NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
496151 | 2ktc | 16693 | cing | 4-filtered-FRED | STAR | entry | full | 300 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2ktc # This FRED archive file contains, for PDB entry <2ktc>: # # - 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, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. 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.PDB_coordinate_file_version . _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_2ktc _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2ktc _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3596.23 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 $Potassium_channel_toxin_alpha_KTx_9_4 A . 1 1 stop_ save_ save_Potassium_channel_toxin_alpha_KTx_9_4 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Potassium channel toxin alpha KTx 9 4" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GSVGCAECPMHCKGKMAKPTCENEVCKCNIGKKD _Entity.Number_of_monomers 34 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 SER . 1 1 3 VAL . 1 1 4 GLY . 1 1 5 CYS . 1 1 6 ALA . 1 1 7 GLU . 1 1 8 CYS . 1 1 9 PRO . 1 1 10 MET . 1 1 11 HIS . 1 1 12 CYS . 1 1 13 LYS . 1 1 14 GLY . 1 1 15 LYS . 1 1 16 MET . 1 1 17 ALA . 1 1 18 LYS . 1 1 19 PRO . 1 1 20 THR . 1 1 21 CYS . 1 1 22 GLU . 1 1 23 ASN . 1 1 24 GLU . 1 1 25 VAL . 1 1 26 CYS . 1 1 27 LYS . 1 1 28 CYS . 1 1 29 ASN . 1 1 30 ILE . 1 1 31 GLY . 1 1 32 LYS . 1 1 33 LYS . 1 1 34 ASP . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 SER 2 2 1 1 VAL 3 3 1 1 GLY 4 4 1 1 CYS 5 5 1 1 ALA 6 6 1 1 GLU 7 7 1 1 CYS 8 8 1 1 PRO 9 9 1 1 MET 10 10 1 1 HIS 11 11 1 1 CYS 12 12 1 1 LYS 13 13 1 1 GLY 14 14 1 1 LYS 15 15 1 1 MET 16 16 1 1 ALA 17 17 1 1 LYS 18 18 1 1 PRO 19 19 1 1 THR 20 20 1 1 CYS 21 21 1 1 GLU 22 22 1 1 ASN 23 23 1 1 GLU 24 24 1 1 VAL 25 25 1 1 CYS 26 26 1 1 LYS 27 27 1 1 CYS 28 28 1 1 ASN 29 29 1 1 ILE 30 30 1 1 GLY 31 31 1 1 LYS 32 32 1 1 LYS 33 33 1 1 ASP 34 34 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 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 2 SER H . 2 . HN 1 1 1 1 2 1 1 2 SER HB2 . 2 . HB2 1 1 2 1 1 1 1 2 SER HA . 2 . HA 1 1 2 1 2 1 1 2 SER HB3 . 2 . HB1 1 1 3 1 1 1 1 2 SER HA . 2 . HA 1 1 3 1 2 1 1 3 VAL H . 3 . HN 1 1 4 1 1 1 1 2 SER HB3 . 2 . HB1 1 1 4 1 2 1 1 3 VAL H . 3 . HN 1 1 5 1 1 1 1 2 SER HA . 2 . HA 1 1 5 1 2 1 1 3 VAL QG . 3 . HG# 1 1 6 1 1 1 1 2 SER HB3 . 2 . HB1 1 1 6 1 2 1 1 3 VAL HA . 3 . HA 1 1 7 1 1 1 1 3 VAL H . 3 . HN 1 1 7 1 2 1 1 3 VAL HA . 3 . HA 1 1 8 1 1 1 1 3 VAL H . 3 . HN 1 1 8 1 2 1 1 3 VAL HB . 3 . HB 1 1 9 1 1 1 1 3 VAL H . 3 . HN 1 1 9 1 2 1 1 3 VAL QG . 3 . HG# 1 1 10 1 1 1 1 3 VAL HA . 3 . HA 1 1 10 1 2 1 1 3 VAL HB . 3 . HB 1 1 11 1 1 1 1 3 VAL HA . 3 . HA 1 1 11 1 2 1 1 3 VAL QG . 3 . HG# 1 1 12 1 1 1 1 3 VAL HB . 3 . HB 1 1 12 1 2 1 1 4 GLY H . 4 . HN 1 1 13 1 1 1 1 3 VAL QG . 3 . HG# 1 1 13 1 2 1 1 4 GLY H . 4 . HN 1 1 14 1 1 1 1 4 GLY H . 4 . HN 1 1 14 1 2 1 1 4 GLY QA . 4 . HA# 1 1 15 1 1 1 1 4 GLY QA . 4 . HA# 1 1 15 1 2 1 1 5 CYS H . 5 . HN 1 1 16 1 1 1 1 4 GLY H . 4 . HN 1 1 16 1 2 1 1 5 CYS H . 5 . HN 1 1 17 1 1 1 1 4 GLY H . 4 . HN 1 1 17 1 2 1 1 7 GLU H . 7 . HN 1 1 18 1 1 1 1 4 GLY QA . 4 . HA# 1 1 18 1 2 1 1 5 CYS HA . 5 . HA 1 1 19 1 1 1 1 4 GLY QA . 4 . HA# 1 1 19 1 2 1 1 8 CYS QB . 8 . HB# 1 1 20 1 1 1 1 4 GLY QA . 4 . HA# 1 1 20 1 2 1 1 9 PRO HD2 . 9 . HD2 1 1 21 1 1 1 1 5 CYS H . 5 . HN 1 1 21 1 2 1 1 5 CYS HA . 5 . HA 1 1 22 1 1 1 1 5 CYS H . 5 . HN 1 1 22 1 2 1 1 5 CYS HB3 . 5 . HB1 1 1 23 1 1 1 1 5 CYS H . 5 . HN 1 1 23 1 2 1 1 6 ALA MB . 6 . HB# 1 1 24 1 1 1 1 5 CYS H . 5 . HN 1 1 24 1 2 1 1 6 ALA H . 6 . HN 1 1 25 1 1 1 1 5 CYS HA . 5 . HA 1 1 25 1 2 1 1 6 ALA H . 6 . HN 1 1 26 1 1 1 1 5 CYS HB3 . 5 . HB1 1 1 26 1 2 1 1 6 ALA H . 6 . HN 1 1 27 1 1 1 1 5 CYS HB3 . 5 . HB1 1 1 27 1 2 1 1 7 GLU H . 7 . HN 1 1 28 1 1 1 1 5 CYS H . 5 . HN 1 1 28 1 2 1 1 8 CYS H . 8 . HN 1 1 29 1 1 1 1 5 CYS HB3 . 5 . HB1 1 1 29 1 2 1 1 6 ALA HA . 6 . HA 1 1 30 1 1 1 1 5 CYS HA . 5 . HA 1 1 30 1 2 1 1 8 CYS H . 8 . HN 1 1 31 1 1 1 1 5 CYS HA . 5 . HA 1 1 31 1 2 1 1 8 CYS HA . 8 . HA 1 1 32 1 1 1 1 5 CYS HA . 5 . HA 1 1 32 1 2 1 1 8 CYS HB3 . 8 . HB1 1 1 33 1 1 1 1 5 CYS HA . 5 . HA 1 1 33 1 2 1 1 26 CYS HB3 . 26 . HB1 1 1 34 1 1 1 1 6 ALA H . 6 . HN 1 1 34 1 2 1 1 6 ALA HA . 6 . HA 1 1 35 1 1 1 1 6 ALA H . 6 . HN 1 1 35 1 2 1 1 6 ALA MB . 6 . HB# 1 1 36 1 1 1 1 6 ALA H . 6 . HN 1 1 36 1 2 1 1 7 GLU H . 7 . HN 1 1 37 1 1 1 1 6 ALA HA . 6 . HA 1 1 37 1 2 1 1 7 GLU H . 7 . HN 1 1 38 1 1 1 1 6 ALA MB . 6 . HB# 1 1 38 1 2 1 1 7 GLU H . 7 . HN 1 1 39 1 1 1 1 6 ALA MB . 6 . HB# 1 1 39 1 2 1 1 8 CYS H . 8 . HN 1 1 40 1 1 1 1 6 ALA MB . 6 . HB# 1 1 40 1 2 1 1 7 GLU HA . 7 . HA 1 1 41 1 1 1 1 6 ALA HA . 6 . HA 1 1 41 1 2 1 1 9 PRO HB3 . 9 . HB1 1 1 42 1 1 1 1 6 ALA HA . 6 . HA 1 1 42 1 2 1 1 9 PRO HD2 . 9 . HD2 1 1 43 1 1 1 1 7 GLU H . 7 . HN 1 1 43 1 2 1 1 7 GLU HA . 7 . HA 1 1 44 1 1 1 1 7 GLU H . 7 . HN 1 1 44 1 2 1 1 7 GLU HB2 . 7 . HB2 1 1 45 1 1 1 1 7 GLU H . 7 . HN 1 1 45 1 2 1 1 7 GLU QG . 7 . HG# 1 1 46 1 1 1 1 7 GLU HA . 7 . HA 1 1 46 1 2 1 1 7 GLU QB . 7 . HB# 1 1 47 1 1 1 1 7 GLU HA . 7 . HA 1 1 47 1 2 1 1 7 GLU QG . 7 . HG# 1 1 48 1 1 1 1 7 GLU H . 7 . HN 1 1 48 1 2 1 1 8 CYS H . 8 . HN 1 1 49 1 1 1 1 7 GLU H . 7 . HN 1 1 49 1 2 1 1 8 CYS HB3 . 8 . HB1 1 1 50 1 1 1 1 7 GLU HA . 7 . HA 1 1 50 1 2 1 1 8 CYS H . 8 . HN 1 1 51 1 1 1 1 7 GLU HB2 . 7 . HB2 1 1 51 1 2 1 1 8 CYS H . 8 . HN 1 1 52 1 1 1 1 7 GLU HB3 . 7 . HB1 1 1 52 1 2 1 1 8 CYS HA . 8 . HA 1 1 53 1 1 1 1 7 GLU HA . 7 . HA 1 1 53 1 2 1 1 9 PRO QD . 9 . HD# 1 1 54 1 1 1 1 8 CYS H . 8 . HN 1 1 54 1 2 1 1 8 CYS HA . 8 . HA 1 1 55 1 1 1 1 8 CYS H . 8 . HN 1 1 55 1 2 1 1 8 CYS HB3 . 8 . HB1 1 1 56 1 1 1 1 8 CYS H . 8 . HN 1 1 56 1 2 1 1 8 CYS HB2 . 8 . HB2 1 1 57 1 1 1 1 8 CYS HA . 8 . HA 1 1 57 1 2 1 1 8 CYS HB3 . 8 . HB1 1 1 58 1 1 1 1 8 CYS HA . 8 . HA 1 1 58 1 2 1 1 8 CYS HB2 . 8 . HB2 1 1 59 1 1 1 1 8 CYS H . 8 . HN 1 1 59 1 2 1 1 9 PRO QD . 9 . HD# 1 1 60 1 1 1 1 8 CYS HA . 8 . HA 1 1 60 1 2 1 1 11 HIS H . 11 . HN 1 1 61 1 1 1 1 8 CYS HA . 8 . HA 1 1 61 1 2 1 1 9 PRO HD3 . 9 . HD1 1 1 62 1 1 1 1 8 CYS HB3 . 8 . HB1 1 1 62 1 2 1 1 9 PRO HD3 . 9 . HD1 1 1 63 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 63 1 2 1 1 9 PRO QD . 9 . HD# 1 1 64 1 1 1 1 9 PRO HB3 . 9 . HB1 1 1 64 1 2 1 1 9 PRO QD . 9 . HD# 1 1 65 1 1 1 1 9 PRO HB2 . 9 . HB2 1 1 65 1 2 1 1 9 PRO QD . 9 . HD# 1 1 66 1 1 1 1 9 PRO HD2 . 9 . HD2 1 1 66 1 2 1 1 10 MET H . 10 . HN 1 1 67 1 1 1 1 9 PRO HA . 9 . HA 1 1 67 1 2 1 1 10 MET H . 10 . HN 1 1 68 1 1 1 1 9 PRO HB2 . 9 . HB2 1 1 68 1 2 1 1 10 MET H . 10 . HN 1 1 69 1 1 1 1 9 PRO HG3 . 9 . HG1 1 1 69 1 2 1 1 10 MET H . 10 . HN 1 1 70 1 1 1 1 9 PRO HA . 9 . HA 1 1 70 1 2 1 1 11 HIS H . 11 . HN 1 1 71 1 1 1 1 9 PRO HD3 . 9 . HD1 1 1 71 1 2 1 1 11 HIS H . 11 . HN 1 1 72 1 1 1 1 9 PRO HA . 9 . HA 1 1 72 1 2 1 1 19 PRO QB . 19 . HB# 1 1 73 1 1 1 1 10 MET H . 10 . HN 1 1 73 1 2 1 1 10 MET HA . 10 . HA 1 1 74 1 1 1 1 10 MET H . 10 . HN 1 1 74 1 2 1 1 10 MET HB3 . 10 . HB1 1 1 75 1 1 1 1 10 MET H . 10 . HN 1 1 75 1 2 1 1 10 MET QG . 10 . HG# 1 1 76 1 1 1 1 10 MET H . 10 . HN 1 1 76 1 2 1 1 10 MET HB2 . 10 . HB2 1 1 77 1 1 1 1 10 MET HA . 10 . HA 1 1 77 1 2 1 1 10 MET HB3 . 10 . HB1 1 1 78 1 1 1 1 10 MET HA . 10 . HA 1 1 78 1 2 1 1 10 MET HB2 . 10 . HB2 1 1 79 1 1 1 1 10 MET HA . 10 . HA 1 1 79 1 2 1 1 10 MET QG . 10 . HG# 1 1 80 1 1 1 1 10 MET H . 10 . HN 1 1 80 1 2 1 1 11 HIS H . 11 . HN 1 1 81 1 1 1 1 10 MET HA . 10 . HA 1 1 81 1 2 1 1 11 HIS H . 11 . HN 1 1 82 1 1 1 1 10 MET HB3 . 10 . HB1 1 1 82 1 2 1 1 11 HIS H . 11 . HN 1 1 83 1 1 1 1 11 HIS H . 11 . HN 1 1 83 1 2 1 1 11 HIS HA . 11 . HA 1 1 84 1 1 1 1 11 HIS H . 11 . HN 1 1 84 1 2 1 1 11 HIS QB . 11 . HB# 1 1 85 1 1 1 1 11 HIS HA . 11 . HA 1 1 85 1 2 1 1 11 HIS QB . 11 . HB# 1 1 86 1 1 1 1 11 HIS HB3 . 11 . HB1 1 1 86 1 2 1 1 12 CYS H . 12 . HN 1 1 87 1 1 1 1 12 CYS H . 12 . HN 1 1 87 1 2 1 1 12 CYS HA . 12 . HA 1 1 88 1 1 1 1 12 CYS H . 12 . HN 1 1 88 1 2 1 1 12 CYS HB2 . 12 . HB1 1 1 89 1 1 1 1 12 CYS H . 12 . HN 1 1 89 1 2 1 1 12 CYS HB3 . 12 . HB2 1 1 90 1 1 1 1 12 CYS HA . 12 . HA 1 1 90 1 2 1 1 13 LYS H . 13 . HN 1 1 91 1 1 1 1 12 CYS QB . 12 . HB# 1 1 91 1 2 1 1 13 LYS H . 13 . HN 1 1 92 1 1 1 1 12 CYS HB2 . 12 . HB1 1 1 92 1 2 1 1 17 ALA MB . 17 . HB# 1 1 93 1 1 1 1 12 CYS HA . 12 . HA 1 1 93 1 2 1 1 28 CYS HA . 28 . HA 1 1 94 1 1 1 1 12 CYS HB2 . 12 . HB1 1 1 94 1 2 1 1 28 CYS HA . 28 . HA 1 1 95 1 1 1 1 13 LYS H . 13 . HN 1 1 95 1 2 1 1 13 LYS HA . 13 . HA 1 1 96 1 1 1 1 13 LYS H . 13 . HN 1 1 96 1 2 1 1 13 LYS QG . 13 . HG# 1 1 97 1 1 1 1 13 LYS H . 13 . HN 1 1 97 1 2 1 1 13 LYS QB . 13 . HB# 1 1 98 1 1 1 1 13 LYS HA . 13 . HA 1 1 98 1 2 1 1 14 GLY H . 14 . HN 1 1 99 1 1 1 1 13 LYS QB . 13 . HB# 1 1 99 1 2 1 1 14 GLY H . 14 . HN 1 1 100 1 1 1 1 14 GLY QA . 14 . HA# 1 1 100 1 2 1 1 16 MET H . 16 . HN 1 1 101 1 1 1 1 15 LYS H . 15 . HN 1 1 101 1 2 1 1 15 LYS HB3 . 15 . HB1 1 1 102 1 1 1 1 15 LYS HA . 15 . HA 1 1 102 1 2 1 1 15 LYS HB3 . 15 . HB1 1 1 103 1 1 1 1 15 LYS HB3 . 15 . HB1 1 1 103 1 2 1 1 15 LYS QG . 15 . HG# 1 1 104 1 1 1 1 15 LYS HA . 15 . HA 1 1 104 1 2 1 1 16 MET H . 16 . HN 1 1 105 1 1 1 1 16 MET H . 16 . HN 1 1 105 1 2 1 1 16 MET HA . 16 . HA 1 1 106 1 1 1 1 16 MET H . 16 . HN 1 1 106 1 2 1 1 16 MET HB2 . 16 . HB2 1 1 107 1 1 1 1 16 MET H . 16 . HN 1 1 107 1 2 1 1 16 MET QG . 16 . HG# 1 1 108 1 1 1 1 16 MET H . 16 . HN 1 1 108 1 2 1 1 16 MET HB3 . 16 . HB1 1 1 109 1 1 1 1 16 MET H . 16 . HN 1 1 109 1 2 1 1 17 ALA H . 17 . HN 1 1 110 1 1 1 1 16 MET HA . 16 . HA 1 1 110 1 2 1 1 17 ALA H . 17 . HN 1 1 111 1 1 1 1 16 MET HA . 16 . HA 1 1 111 1 2 1 1 18 LYS H . 18 . HN 1 1 112 1 1 1 1 17 ALA H . 17 . HN 1 1 112 1 2 1 1 17 ALA MB . 17 . HB# 1 1 113 1 1 1 1 17 ALA H . 17 . HN 1 1 113 1 2 1 1 17 ALA HA . 17 . HA 1 1 114 1 1 1 1 17 ALA H . 17 . HN 1 1 114 1 2 1 1 18 LYS H . 18 . HN 1 1 115 1 1 1 1 17 ALA HA . 17 . HA 1 1 115 1 2 1 1 18 LYS H . 18 . HN 1 1 116 1 1 1 1 17 ALA MB . 17 . HB# 1 1 116 1 2 1 1 18 LYS H . 18 . HN 1 1 117 1 1 1 1 17 ALA HA . 17 . HA 1 1 117 1 2 1 1 30 ILE MD . 30 . HD1# 1 1 118 1 1 1 1 18 LYS H . 18 . HN 1 1 118 1 2 1 1 18 LYS HA . 18 . HA 1 1 119 1 1 1 1 18 LYS H . 18 . HN 1 1 119 1 2 1 1 18 LYS QB . 18 . HB# 1 1 120 1 1 1 1 18 LYS HA . 18 . HA 1 1 120 1 2 1 1 18 LYS QG . 18 . HG# 1 1 121 1 1 1 1 18 LYS H . 18 . HN 1 1 121 1 2 1 1 19 PRO HD3 . 19 . HD1 1 1 122 1 1 1 1 18 LYS HA . 18 . HA 1 1 122 1 2 1 1 19 PRO HD3 . 19 . HD1 1 1 123 1 1 1 1 19 PRO HA . 19 . HA 1 1 123 1 2 1 1 19 PRO HB3 . 19 . HB1 1 1 124 1 1 1 1 19 PRO HA . 19 . HA 1 1 124 1 2 1 1 19 PRO QG . 19 . HG# 1 1 125 1 1 1 1 19 PRO HA . 19 . HA 1 1 125 1 2 1 1 19 PRO QD . 19 . HD# 1 1 126 1 1 1 1 19 PRO QB . 19 . HB# 1 1 126 1 2 1 1 19 PRO HD3 . 19 . HD1 1 1 127 1 1 1 1 19 PRO HD3 . 19 . HD1 1 1 127 1 2 1 1 19 PRO QG . 19 . HG# 1 1 128 1 1 1 1 19 PRO HG3 . 19 . HG1 1 1 128 1 2 1 1 20 THR H . 20 . HN 1 1 129 1 1 1 1 19 PRO HA . 19 . HA 1 1 129 1 2 1 1 20 THR H . 20 . HN 1 1 130 1 1 1 1 19 PRO QB . 19 . HB# 1 1 130 1 2 1 1 20 THR H . 20 . HN 1 1 131 1 1 1 1 19 PRO HA . 19 . HA 1 1 131 1 2 1 1 33 LYS HA . 33 . HA 1 1 132 1 1 1 1 19 PRO HG3 . 19 . HG1 1 1 132 1 2 1 1 34 ASP QB . 34 . HB# 1 1 133 1 1 1 1 20 THR H . 20 . HN 1 1 133 1 2 1 1 20 THR HA . 20 . HA 1 1 134 1 1 1 1 20 THR H . 20 . HN 1 1 134 1 2 1 1 20 THR HB . 20 . HB 1 1 135 1 1 1 1 20 THR H . 20 . HN 1 1 135 1 2 1 1 20 THR HG1 . 20 . HG1 1 1 136 1 1 1 1 20 THR HA . 20 . HA 1 1 136 1 2 1 1 20 THR HB . 20 . HB 1 1 137 1 1 1 1 20 THR HA . 20 . HA 1 1 137 1 2 1 1 20 THR HG1 . 20 . HG1 1 1 138 1 1 1 1 20 THR HB . 20 . HB 1 1 138 1 2 1 1 20 THR HG1 . 20 . HG1 1 1 139 1 1 1 1 20 THR HA . 20 . HA 1 1 139 1 2 1 1 21 CYS H . 21 . HN 1 1 140 1 1 1 1 20 THR HB . 20 . HB 1 1 140 1 2 1 1 21 CYS H . 21 . HN 1 1 141 1 1 1 1 20 THR HG1 . 20 . HG1 1 1 141 1 2 1 1 21 CYS H . 21 . HN 1 1 142 1 1 1 1 20 THR HA . 20 . HA 1 1 142 1 2 1 1 21 CYS HB2 . 21 . HB2 1 1 143 1 1 1 1 20 THR HB . 20 . HB 1 1 143 1 2 1 1 29 ASN HA . 29 . HA 1 1 144 1 1 1 1 20 THR HB . 20 . HB 1 1 144 1 2 1 1 33 LYS HA . 33 . HA 1 1 145 1 1 1 1 21 CYS H . 21 . HN 1 1 145 1 2 1 1 21 CYS HA . 21 . HA 1 1 146 1 1 1 1 21 CYS H . 21 . HN 1 1 146 1 2 1 1 21 CYS HB3 . 21 . HB1 1 1 147 1 1 1 1 21 CYS H . 21 . HN 1 1 147 1 2 1 1 21 CYS HB2 . 21 . HB2 1 1 148 1 1 1 1 21 CYS HA . 21 . HA 1 1 148 1 2 1 1 21 CYS HB3 . 21 . HB1 1 1 149 1 1 1 1 21 CYS HA . 21 . HA 1 1 149 1 2 1 1 21 CYS HB2 . 21 . HB2 1 1 150 1 1 1 1 21 CYS HA . 21 . HA 1 1 150 1 2 1 1 22 GLU H . 22 . HN 1 1 151 1 1 1 1 21 CYS HA . 21 . HA 1 1 151 1 2 1 1 25 VAL H . 25 . HN 1 1 152 1 1 1 1 21 CYS HA . 21 . HA 1 1 152 1 2 1 1 27 LYS H . 27 . HN 1 1 153 1 1 1 1 21 CYS HA . 21 . HA 1 1 153 1 2 1 1 26 CYS HA . 26 . HA 1 1 154 1 1 1 1 22 GLU H . 22 . HN 1 1 154 1 2 1 1 22 GLU HA . 22 . HA 1 1 155 1 1 1 1 22 GLU H . 22 . HN 1 1 155 1 2 1 1 22 GLU HB3 . 22 . HB1 1 1 156 1 1 1 1 22 GLU H . 22 . HN 1 1 156 1 2 1 1 22 GLU QG . 22 . HG# 1 1 157 1 1 1 1 22 GLU H . 22 . HN 1 1 157 1 2 1 1 22 GLU HB2 . 22 . HB2 1 1 158 1 1 1 1 22 GLU HA . 22 . HA 1 1 158 1 2 1 1 22 GLU HB2 . 22 . HB2 1 1 159 1 1 1 1 22 GLU HA . 22 . HA 1 1 159 1 2 1 1 22 GLU QG . 22 . HG# 1 1 160 1 1 1 1 22 GLU HA . 22 . HA 1 1 160 1 2 1 1 23 ASN H . 23 . HN 1 1 161 1 1 1 1 22 GLU H . 22 . HN 1 1 161 1 2 1 1 23 ASN H . 23 . HN 1 1 162 1 1 1 1 22 GLU HA . 22 . HA 1 1 162 1 2 1 1 24 GLU H . 24 . HN 1 1 163 1 1 1 1 22 GLU H . 22 . HN 1 1 163 1 2 1 1 24 GLU H . 24 . HN 1 1 164 1 1 1 1 22 GLU H . 22 . HN 1 1 164 1 2 1 1 25 VAL H . 25 . HN 1 1 165 1 1 1 1 22 GLU H . 22 . HN 1 1 165 1 2 1 1 25 VAL MG1 . 25 . HG1# 1 1 166 1 1 1 1 22 GLU H . 22 . HN 1 1 166 1 2 1 1 26 CYS HA . 26 . HA 1 1 167 1 1 1 1 23 ASN H . 23 . HN 1 1 167 1 2 1 1 23 ASN HA . 23 . HA 1 1 168 1 1 1 1 23 ASN H . 23 . HN 1 1 168 1 2 1 1 23 ASN HB2 . 23 . HB2 1 1 169 1 1 1 1 23 ASN H . 23 . HN 1 1 169 1 2 1 1 23 ASN HB3 . 23 . HB1 1 1 170 1 1 1 1 23 ASN H . 23 . HN 1 1 170 1 2 1 1 24 GLU H . 24 . HN 1 1 171 1 1 1 1 23 ASN HA . 23 . HA 1 1 171 1 2 1 1 24 GLU H . 24 . HN 1 1 172 1 1 1 1 23 ASN HA . 23 . HA 1 1 172 1 2 1 1 25 VAL H . 25 . HN 1 1 173 1 1 1 1 23 ASN HB3 . 23 . HB1 1 1 173 1 2 1 1 24 GLU H . 24 . HN 1 1 174 1 1 1 1 23 ASN HB3 . 23 . HB1 1 1 174 1 2 1 1 24 GLU HA . 24 . HA 1 1 175 1 1 1 1 23 ASN HB2 . 23 . HB2 1 1 175 1 2 1 1 24 GLU H . 24 . HN 1 1 176 1 1 1 1 24 GLU H . 24 . HN 1 1 176 1 2 1 1 24 GLU HA . 24 . HA 1 1 177 1 1 1 1 24 GLU H . 24 . HN 1 1 177 1 2 1 1 24 GLU QB . 24 . HB# 1 1 178 1 1 1 1 24 GLU HA . 24 . HA 1 1 178 1 2 1 1 25 VAL H . 25 . HN 1 1 179 1 1 1 1 25 VAL H . 25 . HN 1 1 179 1 2 1 1 25 VAL HA . 25 . HA 1 1 180 1 1 1 1 25 VAL H . 25 . HN 1 1 180 1 2 1 1 25 VAL HB . 25 . HB 1 1 181 1 1 1 1 25 VAL HA . 25 . HA 1 1 181 1 2 1 1 25 VAL HB . 25 . HB 1 1 182 1 1 1 1 25 VAL HA . 25 . HA 1 1 182 1 2 1 1 25 VAL QG . 25 . HG# 1 1 183 1 1 1 1 25 VAL HA . 25 . HA 1 1 183 1 2 1 1 26 CYS H . 26 . HN 1 1 184 1 1 1 1 25 VAL HA . 25 . HA 1 1 184 1 2 1 1 26 CYS HB3 . 26 . HB1 1 1 185 1 1 1 1 26 CYS H . 26 . HN 1 1 185 1 2 1 1 26 CYS HA . 26 . HA 1 1 186 1 1 1 1 26 CYS H . 26 . HN 1 1 186 1 2 1 1 26 CYS HB3 . 26 . HB1 1 1 187 1 1 1 1 26 CYS H . 26 . HN 1 1 187 1 2 1 1 26 CYS HB2 . 26 . HB2 1 1 188 1 1 1 1 26 CYS HA . 26 . HA 1 1 188 1 2 1 1 26 CYS HB3 . 26 . HB1 1 1 189 1 1 1 1 26 CYS HA . 26 . HA 1 1 189 1 2 1 1 26 CYS HB2 . 26 . HB2 1 1 190 1 1 1 1 26 CYS HA . 26 . HA 1 1 190 1 2 1 1 27 LYS H . 27 . HN 1 1 191 1 1 1 1 26 CYS QB . 26 . HB# 1 1 191 1 2 1 1 27 LYS H . 27 . HN 1 1 192 1 1 1 1 27 LYS H . 27 . HN 1 1 192 1 2 1 1 27 LYS HA . 27 . HA 1 1 193 1 1 1 1 27 LYS H . 27 . HN 1 1 193 1 2 1 1 27 LYS QB . 27 . HB# 1 1 194 1 1 1 1 27 LYS H . 27 . HN 1 1 194 1 2 1 1 27 LYS QG . 27 . HG# 1 1 195 1 1 1 1 27 LYS H . 27 . HN 1 1 195 1 2 1 1 27 LYS HB3 . 27 . HB1 1 1 196 1 1 1 1 27 LYS HA . 27 . HA 1 1 196 1 2 1 1 27 LYS HB2 . 27 . HB2 1 1 197 1 1 1 1 27 LYS HA . 27 . HA 1 1 197 1 2 1 1 27 LYS QG . 27 . HG# 1 1 198 1 1 1 1 27 LYS HB3 . 27 . HB1 1 1 198 1 2 1 1 27 LYS QG . 27 . HG# 1 1 199 1 1 1 1 27 LYS HA . 27 . HA 1 1 199 1 2 1 1 28 CYS H . 28 . HN 1 1 200 1 1 1 1 27 LYS QB . 27 . HB# 1 1 200 1 2 1 1 29 ASN QB . 29 . HB# 1 1 201 1 1 1 1 28 CYS H . 28 . HN 1 1 201 1 2 1 1 28 CYS HA . 28 . HA 1 1 202 1 1 1 1 28 CYS HA . 28 . HA 1 1 202 1 2 1 1 29 ASN H . 29 . HN 1 1 203 1 1 1 1 29 ASN H . 29 . HN 1 1 203 1 2 1 1 29 ASN QB . 29 . HB# 1 1 204 1 1 1 1 29 ASN HA . 29 . HA 1 1 204 1 2 1 1 30 ILE H . 30 . HN 1 1 205 1 1 1 1 29 ASN HB3 . 29 . HB1 1 1 205 1 2 1 1 30 ILE H . 30 . HN 1 1 206 1 1 1 1 30 ILE H . 30 . HN 1 1 206 1 2 1 1 30 ILE HA . 30 . HA 1 1 207 1 1 1 1 30 ILE H . 30 . HN 1 1 207 1 2 1 1 30 ILE HB . 30 . HB 1 1 208 1 1 1 1 30 ILE H . 30 . HN 1 1 208 1 2 1 1 30 ILE QG . 30 . HG1# 1 1 209 1 1 1 1 30 ILE H . 30 . HN 1 1 209 1 2 1 1 30 ILE MD . 30 . HD1# 1 1 210 1 1 1 1 30 ILE HA . 30 . HA 1 1 210 1 2 1 1 30 ILE HB . 30 . HB 1 1 211 1 1 1 1 30 ILE HA . 30 . HA 1 1 211 1 2 1 1 31 GLY H . 31 . HN 1 1 212 1 1 1 1 31 GLY H . 31 . HN 1 1 212 1 2 1 1 31 GLY HA3 . 31 . HA1 1 1 213 1 1 1 1 31 GLY H . 31 . HN 1 1 213 1 2 1 1 31 GLY HA2 . 31 . HA2 1 1 214 1 1 1 1 31 GLY H . 31 . HN 1 1 214 1 2 1 1 32 LYS H . 32 . HN 1 1 215 1 1 1 1 31 GLY HA3 . 31 . HA1 1 1 215 1 2 1 1 32 LYS H . 32 . HN 1 1 216 1 1 1 1 31 GLY HA2 . 31 . HA2 1 1 216 1 2 1 1 32 LYS H . 32 . HN 1 1 217 1 1 1 1 32 LYS H . 32 . HN 1 1 217 1 2 1 1 32 LYS HA . 32 . HA 1 1 218 1 1 1 1 32 LYS H . 32 . HN 1 1 218 1 2 1 1 32 LYS HB2 . 32 . HB2 1 1 219 1 1 1 1 33 LYS H . 33 . HN 1 1 219 1 2 1 1 33 LYS HA . 33 . HA 1 1 220 1 1 1 1 33 LYS H . 33 . HN 1 1 220 1 2 1 1 33 LYS QB . 33 . HB# 1 1 221 1 1 1 1 33 LYS HA . 33 . HA 1 1 221 1 2 1 1 33 LYS QG . 33 . HG# 1 1 222 1 1 1 1 34 ASP HA . 34 . HA 1 1 222 1 2 1 1 34 ASP QB . 34 . HB# 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 . . . . . 3.0 1.8 3.5 1 1 2 1 . . . . . 3.0 1.8 3.5 1 1 3 1 . . . . . 2.5 1.8 3.0 1 1 4 1 . . . . . 3.0 1.8 3.7 1 1 5 1 . . . . . 4.0 2.3 5.0 1 1 6 1 . . . . . 4.0 2.3 5.0 1 1 7 1 . . . . . 3.0 1.8 3.5 1 1 8 1 . . . . . 3.0 1.8 3.5 1 1 9 1 . . . . . 4.0 2.3 5.0 1 1 10 1 . . . . . 3.0 1.8 3.5 1 1 11 1 . . . . . 4.0 2.3 5.0 1 1 12 1 . . . . . 3.0 1.8 3.5 1 1 13 1 . . . . . 4.0 2.3 5.0 1 1 14 1 . . . . . 2.5 1.8 2.7 1 1 15 1 . . . . . 3.0 1.8 3.5 1 1 16 1 . . . . . 3.0 1.8 3.5 1 1 17 1 . . . . . 4.0 2.3 5.0 1 1 18 1 . . . . . 4.0 2.3 5.0 1 1 19 1 . . . . . 4.0 2.3 5.2 1 1 20 1 . . . . . 4.5 3.0 6.0 1 1 21 1 . . . . . 2.5 1.8 2.7 1 1 22 1 . . . . . 3.0 1.8 3.5 1 1 23 1 . . . . . 4.0 2.3 5.5 1 1 24 1 . . . . . 3.0 1.8 3.5 1 1 25 1 . . . . . 4.0 2.3 5.0 1 1 26 1 . . . . . 3.0 1.8 4.0 1 1 27 1 . . . . . 4.5 3.0 6.0 1 1 28 1 . . . . . 4.0 2.3 5.0 1 1 29 1 . . . . . 4.0 2.3 5.2 1 1 30 1 . . . . . 4.0 2.3 5.2 1 1 31 1 . . . . . 4.0 2.3 5.0 1 1 32 1 . . . . . 3.0 1.8 3.5 1 1 33 1 . . . . . 4.0 2.3 5.0 1 1 34 1 . . . . . 2.5 1.8 3.0 1 1 35 1 . . . . . 4.0 2.3 5.0 1 1 36 1 . . . . . 3.0 1.8 3.5 1 1 37 1 . . . . . 3.0 1.8 3.5 1 1 38 1 . . . . . 3.0 1.8 3.5 1 1 39 1 . . . . . 4.0 2.3 5.5 1 1 40 1 . . . . . 4.0 2.3 5.0 1 1 41 1 . . . . . 4.5 3.0 6.0 1 1 42 1 . . . . . 4.0 2.3 5.0 1 1 43 1 . . . . . 3.0 1.8 3.5 1 1 44 1 . . . . . 2.5 1.8 2.7 1 1 45 1 . . . . . 3.0 1.8 3.5 1 1 46 1 . . . . . 2.5 1.8 2.7 1 1 47 1 . . . . . 2.5 1.8 2.9 1 1 48 1 . . . . . 3.0 1.8 3.5 1 1 49 1 . . . . . 4.5 3.0 6.0 1 1 50 1 . . . . . 3.0 1.8 3.5 1 1 51 1 . . . . . 3.0 1.8 3.5 1 1 52 1 . . . . . 4.5 3.0 6.0 1 1 53 1 . . . . . 4.0 2.3 5.0 1 1 54 1 . . . . . 2.5 1.8 2.7 1 1 55 1 . . . . . 3.0 1.8 3.5 1 1 56 1 . . . . . 2.5 1.8 2.7 1 1 57 1 . . . . . 2.5 1.8 3.0 1 1 58 1 . . . . . 3.0 1.8 3.5 1 1 59 1 . . . . . 3.0 1.8 3.5 1 1 60 1 . . . . . 4.0 2.3 5.0 1 1 61 1 . . . . . 4.0 2.3 5.0 1 1 62 1 . . . . . 2.5 1.8 2.7 1 1 63 1 . . . . . 3.0 1.8 3.5 1 1 64 1 . . . . . 3.0 1.8 3.5 1 1 65 1 . . . . . 4.0 2.3 5.0 1 1 66 1 . . . . . 4.0 2.3 5.0 1 1 67 1 . . . . . 4.0 2.3 5.0 1 1 68 1 . . . . . 4.0 2.3 5.0 1 1 69 1 . . . . . 4.0 2.3 5.0 1 1 70 1 . . . . . 4.0 2.3 5.0 1 1 71 1 . . . . . 4.0 2.3 5.4 1 1 72 1 . . . . . 4.5 3.0 6.0 1 1 73 1 . . . . . 3.0 1.8 3.5 1 1 74 1 . . . . . 3.0 1.8 3.5 1 1 75 1 . . . . . 4.0 2.3 5.0 1 1 76 1 . . . . . 2.5 1.8 2.7 1 1 77 1 . . . . . 3.0 1.8 3.5 1 1 78 1 . . . . . 3.0 1.8 3.5 1 1 79 1 . . . . . 4.0 2.3 5.0 1 1 80 1 . . . . . 2.5 1.8 2.7 1 1 81 1 . . . . . 3.0 1.8 3.5 1 1 82 1 . . . . . 4.0 2.3 5.0 1 1 83 1 . . . . . 3.0 1.8 3.5 1 1 84 1 . . . . . 2.5 1.8 2.7 1 1 85 1 . . . . . 4.0 2.3 5.0 1 1 86 1 . . . . . 4.0 2.3 5.0 1 1 87 1 . . . . . 3.0 1.8 3.5 1 1 88 1 . . . . . 4.0 2.3 5.0 1 1 89 1 . . . . . 3.0 1.8 3.5 1 1 90 1 . . . . . 2.5 1.8 3.0 1 1 91 1 . . . . . 3.0 1.8 3.7 1 1 92 1 . . . . . 4.5 3.0 6.0 1 1 93 1 . . . . . 4.5 3.0 6.0 1 1 94 1 . . . . . 4.5 3.0 6.5 1 1 95 1 . . . . . 3.0 1.8 3.5 1 1 96 1 . . . . . 4.0 2.3 5.0 1 1 97 1 . . . . . 3.0 1.8 3.5 1 1 98 1 . . . . . 2.5 1.8 2.7 1 1 99 1 . . . . . 3.0 1.8 3.7 1 1 100 1 . . . . . 4.0 2.3 5.0 1 1 101 1 . . . . . 4.0 2.3 5.0 1 1 102 1 . . . . . 4.0 2.3 5.0 1 1 103 1 . . . . . 2.5 1.8 2.7 1 1 104 1 . . . . . 4.0 2.3 5.0 1 1 105 1 . . . . . 2.5 1.8 2.9 1 1 106 1 . . . . . 3.0 1.8 3.5 1 1 107 1 . . . . . 3.0 1.8 3.7 1 1 108 1 . . . . . 4.0 2.3 5.0 1 1 109 1 . . . . . 4.0 2.3 5.0 1 1 110 1 . . . . . 2.5 1.8 3.2 1 1 111 1 . . . . . 4.5 3.0 6.1 1 1 112 1 . . . . . 3.0 1.8 3.5 1 1 113 1 . . . . . 3.0 1.8 3.5 1 1 114 1 . . . . . 4.0 2.3 5.0 1 1 115 1 . . . . . 3.0 1.8 3.6 1 1 116 1 . . . . . 3.0 1.8 3.7 1 1 117 1 . . . . . 4.5 3.0 6.2 1 1 118 1 . . . . . 3.0 1.8 3.5 1 1 119 1 . . . . . 3.0 1.8 3.7 1 1 120 1 . . . . . 3.0 1.8 3.7 1 1 121 1 . . . . . 4.0 2.3 5.0 1 1 122 1 . . . . . 2.5 1.8 2.7 1 1 123 1 . . . . . 2.5 1.8 2.7 1 1 124 1 . . . . . 3.0 1.8 4.0 1 1 125 1 . . . . . 4.0 2.3 5.0 1 1 126 1 . . . . . 4.0 2.3 5.0 1 1 127 1 . . . . . 2.5 1.8 2.7 1 1 128 1 . . . . . 4.5 3.0 6.0 1 1 129 1 . . . . . 2.5 1.8 2.7 1 1 130 1 . . . . . 4.0 2.3 5.0 1 1 131 1 . . . . . 4.5 3.0 6.5 1 1 132 1 . . . . . 4.5 3.0 6.0 1 1 133 1 . . . . . 3.0 1.8 3.5 1 1 134 1 . . . . . 4.0 2.3 5.0 1 1 135 1 . . . . . 3.0 1.8 3.5 1 1 136 1 . . . . . 2.5 1.8 3.0 1 1 137 1 . . . . . 3.0 1.8 3.5 1 1 138 1 . . . . . 2.5 1.8 2.9 1 1 139 1 . . . . . 2.5 1.8 2.7 1 1 140 1 . . . . . 3.0 1.8 3.5 1 1 141 1 . . . . . 4.0 2.3 5.0 1 1 142 1 . . . . . 4.5 3.0 6.0 1 1 143 1 . . . . . 4.5 3.0 6.5 1 1 144 1 . . . . . 4.5 3.0 6.0 1 1 145 1 . . . . . 3.0 1.8 3.5 1 1 146 1 . . . . . 3.0 1.8 3.7 1 1 147 1 . . . . . 4.0 2.3 5.2 1 1 148 1 . . . . . 3.0 1.8 3.5 1 1 149 1 . . . . . 2.5 1.8 2.9 1 1 150 1 . . . . . 3.0 1.8 3.5 1 1 151 1 . . . . . 4.0 2.3 5.2 1 1 152 1 . . . . . 3.0 1.8 3.6 1 1 153 1 . . . . . 3.0 1.8 3.5 1 1 154 1 . . . . . 3.0 1.8 3.5 1 1 155 1 . . . . . 3.0 1.8 3.5 1 1 156 1 . . . . . 3.0 1.8 3.5 1 1 157 1 . . . . . 4.0 2.3 5.0 1 1 158 1 . . . . . 3.0 1.8 3.5 1 1 159 1 . . . . . 4.0 2.3 5.0 1 1 160 1 . . . . . 3.0 1.8 4.0 1 1 161 1 . . . . . 3.0 1.8 3.7 1 1 162 1 . . . . . 4.0 2.3 5.0 1 1 163 1 . . . . . 4.0 2.3 5.0 1 1 164 1 . . . . . 3.0 1.8 3.5 1 1 165 1 . . . . . 4.0 2.3 5.0 1 1 166 1 . . . . . 3.0 1.8 3.6 1 1 167 1 . . . . . 2.5 1.8 2.7 1 1 168 1 . . . . . 4.0 2.3 5.0 1 1 169 1 . . . . . 3.0 1.8 3.5 1 1 170 1 . . . . . 4.0 2.3 5.0 1 1 171 1 . . . . . 3.0 1.8 3.5 1 1 172 1 . . . . . 4.0 2.3 5.0 1 1 173 1 . . . . . 4.0 2.3 5.0 1 1 174 1 . . . . . 4.5 3.0 6.5 1 1 175 1 . . . . . 4.0 2.3 5.0 1 1 176 1 . . . . . 2.5 1.8 2.7 1 1 177 1 . . . . . 3.0 1.8 3.8 1 1 178 1 . . . . . 3.0 1.8 3.5 1 1 179 1 . . . . . 3.0 1.8 3.5 1 1 180 1 . . . . . 3.0 1.8 3.5 1 1 181 1 . . . . . 3.0 1.8 3.5 1 1 182 1 . . . . . 3.0 1.8 3.5 1 1 183 1 . . . . . 3.0 1.8 3.5 1 1 184 1 . . . . . 4.5 3.0 6.0 1 1 185 1 . . . . . 3.0 1.8 3.5 1 1 186 1 . . . . . 2.5 1.8 2.9 1 1 187 1 . . . . . 3.0 1.8 3.5 1 1 188 1 . . . . . 2.5 1.8 3.0 1 1 189 1 . . . . . 3.0 1.8 3.5 1 1 190 1 . . . . . 2.5 1.8 2.7 1 1 191 1 . . . . . 4.0 2.3 5.0 1 1 192 1 . . . . . 3.0 1.8 3.5 1 1 193 1 . . . . . 3.0 1.8 3.5 1 1 194 1 . . . . . 3.0 1.8 3.5 1 1 195 1 . . . . . 4.0 2.3 5.0 1 1 196 1 . . . . . 3.0 1.8 3.5 1 1 197 1 . . . . . 4.0 2.3 5.0 1 1 198 1 . . . . . 2.5 1.8 2.7 1 1 199 1 . . . . . 4.0 2.3 5.0 1 1 200 1 . . . . . 4.0 2.3 5.0 1 1 201 1 . . . . . 2.5 1.8 2.9 1 1 202 1 . . . . . 2.5 1.8 2.7 1 1 203 1 . . . . . 4.0 2.3 5.0 1 1 204 1 . . . . . 2.5 1.8 2.7 1 1 205 1 . . . . . 4.5 3.0 6.0 1 1 206 1 . . . . . 3.0 1.8 3.5 1 1 207 1 . . . . . 3.0 1.8 3.8 1 1 208 1 . . . . . 4.0 2.3 5.0 1 1 209 1 . . . . . 4.0 2.3 5.0 1 1 210 1 . . . . . 4.0 2.3 5.0 1 1 211 1 . . . . . 3.0 1.8 3.5 1 1 212 1 . . . . . 2.5 1.8 2.9 1 1 213 1 . . . . . 3.0 1.8 3.5 1 1 214 1 . . . . . 3.0 1.8 3.5 1 1 215 1 . . . . . 2.5 1.8 3.0 1 1 216 1 . . . . . 3.0 1.8 3.5 1 1 217 1 . . . . . 2.5 1.8 2.9 1 1 218 1 . . . . . 3.0 1.8 3.5 1 1 219 1 . . . . . 3.0 1.8 3.5 1 1 220 1 . . . . . 4.0 2.3 5.0 1 1 221 1 . . . . . 4.0 2.3 5.0 1 1 222 1 . . . . . 2.5 1.8 2.7 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 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 3 VAL O . 3 . O 1 2 1 1 2 1 1 7 GLU H . 7 . HN 1 2 2 1 1 1 1 3 VAL O . 3 . O 1 2 2 1 2 1 1 7 GLU N . 7 . N 1 2 3 1 1 1 1 4 GLY O . 4 . O 1 2 3 1 2 1 1 8 CYS H . 8 . HN 1 2 4 1 1 1 1 4 GLY O . 4 . O 1 2 4 1 2 1 1 8 CYS N . 8 . N 1 2 5 1 1 1 1 6 ALA O . 6 . O 1 2 5 1 2 1 1 10 MET H . 10 . HN 1 2 6 1 1 1 1 6 ALA O . 6 . O 1 2 6 1 2 1 1 10 MET N . 10 . N 1 2 7 1 1 1 1 7 GLU O . 7 . O 1 2 7 1 2 1 1 11 HIS H . 11 . HN 1 2 8 1 1 1 1 7 GLU O . 7 . O 1 2 8 1 2 1 1 11 HIS N . 11 . N 1 2 9 1 1 1 1 13 LYS O . 13 . O 1 2 9 1 2 1 1 16 MET H . 16 . HN 1 2 10 1 1 1 1 13 LYS O . 13 . O 1 2 10 1 2 1 1 16 MET N . 16 . N 1 2 11 1 1 1 1 22 GLU O . 22 . O 1 2 11 1 2 1 1 25 VAL H . 25 . HN 1 2 12 1 1 1 1 22 GLU O . 22 . O 1 2 12 1 2 1 1 25 VAL N . 25 . N 1 2 13 1 1 1 1 20 THR O . 20 . O 1 2 13 1 2 1 1 27 LYS H . 27 . HN 1 2 14 1 1 1 1 20 THR O . 20 . O 1 2 14 1 2 1 1 27 LYS N . 27 . N 1 2 15 1 1 1 1 18 LYS O . 18 . O 1 2 15 1 2 1 1 29 ASN H . 29 . HN 1 2 16 1 1 1 1 18 LYS O . 18 . O 1 2 16 1 2 1 1 29 ASN N . 29 . N 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 1.8 1.5 2.3 1 2 2 1 . . . . . 2.8 2.4 3.3 1 2 3 1 . . . . . 1.8 1.5 2.3 1 2 4 1 . . . . . 2.8 2.4 3.3 1 2 5 1 . . . . . 1.8 1.5 2.3 1 2 6 1 . . . . . 2.8 2.4 3.3 1 2 7 1 . . . . . 1.8 1.5 2.3 1 2 8 1 . . . . . 2.8 2.4 3.3 1 2 9 1 . . . . . 1.8 1.5 2.3 1 2 10 1 . . . . . 2.8 2.4 3.3 1 2 11 1 . . . . . 1.8 1.5 2.3 1 2 12 1 . . . . . 2.8 2.4 3.3 1 2 13 1 . . . . . 1.8 1.5 2.3 1 2 14 1 . . . . . 2.8 2.4 3.3 1 2 15 1 . . . . . 1.8 1.5 2.3 1 2 16 1 . . . . . 2.8 2.4 3.3 1 2 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 2 SER C 1 1 3 VAL N 1 1 3 VAL CA 1 1 3 VAL C -100.0 -20.0 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 2 . 1 1 4 GLY C 1 1 5 CYS N 1 1 5 CYS CA 1 1 5 CYS C -100.0 -20.0 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1 3 . 1 1 5 CYS C 1 1 6 ALA N 1 1 6 ALA CA 1 1 6 ALA C -100.0 -20.0 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 4 . 1 1 6 ALA C 1 1 7 GLU N 1 1 7 GLU CA 1 1 7 GLU C -100.0 -20.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 5 . 1 1 7 GLU C 1 1 8 CYS N 1 1 8 CYS CA 1 1 8 CYS C -100.0 -20.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 6 . 1 1 9 PRO C 1 1 10 MET N 1 1 10 MET CA 1 1 10 MET C -100.0 -20.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 7 . 1 1 10 MET C 1 1 11 HIS N 1 1 11 HIS CA 1 1 11 HIS C -100.0 -20.0 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 8 . 1 1 11 HIS C 1 1 12 CYS N 1 1 12 CYS CA 1 1 12 CYS C -140.0 -100.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 9 . 1 1 12 CYS N 1 1 12 CYS CA 1 1 12 CYS C 1 1 13 LYS N 100.0 140.0 . 12 . N . 12 . CA . 12 . C . 13 . N 1 1 10 . 1 1 12 CYS C 1 1 13 LYS N 1 1 13 LYS CA 1 1 13 LYS C -140.0 -100.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 11 . 1 1 13 LYS N 1 1 13 LYS CA 1 1 13 LYS C 1 1 14 GLY N 100.0 140.0 . 13 . N . 13 . CA . 13 . C . 14 . N 1 1 12 . 1 1 13 LYS C 1 1 14 GLY N 1 1 14 GLY CA 1 1 14 GLY C -80.0 -40.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 13 . 1 1 14 GLY N 1 1 14 GLY CA 1 1 14 GLY C 1 1 15 LYS N 100.0 140.0 . 14 . N . 14 . CA . 14 . C . 15 . N 1 1 14 . 1 1 14 GLY C 1 1 15 LYS N 1 1 15 LYS CA 1 1 15 LYS C 70.0 110.0 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 15 . 1 1 15 LYS N 1 1 15 LYS CA 1 1 15 LYS C 1 1 16 MET N -20.0 20.0 . 15 . N . 15 . CA . 15 . C . 16 . N 1 1 16 . 1 1 15 LYS C 1 1 16 MET N 1 1 16 MET CA 1 1 16 MET C -140.0 -100.0 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 17 . 1 1 16 MET N 1 1 16 MET CA 1 1 16 MET C 1 1 17 ALA N 100.0 140.0 . 16 . N . 16 . CA . 16 . C . 17 . N 1 1 18 . 1 1 16 MET C 1 1 17 ALA N 1 1 17 ALA CA 1 1 17 ALA C -140.0 -100.0 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 19 . 1 1 17 ALA N 1 1 17 ALA CA 1 1 17 ALA C 1 1 18 LYS N 100.0 140.0 . 17 . N . 17 . CA . 17 . C . 18 . N 1 1 20 . 1 1 17 ALA C 1 1 18 LYS N 1 1 18 LYS CA 1 1 18 LYS C -160.0 -80.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 21 . 1 1 18 LYS N 1 1 18 LYS CA 1 1 18 LYS C 1 1 19 PRO N 80.0 160.0 . 18 . N . 18 . CA . 18 . C . 19 . N 1 1 22 . 1 1 19 PRO N 1 1 19 PRO CA 1 1 19 PRO C 1 1 20 THR N 80.0 160.0 . 19 . N . 19 . CA . 19 . C . 20 . N 1 1 23 . 1 1 19 PRO C 1 1 20 THR N 1 1 20 THR CA 1 1 20 THR C -160.0 -80.0 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 24 . 1 1 20 THR N 1 1 20 THR CA 1 1 20 THR C 1 1 21 CYS N 80.0 160.0 . 20 . N . 20 . CA . 20 . C . 21 . N 1 1 25 . 1 1 20 THR C 1 1 21 CYS N 1 1 21 CYS CA 1 1 21 CYS C -160.0 -80.0 . 20 . C . 21 . N . 21 . CA . 21 . C 1 1 26 . 1 1 21 CYS N 1 1 21 CYS CA 1 1 21 CYS C 1 1 22 GLU N 80.0 160.0 . 21 . N . 21 . CA . 21 . C . 22 . N 1 1 27 . 1 1 21 CYS C 1 1 22 GLU N 1 1 22 GLU CA 1 1 22 GLU C -140.0 -100.0 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 28 . 1 1 22 GLU N 1 1 22 GLU CA 1 1 22 GLU C 1 1 23 ASN N 100.0 140.0 . 22 . N . 22 . CA . 22 . C . 23 . N 1 1 29 . 1 1 22 GLU C 1 1 23 ASN N 1 1 23 ASN CA 1 1 23 ASN C 40.0 80.0 . 22 . C . 23 . N . 23 . CA . 23 . C 1 1 30 . 1 1 23 ASN N 1 1 23 ASN CA 1 1 23 ASN C 1 1 24 GLU N 10.0 50.0 . 23 . N . 23 . CA . 23 . C . 24 . N 1 1 31 . 1 1 23 ASN C 1 1 24 GLU N 1 1 24 GLU CA 1 1 24 GLU C 70.0 110.0 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1 32 . 1 1 24 GLU N 1 1 24 GLU CA 1 1 24 GLU C 1 1 25 VAL N -20.0 20.0 . 24 . N . 24 . CA . 24 . C . 25 . N 1 1 33 . 1 1 24 GLU C 1 1 25 VAL N 1 1 25 VAL CA 1 1 25 VAL C -140.0 -100.0 . 24 . C . 25 . N . 25 . CA . 25 . C 1 1 34 . 1 1 25 VAL N 1 1 25 VAL CA 1 1 25 VAL C 1 1 26 CYS N 100.0 140.0 . 25 . N . 25 . CA . 25 . C . 26 . N 1 1 35 . 1 1 25 VAL C 1 1 26 CYS N 1 1 26 CYS CA 1 1 26 CYS C -160.0 -80.0 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1 36 . 1 1 26 CYS N 1 1 26 CYS CA 1 1 26 CYS C 1 1 27 LYS N 80.0 160.0 . 26 . N . 26 . CA . 26 . C . 27 . N 1 1 37 . 1 1 26 CYS C 1 1 27 LYS N 1 1 27 LYS CA 1 1 27 LYS C -160.0 -80.0 . 26 . C . 27 . N . 27 . CA . 27 . C 1 1 38 . 1 1 27 LYS N 1 1 27 LYS CA 1 1 27 LYS C 1 1 28 CYS N 80.0 160.0 . 27 . N . 27 . CA . 27 . C . 28 . N 1 1 39 . 1 1 27 LYS C 1 1 28 CYS N 1 1 28 CYS CA 1 1 28 CYS C -160.0 -80.0 . 27 . C . 28 . N . 28 . CA . 28 . C 1 1 40 . 1 1 28 CYS N 1 1 28 CYS CA 1 1 28 CYS C 1 1 29 ASN N 80.0 160.0 . 28 . N . 28 . CA . 28 . C . 29 . N 1 1 41 . 1 1 28 CYS C 1 1 29 ASN N 1 1 29 ASN CA 1 1 29 ASN C -140.0 -100.0 . 28 . C . 29 . N . 29 . CA . 29 . C 1 1 42 . 1 1 29 ASN N 1 1 29 ASN CA 1 1 29 ASN C 1 1 30 ILE N 100.0 140.0 . 29 . N . 29 . CA . 29 . C . 30 . N 1 1 43 . 1 1 29 ASN C 1 1 30 ILE N 1 1 30 ILE CA 1 1 30 ILE C -80.0 -40.0 . 29 . C . 30 . N . 30 . CA . 30 . C 1 1 44 . 1 1 30 ILE N 1 1 30 ILE CA 1 1 30 ILE C 1 1 31 GLY N 100.0 140.0 . 30 . N . 30 . CA . 30 . C . 31 . N 1 1 45 . 1 1 30 ILE C 1 1 31 GLY N 1 1 31 GLY CA 1 1 31 GLY C 70.0 110.0 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 46 . 1 1 31 GLY N 1 1 31 GLY CA 1 1 31 GLY C 1 1 32 LYS N -20.0 20.0 . 31 . N . 31 . CA . 31 . C . 32 . N 1 1 47 . 1 1 31 GLY C 1 1 32 LYS N 1 1 32 LYS CA 1 1 32 LYS C -140.0 -100.0 . 31 . C . 32 . N . 32 . CA . 32 . C 1 1 48 . 1 1 32 LYS N 1 1 32 LYS CA 1 1 32 LYS C 1 1 33 LYS N 100.0 140.0 . 32 . N . 32 . CA . 32 . C . 33 . N 1 1 49 . 1 1 32 LYS C 1 1 33 LYS N 1 1 33 LYS CA 1 1 33 LYS C -160.0 -80.0 . 32 . C . 33 . N . 33 . CA . 33 . C 1 1 50 . 1 1 33 LYS N 1 1 33 LYS CA 1 1 33 LYS C 1 1 34 ASP N 80.0 160.0 . 33 . N . 33 . CA . 33 . C . 34 . N 1 1 51 . 1 1 33 LYS C 1 1 34 ASP N 1 1 34 ASP CA 1 1 34 ASP C -160.0 -80.0 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1 52 . 1 1 18 LYS N 1 1 18 LYS CA 1 1 18 LYS CB 1 1 18 LYS CG 20.0 100.0 . 18 . N . 18 . CA . 18 . CB . 18 . CG 1 1 53 . 1 1 22 GLU N 1 1 22 GLU CA 1 1 22 GLU CB 1 1 22 GLU CG 20.0 100.0 . 22 . N . 22 . CA . 22 . CB . 22 . CG 1 1 54 . 1 1 30 ILE N 1 1 30 ILE CA 1 1 30 ILE CB 1 1 30 ILE CG1 20.0 100.0 . 30 . N . 30 . CA . 30 . CB . 30 . CG1 1 1 55 . 1 1 7 GLU N 1 1 7 GLU CA 1 1 7 GLU CB 1 1 7 GLU CG -100.0 -20.0 . 7 . N . 7 . CA . 7 . CB . 7 . CG 1 1 56 . 1 1 10 MET N 1 1 10 MET CA 1 1 10 MET CB 1 1 10 MET CG -100.0 -20.0 . 10 . N . 10 . CA . 10 . CB . 10 . CG 1 1 57 . 1 1 21 CYS N 1 1 21 CYS CA 1 1 21 CYS CB 1 1 21 CYS SG -100.0 -20.0 . 21 . N . 21 . CA . 21 . CB . 21 . SG 1 1 58 . 1 1 24 GLU N 1 1 24 GLU CA 1 1 24 GLU CB 1 1 24 GLU CG -100.0 -20.0 . 24 . N . 24 . CA . 24 . CB . 24 . CG 1 1 59 . 1 1 27 LYS N 1 1 27 LYS CA 1 1 27 LYS CB 1 1 27 LYS CG -100.0 -20.0 . 27 . N . 27 . CA . 27 . CB . 27 . CG 1 1 60 . 1 1 5 CYS CB 1 1 21 CYS SG 1 1 5 CYS SG 1 1 21 CYS CB 70.0 110.0 . 5 . CB . 21 . SG . 5 . SG . 21 . CB 1 1 61 . 1 1 8 CYS CB 1 1 26 CYS SG 1 1 8 CYS SG 1 1 26 CYS CB -110.0 -70.0 . 8 . CB . 26 . SG . 8 . SG . 26 . CB 1 1 62 . 1 1 12 CYS CB 1 1 28 CYS SG 1 1 12 CYS SG 1 1 28 CYS CB 70.0 110.0 . 12 . CB . 28 . SG . 12 . SG . 28 . CB 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C 2.088 12.172 -4.834 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 2.003 13.273 -5.886 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H 1.910 15.182 -5.046 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H 0.683 14.129 -4.497 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H 0.602 14.810 -6.061 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H 1.498 12.896 -6.764 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H 3.002 13.587 -6.152 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N 1.244 14.437 -5.335 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O 2.882 12.260 -3.899 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 SER C C 2.561 9.243 -4.087 1.00 . A A . 2 SER C 1 1 1 11 1 1 2 SER CA C 1.256 10.033 -4.033 1.00 . A A . 2 SER CA 1 1 1 12 1 1 2 SER CB C 0.098 9.084 -4.325 1.00 . A A . 2 SER CB 1 1 1 13 1 1 2 SER H H 0.646 11.123 -5.748 1.00 . A A . 2 SER H 1 1 1 14 1 1 2 SER HA H 1.131 10.433 -3.039 1.00 . A A . 2 SER HA 1 1 1 15 1 1 2 SER HB2 H 0.067 8.861 -5.379 1.00 . A A . 2 SER HB2 1 1 1 16 1 1 2 SER HB3 H 0.254 8.169 -3.771 1.00 . A A . 2 SER HB3 1 1 1 17 1 1 2 SER HG H -1.038 10.665 -4.010 1.00 . A A . 2 SER HG 1 1 1 18 1 1 2 SER N N 1.264 11.140 -4.987 1.00 . A A . 2 SER N 1 1 1 19 1 1 2 SER O O 2.739 8.380 -4.945 1.00 . A A . 2 SER O 1 1 1 20 1 1 2 SER OG O -1.131 9.687 -3.932 1.00 . A A . 2 SER OG 1 1 1 21 1 1 3 VAL C C 4.634 7.667 -2.107 1.00 . A A . 3 VAL C 1 1 1 22 1 1 3 VAL CA C 4.738 8.833 -3.083 1.00 . A A . 3 VAL CA 1 1 1 23 1 1 3 VAL CB C 5.855 9.788 -2.633 1.00 . A A . 3 VAL CB 1 1 1 24 1 1 3 VAL CG1 C 6.566 10.363 -3.859 1.00 . A A . 3 VAL CG1 1 1 1 25 1 1 3 VAL CG2 C 5.266 10.942 -1.813 1.00 . A A . 3 VAL CG2 1 1 1 26 1 1 3 VAL H H 3.240 10.220 -2.493 1.00 . A A . 3 VAL H 1 1 1 27 1 1 3 VAL HA H 4.982 8.444 -4.062 1.00 . A A . 3 VAL HA 1 1 1 28 1 1 3 VAL HB H 6.569 9.243 -2.029 1.00 . A A . 3 VAL HB 1 1 1 29 1 1 3 VAL HG11 H 5.843 10.557 -4.638 1.00 . A A . 3 VAL HG11 1 1 1 30 1 1 3 VAL HG12 H 7.300 9.655 -4.216 1.00 . A A . 3 VAL HG12 1 1 1 31 1 1 3 VAL HG13 H 7.059 11.285 -3.588 1.00 . A A . 3 VAL HG13 1 1 1 32 1 1 3 VAL HG21 H 4.690 11.587 -2.460 1.00 . A A . 3 VAL HG21 1 1 1 33 1 1 3 VAL HG22 H 6.070 11.509 -1.366 1.00 . A A . 3 VAL HG22 1 1 1 34 1 1 3 VAL HG23 H 4.630 10.549 -1.034 1.00 . A A . 3 VAL HG23 1 1 1 35 1 1 3 VAL N N 3.453 9.534 -3.155 1.00 . A A . 3 VAL N 1 1 1 36 1 1 3 VAL O O 5.115 6.561 -2.372 1.00 . A A . 3 VAL O 1 1 1 37 1 1 4 GLY C C 3.437 5.562 -0.625 1.00 . A A . 4 GLY C 1 1 1 38 1 1 4 GLY CA C 3.800 6.885 0.032 1.00 . A A . 4 GLY CA 1 1 1 39 1 1 4 GLY H H 3.612 8.811 -0.824 1.00 . A A . 4 GLY H 1 1 1 40 1 1 4 GLY HA2 H 4.716 6.766 0.594 1.00 . A A . 4 GLY HA2 1 1 1 41 1 1 4 GLY HA3 H 3.006 7.175 0.703 1.00 . A A . 4 GLY HA3 1 1 1 42 1 1 4 GLY N N 3.983 7.919 -0.975 1.00 . A A . 4 GLY N 1 1 1 43 1 1 4 GLY O O 3.952 4.515 -0.250 1.00 . A A . 4 GLY O 1 1 1 44 1 1 5 CYS C C 3.293 3.703 -2.976 1.00 . A A . 5 CYS C 1 1 1 45 1 1 5 CYS CA C 2.116 4.408 -2.312 1.00 . A A . 5 CYS CA 1 1 1 46 1 1 5 CYS CB C 1.020 4.711 -3.333 1.00 . A A . 5 CYS CB 1 1 1 47 1 1 5 CYS H H 2.166 6.480 -1.872 1.00 . A A . 5 CYS H 1 1 1 48 1 1 5 CYS HA H 1.705 3.738 -1.578 1.00 . A A . 5 CYS HA 1 1 1 49 1 1 5 CYS HB2 H 0.897 5.781 -3.432 1.00 . A A . 5 CYS HB2 1 1 1 50 1 1 5 CYS HB3 H 1.280 4.284 -4.291 1.00 . A A . 5 CYS HB3 1 1 1 51 1 1 5 CYS N N 2.542 5.618 -1.615 1.00 . A A . 5 CYS N 1 1 1 52 1 1 5 CYS O O 3.159 2.571 -3.431 1.00 . A A . 5 CYS O 1 1 1 53 1 1 5 CYS SG S -0.520 3.966 -2.733 1.00 . A A . 5 CYS SG 1 1 1 54 1 1 6 ALA C C 6.372 3.034 -2.393 1.00 . A A . 6 ALA C 1 1 1 55 1 1 6 ALA CA C 5.650 3.737 -3.537 1.00 . A A . 6 ALA CA 1 1 1 56 1 1 6 ALA CB C 6.554 4.800 -4.170 1.00 . A A . 6 ALA CB 1 1 1 57 1 1 6 ALA H H 4.512 5.246 -2.574 1.00 . A A . 6 ALA H 1 1 1 58 1 1 6 ALA HA H 5.372 3.007 -4.281 1.00 . A A . 6 ALA HA 1 1 1 59 1 1 6 ALA HB1 H 7.116 5.303 -3.399 1.00 . A A . 6 ALA HB1 1 1 1 60 1 1 6 ALA HB2 H 5.945 5.520 -4.698 1.00 . A A . 6 ALA HB2 1 1 1 61 1 1 6 ALA HB3 H 7.234 4.329 -4.864 1.00 . A A . 6 ALA HB3 1 1 1 62 1 1 6 ALA N N 4.450 4.350 -2.984 1.00 . A A . 6 ALA N 1 1 1 63 1 1 6 ALA O O 6.711 1.846 -2.465 1.00 . A A . 6 ALA O 1 1 1 64 1 1 7 GLU C C 6.245 2.211 0.545 1.00 . A A . 7 GLU C 1 1 1 65 1 1 7 GLU CA C 7.185 3.224 -0.113 1.00 . A A . 7 GLU CA 1 1 1 66 1 1 7 GLU CB C 7.514 4.346 0.877 1.00 . A A . 7 GLU CB 1 1 1 67 1 1 7 GLU CD C 7.827 6.405 -0.531 1.00 . A A . 7 GLU CD 1 1 1 68 1 1 7 GLU CG C 8.537 5.304 0.251 1.00 . A A . 7 GLU CG 1 1 1 69 1 1 7 GLU H H 6.225 4.704 -1.303 1.00 . A A . 7 GLU H 1 1 1 70 1 1 7 GLU HA H 8.097 2.724 -0.396 1.00 . A A . 7 GLU HA 1 1 1 71 1 1 7 GLU HB2 H 6.612 4.889 1.120 1.00 . A A . 7 GLU HB2 1 1 1 72 1 1 7 GLU HB3 H 7.931 3.919 1.777 1.00 . A A . 7 GLU HB3 1 1 1 73 1 1 7 GLU HG2 H 9.131 5.753 1.032 1.00 . A A . 7 GLU HG2 1 1 1 74 1 1 7 GLU HG3 H 9.183 4.755 -0.418 1.00 . A A . 7 GLU HG3 1 1 1 75 1 1 7 GLU N N 6.551 3.774 -1.306 1.00 . A A . 7 GLU N 1 1 1 76 1 1 7 GLU O O 6.673 1.153 0.998 1.00 . A A . 7 GLU O 1 1 1 77 1 1 7 GLU OE1 O 6.993 7.076 0.052 1.00 . A A . 7 GLU OE1 1 1 1 78 1 1 7 GLU OE2 O 8.130 6.561 -1.700 1.00 . A A . 7 GLU OE2 1 1 1 79 1 1 8 CYS C C 4.162 0.224 0.767 1.00 . A A . 8 CYS C 1 1 1 80 1 1 8 CYS CA C 3.930 1.682 1.163 1.00 . A A . 8 CYS CA 1 1 1 81 1 1 8 CYS CB C 2.536 2.131 0.697 1.00 . A A . 8 CYS CB 1 1 1 82 1 1 8 CYS H H 4.686 3.412 0.187 1.00 . A A . 8 CYS H 1 1 1 83 1 1 8 CYS HA H 3.979 1.763 2.237 1.00 . A A . 8 CYS HA 1 1 1 84 1 1 8 CYS HB2 H 2.636 2.775 -0.160 1.00 . A A . 8 CYS HB2 1 1 1 85 1 1 8 CYS HB3 H 1.949 1.268 0.427 1.00 . A A . 8 CYS HB3 1 1 1 86 1 1 8 CYS N N 4.957 2.551 0.577 1.00 . A A . 8 CYS N 1 1 1 87 1 1 8 CYS O O 4.399 -0.627 1.625 1.00 . A A . 8 CYS O 1 1 1 88 1 1 8 CYS SG S 1.696 3.033 2.027 1.00 . A A . 8 CYS SG 1 1 1 89 1 1 9 PRO C C 5.739 -1.942 -0.606 1.00 . A A . 9 PRO C 1 1 1 90 1 1 9 PRO CA C 4.348 -1.469 -1.001 1.00 . A A . 9 PRO CA 1 1 1 91 1 1 9 PRO CB C 4.196 -1.375 -2.524 1.00 . A A . 9 PRO CB 1 1 1 92 1 1 9 PRO CD C 3.845 0.845 -1.615 1.00 . A A . 9 PRO CD 1 1 1 93 1 1 9 PRO CG C 4.299 0.076 -2.855 1.00 . A A . 9 PRO CG 1 1 1 94 1 1 9 PRO HA H 3.602 -2.135 -0.600 1.00 . A A . 9 PRO HA 1 1 1 95 1 1 9 PRO HB2 H 4.985 -1.929 -3.013 1.00 . A A . 9 PRO HB2 1 1 1 96 1 1 9 PRO HB3 H 3.230 -1.752 -2.827 1.00 . A A . 9 PRO HB3 1 1 1 97 1 1 9 PRO HD2 H 4.419 1.753 -1.503 1.00 . A A . 9 PRO HD2 1 1 1 98 1 1 9 PRO HD3 H 2.790 1.063 -1.669 1.00 . A A . 9 PRO HD3 1 1 1 99 1 1 9 PRO HG2 H 5.323 0.326 -3.097 1.00 . A A . 9 PRO HG2 1 1 1 100 1 1 9 PRO HG3 H 3.654 0.314 -3.686 1.00 . A A . 9 PRO HG3 1 1 1 101 1 1 9 PRO N N 4.116 -0.083 -0.511 1.00 . A A . 9 PRO N 1 1 1 102 1 1 9 PRO O O 5.914 -3.067 -0.131 1.00 . A A . 9 PRO O 1 1 1 103 1 1 10 MET C C 8.125 -1.737 1.103 1.00 . A A . 10 MET C 1 1 1 104 1 1 10 MET CA C 8.093 -1.390 -0.385 1.00 . A A . 10 MET CA 1 1 1 105 1 1 10 MET CB C 9.009 -0.194 -0.663 1.00 . A A . 10 MET CB 1 1 1 106 1 1 10 MET CE C 11.658 0.660 -3.330 1.00 . A A . 10 MET CE 1 1 1 107 1 1 10 MET CG C 9.321 -0.116 -2.161 1.00 . A A . 10 MET CG 1 1 1 108 1 1 10 MET H H 6.528 -0.164 -1.130 1.00 . A A . 10 MET H 1 1 1 109 1 1 10 MET HA H 8.431 -2.241 -0.955 1.00 . A A . 10 MET HA 1 1 1 110 1 1 10 MET HB2 H 8.516 0.714 -0.351 1.00 . A A . 10 MET HB2 1 1 1 111 1 1 10 MET HB3 H 9.929 -0.309 -0.113 1.00 . A A . 10 MET HB3 1 1 1 112 1 1 10 MET HE1 H 12.739 0.639 -3.272 1.00 . A A . 10 MET HE1 1 1 1 113 1 1 10 MET HE2 H 11.284 1.567 -2.873 1.00 . A A . 10 MET HE2 1 1 1 114 1 1 10 MET HE3 H 11.356 0.631 -4.365 1.00 . A A . 10 MET HE3 1 1 1 115 1 1 10 MET HG2 H 8.594 -0.694 -2.713 1.00 . A A . 10 MET HG2 1 1 1 116 1 1 10 MET HG3 H 9.279 0.914 -2.486 1.00 . A A . 10 MET HG3 1 1 1 117 1 1 10 MET N N 6.727 -1.059 -0.770 1.00 . A A . 10 MET N 1 1 1 118 1 1 10 MET O O 8.728 -2.728 1.516 1.00 . A A . 10 MET O 1 1 1 119 1 1 10 MET SD S 10.979 -0.778 -2.462 1.00 . A A . 10 MET SD 1 1 1 120 1 1 11 HIS C C 6.282 -2.152 3.680 1.00 . A A . 11 HIS C 1 1 1 121 1 1 11 HIS CA C 7.363 -1.119 3.341 1.00 . A A . 11 HIS CA 1 1 1 122 1 1 11 HIS CB C 7.040 0.214 4.029 1.00 . A A . 11 HIS CB 1 1 1 123 1 1 11 HIS CD2 C 8.697 1.350 5.719 1.00 . A A . 11 HIS CD2 1 1 1 124 1 1 11 HIS CE1 C 8.688 -0.180 7.255 1.00 . A A . 11 HIS CE1 1 1 1 125 1 1 11 HIS CG C 7.859 0.356 5.283 1.00 . A A . 11 HIS CG 1 1 1 126 1 1 11 HIS H H 6.973 -0.151 1.493 1.00 . A A . 11 HIS H 1 1 1 127 1 1 11 HIS HA H 8.316 -1.478 3.701 1.00 . A A . 11 HIS HA 1 1 1 128 1 1 11 HIS HB2 H 7.270 1.028 3.357 1.00 . A A . 11 HIS HB2 1 1 1 129 1 1 11 HIS HB3 H 5.990 0.245 4.282 1.00 . A A . 11 HIS HB3 1 1 1 130 1 1 11 HIS HD2 H 8.917 2.260 5.180 1.00 . A A . 11 HIS HD2 1 1 1 131 1 1 11 HIS HE1 H 8.890 -0.729 8.163 1.00 . A A . 11 HIS HE1 1 1 1 132 1 1 11 HIS HE2 H 9.843 1.533 7.510 1.00 . A A . 11 HIS HE2 1 1 1 133 1 1 11 HIS N N 7.444 -0.916 1.896 1.00 . A A . 11 HIS N 1 1 1 134 1 1 11 HIS ND1 N 7.868 -0.611 6.278 1.00 . A A . 11 HIS ND1 1 1 1 135 1 1 11 HIS NE2 N 9.220 1.011 6.964 1.00 . A A . 11 HIS NE2 1 1 1 136 1 1 11 HIS O O 5.701 -2.133 4.770 1.00 . A A . 11 HIS O 1 1 1 137 1 1 12 CYS C C 5.723 -5.400 3.394 1.00 . A A . 12 CYS C 1 1 1 138 1 1 12 CYS CA C 5.035 -4.116 2.948 1.00 . A A . 12 CYS CA 1 1 1 139 1 1 12 CYS CB C 4.236 -4.362 1.671 1.00 . A A . 12 CYS CB 1 1 1 140 1 1 12 CYS H H 6.538 -3.038 1.905 1.00 . A A . 12 CYS H 1 1 1 141 1 1 12 CYS HA H 4.355 -3.803 3.726 1.00 . A A . 12 CYS HA 1 1 1 142 1 1 12 CYS HB2 H 4.205 -3.457 1.089 1.00 . A A . 12 CYS HB2 1 1 1 143 1 1 12 CYS HB3 H 4.702 -5.148 1.097 1.00 . A A . 12 CYS HB3 1 1 1 144 1 1 12 CYS N N 6.032 -3.065 2.748 1.00 . A A . 12 CYS N 1 1 1 145 1 1 12 CYS O O 6.859 -5.670 3.009 1.00 . A A . 12 CYS O 1 1 1 146 1 1 12 CYS SG S 2.548 -4.851 2.107 1.00 . A A . 12 CYS SG 1 1 1 147 1 1 13 LYS C C 5.203 -8.630 4.001 1.00 . A A . 13 LYS C 1 1 1 148 1 1 13 LYS CA C 5.643 -7.386 4.786 1.00 . A A . 13 LYS CA 1 1 1 149 1 1 13 LYS CB C 5.254 -7.538 6.267 1.00 . A A . 13 LYS CB 1 1 1 150 1 1 13 LYS CD C 6.395 -5.358 6.840 1.00 . A A . 13 LYS CD 1 1 1 151 1 1 13 LYS CE C 6.186 -3.943 7.400 1.00 . A A . 13 LYS CE 1 1 1 152 1 1 13 LYS CG C 5.082 -6.154 6.922 1.00 . A A . 13 LYS CG 1 1 1 153 1 1 13 LYS H H 4.165 -5.879 4.545 1.00 . A A . 13 LYS H 1 1 1 154 1 1 13 LYS HA H 6.717 -7.308 4.724 1.00 . A A . 13 LYS HA 1 1 1 155 1 1 13 LYS HB2 H 4.325 -8.085 6.337 1.00 . A A . 13 LYS HB2 1 1 1 156 1 1 13 LYS HB3 H 6.029 -8.084 6.785 1.00 . A A . 13 LYS HB3 1 1 1 157 1 1 13 LYS HD2 H 7.155 -5.863 7.418 1.00 . A A . 13 LYS HD2 1 1 1 158 1 1 13 LYS HD3 H 6.712 -5.291 5.811 1.00 . A A . 13 LYS HD3 1 1 1 159 1 1 13 LYS HE2 H 5.129 -3.714 7.418 1.00 . A A . 13 LYS HE2 1 1 1 160 1 1 13 LYS HE3 H 6.580 -3.892 8.406 1.00 . A A . 13 LYS HE3 1 1 1 161 1 1 13 LYS HG2 H 4.297 -5.610 6.414 1.00 . A A . 13 LYS HG2 1 1 1 162 1 1 13 LYS HG3 H 4.809 -6.285 7.960 1.00 . A A . 13 LYS HG3 1 1 1 163 1 1 13 LYS HZ1 H 6.232 -2.568 5.812 1.00 . A A . 13 LYS HZ1 1 1 1 164 1 1 13 LYS HZ2 H 7.689 -3.419 6.051 1.00 . A A . 13 LYS HZ2 1 1 1 165 1 1 13 LYS HZ3 H 7.262 -2.168 7.117 1.00 . A A . 13 LYS HZ3 1 1 1 166 1 1 13 LYS N N 5.053 -6.160 4.247 1.00 . A A . 13 LYS N 1 1 1 167 1 1 13 LYS NZ N 6.897 -2.954 6.535 1.00 . A A . 13 LYS NZ 1 1 1 168 1 1 13 LYS O O 4.049 -8.757 3.586 1.00 . A A . 13 LYS O 1 1 1 169 1 1 14 GLY C C 4.627 -11.471 3.427 1.00 . A A . 14 GLY C 1 1 1 170 1 1 14 GLY CA C 5.941 -10.782 3.058 1.00 . A A . 14 GLY CA 1 1 1 171 1 1 14 GLY H H 7.059 -9.352 4.153 1.00 . A A . 14 GLY H 1 1 1 172 1 1 14 GLY HA2 H 5.931 -10.560 2.002 1.00 . A A . 14 GLY HA2 1 1 1 173 1 1 14 GLY HA3 H 6.758 -11.460 3.263 1.00 . A A . 14 GLY HA3 1 1 1 174 1 1 14 GLY N N 6.163 -9.535 3.799 1.00 . A A . 14 GLY N 1 1 1 175 1 1 14 GLY O O 4.222 -11.486 4.589 1.00 . A A . 14 GLY O 1 1 1 176 1 1 15 LYS C C 1.513 -11.835 2.402 1.00 . A A . 15 LYS C 1 1 1 177 1 1 15 LYS CA C 2.711 -12.769 2.571 1.00 . A A . 15 LYS CA 1 1 1 178 1 1 15 LYS CB C 2.642 -13.454 3.944 1.00 . A A . 15 LYS CB 1 1 1 179 1 1 15 LYS CD C 0.293 -14.197 4.437 1.00 . A A . 15 LYS CD 1 1 1 180 1 1 15 LYS CE C -0.826 -14.778 3.567 1.00 . A A . 15 LYS CE 1 1 1 181 1 1 15 LYS CG C 1.661 -14.633 3.891 1.00 . A A . 15 LYS CG 1 1 1 182 1 1 15 LYS H H 4.381 -11.995 1.517 1.00 . A A . 15 LYS H 1 1 1 183 1 1 15 LYS HA H 2.654 -13.531 1.807 1.00 . A A . 15 LYS HA 1 1 1 184 1 1 15 LYS HB2 H 3.624 -13.817 4.214 1.00 . A A . 15 LYS HB2 1 1 1 185 1 1 15 LYS HB3 H 2.307 -12.744 4.685 1.00 . A A . 15 LYS HB3 1 1 1 186 1 1 15 LYS HD2 H 0.182 -14.555 5.451 1.00 . A A . 15 LYS HD2 1 1 1 187 1 1 15 LYS HD3 H 0.228 -13.120 4.429 1.00 . A A . 15 LYS HD3 1 1 1 188 1 1 15 LYS HE2 H -0.453 -15.638 3.028 1.00 . A A . 15 LYS HE2 1 1 1 189 1 1 15 LYS HE3 H -1.651 -15.081 4.198 1.00 . A A . 15 LYS HE3 1 1 1 190 1 1 15 LYS HG2 H 1.556 -14.968 2.869 1.00 . A A . 15 LYS HG2 1 1 1 191 1 1 15 LYS HG3 H 2.044 -15.442 4.495 1.00 . A A . 15 LYS HG3 1 1 1 192 1 1 15 LYS HZ1 H -1.655 -14.200 1.743 1.00 . A A . 15 LYS HZ1 1 1 1 193 1 1 15 LYS HZ2 H -0.477 -13.115 2.342 1.00 . A A . 15 LYS HZ2 1 1 1 194 1 1 15 LYS HZ3 H -2.040 -13.167 3.035 1.00 . A A . 15 LYS HZ3 1 1 1 195 1 1 15 LYS N N 3.982 -12.047 2.409 1.00 . A A . 15 LYS N 1 1 1 196 1 1 15 LYS NZ N -1.288 -13.740 2.601 1.00 . A A . 15 LYS NZ 1 1 1 197 1 1 15 LYS O O 0.407 -12.285 2.085 1.00 . A A . 15 LYS O 1 1 1 198 1 1 16 MET C C 1.213 -8.281 1.806 1.00 . A A . 16 MET C 1 1 1 199 1 1 16 MET CA C 0.668 -9.553 2.450 1.00 . A A . 16 MET CA 1 1 1 200 1 1 16 MET CB C 0.066 -9.213 3.821 1.00 . A A . 16 MET CB 1 1 1 201 1 1 16 MET CE C -0.930 -10.198 7.181 1.00 . A A . 16 MET CE 1 1 1 202 1 1 16 MET CG C -0.389 -10.492 4.530 1.00 . A A . 16 MET CG 1 1 1 203 1 1 16 MET H H 2.637 -10.237 2.843 1.00 . A A . 16 MET H 1 1 1 204 1 1 16 MET HA H -0.105 -9.963 1.820 1.00 . A A . 16 MET HA 1 1 1 205 1 1 16 MET HB2 H 0.812 -8.712 4.426 1.00 . A A . 16 MET HB2 1 1 1 206 1 1 16 MET HB3 H -0.783 -8.559 3.688 1.00 . A A . 16 MET HB3 1 1 1 207 1 1 16 MET HE1 H -0.752 -11.235 7.440 1.00 . A A . 16 MET HE1 1 1 1 208 1 1 16 MET HE2 H -1.530 -9.728 7.946 1.00 . A A . 16 MET HE2 1 1 1 209 1 1 16 MET HE3 H 0.015 -9.682 7.102 1.00 . A A . 16 MET HE3 1 1 1 210 1 1 16 MET HG2 H -0.679 -11.227 3.795 1.00 . A A . 16 MET HG2 1 1 1 211 1 1 16 MET HG3 H 0.422 -10.881 5.128 1.00 . A A . 16 MET HG3 1 1 1 212 1 1 16 MET N N 1.735 -10.539 2.601 1.00 . A A . 16 MET N 1 1 1 213 1 1 16 MET O O 1.802 -7.446 2.488 1.00 . A A . 16 MET O 1 1 1 214 1 1 16 MET SD S -1.803 -10.116 5.597 1.00 . A A . 16 MET SD 1 1 1 215 1 1 17 ALA C C 0.520 -6.426 -1.232 1.00 . A A . 17 ALA C 1 1 1 216 1 1 17 ALA CA C 1.508 -6.938 -0.193 1.00 . A A . 17 ALA CA 1 1 1 217 1 1 17 ALA CB C 2.841 -7.231 -0.867 1.00 . A A . 17 ALA CB 1 1 1 218 1 1 17 ALA H H 0.543 -8.823 -0.007 1.00 . A A . 17 ALA H 1 1 1 219 1 1 17 ALA HA H 1.658 -6.163 0.539 1.00 . A A . 17 ALA HA 1 1 1 220 1 1 17 ALA HB1 H 2.673 -7.837 -1.745 1.00 . A A . 17 ALA HB1 1 1 1 221 1 1 17 ALA HB2 H 3.484 -7.757 -0.180 1.00 . A A . 17 ALA HB2 1 1 1 222 1 1 17 ALA HB3 H 3.305 -6.299 -1.157 1.00 . A A . 17 ALA HB3 1 1 1 223 1 1 17 ALA N N 1.017 -8.130 0.496 1.00 . A A . 17 ALA N 1 1 1 224 1 1 17 ALA O O 0.211 -7.105 -2.216 1.00 . A A . 17 ALA O 1 1 1 225 1 1 18 LYS C C -0.953 -3.069 -1.655 1.00 . A A . 18 LYS C 1 1 1 226 1 1 18 LYS CA C -0.916 -4.577 -1.903 1.00 . A A . 18 LYS CA 1 1 1 227 1 1 18 LYS CB C -2.328 -5.160 -1.743 1.00 . A A . 18 LYS CB 1 1 1 228 1 1 18 LYS CD C -2.248 -7.395 -0.529 1.00 . A A . 18 LYS CD 1 1 1 229 1 1 18 LYS CE C -2.857 -7.931 -1.830 1.00 . A A . 18 LYS CE 1 1 1 230 1 1 18 LYS CG C -2.477 -5.875 -0.392 1.00 . A A . 18 LYS CG 1 1 1 231 1 1 18 LYS H H 0.336 -4.743 -0.199 1.00 . A A . 18 LYS H 1 1 1 232 1 1 18 LYS HA H -0.592 -4.750 -2.913 1.00 . A A . 18 LYS HA 1 1 1 233 1 1 18 LYS HB2 H -3.050 -4.355 -1.797 1.00 . A A . 18 LYS HB2 1 1 1 234 1 1 18 LYS HB3 H -2.515 -5.850 -2.544 1.00 . A A . 18 LYS HB3 1 1 1 235 1 1 18 LYS HD2 H -1.195 -7.604 -0.518 1.00 . A A . 18 LYS HD2 1 1 1 236 1 1 18 LYS HD3 H -2.709 -7.895 0.307 1.00 . A A . 18 LYS HD3 1 1 1 237 1 1 18 LYS HE2 H -3.206 -8.943 -1.673 1.00 . A A . 18 LYS HE2 1 1 1 238 1 1 18 LYS HE3 H -3.689 -7.308 -2.128 1.00 . A A . 18 LYS HE3 1 1 1 239 1 1 18 LYS HG2 H -1.757 -5.471 0.305 1.00 . A A . 18 LYS HG2 1 1 1 240 1 1 18 LYS HG3 H -3.469 -5.701 -0.012 1.00 . A A . 18 LYS HG3 1 1 1 241 1 1 18 LYS HZ1 H -2.139 -7.353 -3.706 1.00 . A A . 18 LYS HZ1 1 1 1 242 1 1 18 LYS HZ2 H -1.632 -8.897 -3.217 1.00 . A A . 18 LYS HZ2 1 1 1 243 1 1 18 LYS HZ3 H -0.917 -7.511 -2.520 1.00 . A A . 18 LYS HZ3 1 1 1 244 1 1 18 LYS N N 0.035 -5.219 -0.998 1.00 . A A . 18 LYS N 1 1 1 245 1 1 18 LYS NZ N -1.812 -7.925 -2.900 1.00 . A A . 18 LYS NZ 1 1 1 246 1 1 18 LYS O O -1.423 -2.613 -0.607 1.00 . A A . 18 LYS O 1 1 1 247 1 1 19 PRO C C -1.822 -0.179 -2.548 1.00 . A A . 19 PRO C 1 1 1 248 1 1 19 PRO CA C -0.430 -0.807 -2.464 1.00 . A A . 19 PRO CA 1 1 1 249 1 1 19 PRO CB C 0.448 -0.364 -3.638 1.00 . A A . 19 PRO CB 1 1 1 250 1 1 19 PRO CD C 0.117 -2.748 -3.866 1.00 . A A . 19 PRO CD 1 1 1 251 1 1 19 PRO CG C 0.328 -1.455 -4.649 1.00 . A A . 19 PRO CG 1 1 1 252 1 1 19 PRO HA H 0.045 -0.524 -1.539 1.00 . A A . 19 PRO HA 1 1 1 253 1 1 19 PRO HB2 H 0.087 0.570 -4.046 1.00 . A A . 19 PRO HB2 1 1 1 254 1 1 19 PRO HB3 H 1.475 -0.265 -3.322 1.00 . A A . 19 PRO HB3 1 1 1 255 1 1 19 PRO HD2 H -0.570 -3.398 -4.394 1.00 . A A . 19 PRO HD2 1 1 1 256 1 1 19 PRO HD3 H 1.059 -3.247 -3.695 1.00 . A A . 19 PRO HD3 1 1 1 257 1 1 19 PRO HG2 H -0.520 -1.266 -5.291 1.00 . A A . 19 PRO HG2 1 1 1 258 1 1 19 PRO HG3 H 1.231 -1.524 -5.232 1.00 . A A . 19 PRO HG3 1 1 1 259 1 1 19 PRO N N -0.463 -2.295 -2.589 1.00 . A A . 19 PRO N 1 1 1 260 1 1 19 PRO O O -2.575 -0.423 -3.496 1.00 . A A . 19 PRO O 1 1 1 261 1 1 20 THR C C -3.271 2.783 -1.242 1.00 . A A . 20 THR C 1 1 1 262 1 1 20 THR CA C -3.454 1.288 -1.488 1.00 . A A . 20 THR CA 1 1 1 263 1 1 20 THR CB C -4.297 0.677 -0.365 1.00 . A A . 20 THR CB 1 1 1 264 1 1 20 THR CG2 C -4.319 -0.841 -0.510 1.00 . A A . 20 THR CG2 1 1 1 265 1 1 20 THR H H -1.512 0.768 -0.813 1.00 . A A . 20 THR H 1 1 1 266 1 1 20 THR HA H -3.964 1.145 -2.427 1.00 . A A . 20 THR HA 1 1 1 267 1 1 20 THR HB H -5.306 1.056 -0.420 1.00 . A A . 20 THR HB 1 1 1 268 1 1 20 THR HG1 H -2.782 0.768 0.858 1.00 . A A . 20 THR HG1 1 1 1 269 1 1 20 THR HG21 H -5.039 -1.260 0.177 1.00 . A A . 20 THR HG21 1 1 1 270 1 1 20 THR HG22 H -3.341 -1.237 -0.292 1.00 . A A . 20 THR HG22 1 1 1 271 1 1 20 THR HG23 H -4.593 -1.101 -1.521 1.00 . A A . 20 THR HG23 1 1 1 272 1 1 20 THR N N -2.154 0.623 -1.541 1.00 . A A . 20 THR N 1 1 1 273 1 1 20 THR O O -2.709 3.181 -0.221 1.00 . A A . 20 THR O 1 1 1 274 1 1 20 THR OG1 O -3.727 1.017 0.890 1.00 . A A . 20 THR OG1 1 1 1 275 1 1 21 CYS C C -4.966 5.729 -1.885 1.00 . A A . 21 CYS C 1 1 1 276 1 1 21 CYS CA C -3.606 5.055 -2.080 1.00 . A A . 21 CYS CA 1 1 1 277 1 1 21 CYS CB C -2.959 5.636 -3.343 1.00 . A A . 21 CYS CB 1 1 1 278 1 1 21 CYS H H -4.160 3.209 -2.995 1.00 . A A . 21 CYS H 1 1 1 279 1 1 21 CYS HA H -2.978 5.287 -1.236 1.00 . A A . 21 CYS HA 1 1 1 280 1 1 21 CYS HB2 H -3.730 5.937 -4.032 1.00 . A A . 21 CYS HB2 1 1 1 281 1 1 21 CYS HB3 H -2.368 6.498 -3.075 1.00 . A A . 21 CYS HB3 1 1 1 282 1 1 21 CYS N N -3.733 3.600 -2.191 1.00 . A A . 21 CYS N 1 1 1 283 1 1 21 CYS O O -5.956 5.361 -2.533 1.00 . A A . 21 CYS O 1 1 1 284 1 1 21 CYS SG S -1.897 4.405 -4.137 1.00 . A A . 21 CYS SG 1 1 1 285 1 1 22 GLU C C -5.839 8.959 -0.497 1.00 . A A . 22 GLU C 1 1 1 286 1 1 22 GLU CA C -6.197 7.490 -0.735 1.00 . A A . 22 GLU CA 1 1 1 287 1 1 22 GLU CB C -6.941 6.918 0.478 1.00 . A A . 22 GLU CB 1 1 1 288 1 1 22 GLU CD C -5.412 5.090 1.285 1.00 . A A . 22 GLU CD 1 1 1 289 1 1 22 GLU CG C -5.942 6.493 1.559 1.00 . A A . 22 GLU CG 1 1 1 290 1 1 22 GLU H H -4.167 6.979 -0.542 1.00 . A A . 22 GLU H 1 1 1 291 1 1 22 GLU HA H -6.846 7.430 -1.598 1.00 . A A . 22 GLU HA 1 1 1 292 1 1 22 GLU HB2 H -7.605 7.673 0.879 1.00 . A A . 22 GLU HB2 1 1 1 293 1 1 22 GLU HB3 H -7.519 6.063 0.168 1.00 . A A . 22 GLU HB3 1 1 1 294 1 1 22 GLU HG2 H -5.116 7.185 1.574 1.00 . A A . 22 GLU HG2 1 1 1 295 1 1 22 GLU HG3 H -6.431 6.503 2.521 1.00 . A A . 22 GLU HG3 1 1 1 296 1 1 22 GLU N N -4.992 6.728 -1.008 1.00 . A A . 22 GLU N 1 1 1 297 1 1 22 GLU O O -5.181 9.302 0.484 1.00 . A A . 22 GLU O 1 1 1 298 1 1 22 GLU OE1 O -6.157 4.273 0.755 1.00 . A A . 22 GLU OE1 1 1 1 299 1 1 22 GLU OE2 O -4.268 4.838 1.626 1.00 . A A . 22 GLU OE2 1 1 1 300 1 1 23 ASN C C -4.587 11.568 -0.864 1.00 . A A . 23 ASN C 1 1 1 301 1 1 23 ASN CA C -6.017 11.257 -1.323 1.00 . A A . 23 ASN CA 1 1 1 302 1 1 23 ASN CB C -7.033 11.914 -0.380 1.00 . A A . 23 ASN CB 1 1 1 303 1 1 23 ASN CG C -6.961 11.296 1.010 1.00 . A A . 23 ASN CG 1 1 1 304 1 1 23 ASN H H -6.775 9.459 -2.167 1.00 . A A . 23 ASN H 1 1 1 305 1 1 23 ASN HA H -6.150 11.683 -2.307 1.00 . A A . 23 ASN HA 1 1 1 306 1 1 23 ASN HB2 H -6.823 12.972 -0.310 1.00 . A A . 23 ASN HB2 1 1 1 307 1 1 23 ASN HB3 H -8.022 11.774 -0.779 1.00 . A A . 23 ASN HB3 1 1 1 308 1 1 23 ASN HD21 H -5.107 11.913 1.339 1.00 . A A . 23 ASN HD21 1 1 1 309 1 1 23 ASN HD22 H -5.822 11.024 2.603 1.00 . A A . 23 ASN HD22 1 1 1 310 1 1 23 ASN N N -6.273 9.811 -1.410 1.00 . A A . 23 ASN N 1 1 1 311 1 1 23 ASN ND2 N -5.876 11.421 1.711 1.00 . A A . 23 ASN ND2 1 1 1 312 1 1 23 ASN O O -4.379 12.334 0.079 1.00 . A A . 23 ASN O 1 1 1 313 1 1 23 ASN OD1 O -7.922 10.684 1.469 1.00 . A A . 23 ASN OD1 1 1 1 314 1 1 24 GLU C C -1.726 10.308 -0.072 1.00 . A A . 24 GLU C 1 1 1 315 1 1 24 GLU CA C -2.193 11.153 -1.257 1.00 . A A . 24 GLU CA 1 1 1 316 1 1 24 GLU CB C -1.854 12.634 -1.028 1.00 . A A . 24 GLU CB 1 1 1 317 1 1 24 GLU CD C -0.978 13.067 -3.349 1.00 . A A . 24 GLU CD 1 1 1 318 1 1 24 GLU CG C -2.066 13.413 -2.335 1.00 . A A . 24 GLU CG 1 1 1 319 1 1 24 GLU H H -3.871 10.373 -2.287 1.00 . A A . 24 GLU H 1 1 1 320 1 1 24 GLU HA H -1.645 10.823 -2.119 1.00 . A A . 24 GLU HA 1 1 1 321 1 1 24 GLU HB2 H -2.486 13.041 -0.255 1.00 . A A . 24 GLU HB2 1 1 1 322 1 1 24 GLU HB3 H -0.821 12.722 -0.727 1.00 . A A . 24 GLU HB3 1 1 1 323 1 1 24 GLU HG2 H -3.030 13.160 -2.749 1.00 . A A . 24 GLU HG2 1 1 1 324 1 1 24 GLU HG3 H -2.036 14.472 -2.129 1.00 . A A . 24 GLU HG3 1 1 1 325 1 1 24 GLU N N -3.620 10.964 -1.548 1.00 . A A . 24 GLU N 1 1 1 326 1 1 24 GLU O O -0.530 10.250 0.218 1.00 . A A . 24 GLU O 1 1 1 327 1 1 24 GLU OE1 O -1.107 12.049 -4.011 1.00 . A A . 24 GLU OE1 1 1 1 328 1 1 24 GLU OE2 O -0.031 13.827 -3.459 1.00 . A A . 24 GLU OE2 1 1 1 329 1 1 25 VAL C C -2.215 7.310 1.175 1.00 . A A . 25 VAL C 1 1 1 330 1 1 25 VAL CA C -2.286 8.743 1.695 1.00 . A A . 25 VAL CA 1 1 1 331 1 1 25 VAL CB C -3.312 8.857 2.830 1.00 . A A . 25 VAL CB 1 1 1 332 1 1 25 VAL CG1 C -3.029 7.800 3.906 1.00 . A A . 25 VAL CG1 1 1 1 333 1 1 25 VAL CG2 C -3.217 10.249 3.458 1.00 . A A . 25 VAL CG2 1 1 1 334 1 1 25 VAL H H -3.594 9.667 0.296 1.00 . A A . 25 VAL H 1 1 1 335 1 1 25 VAL HA H -1.312 9.031 2.065 1.00 . A A . 25 VAL HA 1 1 1 336 1 1 25 VAL HB H -4.305 8.709 2.434 1.00 . A A . 25 VAL HB 1 1 1 337 1 1 25 VAL HG11 H -2.164 7.219 3.627 1.00 . A A . 25 VAL HG11 1 1 1 338 1 1 25 VAL HG12 H -3.884 7.147 4.004 1.00 . A A . 25 VAL HG12 1 1 1 339 1 1 25 VAL HG13 H -2.842 8.289 4.850 1.00 . A A . 25 VAL HG13 1 1 1 340 1 1 25 VAL HG21 H -3.748 10.257 4.399 1.00 . A A . 25 VAL HG21 1 1 1 341 1 1 25 VAL HG22 H -3.655 10.977 2.791 1.00 . A A . 25 VAL HG22 1 1 1 342 1 1 25 VAL HG23 H -2.180 10.498 3.629 1.00 . A A . 25 VAL HG23 1 1 1 343 1 1 25 VAL N N -2.653 9.616 0.581 1.00 . A A . 25 VAL N 1 1 1 344 1 1 25 VAL O O -3.037 6.910 0.348 1.00 . A A . 25 VAL O 1 1 1 345 1 1 26 CYS C C -0.950 4.174 2.263 1.00 . A A . 26 CYS C 1 1 1 346 1 1 26 CYS CA C -1.039 5.191 1.134 1.00 . A A . 26 CYS CA 1 1 1 347 1 1 26 CYS CB C 0.238 5.099 0.313 1.00 . A A . 26 CYS CB 1 1 1 348 1 1 26 CYS H H -0.553 6.921 2.230 1.00 . A A . 26 CYS H 1 1 1 349 1 1 26 CYS HA H -1.871 4.940 0.501 1.00 . A A . 26 CYS HA 1 1 1 350 1 1 26 CYS HB2 H 0.185 4.236 -0.312 1.00 . A A . 26 CYS HB2 1 1 1 351 1 1 26 CYS HB3 H 0.337 5.981 -0.300 1.00 . A A . 26 CYS HB3 1 1 1 352 1 1 26 CYS N N -1.207 6.553 1.612 1.00 . A A . 26 CYS N 1 1 1 353 1 1 26 CYS O O -0.537 4.489 3.378 1.00 . A A . 26 CYS O 1 1 1 354 1 1 26 CYS SG S 1.673 4.963 1.416 1.00 . A A . 26 CYS SG 1 1 1 355 1 1 27 LYS C C -1.168 0.500 2.158 1.00 . A A . 27 LYS C 1 1 1 356 1 1 27 LYS CA C -1.273 1.832 2.901 1.00 . A A . 27 LYS CA 1 1 1 357 1 1 27 LYS CB C -2.526 1.783 3.789 1.00 . A A . 27 LYS CB 1 1 1 358 1 1 27 LYS CD C -4.614 3.058 4.355 1.00 . A A . 27 LYS CD 1 1 1 359 1 1 27 LYS CE C -5.356 2.225 3.297 1.00 . A A . 27 LYS CE 1 1 1 360 1 1 27 LYS CG C -3.122 3.179 4.000 1.00 . A A . 27 LYS CG 1 1 1 361 1 1 27 LYS H H -1.637 2.760 1.024 1.00 . A A . 27 LYS H 1 1 1 362 1 1 27 LYS HA H -0.403 1.953 3.530 1.00 . A A . 27 LYS HA 1 1 1 363 1 1 27 LYS HB2 H -3.260 1.153 3.316 1.00 . A A . 27 LYS HB2 1 1 1 364 1 1 27 LYS HB3 H -2.264 1.360 4.747 1.00 . A A . 27 LYS HB3 1 1 1 365 1 1 27 LYS HD2 H -4.713 2.579 5.319 1.00 . A A . 27 LYS HD2 1 1 1 366 1 1 27 LYS HD3 H -5.050 4.044 4.401 1.00 . A A . 27 LYS HD3 1 1 1 367 1 1 27 LYS HE2 H -5.155 1.175 3.456 1.00 . A A . 27 LYS HE2 1 1 1 368 1 1 27 LYS HE3 H -6.419 2.400 3.386 1.00 . A A . 27 LYS HE3 1 1 1 369 1 1 27 LYS HG2 H -2.600 3.671 4.809 1.00 . A A . 27 LYS HG2 1 1 1 370 1 1 27 LYS HG3 H -3.015 3.760 3.103 1.00 . A A . 27 LYS HG3 1 1 1 371 1 1 27 LYS HZ1 H -5.726 2.851 1.332 1.00 . A A . 27 LYS HZ1 1 1 1 372 1 1 27 LYS HZ2 H -4.344 1.839 1.490 1.00 . A A . 27 LYS HZ2 1 1 1 373 1 1 27 LYS HZ3 H -4.298 3.491 2.001 1.00 . A A . 27 LYS HZ3 1 1 1 374 1 1 27 LYS N N -1.326 2.938 1.942 1.00 . A A . 27 LYS N 1 1 1 375 1 1 27 LYS NZ N -4.900 2.622 1.934 1.00 . A A . 27 LYS NZ 1 1 1 376 1 1 27 LYS O O -1.511 0.412 0.975 1.00 . A A . 27 LYS O 1 1 1 377 1 1 28 CYS C C -1.803 -2.712 2.791 1.00 . A A . 28 CYS C 1 1 1 378 1 1 28 CYS CA C -0.633 -1.872 2.281 1.00 . A A . 28 CYS CA 1 1 1 379 1 1 28 CYS CB C 0.697 -2.527 2.674 1.00 . A A . 28 CYS CB 1 1 1 380 1 1 28 CYS H H -0.506 -0.409 3.806 1.00 . A A . 28 CYS H 1 1 1 381 1 1 28 CYS HA H -0.690 -1.795 1.208 1.00 . A A . 28 CYS HA 1 1 1 382 1 1 28 CYS HB2 H 1.400 -1.763 2.972 1.00 . A A . 28 CYS HB2 1 1 1 383 1 1 28 CYS HB3 H 0.535 -3.206 3.499 1.00 . A A . 28 CYS HB3 1 1 1 384 1 1 28 CYS N N -0.734 -0.537 2.865 1.00 . A A . 28 CYS N 1 1 1 385 1 1 28 CYS O O -1.722 -3.302 3.868 1.00 . A A . 28 CYS O 1 1 1 386 1 1 28 CYS SG S 1.369 -3.443 1.264 1.00 . A A . 28 CYS SG 1 1 1 387 1 1 29 ASN C C -4.785 -4.221 1.354 1.00 . A A . 29 ASN C 1 1 1 388 1 1 29 ASN CA C -4.087 -3.474 2.491 1.00 . A A . 29 ASN CA 1 1 1 389 1 1 29 ASN CB C -5.080 -2.506 3.144 1.00 . A A . 29 ASN CB 1 1 1 390 1 1 29 ASN CG C -4.443 -1.835 4.355 1.00 . A A . 29 ASN CG 1 1 1 391 1 1 29 ASN H H -2.933 -2.225 1.202 1.00 . A A . 29 ASN H 1 1 1 392 1 1 29 ASN HA H -3.781 -4.193 3.232 1.00 . A A . 29 ASN HA 1 1 1 393 1 1 29 ASN HB2 H -5.365 -1.750 2.429 1.00 . A A . 29 ASN HB2 1 1 1 394 1 1 29 ASN HB3 H -5.959 -3.048 3.459 1.00 . A A . 29 ASN HB3 1 1 1 395 1 1 29 ASN HD21 H -4.695 -3.399 5.543 1.00 . A A . 29 ASN HD21 1 1 1 396 1 1 29 ASN HD22 H -3.948 -2.055 6.258 1.00 . A A . 29 ASN HD22 1 1 1 397 1 1 29 ASN N N -2.905 -2.733 2.044 1.00 . A A . 29 ASN N 1 1 1 398 1 1 29 ASN ND2 N -4.355 -2.484 5.478 1.00 . A A . 29 ASN ND2 1 1 1 399 1 1 29 ASN O O -4.931 -3.709 0.244 1.00 . A A . 29 ASN O 1 1 1 400 1 1 29 ASN OD1 O -4.017 -0.689 4.277 1.00 . A A . 29 ASN OD1 1 1 1 401 1 1 30 ILE C C -7.332 -5.665 0.388 1.00 . A A . 30 ILE C 1 1 1 402 1 1 30 ILE CA C -5.968 -6.262 0.707 1.00 . A A . 30 ILE CA 1 1 1 403 1 1 30 ILE CB C -6.133 -7.704 1.226 1.00 . A A . 30 ILE CB 1 1 1 404 1 1 30 ILE CD1 C -4.306 -7.647 2.935 1.00 . A A . 30 ILE CD1 1 1 1 405 1 1 30 ILE CG1 C -5.820 -7.768 2.726 1.00 . A A . 30 ILE CG1 1 1 1 406 1 1 30 ILE CG2 C -5.218 -8.662 0.455 1.00 . A A . 30 ILE CG2 1 1 1 407 1 1 30 ILE H H -5.116 -5.759 2.579 1.00 . A A . 30 ILE H 1 1 1 408 1 1 30 ILE HA H -5.395 -6.293 -0.207 1.00 . A A . 30 ILE HA 1 1 1 409 1 1 30 ILE HB H -7.157 -8.010 1.071 1.00 . A A . 30 ILE HB 1 1 1 410 1 1 30 ILE HD11 H -4.107 -6.986 3.763 1.00 . A A . 30 ILE HD11 1 1 1 411 1 1 30 ILE HD12 H -3.848 -7.250 2.039 1.00 . A A . 30 ILE HD12 1 1 1 412 1 1 30 ILE HD13 H -3.893 -8.622 3.143 1.00 . A A . 30 ILE HD13 1 1 1 413 1 1 30 ILE HG12 H -6.325 -6.961 3.236 1.00 . A A . 30 ILE HG12 1 1 1 414 1 1 30 ILE HG13 H -6.160 -8.713 3.123 1.00 . A A . 30 ILE HG13 1 1 1 415 1 1 30 ILE HG21 H -4.263 -8.727 0.948 1.00 . A A . 30 ILE HG21 1 1 1 416 1 1 30 ILE HG22 H -5.082 -8.302 -0.552 1.00 . A A . 30 ILE HG22 1 1 1 417 1 1 30 ILE HG23 H -5.673 -9.642 0.426 1.00 . A A . 30 ILE HG23 1 1 1 418 1 1 30 ILE N N -5.244 -5.429 1.668 1.00 . A A . 30 ILE N 1 1 1 419 1 1 30 ILE O O -8.004 -5.106 1.253 1.00 . A A . 30 ILE O 1 1 1 420 1 1 31 GLY C C -8.772 -4.102 -2.320 1.00 . A A . 31 GLY C 1 1 1 421 1 1 31 GLY CA C -8.995 -5.260 -1.353 1.00 . A A . 31 GLY CA 1 1 1 422 1 1 31 GLY H H -7.122 -6.243 -1.501 1.00 . A A . 31 GLY H 1 1 1 423 1 1 31 GLY HA2 H -9.543 -6.045 -1.855 1.00 . A A . 31 GLY HA2 1 1 1 424 1 1 31 GLY HA3 H -9.568 -4.908 -0.513 1.00 . A A . 31 GLY HA3 1 1 1 425 1 1 31 GLY N N -7.717 -5.789 -0.874 1.00 . A A . 31 GLY N 1 1 1 426 1 1 31 GLY O O -9.639 -3.779 -3.131 1.00 . A A . 31 GLY O 1 1 1 427 1 1 32 LYS C C -5.801 -2.592 -3.631 1.00 . A A . 32 LYS C 1 1 1 428 1 1 32 LYS CA C -7.228 -2.394 -3.121 1.00 . A A . 32 LYS CA 1 1 1 429 1 1 32 LYS CB C -7.345 -1.058 -2.371 1.00 . A A . 32 LYS CB 1 1 1 430 1 1 32 LYS CD C -8.004 1.257 -3.124 1.00 . A A . 32 LYS CD 1 1 1 431 1 1 32 LYS CE C -7.328 2.432 -2.404 1.00 . A A . 32 LYS CE 1 1 1 432 1 1 32 LYS CG C -7.002 0.104 -3.319 1.00 . A A . 32 LYS CG 1 1 1 433 1 1 32 LYS H H -6.940 -3.819 -1.582 1.00 . A A . 32 LYS H 1 1 1 434 1 1 32 LYS HA H -7.902 -2.384 -3.964 1.00 . A A . 32 LYS HA 1 1 1 435 1 1 32 LYS HB2 H -8.356 -0.942 -2.007 1.00 . A A . 32 LYS HB2 1 1 1 436 1 1 32 LYS HB3 H -6.662 -1.053 -1.537 1.00 . A A . 32 LYS HB3 1 1 1 437 1 1 32 LYS HD2 H -8.360 1.585 -4.090 1.00 . A A . 32 LYS HD2 1 1 1 438 1 1 32 LYS HD3 H -8.841 0.912 -2.535 1.00 . A A . 32 LYS HD3 1 1 1 439 1 1 32 LYS HE2 H -8.052 2.935 -1.778 1.00 . A A . 32 LYS HE2 1 1 1 440 1 1 32 LYS HE3 H -6.519 2.064 -1.790 1.00 . A A . 32 LYS HE3 1 1 1 441 1 1 32 LYS HG2 H -6.001 0.455 -3.112 1.00 . A A . 32 LYS HG2 1 1 1 442 1 1 32 LYS HG3 H -7.054 -0.240 -4.343 1.00 . A A . 32 LYS HG3 1 1 1 443 1 1 32 LYS HZ1 H -6.582 4.319 -2.955 1.00 . A A . 32 LYS HZ1 1 1 1 444 1 1 32 LYS HZ2 H -7.489 3.530 -4.168 1.00 . A A . 32 LYS HZ2 1 1 1 445 1 1 32 LYS HZ3 H -5.895 3.000 -3.832 1.00 . A A . 32 LYS HZ3 1 1 1 446 1 1 32 LYS N N -7.591 -3.501 -2.240 1.00 . A A . 32 LYS N 1 1 1 447 1 1 32 LYS NZ N -6.792 3.391 -3.414 1.00 . A A . 32 LYS NZ 1 1 1 448 1 1 32 LYS O O -4.888 -2.865 -2.852 1.00 . A A . 32 LYS O 1 1 1 449 1 1 33 LYS C C -3.947 -1.472 -6.442 1.00 . A A . 33 LYS C 1 1 1 450 1 1 33 LYS CA C -4.297 -2.651 -5.539 1.00 . A A . 33 LYS CA 1 1 1 451 1 1 33 LYS CB C -4.266 -3.951 -6.350 1.00 . A A . 33 LYS CB 1 1 1 452 1 1 33 LYS CD C -2.959 -4.069 -8.496 1.00 . A A . 33 LYS CD 1 1 1 453 1 1 33 LYS CE C -1.866 -3.138 -9.031 1.00 . A A . 33 LYS CE 1 1 1 454 1 1 33 LYS CG C -2.873 -4.149 -6.964 1.00 . A A . 33 LYS CG 1 1 1 455 1 1 33 LYS H H -6.382 -2.264 -5.518 1.00 . A A . 33 LYS H 1 1 1 456 1 1 33 LYS HA H -3.560 -2.715 -4.752 1.00 . A A . 33 LYS HA 1 1 1 457 1 1 33 LYS HB2 H -4.494 -4.783 -5.699 1.00 . A A . 33 LYS HB2 1 1 1 458 1 1 33 LYS HB3 H -5.004 -3.900 -7.137 1.00 . A A . 33 LYS HB3 1 1 1 459 1 1 33 LYS HD2 H -2.825 -5.056 -8.915 1.00 . A A . 33 LYS HD2 1 1 1 460 1 1 33 LYS HD3 H -3.926 -3.686 -8.787 1.00 . A A . 33 LYS HD3 1 1 1 461 1 1 33 LYS HE2 H -0.959 -3.282 -8.461 1.00 . A A . 33 LYS HE2 1 1 1 462 1 1 33 LYS HE3 H -1.677 -3.365 -10.072 1.00 . A A . 33 LYS HE3 1 1 1 463 1 1 33 LYS HG2 H -2.206 -3.379 -6.600 1.00 . A A . 33 LYS HG2 1 1 1 464 1 1 33 LYS HG3 H -2.490 -5.117 -6.678 1.00 . A A . 33 LYS HG3 1 1 1 465 1 1 33 LYS HZ1 H -1.661 -1.193 -8.252 1.00 . A A . 33 LYS HZ1 1 1 1 466 1 1 33 LYS HZ2 H -3.292 -1.696 -8.498 1.00 . A A . 33 LYS HZ2 1 1 1 467 1 1 33 LYS HZ3 H -2.315 -1.267 -9.835 1.00 . A A . 33 LYS HZ3 1 1 1 468 1 1 33 LYS N N -5.618 -2.471 -4.942 1.00 . A A . 33 LYS N 1 1 1 469 1 1 33 LYS NZ N -2.318 -1.723 -8.903 1.00 . A A . 33 LYS NZ 1 1 1 470 1 1 33 LYS O O -4.211 -1.498 -7.650 1.00 . A A . 33 LYS O 1 1 1 471 1 1 34 ASP C C -1.517 0.603 -7.131 1.00 . A A . 34 ASP C 1 1 1 472 1 1 34 ASP CA C -2.960 0.733 -6.621 1.00 . A A . 34 ASP CA 1 1 1 473 1 1 34 ASP CB C -3.118 1.977 -5.738 1.00 . A A . 34 ASP CB 1 1 1 474 1 1 34 ASP CG C -4.557 2.091 -5.236 1.00 . A A . 34 ASP CG 1 1 1 475 1 1 34 ASP H H -3.150 -0.479 -4.890 1.00 . A A . 34 ASP H 1 1 1 476 1 1 34 ASP HA H -3.619 0.828 -7.472 1.00 . A A . 34 ASP HA 1 1 1 477 1 1 34 ASP HB2 H -2.450 1.900 -4.894 1.00 . A A . 34 ASP HB2 1 1 1 478 1 1 34 ASP HB3 H -2.871 2.856 -6.312 1.00 . A A . 34 ASP HB3 1 1 1 479 1 1 34 ASP N N -3.344 -0.445 -5.857 1.00 . A A . 34 ASP N 1 1 1 480 1 1 34 ASP O O -1.091 -0.521 -7.363 1.00 . A A . 34 ASP O 1 1 1 481 1 1 34 ASP OXT O -0.864 1.619 -7.300 1.00 . A A . 34 ASP OXT 1 1 1 482 1 1 34 ASP OD1 O -5.456 1.668 -5.941 1.00 . A A . 34 ASP OD1 1 1 1 483 1 1 34 ASP OD2 O -4.746 2.608 -4.146 1.00 . A A . 34 ASP OD2 1 1 2 484 1 1 1 GLY C C 2.333 11.637 -4.693 1.00 . A A . 1 GLY C 1 1 2 485 1 1 1 GLY CA C 1.109 11.838 -5.581 1.00 . A A . 1 GLY CA 1 1 2 486 1 1 1 GLY H1 H 0.222 13.585 -6.308 1.00 . A A . 1 GLY H1 1 1 2 487 1 1 1 GLY H2 H 1.333 13.844 -5.047 1.00 . A A . 1 GLY H2 1 1 2 488 1 1 1 GLY H3 H -0.213 13.205 -4.703 1.00 . A A . 1 GLY H3 1 1 2 489 1 1 1 GLY HA2 H 0.347 11.119 -5.311 1.00 . A A . 1 GLY HA2 1 1 2 490 1 1 1 GLY HA3 H 1.392 11.692 -6.613 1.00 . A A . 1 GLY HA3 1 1 2 491 1 1 1 GLY N N 0.576 13.222 -5.399 1.00 . A A . 1 GLY N 1 1 2 492 1 1 1 GLY O O 3.447 11.479 -5.187 1.00 . A A . 1 GLY O 1 1 2 493 1 1 2 SER C C 3.944 10.161 -2.651 1.00 . A A . 2 SER C 1 1 2 494 1 1 2 SER CA C 3.211 11.486 -2.425 1.00 . A A . 2 SER CA 1 1 2 495 1 1 2 SER CB C 2.664 11.531 -0.998 1.00 . A A . 2 SER CB 1 1 2 496 1 1 2 SER H H 1.203 11.802 -3.042 1.00 . A A . 2 SER H 1 1 2 497 1 1 2 SER HA H 3.912 12.297 -2.550 1.00 . A A . 2 SER HA 1 1 2 498 1 1 2 SER HB2 H 1.853 10.827 -0.896 1.00 . A A . 2 SER HB2 1 1 2 499 1 1 2 SER HB3 H 3.452 11.273 -0.304 1.00 . A A . 2 SER HB3 1 1 2 500 1 1 2 SER HG H 1.411 13.015 -1.312 1.00 . A A . 2 SER HG 1 1 2 501 1 1 2 SER N N 2.118 11.658 -3.381 1.00 . A A . 2 SER N 1 1 2 502 1 1 2 SER O O 3.324 9.131 -2.925 1.00 . A A . 2 SER O 1 1 2 503 1 1 2 SER OG O 2.182 12.843 -0.724 1.00 . A A . 2 SER OG 1 1 2 504 1 1 3 VAL C C 5.555 7.819 -1.950 1.00 . A A . 3 VAL C 1 1 2 505 1 1 3 VAL CA C 6.104 9.014 -2.726 1.00 . A A . 3 VAL CA 1 1 2 506 1 1 3 VAL CB C 7.547 9.294 -2.275 1.00 . A A . 3 VAL CB 1 1 2 507 1 1 3 VAL CG1 C 8.371 9.803 -3.460 1.00 . A A . 3 VAL CG1 1 1 2 508 1 1 3 VAL CG2 C 7.558 10.352 -1.165 1.00 . A A . 3 VAL CG2 1 1 2 509 1 1 3 VAL H H 5.705 11.053 -2.314 1.00 . A A . 3 VAL H 1 1 2 510 1 1 3 VAL HA H 6.113 8.767 -3.776 1.00 . A A . 3 VAL HA 1 1 2 511 1 1 3 VAL HB H 7.987 8.379 -1.902 1.00 . A A . 3 VAL HB 1 1 2 512 1 1 3 VAL HG11 H 8.269 10.875 -3.537 1.00 . A A . 3 VAL HG11 1 1 2 513 1 1 3 VAL HG12 H 8.020 9.343 -4.371 1.00 . A A . 3 VAL HG12 1 1 2 514 1 1 3 VAL HG13 H 9.410 9.551 -3.308 1.00 . A A . 3 VAL HG13 1 1 2 515 1 1 3 VAL HG21 H 6.705 10.210 -0.517 1.00 . A A . 3 VAL HG21 1 1 2 516 1 1 3 VAL HG22 H 7.517 11.337 -1.605 1.00 . A A . 3 VAL HG22 1 1 2 517 1 1 3 VAL HG23 H 8.466 10.258 -0.589 1.00 . A A . 3 VAL HG23 1 1 2 518 1 1 3 VAL N N 5.273 10.204 -2.533 1.00 . A A . 3 VAL N 1 1 2 519 1 1 3 VAL O O 5.698 6.672 -2.381 1.00 . A A . 3 VAL O 1 1 2 520 1 1 4 GLY C C 3.813 5.890 -0.808 1.00 . A A . 4 GLY C 1 1 2 521 1 1 4 GLY CA C 4.348 7.043 0.028 1.00 . A A . 4 GLY CA 1 1 2 522 1 1 4 GLY H H 4.846 9.030 -0.526 1.00 . A A . 4 GLY H 1 1 2 523 1 1 4 GLY HA2 H 5.104 6.666 0.700 1.00 . A A . 4 GLY HA2 1 1 2 524 1 1 4 GLY HA3 H 3.536 7.456 0.608 1.00 . A A . 4 GLY HA3 1 1 2 525 1 1 4 GLY N N 4.925 8.096 -0.810 1.00 . A A . 4 GLY N 1 1 2 526 1 1 4 GLY O O 4.008 4.730 -0.466 1.00 . A A . 4 GLY O 1 1 2 527 1 1 5 CYS C C 3.642 4.180 -3.215 1.00 . A A . 5 CYS C 1 1 2 528 1 1 5 CYS CA C 2.574 5.181 -2.773 1.00 . A A . 5 CYS CA 1 1 2 529 1 1 5 CYS CB C 1.925 5.827 -3.999 1.00 . A A . 5 CYS CB 1 1 2 530 1 1 5 CYS H H 3.004 7.153 -2.134 1.00 . A A . 5 CYS H 1 1 2 531 1 1 5 CYS HA H 1.817 4.648 -2.219 1.00 . A A . 5 CYS HA 1 1 2 532 1 1 5 CYS HB2 H 2.692 6.245 -4.635 1.00 . A A . 5 CYS HB2 1 1 2 533 1 1 5 CYS HB3 H 1.376 5.080 -4.545 1.00 . A A . 5 CYS HB3 1 1 2 534 1 1 5 CYS N N 3.135 6.211 -1.905 1.00 . A A . 5 CYS N 1 1 2 535 1 1 5 CYS O O 3.330 3.023 -3.495 1.00 . A A . 5 CYS O 1 1 2 536 1 1 5 CYS SG S 0.795 7.144 -3.471 1.00 . A A . 5 CYS SG 1 1 2 537 1 1 6 ALA C C 6.508 3.018 -2.383 1.00 . A A . 6 ALA C 1 1 2 538 1 1 6 ALA CA C 5.998 3.735 -3.630 1.00 . A A . 6 ALA CA 1 1 2 539 1 1 6 ALA CB C 7.127 4.550 -4.271 1.00 . A A . 6 ALA CB 1 1 2 540 1 1 6 ALA H H 5.087 5.552 -2.999 1.00 . A A . 6 ALA H 1 1 2 541 1 1 6 ALA HA H 5.643 3.001 -4.336 1.00 . A A . 6 ALA HA 1 1 2 542 1 1 6 ALA HB1 H 6.703 5.318 -4.900 1.00 . A A . 6 ALA HB1 1 1 2 543 1 1 6 ALA HB2 H 7.748 3.898 -4.866 1.00 . A A . 6 ALA HB2 1 1 2 544 1 1 6 ALA HB3 H 7.725 5.008 -3.497 1.00 . A A . 6 ALA HB3 1 1 2 545 1 1 6 ALA N N 4.895 4.619 -3.253 1.00 . A A . 6 ALA N 1 1 2 546 1 1 6 ALA O O 6.728 1.800 -2.374 1.00 . A A . 6 ALA O 1 1 2 547 1 1 7 GLU C C 6.032 2.255 0.455 1.00 . A A . 7 GLU C 1 1 2 548 1 1 7 GLU CA C 7.094 3.224 -0.049 1.00 . A A . 7 GLU CA 1 1 2 549 1 1 7 GLU CB C 7.314 4.342 0.977 1.00 . A A . 7 GLU CB 1 1 2 550 1 1 7 GLU CD C 9.633 3.827 1.780 1.00 . A A . 7 GLU CD 1 1 2 551 1 1 7 GLU CG C 8.783 4.784 0.951 1.00 . A A . 7 GLU CG 1 1 2 552 1 1 7 GLU H H 6.438 4.738 -1.374 1.00 . A A . 7 GLU H 1 1 2 553 1 1 7 GLU HA H 8.019 2.690 -0.198 1.00 . A A . 7 GLU HA 1 1 2 554 1 1 7 GLU HB2 H 6.680 5.183 0.733 1.00 . A A . 7 GLU HB2 1 1 2 555 1 1 7 GLU HB3 H 7.066 3.981 1.965 1.00 . A A . 7 GLU HB3 1 1 2 556 1 1 7 GLU HG2 H 9.140 4.785 -0.068 1.00 . A A . 7 GLU HG2 1 1 2 557 1 1 7 GLU HG3 H 8.866 5.779 1.361 1.00 . A A . 7 GLU HG3 1 1 2 558 1 1 7 GLU N N 6.655 3.785 -1.314 1.00 . A A . 7 GLU N 1 1 2 559 1 1 7 GLU O O 6.343 1.205 1.001 1.00 . A A . 7 GLU O 1 1 2 560 1 1 7 GLU OE1 O 9.928 2.752 1.290 1.00 . A A . 7 GLU OE1 1 1 2 561 1 1 7 GLU OE2 O 9.961 4.178 2.904 1.00 . A A . 7 GLU OE2 1 1 2 562 1 1 8 CYS C C 3.909 0.317 0.355 1.00 . A A . 8 CYS C 1 1 2 563 1 1 8 CYS CA C 3.650 1.788 0.676 1.00 . A A . 8 CYS CA 1 1 2 564 1 1 8 CYS CB C 2.353 2.271 0.025 1.00 . A A . 8 CYS CB 1 1 2 565 1 1 8 CYS H H 4.590 3.477 -0.198 1.00 . A A . 8 CYS H 1 1 2 566 1 1 8 CYS HA H 3.545 1.890 1.742 1.00 . A A . 8 CYS HA 1 1 2 567 1 1 8 CYS HB2 H 2.544 3.170 -0.541 1.00 . A A . 8 CYS HB2 1 1 2 568 1 1 8 CYS HB3 H 1.957 1.517 -0.625 1.00 . A A . 8 CYS HB3 1 1 2 569 1 1 8 CYS N N 4.771 2.622 0.251 1.00 . A A . 8 CYS N 1 1 2 570 1 1 8 CYS O O 4.026 -0.503 1.267 1.00 . A A . 8 CYS O 1 1 2 571 1 1 8 CYS SG S 1.161 2.626 1.328 1.00 . A A . 8 CYS SG 1 1 2 572 1 1 9 PRO C C 5.591 -1.927 -0.587 1.00 . A A . 9 PRO C 1 1 2 573 1 1 9 PRO CA C 4.328 -1.444 -1.290 1.00 . A A . 9 PRO CA 1 1 2 574 1 1 9 PRO CB C 4.511 -1.414 -2.815 1.00 . A A . 9 PRO CB 1 1 2 575 1 1 9 PRO CD C 3.920 0.838 -2.076 1.00 . A A . 9 PRO CD 1 1 2 576 1 1 9 PRO CG C 4.531 0.025 -3.219 1.00 . A A . 9 PRO CG 1 1 2 577 1 1 9 PRO HA H 3.496 -2.081 -1.035 1.00 . A A . 9 PRO HA 1 1 2 578 1 1 9 PRO HB2 H 5.444 -1.891 -3.086 1.00 . A A . 9 PRO HB2 1 1 2 579 1 1 9 PRO HB3 H 3.687 -1.917 -3.295 1.00 . A A . 9 PRO HB3 1 1 2 580 1 1 9 PRO HD2 H 4.473 1.751 -1.925 1.00 . A A . 9 PRO HD2 1 1 2 581 1 1 9 PRO HD3 H 2.884 1.050 -2.282 1.00 . A A . 9 PRO HD3 1 1 2 582 1 1 9 PRO HG2 H 5.550 0.341 -3.398 1.00 . A A . 9 PRO HG2 1 1 2 583 1 1 9 PRO HG3 H 3.942 0.164 -4.113 1.00 . A A . 9 PRO HG3 1 1 2 584 1 1 9 PRO N N 4.037 -0.039 -0.906 1.00 . A A . 9 PRO N 1 1 2 585 1 1 9 PRO O O 5.621 -3.022 -0.021 1.00 . A A . 9 PRO O 1 1 2 586 1 1 10 MET C C 7.618 -1.625 1.573 1.00 . A A . 10 MET C 1 1 2 587 1 1 10 MET CA C 7.872 -1.405 0.081 1.00 . A A . 10 MET CA 1 1 2 588 1 1 10 MET CB C 8.874 -0.264 -0.109 1.00 . A A . 10 MET CB 1 1 2 589 1 1 10 MET CE C 11.923 0.309 -1.339 1.00 . A A . 10 MET CE 1 1 2 590 1 1 10 MET CG C 9.253 -0.150 -1.588 1.00 . A A . 10 MET CG 1 1 2 591 1 1 10 MET H H 6.528 -0.200 -1.035 1.00 . A A . 10 MET H 1 1 2 592 1 1 10 MET HA H 8.282 -2.308 -0.345 1.00 . A A . 10 MET HA 1 1 2 593 1 1 10 MET HB2 H 8.430 0.664 0.222 1.00 . A A . 10 MET HB2 1 1 2 594 1 1 10 MET HB3 H 9.758 -0.463 0.472 1.00 . A A . 10 MET HB3 1 1 2 595 1 1 10 MET HE1 H 12.455 -0.006 -0.452 1.00 . A A . 10 MET HE1 1 1 2 596 1 1 10 MET HE2 H 11.345 1.196 -1.123 1.00 . A A . 10 MET HE2 1 1 2 597 1 1 10 MET HE3 H 12.633 0.529 -2.120 1.00 . A A . 10 MET HE3 1 1 2 598 1 1 10 MET HG2 H 8.478 -0.596 -2.195 1.00 . A A . 10 MET HG2 1 1 2 599 1 1 10 MET HG3 H 9.363 0.892 -1.851 1.00 . A A . 10 MET HG3 1 1 2 600 1 1 10 MET N N 6.621 -1.076 -0.592 1.00 . A A . 10 MET N 1 1 2 601 1 1 10 MET O O 8.213 -2.502 2.197 1.00 . A A . 10 MET O 1 1 2 602 1 1 10 MET SD S 10.817 -1.017 -1.879 1.00 . A A . 10 MET SD 1 1 2 603 1 1 11 HIS C C 5.403 -2.065 3.790 1.00 . A A . 11 HIS C 1 1 2 604 1 1 11 HIS CA C 6.364 -0.902 3.538 1.00 . A A . 11 HIS CA 1 1 2 605 1 1 11 HIS CB C 5.698 0.406 3.965 1.00 . A A . 11 HIS CB 1 1 2 606 1 1 11 HIS CD2 C 7.764 1.943 3.464 1.00 . A A . 11 HIS CD2 1 1 2 607 1 1 11 HIS CE1 C 7.824 3.020 5.342 1.00 . A A . 11 HIS CE1 1 1 2 608 1 1 11 HIS CG C 6.744 1.451 4.235 1.00 . A A . 11 HIS CG 1 1 2 609 1 1 11 HIS H H 6.280 -0.136 1.568 1.00 . A A . 11 HIS H 1 1 2 610 1 1 11 HIS HA H 7.257 -1.049 4.124 1.00 . A A . 11 HIS HA 1 1 2 611 1 1 11 HIS HB2 H 5.050 0.748 3.173 1.00 . A A . 11 HIS HB2 1 1 2 612 1 1 11 HIS HB3 H 5.117 0.241 4.858 1.00 . A A . 11 HIS HB3 1 1 2 613 1 1 11 HIS HD2 H 8.009 1.608 2.469 1.00 . A A . 11 HIS HD2 1 1 2 614 1 1 11 HIS HE1 H 8.109 3.703 6.129 1.00 . A A . 11 HIS HE1 1 1 2 615 1 1 11 HIS HE2 H 9.209 3.487 3.832 1.00 . A A . 11 HIS HE2 1 1 2 616 1 1 11 HIS N N 6.720 -0.817 2.128 1.00 . A A . 11 HIS N 1 1 2 617 1 1 11 HIS ND1 N 6.802 2.150 5.429 1.00 . A A . 11 HIS ND1 1 1 2 618 1 1 11 HIS NE2 N 8.443 2.936 4.161 1.00 . A A . 11 HIS NE2 1 1 2 619 1 1 11 HIS O O 4.832 -2.183 4.879 1.00 . A A . 11 HIS O 1 1 2 620 1 1 12 CYS C C 5.189 -5.309 3.311 1.00 . A A . 12 CYS C 1 1 2 621 1 1 12 CYS CA C 4.361 -4.088 2.927 1.00 . A A . 12 CYS CA 1 1 2 622 1 1 12 CYS CB C 3.596 -4.350 1.629 1.00 . A A . 12 CYS CB 1 1 2 623 1 1 12 CYS H H 5.735 -2.793 1.954 1.00 . A A . 12 CYS H 1 1 2 624 1 1 12 CYS HA H 3.647 -3.889 3.715 1.00 . A A . 12 CYS HA 1 1 2 625 1 1 12 CYS HB2 H 3.647 -3.478 0.999 1.00 . A A . 12 CYS HB2 1 1 2 626 1 1 12 CYS HB3 H 4.033 -5.196 1.117 1.00 . A A . 12 CYS HB3 1 1 2 627 1 1 12 CYS N N 5.243 -2.931 2.794 1.00 . A A . 12 CYS N 1 1 2 628 1 1 12 CYS O O 6.342 -5.439 2.908 1.00 . A A . 12 CYS O 1 1 2 629 1 1 12 CYS SG S 1.862 -4.713 2.022 1.00 . A A . 12 CYS SG 1 1 2 630 1 1 13 LYS C C 5.032 -8.608 3.830 1.00 . A A . 13 LYS C 1 1 2 631 1 1 13 LYS CA C 5.341 -7.340 4.634 1.00 . A A . 13 LYS CA 1 1 2 632 1 1 13 LYS CB C 4.994 -7.557 6.112 1.00 . A A . 13 LYS CB 1 1 2 633 1 1 13 LYS CD C 5.130 -5.204 7.011 1.00 . A A . 13 LYS CD 1 1 2 634 1 1 13 LYS CE C 6.186 -4.101 6.874 1.00 . A A . 13 LYS CE 1 1 2 635 1 1 13 LYS CG C 5.807 -6.585 6.984 1.00 . A A . 13 LYS CG 1 1 2 636 1 1 13 LYS H H 3.710 -5.989 4.462 1.00 . A A . 13 LYS H 1 1 2 637 1 1 13 LYS HA H 6.399 -7.142 4.562 1.00 . A A . 13 LYS HA 1 1 2 638 1 1 13 LYS HB2 H 3.938 -7.381 6.263 1.00 . A A . 13 LYS HB2 1 1 2 639 1 1 13 LYS HB3 H 5.232 -8.573 6.392 1.00 . A A . 13 LYS HB3 1 1 2 640 1 1 13 LYS HD2 H 4.426 -5.130 6.195 1.00 . A A . 13 LYS HD2 1 1 2 641 1 1 13 LYS HD3 H 4.605 -5.082 7.947 1.00 . A A . 13 LYS HD3 1 1 2 642 1 1 13 LYS HE2 H 6.920 -4.206 7.663 1.00 . A A . 13 LYS HE2 1 1 2 643 1 1 13 LYS HE3 H 6.677 -4.188 5.914 1.00 . A A . 13 LYS HE3 1 1 2 644 1 1 13 LYS HG2 H 5.866 -6.976 7.991 1.00 . A A . 13 LYS HG2 1 1 2 645 1 1 13 LYS HG3 H 6.804 -6.489 6.580 1.00 . A A . 13 LYS HG3 1 1 2 646 1 1 13 LYS HZ1 H 6.191 -2.074 7.378 1.00 . A A . 13 LYS HZ1 1 1 2 647 1 1 13 LYS HZ2 H 4.690 -2.837 7.592 1.00 . A A . 13 LYS HZ2 1 1 2 648 1 1 13 LYS HZ3 H 5.221 -2.448 6.018 1.00 . A A . 13 LYS HZ3 1 1 2 649 1 1 13 LYS N N 4.617 -6.166 4.142 1.00 . A A . 13 LYS N 1 1 2 650 1 1 13 LYS NZ N 5.524 -2.766 6.978 1.00 . A A . 13 LYS NZ 1 1 2 651 1 1 13 LYS O O 3.898 -8.848 3.410 1.00 . A A . 13 LYS O 1 1 2 652 1 1 14 GLY C C 4.720 -11.445 3.158 1.00 . A A . 14 GLY C 1 1 2 653 1 1 14 GLY CA C 6.000 -10.662 2.871 1.00 . A A . 14 GLY CA 1 1 2 654 1 1 14 GLY H H 6.953 -9.134 3.988 1.00 . A A . 14 GLY H 1 1 2 655 1 1 14 GLY HA2 H 6.042 -10.439 1.814 1.00 . A A . 14 GLY HA2 1 1 2 656 1 1 14 GLY HA3 H 6.849 -11.280 3.128 1.00 . A A . 14 GLY HA3 1 1 2 657 1 1 14 GLY N N 6.084 -9.405 3.624 1.00 . A A . 14 GLY N 1 1 2 658 1 1 14 GLY O O 4.240 -11.487 4.291 1.00 . A A . 14 GLY O 1 1 2 659 1 1 15 LYS C C 1.711 -12.005 2.048 1.00 . A A . 15 LYS C 1 1 2 660 1 1 15 LYS CA C 2.961 -12.874 2.187 1.00 . A A . 15 LYS CA 1 1 2 661 1 1 15 LYS CB C 2.912 -13.660 3.510 1.00 . A A . 15 LYS CB 1 1 2 662 1 1 15 LYS CD C 1.225 -15.282 2.559 1.00 . A A . 15 LYS CD 1 1 2 663 1 1 15 LYS CE C 0.112 -14.898 3.543 1.00 . A A . 15 LYS CE 1 1 2 664 1 1 15 LYS CG C 2.598 -15.139 3.233 1.00 . A A . 15 LYS CG 1 1 2 665 1 1 15 LYS H H 4.635 -11.985 1.237 1.00 . A A . 15 LYS H 1 1 2 666 1 1 15 LYS HA H 2.971 -13.583 1.372 1.00 . A A . 15 LYS HA 1 1 2 667 1 1 15 LYS HB2 H 3.870 -13.590 4.005 1.00 . A A . 15 LYS HB2 1 1 2 668 1 1 15 LYS HB3 H 2.148 -13.245 4.149 1.00 . A A . 15 LYS HB3 1 1 2 669 1 1 15 LYS HD2 H 1.179 -14.638 1.694 1.00 . A A . 15 LYS HD2 1 1 2 670 1 1 15 LYS HD3 H 1.085 -16.306 2.248 1.00 . A A . 15 LYS HD3 1 1 2 671 1 1 15 LYS HE2 H -0.480 -15.773 3.775 1.00 . A A . 15 LYS HE2 1 1 2 672 1 1 15 LYS HE3 H 0.550 -14.509 4.452 1.00 . A A . 15 LYS HE3 1 1 2 673 1 1 15 LYS HG2 H 3.359 -15.550 2.585 1.00 . A A . 15 LYS HG2 1 1 2 674 1 1 15 LYS HG3 H 2.596 -15.684 4.167 1.00 . A A . 15 LYS HG3 1 1 2 675 1 1 15 LYS HZ1 H -1.479 -14.314 2.328 1.00 . A A . 15 LYS HZ1 1 1 2 676 1 1 15 LYS HZ2 H -0.166 -13.221 2.319 1.00 . A A . 15 LYS HZ2 1 1 2 677 1 1 15 LYS HZ3 H -1.222 -13.298 3.663 1.00 . A A . 15 LYS HZ3 1 1 2 678 1 1 15 LYS N N 4.185 -12.067 2.103 1.00 . A A . 15 LYS N 1 1 2 679 1 1 15 LYS NZ N -0.757 -13.857 2.919 1.00 . A A . 15 LYS NZ 1 1 2 680 1 1 15 LYS O O 0.636 -12.504 1.703 1.00 . A A . 15 LYS O 1 1 2 681 1 1 16 MET C C 1.179 -8.481 1.556 1.00 . A A . 16 MET C 1 1 2 682 1 1 16 MET CA C 0.713 -9.791 2.187 1.00 . A A . 16 MET CA 1 1 2 683 1 1 16 MET CB C 0.108 -9.501 3.573 1.00 . A A . 16 MET CB 1 1 2 684 1 1 16 MET CE C -1.525 -11.066 6.622 1.00 . A A . 16 MET CE 1 1 2 685 1 1 16 MET CG C 0.015 -10.789 4.402 1.00 . A A . 16 MET CG 1 1 2 686 1 1 16 MET H H 2.721 -10.355 2.575 1.00 . A A . 16 MET H 1 1 2 687 1 1 16 MET HA H -0.043 -10.237 1.560 1.00 . A A . 16 MET HA 1 1 2 688 1 1 16 MET HB2 H 0.732 -8.787 4.093 1.00 . A A . 16 MET HB2 1 1 2 689 1 1 16 MET HB3 H -0.880 -9.086 3.451 1.00 . A A . 16 MET HB3 1 1 2 690 1 1 16 MET HE1 H -0.749 -11.757 6.925 1.00 . A A . 16 MET HE1 1 1 2 691 1 1 16 MET HE2 H -2.461 -11.340 7.089 1.00 . A A . 16 MET HE2 1 1 2 692 1 1 16 MET HE3 H -1.254 -10.069 6.928 1.00 . A A . 16 MET HE3 1 1 2 693 1 1 16 MET HG2 H 0.406 -11.615 3.835 1.00 . A A . 16 MET HG2 1 1 2 694 1 1 16 MET HG3 H 0.590 -10.673 5.309 1.00 . A A . 16 MET HG3 1 1 2 695 1 1 16 MET N N 1.846 -10.707 2.306 1.00 . A A . 16 MET N 1 1 2 696 1 1 16 MET O O 1.720 -7.616 2.243 1.00 . A A . 16 MET O 1 1 2 697 1 1 16 MET SD S -1.714 -11.117 4.824 1.00 . A A . 16 MET SD 1 1 2 698 1 1 17 ALA C C 0.419 -6.617 -1.460 1.00 . A A . 17 ALA C 1 1 2 699 1 1 17 ALA CA C 1.419 -7.113 -0.423 1.00 . A A . 17 ALA CA 1 1 2 700 1 1 17 ALA CB C 2.768 -7.335 -1.091 1.00 . A A . 17 ALA CB 1 1 2 701 1 1 17 ALA H H 0.557 -9.052 -0.267 1.00 . A A . 17 ALA H 1 1 2 702 1 1 17 ALA HA H 1.536 -6.343 0.326 1.00 . A A . 17 ALA HA 1 1 2 703 1 1 17 ALA HB1 H 2.681 -8.125 -1.821 1.00 . A A . 17 ALA HB1 1 1 2 704 1 1 17 ALA HB2 H 3.496 -7.608 -0.344 1.00 . A A . 17 ALA HB2 1 1 2 705 1 1 17 ALA HB3 H 3.076 -6.423 -1.581 1.00 . A A . 17 ALA HB3 1 1 2 706 1 1 17 ALA N N 0.982 -8.334 0.247 1.00 . A A . 17 ALA N 1 1 2 707 1 1 17 ALA O O 0.210 -7.232 -2.508 1.00 . A A . 17 ALA O 1 1 2 708 1 1 18 LYS C C -1.277 -3.355 -1.556 1.00 . A A . 18 LYS C 1 1 2 709 1 1 18 LYS CA C -1.129 -4.808 -2.010 1.00 . A A . 18 LYS CA 1 1 2 710 1 1 18 LYS CB C -2.492 -5.520 -2.028 1.00 . A A . 18 LYS CB 1 1 2 711 1 1 18 LYS CD C -3.293 -7.776 -1.315 1.00 . A A . 18 LYS CD 1 1 2 712 1 1 18 LYS CE C -2.204 -8.802 -1.644 1.00 . A A . 18 LYS CE 1 1 2 713 1 1 18 LYS CG C -2.649 -6.466 -0.834 1.00 . A A . 18 LYS CG 1 1 2 714 1 1 18 LYS H H 0.085 -5.059 -0.299 1.00 . A A . 18 LYS H 1 1 2 715 1 1 18 LYS HA H -0.733 -4.810 -3.015 1.00 . A A . 18 LYS HA 1 1 2 716 1 1 18 LYS HB2 H -3.277 -4.777 -1.995 1.00 . A A . 18 LYS HB2 1 1 2 717 1 1 18 LYS HB3 H -2.580 -6.084 -2.945 1.00 . A A . 18 LYS HB3 1 1 2 718 1 1 18 LYS HD2 H -3.931 -8.171 -0.539 1.00 . A A . 18 LYS HD2 1 1 2 719 1 1 18 LYS HD3 H -3.882 -7.585 -2.199 1.00 . A A . 18 LYS HD3 1 1 2 720 1 1 18 LYS HE2 H -1.427 -8.753 -0.894 1.00 . A A . 18 LYS HE2 1 1 2 721 1 1 18 LYS HE3 H -2.634 -9.794 -1.648 1.00 . A A . 18 LYS HE3 1 1 2 722 1 1 18 LYS HG2 H -1.686 -6.675 -0.395 1.00 . A A . 18 LYS HG2 1 1 2 723 1 1 18 LYS HG3 H -3.283 -6.003 -0.096 1.00 . A A . 18 LYS HG3 1 1 2 724 1 1 18 LYS HZ1 H -2.334 -8.048 -3.586 1.00 . A A . 18 LYS HZ1 1 1 2 725 1 1 18 LYS HZ2 H -1.308 -9.391 -3.436 1.00 . A A . 18 LYS HZ2 1 1 2 726 1 1 18 LYS HZ3 H -0.791 -7.862 -2.876 1.00 . A A . 18 LYS HZ3 1 1 2 727 1 1 18 LYS N N -0.165 -5.480 -1.144 1.00 . A A . 18 LYS N 1 1 2 728 1 1 18 LYS NZ N -1.620 -8.507 -2.987 1.00 . A A . 18 LYS NZ 1 1 2 729 1 1 18 LYS O O -1.956 -3.063 -0.567 1.00 . A A . 18 LYS O 1 1 2 730 1 1 19 PRO C C -1.798 -0.227 -2.443 1.00 . A A . 19 PRO C 1 1 2 731 1 1 19 PRO CA C -0.612 -1.008 -1.883 1.00 . A A . 19 PRO CA 1 1 2 732 1 1 19 PRO CB C 0.689 -0.522 -2.512 1.00 . A A . 19 PRO CB 1 1 2 733 1 1 19 PRO CD C 0.224 -2.715 -3.422 1.00 . A A . 19 PRO CD 1 1 2 734 1 1 19 PRO CG C 0.829 -1.345 -3.749 1.00 . A A . 19 PRO CG 1 1 2 735 1 1 19 PRO HA H -0.556 -0.881 -0.816 1.00 . A A . 19 PRO HA 1 1 2 736 1 1 19 PRO HB2 H 0.621 0.529 -2.758 1.00 . A A . 19 PRO HB2 1 1 2 737 1 1 19 PRO HB3 H 1.520 -0.706 -1.849 1.00 . A A . 19 PRO HB3 1 1 2 738 1 1 19 PRO HD2 H -0.380 -3.066 -4.248 1.00 . A A . 19 PRO HD2 1 1 2 739 1 1 19 PRO HD3 H 1.000 -3.427 -3.187 1.00 . A A . 19 PRO HD3 1 1 2 740 1 1 19 PRO HG2 H 0.289 -0.881 -4.564 1.00 . A A . 19 PRO HG2 1 1 2 741 1 1 19 PRO HG3 H 1.869 -1.459 -4.007 1.00 . A A . 19 PRO HG3 1 1 2 742 1 1 19 PRO N N -0.612 -2.457 -2.233 1.00 . A A . 19 PRO N 1 1 2 743 1 1 19 PRO O O -2.461 -0.643 -3.400 1.00 . A A . 19 PRO O 1 1 2 744 1 1 20 THR C C -2.837 3.215 -1.750 1.00 . A A . 20 THR C 1 1 2 745 1 1 20 THR CA C -3.105 1.815 -2.269 1.00 . A A . 20 THR CA 1 1 2 746 1 1 20 THR CB C -4.466 1.336 -1.778 1.00 . A A . 20 THR CB 1 1 2 747 1 1 20 THR CG2 C -5.543 2.356 -2.148 1.00 . A A . 20 THR CG2 1 1 2 748 1 1 20 THR H H -1.464 1.200 -1.092 1.00 . A A . 20 THR H 1 1 2 749 1 1 20 THR HA H -3.114 1.844 -3.344 1.00 . A A . 20 THR HA 1 1 2 750 1 1 20 THR HB H -4.434 1.237 -0.714 1.00 . A A . 20 THR HB 1 1 2 751 1 1 20 THR HG1 H -3.945 -0.312 -2.699 1.00 . A A . 20 THR HG1 1 1 2 752 1 1 20 THR HG21 H -5.489 2.576 -3.202 1.00 . A A . 20 THR HG21 1 1 2 753 1 1 20 THR HG22 H -5.389 3.264 -1.584 1.00 . A A . 20 THR HG22 1 1 2 754 1 1 20 THR HG23 H -6.515 1.953 -1.913 1.00 . A A . 20 THR HG23 1 1 2 755 1 1 20 THR N N -2.037 0.927 -1.841 1.00 . A A . 20 THR N 1 1 2 756 1 1 20 THR O O -2.209 3.400 -0.701 1.00 . A A . 20 THR O 1 1 2 757 1 1 20 THR OG1 O -4.779 0.083 -2.386 1.00 . A A . 20 THR OG1 1 1 2 758 1 1 21 CYS C C -4.457 6.339 -2.249 1.00 . A A . 21 CYS C 1 1 2 759 1 1 21 CYS CA C -3.134 5.588 -2.147 1.00 . A A . 21 CYS CA 1 1 2 760 1 1 21 CYS CB C -2.081 6.227 -3.057 1.00 . A A . 21 CYS CB 1 1 2 761 1 1 21 CYS H H -3.801 3.944 -3.320 1.00 . A A . 21 CYS H 1 1 2 762 1 1 21 CYS HA H -2.788 5.645 -1.131 1.00 . A A . 21 CYS HA 1 1 2 763 1 1 21 CYS HB2 H -1.997 5.651 -3.966 1.00 . A A . 21 CYS HB2 1 1 2 764 1 1 21 CYS HB3 H -2.371 7.240 -3.295 1.00 . A A . 21 CYS HB3 1 1 2 765 1 1 21 CYS N N -3.314 4.184 -2.499 1.00 . A A . 21 CYS N 1 1 2 766 1 1 21 CYS O O -5.197 6.191 -3.220 1.00 . A A . 21 CYS O 1 1 2 767 1 1 21 CYS SG S -0.486 6.239 -2.193 1.00 . A A . 21 CYS SG 1 1 2 768 1 1 22 GLU C C -5.689 9.283 -0.611 1.00 . A A . 22 GLU C 1 1 2 769 1 1 22 GLU CA C -5.967 7.899 -1.182 1.00 . A A . 22 GLU CA 1 1 2 770 1 1 22 GLU CB C -7.010 7.161 -0.325 1.00 . A A . 22 GLU CB 1 1 2 771 1 1 22 GLU CD C -6.023 5.010 0.556 1.00 . A A . 22 GLU CD 1 1 2 772 1 1 22 GLU CG C -6.325 6.476 0.872 1.00 . A A . 22 GLU CG 1 1 2 773 1 1 22 GLU H H -4.118 7.216 -0.487 1.00 . A A . 22 GLU H 1 1 2 774 1 1 22 GLU HA H -6.355 8.006 -2.185 1.00 . A A . 22 GLU HA 1 1 2 775 1 1 22 GLU HB2 H -7.742 7.868 0.037 1.00 . A A . 22 GLU HB2 1 1 2 776 1 1 22 GLU HB3 H -7.504 6.414 -0.928 1.00 . A A . 22 GLU HB3 1 1 2 777 1 1 22 GLU HG2 H -5.403 6.988 1.100 1.00 . A A . 22 GLU HG2 1 1 2 778 1 1 22 GLU HG3 H -6.979 6.524 1.730 1.00 . A A . 22 GLU HG3 1 1 2 779 1 1 22 GLU N N -4.744 7.137 -1.232 1.00 . A A . 22 GLU N 1 1 2 780 1 1 22 GLU O O -5.119 9.429 0.468 1.00 . A A . 22 GLU O 1 1 2 781 1 1 22 GLU OE1 O -6.933 4.197 0.634 1.00 . A A . 22 GLU OE1 1 1 2 782 1 1 22 GLU OE2 O -4.880 4.708 0.266 1.00 . A A . 22 GLU OE2 1 1 2 783 1 1 23 ASN C C -4.475 11.917 -0.413 1.00 . A A . 23 ASN C 1 1 2 784 1 1 23 ASN CA C -5.873 11.690 -0.988 1.00 . A A . 23 ASN CA 1 1 2 785 1 1 23 ASN CB C -6.942 12.136 0.021 1.00 . A A . 23 ASN CB 1 1 2 786 1 1 23 ASN CG C -7.026 11.167 1.196 1.00 . A A . 23 ASN CG 1 1 2 787 1 1 23 ASN H H -6.489 10.073 -2.222 1.00 . A A . 23 ASN H 1 1 2 788 1 1 23 ASN HA H -5.972 12.299 -1.876 1.00 . A A . 23 ASN HA 1 1 2 789 1 1 23 ASN HB2 H -6.693 13.120 0.390 1.00 . A A . 23 ASN HB2 1 1 2 790 1 1 23 ASN HB3 H -7.896 12.174 -0.475 1.00 . A A . 23 ASN HB3 1 1 2 791 1 1 23 ASN HD21 H -8.287 9.940 0.290 1.00 . A A . 23 ASN HD21 1 1 2 792 1 1 23 ASN HD22 H -7.827 9.485 1.857 1.00 . A A . 23 ASN HD22 1 1 2 793 1 1 23 ASN N N -6.074 10.286 -1.371 1.00 . A A . 23 ASN N 1 1 2 794 1 1 23 ASN ND2 N -7.777 10.111 1.106 1.00 . A A . 23 ASN ND2 1 1 2 795 1 1 23 ASN O O -4.320 12.482 0.668 1.00 . A A . 23 ASN O 1 1 2 796 1 1 23 ASN OD1 O -6.401 11.385 2.228 1.00 . A A . 23 ASN OD1 1 1 2 797 1 1 24 GLU C C -1.702 10.651 0.372 1.00 . A A . 24 GLU C 1 1 2 798 1 1 24 GLU CA C -2.071 11.607 -0.763 1.00 . A A . 24 GLU CA 1 1 2 799 1 1 24 GLU CB C -1.752 13.055 -0.363 1.00 . A A . 24 GLU CB 1 1 2 800 1 1 24 GLU CD C -0.713 13.378 -2.630 1.00 . A A . 24 GLU CD 1 1 2 801 1 1 24 GLU CG C -1.710 13.936 -1.619 1.00 . A A . 24 GLU CG 1 1 2 802 1 1 24 GLU H H -3.681 11.029 -2.011 1.00 . A A . 24 GLU H 1 1 2 803 1 1 24 GLU HA H -1.463 11.354 -1.614 1.00 . A A . 24 GLU HA 1 1 2 804 1 1 24 GLU HB2 H -2.508 13.424 0.313 1.00 . A A . 24 GLU HB2 1 1 2 805 1 1 24 GLU HB3 H -0.788 13.089 0.126 1.00 . A A . 24 GLU HB3 1 1 2 806 1 1 24 GLU HG2 H -2.693 13.965 -2.067 1.00 . A A . 24 GLU HG2 1 1 2 807 1 1 24 GLU HG3 H -1.416 14.937 -1.344 1.00 . A A . 24 GLU HG3 1 1 2 808 1 1 24 GLU N N -3.473 11.466 -1.160 1.00 . A A . 