NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
384119 | 1k9r | cing | 4-filtered-FRED | STAR | entry | full | 281 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1k9r # This FRED archive file contains, for PDB entry <1k9r>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1k9r _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1k9r _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 5298.81 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 $65_kDa_Yes_associated_protein A . 1 1 2 . 2 $WW_domain_binding_protein_1 B . 1 1 stop_ save_ save_65_kDa_Yes_associated_protein _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "65 kDa Yes associated protein" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code FEIPDDVPLPAGWEMAKTSSGQRYFLNHIDQTTTWQDPRK _Entity.Number_of_monomers 40 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 PHE . 1 1 2 GLU . 1 1 3 ILE . 1 1 4 PRO . 1 1 5 ASP . 1 1 6 ASP . 1 1 7 VAL . 1 1 8 PRO . 1 1 9 LEU . 1 1 10 PRO . 1 1 11 ALA . 1 1 12 GLY . 1 1 13 TRP . 1 1 14 GLU . 1 1 15 MET . 1 1 16 ALA . 1 1 17 LYS . 1 1 18 THR . 1 1 19 SER . 1 1 20 SER . 1 1 21 GLY . 1 1 22 GLN . 1 1 23 ARG . 1 1 24 TYR . 1 1 25 PHE . 1 1 26 LEU . 1 1 27 ASN . 1 1 28 HIS . 1 1 29 ILE . 1 1 30 ASP . 1 1 31 GLN . 1 1 32 THR . 1 1 33 THR . 1 1 34 THR . 1 1 35 TRP . 1 1 36 GLN . 1 1 37 ASP . 1 1 38 PRO . 1 1 39 ARG . 1 1 40 LYS . 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 PHE 1 1 1 1 GLU 2 2 1 1 ILE 3 3 1 1 PRO 4 4 1 1 ASP 5 5 1 1 ASP 6 6 1 1 VAL 7 7 1 1 PRO 8 8 1 1 LEU 9 9 1 1 PRO 10 10 1 1 ALA 11 11 1 1 GLY 12 12 1 1 TRP 13 13 1 1 GLU 14 14 1 1 MET 15 15 1 1 ALA 16 16 1 1 LYS 17 17 1 1 THR 18 18 1 1 SER 19 19 1 1 SER 20 20 1 1 GLY 21 21 1 1 GLN 22 22 1 1 ARG 23 23 1 1 TYR 24 24 1 1 PHE 25 25 1 1 LEU 26 26 1 1 ASN 27 27 1 1 HIS 28 28 1 1 ILE 29 29 1 1 ASP 30 30 1 1 GLN 31 31 1 1 THR 32 32 1 1 THR 33 33 1 1 THR 34 34 1 1 TRP 35 35 1 1 GLN 36 36 1 1 ASP 37 37 1 1 PRO 38 38 1 1 ARG 39 39 1 1 LYS 40 40 1 1 stop_ save_ save_WW_domain_binding_protein_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "WW domain binding protein 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code XPLPPY _Entity.Number_of_monomers 6 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 ACE $ACE 1 2 2 PRO . 1 2 3 LEU . 1 2 4 PRO . 1 2 5 PRO . 1 2 6 TYR . 1 2 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID ACE 1 1 1 2 PRO 2 2 1 2 LEU 3 3 1 2 PRO 4 4 1 2 PRO 5 5 1 2 TYR 6 6 1 2 stop_ save_ save_ACE _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID ACE _Chem_comp.Type non-polymer 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 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 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 GLU H . 6 . HN 1 1 1 1 2 1 1 3 ILE H . 7 . HN 1 1 2 1 1 1 1 3 ILE HA . 7 . HA 1 1 2 1 2 1 1 4 PRO HD3 . 8 . HD1 1 1 3 1 1 1 1 3 ILE HA . 7 . HA 1 1 3 1 2 1 1 4 PRO HD2 . 8 . HD2 1 1 4 1 1 1 1 3 ILE MG . 7 . HG2# 1 1 4 1 2 1 1 4 PRO HD3 . 8 . HD1 1 1 5 1 1 1 1 3 ILE MG . 7 . HG2# 1 1 5 1 2 1 1 4 PRO HD2 . 8 . HD2 1 1 6 1 1 1 1 3 ILE MD . 7 . HD1# 1 1 6 1 2 1 1 40 LYS HB3 . 44 . HB1 1 1 7 1 1 1 1 3 ILE MD . 7 . HD1# 1 1 7 1 2 1 1 40 LYS QG . 44 . HG# 1 1 8 1 1 1 1 3 ILE MD . 7 . HD1# 1 1 8 1 2 1 1 40 LYS QD . 44 . HD# 1 1 9 1 1 1 1 4 PRO QB . 8 . HB# 1 1 9 1 2 1 1 5 ASP H . 9 . HN 1 1 10 1 1 1 1 4 PRO QG . 8 . HG# 1 1 10 1 2 1 1 5 ASP H . 9 . HN 1 1 11 1 1 1 1 4 PRO QB . 8 . HB# 1 1 11 1 2 1 1 6 ASP H . 10 . HN 1 1 12 1 1 1 1 4 PRO QG . 8 . HG# 1 1 12 1 2 1 1 6 ASP H . 10 . HN 1 1 13 1 1 1 1 5 ASP H . 9 . HN 1 1 13 1 2 1 1 5 ASP HB3 . 9 . HB1 1 1 14 1 1 1 1 5 ASP H . 9 . HN 1 1 14 1 2 1 1 5 ASP HB2 . 9 . HB2 1 1 15 1 1 1 1 5 ASP H . 9 . HN 1 1 15 1 2 1 1 6 ASP H . 10 . HN 1 1 16 1 1 1 1 5 ASP HA . 9 . HA 1 1 16 1 2 1 1 6 ASP H . 10 . HN 1 1 17 1 1 1 1 5 ASP HB3 . 9 . HB1 1 1 17 1 2 1 1 6 ASP H . 10 . HN 1 1 18 1 1 1 1 5 ASP HB2 . 9 . HB2 1 1 18 1 2 1 1 6 ASP H . 10 . HN 1 1 19 1 1 1 1 6 ASP H . 10 . HN 1 1 19 1 2 1 1 6 ASP HB3 . 10 . HB1 1 1 20 1 1 1 1 6 ASP H . 10 . HN 1 1 20 1 2 1 1 6 ASP HB2 . 10 . HB2 1 1 21 1 1 1 1 6 ASP H . 10 . HN 1 1 21 1 2 1 1 7 VAL H . 11 . HN 1 1 22 1 1 1 1 6 ASP HA . 10 . HA 1 1 22 1 2 1 1 7 VAL H . 11 . HN 1 1 23 1 1 1 1 7 VAL H . 11 . HN 1 1 23 1 2 1 1 7 VAL HB . 11 . HB 1 1 24 1 1 1 1 7 VAL H . 11 . HN 1 1 24 1 2 1 1 7 VAL QG . 11 . HG# 1 1 25 1 1 1 1 7 VAL HA . 11 . HA 1 1 25 1 2 1 1 8 PRO HD3 . 12 . HD1 1 1 26 1 1 1 1 7 VAL HA . 11 . HA 1 1 26 1 2 1 1 8 PRO HD2 . 12 . HD2 1 1 27 1 1 1 1 7 VAL HB . 11 . HB 1 1 27 1 2 1 1 8 PRO HD3 . 12 . HD1 1 1 28 1 1 1 1 7 VAL QG . 11 . HG# 1 1 28 1 2 1 1 8 PRO HD3 . 12 . HD1 1 1 29 1 1 1 1 7 VAL QG . 11 . HG# 1 1 29 1 2 1 1 8 PRO HD2 . 12 . HD2 1 1 30 1 1 1 1 8 PRO HA . 12 . HA 1 1 30 1 2 1 1 9 LEU H . 13 . HN 1 1 31 1 1 1 1 8 PRO QG . 12 . HG# 1 1 31 1 2 1 1 9 LEU H . 13 . HN 1 1 32 1 1 1 1 9 LEU HA . 13 . HA 1 1 32 1 2 1 1 10 PRO HD3 . 14 . HD1 1 1 33 1 1 1 1 9 LEU HA . 13 . HA 1 1 33 1 2 1 1 10 PRO HD2 . 14 . HD2 1 1 34 1 1 1 1 9 LEU HG . 13 . HG 1 1 34 1 2 1 1 10 PRO HD3 . 14 . HD1 1 1 35 1 1 1 1 9 LEU HG . 13 . HG 1 1 35 1 2 1 1 10 PRO HD2 . 14 . HD2 1 1 36 1 1 1 1 9 LEU QB . 13 . HB# 1 1 36 1 2 1 1 10 PRO HD3 . 14 . HD1 1 1 37 1 1 1 1 9 LEU QB . 13 . HB# 1 1 37 1 2 1 1 10 PRO HD2 . 14 . HD2 1 1 38 1 1 1 1 9 LEU QB . 13 . HB# 1 1 38 1 2 1 1 13 TRP HB3 . 17 . HB1 1 1 39 1 1 1 1 9 LEU QD . 13 . HD# 1 1 39 1 2 1 1 13 TRP HB3 . 17 . HB1 1 1 40 1 1 1 1 9 LEU QD . 13 . HD# 1 1 40 1 2 1 1 13 TRP HB2 . 17 . HB2 1 1 41 1 1 1 1 9 LEU QD . 13 . HD# 1 1 41 1 2 1 1 13 TRP HE3 . 17 . HE3 1 1 42 1 1 1 1 9 LEU QD . 13 . HD# 1 1 42 1 2 1 1 25 PHE QD . 29 . HD# 1 1 43 1 1 1 1 9 LEU HA . 13 . HA 1 1 43 1 2 1 1 39 ARG HB2 . 43 . HB1 1 1 44 1 1 1 1 9 LEU HA . 13 . HA 1 1 44 1 2 1 1 39 ARG HB3 . 43 . HB2 1 1 45 1 1 1 1 9 LEU HA . 13 . HA 1 1 45 1 2 1 1 39 ARG HD2 . 43 . HD1 1 1 46 1 1 1 1 10 PRO HA . 14 . HA 1 1 46 1 2 1 1 11 ALA H . 15 . HN 1 1 47 1 1 1 1 10 PRO HB3 . 14 . HB1 1 1 47 1 2 1 1 11 ALA H . 15 . HN 1 1 48 1 1 1 1 10 PRO HB2 . 14 . HB2 1 1 48 1 2 1 1 11 ALA H . 15 . HN 1 1 49 1 1 1 1 10 PRO HA . 14 . HA 1 1 49 1 2 1 1 13 TRP HD1 . 17 . HD1 1 1 50 1 1 1 1 10 PRO HB3 . 14 . HB1 1 1 50 1 2 1 1 13 TRP HD1 . 17 . HD1 1 1 51 1 1 1 1 10 PRO HB2 . 14 . HB2 1 1 51 1 2 1 1 13 TRP HD1 . 17 . HD1 1 1 52 1 1 1 1 10 PRO HG3 . 14 . HG2 1 1 52 1 2 1 1 13 TRP HD1 . 17 . HD1 1 1 53 1 1 1 1 10 PRO HD3 . 14 . HD1 1 1 53 1 2 1 1 13 TRP HD1 . 17 . HD1 1 1 54 1 1 1 1 10 PRO HD2 . 14 . HD2 1 1 54 1 2 1 1 13 TRP HD1 . 17 . HD1 1 1 55 1 1 1 1 10 PRO HG3 . 14 . HG2 1 1 55 1 2 1 1 38 PRO HB2 . 42 . HB1 1 1 56 1 1 1 1 11 ALA HA . 15 . HA 1 1 56 1 2 1 1 12 GLY H . 16 . HN 1 1 57 1 1 1 1 11 ALA MB . 15 . HB# 1 1 57 1 2 1 1 12 GLY H . 16 . HN 1 1 58 1 1 1 1 11 ALA HA . 15 . HA 1 1 58 1 2 1 1 13 TRP H . 17 . HN 1 1 59 1 1 1 1 11 ALA MB . 15 . HB# 1 1 59 1 2 1 1 13 TRP H . 17 . HN 1 1 60 1 1 1 1 12 GLY H . 16 . HN 1 1 60 1 2 1 1 13 TRP H . 17 . HN 1 1 61 1 1 1 1 12 GLY HA3 . 16 . HA1 1 1 61 1 2 1 1 13 TRP H . 17 . HN 1 1 62 1 1 1 1 12 GLY HA2 . 16 . HA2 1 1 62 1 2 1 1 13 TRP H . 17 . HN 1 1 63 1 1 1 1 12 GLY HA2 . 16 . HA2 1 1 63 1 2 1 1 29 ILE MG . 33 . HG2# 1 1 64 1 1 1 1 12 GLY HA2 . 16 . HA2 1 1 64 1 2 1 1 29 ILE MD . 33 . HD1# 1 1 65 1 1 1 1 12 GLY HA2 . 16 . HA2 1 1 65 1 2 1 1 29 ILE QG . 33 . HG1# 1 1 66 1 1 1 1 13 TRP H . 17 . HN 1 1 66 1 2 1 1 13 TRP HD1 . 17 . HD1 1 1 67 1 1 1 1 13 TRP HA . 17 . HA 1 1 67 1 2 1 1 13 TRP HD1 . 17 . HD1 1 1 68 1 1 1 1 13 TRP HA . 17 . HA 1 1 68 1 2 1 1 13 TRP HE3 . 17 . HE3 1 1 69 1 1 1 1 13 TRP HA . 17 . HA 1 1 69 1 2 1 1 14 GLU H . 18 . HN 1 1 70 1 1 1 1 13 TRP HB3 . 17 . HB1 1 1 70 1 2 1 1 14 GLU H . 18 . HN 1 1 71 1 1 1 1 13 TRP HB2 . 17 . HB2 1 1 71 1 2 1 1 14 GLU H . 18 . HN 1 1 72 1 1 1 1 13 TRP HE3 . 17 . HE3 1 1 72 1 2 1 1 14 GLU H . 18 . HN 1 1 73 1 1 1 1 13 TRP HE3 . 17 . HE3 1 1 73 1 2 1 1 25 PHE HA . 29 . HA 1 1 74 1 1 1 1 13 TRP HE3 . 17 . HE3 1 1 74 1 2 1 1 25 PHE HB3 . 29 . HB1 1 1 75 1 1 1 1 13 TRP HE3 . 17 . HE3 1 1 75 1 2 1 1 25 PHE HB2 . 29 . HB2 1 1 76 1 1 1 1 13 TRP HE3 . 17 . HE3 1 1 76 1 2 1 1 25 PHE QD . 29 . HD# 1 1 77 1 1 1 1 13 TRP HZ3 . 17 . HZ3 1 1 77 1 2 1 1 25 PHE H . 29 . HN 1 1 78 1 1 1 1 13 TRP HZ3 . 17 . HZ3 1 1 78 1 2 1 1 25 PHE HA . 29 . HA 1 1 79 1 1 1 1 13 TRP HZ3 . 17 . HZ3 1 1 79 1 2 1 1 25 PHE HB3 . 29 . HB1 1 1 80 1 1 1 1 13 TRP HZ3 . 17 . HZ3 1 1 80 1 2 1 1 25 PHE HB2 . 29 . HB2 1 1 81 1 1 1 1 13 TRP HH2 . 17 . HH2 1 1 81 1 2 1 1 25 PHE HB3 . 29 . HB1 1 1 82 1 1 1 1 13 TRP HH2 . 17 . HH2 1 1 82 1 2 1 1 25 PHE HB2 . 29 . HB2 1 1 83 1 1 1 1 13 TRP HE3 . 17 . HE3 1 1 83 1 2 1 1 26 LEU H . 30 . HN 1 1 84 1 1 1 1 13 TRP HA . 17 . HA 1 1 84 1 2 1 1 27 ASN HA . 31 . HA 1 1 85 1 1 1 1 13 TRP HE1 . 17 . HE1 1 1 85 1 2 1 1 27 ASN HD22 . 31 . HD21 1 1 86 1 1 1 1 13 TRP HE1 . 17 . HE1 1 1 86 1 2 1 1 27 ASN HD21 . 31 . HD22 1 1 87 1 1 1 1 13 TRP HZ2 . 17 . HZ2 1 1 87 1 2 1 1 27 ASN QB . 31 . HB1 1 1 88 1 1 1 1 13 TRP HZ2 . 17 . HZ2 1 1 88 1 2 1 1 27 ASN HD22 . 31 . HD21 1 1 89 1 1 1 1 13 TRP HZ2 . 17 . HZ2 1 1 89 1 2 1 1 27 ASN HD21 . 31 . HD22 1 1 90 1 1 1 1 13 TRP HZ3 . 17 . HZ3 1 1 90 1 2 1 1 27 ASN QB . 31 . HB1 1 1 91 1 1 1 1 13 TRP HH2 . 17 . HH2 1 1 91 1 2 1 1 27 ASN QB . 31 . HB1 1 1 92 1 1 1 1 13 TRP HH2 . 17 . HH2 1 1 92 1 2 1 1 27 ASN HD21 . 31 . HD22 1 1 93 1 1 1 1 13 TRP HA . 17 . HA 1 1 93 1 2 1 1 28 HIS H . 32 . HN 1 1 94 1 1 1 1 13 TRP HD1 . 17 . HD1 1 1 94 1 2 1 1 29 ILE HB . 33 . HB 1 1 95 1 1 1 1 13 TRP HD1 . 17 . HD1 1 1 95 1 2 1 1 29 ILE QG . 33 . HG1# 1 1 96 1 1 1 1 13 TRP HE1 . 17 . HE1 1 1 96 1 2 1 1 29 ILE HB . 33 . HB 1 1 97 1 1 1 1 13 TRP HE1 . 17 . HE1 1 1 97 1 2 1 1 29 ILE MD . 33 . HD1# 1 1 98 1 1 1 1 13 TRP HE1 . 17 . HE1 1 1 98 1 2 1 1 29 ILE QG . 33 . HG1# 1 1 99 1 1 1 1 13 TRP HE3 . 17 . HE3 1 1 99 1 2 1 1 34 THR MG . 38 . HG2# 1 1 100 1 1 1 1 13 TRP HZ3 . 17 . HZ3 1 1 100 1 2 1 1 34 THR MG . 38 . HG2# 1 1 101 1 1 1 1 13 TRP HH2 . 17 . HH2 1 1 101 1 2 1 1 34 THR HB . 38 . HB 1 1 102 1 1 1 1 13 TRP HH2 . 17 . HH2 1 1 102 1 2 1 1 34 THR MG . 38 . HG2# 1 1 103 1 1 1 1 13 TRP HE3 . 17 . HE3 1 1 103 1 2 1 1 38 PRO QG . 42 . HG# 1 1 104 1 1 1 1 13 TRP HZ3 . 17 . HZ3 1 1 104 1 2 1 1 38 PRO HD2 . 42 . HD2 1 1 105 1 1 1 1 14 GLU HA . 18 . HA 1 1 105 1 2 1 1 15 MET H . 19 . HN 1 1 106 1 1 1 1 14 GLU HA . 18 . HA 1 1 106 1 2 1 1 15 MET ME . 19 . HE# 1 1 107 1 1 1 1 14 GLU HB3 . 18 . HB1 1 1 107 1 2 1 1 15 MET H . 19 . HN 1 1 108 1 1 1 1 14 GLU HB2 . 18 . HB2 1 1 108 1 2 1 1 15 MET H . 19 . HN 1 1 109 1 1 1 1 14 GLU QG . 18 . HG# 1 1 109 1 2 1 1 15 MET H . 19 . HN 1 1 110 1 1 1 1 14 GLU HB3 . 18 . HB1 1 1 110 1 2 1 1 16 ALA MB . 20 . HB# 1 1 111 1 1 1 1 14 GLU HB2 . 18 . HB2 1 1 111 1 2 1 1 16 ALA MB . 20 . HB# 1 1 112 1 1 1 1 14 GLU QG . 18 . HG# 1 1 112 1 2 1 1 16 ALA MB . 20 . HB# 1 1 113 1 1 1 1 14 GLU HB3 . 18 . HB1 1 1 113 1 2 1 1 26 LEU HB3 . 30 . HB2 1 1 114 1 1 1 1 14 GLU H . 18 . HN 1 1 114 1 2 1 1 27 ASN HA . 31 . HA 1 1 115 1 1 1 1 14 GLU QG . 18 . HG# 1 1 115 1 2 1 1 28 HIS HD2 . 32 . HD2 1 1 116 1 1 1 1 15 MET H . 19 . HN 1 1 116 1 2 1 1 15 MET HB2 . 19 . HB1 1 1 117 1 1 1 1 15 MET H . 19 . HN 1 1 117 1 2 1 1 15 MET HB3 . 19 . HB2 1 1 118 1 1 1 1 15 MET HA . 19 . HA 1 1 118 1 2 1 1 16 ALA H . 20 . HN 1 1 119 1 1 1 1 15 MET HB2 . 19 . HB1 1 1 119 1 2 1 1 16 ALA H . 20 . HN 1 1 120 1 1 1 1 15 MET HB3 . 19 . HB2 1 1 120 1 2 1 1 16 ALA H . 20 . HN 1 1 121 1 1 1 1 15 MET HG2 . 19 . HG2 1 1 121 1 2 1 1 16 ALA H . 20 . HN 1 1 122 1 1 1 1 15 MET HA . 19 . HA 1 1 122 1 2 1 1 25 PHE QD . 29 . HD# 1 1 123 1 1 1 1 15 MET HB2 . 19 . HB1 1 1 123 1 2 1 1 25 PHE QD . 29 . HD# 1 1 124 1 1 1 1 15 MET HB3 . 19 . HB2 1 1 124 1 2 1 1 25 PHE QD . 29 . HD# 1 1 125 1 1 1 1 15 MET ME . 19 . HE# 1 1 125 1 2 1 1 25 PHE QD . 29 . HD# 1 1 126 1 1 1 1 15 MET HA . 19 . HA 1 1 126 1 2 1 1 26 LEU H . 30 . HN 1 1 127 1 1 1 1 16 ALA HA . 20 . HA 1 1 127 1 2 1 1 17 LYS H . 21 . HN 1 1 128 1 1 1 1 16 ALA MB . 20 . HB# 1 1 128 1 2 1 1 17 LYS H . 21 . HN 1 1 129 1 1 1 1 16 ALA H . 20 . HN 1 1 129 1 2 1 1 24 TYR H . 28 . HN 1 1 130 1 1 1 1 16 ALA H . 20 . HN 1 1 130 1 2 1 1 25 PHE HA . 29 . HA 1 1 131 1 1 1 1 17 LYS HA . 21 . HA 1 1 131 1 2 1 1 18 THR H . 22 . HN 1 1 132 1 1 1 1 17 LYS HB3 . 21 . HB1 1 1 132 1 2 1 1 18 THR H . 22 . HN 1 1 133 1 1 1 1 17 LYS HA . 21 . HA 1 1 133 1 2 1 1 24 TYR H . 28 . HN 1 1 134 1 1 1 1 17 LYS HA . 21 . HA 1 1 134 1 2 1 1 24 TYR QD . 28 . HD# 1 1 135 1 1 1 1 17 LYS HA . 21 . HA 1 1 135 1 2 1 1 24 TYR QE . 28 . HE# 1 1 136 1 1 1 1 18 THR HA . 22 . HA 1 1 136 1 2 1 1 19 SER H . 23 . HN 1 1 137 1 1 1 1 18 THR HB . 22 . HB 1 1 137 1 2 1 1 19 SER H . 23 . HN 1 1 138 1 1 1 1 18 THR H . 22 . HN 1 1 138 1 2 1 1 22 GLN H . 26 . HN 1 1 139 1 1 1 1 18 THR MG . 22 . HG2# 1 1 139 1 2 1 1 22 GLN QB . 26 . HB1 1 1 140 1 1 1 1 18 THR H . 22 . HN 1 1 140 1 2 1 1 23 ARG HA . 27 . HA 1 1 141 1 1 1 1 18 THR HB . 22 . HB 1 1 141 1 2 1 1 24 TYR QE . 28 . HE# 1 1 142 1 1 1 1 18 THR MG . 22 . HG2# 1 1 142 1 2 1 1 24 TYR QD . 28 . HD# 1 1 143 1 1 1 1 18 THR MG . 22 . HG2# 1 1 143 1 2 1 1 35 TRP HE3 . 39 . HE3 1 1 144 1 1 1 1 18 THR MG . 22 . HG2# 1 1 144 1 2 1 1 35 TRP HZ2 . 39 . HZ2 1 1 145 1 1 1 1 18 THR MG . 22 . HG2# 1 1 145 1 2 1 1 35 TRP HZ3 . 39 . HZ3 1 1 146 1 1 1 1 19 SER H . 23 . HN 1 1 146 1 2 1 1 20 SER H . 24 . HN 1 1 147 1 1 1 1 19 SER HA . 23 . HA 1 1 147 1 2 1 1 20 SER H . 24 . HN 1 1 148 1 1 1 1 19 SER QB . 23 . HB# 1 1 148 1 2 1 1 20 SER H . 24 . HN 1 1 149 1 1 1 1 20 SER H . 24 . HN 1 1 149 1 2 1 1 21 GLY H . 25 . HN 1 1 150 1 1 1 1 20 SER HA . 24 . HA 1 1 150 1 2 1 1 21 GLY H . 25 . HN 1 1 151 1 1 1 1 20 SER HB2 . 24 . HB1 1 1 151 1 2 1 1 21 GLY H . 25 . HN 1 1 152 1 1 1 1 20 SER HB3 . 24 . HB2 1 1 152 1 2 1 1 21 GLY H . 25 . HN 1 1 153 1 1 1 1 21 GLY H . 25 . HN 1 1 153 1 2 1 1 22 GLN H . 26 . HN 1 1 154 1 1 1 1 21 GLY HA3 . 25 . HA1 1 1 154 1 2 1 1 22 GLN H . 26 . HN 1 1 155 1 1 1 1 21 GLY HA2 . 25 . HA2 1 1 155 1 2 1 1 22 GLN H . 26 . HN 1 1 156 1 1 1 1 22 GLN H . 26 . HN 1 1 156 1 2 1 1 22 GLN QB . 26 . HB1 1 1 157 1 1 1 1 22 GLN H . 26 . HN 1 1 157 1 2 1 1 23 ARG H . 27 . HN 1 1 158 1 1 1 1 22 GLN HA . 26 . HA 1 1 158 1 2 1 1 23 ARG H . 27 . HN 1 1 159 1 1 1 1 22 GLN QB . 26 . HB1 1 1 159 1 2 1 1 23 ARG H . 27 . HN 1 1 160 1 1 1 1 22 GLN QG . 26 . HG1 1 1 160 1 2 1 1 23 ARG H . 27 . HN 1 1 161 1 1 1 1 22 GLN QB . 26 . HB1 1 1 161 1 2 1 1 35 TRP HZ3 . 39 . HZ3 1 1 162 1 1 1 1 22 GLN QB . 26 . HB2 1 1 162 1 2 1 1 35 TRP HH2 . 39 . HH2 1 1 163 1 1 1 1 22 GLN QG . 26 . HG1 1 1 163 1 2 1 1 35 TRP HZ3 . 39 . HZ3 1 1 164 1 1 1 1 22 GLN QG . 26 . HG1 1 1 164 1 2 1 1 35 TRP HH2 . 39 . HH2 1 1 165 1 1 1 1 23 ARG HA . 27 . HA 1 1 165 1 2 1 1 24 TYR H . 28 . HN 1 1 166 1 1 1 1 23 ARG HB2 . 27 . HB1 1 1 166 1 2 1 1 24 TYR H . 28 . HN 1 1 167 1 1 1 1 23 ARG HB3 . 27 . HB2 1 1 167 1 2 1 1 24 TYR H . 28 . HN 1 1 168 1 1 1 1 23 ARG QG . 27 . HG1 1 1 168 1 2 1 1 24 TYR H . 28 . HN 1 1 169 1 1 1 1 23 ARG HD3 . 27 . HD1 1 1 169 1 2 1 1 24 TYR H . 28 . HN 1 1 170 1 1 1 1 23 ARG HD2 . 27 . HD2 1 1 170 1 2 1 1 24 TYR H . 28 . HN 1 1 171 1 1 1 1 24 TYR H . 28 . HN 1 1 171 1 2 1 1 24 TYR QD . 28 . HD# 1 1 172 1 1 1 1 24 TYR HA . 28 . HA 1 1 172 1 2 1 1 24 TYR QD . 28 . HD# 1 1 173 1 1 1 1 24 TYR HB2 . 28 . HB1 1 1 173 1 2 1 1 24 TYR QD . 28 . HD# 1 1 174 1 1 1 1 24 TYR HB3 . 28 . HB2 1 1 174 1 2 1 1 24 TYR QD . 28 . HD# 1 1 175 1 1 1 1 24 TYR HA . 28 . HA 1 1 175 1 2 1 1 25 PHE H . 29 . HN 1 1 176 1 1 1 1 24 TYR HA . 28 . HA 1 1 176 1 2 1 1 25 PHE QD . 29 . HD# 1 1 177 1 1 1 1 24 TYR HB2 . 28 . HB1 1 1 177 1 2 1 1 25 PHE H . 29 . HN 1 1 178 1 1 1 1 24 TYR HB3 . 28 . HB2 1 1 178 1 2 1 1 25 PHE H . 29 . HN 1 1 179 1 1 1 1 24 TYR QD . 28 . HD# 1 1 179 1 2 1 1 25 PHE H . 29 . HN 1 1 180 1 1 1 1 24 TYR QD . 28 . HD# 1 1 180 1 2 1 1 26 LEU HB2 . 30 . HB1 1 1 181 1 1 1 1 24 TYR QD . 28 . HD# 1 1 181 1 2 1 1 26 LEU HB3 . 30 . HB2 1 1 182 1 1 1 1 24 TYR QD . 28 . HD# 1 1 182 1 2 1 1 26 LEU HG . 30 . HG 1 1 183 1 1 1 1 24 TYR QD . 28 . HD# 1 1 183 1 2 1 1 26 LEU MD1 . 30 . HD1# 1 1 184 1 1 1 1 24 TYR QD . 28 . HD# 1 1 184 1 2 1 1 26 LEU MD2 . 30 . HD2# 1 1 185 1 1 1 1 24 TYR QE . 28 . HE# 1 1 185 1 2 1 1 26 LEU HB2 . 30 . HB1 1 1 186 1 1 1 1 24 TYR QE . 28 . HE# 1 1 186 1 2 1 1 26 LEU HB3 . 30 . HB2 1 1 187 1 1 1 1 24 TYR QE . 28 . HE# 1 1 187 1 2 1 1 26 LEU HG . 30 . HG 1 1 188 1 1 1 1 24 TYR QE . 28 . HE# 1 1 188 1 2 1 1 26 LEU MD1 . 30 . HD1# 1 1 189 1 1 1 1 24 TYR QE . 28 . HE# 1 1 189 1 2 1 1 26 LEU MD2 . 30 . HD2# 1 1 190 1 1 1 1 24 TYR QD . 28 . HD# 1 1 190 1 2 1 1 33 THR HB . 37 . HB 1 1 191 1 1 1 1 24 TYR QD . 28 . HD# 1 1 191 1 2 1 1 33 THR MG . 37 . HG2# 1 1 192 1 1 1 1 24 TYR QE . 28 . HE# 1 1 192 1 2 1 1 33 THR HB . 37 . HB 1 1 193 1 1 1 1 24 TYR QE . 28 . HE# 1 1 193 1 2 1 1 33 THR MG . 37 . HG2# 1 1 194 1 1 1 1 24 TYR HA . 28 . HA 1 1 194 1 2 1 1 35 TRP HE3 . 39 . HE3 1 1 195 1 1 1 1 24 TYR HB2 . 28 . HB1 1 1 195 1 2 1 1 35 TRP HE3 . 39 . HE3 1 1 196 1 1 1 1 24 TYR HB3 . 28 . HB2 1 1 196 1 2 1 1 35 TRP HE3 . 39 . HE3 1 1 197 1 1 1 1 24 TYR QD . 28 . HD# 1 1 197 1 2 1 1 35 TRP HE3 . 39 . HE3 1 1 198 1 1 1 1 25 PHE H . 29 . HN 1 1 198 1 2 1 1 25 PHE QD . 29 . HD# 1 1 199 1 1 1 1 25 PHE HA . 29 . HA 1 1 199 1 2 1 1 25 PHE QD . 29 . HD# 1 1 200 1 1 1 1 25 PHE HA . 29 . HA 1 1 200 1 2 1 1 26 LEU H . 30 . HN 1 1 201 1 1 1 1 25 PHE HB3 . 29 . HB1 1 1 201 1 2 1 1 26 LEU H . 30 . HN 1 1 202 1 1 1 1 25 PHE HB2 . 29 . HB2 1 1 202 1 2 1 1 26 LEU H . 30 . HN 1 1 203 1 1 1 1 25 PHE QD . 29 . HD# 1 1 203 1 2 1 1 26 LEU H . 30 . HN 1 1 204 1 1 1 1 25 PHE H . 29 . HN 1 1 204 1 2 1 1 34 THR H . 38 . HN 1 1 205 1 1 1 1 25 PHE QD . 29 . HD# 1 1 205 1 2 1 1 34 THR MG . 38 . HG2# 1 1 206 1 1 1 1 25 PHE H . 29 . HN 1 1 206 1 2 1 1 35 TRP HA . 39 . HA 1 1 207 1 1 1 1 25 PHE QD . 29 . HD# 1 1 207 1 2 1 1 35 TRP HA . 39 . HA 1 1 208 1 1 1 1 26 LEU HA . 30 . HA 1 1 208 1 2 1 1 27 ASN H . 31 . HN 1 1 209 1 1 1 1 26 LEU HB2 . 30 . HB1 1 1 209 1 2 1 1 27 ASN H . 31 . HN 1 1 210 1 1 1 1 26 LEU HB3 . 30 . HB2 1 1 210 1 2 1 1 27 ASN H . 31 . HN 1 1 211 1 1 1 1 26 LEU HG . 30 . HG 1 1 211 1 2 1 1 27 ASN H . 31 . HN 1 1 212 1 1 1 1 26 LEU MD1 . 30 . HD1# 1 1 212 1 2 1 1 28 HIS HD2 . 32 . HD2 1 1 213 1 1 1 1 26 LEU HA . 30 . HA 1 1 213 1 2 1 1 34 THR H . 38 . HN 1 1 214 1 1 1 1 27 ASN QB . 31 . HB1 1 1 214 1 2 1 1 27 ASN HD21 . 31 . HD22 1 1 215 1 1 1 1 27 ASN HA . 31 . HA 1 1 215 1 2 1 1 28 HIS H . 32 . HN 1 1 216 1 1 1 1 27 ASN H . 31 . HN 1 1 216 1 2 1 1 32 THR H . 36 . HN 1 1 217 1 1 1 1 27 ASN H . 31 . HN 1 1 217 1 2 1 1 33 THR HA . 37 . HA 1 1 218 1 1 1 1 28 HIS H . 32 . HN 1 1 218 1 2 1 1 28 HIS HD2 . 32 . HD2 1 1 219 1 1 1 1 28 HIS HA . 32 . HA 1 1 219 1 2 1 1 28 HIS HD2 . 32 . HD2 1 1 220 1 1 1 1 28 HIS HB2 . 32 . HB1 1 1 220 1 2 1 1 28 HIS HD2 . 32 . HD2 1 1 221 1 1 1 1 28 HIS HB3 . 32 . HB2 1 1 221 1 2 1 1 28 HIS HD2 . 32 . HD2 1 1 222 1 1 1 1 28 HIS H . 32 . HN 1 1 222 1 2 1 1 29 ILE H . 33 . HN 1 1 223 1 1 1 1 28 HIS HA . 32 . HA 1 1 223 1 2 1 1 29 ILE H . 33 . HN 1 1 224 1 1 1 1 28 HIS HB2 . 32 . HB1 1 1 224 1 2 1 1 29 ILE H . 33 . HN 1 1 225 1 1 1 1 28 HIS HB3 . 32 . HB2 1 1 225 1 2 1 1 29 ILE H . 33 . HN 1 1 226 1 1 1 1 28 HIS HA . 32 . HA 1 1 226 1 2 1 1 31 GLN HA . 35 . HA 1 1 227 1 1 1 1 29 ILE H . 33 . HN 1 1 227 1 2 1 1 30 ASP H . 34 . HN 1 1 228 1 1 1 1 29 ILE HA . 33 . HA 1 1 228 1 2 1 1 30 ASP H . 34 . HN 1 1 229 1 1 1 1 29 ILE HB . 33 . HB 1 1 229 1 2 1 1 30 ASP H . 34 . HN 1 1 230 1 1 1 1 29 ILE MD . 33 . HD1# 1 1 230 1 2 1 1 30 ASP H . 34 . HN 1 1 231 1 1 1 1 29 ILE QG . 33 . HG1# 1 1 231 1 2 1 1 30 ASP H . 34 . HN 1 1 232 1 1 1 1 30 ASP H . 34 . HN 1 1 232 1 2 1 1 31 GLN H . 35 . HN 1 1 233 1 1 1 1 30 ASP HA . 34 . HA 1 1 233 1 2 1 1 31 GLN H . 35 . HN 1 1 234 1 1 1 1 30 ASP HB3 . 34 . HB1 1 1 234 1 2 1 1 31 GLN H . 35 . HN 1 1 235 1 1 1 1 30 ASP HB2 . 34 . HB2 1 1 235 1 2 1 1 31 GLN H . 35 . HN 1 1 236 1 1 1 1 31 GLN HA . 35 . HA 1 1 236 1 2 1 1 32 THR H . 36 . HN 1 1 237 1 1 1 1 32 THR HA . 36 . HA 1 1 237 1 2 1 1 33 THR H . 37 . HN 1 1 238 1 1 1 1 32 THR HB . 36 . HB 1 1 238 1 2 1 1 33 THR H . 37 . HN 1 1 239 1 1 1 1 32 THR MG . 36 . HG2# 1 1 239 1 2 1 1 33 THR H . 37 . HN 1 1 240 1 1 1 1 33 THR HA . 37 . HA 1 1 240 1 2 1 1 34 THR H . 38 . HN 1 1 241 1 1 1 1 33 THR HB . 37 . HB 1 1 241 1 2 1 1 34 THR H . 38 . HN 1 1 242 1 1 1 1 33 THR MG . 37 . HG2# 1 1 242 1 2 1 1 34 THR H . 38 . HN 1 1 243 1 1 1 1 34 THR HA . 38 . HA 1 1 243 1 2 1 1 35 TRP H . 39 . HN 1 1 244 1 1 1 1 34 THR HB . 38 . HB 1 1 244 1 2 1 1 35 TRP H . 39 . HN 1 1 245 1 1 1 1 34 THR MG . 38 . HG2# 1 1 245 1 2 1 1 35 TRP H . 39 . HN 1 1 246 1 1 1 1 35 TRP HA . 39 . HA 1 1 246 1 2 1 1 35 TRP HE3 . 39 . HE3 1 1 247 1 1 1 1 35 TRP HB3 . 39 . HB1 1 1 247 1 2 1 1 35 TRP HE3 . 39 . HE3 1 1 248 1 1 1 1 35 TRP HA . 39 . HA 1 1 248 1 2 1 1 36 GLN H . 40 . HN 1 1 249 1 1 1 1 36 GLN HA . 40 . HA 1 1 249 1 2 1 1 37 ASP H . 41 . HN 1 1 250 1 1 1 1 36 GLN HB3 . 40 . HB1 1 1 250 1 2 1 1 37 ASP H . 41 . HN 1 1 251 1 1 1 1 39 ARG HA . 43 . HA 1 1 251 1 2 1 1 40 LYS H . 44 . HN 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 . . . . . 5.0 1.8 5.75 1 1 2 1 . . . . . 3.5 1.8 3.9 1 1 3 1 . . . . . 3.5 1.8 3.9 1 1 4 1 . . . . . 4.0 1.8 4.75 1 1 5 1 . . . . . 4.5 1.8 5.25 1 1 6 1 . . . . . 4.0 1.8 4.75 1 1 7 1 . . . . . 4.0 1.8 4.75 1 1 8 1 . . . . . 5.0 1.8 5.75 1 1 9 1 . . . . . 4.0 1.8 4.75 1 1 10 1 . . . . . 4.0 1.8 4.75 1 1 11 1 . . . . . 4.5 1.8 5.25 1 1 12 1 . . . . . 4.0 1.8 4.75 1 1 13 1 . . . . . 3.0 1.8 3.4 1 1 14 1 . . . . . 2.5 1.8 2.8 1 1 15 1 . . . . . 3.0 1.8 3.4 1 1 16 1 . . . . . 4.0 1.8 4.75 1 1 17 1 . . . . . 4.0 1.8 4.75 1 1 18 1 . . . . . 4.5 1.8 5.25 1 1 19 1 . . . . . 3.0 1.8 3.4 1 1 20 1 . . . . . 3.0 1.8 3.4 1 1 21 1 . . . . . 3.0 1.8 3.4 1 1 22 1 . . . . . 4.0 1.8 4.75 1 1 23 1 . . . . . 3.0 1.8 3.4 1 1 24 1 . . . . . 3.0 1.8 3.4 1 1 25 1 . . . . . 2.5 1.8 2.8 1 1 26 1 . . . . . 3.0 1.8 3.4 1 1 27 1 . . . . . 5.0 1.8 5.75 1 1 28 1 . . . . . 4.0 1.8 4.75 1 1 29 1 . . . . . 4.0 1.8 4.75 1 1 30 1 . . . . . 4.0 1.8 4.75 1 1 31 1 . . . . . 3.5 1.8 3.9 1 1 32 1 . . . . . 3.0 1.8 3.4 1 1 33 1 . . . . . 3.5 1.8 3.9 1 1 34 1 . . . . . 4.0 1.8 4.75 1 1 35 1 . . . . . 4.0 1.8 4.75 1 1 36 1 . . . . . 4.0 1.8 4.75 1 1 37 1 . . . . . 5.0 1.8 5.75 1 1 38 1 . . . . . 4.0 1.8 4.75 1 1 39 1 . . . . . 5.0 1.8 5.75 1 1 40 1 . . . . . 5.0 1.8 5.75 1 1 41 1 . . . . . 5.0 1.8 5.75 1 1 42 1 . . . . . 4.0 1.8 4.75 1 1 43 1 . . . . . 4.0 1.8 4.75 1 1 44 1 . . . . . 5.0 1.8 5.75 1 1 45 1 . . . . . 5.0 1.8 5.75 1 1 46 1 . . . . . 2.5 1.8 2.8 1 1 47 1 . . . . . 4.0 1.8 4.75 1 1 48 1 . . . . . 3.0 1.8 3.4 1 1 49 1 . . . . . 4.0 1.8 4.75 1 1 50 1 . . . . . 4.0 1.8 4.75 1 1 51 1 . . . . . 4.0 1.8 4.75 1 1 52 1 . . . . . 4.5 1.8 5.25 1 1 53 1 . . . . . 4.0 1.8 4.75 1 1 54 1 . . . . . 3.0 1.8 3.4 1 1 55 1 . . . . . 4.5 1.8 5.25 1 1 56 1 . . . . . 2.5 1.8 2.8 1 1 57 1 . . . . . 3.0 1.8 3.4 1 1 58 1 . . . . . 3.0 1.8 3.4 1 1 59 1 . . . . . 5.0 1.8 5.75 1 1 60 1 . . . . . 2.5 1.8 2.8 1 1 61 1 . . . . . 4.0 1.8 4.75 1 1 62 1 . . . . . 4.0 1.8 4.75 1 1 63 1 . . . . . 4.0 1.8 4.75 1 1 64 1 . . . . . 5.0 1.8 5.75 1 1 65 1 . . . . . 4.5 1.8 5.25 1 1 66 1 . . . . . 3.0 1.8 3.4 1 1 67 1 . . . . . 4.0 1.8 4.75 1 1 68 1 . . . . . 5.0 1.8 5.75 1 1 69 1 . . . . . 3.0 1.8 3.4 1 1 70 1 . . . . . 5.0 1.8 5.75 1 1 71 1 . . . . . 4.0 1.8 4.75 1 1 72 1 . . . . . 4.0 1.8 4.75 1 1 73 1 . . . . . 4.0 1.8 4.75 1 1 74 1 . . . . . 3.5 1.8 3.9 1 1 75 1 . . . . . 4.0 1.8 4.75 1 1 76 1 . . . . . 4.0 1.8 4.75 1 1 77 1 . . . . . 5.0 1.8 5.75 1 1 78 1 . . . . . 5.0 1.8 5.75 1 1 79 1 . . . . . 3.0 1.8 3.4 1 1 80 1 . . . . . 3.0 1.8 3.4 1 1 81 1 . . . . . 4.0 1.8 4.75 1 1 82 1 . . . . . 3.5 1.8 3.9 1 1 83 1 . . . . . 5.0 1.8 5.75 1 1 84 1 . . . . . 4.0 1.8 4.75 1 1 85 1 . . . . . 5.0 1.8 5.75 1 1 86 1 . . . . . 4.0 1.8 4.75 1 1 87 1 . . . . . 5.0 1.8 5.75 1 1 88 1 . . . . . 5.0 1.8 5.75 1 1 89 1 . . . . . 3.0 1.8 3.4 1 1 90 1 . . . . . 3.0 1.8 3.4 1 1 91 1 . . . . . 4.0 1.8 4.75 1 1 92 1 . . . . . 4.0 1.8 4.75 1 1 93 1 . . . . . 4.0 1.8 4.75 1 1 94 1 . . . . . 5.0 1.8 5.75 1 1 95 1 . . . . . 5.0 1.8 5.75 1 1 96 1 . . . . . 4.0 1.8 4.75 1 1 97 1 . . . . . 5.0 1.8 5.75 1 1 98 1 . . . . . 4.0 1.8 4.75 1 1 99 1 . . . . . 5.0 1.8 5.75 1 1 100 1 . . . . . 3.0 1.8 3.4 1 1 101 1 . . . . . 5.0 1.8 5.75 1 1 102 1 . . . . . 4.0 1.8 4.75 1 1 103 1 . . . . . 5.0 1.8 5.75 1 1 104 1 . . . . . 5.5 1.8 6.25 1 1 105 1 . . . . . 2.5 1.8 2.8 1 1 106 1 . . . . . 4.0 1.8 4.75 1 1 107 1 . . . . . 4.0 1.8 4.75 1 1 108 1 . . . . . 4.0 1.8 4.75 1 1 109 1 . . . . . 5.0 1.8 5.75 1 1 110 1 . . . . . 5.0 1.8 5.75 1 1 111 1 . . . . . 4.0 1.8 4.75 1 1 112 1 . . . . . 5.0 1.8 5.75 1 1 113 1 . . . . . 3.0 1.8 3.4 1 1 114 1 . . . . . 5.0 1.8 5.75 1 1 115 1 . . . . . 4.0 1.8 4.75 1 1 116 1 . . . . . 3.0 1.8 3.4 1 1 117 1 . . . . . 3.0 1.8 3.4 1 1 118 1 . . . . . 2.5 1.8 2.8 1 1 119 1 . . . . . 3.0 1.8 3.4 1 1 120 1 . . . . . 4.0 1.8 4.75 1 1 121 1 . . . . . 4.0 1.8 4.75 1 1 122 1 . . . . . 3.0 1.8 3.4 1 1 123 1 . . . . . 4.0 1.8 4.75 1 1 124 1 . . . . . 4.0 1.8 4.75 1 1 125 1 . . . . . 5.0 1.8 5.75 1 1 126 1 . . . . . 4.0 1.8 4.75 1 1 127 1 . . . . . 3.0 1.8 3.4 1 1 128 1 . . . . . 3.0 1.8 3.4 1 1 129 1 . . . . . 3.0 1.8 3.4 1 1 130 1 . . . . . 5.0 1.8 5.75 1 1 131 1 . . . . . 3.0 1.8 3.4 1 1 132 1 . . . . . 4.0 1.8 4.75 1 1 133 1 . . . . . 5.0 1.8 5.75 1 1 134 1 . . . . . 5.0 1.8 5.75 1 1 135 1 . . . . . 4.0 1.8 4.75 1 1 136 1 . . . . . 2.5 1.8 2.8 1 1 137 1 . . . . . 3.0 1.8 3.4 1 1 138 1 . . . . . 5.0 1.8 5.75 1 1 139 1 . . . . . 4.5 1.8 5.25 1 1 140 1 . . . . . 5.0 1.8 5.75 1 1 141 1 . . . . . 3.0 1.8 3.4 1 1 142 1 . . . . . 4.0 1.8 4.75 1 1 143 1 . . . . . 3.0 1.8 3.4 1 1 144 1 . . . . . 5.0 1.8 5.75 1 1 145 1 . . . . . 4.0 1.8 4.75 1 1 146 1 . . . . . 4.0 1.8 4.75 1 1 147 1 . . . . . 4.0 1.8 4.75 1 1 148 1 . . . . . 4.0 1.8 4.75 1 1 149 1 . . . . . 3.0 1.8 3.4 1 1 150 1 . . . . . 3.0 1.8 3.4 1 1 151 1 . . . . . 5.0 1.8 5.75 1 1 152 1 . . . . . 3.0 1.8 3.4 1 1 153 1 . . . . . 3.0 1.8 3.4 1 1 154 1 . . . . . 5.0 1.8 5.75 1 1 155 1 . . . . . 5.0 1.8 5.75 1 1 156 1 . . . . . . 1.8 3.4 1 1 157 1 . . . . . 5.0 1.8 5.75 1 1 158 1 . . . . . 2.5 1.8 2.8 1 1 159 1 . . . . . 4.0 1.8 4.75 1 1 160 1 . . . . . 5.0 1.8 5.75 1 1 161 1 . . . . . 4.0 1.8 4.75 1 1 162 1 . . . . . 4.0 1.8 4.75 1 1 163 1 . . . . . 4.0 1.8 4.75 1 1 164 1 . . . . . 5.0 1.8 5.75 1 1 165 1 . . . . . 3.0 1.8 3.4 1 1 166 1 . . . . . 4.5 1.8 5.25 1 1 167 1 . . . . . 4.0 1.8 4.75 1 1 168 1 . . . . . 3.0 1.8 3.4 1 1 169 1 . . . . . 5.0 1.8 5.75 1 1 170 1 . . . . . 5.0 1.8 5.75 1 1 171 1 . . . . . 3.0 1.8 3.4 1 1 172 1 . . . . . 4.0 1.8 4.75 1 1 173 1 . . . . . 2.5 1.8 2.8 1 1 174 1 . . . . . 2.5 1.8 2.8 1 1 175 1 . . . . . 3.0 1.8 3.4 1 1 176 1 . . . . . 3.5 1.8 3.9 1 1 177 1 . . . . . 3.0 1.8 3.4 1 1 178 1 . . . . . 3.5 1.8 3.9 1 1 179 1 . . . . . 3.0 1.8 3.4 1 1 180 1 . . . . . 5.5 1.8 7.0 1 1 181 1 . . . . . 5.5 1.8 7.0 1 1 182 1 . . . . . 5.5 1.8 7.0 1 1 183 1 . . . . . 5.0 1.8 5.75 1 1 184 1 . . . . . 5.0 1.8 5.75 1 1 185 1 . . . . . 3.0 1.8 3.4 1 1 186 1 . . . . . 4.0 1.8 4.75 1 1 187 1 . . . . . 4.0 1.8 4.75 1 1 188 1 . . . . . 4.0 1.8 4.75 1 1 189 1 . . . . . 4.5 1.8 5.25 1 1 190 1 . . . . . 3.0 1.8 3.4 1 1 191 1 . . . . . 4.5 1.8 5.25 1 1 192 1 . . . . . 4.0 1.8 4.75 1 1 193 1 . . . . . 4.0 1.8 4.75 1 1 194 1 . . . . . 4.0 1.8 4.75 1 1 195 1 . . . . . 4.0 1.8 4.75 1 1 196 1 . . . . . 4.0 1.8 4.75 1 1 197 1 . . . . . 5.0 1.8 5.75 1 1 198 1 . . . . . 3.0 1.8 3.4 1 1 199 1 . . . . . 3.0 1.8 3.4 1 1 200 1 . . . . . 2.5 1.8 2.8 1 1 201 1 . . . . . 5.0 1.8 5.75 1 1 202 1 . . . . . 5.0 1.8 5.75 1 1 203 1 . . . . . 5.0 1.8 5.75 1 1 204 1 . . . . . 4.0 1.8 4.75 1 1 205 1 . . . . . 4.0 1.8 4.75 1 1 206 1 . . . . . 5.0 1.8 5.75 1 1 207 1 . . . . . 4.0 1.8 4.75 1 1 208 1 . . . . . 2.5 1.8 2.8 1 1 209 1 . . . . . 5.0 1.8 5.75 1 1 210 1 . . . . . 5.0 1.8 5.75 1 1 211 1 . . . . . 5.0 1.8 5.75 1 1 212 1 . . . . . 5.0 1.8 5.75 1 1 213 1 . . . . . 5.0 1.8 5.75 1 1 214 1 . . . . . 3.0 1.8 3.4 1 1 215 1 . . . . . 2.5 1.8 2.8 1 1 216 1 . . . . . 4.0 1.8 4.75 1 1 217 1 . . . . . 5.0 1.8 5.75 1 1 218 1 . . . . . 5.0 1.8 5.75 1 1 219 1 . . . . . 4.0 1.8 4.75 1 1 220 1 . . . . . 3.0 1.8 3.4 1 1 221 1 . . . . . 4.0 1.8 4.75 1 1 222 1 . . . . . 3.0 1.8 3.4 1 1 223 1 . . . . . 3.0 1.8 3.4 1 1 224 1 . . . . . 5.0 1.8 5.75 1 1 225 1 . . . . . 5.0 1.8 5.75 1 1 226 1 . . . . . 5.0 1.8 5.75 1 1 227 1 . . . . . 3.0 1.8 3.4 1 1 228 1 . . . . . 5.0 1.8 5.75 1 1 229 1 . . . . . 3.0 1.8 3.4 1 1 230 1 . . . . . 5.0 1.8 5.75 1 1 231 1 . . . . . 3.0 1.8 3.4 1 1 232 1 . . . . . 2.5 1.8 2.8 1 1 233 1 . . . . . 4.0 1.8 4.75 1 1 234 1 . . . . . 4.5 1.8 5.25 1 1 235 1 . . . . . 5.0 1.8 5.75 1 1 236 1 . . . . . 3.5 1.8 3.9 1 1 237 1 . . . . . 2.5 1.8 2.8 1 1 238 1 . . . . . 2.5 1.8 2.8 1 1 239 1 . . . . . 5.0 1.8 5.75 1 1 240 1 . . . . . 3.0 1.8 3.4 1 1 241 1 . . . . . 4.0 1.8 4.75 1 1 242 1 . . . . . 5.0 1.8 5.75 1 1 243 1 . . . . . 2.5 1.8 2.8 1 1 244 1 . . . . . 4.0 1.8 4.75 1 1 245 1 . . . . . 4.0 1.8 4.75 1 1 246 1 . . . . . 3.0 1.8 3.4 1 1 247 1 . . . . . 4.0 1.8 4.75 1 1 248 1 . . . . . 5.0 1.8 5.75 1 1 249 1 . . . . . 3.0 1.8 3.4 1 1 250 1 . . . . . 4.0 1.8 4.75 1 1 251 1 . . . . . 3.0 1.8 3.4 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 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 9 LEU QD . 13 . HD# 1 2 1 1 2 1 1 25 PHE QE . 29 . HE# 1 2 1 1 2 1 1 25 PHE HZ . 29 . HZ 1 2 2 1 1 1 1 15 MET HA . 19 . HA 1 2 2 1 2 1 1 25 PHE QE . 29 . HE# 1 2 2 1 2 1 1 25 PHE HZ . 29 . HZ 1 2 3 1 1 1 1 15 MET HB2 . 19 . HB1 1 2 3 1 2 1 1 25 PHE QE . 29 . HE# 1 2 3 1 2 1 1 25 PHE HZ . 29 . HZ 1 2 4 1 1 1 1 15 MET HB3 . 19 . HB2 1 2 4 1 2 1 1 25 PHE QE . 29 . HE# 1 2 4 1 2 1 1 25 PHE HZ . 29 . HZ 1 2 5 1 1 1 1 15 MET HG2 . 19 . HG2 1 2 5 1 2 1 1 25 PHE QE . 29 . HE# 1 2 5 1 2 1 1 25 PHE HZ . 29 . HZ 1 2 6 1 1 1 1 15 MET ME . 19 . HE# 1 2 6 1 2 1 1 25 PHE QE . 29 . HE# 1 2 6 1 2 1 1 25 PHE HZ . 29 . HZ 1 2 7 1 1 1 1 23 ARG HB2 . 27 . HB1 1 2 7 1 2 1 1 25 PHE QE . 29 . HE# 1 2 7 1 2 1 1 25 PHE HZ . 29 . HZ 1 2 8 1 1 1 1 23 ARG HB3 . 27 . HB2 1 2 8 1 2 1 1 25 PHE QE . 29 . HE# 1 2 8 1 2 1 1 25 PHE HZ . 29 . HZ 1 2 9 1 1 1 1 23 ARG QG . 27 . HG2 1 2 9 1 2 1 1 25 PHE QE . 29 . HE# 1 2 9 1 2 1 1 25 PHE HZ . 29 . HZ 1 2 10 1 1 1 1 24 TYR HA . 28 . HA 1 2 10 1 2 1 1 25 PHE QE . 29 . HE# 1 2 10 1 2 1 1 25 PHE HZ . 29 . HZ 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 . . . . . 4.0 1.8 4.7 1 2 2 1 . . . . . 5.0 1.8 5.75 1 2 3 1 . . . . . 4.0 1.8 4.75 1 2 4 1 . . . . . 3.0 1.8 3.4 1 2 5 1 . . . . . 5.0 1.8 5.75 1 2 6 1 . . . . . 5.0 1.8 5.75 1 2 7 1 . . . . . 4.0 1.8 4.75 1 2 8 1 . . . . . 3.0 1.8 3.4 1 2 9 1 . . . . . 5.0 1.8 5.75 1 2 10 1 . . . . . 5.0 1.8 5.75 1 2 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 3 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 9 1 . . . 1 3 10 1 . . . 1 3 11 1 . . . 1 3 12 1 . . . 1 3 13 1 . . . 1 3 14 1 . . . 1 3 15 1 . . . 1 3 16 1 . . . 1 3 17 1 . . . 1 3 18 1 . . . 1 3 19 1 . . . 1 3 20 1 . . . 1 3 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 12 GLY O . 16 . O 1 3 1 1 2 1 1 28 HIS N . 32 . N 1 3 2 1 1 1 1 12 GLY O . 16 . O 1 3 2 1 2 1 1 28 HIS H . 32 . HN 1 3 3 1 1 1 1 18 THR N . 22 . N 1 3 3 1 2 1 1 22 GLN O . 26 . O 1 3 4 1 1 1 1 18 THR H . 22 . HN 1 3 4 1 2 1 1 22 GLN O . 26 . O 1 3 5 1 1 1 1 27 ASN O . 31 . O 1 3 5 1 2 1 1 32 THR N . 36 . N 1 3 6 1 1 1 1 27 ASN O . 31 . O 1 3 6 1 2 1 1 32 THR H . 36 . HN 1 3 7 1 1 1 1 27 ASN N . 31 . N 1 3 7 1 2 1 1 32 THR O . 36 . O 1 3 8 1 1 1 1 27 ASN H . 31 . HN 1 3 8 1 2 1 1 32 THR O . 36 . O 1 3 9 1 1 1 1 14 GLU N . 18 . N 1 3 9 1 2 1 1 26 LEU O . 30 . O 1 3 10 1 1 1 1 14 GLU O . 18 . O 1 3 10 1 2 1 1 26 LEU N . 30 . N 1 3 11 1 1 1 1 14 GLU H . 18 . HN 1 3 11 1 2 1 1 26 LEU O . 30 . O 1 3 12 1 1 1 1 14 GLU O . 18 . O 1 3 12 1 2 1 1 26 LEU H . 30 . HN 1 3 13 1 1 1 1 16 ALA N . 20 . N 1 3 13 1 2 1 1 24 TYR O . 28 . O 1 3 14 1 1 1 1 16 ALA O . 20 . O 1 3 14 1 2 1 1 24 TYR N . 28 . N 1 3 15 1 1 1 1 16 ALA H . 20 . HN 1 3 15 1 2 1 1 24 TYR O . 28 . O 1 3 16 1 1 1 1 16 ALA O . 20 . O 1 3 16 1 2 1 1 24 TYR H . 28 . HN 1 3 17 1 1 1 1 25 PHE N . 29 . N 1 3 17 1 2 1 1 34 THR O . 38 . O 1 3 18 1 1 1 1 25 PHE O . 29 . O 1 3 18 1 2 1 1 34 THR N . 38 . N 1 3 19 1 1 1 1 25 PHE H . 29 . HN 1 3 19 1 2 1 1 34 THR O . 38 . O 1 3 20 1 1 1 1 25 PHE O . 29 . O 1 3 20 1 2 1 1 34 THR H . 38 . HN 1 3 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.9 2.6 3.4 1 3 2 1 . . . . . 1.9 1.4 2.0 1 3 3 1 . . . . . 2.9 2.6 3.4 1 3 4 1 . . . . . 1.9 1.4 2.0 1 3 5 1 . . . . . 2.9 2.6 3.4 1 3 6 1 . . . . . 1.9 1.4 2.0 1 3 7 1 . . . . . 2.9 2.6 3.4 1 3 8 1 . . . . . 1.9 1.4 2.0 1 3 9 1 . . . . . 2.9 2.6 3.4 1 3 10 1 . . . . . 2.9 2.6 3.4 1 3 11 1 . . . . . 1.9 1.4 2.0 1 3 12 1 . . . . . 1.9 1.4 2.0 1 3 13 1 . . . . . 2.9 2.6 3.4 1 3 14 1 . . . . . 2.9 2.6 3.4 1 3 15 1 . . . . . 1.9 1.4 2.0 1 3 16 1 . . . . . 1.9 1.4 2.0 1 3 17 1 . . . . . 2.9 2.6 3.4 1 3 18 1 . . . . . 2.9 2.6 3.4 1 3 19 1 . . . . . 1.9 1.4 2.0 1 3 20 1 . . . . . 1.9 1.4 2.0 1 3 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 PHE C C 2.767 -15.851 11.749 1.00 . A A . 5 PHE C 1 1 1 2 1 1 1 PHE CA C 2.574 -15.720 13.262 1.00 . A A . 5 PHE CA 1 1 1 3 1 1 1 PHE CB C 1.281 -16.407 13.700 1.00 . A A . 5 PHE CB 1 1 1 4 1 1 1 PHE CD1 C 2.103 -18.733 13.183 1.00 . A A . 5 PHE CD1 1 1 1 5 1 1 1 PHE CD2 C 1.334 -18.240 15.429 1.00 . A A . 5 PHE CD2 1 1 1 6 1 1 1 PHE CE1 C 2.381 -20.050 13.566 1.00 . A A . 5 PHE CE1 1 1 1 7 1 1 1 PHE CE2 C 1.612 -19.558 15.813 1.00 . A A . 5 PHE CE2 1 1 1 8 1 1 1 PHE CG C 1.580 -17.828 14.114 1.00 . A A . 5 PHE CG 1 1 1 9 1 1 1 PHE CZ C 2.135 -20.463 14.882 1.00 . A A . 5 PHE CZ 1 1 1 10 1 1 1 PHE HA H 3.414 -16.146 13.787 1.00 . A A . 5 PHE HA 1 1 1 11 1 1 1 PHE HB2 H 0.853 -15.871 14.534 1.00 . A A . 5 PHE HB2 1 1 1 12 1 1 1 PHE HB3 H 0.580 -16.413 12.879 1.00 . A A . 5 PHE HB3 1 1 1 13 1 1 1 PHE HD1 H 2.292 -18.415 12.168 1.00 . A A . 5 PHE HD1 1 1 1 14 1 1 1 PHE HD2 H 0.931 -17.542 16.148 1.00 . A A . 5 PHE HD2 1 1 1 15 1 1 1 PHE HE1 H 2.784 -20.748 12.849 1.00 . A A . 5 PHE HE1 1 1 1 16 1 1 1 PHE HE2 H 1.422 -19.876 16.827 1.00 . A A . 5 PHE HE2 1 1 1 17 1 1 1 PHE HZ H 2.349 -21.479 15.178 1.00 . A A . 5 PHE HZ 1 1 1 18 1 1 1 PHE N N 2.398 -14.288 13.638 1.00 . A A . 5 PHE N 1 1 1 19 1 1 1 PHE O O 1.829 -16.083 11.011 1.00 . A A . 5 PHE O 1 1 1 20 1 1 2 GLU C C 3.296 -14.880 9.042 1.00 . A A . 6 GLU C 1 1 1 21 1 1 2 GLU CA C 4.228 -15.819 9.815 1.00 . A A . 6 GLU CA 1 1 1 22 1 1 2 GLU CB C 3.922 -17.277 9.473 1.00 . A A . 6 GLU CB 1 1 1 23 1 1 2 GLU CD C 4.581 -18.966 7.753 1.00 . A A . 6 GLU CD 1 1 1 24 1 1 2 GLU CG C 5.097 -17.876 8.696 1.00 . A A . 6 GLU CG 1 1 1 25 1 1 2 GLU H H 4.718 -15.515 11.891 1.00 . A A . 6 GLU H 1 1 1 26 1 1 2 GLU HA H 5.258 -15.596 9.590 1.00 . A A . 6 GLU HA 1 1 1 27 1 1 2 GLU HB2 H 3.772 -17.837 10.386 1.00 . A A . 6 GLU HB2 1 1 1 28 1 1 2 GLU HB3 H 3.028 -17.327 8.871 1.00 . A A . 6 GLU HB3 1 1 1 29 1 1 2 GLU HG2 H 5.579 -17.100 8.120 1.00 . A A . 6 GLU HG2 1 1 1 30 1 1 2 GLU HG3 H 5.806 -18.305 9.388 1.00 . A A . 6 GLU HG3 1 1 1 31 1 1 2 GLU N N 3.976 -15.703 11.280 1.00 . A A . 6 GLU N 1 1 1 32 1 1 2 GLU O O 2.542 -14.124 9.620 1.00 . A A . 6 GLU O 1 1 1 33 1 1 2 GLU OE1 O 3.523 -19.506 8.027 1.00 . A A . 6 GLU OE1 1 1 1 34 1 1 2 GLU OE2 O 5.254 -19.240 6.773 1.00 . A A . 6 GLU OE2 1 1 1 35 1 1 3 ILE C C 1.342 -14.854 6.273 1.00 . A A . 7 ILE C 1 1 1 36 1 1 3 ILE CA C 2.461 -14.035 6.930 1.00 . A A . 7 ILE CA 1 1 1 37 1 1 3 ILE CB C 3.379 -13.431 5.867 1.00 . A A . 7 ILE CB 1 1 1 38 1 1 3 ILE CD1 C 3.754 -11.430 7.316 1.00 . A A . 7 ILE CD1 1 1 1 39 1 1 3 ILE CG1 C 4.439 -12.560 6.544 1.00 . A A . 7 ILE CG1 1 1 1 40 1 1 3 ILE CG2 C 2.554 -12.571 4.906 1.00 . A A . 7 ILE CG2 1 1 1 41 1 1 3 ILE H H 3.959 -15.542 7.291 1.00 . A A . 7 ILE H 1 1 1 42 1 1 3 ILE HA H 2.046 -13.253 7.546 1.00 . A A . 7 ILE HA 1 1 1 43 1 1 3 ILE HB H 3.861 -14.225 5.314 1.00 . A A . 7 ILE HB 1 1 1 44 1 1 3 ILE HD11 H 4.162 -10.481 7.001 1.00 . A A . 7 ILE HD11 1 1 1 45 1 1 3 ILE HD12 H 3.925 -11.562 8.374 1.00 . A A . 7 ILE HD12 1 1 1 46 1 1 3 ILE HD13 H 2.693 -11.451 7.117 1.00 . A A . 7 ILE HD13 1 1 1 47 1 1 3 ILE HG12 H 5.017 -13.164 7.229 1.00 . A A . 7 ILE HG12 1 1 1 48 1 1 3 ILE HG13 H 5.093 -12.139 5.795 1.00 . A A . 7 ILE HG13 1 1 1 49 1 1 3 ILE HG21 H 1.685 -13.126 4.583 1.00 . A A . 7 ILE HG21 1 1 1 50 1 1 3 ILE HG22 H 3.156 -12.313 4.046 1.00 . A A . 7 ILE HG22 1 1 1 51 1 1 3 ILE HG23 H 2.239 -11.669 5.409 1.00 . A A . 7 ILE HG23 1 1 1 52 1 1 3 ILE N N 3.343 -14.924 7.739 1.00 . A A . 7 ILE N 1 1 1 53 1 1 3 ILE O O 1.553 -15.987 5.888 1.00 . A A . 7 ILE O 1 1 1 54 1 1 4 PRO C C -0.772 -15.079 4.034 1.00 . A A . 8 PRO C 1 1 1 55 1 1 4 PRO CA C -0.974 -14.951 5.546 1.00 . A A . 8 PRO CA 1 1 1 56 1 1 4 PRO CB C -2.158 -14.041 5.862 1.00 . A A . 8 PRO CB 1 1 1 57 1 1 4 PRO CD C -0.169 -12.892 6.601 1.00 . A A . 8 PRO CD 1 1 1 58 1 1 4 PRO CG C -1.559 -12.684 6.057 1.00 . A A . 8 PRO CG 1 1 1 59 1 1 4 PRO HA H -1.122 -15.920 5.995 1.00 . A A . 8 PRO HA 1 1 1 60 1 1 4 PRO HB2 H -2.853 -14.028 5.035 1.00 . A A . 8 PRO HB2 1 1 1 61 1 1 4 PRO HB3 H -2.653 -14.367 6.765 1.00 . A A . 8 PRO HB3 1 1 1 62 1 1 4 PRO HD2 H 0.515 -12.172 6.178 1.00 . A A . 8 PRO HD2 1 1 1 63 1 1 4 PRO HD3 H -0.170 -12.828 7.678 1.00 . A A . 8 PRO HD3 1 1 1 64 1 1 4 PRO HG2 H -1.512 -12.162 5.113 1.00 . A A . 8 PRO HG2 1 1 1 65 1 1 4 PRO HG3 H -2.150 -12.119 6.763 1.00 . A A . 8 PRO HG3 1 1 1 66 1 1 4 PRO N N 0.180 -14.255 6.165 1.00 . A A . 8 PRO N 1 1 1 67 1 1 4 PRO O O 0.187 -14.577 3.482 1.00 . A A . 8 PRO O 1 1 1 68 1 1 5 ASP C C -2.850 -15.604 1.185 1.00 . A A . 9 ASP C 1 1 1 69 1 1 5 ASP CA C -1.523 -15.907 1.884 1.00 . A A . 9 ASP CA 1 1 1 70 1 1 5 ASP CB C -1.131 -17.371 1.681 1.00 . A A . 9 ASP CB 1 1 1 71 1 1 5 ASP CG C -0.358 -17.515 0.369 1.00 . A A . 9 ASP CG 1 1 1 72 1 1 5 ASP H H -2.433 -16.146 3.823 1.00 . A A . 9 ASP H 1 1 1 73 1 1 5 ASP HA H -0.743 -15.263 1.509 1.00 . A A . 9 ASP HA 1 1 1 74 1 1 5 ASP HB2 H -0.510 -17.695 2.503 1.00 . A A . 9 ASP HB2 1 1 1 75 1 1 5 ASP HB3 H -2.023 -17.980 1.641 1.00 . A A . 9 ASP HB3 1 1 1 76 1 1 5 ASP N N -1.667 -15.748 3.359 1.00 . A A . 9 ASP N 1 1 1 77 1 1 5 ASP O O -3.442 -16.460 0.556 1.00 . A A . 9 ASP O 1 1 1 78 1 1 5 ASP OD1 O -0.957 -17.318 -0.675 1.00 . A A . 9 ASP OD1 1 1 1 79 1 1 5 ASP OD2 O 0.822 -17.821 0.430 1.00 . A A . 9 ASP OD2 1 1 1 80 1 1 6 ASP C C -4.433 -12.789 -0.245 1.00 . A A . 10 ASP C 1 1 1 81 1 1 6 ASP CA C -4.612 -14.037 0.627 1.00 . A A . 10 ASP CA 1 1 1 82 1 1 6 ASP CB C -5.584 -13.762 1.774 1.00 . A A . 10 ASP CB 1 1 1 83 1 1 6 ASP CG C -6.591 -14.910 1.877 1.00 . A A . 10 ASP CG 1 1 1 84 1 1 6 ASP H H -2.831 -13.716 1.798 1.00 . A A . 10 ASP H 1 1 1 85 1 1 6 ASP HA H -4.969 -14.863 0.032 1.00 . A A . 10 ASP HA 1 1 1 86 1 1 6 ASP HB2 H -5.035 -13.680 2.700 1.00 . A A . 10 ASP HB2 1 1 1 87 1 1 6 ASP HB3 H -6.112 -12.838 1.586 1.00 . A A . 10 ASP HB3 1 1 1 88 1 1 6 ASP N N -3.323 -14.392 1.287 1.00 . A A . 10 ASP N 1 1 1 89 1 1 6 ASP O O -4.238 -12.879 -1.440 1.00 . A A . 10 ASP O 1 1 1 90 1 1 6 ASP OD1 O -6.263 -16.000 1.435 1.00 . A A . 10 ASP OD1 1 1 1 91 1 1 6 ASP OD2 O -7.671 -14.681 2.396 1.00 . A A . 10 ASP OD2 1 1 1 92 1 1 7 VAL C C -3.542 -9.337 0.349 1.00 . A A . 11 VAL C 1 1 1 93 1 1 7 VAL CA C -4.334 -10.377 -0.455 1.00 . A A . 11 VAL CA 1 1 1 94 1 1 7 VAL CB C -5.758 -9.885 -0.713 1.00 . A A . 11 VAL CB 1 1 1 95 1 1 7 VAL CG1 C -6.490 -9.717 0.621 1.00 . A A . 11 VAL CG1 1 1 1 96 1 1 7 VAL CG2 C -5.710 -8.540 -1.440 1.00 . A A . 11 VAL CG2 1 1 1 97 1 1 7 VAL H H -4.660 -11.568 1.307 1.00 . A A . 11 VAL H 1 1 1 98 1 1 7 VAL HA H -3.843 -10.592 -1.391 1.00 . A A . 11 VAL HA 1 1 1 99 1 1 7 VAL HB H -6.284 -10.605 -1.323 1.00 . A A . 11 VAL HB 1 1 1 100 1 1 7 VAL HG11 H -5.821 -9.964 1.432 1.00 . A A . 11 VAL HG11 1 1 1 101 1 1 7 VAL HG12 H -7.345 -10.376 0.648 1.00 . A A . 11 VAL HG12 1 1 1 102 1 1 7 VAL HG13 H -6.819 -8.694 0.726 1.00 . A A . 11 VAL HG13 1 1 1 103 1 1 7 VAL HG21 H -5.112 -7.845 -0.871 1.00 . A A . 11 VAL HG21 1 1 1 104 1 1 7 VAL HG22 H -6.712 -8.152 -1.547 1.00 . A A . 11 VAL HG22 1 1 1 105 1 1 7 VAL HG23 H -5.270 -8.676 -2.418 1.00 . A A . 11 VAL HG23 1 1 1 106 1 1 7 VAL N N -4.499 -11.625 0.343 1.00 . A A . 11 VAL N 1 1 1 107 1 1 7 VAL O O -3.725 -9.214 1.543 1.00 . A A . 11 VAL O 1 1 1 108 1 1 8 PRO C C -2.734 -6.368 0.705 1.00 . A A . 12 PRO C 1 1 1 109 1 1 8 PRO CA C -1.866 -7.578 0.347 1.00 . A A . 12 PRO CA 1 1 1 110 1 1 8 PRO CB C -0.818 -7.204 -0.696 1.00 . A A . 12 PRO CB 1 1 1 111 1 1 8 PRO CD C -2.392 -8.688 -1.772 1.00 . A A . 12 PRO CD 1 1 1 112 1 1 8 PRO CG C -1.442 -7.543 -2.013 1.00 . A A . 12 PRO CG 1 1 1 113 1 1 8 PRO HA H -1.389 -7.981 1.226 1.00 . A A . 12 PRO HA 1 1 1 114 1 1 8 PRO HB2 H -0.597 -6.148 -0.645 1.00 . A A . 12 PRO HB2 1 1 1 115 1 1 8 PRO HB3 H 0.082 -7.784 -0.547 1.00 . A A . 12 PRO HB3 1 1 1 116 1 1 8 PRO HD2 H -3.296 -8.557 -2.348 1.00 . A A . 12 PRO HD2 1 1 1 117 1 1 8 PRO HD3 H -1.920 -9.628 -2.014 1.00 . A A . 12 PRO HD3 1 1 1 118 1 1 8 PRO HG2 H -1.983 -6.690 -2.394 1.00 . A A . 12 PRO HG2 1 1 1 119 1 1 8 PRO HG3 H -0.679 -7.839 -2.717 1.00 . A A . 12 PRO HG3 1 1 1 120 1 1 8 PRO N N -2.682 -8.614 -0.332 1.00 . A A . 12 PRO N 1 1 1 121 1 1 8 PRO O O -2.759 -5.922 1.836 1.00 . A A . 12 PRO O 1 1 1 122 1 1 9 LEU C C -5.764 -4.960 -0.361 1.00 . A A . 13 LEU C 1 1 1 123 1 1 9 LEU CA C -4.312 -4.653 0.034 1.00 . A A . 13 LEU CA 1 1 1 124 1 1 9 LEU CB C -3.740 -3.528 -0.828 1.00 . A A . 13 LEU CB 1 1 1 125 1 1 9 LEU CD1 C -1.339 -3.950 -1.389 1.00 . A A . 13 LEU CD1 1 1 1 126 1 1 9 LEU CD2 C -2.027 -1.749 -0.432 1.00 . A A . 13 LEU CD2 1 1 1 127 1 1 9 LEU CG C -2.291 -3.255 -0.414 1.00 . A A . 13 LEU CG 1 1 1 128 1 1 9 LEU H H -3.411 -6.209 -1.154 1.00 . A A . 13 LEU H 1 1 1 129 1 1 9 LEU HA H -4.253 -4.385 1.078 1.00 . A A . 13 LEU HA 1 1 1 130 1 1 9 LEU HB2 H -3.767 -3.821 -1.867 1.00 . A A . 13 LEU HB2 1 1 1 131 1 1 9 LEU HB3 H -4.329 -2.633 -0.691 1.00 . A A . 13 LEU HB3 1 1 1 132 1 1 9 LEU HD11 H -0.427 -4.215 -0.876 1.00 . A A . 13 LEU HD11 1 1 1 133 1 1 9 LEU HD12 H -1.110 -3.283 -2.207 1.00 . A A . 13 LEU HD12 1 1 1 134 1 1 9 LEU HD13 H -1.807 -4.844 -1.775 1.00 . A A . 13 LEU HD13 1 1 1 135 1 1 9 LEU HD21 H -2.677 -1.260 0.278 1.00 . A A . 13 LEU HD21 1 1 1 136 1 1 9 LEU HD22 H -2.220 -1.362 -1.422 1.00 . A A . 13 LEU HD22 1 1 1 137 1 1 9 LEU HD23 H -0.997 -1.560 -0.167 1.00 . A A . 13 LEU HD23 1 1 1 138 1 1 9 LEU HG H -2.125 -3.637 0.584 1.00 . A A . 13 LEU HG 1 1 1 139 1 1 9 LEU N N -3.445 -5.834 -0.250 1.00 . A A . 13 LEU N 1 1 1 140 1 1 9 LEU O O -6.004 -5.716 -1.281 1.00 . A A . 13 LEU O 1 1 1 141 1 1 10 PRO C C -8.543 -3.898 -1.234 1.00 . A A . 14 PRO C 1 1 1 142 1 1 10 PRO CA C -8.130 -4.595 0.066 1.00 . A A . 14 PRO CA 1 1 1 143 1 1 10 PRO CB C -8.840 -3.978 1.267 1.00 . A A . 14 PRO CB 1 1 1 144 1 1 10 PRO CD C -6.496 -3.441 1.481 1.00 . A A . 14 PRO CD 1 1 1 145 1 1 10 PRO CG C -7.887 -2.955 1.798 1.00 . A A . 14 PRO CG 1 1 1 146 1 1 10 PRO HA H -8.343 -5.650 0.016 1.00 . A A . 14 PRO HA 1 1 1 147 1 1 10 PRO HB2 H -9.761 -3.507 0.957 1.00 . A A . 14 PRO HB2 1 1 1 148 1 1 10 PRO HB3 H -9.037 -4.731 2.015 1.00 . A A . 14 PRO HB3 1 1 1 149 1 1 10 PRO HD2 H -5.865 -2.615 1.187 1.00 . A A . 14 PRO HD2 1 1 1 150 1 1 10 PRO HD3 H -6.072 -3.960 2.328 1.00 . A A . 14 PRO HD3 1 1 1 151 1 1 10 PRO HG2 H -8.064 -2.004 1.321 1.00 . A A . 14 PRO HG2 1 1 1 152 1 1 10 PRO HG3 H -8.008 -2.859 2.867 1.00 . A A . 14 PRO HG3 1 1 1 153 1 1 10 PRO N N -6.691 -4.367 0.355 1.00 . A A . 14 PRO N 1 1 1 154 1 1 10 PRO O O -7.714 -3.528 -2.042 1.00 . A A . 14 PRO O 1 1 1 155 1 1 11 ALA C C -10.012 -1.550 -2.629 1.00 . A A . 15 ALA C 1 1 1 156 1 1 11 ALA CA C -10.289 -3.055 -2.692 1.00 . A A . 15 ALA CA 1 1 1 157 1 1 11 ALA CB C -11.794 -3.322 -2.741 1.00 . A A . 15 ALA CB 1 1 1 158 1 1 11 ALA H H -10.472 -4.033 -0.780 1.00 . A A . 15 ALA H 1 1 1 159 1 1 11 ALA HA H -9.811 -3.491 -3.555 1.00 . A A . 15 ALA HA 1 1 1 160 1 1 11 ALA HB1 H -11.968 -4.358 -2.990 1.00 . A A . 15 ALA HB1 1 1 1 161 1 1 11 ALA HB2 H -12.247 -2.691 -3.491 1.00 . A A . 15 ALA HB2 1 1 1 162 1 1 11 ALA HB3 H -12.229 -3.105 -1.777 1.00 . A A . 15 ALA HB3 1 1 1 163 1 1 11 ALA N N -9.820 -3.722 -1.442 1.00 . A A . 15 ALA N 1 1 1 164 1 1 11 ALA O O -9.707 -1.008 -1.587 1.00 . A A . 15 ALA O 1 1 1 165 1 1 12 GLY C C -8.374 0.863 -3.482 1.00 . A A . 16 GLY C 1 1 1 166 1 1 12 GLY CA C -9.860 0.595 -3.747 1.00 . A A . 16 GLY CA 1 1 1 167 1 1 12 GLY H H -10.367 -1.330 -4.571 1.00 . A A . 16 GLY H 1 1 1 168 1 1 12 GLY HA2 H -10.132 1.003 -4.711 1.00 . A A . 16 GLY HA2 1 1 1 169 1 1 12 GLY HA3 H -10.453 1.067 -2.978 1.00 . A A . 16 GLY HA3 1 1 1 170 1 1 12 GLY N N -10.119 -0.873 -3.741 1.00 . A A . 16 GLY N 1 1 1 171 1 1 12 GLY O O -7.982 1.969 -3.171 1.00 . A A . 16 GLY O 1 1 1 172 1 1 13 TRP C C -5.282 -0.190 -4.621 1.00 . A A . 17 TRP C 1 1 1 173 1 1 13 TRP CA C -6.088 0.065 -3.345 1.00 . A A . 17 TRP CA 1 1 1 174 1 1 13 TRP CB C -5.734 -0.966 -2.280 1.00 . A A . 17 TRP CB 1 1 1 175 1 1 13 TRP CD1 C -6.963 -0.411 -0.149 1.00 . A A . 17 TRP CD1 1 1 1 176 1 1 13 TRP CD2 C -4.889 0.450 -0.210 1.00 . A A . 17 TRP CD2 1 1 1 177 1 1 13 TRP CE2 C -5.449 0.837 1.028 1.00 . A A . 17 TRP CE2 1 1 1 178 1 1 13 TRP CE3 C -3.581 0.862 -0.507 1.00 . A A . 17 TRP CE3 1 1 1 179 1 1 13 TRP CG C -5.866 -0.342 -0.935 1.00 . A A . 17 TRP CG 1 1 1 180 1 1 13 TRP CH2 C -3.428 2.011 1.627 1.00 . A A . 17 TRP CH2 1 1 1 181 1 1 13 TRP CZ2 C -4.730 1.610 1.942 1.00 . A A . 17 TRP CZ2 1 1 1 182 1 1 13 TRP CZ3 C -2.857 1.638 0.407 1.00 . A A . 17 TRP CZ3 1 1 1 183 1 1 13 TRP H H -7.873 -1.027 -3.843 1.00 . A A . 17 TRP H 1 1 1 184 1 1 13 TRP HA H -5.903 1.060 -2.972 1.00 . A A . 17 TRP HA 1 1 1 185 1 1 13 TRP HB2 H -6.405 -1.808 -2.355 1.00 . A A . 17 TRP HB2 1 1 1 186 1 1 13 TRP HB3 H -4.717 -1.301 -2.425 1.00 . A A . 17 TRP HB3 1 1 1 187 1 1 13 TRP HD1 H -7.879 -0.928 -0.396 1.00 . A A . 17 TRP HD1 1 1 1 188 1 1 13 TRP HE1 H -7.354 0.395 1.759 1.00 . A A . 17 TRP HE1 1 1 1 189 1 1 13 TRP HE3 H -3.129 0.580 -1.447 1.00 . A A . 17 TRP HE3 1 1 1 190 1 1 13 TRP HH2 H -2.859 2.608 2.323 1.00 . A A . 17 TRP HH2 1 1 1 191 1 1 13 TRP HZ2 H -5.176 1.895 2.884 1.00 . A A . 17 TRP HZ2 1 1 1 192 1 1 13 TRP HZ3 H -1.857 1.951 0.169 1.00 . A A . 17 TRP HZ3 1 1 1 193 1 1 13 TRP N N -7.543 -0.140 -3.597 1.00 . A A . 17 TRP N 1 1 1 194 1 1 13 TRP NE1 N -6.719 0.289 1.020 1.00 . A A . 17 TRP NE1 1 1 1 195 1 1 13 TRP O O -5.582 -1.087 -5.383 1.00 . A A . 17 TRP O 1 1 1 196 1 1 14 GLU C C -1.955 0.471 -5.803 1.00 . A A . 18 GLU C 1 1 1 197 1 1 14 GLU CA C -3.452 0.374 -6.096 1.00 . A A . 18 GLU CA 1 1 1 198 1 1 14 GLU CB C -3.857 1.502 -7.046 1.00 . A A . 18 GLU CB 1 1 1 199 1 1 14 GLU CD C -5.906 0.442 -8.008 1.00 . A A . 18 GLU CD 1 1 1 200 1 1 14 GLU CG C -4.481 0.910 -8.310 1.00 . A A . 18 GLU CG 1 1 1 201 1 1 14 GLU H H -4.033 1.314 -4.239 1.00 . A A . 18 GLU H 1 1 1 202 1 1 14 GLU HA H -3.688 -0.580 -6.541 1.00 . A A . 18 GLU HA 1 1 1 203 1 1 14 GLU HB2 H -4.569 2.146 -6.558 1.00 . A A . 18 GLU HB2 1 1 1 204 1 1 14 GLU HB3 H -2.983 2.076 -7.315 1.00 . A A . 18 GLU HB3 1 1 1 205 1 1 14 GLU HG2 H -4.503 1.662 -9.085 1.00 . A A . 18 GLU HG2 1 1 1 206 1 1 14 GLU HG3 H -3.888 0.070 -8.642 1.00 . A A . 18 GLU HG3 1 1 1 207 1 1 14 GLU N N -4.262 0.589 -4.863 1.00 . A A . 18 GLU N 1 1 1 208 1 1 14 GLU O O -1.397 1.554 -5.781 1.00 . A A . 18 GLU O 1 1 1 209 1 1 14 GLU OE1 O -6.774 1.292 -7.890 1.00 . A A . 18 GLU OE1 1 1 1 210 1 1 14 GLU OE2 O -6.104 -0.756 -7.900 1.00 . A A . 18 GLU OE2 1 1 1 211 1 1 15 MET C C 0.824 0.071 -6.599 1.00 . A A . 19 MET C 1 1 1 212 1 1 15 MET CA C 0.179 -0.547 -5.368 1.00 . A A . 19 MET CA 1 1 1 213 1 1 15 MET CB C 0.695 -1.968 -5.164 1.00 . A A . 19 MET CB 1 1 1 214 1 1 15 MET CE C -1.470 -4.110 -4.672 1.00 . A A . 19 MET CE 1 1 1 215 1 1 15 MET CG C 0.283 -2.862 -6.339 1.00 . A A . 19 MET CG 1 1 1 216 1 1 15 MET H H -1.723 -1.506 -5.647 1.00 . A A . 19 MET H 1 1 1 217 1 1 15 MET HA H 0.382 0.052 -4.497 1.00 . A A . 19 MET HA 1 1 1 218 1 1 15 MET HB2 H 1.766 -1.928 -5.113 1.00 . A A . 19 MET HB2 1 1 1 219 1 1 15 MET HB3 H 0.311 -2.369 -4.238 1.00 . A A . 19 MET HB3 1 1 1 220 1 1 15 MET HE1 H -2.390 -4.403 -5.157 1.00 . A A . 19 MET HE1 1 1 1 221 1 1 15 MET HE2 H -1.483 -3.048 -4.494 1.00 . A A . 19 MET HE2 1 1 1 222 1 1 15 MET HE3 H -1.373 -4.629 -3.728 1.00 . A A . 19 MET HE3 1 1 1 223 1 1 15 MET HG2 H -0.595 -2.458 -6.816 1.00 . A A . 19 MET HG2 1 1 1 224 1 1 15 MET HG3 H 1.090 -2.904 -7.054 1.00 . A A . 19 MET HG3 1 1 1 225 1 1 15 MET N N -1.282 -0.637 -5.610 1.00 . A A . 19 MET N 1 1 1 226 1 1 15 MET O O 0.735 -0.448 -7.694 1.00 . A A . 19 MET O 1 1 1 227 1 1 15 MET SD S -0.068 -4.532 -5.735 1.00 . A A . 19 MET SD 1 1 1 228 1 1 16 ALA C C 3.501 2.306 -7.199 1.00 . A A . 20 ALA C 1 1 1 229 1 1 16 ALA CA C 2.096 1.856 -7.590 1.00 . A A . 20 ALA CA 1 1 1 230 1 1 16 ALA CB C 1.185 3.049 -7.891 1.00 . A A . 20 ALA CB 1 1 1 231 1 1 16 ALA H H 1.508 1.581 -5.540 1.00 . A A . 20 ALA H 1 1 1 232 1 1 16 ALA HA H 2.133 1.192 -8.439 1.00 . A A . 20 ALA HA 1 1 1 233 1 1 16 ALA HB1 H 1.781 3.886 -8.218 1.00 . A A . 20 ALA HB1 1 1 1 234 1 1 16 ALA HB2 H 0.639 3.319 -6.999 1.00 . A A . 20 ALA HB2 1 1 1 235 1 1 16 ALA HB3 H 0.486 2.777 -8.670 1.00 . A A . 20 ALA HB3 1 1 1 236 1 1 16 ALA N N 1.457 1.183 -6.431 1.00 . A A . 20 ALA N 1 1 1 237 1 1 16 ALA O O 4.047 1.851 -6.212 1.00 . A A . 20 ALA O 1 1 1 238 1 1 17 LYS C C 5.553 5.136 -7.454 1.00 . A A . 21 LYS C 1 1 1 239 1 1 17 LYS CA C 5.477 3.620 -7.592 1.00 . A A . 21 LYS CA 1 1 1 240 1 1 17 LYS CB C 6.373 3.130 -8.729 1.00 . A A . 21 LYS CB 1 1 1 241 1 1 17 LYS CD C 6.843 3.305 -11.177 1.00 . A A . 21 LYS CD 1 1 1 242 1 1 17 LYS CE C 7.563 4.505 -11.795 1.00 . A A . 21 LYS CE 1 1 1 243 1 1 17 LYS CG C 5.934 3.783 -10.043 1.00 . A A . 21 LYS CG 1 1 1 244 1 1 17 LYS H H 3.659 3.538 -8.753 1.00 . A A . 21 LYS H 1 1 1 245 1 1 17 LYS HA H 5.768 3.158 -6.667 1.00 . A A . 21 LYS HA 1 1 1 246 1 1 17 LYS HB2 H 7.398 3.397 -8.519 1.00 . A A . 21 LYS HB2 1 1 1 247 1 1 17 LYS HB3 H 6.290 2.057 -8.816 1.00 . A A . 21 LYS HB3 1 1 1 248 1 1 17 LYS HD2 H 7.571 2.609 -10.787 1.00 . A A . 21 LYS HD2 1 1 1 249 1 1 17 LYS HD3 H 6.246 2.815 -11.933 1.00 . A A . 21 LYS HD3 1 1 1 250 1 1 17 LYS HE2 H 7.736 4.338 -12.847 1.00 . A A . 21 LYS HE2 1 1 1 251 1 1 17 LYS HE3 H 6.987 5.406 -11.644 1.00 . A A . 21 LYS HE3 1 1 1 252 1 1 17 LYS HG2 H 4.913 3.507 -10.258 1.00 . A A . 21 LYS HG2 1 1 1 253 1 1 17 LYS HG3 H 6.006 4.856 -9.951 1.00 . A A . 21 LYS HG3 1 1 1 254 1 1 17 LYS HZ1 H 9.506 5.221 -11.574 1.00 . A A . 21 LYS HZ1 1 1 1 255 1 1 17 LYS HZ2 H 9.280 3.641 -10.992 1.00 . A A . 21 LYS HZ2 1 1 1 256 1 1 17 LYS HZ3 H 8.693 4.967 -10.108 1.00 . A A . 21 LYS HZ3 1 1 1 257 1 1 17 LYS N N 4.102 3.181 -7.955 1.00 . A A . 21 LYS N 1 1 1 258 1 1 17 LYS NZ N 8.859 4.590 -11.062 1.00 . A A . 21 LYS NZ 1 1 1 259 1 1 17 LYS O O 5.003 5.878 -8.244 1.00 . A A . 21 LYS O 1 1 1 260 1 1 18 THR C C 7.792 7.442 -5.904 1.00 . A A . 22 THR C 1 1 1 261 1 1 18 THR CA C 6.347 7.065 -6.226 1.00 . A A . 22 THR CA 1 1 1 262 1 1 18 THR CB C 5.441 7.360 -5.030 1.00 . A A . 22 THR CB 1 1 1 263 1 1 18 THR CG2 C 5.966 6.626 -3.791 1.00 . A A . 22 THR CG2 1 1 1 264 1 1 18 THR H H 6.663 4.972 -5.813 1.00 . A A . 22 THR H 1 1 1 265 1 1 18 THR HA H 6.000 7.602 -7.093 1.00 . A A . 22 THR HA 1 1 1 266 1 1 18 THR HB H 4.437 7.026 -5.245 1.00 . A A . 22 THR HB 1 1 1 267 1 1 18 THR HG1 H 5.132 9.199 -5.584 1.00 . A A . 22 THR HG1 1 1 1 268 1 1 18 THR HG21 H 6.160 5.591 -4.034 1.00 . A A . 22 THR HG21 1 1 1 269 1 1 18 THR HG22 H 5.234 6.678 -2.997 1.00 . A A . 22 THR HG22 1 1 1 270 1 1 18 THR HG23 H 6.880 7.096 -3.467 1.00 . A A . 22 THR HG23 1 1 1 271 1 1 18 THR N N 6.231 5.597 -6.439 1.00 . A A . 22 THR N 1 1 1 272 1 1 18 THR O O 8.717 6.713 -6.196 1.00 . A A . 22 THR O 1 1 1 273 1 1 18 THR OG1 O 5.431 8.760 -4.784 1.00 . A A . 22 THR OG1 1 1 1 274 1 1 19 SER C C 10.320 8.876 -6.118 1.00 . A A . 23 SER C 1 1 1 275 1 1 19 SER CA C 9.358 9.031 -4.928 1.00 . A A . 23 SER CA 1 1 1 276 1 1 19 SER CB C 9.773 8.134 -3.759 1.00 . A A . 23 SER CB 1 1 1 277 1 1 19 SER H H 7.207 9.137 -5.065 1.00 . A A . 23 SER H 1 1 1 278 1 1 19 SER HA H 9.336 10.060 -4.603 1.00 . A A . 23 SER HA 1 1 1 279 1 1 19 SER HB2 H 9.415 8.559 -2.834 1.00 . A A . 23 SER HB2 1 1 1 280 1 1 19 SER HB3 H 9.347 7.150 -3.892 1.00 . A A . 23 SER HB3 1 1 1 281 1 1 19 SER HG H 11.418 7.286 -3.163 1.00 . A A . 23 SER HG 1 1 1 282 1 1 19 SER N N 7.980 8.578 -5.292 1.00 . A A . 23 SER N 1 1 1 283 1 1 19 SER O O 10.451 9.766 -6.934 1.00 . A A . 23 SER O 1 1 1 284 1 1 19 SER OG O 11.189 8.034 -3.719 1.00 . A A . 23 SER OG 1 1 1 285 1 1 20 SER C C 12.034 6.090 -7.744 1.00 . A A . 24 SER C 1 1 1 286 1 1 20 SER CA C 11.936 7.570 -7.373 1.00 . A A . 24 SER CA 1 1 1 287 1 1 20 SER CB C 13.282 8.089 -6.867 1.00 . A A . 24 SER CB 1 1 1 288 1 1 20 SER H H 10.881 7.044 -5.572 1.00 . A A . 24 SER H 1 1 1 289 1 1 20 SER HA H 11.615 8.144 -8.219 1.00 . A A . 24 SER HA 1 1 1 290 1 1 20 SER HB2 H 13.193 8.364 -5.826 1.00 . A A . 24 SER HB2 1 1 1 291 1 1 20 SER HB3 H 14.028 7.315 -6.972 1.00 . A A . 24 SER HB3 1 1 1 292 1 1 20 SER HG H 13.734 8.957 -8.547 1.00 . A A . 24 SER HG 1 1 1 293 1 1 20 SER N N 10.994 7.758 -6.231 1.00 . A A . 24 SER N 1 1 1 294 1 1 20 SER O O 12.046 5.728 -8.904 1.00 . A A . 24 SER O 1 1 1 295 1 1 20 SER OG O 13.667 9.224 -7.627 1.00 . A A . 24 SER OG 1 1 1 296 1 1 21 GLY C C 11.601 2.987 -5.887 1.00 . A A . 25 GLY C 1 1 1 297 1 1 21 GLY CA C 12.201 3.778 -7.052 1.00 . A A . 25 GLY CA 1 1 1 298 1 1 21 GLY H H 12.092 5.559 -5.845 1.00 . A A . 25 GLY H 1 1 1 299 1 1 21 GLY HA2 H 11.659 3.551 -7.958 1.00 . A A . 25 GLY HA2 1 1 1 300 1 1 21 GLY HA3 H 13.239 3.504 -7.175 1.00 . A A . 25 GLY HA3 1 1 1 301 1 1 21 GLY N N 12.104 5.238 -6.767 1.00 . A A . 25 GLY N 1 1 1 302 1 1 21 GLY O O 12.133 1.978 -5.471 1.00 . A A . 25 GLY O 1 1 1 303 1 1 22 GLN C C 8.381 2.452 -4.518 1.00 . A A . 26 GLN C 1 1 1 304 1 1 22 GLN CA C 9.862 2.708 -4.221 1.00 . A A . 26 GLN CA 1 1 1 305 1 1 22 GLN CB C 10.013 3.641 -3.019 1.00 . A A . 26 GLN CB 1 1 1 306 1 1 22 GLN CD C 12.478 3.635 -2.608 1.00 . A A . 26 GLN CD 1 1 1 307 1 1 22 GLN CG C 11.127 3.122 -2.107 1.00 . A A . 26 GLN CG 1 1 1 308 1 1 22 GLN H H 10.081 4.253 -5.709 1.00 . A A . 26 GLN H 1 1 1 309 1 1 22 GLN HA H 10.377 1.779 -4.034 1.00 . A A . 26 GLN HA 1 1 1 310 1 1 22 GLN HB2 H 10.263 4.634 -3.364 1.00 . A A . 26 GLN HB2 1 1 1 311 1 1 22 GLN HB3 H 9.084 3.674 -2.470 1.00 . A A . 26 GLN HB3 1 1 1 312 1 1 22 GLN HE21 H 12.530 5.160 -1.338 1.00 . A A . 26 GLN HE21 1 1 1 313 1 1 22 GLN HE22 H 13.868 5.034 -2.376 1.00 . A A . 26 GLN HE22 1 1 1 314 1 1 22 GLN HG2 H 10.959 3.474 -1.100 1.00 . A A . 26 GLN HG2 1 1 1 315 1 1 22 GLN HG3 H 11.124 2.042 -2.116 1.00 . A A . 26 GLN HG3 1 1 1 316 1 1 22 GLN N N 10.495 3.436 -5.358 1.00 . A A . 26 GLN N 1 1 1 317 1 1 22 GLN NE2 N 13.002 4.698 -2.062 1.00 . A A . 26 GLN NE2 1 1 1 318 1 1 22 GLN O O 7.678 3.318 -5.009 1.00 . A A . 26 GLN O 1 1 1 319 1 1 22 GLN OE1 O 13.063 3.063 -3.506 1.00 . A A . 26 GLN OE1 1 1 1 320 1 1 23 ARG C C 5.588 1.494 -3.375 1.00 . A A . 27 ARG C 1 1 1 321 1 1 23 ARG CA C 6.465 0.976 -4.499 1.00 . A A . 27 ARG CA 1 1 1 322 1 1 23 ARG CB C 6.335 -0.546 -4.577 1.00 . A A . 27 ARG CB 1 1 1 323 1 1 23 ARG CD C 7.445 -1.090 -6.747 1.00 . A A . 27 ARG CD 1 1 1 324 1 1 23 ARG CG C 6.100 -0.945 -6.032 1.00 . A A . 27 ARG CG 1 1 1 325 1 1 23 ARG CZ C 6.888 -3.091 -8.032 1.00 . A A . 27 ARG CZ 1 1 1 326 1 1 23 ARG H H 8.478 0.584 -3.833 1.00 . A A . 27 ARG H 1 1 1 327 1 1 23 ARG HA H 6.166 1.415 -5.438 1.00 . A A . 27 ARG HA 1 1 1 328 1 1 23 ARG HB2 H 7.231 -1.013 -4.206 1.00 . A A . 27 ARG HB2 1 1 1 329 1 1 23 ARG HB3 H 5.491 -0.865 -3.977 1.00 . A A . 27 ARG HB3 1 1 1 330 1 1 23 ARG HD2 H 7.447 -0.517 -7.662 1.00 . A A . 27 ARG HD2 1 1 1 331 1 1 23 ARG HD3 H 8.250 -0.771 -6.102 1.00 . A A . 27 ARG HD3 1 1 1 332 1 1 23 ARG HE H 8.155 -3.106 -6.500 1.00 . A A . 27 ARG HE 1 1 1 333 1 1 23 ARG HG2 H 5.568 -1.884 -6.068 1.00 . A A . 27 ARG HG2 1 1 1 334 1 1 23 ARG HG3 H 5.513 -0.176 -6.518 1.00 . A A . 27 ARG HG3 1 1 1 335 1 1 23 ARG HH11 H 5.983 -1.392 -8.612 1.00 . A A . 27 ARG HH11 1 1 1 336 1 1 23 ARG HH12 H 5.582 -2.804 -9.527 1.00 . A A . 27 ARG HH12 1 1 1 337 1 1 23 ARG HH21 H 7.619 -4.925 -7.702 1.00 . A A . 27 ARG HH21 1 1 1 338 1 1 23 ARG HH22 H 6.500 -4.789 -9.018 1.00 . A A . 27 ARG HH22 1 1 1 339 1 1 23 ARG N N 7.900 1.271 -4.227 1.00 . A A . 27 ARG N 1 1 1 340 1 1 23 ARG NE N 7.564 -2.548 -7.046 1.00 . A A . 27 ARG NE 1 1 1 341 1 1 23 ARG NH1 N 6.089 -2.371 -8.782 1.00 . A A . 27 ARG NH1 1 1 1 342 1 1 23 ARG NH2 N 7.012 -4.368 -8.269 1.00 . A A . 27 ARG NH2 1 1 1 343 1 1 23 ARG O O 5.723 1.100 -2.234 1.00 . A A . 27 ARG O 1 1 1 344 1 1 24 TYR C C 2.380 2.217 -2.884 1.00 . A A . 28 TYR C 1 1 1 345 1 1 24 TYR CA C 3.740 2.840 -2.649 1.00 . A A . 28 TYR CA 1 1 1 346 1 1 24 TYR CB C 3.702 4.374 -2.790 1.00 . A A . 28 TYR CB 1 1 1 347 1 1 24 TYR CD1 C 3.447 4.815 -5.254 1.00 . A A . 28 TYR CD1 1 1 1 348 1 1 24 TYR CD2 C 1.514 5.117 -3.828 1.00 . A A . 28 TYR CD2 1 1 1 349 1 1 24 TYR CE1 C 2.684 5.181 -6.365 1.00 . A A . 28 TYR CE1 1 1 1 350 1 1 24 TYR CE2 C 0.753 5.482 -4.943 1.00 . A A . 28 TYR CE2 1 1 1 351 1 1 24 TYR CG C 2.868 4.782 -3.987 1.00 . A A . 28 TYR CG 1 1 1 352 1 1 24 TYR CZ C 1.344 5.513 -6.212 1.00 . A A . 28 TYR CZ 1 1 1 353 1 1 24 TYR H H 4.549 2.613 -4.631 1.00 . A A . 28 TYR H 1 1 1 354 1 1 24 TYR HA H 4.099 2.562 -1.670 1.00 . A A . 28 TYR HA 1 1 1 355 1 1 24 TYR HB2 H 3.274 4.803 -1.896 1.00 . A A . 28 TYR HB2 1 1 1 356 1 1 24 TYR HB3 H 4.707 4.744 -2.914 1.00 . A A . 28 TYR HB3 1 1 1 357 1 1 24 TYR HD1 H 4.483 4.559 -5.373 1.00 . A A . 28 TYR HD1 1 1 1 358 1 1 24 TYR HD2 H 1.057 5.096 -2.848 1.00 . A A . 28 TYR HD2 1 1 1 359 1 1 24 TYR HE1 H 3.129 5.205 -7.345 1.00 . A A . 28 TYR HE1 1 1 1 360 1 1 24 TYR HE2 H -0.287 5.735 -4.824 1.00 . A A . 28 TYR HE2 1 1 1 361 1 1 24 TYR HH H 0.874 6.760 -7.573 1.00 . A A . 28 TYR HH 1 1 1 362 1 1 24 TYR N N 4.660 2.339 -3.696 1.00 . A A . 28 TYR N 1 1 1 363 1 1 24 TYR O O 2.196 1.431 -3.795 1.00 . A A . 28 TYR O 1 1 1 364 1 1 24 TYR OH O 0.610 5.873 -7.317 1.00 . A A . 28 TYR OH 1 1 1 365 1 1 25 PHE C C -0.932 3.067 -2.322 1.00 . A A . 29 PHE C 1 1 1 366 1 1 25 PHE CA C 0.099 1.958 -2.257 1.00 . A A . 29 PHE CA 1 1 1 367 1 1 25 PHE CB C -0.045 1.008 -1.074 1.00 . A A . 29 PHE CB 1 1 1 368 1 1 25 PHE CD1 C 2.325 0.118 -0.894 1.00 . A A . 29 PHE CD1 1 1 1 369 1 1 25 PHE CD2 C 0.628 -1.246 -1.956 1.00 . A A . 29 PHE CD2 1 1 1 370 1 1 25 PHE CE1 C 3.281 -0.874 -1.158 1.00 . A A . 29 PHE CE1 1 1 1 371 1 1 25 PHE CE2 C 1.585 -2.230 -2.224 1.00 . A A . 29 PHE CE2 1 1 1 372 1 1 25 PHE CG C 0.992 -0.074 -1.292 1.00 . A A . 29 PHE CG 1 1 1 373 1 1 25 PHE CZ C 2.909 -2.046 -1.826 1.00 . A A . 29 PHE CZ 1 1 1 374 1 1 25 PHE H H 1.606 3.176 -1.345 1.00 . A A . 29 PHE H 1 1 1 375 1 1 25 PHE HA H 0.076 1.394 -3.173 1.00 . A A . 29 PHE HA 1 1 1 376 1 1 25 PHE HB2 H 0.137 1.531 -0.145 1.00 . A A . 29 PHE HB2 1 1 1 377 1 1 25 PHE HB3 H -1.035 0.576 -1.068 1.00 . A A . 29 PHE HB3 1 1 1 378 1 1 25 PHE HD1 H 2.618 1.027 -0.380 1.00 . A A . 29 PHE HD1 1 1 1 379 1 1 25 PHE HD2 H -0.392 -1.390 -2.263 1.00 . A A . 29 PHE HD2 1 1 1 380 1 1 25 PHE HE1 H 4.307 -0.729 -0.859 1.00 . A A . 29 PHE HE1 1 1 1 381 1 1 25 PHE HE2 H 1.297 -3.134 -2.746 1.00 . A A . 29 PHE HE2 1 1 1 382 1 1 25 PHE HZ H 3.646 -2.805 -2.041 1.00 . A A . 29 PHE HZ 1 1 1 383 1 1 25 PHE N N 1.435 2.546 -2.075 1.00 . A A . 29 PHE N 1 1 1 384 1 1 25 PHE O O -1.342 3.640 -1.328 1.00 . A A . 29 PHE O 1 1 1 385 1 1 26 LEU C C -3.642 4.094 -3.181 1.00 . A A . 30 LEU C 1 1 1 386 1 1 26 LEU CA C -2.284 4.472 -3.777 1.00 . A A . 30 LEU CA 1 1 1 387 1 1 26 LEU CB C -2.330 4.567 -5.318 1.00 . A A . 30 LEU CB 1 1 1 388 1 1 26 LEU CD1 C -2.460 7.107 -4.867 1.00 . A A . 30 LEU CD1 1 1 1 389 1 1 26 LEU CD2 C -1.977 6.241 -7.142 1.00 . A A . 30 LEU CD2 1 1 1 390 1 1 26 LEU CG C -2.737 5.964 -5.852 1.00 . A A . 30 LEU CG 1 1 1 391 1 1 26 LEU H H -0.920 2.902 -4.293 1.00 . A A . 30 LEU H 1 1 1 392 1 1 26 LEU HA H -1.925 5.388 -3.350 1.00 . A A . 30 LEU HA 1 1 1 393 1 1 26 LEU HB2 H -1.351 4.325 -5.705 1.00 . A A . 30 LEU HB2 1 1 1 394 1 1 26 LEU HB3 H -3.036 3.838 -5.687 1.00 . A A . 30 LEU HB3 1 1 1 395 1 1 26 LEU HD11 H -2.954 6.905 -3.929 1.00 . A A . 30 LEU HD11 1 1 1 396 1 1 26 LEU HD12 H -2.834 8.031 -5.279 1.00 . A A . 30 LEU HD12 1 1 1 397 1 1 26 LEU HD13 H -1.402 7.196 -4.707 1.00 . A A . 30 LEU HD13 1 1 1 398 1 1 26 LEU HD21 H -2.664 6.590 -7.898 1.00 . A A . 30 LEU HD21 1 1 1 399 1 1 26 LEU HD22 H -1.499 5.333 -7.480 1.00 . A A . 30 LEU HD22 1 1 1 400 1 1 26 LEU HD23 H -1.226 6.997 -6.961 1.00 . A A . 30 LEU HD23 1 1 1 401 1 1 26 LEU HG H -3.771 5.948 -6.074 1.00 . A A . 30 LEU HG 1 1 1 402 1 1 26 LEU N N -1.309 3.384 -3.530 1.00 . A A . 30 LEU N 1 1 1 403 1 1 26 LEU O O -4.383 3.298 -3.729 1.00 . A A . 30 LEU O 1 1 1 404 1 1 27 ASN C C -6.387 5.112 -2.062 1.00 . A A . 31 ASN C 1 1 1 405 1 1 27 ASN CA C -5.244 4.362 -1.370 1.00 . A A . 31 ASN CA 1 1 1 406 1 1 27 ASN CB C -5.033 4.872 0.062 1.00 . A A . 31 ASN CB 1 1 1 407 1 1 27 ASN CG C -6.352 4.885 0.833 1.00 . A A . 31 ASN CG 1 1 1 408 1 1 27 ASN H H -3.325 5.287 -1.635 1.00 . A A . 31 ASN H 1 1 1 409 1 1 27 ASN HA H -5.434 3.300 -1.362 1.00 . A A . 31 ASN HA 1 1 1 410 1 1 27 ASN HB2 H -4.338 4.224 0.574 1.00 . A A . 31 ASN HB2 1 1 1 411 1 1 27 ASN HB3 H -4.630 5.874 0.030 1.00 . A A . 31 ASN HB3 1 1 1 412 1 1 27 ASN HD21 H -5.627 3.827 2.346 1.00 . A A . 31 ASN HD21 1 1 1 413 1 1 27 ASN HD22 H -7.252 4.278 2.489 1.00 . A A . 31 ASN HD22 1 1 1 414 1 1 27 ASN N N -3.954 4.660 -2.049 1.00 . A A . 31 ASN N 1 1 1 415 1 1 27 ASN ND2 N -6.417 4.280 1.985 1.00 . A A . 31 ASN ND2 1 1 1 416 1 1 27 ASN O O -6.546 6.305 -1.898 1.00 . A A . 31 ASN O 1 1 1 417 1 1 27 ASN OD1 O -7.326 5.460 0.394 1.00 . A A . 31 ASN OD1 1 1 1 418 1 1 28 HIS C C -9.514 5.206 -2.560 1.00 . A A . 32 HIS C 1 1 1 419 1 1 28 HIS CA C -8.323 5.101 -3.513 1.00 . A A . 32 HIS CA 1 1 1 420 1 1 28 HIS CB C -8.660 4.206 -4.707 1.00 . A A . 32 HIS CB 1 1 1 421 1 1 28 HIS CD2 C -7.937 4.964 -7.117 1.00 . A A . 32 HIS CD2 1 1 1 422 1 1 28 HIS CE1 C -9.309 6.625 -7.350 1.00 . A A . 32 HIS CE1 1 1 1 423 1 1 28 HIS CG C -8.677 5.034 -5.962 1.00 . A A . 32 HIS CG 1 1 1 424 1 1 28 HIS H H -7.049 3.459 -2.941 1.00 . A A . 32 HIS H 1 1 1 425 1 1 28 HIS HA H -8.027 6.076 -3.852 1.00 . A A . 32 HIS HA 1 1 1 426 1 1 28 HIS HB2 H -7.916 3.431 -4.797 1.00 . A A . 32 HIS HB2 1 1 1 427 1 1 28 HIS HB3 H -9.632 3.758 -4.557 1.00 . A A . 32 HIS HB3 1 1 1 428 1 1 28 HIS HD1 H -10.211 6.416 -5.486 1.00 . A A . 32 HIS HD1 1 1 1 429 1 1 28 HIS HD2 H -7.162 4.239 -7.316 1.00 . A A . 32 HIS HD2 1 1 1 430 1 1 28 HIS HE1 H -9.840 7.472 -7.758 1.00 . A A . 32 HIS HE1 1 1 1 431 1 1 28 HIS N N -7.188 4.421 -2.825 1.00 . A A . 32 HIS N 1 1 1 432 1 1 28 HIS ND1 N -9.545 6.101 -6.133 1.00 . A A . 32 HIS ND1 1 1 1 433 1 1 28 HIS NE2 N -8.338 5.970 -7.992 1.00 . A A . 32 HIS NE2 1 1 1 434 1 1 28 HIS O O -10.345 6.083 -2.678 1.00 . A A . 32 HIS O 1 1 1 435 1 1 29 ILE C C -10.817 5.724 0.018 1.00 . A A . 33 ILE C 1 1 1 436 1 1 29 ILE CA C -10.727 4.347 -0.645 1.00 . A A . 33 ILE CA 1 1 1 437 1 1 29 ILE CB C -10.409 3.262 0.391 1.00 . A A . 33 ILE CB 1 1 1 438 1 1 29 ILE CD1 C -8.725 2.384 2.022 1.00 . A A . 33 ILE CD1 1 1 1 439 1 1 29 ILE CG1 C -9.026 3.496 1.013 1.00 . A A . 33 ILE CG1 1 1 1 440 1 1 29 ILE CG2 C -10.441 1.892 -0.287 1.00 . A A . 33 ILE CG2 1 1 1 441 1 1 29 ILE H H -8.911 3.618 -1.550 1.00 . A A . 33 ILE H 1 1 1 442 1 1 29 ILE HA H -11.654 4.114 -1.145 1.00 . A A . 33 ILE HA 1 1 1 443 1 1 29 ILE HB H -11.153 3.294 1.168 1.00 . A A . 33 ILE HB 1 1 1 444 1 1 29 ILE HD11 H -9.296 2.552 2.922 1.00 . A A . 33 ILE HD11 1 1 1 445 1 1 29 ILE HD12 H -7.671 2.387 2.259 1.00 . A A . 33 ILE HD12 1 1 1 446 1 1 29 ILE HD13 H -8.994 1.428 1.599 1.00 . A A . 33 ILE HD13 1 1 1 447 1 1 29 ILE HG12 H -8.272 3.493 0.241 1.00 . A A . 33 ILE HG12 1 1 1 448 1 1 29 ILE HG13 H -9.016 4.445 1.525 1.00 . A A . 33 ILE HG13 1 1 1 449 1 1 29 ILE HG21 H -11.439 1.691 -0.647 1.00 . A A . 33 ILE HG21 1 1 1 450 1 1 29 ILE HG22 H -10.155 1.132 0.426 1.00 . A A . 33 ILE HG22 1 1 1 451 1 1 29 ILE HG23 H -9.751 1.885 -1.118 1.00 . A A . 33 ILE HG23 1 1 1 452 1 1 29 ILE N N -9.595 4.313 -1.617 1.00 . A A . 33 ILE N 1 1 1 453 1 1 29 ILE O O -11.887 6.270 0.201 1.00 . A A . 33 ILE O 1 1 1 454 1 1 30 ASP C C -8.738 8.580 0.317 1.00 . A A . 34 ASP C 1 1 1 455 1 1 30 ASP CA C -9.709 7.628 1.031 1.00 . A A . 34 ASP CA 1 1 1 456 1 1 30 ASP CB C -9.247 7.372 2.466 1.00 . A A . 34 ASP CB 1 1 1 457 1 1 30 ASP CG C -9.650 8.554 3.350 1.00 . A A . 34 ASP CG 1 1 1 458 1 1 30 ASP H H -8.855 5.823 0.220 1.00 . A A . 34 ASP H 1 1 1 459 1 1 30 ASP HA H -10.706 8.040 1.033 1.00 . A A . 34 ASP HA 1 1 1 460 1 1 30 ASP HB2 H -9.712 6.470 2.837 1.00 . A A . 34 ASP HB2 1 1 1 461 1 1 30 ASP HB3 H -8.173 7.258 2.484 1.00 . A A . 34 ASP HB3 1 1 1 462 1 1 30 ASP N N -9.701 6.286 0.378 1.00 . A A . 34 ASP N 1 1 1 463 1 1 30 ASP O O -8.343 9.595 0.856 1.00 . A A . 34 ASP O 1 1 1 464 1 1 30 ASP OD1 O -10.780 9.000 3.231 1.00 . A A . 34 ASP OD1 1 1 1 465 1 1 30 ASP OD2 O -8.822 8.993 4.131 1.00 . A A . 34 ASP OD2 1 1 1 466 1 1 31 GLN C C -6.145 9.412 -0.826 1.00 . A A . 35 GLN C 1 1 1 467 1 1 31 GLN CA C -7.417 9.150 -1.642 1.00 . A A . 35 GLN CA 1 1 1 468 1 1 31 GLN CB C -8.191 10.450 -1.858 1.00 . A A . 35 GLN CB 1 1 1 469 1 1 31 GLN CD C -8.199 10.582 -4.353 1.00 . A A . 35 GLN CD 1 1 1 470 1 1 31 GLN CG C -9.057 10.324 -3.113 1.00 . A A . 35 GLN CG 1 1 1 471 1 1 31 GLN H H -8.688 7.440 -1.309 1.00 . A A . 35 GLN H 1 1 1 472 1 1 31 GLN HA H -7.166 8.710 -2.594 1.00 . A A . 35 GLN HA 1 1 1 473 1 1 31 GLN HB2 H -8.821 10.642 -1.003 1.00 . A A . 35 GLN HB2 1 1 1 474 1 1 31 GLN HB3 H -7.495 11.268 -1.982 1.00 . A A . 35 GLN HB3 1 1 1 475 1 1 31 GLN HE21 H -9.180 9.270 -5.477 1.00 . A A . 35 GLN HE21 1 1 1 476 1 1 31 GLN HE22 H -7.905 10.080 -6.252 1.00 . A A . 35 GLN HE22 1 1 1 477 1 1 31 GLN HG2 H -9.475 9.330 -3.163 1.00 . A A . 35 GLN HG2 1 1 1 478 1 1 31 GLN HG3 H -9.857 11.050 -3.072 1.00 . A A . 35 GLN HG3 1 1 1 479 1 1 31 GLN N N -8.355 8.261 -0.891 1.00 . A A . 35 GLN N 1 1 1 480 1 1 31 GLN NE2 N -8.448 9.922 -5.452 1.00 . A A . 35 GLN NE2 1 1 1 481 1 1 31 GLN O O -6.055 10.374 -0.091 1.00 . A A . 35 GLN O 1 1 1 482 1 1 31 GLN OE1 O -7.292 11.390 -4.322 1.00 . A A . 35 GLN OE1 1 1 1 483 1 1 32 THR C C -2.811 7.807 -0.742 1.00 . A A . 36 THR C 1 1 1 484 1 1 32 THR CA C -3.884 8.760 -0.204 1.00 . A A . 36 THR CA 1 1 1 485 1 1 32 THR CB C -4.211 8.422 1.257 1.00 . A A . 36 THR CB 1 1 1 486 1 1 32 THR CG2 C -4.562 9.703 2.015 1.00 . A A . 36 THR CG2 1 1 1 487 1 1 32 THR H H -5.254 7.799 -1.564 1.00 . A A . 36 THR H 1 1 1 488 1 1 32 THR HA H -3.552 9.784 -0.281 1.00 . A A . 36 THR HA 1 1 1 489 1 1 32 THR HB H -3.350 7.963 1.718 1.00 . A A . 36 THR HB 1 1 1 490 1 1 32 THR HG1 H -6.116 8.026 1.178 1.00 . A A . 36 THR HG1 1 1 1 491 1 1 32 THR HG21 H -3.921 9.795 2.880 1.00 . A A . 36 THR HG21 1 1 1 492 1 1 32 THR HG22 H -5.593 9.662 2.333 1.00 . A A . 36 THR HG22 1 1 1 493 1 1 32 THR HG23 H -4.418 10.555 1.368 1.00 . A A . 36 THR HG23 1 1 1 494 1 1 32 THR N N -5.159 8.565 -0.960 1.00 . A A . 36 THR N 1 1 1 495 1 1 32 THR O O -3.076 6.987 -1.595 1.00 . A A . 36 THR O 1 1 1 496 1 1 32 THR OG1 O -5.310 7.520 1.309 1.00 . A A . 36 THR OG1 1 1 1 497 1 1 33 THR C C 0.332 6.513 0.434 1.00 . A A . 37 THR C 1 1 1 498 1 1 33 THR CA C -0.528 6.984 -0.737 1.00 . A A . 37 THR CA 1 1 1 499 1 1 33 THR CB C 0.324 7.813 -1.701 1.00 . A A . 37 THR CB 1 1 1 500 1 1 33 THR CG2 C -0.554 8.400 -2.801 1.00 . A A . 37 THR CG2 1 1 1 501 1 1 33 THR H H -1.407 8.565 0.444 1.00 . A A . 37 THR H 1 1 1 502 1 1 33 THR HA H -0.957 6.141 -1.254 1.00 . A A . 37 THR HA 1 1 1 503 1 1 33 THR HB H 1.079 7.178 -2.151 1.00 . A A . 37 THR HB 1 1 1 504 1 1 33 THR HG1 H 1.256 9.519 -1.620 1.00 . A A . 37 THR HG1 1 1 1 505 1 1 33 THR HG21 H -0.694 9.455 -2.629 1.00 . A A . 37 THR HG21 1 1 1 506 1 1 33 THR HG22 H -1.511 7.905 -2.798 1.00 . A A . 37 THR HG22 1 1 1 507 1 1 33 THR HG23 H -0.076 8.252 -3.760 1.00 . A A . 37 THR HG23 1 1 1 508 1 1 33 THR N N -1.605 7.901 -0.250 1.00 . A A . 37 THR N 1 1 1 509 1 1 33 THR O O 0.981 7.301 1.091 1.00 . A A . 37 THR O 1 1 1 510 1 1 33 THR OG1 O 0.954 8.865 -0.984 1.00 . A A . 37 THR OG1 1 1 1 511 1 1 34 THR C C 2.224 3.732 1.279 1.00 . A A . 38 THR C 1 1 1 512 1 1 34 THR CA C 1.204 4.735 1.816 1.00 . A A . 38 THR CA 1 1 1 513 1 1 34 THR CB C 0.238 4.066 2.796 1.00 . A A . 38 THR CB 1 1 1 514 1 1 34 THR CG2 C -0.459 2.893 2.113 1.00 . A A . 38 THR CG2 1 1 1 515 1 1 34 THR H H -0.163 4.606 0.144 1.00 . A A . 38 THR H 1 1 1 516 1 1 34 THR HA H 1.708 5.558 2.300 1.00 . A A . 38 THR HA 1 1 1 517 1 1 34 THR HB H -0.503 4.781 3.117 1.00 . A A . 38 THR HB 1 1 1 518 1 1 34 THR HG1 H 0.336 3.199 4.534 1.00 . A A . 38 THR HG1 1 1 1 519 1 1 34 THR HG21 H 0.277 2.256 1.650 1.00 . A A . 38 THR HG21 1 1 1 520 1 1 34 THR HG22 H -1.135 3.270 1.361 1.00 . A A . 38 THR HG22 1 1 1 521 1 1 34 THR HG23 H -1.014 2.327 2.847 1.00 . A A . 38 THR HG23 1 1 1 522 1 1 34 THR N N 0.359 5.237 0.693 1.00 . A A . 38 THR N 1 1 1 523 1 1 34 THR O O 1.928 2.941 0.409 1.00 . A A . 38 THR O 1 1 1 524 1 1 34 THR OG1 O 0.962 3.596 3.924 1.00 . A A . 38 THR OG1 1 1 1 525 1 1 35 TRP C C 4.096 1.384 1.707 1.00 . A A . 39 TRP C 1 1 1 526 1 1 35 TRP CA C 4.458 2.810 1.278 1.00 . A A . 39 TRP CA 1 1 1 527 1 1 35 TRP CB C 5.791 3.226 1.923 1.00 . A A . 39 TRP CB 1 1 1 528 1 1 35 TRP CD1 C 5.708 5.578 2.863 1.00 . A A . 39 TRP CD1 1 1 1 529 1 1 35 TRP CD2 C 6.568 5.523 0.782 1.00 . A A . 39 TRP CD2 1 1 1 530 1 1 35 TRP CE2 C 6.584 6.877 1.199 1.00 . A A . 39 TRP CE2 1 1 1 531 1 1 35 TRP CE3 C 7.065 5.225 -0.504 1.00 . A A . 39 TRP CE3 1 1 1 532 1 1 35 TRP CG C 6.000 4.714 1.860 1.00 . A A . 39 TRP CG 1 1 1 533 1 1 35 TRP CH2 C 7.564 7.575 -0.887 1.00 . A A . 39 TRP CH2 1 1 1 534 1 1 35 TRP CZ2 C 7.072 7.891 0.380 1.00 . A A . 39 TRP CZ2 1 1 1 535 1 1 35 TRP CZ3 C 7.558 6.246 -1.327 1.00 . A A . 39 TRP CZ3 1 1 1 536 1 1 35 TRP H H 3.649 4.411 2.477 1.00 . A A . 39 TRP H 1 1 1 537 1 1 35 TRP HA H 4.530 2.866 0.203 1.00 . A A . 39 TRP HA 1 1 1 538 1 1 35 TRP HB2 H 5.794 2.914 2.957 1.00 . A A . 39 TRP HB2 1 1 1 539 1 1 35 TRP HB3 H 6.601 2.735 1.404 1.00 . A A . 39 TRP HB3 1 1 1 540 1 1 35 TRP HD1 H 5.272 5.310 3.814 1.00 . A A . 39 TRP HD1 1 1 1 541 1 1 35 TRP HE1 H 5.933 7.668 3.007 1.00 . A A . 39 TRP HE1 1 1 1 542 1 1 35 TRP HE3 H 7.059 4.212 -0.865 1.00 . A A . 39 TRP HE3 1 1 1 543 1 1 35 TRP HH2 H 7.946 8.355 -1.530 1.00 . A A . 39 TRP HH2 1 1 1 544 1 1 35 TRP HZ2 H 7.073 8.913 0.726 1.00 . A A . 39 TRP HZ2 1 1 1 545 1 1 35 TRP HZ3 H 7.942 6.002 -2.306 1.00 . A A . 39 TRP HZ3 1 1 1 546 1 1 35 TRP N N 3.426 3.763 1.780 1.00 . A A . 39 TRP N 1 1 1 547 1 1 35 TRP NE1 N 6.047 6.858 2.467 1.00 . A A . 39 TRP NE1 1 1 1 548 1 1 35 TRP O O 4.322 0.434 0.986 1.00 . A A . 39 TRP O 1 1 1 549 1 1 36 GLN C C 1.664 -0.369 3.162 1.00 . A A . 40 GLN C 1 1 1 550 1 1 36 GLN CA C 3.166 -0.135 3.351 1.00 . A A . 40 GLN CA 1 1 1 551 1 1 36 GLN CB C 3.528 -0.150 4.836 1.00 . A A . 40 GLN CB 1 1 1 552 1 1 36 GLN CD C 5.503 1.064 5.769 1.00 . A A . 40 GLN CD 1 1 1 553 1 1 36 GLN CG C 5.050 -0.172 4.990 1.00 . A A . 40 GLN CG 1 1 1 554 1 1 36 GLN H H 3.367 2.010 3.444 1.00 . A A . 40 GLN H 1 1 1 555 1 1 36 GLN HA H 3.734 -0.885 2.825 1.00 . A A . 40 GLN HA 1 1 1 556 1 1 36 GLN HB2 H 3.131 0.734 5.312 1.00 . A A . 40 GLN HB2 1 1 1 557 1 1 36 GLN HB3 H 3.107 -1.029 5.299 1.00 . A A . 40 GLN HB3 1 1 1 558 1 1 36 GLN HE21 H 4.316 0.697 7.318 1.00 . A A . 40 GLN HE21 1 1 1 559 1 1 36 GLN HE22 H 5.270 2.094 7.450 1.00 . A A . 40 GLN HE22 1 1 1 560 1 1 36 GLN HG2 H 5.345 -1.063 5.526 1.00 . A A . 40 GLN HG2 1 1 1 561 1 1 36 GLN HG3 H 5.511 -0.172 4.013 1.00 . A A . 40 GLN HG3 1 1 1 562 1 1 36 GLN N N 3.538 1.230 2.877 1.00 . A A . 40 GLN N 1 1 1 563 1 1 36 GLN NE2 N 4.987 1.305 6.943 1.00 . A A . 40 GLN NE2 1 1 1 564 1 1 36 GLN O O 0.921 0.536 2.839 1.00 . A A . 40 GLN O 1 1 1 565 1 1 36 GLN OE1 O 6.335 1.819 5.304 1.00 . A A . 40 GLN OE1 1 1 1 566 1 1 37 ASP C C -0.936 -1.896 4.559 1.00 . A A . 41 ASP C 1 1 1 567 1 1 37 ASP CA C -0.237 -1.870 3.192 1.00 . A A . 41 ASP CA 1 1 1 568 1 1 37 ASP CB C -0.291 -3.250 2.537 1.00 . A A . 41 ASP CB 1 1 1 569 1 1 37 ASP CG C 0.366 -4.278 3.461 1.00 . A A . 41 ASP CG 1 1 1 570 1 1 37 ASP H H 1.831 -2.294 3.619 1.00 . A A . 41 ASP H 1 1 1 571 1 1 37 ASP HA H -0.697 -1.138 2.547 1.00 . A A . 41 ASP HA 1 1 1 572 1 1 37 ASP HB2 H -1.321 -3.528 2.364 1.00 . A A . 41 ASP HB2 1 1 1 573 1 1 37 ASP HB3 H 0.238 -3.223 1.596 1.00 . A A . 41 ASP HB3 1 1 1 574 1 1 37 ASP N N 1.214 -1.577 3.360 1.00 . A A . 41 ASP N 1 1 1 575 1 1 37 ASP O O -0.306 -2.160 5.565 1.00 . A A . 41 ASP O 1 1 1 576 1 1 37 ASP OD1 O -0.184 -4.530 4.521 1.00 . A A . 41 ASP OD1 1 1 1 577 1 1 37 ASP OD2 O 1.406 -4.797 3.093 1.00 . A A . 41 ASP OD2 1 1 1 578 1 1 38 PRO C C -3.204 -3.046 6.320 1.00 . A A . 42 PRO C 1 1 1 579 1 1 38 PRO CA C -2.994 -1.615 5.818 1.00 . A A . 42 PRO CA 1 1 1 580 1 1 38 PRO CB C -4.323 -0.978 5.423 1.00 . A A . 42 PRO CB 1 1 1 581 1 1 38 PRO CD C -3.057 -1.289 3.391 1.00 . A A . 42 PRO CD 1 1 1 582 1 1 38 PRO CG C -4.453 -1.233 3.954 1.00 . A A . 42 PRO CG 1 1 1 583 1 1 38 PRO HA H -2.503 -1.014 6.566 1.00 . A A . 42 PRO HA 1 1 1 584 1 1 38 PRO HB2 H -5.137 -1.444 5.958 1.00 . A A . 42 PRO HB2 1 1 1 585 1 1 38 PRO HB3 H -4.303 0.085 5.618 1.00 . A A . 42 PRO HB3 1 1 1 586 1 1 38 PRO HD2 H -2.982 -2.061 2.639 1.00 . A A . 42 PRO HD2 1 1 1 587 1 1 38 PRO HD3 H -2.775 -0.331 2.980 1.00 . A A . 42 PRO HD3 1 1 1 588 1 1 38 PRO HG2 H -4.956 -2.174 3.788 1.00 . A A . 42 PRO HG2 1 1 1 589 1 1 38 PRO HG3 H -5.006 -0.431 3.488 1.00 . A A . 42 PRO HG3 1 1 1 590 1 1 38 PRO N N -2.217 -1.620 4.554 1.00 . A A . 42 PRO N 1 1 1 591 1 1 38 PRO O O -3.444 -3.275 7.489 1.00 . A A . 42 PRO O 1 1 1 592 1 1 39 ARG C C -2.121 -6.281 5.430 1.00 . A A . 43 ARG C 1 1 1 593 1 1 39 ARG CA C -3.311 -5.426 5.872 1.00 . A A . 43 ARG CA 1 1 1 594 1 1 39 ARG CB C -4.590 -5.879 5.168 1.00 . A A . 43 ARG CB 1 1 1 595 1 1 39 ARG CD C -6.917 -6.713 5.531 1.00 . A A . 43 ARG CD 1 1 1 596 1 1 39 ARG CG C -5.703 -6.064 6.201 1.00 . A A . 43 ARG CG 1 1 1 597 1 1 39 ARG CZ C -7.192 -8.458 7.218 1.00 . A A . 43 ARG CZ 1 1 1 598 1 1 39 ARG H H -2.922 -3.804 4.507 1.00 . A A . 43 ARG H 1 1 1 599 1 1 39 ARG HA H -3.440 -5.482 6.942 1.00 . A A . 43 ARG HA 1 1 1 600 1 1 39 ARG HB2 H -4.888 -5.133 4.447 1.00 . A A . 43 ARG HB2 1 1 1 601 1 1 39 ARG HB3 H -4.409 -6.816 4.662 1.00 . A A . 43 ARG HB3 1 1 1 602 1 1 39 ARG HD2 H -7.534 -5.960 5.062 1.00 . A A . 43 ARG HD2 1 1 1 603 1 1 39 ARG HD3 H -6.598 -7.446 4.805 1.00 . A A . 43 ARG HD3 1 1 1 604 1 1 39 ARG HE H -8.509 -6.991 6.953 1.00 . A A . 43 ARG HE 1 1 1 605 1 1 39 ARG HG2 H -5.351 -6.700 7.000 1.00 . A A . 43 ARG HG2 1 1 1 606 1 1 39 ARG HG3 H -5.985 -5.102 6.602 1.00 . A A . 43 ARG HG3 1 1 1 607 1 1 39 ARG HH11 H -5.535 -8.581 6.086 1.00 . A A . 43 ARG HH11 1 1 1 608 1 1 39 ARG HH12 H -5.722 -9.820 7.279 1.00 . A A . 43 ARG HH12 1 1 1 609 1 1 39 ARG HH21 H -8.729 -8.610 8.493 1.00 . A A . 43 ARG HH21 1 1 1 610 1 1 39 ARG HH22 H -7.515 -9.838 8.632 1.00 . A A . 43 ARG HH22 1 1 1 611 1 1 39 ARG N N -3.116 -4.011 5.445 1.00 . A A . 43 ARG N 1 1 1 612 1 1 39 ARG NE N -7.660 -7.373 6.645 1.00 . A A . 43 ARG NE 1 1 1 613 1 1 39 ARG NH1 N -6.061 -8.993 6.830 1.00 . A A . 43 ARG NH1 1 1 1 614 1 1 39 ARG NH2 N -7.865 -9.012 8.190 1.00 . A A . 43 ARG NH2 1 1 1 615 1 1 39 ARG O O -1.787 -6.340 4.262 1.00 . A A . 43 ARG O 1 1 1 616 1 1 40 LYS C C -0.592 -9.258 6.326 1.00 . A A . 44 LYS C 1 1 1 617 1 1 40 LYS CA C -0.310 -7.794 5.982 1.00 . A A . 44 LYS CA 1 1 1 618 1 1 40 LYS CB C 0.850 -7.259 6.821 1.00 . A A . 44 LYS CB 1 1 1 619 1 1 40 LYS CD C 2.391 -6.901 4.889 1.00 . A A . 44 LYS CD 1 1 1 620 1 1 40 LYS CE C 3.006 -7.822 3.834 1.00 . A A . 44 LYS CE 1 1 1 621 1 1 40 LYS CG C 2.176 -7.682 6.186 1.00 . A A . 44 LYS CG 1 1 1 622 1 1 40 LYS H H -1.764 -6.882 7.288 1.00 . A A . 44 LYS H 1 1 1 623 1 1 40 LYS HA H -0.085 -7.689 4.932 1.00 . A A . 44 LYS HA 1 1 1 624 1 1 40 LYS HB2 H 0.798 -6.181 6.862 1.00 . A A . 44 LYS HB2 1 1 1 625 1 1 40 LYS HB3 H 0.786 -7.661 7.822 1.00 . A A . 44 LYS HB3 1 1 1 626 1 1 40 LYS HD2 H 1.444 -6.526 4.532 1.00 . A A . 44 LYS HD2 1 1 1 627 1 1 40 LYS HD3 H 3.059 -6.071 5.074 1.00 . A A . 44 LYS HD3 1 1 1 628 1 1 40 LYS HE2 H 4.068 -7.646 3.752 1.00 . A A . 44 LYS HE2 1 1 1 629 1 1 40 LYS HE3 H 2.813 -8.857 4.080 1.00 . A A . 44 LYS HE3 1 1 1 630 1 1 40 LYS HG2 H 2.985 -7.475 6.870 1.00 . A A . 44 LYS HG2 1 1 1 631 1 1 40 LYS HG3 H 2.150 -8.740 5.969 1.00 . A A . 44 LYS HG3 1 1 1 632 1 1 40 LYS HZ1 H 2.445 -6.441 2.380 1.00 . A A . 44 LYS HZ1 1 1 1 633 1 1 40 LYS HZ2 H 1.305 -7.674 2.641 1.00 . A A . 44 LYS HZ2 1 1 1 634 1 1 40 LYS HZ3 H 2.731 -8.000 1.777 1.00 . A A . 44 LYS HZ3 1 1 1 635 1 1 40 LYS N N -1.478 -6.943 6.352 1.00 . A A . 44 LYS N 1 1 1 636 1 1 40 LYS NZ N 2.320 -7.457 2.562 1.00 . A A . 44 LYS NZ 1 1 1 637 1 1 40 LYS O O -1.101 -9.961 5.468 1.00 . A A . 44 LYS O 1 1 1 638 1 1 40 LYS OXT O -0.296 -9.653 7.443 1.00 . A A . 44 LYS OXT 1 1 1 639 2 2 1 ACE C C 6.837 15.215 1.139 1.00 . B B . 45 ACE C 1 1 1 640 2 2 1 ACE CH3 C 7.295 15.560 -0.280 1.00 . B B . 45 ACE CH3 1 1 1 641 2 2 1 ACE H1 H 6.513 15.313 -0.981 1.00 . B B . 45 ACE H1 1 1 1 642 2 2 1 ACE H2 H 8.184 14.995 -0.518 1.00 . B B . 45 ACE H2 1 1 1 643 2 2 1 ACE H3 H 7.513 16.616 -0.341 1.00 . B B . 45 ACE H3 1 1 1 644 2 2 1 ACE O O 5.848 15.736 1.616 1.00 . B B . 45 ACE O 1 1 1 645 2 2 2 PRO C C 6.440 12.347 0.818 1.00 . B B . 46 PRO C 1 1 1 646 2 2 2 PRO CA C 7.785 12.994 1.167 1.00 . B B . 46 PRO CA 1 1 1 647 2 2 2 PRO CB C 8.492 12.209 2.266 1.00 . B B . 46 PRO CB 1 1 1 648 2 2 2 PRO CD C 7.837 14.331 3.211 1.00 . B B . 46 PRO CD 1 1 1 649 2 2 2 PRO CG C 8.095 12.882 3.538 1.00 . B B . 46 PRO CG 1 1 1 650 2 2 2 PRO HA H 8.415 13.059 0.294 1.00 . B B . 46 PRO HA 1 1 1 651 2 2 2 PRO HB2 H 8.160 11.180 2.263 1.00 . B B . 46 PRO HB2 1 1 1 652 2 2 2 PRO HB3 H 9.562 12.261 2.137 1.00 . B B . 46 PRO HB3 1 1 1 653 2 2 2 PRO HD2 H 6.975 14.690 3.757 1.00 . B B . 46 PRO HD2 1 1 1 654 2 2 2 PRO HD3 H 8.706 14.930 3.435 1.00 . B B . 46 PRO HD3 1 1 1 655 2 2 2 PRO HG2 H 7.199 12.425 3.932 1.00 . B B . 46 PRO HG2 1 1 1 656 2 2 2 PRO HG3 H 8.896 12.811 4.258 1.00 . B B . 46 PRO HG3 1 1 1 657 2 2 2 PRO N N 7.576 14.340 1.765 1.00 . B B . 46 PRO N 1 1 1 658 2 2 2 PRO O O 5.393 12.890 1.099 1.00 . B B . 46 PRO O 1 1 1 659 2 2 3 LEU C C 4.385 11.333 -1.158 1.00 . B B . 47 LEU C 1 1 1 660 2 2 3 LEU CA C 5.205 10.481 -0.172 1.00 . B B . 47 LEU CA 1 1 1 661 2 2 3 LEU CB C 4.439 10.272 1.139 1.00 . B B . 47 LEU CB 1 1 1 662 2 2 3 LEU CD1 C 3.758 7.904 0.732 1.00 . B B . 47 LEU CD1 1 1 1 663 2 2 3 LEU CD2 C 2.291 9.412 2.080 1.00 . B B . 47 LEU CD2 1 1 1 664 2 2 3 LEU CG C 3.253 9.339 0.893 1.00 . B B . 47 LEU CG 1 1 1 665 2 2 3 LEU H H 7.336 10.775 -0.004 1.00 . B B . 47 LEU H 1 1 1 666 2 2 3 LEU HA H 5.439 9.525 -0.611 1.00 . B B . 47 LEU HA 1 1 1 667 2 2 3 LEU HB2 H 5.097 9.832 1.874 1.00 . B B . 47 LEU HB2 1 1 1 668 2 2 3 LEU HB3 H 4.076 11.221 1.504 1.00 . B B . 47 LEU HB3 1 1 1 669 2 2 3 LEU HD11 H 4.652 7.902 0.126 1.00 . B B . 47 LEU HD11 1 1 1 670 2 2 3 LEU HD12 H 2.998 7.306 0.253 1.00 . B B . 47 LEU HD12 1 1 1 671 2 2 3 LEU HD13 H 3.981 7.489 1.705 1.00 . B B . 47 LEU HD13 1 1 1 672 2 2 3 LEU HD21 H 1.275 9.452 1.718 1.00 . B B . 47 LEU HD21 1 1 1 673 2 2 3 LEU HD22 H 2.502 10.300 2.659 1.00 . B B . 47 LEU HD22 1 1 1 674 2 2 3 LEU HD23 H 2.419 8.539 2.702 1.00 . B B . 47 LEU HD23 1 1 1 675 2 2 3 LEU HG H 2.740 9.642 -0.007 1.00 . B B . 47 LEU HG 1 1 1 676 2 2 3 LEU N N 6.472 11.187 0.207 1.00 . B B . 47 LEU N 1 1 1 677 2 2 3 LEU O O 4.294 12.535 -1.008 1.00 . B B . 47 LEU O 1 1 1 678 2 2 4 PRO C C 1.647 11.819 -2.575 1.00 . B B . 48 PRO C 1 1 1 679 2 2 4 PRO CA C 3.006 11.406 -3.160 1.00 . B B . 48 PRO CA 1 1 1 680 2 2 4 PRO CB C 2.812 10.375 -4.268 1.00 . B B . 48 PRO CB 1 1 1 681 2 2 4 PRO CD C 3.866 9.236 -2.416 1.00 . B B . 48 PRO CD 1 1 1 682 2 2 4 PRO CG C 2.940 9.049 -3.589 1.00 . B B . 48 PRO CG 1 1 1 683 2 2 4 PRO HA H 3.542 12.258 -3.541 1.00 . B B . 48 PRO HA 1 1 1 684 2 2 4 PRO HB2 H 1.831 10.477 -4.709 1.00 . B B . 48 PRO HB2 1 1 1 685 2 2 4 PRO HB3 H 3.577 10.485 -5.022 1.00 . B B . 48 PRO HB3 1 1 1 686 2 2 4 PRO HD2 H 3.512 8.679 -1.562 1.00 . B B . 48 PRO HD2 1 1 1 687 2 2 4 PRO HD3 H 4.870 8.935 -2.675 1.00 . B B . 48 PRO HD3 1 1 1 688 2 2 4 PRO HG2 H 1.971 8.719 -3.244 1.00 . B B . 48 PRO HG2 1 1 1 689 2 2 4 PRO HG3 H 3.351 8.323 -4.273 1.00 . B B . 48 PRO HG3 1 1 1 690 2 2 4 PRO N N 3.814 10.682 -2.147 1.00 . B B . 48 PRO N 1 1 1 691 2 2 4 PRO O O 0.832 10.973 -2.269 1.00 . B B . 48 PRO O 1 1 1 692 2 2 5 PRO C C -0.959 13.460 -2.948 1.00 . B B . 49 PRO C 1 1 1 693 2 2 5 PRO CA C 0.149 13.603 -1.898 1.00 . B B . 49 PRO CA 1 1 1 694 2 2 5 PRO CB C 0.427 15.073 -1.601 1.00 . B B . 49 PRO CB 1 1 1 695 2 2 5 PRO CD C 2.354 14.205 -2.779 1.00 . B B . 49 PRO CD 1 1 1 696 2 2 5 PRO CG C 1.545 15.452 -2.521 1.00 . B B . 49 PRO CG 1 1 1 697 2 2 5 PRO HA H -0.110 13.081 -0.992 1.00 . B B . 49 PRO HA 1 1 1 698 2 2 5 PRO HB2 H -0.449 15.670 -1.810 1.00 . B B . 49 PRO HB2 1 1 1 699 2 2 5 PRO HB3 H 0.729 15.197 -0.572 1.00 . B B . 49 PRO HB3 1 1 1 700 2 2 5 PRO HD2 H 2.644 14.152 -3.819 1.00 . B B . 49 PRO HD2 1 1 1 701 2 2 5 PRO HD3 H 3.224 14.180 -2.140 1.00 . B B . 49 PRO HD3 1 1 1 702 2 2 5 PRO HG2 H 1.146 15.830 -3.450 1.00 . B B . 49 PRO HG2 1 1 1 703 2 2 5 PRO HG3 H 2.166 16.203 -2.055 1.00 . B B . 49 PRO HG3 1 1 1 704 2 2 5 PRO N N 1.436 13.107 -2.444 1.00 . B B . 49 PRO N 1 1 1 705 2 2 5 PRO O O -1.028 14.216 -3.896 1.00 . B B . 49 PRO O 1 1 1 706 2 2 6 TYR C C -3.669 13.625 -4.010 1.00 . B B . 50 TYR C 1 1 1 707 2 2 6 TYR CA C -2.924 12.306 -3.784 1.00 . B B . 50 TYR CA 1 1 1 708 2 2 6 TYR CB C -3.857 11.266 -3.156 1.00 . B B . 50 TYR CB 1 1 1 709 2 2 6 TYR CD1 C -4.890 10.983 -5.452 1.00 . B B . 50 TYR CD1 1 1 1 710 2 2 6 TYR CD2 C -4.656 9.036 -4.026 1.00 . B B . 50 TYR CD2 1 1 1 711 2 2 6 TYR CE1 C -5.469 10.185 -6.446 1.00 . B B . 50 TYR CE1 1 1 1 712 2 2 6 TYR CE2 C -5.236 8.238 -5.020 1.00 . B B . 50 TYR CE2 1 1 1 713 2 2 6 TYR CG C -4.482 10.408 -4.239 1.00 . B B . 50 TYR CG 1 1 1 714 2 2 6 TYR CZ C -5.642 8.812 -6.230 1.00 . B B . 50 TYR CZ 1 1 1 715 2 2 6 TYR H H -1.751 11.892 -2.020 1.00 . B B . 50 TYR H 1 1 1 716 2 2 6 TYR HA H -2.529 11.931 -4.715 1.00 . B B . 50 TYR HA 1 1 1 717 2 2 6 TYR HB2 H -3.293 10.638 -2.482 1.00 . B B . 50 TYR HB2 1 1 1 718 2 2 6 TYR HB3 H -4.637 11.772 -2.606 1.00 . B B . 50 TYR HB3 1 1 1 719 2 2 6 TYR HD1 H -4.756 12.041 -5.619 1.00 . B B . 50 TYR HD1 1 1 1 720 2 2 6 TYR HD2 H -4.342 8.590 -3.094 1.00 . B B . 50 TYR HD2 1 1 1 721 2 2 6 TYR HE1 H -5.782 10.628 -7.379 1.00 . B B . 50 TYR HE1 1 1 1 722 2 2 6 TYR HE2 H -5.368 7.179 -4.854 1.00 . B B . 50 TYR HE2 1 1 1 723 2 2 6 TYR HH H -5.518 7.749 -7.811 1.00 . B B . 50 TYR HH 1 1 1 724 2 2 6 TYR N N -1.824 12.494 -2.789 1.00 . B B . 50 TYR N 1 1 1 725 2 2 6 TYR O O -3.555 14.167 -5.096 1.00 . B B . 50 TYR O 1 1 1 726 2 2 6 TYR OXT O -4.339 14.069 -3.091 1.00 . B B . 50 TYR OXT 1 1 1 727 2 2 6 TYR OH O -6.213 8.027 -7.210 1.00 . B B . 50 TYR OH 1 1 2 728 1 1 1 PHE C C -3.763 -15.398 15.937 1.00 . A A . 5 PHE C 1 1 2 729 1 1 1 PHE CA C -4.675 -16.599 15.675 1.00 . A A . 5 PHE CA 1 1 2 730 1 1 1 PHE CB C -3.847 -17.833 15.316 1.00 . A A . 5 PHE CB 1 1 2 731 1 1 1 PHE CD1 C -2.912 -18.081 17.644 1.00 . A A . 5 PHE CD1 1 1 2 732 1 1 1 PHE CD2 C -4.040 -19.974 16.633 1.00 . A A . 5 PHE CD2 1 1 2 733 1 1 1 PHE CE1 C -2.677 -18.837 18.799 1.00 . A A . 5 PHE CE1 1 1 2 734 1 1 1 PHE CE2 C -3.805 -20.730 17.789 1.00 . A A . 5 PHE CE2 1 1 2 735 1 1 1 PHE CG C -3.594 -18.648 16.562 1.00 . A A . 5 PHE CG 1 1 2 736 1 1 1 PHE CZ C -3.123 -20.162 18.871 1.00 . A A . 5 PHE CZ 1 1 2 737 1 1 1 PHE HA H -5.286 -16.804 16.540 1.00 . A A . 5 PHE HA 1 1 2 738 1 1 1 PHE HB2 H -4.386 -18.432 14.598 1.00 . A A . 5 PHE HB2 1 1 2 739 1 1 1 PHE HB3 H -2.905 -17.523 14.892 1.00 . A A . 5 PHE HB3 1 1 2 740 1 1 1 PHE HD1 H -2.567 -17.058 17.588 1.00 . A A . 5 PHE HD1 1 1 2 741 1 1 1 PHE HD2 H -4.566 -20.412 15.799 1.00 . A A . 5 PHE HD2 1 1 2 742 1 1 1 PHE HE1 H -2.151 -18.398 19.633 1.00 . A A . 5 PHE HE1 1 1 2 743 1 1 1 PHE HE2 H -4.149 -21.752 17.844 1.00 . A A . 5 PHE HE2 1 1 2 744 1 1 1 PHE HZ H -2.942 -20.745 19.761 1.00 . A A . 5 PHE HZ 1 1 2 745 1 1 1 PHE N N -5.531 -16.346 14.480 1.00 . A A . 5 PHE N 1 1 2 746 1 1 1 PHE O O -3.847 -14.754 16.964 1.00 . A A . 5 PHE O 1 1 2 747 1 1 2 GLU C C -1.833 -13.141 13.907 1.00 . A A . 6 GLU C 1 1 2 748 1 1 2 GLU CA C -1.977 -13.930 15.211 1.00 . A A . 6 GLU CA 1 1 2 749 1 1 2 GLU CB C -0.637 -14.548 15.615 1.00 . A A . 6 GLU CB 1 1 2 750 1 1 2 GLU CD C 1.259 -15.145 14.099 1.00 . A A . 6 GLU CD 1 1 2 751 1 1 2 GLU CG C -0.167 -15.507 14.519 1.00 . A A . 6 GLU CG 1 1 2 752 1 1 2 GLU H H -2.841 -15.622 14.193 1.00 . A A . 6 GLU H 1 1 2 753 1 1 2 GLU HA H -2.340 -13.292 16.001 1.00 . A A . 6 GLU HA 1 1 2 754 1 1 2 GLU HB2 H 0.096 -13.764 15.745 1.00 . A A . 6 GLU HB2 1 1 2 755 1 1 2 GLU HB3 H -0.754 -15.090 16.542 1.00 . A A . 6 GLU HB3 1 1 2 756 1 1 2 GLU HG2 H -0.186 -16.519 14.895 1.00 . A A . 6 GLU HG2 1 1 2 757 1 1 2 GLU HG3 H -0.825 -15.428 13.666 1.00 . A A . 6 GLU HG3 1 1 2 758 1 1 2 GLU N N -2.891 -15.090 15.014 1.00 . A A . 6 GLU N 1 1 2 759 1 1 2 GLU O O -0.821 -13.205 13.239 1.00 . A A . 6 GLU O 1 1 2 760 1 1 2 GLU OE1 O 1.436 -14.077 13.535 1.00 . A A . 6 GLU OE1 1 1 2 761 1 1 2 GLU OE2 O 2.150 -15.940 14.350 1.00 . A A . 6 GLU OE2 1 1 2 762 1 1 3 ILE C C -2.391 -12.511 11.102 1.00 . A A . 7 ILE C 1 1 2 763 1 1 3 ILE CA C -2.762 -11.601 12.281 1.00 . A A . 7 ILE CA 1 1 2 764 1 1 3 ILE CB C -1.662 -10.569 12.528 1.00 . A A . 7 ILE CB 1 1 2 765 1 1 3 ILE CD1 C -0.951 -8.655 13.969 1.00 . A A . 7 ILE CD1 1 1 2 766 1 1 3 ILE CG1 C -2.047 -9.693 13.722 1.00 . A A . 7 ILE CG1 1 1 2 767 1 1 3 ILE CG2 C -1.497 -9.691 11.287 1.00 . A A . 7 ILE CG2 1 1 2 768 1 1 3 ILE H H -3.648 -12.357 14.094 1.00 . A A . 7 ILE H 1 1 2 769 1 1 3 ILE HA H -3.700 -11.103 12.091 1.00 . A A . 7 ILE HA 1 1 2 770 1 1 3 ILE HB H -0.733 -11.077 12.737 1.00 . A A . 7 ILE HB 1 1 2 771 1 1 3 ILE HD11 H -0.005 -9.042 13.618 1.00 . A A . 7 ILE HD11 1 1 2 772 1 1 3 ILE HD12 H -0.883 -8.446 15.028 1.00 . A A . 7 ILE HD12 1 1 2 773 1 1 3 ILE HD13 H -1.188 -7.747 13.437 1.00 . A A . 7 ILE HD13 1 1 2 774 1 1 3 ILE HG12 H -2.980 -9.189 13.514 1.00 . A A . 7 ILE HG12 1 1 2 775 1 1 3 ILE HG13 H -2.161 -10.311 14.602 1.00 . A A . 7 ILE HG13 1 1 2 776 1 1 3 ILE HG21 H -0.778 -8.910 11.491 1.00 . A A . 7 ILE HG21 1 1 2 777 1 1 3 ILE HG22 H -2.447 -9.246 11.031 1.00 . A A . 7 ILE HG22 1 1 2 778 1 1 3 ILE HG23 H -1.149 -10.295 10.463 1.00 . A A . 7 ILE HG23 1 1 2 779 1 1 3 ILE N N -2.840 -12.396 13.540 1.00 . A A . 7 ILE N 1 1 2 780 1 1 3 ILE O O -1.229 -12.792 10.883 1.00 . A A . 7 ILE O 1 1 2 781 1 1 4 PRO C C -2.517 -13.036 8.059 1.00 . A A . 8 PRO C 1 1 2 782 1 1 4 PRO CA C -3.151 -13.827 9.206 1.00 . A A . 8 PRO CA 1 1 2 783 1 1 4 PRO CB C -4.548 -14.311 8.826 1.00 . A A . 8 PRO CB 1 1 2 784 1 1 4 PRO CD C -4.825 -12.656 10.560 1.00 . A A . 8 PRO CD 1 1 2 785 1 1 4 PRO CG C -5.475 -13.256 9.341 1.00 . A A . 8 PRO CG 1 1 2 786 1 1 4 PRO HA H -2.532 -14.665 9.483 1.00 . A A . 8 PRO HA 1 1 2 787 1 1 4 PRO HB2 H -4.636 -14.396 7.753 1.00 . A A . 8 PRO HB2 1 1 2 788 1 1 4 PRO HB3 H -4.758 -15.259 9.297 1.00 . A A . 8 PRO HB3 1 1 2 789 1 1 4 PRO HD2 H -4.994 -11.590 10.593 1.00 . A A . 8 PRO HD2 1 1 2 790 1 1 4 PRO HD3 H -5.191 -13.129 11.458 1.00 . A A . 8 PRO HD3 1 1 2 791 1 1 4 PRO HG2 H -5.623 -12.497 8.588 1.00 . A A . 8 PRO HG2 1 1 2 792 1 1 4 PRO HG3 H -6.423 -13.699 9.610 1.00 . A A . 8 PRO HG3 1 1 2 793 1 1 4 PRO N N -3.392 -12.942 10.372 1.00 . A A . 8 PRO N 1 1 2 794 1 1 4 PRO O O -2.349 -11.836 8.139 1.00 . A A . 8 PRO O 1 1 2 795 1 1 5 ASP C C -2.153 -13.463 4.526 1.00 . A A . 9 ASP C 1 1 2 796 1 1 5 ASP CA C -1.537 -12.984 5.843 1.00 . A A . 9 ASP CA 1 1 2 797 1 1 5 ASP CB C -0.054 -13.350 5.907 1.00 . A A . 9 ASP CB 1 1 2 798 1 1 5 ASP CG C 0.780 -12.203 5.333 1.00 . A A . 9 ASP CG 1 1 2 799 1 1 5 ASP H H -2.304 -14.669 6.948 1.00 . A A . 9 ASP H 1 1 2 800 1 1 5 ASP HA H -1.659 -11.919 5.952 1.00 . A A . 9 ASP HA 1 1 2 801 1 1 5 ASP HB2 H 0.231 -13.523 6.934 1.00 . A A . 9 ASP HB2 1 1 2 802 1 1 5 ASP HB3 H 0.120 -14.246 5.329 1.00 . A A . 9 ASP HB3 1 1 2 803 1 1 5 ASP N N -2.161 -13.700 6.993 1.00 . A A . 9 ASP N 1 1 2 804 1 1 5 ASP O O -1.523 -14.156 3.752 1.00 . A A . 9 ASP O 1 1 2 805 1 1 5 ASP OD1 O 0.236 -11.432 4.561 1.00 . A A . 9 ASP OD1 1 1 2 806 1 1 5 ASP OD2 O 1.946 -12.116 5.676 1.00 . A A . 9 ASP OD2 1 1 2 807 1 1 6 ASP C C -3.834 -12.473 1.910 1.00 . A A . 10 ASP C 1 1 2 808 1 1 6 ASP CA C -4.031 -13.533 2.996 1.00 . A A . 10 ASP CA 1 1 2 809 1 1 6 ASP CB C -5.512 -13.681 3.344 1.00 . A A . 10 ASP CB 1 1 2 810 1 1 6 ASP CG C -5.843 -15.161 3.546 1.00 . A A . 10 ASP CG 1 1 2 811 1 1 6 ASP H H -3.869 -12.538 4.902 1.00 . A A . 10 ASP H 1 1 2 812 1 1 6 ASP HA H -3.631 -14.482 2.674 1.00 . A A . 10 ASP HA 1 1 2 813 1 1 6 ASP HB2 H -5.726 -13.137 4.252 1.00 . A A . 10 ASP HB2 1 1 2 814 1 1 6 ASP HB3 H -6.112 -13.285 2.537 1.00 . A A . 10 ASP HB3 1 1 2 815 1 1 6 ASP N N -3.378 -13.099 4.265 1.00 . A A . 10 ASP N 1 1 2 816 1 1 6 ASP O O -2.958 -12.581 1.075 1.00 . A A . 10 ASP O 1 1 2 817 1 1 6 ASP OD1 O -5.981 -15.858 2.553 1.00 . A A . 10 ASP OD1 1 1 2 818 1 1 6 ASP OD2 O -5.952 -15.573 4.689 1.00 . A A . 10 ASP OD2 1 1 2 819 1 1 7 VAL C C -3.644 -9.228 1.419 1.00 . A A . 11 VAL C 1 1 2 820 1 1 7 VAL CA C -4.498 -10.383 0.877 1.00 . A A . 11 VAL CA 1 1 2 821 1 1 7 VAL CB C -5.925 -9.910 0.600 1.00 . A A . 11 VAL CB 1 1 2 822 1 1 7 VAL CG1 C -5.909 -8.882 -0.534 1.00 . A A . 11 VAL CG1 1 1 2 823 1 1 7 VAL CG2 C -6.791 -11.104 0.195 1.00 . A A . 11 VAL CG2 1 1 2 824 1 1 7 VAL H H -5.342 -11.375 2.592 1.00 . A A . 11 VAL H 1 1 2 825 1 1 7 VAL HA H -4.063 -10.789 -0.021 1.00 . A A . 11 VAL HA 1 1 2 826 1 1 7 VAL HB H -6.333 -9.455 1.490 1.00 . A A . 11 VAL HB 1 1 2 827 1 1 7 VAL HG11 H -5.643 -9.373 -1.459 1.00 . A A . 11 VAL HG11 1 1 2 828 1 1 7 VAL HG12 H -5.184 -8.113 -0.312 1.00 . A A . 11 VAL HG12 1 1 2 829 1 1 7 VAL HG13 H -6.888 -8.438 -0.630 1.00 . A A . 11 VAL HG13 1 1 2 830 1 1 7 VAL HG21 H -7.827 -10.801 0.156 1.00 . A A . 11 VAL HG21 1 1 2 831 1 1 7 VAL HG22 H -6.675 -11.895 0.921 1.00 . A A . 11 VAL HG22 1 1 2 832 1 1 7 VAL HG23 H -6.483 -11.460 -0.777 1.00 . A A . 11 VAL HG23 1 1 2 833 1 1 7 VAL N N -4.641 -11.447 1.913 1.00 . A A . 11 VAL N 1 1 2 834 1 1 7 VAL O O -3.746 -8.880 2.579 1.00 . A A . 11 VAL O 1 1 2 835 1 1 8 PRO C C -2.782 -6.261 1.152 1.00 . A A . 12 PRO C 1 1 2 836 1 1 8 PRO CA C -1.954 -7.540 0.979 1.00 . A A . 12 PRO CA 1 1 2 837 1 1 8 PRO CB C -0.970 -7.398 -0.177 1.00 . A A . 12 PRO CB 1 1 2 838 1 1 8 PRO CD C -2.632 -9.016 -0.854 1.00 . A A . 12 PRO CD 1 1 2 839 1 1 8 PRO CG C -1.679 -7.966 -1.365 1.00 . A A . 12 PRO CG 1 1 2 840 1 1 8 PRO HA H -1.428 -7.780 1.888 1.00 . A A . 12 PRO HA 1 1 2 841 1 1 8 PRO HB2 H -0.734 -6.356 -0.344 1.00 . A A . 12 PRO HB2 1 1 2 842 1 1 8 PRO HB3 H -0.069 -7.958 0.026 1.00 . A A . 12 PRO HB3 1 1 2 843 1 1 8 PRO HD2 H -3.571 -8.967 -1.387 1.00 . A A . 12 PRO HD2 1 1 2 844 1 1 8 PRO HD3 H -2.195 -9.999 -0.944 1.00 . A A . 12 PRO HD3 1 1 2 845 1 1 8 PRO HG2 H -2.228 -7.187 -1.874 1.00 . A A . 12 PRO HG2 1 1 2 846 1 1 8 PRO HG3 H -0.965 -8.415 -2.041 1.00 . A A . 12 PRO HG3 1 1 2 847 1 1 8 PRO N N -2.825 -8.665 0.562 1.00 . A A . 12 PRO N 1 1 2 848 1 1 8 PRO O O -2.740 -5.617 2.180 1.00 . A A . 12 PRO O 1 1 2 849 1 1 9 LEU C C -5.814 -4.964 -0.147 1.00 . A A . 13 LEU C 1 1 2 850 1 1 9 LEU CA C -4.366 -4.658 0.257 1.00 . A A . 13 LEU CA 1 1 2 851 1 1 9 LEU CB C -3.727 -3.668 -0.720 1.00 . A A . 13 LEU CB 1 1 2 852 1 1 9 LEU CD1 C -1.258 -3.984 -0.966 1.00 . A A . 13 LEU CD1 1 1 2 853 1 1 9 LEU CD2 C -2.176 -1.737 -0.376 1.00 . A A . 13 LEU CD2 1 1 2 854 1 1 9 LEU CG C -2.353 -3.245 -0.192 1.00 . A A . 13 LEU CG 1 1 2 855 1 1 9 LEU H H -3.553 -6.426 -0.670 1.00 . A A . 13 LEU H 1 1 2 856 1 1 9 LEU HA H -4.327 -4.263 1.260 1.00 . A A . 13 LEU HA 1 1 2 857 1 1 9 LEU HB2 H -3.614 -4.138 -1.686 1.00 . A A . 13 LEU HB2 1 1 2 858 1 1 9 LEU HB3 H -4.360 -2.798 -0.815 1.00 . A A . 13 LEU HB3 1 1 2 859 1 1 9 LEU HD11 H -1.701 -4.766 -1.563 1.00 . A A . 13 LEU HD11 1 1 2 860 1 1 9 LEU HD12 H -0.555 -4.418 -0.270 1.00 . A A . 13 LEU HD12 1 1 2 861 1 1 9 LEU HD13 H -0.740 -3.288 -1.611 1.00 . A A . 13 LEU HD13 1 1 2 862 1 1 9 LEU HD21 H -2.865 -1.212 0.268 1.00 . A A . 13 LEU HD21 1 1 2 863 1 1 9 LEU HD22 H -2.372 -1.474 -1.405 1.00 . A A . 13 LEU HD22 1 1 2 864 1 1 9 LEU HD23 H -1.162 -1.460 -0.122 1.00 . A A . 13 LEU HD23 1 1 2 865 1 1 9 LEU HG H -2.279 -3.491 0.856 1.00 . A A . 13 LEU HG 1 1 2 866 1 1 9 LEU N N -3.535 -5.891 0.151 1.00 . A A . 13 LEU N 1 1 2 867 1 1 9 LEU O O -6.051 -5.771 -1.024 1.00 . A A . 13 LEU O 1 1 2 868 1 1 10 PRO C C -8.558 -3.912 -1.135 1.00 . A A . 14 PRO C 1 1 2 869 1 1 10 PRO CA C -8.180 -4.540 0.211 1.00 . A A . 14 PRO CA 1 1 2 870 1 1 10 PRO CB C -8.905 -3.846 1.360 1.00 . A A . 14 PRO CB 1 1 2 871 1 1 10 PRO CD C -6.556 -3.326 1.585 1.00 . A A . 14 PRO CD 1 1 2 872 1 1 10 PRO CG C -7.945 -2.809 1.854 1.00 . A A . 14 PRO CG 1 1 2 873 1 1 10 PRO HA H -8.409 -5.593 0.216 1.00 . A A . 14 PRO HA 1 1 2 874 1 1 10 PRO HB2 H -9.812 -3.379 1.007 1.00 . A A . 14 PRO HB2 1 1 2 875 1 1 10 PRO HB3 H -9.127 -4.553 2.146 1.00 . A A . 14 PRO HB3 1 1 2 876 1 1 10 PRO HD2 H -5.911 -2.526 1.253 1.00 . A A . 14 PRO HD2 1 1 2 877 1 1 10 PRO HD3 H -6.150 -3.797 2.468 1.00 . A A . 14 PRO HD3 1 1 2 878 1 1 10 PRO HG2 H -8.103 -1.882 1.324 1.00 . A A . 14 PRO HG2 1 1 2 879 1 1 10 PRO HG3 H -8.082 -2.654 2.914 1.00 . A A . 14 PRO HG3 1 1 2 880 1 1 10 PRO N N -6.745 -4.315 0.513 1.00 . A A . 14 PRO N 1 1 2 881 1 1 10 PRO O O -7.707 -3.558 -1.927 1.00 . A A . 14 PRO O 1 1 2 882 1 1 11 ALA C C -10.022 -1.671 -2.704 1.00 . A A . 15 ALA C 1 1 2 883 1 1 11 ALA CA C -10.267 -3.183 -2.698 1.00 . A A . 15 ALA CA 1 1 2 884 1 1 11 ALA CB C -11.762 -3.483 -2.785 1.00 . A A . 15 ALA CB 1 1 2 885 1 1 11 ALA H H -10.499 -4.076 -0.748 1.00 . A A . 15 ALA H 1 1 2 886 1 1 11 ALA HA H -9.749 -3.651 -3.519 1.00 . A A . 15 ALA HA 1 1 2 887 1 1 11 ALA HB1 H -12.001 -3.837 -3.777 1.00 . A A . 15 ALA HB1 1 1 2 888 1 1 11 ALA HB2 H -12.323 -2.584 -2.579 1.00 . A A . 15 ALA HB2 1 1 2 889 1 1 11 ALA HB3 H -12.021 -4.242 -2.060 1.00 . A A . 15 ALA HB3 1 1 2 890 1 1 11 ALA N N -9.830 -3.778 -1.400 1.00 . A A . 15 ALA N 1 1 2 891 1 1 11 ALA O O -9.713 -1.076 -1.691 1.00 . A A . 15 ALA O 1 1 2 892 1 1 12 GLY C C -8.457 0.747 -3.668 1.00 . A A . 16 GLY C 1 1 2 893 1 1 12 GLY CA C -9.934 0.425 -3.924 1.00 . A A . 16 GLY CA 1 1 2 894 1 1 12 GLY H H -10.408 -1.548 -4.648 1.00 . A A . 16 GLY H 1 1 2 895 1 1 12 GLY HA2 H -10.213 0.775 -4.907 1.00 . A A . 16 GLY HA2 1 1 2 896 1 1 12 GLY HA3 H -10.542 0.920 -3.182 1.00 . A A . 16 GLY HA3 1 1 2 897 1 1 12 GLY N N -10.159 -1.048 -3.843 1.00 . A A . 16 GLY N 1 1 2 898 1 1 12 GLY O O -8.089 1.889 -3.480 1.00 . A A . 16 GLY O 1 1 2 899 1 1 13 TRP C C -5.332 -0.252 -4.659 1.00 . A A . 17 TRP C 1 1 2 900 1 1 13 TRP CA C -6.160 0.018 -3.402 1.00 . A A . 17 TRP CA 1 1 2 901 1 1 13 TRP CB C -5.782 -0.964 -2.299 1.00 . A A . 17 TRP CB 1 1 2 902 1 1 13 TRP CD1 C -6.953 -0.338 -0.157 1.00 . A A . 17 TRP CD1 1 1 2 903 1 1 13 TRP CD2 C -4.914 0.585 -0.340 1.00 . A A . 17 TRP CD2 1 1 2 904 1 1 13 TRP CE2 C -5.440 1.019 0.898 1.00 . A A . 17 TRP CE2 1 1 2 905 1 1 13 TRP CE3 C -3.634 1.023 -0.709 1.00 . A A . 17 TRP CE3 1 1 2 906 1 1 13 TRP CG C -5.888 -0.276 -0.984 1.00 . A A . 17 TRP CG 1 1 2 907 1 1 13 TRP CH2 C -3.442 2.290 1.355 1.00 . A A . 17 TRP CH2 1 1 2 908 1 1 13 TRP CZ2 C -4.717 1.863 1.741 1.00 . A A . 17 TRP CZ2 1 1 2 909 1 1 13 TRP CZ3 C -2.905 1.870 0.132 1.00 . A A . 17 TRP CZ3 1 1 2 910 1 1 13 TRP H H -7.913 -1.162 -3.798 1.00 . A A . 17 TRP H 1 1 2 911 1 1 13 TRP HA H -6.014 1.029 -3.060 1.00 . A A . 17 TRP HA 1 1 2 912 1 1 13 TRP HB2 H -6.454 -1.808 -2.320 1.00 . A A . 17 TRP HB2 1 1 2 913 1 1 13 TRP HB3 H -4.768 -1.303 -2.450 1.00 . A A . 17 TRP HB3 1 1 2 914 1 1 13 TRP HD1 H -7.859 -0.897 -0.342 1.00 . A A . 17 TRP HD1 1 1 2 915 1 1 13 TRP HE1 H -7.298 0.552 1.723 1.00 . A A . 17 TRP HE1 1 1 2 916 1 1 13 TRP HE3 H -3.209 0.706 -1.649 1.00 . A A . 17 TRP HE3 1 1 2 917 1 1 13 TRP HH2 H -2.870 2.942 1.997 1.00 . A A . 17 TRP HH2 1 1 2 918 1 1 13 TRP HZ2 H -5.137 2.184 2.683 1.00 . A A . 17 TRP HZ2 1 1 2 919 1 1 13 TRP HZ3 H -1.926 2.201 -0.162 1.00 . A A . 17 TRP HZ3 1 1 2 920 1 1 13 TRP N N -7.605 -0.245 -3.653 1.00 . A A . 17 TRP N 1 1 2 921 1 1 13 TRP NE1 N -6.689 0.429 0.966 1.00 . A A . 17 TRP NE1 1 1 2 922 1 1 13 TRP O O -5.629 -1.144 -5.428 1.00 . A A . 17 TRP O 1 1 2 923 1 1 14 GLU C C -1.965 0.326 -5.744 1.00 . A A . 18 GLU C 1 1 2 924 1 1 14 GLU CA C -3.454 0.283 -6.088 1.00 . A A . 18 GLU CA 1 1 2 925 1 1 14 GLU CB C -3.791 1.433 -7.036 1.00 . A A . 18 GLU CB 1 1 2 926 1 1 14 GLU CD C -6.048 0.641 -7.759 1.00 . A A . 18 GLU CD 1 1 2 927 1 1 14 GLU CG C -4.610 0.903 -8.213 1.00 . A A . 18 GLU CG 1 1 2 928 1 1 14 GLU H H -4.067 1.229 -4.245 1.00 . A A . 18 GLU H 1 1 2 929 1 1 14 GLU HA H -3.708 -0.657 -6.550 1.00 . A A . 18 GLU HA 1 1 2 930 1 1 14 GLU HB2 H -4.357 2.184 -6.510 1.00 . A A . 18 GLU HB2 1 1 2 931 1 1 14 GLU HB3 H -2.876 1.870 -7.407 1.00 . A A . 18 GLU HB3 1 1 2 932 1 1 14 GLU HG2 H -4.612 1.634 -9.008 1.00 . A A . 18 GLU HG2 1 1 2 933 1 1 14 GLU HG3 H -4.172 -0.016 -8.572 1.00 . A A . 18 GLU HG3 1 1 2 934 1 1 14 GLU N N -4.293 0.511 -4.876 1.00 . A A . 18 GLU N 1 1 2 935 1 1 14 GLU O O -1.368 1.386 -5.681 1.00 . A A . 18 GLU O 1 1 2 936 1 1 14 GLU OE1 O -6.521 1.371 -6.903 1.00 . A A . 18 GLU OE1 1 1 2 937 1 1 14 GLU OE2 O -6.651 -0.286 -8.274 1.00 . A A . 18 GLU OE2 1 1 2 938 1 1 15 MET C C 0.846 -0.350 -6.512 1.00 . A A . 19 MET C 1 1 2 939 1 1 15 MET CA C 0.109 -0.796 -5.256 1.00 . A A . 19 MET CA 1 1 2 940 1 1 15 MET CB C 0.503 -2.224 -4.890 1.00 . A A . 19 MET CB 1 1 2 941 1 1 15 MET CE C -1.743 -4.169 -4.322 1.00 . A A . 19 MET CE 1 1 2 942 1 1 15 MET CG C 0.137 -3.186 -6.028 1.00 . A A . 19 MET CG 1 1 2 943 1 1 15 MET H H -1.823 -1.659 -5.620 1.00 . A A . 19 MET H 1 1 2 944 1 1 15 MET HA H 0.321 -0.127 -4.437 1.00 . A A . 19 MET HA 1 1 2 945 1 1 15 MET HB2 H 1.565 -2.253 -4.736 1.00 . A A . 19 MET HB2 1 1 2 946 1 1 15 MET HB3 H 0.007 -2.519 -3.982 1.00 . A A . 19 MET HB3 1 1 2 947 1 1 15 MET HE1 H -1.357 -3.774 -3.392 1.00 . A A . 19 MET HE1 1 1 2 948 1 1 15 MET HE2 H -2.425 -4.977 -4.112 1.00 . A A . 19 MET HE2 1 1 2 949 1 1 15 MET HE3 H -2.268 -3.390 -4.859 1.00 . A A . 19 MET HE3 1 1 2 950 1 1 15 MET HG2 H -0.669 -2.772 -6.611 1.00 . A A . 19 MET HG2 1 1 2 951 1 1 15 MET HG3 H 0.999 -3.334 -6.661 1.00 . A A . 19 MET HG3 1 1 2 952 1 1 15 MET N N -1.344 -0.811 -5.550 1.00 . A A . 19 MET N 1 1 2 953 1 1 15 MET O O 0.711 -0.932 -7.569 1.00 . A A . 19 MET O 1 1 2 954 1 1 15 MET SD S -0.372 -4.779 -5.332 1.00 . A A . 19 MET SD 1 1 2 955 1 1 16 ALA C C 3.643 1.853 -7.077 1.00 . A A . 20 ALA C 1 1 2 956 1 1 16 ALA CA C 2.359 1.190 -7.581 1.00 . A A . 20 ALA CA 1 1 2 957 1 1 16 ALA CB C 1.386 2.180 -8.237 1.00 . A A . 20 ALA CB 1 1 2 958 1 1 16 ALA H H 1.701 1.134 -5.538 1.00 . A A . 20 ALA H 1 1 2 959 1 1 16 ALA HA H 2.588 0.382 -8.261 1.00 . A A . 20 ALA HA 1 1 2 960 1 1 16 ALA HB1 H 0.788 1.661 -8.971 1.00 . A A . 20 ALA HB1 1 1 2 961 1 1 16 ALA HB2 H 1.933 2.972 -8.718 1.00 . A A . 20 ALA HB2 1 1 2 962 1 1 16 ALA HB3 H 0.737 2.598 -7.481 1.00 . A A . 20 ALA HB3 1 1 2 963 1 1 16 ALA N N 1.614 0.681 -6.403 1.00 . A A . 20 ALA N 1 1 2 964 1 1 16 ALA O O 4.158 1.460 -6.048 1.00 . A A . 20 ALA O 1 1 2 965 1 1 17 LYS C C 5.385 4.966 -7.245 1.00 . A A . 21 LYS C 1 1 2 966 1 1 17 LYS CA C 5.438 3.444 -7.237 1.00 . A A . 21 LYS CA 1 1 2 967 1 1 17 LYS CB C 6.548 2.935 -8.156 1.00 . A A . 21 LYS CB 1 1 2 968 1 1 17 LYS CD C 8.131 1.051 -8.587 1.00 . A A . 21 LYS CD 1 1 2 969 1 1 17 LYS CE C 8.066 -0.477 -8.585 1.00 . A A . 21 LYS CE 1 1 2 970 1 1 17 LYS CG C 7.087 1.608 -7.617 1.00 . A A . 21 LYS CG 1 1 2 971 1 1 17 LYS H H 3.783 3.149 -8.590 1.00 . A A . 21 LYS H 1 1 2 972 1 1 17 LYS HA H 5.610 3.106 -6.234 1.00 . A A . 21 LYS HA 1 1 2 973 1 1 17 LYS HB2 H 6.152 2.786 -9.150 1.00 . A A . 21 LYS HB2 1 1 2 974 1 1 17 LYS HB3 H 7.348 3.660 -8.191 1.00 . A A . 21 LYS HB3 1 1 2 975 1 1 17 LYS HD2 H 7.929 1.418 -9.583 1.00 . A A . 21 LYS HD2 1 1 2 976 1 1 17 LYS HD3 H 9.116 1.370 -8.279 1.00 . A A . 21 LYS HD3 1 1 2 977 1 1 17 LYS HE2 H 8.263 -0.861 -7.594 1.00 . A A . 21 LYS HE2 1 1 2 978 1 1 17 LYS HE3 H 7.098 -0.814 -8.932 1.00 . A A . 21 LYS HE3 1 1 2 979 1 1 17 LYS HG2 H 7.543 1.770 -6.652 1.00 . A A . 21 LYS HG2 1 1 2 980 1 1 17 LYS HG3 H 6.276 0.903 -7.518 1.00 . A A . 21 LYS HG3 1 1 2 981 1 1 17 LYS HZ1 H 9.081 -1.937 -9.670 1.00 . A A . 21 LYS HZ1 1 1 2 982 1 1 17 LYS HZ2 H 10.064 -0.658 -9.138 1.00 . A A . 21 LYS HZ2 1 1 2 983 1 1 17 LYS HZ3 H 9.003 -0.429 -10.444 1.00 . A A . 21 LYS HZ3 1 1 2 984 1 1 17 LYS N N 4.183 2.831 -7.757 1.00 . A A . 21 LYS N 1 1 2 985 1 1 17 LYS NZ N 9.134 -0.907 -9.530 1.00 . A A . 21 LYS NZ 1 1 2 986 1 1 17 LYS O O 4.636 5.578 -7.980 1.00 . A A . 21 LYS O 1 1 2 987 1 1 18 THR C C 7.636 7.558 -6.098 1.00 . A A . 22 THR C 1 1 2 988 1 1 18 THR CA C 6.212 7.061 -6.344 1.00 . A A . 22 THR CA 1 1 2 989 1 1 18 THR CB C 5.322 7.417 -5.154 1.00 . A A . 22 THR CB 1 1 2 990 1 1 18 THR CG2 C 5.883 6.777 -3.883 1.00 . A A . 22 THR CG2 1 1 2 991 1 1 18 THR H H 6.782 5.041 -5.832 1.00 . A A . 22 THR H 1 1 2 992 1 1 18 THR HA H 5.811 7.490 -7.247 1.00 . A A . 22 THR HA 1 1 2 993 1 1 18 THR HB H 4.326 7.053 -5.328 1.00 . A A . 22 THR HB 1 1 2 994 1 1 18 THR HG1 H 4.392 9.126 -5.175 1.00 . A A . 22 THR HG1 1 1 2 995 1 1 18 THR HG21 H 6.287 5.801 -4.114 1.00 . A A . 22 THR HG21 1 1 2 996 1 1 18 THR HG22 H 5.098 6.673 -3.148 1.00 . A A . 22 THR HG22 1 1 2 997 1 1 18 THR HG23 H 6.667 7.403 -3.484 1.00 . A A . 22 THR HG23 1 1 2 998 1 1 18 THR N N 6.189 5.573 -6.415 1.00 . A A . 22 THR N 1 1 2 999 1 1 18 THR O O 8.597 6.851 -6.315 1.00 . A A . 22 THR O 1 1 2 1000 1 1 18 THR OG1 O 5.288 8.830 -5.000 1.00 . A A . 22 THR OG1 1 1 2 1001 1 1 19 SER C C 10.075 9.089 -6.540 1.00 . A A . 23 SER C 1 1 2 1002 1 1 19 SER CA C 9.121 9.343 -5.361 1.00 . A A . 23 SER CA 1 1 2 1003 1 1 19 SER CB C 9.600 8.629 -4.095 1.00 . A A . 23 SER CB 1 1 2 1004 1 1 19 SER H H 6.965 9.313 -5.468 1.00 . A A . 23 SER H 1 1 2 1005 1 1 19 SER HA H 9.043 10.402 -5.172 1.00 . A A . 23 SER HA 1 1 2 1006 1 1 19 SER HB2 H 9.117 7.665 -4.021 1.00 . A A . 23 SER HB2 1 1 2 1007 1 1 19 SER HB3 H 10.670 8.492 -4.142 1.00 . A A . 23 SER HB3 1 1 2 1008 1 1 19 SER HG H 9.842 9.138 -2.235 1.00 . A A . 23 SER HG 1 1 2 1009 1 1 19 SER N N 7.766 8.772 -5.638 1.00 . A A . 23 SER N 1 1 2 1010 1 1 19 SER O O 10.145 9.870 -7.466 1.00 . A A . 23 SER O 1 1 2 1011 1 1 19 SER OG O 9.271 9.412 -2.957 1.00 . A A . 23 SER OG 1 1 2 1012 1 1 20 SER C C 11.976 6.215 -7.779 1.00 . A A . 24 SER C 1 1 2 1013 1 1 20 SER CA C 11.748 7.721 -7.646 1.00 . A A . 24 SER CA 1 1 2 1014 1 1 20 SER CB C 13.049 8.430 -7.269 1.00 . A A . 24 SER CB 1 1 2 1015 1 1 20 SER H H 10.747 7.377 -5.772 1.00 . A A . 24 SER H 1 1 2 1016 1 1 20 SER HA H 11.364 8.122 -8.562 1.00 . A A . 24 SER HA 1 1 2 1017 1 1 20 SER HB2 H 12.835 9.454 -6.999 1.00 . A A . 24 SER HB2 1 1 2 1018 1 1 20 SER HB3 H 13.505 7.924 -6.430 1.00 . A A . 24 SER HB3 1 1 2 1019 1 1 20 SER HG H 14.227 7.502 -8.506 1.00 . A A . 24 SER HG 1 1 2 1020 1 1 20 SER N N 10.811 8.004 -6.520 1.00 . A A . 24 SER N 1 1 2 1021 1 1 20 SER O O 12.004 5.672 -8.866 1.00 . A A . 24 SER O 1 1 2 1022 1 1 20 SER OG O 13.939 8.408 -8.375 1.00 . A A . 24 SER OG 1 1 2 1023 1 1 21 GLY C C 11.778 3.422 -5.470 1.00 . A A . 25 GLY C 1 1 2 1024 1 1 21 GLY CA C 12.362 4.070 -6.728 1.00 . A A . 25 GLY CA 1 1 2 1025 1 1 21 GLY H H 12.108 6.007 -5.822 1.00 . A A . 25 GLY H 1 1 2 1026 1 1 21 GLY HA2 H 11.877 3.660 -7.603 1.00 . A A . 25 GLY HA2 1 1 2 1027 1 1 21 GLY HA3 H 13.422 3.870 -6.777 1.00 . A A . 25 GLY HA3 1 1 2 1028 1 1 21 GLY N N 12.137 5.542 -6.680 1.00 . A A . 25 GLY N 1 1 2 1029 1 1 21 GLY O O 12.498 2.988 -4.593 1.00 . A A . 25 GLY O 1 1 2 1030 1 1 22 GLN C C 8.375 2.421 -4.450 1.00 . A A . 26 GLN C 1 1 2 1031 1 1 22 GLN CA C 9.849 2.736 -4.174 1.00 . A A . 26 GLN CA 1 1 2 1032 1 1 22 GLN CB C 9.974 3.789 -3.072 1.00 . A A . 26 GLN CB 1 1 2 1033 1 1 22 GLN CD C 11.639 3.874 -1.212 1.00 . A A . 26 GLN CD 1 1 2 1034 1 1 22 GLN CG C 10.434 3.120 -1.775 1.00 . A A . 26 GLN CG 1 1 2 1035 1 1 22 GLN H H 9.915 3.713 -6.094 1.00 . A A . 26 GLN H 1 1 2 1036 1 1 22 GLN HA H 10.378 1.842 -3.889 1.00 . A A . 26 GLN HA 1 1 2 1037 1 1 22 GLN HB2 H 10.697 4.535 -3.369 1.00 . A A . 26 GLN HB2 1 1 2 1038 1 1 22 GLN HB3 H 9.016 4.260 -2.914 1.00 . A A . 26 GLN HB3 1 1 2 1039 1 1 22 GLN HE21 H 11.029 3.727 0.673 1.00 . A A . 26 GLN HE21 1 1 2 1040 1 1 22 GLN HE22 H 12.498 4.547 0.447 1.00 . A A . 26 GLN HE22 1 1 2 1041 1 1 22 GLN HG2 H 9.628 3.139 -1.055 1.00 . A A . 26 GLN HG2 1 1 2 1042 1 1 22 GLN HG3 H 10.711 2.095 -1.977 1.00 . A A . 26 GLN HG3 1 1 2 1043 1 1 22 GLN N N 10.478 3.356 -5.375 1.00 . A A . 26 GLN N 1 1 2 1044 1 1 22 GLN NE2 N 11.730 4.065 0.076 1.00 . A A . 26 GLN NE2 1 1 2 1045 1 1 22 GLN O O 7.639 3.250 -4.964 1.00 . A A . 26 GLN O 1 1 2 1046 1 1 22 GLN OE1 O 12.508 4.293 -1.950 1.00 . A A . 26 GLN OE1 1 1 2 1047 1 1 23 ARG C C 5.616 1.478 -3.301 1.00 . A A . 27 ARG C 1 1 2 1048 1 1 23 ARG CA C 6.514 0.873 -4.364 1.00 . A A . 27 ARG CA 1 1 2 1049 1 1 23 ARG CB C 6.415 -0.653 -4.289 1.00 . A A . 27 ARG CB 1 1 2 1050 1 1 23 ARG CD C 4.988 -2.315 -5.484 1.00 . A A . 27 ARG CD 1 1 2 1051 1 1 23 ARG CG C 6.013 -1.192 -5.659 1.00 . A A . 27 ARG CG 1 1 2 1052 1 1 23 ARG CZ C 6.448 -4.012 -6.460 1.00 . A A . 27 ARG CZ 1 1 2 1053 1 1 23 ARG H H 8.546 0.580 -3.703 1.00 . A A . 27 ARG H 1 1 2 1054 1 1 23 ARG HA H 6.211 1.210 -5.343 1.00 . A A . 27 ARG HA 1 1 2 1055 1 1 23 ARG HB2 H 7.357 -1.073 -3.990 1.00 . A A . 27 ARG HB2 1 1 2 1056 1 1 23 ARG HB3 H 5.660 -0.928 -3.566 1.00 . A A . 27 ARG HB3 1 1 2 1057 1 1 23 ARG HD2 H 5.074 -2.754 -4.503 1.00 . A A . 27 ARG HD2 1 1 2 1058 1 1 23 ARG HD3 H 3.988 -1.938 -5.643 1.00 . A A . 27 ARG HD3 1 1 2 1059 1 1 23 ARG HE H 4.728 -3.459 -7.289 1.00 . A A . 27 ARG HE 1 1 2 1060 1 1 23 ARG HG2 H 5.578 -0.393 -6.241 1.00 . A A . 27 ARG HG2 1 1 2 1061 1 1 23 ARG HG3 H 6.885 -1.578 -6.165 1.00 . A A . 27 ARG HG3 1 1 2 1062 1 1 23 ARG HH11 H 7.084 -3.184 -4.742 1.00 . A A . 27 ARG HH11 1 1 2 1063 1 1 23 ARG HH12 H 8.125 -4.386 -5.425 1.00 . A A . 27 ARG HH12 1 1 2 1064 1 1 23 ARG HH21 H 6.094 -5.014 -8.157 1.00 . A A . 27 ARG HH21 1 1 2 1065 1 1 23 ARG HH22 H 7.571 -5.415 -7.344 1.00 . A A . 27 ARG HH22 1 1 2 1066 1 1 23 ARG N N 7.938 1.232 -4.116 1.00 . A A . 27 ARG N 1 1 2 1067 1 1 23 ARG NE N 5.336 -3.318 -6.535 1.00 . A A . 27 ARG NE 1 1 2 1068 1 1 23 ARG NH1 N 7.283 -3.848 -5.464 1.00 . A A . 27 ARG NH1 1 1 2 1069 1 1 23 ARG NH2 N 6.726 -4.882 -7.393 1.00 . A A . 27 ARG NH2 1 1 2 1070 1 1 23 ARG O O 5.684 1.123 -2.140 1.00 . A A . 27 ARG O 1 1 2 1071 1 1 24 TYR C C 2.427 2.359 -2.979 1.00 . A A . 28 TYR C 1 1 2 1072 1 1 24 TYR CA C 3.802 2.922 -2.710 1.00 . A A . 28 TYR CA 1 1 2 1073 1 1 24 TYR CB C 3.871 4.458 -2.847 1.00 . A A . 28 TYR CB 1 1 2 1074 1 1 24 TYR CD1 C 2.700 4.251 -5.107 1.00 . A A . 28 TYR CD1 1 1 2 1075 1 1 24 TYR CD2 C 2.521 6.326 -3.873 1.00 . A A . 28 TYR CD2 1 1 2 1076 1 1 24 TYR CE1 C 1.941 4.802 -6.140 1.00 . A A . 28 TYR CE1 1 1 2 1077 1 1 24 TYR CE2 C 1.752 6.869 -4.904 1.00 . A A . 28 TYR CE2 1 1 2 1078 1 1 24 TYR CG C 2.999 5.011 -3.967 1.00 . A A . 28 TYR CG 1 1 2 1079 1 1 24 TYR CZ C 1.465 6.110 -6.038 1.00 . A A . 28 TYR CZ 1 1 2 1080 1 1 24 TYR H H 4.682 2.579 -4.641 1.00 . A A . 28 TYR H 1 1 2 1081 1 1 24 TYR HA H 4.102 2.631 -1.716 1.00 . A A . 28 TYR HA 1 1 2 1082 1 1 24 TYR HB2 H 3.558 4.902 -1.913 1.00 . A A . 28 TYR HB2 1 1 2 1083 1 1 24 TYR HB3 H 4.896 4.737 -3.036 1.00 . A A . 28 TYR HB3 1 1 2 1084 1 1 24 TYR HD1 H 3.045 3.241 -5.187 1.00 . A A . 28 TYR HD1 1 1 2 1085 1 1 24 TYR HD2 H 2.733 6.917 -2.994 1.00 . A A . 28 TYR HD2 1 1 2 1086 1 1 24 TYR HE1 H 1.715 4.211 -7.012 1.00 . A A . 28 TYR HE1 1 1 2 1087 1 1 24 TYR HE2 H 1.382 7.876 -4.824 1.00 . A A . 28 TYR HE2 1 1 2 1088 1 1 24 TYR HH H 1.255 6.607 -7.867 1.00 . A A . 28 TYR HH 1 1 2 1089 1 1 24 TYR N N 4.742 2.344 -3.695 1.00 . A A . 28 TYR N 1 1 2 1090 1 1 24 TYR O O 2.209 1.652 -3.945 1.00 . A A . 28 TYR O 1 1 2 1091 1 1 24 TYR OH O 0.728 6.655 -7.066 1.00 . A A . 28 TYR OH 1 1 2 1092 1 1 25 PHE C C -0.850 3.202 -2.368 1.00 . A A . 29 PHE C 1 1 2 1093 1 1 25 PHE CA C 0.164 2.075 -2.312 1.00 . A A . 29 PHE CA 1 1 2 1094 1 1 25 PHE CB C -0.003 1.123 -1.133 1.00 . A A . 29 PHE CB 1 1 2 1095 1 1 25 PHE CD1 C 2.365 0.195 -1.082 1.00 . A A . 29 PHE CD1 1 1 2 1096 1 1 25 PHE CD2 C 0.563 -1.215 -1.875 1.00 . A A . 29 PHE CD2 1 1 2 1097 1 1 25 PHE CE1 C 3.280 -0.838 -1.337 1.00 . A A . 29 PHE CE1 1 1 2 1098 1 1 25 PHE CE2 C 1.478 -2.242 -2.133 1.00 . A A . 29 PHE CE2 1 1 2 1099 1 1 25 PHE CG C 0.998 0.002 -1.351 1.00 . A A . 29 PHE CG 1 1 2 1100 1 1 25 PHE CZ C 2.835 -2.055 -1.864 1.00 . A A . 29 PHE CZ 1 1 2 1101 1 1 25 PHE H H 1.718 3.186 -1.343 1.00 . A A . 29 PHE H 1 1 2 1102 1 1 25 PHE HA H 0.130 1.514 -3.234 1.00 . A A . 29 PHE HA 1 1 2 1103 1 1 25 PHE HB2 H 0.201 1.638 -0.204 1.00 . A A . 29 PHE HB2 1 1 2 1104 1 1 25 PHE HB3 H -1.006 0.724 -1.122 1.00 . A A . 29 PHE HB3 1 1 2 1105 1 1 25 PHE HD1 H 2.717 1.136 -0.678 1.00 . A A . 29 PHE HD1 1 1 2 1106 1 1 25 PHE HD2 H -0.482 -1.360 -2.083 1.00 . A A . 29 PHE HD2 1 1 2 1107 1 1 25 PHE HE1 H 4.329 -0.690 -1.136 1.00 . A A . 29 PHE HE1 1 1 2 1108 1 1 25 PHE HE2 H 1.135 -3.181 -2.545 1.00 . A A . 29 PHE HE2 1 1 2 1109 1 1 25 PHE HZ H 3.540 -2.846 -2.071 1.00 . A A . 29 PHE HZ 1 1 2 1110 1 1 25 PHE N N 1.512 2.631 -2.122 1.00 . A A . 29 PHE N 1 1 2 1111 1 1 25 PHE O O -1.177 3.836 -1.383 1.00 . A A . 29 PHE O 1 1 2 1112 1 1 26 LEU C C -3.673 4.133 -3.334 1.00 . A A . 30 LEU C 1 1 2 1113 1 1 26 LEU CA C -2.277 4.564 -3.779 1.00 . A A . 30 LEU CA 1 1 2 1114 1 1 26 LEU CB C -2.200 4.792 -5.296 1.00 . A A . 30 LEU CB 1 1 2 1115 1 1 26 LEU CD1 C -1.162 7.040 -4.834 1.00 . A A . 30 LEU CD1 1 1 2 1116 1 1 26 LEU CD2 C -1.897 6.439 -7.127 1.00 . A A . 30 LEU CD2 1 1 2 1117 1 1 26 LEU CG C -2.215 6.285 -5.644 1.00 . A A . 30 LEU CG 1 1 2 1118 1 1 26 LEU H H -0.990 2.938 -4.323 1.00 . A A . 30 LEU H 1 1 2 1119 1 1 26 LEU HA H -1.973 5.449 -3.250 1.00 . A A . 30 LEU HA 1 1 2 1120 1 1 26 LEU HB2 H -1.287 4.355 -5.670 1.00 . A A . 30 LEU HB2 1 1 2 1121 1 1 26 LEU HB3 H -3.034 4.313 -5.771 1.00 . A A . 30 LEU HB3 1 1 2 1122 1 1 26 LEU HD11 H -0.588 6.343 -4.243 1.00 . A A . 30 LEU HD11 1 1 2 1123 1 1 26 LEU HD12 H -1.655 7.744 -4.184 1.00 . A A . 30 LEU HD12 1 1 2 1124 1 1 26 LEU HD13 H -0.502 7.573 -5.504 1.00 . A A . 30 LEU HD13 1 1 2 1125 1 1 26 LEU HD21 H -2.803 6.351 -7.703 1.00 . A A . 30 LEU HD21 1 1 2 1126 1 1 26 LEU HD22 H -1.201 5.665 -7.424 1.00 . A A . 30 LEU HD22 1 1 2 1127 1 1 26 LEU HD23 H -1.449 7.407 -7.298 1.00 . A A . 30 LEU HD23 1 1 2 1128 1 1 26 LEU HG H -3.191 6.695 -5.438 1.00 . A A . 30 LEU HG 1 1 2 1129 1 1 26 LEU N N -1.308 3.466 -3.556 1.00 . A A . 30 LEU N 1 1 2 1130 1 1 26 LEU O O -4.287 3.256 -3.914 1.00 . A A . 30 LEU O 1 1 2 1131 1 1 27 ASN C C -6.579 5.255 -2.449 1.00 . A A . 31 ASN C 1 1 2 1132 1 1 27 ASN CA C -5.517 4.388 -1.775 1.00 . A A . 31 ASN CA 1 1 2 1133 1 1 27 ASN CB C -5.452 4.689 -0.277 1.00 . A A . 31 ASN CB 1 1 2 1134 1 1 27 ASN CG C -6.764 4.287 0.386 1.00 . A A . 31 ASN CG 1 1 2 1135 1 1 27 ASN H H -3.643 5.438 -1.842 1.00 . A A . 31 ASN H 1 1 2 1136 1 1 27 ASN HA H -5.722 3.341 -1.935 1.00 . A A . 31 ASN HA 1 1 2 1137 1 1 27 ASN HB2 H -4.649 4.127 0.171 1.00 . A A . 31 ASN HB2 1 1 2 1138 1 1 27 ASN HB3 H -5.282 5.745 -0.130 1.00 . A A . 31 ASN HB3 1 1 2 1139 1 1 27 ASN HD21 H -5.911 3.940 2.141 1.00 . A A . 31 ASN HD21 1 1 2 1140 1 1 27 ASN HD22 H -7.579 3.670 2.078 1.00 . A A . 31 ASN HD22 1 1 2 1141 1 1 27 ASN N N -4.168 4.742 -2.291 1.00 . A A . 31 ASN N 1 1 2 1142 1 1 27 ASN ND2 N -6.752 3.939 1.640 1.00 . A A . 31 ASN ND2 1 1 2 1143 1 1 27 ASN O O -6.673 6.443 -2.198 1.00 . A A . 31 ASN O 1 1 2 1144 1 1 27 ASN OD1 O -7.806 4.291 -0.239 1.00 . A A . 31 ASN OD1 1 1 2 1145 1 1 28 HIS C C -9.680 5.588 -3.106 1.00 . A A . 32 HIS C 1 1 2 1146 1 1 28 HIS CA C -8.441 5.447 -3.999 1.00 . A A . 32 HIS CA 1 1 2 1147 1 1 28 HIS CB C -8.773 4.630 -5.249 1.00 . A A . 32 HIS CB 1 1 2 1148 1 1 28 HIS CD2 C -6.472 4.548 -6.517 1.00 . A A . 32 HIS CD2 1 1 2 1149 1 1 28 HIS CE1 C -6.984 5.836 -8.182 1.00 . A A . 32 HIS CE1 1 1 2 1150 1 1 28 HIS CG C -7.775 4.941 -6.330 1.00 . A A . 32 HIS CG 1 1 2 1151 1 1 28 HIS H H -7.278 3.709 -3.483 1.00 . A A . 32 HIS H 1 1 2 1152 1 1 28 HIS HA H -8.070 6.418 -4.284 1.00 . A A . 32 HIS HA 1 1 2 1153 1 1 28 HIS HB2 H -8.732 3.577 -5.012 1.00 . A A . 32 HIS HB2 1 1 2 1154 1 1 28 HIS HB3 H -9.765 4.884 -5.590 1.00 . A A . 32 HIS HB3 1 1 2 1155 1 1 28 HIS HD1 H -8.937 6.207 -7.567 1.00 . A A . 32 HIS HD1 1 1 2 1156 1 1 28 HIS HD2 H -5.918 3.898 -5.856 1.00 . A A . 32 HIS HD2 1 1 2 1157 1 1 28 HIS HE1 H -6.927 6.409 -9.095 1.00 . A A . 32 HIS HE1 1 1 2 1158 1 1 28 HIS N N -7.377 4.667 -3.301 1.00 . A A . 32 HIS N 1 1 2 1159 1 1 28 HIS ND1 N -8.080 5.762 -7.404 1.00 . A A . 32 HIS ND1 1 1 2 1160 1 1 28 HIS NE2 N -5.975 5.115 -7.687 1.00 . A A . 32 HIS NE2 1 1 2 1161 1 1 28 HIS O O -10.614 6.290 -3.438 1.00 . A A . 32 HIS O 1 1 2 1162 1 1 29 ILE C C -10.659 6.286 -0.172 1.00 . A A . 33 ILE C 1 1 2 1163 1 1 29 ILE CA C -10.876 5.069 -1.056 1.00 . A A . 33 ILE CA 1 1 2 1164 1 1 29 ILE CB C -10.950 3.799 -0.173 1.00 . A A . 33 ILE CB 1 1 2 1165 1 1 29 ILE CD1 C -10.615 1.288 -0.116 1.00 . A A . 33 ILE CD1 1 1 2 1166 1 1 29 ILE CG1 C -10.280 2.589 -0.859 1.00 . A A . 33 ILE CG1 1 1 2 1167 1 1 29 ILE CG2 C -12.427 3.488 0.101 1.00 . A A . 33 ILE CG2 1 1 2 1168 1 1 29 ILE H H -8.928 4.398 -1.704 1.00 . A A . 33 ILE H 1 1 2 1169 1 1 29 ILE HA H -11.783 5.178 -1.630 1.00 . A A . 33 ILE HA 1 1 2 1170 1 1 29 ILE HB H -10.454 3.998 0.768 1.00 . A A . 33 ILE HB 1 1 2 1171 1 1 29 ILE HD11 H -11.088 1.523 0.826 1.00 . A A . 33 ILE HD11 1 1 2 1172 1 1 29 ILE HD12 H -9.706 0.733 0.066 1.00 . A A . 33 ILE HD12 1 1 2 1173 1 1 29 ILE HD13 H -11.287 0.692 -0.719 1.00 . A A . 33 ILE HD13 1 1 2 1174 1 1 29 ILE HG12 H -10.622 2.524 -1.878 1.00 . A A . 33 ILE HG12 1 1 2 1175 1 1 29 ILE HG13 H -9.209 2.731 -0.849 1.00 . A A . 33 ILE HG13 1 1 2 1176 1 1 29 ILE HG21 H -12.931 3.289 -0.833 1.00 . A A . 33 ILE HG21 1 1 2 1177 1 1 29 ILE HG22 H -12.890 4.337 0.585 1.00 . A A . 33 ILE HG22 1 1 2 1178 1 1 29 ILE HG23 H -12.500 2.624 0.742 1.00 . A A . 33 ILE HG23 1 1 2 1179 1 1 29 ILE N N -9.693 4.943 -1.967 1.00 . A A . 33 ILE N 1 1 2 1180 1 1 29 ILE O O -11.402 7.245 -0.205 1.00 . A A . 33 ILE O 1 1 2 1181 1 1 30 ASP C C -8.414 8.414 0.760 1.00 . A A . 34 ASP C 1 1 2 1182 1 1 30 ASP CA C -9.311 7.406 1.495 1.00 . A A . 34 ASP CA 1 1 2 1183 1 1 30 ASP CB C -8.571 6.802 2.690 1.00 . A A . 34 ASP CB 1 1 2 1184 1 1 30 ASP CG C -9.347 7.100 3.974 1.00 . A A . 34 ASP CG 1 1 2 1185 1 1 30 ASP H H -9.031 5.461 0.598 1.00 . A A . 34 ASP H 1 1 2 1186 1 1 30 ASP HA H -10.221 7.880 1.827 1.00 . A A . 34 ASP HA 1 1 2 1187 1 1 30 ASP HB2 H -8.488 5.734 2.559 1.00 . A A . 34 ASP HB2 1 1 2 1188 1 1 30 ASP HB3 H -7.584 7.235 2.756 1.00 . A A . 34 ASP HB3 1 1 2 1189 1 1 30 ASP N N -9.620 6.250 0.609 1.00 . A A . 34 ASP N 1 1 2 1190 1 1 30 ASP O O -7.933 9.366 1.340 1.00 . A A . 34 ASP O 1 1 2 1191 1 1 30 ASP OD1 O -9.709 8.248 4.171 1.00 . A A . 34 ASP OD1 1 1 2 1192 1 1 30 ASP OD2 O -9.567 6.175 4.738 1.00 . A A . 34 ASP OD2 1 1 2 1193 1 1 31 GLN C C -6.001 9.389 -0.547 1.00 . A A . 35 GLN C 1 1 2 1194 1 1 31 GLN CA C -7.321 9.158 -1.284 1.00 . A A . 35 GLN CA 1 1 2 1195 1 1 31 GLN CB C -8.126 10.456 -1.362 1.00 . A A . 35 GLN CB 1 1 2 1196 1 1 31 GLN CD C -10.255 11.487 -2.167 1.00 . A A . 35 GLN CD 1 1 2 1197 1 1 31 GLN CG C -9.495 10.171 -1.986 1.00 . A A . 35 GLN CG 1 1 2 1198 1 1 31 GLN H H -8.579 7.441 -0.971 1.00 . A A . 35 GLN H 1 1 2 1199 1 1 31 GLN HA H -7.137 8.778 -2.276 1.00 . A A . 35 GLN HA 1 1 2 1200 1 1 31 GLN HB2 H -8.258 10.858 -0.369 1.00 . A A . 35 GLN HB2 1 1 2 1201 1 1 31 GLN HB3 H -7.594 11.171 -1.972 1.00 . A A . 35 GLN HB3 1 1 2 1202 1 1 31 GLN HE21 H -10.568 11.737 -0.221 1.00 . A A . 35 GLN HE21 1 1 2 1203 1 1 31 GLN HE22 H -11.202 12.954 -1.221 1.00 . A A . 35 GLN HE22 1 1 2 1204 1 1 31 GLN HG2 H -9.361 9.698 -2.947 1.00 . A A . 35 GLN HG2 1 1 2 1205 1 1 31 GLN HG3 H -10.057 9.517 -1.336 1.00 . A A . 35 GLN HG3 1 1 2 1206 1 1 31 GLN N N -8.185 8.211 -0.517 1.00 . A A . 35 GLN N 1 1 2 1207 1 1 31 GLN NE2 N -10.713 12.111 -1.115 1.00 . A A . 35 GLN NE2 1 1 2 1208 1 1 31 GLN O O -5.788 10.426 0.051 1.00 . A A . 35 GLN O 1 1 2 1209 1 1 31 GLN OE1 O -10.435 11.950 -3.275 1.00 . A A . 35 GLN OE1 1 1 2 1210 1 1 32 THR C C -2.745 7.662 -0.420 1.00 . A A . 36 THR C 1 1 2 1211 1 1 32 THR CA C -3.806 8.618 0.130 1.00 . A A . 36 THR CA 1 1 2 1212 1 1 32 THR CB C -4.107 8.296 1.594 1.00 . A A . 36 THR CB 1 1 2 1213 1 1 32 THR CG2 C -4.632 9.548 2.299 1.00 . A A . 36 THR CG2 1 1 2 1214 1 1 32 THR H H -5.300 7.600 -1.068 1.00 . A A . 36 THR H 1 1 2 1215 1 1 32 THR HA H -3.474 9.641 0.043 1.00 . A A . 36 THR HA 1 1 2 1216 1 1 32 THR HB H -3.203 7.967 2.084 1.00 . A A . 36 THR HB 1 1 2 1217 1 1 32 THR HG1 H -5.933 7.647 1.427 1.00 . A A . 36 THR HG1 1 1 2 1218 1 1 32 THR HG21 H -5.711 9.551 2.270 1.00 . A A . 36 THR HG21 1 1 2 1219 1 1 32 THR HG22 H -4.254 10.427 1.798 1.00 . A A . 36 THR HG22 1 1 2 1220 1 1 32 THR HG23 H -4.301 9.548 3.327 1.00 . A A . 36 THR HG23 1 1 2 1221 1 1 32 THR N N -5.110 8.434 -0.580 1.00 . A A . 36 THR N 1 1 2 1222 1 1 32 THR O O -3.029 6.798 -1.224 1.00 . A A . 36 THR O 1 1 2 1223 1 1 32 THR OG1 O -5.084 7.266 1.662 1.00 . A A . 36 THR OG1 1 1 2 1224 1 1 33 THR C C 0.372 6.359 0.692 1.00 . A A . 37 THR C 1 1 2 1225 1 1 33 THR CA C -0.436 6.908 -0.484 1.00 . A A . 37 THR CA 1 1 2 1226 1 1 33 THR CB C 0.477 7.772 -1.362 1.00 . A A . 37 THR CB 1 1 2 1227 1 1 33 THR CG2 C -0.349 8.598 -2.346 1.00 . A A . 37 THR CG2 1 1 2 1228 1 1 33 THR H H -1.310 8.514 0.662 1.00 . A A . 37 THR H 1 1 2 1229 1 1 33 THR HA H -0.854 6.102 -1.065 1.00 . A A . 37 THR HA 1 1 2 1230 1 1 33 THR HB H 1.148 7.130 -1.915 1.00 . A A . 37 THR HB 1 1 2 1231 1 1 33 THR HG1 H 0.664 9.365 -0.262 1.00 . A A . 37 THR HG1 1 1 2 1232 1 1 33 THR HG21 H -1.368 8.243 -2.345 1.00 . A A . 37 THR HG21 1 1 2 1233 1 1 33 THR HG22 H 0.068 8.497 -3.337 1.00 . A A . 37 THR HG22 1 1 2 1234 1 1 33 THR HG23 H -0.329 9.636 -2.051 1.00 . A A . 37 THR HG23 1 1 2 1235 1 1 33 THR N N -1.518 7.811 0.012 1.00 . A A . 37 THR N 1 1 2 1236 1 1 33 THR O O 0.997 7.099 1.425 1.00 . A A . 37 THR O 1 1 2 1237 1 1 33 THR OG1 O 1.235 8.642 -0.534 1.00 . A A . 37 THR OG1 1 1 2 1238 1 1 34 THR C C 2.247 3.548 1.394 1.00 . A A . 38 THR C 1 1 2 1239 1 1 34 THR CA C 1.192 4.487 1.978 1.00 . A A . 38 THR CA 1 1 2 1240 1 1 34 THR CB C 0.189 3.725 2.855 1.00 . A A . 38 THR CB 1 1 2 1241 1 1 34 THR CG2 C -0.358 2.515 2.096 1.00 . A A . 38 THR CG2 1 1 2 1242 1 1 34 THR H H -0.103 4.482 0.251 1.00 . A A . 38 THR H 1 1 2 1243 1 1 34 THR HA H 1.663 5.272 2.551 1.00 . A A . 38 THR HA 1 1 2 1244 1 1 34 THR HB H -0.627 4.378 3.119 1.00 . A A . 38 THR HB 1 1 2 1245 1 1 34 THR HG1 H 0.325 3.583 4.790 1.00 . A A . 38 THR HG1 1 1 2 1246 1 1 34 THR HG21 H -1.222 2.125 2.612 1.00 . A A . 38 THR HG21 1 1 2 1247 1 1 34 THR HG22 H 0.402 1.751 2.038 1.00 . A A . 38 THR HG22 1 1 2 1248 1 1 34 THR HG23 H -0.639 2.818 1.101 1.00 . A A . 38 THR HG23 1 1 2 1249 1 1 34 THR N N 0.392 5.070 0.863 1.00 . A A . 38 THR N 1 1 2 1250 1 1 34 THR O O 1.942 2.687 0.599 1.00 . A A . 38 THR O 1 1 2 1251 1 1 34 THR OG1 O 0.842 3.283 4.038 1.00 . A A . 38 THR OG1 1 1 2 1252 1 1 35 TRP C C 4.246 1.364 1.584 1.00 . A A . 39 TRP C 1 1 2 1253 1 1 35 TRP CA C 4.544 2.817 1.209 1.00 . A A . 39 TRP CA 1 1 2 1254 1 1 35 TRP CB C 5.872 3.258 1.843 1.00 . A A . 39 TRP CB 1 1 2 1255 1 1 35 TRP CD1 C 5.773 5.586 2.835 1.00 . A A . 39 TRP CD1 1 1 2 1256 1 1 35 TRP CD2 C 6.533 5.597 0.713 1.00 . A A . 39 TRP CD2 1 1 2 1257 1 1 35 TRP CE2 C 6.534 6.942 1.160 1.00 . A A . 39 TRP CE2 1 1 2 1258 1 1 35 TRP CE3 C 6.974 5.340 -0.601 1.00 . A A . 39 TRP CE3 1 1 2 1259 1 1 35 TRP CG C 6.039 4.751 1.801 1.00 . A A . 39 TRP CG 1 1 2 1260 1 1 35 TRP CH2 C 7.391 7.711 -0.956 1.00 . A A . 39 TRP CH2 1 1 2 1261 1 1 35 TRP CZ2 C 6.954 7.985 0.340 1.00 . A A . 39 TRP CZ2 1 1 2 1262 1 1 35 TRP CZ3 C 7.399 6.391 -1.425 1.00 . A A . 39 TRP CZ3 1 1 2 1263 1 1 35 TRP H H 3.715 4.414 2.407 1.00 . A A . 39 TRP H 1 1 2 1264 1 1 35 TRP HA H 4.590 2.920 0.136 1.00 . A A . 39 TRP HA 1 1 2 1265 1 1 35 TRP HB2 H 5.898 2.929 2.871 1.00 . A A . 39 TRP HB2 1 1 2 1266 1 1 35 TRP HB3 H 6.689 2.797 1.306 1.00 . A A . 39 TRP HB3 1 1 2 1267 1 1 35 TRP HD1 H 5.393 5.286 3.801 1.00 . A A . 39 TRP HD1 1 1 2 1268 1 1 35 TRP HE1 H 5.953 7.679 3.017 1.00 . A A . 39 TRP HE1 1 1 2 1269 1 1 35 TRP HE3 H 6.980 4.335 -0.984 1.00 . A A . 39 TRP HE3 1 1 2 1270 1 1 35 TRP HH2 H 7.720 8.514 -1.597 1.00 . A A . 39 TRP HH2 1 1 2 1271 1 1 35 TRP HZ2 H 6.945 8.999 0.706 1.00 . A A . 39 TRP HZ2 1 1 2 1272 1 1 35 TRP HZ3 H 7.739 6.181 -2.427 1.00 . A A . 39 TRP HZ3 1 1 2 1273 1 1 35 TRP N N 3.485 3.709 1.769 1.00 . A A . 39 TRP N 1 1 2 1274 1 1 35 TRP NE1 N 6.062 6.882 2.451 1.00 . A A . 39 TRP NE1 1 1 2 1275 1 1 35 TRP O O 4.299 0.476 0.756 1.00 . A A . 39 TRP O 1 1 2 1276 1 1 36 GLN C C 2.125 -0.530 3.238 1.00 . A A . 40 GLN C 1 1 2 1277 1 1 36 GLN CA C 3.635 -0.283 3.254 1.00 . A A . 40 GLN CA 1 1 2 1278 1 1 36 GLN CB C 4.181 -0.387 4.677 1.00 . A A . 40 GLN CB 1 1 2 1279 1 1 36 GLN CD C 6.192 0.999 5.205 1.00 . A A . 40 GLN CD 1 1 2 1280 1 1 36 GLN CG C 5.710 -0.340 4.642 1.00 . A A . 40 GLN CG 1 1 2 1281 1 1 36 GLN H H 3.898 1.843 3.479 1.00 . A A . 40 GLN H 1 1 2 1282 1 1 36 GLN HA H 4.140 -0.990 2.613 1.00 . A A . 40 GLN HA 1 1 2 1283 1 1 36 GLN HB2 H 3.809 0.438 5.267 1.00 . A A . 40 GLN HB2 1 1 2 1284 1 1 36 GLN HB3 H 3.860 -1.318 5.119 1.00 . A A . 40 GLN HB3 1 1 2 1285 1 1 36 GLN HE21 H 5.253 0.768 6.939 1.00 . A A . 40 GLN HE21 1 1 2 1286 1 1 36 GLN HE22 H 6.132 2.211 6.777 1.00 . A A . 40 GLN HE22 1 1 2 1287 1 1 36 GLN HG2 H 6.110 -1.146 5.238 1.00 . A A . 40 GLN HG2 1 1 2 1288 1 1 36 GLN HG3 H 6.051 -0.443 3.621 1.00 . A A . 40 GLN HG3 1 1 2 1289 1 1 36 GLN N N 3.935 1.114 2.826 1.00 . A A . 40 GLN N 1 1 2 1290 1 1 36 GLN NE2 N 5.829 1.356 6.407 1.00 . A A . 40 GLN NE2 1 1 2 1291 1 1 36 GLN O O 1.337 0.369 3.454 1.00 . A A . 40 GLN O 1 1 2 1292 1 1 36 GLN OE1 O 6.907 1.727 4.546 1.00 . A A . 40 GLN OE1 1 1 2 1293 1 1 37 ASP C C -0.414 -1.566 4.251 1.00 . A A . 41 ASP C 1 1 2 1294 1 1 37 ASP CA C 0.254 -2.046 2.956 1.00 . A A . 41 ASP CA 1 1 2 1295 1 1 37 ASP CB C 0.168 -3.569 2.840 1.00 . A A . 41 ASP CB 1 1 2 1296 1 1 37 ASP CG C 0.800 -4.216 4.075 1.00 . A A . 41 ASP CG 1 1 2 1297 1 1 37 ASP H H 2.366 -2.454 2.813 1.00 . A A . 41 ASP H 1 1 2 1298 1 1 37 ASP HA H -0.209 -1.584 2.099 1.00 . A A . 41 ASP HA 1 1 2 1299 1 1 37 ASP HB2 H -0.867 -3.865 2.769 1.00 . A A . 41 ASP HB2 1 1 2 1300 1 1 37 ASP HB3 H 0.696 -3.893 1.955 1.00 . A A . 41 ASP HB3 1 1 2 1301 1 1 37 ASP N N 1.714 -1.743 2.985 1.00 . A A . 41 ASP N 1 1 2 1302 1 1 37 ASP O O 0.253 -1.342 5.242 1.00 . A A . 41 ASP O 1 1 2 1303 1 1 37 ASP OD1 O 1.551 -3.539 4.757 1.00 . A A . 41 ASP OD1 1 1 2 1304 1 1 37 ASP OD2 O 0.522 -5.380 4.318 1.00 . A A . 41 ASP OD2 1 1 2 1305 1 1 38 PRO C C -2.530 -2.070 6.450 1.00 . A A . 42 PRO C 1 1 2 1306 1 1 38 PRO CA C -2.469 -0.960 5.397 1.00 . A A . 42 PRO CA 1 1 2 1307 1 1 38 PRO CB C -3.860 -0.653 4.851 1.00 . A A . 42 PRO CB 1 1 2 1308 1 1 38 PRO CD C -2.603 -1.664 3.055 1.00 . A A . 42 PRO CD 1 1 2 1309 1 1 38 PRO CG C -3.988 -1.498 3.623 1.00 . A A . 42 PRO CG 1 1 2 1310 1 1 38 PRO HA H -2.026 -0.066 5.806 1.00 . A A . 42 PRO HA 1 1 2 1311 1 1 38 PRO HB2 H -4.616 -0.924 5.573 1.00 . A A . 42 PRO HB2 1 1 2 1312 1 1 38 PRO HB3 H -3.941 0.394 4.596 1.00 . A A . 42 PRO HB3 1 1 2 1313 1 1 38 PRO HD2 H -2.467 -2.668 2.679 1.00 . A A . 42 PRO HD2 1 1 2 1314 1 1 38 PRO HD3 H -2.423 -0.938 2.276 1.00 . A A . 42 PRO HD3 1 1 2 1315 1 1 38 PRO HG2 H -4.399 -2.462 3.881 1.00 . A A . 42 PRO HG2 1 1 2 1316 1 1 38 PRO HG3 H -4.626 -1.007 2.902 1.00 . A A . 42 PRO HG3 1 1 2 1317 1 1 38 PRO N N -1.717 -1.421 4.204 1.00 . A A . 42 PRO N 1 1 2 1318 1 1 38 PRO O O -2.721 -1.816 7.624 1.00 . A A . 42 PRO O 1 1 2 1319 1 1 39 ARG C C -1.032 -4.645 7.636 1.00 . A A . 43 ARG C 1 1 2 1320 1 1 39 ARG CA C -2.416 -4.422 7.020 1.00 . A A . 43 ARG CA 1 1 2 1321 1 1 39 ARG CB C -2.842 -5.642 6.203 1.00 . A A . 43 ARG CB 1 1 2 1322 1 1 39 ARG CD C -4.689 -7.322 6.125 1.00 . A A . 43 ARG CD 1 1 2 1323 1 1 39 ARG CG C -3.766 -6.524 7.047 1.00 . A A . 43 ARG CG 1 1 2 1324 1 1 39 ARG CZ C -6.789 -8.503 6.535 1.00 . A A . 43 ARG CZ 1 1 2 1325 1 1 39 ARG H H -2.214 -3.482 5.091 1.00 . A A . 43 ARG H 1 1 2 1326 1 1 39 ARG HA H -3.144 -4.222 7.790 1.00 . A A . 43 ARG HA 1 1 2 1327 1 1 39 ARG HB2 H -3.367 -5.316 5.317 1.00 . A A . 43 ARG HB2 1 1 2 1328 1 1 39 ARG HB3 H -1.968 -6.207 5.916 1.00 . A A . 43 ARG HB3 1 1 2 1329 1 1 39 ARG HD2 H -5.017 -6.710 5.299 1.00 . A A . 43 ARG HD2 1 1 2 1330 1 1 39 ARG HD3 H -4.187 -8.207 5.763 1.00 . A A . 43 ARG HD3 1 1 2 1331 1 1 39 ARG HE H -5.914 -7.347 7.895 1.00 . A A . 43 ARG HE 1 1 2 1332 1 1 39 ARG HG2 H -3.170 -7.204 7.638 1.00 . A A . 43 ARG HG2 1 1 2 1333 1 1 39 ARG HG3 H -4.359 -5.901 7.700 1.00 . A A . 43 ARG HG3 1 1 2 1334 1 1 39 ARG HH11 H -5.972 -8.764 4.716 1.00 . A A . 43 ARG HH11 1 1 2 1335 1 1 39 ARG HH12 H -7.457 -9.604 4.997 1.00 . A A . 43 ARG HH12 1 1 2 1336 1 1 39 ARG HH21 H -7.842 -8.447 8.236 1.00 . A A . 43 ARG HH21 1 1 2 1337 1 1 39 ARG HH22 H -8.508 -9.427 6.974 1.00 . A A . 43 ARG HH22 1 1 2 1338 1 1 39 ARG N N -2.368 -3.298 6.041 1.00 . A A . 43 ARG N 1 1 2 1339 1 1 39 ARG NE N -5.850 -7.701 6.984 1.00 . A A . 43 ARG NE 1 1 2 1340 1 1 39 ARG NH1 N -6.733 -8.995 5.321 1.00 . A A . 43 ARG NH1 1 1 2 1341 1 1 39 ARG NH2 N -7.792 -8.817 7.309 1.00 . A A . 43 ARG NH2 1 1 2 1342 1 1 39 ARG O O -0.067 -4.006 7.266 1.00 . A A . 43 ARG O 1 1 2 1343 1 1 40 LYS C C 1.013 -7.091 8.638 1.00 . A A . 44 LYS C 1 1 2 1344 1 1 40 LYS CA C 0.395 -5.812 9.210 1.00 . A A . 44 LYS CA 1 1 2 1345 1 1 40 LYS CB C 0.090 -5.983 10.697 1.00 . A A . 44 LYS CB 1 1 2 1346 1 1 40 LYS CD C 0.909 -4.538 12.565 1.00 . A A . 44 LYS CD 1 1 2 1347 1 1 40 LYS CE C 1.794 -4.684 13.802 1.00 . A A . 44 LYS CE 1 1 2 1348 1 1 40 LYS CG C 1.315 -5.578 11.519 1.00 . A A . 44 LYS CG 1 1 2 1349 1 1 40 LYS H H -1.717 -6.055 8.857 1.00 . A A . 44 LYS H 1 1 2 1350 1 1 40 LYS HA H 1.058 -4.974 9.064 1.00 . A A . 44 LYS HA 1 1 2 1351 1 1 40 LYS HB2 H -0.748 -5.358 10.968 1.00 . A A . 44 LYS HB2 1 1 2 1352 1 1 40 LYS HB3 H -0.153 -7.016 10.900 1.00 . A A . 44 LYS HB3 1 1 2 1353 1 1 40 LYS HD2 H 1.026 -3.547 12.152 1.00 . A A . 44 LYS HD2 1 1 2 1354 1 1 40 LYS HD3 H -0.125 -4.691 12.842 1.00 . A A . 44 LYS HD3 1 1 2 1355 1 1 40 LYS HE2 H 1.189 -4.736 14.695 1.00 . A A . 44 LYS HE2 1 1 2 1356 1 1 40 LYS HE3 H 2.417 -5.562 13.717 1.00 . A A . 44 LYS HE3 1 1 2 1357 1 1 40 LYS HG2 H 1.720 -6.447 12.015 1.00 . A A . 44 LYS HG2 1 1 2 1358 1 1 40 LYS HG3 H 2.064 -5.156 10.865 1.00 . A A . 44 LYS HG3 1 1 2 1359 1 1 40 LYS HZ1 H 3.375 -3.545 14.540 1.00 . A A . 44 LYS HZ1 1 1 2 1360 1 1 40 LYS HZ2 H 2.037 -2.630 14.036 1.00 . A A . 44 LYS HZ2 1 1 2 1361 1 1 40 LYS HZ3 H 3.078 -3.323 12.885 1.00 . A A . 44 LYS HZ3 1 1 2 1362 1 1 40 LYS N N -0.927 -5.549 8.572 1.00 . A A . 44 LYS N 1 1 2 1363 1 1 40 LYS NZ N 2.634 -3.452 13.817 1.00 . A A . 44 LYS NZ 1 1 2 1364 1 1 40 LYS O O 2.170 -7.347 8.929 1.00 . A A . 44 LYS O 1 1 2 1365 1 1 40 LYS OXT O 0.319 -7.791 7.918 1.00 . A A . 44 LYS OXT 1 1 2 1366 2 2 1 ACE C C 8.052 11.569 5.232 1.00 . B B . 45 ACE C 1 1 2 1367 2 2 1 ACE CH3 C 8.679 12.450 6.314 1.00 . B B . 45 ACE CH3 1 1 2 1368 2 2 1 ACE H1 H 8.691 13.477 5.978 1.00 . B B . 45 ACE H1 1 1 2 1369 2 2 1 ACE H2 H 9.691 12.123 6.504 1.00 . B B . 45 ACE H2 1 1 2 1370 2 2 1 ACE H3 H 8.099 12.374 7.221 1.00 . B B . 45 ACE H3 1 1 2 1371 2 2 1 ACE O O 6.844 11.503 5.107 1.00 . B B . 45 ACE O 1 1 2 1372 2 2 2 PRO C C 7.240 10.234 2.770 1.00 . B B . 46 PRO C 1 1 2 1373 2 2 2 PRO CA C 8.645 10.789 3.025 1.00 . B B . 46 PRO CA 1 1 2 1374 2 2 2 PRO CB C 9.708 9.804 2.551 1.00 . B B . 46 PRO CB 1 1 2 1375 2 2 2 PRO CD C 9.828 9.880 4.960 1.00 . B B . 46 PRO CD 1 1 2 1376 2 2 2 PRO CG C 10.055 8.999 3.760 1.00 . B B . 46 PRO CG 1 1 2 1377 2 2 2 PRO HA H 8.775 11.739 2.530 1.00 . B B . 46 PRO HA 1 1 2 1378 2 2 2 PRO HB2 H 9.308 9.166 1.773 1.00 . B B . 46 PRO HB2 1 1 2 1379 2 2 2 PRO HB3 H 10.579 10.331 2.196 1.00 . B B . 46 PRO HB3 1 1 2 1380 2 2 2 PRO HD2 H 9.383 9.311 5.764 1.00 . B B . 46 PRO HD2 1 1 2 1381 2 2 2 PRO HD3 H 10.756 10.330 5.279 1.00 . B B . 46 PRO HD3 1 1 2 1382 2 2 2 PRO HG2 H 9.419 8.126 3.813 1.00 . B B . 46 PRO HG2 1 1 2 1383 2 2 2 PRO HG3 H 11.090 8.701 3.719 1.00 . B B . 46 PRO HG3 1 1 2 1384 2 2 2 PRO N N 8.900 10.917 4.485 1.00 . B B . 46 PRO N 1 1 2 1385 2 2 2 PRO O O 6.876 9.189 3.272 1.00 . B B . 46 PRO O 1 1 2 1386 2 2 3 LEU C C 4.399 11.357 0.667 1.00 . B B . 47 LEU C 1 1 2 1387 2 2 3 LEU CA C 5.068 10.441 1.706 1.00 . B B . 47 LEU CA 1 1 2 1388 2 2 3 LEU CB C 4.339 10.517 3.057 1.00 . B B . 47 LEU CB 1 1 2 1389 2 2 3 LEU CD1 C 2.002 10.653 2.139 1.00 . B B . 47 LEU CD1 1 1 2 1390 2 2 3 LEU CD2 C 3.114 8.425 2.371 1.00 . B B . 47 LEU CD2 1 1 2 1391 2 2 3 LEU CG C 2.968 9.820 2.984 1.00 . B B . 47 LEU CG 1 1 2 1392 2 2 3 LEU H H 6.765 11.766 1.600 1.00 . B B . 47 LEU H 1 1 2 1393 2 2 3 LEU HA H 5.094 9.421 1.360 1.00 . B B . 47 LEU HA 1 1 2 1394 2 2 3 LEU HB2 H 4.942 10.034 3.811 1.00 . B B . 47 LEU HB2 1 1 2 1395 2 2 3 LEU HB3 H 4.198 11.553 3.324 1.00 . B B . 47 LEU HB3 1 1 2 1396 2 2 3 LEU HD11 H 2.328 11.683 2.130 1.00 . B B . 47 LEU HD11 1 1 2 1397 2 2 3 LEU HD12 H 1.010 10.593 2.560 1.00 . B B . 47 LEU HD12 1 1 2 1398 2 2 3 LEU HD13 H 1.987 10.272 1.128 1.00 . B B . 47 LEU HD13 1 1 2 1399 2 2 3 LEU HD21 H 2.486 7.728 2.907 1.00 . B B . 47 LEU HD21 1 1 2 1400 2 2 3 LEU HD22 H 4.142 8.108 2.439 1.00 . B B . 47 LEU HD22 1 1 2 1401 2 2 3 LEU HD23 H 2.814 8.455 1.334 1.00 . B B . 47 LEU HD23 1 1 2 1402 2 2 3 LEU HG H 2.570 9.726 3.983 1.00 . B B . 47 LEU HG 1 1 2 1403 2 2 3 LEU N N 6.450 10.925 1.995 1.00 . B B . 47 LEU N 1 1 2 1404 2 2 3 LEU O O 4.130 12.508 0.949 1.00 . B B . 47 LEU O 1 1 2 1405 2 2 4 PRO C C 2.029 11.896 -1.230 1.00 . B B . 48 PRO C 1 1 2 1406 2 2 4 PRO CA C 3.500 11.618 -1.580 1.00 . B B . 48 PRO CA 1 1 2 1407 2 2 4 PRO CB C 3.603 10.717 -2.810 1.00 . B B . 48 PRO CB 1 1 2 1408 2 2 4 PRO CD C 4.430 9.443 -0.943 1.00 . B B . 48 PRO CD 1 1 2 1409 2 2 4 PRO CG C 3.711 9.332 -2.260 1.00 . B B . 48 PRO CG 1 1 2 1410 2 2 4 PRO HA H 4.039 12.534 -1.749 1.00 . B B . 48 PRO HA 1 1 2 1411 2 2 4 PRO HB2 H 2.719 10.810 -3.421 1.00 . B B . 48 PRO HB2 1 1 2 1412 2 2 4 PRO HB3 H 4.485 10.964 -3.382 1.00 . B B . 48 PRO HB3 1 1 2 1413 2 2 4 PRO HD2 H 4.037 8.730 -0.234 1.00 . B B . 48 PRO HD2 1 1 2 1414 2 2 4 PRO HD3 H 5.492 9.302 -1.080 1.00 . B B . 48 PRO HD3 1 1 2 1415 2 2 4 PRO HG2 H 2.726 8.917 -2.110 1.00 . B B . 48 PRO HG2 1 1 2 1416 2 2 4 PRO HG3 H 4.276 8.709 -2.938 1.00 . B B . 48 PRO HG3 1 1 2 1417 2 2 4 PRO N N 4.146 10.819 -0.505 1.00 . B B . 48 PRO N 1 1 2 1418 2 2 4 PRO O O 1.232 10.982 -1.165 1.00 . B B . 48 PRO O 1 1 2 1419 2 2 5 PRO C C -0.601 13.361 -1.886 1.00 . B B . 49 PRO C 1 1 2 1420 2 2 5 PRO CA C 0.314 13.523 -0.668 1.00 . B B . 49 PRO CA 1 1 2 1421 2 2 5 PRO CB C 0.422 14.987 -0.256 1.00 . B B . 49 PRO CB 1 1 2 1422 2 2 5 PRO CD C 2.593 14.326 -1.069 1.00 . B B . 49 PRO CD 1 1 2 1423 2 2 5 PRO CG C 1.647 15.492 -0.949 1.00 . B B . 49 PRO CG 1 1 2 1424 2 2 5 PRO HA H -0.044 12.931 0.159 1.00 . B B . 49 PRO HA 1 1 2 1425 2 2 5 PRO HB2 H -0.448 15.535 -0.585 1.00 . B B . 49 PRO HB2 1 1 2 1426 2 2 5 PRO HB3 H 0.536 15.070 0.814 1.00 . B B . 49 PRO HB3 1 1 2 1427 2 2 5 PRO HD2 H 3.120 14.360 -2.010 1.00 . B B . 49 PRO HD2 1 1 2 1428 2 2 5 PRO HD3 H 3.288 14.315 -0.244 1.00 . B B . 49 PRO HD3 1 1 2 1429 2 2 5 PRO HG2 H 1.390 15.860 -1.932 1.00 . B B . 49 PRO HG2 1 1 2 1430 2 2 5 PRO HG3 H 2.103 16.279 -0.368 1.00 . B B . 49 PRO HG3 1 1 2 1431 2 2 5 PRO N N 1.710 13.150 -1.014 1.00 . B B . 49 PRO N 1 1 2 1432 2 2 5 PRO O O -0.513 14.106 -2.843 1.00 . B B . 49 PRO O 1 1 2 1433 2 2 6 TYR C C -3.129 13.486 -3.349 1.00 . B B . 50 TYR C 1 1 2 1434 2 2 6 TYR CA C -2.397 12.185 -3.010 1.00 . B B . 50 TYR CA 1 1 2 1435 2 2 6 TYR CB C -3.388 11.120 -2.537 1.00 . B B . 50 TYR CB 1 1 2 1436 2 2 6 TYR CD1 C -3.170 9.927 -4.747 1.00 . B B . 50 TYR CD1 1 1 2 1437 2 2 6 TYR CD2 C -5.386 10.287 -3.829 1.00 . B B . 50 TYR CD2 1 1 2 1438 2 2 6 TYR CE1 C -3.734 9.286 -5.856 1.00 . B B . 50 TYR CE1 1 1 2 1439 2 2 6 TYR CE2 C -5.950 9.645 -4.938 1.00 . B B . 50 TYR CE2 1 1 2 1440 2 2 6 TYR CG C -3.996 10.429 -3.733 1.00 . B B . 50 TYR CG 1 1 2 1441 2 2 6 TYR CZ C -5.124 9.145 -5.951 1.00 . B B . 50 TYR CZ 1 1 2 1442 2 2 6 TYR H H -1.530 11.806 -1.075 1.00 . B B . 50 TYR H 1 1 2 1443 2 2 6 TYR HA H -1.851 11.824 -3.868 1.00 . B B . 50 TYR HA 1 1 2 1444 2 2 6 TYR HB2 H -2.872 10.396 -1.925 1.00 . B B . 50 TYR HB2 1 1 2 1445 2 2 6 TYR HB3 H -4.170 11.589 -1.958 1.00 . B B . 50 TYR HB3 1 1 2 1446 2 2 6 TYR HD1 H -2.098 10.037 -4.674 1.00 . B B . 50 TYR HD1 1 1 2 1447 2 2 6 TYR HD2 H -6.023 10.673 -3.047 1.00 . B B . 50 TYR HD2 1 1 2 1448 2 2 6 TYR HE1 H -3.099 8.899 -6.639 1.00 . B B . 50 TYR HE1 1 1 2 1449 2 2 6 TYR HE2 H -7.022 9.536 -5.011 1.00 . B B . 50 TYR HE2 1 1 2 1450 2 2 6 TYR HH H -5.596 9.097 -7.800 1.00 . B B . 50 TYR HH 1 1 2 1451 2 2 6 TYR N N -1.477 12.395 -1.856 1.00 . B B . 50 TYR N 1 1 2 1452 2 2 6 TYR O O -3.187 13.824 -4.520 1.00 . B B . 50 TYR O 1 1 2 1453 2 2 6 TYR OXT O -3.618 14.124 -2.430 1.00 . B B . 50 TYR OXT 1 1 2 1454 2 2 6 TYR OH O -5.680 8.512 -7.044 1.00 . B B . 50 TYR OH 1 1 3 1455 1 1 1 PHE C C 4.216 -17.969 9.572 1.00 . A A . 5 PHE C 1 1 3 1456 1 1 1 PHE CA C 3.903 -18.230 11.048 1.00 . A A . 5 PHE CA 1 1 3 1457 1 1 1 PHE CB C 4.282 -19.660 11.433 1.00 . A A . 5 PHE CB 1 1 3 1458 1 1 1 PHE CD1 C 6.206 -18.959 12.902 1.00 . A A . 5 PHE CD1 1 1 3 1459 1 1 1 PHE CD2 C 4.452 -20.335 13.856 1.00 . A A . 5 PHE CD2 1 1 3 1460 1 1 1 PHE CE1 C 6.870 -18.950 14.136 1.00 . A A . 5 PHE CE1 1 1 3 1461 1 1 1 PHE CE2 C 5.115 -20.326 15.090 1.00 . A A . 5 PHE CE2 1 1 3 1462 1 1 1 PHE CG C 4.998 -19.651 12.763 1.00 . A A . 5 PHE CG 1 1 3 1463 1 1 1 PHE CZ C 6.324 -19.634 15.229 1.00 . A A . 5 PHE CZ 1 1 3 1464 1 1 1 PHE HA H 4.429 -17.529 11.676 1.00 . A A . 5 PHE HA 1 1 3 1465 1 1 1 PHE HB2 H 3.389 -20.262 11.509 1.00 . A A . 5 PHE HB2 1 1 3 1466 1 1 1 PHE HB3 H 4.933 -20.075 10.678 1.00 . A A . 5 PHE HB3 1 1 3 1467 1 1 1 PHE HD1 H 6.626 -18.432 12.060 1.00 . A A . 5 PHE HD1 1 1 3 1468 1 1 1 PHE HD2 H 3.519 -20.869 13.748 1.00 . A A . 5 PHE HD2 1 1 3 1469 1 1 1 PHE HE1 H 7.802 -18.417 14.243 1.00 . A A . 5 PHE HE1 1 1 3 1470 1 1 1 PHE HE2 H 4.694 -20.853 15.932 1.00 . A A . 5 PHE HE2 1 1 3 1471 1 1 1 PHE HZ H 6.835 -19.627 16.180 1.00 . A A . 5 PHE HZ 1 1 3 1472 1 1 1 PHE N N 2.433 -18.143 11.286 1.00 . A A . 5 PHE N 1 1 3 1473 1 1 1 PHE O O 4.614 -16.886 9.193 1.00 . A A . 5 PHE O 1 1 3 1474 1 1 2 GLU C C 3.023 -18.764 6.483 1.00 . A A . 6 GLU C 1 1 3 1475 1 1 2 GLU CA C 4.327 -18.763 7.285 1.00 . A A . 6 GLU CA 1 1 3 1476 1 1 2 GLU CB C 5.200 -19.956 6.892 1.00 . A A . 6 GLU CB 1 1 3 1477 1 1 2 GLU CD C 7.395 -18.765 6.985 1.00 . A A . 6 GLU CD 1 1 3 1478 1 1 2 GLU CG C 6.543 -19.866 7.620 1.00 . A A . 6 GLU CG 1 1 3 1479 1 1 2 GLU H H 3.717 -19.822 9.060 1.00 . A A . 6 GLU H 1 1 3 1480 1 1 2 GLU HA H 4.867 -17.843 7.126 1.00 . A A . 6 GLU HA 1 1 3 1481 1 1 2 GLU HB2 H 4.701 -20.872 7.169 1.00 . A A . 6 GLU HB2 1 1 3 1482 1 1 2 GLU HB3 H 5.366 -19.944 5.826 1.00 . A A . 6 GLU HB3 1 1 3 1483 1 1 2 GLU HG2 H 6.373 -19.635 8.661 1.00 . A A . 6 GLU HG2 1 1 3 1484 1 1 2 GLU HG3 H 7.058 -20.811 7.540 1.00 . A A . 6 GLU HG3 1 1 3 1485 1 1 2 GLU N N 4.040 -18.955 8.735 1.00 . A A . 6 GLU N 1 1 3 1486 1 1 2 GLU O O 2.889 -19.464 5.498 1.00 . A A . 6 GLU O 1 1 3 1487 1 1 2 GLU OE1 O 7.168 -17.610 7.305 1.00 . A A . 6 GLU OE1 1 1 3 1488 1 1 2 GLU OE2 O 8.259 -19.096 6.190 1.00 . A A . 6 GLU OE2 1 1 3 1489 1 1 3 ILE C C 1.015 -17.654 4.670 1.00 . A A . 7 ILE C 1 1 3 1490 1 1 3 ILE CA C 0.766 -17.942 6.156 1.00 . A A . 7 ILE CA 1 1 3 1491 1 1 3 ILE CB C -0.018 -16.800 6.800 1.00 . A A . 7 ILE CB 1 1 3 1492 1 1 3 ILE CD1 C 0.006 -14.508 5.804 1.00 . A A . 7 ILE CD1 1 1 3 1493 1 1 3 ILE CG1 C 0.780 -15.500 6.674 1.00 . A A . 7 ILE CG1 1 1 3 1494 1 1 3 ILE CG2 C -0.253 -17.110 8.278 1.00 . A A . 7 ILE CG2 1 1 3 1495 1 1 3 ILE H H 2.189 -17.428 7.692 1.00 . A A . 7 ILE H 1 1 3 1496 1 1 3 ILE HA H 0.232 -18.871 6.277 1.00 . A A . 7 ILE HA 1 1 3 1497 1 1 3 ILE HB H -0.969 -16.690 6.299 1.00 . A A . 7 ILE HB 1 1 3 1498 1 1 3 ILE HD11 H -1.027 -14.815 5.737 1.00 . A A . 7 ILE HD11 1 1 3 1499 1 1 3 ILE HD12 H 0.439 -14.482 4.815 1.00 . A A . 7 ILE HD12 1 1 3 1500 1 1 3 ILE HD13 H 0.061 -13.523 6.246 1.00 . A A . 7 ILE HD13 1 1 3 1501 1 1 3 ILE HG12 H 0.933 -15.074 7.656 1.00 . A A . 7 ILE HG12 1 1 3 1502 1 1 3 ILE HG13 H 1.737 -15.707 6.220 1.00 . A A . 7 ILE HG13 1 1 3 1503 1 1 3 ILE HG21 H -1.072 -16.512 8.646 1.00 . A A . 7 ILE HG21 1 1 3 1504 1 1 3 ILE HG22 H 0.641 -16.884 8.841 1.00 . A A . 7 ILE HG22 1 1 3 1505 1 1 3 ILE HG23 H -0.494 -18.158 8.392 1.00 . A A . 7 ILE HG23 1 1 3 1506 1 1 3 ILE N N 2.061 -17.986 6.896 1.00 . A A . 7 ILE N 1 1 3 1507 1 1 3 ILE O O 2.027 -17.083 4.313 1.00 . A A . 7 ILE O 1 1 3 1508 1 1 4 PRO C C 0.014 -16.349 2.052 1.00 . A A . 8 PRO C 1 1 3 1509 1 1 4 PRO CA C 0.213 -17.831 2.384 1.00 . A A . 8 PRO CA 1 1 3 1510 1 1 4 PRO CB C -0.907 -18.677 1.783 1.00 . A A . 8 PRO CB 1 1 3 1511 1 1 4 PRO CD C -1.174 -18.751 4.181 1.00 . A A . 8 PRO CD 1 1 3 1512 1 1 4 PRO CG C -1.922 -18.803 2.876 1.00 . A A . 8 PRO CG 1 1 3 1513 1 1 4 PRO HA H 1.170 -18.178 2.029 1.00 . A A . 8 PRO HA 1 1 3 1514 1 1 4 PRO HB2 H -1.336 -18.179 0.928 1.00 . A A . 8 PRO HB2 1 1 3 1515 1 1 4 PRO HB3 H -0.534 -19.651 1.504 1.00 . A A . 8 PRO HB3 1 1 3 1516 1 1 4 PRO HD2 H -1.731 -18.190 4.916 1.00 . A A . 8 PRO HD2 1 1 3 1517 1 1 4 PRO HD3 H -0.968 -19.750 4.540 1.00 . A A . 8 PRO HD3 1 1 3 1518 1 1 4 PRO HG2 H -2.625 -17.985 2.820 1.00 . A A . 8 PRO HG2 1 1 3 1519 1 1 4 PRO HG3 H -2.445 -19.744 2.785 1.00 . A A . 8 PRO HG3 1 1 3 1520 1 1 4 PRO N N 0.079 -18.057 3.844 1.00 . A A . 8 PRO N 1 1 3 1521 1 1 4 PRO O O 0.012 -15.504 2.925 1.00 . A A . 8 PRO O 1 1 3 1522 1 1 5 ASP C C -1.700 -14.424 -0.283 1.00 . A A . 9 ASP C 1 1 3 1523 1 1 5 ASP CA C -0.349 -14.601 0.415 1.00 . A A . 9 ASP CA 1 1 3 1524 1 1 5 ASP CB C 0.798 -14.287 -0.547 1.00 . A A . 9 ASP CB 1 1 3 1525 1 1 5 ASP CG C 0.969 -12.771 -0.657 1.00 . A A . 9 ASP CG 1 1 3 1526 1 1 5 ASP H H -0.145 -16.725 0.110 1.00 . A A . 9 ASP H 1 1 3 1527 1 1 5 ASP HA H -0.286 -13.964 1.283 1.00 . A A . 9 ASP HA 1 1 3 1528 1 1 5 ASP HB2 H 1.711 -14.727 -0.173 1.00 . A A . 9 ASP HB2 1 1 3 1529 1 1 5 ASP HB3 H 0.573 -14.696 -1.521 1.00 . A A . 9 ASP HB3 1 1 3 1530 1 1 5 ASP N N -0.151 -16.028 0.800 1.00 . A A . 9 ASP N 1 1 3 1531 1 1 5 ASP O O -1.767 -14.111 -1.456 1.00 . A A . 9 ASP O 1 1 3 1532 1 1 5 ASP OD1 O 0.012 -12.112 -1.031 1.00 . A A . 9 ASP OD1 1 1 3 1533 1 1 5 ASP OD2 O 2.055 -12.294 -0.368 1.00 . A A . 9 ASP OD2 1 1 3 1534 1 1 6 ASP C C -4.233 -13.089 -0.871 1.00 . A A . 10 ASP C 1 1 3 1535 1 1 6 ASP CA C -4.121 -14.460 -0.197 1.00 . A A . 10 ASP CA 1 1 3 1536 1 1 6 ASP CB C -5.112 -14.578 0.963 1.00 . A A . 10 ASP CB 1 1 3 1537 1 1 6 ASP CG C -6.531 -14.313 0.452 1.00 . A A . 10 ASP CG 1 1 3 1538 1 1 6 ASP H H -2.701 -14.869 1.372 1.00 . A A . 10 ASP H 1 1 3 1539 1 1 6 ASP HA H -4.298 -15.247 -0.913 1.00 . A A . 10 ASP HA 1 1 3 1540 1 1 6 ASP HB2 H -5.060 -15.571 1.381 1.00 . A A . 10 ASP HB2 1 1 3 1541 1 1 6 ASP HB3 H -4.864 -13.854 1.725 1.00 . A A . 10 ASP HB3 1 1 3 1542 1 1 6 ASP N N -2.776 -14.618 0.427 1.00 . A A . 10 ASP N 1 1 3 1543 1 1 6 ASP O O -4.166 -12.974 -2.078 1.00 . A A . 10 ASP O 1 1 3 1544 1 1 6 ASP OD1 O -6.751 -14.472 -0.737 1.00 . A A . 10 ASP OD1 1 1 3 1545 1 1 6 ASP OD2 O -7.373 -13.956 1.259 1.00 . A A . 10 ASP OD2 1 1 3 1546 1 1 7 VAL C C -3.729 -9.670 0.136 1.00 . A A . 11 VAL C 1 1 3 1547 1 1 7 VAL CA C -4.521 -10.689 -0.702 1.00 . A A . 11 VAL CA 1 1 3 1548 1 1 7 VAL CB C -6.015 -10.368 -0.662 1.00 . A A . 11 VAL CB 1 1 3 1549 1 1 7 VAL CG1 C -6.525 -10.491 0.777 1.00 . A A . 11 VAL CG1 1 1 3 1550 1 1 7 VAL CG2 C -6.245 -8.942 -1.165 1.00 . A A . 11 VAL CG2 1 1 3 1551 1 1 7 VAL H H -4.458 -12.160 0.870 1.00 . A A . 11 VAL H 1 1 3 1552 1 1 7 VAL HA H -4.174 -10.699 -1.722 1.00 . A A . 11 VAL HA 1 1 3 1553 1 1 7 VAL HB H -6.550 -11.063 -1.292 1.00 . A A . 11 VAL HB 1 1 3 1554 1 1 7 VAL HG11 H -7.591 -10.320 0.798 1.00 . A A . 11 VAL HG11 1 1 3 1555 1 1 7 VAL HG12 H -6.032 -9.757 1.397 1.00 . A A . 11 VAL HG12 1 1 3 1556 1 1 7 VAL HG13 H -6.311 -11.481 1.151 1.00 . A A . 11 VAL HG13 1 1 3 1557 1 1 7 VAL HG21 H -7.305 -8.758 -1.255 1.00 . A A . 11 VAL HG21 1 1 3 1558 1 1 7 VAL HG22 H -5.773 -8.820 -2.128 1.00 . A A . 11 VAL HG22 1 1 3 1559 1 1 7 VAL HG23 H -5.817 -8.241 -0.464 1.00 . A A . 11 VAL HG23 1 1 3 1560 1 1 7 VAL N N -4.404 -12.048 -0.101 1.00 . A A . 11 VAL N 1 1 3 1561 1 1 7 VAL O O -3.834 -9.662 1.346 1.00 . A A . 11 VAL O 1 1 3 1562 1 1 8 PRO C C -3.066 -6.693 0.710 1.00 . A A . 12 PRO C 1 1 3 1563 1 1 8 PRO CA C -2.162 -7.819 0.185 1.00 . A A . 12 PRO CA 1 1 3 1564 1 1 8 PRO CB C -1.191 -7.310 -0.877 1.00 . A A . 12 PRO CB 1 1 3 1565 1 1 8 PRO CD C -2.770 -8.770 -1.989 1.00 . A A . 12 PRO CD 1 1 3 1566 1 1 8 PRO CG C -1.858 -7.587 -2.190 1.00 . A A . 12 PRO CG 1 1 3 1567 1 1 8 PRO HA H -1.615 -8.271 0.996 1.00 . A A . 12 PRO HA 1 1 3 1568 1 1 8 PRO HB2 H -1.027 -6.250 -0.758 1.00 . A A . 12 PRO HB2 1 1 3 1569 1 1 8 PRO HB3 H -0.254 -7.844 -0.814 1.00 . A A . 12 PRO HB3 1 1 3 1570 1 1 8 PRO HD2 H -3.714 -8.608 -2.488 1.00 . A A . 12 PRO HD2 1 1 3 1571 1 1 8 PRO HD3 H -2.302 -9.674 -2.351 1.00 . A A . 12 PRO HD3 1 1 3 1572 1 1 8 PRO HG2 H -2.432 -6.729 -2.503 1.00 . A A . 12 PRO HG2 1 1 3 1573 1 1 8 PRO HG3 H -1.113 -7.821 -2.936 1.00 . A A . 12 PRO HG3 1 1 3 1574 1 1 8 PRO N N -2.962 -8.839 -0.532 1.00 . A A . 12 PRO N 1 1 3 1575 1 1 8 PRO O O -3.517 -6.730 1.838 1.00 . A A . 12 PRO O 1 1 3 1576 1 1 9 LEU C C -5.678 -4.885 0.025 1.00 . A A . 13 LEU C 1 1 3 1577 1 1 9 LEU CA C -4.213 -4.585 0.376 1.00 . A A . 13 LEU CA 1 1 3 1578 1 1 9 LEU CB C -3.715 -3.350 -0.379 1.00 . A A . 13 LEU CB 1 1 3 1579 1 1 9 LEU CD1 C -1.257 -3.813 -0.480 1.00 . A A . 13 LEU CD1 1 1 3 1580 1 1 9 LEU CD2 C -2.074 -1.474 -0.166 1.00 . A A . 13 LEU CD2 1 1 3 1581 1 1 9 LEU CG C -2.341 -2.944 0.164 1.00 . A A . 13 LEU CG 1 1 3 1582 1 1 9 LEU H H -2.970 -5.681 -0.997 1.00 . A A . 13 LEU H 1 1 3 1583 1 1 9 LEU HA H -4.102 -4.437 1.439 1.00 . A A . 13 LEU HA 1 1 3 1584 1 1 9 LEU HB2 H -3.633 -3.579 -1.431 1.00 . A A . 13 LEU HB2 1 1 3 1585 1 1 9 LEU HB3 H -4.412 -2.537 -0.238 1.00 . A A . 13 LEU HB3 1 1 3 1586 1 1 9 LEU HD11 H -1.656 -4.293 -1.361 1.00 . A A . 13 LEU HD11 1 1 3 1587 1 1 9 LEU HD12 H -0.932 -4.564 0.224 1.00 . A A . 13 LEU HD12 1 1 3 1588 1 1 9 LEU HD13 H -0.417 -3.193 -0.759 1.00 . A A . 13 LEU HD13 1 1 3 1589 1 1 9 LEU HD21 H -2.400 -1.266 -1.173 1.00 . A A . 13 LEU HD21 1 1 3 1590 1 1 9 LEU HD22 H -1.017 -1.273 -0.081 1.00 . A A . 13 LEU HD22 1 1 3 1591 1 1 9 LEU HD23 H -2.616 -0.846 0.525 1.00 . A A . 13 LEU HD23 1 1 3 1592 1 1 9 LEU HG H -2.322 -3.081 1.234 1.00 . A A . 13 LEU HG 1 1 3 1593 1 1 9 LEU N N -3.337 -5.698 -0.092 1.00 . A A . 13 LEU N 1 1 3 1594 1 1 9 LEU O O -5.950 -5.698 -0.836 1.00 . A A . 13 LEU O 1 1 3 1595 1 1 10 PRO C C -8.448 -3.828 -0.882 1.00 . A A . 14 PRO C 1 1 3 1596 1 1 10 PRO CA C -8.027 -4.441 0.457 1.00 . A A . 14 PRO CA 1 1 3 1597 1 1 10 PRO CB C -8.708 -3.732 1.625 1.00 . A A . 14 PRO CB 1 1 3 1598 1 1 10 PRO CD C -6.351 -3.222 1.763 1.00 . A A . 14 PRO CD 1 1 3 1599 1 1 10 PRO CG C -7.728 -2.697 2.077 1.00 . A A . 14 PRO CG 1 1 3 1600 1 1 10 PRO HA H -8.262 -5.493 0.482 1.00 . A A . 14 PRO HA 1 1 3 1601 1 1 10 PRO HB2 H -9.624 -3.262 1.296 1.00 . A A . 14 PRO HB2 1 1 3 1602 1 1 10 PRO HB3 H -8.910 -4.430 2.422 1.00 . A A . 14 PRO HB3 1 1 3 1603 1 1 10 PRO HD2 H -5.715 -2.429 1.400 1.00 . A A . 14 PRO HD2 1 1 3 1604 1 1 10 PRO HD3 H -5.915 -3.688 2.636 1.00 . A A . 14 PRO HD3 1 1 3 1605 1 1 10 PRO HG2 H -7.899 -1.772 1.546 1.00 . A A . 14 PRO HG2 1 1 3 1606 1 1 10 PRO HG3 H -7.827 -2.536 3.140 1.00 . A A . 14 PRO HG3 1 1 3 1607 1 1 10 PRO N N -6.582 -4.222 0.709 1.00 . A A . 14 PRO N 1 1 3 1608 1 1 10 PRO O O -7.624 -3.504 -1.714 1.00 . A A . 14 PRO O 1 1 3 1609 1 1 11 ALA C C -9.943 -1.585 -2.430 1.00 . A A . 15 ALA C 1 1 3 1610 1 1 11 ALA CA C -10.205 -3.094 -2.389 1.00 . A A . 15 ALA CA 1 1 3 1611 1 1 11 ALA CB C -11.706 -3.377 -2.416 1.00 . A A . 15 ALA CB 1 1 3 1612 1 1 11 ALA H H -10.375 -3.950 -0.418 1.00 . A A . 15 ALA H 1 1 3 1613 1 1 11 ALA HA H -9.725 -3.581 -3.222 1.00 . A A . 15 ALA HA 1 1 3 1614 1 1 11 ALA HB1 H -12.117 -3.241 -1.426 1.00 . A A . 15 ALA HB1 1 1 3 1615 1 1 11 ALA HB2 H -11.875 -4.394 -2.739 1.00 . A A . 15 ALA HB2 1 1 3 1616 1 1 11 ALA HB3 H -12.189 -2.696 -3.102 1.00 . A A . 15 ALA HB3 1 1 3 1617 1 1 11 ALA N N -9.726 -3.675 -1.100 1.00 . A A . 15 ALA N 1 1 3 1618 1 1 11 ALA O O -9.569 -0.982 -1.445 1.00 . A A . 15 ALA O 1 1 3 1619 1 1 12 GLY C C -8.415 0.802 -3.470 1.00 . A A . 16 GLY C 1 1 3 1620 1 1 12 GLY CA C -9.901 0.492 -3.682 1.00 . A A . 16 GLY CA 1 1 3 1621 1 1 12 GLY H H -10.439 -1.483 -4.350 1.00 . A A . 16 GLY H 1 1 3 1622 1 1 12 GLY HA2 H -10.201 0.829 -4.664 1.00 . A A . 16 GLY HA2 1 1 3 1623 1 1 12 GLY HA3 H -10.484 1.008 -2.934 1.00 . A A . 16 GLY HA3 1 1 3 1624 1 1 12 GLY N N -10.138 -0.975 -3.569 1.00 . A A . 16 GLY N 1 1 3 1625 1 1 12 GLY O O -8.033 1.939 -3.275 1.00 . A A . 16 GLY O 1 1 3 1626 1 1 13 TRP C C -5.327 -0.260 -4.561 1.00 . A A . 17 TRP C 1 1 3 1627 1 1 13 TRP CA C -6.117 0.052 -3.289 1.00 . A A . 17 TRP CA 1 1 3 1628 1 1 13 TRP CB C -5.722 -0.909 -2.174 1.00 . A A . 17 TRP CB 1 1 3 1629 1 1 13 TRP CD1 C -6.869 -0.244 -0.030 1.00 . A A . 17 TRP CD1 1 1 3 1630 1 1 13 TRP CD2 C -4.826 0.662 -0.244 1.00 . A A . 17 TRP CD2 1 1 3 1631 1 1 13 TRP CE2 C -5.338 1.116 0.991 1.00 . A A . 17 TRP CE2 1 1 3 1632 1 1 13 TRP CE3 C -3.545 1.085 -0.630 1.00 . A A . 17 TRP CE3 1 1 3 1633 1 1 13 TRP CG C -5.811 -0.200 -0.867 1.00 . A A . 17 TRP CG 1 1 3 1634 1 1 13 TRP CH2 C -3.324 2.377 1.414 1.00 . A A . 17 TRP CH2 1 1 3 1635 1 1 13 TRP CZ2 C -4.600 1.966 1.817 1.00 . A A . 17 TRP CZ2 1 1 3 1636 1 1 13 TRP CZ3 C -2.803 1.937 0.194 1.00 . A A . 17 TRP CZ3 1 1 3 1637 1 1 13 TRP H H -7.890 -1.108 -3.646 1.00 . A A . 17 TRP H 1 1 3 1638 1 1 13 TRP HA H -5.946 1.069 -2.976 1.00 . A A . 17 TRP HA 1 1 3 1639 1 1 13 TRP HB2 H -6.393 -1.756 -2.173 1.00 . A A . 17 TRP HB2 1 1 3 1640 1 1 13 TRP HB3 H -4.710 -1.250 -2.332 1.00 . A A . 17 TRP HB3 1 1 3 1641 1 1 13 TRP HD1 H -7.781 -0.799 -0.199 1.00 . A A . 17 TRP HD1 1 1 3 1642 1 1 13 TRP HE1 H -7.192 0.676 1.840 1.00 . A A . 17 TRP HE1 1 1 3 1643 1 1 13 TRP HE3 H -3.131 0.751 -1.570 1.00 . A A . 17 TRP HE3 1 1 3 1644 1 1 13 TRP HH2 H -2.742 3.033 2.042 1.00 . A A . 17 TRP HH2 1 1 3 1645 1 1 13 TRP HZ2 H -5.009 2.302 2.759 1.00 . A A . 17 TRP HZ2 1 1 3 1646 1 1 13 TRP HZ3 H -1.824 2.257 -0.114 1.00 . A A . 17 TRP HZ3 1 1 3 1647 1 1 13 TRP N N -7.571 -0.197 -3.497 1.00 . A A . 17 TRP N 1 1 3 1648 1 1 13 TRP NE1 N -6.590 0.538 1.079 1.00 . A A . 17 TRP NE1 1 1 3 1649 1 1 13 TRP O O -5.639 -1.184 -5.285 1.00 . A A . 17 TRP O 1 1 3 1650 1 1 14 GLU C C -2.001 0.254 -5.767 1.00 . A A . 18 GLU C 1 1 3 1651 1 1 14 GLU CA C -3.500 0.232 -6.070 1.00 . A A . 18 GLU CA 1 1 3 1652 1 1 14 GLU CB C -3.844 1.368 -7.034 1.00 . A A . 18 GLU CB 1 1 3 1653 1 1 14 GLU CD C -6.147 0.681 -7.718 1.00 . A A . 18 GLU CD 1 1 3 1654 1 1 14 GLU CG C -4.696 0.825 -8.182 1.00 . A A . 18 GLU CG 1 1 3 1655 1 1 14 GLU H H -4.061 1.247 -4.247 1.00 . A A . 18 GLU H 1 1 3 1656 1 1 14 GLU HA H -3.784 -0.713 -6.504 1.00 . A A . 18 GLU HA 1 1 3 1657 1 1 14 GLU HB2 H -4.388 2.136 -6.510 1.00 . A A . 18 GLU HB2 1 1 3 1658 1 1 14 GLU HB3 H -2.932 1.785 -7.433 1.00 . A A . 18 GLU HB3 1 1 3 1659 1 1 14 GLU HG2 H -4.651 1.509 -9.016 1.00 . A A . 18 GLU HG2 1 1 3 1660 1 1 14 GLU HG3 H -4.317 -0.139 -8.486 1.00 . A A . 18 GLU HG3 1 1 3 1661 1 1 14 GLU N N -4.303 0.502 -4.842 1.00 . A A . 18 GLU N 1 1 3 1662 1 1 14 GLU O O -1.383 1.305 -5.755 1.00 . A A . 18 GLU O 1 1 3 1663 1 1 14 GLU OE1 O -6.668 1.633 -7.160 1.00 . A A . 18 GLU OE1 1 1 3 1664 1 1 14 GLU OE2 O -6.713 -0.379 -7.928 1.00 . A A . 18 GLU OE2 1 1 3 1665 1 1 15 MET C C 0.775 -0.461 -6.563 1.00 . A A . 19 MET C 1 1 3 1666 1 1 15 MET CA C 0.061 -0.890 -5.288 1.00 . A A . 19 MET CA 1 1 3 1667 1 1 15 MET CB C 0.444 -2.324 -4.929 1.00 . A A . 19 MET CB 1 1 3 1668 1 1 15 MET CE C -1.743 -4.328 -4.296 1.00 . A A . 19 MET CE 1 1 3 1669 1 1 15 MET CG C 0.042 -3.280 -6.058 1.00 . A A . 19 MET CG 1 1 3 1670 1 1 15 MET H H -1.896 -1.726 -5.573 1.00 . A A . 19 MET H 1 1 3 1671 1 1 15 MET HA H 0.303 -0.223 -4.477 1.00 . A A . 19 MET HA 1 1 3 1672 1 1 15 MET HB2 H 1.508 -2.369 -4.794 1.00 . A A . 19 MET HB2 1 1 3 1673 1 1 15 MET HB3 H -0.041 -2.612 -4.010 1.00 . A A . 19 MET HB3 1 1 3 1674 1 1 15 MET HE1 H -1.838 -3.253 -4.374 1.00 . A A . 19 MET HE1 1 1 3 1675 1 1 15 MET HE2 H -1.529 -4.593 -3.273 1.00 . A A . 19 MET HE2 1 1 3 1676 1 1 15 MET HE3 H -2.666 -4.800 -4.601 1.00 . A A . 19 MET HE3 1 1 3 1677 1 1 15 MET HG2 H -0.801 -2.878 -6.595 1.00 . A A . 19 MET HG2 1 1 3 1678 1 1 15 MET HG3 H 0.874 -3.398 -6.737 1.00 . A A . 19 MET HG3 1 1 3 1679 1 1 15 MET N N -1.399 -0.886 -5.548 1.00 . A A . 19 MET N 1 1 3 1680 1 1 15 MET O O 0.595 -1.038 -7.618 1.00 . A A . 19 MET O 1 1 3 1681 1 1 15 MET SD S -0.396 -4.893 -5.363 1.00 . A A . 19 MET SD 1 1 3 1682 1 1 16 ALA C C 3.583 1.716 -7.194 1.00 . A A . 20 ALA C 1 1 3 1683 1 1 16 ALA CA C 2.302 1.035 -7.671 1.00 . A A . 20 ALA CA 1 1 3 1684 1 1 16 ALA CB C 1.321 2.009 -8.339 1.00 . A A . 20 ALA CB 1 1 3 1685 1 1 16 ALA H H 1.701 0.996 -5.611 1.00 . A A . 20 ALA H 1 1 3 1686 1 1 16 ALA HA H 2.530 0.217 -8.336 1.00 . A A . 20 ALA HA 1 1 3 1687 1 1 16 ALA HB1 H 0.557 2.290 -7.626 1.00 . A A . 20 ALA HB1 1 1 3 1688 1 1 16 ALA HB2 H 0.857 1.527 -9.186 1.00 . A A . 20 ALA HB2 1 1 3 1689 1 1 16 ALA HB3 H 1.843 2.890 -8.669 1.00 . A A . 20 ALA HB3 1 1 3 1690 1 1 16 ALA N N 1.575 0.549 -6.474 1.00 . A A . 20 ALA N 1 1 3 1691 1 1 16 ALA O O 4.100 1.365 -6.153 1.00 . A A . 20 ALA O 1 1 3 1692 1 1 17 LYS C C 5.245 4.821 -7.357 1.00 . A A . 21 LYS C 1 1 3 1693 1 1 17 LYS CA C 5.371 3.306 -7.418 1.00 . A A . 21 LYS CA 1 1 3 1694 1 1 17 LYS CB C 6.459 2.886 -8.406 1.00 . A A . 21 LYS CB 1 1 3 1695 1 1 17 LYS CD C 7.288 3.297 -10.726 1.00 . A A . 21 LYS CD 1 1 3 1696 1 1 17 LYS CE C 6.857 3.527 -12.177 1.00 . A A . 21 LYS CE 1 1 3 1697 1 1 17 LYS CG C 6.056 3.308 -9.820 1.00 . A A . 21 LYS CG 1 1 3 1698 1 1 17 LYS H H 3.715 2.951 -8.756 1.00 . A A . 21 LYS H 1 1 3 1699 1 1 17 LYS HA H 5.600 2.933 -6.439 1.00 . A A . 21 LYS HA 1 1 3 1700 1 1 17 LYS HB2 H 7.391 3.364 -8.139 1.00 . A A . 21 LYS HB2 1 1 3 1701 1 1 17 LYS HB3 H 6.582 1.814 -8.371 1.00 . A A . 21 LYS HB3 1 1 3 1702 1 1 17 LYS HD2 H 7.966 4.082 -10.423 1.00 . A A . 21 LYS HD2 1 1 3 1703 1 1 17 LYS HD3 H 7.785 2.341 -10.646 1.00 . A A . 21 LYS HD3 1 1 3 1704 1 1 17 LYS HE2 H 7.602 3.143 -12.856 1.00 . A A . 21 LYS HE2 1 1 3 1705 1 1 17 LYS HE3 H 5.900 3.062 -12.362 1.00 . A A . 21 LYS HE3 1 1 3 1706 1 1 17 LYS HG2 H 5.319 2.618 -10.205 1.00 . A A . 21 LYS HG2 1 1 3 1707 1 1 17 LYS HG3 H 5.638 4.304 -9.793 1.00 . A A . 21 LYS HG3 1 1 3 1708 1 1 17 LYS HZ1 H 6.216 5.392 -11.504 1.00 . A A . 21 LYS HZ1 1 1 3 1709 1 1 17 LYS HZ2 H 6.252 5.239 -13.196 1.00 . A A . 21 LYS HZ2 1 1 3 1710 1 1 17 LYS HZ3 H 7.699 5.427 -12.326 1.00 . A A . 21 LYS HZ3 1 1 3 1711 1 1 17 LYS N N 4.118 2.668 -7.911 1.00 . A A . 21 LYS N 1 1 3 1712 1 1 17 LYS NZ N 6.747 5.008 -12.311 1.00 . A A . 21 LYS NZ 1 1 3 1713 1 1 17 LYS O O 4.386 5.418 -7.973 1.00 . A A . 21 LYS O 1 1 3 1714 1 1 18 THR C C 7.386 7.574 -6.811 1.00 . A A . 22 THR C 1 1 3 1715 1 1 18 THR CA C 6.040 6.933 -6.472 1.00 . A A . 22 THR CA 1 1 3 1716 1 1 18 THR CB C 5.649 7.230 -5.014 1.00 . A A . 22 THR CB 1 1 3 1717 1 1 18 THR CG2 C 6.379 6.297 -4.034 1.00 . A A . 22 THR CG2 1 1 3 1718 1 1 18 THR H H 6.789 4.929 -6.101 1.00 . A A . 22 THR H 1 1 3 1719 1 1 18 THR HA H 5.278 7.318 -7.131 1.00 . A A . 22 THR HA 1 1 3 1720 1 1 18 THR HB H 4.585 7.099 -4.904 1.00 . A A . 22 THR HB 1 1 3 1721 1 1 18 THR HG1 H 5.309 9.144 -5.097 1.00 . A A . 22 THR HG1 1 1 3 1722 1 1 18 THR HG21 H 6.002 6.462 -3.034 1.00 . A A . 22 THR HG21 1 1 3 1723 1 1 18 THR HG22 H 7.440 6.508 -4.055 1.00 . A A . 22 THR HG22 1 1 3 1724 1 1 18 THR HG23 H 6.212 5.270 -4.314 1.00 . A A . 22 THR HG23 1 1 3 1725 1 1 18 THR N N 6.105 5.445 -6.596 1.00 . A A . 22 THR N 1 1 3 1726 1 1 18 THR O O 8.348 6.906 -7.131 1.00 . A A . 22 THR O 1 1 3 1727 1 1 18 THR OG1 O 5.982 8.578 -4.711 1.00 . A A . 22 THR OG1 1 1 3 1728 1 1 19 SER C C 9.780 9.311 -6.010 1.00 . A A . 23 SER C 1 1 3 1729 1 1 19 SER CA C 8.717 9.591 -7.074 1.00 . A A . 23 SER CA 1 1 3 1730 1 1 19 SER CB C 8.346 11.073 -7.083 1.00 . A A . 23 SER CB 1 1 3 1731 1 1 19 SER H H 6.651 9.388 -6.492 1.00 . A A . 23 SER H 1 1 3 1732 1 1 19 SER HA H 9.076 9.296 -8.048 1.00 . A A . 23 SER HA 1 1 3 1733 1 1 19 SER HB2 H 7.569 11.246 -7.813 1.00 . A A . 23 SER HB2 1 1 3 1734 1 1 19 SER HB3 H 7.991 11.361 -6.105 1.00 . A A . 23 SER HB3 1 1 3 1735 1 1 19 SER HG H 9.545 11.894 -8.375 1.00 . A A . 23 SER HG 1 1 3 1736 1 1 19 SER N N 7.448 8.877 -6.750 1.00 . A A . 23 SER N 1 1 3 1737 1 1 19 SER O O 9.903 10.028 -5.037 1.00 . A A . 23 SER O 1 1 3 1738 1 1 19 SER OG O 9.490 11.846 -7.418 1.00 . A A . 23 SER OG 1 1 3 1739 1 1 20 SER C C 12.302 6.622 -5.581 1.00 . A A . 24 SER C 1 1 3 1740 1 1 20 SER CA C 11.620 7.933 -5.195 1.00 . A A . 24 SER CA 1 1 3 1741 1 1 20 SER CB C 10.904 7.778 -3.848 1.00 . A A . 24 SER CB 1 1 3 1742 1 1 20 SER H H 10.434 7.713 -6.986 1.00 . A A . 24 SER H 1 1 3 1743 1 1 20 SER HA H 12.342 8.726 -5.139 1.00 . A A . 24 SER HA 1 1 3 1744 1 1 20 SER HB2 H 9.843 7.922 -3.985 1.00 . A A . 24 SER HB2 1 1 3 1745 1 1 20 SER HB3 H 11.085 6.788 -3.456 1.00 . A A . 24 SER HB3 1 1 3 1746 1 1 20 SER HG H 12.325 8.554 -2.771 1.00 . A A . 24 SER HG 1 1 3 1747 1 1 20 SER N N 10.552 8.271 -6.190 1.00 . A A . 24 SER N 1 1 3 1748 1 1 20 SER O O 13.472 6.418 -5.332 1.00 . A A . 24 SER O 1 1 3 1749 1 1 20 SER OG O 11.399 8.745 -2.934 1.00 . A A . 24 SER OG 1 1 3 1750 1 1 21 GLY C C 11.606 3.337 -5.647 1.00 . A A . 25 GLY C 1 1 3 1751 1 1 21 GLY CA C 12.153 4.420 -6.577 1.00 . A A . 25 GLY CA 1 1 3 1752 1 1 21 GLY H H 10.626 5.917 -6.357 1.00 . A A . 25 GLY H 1 1 3 1753 1 1 21 GLY HA2 H 11.879 4.196 -7.596 1.00 . A A . 25 GLY HA2 1 1 3 1754 1 1 21 GLY HA3 H 13.229 4.463 -6.491 1.00 . A A . 25 GLY HA3 1 1 3 1755 1 1 21 GLY N N 11.567 5.729 -6.178 1.00 . A A . 25 GLY N 1 1 3 1756 1 1 21 GLY O O 12.243 2.331 -5.402 1.00 . A A . 25 GLY O 1 1 3 1757 1 1 22 GLN C C 8.369 2.286 -4.557 1.00 . A A . 26 GLN C 1 1 3 1758 1 1 22 GLN CA C 9.837 2.537 -4.199 1.00 . A A . 26 GLN CA 1 1 3 1759 1 1 22 GLN CB C 9.941 3.171 -2.811 1.00 . A A . 26 GLN CB 1 1 3 1760 1 1 22 GLN CD C 10.710 1.480 -1.141 1.00 . A A . 26 GLN CD 1 1 3 1761 1 1 22 GLN CG C 9.486 2.166 -1.752 1.00 . A A . 26 GLN CG 1 1 3 1762 1 1 22 GLN H H 9.939 4.365 -5.329 1.00 . A A . 26 GLN H 1 1 3 1763 1 1 22 GLN HA H 10.397 1.617 -4.228 1.00 . A A . 26 GLN HA 1 1 3 1764 1 1 22 GLN HB2 H 10.966 3.455 -2.623 1.00 . A A . 26 GLN HB2 1 1 3 1765 1 1 22 GLN HB3 H 9.313 4.049 -2.768 1.00 . A A . 26 GLN HB3 1 1 3 1766 1 1 22 GLN HE21 H 10.179 1.885 0.729 1.00 . A A . 26 GLN HE21 1 1 3 1767 1 1 22 GLN HE22 H 11.631 1.024 0.558 1.00 . A A . 26 GLN HE22 1 1 3 1768 1 1 22 GLN HG2 H 8.939 2.684 -0.978 1.00 . A A . 26 GLN HG2 1 1 3 1769 1 1 22 GLN HG3 H 8.848 1.426 -2.209 1.00 . A A . 26 GLN HG3 1 1 3 1770 1 1 22 GLN N N 10.431 3.543 -5.122 1.00 . A A . 26 GLN N 1 1 3 1771 1 1 22 GLN NE2 N 10.851 1.461 0.156 1.00 . A A . 26 GLN NE2 1 1 3 1772 1 1 22 GLN O O 7.686 3.154 -5.089 1.00 . A A . 26 GLN O 1 1 3 1773 1 1 22 GLN OE1 O 11.544 0.956 -1.851 1.00 . A A . 26 GLN OE1 1 1 3 1774 1 1 23 ARG C C 5.552 1.356 -3.495 1.00 . A A . 27 ARG C 1 1 3 1775 1 1 23 ARG CA C 6.454 0.807 -4.579 1.00 . A A . 27 ARG CA 1 1 3 1776 1 1 23 ARG CB C 6.313 -0.715 -4.626 1.00 . A A . 27 ARG CB 1 1 3 1777 1 1 23 ARG CD C 7.425 -1.358 -6.767 1.00 . A A . 27 ARG CD 1 1 3 1778 1 1 23 ARG CG C 6.079 -1.137 -6.074 1.00 . A A . 27 ARG CG 1 1 3 1779 1 1 23 ARG CZ C 7.246 -3.793 -6.711 1.00 . A A . 27 ARG CZ 1 1 3 1780 1 1 23 ARG H H 8.438 0.430 -3.835 1.00 . A A . 27 ARG H 1 1 3 1781 1 1 23 ARG HA H 6.188 1.229 -5.535 1.00 . A A . 27 ARG HA 1 1 3 1782 1 1 23 ARG HB2 H 7.202 -1.183 -4.241 1.00 . A A . 27 ARG HB2 1 1 3 1783 1 1 23 ARG HB3 H 5.463 -1.015 -4.024 1.00 . A A . 27 ARG HB3 1 1 3 1784 1 1 23 ARG HD2 H 7.302 -1.342 -7.840 1.00 . A A . 27 ARG HD2 1 1 3 1785 1 1 23 ARG HD3 H 8.135 -0.604 -6.459 1.00 . A A . 27 ARG HD3 1 1 3 1786 1 1 23 ARG HE H 8.640 -2.788 -5.712 1.00 . A A . 27 ARG HE 1 1 3 1787 1 1 23 ARG HG2 H 5.505 -2.051 -6.097 1.00 . A A . 27 ARG HG2 1 1 3 1788 1 1 23 ARG HG3 H 5.534 -0.352 -6.583 1.00 . A A . 27 ARG HG3 1 1 3 1789 1 1 23 ARG HH11 H 5.885 -2.836 -7.840 1.00 . A A . 27 ARG HH11 1 1 3 1790 1 1 23 ARG HH12 H 5.753 -4.559 -7.807 1.00 . A A . 27 ARG HH12 1 1 3 1791 1 1 23 ARG HH21 H 8.447 -5.024 -5.686 1.00 . A A . 27 ARG HH21 1 1 3 1792 1 1 23 ARG HH22 H 7.191 -5.791 -6.598 1.00 . A A . 27 ARG HH22 1 1 3 1793 1 1 23 ARG N N 7.876 1.107 -4.265 1.00 . A A . 27 ARG N 1 1 3 1794 1 1 23 ARG NE N 7.870 -2.709 -6.314 1.00 . A A . 27 ARG NE 1 1 3 1795 1 1 23 ARG NH1 N 6.215 -3.723 -7.516 1.00 . A A . 27 ARG NH1 1 1 3 1796 1 1 23 ARG NH2 N 7.660 -4.961 -6.299 1.00 . A A . 27 ARG NH2 1 1 3 1797 1 1 23 ARG O O 5.601 0.934 -2.356 1.00 . A A . 27 ARG O 1 1 3 1798 1 1 24 TYR C C 2.394 2.236 -3.086 1.00 . A A . 28 TYR C 1 1 3 1799 1 1 24 TYR CA C 3.771 2.808 -2.837 1.00 . A A . 28 TYR CA 1 1 3 1800 1 1 24 TYR CB C 3.814 4.345 -2.954 1.00 . A A . 28 TYR CB 1 1 3 1801 1 1 24 TYR CD1 C 2.658 4.114 -5.224 1.00 . A A . 28 TYR CD1 1 1 3 1802 1 1 24 TYR CD2 C 2.515 6.217 -4.034 1.00 . A A . 28 TYR CD2 1 1 3 1803 1 1 24 TYR CE1 C 1.916 4.657 -6.272 1.00 . A A . 28 TYR CE1 1 1 3 1804 1 1 24 TYR CE2 C 1.764 6.754 -5.079 1.00 . A A . 28 TYR CE2 1 1 3 1805 1 1 24 TYR CG C 2.964 4.891 -4.097 1.00 . A A . 28 TYR CG 1 1 3 1806 1 1 24 TYR CZ C 1.467 5.978 -6.201 1.00 . A A . 28 TYR CZ 1 1 3 1807 1 1 24 TYR H H 4.669 2.562 -4.778 1.00 . A A . 28 TYR H 1 1 3 1808 1 1 24 TYR HA H 4.094 2.510 -1.851 1.00 . A A . 28 TYR HA 1 1 3 1809 1 1 24 TYR HB2 H 3.459 4.773 -2.027 1.00 . A A . 28 TYR HB2 1 1 3 1810 1 1 24 TYR HB3 H 4.837 4.651 -3.107 1.00 . A A . 28 TYR HB3 1 1 3 1811 1 1 24 TYR HD1 H 2.982 3.093 -5.283 1.00 . A A . 28 TYR HD1 1 1 3 1812 1 1 24 TYR HD2 H 2.737 6.822 -3.169 1.00 . A A . 28 TYR HD2 1 1 3 1813 1 1 24 TYR HE1 H 1.683 4.055 -7.132 1.00 . A A . 28 TYR HE1 1 1 3 1814 1 1 24 TYR HE2 H 1.418 7.771 -5.023 1.00 . A A . 28 TYR HE2 1 1 3 1815 1 1 24 TYR HH H 1.022 7.428 -7.356 1.00 . A A . 28 TYR HH 1 1 3 1816 1 1 24 TYR N N 4.706 2.265 -3.847 1.00 . A A . 28 TYR N 1 1 3 1817 1 1 24 TYR O O 2.173 1.504 -4.031 1.00 . A A . 28 TYR O 1 1 3 1818 1 1 24 TYR OH O 0.743 6.517 -7.241 1.00 . A A . 28 TYR OH 1 1 3 1819 1 1 25 PHE C C -0.857 3.148 -2.464 1.00 . A A . 29 PHE C 1 1 3 1820 1 1 25 PHE CA C 0.128 2.000 -2.408 1.00 . A A . 29 PHE CA 1 1 3 1821 1 1 25 PHE CB C -0.041 1.067 -1.214 1.00 . A A . 29 PHE CB 1 1 3 1822 1 1 25 PHE CD1 C 2.319 0.141 -1.102 1.00 . A A . 29 PHE CD1 1 1 3 1823 1 1 25 PHE CD2 C 0.540 -1.266 -1.954 1.00 . A A . 29 PHE CD2 1 1 3 1824 1 1 25 PHE CE1 C 3.243 -0.883 -1.349 1.00 . A A . 29 PHE CE1 1 1 3 1825 1 1 25 PHE CE2 C 1.464 -2.291 -2.189 1.00 . A A . 29 PHE CE2 1 1 3 1826 1 1 25 PHE CG C 0.961 -0.053 -1.407 1.00 . A A . 29 PHE CG 1 1 3 1827 1 1 25 PHE CZ C 2.814 -2.100 -1.890 1.00 . A A . 29 PHE CZ 1 1 3 1828 1 1 25 PHE H H 1.692 3.124 -1.481 1.00 . A A . 29 PHE H 1 1 3 1829 1 1 25 PHE HA H 0.077 1.429 -3.323 1.00 . A A . 29 PHE HA 1 1 3 1830 1 1 25 PHE HB2 H 0.159 1.598 -0.294 1.00 . A A . 29 PHE HB2 1 1 3 1831 1 1 25 PHE HB3 H -1.044 0.667 -1.199 1.00 . A A . 29 PHE HB3 1 1 3 1832 1 1 25 PHE HD1 H 2.655 1.079 -0.681 1.00 . A A . 29 PHE HD1 1 1 3 1833 1 1 25 PHE HD2 H -0.500 -1.414 -2.187 1.00 . A A . 29 PHE HD2 1 1 3 1834 1 1 25 PHE HE1 H 4.286 -0.735 -1.121 1.00 . A A . 29 PHE HE1 1 1 3 1835 1 1 25 PHE HE2 H 1.134 -3.229 -2.612 1.00 . A A . 29 PHE HE2 1 1 3 1836 1 1 25 PHE HZ H 3.526 -2.887 -2.087 1.00 . A A . 29 PHE HZ 1 1 3 1837 1 1 25 PHE N N 1.482 2.542 -2.240 1.00 . A A . 29 PHE N 1 1 3 1838 1 1 25 PHE O O -1.150 3.808 -1.483 1.00 . A A . 29 PHE O 1 1 3 1839 1 1 26 LEU C C -3.662 4.135 -3.407 1.00 . A A . 30 LEU C 1 1 3 1840 1 1 26 LEU CA C -2.264 4.522 -3.889 1.00 . A A . 30 LEU CA 1 1 3 1841 1 1 26 LEU CB C -2.207 4.705 -5.414 1.00 . A A . 30 LEU CB 1 1 3 1842 1 1 26 LEU CD1 C -1.153 6.962 -5.031 1.00 . A A . 30 LEU CD1 1 1 3 1843 1 1 26 LEU CD2 C -1.889 6.285 -7.302 1.00 . A A . 30 LEU CD2 1 1 3 1844 1 1 26 LEU CG C -2.209 6.185 -5.813 1.00 . A A . 30 LEU CG 1 1 3 1845 1 1 26 LEU H H -1.023 2.855 -4.412 1.00 . A A . 30 LEU H 1 1 3 1846 1 1 26 LEU HA H -1.929 5.412 -3.389 1.00 . A A . 30 LEU HA 1 1 3 1847 1 1 26 LEU HB2 H -1.303 4.245 -5.786 1.00 . A A . 30 LEU HB2 1 1 3 1848 1 1 26 LEU HB3 H -3.053 4.220 -5.864 1.00 . A A . 30 LEU HB3 1 1 3 1849 1 1 26 LEU HD11 H -0.498 7.478 -5.720 1.00 . A A . 30 LEU HD11 1 1 3 1850 1 1 26 LEU HD12 H -0.571 6.281 -4.428 1.00 . A A . 30 LEU HD12 1 1 3 1851 1 1 26 LEU HD13 H -1.643 7.681 -4.398 1.00 . A A . 30 LEU HD13 1 1 3 1852 1 1 26 LEU HD21 H -2.796 6.184 -7.874 1.00 . A A . 30 LEU HD21 1 1 3 1853 1 1 26 LEU HD22 H -1.201 5.496 -7.572 1.00 . A A . 30 LEU HD22 1 1 3 1854 1 1 26 LEU HD23 H -1.434 7.243 -7.506 1.00 . A A . 30 LEU HD23 1 1 3 1855 1 1 26 LEU HG H -3.182 6.608 -5.624 1.00 . A A . 30 LEU HG 1 1 3 1856 1 1 26 LEU N N -1.323 3.404 -3.652 1.00 . A A . 30 LEU N 1 1 3 1857 1 1 26 LEU O O -4.319 3.281 -3.972 1.00 . A A . 30 LEU O 1 1 3 1858 1 1 27 ASN C C -6.514 5.304 -2.469 1.00 . A A . 31 ASN C 1 1 3 1859 1 1 27 ASN CA C -5.450 4.439 -1.793 1.00 . A A . 31 ASN CA 1 1 3 1860 1 1 27 ASN CB C -5.349 4.781 -0.306 1.00 . A A . 31 ASN CB 1 1 3 1861 1 1 27 ASN CG C -6.651 4.419 0.395 1.00 . A A . 31 ASN CG 1 1 3 1862 1 1 27 ASN H H -3.546 5.430 -1.909 1.00 . A A . 31 ASN H 1 1 3 1863 1 1 27 ASN HA H -5.676 3.392 -1.918 1.00 . A A . 31 ASN HA 1 1 3 1864 1 1 27 ASN HB2 H -4.544 4.221 0.140 1.00 . A A . 31 ASN HB2 1 1 3 1865 1 1 27 ASN HB3 H -5.158 5.838 -0.192 1.00 . A A . 31 ASN HB3 1 1 3 1866 1 1 27 ASN HD21 H -5.761 4.077 2.133 1.00 . A A . 31 ASN HD21 1 1 3 1867 1 1 27 ASN HD22 H -7.436 3.846 2.116 1.00 . A A . 31 ASN HD22 1 1 3 1868 1 1 27 ASN N N -4.106 4.756 -2.347 1.00 . A A . 31 ASN N 1 1 3 1869 1 1 27 ASN ND2 N -6.616 4.088 1.654 1.00 . A A . 31 ASN ND2 1 1 3 1870 1 1 27 ASN O O -6.596 6.497 -2.235 1.00 . A A . 31 ASN O 1 1 3 1871 1 1 27 ASN OD1 O -7.709 4.439 -0.202 1.00 . A A . 31 ASN OD1 1 1 3 1872 1 1 28 HIS C C -9.631 5.624 -3.093 1.00 . A A . 32 HIS C 1 1 3 1873 1 1 28 HIS CA C -8.396 5.484 -3.993 1.00 . A A . 32 HIS CA 1 1 3 1874 1 1 28 HIS CB C -8.732 4.664 -5.239 1.00 . A A . 32 HIS CB 1 1 3 1875 1 1 28 HIS CD2 C -6.960 5.159 -7.115 1.00 . A A . 32 HIS CD2 1 1 3 1876 1 1 28 HIS CE1 C -8.039 6.715 -8.165 1.00 . A A . 32 HIS CE1 1 1 3 1877 1 1 28 HIS CG C -8.150 5.333 -6.453 1.00 . A A . 32 HIS CG 1 1 3 1878 1 1 28 HIS H H -7.238 3.747 -3.464 1.00 . A A . 32 HIS H 1 1 3 1879 1 1 28 HIS HA H -8.028 6.455 -4.283 1.00 . A A . 32 HIS HA 1 1 3 1880 1 1 28 HIS HB2 H -8.317 3.673 -5.141 1.00 . A A . 32 HIS HB2 1 1 3 1881 1 1 28 HIS HB3 H -9.805 4.595 -5.346 1.00 . A A . 32 HIS HB3 1 1 3 1882 1 1 28 HIS HD1 H -9.707 6.692 -6.920 1.00 . A A . 32 HIS HD1 1 1 3 1883 1 1 28 HIS HD2 H -6.192 4.450 -6.839 1.00 . A A . 32 HIS HD2 1 1 3 1884 1 1 28 HIS HE1 H -8.306 7.484 -8.876 1.00 . A A . 32 HIS HE1 1 1 3 1885 1 1 28 HIS N N -7.328 4.708 -3.299 1.00 . A A . 32 HIS N 1 1 3 1886 1 1 28 HIS ND1 N -8.822 6.332 -7.141 1.00 . A A . 32 HIS ND1 1 1 3 1887 1 1 28 HIS NE2 N -6.892 6.033 -8.196 1.00 . A A . 32 HIS NE2 1 1 3 1888 1 1 28 HIS O O -10.589 6.286 -3.444 1.00 . A A . 32 HIS O 1 1 3 1889 1 1 29 ILE C C -10.583 6.379 -0.144 1.00 . A A . 33 ILE C 1 1 3 1890 1 1 29 ILE CA C -10.793 5.148 -1.013 1.00 . A A . 33 ILE CA 1 1 3 1891 1 1 29 ILE CB C -10.846 3.889 -0.113 1.00 . A A . 33 ILE CB 1 1 3 1892 1 1 29 ILE CD1 C -10.458 1.386 -0.019 1.00 . A A . 33 ILE CD1 1 1 3 1893 1 1 29 ILE CG1 C -10.154 2.681 -0.785 1.00 . A A . 33 ILE CG1 1 1 3 1894 1 1 29 ILE CG2 C -12.316 3.555 0.164 1.00 . A A . 33 ILE CG2 1 1 3 1895 1 1 29 ILE H H -8.833 4.509 -1.654 1.00 . A A . 33 ILE H 1 1 3 1896 1 1 29 ILE HA H -11.706 5.240 -1.582 1.00 . A A . 33 ILE HA 1 1 3 1897 1 1 29 ILE HB H -10.352 4.108 0.826 1.00 . A A . 33 ILE HB 1 1 3 1898 1 1 29 ILE HD11 H -9.605 0.728 -0.071 1.00 . A A . 33 ILE HD11 1 1 3 1899 1 1 29 ILE HD12 H -11.316 0.900 -0.461 1.00 . A A . 33 ILE HD12 1 1 3 1900 1 1 29 ILE HD13 H -10.671 1.620 1.014 1.00 . A A . 33 ILE HD13 1 1 3 1901 1 1 29 ILE HG12 H -10.502 2.592 -1.800 1.00 . A A . 33 ILE HG12 1 1 3 1902 1 1 29 ILE HG13 H -9.086 2.844 -0.785 1.00 . A A . 33 ILE HG13 1 1 3 1903 1 1 29 ILE HG21 H -12.420 3.200 1.179 1.00 . A A . 33 ILE HG21 1 1 3 1904 1 1 29 ILE HG22 H -12.648 2.788 -0.521 1.00 . A A . 33 ILE HG22 1 1 3 1905 1 1 29 ILE HG23 H -12.917 4.442 0.030 1.00 . A A . 33 ILE HG23 1 1 3 1906 1 1 29 ILE N N -9.615 5.023 -1.931 1.00 . A A . 33 ILE N 1 1 3 1907 1 1 29 ILE O O -11.339 7.329 -0.186 1.00 . A A . 33 ILE O 1 1 3 1908 1 1 30 ASP C C -8.311 8.514 0.766 1.00 . A A . 34 ASP C 1 1 3 1909 1 1 30 ASP CA C -9.238 7.535 1.501 1.00 . A A . 34 ASP CA 1 1 3 1910 1 1 30 ASP CB C -8.536 6.947 2.726 1.00 . A A . 34 ASP CB 1 1 3 1911 1 1 30 ASP CG C -9.204 7.472 3.998 1.00 . A A . 34 ASP CG 1 1 3 1912 1 1 30 ASP H H -8.943 5.583 0.626 1.00 . A A . 34 ASP H 1 1 3 1913 1 1 30 ASP HA H -10.150 8.028 1.799 1.00 . A A . 34 ASP HA 1 1 3 1914 1 1 30 ASP HB2 H -8.609 5.870 2.699 1.00 . A A . 34 ASP HB2 1 1 3 1915 1 1 30 ASP HB3 H -7.496 7.239 2.719 1.00 . A A . 34 ASP HB3 1 1 3 1916 1 1 30 ASP N N -9.540 6.365 0.630 1.00 . A A . 34 ASP N 1 1 3 1917 1 1 30 ASP O O -7.793 9.445 1.350 1.00 . A A . 34 ASP O 1 1 3 1918 1 1 30 ASP OD1 O -9.527 8.648 4.031 1.00 . A A . 34 ASP OD1 1 1 3 1919 1 1 30 ASP OD2 O -9.384 6.688 4.916 1.00 . A A . 34 ASP OD2 1 1 3 1920 1 1 31 GLN C C -5.874 9.422 -0.542 1.00 . A A . 35 GLN C 1 1 3 1921 1 1 31 GLN CA C -7.202 9.230 -1.279 1.00 . A A . 35 GLN CA 1 1 3 1922 1 1 31 GLN CB C -7.965 10.551 -1.360 1.00 . A A . 35 GLN CB 1 1 3 1923 1 1 31 GLN CD C -9.711 11.492 -2.880 1.00 . A A . 35 GLN CD 1 1 3 1924 1 1 31 GLN CG C -9.342 10.311 -1.981 1.00 . A A . 35 GLN CG 1 1 3 1925 1 1 31 GLN H H -8.520 7.557 -0.968 1.00 . A A . 35 GLN H 1 1 3 1926 1 1 31 GLN HA H -7.029 8.844 -2.271 1.00 . A A . 35 GLN HA 1 1 3 1927 1 1 31 GLN HB2 H -8.084 10.960 -0.367 1.00 . A A . 35 GLN HB2 1 1 3 1928 1 1 31 GLN HB3 H -7.411 11.249 -1.971 1.00 . A A . 35 GLN HB3 1 1 3 1929 1 1 31 GLN HE21 H -11.639 11.021 -2.950 1.00 . A A . 35 GLN HE21 1 1 3 1930 1 1 31 GLN HE22 H -11.199 12.407 -3.824 1.00 . A A . 35 GLN HE22 1 1 3 1931 1 1 31 GLN HG2 H -9.317 9.404 -2.569 1.00 . A A . 35 GLN HG2 1 1 3 1932 1 1 31 GLN HG3 H -10.078 10.211 -1.198 1.00 . A A . 35 GLN HG3 1 1 3 1933 1 1 31 GLN N N -8.095 8.312 -0.511 1.00 . A A . 35 GLN N 1 1 3 1934 1 1 31 GLN NE2 N -10.953 11.654 -3.248 1.00 . A A . 35 GLN NE2 1 1 3 1935 1 1 31 GLN O O -5.645 10.437 0.085 1.00 . A A . 35 GLN O 1 1 3 1936 1 1 31 GLN OE1 O -8.861 12.277 -3.251 1.00 . A A . 35 GLN OE1 1 1 3 1937 1 1 32 THR C C -2.640 7.655 -0.490 1.00 . A A . 36 THR C 1 1 3 1938 1 1 32 THR CA C -3.689 8.602 0.100 1.00 . A A . 36 THR CA 1 1 3 1939 1 1 32 THR CB C -3.985 8.230 1.554 1.00 . A A . 36 THR CB 1 1 3 1940 1 1 32 THR CG2 C -4.507 9.459 2.301 1.00 . A A . 36 THR CG2 1 1 3 1941 1 1 32 THR H H -5.200 7.638 -1.119 1.00 . A A . 36 THR H 1 1 3 1942 1 1 32 THR HA H -3.345 9.623 0.046 1.00 . A A . 36 THR HA 1 1 3 1943 1 1 32 THR HB H -3.080 7.885 2.029 1.00 . A A . 36 THR HB 1 1 3 1944 1 1 32 THR HG1 H -5.036 6.891 2.493 1.00 . A A . 36 THR HG1 1 1 3 1945 1 1 32 THR HG21 H -5.580 9.509 2.207 1.00 . A A . 36 THR HG21 1 1 3 1946 1 1 32 THR HG22 H -4.066 10.351 1.879 1.00 . A A . 36 THR HG22 1 1 3 1947 1 1 32 THR HG23 H -4.240 9.386 3.345 1.00 . A A . 36 THR HG23 1 1 3 1948 1 1 32 THR N N -4.998 8.457 -0.609 1.00 . A A . 36 THR N 1 1 3 1949 1 1 32 THR O O -2.942 6.814 -1.312 1.00 . A A . 36 THR O 1 1 3 1950 1 1 32 THR OG1 O -4.964 7.201 1.589 1.00 . A A . 36 THR OG1 1 1 3 1951 1 1 33 THR C C 0.540 6.374 0.533 1.00 . A A . 37 THR C 1 1 3 1952 1 1 33 THR CA C -0.339 6.890 -0.605 1.00 . A A . 37 THR CA 1 1 3 1953 1 1 33 THR CB C 0.510 7.753 -1.543 1.00 . A A . 37 THR CB 1 1 3 1954 1 1 33 THR CG2 C -0.381 8.501 -2.529 1.00 . A A . 37 THR CG2 1 1 3 1955 1 1 33 THR H H -1.187 8.469 0.596 1.00 . A A . 37 THR H 1 1 3 1956 1 1 33 THR HA H -0.773 6.068 -1.151 1.00 . A A . 37 THR HA 1 1 3 1957 1 1 33 THR HB H 1.187 7.117 -2.092 1.00 . A A . 37 THR HB 1 1 3 1958 1 1 33 THR HG1 H 1.958 8.210 -0.328 1.00 . A A . 37 THR HG1 1 1 3 1959 1 1 33 THR HG21 H -1.367 8.060 -2.528 1.00 . A A . 37 THR HG21 1 1 3 1960 1 1 33 THR HG22 H 0.044 8.434 -3.519 1.00 . A A . 37 THR HG22 1 1 3 1961 1 1 33 THR HG23 H -0.450 9.538 -2.238 1.00 . A A . 37 THR HG23 1 1 3 1962 1 1 33 THR N N -1.408 7.786 -0.071 1.00 . A A . 37 THR N 1 1 3 1963 1 1 33 THR O O 1.153 7.138 1.252 1.00 . A A . 37 THR O 1 1 3 1964 1 1 33 THR OG1 O 1.255 8.686 -0.776 1.00 . A A . 37 THR OG1 1 1 3 1965 1 1 34 THR C C 2.565 3.630 1.134 1.00 . A A . 38 THR C 1 1 3 1966 1 1 34 THR CA C 1.506 4.534 1.765 1.00 . A A . 38 THR CA 1 1 3 1967 1 1 34 THR CB C 0.578 3.742 2.693 1.00 . A A . 38 THR CB 1 1 3 1968 1 1 34 THR CG2 C -0.014 2.550 1.943 1.00 . A A . 38 THR CG2 1 1 3 1969 1 1 34 THR H H 0.146 4.479 0.080 1.00 . A A . 38 THR H 1 1 3 1970 1 1 34 THR HA H 1.977 5.338 2.311 1.00 . A A . 38 THR HA 1 1 3 1971 1 1 34 THR HB H -0.221 4.381 3.034 1.00 . A A . 38 THR HB 1 1 3 1972 1 1 34 THR HG1 H 1.072 3.805 4.573 1.00 . A A . 38 THR HG1 1 1 3 1973 1 1 34 THR HG21 H -0.442 2.893 1.016 1.00 . A A . 38 THR HG21 1 1 3 1974 1 1 34 THR HG22 H -0.784 2.091 2.546 1.00 . A A . 38 THR HG22 1 1 3 1975 1 1 34 THR HG23 H 0.763 1.828 1.739 1.00 . A A . 38 THR HG23 1 1 3 1976 1 1 34 THR N N 0.633 5.085 0.687 1.00 . A A . 38 THR N 1 1 3 1977 1 1 34 THR O O 2.365 3.095 0.067 1.00 . A A . 38 THR O 1 1 3 1978 1 1 34 THR OG1 O 1.320 3.275 3.812 1.00 . A A . 38 THR OG1 1 1 3 1979 1 1 35 TRP C C 4.555 1.143 1.644 1.00 . A A . 39 TRP C 1 1 3 1980 1 1 35 TRP CA C 4.743 2.585 1.169 1.00 . A A . 39 TRP CA 1 1 3 1981 1 1 35 TRP CB C 6.093 3.132 1.661 1.00 . A A . 39 TRP CB 1 1 3 1982 1 1 35 TRP CD1 C 5.651 5.494 2.460 1.00 . A A . 39 TRP CD1 1 1 3 1983 1 1 35 TRP CD2 C 6.743 5.450 0.491 1.00 . A A . 39 TRP CD2 1 1 3 1984 1 1 35 TRP CE2 C 6.565 6.813 0.833 1.00 . A A . 39 TRP CE2 1 1 3 1985 1 1 35 TRP CE3 C 7.410 5.155 -0.714 1.00 . A A . 39 TRP CE3 1 1 3 1986 1 1 35 TRP CG C 6.150 4.629 1.546 1.00 . A A . 39 TRP CG 1 1 3 1987 1 1 35 TRP CH2 C 7.692 7.528 -1.173 1.00 . A A . 39 TRP CH2 1 1 3 1988 1 1 35 TRP CZ2 C 7.031 7.841 0.016 1.00 . A A . 39 TRP CZ2 1 1 3 1989 1 1 35 TRP CZ3 C 7.880 6.189 -1.539 1.00 . A A . 39 TRP CZ3 1 1 3 1990 1 1 35 TRP H H 3.842 3.898 2.631 1.00 . A A . 39 TRP H 1 1 3 1991 1 1 35 TRP HA H 4.696 2.630 0.092 1.00 . A A . 39 TRP HA 1 1 3 1992 1 1 35 TRP HB2 H 6.233 2.853 2.695 1.00 . A A . 39 TRP HB2 1 1 3 1993 1 1 35 TRP HB3 H 6.887 2.702 1.069 1.00 . A A . 39 TRP HB3 1 1 3 1994 1 1 35 TRP HD1 H 5.141 5.218 3.372 1.00 . A A . 39 TRP HD1 1 1 3 1995 1 1 35 TRP HE1 H 5.635 7.600 2.518 1.00 . A A . 39 TRP HE1 1 1 3 1996 1 1 35 TRP HE3 H 7.555 4.130 -1.014 1.00 . A A . 39 TRP HE3 1 1 3 1997 1 1 35 TRP HH2 H 8.058 8.319 -1.813 1.00 . A A . 39 TRP HH2 1 1 3 1998 1 1 35 TRP HZ2 H 6.882 8.870 0.302 1.00 . A A . 39 TRP HZ2 1 1 3 1999 1 1 35 TRP HZ3 H 8.393 5.950 -2.458 1.00 . A A . 39 TRP HZ3 1 1 3 2000 1 1 35 TRP N N 3.690 3.457 1.771 1.00 . A A . 39 TRP N 1 1 3 2001 1 1 35 TRP NE1 N 5.895 6.787 2.037 1.00 . A A . 39 TRP NE1 1 1 3 2002 1 1 35 TRP O O 4.477 0.223 0.854 1.00 . A A . 39 TRP O 1 1 3 2003 1 1 36 GLN C C 2.859 -0.920 3.200 1.00 . A A . 40 GLN C 1 1 3 2004 1 1 36 GLN CA C 4.293 -0.447 3.456 1.00 . A A . 40 GLN CA 1 1 3 2005 1 1 36 GLN CB C 4.564 -0.339 4.958 1.00 . A A . 40 GLN CB 1 1 3 2006 1 1 36 GLN CD C 4.231 1.441 6.679 1.00 . A A . 40 GLN CD 1 1 3 2007 1 1 36 GLN CG C 3.545 0.608 5.594 1.00 . A A . 40 GLN CG 1 1 3 2008 1 1 36 GLN H H 4.542 1.692 3.552 1.00 . A A . 40 GLN H 1 1 3 2009 1 1 36 GLN HA H 5.001 -1.121 3.001 1.00 . A A . 40 GLN HA 1 1 3 2010 1 1 36 GLN HB2 H 4.478 -1.317 5.409 1.00 . A A . 40 GLN HB2 1 1 3 2011 1 1 36 GLN HB3 H 5.560 0.046 5.116 1.00 . A A . 40 GLN HB3 1 1 3 2012 1 1 36 GLN HE21 H 5.332 2.473 5.388 1.00 . A A . 40 GLN HE21 1 1 3 2013 1 1 36 GLN HE22 H 5.559 2.878 7.019 1.00 . A A . 40 GLN HE22 1 1 3 2014 1 1 36 GLN HG2 H 3.141 1.264 4.837 1.00 . A A . 40 GLN HG2 1 1 3 2015 1 1 36 GLN HG3 H 2.745 0.033 6.036 1.00 . A A . 40 GLN HG3 1 1 3 2016 1 1 36 GLN N N 4.478 0.936 2.931 1.00 . A A . 40 GLN N 1 1 3 2017 1 1 36 GLN NE2 N 5.113 2.339 6.332 1.00 . A A . 40 GLN NE2 1 1 3 2018 1 1 36 GLN O O 2.178 -0.419 2.327 1.00 . A A . 40 GLN O 1 1 3 2019 1 1 36 GLN OE1 O 3.961 1.276 7.851 1.00 . A A . 40 GLN OE1 1 1 3 2020 1 1 37 ASP C C 0.194 -2.227 5.042 1.00 . A A . 41 ASP C 1 1 3 2021 1 1 37 ASP CA C 1.007 -2.381 3.749 1.00 . A A . 41 ASP CA 1 1 3 2022 1 1 37 ASP CB C 1.169 -3.859 3.388 1.00 . A A . 41 ASP CB 1 1 3 2023 1 1 37 ASP CG C 1.656 -3.980 1.944 1.00 . A A . 41 ASP CG 1 1 3 2024 1 1 37 ASP H H 2.961 -2.270 4.651 1.00 . A A . 41 ASP H 1 1 3 2025 1 1 37 ASP HA H 0.533 -1.853 2.937 1.00 . A A . 41 ASP HA 1 1 3 2026 1 1 37 ASP HB2 H 1.890 -4.314 4.051 1.00 . A A . 41 ASP HB2 1 1 3 2027 1 1 37 ASP HB3 H 0.219 -4.359 3.491 1.00 . A A . 