24 GLU N 1 1 2 809 1 1 24 GLU O O -0.541 10.584 0.780 1.00 . A A . 24 GLU O 1 1 2 810 1 1 24 GLU OE1 O 0.432 13.179 -2.264 1.00 . A A . 24 GLU OE1 1 1 2 811 1 1 24 GLU OE2 O -1.107 13.154 -3.763 1.00 . A A . 24 GLU OE2 1 1 2 812 1 1 25 VAL C C -2.267 7.533 1.324 1.00 . A A . 25 VAL C 1 1 2 813 1 1 25 VAL CA C -2.412 8.927 1.928 1.00 . A A . 25 VAL CA 1 1 2 814 1 1 25 VAL CB C -3.549 8.946 2.958 1.00 . A A . 25 VAL CB 1 1 2 815 1 1 25 VAL CG1 C -3.268 7.921 4.062 1.00 . A A . 25 VAL CG1 1 1 2 816 1 1 25 VAL CG2 C -3.647 10.343 3.582 1.00 . A A . 25 VAL CG2 1 1 2 817 1 1 25 VAL H H -3.587 9.964 0.494 1.00 . A A . 25 VAL H 1 1 2 818 1 1 25 VAL HA H -1.488 9.193 2.421 1.00 . A A . 25 VAL HA 1 1 2 819 1 1 25 VAL HB H -4.482 8.702 2.471 1.00 . A A . 25 VAL HB 1 1 2 820 1 1 25 VAL HG11 H -3.565 6.939 3.725 1.00 . A A . 25 VAL HG11 1 1 2 821 1 1 25 VAL HG12 H -3.830 8.183 4.947 1.00 . A A . 25 VAL HG12 1 1 2 822 1 1 25 VAL HG13 H -2.213 7.920 4.294 1.00 . A A . 25 VAL HG13 1 1 2 823 1 1 25 VAL HG21 H -4.653 10.716 3.473 1.00 . A A . 25 VAL HG21 1 1 2 824 1 1 25 VAL HG22 H -2.960 11.013 3.085 1.00 . A A . 25 VAL HG22 1 1 2 825 1 1 25 VAL HG23 H -3.398 10.289 4.632 1.00 . A A . 25 VAL HG23 1 1 2 826 1 1 25 VAL N N -2.677 9.892 0.864 1.00 . A A . 25 VAL N 1 1 2 827 1 1 25 VAL O O -3.123 7.087 0.561 1.00 . A A . 25 VAL O 1 1 2 828 1 1 26 CYS C C -1.108 4.442 2.153 1.00 . A A . 26 CYS C 1 1 2 829 1 1 26 CYS CA C -0.904 5.528 1.100 1.00 . A A . 26 CYS CA 1 1 2 830 1 1 26 CYS CB C 0.529 5.454 0.583 1.00 . A A . 26 CYS CB 1 1 2 831 1 1 26 CYS H H -0.502 7.271 2.230 1.00 . A A . 26 CYS H 1 1 2 832 1 1 26 CYS HA H -1.577 5.347 0.280 1.00 . A A . 26 CYS HA 1 1 2 833 1 1 26 CYS HB2 H 0.540 4.941 -0.359 1.00 . A A . 26 CYS HB2 1 1 2 834 1 1 26 CYS HB3 H 0.924 6.445 0.453 1.00 . A A . 26 CYS HB3 1 1 2 835 1 1 26 CYS N N -1.163 6.860 1.640 1.00 . A A . 26 CYS N 1 1 2 836 1 1 26 CYS O O -0.835 4.646 3.336 1.00 . A A . 26 CYS O 1 1 2 837 1 1 26 CYS SG S 1.545 4.553 1.772 1.00 . A A . 26 CYS SG 1 1 2 838 1 1 27 LYS C C -1.699 0.812 1.882 1.00 . A A . 27 LYS C 1 1 2 839 1 1 27 LYS CA C -1.799 2.153 2.617 1.00 . A A . 27 LYS CA 1 1 2 840 1 1 27 LYS CB C -3.187 2.251 3.266 1.00 . A A . 27 LYS CB 1 1 2 841 1 1 27 LYS CD C -5.171 3.748 3.689 1.00 . A A . 27 LYS CD 1 1 2 842 1 1 27 LYS CE C -6.005 2.601 3.101 1.00 . A A . 27 LYS CE 1 1 2 843 1 1 27 LYS CG C -3.723 3.687 3.177 1.00 . A A . 27 LYS CG 1 1 2 844 1 1 27 LYS H H -1.771 3.168 0.746 1.00 . A A . 27 LYS H 1 1 2 845 1 1 27 LYS HA H -1.051 2.183 3.396 1.00 . A A . 27 LYS HA 1 1 2 846 1 1 27 LYS HB2 H -3.863 1.581 2.754 1.00 . A A . 27 LYS HB2 1 1 2 847 1 1 27 LYS HB3 H -3.116 1.961 4.302 1.00 . A A . 27 LYS HB3 1 1 2 848 1 1 27 LYS HD2 H -5.171 3.671 4.767 1.00 . A A . 27 LYS HD2 1 1 2 849 1 1 27 LYS HD3 H -5.611 4.691 3.400 1.00 . A A . 27 LYS HD3 1 1 2 850 1 1 27 LYS HE2 H -5.749 1.678 3.600 1.00 . A A . 27 LYS HE2 1 1 2 851 1 1 27 LYS HE3 H -7.056 2.810 3.250 1.00 . A A . 27 LYS HE3 1 1 2 852 1 1 27 LYS HG2 H -3.105 4.336 3.782 1.00 . A A . 27 LYS HG2 1 1 2 853 1 1 27 LYS HG3 H -3.693 4.024 2.152 1.00 . A A . 27 LYS HG3 1 1 2 854 1 1 27 LYS HZ1 H -4.759 2.795 1.443 1.00 . A A . 27 LYS HZ1 1 1 2 855 1 1 27 LYS HZ2 H -6.407 3.089 1.099 1.00 . A A . 27 LYS HZ2 1 1 2 856 1 1 27 LYS HZ3 H -5.832 1.467 1.342 1.00 . A A . 27 LYS HZ3 1 1 2 857 1 1 27 LYS N N -1.576 3.276 1.706 1.00 . A A . 27 LYS N 1 1 2 858 1 1 27 LYS NZ N -5.727 2.475 1.641 1.00 . A A . 27 LYS NZ 1 1 2 859 1 1 27 LYS O O -2.058 0.704 0.709 1.00 . A A . 27 LYS O 1 1 2 860 1 1 28 CYS C C -2.365 -2.363 2.498 1.00 . A A . 28 CYS C 1 1 2 861 1 1 28 CYS CA C -1.153 -1.564 2.025 1.00 . A A . 28 CYS CA 1 1 2 862 1 1 28 CYS CB C 0.148 -2.247 2.473 1.00 . A A . 28 CYS CB 1 1 2 863 1 1 28 CYS H H -1.009 -0.080 3.534 1.00 . A A . 28 CYS H 1 1 2 864 1 1 28 CYS HA H -1.170 -1.497 0.952 1.00 . A A . 28 CYS HA 1 1 2 865 1 1 28 CYS HB2 H 0.873 -1.494 2.747 1.00 . A A . 28 CYS HB2 1 1 2 866 1 1 28 CYS HB3 H -0.049 -2.881 3.325 1.00 . A A . 28 CYS HB3 1 1 2 867 1 1 28 CYS N N -1.249 -0.219 2.596 1.00 . A A . 28 CYS N 1 1 2 868 1 1 28 CYS O O -2.347 -2.946 3.580 1.00 . A A . 28 CYS O 1 1 2 869 1 1 28 CYS SG S 0.805 -3.249 1.111 1.00 . A A . 28 CYS SG 1 1 2 870 1 1 29 ASN C C -4.905 -4.315 1.310 1.00 . A A . 29 ASN C 1 1 2 871 1 1 29 ASN CA C -4.671 -3.021 2.093 1.00 . A A . 29 ASN CA 1 1 2 872 1 1 29 ASN CB C -5.868 -2.072 1.898 1.00 . A A . 29 ASN CB 1 1 2 873 1 1 29 ASN CG C -5.555 -0.996 0.857 1.00 . A A . 29 ASN CG 1 1 2 874 1 1 29 ASN H H -3.400 -1.831 0.868 1.00 . A A . 29 ASN H 1 1 2 875 1 1 29 ASN HA H -4.610 -3.269 3.142 1.00 . A A . 29 ASN HA 1 1 2 876 1 1 29 ASN HB2 H -6.726 -2.639 1.572 1.00 . A A . 29 ASN HB2 1 1 2 877 1 1 29 ASN HB3 H -6.097 -1.594 2.839 1.00 . A A . 29 ASN HB3 1 1 2 878 1 1 29 ASN HD21 H -5.117 -2.298 -0.581 1.00 . A A . 29 ASN HD21 1 1 2 879 1 1 29 ASN HD22 H -4.999 -0.655 -1.019 1.00 . A A . 29 ASN HD22 1 1 2 880 1 1 29 ASN N N -3.434 -2.339 1.707 1.00 . A A . 29 ASN N 1 1 2 881 1 1 29 ASN ND2 N -5.192 -1.344 -0.342 1.00 . A A . 29 ASN ND2 1 1 2 882 1 1 29 ASN O O -4.922 -4.320 0.082 1.00 . A A . 29 ASN O 1 1 2 883 1 1 29 ASN OD1 O -5.653 0.201 1.147 1.00 . A A . 29 ASN OD1 1 1 2 884 1 1 30 ILE C C -6.800 -6.744 0.856 1.00 . A A . 30 ILE C 1 1 2 885 1 1 30 ILE CA C -5.391 -6.707 1.424 1.00 . A A . 30 ILE CA 1 1 2 886 1 1 30 ILE CB C -5.180 -7.867 2.413 1.00 . A A . 30 ILE CB 1 1 2 887 1 1 30 ILE CD1 C -3.779 -6.644 4.063 1.00 . A A . 30 ILE CD1 1 1 2 888 1 1 30 ILE CG1 C -5.128 -7.333 3.845 1.00 . A A . 30 ILE CG1 1 1 2 889 1 1 30 ILE CG2 C -3.871 -8.599 2.093 1.00 . A A . 30 ILE CG2 1 1 2 890 1 1 30 ILE H H -5.119 -5.335 3.019 1.00 . A A . 30 ILE H 1 1 2 891 1 1 30 ILE HA H -4.707 -6.836 0.606 1.00 . A A . 30 ILE HA 1 1 2 892 1 1 30 ILE HB H -6.002 -8.563 2.325 1.00 . A A . 30 ILE HB 1 1 2 893 1 1 30 ILE HD11 H -3.128 -7.302 4.615 1.00 . A A . 30 ILE HD11 1 1 2 894 1 1 30 ILE HD12 H -3.925 -5.730 4.614 1.00 . A A . 30 ILE HD12 1 1 2 895 1 1 30 ILE HD13 H -3.330 -6.420 3.104 1.00 . A A . 30 ILE HD13 1 1 2 896 1 1 30 ILE HG12 H -5.932 -6.627 4.000 1.00 . A A . 30 ILE HG12 1 1 2 897 1 1 30 ILE HG13 H -5.227 -8.152 4.540 1.00 . A A . 30 ILE HG13 1 1 2 898 1 1 30 ILE HG21 H -3.564 -9.175 2.954 1.00 . A A . 30 ILE HG21 1 1 2 899 1 1 30 ILE HG22 H -3.104 -7.878 1.852 1.00 . A A . 30 ILE HG22 1 1 2 900 1 1 30 ILE HG23 H -4.024 -9.260 1.254 1.00 . A A . 30 ILE HG23 1 1 2 901 1 1 30 ILE N N -5.120 -5.409 2.044 1.00 . A A . 30 ILE N 1 1 2 902 1 1 30 ILE O O -7.773 -6.408 1.530 1.00 . A A . 30 ILE O 1 1 2 903 1 1 31 GLY C C -8.285 -6.019 -2.071 1.00 . A A . 31 GLY C 1 1 2 904 1 1 31 GLY CA C -8.153 -7.202 -1.117 1.00 . A A . 31 GLY CA 1 1 2 905 1 1 31 GLY H H -6.054 -7.367 -0.872 1.00 . A A . 31 GLY H 1 1 2 906 1 1 31 GLY HA2 H -8.206 -8.123 -1.677 1.00 . A A . 31 GLY HA2 1 1 2 907 1 1 31 GLY HA3 H -8.960 -7.168 -0.404 1.00 . A A . 31 GLY HA3 1 1 2 908 1 1 31 GLY N N -6.879 -7.135 -0.405 1.00 . A A . 31 GLY N 1 1 2 909 1 1 31 GLY O O -9.073 -6.050 -3.016 1.00 . A A . 31 GLY O 1 1 2 910 1 1 32 LYS C C -6.070 -3.359 -2.970 1.00 . A A . 32 LYS C 1 1 2 911 1 1 32 LYS CA C -7.506 -3.770 -2.625 1.00 . A A . 32 LYS CA 1 1 2 912 1 1 32 LYS CB C -8.229 -2.650 -1.854 1.00 . A A . 32 LYS CB 1 1 2 913 1 1 32 LYS CD C -8.134 -0.913 -3.663 1.00 . A A . 32 LYS CD 1 1 2 914 1 1 32 LYS CE C -7.555 0.447 -4.056 1.00 . A A . 32 LYS CE 1 1 2 915 1 1 32 LYS CG C -7.686 -1.267 -2.242 1.00 . A A . 32 LYS CG 1 1 2 916 1 1 32 LYS H H -6.896 -5.025 -1.037 1.00 . A A . 32 LYS H 1 1 2 917 1 1 32 LYS HA H -8.044 -3.968 -3.539 1.00 . A A . 32 LYS HA 1 1 2 918 1 1 32 LYS HB2 H -9.285 -2.691 -2.076 1.00 . A A . 32 LYS HB2 1 1 2 919 1 1 32 LYS HB3 H -8.084 -2.801 -0.794 1.00 . A A . 32 LYS HB3 1 1 2 920 1 1 32 LYS HD2 H -7.782 -1.666 -4.352 1.00 . A A . 32 LYS HD2 1 1 2 921 1 1 32 LYS HD3 H -9.211 -0.867 -3.700 1.00 . A A . 32 LYS HD3 1 1 2 922 1 1 32 LYS HE2 H -8.009 0.779 -4.981 1.00 . A A . 32 LYS HE2 1 1 2 923 1 1 32 LYS HE3 H -7.762 1.167 -3.277 1.00 . A A . 32 LYS HE3 1 1 2 924 1 1 32 LYS HG2 H -8.068 -0.528 -1.552 1.00 . A A . 32 LYS HG2 1 1 2 925 1 1 32 LYS HG3 H -6.610 -1.272 -2.196 1.00 . A A . 32 LYS HG3 1 1 2 926 1 1 32 LYS HZ1 H -5.880 -0.523 -4.807 1.00 . A A . 32 LYS HZ1 1 1 2 927 1 1 32 LYS HZ2 H -5.603 0.234 -3.297 1.00 . A A . 32 LYS HZ2 1 1 2 928 1 1 32 LYS HZ3 H -5.712 1.179 -4.751 1.00 . A A . 32 LYS HZ3 1 1 2 929 1 1 32 LYS N N -7.498 -4.979 -1.806 1.00 . A A . 32 LYS N 1 1 2 930 1 1 32 LYS NZ N -6.083 0.318 -4.240 1.00 . A A . 32 LYS NZ 1 1 2 931 1 1 32 LYS O O -5.266 -3.082 -2.083 1.00 . A A . 32 LYS O 1 1 2 932 1 1 33 LYS C C -4.433 -1.860 -5.750 1.00 . A A . 33 LYS C 1 1 2 933 1 1 33 LYS CA C -4.399 -2.963 -4.694 1.00 . A A . 33 LYS CA 1 1 2 934 1 1 33 LYS CB C -3.675 -4.198 -5.260 1.00 . A A . 33 LYS CB 1 1 2 935 1 1 33 LYS CD C -3.344 -4.648 -7.727 1.00 . A A . 33 LYS CD 1 1 2 936 1 1 33 LYS CE C -2.860 -3.217 -8.007 1.00 . A A . 33 LYS CE 1 1 2 937 1 1 33 LYS CG C -4.350 -4.669 -6.561 1.00 . A A . 33 LYS CG 1 1 2 938 1 1 33 LYS H H -6.423 -3.569 -4.932 1.00 . A A . 33 LYS H 1 1 2 939 1 1 33 LYS HA H -3.846 -2.604 -3.839 1.00 . A A . 33 LYS HA 1 1 2 940 1 1 33 LYS HB2 H -2.643 -3.949 -5.457 1.00 . A A . 33 LYS HB2 1 1 2 941 1 1 33 LYS HB3 H -3.715 -4.994 -4.532 1.00 . A A . 33 LYS HB3 1 1 2 942 1 1 33 LYS HD2 H -2.495 -5.268 -7.476 1.00 . A A . 33 LYS HD2 1 1 2 943 1 1 33 LYS HD3 H -3.818 -5.041 -8.614 1.00 . A A . 33 LYS HD3 1 1 2 944 1 1 33 LYS HE2 H -2.526 -2.762 -7.086 1.00 . A A . 33 LYS HE2 1 1 2 945 1 1 33 LYS HE3 H -2.036 -3.248 -8.707 1.00 . A A . 33 LYS HE3 1 1 2 946 1 1 33 LYS HG2 H -4.713 -5.678 -6.425 1.00 . A A . 33 LYS HG2 1 1 2 947 1 1 33 LYS HG3 H -5.183 -4.025 -6.795 1.00 . A A . 33 LYS HG3 1 1 2 948 1 1 33 LYS HZ1 H -3.603 -1.453 -8.872 1.00 . A A . 33 LYS HZ1 1 1 2 949 1 1 33 LYS HZ2 H -4.725 -2.281 -7.860 1.00 . A A . 33 LYS HZ2 1 1 2 950 1 1 33 LYS HZ3 H -4.366 -2.891 -9.418 1.00 . A A . 33 LYS HZ3 1 1 2 951 1 1 33 LYS N N -5.748 -3.332 -4.261 1.00 . A A . 33 LYS N 1 1 2 952 1 1 33 LYS NZ N -3.974 -2.410 -8.587 1.00 . A A . 33 LYS NZ 1 1 2 953 1 1 33 LYS O O -5.198 -1.934 -6.717 1.00 . A A . 33 LYS O 1 1 2 954 1 1 34 ASP C C -2.655 -0.179 -7.724 1.00 . A A . 34 ASP C 1 1 2 955 1 1 34 ASP CA C -3.525 0.244 -6.539 1.00 . A A . 34 ASP CA 1 1 2 956 1 1 34 ASP CB C -2.940 1.501 -5.879 1.00 . A A . 34 ASP CB 1 1 2 957 1 1 34 ASP CG C -4.046 2.422 -5.360 1.00 . A A . 34 ASP CG 1 1 2 958 1 1 34 ASP H H -2.993 -0.839 -4.791 1.00 . A A . 34 ASP H 1 1 2 959 1 1 34 ASP HA H -4.520 0.462 -6.900 1.00 . A A . 34 ASP HA 1 1 2 960 1 1 34 ASP HB2 H -2.307 1.207 -5.057 1.00 . A A . 34 ASP HB2 1 1 2 961 1 1 34 ASP HB3 H -2.346 2.038 -6.604 1.00 . A A . 34 ASP HB3 1 1 2 962 1 1 34 ASP N N -3.593 -0.848 -5.575 1.00 . A A . 34 ASP N 1 1 2 963 1 1 34 ASP O O -1.497 -0.494 -7.503 1.00 . A A . 34 ASP O 1 1 2 964 1 1 34 ASP OXT O -3.175 -0.226 -8.832 1.00 . A A . 34 ASP OXT 1 1 2 965 1 1 34 ASP OD1 O -5.208 2.055 -5.457 1.00 . A A . 34 ASP OD1 1 1 2 966 1 1 34 ASP OD2 O -3.716 3.477 -4.848 1.00 . A A . 34 ASP OD2 1 1 3 967 1 1 1 GLY C C 1.733 11.481 -4.858 1.00 . A A . 1 GLY C 1 1 3 968 1 1 1 GLY CA C 0.404 11.361 -5.593 1.00 . A A . 1 GLY CA 1 1 3 969 1 1 1 GLY H1 H -1.062 12.501 -4.627 1.00 . A A . 1 GLY H1 1 1 3 970 1 1 1 GLY H2 H -0.891 12.841 -6.293 1.00 . A A . 1 GLY H2 1 1 3 971 1 1 1 GLY H3 H 0.270 13.403 -5.187 1.00 . A A . 1 GLY H3 1 1 3 972 1 1 1 GLY HA2 H -0.158 10.530 -5.189 1.00 . A A . 1 GLY HA2 1 1 3 973 1 1 1 GLY HA3 H 0.591 11.194 -6.643 1.00 . A A . 1 GLY HA3 1 1 3 974 1 1 1 GLY N N -0.377 12.621 -5.416 1.00 . A A . 1 GLY N 1 1 3 975 1 1 1 GLY O O 2.749 11.841 -5.451 1.00 . A A . 1 GLY O 1 1 3 976 1 1 2 SER C C 3.760 10.007 -2.820 1.00 . A A . 2 SER C 1 1 3 977 1 1 2 SER CA C 2.923 11.290 -2.744 1.00 . A A . 2 SER CA 1 1 3 978 1 1 2 SER CB C 2.528 11.579 -1.294 1.00 . A A . 2 SER CB 1 1 3 979 1 1 2 SER H H 0.871 10.928 -3.140 1.00 . A A . 2 SER H 1 1 3 980 1 1 2 SER HA H 3.521 12.113 -3.105 1.00 . A A . 2 SER HA 1 1 3 981 1 1 2 SER HB2 H 1.746 10.902 -0.988 1.00 . A A . 2 SER HB2 1 1 3 982 1 1 2 SER HB3 H 3.390 11.444 -0.652 1.00 . A A . 2 SER HB3 1 1 3 983 1 1 2 SER HG H 1.248 13.005 -1.764 1.00 . A A . 2 SER HG 1 1 3 984 1 1 2 SER N N 1.716 11.195 -3.561 1.00 . A A . 2 SER N 1 1 3 985 1 1 2 SER O O 3.222 8.899 -2.904 1.00 . A A . 2 SER O 1 1 3 986 1 1 2 SER OG O 2.052 12.921 -1.200 1.00 . A A . 2 SER OG 1 1 3 987 1 1 3 VAL C C 5.561 7.859 -2.026 1.00 . A A . 3 VAL C 1 1 3 988 1 1 3 VAL CA C 6.024 9.050 -2.867 1.00 . A A . 3 VAL CA 1 1 3 989 1 1 3 VAL CB C 7.414 9.500 -2.401 1.00 . A A . 3 VAL CB 1 1 3 990 1 1 3 VAL CG1 C 8.134 10.217 -3.545 1.00 . A A . 3 VAL CG1 1 1 3 991 1 1 3 VAL CG2 C 7.288 10.458 -1.210 1.00 . A A . 3 VAL CG2 1 1 3 992 1 1 3 VAL H H 5.448 11.082 -2.729 1.00 . A A . 3 VAL H 1 1 3 993 1 1 3 VAL HA H 6.097 8.732 -3.895 1.00 . A A . 3 VAL HA 1 1 3 994 1 1 3 VAL HB H 7.985 8.634 -2.104 1.00 . A A . 3 VAL HB 1 1 3 995 1 1 3 VAL HG11 H 9.042 10.666 -3.172 1.00 . A A . 3 VAL HG11 1 1 3 996 1 1 3 VAL HG12 H 7.492 10.984 -3.949 1.00 . A A . 3 VAL HG12 1 1 3 997 1 1 3 VAL HG13 H 8.377 9.505 -4.319 1.00 . A A . 3 VAL HG13 1 1 3 998 1 1 3 VAL HG21 H 6.703 9.992 -0.431 1.00 . A A . 3 VAL HG21 1 1 3 999 1 1 3 VAL HG22 H 6.806 11.369 -1.528 1.00 . A A . 3 VAL HG22 1 1 3 1000 1 1 3 VAL HG23 H 8.272 10.687 -0.829 1.00 . A A . 3 VAL HG23 1 1 3 1001 1 1 3 VAL N N 5.086 10.176 -2.793 1.00 . A A . 3 VAL N 1 1 3 1002 1 1 3 VAL O O 5.754 6.701 -2.415 1.00 . A A . 3 VAL O 1 1 3 1003 1 1 4 GLY C C 3.927 5.900 -0.786 1.00 . A A . 4 GLY C 1 1 3 1004 1 1 4 GLY CA C 4.459 7.084 0.010 1.00 . A A . 4 GLY CA 1 1 3 1005 1 1 4 GLY H H 4.824 9.079 -0.622 1.00 . A A . 4 GLY H 1 1 3 1006 1 1 4 GLY HA2 H 5.269 6.747 0.642 1.00 . A A . 4 GLY HA2 1 1 3 1007 1 1 4 GLY HA3 H 3.666 7.474 0.629 1.00 . A A . 4 GLY HA3 1 1 3 1008 1 1 4 GLY N N 4.949 8.143 -0.877 1.00 . A A . 4 GLY N 1 1 3 1009 1 1 4 GLY O O 4.160 4.749 -0.430 1.00 . A A . 4 GLY O 1 1 3 1010 1 1 5 CYS C C 3.719 4.169 -3.188 1.00 . A A . 5 CYS C 1 1 3 1011 1 1 5 CYS CA C 2.645 5.147 -2.714 1.00 . A A . 5 CYS CA 1 1 3 1012 1 1 5 CYS CB C 1.949 5.771 -3.926 1.00 . A A . 5 CYS CB 1 1 3 1013 1 1 5 CYS H H 3.058 7.130 -2.108 1.00 . A A . 5 CYS H 1 1 3 1014 1 1 5 CYS HA H 1.918 4.600 -2.135 1.00 . A A . 5 CYS HA 1 1 3 1015 1 1 5 CYS HB2 H 2.679 6.287 -4.533 1.00 . A A . 5 CYS HB2 1 1 3 1016 1 1 5 CYS HB3 H 1.483 4.996 -4.507 1.00 . A A . 5 CYS HB3 1 1 3 1017 1 1 5 CYS N N 3.212 6.193 -1.871 1.00 . A A . 5 CYS N 1 1 3 1018 1 1 5 CYS O O 3.416 3.021 -3.502 1.00 . A A . 5 CYS O 1 1 3 1019 1 1 5 CYS SG S 0.690 6.950 -3.368 1.00 . A A . 5 CYS SG 1 1 3 1020 1 1 6 ALA C C 6.614 3.023 -2.415 1.00 . A A . 6 ALA C 1 1 3 1021 1 1 6 ALA CA C 6.076 3.760 -3.635 1.00 . A A . 6 ALA CA 1 1 3 1022 1 1 6 ALA CB C 7.187 4.599 -4.275 1.00 . A A . 6 ALA CB 1 1 3 1023 1 1 6 ALA H H 5.156 5.551 -2.945 1.00 . A A . 6 ALA H 1 1 3 1024 1 1 6 ALA HA H 5.717 3.039 -4.351 1.00 . A A . 6 ALA HA 1 1 3 1025 1 1 6 ALA HB1 H 6.928 4.817 -5.301 1.00 . A A . 6 ALA HB1 1 1 3 1026 1 1 6 ALA HB2 H 8.116 4.048 -4.248 1.00 . A A . 6 ALA HB2 1 1 3 1027 1 1 6 ALA HB3 H 7.301 5.524 -3.729 1.00 . A A . 6 ALA HB3 1 1 3 1028 1 1 6 ALA N N 4.969 4.621 -3.222 1.00 . A A . 6 ALA N 1 1 3 1029 1 1 6 ALA O O 6.845 1.808 -2.438 1.00 . A A . 6 ALA O 1 1 3 1030 1 1 7 GLU C C 6.192 2.226 0.452 1.00 . A A . 7 GLU C 1 1 3 1031 1 1 7 GLU CA C 7.253 3.176 -0.089 1.00 . A A . 7 GLU CA 1 1 3 1032 1 1 7 GLU CB C 7.540 4.269 0.941 1.00 . A A . 7 GLU CB 1 1 3 1033 1 1 7 GLU CD C 8.432 6.606 0.836 1.00 . A A . 7 GLU CD 1 1 3 1034 1 1 7 GLU CG C 8.683 5.156 0.441 1.00 . A A . 7 GLU CG 1 1 3 1035 1 1 7 GLU H H 6.557 4.723 -1.366 1.00 . A A . 7 GLU H 1 1 3 1036 1 1 7 GLU HA H 8.160 2.623 -0.281 1.00 . A A . 7 GLU HA 1 1 3 1037 1 1 7 GLU HB2 H 6.652 4.870 1.084 1.00 . A A . 7 GLU HB2 1 1 3 1038 1 1 7 GLU HB3 H 7.823 3.816 1.879 1.00 . A A . 7 GLU HB3 1 1 3 1039 1 1 7 GLU HG2 H 9.613 4.823 0.879 1.00 . A A . 7 GLU HG2 1 1 3 1040 1 1 7 GLU HG3 H 8.751 5.088 -0.633 1.00 . A A . 7 GLU HG3 1 1 3 1041 1 1 7 GLU N N 6.779 3.766 -1.332 1.00 . A A . 7 GLU N 1 1 3 1042 1 1 7 GLU O O 6.503 1.155 0.958 1.00 . A A . 7 GLU O 1 1 3 1043 1 1 7 GLU OE1 O 7.636 7.250 0.173 1.00 . A A . 7 GLU OE1 1 1 3 1044 1 1 7 GLU OE2 O 9.038 7.046 1.797 1.00 . A A . 7 GLU OE2 1 1 3 1045 1 1 8 CYS C C 3.988 0.359 0.435 1.00 . A A . 8 CYS C 1 1 3 1046 1 1 8 CYS CA C 3.807 1.832 0.799 1.00 . A A . 8 CYS CA 1 1 3 1047 1 1 8 CYS CB C 2.493 2.368 0.226 1.00 . A A . 8 CYS CB 1 1 3 1048 1 1 8 CYS H H 4.755 3.510 -0.093 1.00 . A A . 8 CYS H 1 1 3 1049 1 1 8 CYS HA H 3.761 1.916 1.869 1.00 . A A . 8 CYS HA 1 1 3 1050 1 1 8 CYS HB2 H 2.696 3.207 -0.421 1.00 . A A . 8 CYS HB2 1 1 3 1051 1 1 8 CYS HB3 H 1.989 1.600 -0.330 1.00 . A A . 8 CYS HB3 1 1 3 1052 1 1 8 CYS N N 4.932 2.637 0.328 1.00 . A A . 8 CYS N 1 1 3 1053 1 1 8 CYS O O 4.081 -0.493 1.322 1.00 . A A . 8 CYS O 1 1 3 1054 1 1 8 CYS SG S 1.447 2.903 1.596 1.00 . A A . 8 CYS SG 1 1 3 1055 1 1 9 PRO C C 5.575 -1.916 -0.713 1.00 . A A . 9 PRO C 1 1 3 1056 1 1 9 PRO CA C 4.274 -1.368 -1.283 1.00 . A A . 9 PRO CA 1 1 3 1057 1 1 9 PRO CB C 4.325 -1.293 -2.815 1.00 . A A . 9 PRO CB 1 1 3 1058 1 1 9 PRO CD C 3.969 0.962 -1.971 1.00 . A A . 9 PRO CD 1 1 3 1059 1 1 9 PRO CG C 4.489 0.152 -3.159 1.00 . A A . 9 PRO CG 1 1 3 1060 1 1 9 PRO HA H 3.444 -1.983 -0.974 1.00 . A A . 9 PRO HA 1 1 3 1061 1 1 9 PRO HB2 H 5.166 -1.863 -3.187 1.00 . A A . 9 PRO HB2 1 1 3 1062 1 1 9 PRO HB3 H 3.406 -1.668 -3.236 1.00 . A A . 9 PRO HB3 1 1 3 1063 1 1 9 PRO HD2 H 4.586 1.832 -1.811 1.00 . A A . 9 PRO HD2 1 1 3 1064 1 1 9 PRO HD3 H 2.942 1.249 -2.132 1.00 . A A . 9 PRO HD3 1 1 3 1065 1 1 9 PRO HG2 H 5.533 0.371 -3.334 1.00 . A A . 9 PRO HG2 1 1 3 1066 1 1 9 PRO HG3 H 3.910 0.389 -4.039 1.00 . A A . 9 PRO HG3 1 1 3 1067 1 1 9 PRO N N 4.068 0.037 -0.836 1.00 . A A . 9 PRO N 1 1 3 1068 1 1 9 PRO O O 5.622 -3.041 -0.212 1.00 . A A . 9 PRO O 1 1 3 1069 1 1 10 MET C C 7.799 -1.750 1.276 1.00 . A A . 10 MET C 1 1 3 1070 1 1 10 MET CA C 7.919 -1.495 -0.227 1.00 . A A . 10 MET CA 1 1 3 1071 1 1 10 MET CB C 8.945 -0.392 -0.491 1.00 . A A . 10 MET CB 1 1 3 1072 1 1 10 MET CE C 11.531 0.840 -3.062 1.00 . A A . 10 MET CE 1 1 3 1073 1 1 10 MET CG C 9.407 -0.450 -1.950 1.00 . A A . 10 MET CG 1 1 3 1074 1 1 10 MET H H 6.522 -0.199 -1.160 1.00 . A A . 10 MET H 1 1 3 1075 1 1 10 MET HA H 8.242 -2.403 -0.712 1.00 . A A . 10 MET HA 1 1 3 1076 1 1 10 MET HB2 H 8.498 0.571 -0.293 1.00 . A A . 10 MET HB2 1 1 3 1077 1 1 10 MET HB3 H 9.796 -0.530 0.156 1.00 . A A . 10 MET HB3 1 1 3 1078 1 1 10 MET HE1 H 10.805 0.857 -3.864 1.00 . A A . 10 MET HE1 1 1 3 1079 1 1 10 MET HE2 H 12.527 0.764 -3.476 1.00 . A A . 10 MET HE2 1 1 3 1080 1 1 10 MET HE3 H 11.449 1.748 -2.487 1.00 . A A . 10 MET HE3 1 1 3 1081 1 1 10 MET HG2 H 8.966 -1.310 -2.436 1.00 . A A . 10 MET HG2 1 1 3 1082 1 1 10 MET HG3 H 9.098 0.448 -2.463 1.00 . A A . 10 MET HG3 1 1 3 1083 1 1 10 MET N N 6.625 -1.096 -0.767 1.00 . A A . 10 MET N 1 1 3 1084 1 1 10 MET O O 8.410 -2.671 1.816 1.00 . A A . 10 MET O 1 1 3 1085 1 1 10 MET SD S 11.212 -0.586 -1.995 1.00 . A A . 10 MET SD 1 1 3 1086 1 1 11 HIS C C 5.753 -2.155 3.668 1.00 . A A . 11 HIS C 1 1 3 1087 1 1 11 HIS CA C 6.768 -1.051 3.374 1.00 . A A . 11 HIS CA 1 1 3 1088 1 1 11 HIS CB C 6.262 0.282 3.936 1.00 . A A . 11 HIS CB 1 1 3 1089 1 1 11 HIS CD2 C 7.741 1.628 5.638 1.00 . A A . 11 HIS CD2 1 1 3 1090 1 1 11 HIS CE1 C 7.596 0.273 7.324 1.00 . A A . 11 HIS CE1 1 1 3 1091 1 1 11 HIS CG C 6.955 0.577 5.237 1.00 . A A . 11 HIS CG 1 1 3 1092 1 1 11 HIS H H 6.529 -0.214 1.438 1.00 . A A . 11 HIS H 1 1 3 1093 1 1 11 HIS HA H 7.704 -1.301 3.853 1.00 . A A . 11 HIS HA 1 1 3 1094 1 1 11 HIS HB2 H 6.474 1.073 3.233 1.00 . A A . 11 HIS HB2 1 1 3 1095 1 1 11 HIS HB3 H 5.197 0.225 4.103 1.00 . A A . 11 HIS HB3 1 1 3 1096 1 1 11 HIS HD2 H 8.005 2.476 5.022 1.00 . A A . 11 HIS HD2 1 1 3 1097 1 1 11 HIS HE1 H 7.713 -0.170 8.303 1.00 . A A . 11 HIS HE1 1 1 3 1098 1 1 11 HIS HE2 H 8.712 2.023 7.496 1.00 . A A . 11 HIS HE2 1 1 3 1099 1 1 11 HIS N N 6.992 -0.927 1.936 1.00 . A A . 11 HIS N 1 1 3 1100 1 1 11 HIS ND1 N 6.876 -0.275 6.328 1.00 . A A . 11 HIS ND1 1 1 3 1101 1 1 11 HIS NE2 N 8.145 1.434 6.955 1.00 . A A . 11 HIS NE2 1 1 3 1102 1 1 11 HIS O O 5.196 -2.229 4.768 1.00 . A A . 11 HIS O 1 1 3 1103 1 1 12 CYS C C 5.363 -5.381 3.279 1.00 . A A . 12 CYS C 1 1 3 1104 1 1 12 CYS CA C 4.594 -4.135 2.869 1.00 . A A . 12 CYS CA 1 1 3 1105 1 1 12 CYS CB C 3.800 -4.395 1.590 1.00 . A A . 12 CYS CB 1 1 3 1106 1 1 12 CYS H H 6.015 -2.935 1.842 1.00 . A A . 12 CYS H 1 1 3 1107 1 1 12 CYS HA H 3.903 -3.879 3.661 1.00 . A A . 12 CYS HA 1 1 3 1108 1 1 12 CYS HB2 H 3.844 -3.524 0.957 1.00 . A A . 12 CYS HB2 1 1 3 1109 1 1 12 CYS HB3 H 4.220 -5.244 1.072 1.00 . A A . 12 CYS HB3 1 1 3 1110 1 1 12 CYS N N 5.531 -3.029 2.692 1.00 . A A . 12 CYS N 1 1 3 1111 1 1 12 CYS O O 6.500 -5.590 2.860 1.00 . A A . 12 CYS O 1 1 3 1112 1 1 12 CYS SG S 2.075 -4.741 2.020 1.00 . A A . 12 CYS SG 1 1 3 1113 1 1 13 LYS C C 5.002 -8.635 3.934 1.00 . A A . 13 LYS C 1 1 3 1114 1 1 13 LYS CA C 5.419 -7.359 4.679 1.00 . A A . 13 LYS CA 1 1 3 1115 1 1 13 LYS CB C 5.098 -7.471 6.176 1.00 . A A . 13 LYS CB 1 1 3 1116 1 1 13 LYS CD C 5.354 -5.038 6.842 1.00 . A A . 13 LYS CD 1 1 3 1117 1 1 13 LYS CE C 6.409 -3.992 7.226 1.00 . A A . 13 LYS CE 1 1 3 1118 1 1 13 LYS CG C 5.947 -6.457 6.969 1.00 . A A . 13 LYS CG 1 1 3 1119 1 1 13 LYS H H 3.870 -5.925 4.479 1.00 . A A . 13 LYS H 1 1 3 1120 1 1 13 LYS HA H 6.486 -7.237 4.570 1.00 . A A . 13 LYS HA 1 1 3 1121 1 1 13 LYS HB2 H 4.049 -7.265 6.334 1.00 . A A . 13 LYS HB2 1 1 3 1122 1 1 13 LYS HB3 H 5.323 -8.470 6.519 1.00 . A A . 13 LYS HB3 1 1 3 1123 1 1 13 LYS HD2 H 5.037 -4.869 5.826 1.00 . A A . 13 LYS HD2 1 1 3 1124 1 1 13 LYS HD3 H 4.504 -4.945 7.501 1.00 . A A . 13 LYS HD3 1 1 3 1125 1 1 13 LYS HE2 H 6.617 -4.066 8.284 1.00 . A A . 13 LYS HE2 1 1 3 1126 1 1 13 LYS HE3 H 7.318 -4.177 6.669 1.00 . A A . 13 LYS HE3 1 1 3 1127 1 1 13 LYS HG2 H 5.960 -6.745 8.012 1.00 . A A . 13 LYS HG2 1 1 3 1128 1 1 13 LYS HG3 H 6.958 -6.459 6.588 1.00 . A A . 13 LYS HG3 1 1 3 1129 1 1 13 LYS HZ1 H 5.109 -2.383 7.540 1.00 . A A . 13 LYS HZ1 1 1 3 1130 1 1 13 LYS HZ2 H 5.571 -2.574 5.911 1.00 . A A . 13 LYS HZ2 1 1 3 1131 1 1 13 LYS HZ3 H 6.667 -1.919 7.047 1.00 . A A . 13 LYS HZ3 1 1 3 1132 1 1 13 LYS N N 4.760 -6.169 4.151 1.00 . A A . 13 LYS N 1 1 3 1133 1 1 13 LYS NZ N 5.902 -2.618 6.912 1.00 . A A . 13 LYS NZ 1 1 3 1134 1 1 13 LYS O O 3.842 -8.814 3.557 1.00 . A A . 13 LYS O 1 1 3 1135 1 1 14 GLY C C 4.478 -11.464 3.340 1.00 . A A . 14 GLY C 1 1 3 1136 1 1 14 GLY CA C 5.795 -10.771 2.994 1.00 . A A . 14 GLY CA 1 1 3 1137 1 1 14 GLY H H 6.890 -9.282 4.030 1.00 . A A . 14 GLY H 1 1 3 1138 1 1 14 GLY HA2 H 5.814 -10.575 1.933 1.00 . A A . 14 GLY HA2 1 1 3 1139 1 1 14 GLY HA3 H 6.610 -11.438 3.237 1.00 . A A . 14 GLY HA3 1 1 3 1140 1 1 14 GLY N N 5.991 -9.506 3.712 1.00 . A A . 14 GLY N 1 1 3 1141 1 1 14 GLY O O 4.057 -11.488 4.500 1.00 . A A . 14 GLY O 1 1 3 1142 1 1 15 LYS C C 1.393 -11.836 2.177 1.00 . A A . 15 LYS C 1 1 3 1143 1 1 15 LYS CA C 2.583 -12.765 2.405 1.00 . A A . 15 LYS CA 1 1 3 1144 1 1 15 LYS CB C 2.428 -13.461 3.766 1.00 . A A . 15 LYS CB 1 1 3 1145 1 1 15 LYS CD C 3.660 -14.801 5.478 1.00 . A A . 15 LYS CD 1 1 3 1146 1 1 15 LYS CE C 4.809 -14.046 6.148 1.00 . A A . 15 LYS CE 1 1 3 1147 1 1 15 LYS CG C 3.583 -14.427 3.994 1.00 . A A . 15 LYS CG 1 1 3 1148 1 1 15 LYS H H 4.282 -11.970 1.420 1.00 . A A . 15 LYS H 1 1 3 1149 1 1 15 LYS HA H 2.566 -13.523 1.634 1.00 . A A . 15 LYS HA 1 1 3 1150 1 1 15 LYS HB2 H 2.401 -12.727 4.554 1.00 . A A . 15 LYS HB2 1 1 3 1151 1 1 15 LYS HB3 H 1.513 -14.016 3.770 1.00 . A A . 15 LYS HB3 1 1 3 1152 1 1 15 LYS HD2 H 2.730 -14.541 5.964 1.00 . A A . 15 LYS HD2 1 1 3 1153 1 1 15 LYS HD3 H 3.829 -15.863 5.573 1.00 . A A . 15 LYS HD3 1 1 3 1154 1 1 15 LYS HE2 H 5.078 -14.546 7.068 1.00 . A A . 15 LYS HE2 1 1 3 1155 1 1 15 LYS HE3 H 5.663 -14.026 5.485 1.00 . A A . 15 LYS HE3 1 1 3 1156 1 1 15 LYS HG2 H 3.425 -15.321 3.406 1.00 . A A . 15 LYS HG2 1 1 3 1157 1 1 15 LYS HG3 H 4.494 -13.960 3.691 1.00 . A A . 15 LYS HG3 1 1 3 1158 1 1 15 LYS HZ1 H 5.112 -12.161 6.984 1.00 . A A . 15 LYS HZ1 1 1 3 1159 1 1 15 LYS HZ2 H 3.496 -12.674 7.002 1.00 . A A . 15 LYS HZ2 1 1 3 1160 1 1 15 LYS HZ3 H 4.198 -12.138 5.540 1.00 . A A . 15 LYS HZ3 1 1 3 1161 1 1 15 LYS N N 3.858 -12.035 2.301 1.00 . A A . 15 LYS N 1 1 3 1162 1 1 15 LYS NZ N 4.372 -12.653 6.445 1.00 . A A . 15 LYS NZ 1 1 3 1163 1 1 15 LYS O O 0.310 -12.288 1.810 1.00 . A A . 15 LYS O 1 1 3 1164 1 1 16 MET C C 1.093 -8.293 1.549 1.00 . A A . 16 MET C 1 1 3 1165 1 1 16 MET CA C 0.534 -9.562 2.180 1.00 . A A . 16 MET CA 1 1 3 1166 1 1 16 MET CB C -0.131 -9.221 3.520 1.00 . A A . 16 MET CB 1 1 3 1167 1 1 16 MET CE C -1.664 -10.798 6.670 1.00 . A A . 16 MET CE 1 1 3 1168 1 1 16 MET CG C -0.791 -10.471 4.111 1.00 . A A . 16 MET CG 1 1 3 1169 1 1 16 MET H H 2.489 -10.231 2.664 1.00 . A A . 16 MET H 1 1 3 1170 1 1 16 MET HA H -0.207 -9.984 1.521 1.00 . A A . 16 MET HA 1 1 3 1171 1 1 16 MET HB2 H 0.615 -8.850 4.207 1.00 . A A . 16 MET HB2 1 1 3 1172 1 1 16 MET HB3 H -0.884 -8.461 3.364 1.00 . A A . 16 MET HB3 1 1 3 1173 1 1 16 MET HE1 H -0.648 -10.507 6.897 1.00 . A A . 16 MET HE1 1 1 3 1174 1 1 16 MET HE2 H -1.720 -11.871 6.541 1.00 . A A . 16 MET HE2 1 1 3 1175 1 1 16 MET HE3 H -2.310 -10.505 7.481 1.00 . A A . 16 MET HE3 1 1 3 1176 1 1 16 MET HG2 H -1.141 -11.110 3.313 1.00 . A A . 16 MET HG2 1 1 3 1177 1 1 16 MET HG3 H -0.072 -11.007 4.710 1.00 . A A . 16 MET HG3 1 1 3 1178 1 1 16 MET N N 1.601 -10.540 2.380 1.00 . A A . 16 MET N 1 1 3 1179 1 1 16 MET O O 1.688 -7.465 2.237 1.00 . A A . 16 MET O 1 1 3 1180 1 1 16 MET SD S -2.194 -9.977 5.147 1.00 . A A . 16 MET SD 1 1 3 1181 1 1 17 ALA C C 0.460 -6.415 -1.489 1.00 . A A . 17 ALA C 1 1 3 1182 1 1 17 ALA CA C 1.431 -6.957 -0.445 1.00 . A A . 17 ALA CA 1 1 3 1183 1 1 17 ALA CB C 2.761 -7.271 -1.104 1.00 . A A . 17 ALA CB 1 1 3 1184 1 1 17 ALA H H 0.445 -8.833 -0.273 1.00 . A A . 17 ALA H 1 1 3 1185 1 1 17 ALA HA H 1.593 -6.187 0.292 1.00 . A A . 17 ALA HA 1 1 3 1186 1 1 17 ALA HB1 H 3.473 -7.557 -0.348 1.00 . A A . 17 ALA HB1 1 1 3 1187 1 1 17 ALA HB2 H 3.117 -6.392 -1.623 1.00 . A A . 17 ALA HB2 1 1 3 1188 1 1 17 ALA HB3 H 2.632 -8.078 -1.806 1.00 . A A . 17 ALA HB3 1 1 3 1189 1 1 17 ALA N N 0.915 -8.142 0.236 1.00 . A A . 17 ALA N 1 1 3 1190 1 1 17 ALA O O 0.247 -7.006 -2.554 1.00 . A A . 17 ALA O 1 1 3 1191 1 1 18 LYS C C -1.178 -3.112 -1.548 1.00 . A A . 18 LYS C 1 1 3 1192 1 1 18 LYS CA C -1.042 -4.564 -2.023 1.00 . A A . 18 LYS CA 1 1 3 1193 1 1 18 LYS CB C -2.413 -5.263 -2.076 1.00 . A A . 18 LYS CB 1 1 3 1194 1 1 18 LYS CD C -3.257 -7.535 -1.441 1.00 . A A . 18 LYS CD 1 1 3 1195 1 1 18 LYS CE C -2.193 -8.601 -1.725 1.00 . A A . 18 LYS CE 1 1 3 1196 1 1 18 LYS CG C -2.593 -6.252 -0.913 1.00 . A A . 18 LYS CG 1 1 3 1197 1 1 18 LYS H H 0.143 -4.873 -0.301 1.00 . A A . 18 LYS H 1 1 3 1198 1 1 18 LYS HA H -0.630 -4.552 -3.022 1.00 . A A . 18 LYS HA 1 1 3 1199 1 1 18 LYS HB2 H -3.190 -4.516 -2.024 1.00 . A A . 18 LYS HB2 1 1 3 1200 1 1 18 LYS HB3 H -2.497 -5.795 -3.012 1.00 . A A . 18 LYS HB3 1 1 3 1201 1 1 18 LYS HD2 H -3.950 -7.911 -0.704 1.00 . A A . 18 LYS HD2 1 1 3 1202 1 1 18 LYS HD3 H -3.792 -7.314 -2.352 1.00 . A A . 18 LYS HD3 1 1 3 1203 1 1 18 LYS HE2 H -1.441 -8.575 -0.948 1.00 . A A . 18 LYS HE2 1 1 3 1204 1 1 18 LYS HE3 H -2.658 -9.577 -1.738 1.00 . A A . 18 LYS HE3 1 1 3 1205 1 1 18 LYS HG2 H -1.638 -6.492 -0.476 1.00 . A A . 18 LYS HG2 1 1 3 1206 1 1 18 LYS HG3 H -3.224 -5.807 -0.161 1.00 . A A . 18 LYS HG3 1 1 3 1207 1 1 18 LYS HZ1 H -2.245 -7.890 -3.685 1.00 . A A . 18 LYS HZ1 1 1 3 1208 1 1 18 LYS HZ2 H -1.225 -9.227 -3.463 1.00 . A A . 18 LYS HZ2 1 1 3 1209 1 1 18 LYS HZ3 H -0.732 -7.684 -2.917 1.00 . A A . 18 LYS HZ3 1 1 3 1210 1 1 18 LYS N N -0.102 -5.271 -1.157 1.00 . A A . 18 LYS N 1 1 3 1211 1 1 18 LYS NZ N -1.555 -8.333 -3.049 1.00 . A A . 18 LYS NZ 1 1 3 1212 1 1 18 LYS O O -1.741 -2.846 -0.481 1.00 . A A . 18 LYS O 1 1 3 1213 1 1 19 PRO C C -1.961 -0.022 -2.292 1.00 . A A . 19 PRO C 1 1 3 1214 1 1 19 PRO CA C -0.657 -0.735 -1.932 1.00 . A A . 19 PRO CA 1 1 3 1215 1 1 19 PRO CB C 0.509 -0.169 -2.738 1.00 . A A . 19 PRO CB 1 1 3 1216 1 1 19 PRO CD C 0.056 -2.402 -3.579 1.00 . A A . 19 PRO CD 1 1 3 1217 1 1 19 PRO CG C 0.570 -1.012 -3.970 1.00 . A A . 19 PRO CG 1 1 3 1218 1 1 19 PRO HA H -0.451 -0.614 -0.882 1.00 . A A . 19 PRO HA 1 1 3 1219 1 1 19 PRO HB2 H 0.322 0.866 -2.995 1.00 . A A . 19 PRO HB2 1 1 3 1220 1 1 19 PRO HB3 H 1.429 -0.261 -2.183 1.00 . A A . 19 PRO HB3 1 1 3 1221 1 1 19 PRO HD2 H -0.634 -2.770 -4.327 1.00 . A A . 19 PRO HD2 1 1 3 1222 1 1 19 PRO HD3 H 0.879 -3.086 -3.448 1.00 . A A . 19 PRO HD3 1 1 3 1223 1 1 19 PRO HG2 H -0.058 -0.583 -4.741 1.00 . A A . 19 PRO HG2 1 1 3 1224 1 1 19 PRO HG3 H 1.587 -1.087 -4.319 1.00 . A A . 19 PRO HG3 1 1 3 1225 1 1 19 PRO N N -0.638 -2.181 -2.296 1.00 . A A . 19 PRO N 1 1 3 1226 1 1 19 PRO O O -2.535 -0.241 -3.361 1.00 . A A . 19 PRO O 1 1 3 1227 1 1 20 THR C C -3.303 3.104 -1.312 1.00 . A A . 20 THR C 1 1 3 1228 1 1 20 THR CA C -3.613 1.633 -1.577 1.00 . A A . 20 THR CA 1 1 3 1229 1 1 20 THR CB C -4.710 1.152 -0.622 1.00 . A A . 20 THR CB 1 1 3 1230 1 1 20 THR CG2 C -4.962 -0.338 -0.846 1.00 . A A . 20 THR CG2 1 1 3 1231 1 1 20 THR H H -1.878 0.973 -0.560 1.00 . A A . 20 THR H 1 1 3 1232 1 1 20 THR HA H -3.955 1.521 -2.594 1.00 . A A . 20 THR HA 1 1 3 1233 1 1 20 THR HB H -5.621 1.696 -0.811 1.00 . A A . 20 THR HB 1 1 3 1234 1 1 20 THR HG1 H -3.385 1.038 0.814 1.00 . A A . 20 THR HG1 1 1 3 1235 1 1 20 THR HG21 H -4.864 -0.566 -1.897 1.00 . A A . 20 THR HG21 1 1 3 1236 1 1 20 THR HG22 H -5.958 -0.588 -0.517 1.00 . A A . 20 THR HG22 1 1 3 1237 1 1 20 THR HG23 H -4.243 -0.913 -0.286 1.00 . A A . 20 THR HG23 1 1 3 1238 1 1 20 THR N N -2.397 0.847 -1.385 1.00 . A A . 20 THR N 1 1 3 1239 1 1 20 THR O O -2.853 3.463 -0.220 1.00 . A A . 20 THR O 1 1 3 1240 1 1 20 THR OG1 O -4.300 1.373 0.725 1.00 . A A . 20 THR OG1 1 1 3 1241 1 1 21 CYS C C -4.480 6.208 -2.496 1.00 . A A . 21 CYS C 1 1 3 1242 1 1 21 CYS CA C -3.237 5.375 -2.196 1.00 . A A . 21 CYS CA 1 1 3 1243 1 1 21 CYS CB C -2.105 5.765 -3.150 1.00 . A A . 21 CYS CB 1 1 3 1244 1 1 21 CYS H H -3.858 3.588 -3.184 1.00 . A A . 21 CYS H 1 1 3 1245 1 1 21 CYS HA H -2.921 5.581 -1.187 1.00 . A A . 21 CYS HA 1 1 3 1246 1 1 21 CYS HB2 H -2.017 5.021 -3.927 1.00 . A A . 21 CYS HB2 1 1 3 1247 1 1 21 CYS HB3 H -2.315 6.727 -3.593 1.00 . A A . 21 CYS HB3 1 1 3 1248 1 1 21 CYS N N -3.517 3.944 -2.320 1.00 . A A . 21 CYS N 1 1 3 1249 1 1 21 CYS O O -5.018 6.171 -3.602 1.00 . A A . 21 CYS O 1 1 3 1250 1 1 21 CYS SG S -0.555 5.853 -2.216 1.00 . A A . 21 CYS SG 1 1 3 1251 1 1 22 GLU C C -5.807 9.119 -0.892 1.00 . A A . 22 GLU C 1 1 3 1252 1 1 22 GLU CA C -6.068 7.822 -1.640 1.00 . A A . 22 GLU CA 1 1 3 1253 1 1 22 GLU CB C -7.322 7.124 -1.099 1.00 . A A . 22 GLU CB 1 1 3 1254 1 1 22 GLU CD C -7.340 4.949 0.150 1.00 . A A . 22 GLU CD 1 1 3 1255 1 1 22 GLU CG C -7.010 6.434 0.236 1.00 . A A . 22 GLU CG 1 1 3 1256 1 1 22 GLU H H -4.441 6.979 -0.658 1.00 . A A . 22 GLU H 1 1 3 1257 1 1 22 GLU HA H -6.216 8.047 -2.687 1.00 . A A . 22 GLU HA 1 1 3 1258 1 1 22 GLU HB2 H -8.105 7.853 -0.952 1.00 . A A . 22 GLU HB2 1 1 3 1259 1 1 22 GLU HB3 H -7.653 6.384 -1.813 1.00 . A A . 22 GLU HB3 1 1 3 1260 1 1 22 GLU HG2 H -5.963 6.554 0.471 1.00 . A A . 22 GLU HG2 1 1 3 1261 1 1 22 GLU HG3 H -7.603 6.883 1.018 1.00 . A A . 22 GLU HG3 1 1 3 1262 1 1 22 GLU N N -4.916 6.972 -1.503 1.00 . A A . 22 GLU N 1 1 3 1263 1 1 22 GLU O O -5.260 9.122 0.210 1.00 . A A . 22 GLU O 1 1 3 1264 1 1 22 GLU OE1 O -6.515 4.202 -0.358 1.00 . A A . 22 GLU OE1 1 1 3 1265 1 1 22 GLU OE2 O -8.400 4.571 0.611 1.00 . A A . 22 GLU OE2 1 1 3 1266 1 1 23 ASN C C -4.591 11.671 -0.316 1.00 . A A . 23 ASN C 1 1 3 1267 1 1 23 ASN CA C -5.973 11.548 -0.957 1.00 . A A . 23 ASN CA 1 1 3 1268 1 1 23 ASN CB C -7.067 11.875 0.072 1.00 . A A . 23 ASN CB 1 1 3 1269 1 1 23 ASN CG C -7.406 10.657 0.923 1.00 . A A . 23 ASN CG 1 1 3 1270 1 1 23 ASN H H -6.563 10.109 -2.402 1.00 . A A . 23 ASN H 1 1 3 1271 1 1 23 ASN HA H -6.037 12.268 -1.761 1.00 . A A . 23 ASN HA 1 1 3 1272 1 1 23 ASN HB2 H -6.725 12.672 0.715 1.00 . A A . 23 ASN HB2 1 1 3 1273 1 1 23 ASN HB3 H -7.951 12.200 -0.450 1.00 . A A . 23 ASN HB3 1 1 3 1274 1 1 23 ASN HD21 H -8.537 9.817 -0.466 1.00 . A A . 23 ASN HD21 1 1 3 1275 1 1 23 ASN HD22 H -8.391 8.944 0.981 1.00 . A A . 23 ASN HD22 1 1 3 1276 1 1 23 ASN N N -6.172 10.208 -1.523 1.00 . A A . 23 ASN N 1 1 3 1277 1 1 23 ASN ND2 N -8.176 9.730 0.439 1.00 . A A . 23 ASN ND2 1 1 3 1278 1 1 23 ASN O O -4.448 12.183 0.794 1.00 . A A . 23 ASN O 1 1 3 1279 1 1 23 ASN OD1 O -6.973 10.557 2.067 1.00 . A A . 23 ASN OD1 1 1 3 1280 1 1 24 GLU C C -1.952 10.306 0.599 1.00 . A A . 24 GLU C 1 1 3 1281 1 1 24 GLU CA C -2.197 11.252 -0.578 1.00 . A A . 24 GLU CA 1 1 3 1282 1 1 24 GLU CB C -1.812 12.689 -0.198 1.00 . A A . 24 GLU CB 1 1 3 1283 1 1 24 GLU CD C -1.085 12.992 -2.584 1.00 . A A . 24 GLU CD 1 1 3 1284 1 1 24 GLU CG C -1.898 13.589 -1.440 1.00 . A A . 24 GLU CG 1 1 3 1285 1 1 24 GLU H H -3.774 10.812 -1.920 1.00 . A A . 24 GLU H 1 1 3 1286 1 1 24 GLU HA H -1.564 10.940 -1.392 1.00 . A A . 24 GLU HA 1 1 3 1287 1 1 24 GLU HB2 H -2.485 13.057 0.563 1.00 . A A . 24 GLU HB2 1 1 3 1288 1 1 24 GLU HB3 H -0.801 12.703 0.182 1.00 . A A . 24 GLU HB3 1 1 3 1289 1 1 24 GLU HG2 H -2.929 13.678 -1.746 1.00 . A A . 24 GLU HG2 1 1 3 1290 1 1 24 GLU HG3 H -1.510 14.568 -1.201 1.00 . A A . 24 GLU HG3 1 1 3 1291 1 1 24 GLU N N -3.582 11.199 -1.042 1.00 . A A . 24 GLU N 1 1 3 1292 1 1 24 GLU O O -0.851 10.263 1.150 1.00 . A A . 24 GLU O 1 1 3 1293 1 1 24 GLU OE1 O 0.126 13.139 -2.570 1.00 . A A . 24 GLU OE1 1 1 3 1294 1 1 24 GLU OE2 O -1.682 12.392 -3.464 1.00 . A A . 24 GLU OE2 1 1 3 1295 1 1 25 VAL C C -2.564 7.184 1.506 1.00 . A A . 25 VAL C 1 1 3 1296 1 1 25 VAL CA C -2.827 8.579 2.070 1.00 . A A . 25 VAL CA 1 1 3 1297 1 1 25 VAL CB C -4.099 8.569 2.930 1.00 . A A . 25 VAL CB 1 1 3 1298 1 1 25 VAL CG1 C -3.970 7.525 4.043 1.00 . A A . 25 VAL CG1 1 1 3 1299 1 1 25 VAL CG2 C -4.298 9.949 3.560 1.00 . A A . 25 VAL CG2 1 1 3 1300 1 1 25 VAL H H -3.829 9.589 0.491 1.00 . A A . 25 VAL H 1 1 3 1301 1 1 25 VAL HA H -1.989 8.872 2.686 1.00 . A A . 25 VAL HA 1 1 3 1302 1 1 25 VAL HB H -4.952 8.329 2.309 1.00 . A A . 25 VAL HB 1 1 3 1303 1 1 25 VAL HG11 H -3.508 6.632 3.653 1.00 . A A . 25 VAL HG11 1 1 3 1304 1 1 25 VAL HG12 H -4.951 7.284 4.425 1.00 . A A . 25 VAL HG12 1 1 3 1305 1 1 25 VAL HG13 H -3.363 7.924 4.842 1.00 . A A . 25 VAL HG13 1 1 3 1306 1 1 25 VAL HG21 H -5.151 9.923 4.223 1.00 . A A . 25 VAL HG21 1 1 3 1307 1 1 25 VAL HG22 H -4.469 10.680 2.784 1.00 . A A . 25 VAL HG22 1 1 3 1308 1 1 25 VAL HG23 H -3.416 10.221 4.121 1.00 . A A . 25 VAL HG23 1 1 3 1309 1 1 25 VAL N N -2.969 9.531 0.971 1.00 . A A . 25 VAL N 1 1 3 1310 1 1 25 VAL O O -3.466 6.543 0.961 1.00 . A A . 25 VAL O 1 1 3 1311 1 1 26 CYS C C -0.929 4.358 2.189 1.00 . A A . 26 CYS C 1 1 3 1312 1 1 26 CYS CA C -0.933 5.424 1.095 1.00 . A A . 26 CYS CA 1 1 3 1313 1 1 26 CYS CB C 0.459 5.504 0.465 1.00 . A A . 26 CYS CB 1 1 3 1314 1 1 26 CYS H H -0.637 7.294 2.039 1.00 . A A . 26 CYS H 1 1 3 1315 1 1 26 CYS HA H -1.636 5.137 0.333 1.00 . A A . 26 CYS HA 1 1 3 1316 1 1 26 CYS HB2 H 0.480 4.894 -0.418 1.00 . A A . 26 CYS HB2 1 1 3 1317 1 1 26 CYS HB3 H 0.681 6.521 0.199 1.00 . A A . 26 CYS HB3 1 1 3 1318 1 1 26 CYS N N -1.316 6.732 1.615 1.00 . A A . 26 CYS N 1 1 3 1319 1 1 26 CYS O O -0.353 4.547 3.259 1.00 . A A . 26 CYS O 1 1 3 1320 1 1 26 CYS SG S 1.700 4.902 1.634 1.00 . A A . 26 CYS SG 1 1 3 1321 1 1 27 LYS C C -1.579 0.779 2.121 1.00 . A A . 27 LYS C 1 1 3 1322 1 1 27 LYS CA C -1.622 2.118 2.859 1.00 . A A . 27 LYS CA 1 1 3 1323 1 1 27 LYS CB C -2.906 2.161 3.705 1.00 . A A . 27 LYS CB 1 1 3 1324 1 1 27 LYS CD C -4.757 3.842 3.629 1.00 . A A . 27 LYS CD 1 1 3 1325 1 1 27 LYS CE C -4.814 4.162 2.135 1.00 . A A . 27 LYS CE 1 1 3 1326 1 1 27 LYS CG C -3.303 3.602 4.050 1.00 . A A . 27 LYS CG 1 1 3 1327 1 1 27 LYS H H -2.011 3.133 1.026 1.00 . A A . 27 LYS H 1 1 3 1328 1 1 27 LYS HA H -0.768 2.186 3.517 1.00 . A A . 27 LYS HA 1 1 3 1329 1 1 27 LYS HB2 H -3.710 1.694 3.153 1.00 . A A . 27 LYS HB2 1 1 3 1330 1 1 27 LYS HB3 H -2.743 1.610 4.621 1.00 . A A . 27 LYS HB3 1 1 3 1331 1 1 27 LYS HD2 H -5.341 2.956 3.832 1.00 . A A . 27 LYS HD2 1 1 3 1332 1 1 27 LYS HD3 H -5.160 4.672 4.188 1.00 . A A . 27 LYS HD3 1 1 3 1333 1 1 27 LYS HE2 H -5.310 5.112 1.991 1.00 . A A . 27 LYS HE2 1 1 3 1334 1 1 27 LYS HE3 H -3.812 4.219 1.736 1.00 . A A . 27 LYS HE3 1 1 3 1335 1 1 27 LYS HG2 H -3.208 3.753 5.116 1.00 . A A . 27 LYS HG2 1 1 3 1336 1 1 27 LYS HG3 H -2.663 4.295 3.535 1.00 . A A . 27 LYS HG3 1 1 3 1337 1 1 27 LYS HZ1 H -4.927 2.295 1.169 1.00 . A A . 27 LYS HZ1 1 1 3 1338 1 1 27 LYS HZ2 H -5.991 3.497 0.535 1.00 . A A . 27 LYS HZ2 1 1 3 1339 1 1 27 LYS HZ3 H -6.337 2.743 2.035 1.00 . A A . 27 LYS HZ3 1 1 3 1340 1 1 27 LYS N N -1.570 3.228 1.903 1.00 . A A . 27 LYS N 1 1 3 1341 1 1 27 LYS NZ N -5.574 3.093 1.425 1.00 . A A . 27 LYS NZ 1 1 3 1342 1 1 27 LYS O O -2.135 0.646 1.028 1.00 . A A . 27 LYS O 1 1 3 1343 1 1 28 CYS C C -2.093 -2.356 2.626 1.00 . A A . 28 CYS C 1 1 3 1344 1 1 28 CYS CA C -0.890 -1.554 2.136 1.00 . A A . 28 CYS CA 1 1 3 1345 1 1 28 CYS CB C 0.416 -2.259 2.533 1.00 . A A . 28 CYS CB 1 1 3 1346 1 1 28 CYS H H -0.553 -0.069 3.614 1.00 . A A . 28 CYS H 1 1 3 1347 1 1 28 CYS HA H -0.936 -1.465 1.062 1.00 . A A . 28 CYS HA 1 1 3 1348 1 1 28 CYS HB2 H 1.159 -1.517 2.789 1.00 . A A . 28 CYS HB2 1 1 3 1349 1 1 28 CYS HB3 H 0.239 -2.898 3.385 1.00 . A A . 28 CYS HB3 1 1 3 1350 1 1 28 CYS N N -0.953 -0.221 2.734 1.00 . A A . 28 CYS N 1 1 3 1351 1 1 28 CYS O O -2.042 -2.976 3.688 1.00 . A A . 28 CYS O 1 1 3 1352 1 1 28 CYS SG S 1.018 -3.256 1.144 1.00 . A A . 28 CYS SG 1 1 3 1353 1 1 29 ASN C C -4.715 -4.207 1.407 1.00 . A A . 29 ASN C 1 1 3 1354 1 1 29 ASN CA C -4.414 -2.987 2.272 1.00 . A A . 29 ASN CA 1 1 3 1355 1 1 29 ASN CB C -5.593 -2.016 2.196 1.00 . A A . 29 ASN CB 1 1 3 1356 1 1 29 ASN CG C -6.858 -2.698 2.700 1.00 . A A . 29 ASN CG 1 1 3 1357 1 1 29 ASN H H -3.177 -1.767 1.048 1.00 . A A . 29 ASN H 1 1 3 1358 1 1 29 ASN HA H -4.309 -3.307 3.294 1.00 . A A . 29 ASN HA 1 1 3 1359 1 1 29 ASN HB2 H -5.386 -1.150 2.806 1.00 . A A . 29 ASN HB2 1 1 3 1360 1 1 29 ASN HB3 H -5.739 -1.708 1.173 1.00 . A A . 29 ASN HB3 1 1 3 1361 1 1 29 ASN HD21 H -8.052 -1.753 1.435 1.00 . A A . 29 ASN HD21 1 1 3 1362 1 1 29 ASN HD22 H -8.818 -2.846 2.482 1.00 . A A . 29 ASN HD22 1 1 3 1363 1 1 29 ASN N N -3.187 -2.301 1.871 1.00 . A A . 29 ASN N 1 1 3 1364 1 1 29 ASN ND2 N -8.004 -2.407 2.161 1.00 . A A . 29 ASN ND2 1 1 3 1365 1 1 29 ASN O O -4.659 -4.145 0.179 1.00 . A A . 29 ASN O 1 1 3 1366 1 1 29 ASN OD1 O -6.799 -3.519 3.612 1.00 . A A . 29 ASN OD1 1 1 3 1367 1 1 30 ILE C C -6.861 -6.456 0.848 1.00 . A A . 30 ILE C 1 1 3 1368 1 1 30 ILE CA C -5.432 -6.531 1.362 1.00 . A A . 30 ILE CA 1 1 3 1369 1 1 30 ILE CB C -5.251 -7.765 2.262 1.00 . A A . 30 ILE CB 1 1 3 1370 1 1 30 ILE CD1 C -3.752 -6.740 3.959 1.00 . A A . 30 ILE CD1 1 1 3 1371 1 1 30 ILE CG1 C -5.143 -7.331 3.723 1.00 . A A . 30 ILE CG1 1 1 3 1372 1 1 30 ILE CG2 C -3.984 -8.529 1.858 1.00 . A A . 30 ILE CG2 1 1 3 1373 1 1 30 ILE H H -5.133 -5.274 3.041 1.00 . A A . 30 ILE H 1 1 3 1374 1 1 30 ILE HA H -4.779 -6.633 0.511 1.00 . A A . 30 ILE HA 1 1 3 1375 1 1 30 ILE HB H -6.106 -8.417 2.146 1.00 . A A . 30 ILE HB 1 1 3 1376 1 1 30 ILE HD11 H -3.101 -7.506 4.351 1.00 . A A . 30 ILE HD11 1 1 3 1377 1 1 30 ILE HD12 H -3.820 -5.925 4.660 1.00 . A A . 30 ILE HD12 1 1 3 1378 1 1 30 ILE HD13 H -3.352 -6.377 3.021 1.00 . A A . 30 ILE HD13 1 1 3 1379 1 1 30 ILE HG12 H -5.899 -6.589 3.940 1.00 . A A . 30 ILE HG12 1 1 3 1380 1 1 30 ILE HG13 H -5.281 -8.187 4.366 1.00 . A A . 30 ILE HG13 1 1 3 1381 1 1 30 ILE HG21 H -3.196 -7.826 1.626 1.00 . A A . 30 ILE HG21 1 1 3 1382 1 1 30 ILE HG22 H -4.190 -9.138 0.991 1.00 . A A . 30 ILE HG22 1 1 3 1383 1 1 30 ILE HG23 H -3.670 -9.163 2.675 1.00 . A A . 30 ILE HG23 1 1 3 1384 1 1 30 ILE N N -5.077 -5.301 2.064 1.00 . A A . 30 ILE N 1 1 3 1385 1 1 30 ILE O O -7.771 -6.005 1.544 1.00 . A A . 30 ILE O 1 1 3 1386 1 1 31 GLY C C -8.382 -5.822 -2.134 1.00 . A A . 31 GLY C 1 1 3 1387 1 1 31 GLY CA C -8.337 -6.882 -1.038 1.00 . A A . 31 GLY CA 1 1 3 1388 1 1 31 GLY H H -6.255 -7.231 -0.871 1.00 . A A . 31 GLY H 1 1 3 1389 1 1 31 GLY HA2 H -8.532 -7.853 -1.470 1.00 . A A . 31 GLY HA2 1 1 3 1390 1 1 31 GLY HA3 H -9.096 -6.660 -0.306 1.00 . A A . 31 GLY HA3 1 1 3 1391 1 1 31 GLY N N -7.032 -6.895 -0.385 1.00 . A A . 31 GLY N 1 1 3 1392 1 1 31 GLY O O -9.185 -5.908 -3.059 1.00 . A A . 31 GLY O 1 1 3 1393 1 1 32 LYS C C -5.982 -3.382 -3.307 1.00 . A A . 32 LYS C 1 1 3 1394 1 1 32 LYS CA C -7.432 -3.771 -3.032 1.00 . A A . 32 LYS CA 1 1 3 1395 1 1 32 LYS CB C -8.214 -2.539 -2.562 1.00 . A A . 32 LYS CB 1 1 3 1396 1 1 32 LYS CD C -7.615 -0.755 -4.235 1.00 . A A . 32 LYS CD 1 1 3 1397 1 1 32 LYS CE C -7.933 -0.245 -5.644 1.00 . A A . 32 LYS CE 1 1 3 1398 1 1 32 LYS CG C -8.705 -1.741 -3.780 1.00 . A A . 32 LYS CG 1 1 3 1399 1 1 32 LYS H H -6.874 -4.826 -1.279 1.00 . A A . 32 LYS H 1 1 3 1400 1 1 32 LYS HA H -7.871 -4.132 -3.948 1.00 . A A . 32 LYS HA 1 1 3 1401 1 1 32 LYS HB2 H -9.064 -2.857 -1.975 1.00 . A A . 32 LYS HB2 1 1 3 1402 1 1 32 LYS HB3 H -7.575 -1.913 -1.957 1.00 . A A . 32 LYS HB3 1 1 3 1403 1 1 32 LYS HD2 H -7.581 0.080 -3.552 1.00 . A A . 32 LYS HD2 1 1 3 1404 1 1 32 LYS HD3 H -6.659 -1.251 -4.242 1.00 . A A . 32 LYS HD3 1 1 3 1405 1 1 32 LYS HE2 H -8.494 -0.995 -6.182 1.00 . A A . 32 LYS HE2 1 1 3 1406 1 1 32 LYS HE3 H -8.520 0.660 -5.572 1.00 . A A . 32 LYS HE3 1 1 3 1407 1 1 32 LYS HG2 H -8.937 -2.421 -4.587 1.00 . A A . 32 LYS HG2 1 1 3 1408 1 1 32 LYS HG3 H -9.595 -1.188 -3.512 1.00 . A A . 32 LYS HG3 1 1 3 1409 1 1 32 LYS HZ1 H -6.869 0.545 -7.255 1.00 . A A . 32 LYS HZ1 1 1 3 1410 1 1 32 LYS HZ2 H -6.158 -0.853 -6.587 1.00 . A A . 32 LYS HZ2 1 1 3 1411 1 1 32 LYS HZ3 H -6.033 0.659 -5.760 1.00 . A A . 32 LYS HZ3 1 1 3 1412 1 1 32 LYS N N -7.499 -4.835 -2.032 1.00 . A A . 32 LYS N 1 1 3 1413 1 1 32 LYS NZ N -6.659 0.044 -6.369 1.00 . A A . 32 LYS NZ 1 1 3 1414 1 1 32 LYS O O -5.205 -3.149 -2.384 1.00 . A A . 32 LYS O 1 1 3 1415 1 1 33 LYS C C -4.318 -1.761 -5.965 1.00 . A A . 33 LYS C 1 1 3 1416 1 1 33 LYS CA C -4.279 -2.923 -4.975 1.00 . A A . 33 LYS CA 1 1 3 1417 1 1 33 LYS CB C -3.561 -4.127 -5.607 1.00 . A A . 33 LYS CB 1 1 3 1418 1 1 33 LYS CD C -3.196 -4.415 -8.088 1.00 . A A . 33 LYS CD 1 1 3 1419 1 1 33 LYS CE C -2.686 -2.976 -8.255 1.00 . A A . 33 LYS CE 1 1 3 1420 1 1 33 LYS CG C -4.222 -4.499 -6.946 1.00 . A A . 33 LYS CG 1 1 3 1421 1 1 33 LYS H H -6.298 -3.489 -5.275 1.00 . A A . 33 LYS H 1 1 3 1422 1 1 33 LYS HA H -3.731 -2.613 -4.096 1.00 . A A . 33 LYS HA 1 1 3 1423 1 1 33 LYS HB2 H -2.523 -3.881 -5.771 1.00 . A A . 33 LYS HB2 1 1 3 1424 1 1 33 LYS HB3 H -3.624 -4.970 -4.934 1.00 . A A . 33 LYS HB3 1 1 3 1425 1 1 33 LYS HD2 H -2.362 -5.064 -7.866 1.00 . A A . 33 LYS HD2 1 1 3 1426 1 1 33 LYS HD3 H -3.661 -4.735 -9.009 1.00 . A A . 33 LYS HD3 1 1 3 1427 1 1 33 LYS HE2 H -2.336 -2.602 -7.305 1.00 . A A . 33 LYS HE2 1 1 3 1428 1 1 33 LYS HE3 H -1.869 -2.967 -8.964 1.00 . A A . 33 LYS HE3 1 1 3 1429 1 1 33 LYS HG2 H -4.601 -5.509 -6.884 1.00 . A A . 33 LYS HG2 1 1 3 1430 1 1 33 LYS HG3 H -5.040 -3.827 -7.148 1.00 . A A . 33 LYS HG3 1 1 3 1431 1 1 33 LYS HZ1 H -4.194 -2.509 -9.621 1.00 . A A . 33 LYS HZ1 1 1 3 1432 1 1 33 LYS HZ2 H -3.390 -1.138 -8.977 1.00 . A A . 33 LYS HZ2 1 1 3 1433 1 1 33 LYS HZ3 H -4.531 -2.012 -8.021 1.00 . A A . 33 LYS HZ3 1 1 3 1434 1 1 33 LYS N N -5.632 -3.300 -4.583 1.00 . A A . 33 LYS N 1 1 3 1435 1 1 33 LYS NZ N -3.786 -2.102 -8.759 1.00 . A A . 33 LYS NZ 1 1 3 1436 1 1 33 LYS O O -5.171 -1.723 -6.866 1.00 . A A . 33 LYS O 1 1 3 1437 1 1 34 ASP C C -2.339 0.078 -7.822 1.00 . A A . 34 ASP C 1 1 3 1438 1 1 34 ASP CA C -3.359 0.327 -6.711 1.00 . A A . 34 ASP CA 1 1 3 1439 1 1 34 ASP CB C -3.007 1.590 -5.924 1.00 . A A . 34 ASP CB 1 1 3 1440 1 1 34 ASP CG C -4.212 2.067 -5.116 1.00 . A A . 34 ASP CG 1 1 3 1441 1 1 34 ASP H H -2.753 -0.882 -5.077 1.00 . A A . 34 ASP H 1 1 3 1442 1 1 34 ASP HA H -4.331 0.458 -7.162 1.00 . A A . 34 ASP HA 1 1 3 1443 1 1 34 ASP HB2 H -2.189 1.377 -5.252 1.00 . A A . 34 ASP HB2 1 1 3 1444 1 1 34 ASP HB3 H -2.710 2.368 -6.611 1.00 . A A . 34 ASP HB3 1 1 3 1445 1 1 34 ASP N N -3.406 -0.816 -5.809 1.00 . A A . 34 ASP N 1 1 3 1446 1 1 34 ASP O O -2.757 -0.018 -8.969 1.00 . A A . 34 ASP O 1 1 3 1447 1 1 34 ASP OXT O -1.166 -0.048 -7.513 1.00 . A A . 34 ASP OXT 1 1 3 1448 1 1 34 ASP OD1 O -5.248 1.416 -5.171 1.00 . A A . 34 ASP OD1 1 1 3 1449 1 1 34 ASP OD2 O -4.083 3.076 -4.449 1.00 . A A . 34 ASP OD2 1 1 4 1450 1 1 1 GLY C C 10.768 9.233 0.114 1.00 . A A . 1 GLY C 1 1 4 1451 1 1 1 GLY CA C 11.380 8.688 1.402 1.00 . A A . 1 GLY CA 1 1 4 1452 1 1 1 GLY H1 H 9.602 7.691 1.912 1.00 . A A . 1 GLY H1 1 1 4 1453 1 1 1 GLY H2 H 9.809 9.204 2.678 1.00 . A A . 1 GLY H2 1 1 4 1454 1 1 1 GLY H3 H 10.708 7.858 3.197 1.00 . A A . 1 GLY H3 1 1 4 1455 1 1 1 GLY HA2 H 12.023 9.438 1.840 1.00 . A A . 1 GLY HA2 1 1 4 1456 1 1 1 GLY HA3 H 11.961 7.805 1.175 1.00 . A A . 1 GLY HA3 1 1 4 1457 1 1 1 GLY N N 10.295 8.337 2.371 1.00 . A A . 1 GLY N 1 1 4 1458 1 1 1 GLY O O 10.737 10.443 -0.101 1.00 . A A . 1 GLY O 1 1 4 1459 1 1 2 SER C C 8.157 8.927 -1.826 1.00 . A A . 2 SER C 1 1 4 1460 1 1 2 SER CA C 9.662 8.723 -2.000 1.00 . A A . 2 SER CA 1 1 4 1461 1 1 2 SER CB C 9.911 7.643 -3.058 1.00 . A A . 2 SER CB 1 1 4 1462 1 1 2 SER H H 10.333 7.368 -0.494 1.00 . A A . 2 SER H 1 1 4 1463 1 1 2 SER HA H 10.101 9.648 -2.338 1.00 . A A . 2 SER HA 1 1 4 1464 1 1 2 SER HB2 H 10.960 7.613 -3.305 1.00 . A A . 2 SER HB2 1 1 4 1465 1 1 2 SER HB3 H 9.608 6.680 -2.665 1.00 . A A . 2 SER HB3 1 1 4 1466 1 1 2 SER HG H 9.654 7.640 -4.996 1.00 . A A . 2 SER HG 1 1 4 1467 1 1 2 SER N N 10.280 8.330 -0.732 1.00 . A A . 2 SER N 1 1 4 1468 1 1 2 SER O O 7.685 9.265 -0.740 1.00 . A A . 2 SER O 1 1 4 1469 1 1 2 SER OG O 9.157 7.951 -4.231 1.00 . A A . 2 SER OG 1 1 4 1470 1 1 3 VAL C C 5.316 7.690 -2.149 1.00 . A A . 3 VAL C 1 1 4 1471 1 1 3 VAL CA C 5.963 8.870 -2.867 1.00 . A A . 3 VAL CA 1 1 4 1472 1 1 3 VAL CB C 5.398 8.988 -4.284 1.00 . A A . 3 VAL CB 1 1 4 1473 1 1 3 VAL CG1 C 5.484 10.445 -4.744 1.00 . A A . 3 VAL CG1 1 1 4 1474 1 1 3 VAL CG2 C 6.204 8.108 -5.244 1.00 . A A . 3 VAL CG2 1 1 4 1475 1 1 3 VAL H H 7.854 8.440 -3.744 1.00 . A A . 3 VAL H 1 1 4 1476 1 1 3 VAL HA H 5.726 9.775 -2.325 1.00 . A A . 3 VAL HA 1 1 4 1477 1 1 3 VAL HB H 4.366 8.673 -4.279 1.00 . A A . 3 VAL HB 1 1 4 1478 1 1 3 VAL HG11 H 6.495 10.805 -4.613 1.00 . A A . 3 VAL HG11 1 1 4 1479 1 1 3 VAL HG12 H 4.808 11.050 -4.158 1.00 . A A . 3 VAL HG12 1 1 4 1480 1 1 3 VAL HG13 H 5.213 10.510 -5.787 1.00 . A A . 3 VAL HG13 1 1 4 1481 1 1 3 VAL HG21 H 6.614 7.266 -4.706 1.00 . A A . 3 VAL HG21 1 1 4 1482 1 1 3 VAL HG22 H 7.010 8.689 -5.674 1.00 . A A . 3 VAL HG22 1 1 4 1483 1 1 3 VAL HG23 H 5.558 7.750 -6.032 1.00 . A A . 3 VAL HG23 1 1 4 1484 1 1 3 VAL N N 7.412 8.714 -2.905 1.00 . A A . 3 VAL N 1 1 4 1485 1 1 3 VAL O O 5.389 6.545 -2.604 1.00 . A A . 3 VAL O 1 1 4 1486 1 1 4 GLY C C 3.553 5.768 -0.992 1.00 . A A . 4 GLY C 1 1 4 1487 1 1 4 GLY CA C 4.028 6.979 -0.189 1.00 . A A . 4 GLY CA 1 1 4 1488 1 1 4 GLY H H 4.684 8.922 -0.722 1.00 . A A . 4 GLY H 1 1 4 1489 1 1 4 GLY HA2 H 4.721 6.641 0.568 1.00 . A A . 4 GLY HA2 1 1 4 1490 1 1 4 GLY HA3 H 3.175 7.430 0.296 1.00 . A A . 4 GLY HA3 1 1 4 1491 1 1 4 GLY N N 4.691 7.989 -1.017 1.00 . A A . 4 GLY N 1 1 4 1492 1 1 4 GLY O O 3.901 4.638 -0.670 1.00 . A A . 4 GLY O 1 1 4 1493 1 1 5 CYS C C 3.306 3.962 -3.312 1.00 . A A . 5 CYS C 1 1 4 1494 1 1 5 CYS CA C 2.210 4.915 -2.840 1.00 . A A . 5 CYS CA 1 1 4 1495 1 1 5 CYS CB C 1.471 5.483 -4.055 1.00 . A A . 5 CYS CB 1 1 4 1496 1 1 5 CYS H H 2.488 6.923 -2.228 1.00 . A A . 5 CYS H 1 1 4 1497 1 1 5 CYS HA H 1.512 4.353 -2.237 1.00 . A A . 5 CYS HA 1 1 4 1498 1 1 5 CYS HB2 H 2.185 5.910 -4.744 1.00 . A A . 5 CYS HB2 1 1 4 1499 1 1 5 CYS HB3 H 0.934 4.691 -4.544 1.00 . A A . 5 CYS HB3 1 1 4 1500 1 1 5 CYS N N 2.745 6.005 -2.022 1.00 . A A . 5 CYS N 1 1 4 1501 1 1 5 CYS O O 3.036 2.795 -3.584 1.00 . A A . 5 CYS O 1 1 4 1502 1 1 5 CYS SG S 0.306 6.768 -3.525 1.00 . A A . 5 CYS SG 1 1 4 1503 1 1 6 ALA C C 6.265 2.929 -2.598 1.00 . A A . 6 ALA C 1 1 4 1504 1 1 6 ALA CA C 5.654 3.616 -3.818 1.00 . A A . 6 ALA CA 1 1 4 1505 1 1 6 ALA CB C 6.701 4.480 -4.522 1.00 . A A . 6 ALA CB 1 1 4 1506 1 1 6 ALA H H 4.696 5.396 -3.156 1.00 . A A . 6 ALA H 1 1 4 1507 1 1 6 ALA HA H 5.296 2.863 -4.503 1.00 . A A . 6 ALA HA 1 1 4 1508 1 1 6 ALA HB1 H 6.216 5.094 -5.267 1.00 . A A . 6 ALA HB1 1 1 4 1509 1 1 6 ALA HB2 H 7.432 3.844 -5.000 1.00 . A A . 6 ALA HB2 1 1 4 1510 1 1 6 ALA HB3 H 7.192 5.115 -3.796 1.00 . A A . 6 ALA HB3 1 1 4 1511 1 1 6 ALA N N 4.534 4.453 -3.395 1.00 . A A . 6 ALA N 1 1 4 1512 1 1 6 ALA O O 6.567 1.728 -2.606 1.00 . A A . 6 ALA O 1 1 4 1513 1 1 7 GLU C C 5.948 2.256 0.375 1.00 . A A . 7 GLU C 1 1 4 1514 1 1 7 GLU CA C 6.965 3.180 -0.293 1.00 . A A . 7 GLU CA 1 1 4 1515 1 1 7 GLU CB C 7.324 4.345 0.633 1.00 . A A . 7 GLU CB 1 1 4 1516 1 1 7 GLU CD C 9.047 6.176 0.644 1.00 . A A . 7 GLU CD 1 1 4 1517 1 1 7 GLU CG C 8.015 5.435 -0.194 1.00 . A A . 7 GLU CG 1 1 4 1518 1 1 7 GLU H H 6.140 4.640 -1.583 1.00 . A A . 7 GLU H 1 1 4 1519 1 1 7 GLU HA H 7.862 2.621 -0.512 1.00 . A A . 7 GLU HA 1 1 4 1520 1 1 7 GLU HB2 H 6.424 4.744 1.081 1.00 . A A . 7 GLU HB2 1 1 4 1521 1 1 7 GLU HB3 H 7.994 4.001 1.408 1.00 . A A . 7 GLU HB3 1 1 4 1522 1 1 7 GLU HG2 H 8.509 4.980 -1.042 1.00 . A A . 7 GLU HG2 1 1 4 1523 1 1 7 GLU HG3 H 7.275 6.136 -0.548 1.00 . A A . 7 GLU HG3 1 1 4 1524 1 1 7 GLU N N 6.417 3.701 -1.535 1.00 . A A . 7 GLU N 1 1 4 1525 1 1 7 GLU O O 6.307 1.262 1.001 1.00 . A A . 7 GLU O 1 1 4 1526 1 1 7 GLU OE1 O 8.664 6.801 1.616 1.00 . A A . 7 GLU OE1 1 1 4 1527 1 1 7 GLU OE2 O 10.211 6.130 0.287 1.00 . A A . 7 GLU OE2 1 1 4 1528 1 1 8 CYS C C 3.775 0.323 0.495 1.00 . A A . 8 CYS C 1 1 4 1529 1 1 8 CYS CA C 3.586 1.807 0.792 1.00 . A A . 8 CYS CA 1 1 4 1530 1 1 8 CYS CB C 2.239 2.294 0.260 1.00 . A A . 8 CYS CB 1 1 4 1531 1 1 8 CYS H H 4.452 3.402 -0.300 1.00 . A A . 8 CYS H 1 1 4 1532 1 1 8 CYS HA H 3.597 1.950 1.854 1.00 . A A . 8 CYS HA 1 1 4 1533 1 1 8 CYS HB2 H 2.394 3.087 -0.454 1.00 . A A . 8 CYS HB2 1 1 4 1534 1 1 8 CYS HB3 H 1.708 1.487 -0.210 1.00 . A A . 8 CYS HB3 1 1 4 1535 1 1 8 CYS N N 4.670 2.596 0.218 1.00 . A A . 8 CYS N 1 1 4 1536 1 1 8 CYS O O 3.873 -0.490 1.415 1.00 . A A . 8 CYS O 1 1 4 1537 1 1 8 CYS SG S 1.274 2.918 1.651 1.00 . A A . 8 CYS SG 1 1 4 1538 1 1 9 PRO C C 5.426 -1.943 -0.642 1.00 . A A . 9 PRO C 1 1 4 1539 1 1 9 PRO CA C 4.077 -1.462 -1.157 1.00 . A A . 9 PRO CA 1 1 4 1540 1 1 9 PRO CB C 4.035 -1.449 -2.690 1.00 . A A . 9 PRO CB 1 1 4 1541 1 1 9 PRO CD C 3.753 0.841 -1.928 1.00 . A A . 9 PRO CD 1 1 4 1542 1 1 9 PRO CG C 4.225 -0.024 -3.095 1.00 . A A . 9 PRO CG 1 1 4 1543 1 1 9 PRO HA H 3.286 -2.085 -0.774 1.00 . A A . 9 PRO HA 1 1 4 1544 1 1 9 PRO HB2 H 4.832 -2.062 -3.090 1.00 . A A . 9 PRO HB2 1 1 4 1545 1 1 9 PRO HB3 H 3.079 -1.807 -3.040 1.00 . A A . 9 PRO HB3 1 1 4 1546 1 1 9 PRO HD2 H 4.394 1.700 -1.813 1.00 . A A . 9 PRO HD2 1 1 4 1547 1 1 9 PRO HD3 H 2.730 1.148 -2.072 1.00 . A A . 9 PRO HD3 1 1 4 1548 1 1 9 PRO HG2 H 5.270 0.163 -3.301 1.00 . A A . 9 PRO HG2 1 1 4 1549 1 1 9 PRO HG3 H 3.632 0.195 -3.969 1.00 . A A . 9 PRO HG3 1 1 4 1550 1 1 9 PRO N N 3.857 -0.044 -0.761 1.00 . A A . 9 PRO N 1 1 4 1551 1 1 9 PRO O O 5.549 -3.059 -0.134 1.00 . A A . 9 PRO O 1 1 4 1552 1 1 10 MET C C 7.693 -1.659 1.259 1.00 . A A . 10 MET C 1 1 4 1553 1 1 10 MET CA C 7.761 -1.406 -0.245 1.00 . A A . 10 MET CA 1 1 4 1554 1 1 10 MET CB C 8.725 -0.255 -0.538 1.00 . A A . 10 MET CB 1 1 4 1555 1 1 10 MET CE C 10.877 0.052 -4.025 1.00 . A A . 10 MET CE 1 1 4 1556 1 1 10 MET CG C 9.084 -0.254 -2.027 1.00 . A A . 10 MET CG 1 1 4 1557 1 1 10 MET H H 6.271 -0.183 -1.133 1.00 . A A . 10 MET H 1 1 4 1558 1 1 10 MET HA H 8.113 -2.300 -0.738 1.00 . A A . 10 MET HA 1 1 4 1559 1 1 10 MET HB2 H 8.257 0.683 -0.279 1.00 . A A . 10 MET HB2 1 1 4 1560 1 1 10 MET HB3 H 9.622 -0.379 0.045 1.00 . A A . 10 MET HB3 1 1 4 1561 1 1 10 MET HE1 H 10.297 0.899 -4.360 1.00 . A A . 10 MET HE1 1 1 4 1562 1 1 10 MET HE2 H 10.448 -0.862 -4.417 1.00 . A A . 10 MET HE2 1 1 4 1563 1 1 10 MET HE3 H 11.890 0.153 -4.377 1.00 . A A . 10 MET HE3 1 1 4 1564 1 1 10 MET HG2 H 8.806 -1.200 -2.468 1.00 . A A . 10 MET HG2 1 1 4 1565 1 1 10 MET HG3 H 8.553 0.545 -2.524 1.00 . A A . 10 MET HG3 1 1 4 1566 1 1 10 MET N N 6.433 -1.073 -0.742 1.00 . A A . 10 MET N 1 1 4 1567 1 1 10 MET O O 8.331 -2.570 1.781 1.00 . A A . 10 MET O 1 1 4 1568 1 1 10 MET SD S 10.863 -0.005 -2.220 1.00 . A A . 10 MET SD 1 1 4 1569 1 1 11 HIS C C 5.721 -2.102 3.700 1.00 . A A . 11 HIS C 1 1 4 1570 1 1 11 HIS CA C 6.711 -0.978 3.383 1.00 . A A . 11 HIS CA 1 1 4 1571 1 1 11 HIS CB C 6.197 0.346 3.955 1.00 . A A . 11 HIS CB 1 1 4 1572 1 1 11 HIS CD2 C 6.862 1.682 6.113 1.00 . A A . 11 HIS CD2 1 1 4 1573 1 1 11 HIS CE1 C 7.648 0.036 7.284 1.00 . A A . 11 HIS CE1 1 1 4 1574 1 1 11 HIS CG C 6.742 0.555 5.342 1.00 . A A . 11 HIS CG 1 1 4 1575 1 1 11 HIS H H 6.402 -0.143 1.456 1.00 . A A . 11 HIS H 1 1 4 1576 1 1 11 HIS HA H 7.663 -1.211 3.838 1.00 . A A . 11 HIS HA 1 1 4 1577 1 1 11 HIS HB2 H 6.517 1.158 3.321 1.00 . A A . 11 HIS HB2 1 1 4 1578 1 1 11 HIS HB3 H 5.117 0.327 3.994 1.00 . A A . 11 HIS HB3 1 1 4 1579 1 1 11 HIS HD2 H 6.561 2.676 5.813 1.00 . A A . 11 HIS HD2 1 1 4 1580 1 1 11 HIS HE1 H 8.097 -0.539 8.082 1.00 . A A . 11 HIS HE1 1 1 4 1581 1 1 11 HIS HE2 H 7.630 1.958 8.082 1.00 . A A . 11 HIS HE2 1 1 4 1582 1 1 11 HIS N N 6.892 -0.848 1.940 1.00 . A A . 11 HIS N 1 1 4 1583 1 1 11 HIS ND1 N 7.250 -0.486 6.108 1.00 . A A . 11 HIS ND1 1 1 4 1584 1 1 11 HIS NE2 N 7.433 1.354 7.338 1.00 . A A . 11 HIS NE2 1 1 4 1585 1 1 11 HIS O O 5.149 -2.155 4.795 1.00 . A A . 11 HIS O 1 1 4 1586 1 1 12 CYS C C 5.408 -5.379 3.342 1.00 . A A . 12 CYS C 1 1 4 1587 1 1 12 CYS CA C 4.619 -4.139 2.931 1.00 . A A . 12 CYS CA 1 1 4 1588 1 1 12 CYS CB C 3.823 -4.419 1.657 1.00 . A A . 12 CYS CB 1 1 4 1589 1 1 12 CYS H H 6.023 -2.921 1.898 1.00 . A A . 12 CYS H 1 1 4 1590 1 1 12 CYS HA H 3.926 -3.895 3.723 1.00 . A A . 12 CYS HA 1 1 4 1591 1 1 12 CYS HB2 H 3.852 -3.553 1.018 1.00 . A A . 12 CYS HB2 1 1 4 1592 1 1 12 CYS HB3 H 4.250 -5.268 1.143 1.00 . A A . 12 CYS HB3 1 1 4 1593 1 1 12 CYS N N 5.532 -3.009 2.745 1.00 . A A . 12 CYS N 1 1 4 1594 1 1 12 CYS O O 6.545 -5.573 2.919 1.00 . A A . 12 CYS O 1 1 4 1595 1 1 12 CYS SG S 2.105 -4.783 2.105 1.00 . A A . 12 CYS SG 1 1 4 1596 1 1 13 LYS C C 5.085 -8.650 3.956 1.00 . A A . 13 LYS C 1 1 4 1597 1 1 13 LYS CA C 5.484 -7.379 4.721 1.00 . A A . 13 LYS CA 1 1 4 1598 1 1 13 LYS CB C 5.156 -7.528 6.213 1.00 . A A . 13 LYS CB 1 1 4 1599 1 1 13 LYS CD C 5.455 -5.134 6.976 1.00 . A A . 13 LYS CD 1 1 4 1600 1 1 13 LYS CE C 6.582 -4.129 6.700 1.00 . A A . 13 LYS CE 1 1 4 1601 1 1 13 LYS CG C 6.030 -6.563 7.035 1.00 . A A . 13 LYS CG 1 1 4 1602 1 1 13 LYS H H 3.917 -5.960 4.530 1.00 . A A . 13 LYS H 1 1 4 1603 1 1 13 LYS HA H 6.551 -7.243 4.620 1.00 . A A . 13 LYS HA 1 1 4 1604 1 1 13 LYS HB2 H 4.113 -7.299 6.376 1.00 . A A . 13 LYS HB2 1 1 4 1605 1 1 13 LYS HB3 H 5.354 -8.543 6.526 1.00 . A A . 13 LYS HB3 1 1 4 1606 1 1 13 LYS HD2 H 4.718 -5.073 6.190 1.00 . A A . 13 LYS HD2 1 1 4 1607 1 1 13 LYS HD3 H 4.990 -4.897 7.922 1.00 . A A . 13 LYS HD3 1 1 4 1608 1 1 13 LYS HE2 H 7.375 -4.273 7.420 1.00 . A A . 13 LYS HE2 1 1 4 1609 1 1 13 LYS HE3 H 6.971 -4.288 5.704 1.00 . A A . 13 LYS HE3 1 1 4 1610 1 1 13 LYS HG2 H 6.055 -6.896 8.064 1.00 . A A . 13 LYS HG2 1 1 4 1611 1 1 13 LYS HG3 H 7.035 -6.562 6.638 1.00 . A A . 13 LYS HG3 1 1 4 1612 1 1 13 LYS HZ1 H 5.364 -2.679 7.585 1.00 . A A . 13 LYS HZ1 1 1 4 1613 1 1 13 LYS HZ2 H 5.578 -2.461 5.909 1.00 . A A . 13 LYS HZ2 1 1 4 1614 1 1 13 LYS HZ3 H 6.839 -2.072 6.994 1.00 . A A . 13 LYS HZ3 1 1 4 1615 1 1 13 LYS N N 4.812 -6.186 4.206 1.00 . A A . 13 LYS N 1 1 4 1616 1 1 13 LYS NZ N 6.052 -2.734 6.811 1.00 . A A . 13 LYS NZ 1 1 4 1617 1 1 13 LYS O O 3.929 -8.834 3.567 1.00 . A A . 13 LYS O 1 1 4 1618 1 1 14 GLY C C 4.591 -11.481 3.325 1.00 . A A . 14 GLY C 1 1 4 1619 1 1 14 GLY CA C 5.908 -10.774 3.005 1.00 . A A . 14 GLY CA 1 1 4 1620 1 1 14 GLY H H 6.976 -9.282 4.067 1.00 . A A . 14 GLY H 1 1 4 1621 1 1 14 GLY HA2 H 5.941 -10.567 1.945 1.00 . A A . 14 GLY HA2 1 1 4 1622 1 1 14 GLY HA3 H 6.726 -11.435 3.253 1.00 . A A . 14 GLY HA3 1 1 4 1623 1 1 14 GLY N N 6.083 -9.511 3.736 1.00 . A A . 14 GLY N 1 1 4 1624 1 1 14 GLY O O 4.141 -11.491 4.473 1.00 . A A . 14 GLY O 1 1 4 1625 1 1 15 LYS C C 1.533 -11.907 2.149 1.00 . A A . 15 LYS C 1 1 4 1626 1 1 15 LYS CA C 2.738 -12.825 2.353 1.00 . A A . 15 LYS CA 1 1 4 1627 1 1 15 LYS CB C 2.591 -13.584 3.683 1.00 . A A . 15 LYS CB 1 1 4 1628 1 1 15 LYS CD C 4.717 -14.393 4.779 1.00 . A A . 15 LYS CD 1 1 4 1629 1 1 15 LYS CE C 4.090 -14.111 6.148 1.00 . A A . 15 LYS CE 1 1 4 1630 1 1 15 LYS CG C 3.621 -14.721 3.755 1.00 . A A . 15 LYS CG 1 1 4 1631 1 1 15 LYS H H 4.453 -12.015 1.407 1.00 . A A . 15 LYS H 1 1 4 1632 1 1 15 LYS HA H 2.735 -13.551 1.552 1.00 . A A . 15 LYS HA 1 1 4 1633 1 1 15 LYS HB2 H 2.726 -12.911 4.509 1.00 . A A . 15 LYS HB2 1 1 4 1634 1 1 15 LYS HB3 H 1.602 -14.010 3.733 1.00 . A A . 15 LYS HB3 1 1 4 1635 1 1 15 LYS HD2 H 5.390 -15.234 4.861 1.00 . A A . 15 LYS HD2 1 1 4 1636 1 1 15 LYS HD3 H 5.269 -13.526 4.452 1.00 . A A . 15 LYS HD3 1 1 4 1637 1 1 15 LYS HE2 H 3.047 -14.399 6.135 1.00 . A A . 15 LYS HE2 1 1 4 1638 1 1 15 LYS HE3 H 4.610 -14.680 6.907 1.00 . A A . 15 LYS HE3 1 1 4 1639 1 1 15 LYS HG2 H 3.122 -15.635 4.047 1.00 . A A . 15 LYS HG2 1 1 4 1640 1 1 15 LYS HG3 H 4.068 -14.857 2.783 1.00 . A A . 15 LYS HG3 1 1 4 1641 1 1 15 LYS HZ1 H 4.153 -12.103 5.550 1.00 . A A . 15 LYS HZ1 1 1 4 1642 1 1 15 LYS HZ2 H 5.113 -12.463 6.912 1.00 . A A . 15 LYS HZ2 1 1 4 1643 1 1 15 LYS HZ3 H 3.425 -12.364 7.076 1.00 . A A . 15 LYS HZ3 1 1 4 1644 1 1 15 LYS N N 4.007 -12.076 2.276 1.00 . A A . 15 LYS N 1 1 4 1645 1 1 15 LYS NZ N 4.204 -12.653 6.449 1.00 . A A . 15 LYS NZ 1 1 4 1646 1 1 15 LYS O O 0.455 -12.370 1.783 1.00 . A A . 15 LYS O 1 1 4 1647 1 1 16 MET C C 1.157 -8.361 1.575 1.00 . A A . 16 MET C 1 1 4 1648 1 1 16 MET CA C 0.631 -9.655 2.189 1.00 . A A . 16 MET CA 1 1 4 1649 1 1 16 MET CB C -0.034 -9.356 3.538 1.00 . A A . 16 MET CB 1 1 4 1650 1 1 16 MET CE C -2.375 -11.868 5.809 1.00 . A A . 16 MET CE 1 1 4 1651 1 1 16 MET CG C -0.698 -10.625 4.077 1.00 . A A . 16 MET CG 1 1 4 1652 1 1 16 MET H H 2.600 -10.289 2.654 1.00 . A A . 16 MET H 1 1 4 1653 1 1 16 MET HA H -0.105 -10.082 1.526 1.00 . A A . 16 MET HA 1 1 4 1654 1 1 16 MET HB2 H 0.716 -9.015 4.239 1.00 . A A . 16 MET HB2 1 1 4 1655 1 1 16 MET HB3 H -0.782 -8.588 3.410 1.00 . A A . 16 MET HB3 1 1 4 1656 1 1 16 MET HE1 H -1.524 -12.534 5.775 1.00 . A A . 16 MET HE1 1 1 4 1657 1 1 16 MET HE2 H -3.116 -12.187 5.089 1.00 . A A . 16 MET HE2 1 1 4 1658 1 1 16 MET HE3 H -2.806 -11.886 6.796 1.00 . A A . 16 MET HE3 1 1 4 1659 1 1 16 MET HG2 H -1.244 -11.115 3.283 1.00 . A A . 16 MET HG2 1 1 4 1660 1 1 16 MET HG3 H 0.060 -11.294 4.459 1.00 . A A . 16 MET HG3 1 1 4 1661 1 1 16 MET N N 1.719 -10.611 2.372 1.00 . A A . 16 MET N 1 1 4 1662 1 1 16 MET O O 1.717 -7.522 2.278 1.00 . A A . 16 MET O 1 1 4 1663 1 1 16 MET SD S -1.837 -10.186 5.413 1.00 . A A . 16 MET SD 1 1 4 1664 1 1 17 ALA C C 0.513 -6.474 -1.464 1.00 . A A . 17 ALA C 1 1 4 1665 1 1 17 ALA CA C 1.475 -6.991 -0.399 1.00 . A A . 17 ALA CA 1 1 4 1666 1 1 17 ALA CB C 2.842 -7.239 -1.023 1.00 . A A . 17 ALA CB 1 1 4 1667 1 1 17 ALA H H 0.545 -8.898 -0.261 1.00 . A A . 17 ALA H 1 1 4 1668 1 1 17 ALA HA H 1.582 -6.222 0.353 1.00 . A A . 17 ALA HA 1 1 4 1669 1 1 17 ALA HB1 H 3.296 -8.098 -0.561 1.00 . A A . 17 ALA HB1 1 1 4 1670 1 1 17 ALA HB2 H 3.465 -6.371 -0.869 1.00 . A A . 17 ALA HB2 1 1 4 1671 1 1 17 ALA HB3 H 2.726 -7.414 -2.082 1.00 . A A . 17 ALA HB3 1 1 4 1672 1 1 17 ALA N N 0.988 -8.201 0.261 1.00 . A A . 17 ALA N 1 1 4 1673 1 1 17 ALA O O 0.329 -7.076 -2.528 1.00 . A A . 17 ALA O 1 1 4 1674 1 1 18 LYS C C -1.167 -3.205 -1.539 1.00 . A A . 18 LYS C 1 1 4 1675 1 1 18 LYS CA C -1.001 -4.644 -2.031 1.00 . A A . 18 LYS CA 1 1 4 1676 1 1 18 LYS CB C -2.359 -5.362 -2.125 1.00 . A A . 18 LYS CB 1 1 4 1677 1 1 18 LYS CD C -3.215 -7.636 -1.529 1.00 . A A . 18 LYS CD 1 1 4 1678 1 1 18 LYS CE C -2.157 -8.712 -1.789 1.00 . A A . 18 LYS CE 1 1 4 1679 1 1 18 LYS CG C -2.553 -6.362 -0.977 1.00 . A A . 18 LYS CG 1 1 4 1680 1 1 18 LYS H H 0.154 -4.932 -0.291 1.00 . A A . 18 LYS H 1 1 4 1681 1 1 18 LYS HA H -0.564 -4.613 -3.018 1.00 . A A . 18 LYS HA 1 1 4 1682 1 1 18 LYS HB2 H -3.149 -4.626 -2.084 1.00 . A A . 18 LYS HB2 1 1 4 1683 1 1 18 LYS HB3 H -2.414 -5.886 -3.067 1.00 . A A . 18 LYS HB3 1 1 4 1684 1 1 18 LYS HD2 H -3.933 -8.007 -0.814 1.00 . A A . 18 LYS HD2 1 1 4 1685 1 1 18 LYS HD3 H -3.722 -7.405 -2.455 1.00 . A A . 18 LYS HD3 1 1 4 1686 1 1 18 LYS HE2 H -1.442 -8.717 -0.978 1.00 . A A . 18 LYS HE2 1 1 4 1687 1 1 18 LYS HE3 H -2.637 -9.679 -1.848 1.00 . A A . 18 LYS HE3 1 1 4 1688 1 1 18 LYS HG2 H -1.602 -6.611 -0.536 1.00 . A A . 18 LYS HG2 1 1 4 1689 1 1 18 LYS HG3 H -3.188 -5.923 -0.228 1.00 . A A . 18 LYS HG3 1 1 4 1690 1 1 18 LYS HZ1 H -0.607 -7.823 -2.891 1.00 . A A . 18 LYS HZ1 1 1 4 1691 1 1 18 LYS HZ2 H -2.097 -7.918 -3.718 1.00 . A A . 18 LYS HZ2 1 1 4 1692 1 1 18 LYS HZ3 H -1.155 -9.319 -3.516 1.00 . A A . 18 LYS HZ3 1 1 4 1693 1 1 18 LYS N N -0.071 -5.339 -1.149 1.00 . A A . 18 LYS N 1 1 4 1694 1 1 18 LYS NZ N -1.455 -8.424 -3.076 1.00 . A A . 18 LYS NZ 1 1 4 1695 1 1 18 LYS O O -1.711 -2.970 -0.458 1.00 . A A . 18 LYS O 1 1 4 1696 1 1 19 PRO C C -2.046 -0.121 -2.198 1.00 . A A . 19 PRO C 1 1 4 1697 1 1 19 PRO CA C -0.717 -0.811 -1.883 1.00 . A A . 19 PRO CA 1 1 4 1698 1 1 19 PRO CB C 0.414 -0.203 -2.709 1.00 . A A . 19 PRO CB 1 1 4 1699 1 1 19 PRO CD C 0.009 -2.425 -3.581 1.00 . A A . 19 PRO CD 1 1 4 1700 1 1 19 PRO CG C 0.432 -1.005 -3.966 1.00 . A A . 19 PRO CG 1 1 4 1701 1 1 19 PRO HA H -0.485 -0.706 -0.837 1.00 . A A . 19 PRO HA 1 1 4 1702 1 1 19 PRO HB2 H 0.209 0.839 -2.922 1.00 . A A . 19 PRO HB2 1 1 4 1703 1 1 19 PRO HB3 H 1.354 -0.307 -2.191 1.00 . A A . 19 PRO HB3 1 1 4 1704 1 1 19 PRO HD2 H -0.675 -2.827 -4.316 1.00 . A A . 19 PRO HD2 1 1 4 1705 1 1 19 PRO HD3 H 0.873 -3.063 -3.471 1.00 . A A . 19 PRO HD3 1 1 4 1706 1 1 19 PRO HG2 H -0.267 -0.587 -4.680 1.00 . A A . 19 PRO HG2 1 1 4 1707 1 1 19 PRO HG3 H 1.425 -1.021 -4.385 1.00 . A A . 19 PRO HG3 1 1 4 1708 1 1 19 PRO N N -0.666 -2.250 -2.278 1.00 . A A . 19 PRO N 1 1 4 1709 1 1 19 PRO O O -2.650 -0.346 -3.245 1.00 . A A . 19 PRO O 1 1 4 1710 1 1 20 THR C C -3.412 2.975 -1.166 1.00 . A A . 20 THR C 1 1 4 1711 1 1 20 THR CA C -3.705 1.500 -1.427 1.00 . A A . 20 THR CA 1 1 4 1712 1 1 20 THR CB C -4.761 1.006 -0.433 1.00 . A A . 20 THR CB 1 1 4 1713 1 1 20 THR CG2 C -4.991 -0.491 -0.617 1.00 . A A . 20 THR CG2 1 1 4 1714 1 1 20 THR H H -1.929 0.871 -0.465 1.00 . A A . 20 THR H 1 1 4 1715 1 1 20 THR HA H -4.079 1.383 -2.434 1.00 . A A . 20 THR HA 1 1 4 1716 1 1 20 THR HB H -5.690 1.531 -0.601 1.00 . A A . 20 THR HB 1 1 4 1717 1 1 20 THR HG1 H -3.368 0.976 0.940 1.00 . A A . 20 THR HG1 1 1 4 1718 1 1 20 THR HG21 H -6.009 -0.732 -0.357 1.00 . A A . 20 THR HG21 1 1 4 1719 1 1 20 THR HG22 H -4.316 -1.039 0.024 1.00 . A A . 20 THR HG22 1 1 4 1720 1 1 20 THR HG23 H -4.806 -0.762 -1.646 1.00 . A A . 20 THR HG23 1 1 4 1721 1 1 20 THR N N -2.470 0.736 -1.275 1.00 . A A . 20 THR N 1 1 4 1722 1 1 20 THR O O -2.823 3.316 -0.135 1.00 . A A . 20 THR O 1 1 4 1723 1 1 20 THR OG1 O -4.308 1.245 0.892 1.00 . A A . 20 THR OG1 1 1 4 1724 1 1 21 CYS C C -4.842 6.079 -2.061 1.00 . A A . 21 CYS C 1 1 4 1725 1 1 21 CYS CA C -3.548 5.278 -1.944 1.00 . A A . 21 CYS CA 1 1 4 1726 1 1 21 CYS CB C -2.524 5.752 -2.980 1.00 . A A . 21 CYS CB 1 1 4 1727 1 1 21 CYS H H -4.255 3.509 -2.914 1.00 . A A . 21 CYS H 1 1 4 1728 1 1 21 CYS HA H -3.137 5.446 -0.964 1.00 . A A . 21 CYS HA 1 1 4 1729 1 1 21 CYS HB2 H -2.488 5.048 -3.798 1.00 . A A . 21 CYS HB2 1 1 4 1730 1 1 21 CYS HB3 H -2.805 6.727 -3.353 1.00 . A A . 21 CYS HB3 1 1 4 1731 1 1 21 CYS N N -3.798 3.842 -2.100 1.00 . A A . 21 CYS N 1 1 4 1732 1 1 21 CYS O O -5.611 5.905 -3.007 1.00 . A A . 21 CYS O 1 1 4 1733 1 1 21 CYS SG S -0.896 5.851 -2.185 1.00 . A A . 21 CYS SG 1 1 4 1734 1 1 22 GLU C C -5.944 9.184 -0.585 1.00 . A A . 22 GLU C 1 1 4 1735 1 1 22 GLU CA C -6.267 7.773 -1.073 1.00 . A A . 22 GLU CA 1 1 4 1736 1 1 22 GLU CB C -7.334 7.129 -0.175 1.00 . A A . 22 GLU CB 1 1 4 1737 1 1 22 GLU CD C -6.148 5.237 1.000 1.00 . A A . 22 GLU CD 1 1 4 1738 1 1 22 GLU CG C -6.706 6.650 1.144 1.00 . A A . 22 GLU CG 1 1 4 1739 1 1 22 GLU H H -4.426 7.060 -0.366 1.00 . A A . 22 GLU H 1 1 4 1740 1 1 22 GLU HA H -6.657 7.836 -2.079 1.00 . A A . 22 GLU HA 1 1 4 1741 1 1 22 GLU HB2 H -8.105 7.855 0.039 1.00 . A A . 22 GLU HB2 1 1 4 1742 1 1 22 GLU HB3 H -7.772 6.285 -0.690 1.00 . A A . 22 GLU HB3 1 1 4 1743 1 1 22 GLU HG2 H -5.907 7.318 1.423 1.00 . A A . 22 GLU HG2 1 1 4 1744 1 1 22 GLU HG3 H -7.459 6.654 1.918 1.00 . A A . 22 GLU HG3 1 1 4 1745 1 1 22 GLU N N -5.074 6.957 -1.090 1.00 . A A . 22 GLU N 1 1 4 1746 1 1 22 GLU O O -5.377 9.381 0.487 1.00 . A A . 22 GLU O 1 1 4 1747 1 1 22 GLU OE1 O -6.920 4.331 0.709 1.00 . A A . 22 GLU OE1 1 1 4 1748 1 1 22 GLU OE2 O -4.954 5.068 1.211 1.00 . A A . 22 GLU OE2 1 1 4 1749 1 1 23 ASN C C -4.676 11.818 -0.547 1.00 . A A . 23 ASN C 1 1 4 1750 1 1 23 ASN CA C -6.077 11.572 -1.108 1.00 . A A . 23 ASN CA 1 1 4 1751 1 1 23 ASN CB C -7.141 12.115 -0.138 1.00 . A A . 23 ASN CB 1 1 4 1752 1 1 23 ASN CG C -7.518 11.081 0.915 1.00 . A A . 23 ASN CG 1 1 4 1753 1 1 23 ASN H H -6.728 9.895 -2.240 1.00 . A A . 23 ASN H 1 1 4 1754 1 1 23 ASN HA H -6.159 12.121 -2.036 1.00 . A A . 23 ASN HA 1 1 4 1755 1 1 23 ASN HB2 H -6.754 12.993 0.356 1.00 . A A . 23 ASN HB2 1 1 4 1756 1 1 23 ASN HB3 H -8.019 12.387 -0.700 1.00 . A A . 23 ASN HB3 1 1 4 1757 1 1 23 ASN HD21 H -8.920 10.241 -0.201 1.00 . A A . 23 ASN HD21 1 1 4 1758 1 1 23 ASN HD22 H -8.703 9.554 1.334 1.00 . A A . 23 ASN HD22 1 1 4 1759 1 1 23 ASN N N -6.305 10.149 -1.404 1.00 . A A . 23 ASN N 1 1 4 1760 1 1 23 ASN ND2 N -8.459 10.221 0.660 1.00 . A A . 23 ASN ND2 1 1 4 1761 1 1 23 ASN O O -4.515 12.441 0.501 1.00 . A A . 23 ASN O 1 1 4 1762 1 1 23 ASN OD1 O -6.958 11.069 2.007 1.00 . A A . 23 ASN OD1 1 1 4 1763 1 1 24 GLU C C -1.899 10.563 0.288 1.00 . A A . 24 GLU C 1 1 4 1764 1 1 24 GLU CA C -2.271 11.481 -0.876 1.00 . A A . 24 GLU CA 1 1 4 1765 1 1 24 GLU CB C -1.956 12.945 -0.525 1.00 . A A . 24 GLU CB 1 1 4 1766 1 1 24 GLU CD C -1.916 13.127 -3.044 1.00 . A A . 24 GLU CD 1 1 4 1767 1 1 24 GLU CG C -2.240 13.850 -1.737 1.00 . A A . 24 GLU CG 1 1 4 1768 1 1 24 GLU H H -3.883 10.846 -2.096 1.00 . A A . 24 GLU H 1 1 4 1769 1 1 24 GLU HA H -1.662 11.203 -1.721 1.00 . A A . 24 GLU HA 1 1 4 1770 1 1 24 GLU HB2 H -2.566 13.258 0.311 1.00 . A A . 24 GLU HB2 1 1 4 1771 1 1 24 GLU HB3 H -0.913 13.030 -0.256 1.00 . A A . 24 GLU HB3 1 1 4 1772 1 1 24 GLU HG2 H -3.284 14.130 -1.738 1.00 . A A . 24 GLU HG2 1 1 4 1773 1 1 24 GLU HG3 H -1.634 14.742 -1.667 1.00 . A A . 24 GLU HG3 1 1 4 1774 1 1 24 GLU N N -3.675 11.323 -1.267 1.00 . A A . 24 GLU N 1 1 4 1775 1 1 24 GLU O O -0.739 10.518 0.698 1.00 . A A . 24 GLU O 1 1 4 1776 1 1 24 GLU OE1 O -0.753 13.097 -3.409 1.00 . A A . 24 GLU OE1 1 1 4 1777 1 1 24 GLU OE2 O -2.839 12.613 -3.657 1.00 . A A . 24 GLU OE2 1 1 4 1778 1 1 25 VAL C C -2.415 7.478 1.299 1.00 . A A . 25 VAL C 1 1 4 1779 1 1 25 VAL CA C -2.592 8.871 1.886 1.00 . A A . 25 VAL CA 1 1 4 1780 1 1 25 VAL CB C -3.742 8.867 2.903 1.00 . A A . 25 VAL CB 1 1 4 1781 1 1 25 VAL CG1 C -3.454 7.848 4.010 1.00 . A A . 25 VAL CG1 1 1 4 1782 1 1 25 VAL CG2 C -3.879 10.259 3.527 1.00 . A A . 25 VAL CG2 1 1 4 1783 1 1 25 VAL H H -3.777 9.858 0.423 1.00 . A A . 25 VAL H 1 1 4 1784 1 1 25 VAL HA H -1.679 9.163 2.384 1.00 . A A . 25 VAL HA 1 1 4 1785 1 1 25 VAL HB H -4.663 8.602 2.403 1.00 . A A . 25 VAL HB 1 1 4 1786 1 1 25 VAL HG11 H -2.555 8.133 4.538 1.00 . A A . 25 VAL HG11 1 1 4 1787 1 1 25 VAL HG12 H -3.321 6.868 3.577 1.00 . A A . 25 VAL HG12 1 1 4 1788 1 1 25 VAL HG13 H -4.283 7.825 4.702 1.00 . A A . 25 VAL HG13 1 1 4 1789 1 1 25 VAL HG21 H -4.772 10.735 3.148 1.00 . A A . 25 VAL HG21 1 1 4 1790 1 1 25 VAL HG22 H -3.018 10.856 3.273 1.00 . A A . 25 VAL HG22 1 1 4 1791 1 1 25 VAL HG23 H -3.951 10.168 4.601 1.00 . A A . 25 VAL HG23 1 1 4 1792 1 1 25 VAL N N -2.868 9.806 0.798 1.00 . A A . 25 VAL N 1 1 4 1793 1 1 25 VAL O O -3.220 7.045 0.474 1.00 . A A . 25 VAL O 1 1 4 1794 1 1 26 CYS C C -1.034 4.409 2.267 1.00 . A A . 26 CYS C 1 1 4 1795 1 1 26 CYS CA C -1.069 5.463 1.165 1.00 . A A . 26 CYS CA 1 1 4 1796 1 1 26 CYS CB C 0.275 5.474 0.447 1.00 . A A . 26 CYS CB 1 1 4 1797 1 1 26 CYS H H -0.721 7.191 2.324 1.00 . A A . 26 CYS H 1 1 4 1798 1 1 26 CYS HA H -1.835 5.202 0.458 1.00 . A A . 26 CYS HA 1 1 4 1799 1 1 26 CYS HB2 H 0.224 4.819 -0.395 1.00 . A A . 26 CYS HB2 1 1 4 1800 1 1 26 CYS HB3 H 0.502 6.469 0.109 1.00 . A A . 26 CYS HB3 1 1 4 1801 1 1 26 CYS N N -1.346 6.792 1.693 1.00 . A A . 26 CYS N 1 1 4 1802 1 1 26 CYS O O -0.577 4.670 3.379 1.00 . A A . 26 CYS O 1 1 4 1803 1 1 26 CYS SG S 1.570 4.910 1.572 1.00 . A A . 26 CYS SG 1 1 4 1804 1 1 27 LYS C C -1.521 0.766 2.179 1.00 . A A . 27 LYS C 1 1 4 1805 1 1 27 LYS CA C -1.529 2.115 2.907 1.00 . A A . 27 LYS CA 1 1 4 1806 1 1 27 LYS CB C -2.780 2.199 3.798 1.00 . A A . 27 LYS CB 1 1 4 1807 1 1 27 LYS CD C -4.864 3.584 4.183 1.00 . A A . 27 LYS CD 1 1 4 1808 1 1 27 LYS CE C -5.666 2.603 3.317 1.00 . A A . 27 LYS CE 1 1 4 1809 1 1 27 LYS CG C -3.389 3.611 3.743 1.00 . A A . 27 LYS CG 1 1 4 1810 1 1 27 LYS H H -1.872 3.063 1.035 1.00 . A A . 27 LYS H 1 1 4 1811 1 1 27 LYS HA H -0.649 2.185 3.529 1.00 . A A . 27 LYS HA 1 1 4 1812 1 1 27 LYS HB2 H -3.504 1.478 3.456 1.00 . A A . 27 LYS HB2 1 1 4 1813 1 1 27 LYS HB3 H -2.504 1.972 4.817 1.00 . A A . 27 LYS HB3 1 1 4 1814 1 1 27 LYS HD2 H -4.923 3.281 5.219 1.00 . A A . 27 LYS HD2 1 1 4 1815 1 1 27 LYS HD3 H -5.284 4.575 4.075 1.00 . A A . 27 LYS HD3 1 1 4 1816 1 1 27 LYS HE2 H -5.354 1.591 3.531 1.00 . A A . 27 LYS HE2 1 1 4 1817 1 1 27 LYS HE3 H -6.718 2.706 3.539 1.00 . A A . 27 LYS HE3 1 1 4 1818 1 1 27 LYS HG2 H -2.834 4.265 4.400 1.00 . A A . 27 LYS HG2 1 1 4 1819 1 1 27 LYS HG3 H -3.331 3.990 2.735 1.00 . A A . 27 LYS HG3 1 1 4 1820 1 1 27 LYS HZ1 H -4.842 3.782 1.789 1.00 . A A . 27 LYS HZ1 1 1 4 1821 1 1 27 LYS HZ2 H -6.346 3.082 1.393 1.00 . A A . 27 LYS HZ2 1 1 4 1822 1 1 27 LYS HZ3 H -4.930 2.099 1.415 1.00 . A A . 27 LYS HZ3 1 1 4 1823 1 1 27 LYS N N -1.516 3.211 1.943 1.00 . A A . 27 LYS N 1 1 4 1824 1 1 27 LYS NZ N -5.429 2.907 1.880 1.00 . A A . 27 LYS NZ 1 1 4 1825 1 1 27 LYS O O -2.096 0.634 1.097 1.00 . A A . 27 LYS O 1 1 4 1826 1 1 28 CYS C C -2.055 -2.382 2.690 1.00 . A A . 28 CYS C 1 1 4 1827 1 1 28 CYS CA C -0.853 -1.580 2.195 1.00 . A A . 28 CYS CA 1 1 4 1828 1 1 28 CYS CB C 0.446 -2.292 2.591 1.00 . A A . 28 CYS CB 1 1 4 1829 1 1 28 CYS H H -0.473 -0.085 3.654 1.00 . A A . 28 CYS H 1 1 4 1830 1 1 28 CYS HA H -0.899 -1.497 1.121 1.00 . A A . 28 CYS HA 1 1 4 1831 1 1 28 CYS HB2 H 1.200 -1.556 2.826 1.00 . A A . 28 CYS HB2 1 1 4 1832 1 1 28 CYS HB3 H 0.268 -2.911 3.459 1.00 . A A . 28 CYS HB3 1 1 4 1833 1 1 28 CYS N N -0.895 -0.239 2.786 1.00 . A A . 28 CYS N 1 1 4 1834 1 1 28 CYS O O -2.025 -2.938 3.787 1.00 . A A . 28 CYS O 1 1 4 1835 1 1 28 CYS SG S 1.021 -3.325 1.218 1.00 . A A . 28 CYS SG 1 1 4 1836 1 1 29 ASN C C -4.655 -4.288 1.366 1.00 . A A . 29 ASN C 1 1 4 1837 1 1 29 ASN CA C -4.338 -3.115 2.289 1.00 . A A . 29 ASN CA 1 1 4 1838 1 1 29 ASN CB C -5.514 -2.135 2.295 1.00 . A A . 29 ASN CB 1 1 4 1839 1 1 29 ASN CG C -6.544 -2.566 3.329 1.00 . A A . 29 ASN CG 1 1 4 1840 1 1 29 ASN H H -3.094 -1.931 1.037 1.00 . A A . 29 ASN H 1 1 4 1841 1 1 29 ASN HA H -4.210 -3.495 3.290 1.00 . A A . 29 ASN HA 1 1 4 1842 1 1 29 ASN HB2 H -5.153 -1.149 2.540 1.00 . A A . 29 ASN HB2 1 1 4 1843 1 1 29 ASN HB3 H -5.975 -2.114 1.320 1.00 . A A . 29 ASN HB3 1 1 4 1844 1 1 29 ASN HD21 H -5.608 -1.688 4.835 1.00 . A A . 29 ASN HD21 1 1 4 1845 1 1 29 ASN HD22 H -7.049 -2.486 5.241 1.00 . A A . 29 ASN HD22 1 1 4 1846 1 1 29 ASN N N -3.120 -2.409 1.893 1.00 . A A . 29 ASN N 1 1 4 1847 1 1 29 ASN ND2 N -6.386 -2.219 4.571 1.00 . A A . 29 ASN ND2 1 1 4 1848 1 1 29 ASN O O -4.592 -4.179 0.142 1.00 . A A . 29 ASN O 1 1 4 1849 1 1 29 ASN OD1 O -7.513 -3.241 3.000 1.00 . A A . 29 ASN OD1 1 1 4 1850 1 1 30 ILE C C -6.790 -6.450 0.648 1.00 . A A . 30 ILE C 1 1 4 1851 1 1 30 ILE CA C -5.395 -6.600 1.234 1.00 . A A . 30 ILE CA 1 1 4 1852 1 1 30 ILE CB C -5.305 -7.850 2.127 1.00 . A A . 30 ILE CB 1 1 4 1853 1 1 30 ILE CD1 C -3.858 -6.862 3.894 1.00 . A A . 30 ILE CD1 1 1 4 1854 1 1 30 ILE CG1 C -5.246 -7.439 3.599 1.00 . A A . 30 ILE CG1 1 1 4 1855 1 1 30 ILE CG2 C -4.048 -8.659 1.782 1.00 . A A . 30 ILE CG2 1 1 4 1856 1 1 30 ILE H H -5.083 -5.414 2.953 1.00 . A A . 30 ILE H 1 1 4 1857 1 1 30 ILE HA H -4.703 -6.715 0.419 1.00 . A A . 30 ILE HA 1 1 4 1858 1 1 30 ILE HB H -6.177 -8.466 1.965 1.00 . A A . 30 ILE HB 1 1 4 1859 1 1 30 ILE HD11 H -3.369 -6.608 2.961 1.00 . A A . 30 ILE HD11 1 1 4 1860 1 1 30 ILE HD12 H -3.269 -7.597 4.418 1.00 . A A . 30 ILE HD12 1 1 4 1861 1 1 30 ILE HD13 H -3.957 -5.975 4.498 1.00 . A A . 30 ILE HD13 1 1 4 1862 1 1 30 ILE HG12 H -6.006 -6.697 3.802 1.00 . A A . 30 ILE HG12 1 1 4 1863 1 1 30 ILE HG13 H -5.412 -8.305 4.223 1.00 . A A . 30 ILE HG13 1 1 4 1864 1 1 30 ILE HG21 H -3.221 -7.986 1.608 1.00 . A A . 30 ILE HG21 1 1 4 1865 1 1 30 ILE HG22 H -4.229 -9.246 0.894 1.00 . A A . 30 ILE HG22 1 1 4 1866 1 1 30 ILE HG23 H -3.808 -9.316 2.605 1.00 . A A . 30 ILE HG23 1 1 4 1867 1 1 30 ILE N N -5.030 -5.404 1.978 1.00 . A A . 30 ILE N 1 1 4 1868 1 1 30 ILE O O -7.744 -6.113 1.348 1.00 . A A . 30 ILE O 1 1 4 1869 1 1 31 GLY C C -8.103 -5.413 -2.367 1.00 . A A . 31 GLY C 1 1 4 1870 1 1 31 GLY CA C -8.142 -6.576 -1.377 1.00 . A A . 31 GLY CA 1 1 4 1871 1 1 31 GLY H H -6.068 -6.943 -1.132 1.00 . A A . 31 GLY H 1 1 4 1872 1 1 31 GLY HA2 H -8.331 -7.494 -1.915 1.00 . A A . 31 GLY HA2 1 1 4 1873 1 1 31 GLY HA3 H -8.939 -6.407 -0.674 1.00 . A A . 31 GLY HA3 1 1 4 1874 1 1 31 GLY N N -6.878 -6.692 -0.649 1.00 . A A . 31 GLY N 1 1 4 1875 1 1 31 GLY O O -8.876 -5.375 -3.322 1.00 . A A . 31 GLY O 1 1 4 1876 1 1 32 LYS C C -5.573 -3.065 -3.348 1.00 . A A . 32 LYS C 1 1 4 1877 1 1 32 LYS CA C -7.049 -3.327 -3.038 1.00 . A A . 32 LYS CA 1 1 4 1878 1 1 32 LYS CB C -7.686 -2.084 -2.400 1.00 . A A . 32 LYS CB 1 1 4 1879 1 1 32 LYS CD C -7.858 -0.414 -4.265 1.00 . A A . 32 LYS CD 1 1 4 1880 1 1 32 LYS CE C -8.508 0.968 -4.173 1.00 . A A . 32 LYS CE 1 1 4 1881 1 1 32 LYS CG C -8.637 -1.413 -3.401 1.00 . A A . 32 LYS CG 1 1 4 1882 1 1 32 LYS H H -6.592 -4.564 -1.373 1.00 . A A . 32 LYS H 1 1 4 1883 1 1 32 LYS HA H -7.561 -3.546 -3.962 1.00 . A A . 32 LYS HA 1 1 4 1884 1 1 32 LYS HB2 H -8.242 -2.381 -1.523 1.00 . A A . 32 LYS HB2 1 1 4 1885 1 1 32 LYS HB3 H -6.913 -1.387 -2.115 1.00 . A A . 32 LYS HB3 1 1 4 1886 1 1 32 LYS HD2 H -6.838 -0.356 -3.915 1.00 . A A . 32 LYS HD2 1 1 4 1887 1 1 32 LYS HD3 H -7.864 -0.743 -5.294 1.00 . A A . 32 LYS HD3 1 1 4 1888 1 1 32 LYS HE2 H -9.455 0.957 -4.694 1.00 . A A . 32 LYS HE2 1 1 4 1889 1 1 32 LYS HE3 H -8.673 1.222 -3.135 1.00 . A A . 32 LYS HE3 1 1 4 1890 1 1 32 LYS HG2 H -9.083 -2.167 -4.035 1.00 . A A . 32 LYS HG2 1 1 4 1891 1 1 32 LYS HG3 H -9.415 -0.894 -2.861 1.00 . A A . 32 LYS HG3 1 1 4 1892 1 1 32 LYS HZ1 H -8.056 2.378 -5.642 1.00 . A A . 32 LYS HZ1 1 1 4 1893 1 1 32 LYS HZ2 H -6.692 1.507 -5.082 1.00 . A A . 32 LYS HZ2 1 1 4 1894 1 1 32 LYS HZ3 H -7.399 2.737 -4.116 1.00 . A A . 32 LYS HZ3 1 1 4 1895 1 1 32 LYS N N -7.188 -4.477 -2.145 1.00 . A A . 32 LYS N 1 1 4 1896 1 1 32 LYS NZ N -7.606 1.977 -4.798 1.00 . A A . 32 LYS NZ 1 1 4 1897 1 1 32 LYS O O -4.761 -2.894 -2.442 1.00 . A A . 32 LYS O 1 1 4 1898 1 1 33 LYS C C -3.746 -1.637 -6.017 1.00 . A A . 33 LYS C 1 1 4 1899 1 1 33 LYS CA C -3.849 -2.823 -5.054 1.00 . A A . 33 LYS CA 1 1 4 1900 1 1 33 LYS CB C -3.308 -4.091 -5.729 1.00 . A A . 33 LYS CB 1 1 4 1901 1 1 33 LYS CD C -2.136 -3.926 -7.948 1.00 . A A . 33 LYS CD 1 1 4 1902 1 1 33 LYS CE C -1.476 -2.737 -8.650 1.00 . A A . 33 LYS CE 1 1 4 1903 1 1 33 LYS CG C -1.972 -3.790 -6.426 1.00 . A A . 33 LYS CG 1 1 4 1904 1 1 33 LYS H H -5.923 -3.204 -5.313 1.00 . A A . 33 LYS H 1 1 4 1905 1 1 33 LYS HA H -3.247 -2.613 -4.181 1.00 . A A . 33 LYS HA 1 1 4 1906 1 1 33 LYS HB2 H -3.158 -4.855 -4.980 1.00 . A A . 33 LYS HB2 1 1 4 1907 1 1 33 LYS HB3 H -4.024 -4.442 -6.458 1.00 . A A . 33 LYS HB3 1 1 4 1908 1 1 33 LYS HD2 H -1.668 -4.843 -8.278 1.00 . A A . 33 LYS HD2 1 1 4 1909 1 1 33 LYS HD3 H -3.186 -3.950 -8.198 1.00 . A A . 33 LYS HD3 1 1 4 1910 1 1 33 LYS HE2 H -0.640 -2.387 -8.059 1.00 . A A . 33 LYS HE2 1 1 4 1911 1 1 33 LYS HE3 H -1.122 -3.046 -9.624 1.00 . A A . 33 LYS HE3 1 1 4 1912 1 1 33 LYS HG2 H -1.655 -2.784 -6.183 1.00 . A A . 33 LYS HG2 1 1 4 1913 1 1 33 LYS HG3 H -1.225 -4.492 -6.084 1.00 . A A . 33 LYS HG3 1 1 4 1914 1 1 33 LYS HZ1 H -2.020 -0.709 -8.545 1.00 . A A . 33 LYS HZ1 1 1 4 1915 1 1 33 LYS HZ2 H -3.293 -1.810 -8.165 1.00 . A A . 33 LYS HZ2 1 1 4 1916 1 1 33 LYS HZ3 H -2.799 -1.597 -9.788 1.00 . A A . 33 LYS HZ3 1 1 4 1917 1 1 33 LYS N N -5.234 -3.050 -4.634 1.00 . A A . 33 LYS N 1 1 4 1918 1 1 33 LYS NZ N -2.472 -1.640 -8.805 1.00 . A A . 33 LYS NZ 1 1 4 1919 1 1 33 LYS O O -4.095 -1.747 -7.198 1.00 . A A . 33 LYS O 1 1 4 1920 1 1 34 ASP C C -1.691 0.719 -6.956 1.00 . A A . 34 ASP C 1 1 4 1921 1 1 34 ASP CA C -3.085 0.686 -6.323 1.00 . A A . 34 ASP CA 1 1 4 1922 1 1 34 ASP CB C -3.293 1.929 -5.449 1.00 . A A . 34 ASP CB 1 1 4 1923 1 1 34 ASP CG C -4.722 1.982 -4.921 1.00 . A A . 34 ASP CG 1 1 4 1924 1 1 34 ASP H H -2.977 -0.491 -4.560 1.00 . A A . 34 ASP H 1 1 4 1925 1 1 34 ASP HA H -3.826 0.684 -7.108 1.00 . A A . 34 ASP HA 1 1 4 1926 1 1 34 ASP HB2 H -2.607 1.896 -4.616 1.00 . A A . 34 ASP HB2 1 1 4 1927 1 1 34 ASP HB3 H -3.097 2.813 -6.035 1.00 . A A . 34 ASP HB3 1 1 4 1928 1 1 34 ASP N N -3.250 -0.514 -5.510 1.00 . A A . 34 ASP N 1 1 4 1929 1 1 34 ASP O O -1.584 0.380 -8.124 1.00 . A A . 34 ASP O 1 1 4 1930 1 1 34 ASP OXT O -0.750 1.073 -6.264 1.00 . A A . 34 ASP OXT 1 1 4 1931 1 1 34 ASP OD1 O -5.536 1.179 -5.359 1.00 . A A . 34 ASP OD1 1 1 4 1932 1 1 34 ASP OD2 O -4.991 2.830 -4.084 1.00 . A A . 34 ASP OD2 1 1 5 1933 1 1 1 GLY C C 1.455 11.094 -4.958 1.00 . A A . 1 GLY C 1 1 5 1934 1 1 1 GLY CA C 0.183 10.927 -5.786 1.00 . A A . 1 GLY CA 1 1 5 1935 1 1 1 GLY H1 H -1.102 12.280 -6.727 1.00 . A A . 1 GLY H1 1 1 5 1936 1 1 1 GLY H2 H 0.131 13.014 -5.819 1.00 . A A . 1 GLY H2 1 1 5 1937 1 1 1 GLY H3 H -1.204 12.302 -5.024 1.00 . A A . 1 GLY H3 1 1 5 1938 1 1 1 GLY HA2 H -0.449 10.178 -5.328 1.00 . A A . 1 GLY HA2 1 1 5 1939 1 1 1 GLY HA3 H 0.448 10.612 -6.784 1.00 . A A . 1 GLY HA3 1 1 5 1940 1 1 1 GLY N N -0.550 12.228 -5.848 1.00 . A A . 1 GLY N 1 1 5 1941 1 1 1 GLY O O 2.537 11.298 -5.506 1.00 . A A . 1 GLY O 1 1 5 1942 1 1 2 SER C C 3.344 9.918 -2.746 1.00 . A A . 2 SER C 1 1 5 1943 1 1 2 SER CA C 2.458 11.167 -2.734 1.00 . A A . 2 SER CA 1 1 5 1944 1 1 2 SER CB C 1.974 11.452 -1.307 1.00 . A A . 2 SER CB 1 1 5 1945 1 1 2 SER H H 0.424 10.860 -3.255 1.00 . A A . 2 SER H 1 1 5 1946 1 1 2 SER HA H 3.047 12.010 -3.067 1.00 . A A . 2 SER HA 1 1 5 1947 1 1 2 SER HB2 H 1.186 10.764 -1.042 1.00 . A A . 2 SER HB2 1 1 5 1948 1 1 2 SER HB3 H 2.801 11.332 -0.617 1.00 . A A . 2 SER HB3 1 1 5 1949 1 1 2 SER HG H 0.814 12.903 -1.963 1.00 . A A . 2 SER HG 1 1 5 1950 1 1 2 SER N N 1.314 11.015 -3.635 1.00 . A A . 2 SER N 1 1 5 1951 1 1 2 SER O O 2.852 8.788 -2.792 1.00 . A A . 2 SER O 1 1 5 1952 1 1 2 SER OG O 1.475 12.784 -1.242 1.00 . A A . 2 SER OG 1 1 5 1953 1 1 3 VAL C C 5.184 7.845 -1.918 1.00 . A A . 3 VAL C 1 1 5 1954 1 1 3 VAL CA C 5.647 9.070 -2.715 1.00 . A A . 3 VAL CA 1 1 5 1955 1 1 3 VAL CB C 6.965 9.595 -2.141 1.00 . A A . 3 VAL CB 1 1 5 1956 1 1 3 VAL CG1 C 7.669 10.464 -3.188 1.00 . A A . 3 VAL CG1 1 1 5 1957 1 1 3 VAL CG2 C 6.689 10.439 -0.887 1.00 . A A . 3 VAL CG2 1 1 5 1958 1 1 3 VAL H H 4.975 11.069 -2.670 1.00 . A A . 3 VAL H 1 1 5 1959 1 1 3 VAL HA H 5.815 8.767 -3.737 1.00 . A A . 3 VAL HA 1 1 5 1960 1 1 3 VAL HB H 7.598 8.762 -1.883 1.00 . A A . 3 VAL HB 1 1 5 1961 1 1 3 VAL HG11 H 7.943 9.855 -4.036 1.00 . A A . 3 VAL HG11 1 1 5 1962 1 1 3 VAL HG12 H 8.557 10.899 -2.755 1.00 . A A . 3 VAL HG12 1 1 5 1963 1 1 3 VAL HG13 H 7.004 11.252 -3.509 1.00 . A A . 3 VAL HG13 1 1 5 1964 1 1 3 VAL HG21 H 7.196 10.000 -0.040 1.00 . A A . 3 VAL HG21 1 1 5 1965 1 1 3 VAL HG22 H 5.627 10.468 -0.693 1.00 . A A . 3 VAL HG22 1 1 5 1966 1 1 3 VAL HG23 H 7.051 11.443 -1.042 1.00 . A A . 3 VAL HG23 1 1 5 1967 1 1 3 VAL N N 4.657 10.146 -2.705 1.00 . A A . 3 VAL N 1 1 5 1968 1 1 3 VAL O O 5.398 6.706 -2.342 1.00 . A A . 3 VAL O 1 1 5 1969 1 1 4 GLY C C 3.645 5.787 -0.756 1.00 . A A . 4 GLY C 1 1 5 1970 1 1 4 GLY CA C 4.067 6.987 0.079 1.00 . A A . 4 GLY CA 1 1 5 1971 1 1 4 GLY H H 4.414 9.008 -0.483 1.00 . A A . 4 GLY H 1 1 5 1972 1 1 4 GLY HA2 H 4.856 6.683 0.753 1.00 . A A . 4 GLY HA2 1 1 5 1973 1 1 4 GLY HA3 H 3.220 7.327 0.654 1.00 . A A . 4 GLY HA3 1 1 5 1974 1 1 4 GLY N N 4.552 8.083 -0.768 1.00 . A A . 4 GLY N 1 1 5 1975 1 1 4 GLY O O 3.937 4.647 -0.406 1.00 . A A . 4 GLY O 1 1 5 1976 1 1 5 CYS C C 3.647 4.074 -3.167 1.00 . A A . 5 CYS C 1 1 5 1977 1 1 5 CYS CA C 2.497 4.992 -2.748 1.00 . A A . 5 CYS CA 1 1 5 1978 1 1 5 CYS CB C 1.842 5.589 -3.996 1.00 . A A . 5 CYS CB 1 1 5 1979 1 1 5 CYS H H 2.760 6.987 -2.092 1.00 . A A . 5 CYS H 1 1 5 1980 1 1 5 CYS HA H 1.766 4.402 -2.219 1.00 . A A . 5 CYS HA 1 1 5 1981 1 1 5 CYS HB2 H 2.607 5.974 -4.653 1.00 . A A . 5 CYS HB2 1 1 5 1982 1 1 5 CYS HB3 H 1.288 4.821 -4.504 1.00 . A A . 5 CYS HB3 1 1 5 1983 1 1 5 CYS N N 2.960 6.056 -1.864 1.00 . A A . 5 CYS N 1 1 5 1984 1 1 5 CYS O O 3.431 2.897 -3.438 1.00 . A A . 5 CYS O 1 1 5 1985 1 1 5 CYS SG S 0.721 6.936 -3.524 1.00 . A A . 5 CYS SG 1 1 5 1986 1 1 6 ALA C C 6.568 3.111 -2.324 1.00 . A A . 6 ALA C 1 1 5 1987 1 1 6 ALA CA C 6.032 3.817 -3.567 1.00 . A A . 6 ALA CA 1 1 5 1988 1 1 6 ALA CB C 7.112 4.721 -4.167 1.00 . A A . 6 ALA CB 1 1 5 1989 1 1 6 ALA H H 4.975 5.561 -2.960 1.00 . A A . 6 ALA H 1 1 5 1990 1 1 6 ALA HA H 5.746 3.075 -4.294 1.00 . A A . 6 ALA HA 1 1 5 1991 1 1 6 ALA HB1 H 7.526 5.352 -3.394 1.00 . A A . 6 ALA HB1 1 1 5 1992 1 1 6 ALA HB2 H 6.675 5.339 -4.939 1.00 . A A . 6 ALA HB2 1 1 5 1993 1 1 6 ALA HB3 H 7.896 4.113 -4.594 1.00 . A A . 6 ALA HB3 1 1 5 1994 1 1 6 ALA N N 4.860 4.611 -3.201 1.00 . A A . 6 ALA N 1 1 5 1995 1 1 6 ALA O O 6.850 1.907 -2.333 1.00 . A A . 6 ALA O 1 1 5 1996 1 1 7 GLU C C 6.125 2.265 0.499 1.00 . A A . 7 GLU C 1 1 5 1997 1 1 7 GLU CA C 7.131 3.304 0.019 1.00 . A A . 7 GLU CA 1 1 5 1998 1 1 7 GLU CB C 7.283 4.406 1.072 1.00 . A A . 7 GLU CB 1 1 5 1999 1 1 7 GLU CD C 7.884 6.444 -0.254 1.00 . A A . 7 GLU CD 1 1 5 2000 1 1 7 GLU CG C 8.416 5.355 0.668 1.00 . A A . 7 GLU CG 1 1 5 2001 1 1 7 GLU H H 6.402 4.815 -1.291 1.00 . A A . 7 GLU H 1 1 5 2002 1 1 7 GLU HA H 8.087 2.827 -0.136 1.00 . A A . 7 GLU HA 1 1 5 2003 1 1 7 GLU HB2 H 6.358 4.959 1.150 1.00 . A A . 7 GLU HB2 1 1 5 2004 1 1 7 GLU HB3 H 7.515 3.958 2.028 1.00 . A A . 7 GLU HB3 1 1 5 2005 1 1 7 GLU HG2 H 8.834 5.812 1.552 1.00 . A A . 7 GLU HG2 1 1 5 2006 1 1 7 GLU HG3 H 9.186 4.799 0.154 1.00 . A A . 7 GLU HG3 1 1 5 2007 1 1 7 GLU N N 6.668 3.867 -1.243 1.00 . A A . 7 GLU N 1 1 5 2008 1 1 7 GLU O O 6.494 1.235 1.057 1.00 . A A . 7 GLU O 1 1 5 2009 1 1 7 GLU OE1 O 7.171 7.306 0.228 1.00 . A A . 7 GLU OE1 1 1 5 2010 1 1 7 GLU OE2 O 8.195 6.398 -1.431 1.00 . A A . 7 GLU OE2 1 1 5 2011 1 1 8 CYS C C 4.090 0.205 0.329 1.00 . A A . 8 CYS C 1 1 5 2012 1 1 8 CYS CA C 3.764 1.661 0.672 1.00 . A A . 8 CYS CA 1 1 5 2013 1 1 8 CYS CB C 2.454 2.092 0.012 1.00 . A A . 8 CYS CB 1 1 5 2014 1 1 8 CYS H H 4.624 3.403 -0.181 1.00 . A A . 8 CYS H 1 1 5 2015 1 1 8 CYS HA H 3.642 1.741 1.737 1.00 . A A . 8 CYS HA 1 1 5 2016 1 1 8 CYS HB2 H 2.624 2.971 -0.591 1.00 . A A . 8 CYS HB2 1 1 5 2017 1 1 8 CYS HB3 H 2.072 1.304 -0.607 1.00 . A A . 8 CYS HB3 1 1 5 2018 1 1 8 CYS N N 4.846 2.555 0.270 1.00 . A A . 8 CYS N 1 1 5 2019 1 1 8 CYS O O 4.218 -0.628 1.226 1.00 . A A . 8 CYS O 1 1 5 2020 1 1 8 CYS SG S 1.259 2.474 1.306 1.00 . A A . 8 CYS SG 1 1 5 2021 1 1 9 PRO C C 5.901 -1.940 -0.690 1.00 . A A . 9 PRO C 1 1 5 2022 1 1 9 PRO CA C 4.601 -1.504 -1.349 1.00 . A A . 9 PRO CA 1 1 5 2023 1 1 9 PRO CB C 4.750 -1.439 -2.875 1.00 . A A . 9 PRO CB 1 1 5 2024 1 1 9 PRO CD C 4.121 0.780 -2.086 1.00 . A A . 9 PRO CD 1 1 5 2025 1 1 9 PRO CG C 4.769 0.011 -3.238 1.00 . A A . 9 PRO CG 1 1 5 2026 1 1 9 PRO HA H 3.804 -2.183 -1.090 1.00 . A A . 9 PRO HA 1 1 5 2027 1 1 9 PRO HB2 H 5.676 -1.910 -3.176 1.00 . A A . 9 PRO HB2 1 1 5 2028 1 1 9 PRO HB3 H 3.916 -1.926 -3.350 1.00 . A A . 9 PRO HB3 1 1 5 2029 1 1 9 PRO HD2 H 4.647 1.706 -1.908 1.00 . A A . 9 PRO HD2 1 1 5 2030 1 1 9 PRO HD3 H 3.082 0.967 -2.296 1.00 . A A . 9 PRO HD3 1 1 5 2031 1 1 9 PRO HG2 H 5.789 0.339 -3.379 1.00 . A A . 9 PRO HG2 1 1 5 2032 1 1 9 PRO HG3 H 4.201 0.173 -4.142 1.00 . A A . 9 PRO HG3 1 1 5 2033 1 1 9 PRO N N 4.253 -0.119 -0.935 1.00 . A A . 9 PRO N 1 1 5 2034 1 1 9 PRO O O 6.003 -3.052 -0.167 1.00 . A A . 9 PRO O 1 1 5 2035 1 1 10 MET C C 7.971 -1.610 1.424 1.00 . A A . 10 MET C 1 1 5 2036 1 1 10 MET CA C 8.169 -1.334 -0.067 1.00 . A A . 10 MET CA 1 1 5 2037 1 1 10 MET CB C 9.120 -0.149 -0.260 1.00 . A A . 10 MET CB 1 1 5 2038 1 1 10 MET CE C 11.537 -1.103 -3.273 1.00 . A A . 10 MET CE 1 1 5 2039 1 1 10 MET CG C 9.531 -0.045 -1.736 1.00 . A A . 10 MET CG 1 1 5 2040 1 1 10 MET H H 6.740 -0.160 -1.107 1.00 . A A . 10 MET H 1 1 5 2041 1 1 10 MET HA H 8.596 -2.208 -0.530 1.00 . A A . 10 MET HA 1 1 5 2042 1 1 10 MET HB2 H 8.622 0.762 0.044 1.00 . A A . 10 MET HB2 1 1 5 2043 1 1 10 MET HB3 H 9.998 -0.294 0.346 1.00 . A A . 10 MET HB3 1 1 5 2044 1 1 10 MET HE1 H 11.213 -0.431 -4.055 1.00 . A A . 10 MET HE1 1 1 5 2045 1 1 10 MET HE2 H 12.031 -1.960 -3.712 1.00 . A A . 10 MET HE2 1 1 5 2046 1 1 10 MET HE3 H 12.225 -0.588 -2.621 1.00 . A A . 10 MET HE3 1 1 5 2047 1 1 10 MET HG2 H 8.683 0.274 -2.327 1.00 . A A . 10 MET HG2 1 1 5 2048 1 1 10 MET HG3 H 10.330 0.677 -1.836 1.00 . A A . 10 MET HG3 1 1 5 2049 1 1 10 MET N N 6.885 -1.041 -0.693 1.00 . A A . 10 MET N 1 1 5 2050 1 1 10 MET O O 8.610 -2.491 1.998 1.00 . A A . 10 MET O 1 1 5 2051 1 1 10 MET SD S 10.100 -1.666 -2.322 1.00 . A A . 10 MET SD 1 1 5 2052 1 1 11 HIS C C 5.750 -2.124 3.696 1.00 . A A . 11 HIS C 1 1 5 2053 1 1 11 HIS CA C 6.775 -1.008 3.466 1.00 . A A . 11 HIS CA 1 1 5 2054 1 1 11 HIS CB C 6.246 0.312 4.043 1.00 . A A . 11 HIS CB 1 1 5 2055 1 1 11 HIS CD2 C 7.676 1.652 5.791 1.00 . A A . 11 HIS CD2 1 1 5 2056 1 1 11 HIS CE1 C 7.578 0.237 7.430 1.00 . A A . 11 HIS CE1 1 1 5 2057 1 1 11 HIS CG C 6.924 0.591 5.355 1.00 . A A . 11 HIS CG 1 1 5 2058 1 1 11 HIS H H 6.589 -0.160 1.525 1.00 . A A . 11 HIS H 1 1 5 2059 1 1 11 HIS HA H 7.689 -1.269 3.979 1.00 . A A . 11 HIS HA 1 1 5 2060 1 1 11 HIS HB2 H 6.452 1.116 3.353 1.00 . A A . 11 HIS HB2 1 1 5 2061 1 1 11 HIS HB3 H 5.180 0.235 4.198 1.00 . A A . 11 HIS HB3 1 1 5 2062 1 1 11 HIS HD2 H 7.910 2.530 5.205 1.00 . A A . 11 HIS HD2 1 1 5 2063 1 1 11 HIS HE1 H 7.715 -0.235 8.392 1.00 . A A . 11 HIS HE1 1 1 5 2064 1 1 11 HIS HE2 H 8.640 2.016 7.660 1.00 . A A . 11 HIS HE2 1 1 5 2065 1 1 11 HIS N N 7.069 -0.848 2.041 1.00 . A A . 11 HIS N 1 1 5 2066 1 1 11 HIS ND1 N 6.874 -0.300 6.418 1.00 . A A . 11 HIS ND1 1 1 5 2067 1 1 11 HIS NE2 N 8.089 1.427 7.101 1.00 . A A . 11 HIS NE2 1 1 5 2068 1 1 11 HIS O O 5.102 -2.177 4.747 1.00 . A A . 11 HIS O 1 1 5 2069 1 1 12 CYS C C 5.423 -5.390 3.319 1.00 . A A . 12 CYS C 1 1 5 2070 1 1 12 CYS CA C 4.679 -4.144 2.850 1.00 . A A . 12 CYS CA 1 1 5 2071 1 1 12 CYS CB C 3.974 -4.422 1.523 1.00 . A A . 12 CYS CB 1 1 5 2072 1 1 12 CYS H H 6.168 -2.945 1.917 1.00 . A A . 12 CYS H 1 1 5 2073 1 1 12 CYS HA H 3.933 -3.890 3.590 1.00 . A A . 12 CYS HA 1 1 5 2074 1 1 12 CYS HB2 H 4.078 -3.567 0.874 1.00 . A A . 12 CYS HB2 1 1 5 2075 1 1 12 CYS HB3 H 4.415 -5.289 1.054 1.00 . A A . 12 CYS HB3 1 1 5 2076 1 1 12 CYS N N 5.618 -3.025 2.725 1.00 . A A . 12 CYS N 1 1 5 2077 1 1 12 CYS O O 6.580 -5.606 2.963 1.00 . A A . 12 CYS O 1 1 5 2078 1 1 12 CYS SG S 2.216 -4.735 1.835 1.00 . A A . 12 CYS SG 1 1 5 2079 1 1 13 LYS C C 4.997 -8.659 3.977 1.00 . A A . 13 LYS C 1 1 5 2080 1 1 13 LYS CA C 5.389 -7.375 4.726 1.00 . A A . 13 LYS CA 1 1 5 2081 1 1 13 LYS CB C 5.003 -7.485 6.208 1.00 . A A . 13 LYS CB 1 1 5 2082 1 1 13 LYS CD C 5.277 -5.090 6.964 1.00 . A A . 13 LYS CD 1 1 5 2083 1 1 13 LYS CE C 6.414 -4.066 6.858 1.00 . A A . 13 LYS CE 1 1 5 2084 1 1 13 LYS CG C 5.859 -6.513 7.040 1.00 . A A . 13 LYS CG 1 1 5 2085 1 1 13 LYS H H 3.858 -5.936 4.427 1.00 . A A . 13 LYS H 1 1 5 2086 1 1 13 LYS HA H 6.460 -7.265 4.664 1.00 . A A . 13 LYS HA 1 1 5 2087 1 1 13 LYS HB2 H 3.958 -7.240 6.327 1.00 . A A . 