41 ASP HB3 1 1 3 2028 1 1 37 ASP N N 2.397 -1.879 3.953 1.00 . A A . 41 ASP N 1 1 3 2029 1 1 37 ASP O O 0.713 -2.427 6.121 1.00 . A A . 41 ASP O 1 1 3 2030 1 1 37 ASP OD1 O 2.482 -3.172 1.547 1.00 . A A . 41 ASP OD1 1 1 3 2031 1 1 37 ASP OD2 O 1.198 -4.878 1.257 1.00 . A A . 41 ASP OD2 1 1 3 2032 1 1 38 PRO C C -2.296 -3.061 6.686 1.00 . A A . 42 PRO C 1 1 3 2033 1 1 38 PRO CA C -1.941 -1.701 6.077 1.00 . A A . 42 PRO CA 1 1 3 2034 1 1 38 PRO CB C -3.182 -1.022 5.507 1.00 . A A . 42 PRO CB 1 1 3 2035 1 1 38 PRO CD C -1.776 -1.615 3.634 1.00 . A A . 42 PRO CD 1 1 3 2036 1 1 38 PRO CG C -3.206 -1.410 4.062 1.00 . A A . 42 PRO CG 1 1 3 2037 1 1 38 PRO HA H -1.472 -1.064 6.809 1.00 . A A . 42 PRO HA 1 1 3 2038 1 1 38 PRO HB2 H -4.069 -1.381 6.006 1.00 . A A . 42 PRO HB2 1 1 3 2039 1 1 38 PRO HB3 H -3.102 0.051 5.606 1.00 . A A . 42 PRO HB3 1 1 3 2040 1 1 38 PRO HD2 H -1.698 -2.464 2.971 1.00 . A A . 42 PRO HD2 1 1 3 2041 1 1 38 PRO HD3 H -1.391 -0.726 3.158 1.00 . A A . 42 PRO HD3 1 1 3 2042 1 1 38 PRO HG2 H -3.765 -2.324 3.935 1.00 . A A . 42 PRO HG2 1 1 3 2043 1 1 38 PRO HG3 H -3.655 -0.620 3.476 1.00 . A A . 42 PRO HG3 1 1 3 2044 1 1 38 PRO N N -1.063 -1.878 4.893 1.00 . A A . 42 PRO N 1 1 3 2045 1 1 38 PRO O O -2.453 -3.193 7.884 1.00 . A A . 42 PRO O 1 1 3 2046 1 1 39 ARG C C -1.850 -6.483 5.790 1.00 . A A . 43 ARG C 1 1 3 2047 1 1 39 ARG CA C -2.767 -5.421 6.404 1.00 . A A . 43 ARG CA 1 1 3 2048 1 1 39 ARG CB C -4.217 -5.656 5.980 1.00 . A A . 43 ARG CB 1 1 3 2049 1 1 39 ARG CD C -6.199 -7.148 6.276 1.00 . A A . 43 ARG CD 1 1 3 2050 1 1 39 ARG CG C -4.822 -6.776 6.830 1.00 . A A . 43 ARG CG 1 1 3 2051 1 1 39 ARG CZ C -8.065 -8.358 7.288 1.00 . A A . 43 ARG CZ 1 1 3 2052 1 1 39 ARG H H -2.292 -3.944 4.908 1.00 . A A . 43 ARG H 1 1 3 2053 1 1 39 ARG HA H -2.691 -5.433 7.480 1.00 . A A . 43 ARG HA 1 1 3 2054 1 1 39 ARG HB2 H -4.786 -4.749 6.126 1.00 . A A . 43 ARG HB2 1 1 3 2055 1 1 39 ARG HB3 H -4.247 -5.937 4.939 1.00 . A A . 43 ARG HB3 1 1 3 2056 1 1 39 ARG HD2 H -6.815 -6.266 6.174 1.00 . A A . 43 ARG HD2 1 1 3 2057 1 1 39 ARG HD3 H -6.098 -7.649 5.324 1.00 . A A . 43 ARG HD3 1 1 3 2058 1 1 39 ARG HE H -6.200 -8.478 7.969 1.00 . A A . 43 ARG HE 1 1 3 2059 1 1 39 ARG HG2 H -4.176 -7.641 6.798 1.00 . A A . 43 ARG HG2 1 1 3 2060 1 1 39 ARG HG3 H -4.923 -6.440 7.851 1.00 . A A . 43 ARG HG3 1 1 3 2061 1 1 39 ARG HH11 H -8.517 -7.210 5.701 1.00 . A A . 43 ARG HH11 1 1 3 2062 1 1 39 ARG HH12 H -9.843 -8.063 6.411 1.00 . A A . 43 ARG HH12 1 1 3 2063 1 1 39 ARG HH21 H -7.937 -9.575 8.874 1.00 . A A . 43 ARG HH21 1 1 3 2064 1 1 39 ARG HH22 H -9.520 -9.392 8.193 1.00 . A A . 43 ARG HH22 1 1 3 2065 1 1 39 ARG N N -2.423 -4.072 5.871 1.00 . A A . 43 ARG N 1 1 3 2066 1 1 39 ARG NE N -6.782 -8.075 7.291 1.00 . A A . 43 ARG NE 1 1 3 2067 1 1 39 ARG NH1 N -8.870 -7.835 6.396 1.00 . A A . 43 ARG NH1 1 1 3 2068 1 1 39 ARG NH2 N -8.545 -9.171 8.188 1.00 . A A . 43 ARG NH2 1 1 3 2069 1 1 39 ARG O O -1.586 -6.478 4.604 1.00 . A A . 43 ARG O 1 1 3 2070 1 1 40 LYS C C 0.697 -7.822 5.277 1.00 . A A . 44 LYS C 1 1 3 2071 1 1 40 LYS CA C -0.465 -8.455 6.050 1.00 . A A . 44 LYS CA 1 1 3 2072 1 1 40 LYS CB C -1.343 -9.282 5.112 1.00 . A A . 44 LYS CB 1 1 3 2073 1 1 40 LYS CD C -3.306 -10.829 5.165 1.00 . A A . 44 LYS CD 1 1 3 2074 1 1 40 LYS CE C -3.225 -12.329 4.875 1.00 . A A . 44 LYS CE 1 1 3 2075 1 1 40 LYS CG C -2.044 -10.384 5.909 1.00 . A A . 44 LYS CG 1 1 3 2076 1 1 40 LYS H H -1.589 -7.381 7.542 1.00 . A A . 44 LYS H 1 1 3 2077 1 1 40 LYS HA H -0.094 -9.076 6.849 1.00 . A A . 44 LYS HA 1 1 3 2078 1 1 40 LYS HB2 H -2.085 -8.642 4.656 1.00 . A A . 44 LYS HB2 1 1 3 2079 1 1 40 LYS HB3 H -0.730 -9.727 4.343 1.00 . A A . 44 LYS HB3 1 1 3 2080 1 1 40 LYS HD2 H -4.173 -10.626 5.776 1.00 . A A . 44 LYS HD2 1 1 3 2081 1 1 40 LYS HD3 H -3.385 -10.285 4.236 1.00 . A A . 44 LYS HD3 1 1 3 2082 1 1 40 LYS HE2 H -2.200 -12.665 4.919 1.00 . A A . 44 LYS HE2 1 1 3 2083 1 1 40 LYS HE3 H -3.834 -12.881 5.576 1.00 . A A . 44 LYS HE3 1 1 3 2084 1 1 40 LYS HG2 H -1.378 -11.226 6.021 1.00 . A A . 44 LYS HG2 1 1 3 2085 1 1 40 LYS HG3 H -2.315 -10.007 6.884 1.00 . A A . 44 LYS HG3 1 1 3 2086 1 1 40 LYS HZ1 H -3.518 -13.420 3.127 1.00 . A A . 44 LYS HZ1 1 1 3 2087 1 1 40 LYS HZ2 H -3.344 -11.749 2.879 1.00 . A A . 44 LYS HZ2 1 1 3 2088 1 1 40 LYS HZ3 H -4.795 -12.371 3.508 1.00 . A A . 44 LYS HZ3 1 1 3 2089 1 1 40 LYS N N -1.364 -7.394 6.587 1.00 . A A . 44 LYS N 1 1 3 2090 1 1 40 LYS NZ N -3.760 -12.479 3.493 1.00 . A A . 44 LYS NZ 1 1 3 2091 1 1 40 LYS O O 0.561 -7.649 4.078 1.00 . A A . 44 LYS O 1 1 3 2092 1 1 40 LYS OXT O 1.703 -7.523 5.900 1.00 . A A . 44 LYS OXT 1 1 3 2093 2 2 1 ACE C C 7.977 12.111 4.277 1.00 . B B . 45 ACE C 1 1 3 2094 2 2 1 ACE CH3 C 8.692 13.360 4.794 1.00 . B B . 45 ACE CH3 1 1 3 2095 2 2 1 ACE H1 H 9.282 13.793 3.998 1.00 . B B . 45 ACE H1 1 1 3 2096 2 2 1 ACE H2 H 9.339 13.091 5.615 1.00 . B B . 45 ACE H2 1 1 3 2097 2 2 1 ACE H3 H 7.961 14.079 5.133 1.00 . B B . 45 ACE H3 1 1 3 2098 2 2 1 ACE O O 6.768 12.091 4.158 1.00 . B B . 45 ACE O 1 1 3 2099 2 2 2 PRO C C 7.154 10.004 2.439 1.00 . B B . 46 PRO C 1 1 3 2100 2 2 2 PRO CA C 8.609 10.427 2.664 1.00 . B B . 46 PRO CA 1 1 3 2101 2 2 2 PRO CB C 9.514 9.205 2.779 1.00 . B B . 46 PRO CB 1 1 3 2102 2 2 2 PRO CD C 9.441 10.245 4.955 1.00 . B B . 46 PRO CD 1 1 3 2103 2 2 2 PRO CG C 9.607 8.929 4.242 1.00 . B B . 46 PRO CG 1 1 3 2104 2 2 2 PRO HA H 8.949 11.066 1.866 1.00 . B B . 46 PRO HA 1 1 3 2105 2 2 2 PRO HB2 H 9.075 8.363 2.260 1.00 . B B . 46 PRO HB2 1 1 3 2106 2 2 2 PRO HB3 H 10.493 9.423 2.382 1.00 . B B . 46 PRO HB3 1 1 3 2107 2 2 2 PRO HD2 H 8.834 10.119 5.841 1.00 . B B . 46 PRO HD2 1 1 3 2108 2 2 2 PRO HD3 H 10.402 10.662 5.209 1.00 . B B . 46 PRO HD3 1 1 3 2109 2 2 2 PRO HG2 H 8.822 8.245 4.538 1.00 . B B . 46 PRO HG2 1 1 3 2110 2 2 2 PRO HG3 H 10.572 8.508 4.479 1.00 . B B . 46 PRO HG3 1 1 3 2111 2 2 2 PRO N N 8.758 11.107 3.979 1.00 . B B . 46 PRO N 1 1 3 2112 2 2 2 PRO O O 6.682 9.040 3.010 1.00 . B B . 46 PRO O 1 1 3 2113 2 2 3 LEU C C 4.429 11.272 0.264 1.00 . B B . 47 LEU C 1 1 3 2114 2 2 3 LEU CA C 5.017 10.354 1.348 1.00 . B B . 47 LEU CA 1 1 3 2115 2 2 3 LEU CB C 4.300 10.575 2.680 1.00 . B B . 47 LEU CB 1 1 3 2116 2 2 3 LEU CD1 C 2.493 8.913 3.146 1.00 . B B . 47 LEU CD1 1 1 3 2117 2 2 3 LEU CD2 C 1.987 11.359 3.206 1.00 . B B . 47 LEU CD2 1 1 3 2118 2 2 3 LEU CG C 2.809 10.271 2.515 1.00 . B B . 47 LEU CG 1 1 3 2119 2 2 3 LEU H H 6.839 11.489 1.159 1.00 . B B . 47 LEU H 1 1 3 2120 2 2 3 LEU HA H 4.939 9.320 1.058 1.00 . B B . 47 LEU HA 1 1 3 2121 2 2 3 LEU HB2 H 4.720 9.919 3.428 1.00 . B B . 47 LEU HB2 1 1 3 2122 2 2 3 LEU HB3 H 4.425 11.603 2.991 1.00 . B B . 47 LEU HB3 1 1 3 2123 2 2 3 LEU HD11 H 3.046 8.808 4.069 1.00 . B B . 47 LEU HD11 1 1 3 2124 2 2 3 LEU HD12 H 2.777 8.124 2.464 1.00 . B B . 47 LEU HD12 1 1 3 2125 2 2 3 LEU HD13 H 1.435 8.849 3.350 1.00 . B B . 47 LEU HD13 1 1 3 2126 2 2 3 LEU HD21 H 0.960 11.299 2.873 1.00 . B B . 47 LEU HD21 1 1 3 2127 2 2 3 LEU HD22 H 2.390 12.329 2.957 1.00 . B B . 47 LEU HD22 1 1 3 2128 2 2 3 LEU HD23 H 2.027 11.216 4.275 1.00 . B B . 47 LEU HD23 1 1 3 2129 2 2 3 LEU HG H 2.563 10.244 1.463 1.00 . B B . 47 LEU HG 1 1 3 2130 2 2 3 LEU N N 6.440 10.716 1.611 1.00 . B B . 47 LEU N 1 1 3 2131 2 2 3 LEU O O 4.215 12.443 0.504 1.00 . B B . 47 LEU O 1 1 3 2132 2 2 4 PRO C C 2.148 11.862 -1.728 1.00 . B B . 48 PRO C 1 1 3 2133 2 2 4 PRO CA C 3.616 11.513 -2.013 1.00 . B B . 48 PRO CA 1 1 3 2134 2 2 4 PRO CB C 3.729 10.584 -3.219 1.00 . B B . 48 PRO CB 1 1 3 2135 2 2 4 PRO CD C 4.405 9.313 -1.288 1.00 . B B . 48 PRO CD 1 1 3 2136 2 2 4 PRO CG C 3.754 9.205 -2.640 1.00 . B B . 48 PRO CG 1 1 3 2137 2 2 4 PRO HA H 4.197 12.407 -2.178 1.00 . B B . 48 PRO HA 1 1 3 2138 2 2 4 PRO HB2 H 2.876 10.703 -3.868 1.00 . B B . 48 PRO HB2 1 1 3 2139 2 2 4 PRO HB3 H 4.644 10.781 -3.759 1.00 . B B . 48 PRO HB3 1 1 3 2140 2 2 4 PRO HD2 H 3.929 8.644 -0.584 1.00 . B B . 48 PRO HD2 1 1 3 2141 2 2 4 PRO HD3 H 5.463 9.101 -1.356 1.00 . B B . 48 PRO HD3 1 1 3 2142 2 2 4 PRO HG2 H 2.747 8.831 -2.538 1.00 . B B . 48 PRO HG2 1 1 3 2143 2 2 4 PRO HG3 H 4.330 8.549 -3.277 1.00 . B B . 48 PRO HG3 1 1 3 2144 2 2 4 PRO N N 4.184 10.713 -0.899 1.00 . B B . 48 PRO N 1 1 3 2145 2 2 4 PRO O O 1.433 11.079 -1.138 1.00 . B B . 48 PRO O 1 1 3 2146 2 2 5 PRO C C -0.610 12.704 -2.854 1.00 . B B . 49 PRO C 1 1 3 2147 2 2 5 PRO CA C 0.344 13.477 -1.941 1.00 . B B . 49 PRO CA 1 1 3 2148 2 2 5 PRO CB C 0.373 14.956 -2.312 1.00 . B B . 49 PRO CB 1 1 3 2149 2 2 5 PRO CD C 2.534 14.044 -2.880 1.00 . B B . 49 PRO CD 1 1 3 2150 2 2 5 PRO CG C 1.524 15.097 -3.257 1.00 . B B . 49 PRO CG 1 1 3 2151 2 2 5 PRO HA H 0.065 13.361 -0.905 1.00 . B B . 49 PRO HA 1 1 3 2152 2 2 5 PRO HB2 H -0.549 15.238 -2.800 1.00 . B B . 49 PRO HB2 1 1 3 2153 2 2 5 PRO HB3 H 0.533 15.563 -1.433 1.00 . B B . 49 PRO HB3 1 1 3 2154 2 2 5 PRO HD2 H 2.981 13.614 -3.765 1.00 . B B . 49 PRO HD2 1 1 3 2155 2 2 5 PRO HD3 H 3.294 14.461 -2.236 1.00 . B B . 49 PRO HD3 1 1 3 2156 2 2 5 PRO HG2 H 1.189 14.940 -4.272 1.00 . B B . 49 PRO HG2 1 1 3 2157 2 2 5 PRO HG3 H 1.962 16.079 -3.161 1.00 . B B . 49 PRO HG3 1 1 3 2158 2 2 5 PRO N N 1.743 13.034 -2.160 1.00 . B B . 49 PRO N 1 1 3 2159 2 2 5 PRO O O -0.259 11.685 -3.414 1.00 . B B . 49 PRO O 1 1 3 2160 2 2 6 TYR C C -3.993 13.376 -4.175 1.00 . B B . 50 TYR C 1 1 3 2161 2 2 6 TYR CA C -2.792 12.473 -3.882 1.00 . B B . 50 TYR CA 1 1 3 2162 2 2 6 TYR CB C -3.226 11.244 -3.082 1.00 . B B . 50 TYR CB 1 1 3 2163 2 2 6 TYR CD1 C -3.374 9.718 -5.083 1.00 . B B . 50 TYR CD1 1 1 3 2164 2 2 6 TYR CD2 C -5.345 10.028 -3.704 1.00 . B B . 50 TYR CD2 1 1 3 2165 2 2 6 TYR CE1 C -4.092 8.849 -5.913 1.00 . B B . 50 TYR CE1 1 1 3 2166 2 2 6 TYR CE2 C -6.062 9.160 -4.535 1.00 . B B . 50 TYR CE2 1 1 3 2167 2 2 6 TYR CG C -4.001 10.308 -3.977 1.00 . B B . 50 TYR CG 1 1 3 2168 2 2 6 TYR CZ C -5.435 8.571 -5.639 1.00 . B B . 50 TYR CZ 1 1 3 2169 2 2 6 TYR H H -2.079 14.004 -2.544 1.00 . B B . 50 TYR H 1 1 3 2170 2 2 6 TYR HA H -2.319 12.164 -4.802 1.00 . B B . 50 TYR HA 1 1 3 2171 2 2 6 TYR HB2 H -2.353 10.738 -2.698 1.00 . B B . 50 TYR HB2 1 1 3 2172 2 2 6 TYR HB3 H -3.853 11.554 -2.260 1.00 . B B . 50 TYR HB3 1 1 3 2173 2 2 6 TYR HD1 H -2.336 9.934 -5.293 1.00 . B B . 50 TYR HD1 1 1 3 2174 2 2 6 TYR HD2 H -5.828 10.483 -2.853 1.00 . B B . 50 TYR HD2 1 1 3 2175 2 2 6 TYR HE1 H -3.607 8.394 -6.765 1.00 . B B . 50 TYR HE1 1 1 3 2176 2 2 6 TYR HE2 H -7.099 8.945 -4.324 1.00 . B B . 50 TYR HE2 1 1 3 2177 2 2 6 TYR HH H -6.865 7.343 -5.948 1.00 . B B . 50 TYR HH 1 1 3 2178 2 2 6 TYR N N -1.816 13.180 -3.006 1.00 . B B . 50 TYR N 1 1 3 2179 2 2 6 TYR O O -4.563 13.893 -3.230 1.00 . B B . 50 TYR O 1 1 3 2180 2 2 6 TYR OXT O -4.322 13.533 -5.339 1.00 . B B . 50 TYR OXT 1 1 3 2181 2 2 6 TYR OH O -6.143 7.714 -6.459 1.00 . B B . 50 TYR OH 1 1 4 2182 1 1 1 PHE C C 7.832 -15.331 14.110 1.00 . A A . 5 PHE C 1 1 4 2183 1 1 1 PHE CA C 8.181 -16.572 14.937 1.00 . A A . 5 PHE CA 1 1 4 2184 1 1 1 PHE CB C 9.032 -17.541 14.116 1.00 . A A . 5 PHE CB 1 1 4 2185 1 1 1 PHE CD1 C 11.024 -16.044 14.495 1.00 . A A . 5 PHE CD1 1 1 4 2186 1 1 1 PHE CD2 C 11.310 -18.441 14.711 1.00 . A A . 5 PHE CD2 1 1 4 2187 1 1 1 PHE CE1 C 12.376 -15.854 14.805 1.00 . A A . 5 PHE CE1 1 1 4 2188 1 1 1 PHE CE2 C 12.662 -18.252 15.020 1.00 . A A . 5 PHE CE2 1 1 4 2189 1 1 1 PHE CG C 10.491 -17.338 14.449 1.00 . A A . 5 PHE CG 1 1 4 2190 1 1 1 PHE CZ C 13.195 -16.959 15.066 1.00 . A A . 5 PHE CZ 1 1 4 2191 1 1 1 PHE HA H 8.705 -16.292 15.837 1.00 . A A . 5 PHE HA 1 1 4 2192 1 1 1 PHE HB2 H 8.748 -18.557 14.351 1.00 . A A . 5 PHE HB2 1 1 4 2193 1 1 1 PHE HB3 H 8.874 -17.357 13.065 1.00 . A A . 5 PHE HB3 1 1 4 2194 1 1 1 PHE HD1 H 10.391 -15.192 14.292 1.00 . A A . 5 PHE HD1 1 1 4 2195 1 1 1 PHE HD2 H 10.899 -19.440 14.675 1.00 . A A . 5 PHE HD2 1 1 4 2196 1 1 1 PHE HE1 H 12.786 -14.855 14.839 1.00 . A A . 5 PHE HE1 1 1 4 2197 1 1 1 PHE HE2 H 13.295 -19.104 15.223 1.00 . A A . 5 PHE HE2 1 1 4 2198 1 1 1 PHE HZ H 14.238 -16.811 15.305 1.00 . A A . 5 PHE HZ 1 1 4 2199 1 1 1 PHE N N 6.941 -17.332 15.270 1.00 . A A . 5 PHE N 1 1 4 2200 1 1 1 PHE O O 7.882 -15.349 12.896 1.00 . A A . 5 PHE O 1 1 4 2201 1 1 2 GLU C C 6.056 -13.315 12.961 1.00 . A A . 6 GLU C 1 1 4 2202 1 1 2 GLU CA C 7.131 -13.013 14.010 1.00 . A A . 6 GLU CA 1 1 4 2203 1 1 2 GLU CB C 8.431 -12.576 13.334 1.00 . A A . 6 GLU CB 1 1 4 2204 1 1 2 GLU CD C 10.139 -10.771 13.595 1.00 . A A . 6 GLU CD 1 1 4 2205 1 1 2 GLU CG C 8.640 -11.076 13.555 1.00 . A A . 6 GLU CG 1 1 4 2206 1 1 2 GLU H H 7.447 -14.261 15.738 1.00 . A A . 6 GLU H 1 1 4 2207 1 1 2 GLU HA H 6.790 -12.247 14.688 1.00 . A A . 6 GLU HA 1 1 4 2208 1 1 2 GLU HB2 H 9.259 -13.121 13.762 1.00 . A A . 6 GLU HB2 1 1 4 2209 1 1 2 GLU HB3 H 8.374 -12.780 12.276 1.00 . A A . 6 GLU HB3 1 1 4 2210 1 1 2 GLU HG2 H 8.183 -10.527 12.744 1.00 . A A . 6 GLU HG2 1 1 4 2211 1 1 2 GLU HG3 H 8.187 -10.783 14.489 1.00 . A A . 6 GLU HG3 1 1 4 2212 1 1 2 GLU N N 7.481 -14.254 14.759 1.00 . A A . 6 GLU N 1 1 4 2213 1 1 2 GLU O O 5.582 -14.427 12.846 1.00 . A A . 6 GLU O 1 1 4 2214 1 1 2 GLU OE1 O 10.842 -11.449 14.325 1.00 . A A . 6 GLU OE1 1 1 4 2215 1 1 2 GLU OE2 O 10.558 -9.863 12.895 1.00 . A A . 6 GLU OE2 1 1 4 2216 1 1 3 ILE C C 5.167 -12.189 9.768 1.00 . A A . 7 ILE C 1 1 4 2217 1 1 3 ILE CA C 4.625 -12.563 11.155 1.00 . A A . 7 ILE CA 1 1 4 2218 1 1 3 ILE CB C 3.467 -11.645 11.544 1.00 . A A . 7 ILE CB 1 1 4 2219 1 1 3 ILE CD1 C 3.173 -9.430 10.427 1.00 . A A . 7 ILE CD1 1 1 4 2220 1 1 3 ILE CG1 C 3.936 -10.189 11.514 1.00 . A A . 7 ILE CG1 1 1 4 2221 1 1 3 ILE CG2 C 2.989 -11.995 12.955 1.00 . A A . 7 ILE CG2 1 1 4 2222 1 1 3 ILE H H 6.063 -11.441 12.304 1.00 . A A . 7 ILE H 1 1 4 2223 1 1 3 ILE HA H 4.301 -13.592 11.171 1.00 . A A . 7 ILE HA 1 1 4 2224 1 1 3 ILE HB H 2.652 -11.778 10.847 1.00 . A A . 7 ILE HB 1 1 4 2225 1 1 3 ILE HD11 H 3.693 -9.531 9.484 1.00 . A A . 7 ILE HD11 1 1 4 2226 1 1 3 ILE HD12 H 3.110 -8.386 10.694 1.00 . A A . 7 ILE HD12 1 1 4 2227 1 1 3 ILE HD13 H 2.178 -9.838 10.333 1.00 . A A . 7 ILE HD13 1 1 4 2228 1 1 3 ILE HG12 H 3.750 -9.729 12.473 1.00 . A A . 7 ILE HG12 1 1 4 2229 1 1 3 ILE HG13 H 4.994 -10.158 11.300 1.00 . A A . 7 ILE HG13 1 1 4 2230 1 1 3 ILE HG21 H 3.825 -11.960 13.638 1.00 . A A . 7 ILE HG21 1 1 4 2231 1 1 3 ILE HG22 H 2.565 -12.989 12.955 1.00 . A A . 7 ILE HG22 1 1 4 2232 1 1 3 ILE HG23 H 2.239 -11.283 13.268 1.00 . A A . 7 ILE HG23 1 1 4 2233 1 1 3 ILE N N 5.668 -12.332 12.196 1.00 . A A . 7 ILE N 1 1 4 2234 1 1 3 ILE O O 5.915 -11.242 9.637 1.00 . A A . 7 ILE O 1 1 4 2235 1 1 4 PRO C C 4.543 -11.428 6.832 1.00 . A A . 8 PRO C 1 1 4 2236 1 1 4 PRO CA C 5.231 -12.677 7.389 1.00 . A A . 8 PRO CA 1 1 4 2237 1 1 4 PRO CB C 4.806 -13.921 6.618 1.00 . A A . 8 PRO CB 1 1 4 2238 1 1 4 PRO CD C 3.870 -14.109 8.837 1.00 . A A . 8 PRO CD 1 1 4 2239 1 1 4 PRO CG C 3.656 -14.484 7.393 1.00 . A A . 8 PRO CG 1 1 4 2240 1 1 4 PRO HA H 6.303 -12.570 7.358 1.00 . A A . 8 PRO HA 1 1 4 2241 1 1 4 PRO HB2 H 4.490 -13.655 5.620 1.00 . A A . 8 PRO HB2 1 1 4 2242 1 1 4 PRO HB3 H 5.616 -14.634 6.579 1.00 . A A . 8 PRO HB3 1 1 4 2243 1 1 4 PRO HD2 H 2.933 -13.837 9.300 1.00 . A A . 8 PRO HD2 1 1 4 2244 1 1 4 PRO HD3 H 4.339 -14.922 9.372 1.00 . A A . 8 PRO HD3 1 1 4 2245 1 1 4 PRO HG2 H 2.728 -14.059 7.036 1.00 . A A . 8 PRO HG2 1 1 4 2246 1 1 4 PRO HG3 H 3.633 -15.559 7.289 1.00 . A A . 8 PRO HG3 1 1 4 2247 1 1 4 PRO N N 4.769 -12.947 8.773 1.00 . A A . 8 PRO N 1 1 4 2248 1 1 4 PRO O O 3.649 -10.875 7.439 1.00 . A A . 8 PRO O 1 1 4 2249 1 1 5 ASP C C 3.600 -10.136 3.781 1.00 . A A . 9 ASP C 1 1 4 2250 1 1 5 ASP CA C 4.322 -9.768 5.078 1.00 . A A . 9 ASP CA 1 1 4 2251 1 1 5 ASP CB C 5.483 -8.815 4.795 1.00 . A A . 9 ASP CB 1 1 4 2252 1 1 5 ASP CG C 5.033 -7.373 5.042 1.00 . A A . 9 ASP CG 1 1 4 2253 1 1 5 ASP H H 5.677 -11.440 5.200 1.00 . A A . 9 ASP H 1 1 4 2254 1 1 5 ASP HA H 3.637 -9.315 5.778 1.00 . A A . 9 ASP HA 1 1 4 2255 1 1 5 ASP HB2 H 6.311 -9.050 5.449 1.00 . A A . 9 ASP HB2 1 1 4 2256 1 1 5 ASP HB3 H 5.796 -8.924 3.768 1.00 . A A . 9 ASP HB3 1 1 4 2257 1 1 5 ASP N N 4.954 -10.980 5.675 1.00 . A A . 9 ASP N 1 1 4 2258 1 1 5 ASP O O 3.820 -9.540 2.746 1.00 . A A . 9 ASP O 1 1 4 2259 1 1 5 ASP OD1 O 4.470 -6.786 4.132 1.00 . A A . 9 ASP OD1 1 1 4 2260 1 1 5 ASP OD2 O 5.258 -6.883 6.136 1.00 . A A . 9 ASP OD2 1 1 4 2261 1 1 6 ASP C C 0.646 -10.811 2.526 1.00 . A A . 10 ASP C 1 1 4 2262 1 1 6 ASP CA C 2.002 -11.522 2.596 1.00 . A A . 10 ASP CA 1 1 4 2263 1 1 6 ASP CB C 1.808 -13.032 2.732 1.00 . A A . 10 ASP CB 1 1 4 2264 1 1 6 ASP CG C 2.686 -13.753 1.706 1.00 . A A . 10 ASP CG 1 1 4 2265 1 1 6 ASP H H 2.575 -11.583 4.674 1.00 . A A . 10 ASP H 1 1 4 2266 1 1 6 ASP HA H 2.589 -11.303 1.719 1.00 . A A . 10 ASP HA 1 1 4 2267 1 1 6 ASP HB2 H 2.089 -13.343 3.727 1.00 . A A . 10 ASP HB2 1 1 4 2268 1 1 6 ASP HB3 H 0.772 -13.279 2.556 1.00 . A A . 10 ASP HB3 1 1 4 2269 1 1 6 ASP N N 2.738 -11.115 3.828 1.00 . A A . 10 ASP N 1 1 4 2270 1 1 6 ASP O O 0.047 -10.705 1.475 1.00 . A A . 10 ASP O 1 1 4 2271 1 1 6 ASP OD1 O 2.235 -13.923 0.586 1.00 . A A . 10 ASP OD1 1 1 4 2272 1 1 6 ASP OD2 O 3.793 -14.123 2.059 1.00 . A A . 10 ASP OD2 1 1 4 2273 1 1 7 VAL C C -1.163 -8.518 2.559 1.00 . A A . 11 VAL C 1 1 4 2274 1 1 7 VAL CA C -1.156 -9.623 3.628 1.00 . A A . 11 VAL CA 1 1 4 2275 1 1 7 VAL CB C -1.290 -9.017 5.023 1.00 . A A . 11 VAL CB 1 1 4 2276 1 1 7 VAL CG1 C -2.575 -8.192 5.098 1.00 . A A . 11 VAL CG1 1 1 4 2277 1 1 7 VAL CG2 C -1.343 -10.141 6.060 1.00 . A A . 11 VAL CG2 1 1 4 2278 1 1 7 VAL H H 0.658 -10.421 4.474 1.00 . A A . 11 VAL H 1 1 4 2279 1 1 7 VAL HA H -1.955 -10.327 3.457 1.00 . A A . 11 VAL HA 1 1 4 2280 1 1 7 VAL HB H -0.440 -8.381 5.223 1.00 . A A . 11 VAL HB 1 1 4 2281 1 1 7 VAL HG11 H -2.480 -7.317 4.471 1.00 . A A . 11 VAL HG11 1 1 4 2282 1 1 7 VAL HG12 H -2.750 -7.888 6.118 1.00 . A A . 11 VAL HG12 1 1 4 2283 1 1 7 VAL HG13 H -3.407 -8.791 4.754 1.00 . A A . 11 VAL HG13 1 1 4 2284 1 1 7 VAL HG21 H -0.341 -10.378 6.384 1.00 . A A . 11 VAL HG21 1 1 4 2285 1 1 7 VAL HG22 H -1.795 -11.017 5.618 1.00 . A A . 11 VAL HG22 1 1 4 2286 1 1 7 VAL HG23 H -1.931 -9.822 6.908 1.00 . A A . 11 VAL HG23 1 1 4 2287 1 1 7 VAL N N 0.160 -10.325 3.635 1.00 . A A . 11 VAL N 1 1 4 2288 1 1 7 VAL O O -0.475 -7.528 2.698 1.00 . A A . 11 VAL O 1 1 4 2289 1 1 8 PRO C C -2.883 -6.534 0.863 1.00 . A A . 12 PRO C 1 1 4 2290 1 1 8 PRO CA C -2.016 -7.720 0.430 1.00 . A A . 12 PRO CA 1 1 4 2291 1 1 8 PRO CB C -2.671 -8.489 -0.715 1.00 . A A . 12 PRO CB 1 1 4 2292 1 1 8 PRO CD C -2.804 -9.883 1.262 1.00 . A A . 12 PRO CD 1 1 4 2293 1 1 8 PRO CG C -3.463 -9.572 -0.058 1.00 . A A . 12 PRO CG 1 1 4 2294 1 1 8 PRO HA H -1.031 -7.393 0.142 1.00 . A A . 12 PRO HA 1 1 4 2295 1 1 8 PRO HB2 H -3.324 -7.844 -1.281 1.00 . A A . 12 PRO HB2 1 1 4 2296 1 1 8 PRO HB3 H -1.916 -8.916 -1.359 1.00 . A A . 12 PRO HB3 1 1 4 2297 1 1 8 PRO HD2 H -3.547 -9.980 2.039 1.00 . A A . 12 PRO HD2 1 1 4 2298 1 1 8 PRO HD3 H -2.214 -10.783 1.190 1.00 . A A . 12 PRO HD3 1 1 4 2299 1 1 8 PRO HG2 H -4.475 -9.231 0.108 1.00 . A A . 12 PRO HG2 1 1 4 2300 1 1 8 PRO HG3 H -3.469 -10.450 -0.685 1.00 . A A . 12 PRO HG3 1 1 4 2301 1 1 8 PRO N N -1.940 -8.722 1.520 1.00 . A A . 12 PRO N 1 1 4 2302 1 1 8 PRO O O -3.087 -6.300 2.039 1.00 . A A . 12 PRO O 1 1 4 2303 1 1 9 LEU C C -5.717 -4.915 -0.050 1.00 . A A . 13 LEU C 1 1 4 2304 1 1 9 LEU CA C -4.250 -4.617 0.288 1.00 . A A . 13 LEU CA 1 1 4 2305 1 1 9 LEU CB C -3.721 -3.463 -0.564 1.00 . A A . 13 LEU CB 1 1 4 2306 1 1 9 LEU CD1 C -1.269 -3.881 -0.854 1.00 . A A . 13 LEU CD1 1 1 4 2307 1 1 9 LEU CD2 C -2.088 -1.582 -0.325 1.00 . A A . 13 LEU CD2 1 1 4 2308 1 1 9 LEU CG C -2.318 -3.076 -0.084 1.00 . A A . 13 LEU CG 1 1 4 2309 1 1 9 LEU H H -3.222 -5.990 -1.012 1.00 . A A . 13 LEU H 1 1 4 2310 1 1 9 LEU HA H -4.144 -4.381 1.335 1.00 . A A . 13 LEU HA 1 1 4 2311 1 1 9 LEU HB2 H -3.673 -3.771 -1.598 1.00 . A A . 13 LEU HB2 1 1 4 2312 1 1 9 LEU HB3 H -4.380 -2.614 -0.471 1.00 . A A . 13 LEU HB3 1 1 4 2313 1 1 9 LEU HD11 H -0.869 -3.278 -1.656 1.00 . A A . 13 LEU HD11 1 1 4 2314 1 1 9 LEU HD12 H -1.727 -4.769 -1.264 1.00 . A A . 13 LEU HD12 1 1 4 2315 1 1 9 LEU HD13 H -0.471 -4.165 -0.185 1.00 . A A . 13 LEU HD13 1 1 4 2316 1 1 9 LEU HD21 H -2.718 -1.008 0.338 1.00 . A A . 13 LEU HD21 1 1 4 2317 1 1 9 LEU HD22 H -2.332 -1.342 -1.351 1.00 . A A . 13 LEU HD22 1 1 4 2318 1 1 9 LEU HD23 H -1.053 -1.342 -0.136 1.00 . A A . 13 LEU HD23 1 1 4 2319 1 1 9 LEU HG H -2.229 -3.286 0.972 1.00 . A A . 13 LEU HG 1 1 4 2320 1 1 9 LEU N N -3.396 -5.785 -0.073 1.00 . A A . 13 LEU N 1 1 4 2321 1 1 9 LEU O O -5.997 -5.723 -0.913 1.00 . A A . 13 LEU O 1 1 4 2322 1 1 10 PRO C C -8.494 -3.846 -0.924 1.00 . A A . 14 PRO C 1 1 4 2323 1 1 10 PRO CA C -8.063 -4.474 0.406 1.00 . A A . 14 PRO CA 1 1 4 2324 1 1 10 PRO CB C -8.734 -3.778 1.587 1.00 . A A . 14 PRO CB 1 1 4 2325 1 1 10 PRO CD C -6.374 -3.266 1.706 1.00 . A A . 14 PRO CD 1 1 4 2326 1 1 10 PRO CG C -7.750 -2.747 2.040 1.00 . A A . 14 PRO CG 1 1 4 2327 1 1 10 PRO HA H -8.294 -5.526 0.421 1.00 . A A . 14 PRO HA 1 1 4 2328 1 1 10 PRO HB2 H -9.652 -3.307 1.271 1.00 . A A . 14 PRO HB2 1 1 4 2329 1 1 10 PRO HB3 H -8.927 -4.486 2.379 1.00 . A A . 14 PRO HB3 1 1 4 2330 1 1 10 PRO HD2 H -5.747 -2.465 1.339 1.00 . A A . 14 PRO HD2 1 1 4 2331 1 1 10 PRO HD3 H -5.926 -3.735 2.569 1.00 . A A . 14 PRO HD3 1 1 4 2332 1 1 10 PRO HG2 H -7.929 -1.816 1.526 1.00 . A A . 14 PRO HG2 1 1 4 2333 1 1 10 PRO HG3 H -7.837 -2.600 3.106 1.00 . A A . 14 PRO HG3 1 1 4 2334 1 1 10 PRO N N -6.614 -4.258 0.647 1.00 . A A . 14 PRO N 1 1 4 2335 1 1 10 PRO O O -7.676 -3.517 -1.760 1.00 . A A . 14 PRO O 1 1 4 2336 1 1 11 ALA C C -9.991 -1.584 -2.436 1.00 . A A . 15 ALA C 1 1 4 2337 1 1 11 ALA CA C -10.261 -3.092 -2.405 1.00 . A A . 15 ALA CA 1 1 4 2338 1 1 11 ALA CB C -11.766 -3.366 -2.420 1.00 . A A . 15 ALA CB 1 1 4 2339 1 1 11 ALA H H -10.416 -3.967 -0.442 1.00 . A A . 15 ALA H 1 1 4 2340 1 1 11 ALA HA H -9.792 -3.575 -3.248 1.00 . A A . 15 ALA HA 1 1 4 2341 1 1 11 ALA HB1 H -11.952 -4.365 -2.053 1.00 . A A . 15 ALA HB1 1 1 4 2342 1 1 11 ALA HB2 H -12.137 -3.276 -3.431 1.00 . A A . 15 ALA HB2 1 1 4 2343 1 1 11 ALA HB3 H -12.267 -2.650 -1.787 1.00 . A A . 15 ALA HB3 1 1 4 2344 1 1 11 ALA N N -9.774 -3.688 -1.128 1.00 . A A . 15 ALA N 1 1 4 2345 1 1 11 ALA O O -9.617 -0.988 -1.445 1.00 . A A . 15 ALA O 1 1 4 2346 1 1 12 GLY C C -8.449 0.805 -3.465 1.00 . A A . 16 GLY C 1 1 4 2347 1 1 12 GLY CA C -9.937 0.502 -3.675 1.00 . A A . 16 GLY CA 1 1 4 2348 1 1 12 GLY H H -10.483 -1.467 -4.356 1.00 . A A . 16 GLY H 1 1 4 2349 1 1 12 GLY HA2 H -10.239 0.847 -4.654 1.00 . A A . 16 GLY HA2 1 1 4 2350 1 1 12 GLY HA3 H -10.517 1.015 -2.922 1.00 . A A . 16 GLY HA3 1 1 4 2351 1 1 12 GLY N N -10.180 -0.965 -3.570 1.00 . A A . 16 GLY N 1 1 4 2352 1 1 12 GLY O O -8.062 1.940 -3.274 1.00 . A A . 16 GLY O 1 1 4 2353 1 1 13 TRP C C -5.368 -0.253 -4.564 1.00 . A A . 17 TRP C 1 1 4 2354 1 1 13 TRP CA C -6.154 0.047 -3.287 1.00 . A A . 17 TRP CA 1 1 4 2355 1 1 13 TRP CB C -5.758 -0.926 -2.183 1.00 . A A . 17 TRP CB 1 1 4 2356 1 1 13 TRP CD1 C -6.883 -0.272 -0.025 1.00 . A A . 17 TRP CD1 1 1 4 2357 1 1 13 TRP CD2 C -4.840 0.631 -0.252 1.00 . A A . 17 TRP CD2 1 1 4 2358 1 1 13 TRP CE2 C -5.340 1.078 0.992 1.00 . A A . 17 TRP CE2 1 1 4 2359 1 1 13 TRP CE3 C -3.563 1.054 -0.648 1.00 . A A . 17 TRP CE3 1 1 4 2360 1 1 13 TRP CG C -5.834 -0.227 -0.872 1.00 . A A . 17 TRP CG 1 1 4 2361 1 1 13 TRP CH2 C -3.321 2.333 1.403 1.00 . A A . 17 TRP CH2 1 1 4 2362 1 1 13 TRP CZ2 C -4.593 1.921 1.816 1.00 . A A . 17 TRP CZ2 1 1 4 2363 1 1 13 TRP CZ3 C -2.811 1.900 0.175 1.00 . A A . 17 TRP CZ3 1 1 4 2364 1 1 13 TRP H H -7.933 -1.107 -3.641 1.00 . A A . 17 TRP H 1 1 4 2365 1 1 13 TRP HA H -5.981 1.060 -2.964 1.00 . A A . 17 TRP HA 1 1 4 2366 1 1 13 TRP HB2 H -6.435 -1.768 -2.183 1.00 . A A . 17 TRP HB2 1 1 4 2367 1 1 13 TRP HB3 H -4.749 -1.272 -2.351 1.00 . A A . 17 TRP HB3 1 1 4 2368 1 1 13 TRP HD1 H -7.798 -0.826 -0.190 1.00 . A A . 17 TRP HD1 1 1 4 2369 1 1 13 TRP HE1 H -7.188 0.635 1.854 1.00 . A A . 17 TRP HE1 1 1 4 2370 1 1 13 TRP HE3 H -3.158 0.726 -1.593 1.00 . A A . 17 TRP HE3 1 1 4 2371 1 1 13 TRP HH2 H -2.730 2.984 2.031 1.00 . A A . 17 TRP HH2 1 1 4 2372 1 1 13 TRP HZ2 H -4.993 2.252 2.763 1.00 . A A . 17 TRP HZ2 1 1 4 2373 1 1 13 TRP HZ3 H -1.836 2.220 -0.140 1.00 . A A . 17 TRP HZ3 1 1 4 2374 1 1 13 TRP N N -7.610 -0.197 -3.493 1.00 . A A . 17 TRP N 1 1 4 2375 1 1 13 TRP NE1 N -6.593 0.500 1.086 1.00 . A A . 17 TRP NE1 1 1 4 2376 1 1 13 TRP O O -5.698 -1.153 -5.310 1.00 . A A . 17 TRP O 1 1 4 2377 1 1 14 GLU C C -2.026 0.263 -5.758 1.00 . A A . 18 GLU C 1 1 4 2378 1 1 14 GLU CA C -3.526 0.234 -6.056 1.00 . A A . 18 GLU CA 1 1 4 2379 1 1 14 GLU CB C -3.880 1.371 -7.013 1.00 . A A . 18 GLU CB 1 1 4 2380 1 1 14 GLU CD C -6.163 0.597 -7.664 1.00 . A A . 18 GLU CD 1 1 4 2381 1 1 14 GLU CG C -4.734 0.830 -8.159 1.00 . A A . 18 GLU CG 1 1 4 2382 1 1 14 GLU H H -4.070 1.216 -4.211 1.00 . A A . 18 GLU H 1 1 4 2383 1 1 14 GLU HA H -3.805 -0.710 -6.494 1.00 . A A . 18 GLU HA 1 1 4 2384 1 1 14 GLU HB2 H -4.425 2.135 -6.482 1.00 . A A . 18 GLU HB2 1 1 4 2385 1 1 14 GLU HB3 H -2.971 1.796 -7.414 1.00 . A A . 18 GLU HB3 1 1 4 2386 1 1 14 GLU HG2 H -4.745 1.545 -8.968 1.00 . A A . 18 GLU HG2 1 1 4 2387 1 1 14 GLU HG3 H -4.317 -0.102 -8.509 1.00 . A A . 18 GLU HG3 1 1 4 2388 1 1 14 GLU N N -4.325 0.492 -4.824 1.00 . A A . 18 GLU N 1 1 4 2389 1 1 14 GLU O O -1.408 1.314 -5.762 1.00 . A A . 18 GLU O 1 1 4 2390 1 1 14 GLU OE1 O -6.787 1.556 -7.241 1.00 . A A . 18 GLU OE1 1 1 4 2391 1 1 14 GLU OE2 O -6.610 -0.538 -7.718 1.00 . A A . 18 GLU OE2 1 1 4 2392 1 1 15 MET C C 0.748 -0.445 -6.552 1.00 . A A . 19 MET C 1 1 4 2393 1 1 15 MET CA C 0.042 -0.871 -5.274 1.00 . A A . 19 MET CA 1 1 4 2394 1 1 15 MET CB C 0.433 -2.303 -4.907 1.00 . A A . 19 MET CB 1 1 4 2395 1 1 15 MET CE C -1.762 -4.275 -4.211 1.00 . A A . 19 MET CE 1 1 4 2396 1 1 15 MET CG C 0.011 -3.272 -6.018 1.00 . A A . 19 MET CG 1 1 4 2397 1 1 15 MET H H -1.915 -1.715 -5.539 1.00 . A A . 19 MET H 1 1 4 2398 1 1 15 MET HA H 0.284 -0.200 -4.465 1.00 . A A . 19 MET HA 1 1 4 2399 1 1 15 MET HB2 H 1.498 -2.346 -4.793 1.00 . A A . 19 MET HB2 1 1 4 2400 1 1 15 MET HB3 H -0.034 -2.582 -3.976 1.00 . A A . 19 MET HB3 1 1 4 2401 1 1 15 MET HE1 H -2.696 -4.734 -4.501 1.00 . A A . 19 MET HE1 1 1 4 2402 1 1 15 MET HE2 H -1.846 -3.204 -4.299 1.00 . A A . 19 MET HE2 1 1 4 2403 1 1 15 MET HE3 H -1.530 -4.532 -3.188 1.00 . A A . 19 MET HE3 1 1 4 2404 1 1 15 MET HG2 H -0.834 -2.870 -6.555 1.00 . A A . 19 MET HG2 1 1 4 2405 1 1 15 MET HG3 H 0.835 -3.410 -6.703 1.00 . A A . 19 MET HG3 1 1 4 2406 1 1 15 MET N N -1.419 -0.874 -5.525 1.00 . A A . 19 MET N 1 1 4 2407 1 1 15 MET O O 0.557 -1.020 -7.605 1.00 . A A . 19 MET O 1 1 4 2408 1 1 15 MET SD S -0.438 -4.870 -5.293 1.00 . A A . 19 MET SD 1 1 4 2409 1 1 16 ALA C C 3.559 1.722 -7.217 1.00 . A A . 20 ALA C 1 1 4 2410 1 1 16 ALA CA C 2.266 1.048 -7.678 1.00 . A A . 20 ALA CA 1 1 4 2411 1 1 16 ALA CB C 1.279 2.024 -8.330 1.00 . A A . 20 ALA CB 1 1 4 2412 1 1 16 ALA H H 1.685 1.014 -5.611 1.00 . A A . 20 ALA H 1 1 4 2413 1 1 16 ALA HA H 2.481 0.228 -8.345 1.00 . A A . 20 ALA HA 1 1 4 2414 1 1 16 ALA HB1 H 1.813 2.797 -8.855 1.00 . A A . 20 ALA HB1 1 1 4 2415 1 1 16 ALA HB2 H 0.659 2.471 -7.566 1.00 . A A . 20 ALA HB2 1 1 4 2416 1 1 16 ALA HB3 H 0.651 1.486 -9.025 1.00 . A A . 20 ALA HB3 1 1 4 2417 1 1 16 ALA N N 1.551 0.564 -6.472 1.00 . A A . 20 ALA N 1 1 4 2418 1 1 16 ALA O O 4.095 1.355 -6.190 1.00 . A A . 20 ALA O 1 1 4 2419 1 1 17 LYS C C 5.242 4.825 -7.396 1.00 . A A . 21 LYS C 1 1 4 2420 1 1 17 LYS CA C 5.350 3.309 -7.457 1.00 . A A . 21 LYS CA 1 1 4 2421 1 1 17 LYS CB C 6.418 2.876 -8.460 1.00 . A A . 21 LYS CB 1 1 4 2422 1 1 17 LYS CD C 8.880 2.718 -8.852 1.00 . A A . 21 LYS CD 1 1 4 2423 1 1 17 LYS CE C 10.032 1.906 -8.256 1.00 . A A . 21 LYS CE 1 1 4 2424 1 1 17 LYS CG C 7.794 2.915 -7.793 1.00 . A A . 21 LYS CG 1 1 4 2425 1 1 17 LYS H H 3.666 2.976 -8.766 1.00 . A A . 21 LYS H 1 1 4 2426 1 1 17 LYS HA H 5.589 2.934 -6.481 1.00 . A A . 21 LYS HA 1 1 4 2427 1 1 17 LYS HB2 H 6.210 1.872 -8.798 1.00 . A A . 21 LYS HB2 1 1 4 2428 1 1 17 LYS HB3 H 6.410 3.548 -9.306 1.00 . A A . 21 LYS HB3 1 1 4 2429 1 1 17 LYS HD2 H 8.468 2.189 -9.698 1.00 . A A . 21 LYS HD2 1 1 4 2430 1 1 17 LYS HD3 H 9.247 3.681 -9.174 1.00 . A A . 21 LYS HD3 1 1 4 2431 1 1 17 LYS HE2 H 10.855 2.557 -7.994 1.00 . A A . 21 LYS HE2 1 1 4 2432 1 1 17 LYS HE3 H 9.696 1.357 -7.388 1.00 . A A . 21 LYS HE3 1 1 4 2433 1 1 17 LYS HG2 H 7.933 3.870 -7.308 1.00 . A A . 21 LYS HG2 1 1 4 2434 1 1 17 LYS HG3 H 7.860 2.126 -7.059 1.00 . A A . 21 LYS HG3 1 1 4 2435 1 1 17 LYS HZ1 H 11.302 0.464 -9.057 1.00 . A A . 21 LYS HZ1 1 1 4 2436 1 1 17 LYS HZ2 H 10.617 1.503 -10.212 1.00 . A A . 21 LYS HZ2 1 1 4 2437 1 1 17 LYS HZ3 H 9.676 0.278 -9.504 1.00 . A A . 21 LYS HZ3 1 1 4 2438 1 1 17 LYS N N 4.085 2.681 -7.933 1.00 . A A . 21 LYS N 1 1 4 2439 1 1 17 LYS NZ N 10.438 0.967 -9.339 1.00 . A A . 21 LYS NZ 1 1 4 2440 1 1 17 LYS O O 4.390 5.430 -8.018 1.00 . A A . 21 LYS O 1 1 4 2441 1 1 18 THR C C 7.412 7.556 -6.837 1.00 . A A . 22 THR C 1 1 4 2442 1 1 18 THR CA C 6.054 6.931 -6.515 1.00 . A A . 22 THR CA 1 1 4 2443 1 1 18 THR CB C 5.649 7.238 -5.064 1.00 . A A . 22 THR CB 1 1 4 2444 1 1 18 THR CG2 C 6.376 6.316 -4.072 1.00 . A A . 22 THR CG2 1 1 4 2445 1 1 18 THR H H 6.783 4.919 -6.135 1.00 . A A . 22 THR H 1 1 4 2446 1 1 18 THR HA H 5.306 7.323 -7.185 1.00 . A A . 22 THR HA 1 1 4 2447 1 1 18 THR HB H 4.586 7.103 -4.960 1.00 . A A . 22 THR HB 1 1 4 2448 1 1 18 THR HG1 H 5.302 9.150 -5.157 1.00 . A A . 22 THR HG1 1 1 4 2449 1 1 18 THR HG21 H 5.994 6.485 -3.077 1.00 . A A . 22 THR HG21 1 1 4 2450 1 1 18 THR HG22 H 7.435 6.527 -4.091 1.00 . A A . 22 THR HG22 1 1 4 2451 1 1 18 THR HG23 H 6.213 5.284 -4.347 1.00 . A A . 22 THR HG23 1 1 4 2452 1 1 18 THR N N 6.105 5.441 -6.634 1.00 . A A . 22 THR N 1 1 4 2453 1 1 18 THR O O 8.370 6.877 -7.148 1.00 . A A . 22 THR O 1 1 4 2454 1 1 18 THR OG1 O 5.976 8.589 -4.767 1.00 . A A . 22 THR OG1 1 1 4 2455 1 1 19 SER C C 9.801 9.291 -5.980 1.00 . A A . 23 SER C 1 1 4 2456 1 1 19 SER CA C 8.771 9.556 -7.078 1.00 . A A . 23 SER CA 1 1 4 2457 1 1 19 SER CB C 8.410 11.041 -7.127 1.00 . A A . 23 SER CB 1 1 4 2458 1 1 19 SER H H 6.695 9.377 -6.522 1.00 . A A . 23 SER H 1 1 4 2459 1 1 19 SER HA H 9.152 9.239 -8.036 1.00 . A A . 23 SER HA 1 1 4 2460 1 1 19 SER HB2 H 7.932 11.326 -6.202 1.00 . A A . 23 SER HB2 1 1 4 2461 1 1 19 SER HB3 H 9.308 11.625 -7.264 1.00 . A A . 23 SER HB3 1 1 4 2462 1 1 19 SER HG H 6.802 11.826 -7.889 1.00 . A A . 23 SER HG 1 1 4 2463 1 1 19 SER N N 7.489 8.857 -6.771 1.00 . A A . 23 SER N 1 1 4 2464 1 1 19 SER O O 9.896 10.021 -5.013 1.00 . A A . 23 SER O 1 1 4 2465 1 1 19 SER OG O 7.521 11.276 -8.210 1.00 . A A . 23 SER OG 1 1 4 2466 1 1 20 SER C C 12.340 6.636 -5.469 1.00 . A A . 24 SER C 1 1 4 2467 1 1 20 SER CA C 11.612 7.926 -5.093 1.00 . A A . 24 SER CA 1 1 4 2468 1 1 20 SER CB C 10.847 7.739 -3.780 1.00 . A A . 24 SER CB 1 1 4 2469 1 1 20 SER H H 10.481 7.680 -6.914 1.00 . A A . 24 SER H 1 1 4 2470 1 1 20 SER HA H 12.312 8.735 -5.001 1.00 . A A . 24 SER HA 1 1 4 2471 1 1 20 SER HB2 H 9.802 7.958 -3.937 1.00 . A A . 24 SER HB2 1 1 4 2472 1 1 20 SER HB3 H 10.955 6.718 -3.442 1.00 . A A . 24 SER HB3 1 1 4 2473 1 1 20 SER HG H 11.877 8.097 -2.169 1.00 . A A . 24 SER HG 1 1 4 2474 1 1 20 SER N N 10.577 8.250 -6.123 1.00 . A A . 24 SER N 1 1 4 2475 1 1 20 SER O O 13.513 6.469 -5.202 1.00 . A A . 24 SER O 1 1 4 2476 1 1 20 SER OG O 11.372 8.619 -2.796 1.00 . A A . 24 SER OG 1 1 4 2477 1 1 21 GLY C C 11.702 3.318 -5.604 1.00 . A A . 25 GLY C 1 1 4 2478 1 1 21 GLY CA C 12.276 4.437 -6.473 1.00 . A A . 25 GLY CA 1 1 4 2479 1 1 21 GLY H H 10.701 5.887 -6.275 1.00 . A A . 25 GLY H 1 1 4 2480 1 1 21 GLY HA2 H 12.064 4.232 -7.513 1.00 . A A . 25 GLY HA2 1 1 4 2481 1 1 21 GLY HA3 H 13.344 4.497 -6.328 1.00 . A A . 25 GLY HA3 1 1 4 2482 1 1 21 GLY N N 11.644 5.725 -6.080 1.00 . A A . 25 GLY N 1 1 4 2483 1 1 21 GLY O O 12.338 2.310 -5.371 1.00 . A A . 25 GLY O 1 1 4 2484 1 1 22 GLN C C 8.412 2.254 -4.614 1.00 . A A . 26 GLN C 1 1 4 2485 1 1 22 GLN CA C 9.889 2.445 -4.257 1.00 . A A . 26 GLN CA 1 1 4 2486 1 1 22 GLN CB C 10.030 2.975 -2.829 1.00 . A A . 26 GLN CB 1 1 4 2487 1 1 22 GLN CD C 11.716 2.828 -0.992 1.00 . A A . 26 GLN CD 1 1 4 2488 1 1 22 GLN CG C 11.513 3.114 -2.482 1.00 . A A . 26 GLN CG 1 1 4 2489 1 1 22 GLN H H 10.010 4.317 -5.315 1.00 . A A . 26 GLN H 1 1 4 2490 1 1 22 GLN HA H 10.424 1.514 -4.357 1.00 . A A . 26 GLN HA 1 1 4 2491 1 1 22 GLN HB2 H 9.550 3.941 -2.755 1.00 . A A . 26 GLN HB2 1 1 4 2492 1 1 22 GLN HB3 H 9.561 2.285 -2.142 1.00 . A A . 26 GLN HB3 1 1 4 2493 1 1 22 GLN HE21 H 10.298 4.090 -0.411 1.00 . A A . 26 GLN HE21 1 1 4 2494 1 1 22 GLN HE22 H 11.099 3.272 0.842 1.00 . A A . 26 GLN HE22 1 1 4 2495 1 1 22 GLN HG2 H 12.088 2.410 -3.065 1.00 . A A . 26 GLN HG2 1 1 4 2496 1 1 22 GLN HG3 H 11.842 4.118 -2.703 1.00 . A A . 26 GLN HG3 1 1 4 2497 1 1 22 GLN N N 10.503 3.493 -5.117 1.00 . A A . 26 GLN N 1 1 4 2498 1 1 22 GLN NE2 N 10.976 3.448 -0.114 1.00 . A A . 26 GLN NE2 1 1 4 2499 1 1 22 GLN O O 7.755 3.154 -5.129 1.00 . A A . 26 GLN O 1 1 4 2500 1 1 22 GLN OE1 O 12.557 2.033 -0.624 1.00 . A A . 26 GLN OE1 1 1 4 2501 1 1 23 ARG C C 5.562 1.376 -3.556 1.00 . A A . 27 ARG C 1 1 4 2502 1 1 23 ARG CA C 6.451 0.832 -4.656 1.00 . A A . 27 ARG CA 1 1 4 2503 1 1 23 ARG CB C 6.278 -0.685 -4.732 1.00 . A A . 27 ARG CB 1 1 4 2504 1 1 23 ARG CD C 7.363 -1.312 -6.892 1.00 . A A . 27 ARG CD 1 1 4 2505 1 1 23 ARG CG C 6.026 -1.077 -6.186 1.00 . A A . 27 ARG CG 1 1 4 2506 1 1 23 ARG CZ C 8.474 -3.385 -7.550 1.00 . A A . 27 ARG CZ 1 1 4 2507 1 1 23 ARG H H 8.426 0.384 -3.926 1.00 . A A . 27 ARG H 1 1 4 2508 1 1 23 ARG HA H 6.193 1.278 -5.603 1.00 . A A . 27 ARG HA 1 1 4 2509 1 1 23 ARG HB2 H 7.160 -1.179 -4.363 1.00 . A A . 27 ARG HB2 1 1 4 2510 1 1 23 ARG HB3 H 5.425 -0.981 -4.130 1.00 . A A . 27 ARG HB3 1 1 4 2511 1 1 23 ARG HD2 H 7.427 -0.710 -7.785 1.00 . A A . 27 ARG HD2 1 1 4 2512 1 1 23 ARG HD3 H 8.184 -1.089 -6.225 1.00 . A A . 27 ARG HD3 1 1 4 2513 1 1 23 ARG HE H 6.515 -3.258 -7.244 1.00 . A A . 27 ARG HE 1 1 4 2514 1 1 23 ARG HG2 H 5.434 -1.979 -6.222 1.00 . A A . 27 ARG HG2 1 1 4 2515 1 1 23 ARG HG3 H 5.492 -0.274 -6.679 1.00 . A A . 27 ARG HG3 1 1 4 2516 1 1 23 ARG HH11 H 9.665 -1.780 -7.329 1.00 . A A . 27 ARG HH11 1 1 4 2517 1 1 23 ARG HH12 H 10.460 -3.243 -7.795 1.00 . A A . 27 ARG HH12 1 1 4 2518 1 1 23 ARG HH21 H 7.569 -5.145 -7.850 1.00 . A A . 27 ARG HH21 1 1 4 2519 1 1 23 ARG HH22 H 9.285 -5.135 -8.088 1.00 . A A . 27 ARG HH22 1 1 4 2520 1 1 23 ARG N N 7.881 1.086 -4.340 1.00 . A A . 27 ARG N 1 1 4 2521 1 1 23 ARG NE N 7.360 -2.763 -7.243 1.00 . A A . 27 ARG NE 1 1 4 2522 1 1 23 ARG NH1 N 9.622 -2.751 -7.558 1.00 . A A . 27 ARG NH1 1 1 4 2523 1 1 23 ARG NH2 N 8.440 -4.653 -7.853 1.00 . A A . 27 ARG NH2 1 1 4 2524 1 1 23 ARG O O 5.621 0.946 -2.422 1.00 . A A . 27 ARG O 1 1 4 2525 1 1 24 TYR C C 2.409 2.248 -3.109 1.00 . A A . 28 TYR C 1 1 4 2526 1 1 24 TYR CA C 3.785 2.825 -2.870 1.00 . A A . 28 TYR CA 1 1 4 2527 1 1 24 TYR CB C 3.820 4.362 -2.982 1.00 . A A . 28 TYR CB 1 1 4 2528 1 1 24 TYR CD1 C 2.656 4.129 -5.249 1.00 . A A . 28 TYR CD1 1 1 4 2529 1 1 24 TYR CD2 C 2.521 6.234 -4.059 1.00 . A A . 28 TYR CD2 1 1 4 2530 1 1 24 TYR CE1 C 1.911 4.675 -6.294 1.00 . A A . 28 TYR CE1 1 1 4 2531 1 1 24 TYR CE2 C 1.767 6.772 -5.104 1.00 . A A . 28 TYR CE2 1 1 4 2532 1 1 24 TYR CG C 2.967 4.907 -4.123 1.00 . A A . 28 TYR CG 1 1 4 2533 1 1 24 TYR CZ C 1.466 5.995 -6.223 1.00 . A A . 28 TYR CZ 1 1 4 2534 1 1 24 TYR H H 4.663 2.590 -4.822 1.00 . A A . 28 TYR H 1 1 4 2535 1 1 24 TYR HA H 4.120 2.525 -1.888 1.00 . A A . 28 TYR HA 1 1 4 2536 1 1 24 TYR HB2 H 3.463 4.783 -2.054 1.00 . A A . 28 TYR HB2 1 1 4 2537 1 1 24 TYR HB3 H 4.840 4.675 -3.133 1.00 . A A . 28 TYR HB3 1 1 4 2538 1 1 24 TYR HD1 H 2.975 3.110 -5.307 1.00 . A A . 28 TYR HD1 1 1 4 2539 1 1 24 TYR HD2 H 2.747 6.839 -3.196 1.00 . A A . 28 TYR HD2 1 1 4 2540 1 1 24 TYR HE1 H 1.676 4.073 -7.154 1.00 . A A . 28 TYR HE1 1 1 4 2541 1 1 24 TYR HE2 H 1.424 7.790 -5.047 1.00 . A A . 28 TYR HE2 1 1 4 2542 1 1 24 TYR HH H 1.055 6.143 -8.079 1.00 . A A . 28 TYR HH 1 1 4 2543 1 1 24 TYR N N 4.711 2.289 -3.893 1.00 . A A . 28 TYR N 1 1 4 2544 1 1 24 TYR O O 2.183 1.511 -4.051 1.00 . A A . 28 TYR O 1 1 4 2545 1 1 24 TYR OH O 0.739 6.535 -7.262 1.00 . A A . 28 TYR OH 1 1 4 2546 1 1 25 PHE C C -0.847 3.144 -2.471 1.00 . A A . 29 PHE C 1 1 4 2547 1 1 25 PHE CA C 0.147 2.001 -2.416 1.00 . A A . 29 PHE CA 1 1 4 2548 1 1 25 PHE CB C -0.010 1.073 -1.217 1.00 . A A . 29 PHE CB 1 1 4 2549 1 1 25 PHE CD1 C 2.354 0.159 -1.121 1.00 . A A . 29 PHE CD1 1 1 4 2550 1 1 25 PHE CD2 C 0.576 -1.263 -1.947 1.00 . A A . 29 PHE CD2 1 1 4 2551 1 1 25 PHE CE1 C 3.280 -0.865 -1.360 1.00 . A A . 29 PHE CE1 1 1 4 2552 1 1 25 PHE CE2 C 1.503 -2.283 -2.189 1.00 . A A . 29 PHE CE2 1 1 4 2553 1 1 25 PHE CG C 0.995 -0.043 -1.414 1.00 . A A . 29 PHE CG 1 1 4 2554 1 1 25 PHE CZ C 2.854 -2.084 -1.897 1.00 . A A . 29 PHE CZ 1 1 4 2555 1 1 25 PHE H H 1.711 3.136 -1.501 1.00 . A A . 29 PHE H 1 1 4 2556 1 1 25 PHE HA H 0.093 1.428 -3.328 1.00 . A A . 29 PHE HA 1 1 4 2557 1 1 25 PHE HB2 H 0.196 1.608 -0.300 1.00 . A A . 29 PHE HB2 1 1 4 2558 1 1 25 PHE HB3 H -1.011 0.669 -1.192 1.00 . A A . 29 PHE HB3 1 1 4 2559 1 1 25 PHE HD1 H 2.689 1.102 -0.708 1.00 . A A . 29 PHE HD1 1 1 4 2560 1 1 25 PHE HD2 H -0.464 -1.417 -2.173 1.00 . A A . 29 PHE HD2 1 1 4 2561 1 1 25 PHE HE1 H 4.324 -0.711 -1.140 1.00 . A A . 29 PHE HE1 1 1 4 2562 1 1 25 PHE HE2 H 1.175 -3.224 -2.610 1.00 . A A . 29 PHE HE2 1 1 4 2563 1 1 25 PHE HZ H 3.568 -2.870 -2.092 1.00 . A A . 29 PHE HZ 1 1 4 2564 1 1 25 PHE N N 1.500 2.552 -2.257 1.00 . A A . 29 PHE N 1 1 4 2565 1 1 25 PHE O O -1.154 3.791 -1.485 1.00 . A A . 29 PHE O 1 1 4 2566 1 1 26 LEU C C -3.651 4.121 -3.409 1.00 . A A . 30 LEU C 1 1 4 2567 1 1 26 LEU CA C -2.258 4.518 -3.894 1.00 . A A . 30 LEU CA 1 1 4 2568 1 1 26 LEU CB C -2.203 4.705 -5.419 1.00 . A A . 30 LEU CB 1 1 4 2569 1 1 26 LEU CD1 C -1.148 6.961 -5.031 1.00 . A A . 30 LEU CD1 1 1 4 2570 1 1 26 LEU CD2 C -1.895 6.294 -7.301 1.00 . A A . 30 LEU CD2 1 1 4 2571 1 1 26 LEU CG C -2.209 6.186 -5.812 1.00 . A A . 30 LEU CG 1 1 4 2572 1 1 26 LEU H H -0.999 2.866 -4.422 1.00 . A A . 30 LEU H 1 1 4 2573 1 1 26 LEU HA H -1.927 5.409 -3.391 1.00 . A A . 30 LEU HA 1 1 4 2574 1 1 26 LEU HB2 H -1.300 4.248 -5.794 1.00 . A A . 30 LEU HB2 1 1 4 2575 1 1 26 LEU HB3 H -3.049 4.221 -5.868 1.00 . A A . 30 LEU HB3 1 1 4 2576 1 1 26 LEU HD11 H -1.636 7.679 -4.394 1.00 . A A . 30 LEU HD11 1 1 4 2577 1 1 26 LEU HD12 H -0.495 7.477 -5.720 1.00 . A A . 30 LEU HD12 1 1 4 2578 1 1 26 LEU HD13 H -0.568 6.278 -4.430 1.00 . A A . 30 LEU HD13 1 1 4 2579 1 1 26 LEU HD21 H -1.270 5.463 -7.594 1.00 . A A . 30 LEU HD21 1 1 4 2580 1 1 26 LEU HD22 H -1.372 7.220 -7.490 1.00 . A A . 30 LEU HD22 1 1 4 2581 1 1 26 LEU HD23 H -2.812 6.273 -7.865 1.00 . A A . 30 LEU HD23 1 1 4 2582 1 1 26 LEU HG H -3.179 6.609 -5.615 1.00 . A A . 30 LEU HG 1 1 4 2583 1 1 26 LEU N N -1.307 3.406 -3.659 1.00 . A A . 30 LEU N 1 1 4 2584 1 1 26 LEU O O -4.301 3.257 -3.971 1.00 . A A . 30 LEU O 1 1 4 2585 1 1 27 ASN C C -6.514 5.277 -2.467 1.00 . A A . 31 ASN C 1 1 4 2586 1 1 27 ASN CA C -5.445 4.415 -1.800 1.00 . A A . 31 ASN CA 1 1 4 2587 1 1 27 ASN CB C -5.343 4.749 -0.309 1.00 . A A . 31 ASN CB 1 1 4 2588 1 1 27 ASN CG C -6.643 4.377 0.391 1.00 . A A . 31 ASN CG 1 1 4 2589 1 1 27 ASN H H -3.550 5.424 -1.917 1.00 . A A . 31 ASN H 1 1 4 2590 1 1 27 ASN HA H -5.664 3.367 -1.929 1.00 . A A . 31 ASN HA 1 1 4 2591 1 1 27 ASN HB2 H -4.534 4.189 0.132 1.00 . A A . 31 ASN HB2 1 1 4 2592 1 1 27 ASN HB3 H -5.158 5.806 -0.190 1.00 . A A . 31 ASN HB3 1 1 4 2593 1 1 27 ASN HD21 H -5.752 4.035 2.127 1.00 . A A . 31 ASN HD21 1 1 4 2594 1 1 27 ASN HD22 H -7.425 3.793 2.110 1.00 . A A . 31 ASN HD22 1 1 4 2595 1 1 27 ASN N N -4.102 4.742 -2.354 1.00 . A A . 31 ASN N 1 1 4 2596 1 1 27 ASN ND2 N -6.605 4.042 1.648 1.00 . A A . 31 ASN ND2 1 1 4 2597 1 1 27 ASN O O -6.589 6.473 -2.246 1.00 . A A . 31 ASN O 1 1 4 2598 1 1 27 ASN OD1 O -7.700 4.391 -0.208 1.00 . A A . 31 ASN OD1 1 1 4 2599 1 1 28 HIS C C -9.642 5.600 -3.052 1.00 . A A . 32 HIS C 1 1 4 2600 1 1 28 HIS CA C -8.420 5.446 -3.967 1.00 . A A . 32 HIS CA 1 1 4 2601 1 1 28 HIS CB C -8.775 4.612 -5.198 1.00 . A A . 32 HIS CB 1 1 4 2602 1 1 28 HIS CD2 C -6.860 4.799 -6.986 1.00 . A A . 32 HIS CD2 1 1 4 2603 1 1 28 HIS CE1 C -7.668 6.441 -8.146 1.00 . A A . 32 HIS CE1 1 1 4 2604 1 1 28 HIS CG C -8.048 5.153 -6.398 1.00 . A A . 32 HIS CG 1 1 4 2605 1 1 28 HIS H H -7.259 3.711 -3.435 1.00 . A A . 32 HIS H 1 1 4 2606 1 1 28 HIS HA H -8.053 6.414 -4.273 1.00 . A A . 32 HIS HA 1 1 4 2607 1 1 28 HIS HB2 H -8.486 3.585 -5.034 1.00 . A A . 32 HIS HB2 1 1 4 2608 1 1 28 HIS HB3 H -9.840 4.663 -5.370 1.00 . A A . 32 HIS HB3 1 1 4 2609 1 1 28 HIS HD1 H -9.385 6.683 -6.996 1.00 . A A . 32 HIS HD1 1 1 4 2610 1 1 28 HIS HD2 H -6.207 4.007 -6.646 1.00 . A A . 32 HIS HD2 1 1 4 2611 1 1 28 HIS HE1 H -7.794 7.207 -8.895 1.00 . A A . 32 HIS HE1 1 1 4 2612 1 1 28 HIS N N -7.344 4.675 -3.280 1.00 . A A . 32 HIS N 1 1 4 2613 1 1 28 HIS ND1 N -8.547 6.203 -7.154 1.00 . A A . 32 HIS ND1 1 1 4 2614 1 1 28 HIS NE2 N -6.621 5.613 -8.090 1.00 . A A . 32 HIS NE2 1 1 4 2615 1 1 28 HIS O O -10.592 6.279 -3.387 1.00 . A A . 32 HIS O 1 1 4 2616 1 1 29 ILE C C -10.558 6.359 -0.099 1.00 . A A . 33 ILE C 1 1 4 2617 1 1 29 ILE CA C -10.788 5.128 -0.962 1.00 . A A . 33 ILE CA 1 1 4 2618 1 1 29 ILE CB C -10.841 3.871 -0.060 1.00 . A A . 33 ILE CB 1 1 4 2619 1 1 29 ILE CD1 C -10.484 1.365 0.035 1.00 . A A . 33 ILE CD1 1 1 4 2620 1 1 29 ILE CG1 C -10.173 2.655 -0.737 1.00 . A A . 33 ILE CG1 1 1 4 2621 1 1 29 ILE CG2 C -12.312 3.555 0.240 1.00 . A A . 33 ILE CG2 1 1 4 2622 1 1 29 ILE H H -8.845 4.462 -1.632 1.00 . A A . 33 ILE H 1 1 4 2623 1 1 29 ILE HA H -11.706 5.226 -1.521 1.00 . A A . 33 ILE HA 1 1 4 2624 1 1 29 ILE HB H -10.333 4.086 0.871 1.00 . A A . 33 ILE HB 1 1 4 2625 1 1 29 ILE HD11 H -9.561 0.851 0.263 1.00 . A A . 33 ILE HD11 1 1 4 2626 1 1 29 ILE HD12 H -11.111 0.726 -0.569 1.00 . A A . 33 ILE HD12 1 1 4 2627 1 1 29 ILE HD13 H -10.997 1.608 0.954 1.00 . A A . 33 ILE HD13 1 1 4 2628 1 1 29 ILE HG12 H -10.535 2.568 -1.748 1.00 . A A . 33 ILE HG12 1 1 4 2629 1 1 29 ILE HG13 H -9.103 2.805 -0.750 1.00 . A A . 33 ILE HG13 1 1 4 2630 1 1 29 ILE HG21 H -12.433 3.377 1.298 1.00 . A A . 33 ILE HG21 1 1 4 2631 1 1 29 ILE HG22 H -12.610 2.675 -0.310 1.00 . A A . 33 ILE HG22 1 1 4 2632 1 1 29 ILE HG23 H -12.927 4.391 -0.057 1.00 . A A . 33 ILE HG23 1 1 4 2633 1 1 29 ILE N N -9.622 4.991 -1.894 1.00 . A A . 33 ILE N 1 1 4 2634 1 1 29 ILE O O -11.291 7.325 -0.152 1.00 . A A . 33 ILE O 1 1 4 2635 1 1 30 ASP C C -8.306 8.483 0.795 1.00 . A A . 34 ASP C 1 1 4 2636 1 1 30 ASP CA C -9.204 7.493 1.551 1.00 . A A . 34 ASP CA 1 1 4 2637 1 1 30 ASP CB C -8.463 6.906 2.753 1.00 . A A . 34 ASP CB 1 1 4 2638 1 1 30 ASP CG C -9.146 7.357 4.045 1.00 . A A . 34 ASP CG 1 1 4 2639 1 1 30 ASP H H -8.943 5.530 0.693 1.00 . A A . 34 ASP H 1 1 4 2640 1 1 30 ASP HA H -10.110 7.979 1.879 1.00 . A A . 34 ASP HA 1 1 4 2641 1 1 30 ASP HB2 H -8.481 5.828 2.695 1.00 . A A . 34 ASP HB2 1 1 4 2642 1 1 30 ASP HB3 H -7.439 7.250 2.748 1.00 . A A . 34 ASP HB3 1 1 4 2643 1 1 30 ASP N N -9.522 6.325 0.684 1.00 . A A . 34 ASP N 1 1 4 2644 1 1 30 ASP O O -7.802 9.432 1.362 1.00 . A A . 34 ASP O 1 1 4 2645 1 1 30 ASP OD1 O -10.279 6.962 4.263 1.00 . A A . 34 ASP OD1 1 1 4 2646 1 1 30 ASP OD2 O -8.523 8.092 4.795 1.00 . A A . 34 ASP OD2 1 1 4 2647 1 1 31 GLN C C -5.897 9.412 -0.553 1.00 . A A . 35 GLN C 1 1 4 2648 1 1 31 GLN CA C -7.232 9.197 -1.268 1.00 . A A . 35 GLN CA 1 1 4 2649 1 1 31 GLN CB C -8.017 10.507 -1.340 1.00 . A A . 35 GLN CB 1 1 4 2650 1 1 31 GLN CD C -10.038 11.568 -2.357 1.00 . A A . 35 GLN CD 1 1 4 2651 1 1 31 GLN CG C -9.401 10.242 -1.941 1.00 . A A . 35 GLN CG 1 1 4 2652 1 1 31 GLN H H -8.510 7.500 -0.925 1.00 . A A . 35 GLN H 1 1 4 2653 1 1 31 GLN HA H -7.070 8.811 -2.261 1.00 . A A . 35 GLN HA 1 1 4 2654 1 1 31 GLN HB2 H -8.129 10.916 -0.346 1.00 . A A . 35 GLN HB2 1 1 4 2655 1 1 31 GLN HB3 H -7.485 11.212 -1.961 1.00 . A A . 35 GLN HB3 1 1 4 2656 1 1 31 GLN HE21 H -8.946 11.738 -4.006 1.00 . A A . 35 GLN HE21 1 1 4 2657 1 1 31 GLN HE22 H -10.047 13.001 -3.732 1.00 . A A . 35 GLN HE22 1 1 4 2658 1 1 31 GLN HG2 H -9.300 9.602 -2.805 1.00 . A A . 35 GLN HG2 1 1 4 2659 1 1 31 GLN HG3 H -10.025 9.758 -1.205 1.00 . A A . 35 GLN HG3 1 1 4 2660 1 1 31 GLN N N -8.099 8.269 -0.482 1.00 . A A . 35 GLN N 1 1 4 2661 1 1 31 GLN NE2 N -9.645 12.151 -3.457 1.00 . A A . 35 GLN NE2 1 1 4 2662 1 1 31 GLN O O -5.669 10.437 0.058 1.00 . A A . 35 GLN O 1 1 4 2663 1 1 31 GLN OE1 O -10.904 12.080 -1.676 1.00 . A A . 35 GLN OE1 1 1 4 2664 1 1 32 THR C C -2.644 7.676 -0.514 1.00 . A A . 36 THR C 1 1 4 2665 1 1 32 THR CA C -3.696 8.623 0.071 1.00 . A A . 36 THR CA 1 1 4 2666 1 1 32 THR CB C -3.969 8.275 1.536 1.00 . A A . 36 THR CB 1 1 4 2667 1 1 32 THR CG2 C -4.480 9.515 2.271 1.00 . A A . 36 THR CG2 1 1 4 2668 1 1 32 THR H H -5.213 7.627 -1.114 1.00 . A A . 36 THR H 1 1 4 2669 1 1 32 THR HA H -3.362 9.646 -0.003 1.00 . A A . 36 THR HA 1 1 4 2670 1 1 32 THR HB H -3.058 7.936 2.003 1.00 . A A . 36 THR HB 1 1 4 2671 1 1 32 THR HG1 H -4.493 6.415 1.754 1.00 . A A . 36 THR HG1 1 1 4 2672 1 1 32 THR HG21 H -5.560 9.510 2.280 1.00 . A A . 36 THR HG21 1 1 4 2673 1 1 32 THR HG22 H -4.129 10.403 1.765 1.00 . A A . 36 THR HG22 1 1 4 2674 1 1 32 THR HG23 H -4.112 9.509 3.286 1.00 . A A . 36 THR HG23 1 1 4 2675 1 1 32 THR N N -5.011 8.454 -0.618 1.00 . A A . 36 THR N 1 1 4 2676 1 1 32 THR O O -2.946 6.810 -1.309 1.00 . A A . 36 THR O 1 1 4 2677 1 1 32 THR OG1 O -4.946 7.246 1.601 1.00 . A A . 36 THR OG1 1 1 4 2678 1 1 33 THR C C 0.533 6.415 0.498 1.00 . A A . 37 THR C 1 1 4 2679 1 1 33 THR CA C -0.332 6.942 -0.647 1.00 . A A . 37 THR CA 1 1 4 2680 1 1 33 THR CB C 0.529 7.815 -1.566 1.00 . A A . 37 THR CB 1 1 4 2681 1 1 33 THR CG2 C -0.353 8.559 -2.565 1.00 . A A . 37 THR CG2 1 1 4 2682 1 1 33 THR H H -1.185 8.539 0.525 1.00 . A A . 37 THR H 1 1 4 2683 1 1 33 THR HA H -0.759 6.126 -1.207 1.00 . A A . 37 THR HA 1 1 4 2684 1 1 33 THR HB H 1.222 7.186 -2.106 1.00 . A A . 37 THR HB 1 1 4 2685 1 1 33 THR HG1 H 1.553 9.457 -1.356 1.00 . A A . 37 THR HG1 1 1 4 2686 1 1 33 THR HG21 H -1.347 8.144 -2.546 1.00 . A A . 37 THR HG21 1 1 4 2687 1 1 33 THR HG22 H 0.065 8.455 -3.557 1.00 . A A . 37 THR HG22 1 1 4 2688 1 1 33 THR HG23 H -0.392 9.606 -2.301 1.00 . A A . 37 THR HG23 1 1 4 2689 1 1 33 THR N N -1.406 7.835 -0.119 1.00 . A A . 37 THR N 1 1 4 2690 1 1 33 THR O O 1.165 7.172 1.207 1.00 . A A . 37 THR O 1 1 4 2691 1 1 33 THR OG1 O 1.253 8.751 -0.779 1.00 . A A . 37 THR OG1 1 1 4 2692 1 1 34 THR C C 2.511 3.661 1.131 1.00 . A A . 38 THR C 1 1 4 2693 1 1 34 THR CA C 1.449 4.568 1.754 1.00 . A A . 38 THR CA 1 1 4 2694 1 1 34 THR CB C 0.507 3.778 2.670 1.00 . A A . 38 THR CB 1 1 4 2695 1 1 34 THR CG2 C -0.072 2.582 1.917 1.00 . A A . 38 THR CG2 1 1 4 2696 1 1 34 THR H H 0.090 4.527 0.070 1.00 . A A . 38 THR H 1 1 4 2697 1 1 34 THR HA H 1.919 5.367 2.308 1.00 . A A . 38 THR HA 1 1 4 2698 1 1 34 THR HB H -0.299 4.418 2.994 1.00 . A A . 38 THR HB 1 1 4 2699 1 1 34 THR HG1 H 1.863 2.661 3.505 1.00 . A A . 38 THR HG1 1 1 4 2700 1 1 34 THR HG21 H -0.461 2.912 0.969 1.00 . A A . 38 THR HG21 1 1 4 2701 1 1 34 THR HG22 H -0.868 2.140 2.499 1.00 . A A . 38 THR HG22 1 1 4 2702 1 1 34 THR HG23 H 0.704 1.848 1.752 1.00 . A A . 38 THR HG23 1 1 4 2703 1 1 34 THR N N 0.591 5.128 0.669 1.00 . A A . 38 THR N 1 1 4 2704 1 1 34 THR O O 2.297 3.082 0.090 1.00 . A A . 38 THR O 1 1 4 2705 1 1 34 THR OG1 O 1.230 3.318 3.804 1.00 . A A . 38 THR OG1 1 1 4 2706 1 1 35 TRP C C 4.518 1.222 1.617 1.00 . A A . 39 TRP C 1 1 4 2707 1 1 35 TRP CA C 4.713 2.666 1.150 1.00 . A A . 39 TRP CA 1 1 4 2708 1 1 35 TRP CB C 6.060 3.211 1.654 1.00 . A A . 39 TRP CB 1 1 4 2709 1 1 35 TRP CD1 C 5.638 5.581 2.440 1.00 . A A . 39 TRP CD1 1 1 4 2710 1 1 35 TRP CD2 C 6.727 5.519 0.468 1.00 . A A . 39 TRP CD2 1 1 4 2711 1 1 35 TRP CE2 C 6.560 6.884 0.802 1.00 . A A . 39 TRP CE2 1 1 4 2712 1 1 35 TRP CE3 C 7.389 5.211 -0.738 1.00 . A A . 39 TRP CE3 1 1 4 2713 1 1 35 TRP CG C 6.127 4.706 1.528 1.00 . A A . 39 TRP CG 1 1 4 2714 1 1 35 TRP CH2 C 7.691 7.581 -1.209 1.00 . A A . 39 TRP CH2 1 1 4 2715 1 1 35 TRP CZ2 C 7.033 7.903 -0.021 1.00 . A A . 39 TRP CZ2 1 1 4 2716 1 1 35 TRP CZ3 C 7.868 6.238 -1.567 1.00 . A A . 39 TRP CZ3 1 1 4 2717 1 1 35 TRP H H 3.819 4.013 2.583 1.00 . A A . 39 TRP H 1 1 4 2718 1 1 35 TRP HA H 4.673 2.715 0.071 1.00 . A A . 39 TRP HA 1 1 4 2719 1 1 35 TRP HB2 H 6.184 2.937 2.691 1.00 . A A . 39 TRP HB2 1 1 4 2720 1 1 35 TRP HB3 H 6.857 2.771 1.073 1.00 . A A . 39 TRP HB3 1 1 4 2721 1 1 35 TRP HD1 H 5.129 5.315 3.353 1.00 . A A . 39 TRP HD1 1 1 4 2722 1 1 35 TRP HE1 H 5.638 7.688 2.484 1.00 . A A . 39 TRP HE1 1 1 4 2723 1 1 35 TRP HE3 H 7.528 4.184 -1.032 1.00 . A A . 39 TRP HE3 1 1 4 2724 1 1 35 TRP HH2 H 8.061 8.365 -1.852 1.00 . A A . 39 TRP HH2 1 1 4 2725 1 1 35 TRP HZ2 H 6.893 8.936 0.262 1.00 . A A . 39 TRP HZ2 1 1 4 2726 1 1 35 TRP HZ3 H 8.377 5.991 -2.485 1.00 . A A . 39 TRP HZ3 1 1 4 2727 1 1 35 TRP N N 3.654 3.537 1.744 1.00 . A A . 39 TRP N 1 1 4 2728 1 1 35 TRP NE1 N 5.892 6.869 2.008 1.00 . A A . 39 TRP NE1 1 1 4 2729 1 1 35 TRP O O 4.616 0.289 0.845 1.00 . A A . 39 TRP O 1 1 4 2730 1 1 36 GLN C C 2.630 -0.843 3.061 1.00 . A A . 40 GLN C 1 1 4 2731 1 1 36 GLN CA C 4.042 -0.356 3.395 1.00 . A A . 40 GLN CA 1 1 4 2732 1 1 36 GLN CB C 4.228 -0.245 4.910 1.00 . A A . 40 GLN CB 1 1 4 2733 1 1 36 GLN CD C 5.423 1.596 6.106 1.00 . A A . 40 GLN CD 1 1 4 2734 1 1 36 GLN CG C 5.599 0.365 5.212 1.00 . A A . 40 GLN CG 1 1 4 2735 1 1 36 GLN H H 4.169 1.794 3.487 1.00 . A A . 40 GLN H 1 1 4 2736 1 1 36 GLN HA H 4.781 -1.023 2.981 1.00 . A A . 40 GLN HA 1 1 4 2737 1 1 36 GLN HB2 H 3.455 0.386 5.321 1.00 . A A . 40 GLN HB2 1 1 4 2738 1 1 36 GLN HB3 H 4.167 -1.227 5.352 1.00 . A A . 40 GLN HB3 1 1 4 2739 1 1 36 GLN HE21 H 6.171 0.708 7.717 1.00 . A A . 40 GLN HE21 1 1 4 2740 1 1 36 GLN HE22 H 5.680 2.318 7.937 1.00 . A A . 40 GLN HE22 1 1 4 2741 1 1 36 GLN HG2 H 6.213 -0.363 5.719 1.00 . A A . 40 GLN HG2 1 1 4 2742 1 1 36 GLN HG3 H 6.075 0.658 4.287 1.00 . A A . 40 GLN HG3 1 1 4 2743 1 1 36 GLN N N 4.244 1.029 2.879 1.00 . A A . 40 GLN N 1 1 4 2744 1 1 36 GLN NE2 N 5.789 1.536 7.357 1.00 . A A . 40 GLN NE2 1 1 4 2745 1 1 36 GLN O O 2.007 -0.376 2.128 1.00 . A A . 40 GLN O 1 1 4 2746 1 1 36 GLN OE1 O 4.948 2.622 5.660 1.00 . A A . 40 GLN OE1 1 1 4 2747 1 1 37 ASP C C -0.092 -2.280 4.823 1.00 . A A . 41 ASP C 1 1 4 2748 1 1 37 ASP CA C 0.748 -2.292 3.539 1.00 . A A . 41 ASP CA 1 1 4 2749 1 1 37 ASP CB C 0.954 -3.724 3.046 1.00 . A A . 41 ASP CB 1 1 4 2750 1 1 37 ASP CG C 1.625 -4.550 4.145 1.00 . A A . 41 ASP CG 1 1 4 2751 1 1 37 ASP H H 2.638 -2.142 4.565 1.00 . A A . 41 ASP H 1 1 4 2752 1 1 37 ASP HA H 0.274 -1.702 2.771 1.00 . A A . 41 ASP HA 1 1 4 2753 1 1 37 ASP HB2 H -0.003 -4.162 2.801 1.00 . A A . 41 ASP HB2 1 1 4 2754 1 1 37 ASP HB3 H 1.582 -3.716 2.168 1.00 . A A . 41 ASP HB3 1 1 4 2755 1 1 37 ASP N N 2.121 -1.777 3.816 1.00 . A A . 41 ASP N 1 1 4 2756 1 1 37 ASP O O 0.419 -2.542 5.894 1.00 . A A . 41 ASP O 1 1 4 2757 1 1 37 ASP OD1 O 2.759 -4.245 4.479 1.00 . A A . 41 ASP OD1 1 1 4 2758 1 1 37 ASP OD2 O 0.997 -5.473 4.634 1.00 . A A . 41 ASP OD2 1 1 4 2759 1 1 38 PRO C C -2.565 -3.354 6.345 1.00 . A A . 42 PRO C 1 1 4 2760 1 1 38 PRO CA C -2.266 -1.935 5.852 1.00 . A A . 42 PRO CA 1 1 4 2761 1 1 38 PRO CB C -3.529 -1.273 5.311 1.00 . A A . 42 PRO CB 1 1 4 2762 1 1 38 PRO CD C -2.066 -1.647 3.427 1.00 . A A . 42 PRO CD 1 1 4 2763 1 1 38 PRO CG C -3.511 -1.546 3.841 1.00 . A A . 42 PRO CG 1 1 4 2764 1 1 38 PRO HA H -1.842 -1.336 6.642 1.00 . A A . 42 PRO HA 1 1 4 2765 1 1 38 PRO HB2 H -4.406 -1.711 5.763 1.00 . A A . 42 PRO HB2 1 1 4 2766 1 1 38 PRO HB3 H -3.502 -0.208 5.495 1.00 . A A . 42 PRO HB3 1 1 4 2767 1 1 38 PRO HD2 H -1.933 -2.435 2.700 1.00 . A A . 42 PRO HD2 1 1 4 2768 1 1 38 PRO HD3 H -1.716 -0.703 3.035 1.00 . A A . 42 PRO HD3 1 1 4 2769 1 1 38 PRO HG2 H -4.019 -2.474 3.633 1.00 . A A . 42 PRO HG2 1 1 4 2770 1 1 38 PRO HG3 H -3.989 -0.735 3.309 1.00 . A A . 42 PRO HG3 1 1 4 2771 1 1 38 PRO N N -1.360 -1.977 4.677 1.00 . A A . 42 PRO N 1 1 4 2772 1 1 38 PRO O O -1.985 -4.317 5.884 1.00 . A A . 42 PRO O 1 1 4 2773 1 1 39 ARG C C -2.529 -5.569 8.252 1.00 . A A . 43 ARG C 1 1 4 2774 1 1 39 ARG CA C -3.801 -4.846 7.802 1.00 . A A . 43 ARG CA 1 1 4 2775 1 1 39 ARG CB C -4.445 -5.577 6.623 1.00 . A A . 43 ARG CB 1 1 4 2776 1 1 39 ARG CD C -6.565 -5.213 5.353 1.00 . A A . 43 ARG CD 1 1 4 2777 1 1 39 ARG CG C -5.967 -5.482 6.735 1.00 . A A . 43 ARG CG 1 1 4 2778 1 1 39 ARG CZ C -8.831 -5.941 5.901 1.00 . A A . 43 ARG CZ 1 1 4 2779 1 1 39 ARG H H -3.922 -2.701 7.640 1.00 . A A . 43 ARG H 1 1 4 2780 1 1 39 ARG HA H -4.502 -4.774 8.618 1.00 . A A . 43 ARG HA 1 1 4 2781 1 1 39 ARG HB2 H -4.123 -5.120 5.698 1.00 . A A . 43 ARG HB2 1 1 4 2782 1 1 39 ARG HB3 H -4.146 -6.615 6.634 1.00 . A A . 43 ARG HB3 1 1 4 2783 1 1 39 ARG HD2 H -6.101 -4.345 4.906 1.00 . A A . 43 ARG HD2 1 1 4 2784 1 1 39 ARG HD3 H -6.442 -6.076 4.715 1.00 . A A . 43 ARG HD3 1 1 4 2785 1 1 39 ARG HE H -8.359 -4.042 5.550 1.00 . A A . 43 ARG HE 1 1 4 2786 1 1 39 ARG HG2 H -6.359 -6.413 7.121 1.00 . A A . 43 ARG HG2 1 1 4 2787 1 1 39 ARG HG3 H -6.231 -4.676 7.405 1.00 . A A . 43 ARG HG3 1 1 4 2788 1 1 39 ARG HH11 H -7.437 -7.387 5.820 1.00 . A A . 43 ARG HH11 1 1 4 2789 1 1 39 ARG HH12 H -9.039 -7.911 6.208 1.00 . A A . 43 ARG HH12 1 1 4 2790 1 1 39 ARG HH21 H -10.430 -4.747 6.056 1.00 . A A . 43 ARG HH21 1 1 4 2791 1 1 39 ARG HH22 H -10.721 -6.430 6.341 1.00 . A A . 43 ARG HH22 1 1 4 2792 1 1 39 ARG N N -3.465 -3.491 7.280 1.00 . A A . 43 ARG N 1 1 4 2793 1 1 39 ARG NE N -8.014 -4.957 5.605 1.00 . A A . 43 ARG NE 1 1 4 2794 1 1 39 ARG NH1 N -8.400 -7.176 5.982 1.00 . A A . 43 ARG NH1 1 1 4 2795 1 1 39 ARG NH2 N -10.093 -5.686 6.117 1.00 . A A . 43 ARG NH2 1 1 4 2796 1 1 39 ARG O O -1.999 -6.409 7.550 1.00 . A A . 43 ARG O 1 1 4 2797 1 1 40 LYS C C 0.320 -5.807 8.869 1.00 . A A . 44 LYS C 1 1 4 2798 1 1 40 LYS CA C -0.797 -5.922 9.911 1.00 . A A . 44 LYS CA 1 1 4 2799 1 1 40 LYS CB C -1.192 -7.385 10.115 1.00 . A A . 44 LYS CB 1 1 4 2800 1 1 40 LYS CD C -1.016 -9.347 11.652 1.00 . A A . 44 LYS CD 1 1 4 2801 1 1 40 LYS CE C -1.615 -9.607 13.035 1.00 . A A . 44 LYS CE 1 1 4 2802 1 1 40 LYS CG C -0.727 -7.852 11.495 1.00 . A A . 44 LYS CG 1 1 4 2803 1 1 40 LYS H H -2.477 -4.574 9.968 1.00 . A A . 44 LYS H 1 1 4 2804 1 1 40 LYS HA H -0.484 -5.492 10.848 1.00 . A A . 44 LYS HA 1 1 4 2805 1 1 40 LYS HB2 H -2.266 -7.481 10.045 1.00 . A A . 44 LYS HB2 1 1 4 2806 1 1 40 LYS HB3 H -0.726 -7.994 9.354 1.00 . A A . 44 LYS HB3 1 1 4 2807 1 1 40 LYS HD2 H -1.715 -9.659 10.891 1.00 . A A . 44 LYS HD2 1 1 4 2808 1 1 40 LYS HD3 H -0.095 -9.903 11.548 1.00 . A A . 44 LYS HD3 1 1 4 2809 1 1 40 LYS HE2 H -1.088 -10.410 13.529 1.00 . A A . 44 LYS HE2 1 1 4 2810 1 1 40 LYS HE3 H -1.581 -8.710 13.635 1.00 . A A . 44 LYS HE3 1 1 4 2811 1 1 40 LYS HG2 H 0.333 -7.677 11.596 1.00 . A A . 44 LYS HG2 1 1 4 2812 1 1 40 LYS HG3 H -1.257 -7.301 12.258 1.00 . A A . 44 LYS HG3 1 1 4 2813 1 1 40 LYS HZ1 H -3.058 -10.670 11.975 1.00 . A A . 44 LYS HZ1 1 1 4 2814 1 1 40 LYS HZ2 H -3.586 -9.155 12.535 1.00 . A A . 44 LYS HZ2 1 1 4 2815 1 1 40 LYS HZ3 H -3.426 -10.454 13.616 1.00 . A A . 44 LYS HZ3 1 1 4 2816 1 1 40 LYS N N -2.034 -5.253 9.417 1.00 . A A . 44 LYS N 1 1 4 2817 1 1 40 LYS NZ N -3.028 -10.001 12.771 1.00 . A A . 44 LYS NZ 1 1 4 2818 1 1 40 LYS O O 0.377 -6.657 7.996 1.00 . A A . 44 LYS O 1 1 4 2819 1 1 40 LYS OXT O 1.097 -4.872 8.963 1.00 . A A . 44 LYS OXT 1 1 4 2820 2 2 1 ACE C C 7.714 9.722 5.430 1.00 . B B . 45 ACE C 1 1 4 2821 2 2 1 ACE CH3 C 7.190 10.898 6.256 1.00 . B B . 45 ACE CH3 1 1 4 2822 2 2 1 ACE H1 H 6.261 11.251 5.834 1.00 . B B . 45 ACE H1 1 1 4 2823 2 2 1 ACE H2 H 7.917 11.697 6.247 1.00 . B B . 45 ACE H2 1 1 4 2824 2 2 1 ACE H3 H 7.023 10.576 7.274 1.00 . B B . 45 ACE H3 1 1 4 2825 2 2 1 ACE O O 7.384 8.584 5.691 1.00 . B B . 45 ACE O 1 1 4 2826 2 2 2 PRO C C 6.747 10.198 2.722 1.00 . B B . 46 PRO C 1 1 4 2827 2 2 2 PRO CA C 8.004 10.847 3.313 1.00 . B B . 46 PRO CA 1 1 4 2828 2 2 2 PRO CB C 9.146 10.826 2.303 1.00 . B B . 46 PRO CB 1 1 4 2829 2 2 2 PRO CD C 9.742 9.318 4.088 1.00 . B B . 46 PRO CD 1 1 4 2830 2 2 2 PRO CG C 9.916 9.586 2.616 1.00 . B B . 46 PRO CG 1 1 4 2831 2 2 2 PRO HA H 7.800 11.861 3.621 1.00 . B B . 46 PRO HA 1 1 4 2832 2 2 2 PRO HB2 H 8.755 10.785 1.295 1.00 . B B . 46 PRO HB2 1 1 4 2833 2 2 2 PRO HB3 H 9.775 11.693 2.428 1.00 . B B . 46 PRO HB3 1 1 4 2834 2 2 2 PRO HD2 H 9.623 8.257 4.266 1.00 . B B . 46 PRO HD2 1 1 4 2835 2 2 2 PRO HD3 H 10.583 9.702 4.646 1.00 . B B . 46 PRO HD3 1 1 4 2836 2 2 2 PRO HG2 H 9.529 8.759 2.039 1.00 . B B . 46 PRO HG2 1 1 4 2837 2 2 2 PRO HG3 H 10.961 9.735 2.396 1.00 . B B . 46 PRO HG3 1 1 4 2838 2 2 2 PRO N N 8.518 10.044 4.453 1.00 . B B . 46 PRO N 1 1 4 2839 2 2 2 PRO O O 6.369 9.105 3.094 1.00 . B B . 46 PRO O 1 1 4 2840 2 2 3 LEU C C 4.367 11.193 0.059 1.00 . B B . 47 LEU C 1 1 4 2841 2 2 3 LEU CA C 4.869 10.283 1.192 1.00 . B B . 47 LEU CA 1 1 4 2842 2 2 3 LEU CB C 3.849 10.232 2.329 1.00 . B B . 47 LEU CB 1 1 4 2843 2 2 3 LEU CD1 C 2.617 8.235 3.186 1.00 . B B . 47 LEU CD1 1 1 4 2844 2 2 3 LEU CD2 C 1.443 9.904 1.744 1.00 . B B . 47 LEU CD2 1 1 4 2845 2 2 3 LEU CG C 2.773 9.195 2.004 1.00 . B B . 47 LEU CG 1 1 4 2846 2 2 3 LEU H H 6.421 11.743 1.519 1.00 . B B . 47 LEU H 1 1 4 2847 2 2 3 LEU HA H 5.065 9.289 0.828 1.00 . B B . 47 LEU HA 1 1 4 2848 2 2 3 LEU HB2 H 4.350 9.958 3.246 1.00 . B B . 47 LEU HB2 1 1 4 2849 2 2 3 LEU HB3 H 3.391 11.204 2.446 1.00 . B B . 47 LEU HB3 1 1 4 2850 2 2 3 LEU HD11 H 3.044 8.683 4.073 1.00 . B B . 47 LEU HD11 1 1 4 2851 2 2 3 LEU HD12 H 3.130 7.310 2.969 1.00 . B B . 47 LEU HD12 1 1 4 2852 2 2 3 LEU HD13 H 1.570 8.038 3.353 1.00 . B B . 47 LEU HD13 1 1 4 2853 2 2 3 LEU HD21 H 0.632 9.199 1.847 1.00 . B B . 47 LEU HD21 1 1 4 2854 2 2 3 LEU HD22 H 1.442 10.312 0.744 1.00 . B B . 47 LEU HD22 1 1 4 2855 2 2 3 LEU HD23 H 1.316 10.705 2.459 1.00 . B B . 47 LEU HD23 1 1 4 2856 2 2 3 LEU HG H 3.062 8.638 1.125 1.00 . B B . 47 LEU HG 1 1 4 2857 2 2 3 LEU N N 6.099 10.863 1.804 1.00 . B B . 47 LEU N 1 1 4 2858 2 2 3 LEU O O 4.224 12.384 0.249 1.00 . B B . 47 LEU O 1 1 4 2859 2 2 4 PRO C C 2.161 11.812 -2.034 1.00 . B B . 48 PRO C 1 1 4 2860 2 2 4 PRO CA C 3.625 11.401 -2.246 1.00 . B B . 48 PRO CA 1 1 4 2861 2 2 4 PRO CB C 3.752 10.440 -3.423 1.00 . B B . 48 PRO CB 1 1 4 2862 2 2 4 PRO CD C 4.252 9.182 -1.423 1.00 . B B . 48 PRO CD 1 1 4 2863 2 2 4 PRO CG C 3.690 9.074 -2.816 1.00 . B B . 48 PRO CG 1 1 4 2864 2 2 4 PRO HA H 4.247 12.268 -2.405 1.00 . B B . 48 PRO HA 1 1 4 2865 2 2 4 PRO HB2 H 2.934 10.581 -4.113 1.00 . B B . 48 PRO HB2 1 1 4 2866 2 2 4 PRO HB3 H 4.696 10.585 -3.926 1.00 . B B . 48 PRO HB3 1 1 4 2867 2 2 4 PRO HD2 H 3.679 8.576 -0.736 1.00 . B B . 48 PRO HD2 1 1 4 2868 2 2 4 PRO HD3 H 5.293 8.891 -1.411 1.00 . B B . 48 PRO HD3 1 1 4 2869 2 2 4 PRO HG2 H 2.666 8.737 -2.777 1.00 . B B . 48 PRO HG2 1 1 4 2870 2 2 4 PRO HG3 H 4.282 8.385 -3.399 1.00 . B B . 48 PRO HG3 1 1 4 2871 2 2 4 PRO N N 4.112 10.608 -1.089 1.00 . B B . 48 PRO N 1 1 4 2872 2 2 4 PRO O O 1.412 11.106 -1.388 1.00 . B B . 48 PRO O 1 1 4 2873 2 2 5 PRO C C -0.546 12.602 -3.308 1.00 . B B . 49 PRO C 1 1 4 2874 2 2 5 PRO CA C 0.407 13.439 -2.449 1.00 . B B . 49 PRO CA 1 1 4 2875 2 2 5 PRO CB C 0.481 14.875 -2.963 1.00 . B B . 49 PRO CB 1 1 4 2876 2 2 5 PRO CD C 2.632 13.861 -3.380 1.00 . B B . 49 PRO CD 1 1 4 2877 2 2 5 PRO CG C 1.659 14.894 -3.884 1.00 . B B . 49 PRO CG 1 1 4 2878 2 2 5 PRO HA H 0.097 13.431 -1.416 1.00 . B B . 49 PRO HA 1 1 4 2879 2 2 5 PRO HB2 H -0.421 15.129 -3.499 1.00 . B B . 49 PRO HB2 1 1 4 2880 2 2 5 PRO HB3 H 0.635 15.559 -2.141 1.00 . B B . 49 PRO HB3 1 1 4 2881 2 2 5 PRO HD2 H 3.089 13.336 -4.207 1.00 . B B . 49 PRO HD2 1 1 4 2882 2 2 5 PRO HD3 H 3.387 14.322 -2.759 1.00 . B B . 49 PRO HD3 1 1 4 2883 2 2 5 PRO HG2 H 1.346 14.648 -4.888 1.00 . B B . 49 PRO HG2 1 1 4 2884 2 2 5 PRO HG3 H 2.121 15.871 -3.872 1.00 . B B . 49 PRO HG3 1 1 4 2885 2 2 5 PRO N N 1.798 12.945 -2.587 1.00 . B B . 49 PRO N 1 1 4 2886 2 2 5 PRO O O -0.215 11.514 -3.737 1.00 . B B . 49 PRO O 1 1 4 2887 2 2 6 TYR C C -3.536 13.291 -5.244 1.00 . B B . 50 TYR C 1 1 4 2888 2 2 6 TYR CA C -2.694 12.334 -4.397 1.00 . B B . 50 TYR CA 1 1 4 2889 2 2 6 TYR CB C -3.574 11.588 -3.394 1.00 . B B . 50 TYR CB 1 1 4 2890 2 2 6 TYR CD1 C -4.809 10.413 -5.250 1.00 . B B . 50 TYR CD1 1 1 4 2891 2 2 6 TYR CD2 C -3.936 9.094 -3.412 1.00 . B B . 50 TYR CD2 1 1 4 2892 2 2 6 TYR CE1 C -5.317 9.250 -5.843 1.00 . B B . 50 TYR CE1 1 1 4 2893 2 2 6 TYR CE2 C -4.442 7.932 -4.005 1.00 . B B . 50 TYR CE2 1 1 4 2894 2 2 6 TYR CG C -4.119 10.335 -4.034 1.00 . B B . 50 TYR CG 1 1 4 2895 2 2 6 TYR CZ C -5.133 8.010 -5.221 1.00 . B B . 50 TYR CZ 1 1 4 2896 2 2 6 TYR H H -1.970 13.982 -3.211 1.00 . B B . 50 TYR H 1 1 4 2897 2 2 6 TYR HA H -2.175 11.630 -5.028 1.00 . B B . 50 TYR HA 1 1 4 2898 2 2 6 TYR HB2 H -2.985 11.324 -2.526 1.00 . B B . 50 TYR HB2 1 1 4 2899 2 2 6 TYR HB3 H -4.393 12.224 -3.093 1.00 . B B . 50 TYR HB3 1 1 4 2900 2 2 6 TYR HD1 H -4.952 11.369 -5.730 1.00 . B B . 50 TYR HD1 1 1 4 2901 2 2 6 TYR HD2 H -3.402 9.034 -2.475 1.00 . B B . 50 TYR HD2 1 1 4 2902 2 2 6 TYR HE1 H -5.849 9.309 -6.781 1.00 . B B . 50 TYR HE1 1 1 4 2903 2 2 6 TYR HE2 H -4.301 6.974 -3.525 1.00 . B B . 50 TYR HE2 1 1 4 2904 2 2 6 TYR HH H -6.538 7.037 -6.070 1.00 . B B . 50 TYR HH 1 1 4 2905 2 2 6 TYR N N -1.722 13.102 -3.565 1.00 . B B . 50 TYR N 1 1 4 2906 2 2 6 TYR O O -3.102 13.629 -6.333 1.00 . B B . 50 TYR O 1 1 4 2907 2 2 6 TYR OXT O -4.603 13.670 -4.789 1.00 . B B . 50 TYR OXT 1 1 4 2908 2 2 6 TYR OH O -5.633 6.864 -5.805 1.00 . B B . 50 TYR OH 1 1 5 2909 1 1 1 PHE C C -0.227 -17.875 13.998 1.00 . A A . 5 PHE C 1 1 5 2910 1 1 1 PHE CA C -0.291 -18.861 15.167 1.00 . A A . 5 PHE CA 1 1 5 2911 1 1 1 PHE CB C -0.554 -18.122 16.479 1.00 . A A . 5 PHE CB 1 1 5 2912 1 1 1 PHE CD1 C -3.056 -18.100 16.168 1.00 . A A . 5 PHE CD1 1 1 5 2913 1 1 1 PHE CD2 C -1.905 -15.995 16.526 1.00 . A A . 5 PHE CD2 1 1 5 2914 1 1 1 PHE CE1 C -4.276 -17.418 16.084 1.00 . A A . 5 PHE CE1 1 1 5 2915 1 1 1 PHE CE2 C -3.126 -15.314 16.441 1.00 . A A . 5 PHE CE2 1 1 5 2916 1 1 1 PHE CG C -1.871 -17.388 16.389 1.00 . A A . 5 PHE CG 1 1 5 2917 1 1 1 PHE CZ C -4.311 -16.026 16.220 1.00 . A A . 5 PHE CZ 1 1 5 2918 1 1 1 PHE HA H -1.062 -19.597 14.998 1.00 . A A . 5 PHE HA 1 1 5 2919 1 1 1 PHE HB2 H -0.593 -18.833 17.291 1.00 . A A . 5 PHE HB2 1 1 5 2920 1 1 1 PHE HB3 H 0.240 -17.414 16.659 1.00 . A A . 5 PHE HB3 1 1 5 2921 1 1 1 PHE HD1 H -3.027 -19.174 16.063 1.00 . A A . 5 PHE HD1 1 1 5 2922 1 1 1 PHE HD2 H -0.991 -15.445 16.695 1.00 . A A . 5 PHE HD2 1 1 5 2923 1 1 1 PHE HE1 H -5.190 -17.968 15.913 1.00 . A A . 5 PHE HE1 1 1 5 2924 1 1 1 PHE HE2 H -3.154 -14.239 16.546 1.00 . A A . 5 PHE HE2 1 1 5 2925 1 1 1 PHE HZ H -5.252 -15.500 16.156 1.00 . A A . 5 PHE HZ 1 1 5 2926 1 1 1 PHE N N 1.032 -19.525 15.355 1.00 . A A . 5 PHE N 1 1 5 2927 1 1 1 PHE O O -1.002 -17.952 13.066 1.00 . A A . 5 PHE O 1 1 5 2928 1 1 2 GLU C C -0.549 -15.281 12.686 1.00 . A A . 6 GLU C 1 1 5 2929 1 1 2 GLU CA C 0.803 -15.957 12.932 1.00 . A A . 6 GLU CA 1 1 5 2930 1 1 2 GLU CB C 1.226 -16.774 11.711 1.00 . A A . 6 GLU CB 1 1 5 2931 1 1 2 GLU CD C 3.136 -18.104 10.806 1.00 . A A . 6 GLU CD 1 1 5 2932 1 1 2 GLU CG C 2.747 -16.926 11.700 1.00 . A A . 6 GLU CG 1 1 5 2933 1 1 2 GLU H H 1.306 -16.902 14.803 1.00 . A A . 6 GLU H 1 1 5 2934 1 1 2 GLU HA H 1.557 -15.221 13.161 1.00 . A A . 6 GLU HA 1 1 5 2935 1 1 2 GLU HB2 H 0.767 -17.751 11.757 1.00 . A A . 6 GLU HB2 1 1 5 2936 1 1 2 GLU HB3 H 0.908 -16.269 10.811 1.00 . A A . 6 GLU HB3 1 1 5 2937 1 1 2 GLU HG2 H 3.197 -16.021 11.318 1.00 . A A . 6 GLU HG2 1 1 5 2938 1 1 2 GLU HG3 H 3.100 -17.105 12.706 1.00 . A A . 6 GLU HG3 1 1 5 2939 1 1 2 GLU N N 0.691 -16.948 14.042 1.00 . A A . 6 GLU N 1 1 5 2940 1 1 2 GLU O O -1.458 -15.386 13.484 1.00 . A A . 6 GLU O 1 1 5 2941 1 1 2 GLU OE1 O 2.604 -19.182 11.014 1.00 . A A . 6 GLU OE1 1 1 5 2942 1 1 2 GLU OE2 O 3.961 -17.909 9.928 1.00 . A A . 6 GLU OE2 1 1 5 2943 1 1 3 ILE C C -2.978 -14.909 10.693 1.00 . A A . 7 ILE C 1 1 5 2944 1 1 3 ILE CA C -1.979 -13.910 11.293 1.00 . A A . 7 ILE CA 1 1 5 2945 1 1 3 ILE CB C -1.630 -12.823 10.275 1.00 . A A . 7 ILE CB 1 1 5 2946 1 1 3 ILE CD1 C 0.480 -11.548 9.870 1.00 . A A . 7 ILE CD1 1 1 5 2947 1 1 3 ILE CG1 C -0.616 -11.856 10.890 1.00 . A A . 7 ILE CG1 1 1 5 2948 1 1 3 ILE CG2 C -2.897 -12.055 9.892 1.00 . A A . 7 ILE CG2 1 1 5 2949 1 1 3 ILE H H 0.062 -14.518 10.959 1.00 . A A . 7 ILE H 1 1 5 2950 1 1 3 ILE HA H -2.382 -13.461 12.187 1.00 . A A . 7 ILE HA 1 1 5 2951 1 1 3 ILE HB H -1.205 -13.281 9.393 1.00 . A A . 7 ILE HB 1 1 5 2952 1 1 3 ILE HD11 H 0.028 -11.260 8.932 1.00 . A A . 7 ILE HD11 1 1 5 2953 1 1 3 ILE HD12 H 1.090 -12.428 9.719 1.00 . A A . 7 ILE HD12 1 1 5 2954 1 1 3 ILE HD13 H 1.097 -10.741 10.236 1.00 . A A . 7 ILE HD13 1 1 5 2955 1 1 3 ILE HG12 H -1.117 -10.940 11.170 1.00 . A A . 7 ILE HG12 1 1 5 2956 1 1 3 ILE HG13 H -0.177 -12.307 11.767 1.00 . A A . 7 ILE HG13 1 1 5 2957 1 1 3 ILE HG21 H -3.213 -11.442 10.723 1.00 . A A . 7 ILE HG21 1 1 5 2958 1 1 3 ILE HG22 H -3.682 -12.757 9.645 1.00 . A A . 7 ILE HG22 1 1 5 2959 1 1 3 ILE HG23 H -2.692 -11.429 9.037 1.00 . A A . 7 ILE HG23 1 1 5 2960 1 1 3 ILE N N -0.685 -14.590 11.588 1.00 . A A . 7 ILE N 1 1 5 2961 1 1 3 ILE O O -2.595 -15.788 9.948 1.00 . A A . 7 ILE O 1 1 5 2962 1 1 4 PRO C C -5.538 -15.389 9.026 1.00 . A A . 8 PRO C 1 1 5 2963 1 1 4 PRO CA C -5.283 -15.653 10.519 1.00 . A A . 8 PRO CA 1 1 5 2964 1 1 4 PRO CB C -6.506 -15.316 11.368 1.00 . A A . 8 PRO CB 1 1 5 2965 1 1 4 PRO CD C -4.788 -13.713 11.930 1.00 . A A . 8 PRO CD 1 1 5 2966 1 1 4 PRO CG C -6.278 -13.915 11.845 1.00 . A A . 8 PRO CG 1 1 5 2967 1 1 4 PRO HA H -5.001 -16.682 10.675 1.00 . A A . 8 PRO HA 1 1 5 2968 1 1 4 PRO HB2 H -7.404 -15.365 10.769 1.00 . A A . 8 PRO HB2 1 1 5 2969 1 1 4 PRO HB3 H -6.577 -15.991 12.208 1.00 . A A . 8 PRO HB3 1 1 5 2970 1 1 4 PRO HD2 H -4.521 -12.726 11.581 1.00 . A A . 8 PRO HD2 1 1 5 2971 1 1 4 PRO HD3 H -4.442 -13.862 12.943 1.00 . A A . 8 PRO HD3 1 1 5 2972 1 1 4 PRO HG2 H -6.707 -13.211 11.149 1.00 . A A . 8 PRO HG2 1 1 5 2973 1 1 4 PRO HG3 H -6.722 -13.783 12.821 1.00 . A A . 8 PRO HG3 1 1 5 2974 1 1 4 PRO N N -4.233 -14.744 11.038 1.00 . A A . 8 PRO N 1 1 5 2975 1 1 4 PRO O O -4.944 -16.014 8.172 1.00 . A A . 8 PRO O 1 1 5 2976 1 1 5 ASP C C -5.427 -13.647 6.583 1.00 . A A . 9 ASP C 1 1 5 2977 1 1 5 ASP CA C -6.688 -14.185 7.265 1.00 . A A . 9 ASP CA 1 1 5 2978 1 1 5 ASP CB C -7.787 -13.123 7.277 1.00 . A A . 9 ASP CB 1 1 5 2979 1 1 5 ASP CG C -8.928 -13.560 6.356 1.00 . A A . 9 ASP CG 1 1 5 2980 1 1 5 ASP H H -6.885 -13.974 9.398 1.00 . A A . 9 ASP H 1 1 5 2981 1 1 5 ASP HA H -7.037 -15.074 6.765 1.00 . A A . 9 ASP HA 1 1 5 2982 1 1 5 ASP HB2 H -8.162 -13.005 8.283 1.00 . A A . 9 ASP HB2 1 1 5 2983 1 1 5 ASP HB3 H -7.383 -12.184 6.930 1.00 . A A . 9 ASP HB3 1 1 5 2984 1 1 5 ASP N N -6.412 -14.473 8.703 1.00 . A A . 9 ASP N 1 1 5 2985 1 1 5 ASP O O -5.043 -14.098 5.523 1.00 . A A . 9 ASP O 1 1 5 2986 1 1 5 ASP OD1 O -9.447 -14.644 6.562 1.00 . A A . 9 ASP OD1 1 1 5 2987 1 1 5 ASP OD2 O -9.262 -12.802 5.461 1.00 . A A . 9 ASP OD2 1 1 5 2988 1 1 6 ASP C C -3.819 -11.695 5.124 1.00 . A A . 10 ASP C 1 1 5 2989 1 1 6 ASP CA C -3.545 -12.118 6.570 1.00 . A A . 10 ASP CA 1 1 5 2990 1 1 6 ASP CB C -2.527 -13.256 6.614 1.00 . A A . 10 ASP CB 1 1 5 2991 1 1 6 ASP CG C -1.233 -12.811 5.927 1.00 . A A . 10 ASP CG 1 1 5 2992 1 1 6 ASP H H -5.107 -12.336 8.039 1.00 . A A . 10 ASP H 1 1 5 2993 1 1 6 ASP HA H -3.189 -11.280 7.147 1.00 . A A . 10 ASP HA 1 1 5 2994 1 1 6 ASP HB2 H -2.318 -13.511 7.642 1.00 . A A . 10 ASP HB2 1 1 5 2995 1 1 6 ASP HB3 H -2.929 -14.118 6.104 1.00 . A A . 10 ASP HB3 1 1 5 2996 1 1 6 ASP N N -4.781 -12.685 7.184 1.00 . A A . 10 ASP N 1 1 5 2997 1 1 6 ASP O O -3.163 -12.138 4.202 1.00 . A A . 10 ASP O 1 1 5 2998 1 1 6 ASP OD1 O -0.838 -11.675 6.130 1.00 . A A . 10 ASP OD1 1 1 5 2999 1 1 6 ASP OD2 O -0.662 -13.614 5.209 1.00 . A A . 10 ASP OD2 1 1 5 3000 1 1 7 VAL C C -4.288 -9.131 3.188 1.00 . A A . 11 VAL C 1 1 5 3001 1 1 7 VAL CA C -5.099 -10.388 3.533 1.00 . A A . 11 VAL CA 1 1 5 3002 1 1 7 VAL CB C -6.596 -10.073 3.553 1.00 . A A . 11 VAL CB 1 1 5 3003 1 1 7 VAL CG1 C -7.049 -9.663 2.150 1.00 . A A . 11 VAL CG1 1 1 5 3004 1 1 7 VAL CG2 C -7.370 -11.314 3.998 1.00 . A A . 11 VAL CG2 1 1 5 3005 1 1 7 VAL H H -5.300 -10.493 5.676 1.00 . A A . 11 VAL H 1 1 5 3006 1 1 7 VAL HA H -4.896 -11.176 2.825 1.00 . A A . 11 VAL HA 1 1 5 3007 1 1 7 VAL HB H -6.784 -9.264 4.243 1.00 . A A . 11 VAL HB 1 1 5 3008 1 1 7 VAL HG11 H -8.011 -9.175 2.212 1.00 . A A . 11 VAL HG11 1 1 5 3009 1 1 7 VAL HG12 H -7.131 -10.542 1.527 1.00 . A A . 11 VAL HG12 1 1 5 3010 1 1 7 VAL HG13 H -6.327 -8.984 1.722 1.00 . A A . 11 VAL HG13 1 1 5 3011 1 1 7 VAL HG21 H -7.291 -12.080 3.241 1.00 . A A . 11 VAL HG21 1 1 5 3012 1 1 7 VAL HG22 H -8.409 -11.058 4.142 1.00 . A A . 11 VAL HG22 1 1 5 3013 1 1 7 VAL HG23 H -6.960 -11.682 4.927 1.00 . A A . 11 VAL HG23 1 1 5 3014 1 1 7 VAL N N -4.783 -10.839 4.919 1.00 . A A . 11 VAL N 1 1 5 3015 1 1 7 VAL O O -4.068 -8.289 4.037 1.00 . A A . 11 VAL O 1 1 5 3016 1 1 8 PRO C C -3.975 -6.624 1.428 1.00 . A A . 12 PRO C 1 1 5 3017 1 1 8 PRO CA C -3.078 -7.865 1.503 1.00 . A A . 12 PRO CA 1 1 5 3018 1 1 8 PRO CB C -2.582 -8.272 0.118 1.00 . A A . 12 PRO CB 1 1 5 3019 1 1 8 PRO CD C -4.086 -10.000 0.856 1.00 . A A . 12 PRO CD 1 1 5 3020 1 1 8 PRO CG C -3.573 -9.278 -0.362 1.00 . A A . 12 PRO CG 1 1 5 3021 1 1 8 PRO HA H -2.242 -7.695 2.163 1.00 . A A . 12 PRO HA 1 1 5 3022 1 1 8 PRO HB2 H -2.564 -7.424 -0.548 1.00 . A A . 12 PRO HB2 1 1 5 3023 1 1 8 PRO HB3 H -1.600 -8.717 0.186 1.00 . A A . 12 PRO HB3 1 1 5 3024 1 1 8 PRO HD2 H -5.137 -10.225 0.750 1.00 . A A . 12 PRO HD2 1 1 5 3025 1 1 8 PRO HD3 H -3.519 -10.904 1.028 1.00 . A A . 12 PRO HD3 1 1 5 3026 1 1 8 PRO HG2 H -4.389 -8.778 -0.863 1.00 . A A . 12 PRO HG2 1 1 5 3027 1 1 8 PRO HG3 H -3.098 -9.975 -1.033 1.00 . A A . 12 PRO HG3 1 1 5 3028 1 1 8 PRO N N -3.869 -9.039 1.948 1.00 . A A . 12 PRO N 1 1 5 3029 1 1 8 PRO O O -5.019 -6.566 2.045 1.00 . A A . 12 PRO O 1 1 5 3030 1 1 9 LEU C C -5.852 -4.772 0.171 1.00 . A A . 13 LEU C 1 1 5 3031 1 1 9 LEU CA C -4.412 -4.401 0.568 1.00 . A A . 13 LEU CA 1 1 5 3032 1 1 9 LEU CB C -3.746 -3.571 -0.530 1.00 . A A . 13 LEU CB 1 1 5 3033 1 1 9 LEU CD1 C -1.364 -4.088 -1.092 1.00 . A A . 13 LEU CD1 1 1 5 3034 1 1 9 LEU CD2 C -1.988 -1.810 -0.278 1.00 . A A . 13 LEU CD2 1 1 5 3035 1 1 9 LEU CG C -2.286 -3.306 -0.153 1.00 . A A . 13 LEU CG 1 1 5 3036 1 1 9 LEU H H -2.735 -5.697 0.187 1.00 . A A . 13 LEU H 1 1 5 3037 1 1 9 LEU HA H -4.402 -3.858 1.499 1.00 . A A . 13 LEU HA 1 1 5 3038 1 1 9 LEU HB2 H -3.785 -4.112 -1.464 1.00 . A A . 13 LEU HB2 1 1 5 3039 1 1 9 LEU HB3 H -4.267 -2.631 -0.637 1.00 . A A . 13 LEU HB3 1 1 5 3040 1 1 9 LEU HD11 H -0.998 -3.431 -1.866 1.00 . A A . 13 LEU HD11 1 1 5 3041 1 1 9 LEU HD12 H -1.914 -4.901 -1.541 1.00 . A A . 13 LEU HD12 1 1 5 3042 1 1 9 LEU HD13 H -0.530 -4.484 -0.531 1.00 . A A . 13 LEU HD13 1 1 5 3043 1 1 9 LEU HD21 H -2.615 -1.260 0.409 1.00 . A A . 13 LEU HD21 1 1 5 3044 1 1 9 LEU HD22 H -2.190 -1.486 -1.287 1.00 . A A . 13 LEU HD22 1 1 5 3045 1 1 9 LEU HD23 H -0.951 -1.630 -0.041 1.00 . A A . 13 LEU HD23 1 1 5 3046 1 1 9 LEU HG H -2.114 -3.624 0.865 1.00 . A A . 13 LEU HG 1 1 5 3047 1 1 9 LEU N N -3.579 -5.634 0.677 1.00 . A A . 13 LEU N 1 1 5 3048 1 1 9 LEU O O -6.054 -5.618 -0.676 1.00 . A A . 13 LEU O 1 1 5 3049 1 1 10 PRO C C -8.622 -3.839 -0.870 1.00 . A A . 14 PRO C 1 1 5 3050 1 1 10 PRO CA C -8.234 -4.416 0.496 1.00 . A A . 14 PRO CA 1 1 5 3051 1 1 10 PRO CB C -8.990 -3.711 1.618 1.00 . A A . 14 PRO CB 1 1 5 3052 1 1 10 PRO CD C -6.665 -3.095 1.835 1.00 . A A . 14 PRO CD 1 1 5 3053 1 1 10 PRO CG C -8.075 -2.623 2.081 1.00 . A A . 14 PRO CG 1 1 5 3054 1 1 10 PRO HA H -8.426 -5.476 0.531 1.00 . A A . 14 PRO HA 1 1 5 3055 1 1 10 PRO HB2 H -9.912 -3.292 1.245 1.00 . A A . 14 PRO HB2 1 1 5 3056 1 1 10 PRO HB3 H -9.190 -4.401 2.426 1.00 . A A . 14 PRO HB3 1 1 5 3057 1 1 10 PRO HD2 H -6.052 -2.282 1.475 1.00 . A A . 14 PRO HD2 1 1 5 3058 1 1 10 PRO HD3 H -6.245 -3.517 2.736 1.00 . A A . 14 PRO HD3 1 1 5 3059 1 1 10 PRO HG2 H -8.265 -1.721 1.521 1.00 . A A . 14 PRO HG2 1 1 5 3060 1 1 10 PRO HG3 H -8.223 -2.440 3.135 1.00 . A A . 14 PRO HG3 1 1 5 3061 1 1 10 PRO N N -6.809 -4.129 0.800 1.00 . A A . 14 PRO N 1 1 5 3062 1 1 10 PRO O O -7.776 -3.520 -1.682 1.00 . A A . 14 PRO O 1 1 5 3063 1 1 11 ALA C C -10.096 -1.639 -2.489 1.00 . A A . 15 ALA C 1 1 5 3064 1 1 11 ALA CA C -10.336 -3.150 -2.440 1.00 . A A . 15 ALA CA 1 1 5 3065 1 1 11 ALA CB C -11.832 -3.457 -2.517 1.00 . A A . 15 ALA CB 1 1 5 3066 1 1 11 ALA H H -10.561 -3.969 -0.459 1.00 . A A . 15 ALA H 1 1 5 3067 1 1 11 ALA HA H -9.819 -3.641 -3.249 1.00 . A A . 15 ALA HA 1 1 5 3068 1 1 11 ALA HB1 H -12.315 -2.740 -3.161 1.00 . A A . 15 ALA HB1 1 1 5 3069 1 1 11 ALA HB2 H -12.262 -3.399 -1.527 1.00 . A A . 15 ALA HB2 1 1 5 3070 1 1 11 ALA HB3 H -11.975 -4.452 -2.913 1.00 . A A . 15 ALA HB3 1 1 5 3071 1 1 11 ALA N N -9.893 -3.703 -1.128 1.00 . A A . 15 ALA N 1 1 5 3072 1 1 11 ALA O O -9.741 -1.023 -1.504 1.00 . A A . 15 ALA O 1 1 5 3073 1 1 12 GLY C C -8.591 0.765 -3.506 1.00 . A A . 16 GLY C 1 1 5 3074 1 1 12 GLY CA C -10.068 0.434 -3.749 1.00 . A A . 16 GLY CA 1 1 5 3075 1 1 12 GLY H H -10.572 -1.552 -4.415 1.00 . A A . 16 GLY H 1 1 5 3076 1 1 12 GLY HA2 H -10.351 0.761 -4.739 1.00 . A A . 16 GLY HA2 1 1 5 3077 1 1 12 GLY HA3 H -10.675 0.945 -3.016 1.00 . A A . 16 GLY HA3 1 1 5 3078 1 1 12 GLY N N -10.287 -1.036 -3.633 1.00 . A A . 16 GLY N 1 1 5 3079 1 1 12 GLY O O -8.229 1.907 -3.302 1.00 . A A . 16 GLY O 1 1 5 3080 1 1 13 TRP C C -5.475 -0.216 -4.556 1.00 . A A . 17 TRP C 1 1 5 3081 1 1 13 TRP CA C -6.285 0.047 -3.285 1.00 . A A . 17 TRP CA 1 1 5 3082 1 1 13 TRP CB C -5.886 -0.939 -2.192 1.00 . A A . 17 TRP CB 1 1 5 3083 1 1 13 TRP CD1 C -7.046 -0.308 -0.044 1.00 . A A . 17 TRP CD1 1 1 5 3084 1 1 13 TRP CD2 C -4.986 0.569 -0.213 1.00 . A A . 17 TRP CD2 1 1 5 3085 1 1 13 TRP CE2 C -5.507 1.002 1.029 1.00 . A A . 17 TRP CE2 1 1 5 3086 1 1 13 TRP CE3 C -3.694 0.983 -0.572 1.00 . A A . 17 TRP CE3 1 1 5 3087 1 1 13 TRP CG C -5.978 -0.261 -0.869 1.00 . A A . 17 TRP CG 1 1 5 3088 1 1 13 TRP CH2 C -3.482 2.221 1.508 1.00 . A A . 17 TRP CH2 1 1 5 3089 1 1 13 TRP CZ2 C -4.768 1.818 1.885 1.00 . A A . 17 TRP CZ2 1 1 5 3090 1 1 13 TRP CZ3 C -2.949 1.803 0.284 1.00 . A A . 17 TRP CZ3 1 1 5 3091 1 1 13 TRP H H -8.036 -1.138 -3.680 1.00 . A A . 17 TRP H 1 1 5 3092 1 1 13 TRP HA H -6.136 1.058 -2.941 1.00 . A A . 17 TRP HA 1 1 5 3093 1 1 13 TRP HB2 H -6.553 -1.789 -2.210 1.00 . A A . 17 TRP HB2 1 1 5 3094 1 1 13 TRP HB3 H -4.873 -1.271 -2.357 1.00 . A A . 17 TRP HB3 1 1 5 3095 1 1 13 TRP HD1 H -7.966 -0.843 -0.236 1.00 . A A . 17 TRP HD1 1 1 5 3096 1 1 13 TRP HE1 H -7.377 0.569 1.844 1.00 . A A . 17 TRP HE1 1 1 5 3097 1 1 13 TRP HE3 H -3.273 0.667 -1.515 1.00 . A A . 17 TRP HE3 1 1 5 3098 1 1 13 TRP HH2 H -2.900 2.852 2.160 1.00 . A A . 17 TRP HH2 1 1 5 3099 1 1 13 TRP HZ2 H -5.184 2.138 2.828 1.00 . A A . 17 TRP HZ2 1 1 5 3100 1 1 13 TRP HZ3 H -1.961 2.117 -0.003 1.00 . A A . 17 TRP HZ3 1 1 5 3101 1 1 13 TRP N N -7.732 -0.222 -3.521 1.00 . A A . 17 TRP N 1 1 5 3102 1 1 13 TRP NE1 N -6.769 0.440 1.086 1.00 . A A . 17 TRP NE1 1 1 5 3103 1 1 13 TRP O O -5.797 -1.089 -5.337 1.00 . A A . 17 TRP O 1 1 5 3104 1 1 14 GLU C C -2.112 0.404 -5.697 1.00 . A A . 18 GLU C 1 1 5 3105 1 1 14 GLU CA C -3.607 0.306 -5.999 1.00 . A A . 18 GLU CA 1 1 5 3106 1 1 14 GLU CB C -4.005 1.430 -6.958 1.00 . A A . 18 GLU CB 1 1 5 3107 1 1 14 GLU CD C -6.039 0.306 -7.875 1.00 . A A . 18 GLU CD 1 1 5 3108 1 1 14 GLU CG C -4.642 0.832 -8.212 1.00 . A A . 18 GLU CG 1 1 5 3109 1 1 14 GLU H H -4.176 1.234 -4.135 1.00 . A A . 18 GLU H 1 1 5 3110 1 1 14 GLU HA H -3.841 -0.649 -6.441 1.00 . A A . 18 GLU HA 1 1 5 3111 1 1 14 GLU HB2 H -4.704 2.089 -6.473 1.00 . A A . 18 GLU HB2 1 1 5 3112 1 1 14 GLU HB3 H -3.125 1.990 -7.238 1.00 . A A . 18 GLU HB3 1 1 5 3113 1 1 14 GLU HG2 H -4.718 1.594 -8.974 1.00 . A A . 18 GLU HG2 1 1 5 3114 1 1 14 GLU HG3 H -4.029 0.020 -8.575 1.00 . A A . 18 GLU HG3 1 1 5 3115 1 1 14 GLU N N -4.425 0.529 -4.772 1.00 . A A . 18 GLU N 1 1 5 3116 1 1 14 GLU O O -1.553 1.487 -5.671 1.00 . A A . 18 GLU O 1 1 5 3117 1 1 14 GLU OE1 O -6.620 0.796 -6.920 1.00 . A A . 18 GLU OE1 1 1 5 3118 1 1 14 GLU OE2 O -6.504 -0.576 -8.578 1.00 . A A . 18 GLU OE2 1 1 5 3119 1 1 15 MET C C 0.668 -0.031 -6.494 1.00 . A A . 19 MET C 1 1 5 3120 1 1 15 MET CA C 0.016 -0.619 -5.251 1.00 . A A . 19 MET CA 1 1 5 3121 1 1 15 MET CB C 0.525 -2.038 -5.012 1.00 . A A . 19 MET CB 1 1 5 3122 1 1 15 MET CE C -1.604 -4.169 -4.450 1.00 . A A . 19 MET CE 1 1 5 3123 1 1 15 MET CG C 0.121 -2.955 -6.174 1.00 . A A . 19 MET CG 1 1 5 3124 1 1 15 MET H H -1.887 -1.573 -5.540 1.00 . A A . 19 MET H 1 1 5 3125 1 1 15 MET HA H 0.217 -0.002 -4.392 1.00 . A A . 19 MET HA 1 1 5 3126 1 1 15 MET HB2 H 1.594 -2.002 -4.954 1.00 . A A . 19 MET HB2 1 1 5 3127 1 1 15 MET HB3 H 0.132 -2.420 -4.083 1.00 . A A . 19 MET HB3 1 1 5 3128 1 1 15 MET HE1 H -1.663 -3.094 -4.365 1.00 . A A . 19 MET HE1 1 1 5 3129 1 1 15 MET HE2 H -1.443 -4.596 -3.474 1.00 . A A . 19 MET HE2 1 1 5 3130 1 1 15 MET HE3 H -2.528 -4.554 -4.862 1.00 . A A . 19 MET HE3 1 1 5 3131 1 1 15 MET HG2 H -0.756 -2.563 -6.663 1.00 . A A . 19 MET HG2 1 1 5 3132 1 1 15 MET HG3 H 0.931 -3.009 -6.885 1.00 . A A . 19 MET HG3 1 1 5 3133 1 1 15 MET N N -1.443 -0.706 -5.500 1.00 . A A . 19 MET N 1 1 5 3134 1 1 15 MET O O 0.575 -0.574 -7.577 1.00 . A A . 19 MET O 1 1 5 3135 1 1 15 MET SD S -0.230 -4.616 -5.539 1.00 . A A . 19 MET SD 1 1 5 3136 1 1 16 ALA C C 3.360 2.171 -7.131 1.00 . A A . 20 ALA C 1 1 5 3137 1 1 16 ALA CA C 1.956 1.720 -7.520 1.00 . A A . 20 ALA CA 1 1 5 3138 1 1 16 ALA CB C 1.054 2.911 -7.851 1.00 . A A . 20 ALA CB 1 1 5 3139 1 1 16 ALA H H 1.364 1.495 -5.464 1.00 . A A . 20 ALA H 1 1 5 3140 1 1 16 ALA HA H 1.993 1.037 -8.353 1.00 . A A . 20 ALA HA 1 1 5 3141 1 1 16 ALA HB1 H 0.643 3.318 -6.937 1.00 . A A . 20 ALA HB1 1 1 5 3142 1 1 16 ALA HB2 H 0.245 2.583 -8.490 1.00 . A A . 20 ALA HB2 1 1 5 3143 1 1 16 ALA HB3 H 1.626 3.670 -8.358 1.00 . A A . 20 ALA HB3 1 1 5 3144 1 1 16 ALA N N 1.310 1.077 -6.348 1.00 . A A . 20 ALA N 1 1 5 3145 1 1 16 ALA O O 3.882 1.764 -6.113 1.00 . A A . 20 ALA O 1 1 5 3146 1 1 17 LYS C C 5.447 4.961 -7.483 1.00 . A A . 21 LYS C 1 1 5 3147 1 1 17 LYS CA C 5.356 3.441 -7.556 1.00 . A A . 21 LYS CA 1 1 5 3148 1 1 17 LYS CB C 6.268 2.888 -8.652 1.00 . A A . 21 LYS CB 1 1 5 3149 1 1 17 LYS CD C 8.087 1.197 -8.914 1.00 . A A . 21 LYS CD 1 1 5 3150 1 1 17 LYS CE C 8.281 -0.077 -8.089 1.00 . A A . 21 LYS CE 1 1 5 3151 1 1 17 LYS CG C 7.532 2.305 -8.018 1.00 . A A . 21 LYS CG 1 1 5 3152 1 1 17 LYS H H 3.559 3.320 -8.743 1.00 . A A . 21 LYS H 1 1 5 3153 1 1 17 LYS HA H 5.624 3.020 -6.605 1.00 . A A . 21 LYS HA 1 1 5 3154 1 1 17 LYS HB2 H 5.748 2.114 -9.197 1.00 . A A . 21 LYS HB2 1 1 5 3155 1 1 17 LYS HB3 H 6.539 3.685 -9.327 1.00 . A A . 21 LYS HB3 1 1 5 3156 1 1 17 LYS HD2 H 7.392 1.004 -9.719 1.00 . A A . 21 LYS HD2 1 1 5 3157 1 1 17 LYS HD3 H 9.036 1.509 -9.324 1.00 . A A . 21 LYS HD3 1 1 5 3158 1 1 17 LYS HE2 H 8.572 0.170 -7.079 1.00 . A A . 21 LYS HE2 1 1 5 3159 1 1 17 LYS HE3 H 7.375 -0.665 -8.088 1.00 . A A . 21 LYS HE3 1 1 5 3160 1 1 17 LYS HG2 H 8.272 3.083 -7.906 1.00 . A A . 21 LYS HG2 1 1 5 3161 1 1 17 LYS HG3 H 7.291 1.896 -7.047 1.00 . A A . 21 LYS HG3 1 1 5 3162 1 1 17 LYS HZ1 H 10.282 -0.334 -8.604 1.00 . A A . 21 LYS HZ1 1 1 5 3163 1 1 17 LYS HZ2 H 9.188 -0.837 -9.802 1.00 . A A . 21 LYS HZ2 1 1 5 3164 1 1 17 LYS HZ3 H 9.426 -1.786 -8.413 1.00 . A A . 21 LYS HZ3 1 1 5 3165 1 1 17 LYS N N 3.985 2.997 -7.921 1.00 . A A . 21 LYS N 1 1 5 3166 1 1 17 LYS NZ N 9.378 -0.814 -8.780 1.00 . A A . 21 LYS NZ 1 1 5 3167 1 1 17 LYS O O 4.855 5.675 -8.268 1.00 . A A . 21 LYS O 1 1 5 3168 1 1 18 THR C C 7.788 7.296 -6.105 1.00 . A A . 22 THR C 1 1 5 3169 1 1 18 THR CA C 6.331 6.929 -6.384 1.00 . A A . 22 THR CA 1 1 5 3170 1 1 18 THR CB C 5.455 7.293 -5.184 1.00 . A A . 22 THR CB 1 1 5 3171 1 1 18 THR CG2 C 5.992 6.605 -3.922 1.00 . A A . 22 THR CG2 1 1 5 3172 1 1 18 THR H H 6.656 4.851 -5.909 1.00 . A A . 22 THR H 1 1 5 3173 1 1 18 THR HA H 5.976 7.434 -7.267 1.00 . A A . 22 THR HA 1 1 5 3174 1 1 18 THR HB H 4.444 6.972 -5.366 1.00 . A A . 22 THR HB 1 1 5 3175 1 1 18 THR HG1 H 4.953 9.100 -5.700 1.00 . A A . 22 THR HG1 1 1 5 3176 1 1 18 THR HG21 H 6.261 5.582 -4.151 1.00 . A A . 22 THR HG21 1 1 5 3177 1 1 18 THR HG22 H 5.234 6.612 -3.152 1.00 . A A . 22 THR HG22 1 1 5 3178 1 1 18 THR HG23 H 6.864 7.136 -3.574 1.00 . A A . 22 THR HG23 1 1 5 3179 1 1 18 THR N N 6.191 5.455 -6.532 1.00 . A A . 22 THR N 1 1 5 3180 1 1 18 THR O O 8.695 6.531 -6.363 1.00 . A A . 22 THR O 1 1 5 3181 1 1 18 THR OG1 O 5.480 8.703 -5.004 1.00 . A A . 22 THR OG1 1 1 5 3182 1 1 19 SER C C 10.348 8.619 -6.422 1.00 . A A . 23 SER C 1 1 5 3183 1 1 19 SER CA C 9.403 8.907 -5.247 1.00 . A A . 23 SER CA 1 1 5 3184 1 1 19 SER CB C 9.803 8.085 -4.023 1.00 . A A . 23 SER CB 1 1 5 3185 1 1 19 SER H H 7.250 9.052 -5.361 1.00 . A A . 23 SER H 1 1 5 3186 1 1 19 SER HA H 9.417 9.958 -5.005 1.00 . A A . 23 SER HA 1 1 5 3187 1 1 19 SER HB2 H 8.914 7.754 -3.505 1.00 . A A . 23 SER HB2 1 1 5 3188 1 1 19 SER HB3 H 10.380 7.228 -4.338 1.00 . A A . 23 SER HB3 1 1 5 3189 1 1 19 SER HG H 11.358 8.379 -2.894 1.00 . A A . 23 SER HG 1 1 5 3190 1 1 19 SER N N 8.009 8.465 -5.565 1.00 . A A . 23 SER N 1 1 5 3191 1 1 19 SER O O 9.946 8.624 -7.569 1.00 . A A . 23 SER O 1 1 5 3192 1 1 19 SER OG O 10.586 8.887 -3.150 1.00 . A A . 23 SER OG 1 1 5 3193 1 1 20 SER C C 12.659 6.559 -7.481 1.00 . A A . 24 SER C 1 1 5 3194 1 1 20 SER CA C 12.561 8.070 -7.243 1.00 . A A . 24 SER CA 1 1 5 3195 1 1 20 SER CB C 13.900 8.624 -6.754 1.00 . A A . 24 SER CB 1 1 5 3196 1 1 20 SER H H 11.902 8.362 -5.212 1.00 . A A . 24 SER H 1 1 5 3197 1 1 20 SER HA H 12.263 8.574 -8.146 1.00 . A A . 24 SER HA 1 1 5 3198 1 1 20 SER HB2 H 13.725 9.368 -5.991 1.00 . A A . 24 SER HB2 1 1 5 3199 1 1 20 SER HB3 H 14.494 7.822 -6.343 1.00 . A A . 24 SER HB3 1 1 5 3200 1 1 20 SER HG H 15.478 8.847 -7.867 1.00 . A A . 24 SER HG 1 1 5 3201 1 1 20 SER N N 11.598 8.364 -6.144 1.00 . A A . 24 SER N 1 1 5 3202 1 1 20 SER O O 13.167 6.113 -8.489 1.00 . A A . 24 SER O 1 1 5 3203 1 1 20 SER OG O 14.593 9.217 -7.843 1.00 . A A . 24 SER OG 1 1 5 3204 1 1 21 GLY C C 11.691 3.596 -5.491 1.00 . A A . 25 GLY C 1 1 5 3205 1 1 21 GLY CA C 12.244 4.290 -6.740 1.00 . A A . 25 GLY CA 1 1 5 3206 1 1 21 GLY H H 11.770 6.143 -5.753 1.00 . A A . 25 GLY H 1 1 5 3207 1 1 21 GLY HA2 H 11.657 4.004 -7.600 1.00 . A A . 25 GLY HA2 1 1 5 3208 1 1 21 GLY HA3 H 13.271 3.991 -6.891 1.00 . A A . 25 GLY HA3 1 1 5 3209 1 1 21 GLY N N 12.177 5.768 -6.560 1.00 . A A . 25 GLY N 1 1 5 3210 1 1 21 GLY O O 12.420 3.275 -4.574 1.00 . A A . 25 GLY O 1 1 5 3211 1 1 22 GLN C C 8.331 2.379 -4.520 1.00 . A A . 26 GLN C 1 1 5 3212 1 1 22 GLN CA C 9.808 2.690 -4.260 1.00 . A A . 26 GLN CA 1 1 5 3213 1 1 22 GLN CB C 9.949 3.699 -3.119 1.00 . A A . 26 GLN CB 1 1 5 3214 1 1 22 GLN CD C 10.308 1.823 -1.508 1.00 . A A . 26 GLN CD 1 1 5 3215 1 1 22 GLN CG C 10.887 3.131 -2.050 1.00 . A A . 26 GLN CG 1 1 5 3216 1 1 22 GLN H H 9.837 3.630 -6.201 1.00 . A A . 26 GLN H 1 1 5 3217 1 1 22 GLN HA H 10.349 1.787 -4.024 1.00 . A A . 26 GLN HA 1 1 5 3218 1 1 22 GLN HB2 H 10.355 4.623 -3.501 1.00 . A A . 26 GLN HB2 1 1 5 3219 1 1 22 GLN HB3 H 8.979 3.887 -2.682 1.00 . A A . 26 GLN HB3 1 1 5 3220 1 1 22 GLN HE21 H 12.088 1.033 -1.121 1.00 . A A . 26 GLN HE21 1 1 5 3221 1 1 22 GLN HE22 H 10.760 0.049 -0.738 1.00 . A A . 26 GLN HE22 1 1 5 3222 1 1 22 GLN HG2 H 11.856 2.943 -2.486 1.00 . A A . 26 GLN HG2 1 1 5 3223 1 1 22 GLN HG3 H 10.985 3.843 -1.244 1.00 . A A . 26 GLN HG3 1 1 5 3224 1 1 22 GLN N N 10.407 3.363 -5.449 1.00 . A A . 26 GLN N 1 1 5 3225 1 1 22 GLN NE2 N 11.120 0.891 -1.088 1.00 . A A . 26 GLN NE2 1 1 5 3226 1 1 22 GLN O O 7.594 3.203 -5.036 1.00 . A A . 26 GLN O 1 1 5 3227 1 1 22 GLN OE1 O 9.107 1.647 -1.465 1.00 . A A . 26 GLN OE1 1 1 5 3228 1 1 23 ARG C C 5.578 1.452 -3.319 1.00 . A A . 27 ARG C 1 1 5 3229 1 1 23 ARG CA C 6.458 0.851 -4.403 1.00 . A A . 27 ARG CA 1 1 5 3230 1 1 23 ARG CB C 6.360 -0.675 -4.335 1.00 . A A . 27 ARG CB 1 1 5 3231 1 1 23 ARG CD C 4.912 -2.315 -5.536 1.00 . A A . 27 ARG CD 1 1 5 3232 1 1 23 ARG CG C 5.960 -1.214 -5.706 1.00 . A A . 27 ARG CG 1 1 5 3233 1 1 23 ARG CZ C 5.027 -4.731 -5.878 1.00 . A A . 27 ARG CZ 1 1 5 3234 1 1 23 ARG H H 8.493 0.547 -3.756 1.00 . A A . 27 ARG H 1 1 5 3235 1 1 23 ARG HA H 6.142 1.194 -5.375 1.00 . A A . 27 ARG HA 1 1 5 3236 1 1 23 ARG HB2 H 7.305 -1.094 -4.038 1.00 . A A . 27 ARG HB2 1 1 5 3237 1 1 23 ARG HB3 H 5.607 -0.953 -3.612 1.00 . A A . 27 ARG HB3 1 1 5 3238 1 1 23 ARG HD2 H 4.484 -2.277 -4.546 1.00 . A A . 27 ARG HD2 1 1 5 3239 1 1 23 ARG HD3 H 4.138 -2.216 -6.285 1.00 . A A . 27 ARG HD3 1 1 5 3240 1 1 23 ARG HE H 6.642 -3.577 -5.746 1.00 . A A . 27 ARG HE 1 1 5 3241 1 1 23 ARG HG2 H 5.546 -0.408 -6.298 1.00 . A A . 27 ARG HG2 1 1 5 3242 1 1 23 ARG HG3 H 6.828 -1.617 -6.201 1.00 . A A . 27 ARG HG3 1 1 5 3243 1 1 23 ARG HH11 H 3.180 -3.950 -5.733 1.00 . A A . 27 ARG HH11 1 1 5 3244 1 1 23 ARG HH12 H 3.254 -5.660 -5.975 1.00 . A A . 27 ARG HH12 1 1 5 3245 1 1 23 ARG HH21 H 6.710 -5.799 -6.061 1.00 . A A . 27 ARG HH21 1 1 5 3246 1 1 23 ARG HH22 H 5.236 -6.701 -6.160 1.00 . A A . 27 ARG HH22 1 1 5 3247 1 1 23 ARG N N 7.888 1.198 -4.170 1.00 . A A . 27 ARG N 1 1 5 3248 1 1 23 ARG NE N 5.662 -3.590 -5.729 1.00 . A A . 27 ARG NE 1 1 5 3249 1 1 23 ARG NH1 N 3.718 -4.782 -5.860 1.00 . A A . 27 ARG NH1 1 1 5 3250 1 1 23 ARG NH2 N 5.712 -5.829 -6.045 1.00 . A A . 27 ARG NH2 1 1 5 3251 1 1 23 ARG O O 5.715 1.145 -2.152 1.00 . A A . 27 ARG O 1 1 5 3252 1 1 24 TYR C C 2.348 2.258 -2.923 1.00 . A A . 28 TYR C 1 1 5 3253 1 1 24 TYR CA C 3.727 2.842 -2.689 1.00 . A A . 28 TYR CA 1 1 5 3254 1 1 24 TYR CB C 3.762 4.375 -2.865 1.00 . A A . 28 TYR CB 1 1 5 3255 1 1 24 TYR CD1 C 3.336 4.641 -5.329 1.00 . A A . 28 TYR CD1 1 1 5 3256 1 1 24 TYR CD2 C 1.634 5.395 -3.781 1.00 . A A . 28 TYR CD2 1 1 5 3257 1 1 24 TYR CE1 C 2.535 5.043 -6.405 1.00 . A A . 28 TYR CE1 1 1 5 3258 1 1 24 TYR CE2 C 0.836 5.798 -4.859 1.00 . A A . 28 TYR CE2 1 1 5 3259 1 1 24 TYR CG C 2.888 4.815 -4.021 1.00 . A A . 28 TYR CG 1 1 5 3260 1 1 24 TYR CZ C 1.290 5.620 -6.170 1.00 . A A . 28 TYR CZ 1 1 5 3261 1 1 24 TYR H H 4.529 2.474 -4.651 1.00 . A A . 28 TYR H 1 1 5 3262 1 1 24 TYR HA H 4.061 2.575 -1.699 1.00 . A A . 28 TYR HA 1 1 5 3263 1 1 24 TYR HB2 H 3.411 4.843 -1.958 1.00 . A A . 28 TYR HB2 1 1 5 3264 1 1 24 TYR HB3 H 4.778 4.685 -3.053 1.00 . A A . 28 TYR HB3 1 1 5 3265 1 1 24 TYR HD1 H 4.295 4.194 -5.507 1.00 . A A . 28 TYR HD1 1 1 5 3266 1 1 24 TYR HD2 H 1.282 5.531 -2.766 1.00 . A A . 28 TYR HD2 1 1 5 3267 1 1 24 TYR HE1 H 2.877 4.909 -7.416 1.00 . A A . 