13 LYS HB2 1 1 5 2088 1 1 13 LYS HB3 H 5.175 -8.496 6.551 1.00 . A A . 13 LYS HB3 1 1 5 2089 1 1 13 LYS HD2 H 4.636 -5.008 6.099 1.00 . A A . 13 LYS HD2 1 1 5 2090 1 1 13 LYS HD3 H 4.700 -4.892 7.856 1.00 . A A . 13 LYS HD3 1 1 5 2091 1 1 13 LYS HE2 H 7.079 -4.179 7.703 1.00 . A A . 13 LYS HE2 1 1 5 2092 1 1 13 LYS HE3 H 6.965 -4.233 5.942 1.00 . A A . 13 LYS HE3 1 1 5 2093 1 1 13 LYS HG2 H 5.871 -6.842 8.070 1.00 . A A . 13 LYS HG2 1 1 5 2094 1 1 13 LYS HG3 H 6.870 -6.508 6.656 1.00 . A A . 13 LYS HG3 1 1 5 2095 1 1 13 LYS HZ1 H 5.427 -2.474 5.907 1.00 . A A . 13 LYS HZ1 1 1 5 2096 1 1 13 LYS HZ2 H 6.597 -1.989 7.049 1.00 . A A . 13 LYS HZ2 1 1 5 2097 1 1 13 LYS HZ3 H 5.104 -2.607 7.579 1.00 . A A . 13 LYS HZ3 1 1 5 2098 1 1 13 LYS N N 4.766 -6.179 4.159 1.00 . A A . 13 LYS N 1 1 5 2099 1 1 13 LYS NZ N 5.844 -2.684 6.854 1.00 . A A . 13 LYS NZ 1 1 5 2100 1 1 13 LYS O O 3.853 -8.836 3.554 1.00 . A A . 13 LYS O 1 1 5 2101 1 1 14 GLY C C 4.526 -11.549 3.514 1.00 . A A . 14 GLY C 1 1 5 2102 1 1 14 GLY CA C 5.816 -10.821 3.126 1.00 . A A . 14 GLY CA 1 1 5 2103 1 1 14 GLY H H 6.870 -9.317 4.185 1.00 . A A . 14 GLY H 1 1 5 2104 1 1 14 GLY HA2 H 5.806 -10.640 2.062 1.00 . A A . 14 GLY HA2 1 1 5 2105 1 1 14 GLY HA3 H 6.657 -11.459 3.362 1.00 . A A . 14 GLY HA3 1 1 5 2106 1 1 14 GLY N N 5.987 -9.540 3.823 1.00 . A A . 14 GLY N 1 1 5 2107 1 1 14 GLY O O 4.115 -11.536 4.674 1.00 . A A . 14 GLY O 1 1 5 2108 1 1 15 LYS C C 1.440 -12.074 2.470 1.00 . A A . 15 LYS C 1 1 5 2109 1 1 15 LYS CA C 2.669 -12.955 2.692 1.00 . A A . 15 LYS CA 1 1 5 2110 1 1 15 LYS CB C 2.609 -13.590 4.090 1.00 . A A . 15 LYS CB 1 1 5 2111 1 1 15 LYS CD C 0.325 -14.529 4.566 1.00 . A A . 15 LYS CD 1 1 5 2112 1 1 15 LYS CE C -0.723 -15.161 3.645 1.00 . A A . 15 LYS CE 1 1 5 2113 1 1 15 LYS CG C 1.737 -14.852 4.053 1.00 . A A . 15 LYS CG 1 1 5 2114 1 1 15 LYS H H 4.315 -12.154 1.622 1.00 . A A . 15 LYS H 1 1 5 2115 1 1 15 LYS HA H 2.652 -13.747 1.957 1.00 . A A . 15 LYS HA 1 1 5 2116 1 1 15 LYS HB2 H 3.609 -13.854 4.405 1.00 . A A . 15 LYS HB2 1 1 5 2117 1 1 15 LYS HB3 H 2.188 -12.885 4.790 1.00 . A A . 15 LYS HB3 1 1 5 2118 1 1 15 LYS HD2 H 0.209 -14.922 5.565 1.00 . A A . 15 LYS HD2 1 1 5 2119 1 1 15 LYS HD3 H 0.184 -13.459 4.584 1.00 . A A . 15 LYS HD3 1 1 5 2120 1 1 15 LYS HE2 H -0.273 -15.966 3.082 1.00 . A A . 15 LYS HE2 1 1 5 2121 1 1 15 LYS HE3 H -1.537 -15.552 4.243 1.00 . A A . 15 LYS HE3 1 1 5 2122 1 1 15 LYS HG2 H 1.681 -15.222 3.039 1.00 . A A . 15 LYS HG2 1 1 5 2123 1 1 15 LYS HG3 H 2.181 -15.607 4.685 1.00 . A A . 15 LYS HG3 1 1 5 2124 1 1 15 LYS HZ1 H -0.465 -13.472 2.430 1.00 . A A . 15 LYS HZ1 1 1 5 2125 1 1 15 LYS HZ2 H -1.998 -13.576 3.176 1.00 . A A . 15 LYS HZ2 1 1 5 2126 1 1 15 LYS HZ3 H -1.629 -14.581 1.857 1.00 . A A . 15 LYS HZ3 1 1 5 2127 1 1 15 LYS N N 3.912 -12.190 2.514 1.00 . A A . 15 LYS N 1 1 5 2128 1 1 15 LYS NZ N -1.247 -14.124 2.708 1.00 . A A . 15 LYS NZ 1 1 5 2129 1 1 15 LYS O O 0.357 -12.578 2.157 1.00 . A A . 15 LYS O 1 1 5 2130 1 1 16 MET C C 1.054 -8.565 1.713 1.00 . A A . 16 MET C 1 1 5 2131 1 1 16 MET CA C 0.524 -9.817 2.409 1.00 . A A . 16 MET CA 1 1 5 2132 1 1 16 MET CB C -0.100 -9.424 3.757 1.00 . A A . 16 MET CB 1 1 5 2133 1 1 16 MET CE C -3.019 -11.486 5.306 1.00 . A A . 16 MET CE 1 1 5 2134 1 1 16 MET CG C -0.538 -10.675 4.528 1.00 . A A . 16 MET CG 1 1 5 2135 1 1 16 MET H H 2.505 -10.423 2.854 1.00 . A A . 16 MET H 1 1 5 2136 1 1 16 MET HA H -0.232 -10.274 1.789 1.00 . A A . 16 MET HA 1 1 5 2137 1 1 16 MET HB2 H 0.629 -8.881 4.342 1.00 . A A . 16 MET HB2 1 1 5 2138 1 1 16 MET HB3 H -0.959 -8.794 3.584 1.00 . A A . 16 MET HB3 1 1 5 2139 1 1 16 MET HE1 H -3.982 -11.923 5.080 1.00 . A A . 16 MET HE1 1 1 5 2140 1 1 16 MET HE2 H -3.156 -10.503 5.736 1.00 . A A . 16 MET HE2 1 1 5 2141 1 1 16 MET HE3 H -2.499 -12.113 6.012 1.00 . A A . 16 MET HE3 1 1 5 2142 1 1 16 MET HG2 H 0.247 -11.415 4.490 1.00 . A A . 16 MET HG2 1 1 5 2143 1 1 16 MET HG3 H -0.732 -10.412 5.558 1.00 . A A . 16 MET HG3 1 1 5 2144 1 1 16 MET N N 1.617 -10.764 2.615 1.00 . A A . 16 MET N 1 1 5 2145 1 1 16 MET O O 1.624 -7.691 2.365 1.00 . A A . 16 MET O 1 1 5 2146 1 1 16 MET SD S -2.047 -11.350 3.784 1.00 . A A . 16 MET SD 1 1 5 2147 1 1 17 ALA C C 0.439 -6.801 -1.406 1.00 . A A . 17 ALA C 1 1 5 2148 1 1 17 ALA CA C 1.389 -7.301 -0.322 1.00 . A A . 17 ALA CA 1 1 5 2149 1 1 17 ALA CB C 2.746 -7.608 -0.941 1.00 . A A . 17 ALA CB 1 1 5 2150 1 1 17 ALA H H 0.438 -9.192 -0.096 1.00 . A A . 17 ALA H 1 1 5 2151 1 1 17 ALA HA H 1.521 -6.504 0.396 1.00 . A A . 17 ALA HA 1 1 5 2152 1 1 17 ALA HB1 H 2.934 -8.667 -0.886 1.00 . A A . 17 ALA HB1 1 1 5 2153 1 1 17 ALA HB2 H 3.512 -7.074 -0.401 1.00 . A A . 17 ALA HB2 1 1 5 2154 1 1 17 ALA HB3 H 2.747 -7.291 -1.975 1.00 . A A . 17 ALA HB3 1 1 5 2155 1 1 17 ALA N N 0.885 -8.472 0.393 1.00 . A A . 17 ALA N 1 1 5 2156 1 1 17 ALA O O 0.241 -7.438 -2.445 1.00 . A A . 17 ALA O 1 1 5 2157 1 1 18 LYS C C -1.109 -3.475 -1.650 1.00 . A A . 18 LYS C 1 1 5 2158 1 1 18 LYS CA C -1.006 -4.942 -2.062 1.00 . A A . 18 LYS CA 1 1 5 2159 1 1 18 LYS CB C -2.399 -5.591 -2.119 1.00 . A A . 18 LYS CB 1 1 5 2160 1 1 18 LYS CD C -3.369 -7.773 -1.395 1.00 . A A . 18 LYS CD 1 1 5 2161 1 1 18 LYS CE C -2.347 -8.871 -1.705 1.00 . A A . 18 LYS CE 1 1 5 2162 1 1 18 LYS CG C -2.647 -6.505 -0.914 1.00 . A A . 18 LYS CG 1 1 5 2163 1 1 18 LYS H H 0.140 -5.192 -0.308 1.00 . A A . 18 LYS H 1 1 5 2164 1 1 18 LYS HA H -0.573 -4.984 -3.051 1.00 . A A . 18 LYS HA 1 1 5 2165 1 1 18 LYS HB2 H -3.149 -4.813 -2.128 1.00 . A A . 18 LYS HB2 1 1 5 2166 1 1 18 LYS HB3 H -2.480 -6.168 -3.027 1.00 . A A . 18 LYS HB3 1 1 5 2167 1 1 18 LYS HD2 H -4.041 -8.118 -0.624 1.00 . A A . 18 LYS HD2 1 1 5 2168 1 1 18 LYS HD3 H -3.935 -7.548 -2.286 1.00 . A A . 18 LYS HD3 1 1 5 2169 1 1 18 LYS HE2 H -1.613 -8.915 -0.914 1.00 . A A . 18 LYS HE2 1 1 5 2170 1 1 18 LYS HE3 H -2.855 -9.824 -1.777 1.00 . A A . 18 LYS HE3 1 1 5 2171 1 1 18 LYS HG2 H -1.711 -6.773 -0.453 1.00 . A A . 18 LYS HG2 1 1 5 2172 1 1 18 LYS HG3 H -3.264 -5.991 -0.198 1.00 . A A . 18 LYS HG3 1 1 5 2173 1 1 18 LYS HZ1 H -1.425 -9.456 -3.484 1.00 . A A . 18 LYS HZ1 1 1 5 2174 1 1 18 LYS HZ2 H -0.785 -8.022 -2.818 1.00 . A A . 18 LYS HZ2 1 1 5 2175 1 1 18 LYS HZ3 H -2.303 -8.007 -3.602 1.00 . A A . 18 LYS HZ3 1 1 5 2176 1 1 18 LYS N N -0.104 -5.631 -1.144 1.00 . A A . 18 LYS N 1 1 5 2177 1 1 18 LYS NZ N -1.669 -8.570 -3.001 1.00 . A A . 18 LYS NZ 1 1 5 2178 1 1 18 LYS O O -1.819 -3.128 -0.698 1.00 . A A . 18 LYS O 1 1 5 2179 1 1 19 PRO C C -1.535 -0.405 -2.611 1.00 . A A . 19 PRO C 1 1 5 2180 1 1 19 PRO CA C -0.358 -1.164 -2.008 1.00 . A A . 19 PRO CA 1 1 5 2181 1 1 19 PRO CB C 0.958 -0.712 -2.635 1.00 . A A . 19 PRO CB 1 1 5 2182 1 1 19 PRO CD C 0.494 -2.939 -3.463 1.00 . A A . 19 PRO CD 1 1 5 2183 1 1 19 PRO CG C 1.121 -1.590 -3.831 1.00 . A A . 19 PRO CG 1 1 5 2184 1 1 19 PRO HA H -0.318 -1.009 -0.944 1.00 . A A . 19 PRO HA 1 1 5 2185 1 1 19 PRO HB2 H 0.898 0.328 -2.933 1.00 . A A . 19 PRO HB2 1 1 5 2186 1 1 19 PRO HB3 H 1.775 -0.864 -1.949 1.00 . A A . 19 PRO HB3 1 1 5 2187 1 1 19 PRO HD2 H -0.081 -3.326 -4.294 1.00 . A A . 19 PRO HD2 1 1 5 2188 1 1 19 PRO HD3 H 1.255 -3.643 -3.163 1.00 . A A . 19 PRO HD3 1 1 5 2189 1 1 19 PRO HG2 H 0.608 -1.157 -4.681 1.00 . A A . 19 PRO HG2 1 1 5 2190 1 1 19 PRO HG3 H 2.165 -1.725 -4.057 1.00 . A A . 19 PRO HG3 1 1 5 2191 1 1 19 PRO N N -0.385 -2.619 -2.321 1.00 . A A . 19 PRO N 1 1 5 2192 1 1 19 PRO O O -2.080 -0.787 -3.650 1.00 . A A . 19 PRO O 1 1 5 2193 1 1 20 THR C C -2.892 2.908 -1.826 1.00 . A A . 20 THR C 1 1 5 2194 1 1 20 THR CA C -3.005 1.515 -2.424 1.00 . A A . 20 THR CA 1 1 5 2195 1 1 20 THR CB C -4.364 0.918 -2.055 1.00 . A A . 20 THR CB 1 1 5 2196 1 1 20 THR CG2 C -5.400 1.299 -3.114 1.00 . A A . 20 THR CG2 1 1 5 2197 1 1 20 THR H H -1.434 0.932 -1.134 1.00 . A A . 20 THR H 1 1 5 2198 1 1 20 THR HA H -2.940 1.592 -3.497 1.00 . A A . 20 THR HA 1 1 5 2199 1 1 20 THR HB H -4.675 1.310 -1.101 1.00 . A A . 20 THR HB 1 1 5 2200 1 1 20 THR HG1 H -3.724 -0.795 -2.725 1.00 . A A . 20 THR HG1 1 1 5 2201 1 1 20 THR HG21 H -4.899 1.667 -3.998 1.00 . A A . 20 THR HG21 1 1 5 2202 1 1 20 THR HG22 H -6.050 2.068 -2.726 1.00 . A A . 20 THR HG22 1 1 5 2203 1 1 20 THR HG23 H -5.986 0.430 -3.374 1.00 . A A . 20 THR HG23 1 1 5 2204 1 1 20 THR N N -1.910 0.680 -1.952 1.00 . A A . 20 THR N 1 1 5 2205 1 1 20 THR O O -2.506 3.074 -0.661 1.00 . A A . 20 THR O 1 1 5 2206 1 1 20 THR OG1 O -4.269 -0.496 -1.985 1.00 . A A . 20 THR OG1 1 1 5 2207 1 1 21 CYS C C -4.550 5.925 -2.269 1.00 . A A . 21 CYS C 1 1 5 2208 1 1 21 CYS CA C -3.164 5.291 -2.199 1.00 . A A . 21 CYS CA 1 1 5 2209 1 1 21 CYS CB C -2.162 6.067 -3.060 1.00 . A A . 21 CYS CB 1 1 5 2210 1 1 21 CYS H H -3.515 3.691 -3.554 1.00 . A A . 21 CYS H 1 1 5 2211 1 1 21 CYS HA H -2.832 5.321 -1.177 1.00 . A A . 21 CYS HA 1 1 5 2212 1 1 21 CYS HB2 H -2.050 5.575 -4.011 1.00 . A A . 21 CYS HB2 1 1 5 2213 1 1 21 CYS HB3 H -2.515 7.076 -3.213 1.00 . A A . 21 CYS HB3 1 1 5 2214 1 1 21 CYS N N -3.223 3.901 -2.631 1.00 . A A . 21 CYS N 1 1 5 2215 1 1 21 CYS O O -5.291 5.725 -3.233 1.00 . A A . 21 CYS O 1 1 5 2216 1 1 21 CYS SG S -0.564 6.109 -2.202 1.00 . A A . 21 CYS SG 1 1 5 2217 1 1 22 GLU C C -6.036 8.716 -0.561 1.00 . A A . 22 GLU C 1 1 5 2218 1 1 22 GLU CA C -6.191 7.322 -1.154 1.00 . A A . 22 GLU CA 1 1 5 2219 1 1 22 GLU CB C -7.150 6.480 -0.297 1.00 . A A . 22 GLU CB 1 1 5 2220 1 1 22 GLU CD C -7.184 4.720 1.494 1.00 . A A . 22 GLU CD 1 1 5 2221 1 1 22 GLU CG C -6.400 5.886 0.905 1.00 . A A . 22 GLU CG 1 1 5 2222 1 1 22 GLU H H -4.267 6.797 -0.492 1.00 . A A . 22 GLU H 1 1 5 2223 1 1 22 GLU HA H -6.600 7.410 -2.150 1.00 . A A . 22 GLU HA 1 1 5 2224 1 1 22 GLU HB2 H -7.959 7.104 0.057 1.00 . A A . 22 GLU HB2 1 1 5 2225 1 1 22 GLU HB3 H -7.553 5.677 -0.897 1.00 . A A . 22 GLU HB3 1 1 5 2226 1 1 22 GLU HG2 H -5.430 5.535 0.588 1.00 . A A . 22 GLU HG2 1 1 5 2227 1 1 22 GLU HG3 H -6.274 6.648 1.660 1.00 . A A . 22 GLU HG3 1 1 5 2228 1 1 22 GLU N N -4.896 6.676 -1.231 1.00 . A A . 22 GLU N 1 1 5 2229 1 1 22 GLU O O -5.604 8.876 0.576 1.00 . A A . 22 GLU O 1 1 5 2230 1 1 22 GLU OE1 O -7.055 3.620 0.977 1.00 . A A . 22 GLU OE1 1 1 5 2231 1 1 22 GLU OE2 O -7.885 4.937 2.471 1.00 . A A . 22 GLU OE2 1 1 5 2232 1 1 23 ASN C C -4.862 11.441 -0.466 1.00 . A A . 23 ASN C 1 1 5 2233 1 1 23 ASN CA C -6.275 11.117 -0.969 1.00 . A A . 23 ASN CA 1 1 5 2234 1 1 23 ASN CB C -7.383 11.459 0.059 1.00 . A A . 23 ASN CB 1 1 5 2235 1 1 23 ASN CG C -6.879 11.505 1.503 1.00 . A A . 23 ASN CG 1 1 5 2236 1 1 23 ASN H H -6.679 9.480 -2.260 1.00 . A A . 23 ASN H 1 1 5 2237 1 1 23 ASN HA H -6.447 11.716 -1.854 1.00 . A A . 23 ASN HA 1 1 5 2238 1 1 23 ASN HB2 H -7.801 12.422 -0.187 1.00 . A A . 23 ASN HB2 1 1 5 2239 1 1 23 ASN HB3 H -8.161 10.716 -0.014 1.00 . A A . 23 ASN HB3 1 1 5 2240 1 1 23 ASN HD21 H -6.179 9.650 1.500 1.00 . A A . 23 ASN HD21 1 1 5 2241 1 1 23 ASN HD22 H -5.984 10.512 2.952 1.00 . A A . 23 ASN HD22 1 1 5 2242 1 1 23 ASN N N -6.372 9.706 -1.364 1.00 . A A . 23 ASN N 1 1 5 2243 1 1 23 ASN ND2 N -6.301 10.472 2.030 1.00 . A A . 23 ASN ND2 1 1 5 2244 1 1 23 ASN O O -4.664 12.023 0.597 1.00 . A A . 23 ASN O 1 1 5 2245 1 1 23 ASN OD1 O -7.034 12.521 2.176 1.00 . A A . 23 ASN OD1 1 1 5 2246 1 1 24 GLU C C -1.965 10.367 0.141 1.00 . A A . 24 GLU C 1 1 5 2247 1 1 24 GLU CA C -2.463 11.268 -0.986 1.00 . A A . 24 GLU CA 1 1 5 2248 1 1 24 GLU CB C -2.188 12.743 -0.655 1.00 . A A . 24 GLU CB 1 1 5 2249 1 1 24 GLU CD C -1.364 12.960 -3.019 1.00 . A A . 24 GLU CD 1 1 5 2250 1 1 24 GLU CG C -2.251 13.577 -1.943 1.00 . A A . 24 GLU CG 1 1 5 2251 1 1 24 GLU H H -4.123 10.595 -2.114 1.00 . A A . 24 GLU H 1 1 5 2252 1 1 24 GLU HA H -1.902 11.016 -1.872 1.00 . A A . 24 GLU HA 1 1 5 2253 1 1 24 GLU HB2 H -2.925 13.104 0.047 1.00 . A A . 24 GLU HB2 1 1 5 2254 1 1 24 GLU HB3 H -1.203 12.835 -0.219 1.00 . A A . 24 GLU HB3 1 1 5 2255 1 1 24 GLU HG2 H -3.270 13.610 -2.298 1.00 . A A . 24 GLU HG2 1 1 5 2256 1 1 24 GLU HG3 H -1.911 14.581 -1.736 1.00 . A A . 24 GLU HG3 1 1 5 2257 1 1 24 GLU N N -3.882 11.047 -1.279 1.00 . A A . 24 GLU N 1 1 5 2258 1 1 24 GLU O O -0.771 10.340 0.436 1.00 . A A . 24 GLU O 1 1 5 2259 1 1 24 GLU OE1 O -0.157 13.096 -2.921 1.00 . A A . 24 GLU OE1 1 1 5 2260 1 1 24 GLU OE2 O -1.903 12.349 -3.930 1.00 . A A . 24 GLU OE2 1 1 5 2261 1 1 25 VAL C C -2.324 7.278 1.252 1.00 . A A . 25 VAL C 1 1 5 2262 1 1 25 VAL CA C -2.461 8.692 1.815 1.00 . A A . 25 VAL CA 1 1 5 2263 1 1 25 VAL CB C -3.481 8.714 2.961 1.00 . A A . 25 VAL CB 1 1 5 2264 1 1 25 VAL CG1 C -3.135 7.623 3.980 1.00 . A A . 25 VAL CG1 1 1 5 2265 1 1 25 VAL CG2 C -3.436 10.080 3.659 1.00 . A A . 25 VAL CG2 1 1 5 2266 1 1 25 VAL H H -3.805 9.639 0.471 1.00 . A A . 25 VAL H 1 1 5 2267 1 1 25 VAL HA H -1.501 9.007 2.199 1.00 . A A . 25 VAL HA 1 1 5 2268 1 1 25 VAL HB H -4.471 8.540 2.567 1.00 . A A . 25 VAL HB 1 1 5 2269 1 1 25 VAL HG11 H -2.062 7.549 4.079 1.00 . A A . 25 VAL HG11 1 1 5 2270 1 1 25 VAL HG12 H -3.531 6.677 3.643 1.00 . A A . 25 VAL HG12 1 1 5 2271 1 1 25 VAL HG13 H -3.567 7.875 4.936 1.00 . A A . 25 VAL HG13 1 1 5 2272 1 1 25 VAL HG21 H -2.993 9.969 4.638 1.00 . A A . 25 VAL HG21 1 1 5 2273 1 1 25 VAL HG22 H -4.437 10.467 3.760 1.00 . A A . 25 VAL HG22 1 1 5 2274 1 1 25 VAL HG23 H -2.843 10.767 3.073 1.00 . A A . 25 VAL HG23 1 1 5 2275 1 1 25 VAL N N -2.866 9.605 0.751 1.00 . A A . 25 VAL N 1 1 5 2276 1 1 25 VAL O O -3.249 6.754 0.625 1.00 . A A . 25 VAL O 1 1 5 2277 1 1 26 CYS C C -1.075 4.284 2.051 1.00 . A A . 26 CYS C 1 1 5 2278 1 1 26 CYS CA C -0.890 5.328 0.956 1.00 . A A . 26 CYS CA 1 1 5 2279 1 1 26 CYS CB C 0.542 5.244 0.430 1.00 . A A . 26 CYS CB 1 1 5 2280 1 1 26 CYS H H -0.451 7.145 1.946 1.00 . A A . 26 CYS H 1 1 5 2281 1 1 26 CYS HA H -1.568 5.111 0.150 1.00 . A A . 26 CYS HA 1 1 5 2282 1 1 26 CYS HB2 H 0.552 4.673 -0.481 1.00 . A A . 26 CYS HB2 1 1 5 2283 1 1 26 CYS HB3 H 0.920 6.231 0.236 1.00 . A A . 26 CYS HB3 1 1 5 2284 1 1 26 CYS N N -1.155 6.674 1.458 1.00 . A A . 26 CYS N 1 1 5 2285 1 1 26 CYS O O -0.766 4.534 3.216 1.00 . A A . 26 CYS O 1 1 5 2286 1 1 26 CYS SG S 1.583 4.430 1.661 1.00 . A A . 26 CYS SG 1 1 5 2287 1 1 27 LYS C C -1.696 0.651 1.971 1.00 . A A . 27 LYS C 1 1 5 2288 1 1 27 LYS CA C -1.780 2.033 2.635 1.00 . A A . 27 LYS CA 1 1 5 2289 1 1 27 LYS CB C -3.159 2.182 3.288 1.00 . A A . 27 LYS CB 1 1 5 2290 1 1 27 LYS CD C -4.503 3.561 4.892 1.00 . A A . 27 LYS CD 1 1 5 2291 1 1 27 LYS CE C -5.758 3.470 4.020 1.00 . A A . 27 LYS CE 1 1 5 2292 1 1 27 LYS CG C -3.253 3.532 4.006 1.00 . A A . 27 LYS CG 1 1 5 2293 1 1 27 LYS H H -1.802 2.965 0.721 1.00 . A A . 27 LYS H 1 1 5 2294 1 1 27 LYS HA H -1.027 2.107 3.404 1.00 . A A . 27 LYS HA 1 1 5 2295 1 1 27 LYS HB2 H -3.922 2.123 2.525 1.00 . A A . 27 LYS HB2 1 1 5 2296 1 1 27 LYS HB3 H -3.303 1.385 4.002 1.00 . A A . 27 LYS HB3 1 1 5 2297 1 1 27 LYS HD2 H -4.477 2.726 5.578 1.00 . A A . 27 LYS HD2 1 1 5 2298 1 1 27 LYS HD3 H -4.523 4.484 5.452 1.00 . A A . 27 LYS HD3 1 1 5 2299 1 1 27 LYS HE2 H -5.486 3.598 2.980 1.00 . A A . 27 LYS HE2 1 1 5 2300 1 1 27 LYS HE3 H -6.222 2.503 4.153 1.00 . A A . 27 LYS HE3 1 1 5 2301 1 1 27 LYS HG2 H -2.375 3.674 4.619 1.00 . A A . 27 LYS HG2 1 1 5 2302 1 1 27 LYS HG3 H -3.313 4.325 3.275 1.00 . A A . 27 LYS HG3 1 1 5 2303 1 1 27 LYS HZ1 H -6.188 5.396 4.696 1.00 . A A . 27 LYS HZ1 1 1 5 2304 1 1 27 LYS HZ2 H -7.294 4.217 5.215 1.00 . A A . 27 LYS HZ2 1 1 5 2305 1 1 27 LYS HZ3 H -7.348 4.776 3.590 1.00 . A A . 27 LYS HZ3 1 1 5 2306 1 1 27 LYS N N -1.573 3.110 1.670 1.00 . A A . 27 LYS N 1 1 5 2307 1 1 27 LYS NZ N -6.714 4.544 4.418 1.00 . A A . 27 LYS NZ 1 1 5 2308 1 1 27 LYS O O -2.412 0.373 1.010 1.00 . A A . 27 LYS O 1 1 5 2309 1 1 28 CYS C C -1.908 -2.403 2.543 1.00 . A A . 28 CYS C 1 1 5 2310 1 1 28 CYS CA C -0.746 -1.592 1.981 1.00 . A A . 28 CYS CA 1 1 5 2311 1 1 28 CYS CB C 0.593 -2.227 2.383 1.00 . A A . 28 CYS CB 1 1 5 2312 1 1 28 CYS H H -0.327 0.020 3.300 1.00 . A A . 28 CYS H 1 1 5 2313 1 1 28 CYS HA H -0.822 -1.562 0.905 1.00 . A A . 28 CYS HA 1 1 5 2314 1 1 28 CYS HB2 H 1.293 -1.450 2.654 1.00 . A A . 28 CYS HB2 1 1 5 2315 1 1 28 CYS HB3 H 0.443 -2.887 3.225 1.00 . A A . 28 CYS HB3 1 1 5 2316 1 1 28 CYS N N -0.853 -0.232 2.514 1.00 . A A . 28 CYS N 1 1 5 2317 1 1 28 CYS O O -1.819 -2.954 3.640 1.00 . A A . 28 CYS O 1 1 5 2318 1 1 28 CYS SG S 1.254 -3.174 0.985 1.00 . A A . 28 CYS SG 1 1 5 2319 1 1 29 ASN C C -4.633 -4.262 1.380 1.00 . A A . 29 ASN C 1 1 5 2320 1 1 29 ASN CA C -4.227 -3.094 2.275 1.00 . A A . 29 ASN CA 1 1 5 2321 1 1 29 ASN CB C -5.370 -2.075 2.314 1.00 . A A . 29 ASN CB 1 1 5 2322 1 1 29 ASN CG C -5.276 -1.151 1.104 1.00 . A A . 29 ASN CG 1 1 5 2323 1 1 29 ASN H H -3.035 -1.920 0.964 1.00 . A A . 29 ASN H 1 1 5 2324 1 1 29 ASN HA H -4.064 -3.463 3.276 1.00 . A A . 29 ASN HA 1 1 5 2325 1 1 29 ASN HB2 H -6.318 -2.595 2.297 1.00 . A A . 29 ASN HB2 1 1 5 2326 1 1 29 ASN HB3 H -5.300 -1.488 3.218 1.00 . A A . 29 ASN HB3 1 1 5 2327 1 1 29 ASN HD21 H -4.503 -2.549 -0.078 1.00 . A A . 29 ASN HD21 1 1 5 2328 1 1 29 ASN HD22 H -4.711 -1.015 -0.805 1.00 . A A . 29 ASN HD22 1 1 5 2329 1 1 29 ASN N N -3.016 -2.414 1.813 1.00 . A A . 29 ASN N 1 1 5 2330 1 1 29 ASN ND2 N -4.794 -1.611 -0.016 1.00 . A A . 29 ASN ND2 1 1 5 2331 1 1 29 ASN O O -4.600 -4.164 0.153 1.00 . A A . 29 ASN O 1 1 5 2332 1 1 29 ASN OD1 O -5.662 0.017 1.179 1.00 . A A . 29 ASN OD1 1 1 5 2333 1 1 30 ILE C C -6.933 -6.297 0.760 1.00 . A A . 30 ILE C 1 1 5 2334 1 1 30 ILE CA C -5.525 -6.529 1.282 1.00 . A A . 30 ILE CA 1 1 5 2335 1 1 30 ILE CB C -5.489 -7.788 2.165 1.00 . A A . 30 ILE CB 1 1 5 2336 1 1 30 ILE CD1 C -3.952 -6.901 3.907 1.00 . A A . 30 ILE CD1 1 1 5 2337 1 1 30 ILE CG1 C -5.376 -7.391 3.636 1.00 . A A . 30 ILE CG1 1 1 5 2338 1 1 30 ILE CG2 C -4.294 -8.667 1.782 1.00 . A A . 30 ILE CG2 1 1 5 2339 1 1 30 ILE H H -5.097 -5.349 2.990 1.00 . A A . 30 ILE H 1 1 5 2340 1 1 30 ILE HA H -4.875 -6.683 0.438 1.00 . A A . 30 ILE HA 1 1 5 2341 1 1 30 ILE HB H -6.399 -8.349 2.018 1.00 . A A . 30 ILE HB 1 1 5 2342 1 1 30 ILE HD11 H -3.985 -6.019 4.524 1.00 . A A . 30 ILE HD11 1 1 5 2343 1 1 30 ILE HD12 H -3.467 -6.666 2.967 1.00 . A A . 30 ILE HD12 1 1 5 2344 1 1 30 ILE HD13 H -3.397 -7.677 4.409 1.00 . A A . 30 ILE HD13 1 1 5 2345 1 1 30 ILE HG12 H -6.084 -6.605 3.857 1.00 . A A . 30 ILE HG12 1 1 5 2346 1 1 30 ILE HG13 H -5.584 -8.249 4.258 1.00 . A A . 30 ILE HG13 1 1 5 2347 1 1 30 ILE HG21 H -3.455 -8.043 1.515 1.00 . A A . 30 ILE HG21 1 1 5 2348 1 1 30 ILE HG22 H -4.561 -9.294 0.944 1.00 . A A . 30 ILE HG22 1 1 5 2349 1 1 30 ILE HG23 H -4.024 -9.290 2.623 1.00 . A A . 30 ILE HG23 1 1 5 2350 1 1 30 ILE N N -5.063 -5.350 2.012 1.00 . A A . 30 ILE N 1 1 5 2351 1 1 30 ILE O O -7.850 -5.976 1.514 1.00 . A A . 30 ILE O 1 1 5 2352 1 1 31 GLY C C -8.342 -4.952 -2.017 1.00 . A A . 31 GLY C 1 1 5 2353 1 1 31 GLY CA C -8.362 -6.242 -1.206 1.00 . A A . 31 GLY CA 1 1 5 2354 1 1 31 GLY H H -6.294 -6.693 -1.075 1.00 . A A . 31 GLY H 1 1 5 2355 1 1 31 GLY HA2 H -8.567 -7.075 -1.863 1.00 . A A . 31 GLY HA2 1 1 5 2356 1 1 31 GLY HA3 H -9.137 -6.175 -0.461 1.00 . A A . 31 GLY HA3 1 1 5 2357 1 1 31 GLY N N -7.076 -6.449 -0.544 1.00 . A A . 31 GLY N 1 1 5 2358 1 1 31 GLY O O -9.141 -4.768 -2.933 1.00 . A A . 31 GLY O 1 1 5 2359 1 1 32 LYS C C -5.936 -2.761 -3.114 1.00 . A A . 32 LYS C 1 1 5 2360 1 1 32 LYS CA C -7.269 -2.796 -2.364 1.00 . A A . 32 LYS CA 1 1 5 2361 1 1 32 LYS CB C -7.343 -1.642 -1.355 1.00 . A A . 32 LYS CB 1 1 5 2362 1 1 32 LYS CD C -8.840 0.375 -1.195 1.00 . A A . 32 LYS CD 1 1 5 2363 1 1 32 LYS CE C -8.404 0.902 0.178 1.00 . A A . 32 LYS CE 1 1 5 2364 1 1 32 LYS CG C -8.794 -1.162 -1.213 1.00 . A A . 32 LYS CG 1 1 5 2365 1 1 32 LYS H H -6.805 -4.284 -0.936 1.00 . A A . 32 LYS H 1 1 5 2366 1 1 32 LYS HA H -8.071 -2.693 -3.077 1.00 . A A . 32 LYS HA 1 1 5 2367 1 1 32 LYS HB2 H -6.986 -1.986 -0.396 1.00 . A A . 32 LYS HB2 1 1 5 2368 1 1 32 LYS HB3 H -6.725 -0.825 -1.696 1.00 . A A . 32 LYS HB3 1 1 5 2369 1 1 32 LYS HD2 H -8.180 0.762 -1.956 1.00 . A A . 32 LYS HD2 1 1 5 2370 1 1 32 LYS HD3 H -9.850 0.703 -1.398 1.00 . A A . 32 LYS HD3 1 1 5 2371 1 1 32 LYS HE2 H -9.096 1.667 0.503 1.00 . A A . 32 LYS HE2 1 1 5 2372 1 1 32 LYS HE3 H -8.404 0.092 0.893 1.00 . A A . 32 LYS HE3 1 1 5 2373 1 1 32 LYS HG2 H -9.377 -1.528 -2.047 1.00 . A A . 32 LYS HG2 1 1 5 2374 1 1 32 LYS HG3 H -9.212 -1.544 -0.292 1.00 . A A . 32 LYS HG3 1 1 5 2375 1 1 32 LYS HZ1 H -6.741 1.510 -0.916 1.00 . A A . 32 LYS HZ1 1 1 5 2376 1 1 32 LYS HZ2 H -6.357 0.882 0.622 1.00 . A A . 32 LYS HZ2 1 1 5 2377 1 1 32 LYS HZ3 H -7.030 2.473 0.476 1.00 . A A . 32 LYS HZ3 1 1 5 2378 1 1 32 LYS N N -7.414 -4.071 -1.672 1.00 . A A . 32 LYS N 1 1 5 2379 1 1 32 LYS NZ N -7.033 1.482 0.077 1.00 . A A . 32 LYS NZ 1 1 5 2380 1 1 32 LYS O O -4.922 -3.257 -2.619 1.00 . A A . 32 LYS O 1 1 5 2381 1 1 33 LYS C C -4.590 -0.754 -5.785 1.00 . A A . 33 LYS C 1 1 5 2382 1 1 33 LYS CA C -4.731 -2.121 -5.125 1.00 . A A . 33 LYS CA 1 1 5 2383 1 1 33 LYS CB C -4.769 -3.207 -6.211 1.00 . A A . 33 LYS CB 1 1 5 2384 1 1 33 LYS CD C -4.088 -3.076 -8.638 1.00 . A A . 33 LYS CD 1 1 5 2385 1 1 33 LYS CE C -4.864 -1.796 -8.978 1.00 . A A . 33 LYS CE 1 1 5 2386 1 1 33 LYS CG C -3.588 -3.028 -7.184 1.00 . A A . 33 LYS CG 1 1 5 2387 1 1 33 LYS H H -6.783 -1.826 -4.667 1.00 . A A . 33 LYS H 1 1 5 2388 1 1 33 LYS HA H -3.874 -2.294 -4.491 1.00 . A A . 33 LYS HA 1 1 5 2389 1 1 33 LYS HB2 H -4.704 -4.179 -5.744 1.00 . A A . 33 LYS HB2 1 1 5 2390 1 1 33 LYS HB3 H -5.698 -3.135 -6.756 1.00 . A A . 33 LYS HB3 1 1 5 2391 1 1 33 LYS HD2 H -3.240 -3.168 -9.304 1.00 . A A . 33 LYS HD2 1 1 5 2392 1 1 33 LYS HD3 H -4.735 -3.931 -8.767 1.00 . A A . 33 LYS HD3 1 1 5 2393 1 1 33 LYS HE2 H -5.625 -2.024 -9.712 1.00 . A A . 33 LYS HE2 1 1 5 2394 1 1 33 LYS HE3 H -5.333 -1.410 -8.088 1.00 . A A . 33 LYS HE3 1 1 5 2395 1 1 33 LYS HG2 H -3.105 -2.079 -7.004 1.00 . A A . 33 LYS HG2 1 1 5 2396 1 1 33 LYS HG3 H -2.875 -3.824 -7.029 1.00 . A A . 33 LYS HG3 1 1 5 2397 1 1 33 LYS HZ1 H -4.320 0.191 -9.385 1.00 . A A . 33 LYS HZ1 1 1 5 2398 1 1 33 LYS HZ2 H -3.784 -0.934 -10.548 1.00 . A A . 33 LYS HZ2 1 1 5 2399 1 1 33 LYS HZ3 H -3.000 -0.825 -9.031 1.00 . A A . 33 LYS HZ3 1 1 5 2400 1 1 33 LYS N N -5.945 -2.193 -4.314 1.00 . A A . 33 LYS N 1 1 5 2401 1 1 33 LYS NZ N -3.928 -0.773 -9.535 1.00 . A A . 33 LYS NZ 1 1 5 2402 1 1 33 LYS O O -5.555 -0.211 -6.324 1.00 . A A . 33 LYS O 1 1 5 2403 1 1 34 ASP C C -2.948 0.862 -7.896 1.00 . A A . 34 ASP C 1 1 5 2404 1 1 34 ASP CA C -3.097 1.059 -6.387 1.00 . A A . 34 ASP CA 1 1 5 2405 1 1 34 ASP CB C -1.805 1.652 -5.803 1.00 . A A . 34 ASP CB 1 1 5 2406 1 1 34 ASP CG C -2.044 3.051 -5.240 1.00 . A A . 34 ASP CG 1 1 5 2407 1 1 34 ASP H H -2.642 -0.716 -5.330 1.00 . A A . 34 ASP H 1 1 5 2408 1 1 34 ASP HA H -3.919 1.731 -6.200 1.00 . A A . 34 ASP HA 1 1 5 2409 1 1 34 ASP HB2 H -1.445 1.012 -5.014 1.00 . A A . 34 ASP HB2 1 1 5 2410 1 1 34 ASP HB3 H -1.059 1.709 -6.581 1.00 . A A . 34 ASP HB3 1 1 5 2411 1 1 34 ASP N N -3.374 -0.224 -5.762 1.00 . A A . 34 ASP N 1 1 5 2412 1 1 34 ASP O O -2.116 0.051 -8.296 1.00 . A A . 34 ASP O 1 1 5 2413 1 1 34 ASP OXT O -3.697 1.483 -8.636 1.00 . A A . 34 ASP OXT 1 1 5 2414 1 1 34 ASP OD1 O -3.187 3.386 -4.969 1.00 . A A . 34 ASP OD1 1 1 5 2415 1 1 34 ASP OD2 O -1.072 3.764 -5.067 1.00 . A A . 34 ASP OD2 1 1 6 2416 1 1 1 GLY C C 10.840 9.258 1.472 1.00 . A A . 1 GLY C 1 1 6 2417 1 1 1 GLY CA C 11.051 8.964 2.957 1.00 . A A . 1 GLY CA 1 1 6 2418 1 1 1 GLY H1 H 11.624 6.987 2.622 1.00 . A A . 1 GLY H1 1 1 6 2419 1 1 1 GLY H2 H 9.964 7.179 2.967 1.00 . A A . 1 GLY H2 1 1 6 2420 1 1 1 GLY H3 H 11.124 7.300 4.213 1.00 . A A . 1 GLY H3 1 1 6 2421 1 1 1 GLY HA2 H 10.302 9.489 3.535 1.00 . A A . 1 GLY HA2 1 1 6 2422 1 1 1 GLY HA3 H 12.033 9.304 3.251 1.00 . A A . 1 GLY HA3 1 1 6 2423 1 1 1 GLY N N 10.936 7.498 3.210 1.00 . A A . 1 GLY N 1 1 6 2424 1 1 1 GLY O O 11.559 10.068 0.887 1.00 . A A . 1 GLY O 1 1 6 2425 1 1 2 SER C C 8.040 8.864 -0.775 1.00 . A A . 2 SER C 1 1 6 2426 1 1 2 SER CA C 9.546 8.804 -0.549 1.00 . A A . 2 SER CA 1 1 6 2427 1 1 2 SER CB C 10.136 7.670 -1.383 1.00 . A A . 2 SER CB 1 1 6 2428 1 1 2 SER H H 9.301 7.961 1.395 1.00 . A A . 2 SER H 1 1 6 2429 1 1 2 SER HA H 9.985 9.737 -0.874 1.00 . A A . 2 SER HA 1 1 6 2430 1 1 2 SER HB2 H 11.127 7.434 -1.031 1.00 . A A . 2 SER HB2 1 1 6 2431 1 1 2 SER HB3 H 9.506 6.794 -1.296 1.00 . A A . 2 SER HB3 1 1 6 2432 1 1 2 SER HG H 11.091 8.427 -2.901 1.00 . A A . 2 SER HG 1 1 6 2433 1 1 2 SER N N 9.849 8.599 0.870 1.00 . A A . 2 SER N 1 1 6 2434 1 1 2 SER O O 7.270 9.053 0.166 1.00 . A A . 2 SER O 1 1 6 2435 1 1 2 SER OG O 10.203 8.089 -2.739 1.00 . A A . 2 SER OG 1 1 6 2436 1 1 3 VAL C C 5.477 7.547 -1.724 1.00 . A A . 3 VAL C 1 1 6 2437 1 1 3 VAL CA C 6.200 8.737 -2.352 1.00 . A A . 3 VAL CA 1 1 6 2438 1 1 3 VAL CB C 5.986 8.732 -3.871 1.00 . A A . 3 VAL CB 1 1 6 2439 1 1 3 VAL CG1 C 5.937 10.174 -4.385 1.00 . A A . 3 VAL CG1 1 1 6 2440 1 1 3 VAL CG2 C 7.134 7.989 -4.561 1.00 . A A . 3 VAL CG2 1 1 6 2441 1 1 3 VAL H H 8.279 8.550 -2.742 1.00 . A A . 3 VAL H 1 1 6 2442 1 1 3 VAL HA H 5.781 9.647 -1.946 1.00 . A A . 3 VAL HA 1 1 6 2443 1 1 3 VAL HB H 5.049 8.240 -4.094 1.00 . A A . 3 VAL HB 1 1 6 2444 1 1 3 VAL HG11 H 4.958 10.592 -4.192 1.00 . A A . 3 VAL HG11 1 1 6 2445 1 1 3 VAL HG12 H 6.127 10.185 -5.447 1.00 . A A . 3 VAL HG12 1 1 6 2446 1 1 3 VAL HG13 H 6.688 10.764 -3.879 1.00 . A A . 3 VAL HG13 1 1 6 2447 1 1 3 VAL HG21 H 7.964 8.665 -4.713 1.00 . A A . 3 VAL HG21 1 1 6 2448 1 1 3 VAL HG22 H 6.796 7.615 -5.516 1.00 . A A . 3 VAL HG22 1 1 6 2449 1 1 3 VAL HG23 H 7.452 7.164 -3.942 1.00 . A A . 3 VAL HG23 1 1 6 2450 1 1 3 VAL N N 7.622 8.701 -2.028 1.00 . A A . 3 VAL N 1 1 6 2451 1 1 3 VAL O O 5.779 6.385 -2.020 1.00 . A A . 3 VAL O 1 1 6 2452 1 1 4 GLY C C 3.407 5.646 -1.042 1.00 . A A . 4 GLY C 1 1 6 2453 1 1 4 GLY CA C 3.748 6.831 -0.148 1.00 . A A . 4 GLY CA 1 1 6 2454 1 1 4 GLY H H 4.347 8.797 -0.660 1.00 . A A . 4 GLY H 1 1 6 2455 1 1 4 GLY HA2 H 4.319 6.475 0.696 1.00 . A A . 4 GLY HA2 1 1 6 2456 1 1 4 GLY HA3 H 2.830 7.272 0.211 1.00 . A A . 4 GLY HA3 1 1 6 2457 1 1 4 GLY N N 4.526 7.853 -0.848 1.00 . A A . 4 GLY N 1 1 6 2458 1 1 4 GLY O O 3.601 4.504 -0.656 1.00 . A A . 4 GLY O 1 1 6 2459 1 1 5 CYS C C 3.685 3.958 -3.507 1.00 . A A . 5 CYS C 1 1 6 2460 1 1 5 CYS CA C 2.498 4.850 -3.152 1.00 . A A . 5 CYS CA 1 1 6 2461 1 1 5 CYS CB C 1.883 5.450 -4.414 1.00 . A A . 5 CYS CB 1 1 6 2462 1 1 5 CYS H H 2.726 6.846 -2.487 1.00 . A A . 5 CYS H 1 1 6 2463 1 1 5 CYS HA H 1.753 4.239 -2.664 1.00 . A A . 5 CYS HA 1 1 6 2464 1 1 5 CYS HB2 H 2.619 6.049 -4.930 1.00 . A A . 5 CYS HB2 1 1 6 2465 1 1 5 CYS HB3 H 1.545 4.660 -5.062 1.00 . A A . 5 CYS HB3 1 1 6 2466 1 1 5 CYS N N 2.878 5.918 -2.230 1.00 . A A . 5 CYS N 1 1 6 2467 1 1 5 CYS O O 3.507 2.781 -3.811 1.00 . A A . 5 CYS O 1 1 6 2468 1 1 5 CYS SG S 0.477 6.487 -3.938 1.00 . A A . 5 CYS SG 1 1 6 2469 1 1 6 ALA C C 6.536 3.042 -2.424 1.00 . A A . 6 ALA C 1 1 6 2470 1 1 6 ALA CA C 6.085 3.707 -3.716 1.00 . A A . 6 ALA CA 1 1 6 2471 1 1 6 ALA CB C 7.201 4.595 -4.269 1.00 . A A . 6 ALA CB 1 1 6 2472 1 1 6 ALA H H 4.992 5.441 -3.157 1.00 . A A . 6 ALA H 1 1 6 2473 1 1 6 ALA HA H 5.845 2.944 -4.441 1.00 . A A . 6 ALA HA 1 1 6 2474 1 1 6 ALA HB1 H 7.687 5.114 -3.453 1.00 . A A . 6 ALA HB1 1 1 6 2475 1 1 6 ALA HB2 H 6.781 5.317 -4.955 1.00 . A A . 6 ALA HB2 1 1 6 2476 1 1 6 ALA HB3 H 7.925 3.984 -4.789 1.00 . A A . 6 ALA HB3 1 1 6 2477 1 1 6 ALA N N 4.895 4.502 -3.435 1.00 . A A . 6 ALA N 1 1 6 2478 1 1 6 ALA O O 6.853 1.846 -2.380 1.00 . A A . 6 ALA O 1 1 6 2479 1 1 7 GLU C C 5.875 2.285 0.399 1.00 . A A . 7 GLU C 1 1 6 2480 1 1 7 GLU CA C 6.900 3.319 -0.053 1.00 . A A . 7 GLU CA 1 1 6 2481 1 1 7 GLU CB C 6.981 4.468 0.958 1.00 . A A . 7 GLU CB 1 1 6 2482 1 1 7 GLU CD C 8.812 5.699 2.169 1.00 . A A . 7 GLU CD 1 1 6 2483 1 1 7 GLU CG C 8.342 5.164 0.822 1.00 . A A . 7 GLU CG 1 1 6 2484 1 1 7 GLU H H 6.242 4.764 -1.454 1.00 . A A . 7 GLU H 1 1 6 2485 1 1 7 GLU HA H 7.866 2.844 -0.124 1.00 . A A . 7 GLU HA 1 1 6 2486 1 1 7 GLU HB2 H 6.190 5.178 0.759 1.00 . A A . 7 GLU HB2 1 1 6 2487 1 1 7 GLU HB3 H 6.873 4.080 1.957 1.00 . A A . 7 GLU HB3 1 1 6 2488 1 1 7 GLU HG2 H 9.069 4.460 0.447 1.00 . A A . 7 GLU HG2 1 1 6 2489 1 1 7 GLU HG3 H 8.250 5.985 0.127 1.00 . A A . 7 GLU HG3 1 1 6 2490 1 1 7 GLU N N 6.528 3.828 -1.359 1.00 . A A . 7 GLU N 1 1 6 2491 1 1 7 GLU O O 6.223 1.294 1.021 1.00 . A A . 7 GLU O 1 1 6 2492 1 1 7 GLU OE1 O 9.175 4.900 3.016 1.00 . A A . 7 GLU OE1 1 1 6 2493 1 1 7 GLU OE2 O 8.829 6.908 2.330 1.00 . A A . 7 GLU OE2 1 1 6 2494 1 1 8 CYS C C 3.942 0.157 0.192 1.00 . A A . 8 CYS C 1 1 6 2495 1 1 8 CYS CA C 3.534 1.606 0.443 1.00 . A A . 8 CYS CA 1 1 6 2496 1 1 8 CYS CB C 2.243 1.948 -0.307 1.00 . A A . 8 CYS CB 1 1 6 2497 1 1 8 CYS H H 4.391 3.340 -0.435 1.00 . A A . 8 CYS H 1 1 6 2498 1 1 8 CYS HA H 3.348 1.726 1.496 1.00 . A A . 8 CYS HA 1 1 6 2499 1 1 8 CYS HB2 H 2.380 2.853 -0.875 1.00 . A A . 8 CYS HB2 1 1 6 2500 1 1 8 CYS HB3 H 1.968 1.154 -0.968 1.00 . A A . 8 CYS HB3 1 1 6 2501 1 1 8 CYS N N 4.609 2.524 0.069 1.00 . A A . 8 CYS N 1 1 6 2502 1 1 8 CYS O O 4.057 -0.626 1.138 1.00 . A A . 8 CYS O 1 1 6 2503 1 1 8 CYS SG S 0.938 2.193 0.910 1.00 . A A . 8 CYS SG 1 1 6 2504 1 1 9 PRO C C 5.902 -1.932 -0.566 1.00 . A A . 9 PRO C 1 1 6 2505 1 1 9 PRO CA C 4.638 -1.603 -1.350 1.00 . A A . 9 PRO CA 1 1 6 2506 1 1 9 PRO CB C 4.896 -1.610 -2.864 1.00 . A A . 9 PRO CB 1 1 6 2507 1 1 9 PRO CD C 4.095 0.609 -2.247 1.00 . A A . 9 PRO CD 1 1 6 2508 1 1 9 PRO CG C 4.864 -0.181 -3.307 1.00 . A A . 9 PRO CG 1 1 6 2509 1 1 9 PRO HA H 3.858 -2.308 -1.107 1.00 . A A . 9 PRO HA 1 1 6 2510 1 1 9 PRO HB2 H 5.864 -2.045 -3.074 1.00 . A A . 9 PRO HB2 1 1 6 2511 1 1 9 PRO HB3 H 4.121 -2.168 -3.370 1.00 . A A . 9 PRO HB3 1 1 6 2512 1 1 9 PRO HD2 H 4.555 1.573 -2.089 1.00 . A A . 9 PRO HD2 1 1 6 2513 1 1 9 PRO HD3 H 3.062 0.721 -2.537 1.00 . A A . 9 PRO HD3 1 1 6 2514 1 1 9 PRO HG2 H 5.873 0.196 -3.397 1.00 . A A . 9 PRO HG2 1 1 6 2515 1 1 9 PRO HG3 H 4.355 -0.101 -4.255 1.00 . A A . 9 PRO HG3 1 1 6 2516 1 1 9 PRO N N 4.197 -0.220 -1.039 1.00 . A A . 9 PRO N 1 1 6 2517 1 1 9 PRO O O 5.993 -2.979 0.079 1.00 . A A . 9 PRO O 1 1 6 2518 1 1 10 MET C C 7.815 -1.342 1.641 1.00 . A A . 10 MET C 1 1 6 2519 1 1 10 MET CA C 8.107 -1.197 0.144 1.00 . A A . 10 MET CA 1 1 6 2520 1 1 10 MET CB C 9.041 -0.006 -0.095 1.00 . A A . 10 MET CB 1 1 6 2521 1 1 10 MET CE C 11.488 0.769 -3.342 1.00 . A A . 10 MET CE 1 1 6 2522 1 1 10 MET CG C 9.675 -0.107 -1.489 1.00 . A A . 10 MET CG 1 1 6 2523 1 1 10 MET H H 6.728 -0.176 -1.104 1.00 . A A . 10 MET H 1 1 6 2524 1 1 10 MET HA H 8.590 -2.097 -0.206 1.00 . A A . 10 MET HA 1 1 6 2525 1 1 10 MET HB2 H 8.479 0.913 -0.020 1.00 . A A . 10 MET HB2 1 1 6 2526 1 1 10 MET HB3 H 9.819 -0.008 0.651 1.00 . A A . 10 MET HB3 1 1 6 2527 1 1 10 MET HE1 H 12.172 -0.070 -3.347 1.00 . A A . 10 MET HE1 1 1 6 2528 1 1 10 MET HE2 H 11.975 1.639 -3.764 1.00 . A A . 10 MET HE2 1 1 6 2529 1 1 10 MET HE3 H 10.620 0.525 -3.931 1.00 . A A . 10 MET HE3 1 1 6 2530 1 1 10 MET HG2 H 10.091 -1.094 -1.623 1.00 . A A . 10 MET HG2 1 1 6 2531 1 1 10 MET HG3 H 8.921 0.071 -2.242 1.00 . A A . 10 MET HG3 1 1 6 2532 1 1 10 MET N N 6.865 -1.008 -0.595 1.00 . A A . 10 MET N 1 1 6 2533 1 1 10 MET O O 8.543 -2.024 2.362 1.00 . A A . 10 MET O 1 1 6 2534 1 1 10 MET SD S 10.991 1.130 -1.638 1.00 . A A . 10 MET SD 1 1 6 2535 1 1 11 HIS C C 5.629 -2.041 3.830 1.00 . A A . 11 HIS C 1 1 6 2536 1 1 11 HIS CA C 6.361 -0.738 3.506 1.00 . A A . 11 HIS CA 1 1 6 2537 1 1 11 HIS CB C 5.456 0.453 3.833 1.00 . A A . 11 HIS CB 1 1 6 2538 1 1 11 HIS CD2 C 7.361 2.211 3.442 1.00 . A A . 11 HIS CD2 1 1 6 2539 1 1 11 HIS CE1 C 6.951 3.514 5.123 1.00 . A A . 11 HIS CE1 1 1 6 2540 1 1 11 HIS CG C 6.292 1.671 4.107 1.00 . A A . 11 HIS CG 1 1 6 2541 1 1 11 HIS H H 6.210 -0.147 1.478 1.00 . A A . 11 HIS H 1 1 6 2542 1 1 11 HIS HA H 7.249 -0.676 4.116 1.00 . A A . 11 HIS HA 1 1 6 2543 1 1 11 HIS HB2 H 4.805 0.649 2.993 1.00 . A A . 11 HIS HB2 1 1 6 2544 1 1 11 HIS HB3 H 4.859 0.225 4.702 1.00 . A A . 11 HIS HB3 1 1 6 2545 1 1 11 HIS HD2 H 7.815 1.794 2.556 1.00 . A A . 11 HIS HD2 1 1 6 2546 1 1 11 HIS HE1 H 7.003 4.327 5.834 1.00 . A A . 11 HIS HE1 1 1 6 2547 1 1 11 HIS HE2 H 8.505 3.996 3.794 1.00 . A A . 11 HIS HE2 1 1 6 2548 1 1 11 HIS N N 6.749 -0.689 2.101 1.00 . A A . 11 HIS N 1 1 6 2549 1 1 11 HIS ND1 N 6.046 2.517 5.178 1.00 . A A . 11 HIS ND1 1 1 6 2550 1 1 11 HIS NE2 N 7.775 3.375 4.081 1.00 . A A . 11 HIS NE2 1 1 6 2551 1 1 11 HIS O O 5.249 -2.275 4.982 1.00 . A A . 11 HIS O 1 1 6 2552 1 1 12 CYS C C 5.799 -5.282 3.234 1.00 . A A . 12 CYS C 1 1 6 2553 1 1 12 CYS CA C 4.767 -4.173 3.043 1.00 . A A . 12 CYS CA 1 1 6 2554 1 1 12 CYS CB C 3.852 -4.515 1.870 1.00 . A A . 12 CYS CB 1 1 6 2555 1 1 12 CYS H H 5.777 -2.666 1.927 1.00 . A A . 12 CYS H 1 1 6 2556 1 1 12 CYS HA H 4.162 -4.096 3.937 1.00 . A A . 12 CYS HA 1 1 6 2557 1 1 12 CYS HB2 H 3.759 -3.657 1.225 1.00 . A A . 12 CYS HB2 1 1 6 2558 1 1 12 CYS HB3 H 4.270 -5.343 1.317 1.00 . A A . 12 CYS HB3 1 1 6 2559 1 1 12 CYS N N 5.445 -2.895 2.826 1.00 . A A . 12 CYS N 1 1 6 2560 1 1 12 CYS O O 6.856 -5.272 2.609 1.00 . A A . 12 CYS O 1 1 6 2561 1 1 12 CYS SG S 2.219 -4.978 2.510 1.00 . A A . 12 CYS SG 1 1 6 2562 1 1 13 LYS C C 6.068 -8.603 3.689 1.00 . A A . 13 LYS C 1 1 6 2563 1 1 13 LYS CA C 6.433 -7.306 4.429 1.00 . A A . 13 LYS CA 1 1 6 2564 1 1 13 LYS CB C 6.460 -7.545 5.944 1.00 . A A . 13 LYS CB 1 1 6 2565 1 1 13 LYS CD C 6.505 -5.180 6.836 1.00 . A A . 13 LYS CD 1 1 6 2566 1 1 13 LYS CE C 7.345 -3.959 6.438 1.00 . A A . 13 LYS CE 1 1 6 2567 1 1 13 LYS CG C 7.324 -6.470 6.627 1.00 . A A . 13 LYS CG 1 1 6 2568 1 1 13 LYS H H 4.653 -6.157 4.612 1.00 . A A . 13 LYS H 1 1 6 2569 1 1 13 LYS HA H 7.421 -7.005 4.116 1.00 . A A . 13 LYS HA 1 1 6 2570 1 1 13 LYS HB2 H 5.453 -7.504 6.334 1.00 . A A . 13 LYS HB2 1 1 6 2571 1 1 13 LYS HB3 H 6.881 -8.520 6.144 1.00 . A A . 13 LYS HB3 1 1 6 2572 1 1 13 LYS HD2 H 5.613 -5.217 6.228 1.00 . A A . 13 LYS HD2 1 1 6 2573 1 1 13 LYS HD3 H 6.226 -5.098 7.876 1.00 . A A . 13 LYS HD3 1 1 6 2574 1 1 13 LYS HE2 H 8.282 -3.977 6.977 1.00 . A A . 13 LYS HE2 1 1 6 2575 1 1 13 LYS HE3 H 7.543 -3.988 5.375 1.00 . A A . 13 LYS HE3 1 1 6 2576 1 1 13 LYS HG2 H 7.657 -6.840 7.588 1.00 . A A . 13 LYS HG2 1 1 6 2577 1 1 13 LYS HG3 H 8.183 -6.253 6.010 1.00 . A A . 13 LYS HG3 1 1 6 2578 1 1 13 LYS HZ1 H 5.881 -2.510 6.024 1.00 . A A . 13 LYS HZ1 1 1 6 2579 1 1 13 LYS HZ2 H 7.263 -1.907 6.826 1.00 . A A . 13 LYS HZ2 1 1 6 2580 1 1 13 LYS HZ3 H 6.121 -2.821 7.691 1.00 . A A . 13 LYS HZ3 1 1 6 2581 1 1 13 LYS N N 5.501 -6.214 4.128 1.00 . A A . 13 LYS N 1 1 6 2582 1 1 13 LYS NZ N 6.599 -2.707 6.774 1.00 . A A . 13 LYS NZ 1 1 6 2583 1 1 13 LYS O O 4.894 -8.943 3.534 1.00 . A A . 13 LYS O 1 1 6 2584 1 1 14 GLY C C 5.825 -11.437 3.072 1.00 . A A . 14 GLY C 1 1 6 2585 1 1 14 GLY CA C 6.941 -10.575 2.495 1.00 . A A . 14 GLY CA 1 1 6 2586 1 1 14 GLY H H 8.012 -8.974 3.388 1.00 . A A . 14 GLY H 1 1 6 2587 1 1 14 GLY HA2 H 6.715 -10.354 1.464 1.00 . A A . 14 GLY HA2 1 1 6 2588 1 1 14 GLY HA3 H 7.867 -11.130 2.541 1.00 . A A . 14 GLY HA3 1 1 6 2589 1 1 14 GLY N N 7.106 -9.311 3.231 1.00 . A A . 14 GLY N 1 1 6 2590 1 1 14 GLY O O 5.645 -11.505 4.286 1.00 . A A . 14 GLY O 1 1 6 2591 1 1 15 LYS C C 2.657 -12.153 2.634 1.00 . A A . 15 LYS C 1 1 6 2592 1 1 15 LYS CA C 3.956 -12.952 2.559 1.00 . A A . 15 LYS CA 1 1 6 2593 1 1 15 LYS CB C 4.226 -13.632 3.906 1.00 . A A . 15 LYS CB 1 1 6 2594 1 1 15 LYS CD C 3.993 -16.097 3.564 1.00 . A A . 15 LYS CD 1 1 6 2595 1 1 15 LYS CE C 4.736 -16.790 4.712 1.00 . A A . 15 LYS CE 1 1 6 2596 1 1 15 LYS CG C 3.290 -14.832 4.072 1.00 . A A . 15 LYS CG 1 1 6 2597 1 1 15 LYS H H 5.284 -11.975 1.225 1.00 . A A . 15 LYS H 1 1 6 2598 1 1 15 LYS HA H 3.842 -13.716 1.804 1.00 . A A . 15 LYS HA 1 1 6 2599 1 1 15 LYS HB2 H 5.252 -13.966 3.940 1.00 . A A . 15 LYS HB2 1 1 6 2600 1 1 15 LYS HB3 H 4.049 -12.930 4.706 1.00 . A A . 15 LYS HB3 1 1 6 2601 1 1 15 LYS HD2 H 3.260 -16.771 3.148 1.00 . A A . 15 LYS HD2 1 1 6 2602 1 1 15 LYS HD3 H 4.702 -15.822 2.795 1.00 . A A . 15 LYS HD3 1 1 6 2603 1 1 15 LYS HE2 H 5.772 -16.480 4.710 1.00 . A A . 15 LYS HE2 1 1 6 2604 1 1 15 LYS HE3 H 4.283 -16.518 5.656 1.00 . A A . 15 LYS HE3 1 1 6 2605 1 1 15 LYS HG2 H 3.032 -14.948 5.116 1.00 . A A . 15 LYS HG2 1 1 6 2606 1 1 15 LYS HG3 H 2.387 -14.672 3.498 1.00 . A A . 15 LYS HG3 1 1 6 2607 1 1 15 LYS HZ1 H 5.235 -18.746 5.246 1.00 . A A . 15 LYS HZ1 1 1 6 2608 1 1 15 LYS HZ2 H 5.012 -18.522 3.581 1.00 . A A . 15 LYS HZ2 1 1 6 2609 1 1 15 LYS HZ3 H 3.668 -18.579 4.615 1.00 . A A . 15 LYS HZ3 1 1 6 2610 1 1 15 LYS N N 5.078 -12.084 2.176 1.00 . A A . 15 LYS N 1 1 6 2611 1 1 15 LYS NZ N 4.658 -18.270 4.525 1.00 . A A . 15 LYS NZ 1 1 6 2612 1 1 15 LYS O O 1.564 -12.712 2.548 1.00 . A A . 15 LYS O 1 1 6 2613 1 1 16 MET C C 1.811 -8.733 1.990 1.00 . A A . 16 MET C 1 1 6 2614 1 1 16 MET CA C 1.609 -9.973 2.855 1.00 . A A . 16 MET CA 1 1 6 2615 1 1 16 MET CB C 1.366 -9.547 4.307 1.00 . A A . 16 MET CB 1 1 6 2616 1 1 16 MET CE C -0.910 -11.676 7.005 1.00 . A A . 16 MET CE 1 1 6 2617 1 1 16 MET CG C 0.773 -10.717 5.096 1.00 . A A . 16 MET CG 1 1 6 2618 1 1 16 MET H H 3.676 -10.442 2.840 1.00 . A A . 16 MET H 1 1 6 2619 1 1 16 MET HA H 0.744 -10.512 2.497 1.00 . A A . 16 MET HA 1 1 6 2620 1 1 16 MET HB2 H 2.303 -9.248 4.755 1.00 . A A . 16 MET HB2 1 1 6 2621 1 1 16 MET HB3 H 0.680 -8.716 4.330 1.00 . A A . 16 MET HB3 1 1 6 2622 1 1 16 MET HE1 H 0.030 -12.048 7.396 1.00 . A A . 16 MET HE1 1 1 6 2623 1 1 16 MET HE2 H -1.345 -12.404 6.337 1.00 . A A . 16 MET HE2 1 1 6 2624 1 1 16 MET HE3 H -1.593 -11.493 7.819 1.00 . A A . 16 MET HE3 1 1 6 2625 1 1 16 MET HG2 H 0.425 -11.476 4.411 1.00 . A A . 16 MET HG2 1 1 6 2626 1 1 16 MET HG3 H 1.529 -11.140 5.740 1.00 . A A . 16 MET HG3 1 1 6 2627 1 1 16 MET N N 2.781 -10.839 2.782 1.00 . A A . 16 MET N 1 1 6 2628 1 1 16 MET O O 2.458 -7.777 2.413 1.00 . A A . 16 MET O 1 1 6 2629 1 1 16 MET SD S -0.615 -10.132 6.101 1.00 . A A . 16 MET SD 1 1 6 2630 1 1 17 ALA C C 0.023 -7.152 -0.640 1.00 . A A . 17 ALA C 1 1 6 2631 1 1 17 ALA CA C 1.380 -7.598 -0.116 1.00 . A A . 17 ALA CA 1 1 6 2632 1 1 17 ALA CB C 2.298 -7.939 -1.286 1.00 . A A . 17 ALA CB 1 1 6 2633 1 1 17 ALA H H 0.736 -9.528 0.497 1.00 . A A . 17 ALA H 1 1 6 2634 1 1 17 ALA HA H 1.809 -6.778 0.437 1.00 . A A . 17 ALA HA 1 1 6 2635 1 1 17 ALA HB1 H 2.594 -7.028 -1.789 1.00 . A A . 17 ALA HB1 1 1 6 2636 1 1 17 ALA HB2 H 1.772 -8.576 -1.980 1.00 . A A . 17 ALA HB2 1 1 6 2637 1 1 17 ALA HB3 H 3.176 -8.449 -0.920 1.00 . A A . 17 ALA HB3 1 1 6 2638 1 1 17 ALA N N 1.248 -8.744 0.784 1.00 . A A . 17 ALA N 1 1 6 2639 1 1 17 ALA O O -0.731 -7.939 -1.211 1.00 . A A . 17 ALA O 1 1 6 2640 1 1 18 LYS C C -1.459 -3.761 -0.828 1.00 . A A . 18 LYS C 1 1 6 2641 1 1 18 LYS CA C -1.546 -5.296 -0.840 1.00 . A A . 18 LYS CA 1 1 6 2642 1 1 18 LYS CB C -2.636 -5.773 0.113 1.00 . A A . 18 LYS CB 1 1 6 2643 1 1 18 LYS CD C -1.529 -6.825 2.111 1.00 . A A . 18 LYS CD 1 1 6 2644 1 1 18 LYS CE C -1.630 -6.830 3.639 1.00 . A A . 18 LYS CE 1 1 6 2645 1 1 18 LYS CG C -2.175 -5.549 1.556 1.00 . A A . 18 LYS CG 1 1 6 2646 1 1 18 LYS H H 0.373 -5.319 0.054 1.00 . A A . 18 LYS H 1 1 6 2647 1 1 18 LYS HA H -1.779 -5.630 -1.835 1.00 . A A . 18 LYS HA 1 1 6 2648 1 1 18 LYS HB2 H -3.543 -5.216 -0.072 1.00 . A A . 18 LYS HB2 1 1 6 2649 1 1 18 LYS HB3 H -2.816 -6.823 -0.049 1.00 . A A . 18 LYS HB3 1 1 6 2650 1 1 18 LYS HD2 H -2.039 -7.690 1.714 1.00 . A A . 18 LYS HD2 1 1 6 2651 1 1 18 LYS HD3 H -0.490 -6.857 1.824 1.00 . A A . 18 LYS HD3 1 1 6 2652 1 1 18 LYS HE2 H -2.670 -6.798 3.934 1.00 . A A . 18 LYS HE2 1 1 6 2653 1 1 18 LYS HE3 H -1.177 -7.731 4.027 1.00 . A A . 18 LYS HE3 1 1 6 2654 1 1 18 LYS HG2 H -1.452 -4.748 1.577 1.00 . A A . 18 LYS HG2 1 1 6 2655 1 1 18 LYS HG3 H -3.023 -5.284 2.162 1.00 . A A . 18 LYS HG3 1 1 6 2656 1 1 18 LYS HZ1 H -1.500 -4.771 4.023 1.00 . A A . 18 LYS HZ1 1 1 6 2657 1 1 18 LYS HZ2 H -0.002 -5.530 3.716 1.00 . A A . 18 LYS HZ2 1 1 6 2658 1 1 18 LYS HZ3 H -0.775 -5.761 5.213 1.00 . A A . 18 LYS HZ3 1 1 6 2659 1 1 18 LYS N N -0.276 -5.880 -0.415 1.00 . A A . 18 LYS N 1 1 6 2660 1 1 18 LYS NZ N -0.921 -5.638 4.189 1.00 . A A . 18 LYS NZ 1 1 6 2661 1 1 18 LYS O O -1.902 -3.117 0.120 1.00 . A A . 18 LYS O 1 1 6 2662 1 1 19 PRO C C -1.989 -0.907 -2.200 1.00 . A A . 19 PRO C 1 1 6 2663 1 1 19 PRO CA C -0.696 -1.685 -1.912 1.00 . A A . 19 PRO CA 1 1 6 2664 1 1 19 PRO CB C 0.338 -1.499 -3.028 1.00 . A A . 19 PRO CB 1 1 6 2665 1 1 19 PRO CD C -0.327 -3.857 -3.017 1.00 . A A . 19 PRO CD 1 1 6 2666 1 1 19 PRO CG C 0.291 -2.740 -3.863 1.00 . A A . 19 PRO CG 1 1 6 2667 1 1 19 PRO HA H -0.273 -1.331 -0.989 1.00 . A A . 19 PRO HA 1 1 6 2668 1 1 19 PRO HB2 H 0.088 -0.636 -3.628 1.00 . A A . 19 PRO HB2 1 1 6 2669 1 1 19 PRO HB3 H 1.324 -1.381 -2.604 1.00 . A A . 19 PRO HB3 1 1 6 2670 1 1 19 PRO HD2 H -1.115 -4.351 -3.567 1.00 . A A . 19 PRO HD2 1 1 6 2671 1 1 19 PRO HD3 H 0.428 -4.566 -2.717 1.00 . A A . 19 PRO HD3 1 1 6 2672 1 1 19 PRO HG2 H -0.312 -2.566 -4.745 1.00 . A A . 19 PRO HG2 1 1 6 2673 1 1 19 PRO HG3 H 1.291 -3.022 -4.156 1.00 . A A . 19 PRO HG3 1 1 6 2674 1 1 19 PRO N N -0.874 -3.171 -1.839 1.00 . A A . 19 PRO N 1 1 6 2675 1 1 19 PRO O O -2.690 -1.174 -3.177 1.00 . A A . 19 PRO O 1 1 6 2676 1 1 20 THR C C -3.129 2.391 -1.374 1.00 . A A . 20 THR C 1 1 6 2677 1 1 20 THR CA C -3.483 0.901 -1.468 1.00 . A A . 20 THR CA 1 1 6 2678 1 1 20 THR CB C -4.499 0.564 -0.363 1.00 . A A . 20 THR CB 1 1 6 2679 1 1 20 THR CG2 C -4.794 -0.928 -0.350 1.00 . A A . 20 THR CG2 1 1 6 2680 1 1 20 THR H H -1.679 0.229 -0.571 1.00 . A A . 20 THR H 1 1 6 2681 1 1 20 THR HA H -3.936 0.709 -2.429 1.00 . A A . 20 THR HA 1 1 6 2682 1 1 20 THR HB H -5.415 1.100 -0.537 1.00 . A A . 20 THR HB 1 1 6 2683 1 1 20 THR HG1 H -3.051 0.610 0.944 1.00 . A A . 20 THR HG1 1 1 6 2684 1 1 20 THR HG21 H -4.923 -1.255 0.668 1.00 . A A . 20 THR HG21 1 1 6 2685 1 1 20 THR HG22 H -3.976 -1.466 -0.800 1.00 . A A . 20 THR HG22 1 1 6 2686 1 1 20 THR HG23 H -5.696 -1.120 -0.902 1.00 . A A . 20 THR HG23 1 1 6 2687 1 1 20 THR N N -2.285 0.066 -1.327 1.00 . A A . 20 THR N 1 1 6 2688 1 1 20 THR O O -2.618 2.852 -0.352 1.00 . A A . 20 THR O 1 1 6 2689 1 1 20 THR OG1 O -3.974 0.937 0.901 1.00 . A A . 20 THR OG1 1 1 6 2690 1 1 21 CYS C C -4.479 5.341 -2.779 1.00 . A A . 21 CYS C 1 1 6 2691 1 1 21 CYS CA C -3.186 4.590 -2.476 1.00 . A A . 21 CYS CA 1 1 6 2692 1 1 21 CYS CB C -2.111 4.949 -3.514 1.00 . A A . 21 CYS CB 1 1 6 2693 1 1 21 CYS H H -3.860 2.712 -3.210 1.00 . A A . 21 CYS H 1 1 6 2694 1 1 21 CYS HA H -2.835 4.901 -1.504 1.00 . A A . 21 CYS HA 1 1 6 2695 1 1 21 CYS HB2 H -1.955 4.112 -4.176 1.00 . A A . 21 CYS HB2 1 1 6 2696 1 1 21 CYS HB3 H -2.427 5.808 -4.085 1.00 . A A . 21 CYS HB3 1 1 6 2697 1 1 21 CYS N N -3.435 3.139 -2.439 1.00 . A A . 21 CYS N 1 1 6 2698 1 1 21 CYS O O -5.099 5.137 -3.830 1.00 . A A . 21 CYS O 1 1 6 2699 1 1 21 CYS SG S -0.565 5.329 -2.650 1.00 . A A . 21 CYS SG 1 1 6 2700 1 1 22 GLU C C -5.957 8.345 -1.432 1.00 . A A . 22 GLU C 1 1 6 2701 1 1 22 GLU CA C -6.126 6.932 -1.987 1.00 . A A . 22 GLU CA 1 1 6 2702 1 1 22 GLU CB C -7.271 6.202 -1.266 1.00 . A A . 22 GLU CB 1 1 6 2703 1 1 22 GLU CD C -6.551 3.995 -0.255 1.00 . A A . 22 GLU CD 1 1 6 2704 1 1 22 GLU CG C -6.743 5.493 -0.005 1.00 . A A . 22 GLU CG 1 1 6 2705 1 1 22 GLU H H -4.384 6.295 -1.021 1.00 . A A . 22 GLU H 1 1 6 2706 1 1 22 GLU HA H -6.369 7.000 -3.038 1.00 . A A . 22 GLU HA 1 1 6 2707 1 1 22 GLU HB2 H -8.030 6.918 -0.983 1.00 . A A . 22 GLU HB2 1 1 6 2708 1 1 22 GLU HB3 H -7.700 5.472 -1.931 1.00 . A A . 22 GLU HB3 1 1 6 2709 1 1 22 GLU HG2 H -5.799 5.927 0.282 1.00 . A A . 22 GLU HG2 1 1 6 2710 1 1 22 GLU HG3 H -7.451 5.627 0.798 1.00 . A A . 22 GLU HG3 1 1 6 2711 1 1 22 GLU N N -4.900 6.184 -1.840 1.00 . A A . 22 GLU N 1 1 6 2712 1 1 22 GLU O O -5.620 8.540 -0.267 1.00 . A A . 22 GLU O 1 1 6 2713 1 1 22 GLU OE1 O -5.881 3.640 -1.208 1.00 . A A . 22 GLU OE1 1 1 6 2714 1 1 22 GLU OE2 O -7.061 3.212 0.527 1.00 . A A . 22 GLU OE2 1 1 6 2715 1 1 23 ASN C C -4.767 11.032 -1.203 1.00 . A A . 23 ASN C 1 1 6 2716 1 1 23 ASN CA C -6.067 10.736 -1.951 1.00 . A A . 23 ASN CA 1 1 6 2717 1 1 23 ASN CB C -7.287 11.196 -1.134 1.00 . A A . 23 ASN CB 1 1 6 2718 1 1 23 ASN CG C -7.384 10.461 0.198 1.00 . A A . 23 ASN CG 1 1 6 2719 1 1 23 ASN H H -6.423 9.061 -3.204 1.00 . A A . 23 ASN H 1 1 6 2720 1 1 23 ASN HA H -6.052 11.302 -2.871 1.00 . A A . 23 ASN HA 1 1 6 2721 1 1 23 ASN HB2 H -7.209 12.256 -0.944 1.00 . A A . 23 ASN HB2 1 1 6 2722 1 1 23 ASN HB3 H -8.179 11.006 -1.706 1.00 . A A . 23 ASN HB3 1 1 6 2723 1 1 23 ASN HD21 H -5.744 11.288 0.936 1.00 . A A . 23 ASN HD21 1 1 6 2724 1 1 23 ASN HD22 H -6.542 10.193 1.965 1.00 . A A . 23 ASN HD22 1 1 6 2725 1 1 23 ASN N N -6.183 9.313 -2.298 1.00 . A A . 23 ASN N 1 1 6 2726 1 1 23 ASN ND2 N -6.485 10.662 1.110 1.00 . A A . 23 ASN ND2 1 1 6 2727 1 1 23 ASN O O -4.769 11.650 -0.136 1.00 . A A . 23 ASN O 1 1 6 2728 1 1 23 ASN OD1 O -8.317 9.691 0.416 1.00 . A A . 23 ASN OD1 1 1 6 2729 1 1 24 GLU C C -2.118 9.954 0.035 1.00 . A A . 24 GLU C 1 1 6 2730 1 1 24 GLU CA C -2.335 10.806 -1.215 1.00 . A A . 24 GLU CA 1 1 6 2731 1 1 24 GLU CB C -2.120 12.292 -0.898 1.00 . A A . 24 GLU CB 1 1 6 2732 1 1 24 GLU CD C -1.783 12.482 -3.391 1.00 . A A . 24 GLU CD 1 1 6 2733 1 1 24 GLU CG C -2.396 13.136 -2.155 1.00 . A A . 24 GLU CG 1 1 6 2734 1 1 24 GLU H H -3.735 10.120 -2.644 1.00 . A A . 24 GLU H 1 1 6 2735 1 1 24 GLU HA H -1.607 10.509 -1.950 1.00 . A A . 24 GLU HA 1 1 6 2736 1 1 24 GLU HB2 H -2.790 12.594 -0.107 1.00 . A A . 24 GLU HB2 1 1 6 2737 1 1 24 GLU HB3 H -1.099 12.447 -0.582 1.00 . A A . 24 GLU HB3 1 1 6 2738 1 1 24 GLU HG2 H -3.462 13.229 -2.296 1.00 . A A . 24 GLU HG2 1 1 6 2739 1 1 24 GLU HG3 H -1.968 14.120 -2.026 1.00 . A A . 24 GLU HG3 1 1 6 2740 1 1 24 GLU N N -3.662 10.592 -1.789 1.00 . A A . 24 GLU N 1 1 6 2741 1 1 24 GLU O O -1.012 9.910 0.576 1.00 . A A . 24 GLU O 1 1 6 2742 1 1 24 GLU OE1 O -2.420 11.598 -3.950 1.00 . A A . 24 GLU OE1 1 1 6 2743 1 1 24 GLU OE2 O -0.692 12.879 -3.766 1.00 . A A . 24 GLU OE2 1 1 6 2744 1 1 25 VAL C C -2.813 6.947 1.178 1.00 . A A . 25 VAL C 1 1 6 2745 1 1 25 VAL CA C -3.028 8.385 1.643 1.00 . A A . 25 VAL CA 1 1 6 2746 1 1 25 VAL CB C -4.286 8.480 2.518 1.00 . A A . 25 VAL CB 1 1 6 2747 1 1 25 VAL CG1 C -4.208 7.450 3.651 1.00 . A A . 25 VAL CG1 1 1 6 2748 1 1 25 VAL CG2 C -4.384 9.884 3.122 1.00 . A A . 25 VAL CG2 1 1 6 2749 1 1 25 VAL H H -4.015 9.296 -0.002 1.00 . A A . 25 VAL H 1 1 6 2750 1 1 25 VAL HA H -2.172 8.698 2.224 1.00 . A A . 25 VAL HA 1 1 6 2751 1 1 25 VAL HB H -5.161 8.283 1.914 1.00 . A A . 25 VAL HB 1 1 6 2752 1 1 25 VAL HG11 H -4.960 6.691 3.497 1.00 . A A . 25 VAL HG11 1 1 6 2753 1 1 25 VAL HG12 H -4.381 7.941 4.597 1.00 . A A . 25 VAL HG12 1 1 6 2754 1 1 25 VAL HG13 H -3.230 6.992 3.658 1.00 . A A . 25 VAL HG13 1 1 6 2755 1 1 25 VAL HG21 H -5.329 9.991 3.635 1.00 . A A . 25 VAL HG21 1 1 6 2756 1 1 25 VAL HG22 H -4.316 10.621 2.335 1.00 . A A . 25 VAL HG22 1 1 6 2757 1 1 25 VAL HG23 H -3.576 10.032 3.823 1.00 . A A . 25 VAL HG23 1 1 6 2758 1 1 25 VAL N N -3.156 9.250 0.475 1.00 . A A . 25 VAL N 1 1 6 2759 1 1 25 VAL O O -3.660 6.371 0.493 1.00 . A A . 25 VAL O 1 1 6 2760 1 1 26 CYS C C -1.320 4.045 2.275 1.00 . A A . 26 CYS C 1 1 6 2761 1 1 26 CYS CA C -1.344 5.020 1.101 1.00 . A A . 26 CYS CA 1 1 6 2762 1 1 26 CYS CB C 0.017 4.985 0.409 1.00 . A A . 26 CYS CB 1 1 6 2763 1 1 26 CYS H H -1.004 6.886 2.038 1.00 . A A . 26 CYS H 1 1 6 2764 1 1 26 CYS HA H -2.091 4.697 0.398 1.00 . A A . 26 CYS HA 1 1 6 2765 1 1 26 CYS HB2 H -0.077 4.470 -0.527 1.00 . A A . 26 CYS HB2 1 1 6 2766 1 1 26 CYS HB3 H 0.369 5.982 0.231 1.00 . A A . 26 CYS HB3 1 1 6 2767 1 1 26 CYS N N -1.659 6.380 1.520 1.00 . A A . 26 CYS N 1 1 6 2768 1 1 26 CYS O O -0.986 4.410 3.403 1.00 . A A . 26 CYS O 1 1 6 2769 1 1 26 CYS SG S 1.194 4.112 1.459 1.00 . A A . 26 CYS SG 1 1 6 2770 1 1 27 LYS C C -1.519 0.372 2.321 1.00 . A A . 27 LYS C 1 1 6 2771 1 1 27 LYS CA C -1.665 1.735 2.996 1.00 . A A . 27 LYS CA 1 1 6 2772 1 1 27 LYS CB C -2.973 1.740 3.799 1.00 . A A . 27 LYS CB 1 1 6 2773 1 1 27 LYS CD C -5.061 3.070 4.222 1.00 . A A . 27 LYS CD 1 1 6 2774 1 1 27 LYS CE C -5.792 2.172 3.217 1.00 . A A . 27 LYS CE 1 1 6 2775 1 1 27 LYS CG C -3.568 3.153 3.875 1.00 . A A . 27 LYS CG 1 1 6 2776 1 1 27 LYS H H -1.907 2.569 1.057 1.00 . A A . 27 LYS H 1 1 6 2777 1 1 27 LYS HA H -0.834 1.885 3.671 1.00 . A A . 27 LYS HA 1 1 6 2778 1 1 27 LYS HB2 H -3.678 1.080 3.320 1.00 . A A . 27 LYS HB2 1 1 6 2779 1 1 27 LYS HB3 H -2.777 1.381 4.799 1.00 . A A . 27 LYS HB3 1 1 6 2780 1 1 27 LYS HD2 H -5.177 2.665 5.217 1.00 . A A . 27 LYS HD2 1 1 6 2781 1 1 27 LYS HD3 H -5.490 4.061 4.190 1.00 . A A . 27 LYS HD3 1 1 6 2782 1 1 27 LYS HE2 H -5.599 1.134 3.450 1.00 . A A . 27 LYS HE2 1 1 6 2783 1 1 27 LYS HE3 H -6.856 2.359 3.277 1.00 . A A . 27 LYS HE3 1 1 6 2784 1 1 27 LYS HG2 H -3.051 3.717 4.640 1.00 . A A . 27 LYS HG2 1 1 6 2785 1 1 27 LYS HG3 H -3.450 3.649 2.928 1.00 . A A . 27 LYS HG3 1 1 6 2786 1 1 27 LYS HZ1 H -4.760 1.653 1.457 1.00 . A A . 27 LYS HZ1 1 1 6 2787 1 1 27 LYS HZ2 H -4.706 3.312 1.857 1.00 . A A . 27 LYS HZ2 1 1 6 2788 1 1 27 LYS HZ3 H -6.148 2.666 1.211 1.00 . A A . 27 LYS HZ3 1 1 6 2789 1 1 27 LYS N N -1.662 2.792 1.984 1.00 . A A . 27 LYS N 1 1 6 2790 1 1 27 LYS NZ N -5.313 2.475 1.839 1.00 . A A . 27 LYS NZ 1 1 6 2791 1 1 27 LYS O O -1.810 0.229 1.131 1.00 . A A . 27 LYS O 1 1 6 2792 1 1 28 CYS C C -2.155 -2.841 2.943 1.00 . A A . 28 CYS C 1 1 6 2793 1 1 28 CYS CA C -0.967 -1.972 2.518 1.00 . A A . 28 CYS CA 1 1 6 2794 1 1 28 CYS CB C 0.350 -2.617 2.957 1.00 . A A . 28 CYS CB 1 1 6 2795 1 1 28 CYS H H -0.906 -0.479 4.024 1.00 . A A . 28 CYS H 1 1 6 2796 1 1 28 CYS HA H -0.961 -1.891 1.446 1.00 . A A . 28 CYS HA 1 1 6 2797 1 1 28 CYS HB2 H 1.081 -1.845 3.155 1.00 . A A . 28 CYS HB2 1 1 6 2798 1 1 28 CYS HB3 H 0.191 -3.201 3.850 1.00 . A A . 28 CYS HB3 1 1 6 2799 1 1 28 CYS N N -1.102 -0.634 3.080 1.00 . A A . 28 CYS N 1 1 6 2800 1 1 28 CYS O O -2.044 -3.659 3.862 1.00 . A A . 28 CYS O 1 1 6 2801 1 1 28 CYS SG S 0.943 -3.691 1.622 1.00 . A A . 28 CYS SG 1 1 6 2802 1 1 29 ASN C C -5.139 -4.027 1.331 1.00 . A A . 29 ASN C 1 1 6 2803 1 1 29 ASN CA C -4.504 -3.417 2.588 1.00 . A A . 29 ASN CA 1 1 6 2804 1 1 29 ASN CB C -5.521 -2.505 3.281 1.00 . A A . 29 ASN CB 1 1 6 2805 1 1 29 ASN CG C -4.910 -1.887 4.534 1.00 . A A . 29 ASN CG 1 1 6 2806 1 1 29 ASN H H -3.318 -1.991 1.547 1.00 . A A . 29 ASN H 1 1 6 2807 1 1 29 ASN HA H -4.246 -4.211 3.262 1.00 . A A . 29 ASN HA 1 1 6 2808 1 1 29 ASN HB2 H -5.817 -1.719 2.604 1.00 . A A . 29 ASN HB2 1 1 6 2809 1 1 29 ASN HB3 H -6.389 -3.083 3.558 1.00 . A A . 29 ASN HB3 1 1 6 2810 1 1 29 ASN HD21 H -5.635 -3.270 5.754 1.00 . A A . 29 ASN HD21 1 1 6 2811 1 1 29 ASN HD22 H -4.711 -2.055 6.496 1.00 . A A . 29 ASN HD22 1 1 6 2812 1 1 29 ASN N N -3.292 -2.655 2.269 1.00 . A A . 29 ASN N 1 1 6 2813 1 1 29 ASN ND2 N -5.101 -2.451 5.690 1.00 . A A . 29 ASN ND2 1 1 6 2814 1 1 29 ASN O O -5.184 -3.401 0.279 1.00 . A A . 29 ASN O 1 1 6 2815 1 1 29 ASN OD1 O -4.246 -0.856 4.457 1.00 . A A . 29 ASN OD1 1 1 6 2816 1 1 30 ILE C C -7.693 -5.372 0.094 1.00 . A A . 30 ILE C 1 1 6 2817 1 1 30 ILE CA C -6.287 -5.920 0.322 1.00 . A A . 30 ILE CA 1 1 6 2818 1 1 30 ILE CB C -6.341 -7.449 0.514 1.00 . A A . 30 ILE CB 1 1 6 2819 1 1 30 ILE CD1 C -4.579 -7.624 2.265 1.00 . A A . 30 ILE CD1 1 1 6 2820 1 1 30 ILE CG1 C -6.070 -7.812 1.977 1.00 . A A . 30 ILE CG1 1 1 6 2821 1 1 30 ILE CG2 C -5.305 -8.129 -0.388 1.00 . A A . 30 ILE CG2 1 1 6 2822 1 1 30 ILE H H -5.591 -5.706 2.319 1.00 . A A . 30 ILE H 1 1 6 2823 1 1 30 ILE HA H -5.705 -5.712 -0.563 1.00 . A A . 30 ILE HA 1 1 6 2824 1 1 30 ILE HB H -7.324 -7.802 0.241 1.00 . A A . 30 ILE HB 1 1 6 2825 1 1 30 ILE HD11 H -4.458 -7.101 3.198 1.00 . A A . 30 ILE HD11 1 1 6 2826 1 1 30 ILE HD12 H -4.133 -7.048 1.468 1.00 . A A . 30 ILE HD12 1 1 6 2827 1 1 30 ILE HD13 H -4.098 -8.587 2.320 1.00 . A A . 30 ILE HD13 1 1 6 2828 1 1 30 ILE HG12 H -6.652 -7.176 2.625 1.00 . A A . 30 ILE HG12 1 1 6 2829 1 1 30 ILE HG13 H -6.337 -8.845 2.146 1.00 . A A . 30 ILE HG13 1 1 6 2830 1 1 30 ILE HG21 H -4.530 -7.425 -0.644 1.00 . A A . 30 ILE HG21 1 1 6 2831 1 1 30 ILE HG22 H -5.785 -8.476 -1.289 1.00 . A A . 30 ILE HG22 1 1 6 2832 1 1 30 ILE HG23 H -4.870 -8.969 0.134 1.00 . A A . 30 ILE HG23 1 1 6 2833 1 1 30 ILE N N -5.641 -5.249 1.454 1.00 . A A . 30 ILE N 1 1 6 2834 1 1 30 ILE O O -8.417 -5.058 1.039 1.00 . A A . 30 ILE O 1 1 6 2835 1 1 31 GLY C C -9.286 -3.413 -2.296 1.00 . A A . 31 GLY C 1 1 6 2836 1 1 31 GLY CA C -9.377 -4.755 -1.568 1.00 . A A . 31 GLY CA 1 1 6 2837 1 1 31 GLY H H -7.425 -5.539 -1.871 1.00 . A A . 31 GLY H 1 1 6 2838 1 1 31 GLY HA2 H -9.859 -5.473 -2.215 1.00 . A A . 31 GLY HA2 1 1 6 2839 1 1 31 GLY HA3 H -9.975 -4.627 -0.682 1.00 . A A . 31 GLY HA3 1 1 6 2840 1 1 31 GLY N N -8.059 -5.266 -1.179 1.00 . A A . 31 GLY N 1 1 6 2841 1 1 31 GLY O O -10.202 -3.036 -3.024 1.00 . A A . 31 GLY O 1 1 6 2842 1 1 32 LYS C C -6.604 -1.398 -3.453 1.00 . A A . 32 LYS C 1 1 6 2843 1 1 32 LYS CA C -7.972 -1.422 -2.771 1.00 . A A . 32 LYS CA 1 1 6 2844 1 1 32 LYS CB C -8.100 -0.280 -1.743 1.00 . A A . 32 LYS CB 1 1 6 2845 1 1 32 LYS CD C -8.111 1.601 -3.428 1.00 . A A . 32 LYS CD 1 1 6 2846 1 1 32 LYS CE C -7.694 3.067 -3.611 1.00 . A A . 32 LYS CE 1 1 6 2847 1 1 32 LYS CG C -7.370 0.986 -2.231 1.00 . A A . 32 LYS CG 1 1 6 2848 1 1 32 LYS H H -7.477 -3.068 -1.530 1.00 . A A . 32 LYS H 1 1 6 2849 1 1 32 LYS HA H -8.733 -1.296 -3.523 1.00 . A A . 32 LYS HA 1 1 6 2850 1 1 32 LYS HB2 H -9.145 -0.052 -1.596 1.00 . A A . 32 LYS HB2 1 1 6 2851 1 1 32 LYS HB3 H -7.672 -0.597 -0.803 1.00 . A A . 32 LYS HB3 1 1 6 2852 1 1 32 LYS HD2 H -7.870 1.048 -4.323 1.00 . A A . 32 LYS HD2 1 1 6 2853 1 1 32 LYS HD3 H -9.176 1.553 -3.255 1.00 . A A . 32 LYS HD3 1 1 6 2854 1 1 32 LYS HE2 H -7.971 3.400 -4.602 1.00 . A A . 32 LYS HE2 1 1 6 2855 1 1 32 LYS HE3 H -8.200 3.677 -2.875 1.00 . A A . 32 LYS HE3 1 1 6 2856 1 1 32 LYS HG2 H -7.339 1.705 -1.425 1.00 . A A . 32 LYS HG2 1 1 6 2857 1 1 32 LYS HG3 H -6.362 0.734 -2.522 1.00 . A A . 32 LYS HG3 1 1 6 2858 1 1 32 LYS HZ1 H -5.992 3.230 -2.396 1.00 . A A . 32 LYS HZ1 1 1 6 2859 1 1 32 LYS HZ2 H -5.880 4.093 -3.880 1.00 . A A . 32 LYS HZ2 1 1 6 2860 1 1 32 LYS HZ3 H -5.732 2.379 -3.885 1.00 . A A . 32 LYS HZ3 1 1 6 2861 1 1 32 LYS N N -8.176 -2.710 -2.111 1.00 . A A . 32 LYS N 1 1 6 2862 1 1 32 LYS NZ N -6.218 3.199 -3.436 1.00 . A A . 32 LYS NZ 1 1 6 2863 1 1 32 LYS O O -5.621 -1.900 -2.914 1.00 . A A . 32 LYS O 1 1 6 2864 1 1 33 LYS C C -4.549 0.543 -5.089 1.00 . A A . 33 LYS C 1 1 6 2865 1 1 33 LYS CA C -5.309 -0.744 -5.409 1.00 . A A . 33 LYS CA 1 1 6 2866 1 1 33 LYS CB C -5.615 -0.811 -6.911 1.00 . A A . 33 LYS CB 1 1 6 2867 1 1 33 LYS CD C -5.148 1.335 -8.130 1.00 . A A . 33 LYS CD 1 1 6 2868 1 1 33 LYS CE C -5.539 2.815 -8.156 1.00 . A A . 33 LYS CE 1 1 6 2869 1 1 33 LYS CG C -6.215 0.524 -7.381 1.00 . A A . 33 LYS CG 1 1 6 2870 1 1 33 LYS H H -7.373 -0.451 -5.033 1.00 . A A . 33 LYS H 1 1 6 2871 1 1 33 LYS HA H -4.683 -1.587 -5.143 1.00 . A A . 33 LYS HA 1 1 6 2872 1 1 33 LYS HB2 H -4.703 -1.011 -7.456 1.00 . A A . 33 LYS HB2 1 1 6 2873 1 1 33 LYS HB3 H -6.323 -1.605 -7.096 1.00 . A A . 33 LYS HB3 1 1 6 2874 1 1 33 LYS HD2 H -4.197 1.225 -7.630 1.00 . A A . 33 LYS HD2 1 1 6 2875 1 1 33 LYS HD3 H -5.063 0.970 -9.142 1.00 . A A . 33 LYS HD3 1 1 6 2876 1 1 33 LYS HE2 H -6.085 3.028 -9.065 1.00 . A A . 33 LYS HE2 1 1 6 2877 1 1 33 LYS HE3 H -6.162 3.040 -7.302 1.00 . A A . 33 LYS HE3 1 1 6 2878 1 1 33 LYS HG2 H -7.049 0.329 -8.041 1.00 . A A . 33 LYS HG2 1 1 6 2879 1 1 33 LYS HG3 H -6.558 1.085 -6.525 1.00 . A A . 33 LYS HG3 1 1 6 2880 1 1 33 LYS HZ1 H -4.425 4.499 -8.688 1.00 . A A . 33 LYS HZ1 1 1 6 2881 1 1 33 LYS HZ2 H -3.492 3.096 -8.454 1.00 . A A . 33 LYS HZ2 1 1 6 2882 1 1 33 LYS HZ3 H -4.107 3.928 -7.100 1.00 . A A . 33 LYS HZ3 1 1 6 2883 1 1 33 LYS N N -6.554 -0.823 -4.648 1.00 . A A . 33 LYS N 1 1 6 2884 1 1 33 LYS NZ N -4.306 3.650 -8.106 1.00 . A A . 33 LYS NZ 1 1 6 2885 1 1 33 LYS O O -5.119 1.503 -4.548 1.00 . A A . 33 LYS O 1 1 6 2886 1 1 34 ASP C C -2.694 2.782 -6.263 1.00 . A A . 34 ASP C 1 1 6 2887 1 1 34 ASP CA C -2.439 1.730 -5.182 1.00 . A A . 34 ASP CA 1 1 6 2888 1 1 34 ASP CB C -0.959 1.334 -5.151 1.00 . A A . 34 ASP CB 1 1 6 2889 1 1 34 ASP CG C -0.287 1.947 -3.927 1.00 . A A . 34 ASP CG 1 1 6 2890 1 1 34 ASP H H -2.869 -0.229 -5.852 1.00 . A A . 34 ASP H 1 1 6 2891 1 1 34 ASP HA H -2.704 2.146 -4.228 1.00 . A A . 34 ASP HA 1 1 6 2892 1 1 34 ASP HB2 H -0.876 0.260 -5.107 1.00 . A A . 34 ASP HB2 1 1 6 2893 1 1 34 ASP HB3 H -0.469 1.695 -6.043 1.00 . A A . 34 ASP HB3 1 1 6 2894 1 1 34 ASP N N -3.265 0.558 -5.427 1.00 . A A . 34 ASP N 1 1 6 2895 1 1 34 ASP O O -3.411 3.735 -5.980 1.00 . A A . 34 ASP O 1 1 6 2896 1 1 34 ASP OXT O -2.203 2.612 -7.371 1.00 . A A . 34 ASP OXT 1 1 6 2897 1 1 34 ASP OD1 O -0.510 1.449 -2.838 1.00 . A A . 34 ASP OD1 1 1 6 2898 1 1 34 ASP OD2 O 0.434 2.909 -4.095 1.00 . A A . 34 ASP OD2 1 1 7 2899 1 1 1 GLY C C 11.682 8.581 -1.273 1.00 . A A . 1 GLY C 1 1 7 2900 1 1 1 GLY CA C 12.270 8.348 0.121 1.00 . A A . 1 GLY CA 1 1 7 2901 1 1 1 GLY H1 H 11.197 6.541 0.167 1.00 . A A . 1 GLY H1 1 1 7 2902 1 1 1 GLY H2 H 10.651 7.704 1.287 1.00 . A A . 1 GLY H2 1 1 7 2903 1 1 1 GLY H3 H 12.093 6.857 1.579 1.00 . A A . 1 GLY H3 1 1 7 2904 1 1 1 GLY HA2 H 12.227 9.270 0.685 1.00 . A A . 1 GLY HA2 1 1 7 2905 1 1 1 GLY HA3 H 13.300 8.038 0.022 1.00 . A A . 1 GLY HA3 1 1 7 2906 1 1 1 GLY N N 11.499 7.287 0.844 1.00 . A A . 1 GLY N 1 1 7 2907 1 1 1 GLY O O 12.278 9.275 -2.093 1.00 . A A . 1 GLY O 1 1 7 2908 1 1 2 SER C C 8.388 8.525 -2.651 1.00 . A A . 2 SER C 1 1 7 2909 1 1 2 SER CA C 9.856 8.135 -2.833 1.00 . A A . 2 SER CA 1 1 7 2910 1 1 2 SER CB C 9.944 6.814 -3.600 1.00 . A A . 2 SER CB 1 1 7 2911 1 1 2 SER H H 10.091 7.446 -0.844 1.00 . A A . 2 SER H 1 1 7 2912 1 1 2 SER HA H 10.355 8.905 -3.404 1.00 . A A . 2 SER HA 1 1 7 2913 1 1 2 SER HB2 H 10.965 6.637 -3.899 1.00 . A A . 2 SER HB2 1 1 7 2914 1 1 2 SER HB3 H 9.618 6.006 -2.955 1.00 . A A . 2 SER HB3 1 1 7 2915 1 1 2 SER HG H 9.616 6.534 -5.505 1.00 . A A . 2 SER HG 1 1 7 2916 1 1 2 SER N N 10.517 7.994 -1.534 1.00 . A A . 2 SER N 1 1 7 2917 1 1 2 SER O O 8.019 9.155 -1.659 1.00 . A A . 2 SER O 1 1 7 2918 1 1 2 SER OG O 9.115 6.880 -4.758 1.00 . A A . 2 SER OG 1 1 7 2919 1 1 3 VAL C C 5.379 7.392 -2.743 1.00 . A A . 3 VAL C 1 1 7 2920 1 1 3 VAL CA C 6.129 8.451 -3.553 1.00 . A A . 3 VAL CA 1 1 7 2921 1 1 3 VAL CB C 5.551 8.539 -4.970 1.00 . A A . 3 VAL CB 1 1 7 2922 1 1 3 VAL CG1 C 5.871 9.911 -5.566 1.00 . A A . 3 VAL CG1 1 1 7 2923 1 1 3 VAL CG2 C 6.170 7.453 -5.853 1.00 . A A . 3 VAL CG2 1 1 7 2924 1 1 3 VAL H H 7.914 7.633 -4.380 1.00 . A A . 3 VAL H 1 1 7 2925 1 1 3 VAL HA H 6.002 9.408 -3.069 1.00 . A A . 3 VAL HA 1 1 7 2926 1 1 3 VAL HB H 4.481 8.404 -4.929 1.00 . A A . 3 VAL HB 1 1 7 2927 1 1 3 VAL HG11 H 6.926 9.967 -5.794 1.00 . A A . 3 VAL HG11 1 1 7 2928 1 1 3 VAL HG12 H 5.615 10.682 -4.857 1.00 . A A . 3 VAL HG12 1 1 7 2929 1 1 3 VAL HG13 H 5.300 10.052 -6.473 1.00 . A A . 3 VAL HG13 1 1 7 2930 1 1 3 VAL HG21 H 7.167 7.751 -6.143 1.00 . A A . 3 VAL HG21 1 1 7 2931 1 1 3 VAL HG22 H 5.564 7.318 -6.736 1.00 . A A . 3 VAL HG22 1 1 7 2932 1 1 3 VAL HG23 H 6.218 6.526 -5.305 1.00 . A A . 3 VAL HG23 1 1 7 2933 1 1 3 VAL N N 7.556 8.142 -3.612 1.00 . A A . 3 VAL N 1 1 7 2934 1 1 3 VAL O O 5.438 6.200 -3.049 1.00 . A A . 3 VAL O 1 1 7 2935 1 1 4 GLY C C 3.494 5.654 -1.487 1.00 . A A . 4 GLY C 1 1 7 2936 1 1 4 GLY CA C 3.924 6.958 -0.812 1.00 . A A . 4 GLY CA 1 1 7 2937 1 1 4 GLY H H 4.694 8.807 -1.514 1.00 . A A . 4 GLY H 1 1 7 2938 1 1 4 GLY HA2 H 4.535 6.717 0.045 1.00 . A A . 4 GLY HA2 1 1 7 2939 1 1 4 GLY HA3 H 3.041 7.481 -0.472 1.00 . A A . 4 GLY HA3 1 1 7 2940 1 1 4 GLY N N 4.685 7.845 -1.701 1.00 . A A . 4 GLY N 1 1 7 2941 1 1 4 GLY O O 3.825 4.571 -1.016 1.00 . A A . 4 GLY O 1 1 7 2942 1 1 5 CYS C C 3.368 3.614 -3.639 1.00 . A A . 5 CYS C 1 1 7 2943 1 1 5 CYS CA C 2.244 4.581 -3.280 1.00 . A A . 5 CYS CA 1 1 7 2944 1 1 5 CYS CB C 1.507 5.005 -4.549 1.00 . A A . 5 CYS CB 1 1 7 2945 1 1 5 CYS H H 2.486 6.650 -2.895 1.00 . A A . 5 CYS H 1 1 7 2946 1 1 5 CYS HA H 1.551 4.065 -2.633 1.00 . A A . 5 CYS HA 1 1 7 2947 1 1 5 CYS HB2 H 2.218 5.354 -5.283 1.00 . A A . 5 CYS HB2 1 1 7 2948 1 1 5 CYS HB3 H 0.968 4.162 -4.946 1.00 . A A . 5 CYS HB3 1 1 7 2949 1 1 5 CYS N N 2.736 5.763 -2.571 1.00 . A A . 5 CYS N 1 1 7 2950 1 1 5 CYS O O 3.134 2.418 -3.780 1.00 . A A . 5 CYS O 1 1 7 2951 1 1 5 CYS SG S 0.345 6.336 -4.152 1.00 . A A . 5 CYS SG 1 1 7 2952 1 1 6 ALA C C 6.330 2.741 -2.787 1.00 . A A . 6 ALA C 1 1 7 2953 1 1 6 ALA CA C 5.730 3.280 -4.082 1.00 . A A . 6 ALA CA 1 1 7 2954 1 1 6 ALA CB C 6.777 4.085 -4.850 1.00 . A A . 6 ALA CB 1 1 7 2955 1 1 6 ALA H H 4.718 5.094 -3.627 1.00 . A A . 6 ALA H 1 1 7 2956 1 1 6 ALA HA H 5.404 2.450 -4.691 1.00 . A A . 6 ALA HA 1 1 7 2957 1 1 6 ALA HB1 H 6.358 4.416 -5.788 1.00 . A A . 6 ALA HB1 1 1 7 2958 1 1 6 ALA HB2 H 7.641 3.465 -5.040 1.00 . A A . 6 ALA HB2 1 1 7 2959 1 1 6 ALA HB3 H 7.073 4.944 -4.265 1.00 . A A . 6 ALA HB3 1 1 7 2960 1 1 6 ALA N N 4.583 4.127 -3.766 1.00 . A A . 6 ALA N 1 1 7 2961 1 1 6 ALA O O 6.686 1.563 -2.678 1.00 . A A . 6 ALA O 1 1 7 2962 1 1 7 GLU C C 5.937 2.329 0.219 1.00 . A A . 7 GLU C 1 1 7 2963 1 1 7 GLU CA C 6.935 3.235 -0.495 1.00 . A A . 7 GLU CA 1 1 7 2964 1 1 7 GLU CB C 7.200 4.486 0.336 1.00 . A A . 7 GLU CB 1 1 7 2965 1 1 7 GLU CD C 9.167 6.022 0.130 1.00 . A A . 7 GLU CD 1 1 7 2966 1 1 7 GLU CG C 7.908 5.512 -0.547 1.00 . A A . 7 GLU CG 1 1 7 2967 1 1 7 GLU H H 6.091 4.531 -1.939 1.00 . A A . 7 GLU H 1 1 7 2968 1 1 7 GLU HA H 7.864 2.707 -0.632 1.00 . A A . 7 GLU HA 1 1 7 2969 1 1 7 GLU HB2 H 6.262 4.893 0.689 1.00 . A A . 7 GLU HB2 1 1 7 2970 1 1 7 GLU HB3 H 7.829 4.238 1.177 1.00 . A A . 7 GLU HB3 1 1 7 2971 1 1 7 GLU HG2 H 8.179 5.045 -1.484 1.00 . A A . 7 GLU HG2 1 1 7 2972 1 1 7 GLU HG3 H 7.245 6.338 -0.739 1.00 . A A . 7 GLU HG3 1 1 7 2973 1 1 7 GLU N N 6.409 3.613 -1.795 1.00 . A A . 7 GLU N 1 1 7 2974 1 1 7 GLU O O 6.315 1.408 0.941 1.00 . A A . 7 GLU O 1 1 7 2975 1 1 7 GLU OE1 O 9.052 6.729 1.115 1.00 . A A . 7 GLU OE1 1 1 7 2976 1 1 7 GLU OE2 O 10.241 5.723 -0.365 1.00 . A A . 7 GLU OE2 1 1 7 2977 1 1 8 CYS C C 3.857 0.321 0.429 1.00 . A A . 8 CYS C 1 1 7 2978 1 1 8 CYS CA C 3.595 1.812 0.616 1.00 . A A . 8 CYS CA 1 1 7 2979 1 1 8 CYS CB C 2.230 2.197 0.048 1.00 . A A . 8 CYS CB 1 1 7 2980 1 1 8 CYS H H 4.414 3.352 -0.589 1.00 . A A . 8 CYS H 1 1 7 2981 1 1 8 CYS HA H 3.590 2.029 1.668 1.00 . A A . 8 CYS HA 1 1 7 2982 1 1 8 CYS HB2 H 2.329 3.074 -0.570 1.00 . A A . 8 CYS HB2 1 1 7 2983 1 1 8 CYS HB3 H 1.824 1.396 -0.532 1.00 . A A . 8 CYS HB3 1 1 7 2984 1 1 8 CYS N N 4.653 2.601 0.001 1.00 . A A . 8 CYS N 1 1 7 2985 1 1 8 CYS O O 3.983 -0.417 1.407 1.00 . A A . 8 CYS O 1 1 7 2986 1 1 8 CYS SG S 1.132 2.554 1.430 1.00 . A A . 8 CYS SG 1 1 7 2987 1 1 9 PRO C C 5.599 -1.941 -0.438 1.00 . A A . 9 PRO C 1 1 7 2988 1 1 9 PRO CA C 4.267 -1.564 -1.070 1.00 . A A . 9 PRO CA 1 1 7 2989 1 1 9 PRO CB C 4.305 -1.679 -2.599 1.00 . A A . 9 PRO CB 1 1 7 2990 1 1 9 PRO CD C 3.851 0.649 -2.030 1.00 . A A . 9 PRO CD 1 1 7 2991 1 1 9 PRO CG C 4.374 -0.282 -3.126 1.00 . A A . 9 PRO CG 1 1 7 2992 1 1 9 PRO HA H 3.480 -2.187 -0.675 1.00 . A A . 9 PRO HA 1 1 7 2993 1 1 9 PRO HB2 H 5.177 -2.239 -2.910 1.00 . A A . 9 PRO HB2 1 1 7 2994 1 1 9 PRO HB3 H 3.409 -2.160 -2.958 1.00 . A A . 9 PRO HB3 1 1 7 2995 1 1 9 PRO HD2 H 4.454 1.540 -1.977 1.00 . A A . 9 PRO HD2 1 1 7 2996 1 1 9 PRO HD3 H 2.820 0.901 -2.211 1.00 . A A . 9 PRO HD3 1 1 7 2997 1 1 9 PRO HG2 H 5.396 -0.032 -3.372 1.00 . A A . 9 PRO HG2 1 1 7 2998 1 1 9 PRO HG3 H 3.752 -0.188 -4.003 1.00 . A A . 9 PRO HG3 1 1 7 2999 1 1 9 PRO N N 3.975 -0.136 -0.796 1.00 . A A . 9 PRO N 1 1 7 3000 1 1 9 PRO O O 5.710 -2.964 0.242 1.00 . A A . 9 PRO O 1 1 7 3001 1 1 10 MET C C 7.758 -1.485 1.475 1.00 . A A . 10 MET C 1 1 7 3002 1 1 10 MET CA C 7.910 -1.302 -0.032 1.00 . A A . 10 MET CA 1 1 7 3003 1 1 10 MET CB C 8.823 -0.108 -0.318 1.00 . A A . 10 MET CB 1 1 7 3004 1 1 10 MET CE C 11.015 -0.681 -3.730 1.00 . A A . 10 MET CE 1 1 7 3005 1 1 10 MET CG C 9.193 -0.078 -1.803 1.00 . A A . 10 MET CG 1 1 7 3006 1 1 10 MET H H 6.443 -0.258 -1.151 1.00 . A A . 10 MET H 1 1 7 3007 1 1 10 MET HA H 8.346 -2.195 -0.455 1.00 . A A . 10 MET HA 1 1 7 3008 1 1 10 MET HB2 H 8.313 0.804 -0.053 1.00 . A A . 10 MET HB2 1 1 7 3009 1 1 10 MET HB3 H 9.721 -0.197 0.270 1.00 . A A . 10 MET HB3 1 1 7 3010 1 1 10 MET HE1 H 10.962 -1.756 -3.832 1.00 . A A . 10 MET HE1 1 1 7 3011 1 1 10 MET HE2 H 11.928 -0.315 -4.177 1.00 . A A . 10 MET HE2 1 1 7 3012 1 1 10 MET HE3 H 10.171 -0.232 -4.229 1.00 . A A . 10 MET HE3 1 1 7 3013 1 1 10 MET HG2 H 8.704 -0.894 -2.316 1.00 . A A . 10 MET HG2 1 1 7 3014 1 1 10 MET HG3 H 8.876 0.861 -2.234 1.00 . A A . 10 MET HG3 1 1 7 3015 1 1 10 MET N N 6.599 -1.076 -0.626 1.00 . A A . 10 MET N 1 1 7 3016 1 1 10 MET O O 8.448 -2.295 2.089 1.00 . A A . 10 MET O 1 1 7 3017 1 1 10 MET SD S 10.988 -0.241 -1.975 1.00 . A A . 10 MET SD 1 1 7 3018 1 1 11 HIS C C 5.670 -2.015 3.803 1.00 . A A . 11 HIS C 1 1 7 3019 1 1 11 HIS CA C 6.576 -0.819 3.496 1.00 . A A . 11 HIS CA 1 1 7 3020 1 1 11 HIS CB C 5.921 0.472 3.998 1.00 . A A . 11 HIS CB 1 1 7 3021 1 1 11 HIS CD2 C 6.745 2.023 5.956 1.00 . A A . 11 HIS CD2 1 1 7 3022 1 1 11 HIS CE1 C 7.238 0.481 7.397 1.00 . A A . 11 HIS CE1 1 1 7 3023 1 1 11 HIS CG C 6.466 0.819 5.360 1.00 . A A . 11 HIS CG 1 1 7 3024 1 1 11 HIS H H 6.305 -0.101 1.513 1.00 . A A . 11 HIS H 1 1 7 3025 1 1 11 HIS HA H 7.516 -0.956 4.010 1.00 . A A . 11 HIS HA 1 1 7 3026 1 1 11 HIS HB2 H 6.135 1.275 3.310 1.00 . A A . 11 HIS HB2 1 1 7 3027 1 1 11 HIS HB3 H 4.852 0.332 4.066 1.00 . A A . 11 HIS HB3 1 1 7 3028 1 1 11 HIS HD2 H 6.607 2.991 5.498 1.00 . A A . 11 HIS HD2 1 1 7 3029 1 1 11 HIS HE1 H 7.563 -0.024 8.296 1.00 . A A . 11 HIS HE1 1 1 7 3030 1 1 11 HIS HE2 H 7.513 2.484 7.895 1.00 . A A . 11 HIS HE2 1 1 7 3031 1 1 11 HIS N N 6.832 -0.729 2.061 1.00 . A A . 11 HIS N 1 1 7 3032 1 1 11 HIS ND1 N 6.789 -0.150 6.298 1.00 . A A . 11 HIS ND1 1 1 7 3033 1 1 11 HIS NE2 N 7.232 1.808 7.243 1.00 . A A . 11 HIS NE2 1 1 7 3034 1 1 11 HIS O O 5.223 -2.200 4.941 1.00 . A A . 11 HIS O 1 1 7 3035 1 1 12 CYS C C 5.471 -5.237 3.229 1.00 . A A . 12 CYS C 1 1 7 3036 1 1 12 CYS CA C 4.586 -4.028 2.973 1.00 . A A . 12 CYS CA 1 1 7 3037 1 1 12 CYS CB C 3.705 -4.274 1.751 1.00 . A A . 12 CYS CB 1 1 7 3038 1 1 12 CYS H H 5.820 -2.663 1.908 1.00 . A A . 12 CYS H 1 1 7 3039 1 1 12 CYS HA H 3.949 -3.874 3.833 1.00 . A A . 12 CYS HA 1 1 7 3040 1 1 12 CYS HB2 H 3.653 -3.378 1.157 1.00 . A A . 12 CYS HB2 1 1 7 3041 1 1 12 CYS HB3 H 4.121 -5.079 1.161 1.00 . A A . 12 CYS HB3 1 1 7 3042 1 1 12 CYS N N 5.423 -2.845 2.791 1.00 . A A . 12 CYS N 1 1 7 3043 1 1 12 CYS O O 6.573 -5.341 2.695 1.00 . A A . 12 CYS O 1 1 7 3044 1 1 12 CYS SG S 2.040 -4.732 2.304 1.00 . A A . 12 CYS SG 1 1 7 3045 1 1 13 LYS C C 5.380 -8.544 3.730 1.00 . A A . 13 LYS C 1 1 7 3046 1 1 13 LYS CA C 5.786 -7.276 4.495 1.00 . A A . 13 LYS CA 1 1 7 3047 1 1 13 LYS CB C 5.635 -7.476 6.008 1.00 . A A . 13 LYS CB 1 1 7 3048 1 1 13 LYS CD C 5.935 -5.009 6.519 1.00 . A A . 13 LYS CD 1 1 7 3049 1 1 13 LYS CE C 6.758 -3.988 7.314 1.00 . A A . 13 LYS CE 1 1 7 3050 1 1 13 LYS CG C 6.482 -6.430 6.762 1.00 . A A . 13 LYS CG 1 1 7 3051 1 1 13 LYS H H 4.138 -5.948 4.524 1.00 . A A . 13 LYS H 1 1 7 3052 1 1 13 LYS HA H 6.826 -7.076 4.285 1.00 . A A . 13 LYS HA 1 1 7 3053 1 1 13 LYS HB2 H 4.595 -7.365 6.282 1.00 . A A . 13 LYS HB2 1 1 7 3054 1 1 13 LYS HB3 H 5.971 -8.467 6.274 1.00 . A A . 13 LYS HB3 1 1 7 3055 1 1 13 LYS HD2 H 6.000 -4.773 5.471 1.00 . A A . 13 LYS HD2 1 1 7 3056 1 1 13 LYS HD3 H 4.904 -4.962 6.836 1.00 . A A . 13 LYS HD3 1 1 7 3057 1 1 13 LYS HE2 H 6.498 -4.058 8.361 1.00 . A A . 13 LYS HE2 1 1 7 3058 1 1 13 LYS HE3 H 7.810 -4.205 7.192 1.00 . A A . 13 LYS HE3 1 1 7 3059 1 1 13 LYS HG2 H 6.454 -6.648 7.820 1.00 . A A . 13 LYS HG2 1 1 7 3060 1 1 13 LYS HG3 H 7.505 -6.482 6.416 1.00 . A A . 13 LYS HG3 1 1 7 3061 1 1 13 LYS HZ1 H 7.361 -2.138 6.534 1.00 . A A . 13 LYS HZ1 1 1 7 3062 1 1 13 LYS HZ2 H 6.032 -2.042 7.577 1.00 . A A . 13 LYS HZ2 1 1 7 3063 1 1 13 LYS HZ3 H 5.819 -2.631 5.989 1.00 . A A . 13 LYS HZ3 1 1 7 3064 1 1 13 LYS N N 5.006 -6.111 4.102 1.00 . A A . 13 LYS N 1 1 7 3065 1 1 13 LYS NZ N 6.473 -2.600 6.820 1.00 . A A . 13 LYS NZ 1 1 7 3066 1 1 13 LYS O O 4.203 -8.779 3.445 1.00 . A A . 13 LYS O 1 1 7 3067 1 1 14 GLY C C 4.994 -11.385 3.077 1.00 . A A . 14 GLY C 1 1 7 3068 1 1 14 GLY CA C 6.227 -10.592 2.645 1.00 . A A . 14 GLY CA 1 1 7 3069 1 1 14 GLY H H 7.306 -9.069 3.647 1.00 . A A . 14 GLY H 1 1 7 3070 1 1 14 GLY HA2 H 6.141 -10.361 1.594 1.00 . A A . 14 GLY HA2 1 1 7 3071 1 1 14 GLY HA3 H 7.102 -11.208 2.794 1.00 . A A . 14 GLY HA3 1 1 7 3072 1 1 14 GLY N N 6.398 -9.340 3.392 1.00 . A A . 14 GLY N 1 1 7 3073 1 1 14 GLY O O 4.659 -11.448 4.259 1.00 . A A . 14 GLY O 1 1 7 3074 1 1 15 LYS C C 1.864 -11.978 2.247 1.00 . A A . 15 LYS C 1 1 7 3075 1 1 15 LYS CA C 3.140 -12.816 2.305 1.00 . A A . 15 LYS CA 1 1 7 3076 1 1 15 LYS CB C 3.223 -13.548 3.654 1.00 . A A . 15 LYS CB 1 1 7 3077 1 1 15 LYS CD C 1.018 -14.618 4.206 1.00 . A A . 15 LYS CD 1 1 7 3078 1 1 15 LYS CE C -0.056 -15.260 3.323 1.00 . A A . 15 LYS CE 1 1 7 3079 1 1 15 LYS CG C 2.408 -14.846 3.593 1.00 . A A . 15 LYS CG 1 1 7 3080 1 1 15 LYS H H 4.681 -11.901 1.173 1.00 . A A . 15 LYS H 1 1 7 3081 1 1 15 LYS HA H 3.091 -13.558 1.519 1.00 . A A . 15 LYS HA 1 1 7 3082 1 1 15 LYS HB2 H 4.255 -13.783 3.871 1.00 . A A . 15 LYS HB2 1 1 7 3083 1 1 15 LYS HB3 H 2.829 -12.914 4.433 1.00 . A A . 15 LYS HB3 1 1 7 3084 1 1 15 LYS HD2 H 0.984 -15.063 5.191 1.00 . A A . 15 LYS HD2 1 1 7 3085 1 1 15 LYS HD3 H 0.828 -13.559 4.286 1.00 . A A . 15 LYS HD3 1 1 7 3086 1 1 15 LYS HE2 H 0.397 -16.013 2.692 1.00 . A A . 15 LYS HE2 1 1 7 3087 1 1 15 LYS HE3 H -0.807 -15.721 3.949 1.00 . A A . 15 LYS HE3 1 1 7 3088 1 1 15 LYS HG2 H 2.306 -15.161 2.565 1.00 . A A . 15 LYS HG2 1 1 7 3089 1 1 15 LYS HG3 H 2.922 -15.615 4.154 1.00 . A A . 15 LYS HG3 1 1 7 3090 1 1 15 LYS HZ1 H -1.482 -13.775 2.988 1.00 . A A . 15 LYS HZ1 1 1 7 3091 1 1 15 LYS HZ2 H -1.038 -14.634 1.591 1.00 . A A . 15 LYS HZ2 1 1 7 3092 1 1 15 LYS HZ3 H 0.020 -13.461 2.247 1.00 . A A . 15 LYS HZ3 1 1 7 3093 1 1 15 LYS N N 4.339 -11.996 2.085 1.00 . A A . 15 LYS N 1 1 7 3094 1 1 15 LYS NZ N -0.689 -14.207 2.474 1.00 . A A . 15 LYS NZ 1 1 7 3095 1 1 15 LYS O O 0.778 -12.511 2.001 1.00 . A A . 15 LYS O 1 1 7 3096 1 1 16 MET C C 1.205 -8.460 1.741 1.00 . A A . 16 MET C 1 1 7 3097 1 1 16 MET CA C 0.833 -9.780 2.413 1.00 . A A . 16 MET CA 1 1 7 3098 1 1 16 MET CB C 0.338 -9.500 3.839 1.00 . A A . 16 MET CB 1 1 7 3099 1 1 16 MET CE C -2.484 -11.692 5.253 1.00 . A A . 16 MET CE 1 1 7 3100 1 1 16 MET CG C -0.008 -10.816 4.542 1.00 . A A . 16 MET CG 1 1 7 3101 1 1 16 MET H H 2.879 -10.297 2.643 1.00 . A A . 16 MET H 1 1 7 3102 1 1 16 MET HA H 0.043 -10.254 1.854 1.00 . A A . 16 MET HA 1 1 7 3103 1 1 16 MET HB2 H 1.114 -8.992 4.395 1.00 . A A . 16 MET HB2 1 1 7 3104 1 1 16 MET HB3 H -0.542 -8.875 3.798 1.00 . A A . 16 MET HB3 1 1 7 3105 1 1 16 MET HE1 H -3.015 -10.762 5.411 1.00 . A A . 16 MET HE1 1 1 7 3106 1 1 16 MET HE2 H -1.852 -11.902 6.104 1.00 . A A . 16 MET HE2 1 1 7 3107 1 1 16 MET HE3 H -3.195 -12.492 5.132 1.00 . A A . 16 MET HE3 1 1 7 3108 1 1 16 MET HG2 H 0.827 -11.496 4.467 1.00 . A A . 16 MET HG2 1 1 7 3109 1 1 16 MET HG3 H -0.215 -10.620 5.584 1.00 . A A . 16 MET HG3 1 1 7 3110 1 1 16 MET N N 1.991 -10.671 2.459 1.00 . A A . 16 MET N 1 1 7 3111 1 1 16 MET O O 1.770 -7.576 2.383 1.00 . A A . 16 MET O 1 1 7 3112 1 1 16 MET SD S -1.465 -11.557 3.763 1.00 . A A . 16 MET SD 1 1 7 3113 1 1 17 ALA C C 0.051 -6.512 -1.033 1.00 . A A . 17 ALA C 1 1 7 3114 1 1 17 ALA CA C 1.227 -7.080 -0.249 1.00 . A A . 17 ALA CA 1 1 7 3115 1 1 17 ALA CB C 2.406 -7.311 -1.187 1.00 . A A . 17 ALA CB 1 1 7 3116 1 1 17 ALA H H 0.440 -9.045 -0.025 1.00 . A A . 17 ALA H 1 1 7 3117 1 1 17 ALA HA H 1.515 -6.350 0.490 1.00 . A A . 17 ALA HA 1 1 7 3118 1 1 17 ALA HB1 H 2.040 -7.610 -2.157 1.00 . A A . 17 ALA HB1 1 1 7 3119 1 1 17 ALA HB2 H 3.038 -8.087 -0.785 1.00 . A A . 17 ALA HB2 1 1 7 3120 1 1 17 ALA HB3 H 2.972 -6.396 -1.282 1.00 . A A . 17 ALA HB3 1 1 7 3121 1 1 17 ALA N N 0.890 -8.317 0.452 1.00 . A A . 17 ALA N 1 1 7 3122 1 1 17 ALA O O -0.481 -7.133 -1.962 1.00 . A A . 17 ALA O 1 1 7 3123 1 1 18 LYS C C -1.361 -3.107 -0.965 1.00 . A A . 18 LYS C 1 1 7 3124 1 1 18 LYS CA C -1.431 -4.601 -1.277 1.00 . A A . 18 LYS CA 1 1 7 3125 1 1 18 LYS CB C -2.773 -5.190 -0.821 1.00 . A A . 18 LYS CB 1 1 7 3126 1 1 18 LYS CD C -2.047 -5.190 1.602 1.00 . A A . 18 LYS CD 1 1 7 3127 1 1 18 LYS CE C -1.225 -6.069 2.550 1.00 . A A . 18 LYS CE 1 1 7 3128 1 1 18 LYS CG C -2.590 -6.039 0.447 1.00 . A A . 18 LYS CG 1 1 7 3129 1 1 18 LYS H H 0.156 -4.884 0.090 1.00 . A A . 18 LYS H 1 1 7 3130 1 1 18 LYS HA H -1.349 -4.729 -2.343 1.00 . A A . 18 LYS HA 1 1 7 3131 1 1 18 LYS HB2 H -3.465 -4.385 -0.615 1.00 . A A . 18 LYS HB2 1 1 7 3132 1 1 18 LYS HB3 H -3.175 -5.810 -1.608 1.00 . A A . 18 LYS HB3 1 1 7 3133 1 1 18 LYS HD2 H -1.424 -4.402 1.213 1.00 . A A . 18 LYS HD2 1 1 7 3134 1 1 18 LYS HD3 H -2.871 -4.760 2.144 1.00 . A A . 18 LYS HD3 1 1 7 3135 1 1 18 LYS HE2 H -1.586 -7.088 2.502 1.00 . A A . 18 LYS HE2 1 1 7 3136 1 1 18 LYS HE3 H -0.185 -6.042 2.254 1.00 . A A . 18 LYS HE3 1 1 7 3137 1 1 18 LYS HG2 H -3.541 -6.450 0.727 1.00 . A A . 18 LYS HG2 1 1 7 3138 1 1 18 LYS HG3 H -1.904 -6.847 0.241 1.00 . A A . 18 LYS HG3 1 1 7 3139 1 1 18 LYS HZ1 H -1.750 -4.576 3.932 1.00 . A A . 18 LYS HZ1 1 1 7 3140 1 1 18 LYS HZ2 H -0.426 -5.543 4.405 1.00 . A A . 18 LYS HZ2 1 1 7 3141 1 1 18 LYS HZ3 H -2.001 -6.175 4.487 1.00 . A A . 18 LYS HZ3 1 1 7 3142 1 1 18 LYS N N -0.328 -5.311 -0.644 1.00 . A A . 18 LYS N 1 1 7 3143 1 1 18 LYS NZ N -1.359 -5.556 3.947 1.00 . A A . 18 LYS NZ 1 1 7 3144 1 1 18 LYS O O -1.990 -2.623 -0.017 1.00 . A A . 18 LYS O 1 1 7 3145 1 1 19 PRO C C -1.713 -0.163 -1.914 1.00 . A A . 19 PRO C 1 1 7 3146 1 1 19 PRO CA C -0.437 -0.909 -1.559 1.00 . A A . 19 PRO CA 1 1 7 3147 1 1 19 PRO CB C 0.698 -0.555 -2.519 1.00 . A A . 19 PRO CB 1 1 7 3148 1 1 19 PRO CD C 0.176 -2.868 -2.896 1.00 . A A . 19 PRO CD 1 1 7 3149 1 1 19 PRO CG C 0.609 -1.581 -3.591 1.00 . A A . 19 PRO CG 1 1 7 3150 1 1 19 PRO HA H -0.141 -0.688 -0.546 1.00 . A A . 19 PRO HA 1 1 7 3151 1 1 19 PRO HB2 H 0.554 0.438 -2.928 1.00 . A A . 19 PRO HB2 1 1 7 3152 1 1 19 PRO HB3 H 1.648 -0.626 -2.018 1.00 . A A . 19 PRO HB3 1 1 7 3153 1 1 19 PRO HD2 H -0.441 -3.461 -3.556 1.00 . A A . 19 PRO HD2 1 1 7 3154 1 1 19 PRO HD3 H 1.031 -3.430 -2.558 1.00 . A A . 19 PRO HD3 1 1 7 3155 1 1 19 PRO HG2 H -0.129 -1.285 -4.324 1.00 . A A . 19 PRO HG2 1 1 7 3156 1 1 19 PRO HG3 H 1.568 -1.719 -4.060 1.00 . A A . 19 PRO HG3 1 1 7 3157 1 1 19 PRO N N -0.604 -2.378 -1.743 1.00 . A A . 19 PRO N 1 1 7 3158 1 1 19 PRO O O -2.188 -0.229 -3.047 1.00 . A A . 19 PRO O 1 1 7 3159 1 1 20 THR C C -3.244 2.762 -1.010 1.00 . A A . 20 THR C 1 1 7 3160 1 1 20 THR CA C -3.499 1.269 -1.138 1.00 . A A . 20 THR CA 1 1 7 3161 1 1 20 THR CB C -4.538 0.840 -0.101 1.00 . A A . 20 THR CB 1 1 7 3162 1 1 20 THR CG2 C -4.614 -0.682 -0.060 1.00 . A A . 20 THR CG2 1 1 7 3163 1 1 20 THR H H -1.852 0.525 -0.043 1.00 . A A . 20 THR H 1 1 7 3164 1 1 20 THR HA H -3.885 1.059 -2.122 1.00 . A A . 20 THR HA 1 1 7 3165 1 1 20 THR HB H -5.504 1.241 -0.363 1.00 . A A . 20 THR HB 1 1 7 3166 1 1 20 THR HG1 H -3.213 1.060 1.305 1.00 . A A . 20 THR HG1 1 1 7 3167 1 1 20 THR HG21 H -5.368 -0.987 0.649 1.00 . A A . 20 THR HG21 1 1 7 3168 1 1 20 THR HG22 H -3.659 -1.081 0.236 1.00 . A A . 20 THR HG22 1 1 7 3169 1 1 20 THR HG23 H -4.867 -1.057 -1.039 1.00 . A A . 20 THR HG23 1 1 7 3170 1 1 20 THR N N -2.270 0.526 -0.935 1.00 . A A . 20 THR N 1 1 7 3171 1 1 20 THR O O -2.841 3.245 0.050 1.00 . A A . 20 THR O 1 1 7 3172 1 1 20 THR OG1 O -4.143 1.322 1.173 1.00 . A A . 20 THR OG1 1 1 7 3173 1 1 21 CYS C C -4.669 5.605 -2.275 1.00 . A A . 21 CYS C 1 1 7 3174 1 1 21 CYS CA C -3.311 4.932 -2.112 1.00 . A A . 21 CYS CA 1 1 7 3175 1 1 21 CYS CB C -2.375 5.348 -3.249 1.00 . A A . 21 CYS CB 1 1 7 3176 1 1 21 CYS H H -3.818 3.024 -2.906 1.00 . A A . 21 CYS H 1 1 7 3177 1 1 21 CYS HA H -2.879 5.242 -1.174 1.00 . A A . 21 CYS HA 1 1 7 3178 1 1 21 CYS HB2 H -2.340 4.568 -3.991 1.00 . A A . 21 CYS HB2 1 1 7 3179 1 1 21 CYS HB3 H -2.737 6.260 -3.703 1.00 . A A . 21 CYS HB3 1 1 7 3180 1 1 21 CYS N N -3.492 3.482 -2.095 1.00 . A A . 21 CYS N 1 1 7 3181 1 1 21 CYS O O -5.341 5.434 -3.300 1.00 . A A . 21 CYS O 1 1 7 3182 1 1 21 CYS SG S -0.713 5.626 -2.584 1.00 . A A . 21 CYS SG 1 1 7 3183 1 1 22 GLU C C -6.214 8.391 -0.625 1.00 . A A . 22 GLU C 1 1 7 3184 1 1 22 GLU CA C -6.352 7.016 -1.267 1.00 . A A . 22 GLU CA 1 1 7 3185 1 1 22 GLU CB C -7.405 6.170 -0.527 1.00 . A A . 22 GLU CB 1 1 7 3186 1 1 22 GLU CD C -6.739 3.807 0.071 1.00 . A A . 22 GLU CD 1 1 7 3187 1 1 22 GLU CG C -6.744 5.267 0.532 1.00 . A A . 22 GLU CG 1 1 7 3188 1 1 22 GLU H H -4.519 6.435 -0.465 1.00 . A A . 22 GLU H 1 1 7 3189 1 1 22 GLU HA H -6.669 7.143 -2.292 1.00 . A A . 22 GLU HA 1 1 7 3190 1 1 22 GLU HB2 H -8.115 6.824 -0.044 1.00 . A A . 22 GLU HB2 1 1 7 3191 1 1 22 GLU HB3 H -7.921 5.553 -1.243 1.00 . A A . 22 GLU HB3 1 1 7 3192 1 1 22 GLU HG2 H -5.729 5.590 0.701 1.00 . A A . 22 GLU HG2 1 1 7 3193 1 1 22 GLU HG3 H -7.297 5.342 1.456 1.00 . A A . 22 GLU HG3 1 1 7 3194 1 1 22 GLU N N -5.079 6.343 -1.253 1.00 . A A . 22 GLU N 1 1 7 3195 1 1 22 GLU O O -5.703 8.532 0.483 1.00 . A A . 22 GLU O 1 1 7 3196 1 1 22 GLU OE1 O -6.129 3.523 -0.945 1.00 . A A . 22 GLU OE1 1 1 7 3197 1 1 22 GLU OE2 O -7.340 2.984 0.748 1.00 . A A . 22 GLU OE2 1 1 7 3198 1 1 23 ASN C C -5.203 11.123 -0.329 1.00 . A A . 23 ASN C 1 1 7 3199 1 1 23 ASN CA C -6.576 10.796 -0.919 1.00 . A A . 23 ASN CA 1 1 7 3200 1 1 23 ASN CB C -7.684 11.115 0.104 1.00 . A A . 23 ASN CB 1 1 7 3201 1 1 23 ASN CG C -8.090 9.875 0.890 1.00 . A A . 23 ASN CG 1 1 7 3202 1 1 23 ASN H H -7.003 9.188 -2.239 1.00 . A A . 23 ASN H 1 1 7 3203 1 1 23 ASN HA H -6.723 11.429 -1.783 1.00 . A A . 23 ASN HA 1 1 7 3204 1 1 23 ASN HB2 H -7.328 11.867 0.792 1.00 . A A . 23 ASN HB2 1 1 7 3205 1 1 23 ASN HB3 H -8.544 11.499 -0.420 1.00 . A A . 23 ASN HB3 1 1 7 3206 1 1 23 ASN HD21 H -9.300 9.195 -0.522 1.00 . A A . 23 ASN HD21 1 1 7 3207 1 1 23 ASN HD22 H -9.196 8.236 0.873 1.00 . A A . 23 ASN HD22 1 1 7 3208 1 1 23 ASN N N -6.646 9.395 -1.362 1.00 . A A . 23 ASN N 1 1 7 3209 1 1 23 ASN ND2 N -8.931 9.031 0.368 1.00 . A A . 23 ASN ND2 1 1 7 3210 1 1 23 ASN O O -5.095 11.666 0.770 1.00 . A A . 23 ASN O 1 1 7 3211 1 1 23 ASN OD1 O -7.642 9.675 2.015 1.00 . A A . 23 ASN OD1 1 1 7 3212 1 1 24 GLU C C -2.384 10.171 0.520 1.00 . A A . 24 GLU C 1 1 7 3213 1 1 24 GLU CA C -2.781 11.045 -0.667 1.00 . A A . 24 GLU CA 1 1 7 3214 1 1 24 GLU CB C -2.586 12.530 -0.334 1.00 . A A . 24 GLU CB 1 1 7 3215 1 1 24 GLU CD C -3.529 12.909 -2.631 1.00 . A A . 24 GLU CD 1 1 7 3216 1 1 24 GLU CG C -2.448 13.328 -1.637 1.00 . A A . 24 GLU CG 1 1 7 3217 1 1 24 GLU H H -4.321 10.366 -1.953 1.00 . A A . 24 GLU H 1 1 7 3218 1 1 24 GLU HA H -2.132 10.798 -1.493 1.00 . A A . 24 GLU HA 1 1 7 3219 1 1 24 GLU HB2 H -3.438 12.894 0.223 1.00 . A A . 24 GLU HB2 1 1 7 3220 1 1 24 GLU HB3 H -1.691 12.653 0.257 1.00 . A A . 24 GLU HB3 1 1 7 3221 1 1 24 GLU HG2 H -2.549 14.381 -1.426 1.00 . A A . 24 GLU HG2 1 1 7 3222 1 1 24 GLU HG3 H -1.476 13.142 -2.070 1.00 . A A . 24 GLU HG3 1 1 7 3223 1 1 24 GLU N N -4.160 10.787 -1.083 1.00 . A A . 24 GLU N 1 1 7 3224 1 1 24 GLU O O -1.257 10.253 1.011 1.00 . A A . 24 GLU O 1 1 7 3225 1 1 24 GLU OE1 O -4.595 13.500 -2.599 1.00 . A A . 24 GLU OE1 1 1 7 3226 1 1 24 GLU OE2 O -3.277 11.997 -3.403 1.00 . A A . 24 GLU OE2 1 1 7 3227 1 1 25 VAL C C -2.682 7.036 1.545 1.00 . A A . 25 VAL C 1 1 7 3228 1 1 25 VAL CA C -3.016 8.425 2.080 1.00 . A A . 25 VAL CA 1 1 7 3229 1 1 25 VAL CB C -4.218 8.350 3.027 1.00 . A A . 25 VAL CB 1 1 7 3230 1 1 25 VAL CG1 C -3.896 7.410 4.191 1.00 . A A . 25 VAL CG1 1 1 7 3231 1 1 25 VAL CG2 C -4.524 9.746 3.579 1.00 . A A . 25 VAL CG2 1 1 7 3232 1 1 25 VAL H H -4.184 9.285 0.532 1.00 . A A . 25 VAL H 1 1 7 3233 1 1 25 VAL HA H -2.164 8.804 2.626 1.00 . A A . 25 VAL HA 1 1 7 3234 1 1 25 VAL HB H -5.080 7.976 2.490 1.00 . A A . 25 VAL HB 1 1 7 3235 1 1 25 VAL HG11 H -3.128 7.852 4.806 1.00 . A A . 25 VAL HG11 1 1 7 3236 1 1 25 VAL HG12 H -3.549 6.464 3.805 1.00 . A A . 25 VAL HG12 1 1 7 3237 1 1 25 VAL HG13 H -4.785 7.254 4.783 1.00 . A A . 25 VAL HG13 1 1 7 3238 1 1 25 VAL HG21 H -4.410 10.480 2.795 1.00 . A A . 25 VAL HG21 1 1 7 3239 1 1 25 VAL HG22 H -3.840 9.972 4.383 1.00 . A A . 25 VAL HG22 1 1 7 3240 1 1 25 VAL HG23 H -5.538 9.772 3.951 1.00 . A A . 25 VAL HG23 1 1 7 3241 1 1 25 VAL N N -3.302 9.322 0.967 1.00 . A A . 25 VAL N 1 1 7 3242 1 1 25 VAL O O -3.501 6.407 0.866 1.00 . A A . 25 VAL O 1 1 7 3243 1 1 26 CYS C C -1.027 4.232 2.495 1.00 . A A . 26 CYS C 1 1 7 3244 1 1 26 CYS CA C -1.040 5.259 1.362 1.00 . A A . 26 CYS CA 1 1 7 3245 1 1 26 CYS CB C 0.360 5.351 0.752 1.00 . A A . 26 CYS CB 1 1 7 3246 1 1 26 CYS H H -0.855 7.115 2.359 1.00 . A A . 26 CYS H 1 1 7 3247 1 1 26 CYS HA H -1.722 4.925 0.600 1.00 . A A . 26 CYS HA 1 1 7 3248 1 1 26 CYS HB2 H 0.352 4.893 -0.221 1.00 . A A . 26 CYS HB2 1 1 7 3249 1 1 26 CYS HB3 H 0.654 6.375 0.656 1.00 . A A . 26 CYS HB3 1 1 7 3250 1 1 26 CYS N N -1.471 6.568 1.833 1.00 . A A . 26 CYS N 1 1 7 3251 1 1 26 CYS O O -0.446 4.466 3.557 1.00 . A A . 26 CYS O 1 1 7 3252 1 1 26 CYS SG S 1.533 4.487 1.813 1.00 . A A . 26 CYS SG 1 1 7 3253 1 1 27 LYS C C -1.628 0.662 2.542 1.00 . A A . 27 LYS C 1 1 7 3254 1 1 27 LYS CA C -1.718 2.014 3.244 1.00 . A A . 27 LYS CA 1 1 7 3255 1 1 27 LYS CB C -3.029 2.080 4.041 1.00 . A A . 27 LYS CB 1 1 7 3256 1 1 27 LYS CD C -4.463 3.886 3.049 1.00 . A A . 27 LYS CD 1 1 7 3257 1 1 27 LYS CE C -5.791 3.161 3.269 1.00 . A A . 27 LYS CE 1 1 7 3258 1 1 27 LYS CG C -3.491 3.536 4.182 1.00 . A A . 27 LYS CG 1 1 7 3259 1 1 27 LYS H H -2.110 2.970 1.384 1.00 . A A . 27 LYS H 1 1 7 3260 1 1 27 LYS HA H -0.886 2.117 3.925 1.00 . A A . 27 LYS HA 1 1 7 3261 1 1 27 LYS HB2 H -3.790 1.511 3.525 1.00 . A A . 27 LYS HB2 1 1 7 3262 1 1 27 LYS HB3 H -2.873 1.660 5.023 1.00 . A A . 27 LYS HB3 1 1 7 3263 1 1 27 LYS HD2 H -4.635 4.952 3.038 1.00 . A A . 27 LYS HD2 1 1 7 3264 1 1 27 LYS HD3 H -4.042 3.583 2.103 1.00 . A A . 27 LYS HD3 1 1 7 3265 1 1 27 LYS HE2 H -5.826 2.769 4.276 1.00 . A A . 27 LYS HE2 1 1 7 3266 1 1 27 LYS HE3 H -6.607 3.856 3.126 1.00 . A A . 27 LYS HE3 1 1 7 3267 1 1 27 LYS HG2 H -3.984 3.664 5.132 1.00 . A A . 27 LYS HG2 1 1 7 3268 1 1 27 LYS HG3 H -2.636 4.191 4.134 1.00 . A A . 27 LYS HG3 1 1 7 3269 1 1 27 LYS HZ1 H -6.684 2.267 1.599 1.00 . A A . 27 LYS HZ1 1 1 7 3270 1 1 27 LYS HZ2 H -6.137 1.150 2.800 1.00 . A A . 27 LYS HZ2 1 1 7 3271 1 1 27 LYS HZ3 H -4.998 1.918 1.771 1.00 . A A . 27 LYS HZ3 1 1 7 3272 1 1 27 LYS N N -1.665 3.093 2.254 1.00 . A A . 27 LYS N 1 1 7 3273 1 1 27 LYS NZ N -5.912 2.043 2.293 1.00 . A A . 27 LYS NZ 1 1 7 3274 1 1 27 LYS O O -1.991 0.544 1.373 1.00 . A A . 27 LYS O 1 1 7 3275 1 1 28 CYS C C -2.232 -2.565 3.095 1.00 . A A . 28 CYS C 1 1 7 3276 1 1 28 CYS CA C -1.066 -1.688 2.637 1.00 . A A . 28 CYS CA 1 1 7 3277 1 1 28 CYS CB C 0.273 -2.352 2.981 1.00 . A A . 28 CYS CB 1 1 7 3278 1 1 28 CYS H H -0.893 -0.232 4.175 1.00 . A A . 28 CYS H 1 1 7 3279 1 1 28 CYS HA H -1.124 -1.575 1.569 1.00 . A A . 28 CYS HA 1 1 7 3280 1 1 28 CYS HB2 H 1.001 -1.591 3.224 1.00 . A A . 28 CYS HB2 1 1 7 3281 1 1 28 CYS HB3 H 0.149 -3.014 3.824 1.00 . A A . 28 CYS HB3 1 1 7 3282 1 1 28 CYS N N -1.162 -0.364 3.244 1.00 . A A . 28 CYS N 1 1 7 3283 1 1 28 CYS O O -2.095 -3.379 4.015 1.00 . A A . 28 CYS O 1 1 7 3284 1 1 28 CYS SG S 0.841 -3.297 1.542 1.00 . A A . 28 CYS SG 1 1 7 3285 1 1 29 ASN C C -5.103 -3.953 1.573 1.00 . A A . 29 ASN C 1 1 7 3286 1 1 29 ASN CA C -4.580 -3.171 2.782 1.00 . A A . 29 ASN CA 1 1 7 3287 1 1 29 ASN CB C -5.700 -2.250 3.299 1.00 . A A . 29 ASN CB 1 1 7 3288 1 1 29 ASN CG C -5.146 -0.940 3.840 1.00 . A A . 29 ASN CG 1 1 7 3289 1 1 29 ASN H H -3.423 -1.744 1.712 1.00 . A A . 29 ASN H 1 1 7 3290 1 1 29 ASN HA H -4.330 -3.872 3.562 1.00 . A A . 29 ASN HA 1 1 7 3291 1 1 29 ASN HB2 H -6.380 -2.031 2.490 1.00 . A A . 29 ASN HB2 1 1 7 3292 1 1 29 ASN HB3 H -6.240 -2.755 4.086 1.00 . A A . 29 ASN HB3 1 1 7 3293 1 1 29 ASN HD21 H -3.824 -1.807 5.031 1.00 . A A . 29 ASN HD21 1 1 7 3294 1 1 29 ASN HD22 H -3.839 -0.111 5.073 1.00 . A A . 29 ASN HD22 1 1 7 3295 1 1 29 ASN N N -3.382 -2.397 2.442 1.00 . A A . 29 ASN N 1 1 7 3296 1 1 29 ASN ND2 N -4.189 -0.954 4.719 1.00 . A A . 29 ASN ND2 1 1 7 3297 1 1 29 ASN O O -5.274 -3.402 0.486 1.00 . A A . 29 ASN O 1 1 7 3298 1 1 29 ASN OD1 O -5.616 0.129 3.459 1.00 . A A . 29 ASN OD1 1 1 7 3299 1 1 30 ILE C C -7.247 -5.565 0.203 1.00 . A A . 30 ILE C 1 1 7 3300 1 1 30 ILE CA C -5.910 -6.088 0.715 1.00 . A A . 30 ILE CA 1 1 7 3301 1 1 30 ILE CB C -6.054 -7.550 1.180 1.00 . A A . 30 ILE CB 1 1 7 3302 1 1 30 ILE CD1 C -4.478 -7.550 3.126 1.00 . A A . 30 ILE CD1 1 1 7 3303 1 1 30 ILE CG1 C -5.952 -7.636 2.709 1.00 . A A . 30 ILE CG1 1 1 7 3304 1 1 30 ILE CG2 C -4.977 -8.428 0.529 1.00 . A A . 30 ILE CG2 1 1 7 3305 1 1 30 ILE H H -5.242 -5.613 2.673 1.00 . A A . 30 ILE H 1 1 7 3306 1 1 30 ILE HA H -5.213 -6.064 -0.109 1.00 . A A . 30 ILE HA 1 1 7 3307 1 1 30 ILE HB H -7.024 -7.915 0.875 1.00 . A A . 30 ILE HB 1 1 7 3308 1 1 30 ILE HD11 H -4.036 -8.534 3.080 1.00 . A A . 30 ILE HD11 1 1 7 3309 1 1 30 ILE HD12 H -4.408 -7.166 4.129 1.00 . A A . 30 ILE HD12 1 1 7 3310 1 1 30 ILE HD13 H -3.951 -6.894 2.452 1.00 . A A . 30 ILE HD13 1 1 7 3311 1 1 30 ILE HG12 H -6.507 -6.823 3.156 1.00 . A A . 30 ILE HG12 1 1 7 3312 1 1 30 ILE HG13 H -6.363 -8.577 3.044 1.00 . A A . 30 ILE HG13 1 1 7 3313 1 1 30 ILE HG21 H -4.031 -8.275 1.022 1.00 . A A . 30 ILE HG21 1 1 7 3314 1 1 30 ILE HG22 H -4.884 -8.172 -0.516 1.00 . A A . 30 ILE HG22 1 1 7 3315 1 1 30 ILE HG23 H -5.261 -9.466 0.618 1.00 . A A . 30 ILE HG23 1 1 7 3316 1 1 30 ILE N N -5.379 -5.236 1.782 1.00 . A A . 30 ILE N 1 1 7 3317 1 1 30 ILE O O -8.075 -5.067 0.964 1.00 . A A . 30 ILE O 1 1 7 3318 1 1 31 GLY C C -8.380 -4.050 -2.697 1.00 . A A . 31 GLY C 1 1 7 3319 1 1 31 GLY CA C -8.653 -5.232 -1.767 1.00 . A A . 31 GLY CA 1 1 7 3320 1 1 31 GLY H H -6.720 -6.097 -1.637 1.00 . A A . 31 GLY H 1 1 7 3321 1 1 31 GLY HA2 H -9.072 -6.044 -2.342 1.00 . A A . 31 GLY HA2 1 1 7 3322 1 1 31 GLY HA3 H -9.363 -4.927 -1.019 1.00 . A A . 31 GLY HA3 1 1 7 3323 1 1 31 GLY N N -7.430 -5.688 -1.104 1.00 . A A . 31 GLY N 1 1 7 3324 1 1 31 GLY O O -9.149 -3.794 -3.621 1.00 . A A . 31 GLY O 1 1 7 3325 1 1 32 LYS C C -5.401 -2.286 -3.630 1.00 . A A . 32 LYS C 1 1 7 3326 1 1 32 LYS CA C -6.895 -2.213 -3.300 1.00 . A A . 32 LYS CA 1 1 7 3327 1 1 32 LYS CB C -7.231 -0.897 -2.580 1.00 . A A . 32 LYS CB 1 1 7 3328 1 1 32 LYS CD C -7.837 1.498 -3.012 1.00 . A A . 32 LYS CD 1 1 7 3329 1 1 32 LYS CE C -7.439 2.766 -3.778 1.00 . A A . 32 LYS CE 1 1 7 3330 1 1 32 LYS CG C -7.042 0.291 -3.535 1.00 . A A . 32 LYS CG 1 1 7 3331 1 1 32 LYS H H -6.695 -3.615 -1.720 1.00 . A A . 32 LYS H 1 1 7 3332 1 1 32 LYS HA H -7.456 -2.260 -4.221 1.00 . A A . 32 LYS HA 1 1 7 3333 1 1 32 LYS HB2 H -8.258 -0.928 -2.246 1.00 . A A . 32 LYS HB2 1 1 7 3334 1 1 32 LYS HB3 H -6.584 -0.777 -1.728 1.00 . A A . 32 LYS HB3 1 1 7 3335 1 1 32 LYS HD2 H -8.894 1.316 -3.149 1.00 . A A . 32 LYS HD2 1 1 7 3336 1 1 32 LYS HD3 H -7.632 1.635 -1.961 1.00 . A A . 32 LYS HD3 1 1 7 3337 1 1 32 LYS HE2 H -7.314 2.532 -4.826 1.00 . A A . 32 LYS HE2 1 1 7 3338 1 1 32 LYS HE3 H -8.214 3.513 -3.667 1.00 . A A . 32 LYS HE3 1 1 7 3339 1 1 32 LYS HG2 H -5.993 0.543 -3.591 1.00 . A A . 32 LYS HG2 1 1 7 3340 1 1 32 LYS HG3 H -7.403 0.025 -4.518 1.00 . A A . 32 LYS HG3 1 1 7 3341 1 1 32 LYS HZ1 H -5.353 2.697 -3.575 1.00 . A A . 32 LYS HZ1 1 1 7 3342 1 1 32 LYS HZ2 H -6.179 3.268 -2.165 1.00 . A A . 32 LYS HZ2 1 1 7 3343 1 1 32 LYS HZ3 H -6.010 4.290 -3.544 1.00 . A A . 32 LYS HZ3 1 1 7 3344 1 1 32 LYS N N -7.274 -3.353 -2.462 1.00 . A A . 32 LYS N 1 1 7 3345 1 1 32 LYS NZ N -6.157 3.294 -3.229 1.00 . A A . 32 LYS NZ 1 1 7 3346 1 1 32 LYS O O -4.582 -2.600 -2.764 1.00 . A A . 32 LYS O 1 1 7 3347 1 1 33 LYS C C -3.230 -0.821 -6.049 1.00 . A A . 33 LYS C 1 1 7 3348 1 1 33 LYS CA C -3.657 -2.093 -5.315 1.00 . A A . 33 LYS CA 1 1 7 3349 1 1 33 LYS CB C -3.456 -3.306 -6.234 1.00 . A A . 33 LYS CB 1 1 7 3350 1 1 33 LYS CD C -3.080 -5.105 -4.525 1.00 . A A . 33 LYS CD 1 1 7 3351 1 1 33 LYS CE C -2.460 -6.507 -4.492 1.00 . A A . 33 LYS CE 1 1 7 3352 1 1 33 LYS CG C -2.420 -4.260 -5.626 1.00 . A A . 33 LYS CG 1 1 7 3353 1 1 33 LYS H H -5.748 -1.800 -5.543 1.00 . A A . 33 LYS H 1 1 7 3354 1 1 33 LYS HA H -3.032 -2.212 -4.444 1.00 . A A . 33 LYS HA 1 1 7 3355 1 1 33 LYS HB2 H -4.397 -3.825 -6.354 1.00 . A A . 33 LYS HB2 1 1 7 3356 1 1 33 LYS HB3 H -3.108 -2.973 -7.201 1.00 . A A . 33 LYS HB3 1 1 7 3357 1 1 33 LYS HD2 H -2.937 -4.623 -3.569 1.00 . A A . 33 LYS HD2 1 1 7 3358 1 1 33 LYS HD3 H -4.138 -5.188 -4.726 1.00 . A A . 33 LYS HD3 1 1 7 3359 1 1 33 LYS HE2 H -2.986 -7.117 -3.770 1.00 . A A . 33 LYS HE2 1 1 7 3360 1 1 33 LYS HE3 H -2.545 -6.960 -5.472 1.00 . A A . 