28 TYR HE1 1 1 5 3268 1 1 24 TYR HE2 H -0.131 6.240 -4.681 1.00 . A A . 28 TYR HE2 1 1 5 3269 1 1 24 TYR HH H 0.689 5.420 -7.968 1.00 . A A . 28 TYR HH 1 1 5 3270 1 1 24 TYR N N 4.647 2.271 -3.699 1.00 . A A . 28 TYR N 1 1 5 3271 1 1 24 TYR O O 2.129 1.506 -3.854 1.00 . A A . 28 TYR O 1 1 5 3272 1 1 24 TYR OH O 0.514 6.015 -7.236 1.00 . A A . 28 TYR OH 1 1 5 3273 1 1 25 PHE C C -0.937 3.136 -2.265 1.00 . A A . 29 PHE C 1 1 5 3274 1 1 25 PHE CA C 0.075 2.010 -2.242 1.00 . A A . 29 PHE CA 1 1 5 3275 1 1 25 PHE CB C -0.069 1.056 -1.063 1.00 . A A . 29 PHE CB 1 1 5 3276 1 1 25 PHE CD1 C 2.303 0.164 -0.926 1.00 . A A . 29 PHE CD1 1 1 5 3277 1 1 25 PHE CD2 C 0.573 -1.226 -1.899 1.00 . A A . 29 PHE CD2 1 1 5 3278 1 1 25 PHE CE1 C 3.250 -0.834 -1.195 1.00 . A A . 29 PHE CE1 1 1 5 3279 1 1 25 PHE CE2 C 1.519 -2.225 -2.159 1.00 . A A . 29 PHE CE2 1 1 5 3280 1 1 25 PHE CG C 0.957 -0.036 -1.280 1.00 . A A . 29 PHE CG 1 1 5 3281 1 1 25 PHE CZ C 2.855 -2.029 -1.810 1.00 . A A . 29 PHE CZ 1 1 5 3282 1 1 25 PHE H H 1.631 3.167 -1.329 1.00 . A A . 29 PHE H 1 1 5 3283 1 1 25 PHE HA H 0.020 1.457 -3.165 1.00 . A A . 29 PHE HA 1 1 5 3284 1 1 25 PHE HB2 H 0.120 1.575 -0.134 1.00 . A A . 29 PHE HB2 1 1 5 3285 1 1 25 PHE HB3 H -1.062 0.630 -1.052 1.00 . A A . 29 PHE HB3 1 1 5 3286 1 1 25 PHE HD1 H 2.610 1.087 -0.448 1.00 . A A . 29 PHE HD1 1 1 5 3287 1 1 25 PHE HD2 H -0.456 -1.376 -2.171 1.00 . A A . 29 PHE HD2 1 1 5 3288 1 1 25 PHE HE1 H 4.284 -0.682 -0.931 1.00 . A A . 29 PHE HE1 1 1 5 3289 1 1 25 PHE HE2 H 1.214 -3.145 -2.639 1.00 . A A . 29 PHE HE2 1 1 5 3290 1 1 25 PHE HZ H 3.585 -2.795 -2.024 1.00 . A A . 29 PHE HZ 1 1 5 3291 1 1 25 PHE N N 1.427 2.572 -2.080 1.00 . A A . 29 PHE N 1 1 5 3292 1 1 25 PHE O O -1.249 3.753 -1.263 1.00 . A A . 29 PHE O 1 1 5 3293 1 1 26 LEU C C -3.779 4.081 -3.217 1.00 . A A . 30 LEU C 1 1 5 3294 1 1 26 LEU CA C -2.376 4.537 -3.609 1.00 . A A . 30 LEU CA 1 1 5 3295 1 1 26 LEU CB C -2.269 4.877 -5.110 1.00 . A A . 30 LEU CB 1 1 5 3296 1 1 26 LEU CD1 C -2.413 7.312 -4.303 1.00 . A A . 30 LEU CD1 1 1 5 3297 1 1 26 LEU CD2 C -1.948 6.794 -6.692 1.00 . A A . 30 LEU CD2 1 1 5 3298 1 1 26 LEU CG C -2.694 6.326 -5.445 1.00 . A A . 30 LEU CG 1 1 5 3299 1 1 26 LEU H H -1.110 2.923 -4.227 1.00 . A A . 30 LEU H 1 1 5 3300 1 1 26 LEU HA H -2.076 5.371 -3.008 1.00 . A A . 30 LEU HA 1 1 5 3301 1 1 26 LEU HB2 H -1.248 4.731 -5.428 1.00 . A A . 30 LEU HB2 1 1 5 3302 1 1 26 LEU HB3 H -2.902 4.197 -5.662 1.00 . A A . 30 LEU HB3 1 1 5 3303 1 1 26 LEU HD11 H -1.555 6.986 -3.748 1.00 . A A . 30 LEU HD11 1 1 5 3304 1 1 26 LEU HD12 H -3.268 7.354 -3.646 1.00 . A A . 30 LEU HD12 1 1 5 3305 1 1 26 LEU HD13 H -2.225 8.292 -4.714 1.00 . A A . 30 LEU HD13 1 1 5 3306 1 1 26 LEU HD21 H -2.581 7.458 -7.262 1.00 . A A . 30 LEU HD21 1 1 5 3307 1 1 26 LEU HD22 H -1.684 5.939 -7.297 1.00 . A A . 30 LEU HD22 1 1 5 3308 1 1 26 LEU HD23 H -1.049 7.316 -6.398 1.00 . A A . 30 LEU HD23 1 1 5 3309 1 1 26 LEU HG H -3.733 6.330 -5.658 1.00 . A A . 30 LEU HG 1 1 5 3310 1 1 26 LEU N N -1.414 3.428 -3.439 1.00 . A A . 30 LEU N 1 1 5 3311 1 1 26 LEU O O -4.402 3.274 -3.884 1.00 . A A . 30 LEU O 1 1 5 3312 1 1 27 ASN C C -6.675 5.072 -2.366 1.00 . A A . 31 ASN C 1 1 5 3313 1 1 27 ASN CA C -5.627 4.218 -1.654 1.00 . A A . 31 ASN CA 1 1 5 3314 1 1 27 ASN CB C -5.615 4.520 -0.155 1.00 . A A . 31 ASN CB 1 1 5 3315 1 1 27 ASN CG C -6.872 3.955 0.494 1.00 . A A . 31 ASN CG 1 1 5 3316 1 1 27 ASN H H -3.739 5.240 -1.611 1.00 . A A . 31 ASN H 1 1 5 3317 1 1 27 ASN HA H -5.811 3.169 -1.822 1.00 . A A . 31 ASN HA 1 1 5 3318 1 1 27 ASN HB2 H -4.752 4.062 0.300 1.00 . A A . 31 ASN HB2 1 1 5 3319 1 1 27 ASN HB3 H -5.581 5.588 -0.003 1.00 . A A . 31 ASN HB3 1 1 5 3320 1 1 27 ASN HD21 H -6.040 3.848 2.291 1.00 . A A . 31 ASN HD21 1 1 5 3321 1 1 27 ASN HD22 H -7.641 3.313 2.197 1.00 . A A . 31 ASN HD22 1 1 5 3322 1 1 27 ASN N N -4.271 4.598 -2.125 1.00 . A A . 31 ASN N 1 1 5 3323 1 1 27 ASN ND2 N -6.852 3.684 1.767 1.00 . A A . 31 ASN ND2 1 1 5 3324 1 1 27 ASN O O -6.748 6.273 -2.167 1.00 . A A . 31 ASN O 1 1 5 3325 1 1 27 ASN OD1 O -7.877 3.759 -0.159 1.00 . A A . 31 ASN OD1 1 1 5 3326 1 1 28 HIS C C -9.743 5.475 -3.024 1.00 . A A . 32 HIS C 1 1 5 3327 1 1 28 HIS CA C -8.532 5.225 -3.929 1.00 . A A . 32 HIS CA 1 1 5 3328 1 1 28 HIS CB C -8.917 4.333 -5.110 1.00 . A A . 32 HIS CB 1 1 5 3329 1 1 28 HIS CD2 C -7.469 4.959 -7.212 1.00 . A A . 32 HIS CD2 1 1 5 3330 1 1 28 HIS CE1 C -8.834 6.371 -8.125 1.00 . A A . 32 HIS CE1 1 1 5 3331 1 1 28 HIS CG C -8.573 5.028 -6.398 1.00 . A A . 32 HIS CG 1 1 5 3332 1 1 28 HIS H H -7.395 3.494 -3.334 1.00 . A A . 32 HIS H 1 1 5 3333 1 1 28 HIS HA H -8.134 6.159 -4.288 1.00 . A A . 32 HIS HA 1 1 5 3334 1 1 28 HIS HB2 H -8.377 3.400 -5.047 1.00 . A A . 32 HIS HB2 1 1 5 3335 1 1 28 HIS HB3 H -9.979 4.135 -5.079 1.00 . A A . 32 HIS HB3 1 1 5 3336 1 1 28 HIS HD1 H -10.312 6.208 -6.668 1.00 . A A . 32 HIS HD1 1 1 5 3337 1 1 28 HIS HD2 H -6.603 4.339 -7.032 1.00 . A A . 32 HIS HD2 1 1 5 3338 1 1 28 HIS HE1 H -9.270 7.091 -8.802 1.00 . A A . 32 HIS HE1 1 1 5 3339 1 1 28 HIS N N -7.481 4.461 -3.195 1.00 . A A . 32 HIS N 1 1 5 3340 1 1 28 HIS ND1 N -9.431 5.934 -7.001 1.00 . A A . 32 HIS ND1 1 1 5 3341 1 1 28 HIS NE2 N -7.637 5.808 -8.301 1.00 . A A . 32 HIS NE2 1 1 5 3342 1 1 28 HIS O O -10.592 6.290 -3.322 1.00 . A A . 32 HIS O 1 1 5 3343 1 1 29 ILE C C -10.617 6.188 -0.080 1.00 . A A . 33 ILE C 1 1 5 3344 1 1 29 ILE CA C -10.973 5.019 -0.983 1.00 . A A . 33 ILE CA 1 1 5 3345 1 1 29 ILE CB C -11.169 3.745 -0.123 1.00 . A A . 33 ILE CB 1 1 5 3346 1 1 29 ILE CD1 C -11.085 1.213 -0.119 1.00 . A A . 33 ILE CD1 1 1 5 3347 1 1 29 ILE CG1 C -10.624 2.488 -0.837 1.00 . A A . 33 ILE CG1 1 1 5 3348 1 1 29 ILE CG2 C -12.668 3.576 0.151 1.00 . A A . 33 ILE CG2 1 1 5 3349 1 1 29 ILE H H -9.117 4.159 -1.680 1.00 . A A . 33 ILE H 1 1 5 3350 1 1 29 ILE HA H -11.871 5.235 -1.542 1.00 . A A . 33 ILE HA 1 1 5 3351 1 1 29 ILE HB H -10.652 3.876 0.819 1.00 . A A . 33 ILE HB 1 1 5 3352 1 1 29 ILE HD11 H -10.243 0.546 0.006 1.00 . A A . 33 ILE HD11 1 1 5 3353 1 1 29 ILE HD12 H -11.846 0.723 -0.709 1.00 . A A . 33 ILE HD12 1 1 5 3354 1 1 29 ILE HD13 H -11.488 1.469 0.849 1.00 . A A . 33 ILE HD13 1 1 5 3355 1 1 29 ILE HG12 H -10.975 2.478 -1.856 1.00 . A A . 33 ILE HG12 1 1 5 3356 1 1 29 ILE HG13 H -9.545 2.521 -0.831 1.00 . A A . 33 ILE HG13 1 1 5 3357 1 1 29 ILE HG21 H -12.808 2.870 0.957 1.00 . A A . 33 ILE HG21 1 1 5 3358 1 1 29 ILE HG22 H -13.158 3.210 -0.738 1.00 . A A . 33 ILE HG22 1 1 5 3359 1 1 29 ILE HG23 H -13.092 4.529 0.429 1.00 . A A . 33 ILE HG23 1 1 5 3360 1 1 29 ILE N N -9.821 4.795 -1.912 1.00 . A A . 33 ILE N 1 1 5 3361 1 1 29 ILE O O -11.304 7.188 -0.021 1.00 . A A . 33 ILE O 1 1 5 3362 1 1 30 ASP C C -8.137 8.119 0.733 1.00 . A A . 34 ASP C 1 1 5 3363 1 1 30 ASP CA C -9.071 7.171 1.500 1.00 . A A . 34 ASP CA 1 1 5 3364 1 1 30 ASP CB C -8.319 6.479 2.638 1.00 . A A . 34 ASP CB 1 1 5 3365 1 1 30 ASP CG C -9.303 5.664 3.478 1.00 . A A . 34 ASP CG 1 1 5 3366 1 1 30 ASP H H -8.980 5.249 0.518 1.00 . A A . 34 ASP H 1 1 5 3367 1 1 30 ASP HA H -9.920 7.709 1.891 1.00 . A A . 34 ASP HA 1 1 5 3368 1 1 30 ASP HB2 H -7.568 5.823 2.224 1.00 . A A . 34 ASP HB2 1 1 5 3369 1 1 30 ASP HB3 H -7.844 7.224 3.260 1.00 . A A . 34 ASP HB3 1 1 5 3370 1 1 30 ASP N N -9.520 6.067 0.607 1.00 . A A . 34 ASP N 1 1 5 3371 1 1 30 ASP O O -7.447 8.921 1.326 1.00 . A A . 34 ASP O 1 1 5 3372 1 1 30 ASP OD1 O -10.203 5.079 2.900 1.00 . A A . 34 ASP OD1 1 1 5 3373 1 1 30 ASP OD2 O -9.139 5.640 4.686 1.00 . A A . 34 ASP OD2 1 1 5 3374 1 1 31 GLN C C -5.905 9.203 -0.769 1.00 . A A . 35 GLN C 1 1 5 3375 1 1 31 GLN CA C -7.251 8.905 -1.441 1.00 . A A . 35 GLN CA 1 1 5 3376 1 1 31 GLN CB C -8.050 10.197 -1.672 1.00 . A A . 35 GLN CB 1 1 5 3377 1 1 31 GLN CD C -9.094 12.185 -0.577 1.00 . A A . 35 GLN CD 1 1 5 3378 1 1 31 GLN CG C -8.524 10.786 -0.339 1.00 . A A . 35 GLN CG 1 1 5 3379 1 1 31 GLN H H -8.703 7.368 -1.025 1.00 . A A . 35 GLN H 1 1 5 3380 1 1 31 GLN HA H -7.079 8.423 -2.391 1.00 . A A . 35 GLN HA 1 1 5 3381 1 1 31 GLN HB2 H -7.422 10.917 -2.175 1.00 . A A . 35 GLN HB2 1 1 5 3382 1 1 31 GLN HB3 H -8.909 9.978 -2.289 1.00 . A A . 35 GLN HB3 1 1 5 3383 1 1 31 GLN HE21 H -10.023 11.675 -2.256 1.00 . A A . 35 GLN HE21 1 1 5 3384 1 1 31 GLN HE22 H -10.206 13.297 -1.790 1.00 . A A . 35 GLN HE22 1 1 5 3385 1 1 31 GLN HG2 H -9.291 10.153 0.082 1.00 . A A . 35 GLN HG2 1 1 5 3386 1 1 31 GLN HG3 H -7.692 10.850 0.345 1.00 . A A . 35 GLN HG3 1 1 5 3387 1 1 31 GLN N N -8.126 8.026 -0.586 1.00 . A A . 35 GLN N 1 1 5 3388 1 1 31 GLN NE2 N -9.837 12.404 -1.628 1.00 . A A . 35 GLN NE2 1 1 5 3389 1 1 31 GLN O O -5.688 10.278 -0.247 1.00 . A A . 35 GLN O 1 1 5 3390 1 1 31 GLN OE1 O -8.864 13.089 0.201 1.00 . A A . 35 GLN OE1 1 1 5 3391 1 1 32 THR C C -2.584 7.606 -0.700 1.00 . A A . 36 THR C 1 1 5 3392 1 1 32 THR CA C -3.674 8.518 -0.125 1.00 . A A . 36 THR CA 1 1 5 3393 1 1 32 THR CB C -3.898 8.209 1.356 1.00 . A A . 36 THR CB 1 1 5 3394 1 1 32 THR CG2 C -4.445 9.450 2.063 1.00 . A A . 36 THR CG2 1 1 5 3395 1 1 32 THR H H -5.191 7.394 -1.201 1.00 . A A . 36 THR H 1 1 5 3396 1 1 32 THR HA H -3.396 9.552 -0.242 1.00 . A A . 36 THR HA 1 1 5 3397 1 1 32 THR HB H -2.959 7.926 1.810 1.00 . A A . 36 THR HB 1 1 5 3398 1 1 32 THR HG1 H -5.028 7.032 2.416 1.00 . A A . 36 THR HG1 1 1 5 3399 1 1 32 THR HG21 H -3.930 9.586 3.002 1.00 . A A . 36 THR HG21 1 1 5 3400 1 1 32 THR HG22 H -5.502 9.323 2.246 1.00 . A A . 36 THR HG22 1 1 5 3401 1 1 32 THR HG23 H -4.290 10.317 1.437 1.00 . A A . 36 THR HG23 1 1 5 3402 1 1 32 THR N N -4.999 8.262 -0.775 1.00 . A A . 36 THR N 1 1 5 3403 1 1 32 THR O O -2.859 6.633 -1.372 1.00 . A A . 36 THR O 1 1 5 3404 1 1 32 THR OG1 O -4.826 7.141 1.483 1.00 . A A . 36 THR OG1 1 1 5 3405 1 1 33 THR C C 0.620 6.548 0.224 1.00 . A A . 37 THR C 1 1 5 3406 1 1 33 THR CA C -0.218 7.077 -0.943 1.00 . A A . 37 THR CA 1 1 5 3407 1 1 33 THR CB C 0.644 8.008 -1.801 1.00 . A A . 37 THR CB 1 1 5 3408 1 1 33 THR CG2 C -0.216 8.734 -2.835 1.00 . A A . 37 THR CG2 1 1 5 3409 1 1 33 THR H H -1.145 8.706 0.123 1.00 . A A . 37 THR H 1 1 5 3410 1 1 33 THR HA H -0.596 6.262 -1.541 1.00 . A A . 37 THR HA 1 1 5 3411 1 1 33 THR HB H 1.397 7.425 -2.314 1.00 . A A . 37 THR HB 1 1 5 3412 1 1 33 THR HG1 H 0.599 9.536 -0.600 1.00 . A A . 37 THR HG1 1 1 5 3413 1 1 33 THR HG21 H -0.020 8.324 -3.817 1.00 . A A . 37 THR HG21 1 1 5 3414 1 1 33 THR HG22 H 0.027 9.786 -2.831 1.00 . A A . 37 THR HG22 1 1 5 3415 1 1 33 THR HG23 H -1.260 8.604 -2.595 1.00 . A A . 37 THR HG23 1 1 5 3416 1 1 33 THR N N -1.340 7.919 -0.427 1.00 . A A . 37 THR N 1 1 5 3417 1 1 33 THR O O 1.495 7.228 0.722 1.00 . A A . 37 THR O 1 1 5 3418 1 1 33 THR OG1 O 1.277 8.961 -0.962 1.00 . A A . 37 THR OG1 1 1 5 3419 1 1 34 THR C C 2.202 3.784 1.252 1.00 . A A . 38 THR C 1 1 5 3420 1 1 34 THR CA C 1.191 4.798 1.789 1.00 . A A . 38 THR CA 1 1 5 3421 1 1 34 THR CB C 0.191 4.133 2.740 1.00 . A A . 38 THR CB 1 1 5 3422 1 1 34 THR CG2 C -0.476 2.943 2.049 1.00 . A A . 38 THR CG2 1 1 5 3423 1 1 34 THR H H -0.323 4.795 0.245 1.00 . A A . 38 THR H 1 1 5 3424 1 1 34 THR HA H 1.702 5.599 2.298 1.00 . A A . 38 THR HA 1 1 5 3425 1 1 34 THR HB H -0.565 4.848 3.023 1.00 . A A . 38 THR HB 1 1 5 3426 1 1 34 THR HG1 H 0.804 4.366 4.570 1.00 . A A . 38 THR HG1 1 1 5 3427 1 1 34 THR HG21 H -1.076 3.299 1.226 1.00 . A A . 38 THR HG21 1 1 5 3428 1 1 34 THR HG22 H -1.105 2.425 2.756 1.00 . A A . 38 THR HG22 1 1 5 3429 1 1 34 THR HG23 H 0.280 2.269 1.678 1.00 . A A . 38 THR HG23 1 1 5 3430 1 1 34 THR N N 0.379 5.342 0.662 1.00 . A A . 38 THR N 1 1 5 3431 1 1 34 THR O O 1.891 2.971 0.406 1.00 . A A . 38 THR O 1 1 5 3432 1 1 34 THR OG1 O 0.876 3.682 3.901 1.00 . A A . 38 THR OG1 1 1 5 3433 1 1 35 TRP C C 4.066 1.443 1.655 1.00 . A A . 39 TRP C 1 1 5 3434 1 1 35 TRP CA C 4.437 2.863 1.225 1.00 . A A . 39 TRP CA 1 1 5 3435 1 1 35 TRP CB C 5.771 3.272 1.869 1.00 . A A . 39 TRP CB 1 1 5 3436 1 1 35 TRP CD1 C 5.736 5.637 2.771 1.00 . A A . 39 TRP CD1 1 1 5 3437 1 1 35 TRP CD2 C 6.560 5.538 0.677 1.00 . A A . 39 TRP CD2 1 1 5 3438 1 1 35 TRP CE2 C 6.604 6.896 1.074 1.00 . A A . 39 TRP CE2 1 1 5 3439 1 1 35 TRP CE3 C 7.028 5.213 -0.613 1.00 . A A . 39 TRP CE3 1 1 5 3440 1 1 35 TRP CG C 6.001 4.755 1.778 1.00 . A A . 39 TRP CG 1 1 5 3441 1 1 35 TRP CH2 C 7.559 7.547 -1.042 1.00 . A A . 39 TRP CH2 1 1 5 3442 1 1 35 TRP CZ2 C 7.096 7.890 0.230 1.00 . A A . 39 TRP CZ2 1 1 5 3443 1 1 35 TRP CZ3 C 7.522 6.212 -1.461 1.00 . A A . 39 TRP CZ3 1 1 5 3444 1 1 35 TRP H H 3.652 4.491 2.404 1.00 . A A . 39 TRP H 1 1 5 3445 1 1 35 TRP HA H 4.510 2.920 0.151 1.00 . A A . 39 TRP HA 1 1 5 3446 1 1 35 TRP HB2 H 5.765 2.979 2.908 1.00 . A A . 39 TRP HB2 1 1 5 3447 1 1 35 TRP HB3 H 6.577 2.759 1.364 1.00 . A A . 39 TRP HB3 1 1 5 3448 1 1 35 TRP HD1 H 5.313 5.391 3.735 1.00 . A A . 39 TRP HD1 1 1 5 3449 1 1 35 TRP HE1 H 5.999 7.725 2.882 1.00 . A A . 39 TRP HE1 1 1 5 3450 1 1 35 TRP HE3 H 7.001 4.194 -0.959 1.00 . A A . 39 TRP HE3 1 1 5 3451 1 1 35 TRP HH2 H 7.942 8.311 -1.702 1.00 . A A . 39 TRP HH2 1 1 5 3452 1 1 35 TRP HZ2 H 7.121 8.917 0.561 1.00 . A A . 39 TRP HZ2 1 1 5 3453 1 1 35 TRP HZ3 H 7.882 5.949 -2.444 1.00 . A A . 39 TRP HZ3 1 1 5 3454 1 1 35 TRP N N 3.414 3.828 1.726 1.00 . A A . 39 TRP N 1 1 5 3455 1 1 35 TRP NE1 N 6.091 6.906 2.351 1.00 . A A . 39 TRP NE1 1 1 5 3456 1 1 35 TRP O O 4.225 0.497 0.909 1.00 . A A . 39 TRP O 1 1 5 3457 1 1 36 GLN C C 1.731 -0.365 3.010 1.00 . A A . 40 GLN C 1 1 5 3458 1 1 36 GLN CA C 3.200 -0.078 3.332 1.00 . A A . 40 GLN CA 1 1 5 3459 1 1 36 GLN CB C 3.423 -0.042 4.843 1.00 . A A . 40 GLN CB 1 1 5 3460 1 1 36 GLN CD C 5.159 0.764 6.449 1.00 . A A . 40 GLN CD 1 1 5 3461 1 1 36 GLN CG C 4.922 0.013 5.137 1.00 . A A . 40 GLN CG 1 1 5 3462 1 1 36 GLN H H 3.459 2.059 3.441 1.00 . A A . 40 GLN H 1 1 5 3463 1 1 36 GLN HA H 3.837 -0.824 2.883 1.00 . A A . 40 GLN HA 1 1 5 3464 1 1 36 GLN HB2 H 2.942 0.833 5.256 1.00 . A A . 40 GLN HB2 1 1 5 3465 1 1 36 GLN HB3 H 3.000 -0.929 5.292 1.00 . A A . 40 GLN HB3 1 1 5 3466 1 1 36 GLN HE21 H 5.394 2.526 5.562 1.00 . A A . 40 GLN HE21 1 1 5 3467 1 1 36 GLN HE22 H 5.532 2.539 7.254 1.00 . A A . 40 GLN HE22 1 1 5 3468 1 1 36 GLN HG2 H 5.309 -0.992 5.225 1.00 . A A . 40 GLN HG2 1 1 5 3469 1 1 36 GLN HG3 H 5.429 0.525 4.334 1.00 . A A . 40 GLN HG3 1 1 5 3470 1 1 36 GLN N N 3.577 1.283 2.853 1.00 . A A . 40 GLN N 1 1 5 3471 1 1 36 GLN NE2 N 5.379 2.050 6.420 1.00 . A A . 40 GLN NE2 1 1 5 3472 1 1 36 GLN O O 1.112 0.320 2.223 1.00 . A A . 40 GLN O 1 1 5 3473 1 1 36 GLN OE1 O 5.140 0.175 7.513 1.00 . A A . 40 GLN OE1 1 1 5 3474 1 1 37 ASP C C -1.113 -1.429 4.590 1.00 . A A . 41 ASP C 1 1 5 3475 1 1 37 ASP CA C -0.259 -1.707 3.346 1.00 . A A . 41 ASP CA 1 1 5 3476 1 1 37 ASP CB C -0.267 -3.200 3.012 1.00 . A A . 41 ASP CB 1 1 5 3477 1 1 37 ASP CG C 0.391 -3.983 4.151 1.00 . A A . 41 ASP CG 1 1 5 3478 1 1 37 ASP H H 1.686 -1.918 4.248 1.00 . A A . 41 ASP H 1 1 5 3479 1 1 37 ASP HA H -0.624 -1.141 2.503 1.00 . A A . 41 ASP HA 1 1 5 3480 1 1 37 ASP HB2 H -1.285 -3.536 2.886 1.00 . A A . 41 ASP HB2 1 1 5 3481 1 1 37 ASP HB3 H 0.283 -3.367 2.097 1.00 . A A . 41 ASP HB3 1 1 5 3482 1 1 37 ASP N N 1.169 -1.376 3.616 1.00 . A A . 41 ASP N 1 1 5 3483 1 1 37 ASP O O -0.596 -1.361 5.688 1.00 . A A . 41 ASP O 1 1 5 3484 1 1 37 ASP OD1 O 0.037 -3.740 5.293 1.00 . A A . 41 ASP OD1 1 1 5 3485 1 1 37 ASP OD2 O 1.236 -4.814 3.863 1.00 . A A . 41 ASP OD2 1 1 5 3486 1 1 38 PRO C C -3.505 -2.257 6.366 1.00 . A A . 42 PRO C 1 1 5 3487 1 1 38 PRO CA C -3.321 -1.001 5.511 1.00 . A A . 42 PRO CA 1 1 5 3488 1 1 38 PRO CB C -4.627 -0.615 4.824 1.00 . A A . 42 PRO CB 1 1 5 3489 1 1 38 PRO CD C -3.109 -1.340 3.093 1.00 . A A . 42 PRO CD 1 1 5 3490 1 1 38 PRO CG C -4.564 -1.265 3.479 1.00 . A A . 42 PRO CG 1 1 5 3491 1 1 38 PRO HA H -2.959 -0.180 6.108 1.00 . A A . 42 PRO HA 1 1 5 3492 1 1 38 PRO HB2 H -5.471 -0.991 5.384 1.00 . A A . 42 PRO HB2 1 1 5 3493 1 1 38 PRO HB3 H -4.694 0.458 4.720 1.00 . A A . 42 PRO HB3 1 1 5 3494 1 1 38 PRO HD2 H -2.898 -2.272 2.591 1.00 . A A . 42 PRO HD2 1 1 5 3495 1 1 38 PRO HD3 H -2.839 -0.501 2.469 1.00 . A A . 42 PRO HD3 1 1 5 3496 1 1 38 PRO HG2 H -4.985 -2.258 3.528 1.00 . A A . 42 PRO HG2 1 1 5 3497 1 1 38 PRO HG3 H -5.107 -0.672 2.757 1.00 . A A . 42 PRO HG3 1 1 5 3498 1 1 38 PRO N N -2.399 -1.275 4.381 1.00 . A A . 42 PRO N 1 1 5 3499 1 1 38 PRO O O -3.480 -2.202 7.581 1.00 . A A . 42 PRO O 1 1 5 3500 1 1 39 ARG C C -2.802 -5.670 6.143 1.00 . A A . 43 ARG C 1 1 5 3501 1 1 39 ARG CA C -3.876 -4.647 6.524 1.00 . A A . 43 ARG CA 1 1 5 3502 1 1 39 ARG CB C -5.263 -5.156 6.131 1.00 . A A . 43 ARG CB 1 1 5 3503 1 1 39 ARG CD C -7.690 -4.987 6.704 1.00 . A A . 43 ARG CD 1 1 5 3504 1 1 39 ARG CG C -6.265 -4.808 7.234 1.00 . A A . 43 ARG CG 1 1 5 3505 1 1 39 ARG CZ C -9.401 -6.633 7.281 1.00 . A A . 43 ARG CZ 1 1 5 3506 1 1 39 ARG H H -3.707 -3.414 4.765 1.00 . A A . 43 ARG H 1 1 5 3507 1 1 39 ARG HA H -3.845 -4.443 7.583 1.00 . A A . 43 ARG HA 1 1 5 3508 1 1 39 ARG HB2 H -5.570 -4.689 5.207 1.00 . A A . 43 ARG HB2 1 1 5 3509 1 1 39 ARG HB3 H -5.231 -6.227 5.999 1.00 . A A . 43 ARG HB3 1 1 5 3510 1 1 39 ARG HD2 H -8.224 -4.050 6.738 1.00 . A A . 43 ARG HD2 1 1 5 3511 1 1 39 ARG HD3 H -7.669 -5.376 5.697 1.00 . A A . 43 ARG HD3 1 1 5 3512 1 1 39 ARG HE H -7.918 -6.139 8.508 1.00 . A A . 43 ARG HE 1 1 5 3513 1 1 39 ARG HG2 H -6.111 -5.460 8.081 1.00 . A A . 43 ARG HG2 1 1 5 3514 1 1 39 ARG HG3 H -6.122 -3.781 7.540 1.00 . A A . 43 ARG HG3 1 1 5 3515 1 1 39 ARG HH11 H -9.571 -5.784 5.466 1.00 . A A . 43 ARG HH11 1 1 5 3516 1 1 39 ARG HH12 H -10.787 -6.947 5.865 1.00 . A A . 43 ARG HH12 1 1 5 3517 1 1 39 ARG HH21 H -9.508 -7.645 9.005 1.00 . A A . 43 ARG HH21 1 1 5 3518 1 1 39 ARG HH22 H -10.753 -7.994 7.853 1.00 . A A . 43 ARG HH22 1 1 5 3519 1 1 39 ARG N N -3.689 -3.390 5.745 1.00 . A A . 43 ARG N 1 1 5 3520 1 1 39 ARG NE N -8.318 -5.977 7.630 1.00 . A A . 43 ARG NE 1 1 5 3521 1 1 39 ARG NH1 N -9.961 -6.439 6.111 1.00 . A A . 43 ARG NH1 1 1 5 3522 1 1 39 ARG NH2 N -9.928 -7.490 8.110 1.00 . A A . 43 ARG NH2 1 1 5 3523 1 1 39 ARG O O -3.095 -6.727 5.622 1.00 . A A . 43 ARG O 1 1 5 3524 1 1 40 LYS C C -0.569 -6.724 4.577 1.00 . A A . 44 LYS C 1 1 5 3525 1 1 40 LYS CA C -0.468 -6.316 6.049 1.00 . A A . 44 LYS CA 1 1 5 3526 1 1 40 LYS CB C -0.696 -7.527 6.957 1.00 . A A . 44 LYS CB 1 1 5 3527 1 1 40 LYS CD C 0.361 -6.728 9.077 1.00 . A A . 44 LYS CD 1 1 5 3528 1 1 40 LYS CE C 0.934 -7.378 10.337 1.00 . A A . 44 LYS CE 1 1 5 3529 1 1 40 LYS CG C 0.502 -7.692 7.896 1.00 . A A . 44 LYS CG 1 1 5 3530 1 1 40 LYS H H -1.344 -4.504 6.819 1.00 . A A . 44 LYS H 1 1 5 3531 1 1 40 LYS HA H 0.496 -5.879 6.256 1.00 . A A . 44 LYS HA 1 1 5 3532 1 1 40 LYS HB2 H -1.592 -7.376 7.540 1.00 . A A . 44 LYS HB2 1 1 5 3533 1 1 40 LYS HB3 H -0.803 -8.415 6.353 1.00 . A A . 44 LYS HB3 1 1 5 3534 1 1 40 LYS HD2 H 0.902 -5.817 8.863 1.00 . A A . 44 LYS HD2 1 1 5 3535 1 1 40 LYS HD3 H -0.683 -6.499 9.232 1.00 . A A . 44 LYS HD3 1 1 5 3536 1 1 40 LYS HE2 H 0.140 -7.640 11.020 1.00 . A A . 44 LYS HE2 1 1 5 3537 1 1 40 LYS HE3 H 1.513 -8.254 10.079 1.00 . A A . 44 LYS HE3 1 1 5 3538 1 1 40 LYS HG2 H 0.535 -8.707 8.262 1.00 . A A . 44 LYS HG2 1 1 5 3539 1 1 40 LYS HG3 H 1.413 -7.473 7.359 1.00 . A A . 44 LYS HG3 1 1 5 3540 1 1 40 LYS HZ1 H 2.253 -6.709 11.803 1.00 . A A . 44 LYS HZ1 1 1 5 3541 1 1 40 LYS HZ2 H 1.244 -5.496 11.171 1.00 . A A . 44 LYS HZ2 1 1 5 3542 1 1 40 LYS HZ3 H 2.556 -6.072 10.259 1.00 . A A . 44 LYS HZ3 1 1 5 3543 1 1 40 LYS N N -1.560 -5.362 6.398 1.00 . A A . 44 LYS N 1 1 5 3544 1 1 40 LYS NZ N 1.813 -6.335 10.938 1.00 . A A . 44 LYS NZ 1 1 5 3545 1 1 40 LYS O O -1.398 -6.159 3.883 1.00 . A A . 44 LYS O 1 1 5 3546 1 1 40 LYS OXT O 0.184 -7.593 4.169 1.00 . A A . 44 LYS OXT 1 1 5 3547 2 2 1 ACE C C 7.574 13.955 2.270 1.00 . B B . 45 ACE C 1 1 5 3548 2 2 1 ACE CH3 C 8.399 15.178 1.865 1.00 . B B . 45 ACE CH3 1 1 5 3549 2 2 1 ACE H1 H 9.246 14.862 1.273 1.00 . B B . 45 ACE H1 1 1 5 3550 2 2 1 ACE H2 H 8.750 15.685 2.753 1.00 . B B . 45 ACE H2 1 1 5 3551 2 2 1 ACE H3 H 7.785 15.851 1.285 1.00 . B B . 45 ACE H3 1 1 5 3552 2 2 1 ACE O O 6.369 13.940 2.118 1.00 . B B . 45 ACE O 1 1 5 3553 2 2 2 PRO C C 7.392 11.248 1.204 1.00 . B B . 46 PRO C 1 1 5 3554 2 2 2 PRO CA C 8.630 11.813 1.906 1.00 . B B . 46 PRO CA 1 1 5 3555 2 2 2 PRO CB C 9.209 10.791 2.879 1.00 . B B . 46 PRO CB 1 1 5 3556 2 2 2 PRO CD C 8.302 12.598 4.196 1.00 . B B . 46 PRO CD 1 1 5 3557 2 2 2 PRO CG C 8.591 11.120 4.198 1.00 . B B . 46 PRO CG 1 1 5 3558 2 2 2 PRO HA H 9.378 12.104 1.187 1.00 . B B . 46 PRO HA 1 1 5 3559 2 2 2 PRO HB2 H 8.941 9.789 2.573 1.00 . B B . 46 PRO HB2 1 1 5 3560 2 2 2 PRO HB3 H 10.282 10.894 2.938 1.00 . B B . 46 PRO HB3 1 1 5 3561 2 2 2 PRO HD2 H 7.350 12.796 4.669 1.00 . B B . 46 PRO HD2 1 1 5 3562 2 2 2 PRO HD3 H 9.092 13.140 4.694 1.00 . B B . 46 PRO HD3 1 1 5 3563 2 2 2 PRO HG2 H 7.673 10.562 4.324 1.00 . B B . 46 PRO HG2 1 1 5 3564 2 2 2 PRO HG3 H 9.277 10.885 4.997 1.00 . B B . 46 PRO HG3 1 1 5 3565 2 2 2 PRO N N 8.259 12.963 2.773 1.00 . B B . 46 PRO N 1 1 5 3566 2 2 2 PRO O O 7.374 11.071 0.001 1.00 . B B . 46 PRO O 1 1 5 3567 2 2 3 LEU C C 4.668 11.305 0.153 1.00 . B B . 47 LEU C 1 1 5 3568 2 2 3 LEU CA C 5.118 10.410 1.321 1.00 . B B . 47 LEU CA 1 1 5 3569 2 2 3 LEU CB C 4.079 10.422 2.444 1.00 . B B . 47 LEU CB 1 1 5 3570 2 2 3 LEU CD1 C 2.323 8.684 2.807 1.00 . B B . 47 LEU CD1 1 1 5 3571 2 2 3 LEU CD2 C 1.685 10.948 1.967 1.00 . B B . 47 LEU CD2 1 1 5 3572 2 2 3 LEU CG C 2.755 9.857 1.926 1.00 . B B . 47 LEU CG 1 1 5 3573 2 2 3 LEU H H 6.389 11.114 2.912 1.00 . B B . 47 LEU H 1 1 5 3574 2 2 3 LEU HA H 5.287 9.400 0.988 1.00 . B B . 47 LEU HA 1 1 5 3575 2 2 3 LEU HB2 H 4.431 9.815 3.265 1.00 . B B . 47 LEU HB2 1 1 5 3576 2 2 3 LEU HB3 H 3.930 11.435 2.785 1.00 . B B . 47 LEU HB3 1 1 5 3577 2 2 3 LEU HD11 H 1.290 8.441 2.602 1.00 . B B . 47 LEU HD11 1 1 5 3578 2 2 3 LEU HD12 H 2.429 8.957 3.848 1.00 . B B . 47 LEU HD12 1 1 5 3579 2 2 3 LEU HD13 H 2.943 7.826 2.595 1.00 . B B . 47 LEU HD13 1 1 5 3580 2 2 3 LEU HD21 H 1.564 11.297 2.982 1.00 . B B . 47 LEU HD21 1 1 5 3581 2 2 3 LEU HD22 H 0.747 10.548 1.612 1.00 . B B . 47 LEU HD22 1 1 5 3582 2 2 3 LEU HD23 H 1.986 11.772 1.337 1.00 . B B . 47 LEU HD23 1 1 5 3583 2 2 3 LEU HG H 2.881 9.517 0.909 1.00 . B B . 47 LEU HG 1 1 5 3584 2 2 3 LEU N N 6.355 10.963 1.944 1.00 . B B . 47 LEU N 1 1 5 3585 2 2 3 LEU O O 4.587 12.508 0.301 1.00 . B B . 47 LEU O 1 1 5 3586 2 2 4 PRO C C 2.534 12.000 -1.981 1.00 . B B . 48 PRO C 1 1 5 3587 2 2 4 PRO CA C 3.962 11.466 -2.170 1.00 . B B . 48 PRO CA 1 1 5 3588 2 2 4 PRO CB C 4.006 10.439 -3.300 1.00 . B B . 48 PRO CB 1 1 5 3589 2 2 4 PRO CD C 4.464 9.250 -1.257 1.00 . B B . 48 PRO CD 1 1 5 3590 2 2 4 PRO CG C 3.845 9.117 -2.621 1.00 . B B . 48 PRO CG 1 1 5 3591 2 2 4 PRO HA H 4.652 12.268 -2.374 1.00 . B B . 48 PRO HA 1 1 5 3592 2 2 4 PRO HB2 H 3.196 10.607 -3.993 1.00 . B B . 48 PRO HB2 1 1 5 3593 2 2 4 PRO HB3 H 4.956 10.485 -3.811 1.00 . B B . 48 PRO HB3 1 1 5 3594 2 2 4 PRO HD2 H 3.895 8.695 -0.526 1.00 . B B . 48 PRO HD2 1 1 5 3595 2 2 4 PRO HD3 H 5.490 8.915 -1.275 1.00 . B B . 48 PRO HD3 1 1 5 3596 2 2 4 PRO HG2 H 2.796 8.878 -2.529 1.00 . B B . 48 PRO HG2 1 1 5 3597 2 2 4 PRO HG3 H 4.350 8.348 -3.182 1.00 . B B . 48 PRO HG3 1 1 5 3598 2 2 4 PRO N N 4.396 10.692 -0.979 1.00 . B B . 48 PRO N 1 1 5 3599 2 2 4 PRO O O 1.669 11.285 -1.515 1.00 . B B . 48 PRO O 1 1 5 3600 2 2 5 PRO C C 0.048 13.319 -3.314 1.00 . B B . 49 PRO C 1 1 5 3601 2 2 5 PRO CA C 0.978 13.849 -2.219 1.00 . B B . 49 PRO CA 1 1 5 3602 2 2 5 PRO CB C 1.236 15.341 -2.404 1.00 . B B . 49 PRO CB 1 1 5 3603 2 2 5 PRO CD C 3.300 14.184 -2.923 1.00 . B B . 49 PRO CD 1 1 5 3604 2 2 5 PRO CG C 2.492 15.424 -3.214 1.00 . B B . 49 PRO CG 1 1 5 3605 2 2 5 PRO HA H 0.568 13.660 -1.240 1.00 . B B . 49 PRO HA 1 1 5 3606 2 2 5 PRO HB2 H 0.416 15.799 -2.936 1.00 . B B . 49 PRO HB2 1 1 5 3607 2 2 5 PRO HB3 H 1.375 15.818 -1.446 1.00 . B B . 49 PRO HB3 1 1 5 3608 2 2 5 PRO HD2 H 3.722 13.786 -3.833 1.00 . B B . 49 PRO HD2 1 1 5 3609 2 2 5 PRO HD3 H 4.078 14.400 -2.207 1.00 . B B . 49 PRO HD3 1 1 5 3610 2 2 5 PRO HG2 H 2.249 15.465 -4.265 1.00 . B B . 49 PRO HG2 1 1 5 3611 2 2 5 PRO HG3 H 3.054 16.302 -2.931 1.00 . B B . 49 PRO HG3 1 1 5 3612 2 2 5 PRO N N 2.324 13.241 -2.353 1.00 . B B . 49 PRO N 1 1 5 3613 2 2 5 PRO O O 0.337 13.424 -4.490 1.00 . B B . 49 PRO O 1 1 5 3614 2 2 6 TYR C C -2.344 13.307 -4.994 1.00 . B B . 50 TYR C 1 1 5 3615 2 2 6 TYR CA C -2.011 12.221 -3.967 1.00 . B B . 50 TYR CA 1 1 5 3616 2 2 6 TYR CB C -3.265 11.818 -3.188 1.00 . B B . 50 TYR CB 1 1 5 3617 2 2 6 TYR CD1 C -4.706 11.394 -5.213 1.00 . B B . 50 TYR CD1 1 1 5 3618 2 2 6 TYR CD2 C -4.317 9.577 -3.655 1.00 . B B . 50 TYR CD2 1 1 5 3619 2 2 6 TYR CE1 C -5.495 10.550 -6.002 1.00 . B B . 50 TYR CE1 1 1 5 3620 2 2 6 TYR CE2 C -5.107 8.732 -4.446 1.00 . B B . 50 TYR CE2 1 1 5 3621 2 2 6 TYR CG C -4.116 10.907 -4.039 1.00 . B B . 50 TYR CG 1 1 5 3622 2 2 6 TYR CZ C -5.696 9.219 -5.618 1.00 . B B . 50 TYR CZ 1 1 5 3623 2 2 6 TYR H H -1.287 12.680 -1.988 1.00 . B B . 50 TYR H 1 1 5 3624 2 2 6 TYR HA H -1.587 11.358 -4.456 1.00 . B B . 50 TYR HA 1 1 5 3625 2 2 6 TYR HB2 H -2.975 11.302 -2.285 1.00 . B B . 50 TYR HB2 1 1 5 3626 2 2 6 TYR HB3 H -3.828 12.703 -2.932 1.00 . B B . 50 TYR HB3 1 1 5 3627 2 2 6 TYR HD1 H -4.552 12.421 -5.510 1.00 . B B . 50 TYR HD1 1 1 5 3628 2 2 6 TYR HD2 H -3.863 9.200 -2.752 1.00 . B B . 50 TYR HD2 1 1 5 3629 2 2 6 TYR HE1 H -5.949 10.925 -6.908 1.00 . B B . 50 TYR HE1 1 1 5 3630 2 2 6 TYR HE2 H -5.262 7.705 -4.150 1.00 . B B . 50 TYR HE2 1 1 5 3631 2 2 6 TYR HH H -6.874 7.730 -5.821 1.00 . B B . 50 TYR HH 1 1 5 3632 2 2 6 TYR N N -1.067 12.754 -2.941 1.00 . B B . 50 TYR N 1 1 5 3633 2 2 6 TYR O O -1.824 13.233 -6.095 1.00 . B B . 50 TYR O 1 1 5 3634 2 2 6 TYR OXT O -3.114 14.193 -4.661 1.00 . B B . 50 TYR OXT 1 1 5 3635 2 2 6 TYR OH O -6.475 8.387 -6.397 1.00 . B B . 50 TYR OH 1 1 6 3636 1 1 1 PHE C C 4.220 -9.968 13.451 1.00 . A A . 5 PHE C 1 1 6 3637 1 1 1 PHE CA C 4.947 -10.829 14.487 1.00 . A A . 5 PHE CA 1 1 6 3638 1 1 1 PHE CB C 5.787 -9.954 15.419 1.00 . A A . 5 PHE CB 1 1 6 3639 1 1 1 PHE CD1 C 7.221 -11.522 16.774 1.00 . A A . 5 PHE CD1 1 1 6 3640 1 1 1 PHE CD2 C 5.219 -10.603 17.788 1.00 . A A . 5 PHE CD2 1 1 6 3641 1 1 1 PHE CE1 C 7.496 -12.224 17.953 1.00 . A A . 5 PHE CE1 1 1 6 3642 1 1 1 PHE CE2 C 5.494 -11.305 18.968 1.00 . A A . 5 PHE CE2 1 1 6 3643 1 1 1 PHE CG C 6.082 -10.711 16.691 1.00 . A A . 5 PHE CG 1 1 6 3644 1 1 1 PHE CZ C 6.632 -12.116 19.051 1.00 . A A . 5 PHE CZ 1 1 6 3645 1 1 1 PHE HA H 4.240 -11.406 15.062 1.00 . A A . 5 PHE HA 1 1 6 3646 1 1 1 PHE HB2 H 6.713 -9.694 14.929 1.00 . A A . 5 PHE HB2 1 1 6 3647 1 1 1 PHE HB3 H 5.239 -9.053 15.657 1.00 . A A . 5 PHE HB3 1 1 6 3648 1 1 1 PHE HD1 H 7.887 -11.606 15.929 1.00 . A A . 5 PHE HD1 1 1 6 3649 1 1 1 PHE HD2 H 4.340 -9.978 17.724 1.00 . A A . 5 PHE HD2 1 1 6 3650 1 1 1 PHE HE1 H 8.375 -12.849 18.018 1.00 . A A . 5 PHE HE1 1 1 6 3651 1 1 1 PHE HE2 H 4.828 -11.221 19.813 1.00 . A A . 5 PHE HE2 1 1 6 3652 1 1 1 PHE HZ H 6.845 -12.657 19.961 1.00 . A A . 5 PHE HZ 1 1 6 3653 1 1 1 PHE N N 5.929 -11.727 13.814 1.00 . A A . 5 PHE N 1 1 6 3654 1 1 1 PHE O O 4.330 -8.758 13.449 1.00 . A A . 5 PHE O 1 1 6 3655 1 1 2 GLU C C 1.853 -10.722 10.703 1.00 . A A . 6 GLU C 1 1 6 3656 1 1 2 GLU CA C 2.744 -9.798 11.535 1.00 . A A . 6 GLU CA 1 1 6 3657 1 1 2 GLU CB C 3.835 -9.176 10.663 1.00 . A A . 6 GLU CB 1 1 6 3658 1 1 2 GLU CD C 2.784 -7.828 8.841 1.00 . A A . 6 GLU CD 1 1 6 3659 1 1 2 GLU CG C 3.408 -7.770 10.237 1.00 . A A . 6 GLU CG 1 1 6 3660 1 1 2 GLU H H 3.403 -11.558 12.589 1.00 . A A . 6 GLU H 1 1 6 3661 1 1 2 GLU HA H 2.156 -9.021 11.999 1.00 . A A . 6 GLU HA 1 1 6 3662 1 1 2 GLU HB2 H 4.756 -9.117 11.226 1.00 . A A . 6 GLU HB2 1 1 6 3663 1 1 2 GLU HB3 H 3.988 -9.787 9.786 1.00 . A A . 6 GLU HB3 1 1 6 3664 1 1 2 GLU HG2 H 2.683 -7.385 10.939 1.00 . A A . 6 GLU HG2 1 1 6 3665 1 1 2 GLU HG3 H 4.272 -7.121 10.218 1.00 . A A . 6 GLU HG3 1 1 6 3666 1 1 2 GLU N N 3.478 -10.582 12.570 1.00 . A A . 6 GLU N 1 1 6 3667 1 1 2 GLU O O 2.252 -11.215 9.666 1.00 . A A . 6 GLU O 1 1 6 3668 1 1 2 GLU OE1 O 3.519 -8.052 7.894 1.00 . A A . 6 GLU OE1 1 1 6 3669 1 1 2 GLU OE2 O 1.582 -7.647 8.743 1.00 . A A . 6 GLU OE2 1 1 6 3670 1 1 3 ILE C C -0.603 -11.227 9.019 1.00 . A A . 7 ILE C 1 1 6 3671 1 1 3 ILE CA C -0.266 -11.854 10.381 1.00 . A A . 7 ILE CA 1 1 6 3672 1 1 3 ILE CB C -1.524 -11.962 11.245 1.00 . A A . 7 ILE CB 1 1 6 3673 1 1 3 ILE CD1 C -3.393 -10.370 10.784 1.00 . A A . 7 ILE CD1 1 1 6 3674 1 1 3 ILE CG1 C -2.070 -10.561 11.528 1.00 . A A . 7 ILE CG1 1 1 6 3675 1 1 3 ILE CG2 C -1.175 -12.651 12.565 1.00 . A A . 7 ILE CG2 1 1 6 3676 1 1 3 ILE H H 0.347 -10.553 11.986 1.00 . A A . 7 ILE H 1 1 6 3677 1 1 3 ILE HA H 0.177 -12.829 10.257 1.00 . A A . 7 ILE HA 1 1 6 3678 1 1 3 ILE HB H -2.269 -12.543 10.722 1.00 . A A . 7 ILE HB 1 1 6 3679 1 1 3 ILE HD11 H -3.354 -9.457 10.208 1.00 . A A . 7 ILE HD11 1 1 6 3680 1 1 3 ILE HD12 H -4.202 -10.311 11.498 1.00 . A A . 7 ILE HD12 1 1 6 3681 1 1 3 ILE HD13 H -3.558 -11.207 10.122 1.00 . A A . 7 ILE HD13 1 1 6 3682 1 1 3 ILE HG12 H -2.235 -10.447 12.589 1.00 . A A . 7 ILE HG12 1 1 6 3683 1 1 3 ILE HG13 H -1.359 -9.822 11.192 1.00 . A A . 7 ILE HG13 1 1 6 3684 1 1 3 ILE HG21 H -0.401 -13.384 12.395 1.00 . A A . 7 ILE HG21 1 1 6 3685 1 1 3 ILE HG22 H -2.054 -13.139 12.959 1.00 . A A . 7 ILE HG22 1 1 6 3686 1 1 3 ILE HG23 H -0.825 -11.915 13.272 1.00 . A A . 7 ILE HG23 1 1 6 3687 1 1 3 ILE N N 0.649 -10.961 11.148 1.00 . A A . 7 ILE N 1 1 6 3688 1 1 3 ILE O O -1.276 -10.217 8.960 1.00 . A A . 7 ILE O 1 1 6 3689 1 1 4 PRO C C -1.843 -11.591 6.185 1.00 . A A . 8 PRO C 1 1 6 3690 1 1 4 PRO CA C -0.392 -11.317 6.600 1.00 . A A . 8 PRO CA 1 1 6 3691 1 1 4 PRO CB C 0.580 -12.094 5.717 1.00 . A A . 8 PRO CB 1 1 6 3692 1 1 4 PRO CD C 0.695 -13.064 7.928 1.00 . A A . 8 PRO CD 1 1 6 3693 1 1 4 PRO CG C 0.854 -13.363 6.460 1.00 . A A . 8 PRO CG 1 1 6 3694 1 1 4 PRO HA H -0.174 -10.263 6.549 1.00 . A A . 8 PRO HA 1 1 6 3695 1 1 4 PRO HB2 H 0.125 -12.309 4.761 1.00 . A A . 8 PRO HB2 1 1 6 3696 1 1 4 PRO HB3 H 1.492 -11.534 5.581 1.00 . A A . 8 PRO HB3 1 1 6 3697 1 1 4 PRO HD2 H 0.185 -13.875 8.426 1.00 . A A . 8 PRO HD2 1 1 6 3698 1 1 4 PRO HD3 H 1.657 -12.885 8.385 1.00 . A A . 8 PRO HD3 1 1 6 3699 1 1 4 PRO HG2 H 0.148 -14.124 6.162 1.00 . A A . 8 PRO HG2 1 1 6 3700 1 1 4 PRO HG3 H 1.861 -13.696 6.259 1.00 . A A . 8 PRO HG3 1 1 6 3701 1 1 4 PRO N N -0.126 -11.842 7.962 1.00 . A A . 8 PRO N 1 1 6 3702 1 1 4 PRO O O -2.333 -11.042 5.219 1.00 . A A . 8 PRO O 1 1 6 3703 1 1 5 ASP C C -4.105 -13.034 5.067 1.00 . A A . 9 ASP C 1 1 6 3704 1 1 5 ASP CA C -3.956 -12.735 6.565 1.00 . A A . 9 ASP CA 1 1 6 3705 1 1 5 ASP CB C -4.715 -11.471 6.949 1.00 . A A . 9 ASP CB 1 1 6 3706 1 1 5 ASP CG C -6.217 -11.690 6.749 1.00 . A A . 9 ASP CG 1 1 6 3707 1 1 5 ASP H H -2.133 -12.855 7.691 1.00 . A A . 9 ASP H 1 1 6 3708 1 1 5 ASP HA H -4.315 -13.567 7.150 1.00 . A A . 9 ASP HA 1 1 6 3709 1 1 5 ASP HB2 H -4.517 -11.244 7.986 1.00 . A A . 9 ASP HB2 1 1 6 3710 1 1 5 ASP HB3 H -4.383 -10.651 6.333 1.00 . A A . 9 ASP HB3 1 1 6 3711 1 1 5 ASP N N -2.538 -12.431 6.912 1.00 . A A . 9 ASP N 1 1 6 3712 1 1 5 ASP O O -5.159 -12.854 4.489 1.00 . A A . 9 ASP O 1 1 6 3713 1 1 5 ASP OD1 O -6.630 -12.838 6.734 1.00 . A A . 9 ASP OD1 1 1 6 3714 1 1 5 ASP OD2 O -6.926 -10.707 6.613 1.00 . A A . 9 ASP OD2 1 1 6 3715 1 1 6 ASP C C -3.654 -12.615 2.187 1.00 . A A . 10 ASP C 1 1 6 3716 1 1 6 ASP CA C -3.131 -13.816 2.985 1.00 . A A . 10 ASP CA 1 1 6 3717 1 1 6 ASP CB C -4.106 -14.991 2.896 1.00 . A A . 10 ASP CB 1 1 6 3718 1 1 6 ASP CG C -4.288 -15.399 1.433 1.00 . A A . 10 ASP CG 1 1 6 3719 1 1 6 ASP H H -2.221 -13.639 4.927 1.00 . A A . 10 ASP H 1 1 6 3720 1 1 6 ASP HA H -2.163 -14.117 2.617 1.00 . A A . 10 ASP HA 1 1 6 3721 1 1 6 ASP HB2 H -3.714 -15.826 3.456 1.00 . A A . 10 ASP HB2 1 1 6 3722 1 1 6 ASP HB3 H -5.058 -14.696 3.309 1.00 . A A . 10 ASP HB3 1 1 6 3723 1 1 6 ASP N N -3.057 -13.495 4.439 1.00 . A A . 10 ASP N 1 1 6 3724 1 1 6 ASP O O -4.142 -12.757 1.084 1.00 . A A . 10 ASP O 1 1 6 3725 1 1 6 ASP OD1 O -3.286 -15.585 0.761 1.00 . A A . 10 ASP OD1 1 1 6 3726 1 1 6 ASP OD2 O -5.425 -15.521 1.008 1.00 . A A . 10 ASP OD2 1 1 6 3727 1 1 7 VAL C C -3.166 -9.017 2.315 1.00 . A A . 11 VAL C 1 1 6 3728 1 1 7 VAL CA C -4.050 -10.235 1.995 1.00 . A A . 11 VAL CA 1 1 6 3729 1 1 7 VAL CB C -5.471 -10.014 2.511 1.00 . A A . 11 VAL CB 1 1 6 3730 1 1 7 VAL CG1 C -5.448 -9.884 4.035 1.00 . A A . 11 VAL CG1 1 1 6 3731 1 1 7 VAL CG2 C -6.041 -8.736 1.895 1.00 . A A . 11 VAL CG2 1 1 6 3732 1 1 7 VAL H H -3.163 -11.329 3.619 1.00 . A A . 11 VAL H 1 1 6 3733 1 1 7 VAL HA H -4.071 -10.429 0.937 1.00 . A A . 11 VAL HA 1 1 6 3734 1 1 7 VAL HB H -6.091 -10.855 2.231 1.00 . A A . 11 VAL HB 1 1 6 3735 1 1 7 VAL HG11 H -4.858 -10.686 4.454 1.00 . A A . 11 VAL HG11 1 1 6 3736 1 1 7 VAL HG12 H -6.455 -9.942 4.418 1.00 . A A . 11 VAL HG12 1 1 6 3737 1 1 7 VAL HG13 H -5.011 -8.935 4.310 1.00 . A A . 11 VAL HG13 1 1 6 3738 1 1 7 VAL HG21 H -5.903 -7.915 2.583 1.00 . A A . 11 VAL HG21 1 1 6 3739 1 1 7 VAL HG22 H -7.093 -8.869 1.699 1.00 . A A . 11 VAL HG22 1 1 6 3740 1 1 7 VAL HG23 H -5.525 -8.522 0.970 1.00 . A A . 11 VAL HG23 1 1 6 3741 1 1 7 VAL N N -3.558 -11.432 2.731 1.00 . A A . 11 VAL N 1 1 6 3742 1 1 7 VAL O O -3.015 -8.657 3.465 1.00 . A A . 11 VAL O 1 1 6 3743 1 1 8 PRO C C -2.584 -5.970 1.644 1.00 . A A . 12 PRO C 1 1 6 3744 1 1 8 PRO CA C -1.737 -7.238 1.493 1.00 . A A . 12 PRO CA 1 1 6 3745 1 1 8 PRO CB C -0.904 -7.185 0.217 1.00 . A A . 12 PRO CB 1 1 6 3746 1 1 8 PRO CD C -2.720 -8.773 -0.130 1.00 . A A . 12 PRO CD 1 1 6 3747 1 1 8 PRO CG C -1.724 -7.878 -0.830 1.00 . A A . 12 PRO CG 1 1 6 3748 1 1 8 PRO HA H -1.097 -7.376 2.348 1.00 . A A . 12 PRO HA 1 1 6 3749 1 1 8 PRO HB2 H -0.721 -6.160 -0.069 1.00 . A A . 12 PRO HB2 1 1 6 3750 1 1 8 PRO HB3 H 0.032 -7.704 0.362 1.00 . A A . 12 PRO HB3 1 1 6 3751 1 1 8 PRO HD2 H -3.720 -8.576 -0.489 1.00 . A A . 12 PRO HD2 1 1 6 3752 1 1 8 PRO HD3 H -2.466 -9.812 -0.279 1.00 . A A . 12 PRO HD3 1 1 6 3753 1 1 8 PRO HG2 H -2.248 -7.147 -1.428 1.00 . A A . 12 PRO HG2 1 1 6 3754 1 1 8 PRO HG3 H -1.081 -8.473 -1.462 1.00 . A A . 12 PRO HG3 1 1 6 3755 1 1 8 PRO N N -2.606 -8.417 1.290 1.00 . A A . 12 PRO N 1 1 6 3756 1 1 8 PRO O O -2.544 -5.303 2.659 1.00 . A A . 12 PRO O 1 1 6 3757 1 1 9 LEU C C -5.661 -4.758 0.395 1.00 . A A . 13 LEU C 1 1 6 3758 1 1 9 LEU CA C -4.204 -4.411 0.732 1.00 . A A . 13 LEU CA 1 1 6 3759 1 1 9 LEU CB C -3.625 -3.450 -0.309 1.00 . A A . 13 LEU CB 1 1 6 3760 1 1 9 LEU CD1 C -1.173 -3.830 -0.611 1.00 . A A . 13 LEU CD1 1 1 6 3761 1 1 9 LEU CD2 C -2.035 -1.523 -0.205 1.00 . A A . 13 LEU CD2 1 1 6 3762 1 1 9 LEU CG C -2.228 -3.004 0.129 1.00 . A A . 13 LEU CG 1 1 6 3763 1 1 9 LEU H H -3.372 -6.186 -0.166 1.00 . A A . 13 LEU H 1 1 6 3764 1 1 9 LEU HA H -4.136 -3.975 1.716 1.00 . A A . 13 LEU HA 1 1 6 3765 1 1 9 LEU HB2 H -3.562 -3.950 -1.264 1.00 . A A . 13 LEU HB2 1 1 6 3766 1 1 9 LEU HB3 H -4.268 -2.586 -0.396 1.00 . A A . 13 LEU HB3 1 1 6 3767 1 1 9 LEU HD11 H -0.386 -4.106 0.073 1.00 . A A . 13 LEU HD11 1 1 6 3768 1 1 9 LEU HD12 H -0.761 -3.247 -1.421 1.00 . A A . 13 LEU HD12 1 1 6 3769 1 1 9 LEU HD13 H -1.632 -4.724 -1.011 1.00 . A A . 13 LEU HD13 1 1 6 3770 1 1 9 LEU HD21 H -2.266 -1.355 -1.245 1.00 . A A . 13 LEU HD21 1 1 6 3771 1 1 9 LEU HD22 H -1.011 -1.241 -0.012 1.00 . A A . 13 LEU HD22 1 1 6 3772 1 1 9 LEU HD23 H -2.694 -0.928 0.412 1.00 . A A . 13 LEU HD23 1 1 6 3773 1 1 9 LEU HG H -2.119 -3.152 1.193 1.00 . A A . 13 LEU HG 1 1 6 3774 1 1 9 LEU N N -3.353 -5.633 0.644 1.00 . A A . 13 LEU N 1 1 6 3775 1 1 9 LEU O O -5.915 -5.631 -0.411 1.00 . A A . 13 LEU O 1 1 6 3776 1 1 10 PRO C C -8.435 -3.787 -0.594 1.00 . A A . 14 PRO C 1 1 6 3777 1 1 10 PRO CA C -8.019 -4.318 0.782 1.00 . A A . 14 PRO CA 1 1 6 3778 1 1 10 PRO CB C -8.716 -3.550 1.900 1.00 . A A . 14 PRO CB 1 1 6 3779 1 1 10 PRO CD C -6.367 -2.994 2.016 1.00 . A A . 14 PRO CD 1 1 6 3780 1 1 10 PRO CG C -7.755 -2.474 2.292 1.00 . A A . 14 PRO CG 1 1 6 3781 1 1 10 PRO HA H -8.239 -5.371 0.864 1.00 . A A . 14 PRO HA 1 1 6 3782 1 1 10 PRO HB2 H -9.638 -3.117 1.539 1.00 . A A . 14 PRO HB2 1 1 6 3783 1 1 10 PRO HB3 H -8.912 -4.202 2.739 1.00 . A A . 14 PRO HB3 1 1 6 3784 1 1 10 PRO HD2 H -5.746 -2.214 1.602 1.00 . A A . 14 PRO HD2 1 1 6 3785 1 1 10 PRO HD3 H -5.926 -3.393 2.917 1.00 . A A . 14 PRO HD3 1 1 6 3786 1 1 10 PRO HG2 H -7.939 -1.585 1.707 1.00 . A A . 14 PRO HG2 1 1 6 3787 1 1 10 PRO HG3 H -7.860 -2.251 3.344 1.00 . A A . 14 PRO HG3 1 1 6 3788 1 1 10 PRO N N -6.578 -4.064 1.027 1.00 . A A . 14 PRO N 1 1 6 3789 1 1 10 PRO O O -7.608 -3.530 -1.447 1.00 . A A . 14 PRO O 1 1 6 3790 1 1 11 ALA C C -9.926 -1.614 -2.259 1.00 . A A . 15 ALA C 1 1 6 3791 1 1 11 ALA CA C -10.183 -3.120 -2.138 1.00 . A A . 15 ALA CA 1 1 6 3792 1 1 11 ALA CB C -11.684 -3.409 -2.161 1.00 . A A . 15 ALA CB 1 1 6 3793 1 1 11 ALA H H -10.362 -3.845 -0.118 1.00 . A A . 15 ALA H 1 1 6 3794 1 1 11 ALA HA H -9.695 -3.650 -2.941 1.00 . A A . 15 ALA HA 1 1 6 3795 1 1 11 ALA HB1 H -12.190 -2.642 -2.727 1.00 . A A . 15 ALA HB1 1 1 6 3796 1 1 11 ALA HB2 H -12.062 -3.421 -1.149 1.00 . A A . 15 ALA HB2 1 1 6 3797 1 1 11 ALA HB3 H -11.857 -4.370 -2.621 1.00 . A A . 15 ALA HB3 1 1 6 3798 1 1 11 ALA N N -9.712 -3.627 -0.817 1.00 . A A . 15 ALA N 1 1 6 3799 1 1 11 ALA O O -9.549 -0.959 -1.308 1.00 . A A . 15 ALA O 1 1 6 3800 1 1 12 GLY C C -8.409 0.723 -3.424 1.00 . A A . 16 GLY C 1 1 6 3801 1 1 12 GLY CA C -9.895 0.397 -3.617 1.00 . A A . 16 GLY CA 1 1 6 3802 1 1 12 GLY H H -10.429 -1.612 -4.181 1.00 . A A . 16 GLY H 1 1 6 3803 1 1 12 GLY HA2 H -10.196 0.681 -4.615 1.00 . A A . 16 GLY HA2 1 1 6 3804 1 1 12 GLY HA3 H -10.481 0.949 -2.896 1.00 . A A . 16 GLY HA3 1 1 6 3805 1 1 12 GLY N N -10.127 -1.063 -3.428 1.00 . A A . 16 GLY N 1 1 6 3806 1 1 12 GLY O O -8.033 1.870 -3.287 1.00 . A A . 16 GLY O 1 1 6 3807 1 1 13 TRP C C -5.318 -0.364 -4.470 1.00 . A A . 17 TRP C 1 1 6 3808 1 1 13 TRP CA C -6.108 -0.007 -3.209 1.00 . A A . 17 TRP CA 1 1 6 3809 1 1 13 TRP CB C -5.706 -0.922 -2.056 1.00 . A A . 17 TRP CB 1 1 6 3810 1 1 13 TRP CD1 C -6.844 -0.172 0.064 1.00 . A A . 17 TRP CD1 1 1 6 3811 1 1 13 TRP CD2 C -4.805 0.732 -0.200 1.00 . A A . 17 TRP CD2 1 1 6 3812 1 1 13 TRP CE2 C -5.311 1.235 1.020 1.00 . A A . 17 TRP CE2 1 1 6 3813 1 1 13 TRP CE3 C -3.528 1.145 -0.611 1.00 . A A . 17 TRP CE3 1 1 6 3814 1 1 13 TRP CG C -5.791 -0.159 -0.781 1.00 . A A . 17 TRP CG 1 1 6 3815 1 1 13 TRP CH2 C -3.303 2.523 1.378 1.00 . A A . 17 TRP CH2 1 1 6 3816 1 1 13 TRP CZ2 C -4.573 2.121 1.805 1.00 . A A . 17 TRP CZ2 1 1 6 3817 1 1 13 TRP CZ3 C -2.785 2.035 0.173 1.00 . A A . 17 TRP CZ3 1 1 6 3818 1 1 13 TRP H H -7.879 -1.191 -3.505 1.00 . A A . 17 TRP H 1 1 6 3819 1 1 13 TRP HA H -5.943 1.022 -2.936 1.00 . A A . 17 TRP HA 1 1 6 3820 1 1 13 TRP HB2 H -6.375 -1.769 -2.017 1.00 . A A . 17 TRP HB2 1 1 6 3821 1 1 13 TRP HB3 H -4.694 -1.266 -2.206 1.00 . A A . 17 TRP HB3 1 1 6 3822 1 1 13 TRP HD1 H -7.753 -0.736 -0.075 1.00 . A A . 17 TRP HD1 1 1 6 3823 1 1 13 TRP HE1 H -7.158 0.821 1.898 1.00 . A A . 17 TRP HE1 1 1 6 3824 1 1 13 TRP HE3 H -3.118 0.777 -1.539 1.00 . A A . 17 TRP HE3 1 1 6 3825 1 1 13 TRP HH2 H -2.720 3.206 1.975 1.00 . A A . 17 TRP HH2 1 1 6 3826 1 1 13 TRP HZ2 H -4.978 2.494 2.734 1.00 . A A . 17 TRP HZ2 1 1 6 3827 1 1 13 TRP HZ3 H -1.811 2.347 -0.154 1.00 . A A . 17 TRP HZ3 1 1 6 3828 1 1 13 TRP N N -7.561 -0.272 -3.403 1.00 . A A . 17 TRP N 1 1 6 3829 1 1 13 TRP NE1 N -6.560 0.655 1.139 1.00 . A A . 17 TRP NE1 1 1 6 3830 1 1 13 TRP O O -5.625 -1.320 -5.154 1.00 . A A . 17 TRP O 1 1 6 3831 1 1 14 GLU C C -1.999 0.122 -5.705 1.00 . A A . 18 GLU C 1 1 6 3832 1 1 14 GLU CA C -3.499 0.081 -6.003 1.00 . A A . 18 GLU CA 1 1 6 3833 1 1 14 GLU CB C -3.849 1.177 -7.010 1.00 . A A . 18 GLU CB 1 1 6 3834 1 1 14 GLU CD C -6.170 0.534 -7.677 1.00 . A A . 18 GLU CD 1 1 6 3835 1 1 14 GLU CG C -4.710 0.589 -8.129 1.00 . A A . 18 GLU CG 1 1 6 3836 1 1 14 GLU H H -4.066 1.164 -4.221 1.00 . A A . 18 GLU H 1 1 6 3837 1 1 14 GLU HA H -3.779 -0.881 -6.400 1.00 . A A . 18 GLU HA 1 1 6 3838 1 1 14 GLU HB2 H -4.389 1.966 -6.514 1.00 . A A . 18 GLU HB2 1 1 6 3839 1 1 14 GLU HB3 H -2.940 1.577 -7.434 1.00 . A A . 18 GLU HB3 1 1 6 3840 1 1 14 GLU HG2 H -4.627 1.209 -9.009 1.00 . A A . 18 GLU HG2 1 1 6 3841 1 1 14 GLU HG3 H -4.366 -0.409 -8.360 1.00 . A A . 18 GLU HG3 1 1 6 3842 1 1 14 GLU N N -4.301 0.395 -4.784 1.00 . A A . 18 GLU N 1 1 6 3843 1 1 14 GLU O O -1.385 1.172 -5.740 1.00 . A A . 18 GLU O 1 1 6 3844 1 1 14 GLU OE1 O -6.840 1.549 -7.782 1.00 . A A . 18 GLU OE1 1 1 6 3845 1 1 14 GLU OE2 O -6.595 -0.520 -7.233 1.00 . A A . 18 GLU OE2 1 1 6 3846 1 1 15 MET C C 0.781 -0.632 -6.481 1.00 . A A . 19 MET C 1 1 6 3847 1 1 15 MET CA C 0.069 -0.998 -5.187 1.00 . A A . 19 MET CA 1 1 6 3848 1 1 15 MET CB C 0.457 -2.412 -4.761 1.00 . A A . 19 MET CB 1 1 6 3849 1 1 15 MET CE C -1.732 -4.347 -3.973 1.00 . A A . 19 MET CE 1 1 6 3850 1 1 15 MET CG C 0.035 -3.427 -5.830 1.00 . A A . 19 MET CG 1 1 6 3851 1 1 15 MET H H -1.889 -1.849 -5.430 1.00 . A A . 19 MET H 1 1 6 3852 1 1 15 MET HA H 0.313 -0.292 -4.408 1.00 . A A . 19 MET HA 1 1 6 3853 1 1 15 MET HB2 H 1.522 -2.450 -4.644 1.00 . A A . 19 MET HB2 1 1 6 3854 1 1 15 MET HB3 H -0.009 -2.649 -3.818 1.00 . A A . 19 MET HB3 1 1 6 3855 1 1 15 MET HE1 H -1.823 -3.280 -4.122 1.00 . A A . 19 MET HE1 1 1 6 3856 1 1 15 MET HE2 H -1.490 -4.544 -2.941 1.00 . A A . 19 MET HE2 1 1 6 3857 1 1 15 MET HE3 H -2.666 -4.831 -4.220 1.00 . A A . 19 MET HE3 1 1 6 3858 1 1 15 MET HG2 H -0.807 -3.047 -6.385 1.00 . A A . 19 MET HG2 1 1 6 3859 1 1 15 MET HG3 H 0.860 -3.597 -6.505 1.00 . A A . 19 MET HG3 1 1 6 3860 1 1 15 MET N N -1.393 -1.008 -5.441 1.00 . A A . 19 MET N 1 1 6 3861 1 1 15 MET O O 0.603 -1.263 -7.503 1.00 . A A . 19 MET O 1 1 6 3862 1 1 15 MET SD S -0.418 -4.992 -5.036 1.00 . A A . 19 MET SD 1 1 6 3863 1 1 16 ALA C C 3.614 1.484 -7.272 1.00 . A A . 20 ALA C 1 1 6 3864 1 1 16 ALA CA C 2.298 0.802 -7.677 1.00 . A A . 20 ALA CA 1 1 6 3865 1 1 16 ALA CB C 1.311 1.741 -8.385 1.00 . A A . 20 ALA CB 1 1 6 3866 1 1 16 ALA H H 1.703 0.879 -5.613 1.00 . A A . 20 ALA H 1 1 6 3867 1 1 16 ALA HA H 2.499 -0.057 -8.299 1.00 . A A . 20 ALA HA 1 1 6 3868 1 1 16 ALA HB1 H 0.797 2.342 -7.651 1.00 . A A . 20 ALA HB1 1 1 6 3869 1 1 16 ALA HB2 H 0.586 1.150 -8.926 1.00 . A A . 20 ALA HB2 1 1 6 3870 1 1 16 ALA HB3 H 1.836 2.377 -9.077 1.00 . A A . 20 ALA HB3 1 1 6 3871 1 1 16 ALA N N 1.579 0.384 -6.449 1.00 . A A . 20 ALA N 1 1 6 3872 1 1 16 ALA O O 4.425 0.874 -6.601 1.00 . A A . 20 ALA O 1 1 6 3873 1 1 17 LYS C C 5.081 4.867 -7.245 1.00 . A A . 21 LYS C 1 1 6 3874 1 1 17 LYS CA C 5.142 3.344 -7.214 1.00 . A A . 21 LYS CA 1 1 6 3875 1 1 17 LYS CB C 6.182 2.827 -8.207 1.00 . A A . 21 LYS CB 1 1 6 3876 1 1 17 LYS CD C 6.927 3.759 -10.402 1.00 . A A . 21 LYS CD 1 1 6 3877 1 1 17 LYS CE C 7.505 2.695 -11.338 1.00 . A A . 21 LYS CE 1 1 6 3878 1 1 17 LYS CG C 5.743 3.171 -9.630 1.00 . A A . 21 LYS CG 1 1 6 3879 1 1 17 LYS H H 3.210 3.227 -8.165 1.00 . A A . 21 LYS H 1 1 6 3880 1 1 17 LYS HA H 5.392 3.020 -6.223 1.00 . A A . 21 LYS HA 1 1 6 3881 1 1 17 LYS HB2 H 7.137 3.289 -8.002 1.00 . A A . 21 LYS HB2 1 1 6 3882 1 1 17 LYS HB3 H 6.273 1.756 -8.107 1.00 . A A . 21 LYS HB3 1 1 6 3883 1 1 17 LYS HD2 H 6.593 4.606 -10.982 1.00 . A A . 21 LYS HD2 1 1 6 3884 1 1 17 LYS HD3 H 7.688 4.076 -9.705 1.00 . A A . 21 LYS HD3 1 1 6 3885 1 1 17 LYS HE2 H 7.228 1.706 -11.000 1.00 . A A . 21 LYS HE2 1 1 6 3886 1 1 17 LYS HE3 H 7.162 2.856 -12.348 1.00 . A A . 21 LYS HE3 1 1 6 3887 1 1 17 LYS HG2 H 5.398 2.276 -10.127 1.00 . A A . 21 LYS HG2 1 1 6 3888 1 1 17 LYS HG3 H 4.942 3.894 -9.595 1.00 . A A . 21 LYS HG3 1 1 6 3889 1 1 17 LYS HZ1 H 9.457 2.042 -11.656 1.00 . A A . 21 LYS HZ1 1 1 6 3890 1 1 17 LYS HZ2 H 9.262 2.989 -10.259 1.00 . A A . 21 LYS HZ2 1 1 6 3891 1 1 17 LYS HZ3 H 9.258 3.721 -11.793 1.00 . A A . 21 LYS HZ3 1 1 6 3892 1 1 17 LYS N N 3.854 2.720 -7.636 1.00 . A A . 21 LYS N 1 1 6 3893 1 1 17 LYS NZ N 8.982 2.876 -11.255 1.00 . A A . 21 LYS NZ 1 1 6 3894 1 1 17 LYS O O 4.211 5.463 -7.848 1.00 . A A . 21 LYS O 1 1 6 3895 1 1 18 THR C C 7.488 7.484 -6.602 1.00 . A A . 22 THR C 1 1 6 3896 1 1 18 THR CA C 6.045 6.982 -6.549 1.00 . A A . 22 THR CA 1 1 6 3897 1 1 18 THR CB C 5.395 7.360 -5.215 1.00 . A A . 22 THR CB 1 1 6 3898 1 1 18 THR CG2 C 6.120 6.653 -4.063 1.00 . A A . 22 THR CG2 1 1 6 3899 1 1 18 THR H H 6.705 4.976 -6.103 1.00 . A A . 22 THR H 1 1 6 3900 1 1 18 THR HA H 5.473 7.391 -7.366 1.00 . A A . 22 THR HA 1 1 6 3901 1 1 18 THR HB H 4.361 7.057 -5.224 1.00 . A A . 22 THR HB 1 1 6 3902 1 1 18 THR HG1 H 4.911 9.181 -5.695 1.00 . A A . 22 THR HG1 1 1 6 3903 1 1 18 THR HG21 H 6.294 5.619 -4.320 1.00 . A A . 22 THR HG21 1 1 6 3904 1 1 18 THR HG22 H 5.513 6.703 -3.169 1.00 . A A . 22 THR HG22 1 1 6 3905 1 1 18 THR HG23 H 7.064 7.143 -3.881 1.00 . A A . 22 THR HG23 1 1 6 3906 1 1 18 THR N N 6.016 5.494 -6.584 1.00 . A A . 22 THR N 1 1 6 3907 1 1 18 THR O O 8.386 6.785 -7.029 1.00 . A A . 22 THR O 1 1 6 3908 1 1 18 THR OG1 O 5.471 8.767 -5.035 1.00 . A A . 22 THR OG1 1 1 6 3909 1 1 19 SER C C 10.062 8.295 -5.476 1.00 . A A . 23 SER C 1 1 6 3910 1 1 19 SER CA C 9.100 9.246 -6.194 1.00 . A A . 23 SER CA 1 1 6 3911 1 1 19 SER CB C 9.005 10.577 -5.449 1.00 . A A . 23 SER CB 1 1 6 3912 1 1 19 SER H H 6.973 9.233 -5.831 1.00 . A A . 23 SER H 1 1 6 3913 1 1 19 SER HA H 9.422 9.413 -7.210 1.00 . A A . 23 SER HA 1 1 6 3914 1 1 19 SER HB2 H 8.259 10.502 -4.671 1.00 . A A . 23 SER HB2 1 1 6 3915 1 1 19 SER HB3 H 9.962 10.812 -5.008 1.00 . A A . 23 SER HB3 1 1 6 3916 1 1 19 SER HG H 7.683 11.697 -6.332 1.00 . A A . 23 SER HG 1 1 6 3917 1 1 19 SER N N 7.716 8.691 -6.171 1.00 . A A . 23 SER N 1 1 6 3918 1 1 19 SER O O 9.650 7.350 -4.835 1.00 . A A . 23 SER O 1 1 6 3919 1 1 19 SER OG O 8.638 11.604 -6.358 1.00 . A A . 23 SER OG 1 1 6 3920 1 1 20 SER C C 12.476 6.290 -5.588 1.00 . A A . 24 SER C 1 1 6 3921 1 1 20 SER CA C 12.380 7.669 -4.916 1.00 . A A . 24 SER CA 1 1 6 3922 1 1 20 SER CB C 11.927 7.509 -3.463 1.00 . A A . 24 SER CB 1 1 6 3923 1 1 20 SER H H 11.647 9.314 -6.112 1.00 . A A . 24 SER H 1 1 6 3924 1 1 20 SER HA H 13.343 8.154 -4.939 1.00 . A A . 24 SER HA 1 1 6 3925 1 1 20 SER HB2 H 11.507 8.441 -3.112 1.00 . A A . 24 SER HB2 1 1 6 3926 1 1 20 SER HB3 H 11.178 6.734 -3.412 1.00 . A A . 24 SER HB3 1 1 6 3927 1 1 20 SER HG H 13.534 6.473 -3.116 1.00 . A A . 24 SER HG 1 1 6 3928 1 1 20 SER N N 11.350 8.544 -5.585 1.00 . A A . 24 SER N 1 1 6 3929 1 1 20 SER O O 13.256 5.451 -5.180 1.00 . A A . 24 SER O 1 1 6 3930 1 1 20 SER OG O 13.038 7.152 -2.654 1.00 . A A . 24 SER OG 1 1 6 3931 1 1 21 GLY C C 11.358 3.617 -6.297 1.00 . A A . 25 GLY C 1 1 6 3932 1 1 21 GLY CA C 11.766 4.714 -7.282 1.00 . A A . 25 GLY CA 1 1 6 3933 1 1 21 GLY H H 11.080 6.719 -6.925 1.00 . A A . 25 GLY H 1 1 6 3934 1 1 21 GLY HA2 H 11.092 4.708 -8.126 1.00 . A A . 25 GLY HA2 1 1 6 3935 1 1 21 GLY HA3 H 12.774 4.534 -7.625 1.00 . A A . 25 GLY HA3 1 1 6 3936 1 1 21 GLY N N 11.700 6.041 -6.605 1.00 . A A . 25 GLY N 1 1 6 3937 1 1 21 GLY O O 11.916 2.539 -6.288 1.00 . A A . 25 GLY O 1 1 6 3938 1 1 22 GLN C C 8.468 2.522 -4.695 1.00 . A A . 26 GLN C 1 1 6 3939 1 1 22 GLN CA C 9.947 2.858 -4.479 1.00 . A A . 26 GLN CA 1 1 6 3940 1 1 22 GLN CB C 10.153 3.507 -3.110 1.00 . A A . 26 GLN CB 1 1 6 3941 1 1 22 GLN CD C 12.161 2.720 -1.849 1.00 . A A . 26 GLN CD 1 1 6 3942 1 1 22 GLN CG C 11.647 3.734 -2.873 1.00 . A A . 26 GLN CG 1 1 6 3943 1 1 22 GLN H H 9.952 4.762 -5.488 1.00 . A A . 26 GLN H 1 1 6 3944 1 1 22 GLN HA H 10.553 1.969 -4.560 1.00 . A A . 26 GLN HA 1 1 6 3945 1 1 22 GLN HB2 H 9.637 4.456 -3.079 1.00 . A A . 26 GLN HB2 1 1 6 3946 1 1 22 GLN HB3 H 9.761 2.859 -2.341 1.00 . A A . 26 GLN HB3 1 1 6 3947 1 1 22 GLN HE21 H 13.438 1.876 -3.112 1.00 . A A . 26 GLN HE21 1 1 6 3948 1 1 22 GLN HE22 H 13.417 1.213 -1.550 1.00 . A A . 26 GLN HE22 1 1 6 3949 1 1 22 GLN HG2 H 12.182 3.608 -3.803 1.00 . A A . 26 GLN HG2 1 1 6 3950 1 1 22 GLN HG3 H 11.806 4.735 -2.502 1.00 . A A . 26 GLN HG3 1 1 6 3951 1 1 22 GLN N N 10.388 3.885 -5.464 1.00 . A A . 26 GLN N 1 1 6 3952 1 1 22 GLN NE2 N 13.082 1.866 -2.199 1.00 . A A . 26 GLN NE2 1 1 6 3953 1 1 22 GLN O O 7.699 3.339 -5.175 1.00 . A A . 26 GLN O 1 1 6 3954 1 1 22 GLN OE1 O 11.719 2.708 -0.716 1.00 . A A . 26 GLN OE1 1 1 6 3955 1 1 23 ARG C C 5.760 1.689 -3.531 1.00 . A A . 27 ARG C 1 1 6 3956 1 1 23 ARG CA C 6.631 0.957 -4.535 1.00 . A A . 27 ARG CA 1 1 6 3957 1 1 23 ARG CB C 6.519 -0.551 -4.275 1.00 . A A . 27 ARG CB 1 1 6 3958 1 1 23 ARG CD C 5.183 -2.270 -5.496 1.00 . A A . 27 ARG CD 1 1 6 3959 1 1 23 ARG CG C 6.346 -1.281 -5.606 1.00 . A A . 27 ARG CG 1 1 6 3960 1 1 23 ARG CZ C 5.147 -4.706 -5.665 1.00 . A A . 27 ARG CZ 1 1 6 3961 1 1 23 ARG H H 8.690 0.682 -3.959 1.00 . A A . 27 ARG H 1 1 6 3962 1 1 23 ARG HA H 6.315 1.180 -5.540 1.00 . A A . 27 ARG HA 1 1 6 3963 1 1 23 ARG HB2 H 7.403 -0.906 -3.773 1.00 . A A . 27 ARG HB2 1 1 6 3964 1 1 23 ARG HB3 H 5.656 -0.742 -3.650 1.00 . A A . 27 ARG HB3 1 1 6 3965 1 1 23 ARG HD2 H 4.849 -2.345 -4.471 1.00 . A A . 27 ARG HD2 1 1 6 3966 1 1 23 ARG HD3 H 4.370 -1.964 -6.136 1.00 . A A . 27 ARG HD3 1 1 6 3967 1 1 23 ARG HE H 6.571 -3.584 -6.483 1.00 . A A . 27 ARG HE 1 1 6 3968 1 1 23 ARG HG2 H 6.135 -0.562 -6.384 1.00 . A A . 27 ARG HG2 1 1 6 3969 1 1 23 ARG HG3 H 7.251 -1.817 -5.841 1.00 . A A . 27 ARG HG3 1 1 6 3970 1 1 23 ARG HH11 H 3.635 -3.872 -4.636 1.00 . A A . 27 ARG HH11 1 1 6 3971 1 1 23 ARG HH12 H 3.601 -5.598 -4.752 1.00 . A A . 27 ARG HH12 1 1 6 3972 1 1 23 ARG HH21 H 6.506 -5.824 -6.618 1.00 . A A . 27 ARG HH21 1 1 6 3973 1 1 23 ARG HH22 H 5.213 -6.697 -5.865 1.00 . A A . 27 ARG HH22 1 1 6 3974 1 1 23 ARG N N 8.060 1.326 -4.344 1.00 . A A . 27 ARG N 1 1 6 3975 1 1 23 ARG NE N 5.745 -3.573 -5.956 1.00 . A A . 27 ARG NE 1 1 6 3976 1 1 23 ARG NH1 N 4.041 -4.724 -4.962 1.00 . A A . 27 ARG NH1 1 1 6 3977 1 1 23 ARG NH2 N 5.662 -5.830 -6.081 1.00 . A A . 27 ARG NH2 1 1 6 3978 1 1 23 ARG O O 6.075 1.776 -2.361 1.00 . A A . 27 ARG O 1 1 6 3979 1 1 24 TYR C C 2.332 2.282 -3.245 1.00 . A A . 28 TYR C 1 1 6 3980 1 1 24 TYR CA C 3.717 2.838 -3.029 1.00 . A A . 28 TYR CA 1 1 6 3981 1 1 24 TYR CB C 3.818 4.361 -3.266 1.00 . A A . 28 TYR CB 1 1 6 3982 1 1 24 TYR CD1 C 2.601 4.103 -5.485 1.00 . A A . 28 TYR CD1 1 1 6 3983 1 1 24 TYR CD2 C 2.333 6.162 -4.235 1.00 . A A . 28 TYR CD2 1 1 6 3984 1 1 24 TYR CE1 C 1.788 4.616 -6.497 1.00 . A A . 28 TYR CE1 1 1 6 3985 1 1 24 TYR CE2 C 1.509 6.664 -5.244 1.00 . A A . 28 TYR CE2 1 1 6 3986 1 1 24 TYR CG C 2.880 4.873 -4.350 1.00 . A A . 28 TYR CG 1 1 6 3987 1 1 24 TYR CZ C 1.242 5.894 -6.377 1.00 . A A . 28 TYR CZ 1 1 6 3988 1 1 24 TYR H H 4.393 2.038 -4.909 1.00 . A A . 28 TYR H 1 1 6 3989 1 1 24 TYR HA H 4.022 2.613 -2.016 1.00 . A A . 28 TYR HA 1 1 6 3990 1 1 24 TYR HB2 H 3.586 4.870 -2.343 1.00 . A A . 28 TYR HB2 1 1 6 3991 1 1 24 TYR HB3 H 4.830 4.599 -3.546 1.00 . A A . 28 TYR HB3 1 1 6 3992 1 1 24 TYR HD1 H 3.000 3.115 -5.573 1.00 . A A . 28 TYR HD1 1 1 6 3993 1 1 24 TYR HD2 H 2.531 6.761 -3.359 1.00 . A A . 28 TYR HD2 1 1 6 3994 1 1 24 TYR HE1 H 1.576 4.021 -7.368 1.00 . A A . 28 TYR HE1 1 1 6 3995 1 1 24 TYR HE2 H 1.084 7.650 -5.151 1.00 . A A . 28 TYR HE2 1 1 6 3996 1 1 24 TYR HH H 0.761 7.291 -7.581 1.00 . A A . 28 TYR HH 1 1 6 3997 1 1 24 TYR N N 4.643 2.167 -3.971 1.00 . A A . 28 TYR N 1 1 6 3998 1 1 24 TYR O O 2.078 1.549 -4.180 1.00 . A A . 28 TYR O 1 1 6 3999 1 1 24 TYR OH O 0.456 6.402 -7.386 1.00 . A A . 28 TYR OH 1 1 6 4000 1 1 25 PHE C C -0.904 3.175 -2.538 1.00 . A A . 29 PHE C 1 1 6 4001 1 1 25 PHE CA C 0.093 2.036 -2.481 1.00 . A A . 29 PHE CA 1 1 6 4002 1 1 25 PHE CB C -0.044 1.134 -1.256 1.00 . A A . 29 PHE CB 1 1 6 4003 1 1 25 PHE CD1 C 2.345 0.276 -1.153 1.00 . A A . 29 PHE CD1 1 1 6 4004 1 1 25 PHE CD2 C 0.587 -1.230 -1.866 1.00 . A A . 29 PHE CD2 1 1 6 4005 1 1 25 PHE CE1 C 3.292 -0.734 -1.357 1.00 . A A . 29 PHE CE1 1 1 6 4006 1 1 25 PHE CE2 C 1.536 -2.242 -2.061 1.00 . A A . 29 PHE CE2 1 1 6 4007 1 1 25 PHE CG C 0.985 0.029 -1.409 1.00 . A A . 29 PHE CG 1 1 6 4008 1 1 25 PHE CZ C 2.887 -1.992 -1.811 1.00 . A A . 29 PHE CZ 1 1 6 4009 1 1 25 PHE H H 1.696 3.158 -1.609 1.00 . A A . 29 PHE H 1 1 6 4010 1 1 25 PHE HA H 0.017 1.441 -3.378 1.00 . A A . 29 PHE HA 1 1 6 4011 1 1 25 PHE HB2 H 0.145 1.700 -0.355 1.00 . A A . 29 PHE HB2 1 1 6 4012 1 1 25 PHE HB3 H -1.036 0.710 -1.222 1.00 . A A . 29 PHE HB3 1 1 6 4013 1 1 25 PHE HD1 H 2.663 1.248 -0.801 1.00 . A A . 29 PHE HD1 1 1 6 4014 1 1 25 PHE HD2 H -0.454 -1.423 -2.062 1.00 . A A . 29 PHE HD2 1 1 6 4015 1 1 25 PHE HE1 H 4.336 -0.542 -1.167 1.00 . A A . 29 PHE HE1 1 1 6 4016 1 1 25 PHE HE2 H 1.223 -3.213 -2.419 1.00 . A A . 29 PHE HE2 1 1 6 4017 1 1 25 PHE HZ H 3.618 -2.770 -1.976 1.00 . A A . 29 PHE HZ 1 1 6 4018 1 1 25 PHE N N 1.452 2.586 -2.365 1.00 . A A . 29 PHE N 1 1 6 4019 1 1 25 PHE O O -1.162 3.867 -1.569 1.00 . A A . 29 PHE O 1 1 6 4020 1 1 26 LEU C C -3.767 4.091 -3.414 1.00 . A A . 30 LEU C 1 1 6 4021 1 1 26 LEU CA C -2.389 4.480 -3.952 1.00 . A A . 30 LEU CA 1 1 6 4022 1 1 26 LEU CB C -2.380 4.613 -5.482 1.00 . A A . 30 LEU CB 1 1 6 4023 1 1 26 LEU CD1 C -1.411 6.927 -5.202 1.00 . A A . 30 LEU CD1 1 1 6 4024 1 1 26 LEU CD2 C -2.155 6.128 -7.430 1.00 . A A . 30 LEU CD2 1 1 6 4025 1 1 26 LEU CG C -2.448 6.076 -5.934 1.00 . A A . 30 LEU CG 1 1 6 4026 1 1 26 LEU H H -1.153 2.803 -4.462 1.00 . A A . 30 LEU H 1 1 6 4027 1 1 26 LEU HA H -2.050 5.388 -3.489 1.00 . A A . 30 LEU HA 1 1 6 4028 1 1 26 LEU HB2 H -1.471 4.173 -5.865 1.00 . A A . 30 LEU HB2 1 1 6 4029 1 1 26 LEU HB3 H -3.221 4.082 -5.889 1.00 . A A . 30 LEU HB3 1 1 6 4030 1 1 26 LEU HD11 H -1.920 7.656 -4.593 1.00 . A A . 30 LEU HD11 1 1 6 4031 1 1 26 LEU HD12 H -0.787 7.437 -5.922 1.00 . A A . 30 LEU HD12 1 1 6 4032 1 1 26 LEU HD13 H -0.797 6.299 -4.578 1.00 . A A . 30 LEU HD13 1 1 6 4033 1 1 26 LEU HD21 H -1.454 5.343 -7.682 1.00 . A A . 30 LEU HD21 1 1 6 4034 1 1 26 LEU HD22 H -1.721 7.085 -7.675 1.00 . A A . 30 LEU HD22 1 1 6 4035 1 1 26 LEU HD23 H -3.068 5.989 -7.982 1.00 . A A . 30 LEU HD23 1 1 6 4036 1 1 26 LEU HG H -3.431 6.468 -5.745 1.00 . A A . 30 LEU HG 1 1 6 4037 1 1 26 LEU N N -1.424 3.381 -3.712 1.00 . A A . 30 LEU N 1 1 6 4038 1 1 26 LEU O O -4.410 3.182 -3.908 1.00 . A A . 30 LEU O 1 1 6 4039 1 1 27 ASN C C -6.620 5.309 -2.460 1.00 . A A . 31 ASN C 1 1 6 4040 1 1 27 ASN CA C -5.533 4.465 -1.793 1.00 . A A . 31 ASN CA 1 1 6 4041 1 1 27 ASN CB C -5.390 4.847 -0.319 1.00 . A A . 31 ASN CB 1 1 6 4042 1 1 27 ASN CG C -6.675 4.515 0.428 1.00 . A A . 31 ASN CG 1 1 6 4043 1 1 27 ASN H H -3.659 5.492 -2.018 1.00 . A A . 31 ASN H 1 1 6 4044 1 1 27 ASN HA H -5.758 3.415 -1.883 1.00 . A A . 31 ASN HA 1 1 6 4045 1 1 27 ASN HB2 H -4.577 4.292 0.121 1.00 . A A . 31 ASN HB2 1 1 6 4046 1 1 27 ASN HB3 H -5.189 5.905 -0.240 1.00 . A A . 31 ASN HB3 1 1 6 4047 1 1 27 ASN HD21 H -5.741 4.223 2.151 1.00 . A A . 31 ASN HD21 1 1 6 4048 1 1 27 ASN HD22 H -7.418 4.001 2.186 1.00 . A A . 31 ASN HD22 1 1 6 4049 1 1 27 ASN N N -4.208 4.774 -2.395 1.00 . A A . 31 ASN N 1 1 6 4050 1 1 27 ASN ND2 N -6.607 4.224 1.694 1.00 . A A . 31 ASN ND2 1 1 6 4051 1 1 27 ASN O O -6.710 6.504 -2.242 1.00 . A A . 31 ASN O 1 1 6 4052 1 1 27 ASN OD1 O -7.747 4.522 -0.142 1.00 . A A . 31 ASN OD1 1 1 6 4053 1 1 28 HIS C C -9.746 5.606 -3.037 1.00 . A A . 32 HIS C 1 1 6 4054 1 1 28 HIS CA C -8.528 5.450 -3.959 1.00 . A A . 32 HIS CA 1 1 6 4055 1 1 28 HIS CB C -8.886 4.600 -5.178 1.00 . A A . 32 HIS CB 1 1 6 4056 1 1 28 HIS CD2 C -7.468 5.118 -7.328 1.00 . A A . 32 HIS CD2 1 1 6 4057 1 1 28 HIS CE1 C -8.579 6.841 -8.031 1.00 . A A . 32 HIS CE1 1 1 6 4058 1 1 28 HIS CG C -8.488 5.327 -6.433 1.00 . A A . 32 HIS CG 1 1 6 4059 1 1 28 HIS H H -7.342 3.732 -3.427 1.00 . A A . 32 HIS H 1 1 6 4060 1 1 28 HIS HA H -8.170 6.416 -4.277 1.00 . A A . 32 HIS HA 1 1 6 4061 1 1 28 HIS HB2 H -8.362 3.657 -5.126 1.00 . A A . 32 HIS HB2 1 1 6 4062 1 1 28 HIS HB3 H -9.951 4.419 -5.190 1.00 . A A . 32 HIS HB3 1 1 6 4063 1 1 28 HIS HD1 H -9.972 6.837 -6.484 1.00 . A A . 32 HIS HD1 1 1 6 4064 1 1 28 HIS HD2 H -6.731 4.332 -7.262 1.00 . A A . 32 HIS HD2 1 1 6 4065 1 1 28 HIS HE1 H -8.905 7.687 -8.618 1.00 . A A . 32 HIS HE1 1 1 6 4066 1 1 28 HIS N N -7.440 4.694 -3.271 1.00 . A A . 32 HIS N 1 1 6 4067 1 1 28 HIS ND1 N -9.183 6.430 -6.901 1.00 . A A . 32 HIS ND1 1 1 6 4068 1 1 28 HIS NE2 N -7.529 6.076 -8.337 1.00 . A A . 32 HIS NE2 1 1 6 4069 1 1 28 HIS O O -10.720 6.239 -3.392 1.00 . A A . 32 HIS O 1 1 6 4070 1 1 29 ILE C C -10.642 6.442 -0.084 1.00 . A A . 33 ILE C 1 1 6 4071 1 1 29 ILE CA C -10.858 5.190 -0.919 1.00 . A A . 33 ILE CA 1 1 6 4072 1 1 29 ILE CB C -10.889 3.951 0.010 1.00 . A A . 33 ILE CB 1 1 6 4073 1 1 29 ILE CD1 C -10.469 1.459 0.166 1.00 . A A . 33 ILE CD1 1 1 6 4074 1 1 29 ILE CG1 C -10.194 2.735 -0.641 1.00 . A A . 33 ILE CG1 1 1 6 4075 1 1 29 ILE CG2 C -12.354 3.610 0.310 1.00 . A A . 33 ILE CG2 1 1 6 4076 1 1 29 ILE H H -8.901 4.556 -1.577 1.00 . A A . 33 ILE H 1 1 6 4077 1 1 29 ILE HA H -11.781 5.264 -1.474 1.00 . A A . 33 ILE HA 1 1 6 4078 1 1 29 ILE HB H -10.389 4.196 0.937 1.00 . A A . 33 ILE HB 1 1 6 4079 1 1 29 ILE HD11 H -11.224 0.871 -0.336 1.00 . A A . 33 ILE HD11 1 1 6 4080 1 1 29 ILE HD12 H -10.817 1.724 1.154 1.00 . A A . 33 ILE HD12 1 1 6 4081 1 1 29 ILE HD13 H -9.560 0.882 0.248 1.00 . A A . 33 ILE HD13 1 1 6 4082 1 1 29 ILE HG12 H -10.558 2.613 -1.647 1.00 . A A . 33 ILE HG12 1 1 6 4083 1 1 29 ILE HG13 H -9.128 2.911 -0.663 1.00 . A A . 33 ILE HG13 1 1 6 4084 1 1 29 ILE HG21 H -12.432 3.214 1.311 1.00 . A A . 33 ILE HG21 1 1 6 4085 1 1 29 ILE HG22 H -12.704 2.873 -0.397 1.00 . A A . 33 ILE HG22 1 1 6 4086 1 1 29 ILE HG23 H -12.956 4.503 0.228 1.00 . A A . 33 ILE HG23 1 1 6 4087 1 1 29 ILE N N -9.698 5.049 -1.855 1.00 . A A . 33 ILE N 1 1 6 4088 1 1 29 ILE O O -11.400 7.389 -0.140 1.00 . A A . 33 ILE O 1 1 6 4089 1 1 30 ASP C C -8.373 8.609 0.756 1.00 . A A . 34 ASP C 1 1 6 4090 1 1 30 ASP CA C -9.287 7.641 1.522 1.00 . A A . 34 ASP CA 1 1 6 4091 1 1 30 ASP CB C -8.568 7.086 2.752 1.00 . A A . 34 ASP CB 1 1 6 4092 1 1 30 ASP CG C -9.602 6.605 3.773 1.00 . A A . 34 ASP CG 1 1 6 4093 1 1 30 ASP H H -8.993 5.668 0.694 1.00 . A A . 34 ASP H 1 1 6 4094 1 1 30 ASP HA H -10.198 8.137 1.819 1.00 . A A . 34 ASP HA 1 1 6 4095 1 1 30 ASP HB2 H -7.940 6.258 2.460 1.00 . A A . 34 ASP HB2 1 1 6 4096 1 1 30 ASP HB3 H -7.961 7.861 3.195 1.00 . A A . 34 ASP HB3 1 1 6 4097 1 1 30 ASP N N -9.591 6.449 0.683 1.00 . A A . 34 ASP N 1 1 6 4098 1 1 30 ASP O O -7.841 9.546 1.316 1.00 . A A . 34 ASP O 1 1 6 4099 1 1 30 ASP OD1 O -10.694 7.149 3.783 1.00 . A A . 34 ASP OD1 1 1 6 4100 1 1 30 ASP OD2 O -9.285 5.700 4.527 1.00 . A A . 34 ASP OD2 1 1 6 4101 1 1 31 GLN C C -5.962 9.487 -0.617 1.00 . A A . 35 GLN C 1 1 6 4102 1 1 31 GLN CA C -7.306 9.293 -1.321 1.00 . A A . 35 GLN CA 1 1 6 4103 1 1 31 GLN CB C -8.065 10.618 -1.398 1.00 . A A . 35 GLN CB 1 1 6 4104 1 1 31 GLN CD C -10.509 10.523 -0.886 1.00 . A A . 35 GLN CD 1 1 6 4105 1 1 31 GLN CG C -9.459 10.375 -1.986 1.00 . A A . 35 GLN CG 1 1 6 4106 1 1 31 GLN H H -8.620 7.628 -0.959 1.00 . A A . 35 GLN H 1 1 6 4107 1 1 31 GLN HA H -7.158 8.896 -2.312 1.00 . A A . 35 GLN HA 1 1 6 4108 1 1 31 GLN HB2 H -8.162 11.036 -0.407 1.00 . A A . 35 GLN HB2 1 1 6 4109 1 1 31 GLN HB3 H -7.524 11.307 -2.030 1.00 . A A . 35 GLN HB3 1 1 6 4110 1 1 31 GLN HE21 H -11.746 9.195 -1.692 1.00 . A A . 35 GLN HE21 1 1 6 4111 1 1 31 GLN HE22 H -12.284 9.902 -0.245 1.00 . A A . 35 GLN HE22 1 1 6 4112 1 1 31 GLN HG2 H -9.649 11.097 -2.766 1.00 . A A . 35 GLN HG2 1 1 6 4113 1 1 31 GLN HG3 H -9.505 9.379 -2.399 1.00 . A A . 35 GLN HG3 1 1 6 4114 1 1 31 GLN N N -8.186 8.388 -0.523 1.00 . A A . 35 GLN N 1 1 6 4115 1 1 31 GLN NE2 N -11.603 9.814 -0.946 1.00 . A A . 35 GLN NE2 1 1 6 4116 1 1 31 GLN O O -5.707 10.515 -0.019 1.00 . A A . 35 GLN O 1 1 6 4117 1 1 31 GLN OE1 O -10.333 11.291 0.040 1.00 . A A . 35 GLN OE1 1 1 6 4118 1 1 32 THR C C -2.746 7.689 -0.596 1.00 . A A . 36 THR C 1 1 6 4119 1 1 32 THR CA C -3.772 8.657 0.001 1.00 . A A . 36 THR CA 1 1 6 4120 1 1 32 THR CB C -4.040 8.316 1.466 1.00 . A A . 36 THR CB 1 1 6 4121 1 1 32 THR CG2 C -4.549 9.559 2.197 1.00 . A A . 36 THR CG2 1 1 6 4122 1 1 32 THR H H -5.319 7.683 -1.163 1.00 . A A . 36 THR H 1 1 6 4123 1 1 32 THR HA H -3.421 9.674 -0.080 1.00 . A A . 36 THR HA 1 1 6 4124 1 1 32 THR HB H -3.126 7.980 1.931 1.00 . A A . 36 THR HB 1 1 6 4125 1 1 32 THR HG1 H -5.874 7.677 1.355 1.00 . A A . 36 THR HG1 1 1 6 4126 1 1 32 THR HG21 H -5.613 9.658 2.042 1.00 . A A . 36 THR HG21 1 1 6 4127 1 1 32 THR HG22 H -4.046 10.434 1.813 1.00 . A A . 36 THR HG22 1 1 6 4128 1 1 32 THR HG23 H -4.347 9.463 3.254 1.00 . A A . 36 THR HG23 1 1 6 4129 1 1 32 THR N N -5.097 8.510 -0.677 1.00 . A A . 36 THR N 1 1 6 4130 1 1 32 THR O O -3.061 6.879 -1.442 1.00 . A A . 36 THR O 1 1 6 4131 1 1 32 THR OG1 O -5.017 7.286 1.540 1.00 . A A . 36 THR OG1 1 1 6 4132 1 1 33 THR C C 0.466 6.390 0.421 1.00 . A A . 37 THR C 1 1 6 4133 1 1 33 THR CA C -0.471 6.849 -0.694 1.00 . A A . 37 THR CA 1 1 6 4134 1 1 33 THR CB C 0.329 7.666 -1.712 1.00 . A A . 37 THR CB 1 1 6 4135 1 1 33 THR CG2 C -0.614 8.352 -2.694 1.00 . A A . 37 THR CG2 1 1 6 4136 1 1 33 THR H H -1.283 8.428 0.530 1.00 . A A . 37 THR H 1 1 6 4137 1 1 33 THR HA H -0.926 6.001 -1.179 1.00 . A A . 37 THR HA 1 1 6 4138 1 1 33 THR HB H 0.991 7.008 -2.257 1.00 . A A . 37 THR HB 1 1 6 4139 1 1 33 THR HG1 H 0.484 9.286 -0.648 1.00 . A A . 37 THR HG1 1 1 6 4140 1 1 33 THR HG21 H -0.780 9.371 -2.383 1.00 . A A . 37 THR HG21 1 1 6 4141 1 1 33 THR HG22 H -1.554 7.824 -2.718 1.00 . A A . 37 THR HG22 1 1 6 4142 1 1 33 THR HG23 H -0.170 8.344 -3.681 1.00 . A A . 37 THR HG23 1 1 6 4143 1 1 33 THR N N -1.517 7.769 -0.156 1.00 . A A . 37 THR N 1 1 6 4144 1 1 33 THR O O 1.084 7.191 1.093 1.00 . A A . 37 THR O 1 1 6 4145 1 1 33 THR OG1 O 1.093 8.648 -1.026 1.00 . A A . 37 THR OG1 1 1 6 4146 1 1 34 THR C C 2.605 3.746 1.001 1.00 . A A . 38 THR C 1 1 6 4147 1 1 34 THR CA C 1.533 4.615 1.659 1.00 . A A . 38 THR CA 1 1 6 4148 1 1 34 THR CB C 0.675 3.797 2.630 1.00 . A A . 38 THR CB 1 1 6 4149 1 1 34 THR CG2 C 0.094 2.582 1.912 1.00 . A A . 38 THR CG2 1 1 6 4150 1 1 34 THR H H 0.111 4.473 0.034 1.00 . A A . 38 THR H 1 1 6 4151 1 1 34 THR HA H 1.989 5.445 2.175 1.00 . A A . 38 THR HA 1 1 6 4152 1 1 34 THR HB H -0.132 4.412 2.999 1.00 . A A . 38 THR HB 1 1 6 4153 1 1 34 THR HG1 H 1.837 4.145 4.150 1.00 . A A . 38 THR HG1 1 1 6 4154 1 1 34 THR HG21 H 0.895 1.921 1.614 1.00 . A A . 38 THR HG21 1 1 6 4155 1 1 34 THR HG22 H -0.447 2.909 1.040 1.00 . A A . 38 THR HG22 1 1 6 4156 1 1 34 THR HG23 H -0.577 2.057 2.577 1.00 . A A . 38 THR HG23 1 1 6 4157 1 1 34 THR N N 0.602 5.111 0.605 1.00 . A A . 38 THR N 1 1 6 4158 1 1 34 THR O O 2.435 3.287 -0.107 1.00 . A A . 38 THR O 1 1 6 4159 1 1 34 THR OG1 O 1.477 3.367 3.720 1.00 . A A . 38 THR OG1 1 1 6 4160 1 1 35 TRP C C 4.628 1.232 1.484 1.00 . A A . 39 TRP C 1 1 6 4161 1 1 35 TRP CA C 4.776 2.686 1.031 1.00 . A A . 39 TRP CA 1 1 6 4162 1 1 35 TRP CB C 6.119 3.261 1.512 1.00 . A A . 39 TRP CB 1 1 6 4163 1 1 35 TRP CD1 C 5.614 5.569 2.419 1.00 . A A . 39 TRP CD1 1 1 6 4164 1 1 35 TRP CD2 C 6.645 5.645 0.420 1.00 . A A . 39 TRP CD2 1 1 6 4165 1 1 35 TRP CE2 C 6.428 6.986 0.822 1.00 . A A . 39 TRP CE2 1 1 6 4166 1 1 35 TRP CE3 C 7.284 5.425 -0.817 1.00 . A A . 39 TRP CE3 1 1 6 4167 1 1 35 TRP CG C 6.119 4.762 1.457 1.00 . A A . 39 TRP CG 1 1 6 4168 1 1 35 TRP CH2 C 7.463 7.824 -1.187 1.00 . A A . 39 TRP CH2 1 1 6 4169 1 1 35 TRP CZ2 C 6.829 8.062 0.033 1.00 . A A . 39 TRP CZ2 1 1 6 4170 1 1 35 TRP CZ3 C 7.689 6.507 -1.612 1.00 . A A . 39 TRP CZ3 1 1 6 4171 1 1 35 TRP H H 3.840 3.907 2.548 1.00 . A A . 39 TRP H 1 1 6 4172 1 1 35 TRP HA H 4.714 2.747 -0.046 1.00 . A A . 39 TRP HA 1 1 6 4173 1 1 35 TRP HB2 H 6.294 2.943 2.530 1.00 . A A . 39 TRP HB2 1 1 6 4174 1 1 35 TRP HB3 H 6.911 2.883 0.883 1.00 . A A . 39 TRP HB3 1 1 6 4175 1 1 35 TRP HD1 H 5.145 5.236 3.334 1.00 . A A . 39 TRP HD1 1 1 6 4176 1 1 35 TRP HE1 H 5.522 7.668 2.565 1.00 . A A . 39 TRP HE1 1 1 6 4177 1 1 35 TRP HE3 H 7.458 4.419 -1.164 1.00 . A A . 39 TRP HE3 1 1 6 4178 1 1 35 TRP HH2 H 7.778 8.651 -1.804 1.00 . A A . 39 TRP HH2 1 1 6 4179 1 1 35 TRP HZ2 H 6.651 9.073 0.368 1.00 . A A . 39 TRP HZ2 1 1 6 4180 1 1 35 TRP HZ3 H 8.182 6.325 -2.554 1.00 . A A . 39 TRP HZ3 1 1 6 4181 1 1 35 TRP N N 3.709 3.524 1.657 1.00 . A A . 39 TRP N 1 1 6 4182 1 1 35 TRP NE1 N 5.797 6.885 2.043 1.00 . A A . 39 TRP NE1 1 1 6 4183 1 1 35 TRP O O 5.076 0.316 0.824 1.00 . A A . 39 TRP O 1 1 6 4184 1 1 36 GLN C C 2.337 -0.768 3.056 1.00 . A A . 40 GLN C 1 1 6 4185 1 1 36 GLN CA C 3.818 -0.382 3.103 1.00 . A A . 40 GLN CA 1 1 6 4186 1 1 36 GLN CB C 4.321 -0.355 4.547 1.00 . A A . 40 GLN CB 1 1 6 4187 1 1 36 GLN CD C 6.510 -0.064 5.715 1.00 . A A . 40 GLN CD 1 1 6 4188 1 1 36 GLN CG C 5.784 -0.800 4.587 1.00 . A A . 40 GLN CG 1 1 6 4189 1 1 36 GLN H H 3.643 1.766 3.123 1.00 . A A . 40 GLN H 1 1 6 4190 1 1 36 GLN HA H 4.407 -1.069 2.519 1.00 . A A . 40 GLN HA 1 1 6 4191 1 1 36 GLN HB2 H 4.239 0.648 4.939 1.00 . A A . 40 GLN HB2 1 1 6 4192 1 1 36 GLN HB3 H 3.725 -1.026 5.148 1.00 . A A . 40 GLN HB3 1 1 6 4193 1 1 36 GLN HE21 H 7.175 1.384 4.530 1.00 . A A . 40 GLN HE21 1 1 6 4194 1 1 36 GLN HE22 H 7.626 1.516 6.161 1.00 . A A . 40 GLN HE22 1 1 6 4195 1 1 36 GLN HG2 H 5.831 -1.864 4.763 1.00 . A A . 40 GLN HG2 1 1 6 4196 1 1 36 GLN HG3 H 6.256 -0.570 3.643 1.00 . A A . 40 GLN HG3 1 1 6 4197 1 1 36 GLN N N 3.998 1.014 2.607 1.00 . A A . 40 GLN N 1 1 6 4198 1 1 36 GLN NE2 N 7.158 1.037 5.446 1.00 . A A . 40 GLN NE2 1 1 6 4199 1 1 36 GLN O O 1.534 -0.111 2.425 1.00 . A A . 40 GLN O 1 1 6 4200 1 1 36 GLN OE1 O 6.488 -0.496 6.850 1.00 . A A . 40 GLN OE1 1 1 6 4201 1 1 37 ASP C C -0.189 -1.683 4.934 1.00 . A A . 41 ASP C 1 1 6 4202 1 1 37 ASP CA C 0.539 -2.255 3.709 1.00 . A A . 41 ASP CA 1 1 6 4203 1 1 37 ASP CB C 0.580 -3.781 3.774 1.00 . A A . 41 ASP CB 1 1 6 4204 1 1 37 ASP CG C 1.153 -4.334 2.467 1.00 . A A . 41 ASP CG 1 1 6 4205 1 1 37 ASP H H 2.632 -2.348 4.222 1.00 . A A . 41 ASP H 1 1 6 4206 1 1 37 ASP HA H 0.062 -1.938 2.797 1.00 . A A . 41 ASP HA 1 1 6 4207 1 1 37 ASP HB2 H 1.205 -4.090 4.600 1.00 . A A . 41 ASP HB2 1 1 6 4208 1 1 37 ASP HB3 H -0.420 -4.162 3.919 1.00 . A A . 41 ASP HB3 1 1 6 4209 1 1 37 ASP N N 1.969 -1.831 3.719 1.00 . A A . 41 ASP N 1 1 6 4210 1 1 37 ASP O O 0.338 -1.712 6.029 1.00 . A A . 41 ASP O 1 1 6 4211 1 1 37 ASP OD1 O 2.097 -3.748 1.965 1.00 . A A . 41 ASP OD1 1 1 6 4212 1 1 37 ASP OD2 O 0.637 -5.331 1.992 1.00 . A A . 41 ASP OD2 1 1 6 4213 1 1 38 PRO C C -2.717 -1.708 6.732 1.00 . A A . 42 PRO C 1 1 6 4214 1 1 38 PRO CA C -2.167 -0.598 5.833 1.00 . A A . 42 PRO CA 1 1 6 4215 1 1 38 PRO CB C -3.301 0.142 5.131 1.00 . A A . 42 PRO CB 1 1 6 4216 1 1 38 PRO CD C -2.100 -1.094 3.436 1.00 . A A . 42 PRO CD 1 1 6 4217 1 1 38 PRO CG C -3.453 -0.544 3.810 1.00 . A A . 42 PRO CG 1 1 6 4218 1 1 38 PRO HA H -1.570 0.096 6.403 1.00 . A A . 42 PRO HA 1 1 6 4219 1 1 38 PRO HB2 H -4.213 0.058 5.703 1.00 . A A . 42 PRO HB2 1 1 6 4220 1 1 38 PRO HB3 H -3.041 1.180 4.988 1.00 . A A . 42 PRO HB3 1 1 6 4221 1 1 38 PRO HD2 H -2.200 -2.075 2.994 1.00 . A A . 42 PRO HD2 1 1 6 4222 1 1 38 PRO HD3 H -1.593 -0.422 2.760 1.00 . A A . 42 PRO HD3 1 1 6 4223 1 1 38 PRO HG2 H -4.168 -1.348 3.892 1.00 . A A . 42 PRO HG2 1 1 6 4224 1 1 38 PRO HG3 H -3.781 0.165 3.063 1.00 . A A . 42 PRO HG3 1 1 6 4225 1 1 38 PRO N N -1.380 -1.177 4.717 1.00 . A A . 42 PRO N 1 1 6 4226 1 1 38 PRO O O -2.530 -1.698 7.933 1.00 . A A . 42 PRO O 1 1 6 4227 1 1 39 ARG C C -2.828 -4.670 7.509 1.00 . A A . 43 ARG C 1 1 6 4228 1 1 39 ARG CA C -3.956 -3.777 6.984 1.00 . A A . 43 ARG CA 1 1 6 4229 1 1 39 ARG CB C -4.859 -4.559 6.029 1.00 . A A . 43 ARG CB 1 1 6 4230 1 1 39 ARG CD C -7.322 -4.706 5.637 1.00 . A A . 43 ARG CD 1 1 6 4231 1 1 39 ARG CG C -6.217 -4.795 6.692 1.00 . A A . 43 ARG CG 1 1 6 4232 1 1 39 ARG CZ C -9.459 -3.525 5.676 1.00 . A A . 43 ARG CZ 1 1 6 4233 1 1 39 ARG H H -3.534 -2.656 5.191 1.00 . A A . 43 ARG H 1 1 6 4234 1 1 39 ARG HA H -4.537 -3.383 7.800 1.00 . A A . 43 ARG HA 1 1 6 4235 1 1 39 ARG HB2 H -4.996 -3.993 5.120 1.00 . A A . 43 ARG HB2 1 1 6 4236 1 1 39 ARG HB3 H -4.400 -5.508 5.798 1.00 . A A . 43 ARG HB3 1 1 6 4237 1 1 39 ARG HD2 H -6.905 -4.440 4.677 1.00 . A A . 43 ARG HD2 1 1 6 4238 1 1 39 ARG HD3 H -7.854 -5.644 5.572 1.00 . A A . 43 ARG HD3 1 1 6 4239 1 1 39 ARG HE H -7.903 -2.984 6.788 1.00 . A A . 43 ARG HE 1 1 6 4240 1 1 39 ARG HG2 H -6.231 -5.775 7.146 1.00 . A A . 43 ARG HG2 1 1 6 4241 1 1 39 ARG HG3 H -6.383 -4.045 7.452 1.00 . A A . 43 ARG HG3 1 1 6 4242 1 1 39 ARG HH11 H -9.349 -5.105 4.437 1.00 . A A . 43 ARG HH11 1 1 6 4243 1 1 39 ARG HH12 H -10.866 -4.276 4.458 1.00 . A A . 43 ARG HH12 1 1 6 4244 1 1 39 ARG HH21 H -9.882 -1.923 6.799 1.00 . A A . 43 ARG HH21 1 1 6 4245 1 1 39 ARG HH22 H -11.168 -2.488 5.784 1.00 . A A . 43 ARG HH22 1 1 6 4246 1 1 39 ARG N N -3.395 -2.666 6.161 1.00 . A A . 43 ARG N 1 1 6 4247 1 1 39 ARG NE N -8.230 -3.626 6.125 1.00 . A A . 43 ARG NE 1 1 6 4248 1 1 39 ARG NH1 N -9.926 -4.369 4.787 1.00 . A A . 43 ARG NH1 1 1 6 4249 1 1 39 ARG NH2 N -10.229 -2.571 6.120 1.00 . A A . 43 ARG NH2 1 1 6 4250 1 1 39 ARG O O -2.323 -5.524 6.808 1.00 . A A . 43 ARG O 1 1 6 4251 1 1 40 LYS C C -0.109 -5.278 8.393 1.00 . A A . 44 LYS C 1 1 6 4252 1 1 40 LYS CA C -1.337 -5.317 9.307 1.00 . A A . 44 LYS CA 1 1 6 4253 1 1 40 LYS CB C -1.914 -6.732 9.370 1.00 . A A . 44 LYS CB 1 1 6 4254 1 1 40 LYS CD C -2.908 -7.314 11.587 1.00 . A A . 44 LYS CD 1 1 6 4255 1 1 40 LYS CE C -3.134 -6.242 12.655 1.00 . A A . 44 LYS CE 1 1 6 4256 1 1 40 LYS CG C -3.196 -6.725 10.205 1.00 . A A . 44 LYS CG 1 1 6 4257 1 1 40 LYS H H -2.853 -3.785 9.286 1.00 . A A . 44 LYS H 1 1 6 4258 1 1 40 LYS HA H -1.081 -4.981 10.299 1.00 . A A . 44 LYS HA 1 1 6 4259 1 1 40 LYS HB2 H -2.139 -7.073 8.369 1.00 . A A . 44 LYS HB2 1 1 6 4260 1 1 40 LYS HB3 H -1.193 -7.396 9.822 1.00 . A A . 44 LYS HB3 1 1 6 4261 1 1 40 LYS HD2 H -3.570 -8.147 11.768 1.00 . A A . 44 LYS HD2 1 1 6 4262 1 1 40 LYS HD3 H -1.882 -7.652 11.628 1.00 . A A . 44 LYS HD3 1 1 6 4263 1 1 40 LYS HE2 H -2.482 -6.408 13.499 1.00 . A A . 44 LYS HE2 1 1 6 4264 1 1 40 LYS HE3 H -2.972 -5.257 12.240 1.00 . A A . 44 LYS HE3 1 1 6 4265 1 1 40 LYS HG2 H -3.550 -5.710 10.312 1.00 . A A . 44 LYS HG2 1 1 6 4266 1 1 40 LYS HG3 H -3.952 -7.318 9.710 1.00 . A A . 44 LYS HG3 1 1 6 4267 1 1 40 LYS HZ1 H -4.784 -7.415 13.142 1.00 . A A . 44 LYS HZ1 1 1 6 4268 1 1 40 LYS HZ2 H -5.176 -5.966 12.348 1.00 . A A . 44 LYS HZ2 1 1 6 4269 1 1 40 LYS HZ3 H -4.711 -5.943 13.982 1.00 . A A . 44 LYS HZ3 1 1 6 4270 1 1 40 LYS N N -2.431 -4.479 8.738 1.00 . A A . 44 LYS N 1 1 6 4271 1 1 40 LYS NZ N -4.559 -6.403 13.062 1.00 . A A . 44 LYS NZ 1 1 6 4272 1 1 40 LYS O O -0.044 -6.090 7.485 1.00 . A A . 44 LYS O 1 1 6 4273 1 1 40 LYS OXT O 0.745 -4.437 8.618 1.00 . A A . 44 LYS OXT 1 1 6 4274 2 2 1 ACE C C 7.129 12.403 4.400 1.00 . B B . 45 ACE C 1 1 6 4275 2 2 1 ACE CH3 C 6.079 12.093 5.468 1.00 . B B . 45 ACE CH3 1 1 6 4276 2 2 1 ACE H1 H 5.130 12.514 5.173 1.00 . B B . 45 ACE H1 1 1 6 4277 2 2 1 ACE H2 H 6.386 12.522 6.411 1.00 . B B . 45 ACE H2 1 1 6 4278 2 2 1 ACE H3 H 5.980 11.022 5.575 1.00 . B B . 45 ACE H3 1 1 6 4279 2 2 1 ACE O O 7.087 13.442 3.771 1.00 . B B . 45 ACE O 1 1 6 4280 2 2 2 PRO C C 6.757 10.208 2.521 1.00 . B B . 46 PRO C 1 1 6 4281 2 2 2 PRO CA C 8.123 10.775 2.919 1.00 . B B . 46 PRO CA 1 1 6 4282 2 2 2 PRO CB C 9.120 9.650 3.174 1.00 . B B . 46 PRO CB 1 1 6 4283 2 2 2 PRO CD C 8.670 10.700 5.300 1.00 . B B . 46 PRO CD 1 1 6 4284 2 2 2 PRO CG C 9.051 9.398 4.644 1.00 . B B . 46 PRO CG 1 1 6 4285 2 2 2 PRO HA H 8.500 11.436 2.155 1.00 . B B . 46 PRO HA 1 1 6 4286 2 2 2 PRO HB2 H 8.833 8.763 2.624 1.00 . B B . 46 PRO HB2 1 1 6 4287 2 2 2 PRO HB3 H 10.117 9.959 2.899 1.00 . B B . 46 PRO HB3 1 1 6 4288 2 2 2 PRO HD2 H 7.972 10.526 6.106 1.00 . B B . 46 PRO HD2 1 1 6 4289 2 2 2 PRO HD3 H 9.547 11.213 5.660 1.00 . B B . 46 PRO HD3 1 1 6 4290 2 2 2 PRO HG2 H 8.304 8.645 4.853 1.00 . B B . 46 PRO HG2 1 1 6 4291 2 2 2 PRO HG3 H 10.013 9.077 5.010 1.00 . B B . 46 PRO HG3 1 1 6 4292 2 2 2 PRO N N 8.036 11.481 4.226 1.00 . B B . 46 PRO N 1 1 6 4293 2 2 2 PRO O O 6.346 9.165 2.991 1.00 . B B . 46 PRO O 1 1 6 4294 2 2 3 LEU C C 4.139 11.287 0.125 1.00 . B B . 47 LEU C 1 1 6 4295 2 2 3 LEU CA C 4.712 10.386 1.232 1.00 . B B . 47 LEU CA 1 1 6 4296 2 2 3 LEU CB C 3.844 10.467 2.488 1.00 . B B . 47 LEU CB 1 1 6 4297 2 2 3 LEU CD1 C 2.210 8.656 3.030 1.00 . B B . 47 LEU CD1 1 1 6 4298 2 2 3 LEU CD2 C 1.396 10.962 2.521 1.00 . B B . 47 LEU CD2 1 1 6 4299 2 2 3 LEU CG C 2.453 9.909 2.184 1.00 . B B . 47 LEU CG 1 1 6 4300 2 2 3 LEU H H 6.400 11.725 1.291 1.00 . B B . 47 LEU H 1 1 6 4301 2 2 3 LEU HA H 4.782 9.364 0.900 1.00 . B B . 47 LEU HA 1 1 6 4302 2 2 3 LEU HB2 H 4.300 9.888 3.278 1.00 . B B . 47 LEU HB2 1 1 6 4303 2 2 3 LEU HB3 H 3.758 11.497 2.802 1.00 . B B . 47 LEU HB3 1 1 6 4304 2 2 3 LEU HD11 H 2.808 7.842 2.647 1.00 . B B . 47 LEU HD11 1 1 6 4305 2 2 3 LEU HD12 H 1.166 8.387 2.985 1.00 . B B . 47 LEU HD12 1 1 6 4306 2 2 3 LEU HD13 H 2.487 8.855 4.054 1.00 . B B . 47 LEU HD13 1 1 6 4307 2 2 3 LEU HD21 H 0.581 10.497 3.056 1.00 . B B . 47 LEU HD21 1 1 6 4308 2 2 3 LEU HD22 H 1.022 11.401 1.607 1.00 . B B . 47 LEU HD22 1 1 6 4309 2 2 3 LEU HD23 H 1.838 11.733 3.136 1.00 . B B . 47 LEU HD23 1 1 6 4310 2 2 3 LEU HG H 2.387 9.655 1.138 1.00 . B B . 47 LEU HG 1 1 6 4311 2 2 3 LEU N N 6.050 10.886 1.658 1.00 . B B . 47 LEU N 1 1 6 4312 2 2 3 LEU O O 3.945 12.467 0.339 1.00 . B B . 47 LEU O 1 1 6 4313 2 2 4 PRO C C 1.861 11.841 -1.899 1.00 . B B . 48 PRO C 1 1 6 4314 2 2 4 PRO CA C 3.334 11.496 -2.158 1.00 . B B . 48 PRO CA 1 1 6 4315 2 2 4 PRO CB C 3.471 10.556 -3.352 1.00 . B B . 48 PRO CB 1 1 6 4316 2 2 4 PRO CD C 4.085 9.295 -1.385 1.00 . B B . 48 PRO CD 1 1 6 4317 2 2 4 PRO CG C 3.486 9.181 -2.763 1.00 . B B . 48 PRO CG 1 1 6 4318 2 2 4 PRO HA H 3.914 12.389 -2.320 1.00 . B B . 48 PRO HA 1 1 6 4319 2 2 4 PRO HB2 H 2.628 10.670 -4.017 1.00 . B B . 48 PRO HB2 1 1 6 4320 2 2 4 PRO HB3 H 4.393 10.749 -3.877 1.00 . B B . 48 PRO HB3 1 1 6 4321 2 2 4 PRO HD2 H 3.565 8.652 -0.691 1.00 . B B . 48 PRO HD2 1 1 6 4322 2 2 4 PRO HD3 H 5.138 9.056 -1.410 1.00 . B B . 48 PRO HD3 1 1 6 4323 2 2 4 PRO HG2 H 2.478 8.799 -2.697 1.00 . B B . 48 PRO HG2 1 1 6 4324 2 2 4 PRO HG3 H 4.088 8.525 -3.372 1.00 . B B . 48 PRO HG3 1 1 6 4325 2 2 4 PRO N N 3.887 10.708 -1.027 1.00 . B B . 48 PRO N 1 1 6 4326 2 2 4 PRO O O 1.138 11.058 -1.316 1.00 . B B . 48 PRO O 1 1 6 4327 2 2 5 PRO C C -0.880 12.663 -3.077 1.00 . B B . 49 PRO C 1 1 6 4328 2 2 5 PRO CA C 0.055 13.446 -2.152 1.00 . B B . 49 PRO CA 1 1 6 4329 2 2 5 PRO CB C 0.083 14.923 -2.535 1.00 . B B . 49 PRO CB 1 1 6 4330 2 2 5 PRO CD C 2.258 14.015 -3.058 1.00 . B B . 49 PRO CD 1 1 6 4331 2 2 5 PRO CG C 1.251 15.061 -3.460 1.00 . B B . 49 PRO CG 1 1 6 4332 2 2 5 PRO HA H -0.242 13.336 -1.122 1.00 . B B . 49 PRO HA 1 1 6 4333 2 2 5 PRO HB2 H -0.831 15.197 -3.040 1.00 . B B . 49 PRO HB2 1 1 6 4334 2 2 5 PRO HB3 H 0.227 15.535 -1.656 1.00 . B B . 49 PRO HB3 1 1 6 4335 2 2 5 PRO HD2 H 2.723 13.582 -3.931 1.00 . B B . 49 PRO HD2 1 1 6 4336 2 2 5 PRO HD3 H 3.004 14.442 -2.403 1.00 . B B . 49 PRO HD3 1 1 6 4337 2 2 5 PRO HG2 H 0.934 14.895 -4.479 1.00 . B B . 49 PRO HG2 1 1 6 4338 2 2 5 PRO HG3 H 1.682 16.046 -3.364 1.00 . B B . 49 PRO HG3 1 1 6 4339 2 2 5 PRO N N 1.460 13.007 -2.345 1.00 . B B . 49 PRO N 1 1 6 4340 2 2 5 PRO O O -0.495 11.680 -3.677 1.00 . B B . 49 PRO O 1 1 6 4341 2 2 6 TYR C C -4.274 13.260 -4.388 1.00 . B B . 50 TYR C 1 1 6 4342 2 2 6 TYR CA C -3.067 12.369 -4.081 1.00 . B B . 50 TYR CA 1 1 6 4343 2 2 6 TYR CB C -3.498 11.138 -3.281 1.00 . B B . 50 TYR CB 1 1 6 4344 2 2 6 TYR CD1 C -3.628 9.570 -5.250 1.00 . B B . 50 TYR CD1 1 1 6 4345 2 2 6 TYR CD2 C -5.630 9.964 -3.937 1.00 . B B . 50 TYR CD2 1 1 6 4346 2 2 6 TYR CE1 C -4.345 8.702 -6.082 1.00 . B B . 50 TYR CE1 1 1 6 4347 2 2 6 TYR CE2 C -6.346 9.095 -4.770 1.00 . B B . 50 TYR CE2 1 1 6 4348 2 2 6 TYR CG C -4.271 10.201 -4.178 1.00 . B B . 50 TYR CG 1 1 6 4349 2 2 6 TYR CZ C -5.703 8.464 -5.842 1.00 . B B . 50 TYR CZ 1 1 6 4350 2 2 6 TYR H H -2.400 13.885 -2.701 1.00 . B B . 50 TYR H 1 1 6 4351 2 2 6 TYR HA H -2.581 12.063 -4.993 1.00 . B B . 50 TYR HA 1 1 6 4352 2 2 6 TYR HB2 H -2.623 10.633 -2.899 1.00 . B B . 50 TYR HB2 1 1 6 4353 2 2 6 TYR HB3 H -4.125 11.445 -2.458 1.00 . B B . 50 TYR HB3 1 1 6 4354 2 2 6 TYR HD1 H -2.580 9.753 -5.435 1.00 . B B . 50 TYR HD1 1 1 6 4355 2 2 6 TYR HD2 H -6.125 10.451 -3.111 1.00 . B B . 50 TYR HD2 1 1 6 4356 2 2 6 TYR HE1 H -3.850 8.214 -6.909 1.00 . B B . 50 TYR HE1 1 1 6 4357 2 2 6 TYR HE2 H -7.394 8.912 -4.584 1.00 . B B . 50 TYR HE2 1 1 6 4358 2 2 6 TYR HH H -5.790 6.978 -7.037 1.00 . B B . 50 TYR HH 1 1 6 4359 2 2 6 TYR N N -2.108 13.090 -3.195 1.00 . B B . 50 TYR N 1 1 6 4360 2 2 6 TYR O O -4.872 13.070 -5.434 1.00 . B B . 50 TYR O 1 1 6 4361 2 2 6 TYR OXT O -4.578 14.113 -3.573 1.00 . B B . 50 TYR OXT 1 1 6 4362 2 2 6 TYR OH O -6.409 7.607 -6.661 1.00 . B B . 50 TYR OH 1 1 7 4363 1 1 1 PHE C C -6.331 -10.803 15.859 1.00 . A A . 5 PHE C 1 1 7 4364 1 1 1 PHE CA C -7.568 -10.350 16.640 1.00 . A A . 5 PHE CA 1 1 7 4365 1 1 1 PHE CB C -8.271 -9.204 15.912 1.00 . A A . 5 PHE CB 1 1 7 4366 1 1 1 PHE CD1 C -6.355 -8.072 14.730 1.00 . A A . 5 PHE CD1 1 1 7 4367 1 1 1 PHE CD2 C -7.386 -6.952 16.618 1.00 . A A . 5 PHE CD2 1 1 7 4368 1 1 1 PHE CE1 C -5.467 -7.001 14.579 1.00 . A A . 5 PHE CE1 1 1 7 4369 1 1 1 PHE CE2 C -6.497 -5.880 16.467 1.00 . A A . 5 PHE CE2 1 1 7 4370 1 1 1 PHE CG C -7.314 -8.047 15.750 1.00 . A A . 5 PHE CG 1 1 7 4371 1 1 1 PHE CZ C -5.538 -5.904 15.447 1.00 . A A . 5 PHE CZ 1 1 7 4372 1 1 1 PHE HA H -8.251 -11.174 16.776 1.00 . A A . 5 PHE HA 1 1 7 4373 1 1 1 PHE HB2 H -8.598 -9.541 14.940 1.00 . A A . 5 PHE HB2 1 1 7 4374 1 1 1 PHE HB3 H -9.126 -8.882 16.488 1.00 . A A . 5 PHE HB3 1 1 7 4375 1 1 1 PHE HD1 H -6.299 -8.917 14.060 1.00 . A A . 5 PHE HD1 1 1 7 4376 1 1 1 PHE HD2 H -8.125 -6.934 17.405 1.00 . A A . 5 PHE HD2 1 1 7 4377 1 1 1 PHE HE1 H -4.727 -7.018 13.793 1.00 . A A . 5 PHE HE1 1 1 7 4378 1 1 1 PHE HE2 H -6.552 -5.035 17.137 1.00 . A A . 5 PHE HE2 1 1 7 4379 1 1 1 PHE HZ H -4.853 -5.077 15.331 1.00 . A A . 5 PHE HZ 1 1 7 4380 1 1 1 PHE N N -7.165 -9.782 17.959 1.00 . A A . 5 PHE N 1 1 7 4381 1 1 1 PHE O O -5.278 -10.202 15.943 1.00 . A A . 5 PHE O 1 1 7 4382 1 1 2 GLU C C -5.561 -12.225 12.816 1.00 . A A . 6 GLU C 1 1 7 4383 1 1 2 GLU CA C -5.280 -12.348 14.316 1.00 . A A . 6 GLU CA 1 1 7 4384 1 1 2 GLU CB C -5.122 -13.816 14.714 1.00 . A A . 6 GLU CB 1 1 7 4385 1 1 2 GLU CD C -3.978 -15.362 16.308 1.00 . A A . 6 GLU CD 1 1 7 4386 1 1 2 GLU CG C -4.367 -13.907 16.041 1.00 . A A . 6 GLU CG 1 1 7 4387 1 1 2 GLU H H -7.307 -12.329 15.049 1.00 . A A . 6 GLU H 1 1 7 4388 1 1 2 GLU HA H -4.391 -11.798 14.581 1.00 . A A . 6 GLU HA 1 1 7 4389 1 1 2 GLU HB2 H -6.099 -14.266 14.824 1.00 . A A . 6 GLU HB2 1 1 7 4390 1 1 2 GLU HB3 H -4.570 -14.339 13.948 1.00 . A A . 6 GLU HB3 1 1 7 4391 1 1 2 GLU HG2 H -3.476 -13.300 15.989 1.00 . A A . 6 GLU HG2 1 1 7 4392 1 1 2 GLU HG3 H -4.999 -13.552 16.841 1.00 . A A . 6 GLU HG3 1 1 7 4393 1 1 2 GLU N N -6.449 -11.859 15.102 1.00 . A A . 6 GLU N 1 1 7 4394 1 1 2 GLU O O -6.693 -12.291 12.380 1.00 . A A . 6 GLU O 1 1 7 4395 1 1 2 GLU OE1 O -4.870 -16.195 16.354 1.00 . A A . 6 GLU OE1 1 1 7 4396 1 1 2 GLU OE2 O -2.796 -15.622 16.461 1.00 . A A . 6 GLU OE2 1 1 7 4397 1 1 3 ILE C C -3.803 -12.865 9.801 1.00 . A A . 7 ILE C 1 1 7 4398 1 1 3 ILE CA C -4.748 -11.921 10.554 1.00 . A A . 7 ILE CA 1 1 7 4399 1 1 3 ILE CB C -4.421 -10.464 10.231 1.00 . A A . 7 ILE CB 1 1 7 4400 1 1 3 ILE CD1 C -2.597 -8.757 10.179 1.00 . A A . 7 ILE CD1 1 1 7 4401 1 1 3 ILE CG1 C -2.981 -10.161 10.650 1.00 . A A . 7 ILE CG1 1 1 7 4402 1 1 3 ILE CG2 C -5.376 -9.544 10.994 1.00 . A A . 7 ILE CG2 1 1 7 4403 1 1 3 ILE H H -3.634 -11.998 12.397 1.00 . A A . 7 ILE H 1 1 7 4404 1 1 3 ILE HA H -5.776 -12.133 10.301 1.00 . A A . 7 ILE HA 1 1 7 4405 1 1 3 ILE HB H -4.532 -10.297 9.170 1.00 . A A . 7 ILE HB 1 1 7 4406 1 1 3 ILE HD11 H -2.721 -8.689 9.108 1.00 . A A . 7 ILE HD11 1 1 7 4407 1 1 3 ILE HD12 H -1.567 -8.560 10.435 1.00 . A A . 7 ILE HD12 1 1 7 4408 1 1 3 ILE HD13 H -3.233 -8.030 10.661 1.00 . A A . 7 ILE HD13 1 1 7 4409 1 1 3 ILE HG12 H -2.898 -10.214 11.725 1.00 . A A . 7 ILE HG12 1 1 7 4410 1 1 3 ILE HG13 H -2.316 -10.885 10.202 1.00 . A A . 7 ILE HG13 1 1 7 4411 1 1 3 ILE HG21 H -6.200 -10.124 11.384 1.00 . A A . 7 ILE HG21 1 1 7 4412 1 1 3 ILE HG22 H -5.755 -8.783 10.327 1.00 . A A . 7 ILE HG22 1 1 7 4413 1 1 3 ILE HG23 H -4.849 -9.074 11.811 1.00 . A A . 7 ILE HG23 1 1 7 4414 1 1 3 ILE N N -4.539 -12.047 12.026 1.00 . A A . 7 ILE N 1 1 7 4415 1 1 3 ILE O O -2.680 -13.071 10.218 1.00 . A A . 7 ILE O 1 1 7 4416 1 1 4 PRO C C -2.364 -13.567 7.154 1.00 . A A . 8 PRO C 1 1 7 4417 1 1 4 PRO CA C -3.456 -14.338 7.902 1.00 . A A . 8 PRO CA 1 1 7 4418 1 1 4 PRO CB C -4.452 -14.954 6.925 1.00 . A A . 8 PRO CB 1 1 7 4419 1 1 4 PRO CD C -5.622 -13.220 8.129 1.00 . A A . 8 PRO CD 1 1 7 4420 1 1 4 PRO CG C -5.554 -13.949 6.813 1.00 . A A . 8 PRO CG 1 1 7 4421 1 1 4 PRO HA H -3.024 -15.106 8.525 1.00 . A A . 8 PRO HA 1 1 7 4422 1 1 4 PRO HB2 H -3.988 -15.110 5.962 1.00 . A A . 8 PRO HB2 1 1 7 4423 1 1 4 PRO HB3 H -4.833 -15.886 7.313 1.00 . A A . 8 PRO HB3 1 1 7 4424 1 1 4 PRO HD2 H -5.821 -12.170 7.971 1.00 . A A . 8 PRO HD2 1 1 7 4425 1 1 4 PRO HD3 H -6.376 -13.657 8.766 1.00 . A A . 8 PRO HD3 1 1 7 4426 1 1 4 PRO HG2 H -5.339 -13.252 6.016 1.00 . A A . 8 PRO HG2 1 1 7 4427 1 1 4 PRO HG3 H -6.492 -14.449 6.620 1.00 . A A . 8 PRO HG3 1 1 7 4428 1 1 4 PRO N N -4.283 -13.410 8.709 1.00 . A A . 8 PRO N 1 1 7 4429 1 1 4 PRO O O -2.230 -12.368 7.296 1.00 . A A . 8 PRO O 1 1 7 4430 1 1 5 ASP C C -0.643 -13.835 4.103 1.00 . A A . 9 ASP C 1 1 7 4431 1 1 5 ASP CA C -0.504 -13.552 5.602 1.00 . A A . 9 ASP CA 1 1 7 4432 1 1 5 ASP CB C 0.799 -14.142 6.140 1.00 . A A . 9 ASP CB 1 1 7 4433 1 1 5 ASP CG C 1.937 -13.142 5.932 1.00 . A A . 9 ASP CG 1 1 7 4434 1 1 5 ASP H H -1.710 -15.214 6.257 1.00 . A A . 9 ASP H 1 1 7 4435 1 1 5 ASP HA H -0.533 -12.491 5.790 1.00 . A A . 9 ASP HA 1 1 7 4436 1 1 5 ASP HB2 H 0.692 -14.351 7.195 1.00 . A A . 9 ASP HB2 1 1 7 4437 1 1 5 ASP HB3 H 1.024 -15.059 5.614 1.00 . A A . 9 ASP HB3 1 1 7 4438 1 1 5 ASP N N -1.585 -14.246 6.359 1.00 . A A . 9 ASP N 1 1 7 4439 1 1 5 ASP O O 0.323 -14.113 3.422 1.00 . A A . 9 ASP O 1 1 7 4440 1 1 5 ASP OD1 O 1.884 -12.408 4.958 1.00 . A A . 9 ASP OD1 1 1 7 4441 1 1 5 ASP OD2 O 2.843 -13.126 6.750 1.00 . A A . 9 ASP OD2 1 1 7 4442 1 1 6 ASP C C -2.886 -12.922 1.503 1.00 . A A . 10 ASP C 1 1 7 4443 1 1 6 ASP CA C -2.040 -14.032 2.133 1.00 . A A . 10 ASP CA 1 1 7 4444 1 1 6 ASP CB C -2.778 -15.369 2.073 1.00 . A A . 10 ASP CB 1 1 7 4445 1 1 6 ASP CG C -2.933 -15.801 0.613 1.00 . A A . 10 ASP CG 1 1 7 4446 1 1 6 ASP H H -2.606 -13.540 4.154 1.00 . A A . 10 ASP H 1 1 7 4447 1 1 6 ASP HA H -1.089 -14.114 1.629 1.00 . A A . 10 ASP HA 1 1 7 4448 1 1 6 ASP HB2 H -2.215 -16.116 2.612 1.00 . A A . 10 ASP HB2 1 1 7 4449 1 1 6 ASP HB3 H -3.755 -15.261 2.521 1.00 . A A . 10 ASP HB3 1 1 7 4450 1 1 6 ASP N N -1.839 -13.766 3.586 1.00 . A A . 10 ASP N 1 1 7 4451 1 1 6 ASP O O -2.619 -12.470 0.407 1.00 . A A . 10 ASP O 1 1 7 4452 1 1 6 ASP OD1 O -1.986 -15.632 -0.137 1.00 . A A . 10 ASP OD1 1 1 7 4453 1 1 6 ASP OD2 O -3.996 -16.293 0.271 1.00 . A A . 10 ASP OD2 1 1 7 4454 1 1 7 VAL C C -3.966 -10.089 1.510 1.00 . A A . 11 VAL C 1 1 7 4455 1 1 7 VAL CA C -4.766 -11.398 1.627 1.00 . A A . 11 VAL CA 1 1 7 4456 1 1 7 VAL CB C -5.905 -11.239 2.630 1.00 . A A . 11 VAL CB 1 1 7 4457 1 1 7 VAL CG1 C -6.808 -10.082 2.196 1.00 . A A . 11 VAL CG1 1 1 7 4458 1 1 7 VAL CG2 C -6.721 -12.532 2.678 1.00 . A A . 11 VAL CG2 1 1 7 4459 1 1 7 VAL H H -4.104 -12.855 3.070 1.00 . A A . 11 VAL H 1 1 7 4460 1 1 7 VAL HA H -5.160 -11.694 0.669 1.00 . A A . 11 VAL HA 1 1 7 4461 1 1 7 VAL HB H -5.499 -11.033 3.609 1.00 . A A . 11 VAL HB 1 1 7 4462 1 1 7 VAL HG11 H -7.827 -10.295 2.482 1.00 . A A . 11 VAL HG11 1 1 7 4463 1 1 7 VAL HG12 H -6.750 -9.964 1.125 1.00 . A A . 11 VAL HG12 1 1 7 4464 1 1 7 VAL HG13 H -6.481 -9.172 2.677 1.00 . A A . 11 VAL HG13 1 1 7 4465 1 1 7 VAL HG21 H -7.636 -12.361 3.226 1.00 . A A . 11 VAL HG21 1 1 7 4466 1 1 7 VAL HG22 H -6.147 -13.303 3.170 1.00 . A A . 11 VAL HG22 1 1 7 4467 1 1 7 VAL HG23 H -6.957 -12.847 1.673 1.00 . A A . 11 VAL HG23 1 1 7 4468 1 1 7 VAL N N -3.904 -12.478 2.188 1.00 . A A . 11 VAL N 1 1 7 4469 1 1 7 VAL O O -3.590 -9.511 2.511 1.00 . A A . 11 VAL O 1 1 7 4470 1 1 8 PRO C C -3.846 -7.194 0.362 1.00 . A A . 12 PRO C 1 1 7 4471 1 1 8 PRO CA C -2.961 -8.411 0.072 1.00 . A A . 12 PRO CA 1 1 7 4472 1 1 8 PRO CB C -2.588 -8.477 -1.408 1.00 . A A . 12 PRO CB 1 1 7 4473 1 1 8 PRO CD C -4.136 -10.287 -0.973 1.00 . A A . 12 PRO CD 1 1 7 4474 1 1 8 PRO CG C -3.630 -9.342 -2.035 1.00 . A A . 12 PRO CG 1 1 7 4475 1 1 8 PRO HA H -2.071 -8.395 0.680 1.00 . A A . 12 PRO HA 1 1 7 4476 1 1 8 PRO HB2 H -2.606 -7.496 -1.850 1.00 . A A . 12 PRO HB2 1 1 7 4477 1 1 8 PRO HB3 H -1.610 -8.923 -1.526 1.00 . A A . 12 PRO HB3 1 1 7 4478 1 1 8 PRO HD2 H -5.211 -10.369 -1.024 1.00 . A A . 12 PRO HD2 1 1 7 4479 1 1 8 PRO HD3 H -3.677 -11.259 -1.080 1.00 . A A . 12 PRO HD3 1 1 7 4480 1 1 8 PRO HG2 H -4.442 -8.728 -2.397 1.00 . A A . 12 PRO HG2 1 1 7 4481 1 1 8 PRO HG3 H -3.199 -9.901 -2.850 1.00 . A A . 12 PRO HG3 1 1 7 4482 1 1 8 PRO N N -3.726 -9.662 0.292 1.00 . A A . 12 PRO N 1 1 7 4483 1 1 8 PRO O O -4.837 -7.287 1.058 1.00 . A A . 12 PRO O 1 1 7 4484 1 1 9 LEU C C -5.787 -5.104 -0.276 1.00 . A A . 13 LEU C 1 1 7 4485 1 1 9 LEU CA C -4.319 -4.832 0.081 1.00 . A A . 13 LEU CA 1 1 7 4486 1 1 9 LEU CB C -3.727 -3.764 -0.841 1.00 . A A . 13 LEU CB 1 1 7 4487 1 1 9 LEU CD1 C -1.272 -4.088 -1.211 1.00 . A A . 13 LEU CD1 1 1 7 4488 1 1 9 LEU CD2 C -2.138 -1.870 -0.455 1.00 . A A . 13 LEU CD2 1 1 7 4489 1 1 9 LEU CG C -2.324 -3.386 -0.350 1.00 . A A . 13 LEU CG 1 1 7 4490 1 1 9 LEU H H -2.696 -5.997 -0.723 1.00 . A A . 13 LEU H 1 1 7 4491 1 1 9 LEU HA H -4.233 -4.520 1.111 1.00 . A A . 13 LEU HA 1 1 7 4492 1 1 9 LEU HB2 H -3.663 -4.151 -1.847 1.00 . A A . 13 LEU HB2 1 1 7 4493 1 1 9 LEU HB3 H -4.359 -2.889 -0.832 1.00 . A A . 13 LEU HB3 1 1 7 4494 1 1 9 LEU HD11 H -0.708 -3.350 -1.762 1.00 . A A . 13 LEU HD11 1 1 7 4495 1 1 9 LEU HD12 H -1.761 -4.757 -1.903 1.00 . A A . 13 LEU HD12 1 1 7 4496 1 1 9 LEU HD13 H -0.604 -4.650 -0.575 1.00 . A A . 13 LEU HD13 1 1 7 4497 1 1 9 LEU HD21 H -1.133 -1.611 -0.155 1.00 . A A . 13 LEU HD21 1 1 7 4498 1 1 9 LEU HD22 H -2.846 -1.374 0.191 1.00 . A A . 13 LEU HD22 1 1 7 4499 1 1 9 LEU HD23 H -2.299 -1.558 -1.475 1.00 . A A . 13 LEU HD23 1 1 7 4500 1 1 9 LEU HG H -2.209 -3.691 0.680 1.00 . A A . 13 LEU HG 1 1 7 4501 1 1 9 LEU N N -3.497 -6.052 -0.165 1.00 . A A . 13 LEU N 1 1 7 4502 1 1 9 LEU O O -6.068 -5.870 -1.177 1.00 . A A . 13 LEU O 1 1 7 4503 1 1 10 PRO C C -8.557 -3.973 -1.104 1.00 . A A . 14 PRO C 1 1 7 4504 1 1 10 PRO CA C -8.132 -4.670 0.193 1.00 . A A . 14 PRO CA 1 1 7 4505 1 1 10 PRO CB C -8.801 -4.027 1.406 1.00 . A A . 14 PRO CB 1 1 7 4506 1 1 10 PRO CD C -6.439 -3.534 1.553 1.00 . A A . 14 PRO CD 1 1 7 4507 1 1 10 PRO CG C -7.813 -3.026 1.912 1.00 . A A . 