33 LYS HE3 1 1 7 3361 1 1 33 LYS HG2 H -2.035 -4.909 -6.400 1.00 . A A . 33 LYS HG2 1 1 7 3362 1 1 33 LYS HG3 H -1.609 -3.686 -5.203 1.00 . A A . 33 LYS HG3 1 1 7 3363 1 1 33 LYS HZ1 H -0.445 -6.975 -4.768 1.00 . A A . 33 LYS HZ1 1 1 7 3364 1 1 33 LYS HZ2 H -0.879 -6.780 -3.129 1.00 . A A . 33 LYS HZ2 1 1 7 3365 1 1 33 LYS HZ3 H -0.716 -5.419 -4.154 1.00 . A A . 33 LYS HZ3 1 1 7 3366 1 1 33 LYS N N -5.055 -2.025 -4.889 1.00 . A A . 33 LYS N 1 1 7 3367 1 1 33 LYS NZ N -1.018 -6.411 -4.109 1.00 . A A . 33 LYS NZ 1 1 7 3368 1 1 33 LYS O O -3.619 -0.594 -7.197 1.00 . A A . 33 LYS O 1 1 7 3369 1 1 34 ASP C C -0.411 1.132 -6.214 1.00 . A A . 34 ASP C 1 1 7 3370 1 1 34 ASP CA C -1.918 1.230 -5.958 1.00 . A A . 34 ASP CA 1 1 7 3371 1 1 34 ASP CB C -2.196 2.388 -5.003 1.00 . A A . 34 ASP CB 1 1 7 3372 1 1 34 ASP CG C -3.687 2.682 -4.951 1.00 . A A . 34 ASP CG 1 1 7 3373 1 1 34 ASP H H -2.144 -0.256 -4.464 1.00 . A A . 34 ASP H 1 1 7 3374 1 1 34 ASP HA H -2.424 1.417 -6.893 1.00 . A A . 34 ASP HA 1 1 7 3375 1 1 34 ASP HB2 H -1.846 2.126 -4.015 1.00 . A A . 34 ASP HB2 1 1 7 3376 1 1 34 ASP HB3 H -1.670 3.264 -5.349 1.00 . A A . 34 ASP HB3 1 1 7 3377 1 1 34 ASP N N -2.420 -0.012 -5.378 1.00 . A A . 34 ASP N 1 1 7 3378 1 1 34 ASP O O 0.122 0.039 -6.106 1.00 . A A . 34 ASP O 1 1 7 3379 1 1 34 ASP OXT O 0.189 2.154 -6.511 1.00 . A A . 34 ASP OXT 1 1 7 3380 1 1 34 ASP OD1 O -4.161 3.421 -5.794 1.00 . A A . 34 ASP OD1 1 1 7 3381 1 1 34 ASP OD2 O -4.334 2.178 -4.047 1.00 . A A . 34 ASP OD2 1 1 8 3382 1 1 1 GLY C C 0.360 8.139 -6.092 1.00 . A A . 1 GLY C 1 1 8 3383 1 1 1 GLY CA C -1.000 7.450 -6.126 1.00 . A A . 1 GLY CA 1 1 8 3384 1 1 1 GLY H1 H -1.551 6.186 -7.692 1.00 . A A . 1 GLY H1 1 1 8 3385 1 1 1 GLY H2 H -1.131 5.361 -6.256 1.00 . A A . 1 GLY H2 1 1 8 3386 1 1 1 GLY H3 H 0.081 6.058 -7.241 1.00 . A A . 1 GLY H3 1 1 8 3387 1 1 1 GLY HA2 H -1.719 8.097 -6.608 1.00 . A A . 1 GLY HA2 1 1 8 3388 1 1 1 GLY HA3 H -1.322 7.244 -5.118 1.00 . A A . 1 GLY HA3 1 1 8 3389 1 1 1 GLY N N -0.891 6.171 -6.890 1.00 . A A . 1 GLY N 1 1 8 3390 1 1 1 GLY O O 1.178 7.944 -6.988 1.00 . A A . 1 GLY O 1 1 8 3391 1 1 2 SER C C 2.981 8.726 -4.463 1.00 . A A . 2 SER C 1 1 8 3392 1 1 2 SER CA C 1.859 9.663 -4.913 1.00 . A A . 2 SER CA 1 1 8 3393 1 1 2 SER CB C 1.690 10.795 -3.897 1.00 . A A . 2 SER CB 1 1 8 3394 1 1 2 SER H H -0.103 9.059 -4.374 1.00 . A A . 2 SER H 1 1 8 3395 1 1 2 SER HA H 2.125 10.092 -5.867 1.00 . A A . 2 SER HA 1 1 8 3396 1 1 2 SER HB2 H 1.382 10.389 -2.947 1.00 . A A . 2 SER HB2 1 1 8 3397 1 1 2 SER HB3 H 2.631 11.316 -3.776 1.00 . A A . 2 SER HB3 1 1 8 3398 1 1 2 SER HG H 0.045 11.843 -3.638 1.00 . A A . 2 SER HG 1 1 8 3399 1 1 2 SER N N 0.591 8.943 -5.056 1.00 . A A . 2 SER N 1 1 8 3400 1 1 2 SER O O 2.744 7.557 -4.154 1.00 . A A . 2 SER O 1 1 8 3401 1 1 2 SER OG O 0.694 11.693 -4.368 1.00 . A A . 2 SER OG 1 1 8 3402 1 1 3 VAL C C 5.019 7.453 -2.935 1.00 . A A . 3 VAL C 1 1 8 3403 1 1 3 VAL CA C 5.375 8.475 -4.015 1.00 . A A . 3 VAL CA 1 1 8 3404 1 1 3 VAL CB C 6.475 9.414 -3.501 1.00 . A A . 3 VAL CB 1 1 8 3405 1 1 3 VAL CG1 C 7.183 10.071 -4.686 1.00 . A A . 3 VAL CG1 1 1 8 3406 1 1 3 VAL CG2 C 5.869 10.507 -2.609 1.00 . A A . 3 VAL CG2 1 1 8 3407 1 1 3 VAL H H 4.330 10.189 -4.680 1.00 . A A . 3 VAL H 1 1 8 3408 1 1 3 VAL HA H 5.754 7.943 -4.875 1.00 . A A . 3 VAL HA 1 1 8 3409 1 1 3 VAL HB H 7.188 8.841 -2.931 1.00 . A A . 3 VAL HB 1 1 8 3410 1 1 3 VAL HG11 H 7.683 9.313 -5.272 1.00 . A A . 3 VAL HG11 1 1 8 3411 1 1 3 VAL HG12 H 7.912 10.780 -4.320 1.00 . A A . 3 VAL HG12 1 1 8 3412 1 1 3 VAL HG13 H 6.460 10.585 -5.301 1.00 . A A . 3 VAL HG13 1 1 8 3413 1 1 3 VAL HG21 H 5.597 10.083 -1.654 1.00 . A A . 3 VAL HG21 1 1 8 3414 1 1 3 VAL HG22 H 4.994 10.921 -3.083 1.00 . A A . 3 VAL HG22 1 1 8 3415 1 1 3 VAL HG23 H 6.599 11.289 -2.459 1.00 . A A . 3 VAL HG23 1 1 8 3416 1 1 3 VAL N N 4.206 9.254 -4.426 1.00 . A A . 3 VAL N 1 1 8 3417 1 1 3 VAL O O 5.249 6.257 -3.107 1.00 . A A . 3 VAL O 1 1 8 3418 1 1 4 GLY C C 3.549 5.702 -1.247 1.00 . A A . 4 GLY C 1 1 8 3419 1 1 4 GLY CA C 4.057 7.041 -0.728 1.00 . A A . 4 GLY CA 1 1 8 3420 1 1 4 GLY H H 4.280 8.887 -1.753 1.00 . A A . 4 GLY H 1 1 8 3421 1 1 4 GLY HA2 H 4.911 6.869 -0.090 1.00 . A A . 4 GLY HA2 1 1 8 3422 1 1 4 GLY HA3 H 3.276 7.511 -0.153 1.00 . A A . 4 GLY HA3 1 1 8 3423 1 1 4 GLY N N 4.446 7.927 -1.829 1.00 . A A . 4 GLY N 1 1 8 3424 1 1 4 GLY O O 3.861 4.654 -0.689 1.00 . A A . 4 GLY O 1 1 8 3425 1 1 5 CYS C C 3.309 3.570 -3.344 1.00 . A A . 5 CYS C 1 1 8 3426 1 1 5 CYS CA C 2.213 4.536 -2.913 1.00 . A A . 5 CYS CA 1 1 8 3427 1 1 5 CYS CB C 1.354 4.904 -4.111 1.00 . A A . 5 CYS CB 1 1 8 3428 1 1 5 CYS H H 2.558 6.615 -2.725 1.00 . A A . 5 CYS H 1 1 8 3429 1 1 5 CYS HA H 1.596 4.047 -2.177 1.00 . A A . 5 CYS HA 1 1 8 3430 1 1 5 CYS HB2 H 1.986 5.053 -4.976 1.00 . A A . 5 CYS HB2 1 1 8 3431 1 1 5 CYS HB3 H 0.663 4.113 -4.305 1.00 . A A . 5 CYS HB3 1 1 8 3432 1 1 5 CYS N N 2.768 5.747 -2.319 1.00 . A A . 5 CYS N 1 1 8 3433 1 1 5 CYS O O 3.063 2.379 -3.506 1.00 . A A . 5 CYS O 1 1 8 3434 1 1 5 CYS SG S 0.456 6.437 -3.747 1.00 . A A . 5 CYS SG 1 1 8 3435 1 1 6 ALA C C 6.353 2.790 -2.612 1.00 . A A . 6 ALA C 1 1 8 3436 1 1 6 ALA CA C 5.663 3.277 -3.883 1.00 . A A . 6 ALA CA 1 1 8 3437 1 1 6 ALA CB C 6.642 4.097 -4.730 1.00 . A A . 6 ALA CB 1 1 8 3438 1 1 6 ALA H H 4.634 5.059 -3.350 1.00 . A A . 6 ALA H 1 1 8 3439 1 1 6 ALA HA H 5.327 2.423 -4.451 1.00 . A A . 6 ALA HA 1 1 8 3440 1 1 6 ALA HB1 H 6.874 5.021 -4.220 1.00 . A A . 6 ALA HB1 1 1 8 3441 1 1 6 ALA HB2 H 6.194 4.317 -5.687 1.00 . A A . 6 ALA HB2 1 1 8 3442 1 1 6 ALA HB3 H 7.551 3.533 -4.880 1.00 . A A . 6 ALA HB3 1 1 8 3443 1 1 6 ALA N N 4.511 4.094 -3.507 1.00 . A A . 6 ALA N 1 1 8 3444 1 1 6 ALA O O 6.714 1.618 -2.479 1.00 . A A . 6 ALA O 1 1 8 3445 1 1 7 GLU C C 6.166 2.459 0.409 1.00 . A A . 7 GLU C 1 1 8 3446 1 1 7 GLU CA C 7.102 3.374 -0.379 1.00 . A A . 7 GLU CA 1 1 8 3447 1 1 7 GLU CB C 7.370 4.657 0.418 1.00 . A A . 7 GLU CB 1 1 8 3448 1 1 7 GLU CD C 7.752 6.532 -1.216 1.00 . A A . 7 GLU CD 1 1 8 3449 1 1 7 GLU CG C 8.425 5.509 -0.305 1.00 . A A . 7 GLU CG 1 1 8 3450 1 1 7 GLU H H 6.158 4.613 -1.820 1.00 . A A . 7 GLU H 1 1 8 3451 1 1 7 GLU HA H 8.037 2.862 -0.550 1.00 . A A . 7 GLU HA 1 1 8 3452 1 1 7 GLU HB2 H 6.453 5.221 0.511 1.00 . A A . 7 GLU HB2 1 1 8 3453 1 1 7 GLU HB3 H 7.734 4.400 1.402 1.00 . A A . 7 GLU HB3 1 1 8 3454 1 1 7 GLU HG2 H 9.026 6.028 0.425 1.00 . A A . 7 GLU HG2 1 1 8 3455 1 1 7 GLU HG3 H 9.059 4.868 -0.900 1.00 . A A . 7 GLU HG3 1 1 8 3456 1 1 7 GLU N N 6.493 3.703 -1.661 1.00 . A A . 7 GLU N 1 1 8 3457 1 1 7 GLU O O 6.606 1.548 1.111 1.00 . A A . 7 GLU O 1 1 8 3458 1 1 7 GLU OE1 O 7.089 7.415 -0.698 1.00 . A A . 7 GLU OE1 1 1 8 3459 1 1 7 GLU OE2 O 7.914 6.420 -2.419 1.00 . A A . 7 GLU OE2 1 1 8 3460 1 1 8 CYS C C 4.067 0.428 0.745 1.00 . A A . 8 CYS C 1 1 8 3461 1 1 8 CYS CA C 3.847 1.928 0.959 1.00 . A A . 8 CYS CA 1 1 8 3462 1 1 8 CYS CB C 2.452 2.341 0.481 1.00 . A A . 8 CYS CB 1 1 8 3463 1 1 8 CYS H H 4.585 3.462 -0.303 1.00 . A A . 8 CYS H 1 1 8 3464 1 1 8 CYS HA H 3.915 2.137 2.009 1.00 . A A . 8 CYS HA 1 1 8 3465 1 1 8 CYS HB2 H 2.540 3.060 -0.317 1.00 . A A . 8 CYS HB2 1 1 8 3466 1 1 8 CYS HB3 H 1.911 1.482 0.130 1.00 . A A . 8 CYS HB3 1 1 8 3467 1 1 8 CYS N N 4.867 2.716 0.273 1.00 . A A . 8 CYS N 1 1 8 3468 1 1 8 CYS O O 4.254 -0.317 1.708 1.00 . A A . 8 CYS O 1 1 8 3469 1 1 8 CYS SG S 1.567 3.086 1.867 1.00 . A A . 8 CYS SG 1 1 8 3470 1 1 9 PRO C C 5.662 -1.907 -0.289 1.00 . A A . 9 PRO C 1 1 8 3471 1 1 9 PRO CA C 4.296 -1.469 -0.793 1.00 . A A . 9 PRO CA 1 1 8 3472 1 1 9 PRO CB C 4.205 -1.562 -2.320 1.00 . A A . 9 PRO CB 1 1 8 3473 1 1 9 PRO CD C 3.864 0.761 -1.702 1.00 . A A . 9 PRO CD 1 1 8 3474 1 1 9 PRO CG C 4.330 -0.164 -2.826 1.00 . A A . 9 PRO CG 1 1 8 3475 1 1 9 PRO HA H 3.523 -2.072 -0.344 1.00 . A A . 9 PRO HA 1 1 8 3476 1 1 9 PRO HB2 H 5.009 -2.174 -2.706 1.00 . A A . 9 PRO HB2 1 1 8 3477 1 1 9 PRO HB3 H 3.251 -1.975 -2.611 1.00 . A A . 9 PRO HB3 1 1 8 3478 1 1 9 PRO HD2 H 4.465 1.658 -1.681 1.00 . A A . 9 PRO HD2 1 1 8 3479 1 1 9 PRO HD3 H 2.821 1.005 -1.817 1.00 . A A . 9 PRO HD3 1 1 8 3480 1 1 9 PRO HG2 H 5.360 0.042 -3.077 1.00 . A A . 9 PRO HG2 1 1 8 3481 1 1 9 PRO HG3 H 3.704 -0.025 -3.693 1.00 . A A . 9 PRO HG3 1 1 8 3482 1 1 9 PRO N N 4.070 -0.029 -0.486 1.00 . A A . 9 PRO N 1 1 8 3483 1 1 9 PRO O O 5.807 -2.981 0.297 1.00 . A A . 9 PRO O 1 1 8 3484 1 1 10 MET C C 7.953 -1.634 1.492 1.00 . A A . 10 MET C 1 1 8 3485 1 1 10 MET CA C 8.005 -1.350 -0.009 1.00 . A A . 10 MET CA 1 1 8 3486 1 1 10 MET CB C 8.940 -0.169 -0.286 1.00 . A A . 10 MET CB 1 1 8 3487 1 1 10 MET CE C 9.460 -0.804 -4.322 1.00 . A A . 10 MET CE 1 1 8 3488 1 1 10 MET CG C 9.629 -0.360 -1.641 1.00 . A A . 10 MET CG 1 1 8 3489 1 1 10 MET H H 6.485 -0.192 -0.939 1.00 . A A . 10 MET H 1 1 8 3490 1 1 10 MET HA H 8.375 -2.226 -0.520 1.00 . A A . 10 MET HA 1 1 8 3491 1 1 10 MET HB2 H 8.367 0.747 -0.298 1.00 . A A . 10 MET HB2 1 1 8 3492 1 1 10 MET HB3 H 9.690 -0.114 0.490 1.00 . A A . 10 MET HB3 1 1 8 3493 1 1 10 MET HE1 H 9.477 -1.736 -4.872 1.00 . A A . 10 MET HE1 1 1 8 3494 1 1 10 MET HE2 H 10.467 -0.534 -4.029 1.00 . A A . 10 MET HE2 1 1 8 3495 1 1 10 MET HE3 H 9.051 -0.029 -4.948 1.00 . A A . 10 MET HE3 1 1 8 3496 1 1 10 MET HG2 H 10.014 0.587 -1.986 1.00 . A A . 10 MET HG2 1 1 8 3497 1 1 10 MET HG3 H 10.443 -1.063 -1.535 1.00 . A A . 10 MET HG3 1 1 8 3498 1 1 10 MET N N 6.660 -1.049 -0.486 1.00 . A A . 10 MET N 1 1 8 3499 1 1 10 MET O O 8.761 -2.395 2.023 1.00 . A A . 10 MET O 1 1 8 3500 1 1 10 MET SD S 8.433 -0.997 -2.844 1.00 . A A . 10 MET SD 1 1 8 3501 1 1 11 HIS C C 5.746 -2.293 3.871 1.00 . A A . 11 HIS C 1 1 8 3502 1 1 11 HIS CA C 6.800 -1.215 3.597 1.00 . A A . 11 HIS CA 1 1 8 3503 1 1 11 HIS CB C 6.383 0.102 4.259 1.00 . A A . 11 HIS CB 1 1 8 3504 1 1 11 HIS CD2 C 7.546 1.211 6.340 1.00 . A A . 11 HIS CD2 1 1 8 3505 1 1 11 HIS CE1 C 7.579 -0.520 7.646 1.00 . A A . 11 HIS CE1 1 1 8 3506 1 1 11 HIS CG C 6.968 0.178 5.644 1.00 . A A . 11 HIS CG 1 1 8 3507 1 1 11 HIS H H 6.357 -0.433 1.677 1.00 . A A . 11 HIS H 1 1 8 3508 1 1 11 HIS HA H 7.740 -1.535 4.023 1.00 . A A . 11 HIS HA 1 1 8 3509 1 1 11 HIS HB2 H 6.746 0.932 3.668 1.00 . A A . 11 HIS HB2 1 1 8 3510 1 1 11 HIS HB3 H 5.306 0.151 4.321 1.00 . A A . 11 HIS HB3 1 1 8 3511 1 1 11 HIS HD2 H 7.681 2.214 5.963 1.00 . A A . 11 HIS HD2 1 1 8 3512 1 1 11 HIS HE1 H 7.740 -1.163 8.499 1.00 . A A . 11 HIS HE1 1 1 8 3513 1 1 11 HIS HE2 H 8.370 1.292 8.307 1.00 . A A . 11 HIS HE2 1 1 8 3514 1 1 11 HIS N N 6.977 -1.022 2.161 1.00 . A A . 11 HIS N 1 1 8 3515 1 1 11 HIS ND1 N 6.999 -0.917 6.498 1.00 . A A . 11 HIS ND1 1 1 8 3516 1 1 11 HIS NE2 N 7.932 0.769 7.601 1.00 . A A . 11 HIS NE2 1 1 8 3517 1 1 11 HIS O O 5.125 -2.317 4.940 1.00 . A A . 11 HIS O 1 1 8 3518 1 1 12 CYS C C 5.317 -5.532 3.561 1.00 . A A . 12 CYS C 1 1 8 3519 1 1 12 CYS CA C 4.594 -4.286 3.076 1.00 . A A . 12 CYS CA 1 1 8 3520 1 1 12 CYS CB C 3.866 -4.582 1.764 1.00 . A A . 12 CYS CB 1 1 8 3521 1 1 12 CYS H H 6.094 -3.146 2.088 1.00 . A A . 12 CYS H 1 1 8 3522 1 1 12 CYS HA H 3.866 -3.997 3.820 1.00 . A A . 12 CYS HA 1 1 8 3523 1 1 12 CYS HB2 H 4.026 -3.773 1.074 1.00 . A A . 12 CYS HB2 1 1 8 3524 1 1 12 CYS HB3 H 4.242 -5.501 1.341 1.00 . A A . 12 CYS HB3 1 1 8 3525 1 1 12 CYS N N 5.561 -3.201 2.914 1.00 . A A . 12 CYS N 1 1 8 3526 1 1 12 CYS O O 6.467 -5.776 3.197 1.00 . A A . 12 CYS O 1 1 8 3527 1 1 12 CYS SG S 2.092 -4.751 2.087 1.00 . A A . 12 CYS SG 1 1 8 3528 1 1 13 LYS C C 4.879 -8.748 4.277 1.00 . A A . 13 LYS C 1 1 8 3529 1 1 13 LYS CA C 5.282 -7.465 5.014 1.00 . A A . 13 LYS CA 1 1 8 3530 1 1 13 LYS CB C 4.896 -7.555 6.502 1.00 . A A . 13 LYS CB 1 1 8 3531 1 1 13 LYS CD C 6.241 -5.628 7.452 1.00 . A A . 13 LYS CD 1 1 8 3532 1 1 13 LYS CE C 6.629 -4.482 6.503 1.00 . A A . 13 LYS CE 1 1 8 3533 1 1 13 LYS CG C 4.827 -6.143 7.124 1.00 . A A . 13 LYS CG 1 1 8 3534 1 1 13 LYS H H 3.764 -6.016 4.710 1.00 . A A . 13 LYS H 1 1 8 3535 1 1 13 LYS HA H 6.354 -7.358 4.949 1.00 . A A . 13 LYS HA 1 1 8 3536 1 1 13 LYS HB2 H 3.930 -8.033 6.590 1.00 . A A . 13 LYS HB2 1 1 8 3537 1 1 13 LYS HB3 H 5.633 -8.142 7.029 1.00 . A A . 13 LYS HB3 1 1 8 3538 1 1 13 LYS HD2 H 6.263 -5.271 8.471 1.00 . A A . 13 LYS HD2 1 1 8 3539 1 1 13 LYS HD3 H 6.950 -6.435 7.343 1.00 . A A . 13 LYS HD3 1 1 8 3540 1 1 13 LYS HE2 H 7.696 -4.316 6.561 1.00 . A A . 13 LYS HE2 1 1 8 3541 1 1 13 LYS HE3 H 6.366 -4.749 5.492 1.00 . A A . 13 LYS HE3 1 1 8 3542 1 1 13 LYS HG2 H 4.347 -5.466 6.434 1.00 . A A . 13 LYS HG2 1 1 8 3543 1 1 13 LYS HG3 H 4.247 -6.187 8.036 1.00 . A A . 13 LYS HG3 1 1 8 3544 1 1 13 LYS HZ1 H 5.130 -3.462 7.539 1.00 . A A . 13 LYS HZ1 1 1 8 3545 1 1 13 LYS HZ2 H 5.518 -2.761 6.032 1.00 . A A . 13 LYS HZ2 1 1 8 3546 1 1 13 LYS HZ3 H 6.571 -2.577 7.366 1.00 . A A . 13 LYS HZ3 1 1 8 3547 1 1 13 LYS N N 4.663 -6.282 4.429 1.00 . A A . 13 LYS N 1 1 8 3548 1 1 13 LYS NZ N 5.908 -3.231 6.895 1.00 . A A . 13 LYS NZ 1 1 8 3549 1 1 13 LYS O O 3.732 -8.916 3.855 1.00 . A A . 13 LYS O 1 1 8 3550 1 1 14 GLY C C 4.325 -11.563 3.763 1.00 . A A . 14 GLY C 1 1 8 3551 1 1 14 GLY CA C 5.668 -10.917 3.427 1.00 . A A . 14 GLY CA 1 1 8 3552 1 1 14 GLY H H 6.749 -9.424 4.473 1.00 . A A . 14 GLY H 1 1 8 3553 1 1 14 GLY HA2 H 5.717 -10.747 2.361 1.00 . A A . 14 GLY HA2 1 1 8 3554 1 1 14 GLY HA3 H 6.461 -11.593 3.709 1.00 . A A . 14 GLY HA3 1 1 8 3555 1 1 14 GLY N N 5.861 -9.638 4.120 1.00 . A A . 14 GLY N 1 1 8 3556 1 1 14 GLY O O 3.866 -11.511 4.904 1.00 . A A . 14 GLY O 1 1 8 3557 1 1 15 LYS C C 1.264 -11.896 2.590 1.00 . A A . 15 LYS C 1 1 8 3558 1 1 15 LYS CA C 2.416 -12.854 2.886 1.00 . A A . 15 LYS CA 1 1 8 3559 1 1 15 LYS CB C 2.259 -13.444 4.296 1.00 . A A . 15 LYS CB 1 1 8 3560 1 1 15 LYS CD C -0.041 -14.310 4.816 1.00 . A A . 15 LYS CD 1 1 8 3561 1 1 15 LYS CE C -0.672 -15.546 5.468 1.00 . A A . 15 LYS CE 1 1 8 3562 1 1 15 LYS CG C 1.342 -14.670 4.253 1.00 . A A . 15 LYS CG 1 1 8 3563 1 1 15 LYS H H 4.149 -12.173 1.868 1.00 . A A . 15 LYS H 1 1 8 3564 1 1 15 LYS HA H 2.376 -13.661 2.170 1.00 . A A . 15 LYS HA 1 1 8 3565 1 1 15 LYS HB2 H 3.231 -13.737 4.670 1.00 . A A . 15 LYS HB2 1 1 8 3566 1 1 15 LYS HB3 H 1.835 -12.702 4.951 1.00 . A A . 15 LYS HB3 1 1 8 3567 1 1 15 LYS HD2 H 0.062 -13.526 5.553 1.00 . A A . 15 LYS HD2 1 1 8 3568 1 1 15 LYS HD3 H -0.678 -13.966 4.012 1.00 . A A . 15 LYS HD3 1 1 8 3569 1 1 15 LYS HE2 H -1.742 -15.407 5.547 1.00 . A A . 15 LYS HE2 1 1 8 3570 1 1 15 LYS HE3 H -0.468 -16.419 4.861 1.00 . A A . 15 LYS HE3 1 1 8 3571 1 1 15 LYS HG2 H 1.239 -15.011 3.231 1.00 . A A . 15 LYS HG2 1 1 8 3572 1 1 15 LYS HG3 H 1.775 -15.455 4.849 1.00 . A A . 15 LYS HG3 1 1 8 3573 1 1 15 LYS HZ1 H -0.745 -15.368 7.549 1.00 . A A . 15 LYS HZ1 1 1 8 3574 1 1 15 LYS HZ2 H 0.814 -15.222 6.895 1.00 . A A . 15 LYS HZ2 1 1 8 3575 1 1 15 LYS HZ3 H 0.078 -16.751 7.002 1.00 . A A . 15 LYS HZ3 1 1 8 3576 1 1 15 LYS N N 3.713 -12.175 2.745 1.00 . A A . 15 LYS N 1 1 8 3577 1 1 15 LYS NZ N -0.088 -15.737 6.830 1.00 . A A . 15 LYS NZ 1 1 8 3578 1 1 15 LYS O O 0.159 -12.327 2.260 1.00 . A A . 15 LYS O 1 1 8 3579 1 1 16 MET C C 1.136 -8.400 1.693 1.00 . A A . 16 MET C 1 1 8 3580 1 1 16 MET CA C 0.513 -9.587 2.423 1.00 . A A . 16 MET CA 1 1 8 3581 1 1 16 MET CB C -0.121 -9.113 3.735 1.00 . A A . 16 MET CB 1 1 8 3582 1 1 16 MET CE C -2.417 -11.195 6.422 1.00 . A A . 16 MET CE 1 1 8 3583 1 1 16 MET CG C -0.781 -10.295 4.444 1.00 . A A . 16 MET CG 1 1 8 3584 1 1 16 MET H H 2.432 -10.311 2.956 1.00 . A A . 16 MET H 1 1 8 3585 1 1 16 MET HA H -0.253 -10.019 1.798 1.00 . A A . 16 MET HA 1 1 8 3586 1 1 16 MET HB2 H 0.642 -8.690 4.372 1.00 . A A . 16 MET HB2 1 1 8 3587 1 1 16 MET HB3 H -0.869 -8.364 3.522 1.00 . A A . 16 MET HB3 1 1 8 3588 1 1 16 MET HE1 H -1.824 -11.164 7.328 1.00 . A A . 16 MET HE1 1 1 8 3589 1 1 16 MET HE2 H -2.132 -12.052 5.828 1.00 . A A . 16 MET HE2 1 1 8 3590 1 1 16 MET HE3 H -3.461 -11.271 6.679 1.00 . A A . 16 MET HE3 1 1 8 3591 1 1 16 MET HG2 H -1.163 -10.990 3.708 1.00 . A A . 16 MET HG2 1 1 8 3592 1 1 16 MET HG3 H -0.054 -10.796 5.068 1.00 . A A . 16 MET HG3 1 1 8 3593 1 1 16 MET N N 1.531 -10.597 2.696 1.00 . A A . 16 MET N 1 1 8 3594 1 1 16 MET O O 1.778 -7.553 2.315 1.00 . A A . 16 MET O 1 1 8 3595 1 1 16 MET SD S -2.141 -9.683 5.470 1.00 . A A . 16 MET SD 1 1 8 3596 1 1 17 ALA C C 0.622 -6.705 -1.477 1.00 . A A . 17 ALA C 1 1 8 3597 1 1 17 ALA CA C 1.543 -7.235 -0.382 1.00 . A A . 17 ALA CA 1 1 8 3598 1 1 17 ALA CB C 2.866 -7.659 -1.000 1.00 . A A . 17 ALA CB 1 1 8 3599 1 1 17 ALA H H 0.456 -9.036 -0.087 1.00 . A A . 17 ALA H 1 1 8 3600 1 1 17 ALA HA H 1.740 -6.428 0.308 1.00 . A A . 17 ALA HA 1 1 8 3601 1 1 17 ALA HB1 H 2.699 -8.491 -1.664 1.00 . A A . 17 ALA HB1 1 1 8 3602 1 1 17 ALA HB2 H 3.549 -7.946 -0.217 1.00 . A A . 17 ALA HB2 1 1 8 3603 1 1 17 ALA HB3 H 3.280 -6.829 -1.556 1.00 . A A . 17 ALA HB3 1 1 8 3604 1 1 17 ALA N N 0.963 -8.338 0.373 1.00 . A A . 17 ALA N 1 1 8 3605 1 1 17 ALA O O 0.466 -7.302 -2.548 1.00 . A A . 17 ALA O 1 1 8 3606 1 1 18 LYS C C -0.959 -3.387 -1.643 1.00 . A A . 18 LYS C 1 1 8 3607 1 1 18 LYS CA C -0.824 -4.835 -2.110 1.00 . A A . 18 LYS CA 1 1 8 3608 1 1 18 LYS CB C -2.208 -5.486 -2.248 1.00 . A A . 18 LYS CB 1 1 8 3609 1 1 18 LYS CD C -3.191 -7.694 -1.662 1.00 . A A . 18 LYS CD 1 1 8 3610 1 1 18 LYS CE C -2.149 -8.784 -1.922 1.00 . A A . 18 LYS CE 1 1 8 3611 1 1 18 LYS CG C -2.503 -6.447 -1.093 1.00 . A A . 18 LYS CG 1 1 8 3612 1 1 18 LYS H H 0.270 -5.148 -0.327 1.00 . A A . 18 LYS H 1 1 8 3613 1 1 18 LYS HA H -0.353 -4.831 -3.083 1.00 . A A . 18 LYS HA 1 1 8 3614 1 1 18 LYS HB2 H -2.961 -4.712 -2.259 1.00 . A A . 18 LYS HB2 1 1 8 3615 1 1 18 LYS HB3 H -2.248 -6.027 -3.180 1.00 . A A . 18 LYS HB3 1 1 8 3616 1 1 18 LYS HD2 H -3.921 -8.056 -0.959 1.00 . A A . 18 LYS HD2 1 1 8 3617 1 1 18 LYS HD3 H -3.683 -7.443 -2.590 1.00 . A A . 18 LYS HD3 1 1 8 3618 1 1 18 LYS HE2 H -1.461 -8.829 -1.090 1.00 . A A . 18 LYS HE2 1 1 8 3619 1 1 18 LYS HE3 H -2.647 -9.739 -2.027 1.00 . A A . 18 LYS HE3 1 1 8 3620 1 1 18 LYS HG2 H -1.586 -6.728 -0.599 1.00 . A A . 18 LYS HG2 1 1 8 3621 1 1 18 LYS HG3 H -3.159 -5.966 -0.386 1.00 . A A . 18 LYS HG3 1 1 8 3622 1 1 18 LYS HZ1 H -0.487 -8.002 -2.933 1.00 . A A . 18 LYS HZ1 1 1 8 3623 1 1 18 LYS HZ2 H -1.965 -7.824 -3.762 1.00 . A A . 18 LYS HZ2 1 1 8 3624 1 1 18 LYS HZ3 H -1.216 -9.345 -3.701 1.00 . A A . 18 LYS HZ3 1 1 8 3625 1 1 18 LYS N N 0.056 -5.554 -1.188 1.00 . A A . 18 LYS N 1 1 8 3626 1 1 18 LYS NZ N -1.402 -8.469 -3.176 1.00 . A A . 18 LYS NZ 1 1 8 3627 1 1 18 LYS O O -1.561 -3.112 -0.603 1.00 . A A . 18 LYS O 1 1 8 3628 1 1 19 PRO C C -1.630 -0.280 -2.480 1.00 . A A . 19 PRO C 1 1 8 3629 1 1 19 PRO CA C -0.390 -1.025 -1.996 1.00 . A A . 19 PRO CA 1 1 8 3630 1 1 19 PRO CB C 0.860 -0.501 -2.696 1.00 . A A . 19 PRO CB 1 1 8 3631 1 1 19 PRO CD C 0.369 -2.692 -3.618 1.00 . A A . 19 PRO CD 1 1 8 3632 1 1 19 PRO CG C 0.968 -1.319 -3.942 1.00 . A A . 19 PRO CG 1 1 8 3633 1 1 19 PRO HA H -0.275 -0.909 -0.933 1.00 . A A . 19 PRO HA 1 1 8 3634 1 1 19 PRO HB2 H 0.746 0.548 -2.937 1.00 . A A . 19 PRO HB2 1 1 8 3635 1 1 19 PRO HB3 H 1.727 -0.656 -2.076 1.00 . A A . 19 PRO HB3 1 1 8 3636 1 1 19 PRO HD2 H -0.299 -3.010 -4.409 1.00 . A A . 19 PRO HD2 1 1 8 3637 1 1 19 PRO HD3 H 1.150 -3.421 -3.464 1.00 . A A . 19 PRO HD3 1 1 8 3638 1 1 19 PRO HG2 H 0.411 -0.848 -4.743 1.00 . A A . 19 PRO HG2 1 1 8 3639 1 1 19 PRO HG3 H 2.002 -1.432 -4.226 1.00 . A A . 19 PRO HG3 1 1 8 3640 1 1 19 PRO N N -0.376 -2.467 -2.364 1.00 . A A . 19 PRO N 1 1 8 3641 1 1 19 PRO O O -2.280 -0.677 -3.446 1.00 . A A . 19 PRO O 1 1 8 3642 1 1 20 THR C C -2.868 3.069 -1.664 1.00 . A A . 20 THR C 1 1 8 3643 1 1 20 THR CA C -3.078 1.649 -2.163 1.00 . A A . 20 THR CA 1 1 8 3644 1 1 20 THR CB C -4.376 1.095 -1.584 1.00 . A A . 20 THR CB 1 1 8 3645 1 1 20 THR CG2 C -5.557 1.783 -2.267 1.00 . A A . 20 THR CG2 1 1 8 3646 1 1 20 THR H H -1.372 1.082 -1.039 1.00 . A A . 20 THR H 1 1 8 3647 1 1 20 THR HA H -3.164 1.671 -3.238 1.00 . A A . 20 THR HA 1 1 8 3648 1 1 20 THR HB H -4.413 1.293 -0.525 1.00 . A A . 20 THR HB 1 1 8 3649 1 1 20 THR HG1 H -3.854 -0.517 -2.554 1.00 . A A . 20 THR HG1 1 1 8 3650 1 1 20 THR HG21 H -5.433 1.732 -3.339 1.00 . A A . 20 THR HG21 1 1 8 3651 1 1 20 THR HG22 H -5.599 2.817 -1.959 1.00 . A A . 20 THR HG22 1 1 8 3652 1 1 20 THR HG23 H -6.471 1.289 -1.989 1.00 . A A . 20 THR HG23 1 1 8 3653 1 1 20 THR N N -1.936 0.817 -1.801 1.00 . A A . 20 THR N 1 1 8 3654 1 1 20 THR O O -2.109 3.306 -0.721 1.00 . A A . 20 THR O 1 1 8 3655 1 1 20 THR OG1 O -4.445 -0.305 -1.819 1.00 . A A . 20 THR OG1 1 1 8 3656 1 1 21 CYS C C -4.748 6.133 -2.063 1.00 . A A . 21 CYS C 1 1 8 3657 1 1 21 CYS CA C -3.409 5.414 -1.954 1.00 . A A . 21 CYS CA 1 1 8 3658 1 1 21 CYS CB C -2.410 6.088 -2.887 1.00 . A A . 21 CYS CB 1 1 8 3659 1 1 21 CYS H H -4.105 3.753 -3.071 1.00 . A A . 21 CYS H 1 1 8 3660 1 1 21 CYS HA H -3.048 5.492 -0.944 1.00 . A A . 21 CYS HA 1 1 8 3661 1 1 21 CYS HB2 H -2.423 5.588 -3.838 1.00 . A A . 21 CYS HB2 1 1 8 3662 1 1 21 CYS HB3 H -2.686 7.123 -3.024 1.00 . A A . 21 CYS HB3 1 1 8 3663 1 1 21 CYS N N -3.532 4.010 -2.314 1.00 . A A . 21 CYS N 1 1 8 3664 1 1 21 CYS O O -5.341 6.201 -3.139 1.00 . A A . 21 CYS O 1 1 8 3665 1 1 21 CYS SG S -0.745 5.998 -2.186 1.00 . A A . 21 CYS SG 1 1 8 3666 1 1 22 GLU C C -6.219 8.648 -0.026 1.00 . A A . 22 GLU C 1 1 8 3667 1 1 22 GLU CA C -6.424 7.450 -0.934 1.00 . A A . 22 GLU CA 1 1 8 3668 1 1 22 GLU CB C -7.604 6.580 -0.468 1.00 . A A . 22 GLU CB 1 1 8 3669 1 1 22 GLU CD C -6.425 4.608 0.528 1.00 . A A . 22 GLU CD 1 1 8 3670 1 1 22 GLU CG C -7.254 5.850 0.829 1.00 . A A . 22 GLU CG 1 1 8 3671 1 1 22 GLU H H -4.671 6.660 -0.133 1.00 . A A . 22 GLU H 1 1 8 3672 1 1 22 GLU HA H -6.627 7.807 -1.934 1.00 . A A . 22 GLU HA 1 1 8 3673 1 1 22 GLU HB2 H -8.468 7.207 -0.305 1.00 . A A . 22 GLU HB2 1 1 8 3674 1 1 22 GLU HB3 H -7.833 5.852 -1.234 1.00 . A A . 22 GLU HB3 1 1 8 3675 1 1 22 GLU HG2 H -6.695 6.510 1.468 1.00 . A A . 22 GLU HG2 1 1 8 3676 1 1 22 GLU HG3 H -8.165 5.556 1.330 1.00 . A A . 22 GLU HG3 1 1 8 3677 1 1 22 GLU N N -5.196 6.705 -0.954 1.00 . A A . 22 GLU N 1 1 8 3678 1 1 22 GLU O O -5.521 8.567 0.988 1.00 . A A . 22 GLU O 1 1 8 3679 1 1 22 GLU OE1 O -6.961 3.680 -0.048 1.00 . A A . 22 GLU OE1 1 1 8 3680 1 1 22 GLU OE2 O -5.264 4.601 0.891 1.00 . A A . 22 GLU OE2 1 1 8 3681 1 1 23 ASN C C -5.163 11.361 0.504 1.00 . A A . 23 ASN C 1 1 8 3682 1 1 23 ASN CA C -6.641 11.026 0.294 1.00 . A A . 23 ASN CA 1 1 8 3683 1 1 23 ASN CB C -7.392 10.985 1.645 1.00 . A A . 23 ASN CB 1 1 8 3684 1 1 23 ASN CG C -7.689 9.552 2.082 1.00 . A A . 23 ASN CG 1 1 8 3685 1 1 23 ASN H H -7.263 9.737 -1.272 1.00 . A A . 23 ASN H 1 1 8 3686 1 1 23 ASN HA H -7.075 11.811 -0.311 1.00 . A A . 23 ASN HA 1 1 8 3687 1 1 23 ASN HB2 H -6.791 11.463 2.402 1.00 . A A . 23 ASN HB2 1 1 8 3688 1 1 23 ASN HB3 H -8.321 11.523 1.543 1.00 . A A . 23 ASN HB3 1 1 8 3689 1 1 23 ASN HD21 H -9.097 9.274 0.718 1.00 . A A . 23 ASN HD21 1 1 8 3690 1 1 23 ASN HD22 H -8.800 7.951 1.736 1.00 . A A . 23 ASN HD22 1 1 8 3691 1 1 23 ASN N N -6.777 9.761 -0.437 1.00 . A A . 23 ASN N 1 1 8 3692 1 1 23 ASN ND2 N -8.604 8.870 1.460 1.00 . A A . 23 ASN ND2 1 1 8 3693 1 1 23 ASN O O -4.768 11.893 1.540 1.00 . A A . 23 ASN O 1 1 8 3694 1 1 23 ASN OD1 O -7.077 9.043 3.018 1.00 . A A . 23 ASN OD1 1 1 8 3695 1 1 24 GLU C C -2.214 10.422 0.565 1.00 . A A . 24 GLU C 1 1 8 3696 1 1 24 GLU CA C -2.914 11.299 -0.469 1.00 . A A . 24 GLU CA 1 1 8 3697 1 1 24 GLU CB C -2.632 12.779 -0.183 1.00 . A A . 24 GLU CB 1 1 8 3698 1 1 24 GLU CD C -0.907 13.022 -1.989 1.00 . A A . 24 GLU CD 1 1 8 3699 1 1 24 GLU CG C -2.271 13.493 -1.491 1.00 . A A . 24 GLU CG 1 1 8 3700 1 1 24 GLU H H -4.741 10.620 -1.302 1.00 . A A . 24 GLU H 1 1 8 3701 1 1 24 GLU HA H -2.510 11.057 -1.438 1.00 . A A . 24 GLU HA 1 1 8 3702 1 1 24 GLU HB2 H -3.509 13.238 0.249 1.00 . A A . 24 GLU HB2 1 1 8 3703 1 1 24 GLU HB3 H -1.805 12.864 0.510 1.00 . A A . 24 GLU HB3 1 1 8 3704 1 1 24 GLU HG2 H -3.019 13.273 -2.238 1.00 . A A . 24 GLU HG2 1 1 8 3705 1 1 24 GLU HG3 H -2.238 14.557 -1.321 1.00 . A A . 24 GLU HG3 1 1 8 3706 1 1 24 GLU N N -4.356 11.039 -0.506 1.00 . A A . 24 GLU N 1 1 8 3707 1 1 24 GLU O O -1.000 10.506 0.745 1.00 . A A . 24 GLU O 1 1 8 3708 1 1 24 GLU OE1 O -0.863 12.014 -2.678 1.00 . A A . 24 GLU OE1 1 1 8 3709 1 1 24 GLU OE2 O 0.072 13.675 -1.679 1.00 . A A . 24 GLU OE2 1 1 8 3710 1 1 25 VAL C C -2.223 7.297 1.671 1.00 . A A . 25 VAL C 1 1 8 3711 1 1 25 VAL CA C -2.418 8.694 2.246 1.00 . A A . 25 VAL CA 1 1 8 3712 1 1 25 VAL CB C -3.353 8.633 3.455 1.00 . A A . 25 VAL CB 1 1 8 3713 1 1 25 VAL CG1 C -2.887 7.538 4.412 1.00 . A A . 25 VAL CG1 1 1 8 3714 1 1 25 VAL CG2 C -3.332 9.981 4.183 1.00 . A A . 25 VAL CG2 1 1 8 3715 1 1 25 VAL H H -3.947 9.547 1.055 1.00 . A A . 25 VAL H 1 1 8 3716 1 1 25 VAL HA H -1.461 9.081 2.563 1.00 . A A . 25 VAL HA 1 1 8 3717 1 1 25 VAL HB H -4.359 8.419 3.122 1.00 . A A . 25 VAL HB 1 1 8 3718 1 1 25 VAL HG11 H -2.781 6.606 3.875 1.00 . A A . 25 VAL HG11 1 1 8 3719 1 1 25 VAL HG12 H -3.614 7.418 5.199 1.00 . A A . 25 VAL HG12 1 1 8 3720 1 1 25 VAL HG13 H -1.936 7.815 4.838 1.00 . A A . 25 VAL HG13 1 1 8 3721 1 1 25 VAL HG21 H -2.312 10.319 4.288 1.00 . A A . 25 VAL HG21 1 1 8 3722 1 1 25 VAL HG22 H -3.777 9.870 5.161 1.00 . A A . 25 VAL HG22 1 1 8 3723 1 1 25 VAL HG23 H -3.894 10.707 3.613 1.00 . A A . 25 VAL HG23 1 1 8 3724 1 1 25 VAL N N -2.981 9.579 1.239 1.00 . A A . 25 VAL N 1 1 8 3725 1 1 25 VAL O O -3.195 6.580 1.435 1.00 . A A . 25 VAL O 1 1 8 3726 1 1 26 CYS C C -0.814 4.516 1.968 1.00 . A A . 26 CYS C 1 1 8 3727 1 1 26 CYS CA C -0.678 5.588 0.901 1.00 . A A . 26 CYS CA 1 1 8 3728 1 1 26 CYS CB C 0.742 5.548 0.338 1.00 . A A . 26 CYS CB 1 1 8 3729 1 1 26 CYS H H -0.232 7.518 1.661 1.00 . A A . 26 CYS H 1 1 8 3730 1 1 26 CYS HA H -1.374 5.378 0.105 1.00 . A A . 26 CYS HA 1 1 8 3731 1 1 26 CYS HB2 H 0.785 4.831 -0.463 1.00 . A A . 26 CYS HB2 1 1 8 3732 1 1 26 CYS HB3 H 1.011 6.518 -0.039 1.00 . A A . 26 CYS HB3 1 1 8 3733 1 1 26 CYS N N -0.970 6.910 1.452 1.00 . A A . 26 CYS N 1 1 8 3734 1 1 26 CYS O O -0.600 4.770 3.154 1.00 . A A . 26 CYS O 1 1 8 3735 1 1 26 CYS SG S 1.896 5.064 1.643 1.00 . A A . 26 CYS SG 1 1 8 3736 1 1 27 LYS C C -1.146 0.864 1.756 1.00 . A A . 27 LYS C 1 1 8 3737 1 1 27 LYS CA C -1.376 2.202 2.462 1.00 . A A . 27 LYS CA 1 1 8 3738 1 1 27 LYS CB C -2.804 2.230 3.031 1.00 . A A . 27 LYS CB 1 1 8 3739 1 1 27 LYS CD C -4.657 3.714 3.843 1.00 . A A . 27 LYS CD 1 1 8 3740 1 1 27 LYS CE C -5.083 5.170 4.053 1.00 . A A . 27 LYS CE 1 1 8 3741 1 1 27 LYS CG C -3.203 3.672 3.369 1.00 . A A . 27 LYS CG 1 1 8 3742 1 1 27 LYS H H -1.367 3.182 0.577 1.00 . A A . 27 LYS H 1 1 8 3743 1 1 27 LYS HA H -0.673 2.297 3.277 1.00 . A A . 27 LYS HA 1 1 8 3744 1 1 27 LYS HB2 H -3.490 1.832 2.297 1.00 . A A . 27 LYS HB2 1 1 8 3745 1 1 27 LYS HB3 H -2.847 1.629 3.927 1.00 . A A . 27 LYS HB3 1 1 8 3746 1 1 27 LYS HD2 H -5.294 3.256 3.098 1.00 . A A . 27 LYS HD2 1 1 8 3747 1 1 27 LYS HD3 H -4.749 3.177 4.775 1.00 . A A . 27 LYS HD3 1 1 8 3748 1 1 27 LYS HE2 H -6.108 5.199 4.398 1.00 . A A . 27 LYS HE2 1 1 8 3749 1 1 27 LYS HE3 H -4.444 5.627 4.793 1.00 . A A . 27 LYS HE3 1 1 8 3750 1 1 27 LYS HG2 H -2.557 4.050 4.149 1.00 . A A . 27 LYS HG2 1 1 8 3751 1 1 27 LYS HG3 H -3.100 4.287 2.488 1.00 . A A . 27 LYS HG3 1 1 8 3752 1 1 27 LYS HZ1 H -5.221 5.264 1.959 1.00 . A A . 27 LYS HZ1 1 1 8 3753 1 1 27 LYS HZ2 H -3.990 6.245 2.616 1.00 . A A . 27 LYS HZ2 1 1 8 3754 1 1 27 LYS HZ3 H -5.614 6.728 2.765 1.00 . A A . 27 LYS HZ3 1 1 8 3755 1 1 27 LYS N N -1.191 3.317 1.539 1.00 . A A . 27 LYS N 1 1 8 3756 1 1 27 LYS NZ N -4.970 5.911 2.761 1.00 . A A . 27 LYS NZ 1 1 8 3757 1 1 27 LYS O O -1.215 0.775 0.529 1.00 . A A . 27 LYS O 1 1 8 3758 1 1 28 CYS C C -1.851 -2.394 2.563 1.00 . A A . 28 CYS C 1 1 8 3759 1 1 28 CYS CA C -0.717 -1.529 2.027 1.00 . A A . 28 CYS CA 1 1 8 3760 1 1 28 CYS CB C 0.642 -2.105 2.445 1.00 . A A . 28 CYS CB 1 1 8 3761 1 1 28 CYS H H -0.890 -0.038 3.520 1.00 . A A . 28 CYS H 1 1 8 3762 1 1 28 CYS HA H -0.776 -1.501 0.951 1.00 . A A . 28 CYS HA 1 1 8 3763 1 1 28 CYS HB2 H 1.343 -1.299 2.607 1.00 . A A . 28 CYS HB2 1 1 8 3764 1 1 28 CYS HB3 H 0.532 -2.676 3.356 1.00 . A A . 28 CYS HB3 1 1 8 3765 1 1 28 CYS N N -0.906 -0.178 2.553 1.00 . A A . 28 CYS N 1 1 8 3766 1 1 28 CYS O O -1.785 -2.901 3.681 1.00 . A A . 28 CYS O 1 1 8 3767 1 1 28 CYS SG S 1.253 -3.186 1.125 1.00 . A A . 28 CYS SG 1 1 8 3768 1 1 29 ASN C C -4.543 -4.289 1.209 1.00 . A A . 29 ASN C 1 1 8 3769 1 1 29 ASN CA C -4.111 -3.220 2.210 1.00 . A A . 29 ASN CA 1 1 8 3770 1 1 29 ASN CB C -5.251 -2.213 2.378 1.00 . A A . 29 ASN CB 1 1 8 3771 1 1 29 ASN CG C -5.237 -1.231 1.210 1.00 . A A . 29 ASN CG 1 1 8 3772 1 1 29 ASN H H -2.926 -2.018 0.922 1.00 . A A . 29 ASN H 1 1 8 3773 1 1 29 ASN HA H -3.921 -3.686 3.164 1.00 . A A . 29 ASN HA 1 1 8 3774 1 1 29 ASN HB2 H -6.197 -2.734 2.401 1.00 . A A . 29 ASN HB2 1 1 8 3775 1 1 29 ASN HB3 H -5.117 -1.669 3.302 1.00 . A A . 29 ASN HB3 1 1 8 3776 1 1 29 ASN HD21 H -4.401 -2.523 -0.049 1.00 . A A . 29 ASN HD21 1 1 8 3777 1 1 29 ASN HD22 H -4.722 -0.973 -0.700 1.00 . A A . 29 ASN HD22 1 1 8 3778 1 1 29 ASN N N -2.919 -2.490 1.783 1.00 . A A . 29 ASN N 1 1 8 3779 1 1 29 ASN ND2 N -4.749 -1.609 0.062 1.00 . A A . 29 ASN ND2 1 1 8 3780 1 1 29 ASN O O -4.516 -4.072 -0.003 1.00 . A A . 29 ASN O 1 1 8 3781 1 1 29 ASN OD1 O -5.687 -0.096 1.342 1.00 . A A . 29 ASN OD1 1 1 8 3782 1 1 30 ILE C C -6.867 -6.176 0.364 1.00 . A A . 30 ILE C 1 1 8 3783 1 1 30 ILE CA C -5.488 -6.516 0.911 1.00 . A A . 30 ILE CA 1 1 8 3784 1 1 30 ILE CB C -5.532 -7.836 1.705 1.00 . A A . 30 ILE CB 1 1 8 3785 1 1 30 ILE CD1 C -3.943 -7.156 3.493 1.00 . A A . 30 ILE CD1 1 1 8 3786 1 1 30 ILE CG1 C -5.394 -7.549 3.200 1.00 . A A . 30 ILE CG1 1 1 8 3787 1 1 30 ILE CG2 C -4.398 -8.765 1.259 1.00 . A A . 30 ILE CG2 1 1 8 3788 1 1 30 ILE H H -5.021 -5.507 2.713 1.00 . A A . 30 ILE H 1 1 8 3789 1 1 30 ILE HA H -4.820 -6.642 0.076 1.00 . A A . 30 ILE HA 1 1 8 3790 1 1 30 ILE HB H -6.478 -8.326 1.525 1.00 . A A . 30 ILE HB 1 1 8 3791 1 1 30 ILE HD11 H -3.442 -6.908 2.565 1.00 . A A . 30 ILE HD11 1 1 8 3792 1 1 30 ILE HD12 H -3.435 -7.985 3.961 1.00 . A A . 30 ILE HD12 1 1 8 3793 1 1 30 ILE HD13 H -3.925 -6.301 4.150 1.00 . A A . 30 ILE HD13 1 1 8 3794 1 1 30 ILE HG12 H -6.058 -6.743 3.480 1.00 . A A . 30 ILE HG12 1 1 8 3795 1 1 30 ILE HG13 H -5.645 -8.437 3.763 1.00 . A A . 30 ILE HG13 1 1 8 3796 1 1 30 ILE HG21 H -4.198 -9.485 2.039 1.00 . A A . 30 ILE HG21 1 1 8 3797 1 1 30 ILE HG22 H -3.507 -8.185 1.071 1.00 . A A . 30 ILE HG22 1 1 8 3798 1 1 30 ILE HG23 H -4.692 -9.284 0.359 1.00 . A A . 30 ILE HG23 1 1 8 3799 1 1 30 ILE N N -4.991 -5.420 1.740 1.00 . A A . 30 ILE N 1 1 8 3800 1 1 30 ILE O O -7.778 -5.815 1.109 1.00 . A A . 30 ILE O 1 1 8 3801 1 1 31 GLY C C -8.123 -4.720 -2.487 1.00 . A A . 31 GLY C 1 1 8 3802 1 1 31 GLY CA C -8.254 -5.975 -1.628 1.00 . A A . 31 GLY CA 1 1 8 3803 1 1 31 GLY H H -6.222 -6.566 -1.472 1.00 . A A . 31 GLY H 1 1 8 3804 1 1 31 GLY HA2 H -8.536 -6.808 -2.255 1.00 . A A . 31 GLY HA2 1 1 8 3805 1 1 31 GLY HA3 H -9.019 -5.810 -0.890 1.00 . A A . 31 GLY HA3 1 1 8 3806 1 1 31 GLY N N -6.995 -6.283 -0.950 1.00 . A A . 31 GLY N 1 1 8 3807 1 1 31 GLY O O -8.913 -4.502 -3.404 1.00 . A A . 31 GLY O 1 1 8 3808 1 1 32 LYS C C -5.458 -2.675 -3.519 1.00 . A A . 32 LYS C 1 1 8 3809 1 1 32 LYS CA C -6.878 -2.679 -2.947 1.00 . A A . 32 LYS CA 1 1 8 3810 1 1 32 LYS CB C -7.078 -1.458 -2.046 1.00 . A A . 32 LYS CB 1 1 8 3811 1 1 32 LYS CD C -8.939 0.157 -1.571 1.00 . A A . 32 LYS CD 1 1 8 3812 1 1 32 LYS CE C -8.356 0.775 -0.295 1.00 . A A . 32 LYS CE 1 1 8 3813 1 1 32 LYS CG C -8.555 -1.327 -1.658 1.00 . A A . 32 LYS CG 1 1 8 3814 1 1 32 LYS H H -6.519 -4.140 -1.452 1.00 . A A . 32 LYS H 1 1 8 3815 1 1 32 LYS HA H -7.581 -2.629 -3.763 1.00 . A A . 32 LYS HA 1 1 8 3816 1 1 32 LYS HB2 H -6.485 -1.573 -1.155 1.00 . A A . 32 LYS HB2 1 1 8 3817 1 1 32 LYS HB3 H -6.766 -0.570 -2.574 1.00 . A A . 32 LYS HB3 1 1 8 3818 1 1 32 LYS HD2 H -8.553 0.680 -2.434 1.00 . A A . 32 LYS HD2 1 1 8 3819 1 1 32 LYS HD3 H -10.015 0.246 -1.549 1.00 . A A . 32 LYS HD3 1 1 8 3820 1 1 32 LYS HE2 H -8.772 0.275 0.569 1.00 . A A . 32 LYS HE2 1 1 8 3821 1 1 32 LYS HE3 H -7.281 0.662 -0.292 1.00 . A A . 32 LYS HE3 1 1 8 3822 1 1 32 LYS HG2 H -9.166 -1.816 -2.405 1.00 . A A . 32 LYS HG2 1 1 8 3823 1 1 32 LYS HG3 H -8.717 -1.799 -0.699 1.00 . A A . 32 LYS HG3 1 1 8 3824 1 1 32 LYS HZ1 H -7.821 2.812 -0.156 1.00 . A A . 32 LYS HZ1 1 1 8 3825 1 1 32 LYS HZ2 H -9.321 2.411 0.563 1.00 . A A . 32 LYS HZ2 1 1 8 3826 1 1 32 LYS HZ3 H -9.201 2.493 -1.126 1.00 . A A . 32 LYS HZ3 1 1 8 3827 1 1 32 LYS N N -7.116 -3.907 -2.190 1.00 . A A . 32 LYS N 1 1 8 3828 1 1 32 LYS NZ N -8.708 2.226 -0.251 1.00 . A A . 32 LYS NZ 1 1 8 3829 1 1 32 LYS O O -4.512 -3.106 -2.860 1.00 . A A . 32 LYS O 1 1 8 3830 1 1 33 LYS C C -3.786 -0.824 -6.122 1.00 . A A . 33 LYS C 1 1 8 3831 1 1 33 LYS CA C -4.008 -2.160 -5.407 1.00 . A A . 33 LYS CA 1 1 8 3832 1 1 33 LYS CB C -3.907 -3.320 -6.409 1.00 . A A . 33 LYS CB 1 1 8 3833 1 1 33 LYS CD C -3.562 -2.609 -8.792 1.00 . A A . 33 LYS CD 1 1 8 3834 1 1 33 LYS CE C -2.857 -1.401 -9.417 1.00 . A A . 33 LYS CE 1 1 8 3835 1 1 33 LYS CG C -2.857 -3.013 -7.488 1.00 . A A . 33 LYS CG 1 1 8 3836 1 1 33 LYS H H -6.105 -1.878 -5.238 1.00 . A A . 33 LYS H 1 1 8 3837 1 1 33 LYS HA H -3.239 -2.285 -4.659 1.00 . A A . 33 LYS HA 1 1 8 3838 1 1 33 LYS HB2 H -3.626 -4.221 -5.883 1.00 . A A . 33 LYS HB2 1 1 8 3839 1 1 33 LYS HB3 H -4.869 -3.469 -6.878 1.00 . A A . 33 LYS HB3 1 1 8 3840 1 1 33 LYS HD2 H -3.536 -3.438 -9.484 1.00 . A A . 33 LYS HD2 1 1 8 3841 1 1 33 LYS HD3 H -4.590 -2.351 -8.582 1.00 . A A . 33 LYS HD3 1 1 8 3842 1 1 33 LYS HE2 H -1.861 -1.311 -9.007 1.00 . A A . 33 LYS HE2 1 1 8 3843 1 1 33 LYS HE3 H -2.793 -1.537 -10.488 1.00 . A A . 33 LYS HE3 1 1 8 3844 1 1 33 LYS HG2 H -2.215 -2.208 -7.154 1.00 . A A . 33 LYS HG2 1 1 8 3845 1 1 33 LYS HG3 H -2.260 -3.895 -7.666 1.00 . A A . 33 LYS HG3 1 1 8 3846 1 1 33 LYS HZ1 H -2.968 0.655 -9.011 1.00 . A A . 33 LYS HZ1 1 1 8 3847 1 1 33 LYS HZ2 H -4.162 -0.298 -8.211 1.00 . A A . 33 LYS HZ2 1 1 8 3848 1 1 33 LYS HZ3 H -4.302 0.029 -9.883 1.00 . A A . 33 LYS HZ3 1 1 8 3849 1 1 33 LYS N N -5.317 -2.199 -4.754 1.00 . A A . 33 LYS N 1 1 8 3850 1 1 33 LYS NZ N -3.635 -0.166 -9.115 1.00 . A A . 33 LYS NZ 1 1 8 3851 1 1 33 LYS O O -4.533 -0.466 -7.039 1.00 . A A . 33 LYS O 1 1 8 3852 1 1 34 ASP C C -1.673 1.004 -7.616 1.00 . A A . 34 ASP C 1 1 8 3853 1 1 34 ASP CA C -2.428 1.192 -6.299 1.00 . A A . 34 ASP CA 1 1 8 3854 1 1 34 ASP CB C -1.572 2.008 -5.326 1.00 . A A . 34 ASP CB 1 1 8 3855 1 1 34 ASP CG C -2.135 3.414 -5.184 1.00 . A A . 34 ASP CG 1 1 8 3856 1 1 34 ASP H H -2.199 -0.439 -4.961 1.00 . A A . 34 ASP H 1 1 8 3857 1 1 34 ASP HA H -3.344 1.730 -6.495 1.00 . A A . 34 ASP HA 1 1 8 3858 1 1 34 ASP HB2 H -1.568 1.526 -4.362 1.00 . A A . 34 ASP HB2 1 1 8 3859 1 1 34 ASP HB3 H -0.561 2.066 -5.700 1.00 . A A . 34 ASP HB3 1 1 8 3860 1 1 34 ASP N N -2.756 -0.099 -5.700 1.00 . A A . 34 ASP N 1 1 8 3861 1 1 34 ASP O O -0.660 0.323 -7.613 1.00 . A A . 34 ASP O 1 1 8 3862 1 1 34 ASP OXT O -2.132 1.530 -8.620 1.00 . A A . 34 ASP OXT 1 1 8 3863 1 1 34 ASP OD1 O -3.265 3.539 -4.747 1.00 . A A . 34 ASP OD1 1 1 8 3864 1 1 34 ASP OD2 O -1.425 4.350 -5.509 1.00 . A A . 34 ASP OD2 1 1 9 3865 1 1 1 GLY C C 11.733 8.675 -0.783 1.00 . A A . 1 GLY C 1 1 9 3866 1 1 1 GLY CA C 12.349 8.294 0.560 1.00 . A A . 1 GLY CA 1 1 9 3867 1 1 1 GLY H1 H 10.980 6.907 1.312 1.00 . A A . 1 GLY H1 1 1 9 3868 1 1 1 GLY H2 H 10.444 8.521 1.385 1.00 . A A . 1 GLY H2 1 1 9 3869 1 1 1 GLY H3 H 11.611 7.964 2.486 1.00 . A A . 1 GLY H3 1 1 9 3870 1 1 1 GLY HA2 H 12.889 9.139 0.961 1.00 . A A . 1 GLY HA2 1 1 9 3871 1 1 1 GLY HA3 H 13.026 7.466 0.417 1.00 . A A . 1 GLY HA3 1 1 9 3872 1 1 1 GLY N N 11.267 7.896 1.509 1.00 . A A . 1 GLY N 1 1 9 3873 1 1 1 GLY O O 12.013 9.744 -1.321 1.00 . A A . 1 GLY O 1 1 9 3874 1 1 2 SER C C 8.765 8.440 -2.378 1.00 . A A . 2 SER C 1 1 9 3875 1 1 2 SER CA C 10.226 8.044 -2.595 1.00 . A A . 2 SER CA 1 1 9 3876 1 1 2 SER CB C 10.295 6.789 -3.472 1.00 . A A . 2 SER CB 1 1 9 3877 1 1 2 SER H H 10.701 6.950 -0.827 1.00 . A A . 2 SER H 1 1 9 3878 1 1 2 SER HA H 10.732 8.851 -3.103 1.00 . A A . 2 SER HA 1 1 9 3879 1 1 2 SER HB2 H 11.308 6.641 -3.812 1.00 . A A . 2 SER HB2 1 1 9 3880 1 1 2 SER HB3 H 9.984 5.929 -2.892 1.00 . A A . 2 SER HB3 1 1 9 3881 1 1 2 SER HG H 9.870 6.551 -5.366 1.00 . A A . 2 SER HG 1 1 9 3882 1 1 2 SER N N 10.889 7.793 -1.314 1.00 . A A . 2 SER N 1 1 9 3883 1 1 2 SER O O 8.410 9.002 -1.341 1.00 . A A . 2 SER O 1 1 9 3884 1 1 2 SER OG O 9.438 6.950 -4.603 1.00 . A A . 2 SER OG 1 1 9 3885 1 1 3 VAL C C 5.774 7.421 -2.417 1.00 . A A . 3 VAL C 1 1 9 3886 1 1 3 VAL CA C 6.503 8.460 -3.269 1.00 . A A . 3 VAL CA 1 1 9 3887 1 1 3 VAL CB C 5.884 8.514 -4.671 1.00 . A A . 3 VAL CB 1 1 9 3888 1 1 3 VAL CG1 C 6.200 9.864 -5.319 1.00 . A A . 3 VAL CG1 1 1 9 3889 1 1 3 VAL CG2 C 6.460 7.392 -5.539 1.00 . A A . 3 VAL CG2 1 1 9 3890 1 1 3 VAL H H 8.273 7.682 -4.164 1.00 . A A . 3 VAL H 1 1 9 3891 1 1 3 VAL HA H 6.396 9.428 -2.804 1.00 . A A . 3 VAL HA 1 1 9 3892 1 1 3 VAL HB H 4.814 8.396 -4.592 1.00 . A A . 3 VAL HB 1 1 9 3893 1 1 3 VAL HG11 H 7.238 10.111 -5.150 1.00 . A A . 3 VAL HG11 1 1 9 3894 1 1 3 VAL HG12 H 5.572 10.630 -4.887 1.00 . A A . 3 VAL HG12 1 1 9 3895 1 1 3 VAL HG13 H 6.014 9.805 -6.382 1.00 . A A . 3 VAL HG13 1 1 9 3896 1 1 3 VAL HG21 H 6.850 6.611 -4.906 1.00 . A A . 3 VAL HG21 1 1 9 3897 1 1 3 VAL HG22 H 7.255 7.786 -6.155 1.00 . A A . 3 VAL HG22 1 1 9 3898 1 1 3 VAL HG23 H 5.681 6.989 -6.169 1.00 . A A . 3 VAL HG23 1 1 9 3899 1 1 3 VAL N N 7.925 8.139 -3.358 1.00 . A A . 3 VAL N 1 1 9 3900 1 1 3 VAL O O 5.832 6.223 -2.697 1.00 . A A . 3 VAL O 1 1 9 3901 1 1 4 GLY C C 3.834 5.757 -1.161 1.00 . A A . 4 GLY C 1 1 9 3902 1 1 4 GLY CA C 4.356 7.011 -0.463 1.00 . A A . 4 GLY CA 1 1 9 3903 1 1 4 GLY H H 5.096 8.857 -1.204 1.00 . A A . 4 GLY H 1 1 9 3904 1 1 4 GLY HA2 H 5.009 6.713 0.344 1.00 . A A . 4 GLY HA2 1 1 9 3905 1 1 4 GLY HA3 H 3.518 7.555 -0.051 1.00 . A A . 4 GLY HA3 1 1 9 3906 1 1 4 GLY N N 5.094 7.892 -1.374 1.00 . A A . 4 GLY N 1 1 9 3907 1 1 4 GLY O O 4.099 4.643 -0.720 1.00 . A A . 4 GLY O 1 1 9 3908 1 1 5 CYS C C 3.590 3.799 -3.377 1.00 . A A . 5 CYS C 1 1 9 3909 1 1 5 CYS CA C 2.519 4.812 -2.979 1.00 . A A . 5 CYS CA 1 1 9 3910 1 1 5 CYS CB C 1.796 5.308 -4.233 1.00 . A A . 5 CYS CB 1 1 9 3911 1 1 5 CYS H H 2.895 6.849 -2.548 1.00 . A A . 5 CYS H 1 1 9 3912 1 1 5 CYS HA H 1.805 4.314 -2.338 1.00 . A A . 5 CYS HA 1 1 9 3913 1 1 5 CYS HB2 H 2.514 5.746 -4.913 1.00 . A A . 5 CYS HB2 1 1 9 3914 1 1 5 CYS HB3 H 1.309 4.479 -4.714 1.00 . A A . 5 CYS HB3 1 1 9 3915 1 1 5 CYS N N 3.084 5.941 -2.243 1.00 . A A . 5 CYS N 1 1 9 3916 1 1 5 CYS O O 3.290 2.624 -3.566 1.00 . A A . 5 CYS O 1 1 9 3917 1 1 5 CYS SG S 0.562 6.553 -3.780 1.00 . A A . 5 CYS SG 1 1 9 3918 1 1 6 ALA C C 6.511 2.751 -2.569 1.00 . A A . 6 ALA C 1 1 9 3919 1 1 6 ALA CA C 5.930 3.352 -3.842 1.00 . A A . 6 ALA CA 1 1 9 3920 1 1 6 ALA CB C 7.013 4.121 -4.601 1.00 . A A . 6 ALA CB 1 1 9 3921 1 1 6 ALA H H 5.025 5.201 -3.313 1.00 . A A . 6 ALA H 1 1 9 3922 1 1 6 ALA HA H 5.554 2.557 -4.467 1.00 . A A . 6 ALA HA 1 1 9 3923 1 1 6 ALA HB1 H 6.571 4.618 -5.452 1.00 . A A . 6 ALA HB1 1 1 9 3924 1 1 6 ALA HB2 H 7.771 3.432 -4.941 1.00 . A A . 6 ALA HB2 1 1 9 3925 1 1 6 ALA HB3 H 7.459 4.855 -3.947 1.00 . A A . 6 ALA HB3 1 1 9 3926 1 1 6 ALA N N 4.834 4.249 -3.490 1.00 . A A . 6 ALA N 1 1 9 3927 1 1 6 ALA O O 6.770 1.547 -2.482 1.00 . A A . 6 ALA O 1 1 9 3928 1 1 7 GLU C C 6.179 2.281 0.409 1.00 . A A . 7 GLU C 1 1 9 3929 1 1 7 GLU CA C 7.206 3.168 -0.287 1.00 . A A . 7 GLU CA 1 1 9 3930 1 1 7 GLU CB C 7.520 4.383 0.585 1.00 . A A . 7 GLU CB 1 1 9 3931 1 1 7 GLU CD C 9.346 6.091 0.616 1.00 . A A . 7 GLU CD 1 1 9 3932 1 1 7 GLU CG C 8.302 5.404 -0.245 1.00 . A A . 7 GLU CG 1 1 9 3933 1 1 7 GLU H H 6.439 4.546 -1.700 1.00 . A A . 7 GLU H 1 1 9 3934 1 1 7 GLU HA H 8.112 2.607 -0.445 1.00 . A A . 7 GLU HA 1 1 9 3935 1 1 7 GLU HB2 H 6.597 4.828 0.932 1.00 . A A . 7 GLU HB2 1 1 9 3936 1 1 7 GLU HB3 H 8.115 4.077 1.433 1.00 . A A . 7 GLU HB3 1 1 9 3937 1 1 7 GLU HG2 H 8.794 4.899 -1.062 1.00 . A A . 7 GLU HG2 1 1 9 3938 1 1 7 GLU HG3 H 7.622 6.144 -0.638 1.00 . A A . 7 GLU HG3 1 1 9 3939 1 1 7 GLU N N 6.685 3.604 -1.572 1.00 . A A . 7 GLU N 1 1 9 3940 1 1 7 GLU O O 6.526 1.312 1.083 1.00 . A A . 7 GLU O 1 1 9 3941 1 1 7 GLU OE1 O 8.970 6.761 1.559 1.00 . A A . 7 GLU OE1 1 1 9 3942 1 1 7 GLU OE2 O 10.519 5.956 0.311 1.00 . A A . 7 GLU OE2 1 1 9 3943 1 1 8 CYS C C 4.008 0.373 0.623 1.00 . A A . 8 CYS C 1 1 9 3944 1 1 8 CYS CA C 3.816 1.873 0.832 1.00 . A A . 8 CYS CA 1 1 9 3945 1 1 8 CYS CB C 2.470 2.331 0.268 1.00 . A A . 8 CYS CB 1 1 9 3946 1 1 8 CYS H H 4.700 3.415 -0.323 1.00 . A A . 8 CYS H 1 1 9 3947 1 1 8 CYS HA H 3.818 2.073 1.886 1.00 . A A . 8 CYS HA 1 1 9 3948 1 1 8 CYS HB2 H 2.624 3.136 -0.433 1.00 . A A . 8 CYS HB2 1 1 9 3949 1 1 8 CYS HB3 H 1.971 1.519 -0.224 1.00 . A A . 8 CYS HB3 1 1 9 3950 1 1 8 CYS N N 4.907 2.627 0.229 1.00 . A A . 8 CYS N 1 1 9 3951 1 1 8 CYS O O 4.132 -0.378 1.590 1.00 . A A . 8 CYS O 1 1 9 3952 1 1 8 CYS SG S 1.458 2.911 1.640 1.00 . A A . 8 CYS SG 1 1 9 3953 1 1 9 PRO C C 5.637 -1.963 -0.377 1.00 . A A . 9 PRO C 1 1 9 3954 1 1 9 PRO CA C 4.278 -1.517 -0.907 1.00 . A A . 9 PRO CA 1 1 9 3955 1 1 9 PRO CB C 4.202 -1.613 -2.437 1.00 . A A . 9 PRO CB 1 1 9 3956 1 1 9 PRO CD C 3.927 0.726 -1.829 1.00 . A A . 9 PRO CD 1 1 9 3957 1 1 9 PRO CG C 4.373 -0.219 -2.945 1.00 . A A . 9 PRO CG 1 1 9 3958 1 1 9 PRO HA H 3.493 -2.111 -0.464 1.00 . A A . 9 PRO HA 1 1 9 3959 1 1 9 PRO HB2 H 4.994 -2.248 -2.809 1.00 . A A . 9 PRO HB2 1 1 9 3960 1 1 9 PRO HB3 H 3.241 -1.998 -2.739 1.00 . A A . 9 PRO HB3 1 1 9 3961 1 1 9 PRO HD2 H 4.568 1.592 -1.790 1.00 . A A . 9 PRO HD2 1 1 9 3962 1 1 9 PRO HD3 H 2.901 1.021 -1.972 1.00 . A A . 9 PRO HD3 1 1 9 3963 1 1 9 PRO HG2 H 5.412 -0.041 -3.192 1.00 . A A . 9 PRO HG2 1 1 9 3964 1 1 9 PRO HG3 H 3.756 -0.064 -3.817 1.00 . A A . 9 PRO HG3 1 1 9 3965 1 1 9 PRO N N 4.061 -0.076 -0.608 1.00 . A A . 9 PRO N 1 1 9 3966 1 1 9 PRO O O 5.783 -3.072 0.142 1.00 . A A . 9 PRO O 1 1 9 3967 1 1 10 MET C C 7.899 -1.536 1.541 1.00 . A A . 10 MET C 1 1 9 3968 1 1 10 MET CA C 7.959 -1.359 0.026 1.00 . A A . 10 MET CA 1 1 9 3969 1 1 10 MET CB C 8.915 -0.217 -0.333 1.00 . A A . 10 MET CB 1 1 9 3970 1 1 10 MET CE C 11.574 -0.372 -3.469 1.00 . A A . 10 MET CE 1 1 9 3971 1 1 10 MET CG C 9.479 -0.437 -1.739 1.00 . A A . 10 MET CG 1 1 9 3972 1 1 10 MET H H 6.438 -0.190 -0.882 1.00 . A A . 10 MET H 1 1 9 3973 1 1 10 MET HA H 8.316 -2.274 -0.420 1.00 . A A . 10 MET HA 1 1 9 3974 1 1 10 MET HB2 H 8.380 0.720 -0.303 1.00 . A A . 10 MET HB2 1 1 9 3975 1 1 10 MET HB3 H 9.726 -0.189 0.377 1.00 . A A . 10 MET HB3 1 1 9 3976 1 1 10 MET HE1 H 11.208 0.542 -3.919 1.00 . A A . 10 MET HE1 1 1 9 3977 1 1 10 MET HE2 H 11.057 -1.221 -3.894 1.00 . A A . 10 MET HE2 1 1 9 3978 1 1 10 MET HE3 H 12.630 -0.468 -3.661 1.00 . A A . 10 MET HE3 1 1 9 3979 1 1 10 MET HG2 H 9.192 -1.417 -2.095 1.00 . A A . 10 MET HG2 1 1 9 3980 1 1 10 MET HG3 H 9.089 0.315 -2.407 1.00 . A A . 10 MET HG3 1 1 9 3981 1 1 10 MET N N 6.622 -1.070 -0.480 1.00 . A A . 10 MET N 1 1 9 3982 1 1 10 MET O O 8.608 -2.364 2.109 1.00 . A A . 10 MET O 1 1 9 3983 1 1 10 MET SD S 11.286 -0.320 -1.684 1.00 . A A . 10 MET SD 1 1 9 3984 1 1 11 HIS C C 5.895 -2.001 3.977 1.00 . A A . 11 HIS C 1 1 9 3985 1 1 11 HIS CA C 6.853 -0.857 3.635 1.00 . A A . 11 HIS CA 1 1 9 3986 1 1 11 HIS CB C 6.308 0.464 4.195 1.00 . A A . 11 HIS CB 1 1 9 3987 1 1 11 HIS CD2 C 7.322 1.887 6.162 1.00 . A A . 11 HIS CD2 1 1 9 3988 1 1 11 HIS CE1 C 7.691 0.277 7.566 1.00 . A A . 11 HIS CE1 1 1 9 3989 1 1 11 HIS CG C 6.911 0.728 5.552 1.00 . A A . 11 HIS CG 1 1 9 3990 1 1 11 HIS H H 6.474 -0.126 1.671 1.00 . A A . 11 HIS H 1 1 9 3991 1 1 11 HIS HA H 7.813 -1.059 4.088 1.00 . A A . 11 HIS HA 1 1 9 3992 1 1 11 HIS HB2 H 6.563 1.272 3.525 1.00 . A A . 11 HIS HB2 1 1 9 3993 1 1 11 HIS HB3 H 5.233 0.402 4.288 1.00 . A A . 11 HIS HB3 1 1 9 3994 1 1 11 HIS HD2 H 7.273 2.872 5.721 1.00 . A A . 11 HIS HD2 1 1 9 3995 1 1 11 HIS HE1 H 7.989 -0.272 8.448 1.00 . A A . 11 HIS HE1 1 1 9 3996 1 1 11 HIS HE2 H 8.170 2.235 8.091 1.00 . A A . 11 HIS HE2 1 1 9 3997 1 1 11 HIS N N 7.024 -0.764 2.185 1.00 . A A . 11 HIS N 1 1 9 3998 1 1 11 HIS ND1 N 7.156 -0.287 6.468 1.00 . A A . 11 HIS ND1 1 1 9 3999 1 1 11 HIS NE2 N 7.813 1.601 7.433 1.00 . A A . 11 HIS NE2 1 1 9 4000 1 1 11 HIS O O 5.324 -2.049 5.069 1.00 . A A . 11 HIS O 1 1 9 4001 1 1 12 CYS C C 5.679 -5.298 3.650 1.00 . A A . 12 CYS C 1 1 9 4002 1 1 12 CYS CA C 4.858 -4.081 3.237 1.00 . A A . 12 CYS CA 1 1 9 4003 1 1 12 CYS CB C 4.064 -4.388 1.971 1.00 . A A . 12 CYS CB 1 1 9 4004 1 1 12 CYS H H 6.225 -2.840 2.191 1.00 . A A . 12 CYS H 1 1 9 4005 1 1 12 CYS HA H 4.162 -3.851 4.032 1.00 . A A . 12 CYS HA 1 1 9 4006 1 1 12 CYS HB2 H 4.039 -3.515 1.343 1.00 . A A . 12 CYS HB2 1 1 9 4007 1 1 12 CYS HB3 H 4.530 -5.205 1.441 1.00 . A A . 12 CYS HB3 1 1 9 4008 1 1 12 CYS N N 5.735 -2.929 3.039 1.00 . A A . 12 CYS N 1 1 9 4009 1 1 12 CYS O O 6.825 -5.455 3.234 1.00 . A A . 12 CYS O 1 1 9 4010 1 1 12 CYS SG S 2.374 -4.850 2.429 1.00 . A A . 12 CYS SG 1 1 9 4011 1 1 13 LYS C C 5.457 -8.586 4.241 1.00 . A A . 13 LYS C 1 1 9 4012 1 1 13 LYS CA C 5.812 -7.305 5.015 1.00 . A A . 13 LYS CA 1 1 9 4013 1 1 13 LYS CB C 5.484 -7.475 6.503 1.00 . A A . 13 LYS CB 1 1 9 4014 1 1 13 LYS CD C 5.652 -5.082 7.307 1.00 . A A . 13 LYS CD 1 1 9 4015 1 1 13 LYS CE C 6.720 -4.007 7.064 1.00 . A A . 13 LYS CE 1 1 9 4016 1 1 13 LYS CG C 6.310 -6.476 7.333 1.00 . A A . 13 LYS CG 1 1 9 4017 1 1 13 LYS H H 4.201 -5.937 4.826 1.00 . A A . 13 LYS H 1 1 9 4018 1 1 13 LYS HA H 6.874 -7.135 4.920 1.00 . A A . 13 LYS HA 1 1 9 4019 1 1 13 LYS HB2 H 4.429 -7.296 6.662 1.00 . A A . 13 LYS HB2 1 1 9 4020 1 1 13 LYS HB3 H 5.726 -8.481 6.812 1.00 . A A . 13 LYS HB3 1 1 9 4021 1 1 13 LYS HD2 H 4.917 -5.043 6.518 1.00 . A A . 13 LYS HD2 1 1 9 4022 1 1 13 LYS HD3 H 5.170 -4.896 8.255 1.00 . A A . 13 LYS HD3 1 1 9 4023 1 1 13 LYS HE2 H 7.489 -4.087 7.821 1.00 . A A . 13 LYS HE2 1 1 9 4024 1 1 13 LYS HE3 H 7.163 -4.152 6.088 1.00 . A A . 13 LYS HE3 1 1 9 4025 1 1 13 LYS HG2 H 6.365 -6.825 8.356 1.00 . A A . 13 LYS HG2 1 1 9 4026 1 1 13 LYS HG3 H 7.306 -6.411 6.924 1.00 . A A . 13 LYS HG3 1 1 9 4027 1 1 13 LYS HZ1 H 5.714 -2.388 6.184 1.00 . A A . 13 LYS HZ1 1 1 9 4028 1 1 13 LYS HZ2 H 6.803 -1.944 7.419 1.00 . A A . 13 LYS HZ2 1 1 9 4029 1 1 13 LYS HZ3 H 5.313 -2.661 7.820 1.00 . A A . 13 LYS HZ3 1 1 9 4030 1 1 13 LYS N N 5.104 -6.130 4.507 1.00 . A A . 13 LYS N 1 1 9 4031 1 1 13 LYS NZ N 6.092 -2.651 7.132 1.00 . A A . 13 LYS NZ 1 1 9 4032 1 1 13 LYS O O 4.309 -8.806 3.851 1.00 . A A . 13 LYS O 1 1 9 4033 1 1 14 GLY C C 5.069 -11.442 3.609 1.00 . A A . 14 GLY C 1 1 9 4034 1 1 14 GLY CA C 6.355 -10.681 3.284 1.00 . A A . 14 GLY CA 1 1 9 4035 1 1 14 GLY H H 7.369 -9.155 4.355 1.00 . A A . 14 GLY H 1 1 9 4036 1 1 14 GLY HA2 H 6.373 -10.471 2.226 1.00 . A A . 14 GLY HA2 1 1 9 4037 1 1 14 GLY HA3 H 7.200 -11.312 3.526 1.00 . A A . 14 GLY HA3 1 1 9 4038 1 1 14 GLY N N 6.484 -9.413 4.020 1.00 . A A . 14 GLY N 1 1 9 4039 1 1 14 GLY O O 4.618 -11.470 4.752 1.00 . A A . 14 GLY O 1 1 9 4040 1 1 15 LYS C C 2.036 -11.963 2.501 1.00 . A A . 15 LYS C 1 1 9 4041 1 1 15 LYS CA C 3.266 -12.850 2.695 1.00 . A A . 15 LYS CA 1 1 9 4042 1 1 15 LYS CB C 3.202 -13.555 4.062 1.00 . A A . 15 LYS CB 1 1 9 4043 1 1 15 LYS CD C 1.564 -15.111 5.140 1.00 . A A . 15 LYS CD 1 1 9 4044 1 1 15 LYS CE C 0.844 -16.458 5.019 1.00 . A A . 15 LYS CE 1 1 9 4045 1 1 15 LYS CG C 2.488 -14.899 3.931 1.00 . A A . 15 LYS CG 1 1 9 4046 1 1 15 LYS H H 4.932 -11.995 1.695 1.00 . A A . 15 LYS H 1 1 9 4047 1 1 15 LYS HA H 3.265 -13.604 1.920 1.00 . A A . 15 LYS HA 1 1 9 4048 1 1 15 LYS HB2 H 4.206 -13.721 4.425 1.00 . A A . 15 LYS HB2 1 1 9 4049 1 1 15 LYS HB3 H 2.670 -12.942 4.761 1.00 . A A . 15 LYS HB3 1 1 9 4050 1 1 15 LYS HD2 H 2.155 -15.100 6.045 1.00 . A A . 15 LYS HD2 1 1 9 4051 1 1 15 LYS HD3 H 0.834 -14.315 5.178 1.00 . A A . 15 LYS HD3 1 1 9 4052 1 1 15 LYS HE2 H 1.563 -17.235 4.793 1.00 . A A . 15 LYS HE2 1 1 9 4053 1 1 15 LYS HE3 H 0.347 -16.688 5.955 1.00 . A A . 15 LYS HE3 1 1 9 4054 1 1 15 LYS HG2 H 1.909 -14.919 3.019 1.00 . A A . 15 LYS HG2 1 1 9 4055 1 1 15 LYS HG3 H 3.225 -15.679 3.909 1.00 . A A . 15 LYS HG3 1 1 9 4056 1 1 15 LYS HZ1 H -0.056 -15.476 3.415 1.00 . A A . 15 LYS HZ1 1 1 9 4057 1 1 15 LYS HZ2 H -1.123 -16.428 4.326 1.00 . A A . 15 LYS HZ2 1 1 9 4058 1 1 15 LYS HZ3 H -0.025 -17.169 3.262 1.00 . A A . 15 LYS HZ3 1 1 9 4059 1 1 15 LYS N N 4.502 -12.063 2.573 1.00 . A A . 15 LYS N 1 1 9 4060 1 1 15 LYS NZ N -0.166 -16.377 3.924 1.00 . A A . 15 LYS NZ 1 1 9 4061 1 1 15 LYS O O 0.957 -12.452 2.163 1.00 . A A . 15 LYS O 1 1 9 4062 1 1 16 MET C C 1.610 -8.411 1.905 1.00 . A A . 16 MET C 1 1 9 4063 1 1 16 MET CA C 1.112 -9.709 2.542 1.00 . A A . 16 MET CA 1 1 9 4064 1 1 16 MET CB C 0.498 -9.399 3.913 1.00 . A A . 16 MET CB 1 1 9 4065 1 1 16 MET CE C -1.776 -11.258 6.595 1.00 . A A . 16 MET CE 1 1 9 4066 1 1 16 MET CG C -0.270 -10.618 4.431 1.00 . A A . 16 MET CG 1 1 9 4067 1 1 16 MET H H 3.094 -10.329 2.969 1.00 . A A . 16 MET H 1 1 9 4068 1 1 16 MET HA H 0.356 -10.148 1.910 1.00 . A A . 16 MET HA 1 1 9 4069 1 1 16 MET HB2 H 1.288 -9.150 4.608 1.00 . A A . 16 MET HB2 1 1 9 4070 1 1 16 MET HB3 H -0.178 -8.562 3.825 1.00 . A A . 16 MET HB3 1 1 9 4071 1 1 16 MET HE1 H -2.706 -11.189 7.144 1.00 . A A . 16 MET HE1 1 1 9 4072 1 1 16 MET HE2 H -0.945 -11.039 7.252 1.00 . A A . 16 MET HE2 1 1 9 4073 1 1 16 MET HE3 H -1.669 -12.253 6.200 1.00 . A A . 16 MET HE3 1 1 9 4074 1 1 16 MET HG2 H -0.514 -11.270 3.605 1.00 . A A . 16 MET HG2 1 1 9 4075 1 1 16 MET HG3 H 0.339 -11.153 5.144 1.00 . A A . 16 MET HG3 1 1 9 4076 1 1 16 MET N N 2.210 -10.660 2.707 1.00 . A A . 16 MET N 1 1 9 4077 1 1 16 MET O O 2.154 -7.553 2.597 1.00 . A A . 16 MET O 1 1 9 4078 1 1 16 MET SD S -1.795 -10.069 5.233 1.00 . A A . 16 MET SD 1 1 9 4079 1 1 17 ALA C C 0.876 -6.550 -1.133 1.00 . A A . 17 ALA C 1 1 9 4080 1 1 17 ALA CA C 1.868 -7.032 -0.080 1.00 . A A . 17 ALA CA 1 1 9 4081 1 1 17 ALA CB C 3.223 -7.250 -0.736 1.00 . A A . 17 ALA CB 1 1 9 4082 1 1 17 ALA H H 0.978 -8.963 0.081 1.00 . A A . 17 ALA H 1 1 9 4083 1 1 17 ALA HA H 1.969 -6.257 0.662 1.00 . A A . 17 ALA HA 1 1 9 4084 1 1 17 ALA HB1 H 3.279 -8.256 -1.117 1.00 . A A . 17 ALA HB1 1 1 9 4085 1 1 17 ALA HB2 H 4.003 -7.091 -0.008 1.00 . A A . 17 ALA HB2 1 1 9 4086 1 1 17 ALA HB3 H 3.342 -6.549 -1.550 1.00 . A A . 17 ALA HB3 1 1 9 4087 1 1 17 ALA N N 1.420 -8.256 0.594 1.00 . A A . 17 ALA N 1 1 9 4088 1 1 17 ALA O O 0.638 -7.209 -2.153 1.00 . A A . 17 ALA O 1 1 9 4089 1 1 18 LYS C C -0.790 -3.279 -1.429 1.00 . A A . 18 LYS C 1 1 9 4090 1 1 18 LYS CA C -0.661 -4.765 -1.770 1.00 . A A . 18 LYS CA 1 1 9 4091 1 1 18 LYS CB C -2.032 -5.450 -1.681 1.00 . A A . 18 LYS CB 1 1 9 4092 1 1 18 LYS CD C -1.795 -7.683 -0.488 1.00 . A A . 18 LYS CD 1 1 9 4093 1 1 18 LYS CE C -2.353 -8.277 -1.789 1.00 . A A . 18 LYS CE 1 1 9 4094 1 1 18 LYS CG C -2.186 -6.195 -0.347 1.00 . A A . 18 LYS CG 1 1 9 4095 1 1 18 LYS H H 0.557 -4.931 -0.042 1.00 . A A . 18 LYS H 1 1 9 4096 1 1 18 LYS HA H -0.297 -4.858 -2.778 1.00 . A A . 18 LYS HA 1 1 9 4097 1 1 18 LYS HB2 H -2.807 -4.698 -1.756 1.00 . A A . 18 LYS HB2 1 1 9 4098 1 1 18 LYS HB3 H -2.133 -6.141 -2.498 1.00 . A A . 18 LYS HB3 1 1 9 4099 1 1 18 LYS HD2 H -0.727 -7.777 -0.487 1.00 . A A . 18 LYS HD2 1 1 9 4100 1 1 18 LYS HD3 H -2.190 -8.236 0.349 1.00 . A A . 18 LYS HD3 1 1 9 4101 1 1 18 LYS HE2 H -2.666 -9.297 -1.610 1.00 . A A . 18 LYS HE2 1 1 9 4102 1 1 18 LYS HE3 H -3.202 -7.695 -2.120 1.00 . A A . 18 LYS HE3 1 1 9 4103 1 1 18 LYS HG2 H -1.552 -5.729 0.394 1.00 . A A . 18 LYS HG2 1 1 9 4104 1 1 18 LYS HG3 H -3.212 -6.126 -0.027 1.00 . A A . 18 LYS HG3 1 1 9 4105 1 1 18 LYS HZ1 H -1.030 -9.232 -3.093 1.00 . A A . 18 LYS HZ1 1 1 9 4106 1 1 18 LYS HZ2 H -0.433 -7.758 -2.476 1.00 . A A . 18 LYS HZ2 1 1 9 4107 1 1 18 LYS HZ3 H -1.640 -7.762 -3.685 1.00 . A A . 18 LYS HZ3 1 1 9 4108 1 1 18 LYS N N 0.307 -5.390 -0.868 1.00 . A A . 18 LYS N 1 1 9 4109 1 1 18 LYS NZ N -1.288 -8.258 -2.840 1.00 . A A . 18 LYS NZ 1 1 9 4110 1 1 18 LYS O O -1.307 -2.922 -0.367 1.00 . A A . 18 LYS O 1 1 9 4111 1 1 19 PRO C C -1.706 -0.307 -2.278 1.00 . A A . 19 PRO C 1 1 9 4112 1 1 19 PRO CA C -0.337 -0.946 -2.052 1.00 . A A . 19 PRO CA 1 1 9 4113 1 1 19 PRO CB C 0.682 -0.411 -3.057 1.00 . A A . 19 PRO CB 1 1 9 4114 1 1 19 PRO CD C 0.328 -2.748 -3.579 1.00 . A A . 19 PRO CD 1 1 9 4115 1 1 19 PRO CG C 0.653 -1.382 -4.189 1.00 . A A . 19 PRO CG 1 1 9 4116 1 1 19 PRO HA H 0.005 -0.726 -1.056 1.00 . A A . 19 PRO HA 1 1 9 4117 1 1 19 PRO HB2 H 0.395 0.576 -3.397 1.00 . A A . 19 PRO HB2 1 1 9 4118 1 1 19 PRO HB3 H 1.665 -0.388 -2.618 1.00 . A A . 19 PRO HB3 1 1 9 4119 1 1 19 PRO HD2 H -0.361 -3.289 -4.216 1.00 . A A . 19 PRO HD2 1 1 9 4120 1 1 19 PRO HD3 H 1.229 -3.317 -3.420 1.00 . A A . 19 PRO HD3 1 1 9 4121 1 1 19 PRO HG2 H -0.112 -1.096 -4.900 1.00 . A A . 19 PRO HG2 1 1 9 4122 1 1 19 PRO HG3 H 1.616 -1.420 -4.673 1.00 . A A . 19 PRO HG3 1 1 9 4123 1 1 19 PRO N N -0.305 -2.418 -2.287 1.00 . A A . 19 PRO N 1 1 9 4124 1 1 19 PRO O O -2.350 -0.526 -3.307 1.00 . A A . 19 PRO O 1 1 9 4125 1 1 20 THR C C -3.153 2.705 -1.203 1.00 . A A . 20 THR C 1 1 9 4126 1 1 20 THR CA C -3.392 1.217 -1.400 1.00 . A A . 20 THR CA 1 1 9 4127 1 1 20 THR CB C -4.385 0.733 -0.341 1.00 . A A . 20 THR CB 1 1 9 4128 1 1 20 THR CG2 C -4.618 -0.769 -0.488 1.00 . A A . 20 THR CG2 1 1 9 4129 1 1 20 THR H H -1.554 0.647 -0.523 1.00 . A A . 20 THR H 1 1 9 4130 1 1 20 THR HA H -3.820 1.057 -2.377 1.00 . A A . 20 THR HA 1 1 9 4131 1 1 20 THR HB H -5.322 1.252 -0.473 1.00 . A A . 20 THR HB 1 1 9 4132 1 1 20 THR HG1 H -2.920 0.781 0.948 1.00 . A A . 20 THR HG1 1 1 9 4133 1 1 20 THR HG21 H -4.033 -1.147 -1.311 1.00 . A A . 20 THR HG21 1 1 9 4134 1 1 20 THR HG22 H -5.664 -0.954 -0.676 1.00 . A A . 20 THR HG22 1 1 9 4135 1 1 20 THR HG23 H -4.323 -1.267 0.421 1.00 . A A . 20 THR HG23 1 1 9 4136 1 1 20 THR N N -2.125 0.505 -1.311 1.00 . A A . 20 THR N 1 1 9 4137 1 1 20 THR O O -2.753 3.139 -0.119 1.00 . A A . 20 THR O 1 1 9 4138 1 1 20 THR OG1 O -3.871 1.011 0.955 1.00 . A A . 20 THR OG1 1 1 9 4139 1 1 21 CYS C C -4.551 5.613 -2.393 1.00 . A A . 21 CYS C 1 1 9 4140 1 1 21 CYS CA C -3.211 4.924 -2.183 1.00 . A A . 21 CYS CA 1 1 9 4141 1 1 21 CYS CB C -2.194 5.384 -3.229 1.00 . A A . 21 CYS CB 1 1 9 4142 1 1 21 CYS H H -3.708 3.063 -3.087 1.00 . A A . 21 CYS H 1 1 9 4143 1 1 21 CYS HA H -2.843 5.184 -1.204 1.00 . A A . 21 CYS HA 1 1 9 4144 1 1 21 CYS HB2 H -2.099 4.631 -3.995 1.00 . A A . 21 CYS HB2 1 1 9 4145 1 1 21 CYS HB3 H -2.520 6.315 -3.671 1.00 . A A . 21 CYS HB3 1 1 9 4146 1 1 21 CYS N N -3.394 3.478 -2.248 1.00 . A A . 21 CYS N 1 1 9 4147 1 1 21 CYS O O -5.140 5.535 -3.473 1.00 . A A . 21 CYS O 1 1 9 4148 1 1 21 CYS SG S -0.597 5.629 -2.409 1.00 . A A . 21 CYS SG 1 1 9 4149 1 1 22 GLU C C -6.226 8.267 -0.653 1.00 . A A . 22 GLU C 1 1 9 4150 1 1 22 GLU CA C -6.308 6.941 -1.399 1.00 . A A . 22 GLU CA 1 1 9 4151 1 1 22 GLU CB C -7.406 6.041 -0.798 1.00 . A A . 22 GLU CB 1 1 9 4152 1 1 22 GLU CD C -6.591 3.770 -0.029 1.00 . A A . 22 GLU CD 1 1 9 4153 1 1 22 GLU CG C -6.851 5.223 0.386 1.00 . A A . 22 GLU CG 1 1 9 4154 1 1 22 GLU H H -4.537 6.294 -0.513 1.00 . A A . 22 GLU H 1 1 9 4155 1 1 22 GLU HA H -6.553 7.139 -2.433 1.00 . A A . 22 GLU HA 1 1 9 4156 1 1 22 GLU HB2 H -8.224 6.655 -0.455 1.00 . A A . 22 GLU HB2 1 1 9 4157 1 1 22 GLU HB3 H -7.763 5.365 -1.560 1.00 . A A . 22 GLU HB3 1 1 9 4158 1 1 22 GLU HG2 H -5.926 5.663 0.726 1.00 . A A . 22 GLU HG2 1 1 9 4159 1 1 22 GLU HG3 H -7.568 5.236 1.193 1.00 . A A . 22 GLU HG3 1 1 9 4160 1 1 22 GLU N N -5.038 6.268 -1.345 1.00 . A A . 22 GLU N 1 1 9 4161 1 1 22 GLU O O -5.753 8.342 0.478 1.00 . A A . 22 GLU O 1 1 9 4162 1 1 22 GLU OE1 O -5.899 3.565 -1.007 1.00 . A A . 22 GLU OE1 1 1 9 4163 1 1 22 GLU OE2 O -7.080 2.875 0.651 1.00 . A A . 22 GLU OE2 1 1 9 4164 1 1 23 ASN C C -5.334 11.024 -0.141 1.00 . A A . 23 ASN C 1 1 9 4165 1 1 23 ASN CA C -6.673 10.672 -0.792 1.00 . A A . 23 ASN CA 1 1 9 4166 1 1 23 ASN CB C -7.823 10.872 0.213 1.00 . A A . 23 ASN CB 1 1 9 4167 1 1 23 ASN CG C -8.151 9.578 0.946 1.00 . A A . 23 ASN CG 1 1 9 4168 1 1 23 ASN H H -7.003 9.141 -2.227 1.00 . A A . 23 ASN H 1 1 9 4169 1 1 23 ASN HA H -6.827 11.353 -1.616 1.00 . A A . 23 ASN HA 1 1 9 4170 1 1 23 ASN HB2 H -7.539 11.623 0.934 1.00 . A A . 23 ASN HB2 1 1 9 4171 1 1 23 ASN HB3 H -8.698 11.208 -0.320 1.00 . A A . 23 ASN HB3 1 1 9 4172 1 1 23 ASN HD21 H -9.320 8.885 -0.493 1.00 . A A . 23 ASN HD21 1 1 9 4173 1 1 23 ASN HD22 H -9.153 7.875 0.859 1.00 . A A . 23 ASN HD22 1 1 9 4174 1 1 23 ASN N N -6.675 9.302 -1.329 1.00 . A A . 23 ASN N 1 1 9 4175 1 1 23 ASN ND2 N -8.940 8.708 0.391 1.00 . A A . 23 ASN ND2 1 1 9 4176 1 1 23 ASN O O -5.287 11.502 0.993 1.00 . A A . 23 ASN O 1 1 9 4177 1 1 23 ASN OD1 O -7.691 9.361 2.064 1.00 . A A . 23 ASN OD1 1 1 9 4178 1 1 24 GLU C C -2.496 10.160 0.738 1.00 . A A . 24 GLU C 1 1 9 4179 1 1 24 GLU CA C -2.908 11.101 -0.393 1.00 . A A . 24 GLU CA 1 1 9 4180 1 1 24 GLU CB C -2.825 12.563 0.073 1.00 . A A . 24 GLU CB 1 1 9 4181 1 1 24 GLU CD C -2.972 13.017 -2.402 1.00 . A A . 24 GLU CD 1 1 9 4182 1 1 24 GLU CG C -3.397 13.491 -1.013 1.00 . A A . 24 GLU CG 1 1 9 4183 1 1 24 GLU H H -4.362 10.428 -1.780 1.00 . A A . 24 GLU H 1 1 9 4184 1 1 24 GLU HA H -2.216 10.968 -1.210 1.00 . A A . 24 GLU HA 1 1 9 4185 1 1 24 GLU HB2 H -3.392 12.683 0.985 1.00 . A A . 24 GLU HB2 1 1 9 4186 1 1 24 GLU HB3 H -1.793 12.822 0.257 1.00 . A A . 24 GLU HB3 1 1 9 4187 1 1 24 GLU HG2 H -4.475 13.491 -0.953 1.00 . A A . 24 GLU HG2 1 1 9 4188 1 1 24 GLU HG3 H -3.033 14.494 -0.854 1.00 . A A . 24 GLU HG3 1 1 9 4189 1 1 24 GLU N N -4.253 10.796 -0.879 1.00 . A A . 24 GLU N 1 1 9 4190 1 1 24 GLU O O -1.395 10.270 1.279 1.00 . A A . 24 GLU O 1 1 9 4191 1 1 24 GLU OE1 O -1.878 13.360 -2.814 1.00 . A A . 24 GLU OE1 1 1 9 4192 1 1 24 GLU OE2 O -3.747 12.312 -3.028 1.00 . A A . 24 GLU OE2 1 1 9 4193 1 1 25 VAL C C -2.706 6.914 1.523 1.00 . A A . 25 VAL C 1 1 9 4194 1 1 25 VAL CA C -3.081 8.262 2.138 1.00 . A A . 25 VAL CA 1 1 9 4195 1 1 25 VAL CB C -4.297 8.090 3.059 1.00 . A A . 25 VAL CB 1 1 9 4196 1 1 25 VAL CG1 C -3.952 7.119 4.189 1.00 . A A . 25 VAL CG1 1 1 9 4197 1 1 25 VAL CG2 C -4.681 9.443 3.663 1.00 . A A . 25 VAL CG2 1 1 9 4198 1 1 25 VAL H H -4.239 9.174 0.614 1.00 . A A . 25 VAL H 1 1 9 4199 1 1 25 VAL HA H -2.248 8.624 2.724 1.00 . A A . 25 VAL HA 1 1 9 4200 1 1 25 VAL HB H -5.129 7.698 2.490 1.00 . A A . 25 VAL HB 1 1 9 4201 1 1 25 VAL HG11 H -3.255 7.589 4.866 1.00 . A A . 25 VAL HG11 1 1 9 4202 1 1 25 VAL HG12 H -3.507 6.226 3.776 1.00 . A A . 25 VAL HG12 1 1 9 4203 1 1 25 VAL HG13 H -4.853 6.857 4.725 1.00 . A A . 25 VAL HG13 1 1 9 4204 1 1 25 VAL HG21 H -4.832 10.163 2.872 1.00 . A A . 25 VAL HG21 1 1 9 4205 1 1 25 VAL HG22 H -3.891 9.785 4.314 1.00 . A A . 25 VAL HG22 1 1 9 4206 1 1 25 VAL HG23 H -5.595 9.338 4.230 1.00 . A A . 25 VAL HG23 1 1 9 4207 1 1 25 VAL N N -3.377 9.225 1.083 1.00 . A A . 25 VAL N 1 1 9 4208 1 1 25 VAL O O -3.541 6.250 0.902 1.00 . A A . 25 VAL O 1 1 9 4209 1 1 26 CYS C C -0.850 4.197 2.232 1.00 . A A . 26 CYS C 1 1 9 4210 1 1 26 CYS CA C -0.968 5.257 1.139 1.00 . A A . 26 CYS CA 1 1 9 4211 1 1 26 CYS CB C 0.394 5.453 0.471 1.00 . A A . 26 CYS CB 1 1 9 4212 1 1 26 CYS H H -0.820 7.092 2.175 1.00 . A A . 26 CYS H 1 1 9 4213 1 1 26 CYS HA H -1.669 4.914 0.396 1.00 . A A . 26 CYS HA 1 1 9 4214 1 1 26 CYS HB2 H 0.431 4.872 -0.429 1.00 . A A . 26 CYS HB2 1 1 9 4215 1 1 26 CYS HB3 H 0.537 6.488 0.230 1.00 . A A . 26 CYS HB3 1 1 9 4216 1 1 26 CYS N N -1.444 6.521 1.686 1.00 . A A . 26 CYS N 1 1 9 4217 1 1 26 CYS O O -0.251 4.436 3.283 1.00 . A A . 26 CYS O 1 1 9 4218 1 1 26 CYS SG S 1.705 4.910 1.587 1.00 . A A . 26 CYS SG 1 1 9 4219 1 1 27 LYS C C -1.292 0.576 2.234 1.00 . A A . 27 LYS C 1 1 9 4220 1 1 27 LYS CA C -1.384 1.926 2.946 1.00 . A A . 27 LYS CA 1 1 9 4221 1 1 27 LYS CB C -2.646 1.932 3.822 1.00 . A A . 27 LYS CB 1 1 9 4222 1 1 27 LYS CD C -4.182 3.644 2.830 1.00 . A A . 27 LYS CD 1 1 9 4223 1 1 27 LYS CE C -5.486 2.893 3.091 1.00 . A A . 27 LYS CE 1 1 9 4224 1 1 27 LYS CG C -3.191 3.357 3.963 1.00 . A A . 27 LYS CG 1 1 9 4225 1 1 27 LYS H H -1.902 2.899 1.124 1.00 . A A . 27 LYS H 1 1 9 4226 1 1 27 LYS HA H -0.518 2.048 3.580 1.00 . A A . 27 LYS HA 1 1 9 4227 1 1 27 LYS HB2 H -3.400 1.305 3.365 1.00 . A A . 27 LYS HB2 1 1 9 4228 1 1 27 LYS HB3 H -2.406 1.542 4.800 1.00 . A A . 27 LYS HB3 1 1 9 4229 1 1 27 LYS HD2 H -4.381 4.703 2.784 1.00 . A A . 27 LYS HD2 1 1 9 4230 1 1 27 LYS HD3 H -3.765 3.318 1.892 1.00 . A A . 27 LYS HD3 1 1 9 4231 1 1 27 LYS HE2 H -5.477 2.488 4.094 1.00 . A A . 27 LYS HE2 1 1 9 4232 1 1 27 LYS HE3 H -6.319 3.575 2.989 1.00 . A A . 27 LYS HE3 1 1 9 4233 1 1 27 LYS HG2 H -3.692 3.455 4.913 1.00 . A A . 27 LYS HG2 1 1 9 4234 1 1 27 LYS HG3 H -2.379 4.063 3.915 1.00 . A A . 27 LYS HG3 1 1 9 4235 1 1 27 LYS HZ1 H -4.717 1.644 1.583 1.00 . A A . 27 LYS HZ1 1 1 9 4236 1 1 27 LYS HZ2 H -6.392 2.036 1.414 1.00 . A A . 27 LYS HZ2 1 1 9 4237 1 1 27 LYS HZ3 H -5.866 0.897 2.614 1.00 . A A . 27 LYS HZ3 1 1 9 4238 1 1 27 LYS N N -1.428 3.025 1.978 1.00 . A A . 27 LYS N 1 1 9 4239 1 1 27 LYS NZ N -5.627 1.786 2.107 1.00 . A A . 27 LYS NZ 1 1 9 4240 1 1 27 LYS O O -1.651 0.458 1.060 1.00 . A A . 27 LYS O 1 1 9 4241 1 1 28 CYS C C -1.975 -2.595 2.822 1.00 . A A . 28 CYS C 1 1 9 4242 1 1 28 CYS CA C -0.751 -1.789 2.392 1.00 . A A . 28 CYS CA 1 1 9 4243 1 1 28 CYS CB C 0.533 -2.481 2.866 1.00 . A A . 28 CYS CB 1 1 9 4244 1 1 28 CYS H H -0.598 -0.297 3.892 1.00 . A A . 28 CYS H 1 1 9 4245 1 1 28 CYS HA H -0.736 -1.717 1.317 1.00 . A A . 28 CYS HA 1 1 9 4246 1 1 28 CYS HB2 H 1.256 -1.736 3.162 1.00 . A A . 28 CYS HB2 1 1 9 4247 1 1 28 CYS HB3 H 0.311 -3.120 3.708 1.00 . A A . 28 CYS HB3 1 1 9 4248 1 1 28 CYS N N -0.845 -0.444 2.957 1.00 . A A . 28 CYS N 1 1 9 4249 1 1 28 CYS O O -1.999 -3.171 3.913 1.00 . A A . 28 CYS O 1 1 9 4250 1 1 28 CYS SG S 1.210 -3.477 1.513 1.00 . A A . 28 CYS SG 1 1 9 4251 1 1 29 ASN C C -4.827 -4.062 1.114 1.00 . A A . 29 ASN C 1 1 9 4252 1 1 29 ASN CA C -4.247 -3.316 2.316 1.00 . A A . 29 ASN CA 1 1 9 4253 1 1 29 ASN CB C -5.319 -2.343 2.836 1.00 . A A . 29 ASN CB 1 1 9 4254 1 1 29 ASN CG C -4.710 -1.153 3.565 1.00 . A A . 29 ASN CG 1 1 9 4255 1 1 29 ASN H H -2.943 -2.111 1.135 1.00 . A A . 29 ASN H 1 1 9 4256 1 1 29 ASN HA H -4.033 -4.033 3.093 1.00 . A A . 29 ASN HA 1 1 9 4257 1 1 29 ASN HB2 H -5.897 -1.976 2.002 1.00 . A A . 29 ASN HB2 1 1 9 4258 1 1 29 ASN HB3 H -5.974 -2.869 3.513 1.00 . A A . 29 ASN HB3 1 1 9 4259 1 1 29 ASN HD21 H -3.288 -2.211 4.458 1.00 . A A . 29 ASN HD21 1 1 9 4260 1 1 29 ASN HD22 H -3.300 -0.549 4.814 1.00 . A A . 29 ASN HD22 1 1 9 4261 1 1 29 ASN N N -3.008 -2.605 1.982 1.00 . A A . 29 ASN N 1 1 9 4262 1 1 29 ASN ND2 N -3.680 -1.315 4.342 1.00 . A A . 29 ASN ND2 1 1 9 4263 1 1 29 ASN O O -4.814 -3.571 -0.014 1.00 . A A . 29 ASN O 1 1 9 4264 1 1 29 ASN OD1 O -5.206 -0.038 3.428 1.00 . A A . 29 ASN OD1 1 1 9 4265 1 1 30 ILE C C -7.419 -5.589 0.076 1.00 . A A . 30 ILE C 1 1 9 4266 1 1 30 ILE CA C -5.996 -6.060 0.349 1.00 . A A . 30 ILE CA 1 1 9 4267 1 1 30 ILE CB C -6.018 -7.547 0.745 1.00 . A A . 30 ILE CB 1 1 9 4268 1 1 30 ILE CD1 C -4.271 -7.372 2.524 1.00 . A A . 30 ILE CD1 1 1 9 4269 1 1 30 ILE CG1 C -5.740 -7.705 2.243 1.00 . A A . 30 ILE CG1 1 1 9 4270 1 1 30 ILE CG2 C -4.976 -8.319 -0.060 1.00 . A A . 30 ILE CG2 1 1 9 4271 1 1 30 ILE H H -5.367 -5.562 2.309 1.00 . A A . 30 ILE H 1 1 9 4272 1 1 30 ILE HA H -5.425 -5.956 -0.562 1.00 . A A . 30 ILE HA 1 1 9 4273 1 1 30 ILE HB H -6.994 -7.953 0.525 1.00 . A A . 30 ILE HB 1 1 9 4274 1 1 30 ILE HD11 H -4.205 -6.720 3.379 1.00 . A A . 30 ILE HD11 1 1 9 4275 1 1 30 ILE HD12 H -3.843 -6.881 1.662 1.00 . A A . 30 ILE HD12 1 1 9 4276 1 1 30 ILE HD13 H -3.729 -8.284 2.720 1.00 . A A . 30 ILE HD13 1 1 9 4277 1 1 30 ILE HG12 H -6.379 -7.038 2.803 1.00 . A A . 30 ILE HG12 1 1 9 4278 1 1 30 ILE HG13 H -5.937 -8.725 2.538 1.00 . A A . 30 ILE HG13 1 1 9 4279 1 1 30 ILE HG21 H -5.091 -8.095 -1.111 1.00 . A A . 30 ILE HG21 1 1 9 4280 1 1 30 ILE HG22 H -5.109 -9.379 0.100 1.00 . A A . 30 ILE HG22 1 1 9 4281 1 1 30 ILE HG23 H -3.994 -8.030 0.264 1.00 . A A . 30 ILE HG23 1 1 9 4282 1 1 30 ILE N N -5.366 -5.242 1.383 1.00 . A A . 30 ILE N 1 1 9 4283 1 1 30 ILE O O -8.152 -5.217 0.992 1.00 . A A . 30 ILE O 1 1 9 4284 1 1 31 GLY C C -9.185 -3.970 -2.451 1.00 . A A . 31 GLY C 1 1 9 4285 1 1 31 GLY CA C -9.156 -5.236 -1.597 1.00 . A A . 31 GLY CA 1 1 9 4286 1 1 31 GLY H H -7.177 -5.961 -1.864 1.00 . A A . 31 GLY H 1 1 9 4287 1 1 31 GLY HA2 H -9.607 -6.041 -2.156 1.00 . A A . 31 GLY HA2 1 1 9 4288 1 1 31 GLY HA3 H -9.740 -5.061 -0.710 1.00 . A A . 31 GLY HA3 1 1 9 4289 1 1 31 GLY N N -7.806 -5.635 -1.193 1.00 . A A . 31 GLY N 1 1 9 4290 1 1 31 GLY O O -10.157 -3.734 -3.167 1.00 . A A . 31 GLY O 1 1 9 4291 1 1 32 LYS C C -6.711 -1.664 -3.756 1.00 . A A . 32 LYS C 1 1 9 4292 1 1 32 LYS CA C -8.105 -1.928 -3.180 1.00 . A A . 32 LYS CA 1 1 9 4293 1 1 32 LYS CB C -8.541 -0.754 -2.298 1.00 . A A . 32 LYS CB 1 1 9 4294 1 1 32 LYS CD C -7.605 1.561 -2.518 1.00 . A A . 32 LYS CD 1 1 9 4295 1 1 32 LYS CE C -6.751 2.173 -3.627 1.00 . A A . 32 LYS CE 1 1 9 4296 1 1 32 LYS CG C -8.577 0.540 -3.121 1.00 . A A . 32 LYS CG 1 1 9 4297 1 1 32 LYS H H -7.389 -3.383 -1.800 1.00 . A A . 32 LYS H 1 1 9 4298 1 1 32 LYS HA H -8.805 -2.024 -3.995 1.00 . A A . 32 LYS HA 1 1 9 4299 1 1 32 LYS HB2 H -9.527 -0.952 -1.901 1.00 . A A . 32 LYS HB2 1 1 9 4300 1 1 32 LYS HB3 H -7.845 -0.641 -1.480 1.00 . A A . 32 LYS HB3 1 1 9 4301 1 1 32 LYS HD2 H -8.164 2.342 -2.023 1.00 . A A . 32 LYS HD2 1 1 9 4302 1 1 32 LYS HD3 H -6.962 1.073 -1.801 1.00 . A A . 32 LYS HD3 1 1 9 4303 1 1 32 LYS HE2 H -7.393 2.542 -4.415 1.00 . A A . 32 LYS HE2 1 1 9 4304 1 1 32 LYS HE3 H -6.168 2.991 -3.226 1.00 . A A . 32 LYS HE3 1 1 9 4305 1 1 32 LYS HG2 H -8.293 0.326 -4.142 1.00 . A A . 32 LYS HG2 1 1 9 4306 1 1 32 LYS HG3 H -9.577 0.947 -3.106 1.00 . A A . 32 LYS HG3 1 1 9 4307 1 1 32 LYS HZ1 H -6.168 0.841 -5.129 1.00 . A A . 32 LYS HZ1 1 1 9 4308 1 1 32 LYS HZ2 H -5.822 0.293 -3.539 1.00 . A A . 32 LYS HZ2 1 1 9 4309 1 1 32 LYS HZ3 H -4.853 1.535 -4.255 1.00 . A A . 32 LYS HZ3 1 1 9 4310 1 1 32 LYS N N -8.138 -3.158 -2.384 1.00 . A A . 32 LYS N 1 1 9 4311 1 1 32 LYS NZ N -5.837 1.131 -4.174 1.00 . A A . 32 LYS NZ 1 1 9 4312 1 1 32 LYS O O -5.853 -1.068 -3.099 1.00 . A A . 32 LYS O 1 1 9 4313 1 1 33 LYS C C -5.091 -0.433 -6.182 1.00 . A A . 33 LYS C 1 1 9 4314 1 1 33 LYS CA C -5.217 -1.868 -5.676 1.00 . A A . 33 LYS CA 1 1 9 4315 1 1 33 LYS CB C -5.079 -2.849 -6.849 1.00 . A A . 33 LYS CB 1 1 9 4316 1 1 33 LYS CD C -5.009 -1.727 -9.097 1.00 . A A . 33 LYS CD 1 1 9 4317 1 1 33 LYS CE C -5.683 -0.481 -9.681 1.00 . A A . 33 LYS CE 1 1 9 4318 1 1 33 LYS CG C -5.922 -2.368 -8.042 1.00 . A A . 33 LYS CG 1 1 9 4319 1 1 33 LYS H H -7.232 -2.516 -5.491 1.00 . A A . 33 LYS H 1 1 9 4320 1 1 33 LYS HA H -4.419 -2.057 -4.969 1.00 . A A . 33 LYS HA 1 1 9 4321 1 1 33 LYS HB2 H -4.041 -2.913 -7.143 1.00 . A A . 33 LYS HB2 1 1 9 4322 1 1 33 LYS HB3 H -5.423 -3.825 -6.541 1.00 . A A . 33 LYS HB3 1 1 9 4323 1 1 33 LYS HD2 H -4.071 -1.445 -8.640 1.00 . A A . 33 LYS HD2 1 1 9 4324 1 1 33 LYS HD3 H -4.823 -2.436 -9.890 1.00 . A A . 33 LYS HD3 1 1 9 4325 1 1 33 LYS HE2 H -6.496 -0.781 -10.328 1.00 . A A . 33 LYS HE2 1 1 9 4326 1 1 33 LYS HE3 H -6.070 0.130 -8.876 1.00 . A A . 33 LYS HE3 1 1 9 4327 1 1 33 LYS HG2 H -6.438 -3.212 -8.478 1.00 . A A . 33 LYS HG2 1 1 9 4328 1 1 33 LYS HG3 H -6.647 -1.643 -7.703 1.00 . A A . 33 LYS HG3 1 1 9 4329 1 1 33 LYS HZ1 H -5.016 0.438 -11.434 1.00 . A A . 33 LYS HZ1 1 1 9 4330 1 1 33 LYS HZ2 H -3.774 -0.210 -10.473 1.00 . A A . 33 LYS HZ2 1 1 9 4331 1 1 33 LYS HZ3 H -4.532 1.244 -9.997 1.00 . A A . 33 LYS HZ3 1 1 9 4332 1 1 33 LYS N N -6.505 -2.074 -5.006 1.00 . A A . 33 LYS N 1 1 9 4333 1 1 33 LYS NZ N -4.681 0.298 -10.462 1.00 . A A . 33 LYS NZ 1 1 9 4334 1 1 33 LYS O O -6.092 0.284 -6.300 1.00 . A A . 33 LYS O 1 1 9 4335 1 1 34 ASP C C -3.402 1.327 -8.454 1.00 . A A . 34 ASP C 1 1 9 4336 1 1 34 ASP CA C -3.613 1.339 -6.940 1.00 . A A . 34 ASP CA 1 1 9 4337 1 1 34 ASP CB C -2.377 1.920 -6.246 1.00 . A A . 34 ASP CB 1 1 9 4338 1 1 34 ASP CG C -2.632 2.104 -4.753 1.00 . A A . 34 ASP CG 1 1 9 4339 1 1 34 ASP H H -3.107 -0.621 -6.328 1.00 . A A . 34 ASP H 1 1 9 4340 1 1 34 ASP HA H -4.466 1.960 -6.712 1.00 . A A . 34 ASP HA 1 1 9 4341 1 1 34 ASP HB2 H -1.542 1.248 -6.384 1.00 . A A . 34 ASP HB2 1 1 9 4342 1 1 34 ASP HB3 H -2.139 2.876 -6.685 1.00 . A A . 34 ASP HB3 1 1 9 4343 1 1 34 ASP N N -3.862 -0.013 -6.457 1.00 . A A . 34 ASP N 1 1 9 4344 1 1 34 ASP O O -2.619 0.516 -8.925 1.00 . A A . 34 ASP O 1 1 9 4345 1 1 34 ASP OXT O -4.056 2.109 -9.132 1.00 . A A . 34 ASP OXT 1 1 9 4346 1 1 34 ASP OD1 O -3.790 2.172 -4.363 1.00 . A A . 34 ASP OD1 1 1 9 4347 1 1 34 ASP OD2 O -1.667 2.185 -4.017 1.00 . A A . 34 ASP OD2 1 1 10 4348 1 1 1 GLY C C 11.536 9.047 -0.994 1.00 . A A . 1 GLY C 1 1 10 4349 1 1 1 GLY CA C 12.181 8.771 0.362 1.00 . A A . 1 GLY CA 1 1 10 4350 1 1 1 GLY H1 H 11.577 8.096 2.242 1.00 . A A . 1 GLY H1 1 1 10 4351 1 1 1 GLY H2 H 10.934 7.195 0.944 1.00 . A A . 1 GLY H2 1 1 10 4352 1 1 1 GLY H3 H 10.317 8.742 1.307 1.00 . A A . 1 GLY H3 1 1 10 4353 1 1 1 GLY HA2 H 12.540 9.700 0.784 1.00 . A A . 1 GLY HA2 1 1 10 4354 1 1 1 GLY HA3 H 13.010 8.092 0.229 1.00 . A A . 1 GLY HA3 1 1 10 4355 1 1 1 GLY N N 11.180 8.159 1.285 1.00 . A A . 1 GLY N 1 1 10 4356 1 1 1 GLY O O 11.770 10.093 -1.595 1.00 . A A . 1 GLY O 1 1 10 4357 1 1 2 SER C C 8.568 8.580 -2.566 1.00 . A A . 2 SER C 1 1 10 4358 1 1 2 SER CA C 10.050 8.258 -2.758 1.00 . A A . 2 SER CA 1 1 10 4359 1 1 2 SER CB C 10.188 6.973 -3.577 1.00 . A A . 2 SER CB 1 1 10 4360 1 1 2 SER H H 10.575 7.280 -0.937 1.00 . A A . 2 SER H 1 1 10 4361 1 1 2 SER HA H 10.513 9.067 -3.303 1.00 . A A . 2 SER HA 1 1 10 4362 1 1 2 SER HB2 H 11.217 6.837 -3.867 1.00 . A A . 2 SER HB2 1 1 10 4363 1 1 2 SER HB3 H 9.872 6.130 -2.975 1.00 . A A . 2 SER HB3 1 1 10 4364 1 1 2 SER HG H 9.796 6.557 -5.447 1.00 . A A . 2 SER HG 1 1 10 4365 1 1 2 SER N N 10.725 8.104 -1.468 1.00 . A A . 2 SER N 1 1 10 4366 1 1 2 SER O O 8.159 9.089 -1.521 1.00 . A A . 2 SER O 1 1 10 4367 1 1 2 SER OG O 9.377 7.070 -4.747 1.00 . A A . 2 SER OG 1 1 10 4368 1 1 3 VAL C C 5.643 7.468 -2.667 1.00 . A A . 3 VAL C 1 1 10 4369 1 1 3 VAL CA C 6.337 8.522 -3.530 1.00 . A A . 3 VAL CA 1 1 10 4370 1 1 3 VAL CB C 5.751 8.506 -4.946 1.00 . A A . 3 VAL CB 1 1 10 4371 1 1 3 VAL CG1 C 6.208 9.755 -5.704 1.00 . A A . 3 VAL CG1 1 1 10 4372 1 1 3 VAL CG2 C 6.229 7.259 -5.698 1.00 . A A . 3 VAL CG2 1 1 10 4373 1 1 3 VAL H H 8.164 7.861 -4.389 1.00 . A A . 3 VAL H 1 1 10 4374 1 1 3 VAL HA H 6.167 9.495 -3.094 1.00 . A A . 3 VAL HA 1 1 10 4375 1 1 3 VAL HB H 4.674 8.499 -4.886 1.00 . A A . 3 VAL HB 1 1 10 4376 1 1 3 VAL HG11 H 5.571 9.908 -6.564 1.00 . A A . 3 VAL HG11 1 1 10 4377 1 1 3 VAL HG12 H 7.228 9.623 -6.033 1.00 . A A . 3 VAL HG12 1 1 10 4378 1 1 3 VAL HG13 H 6.148 10.615 -5.054 1.00 . A A . 3 VAL HG13 1 1 10 4379 1 1 3 VAL HG21 H 6.783 7.556 -6.575 1.00 . A A . 3 VAL HG21 1 1 10 4380 1 1 3 VAL HG22 H 5.375 6.668 -5.995 1.00 . A A . 3 VAL HG22 1 1 10 4381 1 1 3 VAL HG23 H 6.865 6.671 -5.055 1.00 . A A . 3 VAL HG23 1 1 10 4382 1 1 3 VAL N N 7.772 8.273 -3.582 1.00 . A A . 3 VAL N 1 1 10 4383 1 1 3 VAL O O 5.737 6.270 -2.936 1.00 . A A . 3 VAL O 1 1 10 4384 1 1 4 GLY C C 3.801 5.735 -1.371 1.00 . A A . 4 GLY C 1 1 10 4385 1 1 4 GLY CA C 4.251 7.033 -0.700 1.00 . A A . 4 GLY CA 1 1 10 4386 1 1 4 GLY H H 4.932 8.893 -1.461 1.00 . A A . 4 GLY H 1 1 10 4387 1 1 4 GLY HA2 H 4.910 6.788 0.121 1.00 . A A . 4 GLY HA2 1 1 10 4388 1 1 4 GLY HA3 H 3.383 7.543 -0.311 1.00 . A A . 4 GLY HA3 1 1 10 4389 1 1 4 GLY N N 4.958 7.927 -1.623 1.00 . A A . 4 GLY N 1 1 10 4390 1 1 4 GLY O O 4.147 4.649 -0.919 1.00 . A A . 4 GLY O 1 1 10 4391 1 1 5 CYS C C 3.637 3.695 -3.505 1.00 . A A . 5 CYS C 1 1 10 4392 1 1 5 CYS CA C 2.520 4.680 -3.159 1.00 . A A . 5 CYS CA 1 1 10 4393 1 1 5 CYS CB C 1.806 5.120 -4.437 1.00 . A A . 5 CYS CB 1 1 10 4394 1 1 5 CYS H H 2.775 6.742 -2.757 1.00 . A A . 5 CYS H 1 1 10 4395 1 1 5 CYS HA H 1.810 4.176 -2.521 1.00 . A A . 5 CYS HA 1 1 10 4396 1 1 5 CYS HB2 H 2.524 5.542 -5.126 1.00 . A A . 5 CYS HB2 1 1 10 4397 1 1 5 CYS HB3 H 1.332 4.269 -4.892 1.00 . A A . 5 CYS HB3 1 1 10 4398 1 1 5 CYS N N 3.024 5.853 -2.444 1.00 . A A . 5 CYS N 1 1 10 4399 1 1 5 CYS O O 3.387 2.502 -3.652 1.00 . A A . 5 CYS O 1 1 10 4400 1 1 5 CYS SG S 0.557 6.366 -4.031 1.00 . A A . 5 CYS SG 1 1 10 4401 1 1 6 ALA C C 6.571 2.768 -2.621 1.00 . A A . 6 ALA C 1 1 10 4402 1 1 6 ALA CA C 6.000 3.327 -3.921 1.00 . A A . 6 ALA CA 1 1 10 4403 1 1 6 ALA CB C 7.071 4.129 -4.660 1.00 . A A . 6 ALA CB 1 1 10 4404 1 1 6 ALA H H 5.011 5.154 -3.474 1.00 . A A . 6 ALA H 1 1 10 4405 1 1 6 ALA HA H 5.673 2.510 -4.545 1.00 . A A . 6 ALA HA 1 1 10 4406 1 1 6 ALA HB1 H 7.426 4.927 -4.022 1.00 . A A . 6 ALA HB1 1 1 10 4407 1 1 6 ALA HB2 H 6.649 4.548 -5.561 1.00 . A A . 6 ALA HB2 1 1 10 4408 1 1 6 ALA HB3 H 7.895 3.480 -4.915 1.00 . A A . 6 ALA HB3 1 1 10 4409 1 1 6 ALA N N 4.862 4.190 -3.617 1.00 . A A . 6 ALA N 1 1 10 4410 1 1 6 ALA O O 6.873 1.575 -2.503 1.00 . A A . 6 ALA O 1 1 10 4411 1 1 7 GLU C C 6.169 2.384 0.381 1.00 . A A . 7 GLU C 1 1 10 4412 1 1 7 GLU CA C 7.195 3.258 -0.333 1.00 . A A . 7 GLU CA 1 1 10 4413 1 1 7 GLU CB C 7.493 4.511 0.493 1.00 . A A . 7 GLU CB 1 1 10 4414 1 1 7 GLU CD C 9.224 6.325 0.413 1.00 . A A . 7 GLU CD 1 1 10 4415 1 1 7 GLU CG C 8.209 5.533 -0.396 1.00 . A A . 7 GLU CG 1 1 10 4416 1 1 7 GLU H H 6.412 4.574 -1.792 1.00 . A A . 7 GLU H 1 1 10 4417 1 1 7 GLU HA H 8.108 2.702 -0.463 1.00 . A A . 7 GLU HA 1 1 10 4418 1 1 7 GLU HB2 H 6.568 4.932 0.860 1.00 . A A . 7 GLU HB2 1 1 10 4419 1 1 7 GLU HB3 H 8.128 4.251 1.327 1.00 . A A . 7 GLU HB3 1 1 10 4420 1 1 7 GLU HG2 H 8.720 5.014 -1.194 1.00 . A A . 7 GLU HG2 1 1 10 4421 1 1 7 GLU HG3 H 7.484 6.210 -0.818 1.00 . A A . 7 GLU HG3 1 1 10 4422 1 1 7 GLU N N 6.688 3.646 -1.639 1.00 . A A . 7 GLU N 1 1 10 4423 1 1 7 GLU O O 6.521 1.472 1.130 1.00 . A A . 7 GLU O 1 1 10 4424 1 1 7 GLU OE1 O 8.825 7.004 1.340 1.00 . A A . 7 GLU OE1 1 1 10 4425 1 1 7 GLU OE2 O 10.398 6.258 0.084 1.00 . A A . 7 GLU OE2 1 1 10 4426 1 1 8 CYS C C 4.045 0.417 0.607 1.00 . A A . 8 CYS C 1 1 10 4427 1 1 8 CYS CA C 3.805 1.918 0.745 1.00 . A A . 8 CYS CA 1 1 10 4428 1 1 8 CYS CB C 2.458 2.311 0.133 1.00 . A A . 8 CYS CB 1 1 10 4429 1 1 8 CYS H H 4.678 3.415 -0.475 1.00 . A A . 8 CYS H 1 1 10 4430 1 1 8 CYS HA H 3.778 2.164 1.790 1.00 . A A . 8 CYS HA 1 1 10 4431 1 1 8 CYS HB2 H 2.585 3.175 -0.501 1.00 . A A . 8 CYS HB2 1 1 10 4432 1 1 8 CYS HB3 H 2.057 1.501 -0.445 1.00 . A A . 8 CYS HB3 1 1 10 4433 1 1 8 CYS N N 4.892 2.673 0.133 1.00 . A A . 8 CYS N 1 1 10 4434 1 1 8 CYS O O 4.155 -0.290 1.610 1.00 . A A . 8 CYS O 1 1 10 4435 1 1 8 CYS SG S 1.319 2.710 1.472 1.00 . A A . 8 CYS SG 1 1 10 4436 1 1 9 PRO C C 5.776 -1.911 -0.221 1.00 . A A . 9 PRO C 1 1 10 4437 1 1 9 PRO CA C 4.432 -1.531 -0.828 1.00 . A A . 9 PRO CA 1 1 10 4438 1 1 9 PRO CB C 4.436 -1.692 -2.354 1.00 . A A . 9 PRO CB 1 1 10 4439 1 1 9 PRO CD C 4.051 0.653 -1.866 1.00 . A A . 9 PRO CD 1 1 10 4440 1 1 9 PRO CG C 4.606 -0.316 -2.909 1.00 . A A . 9 PRO CG 1 1 10 4441 1 1 9 PRO HA H 3.645 -2.131 -0.399 1.00 . A A . 9 PRO HA 1 1 10 4442 1 1 9 PRO HB2 H 5.258 -2.325 -2.660 1.00 . A A . 9 PRO HB2 1 1 10 4443 1 1 9 PRO HB3 H 3.498 -2.109 -2.687 1.00 . A A . 9 PRO HB3 1 1 10 4444 1 1 9 PRO HD2 H 4.643 1.555 -1.837 1.00 . A A . 9 PRO HD2 1 1 10 4445 1 1 9 PRO HD3 H 3.018 0.882 -2.077 1.00 . A A . 9 PRO HD3 1 1 10 4446 1 1 9 PRO HG2 H 5.654 -0.119 -3.085 1.00 . A A . 9 PRO HG2 1 1 10 4447 1 1 9 PRO HG3 H 4.050 -0.216 -3.827 1.00 . A A . 9 PRO HG3 1 1 10 4448 1 1 9 PRO N N 4.161 -0.085 -0.603 1.00 . A A . 9 PRO N 1 1 10 4449 1 1 9 PRO O O 5.902 -2.940 0.446 1.00 . A A . 9 PRO O 1 1 10 4450 1 1 10 MET C C 7.976 -1.483 1.643 1.00 . A A . 10 MET C 1 1 10 4451 1 1 10 MET CA C 8.096 -1.287 0.137 1.00 . A A . 10 MET CA 1 1 10 4452 1 1 10 MET CB C 9.010 -0.099 -0.164 1.00 . A A . 10 MET CB 1 1 10 4453 1 1 10 MET CE C 11.767 0.024 -3.179 1.00 . A A . 10 MET CE 1 1 10 4454 1 1 10 MET CG C 9.596 -0.242 -1.570 1.00 . A A . 10 MET CG 1 1 10 4455 1 1 10 MET H H 6.610 -0.229 -0.947 1.00 . A A . 10 MET H 1 1 10 4456 1 1 10 MET HA H 8.517 -2.180 -0.302 1.00 . A A . 10 MET HA 1 1 10 4457 1 1 10 MET HB2 H 8.440 0.814 -0.102 1.00 . A A . 10 MET HB2 1 1 10 4458 1 1 10 MET HB3 H 9.812 -0.070 0.557 1.00 . A A . 10 MET HB3 1 1 10 4459 1 1 10 MET HE1 H 12.833 -0.040 -3.338 1.00 . A A . 10 MET HE1 1 1 10 4460 1 1 10 MET HE2 H 11.424 1.025 -3.399 1.00 . A A . 10 MET HE2 1 1 10 4461 1 1 10 MET HE3 H 11.266 -0.677 -3.829 1.00 . A A . 10 MET HE3 1 1 10 4462 1 1 10 MET HG2 H 9.199 -1.130 -2.040 1.00 . A A . 10 MET HG2 1 1 10 4463 1 1 10 MET HG3 H 9.335 0.624 -2.159 1.00 . A A . 10 MET HG3 1 1 10 4464 1 1 10 MET N N 6.774 -1.049 -0.427 1.00 . A A . 10 MET N 1 1 10 4465 1 1 10 MET O O 8.736 -2.238 2.248 1.00 . A A . 10 MET O 1 1 10 4466 1 1 10 MET SD S 11.397 -0.374 -1.454 1.00 . A A . 10 MET SD 1 1 10 4467 1 1 11 HIS C C 5.816 -2.094 3.962 1.00 . A A . 11 HIS C 1 1 10 4468 1 1 11 HIS CA C 6.760 -0.925 3.674 1.00 . A A . 11 HIS CA 1 1 10 4469 1 1 11 HIS CB C 6.167 0.377 4.223 1.00 . A A . 11 HIS CB 1 1 10 4470 1 1 11 HIS CD2 C 6.573 1.622 6.503 1.00 . A A . 11 HIS CD2 1 1 10 4471 1 1 11 HIS CE1 C 7.165 -0.084 7.703 1.00 . A A . 11 HIS CE1 1 1 10 4472 1 1 11 HIS CG C 6.531 0.526 5.679 1.00 . A A . 11 HIS CG 1 1 10 4473 1 1 11 HIS H H 6.410 -0.228 1.700 1.00 . A A . 11 HIS H 1 1 10 4474 1 1 11 HIS HA H 7.702 -1.112 4.167 1.00 . A A . 11 HIS HA 1 1 10 4475 1 1 11 HIS HB2 H 6.562 1.214 3.666 1.00 . A A . 11 HIS HB2 1 1 10 4476 1 1 11 HIS HB3 H 5.092 0.355 4.122 1.00 . A A . 11 HIS HB3 1 1 10 4477 1 1 11 HIS HD2 H 6.332 2.633 6.206 1.00 . A A . 11 HIS HD2 1 1 10 4478 1 1 11 HIS HE1 H 7.485 -0.698 8.532 1.00 . A A . 11 HIS HE1 1 1 10 4479 1 1 11 HIS HE2 H 7.087 1.810 8.566 1.00 . A A . 11 HIS HE2 1 1 10 4480 1 1 11 HIS N N 6.995 -0.808 2.240 1.00 . A A . 11 HIS N 1 1 10 4481 1 1 11 HIS ND1 N 6.913 -0.553 6.467 1.00 . A A . 11 HIS ND1 1 1 10 4482 1 1 11 HIS NE2 N 6.973 1.236 7.779 1.00 . A A . 11 HIS NE2 1 1 10 4483 1 1 11 HIS O O 5.285 -2.229 5.070 1.00 . A A . 11 HIS O 1 1 10 4484 1 1 12 CYS C C 5.651 -5.331 3.489 1.00 . A A . 12 CYS C 1 1 10 4485 1 1 12 CYS CA C 4.781 -4.133 3.138 1.00 . A A . 12 CYS CA 1 1 10 4486 1 1 12 CYS CB C 3.979 -4.418 1.871 1.00 . A A . 12 CYS CB 1 1 10 4487 1 1 12 CYS H H 6.099 -2.821 2.113 1.00 . A A . 12 CYS H 1 1 10 4488 1 1 12 CYS HA H 4.091 -3.949 3.952 1.00 . A A . 12 CYS HA 1 1 10 4489 1 1 12 CYS HB2 H 3.962 -3.538 1.251 1.00 . A A . 12 CYS HB2 1 1 10 4490 1 1 12 CYS HB3 H 4.435 -5.234 1.331 1.00 . A A . 12 CYS HB3 1 1 10 4491 1 1 12 CYS N N 5.636 -2.962 2.970 1.00 . A A . 12 CYS N 1 1 10 4492 1 1 12 CYS O O 6.779 -5.449 3.017 1.00 . A A . 12 CYS O 1 1 10 4493 1 1 12 CYS SG S 2.283 -4.869 2.323 1.00 . A A . 12 CYS SG 1 1 10 4494 1 1 13 LYS C C 5.527 -8.621 4.102 1.00 . A A . 13 LYS C 1 1 10 4495 1 1 13 LYS CA C 5.911 -7.331 4.837 1.00 . A A . 13 LYS CA 1 1 10 4496 1 1 13 LYS CB C 5.704 -7.494 6.351 1.00 . A A . 13 LYS CB 1 1 10 4497 1 1 13 LYS CD C 6.983 -5.499 7.239 1.00 . A A . 13 LYS CD 1 1 10 4498 1 1 13 LYS CE C 7.175 -4.269 6.336 1.00 . A A . 13 LYS CE 1 1 10 4499 1 1 13 LYS CG C 5.587 -6.111 7.026 1.00 . A A . 13 LYS CG 1 1 10 4500 1 1 13 LYS H H 4.258 -6.005 4.737 1.00 . A A . 13 LYS H 1 1 10 4501 1 1 13 LYS HA H 6.959 -7.141 4.659 1.00 . A A . 13 LYS HA 1 1 10 4502 1 1 13 LYS HB2 H 4.797 -8.058 6.528 1.00 . A A . 13 LYS HB2 1 1 10 4503 1 1 13 LYS HB3 H 6.543 -8.028 6.772 1.00 . A A . 13 LYS HB3 1 1 10 4504 1 1 13 LYS HD2 H 7.089 -5.201 8.273 1.00 . A A . 13 LYS HD2 1 1 10 4505 1 1 13 LYS HD3 H 7.738 -6.234 7.003 1.00 . A A . 13 LYS HD3 1 1 10 4506 1 1 13 LYS HE2 H 8.223 -4.007 6.307 1.00 . A A . 13 LYS HE2 1 1 10 4507 1 1 13 LYS HE3 H 6.839 -4.502 5.338 1.00 . A A . 13 LYS HE3 1 1 10 4508 1 1 13 LYS HG2 H 4.993 -5.454 6.409 1.00 . A A . 13 LYS HG2 1 1 10 4509 1 1 13 LYS HG3 H 5.102 -6.228 7.986 1.00 . A A . 13 LYS HG3 1 1 10 4510 1 1 13 LYS HZ1 H 7.036 -2.391 7.248 1.00 . A A . 13 LYS HZ1 1 1 10 4511 1 1 13 LYS HZ2 H 5.761 -3.445 7.633 1.00 . A A . 13 LYS HZ2 1 1 10 4512 1 1 13 LYS HZ3 H 5.807 -2.689 6.099 1.00 . A A . 13 LYS HZ3 1 1 10 4513 1 1 13 LYS N N 5.147 -6.178 4.367 1.00 . A A . 13 LYS N 1 1 10 4514 1 1 13 LYS NZ N 6.388 -3.116 6.873 1.00 . A A . 13 LYS NZ 1 1 10 4515 1 1 13 LYS O O 4.361 -8.849 3.774 1.00 . A A . 13 LYS O 1 1 10 4516 1 1 14 GLY C C 5.089 -11.451 3.547 1.00 . A A . 14 GLY C 1 1 10 4517 1 1 14 GLY CA C 6.366 -10.724 3.132 1.00 . A A . 14 GLY CA 1 1 10 4518 1 1 14 GLY H H 7.444 -9.189 4.123 1.00 . A A . 14 GLY H 1 1 10 4519 1 1 14 GLY HA2 H 6.330 -10.535 2.070 1.00 . A A . 14 GLY HA2 1 1 10 4520 1 1 14 GLY HA3 H 7.213 -11.362 3.344 1.00 . A A . 14 GLY HA3 1 1 10 4521 1 1 14 GLY N N 6.544 -9.449 3.838 1.00 . A A . 14 GLY N 1 1 10 4522 1 1 14 GLY O O 4.713 -11.442 4.717 1.00 . A A . 14 GLY O 1 1 10 4523 1 1 15 LYS C C 1.967 -11.930 2.603 1.00 . A A . 15 LYS C 1 1 10 4524 1 1 15 LYS CA C 3.192 -12.829 2.766 1.00 . A A . 15 LYS CA 1 1 10 4525 1 1 15 LYS CB C 3.158 -13.498 4.150 1.00 . A A . 15 LYS CB 1 1 10 4526 1 1 15 LYS CD C 3.996 -15.857 4.097 1.00 . A A . 15 LYS CD 1 1 10 4527 1 1 15 LYS CE C 3.137 -16.352 5.264 1.00 . A A . 15 LYS CE 1 1 10 4528 1 1 15 LYS CG C 4.389 -14.395 4.332 1.00 . A A . 15 LYS CG 1 1 10 4529 1 1 15 LYS H H 4.813 -12.032 1.654 1.00 . A A . 15 LYS H 1 1 10 4530 1 1 15 LYS HA H 3.138 -13.605 2.016 1.00 . A A . 15 LYS HA 1 1 10 4531 1 1 15 LYS HB2 H 3.143 -12.743 4.920 1.00 . A A . 15 LYS HB2 1 1 10 4532 1 1 15 LYS HB3 H 2.268 -14.101 4.230 1.00 . A A . 15 LYS HB3 1 1 10 4533 1 1 15 LYS HD2 H 3.431 -15.931 3.177 1.00 . A A . 15 LYS HD2 1 1 10 4534 1 1 15 LYS HD3 H 4.886 -16.463 4.021 1.00 . A A . 15 LYS HD3 1 1 10 4535 1 1 15 LYS HE2 H 3.079 -15.580 6.017 1.00 . A A . 15 LYS HE2 1 1 10 4536 1 1 15 LYS HE3 H 2.140 -16.582 4.907 1.00 . A A . 15 LYS HE3 1 1 10 4537 1 1 15 LYS HG2 H 5.158 -14.110 3.625 1.00 . A A . 15 LYS HG2 1 1 10 4538 1 1 15 LYS HG3 H 4.764 -14.284 5.336 1.00 . A A . 15 LYS HG3 1 1 10 4539 1 1 15 LYS HZ1 H 4.777 -17.428 5.970 1.00 . A A . 15 LYS HZ1 1 1 10 4540 1 1 15 LYS HZ2 H 3.599 -18.388 5.214 1.00 . A A . 15 LYS HZ2 1 1 10 4541 1 1 15 LYS HZ3 H 3.326 -17.779 6.774 1.00 . A A . 15 LYS HZ3 1 1 10 4542 1 1 15 LYS N N 4.439 -12.076 2.559 1.00 . A A . 15 LYS N 1 1 10 4543 1 1 15 LYS NZ N 3.755 -17.579 5.849 1.00 . A A . 15 LYS NZ 1 1 10 4544 1 1 15 LYS O O 0.859 -12.419 2.381 1.00 . A A . 15 LYS O 1 1 10 4545 1 1 16 MET C C 1.484 -8.449 1.767 1.00 . A A . 16 MET C 1 1 10 4546 1 1 16 MET CA C 1.054 -9.679 2.565 1.00 . A A . 16 MET CA 1 1 10 4547 1 1 16 MET CB C 0.569 -9.246 3.954 1.00 . A A . 16 MET CB 1 1 10 4548 1 1 16 MET CE C -2.143 -11.419 6.146 1.00 . A A . 16 MET CE 1 1 10 4549 1 1 16 MET CG C -0.071 -10.438 4.676 1.00 . A A . 16 MET CG 1 1 10 4550 1 1 16 MET H H 3.065 -10.276 2.885 1.00 . A A . 16 MET H 1 1 10 4551 1 1 16 MET HA H 0.243 -10.168 2.049 1.00 . A A . 16 MET HA 1 1 10 4552 1 1 16 MET HB2 H 1.411 -8.887 4.532 1.00 . A A . 16 MET HB2 1 1 10 4553 1 1 16 MET HB3 H -0.159 -8.458 3.853 1.00 . A A . 16 MET HB3 1 1 10 4554 1 1 16 MET HE1 H -1.456 -12.095 6.636 1.00 . A A . 16 MET HE1 1 1 10 4555 1 1 16 MET HE2 H -2.467 -11.842 5.205 1.00 . A A . 16 MET HE2 1 1 10 4556 1 1 16 MET HE3 H -3.002 -11.262 6.779 1.00 . A A . 16 MET HE3 1 1 10 4557 1 1 16 MET HG2 H -0.539 -11.090 3.952 1.00 . A A . 16 MET HG2 1 1 10 4558 1 1 16 MET HG3 H 0.690 -10.984 5.214 1.00 . A A . 16 MET HG3 1 1 10 4559 1 1 16 MET N N 2.164 -10.618 2.709 1.00 . A A . 16 MET N 1 1 10 4560 1 1 16 MET O O 2.086 -7.527 2.314 1.00 . A A . 16 MET O 1 1 10 4561 1 1 16 MET SD S -1.317 -9.834 5.842 1.00 . A A . 16 MET SD 1 1 10 4562 1 1 17 ALA C C 0.321 -6.800 -1.166 1.00 . A A . 17 ALA C 1 1 10 4563 1 1 17 ALA CA C 1.523 -7.302 -0.376 1.00 . A A . 17 ALA CA 1 1 10 4564 1 1 17 ALA CB C 2.637 -7.695 -1.336 1.00 . A A . 17 ALA CB 1 1 10 4565 1 1 17 ALA H H 0.676 -9.191 0.088 1.00 . A A . 17 ALA H 1 1 10 4566 1 1 17 ALA HA H 1.875 -6.498 0.252 1.00 . A A . 17 ALA HA 1 1 10 4567 1 1 17 ALA HB1 H 3.578 -7.699 -0.809 1.00 . A A . 17 ALA HB1 1 1 10 4568 1 1 17 ALA HB2 H 2.680 -6.980 -2.147 1.00 . A A . 17 ALA HB2 1 1 10 4569 1 1 17 ALA HB3 H 2.437 -8.677 -1.733 1.00 . A A . 17 ALA HB3 1 1 10 4570 1 1 17 ALA N N 1.162 -8.434 0.474 1.00 . A A . 17 ALA N 1 1 10 4571 1 1 17 ALA O O -0.221 -7.495 -2.023 1.00 . A A . 17 ALA O 1 1 10 4572 1 1 18 LYS C C -1.178 -3.417 -1.265 1.00 . A A . 18 LYS C 1 1 10 4573 1 1 18 LYS CA C -1.214 -4.932 -1.499 1.00 . A A . 18 LYS CA 1 1 10 4574 1 1 18 LYS CB C -2.535 -5.519 -0.981 1.00 . A A . 18 LYS CB 1 1 10 4575 1 1 18 LYS CD C -1.779 -5.332 1.418 1.00 . A A . 18 LYS CD 1 1 10 4576 1 1 18 LYS CE C -1.053 -6.138 2.496 1.00 . A A . 18 LYS CE 1 1 10 4577 1 1 18 LYS CG C -2.318 -6.275 0.339 1.00 . A A . 18 LYS CG 1 1 10 4578 1 1 18 LYS H H 0.421 -5.102 -0.158 1.00 . A A . 18 LYS H 1 1 10 4579 1 1 18 LYS HA H -1.152 -5.116 -2.561 1.00 . A A . 18 LYS HA 1 1 10 4580 1 1 18 LYS HB2 H -3.242 -4.719 -0.823 1.00 . A A . 18 LYS HB2 1 1 10 4581 1 1 18 LYS HB3 H -2.932 -6.201 -1.719 1.00 . A A . 18 LYS HB3 1 1 10 4582 1 1 18 LYS HD2 H -1.095 -4.627 0.976 1.00 . A A . 18 LYS HD2 1 1 10 4583 1 1 18 LYS HD3 H -2.599 -4.801 1.866 1.00 . A A . 18 LYS HD3 1 1 10 4584 1 1 18 LYS HE2 H -1.284 -7.189 2.381 1.00 . A A . 18 LYS HE2 1 1 10 4585 1 1 18 LYS HE3 H 0.015 -5.993 2.398 1.00 . A A . 18 LYS HE3 1 1 10 4586 1 1 18 LYS HG2 H -3.260 -6.681 0.664 1.00 . A A . 18 LYS HG2 1 1 10 4587 1 1 18 LYS HG3 H -1.619 -7.081 0.182 1.00 . A A . 18 LYS HG3 1 1 10 4588 1 1 18 LYS HZ1 H -0.725 -5.792 4.526 1.00 . A A . 18 LYS HZ1 1 1 10 4589 1 1 18 LYS HZ2 H -2.319 -6.229 4.153 1.00 . A A . 18 LYS HZ2 1 1 10 4590 1 1 18 LYS HZ3 H -1.764 -4.652 3.796 1.00 . A A . 18 LYS HZ3 1 1 10 4591 1 1 18 LYS N N -0.075 -5.582 -0.849 1.00 . A A . 18 LYS N 1 1 10 4592 1 1 18 LYS NZ N -1.498 -5.672 3.843 1.00 . A A . 18 LYS NZ 1 1 10 4593 1 1 18 LYS O O -1.703 -2.917 -0.264 1.00 . A A . 18 LYS O 1 1 10 4594 1 1 19 PRO C C -1.747 -0.470 -2.319 1.00 . A A . 19 PRO C 1 1 10 4595 1 1 19 PRO CA C -0.433 -1.204 -2.046 1.00 . A A . 19 PRO CA 1 1 10 4596 1 1 19 PRO CB C 0.625 -0.857 -3.097 1.00 . A A . 19 PRO CB 1 1 10 4597 1 1 19 PRO CD C 0.092 -3.200 -3.377 1.00 . A A . 19 PRO CD 1 1 10 4598 1 1 19 PRO CG C 0.521 -1.936 -4.121 1.00 . A A . 19 PRO CG 1 1 10 4599 1 1 19 PRO HA H -0.065 -0.939 -1.071 1.00 . A A . 19 PRO HA 1 1 10 4600 1 1 19 PRO HB2 H 0.414 0.107 -3.540 1.00 . A A . 19 PRO HB2 1 1 10 4601 1 1 19 PRO HB3 H 1.608 -0.861 -2.655 1.00 . A A . 19 PRO HB3 1 1 10 4602 1 1 19 PRO HD2 H -0.607 -3.769 -3.977 1.00 . A A . 19 PRO HD2 1 1 10 4603 1 1 19 PRO HD3 H 0.951 -3.800 -3.120 1.00 . A A . 19 PRO HD3 1 1 10 4604 1 1 19 PRO HG2 H -0.220 -1.671 -4.862 1.00 . A A . 19 PRO HG2 1 1 10 4605 1 1 19 PRO HG3 H 1.477 -2.098 -4.592 1.00 . A A . 19 PRO HG3 1 1 10 4606 1 1 19 PRO N N -0.558 -2.689 -2.158 1.00 . A A . 19 PRO N 1 1 10 4607 1 1 19 PRO O O -2.361 -0.636 -3.370 1.00 . A A . 19 PRO O 1 1 10 4608 1 1 20 THR C C -3.098 2.613 -1.355 1.00 . A A . 20 THR C 1 1 10 4609 1 1 20 THR CA C -3.399 1.122 -1.484 1.00 . A A . 20 THR CA 1 1 10 4610 1 1 20 THR CB C -4.394 0.703 -0.395 1.00 . A A . 20 THR CB 1 1 10 4611 1 1 20 THR CG2 C -4.584 -0.809 -0.427 1.00 . A A . 20 THR CG2 1 1 10 4612 1 1 20 THR H H -1.627 0.439 -0.536 1.00 . A A . 20 THR H 1 1 10 4613 1 1 20 THR HA H -3.838 0.933 -2.453 1.00 . A A . 20 THR HA 1 1 10 4614 1 1 20 THR HB H -5.345 1.182 -0.566 1.00 . A A . 20 THR HB 1 1 10 4615 1 1 20 THR HG1 H -2.948 0.823 0.903 1.00 . A A . 20 THR HG1 1 1 10 4616 1 1 20 THR HG21 H -5.051 -1.092 -1.355 1.00 . A A . 20 THR HG21 1 1 10 4617 1 1 20 THR HG22 H -5.211 -1.109 0.397 1.00 . A A . 20 THR HG22 1 1 10 4618 1 1 20 THR HG23 H -3.624 -1.296 -0.344 1.00 . A A . 20 THR HG23 1 1 10 4619 1 1 20 THR N N -2.164 0.349 -1.356 1.00 . A A . 20 THR N 1 1 10 4620 1 1 20 THR O O -2.557 3.056 -0.340 1.00 . A A . 20 THR O 1 1 10 4621 1 1 20 THR OG1 O -3.888 1.083 0.875 1.00 . A A . 20 THR OG1 1 1 10 4622 1 1 21 CYS C C -4.547 5.550 -2.645 1.00 . A A . 21 CYS C 1 1 10 4623 1 1 21 CYS CA C -3.232 4.825 -2.387 1.00 . A A . 21 CYS CA 1 1 10 4624 1 1 21 CYS CB C -2.194 5.206 -3.448 1.00 . A A . 21 CYS CB 1 1 10 4625 1 1 21 CYS H H -3.886 2.963 -3.156 1.00 . A A . 21 CYS H 1 1 10 4626 1 1 21 CYS HA H -2.861 5.122 -1.419 1.00 . A A . 21 CYS HA 1 1 10 4627 1 1 21 CYS HB2 H -2.102 4.405 -4.166 1.00 . A A . 21 CYS HB2 1 1 10 4628 1 1 21 CYS HB3 H -2.501 6.111 -3.951 1.00 . A A . 21 CYS HB3 1 1 10 4629 1 1 21 CYS N N -3.455 3.378 -2.384 1.00 . A A . 21 CYS N 1 1 10 4630 1 1 21 CYS O O -5.127 5.450 -3.729 1.00 . A A . 21 CYS O 1 1 10 4631 1 1 21 CYS SG S -0.598 5.477 -2.631 1.00 . A A . 21 CYS SG 1 1 10 4632 1 1 22 GLU C C -6.164 8.291 -0.976 1.00 . A A . 22 GLU C 1 1 10 4633 1 1 22 GLU CA C -6.270 6.965 -1.720 1.00 . A A . 22 GLU CA 1 1 10 4634 1 1 22 GLU CB C -7.399 6.106 -1.134 1.00 . A A . 22 GLU CB 1 1 10 4635 1 1 22 GLU CD C -6.639 3.781 -0.477 1.00 . A A . 22 GLU CD 1 1 10 4636 1 1 22 GLU CG C -6.856 5.218 0.002 1.00 . A A . 22 GLU CG 1 1 10 4637 1 1 22 GLU H H -4.540 6.289 -0.794 1.00 . A A . 22 GLU H 1 1 10 4638 1 1 22 GLU HA H -6.487 7.164 -2.759 1.00 . A A . 22 GLU HA 1 1 10 4639 1 1 22 GLU HB2 H -8.178 6.749 -0.747 1.00 . A A . 22 GLU HB2 1 1 10 4640 1 1 22 GLU HB3 H -7.806 5.479 -1.911 1.00 . A A . 22 GLU HB3 1 1 10 4641 1 1 22 GLU HG2 H -5.918 5.620 0.354 1.00 . A A . 22 GLU HG2 1 1 10 4642 1 1 22 GLU HG3 H -7.566 5.216 0.816 1.00 . A A . 22 GLU HG3 1 1 10 4643 1 1 22 GLU N N -5.026 6.254 -1.629 1.00 . A A . 22 GLU N 1 1 10 4644 1 1 22 GLU O O -5.659 8.362 0.144 1.00 . A A . 22 GLU O 1 1 10 4645 1 1 22 GLU OE1 O -6.108 3.594 -1.560 1.00 . A A . 22 GLU OE1 1 1 10 4646 1 1 22 GLU OE2 O -6.993 2.876 0.264 1.00 . A A . 22 GLU OE2 1 1 10 4647 1 1 23 ASN C C -5.324 10.999 -0.339 1.00 . A A . 23 ASN C 1 1 10 4648 1 1 23 ASN CA C -6.623 10.687 -1.084 1.00 . A A . 23 ASN CA 1 1 10 4649 1 1 23 ASN CB C -7.827 10.887 -0.155 1.00 . A A . 23 ASN CB 1 1 10 4650 1 1 23 ASN CG C -7.829 9.844 0.955 1.00 . A A . 23 ASN CG 1 1 10 4651 1 1 23 ASN H H -6.995 9.167 -2.517 1.00 . A A . 23 ASN H 1 1 10 4652 1 1 23 ASN HA H -6.714 11.383 -1.905 1.00 . A A . 23 ASN HA 1 1 10 4653 1 1 23 ASN HB2 H -7.781 11.871 0.282 1.00 . A A . 23 ASN HB2 1 1 10 4654 1 1 23 ASN HB3 H -8.732 10.795 -0.731 1.00 . A A . 23 ASN HB3 1 1 10 4655 1 1 23 ASN HD21 H -6.246 10.611 1.861 1.00 . A A . 23 ASN HD21 1 1 10 4656 1 1 23 ASN HD22 H -6.920 9.235 2.599 1.00 . A A . 23 ASN HD22 1 1 10 4657 1 1 23 ASN N N -6.633 9.325 -1.631 1.00 . A A . 23 ASN N 1 1 10 4658 1 1 23 ASN ND2 N -6.926 9.900 1.883 1.00 . A A . 23 ASN ND2 1 1 10 4659 1 1 23 ASN O O -5.340 11.479 0.798 1.00 . A A . 23 ASN O 1 1 10 4660 1 1 23 ASN OD1 O -8.677 8.956 0.974 1.00 . A A . 23 ASN OD1 1 1 10 4661 1 1 24 GLU C C -2.560 10.072 0.732 1.00 . A A . 24 GLU C 1 1 10 4662 1 1 24 GLU CA C -2.884 11.003 -0.438 1.00 . A A . 24 GLU CA 1 1 10 4663 1 1 24 GLU CB C -2.782 12.469 0.005 1.00 . A A . 24 GLU CB 1 1 10 4664 1 1 24 GLU CD C -2.617 13.001 -2.450 1.00 . A A . 24 GLU CD 1 1 10 4665 1 1 24 GLU CG C -3.268 13.391 -1.126 1.00 . A A . 24 GLU CG 1 1 10 4666 1 1 24 GLU H H -4.267 10.371 -1.911 1.00 . A A . 24 GLU H 1 1 10 4667 1 1 24 GLU HA H -2.154 10.834 -1.212 1.00 . A A . 24 GLU HA 1 1 10 4668 1 1 24 GLU HB2 H -3.393 12.622 0.884 1.00 . A A . 24 GLU HB2 1 1 10 4669 1 1 24 GLU HB3 H -1.754 12.701 0.238 1.00 . A A . 24 GLU HB3 1 1 10 4670 1 1 24 GLU HG2 H -4.340 13.309 -1.219 1.00 . A A . 24 GLU HG2 1 1 10 4671 1 1 24 GLU HG3 H -3.008 14.412 -0.890 1.00 . A A . 24 GLU HG3 1 1 10 4672 1 1 24 GLU N N -4.206 10.736 -1.004 1.00 . A A . 24 GLU N 1 1 10 4673 1 1 24 GLU O O -1.502 10.193 1.352 1.00 . A A . 24 GLU O 1 1 10 4674 1 1 24 GLU OE1 O -3.130 12.102 -3.099 1.00 . A A . 24 GLU OE1 1 1 10 4675 1 1 24 GLU OE2 O -1.614 13.604 -2.794 1.00 . A A . 24 GLU OE2 1 1 10 4676 1 1 25 VAL C C -2.843 6.820 1.566 1.00 . A A . 25 VAL C 1 1 10 4677 1 1 25 VAL CA C -3.227 8.193 2.120 1.00 . A A . 25 VAL CA 1 1 10 4678 1 1 25 VAL CB C -4.483 8.079 2.992 1.00 . A A . 25 VAL CB 1 1 10 4679 1 1 25 VAL CG1 C -4.313 6.931 3.990 1.00 . A A . 25 VAL CG1 1 1 10 4680 1 1 25 VAL CG2 C -4.690 9.387 3.762 1.00 . A A . 25 VAL CG2 1 1 10 4681 1 1 25 VAL H H -4.286 9.068 0.498 1.00 . A A . 25 VAL H 1 1 10 4682 1 1 25 VAL HA H -2.415 8.559 2.731 1.00 . A A . 25 VAL HA 1 1 10 4683 1 1 25 VAL HB H -5.343 7.886 2.365 1.00 . A A . 25 VAL HB 1 1 10 4684 1 1 25 VAL HG11 H -3.335 6.992 4.446 1.00 . A A . 25 VAL HG11 1 1 10 4685 1 1 25 VAL HG12 H -4.411 5.988 3.475 1.00 . A A . 25 VAL HG12 1 1 10 4686 1 1 25 VAL HG13 H -5.071 7.004 4.756 1.00 . A A . 25 VAL HG13 1 1 10 4687 1 1 25 VAL HG21 H -4.760 10.209 3.064 1.00 . A A . 25 VAL HG21 1 1 10 4688 1 1 25 VAL HG22 H -3.854 9.549 4.426 1.00 . A A . 25 VAL HG22 1 1 10 4689 1 1 25 VAL HG23 H -5.600 9.325 4.339 1.00 . A A . 25 VAL HG23 1 1 10 4690 1 1 25 VAL N N -3.457 9.135 1.027 1.00 . A A . 25 VAL N 1 1 10 4691 1 1 25 VAL O O -3.699 6.056 1.111 1.00 . A A . 25 VAL O 1 1 10 4692 1 1 26 CYS C C -1.040 4.183 2.209 1.00 . A A . 26 CYS C 1 1 10 4693 1 1 26 CYS CA C -1.061 5.231 1.100 1.00 . A A . 26 CYS CA 1 1 10 4694 1 1 26 CYS CB C 0.351 5.385 0.530 1.00 . A A . 26 CYS CB 1 1 10 4695 1 1 26 CYS H H -0.910 7.159 1.969 1.00 . A A . 26 CYS H 1 1 10 4696 1 1 26 CYS HA H -1.716 4.896 0.313 1.00 . A A . 26 CYS HA 1 1 10 4697 1 1 26 CYS HB2 H 0.419 4.854 -0.404 1.00 . A A . 26 CYS HB2 1 1 10 4698 1 1 26 CYS HB3 H 0.570 6.421 0.363 1.00 . A A . 26 CYS HB3 1 1 10 4699 1 1 26 CYS N N -1.548 6.513 1.602 1.00 . A A . 26 CYS N 1 1 10 4700 1 1 26 CYS O O -0.641 4.469 3.340 1.00 . A A . 26 CYS O 1 1 10 4701 1 1 26 CYS SG S 1.550 4.698 1.696 1.00 . A A . 26 CYS SG 1 1 10 4702 1 1 27 LYS C C -1.373 0.526 2.172 1.00 . A A . 27 LYS C 1 1 10 4703 1 1 27 LYS CA C -1.485 1.881 2.865 1.00 . A A . 27 LYS CA 1 1 10 4704 1 1 27 LYS CB C -2.781 1.907 3.688 1.00 . A A . 27 LYS CB 1 1 10 4705 1 1 27 LYS CD C -4.876 3.214 4.133 1.00 . A A . 27 LYS CD 1 1 10 4706 1 1 27 LYS CE C -5.678 2.316 3.182 1.00 . A A . 27 LYS CE 1 1 10 4707 1 1 27 LYS CG C -3.413 3.304 3.673 1.00 . A A . 27 LYS CG 1 1 10 4708 1 1 27 LYS H H -1.782 2.797 0.963 1.00 . A A . 27 LYS H 1 1 10 4709 1 1 27 LYS HA H -0.645 2.002 3.535 1.00 . A A . 27 LYS HA 1 1 10 4710 1 1 27 LYS HB2 H -3.478 1.196 3.271 1.00 . A A . 27 LYS HB2 1 1 10 4711 1 1 27 LYS HB3 H -2.559 1.628 4.707 1.00 . A A . 27 LYS HB3 1 1 10 4712 1 1 27 LYS HD2 H -4.912 2.800 5.130 1.00 . A A . 27 LYS HD2 1 1 10 4713 1 1 27 LYS HD3 H -5.311 4.202 4.142 1.00 . A A . 27 LYS HD3 1 1 10 4714 1 1 27 LYS HE2 H -5.483 1.279 3.413 1.00 . A A . 27 LYS HE2 1 1 10 4715 1 1 27 LYS HE3 H -6.734 2.517 3.303 1.00 . A A . 27 LYS HE3 1 1 10 4716 1 1 27 LYS HG2 H -2.864 3.951 4.344 1.00 . A A . 27 LYS HG2 1 1 10 4717 1 1 27 LYS HG3 H -3.376 3.711 2.675 1.00 . A A . 27 LYS HG3 1 1 10 4718 1 1 27 LYS HZ1 H -4.782 3.508 1.727 1.00 . A A . 27 LYS HZ1 1 1 10 4719 1 1 27 LYS HZ2 H -6.142 2.642 1.156 1.00 . A A . 27 LYS HZ2 1 1 10 4720 1 1 27 LYS HZ3 H -4.636 1.832 1.423 1.00 . A A . 27 LYS HZ3 1 1 10 4721 1 1 27 LYS N N -1.470 2.967 1.883 1.00 . A A . 27 LYS N 1 1 10 4722 1 1 27 LYS NZ N -5.278 2.599 1.774 1.00 . A A . 27 LYS NZ 1 1 10 4723 1 1 27 LYS O O -1.679 0.402 0.984 1.00 . A A . 27 LYS O 1 1 10 4724 1 1 28 CYS C C -2.041 -2.685 2.821 1.00 . A A . 28 CYS C 1 1 10 4725 1 1 28 CYS CA C -0.852 -1.836 2.365 1.00 . A A . 28 CYS CA 1 1 10 4726 1 1 28 CYS CB C 0.465 -2.488 2.805 1.00 . A A . 28 CYS CB 1 1 10 4727 1 1 28 CYS H H -0.757 -0.341 3.864 1.00 . A A . 28 CYS H 1 1 10 4728 1 1 28 CYS HA H -0.862 -1.768 1.291 1.00 . A A . 28 CYS HA 1 1 10 4729 1 1 28 CYS HB2 H 1.175 -1.720 3.076 1.00 . A A . 28 CYS HB2 1 1 10 4730 1 1 28 CYS HB3 H 0.287 -3.130 3.654 1.00 . A A . 28 CYS HB3 1 1 10 4731 1 1 28 CYS N N -0.965 -0.491 2.921 1.00 . A A . 28 CYS N 1 1 10 4732 1 1 28 CYS O O -1.946 -3.431 3.800 1.00 . A A . 28 CYS O 1 1 10 4733 1 1 28 CYS SG S 1.130 -3.470 1.434 1.00 . A A . 28 CYS SG 1 1 10 4734 1 1 29 ASN C C -4.916 -4.097 1.264 1.00 . A A . 29 ASN C 1 1 10 4735 1 1 29 ASN CA C -4.367 -3.323 2.465 1.00 . A A . 29 ASN CA 1 1 10 4736 1 1 29 ASN CB C -5.437 -2.367 3.003 1.00 . A A . 29 ASN CB 1 1 10 4737 1 1 29 ASN CG C -4.978 -1.761 4.324 1.00 . A A . 29 ASN CG 1 1 10 4738 1 1 29 ASN H H -3.179 -1.961 1.340 1.00 . A A . 29 ASN H 1 1 10 4739 1 1 29 ASN HA H -4.119 -4.027 3.242 1.00 . A A . 29 ASN HA 1 1 10 4740 1 1 29 ASN HB2 H -5.605 -1.577 2.287 1.00 . A A . 29 ASN HB2 1 1 10 4741 1 1 29 ASN HB3 H -6.357 -2.910 3.159 1.00 . A A . 29 ASN HB3 1 1 10 4742 1 1 29 ASN HD21 H -6.228 -2.831 5.423 1.00 . A A . 29 ASN HD21 1 1 10 4743 1 1 29 ASN HD22 H -5.227 -1.767 6.285 1.00 . A A . 29 ASN HD22 1 1 10 4744 1 1 29 ASN N N -3.162 -2.567 2.112 1.00 . A A . 29 ASN N 1 1 10 4745 1 1 29 ASN ND2 N -5.523 -2.153 5.435 1.00 . A A . 29 ASN ND2 1 1 10 4746 1 1 29 ASN O O -5.023 -3.565 0.162 1.00 . A A . 29 ASN O 1 1 10 4747 1 1 29 ASN OD1 O -4.096 -0.904 4.345 1.00 . A A . 29 ASN OD1 1 1 10 4748 1 1 30 ILE C C -7.241 -5.788 0.071 1.00 . A A . 30 ILE C 1 1 10 4749 1 1 30 ILE CA C -5.821 -6.198 0.425 1.00 . A A . 30 ILE CA 1 1 10 4750 1 1 30 ILE CB C -5.805 -7.692 0.801 1.00 . A A . 30 ILE CB 1 1 10 4751 1 1 30 ILE CD1 C -4.124 -7.687 2.666 1.00 . A A . 30 ILE CD1 1 1 10 4752 1 1 30 ILE CG1 C -5.604 -7.864 2.314 1.00 . A A . 30 ILE CG1 1 1 10 4753 1 1 30 ILE CG2 C -4.707 -8.432 0.022 1.00 . A A . 30 ILE CG2 1 1 10 4754 1 1 30 ILE H H -5.180 -5.727 2.393 1.00 . A A . 30 ILE H 1 1 10 4755 1 1 30 ILE HA H -5.209 -6.063 -0.453 1.00 . A A . 30 ILE HA 1 1 10 4756 1 1 30 ILE HB H -6.759 -8.123 0.530 1.00 . A A . 30 ILE HB 1 1 10 4757 1 1 30 ILE HD11 H -3.831 -6.663 2.495 1.00 . A A . 30 ILE HD11 1 1 10 4758 1 1 30 ILE HD12 H -3.528 -8.340 2.044 1.00 . A A . 30 ILE HD12 1 1 10 4759 1 1 30 ILE HD13 H -3.972 -7.936 3.701 1.00 . A A . 30 ILE HD13 1 1 10 4760 1 1 30 ILE HG12 H -6.194 -7.130 2.841 1.00 . A A . 30 ILE HG12 1 1 10 4761 1 1 30 ILE HG13 H -5.922 -8.854 2.605 1.00 . A A . 30 ILE HG13 1 1 10 4762 1 1 30 ILE HG21 H -5.138 -9.285 -0.480 1.00 . A A . 30 ILE HG21 1 1 10 4763 1 1 30 ILE HG22 H -3.940 -8.769 0.702 1.00 . A A . 30 ILE HG22 1 1 10 4764 1 1 30 ILE HG23 H -4.271 -7.770 -0.712 1.00 . A A . 30 ILE HG23 1 1 10 4765 1 1 30 ILE N N -5.275 -5.358 1.492 1.00 . A A . 30 ILE N 1 1 10 4766 1 1 30 ILE O O -8.042 -5.439 0.938 1.00 . A A . 30 ILE O 1 1 10 4767 1 1 31 GLY C C -8.863 -4.214 -2.545 1.00 . A A . 31 GLY C 1 1 10 4768 1 1 31 GLY CA C -8.868 -5.499 -1.721 1.00 . A A . 31 GLY CA 1 1 10 4769 1 1 31 GLY H H -6.847 -6.150 -1.842 1.00 . A A . 31 GLY H 1 1 10 4770 1 1 31 GLY HA2 H -9.236 -6.307 -2.337 1.00 . A A . 31 GLY HA2 1 1 10 4771 1 1 31 GLY HA3 H -9.529 -5.368 -0.883 1.00 . A A . 31 GLY HA3 1 1 10 4772 1 1 31 GLY N N -7.538 -5.848 -1.219 1.00 . A A . 31 GLY N 1 1 10 4773 1 1 31 GLY O O -9.786 -3.969 -3.321 1.00 . A A . 31 GLY O 1 1 10 4774 1 1 32 LYS C C -6.357 -1.913 -3.706 1.00 . A A . 32 LYS C 1 1 10 4775 1 1 32 LYS CA C -7.749 -2.130 -3.104 1.00 . A A . 32 LYS CA 1 1 10 4776 1 1 32 LYS CB C -8.106 -0.956 -2.183 1.00 . A A . 32 LYS CB 1 1 10 4777 1 1 32 LYS CD C -8.141 1.532 -2.546 1.00 . A A . 32 LYS CD 1 1 10 4778 1 1 32 LYS CE C -7.896 2.450 -3.749 1.00 . A A . 32 LYS CE 1 1 10 4779 1 1 32 LYS CG C -8.709 0.185 -3.016 1.00 . A A . 32 LYS CG 1 1 10 4780 1 1 32 LYS H H -7.135 -3.631 -1.732 1.00 . A A . 32 LYS H 1 1 10 4781 1 1 32 LYS HA H -8.465 -2.159 -3.910 1.00 . A A . 32 LYS HA 1 1 10 4782 1 1 32 LYS HB2 H -8.827 -1.285 -1.448 1.00 . A A . 32 LYS HB2 1 1 10 4783 1 1 32 LYS HB3 H -7.216 -0.607 -1.683 1.00 . A A . 32 LYS HB3 1 1 10 4784 1 1 32 LYS HD2 H -8.846 2.002 -1.875 1.00 . A A . 32 LYS HD2 1 1 10 4785 1 1 32 LYS HD3 H -7.210 1.369 -2.027 1.00 . A A . 32 LYS HD3 1 1 10 4786 1 1 32 LYS HE2 H -8.102 1.914 -4.666 1.00 . A A . 32 LYS HE2 1 1 10 4787 1 1 32 LYS HE3 H -8.544 3.313 -3.682 1.00 . A A . 32 LYS HE3 1 1 10 4788 1 1 32 LYS HG2 H -8.468 0.036 -4.058 1.00 . A A . 32 LYS HG2 1 1 10 4789 1 1 32 LYS HG3 H -9.783 0.188 -2.894 1.00 . A A . 32 LYS HG3 1 1 10 4790 1 1 32 LYS HZ1 H -5.857 2.111 -4.083 1.00 . A A . 32 LYS HZ1 1 1 10 4791 1 1 32 LYS HZ2 H -6.194 3.151 -2.742 1.00 . A A . 32 LYS HZ2 1 1 10 4792 1 1 32 LYS HZ3 H -6.356 3.727 -4.354 1.00 . A A . 32 LYS HZ3 1 1 10 4793 1 1 32 LYS N N -7.836 -3.392 -2.369 1.00 . A A . 32 LYS N 1 1 10 4794 1 1 32 LYS NZ N -6.473 2.893 -3.737 1.00 . A A . 32 LYS NZ 1 1 10 4795 1 1 32 LYS O O -5.344 -2.244 -3.096 1.00 . A A . 32 LYS O 1 1 10 4796 1 1 33 LYS C C -4.588 0.349 -5.276 1.00 . A A . 33 LYS C 1 1 10 4797 1 1 33 LYS CA C -5.082 -1.061 -5.619 1.00 . A A . 33 LYS CA 1 1 10 4798 1 1 33 LYS CB C -5.307 -1.186 -7.131 1.00 . A A . 33 LYS CB 1 1 10 4799 1 1 33 LYS CD C -3.754 -0.008 -8.707 1.00 . A A . 33 LYS CD 1 1 10 4800 1 1 33 LYS CE C -2.291 0.091 -9.157 1.00 . A A . 33 LYS CE 1 1 10 4801 1 1 33 LYS CG C -3.961 -1.274 -7.865 1.00 . A A . 33 LYS CG 1 1 10 4802 1 1 33 LYS H H -7.180 -1.108 -5.336 1.00 . A A . 33 LYS H 1 1 10 4803 1 1 33 LYS HA H -4.330 -1.776 -5.311 1.00 . A A . 33 LYS HA 1 1 10 4804 1 1 33 LYS HB2 H -5.883 -2.078 -7.334 1.00 . A A . 33 LYS HB2 1 1 10 4805 1 1 33 LYS HB3 H -5.852 -0.323 -7.485 1.00 . A A . 33 LYS HB3 1 1 10 4806 1 1 33 LYS HD2 H -4.394 -0.047 -9.577 1.00 . A A . 33 LYS HD2 1 1 10 4807 1 1 33 LYS HD3 H -4.007 0.858 -8.118 1.00 . A A . 33 LYS HD3 1 1 10 4808 1 1 33 LYS HE2 H -1.696 -0.628 -8.613 1.00 . A A . 33 LYS HE2 1 1 10 4809 1 1 33 LYS HE3 H -2.228 -0.122 -10.216 1.00 . A A . 33 LYS HE3 1 1 10 4810 1 1 33 LYS HG2 H -3.161 -1.369 -7.145 1.00 . A A . 33 LYS HG2 1 1 10 4811 1 1 33 LYS HG3 H -3.962 -2.137 -8.515 1.00 . A A . 33 LYS HG3 1 1 10 4812 1 1 33 LYS HZ1 H -1.608 1.962 -9.789 1.00 . A A . 33 LYS HZ1 1 1 10 4813 1 1 33 LYS HZ2 H -0.864 1.407 -8.348 1.00 . A A . 33 LYS HZ2 1 1 10 4814 1 1 33 LYS HZ3 H -2.482 2.013 -8.312 1.00 . A A . 33 LYS HZ3 1 1 10 4815 1 1 33 LYS N N -6.332 -1.348 -4.911 1.00 . A A . 33 LYS N 1 1 10 4816 1 1 33 LYS NZ N -1.775 1.468 -8.894 1.00 . A A . 33 LYS NZ 1 1 10 4817 1 1 33 LYS O O -5.340 1.163 -4.725 1.00 . A A . 33 LYS O 1 1 10 4818 1 1 34 ASP C C -3.231 2.978 -6.304 1.00 . A A . 34 ASP C 1 1 10 4819 1 1 34 ASP CA C -2.751 1.936 -5.290 1.00 . A A . 34 ASP CA 1 1 10 4820 1 1 34 ASP CB C -1.219 1.850 -5.320 1.00 . A A . 34 ASP CB 1 1 10 4821 1 1 34 ASP CG C -0.764 0.917 -6.437 1.00 . A A . 34 ASP CG 1 1 10 4822 1 1 34 ASP H H -2.761 -0.057 -6.006 1.00 . A A . 34 ASP H 1 1 10 4823 1 1 34 ASP HA H -3.059 2.237 -4.308 1.00 . A A . 34 ASP HA 1 1 10 4824 1 1 34 ASP HB2 H -0.809 2.833 -5.489 1.00 . A A . 34 ASP HB2 1 1 10 4825 1 1 34 ASP HB3 H -0.865 1.471 -4.376 1.00 . A A . 34 ASP HB3 1 1 10 4826 1 1 34 ASP N N -3.326 0.630 -5.584 1.00 . A A . 34 ASP N 1 1 10 4827 1 1 34 ASP O O -3.031 2.775 -7.489 1.00 . A A . 34 ASP O 1 1 10 4828 1 1 34 ASP OXT O -3.806 3.962 -5.875 1.00 . A A . 34 ASP OXT 1 1 10 4829 1 1 34 ASP OD1 O -1.127 -0.246 -6.401 1.00 . A A . 34 ASP OD1 1 1 10 4830 1 1 34 ASP OD2 O -0.070 1.384 -7.329 1.00 . A A . 34 ASP OD2 1 1 11 4831 1 1 1 GLY C C 0.729 11.290 -5.003 1.00 . A A . 1 GLY C 1 1 11 4832 1 1 1 GLY CA C -0.593 10.900 -5.648 1.00 . A A . 1 GLY CA 1 1 11 4833 1 1 1 GLY H1 H -2.139 12.169 -6.237 1.00 . A A . 1 GLY H1 1 1 11 4834 1 1 1 GLY H2 H -1.106 12.832 -5.061 1.00 . A A . 1 GLY H2 1 1 11 4835 1 1 1 GLY H3 H -2.254 11.651 -4.618 1.00 . A A . 1 GLY H3 1 1 11 4836 1 1 1 GLY HA2 H -0.939 9.965 -5.231 1.00 . A A . 1 GLY HA2 1 1 11 4837 1 1 1 GLY HA3 H -0.450 10.793 -6.713 1.00 . A A . 1 GLY HA3 1 1 11 4838 1 1 1 GLY N N -1.598 11.968 -5.377 1.00 . A A . 1 GLY N 1 1 11 4839 1 1 1 GLY O O 1.352 12.272 -5.401 1.00 . A A . 1 GLY O 1 1 11 4840 1 1 2 SER C C 3.319 9.600 -3.292 1.00 . A A . 2 SER C 1 1 11 4841 1 1 2 SER CA C 2.387 10.816 -3.291 1.00 . A A . 2 SER CA 1 1 11 4842 1 1 2 SER CB C 2.071 11.238 -1.853 1.00 . A A . 2 SER CB 1 1 11 4843 1 1 2 SER H H 0.597 9.760 -3.715 1.00 . A A . 2 SER H 1 1 11 4844 1 1 2 SER HA H 2.887 11.634 -3.787 1.00 . A A . 2 SER HA 1 1 11 4845 1 1 2 SER HB2 H 1.432 10.504 -1.389 1.00 . A A . 2 SER HB2 1 1 11 4846 1 1 2 SER HB3 H 2.991 11.319 -1.289 1.00 . A A . 2 SER HB3 1 1 11 4847 1 1 2 SER HG H 0.516 12.373 -2.284 1.00 . A A . 2 SER HG 1 1 11 4848 1 1 2 SER N N 1.142 10.525 -3.997 1.00 . A A . 2 SER N 1 1 11 4849 1 1 2 SER O O 2.863 8.452 -3.261 1.00 . A A . 2 SER O 1 1 11 4850 1 1 2 SER OG O 1.401 12.497 -1.874 1.00 . A A . 2 SER OG 1 1 11 4851 1 1 3 VAL C C 5.267 7.658 -2.412 1.00 . A A . 3 VAL C 1 1 11 4852 1 1 3 VAL CA C 5.638 8.813 -3.345 1.00 . A A . 3 VAL CA 1 1 11 4853 1 1 3 VAL CB C 6.992 9.400 -2.937 1.00 . A A . 3 VAL CB 1 1 11 4854 1 1 3 VAL CG1 C 7.573 10.196 -4.108 1.00 . A A . 3 VAL CG1 1 1 11 4855 1 1 3 VAL CG2 C 6.824 10.333 -1.729 1.00 . A A . 3 VAL CG2 1 1 11 4856 1 1 3 VAL H H 4.920 10.802 -3.358 1.00 . A A . 3 VAL H 1 1 11 4857 1 1 3 VAL HA H 5.723 8.426 -4.350 1.00 . A A . 3 VAL HA 1 1 11 4858 1 1 3 VAL HB H 7.664 8.597 -2.680 1.00 . A A . 3 VAL HB 1 1 11 4859 1 1 3 VAL HG11 H 7.966 9.513 -4.847 1.00 . A A . 3 VAL HG11 1 1 11 4860 1 1 3 VAL HG12 H 8.368 10.835 -3.750 1.00 . A A . 3 VAL HG12 1 1 11 4861 1 1 3 VAL HG13 H 6.797 10.802 -4.552 1.00 . A A . 3 VAL HG13 1 1 11 4862 1 1 3 VAL HG21 H 7.386 9.942 -0.893 1.00 . A A . 3 VAL HG21 1 1 11 4863 1 1 3 VAL HG22 H 5.781 10.399 -1.460 1.00 . A A . 3 VAL HG22 1 1 11 4864 1 1 3 VAL HG23 H 7.192 11.317 -1.979 1.00 . A A . 3 VAL HG23 1 1 11 4865 1 1 3 VAL N N 4.625 9.869 -3.333 1.00 . A A . 3 VAL N 1 1 11 4866 1 1 3 VAL O O 5.476 6.490 -2.747 1.00 . A A . 3 VAL O 1 1 11 4867 1 1 4 GLY C C 3.787 5.716 -0.979 1.00 . A A . 4 GLY C 1 1 11 4868 1 1 4 GLY CA C 4.297 6.967 -0.278 1.00 . A A . 4 GLY CA 1 1 11 4869 1 1 4 GLY H H 4.560 8.933 -1.042 1.00 . A A . 4 GLY H 1 1 11 4870 1 1 4 GLY HA2 H 5.141 6.703 0.340 1.00 . A A . 4 GLY HA2 1 1 11 4871 1 1 4 GLY HA3 H 3.509 7.361 0.347 1.00 . A A . 4 GLY HA3 1 1 11 4872 1 1 4 GLY N N 4.706 7.988 -1.249 1.00 . A A . 4 GLY N 1 1 11 4873 1 1 4 GLY O O 4.086 4.598 -0.569 1.00 . A A . 4 GLY O 1 1 11 4874 1 1 5 CYS C C 3.572 3.849 -3.271 1.00 . A A . 5 CYS C 1 1 11 4875 1 1 5 CYS CA C 2.470 4.796 -2.805 1.00 . A A . 5 CYS CA 1 1 11 4876 1 1 5 CYS CB C 1.698 5.313 -4.021 1.00 . A A . 5 CYS CB 1 1 11 4877 1 1 5 CYS H H 2.815 6.830 -2.333 1.00 . A A . 5 CYS H 1 1 11 4878 1 1 5 CYS HA H 1.794 4.249 -2.165 1.00 . A A . 5 CYS HA 1 1 11 4879 1 1 5 CYS HB2 H 2.391 5.748 -4.726 1.00 . A A . 5 CYS HB2 1 1 11 4880 1 1 5 CYS HB3 H 1.185 4.493 -4.487 1.00 . A A . 5 CYS HB3 1 1 11 4881 1 1 5 CYS N N 3.017 5.914 -2.048 1.00 . A A . 5 CYS N 1 1 11 4882 1 1 5 CYS O O 3.323 2.667 -3.490 1.00 . A A . 5 CYS O 1 1 11 4883 1 1 5 CYS SG S 0.496 6.569 -3.506 1.00 . A A . 5 CYS SG 1 1 11 4884 1 1 6 ALA C C 6.527 2.882 -2.589 1.00 . A A . 6 ALA C 1 1 11 4885 1 1 6 ALA CA C 5.919 3.544 -3.819 1.00 . A A . 6 ALA CA 1 1 11 4886 1 1 6 ALA CB C 6.967 4.406 -4.531 1.00 . A A . 6 ALA CB 1 1 11 4887 1 1 6 ALA H H 4.932 5.323 -3.202 1.00 . A A . 6 ALA H 1 1 11 4888 1 1 6 ALA HA H 5.572 2.778 -4.493 1.00 . A A . 6 ALA HA 1 1 11 4889 1 1 6 ALA HB1 H 7.900 3.864 -4.589 1.00 . A A . 6 ALA HB1 1 1 11 4890 1 1 6 ALA HB2 H 7.118 5.322 -3.978 1.00 . A A . 6 ALA HB2 1 1 11 4891 1 1 6 ALA HB3 H 6.624 4.640 -5.527 1.00 . A A . 6 ALA HB3 1 1 11 4892 1 1 6 ALA N N 4.787 4.367 -3.404 1.00 . A A . 6 ALA N 1 1 11 4893 1 1 6 ALA O O 6.778 1.673 -2.566 1.00 . A A . 6 ALA O 1 1 11 4894 1 1 7 GLU C C 6.285 2.202 0.343 1.00 . A A . 7 GLU C 1 1 11 4895 1 1 7 GLU CA C 7.276 3.172 -0.300 1.00 . A A . 7 GLU CA 1 1 11 4896 1 1 7 GLU CB C 7.556 4.326 0.667 1.00 . A A . 7 GLU CB 1 1 11 4897 1 1 7 GLU CD C 7.965 6.310 -0.810 1.00 . A A . 7 GLU CD 1 1 11 4898 1 1 7 GLU CG C 8.621 5.255 0.073 1.00 . A A . 7 GLU CG 1 1 11 4899 1 1 7 GLU H H 6.487 4.635 -1.630 1.00 . A A . 7 GLU H 1 1 11 4900 1 1 7 GLU HA H 8.198 2.651 -0.503 1.00 . A A . 7 GLU HA 1 1 11 4901 1 1 7 GLU HB2 H 6.645 4.883 0.836 1.00 . A A . 7 GLU HB2 1 1 11 4902 1 1 7 GLU HB3 H 7.913 3.930 1.606 1.00 . A A . 7 GLU HB3 1 1 11 4903 1 1 7 GLU HG2 H 9.156 5.746 0.873 1.00 . A A . 7 GLU HG2 1 1 11 4904 1 1 7 GLU HG3 H 9.314 4.678 -0.518 1.00 . A A . 7 GLU HG3 1 1 11 4905 1 1 7 GLU N N 6.729 3.683 -1.553 1.00 . A A . 7 GLU N 1 1 11 4906 1 1 7 GLU O O 6.673 1.184 0.917 1.00 . A A . 7 GLU O 1 1 11 4907 1 1 7 GLU OE1 O 7.335 7.201 -0.268 1.00 . A A . 7 GLU OE1 1 1 11 4908 1 1 7 GLU OE2 O 8.103 6.208 -2.014 1.00 . A A . 7 GLU OE2 1 1 11 4909 1 1 8 CYS C C 4.142 0.234 0.526 1.00 . A A . 8 CYS C 1 1 11 4910 1 1 8 CYS CA C 3.934 1.723 0.814 1.00 . A A . 8 CYS CA 1 1 11 4911 1 1 8 CYS CB C 2.575 2.186 0.292 1.00 . A A . 8 CYS CB 1 1 11 4912 1 1 8 CYS H H 4.766 3.376 -0.226 1.00 . A A . 8 CYS H 1 1 11 4913 1 1 8 CYS HA H 3.942 1.865 1.879 1.00 . A A . 8 CYS HA 1 1 11 4914 1 1 8 CYS HB2 H 2.712 2.983 -0.423 1.00 . A A . 8 CYS HB2 1 1 11 4915 1 1 8 CYS HB3 H 2.056 1.369 -0.177 1.00 . A A . 8 CYS HB3 1 1 11 4916 1 1 8 CYS N N 5.001 2.542 0.241 1.00 . A A . 8 CYS N 1 1 11 4917 1 1 8 CYS O O 4.275 -0.565 1.453 1.00 . A A . 8 CYS O 1 1 11 4918 1 1 8 CYS SG S 1.608 2.791 1.690 1.00 . A A . 8 CYS SG 1 1 11 4919 1 1 9 PRO C C 5.802 -2.035 -0.699 1.00 . A A . 9 PRO C 1 1 11 4920 1 1 9 PRO CA C 4.403 -1.579 -1.104 1.00 . A A . 9 PRO CA 1 1 11 4921 1 1 9 PRO CB C 4.214 -1.599 -2.625 1.00 . A A . 9 PRO CB 1 1 11 4922 1 1 9 PRO CD C 4.028 0.707 -1.902 1.00 . A A . 9 PRO CD 1 1 11 4923 1 1 9 PRO CG C 4.424 -0.191 -3.074 1.00 . A A . 9 PRO CG 1 1 11 4924 1 1 9 PRO HA H 3.659 -2.206 -0.638 1.00 . A A . 9 PRO HA 1 1 11 4925 1 1 9 PRO HB2 H 4.941 -2.254 -3.086 1.00 . A A . 9 PRO HB2 1 1 11 4926 1 1 9 PRO HB3 H 3.214 -1.918 -2.872 1.00 . A A . 9 PRO HB3 1 1 11 4927 1 1 9 PRO HD2 H 4.684 1.561 -1.842 1.00 . A A . 9 PRO HD2 1 1 11 4928 1 1 9 PRO HD3 H 3.003 1.021 -1.998 1.00 . A A . 9 PRO HD3 1 1 11 4929 1 1 9 PRO HG2 H 5.464 -0.036 -3.330 1.00 . A A . 9 PRO HG2 1 1 11 4930 1 1 9 PRO HG3 H 3.797 0.026 -3.925 1.00 . A A . 9 PRO HG3 1 1 11 4931 1 1 9 PRO N N 4.184 -0.155 -0.724 1.00 . A A . 9 PRO N 1 1 11 4932 1 1 9 PRO O O 6.001 -3.176 -0.279 1.00 . A A . 9 PRO O 1 1 11 4933 1 1 10 MET C C 8.192 -1.717 1.084 1.00 . A A . 10 MET C 1 1 11 4934 1 1 10 MET CA C 8.134 -1.425 -0.414 1.00 . A A . 10 MET CA 1 1 11 4935 1 1 10 MET CB C 9.040 -0.238 -0.751 1.00 . A A . 10 MET CB 1 1 11 4936 1 1 10 MET CE C 11.004 -1.451 -4.096 1.00 . A A . 10 MET CE 1 1 11 4937 1 1 10 MET CG C 9.403 -0.277 -2.237 1.00 . A A . 10 MET CG 1 1 11 4938 1 1 10 MET H H 6.543 -0.217 -1.123 1.00 . A A . 10 MET H 1 1 11 4939 1 1 10 MET HA H 8.474 -2.294 -0.954 1.00 . A A . 10 MET HA 1 1 11 4940 1 1 10 MET HB2 H 8.523 0.683 -0.530 1.00 . A A . 10 MET HB2 1 1 11 4941 1 1 10 MET HB3 H 9.941 -0.293 -0.163 1.00 . A A . 10 MET HB3 1 1 11 4942 1 1 10 MET HE1 H 11.852 -2.093 -4.295 1.00 . A A . 10 MET HE1 1 1 11 4943 1 1 10 MET HE2 H 10.996 -0.627 -4.798 1.00 . A A . 10 MET HE2 1 1 11 4944 1 1 10 MET HE3 H 10.095 -2.018 -4.199 1.00 . A A . 10 MET HE3 1 1 11 4945 1 1 10 MET HG2 H 8.757 -0.977 -2.748 1.00 . A A . 10 MET HG2 1 1 11 4946 1 1 10 MET HG3 H 9.280 0.707 -2.665 1.00 . A A . 10 MET HG3 1 1 11 4947 1 1 10 MET N N 6.765 -1.120 -0.801 1.00 . A A . 10 MET N 1 1 11 4948 1 1 10 MET O O 8.794 -2.699 1.517 1.00 . A A . 10 MET O 1 1 11 4949 1 1 10 MET SD S 11.126 -0.799 -2.413 1.00 . A A . 10 MET SD 1 1 11 4950 1 1 11 HIS C C 6.380 -2.013 3.702 1.00 . A A . 11 HIS C 1 1 11 4951 1 1 11 HIS CA C 7.497 -1.039 3.317 1.00 . A A . 11 HIS CA 1 1 11 4952 1 1 11 HIS CB C 7.271 0.318 3.994 1.00 . A A . 11 HIS CB 1 1 11 4953 1 1 11 HIS CD2 C 8.813 1.455 5.793 1.00 . A A . 11 HIS CD2 1 1 11 4954 1 1 11 HIS CE1 C 9.124 -0.264 7.077 1.00 . A A . 11 HIS CE1 1 1 11 4955 1 1 11 HIS CG C 8.116 0.411 5.236 1.00 . A A . 11 HIS CG 1 1 11 4956 1 1 11 HIS H H 7.060 -0.106 1.453 1.00 . A A . 11 HIS H 1 1 11 4957 1 1 11 HIS HA H 8.442 -1.444 3.649 1.00 . A A . 11 HIS HA 1 1 11 4958 1 1 11 HIS HB2 H 7.546 1.110 3.311 1.00 . A A . 11 HIS HB2 1 1 11 4959 1 1 11 HIS HB3 H 6.229 0.421 4.260 1.00 . A A . 11 HIS HB3 1 1 11 4960 1 1 11 HIS HD2 H 8.857 2.456 5.393 1.00 . A A . 11 HIS HD2 1 1 11 4961 1 1 11 HIS HE1 H 9.460 -0.903 7.883 1.00 . A A . 11 HIS HE1 1 1 11 4962 1 1 11 HIS HE2 H 10.019 1.557 7.552 1.00 . A A . 11 HIS HE2 1 1 11 4963 1 1 11 HIS N N 7.538 -0.866 1.865 1.00 . A A . 11 HIS N 1 1 11 4964 1 1 11 HIS ND1 N 8.328 -0.674 6.072 1.00 . A A . 11 HIS ND1 1 1 11 4965 1 1 11 HIS NE2 N 9.449 1.026 6.955 1.00 . A A . 11 HIS NE2 1 1 11 4966 1 1 11 HIS O O 5.724 -1.860 4.739 1.00 . A A . 11 HIS O 1 1 11 4967 1 1 12 CYS C C 5.744 -5.286 3.726 1.00 . A A . 12 CYS C 1 1 11 4968 1 1 12 CYS CA C 5.151 -4.035 3.093 1.00 . A A . 12 CYS CA 1 1 11 4969 1 1 12 CYS CB C 4.459 -4.405 1.787 1.00 . A A . 12 CYS CB 1 1 11 4970 1 1 12 CYS H H 6.748 -3.093 2.062 1.00 . A A . 12 CYS H 1 1 11 4971 1 1 12 CYS HA H 4.413 -3.627 3.767 1.00 . A A . 12 CYS HA 1 1 11 4972 1 1 12 CYS HB2 H 4.420 -3.541 1.146 1.00 . A A . 12 CYS HB2 1 1 11 4973 1 1 12 CYS HB3 H 5.004 -5.199 1.299 1.00 . A A . 12 CYS HB3 1 1 11 4974 1 1 12 CYS N N 6.183 -3.024 2.861 1.00 . A A . 12 CYS N 1 1 11 4975 1 1 12 CYS O O 6.891 -5.643 3.465 1.00 . A A . 12 CYS O 1 1 11 4976 1 1 12 CYS SG S 2.780 -4.959 2.150 1.00 . A A . 12 CYS SG 1 1 11 4977 1 1 13 LYS C C 4.951 -8.406 4.599 1.00 . A A . 13 LYS C 1 1 11 4978 1 1 13 LYS CA C 5.425 -7.120 5.291 1.00 . A A . 13 LYS CA 1 1 11 4979 1 1 13 LYS CB C 4.926 -7.092 6.744 1.00 . A A . 13 LYS CB 1 1 11 4980 1 1 13 LYS CD C 6.213 -4.966 7.169 1.00 . A A . 13 LYS CD 1 1 11 4981 1 1 13 LYS CE C 6.093 -3.482 7.541 1.00 . A A . 13 LYS CE 1 1 11 4982 1 1 13 LYS CG C 4.834 -5.641 7.250 1.00 . A A . 13 LYS CG 1 1 11 4983 1 1 13 LYS H H 4.065 -5.578 4.765 1.00 . A A . 13 LYS H 1 1 11 4984 1 1 13 LYS HA H 6.504 -7.117 5.301 1.00 . A A . 13 LYS HA 1 1 11 4985 1 1 13 LYS HB2 H 3.948 -7.551 6.795 1.00 . A A . 13 LYS HB2 1 1 11 4986 1 1 13 LYS HB3 H 5.612 -7.645 7.370 1.00 . A A . 13 LYS HB3 1 1 11 4987 1 1 13 LYS HD2 H 6.891 -5.454 7.856 1.00 . A A . 13 LYS HD2 1 1 11 4988 1 1 13 LYS HD3 H 6.598 -5.052 6.165 1.00 . A A . 13 LYS HD3 1 1 11 4989 1 1 13 LYS HE2 H 5.054 -3.182 7.505 1.00 . A A . 13 LYS HE2 1 1 11 4990 1 1 13 LYS HE3 H 6.476 -3.330 8.541 1.00 . A A . 13 LYS HE3 1 1 11 4991 1 1 13 LYS HG2 H 4.127 -5.093 6.643 1.00 . A A . 13 LYS HG2 1 1 11 4992 1 1 13 LYS HG3 H 4.497 -5.642 8.277 1.00 . A A . 13 LYS HG3 1 1 11 4993 1 1 13 LYS HZ1 H 7.323 -1.855 7.064 1.00 . A A . 13 LYS HZ1 1 1 11 4994 1 1 13 LYS HZ2 H 6.248 -2.296 5.814 1.00 . A A . 13 LYS HZ2 1 1 11 4995 1 1 13 LYS HZ3 H 7.628 -3.251 6.146 1.00 . A A . 13 LYS HZ3 1 1 11 4996 1 1 13 LYS N N 4.962 -5.925 4.587 1.00 . A A . 13 LYS N 1 1 11 4997 1 1 13 LYS NZ N 6.883 -2.664 6.573 1.00 . A A . 13 LYS NZ 1 1 11 4998 1 1 13 LYS O O 3.825 -8.499 4.104 1.00 . A A . 13 LYS O 1 1 11 4999 1 1 14 GLY C C 4.233 -11.280 4.267 1.00 . A A . 14 GLY C 1 1 11 5000 1 1 14 GLY CA C 5.605 -10.685 3.932 1.00 . A A . 14 GLY CA 1 1 11 5001 1 1 14 GLY H H 6.731 -9.222 4.970 1.00 . A A . 14 GLY H 1 1 11 5002 1 1 14 GLY HA2 H 5.674 -10.565 2.860 1.00 . A A . 14 GLY HA2 1 1 11 5003 1 1 14 GLY HA3 H 6.370 -11.379 4.251 1.00 . A A . 14 GLY HA3 1 1 11 5004 1 1 14 GLY N N 5.853 -9.385 4.565 1.00 . A A . 14 GLY N 1 1 11 5005 1 1 14 GLY O O 3.752 -11.175 5.394 1.00 . A A . 14 GLY O 1 1 11 5006 1 1 15 LYS C C 1.180 -11.673 2.957 1.00 . A A . 15 LYS C 1 1 11 5007 1 1 15 LYS CA C 2.329 -12.592 3.375 1.00 . A A . 15 LYS CA 1 1 11 5008 1 1 15 LYS CB C 2.099 -13.085 4.811 1.00 . A A . 15 LYS CB 1 1 11 5009 1 1 15 LYS CD C -0.296 -13.784 5.126 1.00 . A A . 15 LYS CD 1 1 11 5010 1 1 15 LYS CE C -1.304 -14.487 4.212 1.00 . A A . 15 LYS CE 1 1 11 5011 1 1 15 LYS CG C 1.125 -14.272 4.807 1.00 . A A . 15 LYS CG 1 1 11 5012 1 1 15 LYS H H 4.106 -11.971 2.398 1.00 . A A . 15 LYS H 1 1 11 5013 1 1 15 LYS HA H 2.329 -13.451 2.718 1.00 . A A . 15 LYS HA 1 1 11 5014 1 1 15 LYS HB2 H 3.041 -13.397 5.240 1.00 . A A . 15 LYS HB2 1 1 11 5015 1 1 15 LYS HB3 H 1.684 -12.285 5.405 1.00 . A A . 15 LYS HB3 1 1 11 5016 1 1 15 LYS HD2 H -0.528 -14.007 6.157 1.00 . A A . 15 LYS HD2 1 1 11 5017 1 1 15 LYS HD3 H -0.356 -12.719 4.970 1.00 . A A . 15 LYS HD3 1 1 11 5018 1 1 15 LYS HE2 H -0.896 -15.434 3.887 1.00 . A A . 15 LYS HE2 1 1 11 5019 1 1 15 LYS HE3 H -2.222 -14.660 4.758 1.00 . A A . 15 LYS HE3 1 1 11 5020 1 1 15 LYS HG2 H 1.137 -14.744 3.836 1.00 . A A . 15 LYS HG2 1 1 11 5021 1 1 15 LYS HG3 H 1.432 -14.986 5.557 1.00 . A A . 15 LYS HG3 1 1 11 5022 1 1 15 LYS HZ1 H -1.754 -14.228 2.192 1.00 . A A . 15 LYS HZ1 1 1 11 5023 1 1 15 LYS HZ2 H -0.755 -13.001 2.838 1.00 . A A . 15 LYS HZ2 1 1 11 5024 1 1 15 LYS HZ3 H -2.423 -13.042 3.205 1.00 . A A . 15 LYS HZ3 1 1 11 5025 1 1 15 LYS N N 3.637 -11.926 3.257 1.00 . A A . 15 LYS N 1 1 11 5026 1 1 15 LYS NZ N -1.584 -13.628 3.025 1.00 . A A . 15 LYS NZ 1 1 11 5027 1 1 15 LYS O O 0.111 -12.150 2.562 1.00 . A A . 15 LYS O 1 1 11 5028 1 1 16 MET C C 1.059 -8.203 1.954 1.00 . A A . 16 MET C 1 1 11 5029 1 1 16 MET CA C 0.386 -9.390 2.633 1.00 . A A . 16 MET CA 1 1 11 5030 1 1 16 MET CB C -0.419 -8.894 3.853 1.00 . A A . 16 MET CB 1 1 11 5031 1 1 16 MET CE C -1.042 -9.665 7.640 1.00 . A A . 16 MET CE 1 1 11 5032 1 1 16 MET CG C -0.232 -9.831 5.051 1.00 . A A . 16 MET CG 1 1 11 5033 1 1 16 MET H H 2.277 -10.042 3.340 1.00 . A A . 16 MET H 1 1 11 5034 1 1 16 MET HA H -0.291 -9.855 1.933 1.00 . A A . 16 MET HA 1 1 11 5035 1 1 16 MET HB2 H -0.086 -7.903 4.125 1.00 . A A . 16 MET HB2 1 1 11 5036 1 1 16 MET HB3 H -1.466 -8.857 3.595 1.00 . A A . 16 MET HB3 1 1 11 5037 1 1 16 MET HE1 H -0.482 -10.551 7.907 1.00 . A A . 16 MET HE1 1 1 11 5038 1 1 16 MET HE2 H -1.829 -9.498 8.362 1.00 . A A . 16 MET HE2 1 1 11 5039 1 1 16 MET HE3 H -0.379 -8.814 7.628 1.00 . A A . 16 MET HE3 1 1 11 5040 1 1 16 MET HG2 H 0.017 -10.820 4.706 1.00 . A A . 16 MET HG2 1 1 11 5041 1 1 16 MET HG3 H 0.564 -9.459 5.679 1.00 . A A . 16 MET HG3 1 1 11 5042 1 1 16 MET N N 1.405 -10.363 3.029 1.00 . A A . 16 MET N 1 1 11 5043 1 1 16 MET O O 1.596 -7.332 2.633 1.00 . A A . 16 MET O 1 1 11 5044 1 1 16 MET SD S -1.772 -9.890 6.002 1.00 . A A . 16 MET SD 1 1 11 5045 1 1 17 ALA C C 0.946 -6.576 -1.295 1.00 . A A . 17 ALA C 1 1 11 5046 1 1 17 ALA CA C 1.710 -7.056 -0.068 1.00 . A A . 17 ALA CA 1 1 11 5047 1 1 17 ALA CB C 3.121 -7.450 -0.478 1.00 . A A . 17 ALA CB 1 1 11 5048 1 1 17 ALA H H 0.634 -8.885 0.111 1.00 . A A . 17 ALA H 1 1 11 5049 1 1 17 ALA HA H 1.783 -6.230 0.619 1.00 . A A . 17 ALA HA 1 1 11 5050 1 1 17 ALA HB1 H 3.569 -6.636 -1.030 1.00 . A A . 17 ALA HB1 1 1 11 5051 1 1 17 ALA HB2 H 3.081 -8.331 -1.099 1.00 . A A . 17 ALA HB2 1 1 11 5052 1 1 17 ALA HB3 H 3.705 -7.652 0.407 1.00 . A A . 17 ALA HB3 1 1 11 5053 1 1 17 ALA N N 1.057 -8.166 0.623 1.00 . A A . 17 ALA N 1 1 11 5054 1 1 17 ALA O O 0.930 -7.226 -2.343 1.00 . A A . 17 ALA O 1 1 11 5055 1 1 18 LYS C C -0.558 -3.264 -1.916 1.00 . A A . 18 LYS C 1 1 11 5056 1 1 18 LYS CA C -0.356 -4.751 -2.246 1.00 . A A . 18 LYS CA 1 1 11 5057 1 1 18 LYS CB C -1.680 -5.473 -2.554 1.00 . A A . 18 LYS CB 1 1 11 5058 1 1 18 LYS CD C -4.169 -5.240 -2.648 1.00 . A A . 18 LYS CD 1 1 11 5059 1 1 18 LYS CE C -4.145 -4.919 -4.149 1.00 . A A . 18 LYS CE 1 1 11 5060 1 1 18 LYS CG C -2.885 -4.724 -1.978 1.00 . A A . 18 LYS CG 1 1 11 5061 1 1 18 LYS H H 0.470 -4.932 -0.301 1.00 . A A . 18 LYS H 1 1 11 5062 1 1 18 LYS HA H 0.270 -4.810 -3.125 1.00 . A A . 18 LYS HA 1 1 11 5063 1 1 18 LYS HB2 H -1.791 -5.553 -3.625 1.00 . A A . 18 LYS HB2 1 1 11 5064 1 1 18 LYS HB3 H -1.644 -6.467 -2.130 1.00 . A A . 18 LYS HB3 1 1 11 5065 1 1 18 LYS HD2 H -4.241 -6.308 -2.510 1.00 . A A . 18 LYS HD2 1 1 11 5066 1 1 18 LYS HD3 H -5.023 -4.759 -2.197 1.00 . A A . 18 LYS HD3 1 1 11 5067 1 1 18 LYS HE2 H -5.076 -4.447 -4.429 1.00 . A A . 18 LYS HE2 1 1 11 5068 1 1 18 LYS HE3 H -3.325 -4.247 -4.364 1.00 . A A . 18 LYS HE3 1 1 11 5069 1 1 18 LYS HG2 H -2.937 -4.896 -0.914 1.00 . A A . 18 LYS HG2 1 1 11 5070 1 1 18 LYS HG3 H -2.787 -3.666 -2.168 1.00 . A A . 18 LYS HG3 1 1 11 5071 1 1 18 LYS HZ1 H -4.666 -6.889 -4.604 1.00 . A A . 18 LYS HZ1 1 1 11 5072 1 1 18 LYS HZ2 H -3.015 -6.558 -4.783 1.00 . A A . 18 LYS HZ2 1 1 11 5073 1 1 18 LYS HZ3 H -4.124 -5.993 -5.941 1.00 . A A . 18 LYS HZ3 1 1 11 5074 1 1 18 LYS N N 0.365 -5.398 -1.153 1.00 . A A . 18 LYS N 1 1 11 5075 1 1 18 LYS NZ N -3.974 -6.185 -4.927 1.00 . A A . 18 LYS NZ 1 1 11 5076 1 1 18 LYS O O -1.059 -2.907 -0.833 1.00 . A A . 18 LYS O 1 1 11 5077 1 1 19 PRO C C -1.629 -0.360 -2.657 1.00 . A A . 19 PRO C 1 1 11 5078 1 1 19 PRO CA C -0.211 -0.921 -2.609 1.00 . A A . 19 PRO CA 1 1 11 5079 1 1 19 PRO CB C 0.629 -0.361 -3.760 1.00 . A A . 19 PRO CB 1 1 11 5080 1 1 19 PRO CD C 0.460 -2.744 -4.111 1.00 . A A . 19 PRO CD 1 1 11 5081 1 1 19 PRO CG C 0.573 -1.400 -4.826 1.00 . A A . 19 PRO CG 1 1 11 5082 1 1 19 PRO HA H 0.252 -0.653 -1.677 1.00 . A A . 19 PRO HA 1 1 11 5083 1 1 19 PRO HB2 H 0.207 0.570 -4.115 1.00 . A A . 19 PRO HB2 1 1 11 5084 1 1 19 PRO HB3 H 1.650 -0.213 -3.442 1.00 . A A . 19 PRO HB3 1 1 11 5085 1 1 19 PRO HD2 H -0.187 -3.412 -4.664 1.00 . A A . 19 PRO HD2 1 1 11 5086 1 1 19 PRO HD3 H 1.436 -3.185 -3.972 1.00 . A A . 19 PRO HD3 1 1 11 5087 1 1 19 PRO HG2 H -0.293 -1.237 -5.456 1.00 . A A . 19 PRO HG2 1 1 11 5088 1 1 19 PRO HG3 H 1.474 -1.378 -5.419 1.00 . A A . 19 PRO HG3 1 1 11 5089 1 1 19 PRO N N -0.135 -2.400 -2.807 1.00 . A A . 19 PRO N 1 1 11 5090 1 1 19 PRO O O -2.405 -0.657 -3.569 1.00 . A A . 19 PRO O 1 1 11 5091 1 1 20 THR C C -3.069 2.592 -1.255 1.00 . A A . 20 THR C 1 1 11 5092 1 1 20 THR CA C -3.245 1.118 -1.598 1.00 . A A . 20 THR CA 1 1 11 5093 1 1 20 THR CB C -4.131 0.441 -0.549 1.00 . A A . 20 THR CB 1 1 11 5094 1 1 20 THR CG2 C -4.052 -1.073 -0.712 1.00 . A A . 20 THR CG2 1 1 11 5095 1 1 20 THR H H -1.270 0.680 -0.991 1.00 . A A . 20 THR H 1 1 11 5096 1 1 20 THR HA H -3.726 1.043 -2.561 1.00 . A A . 20 THR HA 1 1 11 5097 1 1 20 THR HB H -5.149 0.759 -0.685 1.00 . A A . 20 THR HB 1 1 11 5098 1 1 20 THR HG1 H -2.733 0.616 0.797 1.00 . A A . 20 THR HG1 1 1 11 5099 1 1 20 THR HG21 H -4.191 -1.332 -1.750 1.00 . A A . 20 THR HG21 1 1 11 5100 1 1 20 THR HG22 H -4.825 -1.537 -0.120 1.00 . A A . 20 THR HG22 1 1 11 5101 1 1 20 THR HG23 H -3.085 -1.421 -0.382 1.00 . A A . 20 THR HG23 1 1 11 5102 1 1 20 THR N N -1.941 0.475 -1.673 1.00 . A A . 20 THR N 1 1 11 5103 1 1 20 THR O O -2.595 2.937 -0.169 1.00 . A A . 20 THR O 1 1 11 5104 1 1 20 THR OG1 O -3.691 0.798 0.753 1.00 . A A . 20 THR OG1 1 1 11 5105 1 1 21 CYS C C -4.673 5.552 -2.217 1.00 . A A . 21 CYS C 1 1 11 5106 1 1 21 CYS CA C -3.314 4.892 -2.021 1.00 . A A . 21 CYS CA 1 1 11 5107 1 1 21 CYS CB C -2.296 5.465 -3.009 1.00 . A A . 21 CYS CB 1 1 11 5108 1 1 21 CYS H H -3.787 3.092 -3.049 1.00 . A A . 21 CYS H 1 1 11 5109 1 1 21 CYS HA H -2.975 5.093 -1.019 1.00 . A A . 21 CYS HA 1 1 11 5110 1 1 21 CYS HB2 H -2.202 4.802 -3.854 1.00 . A A . 21 CYS HB2 1 1 11 5111 1 1 21 CYS HB3 H -2.622 6.438 -3.347 1.00 . A A . 21 CYS HB3 1 1 11 5112 1 1 21 CYS N N -3.433 3.448 -2.199 1.00 . A A . 21 CYS N 1 1 11 5113 1 1 21 CYS O O -5.268 5.477 -3.295 1.00 . A A . 21 CYS O 1 1 11 5114 1 1 21 CYS SG S -0.693 5.619 -2.178 1.00 . A A . 21 CYS SG 1 1 11 5115 1 1 22 GLU C C -6.385 8.154 -0.429 1.00 . A A . 22 GLU C 1 1 11 5116 1 1 22 GLU CA C -6.455 6.827 -1.179 1.00 . A A . 22 GLU CA 1 1 11 5117 1 1 22 GLU CB C -7.508 5.903 -0.545 1.00 . A A . 22 GLU CB 1 1 11 5118 1 1 22 GLU CD C -6.612 3.605 0.031 1.00 . A A . 22 GLU CD 1 1 11 5119 1 1 22 GLU CG C -6.868 5.024 0.549 1.00 . A A . 22 GLU CG 1 1 11 5120 1 1 22 GLU H H -4.649 6.190 -0.328 1.00 . A A . 22 GLU H 1 1 11 5121 1 1 22 GLU HA H -6.733 7.020 -2.205 1.00 . A A . 22 GLU HA 1 1 11 5122 1 1 22 GLU HB2 H -8.296 6.500 -0.110 1.00 . A A . 22 GLU HB2 1 1 11 5123 1 1 22 GLU HB3 H -7.927 5.267 -1.310 1.00 . A A . 22 GLU HB3 1 1 11 5124 1 1 22 GLU HG2 H -5.934 5.461 0.861 1.00 . A A . 22 GLU HG2 1 1 11 5125 1 1 22 GLU HG3 H -7.535 4.974 1.397 1.00 . A A . 22 GLU HG3 1 1 11 5126 1 1 22 GLU N N -5.163 6.177 -1.155 1.00 . A A . 22 GLU N 1 1 11 5127 1 1 22 GLU O O -6.217 8.185 0.783 1.00 . A A . 22 GLU O 1 1 11 5128 1 1 22 GLU OE1 O -5.990 3.469 -1.005 1.00 . A A . 22 GLU OE1 1 1 11 5129 1 1 22 GLU OE2 O -7.031 2.667 0.692 1.00 . A A . 22 GLU OE2 1 1 11 5130 1 1 23 ASN C C -5.032 10.905 -0.104 1.00 . A A . 23 ASN C 1 1 11 5131 1 1 23 ASN CA C -6.431 10.607 -0.660 1.00 . A A . 23 ASN CA 1 1 11 5132 1 1 23 ASN CB C -7.554 10.847 0.387 1.00 . A A . 23 ASN CB 1 1 11 5133 1 1 23 ASN CG C -7.050 10.832 1.833 1.00 . A A . 23 ASN CG 1 1 11 5134 1 1 23 ASN H H -6.596 9.103 -2.149 1.00 . A A . 23 ASN H 1 1 11 5135 1 1 23 ASN HA H -6.600 11.284 -1.489 1.00 . A A . 23 ASN HA 1 1 11 5136 1 1 23 ASN HB2 H -8.008 11.805 0.194 1.00 . A A . 23 ASN HB2 1 1 11 5137 1 1 23 ASN HB3 H -8.303 10.078 0.271 1.00 . A A . 23 ASN HB3 1 1 11 5138 1 1 23 ASN HD21 H -6.529 8.921 1.814 1.00 . A A . 23 ASN HD21 1 1 11 5139 1 1 23 ASN HD22 H -6.254 9.748 3.276 1.00 . A A . 23 ASN HD22 1 1 11 5140 1 1 23 ASN N N -6.490 9.234 -1.189 1.00 . A A . 23 ASN N 1 1 11 5141 1 1 23 ASN ND2 N -6.572 9.747 2.352 1.00 . A A . 23 ASN ND2 1 1 11 5142 1 1 23 ASN O O -4.867 11.469 0.974 1.00 . A A . 23 ASN O 1 1 11 5143 1 1 23 ASN OD1 O -7.109 11.851 2.514 1.00 . A A . 23 ASN OD1 1 1 11 5144 1 1 24 GLU C C -2.218 9.851 0.669 1.00 . A A . 24 GLU C 1 1 11 5145 1 1 24 GLU CA C -2.621 10.732 -0.509 1.00 . A A . 24 GLU CA 1 1 11 5146 1 1 24 GLU CB C -2.361 12.214 -0.192 1.00 . A A . 24 GLU CB 1 1 11 5147 1 1 24 GLU CD C -1.982 12.304 -2.670 1.00 . A A . 24 GLU CD 1 1 11 5148 1 1 24 GLU CG C -2.539 13.052 -1.467 1.00 . A A . 24 GLU CG 1 1 11 5149 1 1 24 GLU H H -4.224 10.085 -1.735 1.00 . A A . 24 GLU H 1 1 11 5150 1 1 24 GLU HA H -2.006 10.454 -1.350 1.00 . A A . 24 GLU HA 1 1 11 5151 1 1 24 GLU HB2 H -3.054 12.552 0.563 1.00 . A A . 24 GLU HB2 1 1 11 5152 1 1 24 GLU HB3 H -1.350 12.330 0.171 1.00 . A A . 24 GLU HB3 1 1 11 5153 1 1 24 GLU HG2 H -3.589 13.246 -1.624 1.00 . A A . 24 GLU HG2 1 1 11 5154 1 1 24 GLU HG3 H -2.013 13.989 -1.357 1.00 . A A . 24 GLU HG3 1 1 11 5155 1 1 24 GLU N N -4.022 10.519 -0.881 1.00 . A A . 24 GLU N 1 1 11 5156 1 1 24 GLU O O -1.063 9.862 1.094 1.00 . A A . 24 GLU O 1 1 11 5157 1 1 24 GLU OE1 O -0.780 12.352 -2.875 1.00 . A A . 24 GLU OE1 1 1 11 5158 1 1 24 GLU OE2 O -2.766 11.680 -3.373 1.00 . A A . 24 GLU OE2 1 1 11 5159 1 1 25 VAL C C -2.619 6.762 1.711 1.00 . A A . 25 VAL C 1 1 11 5160 1 1 25 VAL CA C -2.872 8.155 2.275 1.00 . A A . 25 VAL CA 1 1 11 5161 1 1 25 VAL CB C -4.044 8.122 3.263 1.00 . A A . 25 VAL CB 1 1 11 5162 1 1 25 VAL CG1 C -3.860 6.963 4.247 1.00 . A A . 25 VAL CG1 1 1 11 5163 1 1 25 VAL CG2 C -4.087 9.438 4.044 1.00 . A A . 25 VAL CG2 1 1 11 5164 1 1 25 VAL H H -4.062 9.074 0.780 1.00 . A A . 25 VAL H 1 1 11 5165 1 1 25 VAL HA H -1.985 8.495 2.790 1.00 . A A . 25 VAL HA 1 1 11 5166 1 1 25 VAL HB H -4.970 7.991 2.722 1.00 . A A . 25 VAL HB 1 1 11 5167 1 1 25 VAL HG11 H -4.159 6.039 3.774 1.00 . A A . 25 VAL HG11 1 1 11 5168 1 1 25 VAL HG12 H -4.470 7.133 5.121 1.00 . A A . 25 VAL HG12 1 1 11 5169 1 1 25 VAL HG13 H -2.822 6.899 4.538 1.00 . A A . 25 VAL HG13 1 1 11 5170 1 1 25 VAL HG21 H -3.172 9.554 4.607 1.00 . A A . 25 VAL HG21 1 1 11 5171 1 1 25 VAL HG22 H -4.926 9.428 4.724 1.00 . A A . 25 VAL HG22 1 1 11 5172 1 1 25 VAL HG23 H -4.193 10.265 3.355 1.00 . A A . 25 VAL HG23 1 1 11 5173 1 1 25 VAL N N -3.162 9.062 1.172 1.00 . A A . 25 VAL N 1 1 11 5174 1 1 25 VAL O O -3.542 6.091 1.242 1.00 . A A . 25 VAL O 1 1 11 5175 1 1 26 CYS C C -0.814 4.003 2.269 1.00 . A A . 26 CYS C 1 1 11 5176 1 1 26 CYS CA C -0.974 5.058 1.178 1.00 . A A . 26 CYS CA 1 1 11 5177 1 1 26 CYS CB C 0.343 5.190 0.415 1.00 . A A . 26 CYS CB 1 1 11 5178 1 1 26 CYS H H -0.660 6.943 2.076 1.00 . A A . 26 CYS H 1 1 11 5179 1 1 26 CYS HA H -1.735 4.735 0.491 1.00 . A A . 26 CYS HA 1 1 11 5180 1 1 26 CYS HB2 H 0.342 4.507 -0.413 1.00 . A A . 26 CYS HB2 1 1 11 5181 1 1 26 CYS HB3 H 0.452 6.197 0.049 1.00 . A A . 26 CYS HB3 1 1 11 5182 1 1 26 CYS N N -1.354 6.352 1.721 1.00 . A A . 26 CYS N 1 1 11 5183 1 1 26 CYS O O -0.249 4.264 3.332 1.00 . A A . 26 CYS O 1 1 11 5184 1 1 26 CYS SG S 1.722 4.796 1.513 1.00 . A A . 26 CYS SG 1 1 11 5185 1 1 27 LYS C C -1.071 0.364 2.171 1.00 . A A . 27 LYS C 1 1 11 5186 1 1 27 LYS CA C -1.206 1.687 2.927 1.00 . A A . 27 LYS CA 1 1 11 5187 1 1 27 LYS CB C -2.446 1.610 3.836 1.00 . A A . 27 LYS CB 1 1 11 5188 1 1 27 LYS CD C -4.223 3.083 2.842 1.00 . A A . 27 LYS CD 1 1 11 5189 1 1 27 LYS CE C -5.338 2.064 3.100 1.00 . A A . 27 LYS CE 1 1 11 5190 1 1 27 LYS CG C -3.150 2.972 3.932 1.00 . A A . 27 LYS CG 1 1 11 5191 1 1 27 LYS H H -1.745 2.657 1.114 1.00 . A A . 27 LYS H 1 1 11 5192 1 1 27 LYS HA H -0.330 1.829 3.543 1.00 . A A . 27 LYS HA 1 1 11 5193 1 1 27 LYS HB2 H -3.135 0.882 3.434 1.00 . A A . 27 LYS HB2 1 1 11 5194 1 1 27 LYS HB3 H -2.141 1.300 4.825 1.00 . A A . 27 LYS HB3 1 1 11 5195 1 1 27 LYS HD2 H -4.641 4.080 2.849 1.00 . A A . 27 LYS HD2 1 1 11 5196 1 1 27 LYS HD3 H -3.779 2.891 1.878 1.00 . A A . 27 LYS HD3 1 1 11 5197 1 1 27 LYS HE2 H -5.042 1.391 3.893 1.00 . A A . 27 LYS HE2 1 1 11 5198 1 1 27 LYS HE3 H -6.242 2.583 3.387 1.00 . A A . 27 LYS HE3 1 1 11 5199 1 1 27 LYS HG2 H -3.613 3.066 4.902 1.00 . A A . 27 LYS HG2 1 1 11 5200 1 1 27 LYS HG3 H -2.429 3.763 3.806 1.00 . A A . 27 LYS HG3 1 1 11 5201 1 1 27 LYS HZ1 H -6.283 1.817 1.247 1.00 . A A . 27 LYS HZ1 1 1 11 5202 1 1 27 LYS HZ2 H -5.963 0.337 2.082 1.00 . A A . 27 LYS HZ2 1 1 11 5203 1 1 27 LYS HZ3 H -4.670 1.180 1.324 1.00 . A A . 27 LYS HZ3 1 1 11 5204 1 1 27 LYS N N -1.308 2.801 1.984 1.00 . A A . 27 LYS N 1 1 11 5205 1 1 27 LYS NZ N -5.582 1.292 1.852 1.00 . A A . 27 LYS NZ 1 1 11 5206 1 1 27 LYS O O -1.503 0.248 1.020 1.00 . A A . 27 LYS O 1 1 11 5207 1 1 28 CYS C C -1.511 -2.842 2.685 1.00 . A A . 28 CYS C 1 1 11 5208 1 1 28 CYS CA C -0.360 -1.960 2.216 1.00 . A A . 28 CYS CA 1 1 11 5209 1 1 28 CYS CB C 0.977 -2.586 2.614 1.00 . A A . 28 CYS CB 1 1 11 5210 1 1 28 CYS H H -0.203 -0.502 3.749 1.00 . A A . 28 CYS H 1 1 11 5211 1 1 28 CYS HA H -0.403 -1.861 1.142 1.00 . A A . 28 CYS HA 1 1 11 5212 1 1 28 CYS HB2 H 1.689 -1.805 2.839 1.00 . A A . 28 CYS HB2 1 1 11 5213 1 1 28 CYS HB3 H 0.841 -3.210 3.485 1.00 . A A . 28 CYS HB3 1 1 11 5214 1 1 28 CYS N N -0.504 -0.641 2.828 1.00 . A A . 28 CYS N 1 1 11 5215 1 1 28 CYS O O -1.425 -3.473 3.737 1.00 . A A . 28 CYS O 1 1 11 5216 1 1 28 CYS SG S 1.602 -3.593 1.247 1.00 . A A . 28 CYS SG 1 1 11 5217 1 1 29 ASN C C -4.452 -4.312 1.117 1.00 . A A . 29 ASN C 1 1 11 5218 1 1 29 ASN CA C -3.768 -3.651 2.311 1.00 . A A . 29 ASN CA 1 1 11 5219 1 1 29 ASN CB C -4.765 -2.773 3.100 1.00 . A A . 29 ASN CB 1 1 11 5220 1 1 29 ASN CG C -5.843 -2.170 2.197 1.00 . A A . 29 ASN CG 1 1 11 5221 1 1 29 ASN H H -2.619 -2.328 1.089 1.00 . A A . 29 ASN H 1 1 11 5222 1 1 29 ASN HA H -3.429 -4.434 2.967 1.00 . A A . 29 ASN HA 1 1 11 5223 1 1 29 ASN HB2 H -5.242 -3.376 3.857 1.00 . A A . 29 ASN HB2 1 1 11 5224 1 1 29 ASN HB3 H -4.221 -1.974 3.581 1.00 . A A . 29 ASN HB3 1 1 11 5225 1 1 29 ASN HD21 H -6.689 -3.914 1.761 1.00 . A A . 29 ASN HD21 1 1 11 5226 1 1 29 ASN HD22 H -7.404 -2.554 1.043 1.00 . A A . 29 ASN HD22 1 1 11 5227 1 1 29 ASN N N -2.600 -2.860 1.919 1.00 . A A . 29 ASN N 1 1 11 5228 1 1 29 ASN ND2 N -6.717 -2.944 1.619 1.00 . A A . 29 ASN ND2 1 1 11 5229 1 1 29 ASN O O -4.576 -3.728 0.045 1.00 . A A . 29 ASN O 1 1 11 5230 1 1 29 ASN OD1 O -5.906 -0.950 2.036 1.00 . A A . 29 ASN OD1 1 1 11 5231 1 1 30 ILE C C -7.016 -5.784 0.103 1.00 . A A . 30 ILE C 1 1 11 5232 1 1 30 ILE CA C -5.594 -6.294 0.290 1.00 . A A . 30 ILE CA 1 1 11 5233 1 1 30 ILE CB C -5.628 -7.796 0.614 1.00 . A A . 30 ILE CB 1 1 11 5234 1 1 30 ILE CD1 C -3.865 -7.861 2.374 1.00 . A A . 30 ILE CD1 1 1 11 5235 1 1 30 ILE CG1 C -5.359 -8.021 2.103 1.00 . A A . 30 ILE CG1 1 1 11 5236 1 1 30 ILE CG2 C -4.564 -8.527 -0.214 1.00 . A A . 30 ILE CG2 1 1 11 5237 1 1 30 ILE H H -4.783 -5.943 2.212 1.00 . A A . 30 ILE H 1 1 11 5238 1 1 30 ILE HA H -5.062 -6.159 -0.637 1.00 . A A . 30 ILE HA 1 1 11 5239 1 1 30 ILE HB H -6.602 -8.192 0.364 1.00 . A A . 30 ILE HB 1 1 11 5240 1 1 30 ILE HD11 H -3.723 -7.375 3.326 1.00 . A A . 30 ILE HD11 1 1 11 5241 1 1 30 ILE HD12 H -3.420 -7.262 1.592 1.00 . A A . 30 ILE HD12 1 1 11 5242 1 1 30 ILE HD13 H -3.400 -8.833 2.390 1.00 . A A . 30 ILE HD13 1 1 11 5243 1 1 30 ILE HG12 H -5.916 -7.302 2.685 1.00 . A A . 30 ILE HG12 1 1 11 5244 1 1 30 ILE HG13 H -5.666 -9.020 2.377 1.00 . A A . 30 ILE HG13 1 1 11 5245 1 1 30 ILE HG21 H -4.881 -8.577 -1.244 1.00 . A A . 30 ILE HG21 1 1 11 5246 1 1 30 ILE HG22 H -4.436 -9.528 0.171 1.00 . A A . 30 ILE HG22 1 1 11 5247 1 1 30 ILE HG23 H -3.628 -7.994 -0.149 1.00 . A A . 30 ILE HG23 1 1 11 5248 1 1 30 ILE N N -4.903 -5.539 1.330 1.00 . A A . 30 ILE N 1 1 11 5249 1 1 30 ILE O O -7.682 -5.394 1.062 1.00 . A A . 30 ILE O 1 1 11 5250 1 1 31 GLY C C -8.821 -4.056 -2.302 1.00 . A A . 31 GLY C 1 1 11 5251 1 1 31 GLY CA C -8.818 -5.343 -1.480 1.00 . A A . 31 GLY CA 1 1 11 5252 1 1 31 GLY H H -6.876 -6.126 -1.847 1.00 . A A . 31 GLY H 1 1 11 5253 1 1 31 GLY HA2 H -9.319 -6.117 -2.041 1.00 . A A . 31 GLY HA2 1 1 11 5254 1 1 31 GLY HA3 H -9.360 -5.168 -0.566 1.00 . A A . 31 GLY HA3 1 1 11 5255 1 1 31 GLY N N -7.465 -5.795 -1.142 1.00 . A A . 31 GLY N 1 1 11 5256 1 1 31 GLY O O -9.799 -3.762 -2.985 1.00 . A A . 31 GLY O 1 1 11 5257 1 1 32 LYS C C -6.350 -2.024 -3.826 1.00 . A A . 32 LYS C 1 1 11 5258 1 1 32 LYS CA C -7.634 -2.054 -3.003 1.00 . A A . 32 LYS CA 1 1 11 5259 1 1 32 LYS CB C -7.667 -0.849 -2.055 1.00 . A A . 32 LYS CB 1 1 11 5260 1 1 32 LYS CD C -6.628 1.136 -3.204 1.00 . A A . 32 LYS CD 1 1 11 5261 1 1 32 LYS CE C -6.913 2.471 -3.902 1.00 . A A . 32 LYS CE 1 1 11 5262 1 1 32 LYS CG C -7.950 0.436 -2.852 1.00 . A A . 32 LYS CG 1 1 11 5263 1 1 32 LYS H H -6.982 -3.588 -1.688 1.00 . A A . 32 LYS H 1 1 11 5264 1 1 32 LYS HA H -8.476 -1.992 -3.673 1.00 . A A . 32 LYS HA 1 1 11 5265 1 1 32 LYS HB2 H -8.446 -0.994 -1.321 1.00 . A A . 32 LYS HB2 1 1 11 5266 1 1 32 LYS HB3 H -6.715 -0.758 -1.553 1.00 . A A . 32 LYS HB3 1 1 11 5267 1 1 32 LYS HD2 H -6.069 1.319 -2.301 1.00 . A A . 32 LYS HD2 1 1 11 5268 1 1 32 LYS HD3 H -6.050 0.506 -3.862 1.00 . A A . 32 LYS HD3 1 1 11 5269 1 1 32 LYS HE2 H -7.948 2.501 -4.217 1.00 . A A . 32 LYS HE2 1 1 11 5270 1 1 32 LYS HE3 H -6.726 3.283 -3.214 1.00 . A A . 32 LYS HE3 1 1 11 5271 1 1 32 LYS HG2 H -8.481 0.188 -3.760 1.00 . A A . 32 LYS HG2 1 1 11 5272 1 1 32 LYS HG3 H -8.556 1.102 -2.254 1.00 . A A . 32 LYS HG3 1 1 11 5273 1 1 32 LYS HZ1 H -6.145 1.779 -5.726 1.00 . A A . 32 LYS HZ1 1 1 11 5274 1 1 32 LYS HZ2 H -5.005 2.652 -4.774 1.00 . A A . 32 LYS HZ2 1 1 11 5275 1 1 32 LYS HZ3 H -6.261 3.478 -5.606 1.00 . A A . 32 LYS HZ3 1 1 11 5276 1 1 32 LYS N N -7.731 -3.303 -2.243 1.00 . A A . 32 LYS N 1 1 11 5277 1 1 32 LYS NZ N -6.022 2.609 -5.091 1.00 . A A . 32 LYS NZ 1 1 11 5278 1 1 32 LYS O O -5.298 -2.461 -3.364 1.00 . A A . 32 LYS O 1 1 11 5279 1 1 33 LYS C C -5.070 0.038 -6.378 1.00 . A A . 33 LYS C 1 1 11 5280 1 1 33 LYS CA C -5.275 -1.408 -5.919 1.00 . A A . 33 LYS CA 1 1 11 5281 1 1 33 LYS CB C -5.446 -2.347 -7.126 1.00 . A A . 33 LYS CB 1 1 11 5282 1 1 33 LYS CD C -5.147 -1.161 -9.314 1.00 . A A . 33 LYS CD 1 1 11 5283 1 1 33 LYS CE C -5.632 0.128 -9.983 1.00 . A A . 33 LYS CE 1 1 11 5284 1 1 33 LYS CG C -6.175 -1.634 -8.276 1.00 . A A . 33 LYS CG 1 1 11 5285 1 1 33 LYS H H -7.307 -1.164 -5.361 1.00 . A A . 33 LYS H 1 1 11 5286 1 1 33 LYS HA H -4.400 -1.716 -5.363 1.00 . A A . 33 LYS HA 1 1 11 5287 1 1 33 LYS HB2 H -4.473 -2.671 -7.466 1.00 . A A . 33 LYS HB2 1 1 11 5288 1 1 33 LYS HB3 H -6.022 -3.211 -6.824 1.00 . A A . 33 LYS HB3 1 1 11 5289 1 1 33 LYS HD2 H -4.202 -0.976 -8.823 1.00 . A A . 33 LYS HD2 1 1 11 5290 1 1 33 LYS HD3 H -5.018 -1.925 -10.064 1.00 . A A . 33 LYS HD3 1 1 11 5291 1 1 33 LYS HE2 H -6.308 -0.115 -10.790 1.00 . A A . 33 LYS HE2 1 1 11 5292 1 1 33 LYS HE3 H -6.145 0.743 -9.256 1.00 . A A . 33 LYS HE3 1 1 11 5293 1 1 33 LYS HG2 H -6.867 -2.322 -8.743 1.00 . A A . 33 LYS HG2 1 1 11 5294 1 1 33 LYS HG3 H -6.721 -0.785 -7.893 1.00 . A A . 33 LYS HG3 1 1 11 5295 1 1 33 LYS HZ1 H -4.596 1.897 -10.384 1.00 . A A . 33 LYS HZ1 1 1 11 5296 1 1 33 LYS HZ2 H -4.330 0.664 -11.527 1.00 . A A . 33 LYS HZ2 1 1 11 5297 1 1 33 LYS HZ3 H -3.583 0.586 -9.982 1.00 . A A . 33 LYS HZ3 1 1 11 5298 1 1 33 LYS N N -6.442 -1.500 -5.046 1.00 . A A . 33 LYS N 1 1 11 5299 1 1 33 LYS NZ N -4.456 0.871 -10.518 1.00 . A A . 33 LYS NZ 1 1 11 5300 1 1 33 LYS O O -6.034 0.803 -6.505 1.00 . A A . 33 LYS O 1 1 11 5301 1 1 34 ASP C C -3.211 1.804 -8.535 1.00 . A A . 34 ASP C 1 1 11 5302 1 1 34 ASP CA C -3.495 1.768 -7.037 1.00 . A A . 34 ASP CA 1 1 11 5303 1 1 34 ASP CB C -2.277 2.275 -6.261 1.00 . A A . 34 ASP CB 1 1 11 5304 1 1 34 ASP CG C -2.622 2.458 -4.789 1.00 . A A . 34 ASP CG 1 1 11 5305 1 1 34 ASP H H -3.095 -0.233 -6.475 1.00 . A A . 34 ASP H 1 1 11 5306 1 1 34 ASP HA H -4.334 2.415 -6.829 1.00 . A A . 34 ASP HA 1 1 11 5307 1 1 34 ASP HB2 H -1.474 1.559 -6.354 1.00 . A A . 34 ASP HB2 1 1 11 5308 1 1 34 ASP HB3 H -1.960 3.221 -6.673 1.00 . A A . 34 ASP HB3 1 1 11 5309 1 1 34 ASP N N -3.819 0.411 -6.606 1.00 . A A . 34 ASP N 1 1 11 5310 1 1 34 ASP O O -3.581 2.783 -9.167 1.00 . A A . 34 ASP O 1 1 11 5311 1 1 34 ASP OXT O -2.658 0.835 -9.045 1.00 . A A . 34 ASP OXT 1 1 11 5312 1 1 34 ASP OD1 O -3.795 2.631 -4.480 1.00 . A A . 34 ASP OD1 1 1 11 5313 1 1 34 ASP OD2 O -1.709 2.437 -3.984 1.00 . A A . 34 ASP OD2 1 1 12 5314 1 1 1 GLY C C 1.569 11.402 -5.097 1.00 . A A . 1 GLY C 1 1 12 5315 1 1 1 GLY CA C 0.204 11.520 -5.762 1.00 . A A . 1 GLY CA 1 1 12 5316 1 1 1 GLY H1 H -1.740 10.843 -5.413 1.00 . A A . 1 GLY H1 1 1 12 5317 1 1 1 GLY H2 H -0.799 11.011 -4.005 1.00 . A A . 1 GLY H2 1 1 12 5318 1 1 1 GLY H3 H -0.536 9.697 -5.062 1.00 . A A . 1 GLY H3 1 1 12 5319 1 1 1 GLY HA2 H 0.268 11.164 -6.779 1.00 . A A . 1 GLY HA2 1 1 12 5320 1 1 1 GLY HA3 H -0.103 12.555 -5.761 1.00 . A A . 1 GLY HA3 1 1 12 5321 1 1 1 GLY N N -0.792 10.703 -5.007 1.00 . A A . 1 GLY N 1 1 12 5322 1 1 1 GLY O O 2.581 11.227 -5.773 1.00 . A A . 1 GLY O 1 1 12 5323 1 1 2 SER C C 3.583 10.101 -3.367 1.00 . A A . 2 SER C 1 1 12 5324 1 1 2 SER CA C 2.852 11.397 -3.027 1.00 . A A . 2 SER CA 1 1 12 5325 1 1 2 SER CB C 2.593 11.429 -1.525 1.00 . A A . 2 SER CB 1 1 12 5326 1 1 2 SER H H 0.747 11.645 -3.275 1.00 . A A . 2 SER H 1 1 12 5327 1 1 2 SER HA H 3.482 12.233 -3.289 1.00 . A A . 2 SER HA 1 1 12 5328 1 1 2 SER HB2 H 1.997 12.292 -1.276 1.00 . A A . 2 SER HB2 1 1 12 5329 1 1 2 SER HB3 H 2.067 10.530 -1.235 1.00 . A A . 2 SER HB3 1 1 12 5330 1 1 2 SER HG H 3.779 12.186 -0.172 1.00 . A A . 2 SER HG 1 1 12 5331 1 1 2 SER N N 1.593 11.499 -3.768 1.00 . A A . 2 SER N 1 1 12 5332 1 1 2 SER O O 2.973 9.127 -3.814 1.00 . A A . 2 SER O 1 1 12 5333 1 1 2 SER OG O 3.843 11.501 -0.846 1.00 . A A . 2 SER OG 1 1 12 5334 1 1 3 VAL C C 5.340 7.767 -2.484 1.00 . A A . 3 VAL C 1 1 12 5335 1 1 3 VAL CA C 5.704 8.914 -3.428 1.00 . A A . 3 VAL CA 1 1 12 5336 1 1 3 VAL CB C 7.204 9.235 -3.303 1.00 . A A . 3 VAL CB 1 1 12 5337 1 1 3 VAL CG1 C 7.952 8.709 -4.534 1.00 . A A . 3 VAL CG1 1 1 12 5338 1 1 3 VAL CG2 C 7.418 10.750 -3.205 1.00 . A A . 3 VAL CG2 1 1 12 5339 1 1 3 VAL H H 5.320 10.898 -2.779 1.00 . A A . 3 VAL H 1 1 12 5340 1 1 3 VAL HA H 5.498 8.599 -4.438 1.00 . A A . 3 VAL HA 1 1 12 5341 1 1 3 VAL HB H 7.600 8.757 -2.416 1.00 . A A . 3 VAL HB 1 1 12 5342 1 1 3 VAL HG11 H 7.269 8.165 -5.169 1.00 . A A . 3 VAL HG11 1 1 12 5343 1 1 3 VAL HG12 H 8.747 8.052 -4.217 1.00 . A A . 3 VAL HG12 1 1 12 5344 1 1 3 VAL HG13 H 8.370 9.539 -5.084 1.00 . A A . 3 VAL HG13 1 1 12 5345 1 1 3 VAL HG21 H 6.856 11.246 -3.983 1.00 . A A . 3 VAL HG21 1 1 12 5346 1 1 3 VAL HG22 H 8.468 10.972 -3.326 1.00 . A A . 3 VAL HG22 1 1 12 5347 1 1 3 VAL HG23 H 7.085 11.100 -2.239 1.00 . A A . 3 VAL HG23 1 1 12 5348 1 1 3 VAL N N 4.893 10.096 -3.143 1.00 . A A . 3 VAL N 1 1 12 5349 1 1 3 VAL O O 5.574 6.595 -2.795 1.00 . A A . 3 VAL O 1 1 12 5350 1 1 4 GLY C C 3.837 5.840 -1.048 1.00 . A A . 4 GLY C 1 1 12 5351 1 1 4 GLY CA C 4.347 7.100 -0.358 1.00 . A A . 4 GLY CA 1 1 12 5352 1 1 4 GLY H H 4.585 9.057 -1.150 1.00 . A A . 4 GLY H 1 1 12 5353 1 1 4 GLY HA2 H 5.193 6.844 0.264 1.00 . A A . 4 GLY HA2 1 1 12 5354 1 1 4 GLY HA3 H 3.561 7.501 0.263 1.00 . A A . 4 GLY HA3 1 1 12 5355 1 1 4 GLY N N 4.753 8.109 -1.338 1.00 . A A . 4 GLY N 1 1 12 5356 1 1 4 GLY O O 4.159 4.726 -0.638 1.00 . A A . 4 GLY O 1 1 12 5357 1 1 5 CYS C C 3.610 3.959 -3.318 1.00 . A A . 5 CYS C 1 1 12 5358 1 1 5 CYS CA C 2.498 4.896 -2.845 1.00 . A A . 5 CYS CA 1 1 12 5359 1 1 5 CYS CB C 1.697 5.396 -4.052 1.00 . A A . 5 CYS CB 1 1 12 5360 1 1 5 CYS H H 2.827 6.933 -2.389 1.00 . A A . 5 CYS H 1 1 12 5361 1 1 5 CYS HA H 1.843 4.345 -2.190 1.00 . A A . 5 CYS HA 1 1 12 5362 1 1 5 CYS HB2 H 2.359 5.913 -4.732 1.00 . A A . 5 CYS HB2 1 1 12 5363 1 1 5 CYS HB3 H 1.258 4.556 -4.555 1.00 . A A . 5 CYS HB3 1 1 12 5364 1 1 5 CYS N N 3.046 6.024 -2.103 1.00 . A A . 5 CYS N 1 1 12 5365 1 1 5 CYS O O 3.359 2.791 -3.595 1.00 . A A . 5 CYS O 1 1 12 5366 1 1 5 CYS SG S 0.389 6.534 -3.507 1.00 . A A . 5 CYS SG 1 1 12 5367 1 1 6 ALA C C 6.588 2.989 -2.571 1.00 . A A . 6 ALA C 1 1 12 5368 1 1 6 ALA CA C 5.976 3.656 -3.802 1.00 . A A . 6 ALA CA 1 1 12 5369 1 1 6 ALA CB C 7.020 4.534 -4.499 1.00 . A A . 6 ALA CB 1 1 12 5370 1 1 6 ALA H H 4.979 5.415 -3.142 1.00 . A A . 6 ALA H 1 1 12 5371 1 1 6 ALA HA H 5.640 2.892 -4.485 1.00 . A A . 6 ALA HA 1 1 12 5372 1 1 6 ALA HB1 H 7.900 4.614 -3.876 1.00 . A A . 6 ALA HB1 1 1 12 5373 1 1 6 ALA HB2 H 6.610 5.519 -4.667 1.00 . A A . 6 ALA HB2 1 1 12 5374 1 1 6 ALA HB3 H 7.289 4.090 -5.445 1.00 . A A . 6 ALA HB3 1 1 12 5375 1 1 6 ALA N N 4.834 4.470 -3.389 1.00 . A A . 6 ALA N 1 1 12 5376 1 1 6 ALA O O 6.857 1.781 -2.553 1.00 . A A . 6 ALA O 1 1 12 5377 1 1 7 GLU C C 6.321 2.329 0.380 1.00 . A A . 7 GLU C 1 1 12 5378 1 1 7 GLU CA C 7.328 3.271 -0.279 1.00 . A A . 7 GLU CA 1 1 12 5379 1 1 7 GLU CB C 7.649 4.429 0.671 1.00 . A A . 7 GLU CB 1 1 12 5380 1 1 7 GLU CD C 8.018 6.409 -0.826 1.00 . A A . 7 GLU CD 1 1 12 5381 1 1 7 GLU CG C 8.697 5.347 0.030 1.00 . A A . 7 GLU CG 1 1 12 5382 1 1 7 GLU H H 6.522 4.735 -1.603 1.00 . A A . 7 GLU H 1 1 12 5383 1 1 7 GLU HA H 8.236 2.726 -0.490 1.00 . A A . 7 GLU HA 1 1 12 5384 1 1 7 GLU HB2 H 6.747 4.992 0.870 1.00 . A A . 7 GLU HB2 1 1 12 5385 1 1 7 GLU HB3 H 8.038 4.036 1.599 1.00 . A A . 7 GLU HB3 1 1 12 5386 1 1 7 GLU HG2 H 9.271 5.831 0.806 1.00 . A A . 7 GLU HG2 1 1 12 5387 1 1 7 GLU HG3 H 9.358 4.761 -0.589 1.00 . A A . 7 GLU HG3 1 1 12 5388 1 1 7 GLU N N 6.776 3.785 -1.531 1.00 . A A . 7 GLU N 1 1 12 5389 1 1 7 GLU O O 6.689 1.315 0.983 1.00 . A A . 7 GLU O 1 1 12 5390 1 1 7 GLU OE1 O 7.386 7.284 -0.261 1.00 . A A . 7 GLU OE1 1 1 12 5391 1 1 7 GLU OE2 O 8.142 6.332 -2.037 1.00 . A A . 7 GLU OE2 1 1 12 5392 1 1 8 CYS C C 4.127 0.406 0.514 1.00 . A A . 8 CYS C 1 1 12 5393 1 1 8 CYS CA C 3.961 1.890 0.833 1.00 . A A . 8 CYS CA 1 1 12 5394 1 1 8 CYS CB C 2.610 2.394 0.335 1.00 . A A . 8 CYS CB 1 1 12 5395 1 1 8 CYS H H 4.823 3.508 -0.235 1.00 . A A . 8 CYS H 1 1 12 5396 1 1 8 CYS HA H 3.988 2.014 1.899 1.00 . A A . 8 CYS HA 1 1 12 5397 1 1 8 CYS HB2 H 2.758 3.134 -0.436 1.00 . A A . 8 CYS HB2 1 1 12 5398 1 1 8 CYS HB3 H 2.027 1.577 -0.057 1.00 . A A . 8 CYS HB3 1 1 12 5399 1 1 8 CYS N N 5.043 2.683 0.256 1.00 . A A . 8 CYS N 1 1 12 5400 1 1 8 CYS O O 4.218 -0.419 1.424 1.00 . A A . 8 CYS O 1 1 12 5401 1 1 8 CYS SG S 1.741 3.137 1.728 1.00 . A A . 8 CYS SG 1 1 12 5402 1 1 9 PRO C C 5.723 -1.873 -0.641 1.00 . A A . 9 PRO C 1 1 12 5403 1 1 9 PRO CA C 4.385 -1.367 -1.151 1.00 . A A . 9 PRO CA 1 1 12 5404 1 1 9 PRO CB C 4.337 -1.348 -2.683 1.00 . A A . 9 PRO CB 1 1 12 5405 1 1 9 PRO CD C 4.092 0.941 -1.905 1.00 . A A . 9 PRO CD 1 1 12 5406 1 1 9 PRO CG C 4.541 0.075 -3.084 1.00 . A A . 9 PRO CG 1 1 12 5407 1 1 9 PRO HA H 3.584 -1.979 -0.766 1.00 . A A . 9 PRO HA 1 1 12 5408 1 1 9 PRO HB2 H 5.124 -1.969 -3.090 1.00 . A A . 9 PRO HB2 1 1 12 5409 1 1 9 PRO HB3 H 3.375 -1.692 -3.029 1.00 . A A . 9 PRO HB3 1 1 12 5410 1 1 9 PRO HD2 H 4.745 1.792 -1.792 1.00 . A A . 9 PRO HD2 1 1 12 5411 1 1 9 PRO HD3 H 3.074 1.263 -2.039 1.00 . A A . 9 PRO HD3 1 1 12 5412 1 1 9 PRO HG2 H 5.586 0.248 -3.301 1.00 . A A . 9 PRO HG2 1 1 12 5413 1 1 9 PRO HG3 H 3.942 0.306 -3.952 1.00 . A A . 9 PRO HG3 1 1 12 5414 1 1 9 PRO N N 4.193 0.049 -0.746 1.00 . A A . 9 PRO N 1 1 12 5415 1 1 9 PRO O O 5.836 -3.006 -0.171 1.00 . A A . 9 PRO O 1 1 12 5416 1 1 10 MET C C 7.961 -1.710 1.283 1.00 . A A . 10 MET C 1 1 12 5417 1 1 10 MET CA C 8.050 -1.373 -0.206 1.00 . A A . 10 MET CA 1 1 12 5418 1 1 10 MET CB C 9.032 -0.221 -0.437 1.00 . A A . 10 MET CB 1 1 12 5419 1 1 10 MET CE C 11.612 0.269 -3.517 1.00 . A A . 10 MET CE 1 1 12 5420 1 1 10 MET CG C 9.472 -0.209 -1.903 1.00 . A A . 10 MET CG 1 1 12 5421 1 1 10 MET H H 6.584 -0.104 -1.065 1.00 . A A . 10 MET H 1 1 12 5422 1 1 10 MET HA H 8.397 -2.243 -0.739 1.00 . A A . 10 MET HA 1 1 12 5423 1 1 10 MET HB2 H 8.551 0.716 -0.197 1.00 . A A . 10 MET HB2 1 1 12 5424 1 1 10 MET HB3 H 9.897 -0.351 0.194 1.00 . A A . 10 MET HB3 1 1 12 5425 1 1 10 MET HE1 H 12.052 -0.658 -3.173 1.00 . A A . 10 MET HE1 1 1 12 5426 1 1 10 MET HE2 H 12.390 0.929 -3.876 1.00 . A A . 10 MET HE2 1 1 12 5427 1 1 10 MET HE3 H 10.921 0.062 -4.320 1.00 . A A . 10 MET HE3 1 1 12 5428 1 1 10 MET HG2 H 9.879 -1.174 -2.163 1.00 . A A . 10 MET HG2 1 1 12 5429 1 1 10 MET HG3 H 8.619 0.004 -2.534 1.00 . A A . 10 MET HG3 1 1 12 5430 1 1 10 MET N N 6.734 -1.008 -0.702 1.00 . A A . 10 MET N 1 1 12 5431 1 1 10 MET O O 8.490 -2.724 1.736 1.00 . A A . 10 MET O 1 1 12 5432 1 1 10 MET SD S 10.737 1.064 -2.145 1.00 . A A . 10 MET SD 1 1 12 5433 1 1 11 HIS C C 6.008 -2.127 3.755 1.00 . A A . 11 HIS C 1 1 12 5434 1 1 11 HIS CA C 7.100 -1.082 3.474 1.00 . A A . 11 HIS CA 1 1 12 5435 1 1 11 HIS CB C 6.741 0.242 4.158 1.00 . A A . 11 HIS CB 1 1 12 5436 1 1 11 HIS CD2 C 8.338 1.392 5.895 1.00 . A A . 11 HIS CD2 1 1 12 5437 1 1 11 HIS CE1 C 8.363 -0.173 7.394 1.00 . A A . 11 HIS CE1 1 1 12 5438 1 1 11 HIS CG C 7.535 0.383 5.427 1.00 . A A . 11 HIS CG 1 1 12 5439 1 1 11 HIS H H 6.855 -0.070 1.613 1.00 . A A . 11 HIS H 1 1 12 5440 1 1 11 HIS HA H 8.034 -1.440 3.882 1.00 . A A . 11 HIS HA 1 1 12 5441 1 1 11 HIS HB2 H 6.975 1.062 3.495 1.00 . A A . 11 HIS HB2 1 1 12 5442 1 1 11 HIS HB3 H 5.688 0.256 4.390 1.00 . A A . 11 HIS HB3 1 1 12 5443 1 1 11 HIS HD2 H 8.533 2.319 5.378 1.00 . A A . 11 HIS HD2 1 1 12 5444 1 1 11 HIS HE1 H 8.575 -0.738 8.290 1.00 . A A . 11 HIS HE1 1 1 12 5445 1 1 11 HIS HE2 H 9.465 1.568 7.698 1.00 . A A . 11 HIS HE2 1 1 12 5446 1 1 11 HIS N N 7.268 -0.861 2.036 1.00 . A A . 11 HIS N 1 1 12 5447 1 1 11 HIS ND1 N 7.565 -0.606 6.399 1.00 . A A . 11 HIS ND1 1 1 12 5448 1 1 11 HIS NE2 N 8.860 1.040 7.136 1.00 . A A . 11 HIS NE2 1 1 12 5449 1 1 11 HIS O O 5.338 -2.077 4.796 1.00 . A A . 11 HIS O 1 1 12 5450 1 1 12 CYS C C 5.488 -5.419 3.544 1.00 . A A . 12 CYS C 1 1 12 5451 1 1 12 CYS CA C 4.846 -4.147 3.002 1.00 . A A . 12 CYS CA 1 1 12 5452 1 1 12 CYS CB C 4.138 -4.447 1.682 1.00 . A A . 12 CYS CB 1 1 12 5453 1 1 12 CYS H H 6.423 -3.083 2.046 1.00 . A A . 12 CYS H 1 1 12 5454 1 1 12 CYS HA H 4.104 -3.811 3.714 1.00 . A A . 12 CYS HA 1 1 12 5455 1 1 12 CYS HB2 H 4.141 -3.566 1.062 1.00 . A A . 12 CYS HB2 1 1 12 5456 1 1 12 CYS HB3 H 4.645 -5.253 1.173 1.00 . A A . 12 CYS HB3 1 1 12 5457 1 1 12 CYS N N 5.847 -3.084 2.842 1.00 . A A . 12 CYS N 1 1 12 5458 1 1 12 CYS O O 6.653 -5.703 3.269 1.00 . A A . 12 CYS O 1 1 12 5459 1 1 12 CYS SG S 2.431 -4.933 2.036 1.00 . A A . 12 CYS SG 1 1 12 5460 1 1 13 LYS C C 4.860 -8.639 4.181 1.00 . A A . 13 LYS C 1 1 12 5461 1 1 13 LYS CA C 5.255 -7.380 4.970 1.00 . A A . 13 LYS CA 1 1 12 5462 1 1 13 LYS CB C 4.740 -7.485 6.415 1.00 . A A . 13 LYS CB 1 1 12 5463 1 1 13 LYS CD C 5.939 -5.334 6.974 1.00 . A A . 13 LYS CD 1 1 12 5464 1 1 13 LYS CE C 5.745 -3.874 7.409 1.00 . A A . 13 LYS CE 1 1 12 5465 1 1 13 LYS CG C 4.595 -6.081 7.032 1.00 . A A . 13 LYS CG 1 1 12 5466 1 1 13 LYS H H 3.822 -5.867 4.552 1.00 . A A . 13 LYS H 1 1 12 5467 1 1 13 LYS HA H 6.332 -7.320 4.997 1.00 . A A . 13 LYS HA 1 1 12 5468 1 1 13 LYS HB2 H 3.778 -7.978 6.415 1.00 . A A . 13 LYS HB2 1 1 12 5469 1 1 13 LYS HB3 H 5.438 -8.063 7.002 1.00 . A A . 13 LYS HB3 1 1 12 5470 1 1 13 LYS HD2 H 6.645 -5.815 7.635 1.00 . A A . 13 LYS HD2 1 1 12 5471 1 1 13 LYS HD3 H 6.321 -5.358 5.966 1.00 . A A . 13 LYS HD3 1 1 12 5472 1 1 13 LYS HE2 H 4.700 -3.604 7.323 1.00 . A A . 13 LYS HE2 1 1 12 5473 1 1 13 LYS HE3 H 6.060 -3.761 8.438 1.00 . A A . 13 LYS HE3 1 1 12 5474 1 1 13 LYS HG2 H 3.848 -5.525 6.484 1.00 . A A . 13 LYS HG2 1 1 12 5475 1 1 13 LYS HG3 H 4.283 -6.177 8.063 1.00 . A A . 13 LYS HG3 1 1 12 5476 1 1 13 LYS HZ1 H 7.036 -2.253 7.112 1.00 . A A . 13 LYS HZ1 1 1 12 5477 1 1 13 LYS HZ2 H 5.942 -2.509 5.826 1.00 . A A . 13 LYS HZ2 1 1 12 5478 1 1 13 LYS HZ3 H 7.285 -3.548 6.039 1.00 . A A . 13 LYS HZ3 1 1 12 5479 1 1 13 LYS N N 4.735 -6.159 4.350 1.00 . A A . 13 LYS N 1 1 12 5480 1 1 13 LYS NZ N 6.565 -2.982 6.535 1.00 . A A . 13 LYS NZ 1 1 12 5481 1 1 13 LYS O O 3.749 -8.753 3.659 1.00 . A A . 13 LYS O 1 1 12 5482 1 1 14 GLY C C 4.303 -11.523 3.641 1.00 . A A . 14 GLY C 1 1 12 5483 1 1 14 GLY CA C 5.643 -10.833 3.367 1.00 . A A . 14 GLY CA 1 1 12 5484 1 1 14 GLY H H 6.676 -9.390 4.527 1.00 . A A . 14 GLY H 1 1 12 5485 1 1 14 GLY HA2 H 5.720 -10.637 2.308 1.00 . A A . 14 GLY HA2 1 1 12 5486 1 1 14 GLY HA3 H 6.440 -11.506 3.651 1.00 . A A . 14 GLY HA3 1 1 12 5487 1 1 14 GLY N N 5.814 -9.568 4.095 1.00 . A A . 14 GLY N 1 1 12 5488 1 1 14 GLY O O 3.812 -11.532 4.769 1.00 . A A . 14 GLY O 1 1 12 5489 1 1 15 LYS C C 1.283 -11.957 2.283 1.00 . A A . 15 LYS C 1 1 12 5490 1 1 15 LYS CA C 2.471 -12.855 2.630 1.00 . A A . 15 LYS CA 1 1 12 5491 1 1 15 LYS CB C 2.260 -13.477 4.018 1.00 . A A . 15 LYS CB 1 1 12 5492 1 1 15 LYS CD C -0.086 -14.359 4.167 1.00 . A A . 15 LYS CD 1 1 12 5493 1 1 15 LYS CE C -0.995 -15.077 3.163 1.00 . A A . 15 LYS CE 1 1 12 5494 1 1 15 LYS CG C 1.380 -14.728 3.899 1.00 . A A . 15 LYS CG 1 1 12 5495 1 1 15 LYS H H 4.219 -12.068 1.721 1.00 . A A . 15 LYS H 1 1 12 5496 1 1 15 LYS HA H 2.514 -13.652 1.903 1.00 . A A . 15 LYS HA 1 1 12 5497 1 1 15 LYS HB2 H 3.217 -13.751 4.437 1.00 . A A . 15 LYS HB2 1 1 12 5498 1 1 15 LYS HB3 H 1.778 -12.759 4.665 1.00 . A A . 15 LYS HB3 1 1 12 5499 1 1 15 LYS HD2 H -0.353 -14.658 5.172 1.00 . A A . 15 LYS HD2 1 1 12 5500 1 1 15 LYS HD3 H -0.214 -13.293 4.067 1.00 . A A . 15 LYS HD3 1 1 12 5501 1 1 15 LYS HE2 H -0.498 -15.965 2.797 1.00 . A A . 15 LYS HE2 1 1 12 5502 1 1 15 LYS HE3 H -1.919 -15.358 3.650 1.00 . A A . 15 LYS HE3 1 1 12 5503 1 1 15 LYS HG2 H 1.474 -15.142 2.905 1.00 . A A . 15 LYS HG2 1 1 12 5504 1 1 15 LYS HG3 H 1.701 -15.462 4.624 1.00 . A A . 15 LYS HG3 1 1 12 5505 1 1 15 LYS HZ1 H -1.326 -14.707 1.135 1.00 . A A . 15 LYS HZ1 1 1 12 5506 1 1 15 LYS HZ2 H -0.536 -13.427 1.949 1.00 . A A . 15 LYS HZ2 1 1 12 5507 1 1 15 LYS HZ3 H -2.207 -13.699 2.175 1.00 . A A . 15 LYS HZ3 1 1 12 5508 1 1 15 LYS N N 3.746 -12.115 2.578 1.00 . A A . 15 LYS N 1 1 12 5509 1 1 15 LYS NZ N -1.291 -14.162 2.020 1.00 . A A . 15 LYS NZ 1 1 12 5510 1 1 15 LYS O O 0.240 -12.446 1.832 1.00 . A A . 15 LYS O 1 1 12 5511 1 1 16 MET C C 1.066 -8.422 1.576 1.00 . A A . 16 MET C 1 1 12 5512 1 1 16 MET CA C 0.410 -9.681 2.152 1.00 . A A . 16 MET CA 1 1 12 5513 1 1 16 MET CB C -0.387 -9.313 3.422 1.00 . A A . 16 MET CB 1 1 12 5514 1 1 16 MET CE C -2.951 -11.211 5.875 1.00 . A A . 16 MET CE 1 1 12 5515 1 1 16 MET CG C -0.990 -10.567 4.074 1.00 . A A . 16 MET CG 1 1 12 5516 1 1 16 MET H H 2.314 -10.331 2.815 1.00 . A A . 16 MET H 1 1 12 5517 1 1 16 MET HA H -0.261 -10.102 1.419 1.00 . A A . 16 MET HA 1 1 12 5518 1 1 16 MET HB2 H 0.271 -8.827 4.128 1.00 . A A . 16 MET HB2 1 1 12 5519 1 1 16 MET HB3 H -1.185 -8.634 3.158 1.00 . A A . 16 MET HB3 1 1 12 5520 1 1 16 MET HE1 H -2.596 -12.226 5.764 1.00 . A A . 16 MET HE1 1 1 12 5521 1 1 16 MET HE2 H -3.993 -11.220 6.163 1.00 . A A . 16 MET HE2 1 1 12 5522 1 1 16 MET HE3 H -2.375 -10.712 6.638 1.00 . A A . 16 MET HE3 1 1 12 5523 1 1 16 MET HG2 H -0.822 -11.424 3.443 1.00 . A A . 16 MET HG2 1 1 12 5524 1 1 16 MET HG3 H -0.524 -10.734 5.036 1.00 . A A . 16 MET HG3 1 1 12 5525 1 1 16 MET N N 1.455 -10.653 2.470 1.00 . A A . 16 MET N 1 1 12 5526 1 1 16 MET O O 1.567 -7.593 2.333 1.00 . A A . 16 MET O 1 1 12 5527 1 1 16 MET SD S -2.772 -10.330 4.301 1.00 . A A . 16 MET SD 1 1 12 5528 1 1 17 ALA C C 1.001 -6.515 -1.537 1.00 . A A . 17 ALA C 1 1 12 5529 1 1 17 ALA CA C 1.736 -7.094 -0.333 1.00 . A A . 17 ALA CA 1 1 12 5530 1 1 17 ALA CB C 3.170 -7.406 -0.737 1.00 . A A . 17 ALA CB 1 1 12 5531 1 1 17 ALA H H 0.701 -8.960 -0.334 1.00 . A A . 17 ALA H 1 1 12 5532 1 1 17 ALA HA H 1.765 -6.332 0.428 1.00 . A A . 17 ALA HA 1 1 12 5533 1 1 17 ALA HB1 H 3.773 -7.529 0.147 1.00 . A A . 17 ALA HB1 1 1 12 5534 1 1 17 ALA HB2 H 3.557 -6.587 -1.328 1.00 . A A . 17 ALA HB2 1 1 12 5535 1 1 17 ALA HB3 H 3.187 -8.311 -1.323 1.00 . A A . 17 ALA HB3 1 1 12 5536 1 1 17 ALA N N 1.093 -8.275 0.247 1.00 . A A . 17 ALA N 1 1 12 5537 1 1 17 ALA O O 1.084 -7.021 -2.656 1.00 . A A . 17 ALA O 1 1 12 5538 1 1 18 LYS C C -0.706 -3.263 -1.764 1.00 . A A . 18 LYS C 1 1 12 5539 1 1 18 LYS CA C -0.379 -4.662 -2.302 1.00 . A A . 18 LYS CA 1 1 12 5540 1 1 18 LYS CB C -1.633 -5.400 -2.767 1.00 . A A . 18 LYS CB 1 1 12 5541 1 1 18 LYS CD C -3.740 -6.483 -2.015 1.00 . A A . 18 LYS CD 1 1 12 5542 1 1 18 LYS CE C -4.527 -5.245 -2.473 1.00 . A A . 18 LYS CE 1 1 12 5543 1 1 18 LYS CG C -2.327 -6.083 -1.588 1.00 . A A . 18 LYS CG 1 1 12 5544 1 1 18 LYS H H 0.371 -5.063 -0.367 1.00 . A A . 18 LYS H 1 1 12 5545 1 1 18 LYS HA H 0.282 -4.550 -3.151 1.00 . A A . 18 LYS HA 1 1 12 5546 1 1 18 LYS HB2 H -2.308 -4.699 -3.229 1.00 . A A . 18 LYS HB2 1 1 12 5547 1 1 18 LYS HB3 H -1.351 -6.150 -3.493 1.00 . A A . 18 LYS HB3 1 1 12 5548 1 1 18 LYS HD2 H -3.677 -7.189 -2.832 1.00 . A A . 18 LYS HD2 1 1 12 5549 1 1 18 LYS HD3 H -4.247 -6.945 -1.187 1.00 . A A . 18 LYS HD3 1 1 12 5550 1 1 18 LYS HE2 H -4.423 -5.132 -3.544 1.00 . A A . 18 LYS HE2 1 1 12 5551 1 1 18 LYS HE3 H -5.571 -5.373 -2.230 1.00 . A A . 18 LYS HE3 1 1 12 5552 1 1 18 LYS HG2 H -1.768 -6.967 -1.307 1.00 . A A . 18 LYS HG2 1 1 12 5553 1 1 18 LYS HG3 H -2.378 -5.407 -0.748 1.00 . A A . 18 LYS HG3 1 1 12 5554 1 1 18 LYS HZ1 H -4.313 -3.163 -2.316 1.00 . A A . 18 LYS HZ1 1 1 12 5555 1 1 18 LYS HZ2 H -2.965 -4.045 -1.760 1.00 . A A . 18 LYS HZ2 1 1 12 5556 1 1 18 LYS HZ3 H -4.376 -3.972 -0.811 1.00 . A A . 18 LYS HZ3 1 1 12 5557 1 1 18 LYS N N 0.335 -5.412 -1.277 1.00 . A A . 18 LYS N 1 1 12 5558 1 1 18 LYS NZ N -4.002 -4.021 -1.792 1.00 . A A . 18 LYS NZ 1 1 12 5559 1 1 18 LYS O O -1.419 -3.117 -0.755 1.00 . A A . 18 LYS O 1 1 12 5560 1 1 19 PRO C C -1.719 -0.253 -2.191 1.00 . A A . 19 PRO C 1 1 12 5561 1 1 19 PRO CA C -0.335 -0.836 -1.932 1.00 . A A . 19 PRO CA 1 1 12 5562 1 1 19 PRO CB C 0.727 -0.077 -2.727 1.00 . A A . 19 PRO CB 1 1 12 5563 1 1 19 PRO CD C 0.679 -2.331 -3.594 1.00 . A A . 19 PRO CD 1 1 12 5564 1 1 19 PRO CG C 0.920 -0.870 -3.973 1.00 . A A . 19 PRO CG 1 1 12 5565 1 1 19 PRO HA H -0.102 -0.759 -0.884 1.00 . A A . 19 PRO HA 1 1 12 5566 1 1 19 PRO HB2 H 0.381 0.920 -2.962 1.00 . A A . 19 PRO HB2 1 1 12 5567 1 1 19 PRO HB3 H 1.650 -0.036 -2.172 1.00 . A A . 19 PRO HB3 1 1 12 5568 1 1 19 PRO HD2 H 0.153 -2.843 -4.389 1.00 . A A . 19 PRO HD2 1 1 12 5569 1 1 19 PRO HD3 H 1.611 -2.826 -3.371 1.00 . A A . 19 PRO HD3 1 1 12 5570 1 1 19 PRO HG2 H 0.210 -0.554 -4.727 1.00 . A A . 19 PRO HG2 1 1 12 5571 1 1 19 PRO HG3 H 1.927 -0.750 -4.338 1.00 . A A . 19 PRO HG3 1 1 12 5572 1 1 19 PRO N N -0.161 -2.248 -2.383 1.00 . A A . 19 PRO N 1 1 12 5573 1 1 19 PRO O O -2.312 -0.437 -3.259 1.00 . A A . 19 PRO O 1 1 12 5574 1 1 20 THR C C -3.262 2.650 -1.150 1.00 . A A . 20 THR C 1 1 12 5575 1 1 20 THR CA C -3.487 1.153 -1.280 1.00 . A A . 20 THR CA 1 1 12 5576 1 1 20 THR CB C -4.416 0.692 -0.158 1.00 . A A . 20 THR CB 1 1 12 5577 1 1 20 THR CG2 C -4.474 -0.831 -0.122 1.00 . A A . 20 THR CG2 1 1 12 5578 1 1 20 THR H H -1.657 0.600 -0.385 1.00 . A A . 20 THR H 1 1 12 5579 1 1 20 THR HA H -3.943 0.937 -2.231 1.00 . A A . 20 THR HA 1 1 12 5580 1 1 20 THR HB H -5.408 1.087 -0.325 1.00 . A A . 20 THR HB 1 1 12 5581 1 1 20 THR HG1 H -2.978 0.897 1.142 1.00 . A A . 20 THR HG1 1 1 12 5582 1 1 20 THR HG21 H -5.501 -1.155 -0.195 1.00 . A A . 20 THR HG21 1 1 12 5583 1 1 20 THR HG22 H -4.055 -1.181 0.805 1.00 . A A . 20 THR HG22 1 1 12 5584 1 1 20 THR HG23 H -3.910 -1.235 -0.948 1.00 . A A . 20 THR HG23 1 1 12 5585 1 1 20 THR N N -2.200 0.483 -1.197 1.00 . A A . 20 THR N 1 1 12 5586 1 1 20 THR O O -2.753 3.119 -0.128 1.00 . A A . 20 THR O 1 1 12 5587 1 1 20 THR OG1 O -3.915 1.168 1.082 1.00 . A A . 20 THR OG1 1 1 12 5588 1 1 21 CYS C C -4.796 5.533 -2.375 1.00 . A A . 21 CYS C 1 1 12 5589 1 1 21 CYS CA C -3.456 4.838 -2.154 1.00 . A A . 21 CYS CA 1 1 12 5590 1 1 21 CYS CB C -2.405 5.274 -3.183 1.00 . A A . 21 CYS CB 1 1 12 5591 1 1 21 CYS H H -4.024 2.958 -2.971 1.00 . A A . 21 CYS H 1 1 12 5592 1 1 21 CYS HA H -3.100 5.115 -1.175 1.00 . A A . 21 CYS HA 1 1 12 5593 1 1 21 CYS HB2 H -2.330 4.532 -3.963 1.00 . A A . 21 CYS HB2 1 1 12 5594 1 1 21 CYS HB3 H -2.679 6.228 -3.610 1.00 . A A . 21 CYS HB3 1 1 12 5595 1 1 21 CYS N N -3.628 3.393 -2.179 1.00 . A A . 21 CYS N 1 1 12 5596 1 1 21 CYS O O -5.452 5.366 -3.408 1.00 . A A . 21 CYS O 1 1 12 5597 1 1 21 CYS SG S -0.813 5.424 -2.317 1.00 . A A . 21 CYS SG 1 1 12 5598 1 1 22 GLU C C -6.228 8.349 -0.708 1.00 . A A . 22 GLU C 1 1 12 5599 1 1 22 GLU CA C -6.447 7.000 -1.375 1.00 . A A . 22 GLU CA 1 1 12 5600 1 1 22 GLU CB C -7.525 6.190 -0.633 1.00 . A A . 22 GLU CB 1 1 12 5601 1 1 22 GLU CD C -6.749 3.982 0.335 1.00 . A A . 22 GLU CD 1 1 12 5602 1 1 22 GLU CG C -6.916 5.482 0.594 1.00 . A A . 22 GLU CG 1 1 12 5603 1 1 22 GLU H H -4.644 6.363 -0.577 1.00 . A A . 22 GLU H 1 1 12 5604 1 1 22 GLU HA H -6.760 7.156 -2.398 1.00 . A A . 22 GLU HA 1 1 12 5605 1 1 22 GLU HB2 H -8.313 6.855 -0.308 1.00 . A A . 22 GLU HB2 1 1 12 5606 1 1 22 GLU HB3 H -7.939 5.451 -1.303 1.00 . A A . 22 GLU HB3 1 1 12 5607 1 1 22 GLU HG2 H -5.952 5.912 0.815 1.00 . A A . 22 GLU HG2 1 1 12 5608 1 1 22 GLU HG3 H -7.569 5.623 1.444 1.00 . A A . 22 GLU HG3 1 1 12 5609 1 1 22 GLU N N -5.201 6.286 -1.365 1.00 . A A . 22 GLU N 1 1 12 5610 1 1 22 GLU O O -5.582 8.443 0.335 1.00 . A A . 22 GLU O 1 1 12 5611 1 1 22 GLU OE1 O -6.225 3.629 -0.706 1.00 . A A . 22 GLU OE1 1 1 12 5612 1 1 22 GLU OE2 O -7.132 3.200 1.194 1.00 . A A . 22 GLU OE2 1 1 12 5613 1 1 23 ASN C C -5.173 11.000 -0.313 1.00 . A A . 23 ASN C 1 1 12 5614 1 1 23 ASN CA C -6.586 10.756 -0.848 1.00 . A A . 23 ASN CA 1 1 12 5615 1 1 23 ASN CB C -7.627 11.058 0.243 1.00 . A A . 23 ASN CB 1 1 12 5616 1 1 23 ASN CG C -7.882 9.833 1.113 1.00 . A A . 23 ASN CG 1 1 12 5617 1 1 23 ASN H H -7.193 9.215 -2.178 1.00 . A A . 23 ASN H 1 1 12 5618 1 1 23 ASN HA H -6.754 11.433 -1.673 1.00 . A A . 23 ASN HA 1 1 12 5619 1 1 23 ASN HB2 H -7.268 11.864 0.866 1.00 . A A . 23 ASN HB2 1 1 12 5620 1 1 23 ASN HB3 H -8.549 11.357 -0.225 1.00 . A A . 23 ASN HB3 1 1 12 5621 1 1 23 ASN HD21 H -9.241 9.067 -0.105 1.00 . A A . 23 ASN HD21 1 1 12 5622 1 1 23 ASN HD22 H -8.919 8.159 1.291 1.00 . A A . 23 ASN HD22 1 1 12 5623 1 1 23 ASN N N -6.733 9.380 -1.343 1.00 . A A . 23 ASN N 1 1 12 5624 1 1 23 ASN ND2 N -8.753 8.946 0.735 1.00 . A A . 23 ASN ND2 1 1 12 5625 1 1 23 ASN O O -4.990 11.542 0.776 1.00 . A A . 23 ASN O 1 1 12 5626 1 1 23 ASN OD1 O -7.282 9.687 2.174 1.00 . A A . 23 ASN OD1 1 1 12 5627 1 1 24 GLU C C -2.376 9.890 0.444 1.00 . A A . 24 GLU C 1 1 12 5628 1 1 24 GLU CA C -2.776 10.766 -0.745 1.00 . A A . 24 GLU CA 1 1 12 5629 1 1 24 GLU CB C -2.463 12.243 -0.455 1.00 . A A . 24 GLU CB 1 1 12 5630 1 1 24 GLU CD C -1.925 12.220 -2.920 1.00 . A A . 24 GLU CD 1 1 12 5631 1 1 24 GLU CG C -2.481 13.050 -1.765 1.00 . A A . 24 GLU CG 1 1 12 5632 1 1 24 GLU H H -4.407 10.177 -1.961 1.00 . A A . 24 GLU H 1 1 12 5633 1 1 24 GLU HA H -2.184 10.456 -1.588 1.00 . A A . 24 GLU HA 1 1 12 5634 1 1 24 GLU HB2 H -3.202 12.642 0.224 1.00 . A A . 24 GLU HB2 1 1 12 5635 1 1 24 GLU HB3 H -1.484 12.318 -0.003 1.00 . A A . 24 GLU HB3 1 1 12 5636 1 1 24 GLU HG2 H -3.496 13.338 -1.992 1.00 . A A . 24 GLU HG2 1 1 12 5637 1 1 24 GLU HG3 H -1.878 13.938 -1.644 1.00 . A A . 24 GLU HG3 1 1 12 5638 1 1 24 GLU N N -4.185 10.594 -1.104 1.00 . A A . 24 GLU N 1 1 12 5639 1 1 24 GLU O O -1.243 9.966 0.921 1.00 . A A . 24 GLU O 1 1 12 5640 1 1 24 GLU OE1 O -0.720 12.012 -2.962 1.00 . A A . 24 GLU OE1 1 1 12 5641 1 1 24 GLU OE2 O -2.709 11.787 -3.747 1.00 . A A . 24 GLU OE2 1 1 12 5642 1 1 25 VAL C C -2.625 6.777 1.502 1.00 . A A . 25 VAL C 1 1 12 5643 1 1 25 VAL CA C -2.993 8.162 2.027 1.00 . A A . 25 VAL CA 1 1 12 5644 1 1 25 VAL CB C -4.196 8.070 2.973 1.00 . A A . 25 VAL CB 1 1 12 5645 1 1 25 VAL CG1 C -3.931 7.008 4.041 1.00 . A A . 25 VAL CG1 1 1 12 5646 1 1 25 VAL CG2 C -4.413 9.424 3.653 1.00 . A A . 25 VAL CG2 1 1 12 5647 1 1 25 VAL H H -4.186 9.011 0.488 1.00 . A A . 25 VAL H 1 1 12 5648 1 1 25 VAL HA H -2.150 8.561 2.573 1.00 . A A . 25 VAL HA 1 1 12 5649 1 1 25 VAL HB H -5.079 7.802 2.410 1.00 . A A . 25 VAL HB 1 1 12 5650 1 1 25 VAL HG11 H -4.012 6.028 3.602 1.00 . A A . 25 VAL HG11 1 1 12 5651 1 1 25 VAL HG12 H -4.658 7.108 4.835 1.00 . A A . 25 VAL HG12 1 1 12 5652 1 1 25 VAL HG13 H -2.937 7.142 4.446 1.00 . A A . 25 VAL HG13 1 1 12 5653 1 1 25 VAL HG21 H -5.180 9.972 3.128 1.00 . A A . 25 VAL HG21 1 1 12 5654 1 1 25 VAL HG22 H -3.492 9.989 3.637 1.00 . A A . 25 VAL HG22 1 1 12 5655 1 1 25 VAL HG23 H -4.719 9.268 4.677 1.00 . A A . 25 VAL HG23 1 1 12 5656 1 1 25 VAL N N -3.294 9.047 0.908 1.00 . A A . 25 VAL N 1 1 12 5657 1 1 25 VAL O O -3.494 5.979 1.140 1.00 . A A . 25 VAL O 1 1 12 5658 1 1 26 CYS C C -0.663 4.229 2.085 1.00 . A A . 26 CYS C 1 1 12 5659 1 1 26 CYS CA C -0.836 5.234 0.950 1.00 . A A . 26 CYS CA 1 1 12 5660 1 1 26 CYS CB C 0.503 5.435 0.236 1.00 . A A . 26 CYS CB 1 1 12 5661 1 1 26 CYS H H -0.682 7.191 1.731 1.00 . A A . 26 CYS H 1 1 12 5662 1 1 26 CYS HA H -1.545 4.841 0.242 1.00 . A A . 26 CYS HA 1 1 12 5663 1 1 26 CYS HB2 H 0.570 4.751 -0.589 1.00 . A A . 26 CYS HB2 1 1 12 5664 1 1 26 CYS HB3 H 0.570 6.444 -0.133 1.00 . A A . 26 CYS HB3 1 1 12 5665 1 1 26 CYS N N -1.326 6.510 1.446 1.00 . A A . 26 CYS N 1 1 12 5666 1 1 26 CYS O O -0.044 4.526 3.107 1.00 . A A . 26 CYS O 1 1 12 5667 1 1 26 CYS SG S 1.868 5.121 1.380 1.00 . A A . 26 CYS SG 1 1 12 5668 1 1 27 LYS C C -1.122 0.605 2.219 1.00 . A A . 27 LYS C 1 1 12 5669 1 1 27 LYS CA C -1.098 1.971 2.899 1.00 . A A . 27 LYS CA 1 1 12 5670 1 1 27 LYS CB C -2.260 2.014 3.911 1.00 . A A . 27 LYS CB 1 1 12 5671 1 1 27 LYS CD C -4.219 3.522 4.251 1.00 . A A . 27 LYS CD 1 1 12 5672 1 1 27 LYS CE C -4.737 3.667 2.817 1.00 . A A . 27 LYS CE 1 1 12 5673 1 1 27 LYS CG C -2.688 3.450 4.237 1.00 . A A . 27 LYS CG 1 1 12 5674 1 1 27 LYS H H -1.694 2.856 1.054 1.00 . A A . 27 LYS H 1 1 12 5675 1 1 27 LYS HA H -0.163 2.085 3.430 1.00 . A A . 27 LYS HA 1 1 12 5676 1 1 27 LYS HB2 H -3.103 1.484 3.497 1.00 . A A . 27 LYS HB2 1 1 12 5677 1 1 27 LYS HB3 H -1.950 1.522 4.823 1.00 . A A . 27 LYS HB3 1 1 12 5678 1 1 27 LYS HD2 H -4.618 2.620 4.692 1.00 . A A . 27 LYS HD2 1 1 12 5679 1 1 27 LYS HD3 H -4.533 4.375 4.833 1.00 . A A . 27 LYS HD3 1 1 12 5680 1 1 27 LYS HE2 H -5.505 4.429 2.788 1.00 . A A . 27 LYS HE2 1 1 12 5681 1 1 27 LYS HE3 H -3.924 3.954 2.166 1.00 . A A . 27 LYS HE3 1 1 12 5682 1 1 27 LYS HG2 H -2.303 3.728 5.208 1.00 . A A . 27 LYS HG2 1 1 12 5683 1 1 27 LYS HG3 H -2.308 4.128 3.495 1.00 . A A . 27 LYS HG3 1 1 12 5684 1 1 27 LYS HZ1 H -4.642 1.904 1.679 1.00 . A A . 27 LYS HZ1 1 1 12 5685 1 1 27 LYS HZ2 H -6.232 2.552 1.861 1.00 . A A . 27 LYS HZ2 1 1 12 5686 1 1 27 LYS HZ3 H -5.461 1.733 3.172 1.00 . A A . 27 LYS HZ3 1 1 12 5687 1 1 27 LYS N N -1.209 3.033 1.894 1.00 . A A . 27 LYS N 1 1 12 5688 1 1 27 LYS NZ N -5.309 2.369 2.356 1.00 . A A . 27 LYS NZ 1 1 12 5689 1 1 27 LYS O O -1.724 0.448 1.154 1.00 . A A . 27 LYS O 1 1 12 5690 1 1 28 CYS C C -1.751 -2.458 2.883 1.00 . A A . 28 CYS C 1 1 12 5691 1 1 28 CYS CA C -0.533 -1.745 2.306 1.00 . A A . 28 CYS CA 1 1 12 5692 1 1 28 CYS CB C 0.751 -2.497 2.671 1.00 . A A . 28 CYS CB 1 1 12 5693 1 1 28 CYS H H -0.083 -0.222 3.713 1.00 . A A . 28 CYS H 1 1 12 5694 1 1 28 CYS HA H -0.626 -1.695 1.232 1.00 . A A . 28 CYS HA 1 1 12 5695 1 1 28 CYS HB2 H 1.517 -1.788 2.950 1.00 . A A . 28 CYS HB2 1 1 12 5696 1 1 28 CYS HB3 H 0.558 -3.163 3.500 1.00 . A A . 28 CYS HB3 1 1 12 5697 1 1 28 CYS N N -0.514 -0.391 2.852 1.00 . A A . 28 CYS N 1 1 12 5698 1 1 28 CYS O O -1.747 -2.869 4.043 1.00 . A A . 28 CYS O 1 1 12 5699 1 1 28 CYS SG S 1.306 -3.458 1.241 1.00 . A A . 28 CYS SG 1 1 12 5700 1 1 29 ASN C C -4.691 -4.033 1.469 1.00 . A A . 29 ASN C 1 1 12 5701 1 1 29 ASN CA C -4.052 -3.184 2.560 1.00 . A A . 29 ASN CA 1 1 12 5702 1 1 29 ASN CB C -5.077 -2.118 3.003 1.00 . A A . 29 ASN CB 1 1 12 5703 1 1 29 ASN CG C -4.413 -0.914 3.672 1.00 . A A . 29 ASN CG 1 1 12 5704 1 1 29 ASN H H -2.763 -2.193 1.172 1.00 . A A . 29 ASN H 1 1 12 5705 1 1 29 ASN HA H -3.827 -3.817 3.404 1.00 . A A . 29 ASN HA 1 1 12 5706 1 1 29 ASN HB2 H -5.625 -1.774 2.139 1.00 . A A . 29 ASN HB2 1 1 12 5707 1 1 29 ASN HB3 H -5.770 -2.567 3.700 1.00 . A A . 29 ASN HB3 1 1 12 5708 1 1 29 ASN HD21 H -3.001 -1.980 4.572 1.00 . A A . 29 ASN HD21 1 1 12 5709 1 1 29 ASN HD22 H -2.958 -0.307 4.866 1.00 . A A . 29 ASN HD22 1 1 12 5710 1 1 29 ASN N N -2.810 -2.560 2.087 1.00 . A A . 29 ASN N 1 1 12 5711 1 1 29 ASN ND2 N -3.370 -1.080 4.430 1.00 . A A . 29 ASN ND2 1 1 12 5712 1 1 29 ASN O O -4.710 -3.650 0.303 1.00 . A A . 29 ASN O 1 1 12 5713 1 1 29 ASN OD1 O -4.873 0.216 3.503 1.00 . A A . 29 ASN OD1 1 1 12 5714 1 1 30 ILE C C -7.287 -5.533 0.532 1.00 . A A . 30 ILE C 1 1 12 5715 1 1 30 ILE CA C -5.896 -6.051 0.890 1.00 . A A . 30 ILE CA 1 1 12 5716 1 1 30 ILE CB C -5.968 -7.497 1.416 1.00 . A A . 30 ILE CB 1 1 12 5717 1 1 30 ILE CD1 C -4.191 -7.269 3.150 1.00 . A A . 30 ILE CD1 1 1 12 5718 1 1 30 ILE CG1 C -5.685 -7.524 2.920 1.00 . A A . 30 ILE CG1 1 1 12 5719 1 1 30 ILE CG2 C -4.939 -8.369 0.690 1.00 . A A . 30 ILE CG2 1 1 12 5720 1 1 30 ILE H H -5.213 -5.424 2.798 1.00 . A A . 30 ILE H 1 1 12 5721 1 1 30 ILE HA H -5.308 -6.052 -0.009 1.00 . A A . 30 ILE HA 1 1 12 5722 1 1 30 ILE HB H -6.956 -7.892 1.234 1.00 . A A . 30 ILE HB 1 1 12 5723 1 1 30 ILE HD11 H -3.750 -6.869 2.245 1.00 . A A . 30 ILE HD11 1 1 12 5724 1 1 30 ILE HD12 H -3.703 -8.197 3.402 1.00 . A A . 30 ILE HD12 1 1 12 5725 1 1 30 ILE HD13 H -4.064 -6.562 3.953 1.00 . A A . 30 ILE HD13 1 1 12 5726 1 1 30 ILE HG12 H -6.268 -6.762 3.417 1.00 . A A . 30 ILE HG12 1 1 12 5727 1 1 30 ILE HG13 H -5.945 -8.494 3.318 1.00 . A A . 30 ILE HG13 1 1 12 5728 1 1 30 ILE HG21 H -5.288 -8.581 -0.310 1.00 . A A . 30 ILE HG21 1 1 12 5729 1 1 30 ILE HG22 H -4.812 -9.296 1.230 1.00 . A A . 30 ILE HG22 1 1 12 5730 1 1 30 ILE HG23 H -3.994 -7.850 0.642 1.00 . A A . 30 ILE HG23 1 1 12 5731 1 1 30 ILE N N -5.237 -5.172 1.852 1.00 . A A . 30 ILE N 1 1 12 5732 1 1 30 ILE O O -8.019 -5.024 1.379 1.00 . A A . 30 ILE O 1 1 12 5733 1 1 31 GLY C C -8.778 -4.034 -2.232 1.00 . A A . 31 GLY C 1 1 12 5734 1 1 31 GLY CA C -8.923 -5.219 -1.268 1.00 . A A . 31 GLY CA 1 1 12 5735 1 1 31 GLY H H -6.987 -6.084 -1.356 1.00 . A A . 31 GLY H 1 1 12 5736 1 1 31 GLY HA2 H -9.400 -6.037 -1.785 1.00 . A A . 31 GLY HA2 1 1 12 5737 1 1 31 GLY HA3 H -9.543 -4.917 -0.441 1.00 . A A . 31 GLY HA3 1 1 12 5738 1 1 31 GLY N N -7.626 -5.670 -0.747 1.00 . A A . 31 GLY N 1 1 12 5739 1 1 31 GLY O O -9.655 -3.796 -3.060 1.00 . A A . 31 GLY O 1 1 12 5740 1 1 32 LYS C C -5.964 -2.223 -3.539 1.00 . A A . 32 LYS C 1 1 12 5741 1 1 32 LYS CA C -7.404 -2.165 -3.015 1.00 . A A . 32 LYS CA 1 1 12 5742 1 1 32 LYS CB C -7.637 -0.852 -2.248 1.00 . A A . 32 LYS CB 1 1 12 5743 1 1 32 LYS CD C -8.194 1.583 -2.500 1.00 . A A . 32 LYS CD 1 1 12 5744 1 1 32 LYS CE C -7.891 2.842 -3.325 1.00 . A A . 32 LYS CE 1 1 12 5745 1 1 32 LYS CG C -7.668 0.334 -3.225 1.00 . A A . 32 LYS CG 1 1 12 5746 1 1 32 LYS H H -6.999 -3.560 -1.461 1.00 . A A . 32 LYS H 1 1 12 5747 1 1 32 LYS HA H -8.082 -2.208 -3.851 1.00 . A A . 32 LYS HA 1 1 12 5748 1 1 32 LYS HB2 H -8.580 -0.908 -1.723 1.00 . A A . 32 LYS HB2 1 1 12 5749 1 1 32 LYS HB3 H -6.840 -0.705 -1.535 1.00 . A A . 32 LYS HB3 1 1 12 5750 1 1 32 LYS HD2 H -9.264 1.494 -2.365 1.00 . A A . 32 LYS HD2 1 1 12 5751 1 1 32 LYS HD3 H -7.720 1.667 -1.534 1.00 . A A . 32 LYS HD3 1 1 12 5752 1 1 32 LYS HE2 H -7.914 2.598 -4.379 1.00 . A A . 32 LYS HE2 1 1 12 5753 1 1 32 LYS HE3 H -8.634 3.598 -3.115 1.00 . A A . 32 LYS HE3 1 1 12 5754 1 1 32 LYS HG2 H -6.669 0.522 -3.593 1.00 . A A . 32 LYS HG2 1 1 12 5755 1 1 32 LYS HG3 H -8.319 0.100 -4.055 1.00 . A A . 32 LYS HG3 1 1 12 5756 1 1 32 LYS HZ1 H -6.388 4.311 -3.375 1.00 . A A . 32 LYS HZ1 1 1 12 5757 1 1 32 LYS HZ2 H -5.801 2.699 -3.344 1.00 . A A . 32 LYS HZ2 1 1 12 5758 1 1 32 LYS HZ3 H -6.447 3.416 -1.903 1.00 . A A . 32 LYS HZ3 1 1 12 5759 1 1 32 LYS N N -7.663 -3.313 -2.133 1.00 . A A . 32 LYS N 1 1 12 5760 1 1 32 LYS NZ N -6.540 3.356 -2.963 1.00 . A A . 32 LYS NZ 1 1 12 5761 1 1 32 LYS O O -5.014 -2.256 -2.758 1.00 . A A . 32 LYS O 1 1 12 5762 1 1 33 LYS C C -4.105 -1.091 -6.251 1.00 . A A . 33 LYS C 1 1 12 5763 1 1 33 LYS CA C -4.464 -2.354 -5.462 1.00 . A A . 33 LYS CA 1 1 12 5764 1 1 33 LYS CB C -4.410 -3.571 -6.396 1.00 . A A . 33 LYS CB 1 1 12 5765 1 1 33 LYS CD C -1.966 -3.218 -6.925 1.00 . A A . 33 LYS CD 1 1 12 5766 1 1 33 LYS CE C -2.254 -2.903 -8.398 1.00 . A A . 33 LYS CE 1 1 12 5767 1 1 33 LYS CG C -3.009 -4.203 -6.374 1.00 . A A . 33 LYS CG 1 1 12 5768 1 1 33 LYS H H -6.592 -2.257 -5.444 1.00 . A A . 33 LYS H 1 1 12 5769 1 1 33 LYS HA H -3.737 -2.489 -4.676 1.00 . A A . 33 LYS HA 1 1 12 5770 1 1 33 LYS HB2 H -5.135 -4.302 -6.067 1.00 . A A . 33 LYS HB2 1 1 12 5771 1 1 33 LYS HB3 H -4.649 -3.264 -7.402 1.00 . A A . 33 LYS HB3 1 1 12 5772 1 1 33 LYS HD2 H -1.994 -2.306 -6.349 1.00 . A A . 33 LYS HD2 1 1 12 5773 1 1 33 LYS HD3 H -0.982 -3.658 -6.843 1.00 . A A . 33 LYS HD3 1 1 12 5774 1 1 33 LYS HE2 H -1.400 -3.182 -8.999 1.00 . A A . 33 LYS HE2 1 1 12 5775 1 1 33 LYS HE3 H -3.120 -3.461 -8.727 1.00 . A A . 33 LYS HE3 1 1 12 5776 1 1 33 LYS HG2 H -2.752 -4.467 -5.359 1.00 . A A . 33 LYS HG2 1 1 12 5777 1 1 33 LYS HG3 H -3.011 -5.096 -6.982 1.00 . A A . 33 LYS HG3 1 1 12 5778 1 1 33 LYS HZ1 H -2.399 -1.164 -9.544 1.00 . A A . 33 LYS HZ1 1 1 12 5779 1 1 33 LYS HZ2 H -1.824 -0.894 -7.948 1.00 . A A . 33 LYS HZ2 1 1 12 5780 1 1 33 LYS HZ3 H -3.494 -1.219 -8.233 1.00 . A A . 33 LYS HZ3 1 1 12 5781 1 1 33 LYS N N -5.803 -2.265 -4.862 1.00 . A A . 33 LYS N 1 1 12 5782 1 1 33 LYS NZ N -2.514 -1.442 -8.550 1.00 . A A . 33 LYS NZ 1 1 12 5783 1 1 33 LYS O O -4.465 -0.957 -7.426 1.00 . A A . 33 LYS O 1 1 12 5784 1 1 34 ASP C C -1.529 0.893 -6.866 1.00 . A A . 34 ASP C 1 1 12 5785 1 1 34 ASP CA C -2.941 1.044 -6.286 1.00 . A A . 34 ASP CA 1 1 12 5786 1 1 34 ASP CB C -2.981 2.203 -5.290 1.00 . A A . 34 ASP CB 1 1 12 5787 1 1 34 ASP CG C -4.422 2.529 -4.942 1.00 . A A . 34 ASP CG 1 1 12 5788 1 1 34 ASP H H -3.079 -0.353 -4.689 1.00 . A A . 34 ASP H 1 1 12 5789 1 1 34 ASP HA H -3.625 1.258 -7.093 1.00 . A A . 34 ASP HA 1 1 12 5790 1 1 34 ASP HB2 H -2.448 1.923 -4.393 1.00 . A A . 34 ASP HB2 1 1 12 5791 1 1 34 ASP HB3 H -2.514 3.070 -5.730 1.00 . A A . 34 ASP HB3 1 1 12 5792 1 1 34 ASP N N -3.364 -0.186 -5.618 1.00 . A A . 34 ASP N 1 1 12 5793 1 1 34 ASP O O -0.865 1.901 -7.054 1.00 . A A . 34 ASP O 1 1 12 5794 1 1 34 ASP OXT O -1.138 -0.234 -7.128 1.00 . A A . 34 ASP OXT 1 1 12 5795 1 1 34 ASP OD1 O -5.068 3.204 -5.721 1.00 . A A . 34 ASP OD1 1 1 12 5796 1 1 34 ASP OD2 O -4.862 2.101 -3.888 1.00 . A A . 34 ASP OD2 1 1 13 5797 1 1 1 GLY C C 11.218 8.909 -0.836 1.00 . A A . 1 GLY C 1 1 13 5798 1 1 1 GLY CA C 11.869 8.443 0.461 1.00 . A A . 1 GLY CA 1 1 13 5799 1 1 1 GLY H1 H 10.417 9.393 1.622 1.00 . A A . 1 GLY H1 1 1 13 5800 1 1 1 GLY H2 H 11.316 8.222 2.462 1.00 . A A . 1 GLY H2 1 1 13 5801 1 1 1 GLY H3 H 10.107 7.738 1.357 1.00 . A A . 1 GLY H3 1 1 13 5802 1 1 1 GLY HA2 H 12.682 9.107 0.715 1.00 . A A . 1 GLY HA2 1 1 13 5803 1 1 1 GLY HA3 H 12.249 7.441 0.328 1.00 . A A . 1 GLY HA3 1 1 13 5804 1 1 1 GLY N N 10.854 8.453 1.559 1.00 . A A . 1 GLY N 1 1 13 5805 1 1 1 GLY O O 11.284 10.086 -1.185 1.00 . A A . 1 GLY O 1 1 13 5806 1 1 2 SER C C 8.435 8.630 -2.523 1.00 . A A . 2 SER C 1 1 13 5807 1 1 2 SER CA C 9.900 8.292 -2.791 1.00 . A A . 2 SER CA 1 1 13 5808 1 1 2 SER CB C 9.991 7.098 -3.748 1.00 . A A . 2 SER CB 1 1 13 5809 1 1 2 SER H H 10.556 7.047 -1.191 1.00 . A A . 2 SER H 1 1 13 5810 1 1 2 SER HA H 10.377 9.146 -3.248 1.00 . A A . 2 SER HA 1 1 13 5811 1 1 2 SER HB2 H 11.002 7.002 -4.109 1.00 . A A . 2 SER HB2 1 1 13 5812 1 1 2 SER HB3 H 9.714 6.194 -3.219 1.00 . A A . 2 SER HB3 1 1 13 5813 1 1 2 SER HG H 9.440 6.787 -5.597 1.00 . A A . 2 SER HG 1 1 13 5814 1 1 2 SER N N 10.581 7.977 -1.536 1.00 . A A . 2 SER N 1 1 13 5815 1 1 2 SER O O 8.086 9.128 -1.452 1.00 . A A . 2 SER O 1 1 13 5816 1 1 2 SER OG O 9.114 7.307 -4.854 1.00 . A A . 2 SER OG 1 1 13 5817 1 1 3 VAL C C 5.493 7.543 -2.503 1.00 . A A . 3 VAL C 1 1 13 5818 1 1 3 VAL CA C 6.157 8.618 -3.363 1.00 . A A . 3 VAL CA 1 1 13 5819 1 1 3 VAL CB C 5.493 8.670 -4.744 1.00 . A A . 3 VAL CB 1 1 13 5820 1 1 3 VAL CG1 C 5.629 10.081 -5.321 1.00 . A A . 3 VAL CG1 1 1 13 5821 1 1 3 VAL CG2 C 6.172 7.674 -5.688 1.00 . A A . 3 VAL CG2 1 1 13 5822 1 1 3 VAL H H 7.932 7.943 -4.332 1.00 . A A . 3 VAL H 1 1 13 5823 1 1 3 VAL HA H 6.030 9.575 -2.879 1.00 . A A . 3 VAL HA 1 1 13 5824 1 1 3 VAL HB H 4.446 8.421 -4.649 1.00 . A A . 3 VAL HB 1 1 13 5825 1 1 3 VAL HG11 H 6.675 10.311 -5.467 1.00 . A A . 3 VAL HG11 1 1 13 5826 1 1 3 VAL HG12 H 5.196 10.795 -4.636 1.00 . A A . 3 VAL HG12 1 1 13 5827 1 1 3 VAL HG13 H 5.113 10.133 -6.269 1.00 . A A . 3 VAL HG13 1 1 13 5828 1 1 3 VAL HG21 H 7.056 8.127 -6.115 1.00 . A A . 3 VAL HG21 1 1 13 5829 1 1 3 VAL HG22 H 5.488 7.406 -6.479 1.00 . A A . 3 VAL HG22 1 1 13 5830 1 1 3 VAL HG23 H 6.452 6.790 -5.137 1.00 . A A . 3 VAL HG23 1 1 13 5831 1 1 3 VAL N N 7.585 8.350 -3.499 1.00 . A A . 3 VAL N 1 1 13 5832 1 1 3 VAL O O 5.639 6.346 -2.759 1.00 . A A . 3 VAL O 1 1 13 5833 1 1 4 GLY C C 3.623 5.796 -1.246 1.00 . A A . 4 GLY C 1 1 13 5834 1 1 4 GLY CA C 4.095 7.071 -0.552 1.00 . A A . 4 GLY CA 1 1 13 5835 1 1 4 GLY H H 4.710 8.950 -1.322 1.00 . A A . 4 GLY H 1 1 13 5836 1 1 4 GLY HA2 H 4.775 6.804 0.243 1.00 . A A . 4 GLY HA2 1 1 13 5837 1 1 4 GLY HA3 H 3.240 7.574 -0.127 1.00 . A A . 4 GLY HA3 1 1 13 5838 1 1 4 GLY N N 4.776 7.984 -1.473 1.00 . A A . 4 GLY N 1 1 13 5839 1 1 4 GLY O O 3.984 4.696 -0.841 1.00 . A A . 4 GLY O 1 1 13 5840 1 1 5 CYS C C 3.375 3.834 -3.451 1.00 . A A . 5 CYS C 1 1 13 5841 1 1 5 CYS CA C 2.273 4.795 -3.011 1.00 . A A . 5 CYS CA 1 1 13 5842 1 1 5 CYS CB C 1.493 5.264 -4.239 1.00 . A A . 5 CYS CB 1 1 13 5843 1 1 5 CYS H H 2.541 6.845 -2.559 1.00 . A A . 5 CYS H 1 1 13 5844 1 1 5 CYS HA H 1.602 4.261 -2.353 1.00 . A A . 5 CYS HA 1 1 13 5845 1 1 5 CYS HB2 H 2.174 5.706 -4.950 1.00 . A A . 5 CYS HB2 1 1 13 5846 1 1 5 CYS HB3 H 1.005 4.421 -4.690 1.00 . A A . 5 CYS HB3 1 1 13 5847 1 1 5 CYS N N 2.805 5.946 -2.283 1.00 . A A . 5 CYS N 1 1 13 5848 1 1 5 CYS O O 3.109 2.664 -3.703 1.00 . A A . 5 CYS O 1 1 13 5849 1 1 5 CYS SG S 0.256 6.495 -3.748 1.00 . A A . 5 CYS SG 1 1 13 5850 1 1 6 ALA C C 6.372 2.878 -2.679 1.00 . A A . 6 ALA C 1 1 13 5851 1 1 6 ALA CA C 5.728 3.482 -3.924 1.00 . A A . 6 ALA CA 1 1 13 5852 1 1 6 ALA CB C 6.754 4.310 -4.700 1.00 . A A . 6 ALA CB 1 1 13 5853 1 1 6 ALA H H 4.762 5.273 -3.309 1.00 . A A . 6 ALA H 1 1 13 5854 1 1 6 ALA HA H 5.370 2.683 -4.554 1.00 . A A . 6 ALA HA 1 1 13 5855 1 1 6 ALA HB1 H 6.260 4.820 -5.514 1.00 . A A . 6 ALA HB1 1 1 13 5856 1 1 6 ALA HB2 H 7.521 3.658 -5.093 1.00 . A A . 6 ALA HB2 1 1 13 5857 1 1 6 ALA HB3 H 7.205 5.038 -4.041 1.00 . A A . 6 ALA HB3 1 1 13 5858 1 1 6 ALA N N 4.603 4.326 -3.531 1.00 . A A . 6 ALA N 1 1 13 5859 1 1 6 ALA O O 6.700 1.687 -2.635 1.00 . A A . 6 ALA O 1 1 13 5860 1 1 7 GLU C C 6.088 2.389 0.354 1.00 . A A . 7 GLU C 1 1 13 5861 1 1 7 GLU CA C 7.096 3.263 -0.394 1.00 . A A . 7 GLU CA 1 1 13 5862 1 1 7 GLU CB C 7.478 4.477 0.453 1.00 . A A . 7 GLU CB 1 1 13 5863 1 1 7 GLU CD C 9.368 6.113 0.222 1.00 . A A . 7 GLU CD 1 1 13 5864 1 1 7 GLU CG C 8.138 5.522 -0.451 1.00 . A A . 7 GLU CG 1 1 13 5865 1 1 7 GLU H H 6.219 4.637 -1.749 1.00 . A A . 7 GLU H 1 1 13 5866 1 1 7 GLU HA H 7.985 2.691 -0.598 1.00 . A A . 7 GLU HA 1 1 13 5867 1 1 7 GLU HB2 H 6.590 4.896 0.907 1.00 . A A . 7 GLU HB2 1 1 13 5868 1 1 7 GLU HB3 H 8.172 4.178 1.224 1.00 . A A . 7 GLU HB3 1 1 13 5869 1 1 7 GLU HG2 H 8.434 5.051 -1.378 1.00 . A A . 7 GLU HG2 1 1 13 5870 1 1 7 GLU HG3 H 7.432 6.308 -0.659 1.00 . A A . 7 GLU HG3 1 1 13 5871 1 1 7 GLU N N 6.520 3.708 -1.656 1.00 . A A . 7 GLU N 1 1 13 5872 1 1 7 GLU O O 6.455 1.445 1.057 1.00 . A A . 7 GLU O 1 1 13 5873 1 1 7 GLU OE1 O 9.212 6.778 1.231 1.00 . A A . 7 GLU OE1 1 1 13 5874 1 1 7 GLU OE2 O 10.453 5.913 -0.295 1.00 . A A . 7 GLU OE2 1 1 13 5875 1 1 8 CYS C C 3.866 0.477 0.565 1.00 . A A . 8 CYS C 1 1 13 5876 1 1 8 CYS CA C 3.726 1.977 0.815 1.00 . A A . 8 CYS CA 1 1 13 5877 1 1 8 CYS CB C 2.369 2.476 0.312 1.00 . A A . 8 CYS CB 1 1 13 5878 1 1 8 CYS H H 4.589 3.480 -0.400 1.00 . A A . 8 CYS H 1 1 13 5879 1 1 8 CYS HA H 3.774 2.157 1.871 1.00 . A A . 8 CYS HA 1 1 13 5880 1 1 8 CYS HB2 H 2.516 3.249 -0.425 1.00 . A A . 8 CYS HB2 1 1 13 5881 1 1 8 CYS HB3 H 1.812 1.668 -0.125 1.00 . A A . 8 CYS HB3 1 1 13 5882 1 1 8 CYS N N 4.809 2.717 0.177 1.00 . A A . 8 CYS N 1 1 13 5883 1 1 8 CYS O O 3.949 -0.310 1.509 1.00 . A A . 8 CYS O 1 1 13 5884 1 1 8 CYS SG S 1.452 3.147 1.711 1.00 . A A . 8 CYS SG 1 1 13 5885 1 1 9 PRO C C 5.452 -1.863 -0.621 1.00 . A A . 9 PRO C 1 1 13 5886 1 1 9 PRO CA C 4.078 -1.367 -1.040 1.00 . A A . 9 PRO CA 1 1 13 5887 1 1 9 PRO CB C 3.909 -1.404 -2.561 1.00 . A A . 9 PRO CB 1 1 13 5888 1 1 9 PRO CD C 3.832 0.925 -1.869 1.00 . A A . 9 PRO CD 1 1 13 5889 1 1 9 PRO CG C 4.162 -0.010 -3.032 1.00 . A A . 9 PRO CG 1 1 13 5890 1 1 9 PRO HA H 3.309 -1.961 -0.571 1.00 . A A . 9 PRO HA 1 1 13 5891 1 1 9 PRO HB2 H 4.625 -2.085 -3.001 1.00 . A A . 9 PRO HB2 1 1 13 5892 1 1 9 PRO HB3 H 2.904 -1.702 -2.819 1.00 . A A . 