14 PRO CG 1 1 7 4508 1 1 10 PRO HA H -8.371 -5.719 0.156 1.00 . A A . 14 PRO HA 1 1 7 4509 1 1 10 PRO HB2 H -9.717 -3.536 1.111 1.00 . A A . 14 PRO HB2 1 1 7 4510 1 1 10 PRO HB3 H -9.001 -4.773 2.162 1.00 . A A . 14 PRO HB3 1 1 7 4511 1 1 10 PRO HD2 H -5.808 -2.721 1.225 1.00 . A A . 14 PRO HD2 1 1 7 4512 1 1 10 PRO HD3 H -5.993 -4.046 2.393 1.00 . A A . 14 PRO HD3 1 1 7 4513 1 1 10 PRO HG2 H -7.987 -2.070 1.443 1.00 . A A . 14 PRO HG2 1 1 7 4514 1 1 10 PRO HG3 H -7.901 -2.932 2.984 1.00 . A A . 14 PRO HG3 1 1 7 4515 1 1 10 PRO N N -6.683 -4.474 0.447 1.00 . A A . 14 PRO N 1 1 7 4516 1 1 10 PRO O O -7.737 -3.617 -1.926 1.00 . A A . 14 PRO O 1 1 7 4517 1 1 11 ALA C C -10.026 -1.622 -2.502 1.00 . A A . 15 ALA C 1 1 7 4518 1 1 11 ALA CA C -10.317 -3.124 -2.543 1.00 . A A . 15 ALA CA 1 1 7 4519 1 1 11 ALA CB C -11.826 -3.375 -2.564 1.00 . A A . 15 ALA CB 1 1 7 4520 1 1 11 ALA H H -10.480 -4.089 -0.621 1.00 . A A . 15 ALA H 1 1 7 4521 1 1 11 ALA HA H -9.860 -3.574 -3.409 1.00 . A A . 15 ALA HA 1 1 7 4522 1 1 11 ALA HB1 H -12.181 -3.521 -1.554 1.00 . A A . 15 ALA HB1 1 1 7 4523 1 1 11 ALA HB2 H -12.036 -4.257 -3.150 1.00 . A A . 15 ALA HB2 1 1 7 4524 1 1 11 ALA HB3 H -12.326 -2.525 -3.003 1.00 . A A . 15 ALA HB3 1 1 7 4525 1 1 11 ALA N N -9.835 -3.788 -1.296 1.00 . A A . 15 ALA N 1 1 7 4526 1 1 11 ALA O O -9.649 -1.079 -1.483 1.00 . A A . 15 ALA O 1 1 7 4527 1 1 12 GLY C C -8.439 0.785 -3.411 1.00 . A A . 16 GLY C 1 1 7 4528 1 1 12 GLY CA C -9.931 0.519 -3.639 1.00 . A A . 16 GLY CA 1 1 7 4529 1 1 12 GLY H H -10.502 -1.407 -4.417 1.00 . A A . 16 GLY H 1 1 7 4530 1 1 12 GLY HA2 H -10.220 0.914 -4.601 1.00 . A A . 16 GLY HA2 1 1 7 4531 1 1 12 GLY HA3 H -10.504 1.005 -2.865 1.00 . A A . 16 GLY HA3 1 1 7 4532 1 1 12 GLY N N -10.197 -0.948 -3.607 1.00 . A A . 16 GLY N 1 1 7 4533 1 1 12 GLY O O -8.033 1.905 -3.164 1.00 . A A . 16 GLY O 1 1 7 4534 1 1 13 TRP C C -5.369 -0.295 -4.544 1.00 . A A . 17 TRP C 1 1 7 4535 1 1 13 TRP CA C -6.156 -0.017 -3.262 1.00 . A A . 17 TRP CA 1 1 7 4536 1 1 13 TRP CB C -5.784 -1.026 -2.182 1.00 . A A . 17 TRP CB 1 1 7 4537 1 1 13 TRP CD1 C -6.951 -0.440 -0.025 1.00 . A A . 17 TRP CD1 1 1 7 4538 1 1 13 TRP CD2 C -4.903 0.469 -0.186 1.00 . A A . 17 TRP CD2 1 1 7 4539 1 1 13 TRP CE2 C -5.429 0.879 1.061 1.00 . A A . 17 TRP CE2 1 1 7 4540 1 1 13 TRP CE3 C -3.618 0.905 -0.542 1.00 . A A . 17 TRP CE3 1 1 7 4541 1 1 13 TRP CG C -5.884 -0.369 -0.850 1.00 . A A . 17 TRP CG 1 1 7 4542 1 1 13 TRP CH2 C -3.421 2.122 1.553 1.00 . A A . 17 TRP CH2 1 1 7 4543 1 1 13 TRP CZ2 C -4.701 1.696 1.926 1.00 . A A . 17 TRP CZ2 1 1 7 4544 1 1 13 TRP CZ3 C -2.884 1.726 0.323 1.00 . A A . 17 TRP CZ3 1 1 7 4545 1 1 13 TRP H H -7.953 -1.124 -3.676 1.00 . A A . 17 TRP H 1 1 7 4546 1 1 13 TRP HA H -5.967 0.984 -2.911 1.00 . A A . 17 TRP HA 1 1 7 4547 1 1 13 TRP HB2 H -6.461 -1.866 -2.221 1.00 . A A . 17 TRP HB2 1 1 7 4548 1 1 13 TRP HB3 H -4.772 -1.370 -2.339 1.00 . A A . 17 TRP HB3 1 1 7 4549 1 1 13 TRP HD1 H -7.861 -0.989 -0.224 1.00 . A A . 17 TRP HD1 1 1 7 4550 1 1 13 TRP HE1 H -7.292 0.410 1.874 1.00 . A A . 17 TRP HE1 1 1 7 4551 1 1 13 TRP HE3 H -3.193 0.607 -1.489 1.00 . A A . 17 TRP HE3 1 1 7 4552 1 1 13 TRP HH2 H -2.845 2.753 2.211 1.00 . A A . 17 TRP HH2 1 1 7 4553 1 1 13 TRP HZ2 H -5.120 1.999 2.874 1.00 . A A . 17 TRP HZ2 1 1 7 4554 1 1 13 TRP HZ3 H -1.901 2.057 0.039 1.00 . A A . 17 TRP HZ3 1 1 7 4555 1 1 13 TRP N N -7.615 -0.227 -3.484 1.00 . A A . 17 TRP N 1 1 7 4556 1 1 13 TRP NE1 N -6.683 0.299 1.114 1.00 . A A . 17 TRP NE1 1 1 7 4557 1 1 13 TRP O O -5.703 -1.179 -5.308 1.00 . A A . 17 TRP O 1 1 7 4558 1 1 14 GLU C C -2.025 0.313 -5.739 1.00 . A A . 18 GLU C 1 1 7 4559 1 1 14 GLU CA C -3.523 0.213 -6.022 1.00 . A A . 18 GLU CA 1 1 7 4560 1 1 14 GLU CB C -3.934 1.327 -6.986 1.00 . A A . 18 GLU CB 1 1 7 4561 1 1 14 GLU CD C -6.007 0.256 -7.877 1.00 . A A . 18 GLU CD 1 1 7 4562 1 1 14 GLU CG C -4.591 0.718 -8.224 1.00 . A A . 18 GLU CG 1 1 7 4563 1 1 14 GLU H H -4.066 1.161 -4.159 1.00 . A A . 18 GLU H 1 1 7 4564 1 1 14 GLU HA H -3.764 -0.746 -6.450 1.00 . A A . 18 GLU HA 1 1 7 4565 1 1 14 GLU HB2 H -4.626 1.992 -6.497 1.00 . A A . 18 GLU HB2 1 1 7 4566 1 1 14 GLU HB3 H -3.058 1.882 -7.285 1.00 . A A . 18 GLU HB3 1 1 7 4567 1 1 14 GLU HG2 H -4.634 1.458 -9.009 1.00 . A A . 18 GLU HG2 1 1 7 4568 1 1 14 GLU HG3 H -4.008 -0.128 -8.559 1.00 . A A . 18 GLU HG3 1 1 7 4569 1 1 14 GLU N N -4.322 0.449 -4.786 1.00 . A A . 18 GLU N 1 1 7 4570 1 1 14 GLU O O -1.464 1.396 -5.736 1.00 . A A . 18 GLU O 1 1 7 4571 1 1 14 GLU OE1 O -6.600 0.846 -6.989 1.00 . A A . 18 GLU OE1 1 1 7 4572 1 1 14 GLU OE2 O -6.476 -0.679 -8.507 1.00 . A A . 18 GLU OE2 1 1 7 4573 1 1 15 MET C C 0.749 -0.128 -6.548 1.00 . A A . 19 MET C 1 1 7 4574 1 1 15 MET CA C 0.107 -0.707 -5.297 1.00 . A A . 19 MET CA 1 1 7 4575 1 1 15 MET CB C 0.607 -2.126 -5.055 1.00 . A A . 19 MET CB 1 1 7 4576 1 1 15 MET CE C -1.595 -4.184 -4.506 1.00 . A A . 19 MET CE 1 1 7 4577 1 1 15 MET CG C 0.191 -3.042 -6.212 1.00 . A A . 19 MET CG 1 1 7 4578 1 1 15 MET H H -1.801 -1.660 -5.551 1.00 . A A . 19 MET H 1 1 7 4579 1 1 15 MET HA H 0.317 -0.085 -4.442 1.00 . A A . 19 MET HA 1 1 7 4580 1 1 15 MET HB2 H 1.678 -2.098 -4.996 1.00 . A A . 19 MET HB2 1 1 7 4581 1 1 15 MET HB3 H 0.210 -2.503 -4.126 1.00 . A A . 19 MET HB3 1 1 7 4582 1 1 15 MET HE1 H -2.224 -3.485 -5.039 1.00 . A A . 19 MET HE1 1 1 7 4583 1 1 15 MET HE2 H -1.213 -3.713 -3.615 1.00 . A A . 19 MET HE2 1 1 7 4584 1 1 15 MET HE3 H -2.170 -5.057 -4.230 1.00 . A A . 19 MET HE3 1 1 7 4585 1 1 15 MET HG2 H -0.667 -2.627 -6.717 1.00 . A A . 19 MET HG2 1 1 7 4586 1 1 15 MET HG3 H 1.011 -3.127 -6.911 1.00 . A A . 19 MET HG3 1 1 7 4587 1 1 15 MET N N -1.355 -0.793 -5.530 1.00 . A A . 19 MET N 1 1 7 4588 1 1 15 MET O O 0.634 -0.669 -7.629 1.00 . A A . 19 MET O 1 1 7 4589 1 1 15 MET SD S -0.217 -4.684 -5.568 1.00 . A A . 19 MET SD 1 1 7 4590 1 1 16 ALA C C 3.443 2.086 -7.216 1.00 . A A . 20 ALA C 1 1 7 4591 1 1 16 ALA CA C 2.045 1.605 -7.593 1.00 . A A . 20 ALA CA 1 1 7 4592 1 1 16 ALA CB C 1.123 2.773 -7.948 1.00 . A A . 20 ALA CB 1 1 7 4593 1 1 16 ALA H H 1.479 1.391 -5.530 1.00 . A A . 20 ALA H 1 1 7 4594 1 1 16 ALA HA H 2.094 0.908 -8.416 1.00 . A A . 20 ALA HA 1 1 7 4595 1 1 16 ALA HB1 H 1.711 3.620 -8.261 1.00 . A A . 20 ALA HB1 1 1 7 4596 1 1 16 ALA HB2 H 0.536 3.042 -7.080 1.00 . A A . 20 ALA HB2 1 1 7 4597 1 1 16 ALA HB3 H 0.459 2.477 -8.748 1.00 . A A . 20 ALA HB3 1 1 7 4598 1 1 16 ALA N N 1.408 0.973 -6.412 1.00 . A A . 20 ALA N 1 1 7 4599 1 1 16 ALA O O 4.007 1.639 -6.236 1.00 . A A . 20 ALA O 1 1 7 4600 1 1 17 LYS C C 5.459 4.965 -7.546 1.00 . A A . 21 LYS C 1 1 7 4601 1 1 17 LYS CA C 5.387 3.442 -7.617 1.00 . A A . 21 LYS CA 1 1 7 4602 1 1 17 LYS CB C 6.297 2.904 -8.720 1.00 . A A . 21 LYS CB 1 1 7 4603 1 1 17 LYS CD C 7.610 0.843 -9.240 1.00 . A A . 21 LYS CD 1 1 7 4604 1 1 17 LYS CE C 7.339 -0.038 -10.461 1.00 . A A . 21 LYS CE 1 1 7 4605 1 1 17 LYS CG C 6.284 1.374 -8.691 1.00 . A A . 21 LYS CG 1 1 7 4606 1 1 17 LYS H H 3.564 3.329 -8.766 1.00 . A A . 21 LYS H 1 1 7 4607 1 1 17 LYS HA H 5.670 3.025 -6.670 1.00 . A A . 21 LYS HA 1 1 7 4608 1 1 17 LYS HB2 H 5.944 3.248 -9.681 1.00 . A A . 21 LYS HB2 1 1 7 4609 1 1 17 LYS HB3 H 7.305 3.259 -8.561 1.00 . A A . 21 LYS HB3 1 1 7 4610 1 1 17 LYS HD2 H 8.241 1.671 -9.526 1.00 . A A . 21 LYS HD2 1 1 7 4611 1 1 17 LYS HD3 H 8.107 0.259 -8.479 1.00 . A A . 21 LYS HD3 1 1 7 4612 1 1 17 LYS HE2 H 6.696 0.476 -11.160 1.00 . A A . 21 LYS HE2 1 1 7 4613 1 1 17 LYS HE3 H 8.269 -0.315 -10.939 1.00 . A A . 21 LYS HE3 1 1 7 4614 1 1 17 LYS HG2 H 6.153 1.035 -7.674 1.00 . A A . 21 LYS HG2 1 1 7 4615 1 1 17 LYS HG3 H 5.470 1.010 -9.300 1.00 . A A . 21 LYS HG3 1 1 7 4616 1 1 17 LYS HZ1 H 7.271 -1.707 -9.218 1.00 . A A . 21 LYS HZ1 1 1 7 4617 1 1 17 LYS HZ2 H 6.455 -1.908 -10.695 1.00 . A A . 21 LYS HZ2 1 1 7 4618 1 1 17 LYS HZ3 H 5.766 -0.964 -9.461 1.00 . A A . 21 LYS HZ3 1 1 7 4619 1 1 17 LYS N N 4.019 2.978 -7.974 1.00 . A A . 21 LYS N 1 1 7 4620 1 1 17 LYS NZ N 6.657 -1.246 -9.917 1.00 . A A . 21 LYS NZ 1 1 7 4621 1 1 17 LYS O O 4.893 5.672 -8.356 1.00 . A A . 21 LYS O 1 1 7 4622 1 1 18 THR C C 7.722 7.320 -6.083 1.00 . A A . 22 THR C 1 1 7 4623 1 1 18 THR CA C 6.278 6.939 -6.407 1.00 . A A . 22 THR CA 1 1 7 4624 1 1 18 THR CB C 5.360 7.288 -5.234 1.00 . A A . 22 THR CB 1 1 7 4625 1 1 18 THR CG2 C 5.878 6.628 -3.951 1.00 . A A . 22 THR CG2 1 1 7 4626 1 1 18 THR H H 6.600 4.863 -5.921 1.00 . A A . 22 THR H 1 1 7 4627 1 1 18 THR HA H 5.945 7.443 -7.300 1.00 . A A . 22 THR HA 1 1 7 4628 1 1 18 THR HB H 4.364 6.935 -5.440 1.00 . A A . 22 THR HB 1 1 7 4629 1 1 18 THR HG1 H 4.859 9.079 -5.806 1.00 . A A . 22 THR HG1 1 1 7 4630 1 1 18 THR HG21 H 6.708 7.201 -3.569 1.00 . A A . 22 THR HG21 1 1 7 4631 1 1 18 THR HG22 H 6.207 5.619 -4.165 1.00 . A A . 22 THR HG22 1 1 7 4632 1 1 18 THR HG23 H 5.091 6.599 -3.211 1.00 . A A . 22 THR HG23 1 1 7 4633 1 1 18 THR N N 6.157 5.465 -6.563 1.00 . A A . 22 THR N 1 1 7 4634 1 1 18 THR O O 8.646 6.568 -6.325 1.00 . A A . 22 THR O 1 1 7 4635 1 1 18 THR OG1 O 5.336 8.699 -5.064 1.00 . A A . 22 THR OG1 1 1 7 4636 1 1 19 SER C C 10.274 8.674 -6.309 1.00 . A A . 23 SER C 1 1 7 4637 1 1 19 SER CA C 9.291 8.937 -5.159 1.00 . A A . 23 SER CA 1 1 7 4638 1 1 19 SER CB C 9.665 8.105 -3.932 1.00 . A A . 23 SER CB 1 1 7 4639 1 1 19 SER H H 7.141 9.058 -5.332 1.00 . A A . 23 SER H 1 1 7 4640 1 1 19 SER HA H 9.285 9.985 -4.903 1.00 . A A . 23 SER HA 1 1 7 4641 1 1 19 SER HB2 H 8.776 7.898 -3.353 1.00 . A A . 23 SER HB2 1 1 7 4642 1 1 19 SER HB3 H 10.112 7.174 -4.250 1.00 . A A . 23 SER HB3 1 1 7 4643 1 1 19 SER HG H 10.369 8.678 -2.213 1.00 . A A . 23 SER HG 1 1 7 4644 1 1 19 SER N N 7.913 8.482 -5.523 1.00 . A A . 23 SER N 1 1 7 4645 1 1 19 SER O O 9.909 8.700 -7.468 1.00 . A A . 23 SER O 1 1 7 4646 1 1 19 SER OG O 10.593 8.826 -3.134 1.00 . A A . 23 SER OG 1 1 7 4647 1 1 20 SER C C 12.613 6.644 -7.348 1.00 . A A . 24 SER C 1 1 7 4648 1 1 20 SER CA C 12.514 8.148 -7.071 1.00 . A A . 24 SER CA 1 1 7 4649 1 1 20 SER CB C 13.839 8.681 -6.524 1.00 . A A . 24 SER CB 1 1 7 4650 1 1 20 SER H H 11.793 8.397 -5.057 1.00 . A A . 24 SER H 1 1 7 4651 1 1 20 SER HA H 12.249 8.678 -7.970 1.00 . A A . 24 SER HA 1 1 7 4652 1 1 20 SER HB2 H 14.279 7.944 -5.869 1.00 . A A . 24 SER HB2 1 1 7 4653 1 1 20 SER HB3 H 14.513 8.881 -7.344 1.00 . A A . 24 SER HB3 1 1 7 4654 1 1 20 SER HG H 14.452 10.219 -5.506 1.00 . A A . 24 SER HG 1 1 7 4655 1 1 20 SER N N 11.516 8.416 -5.996 1.00 . A A . 24 SER N 1 1 7 4656 1 1 20 SER O O 13.154 6.223 -8.353 1.00 . A A . 24 SER O 1 1 7 4657 1 1 20 SER OG O 13.603 9.879 -5.800 1.00 . A A . 24 SER OG 1 1 7 4658 1 1 21 GLY C C 11.601 3.627 -5.465 1.00 . A A . 25 GLY C 1 1 7 4659 1 1 21 GLY CA C 12.162 4.356 -6.690 1.00 . A A . 25 GLY CA 1 1 7 4660 1 1 21 GLY H H 11.662 6.184 -5.668 1.00 . A A . 25 GLY H 1 1 7 4661 1 1 21 GLY HA2 H 11.579 4.095 -7.561 1.00 . A A . 25 GLY HA2 1 1 7 4662 1 1 21 GLY HA3 H 13.190 4.061 -6.844 1.00 . A A . 25 GLY HA3 1 1 7 4663 1 1 21 GLY N N 12.094 5.828 -6.470 1.00 . A A . 25 GLY N 1 1 7 4664 1 1 21 GLY O O 12.315 3.325 -4.530 1.00 . A A . 25 GLY O 1 1 7 4665 1 1 22 GLN C C 8.242 2.333 -4.579 1.00 . A A . 26 GLN C 1 1 7 4666 1 1 22 GLN CA C 9.716 2.635 -4.300 1.00 . A A . 26 GLN CA 1 1 7 4667 1 1 22 GLN CB C 9.851 3.606 -3.126 1.00 . A A . 26 GLN CB 1 1 7 4668 1 1 22 GLN CD C 10.263 2.383 -0.987 1.00 . A A . 26 GLN CD 1 1 7 4669 1 1 22 GLN CG C 10.928 3.098 -2.164 1.00 . A A . 26 GLN CG 1 1 7 4670 1 1 22 GLN H H 9.767 3.598 -6.229 1.00 . A A . 26 GLN H 1 1 7 4671 1 1 22 GLN HA H 10.256 1.724 -4.089 1.00 . A A . 26 GLN HA 1 1 7 4672 1 1 22 GLN HB2 H 10.128 4.583 -3.495 1.00 . A A . 26 GLN HB2 1 1 7 4673 1 1 22 GLN HB3 H 8.906 3.673 -2.606 1.00 . A A . 26 GLN HB3 1 1 7 4674 1 1 22 GLN HE21 H 11.127 3.529 0.384 1.00 . A A . 26 GLN HE21 1 1 7 4675 1 1 22 GLN HE22 H 10.097 2.325 0.991 1.00 . A A . 26 GLN HE22 1 1 7 4676 1 1 22 GLN HG2 H 11.580 2.412 -2.683 1.00 . A A . 26 GLN HG2 1 1 7 4677 1 1 22 GLN HG3 H 11.505 3.935 -1.797 1.00 . A A . 26 GLN HG3 1 1 7 4678 1 1 22 GLN N N 10.326 3.344 -5.463 1.00 . A A . 26 GLN N 1 1 7 4679 1 1 22 GLN NE2 N 10.517 2.779 0.230 1.00 . A A . 26 GLN NE2 1 1 7 4680 1 1 22 GLN O O 7.512 3.172 -5.078 1.00 . A A . 26 GLN O 1 1 7 4681 1 1 22 GLN OE1 O 9.506 1.451 -1.177 1.00 . A A . 26 GLN OE1 1 1 7 4682 1 1 23 ARG C C 5.480 1.373 -3.421 1.00 . A A . 27 ARG C 1 1 7 4683 1 1 23 ARG CA C 6.366 0.806 -4.518 1.00 . A A . 27 ARG CA 1 1 7 4684 1 1 23 ARG CB C 6.261 -0.722 -4.501 1.00 . A A . 27 ARG CB 1 1 7 4685 1 1 23 ARG CD C 4.691 -2.278 -5.661 1.00 . A A . 27 ARG CD 1 1 7 4686 1 1 23 ARG CG C 5.760 -1.201 -5.862 1.00 . A A . 27 ARG CG 1 1 7 4687 1 1 23 ARG CZ C 5.560 -3.865 -7.301 1.00 . A A . 27 ARG CZ 1 1 7 4688 1 1 23 ARG H H 8.395 0.480 -3.864 1.00 . A A . 27 ARG H 1 1 7 4689 1 1 23 ARG HA H 6.057 1.184 -5.480 1.00 . A A . 27 ARG HA 1 1 7 4690 1 1 23 ARG HB2 H 7.220 -1.156 -4.288 1.00 . A A . 27 ARG HB2 1 1 7 4691 1 1 23 ARG HB3 H 5.559 -1.024 -3.738 1.00 . A A . 27 ARG HB3 1 1 7 4692 1 1 23 ARG HD2 H 4.982 -2.953 -4.869 1.00 . A A . 27 ARG HD2 1 1 7 4693 1 1 23 ARG HD3 H 3.737 -1.824 -5.438 1.00 . A A . 27 ARG HD3 1 1 7 4694 1 1 23 ARG HE H 3.885 -2.830 -7.578 1.00 . A A . 27 ARG HE 1 1 7 4695 1 1 23 ARG HG2 H 5.333 -0.365 -6.398 1.00 . A A . 27 ARG HG2 1 1 7 4696 1 1 23 ARG HG3 H 6.583 -1.612 -6.424 1.00 . A A . 27 ARG HG3 1 1 7 4697 1 1 23 ARG HH11 H 6.643 -3.656 -5.620 1.00 . A A . 27 ARG HH11 1 1 7 4698 1 1 23 ARG HH12 H 7.266 -4.782 -6.776 1.00 . A A . 27 ARG HH12 1 1 7 4699 1 1 23 ARG HH21 H 4.715 -4.296 -9.063 1.00 . A A . 27 ARG HH21 1 1 7 4700 1 1 23 ARG HH22 H 6.183 -5.142 -8.712 1.00 . A A . 27 ARG HH22 1 1 7 4701 1 1 23 ARG N N 7.795 1.143 -4.264 1.00 . A A . 27 ARG N 1 1 7 4702 1 1 23 ARG NE N 4.629 -3.002 -6.964 1.00 . A A . 27 ARG NE 1 1 7 4703 1 1 23 ARG NH1 N 6.567 -4.119 -6.501 1.00 . A A . 27 ARG NH1 1 1 7 4704 1 1 23 ARG NH2 N 5.480 -4.483 -8.448 1.00 . A A . 27 ARG NH2 1 1 7 4705 1 1 23 ARG O O 5.545 0.955 -2.282 1.00 . A A . 27 ARG O 1 1 7 4706 1 1 24 TYR C C 2.341 2.197 -2.950 1.00 . A A . 28 TYR C 1 1 7 4707 1 1 24 TYR CA C 3.701 2.819 -2.733 1.00 . A A . 28 TYR CA 1 1 7 4708 1 1 24 TYR CB C 3.674 4.351 -2.906 1.00 . A A . 28 TYR CB 1 1 7 4709 1 1 24 TYR CD1 C 3.349 4.679 -5.375 1.00 . A A . 28 TYR CD1 1 1 7 4710 1 1 24 TYR CD2 C 1.496 5.178 -3.903 1.00 . A A . 28 TYR CD2 1 1 7 4711 1 1 24 TYR CE1 C 2.572 5.040 -6.479 1.00 . A A . 28 TYR CE1 1 1 7 4712 1 1 24 TYR CE2 C 0.718 5.541 -5.008 1.00 . A A . 28 TYR CE2 1 1 7 4713 1 1 24 TYR CG C 2.817 4.747 -4.091 1.00 . A A . 28 TYR CG 1 1 7 4714 1 1 24 TYR CZ C 1.263 5.470 -6.297 1.00 . A A . 28 TYR CZ 1 1 7 4715 1 1 24 TYR H H 4.557 2.578 -4.693 1.00 . A A . 28 TYR H 1 1 7 4716 1 1 24 TYR HA H 4.056 2.562 -1.748 1.00 . A A . 28 TYR HA 1 1 7 4717 1 1 24 TYR HB2 H 3.272 4.803 -2.011 1.00 . A A . 28 TYR HB2 1 1 7 4718 1 1 24 TYR HB3 H 4.682 4.707 -3.062 1.00 . A A . 28 TYR HB3 1 1 7 4719 1 1 24 TYR HD1 H 4.360 4.345 -5.514 1.00 . A A . 28 TYR HD1 1 1 7 4720 1 1 24 TYR HD2 H 1.074 5.235 -2.907 1.00 . A A . 28 TYR HD2 1 1 7 4721 1 1 24 TYR HE1 H 2.983 4.985 -7.473 1.00 . A A . 28 TYR HE1 1 1 7 4722 1 1 24 TYR HE2 H -0.302 5.864 -4.867 1.00 . A A . 28 TYR HE2 1 1 7 4723 1 1 24 TYR HH H 0.250 5.032 -7.852 1.00 . A A . 28 TYR HH 1 1 7 4724 1 1 24 TYR N N 4.621 2.281 -3.762 1.00 . A A . 28 TYR N 1 1 7 4725 1 1 24 TYR O O 2.139 1.422 -3.867 1.00 . A A . 28 TYR O 1 1 7 4726 1 1 24 TYR OH O 0.510 5.833 -7.392 1.00 . A A . 28 TYR OH 1 1 7 4727 1 1 25 PHE C C -0.949 3.037 -2.341 1.00 . A A . 29 PHE C 1 1 7 4728 1 1 25 PHE CA C 0.078 1.923 -2.273 1.00 . A A . 29 PHE CA 1 1 7 4729 1 1 25 PHE CB C -0.051 0.994 -1.073 1.00 . A A . 29 PHE CB 1 1 7 4730 1 1 25 PHE CD1 C 2.327 0.105 -0.950 1.00 . A A . 29 PHE CD1 1 1 7 4731 1 1 25 PHE CD2 C 0.589 -1.294 -1.894 1.00 . A A . 29 PHE CD2 1 1 7 4732 1 1 25 PHE CE1 C 3.273 -0.893 -1.223 1.00 . A A . 29 PHE CE1 1 1 7 4733 1 1 25 PHE CE2 C 1.533 -2.293 -2.155 1.00 . A A . 29 PHE CE2 1 1 7 4734 1 1 25 PHE CG C 0.977 -0.099 -1.289 1.00 . A A . 29 PHE CG 1 1 7 4735 1 1 25 PHE CZ C 2.874 -2.092 -1.823 1.00 . A A . 29 PHE CZ 1 1 7 4736 1 1 25 PHE H H 1.603 3.132 -1.384 1.00 . A A . 29 PHE H 1 1 7 4737 1 1 25 PHE HA H 0.041 1.345 -3.182 1.00 . A A . 29 PHE HA 1 1 7 4738 1 1 25 PHE HB2 H 0.151 1.533 -0.155 1.00 . A A . 29 PHE HB2 1 1 7 4739 1 1 25 PHE HB3 H -1.042 0.567 -1.041 1.00 . A A . 29 PHE HB3 1 1 7 4740 1 1 25 PHE HD1 H 2.640 1.032 -0.483 1.00 . A A . 29 PHE HD1 1 1 7 4741 1 1 25 PHE HD2 H -0.443 -1.448 -2.154 1.00 . A A . 29 PHE HD2 1 1 7 4742 1 1 25 PHE HE1 H 4.310 -0.737 -0.973 1.00 . A A . 29 PHE HE1 1 1 7 4743 1 1 25 PHE HE2 H 1.225 -3.217 -2.627 1.00 . A A . 29 PHE HE2 1 1 7 4744 1 1 25 PHE HZ H 3.603 -2.858 -2.042 1.00 . A A . 29 PHE HZ 1 1 7 4745 1 1 25 PHE N N 1.415 2.512 -2.118 1.00 . A A . 29 PHE N 1 1 7 4746 1 1 25 PHE O O -1.329 3.639 -1.353 1.00 . A A . 29 PHE O 1 1 7 4747 1 1 26 LEU C C -3.702 4.021 -3.271 1.00 . A A . 30 LEU C 1 1 7 4748 1 1 26 LEU CA C -2.321 4.422 -3.793 1.00 . A A . 30 LEU CA 1 1 7 4749 1 1 26 LEU CB C -2.307 4.570 -5.329 1.00 . A A . 30 LEU CB 1 1 7 4750 1 1 26 LEU CD1 C -2.570 7.081 -4.814 1.00 . A A . 30 LEU CD1 1 1 7 4751 1 1 26 LEU CD2 C -2.056 6.302 -7.114 1.00 . A A . 30 LEU CD2 1 1 7 4752 1 1 26 LEU CG C -2.795 5.952 -5.827 1.00 . A A . 30 LEU CG 1 1 7 4753 1 1 26 LEU H H -0.984 2.827 -4.309 1.00 . A A . 30 LEU H 1 1 7 4754 1 1 26 LEU HA H -1.981 5.326 -3.322 1.00 . A A . 30 LEU HA 1 1 7 4755 1 1 26 LEU HB2 H -1.302 4.408 -5.684 1.00 . A A . 30 LEU HB2 1 1 7 4756 1 1 26 LEU HB3 H -2.948 3.809 -5.751 1.00 . A A . 30 LEU HB3 1 1 7 4757 1 1 26 LEU HD11 H -3.002 6.811 -3.864 1.00 . A A . 30 LEU HD11 1 1 7 4758 1 1 26 LEU HD12 H -3.036 7.983 -5.177 1.00 . A A . 30 LEU HD12 1 1 7 4759 1 1 26 LEU HD13 H -1.515 7.252 -4.697 1.00 . A A . 30 LEU HD13 1 1 7 4760 1 1 26 LEU HD21 H -1.265 7.004 -6.894 1.00 . A A . 30 LEU HD21 1 1 7 4761 1 1 26 LEU HD22 H -2.745 6.743 -7.816 1.00 . A A . 30 LEU HD22 1 1 7 4762 1 1 26 LEU HD23 H -1.631 5.404 -7.540 1.00 . A A . 30 LEU HD23 1 1 7 4763 1 1 26 LEU HG H -3.828 5.884 -6.046 1.00 . A A . 30 LEU HG 1 1 7 4764 1 1 26 LEU N N -1.353 3.329 -3.546 1.00 . A A . 30 LEU N 1 1 7 4765 1 1 26 LEU O O -4.372 3.175 -3.833 1.00 . A A . 30 LEU O 1 1 7 4766 1 1 27 ASN C C -6.549 5.072 -2.328 1.00 . A A . 31 ASN C 1 1 7 4767 1 1 27 ASN CA C -5.451 4.284 -1.612 1.00 . A A . 31 ASN CA 1 1 7 4768 1 1 27 ASN CB C -5.357 4.706 -0.144 1.00 . A A . 31 ASN CB 1 1 7 4769 1 1 27 ASN CG C -6.671 4.393 0.567 1.00 . A A . 31 ASN CG 1 1 7 4770 1 1 27 ASN H H -3.557 5.293 -1.756 1.00 . A A . 31 ASN H 1 1 7 4771 1 1 27 ASN HA H -5.637 3.225 -1.682 1.00 . A A . 31 ASN HA 1 1 7 4772 1 1 27 ASN HB2 H -4.562 4.160 0.337 1.00 . A A . 31 ASN HB2 1 1 7 4773 1 1 27 ASN HB3 H -5.157 5.764 -0.085 1.00 . A A . 31 ASN HB3 1 1 7 4774 1 1 27 ASN HD21 H -5.774 3.854 2.251 1.00 . A A . 31 ASN HD21 1 1 7 4775 1 1 27 ASN HD22 H -7.464 3.761 2.265 1.00 . A A . 31 ASN HD22 1 1 7 4776 1 1 27 ASN N N -4.122 4.621 -2.190 1.00 . A A . 31 ASN N 1 1 7 4777 1 1 27 ASN ND2 N -6.634 3.968 1.797 1.00 . A A . 31 ASN ND2 1 1 7 4778 1 1 27 ASN O O -6.686 6.268 -2.145 1.00 . A A . 31 ASN O 1 1 7 4779 1 1 27 ASN OD1 O -7.737 4.540 0.002 1.00 . A A . 31 ASN OD1 1 1 7 4780 1 1 28 HIS C C -9.659 5.265 -2.956 1.00 . A A . 32 HIS C 1 1 7 4781 1 1 28 HIS CA C -8.429 5.106 -3.862 1.00 . A A . 32 HIS CA 1 1 7 4782 1 1 28 HIS CB C -8.754 4.201 -5.051 1.00 . A A . 32 HIS CB 1 1 7 4783 1 1 28 HIS CD2 C -7.577 4.827 -7.317 1.00 . A A . 32 HIS CD2 1 1 7 4784 1 1 28 HIS CE1 C -8.881 6.453 -7.909 1.00 . A A . 32 HIS CE1 1 1 7 4785 1 1 28 HIS CG C -8.528 4.954 -6.333 1.00 . A A . 32 HIS CG 1 1 7 4786 1 1 28 HIS H H -7.200 3.443 -3.260 1.00 . A A . 32 HIS H 1 1 7 4787 1 1 28 HIS HA H -8.095 6.069 -4.214 1.00 . A A . 32 HIS HA 1 1 7 4788 1 1 28 HIS HB2 H -8.115 3.331 -5.027 1.00 . A A . 32 HIS HB2 1 1 7 4789 1 1 28 HIS HB3 H -9.787 3.890 -4.996 1.00 . A A . 32 HIS HB3 1 1 7 4790 1 1 28 HIS HD1 H -10.127 6.340 -6.246 1.00 . A A . 32 HIS HD1 1 1 7 4791 1 1 28 HIS HD2 H -6.777 4.102 -7.318 1.00 . A A . 32 HIS HD2 1 1 7 4792 1 1 28 HIS HE1 H -9.324 7.269 -8.462 1.00 . A A . 32 HIS HE1 1 1 7 4793 1 1 28 HIS N N -7.332 4.407 -3.135 1.00 . A A . 32 HIS N 1 1 7 4794 1 1 28 HIS ND1 N -9.349 5.997 -6.733 1.00 . A A . 32 HIS ND1 1 1 7 4795 1 1 28 HIS NE2 N -7.803 5.775 -8.311 1.00 . A A . 32 HIS NE2 1 1 7 4796 1 1 28 HIS O O -10.662 5.820 -3.354 1.00 . A A . 32 HIS O 1 1 7 4797 1 1 29 ILE C C -10.578 6.241 -0.034 1.00 . A A . 33 ILE C 1 1 7 4798 1 1 29 ILE CA C -10.753 4.945 -0.810 1.00 . A A . 33 ILE CA 1 1 7 4799 1 1 29 ILE CB C -10.747 3.749 0.174 1.00 . A A . 33 ILE CB 1 1 7 4800 1 1 29 ILE CD1 C -10.212 1.291 0.463 1.00 . A A . 33 ILE CD1 1 1 7 4801 1 1 29 ILE CG1 C -9.988 2.535 -0.407 1.00 . A A . 33 ILE CG1 1 1 7 4802 1 1 29 ILE CG2 C -12.199 3.357 0.467 1.00 . A A . 33 ILE CG2 1 1 7 4803 1 1 29 ILE H H -8.766 4.368 -1.423 1.00 . A A . 33 ILE H 1 1 7 4804 1 1 29 ILE HA H -11.676 4.962 -1.369 1.00 . A A . 33 ILE HA 1 1 7 4805 1 1 29 ILE HB H -10.274 4.058 1.097 1.00 . A A . 33 ILE HB 1 1 7 4806 1 1 29 ILE HD11 H -11.196 0.890 0.271 1.00 . A A . 33 ILE HD11 1 1 7 4807 1 1 29 ILE HD12 H -10.129 1.561 1.505 1.00 . A A . 33 ILE HD12 1 1 7 4808 1 1 29 ILE HD13 H -9.468 0.545 0.223 1.00 . A A . 33 ILE HD13 1 1 7 4809 1 1 29 ILE HG12 H -10.336 2.345 -1.409 1.00 . A A . 33 ILE HG12 1 1 7 4810 1 1 29 ILE HG13 H -8.932 2.759 -0.431 1.00 . A A . 33 ILE HG13 1 1 7 4811 1 1 29 ILE HG21 H -12.226 2.676 1.306 1.00 . A A . 33 ILE HG21 1 1 7 4812 1 1 29 ILE HG22 H -12.624 2.874 -0.399 1.00 . A A . 33 ILE HG22 1 1 7 4813 1 1 29 ILE HG23 H -12.770 4.242 0.705 1.00 . A A . 33 ILE HG23 1 1 7 4814 1 1 29 ILE N N -9.586 4.798 -1.736 1.00 . A A . 33 ILE N 1 1 7 4815 1 1 29 ILE O O -11.387 7.146 -0.105 1.00 . A A . 33 ILE O 1 1 7 4816 1 1 30 ASP C C -8.376 8.542 0.649 1.00 . A A . 34 ASP C 1 1 7 4817 1 1 30 ASP CA C -9.239 7.578 1.475 1.00 . A A . 34 ASP CA 1 1 7 4818 1 1 30 ASP CB C -8.483 7.112 2.719 1.00 . A A . 34 ASP CB 1 1 7 4819 1 1 30 ASP CG C -9.481 6.820 3.842 1.00 . A A . 34 ASP CG 1 1 7 4820 1 1 30 ASP H H -8.866 5.591 0.720 1.00 . A A . 34 ASP H 1 1 7 4821 1 1 30 ASP HA H -10.166 8.050 1.761 1.00 . A A . 34 ASP HA 1 1 7 4822 1 1 30 ASP HB2 H -7.929 6.213 2.487 1.00 . A A . 34 ASP HB2 1 1 7 4823 1 1 30 ASP HB3 H -7.799 7.884 3.036 1.00 . A A . 34 ASP HB3 1 1 7 4824 1 1 30 ASP N N -9.507 6.337 0.696 1.00 . A A . 34 ASP N 1 1 7 4825 1 1 30 ASP O O -7.871 9.525 1.156 1.00 . A A . 34 ASP O 1 1 7 4826 1 1 30 ASP OD1 O -10.604 6.461 3.532 1.00 . A A . 34 ASP OD1 1 1 7 4827 1 1 30 ASP OD2 O -9.103 6.962 4.995 1.00 . A A . 34 ASP OD2 1 1 7 4828 1 1 31 GLN C C -6.019 9.443 -0.811 1.00 . A A . 35 GLN C 1 1 7 4829 1 1 31 GLN CA C -7.372 9.172 -1.476 1.00 . A A . 35 GLN CA 1 1 7 4830 1 1 31 GLN CB C -8.180 10.465 -1.590 1.00 . A A . 35 GLN CB 1 1 7 4831 1 1 31 GLN CD C -9.689 10.676 -3.571 1.00 . A A . 35 GLN CD 1 1 7 4832 1 1 31 GLN CG C -9.573 10.150 -2.139 1.00 . A A . 35 GLN CG 1 1 7 4833 1 1 31 GLN H H -8.614 7.476 -1.016 1.00 . A A . 35 GLN H 1 1 7 4834 1 1 31 GLN HA H -7.230 8.739 -2.453 1.00 . A A . 35 GLN HA 1 1 7 4835 1 1 31 GLN HB2 H -8.271 10.920 -0.615 1.00 . A A . 35 GLN HB2 1 1 7 4836 1 1 31 GLN HB3 H -7.675 11.146 -2.259 1.00 . A A . 35 GLN HB3 1 1 7 4837 1 1 31 GLN HE21 H -8.692 9.151 -4.361 1.00 . A A . 35 GLN HE21 1 1 7 4838 1 1 31 GLN HE22 H -9.226 10.320 -5.469 1.00 . A A . 35 GLN HE22 1 1 7 4839 1 1 31 GLN HG2 H -9.728 9.081 -2.135 1.00 . A A . 35 GLN HG2 1 1 7 4840 1 1 31 GLN HG3 H -10.319 10.625 -1.520 1.00 . A A . 35 GLN HG3 1 1 7 4841 1 1 31 GLN N N -8.201 8.271 -0.621 1.00 . A A . 35 GLN N 1 1 7 4842 1 1 31 GLN NE2 N -9.158 9.993 -4.548 1.00 . A A . 35 GLN NE2 1 1 7 4843 1 1 31 GLN O O -5.781 10.511 -0.285 1.00 . A A . 35 GLN O 1 1 7 4844 1 1 31 GLN OE1 O -10.267 11.719 -3.803 1.00 . A A . 35 GLN OE1 1 1 7 4845 1 1 32 THR C C -2.758 7.729 -0.740 1.00 . A A . 36 THR C 1 1 7 4846 1 1 32 THR CA C -3.799 8.707 -0.188 1.00 . A A . 36 THR CA 1 1 7 4847 1 1 32 THR CB C -4.030 8.454 1.303 1.00 . A A . 36 THR CB 1 1 7 4848 1 1 32 THR CG2 C -4.552 9.730 1.965 1.00 . A A . 36 THR CG2 1 1 7 4849 1 1 32 THR H H -5.341 7.623 -1.256 1.00 . A A . 36 THR H 1 1 7 4850 1 1 32 THR HA H -3.475 9.724 -0.340 1.00 . A A . 36 THR HA 1 1 7 4851 1 1 32 THR HB H -3.100 8.167 1.768 1.00 . A A . 36 THR HB 1 1 7 4852 1 1 32 THR HG1 H -4.514 6.621 1.737 1.00 . A A . 36 THR HG1 1 1 7 4853 1 1 32 THR HG21 H -5.624 9.664 2.080 1.00 . A A . 36 THR HG21 1 1 7 4854 1 1 32 THR HG22 H -4.310 10.581 1.346 1.00 . A A . 36 THR HG22 1 1 7 4855 1 1 32 THR HG23 H -4.092 9.847 2.934 1.00 . A A . 36 THR HG23 1 1 7 4856 1 1 32 THR N N -5.132 8.485 -0.827 1.00 . A A . 36 THR N 1 1 7 4857 1 1 32 THR O O -3.064 6.868 -1.541 1.00 . A A . 36 THR O 1 1 7 4858 1 1 32 THR OG1 O -4.983 7.411 1.462 1.00 . A A . 36 THR OG1 1 1 7 4859 1 1 33 THR C C 0.409 6.459 0.352 1.00 . A A . 37 THR C 1 1 7 4860 1 1 33 THR CA C -0.466 6.929 -0.810 1.00 . A A . 37 THR CA 1 1 7 4861 1 1 33 THR CB C 0.379 7.753 -1.782 1.00 . A A . 37 THR CB 1 1 7 4862 1 1 33 THR CG2 C -0.515 8.388 -2.844 1.00 . A A . 37 THR CG2 1 1 7 4863 1 1 33 THR H H -1.305 8.555 0.332 1.00 . A A . 37 THR H 1 1 7 4864 1 1 33 THR HA H -0.903 6.087 -1.321 1.00 . A A . 37 THR HA 1 1 7 4865 1 1 33 THR HB H 1.101 7.110 -2.265 1.00 . A A . 37 THR HB 1 1 7 4866 1 1 33 THR HG1 H 1.693 8.351 -0.481 1.00 . A A . 37 THR HG1 1 1 7 4867 1 1 33 THR HG21 H -1.492 7.928 -2.811 1.00 . A A . 37 THR HG21 1 1 7 4868 1 1 33 THR HG22 H -0.078 8.230 -3.820 1.00 . A A . 37 THR HG22 1 1 7 4869 1 1 33 THR HG23 H -0.606 9.445 -2.656 1.00 . A A . 37 THR HG23 1 1 7 4870 1 1 33 THR N N -1.528 7.854 -0.315 1.00 . A A . 37 THR N 1 1 7 4871 1 1 33 THR O O 1.128 7.235 0.949 1.00 . A A . 37 THR O 1 1 7 4872 1 1 33 THR OG1 O 1.060 8.772 -1.065 1.00 . A A . 37 THR OG1 1 1 7 4873 1 1 34 THR C C 2.237 3.692 1.233 1.00 . A A . 38 THR C 1 1 7 4874 1 1 34 THR CA C 1.226 4.696 1.783 1.00 . A A . 38 THR CA 1 1 7 4875 1 1 34 THR CB C 0.270 4.023 2.769 1.00 . A A . 38 THR CB 1 1 7 4876 1 1 34 THR CG2 C -0.431 2.854 2.084 1.00 . A A . 38 THR CG2 1 1 7 4877 1 1 34 THR H H -0.207 4.576 0.167 1.00 . A A . 38 THR H 1 1 7 4878 1 1 34 THR HA H 1.735 5.517 2.264 1.00 . A A . 38 THR HA 1 1 7 4879 1 1 34 THR HB H -0.469 4.736 3.099 1.00 . A A . 38 THR HB 1 1 7 4880 1 1 34 THR HG1 H 0.389 3.120 4.487 1.00 . A A . 38 THR HG1 1 1 7 4881 1 1 34 THR HG21 H 0.306 2.180 1.674 1.00 . A A . 38 THR HG21 1 1 7 4882 1 1 34 THR HG22 H -1.059 3.230 1.290 1.00 . A A . 38 THR HG22 1 1 7 4883 1 1 34 THR HG23 H -1.040 2.327 2.805 1.00 . A A . 38 THR HG23 1 1 7 4884 1 1 34 THR N N 0.370 5.197 0.670 1.00 . A A . 38 THR N 1 1 7 4885 1 1 34 THR O O 1.918 2.883 0.387 1.00 . A A . 38 THR O 1 1 7 4886 1 1 34 THR OG1 O 1.004 3.548 3.888 1.00 . A A . 38 THR OG1 1 1 7 4887 1 1 35 TRP C C 4.110 1.358 1.588 1.00 . A A . 39 TRP C 1 1 7 4888 1 1 35 TRP CA C 4.476 2.786 1.173 1.00 . A A . 39 TRP CA 1 1 7 4889 1 1 35 TRP CB C 5.816 3.189 1.810 1.00 . A A . 39 TRP CB 1 1 7 4890 1 1 35 TRP CD1 C 5.794 5.530 2.773 1.00 . A A . 39 TRP CD1 1 1 7 4891 1 1 35 TRP CD2 C 6.547 5.492 0.651 1.00 . A A . 39 TRP CD2 1 1 7 4892 1 1 35 TRP CE2 C 6.593 6.839 1.080 1.00 . A A . 39 TRP CE2 1 1 7 4893 1 1 35 TRP CE3 C 6.974 5.205 -0.662 1.00 . A A . 39 TRP CE3 1 1 7 4894 1 1 35 TRP CG C 6.033 4.675 1.750 1.00 . A A . 39 TRP CG 1 1 7 4895 1 1 35 TRP CH2 C 7.468 7.555 -1.046 1.00 . A A . 39 TRP CH2 1 1 7 4896 1 1 35 TRP CZ2 C 7.046 7.861 0.248 1.00 . A A . 39 TRP CZ2 1 1 7 4897 1 1 35 TRP CZ3 C 7.430 6.231 -1.499 1.00 . A A . 39 TRP CZ3 1 1 7 4898 1 1 35 TRP H H 3.697 4.404 2.370 1.00 . A A . 39 TRP H 1 1 7 4899 1 1 35 TRP HA H 4.541 2.854 0.099 1.00 . A A . 39 TRP HA 1 1 7 4900 1 1 35 TRP HB2 H 5.824 2.873 2.843 1.00 . A A . 39 TRP HB2 1 1 7 4901 1 1 35 TRP HB3 H 6.619 2.694 1.284 1.00 . A A . 39 TRP HB3 1 1 7 4902 1 1 35 TRP HD1 H 5.404 5.255 3.742 1.00 . A A . 39 TRP HD1 1 1 7 4903 1 1 35 TRP HE1 H 6.043 7.614 2.929 1.00 . A A . 39 TRP HE1 1 1 7 4904 1 1 35 TRP HE3 H 6.945 4.194 -1.034 1.00 . A A . 39 TRP HE3 1 1 7 4905 1 1 35 TRP HH2 H 7.823 8.340 -1.699 1.00 . A A . 39 TRP HH2 1 1 7 4906 1 1 35 TRP HZ2 H 7.071 8.879 0.605 1.00 . A A . 39 TRP HZ2 1 1 7 4907 1 1 35 TRP HZ3 H 7.761 5.995 -2.500 1.00 . A A . 39 TRP HZ3 1 1 7 4908 1 1 35 TRP N N 3.454 3.741 1.693 1.00 . A A . 39 TRP N 1 1 7 4909 1 1 35 TRP NE1 N 6.123 6.811 2.375 1.00 . A A . 39 TRP NE1 1 1 7 4910 1 1 35 TRP O O 4.388 0.407 0.887 1.00 . A A . 39 TRP O 1 1 7 4911 1 1 36 GLN C C 1.655 -0.462 2.821 1.00 . A A . 40 GLN C 1 1 7 4912 1 1 36 GLN CA C 3.111 -0.164 3.188 1.00 . A A . 40 GLN CA 1 1 7 4913 1 1 36 GLN CB C 3.286 -0.131 4.707 1.00 . A A . 40 GLN CB 1 1 7 4914 1 1 36 GLN CD C 5.092 -0.550 6.383 1.00 . A A . 40 GLN CD 1 1 7 4915 1 1 36 GLN CG C 4.422 -1.074 5.110 1.00 . A A . 40 GLN CG 1 1 7 4916 1 1 36 GLN H H 3.278 1.983 3.279 1.00 . A A . 40 GLN H 1 1 7 4917 1 1 36 GLN HA H 3.768 -0.903 2.758 1.00 . A A . 40 GLN HA 1 1 7 4918 1 1 36 GLN HB2 H 3.525 0.874 5.020 1.00 . A A . 40 GLN HB2 1 1 7 4919 1 1 36 GLN HB3 H 2.370 -0.448 5.182 1.00 . A A . 40 GLN HB3 1 1 7 4920 1 1 36 GLN HE21 H 4.003 -1.688 7.592 1.00 . A A . 40 GLN HE21 1 1 7 4921 1 1 36 GLN HE22 H 5.134 -0.683 8.363 1.00 . A A . 40 GLN HE22 1 1 7 4922 1 1 36 GLN HG2 H 4.025 -2.060 5.292 1.00 . A A . 40 GLN HG2 1 1 7 4923 1 1 36 GLN HG3 H 5.150 -1.120 4.314 1.00 . A A . 40 GLN HG3 1 1 7 4924 1 1 36 GLN N N 3.493 1.202 2.726 1.00 . A A . 40 GLN N 1 1 7 4925 1 1 36 GLN NE2 N 4.712 -1.012 7.542 1.00 . A A . 40 GLN NE2 1 1 7 4926 1 1 36 GLN O O 1.087 0.156 1.943 1.00 . A A . 40 GLN O 1 1 7 4927 1 1 36 GLN OE1 O 5.969 0.288 6.320 1.00 . A A . 40 GLN OE1 1 1 7 4928 1 1 37 ASP C C -1.219 -1.714 4.454 1.00 . A A . 41 ASP C 1 1 7 4929 1 1 37 ASP CA C -0.373 -1.743 3.174 1.00 . A A . 41 ASP CA 1 1 7 4930 1 1 37 ASP CB C -0.326 -3.157 2.594 1.00 . A A . 41 ASP CB 1 1 7 4931 1 1 37 ASP CG C 0.361 -4.095 3.591 1.00 . A A . 41 ASP CG 1 1 7 4932 1 1 37 ASP H H 1.522 -1.894 4.191 1.00 . A A . 41 ASP H 1 1 7 4933 1 1 37 ASP HA H -0.770 -1.058 2.442 1.00 . A A . 41 ASP HA 1 1 7 4934 1 1 37 ASP HB2 H -1.330 -3.503 2.409 1.00 . A A . 41 ASP HB2 1 1 7 4935 1 1 37 ASP HB3 H 0.230 -3.148 1.667 1.00 . A A . 41 ASP HB3 1 1 7 4936 1 1 37 ASP N N 1.047 -1.405 3.485 1.00 . A A . 41 ASP N 1 1 7 4937 1 1 37 ASP O O -0.688 -1.813 5.543 1.00 . A A . 41 ASP O 1 1 7 4938 1 1 37 ASP OD1 O 1.558 -3.957 3.775 1.00 . A A . 41 ASP OD1 1 1 7 4939 1 1 37 ASP OD2 O -0.324 -4.934 4.152 1.00 . A A . 41 ASP OD2 1 1 7 4940 1 1 38 PRO C C -3.553 -2.931 6.077 1.00 . A A . 42 PRO C 1 1 7 4941 1 1 38 PRO CA C -3.427 -1.539 5.450 1.00 . A A . 42 PRO CA 1 1 7 4942 1 1 38 PRO CB C -4.757 -1.091 4.850 1.00 . A A . 42 PRO CB 1 1 7 4943 1 1 38 PRO CD C -3.237 -1.451 3.010 1.00 . A A . 42 PRO CD 1 1 7 4944 1 1 38 PRO CG C -4.689 -1.499 3.412 1.00 . A A . 42 PRO CG 1 1 7 4945 1 1 38 PRO HA H -3.088 -0.820 6.178 1.00 . A A . 42 PRO HA 1 1 7 4946 1 1 38 PRO HB2 H -5.579 -1.591 5.342 1.00 . A A . 42 PRO HB2 1 1 7 4947 1 1 38 PRO HB3 H -4.865 -0.020 4.931 1.00 . A A . 42 PRO HB3 1 1 7 4948 1 1 38 PRO HD2 H -2.999 -2.275 2.353 1.00 . A A . 42 PRO HD2 1 1 7 4949 1 1 38 PRO HD3 H -3.007 -0.509 2.534 1.00 . A A . 42 PRO HD3 1 1 7 4950 1 1 38 PRO HG2 H -5.071 -2.502 3.294 1.00 . A A . 42 PRO HG2 1 1 7 4951 1 1 38 PRO HG3 H -5.261 -0.812 2.807 1.00 . A A . 42 PRO HG3 1 1 7 4952 1 1 38 PRO N N -2.512 -1.578 4.283 1.00 . A A . 42 PRO N 1 1 7 4953 1 1 38 PRO O O -2.748 -3.806 5.829 1.00 . A A . 42 PRO O 1 1 7 4954 1 1 39 ARG C C -3.500 -4.856 8.339 1.00 . A A . 43 ARG C 1 1 7 4955 1 1 39 ARG CA C -4.745 -4.472 7.532 1.00 . A A . 43 ARG CA 1 1 7 4956 1 1 39 ARG CB C -4.979 -5.454 6.379 1.00 . A A . 43 ARG CB 1 1 7 4957 1 1 39 ARG CD C -6.742 -6.555 4.992 1.00 . A A . 43 ARG CD 1 1 7 4958 1 1 39 ARG CG C -6.471 -5.780 6.282 1.00 . A A . 43 ARG CG 1 1 7 4959 1 1 39 ARG CZ C -7.776 -8.454 6.128 1.00 . A A . 43 ARG CZ 1 1 7 4960 1 1 39 ARG H H -5.195 -2.416 7.067 1.00 . A A . 43 ARG H 1 1 7 4961 1 1 39 ARG HA H -5.605 -4.456 8.173 1.00 . A A . 43 ARG HA 1 1 7 4962 1 1 39 ARG HB2 H -4.648 -5.008 5.452 1.00 . A A . 43 ARG HB2 1 1 7 4963 1 1 39 ARG HB3 H -4.422 -6.362 6.560 1.00 . A A . 43 ARG HB3 1 1 7 4964 1 1 39 ARG HD2 H -7.690 -6.260 4.568 1.00 . A A . 43 ARG HD2 1 1 7 4965 1 1 39 ARG HD3 H -5.946 -6.392 4.281 1.00 . A A . 43 ARG HD3 1 1 7 4966 1 1 39 ARG HE H -6.054 -8.589 5.139 1.00 . A A . 43 ARG HE 1 1 7 4967 1 1 39 ARG HG2 H -6.763 -6.381 7.131 1.00 . A A . 43 ARG HG2 1 1 7 4968 1 1 39 ARG HG3 H -7.040 -4.862 6.279 1.00 . A A . 43 ARG HG3 1 1 7 4969 1 1 39 ARG HH11 H -8.771 -6.712 6.243 1.00 . A A . 43 ARG HH11 1 1 7 4970 1 1 39 ARG HH12 H -9.510 -8.052 7.051 1.00 . A A . 43 ARG HH12 1 1 7 4971 1 1 39 ARG HH21 H -7.034 -10.313 6.194 1.00 . A A . 43 ARG HH21 1 1 7 4972 1 1 39 ARG HH22 H -8.534 -10.075 7.024 1.00 . A A . 43 ARG HH22 1 1 7 4973 1 1 39 ARG N N -4.559 -3.139 6.885 1.00 . A A . 43 ARG N 1 1 7 4974 1 1 39 ARG NE N -6.781 -7.988 5.407 1.00 . A A . 43 ARG NE 1 1 7 4975 1 1 39 ARG NH1 N -8.762 -7.677 6.502 1.00 . A A . 43 ARG NH1 1 1 7 4976 1 1 39 ARG NH2 N -7.782 -9.713 6.476 1.00 . A A . 43 ARG NH2 1 1 7 4977 1 1 39 ARG O O -3.416 -4.598 9.524 1.00 . A A . 43 ARG O 1 1 7 4978 1 1 40 LYS C C -0.697 -4.643 9.162 1.00 . A A . 44 LYS C 1 1 7 4979 1 1 40 LYS CA C -1.298 -5.857 8.448 1.00 . A A . 44 LYS CA 1 1 7 4980 1 1 40 LYS CB C -0.344 -6.375 7.371 1.00 . A A . 44 LYS CB 1 1 7 4981 1 1 40 LYS CD C -1.653 -8.059 6.071 1.00 . A A . 44 LYS CD 1 1 7 4982 1 1 40 LYS CE C -1.308 -9.284 5.223 1.00 . A A . 44 LYS CE 1 1 7 4983 1 1 40 LYS CG C -0.585 -7.869 7.150 1.00 . A A . 44 LYS CG 1 1 7 4984 1 1 40 LYS H H -2.618 -5.659 6.758 1.00 . A A . 44 LYS H 1 1 7 4985 1 1 40 LYS HA H -1.516 -6.643 9.156 1.00 . A A . 44 LYS HA 1 1 7 4986 1 1 40 LYS HB2 H -0.520 -5.841 6.450 1.00 . A A . 44 LYS HB2 1 1 7 4987 1 1 40 LYS HB3 H 0.677 -6.217 7.689 1.00 . A A . 44 LYS HB3 1 1 7 4988 1 1 40 LYS HD2 H -2.615 -8.205 6.539 1.00 . A A . 44 LYS HD2 1 1 7 4989 1 1 40 LYS HD3 H -1.689 -7.182 5.441 1.00 . A A . 44 LYS HD3 1 1 7 4990 1 1 40 LYS HE2 H -1.524 -9.093 4.182 1.00 . A A . 44 LYS HE2 1 1 7 4991 1 1 40 LYS HE3 H -0.268 -9.549 5.349 1.00 . A A . 44 LYS HE3 1 1 7 4992 1 1 40 LYS HG2 H 0.335 -8.339 6.833 1.00 . A A . 44 LYS HG2 1 1 7 4993 1 1 40 LYS HG3 H -0.921 -8.320 8.072 1.00 . A A . 44 LYS HG3 1 1 7 4994 1 1 40 LYS HZ1 H -1.962 -11.260 5.258 1.00 . A A . 44 LYS HZ1 1 1 7 4995 1 1 40 LYS HZ2 H -3.182 -10.120 5.572 1.00 . A A . 44 LYS HZ2 1 1 7 4996 1 1 40 LYS HZ3 H -2.028 -10.484 6.764 1.00 . A A . 44 LYS HZ3 1 1 7 4997 1 1 40 LYS N N -2.533 -5.463 7.713 1.00 . A A . 44 LYS N 1 1 7 4998 1 1 40 LYS NZ N -2.186 -10.369 5.743 1.00 . A A . 44 LYS NZ 1 1 7 4999 1 1 40 LYS O O -0.228 -3.751 8.476 1.00 . A A . 44 LYS O 1 1 7 5000 1 1 40 LYS OXT O -0.716 -4.630 10.381 1.00 . A A . 44 LYS OXT 1 1 7 5001 2 2 1 ACE C C 6.457 14.499 1.957 1.00 . B B . 45 ACE C 1 1 7 5002 2 2 1 ACE CH3 C 7.404 15.610 2.415 1.00 . B B . 45 ACE CH3 1 1 7 5003 2 2 1 ACE H1 H 8.093 15.215 3.147 1.00 . B B . 45 ACE H1 1 1 7 5004 2 2 1 ACE H2 H 6.831 16.412 2.856 1.00 . B B . 45 ACE H2 1 1 7 5005 2 2 1 ACE H3 H 7.957 15.986 1.567 1.00 . B B . 45 ACE H3 1 1 7 5006 2 2 1 ACE O O 5.362 14.765 1.502 1.00 . B B . 45 ACE O 1 1 7 5007 2 2 2 PRO C C 6.892 11.870 0.062 1.00 . B B . 46 PRO C 1 1 7 5008 2 2 2 PRO CA C 7.754 12.701 1.017 1.00 . B B . 46 PRO CA 1 1 7 5009 2 2 2 PRO CB C 8.747 11.813 1.762 1.00 . B B . 46 PRO CB 1 1 7 5010 2 2 2 PRO CD C 7.159 12.619 3.383 1.00 . B B . 46 PRO CD 1 1 7 5011 2 2 2 PRO CG C 8.065 11.466 3.041 1.00 . B B . 46 PRO CG 1 1 7 5012 2 2 2 PRO HA H 8.279 13.475 0.480 1.00 . B B . 46 PRO HA 1 1 7 5013 2 2 2 PRO HB2 H 8.954 10.921 1.187 1.00 . B B . 46 PRO HB2 1 1 7 5014 2 2 2 PRO HB3 H 9.658 12.353 1.963 1.00 . B B . 46 PRO HB3 1 1 7 5015 2 2 2 PRO HD2 H 6.233 12.257 3.807 1.00 . B B . 46 PRO HD2 1 1 7 5016 2 2 2 PRO HD3 H 7.649 13.296 4.064 1.00 . B B . 46 PRO HD3 1 1 7 5017 2 2 2 PRO HG2 H 7.485 10.560 2.915 1.00 . B B . 46 PRO HG2 1 1 7 5018 2 2 2 PRO HG3 H 8.794 11.333 3.825 1.00 . B B . 46 PRO HG3 1 1 7 5019 2 2 2 PRO N N 6.914 13.285 2.096 1.00 . B B . 46 PRO N 1 1 7 5020 2 2 2 PRO O O 7.057 11.918 -1.140 1.00 . B B . 46 PRO O 1 1 7 5021 2 2 3 LEU C C 4.302 11.169 -1.247 1.00 . B B . 47 LEU C 1 1 7 5022 2 2 3 LEU CA C 5.103 10.273 -0.289 1.00 . B B . 47 LEU CA 1 1 7 5023 2 2 3 LEU CB C 4.168 9.528 0.667 1.00 . B B . 47 LEU CB 1 1 7 5024 2 2 3 LEU CD1 C 1.948 10.216 1.582 1.00 . B B . 47 LEU CD1 1 1 7 5025 2 2 3 LEU CD2 C 3.999 10.426 2.991 1.00 . B B . 47 LEU CD2 1 1 7 5026 2 2 3 LEU CG C 3.446 10.530 1.569 1.00 . B B . 47 LEU CG 1 1 7 5027 2 2 3 LEU H H 5.856 11.083 1.561 1.00 . B B . 47 LEU H 1 1 7 5028 2 2 3 LEU HA H 5.698 9.568 -0.845 1.00 . B B . 47 LEU HA 1 1 7 5029 2 2 3 LEU HB2 H 3.442 8.970 0.096 1.00 . B B . 47 LEU HB2 1 1 7 5030 2 2 3 LEU HB3 H 4.747 8.849 1.276 1.00 . B B . 47 LEU HB3 1 1 7 5031 2 2 3 LEU HD11 H 1.431 10.951 2.179 1.00 . B B . 47 LEU HD11 1 1 7 5032 2 2 3 LEU HD12 H 1.790 9.233 2.002 1.00 . B B . 47 LEU HD12 1 1 7 5033 2 2 3 LEU HD13 H 1.567 10.237 0.571 1.00 . B B . 47 LEU HD13 1 1 7 5034 2 2 3 LEU HD21 H 4.028 11.407 3.440 1.00 . B B . 47 LEU HD21 1 1 7 5035 2 2 3 LEU HD22 H 4.997 10.014 2.961 1.00 . B B . 47 LEU HD22 1 1 7 5036 2 2 3 LEU HD23 H 3.362 9.781 3.580 1.00 . B B . 47 LEU HD23 1 1 7 5037 2 2 3 LEU HG H 3.600 11.531 1.194 1.00 . B B . 47 LEU HG 1 1 7 5038 2 2 3 LEU N N 5.974 11.106 0.589 1.00 . B B . 47 LEU N 1 1 7 5039 2 2 3 LEU O O 4.192 12.359 -1.028 1.00 . B B . 47 LEU O 1 1 7 5040 2 2 4 PRO C C 1.630 11.751 -2.698 1.00 . B B . 48 PRO C 1 1 7 5041 2 2 4 PRO CA C 2.985 11.332 -3.286 1.00 . B B . 48 PRO CA 1 1 7 5042 2 2 4 PRO CB C 2.787 10.333 -4.425 1.00 . B B . 48 PRO CB 1 1 7 5043 2 2 4 PRO CD C 3.857 9.137 -2.629 1.00 . B B . 48 PRO CD 1 1 7 5044 2 2 4 PRO CG C 2.897 8.989 -3.779 1.00 . B B . 48 PRO CG 1 1 7 5045 2 2 4 PRO HA H 3.540 12.185 -3.636 1.00 . B B . 48 PRO HA 1 1 7 5046 2 2 4 PRO HB2 H 1.810 10.456 -4.867 1.00 . B B . 48 PRO HB2 1 1 7 5047 2 2 4 PRO HB3 H 3.558 10.455 -5.171 1.00 . B B . 48 PRO HB3 1 1 7 5048 2 2 4 PRO HD2 H 3.545 8.527 -1.794 1.00 . B B . 48 PRO HD2 1 1 7 5049 2 2 4 PRO HD3 H 4.859 8.878 -2.935 1.00 . B B . 48 PRO HD3 1 1 7 5050 2 2 4 PRO HG2 H 1.929 8.678 -3.414 1.00 . B B . 48 PRO HG2 1 1 7 5051 2 2 4 PRO HG3 H 3.273 8.270 -4.487 1.00 . B B . 48 PRO HG3 1 1 7 5052 2 2 4 PRO N N 3.775 10.566 -2.286 1.00 . B B . 48 PRO N 1 1 7 5053 2 2 4 PRO O O 0.917 10.929 -2.158 1.00 . B B . 48 PRO O 1 1 7 5054 2 2 5 PRO C C -1.109 13.286 -3.322 1.00 . B B . 49 PRO C 1 1 7 5055 2 2 5 PRO CA C 0.013 13.515 -2.301 1.00 . B B . 49 PRO CA 1 1 7 5056 2 2 5 PRO CB C 0.264 15.006 -2.109 1.00 . B B . 49 PRO CB 1 1 7 5057 2 2 5 PRO CD C 2.088 14.088 -3.450 1.00 . B B . 49 PRO CD 1 1 7 5058 2 2 5 PRO CG C 1.363 15.360 -3.071 1.00 . B B . 49 PRO CG 1 1 7 5059 2 2 5 PRO HA H -0.225 13.052 -1.358 1.00 . B B . 49 PRO HA 1 1 7 5060 2 2 5 PRO HB2 H -0.628 15.567 -2.341 1.00 . B B . 49 PRO HB2 1 1 7 5061 2 2 5 PRO HB3 H 0.579 15.203 -1.095 1.00 . B B . 49 PRO HB3 1 1 7 5062 2 2 5 PRO HD2 H 2.104 13.968 -4.523 1.00 . B B . 49 PRO HD2 1 1 7 5063 2 2 5 PRO HD3 H 3.094 14.095 -3.056 1.00 . B B . 49 PRO HD3 1 1 7 5064 2 2 5 PRO HG2 H 0.942 15.814 -3.954 1.00 . B B . 49 PRO HG2 1 1 7 5065 2 2 5 PRO HG3 H 2.052 16.045 -2.601 1.00 . B B . 49 PRO HG3 1 1 7 5066 2 2 5 PRO N N 1.303 13.016 -2.825 1.00 . B B . 49 PRO N 1 1 7 5067 2 2 5 PRO O O -1.885 14.175 -3.612 1.00 . B B . 49 PRO O 1 1 7 5068 2 2 6 TYR C C -2.346 12.925 -5.924 1.00 . B B . 50 TYR C 1 1 7 5069 2 2 6 TYR CA C -2.267 11.809 -4.876 1.00 . B B . 50 TYR CA 1 1 7 5070 2 2 6 TYR CB C -3.564 11.732 -4.071 1.00 . B B . 50 TYR CB 1 1 7 5071 2 2 6 TYR CD1 C -4.906 10.363 -5.707 1.00 . B B . 50 TYR CD1 1 1 7 5072 2 2 6 TYR CD2 C -4.397 9.415 -3.535 1.00 . B B . 50 TYR CD2 1 1 7 5073 2 2 6 TYR CE1 C -5.592 9.195 -6.057 1.00 . B B . 50 TYR CE1 1 1 7 5074 2 2 6 TYR CE2 C -5.084 8.246 -3.886 1.00 . B B . 50 TYR CE2 1 1 7 5075 2 2 6 TYR CG C -4.308 10.473 -4.446 1.00 . B B . 50 TYR CG 1 1 7 5076 2 2 6 TYR CZ C -5.681 8.137 -5.147 1.00 . B B . 50 TYR CZ 1 1 7 5077 2 2 6 TYR H H -0.565 11.401 -3.622 1.00 . B B . 50 TYR H 1 1 7 5078 2 2 6 TYR HA H -2.079 10.861 -5.354 1.00 . B B . 50 TYR HA 1 1 7 5079 2 2 6 TYR HB2 H -3.333 11.715 -3.016 1.00 . B B . 50 TYR HB2 1 1 7 5080 2 2 6 TYR HB3 H -4.178 12.593 -4.292 1.00 . B B . 50 TYR HB3 1 1 7 5081 2 2 6 TYR HD1 H -4.838 11.180 -6.409 1.00 . B B . 50 TYR HD1 1 1 7 5082 2 2 6 TYR HD2 H -3.937 9.499 -2.561 1.00 . B B . 50 TYR HD2 1 1 7 5083 2 2 6 TYR HE1 H -6.053 9.110 -7.031 1.00 . B B . 50 TYR HE1 1 1 7 5084 2 2 6 TYR HE2 H -5.152 7.429 -3.183 1.00 . B B . 50 TYR HE2 1 1 7 5085 2 2 6 TYR HH H -5.715 6.348 -5.816 1.00 . B B . 50 TYR HH 1 1 7 5086 2 2 6 TYR N N -1.199 12.101 -3.870 1.00 . B B . 50 TYR N 1 1 7 5087 2 2 6 TYR O O -3.089 13.867 -5.703 1.00 . B B . 50 TYR O 1 1 7 5088 2 2 6 TYR OXT O -1.665 12.817 -6.929 1.00 . B B . 50 TYR OXT 1 1 7 5089 2 2 6 TYR OH O -6.357 6.984 -5.491 1.00 . B B . 50 TYR OH 1 1 8 5090 1 1 1 PHE C C 5.842 -12.565 12.045 1.00 . A A . 5 PHE C 1 1 8 5091 1 1 1 PHE CA C 5.711 -12.704 13.565 1.00 . A A . 5 PHE CA 1 1 8 5092 1 1 1 PHE CB C 4.357 -12.176 14.038 1.00 . A A . 5 PHE CB 1 1 8 5093 1 1 1 PHE CD1 C 4.109 -13.579 16.118 1.00 . A A . 5 PHE CD1 1 1 8 5094 1 1 1 PHE CD2 C 4.317 -11.175 16.351 1.00 . A A . 5 PHE CD2 1 1 8 5095 1 1 1 PHE CE1 C 4.019 -13.706 17.509 1.00 . A A . 5 PHE CE1 1 1 8 5096 1 1 1 PHE CE2 C 4.227 -11.302 17.742 1.00 . A A . 5 PHE CE2 1 1 8 5097 1 1 1 PHE CG C 4.258 -12.313 15.538 1.00 . A A . 5 PHE CG 1 1 8 5098 1 1 1 PHE CZ C 4.077 -12.568 18.321 1.00 . A A . 5 PHE CZ 1 1 8 5099 1 1 1 PHE HA H 5.829 -13.734 13.861 1.00 . A A . 5 PHE HA 1 1 8 5100 1 1 1 PHE HB2 H 4.260 -11.136 13.764 1.00 . A A . 5 PHE HB2 1 1 8 5101 1 1 1 PHE HB3 H 3.566 -12.746 13.573 1.00 . A A . 5 PHE HB3 1 1 8 5102 1 1 1 PHE HD1 H 4.063 -14.457 15.491 1.00 . A A . 5 PHE HD1 1 1 8 5103 1 1 1 PHE HD2 H 4.433 -10.198 15.905 1.00 . A A . 5 PHE HD2 1 1 8 5104 1 1 1 PHE HE1 H 3.902 -14.683 17.956 1.00 . A A . 5 PHE HE1 1 1 8 5105 1 1 1 PHE HE2 H 4.272 -10.423 18.369 1.00 . A A . 5 PHE HE2 1 1 8 5106 1 1 1 PHE HZ H 4.007 -12.666 19.395 1.00 . A A . 5 PHE HZ 1 1 8 5107 1 1 1 PHE N N 6.721 -11.846 14.248 1.00 . A A . 5 PHE N 1 1 8 5108 1 1 1 PHE O O 5.356 -11.620 11.455 1.00 . A A . 5 PHE O 1 1 8 5109 1 1 2 GLU C C 5.338 -13.788 9.233 1.00 . A A . 6 GLU C 1 1 8 5110 1 1 2 GLU CA C 6.652 -13.420 9.928 1.00 . A A . 6 GLU CA 1 1 8 5111 1 1 2 GLU CB C 7.741 -14.439 9.592 1.00 . A A . 6 GLU CB 1 1 8 5112 1 1 2 GLU CD C 9.362 -14.964 7.765 1.00 . A A . 6 GLU CD 1 1 8 5113 1 1 2 GLU CG C 8.702 -13.838 8.564 1.00 . A A . 6 GLU CG 1 1 8 5114 1 1 2 GLU H H 6.875 -14.254 11.903 1.00 . A A . 6 GLU H 1 1 8 5115 1 1 2 GLU HA H 6.970 -12.432 9.635 1.00 . A A . 6 GLU HA 1 1 8 5116 1 1 2 GLU HB2 H 8.286 -14.693 10.489 1.00 . A A . 6 GLU HB2 1 1 8 5117 1 1 2 GLU HB3 H 7.285 -15.329 9.182 1.00 . A A . 6 GLU HB3 1 1 8 5118 1 1 2 GLU HG2 H 8.154 -13.192 7.894 1.00 . A A . 6 GLU HG2 1 1 8 5119 1 1 2 GLU HG3 H 9.462 -13.266 9.075 1.00 . A A . 6 GLU HG3 1 1 8 5120 1 1 2 GLU N N 6.492 -13.500 11.408 1.00 . A A . 6 GLU N 1 1 8 5121 1 1 2 GLU O O 4.854 -14.897 9.348 1.00 . A A . 6 GLU O 1 1 8 5122 1 1 2 GLU OE1 O 10.278 -15.577 8.288 1.00 . A A . 6 GLU OE1 1 1 8 5123 1 1 2 GLU OE2 O 8.940 -15.193 6.644 1.00 . A A . 6 GLU OE2 1 1 8 5124 1 1 3 ILE C C 3.736 -13.439 6.326 1.00 . A A . 7 ILE C 1 1 8 5125 1 1 3 ILE CA C 3.476 -13.166 7.813 1.00 . A A . 7 ILE CA 1 1 8 5126 1 1 3 ILE CB C 2.628 -11.905 7.986 1.00 . A A . 7 ILE CB 1 1 8 5127 1 1 3 ILE CD1 C 2.039 -10.214 9.728 1.00 . A A . 7 ILE CD1 1 1 8 5128 1 1 3 ILE CG1 C 2.328 -11.694 9.471 1.00 . A A . 7 ILE CG1 1 1 8 5129 1 1 3 ILE CG2 C 1.315 -12.064 7.219 1.00 . A A . 7 ILE CG2 1 1 8 5130 1 1 3 ILE H H 5.165 -11.979 8.436 1.00 . A A . 7 ILE H 1 1 8 5131 1 1 3 ILE HA H 2.983 -14.007 8.272 1.00 . A A . 7 ILE HA 1 1 8 5132 1 1 3 ILE HB H 3.169 -11.052 7.602 1.00 . A A . 7 ILE HB 1 1 8 5133 1 1 3 ILE HD11 H 0.982 -10.080 9.912 1.00 . A A . 7 ILE HD11 1 1 8 5134 1 1 3 ILE HD12 H 2.330 -9.634 8.865 1.00 . A A . 7 ILE HD12 1 1 8 5135 1 1 3 ILE HD13 H 2.599 -9.882 10.590 1.00 . A A . 7 ILE HD13 1 1 8 5136 1 1 3 ILE HG12 H 1.467 -12.283 9.752 1.00 . A A . 7 ILE HG12 1 1 8 5137 1 1 3 ILE HG13 H 3.179 -12.002 10.060 1.00 . A A . 7 ILE HG13 1 1 8 5138 1 1 3 ILE HG21 H 0.679 -12.769 7.733 1.00 . A A . 7 ILE HG21 1 1 8 5139 1 1 3 ILE HG22 H 1.522 -12.425 6.222 1.00 . A A . 7 ILE HG22 1 1 8 5140 1 1 3 ILE HG23 H 0.816 -11.108 7.158 1.00 . A A . 7 ILE HG23 1 1 8 5141 1 1 3 ILE N N 4.759 -12.867 8.514 1.00 . A A . 7 ILE N 1 1 8 5142 1 1 3 ILE O O 4.606 -12.833 5.733 1.00 . A A . 7 ILE O 1 1 8 5143 1 1 4 PRO C C 2.612 -13.557 3.448 1.00 . A A . 8 PRO C 1 1 8 5144 1 1 4 PRO CA C 3.136 -14.692 4.333 1.00 . A A . 8 PRO CA 1 1 8 5145 1 1 4 PRO CB C 2.285 -15.948 4.164 1.00 . A A . 8 PRO CB 1 1 8 5146 1 1 4 PRO CD C 1.899 -15.126 6.401 1.00 . A A . 8 PRO CD 1 1 8 5147 1 1 4 PRO CG C 1.265 -15.872 5.256 1.00 . A A . 8 PRO CG 1 1 8 5148 1 1 4 PRO HA H 4.167 -14.909 4.107 1.00 . A A . 8 PRO HA 1 1 8 5149 1 1 4 PRO HB2 H 1.803 -15.948 3.199 1.00 . A A . 8 PRO HB2 1 1 8 5150 1 1 4 PRO HB3 H 2.895 -16.831 4.280 1.00 . A A . 8 PRO HB3 1 1 8 5151 1 1 4 PRO HD2 H 1.179 -14.472 6.871 1.00 . A A . 8 PRO HD2 1 1 8 5152 1 1 4 PRO HD3 H 2.309 -15.819 7.123 1.00 . A A . 8 PRO HD3 1 1 8 5153 1 1 4 PRO HG2 H 0.392 -15.340 4.908 1.00 . A A . 8 PRO HG2 1 1 8 5154 1 1 4 PRO HG3 H 0.988 -16.867 5.571 1.00 . A A . 8 PRO HG3 1 1 8 5155 1 1 4 PRO N N 2.972 -14.346 5.767 1.00 . A A . 8 PRO N 1 1 8 5156 1 1 4 PRO O O 2.346 -12.466 3.913 1.00 . A A . 8 PRO O 1 1 8 5157 1 1 5 ASP C C 0.622 -13.158 0.647 1.00 . A A . 9 ASP C 1 1 8 5158 1 1 5 ASP CA C 1.960 -12.739 1.262 1.00 . A A . 9 ASP CA 1 1 8 5159 1 1 5 ASP CB C 3.030 -12.607 0.178 1.00 . A A . 9 ASP CB 1 1 8 5160 1 1 5 ASP CG C 3.100 -11.153 -0.294 1.00 . A A . 9 ASP CG 1 1 8 5161 1 1 5 ASP H H 2.686 -14.691 1.819 1.00 . A A . 9 ASP H 1 1 8 5162 1 1 5 ASP HA H 1.855 -11.806 1.792 1.00 . A A . 9 ASP HA 1 1 8 5163 1 1 5 ASP HB2 H 3.987 -12.902 0.579 1.00 . A A . 9 ASP HB2 1 1 8 5164 1 1 5 ASP HB3 H 2.777 -13.244 -0.657 1.00 . A A . 9 ASP HB3 1 1 8 5165 1 1 5 ASP N N 2.465 -13.805 2.175 1.00 . A A . 9 ASP N 1 1 8 5166 1 1 5 ASP O O 0.472 -13.218 -0.556 1.00 . A A . 9 ASP O 1 1 8 5167 1 1 5 ASP OD1 O 3.068 -10.274 0.552 1.00 . A A . 9 ASP OD1 1 1 8 5168 1 1 5 ASP OD2 O 3.186 -10.942 -1.492 1.00 . A A . 9 ASP OD2 1 1 8 5169 1 1 6 ASP C C -2.495 -12.637 0.526 1.00 . A A . 10 ASP C 1 1 8 5170 1 1 6 ASP CA C -1.678 -13.868 0.928 1.00 . A A . 10 ASP CA 1 1 8 5171 1 1 6 ASP CB C -2.357 -14.613 2.076 1.00 . A A . 10 ASP CB 1 1 8 5172 1 1 6 ASP CG C -2.225 -16.122 1.855 1.00 . A A . 10 ASP CG 1 1 8 5173 1 1 6 ASP H H -0.211 -13.399 2.435 1.00 . A A . 10 ASP H 1 1 8 5174 1 1 6 ASP HA H -1.552 -14.528 0.084 1.00 . A A . 10 ASP HA 1 1 8 5175 1 1 6 ASP HB2 H -1.884 -14.345 3.010 1.00 . A A . 10 ASP HB2 1 1 8 5176 1 1 6 ASP HB3 H -3.403 -14.346 2.112 1.00 . A A . 10 ASP HB3 1 1 8 5177 1 1 6 ASP N N -0.352 -13.453 1.467 1.00 . A A . 10 ASP N 1 1 8 5178 1 1 6 ASP O O -2.551 -12.268 -0.630 1.00 . A A . 10 ASP O 1 1 8 5179 1 1 6 ASP OD1 O -1.119 -16.624 1.976 1.00 . A A . 10 ASP OD1 1 1 8 5180 1 1 6 ASP OD2 O -3.231 -16.749 1.569 1.00 . A A . 10 ASP OD2 1 1 8 5181 1 1 7 VAL C C -3.124 -9.518 1.383 1.00 . A A . 11 VAL C 1 1 8 5182 1 1 7 VAL CA C -3.945 -10.794 1.141 1.00 . A A . 11 VAL CA 1 1 8 5183 1 1 7 VAL CB C -5.135 -10.851 2.096 1.00 . A A . 11 VAL CB 1 1 8 5184 1 1 7 VAL CG1 C -6.093 -9.703 1.782 1.00 . A A . 11 VAL CG1 1 1 8 5185 1 1 7 VAL CG2 C -5.861 -12.188 1.924 1.00 . A A . 11 VAL CG2 1 1 8 5186 1 1 7 VAL H H -3.077 -12.312 2.397 1.00 . A A . 11 VAL H 1 1 8 5187 1 1 7 VAL HA H -4.291 -10.840 0.122 1.00 . A A . 11 VAL HA 1 1 8 5188 1 1 7 VAL HB H -4.785 -10.761 3.114 1.00 . A A . 11 VAL HB 1 1 8 5189 1 1 7 VAL HG11 H -6.606 -9.405 2.683 1.00 . A A . 11 VAL HG11 1 1 8 5190 1 1 7 VAL HG12 H -6.815 -10.027 1.047 1.00 . A A . 11 VAL HG12 1 1 8 5191 1 1 7 VAL HG13 H -5.534 -8.865 1.392 1.00 . A A . 11 VAL HG13 1 1 8 5192 1 1 7 VAL HG21 H -6.828 -12.136 2.402 1.00 . A A . 11 VAL HG21 1 1 8 5193 1 1 7 VAL HG22 H -5.277 -12.975 2.376 1.00 . A A . 11 VAL HG22 1 1 8 5194 1 1 7 VAL HG23 H -5.990 -12.393 0.871 1.00 . A A . 11 VAL HG23 1 1 8 5195 1 1 7 VAL N N -3.132 -11.999 1.471 1.00 . A A . 11 VAL N 1 1 8 5196 1 1 7 VAL O O -2.860 -9.165 2.517 1.00 . A A . 11 VAL O 1 1 8 5197 1 1 8 PRO C C -2.848 -6.437 0.822 1.00 . A A . 12 PRO C 1 1 8 5198 1 1 8 PRO CA C -1.948 -7.619 0.437 1.00 . A A . 12 PRO CA 1 1 8 5199 1 1 8 PRO CB C -1.346 -7.436 -0.953 1.00 . A A . 12 PRO CB 1 1 8 5200 1 1 8 PRO CD C -3.011 -9.206 -1.091 1.00 . A A . 12 PRO CD 1 1 8 5201 1 1 8 PRO CG C -2.267 -8.162 -1.890 1.00 . A A . 12 PRO CG 1 1 8 5202 1 1 8 PRO HA H -1.160 -7.746 1.163 1.00 . A A . 12 PRO HA 1 1 8 5203 1 1 8 PRO HB2 H -1.307 -6.387 -1.208 1.00 . A A . 12 PRO HB2 1 1 8 5204 1 1 8 PRO HB3 H -0.357 -7.868 -0.993 1.00 . A A . 12 PRO HB3 1 1 8 5205 1 1 8 PRO HD2 H -4.070 -9.152 -1.296 1.00 . A A . 12 PRO HD2 1 1 8 5206 1 1 8 PRO HD3 H -2.634 -10.193 -1.315 1.00 . A A . 12 PRO HD3 1 1 8 5207 1 1 8 PRO HG2 H -2.968 -7.469 -2.329 1.00 . A A . 12 PRO HG2 1 1 8 5208 1 1 8 PRO HG3 H -1.692 -8.641 -2.668 1.00 . A A . 12 PRO HG3 1 1 8 5209 1 1 8 PRO N N -2.744 -8.861 0.313 1.00 . A A . 12 PRO N 1 1 8 5210 1 1 8 PRO O O -2.988 -6.110 1.984 1.00 . A A . 12 PRO O 1 1 8 5211 1 1 9 LEU C C -5.794 -4.956 -0.220 1.00 . A A . 13 LEU C 1 1 8 5212 1 1 9 LEU CA C -4.348 -4.641 0.189 1.00 . A A . 13 LEU CA 1 1 8 5213 1 1 9 LEU CB C -3.791 -3.474 -0.630 1.00 . A A . 13 LEU CB 1 1 8 5214 1 1 9 LEU CD1 C -1.362 -3.963 -0.968 1.00 . A A . 13 LEU CD1 1 1 8 5215 1 1 9 LEU CD2 C -2.096 -1.658 -0.345 1.00 . A A . 13 LEU CD2 1 1 8 5216 1 1 9 LEU CG C -2.371 -3.151 -0.155 1.00 . A A . 13 LEU CG 1 1 8 5217 1 1 9 LEU H H -3.342 -6.070 -1.067 1.00 . A A . 13 LEU H 1 1 8 5218 1 1 9 LEU HA H -4.295 -4.411 1.241 1.00 . A A . 13 LEU HA 1 1 8 5219 1 1 9 LEU HB2 H -3.769 -3.746 -1.675 1.00 . A A . 13 LEU HB2 1 1 8 5220 1 1 9 LEU HB3 H -4.423 -2.608 -0.496 1.00 . A A . 13 LEU HB3 1 1 8 5221 1 1 9 LEU HD11 H -0.703 -3.292 -1.500 1.00 . A A . 13 LEU HD11 1 1 8 5222 1 1 9 LEU HD12 H -1.888 -4.586 -1.677 1.00 . A A . 13 LEU HD12 1 1 8 5223 1 1 9 LEU HD13 H -0.780 -4.585 -0.304 1.00 . A A . 13 LEU HD13 1 1 8 5224 1 1 9 LEU HD21 H -2.272 -1.388 -1.376 1.00 . A A . 13 LEU HD21 1 1 8 5225 1 1 9 LEU HD22 H -1.068 -1.448 -0.090 1.00 . A A . 13 LEU HD22 1 1 8 5226 1 1 9 LEU HD23 H -2.751 -1.085 0.294 1.00 . A A . 13 LEU HD23 1 1 8 5227 1 1 9 LEU HG H -2.276 -3.403 0.891 1.00 . A A . 13 LEU HG 1 1 8 5228 1 1 9 LEU N N -3.461 -5.795 -0.136 1.00 . A A . 13 LEU N 1 1 8 5229 1 1 9 LEU O O -6.021 -5.756 -1.105 1.00 . A A . 13 LEU O 1 1 8 5230 1 1 10 PRO C C -8.544 -3.918 -1.205 1.00 . A A . 14 PRO C 1 1 8 5231 1 1 10 PRO CA C -8.164 -4.553 0.136 1.00 . A A . 14 PRO CA 1 1 8 5232 1 1 10 PRO CB C -8.896 -3.876 1.290 1.00 . A A . 14 PRO CB 1 1 8 5233 1 1 10 PRO CD C -6.553 -3.338 1.524 1.00 . A A . 14 PRO CD 1 1 8 5234 1 1 10 PRO CG C -7.947 -2.836 1.794 1.00 . A A . 14 PRO CG 1 1 8 5235 1 1 10 PRO HA H -8.384 -5.609 0.131 1.00 . A A . 14 PRO HA 1 1 8 5236 1 1 10 PRO HB2 H -9.807 -3.415 0.939 1.00 . A A . 14 PRO HB2 1 1 8 5237 1 1 10 PRO HB3 H -9.114 -4.593 2.068 1.00 . A A . 14 PRO HB3 1 1 8 5238 1 1 10 PRO HD2 H -5.915 -2.529 1.199 1.00 . A A . 14 PRO HD2 1 1 8 5239 1 1 10 PRO HD3 H -6.144 -3.814 2.403 1.00 . A A . 14 PRO HD3 1 1 8 5240 1 1 10 PRO HG2 H -8.112 -1.905 1.273 1.00 . A A . 14 PRO HG2 1 1 8 5241 1 1 10 PRO HG3 H -8.088 -2.693 2.856 1.00 . A A . 14 PRO HG3 1 1 8 5242 1 1 10 PRO N N -6.730 -4.321 0.443 1.00 . A A . 14 PRO N 1 1 8 5243 1 1 10 PRO O O -7.698 -3.588 -2.010 1.00 . A A . 14 PRO O 1 1 8 5244 1 1 11 ALA C C -9.993 -1.636 -2.747 1.00 . A A . 15 ALA C 1 1 8 5245 1 1 11 ALA CA C -10.259 -3.145 -2.741 1.00 . A A . 15 ALA CA 1 1 8 5246 1 1 11 ALA CB C -11.760 -3.424 -2.816 1.00 . A A . 15 ALA CB 1 1 8 5247 1 1 11 ALA H H -10.484 -4.030 -0.790 1.00 . A A . 15 ALA H 1 1 8 5248 1 1 11 ALA HA H -9.756 -3.618 -3.571 1.00 . A A . 15 ALA HA 1 1 8 5249 1 1 11 ALA HB1 H -12.147 -3.062 -3.756 1.00 . A A . 15 ALA HB1 1 1 8 5250 1 1 11 ALA HB2 H -12.259 -2.920 -2.002 1.00 . A A . 15 ALA HB2 1 1 8 5251 1 1 11 ALA HB3 H -11.933 -4.487 -2.741 1.00 . A A . 15 ALA HB3 1 1 8 5252 1 1 11 ALA N N -9.818 -3.750 -1.452 1.00 . A A . 15 ALA N 1 1 8 5253 1 1 11 ALA O O -9.641 -1.052 -1.740 1.00 . A A . 15 ALA O 1 1 8 5254 1 1 12 GLY C C -8.436 0.769 -3.692 1.00 . A A . 16 GLY C 1 1 8 5255 1 1 12 GLY CA C -9.917 0.467 -3.955 1.00 . A A . 16 GLY CA 1 1 8 5256 1 1 12 GLY H H -10.442 -1.494 -4.675 1.00 . A A . 16 GLY H 1 1 8 5257 1 1 12 GLY HA2 H -10.185 0.823 -4.940 1.00 . A A . 16 GLY HA2 1 1 8 5258 1 1 12 GLY HA3 H -10.522 0.970 -3.215 1.00 . A A . 16 GLY HA3 1 1 8 5259 1 1 12 GLY N N -10.159 -1.002 -3.876 1.00 . A A . 16 GLY N 1 1 8 5260 1 1 12 GLY O O -8.059 1.901 -3.463 1.00 . A A . 16 GLY O 1 1 8 5261 1 1 13 TRP C C -5.316 -0.267 -4.712 1.00 . A A . 17 TRP C 1 1 8 5262 1 1 13 TRP CA C -6.147 0.010 -3.457 1.00 . A A . 17 TRP CA 1 1 8 5263 1 1 13 TRP CB C -5.787 -0.979 -2.355 1.00 . A A . 17 TRP CB 1 1 8 5264 1 1 13 TRP CD1 C -6.985 -0.361 -0.227 1.00 . A A . 17 TRP CD1 1 1 8 5265 1 1 13 TRP CD2 C -4.938 0.552 -0.375 1.00 . A A . 17 TRP CD2 1 1 8 5266 1 1 13 TRP CE2 C -5.480 0.979 0.859 1.00 . A A . 17 TRP CE2 1 1 8 5267 1 1 13 TRP CE3 C -3.651 0.984 -0.722 1.00 . A A . 17 TRP CE3 1 1 8 5268 1 1 13 TRP CG C -5.908 -0.299 -1.038 1.00 . A A . 17 TRP CG 1 1 8 5269 1 1 13 TRP CH2 C -3.481 2.235 1.354 1.00 . A A . 17 TRP CH2 1 1 8 5270 1 1 13 TRP CZ2 C -4.763 1.811 1.720 1.00 . A A . 17 TRP CZ2 1 1 8 5271 1 1 13 TRP CZ3 C -2.928 1.821 0.137 1.00 . A A . 17 TRP CZ3 1 1 8 5272 1 1 13 TRP H H -7.911 -1.138 -3.892 1.00 . A A . 17 TRP H 1 1 8 5273 1 1 13 TRP HA H -5.985 1.019 -3.112 1.00 . A A . 17 TRP HA 1 1 8 5274 1 1 13 TRP HB2 H -6.462 -1.821 -2.392 1.00 . A A . 17 TRP HB2 1 1 8 5275 1 1 13 TRP HB3 H -4.772 -1.322 -2.494 1.00 . A A . 17 TRP HB3 1 1 8 5276 1 1 13 TRP HD1 H -7.891 -0.913 -0.430 1.00 . A A . 17 TRP HD1 1 1 8 5277 1 1 13 TRP HE1 H -7.351 0.517 1.655 1.00 . A A . 17 TRP HE1 1 1 8 5278 1 1 13 TRP HE3 H -3.213 0.671 -1.659 1.00 . A A . 17 TRP HE3 1 1 8 5279 1 1 13 TRP HH2 H -2.913 2.878 2.008 1.00 . A A . 17 TRP HH2 1 1 8 5280 1 1 13 TRP HZ2 H -5.194 2.128 2.658 1.00 . A A . 17 TRP HZ2 1 1 8 5281 1 1 13 TRP HZ3 H -1.944 2.149 -0.142 1.00 . A A . 17 TRP HZ3 1 1 8 5282 1 1 13 TRP N N -7.593 -0.230 -3.716 1.00 . A A . 17 TRP N 1 1 8 5283 1 1 13 TRP NE1 N -6.733 0.396 0.905 1.00 . A A . 17 TRP NE1 1 1 8 5284 1 1 13 TRP O O -5.612 -1.166 -5.475 1.00 . A A . 17 TRP O 1 1 8 5285 1 1 14 GLU C C -1.948 0.300 -5.789 1.00 . A A . 18 GLU C 1 1 8 5286 1 1 14 GLU CA C -3.435 0.259 -6.139 1.00 . A A . 18 GLU CA 1 1 8 5287 1 1 14 GLU CB C -3.766 1.406 -7.095 1.00 . A A . 18 GLU CB 1 1 8 5288 1 1 14 GLU CD C -6.063 1.026 -7.999 1.00 . A A . 18 GLU CD 1 1 8 5289 1 1 14 GLU CG C -4.568 0.871 -8.281 1.00 . A A . 18 GLU CG 1 1 8 5290 1 1 14 GLU H H -4.051 1.217 -4.305 1.00 . A A . 18 GLU H 1 1 8 5291 1 1 14 GLU HA H -3.689 -0.683 -6.597 1.00 . A A . 18 GLU HA 1 1 8 5292 1 1 14 GLU HB2 H -4.342 2.155 -6.576 1.00 . A A . 18 GLU HB2 1 1 8 5293 1 1 14 GLU HB3 H -2.847 1.848 -7.454 1.00 . A A . 18 GLU HB3 1 1 8 5294 1 1 14 GLU HG2 H -4.308 1.427 -9.170 1.00 . A A . 18 GLU HG2 1 1 8 5295 1 1 14 GLU HG3 H -4.335 -0.174 -8.430 1.00 . A A . 18 GLU HG3 1 1 8 5296 1 1 14 GLU N N -4.278 0.495 -4.933 1.00 . A A . 18 GLU N 1 1 8 5297 1 1 14 GLU O O -1.350 1.360 -5.722 1.00 . A A . 18 GLU O 1 1 8 5298 1 1 14 GLU OE1 O -6.515 0.498 -6.995 1.00 . A A . 18 GLU OE1 1 1 8 5299 1 1 14 GLU OE2 O -6.732 1.669 -8.792 1.00 . A A . 18 GLU OE2 1 1 8 5300 1 1 15 MET C C 0.872 -0.381 -6.534 1.00 . A A . 19 MET C 1 1 8 5301 1 1 15 MET CA C 0.122 -0.821 -5.284 1.00 . A A . 19 MET CA 1 1 8 5302 1 1 15 MET CB C 0.516 -2.246 -4.910 1.00 . A A . 19 MET CB 1 1 8 5303 1 1 15 MET CE C -1.735 -4.180 -4.324 1.00 . A A . 19 MET CE 1 1 8 5304 1 1 15 MET CG C 0.150 -3.217 -6.038 1.00 . A A . 19 MET CG 1 1 8 5305 1 1 15 MET H H -1.809 -1.683 -5.657 1.00 . A A . 19 MET H 1 1 8 5306 1 1 15 MET HA H 0.328 -0.150 -4.466 1.00 . A A . 19 MET HA 1 1 8 5307 1 1 15 MET HB2 H 1.577 -2.274 -4.756 1.00 . A A . 19 MET HB2 1 1 8 5308 1 1 15 MET HB3 H 0.019 -2.535 -3.999 1.00 . A A . 19 MET HB3 1 1 8 5309 1 1 15 MET HE1 H -2.423 -4.986 -4.113 1.00 . A A . 19 MET HE1 1 1 8 5310 1 1 15 MET HE2 H -2.251 -3.399 -4.857 1.00 . A A . 19 MET HE2 1 1 8 5311 1 1 15 MET HE3 H -1.344 -3.781 -3.398 1.00 . A A . 19 MET HE3 1 1 8 5312 1 1 15 MET HG2 H -0.653 -2.806 -6.630 1.00 . A A . 19 MET HG2 1 1 8 5313 1 1 15 MET HG3 H 1.011 -3.373 -6.669 1.00 . A A . 19 MET HG3 1 1 8 5314 1 1 15 MET N N -1.329 -0.836 -5.589 1.00 . A A . 19 MET N 1 1 8 5315 1 1 15 MET O O 0.762 -0.976 -7.587 1.00 . A A . 19 MET O 1 1 8 5316 1 1 15 MET SD S -0.368 -4.804 -5.332 1.00 . A A . 19 MET SD 1 1 8 5317 1 1 16 ALA C C 3.653 1.847 -7.068 1.00 . A A . 20 ALA C 1 1 8 5318 1 1 16 ALA CA C 2.383 1.171 -7.590 1.00 . A A . 20 ALA CA 1 1 8 5319 1 1 16 ALA CB C 1.413 2.149 -8.269 1.00 . A A . 20 ALA CB 1 1 8 5320 1 1 16 ALA H H 1.688 1.122 -5.560 1.00 . A A . 20 ALA H 1 1 8 5321 1 1 16 ALA HA H 2.630 0.363 -8.261 1.00 . A A . 20 ALA HA 1 1 8 5322 1 1 16 ALA HB1 H 0.856 1.628 -9.034 1.00 . A A . 20 ALA HB1 1 1 8 5323 1 1 16 ALA HB2 H 1.958 2.962 -8.714 1.00 . A A . 20 ALA HB2 1 1 8 5324 1 1 16 ALA HB3 H 0.725 2.539 -7.532 1.00 . A A . 20 ALA HB3 1 1 8 5325 1 1 16 ALA N N 1.622 0.663 -6.423 1.00 . A A . 20 ALA N 1 1 8 5326 1 1 16 ALA O O 4.162 1.455 -6.035 1.00 . A A . 20 ALA O 1 1 8 5327 1 1 17 LYS C C 5.369 4.979 -7.190 1.00 . A A . 21 LYS C 1 1 8 5328 1 1 17 LYS CA C 5.436 3.456 -7.195 1.00 . A A . 21 LYS CA 1 1 8 5329 1 1 17 LYS CB C 6.560 2.967 -8.106 1.00 . A A . 21 LYS CB 1 1 8 5330 1 1 17 LYS CD C 6.684 2.415 -10.541 1.00 . A A . 21 LYS CD 1 1 8 5331 1 1 17 LYS CE C 7.212 3.064 -11.822 1.00 . A A . 21 LYS CE 1 1 8 5332 1 1 17 LYS CG C 6.340 3.504 -9.522 1.00 . A A . 21 LYS CG 1 1 8 5333 1 1 17 LYS H H 3.801 3.154 -8.572 1.00 . A A . 21 LYS H 1 1 8 5334 1 1 17 LYS HA H 5.601 3.110 -6.195 1.00 . A A . 21 LYS HA 1 1 8 5335 1 1 17 LYS HB2 H 7.508 3.320 -7.730 1.00 . A A . 21 LYS HB2 1 1 8 5336 1 1 17 LYS HB3 H 6.560 1.887 -8.127 1.00 . A A . 21 LYS HB3 1 1 8 5337 1 1 17 LYS HD2 H 7.441 1.763 -10.129 1.00 . A A . 21 LYS HD2 1 1 8 5338 1 1 17 LYS HD3 H 5.798 1.840 -10.766 1.00 . A A . 21 LYS HD3 1 1 8 5339 1 1 17 LYS HE2 H 6.897 4.096 -11.878 1.00 . A A . 21 LYS HE2 1 1 8 5340 1 1 17 LYS HE3 H 8.290 2.996 -11.861 1.00 . A A . 21 LYS HE3 1 1 8 5341 1 1 17 LYS HG2 H 5.307 3.794 -9.640 1.00 . A A . 21 LYS HG2 1 1 8 5342 1 1 17 LYS HG3 H 6.976 4.362 -9.684 1.00 . A A . 21 LYS HG3 1 1 8 5343 1 1 17 LYS HZ1 H 6.650 2.820 -13.812 1.00 . A A . 21 LYS HZ1 1 1 8 5344 1 1 17 LYS HZ2 H 5.608 2.069 -12.700 1.00 . A A . 21 LYS HZ2 1 1 8 5345 1 1 17 LYS HZ3 H 7.123 1.382 -13.046 1.00 . A A . 21 LYS HZ3 1 1 8 5346 1 1 17 LYS N N 4.193 2.836 -7.735 1.00 . A A . 21 LYS N 1 1 8 5347 1 1 17 LYS NZ N 6.602 2.274 -12.929 1.00 . A A . 21 LYS NZ 1 1 8 5348 1 1 17 LYS O O 4.598 5.592 -7.903 1.00 . A A . 21 LYS O 1 1 8 5349 1 1 18 THR C C 7.637 7.577 -6.139 1.00 . A A . 22 THR C 1 1 8 5350 1 1 18 THR CA C 6.203 7.073 -6.284 1.00 . A A . 22 THR CA 1 1 8 5351 1 1 18 THR CB C 5.402 7.405 -5.026 1.00 . A A . 22 THR CB 1 1 8 5352 1 1 18 THR CG2 C 6.010 6.677 -3.823 1.00 . A A . 22 THR CG2 1 1 8 5353 1 1 18 THR H H 6.796 5.053 -5.808 1.00 . A A . 22 THR H 1 1 8 5354 1 1 18 THR HA H 5.731 7.510 -7.149 1.00 . A A . 22 THR HA 1 1 8 5355 1 1 18 THR HB H 4.383 7.092 -5.155 1.00 . A A . 22 THR HB 1 1 8 5356 1 1 18 THR HG1 H 4.964 9.236 -5.516 1.00 . A A . 22 THR HG1 1 1 8 5357 1 1 18 THR HG21 H 5.339 6.746 -2.977 1.00 . A A . 22 THR HG21 1 1 8 5358 1 1 18 THR HG22 H 6.954 7.135 -3.569 1.00 . A A . 22 THR HG22 1 1 8 5359 1 1 18 THR HG23 H 6.170 5.637 -4.069 1.00 . A A . 22 THR HG23 1 1 8 5360 1 1 18 THR N N 6.187 5.585 -6.371 1.00 . A A . 22 THR N 1 1 8 5361 1 1 18 THR O O 8.585 6.859 -6.375 1.00 . A A . 22 THR O 1 1 8 5362 1 1 18 THR OG1 O 5.441 8.808 -4.802 1.00 . A A . 22 THR OG1 1 1 8 5363 1 1 19 SER C C 10.067 9.052 -6.751 1.00 . A A . 23 SER C 1 1 8 5364 1 1 19 SER CA C 9.159 9.392 -5.557 1.00 . A A . 23 SER CA 1 1 8 5365 1 1 19 SER CB C 9.686 8.765 -4.264 1.00 . A A . 23 SER CB 1 1 8 5366 1 1 19 SER H H 6.999 9.356 -5.546 1.00 . A A . 23 SER H 1 1 8 5367 1 1 19 SER HA H 9.090 10.461 -5.438 1.00 . A A . 23 SER HA 1 1 8 5368 1 1 19 SER HB2 H 9.228 9.254 -3.415 1.00 . A A . 23 SER HB2 1 1 8 5369 1 1 19 SER HB3 H 9.443 7.713 -4.248 1.00 . A A . 23 SER HB3 1 1 8 5370 1 1 19 SER HG H 11.469 8.121 -3.836 1.00 . A A . 23 SER HG 1 1 8 5371 1 1 19 SER N N 7.791 8.809 -5.737 1.00 . A A . 23 SER N 1 1 8 5372 1 1 19 SER O O 10.099 9.767 -7.732 1.00 . A A . 23 SER O 1 1 8 5373 1 1 19 SER OG O 11.095 8.926 -4.200 1.00 . A A . 23 SER OG 1 1 8 5374 1 1 20 SER C C 11.967 6.105 -7.828 1.00 . A A . 24 SER C 1 1 8 5375 1 1 20 SER CA C 11.699 7.609 -7.821 1.00 . A A . 24 SER CA 1 1 8 5376 1 1 20 SER CB C 12.993 8.385 -7.573 1.00 . A A . 24 SER CB 1 1 8 5377 1 1 20 SER H H 10.772 7.400 -5.890 1.00 . A A . 24 SER H 1 1 8 5378 1 1 20 SER HA H 11.262 7.913 -8.750 1.00 . A A . 24 SER HA 1 1 8 5379 1 1 20 SER HB2 H 13.008 8.746 -6.556 1.00 . A A . 24 SER HB2 1 1 8 5380 1 1 20 SER HB3 H 13.839 7.734 -7.735 1.00 . A A . 24 SER HB3 1 1 8 5381 1 1 20 SER HG H 13.959 9.533 -8.811 1.00 . A A . 24 SER HG 1 1 8 5382 1 1 20 SER N N 10.805 7.973 -6.683 1.00 . A A . 24 SER N 1 1 8 5383 1 1 20 SER O O 11.973 5.467 -8.861 1.00 . A A . 24 SER O 1 1 8 5384 1 1 20 SER OG O 13.064 9.486 -8.468 1.00 . A A . 24 SER OG 1 1 8 5385 1 1 21 GLY C C 11.838 3.499 -5.332 1.00 . A A . 25 GLY C 1 1 8 5386 1 1 21 GLY CA C 12.458 4.072 -6.608 1.00 . A A . 25 GLY CA 1 1 8 5387 1 1 21 GLY H H 12.179 6.075 -5.865 1.00 . A A . 25 GLY H 1 1 8 5388 1 1 21 GLY HA2 H 12.026 3.584 -7.469 1.00 . A A . 25 GLY HA2 1 1 8 5389 1 1 21 GLY HA3 H 13.526 3.903 -6.598 1.00 . A A . 25 GLY HA3 1 1 8 5390 1 1 21 GLY N N 12.189 5.538 -6.680 1.00 . A A . 25 GLY N 1 1 8 5391 1 1 21 GLY O O 12.531 3.155 -4.395 1.00 . A A . 25 GLY O 1 1 8 5392 1 1 22 GLN C C 8.409 2.509 -4.380 1.00 . A A . 26 GLN C 1 1 8 5393 1 1 22 GLN CA C 9.873 2.836 -4.074 1.00 . A A . 26 GLN CA 1 1 8 5394 1 1 22 GLN CB C 9.965 3.948 -3.028 1.00 . A A . 26 GLN CB 1 1 8 5395 1 1 22 GLN CD C 10.375 2.240 -1.252 1.00 . A A . 26 GLN CD 1 1 8 5396 1 1 22 GLN CG C 10.908 3.516 -1.904 1.00 . A A . 26 GLN CG 1 1 8 5397 1 1 22 GLN H H 9.999 3.672 -6.057 1.00 . A A . 26 GLN H 1 1 8 5398 1 1 22 GLN HA H 10.393 1.957 -3.725 1.00 . A A . 26 GLN HA 1 1 8 5399 1 1 22 GLN HB2 H 10.341 4.849 -3.489 1.00 . A A . 26 GLN HB2 1 1 8 5400 1 1 22 GLN HB3 H 8.983 4.137 -2.619 1.00 . A A . 26 GLN HB3 1 1 8 5401 1 1 22 GLN HE21 H 11.754 2.225 0.178 1.00 . A A . 26 GLN HE21 1 1 8 5402 1 1 22 GLN HE22 H 10.638 0.946 0.233 1.00 . A A . 26 GLN HE22 1 1 8 5403 1 1 22 GLN HG2 H 11.892 3.329 -2.311 1.00 . A A . 26 GLN HG2 1 1 8 5404 1 1 22 GLN HG3 H 10.969 4.300 -1.164 1.00 . A A . 26 GLN HG3 1 1 8 5405 1 1 22 GLN N N 10.539 3.390 -5.289 1.00 . A A . 26 GLN N 1 1 8 5406 1 1 22 GLN NE2 N 10.972 1.764 -0.193 1.00 . A A . 26 GLN NE2 1 1 8 5407 1 1 22 GLN O O 7.673 3.336 -4.895 1.00 . A A . 26 GLN O 1 1 8 5408 1 1 22 GLN OE1 O 9.406 1.668 -1.711 1.00 . A A . 26 GLN OE1 1 1 8 5409 1 1 23 ARG C C 5.643 1.519 -3.281 1.00 . A A . 27 ARG C 1 1 8 5410 1 1 23 ARG CA C 6.556 0.954 -4.349 1.00 . A A . 27 ARG CA 1 1 8 5411 1 1 23 ARG CB C 6.462 -0.572 -4.331 1.00 . A A . 27 ARG CB 1 1 8 5412 1 1 23 ARG CD C 7.687 -1.240 -6.401 1.00 . A A . 27 ARG CD 1 1 8 5413 1 1 23 ARG CG C 6.306 -1.066 -5.766 1.00 . A A . 27 ARG CG 1 1 8 5414 1 1 23 ARG CZ C 7.407 -3.635 -6.797 1.00 . A A . 27 ARG CZ 1 1 8 5415 1 1 23 ARG H H 8.576 0.658 -3.655 1.00 . A A . 27 ARG H 1 1 8 5416 1 1 23 ARG HA H 6.265 1.325 -5.319 1.00 . A A . 27 ARG HA 1 1 8 5417 1 1 23 ARG HB2 H 7.345 -0.994 -3.887 1.00 . A A . 27 ARG HB2 1 1 8 5418 1 1 23 ARG HB3 H 5.595 -0.870 -3.754 1.00 . A A . 27 ARG HB3 1 1 8 5419 1 1 23 ARG HD2 H 7.949 -0.366 -6.978 1.00 . A A . 27 ARG HD2 1 1 8 5420 1 1 23 ARG HD3 H 8.430 -1.428 -5.640 1.00 . A A . 27 ARG HD3 1 1 8 5421 1 1 23 ARG HE H 7.563 -2.306 -8.267 1.00 . A A . 27 ARG HE 1 1 8 5422 1 1 23 ARG HG2 H 5.784 -2.011 -5.769 1.00 . A A . 27 ARG HG2 1 1 8 5423 1 1 23 ARG HG3 H 5.738 -0.336 -6.330 1.00 . A A . 27 ARG HG3 1 1 8 5424 1 1 23 ARG HH11 H 7.473 -3.062 -4.871 1.00 . A A . 27 ARG HH11 1 1 8 5425 1 1 23 ARG HH12 H 7.275 -4.759 -5.142 1.00 . A A . 27 ARG HH12 1 1 8 5426 1 1 23 ARG HH21 H 7.306 -4.512 -8.593 1.00 . A A . 27 ARG HH21 1 1 8 5427 1 1 23 ARG HH22 H 7.181 -5.575 -7.232 1.00 . A A . 27 ARG HH22 1 1 8 5428 1 1 23 ARG N N 7.975 1.311 -4.068 1.00 . A A . 27 ARG N 1 1 8 5429 1 1 23 ARG NE N 7.548 -2.429 -7.295 1.00 . A A . 27 ARG NE 1 1 8 5430 1 1 23 ARG NH1 N 7.385 -3.832 -5.501 1.00 . A A . 27 ARG NH1 1 1 8 5431 1 1 23 ARG NH2 N 7.289 -4.653 -7.603 1.00 . A A . 27 ARG NH2 1 1 8 5432 1 1 23 ARG O O 5.746 1.191 -2.115 1.00 . A A . 27 ARG O 1 1 8 5433 1 1 24 TYR C C 2.399 2.307 -2.964 1.00 . A A . 28 TYR C 1 1 8 5434 1 1 24 TYR CA C 3.767 2.887 -2.692 1.00 . A A . 28 TYR CA 1 1 8 5435 1 1 24 TYR CB C 3.814 4.425 -2.820 1.00 . A A . 28 TYR CB 1 1 8 5436 1 1 24 TYR CD1 C 2.651 4.201 -5.088 1.00 . A A . 28 TYR CD1 1 1 8 5437 1 1 24 TYR CD2 C 2.482 6.291 -3.875 1.00 . A A . 28 TYR CD2 1 1 8 5438 1 1 24 TYR CE1 C 1.899 4.748 -6.129 1.00 . A A . 28 TYR CE1 1 1 8 5439 1 1 24 TYR CE2 C 1.721 6.828 -4.915 1.00 . A A . 28 TYR CE2 1 1 8 5440 1 1 24 TYR CG C 2.949 4.970 -3.954 1.00 . A A . 28 TYR CG 1 1 8 5441 1 1 24 TYR CZ C 1.432 6.060 -6.042 1.00 . A A . 28 TYR CZ 1 1 8 5442 1 1 24 TYR H H 4.645 2.553 -4.626 1.00 . A A . 28 TYR H 1 1 8 5443 1 1 24 TYR HA H 4.070 2.597 -1.697 1.00 . A A . 28 TYR HA 1 1 8 5444 1 1 24 TYR HB2 H 3.477 4.858 -1.891 1.00 . A A . 28 TYR HB2 1 1 8 5445 1 1 24 TYR HB3 H 4.837 4.724 -2.990 1.00 . A A . 28 TYR HB3 1 1 8 5446 1 1 24 TYR HD1 H 2.988 3.188 -5.157 1.00 . A A . 28 TYR HD1 1 1 8 5447 1 1 24 TYR HD2 H 2.696 6.890 -3.004 1.00 . A A . 28 TYR HD2 1 1 8 5448 1 1 24 TYR HE1 H 1.672 4.152 -6.995 1.00 . A A . 28 TYR HE1 1 1 8 5449 1 1 24 TYR HE2 H 1.358 7.839 -4.847 1.00 . A A . 28 TYR HE2 1 1 8 5450 1 1 24 TYR HH H 0.900 7.540 -7.121 1.00 . A A . 28 TYR HH 1 1 8 5451 1 1 24 TYR N N 4.723 2.335 -3.678 1.00 . A A . 28 TYR N 1 1 8 5452 1 1 24 TYR O O 2.198 1.580 -3.918 1.00 . A A . 28 TYR O 1 1 8 5453 1 1 24 TYR OH O 0.704 6.600 -7.077 1.00 . A A . 28 TYR OH 1 1 8 5454 1 1 25 PHE C C -0.888 3.147 -2.376 1.00 . A A . 29 PHE C 1 1 8 5455 1 1 25 PHE CA C 0.128 2.025 -2.319 1.00 . A A . 29 PHE CA 1 1 8 5456 1 1 25 PHE CB C -0.037 1.071 -1.139 1.00 . A A . 29 PHE CB 1 1 8 5457 1 1 25 PHE CD1 C 2.332 0.160 -1.040 1.00 . A A . 29 PHE CD1 1 1 8 5458 1 1 25 PHE CD2 C 0.561 -1.250 -1.902 1.00 . A A . 29 PHE CD2 1 1 8 5459 1 1 25 PHE CE1 C 3.260 -0.860 -1.288 1.00 . A A . 29 PHE CE1 1 1 8 5460 1 1 25 PHE CE2 C 1.492 -2.265 -2.152 1.00 . A A . 29 PHE CE2 1 1 8 5461 1 1 25 PHE CG C 0.974 -0.038 -1.346 1.00 . A A . 29 PHE CG 1 1 8 5462 1 1 25 PHE CZ C 2.839 -2.071 -1.846 1.00 . A A . 29 PHE CZ 1 1 8 5463 1 1 25 PHE H H 1.662 3.162 -1.353 1.00 . A A . 29 PHE H 1 1 8 5464 1 1 25 PHE HA H 0.101 1.463 -3.240 1.00 . A A . 29 PHE HA 1 1 8 5465 1 1 25 PHE HB2 H 0.155 1.589 -0.210 1.00 . A A . 29 PHE HB2 1 1 8 5466 1 1 25 PHE HB3 H -1.037 0.663 -1.134 1.00 . A A . 29 PHE HB3 1 1 8 5467 1 1 25 PHE HD1 H 2.664 1.096 -0.610 1.00 . A A . 29 PHE HD1 1 1 8 5468 1 1 25 PHE HD2 H -0.475 -1.399 -2.142 1.00 . A A . 29 PHE HD2 1 1 8 5469 1 1 25 PHE HE1 H 4.302 -0.708 -1.058 1.00 . A A . 29 PHE HE1 1 1 8 5470 1 1 25 PHE HE2 H 1.166 -3.200 -2.588 1.00 . A A . 29 PHE HE2 1 1 8 5471 1 1 25 PHE HZ H 3.555 -2.854 -2.046 1.00 . A A . 29 PHE HZ 1 1 8 5472 1 1 25 PHE N N 1.471 2.588 -2.124 1.00 . A A . 29 PHE N 1 1 8 5473 1 1 25 PHE O O -1.224 3.778 -1.390 1.00 . A A . 29 PHE O 1 1 8 5474 1 1 26 LEU C C -3.698 4.094 -3.342 1.00 . A A . 30 LEU C 1 1 8 5475 1 1 26 LEU CA C -2.302 4.516 -3.799 1.00 . A A . 30 LEU CA 1 1 8 5476 1 1 26 LEU CB C -2.231 4.728 -5.318 1.00 . A A . 30 LEU CB 1 1 8 5477 1 1 26 LEU CD1 C -1.200 6.984 -4.877 1.00 . A A . 30 LEU CD1 1 1 8 5478 1 1 26 LEU CD2 C -1.918 6.352 -7.168 1.00 . A A . 30 LEU CD2 1 1 8 5479 1 1 26 LEU CG C -2.246 6.215 -5.684 1.00 . A A . 30 LEU CG 1 1 8 5480 1 1 26 LEU H H -1.007 2.892 -4.333 1.00 . A A . 30 LEU H 1 1 8 5481 1 1 26 LEU HA H -1.992 5.404 -3.279 1.00 . A A . 30 LEU HA 1 1 8 5482 1 1 26 LEU HB2 H -1.318 4.287 -5.690 1.00 . A A . 30 LEU HB2 1 1 8 5483 1 1 26 LEU HB3 H -3.066 4.244 -5.786 1.00 . A A . 30 LEU HB3 1 1 8 5484 1 1 26 LEU HD11 H -0.552 7.530 -5.549 1.00 . A A . 30 LEU HD11 1 1 8 5485 1 1 26 LEU HD12 H -0.612 6.293 -4.293 1.00 . A A . 30 LEU HD12 1 1 8 5486 1 1 26 LEU HD13 H -1.700 7.678 -4.221 1.00 . A A . 30 LEU HD13 1 1 8 5487 1 1 26 LEU HD21 H -1.268 5.540 -7.464 1.00 . A A . 30 LEU HD21 1 1 8 5488 1 1 26 LEU HD22 H -1.415 7.293 -7.339 1.00 . A A . 30 LEU HD22 1 1 8 5489 1 1 26 LEU HD23 H -2.826 6.316 -7.743 1.00 . A A . 30 LEU HD23 1 1 8 5490 1 1 26 LEU HG H -3.223 6.627 -5.490 1.00 . A A . 30 LEU HG 1 1 8 5491 1 1 26 LEU N N -1.335 3.416 -3.567 1.00 . A A . 30 LEU N 1 1 8 5492 1 1 26 LEU O O -4.324 3.224 -3.919 1.00 . A A . 30 LEU O 1 1 8 5493 1 1 27 ASN C C -6.586 5.256 -2.428 1.00 . A A . 31 ASN C 1 1 8 5494 1 1 27 ASN CA C -5.529 4.366 -1.771 1.00 . A A . 31 ASN CA 1 1 8 5495 1 1 27 ASN CB C -5.446 4.653 -0.272 1.00 . A A . 31 ASN CB 1 1 8 5496 1 1 27 ASN CG C -6.772 4.307 0.395 1.00 . A A . 31 ASN CG 1 1 8 5497 1 1 27 ASN H H -3.648 5.401 -1.851 1.00 . A A . 31 ASN H 1 1 8 5498 1 1 27 ASN HA H -5.750 3.324 -1.938 1.00 . A A . 31 ASN HA 1 1 8 5499 1 1 27 ASN HB2 H -4.667 4.052 0.170 1.00 . A A . 31 ASN HB2 1 1 8 5500 1 1 27 ASN HB3 H -5.227 5.699 -0.115 1.00 . A A . 31 ASN HB3 1 1 8 5501 1 1 27 ASN HD21 H -5.927 3.902 2.142 1.00 . A A . 31 ASN HD21 1 1 8 5502 1 1 27 ASN HD22 H -7.606 3.712 2.086 1.00 . A A . 31 ASN HD22 1 1 8 5503 1 1 27 ASN N N -4.181 4.709 -2.296 1.00 . A A . 31 ASN N 1 1 8 5504 1 1 27 ASN ND2 N -6.770 3.945 1.646 1.00 . A A . 31 ASN ND2 1 1 8 5505 1 1 27 ASN O O -6.681 6.434 -2.139 1.00 . A A . 31 ASN O 1 1 8 5506 1 1 27 ASN OD1 O -7.815 4.367 -0.223 1.00 . A A . 31 ASN OD1 1 1 8 5507 1 1 28 HIS C C -9.680 5.615 -3.109 1.00 . A A . 32 HIS C 1 1 8 5508 1 1 28 HIS CA C -8.430 5.498 -3.993 1.00 . A A . 32 HIS CA 1 1 8 5509 1 1 28 HIS CB C -8.749 4.721 -5.270 1.00 . A A . 32 HIS CB 1 1 8 5510 1 1 28 HIS CD2 C -6.819 5.097 -7.014 1.00 . A A . 32 HIS CD2 1 1 8 5511 1 1 28 HIS CE1 C -7.707 6.737 -8.117 1.00 . A A . 32 HIS CE1 1 1 8 5512 1 1 28 HIS CG C -8.036 5.354 -6.432 1.00 . A A . 32 HIS CG 1 1 8 5513 1 1 28 HIS H H -7.271 3.744 -3.520 1.00 . A A . 32 HIS H 1 1 8 5514 1 1 28 HIS HA H -8.052 6.477 -4.243 1.00 . A A . 32 HIS HA 1 1 8 5515 1 1 28 HIS HB2 H -8.420 3.698 -5.161 1.00 . A A . 32 HIS HB2 1 1 8 5516 1 1 28 HIS HB3 H -9.813 4.741 -5.446 1.00 . A A . 32 HIS HB3 1 1 8 5517 1 1 28 HIS HD1 H -9.453 6.827 -6.990 1.00 . A A . 32 HIS HD1 1 1 8 5518 1 1 28 HIS HD2 H -6.126 4.332 -6.695 1.00 . A A . 32 HIS HD2 1 1 8 5519 1 1 28 HIS HE1 H -7.867 7.526 -8.836 1.00 . A A . 32 HIS HE1 1 1 8 5520 1 1 28 HIS N N -7.373 4.696 -3.308 1.00 . A A . 32 HIS N 1 1 8 5521 1 1 28 HIS ND1 N -8.584 6.405 -7.153 1.00 . A A . 32 HIS ND1 1 1 8 5522 1 1 28 HIS NE2 N -6.613 5.971 -8.077 1.00 . A A . 32 HIS NE2 1 1 8 5523 1 1 28 HIS O O -10.631 6.285 -3.459 1.00 . A A . 32 HIS O 1 1 8 5524 1 1 29 ILE C C -10.682 6.297 -0.161 1.00 . A A . 33 ILE C 1 1 8 5525 1 1 29 ILE CA C -10.878 5.089 -1.064 1.00 . A A . 33 ILE CA 1 1 8 5526 1 1 29 ILE CB C -10.950 3.807 -0.200 1.00 . A A . 33 ILE CB 1 1 8 5527 1 1 29 ILE CD1 C -10.563 1.304 -0.158 1.00 . A A . 33 ILE CD1 1 1 8 5528 1 1 29 ILE CG1 C -10.243 2.617 -0.886 1.00 . A A . 33 ILE CG1 1 1 8 5529 1 1 29 ILE CG2 C -12.427 3.467 0.036 1.00 . A A . 33 ILE CG2 1 1 8 5530 1 1 29 ILE H H -8.906 4.464 -1.686 1.00 . A A . 33 ILE H 1 1 8 5531 1 1 29 ILE HA H -11.779 5.198 -1.648 1.00 . A A . 33 ILE HA 1 1 8 5532 1 1 29 ILE HB H -10.479 4.002 0.755 1.00 . A A . 33 ILE HB 1 1 8 5533 1 1 29 ILE HD11 H -10.854 1.518 0.860 1.00 . A A . 33 ILE HD11 1 1 8 5534 1 1 29 ILE HD12 H -9.687 0.671 -0.157 1.00 . A A . 33 ILE HD12 1 1 8 5535 1 1 29 ILE HD13 H -11.371 0.798 -0.667 1.00 . A A . 33 ILE HD13 1 1 8 5536 1 1 29 ILE HG12 H -10.570 2.553 -1.911 1.00 . A A . 33 ILE HG12 1 1 8 5537 1 1 29 ILE HG13 H -9.177 2.780 -0.858 1.00 . A A . 33 ILE HG13 1 1 8 5538 1 1 29 ILE HG21 H -12.529 2.936 0.971 1.00 . A A . 33 ILE HG21 1 1 8 5539 1 1 29 ILE HG22 H -12.786 2.845 -0.772 1.00 . A A . 33 ILE HG22 1 1 8 5540 1 1 29 ILE HG23 H -13.004 4.379 0.073 1.00 . A A . 33 ILE HG23 1 1 8 5541 1 1 29 ILE N N -9.684 4.986 -1.964 1.00 . A A . 33 ILE N 1 1 8 5542 1 1 29 ILE O O -11.454 7.236 -0.168 1.00 . A A . 33 ILE O 1 1 8 5543 1 1 30 ASP C C -8.334 8.364 0.846 1.00 . A A . 34 ASP C 1 1 8 5544 1 1 30 ASP CA C -9.345 7.424 1.510 1.00 . A A . 34 ASP CA 1 1 8 5545 1 1 30 ASP CB C -8.751 6.797 2.772 1.00 . A A . 34 ASP CB 1 1 8 5546 1 1 30 ASP CG C -9.826 5.980 3.490 1.00 . A A . 34 ASP CG 1 1 8 5547 1 1 30 ASP H H -9.025 5.505 0.574 1.00 . A A . 34 ASP H 1 1 8 5548 1 1 30 ASP HA H -10.254 7.953 1.752 1.00 . A A . 34 ASP HA 1 1 8 5549 1 1 30 ASP HB2 H -7.929 6.151 2.499 1.00 . A A . 34 ASP HB2 1 1 8 5550 1 1 30 ASP HB3 H -8.394 7.577 3.427 1.00 . A A . 34 ASP HB3 1 1 8 5551 1 1 30 ASP N N -9.634 6.278 0.605 1.00 . A A . 34 ASP N 1 1 8 5552 1 1 30 ASP O O -7.647 9.112 1.513 1.00 . A A . 34 ASP O 1 1 8 5553 1 1 30 ASP OD1 O -10.878 6.532 3.766 1.00 . A A . 34 ASP OD1 1 1 8 5554 1 1 30 ASP OD2 O -9.579 4.813 3.752 1.00 . A A . 34 ASP OD2 1 1 8 5555 1 1 31 GLN C C -5.970 9.393 -0.478 1.00 . A A . 35 GLN C 1 1 8 5556 1 1 31 GLN CA C -7.288 9.193 -1.236 1.00 . A A . 35 GLN CA 1 1 8 5557 1 1 31 GLN CB C -8.009 10.533 -1.450 1.00 . A A . 35 GLN CB 1 1 8 5558 1 1 31 GLN CD C -8.996 12.532 -0.324 1.00 . A A . 35 GLN CD 1 1 8 5559 1 1 31 GLN CG C -8.512 11.096 -0.117 1.00 . A A . 35 GLN CG 1 1 8 5560 1 1 31 GLN H H -8.822 7.702 -0.964 1.00 . A A . 35 GLN H 1 1 8 5561 1 1 31 GLN HA H -7.085 8.744 -2.196 1.00 . A A . 35 GLN HA 1 1 8 5562 1 1 31 GLN HB2 H -7.324 11.237 -1.897 1.00 . A A . 35 GLN HB2 1 1 8 5563 1 1 31 GLN HB3 H -8.848 10.382 -2.112 1.00 . A A . 35 GLN HB3 1 1 8 5564 1 1 31 GLN HE21 H -9.940 12.617 1.421 1.00 . A A . 35 GLN HE21 1 1 8 5565 1 1 31 GLN HE22 H -10.029 14.026 0.480 1.00 . A A . 35 GLN HE22 1 1 8 5566 1 1 31 GLN HG2 H -9.331 10.492 0.244 1.00 . A A . 35 GLN HG2 1 1 8 5567 1 1 31 GLN HG3 H -7.712 11.088 0.606 1.00 . A A . 35 GLN HG3 1 1 8 5568 1 1 31 GLN N N -8.246 8.321 -0.469 1.00 . A A . 35 GLN N 1 1 8 5569 1 1 31 GLN NE2 N -9.714 13.106 0.602 1.00 . A A . 35 GLN NE2 1 1 8 5570 1 1 31 GLN O O -5.711 10.447 0.069 1.00 . A A . 35 GLN O 1 1 8 5571 1 1 31 GLN OE1 O -8.717 13.139 -1.339 1.00 . A A . 35 GLN OE1 1 1 8 5572 1 1 32 THR C C -2.783 7.583 -0.280 1.00 . A A . 36 THR C 1 1 8 5573 1 1 32 THR CA C -3.837 8.540 0.283 1.00 . A A . 36 THR CA 1 1 8 5574 1 1 32 THR CB C -4.158 8.185 1.737 1.00 . A A . 36 THR CB 1 1 8 5575 1 1 32 THR CG2 C -4.689 9.423 2.461 1.00 . A A . 36 THR CG2 1 1 8 5576 1 1 32 THR H H -5.358 7.545 -0.895 1.00 . A A . 36 THR H 1 1 8 5577 1 1 32 THR HA H -3.489 9.559 0.225 1.00 . A A . 36 THR HA 1 1 8 5578 1 1 32 THR HB H -3.261 7.842 2.230 1.00 . A A . 36 THR HB 1 1 8 5579 1 1 32 THR HG1 H -4.683 6.314 1.776 1.00 . A A . 36 THR HG1 1 1 8 5580 1 1 32 THR HG21 H -4.208 9.510 3.426 1.00 . A A . 36 THR HG21 1 1 8 5581 1 1 32 THR HG22 H -5.756 9.330 2.597 1.00 . A A . 36 THR HG22 1 1 8 5582 1 1 32 THR HG23 H -4.476 10.304 1.873 1.00 . A A . 36 THR HG23 1 1 8 5583 1 1 32 THR N N -5.134 8.392 -0.444 1.00 . A A . 36 THR N 1 1 8 5584 1 1 32 THR O O -3.097 6.625 -0.954 1.00 . A A . 36 THR O 1 1 8 5585 1 1 32 THR OG1 O -5.138 7.158 1.765 1.00 . A A . 36 THR OG1 1 1 8 5586 1 1 33 THR C C 0.377 6.384 0.632 1.00 . A A . 37 THR C 1 1 8 5587 1 1 33 THR CA C -0.456 6.936 -0.524 1.00 . A A . 37 THR CA 1 1 8 5588 1 1 33 THR CB C 0.436 7.806 -1.416 1.00 . A A . 37 THR CB 1 1 8 5589 1 1 33 THR CG2 C -0.412 8.599 -2.408 1.00 . A A . 37 THR CG2 1 1 8 5590 1 1 33 THR H H -1.294 8.615 0.542 1.00 . A A . 37 THR H 1 1 8 5591 1 1 33 THR HA H -0.882 6.132 -1.102 1.00 . A A . 37 THR HA 1 1 8 5592 1 1 33 THR HB H 1.117 7.171 -1.963 1.00 . A A . 37 THR HB 1 1 8 5593 1 1 33 THR HG1 H 0.555 9.251 -0.121 1.00 . A A . 37 THR HG1 1 1 8 5594 1 1 33 THR HG21 H -1.425 8.225 -2.393 1.00 . A A . 37 THR HG21 1 1 8 5595 1 1 33 THR HG22 H 0.000 8.487 -3.400 1.00 . A A . 37 THR HG22 1 1 8 5596 1 1 33 THR HG23 H -0.409 9.642 -2.132 1.00 . A A . 37 THR HG23 1 1 8 5597 1 1 33 THR N N -1.529 7.837 -0.005 1.00 . A A . 37 THR N 1 1 8 5598 1 1 33 THR O O 1.073 7.112 1.310 1.00 . A A . 37 THR O 1 1 8 5599 1 1 33 THR OG1 O 1.178 8.705 -0.604 1.00 . A A . 37 THR OG1 1 1 8 5600 1 1 34 THR C C 2.220 3.598 1.335 1.00 . A A . 38 THR C 1 1 8 5601 1 1 34 THR CA C 1.158 4.514 1.945 1.00 . A A . 38 THR CA 1 1 8 5602 1 1 34 THR CB C 0.178 3.728 2.827 1.00 . A A . 38 THR CB 1 1 8 5603 1 1 34 THR CG2 C -0.359 2.513 2.069 1.00 . A A . 38 THR CG2 1 1 8 5604 1 1 34 THR H H -0.215 4.522 0.275 1.00 . A A . 38 THR H 1 1 8 5605 1 1 34 THR HA H 1.626 5.297 2.520 1.00 . A A . 38 THR HA 1 1 8 5606 1 1 34 THR HB H -0.647 4.367 3.104 1.00 . A A . 38 THR HB 1 1 8 5607 1 1 34 THR HG1 H 0.204 2.871 4.573 1.00 . A A . 38 THR HG1 1 1 8 5608 1 1 34 THR HG21 H -1.221 2.119 2.586 1.00 . A A . 38 THR HG21 1 1 8 5609 1 1 34 THR HG22 H 0.407 1.755 2.017 1.00 . A A . 38 THR HG22 1 1 8 5610 1 1 34 THR HG23 H -0.640 2.812 1.073 1.00 . A A . 38 THR HG23 1 1 8 5611 1 1 34 THR N N 0.337 5.101 0.846 1.00 . A A . 38 THR N 1 1 8 5612 1 1 34 THR O O 1.949 2.858 0.413 1.00 . A A . 38 THR O 1 1 8 5613 1 1 34 THR OG1 O 0.850 3.293 4.001 1.00 . A A . 38 THR OG1 1 1 8 5614 1 1 35 TRP C C 4.227 1.313 1.631 1.00 . A A . 39 TRP C 1 1 8 5615 1 1 35 TRP CA C 4.488 2.773 1.249 1.00 . A A . 39 TRP CA 1 1 8 5616 1 1 35 TRP CB C 5.818 3.244 1.862 1.00 . A A . 39 TRP CB 1 1 8 5617 1 1 35 TRP CD1 C 5.600 5.597 2.773 1.00 . A A . 39 TRP CD1 1 1 8 5618 1 1 35 TRP CD2 C 6.521 5.561 0.718 1.00 . A A . 39 TRP CD2 1 1 8 5619 1 1 35 TRP CE2 C 6.463 6.919 1.120 1.00 . A A . 39 TRP CE2 1 1 8 5620 1 1 35 TRP CE3 C 7.067 5.275 -0.550 1.00 . A A . 39 TRP CE3 1 1 8 5621 1 1 35 TRP CG C 5.960 4.738 1.789 1.00 . A A . 39 TRP CG 1 1 8 5622 1 1 35 TRP CH2 C 7.471 7.641 -0.946 1.00 . A A . 39 TRP CH2 1 1 8 5623 1 1 35 TRP CZ2 C 6.929 7.945 0.304 1.00 . A A . 39 TRP CZ2 1 1 8 5624 1 1 35 TRP CZ3 C 7.537 6.308 -1.371 1.00 . A A . 39 TRP CZ3 1 1 8 5625 1 1 35 TRP H H 3.628 4.249 2.568 1.00 . A A . 39 TRP H 1 1 8 5626 1 1 35 TRP HA H 4.516 2.877 0.176 1.00 . A A . 39 TRP HA 1 1 8 5627 1 1 35 TRP HB2 H 5.857 2.936 2.896 1.00 . A A . 39 TRP HB2 1 1 8 5628 1 1 35 TRP HB3 H 6.635 2.786 1.326 1.00 . A A . 39 TRP HB3 1 1 8 5629 1 1 35 TRP HD1 H 5.148 5.319 3.713 1.00 . A A . 39 TRP HD1 1 1 8 5630 1 1 35 TRP HE1 H 5.726 7.697 2.902 1.00 . A A . 39 TRP HE1 1 1 8 5631 1 1 35 TRP HE3 H 7.117 4.258 -0.900 1.00 . A A . 39 TRP HE3 1 1 8 5632 1 1 35 TRP HH2 H 7.837 8.429 -1.586 1.00 . A A . 39 TRP HH2 1 1 8 5633 1 1 35 TRP HZ2 H 6.874 8.972 0.638 1.00 . A A . 39 TRP HZ2 1 1 8 5634 1 1 35 TRP HZ3 H 7.960 6.072 -2.335 1.00 . A A . 39 TRP HZ3 1 1 8 5635 1 1 35 TRP N N 3.425 3.645 1.828 1.00 . A A . 39 TRP N 1 1 8 5636 1 1 35 TRP NE1 N 5.891 6.888 2.373 1.00 . A A . 39 TRP NE1 1 1 8 5637 1 1 35 TRP O O 4.315 0.423 0.810 1.00 . A A . 39 TRP O 1 1 8 5638 1 1 36 GLN C C 2.201 -0.733 2.973 1.00 . A A . 40 GLN C 1 1 8 5639 1 1 36 GLN CA C 3.643 -0.339 3.304 1.00 . A A . 40 GLN CA 1 1 8 5640 1 1 36 GLN CB C 3.862 -0.335 4.817 1.00 . A A . 40 GLN CB 1 1 8 5641 1 1 36 GLN CD C 5.392 0.510 6.603 1.00 . A A . 40 GLN CD 1 1 8 5642 1 1 36 GLN CG C 5.286 0.135 5.124 1.00 . A A . 40 GLN CG 1 1 8 5643 1 1 36 GLN H H 3.843 1.796 3.518 1.00 . A A . 40 GLN H 1 1 8 5644 1 1 36 GLN HA H 4.336 -1.017 2.833 1.00 . A A . 40 GLN HA 1 1 8 5645 1 1 36 GLN HB2 H 3.154 0.336 5.282 1.00 . A A . 40 GLN HB2 1 1 8 5646 1 1 36 GLN HB3 H 3.721 -1.333 5.205 1.00 . A A . 40 GLN HB3 1 1 8 5647 1 1 36 GLN HE21 H 4.630 2.324 6.343 1.00 . A A . 40 GLN HE21 1 1 8 5648 1 1 36 GLN HE22 H 5.057 1.939 7.940 1.00 . A A . 40 GLN HE22 1 1 8 5649 1 1 36 GLN HG2 H 5.982 -0.661 4.904 1.00 . A A . 40 GLN HG2 1 1 8 5650 1 1 36 GLN HG3 H 5.520 0.996 4.516 1.00 . A A . 40 GLN HG3 1 1 8 5651 1 1 36 GLN N N 3.908 1.063 2.871 1.00 . A A . 40 GLN N 1 1 8 5652 1 1 36 GLN NE2 N 4.993 1.690 6.995 1.00 . A A . 40 GLN NE2 1 1 8 5653 1 1 36 GLN O O 1.547 -0.109 2.159 1.00 . A A . 40 GLN O 1 1 8 5654 1 1 36 GLN OE1 O 5.841 -0.278 7.411 1.00 . A A . 40 GLN OE1 1 1 8 5655 1 1 37 ASP C C -0.495 -2.303 4.626 1.00 . A A . 41 ASP C 1 1 8 5656 1 1 37 ASP CA C 0.298 -2.195 3.317 1.00 . A A . 41 ASP CA 1 1 8 5657 1 1 37 ASP CB C 0.433 -3.567 2.656 1.00 . A A . 41 ASP CB 1 1 8 5658 1 1 37 ASP CG C 1.332 -3.453 1.423 1.00 . A A . 41 ASP CG 1 1 8 5659 1 1 37 ASP H H 2.241 -2.252 4.249 1.00 . A A . 41 ASP H 1 1 8 5660 1 1 37 ASP HA H -0.181 -1.505 2.641 1.00 . A A . 41 ASP HA 1 1 8 5661 1 1 37 ASP HB2 H 0.869 -4.263 3.357 1.00 . A A . 41 ASP HB2 1 1 8 5662 1 1 37 ASP HB3 H -0.543 -3.920 2.358 1.00 . A A . 41 ASP HB3 1 1 8 5663 1 1 37 ASP N N 1.698 -1.763 3.597 1.00 . A A . 41 ASP N 1 1 8 5664 1 1 37 ASP O O 0.056 -2.651 5.652 1.00 . A A . 41 ASP O 1 1 8 5665 1 1 37 ASP OD1 O 1.232 -2.454 0.731 1.00 . A A . 41 ASP OD1 1 1 8 5666 1 1 37 ASP OD2 O 2.106 -4.368 1.192 1.00 . A A . 41 ASP OD2 1 1 8 5667 1 1 38 PRO C C -2.896 -3.529 6.140 1.00 . A A . 42 PRO C 1 1 8 5668 1 1 38 PRO CA C -2.633 -2.070 5.755 1.00 . A A . 42 PRO CA 1 1 8 5669 1 1 38 PRO CB C -3.923 -1.384 5.313 1.00 . A A . 42 PRO CB 1 1 8 5670 1 1 38 PRO CD C -2.517 -1.574 3.359 1.00 . A A . 42 PRO CD 1 1 8 5671 1 1 38 PRO CG C -3.950 -1.533 3.825 1.00 . A A . 42 PRO CG 1 1 8 5672 1 1 38 PRO HA H -2.189 -1.532 6.576 1.00 . A A . 42 PRO HA 1 1 8 5673 1 1 38 PRO HB2 H -4.779 -1.871 5.755 1.00 . A A . 42 PRO HB2 1 1 8 5674 1 1 38 PRO HB3 H -3.902 -0.337 5.584 1.00 . A A . 42 PRO HB3 1 1 8 5675 1 1 38 PRO HD2 H -2.400 -2.290 2.559 1.00 . A A . 42 PRO HD2 1 1 8 5676 1 1 38 PRO HD3 H -2.195 -0.593 3.040 1.00 . A A . 42 PRO HD3 1 1 8 5677 1 1 38 PRO HG2 H -4.450 -2.453 3.557 1.00 . A A . 42 PRO HG2 1 1 8 5678 1 1 38 PRO HG3 H -4.460 -0.692 3.379 1.00 . A A . 42 PRO HG3 1 1 8 5679 1 1 38 PRO N N -1.768 -2.002 4.550 1.00 . A A . 42 PRO N 1 1 8 5680 1 1 38 PRO O O -2.206 -4.430 5.707 1.00 . A A . 42 PRO O 1 1 8 5681 1 1 39 ARG C C -2.946 -5.840 7.932 1.00 . A A . 43 ARG C 1 1 8 5682 1 1 39 ARG CA C -4.199 -5.168 7.363 1.00 . A A . 43 ARG CA 1 1 8 5683 1 1 39 ARG CB C -4.648 -5.869 6.080 1.00 . A A . 43 ARG CB 1 1 8 5684 1 1 39 ARG CD C -6.772 -7.110 5.641 1.00 . A A . 43 ARG CD 1 1 8 5685 1 1 39 ARG CG C -5.466 -7.111 6.439 1.00 . A A . 43 ARG CG 1 1 8 5686 1 1 39 ARG CZ C -8.220 -7.927 7.430 1.00 . A A . 43 ARG CZ 1 1 8 5687 1 1 39 ARG H H -4.437 -3.027 7.289 1.00 . A A . 43 ARG H 1 1 8 5688 1 1 39 ARG HA H -4.997 -5.181 8.089 1.00 . A A . 43 ARG HA 1 1 8 5689 1 1 39 ARG HB2 H -5.256 -5.195 5.496 1.00 . A A . 43 ARG HB2 1 1 8 5690 1 1 39 ARG HB3 H -3.782 -6.162 5.507 1.00 . A A . 43 ARG HB3 1 1 8 5691 1 1 39 ARG HD2 H -6.781 -6.289 4.937 1.00 . A A . 43 ARG HD2 1 1 8 5692 1 1 39 ARG HD3 H -6.898 -8.050 5.125 1.00 . A A . 43 ARG HD3 1 1 8 5693 1 1 39 ARG HE H -8.274 -6.054 6.763 1.00 . A A . 43 ARG HE 1 1 8 5694 1 1 39 ARG HG2 H -4.899 -7.998 6.198 1.00 . A A . 43 ARG HG2 1 1 8 5695 1 1 39 ARG HG3 H -5.691 -7.103 7.495 1.00 . A A . 43 ARG HG3 1 1 8 5696 1 1 39 ARG HH11 H -6.943 -9.270 6.649 1.00 . A A . 43 ARG HH11 1 1 8 5697 1 1 39 ARG HH12 H -7.965 -9.855 7.915 1.00 . A A . 43 ARG HH12 1 1 8 5698 1 1 39 ARG HH21 H -9.589 -6.839 8.405 1.00 . A A . 43 ARG HH21 1 1 8 5699 1 1 39 ARG HH22 H -9.452 -8.492 8.903 1.00 . A A . 43 ARG HH22 1 1 8 5700 1 1 39 ARG N N -3.892 -3.768 6.950 1.00 . A A . 43 ARG N 1 1 8 5701 1 1 39 ARG NE N -7.845 -6.928 6.663 1.00 . A A . 43 ARG NE 1 1 8 5702 1 1 39 ARG NH1 N -7.664 -9.109 7.322 1.00 . A A . 43 ARG NH1 1 1 8 5703 1 1 39 ARG NH2 N -9.160 -7.738 8.314 1.00 . A A . 43 ARG NH2 1 1 8 5704 1 1 39 ARG O O -2.538 -6.893 7.486 1.00 . A A . 43 ARG O 1 1 8 5705 1 1 40 LYS C C -0.079 -6.145 8.415 1.00 . A A . 44 LYS C 1 1 8 5706 1 1 40 LYS CA C -1.105 -5.841 9.510 1.00 . A A . 44 LYS CA 1 1 8 5707 1 1 40 LYS CB C -1.583 -7.134 10.171 1.00 . A A . 44 LYS CB 1 1 8 5708 1 1 40 LYS CD C -1.263 -8.624 12.151 1.00 . A A . 44 LYS CD 1 1 8 5709 1 1 40 LYS CE C -0.216 -9.178 13.120 1.00 . A A . 44 LYS CE 1 1 8 5710 1 1 40 LYS CG C -0.649 -7.488 11.331 1.00 . A A . 44 LYS CG 1 1 8 5711 1 1 40 LYS H H -2.677 -4.386 9.258 1.00 . A A . 44 LYS H 1 1 8 5712 1 1 40 LYS HA H -0.683 -5.181 10.250 1.00 . A A . 44 LYS HA 1 1 8 5713 1 1 40 LYS HB2 H -2.587 -6.998 10.546 1.00 . A A . 44 LYS HB2 1 1 8 5714 1 1 40 LYS HB3 H -1.574 -7.934 9.446 1.00 . A A . 44 LYS HB3 1 1 8 5715 1 1 40 LYS HD2 H -2.108 -8.250 12.709 1.00 . A A . 44 LYS HD2 1 1 8 5716 1 1 40 LYS HD3 H -1.591 -9.411 11.487 1.00 . A A . 44 LYS HD3 1 1 8 5717 1 1 40 LYS HE2 H 0.126 -10.147 12.788 1.00 . A A . 44 LYS HE2 1 1 8 5718 1 1 40 LYS HE3 H 0.616 -8.495 13.205 1.00 . A A . 44 LYS HE3 1 1 8 5719 1 1 40 LYS HG2 H 0.308 -7.802 10.940 1.00 . A A . 44 LYS HG2 1 1 8 5720 1 1 40 LYS HG3 H -0.515 -6.621 11.961 1.00 . A A . 44 LYS HG3 1 1 8 5721 1 1 40 LYS HZ1 H -1.816 -9.816 14.288 1.00 . A A . 44 LYS HZ1 1 1 8 5722 1 1 40 LYS HZ2 H -1.133 -8.345 14.792 1.00 . A A . 44 LYS HZ2 1 1 8 5723 1 1 40 LYS HZ3 H -0.328 -9.809 15.100 1.00 . A A . 44 LYS HZ3 1 1 8 5724 1 1 40 LYS N N -2.331 -5.237 8.913 1.00 . A A . 44 LYS N 1 1 8 5725 1 1 40 LYS NZ N -0.927 -9.296 14.424 1.00 . A A . 44 LYS NZ 1 1 8 5726 1 1 40 LYS O O 0.573 -5.216 7.967 1.00 . A A . 44 LYS O 1 1 8 5727 1 1 40 LYS OXT O 0.038 -7.302 8.045 1.00 . A A . 44 LYS OXT 1 1 8 5728 2 2 1 ACE C C 8.409 11.747 5.287 1.00 . B B . 45 ACE C 1 1 8 5729 2 2 1 ACE CH3 C 8.262 11.480 6.787 1.00 . B B . 45 ACE CH3 1 1 8 5730 2 2 1 ACE H1 H 9.113 10.917 7.138 1.00 . B B . 45 ACE H1 1 1 8 5731 2 2 1 ACE H2 H 7.358 10.914 6.964 1.00 . B B . 45 ACE H2 1 1 8 5732 2 2 1 ACE H3 H 8.207 12.420 7.316 1.00 . B B . 45 ACE H3 1 1 8 5733 2 2 1 ACE O O 8.280 12.870 4.841 1.00 . B B . 45 ACE O 1 1 8 5734 2 2 2 PRO C C 7.079 10.195 2.735 1.00 . B B . 46 PRO C 1 1 8 5735 2 2 2 PRO CA C 8.456 10.761 3.091 1.00 . B B . 46 PRO CA 1 1 8 5736 2 2 2 PRO CB C 9.564 9.888 2.512 1.00 . B B . 46 PRO CB 1 1 8 5737 2 2 2 PRO CD C 9.657 9.658 4.907 1.00 . B B . 46 PRO CD 1 1 8 5738 2 2 2 PRO CG C 9.920 8.942 3.610 1.00 . B B . 46 PRO CG 1 1 8 5739 2 2 2 PRO HA H 8.556 11.773 2.733 1.00 . B B . 46 PRO HA 1 1 8 5740 2 2 2 PRO HB2 H 9.203 9.347 1.647 1.00 . B B . 46 PRO HB2 1 1 8 5741 2 2 2 PRO HB3 H 10.422 10.490 2.251 1.00 . B B . 46 PRO HB3 1 1 8 5742 2 2 2 PRO HD2 H 9.245 8.975 5.637 1.00 . B B . 46 PRO HD2 1 1 8 5743 2 2 2 PRO HD3 H 10.561 10.112 5.279 1.00 . B B . 46 PRO HD3 1 1 8 5744 2 2 2 PRO HG2 H 9.306 8.055 3.543 1.00 . B B . 46 PRO HG2 1 1 8 5745 2 2 2 PRO HG3 H 10.964 8.677 3.547 1.00 . B B . 