9 PRO HB3 1 1 13 5893 1 1 9 PRO HD2 H 4.553 1.723 -1.814 1.00 . A A . 9 PRO HD2 1 1 13 5894 1 1 9 PRO HD3 H 2.836 1.322 -1.972 1.00 . A A . 9 PRO HD3 1 1 13 5895 1 1 9 PRO HG2 H 5.200 0.099 -3.315 1.00 . A A . 9 PRO HG2 1 1 13 5896 1 1 9 PRO HG3 H 3.525 0.219 -3.872 1.00 . A A . 9 PRO HG3 1 1 13 5897 1 1 9 PRO N N 3.917 0.069 -0.680 1.00 . A A . 9 PRO N 1 1 13 5898 1 1 9 PRO O O 5.612 -2.999 -0.181 1.00 . A A . 9 PRO O 1 1 13 5899 1 1 10 MET C C 7.805 -1.685 1.155 1.00 . A A . 10 MET C 1 1 13 5900 1 1 10 MET CA C 7.797 -1.326 -0.327 1.00 . A A . 10 MET CA 1 1 13 5901 1 1 10 MET CB C 8.732 -0.142 -0.573 1.00 . A A . 10 MET CB 1 1 13 5902 1 1 10 MET CE C 11.563 -0.039 -3.498 1.00 . A A . 10 MET CE 1 1 13 5903 1 1 10 MET CG C 9.321 -0.231 -1.981 1.00 . A A . 10 MET CG 1 1 13 5904 1 1 10 MET H H 6.251 -0.079 -1.072 1.00 . A A . 10 MET H 1 1 13 5905 1 1 10 MET HA H 8.137 -2.177 -0.897 1.00 . A A . 10 MET HA 1 1 13 5906 1 1 10 MET HB2 H 8.176 0.778 -0.473 1.00 . A A . 10 MET HB2 1 1 13 5907 1 1 10 MET HB3 H 9.534 -0.159 0.151 1.00 . A A . 10 MET HB3 1 1 13 5908 1 1 10 MET HE1 H 10.831 -0.353 -4.228 1.00 . A A . 10 MET HE1 1 1 13 5909 1 1 10 MET HE2 H 12.533 -0.443 -3.757 1.00 . A A . 10 MET HE2 1 1 13 5910 1 1 10 MET HE3 H 11.618 1.039 -3.485 1.00 . A A . 10 MET HE3 1 1 13 5911 1 1 10 MET HG2 H 8.807 -0.998 -2.542 1.00 . A A . 10 MET HG2 1 1 13 5912 1 1 10 MET HG3 H 9.207 0.719 -2.480 1.00 . A A . 10 MET HG3 1 1 13 5913 1 1 10 MET N N 6.441 -0.982 -0.732 1.00 . A A . 10 MET N 1 1 13 5914 1 1 10 MET O O 8.498 -2.606 1.584 1.00 . A A . 10 MET O 1 1 13 5915 1 1 10 MET SD S 11.078 -0.643 -1.864 1.00 . A A . 10 MET SD 1 1 13 5916 1 1 11 HIS C C 5.880 -2.273 3.670 1.00 . A A . 11 HIS C 1 1 13 5917 1 1 11 HIS CA C 6.916 -1.187 3.368 1.00 . A A . 11 HIS CA 1 1 13 5918 1 1 11 HIS CB C 6.530 0.109 4.083 1.00 . A A . 11 HIS CB 1 1 13 5919 1 1 11 HIS CD2 C 7.732 1.184 6.157 1.00 . A A . 11 HIS CD2 1 1 13 5920 1 1 11 HIS CE1 C 7.960 -0.607 7.359 1.00 . A A . 11 HIS CE1 1 1 13 5921 1 1 11 HIS CG C 7.184 0.152 5.439 1.00 . A A . 11 HIS CG 1 1 13 5922 1 1 11 HIS H H 6.479 -0.230 1.523 1.00 . A A . 11 HIS H 1 1 13 5923 1 1 11 HIS HA H 7.878 -1.513 3.734 1.00 . A A . 11 HIS HA 1 1 13 5924 1 1 11 HIS HB2 H 6.862 0.955 3.497 1.00 . A A . 11 HIS HB2 1 1 13 5925 1 1 11 HIS HB3 H 5.458 0.154 4.201 1.00 . A A . 11 HIS HB3 1 1 13 5926 1 1 11 HIS HD2 H 7.774 2.213 5.832 1.00 . A A . 11 HIS HD2 1 1 13 5927 1 1 11 HIS HE1 H 8.220 -1.283 8.162 1.00 . A A . 11 HIS HE1 1 1 13 5928 1 1 11 HIS HE2 H 8.669 1.219 8.074 1.00 . A A . 11 HIS HE2 1 1 13 5929 1 1 11 HIS N N 7.013 -0.948 1.930 1.00 . A A . 11 HIS N 1 1 13 5930 1 1 11 HIS ND1 N 7.340 -0.983 6.225 1.00 . A A . 11 HIS ND1 1 1 13 5931 1 1 11 HIS NE2 N 8.223 0.705 7.368 1.00 . A A . 11 HIS NE2 1 1 13 5932 1 1 11 HIS O O 5.279 -2.295 4.751 1.00 . A A . 11 HIS O 1 1 13 5933 1 1 12 CYS C C 5.458 -5.524 3.382 1.00 . A A . 12 CYS C 1 1 13 5934 1 1 12 CYS CA C 4.730 -4.276 2.911 1.00 . A A . 12 CYS CA 1 1 13 5935 1 1 12 CYS CB C 3.976 -4.577 1.619 1.00 . A A . 12 CYS CB 1 1 13 5936 1 1 12 CYS H H 6.203 -3.133 1.890 1.00 . A A . 12 CYS H 1 1 13 5937 1 1 12 CYS HA H 4.017 -3.985 3.669 1.00 . A A . 12 CYS HA 1 1 13 5938 1 1 12 CYS HB2 H 4.091 -3.754 0.937 1.00 . A A . 12 CYS HB2 1 1 13 5939 1 1 12 CYS HB3 H 4.364 -5.479 1.171 1.00 . A A . 12 CYS HB3 1 1 13 5940 1 1 12 CYS N N 5.687 -3.186 2.724 1.00 . A A . 12 CYS N 1 1 13 5941 1 1 12 CYS O O 6.591 -5.783 2.983 1.00 . A A . 12 CYS O 1 1 13 5942 1 1 12 CYS SG S 2.222 -4.795 1.993 1.00 . A A . 12 CYS SG 1 1 13 5943 1 1 13 LYS C C 4.945 -8.727 4.102 1.00 . A A . 13 LYS C 1 1 13 5944 1 1 13 LYS CA C 5.421 -7.463 4.833 1.00 . A A . 13 LYS CA 1 1 13 5945 1 1 13 LYS CB C 5.083 -7.546 6.331 1.00 . A A . 13 LYS CB 1 1 13 5946 1 1 13 LYS CD C 6.566 -5.673 7.171 1.00 . A A . 13 LYS CD 1 1 13 5947 1 1 13 LYS CE C 6.901 -4.506 6.227 1.00 . A A . 13 LYS CE 1 1 13 5948 1 1 13 LYS CG C 5.113 -6.138 6.962 1.00 . A A . 13 LYS CG 1 1 13 5949 1 1 13 LYS H H 3.924 -5.989 4.565 1.00 . A A . 13 LYS H 1 1 13 5950 1 1 13 LYS HA H 6.494 -7.391 4.729 1.00 . A A . 13 LYS HA 1 1 13 5951 1 1 13 LYS HB2 H 4.096 -7.970 6.449 1.00 . A A . 13 LYS HB2 1 1 13 5952 1 1 13 LYS HB3 H 5.805 -8.177 6.829 1.00 . A A . 13 LYS HB3 1 1 13 5953 1 1 13 LYS HD2 H 6.695 -5.351 8.194 1.00 . A A . 13 LYS HD2 1 1 13 5954 1 1 13 LYS HD3 H 7.239 -6.496 6.971 1.00 . A A . 13 LYS HD3 1 1 13 5955 1 1 13 LYS HE2 H 7.964 -4.312 6.261 1.00 . A A . 13 LYS HE2 1 1 13 5956 1 1 13 LYS HE3 H 6.622 -4.768 5.219 1.00 . A A . 13 LYS HE3 1 1 13 5957 1 1 13 LYS HG2 H 4.600 -5.442 6.315 1.00 . A A . 13 LYS HG2 1 1 13 5958 1 1 13 LYS HG3 H 4.611 -6.168 7.918 1.00 . A A . 13 LYS HG3 1 1 13 5959 1 1 13 LYS HZ1 H 5.411 -3.535 7.321 1.00 . A A . 13 LYS HZ1 1 1 13 5960 1 1 13 LYS HZ2 H 5.721 -2.817 5.805 1.00 . A A . 13 LYS HZ2 1 1 13 5961 1 1 13 LYS HZ3 H 6.819 -2.606 7.098 1.00 . A A . 13 LYS HZ3 1 1 13 5962 1 1 13 LYS N N 4.815 -6.265 4.267 1.00 . A A . 13 LYS N 1 1 13 5963 1 1 13 LYS NZ N 6.158 -3.279 6.649 1.00 . A A . 13 LYS NZ 1 1 13 5964 1 1 13 LYS O O 3.779 -8.848 3.722 1.00 . A A . 13 LYS O 1 1 13 5965 1 1 14 GLY C C 4.276 -11.536 3.554 1.00 . A A . 14 GLY C 1 1 13 5966 1 1 14 GLY CA C 5.628 -10.913 3.198 1.00 . A A . 14 GLY CA 1 1 13 5967 1 1 14 GLY H H 6.796 -9.467 4.217 1.00 . A A . 14 GLY H 1 1 13 5968 1 1 14 GLY HA2 H 5.657 -10.731 2.134 1.00 . A A . 14 GLY HA2 1 1 13 5969 1 1 14 GLY HA3 H 6.409 -11.616 3.451 1.00 . A A . 14 GLY HA3 1 1 13 5970 1 1 14 GLY N N 5.887 -9.649 3.899 1.00 . A A . 14 GLY N 1 1 13 5971 1 1 14 GLY O O 3.846 -11.503 4.705 1.00 . A A . 14 GLY O 1 1 13 5972 1 1 15 LYS C C 1.174 -11.850 2.330 1.00 . A A . 15 LYS C 1 1 13 5973 1 1 15 LYS CA C 2.333 -12.790 2.667 1.00 . A A . 15 LYS CA 1 1 13 5974 1 1 15 LYS CB C 2.144 -13.336 4.092 1.00 . A A . 15 LYS CB 1 1 13 5975 1 1 15 LYS CD C -0.260 -13.862 4.597 1.00 . A A . 15 LYS CD 1 1 13 5976 1 1 15 LYS CE C -1.419 -14.437 3.777 1.00 . A A . 15 LYS CE 1 1 13 5977 1 1 15 LYS CG C 1.073 -14.432 4.090 1.00 . A A . 15 LYS CG 1 1 13 5978 1 1 15 LYS H H 4.064 -12.105 1.652 1.00 . A A . 15 LYS H 1 1 13 5979 1 1 15 LYS HA H 2.307 -13.622 1.979 1.00 . A A . 15 LYS HA 1 1 13 5980 1 1 15 LYS HB2 H 3.079 -13.748 4.445 1.00 . A A . 15 LYS HB2 1 1 13 5981 1 1 15 LYS HB3 H 1.837 -12.537 4.749 1.00 . A A . 15 LYS HB3 1 1 13 5982 1 1 15 LYS HD2 H -0.391 -14.126 5.637 1.00 . A A . 15 LYS HD2 1 1 13 5983 1 1 15 LYS HD3 H -0.255 -12.788 4.501 1.00 . A A . 15 LYS HD3 1 1 13 5984 1 1 15 LYS HE2 H -1.130 -15.396 3.369 1.00 . A A . 15 LYS HE2 1 1 13 5985 1 1 15 LYS HE3 H -2.283 -14.563 4.415 1.00 . A A . 15 LYS HE3 1 1 13 5986 1 1 15 LYS HG2 H 0.947 -14.812 3.087 1.00 . A A . 15 LYS HG2 1 1 13 5987 1 1 15 LYS HG3 H 1.385 -15.235 4.741 1.00 . A A . 15 LYS HG3 1 1 13 5988 1 1 15 LYS HZ1 H -0.877 -12.998 2.348 1.00 . A A . 15 LYS HZ1 1 1 13 5989 1 1 15 LYS HZ2 H -2.447 -12.797 2.998 1.00 . A A . 15 LYS HZ2 1 1 13 5990 1 1 15 LYS HZ3 H -2.149 -14.029 1.866 1.00 . A A . 15 LYS HZ3 1 1 13 5991 1 1 15 LYS N N 3.636 -12.116 2.533 1.00 . A A . 15 LYS N 1 1 13 5992 1 1 15 LYS NZ N -1.752 -13.498 2.665 1.00 . A A . 15 LYS NZ 1 1 13 5993 1 1 15 LYS O O 0.086 -12.309 1.962 1.00 . A A . 15 LYS O 1 1 13 5994 1 1 16 MET C C 0.992 -8.325 1.481 1.00 . A A . 16 MET C 1 1 13 5995 1 1 16 MET CA C 0.368 -9.554 2.146 1.00 . A A . 16 MET CA 1 1 13 5996 1 1 16 MET CB C -0.381 -9.118 3.426 1.00 . A A . 16 MET CB 1 1 13 5997 1 1 16 MET CE C -0.934 -9.756 7.166 1.00 . A A . 16 MET CE 1 1 13 5998 1 1 16 MET CG C -0.054 -10.044 4.609 1.00 . A A . 16 MET CG 1 1 13 5999 1 1 16 MET H H 2.288 -10.237 2.746 1.00 . A A . 16 MET H 1 1 13 6000 1 1 16 MET HA H -0.340 -9.993 1.460 1.00 . A A . 16 MET HA 1 1 13 6001 1 1 16 MET HB2 H -0.095 -8.108 3.681 1.00 . A A . 16 MET HB2 1 1 13 6002 1 1 16 MET HB3 H -1.444 -9.146 3.240 1.00 . A A . 16 MET HB3 1 1 13 6003 1 1 16 MET HE1 H -0.998 -8.677 7.199 1.00 . A A . 16 MET HE1 1 1 13 6004 1 1 16 MET HE2 H 0.097 -10.064 7.289 1.00 . A A . 16 MET HE2 1 1 13 6005 1 1 16 MET HE3 H -1.528 -10.173 7.963 1.00 . A A . 16 MET HE3 1 1 13 6006 1 1 16 MET HG2 H 0.329 -10.980 4.246 1.00 . A A . 16 MET HG2 1 1 13 6007 1 1 16 MET HG3 H 0.685 -9.573 5.241 1.00 . A A . 16 MET HG3 1 1 13 6008 1 1 16 MET N N 1.404 -10.544 2.451 1.00 . A A . 16 MET N 1 1 13 6009 1 1 16 MET O O 1.563 -7.476 2.165 1.00 . A A . 16 MET O 1 1 13 6010 1 1 16 MET SD S -1.556 -10.348 5.572 1.00 . A A . 16 MET SD 1 1 13 6011 1 1 17 ALA C C 0.588 -6.460 -1.587 1.00 . A A . 17 ALA C 1 1 13 6012 1 1 17 ALA CA C 1.496 -7.070 -0.524 1.00 . A A . 17 ALA CA 1 1 13 6013 1 1 17 ALA CB C 2.824 -7.453 -1.158 1.00 . A A . 17 ALA CB 1 1 13 6014 1 1 17 ALA H H 0.453 -8.922 -0.364 1.00 . A A . 17 ALA H 1 1 13 6015 1 1 17 ALA HA H 1.689 -6.313 0.222 1.00 . A A . 17 ALA HA 1 1 13 6016 1 1 17 ALA HB1 H 3.535 -7.688 -0.382 1.00 . A A . 17 ALA HB1 1 1 13 6017 1 1 17 ALA HB2 H 3.189 -6.621 -1.743 1.00 . A A . 17 ALA HB2 1 1 13 6018 1 1 17 ALA HB3 H 2.683 -8.310 -1.797 1.00 . A A . 17 ALA HB3 1 1 13 6019 1 1 17 ALA N N 0.903 -8.223 0.154 1.00 . A A . 17 ALA N 1 1 13 6020 1 1 17 ALA O O 0.409 -7.007 -2.681 1.00 . A A . 17 ALA O 1 1 13 6021 1 1 18 LYS C C -0.918 -3.090 -1.599 1.00 . A A . 18 LYS C 1 1 13 6022 1 1 18 LYS CA C -0.800 -4.520 -2.133 1.00 . A A . 18 LYS CA 1 1 13 6023 1 1 18 LYS CB C -2.194 -5.140 -2.311 1.00 . A A . 18 LYS CB 1 1 13 6024 1 1 18 LYS CD C -3.200 -7.366 -1.806 1.00 . A A . 18 LYS CD 1 1 13 6025 1 1 18 LYS CE C -2.163 -8.465 -2.053 1.00 . A A . 18 LYS CE 1 1 13 6026 1 1 18 LYS CG C -2.521 -6.134 -1.193 1.00 . A A . 18 LYS CG 1 1 13 6027 1 1 18 LYS H H 0.287 -4.940 -0.368 1.00 . A A . 18 LYS H 1 1 13 6028 1 1 18 LYS HA H -0.322 -4.478 -3.101 1.00 . A A . 18 LYS HA 1 1 13 6029 1 1 18 LYS HB2 H -2.932 -4.352 -2.305 1.00 . A A . 18 LYS HB2 1 1 13 6030 1 1 18 LYS HB3 H -2.232 -5.648 -3.261 1.00 . A A . 18 LYS HB3 1 1 13 6031 1 1 18 LYS HD2 H -3.957 -7.731 -1.133 1.00 . A A . 18 LYS HD2 1 1 13 6032 1 1 18 LYS HD3 H -3.659 -7.094 -2.745 1.00 . A A . 18 LYS HD3 1 1 13 6033 1 1 18 LYS HE2 H -1.458 -8.486 -1.233 1.00 . A A . 18 LYS HE2 1 1 13 6034 1 1 18 LYS HE3 H -2.663 -9.422 -2.119 1.00 . A A . 18 LYS HE3 1 1 13 6035 1 1 18 LYS HG2 H -1.618 -6.430 -0.684 1.00 . A A . 18 LYS HG2 1 1 13 6036 1 1 18 LYS HG3 H -3.193 -5.668 -0.489 1.00 . A A . 18 LYS HG3 1 1 13 6037 1 1 18 LYS HZ1 H -0.522 -7.711 -3.117 1.00 . A A . 18 LYS HZ1 1 1 13 6038 1 1 18 LYS HZ2 H -2.017 -7.566 -3.927 1.00 . A A . 18 LYS HZ2 1 1 13 6039 1 1 18 LYS HZ3 H -1.259 -9.083 -3.827 1.00 . A A . 18 LYS HZ3 1 1 13 6040 1 1 18 LYS N N 0.058 -5.302 -1.243 1.00 . A A . 18 LYS N 1 1 13 6041 1 1 18 LYS NZ N -1.440 -8.189 -3.328 1.00 . A A . 18 LYS NZ 1 1 13 6042 1 1 18 LYS O O -1.428 -2.871 -0.497 1.00 . A A . 18 LYS O 1 1 13 6043 1 1 19 PRO C C -1.832 -0.035 -2.117 1.00 . A A . 19 PRO C 1 1 13 6044 1 1 19 PRO CA C -0.471 -0.695 -1.914 1.00 . A A . 19 PRO CA 1 1 13 6045 1 1 19 PRO CB C 0.581 -0.050 -2.812 1.00 . A A . 19 PRO CB 1 1 13 6046 1 1 19 PRO CD C 0.193 -2.282 -3.663 1.00 . A A . 19 PRO CD 1 1 13 6047 1 1 19 PRO CG C 0.555 -0.852 -4.069 1.00 . A A . 19 PRO CG 1 1 13 6048 1 1 19 PRO HA H -0.164 -0.604 -0.886 1.00 . A A . 19 PRO HA 1 1 13 6049 1 1 19 PRO HB2 H 0.323 0.982 -3.016 1.00 . A A . 19 PRO HB2 1 1 13 6050 1 1 19 PRO HB3 H 1.553 -0.113 -2.355 1.00 . A A . 19 PRO HB3 1 1 13 6051 1 1 19 PRO HD2 H -0.503 -2.711 -4.371 1.00 . A A . 19 PRO HD2 1 1 13 6052 1 1 19 PRO HD3 H 1.081 -2.890 -3.583 1.00 . A A . 19 PRO HD3 1 1 13 6053 1 1 19 PRO HG2 H -0.191 -0.454 -4.746 1.00 . A A . 19 PRO HG2 1 1 13 6054 1 1 19 PRO HG3 H 1.526 -0.841 -4.539 1.00 . A A . 19 PRO HG3 1 1 13 6055 1 1 19 PRO N N -0.438 -2.125 -2.339 1.00 . A A . 19 PRO N 1 1 13 6056 1 1 19 PRO O O -2.385 -0.047 -3.220 1.00 . A A . 19 PRO O 1 1 13 6057 1 1 20 THR C C -3.399 2.761 -0.992 1.00 . A A . 20 THR C 1 1 13 6058 1 1 20 THR CA C -3.631 1.261 -1.116 1.00 . A A . 20 THR CA 1 1 13 6059 1 1 20 THR CB C -4.571 0.794 0.001 1.00 . A A . 20 THR CB 1 1 13 6060 1 1 20 THR CG2 C -4.618 -0.731 0.027 1.00 . A A . 20 THR CG2 1 1 13 6061 1 1 20 THR H H -1.855 0.557 -0.199 1.00 . A A . 20 THR H 1 1 13 6062 1 1 20 THR HA H -4.093 1.055 -2.067 1.00 . A A . 20 THR HA 1 1 13 6063 1 1 20 THR HB H -5.560 1.176 -0.184 1.00 . A A . 20 THR HB 1 1 13 6064 1 1 20 THR HG1 H -3.150 1.053 1.309 1.00 . A A . 20 THR HG1 1 1 13 6065 1 1 20 THR HG21 H -4.457 -1.115 -0.969 1.00 . A A . 20 THR HG21 1 1 13 6066 1 1 20 THR HG22 H -5.584 -1.055 0.386 1.00 . A A . 20 THR HG22 1 1 13 6067 1 1 20 THR HG23 H -3.850 -1.100 0.683 1.00 . A A . 20 THR HG23 1 1 13 6068 1 1 20 THR N N -2.351 0.565 -1.050 1.00 . A A . 20 THR N 1 1 13 6069 1 1 20 THR O O -2.956 3.251 0.052 1.00 . A A . 20 THR O 1 1 13 6070 1 1 20 THR OG1 O -4.100 1.272 1.254 1.00 . A A . 20 THR OG1 1 1 13 6071 1 1 21 CYS C C -4.851 5.616 -2.330 1.00 . A A . 21 CYS C 1 1 13 6072 1 1 21 CYS CA C -3.513 4.925 -2.091 1.00 . A A . 21 CYS CA 1 1 13 6073 1 1 21 CYS CB C -2.497 5.323 -3.165 1.00 . A A . 21 CYS CB 1 1 13 6074 1 1 21 CYS H H -4.031 3.014 -2.870 1.00 . A A . 21 CYS H 1 1 13 6075 1 1 21 CYS HA H -3.136 5.241 -1.132 1.00 . A A . 21 CYS HA 1 1 13 6076 1 1 21 CYS HB2 H -2.433 4.542 -3.908 1.00 . A A . 21 CYS HB2 1 1 13 6077 1 1 21 CYS HB3 H -2.803 6.247 -3.635 1.00 . A A . 21 CYS HB3 1 1 13 6078 1 1 21 CYS N N -3.690 3.478 -2.067 1.00 . A A . 21 CYS N 1 1 13 6079 1 1 21 CYS O O -5.483 5.443 -3.378 1.00 . A A . 21 CYS O 1 1 13 6080 1 1 21 CYS SG S -0.882 5.549 -2.374 1.00 . A A . 21 CYS SG 1 1 13 6081 1 1 22 GLU C C -6.361 8.447 -0.719 1.00 . A A . 22 GLU C 1 1 13 6082 1 1 22 GLU CA C -6.526 7.091 -1.391 1.00 . A A . 22 GLU CA 1 1 13 6083 1 1 22 GLU CB C -7.627 6.275 -0.695 1.00 . A A . 22 GLU CB 1 1 13 6084 1 1 22 GLU CD C -6.911 3.994 0.130 1.00 . A A . 22 GLU CD 1 1 13 6085 1 1 22 GLU CG C -7.039 5.478 0.483 1.00 . A A . 22 GLU CG 1 1 13 6086 1 1 22 GLU H H -4.740 6.470 -0.535 1.00 . A A . 22 GLU H 1 1 13 6087 1 1 22 GLU HA H -6.801 7.242 -2.424 1.00 . A A . 22 GLU HA 1 1 13 6088 1 1 22 GLU HB2 H -8.392 6.944 -0.330 1.00 . A A . 22 GLU HB2 1 1 13 6089 1 1 22 GLU HB3 H -8.061 5.590 -1.407 1.00 . A A . 22 GLU HB3 1 1 13 6090 1 1 22 GLU HG2 H -6.064 5.867 0.731 1.00 . A A . 22 GLU HG2 1 1 13 6091 1 1 22 GLU HG3 H -7.689 5.582 1.339 1.00 . A A . 22 GLU HG3 1 1 13 6092 1 1 22 GLU N N -5.278 6.380 -1.335 1.00 . A A . 22 GLU N 1 1 13 6093 1 1 22 GLU O O -5.783 8.558 0.362 1.00 . A A . 22 GLU O 1 1 13 6094 1 1 22 GLU OE1 O -6.427 3.692 -0.947 1.00 . A A . 22 GLU OE1 1 1 13 6095 1 1 22 GLU OE2 O -7.284 3.175 0.955 1.00 . A A . 22 GLU OE2 1 1 13 6096 1 1 23 ASN C C -5.429 11.154 -0.263 1.00 . A A . 23 ASN C 1 1 13 6097 1 1 23 ASN CA C -6.789 10.843 -0.888 1.00 . A A . 23 ASN CA 1 1 13 6098 1 1 23 ASN CB C -7.908 11.098 0.127 1.00 . A A . 23 ASN CB 1 1 13 6099 1 1 23 ASN CG C -7.907 10.030 1.211 1.00 . A A . 23 ASN CG 1 1 13 6100 1 1 23 ASN H H -7.277 9.279 -2.237 1.00 . A A . 23 ASN H 1 1 13 6101 1 1 23 ASN HA H -6.933 11.511 -1.725 1.00 . A A . 23 ASN HA 1 1 13 6102 1 1 23 ASN HB2 H -7.762 12.066 0.583 1.00 . A A . 23 ASN HB2 1 1 13 6103 1 1 23 ASN HB3 H -8.855 11.085 -0.384 1.00 . A A . 23 ASN HB3 1 1 13 6104 1 1 23 ASN HD21 H -6.357 10.806 2.165 1.00 . A A . 23 ASN HD21 1 1 13 6105 1 1 23 ASN HD22 H -7.009 9.394 2.852 1.00 . A A . 23 ASN HD22 1 1 13 6106 1 1 23 ASN N N -6.858 9.462 -1.385 1.00 . A A . 23 ASN N 1 1 13 6107 1 1 23 ASN ND2 N -7.019 10.081 2.156 1.00 . A A . 23 ASN ND2 1 1 13 6108 1 1 23 ASN O O -5.347 11.644 0.866 1.00 . A A . 23 ASN O 1 1 13 6109 1 1 23 ASN OD1 O -8.737 9.125 1.193 1.00 . A A . 23 ASN OD1 1 1 13 6110 1 1 24 GLU C C -2.590 10.205 0.573 1.00 . A A . 24 GLU C 1 1 13 6111 1 1 24 GLU CA C -3.003 11.128 -0.575 1.00 . A A . 24 GLU CA 1 1 13 6112 1 1 24 GLU CB C -2.840 12.598 -0.152 1.00 . A A . 24 GLU CB 1 1 13 6113 1 1 24 GLU CD C -3.515 12.806 -2.593 1.00 . A A . 24 GLU CD 1 1 13 6114 1 1 24 GLU CG C -2.971 13.541 -1.367 1.00 . A A . 24 GLU CG 1 1 13 6115 1 1 24 GLU H H -4.519 10.492 -1.908 1.00 . A A . 24 GLU H 1 1 13 6116 1 1 24 GLU HA H -2.345 10.942 -1.406 1.00 . A A . 24 GLU HA 1 1 13 6117 1 1 24 GLU HB2 H -3.597 12.849 0.576 1.00 . A A . 24 GLU HB2 1 1 13 6118 1 1 24 GLU HB3 H -1.865 12.732 0.293 1.00 . A A . 24 GLU HB3 1 1 13 6119 1 1 24 GLU HG2 H -3.642 14.349 -1.117 1.00 . A A . 24 GLU HG2 1 1 13 6120 1 1 24 GLU HG3 H -2.001 13.951 -1.604 1.00 . A A . 24 GLU HG3 1 1 13 6121 1 1 24 GLU N N -4.373 10.869 -1.016 1.00 . A A . 24 GLU N 1 1 13 6122 1 1 24 GLU O O -1.463 10.286 1.065 1.00 . A A . 24 GLU O 1 1 13 6123 1 1 24 GLU OE1 O -2.715 12.260 -3.333 1.00 . A A . 24 GLU OE1 1 1 13 6124 1 1 24 GLU OE2 O -4.723 12.803 -2.773 1.00 . A A . 24 GLU OE2 1 1 13 6125 1 1 25 VAL C C -2.807 7.027 1.504 1.00 . A A . 25 VAL C 1 1 13 6126 1 1 25 VAL CA C -3.176 8.394 2.073 1.00 . A A . 25 VAL CA 1 1 13 6127 1 1 25 VAL CB C -4.372 8.263 3.026 1.00 . A A . 25 VAL CB 1 1 13 6128 1 1 25 VAL CG1 C -4.101 7.157 4.050 1.00 . A A . 25 VAL CG1 1 1 13 6129 1 1 25 VAL CG2 C -4.577 9.587 3.767 1.00 . A A . 25 VAL CG2 1 1 13 6130 1 1 25 VAL H H -4.377 9.287 0.565 1.00 . A A . 25 VAL H 1 1 13 6131 1 1 25 VAL HA H -2.333 8.777 2.629 1.00 . A A . 25 VAL HA 1 1 13 6132 1 1 25 VAL HB H -5.261 8.021 2.461 1.00 . A A . 25 VAL HB 1 1 13 6133 1 1 25 VAL HG11 H -3.877 6.234 3.535 1.00 . A A . 25 VAL HG11 1 1 13 6134 1 1 25 VAL HG12 H -4.976 7.019 4.668 1.00 . A A . 25 VAL HG12 1 1 13 6135 1 1 25 VAL HG13 H -3.263 7.438 4.671 1.00 . A A . 25 VAL HG13 1 1 13 6136 1 1 25 VAL HG21 H -5.413 9.494 4.445 1.00 . A A . 25 VAL HG21 1 1 13 6137 1 1 25 VAL HG22 H -4.777 10.373 3.054 1.00 . A A . 25 VAL HG22 1 1 13 6138 1 1 25 VAL HG23 H -3.686 9.829 4.327 1.00 . A A . 25 VAL HG23 1 1 13 6139 1 1 25 VAL N N -3.489 9.322 0.992 1.00 . A A . 25 VAL N 1 1 13 6140 1 1 25 VAL O O -3.660 6.306 0.981 1.00 . A A . 25 VAL O 1 1 13 6141 1 1 26 CYS C C -0.888 4.393 2.222 1.00 . A A . 26 CYS C 1 1 13 6142 1 1 26 CYS CA C -1.045 5.408 1.092 1.00 . A A . 26 CYS CA 1 1 13 6143 1 1 26 CYS CB C 0.301 5.594 0.388 1.00 . A A . 26 CYS CB 1 1 13 6144 1 1 26 CYS H H -0.890 7.299 2.016 1.00 . A A . 26 CYS H 1 1 13 6145 1 1 26 CYS HA H -1.757 5.027 0.379 1.00 . A A . 26 CYS HA 1 1 13 6146 1 1 26 CYS HB2 H 0.334 4.964 -0.479 1.00 . A A . 26 CYS HB2 1 1 13 6147 1 1 26 CYS HB3 H 0.414 6.618 0.086 1.00 . A A . 26 CYS HB3 1 1 13 6148 1 1 26 CYS N N -1.525 6.683 1.600 1.00 . A A . 26 CYS N 1 1 13 6149 1 1 26 CYS O O -0.277 4.680 3.251 1.00 . A A . 26 CYS O 1 1 13 6150 1 1 26 CYS SG S 1.651 5.145 1.504 1.00 . A A . 26 CYS SG 1 1 13 6151 1 1 27 LYS C C -1.286 0.777 2.310 1.00 . A A . 27 LYS C 1 1 13 6152 1 1 27 LYS CA C -1.347 2.133 3.012 1.00 . A A . 27 LYS CA 1 1 13 6153 1 1 27 LYS CB C -2.563 2.138 3.959 1.00 . A A . 27 LYS CB 1 1 13 6154 1 1 27 LYS CD C -4.511 3.676 4.290 1.00 . A A . 27 LYS CD 1 1 13 6155 1 1 27 LYS CE C -4.984 3.827 2.839 1.00 . A A . 27 LYS CE 1 1 13 6156 1 1 27 LYS CG C -2.982 3.569 4.325 1.00 . A A . 27 LYS CG 1 1 13 6157 1 1 27 LYS H H -1.920 3.037 1.170 1.00 . A A . 27 LYS H 1 1 13 6158 1 1 27 LYS HA H -0.447 2.272 3.594 1.00 . A A . 27 LYS HA 1 1 13 6159 1 1 27 LYS HB2 H -3.390 1.639 3.477 1.00 . A A . 27 LYS HB2 1 1 13 6160 1 1 27 LYS HB3 H -2.307 1.602 4.863 1.00 . A A . 27 LYS HB3 1 1 13 6161 1 1 27 LYS HD2 H -4.945 2.786 4.722 1.00 . A A . 27 LYS HD2 1 1 13 6162 1 1 27 LYS HD3 H -4.824 4.539 4.858 1.00 . A A . 27 LYS HD3 1 1 13 6163 1 1 27 LYS HE2 H -5.724 4.614 2.781 1.00 . A A . 27 LYS HE2 1 1 13 6164 1 1 27 LYS HE3 H -4.143 4.079 2.207 1.00 . A A . 27 LYS HE3 1 1 13 6165 1 1 27 LYS HG2 H -2.628 3.802 5.320 1.00 . A A . 27 LYS HG2 1 1 13 6166 1 1 27 LYS HG3 H -2.561 4.267 3.627 1.00 . A A . 27 LYS HG3 1 1 13 6167 1 1 27 LYS HZ1 H -4.862 1.972 1.856 1.00 . A A . 27 LYS HZ1 1 1 13 6168 1 1 27 LYS HZ2 H -6.400 2.750 1.724 1.00 . A A . 27 LYS HZ2 1 1 13 6169 1 1 27 LYS HZ3 H -5.930 2.006 3.198 1.00 . A A . 27 LYS HZ3 1 1 13 6170 1 1 27 LYS N N -1.442 3.204 2.016 1.00 . A A . 27 LYS N 1 1 13 6171 1 1 27 LYS NZ N -5.587 2.543 2.379 1.00 . A A . 27 LYS NZ 1 1 13 6172 1 1 27 LYS O O -1.913 0.589 1.269 1.00 . A A . 27 LYS O 1 1 13 6173 1 1 28 CYS C C -1.587 -2.372 2.897 1.00 . A A . 28 CYS C 1 1 13 6174 1 1 28 CYS CA C -0.482 -1.511 2.303 1.00 . A A . 28 CYS CA 1 1 13 6175 1 1 28 CYS CB C 0.880 -2.148 2.579 1.00 . A A . 28 CYS CB 1 1 13 6176 1 1 28 CYS H H -0.101 0.015 3.728 1.00 . A A . 28 CYS H 1 1 13 6177 1 1 28 CYS HA H -0.629 -1.439 1.236 1.00 . A A . 28 CYS HA 1 1 13 6178 1 1 28 CYS HB2 H 1.621 -1.374 2.721 1.00 . A A . 28 CYS HB2 1 1 13 6179 1 1 28 CYS HB3 H 0.823 -2.761 3.467 1.00 . A A . 28 CYS HB3 1 1 13 6180 1 1 28 CYS N N -0.562 -0.174 2.888 1.00 . A A . 28 CYS N 1 1 13 6181 1 1 28 CYS O O -1.476 -2.844 4.026 1.00 . A A . 28 CYS O 1 1 13 6182 1 1 28 CYS SG S 1.346 -3.178 1.164 1.00 . A A . 28 CYS SG 1 1 13 6183 1 1 29 ASN C C -4.428 -4.179 1.542 1.00 . A A . 29 ASN C 1 1 13 6184 1 1 29 ASN CA C -3.808 -3.311 2.634 1.00 . A A . 29 ASN CA 1 1 13 6185 1 1 29 ASN CB C -4.867 -2.361 3.198 1.00 . A A . 29 ASN CB 1 1 13 6186 1 1 29 ASN CG C -6.081 -3.154 3.659 1.00 . A A . 29 ASN CG 1 1 13 6187 1 1 29 ASN H H -2.712 -2.123 1.261 1.00 . A A . 29 ASN H 1 1 13 6188 1 1 29 ASN HA H -3.473 -3.952 3.430 1.00 . A A . 29 ASN HA 1 1 13 6189 1 1 29 ASN HB2 H -4.453 -1.822 4.037 1.00 . A A . 29 ASN HB2 1 1 13 6190 1 1 29 ASN HB3 H -5.166 -1.662 2.433 1.00 . A A . 29 ASN HB3 1 1 13 6191 1 1 29 ASN HD21 H -7.393 -1.892 2.881 1.00 . A A . 29 ASN HD21 1 1 13 6192 1 1 29 ASN HD22 H -8.056 -3.237 3.673 1.00 . A A . 29 ASN HD22 1 1 13 6193 1 1 29 ASN N N -2.670 -2.541 2.146 1.00 . A A . 29 ASN N 1 1 13 6194 1 1 29 ASN ND2 N -7.275 -2.724 3.383 1.00 . A A . 29 ASN ND2 1 1 13 6195 1 1 29 ASN O O -4.547 -3.767 0.389 1.00 . A A . 29 ASN O 1 1 13 6196 1 1 29 ASN OD1 O -5.934 -4.199 4.287 1.00 . A A . 29 ASN OD1 1 1 13 6197 1 1 30 ILE C C -6.854 -5.793 0.580 1.00 . A A . 30 ILE C 1 1 13 6198 1 1 30 ILE CA C -5.482 -6.306 1.000 1.00 . A A . 30 ILE CA 1 1 13 6199 1 1 30 ILE CB C -5.602 -7.714 1.615 1.00 . A A . 30 ILE CB 1 1 13 6200 1 1 30 ILE CD1 C -3.895 -7.483 3.413 1.00 . A A . 30 ILE CD1 1 1 13 6201 1 1 30 ILE CG1 C -5.391 -7.648 3.130 1.00 . A A . 30 ILE CG1 1 1 13 6202 1 1 30 ILE CG2 C -4.561 -8.656 0.999 1.00 . A A . 30 ILE CG2 1 1 13 6203 1 1 30 ILE H H -4.741 -5.634 2.869 1.00 . A A . 30 ILE H 1 1 13 6204 1 1 30 ILE HA H -4.867 -6.374 0.118 1.00 . A A . 30 ILE HA 1 1 13 6205 1 1 30 ILE HB H -6.590 -8.105 1.413 1.00 . A A . 30 ILE HB 1 1 13 6206 1 1 30 ILE HD11 H -3.755 -6.763 4.202 1.00 . A A . 30 ILE HD11 1 1 13 6207 1 1 30 ILE HD12 H -3.394 -7.139 2.517 1.00 . A A . 30 ILE HD12 1 1 13 6208 1 1 30 ILE HD13 H -3.482 -8.434 3.711 1.00 . A A . 30 ILE HD13 1 1 13 6209 1 1 30 ILE HG12 H -5.937 -6.809 3.538 1.00 . A A . 30 ILE HG12 1 1 13 6210 1 1 30 ILE HG13 H -5.742 -8.562 3.583 1.00 . A A . 30 ILE HG13 1 1 13 6211 1 1 30 ILE HG21 H -4.916 -9.009 0.043 1.00 . A A . 30 ILE HG21 1 1 13 6212 1 1 30 ILE HG22 H -4.404 -9.497 1.658 1.00 . A A . 30 ILE HG22 1 1 13 6213 1 1 30 ILE HG23 H -3.629 -8.126 0.867 1.00 . A A . 30 ILE HG23 1 1 13 6214 1 1 30 ILE N N -4.844 -5.378 1.931 1.00 . A A . 30 ILE N 1 1 13 6215 1 1 30 ILE O O -7.610 -5.250 1.386 1.00 . A A . 30 ILE O 1 1 13 6216 1 1 31 GLY C C -8.246 -4.372 -2.236 1.00 . A A . 31 GLY C 1 1 13 6217 1 1 31 GLY CA C -8.432 -5.535 -1.262 1.00 . A A . 31 GLY CA 1 1 13 6218 1 1 31 GLY H H -6.502 -6.415 -1.273 1.00 . A A . 31 GLY H 1 1 13 6219 1 1 31 GLY HA2 H -8.896 -6.361 -1.781 1.00 . A A . 31 GLY HA2 1 1 13 6220 1 1 31 GLY HA3 H -9.077 -5.215 -0.461 1.00 . A A . 31 GLY HA3 1 1 13 6221 1 1 31 GLY N N -7.157 -5.974 -0.698 1.00 . A A . 31 GLY N 1 1 13 6222 1 1 31 GLY O O -9.098 -4.126 -3.088 1.00 . A A . 31 GLY O 1 1 13 6223 1 1 32 LYS C C -5.352 -2.527 -3.389 1.00 . A A . 32 LYS C 1 1 13 6224 1 1 32 LYS CA C -6.833 -2.538 -3.002 1.00 . A A . 32 LYS CA 1 1 13 6225 1 1 32 LYS CB C -7.207 -1.220 -2.305 1.00 . A A . 32 LYS CB 1 1 13 6226 1 1 32 LYS CD C -7.814 1.184 -2.677 1.00 . A A . 32 LYS CD 1 1 13 6227 1 1 32 LYS CE C -7.659 2.389 -3.616 1.00 . A A . 32 LYS CE 1 1 13 6228 1 1 32 LYS CG C -7.192 -0.066 -3.318 1.00 . A A . 32 LYS CG 1 1 13 6229 1 1 32 LYS H H -6.480 -3.916 -1.423 1.00 . A A . 32 LYS H 1 1 13 6230 1 1 32 LYS HA H -7.424 -2.638 -3.897 1.00 . A A . 32 LYS HA 1 1 13 6231 1 1 32 LYS HB2 H -8.196 -1.311 -1.878 1.00 . A A . 32 LYS HB2 1 1 13 6232 1 1 32 LYS HB3 H -6.497 -1.016 -1.520 1.00 . A A . 32 LYS HB3 1 1 13 6233 1 1 32 LYS HD2 H -8.864 1.007 -2.493 1.00 . A A . 32 LYS HD2 1 1 13 6234 1 1 32 LYS HD3 H -7.318 1.394 -1.741 1.00 . A A . 32 LYS HD3 1 1 13 6235 1 1 32 LYS HE2 H -7.517 2.041 -4.630 1.00 . A A . 32 LYS HE2 1 1 13 6236 1 1 32 LYS HE3 H -8.550 3.000 -3.567 1.00 . A A . 32 LYS HE3 1 1 13 6237 1 1 32 LYS HG2 H -6.172 0.145 -3.609 1.00 . A A . 32 LYS HG2 1 1 13 6238 1 1 32 LYS HG3 H -7.766 -0.344 -4.190 1.00 . A A . 32 LYS HG3 1 1 13 6239 1 1 32 LYS HZ1 H -5.588 2.692 -3.474 1.00 . A A . 32 LYS HZ1 1 1 13 6240 1 1 32 LYS HZ2 H -6.482 3.328 -2.137 1.00 . A A . 32 LYS HZ2 1 1 13 6241 1 1 32 LYS HZ3 H -6.497 4.134 -3.657 1.00 . A A . 32 LYS HZ3 1 1 13 6242 1 1 32 LYS N N -7.125 -3.669 -2.116 1.00 . A A . 32 LYS N 1 1 13 6243 1 1 32 LYS NZ N -6.476 3.195 -3.194 1.00 . A A . 32 LYS NZ 1 1 13 6244 1 1 32 LYS O O -4.485 -2.806 -2.562 1.00 . A A . 32 LYS O 1 1 13 6245 1 1 33 LYS C C -3.448 -1.006 -6.076 1.00 . A A . 33 LYS C 1 1 13 6246 1 1 33 LYS CA C -3.683 -2.184 -5.129 1.00 . A A . 33 LYS CA 1 1 13 6247 1 1 33 LYS CB C -3.356 -3.499 -5.849 1.00 . A A . 33 LYS CB 1 1 13 6248 1 1 33 LYS CD C -2.167 -3.371 -8.063 1.00 . A A . 33 LYS CD 1 1 13 6249 1 1 33 LYS CE C -1.295 -2.270 -8.675 1.00 . A A . 33 LYS CE 1 1 13 6250 1 1 33 LYS CG C -1.984 -3.398 -6.537 1.00 . A A . 33 LYS CG 1 1 13 6251 1 1 33 LYS H H -5.796 -2.008 -5.272 1.00 . A A . 33 LYS H 1 1 13 6252 1 1 33 LYS HA H -3.023 -2.081 -4.280 1.00 . A A . 33 LYS HA 1 1 13 6253 1 1 33 LYS HB2 H -3.336 -4.304 -5.128 1.00 . A A . 33 LYS HB2 1 1 13 6254 1 1 33 LYS HB3 H -4.115 -3.701 -6.590 1.00 . A A . 33 LYS HB3 1 1 13 6255 1 1 33 LYS HD2 H -1.879 -4.328 -8.476 1.00 . A A . 33 LYS HD2 1 1 13 6256 1 1 33 LYS HD3 H -3.204 -3.178 -8.300 1.00 . A A . 33 LYS HD3 1 1 13 6257 1 1 33 LYS HE2 H -0.432 -2.100 -8.047 1.00 . A A . 33 LYS HE2 1 1 13 6258 1 1 33 LYS HE3 H -0.969 -2.576 -9.660 1.00 . A A . 33 LYS HE3 1 1 13 6259 1 1 33 LYS HG2 H -1.484 -2.494 -6.217 1.00 . A A . 33 LYS HG2 1 1 13 6260 1 1 33 LYS HG3 H -1.384 -4.255 -6.267 1.00 . A A . 33 LYS HG3 1 1 13 6261 1 1 33 LYS HZ1 H -2.373 -0.860 -9.767 1.00 . A A . 33 LYS HZ1 1 1 13 6262 1 1 33 LYS HZ2 H -1.506 -0.191 -8.443 1.00 . A A . 33 LYS HZ2 1 1 13 6263 1 1 33 LYS HZ3 H -2.954 -1.092 -8.178 1.00 . A A . 33 LYS HZ3 1 1 13 6264 1 1 33 LYS N N -5.067 -2.214 -4.652 1.00 . A A . 33 LYS N 1 1 13 6265 1 1 33 LYS NZ N -2.093 -1.017 -8.781 1.00 . A A . 33 LYS NZ 1 1 13 6266 1 1 33 LYS O O -3.799 -1.062 -7.259 1.00 . A A . 33 LYS O 1 1 13 6267 1 1 34 ASP C C -1.086 1.195 -6.832 1.00 . A A . 34 ASP C 1 1 13 6268 1 1 34 ASP CA C -2.543 1.229 -6.355 1.00 . A A . 34 ASP CA 1 1 13 6269 1 1 34 ASP CB C -2.801 2.493 -5.528 1.00 . A A . 34 ASP CB 1 1 13 6270 1 1 34 ASP CG C -4.259 2.548 -5.095 1.00 . A A . 34 ASP CG 1 1 13 6271 1 1 34 ASP H H -2.572 0.033 -4.600 1.00 . A A . 34 ASP H 1 1 13 6272 1 1 34 ASP HA H -3.192 1.241 -7.219 1.00 . A A . 34 ASP HA 1 1 13 6273 1 1 34 ASP HB2 H -2.168 2.480 -4.653 1.00 . A A . 34 ASP HB2 1 1 13 6274 1 1 34 ASP HB3 H -2.572 3.362 -6.124 1.00 . A A . 34 ASP HB3 1 1 13 6275 1 1 34 ASP N N -2.839 0.050 -5.551 1.00 . A A . 34 ASP N 1 1 13 6276 1 1 34 ASP O O -0.861 0.755 -7.951 1.00 . A A . 34 ASP O 1 1 13 6277 1 1 34 ASP OXT O -0.214 1.595 -6.072 1.00 . A A . 34 ASP OXT 1 1 13 6278 1 1 34 ASP OD1 O -5.090 2.913 -5.904 1.00 . A A . 34 ASP OD1 1 1 13 6279 1 1 34 ASP OD2 O -4.526 2.231 -3.946 1.00 . A A . 34 ASP OD2 1 1 14 6280 1 1 1 GLY C C 2.888 12.473 -2.253 1.00 . A A . 1 GLY C 1 1 14 6281 1 1 1 GLY CA C 3.292 13.891 -2.642 1.00 . A A . 1 GLY CA 1 1 14 6282 1 1 1 GLY H1 H 1.880 15.380 -3.033 1.00 . A A . 1 GLY H1 1 1 14 6283 1 1 1 GLY H2 H 2.612 15.506 -1.505 1.00 . A A . 1 GLY H2 1 1 14 6284 1 1 1 GLY H3 H 1.421 14.313 -1.787 1.00 . A A . 1 GLY H3 1 1 14 6285 1 1 1 GLY HA2 H 3.418 13.950 -3.714 1.00 . A A . 1 GLY HA2 1 1 14 6286 1 1 1 GLY HA3 H 4.221 14.142 -2.155 1.00 . A A . 1 GLY HA3 1 1 14 6287 1 1 1 GLY N N 2.225 14.847 -2.211 1.00 . A A . 1 GLY N 1 1 14 6288 1 1 1 GLY O O 3.181 12.019 -1.151 1.00 . A A . 1 GLY O 1 1 14 6289 1 1 2 SER C C 2.868 9.400 -2.925 1.00 . A A . 2 SER C 1 1 14 6290 1 1 2 SER CA C 1.734 10.423 -2.888 1.00 . A A . 2 SER CA 1 1 14 6291 1 1 2 SER CB C 0.668 10.040 -3.905 1.00 . A A . 2 SER CB 1 1 14 6292 1 1 2 SER H H 1.978 12.208 -4.015 1.00 . A A . 2 SER H 1 1 14 6293 1 1 2 SER HA H 1.300 10.403 -1.906 1.00 . A A . 2 SER HA 1 1 14 6294 1 1 2 SER HB2 H 0.041 10.892 -4.116 1.00 . A A . 2 SER HB2 1 1 14 6295 1 1 2 SER HB3 H 1.154 9.717 -4.816 1.00 . A A . 2 SER HB3 1 1 14 6296 1 1 2 SER HG H 0.460 8.264 -3.142 1.00 . A A . 2 SER HG 1 1 14 6297 1 1 2 SER N N 2.199 11.786 -3.157 1.00 . A A . 2 SER N 1 1 14 6298 1 1 2 SER O O 2.623 8.190 -2.978 1.00 . A A . 2 SER O 1 1 14 6299 1 1 2 SER OG O -0.128 8.991 -3.373 1.00 . A A . 2 SER OG 1 1 14 6300 1 1 3 VAL C C 5.043 7.783 -2.029 1.00 . A A . 3 VAL C 1 1 14 6301 1 1 3 VAL CA C 5.282 9.037 -2.869 1.00 . A A . 3 VAL CA 1 1 14 6302 1 1 3 VAL CB C 6.452 9.823 -2.284 1.00 . A A . 3 VAL CB 1 1 14 6303 1 1 3 VAL CG1 C 6.769 11.015 -3.190 1.00 . A A . 3 VAL CG1 1 1 14 6304 1 1 3 VAL CG2 C 6.077 10.336 -0.887 1.00 . A A . 3 VAL CG2 1 1 14 6305 1 1 3 VAL H H 4.205 10.856 -2.810 1.00 . A A . 3 VAL H 1 1 14 6306 1 1 3 VAL HA H 5.519 8.748 -3.881 1.00 . A A . 3 VAL HA 1 1 14 6307 1 1 3 VAL HB H 7.312 9.181 -2.213 1.00 . A A . 3 VAL HB 1 1 14 6308 1 1 3 VAL HG11 H 7.063 10.658 -4.168 1.00 . A A . 3 VAL HG11 1 1 14 6309 1 1 3 VAL HG12 H 7.575 11.590 -2.759 1.00 . A A . 3 VAL HG12 1 1 14 6310 1 1 3 VAL HG13 H 5.892 11.638 -3.285 1.00 . A A . 3 VAL HG13 1 1 14 6311 1 1 3 VAL HG21 H 5.045 10.654 -0.882 1.00 . A A . 3 VAL HG21 1 1 14 6312 1 1 3 VAL HG22 H 6.711 11.172 -0.629 1.00 . A A . 3 VAL HG22 1 1 14 6313 1 1 3 VAL HG23 H 6.213 9.546 -0.164 1.00 . A A . 3 VAL HG23 1 1 14 6314 1 1 3 VAL N N 4.093 9.893 -2.869 1.00 . A A . 3 VAL N 1 1 14 6315 1 1 3 VAL O O 5.433 6.669 -2.402 1.00 . A A . 3 VAL O 1 1 14 6316 1 1 4 GLY C C 3.668 5.636 -0.779 1.00 . A A . 4 GLY C 1 1 14 6317 1 1 4 GLY CA C 4.060 6.879 0.005 1.00 . A A . 4 GLY CA 1 1 14 6318 1 1 4 GLY H H 4.096 8.887 -0.667 1.00 . A A . 4 GLY H 1 1 14 6319 1 1 4 GLY HA2 H 4.922 6.656 0.618 1.00 . A A . 4 GLY HA2 1 1 14 6320 1 1 4 GLY HA3 H 3.237 7.167 0.642 1.00 . A A . 4 GLY HA3 1 1 14 6321 1 1 4 GLY N N 4.380 7.980 -0.896 1.00 . A A . 4 GLY N 1 1 14 6322 1 1 4 GLY O O 3.998 4.526 -0.391 1.00 . A A . 4 GLY O 1 1 14 6323 1 1 5 CYS C C 3.740 3.870 -3.153 1.00 . A A . 5 CYS C 1 1 14 6324 1 1 5 CYS CA C 2.543 4.709 -2.724 1.00 . A A . 5 CYS CA 1 1 14 6325 1 1 5 CYS CB C 1.797 5.218 -3.956 1.00 . A A . 5 CYS CB 1 1 14 6326 1 1 5 CYS H H 2.733 6.744 -2.169 1.00 . A A . 5 CYS H 1 1 14 6327 1 1 5 CYS HA H 1.880 4.088 -2.142 1.00 . A A . 5 CYS HA 1 1 14 6328 1 1 5 CYS HB2 H 2.476 5.778 -4.582 1.00 . A A . 5 CYS HB2 1 1 14 6329 1 1 5 CYS HB3 H 1.411 4.381 -4.507 1.00 . A A . 5 CYS HB3 1 1 14 6330 1 1 5 CYS N N 2.966 5.832 -1.894 1.00 . A A . 5 CYS N 1 1 14 6331 1 1 5 CYS O O 3.594 2.693 -3.467 1.00 . A A . 5 CYS O 1 1 14 6332 1 1 5 CYS SG S 0.432 6.289 -3.433 1.00 . A A . 5 CYS SG 1 1 14 6333 1 1 6 ALA C C 6.684 3.076 -2.250 1.00 . A A . 6 ALA C 1 1 14 6334 1 1 6 ALA CA C 6.134 3.750 -3.499 1.00 . A A . 6 ALA CA 1 1 14 6335 1 1 6 ALA CB C 7.172 4.718 -4.076 1.00 . A A . 6 ALA CB 1 1 14 6336 1 1 6 ALA H H 4.980 5.416 -2.863 1.00 . A A . 6 ALA H 1 1 14 6337 1 1 6 ALA HA H 5.902 2.997 -4.234 1.00 . A A . 6 ALA HA 1 1 14 6338 1 1 6 ALA HB1 H 6.665 5.537 -4.569 1.00 . A A . 6 ALA HB1 1 1 14 6339 1 1 6 ALA HB2 H 7.793 4.197 -4.789 1.00 . A A . 6 ALA HB2 1 1 14 6340 1 1 6 ALA HB3 H 7.787 5.106 -3.279 1.00 . A A . 6 ALA HB3 1 1 14 6341 1 1 6 ALA N N 4.920 4.471 -3.142 1.00 . A A . 6 ALA N 1 1 14 6342 1 1 6 ALA O O 7.007 1.879 -2.241 1.00 . A A . 6 ALA O 1 1 14 6343 1 1 7 GLU C C 6.249 2.304 0.643 1.00 . A A . 7 GLU C 1 1 14 6344 1 1 7 GLU CA C 7.240 3.328 0.089 1.00 . A A . 7 GLU CA 1 1 14 6345 1 1 7 GLU CB C 7.430 4.464 1.098 1.00 . A A . 7 GLU CB 1 1 14 6346 1 1 7 GLU CD C 7.896 6.489 -0.309 1.00 . A A . 7 GLU CD 1 1 14 6347 1 1 7 GLU CG C 8.513 5.426 0.592 1.00 . A A . 7 GLU CG 1 1 14 6348 1 1 7 GLU H H 6.463 4.793 -1.247 1.00 . A A . 7 GLU H 1 1 14 6349 1 1 7 GLU HA H 8.189 2.842 -0.072 1.00 . A A . 7 GLU HA 1 1 14 6350 1 1 7 GLU HB2 H 6.499 5.000 1.218 1.00 . A A . 7 GLU HB2 1 1 14 6351 1 1 7 GLU HB3 H 7.734 4.054 2.050 1.00 . A A . 7 GLU HB3 1 1 14 6352 1 1 7 GLU HG2 H 8.987 5.907 1.435 1.00 . A A . 7 GLU HG2 1 1 14 6353 1 1 7 GLU HG3 H 9.253 4.874 0.034 1.00 . A A . 7 GLU HG3 1 1 14 6354 1 1 7 GLU N N 6.757 3.853 -1.180 1.00 . A A . 7 GLU N 1 1 14 6355 1 1 7 GLU O O 6.643 1.294 1.211 1.00 . A A . 7 GLU O 1 1 14 6356 1 1 7 GLU OE1 O 7.143 7.303 0.198 1.00 . A A . 7 GLU OE1 1 1 14 6357 1 1 7 GLU OE2 O 8.186 6.473 -1.491 1.00 . A A . 7 GLU OE2 1 1 14 6358 1 1 8 CYS C C 4.209 0.229 0.614 1.00 . A A . 8 CYS C 1 1 14 6359 1 1 8 CYS CA C 3.905 1.687 0.952 1.00 . A A . 8 CYS CA 1 1 14 6360 1 1 8 CYS CB C 2.550 2.101 0.378 1.00 . A A . 8 CYS CB 1 1 14 6361 1 1 8 CYS H H 4.712 3.408 0.005 1.00 . A A . 8 CYS H 1 1 14 6362 1 1 8 CYS HA H 3.855 1.784 2.020 1.00 . A A . 8 CYS HA 1 1 14 6363 1 1 8 CYS HB2 H 2.687 2.868 -0.367 1.00 . A A . 8 CYS HB2 1 1 14 6364 1 1 8 CYS HB3 H 2.056 1.257 -0.067 1.00 . A A . 8 CYS HB3 1 1 14 6365 1 1 8 CYS N N 4.960 2.578 0.467 1.00 . A A . 8 CYS N 1 1 14 6366 1 1 8 CYS O O 4.366 -0.596 1.515 1.00 . A A . 8 CYS O 1 1 14 6367 1 1 8 CYS SG S 1.538 2.743 1.727 1.00 . A A . 8 CYS SG 1 1 14 6368 1 1 9 PRO C C 5.969 -1.919 -0.433 1.00 . A A . 9 PRO C 1 1 14 6369 1 1 9 PRO CA C 4.646 -1.497 -1.059 1.00 . A A . 9 PRO CA 1 1 14 6370 1 1 9 PRO CB C 4.728 -1.446 -2.591 1.00 . A A . 9 PRO CB 1 1 14 6371 1 1 9 PRO CD C 4.152 0.781 -1.801 1.00 . A A . 9 PRO CD 1 1 14 6372 1 1 9 PRO CG C 4.772 0.001 -2.960 1.00 . A A . 9 PRO CG 1 1 14 6373 1 1 9 PRO HA H 3.861 -2.170 -0.757 1.00 . A A . 9 PRO HA 1 1 14 6374 1 1 9 PRO HB2 H 5.625 -1.946 -2.933 1.00 . A A . 9 PRO HB2 1 1 14 6375 1 1 9 PRO HB3 H 3.856 -1.908 -3.025 1.00 . A A . 9 PRO HB3 1 1 14 6376 1 1 9 PRO HD2 H 4.678 1.713 -1.648 1.00 . A A . 9 PRO HD2 1 1 14 6377 1 1 9 PRO HD3 H 3.104 0.961 -1.984 1.00 . A A . 9 PRO HD3 1 1 14 6378 1 1 9 PRO HG2 H 5.796 0.311 -3.113 1.00 . A A . 9 PRO HG2 1 1 14 6379 1 1 9 PRO HG3 H 4.198 0.173 -3.857 1.00 . A A . 9 PRO HG3 1 1 14 6380 1 1 9 PRO N N 4.320 -0.108 -0.647 1.00 . A A . 9 PRO N 1 1 14 6381 1 1 9 PRO O O 6.078 -3.000 0.155 1.00 . A A . 9 PRO O 1 1 14 6382 1 1 10 MET C C 8.091 -1.552 1.565 1.00 . A A . 10 MET C 1 1 14 6383 1 1 10 MET CA C 8.259 -1.298 0.070 1.00 . A A . 10 MET CA 1 1 14 6384 1 1 10 MET CB C 9.172 -0.096 -0.159 1.00 . A A . 10 MET CB 1 1 14 6385 1 1 10 MET CE C 11.898 0.068 -3.043 1.00 . A A . 10 MET CE 1 1 14 6386 1 1 10 MET CG C 9.593 -0.050 -1.628 1.00 . A A . 10 MET CG 1 1 14 6387 1 1 10 MET H H 6.803 -0.172 -0.979 1.00 . A A . 10 MET H 1 1 14 6388 1 1 10 MET HA H 8.696 -2.168 -0.392 1.00 . A A . 10 MET HA 1 1 14 6389 1 1 10 MET HB2 H 8.642 0.811 0.095 1.00 . A A . 10 MET HB2 1 1 14 6390 1 1 10 MET HB3 H 10.050 -0.186 0.462 1.00 . A A . 10 MET HB3 1 1 14 6391 1 1 10 MET HE1 H 12.938 -0.209 -3.142 1.00 . A A . 10 MET HE1 1 1 14 6392 1 1 10 MET HE2 H 11.821 1.090 -2.704 1.00 . A A . 10 MET HE2 1 1 14 6393 1 1 10 MET HE3 H 11.409 -0.030 -3.999 1.00 . A A . 10 MET HE3 1 1 14 6394 1 1 10 MET HG2 H 8.806 -0.461 -2.247 1.00 . A A . 10 MET HG2 1 1 14 6395 1 1 10 MET HG3 H 9.777 0.971 -1.917 1.00 . A A . 10 MET HG3 1 1 14 6396 1 1 10 MET N N 6.960 -1.033 -0.526 1.00 . A A . 10 MET N 1 1 14 6397 1 1 10 MET O O 8.735 -2.426 2.141 1.00 . A A . 10 MET O 1 1 14 6398 1 1 10 MET SD S 11.103 -1.022 -1.843 1.00 . A A . 10 MET SD 1 1 14 6399 1 1 11 HIS C C 5.950 -2.067 3.853 1.00 . A A . 11 HIS C 1 1 14 6400 1 1 11 HIS CA C 6.921 -0.912 3.601 1.00 . A A . 11 HIS CA 1 1 14 6401 1 1 11 HIS CB C 6.336 0.394 4.147 1.00 . A A . 11 HIS CB 1 1 14 6402 1 1 11 HIS CD2 C 7.519 1.796 6.026 1.00 . A A . 11 HIS CD2 1 1 14 6403 1 1 11 HIS CE1 C 7.543 0.286 7.580 1.00 . A A . 11 HIS CE1 1 1 14 6404 1 1 11 HIS CG C 6.926 0.676 5.501 1.00 . A A . 11 HIS CG 1 1 14 6405 1 1 11 HIS H H 6.715 -0.100 1.653 1.00 . A A . 11 HIS H 1 1 14 6406 1 1 11 HIS HA H 7.847 -1.120 4.117 1.00 . A A . 11 HIS HA 1 1 14 6407 1 1 11 HIS HB2 H 6.574 1.206 3.476 1.00 . A A . 11 HIS HB2 1 1 14 6408 1 1 11 HIS HB3 H 5.264 0.302 4.236 1.00 . A A . 11 HIS HB3 1 1 14 6409 1 1 11 HIS HD2 H 7.661 2.729 5.499 1.00 . A A . 11 HIS HD2 1 1 14 6410 1 1 11 HIS HE1 H 7.700 -0.221 8.522 1.00 . A A . 11 HIS HE1 1 1 14 6411 1 1 11 HIS HE2 H 8.357 2.167 7.953 1.00 . A A . 11 HIS HE2 1 1 14 6412 1 1 11 HIS N N 7.200 -0.778 2.178 1.00 . A A . 11 HIS N 1 1 14 6413 1 1 11 HIS ND1 N 6.952 -0.275 6.511 1.00 . A A . 11 HIS ND1 1 1 14 6414 1 1 11 HIS NE2 N 7.909 1.548 7.338 1.00 . A A . 11 HIS NE2 1 1 14 6415 1 1 11 HIS O O 5.412 -2.214 4.953 1.00 . A A . 11 HIS O 1 1 14 6416 1 1 12 CYS C C 5.737 -5.287 3.279 1.00 . A A . 12 CYS C 1 1 14 6417 1 1 12 CYS CA C 4.879 -4.067 2.975 1.00 . A A . 12 CYS CA 1 1 14 6418 1 1 12 CYS CB C 4.060 -4.296 1.707 1.00 . A A . 12 CYS CB 1 1 14 6419 1 1 12 CYS H H 6.232 -2.756 1.993 1.00 . A A . 12 CYS H 1 1 14 6420 1 1 12 CYS HA H 4.202 -3.900 3.802 1.00 . A A . 12 CYS HA 1 1 14 6421 1 1 12 CYS HB2 H 4.045 -3.393 1.120 1.00 . A A . 12 CYS HB2 1 1 14 6422 1 1 12 CYS HB3 H 4.500 -5.097 1.133 1.00 . A A . 12 CYS HB3 1 1 14 6423 1 1 12 CYS N N 5.756 -2.907 2.840 1.00 . A A . 12 CYS N 1 1 14 6424 1 1 12 CYS O O 6.866 -5.394 2.802 1.00 . A A . 12 CYS O 1 1 14 6425 1 1 12 CYS SG S 2.363 -4.747 2.167 1.00 . A A . 12 CYS SG 1 1 14 6426 1 1 13 LYS C C 5.644 -8.598 3.728 1.00 . A A . 13 LYS C 1 1 14 6427 1 1 13 LYS CA C 6.003 -7.340 4.528 1.00 . A A . 13 LYS CA 1 1 14 6428 1 1 13 LYS CB C 5.789 -7.580 6.028 1.00 . A A . 13 LYS CB 1 1 14 6429 1 1 13 LYS CD C 5.940 -5.230 6.946 1.00 . A A . 13 LYS CD 1 1 14 6430 1 1 13 LYS CE C 6.971 -4.095 6.879 1.00 . A A . 13 LYS CE 1 1 14 6431 1 1 13 LYS CG C 6.652 -6.593 6.835 1.00 . A A . 13 LYS CG 1 1 14 6432 1 1 13 LYS H H 4.343 -6.016 4.499 1.00 . A A . 13 LYS H 1 1 14 6433 1 1 13 LYS HA H 7.049 -7.128 4.369 1.00 . A A . 13 LYS HA 1 1 14 6434 1 1 13 LYS HB2 H 4.745 -7.433 6.272 1.00 . A A . 13 LYS HB2 1 1 14 6435 1 1 13 LYS HB3 H 6.076 -8.591 6.276 1.00 . A A . 13 LYS HB3 1 1 14 6436 1 1 13 LYS HD2 H 5.237 -5.123 6.134 1.00 . A A . 13 LYS HD2 1 1 14 6437 1 1 13 LYS HD3 H 5.412 -5.178 7.886 1.00 . A A . 13 LYS HD3 1 1 14 6438 1 1 13 LYS HE2 H 7.674 -4.199 7.694 1.00 . A A . 13 LYS HE2 1 1 14 6439 1 1 13 LYS HE3 H 7.502 -4.145 5.938 1.00 . A A . 13 LYS HE3 1 1 14 6440 1 1 13 LYS HG2 H 6.818 -6.992 7.826 1.00 . A A . 13 LYS HG2 1 1 14 6441 1 1 13 LYS HG3 H 7.603 -6.461 6.340 1.00 . A A . 13 LYS HG3 1 1 14 6442 1 1 13 LYS HZ1 H 6.962 -2.028 7.216 1.00 . A A . 13 LYS HZ1 1 1 14 6443 1 1 13 LYS HZ2 H 5.553 -2.822 7.734 1.00 . A A . 13 LYS HZ2 1 1 14 6444 1 1 13 LYS HZ3 H 5.808 -2.544 6.069 1.00 . A A . 13 LYS HZ3 1 1 14 6445 1 1 13 LYS N N 5.230 -6.171 4.119 1.00 . A A . 13 LYS N 1 1 14 6446 1 1 13 LYS NZ N 6.272 -2.776 6.988 1.00 . A A . 13 LYS NZ 1 1 14 6447 1 1 13 LYS O O 4.480 -8.859 3.418 1.00 . A A . 13 LYS O 1 1 14 6448 1 1 14 GLY C C 5.375 -11.459 3.082 1.00 . A A . 14 GLY C 1 1 14 6449 1 1 14 GLY CA C 6.558 -10.606 2.630 1.00 . A A . 14 GLY CA 1 1 14 6450 1 1 14 GLY H H 7.581 -9.080 3.682 1.00 . A A . 14 GLY H 1 1 14 6451 1 1 14 GLY HA2 H 6.430 -10.360 1.587 1.00 . A A . 14 GLY HA2 1 1 14 6452 1 1 14 GLY HA3 H 7.464 -11.184 2.743 1.00 . A A . 14 GLY HA3 1 1 14 6453 1 1 14 GLY N N 6.687 -9.364 3.399 1.00 . A A . 14 GLY N 1 1 14 6454 1 1 14 GLY O O 5.073 -11.538 4.270 1.00 . A A . 14 GLY O 1 1 14 6455 1 1 15 LYS C C 2.255 -12.172 2.288 1.00 . A A . 15 LYS C 1 1 14 6456 1 1 15 LYS CA C 3.561 -12.963 2.325 1.00 . A A . 15 LYS CA 1 1 14 6457 1 1 15 LYS CB C 3.683 -13.728 3.658 1.00 . A A . 15 LYS CB 1 1 14 6458 1 1 15 LYS CD C 2.363 -15.691 2.769 1.00 . A A . 15 LYS CD 1 1 14 6459 1 1 15 LYS CE C 0.891 -15.964 2.445 1.00 . A A . 15 LYS CE 1 1 14 6460 1 1 15 LYS CG C 2.460 -14.634 3.879 1.00 . A A . 15 LYS CG 1 1 14 6461 1 1 15 LYS H H 5.040 -11.965 1.181 1.00 . A A . 15 LYS H 1 1 14 6462 1 1 15 LYS HA H 3.534 -13.684 1.523 1.00 . A A . 15 LYS HA 1 1 14 6463 1 1 15 LYS HB2 H 4.579 -14.332 3.645 1.00 . A A . 15 LYS HB2 1 1 14 6464 1 1 15 LYS HB3 H 3.743 -13.024 4.473 1.00 . A A . 15 LYS HB3 1 1 14 6465 1 1 15 LYS HD2 H 2.867 -15.341 1.883 1.00 . A A . 15 LYS HD2 1 1 14 6466 1 1 15 LYS HD3 H 2.828 -16.607 3.106 1.00 . A A . 15 LYS HD3 1 1 14 6467 1 1 15 LYS HE2 H 0.809 -16.898 1.905 1.00 . A A . 15 LYS HE2 1 1 14 6468 1 1 15 LYS HE3 H 0.327 -16.031 3.364 1.00 . A A . 15 LYS HE3 1 1 14 6469 1 1 15 LYS HG2 H 2.557 -15.131 4.834 1.00 . A A . 15 LYS HG2 1 1 14 6470 1 1 15 LYS HG3 H 1.564 -14.032 3.882 1.00 . A A . 15 LYS HG3 1 1 14 6471 1 1 15 LYS HZ1 H -0.676 -14.782 1.736 1.00 . A A . 15 LYS HZ1 1 1 14 6472 1 1 15 LYS HZ2 H 0.563 -15.037 0.604 1.00 . A A . 15 LYS HZ2 1 1 14 6473 1 1 15 LYS HZ3 H 0.798 -13.938 1.893 1.00 . A A . 15 LYS HZ3 1 1 14 6474 1 1 15 LYS N N 4.722 -12.088 2.099 1.00 . A A . 15 LYS N 1 1 14 6475 1 1 15 LYS NZ N 0.352 -14.851 1.606 1.00 . A A . 15 LYS NZ 1 1 14 6476 1 1 15 LYS O O 1.187 -12.746 2.045 1.00 . A A . 15 LYS O 1 1 14 6477 1 1 16 MET C C 1.448 -8.694 1.766 1.00 . A A . 16 MET C 1 1 14 6478 1 1 16 MET CA C 1.149 -10.014 2.474 1.00 . A A . 16 MET CA 1 1 14 6479 1 1 16 MET CB C 0.662 -9.731 3.902 1.00 . A A . 16 MET CB 1 1 14 6480 1 1 16 MET CE C -0.722 -11.450 7.094 1.00 . A A . 16 MET CE 1 1 14 6481 1 1 16 MET CG C 0.335 -11.049 4.616 1.00 . A A . 16 MET CG 1 1 14 6482 1 1 16 MET H H 3.215 -10.455 2.681 1.00 . A A . 16 MET H 1 1 14 6483 1 1 16 MET HA H 0.368 -10.527 1.936 1.00 . A A . 16 MET HA 1 1 14 6484 1 1 16 MET HB2 H 1.436 -9.210 4.448 1.00 . A A . 16 MET HB2 1 1 14 6485 1 1 16 MET HB3 H -0.225 -9.116 3.863 1.00 . A A . 16 MET HB3 1 1 14 6486 1 1 16 MET HE1 H -0.365 -12.469 7.033 1.00 . A A . 16 MET HE1 1 1 14 6487 1 1 16 MET HE2 H -1.554 -11.396 7.784 1.00 . A A . 16 MET HE2 1 1 14 6488 1 1 16 MET HE3 H 0.073 -10.813 7.444 1.00 . A A . 16 MET HE3 1 1 14 6489 1 1 16 MET HG2 H 0.285 -11.850 3.894 1.00 . A A . 16 MET HG2 1 1 14 6490 1 1 16 MET HG3 H 1.103 -11.265 5.342 1.00 . A A . 16 MET HG3 1 1 14 6491 1 1 16 MET N N 2.339 -10.861 2.506 1.00 . A A . 16 MET N 1 1 14 6492 1 1 16 MET O O 1.997 -7.769 2.364 1.00 . A A . 16 MET O 1 1 14 6493 1 1 16 MET SD S -1.264 -10.899 5.455 1.00 . A A . 16 MET SD 1 1 14 6494 1 1 17 ALA C C -0.002 -6.874 -0.862 1.00 . A A . 17 ALA C 1 1 14 6495 1 1 17 ALA CA C 1.301 -7.387 -0.273 1.00 . A A . 17 ALA CA 1 1 14 6496 1 1 17 ALA CB C 2.313 -7.648 -1.386 1.00 . A A . 17 ALA CB 1 1 14 6497 1 1 17 ALA H H 0.626 -9.366 0.070 1.00 . A A . 17 ALA H 1 1 14 6498 1 1 17 ALA HA H 1.691 -6.631 0.389 1.00 . A A . 17 ALA HA 1 1 14 6499 1 1 17 ALA HB1 H 2.700 -6.706 -1.748 1.00 . A A . 17 ALA HB1 1 1 14 6500 1 1 17 ALA HB2 H 1.830 -8.173 -2.197 1.00 . A A . 17 ALA HB2 1 1 14 6501 1 1 17 ALA HB3 H 3.124 -8.245 -1.001 1.00 . A A . 17 ALA HB3 1 1 14 6502 1 1 17 ALA N N 1.071 -8.606 0.496 1.00 . A A . 17 ALA N 1 1 14 6503 1 1 17 ALA O O -0.753 -7.615 -1.492 1.00 . A A . 17 ALA O 1 1 14 6504 1 1 18 LYS C C -1.386 -3.462 -1.070 1.00 . A A . 18 LYS C 1 1 14 6505 1 1 18 LYS CA C -1.503 -4.989 -1.084 1.00 . A A . 18 LYS CA 1 1 14 6506 1 1 18 LYS CB C -2.638 -5.452 -0.172 1.00 . A A . 18 LYS CB 1 1 14 6507 1 1 18 LYS CD C -1.597 -6.481 1.892 1.00 . A A . 18 LYS CD 1 1 14 6508 1 1 18 LYS CE C -0.656 -6.085 3.033 1.00 . A A . 18 LYS CE 1 1 14 6509 1 1 18 LYS CG C -2.233 -5.217 1.291 1.00 . A A . 18 LYS CG 1 1 14 6510 1 1 18 LYS H H 0.360 -5.074 -0.085 1.00 . A A . 18 LYS H 1 1 14 6511 1 1 18 LYS HA H -1.703 -5.318 -2.088 1.00 . A A . 18 LYS HA 1 1 14 6512 1 1 18 LYS HB2 H -3.535 -4.894 -0.398 1.00 . A A . 18 LYS HB2 1 1 14 6513 1 1 18 LYS HB3 H -2.817 -6.505 -0.329 1.00 . A A . 18 LYS HB3 1 1 14 6514 1 1 18 LYS HD2 H -2.367 -7.130 2.273 1.00 . A A . 18 LYS HD2 1 1 14 6515 1 1 18 LYS HD3 H -1.037 -7.001 1.135 1.00 . A A . 18 LYS HD3 1 1 14 6516 1 1 18 LYS HE2 H -0.114 -6.956 3.372 1.00 . A A . 18 LYS HE2 1 1 14 6517 1 1 18 LYS HE3 H 0.045 -5.342 2.678 1.00 . A A . 18 LYS HE3 1 1 14 6518 1 1 18 LYS HG2 H -1.519 -4.409 1.333 1.00 . A A . 18 LYS HG2 1 1 14 6519 1 1 18 LYS HG3 H -3.104 -4.951 1.861 1.00 . A A . 18 LYS HG3 1 1 14 6520 1 1 18 LYS HZ1 H -0.899 -5.568 5.039 1.00 . A A . 18 LYS HZ1 1 1 14 6521 1 1 18 LYS HZ2 H -2.329 -6.064 4.278 1.00 . A A . 18 LYS HZ2 1 1 14 6522 1 1 18 LYS HZ3 H -1.692 -4.511 3.958 1.00 . A A . 18 LYS HZ3 1 1 14 6523 1 1 18 LYS N N -0.272 -5.603 -0.614 1.00 . A A . 18 LYS N 1 1 14 6524 1 1 18 LYS NZ N -1.454 -5.519 4.162 1.00 . A A . 18 LYS NZ 1 1 14 6525 1 1 18 LYS O O -1.779 -2.810 -0.104 1.00 . A A . 18 LYS O 1 1 14 6526 1 1 19 PRO C C -1.963 -0.651 -2.325 1.00 . A A . 19 PRO C 1 1 14 6527 1 1 19 PRO CA C -0.649 -1.406 -2.197 1.00 . A A . 19 PRO CA 1 1 14 6528 1 1 19 PRO CB C 0.198 -1.226 -3.457 1.00 . A A . 19 PRO CB 1 1 14 6529 1 1 19 PRO CD C -0.362 -3.566 -3.323 1.00 . A A . 19 PRO CD 1 1 14 6530 1 1 19 PRO CG C -0.127 -2.410 -4.296 1.00 . A A . 19 PRO CG 1 1 14 6531 1 1 19 PRO HA H -0.098 -1.048 -1.343 1.00 . A A . 19 PRO HA 1 1 14 6532 1 1 19 PRO HB2 H -0.075 -0.310 -3.968 1.00 . A A . 19 PRO HB2 1 1 14 6533 1 1 19 PRO HB3 H 1.247 -1.222 -3.210 1.00 . A A . 19 PRO HB3 1 1 14 6534 1 1 19 PRO HD2 H -1.115 -4.239 -3.711 1.00 . A A . 19 PRO HD2 1 1 14 6535 1 1 19 PRO HD3 H 0.555 -4.095 -3.119 1.00 . A A . 19 PRO HD3 1 1 14 6536 1 1 19 PRO HG2 H -1.023 -2.216 -4.870 1.00 . A A . 19 PRO HG2 1 1 14 6537 1 1 19 PRO HG3 H 0.692 -2.635 -4.952 1.00 . A A . 19 PRO HG3 1 1 14 6538 1 1 19 PRO N N -0.841 -2.885 -2.109 1.00 . A A . 19 PRO N 1 1 14 6539 1 1 19 PRO O O -2.643 -0.735 -3.348 1.00 . A A . 19 PRO O 1 1 14 6540 1 1 20 THR C C -3.173 2.353 -1.162 1.00 . A A . 20 THR C 1 1 14 6541 1 1 20 THR CA C -3.526 0.879 -1.294 1.00 . A A . 20 THR CA 1 1 14 6542 1 1 20 THR CB C -4.437 0.471 -0.140 1.00 . A A . 20 THR CB 1 1 14 6543 1 1 20 THR CG2 C -5.876 0.316 -0.632 1.00 . A A . 20 THR CG2 1 1 14 6544 1 1 20 THR H H -1.717 0.129 -0.498 1.00 . A A . 20 THR H 1 1 14 6545 1 1 20 THR HA H -4.045 0.722 -2.228 1.00 . A A . 20 THR HA 1 1 14 6546 1 1 20 THR HB H -4.406 1.241 0.601 1.00 . A A . 20 THR HB 1 1 14 6547 1 1 20 THR HG1 H -4.425 -1.481 -0.060 1.00 . A A . 20 THR HG1 1 1 14 6548 1 1 20 THR HG21 H -6.282 -0.618 -0.271 1.00 . A A . 20 THR HG21 1 1 14 6549 1 1 20 THR HG22 H -5.892 0.324 -1.710 1.00 . A A . 20 THR HG22 1 1 14 6550 1 1 20 THR HG23 H -6.474 1.135 -0.259 1.00 . A A . 20 THR HG23 1 1 14 6551 1 1 20 THR N N -2.306 0.093 -1.288 1.00 . A A . 20 THR N 1 1 14 6552 1 1 20 THR O O -2.479 2.759 -0.229 1.00 . A A . 20 THR O 1 1 14 6553 1 1 20 THR OG1 O -3.990 -0.760 0.421 1.00 . A A . 20 THR OG1 1 1 14 6554 1 1 21 CYS C C -4.648 5.372 -2.411 1.00 . A A . 21 CYS C 1 1 14 6555 1 1 21 CYS CA C -3.378 4.580 -2.104 1.00 . A A . 21 CYS CA 1 1 14 6556 1 1 21 CYS CB C -2.274 4.913 -3.119 1.00 . A A . 21 CYS CB 1 1 14 6557 1 1 21 CYS H H -4.195 2.741 -2.814 1.00 . A A . 21 CYS H 1 1 14 6558 1 1 21 CYS HA H -3.032 4.862 -1.123 1.00 . A A . 21 CYS HA 1 1 14 6559 1 1 21 CYS HB2 H -2.177 4.104 -3.826 1.00 . A A . 21 CYS HB2 1 1 14 6560 1 1 21 CYS HB3 H -2.524 5.824 -3.644 1.00 . A A . 21 CYS HB3 1 1 14 6561 1 1 21 CYS N N -3.647 3.141 -2.101 1.00 . A A . 21 CYS N 1 1 14 6562 1 1 21 CYS O O -5.277 5.193 -3.457 1.00 . A A . 21 CYS O 1 1 14 6563 1 1 21 CYS SG S -0.710 5.135 -2.227 1.00 . A A . 21 CYS SG 1 1 14 6564 1 1 22 GLU C C -5.936 8.443 -1.047 1.00 . A A . 22 GLU C 1 1 14 6565 1 1 22 GLU CA C -6.200 7.055 -1.616 1.00 . A A . 22 GLU CA 1 1 14 6566 1 1 22 GLU CB C -7.387 6.401 -0.899 1.00 . A A . 22 GLU CB 1 1 14 6567 1 1 22 GLU CD C -6.550 4.088 -0.355 1.00 . A A . 22 GLU CD 1 1 14 6568 1 1 22 GLU CG C -6.894 5.464 0.216 1.00 . A A . 22 GLU CG 1 1 14 6569 1 1 22 GLU H H -4.497 6.341 -0.677 1.00 . A A . 22 GLU H 1 1 14 6570 1 1 22 GLU HA H -6.438 7.150 -2.667 1.00 . A A . 22 GLU HA 1 1 14 6571 1 1 22 GLU HB2 H -8.017 7.169 -0.470 1.00 . A A . 22 GLU HB2 1 1 14 6572 1 1 22 GLU HB3 H -7.957 5.832 -1.613 1.00 . A A . 22 GLU HB3 1 1 14 6573 1 1 22 GLU HG2 H -6.017 5.889 0.680 1.00 . A A . 22 GLU HG2 1 1 14 6574 1 1 22 GLU HG3 H -7.671 5.355 0.957 1.00 . A A . 22 GLU HG3 1 1 14 6575 1 1 22 GLU N N -5.023 6.241 -1.478 1.00 . A A . 22 GLU N 1 1 14 6576 1 1 22 GLU O O -5.386 8.595 0.046 1.00 . A A . 22 GLU O 1 1 14 6577 1 1 22 GLU OE1 O -7.307 3.588 -1.168 1.00 . A A . 22 GLU OE1 1 1 14 6578 1 1 22 GLU OE2 O -5.527 3.550 0.027 1.00 . A A . 22 GLU OE2 1 1 14 6579 1 1 23 ASN C C -4.782 11.116 -0.826 1.00 . A A . 23 ASN C 1 1 14 6580 1 1 23 ASN CA C -6.158 10.843 -1.441 1.00 . A A . 23 ASN CA 1 1 14 6581 1 1 23 ASN CB C -7.272 11.278 -0.478 1.00 . A A . 23 ASN CB 1 1 14 6582 1 1 23 ASN CG C -7.423 10.285 0.667 1.00 . A A . 23 ASN CG 1 1 14 6583 1 1 23 ASN H H -6.732 9.208 -2.664 1.00 . A A . 23 ASN H 1 1 14 6584 1 1 23 ASN HA H -6.243 11.440 -2.338 1.00 . A A . 23 ASN HA 1 1 14 6585 1 1 23 ASN HB2 H -7.036 12.252 -0.074 1.00 . A A . 23 ASN HB2 1 1 14 6586 1 1 23 ASN HB3 H -8.199 11.335 -1.021 1.00 . A A . 23 ASN HB3 1 1 14 6587 1 1 23 ASN HD21 H -6.190 11.264 1.866 1.00 . A A . 23 ASN HD21 1 1 14 6588 1 1 23 ASN HD22 H -6.863 9.845 2.510 1.00 . A A . 23 ASN HD22 1 1 14 6589 1 1 23 ASN N N -6.325 9.434 -1.815 1.00 . A A . 23 ASN N 1 1 14 6590 1 1 23 ASN ND2 N -6.772 10.481 1.773 1.00 . A A . 23 ASN ND2 1 1 14 6591 1 1 23 ASN O O -4.673 11.713 0.245 1.00 . A A . 23 ASN O 1 1 14 6592 1 1 23 ASN OD1 O -8.160 9.308 0.552 1.00 . A A . 23 ASN OD1 1 1 14 6593 1 1 24 GLU C C -1.999 10.041 0.134 1.00 . A A . 24 GLU C 1 1 14 6594 1 1 24 GLU CA C -2.356 10.872 -1.105 1.00 . A A . 24 GLU CA 1 1 14 6595 1 1 24 GLU CB C -2.075 12.361 -0.842 1.00 . A A . 24 GLU CB 1 1 14 6596 1 1 24 GLU CD C -0.347 13.403 -2.374 1.00 . A A . 24 GLU CD 1 1 14 6597 1 1 24 GLU CG C -1.832 13.087 -2.179 1.00 . A A . 24 GLU CG 1 1 14 6598 1 1 24 GLU H H -3.914 10.219 -2.381 1.00 . A A . 24 GLU H 1 1 14 6599 1 1 24 GLU HA H -1.716 10.553 -1.911 1.00 . A A . 24 GLU HA 1 1 14 6600 1 1 24 GLU HB2 H -2.923 12.806 -0.340 1.00 . A A . 24 GLU HB2 1 1 14 6601 1 1 24 GLU HB3 H -1.200 12.457 -0.217 1.00 . A A . 24 GLU HB3 1 1 14 6602 1 1 24 GLU HG2 H -2.170 12.463 -2.992 1.00 . A A . 24 GLU HG2 1 1 14 6603 1 1 24 GLU HG3 H -2.393 14.011 -2.187 1.00 . A A . 24 GLU HG3 1 1 14 6604 1 1 24 GLU N N -3.743 10.676 -1.533 1.00 . A A . 24 GLU N 1 1 14 6605 1 1 24 GLU O O -0.867 10.100 0.615 1.00 . A A . 24 GLU O 1 1 14 6606 1 1 24 GLU OE1 O 0.318 13.707 -1.397 1.00 . A A . 24 GLU OE1 1 1 14 6607 1 1 24 GLU OE2 O 0.107 13.354 -3.505 1.00 . A A . 24 GLU OE2 1 1 14 6608 1 1 25 VAL C C -2.373 6.979 1.367 1.00 . A A . 25 VAL C 1 1 14 6609 1 1 25 VAL CA C -2.667 8.412 1.808 1.00 . A A . 25 VAL CA 1 1 14 6610 1 1 25 VAL CB C -3.853 8.434 2.782 1.00 . A A . 25 VAL CB 1 1 14 6611 1 1 25 VAL CG1 C -3.619 7.415 3.903 1.00 . A A . 25 VAL CG1 1 1 14 6612 1 1 25 VAL CG2 C -3.983 9.831 3.399 1.00 . A A . 25 VAL CG2 1 1 14 6613 1 1 25 VAL H H -3.836 9.221 0.219 1.00 . A A . 25 VAL H 1 1 14 6614 1 1 25 VAL HA H -1.796 8.802 2.316 1.00 . A A . 25 VAL HA 1 1 14 6615 1 1 25 VAL HB H -4.762 8.185 2.251 1.00 . A A . 25 VAL HB 1 1 14 6616 1 1 25 VAL HG11 H -2.781 7.733 4.507 1.00 . A A . 25 VAL HG11 1 1 14 6617 1 1 25 VAL HG12 H -3.408 6.447 3.477 1.00 . A A . 25 VAL HG12 1 1 14 6618 1 1 25 VAL HG13 H -4.502 7.352 4.521 1.00 . A A . 25 VAL HG13 1 1 14 6619 1 1 25 VAL HG21 H -4.922 10.271 3.100 1.00 . A A . 25 VAL HG21 1 1 14 6620 1 1 25 VAL HG22 H -3.170 10.455 3.057 1.00 . A A . 25 VAL HG22 1 1 14 6621 1 1 25 VAL HG23 H -3.949 9.755 4.476 1.00 . A A . 25 VAL HG23 1 1 14 6622 1 1 25 VAL N N -2.946 9.251 0.640 1.00 . A A . 25 VAL N 1 1 14 6623 1 1 25 VAL O O -3.286 6.210 1.044 1.00 . A A . 25 VAL O 1 1 14 6624 1 1 26 CYS C C -0.760 4.286 2.085 1.00 . A A . 26 CYS C 1 1 14 6625 1 1 26 CYS CA C -0.684 5.283 0.931 1.00 . A A . 26 CYS CA 1 1 14 6626 1 1 26 CYS CB C 0.746 5.304 0.390 1.00 . A A . 26 CYS CB 1 1 14 6627 1 1 26 CYS H H -0.407 7.275 1.605 1.00 . A A . 26 CYS H 1 1 14 6628 1 1 26 CYS HA H -1.342 4.948 0.144 1.00 . A A . 26 CYS HA 1 1 14 6629 1 1 26 CYS HB2 H 0.812 4.654 -0.465 1.00 . A A . 26 CYS HB2 1 1 14 6630 1 1 26 CYS HB3 H 1.011 6.303 0.098 1.00 . A A . 26 CYS HB3 1 1 14 6631 1 1 26 CYS N N -1.091 6.624 1.346 1.00 . A A . 26 CYS N 1 1 14 6632 1 1 26 CYS O O -0.388 4.593 3.219 1.00 . A A . 26 CYS O 1 1 14 6633 1 1 26 CYS SG S 1.883 4.728 1.670 1.00 . A A . 26 CYS SG 1 1 14 6634 1 1 27 LYS C C -1.213 0.661 2.072 1.00 . A A . 27 LYS C 1 1 14 6635 1 1 27 LYS CA C -1.365 2.020 2.757 1.00 . A A . 27 LYS CA 1 1 14 6636 1 1 27 LYS CB C -2.745 2.076 3.429 1.00 . A A . 27 LYS CB 1 1 14 6637 1 1 27 LYS CD C -4.525 3.672 4.169 1.00 . A A . 27 LYS CD 1 1 14 6638 1 1 27 LYS CE C -5.110 4.443 2.975 1.00 . A A . 27 LYS CE 1 1 14 6639 1 1 27 LYS CG C -3.012 3.475 3.995 1.00 . A A . 27 LYS CG 1 1 14 6640 1 1 27 LYS H H -1.517 2.916 0.845 1.00 . A A . 27 LYS H 1 1 14 6641 1 1 27 LYS HA H -0.599 2.131 3.508 1.00 . A A . 27 LYS HA 1 1 14 6642 1 1 27 LYS HB2 H -3.506 1.831 2.701 1.00 . A A . 27 LYS HB2 1 1 14 6643 1 1 27 LYS HB3 H -2.778 1.355 4.232 1.00 . A A . 27 LYS HB3 1 1 14 6644 1 1 27 LYS HD2 H -5.006 2.708 4.241 1.00 . A A . 27 LYS HD2 1 1 14 6645 1 1 27 LYS HD3 H -4.709 4.229 5.076 1.00 . A A . 27 LYS HD3 1 1 14 6646 1 1 27 LYS HE2 H -6.101 4.069 2.760 1.00 . A A . 27 LYS HE2 1 1 14 6647 1 1 27 LYS HE3 H -5.172 5.493 3.221 1.00 . A A . 27 LYS HE3 1 1 14 6648 1 1 27 LYS HG2 H -2.521 3.571 4.952 1.00 . A A . 27 LYS HG2 1 1 14 6649 1 1 27 LYS HG3 H -2.628 4.222 3.322 1.00 . A A . 27 LYS HG3 1 1 14 6650 1 1 27 LYS HZ1 H -3.494 3.576 1.978 1.00 . A A . 27 LYS HZ1 1 1 14 6651 1 1 27 LYS HZ2 H -3.810 5.183 1.499 1.00 . A A . 27 LYS HZ2 1 1 14 6652 1 1 27 LYS HZ3 H -4.833 3.901 0.963 1.00 . A A . 27 LYS HZ3 1 1 14 6653 1 1 27 LYS N N -1.240 3.090 1.773 1.00 . A A . 27 LYS N 1 1 14 6654 1 1 27 LYS NZ N -4.243 4.262 1.773 1.00 . A A . 27 LYS NZ 1 1 14 6655 1 1 27 LYS O O -1.408 0.538 0.862 1.00 . A A . 27 LYS O 1 1 14 6656 1 1 28 CYS C C -1.992 -2.529 2.764 1.00 . A A . 28 CYS C 1 1 14 6657 1 1 28 CYS CA C -0.788 -1.710 2.297 1.00 . A A . 28 CYS CA 1 1 14 6658 1 1 28 CYS CB C 0.527 -2.377 2.734 1.00 . A A . 28 CYS CB 1 1 14 6659 1 1 28 CYS H H -0.786 -0.229 3.813 1.00 . A A . 28 CYS H 1 1 14 6660 1 1 28 CYS HA H -0.801 -1.640 1.225 1.00 . A A . 28 CYS HA 1 1 14 6661 1 1 28 CYS HB2 H 1.236 -1.619 3.033 1.00 . A A . 28 CYS HB2 1 1 14 6662 1 1 28 CYS HB3 H 0.342 -3.045 3.561 1.00 . A A . 28 CYS HB3 1 1 14 6663 1 1 28 CYS N N -0.903 -0.368 2.853 1.00 . A A . 28 CYS N 1 1 14 6664 1 1 28 CYS O O -1.884 -3.332 3.697 1.00 . A A . 28 CYS O 1 1 14 6665 1 1 28 CYS SG S 1.199 -3.318 1.334 1.00 . A A . 28 CYS SG 1 1 14 6666 1 1 29 ASN C C -5.105 -3.613 1.305 1.00 . A A . 29 ASN C 1 1 14 6667 1 1 29 ASN CA C -4.380 -2.996 2.508 1.00 . A A . 29 ASN CA 1 1 14 6668 1 1 29 ASN CB C -5.313 -2.015 3.225 1.00 . A A . 29 ASN CB 1 1 14 6669 1 1 29 ASN CG C -4.938 -1.921 4.703 1.00 . A A . 29 ASN CG 1 1 14 6670 1 1 29 ASN H H -3.175 -1.634 1.394 1.00 . A A . 29 ASN H 1 1 14 6671 1 1 29 ASN HA H -4.129 -3.788 3.197 1.00 . A A . 29 ASN HA 1 1 14 6672 1 1 29 ASN HB2 H -5.223 -1.040 2.770 1.00 . A A . 29 ASN HB2 1 1 14 6673 1 1 29 ASN HB3 H -6.332 -2.360 3.136 1.00 . A A . 29 ASN HB3 1 1 14 6674 1 1 29 ASN HD21 H -6.629 -1.038 5.236 1.00 . A A . 29 ASN HD21 1 1 14 6675 1 1 29 ASN HD22 H -5.527 -1.323 6.494 1.00 . A A . 29 ASN HD22 1 1 14 6676 1 1 29 ASN N N -3.147 -2.302 2.126 1.00 . A A . 29 ASN N 1 1 14 6677 1 1 29 ASN ND2 N -5.768 -1.382 5.546 1.00 . A A . 29 ASN ND2 1 1 14 6678 1 1 29 ASN O O -5.152 -3.035 0.217 1.00 . A A . 29 ASN O 1 1 14 6679 1 1 29 ASN OD1 O -3.859 -2.350 5.101 1.00 . A A . 29 ASN OD1 1 1 14 6680 1 1 30 ILE C C -7.805 -5.023 0.276 1.00 . A A . 30 ILE C 1 1 14 6681 1 1 30 ILE CA C -6.395 -5.565 0.522 1.00 . A A . 30 ILE CA 1 1 14 6682 1 1 30 ILE CB C -6.471 -7.057 0.893 1.00 . A A . 30 ILE CB 1 1 14 6683 1 1 30 ILE CD1 C -4.625 -7.102 2.566 1.00 . A A . 30 ILE CD1 1 1 14 6684 1 1 30 ILE CG1 C -6.135 -7.254 2.376 1.00 . A A . 30 ILE CG1 1 1 14 6685 1 1 30 ILE CG2 C -5.488 -7.859 0.031 1.00 . A A . 30 ILE CG2 1 1 14 6686 1 1 30 ILE H H -5.572 -5.186 2.435 1.00 . A A . 30 ILE H 1 1 14 6687 1 1 30 ILE HA H -5.847 -5.483 -0.405 1.00 . A A . 30 ILE HA 1 1 14 6688 1 1 30 ILE HB H -7.472 -7.418 0.706 1.00 . A A . 30 ILE HB 1 1 14 6689 1 1 30 ILE HD11 H -4.429 -6.516 3.449 1.00 . A A . 30 ILE HD11 1 1 14 6690 1 1 30 ILE HD12 H -4.206 -6.606 1.703 1.00 . A A . 30 ILE HD12 1 1 14 6691 1 1 30 ILE HD13 H -4.177 -8.078 2.670 1.00 . A A . 30 ILE HD13 1 1 14 6692 1 1 30 ILE HG12 H -6.656 -6.516 2.968 1.00 . A A . 30 ILE HG12 1 1 14 6693 1 1 30 ILE HG13 H -6.437 -8.243 2.686 1.00 . A A . 30 ILE HG13 1 1 14 6694 1 1 30 ILE HG21 H -5.873 -7.938 -0.976 1.00 . A A . 30 ILE HG21 1 1 14 6695 1 1 30 ILE HG22 H -5.365 -8.847 0.448 1.00 . A A . 30 ILE HG22 1 1 14 6696 1 1 30 ILE HG23 H -4.533 -7.357 0.012 1.00 . A A . 30 ILE HG23 1 1 14 6697 1 1 30 ILE N N -5.660 -4.802 1.540 1.00 . A A . 30 ILE N 1 1 14 6698 1 1 30 ILE O O -8.469 -4.514 1.177 1.00 . A A . 30 ILE O 1 1 14 6699 1 1 31 GLY C C -9.411 -3.548 -2.428 1.00 . A A . 31 GLY C 1 1 14 6700 1 1 31 GLY CA C -9.550 -4.686 -1.424 1.00 . A A . 31 GLY CA 1 1 14 6701 1 1 31 GLY H H -7.633 -5.565 -1.630 1.00 . A A . 31 GLY H 1 1 14 6702 1 1 31 GLY HA2 H -10.079 -5.507 -1.887 1.00 . A A . 31 GLY HA2 1 1 14 6703 1 1 31 GLY HA3 H -10.110 -4.337 -0.572 1.00 . A A . 31 GLY HA3 1 1 14 6704 1 1 31 GLY N N -8.231 -5.148 -0.977 1.00 . A A . 31 GLY N 1 1 14 6705 1 1 31 GLY O O -10.286 -3.335 -3.266 1.00 . A A . 31 GLY O 1 1 14 6706 1 1 32 LYS C C -6.492 -1.835 -3.644 1.00 . A A . 32 LYS C 1 1 14 6707 1 1 32 LYS CA C -7.979 -1.794 -3.311 1.00 . A A . 32 LYS CA 1 1 14 6708 1 1 32 LYS CB C -8.359 -0.425 -2.738 1.00 . A A . 32 LYS CB 1 1 14 6709 1 1 32 LYS CD C -8.647 1.941 -3.541 1.00 . A A . 32 LYS CD 1 1 14 6710 1 1 32 LYS CE C -7.900 3.119 -4.176 1.00 . A A . 32 LYS CE 1 1 14 6711 1 1 32 LYS CG C -7.791 0.675 -3.647 1.00 . A A . 32 LYS CG 1 1 14 6712 1 1 32 LYS H H -7.607 -3.119 -1.707 1.00 . A A . 32 LYS H 1 1 14 6713 1 1 32 LYS HA H -8.541 -1.962 -4.220 1.00 . A A . 32 LYS HA 1 1 14 6714 1 1 32 LYS HB2 H -9.435 -0.339 -2.693 1.00 . A A . 32 LYS HB2 1 1 14 6715 1 1 32 LYS HB3 H -7.948 -0.319 -1.746 1.00 . A A . 32 LYS HB3 1 1 14 6716 1 1 32 LYS HD2 H -9.583 1.786 -4.058 1.00 . A A . 32 LYS HD2 1 1 14 6717 1 1 32 LYS HD3 H -8.842 2.159 -2.501 1.00 . A A . 32 LYS HD3 1 1 14 6718 1 1 32 LYS HE2 H -7.620 2.866 -5.188 1.00 . A A . 32 LYS HE2 1 1 14 6719 1 1 32 LYS HE3 H -8.540 3.990 -4.186 1.00 . A A . 32 LYS HE3 1 1 14 6720 1 1 32 LYS HG2 H -6.780 0.900 -3.347 1.00 . A A . 32 LYS HG2 1 1 14 6721 1 1 32 LYS HG3 H -7.791 0.331 -4.671 1.00 . A A . 32 LYS HG3 1 1 14 6722 1 1 32 LYS HZ1 H -5.932 2.683 -3.582 1.00 . A A . 32 LYS HZ1 1 1 14 6723 1 1 32 LYS HZ2 H -6.916 3.382 -2.341 1.00 . A A . 32 LYS HZ2 1 1 14 6724 1 1 32 LYS HZ3 H -6.299 4.363 -3.622 1.00 . A A . 32 LYS HZ3 1 1 14 6725 1 1 32 LYS N N -8.279 -2.867 -2.372 1.00 . A A . 32 LYS N 1 1 14 6726 1 1 32 LYS NZ N -6.677 3.408 -3.375 1.00 . A A . 32 LYS NZ 1 1 14 6727 1 1 32 LYS O O -5.654 -1.542 -2.793 1.00 . A A . 32 LYS O 1 1 14 6728 1 1 33 LYS C C -4.352 -1.085 -6.081 1.00 . A A . 33 LYS C 1 1 14 6729 1 1 33 LYS CA C -4.764 -2.304 -5.266 1.00 . A A . 33 LYS CA 1 1 14 6730 1 1 33 LYS CB C -4.528 -3.577 -6.087 1.00 . A A . 33 LYS CB 1 1 14 6731 1 1 33 LYS CD C -3.045 -3.480 -8.124 1.00 . A A . 33 LYS CD 1 1 14 6732 1 1 33 LYS CE C -2.371 -2.163 -8.526 1.00 . A A . 33 LYS CE 1 1 14 6733 1 1 33 LYS CG C -3.075 -3.611 -6.592 1.00 . A A . 33 LYS CG 1 1 14 6734 1 1 33 LYS H H -6.866 -2.456 -5.508 1.00 . A A . 33 LYS H 1 1 14 6735 1 1 33 LYS HA H -4.153 -2.344 -4.373 1.00 . A A . 33 LYS HA 1 1 14 6736 1 1 33 LYS HB2 H -4.713 -4.442 -5.466 1.00 . A A . 33 LYS HB2 1 1 14 6737 1 1 33 LYS HB3 H -5.203 -3.591 -6.930 1.00 . A A . 33 LYS HB3 1 1 14 6738 1 1 33 LYS HD2 H -2.491 -4.307 -8.542 1.00 . A A . 33 LYS HD2 1 1 14 6739 1 1 33 LYS HD3 H -4.054 -3.496 -8.510 1.00 . A A . 33 LYS HD3 1 1 14 6740 1 1 33 LYS HE2 H -2.255 -2.131 -9.601 1.00 . A A . 33 LYS HE2 1 1 14 6741 1 1 33 LYS HE3 H -2.982 -1.330 -8.208 1.00 . A A . 33 LYS HE3 1 1 14 6742 1 1 33 LYS HG2 H -2.523 -2.795 -6.149 1.00 . A A . 33 LYS HG2 1 1 14 6743 1 1 33 LYS HG3 H -2.619 -4.547 -6.305 1.00 . A A . 33 LYS HG3 1 1 14 6744 1 1 33 LYS HZ1 H -1.047 -1.323 -7.123 1.00 . A A . 33 LYS HZ1 1 1 14 6745 1 1 33 LYS HZ2 H -0.318 -1.818 -8.586 1.00 . A A . 33 LYS HZ2 1 1 14 6746 1 1 33 LYS HZ3 H -0.787 -2.990 -7.455 1.00 . A A . 33 LYS HZ3 1 1 14 6747 1 1 33 LYS N N -6.164 -2.218 -4.869 1.00 . A A . 33 LYS N 1 1 14 6748 1 1 33 LYS NZ N -1.031 -2.074 -7.878 1.00 . A A . 33 LYS NZ 1 1 14 6749 1 1 33 LYS O O -4.868 -0.848 -7.176 1.00 . A A . 33 LYS O 1 1 14 6750 1 1 34 ASP C C -1.532 0.601 -6.802 1.00 . A A . 34 ASP C 1 1 14 6751 1 1 34 ASP CA C -2.913 0.864 -6.203 1.00 . A A . 34 ASP CA 1 1 14 6752 1 1 34 ASP CB C -2.831 1.996 -5.188 1.00 . A A . 34 ASP CB 1 1 14 6753 1 1 34 ASP CG C -4.226 2.551 -4.926 1.00 . A A . 34 ASP CG 1 1 14 6754 1 1 34 ASP H H -3.040 -0.579 -4.658 1.00 . A A . 34 ASP H 1 1 14 6755 1 1 34 ASP HA H -3.594 1.148 -6.993 1.00 . A A . 34 ASP HA 1 1 14 6756 1 1 34 ASP HB2 H -2.412 1.614 -4.267 1.00 . A A . 34 ASP HB2 1 1 14 6757 1 1 34 ASP HB3 H -2.196 2.776 -5.576 1.00 . A A . 34 ASP HB3 1 1 14 6758 1 1 34 ASP N N -3.415 -0.327 -5.538 1.00 . A A . 34 ASP N 1 1 14 6759 1 1 34 ASP O O -0.894 -0.350 -6.376 1.00 . A A . 34 ASP O 1 1 14 6760 1 1 34 ASP OXT O -1.138 1.339 -7.686 1.00 . A A . 34 ASP OXT 1 1 14 6761 1 1 34 ASP OD1 O -4.668 3.383 -5.696 1.00 . A A . 34 ASP OD1 1 1 14 6762 1 1 34 ASP OD2 O -4.840 2.136 -3.951 1.00 . A A . 34 ASP OD2 1 1 15 6763 1 1 1 GLY C C 2.450 12.882 -4.895 1.00 . A A . 1 GLY C 1 1 15 6764 1 1 1 GLY CA C 1.571 13.498 -5.979 1.00 . A A . 1 GLY CA 1 1 15 6765 1 1 1 GLY H1 H 1.063 15.502 -5.689 1.00 . A A . 1 GLY H1 1 1 15 6766 1 1 1 GLY H2 H 0.755 14.509 -4.332 1.00 . A A . 1 GLY H2 1 1 15 6767 1 1 1 GLY H3 H -0.265 14.445 -5.696 1.00 . A A . 1 GLY H3 1 1 15 6768 1 1 1 GLY HA2 H 0.940 12.733 -6.409 1.00 . A A . 1 GLY HA2 1 1 15 6769 1 1 1 GLY HA3 H 2.200 13.921 -6.748 1.00 . A A . 1 GLY HA3 1 1 15 6770 1 1 1 GLY N N 0.718 14.570 -5.384 1.00 . A A . 1 GLY N 1 1 15 6771 1 1 1 GLY O O 3.669 13.031 -4.913 1.00 . A A . 1 GLY O 1 1 15 6772 1 1 2 SER C C 3.371 10.387 -3.322 1.00 . A A . 2 SER C 1 1 15 6773 1 1 2 SER CA C 2.534 11.574 -2.841 1.00 . A A . 2 SER CA 1 1 15 6774 1 1 2 SER CB C 1.528 11.101 -1.794 1.00 . A A . 2 SER CB 1 1 15 6775 1 1 2 SER H H 0.828 12.135 -3.983 1.00 . A A . 2 SER H 1 1 15 6776 1 1 2 SER HA H 3.188 12.302 -2.387 1.00 . A A . 2 SER HA 1 1 15 6777 1 1 2 SER HB2 H 0.882 11.920 -1.522 1.00 . A A . 2 SER HB2 1 1 15 6778 1 1 2 SER HB3 H 0.932 10.300 -2.209 1.00 . A A . 2 SER HB3 1 1 15 6779 1 1 2 SER HG H 1.577 10.623 0.090 1.00 . A A . 2 SER HG 1 1 15 6780 1 1 2 SER N N 1.815 12.205 -3.947 1.00 . A A . 2 SER N 1 1 15 6781 1 1 2 SER O O 3.048 9.749 -4.324 1.00 . A A . 2 SER O 1 1 15 6782 1 1 2 SER OG O 2.216 10.647 -0.637 1.00 . A A . 2 SER OG 1 1 15 6783 1 1 3 VAL C C 5.018 7.767 -2.047 1.00 . A A . 3 VAL C 1 1 15 6784 1 1 3 VAL CA C 5.330 8.978 -2.928 1.00 . A A . 3 VAL CA 1 1 15 6785 1 1 3 VAL CB C 6.799 9.387 -2.731 1.00 . A A . 3 VAL CB 1 1 15 6786 1 1 3 VAL CG1 C 7.635 8.883 -3.911 1.00 . A A . 3 VAL CG1 1 1 15 6787 1 1 3 VAL CG2 C 6.913 10.916 -2.650 1.00 . A A . 3 VAL CG2 1 1 15 6788 1 1 3 VAL H H 4.636 10.639 -1.798 1.00 . A A . 3 VAL H 1 1 15 6789 1 1 3 VAL HA H 5.178 8.706 -3.962 1.00 . A A . 3 VAL HA 1 1 15 6790 1 1 3 VAL HB H 7.173 8.949 -1.813 1.00 . A A . 3 VAL HB 1 1 15 6791 1 1 3 VAL HG11 H 8.639 9.279 -3.836 1.00 . A A . 3 VAL HG11 1 1 15 6792 1 1 3 VAL HG12 H 7.189 9.212 -4.837 1.00 . A A . 3 VAL HG12 1 1 15 6793 1 1 3 VAL HG13 H 7.672 7.802 -3.892 1.00 . A A . 3 VAL HG13 1 1 15 6794 1 1 3 VAL HG21 H 6.487 11.263 -1.720 1.00 . A A . 3 VAL HG21 1 1 15 6795 1 1 3 VAL HG22 H 6.382 11.361 -3.479 1.00 . A A . 3 VAL HG22 1 1 15 6796 1 1 3 VAL HG23 H 7.954 11.201 -2.696 1.00 . A A . 3 VAL HG23 1 1 15 6797 1 1 3 VAL N N 4.441 10.096 -2.588 1.00 . A A . 3 VAL N 1 1 15 6798 1 1 3 VAL O O 5.330 6.623 -2.394 1.00 . A A . 3 VAL O 1 1 15 6799 1 1 4 GLY C C 3.575 5.713 -0.683 1.00 . A A . 4 GLY C 1 1 15 6800 1 1 4 GLY CA C 4.035 6.974 0.037 1.00 . A A . 4 GLY CA 1 1 15 6801 1 1 4 GLY H H 4.170 8.962 -0.687 1.00 . A A . 4 GLY H 1 1 15 6802 1 1 4 GLY HA2 H 4.896 6.735 0.645 1.00 . A A . 4 GLY HA2 1 1 15 6803 1 1 4 GLY HA3 H 3.237 7.321 0.676 1.00 . A A . 4 GLY HA3 1 1 15 6804 1 1 4 GLY N N 4.393 8.032 -0.904 1.00 . A A . 4 GLY N 1 1 15 6805 1 1 4 GLY O O 3.990 4.609 -0.336 1.00 . A A . 4 GLY O 1 1 15 6806 1 1 5 CYS C C 3.332 3.920 -3.055 1.00 . A A . 5 CYS C 1 1 15 6807 1 1 5 CYS CA C 2.198 4.725 -2.426 1.00 . A A . 5 CYS CA 1 1 15 6808 1 1 5 CYS CB C 1.168 5.149 -3.482 1.00 . A A . 5 CYS CB 1 1 15 6809 1 1 5 CYS H H 2.405 6.775 -1.915 1.00 . A A . 5 CYS H 1 1 15 6810 1 1 5 CYS HA H 1.702 4.082 -1.721 1.00 . A A . 5 CYS HA 1 1 15 6811 1 1 5 CYS HB2 H 1.080 6.225 -3.497 1.00 . A A . 5 CYS HB2 1 1 15 6812 1 1 5 CYS HB3 H 1.474 4.794 -4.455 1.00 . A A . 5 CYS HB3 1 1 15 6813 1 1 5 CYS N N 2.708 5.877 -1.684 1.00 . A A . 5 CYS N 1 1 15 6814 1 1 5 CYS O O 3.118 2.797 -3.501 1.00 . A A . 5 CYS O 1 1 15 6815 1 1 5 CYS SG S -0.432 4.407 -3.040 1.00 . A A . 5 CYS SG 1 1 15 6816 1 1 6 ALA C C 6.355 3.012 -2.393 1.00 . A A . 6 ALA C 1 1 15 6817 1 1 6 ALA CA C 5.702 3.751 -3.560 1.00 . A A . 6 ALA CA 1 1 15 6818 1 1 6 ALA CB C 6.694 4.730 -4.197 1.00 . A A . 6 ALA CB 1 1 15 6819 1 1 6 ALA H H 4.671 5.363 -2.636 1.00 . A A . 6 ALA H 1 1 15 6820 1 1 6 ALA HA H 5.378 3.034 -4.297 1.00 . A A . 6 ALA HA 1 1 15 6821 1 1 6 ALA HB1 H 6.151 5.495 -4.732 1.00 . A A . 6 ALA HB1 1 1 15 6822 1 1 6 ALA HB2 H 7.335 4.198 -4.885 1.00 . A A . 6 ALA HB2 1 1 15 6823 1 1 6 ALA HB3 H 7.296 5.188 -3.427 1.00 . A A . 6 ALA HB3 1 1 15 6824 1 1 6 ALA N N 4.544 4.470 -3.040 1.00 . A A . 6 ALA N 1 1 15 6825 1 1 6 ALA O O 6.628 1.803 -2.451 1.00 . A A . 6 ALA O 1 1 15 6826 1 1 7 GLU C C 6.137 2.189 0.524 1.00 . A A . 7 GLU C 1 1 15 6827 1 1 7 GLU CA C 7.128 3.169 -0.101 1.00 . A A . 7 GLU CA 1 1 15 6828 1 1 7 GLU CB C 7.470 4.273 0.904 1.00 . A A . 7 GLU CB 1 1 15 6829 1 1 7 GLU CD C 8.029 6.263 -0.519 1.00 . A A . 7 GLU CD 1 1 15 6830 1 1 7 GLU CG C 8.601 5.148 0.349 1.00 . A A . 7 GLU CG 1 1 15 6831 1 1 7 GLU H H 6.283 4.695 -1.317 1.00 . A A . 7 GLU H 1 1 15 6832 1 1 7 GLU HA H 8.030 2.639 -0.360 1.00 . A A . 7 GLU HA 1 1 15 6833 1 1 7 GLU HB2 H 6.595 4.884 1.081 1.00 . A A . 7 GLU HB2 1 1 15 6834 1 1 7 GLU HB3 H 7.789 3.827 1.835 1.00 . A A . 7 GLU HB3 1 1 15 6835 1 1 7 GLU HG2 H 9.152 5.584 1.168 1.00 . A A . 7 GLU HG2 1 1 15 6836 1 1 7 GLU HG3 H 9.267 4.541 -0.247 1.00 . A A . 7 GLU HG3 1 1 15 6837 1 1 7 GLU N N 6.554 3.748 -1.309 1.00 . A A . 7 GLU N 1 1 15 6838 1 1 7 GLU O O 6.514 1.108 0.966 1.00 . A A . 7 GLU O 1 1 15 6839 1 1 7 GLU OE1 O 7.280 7.071 0.005 1.00 . A A . 7 GLU OE1 1 1 15 6840 1 1 7 GLU OE2 O 8.346 6.292 -1.694 1.00 . A A . 7 GLU OE2 1 1 15 6841 1 1 8 CYS C C 3.993 0.278 0.693 1.00 . A A . 8 CYS C 1 1 15 6842 1 1 8 CYS CA C 3.806 1.736 1.107 1.00 . A A . 8 CYS CA 1 1 15 6843 1 1 8 CYS CB C 2.430 2.231 0.650 1.00 . A A . 8 CYS CB 1 1 15 6844 1 1 8 CYS H H 4.629 3.455 0.166 1.00 . A A . 8 CYS H 1 1 15 6845 1 1 8 CYS HA H 3.853 1.796 2.183 1.00 . A A . 8 CYS HA 1 1 15 6846 1 1 8 CYS HB2 H 2.550 2.926 -0.167 1.00 . A A . 8 CYS HB2 1 1 15 6847 1 1 8 CYS HB3 H 1.833 1.394 0.323 1.00 . A A . 8 CYS HB3 1 1 15 6848 1 1 8 CYS N N 4.863 2.579 0.544 1.00 . A A . 8 CYS N 1 1 15 6849 1 1 8 CYS O O 4.164 -0.594 1.545 1.00 . A A . 8 CYS O 1 1 15 6850 1 1 8 CYS SG S 1.602 3.059 2.028 1.00 . A A . 8 CYS SG 1 1 15 6851 1 1 9 PRO C C 5.519 -1.938 -0.610 1.00 . A A . 9 PRO C 1 1 15 6852 1 1 9 PRO CA C 4.179 -1.395 -1.083 1.00 . A A . 9 PRO CA 1 1 15 6853 1 1 9 PRO CB C 4.124 -1.285 -2.614 1.00 . A A . 9 PRO CB 1 1 15 6854 1 1 9 PRO CD C 3.793 0.948 -1.689 1.00 . A A . 9 PRO CD 1 1 15 6855 1 1 9 PRO CG C 4.205 0.171 -2.941 1.00 . A A . 9 PRO CG 1 1 15 6856 1 1 9 PRO HA H 3.379 -2.028 -0.734 1.00 . A A . 9 PRO HA 1 1 15 6857 1 1 9 PRO HB2 H 4.960 -1.813 -3.054 1.00 . A A . 9 PRO HB2 1 1 15 6858 1 1 9 PRO HB3 H 3.194 -1.691 -2.979 1.00 . A A . 9 PRO HB3 1 1 15 6859 1 1 9 PRO HD2 H 4.428 1.811 -1.559 1.00 . A A . 9 PRO HD2 1 1 15 6860 1 1 9 PRO HD3 H 2.759 1.245 -1.750 1.00 . A A . 9 PRO HD3 1 1 15 6861 1 1 9 PRO HG2 H 5.215 0.426 -3.225 1.00 . A A . 9 PRO HG2 1 1 15 6862 1 1 9 PRO HG3 H 3.527 0.404 -3.747 1.00 . A A . 9 PRO HG3 1 1 15 6863 1 1 9 PRO N N 3.984 -0.007 -0.589 1.00 . A A . 9 PRO N 1 1 15 6864 1 1 9 PRO O O 5.612 -3.072 -0.132 1.00 . A A . 9 PRO O 1 1 15 6865 1 1 10 MET C C 7.837 -1.771 1.248 1.00 . A A . 10 MET C 1 1 15 6866 1 1 10 MET CA C 7.878 -1.496 -0.254 1.00 . A A . 10 MET CA 1 1 15 6867 1 1 10 MET CB C 8.872 -0.375 -0.560 1.00 . A A . 10 MET CB 1 1 15 6868 1 1 10 MET CE C 11.692 -0.341 -3.212 1.00 . A A . 10 MET CE 1 1 15 6869 1 1 10 MET CG C 9.233 -0.406 -2.046 1.00 . A A . 10 MET CG 1 1 15 6870 1 1 10 MET H H 6.413 -0.199 -1.078 1.00 . A A . 10 MET H 1 1 15 6871 1 1 10 MET HA H 8.182 -2.395 -0.770 1.00 . A A . 10 MET HA 1 1 15 6872 1 1 10 MET HB2 H 8.424 0.577 -0.315 1.00 . A A . 10 MET HB2 1 1 15 6873 1 1 10 MET HB3 H 9.766 -0.512 0.027 1.00 . A A . 10 MET HB3 1 1 15 6874 1 1 10 MET HE1 H 11.718 -0.623 -4.252 1.00 . A A . 10 MET HE1 1 1 15 6875 1 1 10 MET HE2 H 12.691 -0.360 -2.804 1.00 . A A . 10 MET HE2 1 1 15 6876 1 1 10 MET HE3 H 11.290 0.655 -3.123 1.00 . A A . 10 MET HE3 1 1 15 6877 1 1 10 MET HG2 H 8.388 -0.768 -2.615 1.00 . A A . 10 MET HG2 1 1 15 6878 1 1 10 MET HG3 H 9.484 0.591 -2.374 1.00 . A A . 10 MET HG3 1 1 15 6879 1 1 10 MET N N 6.552 -1.104 -0.711 1.00 . A A . 10 MET N 1 1 15 6880 1 1 10 MET O O 8.498 -2.681 1.748 1.00 . A A . 10 MET O 1 1 15 6881 1 1 10 MET SD S 10.649 -1.507 -2.302 1.00 . A A . 10 MET SD 1 1 15 6882 1 1 11 HIS C C 5.800 -2.163 3.725 1.00 . A A . 11 HIS C 1 1 15 6883 1 1 11 HIS CA C 6.887 -1.130 3.400 1.00 . A A . 11 HIS CA 1 1 15 6884 1 1 11 HIS CB C 6.531 0.224 4.026 1.00 . A A . 11 HIS CB 1 1 15 6885 1 1 11 HIS CD2 C 8.158 1.363 5.746 1.00 . A A . 11 HIS CD2 1 1 15 6886 1 1 11 HIS CE1 C 7.954 -0.061 7.366 1.00 . A A . 11 HIS CE1 1 1 15 6887 1 1 11 HIS CG C 7.282 0.398 5.317 1.00 . A A . 11 HIS CG 1 1 15 6888 1 1 11 HIS H H 6.532 -0.272 1.492 1.00 . A A . 11 HIS H 1 1 15 6889 1 1 11 HIS HA H 7.824 -1.471 3.817 1.00 . A A . 11 HIS HA 1 1 15 6890 1 1 11 HIS HB2 H 6.802 1.017 3.344 1.00 . A A . 11 HIS HB2 1 1 15 6891 1 1 11 HIS HB3 H 5.470 0.265 4.220 1.00 . A A . 11 HIS HB3 1 1 15 6892 1 1 11 HIS HD2 H 8.474 2.218 5.166 1.00 . A A . 11 HIS HD2 1 1 15 6893 1 1 11 HIS HE1 H 8.063 -0.562 8.317 1.00 . A A . 11 HIS HE1 1 1 15 6894 1 1 11 HIS HE2 H 9.202 1.587 7.593 1.00 . A A . 11 HIS HE2 1 1 15 6895 1 1 11 HIS N N 7.038 -0.979 1.957 1.00 . A A . 11 HIS N 1 1 15 6896 1 1 11 HIS ND1 N 7.167 -0.501 6.368 1.00 . A A . 11 HIS ND1 1 1 15 6897 1 1 11 HIS NE2 N 8.580 1.071 7.040 1.00 . A A . 11 HIS NE2 1 1 15 6898 1 1 11 HIS O O 5.217 -2.151 4.814 1.00 . A A . 11 HIS O 1 1 15 6899 1 1 12 CYS C C 5.271 -5.407 3.423 1.00 . A A . 12 CYS C 1 1 15 6900 1 1 12 CYS CA C 4.564 -4.129 2.974 1.00 . A A . 12 CYS CA 1 1 15 6901 1 1 12 CYS CB C 3.774 -4.378 1.688 1.00 . A A . 12 CYS CB 1 1 15 6902 1 1 12 CYS H H 6.070 -3.039 1.949 1.00 . A A . 12 CYS H 1 1 15 6903 1 1 12 CYS HA H 3.874 -3.823 3.748 1.00 . A A . 12 CYS HA 1 1 15 6904 1 1 12 CYS HB2 H 3.846 -3.513 1.048 1.00 . A A . 12 CYS HB2 1 1 15 6905 1 1 12 CYS HB3 H 4.174 -5.242 1.179 1.00 . A A . 12 CYS HB3 1 1 15 6906 1 1 12 CYS N N 5.557 -3.070 2.786 1.00 . A A . 12 CYS N 1 1 15 6907 1 1 12 CYS O O 6.418 -5.651 3.050 1.00 . A A . 12 CYS O 1 1 15 6908 1 1 12 CYS SG S 2.035 -4.673 2.103 1.00 . A A . 12 CYS SG 1 1 15 6909 1 1 13 LYS C C 4.850 -8.656 4.030 1.00 . A A . 13 LYS C 1 1 15 6910 1 1 13 LYS CA C 5.232 -7.395 4.817 1.00 . A A . 13 LYS CA 1 1 15 6911 1 1 13 LYS CB C 4.833 -7.562 6.292 1.00 . A A . 13 LYS CB 1 1 15 6912 1 1 13 LYS CD C 5.928 -5.356 6.859 1.00 . A A . 13 LYS CD 1 1 15 6913 1 1 13 LYS CE C 5.693 -3.956 7.446 1.00 . A A . 13 LYS CE 1 1 15 6914 1 1 13 LYS CG C 4.636 -6.187 6.957 1.00 . A A . 13 LYS CG 1 1 15 6915 1 1 13 LYS H H 3.719 -5.921 4.567 1.00 . A A . 13 LYS H 1 1 15 6916 1 1 13 LYS HA H 6.305 -7.281 4.770 1.00 . A A . 13 LYS HA 1 1 15 6917 1 1 13 LYS HB2 H 3.909 -8.122 6.349 1.00 . A A . 13 LYS HB2 1 1 15 6918 1 1 13 LYS HB3 H 5.609 -8.103 6.814 1.00 . A A . 13 LYS HB3 1 1 15 6919 1 1 13 LYS HD2 H 6.714 -5.849 7.411 1.00 . A A . 13 LYS HD2 1 1 15 6920 1 1 13 LYS HD3 H 6.221 -5.265 5.824 1.00 . A A . 13 LYS HD3 1 1 15 6921 1 1 13 LYS HE2 H 4.633 -3.744 7.458 1.00 . A A . 13 LYS HE2 1 1 15 6922 1 1 13 LYS HE3 H 6.077 -3.922 8.456 1.00 . A A . 13 LYS HE3 1 1 15 6923 1 1 13 LYS HG2 H 3.831 -5.662 6.465 1.00 . A A . 13 LYS HG2 1 1 15 6924 1 1 13 LYS HG3 H 4.383 -6.330 7.998 1.00 . A A . 13 LYS HG3 1 1 15 6925 1 1 13 LYS HZ1 H 7.217 -3.376 6.143 1.00 . A A . 13 LYS HZ1 1 1 15 6926 1 1 13 LYS HZ2 H 6.721 -2.146 7.203 1.00 . A A . 13 LYS HZ2 1 1 15 6927 1 1 13 LYS HZ3 H 5.738 -2.568 5.871 1.00 . A A . 13 LYS HZ3 1 1 15 6928 1 1 13 LYS N N 4.613 -6.184 4.271 1.00 . A A . 13 LYS N 1 1 15 6929 1 1 13 LYS NZ N 6.398 -2.940 6.607 1.00 . A A . 13 LYS NZ 1 1 15 6930 1 1 13 LYS O O 3.714 -8.817 3.579 1.00 . A A . 13 LYS O 1 1 15 6931 1 1 14 GLY C C 4.322 -11.453 3.390 1.00 . A A . 14 GLY C 1 1 15 6932 1 1 14 GLY CA C 5.671 -10.794 3.125 1.00 . A A . 14 GLY CA 1 1 15 6933 1 1 14 GLY H H 6.720 -9.333 4.244 1.00 . A A . 14 GLY H 1 1 15 6934 1 1 14 GLY HA2 H 5.757 -10.589 2.069 1.00 . A A . 14 GLY HA2 1 1 15 6935 1 1 14 GLY HA3 H 6.455 -11.479 3.412 1.00 . A A . 14 GLY HA3 1 1 15 6936 1 1 14 GLY N N 5.840 -9.538 3.865 1.00 . A A . 14 GLY N 1 1 15 6937 1 1 14 GLY O O 3.827 -11.454 4.515 1.00 . A A . 14 GLY O 1 1 15 6938 1 1 15 LYS C C 1.309 -11.715 2.135 1.00 . A A . 15 LYS C 1 1 15 6939 1 1 15 LYS CA C 2.451 -12.696 2.379 1.00 . A A . 15 LYS CA 1 1 15 6940 1 1 15 LYS CB C 2.251 -13.381 3.736 1.00 . A A . 15 LYS CB 1 1 15 6941 1 1 15 LYS CD C 1.755 -15.830 3.521 1.00 . A A . 15 LYS CD 1 1 15 6942 1 1 15 LYS CE C 1.679 -16.529 4.876 1.00 . A A . 15 LYS CE 1 1 15 6943 1 1 15 LYS CG C 1.141 -14.431 3.625 1.00 . A A . 15 LYS CG 1 1 15 6944 1 1 15 LYS H H 4.217 -11.968 1.464 1.00 . A A . 15 LYS H 1 1 15 6945 1 1 15 LYS HA H 2.427 -13.450 1.606 1.00 . A A . 15 LYS HA 1 1 15 6946 1 1 15 LYS HB2 H 3.171 -13.857 4.038 1.00 . A A . 15 LYS HB2 1 1 15 6947 1 1 15 LYS HB3 H 1.969 -12.644 4.473 1.00 . A A . 15 LYS HB3 1 1 15 6948 1 1 15 LYS HD2 H 1.209 -16.406 2.789 1.00 . A A . 15 LYS HD2 1 1 15 6949 1 1 15 LYS HD3 H 2.790 -15.753 3.218 1.00 . A A . 15 LYS HD3 1 1 15 6950 1 1 15 LYS HE2 H 2.382 -16.071 5.561 1.00 . A A . 15 LYS HE2 1 1 15 6951 1 1 15 LYS HE3 H 0.676 -16.438 5.273 1.00 . A A . 15 LYS HE3 1 1 15 6952 1 1 15 LYS HG2 H 0.506 -14.378 4.499 1.00 . A A . 15 LYS HG2 1 1 15 6953 1 1 15 LYS HG3 H 0.552 -14.233 2.744 1.00 . A A . 15 LYS HG3 1 1 15 6954 1 1 15 LYS HZ1 H 1.325 -18.411 4.057 1.00 . A A . 15 LYS HZ1 1 1 15 6955 1 1 15 LYS HZ2 H 1.988 -18.450 5.617 1.00 . A A . 15 LYS HZ2 1 1 15 6956 1 1 15 LYS HZ3 H 2.971 -18.054 4.289 1.00 . A A . 15 LYS HZ3 1 1 15 6957 1 1 15 LYS N N 3.749 -12.014 2.323 1.00 . A A . 15 LYS N 1 1 15 6958 1 1 15 LYS NZ N 2.016 -17.969 4.697 1.00 . A A . 15 LYS NZ 1 1 15 6959 1 1 15 LYS O O 0.217 -12.115 1.732 1.00 . A A . 15 LYS O 1 1 15 6960 1 1 16 MET C C 1.156 -8.177 1.504 1.00 . A A . 16 MET C 1 1 15 6961 1 1 16 MET CA C 0.544 -9.409 2.160 1.00 . A A . 16 MET CA 1 1 15 6962 1 1 16 MET CB C -0.077 -9.005 3.501 1.00 . A A . 16 MET CB 1 1 15 6963 1 1 16 MET CE C -0.929 -10.178 6.972 1.00 . A A . 16 MET CE 1 1 15 6964 1 1 16 MET CG C -0.505 -10.250 4.287 1.00 . A A . 16 MET CG 1 1 15 6965 1 1 16 MET H H 2.453 -10.163 2.686 1.00 . A A . 16 MET H 1 1 15 6966 1 1 16 MET HA H -0.228 -9.805 1.519 1.00 . A A . 16 MET HA 1 1 15 6967 1 1 16 MET HB2 H 0.652 -8.449 4.076 1.00 . A A . 16 MET HB2 1 1 15 6968 1 1 16 MET HB3 H -0.940 -8.380 3.322 1.00 . A A . 16 MET HB3 1 1 15 6969 1 1 16 MET HE1 H -1.132 -9.127 7.125 1.00 . A A . 16 MET HE1 1 1 15 6970 1 1 16 MET HE2 H -0.676 -10.642 7.914 1.00 . A A . 16 MET HE2 1 1 15 6971 1 1 16 MET HE3 H -1.806 -10.655 6.562 1.00 . A A . 16 MET HE3 1 1 15 6972 1 1 16 MET HG2 H -1.554 -10.180 4.525 1.00 . A A . 16 MET HG2 1 1 15 6973 1 1 16 MET HG3 H -0.333 -11.132 3.692 1.00 . A A . 16 MET HG3 1 1 15 6974 1 1 16 MET N N 1.565 -10.430 2.367 1.00 . A A . 16 MET N 1 1 15 6975 1 1 16 MET O O 1.756 -7.344 2.182 1.00 . A A . 16 MET O 1 1 15 6976 1 1 16 MET SD S 0.455 -10.361 5.819 1.00 . A A . 16 MET SD 1 1 15 6977 1 1 17 ALA C C 0.646 -6.367 -1.600 1.00 . A A . 17 ALA C 1 1 15 6978 1 1 17 ALA CA C 1.564 -6.891 -0.503 1.00 . A A . 17 ALA CA 1 1 15 6979 1 1 17 ALA CB C 2.923 -7.218 -1.098 1.00 . A A . 17 ALA CB 1 1 15 6980 1 1 17 ALA H H 0.523 -8.737 -0.317 1.00 . A A . 17 ALA H 1 1 15 6981 1 1 17 ALA HA H 1.695 -6.103 0.225 1.00 . A A . 17 ALA HA 1 1 15 6982 1 1 17 ALA HB1 H 3.477 -6.300 -1.239 1.00 . A A . 17 ALA HB1 1 1 15 6983 1 1 17 ALA HB2 H 2.788 -7.707 -2.050 1.00 . A A . 17 ALA HB2 1 1 15 6984 1 1 17 ALA HB3 H 3.462 -7.867 -0.427 1.00 . A A . 17 ALA HB3 1 1 15 6985 1 1 17 ALA N N 1.007 -8.051 0.187 1.00 . A A . 17 ALA N 1 1 15 6986 1 1 17 ALA O O 0.487 -6.976 -2.664 1.00 . A A . 17 ALA O 1 1 15 6987 1 1 18 LYS C C -0.972 -3.080 -1.832 1.00 . A A . 18 LYS C 1 1 15 6988 1 1 18 LYS CA C -0.817 -4.542 -2.260 1.00 . A A . 18 LYS CA 1 1 15 6989 1 1 18 LYS CB C -2.183 -5.236 -2.365 1.00 . A A . 18 LYS CB 1 1 15 6990 1 1 18 LYS CD C -2.127 -7.551 -1.286 1.00 . A A . 18 LYS CD 1 1 15 6991 1 1 18 LYS CE C -2.514 -8.060 -2.681 1.00 . A A . 18 LYS CE 1 1 15 6992 1 1 18 LYS CG C -2.492 -6.061 -1.105 1.00 . A A . 18 LYS CG 1 1 15 6993 1 1 18 LYS H H 0.268 -4.801 -0.464 1.00 . A A . 18 LYS H 1 1 15 6994 1 1 18 LYS HA H -0.353 -4.561 -3.231 1.00 . A A . 18 LYS HA 1 1 15 6995 1 1 18 LYS HB2 H -2.951 -4.483 -2.488 1.00 . A A . 18 LYS HB2 1 1 15 6996 1 1 18 LYS HB3 H -2.180 -5.877 -3.226 1.00 . A A . 18 LYS HB3 1 1 15 6997 1 1 18 LYS HD2 H -1.069 -7.681 -1.142 1.00 . A A . 18 LYS HD2 1 1 15 6998 1 1 18 LYS HD3 H -2.652 -8.132 -0.542 1.00 . A A . 18 LYS HD3 1 1 15 6999 1 1 18 LYS HE2 H -2.979 -9.033 -2.589 1.00 . A A . 18 LYS HE2 1 1 15 7000 1 1 18 LYS HE3 H -3.212 -7.376 -3.141 1.00 . A A . 18 LYS HE3 1 1 15 7001 1 1 18 LYS HG2 H -1.936 -5.656 -0.271 1.00 . A A . 18 LYS HG2 1 1 15 7002 1 1 18 LYS HG3 H -3.544 -5.982 -0.895 1.00 . A A . 18 LYS HG3 1 1 15 7003 1 1 18 LYS HZ1 H -0.956 -9.160 -3.532 1.00 . A A . 18 LYS HZ1 1 1 15 7004 1 1 18 LYS HZ2 H -0.519 -7.563 -3.126 1.00 . A A . 18 LYS HZ2 1 1 15 7005 1 1 18 LYS HZ3 H -1.495 -7.871 -4.496 1.00 . A A . 18 LYS HZ3 1 1 15 7006 1 1 18 LYS N N 0.069 -5.221 -1.323 1.00 . A A . 18 LYS N 1 1 15 7007 1 1 18 LYS NZ N -1.283 -8.174 -3.524 1.00 . A A . 18 LYS NZ 1 1 15 7008 1 1 18 LYS O O -1.551 -2.787 -0.780 1.00 . A A . 18 LYS O 1 1 15 7009 1 1 19 PRO C C -1.805 -0.037 -2.575 1.00 . A A . 19 PRO C 1 1 15 7010 1 1 19 PRO CA C -0.466 -0.708 -2.270 1.00 . A A . 19 PRO CA 1 1 15 7011 1 1 19 PRO CB C 0.639 -0.133 -3.152 1.00 . A A . 19 PRO CB 1 1 15 7012 1 1 19 PRO CD C 0.286 -2.414 -3.868 1.00 . A A . 19 PRO CD 1 1 15 7013 1 1 19 PRO CG C 0.663 -1.014 -4.356 1.00 . A A . 19 PRO CG 1 1 15 7014 1 1 19 PRO HA H -0.206 -0.557 -1.236 1.00 . A A . 19 PRO HA 1 1 15 7015 1 1 19 PRO HB2 H 0.408 0.886 -3.431 1.00 . A A . 19 PRO HB2 1 1 15 7016 1 1 19 PRO HB3 H 1.589 -0.179 -2.643 1.00 . A A . 19 PRO HB3 1 1 15 7017 1 1 19 PRO HD2 H -0.360 -2.902 -4.586 1.00 . A A . 19 PRO HD2 1 1 15 7018 1 1 19 PRO HD3 H 1.172 -3.006 -3.689 1.00 . A A . 19 PRO HD3 1 1 15 7019 1 1 19 PRO HG2 H -0.056 -0.663 -5.085 1.00 . A A . 19 PRO HG2 1 1 15 7020 1 1 19 PRO HG3 H 1.651 -1.032 -4.787 1.00 . A A . 19 PRO HG3 1 1 15 7021 1 1 19 PRO N N -0.428 -2.166 -2.599 1.00 . A A . 19 PRO N 1 1 15 7022 1 1 19 PRO O O -2.491 -0.395 -3.536 1.00 . A A . 19 PRO O 1 1 15 7023 1 1 20 THR C C -3.140 3.191 -1.607 1.00 . A A . 20 THR C 1 1 15 7024 1 1 20 THR CA C -3.385 1.712 -1.920 1.00 . A A . 20 THR CA 1 1 15 7025 1 1 20 THR CB C -4.489 1.168 -0.997 1.00 . A A . 20 THR CB 1 1 15 7026 1 1 20 THR CG2 C -5.590 0.524 -1.840 1.00 . A A . 20 THR CG2 1 1 15 7027 1 1 20 THR H H -1.542 1.188 -1.014 1.00 . A A . 20 THR H 1 1 15 7028 1 1 20 THR HA H -3.709 1.623 -2.943 1.00 . A A . 20 THR HA 1 1 15 7029 1 1 20 THR HB H -4.912 1.980 -0.426 1.00 . A A . 20 THR HB 1 1 15 7030 1 1 20 THR HG1 H -3.045 0.475 0.130 1.00 . A A . 20 THR HG1 1 1 15 7031 1 1 20 THR HG21 H -6.446 0.317 -1.215 1.00 . A A . 20 THR HG21 1 1 15 7032 1 1 20 THR HG22 H -5.224 -0.399 -2.266 1.00 . A A . 20 THR HG22 1 1 15 7033 1 1 20 THR HG23 H -5.878 1.197 -2.633 1.00 . A A . 20 THR HG23 1 1 15 7034 1 1 20 THR N N -2.146 0.954 -1.751 1.00 . A A . 20 THR N 1 1 15 7035 1 1 20 THR O O -2.569 3.526 -0.561 1.00 . A A . 20 THR O 1 1 15 7036 1 1 20 THR OG1 O -3.950 0.195 -0.110 1.00 . A A . 20 THR OG1 1 1 15 7037 1 1 21 CYS C C -4.720 6.174 -1.946 1.00 . A A . 21 CYS C 1 1 15 7038 1 1 21 CYS CA C -3.393 5.513 -2.332 1.00 . A A . 21 CYS CA 1 1 15 7039 1 1 21 CYS CB C -2.860 6.153 -3.619 1.00 . A A . 21 CYS CB 1 1 15 7040 1 1 21 CYS H H -4.019 3.733 -3.336 1.00 . A A . 21 CYS H 1 1 15 7041 1 1 21 CYS HA H -2.680 5.682 -1.544 1.00 . A A . 21 CYS HA 1 1 15 7042 1 1 21 CYS HB2 H -3.687 6.383 -4.268 1.00 . A A . 21 CYS HB2 1 1 15 7043 1 1 21 CYS HB3 H -2.335 7.063 -3.374 1.00 . A A . 21 CYS HB3 1 1 15 7044 1 1 21 CYS N N -3.569 4.068 -2.516 1.00 . A A . 21 CYS N 1 1 15 7045 1 1 21 CYS O O -5.766 5.870 -2.520 1.00 . A A . 21 CYS O 1 1 15 7046 1 1 21 CYS SG S -1.727 5.014 -4.468 1.00 . A A . 21 CYS SG 1 1 15 7047 1 1 22 GLU C C -5.562 9.227 -0.187 1.00 . A A . 22 GLU C 1 1 15 7048 1 1 22 GLU CA C -5.864 7.760 -0.498 1.00 . A A . 22 GLU CA 1 1 15 7049 1 1 22 GLU CB C -6.407 7.060 0.757 1.00 . A A . 22 GLU CB 1 1 15 7050 1 1 22 GLU CD C -5.761 5.787 2.824 1.00 . A A . 22 GLU CD 1 1 15 7051 1 1 22 GLU CG C -5.241 6.520 1.597 1.00 . A A . 22 GLU CG 1 1 15 7052 1 1 22 GLU H H -3.812 7.272 -0.536 1.00 . A A . 22 GLU H 1 1 15 7053 1 1 22 GLU HA H -6.619 7.716 -1.269 1.00 . A A . 22 GLU HA 1 1 15 7054 1 1 22 GLU HB2 H -6.979 7.765 1.344 1.00 . A A . 22 GLU HB2 1 1 15 7055 1 1 22 GLU HB3 H -7.042 6.240 0.462 1.00 . A A . 22 GLU HB3 1 1 15 7056 1 1 22 GLU HG2 H -4.656 5.837 1.002 1.00 . A A . 22 GLU HG2 1 1 15 7057 1 1 22 GLU HG3 H -4.620 7.341 1.914 1.00 . A A . 22 GLU HG3 1 1 15 7058 1 1 22 GLU N N -4.671 7.072 -0.965 1.00 . A A . 22 GLU N 1 1 15 7059 1 1 22 GLU O O -4.921 9.547 0.810 1.00 . A A . 22 GLU O 1 1 15 7060 1 1 22 GLU OE1 O -6.567 4.877 2.661 1.00 . A A . 22 GLU OE1 1 1 15 7061 1 1 22 GLU OE2 O -5.336 6.128 3.919 1.00 . A A . 22 GLU OE2 1 1 15 7062 1 1 23 ASN C C -4.385 11.898 -0.531 1.00 . A A . 23 ASN C 1 1 15 7063 1 1 23 ASN CA C -5.843 11.554 -0.890 1.00 . A A . 23 ASN CA 1 1 15 7064 1 1 23 ASN CB C -6.853 12.085 0.155 1.00 . A A . 23 ASN CB 1 1 15 7065 1 1 23 ASN CG C -6.235 12.295 1.540 1.00 . A A . 23 ASN CG 1 1 15 7066 1 1 23 ASN H H -6.533 9.774 -1.825 1.00 . A A . 23 ASN H 1 1 15 7067 1 1 23 ASN HA H -6.065 12.027 -1.837 1.00 . A A . 23 ASN HA 1 1 15 7068 1 1 23 ASN HB2 H -7.251 13.028 -0.191 1.00 . A A . 23 ASN HB2 1 1 15 7069 1 1 23 ASN HB3 H -7.663 11.378 0.239 1.00 . A A . 23 ASN HB3 1 1 15 7070 1 1 23 ASN HD21 H -5.443 10.479 1.654 1.00 . A A . 23 ASN HD21 1 1 15 7071 1 1 23 ASN HD22 H -5.173 11.488 2.996 1.00 . A A . 23 ASN HD22 1 1 15 7072 1 1 23 ASN N N -6.035 10.106 -1.054 1.00 . A A . 23 ASN N 1 1 15 7073 1 1 23 ASN ND2 N -5.563 11.343 2.111 1.00 . A A . 23 ASN ND2 1 1 15 7074 1 1 23 ASN O O -4.112 12.629 0.416 1.00 . A A . 23 ASN O 1 1 15 7075 1 1 23 ASN OD1 O -6.382 13.366 2.122 1.00 . A A . 23 ASN OD1 1 1 15 7076 1 1 24 GLU C C -1.467 10.696 -0.007 1.00 . A A . 24 GLU C 1 1 15 7077 1 1 24 GLU CA C -2.020 11.568 -1.134 1.00 . A A . 24 GLU CA 1 1 15 7078 1 1 24 GLU CB C -1.691 13.050 -0.885 1.00 . A A . 24 GLU CB 1 1 15 7079 1 1 24 GLU CD C -0.607 13.548 -3.098 1.00 . A A . 24 GLU CD 1 1 15 7080 1 1 24 GLU CG C -1.812 13.825 -2.204 1.00 . A A . 24 GLU CG 1 1 15 7081 1 1 24 GLU H H -3.759 10.782 -2.059 1.00 . A A . 24 GLU H 1 1 15 7082 1 1 24 GLU HA H -1.527 11.269 -2.046 1.00 . A A . 24 GLU HA 1 1 15 7083 1 1 24 GLU HB2 H -2.371 13.463 -0.159 1.00 . A A . 24 GLU HB2 1 1 15 7084 1 1 24 GLU HB3 H -0.680 13.136 -0.514 1.00 . A A . 24 GLU HB3 1 1 15 7085 1 1 24 GLU HG2 H -2.712 13.522 -2.716 1.00 . A A . 24 GLU HG2 1 1 15 7086 1 1 24 GLU HG3 H -1.861 14.883 -1.993 1.00 . A A . 24 GLU HG3 1 1 15 7087 1 1 24 GLU N N -3.462 11.352 -1.322 1.00 . A A . 24 GLU N 1 1 15 7088 1 1 24 GLU O O -0.252 10.628 0.199 1.00 . A A . 24 GLU O 1 1 15 7089 1 1 24 GLU OE1 O -0.638 12.572 -3.828 1.00 . A A . 24 GLU OE1 1 1 15 7090 1 1 24 GLU OE2 O 0.334 14.322 -3.054 1.00 . A A . 24 GLU OE2 1 1 15 7091 1 1 25 VAL C C -1.917 7.667 1.189 1.00 . A A . 25 VAL C 1 1 15 7092 1 1 25 VAL CA C -1.931 9.085 1.755 1.00 . A A . 25 VAL CA 1 1 15 7093 1 1 25 VAL CB C -2.877 9.180 2.962 1.00 . A A . 25 VAL CB 1 1 15 7094 1 1 25 VAL CG1 C -2.534 8.092 3.984 1.00 . A A . 25 VAL CG1 1 1 15 7095 1 1 25 VAL CG2 C -2.717 10.553 3.622 1.00 . A A . 25 VAL CG2 1 1 15 7096 1 1 25 VAL H H -3.311 10.055 0.467 1.00 . A A . 25 VAL H 1 1 15 7097 1 1 25 VAL HA H -0.930 9.348 2.065 1.00 . A A . 25 VAL HA 1 1 15 7098 1 1 25 VAL HB H -3.897 9.056 2.634 1.00 . A A . 25 VAL HB 1 1 15 7099 1 1 25 VAL HG11 H -1.465 8.047 4.118 1.00 . A A . 25 VAL HG11 1 1 15 7100 1 1 25 VAL HG12 H -2.895 7.137 3.629 1.00 . A A . 25 VAL HG12 1 1 15 7101 1 1 25 VAL HG13 H -3.005 8.325 4.928 1.00 . A A . 25 VAL HG13 1 1 15 7102 1 1 25 VAL HG21 H -3.529 10.716 4.315 1.00 . A A . 25 VAL HG21 1 1 15 7103 1 1 25 VAL HG22 H -2.731 11.322 2.864 1.00 . A A . 25 VAL HG22 1 1 15 7104 1 1 25 VAL HG23 H -1.779 10.591 4.154 1.00 . A A . 25 VAL HG23 1 1 15 7105 1 1 25 VAL N N -2.356 9.992 0.691 1.00 . A A . 25 VAL N 1 1 15 7106 1 1 25 VAL O O -2.776 7.309 0.383 1.00 . A A . 25 VAL O 1 1 15 7107 1 1 26 CYS C C -0.959 4.462 2.106 1.00 . A A . 26 CYS C 1 1 15 7108 1 1 26 CYS CA C -0.801 5.526 1.028 1.00 . A A . 26 CYS CA 1 1 15 7109 1 1 26 CYS CB C 0.561 5.370 0.370 1.00 . A A . 26 CYS CB 1 1 15 7110 1 1 26 CYS H H -0.230 7.209 2.164 1.00 . A A . 26 CYS H 1 1 15 7111 1 1 26 CYS HA H -1.561 5.377 0.279 1.00 . A A . 26 CYS HA 1 1 15 7112 1 1 26 CYS HB2 H 0.520 4.558 -0.323 1.00 . A A . 26 CYS HB2 1 1 15 7113 1 1 26 CYS HB3 H 0.815 6.279 -0.155 1.00 . A A . 26 CYS HB3 1 1 15 7114 1 1 26 CYS N N -0.917 6.877 1.560 1.00 . A A . 26 CYS N 1 1 15 7115 1 1 26 CYS O O -0.597 4.671 3.262 1.00 . A A . 26 CYS O 1 1 15 7116 1 1 26 CYS SG S 1.817 5.027 1.628 1.00 . A A . 26 CYS SG 1 1 15 7117 1 1 27 LYS C C -1.551 0.859 1.890 1.00 . A A . 27 LYS C 1 1 15 7118 1 1 27 LYS CA C -1.705 2.198 2.619 1.00 . A A . 27 LYS CA 1 1 15 7119 1 1 27 LYS CB C -3.115 2.276 3.218 1.00 . A A . 27 LYS CB 1 1 15 7120 1 1 27 LYS CD C -4.092 3.180 5.352 1.00 . A A . 27 LYS CD 1 1 15 7121 1 1 27 LYS CE C -5.536 2.890 4.931 1.00 . A A . 27 LYS CE 1 1 15 7122 1 1 27 LYS CG C -3.235 3.510 4.121 1.00 . A A . 27 LYS CG 1 1 15 7123 1 1 27 LYS H H -1.766 3.219 0.760 1.00 . A A . 27 LYS H 1 1 15 7124 1 1 27 LYS HA H -0.981 2.255 3.418 1.00 . A A . 27 LYS HA 1 1 15 7125 1 1 27 LYS HB2 H -3.837 2.348 2.415 1.00 . A A . 27 LYS HB2 1 1 15 7126 1 1 27 LYS HB3 H -3.312 1.383 3.797 1.00 . A A . 27 LYS HB3 1 1 15 7127 1 1 27 LYS HD2 H -3.683 2.313 5.849 1.00 . A A . 27 LYS HD2 1 1 15 7128 1 1 27 LYS HD3 H -4.080 4.020 6.032 1.00 . A A . 27 LYS HD3 1 1 15 7129 1 1 27 LYS HE2 H -5.540 2.401 3.967 1.00 . A A . 27 LYS HE2 1 1 15 7130 1 1 27 LYS HE3 H -6.001 2.242 5.662 1.00 . A A . 27 LYS HE3 1 1 15 7131 1 1 27 LYS HG2 H -2.249 3.814 4.442 1.00 . A A . 27 LYS HG2 1 1 15 7132 1 1 27 LYS HG3 H -3.695 4.316 3.567 1.00 . A A . 27 LYS HG3 1 1 15 7133 1 1 27 LYS HZ1 H -5.655 4.981 5.018 1.00 . A A . 27 LYS HZ1 1 1 15 7134 1 1 27 LYS HZ2 H -7.069 4.180 5.537 1.00 . A A . 27 LYS HZ2 1 1 15 7135 1 1 27 LYS HZ3 H -6.694 4.277 3.862 1.00 . A A . 27 LYS HZ3 1 1 15 7136 1 1 27 LYS N N -1.499 3.316 1.703 1.00 . A A . 27 LYS N 1 1 15 7137 1 1 27 LYS NZ N -6.297 4.170 4.843 1.00 . A A . 27 LYS NZ 1 1 15 7138 1 1 27 LYS O O -1.899 0.741 0.714 1.00 . A A . 27 LYS O 1 1 15 7139 1 1 28 CYS C C -2.120 -2.326 2.492 1.00 . A A . 28 CYS C 1 1 15 7140 1 1 28 CYS CA C -0.928 -1.495 2.026 1.00 . A A . 28 CYS CA 1 1 15 7141 1 1 28 CYS CB C 0.386 -2.148 2.477 1.00 . A A . 28 CYS CB 1 1 15 7142 1 1 28 CYS H H -0.839 -0.013 3.543 1.00 . A A . 28 CYS H 1 1 15 7143 1 1 28 CYS HA H -0.940 -1.424 0.952 1.00 . A A . 28 CYS HA 1 1 15 7144 1 1 28 CYS HB2 H 1.113 -1.379 2.696 1.00 . A A . 28 CYS HB2 1 1 15 7145 1 1 28 CYS HB3 H 0.213 -2.742 3.361 1.00 . A A . 28 CYS HB3 1 1 15 7146 1 1 28 CYS N N -1.070 -0.156 2.604 1.00 . A A . 28 CYS N 1 1 15 7147 1 1 28 CYS O O -2.114 -2.855 3.603 1.00 . A A . 28 CYS O 1 1 15 7148 1 1 28 CYS SG S 1.015 -3.210 1.148 1.00 . A A . 