46 PRO HG3 1 1 8 5746 2 2 2 PRO N N 8.677 10.697 4.560 1.00 . B B . 46 PRO N 1 1 8 5747 2 2 2 PRO O O 6.690 9.141 3.198 1.00 . B B . 46 PRO O 1 1 8 5748 2 2 3 LEU C C 4.368 11.314 0.464 1.00 . B B . 47 LEU C 1 1 8 5749 2 2 3 LEU CA C 4.985 10.391 1.527 1.00 . B B . 47 LEU CA 1 1 8 5750 2 2 3 LEU CB C 4.165 10.439 2.818 1.00 . B B . 47 LEU CB 1 1 8 5751 2 2 3 LEU CD1 C 2.273 9.360 4.042 1.00 . B B . 47 LEU CD1 1 1 8 5752 2 2 3 LEU CD2 C 1.938 10.198 1.712 1.00 . B B . 47 LEU CD2 1 1 8 5753 2 2 3 LEU CG C 2.932 9.545 2.675 1.00 . B B . 47 LEU CG 1 1 8 5754 2 2 3 LEU H H 6.669 11.736 1.551 1.00 . B B . 47 LEU H 1 1 8 5755 2 2 3 LEU HA H 5.046 9.377 1.170 1.00 . B B . 47 LEU HA 1 1 8 5756 2 2 3 LEU HB2 H 4.770 10.089 3.641 1.00 . B B . 47 LEU HB2 1 1 8 5757 2 2 3 LEU HB3 H 3.852 11.455 3.008 1.00 . B B . 47 LEU HB3 1 1 8 5758 2 2 3 LEU HD11 H 1.809 10.288 4.345 1.00 . B B . 47 LEU HD11 1 1 8 5759 2 2 3 LEU HD12 H 3.022 9.080 4.767 1.00 . B B . 47 LEU HD12 1 1 8 5760 2 2 3 LEU HD13 H 1.523 8.585 3.979 1.00 . B B . 47 LEU HD13 1 1 8 5761 2 2 3 LEU HD21 H 0.970 9.730 1.823 1.00 . B B . 47 LEU HD21 1 1 8 5762 2 2 3 LEU HD22 H 2.285 10.072 0.697 1.00 . B B . 47 LEU HD22 1 1 8 5763 2 2 3 LEU HD23 H 1.857 11.250 1.937 1.00 . B B . 47 LEU HD23 1 1 8 5764 2 2 3 LEU HG H 3.229 8.581 2.285 1.00 . B B . 47 LEU HG 1 1 8 5765 2 2 3 LEU N N 6.337 10.888 1.914 1.00 . B B . 47 LEU N 1 1 8 5766 2 2 3 LEU O O 4.188 12.491 0.707 1.00 . B B . 47 LEU O 1 1 8 5767 2 2 4 PRO C C 2.009 11.930 -1.443 1.00 . B B . 48 PRO C 1 1 8 5768 2 2 4 PRO CA C 3.464 11.568 -1.779 1.00 . B B . 48 PRO CA 1 1 8 5769 2 2 4 PRO CB C 3.529 10.643 -2.989 1.00 . B B . 48 PRO CB 1 1 8 5770 2 2 4 PRO CD C 4.239 9.351 -1.079 1.00 . B B . 48 PRO CD 1 1 8 5771 2 2 4 PRO CG C 3.557 9.261 -2.420 1.00 . B B . 48 PRO CG 1 1 8 5772 2 2 4 PRO HA H 4.050 12.454 -1.957 1.00 . B B . 48 PRO HA 1 1 8 5773 2 2 4 PRO HB2 H 2.656 10.775 -3.610 1.00 . B B . 48 PRO HB2 1 1 8 5774 2 2 4 PRO HB3 H 4.427 10.832 -3.560 1.00 . B B . 48 PRO HB3 1 1 8 5775 2 2 4 PRO HD2 H 3.760 8.696 -0.367 1.00 . B B . 48 PRO HD2 1 1 8 5776 2 2 4 PRO HD3 H 5.288 9.113 -1.173 1.00 . B B . 48 PRO HD3 1 1 8 5777 2 2 4 PRO HG2 H 2.550 8.892 -2.299 1.00 . B B . 48 PRO HG2 1 1 8 5778 2 2 4 PRO HG3 H 4.114 8.604 -3.073 1.00 . B B . 48 PRO HG3 1 1 8 5779 2 2 4 PRO N N 4.063 10.758 -0.686 1.00 . B B . 48 PRO N 1 1 8 5780 2 2 4 PRO O O 1.271 11.104 -0.945 1.00 . B B . 48 PRO O 1 1 8 5781 2 2 5 PRO C C -0.726 12.998 -2.454 1.00 . B B . 49 PRO C 1 1 8 5782 2 2 5 PRO CA C 0.253 13.607 -1.445 1.00 . B B . 49 PRO CA 1 1 8 5783 2 2 5 PRO CB C 0.326 15.121 -1.611 1.00 . B B . 49 PRO CB 1 1 8 5784 2 2 5 PRO CD C 2.453 14.224 -2.327 1.00 . B B . 49 PRO CD 1 1 8 5785 2 2 5 PRO CG C 1.480 15.356 -2.535 1.00 . B B . 49 PRO CG 1 1 8 5786 2 2 5 PRO HA H -0.032 13.358 -0.435 1.00 . B B . 49 PRO HA 1 1 8 5787 2 2 5 PRO HB2 H -0.587 15.496 -2.051 1.00 . B B . 49 PRO HB2 1 1 8 5788 2 2 5 PRO HB3 H 0.506 15.596 -0.658 1.00 . B B . 49 PRO HB3 1 1 8 5789 2 2 5 PRO HD2 H 2.863 13.901 -3.273 1.00 . B B . 49 PRO HD2 1 1 8 5790 2 2 5 PRO HD3 H 3.242 14.520 -1.653 1.00 . B B . 49 PRO HD3 1 1 8 5791 2 2 5 PRO HG2 H 1.138 15.365 -3.558 1.00 . B B . 49 PRO HG2 1 1 8 5792 2 2 5 PRO HG3 H 1.956 16.296 -2.297 1.00 . B B . 49 PRO HG3 1 1 8 5793 2 2 5 PRO N N 1.638 13.155 -1.728 1.00 . B B . 49 PRO N 1 1 8 5794 2 2 5 PRO O O -0.328 12.424 -3.449 1.00 . B B . 49 PRO O 1 1 8 5795 2 2 6 TYR C C -4.394 13.108 -2.849 1.00 . B B . 50 TYR C 1 1 8 5796 2 2 6 TYR CA C -3.003 12.547 -3.151 1.00 . B B . 50 TYR CA 1 1 8 5797 2 2 6 TYR CB C -2.968 11.038 -2.905 1.00 . B B . 50 TYR CB 1 1 8 5798 2 2 6 TYR CD1 C -3.559 10.675 -5.329 1.00 . B B . 50 TYR CD1 1 1 8 5799 2 2 6 TYR CD2 C -4.679 9.340 -3.643 1.00 . B B . 50 TYR CD2 1 1 8 5800 2 2 6 TYR CE1 C -4.288 10.022 -6.330 1.00 . B B . 50 TYR CE1 1 1 8 5801 2 2 6 TYR CE2 C -5.408 8.687 -4.644 1.00 . B B . 50 TYR CE2 1 1 8 5802 2 2 6 TYR CG C -3.755 10.334 -3.986 1.00 . B B . 50 TYR CG 1 1 8 5803 2 2 6 TYR CZ C -5.213 9.027 -5.988 1.00 . B B . 50 TYR CZ 1 1 8 5804 2 2 6 TYR H H -2.300 13.585 -1.397 1.00 . B B . 50 TYR H 1 1 8 5805 2 2 6 TYR HA H -2.722 12.761 -4.170 1.00 . B B . 50 TYR HA 1 1 8 5806 2 2 6 TYR HB2 H -1.945 10.695 -2.922 1.00 . B B . 50 TYR HB2 1 1 8 5807 2 2 6 TYR HB3 H -3.406 10.820 -1.942 1.00 . B B . 50 TYR HB3 1 1 8 5808 2 2 6 TYR HD1 H -2.846 11.441 -5.593 1.00 . B B . 50 TYR HD1 1 1 8 5809 2 2 6 TYR HD2 H -4.831 9.078 -2.608 1.00 . B B . 50 TYR HD2 1 1 8 5810 2 2 6 TYR HE1 H -4.138 10.285 -7.367 1.00 . B B . 50 TYR HE1 1 1 8 5811 2 2 6 TYR HE2 H -6.122 7.920 -4.380 1.00 . B B . 50 TYR HE2 1 1 8 5812 2 2 6 TYR HH H -5.384 7.678 -7.327 1.00 . B B . 50 TYR HH 1 1 8 5813 2 2 6 TYR N N -2.001 13.117 -2.205 1.00 . B B . 50 TYR N 1 1 8 5814 2 2 6 TYR O O -4.752 13.158 -1.683 1.00 . B B . 50 TYR O 1 1 8 5815 2 2 6 TYR OXT O -5.079 13.479 -3.788 1.00 . B B . 50 TYR OXT 1 1 8 5816 2 2 6 TYR OH O -5.930 8.384 -6.975 1.00 . B B . 50 TYR OH 1 1 9 5817 1 1 1 PHE C C 6.288 -11.141 13.550 1.00 . A A . 5 PHE C 1 1 9 5818 1 1 1 PHE CA C 7.022 -12.473 13.386 1.00 . A A . 5 PHE CA 1 1 9 5819 1 1 1 PHE CB C 8.498 -12.323 13.758 1.00 . A A . 5 PHE CB 1 1 9 5820 1 1 1 PHE CD1 C 8.158 -12.856 16.198 1.00 . A A . 5 PHE CD1 1 1 9 5821 1 1 1 PHE CD2 C 9.182 -10.741 15.597 1.00 . A A . 5 PHE CD2 1 1 9 5822 1 1 1 PHE CE1 C 8.268 -12.523 17.554 1.00 . A A . 5 PHE CE1 1 1 9 5823 1 1 1 PHE CE2 C 9.291 -10.408 16.953 1.00 . A A . 5 PHE CE2 1 1 9 5824 1 1 1 PHE CG C 8.616 -11.965 15.220 1.00 . A A . 5 PHE CG 1 1 9 5825 1 1 1 PHE CZ C 8.834 -11.300 17.932 1.00 . A A . 5 PHE CZ 1 1 9 5826 1 1 1 PHE HA H 6.564 -13.234 13.999 1.00 . A A . 5 PHE HA 1 1 9 5827 1 1 1 PHE HB2 H 9.013 -13.254 13.573 1.00 . A A . 5 PHE HB2 1 1 9 5828 1 1 1 PHE HB3 H 8.942 -11.541 13.160 1.00 . A A . 5 PHE HB3 1 1 9 5829 1 1 1 PHE HD1 H 7.721 -13.800 15.906 1.00 . A A . 5 PHE HD1 1 1 9 5830 1 1 1 PHE HD2 H 9.534 -10.054 14.843 1.00 . A A . 5 PHE HD2 1 1 9 5831 1 1 1 PHE HE1 H 7.914 -13.211 18.307 1.00 . A A . 5 PHE HE1 1 1 9 5832 1 1 1 PHE HE2 H 9.728 -9.466 17.245 1.00 . A A . 5 PHE HE2 1 1 9 5833 1 1 1 PHE HZ H 8.918 -11.044 18.976 1.00 . A A . 5 PHE HZ 1 1 9 5834 1 1 1 PHE N N 7.025 -12.889 11.955 1.00 . A A . 5 PHE N 1 1 9 5835 1 1 1 PHE O O 5.228 -11.071 14.138 1.00 . A A . 5 PHE O 1 1 9 5836 1 1 2 GLU C C 5.202 -8.536 11.996 1.00 . A A . 6 GLU C 1 1 9 5837 1 1 2 GLU CA C 6.178 -8.750 13.156 1.00 . A A . 6 GLU CA 1 1 9 5838 1 1 2 GLU CB C 7.315 -7.730 13.097 1.00 . A A . 6 GLU CB 1 1 9 5839 1 1 2 GLU CD C 9.507 -8.229 12.007 1.00 . A A . 6 GLU CD 1 1 9 5840 1 1 2 GLU CG C 8.045 -7.856 11.759 1.00 . A A . 6 GLU CG 1 1 9 5841 1 1 2 GLU H H 7.700 -10.155 12.559 1.00 . A A . 6 GLU H 1 1 9 5842 1 1 2 GLU HA H 5.664 -8.675 14.101 1.00 . A A . 6 GLU HA 1 1 9 5843 1 1 2 GLU HB2 H 6.910 -6.735 13.195 1.00 . A A . 6 GLU HB2 1 1 9 5844 1 1 2 GLU HB3 H 8.009 -7.917 13.904 1.00 . A A . 6 GLU HB3 1 1 9 5845 1 1 2 GLU HG2 H 7.574 -8.622 11.163 1.00 . A A . 6 GLU HG2 1 1 9 5846 1 1 2 GLU HG3 H 7.999 -6.913 11.234 1.00 . A A . 6 GLU HG3 1 1 9 5847 1 1 2 GLU N N 6.845 -10.079 13.031 1.00 . A A . 6 GLU N 1 1 9 5848 1 1 2 GLU O O 4.294 -7.733 12.078 1.00 . A A . 6 GLU O 1 1 9 5849 1 1 2 GLU OE1 O 10.099 -7.658 12.909 1.00 . A A . 6 GLU OE1 1 1 9 5850 1 1 2 GLU OE2 O 10.011 -9.079 11.293 1.00 . A A . 6 GLU OE2 1 1 9 5851 1 1 3 ILE C C 3.723 -10.394 9.472 1.00 . A A . 7 ILE C 1 1 9 5852 1 1 3 ILE CA C 4.466 -9.081 9.752 1.00 . A A . 7 ILE CA 1 1 9 5853 1 1 3 ILE CB C 5.377 -8.721 8.579 1.00 . A A . 7 ILE CB 1 1 9 5854 1 1 3 ILE CD1 C 4.985 -6.294 9.031 1.00 . A A . 7 ILE CD1 1 1 9 5855 1 1 3 ILE CG1 C 6.053 -7.375 8.855 1.00 . A A . 7 ILE CG1 1 1 9 5856 1 1 3 ILE CG2 C 4.545 -8.618 7.299 1.00 . A A . 7 ILE CG2 1 1 9 5857 1 1 3 ILE H H 6.122 -9.888 10.870 1.00 . A A . 7 ILE H 1 1 9 5858 1 1 3 ILE HA H 3.766 -8.282 9.935 1.00 . A A . 7 ILE HA 1 1 9 5859 1 1 3 ILE HB H 6.129 -9.487 8.458 1.00 . A A . 7 ILE HB 1 1 9 5860 1 1 3 ILE HD11 H 4.039 -6.658 8.657 1.00 . A A . 7 ILE HD11 1 1 9 5861 1 1 3 ILE HD12 H 5.273 -5.411 8.481 1.00 . A A . 7 ILE HD12 1 1 9 5862 1 1 3 ILE HD13 H 4.888 -6.050 10.079 1.00 . A A . 7 ILE HD13 1 1 9 5863 1 1 3 ILE HG12 H 6.644 -7.448 9.757 1.00 . A A . 7 ILE HG12 1 1 9 5864 1 1 3 ILE HG13 H 6.693 -7.118 8.023 1.00 . A A . 7 ILE HG13 1 1 9 5865 1 1 3 ILE HG21 H 3.546 -8.983 7.488 1.00 . A A . 7 ILE HG21 1 1 9 5866 1 1 3 ILE HG22 H 5.004 -9.212 6.523 1.00 . A A . 7 ILE HG22 1 1 9 5867 1 1 3 ILE HG23 H 4.497 -7.587 6.982 1.00 . A A . 7 ILE HG23 1 1 9 5868 1 1 3 ILE N N 5.384 -9.247 10.916 1.00 . A A . 7 ILE N 1 1 9 5869 1 1 3 ILE O O 4.276 -11.299 8.879 1.00 . A A . 7 ILE O 1 1 9 5870 1 1 4 PRO C C 1.280 -11.808 8.219 1.00 . A A . 8 PRO C 1 1 9 5871 1 1 4 PRO CA C 1.676 -11.684 9.692 1.00 . A A . 8 PRO CA 1 1 9 5872 1 1 4 PRO CB C 0.446 -11.461 10.570 1.00 . A A . 8 PRO CB 1 1 9 5873 1 1 4 PRO CD C 1.737 -9.424 10.633 1.00 . A A . 8 PRO CD 1 1 9 5874 1 1 4 PRO CG C 0.337 -9.977 10.709 1.00 . A A . 8 PRO CG 1 1 9 5875 1 1 4 PRO HA H 2.210 -12.561 10.022 1.00 . A A . 8 PRO HA 1 1 9 5876 1 1 4 PRO HB2 H -0.435 -11.859 10.089 1.00 . A A . 8 PRO HB2 1 1 9 5877 1 1 4 PRO HB3 H 0.587 -11.919 11.537 1.00 . A A . 8 PRO HB3 1 1 9 5878 1 1 4 PRO HD2 H 1.748 -8.494 10.083 1.00 . A A . 8 PRO HD2 1 1 9 5879 1 1 4 PRO HD3 H 2.143 -9.283 11.623 1.00 . A A . 8 PRO HD3 1 1 9 5880 1 1 4 PRO HG2 H -0.262 -9.574 9.906 1.00 . A A . 8 PRO HG2 1 1 9 5881 1 1 4 PRO HG3 H -0.107 -9.727 11.663 1.00 . A A . 8 PRO HG3 1 1 9 5882 1 1 4 PRO N N 2.488 -10.461 9.908 1.00 . A A . 8 PRO N 1 1 9 5883 1 1 4 PRO O O 1.760 -11.080 7.374 1.00 . A A . 8 PRO O 1 1 9 5884 1 1 5 ASP C C -1.542 -12.850 6.378 1.00 . A A . 9 ASP C 1 1 9 5885 1 1 5 ASP CA C -0.015 -12.899 6.485 1.00 . A A . 9 ASP CA 1 1 9 5886 1 1 5 ASP CB C 0.508 -14.276 6.078 1.00 . A A . 9 ASP CB 1 1 9 5887 1 1 5 ASP CG C 1.321 -14.153 4.787 1.00 . A A . 9 ASP CG 1 1 9 5888 1 1 5 ASP H H 0.034 -13.307 8.600 1.00 . A A . 9 ASP H 1 1 9 5889 1 1 5 ASP HA H 0.431 -12.138 5.865 1.00 . A A . 9 ASP HA 1 1 9 5890 1 1 5 ASP HB2 H 1.136 -14.670 6.863 1.00 . A A . 9 ASP HB2 1 1 9 5891 1 1 5 ASP HB3 H -0.325 -14.944 5.916 1.00 . A A . 9 ASP HB3 1 1 9 5892 1 1 5 ASP N N 0.409 -12.728 7.904 1.00 . A A . 9 ASP N 1 1 9 5893 1 1 5 ASP O O -2.148 -13.623 5.663 1.00 . A A . 9 ASP O 1 1 9 5894 1 1 5 ASP OD1 O 0.955 -13.341 3.955 1.00 . A A . 9 ASP OD1 1 1 9 5895 1 1 5 ASP OD2 O 2.297 -14.873 4.655 1.00 . A A . 9 ASP OD2 1 1 9 5896 1 1 6 ASP C C -4.088 -11.253 5.679 1.00 . A A . 10 ASP C 1 1 9 5897 1 1 6 ASP CA C -3.655 -11.853 7.019 1.00 . A A . 10 ASP CA 1 1 9 5898 1 1 6 ASP CB C -4.042 -10.931 8.174 1.00 . A A . 10 ASP CB 1 1 9 5899 1 1 6 ASP CG C -4.517 -11.770 9.361 1.00 . A A . 10 ASP CG 1 1 9 5900 1 1 6 ASP H H -1.660 -11.333 7.653 1.00 . A A . 10 ASP H 1 1 9 5901 1 1 6 ASP HA H -4.100 -12.825 7.159 1.00 . A A . 10 ASP HA 1 1 9 5902 1 1 6 ASP HB2 H -3.187 -10.342 8.469 1.00 . A A . 10 ASP HB2 1 1 9 5903 1 1 6 ASP HB3 H -4.839 -10.272 7.857 1.00 . A A . 10 ASP HB3 1 1 9 5904 1 1 6 ASP N N -2.168 -11.949 7.084 1.00 . A A . 10 ASP N 1 1 9 5905 1 1 6 ASP O O -4.450 -11.961 4.760 1.00 . A A . 10 ASP O 1 1 9 5906 1 1 6 ASP OD1 O -5.671 -12.170 9.354 1.00 . A A . 10 ASP OD1 1 1 9 5907 1 1 6 ASP OD2 O -3.721 -11.998 10.256 1.00 . A A . 10 ASP OD2 1 1 9 5908 1 1 7 VAL C C -3.508 -8.159 3.934 1.00 . A A . 11 VAL C 1 1 9 5909 1 1 7 VAL CA C -4.463 -9.312 4.275 1.00 . A A . 11 VAL CA 1 1 9 5910 1 1 7 VAL CB C -5.873 -8.782 4.535 1.00 . A A . 11 VAL CB 1 1 9 5911 1 1 7 VAL CG1 C -5.852 -7.850 5.751 1.00 . A A . 11 VAL CG1 1 1 9 5912 1 1 7 VAL CG2 C -6.360 -8.009 3.308 1.00 . A A . 11 VAL CG2 1 1 9 5913 1 1 7 VAL H H -3.759 -9.399 6.310 1.00 . A A . 11 VAL H 1 1 9 5914 1 1 7 VAL HA H -4.484 -10.042 3.484 1.00 . A A . 11 VAL HA 1 1 9 5915 1 1 7 VAL HB H -6.540 -9.609 4.727 1.00 . A A . 11 VAL HB 1 1 9 5916 1 1 7 VAL HG11 H -6.855 -7.510 5.961 1.00 . A A . 11 VAL HG11 1 1 9 5917 1 1 7 VAL HG12 H -5.219 -7.000 5.542 1.00 . A A . 11 VAL HG12 1 1 9 5918 1 1 7 VAL HG13 H -5.467 -8.385 6.606 1.00 . A A . 11 VAL HG13 1 1 9 5919 1 1 7 VAL HG21 H -7.311 -7.547 3.528 1.00 . A A . 11 VAL HG21 1 1 9 5920 1 1 7 VAL HG22 H -6.474 -8.688 2.476 1.00 . A A . 11 VAL HG22 1 1 9 5921 1 1 7 VAL HG23 H -5.638 -7.245 3.056 1.00 . A A . 11 VAL HG23 1 1 9 5922 1 1 7 VAL N N -4.054 -9.953 5.558 1.00 . A A . 11 VAL N 1 1 9 5923 1 1 7 VAL O O -3.183 -7.360 4.789 1.00 . A A . 11 VAL O 1 1 9 5924 1 1 8 PRO C C -2.903 -5.685 2.161 1.00 . A A . 12 PRO C 1 1 9 5925 1 1 8 PRO CA C -2.161 -7.026 2.262 1.00 . A A . 12 PRO CA 1 1 9 5926 1 1 8 PRO CB C -1.666 -7.499 0.897 1.00 . A A . 12 PRO CB 1 1 9 5927 1 1 8 PRO CD C -3.419 -9.017 1.589 1.00 . A A . 12 PRO CD 1 1 9 5928 1 1 8 PRO CG C -2.732 -8.419 0.387 1.00 . A A . 12 PRO CG 1 1 9 5929 1 1 8 PRO HA H -1.332 -6.948 2.946 1.00 . A A . 12 PRO HA 1 1 9 5930 1 1 8 PRO HB2 H -1.547 -6.659 0.230 1.00 . A A . 12 PRO HB2 1 1 9 5931 1 1 8 PRO HB3 H -0.732 -8.031 1.001 1.00 . A A . 12 PRO HB3 1 1 9 5932 1 1 8 PRO HD2 H -4.487 -9.051 1.435 1.00 . A A . 12 PRO HD2 1 1 9 5933 1 1 8 PRO HD3 H -3.035 -10.007 1.789 1.00 . A A . 12 PRO HD3 1 1 9 5934 1 1 8 PRO HG2 H -3.444 -7.867 -0.207 1.00 . A A . 12 PRO HG2 1 1 9 5935 1 1 8 PRO HG3 H -2.286 -9.202 -0.208 1.00 . A A . 12 PRO HG3 1 1 9 5936 1 1 8 PRO N N -3.086 -8.103 2.692 1.00 . A A . 12 PRO N 1 1 9 5937 1 1 8 PRO O O -2.947 -4.924 3.108 1.00 . A A . 12 PRO O 1 1 9 5938 1 1 9 LEU C C -5.716 -4.361 0.663 1.00 . A A . 13 LEU C 1 1 9 5939 1 1 9 LEU CA C -4.222 -4.095 0.893 1.00 . A A . 13 LEU CA 1 1 9 5940 1 1 9 LEU CB C -3.604 -3.420 -0.334 1.00 . A A . 13 LEU CB 1 1 9 5941 1 1 9 LEU CD1 C -1.227 -4.024 -0.819 1.00 . A A . 13 LEU CD1 1 1 9 5942 1 1 9 LEU CD2 C -1.867 -1.632 -0.498 1.00 . A A . 13 LEU CD2 1 1 9 5943 1 1 9 LEU CG C -2.142 -3.069 -0.049 1.00 . A A . 13 LEU CG 1 1 9 5944 1 1 9 LEU H H -3.449 -6.007 0.277 1.00 . A A . 13 LEU H 1 1 9 5945 1 1 9 LEU HA H -4.074 -3.481 1.767 1.00 . A A . 13 LEU HA 1 1 9 5946 1 1 9 LEU HB2 H -3.655 -4.093 -1.178 1.00 . A A . 13 LEU HB2 1 1 9 5947 1 1 9 LEU HB3 H -4.153 -2.518 -0.562 1.00 . A A . 13 LEU HB3 1 1 9 5948 1 1 9 LEU HD11 H -1.747 -4.397 -1.689 1.00 . A A . 13 LEU HD11 1 1 9 5949 1 1 9 LEU HD12 H -0.950 -4.851 -0.182 1.00 . A A . 13 LEU HD12 1 1 9 5950 1 1 9 LEU HD13 H -0.338 -3.497 -1.131 1.00 . A A . 13 LEU HD13 1 1 9 5951 1 1 9 LEU HD21 H -0.842 -1.376 -0.279 1.00 . A A . 13 LEU HD21 1 1 9 5952 1 1 9 LEU HD22 H -2.527 -0.959 0.027 1.00 . A A . 13 LEU HD22 1 1 9 5953 1 1 9 LEU HD23 H -2.040 -1.549 -1.561 1.00 . A A . 13 LEU HD23 1 1 9 5954 1 1 9 LEU HG H -1.949 -3.160 1.010 1.00 . A A . 13 LEU HG 1 1 9 5955 1 1 9 LEU N N -3.488 -5.387 1.030 1.00 . A A . 13 LEU N 1 1 9 5956 1 1 9 LEU O O -6.072 -5.292 -0.032 1.00 . A A . 13 LEU O 1 1 9 5957 1 1 10 PRO C C -8.453 -3.262 -0.308 1.00 . A A . 14 PRO C 1 1 9 5958 1 1 10 PRO CA C -8.012 -3.703 1.090 1.00 . A A . 14 PRO CA 1 1 9 5959 1 1 10 PRO CB C -8.600 -2.800 2.169 1.00 . A A . 14 PRO CB 1 1 9 5960 1 1 10 PRO CD C -6.215 -2.385 2.105 1.00 . A A . 14 PRO CD 1 1 9 5961 1 1 10 PRO CG C -7.552 -1.767 2.435 1.00 . A A . 14 PRO CG 1 1 9 5962 1 1 10 PRO HA H -8.296 -4.727 1.271 1.00 . A A . 14 PRO HA 1 1 9 5963 1 1 10 PRO HB2 H -9.506 -2.333 1.813 1.00 . A A . 14 PRO HB2 1 1 9 5964 1 1 10 PRO HB3 H -8.801 -3.370 3.065 1.00 . A A . 14 PRO HB3 1 1 9 5965 1 1 10 PRO HD2 H -5.596 -1.681 1.568 1.00 . A A . 14 PRO HD2 1 1 9 5966 1 1 10 PRO HD3 H -5.719 -2.715 3.005 1.00 . A A . 14 PRO HD3 1 1 9 5967 1 1 10 PRO HG2 H -7.723 -0.903 1.812 1.00 . A A . 14 PRO HG2 1 1 9 5968 1 1 10 PRO HG3 H -7.575 -1.479 3.476 1.00 . A A . 14 PRO HG3 1 1 9 5969 1 1 10 PRO N N -6.548 -3.535 1.250 1.00 . A A . 14 PRO N 1 1 9 5970 1 1 10 PRO O O -7.646 -2.878 -1.131 1.00 . A A . 14 PRO O 1 1 9 5971 1 1 11 ALA C C -10.024 -1.417 -2.159 1.00 . A A . 15 ALA C 1 1 9 5972 1 1 11 ALA CA C -10.217 -2.920 -1.938 1.00 . A A . 15 ALA CA 1 1 9 5973 1 1 11 ALA CB C -11.704 -3.274 -1.938 1.00 . A A . 15 ALA CB 1 1 9 5974 1 1 11 ALA H H -10.360 -3.645 0.088 1.00 . A A . 15 ALA H 1 1 9 5975 1 1 11 ALA HA H -9.708 -3.481 -2.707 1.00 . A A . 15 ALA HA 1 1 9 5976 1 1 11 ALA HB1 H -11.848 -4.225 -1.447 1.00 . A A . 15 ALA HB1 1 1 9 5977 1 1 11 ALA HB2 H -12.061 -3.336 -2.955 1.00 . A A . 15 ALA HB2 1 1 9 5978 1 1 11 ALA HB3 H -12.256 -2.510 -1.411 1.00 . A A . 15 ALA HB3 1 1 9 5979 1 1 11 ALA N N -9.726 -3.325 -0.588 1.00 . A A . 15 ALA N 1 1 9 5980 1 1 11 ALA O O -9.860 -0.657 -1.225 1.00 . A A . 15 ALA O 1 1 9 5981 1 1 12 GLY C C -8.407 0.863 -3.491 1.00 . A A . 16 GLY C 1 1 9 5982 1 1 12 GLY CA C -9.873 0.466 -3.684 1.00 . A A . 16 GLY CA 1 1 9 5983 1 1 12 GLY H H -10.187 -1.617 -4.128 1.00 . A A . 16 GLY H 1 1 9 5984 1 1 12 GLY HA2 H -10.166 0.665 -4.704 1.00 . A A . 16 GLY HA2 1 1 9 5985 1 1 12 GLY HA3 H -10.492 1.044 -3.015 1.00 . A A . 16 GLY HA3 1 1 9 5986 1 1 12 GLY N N -10.049 -0.985 -3.392 1.00 . A A . 16 GLY N 1 1 9 5987 1 1 12 GLY O O -8.087 2.023 -3.326 1.00 . A A . 16 GLY O 1 1 9 5988 1 1 13 TRP C C -5.286 -0.063 -4.602 1.00 . A A . 17 TRP C 1 1 9 5989 1 1 13 TRP CA C -6.073 0.245 -3.325 1.00 . A A . 17 TRP CA 1 1 9 5990 1 1 13 TRP CB C -5.615 -0.642 -2.171 1.00 . A A . 17 TRP CB 1 1 9 5991 1 1 13 TRP CD1 C -6.803 0.230 -0.118 1.00 . A A . 17 TRP CD1 1 1 9 5992 1 1 13 TRP CD2 C -4.681 0.947 -0.268 1.00 . A A . 17 TRP CD2 1 1 9 5993 1 1 13 TRP CE2 C -5.213 1.510 0.915 1.00 . A A . 17 TRP CE2 1 1 9 5994 1 1 13 TRP CE3 C -3.352 1.241 -0.603 1.00 . A A . 17 TRP CE3 1 1 9 5995 1 1 13 TRP CG C -5.706 0.137 -0.901 1.00 . A A . 17 TRP CG 1 1 9 5996 1 1 13 TRP CH2 C -3.125 2.619 1.385 1.00 . A A . 17 TRP CH2 1 1 9 5997 1 1 13 TRP CZ2 C -4.447 2.337 1.737 1.00 . A A . 17 TRP CZ2 1 1 9 5998 1 1 13 TRP CZ3 C -2.582 2.072 0.219 1.00 . A A . 17 TRP CZ3 1 1 9 5999 1 1 13 TRP H H -7.787 -1.017 -3.642 1.00 . A A . 17 TRP H 1 1 9 6000 1 1 13 TRP HA H -5.958 1.284 -3.057 1.00 . A A . 17 TRP HA 1 1 9 6001 1 1 13 TRP HB2 H -6.252 -1.511 -2.110 1.00 . A A . 17 TRP HB2 1 1 9 6002 1 1 13 TRP HB3 H -4.593 -0.950 -2.334 1.00 . A A . 17 TRP HB3 1 1 9 6003 1 1 13 TRP HD1 H -7.752 -0.254 -0.304 1.00 . A A . 17 TRP HD1 1 1 9 6004 1 1 13 TRP HE1 H -7.136 1.285 1.682 1.00 . A A . 17 TRP HE1 1 1 9 6005 1 1 13 TRP HE3 H -2.920 0.826 -1.501 1.00 . A A . 17 TRP HE3 1 1 9 6006 1 1 13 TRP HH2 H -2.519 3.256 2.010 1.00 . A A . 17 TRP HH2 1 1 9 6007 1 1 13 TRP HZ2 H -4.872 2.756 2.637 1.00 . A A . 17 TRP HZ2 1 1 9 6008 1 1 13 TRP HZ3 H -1.567 2.298 -0.050 1.00 . A A . 17 TRP HZ3 1 1 9 6009 1 1 13 TRP N N -7.513 -0.088 -3.510 1.00 . A A . 17 TRP N 1 1 9 6010 1 1 13 TRP NE1 N -6.513 1.048 0.964 1.00 . A A . 17 TRP NE1 1 1 9 6011 1 1 13 TRP O O -5.687 -0.882 -5.404 1.00 . A A . 17 TRP O 1 1 9 6012 1 1 14 GLU C C -1.879 0.357 -5.761 1.00 . A A . 18 GLU C 1 1 9 6013 1 1 14 GLU CA C -3.382 0.347 -6.046 1.00 . A A . 18 GLU CA 1 1 9 6014 1 1 14 GLU CB C -3.727 1.518 -6.970 1.00 . A A . 18 GLU CB 1 1 9 6015 1 1 14 GLU CD C -5.878 0.474 -7.698 1.00 . A A . 18 GLU CD 1 1 9 6016 1 1 14 GLU CG C -4.529 1.016 -8.171 1.00 . A A . 18 GLU CG 1 1 9 6017 1 1 14 GLU H H -3.872 1.263 -4.155 1.00 . A A . 18 GLU H 1 1 9 6018 1 1 14 GLU HA H -3.677 -0.581 -6.506 1.00 . A A . 18 GLU HA 1 1 9 6019 1 1 14 GLU HB2 H -4.309 2.245 -6.426 1.00 . A A . 18 GLU HB2 1 1 9 6020 1 1 14 GLU HB3 H -2.815 1.979 -7.317 1.00 . A A . 18 GLU HB3 1 1 9 6021 1 1 14 GLU HG2 H -4.691 1.835 -8.858 1.00 . A A . 18 GLU HG2 1 1 9 6022 1 1 14 GLU HG3 H -3.978 0.234 -8.669 1.00 . A A . 18 GLU HG3 1 1 9 6023 1 1 14 GLU N N -4.176 0.597 -4.806 1.00 . A A . 18 GLU N 1 1 9 6024 1 1 14 GLU O O -1.255 1.403 -5.753 1.00 . A A . 18 GLU O 1 1 9 6025 1 1 14 GLU OE1 O -6.591 1.209 -7.037 1.00 . A A . 18 GLU OE1 1 1 9 6026 1 1 14 GLU OE2 O -6.175 -0.668 -8.006 1.00 . A A . 18 GLU OE2 1 1 9 6027 1 1 15 MET C C 0.893 -0.249 -6.553 1.00 . A A . 19 MET C 1 1 9 6028 1 1 15 MET CA C 0.191 -0.794 -5.314 1.00 . A A . 19 MET CA 1 1 9 6029 1 1 15 MET CB C 0.594 -2.248 -5.085 1.00 . A A . 19 MET CB 1 1 9 6030 1 1 15 MET CE C -1.481 -4.376 -4.503 1.00 . A A . 19 MET CE 1 1 9 6031 1 1 15 MET CG C 0.156 -3.115 -6.270 1.00 . A A . 19 MET CG 1 1 9 6032 1 1 15 MET H H -1.773 -1.626 -5.579 1.00 . A A . 19 MET H 1 1 9 6033 1 1 15 MET HA H 0.434 -0.198 -4.449 1.00 . A A . 19 MET HA 1 1 9 6034 1 1 15 MET HB2 H 1.662 -2.297 -4.992 1.00 . A A . 19 MET HB2 1 1 9 6035 1 1 15 MET HB3 H 0.146 -2.609 -4.173 1.00 . A A . 19 MET HB3 1 1 9 6036 1 1 15 MET HE1 H -2.399 -4.878 -4.772 1.00 . A A . 19 MET HE1 1 1 9 6037 1 1 15 MET HE2 H -1.641 -3.310 -4.506 1.00 . A A . 19 MET HE2 1 1 9 6038 1 1 15 MET HE3 H -1.168 -4.689 -3.515 1.00 . A A . 19 MET HE3 1 1 9 6039 1 1 15 MET HG2 H -0.730 -2.698 -6.722 1.00 . A A . 19 MET HG2 1 1 9 6040 1 1 15 MET HG3 H 0.948 -3.144 -7.004 1.00 . A A . 19 MET HG3 1 1 9 6041 1 1 15 MET N N -1.275 -0.788 -5.555 1.00 . A A . 19 MET N 1 1 9 6042 1 1 15 MET O O 0.696 -0.724 -7.654 1.00 . A A . 19 MET O 1 1 9 6043 1 1 15 MET SD S -0.191 -4.798 -5.700 1.00 . A A . 19 MET SD 1 1 9 6044 1 1 16 ALA C C 3.745 1.922 -7.057 1.00 . A A . 20 ALA C 1 1 9 6045 1 1 16 ALA CA C 2.411 1.337 -7.544 1.00 . A A . 20 ALA CA 1 1 9 6046 1 1 16 ALA CB C 1.440 2.401 -8.071 1.00 . A A . 20 ALA CB 1 1 9 6047 1 1 16 ALA H H 1.837 1.114 -5.485 1.00 . A A . 20 ALA H 1 1 9 6048 1 1 16 ALA HA H 2.583 0.584 -8.300 1.00 . A A . 20 ALA HA 1 1 9 6049 1 1 16 ALA HB1 H 1.061 2.982 -7.244 1.00 . A A . 20 ALA HB1 1 1 9 6050 1 1 16 ALA HB2 H 0.614 1.912 -8.568 1.00 . A A . 20 ALA HB2 1 1 9 6051 1 1 16 ALA HB3 H 1.943 3.047 -8.771 1.00 . A A . 20 ALA HB3 1 1 9 6052 1 1 16 ALA N N 1.700 0.746 -6.382 1.00 . A A . 20 ALA N 1 1 9 6053 1 1 16 ALA O O 4.469 1.264 -6.333 1.00 . A A . 20 ALA O 1 1 9 6054 1 1 17 LYS C C 5.371 5.197 -6.808 1.00 . A A . 21 LYS C 1 1 9 6055 1 1 17 LYS CA C 5.396 3.676 -6.931 1.00 . A A . 21 LYS CA 1 1 9 6056 1 1 17 LYS CB C 6.429 3.235 -7.968 1.00 . A A . 21 LYS CB 1 1 9 6057 1 1 17 LYS CD C 5.602 2.804 -10.286 1.00 . A A . 21 LYS CD 1 1 9 6058 1 1 17 LYS CE C 6.621 2.618 -11.411 1.00 . A A . 21 LYS CE 1 1 9 6059 1 1 17 LYS CG C 6.103 3.878 -9.317 1.00 . A A . 21 LYS CG 1 1 9 6060 1 1 17 LYS H H 3.521 3.668 -7.999 1.00 . A A . 21 LYS H 1 1 9 6061 1 1 17 LYS HA H 5.631 3.244 -5.978 1.00 . A A . 21 LYS HA 1 1 9 6062 1 1 17 LYS HB2 H 7.413 3.546 -7.650 1.00 . A A . 21 LYS HB2 1 1 9 6063 1 1 17 LYS HB3 H 6.405 2.161 -8.066 1.00 . A A . 21 LYS HB3 1 1 9 6064 1 1 17 LYS HD2 H 5.477 1.871 -9.756 1.00 . A A . 21 LYS HD2 1 1 9 6065 1 1 17 LYS HD3 H 4.655 3.110 -10.704 1.00 . A A . 21 LYS HD3 1 1 9 6066 1 1 17 LYS HE2 H 7.607 2.908 -11.078 1.00 . A A . 21 LYS HE2 1 1 9 6067 1 1 17 LYS HE3 H 6.624 1.592 -11.751 1.00 . A A . 21 LYS HE3 1 1 9 6068 1 1 17 LYS HG2 H 5.336 4.626 -9.183 1.00 . A A . 21 LYS HG2 1 1 9 6069 1 1 17 LYS HG3 H 6.992 4.340 -9.720 1.00 . A A . 21 LYS HG3 1 1 9 6070 1 1 17 LYS HZ1 H 5.316 3.114 -12.955 1.00 . A A . 21 LYS HZ1 1 1 9 6071 1 1 17 LYS HZ2 H 6.913 3.633 -13.207 1.00 . A A . 21 LYS HZ2 1 1 9 6072 1 1 17 LYS HZ3 H 5.916 4.451 -12.101 1.00 . A A . 21 LYS HZ3 1 1 9 6073 1 1 17 LYS N N 4.095 3.131 -7.422 1.00 . A A . 21 LYS N 1 1 9 6074 1 1 17 LYS NZ N 6.156 3.522 -12.501 1.00 . A A . 21 LYS NZ 1 1 9 6075 1 1 17 LYS O O 4.534 5.871 -7.374 1.00 . A A . 21 LYS O 1 1 9 6076 1 1 18 THR C C 7.809 7.685 -5.894 1.00 . A A . 22 THR C 1 1 9 6077 1 1 18 THR CA C 6.361 7.209 -5.877 1.00 . A A . 22 THR CA 1 1 9 6078 1 1 18 THR CB C 5.749 7.478 -4.502 1.00 . A A . 22 THR CB 1 1 9 6079 1 1 18 THR CG2 C 6.460 6.624 -3.442 1.00 . A A . 22 THR CG2 1 1 9 6080 1 1 18 THR H H 6.961 5.155 -5.617 1.00 . A A . 22 THR H 1 1 9 6081 1 1 18 THR HA H 5.788 7.711 -6.640 1.00 . A A . 22 THR HA 1 1 9 6082 1 1 18 THR HB H 4.706 7.226 -4.523 1.00 . A A . 22 THR HB 1 1 9 6083 1 1 18 THR HG1 H 6.724 8.985 -3.724 1.00 . A A . 22 THR HG1 1 1 9 6084 1 1 18 THR HG21 H 7.451 7.017 -3.275 1.00 . A A . 22 THR HG21 1 1 9 6085 1 1 18 THR HG22 H 6.534 5.603 -3.786 1.00 . A A . 22 THR HG22 1 1 9 6086 1 1 18 THR HG23 H 5.902 6.652 -2.517 1.00 . A A . 22 THR HG23 1 1 9 6087 1 1 18 THR N N 6.300 5.732 -6.059 1.00 . A A . 22 THR N 1 1 9 6088 1 1 18 THR O O 8.724 6.913 -6.097 1.00 . A A . 22 THR O 1 1 9 6089 1 1 18 THR OG1 O 5.889 8.862 -4.185 1.00 . A A . 22 THR OG1 1 1 9 6090 1 1 19 SER C C 10.242 8.982 -6.814 1.00 . A A . 23 SER C 1 1 9 6091 1 1 19 SER CA C 9.392 9.527 -5.651 1.00 . A A . 23 SER CA 1 1 9 6092 1 1 19 SER CB C 9.974 9.111 -4.299 1.00 . A A . 23 SER CB 1 1 9 6093 1 1 19 SER H H 7.237 9.533 -5.500 1.00 . A A . 23 SER H 1 1 9 6094 1 1 19 SER HA H 9.344 10.604 -5.705 1.00 . A A . 23 SER HA 1 1 9 6095 1 1 19 SER HB2 H 10.954 9.550 -4.178 1.00 . A A . 23 SER HB2 1 1 9 6096 1 1 19 SER HB3 H 9.325 9.455 -3.506 1.00 . A A . 23 SER HB3 1 1 9 6097 1 1 19 SER HG H 9.933 7.422 -3.334 1.00 . A A . 23 SER HG 1 1 9 6098 1 1 19 SER N N 8.008 8.952 -5.669 1.00 . A A . 23 SER N 1 1 9 6099 1 1 19 SER O O 10.245 9.535 -7.896 1.00 . A A . 23 SER O 1 1 9 6100 1 1 19 SER OG O 10.081 7.696 -4.243 1.00 . A A . 23 SER OG 1 1 9 6101 1 1 20 SER C C 11.392 5.907 -8.010 1.00 . A A . 24 SER C 1 1 9 6102 1 1 20 SER CA C 11.799 7.350 -7.706 1.00 . A A . 24 SER CA 1 1 9 6103 1 1 20 SER CB C 13.234 7.409 -7.179 1.00 . A A . 24 SER CB 1 1 9 6104 1 1 20 SER H H 10.953 7.468 -5.731 1.00 . A A . 24 SER H 1 1 9 6105 1 1 20 SER HA H 11.710 7.954 -8.588 1.00 . A A . 24 SER HA 1 1 9 6106 1 1 20 SER HB2 H 13.224 7.359 -6.101 1.00 . A A . 24 SER HB2 1 1 9 6107 1 1 20 SER HB3 H 13.796 6.574 -7.572 1.00 . A A . 24 SER HB3 1 1 9 6108 1 1 20 SER HG H 13.944 9.182 -6.818 1.00 . A A . 24 SER HG 1 1 9 6109 1 1 20 SER N N 10.962 7.908 -6.605 1.00 . A A . 24 SER N 1 1 9 6110 1 1 20 SER O O 10.658 5.641 -8.940 1.00 . A A . 24 SER O 1 1 9 6111 1 1 20 SER OG O 13.841 8.624 -7.592 1.00 . A A . 24 SER OG 1 1 9 6112 1 1 21 GLY C C 10.801 2.957 -6.270 1.00 . A A . 25 GLY C 1 1 9 6113 1 1 21 GLY CA C 11.522 3.546 -7.487 1.00 . A A . 25 GLY CA 1 1 9 6114 1 1 21 GLY H H 12.467 5.213 -6.502 1.00 . A A . 25 GLY H 1 1 9 6115 1 1 21 GLY HA2 H 10.877 3.481 -8.351 1.00 . A A . 25 GLY HA2 1 1 9 6116 1 1 21 GLY HA3 H 12.426 2.984 -7.674 1.00 . A A . 25 GLY HA3 1 1 9 6117 1 1 21 GLY N N 11.872 4.974 -7.239 1.00 . A A . 25 GLY N 1 1 9 6118 1 1 21 GLY O O 10.161 1.928 -6.359 1.00 . A A . 25 GLY O 1 1 9 6119 1 1 22 GLN C C 8.743 2.743 -4.223 1.00 . A A . 26 GLN C 1 1 9 6120 1 1 22 GLN CA C 10.212 3.057 -3.915 1.00 . A A . 26 GLN CA 1 1 9 6121 1 1 22 GLN CB C 10.313 4.176 -2.879 1.00 . A A . 26 GLN CB 1 1 9 6122 1 1 22 GLN CD C 12.187 3.948 -1.242 1.00 . A A . 26 GLN CD 1 1 9 6123 1 1 22 GLN CG C 11.786 4.495 -2.615 1.00 . A A . 26 GLN CG 1 1 9 6124 1 1 22 GLN H H 11.417 4.422 -5.075 1.00 . A A . 26 GLN H 1 1 9 6125 1 1 22 GLN HA H 10.719 2.176 -3.557 1.00 . A A . 26 GLN HA 1 1 9 6126 1 1 22 GLN HB2 H 9.816 5.059 -3.251 1.00 . A A . 26 GLN HB2 1 1 9 6127 1 1 22 GLN HB3 H 9.843 3.859 -1.961 1.00 . A A . 26 GLN HB3 1 1 9 6128 1 1 22 GLN HE21 H 10.973 2.381 -1.355 1.00 . A A . 26 GLN HE21 1 1 9 6129 1 1 22 GLN HE22 H 11.887 2.491 0.072 1.00 . A A . 26 GLN HE22 1 1 9 6130 1 1 22 GLN HG2 H 12.396 4.033 -3.377 1.00 . A A . 26 GLN HG2 1 1 9 6131 1 1 22 GLN HG3 H 11.933 5.564 -2.632 1.00 . A A . 26 GLN HG3 1 1 9 6132 1 1 22 GLN N N 10.896 3.594 -5.131 1.00 . A A . 26 GLN N 1 1 9 6133 1 1 22 GLN NE2 N 11.636 2.850 -0.805 1.00 . A A . 26 GLN NE2 1 1 9 6134 1 1 22 GLN O O 8.017 3.570 -4.746 1.00 . A A . 26 GLN O 1 1 9 6135 1 1 22 GLN OE1 O 13.009 4.529 -0.561 1.00 . A A . 26 GLN OE1 1 1 9 6136 1 1 23 ARG C C 5.951 1.850 -3.176 1.00 . A A . 27 ARG C 1 1 9 6137 1 1 23 ARG CA C 6.879 1.202 -4.188 1.00 . A A . 27 ARG CA 1 1 9 6138 1 1 23 ARG CB C 6.760 -0.321 -4.059 1.00 . A A . 27 ARG CB 1 1 9 6139 1 1 23 ARG CD C 5.555 -1.976 -5.487 1.00 . A A . 27 ARG CD 1 1 9 6140 1 1 23 ARG CG C 6.684 -0.943 -5.451 1.00 . A A . 27 ARG CG 1 1 9 6141 1 1 23 ARG CZ C 5.591 -4.382 -5.061 1.00 . A A . 27 ARG CZ 1 1 9 6142 1 1 23 ARG H H 8.895 0.898 -3.487 1.00 . A A . 27 ARG H 1 1 9 6143 1 1 23 ARG HA H 6.610 1.504 -5.189 1.00 . A A . 27 ARG HA 1 1 9 6144 1 1 23 ARG HB2 H 7.612 -0.714 -3.529 1.00 . A A . 27 ARG HB2 1 1 9 6145 1 1 23 ARG HB3 H 5.858 -0.564 -3.512 1.00 . A A . 27 ARG HB3 1 1 9 6146 1 1 23 ARG HD2 H 4.713 -1.634 -4.903 1.00 . A A . 27 ARG HD2 1 1 9 6147 1 1 23 ARG HD3 H 5.255 -2.170 -6.505 1.00 . A A . 27 ARG HD3 1 1 9 6148 1 1 23 ARG HE H 6.954 -3.131 -4.326 1.00 . A A . 27 ARG HE 1 1 9 6149 1 1 23 ARG HG2 H 6.484 -0.167 -6.178 1.00 . A A . 27 ARG HG2 1 1 9 6150 1 1 23 ARG HG3 H 7.620 -1.425 -5.683 1.00 . A A . 27 ARG HG3 1 1 9 6151 1 1 23 ARG HH11 H 4.086 -3.714 -6.214 1.00 . A A . 27 ARG HH11 1 1 9 6152 1 1 23 ARG HH12 H 4.106 -5.417 -5.918 1.00 . A A . 27 ARG HH12 1 1 9 6153 1 1 23 ARG HH21 H 6.956 -5.346 -3.957 1.00 . A A . 27 ARG HH21 1 1 9 6154 1 1 23 ARG HH22 H 5.716 -6.337 -4.651 1.00 . A A . 27 ARG HH22 1 1 9 6155 1 1 23 ARG N N 8.298 1.553 -3.905 1.00 . A A . 27 ARG N 1 1 9 6156 1 1 23 ARG NE N 6.144 -3.206 -4.875 1.00 . A A . 27 ARG NE 1 1 9 6157 1 1 23 ARG NH1 N 4.509 -4.513 -5.789 1.00 . A A . 27 ARG NH1 1 1 9 6158 1 1 23 ARG NH2 N 6.130 -5.438 -4.513 1.00 . A A . 27 ARG NH2 1 1 9 6159 1 1 23 ARG O O 6.194 1.830 -1.986 1.00 . A A . 27 ARG O 1 1 9 6160 1 1 24 TYR C C 2.511 2.426 -3.077 1.00 . A A . 28 TYR C 1 1 9 6161 1 1 24 TYR CA C 3.873 2.954 -2.705 1.00 . A A . 28 TYR CA 1 1 9 6162 1 1 24 TYR CB C 3.985 4.492 -2.790 1.00 . A A . 28 TYR CB 1 1 9 6163 1 1 24 TYR CD1 C 2.958 4.461 -5.115 1.00 . A A . 28 TYR CD1 1 1 9 6164 1 1 24 TYR CD2 C 2.538 6.364 -3.680 1.00 . A A . 28 TYR CD2 1 1 9 6165 1 1 24 TYR CE1 C 2.205 5.060 -6.126 1.00 . A A . 28 TYR CE1 1 1 9 6166 1 1 24 TYR CE2 C 1.797 6.967 -4.698 1.00 . A A . 28 TYR CE2 1 1 9 6167 1 1 24 TYR CG C 3.128 5.109 -3.888 1.00 . A A . 28 TYR CG 1 1 9 6168 1 1 24 TYR CZ C 1.630 6.314 -5.922 1.00 . A A . 28 TYR CZ 1 1 9 6169 1 1 24 TYR H H 4.671 2.317 -4.597 1.00 . A A . 28 TYR H 1 1 9 6170 1 1 24 TYR HA H 4.102 2.631 -1.699 1.00 . A A . 28 TYR HA 1 1 9 6171 1 1 24 TYR HB2 H 3.684 4.911 -1.841 1.00 . A A . 28 TYR HB2 1 1 9 6172 1 1 24 TYR HB3 H 5.012 4.748 -2.969 1.00 . A A . 28 TYR HB3 1 1 9 6173 1 1 24 TYR HD1 H 3.383 3.494 -5.274 1.00 . A A . 28 TYR HD1 1 1 9 6174 1 1 24 TYR HD2 H 2.656 6.871 -2.734 1.00 . A A . 28 TYR HD2 1 1 9 6175 1 1 24 TYR HE1 H 2.077 4.558 -7.072 1.00 . A A . 28 TYR HE1 1 1 9 6176 1 1 24 TYR HE2 H 1.342 7.930 -4.536 1.00 . A A . 28 TYR HE2 1 1 9 6177 1 1 24 TYR HH H 1.070 7.860 -6.886 1.00 . A A . 28 TYR HH 1 1 9 6178 1 1 24 TYR N N 4.862 2.366 -3.639 1.00 . A A . 28 TYR N 1 1 9 6179 1 1 24 TYR O O 2.334 1.786 -4.095 1.00 . A A . 28 TYR O 1 1 9 6180 1 1 24 TYR OH O 0.912 6.914 -6.930 1.00 . A A . 28 TYR OH 1 1 9 6181 1 1 25 PHE C C -0.791 3.225 -2.541 1.00 . A A . 29 PHE C 1 1 9 6182 1 1 25 PHE CA C 0.227 2.100 -2.516 1.00 . A A . 29 PHE CA 1 1 9 6183 1 1 25 PHE CB C 0.012 1.079 -1.401 1.00 . A A . 29 PHE CB 1 1 9 6184 1 1 25 PHE CD1 C 2.390 0.217 -1.213 1.00 . A A . 29 PHE CD1 1 1 9 6185 1 1 25 PHE CD2 C 0.692 -1.225 -2.164 1.00 . A A . 29 PHE CD2 1 1 9 6186 1 1 25 PHE CE1 C 3.353 -0.776 -1.431 1.00 . A A . 29 PHE CE1 1 1 9 6187 1 1 25 PHE CE2 C 1.656 -2.220 -2.371 1.00 . A A . 29 PHE CE2 1 1 9 6188 1 1 25 PHE CG C 1.054 -0.007 -1.583 1.00 . A A . 29 PHE CG 1 1 9 6189 1 1 25 PHE CZ C 2.984 -1.996 -2.008 1.00 . A A . 29 PHE CZ 1 1 9 6190 1 1 25 PHE H H 1.746 3.133 -1.414 1.00 . A A . 29 PHE H 1 1 9 6191 1 1 25 PHE HA H 0.229 1.593 -3.469 1.00 . A A . 29 PHE HA 1 1 9 6192 1 1 25 PHE HB2 H 0.141 1.552 -0.442 1.00 . A A . 29 PHE HB2 1 1 9 6193 1 1 25 PHE HB3 H -0.979 0.656 -1.475 1.00 . A A . 29 PHE HB3 1 1 9 6194 1 1 25 PHE HD1 H 2.680 1.159 -0.764 1.00 . A A . 29 PHE HD1 1 1 9 6195 1 1 25 PHE HD2 H -0.330 -1.400 -2.447 1.00 . A A . 29 PHE HD2 1 1 9 6196 1 1 25 PHE HE1 H 4.380 -0.603 -1.155 1.00 . A A . 29 PHE HE1 1 1 9 6197 1 1 25 PHE HE2 H 1.371 -3.161 -2.820 1.00 . A A . 29 PHE HE2 1 1 9 6198 1 1 25 PHE HZ H 3.724 -2.760 -2.182 1.00 . A A . 29 PHE HZ 1 1 9 6199 1 1 25 PHE N N 1.566 2.641 -2.239 1.00 . A A . 29 PHE N 1 1 9 6200 1 1 25 PHE O O -1.120 3.830 -1.535 1.00 . A A . 29 PHE O 1 1 9 6201 1 1 26 LEU C C -3.648 4.082 -3.731 1.00 . A A . 30 LEU C 1 1 9 6202 1 1 26 LEU CA C -2.228 4.599 -3.963 1.00 . A A . 30 LEU CA 1 1 9 6203 1 1 26 LEU CB C -2.002 4.932 -5.442 1.00 . A A . 30 LEU CB 1 1 9 6204 1 1 26 LEU CD1 C -1.155 7.209 -4.791 1.00 . A A . 30 LEU CD1 1 1 9 6205 1 1 26 LEU CD2 C -1.700 6.689 -7.156 1.00 . A A . 30 LEU CD2 1 1 9 6206 1 1 26 LEU CG C -2.098 6.434 -5.706 1.00 . A A . 30 LEU CG 1 1 9 6207 1 1 26 LEU H H -0.919 2.990 -4.496 1.00 . A A . 30 LEU H 1 1 9 6208 1 1 26 LEU HA H -2.020 5.454 -3.343 1.00 . A A . 30 LEU HA 1 1 9 6209 1 1 26 LEU HB2 H -1.021 4.589 -5.733 1.00 . A A . 30 LEU HB2 1 1 9 6210 1 1 26 LEU HB3 H -2.741 4.423 -6.037 1.00 . A A . 30 LEU HB3 1 1 9 6211 1 1 26 LEU HD11 H -0.410 7.717 -5.386 1.00 . A A . 30 LEU HD11 1 1 9 6212 1 1 26 LEU HD12 H -0.667 6.532 -4.108 1.00 . A A . 30 LEU HD12 1 1 9 6213 1 1 26 LEU HD13 H -1.724 7.938 -4.238 1.00 . A A . 30 LEU HD13 1 1 9 6214 1 1 26 LEU HD21 H -2.580 6.715 -7.773 1.00 . A A . 30 LEU HD21 1 1 9 6215 1 1 26 LEU HD22 H -1.045 5.895 -7.488 1.00 . A A . 30 LEU HD22 1 1 9 6216 1 1 26 LEU HD23 H -1.180 7.633 -7.222 1.00 . A A . 30 LEU HD23 1 1 9 6217 1 1 26 LEU HG H -3.108 6.764 -5.547 1.00 . A A . 30 LEU HG 1 1 9 6218 1 1 26 LEU N N -1.249 3.509 -3.728 1.00 . A A . 30 LEU N 1 1 9 6219 1 1 26 LEU O O -4.130 3.232 -4.453 1.00 . A A . 30 LEU O 1 1 9 6220 1 1 27 ASN C C -6.724 5.193 -2.765 1.00 . A A . 31 ASN C 1 1 9 6221 1 1 27 ASN CA C -5.700 4.092 -2.466 1.00 . A A . 31 ASN CA 1 1 9 6222 1 1 27 ASN CB C -5.700 3.658 -0.985 1.00 . A A . 31 ASN CB 1 1 9 6223 1 1 27 ASN CG C -6.077 4.800 -0.034 1.00 . A A . 31 ASN CG 1 1 9 6224 1 1 27 ASN H H -3.916 5.258 -2.151 1.00 . A A . 31 ASN H 1 1 9 6225 1 1 27 ASN HA H -5.904 3.234 -3.088 1.00 . A A . 31 ASN HA 1 1 9 6226 1 1 27 ASN HB2 H -6.398 2.845 -0.855 1.00 . A A . 31 ASN HB2 1 1 9 6227 1 1 27 ASN HB3 H -4.710 3.317 -0.725 1.00 . A A . 31 ASN HB3 1 1 9 6228 1 1 27 ASN HD21 H -4.399 4.654 1.010 1.00 . A A . 31 ASN HD21 1 1 9 6229 1 1 27 ASN HD22 H -5.487 5.835 1.542 1.00 . A A . 31 ASN HD22 1 1 9 6230 1 1 27 ASN N N -4.319 4.577 -2.728 1.00 . A A . 31 ASN N 1 1 9 6231 1 1 27 ASN ND2 N -5.251 5.129 0.915 1.00 . A A . 31 ASN ND2 1 1 9 6232 1 1 27 ASN O O -6.593 6.320 -2.320 1.00 . A A . 31 ASN O 1 1 9 6233 1 1 27 ASN OD1 O -7.134 5.388 -0.148 1.00 . A A . 31 ASN OD1 1 1 9 6234 1 1 28 HIS C C -9.856 5.878 -2.760 1.00 . A A . 32 HIS C 1 1 9 6235 1 1 28 HIS CA C -8.786 5.865 -3.851 1.00 . A A . 32 HIS CA 1 1 9 6236 1 1 28 HIS CB C -9.369 5.394 -5.185 1.00 . A A . 32 HIS CB 1 1 9 6237 1 1 28 HIS CD2 C -7.309 5.326 -6.826 1.00 . A A . 32 HIS CD2 1 1 9 6238 1 1 28 HIS CE1 C -7.779 7.096 -7.987 1.00 . A A . 32 HIS CE1 1 1 9 6239 1 1 28 HIS CG C -8.476 5.842 -6.311 1.00 . A A . 32 HIS CG 1 1 9 6240 1 1 28 HIS H H -7.818 3.945 -3.855 1.00 . A A . 32 HIS H 1 1 9 6241 1 1 28 HIS HA H -8.348 6.840 -3.961 1.00 . A A . 32 HIS HA 1 1 9 6242 1 1 28 HIS HB2 H -9.438 4.316 -5.187 1.00 . A A . 32 HIS HB2 1 1 9 6243 1 1 28 HIS HB3 H -10.353 5.818 -5.316 1.00 . A A . 32 HIS HB3 1 1 9 6244 1 1 28 HIS HD1 H -9.523 7.568 -6.954 1.00 . A A . 32 HIS HD1 1 1 9 6245 1 1 28 HIS HD2 H -6.804 4.439 -6.467 1.00 . A A . 32 HIS HD2 1 1 9 6246 1 1 28 HIS HE1 H -7.735 7.889 -8.717 1.00 . A A . 32 HIS HE1 1 1 9 6247 1 1 28 HIS N N -7.741 4.862 -3.515 1.00 . A A . 32 HIS N 1 1 9 6248 1 1 28 HIS ND1 N -8.755 6.969 -7.068 1.00 . A A . 32 HIS ND1 1 1 9 6249 1 1 28 HIS NE2 N -6.873 6.120 -7.882 1.00 . A A . 32 HIS NE2 1 1 9 6250 1 1 28 HIS O O -10.523 6.869 -2.538 1.00 . A A . 32 HIS O 1 1 9 6251 1 1 29 ILE C C -10.875 5.929 -0.039 1.00 . A A . 33 ILE C 1 1 9 6252 1 1 29 ILE CA C -11.031 4.723 -0.971 1.00 . A A . 33 ILE CA 1 1 9 6253 1 1 29 ILE CB C -10.769 3.412 -0.208 1.00 . A A . 33 ILE CB 1 1 9 6254 1 1 29 ILE CD1 C -9.020 3.524 1.576 1.00 . A A . 33 ILE CD1 1 1 9 6255 1 1 29 ILE CG1 C -9.273 3.233 0.097 1.00 . A A . 33 ILE CG1 1 1 9 6256 1 1 29 ILE CG2 C -11.254 2.232 -1.047 1.00 . A A . 33 ILE CG2 1 1 9 6257 1 1 29 ILE H H -9.456 4.004 -2.263 1.00 . A A . 33 ILE H 1 1 9 6258 1 1 29 ILE HA H -12.025 4.707 -1.391 1.00 . A A . 33 ILE HA 1 1 9 6259 1 1 29 ILE HB H -11.319 3.432 0.722 1.00 . A A . 33 ILE HB 1 1 9 6260 1 1 29 ILE HD11 H -9.140 2.616 2.148 1.00 . A A . 33 ILE HD11 1 1 9 6261 1 1 29 ILE HD12 H -9.726 4.263 1.923 1.00 . A A . 33 ILE HD12 1 1 9 6262 1 1 29 ILE HD13 H -8.015 3.898 1.703 1.00 . A A . 33 ILE HD13 1 1 9 6263 1 1 29 ILE HG12 H -8.983 2.216 -0.122 1.00 . A A . 33 ILE HG12 1 1 9 6264 1 1 29 ILE HG13 H -8.688 3.906 -0.504 1.00 . A A . 33 ILE HG13 1 1 9 6265 1 1 29 ILE HG21 H -12.156 1.828 -0.613 1.00 . A A . 33 ILE HG21 1 1 9 6266 1 1 29 ILE HG22 H -10.491 1.467 -1.068 1.00 . A A . 33 ILE HG22 1 1 9 6267 1 1 29 ILE HG23 H -11.457 2.565 -2.054 1.00 . A A . 33 ILE HG23 1 1 9 6268 1 1 29 ILE N N -10.013 4.784 -2.067 1.00 . A A . 33 ILE N 1 1 9 6269 1 1 29 ILE O O -11.840 6.558 0.348 1.00 . A A . 33 ILE O 1 1 9 6270 1 1 30 ASP C C -8.495 8.437 0.526 1.00 . A A . 34 ASP C 1 1 9 6271 1 1 30 ASP CA C -9.439 7.434 1.202 1.00 . A A . 34 ASP CA 1 1 9 6272 1 1 30 ASP CB C -8.795 6.856 2.462 1.00 . A A . 34 ASP CB 1 1 9 6273 1 1 30 ASP CG C -9.809 6.877 3.608 1.00 . A A . 34 ASP CG 1 1 9 6274 1 1 30 ASP H H -8.901 5.749 -0.021 1.00 . A A . 34 ASP H 1 1 9 6275 1 1 30 ASP HA H -10.377 7.906 1.449 1.00 . A A . 34 ASP HA 1 1 9 6276 1 1 30 ASP HB2 H -8.486 5.837 2.274 1.00 . A A . 34 ASP HB2 1 1 9 6277 1 1 30 ASP HB3 H -7.934 7.449 2.732 1.00 . A A . 34 ASP HB3 1 1 9 6278 1 1 30 ASP N N -9.665 6.262 0.311 1.00 . A A . 34 ASP N 1 1 9 6279 1 1 30 ASP O O -8.018 9.366 1.147 1.00 . A A . 34 ASP O 1 1 9 6280 1 1 30 ASP OD1 O -10.153 7.961 4.048 1.00 . A A . 34 ASP OD1 1 1 9 6281 1 1 30 ASP OD2 O -10.224 5.809 4.026 1.00 . A A . 34 ASP OD2 1 1 9 6282 1 1 31 GLN C C -6.008 9.384 -0.657 1.00 . A A . 35 GLN C 1 1 9 6283 1 1 31 GLN CA C -7.303 9.199 -1.451 1.00 . A A . 35 GLN CA 1 1 9 6284 1 1 31 GLN CB C -8.076 10.517 -1.529 1.00 . A A . 35 GLN CB 1 1 9 6285 1 1 31 GLN CD C -10.479 11.186 -1.680 1.00 . A A . 35 GLN CD 1 1 9 6286 1 1 31 GLN CG C -9.392 10.293 -2.279 1.00 . A A . 35 GLN CG 1 1 9 6287 1 1 31 GLN H H -8.608 7.503 -1.229 1.00 . A A . 35 GLN H 1 1 9 6288 1 1 31 GLN HA H -7.088 8.840 -2.445 1.00 . A A . 35 GLN HA 1 1 9 6289 1 1 31 GLN HB2 H -8.288 10.869 -0.530 1.00 . A A . 35 GLN HB2 1 1 9 6290 1 1 31 GLN HB3 H -7.485 11.252 -2.052 1.00 . A A . 35 GLN HB3 1 1 9 6291 1 1 31 GLN HE21 H -11.469 9.672 -0.862 1.00 . A A . 35 GLN HE21 1 1 9 6292 1 1 31 GLN HE22 H -12.147 11.208 -0.603 1.00 . A A . 35 GLN HE22 1 1 9 6293 1 1 31 GLN HG2 H -9.257 10.539 -3.321 1.00 . A A . 35 GLN HG2 1 1 9 6294 1 1 31 GLN HG3 H -9.686 9.258 -2.189 1.00 . A A . 35 GLN HG3 1 1 9 6295 1 1 31 GLN N N -8.217 8.256 -0.742 1.00 . A A . 35 GLN N 1 1 9 6296 1 1 31 GLN NE2 N -11.445 10.643 -0.990 1.00 . A A . 35 GLN NE2 1 1 9 6297 1 1 31 GLN O O -5.758 10.432 -0.096 1.00 . A A . 35 GLN O 1 1 9 6298 1 1 31 GLN OE1 O -10.449 12.390 -1.840 1.00 . A A . 35 GLN OE1 1 1 9 6299 1 1 32 THR C C -2.832 7.578 -0.394 1.00 . A A . 36 THR C 1 1 9 6300 1 1 32 THR CA C -3.904 8.512 0.167 1.00 . A A . 36 THR CA 1 1 9 6301 1 1 32 THR CB C -4.241 8.123 1.612 1.00 . A A . 36 THR CB 1 1 9 6302 1 1 32 THR CG2 C -3.457 9.014 2.575 1.00 . A A . 36 THR CG2 1 1 9 6303 1 1 32 THR H H -5.397 7.532 -1.061 1.00 . A A . 36 THR H 1 1 9 6304 1 1 32 THR HA H -3.560 9.535 0.137 1.00 . A A . 36 THR HA 1 1 9 6305 1 1 32 THR HB H -3.963 7.094 1.778 1.00 . A A . 36 THR HB 1 1 9 6306 1 1 32 THR HG1 H -5.829 9.223 1.850 1.00 . A A . 36 THR HG1 1 1 9 6307 1 1 32 THR HG21 H -2.564 9.376 2.085 1.00 . A A . 36 THR HG21 1 1 9 6308 1 1 32 THR HG22 H -3.181 8.442 3.449 1.00 . A A . 36 THR HG22 1 1 9 6309 1 1 32 THR HG23 H -4.071 9.852 2.871 1.00 . A A . 36 THR HG23 1 1 9 6310 1 1 32 THR N N -5.181 8.374 -0.601 1.00 . A A . 36 THR N 1 1 9 6311 1 1 32 THR O O -3.065 6.839 -1.333 1.00 . A A . 36 THR O 1 1 9 6312 1 1 32 THR OG1 O -5.635 8.283 1.847 1.00 . A A . 36 THR OG1 1 1 9 6313 1 1 33 THR C C 0.270 6.186 0.845 1.00 . A A . 37 THR C 1 1 9 6314 1 1 33 THR CA C -0.562 6.710 -0.322 1.00 . A A . 37 THR CA 1 1 9 6315 1 1 33 THR CB C 0.329 7.580 -1.218 1.00 . A A . 37 THR CB 1 1 9 6316 1 1 33 THR CG2 C -0.521 8.394 -2.190 1.00 . A A . 37 THR CG2 1 1 9 6317 1 1 33 THR H H -1.493 8.201 0.933 1.00 . A A . 37 THR H 1 1 9 6318 1 1 33 THR HA H -0.973 5.895 -0.892 1.00 . A A . 37 THR HA 1 1 9 6319 1 1 33 THR HB H 0.996 6.943 -1.780 1.00 . A A . 37 THR HB 1 1 9 6320 1 1 33 THR HG1 H 0.496 9.130 -0.055 1.00 . A A . 37 THR HG1 1 1 9 6321 1 1 33 THR HG21 H -1.450 7.878 -2.369 1.00 . A A . 37 THR HG21 1 1 9 6322 1 1 33 THR HG22 H 0.014 8.513 -3.121 1.00 . A A . 37 THR HG22 1 1 9 6323 1 1 33 THR HG23 H -0.723 9.365 -1.765 1.00 . A A . 37 THR HG23 1 1 9 6324 1 1 33 THR N N -1.655 7.601 0.177 1.00 . A A . 37 THR N 1 1 9 6325 1 1 33 THR O O 0.792 6.948 1.635 1.00 . A A . 37 THR O 1 1 9 6326 1 1 33 THR OG1 O 1.089 8.462 -0.405 1.00 . A A . 37 THR OG1 1 1 9 6327 1 1 34 THR C C 2.390 3.487 1.470 1.00 . A A . 38 THR C 1 1 9 6328 1 1 34 THR CA C 1.272 4.355 2.057 1.00 . A A . 38 THR CA 1 1 9 6329 1 1 34 THR CB C 0.326 3.543 2.955 1.00 . A A . 38 THR CB 1 1 9 6330 1 1 34 THR CG2 C -0.114 2.266 2.245 1.00 . A A . 38 THR CG2 1 1 9 6331 1 1 34 THR H H 0.021 4.290 0.283 1.00 . A A . 38 THR H 1 1 9 6332 1 1 34 THR HA H 1.700 5.169 2.622 1.00 . A A . 38 THR HA 1 1 9 6333 1 1 34 THR HB H -0.545 4.136 3.187 1.00 . A A . 38 THR HB 1 1 9 6334 1 1 34 THR HG1 H 0.563 3.661 4.882 1.00 . A A . 38 THR HG1 1 1 9 6335 1 1 34 THR HG21 H 0.581 1.469 2.470 1.00 . A A . 38 THR HG21 1 1 9 6336 1 1 34 THR HG22 H -0.127 2.441 1.186 1.00 . A A . 38 THR HG22 1 1 9 6337 1 1 34 THR HG23 H -1.102 1.988 2.580 1.00 . A A . 38 THR HG23 1 1 9 6338 1 1 34 THR N N 0.430 4.896 0.947 1.00 . A A . 38 THR N 1 1 9 6339 1 1 34 THR O O 2.287 2.995 0.364 1.00 . A A . 38 THR O 1 1 9 6340 1 1 34 THR OG1 O 0.998 3.205 4.160 1.00 . A A . 38 THR OG1 1 1 9 6341 1 1 35 TRP C C 4.456 1.036 2.146 1.00 . A A . 39 TRP C 1 1 9 6342 1 1 35 TRP CA C 4.583 2.478 1.651 1.00 . A A . 39 TRP CA 1 1 9 6343 1 1 35 TRP CB C 5.887 3.096 2.192 1.00 . A A . 39 TRP CB 1 1 9 6344 1 1 35 TRP CD1 C 5.274 5.376 3.110 1.00 . A A . 39 TRP CD1 1 1 9 6345 1 1 35 TRP CD2 C 6.425 5.512 1.179 1.00 . A A . 39 TRP CD2 1 1 9 6346 1 1 35 TRP CE2 C 6.157 6.839 1.592 1.00 . A A . 39 TRP CE2 1 1 9 6347 1 1 35 TRP CE3 C 7.143 5.326 -0.017 1.00 . A A . 39 TRP CE3 1 1 9 6348 1 1 35 TRP CG C 5.851 4.597 2.163 1.00 . A A . 39 TRP CG 1 1 9 6349 1 1 35 TRP CH2 C 7.302 7.734 -0.330 1.00 . A A . 39 TRP CH2 1 1 9 6350 1 1 35 TRP CZ2 C 6.586 7.938 0.851 1.00 . A A . 39 TRP CZ2 1 1 9 6351 1 1 35 TRP CZ3 C 7.577 6.430 -0.762 1.00 . A A . 39 TRP CZ3 1 1 9 6352 1 1 35 TRP H H 3.532 3.712 3.078 1.00 . A A . 39 TRP H 1 1 9 6353 1 1 35 TRP HA H 4.583 2.506 0.570 1.00 . A A . 39 TRP HA 1 1 9 6354 1 1 35 TRP HB2 H 6.035 2.767 3.209 1.00 . A A . 39 TRP HB2 1 1 9 6355 1 1 35 TRP HB3 H 6.714 2.751 1.588 1.00 . A A . 39 TRP HB3 1 1 9 6356 1 1 35 TRP HD1 H 4.755 5.018 3.985 1.00 . A A . 39 TRP HD1 1 1 9 6357 1 1 35 TRP HE1 H 5.131 7.470 3.287 1.00 . A A . 39 TRP HE1 1 1 9 6358 1 1 35 TRP HE3 H 7.354 4.331 -0.372 1.00 . A A . 39 TRP HE3 1 1 9 6359 1 1 35 TRP HH2 H 7.640 8.579 -0.910 1.00 . A A . 39 TRP HH2 1 1 9 6360 1 1 35 TRP HZ2 H 6.370 8.938 1.191 1.00 . A A . 39 TRP HZ2 1 1 9 6361 1 1 35 TRP HZ3 H 8.134 6.274 -1.672 1.00 . A A . 39 TRP HZ3 1 1 9 6362 1 1 35 TRP N N 3.461 3.304 2.191 1.00 . A A . 39 TRP N 1 1 9 6363 1 1 35 TRP NE1 N 5.453 6.704 2.768 1.00 . A A . 39 TRP NE1 1 1 9 6364 1 1 35 TRP O O 4.076 0.788 3.274 1.00 . A A . 39 TRP O 1 1 9 6365 1 1 36 GLN C C 3.346 -1.638 2.416 1.00 . A A . 40 GLN C 1 1 9 6366 1 1 36 GLN CA C 4.691 -1.351 1.738 1.00 . A A . 40 GLN CA 1 1 9 6367 1 1 36 GLN CB C 5.839 -1.540 2.729 1.00 . A A . 40 GLN CB 1 1 9 6368 1 1 36 GLN CD C 7.550 -2.690 1.318 1.00 . A A . 40 GLN CD 1 1 9 6369 1 1 36 GLN CG C 6.539 -2.872 2.452 1.00 . A A . 40 GLN CG 1 1 9 6370 1 1 36 GLN H H 5.092 0.304 0.414 1.00 . A A . 40 GLN H 1 1 9 6371 1 1 36 GLN HA H 4.831 -2.001 0.889 1.00 . A A . 40 GLN HA 1 1 9 6372 1 1 36 GLN HB2 H 6.547 -0.731 2.620 1.00 . A A . 40 GLN HB2 1 1 9 6373 1 1 36 GLN HB3 H 5.449 -1.541 3.737 1.00 . A A . 40 GLN HB3 1 1 9 6374 1 1 36 GLN HE21 H 6.204 -2.966 -0.115 1.00 . A A . 40 GLN HE21 1 1 9 6375 1 1 36 GLN HE22 H 7.785 -2.669 -0.653 1.00 . A A . 40 GLN HE22 1 1 9 6376 1 1 36 GLN HG2 H 7.054 -3.201 3.343 1.00 . A A . 40 GLN HG2 1 1 9 6377 1 1 36 GLN HG3 H 5.805 -3.611 2.166 1.00 . A A . 40 GLN HG3 1 1 9 6378 1 1 36 GLN N N 4.781 0.080 1.316 1.00 . A A . 40 GLN N 1 1 9 6379 1 1 36 GLN NE2 N 7.146 -2.783 0.080 1.00 . A A . 40 GLN NE2 1 1 9 6380 1 1 36 GLN O O 3.288 -1.915 3.598 1.00 . A A . 40 GLN O 1 1 9 6381 1 1 36 GLN OE1 O 8.718 -2.463 1.561 1.00 . A A . 40 GLN OE1 1 1 9 6382 1 1 37 ASP C C 0.604 -0.876 3.399 1.00 . A A . 41 ASP C 1 1 9 6383 1 1 37 ASP CA C 0.918 -1.847 2.248 1.00 . A A . 41 ASP CA 1 1 9 6384 1 1 37 ASP CB C 0.970 -3.292 2.760 1.00 . A A . 41 ASP CB 1 1 9 6385 1 1 37 ASP CG C 0.539 -4.243 1.642 1.00 . A A . 41 ASP CG 1 1 9 6386 1 1 37 ASP H H 2.356 -1.353 0.720 1.00 . A A . 41 ASP H 1 1 9 6387 1 1 37 ASP HA H 0.167 -1.763 1.480 1.00 . A A . 41 ASP HA 1 1 9 6388 1 1 37 ASP HB2 H 1.974 -3.535 3.067 1.00 . A A . 41 ASP HB2 1 1 9 6389 1 1 37 ASP HB3 H 0.301 -3.399 3.600 1.00 . A A . 41 ASP HB3 1 1 9 6390 1 1 37 ASP N N 2.273 -1.577 1.671 1.00 . A A . 41 ASP N 1 1 9 6391 1 1 37 ASP O O 1.495 -0.403 4.074 1.00 . A A . 41 ASP O 1 1 9 6392 1 1 37 ASP OD1 O 1.069 -4.120 0.551 1.00 . A A . 41 ASP OD1 1 1 9 6393 1 1 37 ASP OD2 O -0.311 -5.079 1.897 1.00 . A A . 41 ASP OD2 1 1 9 6394 1 1 38 PRO C C -1.006 -0.389 6.024 1.00 . A A . 42 PRO C 1 1 9 6395 1 1 38 PRO CA C -1.094 0.314 4.667 1.00 . A A . 42 PRO CA 1 1 9 6396 1 1 38 PRO CB C -2.545 0.631 4.319 1.00 . A A . 42 PRO CB 1 1 9 6397 1 1 38 PRO CD C -1.811 -1.123 2.818 1.00 . A A . 42 PRO CD 1 1 9 6398 1 1 38 PRO CG C -3.017 -0.534 3.507 1.00 . A A . 42 PRO CG 1 1 9 6399 1 1 38 PRO HA H -0.503 1.214 4.660 1.00 . A A . 42 PRO HA 1 1 9 6400 1 1 38 PRO HB2 H -3.134 0.724 5.219 1.00 . A A . 42 PRO HB2 1 1 9 6401 1 1 38 PRO HB3 H -2.600 1.540 3.738 1.00 . A A . 42 PRO HB3 1 1 9 6402 1 1 38 PRO HD2 H -1.840 -2.202 2.863 1.00 . A A . 42 PRO HD2 1 1 9 6403 1 1 38 PRO HD3 H -1.759 -0.786 1.795 1.00 . A A . 42 PRO HD3 1 1 9 6404 1 1 38 PRO HG2 H -3.468 -1.273 4.152 1.00 . A A . 42 PRO HG2 1 1 9 6405 1 1 38 PRO HG3 H -3.734 -0.204 2.771 1.00 . A A . 42 PRO HG3 1 1 9 6406 1 1 38 PRO N N -0.667 -0.608 3.585 1.00 . A A . 42 PRO N 1 1 9 6407 1 1 38 PRO O O -0.403 0.108 6.955 1.00 . A A . 42 PRO O 1 1 9 6408 1 1 39 ARG C C -0.149 -2.824 7.688 1.00 . A A . 43 ARG C 1 1 9 6409 1 1 39 ARG CA C -1.558 -2.281 7.435 1.00 . A A . 43 ARG CA 1 1 9 6410 1 1 39 ARG CB C -2.555 -3.428 7.268 1.00 . A A . 43 ARG CB 1 1 9 6411 1 1 39 ARG CD C -4.841 -3.843 8.188 1.00 . A A . 43 ARG CD 1 1 9 6412 1 1 39 ARG CG C -3.377 -3.583 8.550 1.00 . A A . 43 ARG CG 1 1 9 6413 1 1 39 ARG CZ C -5.737 -1.723 9.003 1.00 . A A . 43 ARG CZ 1 1 9 6414 1 1 39 ARG H H -2.085 -1.924 5.377 1.00 . A A . 43 ARG H 1 1 9 6415 1 1 39 ARG HA H -1.867 -1.640 8.247 1.00 . A A . 43 ARG HA 1 1 9 6416 1 1 39 ARG HB2 H -3.215 -3.215 6.441 1.00 . A A . 43 ARG HB2 1 1 9 6417 1 1 39 ARG HB3 H -2.017 -4.346 7.072 1.00 . A A . 43 ARG HB3 1 1 9 6418 1 1 39 ARG HD2 H -4.906 -4.424 7.280 1.00 . A A . 43 ARG HD2 1 1 9 6419 1 1 39 ARG HD3 H -5.343 -4.352 8.999 1.00 . A A . 43 ARG HD3 1 1 9 6420 1 1 39 ARG HE H -5.590 -2.164 7.069 1.00 . A A . 43 ARG HE 1 1 9 6421 1 1 39 ARG HG2 H -2.994 -4.413 9.126 1.00 . A A . 43 ARG HG2 1 1 9 6422 1 1 39 ARG HG3 H -3.306 -2.677 9.134 1.00 . A A . 43 ARG HG3 1 1 9 6423 1 1 39 ARG HH11 H -5.144 -3.025 10.413 1.00 . A A . 43 ARG HH11 1 1 9 6424 1 1 39 ARG HH12 H -5.778 -1.527 10.998 1.00 . A A . 43 ARG HH12 1 1 9 6425 1 1 39 ARG HH21 H -6.409 -0.227 7.853 1.00 . A A . 43 ARG HH21 1 1 9 6426 1 1 39 ARG HH22 H -6.490 0.047 9.562 1.00 . A A . 43 ARG HH22 1 1 9 6427 1 1 39 ARG N N -1.605 -1.542 6.142 1.00 . A A . 43 ARG N 1 1 9 6428 1 1 39 ARG NE N -5.429 -2.487 7.981 1.00 . A A . 43 ARG NE 1 1 9 6429 1 1 39 ARG NH1 N -5.537 -2.125 10.234 1.00 . A A . 43 ARG NH1 1 1 9 6430 1 1 39 ARG NH2 N -6.252 -0.542 8.788 1.00 . A A . 43 ARG NH2 1 1 9 6431 1 1 39 ARG O O 0.815 -2.372 7.100 1.00 . A A . 43 ARG O 1 1 9 6432 1 1 40 LYS C C 1.189 -5.766 9.435 1.00 . A A . 44 LYS C 1 1 9 6433 1 1 40 LYS CA C 1.326 -4.361 8.841 1.00 . A A . 44 LYS CA 1 1 9 6434 1 1 40 LYS CB C 1.951 -3.408 9.860 1.00 . A A . 44 LYS CB 1 1 9 6435 1 1 40 LYS CD C 4.121 -2.746 10.908 1.00 . A A . 44 LYS CD 1 1 9 6436 1 1 40 LYS CE C 4.798 -1.834 9.881 1.00 . A A . 44 LYS CE 1 1 9 6437 1 1 40 LYS CG C 3.375 -3.866 10.180 1.00 . A A . 44 LYS CG 1 1 9 6438 1 1 40 LYS H H -0.811 -4.142 9.016 1.00 . A A . 44 LYS H 1 1 9 6439 1 1 40 LYS HA H 1.923 -4.387 7.944 1.00 . A A . 44 LYS HA 1 1 9 6440 1 1 40 LYS HB2 H 1.978 -2.409 9.448 1.00 . A A . 44 LYS HB2 1 1 9 6441 1 1 40 LYS HB3 H 1.360 -3.409 10.763 1.00 . A A . 44 LYS HB3 1 1 9 6442 1 1 40 LYS HD2 H 3.420 -2.169 11.494 1.00 . A A . 44 LYS HD2 1 1 9 6443 1 1 40 LYS HD3 H 4.869 -3.174 11.558 1.00 . A A . 44 LYS HD3 1 1 9 6444 1 1 40 LYS HE2 H 5.666 -2.321 9.462 1.00 . A A . 44 LYS HE2 1 1 9 6445 1 1 40 LYS HE3 H 4.103 -1.565 9.100 1.00 . A A . 44 LYS HE3 1 1 9 6446 1 1 40 LYS HG2 H 3.338 -4.742 10.811 1.00 . A A . 44 LYS HG2 1 1 9 6447 1 1 40 LYS HG3 H 3.891 -4.105 9.263 1.00 . A A . 44 LYS HG3 1 1 9 6448 1 1 40 LYS HZ1 H 5.528 0.113 9.998 1.00 . A A . 44 LYS HZ1 1 1 9 6449 1 1 40 LYS HZ2 H 5.976 -0.874 11.306 1.00 . A A . 44 LYS HZ2 1 1 9 6450 1 1 40 LYS HZ3 H 4.391 -0.272 11.197 1.00 . A A . 44 LYS HZ3 1 1 9 6451 1 1 40 LYS N N -0.022 -3.791 8.554 1.00 . A A . 44 LYS N 1 1 9 6452 1 1 40 LYS NZ N 5.204 -0.626 10.655 1.00 . A A . 44 LYS NZ 1 1 9 6453 1 1 40 LYS O O 0.073 -6.252 9.505 1.00 . A A . 44 LYS O 1 1 9 6454 1 1 40 LYS OXT O 2.205 -6.331 9.808 1.00 . A A . 44 LYS OXT 1 1 9 6455 2 2 1 ACE C C 7.046 11.791 5.619 1.00 . B B . 45 ACE C 1 1 9 6456 2 2 1 ACE CH3 C 7.386 13.256 5.336 1.00 . B B . 45 ACE CH3 1 1 9 6457 2 2 1 ACE H1 H 8.229 13.307 4.664 1.00 . B B . 45 ACE H1 1 1 9 6458 2 2 1 ACE H2 H 7.633 13.755 6.262 1.00 . B B . 45 ACE H2 1 1 9 6459 2 2 1 ACE H3 H 6.534 13.742 4.882 1.00 . B B . 45 ACE H3 1 1 9 6460 2 2 1 ACE O O 6.016 11.491 6.189 1.00 . B B . 45 ACE O 1 1 9 6461 2 2 2 PRO C C 6.539 10.005 3.373 1.00 . B B . 46 PRO C 1 1 9 6462 2 2 2 PRO CA C 7.932 10.494 3.785 1.00 . B B . 46 PRO CA 1 1 9 6463 2 2 2 PRO CB C 8.936 9.348 3.748 1.00 . B B . 46 PRO CB 1 1 9 6464 2 2 2 PRO CD C 8.631 9.954 6.062 1.00 . B B . 46 PRO CD 1 1 9 6465 2 2 2 PRO CG C 8.962 8.811 5.141 1.00 . B B . 46 PRO CG 1 1 9 6466 2 2 2 PRO HA H 8.259 11.295 3.144 1.00 . B B . 46 PRO HA 1 1 9 6467 2 2 2 PRO HB2 H 8.610 8.585 3.053 1.00 . B B . 46 PRO HB2 1 1 9 6468 2 2 2 PRO HB3 H 9.914 9.713 3.475 1.00 . B B . 46 PRO HB3 1 1 9 6469 2 2 2 PRO HD2 H 7.985 9.617 6.862 1.00 . B B . 46 PRO HD2 1 1 9 6470 2 2 2 PRO HD3 H 9.533 10.392 6.462 1.00 . B B . 46 PRO HD3 1 1 9 6471 2 2 2 PRO HG2 H 8.227 8.025 5.245 1.00 . B B . 46 PRO HG2 1 1 9 6472 2 2 2 PRO HG3 H 9.945 8.430 5.372 1.00 . B B . 46 PRO HG3 1 1 9 6473 2 2 2 PRO N N 7.933 10.926 5.208 1.00 . B B . 46 PRO N 1 1 9 6474 2 2 2 PRO O O 6.072 8.977 3.822 1.00 . B B . 46 PRO O 1 1 9 6475 2 2 3 LEU C C 3.982 11.274 1.002 1.00 . B B . 47 LEU C 1 1 9 6476 2 2 3 LEU CA C 4.509 10.314 2.081 1.00 . B B . 47 LEU CA 1 1 9 6477 2 2 3 LEU CB C 3.645 10.399 3.339 1.00 . B B . 47 LEU CB 1 1 9 6478 2 2 3 LEU CD1 C 1.935 8.579 3.430 1.00 . B B . 47 LEU CD1 1 1 9 6479 2 2 3 LEU CD2 C 1.241 10.961 3.722 1.00 . B B . 47 LEU CD2 1 1 9 6480 2 2 3 LEU CG C 2.204 10.021 2.994 1.00 . B B . 47 LEU CG 1 1 9 6481 2 2 3 LEU H H 6.266 11.562 2.170 1.00 . B B . 47 LEU H 1 1 9 6482 2 2 3 LEU HA H 4.529 9.300 1.717 1.00 . B B . 47 LEU HA 1 1 9 6483 2 2 3 LEU HB2 H 4.027 9.718 4.085 1.00 . B B . 47 LEU HB2 1 1 9 6484 2 2 3 LEU HB3 H 3.670 11.407 3.725 1.00 . B B . 47 LEU HB3 1 1 9 6485 2 2 3 LEU HD11 H 0.872 8.391 3.419 1.00 . B B . 47 LEU HD11 1 1 9 6486 2 2 3 LEU HD12 H 2.317 8.429 4.429 1.00 . B B . 47 LEU HD12 1 1 9 6487 2 2 3 LEU HD13 H 2.429 7.900 2.750 1.00 . B B . 47 LEU HD13 1 1 9 6488 2 2 3 LEU HD21 H 0.480 10.381 4.223 1.00 . B B . 47 LEU HD21 1 1 9 6489 2 2 3 LEU HD22 H 0.775 11.624 3.007 1.00 . B B . 47 LEU HD22 1 1 9 6490 2 2 3 LEU HD23 H 1.788 11.543 4.449 1.00 . B B . 47 LEU HD23 1 1 9 6491 2 2 3 LEU HG H 2.053 10.108 1.927 1.00 . B B . 47 LEU HG 1 1 9 6492 2 2 3 LEU N N 5.872 10.736 2.521 1.00 . B B . 47 LEU N 1 1 9 6493 2 2 3 LEU O O 3.741 12.431 1.279 1.00 . B B . 47 LEU O 1 1 9 6494 2 2 4 PRO C C 1.827 11.941 -1.098 1.00 . B B . 48 PRO C 1 1 9 6495 2 2 4 PRO CA C 3.312 11.612 -1.308 1.00 . B B . 48 PRO CA 1 1 9 6496 2 2 4 PRO CB C 3.508 10.740 -2.545 1.00 . B B . 48 PRO CB 1 1 9 6497 2 2 4 PRO CD C 4.077 9.386 -0.636 1.00 . B B . 48 PRO CD 1 1 9 6498 2 2 4 PRO CG C 3.508 9.337 -2.030 1.00 . B B . 48 PRO CG 1 1 9 6499 2 2 4 PRO HA H 3.897 12.514 -1.396 1.00 . B B . 48 PRO HA 1 1 9 6500 2 2 4 PRO HB2 H 2.693 10.883 -3.240 1.00 . B B . 48 PRO HB2 1 1 9 6501 2 2 4 PRO HB3 H 4.452 10.966 -3.020 1.00 . B B . 48 PRO HB3 1 1 9 6502 2 2 4 PRO HD2 H 3.569 8.683 0.006 1.00 . B B . 48 PRO HD2 1 1 9 6503 2 2 4 PRO HD3 H 5.138 9.187 -0.652 1.00 . B B . 48 PRO HD3 1 1 9 6504 2 2 4 PRO HG2 H 2.500 8.952 -2.004 1.00 . B B . 48 PRO HG2 1 1 9 6505 2 2 4 PRO HG3 H 4.127 8.713 -2.658 1.00 . B B . 48 PRO HG3 1 1 9 6506 2 2 4 PRO N N 3.818 10.767 -0.198 1.00 . B B . 48 PRO N 1 1 9 6507 2 2 4 PRO O O 1.074 11.109 -0.633 1.00 . B B . 48 PRO O 1 1 9 6508 2 2 5 PRO C C -0.850 12.889 -2.325 1.00 . B B . 49 PRO C 1 1 9 6509 2 2 5 PRO CA C 0.038 13.575 -1.282 1.00 . B B . 49 PRO CA 1 1 9 6510 2 2 5 PRO CB C 0.086 15.082 -1.516 1.00 . B B . 49 PRO CB 1 1 9 6511 2 2 5 PRO CD C 2.285 14.219 -2.013 1.00 . B B . 49 PRO CD 1 1 9 6512 2 2 5 PRO CG C 1.298 15.303 -2.363 1.00 . B B . 49 PRO CG 1 1 9 6513 2 2 5 PRO HA H -0.311 13.366 -0.284 1.00 . B B . 49 PRO HA 1 1 9 6514 2 2 5 PRO HB2 H -0.802 15.409 -2.038 1.00 . B B . 49 PRO HB2 1 1 9 6515 2 2 5 PRO HB3 H 0.184 15.605 -0.576 1.00 . B B . 49 PRO HB3 1 1 9 6516 2 2 5 PRO HD2 H 2.795 13.870 -2.900 1.00 . B B . 49 PRO HD2 1 1 9 6517 2 2 5 PRO HD3 H 2.995 14.576 -1.282 1.00 . B B . 49 PRO HD3 1 1 9 6518 2 2 5 PRO HG2 H 1.035 15.239 -3.409 1.00 . B B . 49 PRO HG2 1 1 9 6519 2 2 5 PRO HG3 H 1.725 16.272 -2.149 1.00 . B B . 49 PRO HG3 1 1 9 6520 2 2 5 PRO N N 1.451 13.150 -1.445 1.00 . B B . 49 PRO N 1 1 9 6521 2 2 5 PRO O O -0.468 11.909 -2.932 1.00 . B B . 49 PRO O 1 1 9 6522 2 2 6 TYR C C -4.117 13.714 -3.839 1.00 . B B . 50 TYR C 1 1 9 6523 2 2 6 TYR CA C -2.945 12.777 -3.536 1.00 . B B . 50 TYR CA 1 1 9 6524 2 2 6 TYR CB C -3.445 11.491 -2.874 1.00 . B B . 50 TYR CB 1 1 9 6525 2 2 6 TYR CD1 C -3.139 9.982 -4.869 1.00 . B B . 50 TYR CD1 1 1 9 6526 2 2 6 TYR CD2 C -5.368 10.287 -3.966 1.00 . B B . 50 TYR CD2 1 1 9 6527 2 2 6 TYR CE1 C -3.653 9.122 -5.847 1.00 . B B . 50 TYR CE1 1 1 9 6528 2 2 6 TYR CE2 C -5.882 9.427 -4.944 1.00 . B B . 50 TYR CE2 1 1 9 6529 2 2 6 TYR CG C -3.997 10.564 -3.928 1.00 . B B . 50 TYR CG 1 1 9 6530 2 2 6 TYR CZ C -5.024 8.845 -5.885 1.00 . B B . 50 TYR CZ 1 1 9 6531 2 2 6 TYR H H -2.323 14.189 -2.033 1.00 . B B . 50 TYR H 1 1 9 6532 2 2 6 TYR HA H -2.407 12.539 -4.440 1.00 . B B . 50 TYR HA 1 1 9 6533 2 2 6 TYR HB2 H -2.624 11.009 -2.362 1.00 . B B . 50 TYR HB2 1 1 9 6534 2 2 6 TYR HB3 H -4.221 11.732 -2.163 1.00 . B B . 50 TYR HB3 1 1 9 6535 2 2 6 TYR HD1 H -2.081 10.197 -4.839 1.00 . B B . 50 TYR HD1 1 1 9 6536 2 2 6 TYR HD2 H -6.031 10.736 -3.241 1.00 . B B . 50 TYR HD2 1 1 9 6537 2 2 6 TYR HE1 H -2.990 8.674 -6.573 1.00 . B B . 50 TYR HE1 1 1 9 6538 2 2 6 TYR HE2 H -6.940 9.212 -4.974 1.00 . B B . 50 TYR HE2 1 1 9 6539 2 2 6 TYR HH H -5.606 7.122 -6.463 1.00 . B B . 50 TYR HH 1 1 9 6540 2 2 6 TYR N N -2.033 13.398 -2.535 1.00 . B B . 50 TYR N 1 1 9 6541 2 2 6 TYR O O -4.067 14.383 -4.859 1.00 . B B . 50 TYR O 1 1 9 6542 2 2 6 TYR OXT O -5.044 13.747 -3.046 1.00 . B B . 50 TYR OXT 1 1 9 6543 2 2 6 TYR OH O -5.529 7.997 -6.850 1.00 . B B . 50 TYR OH 1 1 10 6544 1 1 1 PHE C C 3.832 -13.500 9.462 1.00 . A A . 5 PHE C 1 1 10 6545 1 1 1 PHE CA C 3.304 -12.501 10.495 1.00 . A A . 5 PHE CA 1 1 10 6546 1 1 1 PHE CB C 4.372 -11.460 10.829 1.00 . A A . 5 PHE CB 1 1 10 6547 1 1 1 PHE CD1 C 3.646 -10.460 13.026 1.00 . A A . 5 PHE CD1 1 1 10 6548 1 1 1 PHE CD2 C 3.284 -9.191 10.991 1.00 . A A . 5 PHE CD2 1 1 10 6549 1 1 1 PHE CE1 C 3.072 -9.424 13.773 1.00 . A A . 5 PHE CE1 1 1 10 6550 1 1 1 PHE CE2 C 2.710 -8.155 11.738 1.00 . A A . 5 PHE CE2 1 1 10 6551 1 1 1 PHE CG C 3.752 -10.343 11.635 1.00 . A A . 5 PHE CG 1 1 10 6552 1 1 1 PHE CZ C 2.604 -8.273 13.129 1.00 . A A . 5 PHE CZ 1 1 10 6553 1 1 1 PHE HA H 2.415 -12.013 10.128 1.00 . A A . 5 PHE HA 1 1 10 6554 1 1 1 PHE HB2 H 5.160 -11.925 11.403 1.00 . A A . 5 PHE HB2 1 1 10 6555 1 1 1 PHE HB3 H 4.782 -11.058 9.914 1.00 . A A . 5 PHE HB3 1 1 10 6556 1 1 1 PHE HD1 H 4.008 -11.348 13.522 1.00 . A A . 5 PHE HD1 1 1 10 6557 1 1 1 PHE HD2 H 3.367 -9.102 9.917 1.00 . A A . 5 PHE HD2 1 1 10 6558 1 1 1 PHE HE1 H 2.990 -9.515 14.846 1.00 . A A . 5 PHE HE1 1 1 10 6559 1 1 1 PHE HE2 H 2.349 -7.268 11.241 1.00 . A A . 5 PHE HE2 1 1 10 6560 1 1 1 PHE HZ H 2.161 -7.475 13.706 1.00 . A A . 5 PHE HZ 1 1 10 6561 1 1 1 PHE N N 3.023 -13.194 11.785 1.00 . A A . 5 PHE N 1 1 10 6562 1 1 1 PHE O O 5.002 -13.832 9.446 1.00 . A A . 5 PHE O 1 1 10 6563 1 1 2 GLU C C 2.767 -14.659 6.223 1.00 . A A . 6 GLU C 1 1 10 6564 1 1 2 GLU CA C 3.434 -14.960 7.568 1.00 . A A . 6 GLU CA 1 1 10 6565 1 1 2 GLU CB C 2.990 -16.326 8.093 1.00 . A A . 6 GLU CB 1 1 10 6566 1 1 2 GLU CD C 3.208 -17.724 10.153 1.00 . A A . 6 GLU CD 1 1 10 6567 1 1 2 GLU CG C 3.944 -16.782 9.199 1.00 . A A . 6 GLU CG 1 1 10 6568 1 1 2 GLU H H 2.042 -13.703 8.628 1.00 . A A . 6 GLU H 1 1 10 6569 1 1 2 GLU HA H 4.508 -14.935 7.472 1.00 . A A . 6 GLU HA 1 1 10 6570 1 1 2 GLU HB2 H 1.988 -16.249 8.492 1.00 . A A . 6 GLU HB2 1 1 10 6571 1 1 2 GLU HB3 H 3.002 -17.043 7.287 1.00 . A A . 6 GLU HB3 1 1 10 6572 1 1 2 GLU HG2 H 4.783 -17.302 8.758 1.00 . A A . 6 GLU HG2 1 1 10 6573 1 1 2 GLU HG3 H 4.300 -15.922 9.746 1.00 . A A . 6 GLU HG3 1 1 10 6574 1 1 2 GLU N N 2.980 -13.983 8.599 1.00 . A A . 6 GLU N 1 1 10 6575 1 1 2 GLU O O 1.584 -14.873 6.044 1.00 . A A . 6 GLU O 1 1 10 6576 1 1 2 GLU OE1 O 2.755 -18.762 9.698 1.00 . A A . 6 GLU OE1 1 1 10 6577 1 1 2 GLU OE2 O 3.108 -17.391 11.323 1.00 . A A . 6 GLU OE2 1 1 10 6578 1 1 3 ILE C C 3.867 -14.310 2.824 1.00 . A A . 7 ILE C 1 1 10 6579 1 1 3 ILE CA C 2.924 -13.851 3.945 1.00 . A A . 7 ILE CA 1 1 10 6580 1 1 3 ILE CB C 2.772 -12.331 3.927 1.00 . A A . 7 ILE CB 1 1 10 6581 1 1 3 ILE CD1 C 3.981 -10.158 4.181 1.00 . A A . 7 ILE CD1 1 1 10 6582 1 1 3 ILE CG1 C 4.133 -11.681 4.192 1.00 . A A . 7 ILE CG1 1 1 10 6583 1 1 3 ILE CG2 C 1.784 -11.902 5.014 1.00 . A A . 7 ILE CG2 1 1 10 6584 1 1 3 ILE H H 4.469 -14.000 5.440 1.00 . A A . 7 ILE H 1 1 10 6585 1 1 3 ILE HA H 1.959 -14.319 3.840 1.00 . A A . 7 ILE HA 1 1 10 6586 1 1 3 ILE HB H 2.403 -12.016 2.962 1.00 . A A . 7 ILE HB 1 1 10 6587 1 1 3 ILE HD11 H 4.371 -9.751 5.103 1.00 . A A . 7 ILE HD11 1 1 10 6588 1 1 3 ILE HD12 H 2.937 -9.901 4.088 1.00 . A A . 7 ILE HD12 1 1 10 6589 1 1 3 ILE HD13 H 4.530 -9.747 3.346 1.00 . A A . 7 ILE HD13 1 1 10 6590 1 1 3 ILE HG12 H 4.503 -11.999 5.153 1.00 . A A . 7 ILE HG12 1 1 10 6591 1 1 3 ILE HG13 H 4.829 -11.977 3.421 1.00 . A A . 7 ILE HG13 1 1 10 6592 1 1 3 ILE HG21 H 2.326 -11.456 5.836 1.00 . A A . 7 ILE HG21 1 1 10 6593 1 1 3 ILE HG22 H 1.243 -12.766 5.367 1.00 . A A . 7 ILE HG22 1 1 10 6594 1 1 3 ILE HG23 H 1.091 -11.183 4.606 1.00 . A A . 7 ILE HG23 1 1 10 6595 1 1 3 ILE N N 3.516 -14.165 5.277 1.00 . A A . 7 ILE N 1 1 10 6596 1 1 3 ILE O O 5.065 -14.376 3.014 1.00 . A A . 7 ILE O 1 1 10 6597 1 1 4 PRO C C 4.610 -13.878 -0.300 1.00 . A A . 8 PRO C 1 1 10 6598 1 1 4 PRO CA C 4.098 -15.069 0.524 1.00 . A A . 8 PRO CA 1 1 10 6599 1 1 4 PRO CB C 3.102 -15.887 -0.288 1.00 . A A . 8 PRO CB 1 1 10 6600 1 1 4 PRO CD C 1.863 -14.575 1.361 1.00 . A A . 8 PRO CD 1 1 10 6601 1 1 4 PRO CG C 1.744 -15.348 0.067 1.00 . A A . 8 PRO CG 1 1 10 6602 1 1 4 PRO HA H 4.914 -15.696 0.846 1.00 . A A . 8 PRO HA 1 1 10 6603 1 1 4 PRO HB2 H 3.290 -15.758 -1.345 1.00 . A A . 8 PRO HB2 1 1 10 6604 1 1 4 PRO HB3 H 3.171 -16.930 -0.023 1.00 . A A . 8 PRO HB3 1 1 10 6605 1 1 4 PRO HD2 H 1.536 -13.554 1.222 1.00 . A A . 8 PRO HD2 1 1 10 6606 1 1 4 PRO HD3 H 1.289 -15.054 2.141 1.00 . A A . 8 PRO HD3 1 1 10 6607 1 1 4 PRO HG2 H 1.397 -14.693 -0.717 1.00 . A A . 8 PRO HG2 1 1 10 6608 1 1 4 PRO HG3 H 1.050 -16.165 0.195 1.00 . A A . 8 PRO HG3 1 1 10 6609 1 1 4 PRO N N 3.294 -14.615 1.681 1.00 . A A . 8 PRO N 1 1 10 6610 1 1 4 PRO O O 4.735 -13.964 -1.505 1.00 . A A . 8 PRO O 1 1 10 6611 1 1 5 ASP C C 4.577 -11.312 -1.659 1.00 . A A . 9 ASP C 1 1 10 6612 1 1 5 ASP CA C 5.427 -11.587 -0.412 1.00 . A A . 9 ASP CA 1 1 10 6613 1 1 5 ASP CB C 6.850 -11.971 -0.800 1.00 . A A . 9 ASP CB 1 1 10 6614 1 1 5 ASP CG C 7.552 -10.770 -1.434 1.00 . A A . 9 ASP CG 1 1 10 6615 1 1 5 ASP H H 4.822 -12.727 1.303 1.00 . A A . 9 ASP H 1 1 10 6616 1 1 5 ASP HA H 5.445 -10.721 0.230 1.00 . A A . 9 ASP HA 1 1 10 6617 1 1 5 ASP HB2 H 7.386 -12.278 0.086 1.00 . A A . 9 ASP HB2 1 1 10 6618 1 1 5 ASP HB3 H 6.821 -12.788 -1.503 1.00 . A A . 9 ASP HB3 1 1 10 6619 1 1 5 ASP N N 4.917 -12.775 0.335 1.00 . A A . 9 ASP N 1 1 10 6620 1 1 5 ASP O O 5.085 -11.209 -2.757 1.00 . A A . 9 ASP O 1 1 10 6621 1 1 5 ASP OD1 O 7.150 -9.654 -1.150 1.00 . A A . 9 ASP OD1 1 1 10 6622 1 1 5 ASP OD2 O 8.482 -10.985 -2.193 1.00 . A A . 9 ASP OD2 1 1 10 6623 1 1 6 ASP C C 0.975 -10.650 -2.206 1.00 . A A . 10 ASP C 1 1 10 6624 1 1 6 ASP CA C 2.409 -10.924 -2.670 1.00 . A A . 10 ASP CA 1 1 10 6625 1 1 6 ASP CB C 2.467 -12.202 -3.507 1.00 . A A . 10 ASP CB 1 1 10 6626 1 1 6 ASP CG C 2.245 -11.856 -4.981 1.00 . A A . 10 ASP CG 1 1 10 6627 1 1 6 ASP H H 2.899 -11.278 -0.600 1.00 . A A . 10 ASP H 1 1 10 6628 1 1 6 ASP HA H 2.787 -10.091 -3.240 1.00 . A A . 10 ASP HA 1 1 10 6629 1 1 6 ASP HB2 H 3.435 -12.667 -3.388 1.00 . A A . 10 ASP HB2 1 1 10 6630 1 1 6 ASP HB3 H 1.697 -12.883 -3.178 1.00 . A A . 10 ASP HB3 1 1 10 6631 1 1 6 ASP N N 3.289 -11.192 -1.495 1.00 . A A . 10 ASP N 1 1 10 6632 1 1 6 ASP O O 0.055 -11.362 -2.552 1.00 . A A . 10 ASP O 1 1 10 6633 1 1 6 ASP OD1 O 2.838 -10.893 -5.438 1.00 . A A . 10 ASP OD1 1 1 10 6634 1 1 6 ASP OD2 O 1.487 -12.562 -5.626 1.00 . A A . 10 ASP OD2 1 1 10 6635 1 1 7 VAL C C -1.307 -8.376 -1.925 1.00 . A A . 11 VAL C 1 1 10 6636 1 1 7 VAL CA C -0.590 -9.308 -0.934 1.00 . A A . 11 VAL CA 1 1 10 6637 1 1 7 VAL CB C -0.374 -8.598 0.401 1.00 . A A . 11 VAL CB 1 1 10 6638 1 1 7 VAL CG1 C -1.723 -8.150 0.965 1.00 . A A . 11 VAL CG1 1 1 10 6639 1 1 7 VAL CG2 C 0.299 -9.560 1.383 1.00 . A A . 11 VAL CG2 1 1 10 6640 1 1 7 VAL H H 1.538 -9.064 -1.152 1.00 . A A . 11 VAL H 1 1 10 6641 1 1 7 VAL HA H -1.150 -10.214 -0.781 1.00 . A A . 11 VAL HA 1 1 10 6642 1 1 7 VAL HB H 0.259 -7.736 0.253 1.00 . A A . 11 VAL HB 1 1 10 6643 1 1 7 VAL HG11 H -1.813 -7.078 0.875 1.00 . A A . 11 VAL HG11 1 1 10 6644 1 1 7 VAL HG12 H -1.787 -8.430 2.007 1.00 . A A . 11 VAL HG12 1 1 10 6645 1 1 7 VAL HG13 H -2.519 -8.627 0.415 1.00 . A A . 11 VAL HG13 1 1 10 6646 1 1 7 VAL HG21 H 1.368 -9.548 1.225 1.00 . A A . 11 VAL HG21 1 1 10 6647 1 1 7 VAL HG22 H -0.077 -10.560 1.223 1.00 . A A . 11 VAL HG22 1 1 10 6648 1 1 7 VAL HG23 H 0.081 -9.253 2.395 1.00 . A A . 11 VAL HG23 1 1 10 6649 1 1 7 VAL N N 0.782 -9.625 -1.422 1.00 . A A . 11 VAL N 1 1 10 6650 1 1 7 VAL O O -0.794 -7.327 -2.261 1.00 . A A . 11 VAL O 1 1 10 6651 1 1 8 PRO C C -3.911 -6.762 -2.621 1.00 . A A . 12 PRO C 1 1 10 6652 1 1 8 PRO CA C -3.252 -7.957 -3.327 1.00 . A A . 12 PRO CA 1 1 10 6653 1 1 8 PRO CB C -4.318 -8.915 -3.848 1.00 . A A . 12 PRO CB 1 1 10 6654 1 1 8 PRO CD C -3.177 -10.033 -2.028 1.00 . A A . 12 PRO CD 1 1 10 6655 1 1 8 PRO CG C -4.488 -9.935 -2.765 1.00 . A A . 12 PRO CG 1 1 10 6656 1 1 8 PRO HA H -2.625 -7.627 -4.139 1.00 . A A . 12 PRO HA 1 1 10 6657 1 1 8 PRO HB2 H -5.244 -8.388 -4.016 1.00 . A A . 12 PRO HB2 1 1 10 6658 1 1 8 PRO HB3 H -3.983 -9.388 -4.758 1.00 . A A . 12 PRO HB3 1 1 10 6659 1 1 8 PRO HD2 H -3.347 -10.093 -0.964 1.00 . A A . 12 PRO HD2 1 1 10 6660 1 1 8 PRO HD3 H -2.614 -10.888 -2.371 1.00 . A A . 12 PRO HD3 1 1 10 6661 1 1 8 PRO HG2 H -5.267 -9.622 -2.087 1.00 . A A . 12 PRO HG2 1 1 10 6662 1 1 8 PRO HG3 H -4.739 -10.892 -3.198 1.00 . A A . 12 PRO HG3 1 1 10 6663 1 1 8 PRO N N -2.477 -8.785 -2.367 1.00 . A A . 12 PRO N 1 1 10 6664 1 1 8 PRO O O -4.593 -5.974 -3.243 1.00 . A A . 12 PRO O 1 1 10 6665 1 1 9 LEU C C -5.873 -5.509 -0.777 1.00 . A A . 13 LEU C 1 1 10 6666 1 1 9 LEU CA C -4.347 -5.490 -0.588 1.00 . A A . 13 LEU CA 1 1 10 6667 1 1 9 LEU CB C -3.729 -4.221 -1.186 1.00 . A A . 13 LEU CB 1 1 10 6668 1 1 9 LEU CD1 C -1.311 -4.856 -1.308 1.00 . A A . 13 LEU CD1 1 1 10 6669 1 1 9 LEU CD2 C -1.956 -2.519 -0.714 1.00 . A A . 13 LEU CD2 1 1 10 6670 1 1 9 LEU CG C -2.342 -3.993 -0.575 1.00 . A A . 13 LEU CG 1 1 10 6671 1 1 9 LEU H H -3.179 -7.281 -0.844 1.00 . A A . 13 LEU H 1 1 10 6672 1 1 9 LEU HA H -4.104 -5.556 0.462 1.00 . A A . 13 LEU HA 1 1 10 6673 1 1 9 LEU HB2 H -3.635 -4.327 -2.253 1.00 . A A . 13 LEU HB2 1 1 10 6674 1 1 9 LEU HB3 H -4.362 -3.374 -0.963 1.00 . A A . 13 LEU HB3 1 1 10 6675 1 1 9 LEU HD11 H -1.671 -5.084 -2.300 1.00 . A A . 13 LEU HD11 1 1 10 6676 1 1 9 LEU HD12 H -1.157 -5.774 -0.761 1.00 . A A . 13 LEU HD12 1 1 10 6677 1 1 9 LEU HD13 H -0.376 -4.318 -1.380 1.00 . A A . 13 LEU HD13 1 1 10 6678 1 1 9 LEU HD21 H -0.914 -2.393 -0.459 1.00 . A A . 13 LEU HD21 1 1 10 6679 1 1 9 LEU HD22 H -2.562 -1.923 -0.048 1.00 . A A . 13 LEU HD22 1 1 10 6680 1 1 9 LEU HD23 H -2.118 -2.197 -1.733 1.00 . A A . 13 LEU HD23 1 1 10 6681 1 1 9 LEU HG H -2.359 -4.264 0.470 1.00 . A A . 13 LEU HG 1 1 10 6682 1 1 9 LEU N N -3.724 -6.629 -1.329 1.00 . A A . 13 LEU N 1 1 10 6683 1 1 9 LEU O O -6.378 -6.200 -1.640 1.00 . A A . 13 LEU O 1 1 10 6684 1 1 10 PRO C C -8.496 -3.873 -1.242 1.00 . A A . 14 PRO C 1 1 10 6685 1 1 10 PRO CA C -8.045 -4.713 -0.042 1.00 . A A . 14 PRO CA 1 1 10 6686 1 1 10 PRO CB C -8.466 -4.069 1.277 1.00 . A A . 14 PRO CB 1 1 10 6687 1 1 10 PRO CD C -6.049 -3.893 1.117 1.00 . A A . 14 PRO CD 1 1 10 6688 1 1 10 PRO CG C -7.283 -3.267 1.722 1.00 . A A . 14 PRO CG 1 1 10 6689 1 1 10 PRO HA H -8.448 -5.707 -0.106 1.00 . A A . 14 PRO HA 1 1 10 6690 1 1 10 PRO HB2 H -9.318 -3.425 1.121 1.00 . A A . 14 PRO HB2 1 1 10 6691 1 1 10 PRO HB3 H -8.698 -4.831 2.006 1.00 . A A . 14 PRO HB3 1 1 10 6692 1 1 10 PRO HD2 H -5.401 -3.131 0.709 1.00 . A A . 14 PRO HD2 1 1 10 6693 1 1 10 PRO HD3 H -5.524 -4.480 1.855 1.00 . A A . 14 PRO HD3 1 1 10 6694 1 1 10 PRO HG2 H -7.383 -2.248 1.384 1.00 . A A . 14 PRO HG2 1 1 10 6695 1 1 10 PRO HG3 H -7.214 -3.289 2.799 1.00 . A A . 14 PRO HG3 1 1 10 6696 1 1 10 PRO N N -6.566 -4.757 0.046 1.00 . A A . 14 PRO N 1 1 10 6697 1 1 10 PRO O O -7.692 -3.311 -1.955 1.00 . A A . 14 PRO O 1 1 10 6698 1 1 11 ALA C C -10.004 -1.514 -2.433 1.00 . A A . 15 ALA C 1 1 10 6699 1 1 11 ALA CA C -10.285 -3.006 -2.633 1.00 . A A . 15 ALA CA 1 1 10 6700 1 1 11 ALA CB C -11.791 -3.267 -2.660 1.00 . A A . 15 ALA CB 1 1 10 6701 1 1 11 ALA H H -10.410 -4.267 -0.889 1.00 . A A . 15 ALA H 1 1 10 6702 1 1 11 ALA HA H -9.837 -3.354 -3.550 1.00 . A A . 15 ALA HA 1 1 10 6703 1 1 11 ALA HB1 H -12.261 -2.591 -3.360 1.00 . A A . 15 ALA HB1 1 1 10 6704 1 1 11 ALA HB2 H -12.202 -3.108 -1.675 1.00 . A A . 15 ALA HB2 1 1 10 6705 1 1 11 ALA HB3 H -11.975 -4.287 -2.966 1.00 . A A . 15 ALA HB3 1 1 10 6706 1 1 11 ALA N N -9.779 -3.797 -1.473 1.00 . A A . 15 ALA N 1 1 10 6707 1 1 11 ALA O O -9.767 -1.059 -1.333 1.00 . A A . 15 ALA O 1 1 10 6708 1 1 12 GLY C C -8.271 0.946 -3.150 1.00 . A A . 16 GLY C 1 1 10 6709 1 1 12 GLY CA C -9.768 0.710 -3.371 1.00 . A A . 16 GLY CA 1 1 10 6710 1 1 12 GLY H H -10.227 -1.141 -4.370 1.00 . A A . 16 GLY H 1 1 10 6711 1 1 12 GLY HA2 H -10.081 1.209 -4.275 1.00 . A A . 16 GLY HA2 1 1 10 6712 1 1 12 GLY HA3 H -10.322 1.106 -2.531 1.00 . A A . 16 GLY HA3 1 1 10 6713 1 1 12 GLY N N -10.031 -0.752 -3.493 1.00 . A A . 16 GLY N 1 1 10 6714 1 1 12 GLY O O -7.865 1.977 -2.651 1.00 . A A . 16 GLY O 1 1 10 6715 1 1 13 TRP C C -5.225 -0.045 -4.625 1.00 . A A . 17 TRP C 1 1 10 6716 1 1 13 TRP CA C -5.981 0.173 -3.314 1.00 . A A . 17 TRP CA 1 1 10 6717 1 1 13 TRP CB C -5.602 -0.903 -2.306 1.00 . A A . 17 TRP CB 1 1 10 6718 1 1 13 TRP CD1 C -6.855 -0.472 -0.163 1.00 . A A . 17 TRP CD1 1 1 10 6719 1 1 13 TRP CD2 C -4.781 0.387 -0.150 1.00 . A A . 17 TRP CD2 1 1 10 6720 1 1 13 TRP CE2 C -5.353 0.702 1.104 1.00 . A A . 17 TRP CE2 1 1 10 6721 1 1 13 TRP CE3 C -3.472 0.812 -0.409 1.00 . A A . 17 TRP CE3 1 1 10 6722 1 1 13 TRP CG C -5.751 -0.359 -0.930 1.00 . A A . 17 TRP CG 1 1 10 6723 1 1 13 TRP CH2 C -3.333 1.832 1.789 1.00 . A A . 17 TRP CH2 1 1 10 6724 1 1 13 TRP CZ2 C -4.640 1.418 2.068 1.00 . A A . 17 TRP CZ2 1 1 10 6725 1 1 13 TRP CZ3 C -2.754 1.530 0.555 1.00 . A A . 17 TRP CZ3 1 1 10 6726 1 1 13 TRP H H -7.794 -0.827 -3.903 1.00 . A A . 17 TRP H 1 1 10 6727 1 1 13 TRP HA H -5.764 1.150 -2.908 1.00 . A A . 17 TRP HA 1 1 10 6728 1 1 13 TRP HB2 H -6.249 -1.757 -2.430 1.00 . A A . 17 TRP HB2 1 1 10 6729 1 1 13 TRP HB3 H -4.575 -1.202 -2.466 1.00 . A A . 17 TRP HB3 1 1 10 6730 1 1 13 TRP HD1 H -7.769 -0.976 -0.450 1.00 . A A . 17 TRP HD1 1 1 10 6731 1 1 13 TRP HE1 H -7.267 0.221 1.787 1.00 . A A . 17 TRP HE1 1 1 10 6732 1 1 13 TRP HE3 H -3.015 0.585 -1.361 1.00 . A A . 17 TRP HE3 1 1 10 6733 1 1 13 TRP HH2 H -2.768 2.384 2.522 1.00 . A A . 17 TRP HH2 1 1 10 6734 1 1 13 TRP HZ2 H -5.094 1.648 3.022 1.00 . A A . 17 TRP HZ2 1 1 10 6735 1 1 13 TRP HZ3 H -1.750 1.853 0.344 1.00 . A A . 17 TRP HZ3 1 1 10 6736 1 1 13 TRP N N -7.449 0.000 -3.511 1.00 . A A . 17 TRP N 1 1 10 6737 1 1 13 TRP NE1 N -6.624 0.158 1.049 1.00 . A A . 17 TRP NE1 1 1 10 6738 1 1 13 TRP O O -5.583 -0.887 -5.424 1.00 . A A . 17 TRP O 1 1 10 6739 1 1 14 GLU C C -1.899 0.553 -5.853 1.00 . A A . 18 GLU C 1 1 10 6740 1 1 14 GLU CA C -3.406 0.519 -6.115 1.00 . A A . 18 GLU CA 1 1 10 6741 1 1 14 GLU CB C -3.797 1.702 -7.001 1.00 . A A . 18 GLU CB 1 1 10 6742 1 1 14 GLU CD C -5.960 0.804 -7.871 1.00 . A A . 18 GLU CD 1 1 10 6743 1 1 14 GLU CG C -4.527 1.194 -8.244 1.00 . A A . 18 GLU CG 1 1 10 6744 1 1 14 GLU H H -3.900 1.379 -4.195 1.00 . A A . 18 GLU H 1 1 10 6745 1 1 14 GLU HA H -3.684 -0.404 -6.597 1.00 . A A . 18 GLU HA 1 1 10 6746 1 1 14 GLU HB2 H -4.438 2.370 -6.449 1.00 . A A . 18 GLU HB2 1 1 10 6747 1 1 14 GLU HB3 H -2.906 2.233 -7.303 1.00 . A A . 18 GLU HB3 1 1 10 6748 1 1 14 GLU HG2 H -4.549 1.974 -8.991 1.00 . A A . 18 GLU HG2 1 1 10 6749 1 1 14 GLU HG3 H -4.009 0.332 -8.636 1.00 . A A . 18 GLU HG3 1 1 10 6750 1 1 14 GLU N N -4.177 0.701 -4.853 1.00 . A A . 18 GLU N 1 1 10 6751 1 1 14 GLU O O -1.295 1.611 -5.842 1.00 . A A . 18 GLU O 1 1 10 6752 1 1 14 GLU OE1 O -6.495 1.400 -6.950 1.00 . A A . 18 GLU OE1 1 1 10 6753 1 1 14 GLU OE2 O -6.497 -0.084 -8.512 1.00 . A A . 18 GLU OE2 1 1 10 6754 1 1 15 MET C C 0.852 0.034 -6.686 1.00 . A A . 19 MET C 1 1 10 6755 1 1 15 MET CA C 0.196 -0.561 -5.449 1.00 . A A . 19 MET CA 1 1 10 6756 1 1 15 MET CB C 0.650 -2.003 -5.253 1.00 . A A . 19 MET CB 1 1 10 6757 1 1 15 MET CE C -1.625 -3.980 -4.688 1.00 . A A . 19 MET CE 1 1 10 6758 1 1 15 MET CG C 0.168 -2.879 -6.415 1.00 . A A . 19 MET CG 1 1 10 6759 1 1 15 MET H H -1.753 -1.432 -5.691 1.00 . A A . 19 MET H 1 1 10 6760 1 1 15 MET HA H 0.439 0.025 -4.580 1.00 . A A . 19 MET HA 1 1 10 6761 1 1 15 MET HB2 H 1.721 -2.017 -5.225 1.00 . A A . 19 MET HB2 1 1 10 6762 1 1 15 MET HB3 H 0.266 -2.385 -4.318 1.00 . A A . 19 MET HB3 1 1 10 6763 1 1 15 MET HE1 H -2.235 -3.244 -5.193 1.00 . A A . 19 MET HE1 1 1 10 6764 1 1 15 MET HE2 H -1.203 -3.543 -3.798 1.00 . A A . 19 MET HE2 1 1 10 6765 1 1 15 MET HE3 H -2.230 -4.833 -4.416 1.00 . A A . 19 MET HE3 1 1 10 6766 1 1 15 MET HG2 H -0.683 -2.421 -6.892 1.00 . A A . 19 MET HG2 1 1 10 6767 1 1 15 MET HG3 H 0.966 -2.982 -7.135 1.00 . A A . 19 MET HG3 1 1 10 6768 1 1 15 MET N N -1.271 -0.584 -5.667 1.00 . A A . 19 MET N 1 1 10 6769 1 1 15 MET O O 0.713 -0.469 -7.785 1.00 . A A . 19 MET O 1 1 10 6770 1 1 15 MET SD S -0.293 -4.514 -5.792 1.00 . A A . 19 MET SD 1 1 10 6771 1 1 16 ALA C C 3.597 2.232 -7.261 1.00 . A A . 20 ALA C 1 1 10 6772 1 1 16 ALA CA C 2.209 1.758 -7.675 1.00 . A A . 20 ALA CA 1 1 10 6773 1 1 16 ALA CB C 1.296 2.936 -8.023 1.00 . A A . 20 ALA CB 1 1 10 6774 1 1 16 ALA H H 1.639 1.487 -5.621 1.00 . A A . 20 ALA H 1 1 10 6775 1 1 16 ALA HA H 2.272 1.077 -8.509 1.00 . A A . 20 ALA HA 1 1 10 6776 1 1 16 ALA HB1 H 1.893 3.774 -8.350 1.00 . A A . 20 ALA HB1 1 1 10 6777 1 1 16 ALA HB2 H 0.725 3.220 -7.150 1.00 . A A . 20 ALA HB2 1 1 10 6778 1 1 16 ALA HB3 H 0.618 2.646 -8.813 1.00 . A A . 20 ALA HB3 1 1 10 6779 1 1 16 ALA N N 1.550 1.105 -6.517 1.00 . A A . 20 ALA N 1 1 10 6780 1 1 16 ALA O O 4.131 1.794 -6.260 1.00 . A A . 20 ALA O 1 1 10 6781 1 1 17 LYS C C 5.581 5.104 -7.466 1.00 . A A . 21 LYS C 1 1 10 6782 1 1 17 LYS CA C 5.551 3.588 -7.618 1.00 . A A . 21 LYS CA 1 1 10 6783 1 1 17 LYS CB C 6.479 3.131 -8.742 1.00 . A A . 21 LYS CB 1 1 10 6784 1 1 17 LYS CD C 7.028 3.400 -11.165 1.00 . A A . 21 LYS CD 1 1 10 6785 1 1 17 LYS CE C 6.653 2.050 -11.781 1.00 . A A . 21 LYS CE 1 1 10 6786 1 1 17 LYS CG C 6.027 3.754 -10.063 1.00 . A A . 21 LYS CG 1 1 10 6787 1 1 17 LYS H H 3.760 3.465 -8.814 1.00 . A A . 21 LYS H 1 1 10 6788 1 1 17 LYS HA H 5.835 3.128 -6.691 1.00 . A A . 21 LYS HA 1 1 10 6789 1 1 17 LYS HB2 H 7.490 3.444 -8.524 1.00 . A A . 21 LYS HB2 1 1 10 6790 1 1 17 LYS HB3 H 6.446 2.054 -8.821 1.00 . A A . 21 LYS HB3 1 1 10 6791 1 1 17 LYS HD2 H 7.009 4.163 -11.929 1.00 . A A . 21 LYS HD2 1 1 10 6792 1 1 17 LYS HD3 H 8.021 3.339 -10.743 1.00 . A A . 21 LYS HD3 1 1 10 6793 1 1 17 LYS HE2 H 7.464 1.346 -11.665 1.00 . A A . 21 LYS HE2 1 1 10 6794 1 1 17 LYS HE3 H 5.752 1.666 -11.326 1.00 . A A . 21 LYS HE3 1 1 10 6795 1 1 17 LYS HG2 H 5.053 3.371 -10.327 1.00 . A A . 21 LYS HG2 1 1 10 6796 1 1 17 LYS HG3 H 5.974 4.828 -9.957 1.00 . A A . 21 LYS HG3 1 1 10 6797 1 1 17 LYS HZ1 H 6.468 1.456 -13.768 1.00 . A A . 21 LYS HZ1 1 1 10 6798 1 1 17 LYS HZ2 H 7.153 2.998 -13.567 1.00 . A A . 21 LYS HZ2 1 1 10 6799 1 1 17 LYS HZ3 H 5.484 2.772 -13.345 1.00 . A A . 21 LYS HZ3 1 1 10 6800 1 1 17 LYS N N 4.195 3.118 -8.007 1.00 . A A . 21 LYS N 1 1 10 6801 1 1 17 LYS NZ N 6.422 2.341 -13.224 1.00 . A A . 21 LYS NZ 1 1 10 6802 1 1 17 LYS O O 5.026 5.837 -8.263 1.00 . A A . 21 LYS O 1 1 10 6803 1 1 18 THR C C 7.732 7.479 -5.951 1.00 . A A . 22 THR C 1 1 10 6804 1 1 18 THR CA C 6.290 7.046 -6.212 1.00 . A A . 22 THR CA 1 1 10 6805 1 1 18 THR CB C 5.436 7.287 -4.971 1.00 . A A . 22 THR CB 1 1 10 6806 1 1 18 THR CG2 C 6.019 6.494 -3.797 1.00 . A A . 22 THR CG2 1 1 10 6807 1 1 18 THR H H 6.661 4.960 -5.805 1.00 . A A . 22 THR H 1 1 10 6808 1 1 18 THR HA H 5.879 7.578 -7.055 1.00 . A A . 22 THR HA 1 1 10 6809 1 1 18 THR HB H 4.425 6.961 -5.159 1.00 . A A . 22 THR HB 1 1 10 6810 1 1 18 THR HG1 H 5.165 9.155 -5.444 1.00 . A A . 22 THR HG1 1 1 10 6811 1 1 18 THR HG21 H 7.032 6.819 -3.615 1.00 . A A . 22 THR HG21 1 1 10 6812 1 1 18 THR HG22 H 6.018 5.442 -4.034 1.00 . A A . 22 THR HG22 1 1 10 6813 1 1 18 THR HG23 H 5.423 6.664 -2.910 1.00 . A A . 22 THR HG23 1 1 10 6814 1 1 18 THR N N 6.224 5.576 -6.437 1.00 . A A . 22 THR N 1 1 10 6815 1 1 18 THR O O 8.668 6.765 -6.240 1.00 . A A . 22 THR O 1 1 10 6816 1 1 18 THR OG1 O 5.442 8.674 -4.660 1.00 . A A . 22 THR OG1 1 1 10 6817 1 1 19 SER C C 10.224 8.938 -6.286 1.00 . A A . 23 SER C 1 1 10 6818 1 1 19 SER CA C 9.277 9.160 -5.092 1.00 . A A . 23 SER CA 1 1 10 6819 1 1 19 SER CB C 9.733 8.364 -3.867 1.00 . A A . 23 SER CB 1 1 10 6820 1 1 19 SER H H 7.119 9.192 -5.170 1.00 . A A . 23 SER H 1 1 10 6821 1 1 19 SER HA H 9.233 10.208 -4.845 1.00 . A A . 23 SER HA 1 1 10 6822 1 1 19 SER HB2 H 9.115 8.619 -3.021 1.00 . A A . 23 SER HB2 1 1 10 6823 1 1 19 SER HB3 H 9.645 7.307 -4.071 1.00 . A A . 23 SER HB3 1 1 10 6824 1 1 19 SER HG H 11.630 7.935 -3.847 1.00 . A A . 23 SER HG 1 1 10 6825 1 1 19 SER N N 7.903 8.648 -5.395 1.00 . A A . 23 SER N 1 1 10 6826 1 1 19 SER O O 10.316 9.766 -7.170 1.00 . A A . 23 SER O 1 1 10 6827 1 1 19 SER OG O 11.087 8.679 -3.577 1.00 . A A . 23 SER OG 1 1 10 6828 1 1 20 SER C C 12.064 6.080 -7.651 1.00 . A A . 24 SER C 1 1 10 6829 1 1 20 SER CA C 11.857 7.583 -7.462 1.00 . A A . 24 SER CA 1 1 10 6830 1 1 20 SER CB C 13.169 8.261 -7.066 1.00 . A A . 24 SER CB 1 1 10 6831 1 1 20 SER H H 10.847 7.173 -5.608 1.00 . A A . 24 SER H 1 1 10 6832 1 1 20 SER HA H 11.472 8.020 -8.362 1.00 . A A . 24 SER HA 1 1 10 6833 1 1 20 SER HB2 H 13.307 8.182 -5.999 1.00 . A A . 24 SER HB2 1 1 10 6834 1 1 20 SER HB3 H 13.991 7.778 -7.572 1.00 . A A . 24 SER HB3 1 1 10 6835 1 1 20 SER HG H 13.505 9.713 -8.315 1.00 . A A . 24 SER HG 1 1 10 6836 1 1 20 SER N N 10.929 7.835 -6.322 1.00 . A A . 24 SER N 1 1 10 6837 1 1 20 SER O O 12.078 5.576 -8.758 1.00 . A A . 24 SER O 1 1 10 6838 1 1 20 SER OG O 13.123 9.631 -7.438 1.00 . A A . 24 SER OG 1 1 10 6839 1 1 21 GLY C C 11.786 3.207 -5.468 1.00 . A A . 25 GLY C 1 1 10 6840 1 1 21 GLY CA C 12.425 3.893 -6.677 1.00 . A A . 25 GLY CA 1 1 10 6841 1 1 21 GLY H H 12.201 5.800 -5.704 1.00 . A A . 25 GLY H 1 1 10 6842 1 1 21 GLY HA2 H 11.966 3.527 -7.585 1.00 . A A . 25 GLY HA2 1 1 10 6843 1 1 21 GLY HA3 H 13.483 3.678 -6.699 1.00 . A A . 25 GLY HA3 1 1 10 6844 1 1 21 GLY N N 12.220 5.367 -6.578 1.00 . A A . 25 GLY N 1 1 10 6845 1 1 21 GLY O O 12.458 2.581 -4.672 1.00 . A A . 25 GLY O 1 1 10 6846 1 1 22 GLN C C 8.339 2.419 -4.493 1.00 . A A . 26 GLN C 1 1 10 6847 1 1 22 GLN CA C 9.812 2.673 -4.165 1.00 . A A . 26 GLN CA 1 1 10 6848 1 1 22 GLN CB C 9.943 3.678 -3.021 1.00 . A A . 26 GLN CB 1 1 10 6849 1 1 22 GLN CD C 10.733 3.554 -0.653 1.00 . A A . 26 GLN CD 1 1 10 6850 1 1 22 GLN CG C 9.775 2.953 -1.683 1.00 . A A . 26 GLN CG 1 1 10 6851 1 1 22 GLN H H 9.971 3.828 -5.979 1.00 . A A . 26 GLN H 1 1 10 6852 1 1 22 GLN HA H 10.306 1.750 -3.905 1.00 . A A . 26 GLN HA 1 1 10 6853 1 1 22 GLN HB2 H 10.917 4.141 -3.057 1.00 . A A . 26 GLN HB2 1 1 10 6854 1 1 22 GLN HB3 H 9.180 4.437 -3.118 1.00 . A A . 26 GLN HB3 1 1 10 6855 1 1 22 GLN HE21 H 12.276 2.447 -1.234 1.00 . A A . 26 GLN HE21 1 1 10 6856 1 1 22 GLN HE22 H 12.591 3.517 0.047 1.00 . A A . 26 GLN HE22 1 1 10 6857 1 1 22 GLN HG2 H 8.758 3.067 -1.338 1.00 . A A . 26 GLN HG2 1 1 10 6858 1 1 22 GLN HG3 H 9.997 1.904 -1.813 1.00 . A A . 26 GLN HG3 1 1 10 6859 1 1 22 GLN N N 10.494 3.319 -5.325 1.00 . A A . 26 GLN N 1 1 10 6860 1 1 22 GLN NE2 N 11.969 3.138 -0.609 1.00 . A A . 26 GLN NE2 1 1 10 6861 1 1 22 GLN O O 7.642 3.296 -4.980 1.00 . A A . 26 GLN O 1 1 10 6862 1 1 22 GLN OE1 O 10.352 4.410 0.120 1.00 . A A . 26 GLN OE1 1 1 10 6863 1 1 23 ARG C C 5.527 1.452 -3.424 1.00 . A A . 27 ARG C 1 1 10 6864 1 1 23 ARG CA C 6.425 0.941 -4.536 1.00 . A A . 27 ARG CA 1 1 10 6865 1 1 23 ARG CB C 6.294 -0.579 -4.623 1.00 . A A . 27 ARG CB 1 1 10 6866 1 1 23 ARG CD C 7.449 -1.082 -6.780 1.00 . A A . 27 ARG CD 1 1 10 6867 1 1 23 ARG CG C 6.089 -0.970 -6.086 1.00 . A A . 27 ARG CG 1 1 10 6868 1 1 23 ARG CZ C 8.042 -1.891 -9.006 1.00 . A A . 27 ARG CZ 1 1 10 6869 1 1 23 ARG H H 8.427 0.541 -3.842 1.00 . A A . 27 ARG H 1 1 10 6870 1 1 23 ARG HA H 6.143 1.387 -5.476 1.00 . A A . 27 ARG HA 1 1 10 6871 1 1 23 ARG HB2 H 7.180 -1.050 -4.235 1.00 . A A . 27 ARG HB2 1 1 10 6872 1 1 23 ARG HB3 H 5.435 -0.901 -4.045 1.00 . A A . 27 ARG HB3 1 1 10 6873 1 1 23 ARG HD2 H 7.820 -0.101 -7.039 1.00 . A A . 27 ARG HD2 1 1 10 6874 1 1 23 ARG HD3 H 8.155 -1.596 -6.144 1.00 . A A . 27 ARG HD3 1 1 10 6875 1 1 23 ARG HE H 6.356 -2.401 -8.084 1.00 . A A . 27 ARG HE 1 1 10 6876 1 1 23 ARG HG2 H 5.577 -1.918 -6.139 1.00 . A A . 27 ARG HG2 1 1 10 6877 1 1 23 ARG HG3 H 5.495 -0.208 -6.574 1.00 . A A . 27 ARG HG3 1 1 10 6878 1 1 23 ARG HH11 H 9.370 -0.658 -8.135 1.00 . A A . 27 ARG HH11 1 1 10 6879 1 1 23 ARG HH12 H 9.799 -1.228 -9.711 1.00 . A A . 27 ARG HH12 1 1 10 6880 1 1 23 ARG HH21 H 6.936 -3.127 -10.127 1.00 . A A . 27 ARG HH21 1 1 10 6881 1 1 23 ARG HH22 H 8.432 -2.615 -10.832 1.00 . A A . 27 ARG HH22 1 1 10 6882 1 1 23 ARG N N 7.854 1.233 -4.233 1.00 . A A . 27 ARG N 1 1 10 6883 1 1 23 ARG NE N 7.183 -1.880 -8.013 1.00 . A A . 27 ARG NE 1 1 10 6884 1 1 23 ARG NH1 N 9.157 -1.204 -8.944 1.00 . A A . 27 ARG NH1 1 1 10 6885 1 1 23 ARG NH2 N 7.783 -2.600 -10.071 1.00 . A A . 27 ARG NH2 1 1 10 6886 1 1 23 ARG O O 5.644 1.053 -2.281 1.00 . A A . 27 ARG O 1 1 10 6887 1 1 24 TYR C C 2.312 2.156 -2.970 1.00 . A A . 28 TYR C 1 1 10 6888 1 1 24 TYR CA C 3.666 2.789 -2.720 1.00 . A A . 28 TYR CA 1 1 10 6889 1 1 24 TYR CB C 3.621 4.324 -2.849 1.00 . A A . 28 TYR CB 1 1 10 6890 1 1 24 TYR CD1 C 3.432 4.713 -5.332 1.00 . A A . 28 TYR CD1 1 1 10 6891 1 1 24 TYR CD2 C 1.491 5.136 -3.944 1.00 . A A . 28 TYR CD2 1 1 10 6892 1 1 24 TYR CE1 C 2.702 5.088 -6.463 1.00 . A A . 28 TYR CE1 1 1 10 6893 1 1 24 TYR CE2 C 0.765 5.511 -5.078 1.00 . A A . 28 TYR CE2 1 1 10 6894 1 1 24 TYR CG C 2.830 4.737 -4.073 1.00 . A A . 28 TYR CG 1 1 10 6895 1 1 24 TYR CZ C 1.374 5.484 -6.338 1.00 . A A . 28 TYR CZ 1 1 10 6896 1 1 24 TYR H H 4.504 2.575 -4.692 1.00 . A A . 28 TYR H 1 1 10 6897 1 1 24 TYR HA H 4.017 2.508 -1.738 1.00 . A A . 28 TYR HA 1 1 10 6898 1 1 24 TYR HB2 H 3.156 4.740 -1.969 1.00 . A A . 28 TYR HB2 1 1 10 6899 1 1 24 TYR HB3 H 4.627 4.701 -2.931 1.00 . A A . 28 TYR HB3 1 1 10 6900 1 1 24 TYR HD1 H 4.459 4.409 -5.429 1.00 . A A . 28 TYR HD1 1 1 10 6901 1 1 24 TYR HD2 H 1.021 5.159 -2.969 1.00 . A A . 28 TYR HD2 1 1 10 6902 1 1 24 TYR HE1 H 3.160 5.070 -7.435 1.00 . A A . 28 TYR HE1 1 1 10 6903 1 1 24 TYR HE2 H -0.264 5.815 -4.982 1.00 . A A . 28 TYR HE2 1 1 10 6904 1 1 24 TYR HH H 0.788 6.796 -7.590 1.00 . A A . 28 TYR HH 1 1 10 6905 1 1 24 TYR N N 4.603 2.297 -3.755 1.00 . A A . 28 TYR N 1 1 10 6906 1 1 24 TYR O O 2.150 1.346 -3.863 1.00 . A A . 28 TYR O 1 1 10 6907 1 1 24 TYR OH O 0.672 5.851 -7.462 1.00 . A A . 28 TYR OH 1 1 10 6908 1 1 25 PHE C C -1.017 2.998 -2.444 1.00 . A A . 29 PHE C 1 1 10 6909 1 1 25 PHE CA C 0.022 1.899 -2.369 1.00 . A A . 29 PHE CA 1 1 10 6910 1 1 25 PHE CB C -0.121 0.962 -1.173 1.00 . A A . 29 PHE CB 1 1 10 6911 1 1 25 PHE CD1 C 2.250 0.076 -0.949 1.00 . A A . 29 PHE CD1 1 1 10 6912 1 1 25 PHE CD2 C 0.571 -1.285 -2.043 1.00 . A A . 29 PHE CD2 1 1 10 6913 1 1 25 PHE CE1 C 3.210 -0.914 -1.200 1.00 . A A . 29 PHE CE1 1 1 10 6914 1 1 25 PHE CE2 C 1.530 -2.269 -2.297 1.00 . A A . 29 PHE CE2 1 1 10 6915 1 1 25 PHE CG C 0.922 -0.116 -1.371 1.00 . A A . 29 PHE CG 1 1 10 6916 1 1 25 PHE CZ C 2.848 -2.085 -1.876 1.00 . A A . 29 PHE CZ 1 1 10 6917 1 1 25 PHE H H 1.509 3.142 -1.466 1.00 . A A . 29 PHE H 1 1 10 6918 1 1 25 PHE HA H 0.003 1.326 -3.279 1.00 . A A . 29 PHE HA 1 1 10 6919 1 1 25 PHE HB2 H 0.052 1.495 -0.248 1.00 . A A . 29 PHE HB2 1 1 10 6920 1 1 25 PHE HB3 H -1.105 0.521 -1.166 1.00 . A A . 29 PHE HB3 1 1 10 6921 1 1 25 PHE HD1 H 2.533 0.984 -0.427 1.00 . A A . 29 PHE HD1 1 1 10 6922 1 1 25 PHE HD2 H -0.444 -1.426 -2.365 1.00 . A A . 29 PHE HD2 1 1 10 6923 1 1 25 PHE HE1 H 4.229 -0.770 -0.881 1.00 . A A . 29 PHE HE1 1 1 10 6924 1 1 25 PHE HE2 H 1.250 -3.172 -2.826 1.00 . A A . 29 PHE HE2 1 1 10 6925 1 1 25 PHE HZ H 3.589 -2.844 -2.081 1.00 . A A . 29 PHE HZ 1 1 10 6926 1 1 25 PHE N N 1.353 2.497 -2.186 1.00 . A A . 29 PHE N 1 1 10 6927 1 1 25 PHE O O -1.555 3.460 -1.455 1.00 . A A . 29 PHE O 1 1 10 6928 1 1 26 LEU C C -3.582 4.141 -3.264 1.00 . A A . 30 LEU C 1 1 10 6929 1 1 26 LEU CA C -2.237 4.520 -3.885 1.00 . A A . 30 LEU CA 1 1 10 6930 1 1 26 LEU CB C -2.306 4.621 -5.422 1.00 . A A . 30 LEU CB 1 1 10 6931 1 1 26 LEU CD1 C -2.458 7.159 -4.932 1.00 . A A . 30 LEU CD1 1 1 10 6932 1 1 26 LEU CD2 C -1.896 6.330 -7.210 1.00 . A A . 30 LEU CD2 1 1 10 6933 1 1 26 LEU CG C -2.696 6.029 -5.948 1.00 . A A . 30 LEU CG 1 1 10 6934 1 1 26 LEU H H -0.788 3.033 -4.411 1.00 . A A . 30 LEU H 1 1 10 6935 1 1 26 LEU HA H -1.866 5.433 -3.459 1.00 . A A . 30 LEU HA 1 1 10 6936 1 1 26 LEU HB2 H -1.339 4.359 -5.828 1.00 . A A . 30 LEU HB2 1 1 10 6937 1 1 26 LEU HB3 H -3.034 3.907 -5.781 1.00 . A A . 30 LEU HB3 1 1 10 6938 1 1 26 LEU HD11 H -2.941 6.915 -4.000 1.00 . A A . 30 LEU HD11 1 1 10 6939 1 1 26 LEU HD12 H -2.870 8.078 -5.319 1.00 . A A . 30 LEU HD12 1 1 10 6940 1 1 26 LEU HD13 H -1.400 7.285 -4.771 1.00 . A A . 30 LEU HD13 1 1 10 6941 1 1 26 LEU HD21 H -2.547 6.759 -7.957 1.00 . A A . 30 LEU HD21 1 1 10 6942 1 1 26 LEU HD22 H -1.466 5.414 -7.590 1.00 . A A . 30 LEU HD22 1 1 10 6943 1 1 26 LEU HD23 H -1.106 7.028 -6.977 1.00 . A A . 30 LEU HD23 1 1 10 6944 1 1 26 LEU HG H -3.722 6.014 -6.206 1.00 . A A . 30 LEU HG 1 1 10 6945 1 1 26 LEU N N -1.266 3.430 -3.649 1.00 . A A . 30 LEU N 1 1 10 6946 1 1 26 LEU O O -4.350 3.377 -3.818 1.00 . A A . 30 LEU O 1 1 10 6947 1 1 27 ASN C C -6.283 5.122 -2.035 1.00 . A A . 31 ASN C 1 1 10 6948 1 1 27 ASN CA C -5.120 4.358 -1.392 1.00 . A A . 31 ASN CA 1 1 10 6949 1 1 27 ASN CB C -4.864 4.838 0.043 1.00 . A A . 31 ASN CB 1 1 10 6950 1 1 27 ASN CG C -6.159 4.827 0.853 1.00 . A A . 31 ASN CG 1 1 10 6951 1 1 27 ASN H H -3.195 5.264 -1.682 1.00 . A A . 31 ASN H 1 1 10 6952 1 1 27 ASN HA H -5.311 3.297 -1.399 1.00 . A A . 31 ASN HA 1 1 10 6953 1 1 27 ASN HB2 H -4.151 4.183 0.518 1.00 . A A . 31 ASN HB2 1 1 10 6954 1 1 27 ASN HB3 H -4.467 5.843 0.019 1.00 . A A . 31 ASN HB3 1 1 10 6955 1 1 27 ASN HD21 H -5.391 3.713 2.303 1.00 . A A . 31 ASN HD21 1 1 10 6956 1 1 27 ASN HD22 H -7.010 4.164 2.512 1.00 . A A . 31 ASN HD22 1 1 10 6957 1 1 27 ASN N N -3.848 4.666 -2.101 1.00 . A A . 31 ASN N 1 1 10 6958 1 1 27 ASN ND2 N -6.191 4.181 1.983 1.00 . A A . 31 ASN ND2 1 1 10 6959 1 1 27 ASN O O -6.437 6.311 -1.841 1.00 . A A . 31 ASN O 1 1 10 6960 1 1 27 ASN OD1 O -7.142 5.419 0.463 1.00 . A A . 31 ASN OD1 1 1 10 6961 1 1 28 HIS C C -9.413 5.250 -2.429 1.00 . A A . 32 HIS C 1 1 10 6962 1 1 28 HIS CA C -8.261 5.136 -3.429 1.00 . A A . 32 HIS CA 1 1 10 6963 1 1 28 HIS CB C -8.656 4.244 -4.607 1.00 . A A . 32 HIS CB 1 1 10 6964 1 1 28 HIS CD2 C -7.959 5.105 -6.990 1.00 . A A . 32 HIS CD2 1 1 10 6965 1 1 28 HIS CE1 C -9.515 6.588 -7.256 1.00 . A A . 32 HIS CE1 1 1 10 6966 1 1 28 HIS CG C -8.735 5.075 -5.859 1.00 . A A . 32 HIS CG 1 1 10 6967 1 1 28 HIS H H -6.969 3.486 -2.926 1.00 . A A . 32 HIS H 1 1 10 6968 1 1 28 HIS HA H -7.972 6.108 -3.779 1.00 . A A . 32 HIS HA 1 1 10 6969 1 1 28 HIS HB2 H -7.914 3.469 -4.736 1.00 . A A . 32 HIS HB2 1 1 10 6970 1 1 28 HIS HB3 H -9.617 3.793 -4.411 1.00 . A A . 32 HIS HB3 1 1 10 6971 1 1 28 HIS HD1 H -10.440 6.254 -5.422 1.00 . A A . 32 HIS HD1 1 1 10 6972 1 1 28 HIS HD2 H -7.095 4.481 -7.170 1.00 . A A . 32 HIS HD2 1 1 10 6973 1 1 28 HIS HE1 H -10.133 7.369 -7.676 1.00 . A A . 32 HIS HE1 1 1 10 6974 1 1 28 HIS N N -7.106 4.446 -2.788 1.00 . A A . 32 HIS N 1 1 10 6975 1 1 28 HIS ND1 N -9.723 6.029 -6.050 1.00 . A A . 32 HIS ND1 1 1 10 6976 1 1 28 HIS NE2 N -8.453 6.062 -7.872 1.00 . A A . 32 HIS NE2 1 1 10 6977 1 1 28 HIS O O -10.201 6.172 -2.471 1.00 . A A . 32 HIS O 1 1 10 6978 1 1 29 ILE C C -10.641 5.718 0.174 1.00 . A A . 33 ILE C 1 1 10 6979 1 1 29 ILE CA C -10.599 4.351 -0.514 1.00 . A A . 33 ILE CA 1 1 10 6980 1 1 29 ILE CB C -10.255 3.245 0.493 1.00 . A A . 33 ILE CB 1 1 10 6981 1 1 29 ILE CD1 C -8.504 2.306 2.017 1.00 . A A . 