28 CYS SG 1 1 15 7149 1 1 29 ASN C C -4.608 -4.372 1.249 1.00 . A A . 29 ASN C 1 1 15 7150 1 1 29 ASN CA C -4.382 -3.092 2.049 1.00 . A A . 29 ASN CA 1 1 15 7151 1 1 29 ASN CB C -5.583 -2.163 1.852 1.00 . A A . 29 ASN CB 1 1 15 7152 1 1 29 ASN CG C -5.380 -0.866 2.616 1.00 . A A . 29 ASN CG 1 1 15 7153 1 1 29 ASN H H -3.123 -1.907 0.805 1.00 . A A . 29 ASN H 1 1 15 7154 1 1 29 ASN HA H -4.323 -3.348 3.097 1.00 . A A . 29 ASN HA 1 1 15 7155 1 1 29 ASN HB2 H -5.690 -1.938 0.801 1.00 . A A . 29 ASN HB2 1 1 15 7156 1 1 29 ASN HB3 H -6.476 -2.648 2.210 1.00 . A A . 29 ASN HB3 1 1 15 7157 1 1 29 ASN HD21 H -4.680 0.116 1.036 1.00 . A A . 29 ASN HD21 1 1 15 7158 1 1 29 ASN HD22 H -4.796 1.009 2.483 1.00 . A A . 29 ASN HD22 1 1 15 7159 1 1 29 ASN N N -3.161 -2.382 1.666 1.00 . A A . 29 ASN N 1 1 15 7160 1 1 29 ASN ND2 N -4.911 0.171 1.999 1.00 . A A . 29 ASN ND2 1 1 15 7161 1 1 29 ASN O O -4.535 -4.377 0.021 1.00 . A A . 29 ASN O 1 1 15 7162 1 1 29 ASN OD1 O -5.650 -0.798 3.811 1.00 . A A . 29 ASN OD1 1 1 15 7163 1 1 30 ILE C C -6.635 -6.754 0.788 1.00 . A A . 30 ILE C 1 1 15 7164 1 1 30 ILE CA C -5.214 -6.731 1.331 1.00 . A A . 30 ILE CA 1 1 15 7165 1 1 30 ILE CB C -5.008 -7.898 2.311 1.00 . A A . 30 ILE CB 1 1 15 7166 1 1 30 ILE CD1 C -3.616 -6.685 3.976 1.00 . A A . 30 ILE CD1 1 1 15 7167 1 1 30 ILE CG1 C -4.961 -7.374 3.747 1.00 . A A . 30 ILE CG1 1 1 15 7168 1 1 30 ILE CG2 C -3.702 -8.629 1.988 1.00 . A A . 30 ILE CG2 1 1 15 7169 1 1 30 ILE H H -5.003 -5.365 2.935 1.00 . A A . 30 ILE H 1 1 15 7170 1 1 30 ILE HA H -4.535 -6.860 0.503 1.00 . A A . 30 ILE HA 1 1 15 7171 1 1 30 ILE HB H -5.831 -8.592 2.213 1.00 . A A . 30 ILE HB 1 1 15 7172 1 1 30 ILE HD11 H -2.965 -7.345 4.525 1.00 . A A . 30 ILE HD11 1 1 15 7173 1 1 30 ILE HD12 H -3.767 -5.775 4.533 1.00 . A A . 30 ILE HD12 1 1 15 7174 1 1 30 ILE HD13 H -3.165 -6.451 3.020 1.00 . A A . 30 ILE HD13 1 1 15 7175 1 1 30 ILE HG12 H -5.766 -6.671 3.905 1.00 . A A . 30 ILE HG12 1 1 15 7176 1 1 30 ILE HG13 H -5.062 -8.199 4.436 1.00 . A A . 30 ILE HG13 1 1 15 7177 1 1 30 ILE HG21 H -3.800 -9.140 1.040 1.00 . A A . 30 ILE HG21 1 1 15 7178 1 1 30 ILE HG22 H -3.491 -9.349 2.765 1.00 . A A . 30 ILE HG22 1 1 15 7179 1 1 30 ILE HG23 H -2.893 -7.914 1.931 1.00 . A A . 30 ILE HG23 1 1 15 7180 1 1 30 ILE N N -4.929 -5.446 1.964 1.00 . A A . 30 ILE N 1 1 15 7181 1 1 30 ILE O O -7.593 -6.406 1.479 1.00 . A A . 30 ILE O 1 1 15 7182 1 1 31 GLY C C -8.163 -6.168 -2.208 1.00 . A A . 31 GLY C 1 1 15 7183 1 1 31 GLY CA C -8.035 -7.253 -1.143 1.00 . A A . 31 GLY CA 1 1 15 7184 1 1 31 GLY H H -5.933 -7.427 -0.937 1.00 . A A . 31 GLY H 1 1 15 7185 1 1 31 GLY HA2 H -8.130 -8.222 -1.609 1.00 . A A . 31 GLY HA2 1 1 15 7186 1 1 31 GLY HA3 H -8.825 -7.128 -0.421 1.00 . A A . 31 GLY HA3 1 1 15 7187 1 1 31 GLY N N -6.744 -7.169 -0.460 1.00 . A A . 31 GLY N 1 1 15 7188 1 1 31 GLY O O -8.928 -6.309 -3.159 1.00 . A A . 31 GLY O 1 1 15 7189 1 1 32 LYS C C -6.002 -3.453 -3.230 1.00 . A A . 32 LYS C 1 1 15 7190 1 1 32 LYS CA C -7.408 -4.002 -3.019 1.00 . A A . 32 LYS CA 1 1 15 7191 1 1 32 LYS CB C -8.331 -2.872 -2.544 1.00 . A A . 32 LYS CB 1 1 15 7192 1 1 32 LYS CD C -7.825 -1.045 -4.207 1.00 . A A . 32 LYS CD 1 1 15 7193 1 1 32 LYS CE C -8.171 -0.540 -5.613 1.00 . A A . 32 LYS CE 1 1 15 7194 1 1 32 LYS CG C -8.860 -2.090 -3.759 1.00 . A A . 32 LYS CG 1 1 15 7195 1 1 32 LYS H H -6.790 -5.049 -1.282 1.00 . A A . 32 LYS H 1 1 15 7196 1 1 32 LYS HA H -7.777 -4.378 -3.960 1.00 . A A . 32 LYS HA 1 1 15 7197 1 1 32 LYS HB2 H -9.162 -3.295 -1.998 1.00 . A A . 32 LYS HB2 1 1 15 7198 1 1 32 LYS HB3 H -7.781 -2.203 -1.898 1.00 . A A . 32 LYS HB3 1 1 15 7199 1 1 32 LYS HD2 H -7.832 -0.213 -3.517 1.00 . A A . 32 LYS HD2 1 1 15 7200 1 1 32 LYS HD3 H -6.843 -1.488 -4.220 1.00 . A A . 32 LYS HD3 1 1 15 7201 1 1 32 LYS HE2 H -8.692 -1.315 -6.157 1.00 . A A . 32 LYS HE2 1 1 15 7202 1 1 32 LYS HE3 H -8.806 0.331 -5.534 1.00 . A A . 32 LYS HE3 1 1 15 7203 1 1 32 LYS HG2 H -9.055 -2.778 -4.569 1.00 . A A . 32 LYS HG2 1 1 15 7204 1 1 32 LYS HG3 H -9.779 -1.589 -3.487 1.00 . A A . 32 LYS HG3 1 1 15 7205 1 1 32 LYS HZ1 H -6.330 -1.035 -6.501 1.00 . A A . 32 LYS HZ1 1 1 15 7206 1 1 32 LYS HZ2 H -6.352 0.518 -5.760 1.00 . A A . 32 LYS HZ2 1 1 15 7207 1 1 32 LYS HZ3 H -7.155 0.254 -7.256 1.00 . A A . 32 LYS HZ3 1 1 15 7208 1 1 32 LYS N N -7.392 -5.098 -2.052 1.00 . A A . 32 LYS N 1 1 15 7209 1 1 32 LYS NZ N -6.915 -0.178 -6.341 1.00 . A A . 32 LYS NZ 1 1 15 7210 1 1 32 LYS O O -5.323 -3.076 -2.277 1.00 . A A . 32 LYS O 1 1 15 7211 1 1 33 LYS C C -4.372 -1.736 -5.820 1.00 . A A . 33 LYS C 1 1 15 7212 1 1 33 LYS CA C -4.259 -2.874 -4.809 1.00 . A A . 33 LYS CA 1 1 15 7213 1 1 33 LYS CB C -3.373 -4.000 -5.367 1.00 . A A . 33 LYS CB 1 1 15 7214 1 1 33 LYS CD C -2.701 -3.428 -7.718 1.00 . A A . 33 LYS CD 1 1 15 7215 1 1 33 LYS CE C -3.373 -3.035 -9.036 1.00 . A A . 33 LYS CE 1 1 15 7216 1 1 33 LYS CG C -3.677 -4.240 -6.854 1.00 . A A . 33 LYS CG 1 1 15 7217 1 1 33 LYS H H -6.169 -3.700 -5.204 1.00 . A A . 33 LYS H 1 1 15 7218 1 1 33 LYS HA H -3.804 -2.491 -3.907 1.00 . A A . 33 LYS HA 1 1 15 7219 1 1 33 LYS HB2 H -2.334 -3.726 -5.252 1.00 . A A . 33 LYS HB2 1 1 15 7220 1 1 33 LYS HB3 H -3.564 -4.909 -4.815 1.00 . A A . 33 LYS HB3 1 1 15 7221 1 1 33 LYS HD2 H -2.403 -2.535 -7.188 1.00 . A A . 33 LYS HD2 1 1 15 7222 1 1 33 LYS HD3 H -1.827 -4.026 -7.930 1.00 . A A . 33 LYS HD3 1 1 15 7223 1 1 33 LYS HE2 H -2.616 -2.866 -9.790 1.00 . A A . 33 LYS HE2 1 1 15 7224 1 1 33 LYS HE3 H -4.030 -3.830 -9.358 1.00 . A A . 33 LYS HE3 1 1 15 7225 1 1 33 LYS HG2 H -3.565 -5.292 -7.076 1.00 . A A . 33 LYS HG2 1 1 15 7226 1 1 33 LYS HG3 H -4.689 -3.935 -7.070 1.00 . A A . 33 LYS HG3 1 1 15 7227 1 1 33 LYS HZ1 H -4.872 -1.695 -9.578 1.00 . A A . 33 LYS HZ1 1 1 15 7228 1 1 33 LYS HZ2 H -3.505 -0.944 -8.863 1.00 . A A . 33 LYS HZ2 1 1 15 7229 1 1 33 LYS HZ3 H -4.636 -1.819 -7.895 1.00 . A A . 33 LYS HZ3 1 1 15 7230 1 1 33 LYS N N -5.579 -3.395 -4.484 1.00 . A A . 33 LYS N 1 1 15 7231 1 1 33 LYS NZ N -4.160 -1.786 -8.832 1.00 . A A . 33 LYS NZ 1 1 15 7232 1 1 33 LYS O O -5.211 -1.774 -6.736 1.00 . A A . 33 LYS O 1 1 15 7233 1 1 34 ASP C C -2.439 0.256 -7.602 1.00 . A A . 34 ASP C 1 1 15 7234 1 1 34 ASP CA C -3.549 0.411 -6.563 1.00 . A A . 34 ASP CA 1 1 15 7235 1 1 34 ASP CB C -3.372 1.708 -5.767 1.00 . A A . 34 ASP CB 1 1 15 7236 1 1 34 ASP CG C -4.677 2.080 -5.063 1.00 . A A . 34 ASP CG 1 1 15 7237 1 1 34 ASP H H -2.895 -0.737 -4.905 1.00 . A A . 34 ASP H 1 1 15 7238 1 1 34 ASP HA H -4.498 0.444 -7.076 1.00 . A A . 34 ASP HA 1 1 15 7239 1 1 34 ASP HB2 H -2.594 1.572 -5.030 1.00 . A A . 34 ASP HB2 1 1 15 7240 1 1 34 ASP HB3 H -3.091 2.506 -6.439 1.00 . A A . 34 ASP HB3 1 1 15 7241 1 1 34 ASP N N -3.537 -0.724 -5.656 1.00 . A A . 34 ASP N 1 1 15 7242 1 1 34 ASP O O -2.771 0.081 -8.765 1.00 . A A . 34 ASP O 1 1 15 7243 1 1 34 ASP OXT O -1.281 0.278 -7.219 1.00 . A A . 34 ASP OXT 1 1 15 7244 1 1 34 ASP OD1 O -5.627 1.313 -5.157 1.00 . A A . 34 ASP OD1 1 1 15 7245 1 1 34 ASP OD2 O -4.709 3.123 -4.435 1.00 . A A . 34 ASP OD2 1 1 16 7246 1 1 1 GLY C C 1.736 10.932 -5.005 1.00 . A A . 1 GLY C 1 1 16 7247 1 1 1 GLY CA C 1.963 12.326 -5.583 1.00 . A A . 1 GLY CA 1 1 16 7248 1 1 1 GLY H1 H -0.091 12.498 -5.183 1.00 . A A . 1 GLY H1 1 1 16 7249 1 1 1 GLY H2 H 0.449 13.424 -6.514 1.00 . A A . 1 GLY H2 1 1 16 7250 1 1 1 GLY H3 H 0.797 13.929 -4.928 1.00 . A A . 1 GLY H3 1 1 16 7251 1 1 1 GLY HA2 H 2.308 12.240 -6.604 1.00 . A A . 1 GLY HA2 1 1 16 7252 1 1 1 GLY HA3 H 2.710 12.836 -4.993 1.00 . A A . 1 GLY HA3 1 1 16 7253 1 1 1 GLY N N 0.686 13.103 -5.554 1.00 . A A . 1 GLY N 1 1 16 7254 1 1 1 GLY O O 1.953 9.929 -5.681 1.00 . A A . 1 GLY O 1 1 16 7255 1 1 2 SER C C 2.241 8.699 -3.047 1.00 . A A . 2 SER C 1 1 16 7256 1 1 2 SER CA C 1.015 9.603 -3.079 1.00 . A A . 2 SER CA 1 1 16 7257 1 1 2 SER CB C -0.119 8.870 -3.782 1.00 . A A . 2 SER CB 1 1 16 7258 1 1 2 SER H H 1.117 11.726 -3.267 1.00 . A A . 2 SER H 1 1 16 7259 1 1 2 SER HA H 0.722 9.810 -2.066 1.00 . A A . 2 SER HA 1 1 16 7260 1 1 2 SER HB2 H -1.036 9.426 -3.679 1.00 . A A . 2 SER HB2 1 1 16 7261 1 1 2 SER HB3 H 0.127 8.770 -4.830 1.00 . A A . 2 SER HB3 1 1 16 7262 1 1 2 SER HG H 0.610 7.265 -2.944 1.00 . A A . 2 SER HG 1 1 16 7263 1 1 2 SER N N 1.286 10.879 -3.754 1.00 . A A . 2 SER N 1 1 16 7264 1 1 2 SER O O 2.125 7.491 -2.796 1.00 . A A . 2 SER O 1 1 16 7265 1 1 2 SER OG O -0.271 7.582 -3.193 1.00 . A A . 2 SER OG 1 1 16 7266 1 1 3 VAL C C 4.672 7.464 -2.243 1.00 . A A . 3 VAL C 1 1 16 7267 1 1 3 VAL CA C 4.679 8.585 -3.277 1.00 . A A . 3 VAL CA 1 1 16 7268 1 1 3 VAL CB C 5.793 9.577 -2.949 1.00 . A A . 3 VAL CB 1 1 16 7269 1 1 3 VAL CG1 C 6.042 10.478 -4.159 1.00 . A A . 3 VAL CG1 1 1 16 7270 1 1 3 VAL CG2 C 5.381 10.441 -1.748 1.00 . A A . 3 VAL CG2 1 1 16 7271 1 1 3 VAL H H 3.397 10.256 -3.466 1.00 . A A . 3 VAL H 1 1 16 7272 1 1 3 VAL HA H 4.859 8.164 -4.254 1.00 . A A . 3 VAL HA 1 1 16 7273 1 1 3 VAL HB H 6.692 9.034 -2.711 1.00 . A A . 3 VAL HB 1 1 16 7274 1 1 3 VAL HG11 H 6.498 9.902 -4.950 1.00 . A A . 3 VAL HG11 1 1 16 7275 1 1 3 VAL HG12 H 6.700 11.286 -3.877 1.00 . A A . 3 VAL HG12 1 1 16 7276 1 1 3 VAL HG13 H 5.103 10.883 -4.506 1.00 . A A . 3 VAL HG13 1 1 16 7277 1 1 3 VAL HG21 H 4.335 10.287 -1.528 1.00 . A A . 3 VAL HG21 1 1 16 7278 1 1 3 VAL HG22 H 5.548 11.484 -1.979 1.00 . A A . 3 VAL HG22 1 1 16 7279 1 1 3 VAL HG23 H 5.971 10.165 -0.887 1.00 . A A . 3 VAL HG23 1 1 16 7280 1 1 3 VAL N N 3.399 9.298 -3.286 1.00 . A A . 3 VAL N 1 1 16 7281 1 1 3 VAL O O 5.205 6.365 -2.470 1.00 . A A . 3 VAL O 1 1 16 7282 1 1 4 GLY C C 3.615 5.387 -0.669 1.00 . A A . 4 GLY C 1 1 16 7283 1 1 4 GLY CA C 3.941 6.742 -0.062 1.00 . A A . 4 GLY CA 1 1 16 7284 1 1 4 GLY H H 3.626 8.613 -0.991 1.00 . A A . 4 GLY H 1 1 16 7285 1 1 4 GLY HA2 H 4.882 6.682 0.469 1.00 . A A . 4 GLY HA2 1 1 16 7286 1 1 4 GLY HA3 H 3.157 7.020 0.626 1.00 . A A . 4 GLY HA3 1 1 16 7287 1 1 4 GLY N N 4.041 7.736 -1.111 1.00 . A A . 4 GLY N 1 1 16 7288 1 1 4 GLY O O 4.086 4.366 -0.196 1.00 . A A . 4 GLY O 1 1 16 7289 1 1 5 CYS C C 3.661 3.409 -2.953 1.00 . A A . 5 CYS C 1 1 16 7290 1 1 5 CYS CA C 2.440 4.137 -2.398 1.00 . A A . 5 CYS CA 1 1 16 7291 1 1 5 CYS CB C 1.394 4.370 -3.491 1.00 . A A . 5 CYS CB 1 1 16 7292 1 1 5 CYS H H 2.469 6.240 -2.087 1.00 . A A . 5 CYS H 1 1 16 7293 1 1 5 CYS HA H 1.997 3.502 -1.653 1.00 . A A . 5 CYS HA 1 1 16 7294 1 1 5 CYS HB2 H 1.317 5.425 -3.709 1.00 . A A . 5 CYS HB2 1 1 16 7295 1 1 5 CYS HB3 H 1.671 3.831 -4.385 1.00 . A A . 5 CYS HB3 1 1 16 7296 1 1 5 CYS N N 2.811 5.387 -1.739 1.00 . A A . 5 CYS N 1 1 16 7297 1 1 5 CYS O O 3.561 2.261 -3.378 1.00 . A A . 5 CYS O 1 1 16 7298 1 1 5 CYS SG S -0.192 3.748 -2.873 1.00 . A A . 5 CYS SG 1 1 16 7299 1 1 6 ALA C C 6.753 2.890 -2.081 1.00 . A A . 6 ALA C 1 1 16 7300 1 1 6 ALA CA C 6.064 3.434 -3.329 1.00 . A A . 6 ALA CA 1 1 16 7301 1 1 6 ALA CB C 6.962 4.454 -4.035 1.00 . A A . 6 ALA CB 1 1 16 7302 1 1 6 ALA H H 4.845 4.968 -2.511 1.00 . A A . 6 ALA H 1 1 16 7303 1 1 6 ALA HA H 5.844 2.618 -3.999 1.00 . A A . 6 ALA HA 1 1 16 7304 1 1 6 ALA HB1 H 6.582 4.643 -5.027 1.00 . A A . 6 ALA HB1 1 1 16 7305 1 1 6 ALA HB2 H 7.968 4.063 -4.102 1.00 . A A . 6 ALA HB2 1 1 16 7306 1 1 6 ALA HB3 H 6.974 5.375 -3.473 1.00 . A A . 6 ALA HB3 1 1 16 7307 1 1 6 ALA N N 4.819 4.058 -2.895 1.00 . A A . 6 ALA N 1 1 16 7308 1 1 6 ALA O O 7.184 1.730 -2.019 1.00 . A A . 6 ALA O 1 1 16 7309 1 1 7 GLU C C 6.457 2.314 0.895 1.00 . A A . 7 GLU C 1 1 16 7310 1 1 7 GLU CA C 7.377 3.335 0.219 1.00 . A A . 7 GLU CA 1 1 16 7311 1 1 7 GLU CB C 7.555 4.558 1.124 1.00 . A A . 7 GLU CB 1 1 16 7312 1 1 7 GLU CD C 7.965 6.359 -0.574 1.00 . A A . 7 GLU CD 1 1 16 7313 1 1 7 GLU CG C 8.600 5.502 0.514 1.00 . A A . 7 GLU CG 1 1 16 7314 1 1 7 GLU H H 6.398 4.634 -1.161 1.00 . A A . 7 GLU H 1 1 16 7315 1 1 7 GLU HA H 8.340 2.881 0.044 1.00 . A A . 7 GLU HA 1 1 16 7316 1 1 7 GLU HB2 H 6.611 5.077 1.220 1.00 . A A . 7 GLU HB2 1 1 16 7317 1 1 7 GLU HB3 H 7.889 4.239 2.101 1.00 . A A . 7 GLU HB3 1 1 16 7318 1 1 7 GLU HG2 H 8.997 6.144 1.286 1.00 . A A . 7 GLU HG2 1 1 16 7319 1 1 7 GLU HG3 H 9.402 4.921 0.086 1.00 . A A . 7 GLU HG3 1 1 16 7320 1 1 7 GLU N N 6.795 3.735 -1.059 1.00 . A A . 7 GLU N 1 1 16 7321 1 1 7 GLU O O 6.913 1.357 1.511 1.00 . A A . 7 GLU O 1 1 16 7322 1 1 7 GLU OE1 O 7.150 7.203 -0.239 1.00 . A A . 7 GLU OE1 1 1 16 7323 1 1 7 GLU OE2 O 8.301 6.159 -1.728 1.00 . A A . 7 GLU OE2 1 1 16 7324 1 1 8 CYS C C 4.454 0.188 1.000 1.00 . A A . 8 CYS C 1 1 16 7325 1 1 8 CYS CA C 4.135 1.646 1.317 1.00 . A A . 8 CYS CA 1 1 16 7326 1 1 8 CYS CB C 2.749 2.010 0.769 1.00 . A A . 8 CYS CB 1 1 16 7327 1 1 8 CYS H H 4.861 3.315 0.234 1.00 . A A . 8 CYS H 1 1 16 7328 1 1 8 CYS HA H 4.127 1.774 2.388 1.00 . A A . 8 CYS HA 1 1 16 7329 1 1 8 CYS HB2 H 2.859 2.635 -0.100 1.00 . A A . 8 CYS HB2 1 1 16 7330 1 1 8 CYS HB3 H 2.216 1.115 0.496 1.00 . A A . 8 CYS HB3 1 1 16 7331 1 1 8 CYS N N 5.151 2.533 0.748 1.00 . A A . 8 CYS N 1 1 16 7332 1 1 8 CYS O O 4.672 -0.610 1.910 1.00 . A A . 8 CYS O 1 1 16 7333 1 1 8 CYS SG S 1.813 2.898 2.036 1.00 . A A . 8 CYS SG 1 1 16 7334 1 1 9 PRO C C 6.162 -1.958 0.001 1.00 . A A . 9 PRO C 1 1 16 7335 1 1 9 PRO CA C 4.852 -1.564 -0.655 1.00 . A A . 9 PRO CA 1 1 16 7336 1 1 9 PRO CB C 4.967 -1.535 -2.186 1.00 . A A . 9 PRO CB 1 1 16 7337 1 1 9 PRO CD C 4.267 0.676 -1.430 1.00 . A A . 9 PRO CD 1 1 16 7338 1 1 9 PRO CG C 4.891 -0.099 -2.593 1.00 . A A . 9 PRO CG 1 1 16 7339 1 1 9 PRO HA H 4.066 -2.240 -0.357 1.00 . A A . 9 PRO HA 1 1 16 7340 1 1 9 PRO HB2 H 5.912 -1.960 -2.496 1.00 . A A . 9 PRO HB2 1 1 16 7341 1 1 9 PRO HB3 H 4.151 -2.084 -2.628 1.00 . A A . 9 PRO HB3 1 1 16 7342 1 1 9 PRO HD2 H 4.750 1.634 -1.315 1.00 . A A . 9 PRO HD2 1 1 16 7343 1 1 9 PRO HD3 H 3.207 0.800 -1.586 1.00 . A A . 9 PRO HD3 1 1 16 7344 1 1 9 PRO HG2 H 5.882 0.274 -2.802 1.00 . A A . 9 PRO HG2 1 1 16 7345 1 1 9 PRO HG3 H 4.268 0.002 -3.468 1.00 . A A . 9 PRO HG3 1 1 16 7346 1 1 9 PRO N N 4.512 -0.176 -0.263 1.00 . A A . 9 PRO N 1 1 16 7347 1 1 9 PRO O O 6.269 -3.021 0.617 1.00 . A A . 9 PRO O 1 1 16 7348 1 1 10 MET C C 8.217 -1.503 2.048 1.00 . A A . 10 MET C 1 1 16 7349 1 1 10 MET CA C 8.433 -1.303 0.546 1.00 . A A . 10 MET CA 1 1 16 7350 1 1 10 MET CB C 9.365 -0.116 0.299 1.00 . A A . 10 MET CB 1 1 16 7351 1 1 10 MET CE C 11.916 0.320 -2.899 1.00 . A A . 10 MET CE 1 1 16 7352 1 1 10 MET CG C 9.930 -0.190 -1.122 1.00 . A A . 10 MET CG 1 1 16 7353 1 1 10 MET H H 6.991 -0.208 -0.563 1.00 . A A . 10 MET H 1 1 16 7354 1 1 10 MET HA H 8.871 -2.196 0.131 1.00 . A A . 10 MET HA 1 1 16 7355 1 1 10 MET HB2 H 8.814 0.807 0.417 1.00 . A A . 10 MET HB2 1 1 16 7356 1 1 10 MET HB3 H 10.176 -0.140 1.008 1.00 . A A . 10 MET HB3 1 1 16 7357 1 1 10 MET HE1 H 12.955 0.567 -3.065 1.00 . A A . 10 MET HE1 1 1 16 7358 1 1 10 MET HE2 H 11.295 0.857 -3.602 1.00 . A A . 10 MET HE2 1 1 16 7359 1 1 10 MET HE3 H 11.775 -0.739 -3.036 1.00 . A A . 10 MET HE3 1 1 16 7360 1 1 10 MET HG2 H 10.143 -1.219 -1.372 1.00 . A A . 10 MET HG2 1 1 16 7361 1 1 10 MET HG3 H 9.207 0.209 -1.820 1.00 . A A . 10 MET HG3 1 1 16 7362 1 1 10 MET N N 7.146 -1.060 -0.089 1.00 . A A . 10 MET N 1 1 16 7363 1 1 10 MET O O 8.830 -2.368 2.670 1.00 . A A . 10 MET O 1 1 16 7364 1 1 10 MET SD S 11.453 0.781 -1.212 1.00 . A A . 10 MET SD 1 1 16 7365 1 1 11 HIS C C 6.015 -1.934 4.291 1.00 . A A . 11 HIS C 1 1 16 7366 1 1 11 HIS CA C 6.981 -0.772 4.027 1.00 . A A . 11 HIS CA 1 1 16 7367 1 1 11 HIS CB C 6.338 0.549 4.461 1.00 . A A . 11 HIS CB 1 1 16 7368 1 1 11 HIS CD2 C 8.574 1.913 4.273 1.00 . A A . 11 HIS CD2 1 1 16 7369 1 1 11 HIS CE1 C 8.438 2.999 6.143 1.00 . A A . 11 HIS CE1 1 1 16 7370 1 1 11 HIS CG C 7.407 1.521 4.876 1.00 . A A . 11 HIS CG 1 1 16 7371 1 1 11 HIS H H 6.857 -0.031 2.046 1.00 . A A . 11 HIS H 1 1 16 7372 1 1 11 HIS HA H 7.883 -0.929 4.599 1.00 . A A . 11 HIS HA 1 1 16 7373 1 1 11 HIS HB2 H 5.782 0.963 3.633 1.00 . A A . 11 HIS HB2 1 1 16 7374 1 1 11 HIS HB3 H 5.671 0.372 5.289 1.00 . A A . 11 HIS HB3 1 1 16 7375 1 1 11 HIS HD2 H 8.933 1.552 3.320 1.00 . A A . 11 HIS HD2 1 1 16 7376 1 1 11 HIS HE1 H 8.656 3.663 6.969 1.00 . A A . 11 HIS HE1 1 1 16 7377 1 1 11 HIS HE2 H 10.081 3.293 4.894 1.00 . A A . 11 HIS HE2 1 1 16 7378 1 1 11 HIS N N 7.317 -0.697 2.609 1.00 . A A . 11 HIS N 1 1 16 7379 1 1 11 HIS ND1 N 7.340 2.226 6.066 1.00 . A A . 11 HIS ND1 1 1 16 7380 1 1 11 HIS NE2 N 9.226 2.847 5.074 1.00 . A A . 11 HIS NE2 1 1 16 7381 1 1 11 HIS O O 5.467 -2.068 5.385 1.00 . A A . 11 HIS O 1 1 16 7382 1 1 12 CYS C C 5.779 -5.198 3.652 1.00 . A A . 12 CYS C 1 1 16 7383 1 1 12 CYS CA C 4.942 -3.943 3.394 1.00 . A A . 12 CYS CA 1 1 16 7384 1 1 12 CYS CB C 4.099 -4.124 2.135 1.00 . A A . 12 CYS CB 1 1 16 7385 1 1 12 CYS H H 6.300 -2.621 2.432 1.00 . A A . 12 CYS H 1 1 16 7386 1 1 12 CYS HA H 4.275 -3.790 4.233 1.00 . A A . 12 CYS HA 1 1 16 7387 1 1 12 CYS HB2 H 4.019 -3.181 1.617 1.00 . A A . 12 CYS HB2 1 1 16 7388 1 1 12 CYS HB3 H 4.560 -4.856 1.490 1.00 . A A . 12 CYS HB3 1 1 16 7389 1 1 12 CYS N N 5.825 -2.778 3.278 1.00 . A A . 12 CYS N 1 1 16 7390 1 1 12 CYS O O 6.911 -5.300 3.184 1.00 . A A . 12 CYS O 1 1 16 7391 1 1 12 CYS SG S 2.448 -4.694 2.617 1.00 . A A . 12 CYS SG 1 1 16 7392 1 1 13 LYS C C 5.666 -8.510 3.818 1.00 . A A . 13 LYS C 1 1 16 7393 1 1 13 LYS CA C 5.986 -7.354 4.763 1.00 . A A . 13 LYS CA 1 1 16 7394 1 1 13 LYS CB C 5.680 -7.778 6.200 1.00 . A A . 13 LYS CB 1 1 16 7395 1 1 13 LYS CD C 5.914 -10.045 7.256 1.00 . A A . 13 LYS CD 1 1 16 7396 1 1 13 LYS CE C 6.686 -11.345 7.004 1.00 . A A . 13 LYS CE 1 1 16 7397 1 1 13 LYS CG C 6.677 -8.855 6.653 1.00 . A A . 13 LYS CG 1 1 16 7398 1 1 13 LYS H H 4.345 -5.998 4.794 1.00 . A A . 13 LYS H 1 1 16 7399 1 1 13 LYS HA H 7.042 -7.138 4.691 1.00 . A A . 13 LYS HA 1 1 16 7400 1 1 13 LYS HB2 H 5.763 -6.919 6.849 1.00 . A A . 13 LYS HB2 1 1 16 7401 1 1 13 LYS HB3 H 4.678 -8.173 6.249 1.00 . A A . 13 LYS HB3 1 1 16 7402 1 1 13 LYS HD2 H 5.801 -9.896 8.322 1.00 . A A . 13 LYS HD2 1 1 16 7403 1 1 13 LYS HD3 H 4.938 -10.117 6.800 1.00 . A A . 13 LYS HD3 1 1 16 7404 1 1 13 LYS HE2 H 7.547 -11.143 6.381 1.00 . A A . 13 LYS HE2 1 1 16 7405 1 1 13 LYS HE3 H 7.016 -11.756 7.948 1.00 . A A . 13 LYS HE3 1 1 16 7406 1 1 13 LYS HG2 H 7.257 -9.188 5.803 1.00 . A A . 13 LYS HG2 1 1 16 7407 1 1 13 LYS HG3 H 7.340 -8.439 7.398 1.00 . A A . 13 LYS HG3 1 1 16 7408 1 1 13 LYS HZ1 H 6.234 -13.262 6.314 1.00 . A A . 13 LYS HZ1 1 1 16 7409 1 1 13 LYS HZ2 H 5.617 -12.011 5.326 1.00 . A A . 13 LYS HZ2 1 1 16 7410 1 1 13 LYS HZ3 H 4.882 -12.372 6.828 1.00 . A A . 13 LYS HZ3 1 1 16 7411 1 1 13 LYS N N 5.239 -6.136 4.426 1.00 . A A . 13 LYS N 1 1 16 7412 1 1 13 LYS NZ N 5.788 -12.322 6.321 1.00 . A A . 13 LYS NZ 1 1 16 7413 1 1 13 LYS O O 4.525 -8.708 3.388 1.00 . A A . 13 LYS O 1 1 16 7414 1 1 14 GLY C C 5.514 -11.370 2.973 1.00 . A A . 14 GLY C 1 1 16 7415 1 1 14 GLY CA C 6.629 -10.402 2.593 1.00 . A A . 14 GLY CA 1 1 16 7416 1 1 14 GLY H H 7.583 -9.019 3.882 1.00 . A A . 14 GLY H 1 1 16 7417 1 1 14 GLY HA2 H 6.452 -10.042 1.590 1.00 . A A . 14 GLY HA2 1 1 16 7418 1 1 14 GLY HA3 H 7.570 -10.933 2.611 1.00 . A A . 14 GLY HA3 1 1 16 7419 1 1 14 GLY N N 6.716 -9.257 3.498 1.00 . A A . 14 GLY N 1 1 16 7420 1 1 14 GLY O O 5.352 -11.722 4.147 1.00 . A A . 14 GLY O 1 1 16 7421 1 1 15 LYS C C 2.307 -12.035 1.918 1.00 . A A . 15 LYS C 1 1 16 7422 1 1 15 LYS CA C 3.656 -12.744 2.074 1.00 . A A . 15 LYS CA 1 1 16 7423 1 1 15 LYS CB C 3.696 -13.497 3.415 1.00 . A A . 15 LYS CB 1 1 16 7424 1 1 15 LYS CD C 2.960 -15.704 2.431 1.00 . A A . 15 LYS CD 1 1 16 7425 1 1 15 LYS CE C 2.179 -15.518 1.117 1.00 . A A . 15 LYS CE 1 1 16 7426 1 1 15 LYS CG C 2.619 -14.594 3.443 1.00 . A A . 15 LYS CG 1 1 16 7427 1 1 15 LYS H H 4.998 -11.464 1.050 1.00 . A A . 15 LYS H 1 1 16 7428 1 1 15 LYS HA H 3.745 -13.468 1.278 1.00 . A A . 15 LYS HA 1 1 16 7429 1 1 15 LYS HB2 H 4.670 -13.946 3.547 1.00 . A A . 15 LYS HB2 1 1 16 7430 1 1 15 LYS HB3 H 3.510 -12.801 4.222 1.00 . A A . 15 LYS HB3 1 1 16 7431 1 1 15 LYS HD2 H 4.020 -15.679 2.219 1.00 . A A . 15 LYS HD2 1 1 16 7432 1 1 15 LYS HD3 H 2.709 -16.664 2.859 1.00 . A A . 15 LYS HD3 1 1 16 7433 1 1 15 LYS HE2 H 2.733 -14.865 0.458 1.00 . A A . 15 LYS HE2 1 1 16 7434 1 1 15 LYS HE3 H 2.053 -16.480 0.639 1.00 . A A . 15 LYS HE3 1 1 16 7435 1 1 15 LYS HG2 H 2.576 -15.023 4.436 1.00 . A A . 15 LYS HG2 1 1 16 7436 1 1 15 LYS HG3 H 1.661 -14.164 3.204 1.00 . A A . 15 LYS HG3 1 1 16 7437 1 1 15 LYS HZ1 H 0.190 -15.138 0.607 1.00 . A A . 15 LYS HZ1 1 1 16 7438 1 1 15 LYS HZ2 H 0.934 -13.875 1.488 1.00 . A A . 15 LYS HZ2 1 1 16 7439 1 1 15 LYS HZ3 H 0.455 -15.316 2.275 1.00 . A A . 15 LYS HZ3 1 1 16 7440 1 1 15 LYS N N 4.773 -11.796 1.945 1.00 . A A . 15 LYS N 1 1 16 7441 1 1 15 LYS NZ N 0.837 -14.921 1.393 1.00 . A A . 15 LYS NZ 1 1 16 7442 1 1 15 LYS O O 1.303 -12.676 1.587 1.00 . A A . 15 LYS O 1 1 16 7443 1 1 16 MET C C 1.298 -8.595 1.348 1.00 . A A . 16 MET C 1 1 16 7444 1 1 16 MET CA C 1.037 -9.957 2.005 1.00 . A A . 16 MET CA 1 1 16 7445 1 1 16 MET CB C 0.399 -9.734 3.389 1.00 . A A . 16 MET CB 1 1 16 7446 1 1 16 MET CE C -0.055 -12.191 6.620 1.00 . A A . 16 MET CE 1 1 16 7447 1 1 16 MET CG C 0.343 -11.045 4.184 1.00 . A A . 16 MET CG 1 1 16 7448 1 1 16 MET H H 3.108 -10.255 2.394 1.00 . A A . 16 MET H 1 1 16 7449 1 1 16 MET HA H 0.349 -10.516 1.390 1.00 . A A . 16 MET HA 1 1 16 7450 1 1 16 MET HB2 H 0.984 -9.014 3.939 1.00 . A A . 16 MET HB2 1 1 16 7451 1 1 16 MET HB3 H -0.606 -9.356 3.262 1.00 . A A . 16 MET HB3 1 1 16 7452 1 1 16 MET HE1 H -1.121 -12.172 6.445 1.00 . A A . 16 MET HE1 1 1 16 7453 1 1 16 MET HE2 H 0.141 -12.229 7.684 1.00 . A A . 16 MET HE2 1 1 16 7454 1 1 16 MET HE3 H 0.370 -13.063 6.149 1.00 . A A . 16 MET HE3 1 1 16 7455 1 1 16 MET HG2 H -0.642 -11.480 4.096 1.00 . A A . 16 MET HG2 1 1 16 7456 1 1 16 MET HG3 H 1.077 -11.735 3.803 1.00 . A A . 16 MET HG3 1 1 16 7457 1 1 16 MET N N 2.282 -10.719 2.141 1.00 . A A . 16 MET N 1 1 16 7458 1 1 16 MET O O 1.665 -7.630 2.026 1.00 . A A . 16 MET O 1 1 16 7459 1 1 16 MET SD S 0.695 -10.698 5.926 1.00 . A A . 16 MET SD 1 1 16 7460 1 1 17 ALA C C -0.050 -6.656 -1.121 1.00 . A A . 17 ALA C 1 1 16 7461 1 1 17 ALA CA C 1.283 -7.256 -0.693 1.00 . A A . 17 ALA CA 1 1 16 7462 1 1 17 ALA CB C 2.156 -7.491 -1.928 1.00 . A A . 17 ALA CB 1 1 16 7463 1 1 17 ALA H H 0.767 -9.303 -0.452 1.00 . A A . 17 ALA H 1 1 16 7464 1 1 17 ALA HA H 1.779 -6.554 -0.042 1.00 . A A . 17 ALA HA 1 1 16 7465 1 1 17 ALA HB1 H 3.016 -6.839 -1.890 1.00 . A A . 17 ALA HB1 1 1 16 7466 1 1 17 ALA HB2 H 1.583 -7.278 -2.821 1.00 . A A . 17 ALA HB2 1 1 16 7467 1 1 17 ALA HB3 H 2.485 -8.518 -1.949 1.00 . A A . 17 ALA HB3 1 1 16 7468 1 1 17 ALA N N 1.080 -8.513 0.034 1.00 . A A . 17 ALA N 1 1 16 7469 1 1 17 ALA O O -0.903 -7.344 -1.678 1.00 . A A . 17 ALA O 1 1 16 7470 1 1 18 LYS C C -1.304 -3.172 -1.187 1.00 . A A . 18 LYS C 1 1 16 7471 1 1 18 LYS CA C -1.474 -4.697 -1.170 1.00 . A A . 18 LYS CA 1 1 16 7472 1 1 18 LYS CB C -2.537 -5.105 -0.154 1.00 . A A . 18 LYS CB 1 1 16 7473 1 1 18 LYS CD C -1.299 -6.374 1.636 1.00 . A A . 18 LYS CD 1 1 16 7474 1 1 18 LYS CE C -1.081 -6.442 3.151 1.00 . A A . 18 LYS CE 1 1 16 7475 1 1 18 LYS CG C -1.950 -5.034 1.261 1.00 . A A . 18 LYS CG 1 1 16 7476 1 1 18 LYS H H 0.483 -4.880 -0.373 1.00 . A A . 18 LYS H 1 1 16 7477 1 1 18 LYS HA H -1.793 -5.020 -2.144 1.00 . A A . 18 LYS HA 1 1 16 7478 1 1 18 LYS HB2 H -3.380 -4.437 -0.234 1.00 . A A . 18 LYS HB2 1 1 16 7479 1 1 18 LYS HB3 H -2.856 -6.114 -0.361 1.00 . A A . 18 LYS HB3 1 1 16 7480 1 1 18 LYS HD2 H -1.940 -7.187 1.328 1.00 . A A . 18 LYS HD2 1 1 16 7481 1 1 18 LYS HD3 H -0.348 -6.462 1.142 1.00 . A A . 18 LYS HD3 1 1 16 7482 1 1 18 LYS HE2 H -1.627 -5.641 3.633 1.00 . A A . 18 LYS HE2 1 1 16 7483 1 1 18 LYS HE3 H -1.436 -7.392 3.524 1.00 . A A . 18 LYS HE3 1 1 16 7484 1 1 18 LYS HG2 H -1.206 -4.253 1.297 1.00 . A A . 18 LYS HG2 1 1 16 7485 1 1 18 LYS HG3 H -2.737 -4.812 1.960 1.00 . A A . 18 LYS HG3 1 1 16 7486 1 1 18 LYS HZ1 H 0.569 -6.601 4.419 1.00 . A A . 18 LYS HZ1 1 1 16 7487 1 1 18 LYS HZ2 H 0.657 -5.309 3.326 1.00 . A A . 18 LYS HZ2 1 1 16 7488 1 1 18 LYS HZ3 H 0.935 -6.901 2.776 1.00 . A A . 18 LYS HZ3 1 1 16 7489 1 1 18 LYS N N -0.227 -5.372 -0.834 1.00 . A A . 18 LYS N 1 1 16 7490 1 1 18 LYS NZ N 0.376 -6.302 3.443 1.00 . A A . 18 LYS NZ 1 1 16 7491 1 1 18 LYS O O -1.619 -2.487 -0.208 1.00 . A A . 18 LYS O 1 1 16 7492 1 1 19 PRO C C -1.897 -0.382 -2.564 1.00 . A A . 19 PRO C 1 1 16 7493 1 1 19 PRO CA C -0.588 -1.165 -2.430 1.00 . A A . 19 PRO CA 1 1 16 7494 1 1 19 PRO CB C 0.255 -1.061 -3.705 1.00 . A A . 19 PRO CB 1 1 16 7495 1 1 19 PRO CD C -0.421 -3.378 -3.490 1.00 . A A . 19 PRO CD 1 1 16 7496 1 1 19 PRO CG C -0.078 -2.281 -4.499 1.00 . A A . 19 PRO CG 1 1 16 7497 1 1 19 PRO HA H -0.021 -0.791 -1.596 1.00 . A A . 19 PRO HA 1 1 16 7498 1 1 19 PRO HB2 H -0.007 -0.167 -4.256 1.00 . A A . 19 PRO HB2 1 1 16 7499 1 1 19 PRO HB3 H 1.306 -1.057 -3.460 1.00 . A A . 19 PRO HB3 1 1 16 7500 1 1 19 PRO HD2 H -1.243 -3.980 -3.855 1.00 . A A . 19 PRO HD2 1 1 16 7501 1 1 19 PRO HD3 H 0.441 -3.994 -3.289 1.00 . A A . 19 PRO HD3 1 1 16 7502 1 1 19 PRO HG2 H -0.929 -2.082 -5.137 1.00 . A A . 19 PRO HG2 1 1 16 7503 1 1 19 PRO HG3 H 0.770 -2.583 -5.092 1.00 . A A . 19 PRO HG3 1 1 16 7504 1 1 19 PRO N N -0.813 -2.637 -2.279 1.00 . A A . 19 PRO N 1 1 16 7505 1 1 19 PRO O O -2.598 -0.493 -3.570 1.00 . A A . 19 PRO O 1 1 16 7506 1 1 20 THR C C -3.121 2.697 -1.505 1.00 . A A . 20 THR C 1 1 16 7507 1 1 20 THR CA C -3.442 1.207 -1.546 1.00 . A A . 20 THR CA 1 1 16 7508 1 1 20 THR CB C -4.315 0.849 -0.338 1.00 . A A . 20 THR CB 1 1 16 7509 1 1 20 THR CG2 C -4.412 -0.667 -0.198 1.00 . A A . 20 THR CG2 1 1 16 7510 1 1 20 THR H H -1.618 0.454 -0.761 1.00 . A A . 20 THR H 1 1 16 7511 1 1 20 THR HA H -3.995 0.995 -2.446 1.00 . A A . 20 THR HA 1 1 16 7512 1 1 20 THR HB H -5.305 1.257 -0.473 1.00 . A A . 20 THR HB 1 1 16 7513 1 1 20 THR HG1 H -2.832 1.019 0.912 1.00 . A A . 20 THR HG1 1 1 16 7514 1 1 20 THR HG21 H -3.420 -1.086 -0.126 1.00 . A A . 20 THR HG21 1 1 16 7515 1 1 20 THR HG22 H -4.914 -1.078 -1.061 1.00 . A A . 20 THR HG22 1 1 16 7516 1 1 20 THR HG23 H -4.972 -0.911 0.692 1.00 . A A . 20 THR HG23 1 1 16 7517 1 1 20 THR N N -2.215 0.408 -1.538 1.00 . A A . 20 THR N 1 1 16 7518 1 1 20 THR O O -2.517 3.181 -0.542 1.00 . A A . 20 THR O 1 1 16 7519 1 1 20 THR OG1 O -3.735 1.386 0.842 1.00 . A A . 20 THR OG1 1 1 16 7520 1 1 21 CYS C C -4.631 5.604 -2.520 1.00 . A A . 21 CYS C 1 1 16 7521 1 1 21 CYS CA C -3.299 4.857 -2.614 1.00 . A A . 21 CYS CA 1 1 16 7522 1 1 21 CYS CB C -2.608 5.227 -3.929 1.00 . A A . 21 CYS CB 1 1 16 7523 1 1 21 CYS H H -4.013 2.970 -3.282 1.00 . A A . 21 CYS H 1 1 16 7524 1 1 21 CYS HA H -2.668 5.149 -1.788 1.00 . A A . 21 CYS HA 1 1 16 7525 1 1 21 CYS HB2 H -3.352 5.363 -4.694 1.00 . A A . 21 CYS HB2 1 1 16 7526 1 1 21 CYS HB3 H -2.059 6.146 -3.799 1.00 . A A . 21 CYS HB3 1 1 16 7527 1 1 21 CYS N N -3.532 3.417 -2.545 1.00 . A A . 21 CYS N 1 1 16 7528 1 1 21 CYS O O -5.487 5.469 -3.396 1.00 . A A . 21 CYS O 1 1 16 7529 1 1 21 CYS SG S -1.467 3.911 -4.428 1.00 . A A . 21 CYS SG 1 1 16 7530 1 1 22 GLU C C -5.721 8.517 -0.728 1.00 . A A . 22 GLU C 1 1 16 7531 1 1 22 GLU CA C -6.028 7.126 -1.267 1.00 . A A . 22 GLU CA 1 1 16 7532 1 1 22 GLU CB C -6.967 6.370 -0.310 1.00 . A A . 22 GLU CB 1 1 16 7533 1 1 22 GLU CD C -6.384 3.933 0.016 1.00 . A A . 22 GLU CD 1 1 16 7534 1 1 22 GLU CG C -6.188 5.355 0.550 1.00 . A A . 22 GLU CG 1 1 16 7535 1 1 22 GLU H H -4.111 6.470 -0.792 1.00 . A A . 22 GLU H 1 1 16 7536 1 1 22 GLU HA H -6.524 7.230 -2.222 1.00 . A A . 22 GLU HA 1 1 16 7537 1 1 22 GLU HB2 H -7.465 7.078 0.338 1.00 . A A . 22 GLU HB2 1 1 16 7538 1 1 22 GLU HB3 H -7.702 5.844 -0.891 1.00 . A A . 22 GLU HB3 1 1 16 7539 1 1 22 GLU HG2 H -5.138 5.600 0.538 1.00 . A A . 22 GLU HG2 1 1 16 7540 1 1 22 GLU HG3 H -6.549 5.404 1.566 1.00 . A A . 22 GLU HG3 1 1 16 7541 1 1 22 GLU N N -4.808 6.388 -1.459 1.00 . A A . 22 GLU N 1 1 16 7542 1 1 22 GLU O O -5.028 8.679 0.274 1.00 . A A . 22 GLU O 1 1 16 7543 1 1 22 GLU OE1 O -5.870 3.640 -1.045 1.00 . A A . 22 GLU OE1 1 1 16 7544 1 1 22 GLU OE2 O -7.034 3.144 0.689 1.00 . A A . 22 GLU OE2 1 1 16 7545 1 1 23 ASN C C -4.610 11.228 -0.683 1.00 . A A . 23 ASN C 1 1 16 7546 1 1 23 ASN CA C -6.055 10.921 -1.080 1.00 . A A . 23 ASN CA 1 1 16 7547 1 1 23 ASN CB C -7.013 11.314 0.050 1.00 . A A . 23 ASN CB 1 1 16 7548 1 1 23 ASN CG C -6.786 10.444 1.281 1.00 . A A . 23 ASN CG 1 1 16 7549 1 1 23 ASN H H -6.751 9.272 -2.221 1.00 . A A . 23 ASN H 1 1 16 7550 1 1 23 ASN HA H -6.296 11.518 -1.947 1.00 . A A . 23 ASN HA 1 1 16 7551 1 1 23 ASN HB2 H -6.853 12.349 0.313 1.00 . A A . 23 ASN HB2 1 1 16 7552 1 1 23 ASN HB3 H -8.026 11.186 -0.291 1.00 . A A . 23 ASN HB3 1 1 16 7553 1 1 23 ASN HD21 H -4.941 11.104 1.575 1.00 . A A . 23 ASN HD21 1 1 16 7554 1 1 23 ASN HD22 H -5.498 9.946 2.692 1.00 . A A . 23 ASN HD22 1 1 16 7555 1 1 23 ASN N N -6.238 9.505 -1.432 1.00 . A A . 23 ASN N 1 1 16 7556 1 1 23 ASN ND2 N -5.650 10.503 1.903 1.00 . A A . 23 ASN ND2 1 1 16 7557 1 1 23 ASN O O -4.348 11.808 0.372 1.00 . A A . 23 ASN O 1 1 16 7558 1 1 23 ASN OD1 O -7.670 9.692 1.683 1.00 . A A . 23 ASN OD1 1 1 16 7559 1 1 24 GLU C C -1.725 10.191 -0.167 1.00 . A A . 24 GLU C 1 1 16 7560 1 1 24 GLU CA C -2.254 11.045 -1.319 1.00 . A A . 24 GLU CA 1 1 16 7561 1 1 24 GLU CB C -1.959 12.529 -1.054 1.00 . A A . 24 GLU CB 1 1 16 7562 1 1 24 GLU CD C -0.789 12.766 -3.268 1.00 . A A . 24 GLU CD 1 1 16 7563 1 1 24 GLU CG C -1.915 13.294 -2.384 1.00 . A A . 24 GLU CG 1 1 16 7564 1 1 24 GLU H H -3.967 10.369 -2.364 1.00 . A A . 24 GLU H 1 1 16 7565 1 1 24 GLU HA H -1.733 10.755 -2.214 1.00 . A A . 24 GLU HA 1 1 16 7566 1 1 24 GLU HB2 H -2.730 12.947 -0.424 1.00 . A A . 24 GLU HB2 1 1 16 7567 1 1 24 GLU HB3 H -1.004 12.621 -0.558 1.00 . A A . 24 GLU HB3 1 1 16 7568 1 1 24 GLU HG2 H -2.857 13.173 -2.897 1.00 . A A . 24 GLU HG2 1 1 16 7569 1 1 24 GLU HG3 H -1.749 14.342 -2.187 1.00 . A A . 24 GLU HG3 1 1 16 7570 1 1 24 GLU N N -3.683 10.826 -1.545 1.00 . A A . 24 GLU N 1 1 16 7571 1 1 24 GLU O O -0.523 10.180 0.099 1.00 . A A . 24 GLU O 1 1 16 7572 1 1 24 GLU OE1 O 0.365 12.989 -2.935 1.00 . A A . 24 GLU OE1 1 1 16 7573 1 1 24 GLU OE2 O -1.089 12.154 -4.282 1.00 . A A . 24 GLU OE2 1 1 16 7574 1 1 25 VAL C C -2.082 7.154 1.108 1.00 . A A . 25 VAL C 1 1 16 7575 1 1 25 VAL CA C -2.193 8.595 1.602 1.00 . A A . 25 VAL CA 1 1 16 7576 1 1 25 VAL CB C -3.190 8.689 2.765 1.00 . A A . 25 VAL CB 1 1 16 7577 1 1 25 VAL CG1 C -2.921 7.564 3.768 1.00 . A A . 25 VAL CG1 1 1 16 7578 1 1 25 VAL CG2 C -3.024 10.041 3.471 1.00 . A A . 25 VAL CG2 1 1 16 7579 1 1 25 VAL H H -3.562 9.485 0.244 1.00 . A A . 25 VAL H 1 1 16 7580 1 1 25 VAL HA H -1.222 8.918 1.950 1.00 . A A . 25 VAL HA 1 1 16 7581 1 1 25 VAL HB H -4.198 8.597 2.385 1.00 . A A . 25 VAL HB 1 1 16 7582 1 1 25 VAL HG11 H -3.580 7.674 4.617 1.00 . A A . 25 VAL HG11 1 1 16 7583 1 1 25 VAL HG12 H -1.894 7.617 4.102 1.00 . A A . 25 VAL HG12 1 1 16 7584 1 1 25 VAL HG13 H -3.097 6.609 3.298 1.00 . A A . 25 VAL HG13 1 1 16 7585 1 1 25 VAL HG21 H -3.975 10.549 3.506 1.00 . A A . 25 VAL HG21 1 1 16 7586 1 1 25 VAL HG22 H -2.312 10.647 2.931 1.00 . A A . 25 VAL HG22 1 1 16 7587 1 1 25 VAL HG23 H -2.667 9.879 4.479 1.00 . A A . 25 VAL HG23 1 1 16 7588 1 1 25 VAL N N -2.613 9.459 0.503 1.00 . A A . 25 VAL N 1 1 16 7589 1 1 25 VAL O O -2.988 6.640 0.446 1.00 . A A . 25 VAL O 1 1 16 7590 1 1 26 CYS C C -0.718 4.170 2.133 1.00 . A A . 26 CYS C 1 1 16 7591 1 1 26 CYS CA C -0.725 5.147 0.969 1.00 . A A . 26 CYS CA 1 1 16 7592 1 1 26 CYS CB C 0.620 5.055 0.262 1.00 . A A . 26 CYS CB 1 1 16 7593 1 1 26 CYS H H -0.257 6.972 1.912 1.00 . A A . 26 CYS H 1 1 16 7594 1 1 26 CYS HA H -1.499 4.866 0.276 1.00 . A A . 26 CYS HA 1 1 16 7595 1 1 26 CYS HB2 H 0.607 4.215 -0.400 1.00 . A A . 26 CYS HB2 1 1 16 7596 1 1 26 CYS HB3 H 0.798 5.953 -0.303 1.00 . A A . 26 CYS HB3 1 1 16 7597 1 1 26 CYS N N -0.954 6.514 1.407 1.00 . A A . 26 CYS N 1 1 16 7598 1 1 26 CYS O O -0.139 4.439 3.186 1.00 . A A . 26 CYS O 1 1 16 7599 1 1 26 CYS SG S 1.940 4.840 1.485 1.00 . A A . 26 CYS SG 1 1 16 7600 1 1 27 LYS C C -1.326 0.600 2.315 1.00 . A A . 27 LYS C 1 1 16 7601 1 1 27 LYS CA C -1.398 1.984 2.956 1.00 . A A . 27 LYS CA 1 1 16 7602 1 1 27 LYS CB C -2.685 2.092 3.781 1.00 . A A . 27 LYS CB 1 1 16 7603 1 1 27 LYS CD C -4.115 3.917 2.837 1.00 . A A . 27 LYS CD 1 1 16 7604 1 1 27 LYS CE C -5.397 3.121 3.066 1.00 . A A . 27 LYS CE 1 1 16 7605 1 1 27 LYS CG C -3.096 3.561 3.922 1.00 . A A . 27 LYS CG 1 1 16 7606 1 1 27 LYS H H -1.792 2.874 1.057 1.00 . A A . 27 LYS H 1 1 16 7607 1 1 27 LYS HA H -0.550 2.107 3.614 1.00 . A A . 27 LYS HA 1 1 16 7608 1 1 27 LYS HB2 H -3.473 1.541 3.289 1.00 . A A . 27 LYS HB2 1 1 16 7609 1 1 27 LYS HB3 H -2.516 1.674 4.763 1.00 . A A . 27 LYS HB3 1 1 16 7610 1 1 27 LYS HD2 H -4.334 4.973 2.881 1.00 . A A . 27 LYS HD2 1 1 16 7611 1 1 27 LYS HD3 H -3.711 3.674 1.866 1.00 . A A . 27 LYS HD3 1 1 16 7612 1 1 27 LYS HE2 H -5.376 2.675 4.050 1.00 . A A . 27 LYS HE2 1 1 16 7613 1 1 27 LYS HE3 H -6.250 3.781 2.992 1.00 . A A . 27 LYS HE3 1 1 16 7614 1 1 27 LYS HG2 H -3.538 3.715 4.894 1.00 . A A . 27 LYS HG2 1 1 16 7615 1 1 27 LYS HG3 H -2.230 4.192 3.820 1.00 . A A . 27 LYS HG3 1 1 16 7616 1 1 27 LYS HZ1 H -6.287 2.303 1.361 1.00 . A A . 27 LYS HZ1 1 1 16 7617 1 1 27 LYS HZ2 H -5.726 1.134 2.503 1.00 . A A . 27 LYS HZ2 1 1 16 7618 1 1 27 LYS HZ3 H -4.592 1.959 1.504 1.00 . A A . 27 LYS HZ3 1 1 16 7619 1 1 27 LYS N N -1.353 3.025 1.926 1.00 . A A . 27 LYS N 1 1 16 7620 1 1 27 LYS NZ N -5.508 2.050 2.036 1.00 . A A . 27 LYS NZ 1 1 16 7621 1 1 27 LYS O O -1.648 0.439 1.133 1.00 . A A . 27 LYS O 1 1 16 7622 1 1 28 CYS C C -2.049 -2.572 3.048 1.00 . A A . 28 CYS C 1 1 16 7623 1 1 28 CYS CA C -0.829 -1.765 2.592 1.00 . A A . 28 CYS CA 1 1 16 7624 1 1 28 CYS CB C 0.464 -2.429 3.081 1.00 . A A . 28 CYS CB 1 1 16 7625 1 1 28 CYS H H -0.688 -0.212 4.029 1.00 . A A . 28 CYS H 1 1 16 7626 1 1 28 CYS HA H -0.809 -1.734 1.519 1.00 . A A . 28 CYS HA 1 1 16 7627 1 1 28 CYS HB2 H 1.168 -1.668 3.385 1.00 . A A . 28 CYS HB2 1 1 16 7628 1 1 28 CYS HB3 H 0.250 -3.076 3.917 1.00 . A A . 28 CYS HB3 1 1 16 7629 1 1 28 CYS N N -0.920 -0.397 3.097 1.00 . A A . 28 CYS N 1 1 16 7630 1 1 28 CYS O O -1.993 -3.279 4.056 1.00 . A A . 28 CYS O 1 1 16 7631 1 1 28 CYS SG S 1.175 -3.403 1.724 1.00 . A A . 28 CYS SG 1 1 16 7632 1 1 29 ASN C C -5.009 -3.879 1.452 1.00 . A A . 29 ASN C 1 1 16 7633 1 1 29 ASN CA C -4.387 -3.180 2.664 1.00 . A A . 29 ASN CA 1 1 16 7634 1 1 29 ASN CB C -5.430 -2.231 3.280 1.00 . A A . 29 ASN CB 1 1 16 7635 1 1 29 ASN CG C -4.810 -0.899 3.675 1.00 . A A . 29 ASN CG 1 1 16 7636 1 1 29 ASN H H -3.147 -1.879 1.512 1.00 . A A . 29 ASN H 1 1 16 7637 1 1 29 ASN HA H -4.139 -3.930 3.397 1.00 . A A . 29 ASN HA 1 1 16 7638 1 1 29 ASN HB2 H -6.213 -2.049 2.560 1.00 . A A . 29 ASN HB2 1 1 16 7639 1 1 29 ASN HB3 H -5.856 -2.694 4.157 1.00 . A A . 29 ASN HB3 1 1 16 7640 1 1 29 ASN HD21 H -3.421 -1.710 4.834 1.00 . A A . 29 ASN HD21 1 1 16 7641 1 1 29 ASN HD22 H -3.396 -0.015 4.740 1.00 . A A . 29 ASN HD22 1 1 16 7642 1 1 29 ASN N N -3.157 -2.457 2.306 1.00 . A A . 29 ASN N 1 1 16 7643 1 1 29 ASN ND2 N -3.790 -0.872 4.482 1.00 . A A . 29 ASN ND2 1 1 16 7644 1 1 29 ASN O O -5.132 -3.300 0.375 1.00 . A A . 29 ASN O 1 1 16 7645 1 1 29 ASN OD1 O -5.282 0.150 3.242 1.00 . A A . 29 ASN OD1 1 1 16 7646 1 1 30 ILE C C -7.494 -5.469 0.355 1.00 . A A . 30 ILE C 1 1 16 7647 1 1 30 ILE CA C -6.057 -5.916 0.592 1.00 . A A . 30 ILE CA 1 1 16 7648 1 1 30 ILE CB C -6.025 -7.424 0.911 1.00 . A A . 30 ILE CB 1 1 16 7649 1 1 30 ILE CD1 C -4.214 -7.366 2.618 1.00 . A A . 30 ILE CD1 1 1 16 7650 1 1 30 ILE CG1 C -5.701 -7.645 2.390 1.00 . A A . 30 ILE CG1 1 1 16 7651 1 1 30 ILE CG2 C -4.975 -8.125 0.042 1.00 . A A . 30 ILE CG2 1 1 16 7652 1 1 30 ILE H H -5.313 -5.524 2.540 1.00 . A A . 30 ILE H 1 1 16 7653 1 1 30 ILE HA H -5.504 -5.753 -0.321 1.00 . A A . 30 ILE HA 1 1 16 7654 1 1 30 ILE HB H -6.994 -7.847 0.696 1.00 . A A . 30 ILE HB 1 1 16 7655 1 1 30 ILE HD11 H -4.081 -6.865 3.562 1.00 . A A . 30 ILE HD11 1 1 16 7656 1 1 30 ILE HD12 H -3.843 -6.738 1.820 1.00 . A A . 30 ILE HD12 1 1 16 7657 1 1 30 ILE HD13 H -3.672 -8.298 2.619 1.00 . A A . 30 ILE HD13 1 1 16 7658 1 1 30 ILE HG12 H -6.298 -6.980 2.999 1.00 . A A . 30 ILE HG12 1 1 16 7659 1 1 30 ILE HG13 H -5.917 -8.669 2.657 1.00 . A A . 30 ILE HG13 1 1 16 7660 1 1 30 ILE HG21 H -4.251 -7.406 -0.305 1.00 . A A . 30 ILE HG21 1 1 16 7661 1 1 30 ILE HG22 H -5.460 -8.584 -0.807 1.00 . A A . 30 ILE HG22 1 1 16 7662 1 1 30 ILE HG23 H -4.475 -8.886 0.623 1.00 . A A . 30 ILE HG23 1 1 16 7663 1 1 30 ILE N N -5.422 -5.127 1.653 1.00 . A A . 30 ILE N 1 1 16 7664 1 1 30 ILE O O -8.207 -5.093 1.285 1.00 . A A . 30 ILE O 1 1 16 7665 1 1 31 GLY C C -9.226 -3.843 -2.156 1.00 . A A . 31 GLY C 1 1 16 7666 1 1 31 GLY CA C -9.251 -5.107 -1.304 1.00 . A A . 31 GLY CA 1 1 16 7667 1 1 31 GLY H H -7.271 -5.821 -1.590 1.00 . A A . 31 GLY H 1 1 16 7668 1 1 31 GLY HA2 H -9.711 -5.905 -1.868 1.00 . A A . 31 GLY HA2 1 1 16 7669 1 1 31 GLY HA3 H -9.834 -4.918 -0.419 1.00 . A A . 31 GLY HA3 1 1 16 7670 1 1 31 GLY N N -7.898 -5.510 -0.908 1.00 . A A . 31 GLY N 1 1 16 7671 1 1 31 GLY O O -10.169 -3.563 -2.896 1.00 . A A . 31 GLY O 1 1 16 7672 1 1 32 LYS C C -6.660 -1.927 -3.618 1.00 . A A . 32 LYS C 1 1 16 7673 1 1 32 LYS CA C -7.970 -1.872 -2.832 1.00 . A A . 32 LYS CA 1 1 16 7674 1 1 32 LYS CB C -7.969 -0.660 -1.893 1.00 . A A . 32 LYS CB 1 1 16 7675 1 1 32 LYS CD C -7.200 1.264 -3.305 1.00 . A A . 32 LYS CD 1 1 16 7676 1 1 32 LYS CE C -7.647 2.074 -4.524 1.00 . A A . 32 LYS CE 1 1 16 7677 1 1 32 LYS CG C -8.416 0.592 -2.657 1.00 . A A . 32 LYS CG 1 1 16 7678 1 1 32 LYS H H -7.416 -3.385 -1.460 1.00 . A A . 32 LYS H 1 1 16 7679 1 1 32 LYS HA H -8.792 -1.782 -3.524 1.00 . A A . 32 LYS HA 1 1 16 7680 1 1 32 LYS HB2 H -8.651 -0.843 -1.073 1.00 . A A . 32 LYS HB2 1 1 16 7681 1 1 32 LYS HB3 H -6.974 -0.506 -1.502 1.00 . A A . 32 LYS HB3 1 1 16 7682 1 1 32 LYS HD2 H -6.729 1.923 -2.590 1.00 . A A . 32 LYS HD2 1 1 16 7683 1 1 32 LYS HD3 H -6.492 0.512 -3.617 1.00 . A A . 32 LYS HD3 1 1 16 7684 1 1 32 LYS HE2 H -8.524 1.617 -4.961 1.00 . A A . 32 LYS HE2 1 1 16 7685 1 1 32 LYS HE3 H -7.881 3.085 -4.219 1.00 . A A . 32 LYS HE3 1 1 16 7686 1 1 32 LYS HG2 H -9.127 0.313 -3.421 1.00 . A A . 32 LYS HG2 1 1 16 7687 1 1 32 LYS HG3 H -8.882 1.284 -1.970 1.00 . A A . 32 LYS HG3 1 1 16 7688 1 1 32 LYS HZ1 H -6.650 2.922 -6.148 1.00 . A A . 32 LYS HZ1 1 1 16 7689 1 1 32 LYS HZ2 H -6.565 1.216 -6.104 1.00 . A A . 32 LYS HZ2 1 1 16 7690 1 1 32 LYS HZ3 H -5.610 2.159 -5.021 1.00 . A A . 32 LYS HZ3 1 1 16 7691 1 1 32 LYS N N -8.133 -3.099 -2.057 1.00 . A A . 32 LYS N 1 1 16 7692 1 1 32 LYS NZ N -6.544 2.098 -5.526 1.00 . A A . 32 LYS NZ 1 1 16 7693 1 1 32 LYS O O -5.584 -2.023 -3.033 1.00 . A A . 32 LYS O 1 1 16 7694 1 1 33 LYS C C -5.292 -0.599 -6.468 1.00 . A A . 33 LYS C 1 1 16 7695 1 1 33 LYS CA C -5.560 -1.939 -5.786 1.00 . A A . 33 LYS CA 1 1 16 7696 1 1 33 LYS CB C -5.730 -3.034 -6.849 1.00 . A A . 33 LYS CB 1 1 16 7697 1 1 33 LYS CD C -4.223 -2.693 -8.829 1.00 . A A . 33 LYS CD 1 1 16 7698 1 1 33 LYS CE C -2.815 -2.931 -9.386 1.00 . A A . 33 LYS CE 1 1 16 7699 1 1 33 LYS CG C -4.367 -3.384 -7.466 1.00 . A A . 33 LYS CG 1 1 16 7700 1 1 33 LYS H H -7.639 -1.814 -5.365 1.00 . A A . 33 LYS H 1 1 16 7701 1 1 33 LYS HA H -4.708 -2.188 -5.165 1.00 . A A . 33 LYS HA 1 1 16 7702 1 1 33 LYS HB2 H -6.152 -3.915 -6.388 1.00 . A A . 33 LYS HB2 1 1 16 7703 1 1 33 LYS HB3 H -6.394 -2.681 -7.624 1.00 . A A . 33 LYS HB3 1 1 16 7704 1 1 33 LYS HD2 H -4.955 -3.095 -9.516 1.00 . A A . 33 LYS HD2 1 1 16 7705 1 1 33 LYS HD3 H -4.386 -1.631 -8.715 1.00 . A A . 33 LYS HD3 1 1 16 7706 1 1 33 LYS HE2 H -2.151 -3.209 -8.578 1.00 . A A . 33 LYS HE2 1 1 16 7707 1 1 33 LYS HE3 H -2.846 -3.729 -10.115 1.00 . A A . 33 LYS HE3 1 1 16 7708 1 1 33 LYS HG2 H -3.576 -3.055 -6.808 1.00 . A A . 33 LYS HG2 1 1 16 7709 1 1 33 LYS HG3 H -4.299 -4.454 -7.600 1.00 . A A . 33 LYS HG3 1 1 16 7710 1 1 33 LYS HZ1 H -1.881 -1.053 -9.294 1.00 . A A . 33 LYS HZ1 1 1 16 7711 1 1 33 LYS HZ2 H -3.113 -1.170 -10.469 1.00 . A A . 33 LYS HZ2 1 1 16 7712 1 1 33 LYS HZ3 H -1.612 -1.912 -10.755 1.00 . A A . 33 LYS HZ3 1 1 16 7713 1 1 33 LYS N N -6.756 -1.880 -4.945 1.00 . A A . 33 LYS N 1 1 16 7714 1 1 33 LYS NZ N -2.320 -1.681 -10.032 1.00 . A A . 33 LYS NZ 1 1 16 7715 1 1 33 LYS O O -6.217 0.183 -6.728 1.00 . A A . 33 LYS O 1 1 16 7716 1 1 34 ASP C C -2.688 0.530 -8.599 1.00 . A A . 34 ASP C 1 1 16 7717 1 1 34 ASP CA C -3.601 0.873 -7.422 1.00 . A A . 34 ASP CA 1 1 16 7718 1 1 34 ASP CB C -2.864 1.774 -6.425 1.00 . A A . 34 ASP CB 1 1 16 7719 1 1 34 ASP CG C -3.854 2.695 -5.727 1.00 . A A . 34 ASP CG 1 1 16 7720 1 1 34 ASP H H -3.344 -1.020 -6.527 1.00 . A A . 34 ASP H 1 1 16 7721 1 1 34 ASP HA H -4.471 1.393 -7.794 1.00 . A A . 34 ASP HA 1 1 16 7722 1 1 34 ASP HB2 H -2.365 1.162 -5.690 1.00 . A A . 34 ASP HB2 1 1 16 7723 1 1 34 ASP HB3 H -2.135 2.369 -6.952 1.00 . A A . 34 ASP HB3 1 1 16 7724 1 1 34 ASP N N -4.021 -0.354 -6.760 1.00 . A A . 34 ASP N 1 1 16 7725 1 1 34 ASP O O -1.694 -0.155 -8.384 1.00 . A A . 34 ASP O 1 1 16 7726 1 1 34 ASP OXT O -3.008 0.917 -9.710 1.00 . A A . 34 ASP OXT 1 1 16 7727 1 1 34 ASP OD1 O -4.389 2.298 -4.696 1.00 . A A . 34 ASP OD1 1 1 16 7728 1 1 34 ASP OD2 O -4.088 3.776 -6.235 1.00 . A A . 34 ASP OD2 1 1 17 7729 1 1 1 GLY C C -0.161 7.344 -8.023 1.00 . A A . 1 GLY C 1 1 17 7730 1 1 1 GLY CA C -0.945 6.275 -8.782 1.00 . A A . 1 GLY CA 1 1 17 7731 1 1 1 GLY H1 H -0.972 4.186 -8.909 1.00 . A A . 1 GLY H1 1 1 17 7732 1 1 1 GLY H2 H -0.092 4.798 -7.570 1.00 . A A . 1 GLY H2 1 1 17 7733 1 1 1 GLY H3 H 0.569 4.882 -9.144 1.00 . A A . 1 GLY H3 1 1 17 7734 1 1 1 GLY HA2 H -0.955 6.520 -9.835 1.00 . A A . 1 GLY HA2 1 1 17 7735 1 1 1 GLY HA3 H -1.959 6.249 -8.413 1.00 . A A . 1 GLY HA3 1 1 17 7736 1 1 1 GLY N N -0.307 4.939 -8.591 1.00 . A A . 1 GLY N 1 1 17 7737 1 1 1 GLY O O 0.382 8.264 -8.630 1.00 . A A . 1 GLY O 1 1 17 7738 1 1 2 SER C C 2.073 7.764 -5.655 1.00 . A A . 2 SER C 1 1 17 7739 1 1 2 SER CA C 0.626 8.201 -5.880 1.00 . A A . 2 SER CA 1 1 17 7740 1 1 2 SER CB C -0.071 8.402 -4.528 1.00 . A A . 2 SER CB 1 1 17 7741 1 1 2 SER H H -0.556 6.464 -6.258 1.00 . A A . 2 SER H 1 1 17 7742 1 1 2 SER HA H 0.634 9.147 -6.403 1.00 . A A . 2 SER HA 1 1 17 7743 1 1 2 SER HB2 H -1.057 8.809 -4.686 1.00 . A A . 2 SER HB2 1 1 17 7744 1 1 2 SER HB3 H -0.156 7.448 -4.024 1.00 . A A . 2 SER HB3 1 1 17 7745 1 1 2 SER HG H 0.088 10.024 -3.413 1.00 . A A . 2 SER HG 1 1 17 7746 1 1 2 SER N N -0.104 7.222 -6.695 1.00 . A A . 2 SER N 1 1 17 7747 1 1 2 SER O O 2.577 6.860 -6.325 1.00 . A A . 2 SER O 1 1 17 7748 1 1 2 SER OG O 0.692 9.312 -3.733 1.00 . A A . 2 SER OG 1 1 17 7749 1 1 3 VAL C C 4.198 7.126 -3.219 1.00 . A A . 3 VAL C 1 1 17 7750 1 1 3 VAL CA C 4.128 8.110 -4.379 1.00 . A A . 3 VAL CA 1 1 17 7751 1 1 3 VAL CB C 4.897 9.392 -4.014 1.00 . A A . 3 VAL CB 1 1 17 7752 1 1 3 VAL CG1 C 5.969 9.665 -5.070 1.00 . A A . 3 VAL CG1 1 1 17 7753 1 1 3 VAL CG2 C 3.939 10.588 -3.954 1.00 . A A . 3 VAL CG2 1 1 17 7754 1 1 3 VAL H H 2.262 9.128 -4.204 1.00 . A A . 3 VAL H 1 1 17 7755 1 1 3 VAL HA H 4.595 7.658 -5.242 1.00 . A A . 3 VAL HA 1 1 17 7756 1 1 3 VAL HB H 5.373 9.262 -3.049 1.00 . A A . 3 VAL HB 1 1 17 7757 1 1 3 VAL HG11 H 6.632 10.443 -4.718 1.00 . A A . 3 VAL HG11 1 1 17 7758 1 1 3 VAL HG12 H 5.497 9.984 -5.989 1.00 . A A . 3 VAL HG12 1 1 17 7759 1 1 3 VAL HG13 H 6.537 8.765 -5.251 1.00 . A A . 3 VAL HG13 1 1 17 7760 1 1 3 VAL HG21 H 3.380 10.648 -4.878 1.00 . A A . 3 VAL HG21 1 1 17 7761 1 1 3 VAL HG22 H 4.507 11.496 -3.818 1.00 . A A . 3 VAL HG22 1 1 17 7762 1 1 3 VAL HG23 H 3.254 10.463 -3.127 1.00 . A A . 3 VAL HG23 1 1 17 7763 1 1 3 VAL N N 2.732 8.418 -4.704 1.00 . A A . 3 VAL N 1 1 17 7764 1 1 3 VAL O O 4.595 5.971 -3.391 1.00 . A A . 3 VAL O 1 1 17 7765 1 1 4 GLY C C 3.330 5.320 -1.234 1.00 . A A . 4 GLY C 1 1 17 7766 1 1 4 GLY CA C 3.810 6.712 -0.858 1.00 . A A . 4 GLY CA 1 1 17 7767 1 1 4 GLY H H 3.481 8.503 -1.953 1.00 . A A . 4 GLY H 1 1 17 7768 1 1 4 GLY HA2 H 4.816 6.650 -0.469 1.00 . A A . 4 GLY HA2 1 1 17 7769 1 1 4 GLY HA3 H 3.158 7.118 -0.102 1.00 . A A . 4 GLY HA3 1 1 17 7770 1 1 4 GLY N N 3.798 7.578 -2.034 1.00 . A A . 4 GLY N 1 1 17 7771 1 1 4 GLY O O 3.860 4.321 -0.761 1.00 . A A . 4 GLY O 1 1 17 7772 1 1 5 CYS C C 2.852 3.136 -3.220 1.00 . A A . 5 CYS C 1 1 17 7773 1 1 5 CYS CA C 1.777 4.001 -2.565 1.00 . A A . 5 CYS CA 1 1 17 7774 1 1 5 CYS CB C 0.622 4.241 -3.539 1.00 . A A . 5 CYS CB 1 1 17 7775 1 1 5 CYS H H 1.958 6.105 -2.457 1.00 . A A . 5 CYS H 1 1 17 7776 1 1 5 CYS HA H 1.396 3.472 -1.708 1.00 . A A . 5 CYS HA 1 1 17 7777 1 1 5 CYS HB2 H 0.521 5.299 -3.732 1.00 . A A . 5 CYS HB2 1 1 17 7778 1 1 5 CYS HB3 H 0.817 3.721 -4.465 1.00 . A A . 5 CYS HB3 1 1 17 7779 1 1 5 CYS N N 2.327 5.271 -2.108 1.00 . A A . 5 CYS N 1 1 17 7780 1 1 5 CYS O O 2.649 1.942 -3.424 1.00 . A A . 5 CYS O 1 1 17 7781 1 1 5 CYS SG S -0.908 3.608 -2.805 1.00 . A A . 5 CYS SG 1 1 17 7782 1 1 6 ALA C C 6.049 2.570 -2.971 1.00 . A A . 6 ALA C 1 1 17 7783 1 1 6 ALA CA C 5.117 3.000 -4.101 1.00 . A A . 6 ALA CA 1 1 17 7784 1 1 6 ALA CB C 5.861 3.880 -5.110 1.00 . A A . 6 ALA CB 1 1 17 7785 1 1 6 ALA H H 4.117 4.695 -3.310 1.00 . A A . 6 ALA H 1 1 17 7786 1 1 6 ALA HA H 4.741 2.121 -4.600 1.00 . A A . 6 ALA HA 1 1 17 7787 1 1 6 ALA HB1 H 6.598 3.288 -5.632 1.00 . A A . 6 ALA HB1 1 1 17 7788 1 1 6 ALA HB2 H 6.351 4.688 -4.590 1.00 . A A . 6 ALA HB2 1 1 17 7789 1 1 6 ALA HB3 H 5.156 4.287 -5.821 1.00 . A A . 6 ALA HB3 1 1 17 7790 1 1 6 ALA N N 4.002 3.735 -3.515 1.00 . A A . 6 ALA N 1 1 17 7791 1 1 6 ALA O O 6.499 1.422 -2.904 1.00 . A A . 6 ALA O 1 1 17 7792 1 1 7 GLU C C 6.364 2.254 0.045 1.00 . A A . 7 GLU C 1 1 17 7793 1 1 7 GLU CA C 7.121 3.204 -0.888 1.00 . A A . 7 GLU CA 1 1 17 7794 1 1 7 GLU CB C 7.463 4.501 -0.141 1.00 . A A . 7 GLU CB 1 1 17 7795 1 1 7 GLU CD C 7.586 6.147 -2.033 1.00 . A A . 7 GLU CD 1 1 17 7796 1 1 7 GLU CG C 8.391 5.367 -1.001 1.00 . A A . 7 GLU CG 1 1 17 7797 1 1 7 GLU H H 5.875 4.384 -2.144 1.00 . A A . 7 GLU H 1 1 17 7798 1 1 7 GLU HA H 8.034 2.731 -1.212 1.00 . A A . 7 GLU HA 1 1 17 7799 1 1 7 GLU HB2 H 6.553 5.046 0.070 1.00 . A A . 7 GLU HB2 1 1 17 7800 1 1 7 GLU HB3 H 7.960 4.260 0.787 1.00 . A A . 7 GLU HB3 1 1 17 7801 1 1 7 GLU HG2 H 8.923 6.061 -0.367 1.00 . A A . 7 GLU HG2 1 1 17 7802 1 1 7 GLU HG3 H 9.102 4.734 -1.511 1.00 . A A . 7 GLU HG3 1 1 17 7803 1 1 7 GLU N N 6.289 3.496 -2.051 1.00 . A A . 7 GLU N 1 1 17 7804 1 1 7 GLU O O 6.942 1.337 0.634 1.00 . A A . 7 GLU O 1 1 17 7805 1 1 7 GLU OE1 O 6.871 7.054 -1.641 1.00 . A A . 7 GLU OE1 1 1 17 7806 1 1 7 GLU OE2 O 7.697 5.824 -3.202 1.00 . A A . 7 GLU OE2 1 1 17 7807 1 1 8 CYS C C 4.471 0.170 0.759 1.00 . A A . 8 CYS C 1 1 17 7808 1 1 8 CYS CA C 4.201 1.655 1.003 1.00 . A A . 8 CYS CA 1 1 17 7809 1 1 8 CYS CB C 2.727 1.970 0.738 1.00 . A A . 8 CYS CB 1 1 17 7810 1 1 8 CYS H H 4.660 3.230 -0.343 1.00 . A A . 8 CYS H 1 1 17 7811 1 1 8 CYS HA H 4.418 1.880 2.032 1.00 . A A . 8 CYS HA 1 1 17 7812 1 1 8 CYS HB2 H 2.649 2.700 -0.051 1.00 . A A . 8 CYS HB2 1 1 17 7813 1 1 8 CYS HB3 H 2.206 1.072 0.448 1.00 . A A . 8 CYS HB3 1 1 17 7814 1 1 8 CYS N N 5.058 2.483 0.158 1.00 . A A . 8 CYS N 1 1 17 7815 1 1 8 CYS O O 4.855 -0.551 1.679 1.00 . A A . 8 CYS O 1 1 17 7816 1 1 8 CYS SG S 1.982 2.633 2.247 1.00 . A A . 8 CYS SG 1 1 17 7817 1 1 9 PRO C C 6.014 -2.078 -0.507 1.00 . A A . 9 PRO C 1 1 17 7818 1 1 9 PRO CA C 4.560 -1.724 -0.796 1.00 . A A . 9 PRO CA 1 1 17 7819 1 1 9 PRO CB C 4.231 -1.833 -2.292 1.00 . A A . 9 PRO CB 1 1 17 7820 1 1 9 PRO CD C 3.845 0.463 -1.627 1.00 . A A . 9 PRO CD 1 1 17 7821 1 1 9 PRO CG C 4.214 -0.434 -2.806 1.00 . A A . 9 PRO CG 1 1 17 7822 1 1 9 PRO HA H 3.902 -2.365 -0.234 1.00 . A A . 9 PRO HA 1 1 17 7823 1 1 9 PRO HB2 H 4.992 -2.411 -2.800 1.00 . A A . 9 PRO HB2 1 1 17 7824 1 1 9 PRO HB3 H 3.262 -2.287 -2.428 1.00 . A A . 9 PRO HB3 1 1 17 7825 1 1 9 PRO HD2 H 4.361 1.408 -1.696 1.00 . A A . 9 PRO HD2 1 1 17 7826 1 1 9 PRO HD3 H 2.778 0.612 -1.583 1.00 . A A . 9 PRO HD3 1 1 17 7827 1 1 9 PRO HG2 H 5.190 -0.173 -3.187 1.00 . A A . 9 PRO HG2 1 1 17 7828 1 1 9 PRO HG3 H 3.475 -0.334 -3.584 1.00 . A A . 9 PRO HG3 1 1 17 7829 1 1 9 PRO N N 4.300 -0.298 -0.457 1.00 . A A . 9 PRO N 1 1 17 7830 1 1 9 PRO O O 6.309 -3.142 0.041 1.00 . A A . 9 PRO O 1 1 17 7831 1 1 10 MET C C 8.539 -1.650 0.913 1.00 . A A . 10 MET C 1 1 17 7832 1 1 10 MET CA C 8.336 -1.375 -0.577 1.00 . A A . 10 MET CA 1 1 17 7833 1 1 10 MET CB C 9.139 -0.144 -1.001 1.00 . A A . 10 MET CB 1 1 17 7834 1 1 10 MET CE C 10.841 0.496 -4.631 1.00 . A A . 10 MET CE 1 1 17 7835 1 1 10 MET CG C 9.224 -0.089 -2.528 1.00 . A A . 10 MET CG 1 1 17 7836 1 1 10 MET H H 6.630 -0.313 -1.256 1.00 . A A . 10 MET H 1 1 17 7837 1 1 10 MET HA H 8.676 -2.230 -1.140 1.00 . A A . 10 MET HA 1 1 17 7838 1 1 10 MET HB2 H 8.652 0.748 -0.636 1.00 . A A . 10 MET HB2 1 1 17 7839 1 1 10 MET HB3 H 10.132 -0.204 -0.590 1.00 . A A . 10 MET HB3 1 1 17 7840 1 1 10 MET HE1 H 9.941 0.196 -5.150 1.00 . A A . 10 MET HE1 1 1 17 7841 1 1 10 MET HE2 H 11.708 0.246 -5.226 1.00 . A A . 10 MET HE2 1 1 17 7842 1 1 10 MET HE3 H 10.819 1.561 -4.463 1.00 . A A . 10 MET HE3 1 1 17 7843 1 1 10 MET HG2 H 8.592 -0.855 -2.954 1.00 . A A . 10 MET HG2 1 1 17 7844 1 1 10 MET HG3 H 8.896 0.880 -2.875 1.00 . A A . 10 MET HG3 1 1 17 7845 1 1 10 MET N N 6.921 -1.158 -0.844 1.00 . A A . 10 MET N 1 1 17 7846 1 1 10 MET O O 9.321 -2.520 1.297 1.00 . A A . 10 MET O 1 1 17 7847 1 1 10 MET SD S 10.936 -0.367 -3.043 1.00 . A A . 10 MET SD 1 1 17 7848 1 1 11 HIS C C 6.698 -1.959 3.668 1.00 . A A . 11 HIS C 1 1 17 7849 1 1 11 HIS CA C 7.874 -1.097 3.195 1.00 . A A . 11 HIS CA 1 1 17 7850 1 1 11 HIS CB C 7.843 0.271 3.892 1.00 . A A . 11 HIS CB 1 1 17 7851 1 1 11 HIS CD2 C 9.860 0.951 5.436 1.00 . A A . 11 HIS CD2 1 1 17 7852 1 1 11 HIS CE1 C 9.460 -0.392 7.089 1.00 . A A . 11 HIS CE1 1 1 17 7853 1 1 11 HIS CG C 8.732 0.241 5.107 1.00 . A A . 11 HIS CG 1 1 17 7854 1 1 11 HIS H H 7.181 -0.251 1.371 1.00 . A A . 11 HIS H 1 1 17 7855 1 1 11 HIS HA H 8.798 -1.598 3.443 1.00 . A A . 11 HIS HA 1 1 17 7856 1 1 11 HIS HB2 H 8.197 1.030 3.209 1.00 . A A . 11 HIS HB2 1 1 17 7857 1 1 11 HIS HB3 H 6.832 0.503 4.192 1.00 . A A . 11 HIS HB3 1 1 17 7858 1 1 11 HIS HD2 H 10.320 1.707 4.817 1.00 . A A . 11 HIS HD2 1 1 17 7859 1 1 11 HIS HE1 H 9.532 -0.914 8.032 1.00 . A A . 11 HIS HE1 1 1 17 7860 1 1 11 HIS HE2 H 11.106 0.885 7.167 1.00 . A A . 11 HIS HE2 1 1 17 7861 1 1 11 HIS N N 7.802 -0.917 1.744 1.00 . A A . 11 HIS N 1 1 17 7862 1 1 11 HIS ND1 N 8.496 -0.609 6.178 1.00 . A A . 11 HIS ND1 1 1 17 7863 1 1 11 HIS NE2 N 10.319 0.550 6.687 1.00 . A A . 11 HIS NE2 1 1 17 7864 1 1 11 HIS O O 6.069 -1.684 4.696 1.00 . A A . 11 HIS O 1 1 17 7865 1 1 12 CYS C C 5.779 -5.169 3.910 1.00 . A A . 12 CYS C 1 1 17 7866 1 1 12 CYS CA C 5.298 -3.909 3.203 1.00 . A A . 12 CYS CA 1 1 17 7867 1 1 12 CYS CB C 4.567 -4.296 1.927 1.00 . A A . 12 CYS CB 1 1 17 7868 1 1 12 CYS H H 6.943 -3.159 2.088 1.00 . A A . 12 CYS H 1 1 17 7869 1 1 12 CYS HA H 4.603 -3.396 3.850 1.00 . A A . 12 CYS HA 1 1 17 7870 1 1 12 CYS HB2 H 4.481 -3.434 1.290 1.00 . A A . 12 CYS HB2 1 1 17 7871 1 1 12 CYS HB3 H 5.114 -5.074 1.419 1.00 . A A . 12 CYS HB3 1 1 17 7872 1 1 12 CYS N N 6.406 -3.001 2.897 1.00 . A A . 12 CYS N 1 1 17 7873 1 1 12 CYS O O 6.880 -5.654 3.663 1.00 . A A . 12 CYS O 1 1 17 7874 1 1 12 CYS SG S 2.919 -4.895 2.351 1.00 . A A . 12 CYS SG 1 1 17 7875 1 1 13 LYS C C 4.681 -8.136 4.980 1.00 . A A . 13 LYS C 1 1 17 7876 1 1 13 LYS CA C 5.293 -6.864 5.585 1.00 . A A . 13 LYS CA 1 1 17 7877 1 1 13 LYS CB C 4.818 -6.691 7.032 1.00 . A A . 13 LYS CB 1 1 17 7878 1 1 13 LYS CD C 5.471 -4.307 7.517 1.00 . A A . 13 LYS CD 1 1 17 7879 1 1 13 LYS CE C 6.758 -3.542 7.184 1.00 . A A . 13 LYS CE 1 1 17 7880 1 1 13 LYS CG C 5.797 -5.784 7.795 1.00 . A A . 13 LYS CG 1 1 17 7881 1 1 13 LYS H H 4.088 -5.229 4.969 1.00 . A A . 13 LYS H 1 1 17 7882 1 1 13 LYS HA H 6.368 -6.971 5.589 1.00 . A A . 13 LYS HA 1 1 17 7883 1 1 13 LYS HB2 H 3.833 -6.246 7.038 1.00 . A A . 13 LYS HB2 1 1 17 7884 1 1 13 LYS HB3 H 4.777 -7.658 7.515 1.00 . A A . 13 LYS HB3 1 1 17 7885 1 1 13 LYS HD2 H 4.786 -4.237 6.685 1.00 . A A . 13 LYS HD2 1 1 17 7886 1 1 13 LYS HD3 H 5.014 -3.870 8.394 1.00 . A A . 13 LYS HD3 1 1 17 7887 1 1 13 LYS HE2 H 7.443 -3.613 8.018 1.00 . A A . 13 LYS HE2 1 1 17 7888 1 1 13 LYS HE3 H 7.217 -3.975 6.306 1.00 . A A . 13 LYS HE3 1 1 17 7889 1 1 13 LYS HG2 H 5.710 -5.978 8.855 1.00 . A A . 13 LYS HG2 1 1 17 7890 1 1 13 LYS HG3 H 6.807 -5.995 7.475 1.00 . A A . 13 LYS HG3 1 1 17 7891 1 1 13 LYS HZ1 H 5.603 -1.828 7.483 1.00 . A A . 13 LYS HZ1 1 1 17 7892 1 1 13 LYS HZ2 H 6.218 -1.971 5.899 1.00 . A A . 13 LYS HZ2 1 1 17 7893 1 1 13 LYS HZ3 H 7.247 -1.509 7.182 1.00 . A A . 13 LYS HZ3 1 1 17 7894 1 1 13 LYS N N 4.946 -5.674 4.812 1.00 . A A . 13 LYS N 1 1 17 7895 1 1 13 LYS NZ N 6.432 -2.107 6.923 1.00 . A A . 13 LYS NZ 1 1 17 7896 1 1 13 LYS O O 3.542 -8.147 4.506 1.00 . A A . 13 LYS O 1 1 17 7897 1 1 14 GLY C C 3.677 -10.930 4.898 1.00 . A A . 14 GLY C 1 1 17 7898 1 1 14 GLY CA C 5.077 -10.502 4.455 1.00 . A A . 14 GLY CA 1 1 17 7899 1 1 14 GLY H H 6.373 -9.110 5.386 1.00 . A A . 14 GLY H 1 1 17 7900 1 1 14 GLY HA2 H 5.098 -10.446 3.376 1.00 . A A . 14 GLY HA2 1 1 17 7901 1 1 14 GLY HA3 H 5.788 -11.250 4.777 1.00 . A A . 14 GLY HA3 1 1 17 7902 1 1 14 GLY N N 5.479 -9.202 5.000 1.00 . A A . 14 GLY N 1 1 17 7903 1 1 14 GLY O O 3.282 -10.710 6.041 1.00 . A A . 14 GLY O 1 1 17 7904 1 1 15 LYS C C 0.552 -11.124 3.570 1.00 . A A . 15 LYS C 1 1 17 7905 1 1 15 LYS CA C 1.592 -12.070 4.168 1.00 . A A . 15 LYS CA 1 1 17 7906 1 1 15 LYS CB C 1.305 -12.267 5.667 1.00 . A A . 15 LYS CB 1 1 17 7907 1 1 15 LYS CD C 0.155 -14.495 5.634 1.00 . A A . 15 LYS CD 1 1 17 7908 1 1 15 LYS CE C -1.146 -15.102 5.111 1.00 . A A . 15 LYS CE 1 1 17 7909 1 1 15 LYS CG C -0.033 -12.991 5.864 1.00 . A A . 15 LYS CG 1 1 17 7910 1 1 15 LYS H H 3.370 -11.691 3.081 1.00 . A A . 15 LYS H 1 1 17 7911 1 1 15 LYS HA H 1.507 -13.025 3.674 1.00 . A A . 15 LYS HA 1 1 17 7912 1 1 15 LYS HB2 H 2.098 -12.852 6.111 1.00 . A A . 15 LYS HB2 1 1 17 7913 1 1 15 LYS HB3 H 1.259 -11.303 6.153 1.00 . A A . 15 LYS HB3 1 1 17 7914 1 1 15 LYS HD2 H 0.942 -14.654 4.912 1.00 . A A . 15 LYS HD2 1 1 17 7915 1 1 15 LYS HD3 H 0.422 -14.970 6.566 1.00 . A A . 15 LYS HD3 1 1 17 7916 1 1 15 LYS HE2 H -1.093 -16.181 5.182 1.00 . A A . 15 LYS HE2 1 1 17 7917 1 1 15 LYS HE3 H -1.977 -14.746 5.704 1.00 . A A . 15 LYS HE3 1 1 17 7918 1 1 15 LYS HG2 H -0.385 -12.820 6.872 1.00 . A A . 15 LYS HG2 1 1 17 7919 1 1 15 LYS HG3 H -0.759 -12.606 5.163 1.00 . A A . 15 LYS HG3 1 1 17 7920 1 1 15 LYS HZ1 H -2.349 -14.702 3.455 1.00 . A A . 15 LYS HZ1 1 1 17 7921 1 1 15 LYS HZ2 H -0.837 -15.367 3.067 1.00 . A A . 15 LYS HZ2 1 1 17 7922 1 1 15 LYS HZ3 H -0.948 -13.738 3.546 1.00 . A A . 15 LYS HZ3 1 1 17 7923 1 1 15 LYS N N 2.958 -11.556 3.959 1.00 . A A . 15 LYS N 1 1 17 7924 1 1 15 LYS NZ N -1.335 -14.697 3.688 1.00 . A A . 15 LYS NZ 1 1 17 7925 1 1 15 LYS O O -0.526 -11.562 3.161 1.00 . A A . 15 LYS O 1 1 17 7926 1 1 16 MET C C 0.808 -7.787 2.168 1.00 . A A . 16 MET C 1 1 17 7927 1 1 16 MET CA C -0.007 -8.852 2.892 1.00 . A A . 16 MET CA 1 1 17 7928 1 1 16 MET CB C -0.860 -8.195 3.983 1.00 . A A . 16 MET CB 1 1 17 7929 1 1 16 MET CE C -2.630 -8.732 7.173 1.00 . A A . 16 MET CE 1 1 17 7930 1 1 16 MET CG C -1.775 -9.239 4.631 1.00 . A A . 16 MET CG 1 1 17 7931 1 1 16 MET H H 1.779 -9.556 3.802 1.00 . A A . 16 MET H 1 1 17 7932 1 1 16 MET HA H -0.656 -9.342 2.182 1.00 . A A . 16 MET HA 1 1 17 7933 1 1 16 MET HB2 H -0.213 -7.768 4.735 1.00 . A A . 16 MET HB2 1 1 17 7934 1 1 16 MET HB3 H -1.465 -7.415 3.546 1.00 . A A . 16 MET HB3 1 1 17 7935 1 1 16 MET HE1 H -2.221 -7.831 7.607 1.00 . A A . 16 MET HE1 1 1 17 7936 1 1 16 MET HE2 H -1.882 -9.513 7.182 1.00 . A A . 16 MET HE2 1 1 17 7937 1 1 16 MET HE3 H -3.482 -9.051 7.752 1.00 . A A . 16 MET HE3 1 1 17 7938 1 1 16 MET HG2 H -2.168 -9.898 3.871 1.00 . A A . 16 MET HG2 1 1 17 7939 1 1 16 MET HG3 H -1.210 -9.816 5.348 1.00 . A A . 16 MET HG3 1 1 17 7940 1 1 16 MET N N 0.893 -9.842 3.483 1.00 . A A . 16 MET N 1 1 17 7941 1 1 16 MET O O 1.321 -6.877 2.812 1.00 . A A . 16 MET O 1 1 17 7942 1 1 16 MET SD S -3.145 -8.398 5.468 1.00 . A A . 16 MET SD 1 1 17 7943 1 1 17 ALA C C 1.149 -6.471 -1.204 1.00 . A A . 17 ALA C 1 1 17 7944 1 1 17 ALA CA C 1.742 -6.889 0.134 1.00 . A A . 17 ALA CA 1 1 17 7945 1 1 17 ALA CB C 3.152 -7.405 -0.087 1.00 . A A . 17 ALA CB 1 1 17 7946 1 1 17 ALA H H 0.535 -8.632 0.362 1.00 . A A . 17 ALA H 1 1 17 7947 1 1 17 ALA HA H 1.807 -6.011 0.752 1.00 . A A . 17 ALA HA 1 1 17 7948 1 1 17 ALA HB1 H 3.462 -7.976 0.772 1.00 . A A . 17 ALA HB1 1 1 17 7949 1 1 17 ALA HB2 H 3.818 -6.566 -0.225 1.00 . A A . 17 ALA HB2 1 1 17 7950 1 1 17 ALA HB3 H 3.171 -8.029 -0.967 1.00 . A A . 17 ALA HB3 1 1 17 7951 1 1 17 ALA N N 0.947 -7.888 0.848 1.00 . A A . 17 ALA N 1 1 17 7952 1 1 17 ALA O O 1.261 -7.171 -2.213 1.00 . A A . 17 ALA O 1 1 17 7953 1 1 18 LYS C C -0.245 -3.183 -2.159 1.00 . A A . 18 LYS C 1 1 17 7954 1 1 18 LYS CA C 0.007 -4.683 -2.399 1.00 . A A . 18 LYS CA 1 1 17 7955 1 1 18 LYS CB C -1.260 -5.429 -2.855 1.00 . A A . 18 LYS CB 1 1 17 7956 1 1 18 LYS CD C -3.725 -5.246 -3.220 1.00 . A A . 18 LYS CD 1 1 17 7957 1 1 18 LYS CE C -3.573 -4.964 -4.718 1.00 . A A . 18 LYS CE 1 1 17 7958 1 1 18 LYS CG C -2.526 -4.676 -2.450 1.00 . A A . 18 LYS CG 1 1 17 7959 1 1 18 LYS H H 0.575 -4.780 -0.359 1.00 . A A . 18 LYS H 1 1 17 7960 1 1 18 LYS HA H 0.747 -4.770 -3.183 1.00 . A A . 18 LYS HA 1 1 17 7961 1 1 18 LYS HB2 H -1.237 -5.535 -3.928 1.00 . A A . 18 LYS HB2 1 1 17 7962 1 1 18 LYS HB3 H -1.271 -6.411 -2.404 1.00 . A A . 18 LYS HB3 1 1 17 7963 1 1 18 LYS HD2 H -3.780 -6.313 -3.060 1.00 . A A . 18 LYS HD2 1 1 17 7964 1 1 18 LYS HD3 H -4.632 -4.782 -2.861 1.00 . A A . 18 LYS HD3 1 1 17 7965 1 1 18 LYS HE2 H -4.479 -4.506 -5.092 1.00 . A A . 18 LYS HE2 1 1 17 7966 1 1 18 LYS HE3 H -2.741 -4.293 -4.878 1.00 . A A . 18 LYS HE3 1 1 17 7967 1 1 18 LYS HG2 H -2.685 -4.797 -1.390 1.00 . A A . 18 LYS HG2 1 1 17 7968 1 1 18 LYS HG3 H -2.421 -3.626 -2.682 1.00 . A A . 18 LYS HG3 1 1 17 7969 1 1 18 LYS HZ1 H -3.285 -6.073 -6.465 1.00 . A A . 18 LYS HZ1 1 1 17 7970 1 1 18 LYS HZ2 H -4.105 -6.915 -5.241 1.00 . A A . 18 LYS HZ2 1 1 17 7971 1 1 18 LYS HZ3 H -2.428 -6.666 -5.121 1.00 . A A . 18 LYS HZ3 1 1 17 7972 1 1 18 LYS N N 0.572 -5.285 -1.195 1.00 . A A . 18 LYS N 1 1 17 7973 1 1 18 LYS NZ N -3.329 -6.250 -5.440 1.00 . A A . 18 LYS NZ 1 1 17 7974 1 1 18 LYS O O -0.750 -2.784 -1.092 1.00 . A A . 18 LYS O 1 1 17 7975 1 1 19 PRO C C -1.457 -0.378 -2.907 1.00 . A A . 19 PRO C 1 1 17 7976 1 1 19 PRO CA C -0.010 -0.861 -3.013 1.00 . A A . 19 PRO CA 1 1 17 7977 1 1 19 PRO CB C 0.631 -0.343 -4.307 1.00 . A A . 19 PRO CB 1 1 17 7978 1 1 19 PRO CD C 0.730 -2.752 -4.399 1.00 . A A . 19 PRO CD 1 1 17 7979 1 1 19 PRO CG C 0.609 -1.494 -5.253 1.00 . A A . 19 PRO CG 1 1 17 7980 1 1 19 PRO HA H 0.557 -0.497 -2.172 1.00 . A A . 19 PRO HA 1 1 17 7981 1 1 19 PRO HB2 H 0.057 0.483 -4.704 1.00 . A A . 19 PRO HB2 1 1 17 7982 1 1 19 PRO HB3 H 1.648 -0.036 -4.124 1.00 . A A . 19 PRO HB3 1 1 17 7983 1 1 19 PRO HD2 H 0.178 -3.567 -4.847 1.00 . A A . 19 PRO HD2 1 1 17 7984 1 1 19 PRO HD3 H 1.766 -3.020 -4.261 1.00 . A A . 19 PRO HD3 1 1 17 7985 1 1 19 PRO HG2 H -0.322 -1.502 -5.805 1.00 . A A . 19 PRO HG2 1 1 17 7986 1 1 19 PRO HG3 H 1.445 -1.434 -5.934 1.00 . A A . 19 PRO HG3 1 1 17 7987 1 1 19 PRO N N 0.130 -2.354 -3.113 1.00 . A A . 19 PRO N 1 1 17 7988 1 1 19 PRO O O -2.322 -0.781 -3.686 1.00 . A A . 19 PRO O 1 1 17 7989 1 1 20 THR C C -2.910 2.500 -1.194 1.00 . A A . 20 THR C 1 1 17 7990 1 1 20 THR CA C -3.028 1.079 -1.733 1.00 . A A . 20 THR CA 1 1 17 7991 1 1 20 THR CB C -3.835 0.229 -0.750 1.00 . A A . 20 THR CB 1 1 17 7992 1 1 20 THR CG2 C -3.422 -1.232 -0.855 1.00 . A A . 20 THR CG2 1 1 17 7993 1 1 20 THR H H -0.960 0.800 -1.366 1.00 . A A . 20 THR H 1 1 17 7994 1 1 20 THR HA H -3.548 1.108 -2.676 1.00 . A A . 20 THR HA 1 1 17 7995 1 1 20 THR HB H -4.879 0.320 -0.979 1.00 . A A . 20 THR HB 1 1 17 7996 1 1 20 THR HG1 H -2.638 0.632 0.726 1.00 . A A . 20 THR HG1 1 1 17 7997 1 1 20 THR HG21 H -3.967 -1.803 -0.124 1.00 . A A . 20 THR HG21 1 1 17 7998 1 1 20 THR HG22 H -2.365 -1.322 -0.666 1.00 . A A . 20 THR HG22 1 1 17 7999 1 1 20 THR HG23 H -3.646 -1.604 -1.845 1.00 . A A . 20 THR HG23 1 1 17 8000 1 1 20 THR N N -1.698 0.509 -1.943 1.00 . A A . 20 THR N 1 1 17 8001 1 1 20 THR O O -2.109 2.767 -0.289 1.00 . A A . 20 THR O 1 1 17 8002 1 1 20 THR OG1 O -3.603 0.677 0.571 1.00 . A A . 20 THR OG1 1 1 17 8003 1 1 21 CYS C C -5.028 5.300 -0.913 1.00 . A A . 21 CYS C 1 1 17 8004 1 1 21 CYS CA C -3.645 4.809 -1.344 1.00 . A A . 21 CYS CA 1 1 17 8005 1 1 21 CYS CB C -3.152 5.670 -2.505 1.00 . A A . 21 CYS CB 1 1 17 8006 1 1 21 CYS H H -4.297 3.149 -2.488 1.00 . A A . 21 CYS H 1 1 17 8007 1 1 21 CYS HA H -2.961 4.910 -0.519 1.00 . A A . 21 CYS HA 1 1 17 8008 1 1 21 CYS HB2 H -3.984 6.198 -2.944 1.00 . A A . 21 CYS HB2 1 1 17 8009 1 1 21 CYS HB3 H -2.425 6.379 -2.143 1.00 . A A . 21 CYS HB3 1 1 17 8010 1 1 21 CYS N N -3.693 3.413 -1.763 1.00 . A A . 21 CYS N 1 1 17 8011 1 1 21 CYS O O -6.046 4.896 -1.478 1.00 . A A . 21 CYS O 1 1 17 8012 1 1 21 CYS SG S -2.384 4.607 -3.754 1.00 . A A . 21 CYS SG 1 1 17 8013 1 1 22 GLU C C -6.039 8.232 0.901 1.00 . A A . 22 GLU C 1 1 17 8014 1 1 22 GLU CA C -6.276 6.758 0.581 1.00 . A A . 22 GLU CA 1 1 17 8015 1 1 22 GLU CB C -6.765 5.997 1.827 1.00 . A A . 22 GLU CB 1 1 17 8016 1 1 22 GLU CD C -5.858 4.102 3.207 1.00 . A A . 22 GLU CD 1 1 17 8017 1 1 22 GLU CG C -5.579 5.503 2.670 1.00 . A A . 22 GLU CG 1 1 17 8018 1 1 22 GLU H H -4.199 6.473 0.471 1.00 . A A . 22 GLU H 1 1 17 8019 1 1 22 GLU HA H -7.032 6.689 -0.188 1.00 . A A . 22 GLU HA 1 1 17 8020 1 1 22 GLU HB2 H -7.382 6.652 2.426 1.00 . A A . 22 GLU HB2 1 1 17 8021 1 1 22 GLU HB3 H -7.352 5.150 1.509 1.00 . A A . 22 GLU HB3 1 1 17 8022 1 1 22 GLU HG2 H -4.687 5.475 2.066 1.00 . A A . 22 GLU HG2 1 1 17 8023 1 1 22 GLU HG3 H -5.426 6.175 3.501 1.00 . A A . 22 GLU HG3 1 1 17 8024 1 1 22 GLU N N -5.044 6.184 0.075 1.00 . A A . 22 GLU N 1 1 17 8025 1 1 22 GLU O O -5.245 8.570 1.774 1.00 . A A . 22 GLU O 1 1 17 8026 1 1 22 GLU OE1 O -5.585 3.145 2.499 1.00 . A A . 22 GLU OE1 1 1 17 8027 1 1 22 GLU OE2 O -6.331 4.002 4.327 1.00 . A A . 22 GLU OE2 1 1 17 8028 1 1 23 ASN C C -5.075 10.936 0.444 1.00 . A A . 23 ASN C 1 1 17 8029 1 1 23 ASN CA C -6.553 10.553 0.321 1.00 . A A . 23 ASN CA 1 1 17 8030 1 1 23 ASN CB C -7.348 11.051 1.538 1.00 . A A . 23 ASN CB 1 1 17 8031 1 1 23 ASN CG C -7.031 10.229 2.779 1.00 . A A . 23 ASN CG 1 1 17 8032 1 1 23 ASN H H -7.283 8.754 -0.551 1.00 . A A . 23 ASN H 1 1 17 8033 1 1 23 ASN HA H -6.948 11.036 -0.562 1.00 . A A . 23 ASN HA 1 1 17 8034 1 1 23 ASN HB2 H -7.101 12.084 1.727 1.00 . A A . 23 ASN HB2 1 1 17 8035 1 1 23 ASN HB3 H -8.401 10.973 1.323 1.00 . A A . 23 ASN HB3 1 1 17 8036 1 1 23 ASN HD21 H -5.298 11.125 3.101 1.00 . A A . 23 ASN HD21 1 1 17 8037 1 1 23 ASN HD22 H -5.712 9.915 4.217 1.00 . A A . 23 ASN HD22 1 1 17 8038 1 1 23 ASN N N -6.703 9.099 0.151 1.00 . A A . 23 ASN N 1 1 17 8039 1 1 23 ASN ND2 N -5.923 10.441 3.420 1.00 . A A . 23 ASN ND2 1 1 17 8040 1 1 23 ASN O O -4.666 11.624 1.381 1.00 . A A . 23 ASN O 1 1 17 8041 1 1 23 ASN OD1 O -7.816 9.372 3.177 1.00 . A A . 23 ASN OD1 1 1 17 8042 1 1 24 GLU C C -2.089 9.939 0.496 1.00 . A A . 24 GLU C 1 1 17 8043 1 1 24 GLU CA C -2.850 10.706 -0.581 1.00 . A A . 24 GLU CA 1 1 17 8044 1 1 24 GLU CB C -2.524 12.202 -0.512 1.00 . A A . 24 GLU CB 1 1 17 8045 1 1 24 GLU CD C -0.819 12.131 -2.363 1.00 . A A . 24 GLU CD 1 1 17 8046 1 1 24 GLU CG C -2.172 12.701 -1.922 1.00 . A A . 24 GLU CG 1 1 17 8047 1 1 24 GLU H H -4.703 9.914 -1.226 1.00 . A A . 24 GLU H 1 1 17 8048 1 1 24 GLU HA H -2.506 10.340 -1.533 1.00 . A A . 24 GLU HA 1 1 17 8049 1 1 24 GLU HB2 H -3.381 12.745 -0.139 1.00 . A A . 24 GLU HB2 1 1 17 8050 1 1 24 GLU HB3 H -1.681 12.362 0.145 1.00 . A A . 24 GLU HB3 1 1 17 8051 1 1 24 GLU HG2 H -2.935 12.385 -2.617 1.00 . A A . 24 GLU HG2 1 1 17 8052 1 1 24 GLU HG3 H -2.117 13.779 -1.917 1.00 . A A . 24 GLU HG3 1 1 17 8053 1 1 24 GLU N N -4.293 10.459 -0.523 1.00 . A A . 24 GLU N 1 1 17 8054 1 1 24 GLU O O -0.865 10.037 0.586 1.00 . A A . 24 GLU O 1 1 17 8055 1 1 24 GLU OE1 O 0.185 12.771 -2.099 1.00 . A A . 24 GLU OE1 1 1 17 8056 1 1 24 GLU OE2 O -0.806 11.059 -2.959 1.00 . A A . 24 GLU OE2 1 1 17 8057 1 1 25 VAL C C -1.981 6.911 1.741 1.00 . A A . 25 VAL C 1 1 17 8058 1 1 25 VAL CA C -2.147 8.322 2.297 1.00 . A A . 25 VAL CA 1 1 17 8059 1 1 25 VAL CB C -2.969 8.297 3.590 1.00 . A A . 25 VAL CB 1 1 17 8060 1 1 25 VAL CG1 C -2.318 7.347 4.599 1.00 . A A . 25 VAL CG1 1 1 17 8061 1 1 25 VAL CG2 C -3.013 9.705 4.186 1.00 . A A . 25 VAL CG2 1 1 17 8062 1 1 25 VAL H H -3.772 9.062 1.150 1.00 . A A . 25 VAL H 1 1 17 8063 1 1 25 VAL HA H -1.170 8.736 2.505 1.00 . A A . 25 VAL HA 1 1 17 8064 1 1 25 VAL HB H -3.972 7.961 3.376 1.00 . A A . 25 VAL HB 1 1 17 8065 1 1 25 VAL HG11 H -2.517 6.325 4.314 1.00 . A A . 25 VAL HG11 1 1 17 8066 1 1 25 VAL HG12 H -2.727 7.532 5.581 1.00 . A A . 25 VAL HG12 1 1 17 8067 1 1 25 VAL HG13 H -1.252 7.516 4.617 1.00 . A A . 25 VAL HG13 1 1 17 8068 1 1 25 VAL HG21 H -2.005 10.060 4.344 1.00 . A A . 25 VAL HG21 1 1 17 8069 1 1 25 VAL HG22 H -3.538 9.681 5.130 1.00 . A A . 25 VAL HG22 1 1 17 8070 1 1 25 VAL HG23 H -3.525 10.369 3.506 1.00 . A A . 25 VAL HG23 1 1 17 8071 1 1 25 VAL N N -2.800 9.135 1.279 1.00 . A A . 25 VAL N 1 1 17 8072 1 1 25 VAL O O -2.899 6.373 1.122 1.00 . A A . 25 VAL O 1 1 17 8073 1 1 26 CYS C C -0.584 3.919 2.439 1.00 . A A . 26 CYS C 1 1 17 8074 1 1 26 CYS CA C -0.515 5.011 1.373 1.00 . A A . 26 CYS CA 1 1 17 8075 1 1 26 CYS CB C 0.878 5.015 0.752 1.00 . A A . 26 CYS CB 1 1 17 8076 1 1 26 CYS H H -0.084 6.825 2.372 1.00 . A A . 26 CYS H 1 1 17 8077 1 1 26 CYS HA H -1.231 4.788 0.601 1.00 . A A . 26 CYS HA 1 1 17 8078 1 1 26 CYS HB2 H 0.920 4.277 -0.022 1.00 . A A . 26 CYS HB2 1 1 17 8079 1 1 26 CYS HB3 H 1.082 5.987 0.331 1.00 . A A . 26 CYS HB3 1 1 17 8080 1 1 26 CYS N N -0.795 6.338 1.911 1.00 . A A . 26 CYS N 1 1 17 8081 1 1 26 CYS O O -0.144 4.111 3.573 1.00 . A A . 26 CYS O 1 1 17 8082 1 1 26 CYS SG S 2.115 4.635 2.018 1.00 . A A . 26 CYS SG 1 1 17 8083 1 1 27 LYS C C -1.076 0.309 2.171 1.00 . A A . 27 LYS C 1 1 17 8084 1 1 27 LYS CA C -1.249 1.617 2.951 1.00 . A A . 27 LYS CA 1 1 17 8085 1 1 27 LYS CB C -2.624 1.626 3.633 1.00 . A A . 27 LYS CB 1 1 17 8086 1 1 27 LYS CD C -3.212 2.334 5.970 1.00 . A A . 27 LYS CD 1 1 17 8087 1 1 27 LYS CE C -4.700 1.977 5.906 1.00 . A A . 27 LYS CE 1 1 17 8088 1 1 27 LYS CG C -2.723 2.814 4.595 1.00 . A A . 27 LYS CG 1 1 17 8089 1 1 27 LYS H H -1.455 2.680 1.124 1.00 . A A . 27 LYS H 1 1 17 8090 1 1 27 LYS HA H -0.480 1.681 3.709 1.00 . A A . 27 LYS HA 1 1 17 8091 1 1 27 LYS HB2 H -3.395 1.708 2.881 1.00 . A A . 27 LYS HB2 1 1 17 8092 1 1 27 LYS HB3 H -2.757 0.708 4.184 1.00 . A A . 27 LYS HB3 1 1 17 8093 1 1 27 LYS HD2 H -2.645 1.463 6.266 1.00 . A A . 27 LYS HD2 1 1 17 8094 1 1 27 LYS HD3 H -3.063 3.119 6.696 1.00 . A A . 27 LYS HD3 1 1 17 8095 1 1 27 LYS HE2 H -4.957 1.680 4.898 1.00 . A A . 27 LYS HE2 1 1 17 8096 1 1 27 LYS HE3 H -4.903 1.159 6.583 1.00 . A A . 27 LYS HE3 1 1 17 8097 1 1 27 LYS HG2 H -1.751 3.271 4.700 1.00 . A A . 27 LYS HG2 1 1 17 8098 1 1 27 LYS HG3 H -3.418 3.540 4.198 1.00 . A A . 27 LYS HG3 1 1 17 8099 1 1 27 LYS HZ1 H -6.271 2.875 6.946 1.00 . A A . 27 LYS HZ1 1 1 17 8100 1 1 27 LYS HZ2 H -5.946 3.599 5.426 1.00 . A A . 27 LYS HZ2 1 1 17 8101 1 1 27 LYS HZ3 H -4.902 3.865 6.766 1.00 . A A . 27 LYS HZ3 1 1 17 8102 1 1 27 LYS N N -1.130 2.765 2.049 1.00 . A A . 27 LYS N 1 1 17 8103 1 1 27 LYS NZ N -5.512 3.165 6.299 1.00 . A A . 27 LYS NZ 1 1 17 8104 1 1 27 LYS O O -1.405 0.237 0.985 1.00 . A A . 27 LYS O 1 1 17 8105 1 1 28 CYS C C -1.573 -2.932 2.537 1.00 . A A . 28 CYS C 1 1 17 8106 1 1 28 CYS CA C -0.382 -2.036 2.212 1.00 . A A . 28 CYS CA 1 1 17 8107 1 1 28 CYS CB C 0.907 -2.686 2.723 1.00 . A A . 28 CYS CB 1 1 17 8108 1 1 28 CYS H H -0.343 -0.612 3.788 1.00 . A A . 28 CYS H 1 1 17 8109 1 1 28 CYS HA H -0.314 -1.907 1.144 1.00 . A A . 28 CYS HA 1 1 17 8110 1 1 28 CYS HB2 H 1.590 -1.920 3.057 1.00 . A A . 28 CYS HB2 1 1 17 8111 1 1 28 CYS HB3 H 0.678 -3.348 3.546 1.00 . A A . 28 CYS HB3 1 1 17 8112 1 1 28 CYS N N -0.575 -0.726 2.845 1.00 . A A . 28 CYS N 1 1 17 8113 1 1 28 CYS O O -1.610 -3.566 3.593 1.00 . A A . 28 CYS O 1 1 17 8114 1 1 28 CYS SG S 1.673 -3.634 1.388 1.00 . A A . 28 CYS SG 1 1 17 8115 1 1 29 ASN C C -4.290 -4.419 0.603 1.00 . A A . 29 ASN C 1 1 17 8116 1 1 29 ASN CA C -3.759 -3.773 1.881 1.00 . A A . 29 ASN CA 1 1 17 8117 1 1 29 ASN CB C -4.854 -2.911 2.517 1.00 . A A . 29 ASN CB 1 1 17 8118 1 1 29 ASN CG C -4.283 -2.092 3.664 1.00 . A A . 29 ASN CG 1 1 17 8119 1 1 29 ASN H H -2.476 -2.432 0.811 1.00 . A A . 29 ASN H 1 1 17 8120 1 1 29 ASN HA H -3.505 -4.561 2.575 1.00 . A A . 29 ASN HA 1 1 17 8121 1 1 29 ASN HB2 H -5.259 -2.245 1.775 1.00 . A A . 29 ASN HB2 1 1 17 8122 1 1 29 ASN HB3 H -5.641 -3.547 2.893 1.00 . A A . 29 ASN HB3 1 1 17 8123 1 1 29 ASN HD21 H -3.788 -3.671 4.762 1.00 . A A . 29 ASN HD21 1 1 17 8124 1 1 29 ASN HD22 H -3.422 -2.160 5.445 1.00 . A A . 29 ASN HD22 1 1 17 8125 1 1 29 ASN N N -2.557 -2.964 1.641 1.00 . A A . 29 ASN N 1 1 17 8126 1 1 29 ASN ND2 N -3.791 -2.691 4.710 1.00 . A A . 29 ASN ND2 1 1 17 8127 1 1 29 ASN O O -4.293 -3.814 -0.466 1.00 . A A . 29 ASN O 1 1 17 8128 1 1 29 ASN OD1 O -4.284 -0.864 3.604 1.00 . A A . 29 ASN OD1 1 1 17 8129 1 1 30 ILE C C -6.686 -5.875 -0.793 1.00 . A A . 30 ILE C 1 1 17 8130 1 1 30 ILE CA C -5.295 -6.380 -0.415 1.00 . A A . 30 ILE CA 1 1 17 8131 1 1 30 ILE CB C -5.351 -7.888 -0.135 1.00 . A A . 30 ILE CB 1 1 17 8132 1 1 30 ILE CD1 C -3.846 -7.975 1.852 1.00 . A A . 30 ILE CD1 1 1 17 8133 1 1 30 ILE CG1 C -5.286 -8.149 1.372 1.00 . A A . 30 ILE CG1 1 1 17 8134 1 1 30 ILE CG2 C -4.167 -8.578 -0.824 1.00 . A A . 30 ILE CG2 1 1 17 8135 1 1 30 ILE H H -4.741 -6.078 1.607 1.00 . A A . 30 ILE H 1 1 17 8136 1 1 30 ILE HA H -4.640 -6.218 -1.253 1.00 . A A . 30 ILE HA 1 1 17 8137 1 1 30 ILE HB H -6.272 -8.290 -0.530 1.00 . A A . 30 ILE HB 1 1 17 8138 1 1 30 ILE HD11 H -3.378 -8.943 1.930 1.00 . A A . 30 ILE HD11 1 1 17 8139 1 1 30 ILE HD12 H -3.845 -7.493 2.816 1.00 . A A . 30 ILE HD12 1 1 17 8140 1 1 30 ILE HD13 H -3.301 -7.368 1.143 1.00 . A A . 30 ILE HD13 1 1 17 8141 1 1 30 ILE HG12 H -5.930 -7.452 1.890 1.00 . A A . 30 ILE HG12 1 1 17 8142 1 1 30 ILE HG13 H -5.610 -9.158 1.575 1.00 . A A . 30 ILE HG13 1 1 17 8143 1 1 30 ILE HG21 H -3.271 -7.992 -0.675 1.00 . A A . 30 ILE HG21 1 1 17 8144 1 1 30 ILE HG22 H -4.366 -8.667 -1.880 1.00 . A A . 30 ILE HG22 1 1 17 8145 1 1 30 ILE HG23 H -4.028 -9.561 -0.399 1.00 . A A . 30 ILE HG23 1 1 17 8146 1 1 30 ILE N N -4.754 -5.652 0.729 1.00 . A A . 30 ILE N 1 1 17 8147 1 1 30 ILE O O -7.504 -5.549 0.065 1.00 . A A . 30 ILE O 1 1 17 8148 1 1 31 GLY C C -8.105 -3.943 -3.199 1.00 . A A . 31 GLY C 1 1 17 8149 1 1 31 GLY CA C -8.209 -5.362 -2.639 1.00 . A A . 31 GLY CA 1 1 17 8150 1 1 31 GLY H H -6.219 -6.103 -2.709 1.00 . A A . 31 GLY H 1 1 17 8151 1 1 31 GLY HA2 H -8.520 -6.031 -3.430 1.00 . A A . 31 GLY HA2 1 1 17 8152 1 1 31 GLY HA3 H -8.947 -5.375 -1.856 1.00 . A A . 31 GLY HA3 1 1 17 8153 1 1 31 GLY N N -6.925 -5.821 -2.097 1.00 . A A . 31 GLY N 1 1 17 8154 1 1 31 GLY O O -8.916 -3.532 -4.027 1.00 . A A . 31 GLY O 1 1 17 8155 1 1 32 LYS C C -5.751 -1.785 -4.236 1.00 . A A . 32 LYS C 1 1 17 8156 1 1 32 LYS CA C -6.874 -1.831 -3.194 1.00 . A A . 32 LYS CA 1 1 17 8157 1 1 32 LYS CB C -6.473 -0.951 -2.009 1.00 . A A . 32 LYS CB 1 1 17 8158 1 1 32 LYS CD C -7.134 -0.527 0.372 1.00 . A A . 32 LYS CD 1 1 17 8159 1 1 32 LYS CE C -6.742 0.942 0.593 1.00 . A A . 32 LYS CE 1 1 17 8160 1 1 32 LYS CG C -7.658 -0.732 -1.062 1.00 . A A . 32 LYS CG 1 1 17 8161 1 1 32 LYS H H -6.488 -3.598 -2.085 1.00 . A A . 32 LYS H 1 1 17 8162 1 1 32 LYS HA H -7.783 -1.447 -3.629 1.00 . A A . 32 LYS HA 1 1 17 8163 1 1 32 LYS HB2 H -5.675 -1.435 -1.470 1.00 . A A . 32 LYS HB2 1 1 17 8164 1 1 32 LYS HB3 H -6.131 0.004 -2.378 1.00 . A A . 32 LYS HB3 1 1 17 8165 1 1 32 LYS HD2 H -7.907 -0.801 1.077 1.00 . A A . 32 LYS HD2 1 1 17 8166 1 1 32 LYS HD3 H -6.270 -1.152 0.530 1.00 . A A . 32 LYS HD3 1 1 17 8167 1 1 32 LYS HE2 H -6.449 1.384 -0.348 1.00 . A A . 32 LYS HE2 1 1 17 8168 1 1 32 LYS HE3 H -7.591 1.482 0.989 1.00 . A A . 32 LYS HE3 1 1 17 8169 1 1 32 LYS HG2 H -8.214 0.143 -1.374 1.00 . A A . 32 LYS HG2 1 1 17 8170 1 1 32 LYS HG3 H -8.307 -1.596 -1.086 1.00 . A A . 32 LYS HG3 1 1 17 8171 1 1 32 LYS HZ1 H -4.683 0.856 1.060 1.00 . A A . 32 LYS HZ1 1 1 17 8172 1 1 32 LYS HZ2 H -5.722 0.313 2.310 1.00 . A A . 32 LYS HZ2 1 1 17 8173 1 1 32 LYS HZ3 H -5.585 1.999 2.003 1.00 . A A . 32 LYS HZ3 1 1 17 8174 1 1 32 LYS N N -7.097 -3.208 -2.742 1.00 . A A . 32 LYS N 1 1 17 8175 1 1 32 LYS NZ N -5.604 1.026 1.563 1.00 . A A . 32 LYS NZ 1 1 17 8176 1 1 32 LYS O O -4.756 -2.496 -4.109 1.00 . A A . 32 LYS O 1 1 17 8177 1 1 33 LYS C C -4.555 0.640 -6.606 1.00 . A A . 33 LYS C 1 1 17 8178 1 1 33 LYS CA C -4.881 -0.826 -6.301 1.00 . A A . 33 LYS CA 1 1 17 8179 1 1 33 LYS CB C -5.357 -1.516 -7.583 1.00 . A A . 33 LYS CB 1 1 17 8180 1 1 33 LYS CD C -4.656 -1.062 -9.958 1.00 . A A . 33 LYS CD 1 1 17 8181 1 1 33 LYS CE C -4.236 0.405 -10.113 1.00 . A A . 33 LYS CE 1 1 17 8182 1 1 33 LYS CG C -4.199 -1.597 -8.592 1.00 . A A . 33 LYS CG 1 1 17 8183 1 1 33 LYS H H -6.715 -0.391 -5.314 1.00 . A A . 33 LYS H 1 1 17 8184 1 1 33 LYS HA H -3.980 -1.316 -5.959 1.00 . A A . 33 LYS HA 1 1 17 8185 1 1 33 LYS HB2 H -5.699 -2.514 -7.347 1.00 . A A . 33 LYS HB2 1 1 17 8186 1 1 33 LYS HB3 H -6.170 -0.952 -8.014 1.00 . A A . 33 LYS HB3 1 1 17 8187 1 1 33 LYS HD2 H -4.202 -1.651 -10.743 1.00 . A A . 33 LYS HD2 1 1 17 8188 1 1 33 LYS HD3 H -5.731 -1.136 -10.034 1.00 . A A . 33 LYS HD3 1 1 17 8189 1 1 33 LYS HE2 H -4.896 0.896 -10.816 1.00 . A A . 33 LYS HE2 1 1 17 8190 1 1 33 LYS HE3 H -4.300 0.903 -9.156 1.00 . A A . 33 LYS HE3 1 1 17 8191 1 1 33 LYS HG2 H -3.366 -1.009 -8.235 1.00 . A A . 33 LYS HG2 1 1 17 8192 1 1 33 LYS HG3 H -3.890 -2.626 -8.698 1.00 . A A . 33 LYS HG3 1 1 17 8193 1 1 33 LYS HZ1 H -2.192 0.816 -9.841 1.00 . A A . 33 LYS HZ1 1 1 17 8194 1 1 33 LYS HZ2 H -2.777 1.123 -11.421 1.00 . A A . 33 LYS HZ2 1 1 17 8195 1 1 33 LYS HZ3 H -2.527 -0.479 -10.917 1.00 . A A . 33 LYS HZ3 1 1 17 8196 1 1 33 LYS N N -5.907 -0.943 -5.260 1.00 . A A . 33 LYS N 1 1 17 8197 1 1 33 LYS NZ N -2.831 0.468 -10.617 1.00 . A A . 33 LYS NZ 1 1 17 8198 1 1 33 LYS O O -5.442 1.494 -6.624 1.00 . A A . 33 LYS O 1 1 17 8199 1 1 34 ASP C C -2.020 2.256 -8.491 1.00 . A A . 34 ASP C 1 1 17 8200 1 1 34 ASP CA C -2.814 2.260 -7.180 1.00 . A A . 34 ASP CA 1 1 17 8201 1 1 34 ASP CB C -1.931 2.787 -6.044 1.00 . A A . 34 ASP CB 1 1 17 8202 1 1 34 ASP CG C -1.562 4.247 -6.294 1.00 . A A . 34 ASP CG 1 1 17 8203 1 1 34 ASP H H -2.621 0.181 -6.836 1.00 . A A . 34 ASP H 1 1 17 8204 1 1 34 ASP HA H -3.669 2.911 -7.291 1.00 . A A . 34 ASP HA 1 1 17 8205 1 1 34 ASP HB2 H -2.467 2.708 -5.112 1.00 . A A . 34 ASP HB2 1 1 17 8206 1 1 34 ASP HB3 H -1.029 2.197 -5.989 1.00 . A A . 34 ASP HB3 1 1 17 8207 1 1 34 ASP N N -3.273 0.909 -6.859 1.00 . A A . 34 ASP N 1 1 17 8208 1 1 34 ASP O O -1.933 3.296 -9.121 1.00 . A A . 34 ASP O 1 1 17 8209 1 1 34 ASP OXT O -1.516 1.204 -8.857 1.00 . A A . 34 ASP OXT 1 1 17 8210 1 1 34 ASP OD1 O -2.454 5.040 -6.531 1.00 . A A . 34 ASP OD1 1 1 17 8211 1 1 34 ASP OD2 O -0.379 4.555 -6.260 1.00 . A A . 34 ASP OD2 1 1 18 8212 1 1 1 GLY C C 0.285 6.912 -7.578 1.00 . A A . 1 GLY C 1 1 18 8213 1 1 1 GLY CA C -0.715 5.838 -8.009 1.00 . A A . 1 GLY CA 1 1 18 8214 1 1 1 GLY H1 H 0.203 4.716 -6.505 1.00 . A A . 1 GLY H1 1 1 18 8215 1 1 1 GLY H2 H -0.714 3.775 -7.596 1.00 . A A . 1 GLY H2 1 1 18 8216 1 1 1 GLY H3 H -1.500 4.736 -6.412 1.00 . A A . 1 GLY H3 1 1 18 8217 1 1 1 GLY HA2 H -0.465 5.495 -9.003 1.00 . A A . 1 GLY HA2 1 1 18 8218 1 1 1 GLY HA3 H -1.709 6.262 -8.017 1.00 . A A . 1 GLY HA3 1 1 18 8219 1 1 1 GLY N N -0.673 4.683 -7.060 1.00 . A A . 1 GLY N 1 1 18 8220 1 1 1 GLY O O 1.111 7.349 -8.376 1.00 . A A . 1 GLY O 1 1 18 8221 1 1 2 SER C C 2.459 7.771 -5.395 1.00 . A A . 2 SER C 1 1 18 8222 1 1 2 SER CA C 1.115 8.375 -5.806 1.00 . A A . 2 SER CA 1 1 18 8223 1 1 2 SER CB C 0.495 9.095 -4.605 1.00 . A A . 2 SER CB 1 1 18 8224 1 1 2 SER H H -0.476 6.962 -5.720 1.00 . A A . 2 SER H 1 1 18 8225 1 1 2 SER HA H 1.290 9.098 -6.587 1.00 . A A . 2 SER HA 1 1 18 8226 1 1 2 SER HB2 H -0.435 9.557 -4.898 1.00 . A A . 2 SER HB2 1 1 18 8227 1 1 2 SER HB3 H 0.306 8.382 -3.813 1.00 . A A . 2 SER HB3 1 1 18 8228 1 1 2 SER HG H 0.861 10.834 -3.757 1.00 . A A . 2 SER HG 1 1 18 8229 1 1 2 SER N N 0.204 7.341 -6.315 1.00 . A A . 2 SER N 1 1 18 8230 1 1 2 SER O O 2.751 6.614 -5.703 1.00 . A A . 2 SER O 1 1 18 8231 1 1 2 SER OG O 1.396 10.099 -4.149 1.00 . A A . 2 SER OG 1 1 18 8232 1 1 3 VAL C C 4.482 7.114 -3.102 1.00 . A A . 3 VAL C 1 1 18 8233 1 1 3 VAL CA C 4.593 8.119 -4.249 1.00 . A A . 3 VAL CA 1 1 18 8234 1 1 3 VAL CB C 5.430 9.325 -3.802 1.00 . A A . 3 VAL CB 1 1 18 8235 1 1 3 VAL CG1 C 6.154 9.920 -5.011 1.00 . A A . 3 VAL CG1 1 1 18 8236 1 1 3 VAL CG2 C 4.524 10.398 -3.184 1.00 . A A . 3 VAL CG2 1 1 18 8237 1 1 3 VAL H H 2.969 9.480 -4.488 1.00 . A A . 3 VAL H 1 1 18 8238 1 1 3 VAL HA H 5.095 7.639 -5.075 1.00 . A A . 3 VAL HA 1 1 18 8239 1 1 3 VAL HB H 6.160 9.004 -3.072 1.00 . A A . 3 VAL HB 1 1 18 8240 1 1 3 VAL HG11 H 6.875 9.207 -5.387 1.00 . A A . 3 VAL HG11 1 1 18 8241 1 1 3 VAL HG12 H 6.666 10.824 -4.716 1.00 . A A . 3 VAL HG12 1 1 18 8242 1 1 3 VAL HG13 H 5.436 10.149 -5.785 1.00 . A A . 3 VAL HG13 1 1 18 8243 1 1 3 VAL HG21 H 4.287 11.143 -3.932 1.00 . A A . 3 VAL HG21 1 1 18 8244 1 1 3 VAL HG22 H 5.037 10.870 -2.358 1.00 . A A . 3 VAL HG22 1 1 18 8245 1 1 3 VAL HG23 H 3.611 9.947 -2.829 1.00 . A A . 3 VAL HG23 1 1 18 8246 1 1 3 VAL N N 3.269 8.566 -4.700 1.00 . A A . 3 VAL N 1 1 18 8247 1 1 3 VAL O O 4.807 5.932 -3.266 1.00 . A A . 3 VAL O 1 1 18 8248 1 1 4 GLY C C 3.350 5.343 -1.211 1.00 . A A . 4 GLY C 1 1 18 8249 1 1 4 GLY CA C 3.869 6.703 -0.779 1.00 . A A . 4 GLY CA 1 1 18 8250 1 1 4 GLY H H 3.776 8.524 -1.867 1.00 . A A . 4 GLY H 1 1 18 8251 1 1 4 GLY HA2 H 4.827 6.579 -0.294 1.00 . A A . 4 GLY HA2 1 1 18 8252 1 1 4 GLY HA3 H 3.170 7.142 -0.084 1.00 . A A . 4 GLY HA3 1 1 18 8253 1 1 4 GLY N N 4.021 7.580 -1.941 1.00 . A A . 4 GLY N 1 1 18 8254 1 1 4 GLY O O 3.656 4.327 -0.603 1.00 . A A . 4 GLY O 1 1 18 8255 1 1 5 CYS C C 3.094 3.140 -3.222 1.00 . A A . 5 CYS C 1 1 18 8256 1 1 5 CYS CA C 2.000 4.118 -2.823 1.00 . A A . 5 CYS CA 1 1 18 8257 1 1 5 CYS CB C 1.158 4.447 -4.045 1.00 . A A . 5 CYS CB 1 1 18 8258 1 1 5 CYS H H 2.369 6.191 -2.722 1.00 . A A . 5 CYS H 1 1 18 8259 1 1 5 CYS HA H 1.377 3.661 -2.073 1.00 . A A . 5 CYS HA 1 1 18 8260 1 1 5 CYS HB2 H 1.801 4.538 -4.911 1.00 . A A . 5 CYS HB2 1 1 18 8261 1 1 5 CYS HB3 H 0.447 3.661 -4.208 1.00 . A A . 5 CYS HB3 1 1 18 8262 1 1 5 CYS N N 2.567 5.343 -2.281 1.00 . A A . 5 CYS N 1 1 18 8263 1 1 5 CYS O O 2.867 1.936 -3.267 1.00 . A A . 5 CYS O 1 1 18 8264 1 1 5 CYS SG S 0.293 6.012 -3.769 1.00 . A A . 5 CYS SG 1 1 18 8265 1 1 6 ALA C C 6.133 2.431 -2.578 1.00 . A A . 6 ALA C 1 1 18 8266 1 1 6 ALA CA C 5.416 2.838 -3.857 1.00 . A A . 6 ALA CA 1 1 18 8267 1 1 6 ALA CB C 6.367 3.612 -4.776 1.00 . A A . 6 ALA CB 1 1 18 8268 1 1 6 ALA H H 4.387 4.647 -3.431 1.00 . A A . 6 ALA H 1 1 18 8269 1 1 6 ALA HA H 5.067 1.952 -4.366 1.00 . A A . 6 ALA HA 1 1 18 8270 1 1 6 ALA HB1 H 6.256 3.258 -5.790 1.00 . A A . 6 ALA HB1 1 1 18 8271 1 1 6 ALA HB2 H 7.387 3.460 -4.452 1.00 . A A . 6 ALA HB2 1 1 18 8272 1 1 6 ALA HB3 H 6.133 4.666 -4.734 1.00 . A A . 6 ALA HB3 1 1 18 8273 1 1 6 ALA N N 4.275 3.669 -3.494 1.00 . A A . 6 ALA N 1 1 18 8274 1 1 6 ALA O O 6.497 1.270 -2.383 1.00 . A A . 6 ALA O 1 1 18 8275 1 1 7 GLU C C 6.042 2.255 0.445 1.00 . A A . 7 GLU C 1 1 18 8276 1 1 7 GLU CA C 6.933 3.160 -0.406 1.00 . A A . 7 GLU CA 1 1 18 8277 1 1 7 GLU CB C 7.174 4.488 0.322 1.00 . A A . 7 GLU CB 1 1 18 8278 1 1 7 GLU CD C 7.499 5.984 -1.671 1.00 . A A . 7 GLU CD 1 1 18 8279 1 1 7 GLU CG C 8.178 5.340 -0.467 1.00 . A A . 7 GLU CG 1 1 18 8280 1 1 7 GLU H H 5.961 4.307 -1.908 1.00 . A A . 7 GLU H 1 1 18 8281 1 1 7 GLU HA H 7.881 2.670 -0.568 1.00 . A A . 7 GLU HA 1 1 18 8282 1 1 7 GLU HB2 H 6.239 5.023 0.412 1.00 . A A . 7 GLU HB2 1 1 18 8283 1 1 7 GLU HB3 H 7.570 4.291 1.307 1.00 . A A . 7 GLU HB3 1 1 18 8284 1 1 7 GLU HG2 H 8.572 6.114 0.174 1.00 . A A . 7 GLU HG2 1 1 18 8285 1 1 7 GLU HG3 H 8.989 4.715 -0.810 1.00 . A A . 7 GLU HG3 1 1 18 8286 1 1 7 GLU N N 6.294 3.404 -1.693 1.00 . A A . 7 GLU N 1 1 18 8287 1 1 7 GLU O O 6.524 1.393 1.181 1.00 . A A . 7 GLU O 1 1 18 8288 1 1 7 GLU OE1 O 6.900 7.030 -1.499 1.00 . A A . 7 GLU OE1 1 1 18 8289 1 1 7 GLU OE2 O 7.586 5.418 -2.747 1.00 . A A . 7 GLU OE2 1 1 18 8290 1 1 8 CYS C C 4.030 0.181 0.946 1.00 . A A . 8 CYS C 1 1 18 8291 1 1 8 CYS CA C 3.757 1.677 1.086 1.00 . A A . 8 CYS CA 1 1 18 8292 1 1 8 CYS CB C 2.336 2.005 0.631 1.00 . A A . 8 CYS CB 1 1 18 8293 1 1 8 CYS H H 4.411 3.172 -0.271 1.00 . A A . 8 CYS H 1 1 18 8294 1 1 8 CYS HA H 3.844 1.944 2.123 1.00 . A A . 8 CYS HA 1 1 18 8295 1 1 8 CYS HB2 H 2.365 2.764 -0.134 1.00 . A A . 8 CYS HB2 1 1 18 8296 1 1 8 CYS HB3 H 1.855 1.127 0.242 1.00 . A A . 8 CYS HB3 1 1 18 8297 1 1 8 CYS N N 4.731 2.464 0.333 1.00 . A A . 8 CYS N 1 1 18 8298 1 1 8 CYS O O 4.295 -0.498 1.937 1.00 . A A . 8 CYS O 1 1 18 8299 1 1 8 CYS SG S 1.407 2.619 2.050 1.00 . A A . 8 CYS SG 1 1 18 8300 1 1 9 PRO C C 5.678 -2.116 0.041 1.00 . A A . 9 PRO C 1 1 18 8301 1 1 9 PRO CA C 4.289 -1.785 -0.491 1.00 . A A . 9 PRO CA 1 1 18 8302 1 1 9 PRO CB C 4.202 -1.961 -2.014 1.00 . A A . 9 PRO CB 1 1 18 8303 1 1 9 PRO CD C 3.698 0.359 -1.502 1.00 . A A . 9 PRO CD 1 1 18 8304 1 1 9 PRO CG C 4.200 -0.585 -2.593 1.00 . A A . 9 PRO CG 1 1 18 8305 1 1 9 PRO HA H 3.546 -2.398 -0.008 1.00 . A A . 9 PRO HA 1 1 18 8306 1 1 9 PRO HB2 H 5.057 -2.518 -2.375 1.00 . A A . 9 PRO HB2 1 1 18 8307 1 1 9 PRO HB3 H 3.288 -2.471 -2.277 1.00 . A A . 9 PRO HB3 1 1 18 8308 1 1 9 PRO HD2 H 4.225 1.300 -1.547 1.00 . A A . 9 PRO HD2 1 1 18 8309 1 1 9 PRO HD3 H 2.634 0.512 -1.594 1.00 . A A . 9 PRO HD3 1 1 18 8310 1 1 9 PRO HG2 H 5.201 -0.314 -2.893 1.00 . A A . 9 PRO HG2 1 1 18 8311 1 1 9 PRO HG3 H 3.537 -0.541 -3.443 1.00 . A A . 9 PRO HG3 1 1 18 8312 1 1 9 PRO N N 4.002 -0.345 -0.258 1.00 . A A . 9 PRO N 1 1 18 8313 1 1 9 PRO O O 5.873 -3.121 0.725 1.00 . A A . 9 PRO O 1 1 18 8314 1 1 10 MET C C 7.932 -1.531 1.790 1.00 . A A . 10 MET C 1 1 18 8315 1 1 10 MET CA C 7.986 -1.395 0.269 1.00 . A A . 10 MET CA 1 1 18 8316 1 1 10 MET CB C 8.848 -0.188 -0.120 1.00 . A A . 10 MET CB 1 1 18 8317 1 1 10 MET CE C 11.841 -0.259 -2.771 1.00 . A A . 10 MET CE 1 1 18 8318 1 1 10 MET CG C 9.421 -0.382 -1.529 1.00 . A A . 10 MET CG 1 1 18 8319 1 1 10 MET H H 6.406 -0.420 -0.751 1.00 . A A . 10 MET H 1 1 18 8320 1 1 10 MET HA H 8.414 -2.293 -0.153 1.00 . A A . 10 MET HA 1 1 18 8321 1 1 10 MET HB2 H 8.244 0.706 -0.103 1.00 . A A . 10 MET HB2 1 1 18 8322 1 1 10 MET HB3 H 9.660 -0.085 0.583 1.00 . A A . 10 MET HB3 1 1 18 8323 1 1 10 MET HE1 H 12.913 -0.288 -2.641 1.00 . A A . 10 MET HE1 1 1 18 8324 1 1 10 MET HE2 H 11.501 0.767 -2.782 1.00 . A A . 10 MET HE2 1 1 18 8325 1 1 10 MET HE3 H 11.582 -0.730 -3.705 1.00 . A A . 10 MET HE3 1 1 18 8326 1 1 10 MET HG2 H 8.765 -1.022 -2.105 1.00 . A A . 10 MET HG2 1 1 18 8327 1 1 10 MET HG3 H 9.507 0.578 -2.017 1.00 . A A . 10 MET HG3 1 1 18 8328 1 1 10 MET N N 6.631 -1.224 -0.233 1.00 . A A . 10 MET N 1 1 18 8329 1 1 10 MET O O 8.678 -2.305 2.387 1.00 . A A . 10 MET O 1 1 18 8330 1 1 10 MET SD S 11.055 -1.147 -1.405 1.00 . A A . 10 MET SD 1 1 18 8331 1 1 11 HIS C C 5.878 -1.990 4.219 1.00 . A A . 11 HIS C 1 1 18 8332 1 1 11 HIS CA C 6.821 -0.842 3.855 1.00 . A A . 11 HIS CA 1 1 18 8333 1 1 11 HIS CB C 6.252 0.484 4.373 1.00 . A A . 11 HIS CB 1 1 18 8334 1 1 11 HIS CD2 C 7.242 1.967 6.303 1.00 . A A . 11 HIS CD2 1 1 18 8335 1 1 11 HIS CE1 C 7.584 0.407 7.768 1.00 . A A . 11 HIS CE1 1 1 18 8336 1 1 11 HIS CG C 6.835 0.789 5.729 1.00 . A A . 11 HIS CG 1 1 18 8337 1 1 11 HIS H H 6.428 -0.202 1.866 1.00 . A A . 11 HIS H 1 1 18 8338 1 1 11 HIS HA H 7.778 -1.017 4.325 1.00 . A A . 11 HIS HA 1 1 18 8339 1 1 11 HIS HB2 H 6.505 1.277 3.685 1.00 . A A . 11 HIS HB2 1 1 18 8340 1 1 11 HIS HB3 H 5.178 0.408 4.455 1.00 . A A . 11 HIS HB3 1 1 18 8341 1 1 11 HIS HD2 H 7.199 2.935 5.830 1.00 . A A . 11 HIS HD2 1 1 18 8342 1 1 11 HIS HE1 H 7.861 -0.112 8.676 1.00 . A A . 11 HIS HE1 1 1 18 8343 1 1 11 HIS HE2 H 8.067 2.381 8.226 1.00 . A A . 11 HIS HE2 1 1 18 8344 1 1 11 HIS N N 7.008 -0.787 2.404 1.00 . A A . 11 HIS N 1 1 18 8345 1 1 11 HIS ND1 N 7.063 -0.194 6.681 1.00 . A A . 11 HIS ND1 1 1 18 8346 1 1 11 HIS NE2 N 7.713 1.725 7.589 1.00 . A A . 11 HIS NE2 1 1 18 8347 1 1 11 HIS O O 5.374 -2.076 5.343 1.00 . A A . 11 HIS O 1 1 18 8348 1 1 12 CYS C C 5.683 -5.259 3.778 1.00 . A A . 12 CYS C 1 1 18 8349 1 1 12 CYS CA C 4.813 -4.051 3.468 1.00 . A A . 12 CYS CA 1 1 18 8350 1 1 12 CYS CB C 3.954 -4.332 2.241 1.00 . A A . 12 CYS CB 1 1 18 8351 1 1 12 CYS H H 6.114 -2.770 2.394 1.00 . A A . 12 CYS H 1 1 18 8352 1 1 12 CYS HA H 4.163 -3.865 4.312 1.00 . A A . 12 CYS HA 1 1 18 8353 1 1 12 CYS HB2 H 3.872 -3.436 1.649 1.00 . A A . 12 CYS HB2 1 1 18 8354 1 1 12 CYS HB3 H 4.405 -5.117 1.653 1.00 . A A . 12 CYS HB3 1 1 18 8355 1 1 12 CYS N N 5.668 -2.886 3.262 1.00 . A A . 12 CYS N 1 1 18 8356 1 1 12 CYS O O 6.809 -5.360 3.295 1.00 . A A . 12 CYS O 1 1 18 8357 1 1 12 CYS SG S 2.307 -4.851 2.781 1.00 . A A . 12 CYS SG 1 1 18 8358 1 1 13 LYS C C 5.639 -8.527 4.139 1.00 . A A . 13 LYS C 1 1 18 8359 1 1 13 LYS CA C 5.966 -7.314 5.014 1.00 . A A . 13 LYS CA 1 1 18 8360 1 1 13 LYS CB C 5.700 -7.636 6.493 1.00 . A A . 13 LYS CB 1 1 18 8361 1 1 13 LYS CD C 6.496 -5.333 7.167 1.00 . A A . 13 LYS CD 1 1 18 8362 1 1 13 LYS CE C 6.071 -3.998 7.794 1.00 . A A . 13 LYS CE 1 1 18 8363 1 1 13 LYS CG C 5.344 -6.351 7.267 1.00 . A A . 13 LYS CG 1 1 18 8364 1 1 13 LYS H H 4.294 -6.008 4.997 1.00 . A A . 13 LYS H 1 1 18 8365 1 1 13 LYS HA H 7.013 -7.081 4.898 1.00 . A A . 13 LYS HA 1 1 18 8366 1 1 13 LYS HB2 H 4.878 -8.336 6.566 1.00 . A A . 13 LYS HB2 1 1 18 8367 1 1 13 LYS HB3 H 6.585 -8.078 6.927 1.00 . A A . 13 LYS HB3 1 1 18 8368 1 1 13 LYS HD2 H 7.359 -5.718 7.692 1.00 . A A . 13 LYS HD2 1 1 18 8369 1 1 13 LYS HD3 H 6.750 -5.176 6.130 1.00 . A A . 13 LYS HD3 1 1 18 8370 1 1 13 LYS HE2 H 4.993 -3.911 7.766 1.00 . A A . 13 LYS HE2 1 1 18 8371 1 1 13 LYS HE3 H 6.407 -3.960 8.821 1.00 . A A . 13 LYS HE3 1 1 18 8372 1 1 13 LYS HG2 H 4.445 -5.919 6.851 1.00 . A A . 13 LYS HG2 1 1 18 8373 1 1 13 LYS HG3 H 5.175 -6.596 8.305 1.00 . A A . 13 LYS HG3 1 1 18 8374 1 1 13 LYS HZ1 H 7.537 -3.202 6.538 1.00 . A A . 13 LYS HZ1 1 1 18 8375 1 1 13 LYS HZ2 H 6.938 -2.095 7.675 1.00 . A A . 13 LYS HZ2 1 1 18 8376 1 1 13 LYS HZ3 H 5.991 -2.507 6.314 1.00 . A A . 13 LYS HZ3 1 1 18 8377 1 1 13 LYS N N 5.184 -6.149 4.618 1.00 . A A . 13 LYS N 1 1 18 8378 1 1 13 LYS NZ N 6.683 -2.869 7.028 1.00 . A A . 13 LYS NZ 1 1 18 8379 1 1 13 LYS O O 4.479 -8.798 3.819 1.00 . A A . 13 LYS O 1 1 18 8380 1 1 14 GLY C C 5.399 -11.297 3.229 1.00 . A A . 14 GLY C 1 1 18 8381 1 1 14 GLY CA C 6.593 -10.410 2.877 1.00 . A A . 14 GLY CA 1 1 18 8382 1 1 14 GLY H H 7.588 -8.934 4.025 1.00 . A A . 14 GLY H 1 1 18 8383 1 1 14 GLY HA2 H 6.494 -10.082 1.853 1.00 . A A . 14 GLY HA2 1 1 18 8384 1 1 14 GLY HA3 H 7.498 -10.991 2.971 1.00 . A A . 14 GLY HA3 1 1 18 8385 1 1 14 GLY N N 6.698 -9.230 3.740 1.00 . A A . 14 GLY N 1 1 18 8386 1 1 14 GLY O O 5.070 -11.475 4.400 1.00 . A A . 14 GLY O 1 1 18 8387 1 1 15 LYS C C 2.289 -11.991 2.174 1.00 . A A . 15 LYS C 1 1 18 8388 1 1 15 LYS CA C 3.612 -12.746 2.330 1.00 . A A . 15 LYS CA 1 1 18 8389 1 1 15 LYS CB C 3.652 -13.471 3.685 1.00 . A A . 15 LYS CB 1 1 18 8390 1 1 15 LYS CD C 1.601 -14.749 4.327 1.00 . A A . 15 LYS CD 1 1 18 8391 1 1 15 LYS CE C 0.724 -15.935 3.925 1.00 . A A . 15 LYS CE 1 1 18 8392 1 1 15 LYS CG C 2.936 -14.820 3.581 1.00 . A A . 15 LYS CG 1 1 18 8393 1 1 15 LYS H H 5.106 -11.661 1.283 1.00 . A A . 15 LYS H 1 1 18 8394 1 1 15 LYS HA H 3.664 -13.490 1.549 1.00 . A A . 15 LYS HA 1 1 18 8395 1 1 15 LYS HB2 H 4.681 -13.634 3.970 1.00 . A A . 15 LYS HB2 1 1 18 8396 1 1 15 LYS HB3 H 3.168 -12.866 4.434 1.00 . A A . 15 LYS HB3 1 1 18 8397 1 1 15 LYS HD2 H 1.782 -14.778 5.393 1.00 . A A . 15 LYS HD2 1 1 18 8398 1 1 15 LYS HD3 H 1.097 -13.829 4.074 1.00 . A A . 15 LYS HD3 1 1 18 8399 1 1 15 LYS HE2 H 1.337 -16.823 3.827 1.00 . A A . 15 LYS HE2 1 1 18 8400 1 1 15 LYS HE3 H -0.030 -16.100 4.684 1.00 . A A . 15 LYS HE3 1 1 18 8401 1 1 15 LYS HG2 H 2.760 -15.061 2.544 1.00 . A A . 15 LYS HG2 1 1 18 8402 1 1 15 LYS HG3 H 3.553 -15.582 4.029 1.00 . A A . 15 LYS HG3 1 1 18 8403 1 1 15 LYS HZ1 H 0.373 -16.314 1.902 1.00 . A A . 15 LYS HZ1 1 1 18 8404 1 1 15 LYS HZ2 H 0.338 -14.666 2.314 1.00 . A A . 15 LYS HZ2 1 1 18 8405 1 1 15 LYS HZ3 H -0.969 -15.678 2.729 1.00 . A A . 15 LYS HZ3 1 1 18 8406 1 1 15 LYS N N 4.770 -11.850 2.185 1.00 . A A . 15 LYS N 1 1 18 8407 1 1 15 LYS NZ N 0.066 -15.626 2.619 1.00 . A A . 