33 ILE CD1 1 1 10 6982 1 1 29 ILE CG1 C -8.834 3.437 1.040 1.00 . A A . 33 ILE CG1 1 1 10 6983 1 1 29 ILE CG2 C -10.358 1.885 -0.197 1.00 . A A . 33 ILE CG2 1 1 10 6984 1 1 29 ILE H H -8.854 3.584 -1.524 1.00 . A A . 33 ILE H 1 1 10 6985 1 1 29 ILE HA H -11.548 4.137 -0.980 1.00 . A A . 33 ILE HA 1 1 10 6986 1 1 29 ILE HB H -10.955 3.285 1.309 1.00 . A A . 33 ILE HB 1 1 10 6987 1 1 29 ILE HD11 H -9.011 2.481 2.955 1.00 . A A . 33 ILE HD11 1 1 10 6988 1 1 29 ILE HD12 H -7.437 2.275 2.186 1.00 . A A . 33 ILE HD12 1 1 10 6989 1 1 29 ILE HD13 H -8.830 1.364 1.603 1.00 . A A . 33 ILE HD13 1 1 10 6990 1 1 29 ILE HG12 H -8.123 3.429 0.227 1.00 . A A . 33 ILE HG12 1 1 10 6991 1 1 29 ILE HG13 H -8.775 4.381 1.560 1.00 . A A . 33 ILE HG13 1 1 10 6992 1 1 29 ILE HG21 H -10.472 1.111 0.547 1.00 . A A . 33 ILE HG21 1 1 10 6993 1 1 29 ILE HG22 H -9.460 1.703 -0.770 1.00 . A A . 33 ILE HG22 1 1 10 6994 1 1 29 ILE HG23 H -11.213 1.879 -0.858 1.00 . A A . 33 ILE HG23 1 1 10 6995 1 1 29 ILE N N -9.505 4.313 -1.530 1.00 . A A . 33 ILE N 1 1 10 6996 1 1 29 ILE O O -11.696 6.275 0.411 1.00 . A A . 33 ILE O 1 1 10 6997 1 1 30 ASP C C -8.568 8.563 0.368 1.00 . A A . 34 ASP C 1 1 10 6998 1 1 30 ASP CA C -9.459 7.594 1.157 1.00 . A A . 34 ASP CA 1 1 10 6999 1 1 30 ASP CB C -8.865 7.325 2.539 1.00 . A A . 34 ASP CB 1 1 10 7000 1 1 30 ASP CG C -9.938 7.536 3.608 1.00 . A A . 34 ASP CG 1 1 10 7001 1 1 30 ASP H H -8.671 5.790 0.284 1.00 . A A . 34 ASP H 1 1 10 7002 1 1 30 ASP HA H -10.456 7.997 1.258 1.00 . A A . 34 ASP HA 1 1 10 7003 1 1 30 ASP HB2 H -8.507 6.306 2.584 1.00 . A A . 34 ASP HB2 1 1 10 7004 1 1 30 ASP HB3 H -8.042 8.002 2.716 1.00 . A A . 34 ASP HB3 1 1 10 7005 1 1 30 ASP N N -9.502 6.261 0.488 1.00 . A A . 34 ASP N 1 1 10 7006 1 1 30 ASP O O -8.160 9.592 0.870 1.00 . A A . 34 ASP O 1 1 10 7007 1 1 30 ASP OD1 O -10.103 8.666 4.039 1.00 . A A . 34 ASP OD1 1 1 10 7008 1 1 30 ASP OD2 O -10.580 6.565 3.976 1.00 . A A . 34 ASP OD2 1 1 10 7009 1 1 31 GLN C C -6.085 9.451 -0.971 1.00 . A A . 35 GLN C 1 1 10 7010 1 1 31 GLN CA C -7.407 9.150 -1.687 1.00 . A A . 35 GLN CA 1 1 10 7011 1 1 31 GLN CB C -8.226 10.430 -1.856 1.00 . A A . 35 GLN CB 1 1 10 7012 1 1 31 GLN CD C -8.792 11.209 -4.161 1.00 . A A . 35 GLN CD 1 1 10 7013 1 1 31 GLN CG C -9.195 10.264 -3.029 1.00 . A A . 35 GLN CG 1 1 10 7014 1 1 31 GLN H H -8.608 7.415 -1.252 1.00 . A A . 35 GLN H 1 1 10 7015 1 1 31 GLN HA H -7.217 8.709 -2.652 1.00 . A A . 35 GLN HA 1 1 10 7016 1 1 31 GLN HB2 H -8.785 10.622 -0.953 1.00 . A A . 35 GLN HB2 1 1 10 7017 1 1 31 GLN HB3 H -7.563 11.259 -2.052 1.00 . A A . 35 GLN HB3 1 1 10 7018 1 1 31 GLN HE21 H -10.621 11.948 -4.388 1.00 . A A . 35 GLN HE21 1 1 10 7019 1 1 31 GLN HE22 H -9.446 12.589 -5.432 1.00 . A A . 35 GLN HE22 1 1 10 7020 1 1 31 GLN HG2 H -9.160 9.243 -3.383 1.00 . A A . 35 GLN HG2 1 1 10 7021 1 1 31 GLN HG3 H -10.198 10.499 -2.704 1.00 . A A . 35 GLN HG3 1 1 10 7022 1 1 31 GLN N N -8.266 8.246 -0.864 1.00 . A A . 35 GLN N 1 1 10 7023 1 1 31 GLN NE2 N -9.695 11.979 -4.705 1.00 . A A . 35 GLN NE2 1 1 10 7024 1 1 31 GLN O O -5.893 10.517 -0.422 1.00 . A A . 35 GLN O 1 1 10 7025 1 1 31 GLN OE1 O -7.644 11.250 -4.556 1.00 . A A . 35 GLN OE1 1 1 10 7026 1 1 32 THR C C -2.803 7.790 -0.891 1.00 . A A . 36 THR C 1 1 10 7027 1 1 32 THR CA C -3.849 8.751 -0.317 1.00 . A A . 36 THR CA 1 1 10 7028 1 1 32 THR CB C -4.082 8.454 1.168 1.00 . A A . 36 THR CB 1 1 10 7029 1 1 32 THR CG2 C -3.128 9.297 2.013 1.00 . A A . 36 THR CG2 1 1 10 7030 1 1 32 THR H H -5.340 7.672 -1.442 1.00 . A A . 36 THR H 1 1 10 7031 1 1 32 THR HA H -3.534 9.774 -0.446 1.00 . A A . 36 THR HA 1 1 10 7032 1 1 32 THR HB H -3.895 7.409 1.358 1.00 . A A . 36 THR HB 1 1 10 7033 1 1 32 THR HG1 H -5.518 9.722 1.506 1.00 . A A . 36 THR HG1 1 1 10 7034 1 1 32 THR HG21 H -2.896 10.213 1.490 1.00 . A A . 36 THR HG21 1 1 10 7035 1 1 32 THR HG22 H -2.216 8.743 2.187 1.00 . A A . 36 THR HG22 1 1 10 7036 1 1 32 THR HG23 H -3.593 9.531 2.959 1.00 . A A . 36 THR HG23 1 1 10 7037 1 1 32 THR N N -5.166 8.521 -0.985 1.00 . A A . 36 THR N 1 1 10 7038 1 1 32 THR O O -3.069 7.063 -1.825 1.00 . A A . 36 THR O 1 1 10 7039 1 1 32 THR OG1 O -5.425 8.767 1.515 1.00 . A A . 36 THR OG1 1 1 10 7040 1 1 33 THR C C 0.191 6.214 0.314 1.00 . A A . 37 THR C 1 1 10 7041 1 1 33 THR CA C -0.569 6.845 -0.854 1.00 . A A . 37 THR CA 1 1 10 7042 1 1 33 THR CB C 0.377 7.705 -1.697 1.00 . A A . 37 THR CB 1 1 10 7043 1 1 33 THR CG2 C -0.394 8.353 -2.848 1.00 . A A . 37 THR CG2 1 1 10 7044 1 1 33 THR H H -1.424 8.364 0.419 1.00 . A A . 37 THR H 1 1 10 7045 1 1 33 THR HA H -1.015 6.078 -1.470 1.00 . A A . 37 THR HA 1 1 10 7046 1 1 33 THR HB H 1.163 7.083 -2.103 1.00 . A A . 37 THR HB 1 1 10 7047 1 1 33 THR HG1 H 1.425 8.288 -0.167 1.00 . A A . 37 THR HG1 1 1 10 7048 1 1 33 THR HG21 H -1.389 7.939 -2.892 1.00 . A A . 37 THR HG21 1 1 10 7049 1 1 33 THR HG22 H 0.119 8.156 -3.779 1.00 . A A . 37 THR HG22 1 1 10 7050 1 1 33 THR HG23 H -0.454 9.419 -2.687 1.00 . A A . 37 THR HG23 1 1 10 7051 1 1 33 THR N N -1.619 7.774 -0.339 1.00 . A A . 37 THR N 1 1 10 7052 1 1 33 THR O O 1.069 6.820 0.895 1.00 . A A . 37 THR O 1 1 10 7053 1 1 33 THR OG1 O 0.945 8.717 -0.879 1.00 . A A . 37 THR OG1 1 1 10 7054 1 1 34 THR C C 1.791 3.576 1.224 1.00 . A A . 38 THR C 1 1 10 7055 1 1 34 THR CA C 0.575 4.327 1.783 1.00 . A A . 38 THR CA 1 1 10 7056 1 1 34 THR CB C -0.492 3.380 2.384 1.00 . A A . 38 THR CB 1 1 10 7057 1 1 34 THR CG2 C 0.111 2.038 2.837 1.00 . A A . 38 THR CG2 1 1 10 7058 1 1 34 THR H H -0.844 4.526 0.169 1.00 . A A . 38 THR H 1 1 10 7059 1 1 34 THR HA H 0.886 5.051 2.521 1.00 . A A . 38 THR HA 1 1 10 7060 1 1 34 THR HB H -1.249 3.191 1.639 1.00 . A A . 38 THR HB 1 1 10 7061 1 1 34 THR HG1 H -1.973 4.303 3.242 1.00 . A A . 38 THR HG1 1 1 10 7062 1 1 34 THR HG21 H 0.194 1.376 1.986 1.00 . A A . 38 THR HG21 1 1 10 7063 1 1 34 THR HG22 H -0.526 1.588 3.582 1.00 . A A . 38 THR HG22 1 1 10 7064 1 1 34 THR HG23 H 1.092 2.207 3.256 1.00 . A A . 38 THR HG23 1 1 10 7065 1 1 34 THR N N -0.134 5.000 0.657 1.00 . A A . 38 THR N 1 1 10 7066 1 1 34 THR O O 1.677 2.833 0.280 1.00 . A A . 38 THR O 1 1 10 7067 1 1 34 THR OG1 O -1.095 4.015 3.502 1.00 . A A . 38 THR OG1 1 1 10 7068 1 1 35 TRP C C 4.071 1.555 1.680 1.00 . A A . 39 TRP C 1 1 10 7069 1 1 35 TRP CA C 4.143 3.028 1.275 1.00 . A A . 39 TRP CA 1 1 10 7070 1 1 35 TRP CB C 5.361 3.693 1.926 1.00 . A A . 39 TRP CB 1 1 10 7071 1 1 35 TRP CD1 C 4.701 6.081 2.456 1.00 . A A . 39 TRP CD1 1 1 10 7072 1 1 35 TRP CD2 C 6.057 5.941 0.664 1.00 . A A . 39 TRP CD2 1 1 10 7073 1 1 35 TRP CE2 C 5.777 7.314 0.861 1.00 . A A . 39 TRP CE2 1 1 10 7074 1 1 35 TRP CE3 C 6.896 5.587 -0.410 1.00 . A A . 39 TRP CE3 1 1 10 7075 1 1 35 TRP CG C 5.359 5.175 1.693 1.00 . A A . 39 TRP CG 1 1 10 7076 1 1 35 TRP CH2 C 7.142 7.926 -1.030 1.00 . A A . 39 TRP CH2 1 1 10 7077 1 1 35 TRP CZ2 C 6.310 8.296 0.028 1.00 . A A . 39 TRP CZ2 1 1 10 7078 1 1 35 TRP CZ3 C 7.434 6.575 -1.248 1.00 . A A . 39 TRP CZ3 1 1 10 7079 1 1 35 TRP H H 3.027 4.352 2.570 1.00 . A A . 39 TRP H 1 1 10 7080 1 1 35 TRP HA H 4.195 3.118 0.200 1.00 . A A . 39 TRP HA 1 1 10 7081 1 1 35 TRP HB2 H 5.343 3.500 2.988 1.00 . A A . 39 TRP HB2 1 1 10 7082 1 1 35 TRP HB3 H 6.260 3.269 1.504 1.00 . A A . 39 TRP HB3 1 1 10 7083 1 1 35 TRP HD1 H 4.082 5.851 3.309 1.00 . A A . 39 TRP HD1 1 1 10 7084 1 1 35 TRP HE1 H 4.588 8.181 2.330 1.00 . A A . 39 TRP HE1 1 1 10 7085 1 1 35 TRP HE3 H 7.124 4.551 -0.598 1.00 . A A . 39 TRP HE3 1 1 10 7086 1 1 35 TRP HH2 H 7.561 8.681 -1.678 1.00 . A A . 39 TRP HH2 1 1 10 7087 1 1 35 TRP HZ2 H 6.082 9.336 0.203 1.00 . A A . 39 TRP HZ2 1 1 10 7088 1 1 35 TRP HZ3 H 8.078 6.291 -2.066 1.00 . A A . 39 TRP HZ3 1 1 10 7089 1 1 35 TRP N N 2.948 3.754 1.799 1.00 . A A . 39 TRP N 1 1 10 7090 1 1 35 TRP NE1 N 4.948 7.348 1.960 1.00 . A A . 39 TRP NE1 1 1 10 7091 1 1 35 TRP O O 4.263 0.668 0.871 1.00 . A A . 39 TRP O 1 1 10 7092 1 1 36 GLN C C 3.267 -0.188 4.848 1.00 . A A . 40 GLN C 1 1 10 7093 1 1 36 GLN CA C 3.715 -0.131 3.385 1.00 . A A . 40 GLN CA 1 1 10 7094 1 1 36 GLN CB C 5.134 -0.680 3.237 1.00 . A A . 40 GLN CB 1 1 10 7095 1 1 36 GLN CD C 6.062 -2.972 2.885 1.00 . A A . 40 GLN CD 1 1 10 7096 1 1 36 GLN CG C 5.111 -1.912 2.328 1.00 . A A . 40 GLN CG 1 1 10 7097 1 1 36 GLN H H 3.647 2.015 3.564 1.00 . A A . 40 GLN H 1 1 10 7098 1 1 36 GLN HA H 3.035 -0.691 2.761 1.00 . A A . 40 GLN HA 1 1 10 7099 1 1 36 GLN HB2 H 5.768 0.077 2.802 1.00 . A A . 40 GLN HB2 1 1 10 7100 1 1 36 GLN HB3 H 5.516 -0.956 4.208 1.00 . A A . 40 GLN HB3 1 1 10 7101 1 1 36 GLN HE21 H 7.438 -1.652 3.438 1.00 . A A . 40 GLN HE21 1 1 10 7102 1 1 36 GLN HE22 H 7.816 -3.275 3.765 1.00 . A A . 40 GLN HE22 1 1 10 7103 1 1 36 GLN HG2 H 4.109 -2.311 2.289 1.00 . A A . 40 GLN HG2 1 1 10 7104 1 1 36 GLN HG3 H 5.427 -1.631 1.335 1.00 . A A . 40 GLN HG3 1 1 10 7105 1 1 36 GLN N N 3.798 1.285 2.927 1.00 . A A . 40 GLN N 1 1 10 7106 1 1 36 GLN NE2 N 7.200 -2.603 3.406 1.00 . A A . 40 GLN NE2 1 1 10 7107 1 1 36 GLN O O 3.791 0.508 5.696 1.00 . A A . 40 GLN O 1 1 10 7108 1 1 36 GLN OE1 O 5.768 -4.150 2.845 1.00 . A A . 40 GLN OE1 1 1 10 7109 1 1 37 ASP C C 0.729 -2.196 6.668 1.00 . A A . 41 ASP C 1 1 10 7110 1 1 37 ASP CA C 1.822 -1.124 6.561 1.00 . A A . 41 ASP CA 1 1 10 7111 1 1 37 ASP CB C 1.264 0.259 6.912 1.00 . A A . 41 ASP CB 1 1 10 7112 1 1 37 ASP CG C 2.210 0.958 7.892 1.00 . A A . 41 ASP CG 1 1 10 7113 1 1 37 ASP H H 1.900 -1.571 4.453 1.00 . A A . 41 ASP H 1 1 10 7114 1 1 37 ASP HA H 2.644 -1.364 7.219 1.00 . A A . 41 ASP HA 1 1 10 7115 1 1 37 ASP HB2 H 1.177 0.851 6.012 1.00 . A A . 41 ASP HB2 1 1 10 7116 1 1 37 ASP HB3 H 0.291 0.150 7.368 1.00 . A A . 41 ASP HB3 1 1 10 7117 1 1 37 ASP N N 2.304 -1.016 5.152 1.00 . A A . 41 ASP N 1 1 10 7118 1 1 37 ASP O O 0.883 -3.157 7.394 1.00 . A A . 41 ASP O 1 1 10 7119 1 1 37 ASP OD1 O 2.311 0.498 9.016 1.00 . A A . 41 ASP OD1 1 1 10 7120 1 1 37 ASP OD2 O 2.817 1.941 7.499 1.00 . A A . 41 ASP OD2 1 1 10 7121 1 1 38 PRO C C -1.057 -4.264 5.222 1.00 . A A . 42 PRO C 1 1 10 7122 1 1 38 PRO CA C -1.457 -2.988 5.968 1.00 . A A . 42 PRO CA 1 1 10 7123 1 1 38 PRO CB C -2.595 -2.273 5.246 1.00 . A A . 42 PRO CB 1 1 10 7124 1 1 38 PRO CD C -0.633 -0.882 5.033 1.00 . A A . 42 PRO CD 1 1 10 7125 1 1 38 PRO CG C -1.922 -1.277 4.357 1.00 . A A . 42 PRO CG 1 1 10 7126 1 1 38 PRO HA H -1.744 -3.212 6.983 1.00 . A A . 42 PRO HA 1 1 10 7127 1 1 38 PRO HB2 H -3.167 -2.975 4.659 1.00 . A A . 42 PRO HB2 1 1 10 7128 1 1 38 PRO HB3 H -3.234 -1.769 5.958 1.00 . A A . 42 PRO HB3 1 1 10 7129 1 1 38 PRO HD2 H 0.155 -0.770 4.302 1.00 . A A . 42 PRO HD2 1 1 10 7130 1 1 38 PRO HD3 H -0.766 0.032 5.591 1.00 . A A . 42 PRO HD3 1 1 10 7131 1 1 38 PRO HG2 H -1.713 -1.723 3.396 1.00 . A A . 42 PRO HG2 1 1 10 7132 1 1 38 PRO HG3 H -2.553 -0.410 4.231 1.00 . A A . 42 PRO HG3 1 1 10 7133 1 1 38 PRO N N -0.348 -2.005 5.938 1.00 . A A . 42 PRO N 1 1 10 7134 1 1 38 PRO O O -1.065 -4.312 4.008 1.00 . A A . 42 PRO O 1 1 10 7135 1 1 39 ARG C C 0.809 -6.292 4.248 1.00 . A A . 43 ARG C 1 1 10 7136 1 1 39 ARG CA C -0.299 -6.566 5.267 1.00 . A A . 43 ARG CA 1 1 10 7137 1 1 39 ARG CB C -1.564 -7.065 4.564 1.00 . A A . 43 ARG CB 1 1 10 7138 1 1 39 ARG CD C -3.548 -8.218 5.550 1.00 . A A . 43 ARG CD 1 1 10 7139 1 1 39 ARG CG C -2.055 -8.343 5.246 1.00 . A A . 43 ARG CG 1 1 10 7140 1 1 39 ARG CZ C -4.184 -10.423 4.714 1.00 . A A . 43 ARG CZ 1 1 10 7141 1 1 39 ARG H H -0.702 -5.238 6.915 1.00 . A A . 43 ARG H 1 1 10 7142 1 1 39 ARG HA H 0.028 -7.290 5.995 1.00 . A A . 43 ARG HA 1 1 10 7143 1 1 39 ARG HB2 H -2.331 -6.307 4.624 1.00 . A A . 43 ARG HB2 1 1 10 7144 1 1 39 ARG HB3 H -1.341 -7.272 3.527 1.00 . A A . 43 ARG HB3 1 1 10 7145 1 1 39 ARG HD2 H -3.700 -7.646 6.453 1.00 . A A . 43 ARG HD2 1 1 10 7146 1 1 39 ARG HD3 H -4.064 -7.758 4.720 1.00 . A A . 43 ARG HD3 1 1 10 7147 1 1 39 ARG HE H -4.207 -9.951 6.645 1.00 . A A . 43 ARG HE 1 1 10 7148 1 1 39 ARG HG2 H -1.890 -9.188 4.590 1.00 . A A . 43 ARG HG2 1 1 10 7149 1 1 39 ARG HG3 H -1.509 -8.493 6.166 1.00 . A A . 43 ARG HG3 1 1 10 7150 1 1 39 ARG HH11 H -3.626 -9.082 3.324 1.00 . A A . 43 ARG HH11 1 1 10 7151 1 1 39 ARG HH12 H -4.075 -10.641 2.724 1.00 . A A . 43 ARG HH12 1 1 10 7152 1 1 39 ARG HH21 H -4.784 -11.965 5.841 1.00 . A A . 43 ARG HH21 1 1 10 7153 1 1 39 ARG HH22 H -4.726 -12.262 4.135 1.00 . A A . 43 ARG HH22 1 1 10 7154 1 1 39 ARG N N -0.704 -5.297 5.938 1.00 . A A . 43 ARG N 1 1 10 7155 1 1 39 ARG NE N -4.019 -9.621 5.741 1.00 . A A . 43 ARG NE 1 1 10 7156 1 1 39 ARG NH1 N -3.941 -10.014 3.493 1.00 . A A . 43 ARG NH1 1 1 10 7157 1 1 39 ARG NH2 N -4.597 -11.645 4.913 1.00 . A A . 43 ARG NH2 1 1 10 7158 1 1 39 ARG O O 0.552 -5.942 3.114 1.00 . A A . 43 ARG O 1 1 10 7159 1 1 40 LYS C C 2.963 -6.982 2.401 1.00 . A A . 44 LYS C 1 1 10 7160 1 1 40 LYS CA C 3.171 -6.195 3.698 1.00 . A A . 44 LYS CA 1 1 10 7161 1 1 40 LYS CB C 4.420 -6.690 4.429 1.00 . A A . 44 LYS CB 1 1 10 7162 1 1 40 LYS CD C 5.966 -6.256 6.342 1.00 . A A . 44 LYS CD 1 1 10 7163 1 1 40 LYS CE C 5.754 -6.354 7.854 1.00 . A A . 44 LYS CE 1 1 10 7164 1 1 40 LYS CG C 4.658 -5.829 5.671 1.00 . A A . 44 LYS CG 1 1 10 7165 1 1 40 LYS H H 2.231 -6.732 5.563 1.00 . A A . 44 LYS H 1 1 10 7166 1 1 40 LYS HA H 3.260 -5.141 3.490 1.00 . A A . 44 LYS HA 1 1 10 7167 1 1 40 LYS HB2 H 4.279 -7.720 4.726 1.00 . A A . 44 LYS HB2 1 1 10 7168 1 1 40 LYS HB3 H 5.273 -6.618 3.771 1.00 . A A . 44 LYS HB3 1 1 10 7169 1 1 40 LYS HD2 H 6.271 -7.218 5.959 1.00 . A A . 44 LYS HD2 1 1 10 7170 1 1 40 LYS HD3 H 6.734 -5.524 6.133 1.00 . A A . 44 LYS HD3 1 1 10 7171 1 1 40 LYS HE2 H 5.718 -5.367 8.294 1.00 . A A . 44 LYS HE2 1 1 10 7172 1 1 40 LYS HE3 H 4.847 -6.897 8.073 1.00 . A A . 44 LYS HE3 1 1 10 7173 1 1 40 LYS HG2 H 4.725 -4.790 5.382 1.00 . A A . 44 LYS HG2 1 1 10 7174 1 1 40 LYS HG3 H 3.840 -5.959 6.363 1.00 . A A . 44 LYS HG3 1 1 10 7175 1 1 40 LYS HZ1 H 6.819 -8.117 8.162 1.00 . A A . 44 LYS HZ1 1 1 10 7176 1 1 40 LYS HZ2 H 7.033 -6.955 9.384 1.00 . A A . 44 LYS HZ2 1 1 10 7177 1 1 40 LYS HZ3 H 7.795 -6.760 7.877 1.00 . A A . 44 LYS HZ3 1 1 10 7178 1 1 40 LYS N N 2.045 -6.448 4.644 1.00 . A A . 44 LYS N 1 1 10 7179 1 1 40 LYS NZ N 6.940 -7.103 8.357 1.00 . A A . 44 LYS NZ 1 1 10 7180 1 1 40 LYS O O 3.765 -6.816 1.496 1.00 . A A . 44 LYS O 1 1 10 7181 1 1 40 LYS OXT O 2.007 -7.736 2.335 1.00 . A A . 44 LYS OXT 1 1 10 7182 2 2 1 ACE C C 7.006 13.064 3.684 1.00 . B B . 45 ACE C 1 1 10 7183 2 2 1 ACE CH3 C 7.816 14.361 3.742 1.00 . B B . 45 ACE CH3 1 1 10 7184 2 2 1 ACE H1 H 8.548 14.293 4.533 1.00 . B B . 45 ACE H1 1 1 10 7185 2 2 1 ACE H2 H 7.154 15.191 3.935 1.00 . B B . 45 ACE H2 1 1 10 7186 2 2 1 ACE H3 H 8.319 14.514 2.798 1.00 . B B . 45 ACE H3 1 1 10 7187 2 2 1 ACE O O 5.964 12.956 4.299 1.00 . B B . 45 ACE O 1 1 10 7188 2 2 2 PRO C C 6.384 11.700 0.776 1.00 . B B . 46 PRO C 1 1 10 7189 2 2 2 PRO CA C 7.598 12.325 1.469 1.00 . B B . 46 PRO CA 1 1 10 7190 2 2 2 PRO CB C 8.881 11.604 1.067 1.00 . B B . 46 PRO CB 1 1 10 7191 2 2 2 PRO CD C 8.498 11.126 3.396 1.00 . B B . 46 PRO CD 1 1 10 7192 2 2 2 PRO CG C 9.091 10.575 2.127 1.00 . B B . 46 PRO CG 1 1 10 7193 2 2 2 PRO HA H 7.674 13.375 1.234 1.00 . B B . 46 PRO HA 1 1 10 7194 2 2 2 PRO HB2 H 8.758 11.134 0.101 1.00 . B B . 46 PRO HB2 1 1 10 7195 2 2 2 PRO HB3 H 9.711 12.292 1.050 1.00 . B B . 46 PRO HB3 1 1 10 7196 2 2 2 PRO HD2 H 8.009 10.340 3.955 1.00 . B B . 46 PRO HD2 1 1 10 7197 2 2 2 PRO HD3 H 9.258 11.601 3.995 1.00 . B B . 46 PRO HD3 1 1 10 7198 2 2 2 PRO HG2 H 8.592 9.655 1.851 1.00 . B B . 46 PRO HG2 1 1 10 7199 2 2 2 PRO HG3 H 10.145 10.397 2.267 1.00 . B B . 46 PRO HG3 1 1 10 7200 2 2 2 PRO N N 7.517 12.122 2.940 1.00 . B B . 46 PRO N 1 1 10 7201 2 2 2 PRO O O 6.413 11.410 -0.404 1.00 . B B . 46 PRO O 1 1 10 7202 2 2 3 LEU C C 3.711 11.654 -0.392 1.00 . B B . 47 LEU C 1 1 10 7203 2 2 3 LEU CA C 4.102 10.884 0.882 1.00 . B B . 47 LEU CA 1 1 10 7204 2 2 3 LEU CB C 3.012 11.020 1.946 1.00 . B B . 47 LEU CB 1 1 10 7205 2 2 3 LEU CD1 C 1.292 9.215 2.082 1.00 . B B . 47 LEU CD1 1 1 10 7206 2 2 3 LEU CD2 C 0.598 11.571 1.619 1.00 . B B . 47 LEU CD2 1 1 10 7207 2 2 3 LEU CG C 1.682 10.518 1.381 1.00 . B B . 47 LEU CG 1 1 10 7208 2 2 3 LEU H H 5.315 11.733 2.449 1.00 . B B . 47 LEU H 1 1 10 7209 2 2 3 LEU HA H 4.273 9.844 0.665 1.00 . B B . 47 LEU HA 1 1 10 7210 2 2 3 LEU HB2 H 3.280 10.433 2.812 1.00 . B B . 47 LEU HB2 1 1 10 7211 2 2 3 LEU HB3 H 2.914 12.058 2.229 1.00 . B B . 47 LEU HB3 1 1 10 7212 2 2 3 LEU HD11 H 2.065 8.478 1.928 1.00 . B B . 47 LEU HD11 1 1 10 7213 2 2 3 LEU HD12 H 0.360 8.852 1.671 1.00 . B B . 47 LEU HD12 1 1 10 7214 2 2 3 LEU HD13 H 1.173 9.397 3.140 1.00 . B B . 47 LEU HD13 1 1 10 7215 2 2 3 LEU HD21 H 1.051 12.549 1.668 1.00 . B B . 47 LEU HD21 1 1 10 7216 2 2 3 LEU HD22 H 0.090 11.362 2.549 1.00 . B B . 47 LEU HD22 1 1 10 7217 2 2 3 LEU HD23 H -0.113 11.544 0.807 1.00 . B B . 47 LEU HD23 1 1 10 7218 2 2 3 LEU HG H 1.784 10.340 0.320 1.00 . B B . 47 LEU HG 1 1 10 7219 2 2 3 LEU N N 5.317 11.491 1.499 1.00 . B B . 47 LEU N 1 1 10 7220 2 2 3 LEU O O 3.575 12.861 -0.360 1.00 . B B . 47 LEU O 1 1 10 7221 2 2 4 PRO C C 1.724 12.108 -2.694 1.00 . B B . 48 PRO C 1 1 10 7222 2 2 4 PRO CA C 3.166 11.584 -2.761 1.00 . B B . 48 PRO CA 1 1 10 7223 2 2 4 PRO CB C 3.289 10.456 -3.784 1.00 . B B . 48 PRO CB 1 1 10 7224 2 2 4 PRO CD C 3.682 9.479 -1.624 1.00 . B B . 48 PRO CD 1 1 10 7225 2 2 4 PRO CG C 3.112 9.203 -2.990 1.00 . B B . 48 PRO CG 1 1 10 7226 2 2 4 PRO HA H 3.854 12.377 -3.001 1.00 . B B . 48 PRO HA 1 1 10 7227 2 2 4 PRO HB2 H 2.512 10.538 -4.531 1.00 . B B . 48 PRO HB2 1 1 10 7228 2 2 4 PRO HB3 H 4.263 10.474 -4.249 1.00 . B B . 48 PRO HB3 1 1 10 7229 2 2 4 PRO HD2 H 3.114 8.965 -0.864 1.00 . B B . 48 PRO HD2 1 1 10 7230 2 2 4 PRO HD3 H 4.722 9.191 -1.583 1.00 . B B . 48 PRO HD3 1 1 10 7231 2 2 4 PRO HG2 H 2.064 8.962 -2.911 1.00 . B B . 48 PRO HG2 1 1 10 7232 2 2 4 PRO HG3 H 3.646 8.389 -3.457 1.00 . B B . 48 PRO HG3 1 1 10 7233 2 2 4 PRO N N 3.543 10.936 -1.479 1.00 . B B . 48 PRO N 1 1 10 7234 2 2 4 PRO O O 0.854 11.442 -2.164 1.00 . B B . 48 PRO O 1 1 10 7235 2 2 5 PRO C C -0.756 13.163 -4.222 1.00 . B B . 49 PRO C 1 1 10 7236 2 2 5 PRO CA C 0.152 13.882 -3.221 1.00 . B B . 49 PRO CA 1 1 10 7237 2 2 5 PRO CB C 0.390 15.328 -3.647 1.00 . B B . 49 PRO CB 1 1 10 7238 2 2 5 PRO CD C 2.491 14.161 -3.892 1.00 . B B . 49 PRO CD 1 1 10 7239 2 2 5 PRO CG C 1.661 15.295 -4.435 1.00 . B B . 49 PRO CG 1 1 10 7240 2 2 5 PRO HA H -0.270 13.854 -2.229 1.00 . B B . 49 PRO HA 1 1 10 7241 2 2 5 PRO HB2 H -0.425 15.677 -4.264 1.00 . B B . 49 PRO HB2 1 1 10 7242 2 2 5 PRO HB3 H 0.503 15.961 -2.780 1.00 . B B . 49 PRO HB3 1 1 10 7243 2 2 5 PRO HD2 H 2.987 13.636 -4.695 1.00 . B B . 49 PRO HD2 1 1 10 7244 2 2 5 PRO HD3 H 3.212 14.529 -3.175 1.00 . B B . 49 PRO HD3 1 1 10 7245 2 2 5 PRO HG2 H 1.444 15.123 -5.479 1.00 . B B . 49 PRO HG2 1 1 10 7246 2 2 5 PRO HG3 H 2.191 16.228 -4.318 1.00 . B B . 49 PRO HG3 1 1 10 7247 2 2 5 PRO N N 1.510 13.285 -3.232 1.00 . B B . 49 PRO N 1 1 10 7248 2 2 5 PRO O O -0.332 12.778 -5.294 1.00 . B B . 49 PRO O 1 1 10 7249 2 2 6 TYR C C -3.553 13.292 -5.789 1.00 . B B . 50 TYR C 1 1 10 7250 2 2 6 TYR CA C -2.935 12.285 -4.815 1.00 . B B . 50 TYR CA 1 1 10 7251 2 2 6 TYR CB C -4.012 11.675 -3.917 1.00 . B B . 50 TYR CB 1 1 10 7252 2 2 6 TYR CD1 C -5.169 10.603 -5.884 1.00 . B B . 50 TYR CD1 1 1 10 7253 2 2 6 TYR CD2 C -4.631 9.232 -3.957 1.00 . B B . 50 TYR CD2 1 1 10 7254 2 2 6 TYR CE1 C -5.733 9.489 -6.517 1.00 . B B . 50 TYR CE1 1 1 10 7255 2 2 6 TYR CE2 C -5.196 8.119 -4.591 1.00 . B B . 50 TYR CE2 1 1 10 7256 2 2 6 TYR CG C -4.619 10.474 -4.602 1.00 . B B . 50 TYR CG 1 1 10 7257 2 2 6 TYR CZ C -5.746 8.247 -5.872 1.00 . B B . 50 TYR CZ 1 1 10 7258 2 2 6 TYR H H -2.324 13.297 -3.013 1.00 . B B . 50 TYR H 1 1 10 7259 2 2 6 TYR HA H -2.419 11.505 -5.353 1.00 . B B . 50 TYR HA 1 1 10 7260 2 2 6 TYR HB2 H -3.570 11.371 -2.980 1.00 . B B . 50 TYR HB2 1 1 10 7261 2 2 6 TYR HB3 H -4.782 12.409 -3.729 1.00 . B B . 50 TYR HB3 1 1 10 7262 2 2 6 TYR HD1 H -5.159 11.560 -6.382 1.00 . B B . 50 TYR HD1 1 1 10 7263 2 2 6 TYR HD2 H -4.207 9.132 -2.969 1.00 . B B . 50 TYR HD2 1 1 10 7264 2 2 6 TYR HE1 H -6.158 9.588 -7.506 1.00 . B B . 50 TYR HE1 1 1 10 7265 2 2 6 TYR HE2 H -5.205 7.161 -4.093 1.00 . B B . 50 TYR HE2 1 1 10 7266 2 2 6 TYR HH H -7.077 7.444 -6.980 1.00 . B B . 50 TYR HH 1 1 10 7267 2 2 6 TYR N N -2.002 12.979 -3.882 1.00 . B B . 50 TYR N 1 1 10 7268 2 2 6 TYR O O -3.244 13.213 -6.966 1.00 . B B . 50 TYR O 1 1 10 7269 2 2 6 TYR OXT O -4.324 14.124 -5.340 1.00 . B B . 50 TYR OXT 1 1 10 7270 2 2 6 TYR OH O -6.301 7.149 -6.497 1.00 . B B . 50 TYR OH 1 1 11 7271 1 1 1 PHE C C 3.175 -12.259 14.860 1.00 . A A . 5 PHE C 1 1 11 7272 1 1 1 PHE CA C 3.554 -13.716 14.581 1.00 . A A . 5 PHE CA 1 1 11 7273 1 1 1 PHE CB C 2.328 -14.513 14.134 1.00 . A A . 5 PHE CB 1 1 11 7274 1 1 1 PHE CD1 C 3.618 -16.328 12.954 1.00 . A A . 5 PHE CD1 1 1 11 7275 1 1 1 PHE CD2 C 2.152 -16.942 14.786 1.00 . A A . 5 PHE CD2 1 1 11 7276 1 1 1 PHE CE1 C 3.971 -17.674 12.788 1.00 . A A . 5 PHE CE1 1 1 11 7277 1 1 1 PHE CE2 C 2.505 -18.286 14.620 1.00 . A A . 5 PHE CE2 1 1 11 7278 1 1 1 PHE CG C 2.708 -15.962 13.954 1.00 . A A . 5 PHE CG 1 1 11 7279 1 1 1 PHE CZ C 3.415 -18.652 13.620 1.00 . A A . 5 PHE CZ 1 1 11 7280 1 1 1 PHE HA H 4.322 -13.769 13.828 1.00 . A A . 5 PHE HA 1 1 11 7281 1 1 1 PHE HB2 H 1.554 -14.434 14.883 1.00 . A A . 5 PHE HB2 1 1 11 7282 1 1 1 PHE HB3 H 1.964 -14.118 13.197 1.00 . A A . 5 PHE HB3 1 1 11 7283 1 1 1 PHE HD1 H 4.048 -15.575 12.312 1.00 . A A . 5 PHE HD1 1 1 11 7284 1 1 1 PHE HD2 H 1.450 -16.660 15.557 1.00 . A A . 5 PHE HD2 1 1 11 7285 1 1 1 PHE HE1 H 4.673 -17.957 12.017 1.00 . A A . 5 PHE HE1 1 1 11 7286 1 1 1 PHE HE2 H 2.076 -19.040 15.262 1.00 . A A . 5 PHE HE2 1 1 11 7287 1 1 1 PHE HZ H 3.686 -19.690 13.492 1.00 . A A . 5 PHE HZ 1 1 11 7288 1 1 1 PHE N N 4.008 -14.380 15.838 1.00 . A A . 5 PHE N 1 1 11 7289 1 1 1 PHE O O 3.287 -11.780 15.971 1.00 . A A . 5 PHE O 1 1 11 7290 1 1 2 GLU C C 0.835 -9.947 13.855 1.00 . A A . 6 GLU C 1 1 11 7291 1 1 2 GLU CA C 2.340 -10.126 14.069 1.00 . A A . 6 GLU CA 1 1 11 7292 1 1 2 GLU CB C 3.128 -9.345 13.016 1.00 . A A . 6 GLU CB 1 1 11 7293 1 1 2 GLU CD C 5.588 -9.171 12.613 1.00 . A A . 6 GLU CD 1 1 11 7294 1 1 2 GLU CG C 4.463 -8.891 13.612 1.00 . A A . 6 GLU CG 1 1 11 7295 1 1 2 GLU H H 2.642 -11.956 12.972 1.00 . A A . 6 GLU H 1 1 11 7296 1 1 2 GLU HA H 2.622 -9.800 15.058 1.00 . A A . 6 GLU HA 1 1 11 7297 1 1 2 GLU HB2 H 3.313 -9.978 12.161 1.00 . A A . 6 GLU HB2 1 1 11 7298 1 1 2 GLU HB3 H 2.559 -8.480 12.708 1.00 . A A . 6 GLU HB3 1 1 11 7299 1 1 2 GLU HG2 H 4.422 -7.832 13.821 1.00 . A A . 6 GLU HG2 1 1 11 7300 1 1 2 GLU HG3 H 4.652 -9.431 14.527 1.00 . A A . 6 GLU HG3 1 1 11 7301 1 1 2 GLU N N 2.726 -11.551 13.860 1.00 . A A . 6 GLU N 1 1 11 7302 1 1 2 GLU O O 0.129 -9.459 14.714 1.00 . A A . 6 GLU O 1 1 11 7303 1 1 2 GLU OE1 O 6.071 -10.291 12.593 1.00 . A A . 6 GLU OE1 1 1 11 7304 1 1 2 GLU OE2 O 5.946 -8.260 11.884 1.00 . A A . 6 GLU OE2 1 1 11 7305 1 1 3 ILE C C -1.762 -11.570 12.236 1.00 . A A . 7 ILE C 1 1 11 7306 1 1 3 ILE CA C -1.119 -10.192 12.443 1.00 . A A . 7 ILE CA 1 1 11 7307 1 1 3 ILE CB C -1.202 -9.362 11.161 1.00 . A A . 7 ILE CB 1 1 11 7308 1 1 3 ILE CD1 C -0.428 -7.266 10.045 1.00 . A A . 7 ILE CD1 1 1 11 7309 1 1 3 ILE CG1 C -0.465 -8.036 11.365 1.00 . A A . 7 ILE CG1 1 1 11 7310 1 1 3 ILE CG2 C -2.667 -9.084 10.825 1.00 . A A . 7 ILE CG2 1 1 11 7311 1 1 3 ILE H H 0.926 -10.730 12.032 1.00 . A A . 7 ILE H 1 1 11 7312 1 1 3 ILE HA H -1.602 -9.667 13.254 1.00 . A A . 7 ILE HA 1 1 11 7313 1 1 3 ILE HB H -0.744 -9.910 10.350 1.00 . A A . 7 ILE HB 1 1 11 7314 1 1 3 ILE HD11 H 0.292 -7.722 9.381 1.00 . A A . 7 ILE HD11 1 1 11 7315 1 1 3 ILE HD12 H -0.144 -6.241 10.233 1.00 . A A . 7 ILE HD12 1 1 11 7316 1 1 3 ILE HD13 H -1.406 -7.289 9.585 1.00 . A A . 7 ILE HD13 1 1 11 7317 1 1 3 ILE HG12 H -0.980 -7.449 12.111 1.00 . A A . 7 ILE HG12 1 1 11 7318 1 1 3 ILE HG13 H 0.544 -8.232 11.697 1.00 . A A . 7 ILE HG13 1 1 11 7319 1 1 3 ILE HG21 H -3.042 -8.302 11.469 1.00 . A A . 7 ILE HG21 1 1 11 7320 1 1 3 ILE HG22 H -3.248 -9.982 10.973 1.00 . A A . 7 ILE HG22 1 1 11 7321 1 1 3 ILE HG23 H -2.747 -8.769 9.795 1.00 . A A . 7 ILE HG23 1 1 11 7322 1 1 3 ILE N N 0.340 -10.340 12.713 1.00 . A A . 7 ILE N 1 1 11 7323 1 1 3 ILE O O -1.151 -12.454 11.667 1.00 . A A . 7 ILE O 1 1 11 7324 1 1 4 PRO C C -4.090 -13.242 11.092 1.00 . A A . 8 PRO C 1 1 11 7325 1 1 4 PRO CA C -3.695 -13.004 12.556 1.00 . A A . 8 PRO CA 1 1 11 7326 1 1 4 PRO CB C -4.922 -12.842 13.452 1.00 . A A . 8 PRO CB 1 1 11 7327 1 1 4 PRO CD C -3.794 -10.707 13.403 1.00 . A A . 8 PRO CD 1 1 11 7328 1 1 4 PRO CG C -5.142 -11.364 13.548 1.00 . A A . 8 PRO CG 1 1 11 7329 1 1 4 PRO HA H -3.084 -13.816 12.918 1.00 . A A . 8 PRO HA 1 1 11 7330 1 1 4 PRO HB2 H -5.780 -13.320 13.003 1.00 . A A . 8 PRO HB2 1 1 11 7331 1 1 4 PRO HB3 H -4.730 -13.257 14.430 1.00 . A A . 8 PRO HB3 1 1 11 7332 1 1 4 PRO HD2 H -3.875 -9.807 12.811 1.00 . A A . 8 PRO HD2 1 1 11 7333 1 1 4 PRO HD3 H -3.375 -10.487 14.373 1.00 . A A . 8 PRO HD3 1 1 11 7334 1 1 4 PRO HG2 H -5.801 -11.034 12.759 1.00 . A A . 8 PRO HG2 1 1 11 7335 1 1 4 PRO HG3 H -5.569 -11.118 14.509 1.00 . A A . 8 PRO HG3 1 1 11 7336 1 1 4 PRO N N -2.980 -11.713 12.704 1.00 . A A . 8 PRO N 1 1 11 7337 1 1 4 PRO O O -3.363 -13.868 10.343 1.00 . A A . 8 PRO O 1 1 11 7338 1 1 5 ASP C C -4.534 -12.505 8.301 1.00 . A A . 9 ASP C 1 1 11 7339 1 1 5 ASP CA C -5.643 -12.960 9.253 1.00 . A A . 9 ASP CA 1 1 11 7340 1 1 5 ASP CB C -6.890 -12.091 9.078 1.00 . A A . 9 ASP CB 1 1 11 7341 1 1 5 ASP CG C -8.127 -12.987 8.990 1.00 . A A . 9 ASP CG 1 1 11 7342 1 1 5 ASP H H -5.802 -12.250 11.280 1.00 . A A . 9 ASP H 1 1 11 7343 1 1 5 ASP HA H -5.890 -13.994 9.080 1.00 . A A . 9 ASP HA 1 1 11 7344 1 1 5 ASP HB2 H -6.986 -11.425 9.923 1.00 . A A . 9 ASP HB2 1 1 11 7345 1 1 5 ASP HB3 H -6.800 -11.511 8.171 1.00 . A A . 9 ASP HB3 1 1 11 7346 1 1 5 ASP N N -5.225 -12.751 10.670 1.00 . A A . 9 ASP N 1 1 11 7347 1 1 5 ASP O O -4.325 -13.085 7.254 1.00 . A A . 9 ASP O 1 1 11 7348 1 1 5 ASP OD1 O -8.379 -13.513 7.918 1.00 . A A . 9 ASP OD1 1 1 11 7349 1 1 5 ASP OD2 O -8.803 -13.130 9.995 1.00 . A A . 9 ASP OD2 1 1 11 7350 1 1 6 ASP C C -3.247 -10.745 6.356 1.00 . A A . 10 ASP C 1 1 11 7351 1 1 6 ASP CA C -2.723 -10.982 7.776 1.00 . A A . 10 ASP CA 1 1 11 7352 1 1 6 ASP CB C -1.680 -12.100 7.785 1.00 . A A . 10 ASP CB 1 1 11 7353 1 1 6 ASP CG C -0.543 -11.748 6.824 1.00 . A A . 10 ASP CG 1 1 11 7354 1 1 6 ASP H H -4.004 -11.020 9.507 1.00 . A A . 10 ASP H 1 1 11 7355 1 1 6 ASP HA H -2.295 -10.075 8.175 1.00 . A A . 10 ASP HA 1 1 11 7356 1 1 6 ASP HB2 H -1.286 -12.215 8.783 1.00 . A A . 10 ASP HB2 1 1 11 7357 1 1 6 ASP HB3 H -2.143 -13.024 7.470 1.00 . A A . 10 ASP HB3 1 1 11 7358 1 1 6 ASP N N -3.820 -11.472 8.657 1.00 . A A . 10 ASP N 1 1 11 7359 1 1 6 ASP O O -2.808 -11.368 5.410 1.00 . A A . 10 ASP O 1 1 11 7360 1 1 6 ASP OD1 O 0.327 -10.988 7.221 1.00 . A A . 10 ASP OD1 1 1 11 7361 1 1 6 ASP OD2 O -0.559 -12.244 5.710 1.00 . A A . 10 ASP OD2 1 1 11 7362 1 1 7 VAL C C -3.957 -8.426 4.179 1.00 . A A . 11 VAL C 1 1 11 7363 1 1 7 VAL CA C -4.733 -9.574 4.842 1.00 . A A . 11 VAL CA 1 1 11 7364 1 1 7 VAL CB C -6.189 -9.171 5.077 1.00 . A A . 11 VAL CB 1 1 11 7365 1 1 7 VAL CG1 C -6.884 -8.965 3.732 1.00 . A A . 11 VAL CG1 1 1 11 7366 1 1 7 VAL CG2 C -6.904 -10.276 5.858 1.00 . A A . 11 VAL CG2 1 1 11 7367 1 1 7 VAL H H -4.523 -9.357 6.975 1.00 . A A . 11 VAL H 1 1 11 7368 1 1 7 VAL HA H -4.690 -10.461 4.231 1.00 . A A . 11 VAL HA 1 1 11 7369 1 1 7 VAL HB H -6.220 -8.252 5.645 1.00 . A A . 11 VAL HB 1 1 11 7370 1 1 7 VAL HG11 H -6.885 -9.893 3.180 1.00 . A A . 11 VAL HG11 1 1 11 7371 1 1 7 VAL HG12 H -6.358 -8.209 3.165 1.00 . A A . 11 VAL HG12 1 1 11 7372 1 1 7 VAL HG13 H -7.903 -8.645 3.899 1.00 . A A . 11 VAL HG13 1 1 11 7373 1 1 7 VAL HG21 H -7.921 -10.365 5.504 1.00 . A A . 11 VAL HG21 1 1 11 7374 1 1 7 VAL HG22 H -6.909 -10.030 6.909 1.00 . A A . 11 VAL HG22 1 1 11 7375 1 1 7 VAL HG23 H -6.387 -11.213 5.711 1.00 . A A . 11 VAL HG23 1 1 11 7376 1 1 7 VAL N N -4.182 -9.850 6.200 1.00 . A A . 11 VAL N 1 1 11 7377 1 1 7 VAL O O -3.565 -7.487 4.843 1.00 . A A . 11 VAL O 1 1 11 7378 1 1 8 PRO C C -3.886 -6.226 2.016 1.00 . A A . 12 PRO C 1 1 11 7379 1 1 8 PRO CA C -3.021 -7.483 2.144 1.00 . A A . 12 PRO CA 1 1 11 7380 1 1 8 PRO CB C -2.768 -8.118 0.779 1.00 . A A . 12 PRO CB 1 1 11 7381 1 1 8 PRO CD C -4.192 -9.629 2.004 1.00 . A A . 12 PRO CD 1 1 11 7382 1 1 8 PRO CG C -3.853 -9.132 0.624 1.00 . A A . 12 PRO CG 1 1 11 7383 1 1 8 PRO HA H -2.084 -7.257 2.628 1.00 . A A . 12 PRO HA 1 1 11 7384 1 1 8 PRO HB2 H -2.836 -7.381 -0.003 1.00 . A A . 12 PRO HB2 1 1 11 7385 1 1 8 PRO HB3 H -1.802 -8.599 0.762 1.00 . A A . 12 PRO HB3 1 1 11 7386 1 1 8 PRO HD2 H -5.255 -9.792 2.097 1.00 . A A . 12 PRO HD2 1 1 11 7387 1 1 8 PRO HD3 H -3.648 -10.535 2.227 1.00 . A A . 12 PRO HD3 1 1 11 7388 1 1 8 PRO HG2 H -4.720 -8.673 0.173 1.00 . A A . 12 PRO HG2 1 1 11 7389 1 1 8 PRO HG3 H -3.506 -9.949 0.010 1.00 . A A . 12 PRO HG3 1 1 11 7390 1 1 8 PRO N N -3.759 -8.535 2.887 1.00 . A A . 12 PRO N 1 1 11 7391 1 1 8 PRO O O -4.819 -6.024 2.768 1.00 . A A . 12 PRO O 1 1 11 7392 1 1 9 LEU C C -5.840 -4.502 0.510 1.00 . A A . 13 LEU C 1 1 11 7393 1 1 9 LEU CA C -4.399 -4.138 0.897 1.00 . A A . 13 LEU CA 1 1 11 7394 1 1 9 LEU CB C -3.710 -3.372 -0.235 1.00 . A A . 13 LEU CB 1 1 11 7395 1 1 9 LEU CD1 C -1.352 -4.037 -0.742 1.00 . A A . 13 LEU CD1 1 1 11 7396 1 1 9 LEU CD2 C -1.875 -1.676 -0.122 1.00 . A A . 13 LEU CD2 1 1 11 7397 1 1 9 LEU CG C -2.240 -3.142 0.125 1.00 . A A . 13 LEU CG 1 1 11 7398 1 1 9 LEU H H -2.835 -5.557 0.472 1.00 . A A . 13 LEU H 1 1 11 7399 1 1 9 LEU HA H -4.383 -3.552 1.802 1.00 . A A . 13 LEU HA 1 1 11 7400 1 1 9 LEU HB2 H -3.771 -3.947 -1.147 1.00 . A A . 13 LEU HB2 1 1 11 7401 1 1 9 LEU HB3 H -4.200 -2.420 -0.375 1.00 . A A . 13 LEU HB3 1 1 11 7402 1 1 9 LEU HD11 H -0.873 -3.440 -1.503 1.00 . A A . 13 LEU HD11 1 1 11 7403 1 1 9 LEU HD12 H -1.958 -4.798 -1.211 1.00 . A A . 13 LEU HD12 1 1 11 7404 1 1 9 LEU HD13 H -0.600 -4.506 -0.125 1.00 . A A . 13 LEU HD13 1 1 11 7405 1 1 9 LEU HD21 H -2.111 -1.412 -1.142 1.00 . A A . 13 LEU HD21 1 1 11 7406 1 1 9 LEU HD22 H -0.819 -1.532 0.054 1.00 . A A . 13 LEU HD22 1 1 11 7407 1 1 9 LEU HD23 H -2.440 -1.046 0.551 1.00 . A A . 13 LEU HD23 1 1 11 7408 1 1 9 LEU HG H -2.083 -3.380 1.167 1.00 . A A . 13 LEU HG 1 1 11 7409 1 1 9 LEU N N -3.588 -5.379 1.069 1.00 . A A . 13 LEU N 1 1 11 7410 1 1 9 LEU O O -6.053 -5.397 -0.285 1.00 . A A . 13 LEU O 1 1 11 7411 1 1 10 PRO C C -8.578 -3.573 -0.621 1.00 . A A . 14 PRO C 1 1 11 7412 1 1 10 PRO CA C -8.217 -4.073 0.782 1.00 . A A . 14 PRO CA 1 1 11 7413 1 1 10 PRO CB C -8.969 -3.290 1.853 1.00 . A A . 14 PRO CB 1 1 11 7414 1 1 10 PRO CD C -6.632 -2.702 2.050 1.00 . A A . 14 PRO CD 1 1 11 7415 1 1 10 PRO CG C -8.036 -2.195 2.265 1.00 . A A . 14 PRO CG 1 1 11 7416 1 1 10 PRO HA H -8.431 -5.125 0.878 1.00 . A A . 14 PRO HA 1 1 11 7417 1 1 10 PRO HB2 H -9.878 -2.873 1.446 1.00 . A A . 14 PRO HB2 1 1 11 7418 1 1 10 PRO HB3 H -9.191 -3.927 2.697 1.00 . A A . 14 PRO HB3 1 1 11 7419 1 1 10 PRO HD2 H -6.006 -1.923 1.639 1.00 . A A . 14 PRO HD2 1 1 11 7420 1 1 10 PRO HD3 H -6.218 -3.070 2.976 1.00 . A A . 14 PRO HD3 1 1 11 7421 1 1 10 PRO HG2 H -8.208 -1.319 1.657 1.00 . A A . 14 PRO HG2 1 1 11 7422 1 1 10 PRO HG3 H -8.185 -1.955 3.307 1.00 . A A . 14 PRO HG3 1 1 11 7423 1 1 10 PRO N N -6.789 -3.799 1.083 1.00 . A A . 14 PRO N 1 1 11 7424 1 1 10 PRO O O -7.719 -3.333 -1.445 1.00 . A A . 14 PRO O 1 1 11 7425 1 1 11 ALA C C -9.974 -1.447 -2.404 1.00 . A A . 15 ALA C 1 1 11 7426 1 1 11 ALA CA C -10.260 -2.944 -2.251 1.00 . A A . 15 ALA CA 1 1 11 7427 1 1 11 ALA CB C -11.765 -3.210 -2.318 1.00 . A A . 15 ALA CB 1 1 11 7428 1 1 11 ALA H H -10.523 -3.626 -0.223 1.00 . A A . 15 ALA H 1 1 11 7429 1 1 11 ALA HA H -9.754 -3.504 -3.021 1.00 . A A . 15 ALA HA 1 1 11 7430 1 1 11 ALA HB1 H -12.039 -3.924 -1.556 1.00 . A A . 15 ALA HB1 1 1 11 7431 1 1 11 ALA HB2 H -12.017 -3.606 -3.289 1.00 . A A . 15 ALA HB2 1 1 11 7432 1 1 11 ALA HB3 H -12.301 -2.286 -2.155 1.00 . A A . 15 ALA HB3 1 1 11 7433 1 1 11 ALA N N -9.845 -3.421 -0.900 1.00 . A A . 15 ALA N 1 1 11 7434 1 1 11 ALA O O -9.589 -0.779 -1.465 1.00 . A A . 15 ALA O 1 1 11 7435 1 1 12 GLY C C -8.413 0.839 -3.572 1.00 . A A . 16 GLY C 1 1 11 7436 1 1 12 GLY CA C -9.899 0.535 -3.802 1.00 . A A . 16 GLY CA 1 1 11 7437 1 1 12 GLY H H -10.471 -1.474 -4.326 1.00 . A A . 16 GLY H 1 1 11 7438 1 1 12 GLY HA2 H -10.166 0.798 -4.814 1.00 . A A . 16 GLY HA2 1 1 11 7439 1 1 12 GLY HA3 H -10.494 1.115 -3.112 1.00 . A A . 16 GLY HA3 1 1 11 7440 1 1 12 GLY N N -10.160 -0.916 -3.582 1.00 . A A . 16 GLY N 1 1 11 7441 1 1 12 GLY O O -8.023 1.981 -3.428 1.00 . A A . 16 GLY O 1 1 11 7442 1 1 13 TRP C C -5.326 -0.233 -4.569 1.00 . A A . 17 TRP C 1 1 11 7443 1 1 13 TRP CA C -6.128 0.075 -3.305 1.00 . A A . 17 TRP CA 1 1 11 7444 1 1 13 TRP CB C -5.752 -0.893 -2.190 1.00 . A A . 17 TRP CB 1 1 11 7445 1 1 13 TRP CD1 C -6.877 -0.202 -0.040 1.00 . A A . 17 TRP CD1 1 1 11 7446 1 1 13 TRP CD2 C -4.817 0.664 -0.268 1.00 . A A . 17 TRP CD2 1 1 11 7447 1 1 13 TRP CE2 C -5.314 1.131 0.970 1.00 . A A . 17 TRP CE2 1 1 11 7448 1 1 13 TRP CE3 C -3.532 1.062 -0.662 1.00 . A A . 17 TRP CE3 1 1 11 7449 1 1 13 TRP CG C -5.822 -0.181 -0.884 1.00 . A A . 17 TRP CG 1 1 11 7450 1 1 13 TRP CH2 C -3.278 2.355 1.379 1.00 . A A . 17 TRP CH2 1 1 11 7451 1 1 13 TRP CZ2 C -4.556 1.968 1.789 1.00 . A A . 17 TRP CZ2 1 1 11 7452 1 1 13 TRP CZ3 C -2.769 1.902 0.157 1.00 . A A . 17 TRP CZ3 1 1 11 7453 1 1 13 TRP H H -7.910 -1.082 -3.643 1.00 . A A . 17 TRP H 1 1 11 7454 1 1 13 TRP HA H -5.959 1.089 -2.984 1.00 . A A . 17 TRP HA 1 1 11 7455 1 1 13 TRP HB2 H -6.441 -1.724 -2.185 1.00 . A A . 17 TRP HB2 1 1 11 7456 1 1 13 TRP HB3 H -4.748 -1.257 -2.349 1.00 . A A . 17 TRP HB3 1 1 11 7457 1 1 13 TRP HD1 H -7.800 -0.739 -0.204 1.00 . A A . 17 TRP HD1 1 1 11 7458 1 1 13 TRP HE1 H -7.172 0.726 1.829 1.00 . A A . 17 TRP HE1 1 1 11 7459 1 1 13 TRP HE3 H -3.128 0.719 -1.604 1.00 . A A . 17 TRP HE3 1 1 11 7460 1 1 13 TRP HH2 H -2.678 3.002 2.003 1.00 . A A . 17 TRP HH2 1 1 11 7461 1 1 13 TRP HZ2 H -4.955 2.314 2.733 1.00 . A A . 17 TRP HZ2 1 1 11 7462 1 1 13 TRP HZ3 H -1.787 2.204 -0.158 1.00 . A A . 17 TRP HZ3 1 1 11 7463 1 1 13 TRP N N -7.582 -0.167 -3.532 1.00 . A A . 17 TRP N 1 1 11 7464 1 1 13 TRP NE1 N -6.577 0.575 1.064 1.00 . A A . 17 TRP NE1 1 1 11 7465 1 1 13 TRP O O -5.657 -1.128 -5.321 1.00 . A A . 17 TRP O 1 1 11 7466 1 1 14 GLU C C -1.961 0.244 -5.723 1.00 . A A . 18 GLU C 1 1 11 7467 1 1 14 GLU CA C -3.459 0.231 -6.035 1.00 . A A . 18 GLU CA 1 1 11 7468 1 1 14 GLU CB C -3.791 1.370 -6.998 1.00 . A A . 18 GLU CB 1 1 11 7469 1 1 14 GLU CD C -6.120 1.042 -7.842 1.00 . A A . 18 GLU CD 1 1 11 7470 1 1 14 GLU CG C -4.637 0.835 -8.154 1.00 . A A . 18 GLU CG 1 1 11 7471 1 1 14 GLU H H -4.015 1.221 -4.198 1.00 . A A . 18 GLU H 1 1 11 7472 1 1 14 GLU HA H -3.743 -0.711 -6.476 1.00 . A A . 18 GLU HA 1 1 11 7473 1 1 14 GLU HB2 H -4.337 2.139 -6.475 1.00 . A A . 18 GLU HB2 1 1 11 7474 1 1 14 GLU HB3 H -2.874 1.787 -7.388 1.00 . A A . 18 GLU HB3 1 1 11 7475 1 1 14 GLU HG2 H -4.381 1.364 -9.060 1.00 . A A . 18 GLU HG2 1 1 11 7476 1 1 14 GLU HG3 H -4.439 -0.219 -8.285 1.00 . A A . 18 GLU HG3 1 1 11 7477 1 1 14 GLU N N -4.270 0.498 -4.813 1.00 . A A . 18 GLU N 1 1 11 7478 1 1 14 GLU O O -1.331 1.287 -5.729 1.00 . A A . 18 GLU O 1 1 11 7479 1 1 14 GLU OE1 O -6.559 0.571 -6.805 1.00 . A A . 18 GLU OE1 1 1 11 7480 1 1 14 GLU OE2 O -6.792 1.670 -8.644 1.00 . A A . 18 GLU OE2 1 1 11 7481 1 1 15 MET C C 0.810 -0.498 -6.495 1.00 . A A . 19 MET C 1 1 11 7482 1 1 15 MET CA C 0.091 -0.914 -5.219 1.00 . A A . 19 MET CA 1 1 11 7483 1 1 15 MET CB C 0.462 -2.350 -4.849 1.00 . A A . 19 MET CB 1 1 11 7484 1 1 15 MET CE C -1.763 -4.282 -4.145 1.00 . A A . 19 MET CE 1 1 11 7485 1 1 15 MET CG C 0.027 -3.318 -5.957 1.00 . A A . 19 MET CG 1 1 11 7486 1 1 15 MET H H -1.876 -1.734 -5.497 1.00 . A A . 19 MET H 1 1 11 7487 1 1 15 MET HA H 0.336 -0.244 -4.409 1.00 . A A . 19 MET HA 1 1 11 7488 1 1 15 MET HB2 H 1.526 -2.409 -4.734 1.00 . A A . 19 MET HB2 1 1 11 7489 1 1 15 MET HB3 H -0.007 -2.621 -3.917 1.00 . A A . 19 MET HB3 1 1 11 7490 1 1 15 MET HE1 H -2.705 -4.730 -4.432 1.00 . A A . 19 MET HE1 1 1 11 7491 1 1 15 MET HE2 H -1.833 -3.211 -4.240 1.00 . A A . 19 MET HE2 1 1 11 7492 1 1 15 MET HE3 H -1.534 -4.537 -3.120 1.00 . A A . 19 MET HE3 1 1 11 7493 1 1 15 MET HG2 H -0.807 -2.904 -6.499 1.00 . A A . 19 MET HG2 1 1 11 7494 1 1 15 MET HG3 H 0.852 -3.473 -6.637 1.00 . A A . 19 MET HG3 1 1 11 7495 1 1 15 MET N N -1.370 -0.900 -5.482 1.00 . A A . 19 MET N 1 1 11 7496 1 1 15 MET O O 0.604 -1.063 -7.550 1.00 . A A . 19 MET O 1 1 11 7497 1 1 15 MET SD S -0.451 -4.905 -5.226 1.00 . A A . 19 MET SD 1 1 11 7498 1 1 16 ALA C C 3.656 1.634 -7.162 1.00 . A A . 20 ALA C 1 1 11 7499 1 1 16 ALA CA C 2.359 0.962 -7.618 1.00 . A A . 20 ALA CA 1 1 11 7500 1 1 16 ALA CB C 1.378 1.937 -8.280 1.00 . A A . 20 ALA CB 1 1 11 7501 1 1 16 ALA H H 1.782 0.936 -5.549 1.00 . A A . 20 ALA H 1 1 11 7502 1 1 16 ALA HA H 2.572 0.134 -8.278 1.00 . A A . 20 ALA HA 1 1 11 7503 1 1 16 ALA HB1 H 0.719 1.390 -8.939 1.00 . A A . 20 ALA HB1 1 1 11 7504 1 1 16 ALA HB2 H 1.916 2.677 -8.847 1.00 . A A . 20 ALA HB2 1 1 11 7505 1 1 16 ALA HB3 H 0.789 2.427 -7.518 1.00 . A A . 20 ALA HB3 1 1 11 7506 1 1 16 ALA N N 1.637 0.492 -6.410 1.00 . A A . 20 ALA N 1 1 11 7507 1 1 16 ALA O O 4.196 1.273 -6.134 1.00 . A A . 20 ALA O 1 1 11 7508 1 1 17 LYS C C 5.326 4.741 -7.364 1.00 . A A . 21 LYS C 1 1 11 7509 1 1 17 LYS CA C 5.444 3.223 -7.417 1.00 . A A . 21 LYS CA 1 1 11 7510 1 1 17 LYS CB C 6.507 2.786 -8.429 1.00 . A A . 21 LYS CB 1 1 11 7511 1 1 17 LYS CD C 8.874 3.086 -9.167 1.00 . A A . 21 LYS CD 1 1 11 7512 1 1 17 LYS CE C 8.516 3.774 -10.486 1.00 . A A . 21 LYS CE 1 1 11 7513 1 1 17 LYS CG C 7.842 3.459 -8.100 1.00 . A A . 21 LYS CG 1 1 11 7514 1 1 17 LYS H H 3.756 2.882 -8.714 1.00 . A A . 21 LYS H 1 1 11 7515 1 1 17 LYS HA H 5.689 2.855 -6.440 1.00 . A A . 21 LYS HA 1 1 11 7516 1 1 17 LYS HB2 H 6.623 1.715 -8.385 1.00 . A A . 21 LYS HB2 1 1 11 7517 1 1 17 LYS HB3 H 6.195 3.074 -9.422 1.00 . A A . 21 LYS HB3 1 1 11 7518 1 1 17 LYS HD2 H 9.855 3.409 -8.847 1.00 . A A . 21 LYS HD2 1 1 11 7519 1 1 17 LYS HD3 H 8.876 2.015 -9.308 1.00 . A A . 21 LYS HD3 1 1 11 7520 1 1 17 LYS HE2 H 7.716 3.243 -10.980 1.00 . A A . 21 LYS HE2 1 1 11 7521 1 1 17 LYS HE3 H 8.235 4.802 -10.309 1.00 . A A . 21 LYS HE3 1 1 11 7522 1 1 17 LYS HG2 H 7.713 4.529 -8.083 1.00 . A A . 21 LYS HG2 1 1 11 7523 1 1 17 LYS HG3 H 8.187 3.121 -7.135 1.00 . A A . 21 LYS HG3 1 1 11 7524 1 1 17 LYS HZ1 H 10.171 2.756 -11.236 1.00 . A A . 21 LYS HZ1 1 1 11 7525 1 1 17 LYS HZ2 H 10.447 4.407 -10.942 1.00 . A A . 21 LYS HZ2 1 1 11 7526 1 1 17 LYS HZ3 H 9.539 3.921 -12.293 1.00 . A A . 21 LYS HZ3 1 1 11 7527 1 1 17 LYS N N 4.178 2.590 -7.882 1.00 . A A . 21 LYS N 1 1 11 7528 1 1 17 LYS NZ N 9.762 3.709 -11.299 1.00 . A A . 21 LYS NZ 1 1 11 7529 1 1 17 LYS O O 4.471 5.336 -7.989 1.00 . A A . 21 LYS O 1 1 11 7530 1 1 18 THR C C 7.463 7.494 -6.868 1.00 . A A . 22 THR C 1 1 11 7531 1 1 18 THR CA C 6.121 6.857 -6.496 1.00 . A A . 22 THR CA 1 1 11 7532 1 1 18 THR CB C 5.744 7.176 -5.036 1.00 . A A . 22 THR CB 1 1 11 7533 1 1 18 THR CG2 C 6.471 6.248 -4.047 1.00 . A A . 22 THR CG2 1 1 11 7534 1 1 18 THR H H 6.865 4.855 -6.104 1.00 . A A . 22 THR H 1 1 11 7535 1 1 18 THR HA H 5.351 7.233 -7.151 1.00 . A A . 22 THR HA 1 1 11 7536 1 1 18 THR HB H 4.680 7.056 -4.916 1.00 . A A . 22 THR HB 1 1 11 7537 1 1 18 THR HG1 H 5.360 9.081 -5.012 1.00 . A A . 22 THR HG1 1 1 11 7538 1 1 18 THR HG21 H 6.311 5.218 -4.326 1.00 . A A . 22 THR HG21 1 1 11 7539 1 1 18 THR HG22 H 6.078 6.410 -3.054 1.00 . A A . 22 THR HG22 1 1 11 7540 1 1 18 THR HG23 H 7.529 6.464 -4.055 1.00 . A A . 22 THR HG23 1 1 11 7541 1 1 18 THR N N 6.183 5.368 -6.605 1.00 . A A . 22 THR N 1 1 11 7542 1 1 18 THR O O 8.414 6.823 -7.215 1.00 . A A . 22 THR O 1 1 11 7543 1 1 18 THR OG1 O 6.095 8.522 -4.751 1.00 . A A . 22 THR OG1 1 1 11 7544 1 1 19 SER C C 10.013 8.859 -6.532 1.00 . A A . 23 SER C 1 1 11 7545 1 1 19 SER CA C 8.790 9.519 -7.174 1.00 . A A . 23 SER CA 1 1 11 7546 1 1 19 SER CB C 8.602 10.934 -6.626 1.00 . A A . 23 SER CB 1 1 11 7547 1 1 19 SER H H 6.739 9.309 -6.537 1.00 . A A . 23 SER H 1 1 11 7548 1 1 19 SER HA H 8.903 9.556 -8.245 1.00 . A A . 23 SER HA 1 1 11 7549 1 1 19 SER HB2 H 9.272 11.610 -7.138 1.00 . A A . 23 SER HB2 1 1 11 7550 1 1 19 SER HB3 H 7.582 11.250 -6.787 1.00 . A A . 23 SER HB3 1 1 11 7551 1 1 19 SER HG H 9.414 11.728 -5.048 1.00 . A A . 23 SER HG 1 1 11 7552 1 1 19 SER N N 7.529 8.799 -6.810 1.00 . A A . 23 SER N 1 1 11 7553 1 1 19 SER O O 11.019 8.637 -7.177 1.00 . A A . 23 SER O 1 1 11 7554 1 1 19 SER OG O 8.888 10.946 -5.236 1.00 . A A . 23 SER OG 1 1 11 7555 1 1 20 SER C C 11.564 6.668 -5.377 1.00 . A A . 24 SER C 1 1 11 7556 1 1 20 SER CA C 11.108 7.903 -4.594 1.00 . A A . 24 SER CA 1 1 11 7557 1 1 20 SER CB C 10.597 7.514 -3.205 1.00 . A A . 24 SER CB 1 1 11 7558 1 1 20 SER H H 9.125 8.733 -4.761 1.00 . A A . 24 SER H 1 1 11 7559 1 1 20 SER HA H 11.918 8.605 -4.505 1.00 . A A . 24 SER HA 1 1 11 7560 1 1 20 SER HB2 H 10.765 8.331 -2.520 1.00 . A A . 24 SER HB2 1 1 11 7561 1 1 20 SER HB3 H 9.541 7.303 -3.261 1.00 . A A . 24 SER HB3 1 1 11 7562 1 1 20 SER HG H 10.651 5.650 -2.654 1.00 . A A . 24 SER HG 1 1 11 7563 1 1 20 SER N N 9.941 8.544 -5.268 1.00 . A A . 24 SER N 1 1 11 7564 1 1 20 SER O O 12.694 6.236 -5.272 1.00 . A A . 24 SER O 1 1 11 7565 1 1 20 SER OG O 11.288 6.361 -2.746 1.00 . A A . 24 SER OG 1 1 11 7566 1 1 21 GLY C C 10.574 3.643 -6.232 1.00 . A A . 25 GLY C 1 1 11 7567 1 1 21 GLY CA C 11.072 4.897 -6.951 1.00 . A A . 25 GLY CA 1 1 11 7568 1 1 21 GLY H H 9.787 6.468 -6.228 1.00 . A A . 25 GLY H 1 1 11 7569 1 1 21 GLY HA2 H 10.620 4.953 -7.931 1.00 . A A . 25 GLY HA2 1 1 11 7570 1 1 21 GLY HA3 H 12.146 4.854 -7.049 1.00 . A A . 25 GLY HA3 1 1 11 7571 1 1 21 GLY N N 10.692 6.101 -6.161 1.00 . A A . 25 GLY N 1 1 11 7572 1 1 21 GLY O O 10.346 2.616 -6.840 1.00 . A A . 25 GLY O 1 1 11 7573 1 1 22 GLN C C 8.448 2.261 -4.508 1.00 . A A . 26 GLN C 1 1 11 7574 1 1 22 GLN CA C 9.920 2.531 -4.183 1.00 . A A . 26 GLN CA 1 1 11 7575 1 1 22 GLN CB C 10.083 2.908 -2.711 1.00 . A A . 26 GLN CB 1 1 11 7576 1 1 22 GLN CD C 11.953 1.986 -1.335 1.00 . A A . 26 GLN CD 1 1 11 7577 1 1 22 GLN CG C 11.571 3.035 -2.380 1.00 . A A . 26 GLN CG 1 1 11 7578 1 1 22 GLN H H 10.591 4.558 -4.471 1.00 . A A . 26 GLN H 1 1 11 7579 1 1 22 GLN HA H 10.522 1.666 -4.413 1.00 . A A . 26 GLN HA 1 1 11 7580 1 1 22 GLN HB2 H 9.590 3.851 -2.524 1.00 . A A . 26 GLN HB2 1 1 11 7581 1 1 22 GLN HB3 H 9.640 2.141 -2.093 1.00 . A A . 26 GLN HB3 1 1 11 7582 1 1 22 GLN HE21 H 12.431 0.609 -2.685 1.00 . A A . 26 GLN HE21 1 1 11 7583 1 1 22 GLN HE22 H 12.613 0.132 -1.067 1.00 . A A . 26 GLN HE22 1 1 11 7584 1 1 22 GLN HG2 H 12.153 2.880 -3.276 1.00 . A A . 26 GLN HG2 1 1 11 7585 1 1 22 GLN HG3 H 11.768 4.021 -1.988 1.00 . A A . 26 GLN HG3 1 1 11 7586 1 1 22 GLN N N 10.402 3.718 -4.943 1.00 . A A . 26 GLN N 1 1 11 7587 1 1 22 GLN NE2 N 12.366 0.811 -1.728 1.00 . A A . 26 GLN NE2 1 1 11 7588 1 1 22 GLN O O 7.737 3.129 -5.002 1.00 . A A . 26 GLN O 1 1 11 7589 1 1 22 GLN OE1 O 11.874 2.234 -0.149 1.00 . A A . 26 GLN OE1 1 1 11 7590 1 1 23 ARG C C 5.659 1.320 -3.454 1.00 . A A . 27 ARG C 1 1 11 7591 1 1 23 ARG CA C 6.557 0.753 -4.531 1.00 . A A . 27 ARG CA 1 1 11 7592 1 1 23 ARG CB C 6.423 -0.771 -4.543 1.00 . A A . 27 ARG CB 1 1 11 7593 1 1 23 ARG CD C 7.553 -1.448 -6.664 1.00 . A A . 27 ARG CD 1 1 11 7594 1 1 23 ARG CG C 6.201 -1.225 -5.983 1.00 . A A . 27 ARG CG 1 1 11 7595 1 1 23 ARG CZ C 7.015 -3.626 -7.632 1.00 . A A . 27 ARG CZ 1 1 11 7596 1 1 23 ARG H H 8.565 0.387 -3.842 1.00 . A A . 27 ARG H 1 1 11 7597 1 1 23 ARG HA H 6.281 1.151 -5.494 1.00 . A A . 27 ARG HA 1 1 11 7598 1 1 23 ARG HB2 H 7.311 -1.227 -4.142 1.00 . A A . 27 ARG HB2 1 1 11 7599 1 1 23 ARG HB3 H 5.570 -1.061 -3.941 1.00 . A A . 27 ARG HB3 1 1 11 7600 1 1 23 ARG HD2 H 7.957 -0.509 -7.014 1.00 . A A . 27 ARG HD2 1 1 11 7601 1 1 23 ARG HD3 H 8.244 -1.925 -5.984 1.00 . A A . 27 ARG HD3 1 1 11 7602 1 1 23 ARG HE H 7.243 -1.982 -8.726 1.00 . A A . 27 ARG HE 1 1 11 7603 1 1 23 ARG HG2 H 5.637 -2.146 -5.989 1.00 . A A . 27 ARG HG2 1 1 11 7604 1 1 23 ARG HG3 H 5.650 -0.457 -6.512 1.00 . A A . 27 ARG HG3 1 1 11 7605 1 1 23 ARG HH11 H 7.219 -3.577 -5.632 1.00 . A A . 27 ARG HH11 1 1 11 7606 1 1 23 ARG HH12 H 6.839 -5.122 -6.309 1.00 . A A . 27 ARG HH12 1 1 11 7607 1 1 23 ARG HH21 H 6.748 -3.997 -9.581 1.00 . A A . 27 ARG HH21 1 1 11 7608 1 1 23 ARG HH22 H 6.572 -5.360 -8.528 1.00 . A A . 27 ARG HH22 1 1 11 7609 1 1 23 ARG N N 7.981 1.067 -4.237 1.00 . A A . 27 ARG N 1 1 11 7610 1 1 23 ARG NE N 7.257 -2.348 -7.818 1.00 . A A . 27 ARG NE 1 1 11 7611 1 1 23 ARG NH1 N 7.025 -4.147 -6.430 1.00 . A A . 27 ARG NH1 1 1 11 7612 1 1 23 ARG NH2 N 6.759 -4.387 -8.660 1.00 . A A . 27 ARG NH2 1 1 11 7613 1 1 23 ARG O O 5.709 0.921 -2.308 1.00 . A A . 27 ARG O 1 1 11 7614 1 1 24 TYR C C 2.492 2.212 -3.079 1.00 . A A . 28 TYR C 1 1 11 7615 1 1 24 TYR CA C 3.869 2.777 -2.825 1.00 . A A . 28 TYR CA 1 1 11 7616 1 1 24 TYR CB C 3.919 4.313 -2.951 1.00 . A A . 28 TYR CB 1 1 11 7617 1 1 24 TYR CD1 C 2.787 4.076 -5.229 1.00 . A A . 28 TYR CD1 1 1 11 7618 1 1 24 TYR CD2 C 2.604 6.174 -4.033 1.00 . A A . 28 TYR CD2 1 1 11 7619 1 1 24 TYR CE1 C 2.048 4.614 -6.284 1.00 . A A . 28 TYR CE1 1 1 11 7620 1 1 24 TYR CE2 C 1.856 6.704 -5.085 1.00 . A A . 28 TYR CE2 1 1 11 7621 1 1 24 TYR CG C 3.071 4.854 -4.098 1.00 . A A . 28 TYR CG 1 1 11 7622 1 1 24 TYR CZ C 1.581 5.927 -6.213 1.00 . A A . 28 TYR CZ 1 1 11 7623 1 1 24 TYR H H 4.770 2.492 -4.761 1.00 . A A . 28 TYR H 1 1 11 7624 1 1 24 TYR HA H 4.184 2.485 -1.833 1.00 . A A . 28 TYR HA 1 1 11 7625 1 1 24 TYR HB2 H 3.568 4.747 -2.027 1.00 . A A . 28 TYR HB2 1 1 11 7626 1 1 24 TYR HB3 H 4.943 4.613 -3.106 1.00 . A A . 28 TYR HB3 1 1 11 7627 1 1 24 TYR HD1 H 3.124 3.061 -5.286 1.00 . A A . 28 TYR HD1 1 1 11 7628 1 1 24 TYR HD2 H 2.806 6.777 -3.161 1.00 . A A . 28 TYR HD2 1 1 11 7629 1 1 24 TYR HE1 H 1.836 4.013 -7.150 1.00 . A A . 28 TYR HE1 1 1 11 7630 1 1 24 TYR HE2 H 1.495 7.717 -5.028 1.00 . A A . 28 TYR HE2 1 1 11 7631 1 1 24 TYR HH H 1.227 7.325 -7.461 1.00 . A A . 28 TYR HH 1 1 11 7632 1 1 24 TYR N N 4.809 2.218 -3.824 1.00 . A A . 28 TYR N 1 1 11 7633 1 1 24 TYR O O 2.266 1.490 -4.030 1.00 . A A . 28 TYR O 1 1 11 7634 1 1 24 TYR OH O 0.862 6.461 -7.260 1.00 . A A . 28 TYR OH 1 1 11 7635 1 1 25 PHE C C -0.757 3.125 -2.456 1.00 . A A . 29 PHE C 1 1 11 7636 1 1 25 PHE CA C 0.229 1.975 -2.393 1.00 . A A . 29 PHE CA 1 1 11 7637 1 1 25 PHE CB C 0.058 1.049 -1.194 1.00 . A A . 29 PHE CB 1 1 11 7638 1 1 25 PHE CD1 C 2.416 0.111 -1.103 1.00 . A A . 29 PHE CD1 1 1 11 7639 1 1 25 PHE CD2 C 0.618 -1.301 -1.899 1.00 . A A . 29 PHE CD2 1 1 11 7640 1 1 25 PHE CE1 C 3.330 -0.924 -1.334 1.00 . A A . 29 PHE CE1 1 1 11 7641 1 1 25 PHE CE2 C 1.534 -2.334 -2.134 1.00 . A A . 29 PHE CE2 1 1 11 7642 1 1 25 PHE CG C 1.052 -0.081 -1.384 1.00 . A A . 29 PHE CG 1 1 11 7643 1 1 25 PHE CZ C 2.889 -2.145 -1.852 1.00 . A A . 29 PHE CZ 1 1 11 7644 1 1 25 PHE H H 1.799 3.086 -1.462 1.00 . A A . 29 PHE H 1 1 11 7645 1 1 25 PHE HA H 0.175 1.399 -3.305 1.00 . A A . 29 PHE HA 1 1 11 7646 1 1 25 PHE HB2 H 0.264 1.583 -0.277 1.00 . A A . 29 PHE HB2 1 1 11 7647 1 1 25 PHE HB3 H -0.948 0.654 -1.173 1.00 . A A . 29 PHE HB3 1 1 11 7648 1 1 25 PHE HD1 H 2.764 1.056 -0.706 1.00 . A A . 29 PHE HD1 1 1 11 7649 1 1 25 PHE HD2 H -0.424 -1.448 -2.118 1.00 . A A . 29 PHE HD2 1 1 11 7650 1 1 25 PHE HE1 H 4.376 -0.777 -1.123 1.00 . A A . 29 PHE HE1 1 1 11 7651 1 1 25 PHE HE2 H 1.193 -3.276 -2.540 1.00 . A A . 29 PHE HE2 1 1 11 7652 1 1 25 PHE HZ H 3.593 -2.941 -2.041 1.00 . A A . 29 PHE HZ 1 1 11 7653 1 1 25 PHE N N 1.583 2.513 -2.225 1.00 . A A . 29 PHE N 1 1 11 7654 1 1 25 PHE O O -1.069 3.776 -1.472 1.00 . A A . 29 PHE O 1 1 11 7655 1 1 26 LEU C C -3.547 4.126 -3.412 1.00 . A A . 30 LEU C 1 1 11 7656 1 1 26 LEU CA C -2.147 4.512 -3.893 1.00 . A A . 30 LEU CA 1 1 11 7657 1 1 26 LEU CB C -2.084 4.689 -5.418 1.00 . A A . 30 LEU CB 1 1 11 7658 1 1 26 LEU CD1 C -1.052 6.965 -5.050 1.00 . A A . 30 LEU CD1 1 1 11 7659 1 1 26 LEU CD2 C -1.777 6.259 -7.315 1.00 . A A . 30 LEU CD2 1 1 11 7660 1 1 26 LEU CG C -2.100 6.166 -5.827 1.00 . A A . 30 LEU CG 1 1 11 7661 1 1 26 LEU H H -0.894 2.849 -4.408 1.00 . A A . 30 LEU H 1 1 11 7662 1 1 26 LEU HA H -1.813 5.403 -3.394 1.00 . A A . 30 LEU HA 1 1 11 7663 1 1 26 LEU HB2 H -1.174 4.236 -5.783 1.00 . A A . 30 LEU HB2 1 1 11 7664 1 1 26 LEU HB3 H -2.924 4.192 -5.869 1.00 . A A . 30 LEU HB3 1 1 11 7665 1 1 26 LEU HD11 H -0.499 6.308 -4.398 1.00 . A A . 30 LEU HD11 1 1 11 7666 1 1 26 LEU HD12 H -1.550 7.721 -4.469 1.00 . A A . 30 LEU HD12 1 1 11 7667 1 1 26 LEU HD13 H -0.371 7.438 -5.743 1.00 . A A . 30 LEU HD13 1 1 11 7668 1 1 26 LEU HD21 H -2.691 6.227 -7.884 1.00 . A A . 30 LEU HD21 1 1 11 7669 1 1 26 LEU HD22 H -1.145 5.427 -7.596 1.00 . A A . 30 LEU HD22 1 1 11 7670 1 1 26 LEU HD23 H -1.258 7.185 -7.510 1.00 . A A . 30 LEU HD23 1 1 11 7671 1 1 26 LEU HG H -3.076 6.581 -5.643 1.00 . A A . 30 LEU HG 1 1 11 7672 1 1 26 LEU N N -1.206 3.392 -3.648 1.00 . A A . 30 LEU N 1 1 11 7673 1 1 26 LEU O O -4.203 3.268 -3.976 1.00 . A A . 30 LEU O 1 1 11 7674 1 1 27 ASN C C -6.401 5.298 -2.495 1.00 . A A . 31 ASN C 1 1 11 7675 1 1 27 ASN CA C -5.340 4.443 -1.805 1.00 . A A . 31 ASN CA 1 1 11 7676 1 1 27 ASN CB C -5.239 4.806 -0.323 1.00 . A A . 31 ASN CB 1 1 11 7677 1 1 27 ASN CG C -6.555 4.486 0.378 1.00 . A A . 31 ASN CG 1 1 11 7678 1 1 27 ASN H H -3.435 5.429 -1.923 1.00 . A A . 31 ASN H 1 1 11 7679 1 1 27 ASN HA H -5.564 3.394 -1.915 1.00 . A A . 31 ASN HA 1 1 11 7680 1 1 27 ASN HB2 H -4.451 4.234 0.138 1.00 . A A . 31 ASN HB2 1 1 11 7681 1 1 27 ASN HB3 H -5.025 5.859 -0.223 1.00 . A A . 31 ASN HB3 1 1 11 7682 1 1 27 ASN HD21 H -5.677 4.099 2.112 1.00 . A A . 31 ASN HD21 1 1 11 7683 1 1 27 ASN HD22 H -7.359 3.928 2.096 1.00 . A A . 31 ASN HD22 1 1 11 7684 1 1 27 ASN N N -3.994 4.753 -2.359 1.00 . A A . 31 ASN N 1 1 11 7685 1 1 27 ASN ND2 N -6.530 4.145 1.633 1.00 . A A . 31 ASN ND2 1 1 11 7686 1 1 27 ASN O O -6.497 6.491 -2.263 1.00 . A A . 31 ASN O 1 1 11 7687 1 1 27 ASN OD1 O -7.610 4.550 -0.220 1.00 . A A . 31 ASN OD1 1 1 11 7688 1 1 28 HIS C C -9.498 5.631 -3.159 1.00 . A A . 32 HIS C 1 1 11 7689 1 1 28 HIS CA C -8.259 5.465 -4.052 1.00 . A A . 32 HIS CA 1 1 11 7690 1 1 28 HIS CB C -8.596 4.623 -5.283 1.00 . A A . 32 HIS CB 1 1 11 7691 1 1 28 HIS CD2 C -7.424 5.314 -7.531 1.00 . A A . 32 HIS CD2 1 1 11 7692 1 1 28 HIS CE1 C -8.660 7.027 -8.017 1.00 . A A . 32 HIS CE1 1 1 11 7693 1 1 28 HIS CG C -8.354 5.433 -6.527 1.00 . A A . 32 HIS CG 1 1 11 7694 1 1 28 HIS H H -7.096 3.735 -3.506 1.00 . A A . 32 HIS H 1 1 11 7695 1 1 28 HIS HA H -7.884 6.428 -4.358 1.00 . A A . 32 HIS HA 1 1 11 7696 1 1 28 HIS HB2 H -7.972 3.742 -5.298 1.00 . A A . 32 HIS HB2 1 1 11 7697 1 1 28 HIS HB3 H -9.634 4.327 -5.242 1.00 . A A . 32 HIS HB3 1 1 11 7698 1 1 28 HIS HD1 H -9.886 6.883 -6.342 1.00 . A A . 32 HIS HD1 1 1 11 7699 1 1 28 HIS HD2 H -6.658 4.554 -7.584 1.00 . A A . 32 HIS HD2 1 1 11 7700 1 1 28 HIS HE1 H -9.072 7.889 -8.519 1.00 . A A . 32 HIS HE1 1 1 11 7701 1 1 28 HIS N N -7.197 4.696 -3.341 1.00 . A A . 32 HIS N 1 1 11 7702 1 1 28 HIS ND1 N -9.130 6.530 -6.858 1.00 . A A . 32 HIS ND1 1 1 11 7703 1 1 28 HIS NE2 N -7.619 6.322 -8.471 1.00 . A A . 32 HIS NE2 1 1 11 7704 1 1 28 HIS O O -10.455 6.279 -3.534 1.00 . A A . 32 HIS O 1 1 11 7705 1 1 29 ILE C C -10.465 6.479 -0.242 1.00 . A A . 33 ILE C 1 1 11 7706 1 1 29 ILE CA C -10.667 5.221 -1.071 1.00 . A A . 33 ILE CA 1 1 11 7707 1 1 29 ILE CB C -10.722 3.990 -0.132 1.00 . A A . 33 ILE CB 1 1 11 7708 1 1 29 ILE CD1 C -10.338 1.493 0.042 1.00 . A A . 33 ILE CD1 1 1 11 7709 1 1 29 ILE CG1 C -10.029 2.763 -0.763 1.00 . A A . 33 ILE CG1 1 1 11 7710 1 1 29 ILE CG2 C -12.193 3.667 0.153 1.00 . A A . 33 ILE CG2 1 1 11 7711 1 1 29 ILE H H -8.703 4.563 -1.684 1.00 . A A . 33 ILE H 1 1 11 7712 1 1 29 ILE HA H -11.578 5.292 -1.647 1.00 . A A . 33 ILE HA 1 1 11 7713 1 1 29 ILE HB H -10.231 4.240 0.800 1.00 . A A . 33 ILE HB 1 1 11 7714 1 1 29 ILE HD11 H -11.190 0.991 -0.390 1.00 . A A . 33 ILE HD11 1 1 11 7715 1 1 29 ILE HD12 H -10.557 1.760 1.066 1.00 . A A . 33 ILE HD12 1 1 11 7716 1 1 29 ILE HD13 H -9.482 0.835 0.017 1.00 . A A . 33 ILE HD13 1 1 11 7717 1 1 29 ILE HG12 H -10.375 2.641 -1.776 1.00 . A A . 33 ILE HG12 1 1 11 7718 1 1 29 ILE HG13 H -8.963 2.925 -0.766 1.00 . A A . 33 ILE HG13 1 1 11 7719 1 1 29 ILE HG21 H -12.323 3.486 1.210 1.00 . A A . 33 ILE HG21 1 1 11 7720 1 1 29 ILE HG22 H -12.481 2.786 -0.401 1.00 . A A . 33 ILE HG22 1 1 11 7721 1 1 29 ILE HG23 H -12.810 4.501 -0.149 1.00 . A A . 33 ILE HG23 1 1 11 7722 1 1 29 ILE N N -9.484 5.069 -1.979 1.00 . A A . 33 ILE N 1 1 11 7723 1 1 29 ILE O O -11.216 7.431 -0.327 1.00 . A A . 33 ILE O 1 1 11 7724 1 1 30 ASP C C -8.184 8.628 0.637 1.00 . A A . 34 ASP C 1 1 11 7725 1 1 30 ASP CA C -9.140 7.687 1.383 1.00 . A A . 34 ASP CA 1 1 11 7726 1 1 30 ASP CB C -8.478 7.139 2.646 1.00 . A A . 34 ASP CB 1 1 11 7727 1 1 30 ASP CG C -9.524 7.011 3.757 1.00 . A A . 34 ASP CG 1 1 11 7728 1 1 30 ASP H H -8.839 5.705 0.580 1.00 . A A . 34 ASP H 1 1 11 7729 1 1 30 ASP HA H -10.054 8.201 1.637 1.00 . A A . 34 ASP HA 1 1 11 7730 1 1 30 ASP HB2 H -8.054 6.168 2.437 1.00 . A A . 34 ASP HB2 1 1 11 7731 1 1 30 ASP HB3 H -7.696 7.812 2.964 1.00 . A A . 34 ASP HB3 1 1 11 7732 1 1 30 ASP N N -9.433 6.489 0.548 1.00 . A A . 34 ASP N 1 1 11 7733 1 1 30 ASP O O -7.636 9.550 1.209 1.00 . A A . 34 ASP O 1 1 11 7734 1 1 30 ASP OD1 O -10.522 6.348 3.530 1.00 . A A . 34 ASP OD1 1 1 11 7735 1 1 30 ASP OD2 O -9.308 7.580 4.814 1.00 . A A . 34 ASP OD2 1 1 11 7736 1 1 31 GLN C C -5.727 9.463 -0.675 1.00 . A A . 35 GLN C 1 1 11 7737 1 1 31 GLN CA C -7.052 9.280 -1.419 1.00 . A A . 35 GLN CA 1 1 11 7738 1 1 31 GLN CB C -7.783 10.617 -1.546 1.00 . A A . 35 GLN CB 1 1 11 7739 1 1 31 GLN CD C -9.649 11.688 -2.816 1.00 . A A . 35 GLN CD 1 1 11 7740 1 1 31 GLN CG C -9.164 10.391 -2.165 1.00 . A A . 35 GLN CG 1 1 11 7741 1 1 31 GLN H H -8.422 7.655 -1.083 1.00 . A A . 35 GLN H 1 1 11 7742 1 1 31 GLN HA H -6.879 8.863 -2.399 1.00 . A A . 35 GLN HA 1 1 11 7743 1 1 31 GLN HB2 H -7.896 11.060 -0.567 1.00 . A A . 35 GLN HB2 1 1 11 7744 1 1 31 GLN HB3 H -7.210 11.281 -2.176 1.00 . A A . 35 GLN HB3 1 1 11 7745 1 1 31 GLN HE21 H -10.615 10.756 -4.280 1.00 . A A . 35 GLN HE21 1 1 11 7746 1 1 31 GLN HE22 H -10.698 12.451 -4.318 1.00 . A A . 35 GLN HE22 1 1 11 7747 1 1 31 GLN HG2 H -9.099 9.614 -2.914 1.00 . A A . 35 GLN HG2 1 1 11 7748 1 1 31 GLN HG3 H -9.859 10.091 -1.394 1.00 . A A . 35 GLN HG3 1 1 11 7749 1 1 31 GLN N N -7.975 8.402 -0.639 1.00 . A A . 35 GLN N 1 1 11 7750 1 1 31 GLN NE2 N -10.382 11.627 -3.895 1.00 . A A . 35 GLN NE2 1 1 11 7751 1 1 31 GLN O O -5.450 10.515 -0.135 1.00 . A A . 35 GLN O 1 1 11 7752 1 1 31 GLN OE1 O -9.359 12.766 -2.338 1.00 . A A . 35 GLN OE1 1 1 11 7753 1 1 32 THR C C -2.566 7.621 -0.517 1.00 . A A . 36 THR C 1 1 11 7754 1 1 32 THR CA C -3.599 8.581 0.075 1.00 . A A . 36 THR CA 1 1 11 7755 1 1 32 THR CB C -3.883 8.216 1.538 1.00 . A A . 36 THR CB 1 1 11 7756 1 1 32 THR CG2 C -3.092 9.147 2.458 1.00 . A A . 36 THR CG2 1 1 11 7757 1 1 32 THR H H -5.148 7.603 -1.085 1.00 . A A . 36 THR H 1 1 11 7758 1 1 32 THR HA H -3.243 9.598 0.015 1.00 . A A . 36 THR HA 1 1 11 7759 1 1 32 THR HB H -3.572 7.198 1.718 1.00 . A A . 36 THR HB 1 1 11 7760 1 1 32 THR HG1 H -5.700 7.517 1.586 1.00 . A A . 36 THR HG1 1 1 11 7761 1 1 32 THR HG21 H -3.720 9.971 2.761 1.00 . A A . 36 THR HG21 1 1 11 7762 1 1 32 THR HG22 H -2.230 9.527 1.929 1.00 . A A . 36 THR HG22 1 1 11 7763 1 1 32 THR HG23 H -2.768 8.600 3.331 1.00 . A A . 36 THR HG23 1 1 11 7764 1 1 32 THR N N -4.907 8.448 -0.641 1.00 . A A . 36 THR N 1 1 11 7765 1 1 32 THR O O -2.855 6.860 -1.415 1.00 . A A . 36 THR O 1 1 11 7766 1 1 32 THR OG1 O -5.272 8.345 1.815 1.00 . A A . 36 THR OG1 1 1 11 7767 1 1 33 THR C C 0.578 6.224 0.585 1.00 . A A . 37 THR C 1 1 11 7768 1 1 33 THR CA C -0.304 6.739 -0.548 1.00 . A A . 37 THR CA 1 1 11 7769 1 1 33 THR CB C 0.547 7.583 -1.502 1.00 . A A . 37 THR CB 1 1 11 7770 1 1 33 THR CG2 C -0.345 8.331 -2.488 1.00 . A A . 37 THR CG2 1 1 11 7771 1 1 33 THR H H -1.149 8.274 0.713 1.00 . A A . 37 THR H 1 1 11 7772 1 1 33 THR HA H -0.752 5.917 -1.084 1.00 . A A . 37 THR HA 1 1 11 7773 1 1 33 THR HB H 1.216 6.936 -2.052 1.00 . A A . 37 THR HB 1 1 11 7774 1 1 33 THR HG1 H 0.701 9.150 -0.361 1.00 . A A . 37 THR HG1 1 1 11 7775 1 1 33 THR HG21 H 0.137 8.369 -3.454 1.00 . A A . 37 THR HG21 1 1 11 7776 1 1 33 THR HG22 H -0.513 9.336 -2.131 1.00 . A A . 37 THR HG22 1 1 11 7777 1 1 33 THR HG23 H -1.289 7.817 -2.578 1.00 . A A . 37 THR HG23 1 1 11 7778 1 1 33 THR N N -1.359 7.653 -0.015 1.00 . A A . 37 THR N 1 1 11 7779 1 1 33 THR O O 1.277 6.979 1.230 1.00 . A A . 37 THR O 1 1 11 7780 1 1 33 THR OG1 O 1.308 8.515 -0.749 1.00 . A A . 37 THR OG1 1 1 11 7781 1 1 34 THR C C 2.545 3.534 1.232 1.00 . A A . 38 THR C 1 1 11 7782 1 1 34 THR CA C 1.460 4.393 1.884 1.00 . A A . 38 THR CA 1 1 11 7783 1 1 34 THR CB C 0.549 3.555 2.789 1.00 . A A . 38 THR CB 1 1 11 7784 1 1 34 THR CG2 C 0.013 2.348 2.021 1.00 . A A . 38 THR CG2 1 1 11 7785 1 1 34 THR H H 0.030 4.341 0.260 1.00 . A A . 38 THR H 1 1 11 7786 1 1 34 THR HA H 1.907 5.196 2.449 1.00 . A A . 38 THR HA 1 1 11 7787 1 1 34 THR HB H -0.280 4.161 3.122 1.00 . A A . 38 THR HB 1 1 11 7788 1 1 34 THR HG1 H 2.022 2.576 3.597 1.00 . A A . 38 THR HG1 1 1 11 7789 1 1 34 THR HG21 H -0.686 1.806 2.641 1.00 . A A . 38 THR HG21 1 1 11 7790 1 1 34 THR HG22 H 0.833 1.699 1.749 1.00 . A A . 38 THR HG22 1 1 11 7791 1 1 34 THR HG23 H -0.487 2.688 1.130 1.00 . A A . 38 THR HG23 1 1 11 7792 1 1 34 THR N N 0.582 4.943 0.811 1.00 . A A . 38 THR N 1 1 11 7793 1 1 34 THR O O 2.337 2.973 0.179 1.00 . A A . 38 THR O 1 1 11 7794 1 1 34 THR OG1 O 1.289 3.107 3.915 1.00 . A A . 38 THR OG1 1 1 11 7795 1 1 35 TRP C C 4.646 1.157 1.648 1.00 . A A . 39 TRP C 1 1 11 7796 1 1 35 TRP CA C 4.777 2.616 1.204 1.00 . A A . 39 TRP CA 1 1 11 7797 1 1 35 TRP CB C 6.102 3.207 1.706 1.00 . A A . 39 TRP CB 1 1 11 7798 1 1 35 TRP CD1 C 5.570 5.584 2.402 1.00 . A A . 39 TRP CD1 1 1 11 7799 1 1 35 TRP CD2 C 6.737 5.497 0.479 1.00 . A A . 39 TRP CD2 1 1 11 7800 1 1 35 TRP CE2 C 6.517 6.866 0.763 1.00 . A A . 39 TRP CE2 1 1 11 7801 1 1 35 TRP CE3 C 7.454 5.174 -0.689 1.00 . A A . 39 TRP CE3 1 1 11 7802 1 1 35 TRP CG C 6.125 4.700 1.539 1.00 . A A . 39 TRP CG 1 1 11 7803 1 1 35 TRP CH2 C 7.705 7.533 -1.225 1.00 . A A . 39 TRP CH2 1 1 11 7804 1 1 35 TRP CZ2 C 6.993 7.874 -0.074 1.00 . A A . 39 TRP CZ2 1 1 11 7805 1 1 35 TRP CZ3 C 7.933 6.186 -1.533 1.00 . A A . 39 TRP CZ3 1 1 11 7806 1 1 35 TRP H H 3.855 3.902 2.676 1.00 . A A . 39 TRP H 1 1 11 7807 1 1 35 TRP HA H 4.725 2.684 0.128 1.00 . A A . 39 TRP HA 1 1 11 7808 1 1 35 TRP HB2 H 6.225 2.965 2.751 1.00 . A A . 39 TRP HB2 1 1 11 7809 1 1 35 TRP HB3 H 6.918 2.776 1.144 1.00 . A A . 39 TRP HB3 1 1 11 7810 1 1 35 TRP HD1 H 5.031 5.330 3.303 1.00 . A A . 39 TRP HD1 1 1 11 7811 1 1 35 TRP HE1 H 5.503 7.692 2.380 1.00 . A A . 39 TRP HE1 1 1 11 7812 1 1 35 TRP HE3 H 7.629 4.142 -0.948 1.00 . A A . 39 TRP HE3 1 1 11 7813 1 1 35 TRP HH2 H 8.076 8.308 -1.879 1.00 . A A . 39 TRP HH2 1 1 11 7814 1 1 35 TRP HZ2 H 6.814 8.910 0.170 1.00 . A A . 39 TRP HZ2 1 1 11 7815 1 1 35 TRP HZ3 H 8.484 5.924 -2.423 1.00 . A A . 39 TRP HZ3 1 1 11 7816 1 1 35 TRP N N 3.697 3.436 1.829 1.00 . A A . 39 TRP N 1 1 11 7817 1 1 35 TRP NE1 N 5.802 6.867 1.940 1.00 . A A . 39 TRP NE1 1 1 11 7818 1 1 35 TRP O O 4.923 0.243 0.897 1.00 . A A . 39 TRP O 1 1 11 7819 1 1 36 GLN C C 3.315 -0.490 4.679 1.00 . A A . 40 GLN C 1 1 11 7820 1 1 36 GLN CA C 4.078 -0.471 3.352 1.00 . A A . 40 GLN CA 1 1 11 7821 1 1 36 GLN CB C 5.509 -0.975 3.548 1.00 . A A . 40 GLN CB 1 1 11 7822 1 1 36 GLN CD C 6.885 -3.055 3.706 1.00 . A A . 40 GLN CD 1 1 11 7823 1 1 36 GLN CG C 5.585 -2.454 3.164 1.00 . A A . 40 GLN CG 1 1 11 7824 1 1 36 GLN H H 4.008 1.681 3.453 1.00 . A A . 40 GLN H 1 1 11 7825 1 1 36 GLN HA H 3.573 -1.075 2.616 1.00 . A A . 40 GLN HA 1 1 11 7826 1 1 36 GLN HB2 H 6.181 -0.405 2.921 1.00 . A A . 40 GLN HB2 1 1 11 7827 1 1 36 GLN HB3 H 5.794 -0.855 4.582 1.00 . A A . 40 GLN HB3 1 1 11 7828 1 1 36 GLN HE21 H 5.962 -4.237 5.006 1.00 . A A . 40 GLN HE21 1 1 11 7829 1 1 36 GLN HE22 H 7.656 -4.343 5.003 1.00 . A A . 40 GLN HE22 1 1 11 7830 1 1 36 GLN HG2 H 4.742 -2.979 3.588 1.00 . A A . 40 GLN HG2 1 1 11 7831 1 1 36 GLN HG3 H 5.566 -2.549 2.088 1.00 . A A . 40 GLN HG3 1 1 11 7832 1 1 36 GLN N N 4.227 0.930 2.862 1.00 . A A . 40 GLN N 1 1 11 7833 1 1 36 GLN NE2 N 6.831 -3.953 4.649 1.00 . A A . 40 GLN NE2 1 1 11 7834 1 1 36 GLN O O 3.760 -1.067 5.652 1.00 . A A . 40 GLN O 1 1 11 7835 1 1 36 GLN OE1 O 7.960 -2.702 3.263 1.00 . A A . 40 GLN OE1 1 1 11 7836 1 1 37 ASP C C -0.022 0.719 5.732 1.00 . A A . 41 ASP C 1 1 11 7837 1 1 37 ASP CA C 1.379 0.148 5.989 1.00 . A A . 41 ASP CA 1 1 11 7838 1 1 37 ASP CB C 2.164 1.057 6.936 1.00 . A A . 41 ASP CB 1 1 11 7839 1 1 37 ASP CG C 2.081 0.503 8.359 1.00 . A A . 41 ASP CG 1 1 11 7840 1 1 37 ASP H H 1.829 0.591 3.929 1.00 . A A . 41 ASP H 1 1 11 7841 1 1 37 ASP HA H 1.313 -0.845 6.404 1.00 . A A . 41 ASP HA 1 1 11 7842 1 1 37 ASP HB2 H 3.198 1.097 6.623 1.00 . A A . 41 ASP HB2 1 1 11 7843 1 1 37 ASP HB3 H 1.743 2.051 6.912 1.00 . A A . 41 ASP HB3 1 1 11 7844 1 1 37 ASP N N 2.170 0.133 4.725 1.00 . A A . 41 ASP N 1 1 11 7845 1 1 37 ASP O O -0.389 1.726 6.304 1.00 . A A . 41 ASP O 1 1 11 7846 1 1 37 ASP OD1 O 2.191 -0.703 8.513 1.00 . A A . 41 ASP OD1 1 1 11 7847 1 1 37 ASP OD2 O 1.911 1.295 9.274 1.00 . A A . 41 ASP OD2 1 1 11 7848 1 1 38 PRO C C -3.082 0.272 5.737 1.00 . A A . 42 PRO C 1 1 11 7849 1 1 38 PRO CA C -2.134 0.516 4.553 1.00 . A A . 42 PRO CA 1 1 11 7850 1 1 38 PRO CB C -2.521 -0.327 3.339 1.00 . A A . 42 PRO CB 1 1 11 7851 1 1 38 PRO CD C -0.401 -1.168 4.143 1.00 . A A . 42 PRO CD 1 1 11 7852 1 1 38 PRO CG C -1.671 -1.558 3.429 1.00 . A A . 42 PRO CG 1 1 11 7853 1 1 38 PRO HA H -2.127 1.559 4.286 1.00 . A A . 42 PRO HA 1 1 11 7854 1 1 38 PRO HB2 H -3.567 -0.591 3.385 1.00 . A A . 42 PRO HB2 1 1 11 7855 1 1 38 PRO HB3 H -2.308 0.208 2.426 1.00 . A A . 42 PRO HB3 1 1 11 7856 1 1 38 PRO HD2 H -0.099 -1.947 4.828 1.00 . A A . 42 PRO HD2 1 1 11 7857 1 1 38 PRO HD3 H 0.384 -0.963 3.431 1.00 . A A . 42 PRO HD3 1 1 11 7858 1 1 38 PRO HG2 H -2.186 -2.326 3.986 1.00 . A A . 42 PRO HG2 1 1 11 7859 1 1 38 PRO HG3 H -1.439 -1.917 2.438 1.00 . A A . 42 PRO HG3 1 1 11 7860 1 1 38 PRO N N -0.762 0.054 4.878 1.00 . A A . 42 PRO N 1 1 11 7861 1 1 38 PRO O O -3.274 1.134 6.571 1.00 . A A . 42 PRO O 1 1 11 7862 1 1 39 ARG C C -3.887 -1.977 8.042 1.00 . A A . 43 ARG C 1 1 11 7863 1 1 39 ARG CA C -4.604 -1.166 6.959 1.00 . A A . 43 ARG CA 1 1 11 7864 1 1 39 ARG CB C -5.745 -1.977 6.349 1.00 . A A . 43 ARG CB 1 1 11 7865 1 1 39 ARG CD C -7.089 -3.723 7.529 1.00 . A A . 43 ARG CD 1 1 11 7866 1 1 39 ARG CG C -6.821 -2.221 7.408 1.00 . A A . 43 ARG CG 1 1 11 7867 1 1 39 ARG CZ C -8.054 -3.532 9.764 1.00 . A A . 43 ARG CZ 1 1 11 7868 1 1 39 ARG H H -3.517 -1.577 5.149 1.00 . A A . 43 ARG H 1 1 11 7869 1 1 39 ARG HA H -4.984 -0.243 7.368 1.00 . A A . 43 ARG HA 1 1 11 7870 1 1 39 ARG HB2 H -6.173 -1.433 5.520 1.00 . A A . 43 ARG HB2 1 1 11 7871 1 1 39 ARG HB3 H -5.364 -2.926 5.997 1.00 . A A . 43 ARG HB3 1 1 11 7872 1 1 39 ARG HD2 H -8.049 -3.970 7.098 1.00 . A A . 43 ARG HD2 1 1 11 7873 1 1 39 ARG HD3 H -6.302 -4.284 7.046 1.00 . A A . 43 ARG HD3 1 1 11 7874 1 1 39 ARG HE H -6.371 -4.524 9.394 1.00 . A A . 43 ARG HE 1 1 11 7875 1 1 39 ARG HG2 H -6.483 -1.838 8.360 1.00 . A A . 43 ARG HG2 1 1 11 7876 1 1 39 ARG HG3 H -7.731 -1.715 7.121 1.00 . A A . 43 ARG HG3 1 1 11 7877 1 1 39 ARG HH11 H -9.066 -2.617 8.288 1.00 . A A . 43 ARG HH11 1 1 11 7878 1 1 39 ARG HH12 H -9.756 -2.477 9.868 1.00 . A A . 43 ARG HH12 1 1 11 7879 1 1 39 ARG HH21 H -7.286 -4.328 11.434 1.00 . A A . 43 ARG HH21 1 1 11 7880 1 1 39 ARG HH22 H -8.758 -3.438 11.636 1.00 . A A . 43 ARG HH22 1 1 11 7881 1 1 39 ARG N N -3.676 -0.889 5.824 1.00 . A A . 43 ARG N 1 1 11 7882 1 1 39 ARG NE N -7.094 -3.993 8.998 1.00 . A A . 43 ARG NE 1 1 11 7883 1 1 39 ARG NH1 N -9.035 -2.820 9.265 1.00 . A A . 43 ARG NH1 1 1 11 7884 1 1 39 ARG NH2 N -8.030 -3.786 11.045 1.00 . A A . 43 ARG NH2 1 1 11 7885 1 1 39 ARG O O -4.506 -2.668 8.825 1.00 . A A . 43 ARG O 1 1 11 7886 1 1 40 LYS C C -0.516 -1.949 9.457 1.00 . A A . 44 LYS C 1 1 11 7887 1 1 40 LYS CA C -1.829 -2.662 9.126 1.00 . A A . 44 LYS CA 1 1 11 7888 1 1 40 LYS CB C -1.555 -4.023 8.485 1.00 . A A . 44 LYS CB 1 1 11 7889 1 1 40 LYS CD C 0.481 -4.756 7.234 1.00 . A A . 44 LYS CD 1 1 11 7890 1 1 40 LYS CE C 1.708 -4.000 6.723 1.00 . A A . 44 LYS CE 1 1 11 7891 1 1 40 LYS CG C -0.737 -3.829 7.206 1.00 . A A . 44 LYS CG 1 1 11 7892 1 1 40 LYS H H -2.103 -1.332 7.451 1.00 . A A . 44 LYS H 1 1 11 7893 1 1 40 LYS HA H -2.427 -2.785 10.014 1.00 . A A . 44 LYS HA 1 1 11 7894 1 1 40 LYS HB2 H -1.000 -4.639 9.177 1.00 . A A . 44 LYS HB2 1 1 11 7895 1 1 40 LYS HB3 H -2.490 -4.503 8.245 1.00 . A A . 44 LYS HB3 1 1 11 7896 1 1 40 LYS HD2 H 0.657 -5.087 8.247 1.00 . A A . 44 LYS HD2 1 1 11 7897 1 1 40 LYS HD3 H 0.296 -5.611 6.602 1.00 . A A . 44 LYS HD3 1 1 11 7898 1 1 40 LYS HE2 H 1.446 -2.983 6.471 1.00 . A A . 44 LYS HE2 1 1 11 7899 1 1 40 LYS HE3 H 2.493 -4.013 7.465 1.00 . A A . 44 LYS HE3 1 1 11 7900 1 1 40 LYS HG2 H -1.349 -4.066 6.348 1.00 . A A . 44 LYS HG2 1 1 11 7901 1 1 40 LYS HG3 H -0.407 -2.803 7.143 1.00 . A A . 44 LYS HG3 1 1 11 7902 1 1 40 LYS HZ1 H 2.833 -4.179 4.980 1.00 . A A . 44 LYS HZ1 1 1 11 7903 1 1 40 LYS HZ2 H 1.305 -4.917 4.898 1.00 . A A . 44 LYS HZ2 1 1 11 7904 1 1 40 LYS HZ3 H 2.560 -5.649 5.779 1.00 . A A . 44 LYS HZ3 1 1 11 7905 1 1 40 LYS N N -2.585 -1.895 8.092 1.00 . A A . 44 LYS N 1 1 11 7906 1 1 40 LYS NZ N 2.133 -4.742 5.503 1.00 . A A . 44 LYS NZ 1 1 11 7907 1 1 40 LYS O O 0.425 -2.627 9.833 1.00 . A A . 44 LYS O 1 1 11 7908 1 1 40 LYS OXT O -0.475 -0.736 9.330 1.00 . A A . 44 LYS OXT 1 1 11 7909 2 2 1 ACE C C 7.556 14.056 2.955 1.00 . B B . 45 ACE C 1 1 11 7910 2 2 1 ACE CH3 C 8.691 15.028 3.285 1.00 . B B . 45 ACE CH3 1 1 11 7911 2 2 1 ACE H1 H 9.604 14.474 3.451 1.00 . B B . 45 ACE H1 1 1 11 7912 2 2 1 ACE H2 H 8.440 15.585 4.176 1.00 . B B . 45 ACE H2 1 1 11 7913 2 2 1 ACE H3 H 8.829 15.712 2.461 1.00 . B B . 45 ACE H3 1 1 11 7914 2 2 1 ACE O O 6.449 14.467 2.669 1.00 . B B . 45 ACE O 1 1 11 7915 2 2 2 PRO C C 7.061 11.375 1.150 1.00 . B B . 46 PRO C 1 1 11 7916 2 2 2 PRO CA C 8.268 12.089 1.764 1.00 . B B . 46 PRO CA 1 1 11 7917 2 2 2 PRO CB C 9.315 11.078 2.222 1.00 . B B . 46 PRO CB 1 1 11 7918 2 2 2 PRO CD C 8.407 12.109 4.201 1.00 . B B . 46 PRO CD 1 1 11 7919 2 2 2 PRO CG C 9.011 10.838 3.664 1.00 . B B . 46 PRO CG 1 1 11 7920 2 2 2 PRO HA H 8.703 12.778 1.058 1.00 . B B . 46 PRO HA 1 1 11 7921 2 2 2 PRO HB2 H 9.223 10.161 1.657 1.00 . B B . 46 PRO HB2 1 1 11 7922 2 2 2 PRO HB3 H 10.306 11.490 2.116 1.00 . B B . 46 PRO HB3 1 1 11 7923 2 2 2 PRO HD2 H 7.612 11.881 4.898 1.00 . B B . 46 PRO HD2 1 1 11 7924 2 2 2 PRO HD3 H 9.163 12.718 4.671 1.00 . B B . 46 PRO HD3 1 1 11 7925 2 2 2 PRO HG2 H 8.309 10.021 3.760 1.00 . B B . 46 PRO HG2 1 1 11 7926 2 2 2 PRO HG3 H 9.920 10.612 4.200 1.00 . B B . 46 PRO HG3 1 1 11 7927 2 2 2 PRO N N 7.873 12.791 3.013 1.00 . B B . 46 PRO N 1 1 11 7928 2 2 2 PRO O O 7.030 11.089 -0.031 1.00 . B B . 46 PRO O 1 1 11 7929 2 2 3 LEU C C 4.185 11.268 0.335 1.00 . B B . 47 LEU C 1 1 11 7930 2 2 3 LEU CA C 4.861 10.388 1.400 1.00 . B B . 47 LEU CA 1 1 11 7931 2 2 3 LEU CB C 3.928 10.194 2.602 1.00 . B B . 47 LEU CB 1 1 11 7932 2 2 3 LEU CD1 C 4.746 10.510 4.942 1.00 . B B . 47 LEU CD1 1 1 11 7933 2 2 3 LEU CD2 C 3.973 8.259 4.184 1.00 . B B . 47 LEU CD2 1 1 11 7934 2 2 3 LEU CG C 4.691 9.542 3.758 1.00 . B B . 47 LEU CG 1 1 11 7935 2 2 3 LEU H H 6.108 11.322 2.891 1.00 . B B . 47 LEU H 1 1 11 7936 2 2 3 LEU HA H 5.136 9.431 0.991 1.00 . B B . 47 LEU HA 1 1 11 7937 2 2 3 LEU HB2 H 3.549 11.153 2.918 1.00 . B B . 47 LEU HB2 1 1 11 7938 2 2 3 LEU HB3 H 3.104 9.559 2.314 1.00 . B B . 47 LEU HB3 1 1 11 7939 2 2 3 LEU HD11 H 3.804 11.031 5.025 1.00 . B B . 47 LEU HD11 1 1 11 7940 2 2 3 LEU HD12 H 5.542 11.223 4.786 1.00 . B B . 47 LEU HD12 1 1 11 7941 2 2 3 LEU HD13 H 4.932 9.957 5.852 1.00 . B B . 47 LEU HD13 1 1 11 7942 2 2 3 LEU HD21 H 3.407 8.444 5.084 1.00 . B B . 47 LEU HD21 1 1 11 7943 2 2 3 LEU HD22 H 4.702 7.484 4.371 1.00 . B B . 47 LEU HD22 1 1 11 7944 2 2 3 LEU HD23 H 3.305 7.943 3.397 1.00 . B B . 47 LEU HD23 1 1 11 7945 2 2 3 LEU HG H 5.696 9.304 3.441 1.00 . B B . 47 LEU HG 1 1 11 7946 2 2 3 LEU N N 6.065 11.085 1.941 1.00 . B B . 47 LEU N 1 1 11 7947 2 2 3 LEU O O 3.850 12.404 0.606 1.00 . B B . 47 LEU O 1 1 11 7948 2 2 4 PRO C C 1.865 11.679 -1.668 1.00 . B B . 48 PRO C 1 1 11 7949 2 2 4 PRO CA C 3.366 11.495 -1.944 1.00 . B B . 48 PRO CA 1 1 11 7950 2 2 4 PRO CB C 3.584 10.617 -3.175 1.00 . B B . 48 PRO CB 1 1 11 7951 2 2 4 PRO CD C 4.373 9.365 -1.274 1.00 . B B . 48 PRO CD 1 1 11 7952 2 2 4 PRO CG C 3.746 9.232 -2.636 1.00 . B B . 48 PRO CG 1 1 11 7953 2 2 4 PRO HA H 3.854 12.444 -2.079 1.00 . B B . 48 PRO HA 1 1 11 7954 2 2 4 PRO HB2 H 2.726 10.666 -3.829 1.00 . B B . 48 PRO HB2 1 1 11 7955 2 2 4 PRO HB3 H 4.477 10.922 -3.700 1.00 . B B . 48 PRO HB3 1 1 11 7956 2 2 4 PRO HD2 H 3.963 8.631 -0.595 1.00 . B B . 48 PRO HD2 1 1 11 7957 2 2 4 PRO HD3 H 5.446 9.265 -1.340 1.00 . B B . 48 PRO HD3 1 1 11 7958 2 2 4 PRO HG2 H 2.782 8.753 -2.554 1.00 . B B . 48 PRO HG2 1 1 11 7959 2 2 4 PRO HG3 H 4.390 8.657 -3.285 1.00 . B B . 48 PRO HG3 1 1 11 7960 2 2 4 PRO N N 4.005 10.723 -0.847 1.00 . B B . 48 PRO N 1 1 11 7961 2 2 4 PRO O O 1.115 10.727 -1.706 1.00 . B B . 48 PRO O 1 1 11 7962 2 2 5 PRO C C -0.793 13.086 -2.399 1.00 . B B . 49 PRO C 1 1 11 7963 2 2 5 PRO CA C 0.039 13.184 -1.116 1.00 . B B . 49 PRO CA 1 1 11 7964 2 2 5 PRO CB C 0.052 14.615 -0.585 1.00 . B B . 49 PRO CB 1 1 11 7965 2 2 5 PRO CD C 2.294 14.119 -1.331 1.00 . B B . 49 PRO CD 1 1 11 7966 2 2 5 PRO CG C 1.289 15.229 -1.159 1.00 . B B . 49 PRO CG 1 1 11 7967 2 2 5 PRO HA H -0.341 12.514 -0.363 1.00 . B B . 49 PRO HA 1 1 11 7968 2 2 5 PRO HB2 H -0.823 15.148 -0.924 1.00 . B B . 49 PRO HB2 1 1 11 7969 2 2 5 PRO HB3 H 0.099 14.615 0.493 1.00 . B B . 49 PRO HB3 1 1 11 7970 2 2 5 PRO HD2 H 2.851 14.250 -2.245 1.00 . B B . 49 PRO HD2 1 1 11 7971 2 2 5 PRO HD3 H 2.960 14.077 -0.481 1.00 . B B . 49 PRO HD3 1 1 11 7972 2 2 5 PRO HG2 H 1.068 15.675 -2.118 1.00 . B B . 49 PRO HG2 1 1 11 7973 2 2 5 PRO HG3 H 1.677 15.976 -0.484 1.00 . B B . 49 PRO HG3 1 1 11 7974 2 2 5 PRO N N 1.469 12.901 -1.398 1.00 . B B . 49 PRO N 1 1 11 7975 2 2 5 PRO O O -1.423 14.039 -2.815 1.00 . B B . 49 PRO O 1 1 11 7976 2 2 6 TYR C C -1.281 12.915 -5.265 1.00 . B B . 50 TYR C 1 1 11 7977 2 2 6 TYR CA C -1.595 11.780 -4.284 1.00 . B B . 50 TYR CA 1 1 11 7978 2 2 6 TYR CB C -3.057 11.842 -3.840 1.00 . B B . 50 TYR CB 1 1 11 7979 2 2 6 TYR CD1 C -3.605 9.418 -3.415 1.00 . B B . 50 TYR CD1 1 1 11 7980 2 2 6 TYR CD2 C -4.548 10.501 -5.369 1.00 . B B . 50 TYR CD2 1 1 11 7981 2 2 6 TYR CE1 C -4.251 8.226 -3.766 1.00 . B B . 50 TYR CE1 1 1 11 7982 2 2 6 TYR CE2 C -5.194 9.309 -5.718 1.00 . B B . 50 TYR CE2 1 1 11 7983 2 2 6 TYR CG C -3.755 10.556 -4.218 1.00 . B B . 50 TYR CG 1 1 11 7984 2 2 6 TYR CZ C -5.045 8.172 -4.917 1.00 . B B . 50 TYR CZ 1 1 11 7985 2 2 6 TYR H H -0.290 11.186 -2.677 1.00 . B B . 50 TYR H 1 1 11 7986 2 2 6 TYR HA H -1.390 10.823 -4.738 1.00 . B B . 50 TYR HA 1 1 11 7987 2 2 6 TYR HB2 H -3.103 11.976 -2.770 1.00 . B B . 50 TYR HB2 1 1 11 7988 2 2 6 TYR HB3 H -3.547 12.671 -4.328 1.00 . B B . 50 TYR HB3 1 1 11 7989 2 2 6 TYR HD1 H -2.994 9.459 -2.528 1.00 . B B . 50 TYR HD1 1 1 11 7990 2 2 6 TYR HD2 H -4.664 11.380 -5.988 1.00 . B B . 50 TYR HD2 1 1 11 7991 2 2 6 TYR HE1 H -4.136 7.348 -3.147 1.00 . B B . 50 TYR HE1 1 1 11 7992 2 2 6 TYR HE2 H -5.806 9.267 -6.607 1.00 . B B . 50 TYR HE2 1 1 11 7993 2 2 6 TYR HH H -5.802 6.993 -6.215 1.00 . B B . 50 TYR HH 1 1 11 7994 2 2 6 TYR N N -0.802 11.941 -3.029 1.00 . B B . 50 TYR N 1 1 11 7995 2 2 6 TYR O O -0.142 13.348 -5.294 1.00 . B B . 50 TYR O 1 1 11 7996 2 2 6 TYR OXT O -2.188 13.329 -5.970 1.00 . B B . 50 TYR OXT 1 1 11 7997 2 2 6 TYR OH O -5.681 6.997 -5.263 1.00 . B B . 50 TYR OH 1 1 12 7998 1 1 1 PHE C C 3.355 -16.250 9.839 1.00 . A A . 5 PHE C 1 1 12 7999 1 1 1 PHE CA C 4.651 -15.889 10.569 1.00 . A A . 5 PHE CA 1 1 12 8000 1 1 1 PHE CB C 5.184 -17.097 11.342 1.00 . A A . 5 PHE CB 1 1 12 8001 1 1 1 PHE CD1 C 7.595 -16.722 10.713 1.00 . A A . 5 PHE CD1 1 1 12 8002 1 1 1 PHE CD2 C 6.557 -18.837 10.144 1.00 . A A . 5 PHE CD2 1 1 12 8003 1 1 1 PHE CE1 C 8.794 -17.155 10.135 1.00 . A A . 5 PHE CE1 1 1 12 8004 1 1 1 PHE CE2 C 7.755 -19.270 9.565 1.00 . A A . 5 PHE CE2 1 1 12 8005 1 1 1 PHE CG C 6.476 -17.563 10.718 1.00 . A A . 5 PHE CG 1 1 12 8006 1 1 1 PHE CZ C 8.875 -18.429 9.560 1.00 . A A . 5 PHE CZ 1 1 12 8007 1 1 1 PHE HA H 5.394 -15.541 9.871 1.00 . A A . 5 PHE HA 1 1 12 8008 1 1 1 PHE HB2 H 5.361 -16.815 12.371 1.00 . A A . 5 PHE HB2 1 1 12 8009 1 1 1 PHE HB3 H 4.459 -17.895 11.306 1.00 . A A . 5 PHE HB3 1 1 12 8010 1 1 1 PHE HD1 H 7.534 -15.738 11.156 1.00 . A A . 5 PHE HD1 1 1 12 8011 1 1 1 PHE HD2 H 5.694 -19.487 10.147 1.00 . A A . 5 PHE HD2 1 1 12 8012 1 1 1 PHE HE1 H 9.657 -16.506 10.131 1.00 . A A . 5 PHE HE1 1 1 12 8013 1 1 1 PHE HE2 H 7.817 -20.254 9.122 1.00 . A A . 5 PHE HE2 1 1 12 8014 1 1 1 PHE HZ H 9.799 -18.763 9.114 1.00 . A A . 5 PHE HZ 1 1 12 8015 1 1 1 PHE N N 4.385 -14.853 11.608 1.00 . A A . 5 PHE N 1 1 12 8016 1 1 1 PHE O O 2.416 -15.478 9.802 1.00 . A A . 5 PHE O 1 1 12 8017 1 1 2 GLU C C 1.670 -16.755 7.502 1.00 . A A . 6 GLU C 1 1 12 8018 1 1 2 GLU CA C 2.059 -17.824 8.527 1.00 . A A . 6 GLU CA 1 1 12 8019 1 1 2 GLU CB C 0.985 -17.947 9.607 1.00 . A A . 6 GLU CB 1 1 12 8020 1 1 2 GLU CD C 0.284 -19.265 11.611 1.00 . A A . 6 GLU CD 1 1 12 8021 1 1 2 GLU CG C 1.452 -18.933 10.680 1.00 . A A . 6 GLU CG 1 1 12 8022 1 1 2 GLU H H 4.063 -18.023 9.296 1.00 . A A . 6 GLU H 1 1 12 8023 1 1 2 GLU HA H 2.205 -18.776 8.042 1.00 . A A . 6 GLU HA 1 1 12 8024 1 1 2 GLU HB2 H 0.813 -16.980 10.057 1.00 . A A . 6 GLU HB2 1 1 12 8025 1 1 2 GLU HB3 H 0.067 -18.306 9.164 1.00 . A A . 6 GLU HB3 1 1 12 8026 1 1 2 GLU HG2 H 1.804 -19.838 10.208 1.00 . A A . 6 GLU HG2 1 1 12 8027 1 1 2 GLU HG3 H 2.254 -18.490 11.253 1.00 . A A . 6 GLU HG3 1 1 12 8028 1 1 2 GLU N N 3.295 -17.416 9.256 1.00 . A A . 6 GLU N 1 1 12 8029 1 1 2 GLU O O 0.944 -15.828 7.802 1.00 . A A . 6 GLU O 1 1 12 8030 1 1 2 GLU OE1 O -0.646 -19.914 11.157 1.00 . A A . 6 GLU OE1 1 1 12 8031 1 1 2 GLU OE2 O 0.337 -18.865 12.762 1.00 . A A . 6 GLU OE2 1 1 12 8032 1 1 3 ILE C C 1.134 -16.547 4.054 1.00 . A A . 7 ILE C 1 1 12 8033 1 1 3 ILE CA C 1.807 -15.865 5.252 1.00 . A A . 7 ILE CA 1 1 12 8034 1 1 3 ILE CB C 3.145 -15.253 4.839 1.00 . A A . 7 ILE CB 1 1 12 8035 1 1 3 ILE CD1 C 5.093 -13.896 5.620 1.00 . A A . 7 ILE CD1 1 1 12 8036 1 1 3 ILE CG1 C 3.760 -14.520 6.035 1.00 . A A . 7 ILE CG1 1 1 12 8037 1 1 3 ILE CG2 C 2.923 -14.261 3.696 1.00 . A A . 7 ILE CG2 1 1 12 8038 1 1 3 ILE H H 2.734 -17.629 6.072 1.00 . A A . 7 ILE H 1 1 12 8039 1 1 3 ILE HA H 1.165 -15.102 5.662 1.00 . A A . 7 ILE HA 1 1 12 8040 1 1 3 ILE HB H 3.813 -16.036 4.511 1.00 . A A . 7 ILE HB 1 1 12 8041 1 1 3 ILE HD11 H 5.082 -12.839 5.847 1.00 . A A . 7 ILE HD11 1 1 12 8042 1 1 3 ILE HD12 H 5.241 -14.034 4.559 1.00 . A A . 7 ILE HD12 1 1 12 8043 1 1 3 ILE HD13 H 5.898 -14.372 6.161 1.00 . A A . 7 ILE HD13 1 1 12 8044 1 1 3 ILE HG12 H 3.086 -13.745 6.367 1.00 . A A . 7 ILE HG12 1 1 12 8045 1 1 3 ILE HG13 H 3.926 -15.222 6.839 1.00 . A A . 7 ILE HG13 1 1 12 8046 1 1 3 ILE HG21 H 1.873 -14.230 3.445 1.00 . A A . 7 ILE HG21 1 1 12 8047 1 1 3 ILE HG22 H 3.489 -14.576 2.832 1.00 . A A . 7 ILE HG22 1 1 12 8048 1 1 3 ILE HG23 H 3.249 -13.279 4.001 1.00 . A A . 7 ILE HG23 1 1 12 8049 1 1 3 ILE N N 2.149 -16.875 6.294 1.00 . A A . 7 ILE N 1 1 12 8050 1 1 3 ILE O O 1.803 -17.140 3.229 1.00 . A A . 7 ILE O 1 1 12 8051 1 1 4 PRO C C -0.689 -16.292 1.570 1.00 . A A . 8 PRO C 1 1 12 8052 1 1 4 PRO CA C -0.926 -17.064 2.873 1.00 . A A . 8 PRO CA 1 1 12 8053 1 1 4 PRO CB C -2.383 -16.950 3.315 1.00 . A A . 8 PRO CB 1 1 12 8054 1 1 4 PRO CD C -1.062 -15.749 4.935 1.00 . A A . 8 PRO CD 1 1 12 8055 1 1 4 PRO CG C -2.409 -15.795 4.265 1.00 . A A . 8 PRO CG 1 1 12 8056 1 1 4 PRO HA H -0.654 -18.100 2.759 1.00 . A A . 8 PRO HA 1 1 12 8057 1 1 4 PRO HB2 H -3.018 -16.751 2.464 1.00 . A A . 8 PRO HB2 1 1 12 8058 1 1 4 PRO HB3 H -2.695 -17.854 3.814 1.00 . A A . 8 PRO HB3 1 1 12 8059 1 1 4 PRO HD2 H -0.743 -14.726 5.075 1.00 . A A . 8 PRO HD2 1 1 12 8060 1 1 4 PRO HD3 H -1.091 -16.270 5.880 1.00 . A A . 8 PRO HD3 1 1 12 8061 1 1 4 PRO HG2 H -2.584 -14.877 3.723 1.00 . A A . 8 PRO HG2 1 1 12 8062 1 1 4 PRO HG3 H -3.185 -15.942 5.002 1.00 . A A . 8 PRO HG3 1 1 12 8063 1 1 4 PRO N N -0.172 -16.442 3.990 1.00 . A A . 8 PRO N 1 1 12 8064 1 1 4 PRO O O -0.907 -16.803 0.489 1.00 . A A . 8 PRO O 1 1 12 8065 1 1 5 ASP C C -1.138 -14.358 -0.548 1.00 . A A . 9 ASP C 1 1 12 8066 1 1 5 ASP CA C 0.030 -14.259 0.440 1.00 . A A . 9 ASP CA 1 1 12 8067 1 1 5 ASP CB C 1.293 -14.875 -0.151 1.00 . A A . 9 ASP CB 1 1 12 8068 1 1 5 ASP CG C 1.768 -14.034 -1.339 1.00 . A A . 9 ASP CG 1 1 12 8069 1 1 5 ASP H H -0.054 -14.683 2.544 1.00 . A A . 9 ASP H 1 1 12 8070 1 1 5 ASP HA H 0.215 -13.230 0.702 1.00 . A A . 9 ASP HA 1 1 12 8071 1 1 5 ASP HB2 H 2.063 -14.899 0.607 1.00 . A A . 9 ASP HB2 1 1 12 8072 1 1 5 ASP HB3 H 1.081 -15.880 -0.479 1.00 . A A . 9 ASP HB3 1 1 12 8073 1 1 5 ASP N N -0.233 -15.068 1.665 1.00 . A A . 9 ASP N 1 1 12 8074 1 1 5 ASP O O -0.949 -14.380 -1.748 1.00 . A A . 9 ASP O 1 1 12 8075 1 1 5 ASP OD1 O 2.321 -12.973 -1.103 1.00 . A A . 9 ASP OD1 1 1 12 8076 1 1 5 ASP OD2 O 1.571 -14.468 -2.462 1.00 . A A . 9 ASP OD2 1 1 12 8077 1 1 6 ASP C C -3.714 -13.195 -1.714 1.00 . A A . 10 ASP C 1 1 12 8078 1 1 6 ASP CA C -3.520 -14.514 -0.961 1.00 . A A . 10 ASP CA 1 1 12 8079 1 1 6 ASP CB C -4.711 -14.787 -0.042 1.00 . A A . 10 ASP CB 1 1 12 8080 1 1 6 ASP CG C -5.654 -15.789 -0.712 1.00 . A A . 10 ASP CG 1 1 12 8081 1 1 6 ASP H H -2.475 -14.399 0.920 1.00 . A A . 10 ASP H 1 1 12 8082 1 1 6 ASP HA H -3.396 -15.329 -1.656 1.00 . A A . 10 ASP HA 1 1 12 8083 1 1 6 ASP HB2 H -4.358 -15.195 0.893 1.00 . A A . 10 ASP HB2 1 1 12 8084 1 1 6 ASP HB3 H -5.240 -13.865 0.145 1.00 . A A . 10 ASP HB3 1 1 12 8085 1 1 6 ASP N N -2.344 -14.418 -0.051 1.00 . A A . 10 ASP N 1 1 12 8086 1 1 6 ASP O O -3.835 -13.170 -2.923 1.00 . A A . 10 ASP O 1 1 12 8087 1 1 6 ASP OD1 O -5.165 -16.787 -1.216 1.00 . A A . 10 ASP OD1 1 1 12 8088 1 1 6 ASP OD2 O -6.848 -15.542 -0.710 1.00 . A A . 10 ASP OD2 1 1 12 8089 1 1 7 VAL C C -2.939 -9.753 -1.116 1.00 . A A . 11 VAL C 1 1 12 8090 1 1 7 VAL CA C -3.929 -10.780 -1.683 1.00 . A A . 11 VAL CA 1 1 12 8091 1 1 7 VAL CB C -5.367 -10.371 -1.365 1.00 . A A . 11 VAL CB 1 1 12 8092 1 1 7 VAL CG1 C -5.569 -10.353 0.152 1.00 . A A . 11 VAL CG1 1 1 12 8093 1 1 7 VAL CG2 C -5.638 -8.977 -1.933 1.00 . A A . 11 VAL CG2 1 1 12 8094 1 1 7 VAL H H -3.645 -12.139 -0.033 1.00 . A A . 11 VAL H 1 1 12 8095 1 1 7 VAL HA H -3.801 -10.882 -2.748 1.00 . A A . 11 VAL HA 1 1 12 8096 1 1 7 VAL HB H -6.050 -11.081 -1.809 1.00 . A A . 11 VAL HB 1 1 12 8097 1 1 7 VAL HG11 H -5.423 -11.348 0.547 1.00 . A A . 11 VAL HG11 1 1 12 8098 1 1 7 VAL HG12 H -6.571 -10.021 0.378 1.00 . A A . 11 VAL HG12 1 1 12 8099 1 1 7 VAL HG13 H -4.856 -9.678 0.602 1.00 . A A . 11 VAL HG13 1 1 12 8100 1 1 7 VAL HG21 H -4.834 -8.313 -1.655 1.00 . A A . 11 VAL HG21 1 1 12 8101 1 1 7 VAL HG22 H -6.569 -8.601 -1.535 1.00 . A A . 11 VAL HG22 1 1 12 8102 1 1 7 VAL HG23 H -5.703 -9.033 -3.010 1.00 . A A . 11 VAL HG23 1 1 12 8103 1 1 7 VAL N N -3.743 -12.098 -1.008 1.00 . A A . 11 VAL N 1 1 12 8104 1 1 7 VAL O O -2.642 -9.771 0.061 1.00 . A A . 11 VAL O 1 1 12 8105 1 1 8 PRO C C -2.201 -6.777 -0.704 1.00 . A A . 12 PRO C 1 1 12 8106 1 1 8 PRO CA C -1.491 -7.848 -1.539 1.00 . A A . 12 PRO CA 1 1 12 8107 1 1 8 PRO CB C -0.973 -7.263 -2.849 1.00 . A A . 12 PRO CB 1 1 12 8108 1 1 8 PRO CD C -2.758 -8.789 -3.413 1.00 . A A . 12 PRO CD 1 1 12 8109 1 1 8 PRO CG C -2.056 -7.528 -3.847 1.00 . A A . 12 PRO CG 1 1 12 8110 1 1 8 PRO HA H -0.680 -8.291 -0.983 1.00 . A A . 12 PRO HA 1 1 12 8111 1 1 8 PRO HB2 H -0.808 -6.201 -2.747 1.00 . A A . 12 PRO HB2 1 1 12 8112 1 1 8 PRO HB3 H -0.061 -7.759 -3.145 1.00 . A A . 12 PRO HB3 1 1 12 8113 1 1 8 PRO HD2 H -3.822 -8.704 -3.572 1.00 . A A . 12 PRO HD2 1 1 12 8114 1 1 8 PRO HD3 H -2.361 -9.644 -3.942 1.00 . A A . 12 PRO HD3 1 1 12 8115 1 1 8 PRO HG2 H -2.753 -6.704 -3.861 1.00 . A A . 12 PRO HG2 1 1 12 8116 1 1 8 PRO HG3 H -1.627 -7.664 -4.828 1.00 . A A . 12 PRO HG3 1 1 12 8117 1 1 8 PRO N N -2.457 -8.887 -1.975 1.00 . A A . 12 PRO N 1 1 12 8118 1 1 8 PRO O O -1.793 -6.463 0.397 1.00 . A A . 12 PRO O 1 1 12 8119 1 1 9 LEU C C -5.510 -5.344 -0.643 1.00 . A A . 13 LEU C 1 1 12 8120 1 1 9 LEU CA C -3.997 -5.168 -0.453 1.00 . A A . 13 LEU CA 1 1 12 8121 1 1 9 LEU CB C -3.529 -3.840 -1.051 1.00 . A A . 13 LEU CB 1 1 12 8122 1 1 9 LEU CD1 C -1.044 -4.040 -0.870 1.00 . A A . 13 LEU CD1 1 1 12 8123 1 1 9 LEU CD2 C -2.152 -1.836 -0.470 1.00 . A A . 13 LEU CD2 1 1 12 8124 1 1 9 LEU CG C -2.288 -3.351 -0.301 1.00 . A A . 13 LEU CG 1 1 12 8125 1 1 9 LEU H H -3.575 -6.485 -2.107 1.00 . A A . 13 LEU H 1 1 12 8126 1 1 9 LEU HA H -3.740 -5.214 0.593 1.00 . A A . 13 LEU HA 1 1 12 8127 1 1 9 LEU HB2 H -3.289 -3.980 -2.094 1.00 . A A . 13 LEU HB2 1 1 12 8128 1 1 9 LEU HB3 H -4.317 -3.106 -0.958 1.00 . A A . 13 LEU HB3 1 1 12 8129 1 1 9 LEU HD11 H -0.618 -4.689 -0.119 1.00 . A A . 13 LEU HD11 1 1 12 8130 1 1 9 LEU HD12 H -0.317 -3.292 -1.153 1.00 . A A . 13 LEU HD12 1 1 12 8131 1 1 9 LEU HD13 H -1.320 -4.620 -1.736 1.00 . A A . 13 LEU HD13 1 1 12 8132 1 1 9 LEU HD21 H -1.129 -1.544 -0.285 1.00 . A A . 13 LEU HD21 1 1 12 8133 1 1 9 LEU HD22 H -2.803 -1.337 0.231 1.00 . A A . 13 LEU HD22 1 1 12 8134 1 1 9 LEU HD23 H -2.428 -1.561 -1.478 1.00 . A A . 13 LEU HD23 1 1 12 8135 1 1 9 LEU HG H -2.383 -3.590 0.748 1.00 . A A . 13 LEU HG 1 1 12 8136 1 1 9 LEU N N -3.262 -6.216 -1.219 1.00 . A A . 13 LEU N 1 1 12 8137 1 1 9 LEU O O -5.938 -6.070 -1.518 1.00 . A A . 13 LEU O 1 1 12 8138 1 1 10 PRO C C -8.263 -4.009 -1.139 1.00 . A A . 14 PRO C 1 1 12 8139 1 1 10 PRO CA C -7.752 -4.769 0.088 1.00 . A A . 14 PRO CA 1 1 12 8140 1 1 10 PRO CB C -8.241 -4.132 1.385 1.00 . A A . 14 PRO CB 1 1 12 8141 1 1 10 PRO CD C -5.850 -3.771 1.266 1.00 . A A . 14 PRO CD 1 1 12 8142 1 1 10 PRO CG C -7.140 -3.213 1.811 1.00 . A A . 14 PRO CG 1 1 12 8143 1 1 10 PRO HA H -8.059 -5.800 0.047 1.00 . A A . 14 PRO HA 1 1 12 8144 1 1 10 PRO HB2 H -9.149 -3.573 1.208 1.00 . A A . 14 PRO HB2 1 1 12 8145 1 1 10 PRO HB3 H -8.408 -4.890 2.135 1.00 . A A . 14 PRO HB3 1 1 12 8146 1 1 10 PRO HD2 H -5.230 -2.978 0.876 1.00 . A A . 14 PRO HD2 1 1 12 8147 1 1 10 PRO HD3 H -5.324 -4.323 2.030 1.00 . A A . 14 PRO HD3 1 1 12 8148 1 1 10 PRO HG2 H -7.313 -2.225 1.414 1.00 . A A . 14 PRO HG2 1 1 12 8149 1 1 10 PRO HG3 H -7.094 -3.171 2.890 1.00 . A A . 14 PRO HG3 1 1 12 8150 1 1 10 PRO N N -6.276 -4.671 0.183 1.00 . A A . 14 PRO N 1 1 12 8151 1 1 10 PRO O O -7.504 -3.393 -1.859 1.00 . A A . 14 PRO O 1 1 12 8152 1 1 11 ALA C C -9.916 -1.833 -2.444 1.00 . A A . 15 ALA C 1 1 12 8153 1 1 11 ALA CA C -10.099 -3.348 -2.580 1.00 . A A . 15 ALA CA 1 1 12 8154 1 1 11 ALA CB C -11.584 -3.706 -2.594 1.00 . A A . 15 ALA CB 1 1 12 8155 1 1 11 ALA H H -10.137 -4.567 -0.802 1.00 . A A . 15 ALA H 1 1 12 8156 1 1 11 ALA HA H -9.628 -3.703 -3.484 1.00 . A A . 15 ALA HA 1 1 12 8157 1 1 11 ALA HB1 H -11.990 -3.600 -1.599 1.00 . A A . 15 ALA HB1 1 1 12 8158 1 1 11 ALA HB2 H -11.705 -4.728 -2.923 1.00 . A A . 15 ALA HB2 1 1 12 8159 1 1 11 ALA HB3 H -12.108 -3.045 -3.269 1.00 . A A . 15 ALA HB3 1 1 12 8160 1 1 11 ALA N N -9.542 -4.057 -1.391 1.00 . A A . 15 ALA N 1 1 12 8161 1 1 11 ALA O O -9.747 -1.312 -1.358 1.00 . A A . 15 ALA O 1 1 12 8162 1 1 12 GLY C C -8.314 0.707 -3.259 1.00 . A A . 16 GLY C 1 1 12 8163 1 1 12 GLY CA C -9.787 0.356 -3.485 1.00 . A A . 16 GLY CA 1 1 12 8164 1 1 12 GLY H H -10.094 -1.568 -4.403 1.00 . A A . 16 GLY H 1 1 12 8165 1 1 12 GLY HA2 H -10.120 0.789 -4.416 1.00 . A A . 16 GLY HA2 1 1 12 8166 1 1 12 GLY HA3 H -10.379 0.750 -2.672 1.00 . A A . 16 GLY HA3 1 1 12 8167 1 1 12 GLY N N -9.953 -1.126 -3.540 1.00 . A A . 16 GLY N 1 1 12 8168 1 1 12 GLY O O -7.988 1.781 -2.798 1.00 . A A . 16 GLY O 1 1 12 8169 1 1 13 TRP C C -5.189 -0.081 -4.670 1.00 . A A . 17 TRP C 1 1 12 8170 1 1 13 TRP CA C -5.972 0.095 -3.368 1.00 . A A . 17 TRP CA 1 1 12 8171 1 1 13 TRP CB C -5.518 -0.935 -2.341 1.00 . A A . 17 TRP CB 1 1 12 8172 1 1 13 TRP CD1 C -6.792 -0.511 -0.208 1.00 . A A . 17 TRP CD1 1 1 12 8173 1 1 13 TRP CD2 C -4.752 0.430 -0.209 1.00 . A A . 17 TRP CD2 1 1 12 8174 1 1 13 TRP CE2 C -5.340 0.745 1.037 1.00 . A A . 17 TRP CE2 1 1 12 8175 1 1 13 TRP CE3 C -3.459 0.903 -0.475 1.00 . A A . 17 TRP CE3 1 1 12 8176 1 1 13 TRP CG C -5.690 -0.369 -0.976 1.00 . A A . 17 TRP CG 1 1 12 8177 1 1 13 TRP CH2 C -3.371 1.971 1.706 1.00 . A A . 17 TRP CH2 1 1 12 8178 1 1 13 TRP CZ2 C -4.661 1.508 1.990 1.00 . A A . 17 TRP CZ2 1 1 12 8179 1 1 13 TRP CZ3 C -2.774 1.669 0.477 1.00 . A A . 17 TRP CZ3 1 1 12 8180 1 1 13 TRP H H -7.702 -1.058 -3.937 1.00 . A A . 17 TRP H 1 1 12 8181 1 1 13 TRP HA H -5.836 1.089 -2.975 1.00 . A A . 17 TRP HA 1 1 12 8182 1 1 13 TRP HB2 H -6.113 -1.829 -2.441 1.00 . A A . 17 TRP HB2 1 1 12 8183 1 1 13 TRP HB3 H -4.478 -1.174 -2.505 1.00 . A A . 17 TRP HB3 1 1 12 8184 1 1 13 TRP HD1 H -7.685 -1.055 -0.485 1.00 . A A . 17 TRP HD1 1 1 12 8185 1 1 13 TRP HE1 H -7.232 0.203 1.728 1.00 . A A . 17 TRP HE1 1 1 12 8186 1 1 13 TRP HE3 H -2.989 0.676 -1.420 1.00 . A A . 17 TRP HE3 1 1 12 8187 1 1 13 TRP HH2 H -2.833 2.558 2.433 1.00 . A A . 17 TRP HH2 1 1 12 8188 1 1 13 TRP HZ2 H -5.126 1.738 2.936 1.00 . A A . 17 TRP HZ2 1 1 12 8189 1 1 13 TRP HZ3 H -1.783 2.029 0.263 1.00 . A A . 17 TRP HZ3 1 1 12 8190 1 1 13 TRP N N -7.422 -0.192 -3.574 1.00 . A A . 17 TRP N 1 1 12 8191 1 1 13 TRP NE1 N -6.586 0.150 0.992 1.00 . A A . 17 TRP NE1 1 1 12 8192 1 1 13 TRP O O -5.527 -0.898 -5.503 1.00 . A A . 17 TRP O 1 1 12 8193 1 1 14 GLU C C -1.839 0.589 -5.796 1.00 . A A . 18 GLU C 1 1 12 8194 1 1 14 GLU CA C -3.338 0.540 -6.099 1.00 . A A . 18 GLU CA 1 1 12 8195 1 1 14 GLU CB C -3.722 1.743 -6.960 1.00 . A A . 18 GLU CB 1 1 12 8196 1 1 14 GLU CD C -5.913 1.120 -7.991 1.00 . A A . 18 GLU CD 1 1 12 8197 1 1 14 GLU CG C -4.408 1.260 -8.238 1.00 . A A . 18 GLU CG 1 1 12 8198 1 1 14 GLU H H -3.881 1.332 -4.166 1.00 . A A . 18 GLU H 1 1 12 8199 1 1 14 GLU HA H -3.590 -0.374 -6.610 1.00 . A A . 18 GLU HA 1 1 12 8200 1 1 14 GLU HB2 H -4.390 2.384 -6.409 1.00 . A A . 18 GLU HB2 1 1 12 8201 1 1 14 GLU HB3 H -2.832 2.296 -7.221 1.00 . A A . 18 GLU HB3 1 1 12 8202 1 1 14 GLU HG2 H -4.238 1.977 -9.028 1.00 . A A . 18 GLU HG2 1 1 12 8203 1 1 14 GLU HG3 H -3.998 0.303 -8.525 1.00 . A A . 18 GLU HG3 1 1 12 8204 1 1 14 GLU N N -4.141 0.677 -4.850 1.00 . A A . 