15 LYS NZ 1 1 18 8408 1 1 15 LYS O O 1.259 -12.599 1.867 1.00 . A A . 15 LYS O 1 1 18 8409 1 1 16 MET C C 1.406 -8.507 1.594 1.00 . A A . 16 MET C 1 1 18 8410 1 1 16 MET CA C 1.098 -9.871 2.225 1.00 . A A . 16 MET CA 1 1 18 8411 1 1 16 MET CB C 0.450 -9.675 3.603 1.00 . A A . 16 MET CB 1 1 18 8412 1 1 16 MET CE C -1.758 -12.309 5.855 1.00 . A A . 16 MET CE 1 1 18 8413 1 1 16 MET CG C -0.172 -10.991 4.080 1.00 . A A . 16 MET CG 1 1 18 8414 1 1 16 MET H H 3.159 -10.234 2.608 1.00 . A A . 16 MET H 1 1 18 8415 1 1 16 MET HA H 0.406 -10.399 1.589 1.00 . A A . 16 MET HA 1 1 18 8416 1 1 16 MET HB2 H 1.203 -9.359 4.312 1.00 . A A . 16 MET HB2 1 1 18 8417 1 1 16 MET HB3 H -0.317 -8.922 3.536 1.00 . A A . 16 MET HB3 1 1 18 8418 1 1 16 MET HE1 H -0.821 -12.680 6.250 1.00 . A A . 16 MET HE1 1 1 18 8419 1 1 16 MET HE2 H -2.097 -12.949 5.051 1.00 . A A . 16 MET HE2 1 1 18 8420 1 1 16 MET HE3 H -2.495 -12.302 6.639 1.00 . A A . 16 MET HE3 1 1 18 8421 1 1 16 MET HG2 H -0.557 -11.539 3.233 1.00 . A A . 16 MET HG2 1 1 18 8422 1 1 16 MET HG3 H 0.579 -11.585 4.583 1.00 . A A . 16 MET HG3 1 1 18 8423 1 1 16 MET N N 2.313 -10.672 2.372 1.00 . A A . 16 MET N 1 1 18 8424 1 1 16 MET O O 1.777 -7.564 2.297 1.00 . A A . 16 MET O 1 1 18 8425 1 1 16 MET SD S -1.523 -10.627 5.226 1.00 . A A . 16 MET SD 1 1 18 8426 1 1 17 ALA C C 0.176 -6.551 -0.996 1.00 . A A . 17 ALA C 1 1 18 8427 1 1 17 ALA CA C 1.470 -7.124 -0.427 1.00 . A A . 17 ALA CA 1 1 18 8428 1 1 17 ALA CB C 2.481 -7.334 -1.556 1.00 . A A . 17 ALA CB 1 1 18 8429 1 1 17 ALA H H 0.900 -9.168 -0.234 1.00 . A A . 17 ALA H 1 1 18 8430 1 1 17 ALA HA H 1.874 -6.416 0.278 1.00 . A A . 17 ALA HA 1 1 18 8431 1 1 17 ALA HB1 H 3.290 -7.957 -1.205 1.00 . A A . 17 ALA HB1 1 1 18 8432 1 1 17 ALA HB2 H 2.875 -6.379 -1.870 1.00 . A A . 17 ALA HB2 1 1 18 8433 1 1 17 ALA HB3 H 1.993 -7.814 -2.393 1.00 . A A . 17 ALA HB3 1 1 18 8434 1 1 17 ALA N N 1.219 -8.393 0.274 1.00 . A A . 17 ALA N 1 1 18 8435 1 1 17 ALA O O -0.605 -7.262 -1.626 1.00 . A A . 17 ALA O 1 1 18 8436 1 1 18 LYS C C -1.154 -3.076 -1.176 1.00 . A A . 18 LYS C 1 1 18 8437 1 1 18 LYS CA C -1.283 -4.612 -1.191 1.00 . A A . 18 LYS CA 1 1 18 8438 1 1 18 LYS CB C -2.426 -5.058 -0.278 1.00 . A A . 18 LYS CB 1 1 18 8439 1 1 18 LYS CD C -1.187 -6.270 1.564 1.00 . A A . 18 LYS CD 1 1 18 8440 1 1 18 LYS CE C -1.184 -6.453 3.085 1.00 . A A . 18 LYS CE 1 1 18 8441 1 1 18 LYS CG C -1.967 -5.000 1.187 1.00 . A A . 18 LYS CG 1 1 18 8442 1 1 18 LYS H H 0.593 -4.757 -0.206 1.00 . A A . 18 LYS H 1 1 18 8443 1 1 18 LYS HA H -1.501 -4.934 -2.192 1.00 . A A . 18 LYS HA 1 1 18 8444 1 1 18 LYS HB2 H -3.272 -4.404 -0.422 1.00 . A A . 18 LYS HB2 1 1 18 8445 1 1 18 LYS HB3 H -2.707 -6.069 -0.527 1.00 . A A . 18 LYS HB3 1 1 18 8446 1 1 18 LYS HD2 H -1.648 -7.130 1.099 1.00 . A A . 18 LYS HD2 1 1 18 8447 1 1 18 LYS HD3 H -0.171 -6.180 1.224 1.00 . A A . 18 LYS HD3 1 1 18 8448 1 1 18 LYS HE2 H -1.759 -5.660 3.545 1.00 . A A . 18 LYS HE2 1 1 18 8449 1 1 18 LYS HE3 H -1.628 -7.406 3.335 1.00 . A A . 18 LYS HE3 1 1 18 8450 1 1 18 LYS HG2 H -1.330 -4.139 1.321 1.00 . A A . 18 LYS HG2 1 1 18 8451 1 1 18 LYS HG3 H -2.829 -4.910 1.823 1.00 . A A . 18 LYS HG3 1 1 18 8452 1 1 18 LYS HZ1 H 0.863 -6.922 2.923 1.00 . A A . 18 LYS HZ1 1 1 18 8453 1 1 18 LYS HZ2 H 0.277 -6.851 4.524 1.00 . A A . 18 LYS HZ2 1 1 18 8454 1 1 18 LYS HZ3 H 0.533 -5.417 3.656 1.00 . A A . 18 LYS HZ3 1 1 18 8455 1 1 18 LYS N N -0.057 -5.264 -0.735 1.00 . A A . 18 LYS N 1 1 18 8456 1 1 18 LYS NZ N 0.225 -6.407 3.587 1.00 . A A . 18 LYS NZ 1 1 18 8457 1 1 18 LYS O O -1.464 -2.427 -0.174 1.00 . A A . 18 LYS O 1 1 18 8458 1 1 19 PRO C C -1.838 -0.228 -2.467 1.00 . A A . 19 PRO C 1 1 18 8459 1 1 19 PRO CA C -0.517 -0.999 -2.358 1.00 . A A . 19 PRO CA 1 1 18 8460 1 1 19 PRO CB C 0.320 -0.826 -3.625 1.00 . A A . 19 PRO CB 1 1 18 8461 1 1 19 PRO CD C -0.310 -3.162 -3.510 1.00 . A A . 19 PRO CD 1 1 18 8462 1 1 19 PRO CG C -0.015 -2.008 -4.472 1.00 . A A . 19 PRO CG 1 1 18 8463 1 1 19 PRO HA H 0.047 -0.642 -1.510 1.00 . A A . 19 PRO HA 1 1 18 8464 1 1 19 PRO HB2 H 0.050 0.091 -4.131 1.00 . A A . 19 PRO HB2 1 1 18 8465 1 1 19 PRO HB3 H 1.372 -0.829 -3.385 1.00 . A A . 19 PRO HB3 1 1 18 8466 1 1 19 PRO HD2 H -1.122 -3.771 -3.888 1.00 . A A . 19 PRO HD2 1 1 18 8467 1 1 19 PRO HD3 H 0.573 -3.763 -3.351 1.00 . A A . 19 PRO HD3 1 1 18 8468 1 1 19 PRO HG2 H -0.886 -1.792 -5.077 1.00 . A A . 19 PRO HG2 1 1 18 8469 1 1 19 PRO HG3 H 0.821 -2.261 -5.101 1.00 . A A . 19 PRO HG3 1 1 18 8470 1 1 19 PRO N N -0.700 -2.486 -2.260 1.00 . A A . 19 PRO N 1 1 18 8471 1 1 19 PRO O O -2.490 -0.224 -3.516 1.00 . A A . 19 PRO O 1 1 18 8472 1 1 20 THR C C -3.133 2.703 -1.118 1.00 . A A . 20 THR C 1 1 18 8473 1 1 20 THR CA C -3.447 1.225 -1.341 1.00 . A A . 20 THR CA 1 1 18 8474 1 1 20 THR CB C -4.347 0.733 -0.206 1.00 . A A . 20 THR CB 1 1 18 8475 1 1 20 THR CG2 C -4.505 -0.783 -0.282 1.00 . A A . 20 THR CG2 1 1 18 8476 1 1 20 THR H H -1.647 0.402 -0.575 1.00 . A A . 20 THR H 1 1 18 8477 1 1 20 THR HA H -3.970 1.110 -2.277 1.00 . A A . 20 THR HA 1 1 18 8478 1 1 20 THR HB H -5.318 1.198 -0.283 1.00 . A A . 20 THR HB 1 1 18 8479 1 1 20 THR HG1 H -2.838 0.711 1.033 1.00 . A A . 20 THR HG1 1 1 18 8480 1 1 20 THR HG21 H -3.801 -1.191 -0.993 1.00 . A A . 20 THR HG21 1 1 18 8481 1 1 20 THR HG22 H -5.508 -1.028 -0.588 1.00 . A A . 20 THR HG22 1 1 18 8482 1 1 20 THR HG23 H -4.319 -1.206 0.690 1.00 . A A . 20 THR HG23 1 1 18 8483 1 1 20 THR N N -2.214 0.437 -1.375 1.00 . A A . 20 THR N 1 1 18 8484 1 1 20 THR O O -2.362 3.049 -0.219 1.00 . A A . 20 THR O 1 1 18 8485 1 1 20 THR OG1 O -3.748 1.069 1.037 1.00 . A A . 20 THR OG1 1 1 18 8486 1 1 21 CYS C C -4.827 5.786 -1.970 1.00 . A A . 21 CYS C 1 1 18 8487 1 1 21 CYS CA C -3.515 5.011 -1.814 1.00 . A A . 21 CYS CA 1 1 18 8488 1 1 21 CYS CB C -2.524 5.475 -2.880 1.00 . A A . 21 CYS CB 1 1 18 8489 1 1 21 CYS H H -4.341 3.231 -2.629 1.00 . A A . 21 CYS H 1 1 18 8490 1 1 21 CYS HA H -3.100 5.222 -0.842 1.00 . A A . 21 CYS HA 1 1 18 8491 1 1 21 CYS HB2 H -2.477 4.738 -3.655 1.00 . A A . 21 CYS HB2 1 1 18 8492 1 1 21 CYS HB3 H -2.849 6.417 -3.295 1.00 . A A . 21 CYS HB3 1 1 18 8493 1 1 21 CYS N N -3.735 3.568 -1.935 1.00 . A A . 21 CYS N 1 1 18 8494 1 1 21 CYS O O -5.575 5.589 -2.934 1.00 . A A . 21 CYS O 1 1 18 8495 1 1 21 CYS SG S -0.879 5.669 -2.160 1.00 . A A . 21 CYS SG 1 1 18 8496 1 1 22 GLU C C -5.999 8.880 -0.508 1.00 . A A . 22 GLU C 1 1 18 8497 1 1 22 GLU CA C -6.303 7.472 -1.020 1.00 . A A . 22 GLU CA 1 1 18 8498 1 1 22 GLU CB C -7.397 6.807 -0.174 1.00 . A A . 22 GLU CB 1 1 18 8499 1 1 22 GLU CD C -6.620 4.430 0.049 1.00 . A A . 22 GLU CD 1 1 18 8500 1 1 22 GLU CG C -6.789 5.762 0.776 1.00 . A A . 22 GLU CG 1 1 18 8501 1 1 22 GLU H H -4.477 6.771 -0.274 1.00 . A A . 22 GLU H 1 1 18 8502 1 1 22 GLU HA H -6.657 7.549 -2.040 1.00 . A A . 22 GLU HA 1 1 18 8503 1 1 22 GLU HB2 H -7.915 7.560 0.402 1.00 . A A . 22 GLU HB2 1 1 18 8504 1 1 22 GLU HB3 H -8.091 6.320 -0.831 1.00 . A A . 22 GLU HB3 1 1 18 8505 1 1 22 GLU HG2 H -5.827 6.107 1.125 1.00 . A A . 22 GLU HG2 1 1 18 8506 1 1 22 GLU HG3 H -7.446 5.625 1.622 1.00 . A A . 22 GLU HG3 1 1 18 8507 1 1 22 GLU N N -5.099 6.663 -1.010 1.00 . A A . 22 GLU N 1 1 18 8508 1 1 22 GLU O O -5.715 9.076 0.667 1.00 . A A . 22 GLU O 1 1 18 8509 1 1 22 GLU OE1 O -7.577 3.980 -0.563 1.00 . A A . 22 GLU OE1 1 1 18 8510 1 1 22 GLU OE2 O -5.534 3.880 0.104 1.00 . A A . 22 GLU OE2 1 1 18 8511 1 1 23 ASN C C -4.354 11.405 -0.501 1.00 . A A . 23 ASN C 1 1 18 8512 1 1 23 ASN CA C -5.753 11.252 -1.120 1.00 . A A . 23 ASN CA 1 1 18 8513 1 1 23 ASN CB C -6.873 11.856 -0.231 1.00 . A A . 23 ASN CB 1 1 18 8514 1 1 23 ASN CG C -6.474 11.994 1.242 1.00 . A A . 23 ASN CG 1 1 18 8515 1 1 23 ASN H H -6.244 9.584 -2.341 1.00 . A A . 23 ASN H 1 1 18 8516 1 1 23 ASN HA H -5.750 11.791 -2.059 1.00 . A A . 23 ASN HA 1 1 18 8517 1 1 23 ASN HB2 H -7.131 12.832 -0.610 1.00 . A A . 23 ASN HB2 1 1 18 8518 1 1 23 ASN HB3 H -7.742 11.219 -0.295 1.00 . A A . 23 ASN HB3 1 1 18 8519 1 1 23 ASN HD21 H -5.988 10.089 1.469 1.00 . A A . 23 ASN HD21 1 1 18 8520 1 1 23 ASN HD22 H -5.797 11.069 2.846 1.00 . A A . 23 ASN HD22 1 1 18 8521 1 1 23 ASN N N -6.036 9.838 -1.422 1.00 . A A . 23 ASN N 1 1 18 8522 1 1 23 ASN ND2 N -6.054 10.968 1.909 1.00 . A A . 23 ASN ND2 1 1 18 8523 1 1 23 ASN O O -4.161 12.043 0.529 1.00 . A A . 23 ASN O 1 1 18 8524 1 1 23 ASN OD1 O -6.560 13.084 1.800 1.00 . A A . 23 ASN OD1 1 1 18 8525 1 1 24 GLU C C -1.742 10.036 0.525 1.00 . A A . 24 GLU C 1 1 18 8526 1 1 24 GLU CA C -1.977 10.854 -0.747 1.00 . A A . 24 GLU CA 1 1 18 8527 1 1 24 GLU CB C -1.521 12.308 -0.556 1.00 . A A . 24 GLU CB 1 1 18 8528 1 1 24 GLU CD C -1.147 12.047 -3.044 1.00 . A A . 24 GLU CD 1 1 18 8529 1 1 24 GLU CG C -1.476 13.027 -1.919 1.00 . A A . 24 GLU CG 1 1 18 8530 1 1 24 GLU H H -3.599 10.326 -2.003 1.00 . A A . 24 GLU H 1 1 18 8531 1 1 24 GLU HA H -1.377 10.415 -1.527 1.00 . A A . 24 GLU HA 1 1 18 8532 1 1 24 GLU HB2 H -2.211 12.819 0.098 1.00 . A A . 24 GLU HB2 1 1 18 8533 1 1 24 GLU HB3 H -0.535 12.320 -0.115 1.00 . A A . 24 GLU HB3 1 1 18 8534 1 1 24 GLU HG2 H -2.436 13.480 -2.115 1.00 . A A . 24 GLU HG2 1 1 18 8535 1 1 24 GLU HG3 H -0.720 13.797 -1.890 1.00 . A A . 24 GLU HG3 1 1 18 8536 1 1 24 GLU N N -3.376 10.806 -1.178 1.00 . A A . 24 GLU N 1 1 18 8537 1 1 24 GLU O O -0.633 10.012 1.060 1.00 . A A . 24 GLU O 1 1 18 8538 1 1 24 GLU OE1 O 0.030 11.797 -3.268 1.00 . A A . 24 GLU OE1 1 1 18 8539 1 1 24 GLU OE2 O -2.076 11.549 -3.660 1.00 . A A . 24 GLU OE2 1 1 18 8540 1 1 25 VAL C C -2.439 7.033 1.705 1.00 . A A . 25 VAL C 1 1 18 8541 1 1 25 VAL CA C -2.634 8.478 2.163 1.00 . A A . 25 VAL CA 1 1 18 8542 1 1 25 VAL CB C -3.872 8.590 3.065 1.00 . A A . 25 VAL CB 1 1 18 8543 1 1 25 VAL CG1 C -3.812 7.520 4.160 1.00 . A A . 25 VAL CG1 1 1 18 8544 1 1 25 VAL CG2 C -3.902 9.971 3.722 1.00 . A A . 25 VAL CG2 1 1 18 8545 1 1 25 VAL H H -3.628 9.357 0.506 1.00 . A A . 25 VAL H 1 1 18 8546 1 1 25 VAL HA H -1.763 8.788 2.722 1.00 . A A . 25 VAL HA 1 1 18 8547 1 1 25 VAL HB H -4.764 8.448 2.476 1.00 . A A . 25 VAL HB 1 1 18 8548 1 1 25 VAL HG11 H -4.635 7.664 4.846 1.00 . A A . 25 VAL HG11 1 1 18 8549 1 1 25 VAL HG12 H -2.879 7.604 4.696 1.00 . A A . 25 VAL HG12 1 1 18 8550 1 1 25 VAL HG13 H -3.885 6.539 3.712 1.00 . A A . 25 VAL HG13 1 1 18 8551 1 1 25 VAL HG21 H -3.119 10.034 4.464 1.00 . A A . 25 VAL HG21 1 1 18 8552 1 1 25 VAL HG22 H -4.861 10.122 4.198 1.00 . A A . 25 VAL HG22 1 1 18 8553 1 1 25 VAL HG23 H -3.748 10.734 2.972 1.00 . A A . 25 VAL HG23 1 1 18 8554 1 1 25 VAL N N -2.773 9.329 0.983 1.00 . A A . 25 VAL N 1 1 18 8555 1 1 25 VAL O O -3.374 6.390 1.224 1.00 . A A . 25 VAL O 1 1 18 8556 1 1 26 CYS C C -0.930 4.182 2.531 1.00 . A A . 26 CYS C 1 1 18 8557 1 1 26 CYS CA C -0.896 5.184 1.379 1.00 . A A . 26 CYS CA 1 1 18 8558 1 1 26 CYS CB C 0.491 5.157 0.740 1.00 . A A . 26 CYS CB 1 1 18 8559 1 1 26 CYS H H -0.494 7.102 2.178 1.00 . A A . 26 CYS H 1 1 18 8560 1 1 26 CYS HA H -1.618 4.887 0.637 1.00 . A A . 26 CYS HA 1 1 18 8561 1 1 26 CYS HB2 H 0.486 4.474 -0.090 1.00 . A A . 26 CYS HB2 1 1 18 8562 1 1 26 CYS HB3 H 0.752 6.139 0.390 1.00 . A A . 26 CYS HB3 1 1 18 8563 1 1 26 CYS N N -1.209 6.540 1.819 1.00 . A A . 26 CYS N 1 1 18 8564 1 1 26 CYS O O -0.518 4.484 3.651 1.00 . A A . 26 CYS O 1 1 18 8565 1 1 26 CYS SG S 1.702 4.611 1.964 1.00 . A A . 26 CYS SG 1 1 18 8566 1 1 27 LYS C C -1.347 0.543 2.538 1.00 . A A . 27 LYS C 1 1 18 8567 1 1 27 LYS CA C -1.480 1.902 3.231 1.00 . A A . 27 LYS CA 1 1 18 8568 1 1 27 LYS CB C -2.815 1.929 4.003 1.00 . A A . 27 LYS CB 1 1 18 8569 1 1 27 LYS CD C -4.788 3.475 4.314 1.00 . A A . 27 LYS CD 1 1 18 8570 1 1 27 LYS CE C -5.377 2.855 3.037 1.00 . A A . 27 LYS CE 1 1 18 8571 1 1 27 LYS CG C -3.252 3.371 4.319 1.00 . A A . 27 LYS CG 1 1 18 8572 1 1 27 LYS H H -1.711 2.796 1.312 1.00 . A A . 27 LYS H 1 1 18 8573 1 1 27 LYS HA H -0.665 2.020 3.932 1.00 . A A . 27 LYS HA 1 1 18 8574 1 1 27 LYS HB2 H -3.573 1.445 3.410 1.00 . A A . 27 LYS HB2 1 1 18 8575 1 1 27 LYS HB3 H -2.696 1.387 4.931 1.00 . A A . 27 LYS HB3 1 1 18 8576 1 1 27 LYS HD2 H -5.182 2.955 5.176 1.00 . A A . 27 LYS HD2 1 1 18 8577 1 1 27 LYS HD3 H -5.074 4.515 4.367 1.00 . A A . 27 LYS HD3 1 1 18 8578 1 1 27 LYS HE2 H -5.566 1.803 3.203 1.00 . A A . 27 LYS HE2 1 1 18 8579 1 1 27 LYS HE3 H -6.307 3.350 2.794 1.00 . A A . 27 LYS HE3 1 1 18 8580 1 1 27 LYS HG2 H -2.883 3.647 5.296 1.00 . A A . 27 LYS HG2 1 1 18 8581 1 1 27 LYS HG3 H -2.851 4.048 3.588 1.00 . A A . 27 LYS HG3 1 1 18 8582 1 1 27 LYS HZ1 H -4.076 2.062 1.591 1.00 . A A . 27 LYS HZ1 1 1 18 8583 1 1 27 LYS HZ2 H -3.613 3.589 2.204 1.00 . A A . 27 LYS HZ2 1 1 18 8584 1 1 27 LYS HZ3 H -4.908 3.489 1.087 1.00 . A A . 27 LYS HZ3 1 1 18 8585 1 1 27 LYS N N -1.410 2.975 2.233 1.00 . A A . 27 LYS N 1 1 18 8586 1 1 27 LYS NZ N -4.419 3.014 1.905 1.00 . A A . 27 LYS NZ 1 1 18 8587 1 1 27 LYS O O -1.594 0.426 1.331 1.00 . A A . 27 LYS O 1 1 18 8588 1 1 28 CYS C C -2.108 -2.650 3.108 1.00 . A A . 28 CYS C 1 1 18 8589 1 1 28 CYS CA C -0.873 -1.829 2.735 1.00 . A A . 28 CYS CA 1 1 18 8590 1 1 28 CYS CB C 0.398 -2.528 3.226 1.00 . A A . 28 CYS CB 1 1 18 8591 1 1 28 CYS H H -0.828 -0.350 4.254 1.00 . A A . 28 CYS H 1 1 18 8592 1 1 28 CYS HA H -0.825 -1.744 1.663 1.00 . A A . 28 CYS HA 1 1 18 8593 1 1 28 CYS HB2 H 1.131 -1.788 3.512 1.00 . A A . 28 CYS HB2 1 1 18 8594 1 1 28 CYS HB3 H 0.166 -3.153 4.076 1.00 . A A . 28 CYS HB3 1 1 18 8595 1 1 28 CYS N N -0.990 -0.488 3.300 1.00 . A A . 28 CYS N 1 1 18 8596 1 1 28 CYS O O -2.113 -3.362 4.114 1.00 . A A . 28 CYS O 1 1 18 8597 1 1 28 CYS SG S 1.057 -3.549 1.881 1.00 . A A . 28 CYS SG 1 1 18 8598 1 1 29 ASN C C -4.956 -3.909 1.273 1.00 . A A . 29 ASN C 1 1 18 8599 1 1 29 ASN CA C -4.411 -3.251 2.546 1.00 . A A . 29 ASN CA 1 1 18 8600 1 1 29 ASN CB C -5.462 -2.283 3.101 1.00 . A A . 29 ASN CB 1 1 18 8601 1 1 29 ASN CG C -4.954 -1.622 4.376 1.00 . A A . 29 ASN CG 1 1 18 8602 1 1 29 ASN H H -3.083 -1.946 1.509 1.00 . A A . 29 ASN H 1 1 18 8603 1 1 29 ASN HA H -4.229 -4.020 3.282 1.00 . A A . 29 ASN HA 1 1 18 8604 1 1 29 ASN HB2 H -5.673 -1.523 2.365 1.00 . A A . 29 ASN HB2 1 1 18 8605 1 1 29 ASN HB3 H -6.368 -2.827 3.321 1.00 . A A . 29 ASN HB3 1 1 18 8606 1 1 29 ASN HD21 H -5.594 -3.071 5.563 1.00 . A A . 29 ASN HD21 1 1 18 8607 1 1 29 ASN HD22 H -4.812 -1.782 6.342 1.00 . A A . 29 ASN HD22 1 1 18 8608 1 1 29 ASN N N -3.155 -2.533 2.293 1.00 . A A . 29 ASN N 1 1 18 8609 1 1 29 ASN ND2 N -5.134 -2.208 5.521 1.00 . A A . 29 ASN ND2 1 1 18 8610 1 1 29 ASN O O -5.046 -3.286 0.220 1.00 . A A . 29 ASN O 1 1 18 8611 1 1 29 ASN OD1 O -4.379 -0.539 4.329 1.00 . A A . 29 ASN OD1 1 1 18 8612 1 1 30 ILE C C -7.269 -5.427 -0.129 1.00 . A A . 30 ILE C 1 1 18 8613 1 1 30 ILE CA C -5.883 -5.928 0.265 1.00 . A A . 30 ILE CA 1 1 18 8614 1 1 30 ILE CB C -5.934 -7.434 0.573 1.00 . A A . 30 ILE CB 1 1 18 8615 1 1 30 ILE CD1 C -4.296 -7.501 2.450 1.00 . A A . 30 ILE CD1 1 1 18 8616 1 1 30 ILE CG1 C -5.773 -7.669 2.077 1.00 . A A . 30 ILE CG1 1 1 18 8617 1 1 30 ILE CG2 C -4.816 -8.159 -0.183 1.00 . A A . 30 ILE CG2 1 1 18 8618 1 1 30 ILE H H -5.249 -5.610 2.264 1.00 . A A . 30 ILE H 1 1 18 8619 1 1 30 ILE HA H -5.228 -5.783 -0.581 1.00 . A A . 30 ILE HA 1 1 18 8620 1 1 30 ILE HB H -6.887 -7.828 0.252 1.00 . A A . 30 ILE HB 1 1 18 8621 1 1 30 ILE HD11 H -4.217 -6.958 3.377 1.00 . A A . 30 ILE HD11 1 1 18 8622 1 1 30 ILE HD12 H -3.789 -6.953 1.666 1.00 . A A . 30 ILE HD12 1 1 18 8623 1 1 30 ILE HD13 H -3.842 -8.474 2.556 1.00 . A A . 30 ILE HD13 1 1 18 8624 1 1 30 ILE HG12 H -6.374 -6.957 2.624 1.00 . A A . 30 ILE HG12 1 1 18 8625 1 1 30 ILE HG13 H -6.092 -8.672 2.320 1.00 . A A . 30 ILE HG13 1 1 18 8626 1 1 30 ILE HG21 H -4.724 -9.167 0.196 1.00 . A A . 30 ILE HG21 1 1 18 8627 1 1 30 ILE HG22 H -3.884 -7.635 -0.040 1.00 . A A . 30 ILE HG22 1 1 18 8628 1 1 30 ILE HG23 H -5.055 -8.190 -1.236 1.00 . A A . 30 ILE HG23 1 1 18 8629 1 1 30 ILE N N -5.331 -5.173 1.393 1.00 . A A . 30 ILE N 1 1 18 8630 1 1 30 ILE O O -8.070 -5.027 0.716 1.00 . A A . 30 ILE O 1 1 18 8631 1 1 31 GLY C C -8.631 -3.764 -2.865 1.00 . A A . 31 GLY C 1 1 18 8632 1 1 31 GLY CA C -8.807 -5.003 -1.989 1.00 . A A . 31 GLY CA 1 1 18 8633 1 1 31 GLY H H -6.834 -5.786 -2.037 1.00 . A A . 31 GLY H 1 1 18 8634 1 1 31 GLY HA2 H -9.240 -5.796 -2.581 1.00 . A A . 31 GLY HA2 1 1 18 8635 1 1 31 GLY HA3 H -9.474 -4.762 -1.179 1.00 . A A . 31 GLY HA3 1 1 18 8636 1 1 31 GLY N N -7.527 -5.455 -1.433 1.00 . A A . 31 GLY N 1 1 18 8637 1 1 31 GLY O O -9.463 -3.478 -3.726 1.00 . A A . 31 GLY O 1 1 18 8638 1 1 32 LYS C C -5.778 -1.921 -3.952 1.00 . A A . 32 LYS C 1 1 18 8639 1 1 32 LYS CA C -7.225 -1.861 -3.455 1.00 . A A . 32 LYS CA 1 1 18 8640 1 1 32 LYS CB C -7.443 -0.591 -2.623 1.00 . A A . 32 LYS CB 1 1 18 8641 1 1 32 LYS CD C -7.486 1.914 -2.719 1.00 . A A . 32 LYS CD 1 1 18 8642 1 1 32 LYS CE C -7.423 3.129 -3.649 1.00 . A A . 32 LYS CE 1 1 18 8643 1 1 32 LYS CG C -7.518 0.627 -3.552 1.00 . A A . 32 LYS CG 1 1 18 8644 1 1 32 LYS H H -6.895 -3.342 -1.975 1.00 . A A . 32 LYS H 1 1 18 8645 1 1 32 LYS HA H -7.885 -1.838 -4.309 1.00 . A A . 32 LYS HA 1 1 18 8646 1 1 32 LYS HB2 H -8.366 -0.678 -2.066 1.00 . A A . 32 LYS HB2 1 1 18 8647 1 1 32 LYS HB3 H -6.623 -0.464 -1.938 1.00 . A A . 32 LYS HB3 1 1 18 8648 1 1 32 LYS HD2 H -8.378 1.972 -2.110 1.00 . A A . 32 LYS HD2 1 1 18 8649 1 1 32 LYS HD3 H -6.617 1.909 -2.079 1.00 . A A . 32 LYS HD3 1 1 18 8650 1 1 32 LYS HE2 H -6.482 3.127 -4.181 1.00 . A A . 32 LYS HE2 1 1 18 8651 1 1 32 LYS HE3 H -8.237 3.080 -4.359 1.00 . A A . 32 LYS HE3 1 1 18 8652 1 1 32 LYS HG2 H -6.676 0.615 -4.231 1.00 . A A . 32 LYS HG2 1 1 18 8653 1 1 32 LYS HG3 H -8.438 0.590 -4.119 1.00 . A A . 32 LYS HG3 1 1 18 8654 1 1 32 LYS HZ1 H -8.396 4.895 -3.113 1.00 . A A . 32 LYS HZ1 1 1 18 8655 1 1 32 LYS HZ2 H -6.692 4.986 -3.006 1.00 . A A . 32 LYS HZ2 1 1 18 8656 1 1 32 LYS HZ3 H -7.592 4.129 -1.804 1.00 . A A . 32 LYS HZ3 1 1 18 8657 1 1 32 LYS N N -7.528 -3.052 -2.662 1.00 . A A . 32 LYS N 1 1 18 8658 1 1 32 LYS NZ N -7.539 4.378 -2.840 1.00 . A A . 32 LYS NZ 1 1 18 8659 1 1 32 LYS O O -4.853 -2.118 -3.163 1.00 . A A . 32 LYS O 1 1 18 8660 1 1 33 LYS C C -3.885 -0.508 -6.536 1.00 . A A . 33 LYS C 1 1 18 8661 1 1 33 LYS CA C -4.243 -1.823 -5.843 1.00 . A A . 33 LYS CA 1 1 18 8662 1 1 33 LYS CB C -4.168 -2.983 -6.846 1.00 . A A . 33 LYS CB 1 1 18 8663 1 1 33 LYS CD C -3.207 -2.598 -9.135 1.00 . A A . 33 LYS CD 1 1 18 8664 1 1 33 LYS CE C -2.213 -1.581 -9.702 1.00 . A A . 33 LYS CE 1 1 18 8665 1 1 33 LYS CG C -2.870 -2.897 -7.665 1.00 . A A . 33 LYS CG 1 1 18 8666 1 1 33 LYS H H -6.360 -1.623 -5.848 1.00 . A A . 33 LYS H 1 1 18 8667 1 1 33 LYS HA H -3.530 -2.001 -5.054 1.00 . A A . 33 LYS HA 1 1 18 8668 1 1 33 LYS HB2 H -4.189 -3.919 -6.307 1.00 . A A . 33 LYS HB2 1 1 18 8669 1 1 33 LYS HB3 H -5.016 -2.935 -7.510 1.00 . A A . 33 LYS HB3 1 1 18 8670 1 1 33 LYS HD2 H -3.151 -3.513 -9.708 1.00 . A A . 33 LYS HD2 1 1 18 8671 1 1 33 LYS HD3 H -4.206 -2.195 -9.202 1.00 . A A . 33 LYS HD3 1 1 18 8672 1 1 33 LYS HE2 H -1.203 -1.923 -9.522 1.00 . A A . 33 LYS HE2 1 1 18 8673 1 1 33 LYS HE3 H -2.373 -1.477 -10.766 1.00 . A A . 33 LYS HE3 1 1 18 8674 1 1 33 LYS HG2 H -2.242 -2.111 -7.269 1.00 . A A . 33 LYS HG2 1 1 18 8675 1 1 33 LYS HG3 H -2.345 -3.839 -7.604 1.00 . A A . 33 LYS HG3 1 1 18 8676 1 1 33 LYS HZ1 H -1.649 -0.098 -8.327 1.00 . A A . 33 LYS HZ1 1 1 18 8677 1 1 33 LYS HZ2 H -3.352 -0.263 -8.537 1.00 . A A . 33 LYS HZ2 1 1 18 8678 1 1 33 LYS HZ3 H -2.405 0.493 -9.743 1.00 . A A . 33 LYS HZ3 1 1 18 8679 1 1 33 LYS N N -5.587 -1.766 -5.262 1.00 . A A . 33 LYS N 1 1 18 8680 1 1 33 LYS NZ N -2.422 -0.266 -9.037 1.00 . A A . 33 LYS NZ 1 1 18 8681 1 1 33 LYS O O -4.287 -0.263 -7.681 1.00 . A A . 33 LYS O 1 1 18 8682 1 1 34 ASP C C -1.443 1.468 -7.272 1.00 . A A . 34 ASP C 1 1 18 8683 1 1 34 ASP CA C -2.699 1.612 -6.406 1.00 . A A . 34 ASP CA 1 1 18 8684 1 1 34 ASP CB C -2.430 2.600 -5.274 1.00 . A A . 34 ASP CB 1 1 18 8685 1 1 34 ASP CG C -3.276 3.845 -5.475 1.00 . A A . 34 ASP CG 1 1 18 8686 1 1 34 ASP H H -2.817 0.074 -4.940 1.00 . A A . 34 ASP H 1 1 18 8687 1 1 34 ASP HA H -3.497 2.001 -7.020 1.00 . A A . 34 ASP HA 1 1 18 8688 1 1 34 ASP HB2 H -2.680 2.140 -4.329 1.00 . A A . 34 ASP HB2 1 1 18 8689 1 1 34 ASP HB3 H -1.385 2.871 -5.275 1.00 . A A . 34 ASP HB3 1 1 18 8690 1 1 34 ASP N N -3.116 0.327 -5.846 1.00 . A A . 34 ASP N 1 1 18 8691 1 1 34 ASP O O -1.020 2.461 -7.844 1.00 . A A . 34 ASP O 1 1 18 8692 1 1 34 ASP OXT O -0.934 0.359 -7.371 1.00 . A A . 34 ASP OXT 1 1 18 8693 1 1 34 ASP OD1 O -4.458 3.783 -5.192 1.00 . A A . 34 ASP OD1 1 1 18 8694 1 1 34 ASP OD2 O -2.722 4.847 -5.904 1.00 . A A . 34 ASP OD2 1 1 19 8695 1 1 1 GLY C C 10.639 8.136 -0.574 1.00 . A A . 1 GLY C 1 1 19 8696 1 1 1 GLY CA C 11.665 8.122 0.557 1.00 . A A . 1 GLY CA 1 1 19 8697 1 1 1 GLY H1 H 11.648 7.914 2.634 1.00 . A A . 1 GLY H1 1 1 19 8698 1 1 1 GLY H2 H 10.214 7.377 1.881 1.00 . A A . 1 GLY H2 1 1 19 8699 1 1 1 GLY H3 H 10.531 9.048 2.048 1.00 . A A . 1 GLY H3 1 1 19 8700 1 1 1 GLY HA2 H 12.292 8.998 0.485 1.00 . A A . 1 GLY HA2 1 1 19 8701 1 1 1 GLY HA3 H 12.276 7.236 0.472 1.00 . A A . 1 GLY HA3 1 1 19 8702 1 1 1 GLY N N 10.965 8.120 1.879 1.00 . A A . 1 GLY N 1 1 19 8703 1 1 1 GLY O O 9.773 7.269 -0.644 1.00 . A A . 1 GLY O 1 1 19 8704 1 1 2 SER C C 8.378 9.366 -2.136 1.00 . A A . 2 SER C 1 1 19 8705 1 1 2 SER CA C 9.830 9.247 -2.599 1.00 . A A . 2 SER CA 1 1 19 8706 1 1 2 SER CB C 9.967 8.042 -3.533 1.00 . A A . 2 SER CB 1 1 19 8707 1 1 2 SER H H 11.467 9.783 -1.355 1.00 . A A . 2 SER H 1 1 19 8708 1 1 2 SER HA H 10.087 10.139 -3.153 1.00 . A A . 2 SER HA 1 1 19 8709 1 1 2 SER HB2 H 10.959 8.020 -3.955 1.00 . A A . 2 SER HB2 1 1 19 8710 1 1 2 SER HB3 H 9.798 7.130 -2.972 1.00 . A A . 2 SER HB3 1 1 19 8711 1 1 2 SER HG H 9.466 8.045 -5.424 1.00 . A A . 2 SER HG 1 1 19 8712 1 1 2 SER N N 10.751 9.123 -1.462 1.00 . A A . 2 SER N 1 1 19 8713 1 1 2 SER O O 8.103 9.753 -0.999 1.00 . A A . 2 SER O 1 1 19 8714 1 1 2 SER OG O 9.008 8.155 -4.585 1.00 . A A . 2 SER OG 1 1 19 8715 1 1 3 VAL C C 5.579 7.894 -1.918 1.00 . A A . 3 VAL C 1 1 19 8716 1 1 3 VAL CA C 6.034 9.105 -2.732 1.00 . A A . 3 VAL CA 1 1 19 8717 1 1 3 VAL CB C 5.237 9.187 -4.036 1.00 . A A . 3 VAL CB 1 1 19 8718 1 1 3 VAL CG1 C 5.592 10.485 -4.764 1.00 . A A . 3 VAL CG1 1 1 19 8719 1 1 3 VAL CG2 C 5.575 7.993 -4.934 1.00 . A A . 3 VAL CG2 1 1 19 8720 1 1 3 VAL H H 7.749 8.733 -3.925 1.00 . A A . 3 VAL H 1 1 19 8721 1 1 3 VAL HA H 5.846 9.999 -2.157 1.00 . A A . 3 VAL HA 1 1 19 8722 1 1 3 VAL HB H 4.184 9.181 -3.809 1.00 . A A . 3 VAL HB 1 1 19 8723 1 1 3 VAL HG11 H 5.142 11.322 -4.251 1.00 . A A . 3 VAL HG11 1 1 19 8724 1 1 3 VAL HG12 H 5.220 10.443 -5.778 1.00 . A A . 3 VAL HG12 1 1 19 8725 1 1 3 VAL HG13 H 6.665 10.606 -4.782 1.00 . A A . 3 VAL HG13 1 1 19 8726 1 1 3 VAL HG21 H 5.070 7.112 -4.569 1.00 . A A . 3 VAL HG21 1 1 19 8727 1 1 3 VAL HG22 H 6.642 7.826 -4.928 1.00 . A A . 3 VAL HG22 1 1 19 8728 1 1 3 VAL HG23 H 5.253 8.198 -5.944 1.00 . A A . 3 VAL HG23 1 1 19 8729 1 1 3 VAL N N 7.459 9.033 -3.033 1.00 . A A . 3 VAL N 1 1 19 8730 1 1 3 VAL O O 5.873 6.743 -2.263 1.00 . A A . 3 VAL O 1 1 19 8731 1 1 4 GLY C C 3.843 5.915 -0.778 1.00 . A A . 4 GLY C 1 1 19 8732 1 1 4 GLY CA C 4.363 7.095 0.034 1.00 . A A . 4 GLY CA 1 1 19 8733 1 1 4 GLY H H 4.658 9.094 -0.610 1.00 . A A . 4 GLY H 1 1 19 8734 1 1 4 GLY HA2 H 5.168 6.756 0.671 1.00 . A A . 4 GLY HA2 1 1 19 8735 1 1 4 GLY HA3 H 3.563 7.479 0.649 1.00 . A A . 4 GLY HA3 1 1 19 8736 1 1 4 GLY N N 4.859 8.161 -0.833 1.00 . A A . 4 GLY N 1 1 19 8737 1 1 4 GLY O O 4.090 4.765 -0.435 1.00 . A A . 4 GLY O 1 1 19 8738 1 1 5 CYS C C 3.666 4.198 -3.186 1.00 . A A . 5 CYS C 1 1 19 8739 1 1 5 CYS CA C 2.571 5.145 -2.702 1.00 . A A . 5 CYS CA 1 1 19 8740 1 1 5 CYS CB C 1.832 5.750 -3.901 1.00 . A A . 5 CYS CB 1 1 19 8741 1 1 5 CYS H H 2.948 7.134 -2.092 1.00 . A A . 5 CYS H 1 1 19 8742 1 1 5 CYS HA H 1.870 4.576 -2.112 1.00 . A A . 5 CYS HA 1 1 19 8743 1 1 5 CYS HB2 H 2.502 6.391 -4.454 1.00 . A A . 5 CYS HB2 1 1 19 8744 1 1 5 CYS HB3 H 1.483 4.959 -4.541 1.00 . A A . 5 CYS HB3 1 1 19 8745 1 1 5 CYS N N 3.120 6.203 -1.860 1.00 . A A . 5 CYS N 1 1 19 8746 1 1 5 CYS O O 3.382 3.060 -3.549 1.00 . A A . 5 CYS O 1 1 19 8747 1 1 5 CYS SG S 0.419 6.719 -3.308 1.00 . A A . 5 CYS SG 1 1 19 8748 1 1 6 ALA C C 6.550 3.040 -2.361 1.00 . A A . 6 ALA C 1 1 19 8749 1 1 6 ALA CA C 6.027 3.798 -3.577 1.00 . A A . 6 ALA CA 1 1 19 8750 1 1 6 ALA CB C 7.147 4.638 -4.196 1.00 . A A . 6 ALA CB 1 1 19 8751 1 1 6 ALA H H 5.097 5.569 -2.846 1.00 . A A . 6 ALA H 1 1 19 8752 1 1 6 ALA HA H 5.674 3.087 -4.307 1.00 . A A . 6 ALA HA 1 1 19 8753 1 1 6 ALA HB1 H 7.054 4.626 -5.272 1.00 . A A . 6 ALA HB1 1 1 19 8754 1 1 6 ALA HB2 H 8.106 4.225 -3.913 1.00 . A A . 6 ALA HB2 1 1 19 8755 1 1 6 ALA HB3 H 7.076 5.656 -3.840 1.00 . A A . 6 ALA HB3 1 1 19 8756 1 1 6 ALA N N 4.915 4.653 -3.165 1.00 . A A . 6 ALA N 1 1 19 8757 1 1 6 ALA O O 6.795 1.828 -2.408 1.00 . A A . 6 ALA O 1 1 19 8758 1 1 7 GLU C C 6.064 2.243 0.545 1.00 . A A . 7 GLU C 1 1 19 8759 1 1 7 GLU CA C 7.154 3.150 -0.024 1.00 . A A . 7 GLU CA 1 1 19 8760 1 1 7 GLU CB C 7.531 4.234 0.990 1.00 . A A . 7 GLU CB 1 1 19 8761 1 1 7 GLU CD C 9.503 5.186 2.219 1.00 . A A . 7 GLU CD 1 1 19 8762 1 1 7 GLU CG C 9.054 4.409 0.989 1.00 . A A . 7 GLU CG 1 1 19 8763 1 1 7 GLU H H 6.460 4.714 -1.275 1.00 . A A . 7 GLU H 1 1 19 8764 1 1 7 GLU HA H 8.026 2.553 -0.236 1.00 . A A . 7 GLU HA 1 1 19 8765 1 1 7 GLU HB2 H 7.059 5.167 0.715 1.00 . A A . 7 GLU HB2 1 1 19 8766 1 1 7 GLU HB3 H 7.205 3.942 1.978 1.00 . A A . 7 GLU HB3 1 1 19 8767 1 1 7 GLU HG2 H 9.526 3.439 0.990 1.00 . A A . 7 GLU HG2 1 1 19 8768 1 1 7 GLU HG3 H 9.348 4.948 0.100 1.00 . A A . 7 GLU HG3 1 1 19 8769 1 1 7 GLU N N 6.691 3.760 -1.259 1.00 . A A . 7 GLU N 1 1 19 8770 1 1 7 GLU O O 6.346 1.172 1.069 1.00 . A A . 7 GLU O 1 1 19 8771 1 1 7 GLU OE1 O 9.418 6.403 2.187 1.00 . A A . 7 GLU OE1 1 1 19 8772 1 1 7 GLU OE2 O 9.936 4.556 3.170 1.00 . A A . 7 GLU OE2 1 1 19 8773 1 1 8 CYS C C 3.821 0.432 0.550 1.00 . A A . 8 CYS C 1 1 19 8774 1 1 8 CYS CA C 3.678 1.909 0.912 1.00 . A A . 8 CYS CA 1 1 19 8775 1 1 8 CYS CB C 2.371 2.477 0.360 1.00 . A A . 8 CYS CB 1 1 19 8776 1 1 8 CYS H H 4.655 3.547 -0.017 1.00 . A A . 8 CYS H 1 1 19 8777 1 1 8 CYS HA H 3.653 1.996 1.983 1.00 . A A . 8 CYS HA 1 1 19 8778 1 1 8 CYS HB2 H 2.585 3.255 -0.353 1.00 . A A . 8 CYS HB2 1 1 19 8779 1 1 8 CYS HB3 H 1.798 1.701 -0.115 1.00 . A A . 8 CYS HB3 1 1 19 8780 1 1 8 CYS N N 4.816 2.682 0.420 1.00 . A A . 8 CYS N 1 1 19 8781 1 1 8 CYS O O 3.858 -0.426 1.435 1.00 . A A . 8 CYS O 1 1 19 8782 1 1 8 CYS SG S 1.428 3.160 1.739 1.00 . A A . 8 CYS SG 1 1 19 8783 1 1 9 PRO C C 5.431 -1.847 -0.645 1.00 . A A . 9 PRO C 1 1 19 8784 1 1 9 PRO CA C 4.111 -1.294 -1.166 1.00 . A A . 9 PRO CA 1 1 19 8785 1 1 9 PRO CB C 4.099 -1.222 -2.697 1.00 . A A . 9 PRO CB 1 1 19 8786 1 1 9 PRO CD C 3.898 1.046 -1.857 1.00 . A A . 9 PRO CD 1 1 19 8787 1 1 9 PRO CG C 4.378 0.204 -3.040 1.00 . A A . 9 PRO CG 1 1 19 8788 1 1 9 PRO HA H 3.290 -1.903 -0.821 1.00 . A A . 9 PRO HA 1 1 19 8789 1 1 9 PRO HB2 H 4.869 -1.864 -3.107 1.00 . A A . 9 PRO HB2 1 1 19 8790 1 1 9 PRO HB3 H 3.133 -1.509 -3.077 1.00 . A A . 9 PRO HB3 1 1 19 8791 1 1 9 PRO HD2 H 4.566 1.877 -1.691 1.00 . A A . 9 PRO HD2 1 1 19 8792 1 1 9 PRO HD3 H 2.892 1.393 -2.024 1.00 . A A . 9 PRO HD3 1 1 19 8793 1 1 9 PRO HG2 H 5.439 0.345 -3.196 1.00 . A A . 9 PRO HG2 1 1 19 8794 1 1 9 PRO HG3 H 3.834 0.485 -3.928 1.00 . A A . 9 PRO HG3 1 1 19 8795 1 1 9 PRO N N 3.931 0.113 -0.720 1.00 . A A . 9 PRO N 1 1 19 8796 1 1 9 PRO O O 5.506 -2.994 -0.202 1.00 . A A . 9 PRO O 1 1 19 8797 1 1 10 MET C C 7.698 -1.714 1.326 1.00 . A A . 10 MET C 1 1 19 8798 1 1 10 MET CA C 7.776 -1.422 -0.175 1.00 . A A . 10 MET CA 1 1 19 8799 1 1 10 MET CB C 8.801 -0.318 -0.444 1.00 . A A . 10 MET CB 1 1 19 8800 1 1 10 MET CE C 11.578 -0.859 -3.315 1.00 . A A . 10 MET CE 1 1 19 8801 1 1 10 MET CG C 9.302 -0.415 -1.888 1.00 . A A . 10 MET CG 1 1 19 8802 1 1 10 MET H H 6.347 -0.099 -1.023 1.00 . A A . 10 MET H 1 1 19 8803 1 1 10 MET HA H 8.082 -2.321 -0.689 1.00 . A A . 10 MET HA 1 1 19 8804 1 1 10 MET HB2 H 8.337 0.643 -0.289 1.00 . A A . 10 MET HB2 1 1 19 8805 1 1 10 MET HB3 H 9.633 -0.426 0.232 1.00 . A A . 10 MET HB3 1 1 19 8806 1 1 10 MET HE1 H 12.645 -0.997 -3.222 1.00 . A A . 10 MET HE1 1 1 19 8807 1 1 10 MET HE2 H 11.349 -0.402 -4.269 1.00 . A A . 10 MET HE2 1 1 19 8808 1 1 10 MET HE3 H 11.088 -1.816 -3.249 1.00 . A A . 10 MET HE3 1 1 19 8809 1 1 10 MET HG2 H 9.280 -1.447 -2.208 1.00 . A A . 10 MET HG2 1 1 19 8810 1 1 10 MET HG3 H 8.665 0.175 -2.531 1.00 . A A . 10 MET HG3 1 1 19 8811 1 1 10 MET N N 6.468 -1.011 -0.674 1.00 . A A . 10 MET N 1 1 19 8812 1 1 10 MET O O 8.330 -2.643 1.824 1.00 . A A . 10 MET O 1 1 19 8813 1 1 10 MET SD S 10.998 0.213 -1.978 1.00 . A A . 10 MET SD 1 1 19 8814 1 1 11 HIS C C 5.775 -2.248 3.779 1.00 . A A . 11 HIS C 1 1 19 8815 1 1 11 HIS CA C 6.728 -1.083 3.480 1.00 . A A . 11 HIS CA 1 1 19 8816 1 1 11 HIS CB C 6.139 0.205 4.067 1.00 . A A . 11 HIS CB 1 1 19 8817 1 1 11 HIS CD2 C 8.007 1.955 3.484 1.00 . A A . 11 HIS CD2 1 1 19 8818 1 1 11 HIS CE1 C 8.531 2.552 5.495 1.00 . A A . 11 HIS CE1 1 1 19 8819 1 1 11 HIS CG C 7.226 1.214 4.329 1.00 . A A . 11 HIS CG 1 1 19 8820 1 1 11 HIS H H 6.420 -0.190 1.581 1.00 . A A . 11 HIS H 1 1 19 8821 1 1 11 HIS HA H 7.685 -1.276 3.940 1.00 . A A . 11 HIS HA 1 1 19 8822 1 1 11 HIS HB2 H 5.431 0.622 3.366 1.00 . A A . 11 HIS HB2 1 1 19 8823 1 1 11 HIS HB3 H 5.634 -0.022 4.991 1.00 . A A . 11 HIS HB3 1 1 19 8824 1 1 11 HIS HD2 H 7.998 1.884 2.410 1.00 . A A . 11 HIS HD2 1 1 19 8825 1 1 11 HIS HE1 H 8.996 3.048 6.334 1.00 . A A . 11 HIS HE1 1 1 19 8826 1 1 11 HIS HE2 H 9.464 3.485 3.861 1.00 . A A . 11 HIS HE2 1 1 19 8827 1 1 11 HIS N N 6.905 -0.914 2.038 1.00 . A A . 11 HIS N 1 1 19 8828 1 1 11 HIS ND1 N 7.578 1.607 5.610 1.00 . A A . 11 HIS ND1 1 1 19 8829 1 1 11 HIS NE2 N 8.826 2.802 4.218 1.00 . A A . 11 HIS NE2 1 1 19 8830 1 1 11 HIS O O 5.241 -2.355 4.889 1.00 . A A . 11 HIS O 1 1 19 8831 1 1 12 CYS C C 5.461 -5.516 3.304 1.00 . A A . 12 CYS C 1 1 19 8832 1 1 12 CYS CA C 4.671 -4.262 2.951 1.00 . A A . 12 CYS CA 1 1 19 8833 1 1 12 CYS CB C 3.861 -4.503 1.677 1.00 . A A . 12 CYS CB 1 1 19 8834 1 1 12 CYS H H 6.021 -2.977 1.930 1.00 . A A . 12 CYS H 1 1 19 8835 1 1 12 CYS HA H 3.984 -4.051 3.758 1.00 . A A . 12 CYS HA 1 1 19 8836 1 1 12 CYS HB2 H 3.924 -3.635 1.042 1.00 . A A . 12 CYS HB2 1 1 19 8837 1 1 12 CYS HB3 H 4.249 -5.365 1.157 1.00 . A A . 12 CYS HB3 1 1 19 8838 1 1 12 CYS N N 5.567 -3.114 2.790 1.00 . A A . 12 CYS N 1 1 19 8839 1 1 12 CYS O O 6.592 -5.698 2.860 1.00 . A A . 12 CYS O 1 1 19 8840 1 1 12 CYS SG S 2.132 -4.793 2.121 1.00 . A A . 12 CYS SG 1 1 19 8841 1 1 13 LYS C C 5.109 -8.800 3.777 1.00 . A A . 13 LYS C 1 1 19 8842 1 1 13 LYS CA C 5.530 -7.574 4.598 1.00 . A A . 13 LYS CA 1 1 19 8843 1 1 13 LYS CB C 5.206 -7.795 6.080 1.00 . A A . 13 LYS CB 1 1 19 8844 1 1 13 LYS CD C 5.421 -5.449 6.987 1.00 . A A . 13 LYS CD 1 1 19 8845 1 1 13 LYS CE C 6.504 -4.380 6.788 1.00 . A A . 13 LYS CE 1 1 19 8846 1 1 13 LYS CG C 6.057 -6.850 6.945 1.00 . A A . 13 LYS CG 1 1 19 8847 1 1 13 LYS H H 3.973 -6.140 4.480 1.00 . A A . 13 LYS H 1 1 19 8848 1 1 13 LYS HA H 6.599 -7.445 4.499 1.00 . A A . 13 LYS HA 1 1 19 8849 1 1 13 LYS HB2 H 4.156 -7.596 6.251 1.00 . A A . 13 LYS HB2 1 1 19 8850 1 1 13 LYS HB3 H 5.425 -8.818 6.348 1.00 . A A . 13 LYS HB3 1 1 19 8851 1 1 13 LYS HD2 H 4.683 -5.362 6.204 1.00 . A A . 13 LYS HD2 1 1 19 8852 1 1 13 LYS HD3 H 4.945 -5.300 7.945 1.00 . A A . 13 LYS HD3 1 1 19 8853 1 1 13 LYS HE2 H 7.296 -4.534 7.507 1.00 . A A . 13 LYS HE2 1 1 19 8854 1 1 13 LYS HE3 H 6.906 -4.456 5.787 1.00 . A A . 13 LYS HE3 1 1 19 8855 1 1 13 LYS HG2 H 6.117 -7.246 7.950 1.00 . A A . 13 LYS HG2 1 1 19 8856 1 1 13 LYS HG3 H 7.051 -6.781 6.529 1.00 . A A . 13 LYS HG3 1 1 19 8857 1 1 13 LYS HZ1 H 6.604 -2.397 7.435 1.00 . A A . 13 LYS HZ1 1 1 19 8858 1 1 13 LYS HZ2 H 5.066 -3.100 7.591 1.00 . A A . 13 LYS HZ2 1 1 19 8859 1 1 13 LYS HZ3 H 5.624 -2.624 6.048 1.00 . A A . 13 LYS HZ3 1 1 19 8860 1 1 13 LYS N N 4.866 -6.356 4.143 1.00 . A A . 13 LYS N 1 1 19 8861 1 1 13 LYS NZ N 5.906 -3.025 6.985 1.00 . A A . 13 LYS NZ 1 1 19 8862 1 1 13 LYS O O 3.948 -8.952 3.394 1.00 . A A . 13 LYS O 1 1 19 8863 1 1 14 GLY C C 4.586 -11.602 3.037 1.00 . A A . 14 GLY C 1 1 19 8864 1 1 14 GLY CA C 5.898 -10.883 2.719 1.00 . A A . 14 GLY CA 1 1 19 8865 1 1 14 GLY H H 6.994 -9.456 3.838 1.00 . A A . 14 GLY H 1 1 19 8866 1 1 14 GLY HA2 H 5.907 -10.628 1.670 1.00 . A A . 14 GLY HA2 1 1 19 8867 1 1 14 GLY HA3 H 6.717 -11.558 2.918 1.00 . A A . 14 GLY HA3 1 1 19 8868 1 1 14 GLY N N 6.094 -9.659 3.505 1.00 . A A . 14 GLY N 1 1 19 8869 1 1 14 GLY O O 4.168 -11.679 4.192 1.00 . A A . 14 GLY O 1 1 19 8870 1 1 15 LYS C C 1.488 -11.964 1.960 1.00 . A A . 15 LYS C 1 1 19 8871 1 1 15 LYS CA C 2.700 -12.886 2.095 1.00 . A A . 15 LYS CA 1 1 19 8872 1 1 15 LYS CB C 2.633 -13.645 3.428 1.00 . A A . 15 LYS CB 1 1 19 8873 1 1 15 LYS CD C 0.332 -14.544 3.883 1.00 . A A . 15 LYS CD 1 1 19 8874 1 1 15 LYS CE C -0.771 -15.040 2.942 1.00 . A A . 15 LYS CE 1 1 19 8875 1 1 15 LYS CG C 1.712 -14.863 3.290 1.00 . A A . 15 LYS CG 1 1 19 8876 1 1 15 LYS H H 4.373 -12.042 1.099 1.00 . A A . 15 LYS H 1 1 19 8877 1 1 15 LYS HA H 2.665 -13.607 1.291 1.00 . A A . 15 LYS HA 1 1 19 8878 1 1 15 LYS HB2 H 3.627 -13.976 3.702 1.00 . A A . 15 LYS HB2 1 1 19 8879 1 1 15 LYS HB3 H 2.251 -12.993 4.198 1.00 . A A . 15 LYS HB3 1 1 19 8880 1 1 15 LYS HD2 H 0.232 -15.033 4.842 1.00 . A A . 15 LYS HD2 1 1 19 8881 1 1 15 LYS HD3 H 0.234 -13.478 4.016 1.00 . A A . 15 LYS HD3 1 1 19 8882 1 1 15 LYS HE2 H -0.368 -15.789 2.275 1.00 . A A . 15 LYS HE2 1 1 19 8883 1 1 15 LYS HE3 H -1.573 -15.471 3.524 1.00 . A A . 15 LYS HE3 1 1 19 8884 1 1 15 LYS HG2 H 1.610 -15.121 2.246 1.00 . A A . 15 LYS HG2 1 1 19 8885 1 1 15 LYS HG3 H 2.145 -15.697 3.823 1.00 . A A . 15 LYS HG3 1 1 19 8886 1 1 15 LYS HZ1 H -1.774 -14.240 1.295 1.00 . A A . 15 LYS HZ1 1 1 19 8887 1 1 15 LYS HZ2 H -0.491 -13.263 1.863 1.00 . A A . 15 LYS HZ2 1 1 19 8888 1 1 15 LYS HZ3 H -1.966 -13.341 2.723 1.00 . A A . 15 LYS HZ3 1 1 19 8889 1 1 15 LYS N N 3.962 -12.139 1.984 1.00 . A A . 15 LYS N 1 1 19 8890 1 1 15 LYS NZ N -1.294 -13.888 2.147 1.00 . A A . 15 LYS NZ 1 1 19 8891 1 1 15 LYS O O 0.391 -12.421 1.621 1.00 . A A . 15 LYS O 1 1 19 8892 1 1 16 MET C C 1.127 -8.397 1.494 1.00 . A A . 16 MET C 1 1 19 8893 1 1 16 MET CA C 0.600 -9.697 2.101 1.00 . A A . 16 MET CA 1 1 19 8894 1 1 16 MET CB C 0.013 -9.405 3.492 1.00 . A A . 16 MET CB 1 1 19 8895 1 1 16 MET CE C -2.806 -11.374 5.213 1.00 . A A . 16 MET CE 1 1 19 8896 1 1 16 MET CG C -0.378 -10.711 4.192 1.00 . A A . 16 MET CG 1 1 19 8897 1 1 16 MET H H 2.579 -10.365 2.472 1.00 . A A . 16 MET H 1 1 19 8898 1 1 16 MET HA H -0.175 -10.100 1.469 1.00 . A A . 16 MET HA 1 1 19 8899 1 1 16 MET HB2 H 0.752 -8.888 4.089 1.00 . A A . 16 MET HB2 1 1 19 8900 1 1 16 MET HB3 H -0.862 -8.780 3.387 1.00 . A A . 16 MET HB3 1 1 19 8901 1 1 16 MET HE1 H -2.474 -12.273 5.716 1.00 . A A . 16 MET HE1 1 1 19 8902 1 1 16 MET HE2 H -3.878 -11.407 5.076 1.00 . A A . 16 MET HE2 1 1 19 8903 1 1 16 MET HE3 H -2.550 -10.515 5.811 1.00 . A A . 16 MET HE3 1 1 19 8904 1 1 16 MET HG2 H 0.358 -11.469 3.982 1.00 . A A . 16 MET HG2 1 1 19 8905 1 1 16 MET HG3 H -0.424 -10.544 5.258 1.00 . A A . 16 MET HG3 1 1 19 8906 1 1 16 MET N N 1.685 -10.673 2.212 1.00 . A A . 16 MET N 1 1 19 8907 1 1 16 MET O O 1.717 -7.581 2.200 1.00 . A A . 16 MET O 1 1 19 8908 1 1 16 MET SD S -1.997 -11.258 3.598 1.00 . A A . 16 MET SD 1 1 19 8909 1 1 17 ALA C C 0.461 -6.403 -1.482 1.00 . A A . 17 ALA C 1 1 19 8910 1 1 17 ALA CA C 1.423 -6.977 -0.444 1.00 . A A . 17 ALA CA 1 1 19 8911 1 1 17 ALA CB C 2.768 -7.237 -1.105 1.00 . A A . 17 ALA CB 1 1 19 8912 1 1 17 ALA H H 0.463 -8.875 -0.343 1.00 . A A . 17 ALA H 1 1 19 8913 1 1 17 ALA HA H 1.565 -6.235 0.325 1.00 . A A . 17 ALA HA 1 1 19 8914 1 1 17 ALA HB1 H 3.538 -7.265 -0.349 1.00 . A A . 17 ALA HB1 1 1 19 8915 1 1 17 ALA HB2 H 2.980 -6.443 -1.806 1.00 . A A . 17 ALA HB2 1 1 19 8916 1 1 17 ALA HB3 H 2.735 -8.180 -1.628 1.00 . A A . 17 ALA HB3 1 1 19 8917 1 1 17 ALA N N 0.927 -8.199 0.190 1.00 . A A . 17 ALA N 1 1 19 8918 1 1 17 ALA O O 0.248 -6.974 -2.555 1.00 . A A . 17 ALA O 1 1 19 8919 1 1 18 LYS C C -1.091 -3.059 -1.529 1.00 . A A . 18 LYS C 1 1 19 8920 1 1 18 LYS CA C -0.985 -4.505 -2.018 1.00 . A A . 18 LYS CA 1 1 19 8921 1 1 18 LYS CB C -2.379 -5.151 -2.106 1.00 . A A . 18 LYS CB 1 1 19 8922 1 1 18 LYS CD C -3.348 -7.371 -1.494 1.00 . A A . 18 LYS CD 1 1 19 8923 1 1 18 LYS CE C -2.320 -8.437 -1.888 1.00 . A A . 18 LYS CE 1 1 19 8924 1 1 18 LYS CG C -2.632 -6.126 -0.949 1.00 . A A . 18 LYS CG 1 1 19 8925 1 1 18 LYS H H 0.177 -4.856 -0.286 1.00 . A A . 18 LYS H 1 1 19 8926 1 1 18 LYS HA H -0.555 -4.494 -3.010 1.00 . A A . 18 LYS HA 1 1 19 8927 1 1 18 LYS HB2 H -3.128 -4.373 -2.077 1.00 . A A . 18 LYS HB2 1 1 19 8928 1 1 18 LYS HB3 H -2.460 -5.680 -3.041 1.00 . A A . 18 LYS HB3 1 1 19 8929 1 1 18 LYS HD2 H -4.002 -7.770 -0.735 1.00 . A A . 18 LYS HD2 1 1 19 8930 1 1 18 LYS HD3 H -3.931 -7.101 -2.362 1.00 . A A . 18 LYS HD3 1 1 19 8931 1 1 18 LYS HE2 H -1.571 -8.519 -1.113 1.00 . A A . 18 LYS HE2 1 1 19 8932 1 1 18 LYS HE3 H -2.817 -9.389 -2.008 1.00 . A A . 18 LYS HE3 1 1 19 8933 1 1 18 LYS HG2 H -1.698 -6.412 -0.493 1.00 . A A . 18 LYS HG2 1 1 19 8934 1 1 18 LYS HG3 H -3.258 -5.649 -0.212 1.00 . A A . 18 LYS HG3 1 1 19 8935 1 1 18 LYS HZ1 H -2.273 -7.381 -3.686 1.00 . A A . 18 LYS HZ1 1 1 19 8936 1 1 18 LYS HZ2 H -1.513 -8.896 -3.758 1.00 . A A . 18 LYS HZ2 1 1 19 8937 1 1 18 LYS HZ3 H -0.735 -7.592 -2.972 1.00 . A A . 18 LYS HZ3 1 1 19 8938 1 1 18 LYS N N -0.077 -5.246 -1.144 1.00 . A A . 18 LYS N 1 1 19 8939 1 1 18 LYS NZ N -1.666 -8.049 -3.174 1.00 . A A . 18 LYS NZ 1 1 19 8940 1 1 18 LYS O O -1.608 -2.799 -0.438 1.00 . A A . 18 LYS O 1 1 19 8941 1 1 19 PRO C C -1.935 0.000 -2.163 1.00 . A A . 19 PRO C 1 1 19 8942 1 1 19 PRO CA C -0.596 -0.687 -1.909 1.00 . A A . 19 PRO CA 1 1 19 8943 1 1 19 PRO CB C 0.496 -0.088 -2.792 1.00 . A A . 19 PRO CB 1 1 19 8944 1 1 19 PRO CD C 0.058 -2.330 -3.604 1.00 . A A . 19 PRO CD 1 1 19 8945 1 1 19 PRO CG C 0.491 -0.924 -4.028 1.00 . A A . 19 PRO CG 1 1 19 8946 1 1 19 PRO HA H -0.314 -0.576 -0.875 1.00 . A A . 19 PRO HA 1 1 19 8947 1 1 19 PRO HB2 H 0.266 0.943 -3.028 1.00 . A A . 19 PRO HB2 1 1 19 8948 1 1 19 PRO HB3 H 1.455 -0.158 -2.303 1.00 . A A . 19 PRO HB3 1 1 19 8949 1 1 19 PRO HD2 H -0.647 -2.738 -4.317 1.00 . A A . 19 PRO HD2 1 1 19 8950 1 1 19 PRO HD3 H 0.916 -2.977 -3.503 1.00 . A A . 19 PRO HD3 1 1 19 8951 1 1 19 PRO HG2 H -0.211 -0.516 -4.746 1.00 . A A . 19 PRO HG2 1 1 19 8952 1 1 19 PRO HG3 H 1.479 -0.961 -4.457 1.00 . A A . 19 PRO HG3 1 1 19 8953 1 1 19 PRO N N -0.583 -2.125 -2.291 1.00 . A A . 19 PRO N 1 1 19 8954 1 1 19 PRO O O -2.441 0.012 -3.289 1.00 . A A . 19 PRO O 1 1 19 8955 1 1 20 THR C C -3.439 2.820 -1.130 1.00 . A A . 20 THR C 1 1 19 8956 1 1 20 THR CA C -3.736 1.328 -1.197 1.00 . A A . 20 THR CA 1 1 19 8957 1 1 20 THR CB C -4.678 0.941 -0.054 1.00 . A A . 20 THR CB 1 1 19 8958 1 1 20 THR CG2 C -4.835 -0.578 -0.004 1.00 . A A . 20 THR CG2 1 1 19 8959 1 1 20 THR H H -2.007 0.566 -0.241 1.00 . A A . 20 THR H 1 1 19 8960 1 1 20 THR HA H -4.212 1.103 -2.138 1.00 . A A . 20 THR HA 1 1 19 8961 1 1 20 THR HB H -5.641 1.390 -0.223 1.00 . A A . 20 THR HB 1 1 19 8962 1 1 20 THR HG1 H -3.219 1.100 1.235 1.00 . A A . 20 THR HG1 1 1 19 8963 1 1 20 THR HG21 H -5.829 -0.826 0.337 1.00 . A A . 20 THR HG21 1 1 19 8964 1 1 20 THR HG22 H -4.109 -0.992 0.676 1.00 . A A . 20 THR HG22 1 1 19 8965 1 1 20 THR HG23 H -4.681 -0.992 -0.989 1.00 . A A . 20 THR HG23 1 1 19 8966 1 1 20 THR N N -2.479 0.596 -1.107 1.00 . A A . 20 THR N 1 1 19 8967 1 1 20 THR O O -2.976 3.327 -0.103 1.00 . A A . 20 THR O 1 1 19 8968 1 1 20 THR OG1 O -4.145 1.406 1.183 1.00 . A A . 20 THR OG1 1 1 19 8969 1 1 21 CYS C C -4.627 5.746 -2.705 1.00 . A A . 21 CYS C 1 1 19 8970 1 1 21 CYS CA C -3.396 4.947 -2.293 1.00 . A A . 21 CYS CA 1 1 19 8971 1 1 21 CYS CB C -2.239 5.212 -3.262 1.00 . A A . 21 CYS CB 1 1 19 8972 1 1 21 CYS H H -4.026 3.043 -3.030 1.00 . A A . 21 CYS H 1 1 19 8973 1 1 21 CYS HA H -3.094 5.278 -1.312 1.00 . A A . 21 CYS HA 1 1 19 8974 1 1 21 CYS HB2 H -2.141 4.381 -3.944 1.00 . A A . 21 CYS HB2 1 1 19 8975 1 1 21 CYS HB3 H -2.424 6.119 -3.817 1.00 . A A . 21 CYS HB3 1 1 19 8976 1 1 21 CYS N N -3.674 3.513 -2.232 1.00 . A A . 21 CYS N 1 1 19 8977 1 1 21 CYS O O -5.092 5.662 -3.841 1.00 . A A . 21 CYS O 1 1 19 8978 1 1 21 CYS SG S -0.716 5.390 -2.294 1.00 . A A . 21 CYS SG 1 1 19 8979 1 1 22 GLU C C -6.071 8.696 -1.270 1.00 . A A . 22 GLU C 1 1 19 8980 1 1 22 GLU CA C -6.280 7.370 -1.988 1.00 . A A . 22 GLU CA 1 1 19 8981 1 1 22 GLU CB C -7.553 6.680 -1.482 1.00 . A A . 22 GLU CB 1 1 19 8982 1 1 22 GLU CD C -6.998 4.293 -0.823 1.00 . A A . 22 GLU CD 1 1 19 8983 1 1 22 GLU CG C -7.218 5.726 -0.319 1.00 . A A . 22 GLU CG 1 1 19 8984 1 1 22 GLU H H -4.712 6.577 -0.896 1.00 . A A . 22 GLU H 1 1 19 8985 1 1 22 GLU HA H -6.379 7.556 -3.048 1.00 . A A . 22 GLU HA 1 1 19 8986 1 1 22 GLU HB2 H -8.257 7.425 -1.144 1.00 . A A . 22 GLU HB2 1 1 19 8987 1 1 22 GLU HB3 H -7.992 6.118 -2.288 1.00 . A A . 22 GLU HB3 1 1 19 8988 1 1 22 GLU HG2 H -6.321 6.068 0.174 1.00 . A A . 22 GLU HG2 1 1 19 8989 1 1 22 GLU HG3 H -8.033 5.731 0.390 1.00 . A A . 22 GLU HG3 1 1 19 8990 1 1 22 GLU N N -5.132 6.537 -1.764 1.00 . A A . 22 GLU N 1 1 19 8991 1 1 22 GLU O O -5.550 8.744 -0.157 1.00 . A A . 22 GLU O 1 1 19 8992 1 1 22 GLU OE1 O -6.973 4.085 -2.031 1.00 . A A . 22 GLU OE1 1 1 19 8993 1 1 22 GLU OE2 O -6.837 3.418 0.016 1.00 . A A . 22 GLU OE2 1 1 19 8994 1 1 23 ASN C C -4.986 11.311 -0.690 1.00 . A A . 23 ASN C 1 1 19 8995 1 1 23 ASN CA C -6.323 11.117 -1.408 1.00 . A A . 23 ASN CA 1 1 19 8996 1 1 23 ASN CB C -7.482 11.446 -0.453 1.00 . A A . 23 ASN CB 1 1 19 8997 1 1 23 ASN CG C -7.959 10.197 0.279 1.00 . A A . 23 ASN CG 1 1 19 8998 1 1 23 ASN H H -6.834 9.613 -2.817 1.00 . A A . 23 ASN H 1 1 19 8999 1 1 23 ASN HA H -6.362 11.808 -2.239 1.00 . A A . 23 ASN HA 1 1 19 9000 1 1 23 ASN HB2 H -7.150 12.174 0.272 1.00 . A A . 23 ASN HB2 1 1 19 9001 1 1 23 ASN HB3 H -8.298 11.859 -1.020 1.00 . A A . 23 ASN HB3 1 1 19 9002 1 1 23 ASN HD21 H -9.166 9.627 -1.182 1.00 . A A . 23 ASN HD21 1 1 19 9003 1 1 23 ASN HD22 H -9.133 8.610 0.175 1.00 . A A . 23 ASN HD22 1 1 19 9004 1 1 23 ASN N N -6.459 9.753 -1.937 1.00 . A A . 23 ASN N 1 1 19 9005 1 1 23 ASN ND2 N -8.825 9.413 -0.291 1.00 . A A . 23 ASN ND2 1 1 19 9006 1 1 23 ASN O O -4.937 11.819 0.431 1.00 . A A . 23 ASN O 1 1 19 9007 1 1 23 ASN OD1 O -7.545 9.935 1.404 1.00 . A A . 23 ASN OD1 1 1 19 9008 1 1 24 GLU C C -2.347 10.131 0.405 1.00 . A A . 24 GLU C 1 1 19 9009 1 1 24 GLU CA C -2.560 11.058 -0.791 1.00 . A A . 24 GLU CA 1 1 19 9010 1 1 24 GLU CB C -2.301 12.515 -0.376 1.00 . A A . 24 GLU CB 1 1 19 9011 1 1 24 GLU CD C -1.922 12.882 -2.834 1.00 . A A . 24 GLU CD 1 1 19 9012 1 1 24 GLU CG C -2.559 13.448 -1.568 1.00 . A A . 24 GLU CG 1 1 19 9013 1 1 24 GLU H H -4.009 10.532 -2.247 1.00 . A A . 24 GLU H 1 1 19 9014 1 1 24 GLU HA H -1.849 10.791 -1.555 1.00 . A A . 24 GLU HA 1 1 19 9015 1 1 24 GLU HB2 H -2.956 12.781 0.440 1.00 . A A . 24 GLU HB2 1 1 19 9016 1 1 24 GLU HB3 H -1.274 12.618 -0.060 1.00 . A A . 24 GLU HB3 1 1 19 9017 1 1 24 GLU HG2 H -3.623 13.549 -1.719 1.00 . A A . 24 GLU HG2 1 1 19 9018 1 1 24 GLU HG3 H -2.134 14.418 -1.362 1.00 . A A . 24 GLU HG3 1 1 19 9019 1 1 24 GLU N N -3.905 10.916 -1.353 1.00 . A A . 24 GLU N 1 1 19 9020 1 1 24 GLU O O -1.288 10.159 1.036 1.00 . A A . 24 GLU O 1 1 19 9021 1 1 24 GLU OE1 O -0.765 13.176 -3.074 1.00 . A A . 24 GLU OE1 1 1 19 9022 1 1 24 GLU OE2 O -2.604 12.157 -3.542 1.00 . A A . 24 GLU OE2 1 1 19 9023 1 1 25 VAL C C -2.805 6.998 1.320 1.00 . A A . 25 VAL C 1 1 19 9024 1 1 25 VAL CA C -3.214 8.375 1.832 1.00 . A A . 25 VAL CA 1 1 19 9025 1 1 25 VAL CB C -4.543 8.286 2.593 1.00 . A A . 25 VAL CB 1 1 19 9026 1 1 25 VAL CG1 C -4.395 7.342 3.788 1.00 . A A . 25 VAL CG1 1 1 19 9027 1 1 25 VAL CG2 C -4.933 9.678 3.100 1.00 . A A . 25 VAL CG2 1 1 19 9028 1 1 25 VAL H H -4.168 9.304 0.176 1.00 . A A . 25 VAL H 1 1 19 9029 1 1 25 VAL HA H -2.451 8.740 2.505 1.00 . A A . 25 VAL HA 1 1 19 9030 1 1 25 VAL HB H -5.314 7.913 1.932 1.00 . A A . 25 VAL HB 1 1 19 9031 1 1 25 VAL HG11 H -5.340 7.271 4.308 1.00 . A A . 25 VAL HG11 1 1 19 9032 1 1 25 VAL HG12 H -3.645 7.729 4.461 1.00 . A A . 25 VAL HG12 1 1 19 9033 1 1 25 VAL HG13 H -4.099 6.364 3.444 1.00 . A A . 25 VAL HG13 1 1 19 9034 1 1 25 VAL HG21 H -4.080 10.143 3.572 1.00 . A A . 25 VAL HG21 1 1 19 9035 1 1 25 VAL HG22 H -5.737 9.588 3.817 1.00 . A A . 25 VAL HG22 1 1 19 9036 1 1 25 VAL HG23 H -5.261 10.286 2.269 1.00 . A A . 25 VAL HG23 1 1 19 9037 1 1 25 VAL N N -3.340 9.300 0.712 1.00 . A A . 25 VAL N 1 1 19 9038 1 1 25 VAL O O -3.635 6.214 0.848 1.00 . A A . 25 VAL O 1 1 19 9039 1 1 26 CYS C C -0.899 4.448 2.103 1.00 . A A . 26 CYS C 1 1 19 9040 1 1 26 CYS CA C -0.971 5.444 0.955 1.00 . A A . 26 CYS CA 1 1 19 9041 1 1 26 CYS CB C 0.430 5.643 0.366 1.00 . A A . 26 CYS CB 1 1 19 9042 1 1 26 CYS H H -0.898 7.385 1.788 1.00 . A A . 26 CYS H 1 1 19 9043 1 1 26 CYS HA H -1.616 5.049 0.187 1.00 . A A . 26 CYS HA 1 1 19 9044 1 1 26 CYS HB2 H 0.533 5.037 -0.514 1.00 . A A . 26 CYS HB2 1 1 19 9045 1 1 26 CYS HB3 H 0.571 6.675 0.102 1.00 . A A . 26 CYS HB3 1 1 19 9046 1 1 26 CYS N N -1.507 6.718 1.412 1.00 . A A . 26 CYS N 1 1 19 9047 1 1 26 CYS O O -0.433 4.773 3.195 1.00 . A A . 26 CYS O 1 1 19 9048 1 1 26 CYS SG S 1.686 5.154 1.571 1.00 . A A . 26 CYS SG 1 1 19 9049 1 1 27 LYS C C -1.333 0.815 2.205 1.00 . A A . 27 LYS C 1 1 19 9050 1 1 27 LYS CA C -1.346 2.189 2.866 1.00 . A A . 27 LYS CA 1 1 19 9051 1 1 27 LYS CB C -2.586 2.273 3.769 1.00 . A A . 27 LYS CB 1 1 19 9052 1 1 27 LYS CD C -4.772 3.472 3.885 1.00 . A A . 27 LYS CD 1 1 19 9053 1 1 27 LYS CE C -5.547 4.026 2.684 1.00 . A A . 27 LYS CE 1 1 19 9054 1 1 27 LYS CG C -3.264 3.646 3.671 1.00 . A A . 27 LYS CG 1 1 19 9055 1 1 27 LYS H H -1.735 3.033 0.958 1.00 . A A . 27 LYS H 1 1 19 9056 1 1 27 LYS HA H -0.460 2.303 3.472 1.00 . A A . 27 LYS HA 1 1 19 9057 1 1 27 LYS HB2 H -3.290 1.508 3.475 1.00 . A A . 27 LYS HB2 1 1 19 9058 1 1 27 LYS HB3 H -2.285 2.100 4.791 1.00 . A A . 27 LYS HB3 1 1 19 9059 1 1 27 LYS HD2 H -4.999 2.421 4.002 1.00 . A A . 27 LYS HD2 1 1 19 9060 1 1 27 LYS HD3 H -5.071 4.003 4.776 1.00 . A A . 27 LYS HD3 1 1 19 9061 1 1 27 LYS HE2 H -6.589 3.751 2.772 1.00 . A A . 27 LYS HE2 1 1 19 9062 1 1 27 LYS HE3 H -5.464 5.104 2.669 1.00 . A A . 27 LYS HE3 1 1 19 9063 1 1 27 LYS HG2 H -2.863 4.302 4.430 1.00 . A A . 27 LYS HG2 1 1 19 9064 1 1 27 LYS HG3 H -3.092 4.075 2.698 1.00 . A A . 27 LYS HG3 1 1 19 9065 1 1 27 LYS HZ1 H -5.780 3.414 0.692 1.00 . A A . 27 LYS HZ1 1 1 19 9066 1 1 27 LYS HZ2 H -4.611 2.490 1.565 1.00 . A A . 27 LYS HZ2 1 1 19 9067 1 1 27 LYS HZ3 H -4.238 4.087 1.050 1.00 . A A . 27 LYS HZ3 1 1 19 9068 1 1 27 LYS N N -1.367 3.232 1.847 1.00 . A A . 27 LYS N 1 1 19 9069 1 1 27 LYS NZ N -4.998 3.468 1.411 1.00 . A A . 27 LYS NZ 1 1 19 9070 1 1 27 LYS O O -1.952 0.621 1.162 1.00 . A A . 27 LYS O 1 1 19 9071 1 1 28 CYS C C -1.779 -2.296 2.918 1.00 . A A . 28 CYS C 1 1 19 9072 1 1 28 CYS CA C -0.641 -1.502 2.293 1.00 . A A . 28 CYS CA 1 1 19 9073 1 1 28 CYS CB C 0.696 -2.178 2.601 1.00 . A A . 28 CYS CB 1 1 19 9074 1 1 28 CYS H H -0.219 0.048 3.676 1.00 . A A . 28 CYS H 1 1 19 9075 1 1 28 CYS HA H -0.781 -1.463 1.224 1.00 . A A . 28 CYS HA 1 1 19 9076 1 1 28 CYS HB2 H 1.461 -1.425 2.719 1.00 . A A . 28 CYS HB2 1 1 19 9077 1 1 28 CYS HB3 H 0.610 -2.751 3.513 1.00 . A A . 28 CYS HB3 1 1 19 9078 1 1 28 CYS N N -0.668 -0.146 2.830 1.00 . A A . 28 CYS N 1 1 19 9079 1 1 28 CYS O O -1.662 -2.772 4.045 1.00 . A A . 28 CYS O 1 1 19 9080 1 1 28 CYS SG S 1.135 -3.280 1.234 1.00 . A A . 28 CYS SG 1 1 19 9081 1 1 29 ASN C C -4.569 -4.160 1.722 1.00 . A A . 29 ASN C 1 1 19 9082 1 1 29 ASN CA C -4.048 -3.133 2.716 1.00 . A A . 29 ASN CA 1 1 19 9083 1 1 29 ASN CB C -5.173 -2.151 3.068 1.00 . A A . 29 ASN CB 1 1 19 9084 1 1 29 ASN CG C -6.149 -2.816 4.035 1.00 . A A . 29 ASN CG 1 1 19 9085 1 1 29 ASN H H -2.930 -2.005 1.304 1.00 . A A . 29 ASN H 1 1 19 9086 1 1 29 ASN HA H -3.755 -3.645 3.614 1.00 . A A . 29 ASN HA 1 1 19 9087 1 1 29 ASN HB2 H -4.752 -1.273 3.530 1.00 . A A . 29 ASN HB2 1 1 19 9088 1 1 29 ASN HB3 H -5.699 -1.869 2.170 1.00 . A A . 29 ASN HB3 1 1 19 9089 1 1 29 ASN HD21 H -7.636 -1.568 3.648 1.00 . A A . 29 ASN HD21 1 1 19 9090 1 1 29 ASN HD22 H -7.979 -2.776 4.788 1.00 . A A . 29 ASN HD22 1 1 19 9091 1 1 29 ASN N N -2.888 -2.415 2.194 1.00 . A A . 29 ASN N 1 1 19 9092 1 1 29 ASN ND2 N -7.354 -2.346 4.167 1.00 . A A . 29 ASN ND2 1 1 19 9093 1 1 29 ASN O O -4.623 -3.914 0.518 1.00 . A A . 29 ASN O 1 1 19 9094 1 1 29 ASN OD1 O -5.803 -3.797 4.686 1.00 . A A . 29 ASN OD1 1 1 19 9095 1 1 30 ILE C C -6.941 -6.022 0.986 1.00 . A A . 30 ILE C 1 1 19 9096 1 1 30 ILE CA C -5.521 -6.365 1.411 1.00 . A A . 30 ILE CA 1 1 19 9097 1 1 30 ILE CB C -5.483 -7.723 2.139 1.00 . A A . 30 ILE CB 1 1 19 9098 1 1 30 ILE CD1 C -3.822 -7.085 3.892 1.00 . A A . 30 ILE CD1 1 1 19 9099 1 1 30 ILE CG1 C -5.273 -7.510 3.642 1.00 . A A . 30 ILE CG1 1 1 19 9100 1 1 30 ILE CG2 C -4.344 -8.587 1.581 1.00 . A A . 30 ILE CG2 1 1 19 9101 1 1 30 ILE H H -4.931 -5.429 3.215 1.00 . A A . 30 ILE H 1 1 19 9102 1 1 30 ILE HA H -4.915 -6.438 0.523 1.00 . A A . 30 ILE HA 1 1 19 9103 1 1 30 ILE HB H -6.421 -8.236 1.982 1.00 . A A . 30 ILE HB 1 1 19 9104 1 1 30 ILE HD11 H -3.356 -7.786 4.567 1.00 . A A . 30 ILE HD11 1 1 19 9105 1 1 30 ILE HD12 H -3.805 -6.098 4.327 1.00 . A A . 30 ILE HD12 1 1 19 9106 1 1 30 ILE HD13 H -3.282 -7.073 2.955 1.00 . A A . 30 ILE HD13 1 1 19 9107 1 1 30 ILE HG12 H -5.945 -6.741 3.997 1.00 . A A . 30 ILE HG12 1 1 19 9108 1 1 30 ILE HG13 H -5.471 -8.432 4.167 1.00 . A A . 30 ILE HG13 1 1 19 9109 1 1 30 ILE HG21 H -4.674 -9.078 0.678 1.00 . A A . 30 ILE HG21 1 1 19 9110 1 1 30 ILE HG22 H -4.065 -9.331 2.313 1.00 . A A . 30 ILE HG22 1 1 19 9111 1 1 30 ILE HG23 H -3.491 -7.961 1.362 1.00 . A A . 30 ILE HG23 1 1 19 9112 1 1 30 ILE N N -4.977 -5.305 2.246 1.00 . A A . 30 ILE N 1 1 19 9113 1 1 30 ILE O O -7.737 -5.507 1.770 1.00 . A A . 30 ILE O 1 1 19 9114 1 1 31 GLY C C -8.490 -4.892 -1.864 1.00 . A A . 31 GLY C 1 1 19 9115 1 1 31 GLY CA C -8.556 -6.018 -0.835 1.00 . A A . 31 GLY CA 1 1 19 9116 1 1 31 GLY H H -6.550 -6.704 -0.837 1.00 . A A . 31 GLY H 1 1 19 9117 1 1 31 GLY HA2 H -8.944 -6.909 -1.307 1.00 . A A . 31 GLY HA2 1 1 19 9118 1 1 31 GLY HA3 H -9.219 -5.722 -0.039 1.00 . A A . 31 GLY HA3 1 1 19 9119 1 1 31 GLY N N -7.238 -6.303 -0.273 1.00 . A A . 31 GLY N 1 1 19 9120 1 1 31 GLY O O -9.364 -4.778 -2.720 1.00 . A A . 31 GLY O 1 1 19 9121 1 1 32 LYS C C -5.809 -2.819 -3.127 1.00 . A A . 32 LYS C 1 1 19 9122 1 1 32 LYS CA C -7.273 -2.969 -2.727 1.00 . A A . 32 LYS CA 1 1 19 9123 1 1 32 LYS CB C -7.771 -1.654 -2.111 1.00 . A A . 32 LYS CB 1 1 19 9124 1 1 32 LYS CD C -7.227 0.653 -2.976 1.00 . A A . 32 LYS CD 1 1 19 9125 1 1 32 LYS CE C -7.622 1.723 -3.997 1.00 . A A . 32 LYS CE 1 1 19 9126 1 1 32 LYS CG C -8.036 -0.630 -3.229 1.00 . A A . 32 LYS CG 1 1 19 9127 1 1 32 LYS H H -6.774 -4.219 -1.085 1.00 . A A . 32 LYS H 1 1 19 9128 1 1 32 LYS HA H -7.854 -3.179 -3.611 1.00 . A A . 32 LYS HA 1 1 19 9129 1 1 32 LYS HB2 H -8.687 -1.840 -1.568 1.00 . A A . 32 LYS HB2 1 1 19 9130 1 1 32 LYS HB3 H -7.025 -1.264 -1.437 1.00 . A A . 32 LYS HB3 1 1 19 9131 1 1 32 LYS HD2 H -7.425 1.018 -1.978 1.00 . A A . 32 LYS HD2 1 1 19 9132 1 1 32 LYS HD3 H -6.173 0.440 -3.078 1.00 . A A . 32 LYS HD3 1 1 19 9133 1 1 32 LYS HE2 H -7.642 1.285 -4.987 1.00 . A A . 32 LYS HE2 1 1 19 9134 1 1 32 LYS HE3 H -8.604 2.109 -3.753 1.00 . A A . 32 LYS HE3 1 1 19 9135 1 1 32 LYS HG2 H -7.746 -1.052 -4.180 1.00 . A A . 32 LYS HG2 1 1 19 9136 1 1 32 LYS HG3 H -9.091 -0.389 -3.249 1.00 . A A . 32 LYS HG3 1 1 19 9137 1 1 32 LYS HZ1 H -6.826 3.479 -3.140 1.00 . A A . 32 LYS HZ1 1 1 19 9138 1 1 32 LYS HZ2 H -6.672 3.376 -4.849 1.00 . A A . 32 LYS HZ2 1 1 19 9139 1 1 32 LYS HZ3 H -5.646 2.432 -3.867 1.00 . A A . 32 LYS HZ3 1 1 19 9140 1 1 32 LYS N N -7.445 -4.074 -1.783 1.00 . A A . 32 LYS N 1 1 19 9141 1 1 32 LYS NZ N -6.625 2.832 -3.963 1.00 . A A . 32 LYS NZ 1 1 19 9142 1 1 32 LYS O O -4.913 -2.916 -2.289 1.00 . A A . 32 LYS O 1 1 19 9143 1 1 33 LYS C C -4.165 -1.332 -5.997 1.00 . A A . 33 LYS C 1 1 19 9144 1 1 33 LYS CA C -4.212 -2.406 -4.906 1.00 . A A . 33 LYS CA 1 1 19 9145 1 1 33 LYS CB C -3.663 -3.752 -5.422 1.00 . A A . 33 LYS CB 1 1 19 9146 1 1 33 LYS CD C -3.029 -3.568 -7.844 1.00 . A A . 33 LYS CD 1 1 19 9147 1 1 33 LYS CE C -3.665 -3.111 -9.159 1.00 . A A . 33 LYS CE 1 1 19 9148 1 1 33 LYS CG C -4.121 -4.025 -6.863 1.00 . A A . 33 LYS CG 1 1 19 9149 1 1 33 LYS H H -6.324 -2.508 -5.034 1.00 . A A . 33 LYS H 1 1 19 9150 1 1 33 LYS HA H -3.589 -2.078 -4.084 1.00 . A A . 33 LYS HA 1 1 19 9151 1 1 33 LYS HB2 H -2.583 -3.732 -5.389 1.00 . A A . 33 LYS HB2 1 1 19 9152 1 1 33 LYS HB3 H -4.019 -4.545 -4.781 1.00 . A A . 33 LYS HB3 1 1 19 9153 1 1 33 LYS HD2 H -2.477 -2.746 -7.410 1.00 . A A . 33 LYS HD2 1 1 19 9154 1 1 33 LYS HD3 H -2.355 -4.388 -8.040 1.00 . A A . 33 LYS HD3 1 1 19 9155 1 1 33 LYS HE2 H -2.960 -3.253 -9.969 1.00 . A A . 33 LYS HE2 1 1 19 9156 1 1 33 LYS HE3 H -4.556 -3.690 -9.351 1.00 . A A . 33 LYS HE3 1 1 19 9157 1 1 33 LYS HG2 H -4.292 -5.085 -6.988 1.00 . A A . 33 LYS HG2 1 1 19 9158 1 1 33 LYS HG3 H -5.036 -3.491 -7.064 1.00 . A A . 33 LYS HG3 1 1 19 9159 1 1 33 LYS HZ1 H -3.130 -1.086 -8.949 1.00 . A A . 33 LYS HZ1 1 1 19 9160 1 1 33 LYS HZ2 H -4.620 -1.518 -8.197 1.00 . A A . 33 LYS HZ2 1 1 19 9161 1 1 33 LYS HZ3 H -4.531 -1.364 -9.899 1.00 . A A . 33 LYS HZ3 1 1 19 9162 1 1 33 LYS N N -5.572 -2.577 -4.410 1.00 . A A . 33 LYS N 1 1 19 9163 1 1 33 LYS NZ N -4.018 -1.668 -9.050 1.00 . A A . 33 LYS NZ 1 1 19 9164 1 1 33 LYS O O -4.901 -1.395 -6.989 1.00 . A A . 33 LYS O 1 1 19 9165 1 1 34 ASP C C -2.001 0.463 -7.722 1.00 . A A . 34 ASP C 1 1 19 9166 1 1 34 ASP CA C -3.170 0.744 -6.767 1.00 . A A . 34 ASP CA 1 1 19 9167 1 1 34 ASP CB C -2.962 2.067 -6.022 1.00 . A A . 34 ASP CB 1 1 19 9168 1 1 34 ASP CG C -4.256 2.494 -5.341 1.00 . A A . 34 ASP CG 1 1 19 9169 1 1 34 ASP H H -2.754 -0.331 -4.988 1.00 . A A . 34 ASP H 1 1 19 9170 1 1 34 ASP HA H -4.079 0.812 -7.347 1.00 . A A . 34 ASP HA 1 1 19 9171 1 1 34 ASP HB2 H -2.191 1.940 -5.277 1.00 . A A . 34 ASP HB2 1 1 19 9172 1 1 34 ASP HB3 H -2.660 2.830 -6.724 1.00 . A A . 34 ASP HB3 1 1 19 9173 1 1 34 ASP N N -3.304 -0.340 -5.801 1.00 . A A . 34 ASP N 1 1 19 9174 1 1 34 ASP O O -0.947 1.056 -7.548 1.00 . A A . 34 ASP O 1 1 19 9175 1 1 34 ASP OXT O -2.177 -0.359 -8.612 1.00 . A A . 34 ASP OXT 1 1 19 9176 1 1 34 ASP OD1 O -5.086 3.095 -6.000 1.00 . A A . 34 ASP OD1 1 1 19 9177 1 1 34 ASP OD2 O -4.405 2.212 -4.158 1.00 . A A . 34 ASP OD2 1 1 20 9178 1 1 1 GLY C C 0.572 11.485 -5.449 1.00 . A A . 1 GLY C 1 1 20 9179 1 1 1 GLY CA C -0.821 11.159 -5.977 1.00 . A A . 1 GLY CA 1 1 20 9180 1 1 1 GLY H1 H -2.111 12.581 -6.800 1.00 . A A . 1 GLY H1 1 1 20 9181 1 1 1 GLY H2 H -1.103 13.183 -5.566 1.00 . A A . 1 GLY H2 1 1 20 9182 1 1 1 GLY H3 H -2.442 12.206 -5.169 1.00 . A A . 1 GLY H3 1 1 20 9183 1 1 1 GLY HA2 H -1.253 10.359 -5.390 1.00 . A A . 1 GLY HA2 1 1 20 9184 1 1 1 GLY HA3 H -0.746 10.850 -7.009 1.00 . A A . 1 GLY HA3 1 1 20 9185 1 1 1 GLY N N -1.683 12.372 -5.877 1.00 . A A . 1 GLY N 1 1 20 9186 1 1 1 GLY O O 1.217 12.415 -5.931 1.00 . A A . 1 GLY O 1 1 20 9187 1 1 2 SER C C 3.259 9.741 -4.098 1.00 . A A . 2 SER C 1 1 20 9188 1 1 2 SER CA C 2.347 10.945 -3.867 1.00 . A A . 2 SER CA 1 1 20 9189 1 1 2 SER CB C 2.212 11.196 -2.366 1.00 . A A . 2 SER CB 1 1 20 9190 1 1 2 SER H H 0.464 9.997 -4.112 1.00 . A A . 2 SER H 1 1 20 9191 1 1 2 SER HA H 2.797 11.814 -4.325 1.00 . A A . 2 SER HA 1 1 20 9192 1 1 2 SER HB2 H 1.698 12.130 -2.199 1.00 . A A . 2 SER HB2 1 1 20 9193 1 1 2 SER HB3 H 1.644 10.391 -1.916 1.00 . A A . 2 SER HB3 1 1 20 9194 1 1 2 SER HG H 3.479 11.885 -1.048 1.00 . A A . 2 SER HG 1 1 20 9195 1 1 2 SER N N 1.026 10.722 -4.456 1.00 . A A . 2 SER N 1 1 20 9196 1 1 2 SER O O 2.939 8.843 -4.878 1.00 . A A . 2 SER O 1 1 20 9197 1 1 2 SER OG O 3.512 11.261 -1.782 1.00 . A A . 2 SER OG 1 1 20 9198 1 1 3 VAL C C 4.952 7.486 -2.589 1.00 . A A . 3 VAL C 1 1 20 9199 1 1 3 VAL CA C 5.349 8.631 -3.517 1.00 . A A . 3 VAL CA 1 1 20 9200 1 1 3 VAL CB C 6.775 9.107 -3.176 1.00 . A A . 3 VAL CB 1 1 20 9201 1 1 3 VAL CG1 C 7.638 9.107 -4.441 1.00 . A A . 3 VAL CG1 1 1 20 9202 1 1 3 VAL CG2 C 6.743 10.529 -2.602 1.00 . A A . 3 VAL CG2 1 1 20 9203 1 1 3 VAL H H 4.575 10.475 -2.782 1.00 . A A . 3 VAL H 1 1 20 9204 1 1 3 VAL HA H 5.338 8.267 -4.534 1.00 . A A . 3 VAL HA 1 1 20 9205 1 1 3 VAL HB H 7.213 8.435 -2.448 1.00 . A A . 3 VAL HB 1 1 20 9206 1 1 3 VAL HG11 H 8.309 9.954 -4.419 1.00 . A A . 3 VAL HG11 1 1 20 9207 1 1 3 VAL HG12 H 7.005 9.174 -5.313 1.00 . A A . 3 VAL HG12 1 1 20 9208 1 1 3 VAL HG13 H 8.214 8.194 -4.482 1.00 . A A . 3 VAL HG13 1 1 20 9209 1 1 3 VAL HG21 H 6.173 10.536 -1.687 1.00 . A A . 3 VAL HG21 1 1 20 9210 1 1 3 VAL HG22 H 6.288 11.198 -3.318 1.00 . A A . 3 VAL HG22 1 1 20 9211 1 1 3 VAL HG23 H 7.754 10.855 -2.399 1.00 . A A . 3 VAL HG23 1 1 20 9212 1 1 3 VAL N N 4.389 9.730 -3.401 1.00 . A A . 3 VAL N 1 1 20 9213 1 1 3 VAL O O 5.170 6.316 -2.901 1.00 . A A . 3 VAL O 1 1 20 9214 1 1 4 GLY C C 3.401 5.573 -1.159 1.00 . A A . 4 GLY C 1 1 20 9215 1 1 4 GLY CA C 3.914 6.834 -0.474 1.00 . A A . 4 GLY CA 1 1 20 9216 1 1 4 GLY H H 4.200 8.785 -1.266 1.00 . A A . 4 GLY H 1 1 20 9217 1 1 4 GLY HA2 H 4.745 6.572 0.165 1.00 . A A . 4 GLY HA2 1 1 20 9218 1 1 4 GLY HA3 H 3.121 7.250 0.130 1.00 . A A . 4 GLY HA3 1 1 20 9219 1 1 4 GLY N N 4.353 7.836 -1.451 1.00 . A A . 4 GLY N 1 1 20 9220 1 1 4 GLY O O 3.651 4.463 -0.700 1.00 . A A . 4 GLY O 1 1 20 9221 1 1 5 CYS C C 3.251 3.659 -3.423 1.00 . A A . 5 CYS C 1 1 20 9222 1 1 5 CYS CA C 2.141 4.618 -3.002 1.00 . A A . 5 CYS CA 1 1 20 9223 1 1 5 CYS CB C 1.385 5.112 -4.238 1.00 . A A . 5 CYS CB 1 1 20 9224 1 1 5 CYS H H 2.511 6.655 -2.587 1.00 . A A . 5 CYS H 1 1 20 9225 1 1 5 CYS HA H 1.455 4.088 -2.360 1.00 . A A . 5 CYS HA 1 1 20 9226 1 1 5 CYS HB2 H 2.090 5.506 -4.957 1.00 . A A . 5 CYS HB2 1 1 20 9227 1 1 5 CYS HB3 H 0.850 4.290 -4.678 1.00 . A A . 5 CYS HB3 1 1 20 9228 1 1 5 CYS N N 2.681 5.751 -2.263 1.00 . A A . 5 CYS N 1 1 20 9229 1 1 5 CYS O O 3.008 2.473 -3.619 1.00 . A A . 5 CYS O 1 1 20 9230 1 1 5 CYS SG S 0.220 6.416 -3.759 1.00 . A A . 5 CYS SG 1 1 20 9231 1 1 6 ALA C C 6.197 2.716 -2.637 1.00 . A A . 6 ALA C 1 1 20 9232 1 1 6 ALA CA C 5.619 3.349 -3.899 1.00 . A A . 6 ALA CA 1 1 20 9233 1 1 6 ALA CB C 6.686 4.200 -4.595 1.00 . A A . 6 ALA CB 1 1 20 9234 1 1 6 ALA H H 4.607 5.136 -3.346 1.00 . A A . 6 ALA H 1 1 20 9235 1 1 6 ALA HA H 5.295 2.567 -4.567 1.00 . A A . 6 ALA HA 1 1 20 9236 1 1 6 ALA HB1 H 6.616 4.062 -5.664 1.00 . A A . 6 ALA HB1 1 1 20 9237 1 1 6 ALA HB2 H 7.667 3.898 -4.257 1.00 . A A . 6 ALA HB2 1 1 20 9238 1 1 6 ALA HB3 H 6.529 5.242 -4.357 1.00 . A A . 6 ALA HB3 1 1 20 9239 1 1 6 ALA N N 4.470 4.177 -3.534 1.00 . A A . 6 ALA N 1 1 20 9240 1 1 6 ALA O O 6.543 1.529 -2.608 1.00 . A A . 6 ALA O 1 1 20 9241 1 1 7 GLU C C 5.759 2.083 0.327 1.00 . A A . 7 GLU C 1 1 20 9242 1 1 7 GLU CA C 6.775 3.033 -0.303 1.00 . A A . 7 GLU CA 1 1 20 9243 1 1 7 GLU CB C 7.032 4.210 0.643 1.00 . A A . 7 GLU CB 1 1 20 9244 1 1 7 GLU CD C 7.619 6.069 -0.927 1.00 . A A . 7 GLU CD 1 1 20 9245 1 1 7 GLU CG C 8.167 5.075 0.088 1.00 . A A . 7 GLU CG 1 1 20 9246 1 1 7 GLU H H 5.964 4.447 -1.665 1.00 . A A . 7 GLU H 1 1 20 9247 1 1 7 GLU HA H 7.700 2.505 -0.465 1.00 . A A . 7 GLU HA 1 1 20 9248 1 1 7 GLU HB2 H 6.134 4.805 0.729 1.00 . A A . 7 GLU HB2 1 1 20 9249 1 1 7 GLU HB3 H 7.311 3.836 1.617 1.00 . A A . 7 GLU HB3 1 1 20 9250 1 1 7 GLU HG2 H 8.637 5.615 0.897 1.00 . A A . 7 GLU HG2 1 1 20 9251 1 1 7 GLU HG3 H 8.900 4.446 -0.394 1.00 . A A . 7 GLU HG3 1 1 20 9252 1 1 7 GLU N N 6.270 3.515 -1.582 1.00 . A A . 7 GLU N 1 1 20 9253 1 1 7 GLU O O 6.119 1.054 0.894 1.00 . A A . 7 GLU O 1 1 20 9254 1 1 7 GLU OE1 O 7.019 7.045 -0.506 1.00 . A A . 7 GLU OE1 1 1 20 9255 1 1 7 GLU OE2 O 7.803 5.839 -2.109 1.00 . A A . 7 GLU OE2 1 1 20 9256 1 1 8 CYS C C 3.651 0.143 0.530 1.00 . A A . 8 CYS C 1 1 20 9257 1 1 8 CYS CA C 3.408 1.630 0.779 1.00 . A A . 8 CYS CA 1 1 20 9258 1 1 8 CYS CB C 2.060 2.068 0.206 1.00 . A A . 8 CYS CB 1 1 20 9259 1 1 8 CYS H H 4.262 3.280 -0.245 1.00 . A A . 8 CYS H 1 1 20 9260 1 1 8 CYS HA H 3.384 1.796 1.841 1.00 . A A . 8 CYS HA 1 1 20 9261 1 1 8 CYS HB2 H 2.202 2.911 -0.451 1.00 . A A . 8 CYS HB2 1 1 20 9262 1 1 8 CYS HB3 H 1.602 1.266 -0.336 1.00 . A A . 8 CYS HB3 1 1 20 9263 1 1 8 CYS N N 4.484 2.442 0.220 1.00 . A A . 8 CYS N 1 1 20 9264 1 1 8 CYS O O 3.709 -0.646 1.475 1.00 . A A . 8 CYS O 1 1 20 9265 1 1 8 CYS SG S 1.000 2.547 1.579 1.00 . A A . 8 CYS SG 1 1 20 9266 1 1 9 PRO C C 5.489 -2.072 -0.522 1.00 . A A . 9 PRO C 1 1 20 9267 1 1 9 PRO CA C 4.111 -1.671 -1.045 1.00 . A A . 9 PRO CA 1 1 20 9268 1 1 9 PRO CB C 4.046 -1.725 -2.575 1.00 . A A . 9 PRO CB 1 1 20 9269 1 1 9 PRO CD C 3.769 0.598 -1.902 1.00 . A A . 9 PRO CD 1 1 20 9270 1 1 9 PRO CG C 4.217 -0.317 -3.044 1.00 . A A . 9 PRO CG 1 1 20 9271 1 1 9 PRO HA H 3.354 -2.313 -0.625 1.00 . A A . 9 PRO HA 1 1 20 9272 1 1 9 PRO HB2 H 4.842 -2.348 -2.960 1.00 . A A . 9 PRO HB2 1 1 20 9273 1 1 9 PRO HB3 H 3.089 -2.104 -2.894 1.00 . A A . 9 PRO HB3 1 1 20 9274 1 1 9 PRO HD2 H 4.441 1.435 -1.806 1.00 . A A . 9 PRO HD2 1 1 20 9275 1 1 9 PRO HD3 H 2.761 0.940 -2.067 1.00 . A A . 9 PRO HD3 1 1 20 9276 1 1 9 PRO HG2 H 5.256 -0.134 -3.284 1.00 . A A . 9 PRO HG2 1 1 20 9277 1 1 9 PRO HG3 H 3.601 -0.139 -3.912 1.00 . A A . 9 PRO HG3 1 1 20 9278 1 1 9 PRO N N 3.827 -0.253 -0.707 1.00 . A A . 9 PRO N 1 1 20 9279 1 1 9 PRO O O 5.654 -3.144 0.063 1.00 . A A . 9 PRO O 1 1 20 9280 1 1 10 MET C C 7.765 -1.675 1.310 1.00 . A A . 10 MET C 1 1 20 9281 1 1 10 MET CA C 7.818 -1.452 -0.205 1.00 . A A . 10 MET CA 1 1 20 9282 1 1 10 MET CB C 8.746 -0.278 -0.541 1.00 . A A . 10 MET CB 1 1 20 9283 1 1 10 MET CE C 11.333 -0.560 -3.746 1.00 . A A . 10 MET CE 1 1 20 9284 1 1 10 MET CG C 9.243 -0.398 -1.988 1.00 . A A . 10 MET CG 1 1 20 9285 1 1 10 MET H H 6.284 -0.329 -1.149 1.00 . A A . 10 MET H 1 1 20 9286 1 1 10 MET HA H 8.195 -2.348 -0.674 1.00 . A A . 10 MET HA 1 1 20 9287 1 1 10 MET HB2 H 8.208 0.650 -0.422 1.00 . A A . 10 MET HB2 1 1 20 9288 1 1 10 MET HB3 H 9.592 -0.286 0.127 1.00 . A A . 10 MET HB3 1 1 20 9289 1 1 10 MET HE1 H 12.329 -0.250 -4.033 1.00 . A A . 10 MET HE1 1 1 20 9290 1 1 10 MET HE2 H 10.605 -0.097 -4.396 1.00 . A A . 10 MET HE2 1 1 20 9291 1 1 10 MET HE3 H 11.256 -1.633 -3.831 1.00 . A A . 10 MET HE3 1 1 20 9292 1 1 10 MET HG2 H 9.054 -1.395 -2.357 1.00 . A A . 10 MET HG2 1 1 20 9293 1 1 10 MET HG3 H 8.725 0.319 -2.608 1.00 . A A . 10 MET HG3 1 1 20 9294 1 1 10 MET N N 6.473 -1.184 -0.700 1.00 . A A . 10 MET N 1 1 20 9295 1 1 10 MET O O 8.460 -2.534 1.848 1.00 . A A . 10 MET O 1 1 20 9296 1 1 10 MET SD S 11.024 -0.061 -2.033 1.00 . A A . 10 MET SD 1 1 20 9297 1 1 11 HIS C C 5.816 -2.205 3.763 1.00 . A A . 11 HIS C 1 1 20 9298 1 1 11 HIS CA C 6.737 -1.028 3.429 1.00 . A A . 11 HIS CA 1 1 20 9299 1 1 11 HIS CB C 6.147 0.267 4.000 1.00 . A A . 11 HIS CB 1 1 20 9300 1 1 11 HIS CD2 C 7.326 1.767 5.806 1.00 . A A . 11 HIS CD2 1 1 20 9301 1 1 11 HIS CE1 C 7.636 0.255 7.329 1.00 . A A . 11 HIS CE1 1 1 20 9302 1 1 11 HIS CG C 6.816 0.595 5.309 1.00 . A A . 11 HIS CG 1 1 20 9303 1 1 11 HIS H H 6.371 -0.245 1.486 1.00 . A A . 11 HIS H 1 1 20 9304 1 1 11 HIS HA H 7.701 -1.201 3.883 1.00 . A A . 11 HIS HA 1 1 20 9305 1 1 11 HIS HB2 H 6.309 1.076 3.302 1.00 . A A . 11 HIS HB2 1 1 20 9306 1 1 11 HIS HB3 H 5.086 0.141 4.162 1.00 . A A . 11 HIS HB3 1 1 20 9307 1 1 11 HIS HD2 H 7.330 2.713 5.284 1.00 . A A . 11 HIS HD2 1 1 20 9308 1 1 11 HIS HE1 H 7.926 -0.240 8.245 1.00 . A A . 11 HIS HE1 1 1 20 9309 1 1 11 HIS HE2 H 8.264 2.212 7.671 1.00 . A A . 11 HIS HE2 1 1 20 9310 1 1 11 HIS N N 6.909 -0.906 1.980 1.00 . A A . 11 HIS N 1 1 20 9311 1 1 11 HIS ND1 N 7.026 -0.358 6.297 1.00 . A A . 11 HIS ND1 1 1 20 9312 1 1 11 HIS NE2 N 7.842 1.552 7.081 1.00 . A A . 11 HIS NE2 1 1 20 9313 1 1 11 HIS O O 5.361 -2.347 4.904 1.00 . A A . 11 HIS O 1 1 20 9314 1 1 12 CYS C C 5.577 -5.446 3.264 1.00 . A A . 12 CYS C 1 1 20 9315 1 1 12 CYS CA C 4.708 -4.227 2.974 1.00 . A A . 12 CYS CA 1 1 20 9316 1 1 12 CYS CB C 3.832 -4.490 1.751 1.00 . A A . 12 CYS CB 1 1 20 9317 1 1 12 CYS H H 5.964 -2.900 1.888 1.00 . A A . 12 CYS H 1 1 20 9318 1 1 12 CYS HA H 4.065 -4.044 3.825 1.00 . A A . 12 CYS HA 1 1 20 9319 1 1 12 CYS HB2 H 3.846 -3.629 1.105 1.00 . A A . 12 CYS HB2 1 1 20 9320 1 1 12 CYS HB3 H 4.206 -5.352 1.217 1.00 . A A . 12 CYS HB3 1 1 20 9321 1 1 12 CYS N N 5.563 -3.056 2.772 1.00 . A A . 12 CYS N 1 1 20 9322 1 1 12 CYS O O 6.685 -5.570 2.747 1.00 . A A . 12 CYS O 1 1 20 9323 1 1 12 CYS SG S 2.134 -4.809 2.297 1.00 . A A . 12 CYS SG 1 1 20 9324 1 1 13 LYS C C 5.422 -8.757 3.798 1.00 . A A . 13 LYS C 1 1 20 9325 1 1 13 LYS CA C 5.845 -7.488 4.554 1.00 . A A . 13 LYS CA 1 1 20 9326 1 1 13 LYS CB C 5.671 -7.675 6.065 1.00 . A A . 13 LYS CB 1 1 20 9327 1 1 13 LYS CD C 5.963 -5.288 6.855 1.00 . A A . 13 LYS CD 1 1 20 9328 1 1 13 LYS CE C 7.064 -4.221 6.771 1.00 . A A . 13 LYS CE 1 1 20 9329 1 1 13 LYS CG C 6.590 -6.696 6.818 1.00 . A A . 13 LYS CG 1 1 20 9330 1 1 13 LYS H H 4.214 -6.134 4.543 1.00 . A A . 13 LYS H 1 1 20 9331 1 1 13 LYS HA H 6.890 -7.310 4.355 1.00 . A A . 13 LYS HA 1 1 20 9332 1 1 13 LYS HB2 H 4.640 -7.486 6.334 1.00 . A A . 13 LYS HB2 1 1 20 9333 1 1 13 LYS HB3 H 5.930 -8.688 6.334 1.00 . A A . 13 LYS HB3 1 1 20 9334 1 1 13 LYS HD2 H 5.287 -5.171 6.023 1.00 . A A . 13 LYS HD2 1 1 20 9335 1 1 13 LYS HD3 H 5.418 -5.165 7.779 1.00 . A A . 13 LYS HD3 1 1 20 9336 1 1 13 LYS HE2 H 7.761 -4.360 7.587 1.00 . A A . 13 LYS HE2 1 1 20 9337 1 1 13 LYS HE3 H 7.590 -4.318 5.830 1.00 . A A . 13 LYS HE3 1 1 20 9338 1 1 13 LYS HG2 H 6.734 -7.049 7.829 1.00 . A A . 13 LYS HG2 1 1 20 9339 1 1 13 LYS HG3 H 7.548 -6.648 6.318 1.00 . A A . 13 LYS HG3 1 1 20 9340 1 1 13 LYS HZ1 H 7.202 -2.139 6.965 1.00 . A A . 13 LYS HZ1 1 1 20 9341 1 1 13 LYS HZ2 H 5.822 -2.814 7.688 1.00 . A A . 13 LYS HZ2 1 1 20 9342 1 1 13 LYS HZ3 H 5.898 -2.654 5.988 1.00 . A A . 13 LYS HZ3 1 1 20 9343 1 1 13 LYS N N 5.088 -6.309 4.139 1.00 . A A . 13 LYS N 1 1 20 9344 1 1 13 LYS NZ N 6.452 -2.858 6.864 1.00 . A A . 13 LYS NZ 1 1 20 9345 1 1 13 LYS O O 4.245 -8.966 3.499 1.00 . A A . 13 LYS O 1 1 20 9346 1 1 14 GLY C C 4.935 -11.571 3.164 1.00 . A A . 14 GLY C 1 1 20 9347 1 1 14 GLY CA C 6.216 -10.847 2.753 1.00 . A A . 14 GLY CA 1 1 20 9348 1 1 14 GLY H H 7.333 -9.347 3.751 1.00 . A A . 14 GLY H 1 1 20 9349 1 1 14 GLY HA2 H 6.169 -10.631 1.696 1.00 . A A . 14 GLY HA2 1 1 20 9350 1 1 14 GLY HA3 H 7.057 -11.500 2.938 1.00 . A A . 14 GLY HA3 1 1 20 9351 1 1 14 GLY N N 6.422 -9.591 3.487 1.00 . A A . 14 GLY N 1 1 20 9352 1 1 14 GLY O O 4.556 -11.574 4.334 1.00 . A A . 14 GLY O 1 1 20 9353 1 1 15 LYS C C 1.820 -11.983 2.348 1.00 . A A . 15 LYS C 1 1 20 9354 1 1 15 LYS CA C 3.029 -12.921 2.354 1.00 . A A . 15 LYS CA 1 1 20 9355 1 1 15 LYS CB C 3.044 -13.755 3.650 1.00 . A A . 15 LYS CB 1 1 20 9356 1 1 15 LYS CD C 5.210 -14.558 4.659 1.00 . A A . 15 LYS CD 1 1 20 9357 1 1 15 LYS CE C 5.069 -15.584 5.788 1.00 . A A . 15 LYS CE 1 1 20 9358 1 1 15 LYS CG C 4.148 -14.817 3.577 1.00 . A A . 15 LYS CG 1 1 20 9359 1 1 15 LYS H H 4.658 -12.116 1.263 1.00 . A A . 15 LYS H 1 1 20 9360 1 1 15 LYS HA H 2.919 -13.601 1.521 1.00 . A A . 15 LYS HA 1 1 20 9361 1 1 15 LYS HB2 H 3.204 -13.113 4.501 1.00 . A A . 15 LYS HB2 1 1 20 9362 1 1 15 LYS HB3 H 2.093 -14.249 3.756 1.00 . A A . 15 LYS HB3 1 1 20 9363 1 1 15 LYS HD2 H 6.194 -14.638 4.222 1.00 . A A . 15 LYS HD2 1 1 20 9364 1 1 15 LYS HD3 H 5.078 -13.567 5.061 1.00 . A A . 15 LYS HD3 1 1 20 9365 1 1 15 LYS HE2 H 4.022 -15.800 5.949 1.00 . A A . 15 LYS HE2 1 1 20 9366 1 1 15 LYS HE3 H 5.586 -16.494 5.514 1.00 . A A . 15 LYS HE3 1 1 20 9367 1 1 15 LYS HG2 H 3.712 -15.797 3.725 1.00 . A A . 15 LYS HG2 1 1 20 9368 1 1 15 LYS HG3 H 4.611 -14.780 2.606 1.00 . A A . 15 LYS HG3 1 1 20 9369 1 1 15 LYS HZ1 H 6.699 -15.137 7.012 1.00 . A A . 15 LYS HZ1 1 1 20 9370 1 1 15 LYS HZ2 H 5.287 -15.537 7.864 1.00 . A A . 15 LYS HZ2 1 1 20 9371 1 1 15 LYS HZ3 H 5.424 -14.020 7.117 1.00 . A A . 15 LYS HZ3 1 1 20 9372 1 1 15 LYS N N 4.282 -12.175 2.166 1.00 . A A . 15 LYS N 1 1 20 9373 1 1 15 LYS NZ N 5.665 -15.027 7.040 1.00 . A A . 15 LYS NZ 1 1 20 9374 1 1 15 LYS O O 0.685 -12.428 2.175 1.00 . A A . 15 LYS O 1 1 20 9375 1 1 16 MET C C 1.396 -8.432 1.798 1.00 . A A . 16 MET C 1 1 20 9376 1 1 16 MET CA C 0.971 -9.712 2.522 1.00 . A A . 16 MET CA 1 1 20 9377 1 1 16 MET CB C 0.566 -9.386 3.968 1.00 . A A . 16 MET CB 1 1 20 9378 1 1 16 MET CE C -2.041 -11.641 6.244 1.00 . A A . 16 MET CE 1 1 20 9379 1 1 16 MET CG C -0.132 -10.599 4.599 1.00 . A A . 16 MET CG 1 1 20 9380 1 1 16 MET H H 2.982 -10.378 2.652 1.00 . A A . 16 MET H 1 1 20 9381 1 1 16 MET HA H 0.123 -10.137 2.008 1.00 . A A . 16 MET HA 1 1 20 9382 1 1 16 MET HB2 H 1.449 -9.142 4.540 1.00 . A A . 16 MET HB2 1 1 20 9383 1 1 16 MET HB3 H -0.110 -8.544 3.973 1.00 . A A . 16 MET HB3 1 1 20 9384 1 1 16 MET HE1 H -2.990 -11.751 5.737 1.00 . A A . 16 MET HE1 1 1 20 9385 1 1 16 MET HE2 H -2.188 -11.708 7.313 1.00 . A A . 16 MET HE2 1 1 20 9386 1 1 16 MET HE3 H -1.375 -12.427 5.925 1.00 . A A . 16 MET HE3 1 1 20 9387 1 1 16 MET HG2 H -0.647 -11.160 3.832 1.00 . A A . 16 MET HG2 1 1 20 9388 1 1 16 MET HG3 H 0.604 -11.231 5.075 1.00 . A A . 16 MET HG3 1 1 20 9389 1 1 16 MET N N 2.060 -10.687 2.525 1.00 . A A . 16 MET N 1 1 20 9390 1 1 16 MET O O 2.068 -7.581 2.380 1.00 . A A . 16 MET O 1 1 20 9391 1 1 16 MET SD S -1.323 -10.027 5.839 1.00 . A A . 16 MET SD 1 1 20 9392 1 1 17 ALA C C 0.200 -6.574 -1.066 1.00 . A A . 17 ALA C 1 1 20 9393 1 1 17 ALA CA C 1.366 -7.096 -0.236 1.00 . A A . 17 ALA CA 1 1 20 9394 1 1 17 ALA CB C 2.556 -7.383 -1.144 1.00 . A A . 17 ALA CB 1 1 20 9395 1 1 17 ALA H H 0.466 -8.993 0.104 1.00 . A A . 17 ALA H 1 1 20 9396 1 1 17 ALA HA H 1.645 -6.326 0.464 1.00 . A A . 17 ALA HA 1 1 20 9397 1 1 17 ALA HB1 H 3.406 -7.668 -0.544 1.00 . A A . 17 ALA HB1 1 1 20 9398 1 1 17 ALA HB2 H 2.796 -6.492 -1.710 1.00 . A A . 17 ALA HB2 1 1 20 9399 1 1 17 ALA HB3 H 2.306 -8.183 -1.823 1.00 . A A . 17 ALA HB3 1 1 20 9400 1 1 17 ALA N N 1.003 -8.292 0.528 1.00 . A A . 17 ALA N 1 1 20 9401 1 1 17 ALA O O -0.312 -7.247 -1.960 1.00 . A A . 17 ALA O 1 1 20 9402 1 1 18 LYS C C -1.286 -3.180 -1.112 1.00 . A A . 18 LYS C 1 1 20 9403 1 1 18 LYS CA C -1.312 -4.687 -1.399 1.00 . A A . 18 LYS CA 1 1 20 9404 1 1 18 LYS CB C -2.644 -5.305 -0.952 1.00 . A A . 18 LYS CB 1 1 20 9405 1 1 18 LYS CD C -1.866 -5.312 1.462 1.00 . A A . 18 LYS CD 1 1 20 9406 1 1 18 LYS CE C -1.018 -6.202 2.371 1.00 . A A . 18 LYS CE 1 1 20 9407 1 1 18 LYS CG C -2.456 -6.150 0.321 1.00 . A A . 18 LYS CG 1 1 20 9408 1 1 18 LYS H H 0.265 -4.902 -0.009 1.00 . A A . 18 LYS H 1 1 20 9409 1 1 18 LYS HA H -1.211 -4.833 -2.466 1.00 . A A . 18 LYS HA 1 1 20 9410 1 1 18 LYS HB2 H -3.355 -4.515 -0.755 1.00 . A A . 18 LYS HB2 1 1 20 9411 1 1 18 LYS HB3 H -3.025 -5.934 -1.743 1.00 . A A . 18 LYS HB3 1 1 20 9412 1 1 18 LYS HD2 H -1.255 -4.523 1.058 1.00 . A A . 18 LYS HD2 1 1 20 9413 1 1 18 LYS HD3 H -2.665 -4.885 2.036 1.00 . A A . 18 LYS HD3 1 1 20 9414 1 1 18 LYS HE2 H -1.381 -7.220 2.321 1.00 . A A . 18 LYS HE2 1 1 20 9415 1 1 18 LYS HE3 H 0.012 -6.172 2.045 1.00 . A A . 18 LYS HE3 1 1 20 9416 1 1 18 LYS HG2 H -3.412 -6.535 0.625 1.00 . A A . 18 LYS HG2 1 1 20 9417 1 1 18 LYS HG3 H -1.798 -6.978 0.106 1.00 . A A . 18 LYS HG3 1 1 20 9418 1 1 18 LYS HZ1 H -1.836 -6.246 4.290 1.00 . A A . 18 LYS HZ1 1 1 20 9419 1 1 18 LYS HZ2 H -1.378 -4.684 3.778 1.00 . A A . 18 LYS HZ2 1 1 20 9420 1 1 18 LYS HZ3 H -0.191 -5.823 4.248 1.00 . A A . 18 LYS HZ3 1 1 20 9421 1 1 18 LYS N N -0.202 -5.360 -0.733 1.00 . A A . 18 LYS N 1 1 20 9422 1 1 18 LYS NZ N -1.112 -5.705 3.776 1.00 . A A . 18 LYS NZ 1 1 20 9423 1 1 18 LYS O O -1.820 -2.719 -0.095 1.00 . A A . 18 LYS O 1 1 20 9424 1 1 19 PRO C C -1.875 -0.212 -2.064 1.00 . A A . 19 PRO C 1 1 20 9425 1 1 19 PRO CA C -0.551 -0.933 -1.812 1.00 . A A . 19 PRO CA 1 1 20 9426 1 1 19 PRO CB C 0.500 -0.537 -2.851 1.00 . A A . 19 PRO CB 1 1 20 9427 1 1 19 PRO CD C -0.009 -2.873 -3.217 1.00 . A A . 19 PRO CD 1 1 20 9428 1 1 19 PRO CG C 0.408 -1.578 -3.915 1.00 . A A . 19 PRO CG 1 1 20 9429 1 1 19 PRO HA H -0.185 -0.698 -0.826 1.00 . A A . 19 PRO HA 1 1 20 9430 1 1 19 PRO HB2 H 0.277 0.442 -3.259 1.00 . A A . 19 PRO HB2 1 1 20 9431 1 1 19 PRO HB3 H 1.483 -0.546 -2.411 1.00 . A A . 19 PRO HB3 1 1 20 9432 1 1 19 PRO HD2 H -0.703 -3.428 -3.836 1.00 . A A . 19 PRO HD2 1 1 20 9433 1 1 19 PRO HD3 H 0.855 -3.474 -2.980 1.00 . A A . 19 PRO HD3 1 1 20 9434 1 1 19 PRO HG2 H -0.335 -1.290 -4.648 1.00 . A A . 19 PRO HG2 1 1 20 9435 1 1 19 PRO HG3 H 1.367 -1.711 -4.390 1.00 . A A . 19 PRO HG3 1 1 20 9436 1 1 19 PRO N N -0.667 -2.414 -1.978 1.00 . A A . 19 PRO N 1 1 20 9437 1 1 19 PRO O O -2.427 -0.266 -3.160 1.00 . A A . 19 PRO O 1 1 20 9438 1 1 20 THR C C -3.397 2.672 -0.905 1.00 . A A . 20 THR C 1 1 20 9439 1 1 20 THR CA C -3.633 1.192 -1.141 1.00 . A A . 20 THR CA 1 1 20 9440 1 1 20 THR CB C -4.626 0.652 -0.111 1.00 . A A . 20 THR CB 1 1 20 9441 1 1 20 THR CG2 C -4.503 -0.867 -0.061 1.00 . A A . 20 THR CG2 1 1 20 9442 1 1 20 THR H H -1.890 0.465 -0.176 1.00 . A A . 20 THR H 1 1 20 9443 1 1 20 THR HA H -4.045 1.053 -2.130 1.00 . A A . 20 THR HA 1 1 20 9444 1 1 20 THR HB H -5.628 0.915 -0.400 1.00 . A A . 20 THR HB 1 1 20 9445 1 1 20 THR HG1 H -3.859 2.035 1.038 1.00 . A A . 20 THR HG1 1 1 20 9446 1 1 20 THR HG21 H -4.559 -1.267 -1.061 1.00 . A A . 20 THR HG21 1 1 20 9447 1 1 20 THR HG22 H -5.304 -1.274 0.533 1.00 . A A . 20 THR HG22 1 1 20 9448 1 1 20 THR HG23 H -3.556 -1.132 0.373 1.00 . A A . 20 THR HG23 1 1 20 9449 1 1 20 THR N N -2.376 0.460 -1.035 1.00 . A A . 20 THR N 1 1 20 9450 1 1 20 THR O O -2.969 3.072 0.181 1.00 . A A . 20 THR O 1 1 20 9451 1 1 20 THR OG1 O -4.338 1.202 1.172 1.00 . A A . 20 THR OG1 1 1 20 9452 1 1 21 CYS C C -4.819 5.648 -1.954 1.00 . A A . 21 CYS C 1 1 20 9453 1 1 21 CYS CA C -3.480 4.920 -1.843 1.00 . A A . 21 CYS CA 1 1 20 9454 1 1 21 CYS CB C -2.527 5.392 -2.949 1.00 . A A . 21 CYS CB 1 1 20 9455 1 1 21 CYS H H -4.005 3.073 -2.771 1.00 . A A . 21 CYS H 1 1 20 9456 1 1 21 CYS HA H -3.040 5.155 -0.890 1.00 . A A . 21 CYS HA 1 1 20 9457 1 1 21 CYS HB2 H -2.494 4.653 -3.734 1.00 . A A . 21 CYS HB2 1 1 20 9458 1 1 21 CYS HB3 H -2.876 6.332 -3.353 1.00 . A A . 21 CYS HB3 1 1 20 9459 1 1 21 CYS N N -3.669 3.472 -1.929 1.00 . A A . 21 CYS N 1 1 20 9460 1 1 21 CYS O O -5.656 5.308 -2.799 1.00 . A A . 21 CYS O 1 1 20 9461 1 1 21 CYS SG S -0.867 5.611 -2.255 1.00 . A A . 21 CYS SG 1 1 20 9462 1 1 22 GLU C C -5.946 8.884 -0.783 1.00 . A A . 22 GLU C 1 1 20 9463 1 1 22 GLU CA C -6.244 7.417 -1.081 1.00 . A A . 22 GLU CA 1 1 20 9464 1 1 22 GLU CB C -7.217 6.859 -0.033 1.00 . A A . 22 GLU CB 1 1 20 9465 1 1 22 GLU CD C -6.418 5.089 1.556 1.00 . A A . 22 GLU CD 1 1 20 9466 1 1 22 GLU CG C -6.475 6.585 1.283 1.00 . A A . 22 GLU CG 1 1 20 9467 1 1 22 GLU H H -4.317 6.866 -0.446 1.00 . A A . 22 GLU H 1 1 20 9468 1 1 22 GLU HA H -6.709 7.348 -2.053 1.00 . A A . 22 GLU HA 1 1 20 9469 1 1 22 GLU HB2 H -8.004 7.579 0.144 1.00 . A A . 22 GLU HB2 1 1 20 9470 1 1 22 GLU HB3 H -7.649 5.939 -0.398 1.00 . A A . 22 GLU HB3 1 1 20 9471 1 1 22 GLU HG2 H -5.471 6.971 1.219 1.00 . A A . 22 GLU HG2 1 1 20 9472 1 1 22 GLU HG3 H -6.993 7.074 2.095 1.00 . A A . 22 GLU HG3 1 1 20 9473 1 1 22 GLU N N -5.017 6.644 -1.092 1.00 . A A . 22 GLU N 1 1 20 9474 1 1 22 GLU O O -5.397 9.226 0.261 1.00 . A A . 22 GLU O 1 1 20 9475 1 1 22 GLU OE1 O -7.425 4.548 1.984 1.00 . A A . 22 GLU OE1 1 1 20 9476 1 1 22 GLU OE2 O -5.370 4.506 1.343 1.00 . A A . 22 GLU OE2 1 1 20 9477 1 1 23 ASN C C -4.772 11.536 -0.954 1.00 . A A . 23 ASN C 1 1 20 9478 1 1 23 ASN CA C -6.120 11.185 -1.591 1.00 . A A . 23 ASN CA 1 1 20 9479 1 1 23 ASN CB C -7.265 11.793 -0.771 1.00 . A A . 23 ASN CB 1 1 20 9480 1 1 23 ASN CG C -7.320 11.176 0.621 1.00 . A A . 23 ASN CG 1 1 20 9481 1 1 23 ASN H H -6.735 9.375 -2.518 1.00 . A A . 23 ASN H 1 1 20 9482 1 1 23 ASN HA H -6.147 11.619 -2.579 1.00 . A A . 23 ASN HA 1 1 20 9483 1 1 23 ASN HB2 H -7.115 12.859 -0.681 1.00 . A A . 23 ASN HB2 1 1 20 9484 1 1 23 ASN HB3 H -8.196 11.606 -1.278 1.00 . A A . 23 ASN HB3 1 1 20 9485 1 1 23 ASN HD21 H -5.535 11.861 1.144 1.00 . A A . 23 ASN HD21 1 1 20 9486 1 1 23 ASN HD22 H -6.346 10.940 2.326 1.00 . A A . 23 ASN HD22 1 1 20 9487 1 1 23 ASN N N -6.316 9.733 -1.718 1.00 . A A . 23 ASN N 1 1 20 9488 1 1 23 ASN ND2 N -6.321 11.339 1.433 1.00 . A A . 23 ASN ND2 1 1 20 9489 1 1 23 ASN O O -4.707 12.307 0.006 1.00 . A A . 23 ASN O 1 1 20 9490 1 1 23 ASN OD1 O -8.301 10.529 0.977 1.00 . A A . 23 ASN OD1 1 1 20 9491 1 1 24 GLU C C -2.008 10.363 0.198 1.00 . A A . 24 GLU C 1 1 20 9492 1 1 24 GLU CA C -2.345 11.212 -1.030 1.00 . A A . 24 GLU CA 1 1 20 9493 1 1 24 GLU CB C -2.129 12.700 -0.725 1.00 . A A . 24 GLU CB 1 1 20 9494 1 1 24 GLU CD C -2.146 12.932 -3.232 1.00 . A A . 24 GLU CD 1 1 20 9495 1 1 24 GLU CG C -2.600 13.552 -1.915 1.00 . A A . 24 GLU CG 1 1 20 9496 1 1 24 GLU H H -3.838 10.374 -2.274 1.00 . A A . 24 GLU H 1 1 20 9497 1 1 24 GLU HA H -1.668 10.933 -1.819 1.00 . A A . 24 GLU HA 1 1 20 9498 1 1 24 GLU HB2 H -2.685 12.976 0.159 1.00 . A A . 24 GLU HB2 1 1 20 9499 1 1 24 GLU HB3 H -1.077 12.880 -0.555 1.00 . A A . 24 GLU HB3 1 1 20 9500 1 1 24 GLU HG2 H -3.677 13.615 -1.906 1.00 . A A . 24 GLU HG2 1 1 20 9501 1 1 24 GLU HG3 H -2.185 14.545 -1.830 1.00 . A A . 24 GLU HG3 1 1 20 9502 1 1 24 GLU N N -3.708 10.967 -1.509 1.00 . A A . 24 GLU N 1 1 20 9503 1 1 24 GLU O O -0.869 10.374 0.668 1.00 . A A . 24 GLU O 1 1 20 9504 1 1 24 GLU OE1 O -0.995 13.114 -3.588 1.00 . A A . 24 GLU OE1 1 1 20 9505 1 1 24 GLU OE2 O -2.959 12.282 -3.877 1.00 . A A . 24 GLU OE2 1 1 20 9506 1 1 25 VAL C C -2.519 7.307 1.348 1.00 . A A . 25 VAL C 1 1 20 9507 1 1 25 VAL CA C -2.742 8.733 1.847 1.00 . A A . 25 VAL CA 1 1 20 9508 1 1 25 VAL CB C -3.934 8.774 2.813 1.00 . A A . 25 VAL CB 1 1 20 9509 1 1 25 VAL CG1 C -3.774 7.685 3.879 1.00 . A A . 25 VAL CG1 1 1 20 9510 1 1 25 VAL CG2 C -3.987 10.141 3.499 1.00 . A A . 25 VAL CG2 1 1 20 9511 1 1 25 VAL H H -3.874 9.615 0.276 1.00 . A A . 25 VAL H 1 1 20 9512 1 1 25 VAL HA H -1.855 9.067 2.366 1.00 . A A . 25 VAL HA 1 1 20 9513 1 1 25 VAL HB H -4.849 8.608 2.265 1.00 . A A . 25 VAL HB 1 1 20 9514 1 1 25 VAL HG11 H -4.596 7.744 4.577 1.00 . A A . 25 VAL HG11 1 1 20 9515 1 1 25 VAL HG12 H -2.843 7.831 4.406 1.00 . A A . 25 VAL HG12 1 1 20 9516 1 1 25 VAL HG13 H -3.772 6.714 3.405 1.00 . A A . 25 VAL HG13 1 1 20 9517 1 1 25 VAL HG21 H -4.152 10.909 2.757 1.00 . A A . 25 VAL HG21 1 1 20 9518 1 1 25 VAL HG22 H -3.052 10.328 4.006 1.00 . A A . 25 VAL HG22 1 1 20 9519 1 1 25 VAL HG23 H -4.794 10.154 4.215 1.00 . A A . 25 VAL HG23 1 1 20 9520 1 1 25 VAL N N -2.983 9.606 0.698 1.00 . A A . 25 VAL N 1 1 20 9521 1 1 25 VAL O O -3.288 6.807 0.528 1.00 . A A . 25 VAL O 1 1 20 9522 1 1 26 CYS C C -1.147 4.305 2.511 1.00 . A A . 26 CYS C 1 1 20 9523 1 1 26 CYS CA C -1.134 5.317 1.367 1.00 . A A . 26 CYS CA 1 1 20 9524 1 1 26 CYS CB C 0.245 5.304 0.713 1.00 . A A . 26 CYS CB 1 1 20 9525 1 1 26 CYS H H -0.847 7.116 2.435 1.00 . A A . 26 CYS H 1 1 20 9526 1 1 26 CYS HA H -1.861 5.015 0.633 1.00 . A A . 26 CYS HA 1 1 20 9527 1 1 26 CYS HB2 H 0.190 4.762 -0.209 1.00 . A A . 26 CYS HB2 1 1 20 9528 1 1 26 CYS HB3 H 0.568 6.305 0.514 1.00 . A A . 26 CYS HB3 1 1 20 9529 1 1 26 CYS N N -1.448 6.667 1.811 1.00 . A A . 26 CYS N 1 1 20 9530 1 1 26 CYS O O -0.786 4.617 3.648 1.00 . A A . 26 CYS O 1 1 20 9531 1 1 26 CYS SG S 1.424 4.501 1.818 1.00 . A A . 26 CYS SG 1 1 20 9532 1 1 27 LYS C C -1.422 0.646 2.402 1.00 . A A . 27 LYS C 1 1 20 9533 1 1 27 LYS CA C -1.595 1.981 3.137 1.00 . A A . 27 LYS CA 1 1 20 9534 1 1 27 LYS CB C -2.932 1.977 3.896 1.00 . A A . 27 LYS CB 1 1 20 9535 1 1 27 LYS CD C -4.912 3.337 4.607 1.00 . A A . 27 LYS CD 1 1 20 9536 1 1 27 LYS CE C -5.896 2.566 3.721 1.00 . A A . 27 LYS CE 1 1 20 9537 1 1 27 LYS CG C -3.533 3.387 3.936 1.00 . A A . 27 LYS CG 1 1 20 9538 1 1 27 LYS H H -1.809 2.907 1.243 1.00 . A A . 27 LYS H 1 1 20 9539 1 1 27 LYS HA H -0.788 2.099 3.847 1.00 . A A . 27 LYS HA 1 1 20 9540 1 1 27 LYS HB2 H -3.619 1.314 3.397 1.00 . A A . 27 LYS HB2 1 1 20 9541 1 1 27 LYS HB3 H -2.769 1.631 4.904 1.00 . A A . 27 LYS HB3 1 1 20 9542 1 1 27 LYS HD2 H -4.827 2.846 5.565 1.00 . A A . 27 LYS HD2 1 1 20 9543 1 1 27 LYS HD3 H -5.274 4.345 4.751 1.00 . A A . 27 LYS HD3 1 1 20 9544 1 1 27 LYS HE2 H -5.559 2.597 2.695 1.00 . A A . 27 LYS HE2 1 1 20 9545 1 1 27 LYS HE3 H -5.948 1.538 4.051 1.00 . A A . 27 LYS HE3 1 1 20 9546 1 1 27 LYS HG2 H -2.882 4.040 4.498 1.00 . A A . 27 LYS HG2 1 1 20 9547 1 1 27 LYS HG3 H -3.640 3.764 2.929 1.00 . A A . 27 LYS HG3 1 1 20 9548 1 1 27 LYS HZ1 H -7.975 2.460 3.862 1.00 . A A . 27 LYS HZ1 1 1 20 9549 1 1 27 LYS HZ2 H -7.410 3.809 2.969 1.00 . A A . 27 LYS HZ2 1 1 20 9550 1 1 27 LYS HZ3 H -7.289 3.779 4.682 1.00 . A A . 27 LYS HZ3 1 1 20 9551 1 1 27 LYS N N -1.548 3.080 2.176 1.00 . A A . 27 LYS N 1 1 20 9552 1 1 27 LYS NZ N -7.243 3.194 3.825 1.00 . A A . 27 LYS NZ 1 1 20 9553 1 1 27 LYS O O -1.634 0.567 1.193 1.00 . A A . 27 LYS O 1 1 20 9554 1 1 28 CYS C C -1.949 -2.684 3.012 1.00 . A A . 28 CYS C 1 1 20 9555 1 1 28 CYS CA C -0.870 -1.719 2.514 1.00 . A A . 28 CYS CA 1 1 20 9556 1 1 28 CYS CB C 0.524 -2.285 2.819 1.00 . A A . 28 CYS CB 1 1 20 9557 1 1 28 CYS H H -0.892 -0.294 4.090 1.00 . A A . 28 CYS H 1 1 20 9558 1 1 28 CYS HA H -0.966 -1.613 1.449 1.00 . A A . 28 CYS HA 1 1 20 9559 1 1 28 CYS HB2 H 1.227 -1.472 2.938 1.00 . A A . 28 CYS HB2 1 1 20 9560 1 1 28 CYS HB3 H 0.491 -2.868 3.727 1.00 . A A . 28 CYS HB3 1 1 20 9561 1 1 28 CYS N N -1.045 -0.403 3.130 1.00 . A A . 28 CYS N 1 1 20 9562 1 1 28 CYS O O -1.706 -3.489 3.913 1.00 . A A . 28 CYS O 1 1 20 9563 1 1 28 CYS SG S 1.045 -3.340 1.439 1.00 . A A . 28 CYS SG 1 1 20 9564 1 1 29 ASN C C -4.883 -4.162 1.591 1.00 . A A . 29 ASN C 1 1 20 9565 1 1 29 ASN CA C -4.262 -3.466 2.806 1.00 . A A . 29 ASN CA 1 1 20 9566 1 1 29 ASN CB C -5.338 -2.654 3.549 1.00 . A A . 29 ASN CB 1 1 20 9567 1 1 29 ASN CG C -5.556 -1.312 2.868 1.00 . A A . 29 ASN CG 1 1 20 9568 1 1 29 ASN H H -3.266 -1.949 1.694 1.00 . A A . 29 ASN H 1 1 20 9569 1 1 29 ASN HA H -3.891 -4.219 3.473 1.00 . A A . 29 ASN HA 1 1 20 9570 1 1 29 ASN HB2 H -6.267 -3.206 3.547 1.00 . A A . 29 ASN HB2 1 1 20 9571 1 1 29 ASN HB3 H -5.023 -2.489 4.568 1.00 . A A . 29 ASN HB3 1 1 20 9572 1 1 29 ASN HD21 H -3.656 -0.789 2.982 1.00 . A A . 29 ASN HD21 1 1 20 9573 1 1 29 ASN HD22 H -4.666 0.331 2.190 1.00 . A A . 29 ASN HD22 1 1 20 9574 1 1 29 ASN N N -3.141 -2.600 2.414 1.00 . A A . 29 ASN N 1 1 20 9575 1 1 29 ASN ND2 N -4.545 -0.524 2.678 1.00 . A A . 29 ASN ND2 1 1 20 9576 1 1 29 ASN O O -5.108 -3.547 0.551 1.00 . A A . 29 ASN O 1 1 20 9577 1 1 29 ASN OD1 O -6.680 -0.966 2.516 1.00 . A A . 29 ASN OD1 1 1 20 9578 1 1 30 ILE C C -7.095 -5.641 0.217 1.00 . A A . 30 ILE C 1 1 20 9579 1 1 30 ILE CA C -5.768 -6.239 0.664 1.00 . A A . 30 ILE CA 1 1 20 9580 1 1 30 ILE CB C -5.958 -7.711 1.080 1.00 . A A . 30 ILE CB 1 1 20 9581 1 1 30 ILE CD1 C -4.328 -7.874 2.972 1.00 . A A . 30 ILE CD1 1 1 20 9582 1 1 30 ILE CG1 C -5.817 -7.858 2.601 1.00 . A A . 30 ILE CG1 1 1 20 9583 1 1 30 ILE CG2 C -4.926 -8.601 0.371 1.00 . A A . 30 ILE CG2 1 1 20 9584 1 1 30 ILE H H -4.968 -5.887 2.598 1.00 . A A . 30 ILE H 1 1 20 9585 1 1 30 ILE HA H -5.098 -6.214 -0.182 1.00 . A A . 30 ILE HA 1 1 20 9586 1 1 30 ILE HB H -6.947 -8.031 0.787 1.00 . A A . 30 ILE HB 1 1 20 9587 1 1 30 ILE HD11 H -4.202 -7.497 3.973 1.00 . A A . 30 ILE HD11 1 1 20 9588 1 1 30 ILE HD12 H -3.778 -7.255 2.282 1.00 . A A . 30 ILE HD12 1 1 20 9589 1 1 30 ILE HD13 H -3.957 -8.886 2.916 1.00 . A A . 30 ILE HD13 1 1 20 9590 1 1 30 ILE HG12 H -6.308 -7.031 3.092 1.00 . A A . 30 ILE HG12 1 1 20 9591 1 1 30 ILE HG13 H -6.272 -8.784 2.915 1.00 . A A . 30 ILE HG13 1 1 20 9592 1 1 30 ILE HG21 H -3.950 -8.443 0.802 1.00 . A A . 30 ILE HG21 1 1 20 9593 1 1 30 ILE HG22 H -4.899 -8.355 -0.680 1.00 . A A . 30 ILE HG22 1 1 20 9594 1 1 30 ILE HG23 H -5.207 -9.639 0.490 1.00 . A A . 30 ILE HG23 1 1 20 9595 1 1 30 ILE N N -5.164 -5.454 1.743 1.00 . A A . 30 ILE N 1 1 20 9596 1 1 30 ILE O O -7.888 -5.158 1.024 1.00 . A A . 30 ILE O 1 1 20 9597 1 1 31 GLY C C -8.225 -3.930 -2.569 1.00 . A A . 31 GLY C 1 1 20 9598 1 1 31 GLY CA C -8.528 -5.152 -1.703 1.00 . A A . 31 GLY CA 1 1 20 9599 1 1 31 GLY H H -6.625 -6.092 -1.660 1.00 . A A . 31 GLY H 1 1 20 9600 1 1 31 GLY HA2 H -8.986 -5.916 -2.314 1.00 . A A . 31 GLY HA2 1 1 20 9601 1 1 31 GLY HA3 H -9.213 -4.864 -0.924 1.00 . A A . 31 GLY HA3 1 1 20 9602 1 1 31 GLY N N -7.310 -5.688 -1.091 1.00 . A A . 31 GLY N 1 1 20 9603 1 1 31 GLY O O -8.989 -3.597 -3.472 1.00 . A A . 31 GLY O 1 1 20 9604 1 1 32 LYS C C -5.228 -2.286 -3.544 1.00 . A A . 32 LYS C 1 1 20 9605 1 1 32 LYS CA C -6.680 -2.117 -3.091 1.00 . A A . 32 LYS CA 1 1 20 9606 1 1 32 LYS CB C -6.824 -0.834 -2.256 1.00 . A A . 32 LYS CB 1 1 20 9607 1 1 32 LYS CD C -7.139 1.137 -3.795 1.00 . A A . 32 LYS CD 1 1 20 9608 1 1 32 LYS CE C -7.352 2.552 -3.238 1.00 . A A . 32 LYS CE 1 1 20 9609 1 1 32 LYS CG C -7.854 0.108 -2.903 1.00 . A A . 32 LYS CG 1 1 20 9610 1 1 32 LYS H H -6.515 -3.610 -1.591 1.00 . A A . 32 LYS H 1 1 20 9611 1 1 32 LYS HA H -7.309 -2.042 -3.963 1.00 . A A . 32 LYS HA 1 1 20 9612 1 1 32 LYS HB2 H -7.150 -1.090 -1.259 1.00 . A A . 32 LYS HB2 1 1 20 9613 1 1 32 LYS HB3 H -5.870 -0.332 -2.202 1.00 . A A . 32 LYS HB3 1 1 20 9614 1 1 32 LYS HD2 H -6.082 0.917 -3.822 1.00 . A A . 32 LYS HD2 1 1 20 9615 1 1 32 LYS HD3 H -7.541 1.085 -4.796 1.00 . A A . 32 LYS HD3 1 1 20 9616 1 1 32 LYS HE2 H -8.383 2.844 -3.383 1.00 . A A . 32 LYS HE2 1 1 20 9617 1 1 32 LYS HE3 H -7.120 2.562 -2.181 1.00 . A A . 32 LYS HE3 1 1 20 9618 1 1 32 LYS HG2 H -8.543 -0.471 -3.502 1.00 . A A . 32 LYS HG2 1 1 20 9619 1 1 32 LYS HG3 H -8.403 0.622 -2.128 1.00 . A A . 32 LYS HG3 1 1 20 9620 1 1 32 LYS HZ1 H -6.878 3.771 -4.866 1.00 . A A . 32 LYS HZ1 1 1 20 9621 1 1 32 LYS HZ2 H -5.516 3.042 -4.133 1.00 . A A . 32 LYS HZ2 1 1 20 9622 1 1 32 LYS HZ3 H -6.303 4.371 -3.370 1.00 . A A . 32 LYS HZ3 1 1 20 9623 1 1 32 LYS N N -7.093 -3.285 -2.309 1.00 . A A . 32 LYS N 1 1 20 9624 1 1 32 LYS NZ N -6.455 3.505 -3.957 1.00 . A A . 32 LYS NZ 1 1 20 9625 1 1 32 LYS O O -4.382 -2.750 -2.778 1.00 . A A . 32 LYS O 1 1 20 9626 1 1 33 LYS C C -3.182 -0.830 -6.133 1.00 . A A . 33 LYS C 1 1 20 9627 1 1 33 LYS CA C -3.590 -2.060 -5.325 1.00 . A A . 33 LYS CA 1 1 20 9628 1 1 33 LYS CB C -3.501 -3.311 -6.207 1.00 . A A . 33 LYS CB 1 1 20 9629 1 1 33 LYS CD C -1.856 -3.122 -8.102 1.00 . A A . 33 LYS CD 1 1 20 9630 1 1 33 LYS CE C -0.821 -1.995 -8.202 1.00 . A A . 33 LYS CE 1 1 20 9631 1 1 33 LYS CG C -2.045 -3.542 -6.634 1.00 . A A . 33 LYS CG 1 1 20 9632 1 1 33 LYS H H -5.657 -1.570 -5.366 1.00 . A A . 33 LYS H 1 1 20 9633 1 1 33 LYS HA H -2.903 -2.173 -4.500 1.00 . A A . 33 LYS HA 1 1 20 9634 1 1 33 LYS HB2 H -3.853 -4.166 -5.648 1.00 . A A . 33 LYS HB2 1 1 20 9635 1 1 33 LYS HB3 H -4.118 -3.177 -7.082 1.00 . A A . 33 LYS HB3 1 1 20 9636 1 1 33 LYS HD2 H -1.514 -3.972 -8.674 1.00 . A A . 33 LYS HD2 1 1 20 9637 1 1 33 LYS HD3 H -2.798 -2.778 -8.504 1.00 . A A . 33 LYS HD3 1 1 20 9638 1 1 33 LYS HE2 H -0.320 -1.875 -7.251 1.00 . A A . 33 LYS HE2 1 1 20 9639 1 1 33 LYS HE3 H -0.093 -2.243 -8.962 1.00 . A A . 33 LYS HE3 1 1 20 9640 1 1 33 LYS HG2 H -1.387 -2.964 -6.002 1.00 . A A . 33 LYS HG2 1 1 20 9641 1 1 33 LYS HG3 H -1.808 -4.591 -6.532 1.00 . A A . 33 LYS HG3 1 1 20 9642 1 1 33 LYS HZ1 H -1.609 -0.663 -9.596 1.00 . A A . 33 LYS HZ1 1 1 20 9643 1 1 33 LYS HZ2 H -0.936 0.104 -8.217 1.00 . A A . 33 LYS HZ2 1 1 20 9644 1 1 33 LYS HZ3 H -2.461 -0.700 -8.119 1.00 . A A . 33 LYS HZ3 1 1 20 9645 1 1 33 LYS N N -4.946 -1.924 -4.794 1.00 . A A . 33 LYS N 1 1 20 9646 1 1 33 LYS NZ N -1.508 -0.725 -8.567 1.00 . A A . 33 LYS NZ 1 1 20 9647 1 1 33 LYS O O -3.433 -0.748 -7.340 1.00 . A A . 33 LYS O 1 1 20 9648 1 1 34 ASP C C -0.604 1.198 -6.510 1.00 . A A . 34 ASP C 1 1 20 9649 1 1 34 ASP CA C -2.075 1.334 -6.111 1.00 . A A . 34 ASP CA 1 1 20 9650 1 1 34 ASP CB C -2.250 2.519 -5.161 1.00 . A A . 34 ASP CB 1 1 20 9651 1 1 34 ASP CG C -3.717 2.915 -5.082 1.00 . A A . 34 ASP CG 1 1 20 9652 1 1 34 ASP H H -2.358 -0.016 -4.498 1.00 . A A . 34 ASP H 1 1 20 9653 1 1 34 ASP HA H -2.664 1.507 -7.000 1.00 . A A . 34 ASP HA 1 1 20 9654 1 1 34 ASP HB2 H -1.899 2.243 -4.177 1.00 . A A . 34 ASP HB2 1 1 20 9655 1 1 34 ASP HB3 H -1.674 3.355 -5.525 1.00 . A A . 34 ASP HB3 1 1 20 9656 1 1 34 ASP N N -2.537 0.114 -5.461 1.00 . A A . 34 ASP N 1 1 20 9657 1 1 34 ASP O O 0.237 1.207 -5.626 1.00 . A A . 34 ASP O 1 1 20 9658 1 1 34 ASP OXT O -0.340 1.072 -7.697 1.00 . A A . 34 ASP OXT 1 1 20 9659 1 1 34 ASP OD1 O -4.190 3.570 -5.992 1.00 . A A . 34 ASP OD1 1 1 20 9660 1 1 34 ASP OD2 O -4.354 2.568 -4.099 1.00 . A A . 34 ASP OD2 1 1 stop_ save_
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