18 GLU N 1 1 12 8205 1 1 14 GLU O O -1.248 1.656 -5.756 1.00 . A A . 18 GLU O 1 1 12 8206 1 1 14 GLU OE1 O -6.298 1.030 -6.837 1.00 . A A . 18 GLU OE1 1 1 12 8207 1 1 14 GLU OE2 O -6.652 1.104 -8.961 1.00 . A A . 18 GLU OE2 1 1 12 8208 1 1 15 MET C C 0.935 0.111 -6.570 1.00 . A A . 19 MET C 1 1 12 8209 1 1 15 MET CA C 0.258 -0.501 -5.354 1.00 . A A . 19 MET CA 1 1 12 8210 1 1 15 MET CB C 0.730 -1.939 -5.156 1.00 . A A . 19 MET CB 1 1 12 8211 1 1 15 MET CE C -1.460 -4.026 -4.643 1.00 . A A . 19 MET CE 1 1 12 8212 1 1 15 MET CG C 0.294 -2.814 -6.338 1.00 . A A . 19 MET CG 1 1 12 8213 1 1 15 MET H H -1.671 -1.395 -5.655 1.00 . A A . 19 MET H 1 1 12 8214 1 1 15 MET HA H 0.472 0.082 -4.474 1.00 . A A . 19 MET HA 1 1 12 8215 1 1 15 MET HB2 H 1.800 -1.933 -5.103 1.00 . A A . 19 MET HB2 1 1 12 8216 1 1 15 MET HB3 H 0.332 -2.334 -4.234 1.00 . A A . 19 MET HB3 1 1 12 8217 1 1 15 MET HE1 H -1.482 -2.953 -4.521 1.00 . A A . 19 MET HE1 1 1 12 8218 1 1 15 MET HE2 H -1.314 -4.491 -3.681 1.00 . A A . 19 MET HE2 1 1 12 8219 1 1 15 MET HE3 H -2.393 -4.365 -5.067 1.00 . A A . 19 MET HE3 1 1 12 8220 1 1 15 MET HG2 H -0.574 -2.385 -6.812 1.00 . A A . 19 MET HG2 1 1 12 8221 1 1 15 MET HG3 H 1.099 -2.869 -7.056 1.00 . A A . 19 MET HG3 1 1 12 8222 1 1 15 MET N N -1.202 -0.542 -5.608 1.00 . A A . 19 MET N 1 1 12 8223 1 1 15 MET O O 0.840 -0.393 -7.671 1.00 . A A . 19 MET O 1 1 12 8224 1 1 15 MET SD S -0.097 -4.479 -5.746 1.00 . A A . 19 MET SD 1 1 12 8225 1 1 16 ALA C C 3.665 2.314 -7.094 1.00 . A A . 20 ALA C 1 1 12 8226 1 1 16 ALA CA C 2.272 1.869 -7.522 1.00 . A A . 20 ALA CA 1 1 12 8227 1 1 16 ALA CB C 1.375 3.067 -7.846 1.00 . A A . 20 ALA CB 1 1 12 8228 1 1 16 ALA H H 1.651 1.586 -5.484 1.00 . A A . 20 ALA H 1 1 12 8229 1 1 16 ALA HA H 2.327 1.205 -8.371 1.00 . A A . 20 ALA HA 1 1 12 8230 1 1 16 ALA HB1 H 0.944 3.451 -6.934 1.00 . A A . 20 ALA HB1 1 1 12 8231 1 1 16 ALA HB2 H 0.581 2.753 -8.511 1.00 . A A . 20 ALA HB2 1 1 12 8232 1 1 16 ALA HB3 H 1.959 3.838 -8.323 1.00 . A A . 20 ALA HB3 1 1 12 8233 1 1 16 ALA N N 1.599 1.200 -6.381 1.00 . A A . 20 ALA N 1 1 12 8234 1 1 16 ALA O O 4.185 1.854 -6.096 1.00 . A A . 20 ALA O 1 1 12 8235 1 1 17 LYS C C 5.722 5.154 -7.318 1.00 . A A . 21 LYS C 1 1 12 8236 1 1 17 LYS CA C 5.647 3.636 -7.423 1.00 . A A . 21 LYS CA 1 1 12 8237 1 1 17 LYS CB C 6.581 3.115 -8.515 1.00 . A A . 21 LYS CB 1 1 12 8238 1 1 17 LYS CD C 8.133 1.208 -8.955 1.00 . A A . 21 LYS CD 1 1 12 8239 1 1 17 LYS CE C 7.918 0.862 -10.429 1.00 . A A . 21 LYS CE 1 1 12 8240 1 1 17 LYS CG C 6.799 1.613 -8.326 1.00 . A A . 21 LYS CG 1 1 12 8241 1 1 17 LYS H H 3.862 3.559 -8.632 1.00 . A A . 21 LYS H 1 1 12 8242 1 1 17 LYS HA H 5.901 3.194 -6.478 1.00 . A A . 21 LYS HA 1 1 12 8243 1 1 17 LYS HB2 H 6.139 3.295 -9.483 1.00 . A A . 21 LYS HB2 1 1 12 8244 1 1 17 LYS HB3 H 7.529 3.627 -8.451 1.00 . A A . 21 LYS HB3 1 1 12 8245 1 1 17 LYS HD2 H 8.832 2.027 -8.876 1.00 . A A . 21 LYS HD2 1 1 12 8246 1 1 17 LYS HD3 H 8.528 0.346 -8.438 1.00 . A A . 21 LYS HD3 1 1 12 8247 1 1 17 LYS HE2 H 7.090 0.177 -10.539 1.00 . A A . 21 LYS HE2 1 1 12 8248 1 1 17 LYS HE3 H 7.742 1.760 -11.005 1.00 . A A . 21 LYS HE3 1 1 12 8249 1 1 17 LYS HG2 H 6.813 1.381 -7.272 1.00 . A A . 21 LYS HG2 1 1 12 8250 1 1 17 LYS HG3 H 5.996 1.070 -8.803 1.00 . A A . 21 LYS HG3 1 1 12 8251 1 1 17 LYS HZ1 H 9.997 0.755 -10.495 1.00 . A A . 21 LYS HZ1 1 1 12 8252 1 1 17 LYS HZ2 H 9.228 0.183 -11.899 1.00 . A A . 21 LYS HZ2 1 1 12 8253 1 1 17 LYS HZ3 H 9.227 -0.756 -10.483 1.00 . A A . 21 LYS HZ3 1 1 12 8254 1 1 17 LYS N N 4.284 3.195 -7.826 1.00 . A A . 21 LYS N 1 1 12 8255 1 1 17 LYS NZ N 9.189 0.212 -10.859 1.00 . A A . 21 LYS NZ 1 1 12 8256 1 1 17 LYS O O 5.174 5.878 -8.127 1.00 . A A . 21 LYS O 1 1 12 8257 1 1 18 THR C C 7.962 7.508 -5.857 1.00 . A A . 22 THR C 1 1 12 8258 1 1 18 THR CA C 6.515 7.111 -6.139 1.00 . A A . 22 THR CA 1 1 12 8259 1 1 18 THR CB C 5.640 7.423 -4.925 1.00 . A A . 22 THR CB 1 1 12 8260 1 1 18 THR CG2 C 6.139 6.614 -3.725 1.00 . A A . 22 THR CG2 1 1 12 8261 1 1 18 THR H H 6.831 5.029 -5.676 1.00 . A A . 22 THR H 1 1 12 8262 1 1 18 THR HA H 6.138 7.629 -7.006 1.00 . A A . 22 THR HA 1 1 12 8263 1 1 18 THR HB H 4.616 7.159 -5.138 1.00 . A A . 22 THR HB 1 1 12 8264 1 1 18 THR HG1 H 5.346 9.294 -5.373 1.00 . A A . 22 THR HG1 1 1 12 8265 1 1 18 THR HG21 H 7.161 6.887 -3.511 1.00 . A A . 22 THR HG21 1 1 12 8266 1 1 18 THR HG22 H 6.094 5.559 -3.954 1.00 . A A . 22 THR HG22 1 1 12 8267 1 1 18 THR HG23 H 5.521 6.823 -2.862 1.00 . A A . 22 THR HG23 1 1 12 8268 1 1 18 THR N N 6.399 5.638 -6.317 1.00 . A A . 22 THR N 1 1 12 8269 1 1 18 THR O O 8.887 6.759 -6.105 1.00 . A A . 22 THR O 1 1 12 8270 1 1 18 THR OG1 O 5.727 8.811 -4.636 1.00 . A A . 22 THR OG1 1 1 12 8271 1 1 19 SER C C 10.504 8.878 -6.174 1.00 . A A . 23 SER C 1 1 12 8272 1 1 19 SER CA C 9.536 9.167 -5.012 1.00 . A A . 23 SER CA 1 1 12 8273 1 1 19 SER CB C 9.939 8.403 -3.748 1.00 . A A . 23 SER CB 1 1 12 8274 1 1 19 SER H H 7.385 9.261 -5.139 1.00 . A A . 23 SER H 1 1 12 8275 1 1 19 SER HA H 9.518 10.226 -4.802 1.00 . A A . 23 SER HA 1 1 12 8276 1 1 19 SER HB2 H 9.491 8.872 -2.885 1.00 . A A . 23 SER HB2 1 1 12 8277 1 1 19 SER HB3 H 9.594 7.381 -3.822 1.00 . A A . 23 SER HB3 1 1 12 8278 1 1 19 SER HG H 11.571 8.924 -2.831 1.00 . A A . 23 SER HG 1 1 12 8279 1 1 19 SER N N 8.157 8.688 -5.331 1.00 . A A . 23 SER N 1 1 12 8280 1 1 19 SER O O 10.618 9.661 -7.097 1.00 . A A . 23 SER O 1 1 12 8281 1 1 19 SER OG O 11.352 8.417 -3.616 1.00 . A A . 23 SER OG 1 1 12 8282 1 1 20 SER C C 12.018 6.006 -7.713 1.00 . A A . 24 SER C 1 1 12 8283 1 1 20 SER CA C 12.156 7.465 -7.250 1.00 . A A . 24 SER CA 1 1 12 8284 1 1 20 SER CB C 13.540 7.697 -6.647 1.00 . A A . 24 SER CB 1 1 12 8285 1 1 20 SER H H 11.112 7.150 -5.392 1.00 . A A . 24 SER H 1 1 12 8286 1 1 20 SER HA H 12.000 8.138 -8.077 1.00 . A A . 24 SER HA 1 1 12 8287 1 1 20 SER HB2 H 13.594 8.698 -6.245 1.00 . A A . 24 SER HB2 1 1 12 8288 1 1 20 SER HB3 H 13.711 6.981 -5.857 1.00 . A A . 24 SER HB3 1 1 12 8289 1 1 20 SER HG H 14.420 6.664 -8.040 1.00 . A A . 24 SER HG 1 1 12 8290 1 1 20 SER N N 11.204 7.771 -6.141 1.00 . A A . 24 SER N 1 1 12 8291 1 1 20 SER O O 12.693 5.575 -8.626 1.00 . A A . 24 SER O 1 1 12 8292 1 1 20 SER OG O 14.527 7.537 -7.655 1.00 . A A . 24 SER OG 1 1 12 8293 1 1 21 GLY C C 10.321 3.020 -6.400 1.00 . A A . 25 GLY C 1 1 12 8294 1 1 21 GLY CA C 10.997 3.819 -7.519 1.00 . A A . 25 GLY CA 1 1 12 8295 1 1 21 GLY H H 10.617 5.593 -6.364 1.00 . A A . 25 GLY H 1 1 12 8296 1 1 21 GLY HA2 H 10.388 3.774 -8.409 1.00 . A A . 25 GLY HA2 1 1 12 8297 1 1 21 GLY HA3 H 11.969 3.394 -7.726 1.00 . A A . 25 GLY HA3 1 1 12 8298 1 1 21 GLY N N 11.155 5.238 -7.098 1.00 . A A . 25 GLY N 1 1 12 8299 1 1 21 GLY O O 9.679 2.019 -6.642 1.00 . A A . 25 GLY O 1 1 12 8300 1 1 22 GLN C C 8.350 2.433 -4.349 1.00 . A A . 26 GLN C 1 1 12 8301 1 1 22 GLN CA C 9.825 2.719 -4.041 1.00 . A A . 26 GLN CA 1 1 12 8302 1 1 22 GLN CB C 9.949 3.658 -2.840 1.00 . A A . 26 GLN CB 1 1 12 8303 1 1 22 GLN CD C 11.110 2.734 -0.830 1.00 . A A . 26 GLN CD 1 1 12 8304 1 1 22 GLN CG C 9.764 2.860 -1.548 1.00 . A A . 26 GLN CG 1 1 12 8305 1 1 22 GLN H H 10.984 4.265 -4.999 1.00 . A A . 26 GLN H 1 1 12 8306 1 1 22 GLN HA H 10.353 1.800 -3.846 1.00 . A A . 26 GLN HA 1 1 12 8307 1 1 22 GLN HB2 H 10.927 4.117 -2.844 1.00 . A A . 26 GLN HB2 1 1 12 8308 1 1 22 GLN HB3 H 9.191 4.424 -2.902 1.00 . A A . 26 GLN HB3 1 1 12 8309 1 1 22 GLN HE21 H 12.113 2.300 -2.487 1.00 . A A . 26 GLN HE21 1 1 12 8310 1 1 22 GLN HE22 H 13.044 2.355 -1.069 1.00 . A A . 26 GLN HE22 1 1 12 8311 1 1 22 GLN HG2 H 9.061 3.372 -0.907 1.00 . A A . 26 GLN HG2 1 1 12 8312 1 1 22 GLN HG3 H 9.386 1.877 -1.782 1.00 . A A . 26 GLN HG3 1 1 12 8313 1 1 22 GLN N N 10.461 3.456 -5.175 1.00 . A A . 26 GLN N 1 1 12 8314 1 1 22 GLN NE2 N 12.177 2.438 -1.519 1.00 . A A . 26 GLN NE2 1 1 12 8315 1 1 22 GLN O O 7.634 3.286 -4.846 1.00 . A A . 26 GLN O 1 1 12 8316 1 1 22 GLN OE1 O 11.190 2.905 0.371 1.00 . A A . 26 GLN OE1 1 1 12 8317 1 1 23 ARG C C 5.557 1.460 -3.262 1.00 . A A . 27 ARG C 1 1 12 8318 1 1 23 ARG CA C 6.467 0.914 -4.349 1.00 . A A . 27 ARG CA 1 1 12 8319 1 1 23 ARG CB C 6.365 -0.613 -4.366 1.00 . A A . 27 ARG CB 1 1 12 8320 1 1 23 ARG CD C 4.842 -2.160 -5.597 1.00 . A A . 27 ARG CD 1 1 12 8321 1 1 23 ARG CG C 5.903 -1.068 -5.748 1.00 . A A . 27 ARG CG 1 1 12 8322 1 1 23 ARG CZ C 4.795 -4.491 -6.328 1.00 . A A . 27 ARG CZ 1 1 12 8323 1 1 23 ARG H H 8.482 0.568 -3.667 1.00 . A A . 27 ARG H 1 1 12 8324 1 1 23 ARG HA H 6.177 1.309 -5.310 1.00 . A A . 27 ARG HA 1 1 12 8325 1 1 23 ARG HB2 H 7.321 -1.049 -4.138 1.00 . A A . 27 ARG HB2 1 1 12 8326 1 1 23 ARG HB3 H 5.644 -0.933 -3.628 1.00 . A A . 27 ARG HB3 1 1 12 8327 1 1 23 ARG HD2 H 4.741 -2.446 -4.561 1.00 . A A . 27 ARG HD2 1 1 12 8328 1 1 23 ARG HD3 H 3.894 -1.821 -5.987 1.00 . A A . 27 ARG HD3 1 1 12 8329 1 1 23 ARG HE H 6.123 -3.173 -7.000 1.00 . A A . 27 ARG HE 1 1 12 8330 1 1 23 ARG HG2 H 5.479 -0.225 -6.278 1.00 . A A . 27 ARG HG2 1 1 12 8331 1 1 23 ARG HG3 H 6.743 -1.458 -6.299 1.00 . A A . 27 ARG HG3 1 1 12 8332 1 1 23 ARG HH11 H 3.395 -3.961 -4.986 1.00 . A A . 27 ARG HH11 1 1 12 8333 1 1 23 ARG HH12 H 3.354 -5.612 -5.497 1.00 . A A . 27 ARG HH12 1 1 12 8334 1 1 23 ARG HH21 H 6.049 -5.321 -7.648 1.00 . A A . 27 ARG HH21 1 1 12 8335 1 1 23 ARG HH22 H 4.845 -6.379 -6.993 1.00 . A A . 27 ARG HH22 1 1 12 8336 1 1 23 ARG N N 7.891 1.242 -4.063 1.00 . A A . 27 ARG N 1 1 12 8337 1 1 23 ARG NE N 5.355 -3.306 -6.405 1.00 . A A . 27 ARG NE 1 1 12 8338 1 1 23 ARG NH1 N 3.767 -4.702 -5.542 1.00 . A A . 27 ARG NH1 1 1 12 8339 1 1 23 ARG NH2 N 5.265 -5.473 -7.046 1.00 . A A . 27 ARG NH2 1 1 12 8340 1 1 23 ARG O O 5.604 1.029 -2.126 1.00 . A A . 27 ARG O 1 1 12 8341 1 1 24 TYR C C 2.384 2.281 -2.879 1.00 . A A . 28 TYR C 1 1 12 8342 1 1 24 TYR CA C 3.748 2.884 -2.594 1.00 . A A . 28 TYR CA 1 1 12 8343 1 1 24 TYR CB C 3.750 4.420 -2.720 1.00 . A A . 28 TYR CB 1 1 12 8344 1 1 24 TYR CD1 C 3.556 4.809 -5.200 1.00 . A A . 28 TYR CD1 1 1 12 8345 1 1 24 TYR CD2 C 1.656 5.344 -3.793 1.00 . A A . 28 TYR CD2 1 1 12 8346 1 1 24 TYR CE1 C 2.837 5.224 -6.325 1.00 . A A . 28 TYR CE1 1 1 12 8347 1 1 24 TYR CE2 C 0.939 5.759 -4.923 1.00 . A A . 28 TYR CE2 1 1 12 8348 1 1 24 TYR CG C 2.968 4.870 -3.936 1.00 . A A . 28 TYR CG 1 1 12 8349 1 1 24 TYR CZ C 1.534 5.696 -6.189 1.00 . A A . 28 TYR CZ 1 1 12 8350 1 1 24 TYR H H 4.645 2.668 -4.537 1.00 . A A . 28 TYR H 1 1 12 8351 1 1 24 TYR HA H 4.068 2.592 -1.605 1.00 . A A . 28 TYR HA 1 1 12 8352 1 1 24 TYR HB2 H 3.303 4.847 -1.835 1.00 . A A . 28 TYR HB2 1 1 12 8353 1 1 24 TYR HB3 H 4.768 4.765 -2.804 1.00 . A A . 28 TYR HB3 1 1 12 8354 1 1 24 TYR HD1 H 4.565 4.445 -5.305 1.00 . A A . 28 TYR HD1 1 1 12 8355 1 1 24 TYR HD2 H 1.199 5.393 -2.814 1.00 . A A . 28 TYR HD2 1 1 12 8356 1 1 24 TYR HE1 H 3.287 5.178 -7.302 1.00 . A A . 28 TYR HE1 1 1 12 8357 1 1 24 TYR HE2 H -0.072 6.123 -4.818 1.00 . A A . 28 TYR HE2 1 1 12 8358 1 1 24 TYR HH H 1.164 5.599 -8.057 1.00 . A A . 28 TYR HH 1 1 12 8359 1 1 24 TYR N N 4.694 2.364 -3.607 1.00 . A A . 28 TYR N 1 1 12 8360 1 1 24 TYR O O 2.217 1.511 -3.806 1.00 . A A . 28 TYR O 1 1 12 8361 1 1 24 TYR OH O 0.839 6.101 -7.307 1.00 . A A . 28 TYR OH 1 1 12 8362 1 1 25 PHE C C -0.950 3.119 -2.342 1.00 . A A . 29 PHE C 1 1 12 8363 1 1 25 PHE CA C 0.082 2.014 -2.300 1.00 . A A . 29 PHE CA 1 1 12 8364 1 1 25 PHE CB C -0.089 1.035 -1.141 1.00 . A A . 29 PHE CB 1 1 12 8365 1 1 25 PHE CD1 C 2.291 0.178 -0.890 1.00 . A A . 29 PHE CD1 1 1 12 8366 1 1 25 PHE CD2 C 0.641 -1.209 -1.994 1.00 . A A . 29 PHE CD2 1 1 12 8367 1 1 25 PHE CE1 C 3.265 -0.803 -1.123 1.00 . A A . 29 PHE CE1 1 1 12 8368 1 1 25 PHE CE2 C 1.614 -2.183 -2.233 1.00 . A A . 29 PHE CE2 1 1 12 8369 1 1 25 PHE CG C 0.971 -0.032 -1.326 1.00 . A A . 29 PHE CG 1 1 12 8370 1 1 25 PHE CZ C 2.927 -1.982 -1.799 1.00 . A A . 29 PHE CZ 1 1 12 8371 1 1 25 PHE H H 1.581 3.206 -1.336 1.00 . A A . 29 PHE H 1 1 12 8372 1 1 25 PHE HA H 0.070 1.473 -3.231 1.00 . A A . 29 PHE HA 1 1 12 8373 1 1 25 PHE HB2 H 0.041 1.542 -0.193 1.00 . A A . 29 PHE HB2 1 1 12 8374 1 1 25 PHE HB3 H -1.068 0.586 -1.184 1.00 . A A . 29 PHE HB3 1 1 12 8375 1 1 25 PHE HD1 H 2.559 1.089 -0.368 1.00 . A A . 29 PHE HD1 1 1 12 8376 1 1 25 PHE HD2 H -0.369 -1.363 -2.329 1.00 . A A . 29 PHE HD2 1 1 12 8377 1 1 25 PHE HE1 H 4.280 -0.647 -0.795 1.00 . A A . 29 PHE HE1 1 1 12 8378 1 1 25 PHE HE2 H 1.352 -3.092 -2.759 1.00 . A A . 29 PHE HE2 1 1 12 8379 1 1 25 PHE HZ H 3.677 -2.735 -1.990 1.00 . A A . 29 PHE HZ 1 1 12 8380 1 1 25 PHE N N 1.421 2.596 -2.085 1.00 . A A . 29 PHE N 1 1 12 8381 1 1 25 PHE O O -1.430 3.605 -1.334 1.00 . A A . 29 PHE O 1 1 12 8382 1 1 26 LEU C C -3.634 4.150 -3.311 1.00 . A A . 30 LEU C 1 1 12 8383 1 1 26 LEU CA C -2.244 4.628 -3.727 1.00 . A A . 30 LEU CA 1 1 12 8384 1 1 26 LEU CB C -2.155 4.932 -5.240 1.00 . A A . 30 LEU CB 1 1 12 8385 1 1 26 LEU CD1 C -2.264 7.390 -4.454 1.00 . A A . 30 LEU CD1 1 1 12 8386 1 1 26 LEU CD2 C -1.637 6.830 -6.796 1.00 . A A . 30 LEU CD2 1 1 12 8387 1 1 26 LEU CG C -2.493 6.401 -5.607 1.00 . A A . 30 LEU CG 1 1 12 8388 1 1 26 LEU H H -0.840 3.119 -4.320 1.00 . A A . 30 LEU H 1 1 12 8389 1 1 26 LEU HA H -1.954 5.478 -3.145 1.00 . A A . 30 LEU HA 1 1 12 8390 1 1 26 LEU HB2 H -1.154 4.713 -5.577 1.00 . A A . 30 LEU HB2 1 1 12 8391 1 1 26 LEU HB3 H -2.843 4.282 -5.760 1.00 . A A . 30 LEU HB3 1 1 12 8392 1 1 26 LEU HD11 H -1.394 7.099 -3.897 1.00 . A A . 30 LEU HD11 1 1 12 8393 1 1 26 LEU HD12 H -3.126 7.389 -3.805 1.00 . A A . 30 LEU HD12 1 1 12 8394 1 1 26 LEU HD13 H -2.119 8.381 -4.857 1.00 . A A . 30 LEU HD13 1 1 12 8395 1 1 26 LEU HD21 H -0.754 7.337 -6.437 1.00 . A A . 30 LEU HD21 1 1 12 8396 1 1 26 LEU HD22 H -2.206 7.499 -7.425 1.00 . A A . 30 LEU HD22 1 1 12 8397 1 1 26 LEU HD23 H -1.347 5.959 -7.363 1.00 . A A . 30 LEU HD23 1 1 12 8398 1 1 26 LEU HG H -3.511 6.445 -5.902 1.00 . A A . 30 LEU HG 1 1 12 8399 1 1 26 LEU N N -1.268 3.532 -3.535 1.00 . A A . 30 LEU N 1 1 12 8400 1 1 26 LEU O O -4.264 3.354 -3.984 1.00 . A A . 30 LEU O 1 1 12 8401 1 1 27 ASN C C -6.536 5.003 -2.384 1.00 . A A . 31 ASN C 1 1 12 8402 1 1 27 ASN CA C -5.436 4.201 -1.689 1.00 . A A . 31 ASN CA 1 1 12 8403 1 1 27 ASN CB C -5.404 4.513 -0.193 1.00 . A A . 31 ASN CB 1 1 12 8404 1 1 27 ASN CG C -6.712 4.071 0.455 1.00 . A A . 31 ASN CG 1 1 12 8405 1 1 27 ASN H H -3.559 5.246 -1.662 1.00 . A A . 31 ASN H 1 1 12 8406 1 1 27 ASN HA H -5.583 3.143 -1.842 1.00 . A A . 31 ASN HA 1 1 12 8407 1 1 27 ASN HB2 H -4.588 3.982 0.272 1.00 . A A . 31 ASN HB2 1 1 12 8408 1 1 27 ASN HB3 H -5.272 5.575 -0.048 1.00 . A A . 31 ASN HB3 1 1 12 8409 1 1 27 ASN HD21 H -5.848 3.620 2.181 1.00 . A A . 31 ASN HD21 1 1 12 8410 1 1 27 ASN HD22 H -7.519 3.355 2.112 1.00 . A A . 31 ASN HD22 1 1 12 8411 1 1 27 ASN N N -4.100 4.620 -2.187 1.00 . A A . 31 ASN N 1 1 12 8412 1 1 27 ASN ND2 N -6.693 3.648 1.685 1.00 . A A . 31 ASN ND2 1 1 12 8413 1 1 27 ASN O O -6.635 6.207 -2.222 1.00 . A A . 31 ASN O 1 1 12 8414 1 1 27 ASN OD1 O -7.757 4.113 -0.162 1.00 . A A . 31 ASN OD1 1 1 12 8415 1 1 28 HIS C C -9.656 5.265 -2.917 1.00 . A A . 32 HIS C 1 1 12 8416 1 1 28 HIS CA C -8.465 5.052 -3.860 1.00 . A A . 32 HIS CA 1 1 12 8417 1 1 28 HIS CB C -8.853 4.127 -5.015 1.00 . A A . 32 HIS CB 1 1 12 8418 1 1 28 HIS CD2 C -7.063 4.616 -6.874 1.00 . A A . 32 HIS CD2 1 1 12 8419 1 1 28 HIS CE1 C -8.317 5.752 -8.228 1.00 . A A . 32 HIS CE1 1 1 12 8420 1 1 28 HIS CG C -8.310 4.678 -6.303 1.00 . A A . 32 HIS CG 1 1 12 8421 1 1 28 HIS H H -7.257 3.373 -3.260 1.00 . A A . 32 HIS H 1 1 12 8422 1 1 28 HIS HA H -8.117 5.996 -4.247 1.00 . A A . 32 HIS HA 1 1 12 8423 1 1 28 HIS HB2 H -8.442 3.144 -4.841 1.00 . A A . 32 HIS HB2 1 1 12 8424 1 1 28 HIS HB3 H -9.930 4.061 -5.076 1.00 . A A . 32 HIS HB3 1 1 12 8425 1 1 28 HIS HD1 H -10.041 5.631 -7.068 1.00 . A A . 32 HIS HD1 1 1 12 8426 1 1 28 HIS HD2 H -6.207 4.117 -6.446 1.00 . A A . 32 HIS HD2 1 1 12 8427 1 1 28 HIS HE1 H -8.660 6.328 -9.074 1.00 . A A . 32 HIS HE1 1 1 12 8428 1 1 28 HIS N N -7.361 4.342 -3.153 1.00 . A A . 32 HIS N 1 1 12 8429 1 1 28 HIS ND1 N -9.092 5.407 -7.185 1.00 . A A . 32 HIS ND1 1 1 12 8430 1 1 28 HIS NE2 N -7.069 5.294 -8.090 1.00 . A A . 32 HIS NE2 1 1 12 8431 1 1 28 HIS O O -10.575 5.996 -3.225 1.00 . A A . 32 HIS O 1 1 12 8432 1 1 29 ILE C C -10.489 6.108 -0.010 1.00 . A A . 33 ILE C 1 1 12 8433 1 1 29 ILE CA C -10.770 4.842 -0.800 1.00 . A A . 33 ILE CA 1 1 12 8434 1 1 29 ILE CB C -10.802 3.630 0.164 1.00 . A A . 33 ILE CB 1 1 12 8435 1 1 29 ILE CD1 C -10.542 1.112 0.327 1.00 . A A . 33 ILE CD1 1 1 12 8436 1 1 29 ILE CG1 C -10.215 2.366 -0.499 1.00 . A A . 33 ILE CG1 1 1 12 8437 1 1 29 ILE CG2 C -12.259 3.378 0.570 1.00 . A A . 33 ILE CG2 1 1 12 8438 1 1 29 ILE H H -8.882 4.080 -1.525 1.00 . A A . 33 ILE H 1 1 12 8439 1 1 29 ILE HA H -11.707 4.926 -1.329 1.00 . A A . 33 ILE HA 1 1 12 8440 1 1 29 ILE HB H -10.228 3.871 1.051 1.00 . A A . 33 ILE HB 1 1 12 8441 1 1 29 ILE HD11 H -10.615 1.380 1.372 1.00 . A A . 33 ILE HD11 1 1 12 8442 1 1 29 ILE HD12 H -9.759 0.380 0.196 1.00 . A A . 33 ILE HD12 1 1 12 8443 1 1 29 ILE HD13 H -11.482 0.698 -0.005 1.00 . A A . 33 ILE HD13 1 1 12 8444 1 1 29 ILE HG12 H -10.623 2.264 -1.488 1.00 . A A . 33 ILE HG12 1 1 12 8445 1 1 29 ILE HG13 H -9.142 2.471 -0.563 1.00 . A A . 33 ILE HG13 1 1 12 8446 1 1 29 ILE HG21 H -12.293 3.013 1.585 1.00 . A A . 33 ILE HG21 1 1 12 8447 1 1 29 ILE HG22 H -12.695 2.642 -0.092 1.00 . A A . 33 ILE HG22 1 1 12 8448 1 1 29 ILE HG23 H -12.817 4.300 0.500 1.00 . A A . 33 ILE HG23 1 1 12 8449 1 1 29 ILE N N -9.639 4.648 -1.764 1.00 . A A . 33 ILE N 1 1 12 8450 1 1 29 ILE O O -11.232 7.069 -0.050 1.00 . A A . 33 ILE O 1 1 12 8451 1 1 30 ASP C C -8.231 8.298 0.603 1.00 . A A . 34 ASP C 1 1 12 8452 1 1 30 ASP CA C -9.020 7.318 1.484 1.00 . A A . 34 ASP CA 1 1 12 8453 1 1 30 ASP CB C -8.142 6.789 2.618 1.00 . A A . 34 ASP CB 1 1 12 8454 1 1 30 ASP CG C -8.940 6.788 3.923 1.00 . A A . 34 ASP CG 1 1 12 8455 1 1 30 ASP H H -8.813 5.320 0.687 1.00 . A A . 34 ASP H 1 1 12 8456 1 1 30 ASP HA H -9.899 7.794 1.887 1.00 . A A . 34 ASP HA 1 1 12 8457 1 1 30 ASP HB2 H -7.825 5.782 2.390 1.00 . A A . 34 ASP HB2 1 1 12 8458 1 1 30 ASP HB3 H -7.275 7.423 2.727 1.00 . A A . 34 ASP HB3 1 1 12 8459 1 1 30 ASP N N -9.398 6.112 0.695 1.00 . A A . 34 ASP N 1 1 12 8460 1 1 30 ASP O O -7.776 9.327 1.062 1.00 . A A . 34 ASP O 1 1 12 8461 1 1 30 ASP OD1 O -9.189 7.863 4.443 1.00 . A A . 34 ASP OD1 1 1 12 8462 1 1 30 ASP OD2 O -9.291 5.712 4.380 1.00 . A A . 34 ASP OD2 1 1 12 8463 1 1 31 GLN C C -5.956 9.268 -0.943 1.00 . A A . 35 GLN C 1 1 12 8464 1 1 31 GLN CA C -7.304 8.905 -1.565 1.00 . A A . 35 GLN CA 1 1 12 8465 1 1 31 GLN CB C -8.181 10.149 -1.706 1.00 . A A . 35 GLN CB 1 1 12 8466 1 1 31 GLN CD C -10.631 10.305 -1.240 1.00 . A A . 35 GLN CD 1 1 12 8467 1 1 31 GLN CG C -9.573 9.743 -2.193 1.00 . A A . 35 GLN CG 1 1 12 8468 1 1 31 GLN H H -8.434 7.158 -1.019 1.00 . A A . 35 GLN H 1 1 12 8469 1 1 31 GLN HA H -7.161 8.444 -2.530 1.00 . A A . 35 GLN HA 1 1 12 8470 1 1 31 GLN HB2 H -8.263 10.641 -0.749 1.00 . A A . 35 GLN HB2 1 1 12 8471 1 1 31 GLN HB3 H -7.733 10.824 -2.421 1.00 . A A . 35 GLN HB3 1 1 12 8472 1 1 31 GLN HE21 H -11.985 10.560 -2.670 1.00 . A A . 35 GLN HE21 1 1 12 8473 1 1 31 GLN HE22 H -12.479 11.020 -1.112 1.00 . A A . 35 GLN HE22 1 1 12 8474 1 1 31 GLN HG2 H -9.737 10.135 -3.186 1.00 . A A . 35 GLN HG2 1 1 12 8475 1 1 31 GLN HG3 H -9.647 8.665 -2.215 1.00 . A A . 35 GLN HG3 1 1 12 8476 1 1 31 GLN N N -8.063 7.990 -0.662 1.00 . A A . 35 GLN N 1 1 12 8477 1 1 31 GLN NE2 N -11.795 10.658 -1.714 1.00 . A A . 35 GLN NE2 1 1 12 8478 1 1 31 GLN O O -5.753 10.373 -0.483 1.00 . A A . 35 GLN O 1 1 12 8479 1 1 31 GLN OE1 O -10.395 10.427 -0.055 1.00 . A A . 35 GLN OE1 1 1 12 8480 1 1 32 THR C C -2.620 7.722 -0.869 1.00 . A A . 36 THR C 1 1 12 8481 1 1 32 THR CA C -3.696 8.662 -0.321 1.00 . A A . 36 THR CA 1 1 12 8482 1 1 32 THR CB C -3.863 8.453 1.187 1.00 . A A . 36 THR CB 1 1 12 8483 1 1 32 THR CG2 C -2.993 9.460 1.940 1.00 . A A . 36 THR CG2 1 1 12 8484 1 1 32 THR H H -5.209 7.457 -1.298 1.00 . A A . 36 THR H 1 1 12 8485 1 1 32 THR HA H -3.430 9.689 -0.520 1.00 . A A . 36 THR HA 1 1 12 8486 1 1 32 THR HB H -3.550 7.453 1.447 1.00 . A A . 36 THR HB 1 1 12 8487 1 1 32 THR HG1 H -5.353 8.245 2.422 1.00 . A A . 36 THR HG1 1 1 12 8488 1 1 32 THR HG21 H -3.610 10.029 2.622 1.00 . A A . 36 THR HG21 1 1 12 8489 1 1 32 THR HG22 H -2.525 10.130 1.235 1.00 . A A . 36 THR HG22 1 1 12 8490 1 1 32 THR HG23 H -2.232 8.934 2.498 1.00 . A A . 36 THR HG23 1 1 12 8491 1 1 32 THR N N -5.029 8.348 -0.922 1.00 . A A . 36 THR N 1 1 12 8492 1 1 32 THR O O -2.881 6.874 -1.697 1.00 . A A . 36 THR O 1 1 12 8493 1 1 32 THR OG1 O -5.224 8.636 1.554 1.00 . A A . 36 THR OG1 1 1 12 8494 1 1 33 THR C C 0.384 6.298 0.292 1.00 . A A . 37 THR C 1 1 12 8495 1 1 33 THR CA C -0.308 6.983 -0.889 1.00 . A A . 37 THR CA 1 1 12 8496 1 1 33 THR CB C 0.676 7.910 -1.602 1.00 . A A . 37 THR CB 1 1 12 8497 1 1 33 THR CG2 C -0.043 8.681 -2.710 1.00 . A A . 37 THR CG2 1 1 12 8498 1 1 33 THR H H -1.222 8.554 0.269 1.00 . A A . 37 THR H 1 1 12 8499 1 1 33 THR HA H -0.690 6.249 -1.580 1.00 . A A . 37 THR HA 1 1 12 8500 1 1 33 THR HB H 1.471 7.323 -2.039 1.00 . A A . 37 THR HB 1 1 12 8501 1 1 33 THR HG1 H 1.737 8.327 -0.026 1.00 . A A . 37 THR HG1 1 1 12 8502 1 1 33 THR HG21 H 0.294 9.706 -2.713 1.00 . A A . 37 THR HG21 1 1 12 8503 1 1 33 THR HG22 H -1.108 8.651 -2.537 1.00 . A A . 37 THR HG22 1 1 12 8504 1 1 33 THR HG23 H 0.180 8.226 -3.665 1.00 . A A . 37 THR HG23 1 1 12 8505 1 1 33 THR N N -1.408 7.866 -0.403 1.00 . A A . 37 THR N 1 1 12 8506 1 1 33 THR O O 1.363 6.789 0.819 1.00 . A A . 37 THR O 1 1 12 8507 1 1 33 THR OG1 O 1.223 8.828 -0.665 1.00 . A A . 37 THR OG1 1 1 12 8508 1 1 34 THR C C 1.748 3.670 1.305 1.00 . A A . 38 THR C 1 1 12 8509 1 1 34 THR CA C 0.533 4.444 1.836 1.00 . A A . 38 THR CA 1 1 12 8510 1 1 34 THR CB C -0.584 3.514 2.364 1.00 . A A . 38 THR CB 1 1 12 8511 1 1 34 THR CG2 C -0.034 2.153 2.830 1.00 . A A . 38 THR CG2 1 1 12 8512 1 1 34 THR H H -0.891 4.779 0.253 1.00 . A A . 38 THR H 1 1 12 8513 1 1 34 THR HA H 0.833 5.138 2.605 1.00 . A A . 38 THR HA 1 1 12 8514 1 1 34 THR HB H -1.301 3.352 1.577 1.00 . A A . 38 THR HB 1 1 12 8515 1 1 34 THR HG1 H -1.917 4.719 3.104 1.00 . A A . 38 THR HG1 1 1 12 8516 1 1 34 THR HG21 H 0.378 1.624 1.981 1.00 . A A . 38 THR HG21 1 1 12 8517 1 1 34 THR HG22 H -0.831 1.570 3.262 1.00 . A A . 38 THR HG22 1 1 12 8518 1 1 34 THR HG23 H 0.741 2.310 3.565 1.00 . A A . 38 THR HG23 1 1 12 8519 1 1 34 THR N N -0.107 5.165 0.701 1.00 . A A . 38 THR N 1 1 12 8520 1 1 34 THR O O 1.627 2.870 0.411 1.00 . A A . 38 THR O 1 1 12 8521 1 1 34 THR OG1 O -1.232 4.146 3.458 1.00 . A A . 38 THR OG1 1 1 12 8522 1 1 35 TRP C C 3.981 1.671 1.743 1.00 . A A . 39 TRP C 1 1 12 8523 1 1 35 TRP CA C 4.103 3.146 1.350 1.00 . A A . 39 TRP CA 1 1 12 8524 1 1 35 TRP CB C 5.321 3.777 2.036 1.00 . A A . 39 TRP CB 1 1 12 8525 1 1 35 TRP CD1 C 4.740 6.184 2.580 1.00 . A A . 39 TRP CD1 1 1 12 8526 1 1 35 TRP CD2 C 6.084 6.012 0.783 1.00 . A A . 39 TRP CD2 1 1 12 8527 1 1 35 TRP CE2 C 5.847 7.393 0.988 1.00 . A A . 39 TRP CE2 1 1 12 8528 1 1 35 TRP CE3 C 6.911 5.640 -0.296 1.00 . A A . 39 TRP CE3 1 1 12 8529 1 1 35 TRP CG C 5.365 5.260 1.810 1.00 . A A . 39 TRP CG 1 1 12 8530 1 1 35 TRP CH2 C 7.226 7.975 -0.901 1.00 . A A . 39 TRP CH2 1 1 12 8531 1 1 35 TRP CZ2 C 6.407 8.364 0.162 1.00 . A A . 39 TRP CZ2 1 1 12 8532 1 1 35 TRP CZ3 C 7.475 6.617 -1.129 1.00 . A A . 39 TRP CZ3 1 1 12 8533 1 1 35 TRP H H 2.998 4.535 2.581 1.00 . A A . 39 TRP H 1 1 12 8534 1 1 35 TRP HA H 4.185 3.240 0.278 1.00 . A A . 39 TRP HA 1 1 12 8535 1 1 35 TRP HB2 H 5.269 3.583 3.098 1.00 . A A . 39 TRP HB2 1 1 12 8536 1 1 35 TRP HB3 H 6.221 3.334 1.639 1.00 . A A . 39 TRP HB3 1 1 12 8537 1 1 35 TRP HD1 H 4.117 5.968 3.436 1.00 . A A . 39 TRP HD1 1 1 12 8538 1 1 35 TRP HE1 H 4.689 8.287 2.466 1.00 . A A . 39 TRP HE1 1 1 12 8539 1 1 35 TRP HE3 H 7.106 4.600 -0.494 1.00 . A A . 39 TRP HE3 1 1 12 8540 1 1 35 TRP HH2 H 7.664 8.721 -1.546 1.00 . A A . 39 TRP HH2 1 1 12 8541 1 1 35 TRP HZ2 H 6.210 9.409 0.343 1.00 . A A . 39 TRP HZ2 1 1 12 8542 1 1 35 TRP HZ3 H 8.111 6.317 -1.947 1.00 . A A . 39 TRP HZ3 1 1 12 8543 1 1 35 TRP N N 2.911 3.893 1.849 1.00 . A A . 39 TRP N 1 1 12 8544 1 1 35 TRP NE1 N 5.022 7.445 2.090 1.00 . A A . 39 TRP NE1 1 1 12 8545 1 1 35 TRP O O 2.896 1.159 1.938 1.00 . A A . 39 TRP O 1 1 12 8546 1 1 36 GLN C C 4.615 -0.591 3.720 1.00 . A A . 40 GLN C 1 1 12 8547 1 1 36 GLN CA C 5.021 -0.457 2.249 1.00 . A A . 40 GLN CA 1 1 12 8548 1 1 36 GLN CB C 6.437 -0.987 2.032 1.00 . A A . 40 GLN CB 1 1 12 8549 1 1 36 GLN CD C 7.522 -2.099 0.074 1.00 . A A . 40 GLN CD 1 1 12 8550 1 1 36 GLN CG C 6.392 -2.201 1.101 1.00 . A A . 40 GLN CG 1 1 12 8551 1 1 36 GLN H H 5.950 1.410 1.707 1.00 . A A . 40 GLN H 1 1 12 8552 1 1 36 GLN HA H 4.328 -0.988 1.615 1.00 . A A . 40 GLN HA 1 1 12 8553 1 1 36 GLN HB2 H 7.048 -0.215 1.586 1.00 . A A . 40 GLN HB2 1 1 12 8554 1 1 36 GLN HB3 H 6.863 -1.279 2.981 1.00 . A A . 40 GLN HB3 1 1 12 8555 1 1 36 GLN HE21 H 6.300 -1.714 -1.443 1.00 . A A . 40 GLN HE21 1 1 12 8556 1 1 36 GLN HE22 H 7.950 -1.774 -1.836 1.00 . A A . 40 GLN HE22 1 1 12 8557 1 1 36 GLN HG2 H 6.513 -3.105 1.680 1.00 . A A . 40 GLN HG2 1 1 12 8558 1 1 36 GLN HG3 H 5.442 -2.225 0.589 1.00 . A A . 40 GLN HG3 1 1 12 8559 1 1 36 GLN N N 5.084 0.983 1.864 1.00 . A A . 40 GLN N 1 1 12 8560 1 1 36 GLN NE2 N 7.234 -1.841 -1.172 1.00 . A A . 40 GLN NE2 1 1 12 8561 1 1 36 GLN O O 5.178 0.045 4.587 1.00 . A A . 40 GLN O 1 1 12 8562 1 1 36 GLN OE1 O 8.679 -2.255 0.410 1.00 . A A . 40 GLN OE1 1 1 12 8563 1 1 37 ASP C C 2.093 -2.645 5.520 1.00 . A A . 41 ASP C 1 1 12 8564 1 1 37 ASP CA C 3.204 -1.587 5.425 1.00 . A A . 41 ASP CA 1 1 12 8565 1 1 37 ASP CB C 2.682 -0.215 5.861 1.00 . A A . 41 ASP CB 1 1 12 8566 1 1 37 ASP CG C 3.659 0.408 6.860 1.00 . A A . 41 ASP CG 1 1 12 8567 1 1 37 ASP H H 3.203 -1.922 3.292 1.00 . A A . 41 ASP H 1 1 12 8568 1 1 37 ASP HA H 4.042 -1.871 6.041 1.00 . A A . 41 ASP HA 1 1 12 8569 1 1 37 ASP HB2 H 2.592 0.426 4.997 1.00 . A A . 41 ASP HB2 1 1 12 8570 1 1 37 ASP HB3 H 1.714 -0.330 6.328 1.00 . A A . 41 ASP HB3 1 1 12 8571 1 1 37 ASP N N 3.642 -1.415 4.008 1.00 . A A . 41 ASP N 1 1 12 8572 1 1 37 ASP O O 2.255 -3.642 6.196 1.00 . A A . 41 ASP O 1 1 12 8573 1 1 37 ASP OD1 O 4.216 -0.333 7.655 1.00 . A A . 41 ASP OD1 1 1 12 8574 1 1 37 ASP OD2 O 3.833 1.614 6.814 1.00 . A A . 41 ASP OD2 1 1 12 8575 1 1 38 PRO C C 0.212 -4.625 4.080 1.00 . A A . 42 PRO C 1 1 12 8576 1 1 38 PRO CA C -0.136 -3.362 4.874 1.00 . A A . 42 PRO CA 1 1 12 8577 1 1 38 PRO CB C -1.278 -2.598 4.210 1.00 . A A . 42 PRO CB 1 1 12 8578 1 1 38 PRO CD C 0.698 -1.232 3.998 1.00 . A A . 42 PRO CD 1 1 12 8579 1 1 38 PRO CG C -0.608 -1.585 3.337 1.00 . A A . 42 PRO CG 1 1 12 8580 1 1 38 PRO HA H -0.398 -3.609 5.889 1.00 . A A . 42 PRO HA 1 1 12 8581 1 1 38 PRO HB2 H -1.882 -3.267 3.613 1.00 . A A . 42 PRO HB2 1 1 12 8582 1 1 38 PRO HB3 H -1.886 -2.108 4.956 1.00 . A A . 42 PRO HB3 1 1 12 8583 1 1 38 PRO HD2 H 1.470 -1.091 3.257 1.00 . A A . 42 PRO HD2 1 1 12 8584 1 1 38 PRO HD3 H 0.589 -0.345 4.604 1.00 . A A . 42 PRO HD3 1 1 12 8585 1 1 38 PRO HG2 H -0.426 -2.004 2.359 1.00 . A A . 42 PRO HG2 1 1 12 8586 1 1 38 PRO HG3 H -1.229 -0.704 3.252 1.00 . A A . 42 PRO HG3 1 1 12 8587 1 1 38 PRO N N 0.994 -2.401 4.842 1.00 . A A . 42 PRO N 1 1 12 8588 1 1 38 PRO O O 0.682 -4.557 2.961 1.00 . A A . 42 PRO O 1 1 12 8589 1 1 39 ARG C C 1.768 -7.042 3.479 1.00 . A A . 43 ARG C 1 1 12 8590 1 1 39 ARG CA C 0.308 -7.047 3.936 1.00 . A A . 43 ARG CA 1 1 12 8591 1 1 39 ARG CB C -0.632 -7.069 2.730 1.00 . A A . 43 ARG CB 1 1 12 8592 1 1 39 ARG CD C -2.895 -8.128 2.664 1.00 . A A . 43 ARG CD 1 1 12 8593 1 1 39 ARG CG C -2.081 -6.954 3.210 1.00 . A A . 43 ARG CG 1 1 12 8594 1 1 39 ARG CZ C -4.048 -8.619 4.760 1.00 . A A . 43 ARG CZ 1 1 12 8595 1 1 39 ARG H H -0.389 -5.807 5.557 1.00 . A A . 43 ARG H 1 1 12 8596 1 1 39 ARG HA H 0.113 -7.896 4.571 1.00 . A A . 43 ARG HA 1 1 12 8597 1 1 39 ARG HB2 H -0.403 -6.241 2.077 1.00 . A A . 43 ARG HB2 1 1 12 8598 1 1 39 ARG HB3 H -0.506 -7.998 2.193 1.00 . A A . 43 ARG HB3 1 1 12 8599 1 1 39 ARG HD2 H -3.170 -7.949 1.635 1.00 . A A . 43 ARG HD2 1 1 12 8600 1 1 39 ARG HD3 H -2.334 -9.046 2.749 1.00 . A A . 43 ARG HD3 1 1 12 8601 1 1 39 ARG HE H -4.975 -7.886 3.162 1.00 . A A . 43 ARG HE 1 1 12 8602 1 1 39 ARG HG2 H -2.105 -6.971 4.289 1.00 . A A . 43 ARG HG2 1 1 12 8603 1 1 39 ARG HG3 H -2.505 -6.026 2.855 1.00 . A A . 43 ARG HG3 1 1 12 8604 1 1 39 ARG HH11 H -2.074 -9.001 4.730 1.00 . A A . 43 ARG HH11 1 1 12 8605 1 1 39 ARG HH12 H -2.882 -9.352 6.219 1.00 . A A . 43 ARG HH12 1 1 12 8606 1 1 39 ARG HH21 H -6.001 -8.350 5.104 1.00 . A A . 43 ARG HH21 1 1 12 8607 1 1 39 ARG HH22 H -5.087 -8.986 6.430 1.00 . A A . 43 ARG HH22 1 1 12 8608 1 1 39 ARG N N -0.011 -5.776 4.654 1.00 . A A . 43 ARG N 1 1 12 8609 1 1 39 ARG NE N -4.114 -8.181 3.524 1.00 . A A . 43 ARG NE 1 1 12 8610 1 1 39 ARG NH1 N -2.910 -9.021 5.275 1.00 . A A . 43 ARG NH1 1 1 12 8611 1 1 39 ARG NH2 N -5.131 -8.655 5.489 1.00 . A A . 43 ARG NH2 1 1 12 8612 1 1 39 ARG O O 2.471 -6.061 3.619 1.00 . A A . 43 ARG O 1 1 12 8613 1 1 40 LYS C C 3.700 -8.241 0.939 1.00 . A A . 44 LYS C 1 1 12 8614 1 1 40 LYS CA C 3.647 -8.192 2.468 1.00 . A A . 44 LYS CA 1 1 12 8615 1 1 40 LYS CB C 4.206 -9.484 3.066 1.00 . A A . 44 LYS CB 1 1 12 8616 1 1 40 LYS CD C 5.784 -9.305 4.995 1.00 . A A . 44 LYS CD 1 1 12 8617 1 1 40 LYS CE C 5.892 -8.930 6.474 1.00 . A A . 44 LYS CE 1 1 12 8618 1 1 40 LYS CG C 4.311 -9.340 4.585 1.00 . A A . 44 LYS CG 1 1 12 8619 1 1 40 LYS H H 1.649 -8.915 2.830 1.00 . A A . 44 LYS H 1 1 12 8620 1 1 40 LYS HA H 4.201 -7.345 2.837 1.00 . A A . 44 LYS HA 1 1 12 8621 1 1 40 LYS HB2 H 3.550 -10.306 2.825 1.00 . A A . 44 LYS HB2 1 1 12 8622 1 1 40 LYS HB3 H 5.188 -9.675 2.654 1.00 . A A . 44 LYS HB3 1 1 12 8623 1 1 40 LYS HD2 H 6.225 -10.277 4.835 1.00 . A A . 44 LYS HD2 1 1 12 8624 1 1 40 LYS HD3 H 6.306 -8.571 4.398 1.00 . A A . 44 LYS HD3 1 1 12 8625 1 1 40 LYS HE2 H 6.665 -8.188 6.618 1.00 . A A . 44 LYS HE2 1 1 12 8626 1 1 40 LYS HE3 H 4.945 -8.564 6.840 1.00 . A A . 44 LYS HE3 1 1 12 8627 1 1 40 LYS HG2 H 3.829 -8.423 4.892 1.00 . A A . 44 LYS HG2 1 1 12 8628 1 1 40 LYS HG3 H 3.825 -10.179 5.060 1.00 . A A . 44 LYS HG3 1 1 12 8629 1 1 40 LYS HZ1 H 6.995 -10.691 6.618 1.00 . A A . 44 LYS HZ1 1 1 12 8630 1 1 40 LYS HZ2 H 5.417 -10.808 7.237 1.00 . A A . 44 LYS HZ2 1 1 12 8631 1 1 40 LYS HZ3 H 6.619 -9.988 8.114 1.00 . A A . 44 LYS HZ3 1 1 12 8632 1 1 40 LYS N N 2.232 -8.133 2.933 1.00 . A A . 44 LYS N 1 1 12 8633 1 1 40 LYS NZ N 6.259 -10.200 7.163 1.00 . A A . 44 LYS NZ 1 1 12 8634 1 1 40 LYS O O 4.792 -8.347 0.406 1.00 . A A . 44 LYS O 1 1 12 8635 1 1 40 LYS OXT O 2.646 -8.172 0.327 1.00 . A A . 44 LYS OXT 1 1 12 8636 2 2 1 ACE C C 7.504 13.067 4.368 1.00 . B B . 45 ACE C 1 1 12 8637 2 2 1 ACE CH3 C 6.077 13.579 4.160 1.00 . B B . 45 ACE CH3 1 1 12 8638 2 2 1 ACE H1 H 6.094 14.437 3.506 1.00 . B B . 45 ACE H1 1 1 12 8639 2 2 1 ACE H2 H 5.654 13.861 5.113 1.00 . B B . 45 ACE H2 1 1 12 8640 2 2 1 ACE H3 H 5.476 12.799 3.717 1.00 . B B . 45 ACE H3 1 1 12 8641 2 2 1 ACE O O 8.395 13.826 4.695 1.00 . B B . 45 ACE O 1 1 12 8642 2 2 2 PRO C C 6.320 10.778 2.357 1.00 . B B . 46 PRO C 1 1 12 8643 2 2 2 PRO CA C 7.706 11.270 2.777 1.00 . B B . 46 PRO CA 1 1 12 8644 2 2 2 PRO CB C 8.696 10.110 2.840 1.00 . B B . 46 PRO CB 1 1 12 8645 2 2 2 PRO CD C 8.351 10.873 5.098 1.00 . B B . 46 PRO CD 1 1 12 8646 2 2 2 PRO CG C 8.672 9.662 4.262 1.00 . B B . 46 PRO CG 1 1 12 8647 2 2 2 PRO HA H 8.065 12.027 2.099 1.00 . B B . 46 PRO HA 1 1 12 8648 2 2 2 PRO HB2 H 8.378 9.311 2.184 1.00 . B B . 46 PRO HB2 1 1 12 8649 2 2 2 PRO HB3 H 9.686 10.446 2.575 1.00 . B B . 46 PRO HB3 1 1 12 8650 2 2 2 PRO HD2 H 7.699 10.603 5.917 1.00 . B B . 46 PRO HD2 1 1 12 8651 2 2 2 PRO HD3 H 9.258 11.327 5.469 1.00 . B B . 46 PRO HD3 1 1 12 8652 2 2 2 PRO HG2 H 7.911 8.906 4.397 1.00 . B B . 46 PRO HG2 1 1 12 8653 2 2 2 PRO HG3 H 9.638 9.271 4.544 1.00 . B B . 46 PRO HG3 1 1 12 8654 2 2 2 PRO N N 7.670 11.788 4.172 1.00 . B B . 46 PRO N 1 1 12 8655 2 2 2 PRO O O 5.782 9.847 2.922 1.00 . B B . 46 PRO O 1 1 12 8656 2 2 3 LEU C C 3.973 11.750 -0.346 1.00 . B B . 47 LEU C 1 1 12 8657 2 2 3 LEU CA C 4.383 10.964 0.910 1.00 . B B . 47 LEU CA 1 1 12 8658 2 2 3 LEU CB C 3.453 11.293 2.077 1.00 . B B . 47 LEU CB 1 1 12 8659 2 2 3 LEU CD1 C 1.619 9.619 2.361 1.00 . B B . 47 LEU CD1 1 1 12 8660 2 2 3 LEU CD2 C 1.073 12.051 2.178 1.00 . B B . 47 LEU CD2 1 1 12 8661 2 2 3 LEU CG C 2.012 10.942 1.699 1.00 . B B . 47 LEU CG 1 1 12 8662 2 2 3 LEU H H 6.186 12.145 0.924 1.00 . B B . 47 LEU H 1 1 12 8663 2 2 3 LEU HA H 4.371 9.904 0.722 1.00 . B B . 47 LEU HA 1 1 12 8664 2 2 3 LEU HB2 H 3.747 10.720 2.944 1.00 . B B . 47 LEU HB2 1 1 12 8665 2 2 3 LEU HB3 H 3.518 12.347 2.304 1.00 . B B . 47 LEU HB3 1 1 12 8666 2 2 3 LEU HD11 H 1.443 9.782 3.414 1.00 . B B . 47 LEU HD11 1 1 12 8667 2 2 3 LEU HD12 H 2.418 8.903 2.236 1.00 . B B . 47 LEU HD12 1 1 12 8668 2 2 3 LEU HD13 H 0.720 9.239 1.900 1.00 . B B . 47 LEU HD13 1 1 12 8669 2 2 3 LEU HD21 H 0.242 11.613 2.712 1.00 . B B . 47 LEU HD21 1 1 12 8670 2 2 3 LEU HD22 H 0.704 12.603 1.328 1.00 . B B . 47 LEU HD22 1 1 12 8671 2 2 3 LEU HD23 H 1.611 12.718 2.835 1.00 . B B . 47 LEU HD23 1 1 12 8672 2 2 3 LEU HG H 1.934 10.844 0.625 1.00 . B B . 47 LEU HG 1 1 12 8673 2 2 3 LEU N N 5.736 11.397 1.366 1.00 . B B . 47 LEU N 1 1 12 8674 2 2 3 LEU O O 3.825 12.955 -0.292 1.00 . B B . 47 LEU O 1 1 12 8675 2 2 4 PRO C C 1.956 12.215 -2.617 1.00 . B B . 48 PRO C 1 1 12 8676 2 2 4 PRO CA C 3.405 11.712 -2.710 1.00 . B B . 48 PRO CA 1 1 12 8677 2 2 4 PRO CB C 3.535 10.604 -3.754 1.00 . B B . 48 PRO CB 1 1 12 8678 2 2 4 PRO CD C 3.953 9.594 -1.612 1.00 . B B . 48 PRO CD 1 1 12 8679 2 2 4 PRO CG C 3.385 9.335 -2.981 1.00 . B B . 48 PRO CG 1 1 12 8680 2 2 4 PRO HA H 4.076 12.522 -2.944 1.00 . B B . 48 PRO HA 1 1 12 8681 2 2 4 PRO HB2 H 2.753 10.686 -4.494 1.00 . B B . 48 PRO HB2 1 1 12 8682 2 2 4 PRO HB3 H 4.505 10.644 -4.226 1.00 . B B . 48 PRO HB3 1 1 12 8683 2 2 4 PRO HD2 H 3.391 9.062 -0.860 1.00 . B B . 48 PRO HD2 1 1 12 8684 2 2 4 PRO HD3 H 4.996 9.315 -1.576 1.00 . B B . 48 PRO HD3 1 1 12 8685 2 2 4 PRO HG2 H 2.342 9.076 -2.904 1.00 . B B . 48 PRO HG2 1 1 12 8686 2 2 4 PRO HG3 H 3.929 8.538 -3.464 1.00 . B B . 48 PRO HG3 1 1 12 8687 2 2 4 PRO N N 3.801 11.048 -1.442 1.00 . B B . 48 PRO N 1 1 12 8688 2 2 4 PRO O O 1.128 11.591 -1.981 1.00 . B B . 48 PRO O 1 1 12 8689 2 2 5 PRO C C -0.626 13.083 -4.085 1.00 . B B . 49 PRO C 1 1 12 8690 2 2 5 PRO CA C 0.330 13.915 -3.227 1.00 . B B . 49 PRO CA 1 1 12 8691 2 2 5 PRO CB C 0.522 15.307 -3.822 1.00 . B B . 49 PRO CB 1 1 12 8692 2 2 5 PRO CD C 2.629 14.152 -4.042 1.00 . B B . 49 PRO CD 1 1 12 8693 2 2 5 PRO CG C 1.748 15.199 -4.671 1.00 . B B . 49 PRO CG 1 1 12 8694 2 2 5 PRO HA H -0.033 13.992 -2.215 1.00 . B B . 49 PRO HA 1 1 12 8695 2 2 5 PRO HB2 H -0.332 15.578 -4.426 1.00 . B B . 49 PRO HB2 1 1 12 8696 2 2 5 PRO HB3 H 0.672 16.033 -3.036 1.00 . B B . 49 PRO HB3 1 1 12 8697 2 2 5 PRO HD2 H 3.107 13.552 -4.803 1.00 . B B . 49 PRO HD2 1 1 12 8698 2 2 5 PRO HD3 H 3.367 14.611 -3.401 1.00 . B B . 49 PRO HD3 1 1 12 8699 2 2 5 PRO HG2 H 1.477 14.899 -5.673 1.00 . B B . 49 PRO HG2 1 1 12 8700 2 2 5 PRO HG3 H 2.264 16.148 -4.696 1.00 . B B . 49 PRO HG3 1 1 12 8701 2 2 5 PRO N N 1.696 13.333 -3.252 1.00 . B B . 49 PRO N 1 1 12 8702 2 2 5 PRO O O -0.212 12.235 -4.849 1.00 . B B . 49 PRO O 1 1 12 8703 2 2 6 TYR C C -3.993 13.469 -5.291 1.00 . B B . 50 TYR C 1 1 12 8704 2 2 6 TYR CA C -2.889 12.544 -4.773 1.00 . B B . 50 TYR CA 1 1 12 8705 2 2 6 TYR CB C -3.465 11.509 -3.806 1.00 . B B . 50 TYR CB 1 1 12 8706 2 2 6 TYR CD1 C -3.765 9.931 -5.751 1.00 . B B . 50 TYR CD1 1 1 12 8707 2 2 6 TYR CD2 C -5.547 10.118 -4.117 1.00 . B B . 50 TYR CD2 1 1 12 8708 2 2 6 TYR CE1 C -4.518 8.991 -6.466 1.00 . B B . 50 TYR CE1 1 1 12 8709 2 2 6 TYR CE2 C -6.300 9.178 -4.832 1.00 . B B . 50 TYR CE2 1 1 12 8710 2 2 6 TYR CG C -4.280 10.496 -4.577 1.00 . B B . 50 TYR CG 1 1 12 8711 2 2 6 TYR CZ C -5.785 8.615 -6.005 1.00 . B B . 50 TYR CZ 1 1 12 8712 2 2 6 TYR H H -2.217 14.010 -3.342 1.00 . B B . 50 TYR H 1 1 12 8713 2 2 6 TYR HA H -2.394 12.050 -5.593 1.00 . B B . 50 TYR HA 1 1 12 8714 2 2 6 TYR HB2 H -2.658 11.006 -3.294 1.00 . B B . 50 TYR HB2 1 1 12 8715 2 2 6 TYR HB3 H -4.099 12.003 -3.085 1.00 . B B . 50 TYR HB3 1 1 12 8716 2 2 6 TYR HD1 H -2.787 10.221 -6.106 1.00 . B B . 50 TYR HD1 1 1 12 8717 2 2 6 TYR HD2 H -5.944 10.553 -3.211 1.00 . B B . 50 TYR HD2 1 1 12 8718 2 2 6 TYR HE1 H -4.120 8.556 -7.370 1.00 . B B . 50 TYR HE1 1 1 12 8719 2 2 6 TYR HE2 H -7.277 8.888 -4.477 1.00 . B B . 50 TYR HE2 1 1 12 8720 2 2 6 TYR HH H -6.398 7.854 -7.645 1.00 . B B . 50 TYR HH 1 1 12 8721 2 2 6 TYR N N -1.904 13.320 -3.963 1.00 . B B . 50 TYR N 1 1 12 8722 2 2 6 TYR O O -4.712 14.018 -4.473 1.00 . B B . 50 TYR O 1 1 12 8723 2 2 6 TYR OXT O -4.101 13.611 -6.498 1.00 . B B . 50 TYR OXT 1 1 12 8724 2 2 6 TYR OH O -6.527 7.689 -6.709 1.00 . B B . 50 TYR OH 1 1 13 8725 1 1 1 PHE C C -11.839 -14.662 11.449 1.00 . A A . 5 PHE C 1 1 13 8726 1 1 1 PHE CA C -13.332 -14.407 11.676 1.00 . A A . 5 PHE CA 1 1 13 8727 1 1 1 PHE CB C -13.661 -14.446 13.167 1.00 . A A . 5 PHE CB 1 1 13 8728 1 1 1 PHE CD1 C -15.997 -13.505 13.261 1.00 . A A . 5 PHE CD1 1 1 13 8729 1 1 1 PHE CD2 C -14.157 -12.136 14.047 1.00 . A A . 5 PHE CD2 1 1 13 8730 1 1 1 PHE CE1 C -16.895 -12.476 13.570 1.00 . A A . 5 PHE CE1 1 1 13 8731 1 1 1 PHE CE2 C -15.054 -11.107 14.356 1.00 . A A . 5 PHE CE2 1 1 13 8732 1 1 1 PHE CG C -14.629 -13.336 13.500 1.00 . A A . 5 PHE CG 1 1 13 8733 1 1 1 PHE CZ C -16.423 -11.276 14.118 1.00 . A A . 5 PHE CZ 1 1 13 8734 1 1 1 PHE HA H -13.621 -13.456 11.259 1.00 . A A . 5 PHE HA 1 1 13 8735 1 1 1 PHE HB2 H -14.109 -15.398 13.414 1.00 . A A . 5 PHE HB2 1 1 13 8736 1 1 1 PHE HB3 H -12.755 -14.316 13.740 1.00 . A A . 5 PHE HB3 1 1 13 8737 1 1 1 PHE HD1 H -16.363 -14.430 12.839 1.00 . A A . 5 PHE HD1 1 1 13 8738 1 1 1 PHE HD2 H -13.101 -12.005 14.231 1.00 . A A . 5 PHE HD2 1 1 13 8739 1 1 1 PHE HE1 H -17.952 -12.606 13.386 1.00 . A A . 5 PHE HE1 1 1 13 8740 1 1 1 PHE HE2 H -14.690 -10.181 14.777 1.00 . A A . 5 PHE HE2 1 1 13 8741 1 1 1 PHE HZ H -17.116 -10.482 14.355 1.00 . A A . 5 PHE HZ 1 1 13 8742 1 1 1 PHE N N -14.140 -15.508 11.074 1.00 . A A . 5 PHE N 1 1 13 8743 1 1 1 PHE O O -11.442 -15.710 10.980 1.00 . A A . 5 PHE O 1 1 13 8744 1 1 2 GLU C C -9.250 -14.311 10.136 1.00 . A A . 6 GLU C 1 1 13 8745 1 1 2 GLU CA C -9.543 -13.897 11.582 1.00 . A A . 6 GLU CA 1 1 13 8746 1 1 2 GLU CB C -9.153 -15.014 12.550 1.00 . A A . 6 GLU CB 1 1 13 8747 1 1 2 GLU CD C -7.106 -16.385 12.965 1.00 . A A . 6 GLU CD 1 1 13 8748 1 1 2 GLU CG C -7.647 -14.961 12.808 1.00 . A A . 6 GLU CG 1 1 13 8749 1 1 2 GLU H H -11.350 -12.872 12.154 1.00 . A A . 6 GLU H 1 1 13 8750 1 1 2 GLU HA H -9.011 -12.992 11.829 1.00 . A A . 6 GLU HA 1 1 13 8751 1 1 2 GLU HB2 H -9.683 -14.884 13.482 1.00 . A A . 6 GLU HB2 1 1 13 8752 1 1 2 GLU HB3 H -9.411 -15.970 12.119 1.00 . A A . 6 GLU HB3 1 1 13 8753 1 1 2 GLU HG2 H -7.154 -14.479 11.976 1.00 . A A . 6 GLU HG2 1 1 13 8754 1 1 2 GLU HG3 H -7.455 -14.403 13.712 1.00 . A A . 6 GLU HG3 1 1 13 8755 1 1 2 GLU N N -11.010 -13.710 11.777 1.00 . A A . 6 GLU N 1 1 13 8756 1 1 2 GLU O O -9.050 -15.473 9.844 1.00 . A A . 6 GLU O 1 1 13 8757 1 1 2 GLU OE1 O -7.669 -17.128 13.750 1.00 . A A . 6 GLU OE1 1 1 13 8758 1 1 2 GLU OE2 O -6.137 -16.706 12.296 1.00 . A A . 6 GLU OE2 1 1 13 8759 1 1 3 ILE C C -7.452 -14.041 7.630 1.00 . A A . 7 ILE C 1 1 13 8760 1 1 3 ILE CA C -8.940 -13.711 7.809 1.00 . A A . 7 ILE CA 1 1 13 8761 1 1 3 ILE CB C -9.310 -12.455 7.020 1.00 . A A . 7 ILE CB 1 1 13 8762 1 1 3 ILE CD1 C -7.649 -10.694 6.401 1.00 . A A . 7 ILE CD1 1 1 13 8763 1 1 3 ILE CG1 C -8.494 -11.269 7.539 1.00 . A A . 7 ILE CG1 1 1 13 8764 1 1 3 ILE CG2 C -10.801 -12.162 7.198 1.00 . A A . 7 ILE CG2 1 1 13 8765 1 1 3 ILE H H -9.385 -12.438 9.491 1.00 . A A . 7 ILE H 1 1 13 8766 1 1 3 ILE HA H -9.553 -14.540 7.492 1.00 . A A . 7 ILE HA 1 1 13 8767 1 1 3 ILE HB H -9.096 -12.611 5.974 1.00 . A A . 7 ILE HB 1 1 13 8768 1 1 3 ILE HD11 H -8.128 -9.809 6.009 1.00 . A A . 7 ILE HD11 1 1 13 8769 1 1 3 ILE HD12 H -7.555 -11.430 5.615 1.00 . A A . 7 ILE HD12 1 1 13 8770 1 1 3 ILE HD13 H -6.669 -10.438 6.774 1.00 . A A . 7 ILE HD13 1 1 13 8771 1 1 3 ILE HG12 H -9.161 -10.507 7.912 1.00 . A A . 7 ILE HG12 1 1 13 8772 1 1 3 ILE HG13 H -7.845 -11.600 8.338 1.00 . A A . 7 ILE HG13 1 1 13 8773 1 1 3 ILE HG21 H -11.082 -12.332 8.226 1.00 . A A . 7 ILE HG21 1 1 13 8774 1 1 3 ILE HG22 H -11.375 -12.814 6.555 1.00 . A A . 7 ILE HG22 1 1 13 8775 1 1 3 ILE HG23 H -10.999 -11.133 6.936 1.00 . A A . 7 ILE HG23 1 1 13 8776 1 1 3 ILE N N -9.222 -13.370 9.233 1.00 . A A . 7 ILE N 1 1 13 8777 1 1 3 ILE O O -6.608 -13.447 8.270 1.00 . A A . 7 ILE O 1 1 13 8778 1 1 4 PRO C C -5.038 -14.300 5.713 1.00 . A A . 8 PRO C 1 1 13 8779 1 1 4 PRO CA C -5.769 -15.385 6.507 1.00 . A A . 8 PRO CA 1 1 13 8780 1 1 4 PRO CB C -5.902 -16.662 5.684 1.00 . A A . 8 PRO CB 1 1 13 8781 1 1 4 PRO CD C -8.123 -15.755 5.942 1.00 . A A . 8 PRO CD 1 1 13 8782 1 1 4 PRO CG C -7.239 -16.560 5.024 1.00 . A A . 8 PRO CG 1 1 13 8783 1 1 4 PRO HA H -5.258 -15.593 7.433 1.00 . A A . 8 PRO HA 1 1 13 8784 1 1 4 PRO HB2 H -5.118 -16.713 4.941 1.00 . A A . 8 PRO HB2 1 1 13 8785 1 1 4 PRO HB3 H -5.866 -17.530 6.327 1.00 . A A . 8 PRO HB3 1 1 13 8786 1 1 4 PRO HD2 H -8.759 -15.092 5.373 1.00 . A A . 8 PRO HD2 1 1 13 8787 1 1 4 PRO HD3 H -8.717 -16.409 6.565 1.00 . A A . 8 PRO HD3 1 1 13 8788 1 1 4 PRO HG2 H -7.143 -16.057 4.073 1.00 . A A . 8 PRO HG2 1 1 13 8789 1 1 4 PRO HG3 H -7.656 -17.545 4.880 1.00 . A A . 8 PRO HG3 1 1 13 8790 1 1 4 PRO N N -7.174 -14.985 6.760 1.00 . A A . 8 PRO N 1 1 13 8791 1 1 4 PRO O O -5.646 -13.408 5.156 1.00 . A A . 8 PRO O 1 1 13 8792 1 1 5 ASP C C -2.880 -13.725 3.425 1.00 . A A . 9 ASP C 1 1 13 8793 1 1 5 ASP CA C -2.964 -13.347 4.907 1.00 . A A . 9 ASP CA 1 1 13 8794 1 1 5 ASP CB C -1.578 -13.373 5.546 1.00 . A A . 9 ASP CB 1 1 13 8795 1 1 5 ASP CG C -0.967 -14.767 5.384 1.00 . A A . 9 ASP CG 1 1 13 8796 1 1 5 ASP H H -3.264 -15.093 6.114 1.00 . A A . 9 ASP H 1 1 13 8797 1 1 5 ASP HA H -3.407 -12.372 5.025 1.00 . A A . 9 ASP HA 1 1 13 8798 1 1 5 ASP HB2 H -0.948 -12.649 5.063 1.00 . A A . 9 ASP HB2 1 1 13 8799 1 1 5 ASP HB3 H -1.661 -13.136 6.596 1.00 . A A . 9 ASP HB3 1 1 13 8800 1 1 5 ASP N N -3.737 -14.368 5.658 1.00 . A A . 9 ASP N 1 1 13 8801 1 1 5 ASP O O -1.816 -13.746 2.840 1.00 . A A . 9 ASP O 1 1 13 8802 1 1 5 ASP OD1 O -1.331 -15.644 6.150 1.00 . A A . 9 ASP OD1 1 1 13 8803 1 1 5 ASP OD2 O -0.146 -14.933 4.496 1.00 . A A . 9 ASP OD2 1 1 13 8804 1 1 6 ASP C C -4.267 -13.182 0.493 1.00 . A A . 10 ASP C 1 1 13 8805 1 1 6 ASP CA C -3.971 -14.403 1.371 1.00 . A A . 10 ASP CA 1 1 13 8806 1 1 6 ASP CB C -5.075 -15.450 1.221 1.00 . A A . 10 ASP CB 1 1 13 8807 1 1 6 ASP CG C -4.480 -16.741 0.655 1.00 . A A . 10 ASP CG 1 1 13 8808 1 1 6 ASP H H -4.842 -14.003 3.303 1.00 . A A . 10 ASP H 1 1 13 8809 1 1 6 ASP HA H -3.019 -14.834 1.109 1.00 . A A . 10 ASP HA 1 1 13 8810 1 1 6 ASP HB2 H -5.516 -15.651 2.186 1.00 . A A . 10 ASP HB2 1 1 13 8811 1 1 6 ASP HB3 H -5.835 -15.079 0.548 1.00 . A A . 10 ASP HB3 1 1 13 8812 1 1 6 ASP N N -3.993 -14.025 2.814 1.00 . A A . 10 ASP N 1 1 13 8813 1 1 6 ASP O O -4.578 -13.309 -0.675 1.00 . A A . 10 ASP O 1 1 13 8814 1 1 6 ASP OD1 O -3.539 -17.244 1.245 1.00 . A A . 10 ASP OD1 1 1 13 8815 1 1 6 ASP OD2 O -4.975 -17.205 -0.359 1.00 . A A . 10 ASP OD2 1 1 13 8816 1 1 7 VAL C C -3.448 -9.670 0.584 1.00 . A A . 11 VAL C 1 1 13 8817 1 1 7 VAL CA C -4.450 -10.779 0.230 1.00 . A A . 11 VAL CA 1 1 13 8818 1 1 7 VAL CB C -5.868 -10.362 0.623 1.00 . A A . 11 VAL CB 1 1 13 8819 1 1 7 VAL CG1 C -5.942 -10.168 2.140 1.00 . A A . 11 VAL CG1 1 1 13 8820 1 1 7 VAL CG2 C -6.225 -9.049 -0.078 1.00 . A A . 11 VAL CG2 1 1 13 8821 1 1 7 VAL H H -3.924 -11.912 1.984 1.00 . A A . 11 VAL H 1 1 13 8822 1 1 7 VAL HA H -4.412 -11.011 -0.820 1.00 . A A . 11 VAL HA 1 1 13 8823 1 1 7 VAL HB H -6.566 -11.130 0.324 1.00 . A A . 11 VAL HB 1 1 13 8824 1 1 7 VAL HG11 H -6.957 -9.933 2.423 1.00 . A A . 11 VAL HG11 1 1 13 8825 1 1 7 VAL HG12 H -5.289 -9.358 2.431 1.00 . A A . 11 VAL HG12 1 1 13 8826 1 1 7 VAL HG13 H -5.631 -11.076 2.634 1.00 . A A . 11 VAL HG13 1 1 13 8827 1 1 7 VAL HG21 H -5.427 -8.335 0.068 1.00 . A A . 11 VAL HG21 1 1 13 8828 1 1 7 VAL HG22 H -7.140 -8.656 0.339 1.00 . A A . 11 VAL HG22 1 1 13 8829 1 1 7 VAL HG23 H -6.357 -9.230 -1.133 1.00 . A A . 11 VAL HG23 1 1 13 8830 1 1 7 VAL N N -4.173 -11.999 1.041 1.00 . A A . 11 VAL N 1 1 13 8831 1 1 7 VAL O O -3.178 -9.435 1.745 1.00 . A A . 11 VAL O 1 1 13 8832 1 1 8 PRO C C -2.658 -6.680 0.343 1.00 . A A . 12 PRO C 1 1 13 8833 1 1 8 PRO CA C -1.947 -7.926 -0.194 1.00 . A A . 12 PRO CA 1 1 13 8834 1 1 8 PRO CB C -1.360 -7.666 -1.577 1.00 . A A . 12 PRO CB 1 1 13 8835 1 1 8 PRO CD C -3.183 -9.226 -1.861 1.00 . A A . 12 PRO CD 1 1 13 8836 1 1 8 PRO CG C -2.410 -8.125 -2.538 1.00 . A A . 12 PRO CG 1 1 13 8837 1 1 8 PRO HA H -1.171 -8.247 0.484 1.00 . A A . 12 PRO HA 1 1 13 8838 1 1 8 PRO HB2 H -1.165 -6.612 -1.709 1.00 . A A . 12 PRO HB2 1 1 13 8839 1 1 8 PRO HB3 H -0.453 -8.237 -1.713 1.00 . A A . 12 PRO HB3 1 1 13 8840 1 1 8 PRO HD2 H -4.239 -9.133 -2.072 1.00 . A A . 12 PRO HD2 1 1 13 8841 1 1 8 PRO HD3 H -2.818 -10.193 -2.175 1.00 . A A . 12 PRO HD3 1 1 13 8842 1 1 8 PRO HG2 H -3.071 -7.305 -2.780 1.00 . A A . 12 PRO HG2 1 1 13 8843 1 1 8 PRO HG3 H -1.946 -8.501 -3.439 1.00 . A A . 12 PRO HG3 1 1 13 8844 1 1 8 PRO N N -2.924 -9.018 -0.427 1.00 . A A . 12 PRO N 1 1 13 8845 1 1 8 PRO O O -2.292 -6.135 1.366 1.00 . A A . 12 PRO O 1 1 13 8846 1 1 9 LEU C C -5.911 -5.169 -0.178 1.00 . A A . 13 LEU C 1 1 13 8847 1 1 9 LEU CA C -4.414 -5.021 0.133 1.00 . A A . 13 LEU CA 1 1 13 8848 1 1 9 LEU CB C -3.811 -3.853 -0.653 1.00 . A A . 13 LEU CB 1 1 13 8849 1 1 9 LEU CD1 C -1.368 -4.323 -0.905 1.00 . A A . 13 LEU CD1 1 1 13 8850 1 1 9 LEU CD2 C -2.135 -2.040 -0.249 1.00 . A A . 13 LEU CD2 1 1 13 8851 1 1 9 LEU CG C -2.414 -3.539 -0.110 1.00 . A A . 13 LEU CG 1 1 13 8852 1 1 9 LEU H H -3.955 -6.683 -1.159 1.00 . A A . 13 LEU H 1 1 13 8853 1 1 9 LEU HA H -4.261 -4.872 1.191 1.00 . A A . 13 LEU HA 1 1 13 8854 1 1 9 LEU HB2 H -3.739 -4.122 -1.696 1.00 . A A . 13 LEU HB2 1 1 13 8855 1 1 9 LEU HB3 H -4.442 -2.983 -0.548 1.00 . A A . 13 LEU HB3 1 1 13 8856 1 1 9 LEU HD11 H -0.597 -3.650 -1.249 1.00 . A A . 13 LEU HD11 1 1 13 8857 1 1 9 LEU HD12 H -1.841 -4.794 -1.754 1.00 . A A . 13 LEU HD12 1 1 13 8858 1 1 9 LEU HD13 H -0.928 -5.080 -0.273 1.00 . A A . 13 LEU HD13 1 1 13 8859 1 1 9 LEU HD21 H -2.294 -1.738 -1.273 1.00 . A A . 13 LEU HD21 1 1 13 8860 1 1 9 LEU HD22 H -1.111 -1.838 0.032 1.00 . A A . 13 LEU HD22 1 1 13 8861 1 1 9 LEU HD23 H -2.801 -1.489 0.398 1.00 . A A . 13 LEU HD23 1 1 13 8862 1 1 9 LEU HG H -2.361 -3.821 0.931 1.00 . A A . 13 LEU HG 1 1 13 8863 1 1 9 LEU N N -3.675 -6.228 -0.337 1.00 . A A . 13 LEU N 1 1 13 8864 1 1 9 LEU O O -6.284 -5.938 -1.040 1.00 . A A . 13 LEU O 1 1 13 8865 1 1 10 PRO C C -8.582 -3.833 -0.998 1.00 . A A . 14 PRO C 1 1 13 8866 1 1 10 PRO CA C -8.193 -4.503 0.325 1.00 . A A . 14 PRO CA 1 1 13 8867 1 1 10 PRO CB C -8.770 -3.751 1.520 1.00 . A A . 14 PRO CB 1 1 13 8868 1 1 10 PRO CD C -6.369 -3.475 1.600 1.00 . A A . 14 PRO CD 1 1 13 8869 1 1 10 PRO CG C -7.681 -2.828 1.966 1.00 . A A . 14 PRO CG 1 1 13 8870 1 1 10 PRO HA H -8.525 -5.526 0.340 1.00 . A A . 14 PRO HA 1 1 13 8871 1 1 10 PRO HB2 H -9.642 -3.187 1.222 1.00 . A A . 14 PRO HB2 1 1 13 8872 1 1 10 PRO HB3 H -9.023 -4.441 2.311 1.00 . A A . 14 PRO HB3 1 1 13 8873 1 1 10 PRO HD2 H -5.675 -2.738 1.225 1.00 . A A . 14 PRO HD2 1 1 13 8874 1 1 10 PRO HD3 H -5.952 -3.994 2.451 1.00 . A A . 14 PRO HD3 1 1 13 8875 1 1 10 PRO HG2 H -7.777 -1.878 1.464 1.00 . A A . 14 PRO HG2 1 1 13 8876 1 1 10 PRO HG3 H -7.735 -2.686 3.034 1.00 . A A . 14 PRO HG3 1 1 13 8877 1 1 10 PRO N N -6.726 -4.431 0.539 1.00 . A A . 14 PRO N 1 1 13 8878 1 1 10 PRO O O -7.740 -3.398 -1.757 1.00 . A A . 14 PRO O 1 1 13 8879 1 1 11 ALA C C -10.076 -1.621 -2.538 1.00 . A A . 15 ALA C 1 1 13 8880 1 1 11 ALA CA C -10.302 -3.136 -2.565 1.00 . A A . 15 ALA CA 1 1 13 8881 1 1 11 ALA CB C -11.797 -3.450 -2.654 1.00 . A A . 15 ALA CB 1 1 13 8882 1 1 11 ALA H H -10.517 -4.129 -0.663 1.00 . A A . 15 ALA H 1 1 13 8883 1 1 11 ALA HA H -9.785 -3.579 -3.401 1.00 . A A . 15 ALA HA 1 1 13 8884 1 1 11 ALA HB1 H -12.364 -2.607 -2.291 1.00 . A A . 15 ALA HB1 1 1 13 8885 1 1 11 ALA HB2 H -12.018 -4.320 -2.053 1.00 . A A . 15 ALA HB2 1 1 13 8886 1 1 11 ALA HB3 H -12.061 -3.646 -3.682 1.00 . A A . 15 ALA HB3 1 1 13 8887 1 1 11 ALA N N -9.854 -3.762 -1.284 1.00 . A A . 15 ALA N 1 1 13 8888 1 1 11 ALA O O -9.768 -1.045 -1.514 1.00 . A A . 15 ALA O 1 1 13 8889 1 1 12 GLY C C -8.544 0.832 -3.484 1.00 . A A . 16 GLY C 1 1 13 8890 1 1 12 GLY CA C -10.023 0.503 -3.713 1.00 . A A . 16 GLY CA 1 1 13 8891 1 1 12 GLY H H -10.477 -1.460 -4.476 1.00 . A A . 16 GLY H 1 1 13 8892 1 1 12 GLY HA2 H -10.328 0.874 -4.679 1.00 . A A . 16 GLY HA2 1 1 13 8893 1 1 12 GLY HA3 H -10.619 0.974 -2.944 1.00 . A A . 16 GLY HA3 1 1 13 8894 1 1 12 GLY N N -10.227 -0.973 -3.663 1.00 . A A . 16 GLY N 1 1 13 8895 1 1 12 GLY O O -8.191 1.954 -3.179 1.00 . A A . 16 GLY O 1 1 13 8896 1 1 13 TRP C C -5.416 -0.109 -4.667 1.00 . A A . 17 TRP C 1 1 13 8897 1 1 13 TRP CA C -6.226 0.132 -3.394 1.00 . A A . 17 TRP CA 1 1 13 8898 1 1 13 TRP CB C -5.822 -0.867 -2.319 1.00 . A A . 17 TRP CB 1 1 13 8899 1 1 13 TRP CD1 C -7.004 -0.281 -0.175 1.00 . A A . 17 TRP CD1 1 1 13 8900 1 1 13 TRP CD2 C -4.957 0.628 -0.322 1.00 . A A . 17 TRP CD2 1 1 13 8901 1 1 13 TRP CE2 C -5.490 1.042 0.919 1.00 . A A . 17 TRP CE2 1 1 13 8902 1 1 13 TRP CE3 C -3.671 1.062 -0.674 1.00 . A A . 17 TRP CE3 1 1 13 8903 1 1 13 TRP CG C -5.933 -0.210 -0.991 1.00 . A A . 17 TRP CG 1 1 13 8904 1 1 13 TRP CH2 C -3.484 2.285 1.418 1.00 . A A . 17 TRP CH2 1 1 13 8905 1 1 13 TRP CZ2 C -4.765 1.861 1.785 1.00 . A A . 17 TRP CZ2 1 1 13 8906 1 1 13 TRP CZ3 C -2.942 1.885 0.190 1.00 . A A . 17 TRP CZ3 1 1 13 8907 1 1 13 TRP H H -7.975 -1.036 -3.851 1.00 . A A . 17 TRP H 1 1 13 8908 1 1 13 TRP HA H -6.078 1.137 -3.035 1.00 . A A . 17 TRP HA 1 1 13 8909 1 1 13 TRP HB2 H -6.476 -1.724 -2.355 1.00 . A A . 17 TRP HB2 1 1 13 8910 1 1 13 TRP HB3 H -4.802 -1.183 -2.484 1.00 . A A . 17 TRP HB3 1 1 13 8911 1 1 13 TRP HD1 H -7.912 -0.831 -0.380 1.00 . A A . 17 TRP HD1 1 1 13 8912 1 1 13 TRP HE1 H -7.358 0.574 1.720 1.00 . A A . 17 TRP HE1 1 1 13 8913 1 1 13 TRP HE3 H -3.241 0.761 -1.617 1.00 . A A . 17 TRP HE3 1 1 13 8914 1 1 13 TRP HH2 H -2.912 2.918 2.075 1.00 . A A . 17 TRP HH2 1 1 13 8915 1 1 13 TRP HZ2 H -5.189 2.166 2.730 1.00 . A A . 17 TRP HZ2 1 1 13 8916 1 1 13 TRP HZ3 H -1.958 2.212 -0.090 1.00 . A A . 17 TRP HZ3 1 1 13 8917 1 1 13 TRP N N -7.675 -0.136 -3.618 1.00 . A A . 17 TRP N 1 1 13 8918 1 1 13 TRP NE1 N -6.744 0.461 0.966 1.00 . A A . 17 TRP NE1 1 1 13 8919 1 1 13 TRP O O -5.711 -0.994 -5.445 1.00 . A A . 17 TRP O 1 1 13 8920 1 1 14 GLU C C -2.064 0.451 -5.755 1.00 . A A . 18 GLU C 1 1 13 8921 1 1 14 GLU CA C -3.553 0.468 -6.103 1.00 . A A . 18 GLU CA 1 1 13 8922 1 1 14 GLU CB C -3.852 1.667 -7.002 1.00 . A A . 18 GLU CB 1 1 13 8923 1 1 14 GLU CD C -6.182 1.030 -7.637 1.00 . A A . 18 GLU CD 1 1 13 8924 1 1 14 GLU CG C -4.756 1.230 -8.155 1.00 . A A . 18 GLU CG 1 1 13 8925 1 1 14 GLU H H -4.158 1.376 -4.240 1.00 . A A . 18 GLU H 1 1 13 8926 1 1 14 GLU HA H -3.834 -0.444 -6.604 1.00 . A A . 18 GLU HA 1 1 13 8927 1 1 14 GLU HB2 H -4.337 2.439 -6.430 1.00 . A A . 18 GLU HB2 1 1 13 8928 1 1 14 GLU HB3 H -2.925 2.051 -7.402 1.00 . A A . 18 GLU HB3 1 1 13 8929 1 1 14 GLU HG2 H -4.755 1.992 -8.921 1.00 . A A . 18 GLU HG2 1 1 13 8930 1 1 14 GLU HG3 H -4.388 0.304 -8.569 1.00 . A A . 18 GLU HG3 1 1 13 8931 1 1 14 GLU N N -4.385 0.667 -4.881 1.00 . A A . 18 GLU N 1 1 13 8932 1 1 14 GLU O O -1.426 1.487 -5.700 1.00 . A A . 18 GLU O 1 1 13 8933 1 1 14 GLU OE1 O -6.835 2.021 -7.355 1.00 . A A . 18 GLU OE1 1 1 13 8934 1 1 14 GLU OE2 O -6.598 -0.113 -7.532 1.00 . A A . 18 GLU OE2 1 1 13 8935 1 1 15 MET C C 0.724 -0.387 -6.508 1.00 . A A . 19 MET C 1 1 13 8936 1 1 15 MET CA C -0.041 -0.744 -5.242 1.00 . A A . 19 MET CA 1 1 13 8937 1 1 15 MET CB C 0.305 -2.166 -4.809 1.00 . A A . 19 MET CB 1 1 13 8938 1 1 15 MET CE C -2.036 -3.923 -4.075 1.00 . A A . 19 MET CE 1 1 13 8939 1 1 15 MET CG C -0.130 -3.179 -5.875 1.00 . A A . 19 MET CG 1 1 13 8940 1 1 15 MET H H -2.004 -1.535 -5.599 1.00 . A A . 19 MET H 1 1 13 8941 1 1 15 MET HA H 0.196 -0.048 -4.452 1.00 . A A . 19 MET HA 1 1 13 8942 1 1 15 MET HB2 H 1.368 -2.227 -4.685 1.00 . A A . 19 MET HB2 1 1 13 8943 1 1 15 MET HB3 H -0.171 -2.389 -3.868 1.00 . A A . 19 MET HB3 1 1 13 8944 1 1 15 MET HE1 H -2.519 -3.144 -4.648 1.00 . A A . 19 MET HE1 1 1 13 8945 1 1 15 MET HE2 H -1.605 -3.494 -3.184 1.00 . A A . 19 MET HE2 1 1 13 8946 1 1 15 MET HE3 H -2.761 -4.674 -3.795 1.00 . A A . 19 MET HE3 1 1 13 8947 1 1 15 MET HG2 H -0.911 -2.756 -6.487 1.00 . A A . 19 MET HG2 1 1 13 8948 1 1 15 MET HG3 H 0.717 -3.423 -6.499 1.00 . A A . 19 MET HG3 1 1 13 8949 1 1 15 MET N N -1.493 -0.708 -5.542 1.00 . A A . 19 MET N 1 1 13 8950 1 1 15 MET O O 0.621 -1.047 -7.522 1.00 . A A . 19 MET O 1 1 13 8951 1 1 15 MET SD S -0.734 -4.686 -5.072 1.00 . A A . 19 MET SD 1 1 13 8952 1 1 16 ALA C C 3.545 1.744 -7.131 1.00 . A A . 20 ALA C 1 1 13 8953 1 1 16 ALA CA C 2.258 1.085 -7.633 1.00 . A A . 20 ALA CA 1 1 13 8954 1 1 16 ALA CB C 1.328 2.061 -8.366 1.00 . A A . 20 ALA CB 1 1 13 8955 1 1 16 ALA H H 1.538 1.161 -5.614 1.00 . A A . 20 ALA H 1 1 13 8956 1 1 16 ALA HA H 2.487 0.240 -8.263 1.00 . A A . 20 ALA HA 1 1 13 8957 1 1 16 ALA HB1 H 0.957 1.596 -9.266 1.00 . A A . 20 ALA HB1 1 1 13 8958 1 1 16 ALA HB2 H 1.861 2.961 -8.619 1.00 . A A . 20 ALA HB2 1 1 13 8959 1 1 16 ALA HB3 H 0.492 2.309 -7.724 1.00 . A A . 20 ALA HB3 1 1 13 8960 1 1 16 ALA N N 1.479 0.654 -6.450 1.00 . A A . 20 ALA N 1 1 13 8961 1 1 16 ALA O O 4.035 1.381 -6.079 1.00 . A A . 20 ALA O 1 1 13 8962 1 1 17 LYS C C 5.353 4.813 -7.357 1.00 . A A . 21 LYS C 1 1 13 8963 1 1 17 LYS CA C 5.377 3.289 -7.316 1.00 . A A . 21 LYS CA 1 1 13 8964 1 1 17 LYS CB C 6.488 2.745 -8.215 1.00 . A A . 21 LYS CB 1 1 13 8965 1 1 17 LYS CD C 5.896 0.729 -9.566 1.00 . A A . 21 LYS CD 1 1 13 8966 1 1 17 LYS CE C 6.894 1.069 -10.675 1.00 . A A . 21 LYS CE 1 1 13 8967 1 1 17 LYS CG C 6.440 1.216 -8.222 1.00 . A A . 21 LYS CG 1 1 13 8968 1 1 17 LYS H H 3.739 2.976 -8.691 1.00 . A A . 21 LYS H 1 1 13 8969 1 1 17 LYS HA H 5.535 2.966 -6.304 1.00 . A A . 21 LYS HA 1 1 13 8970 1 1 17 LYS HB2 H 6.350 3.114 -9.219 1.00 . A A . 21 LYS HB2 1 1 13 8971 1 1 17 LYS HB3 H 7.447 3.073 -7.840 1.00 . A A . 21 LYS HB3 1 1 13 8972 1 1 17 LYS HD2 H 5.750 -0.340 -9.529 1.00 . A A . 21 LYS HD2 1 1 13 8973 1 1 17 LYS HD3 H 4.953 1.214 -9.770 1.00 . A A . 21 LYS HD3 1 1 13 8974 1 1 17 LYS HE2 H 6.373 1.304 -11.591 1.00 . A A . 21 LYS HE2 1 1 13 8975 1 1 17 LYS HE3 H 7.520 1.897 -10.375 1.00 . A A . 21 LYS HE3 1 1 13 8976 1 1 17 LYS HG2 H 7.435 0.824 -8.074 1.00 . A A . 21 LYS HG2 1 1 13 8977 1 1 17 LYS HG3 H 5.797 0.873 -7.427 1.00 . A A . 21 LYS HG3 1 1 13 8978 1 1 17 LYS HZ1 H 8.369 -0.259 -10.045 1.00 . A A . 21 LYS HZ1 1 1 13 8979 1 1 17 LYS HZ2 H 8.250 -0.104 -11.734 1.00 . A A . 21 LYS HZ2 1 1 13 8980 1 1 17 LYS HZ3 H 7.085 -0.995 -10.874 1.00 . A A . 21 LYS HZ3 1 1 13 8981 1 1 17 LYS N N 4.116 2.685 -7.838 1.00 . A A . 21 LYS N 1 1 13 8982 1 1 17 LYS NZ N 7.711 -0.166 -10.845 1.00 . A A . 21 LYS NZ 1 1 13 8983 1 1 17 LYS O O 4.630 5.426 -8.115 1.00 . A A . 21 LYS O 1 1 13 8984 1 1 18 THR C C 7.659 7.347 -6.178 1.00 . A A . 22 THR C 1 1 13 8985 1 1 18 THR CA C 6.229 6.902 -6.482 1.00 . A A . 22 THR CA 1 1 13 8986 1 1 18 THR CB C 5.299 7.310 -5.340 1.00 . A A . 22 THR CB 1 1 13 8987 1 1 18 THR CG2 C 5.798 6.701 -4.026 1.00 . A A . 22 THR CG2 1 1 13 8988 1 1 18 THR H H 6.735 4.882 -5.932 1.00 . A A . 22 THR H 1 1 13 8989 1 1 18 THR HA H 5.887 7.330 -7.410 1.00 . A A . 22 THR HA 1 1 13 8990 1 1 18 THR HB H 4.305 6.956 -5.543 1.00 . A A . 22 THR HB 1 1 13 8991 1 1 18 THR HG1 H 4.558 9.058 -5.764 1.00 . A A . 22 THR HG1 1 1 13 8992 1 1 18 THR HG21 H 4.968 6.577 -3.343 1.00 . A A . 22 THR HG21 1 1 13 8993 1 1 18 THR HG22 H 6.529 7.359 -3.584 1.00 . A A . 22 THR HG22 1 1 13 8994 1 1 18 THR HG23 H 6.251 5.738 -4.218 1.00 . A A . 22 THR HG23 1 1 13 8995 1 1 18 THR N N 6.162 5.417 -6.527 1.00 . A A . 22 THR N 1 1 13 8996 1 1 18 THR O O 8.604 6.608 -6.368 1.00 . A A . 22 THR O 1 1 13 8997 1 1 18 THR OG1 O 5.285 8.727 -5.231 1.00 . A A . 22 THR OG1 1 1 13 8998 1 1 19 SER C C 10.164 8.766 -6.517 1.00 . A A . 23 SER C 1 1 13 8999 1 1 19 SER CA C 9.186 9.054 -5.367 1.00 . A A . 23 SER CA 1 1 13 9000 1 1 19 SER CB C 9.588 8.284 -4.108 1.00 . A A . 23 SER CB 1 1 13 9001 1 1 19 SER H H 7.033 9.118 -5.551 1.00 . A A . 23 SER H 1 1 13 9002 1 1 19 SER HA H 9.155 10.111 -5.157 1.00 . A A . 23 SER HA 1 1 13 9003 1 1 19 SER HB2 H 8.701 7.994 -3.565 1.00 . A A . 23 SER HB2 1 1 13 9004 1 1 19 SER HB3 H 10.144 7.401 -4.388 1.00 . A A . 23 SER HB3 1 1 13 9005 1 1 19 SER HG H 10.195 8.907 -2.369 1.00 . A A . 23 SER HG 1 1 13 9006 1 1 19 SER N N 7.818 8.549 -5.699 1.00 . A A . 23 SER N 1 1 13 9007 1 1 19 SER O O 9.794 8.784 -7.674 1.00 . A A . 23 SER O 1 1 13 9008 1 1 19 SER OG O 10.397 9.112 -3.285 1.00 . A A . 23 SER OG 1 1 13 9009 1 1 20 SER C C 12.544 6.702 -7.499 1.00 . A A . 24 SER C 1 1 13 9010 1 1 20 SER CA C 12.395 8.214 -7.289 1.00 . A A . 24 SER CA 1 1 13 9011 1 1 20 SER CB C 13.708 8.819 -6.794 1.00 . A A . 24 SER CB 1 1 13 9012 1 1 20 SER H H 11.691 8.489 -5.273 1.00 . A A . 24 SER H 1 1 13 9013 1 1 20 SER HA H 12.094 8.690 -8.207 1.00 . A A . 24 SER HA 1 1 13 9014 1 1 20 SER HB2 H 13.502 9.549 -6.026 1.00 . A A . 24 SER HB2 1 1 13 9015 1 1 20 SER HB3 H 14.335 8.036 -6.392 1.00 . A A . 24 SER HB3 1 1 13 9016 1 1 20 SER HG H 15.075 9.998 -7.516 1.00 . A A . 24 SER HG 1 1 13 9017 1 1 20 SER N N 11.406 8.501 -6.209 1.00 . A A . 24 SER N 1 1 13 9018 1 1 20 SER O O 13.095 6.258 -8.487 1.00 . A A . 24 SER O 1 1 13 9019 1 1 20 SER OG O 14.376 9.449 -7.878 1.00 . A A . 24 SER OG 1 1 13 9020 1 1 21 GLY C C 11.662 3.726 -5.486 1.00 . A A . 25 GLY C 1 1 13 9021 1 1 21 GLY CA C 12.184 4.429 -6.743 1.00 . A A . 25 GLY CA 1 1 13 9022 1 1 21 GLY H H 11.619 6.280 -5.793 1.00 . A A . 25 GLY H 1 1 13 9023 1 1 21 GLY HA2 H 11.604 4.112 -7.598 1.00 . A A . 25 GLY HA2 1 1 13 9024 1 1 21 GLY HA3 H 13.220 4.170 -6.895 1.00 . A A . 25 GLY HA3 1 1 13 9025 1 1 21 GLY N N 12.061 5.907 -6.582 1.00 . A A . 25 GLY N 1 1 13 9026 1 1 21 GLY O O 12.396 3.480 -4.550 1.00 . A A . 25 GLY O 1 1 13 9027 1 1 22 GLN C C 8.350 2.369 -4.516 1.00 . A A . 26 GLN C 1 1 13 9028 1 1 22 GLN CA C 9.823 2.707 -4.268 1.00 . A A . 26 GLN CA 1 1 13 9029 1 1 22 GLN CB C 9.953 3.711 -3.121 1.00 . A A . 26 GLN CB 1 1 13 9030 1 1 22 GLN CD C 9.135 2.201 -1.306 1.00 . A A . 26 GLN CD 1 1 13 9031 1 1 22 GLN CG C 10.343 2.975 -1.838 1.00 . A A . 26 GLN CG 1 1 13 9032 1 1 22 GLN H H 9.822 3.605 -6.227 1.00 . A A . 26 GLN H 1 1 13 9033 1 1 22 GLN HA H 10.384 1.813 -4.041 1.00 . A A . 26 GLN HA 1 1 13 9034 1 1 22 GLN HB2 H 10.712 4.439 -3.363 1.00 . A A . 26 GLN HB2 1 1 13 9035 1 1 22 GLN HB3 H 9.008 4.214 -2.975 1.00 . A A . 26 GLN HB3 1 1 13 9036 1 1 22 GLN HE21 H 10.156 1.329 0.155 1.00 . A A . 26 GLN HE21 1 1 13 9037 1 1 22 GLN HE22 H 8.512 0.919 0.076 1.00 . A A . 26 GLN HE22 1 1 13 9038 1 1 22 GLN HG2 H 11.147 2.285 -2.049 1.00 . A A . 26 GLN HG2 1 1 13 9039 1 1 22 GLN HG3 H 10.669 3.689 -1.096 1.00 . A A . 26 GLN HG3 1 1 13 9040 1 1 22 GLN N N 10.396 3.398 -5.461 1.00 . A A . 26 GLN N 1 1 13 9041 1 1 22 GLN NE2 N 9.280 1.418 -0.273 1.00 . A A . 26 GLN NE2 1 1 13 9042 1 1 22 GLN O O 7.598 3.181 -5.032 1.00 . A A . 26 GLN O 1 1 13 9043 1 1 22 GLN OE1 O 8.048 2.310 -1.838 1.00 . A A . 26 GLN OE1 1 1 13 9044 1 1 23 ARG C C 5.612 1.442 -3.328 1.00 . A A . 27 ARG C 1 1 13 9045 1 1 23 ARG CA C 6.498 0.819 -4.388 1.00 . A A . 27 ARG CA 1 1 13 9046 1 1 23 ARG CB C 6.398 -0.704 -4.289 1.00 . A A . 27 ARG CB 1 1 13 9047 1 1 23 ARG CD C 7.525 -1.351 -6.420 1.00 . A A . 27 ARG CD 1 1 13 9048 1 1 23 ARG CG C 6.185 -1.274 -5.688 1.00 . A A . 27 ARG CG 1 1 13 9049 1 1 23 ARG CZ C 9.187 -3.135 -6.566 1.00 . A A . 27 ARG CZ 1 1 13 9050 1 1 23 ARG H H 8.539 0.539 -3.748 1.00 . A A . 27 ARG H 1 1 13 9051 1 1 23 ARG HA H 6.185 1.141 -5.369 1.00 . A A . 27 ARG HA 1 1 13 9052 1 1 23 ARG HB2 H 7.293 -1.109 -3.856 1.00 . A A . 27 ARG HB2 1 1 13 9053 1 1 23 ARG HB3 H 5.552 -0.966 -3.666 1.00 . A A . 27 ARG HB3 1 1 13 9054 1 1 23 ARG HD2 H 7.400 -1.102 -7.464 1.00 . A A . 27 ARG HD2 1 1 13 9055 1 1 23 ARG HD3 H 8.244 -0.689 -5.959 1.00 . A A . 27 ARG HD3 1 1 13 9056 1 1 23 ARG HE H 7.320 -3.442 -5.954 1.00 . A A . 27 ARG HE 1 1 13 9057 1 1 23 ARG HG2 H 5.754 -2.261 -5.616 1.00 . A A . 27 ARG HG2 1 1 13 9058 1 1 23 ARG HG3 H 5.512 -0.623 -6.232 1.00 . A A . 27 ARG HG3 1 1 13 9059 1 1 23 ARG HH11 H 9.814 -1.303 -7.104 1.00 . A A . 27 ARG HH11 1 1 13 9060 1 1 23 ARG HH12 H 10.997 -2.561 -7.212 1.00 . A A . 27 ARG HH12 1 1 13 9061 1 1 23 ARG HH21 H 8.873 -5.058 -6.104 1.00 . A A . 27 ARG HH21 1 1 13 9062 1 1 23 ARG HH22 H 10.469 -4.671 -6.650 1.00 . A A . 27 ARG HH22 1 1 13 9063 1 1 23 ARG N N 7.925 1.182 -4.160 1.00 . A A . 27 ARG N 1 1 13 9064 1 1 23 ARG NE N 7.959 -2.771 -6.273 1.00 . A A . 27 ARG NE 1 1 13 9065 1 1 23 ARG NH1 N 10.067 -2.263 -6.994 1.00 . A A . 27 ARG NH1 1 1 13 9066 1 1 23 ARG NH2 N 9.537 -4.386 -6.429 1.00 . A A . 27 ARG NH2 1 1 13 9067 1 1 23 ARG O O 5.743 1.169 -2.150 1.00 . A A . 27 ARG O 1 1 13 9068 1 1 24 TYR C C 2.369 2.278 -2.982 1.00 . A A . 28 TYR C 1 1 13 9069 1 1 24 TYR CA C 3.753 2.841 -2.755 1.00 . A A . 28 TYR CA 1 1 13 9070 1 1 24 TYR CB C 3.829 4.376 -2.924 1.00 . A A . 28 TYR CB 1 1 13 9071 1 1 24 TYR CD1 C 2.605 4.114 -5.156 1.00 . A A . 28 TYR CD1 1 1 13 9072 1 1 24 TYR CD2 C 2.548 6.254 -4.025 1.00 . A A . 28 TYR CD2 1 1 13 9073 1 1 24 TYR CE1 C 1.855 4.646 -6.201 1.00 . A A . 28 TYR CE1 1 1 13 9074 1 1 24 TYR CE2 C 1.785 6.779 -5.072 1.00 . A A . 28 TYR CE2 1 1 13 9075 1 1 24 TYR CG C 2.960 4.913 -4.060 1.00 . A A . 28 TYR CG 1 1 13 9076 1 1 24 TYR CZ C 1.443 5.976 -6.162 1.00 . A A . 28 TYR CZ 1 1 13 9077 1 1 24 TYR H H 4.578 2.413 -4.699 1.00 . A A . 28 TYR H 1 1 13 9078 1 1 24 TYR HA H 4.071 2.573 -1.758 1.00 . A A . 28 TYR HA 1 1 13 9079 1 1 24 TYR HB2 H 3.514 4.840 -2.002 1.00 . A A . 28 TYR HB2 1 1 13 9080 1 1 24 TYR HB3 H 4.855 4.649 -3.116 1.00 . A A . 28 TYR HB3 1 1 13 9081 1 1 24 TYR HD1 H 2.901 3.087 -5.192 1.00 . A A . 28 TYR HD1 1 1 13 9082 1 1 24 TYR HD2 H 2.800 6.882 -3.183 1.00 . A A . 28 TYR HD2 1 1 13 9083 1 1 24 TYR HE1 H 1.583 4.025 -7.036 1.00 . A A . 28 TYR HE1 1 1 13 9084 1 1 24 TYR HE2 H 1.464 7.804 -5.040 1.00 . A A . 28 TYR HE2 1 1 13 9085 1 1 24 TYR HH H 1.314 6.649 -7.941 1.00 . A A . 28 TYR HH 1 1 13 9086 1 1 24 TYR N N 4.683 2.241 -3.742 1.00 . A A . 28 TYR N 1 1 13 9087 1 1 24 TYR O O 2.135 1.521 -3.905 1.00 . A A . 28 TYR O 1 1 13 9088 1 1 24 TYR OH O 0.714 6.500 -7.207 1.00 . A A . 28 TYR OH 1 1 13 9089 1 1 25 PHE C C -0.887 3.208 -2.301 1.00 . A A . 29 PHE C 1 1 13 9090 1 1 25 PHE CA C 0.102 2.065 -2.287 1.00 . A A . 29 PHE CA 1 1 13 9091 1 1 25 PHE CB C -0.053 1.125 -1.097 1.00 . A A . 29 PHE CB 1 1 13 9092 1 1 25 PHE CD1 C 2.301 0.171 -1.017 1.00 . A A . 29 PHE CD1 1 1 13 9093 1 1 25 PHE CD2 C 0.492 -1.209 -1.847 1.00 . A A . 29 PHE CD2 1 1 13 9094 1 1 25 PHE CE1 C 3.206 -0.870 -1.266 1.00 . A A . 29 PHE CE1 1 1 13 9095 1 1 25 PHE CE2 C 1.398 -2.245 -2.100 1.00 . A A . 29 PHE CE2 1 1 13 9096 1 1 25 PHE CG C 0.937 -0.003 -1.307 1.00 . A A . 29 PHE CG 1 1 13 9097 1 1 25 PHE CZ C 2.752 -2.077 -1.810 1.00 . A A . 29 PHE CZ 1 1 13 9098 1 1 25 PHE H H 1.677 3.204 -1.391 1.00 . A A . 29 PHE H 1 1 13 9099 1 1 25 PHE HA H 0.030 1.504 -3.207 1.00 . A A . 29 PHE HA 1 1 13 9100 1 1 25 PHE HB2 H 0.160 1.649 -0.174 1.00 . A A . 29 PHE HB2 1 1 13 9101 1 1 25 PHE HB3 H -1.057 0.730 -1.070 1.00 . A A . 29 PHE HB3 1 1 13 9102 1 1 25 PHE HD1 H 2.657 1.106 -0.600 1.00 . A A . 29 PHE HD1 1 1 13 9103 1 1 25 PHE HD2 H -0.550 -1.339 -2.072 1.00 . A A . 29 PHE HD2 1 1 13 9104 1 1 25 PHE HE1 H 4.252 -0.738 -1.050 1.00 . A A . 29 PHE HE1 1 1 13 9105 1 1 25 PHE HE2 H 1.046 -3.175 -2.525 1.00 . A A . 29 PHE HE2 1 1 13 9106 1 1 25 PHE HZ H 3.448 -2.876 -2.013 1.00 . A A . 29 PHE HZ 1 1 13 9107 1 1 25 PHE N N 1.462 2.609 -2.136 1.00 . A A . 29 PHE N 1 1 13 9108 1 1 25 PHE O O -1.166 3.831 -1.293 1.00 . A A . 29 PHE O 1 1 13 9109 1 1 26 LEU C C -3.738 4.184 -3.196 1.00 . A A . 30 LEU C 1 1 13 9110 1 1 26 LEU CA C -2.330 4.638 -3.578 1.00 . A A . 30 LEU CA 1 1 13 9111 1 1 26 LEU CB C -2.244 5.072 -5.047 1.00 . A A . 30 LEU CB 1 1 13 9112 1 1 26 LEU CD1 C -1.803 6.969 -6.604 1.00 . A A . 30 LEU CD1 1 1 13 9113 1 1 26 LEU CD2 C -2.338 7.460 -4.231 1.00 . A A . 30 LEU CD2 1 1 13 9114 1 1 26 LEU CG C -1.641 6.480 -5.167 1.00 . A A . 30 LEU CG 1 1 13 9115 1 1 26 LEU H H -1.119 3.005 -4.262 1.00 . A A . 30 LEU H 1 1 13 9116 1 1 26 LEU HA H -2.016 5.437 -2.936 1.00 . A A . 30 LEU HA 1 1 13 9117 1 1 26 LEU HB2 H -1.609 4.380 -5.583 1.00 . A A . 30 LEU HB2 1 1 13 9118 1 1 26 LEU HB3 H -3.225 5.068 -5.485 1.00 . A A . 30 LEU HB3 1 1 13 9119 1 1 26 LEU HD11 H -1.167 7.827 -6.764 1.00 . A A . 30 LEU HD11 1 1 13 9120 1 1 26 LEU HD12 H -2.832 7.244 -6.778 1.00 . A A . 30 LEU HD12 1 1 13 9121 1 1 26 LEU HD13 H -1.521 6.180 -7.286 1.00 . A A . 30 LEU HD13 1 1 13 9122 1 1 26 LEU HD21 H -3.405 7.374 -4.350 1.00 . A A . 30 LEU HD21 1 1 13 9123 1 1 26 LEU HD22 H -2.023 8.461 -4.476 1.00 . A A . 30 LEU HD22 1 1 13 9124 1 1 26 LEU HD23 H -2.067 7.243 -3.212 1.00 . A A . 30 LEU HD23 1 1 13 9125 1 1 26 LEU HG H -0.596 6.444 -4.919 1.00 . A A . 30 LEU HG 1 1 13 9126 1 1 26 LEU N N -1.388 3.512 -3.460 1.00 . A A . 30 LEU N 1 1 13 9127 1 1 26 LEU O O -4.374 3.415 -3.893 1.00 . A A . 30 LEU O 1 1 13 9128 1 1 27 ASN C C -6.617 5.112 -2.345 1.00 . A A . 31 ASN C 1 1 13 9129 1 1 27 ASN CA C -5.570 4.278 -1.609 1.00 . A A . 31 ASN CA 1 1 13 9130 1 1 27 ASN CB C -5.565 4.618 -0.120 1.00 . A A . 31 ASN CB 1 1 13 9131 1 1 27 ASN CG C -6.856 4.136 0.528 1.00 . A A . 31 ASN CG 1 1 13 9132 1 1 27 ASN H H -3.667 5.268 -1.540 1.00 . A A . 31 ASN H 1 1 13 9133 1 1 27 ASN HA H -5.746 3.225 -1.753 1.00 . A A . 31 ASN HA 1 1 13 9134 1 1 27 ASN HB2 H -4.732 4.131 0.360 1.00 . A A . 31 ASN HB2 1 1 13 9135 1 1 27 ASN HB3 H -5.478 5.685 0.004 1.00 . A A . 31 ASN HB3 1 1 13 9136 1 1 27 ASN HD21 H -6.011 3.880 2.302 1.00 . A A . 31 ASN HD21 1 1 13 9137 1 1 27 ASN HD22 H -7.654 3.490 2.217 1.00 . A A . 31 ASN HD22 1 1 13 9138 1 1 27 ASN N N -4.213 4.656 -2.079 1.00 . A A . 31 ASN N 1 1 13 9139 1 1 27 ASN ND2 N -6.841 3.810 1.788 1.00 . A A . 31 ASN ND2 1 1 13 9140 1 1 27 ASN O O -6.695 6.314 -2.168 1.00 . A A . 31 ASN O 1 1 13 9141 1 1 27 ASN OD1 O -7.884 4.062 -0.112 1.00 . A A . 31 ASN OD1 1 1 13 9142 1 1 28 HIS C C -9.700 5.458 -3.055 1.00 . A A . 32 HIS C 1 1 13 9143 1 1 28 HIS CA C -8.460 5.230 -3.927 1.00 . A A . 32 HIS CA 1 1 13 9144 1 1 28 HIS CB C -8.800 4.333 -5.118 1.00 . A A . 32 HIS CB 1 1 13 9145 1 1 28 HIS CD2 C -6.464 4.499 -6.309 1.00 . A A . 32 HIS CD2 1 1 13 9146 1 1 28 HIS CE1 C -7.148 5.162 -8.255 1.00 . A A . 32 HIS CE1 1 1 13 9147 1 1 28 HIS CG C -7.831 4.596 -6.238 1.00 . A A . 32 HIS CG 1 1 13 9148 1 1 28 HIS H H -7.321 3.514 -3.293 1.00 . A A . 32 HIS H 1 1 13 9149 1 1 28 HIS HA H -8.068 6.171 -4.277 1.00 . A A . 32 HIS HA 1 1 13 9150 1 1 28 HIS HB2 H -8.733 3.297 -4.819 1.00 . A A . 32 HIS HB2 1 1 13 9151 1 1 28 HIS HB3 H -9.804 4.547 -5.453 1.00 . A A . 32 HIS HB3 1 1 13 9152 1 1 28 HIS HD1 H -9.171 5.188 -7.769 1.00 . A A . 32 HIS HD1 1 1 13 9153 1 1 28 HIS HD2 H -5.818 4.191 -5.500 1.00 . A A . 32 HIS HD2 1 1 13 9154 1 1 28 HIS HE1 H -7.165 5.485 -9.286 1.00 . A A . 32 HIS HE1 1 1 13 9155 1 1 28 HIS N N -7.414 4.482 -3.169 1.00 . A A . 32 HIS N 1 1 13 9156 1 1 28 HIS ND1 N -8.246 5.021 -7.490 1.00 . A A . 32 HIS ND1 1 1 13 9157 1 1 28 HIS NE2 N -6.034 4.858 -7.585 1.00 . A A . 32 HIS NE2 1 1 13 9158 1 1 28 HIS O O -10.585 6.209 -3.410 1.00 . A A . 32 HIS O 1 1 13 9159 1 1 29 ILE C C -10.704 6.300 -0.205 1.00 . A A . 33 ILE C 1 1 13 9160 1 1 29 ILE CA C -10.951 5.041 -1.018 1.00 . A A . 33 ILE CA 1 1 13 9161 1 1 29 ILE CB C -11.059 3.827 -0.064 1.00 . A A . 33 ILE CB 1 1 13 9162 1 1 29 ILE CD1 C -10.886 1.297 0.077 1.00 . A A . 33 ILE CD1 1 1 13 9163 1 1 29 ILE CG1 C -10.476 2.551 -0.710 1.00 . A A . 33 ILE CG1 1 1 13 9164 1 1 29 ILE CG2 C -12.541 3.611 0.273 1.00 . A A . 33 ILE CG2 1 1 13 9165 1 1 29 ILE H H -9.037 4.246 -1.630 1.00 . A A . 33 ILE H 1 1 13 9166 1 1 29 ILE HA H -11.852 5.139 -1.604 1.00 . A A . 33 ILE HA 1 1 13 9167 1 1 29 ILE HB H -10.520 4.046 0.849 1.00 . A A . 33 ILE HB 1 1 13 9168 1 1 29 ILE HD11 H -11.619 0.742 -0.489 1.00 . A A . 33 ILE HD11 1 1 13 9169 1 1 29 ILE HD12 H -11.311 1.592 1.026 1.00 . A A . 33 ILE HD12 1 1 13 9170 1 1 29 ILE HD13 H -10.018 0.679 0.249 1.00 . A A . 33 ILE HD13 1 1 13 9171 1 1 29 ILE HG12 H -10.830 2.476 -1.723 1.00 . A A . 33 ILE HG12 1 1 13 9172 1 1 29 ILE HG13 H -9.398 2.622 -0.712 1.00 . A A . 33 ILE HG13 1 1 13 9173 1 1 29 ILE HG21 H -12.944 4.509 0.717 1.00 . A A . 33 ILE HG21 1 1 13 9174 1 1 29 ILE HG22 H -12.635 2.791 0.968 1.00 . A A . 33 ILE HG22 1 1 13 9175 1 1 29 ILE HG23 H -13.085 3.381 -0.632 1.00 . A A . 33 ILE HG23 1 1 13 9176 1 1 29 ILE N N -9.766 4.832 -1.910 1.00 . A A . 33 ILE N 1 1 13 9177 1 1 29 ILE O O -11.439 7.266 -0.276 1.00 . A A . 33 ILE O 1 1 13 9178 1 1 30 ASP C C -8.336 8.399 0.600 1.00 . A A . 34 ASP C 1 1 13 9179 1 1 30 ASP CA C -9.308 7.492 1.372 1.00 . A A . 34 ASP CA 1 1 13 9180 1 1 30 ASP CB C -8.639 6.934 2.628 1.00 . A A . 34 ASP CB 1 1 13 9181 1 1 30 ASP CG C -9.688 6.243 3.500 1.00 . A A . 34 ASP CG 1 1 13 9182 1 1 30 ASP H H -9.073 5.497 0.571 1.00 . A A . 34 ASP H 1 1 13 9183 1 1 30 ASP HA H -10.201 8.035 1.639 1.00 . A A . 34 ASP HA 1 1 13 9184 1 1 30 ASP HB2 H -7.879 6.220 2.345 1.00 . A A . 34 ASP HB2 1 1 13 9185 1 1 30 ASP HB3 H -8.185 7.742 3.183 1.00 . A A . 34 ASP HB3 1 1 13 9186 1 1 30 ASP N N -9.650 6.294 0.553 1.00 . A A . 34 ASP N 1 1 13 9187 1 1 30 ASP O O -7.803 9.349 1.140 1.00 . A A . 34 ASP O 1 1 13 9188 1 1 30 ASP OD1 O -10.841 6.636 3.430 1.00 . A A . 34 ASP OD1 1 1 13 9189 1 1 30 ASP OD2 O -9.322 5.333 4.225 1.00 . A A . 34 ASP OD2 1 1 13 9190 1 1 31 GLN C C -5.867 9.215 -0.698 1.00 . A A . 35 GLN C 1 1 13 9191 1 1 31 GLN CA C -7.163 8.952 -1.469 1.00 . A A . 35 GLN CA 1 1 13 9192 1 1 31 GLN CB C -7.901 10.266 -1.731 1.00 . A A . 35 GLN CB 1 1 13 9193 1 1 31 GLN CD C -10.079 11.283 -2.419 1.00 . A A . 35 GLN CD 1 1 13 9194 1 1 31 GLN CG C -9.289 9.977 -2.311 1.00 . A A . 35 GLN CG 1 1 13 9195 1 1 31 GLN H H -8.539 7.343 -1.075 1.00 . A A . 35 GLN H 1 1 13 9196 1 1 31 GLN HA H -6.946 8.464 -2.407 1.00 . A A . 35 GLN HA 1 1 13 9197 1 1 31 GLN HB2 H -8.002 10.812 -0.807 1.00 . A A . 35 GLN HB2 1 1 13 9198 1 1 31 GLN HB3 H -7.335 10.857 -2.436 1.00 . A A . 35 GLN HB3 1 1 13 9199 1 1 31 GLN HE21 H -11.847 10.377 -2.424 1.00 . A A . 35 GLN HE21 1 1 13 9200 1 1 31 GLN HE22 H -11.898 12.071 -2.531 1.00 . A A . 35 GLN HE22 1 1 13 9201 1 1 31 GLN HG2 H -9.185 9.536 -3.292 1.00 . A A . 35 GLN HG2 1 1 13 9202 1 1 31 GLN HG3 H -9.814 9.291 -1.662 1.00 . A A . 35 GLN HG3 1 1 13 9203 1 1 31 GLN N N -8.100 8.113 -0.658 1.00 . A A . 35 GLN N 1 1 13 9204 1 1 31 GLN NE2 N -11.382 11.240 -2.461 1.00 . A A . 35 GLN NE2 1 1 13 9205 1 1 31 GLN O O -5.669 10.278 -0.144 1.00 . A A . 35 GLN O 1 1 13 9206 1 1 31 GLN OE1 O -9.505 12.352 -2.465 1.00 . A A . 35 GLN OE1 1 1 13 9207 1 1 32 THR C C -2.596 7.567 -0.495 1.00 . A A . 36 THR C 1 1 13 9208 1 1 32 THR CA C -3.696 8.471 0.073 1.00 . A A . 36 THR CA 1 1 13 9209 1 1 32 THR CB C -3.993 8.103 1.531 1.00 . A A . 36 THR CB 1 1 13 9210 1 1 32 THR CG2 C -4.456 9.352 2.286 1.00 . A A . 36 THR CG2 1 1 13 9211 1 1 32 THR H H -5.161 7.404 -1.121 1.00 . A A . 36 THR H 1 1 13 9212 1 1 32 THR HA H -3.397 9.504 0.010 1.00 . A A . 36 THR HA 1 1 13 9213 1 1 32 THR HB H -3.097 7.722 1.996 1.00 . A A . 36 THR HB 1 1 13 9214 1 1 32 THR HG1 H -4.905 6.618 2.394 1.00 . A A . 36 THR HG1 1 1 13 9215 1 1 32 THR HG21 H -5.526 9.461 2.180 1.00 . A A . 36 THR HG21 1 1 13 9216 1 1 32 THR HG22 H -3.962 10.222 1.881 1.00 . A A . 36 THR HG22 1 1 13 9217 1 1 32 THR HG23 H -4.208 9.252 3.333 1.00 . A A . 36 THR HG23 1 1 13 9218 1 1 32 THR N N -4.982 8.259 -0.661 1.00 . A A . 36 THR N 1 1 13 9219 1 1 32 THR O O -2.860 6.660 -1.257 1.00 . A A . 36 THR O 1 1 13 9220 1 1 32 THR OG1 O -5.011 7.115 1.580 1.00 . A A . 36 THR OG1 1 1 13 9221 1 1 33 THR C C 0.576 6.389 0.490 1.00 . A A . 37 THR C 1 1 13 9222 1 1 33 THR CA C -0.258 6.956 -0.661 1.00 . A A . 37 THR CA 1 1 13 9223 1 1 33 THR CB C 0.621 7.878 -1.513 1.00 . A A . 37 THR CB 1 1 13 9224 1 1 33 THR CG2 C -0.221 8.652 -2.530 1.00 . A A . 37 THR CG2 1 1 13 9225 1 1 33 THR H H -1.167 8.545 0.482 1.00 . A A . 37 THR H 1 1 13 9226 1 1 33 THR HA H -0.652 6.158 -1.270 1.00 . A A . 37 THR HA 1 1 13 9227 1 1 33 THR HB H 1.348 7.279 -2.042 1.00 . A A . 37 THR HB 1 1 13 9228 1 1 33 THR HG1 H 1.946 8.303 -0.157 1.00 . A A . 37 THR HG1 1 1 13 9229 1 1 33 THR HG21 H -1.253 8.667 -2.216 1.00 . A A . 37 THR HG21 1 1 13 9230 1 1 33 THR HG22 H -0.145 8.172 -3.494 1.00 . A A . 37 THR HG22 1 1 13 9231 1 1 33 THR HG23 H 0.147 9.663 -2.604 1.00 . A A . 37 THR HG23 1 1 13 9232 1 1 33 THR N N -1.363 7.808 -0.133 1.00 . A A . 37 THR N 1 1 13 9233 1 1 33 THR O O 1.437 7.058 1.026 1.00 . A A . 37 THR O 1 1 13 9234 1 1 33 THR OG1 O 1.297 8.794 -0.665 1.00 . A A . 37 THR OG1 1 1 13 9235 1 1 34 THR C C 2.204 3.619 1.363 1.00 . A A . 38 THR C 1 1 13 9236 1 1 34 THR CA C 1.164 4.570 1.963 1.00 . A A . 38 THR CA 1 1 13 9237 1 1 34 THR CB C 0.169 3.820 2.861 1.00 . A A . 38 THR CB 1 1 13 9238 1 1 34 THR CG2 C -0.367 2.581 2.140 1.00 . A A . 38 THR CG2 1 1 13 9239 1 1 34 THR H H -0.335 4.623 0.409 1.00 . A A . 38 THR H 1 1 13 9240 1 1 34 THR HA H 1.653 5.349 2.526 1.00 . A A . 38 THR HA 1 1 13 9241 1 1 34 THR HB H -0.655 4.472 3.104 1.00 . A A . 38 THR HB 1 1 13 9242 1 1 34 THR HG1 H 0.633 4.078 4.731 1.00 . A A . 38 THR HG1 1 1 13 9243 1 1 34 THR HG21 H -1.223 2.195 2.673 1.00 . A A . 38 THR HG21 1 1 13 9244 1 1 34 THR HG22 H 0.402 1.826 2.102 1.00 . A A . 38 THR HG22 1 1 13 9245 1 1 34 THR HG23 H -0.657 2.849 1.138 1.00 . A A . 38 THR HG23 1 1 13 9246 1 1 34 THR N N 0.351 5.161 0.861 1.00 . A A . 38 THR N 1 1 13 9247 1 1 34 THR O O 1.885 2.773 0.554 1.00 . A A . 38 THR O 1 1 13 9248 1 1 34 THR OG1 O 0.824 3.421 4.057 1.00 . A A . 38 THR OG1 1 1 13 9249 1 1 35 TRP C C 4.196 1.403 1.556 1.00 . A A . 39 TRP C 1 1 13 9250 1 1 35 TRP CA C 4.488 2.855 1.166 1.00 . A A . 39 TRP CA 1 1 13 9251 1 1 35 TRP CB C 5.828 3.299 1.774 1.00 . A A . 39 TRP CB 1 1 13 9252 1 1 35 TRP CD1 C 5.740 5.638 2.744 1.00 . A A . 39 TRP CD1 1 1 13 9253 1 1 35 TRP CD2 C 6.478 5.626 0.615 1.00 . A A . 39 TRP CD2 1 1 13 9254 1 1 35 TRP CE2 C 6.485 6.976 1.047 1.00 . A A . 39 TRP CE2 1 1 13 9255 1 1 35 TRP CE3 C 6.905 5.355 -0.701 1.00 . A A . 39 TRP CE3 1 1 13 9256 1 1 35 TRP CG C 5.996 4.793 1.717 1.00 . A A . 39 TRP CG 1 1 13 9257 1 1 35 TRP CH2 C 7.322 7.721 -1.085 1.00 . A A . 39 TRP CH2 1 1 13 9258 1 1 35 TRP CZ2 C 6.900 8.010 0.213 1.00 . A A . 39 TRP CZ2 1 1 13 9259 1 1 35 TRP CZ3 C 7.323 6.396 -1.540 1.00 . A A . 39 TRP CZ3 1 1 13 9260 1 1 35 TRP H H 3.686 4.445 2.387 1.00 . A A . 39 TRP H 1 1 13 9261 1 1 35 TRP HA H 4.516 2.953 0.092 1.00 . A A . 39 TRP HA 1 1 13 9262 1 1 35 TRP HB2 H 5.870 2.981 2.805 1.00 . A A . 39 TRP HB2 1 1 13 9263 1 1 35 TRP HB3 H 6.634 2.832 1.228 1.00 . A A . 39 TRP HB3 1 1 13 9264 1 1 35 TRP HD1 H 5.368 5.351 3.716 1.00 . A A . 39 TRP HD1 1 1 13 9265 1 1 35 TRP HE1 H 5.924 7.732 2.902 1.00 . A A . 39 TRP HE1 1 1 13 9266 1 1 35 TRP HE3 H 6.904 4.345 -1.074 1.00 . A A . 39 TRP HE3 1 1 13 9267 1 1 35 TRP HH2 H 7.646 8.517 -1.738 1.00 . A A . 39 TRP HH2 1 1 13 9268 1 1 35 TRP HZ2 H 6.899 9.027 0.572 1.00 . A A . 39 TRP HZ2 1 1 13 9269 1 1 35 TRP HZ3 H 7.652 6.174 -2.543 1.00 . A A . 39 TRP HZ3 1 1 13 9270 1 1 35 TRP N N 3.444 3.754 1.739 1.00 . A A . 39 TRP N 1 1 13 9271 1 1 35 TRP NE1 N 6.026 6.931 2.345 1.00 . A A . 39 TRP NE1 1 1 13 9272 1 1 35 TRP O O 4.303 0.501 0.750 1.00 . A A . 39 TRP O 1 1 13 9273 1 1 36 GLN C C 2.109 -0.616 2.829 1.00 . A A . 40 GLN C 1 1 13 9274 1 1 36 GLN CA C 3.535 -0.224 3.225 1.00 . A A . 40 GLN CA 1 1 13 9275 1 1 36 GLN CB C 3.682 -0.199 4.747 1.00 . A A . 40 GLN CB 1 1 13 9276 1 1 36 GLN CD C 5.009 1.562 5.924 1.00 . A A . 40 GLN CD 1 1 13 9277 1 1 36 GLN CG C 5.093 0.265 5.117 1.00 . A A . 40 GLN CG 1 1 13 9278 1 1 36 GLN H H 3.751 1.911 3.424 1.00 . A A . 40 GLN H 1 1 13 9279 1 1 36 GLN HA H 4.248 -0.912 2.799 1.00 . A A . 40 GLN HA 1 1 13 9280 1 1 36 GLN HB2 H 2.957 0.482 5.168 1.00 . A A . 40 GLN HB2 1 1 13 9281 1 1 36 GLN HB3 H 3.515 -1.191 5.142 1.00 . A A . 40 GLN HB3 1 1 13 9282 1 1 36 GLN HE21 H 6.386 2.494 4.839 1.00 . A A . 40 GLN HE21 1 1 13 9283 1 1 36 GLN HE22 H 5.724 3.405 6.108 1.00 . A A . 40 GLN HE22 1 1 13 9284 1 1 36 GLN HG2 H 5.579 -0.496 5.708 1.00 . A A . 40 GLN HG2 1 1 13 9285 1 1 36 GLN HG3 H 5.662 0.439 4.215 1.00 . A A . 40 GLN HG3 1 1 13 9286 1 1 36 GLN N N 3.830 1.171 2.787 1.00 . A A . 40 GLN N 1 1 13 9287 1 1 36 GLN NE2 N 5.768 2.570 5.597 1.00 . A A . 40 GLN NE2 1 1 13 9288 1 1 36 GLN O O 1.524 -0.043 1.932 1.00 . A A . 40 GLN O 1 1 13 9289 1 1 36 GLN OE1 O 4.244 1.657 6.864 1.00 . A A . 40 GLN OE1 1 1 13 9290 1 1 37 ASP C C -0.710 -2.057 4.415 1.00 . A A . 41 ASP C 1 1 13 9291 1 1 37 ASP CA C 0.158 -2.020 3.150 1.00 . A A . 41 ASP CA 1 1 13 9292 1 1 37 ASP CB C 0.310 -3.424 2.562 1.00 . A A . 41 ASP CB 1 1 13 9293 1 1 37 ASP CG C 1.187 -3.359 1.310 1.00 . A A . 41 ASP CG 1 1 13 9294 1 1 37 ASP H H 2.035 -2.042 4.208 1.00 . A A . 41 ASP H 1 1 13 9295 1 1 37 ASP HA H -0.272 -1.356 2.416 1.00 . A A . 41 ASP HA 1 1 13 9296 1 1 37 ASP HB2 H 0.771 -4.071 3.292 1.00 . A A . 41 ASP HB2 1 1 13 9297 1 1 37 ASP HB3 H -0.664 -3.811 2.300 1.00 . A A . 41 ASP HB3 1 1 13 9298 1 1 37 ASP N N 1.545 -1.592 3.489 1.00 . A A . 41 ASP N 1 1 13 9299 1 1 37 ASP O O -0.228 -2.384 5.482 1.00 . A A . 41 ASP O 1 1 13 9300 1 1 37 ASP OD1 O 1.031 -2.419 0.548 1.00 . A A . 41 ASP OD1 1 1 13 9301 1 1 37 ASP OD2 O 1.998 -4.252 1.133 1.00 . A A . 41 ASP OD2 1 1 13 9302 1 1 38 PRO C C -3.260 -3.149 5.816 1.00 . A A . 42 PRO C 1 1 13 9303 1 1 38 PRO CA C -2.897 -1.716 5.414 1.00 . A A . 42 PRO CA 1 1 13 9304 1 1 38 PRO CB C -4.122 -0.970 4.891 1.00 . A A . 42 PRO CB 1 1 13 9305 1 1 38 PRO CD C -2.634 -1.308 3.013 1.00 . A A . 42 PRO CD 1 1 13 9306 1 1 38 PRO CG C -4.081 -1.147 3.404 1.00 . A A . 42 PRO CG 1 1 13 9307 1 1 38 PRO HA H -2.469 -1.183 6.246 1.00 . A A . 42 PRO HA 1 1 13 9308 1 1 38 PRO HB2 H -5.024 -1.403 5.295 1.00 . A A . 42 PRO HB2 1 1 13 9309 1 1 38 PRO HB3 H -4.060 0.077 5.145 1.00 . A A . 42 PRO HB3 1 1 13 9310 1 1 38 PRO HD2 H -2.530 -2.076 2.258 1.00 . A A . 42 PRO HD2 1 1 13 9311 1 1 38 PRO HD3 H -2.232 -0.372 2.658 1.00 . A A . 42 PRO HD3 1 1 13 9312 1 1 38 PRO HG2 H -4.640 -2.026 3.122 1.00 . A A . 42 PRO HG2 1 1 13 9313 1 1 38 PRO HG3 H -4.497 -0.277 2.921 1.00 . A A . 42 PRO HG3 1 1 13 9314 1 1 38 PRO N N -1.967 -1.717 4.259 1.00 . A A . 42 PRO N 1 1 13 9315 1 1 38 PRO O O -3.092 -3.545 6.952 1.00 . A A . 42 PRO O 1 1 13 9316 1 1 39 ARG C C -5.045 -5.366 6.455 1.00 . A A . 43 ARG C 1 1 13 9317 1 1 39 ARG CA C -4.133 -5.335 5.225 1.00 . A A . 43 ARG CA 1 1 13 9318 1 1 39 ARG CB C -2.809 -6.039 5.522 1.00 . A A . 43 ARG CB 1 1 13 9319 1 1 39 ARG CD C -1.521 -7.958 4.572 1.00 . A A . 43 ARG CD 1 1 13 9320 1 1 39 ARG CG C -2.895 -7.496 5.066 1.00 . A A . 43 ARG CG 1 1 13 9321 1 1 39 ARG CZ C -0.060 -7.161 2.786 1.00 . A A . 43 ARG CZ 1 1 13 9322 1 1 39 ARG H H -3.887 -3.591 3.984 1.00 . A A . 43 ARG H 1 1 13 9323 1 1 39 ARG HA H -4.618 -5.803 4.385 1.00 . A A . 43 ARG HA 1 1 13 9324 1 1 39 ARG HB2 H -2.011 -5.540 4.992 1.00 . A A . 43 ARG HB2 1 1 13 9325 1 1 39 ARG HB3 H -2.612 -6.003 6.583 1.00 . A A . 43 ARG HB3 1 1 13 9326 1 1 39 ARG HD2 H -0.791 -7.877 5.364 1.00 . A A . 43 ARG HD2 1 1 13 9327 1 1 39 ARG HD3 H -1.576 -8.975 4.212 1.00 . A A . 43 ARG HD3 1 1 13 9328 1 1 39 ARG HE H -1.807 -6.312 3.216 1.00 . A A . 43 ARG HE 1 1 13 9329 1 1 39 ARG HG2 H -3.206 -8.115 5.895 1.00 . A A . 43 ARG HG2 1 1 13 9330 1 1 39 ARG HG3 H -3.613 -7.581 4.264 1.00 . A A . 43 ARG HG3 1 1 13 9331 1 1 39 ARG HH11 H 0.605 -8.749 3.824 1.00 . A A . 43 ARG HH11 1 1 13 9332 1 1 39 ARG HH12 H 1.645 -8.191 2.560 1.00 . A A . 43 ARG HH12 1 1 13 9333 1 1 39 ARG HH21 H -0.440 -5.608 1.580 1.00 . A A . 43 ARG HH21 1 1 13 9334 1 1 39 ARG HH22 H 1.060 -6.428 1.297 1.00 . A A . 43 ARG HH22 1 1 13 9335 1 1 39 ARG N N -3.758 -3.928 4.894 1.00 . A A . 43 ARG N 1 1 13 9336 1 1 39 ARG NE N -1.183 -7.029 3.455 1.00 . A A . 43 ARG NE 1 1 13 9337 1 1 39 ARG NH1 N 0.795 -8.109 3.081 1.00 . A A . 43 ARG NH1 1 1 13 9338 1 1 39 ARG NH2 N 0.207 -6.334 1.812 1.00 . A A . 43 ARG NH2 1 1 13 9339 1 1 39 ARG O O -5.538 -4.350 6.903 1.00 . A A . 43 ARG O 1 1 13 9340 1 1 40 LYS C C -5.304 -6.729 9.478 1.00 . A A . 44 LYS C 1 1 13 9341 1 1 40 LYS CA C -6.153 -6.623 8.208 1.00 . A A . 44 LYS CA 1 1 13 9342 1 1 40 LYS CB C -6.970 -7.899 8.000 1.00 . A A . 44 LYS CB 1 1 13 9343 1 1 40 LYS CD C -9.392 -7.293 8.088 1.00 . A A . 44 LYS CD 1 1 13 9344 1 1 40 LYS CE C -10.104 -6.220 8.915 1.00 . A A . 44 LYS CE 1 1 13 9345 1 1 40 LYS CG C -8.216 -7.858 8.886 1.00 . A A . 44 LYS CG 1 1 13 9346 1 1 40 LYS H H -4.867 -7.336 6.631 1.00 . A A . 44 LYS H 1 1 13 9347 1 1 40 LYS HA H -6.810 -5.770 8.262 1.00 . A A . 44 LYS HA 1 1 13 9348 1 1 40 LYS HB2 H -7.267 -7.973 6.965 1.00 . A A . 44 LYS HB2 1 1 13 9349 1 1 40 LYS HB3 H -6.369 -8.758 8.263 1.00 . A A . 44 LYS HB3 1 1 13 9350 1 1 40 LYS HD2 H -9.027 -6.855 7.169 1.00 . A A . 44 LYS HD2 1 1 13 9351 1 1 40 LYS HD3 H -10.085 -8.088 7.855 1.00 . A A . 44 LYS HD3 1 1 13 9352 1 1 40 LYS HE2 H -9.673 -6.161 9.904 1.00 . A A . 44 LYS HE2 1 1 13 9353 1 1 40 LYS HE3 H -10.046 -5.262 8.419 1.00 . A A . 44 LYS HE3 1 1 13 9354 1 1 40 LYS HG2 H -8.454 -8.856 9.219 1.00 . A A . 44 LYS HG2 1 1 13 9355 1 1 40 LYS HG3 H -8.027 -7.228 9.744 1.00 . A A . 44 LYS HG3 1 1 13 9356 1 1 40 LYS HZ1 H -12.119 -5.898 9.335 1.00 . A A . 44 LYS HZ1 1 1 13 9357 1 1 40 LYS HZ2 H -11.588 -7.482 9.654 1.00 . A A . 44 LYS HZ2 1 1 13 9358 1 1 40 LYS HZ3 H -11.843 -6.975 8.052 1.00 . A A . 44 LYS HZ3 1 1 13 9359 1 1 40 LYS N N -5.275 -6.527 7.006 1.00 . A A . 44 LYS N 1 1 13 9360 1 1 40 LYS NZ N -11.521 -6.679 8.995 1.00 . A A . 44 LYS NZ 1 1 13 9361 1 1 40 LYS O O -5.088 -5.708 10.108 1.00 . A A . 44 LYS O 1 1 13 9362 1 1 40 LYS OXT O -4.886 -7.829 9.796 1.00 . A A . 44 LYS OXT 1 1 13 9363 2 2 1 ACE C C 7.953 13.914 2.703 1.00 . B B . 45 ACE C 1 1 13 9364 2 2 1 ACE CH3 C 6.813 14.281 3.656 1.00 . B B . 45 ACE CH3 1 1 13 9365 2 2 1 ACE H1 H 7.000 13.842 4.625 1.00 . B B . 45 ACE H1 1 1 13 9366 2 2 1 ACE H2 H 5.881 13.905 3.264 1.00 . B B . 45 ACE H2 1 1 13 9367 2 2 1 ACE H3 H 6.757 15.354 3.753 1.00 . B B . 45 ACE H3 1 1 13 9368 2 2 1 ACE O O 8.553 14.775 2.092 1.00 . B B . 45 ACE O 1 1 13 9369 2 2 2 PRO C C 7.106 11.446 0.738 1.00 . B B . 46 PRO C 1 1 13 9370 2 2 2 PRO CA C 8.415 12.038 1.263 1.00 . B B . 46 PRO CA 1 1 13 9371 2 2 2 PRO CB C 9.449 10.941 1.503 1.00 . B B . 46 PRO CB 1 1 13 9372 2 2 2 PRO CD C 8.835 11.821 3.658 1.00 . B B . 46 PRO CD 1 1 13 9373 2 2 2 PRO CG C 9.297 10.581 2.941 1.00 . B B . 46 PRO CG 1 1 13 9374 2 2 2 PRO HA H 8.806 12.771 0.576 1.00 . B B . 46 PRO HA 1 1 13 9375 2 2 2 PRO HB2 H 9.240 10.087 0.873 1.00 . B B . 46 PRO HB2 1 1 13 9376 2 2 2 PRO HB3 H 10.444 11.312 1.317 1.00 . B B . 46 PRO HB3 1 1 13 9377 2 2 2 PRO HD2 H 8.116 11.568 4.426 1.00 . B B . 46 PRO HD2 1 1 13 9378 2 2 2 PRO HD3 H 9.676 12.347 4.083 1.00 . B B . 46 PRO HD3 1 1 13 9379 2 2 2 PRO HG2 H 8.562 9.794 3.049 1.00 . B B . 46 PRO HG2 1 1 13 9380 2 2 2 PRO HG3 H 10.244 10.259 3.345 1.00 . B B . 46 PRO HG3 1 1 13 9381 2 2 2 PRO N N 8.209 12.638 2.608 1.00 . B B . 46 PRO N 1 1 13 9382 2 2 2 PRO O O 6.917 11.291 -0.454 1.00 . B B . 46 PRO O 1 1 13 9383 2 2 3 LEU C C 4.264 11.416 0.085 1.00 . B B . 47 LEU C 1 1 13 9384 2 2 3 LEU CA C 4.901 10.529 1.170 1.00 . B B . 47 LEU CA 1 1 13 9385 2 2 3 LEU CB C 4.032 10.507 2.426 1.00 . B B . 47 LEU CB 1 1 13 9386 2 2 3 LEU CD1 C 2.405 8.678 2.922 1.00 . B B . 47 LEU CD1 1 1 13 9387 2 2 3 LEU CD2 C 1.579 10.979 2.401 1.00 . B B . 47 LEU CD2 1 1 13 9388 2 2 3 LEU CG C 2.653 9.936 2.088 1.00 . B B . 47 LEU CG 1 1 13 9389 2 2 3 LEU H H 6.373 11.245 2.572 1.00 . B B . 47 LEU H 1 1 13 9390 2 2 3 LEU HA H 5.045 9.525 0.808 1.00 . B B . 47 LEU HA 1 1 13 9391 2 2 3 LEU HB2 H 4.502 9.889 3.177 1.00 . B B . 47 LEU HB2 1 1 13 9392 2 2 3 LEU HB3 H 3.922 11.512 2.805 1.00 . B B . 47 LEU HB3 1 1 13 9393 2 2 3 LEU HD11 H 2.958 7.852 2.503 1.00 . B B . 47 LEU HD11 1 1 13 9394 2 2 3 LEU HD12 H 1.350 8.446 2.915 1.00 . B B . 47 LEU HD12 1 1 13 9395 2 2 3 LEU HD13 H 2.728 8.851 3.938 1.00 . B B . 47 LEU HD13 1 1 13 9396 2 2 3 LEU HD21 H 1.064 10.702 3.309 1.00 . B B . 47 LEU HD21 1 1 13 9397 2 2 3 LEU HD22 H 0.872 11.023 1.586 1.00 . B B . 47 LEU HD22 1 1 13 9398 2 2 3 LEU HD23 H 2.042 11.946 2.531 1.00 . B B . 47 LEU HD23 1 1 13 9399 2 2 3 LEU HG H 2.616 9.686 1.037 1.00 . B B . 47 LEU HG 1 1 13 9400 2 2 3 LEU N N 6.200 11.112 1.617 1.00 . B B . 47 LEU N 1 1 13 9401 2 2 3 LEU O O 4.047 12.591 0.306 1.00 . B B . 47 LEU O 1 1 13 9402 2 2 4 PRO C C 1.916 11.943 -1.859 1.00 . B B . 48 PRO C 1 1 13 9403 2 2 4 PRO CA C 3.381 11.603 -2.175 1.00 . B B . 48 PRO CA 1 1 13 9404 2 2 4 PRO CB C 3.474 10.650 -3.365 1.00 . B B . 48 PRO CB 1 1 13 9405 2 2 4 PRO CD C 4.214 9.424 -1.427 1.00 . B B . 48 PRO CD 1 1 13 9406 2 2 4 PRO CG C 3.530 9.284 -2.761 1.00 . B B . 48 PRO CG 1 1 13 9407 2 2 4 PRO HA H 3.951 12.495 -2.372 1.00 . B B . 48 PRO HA 1 1 13 9408 2 2 4 PRO HB2 H 2.599 10.746 -3.992 1.00 . B B . 48 PRO HB2 1 1 13 9409 2 2 4 PRO HB3 H 4.370 10.846 -3.935 1.00 . B B . 48 PRO HB3 1 1 13 9410 2 2 4 PRO HD2 H 3.761 8.767 -0.698 1.00 . B B . 48 PRO HD2 1 1 13 9411 2 2 4 PRO HD3 H 5.270 9.219 -1.519 1.00 . B B . 48 PRO HD3 1 1 13 9412 2 2 4 PRO HG2 H 2.530 8.899 -2.625 1.00 . B B . 48 PRO HG2 1 1 13 9413 2 2 4 PRO HG3 H 4.096 8.621 -3.398 1.00 . B B . 48 PRO HG3 1 1 13 9414 2 2 4 PRO N N 3.990 10.831 -1.060 1.00 . B B . 48 PRO N 1 1 13 9415 2 2 4 PRO O O 1.192 11.116 -1.344 1.00 . B B . 48 PRO O 1 1 13 9416 2 2 5 PRO C C -0.828 12.940 -2.933 1.00 . B B . 49 PRO C 1 1 13 9417 2 2 5 PRO CA C 0.127 13.584 -1.921 1.00 . B B . 49 PRO CA 1 1 13 9418 2 2 5 PRO CB C 0.174 15.097 -2.110 1.00 . B B . 49 PRO CB 1 1 13 9419 2 2 5 PRO CD C 2.321 14.222 -2.801 1.00 . B B . 49 PRO CD 1 1 13 9420 2 2 5 PRO CG C 1.334 15.338 -3.025 1.00 . B B . 49 PRO CG 1 1 13 9421 2 2 5 PRO HA H -0.166 13.346 -0.911 1.00 . B B . 49 PRO HA 1 1 13 9422 2 2 5 PRO HB2 H -0.741 15.446 -2.566 1.00 . B B . 49 PRO HB2 1 1 13 9423 2 2 5 PRO HB3 H 0.333 15.588 -1.164 1.00 . B B . 49 PRO HB3 1 1 13 9424 2 2 5 PRO HD2 H 2.732 13.886 -3.742 1.00 . B B . 49 PRO HD2 1 1 13 9425 2 2 5 PRO HD3 H 3.109 14.540 -2.135 1.00 . B B . 49 PRO HD3 1 1 13 9426 2 2 5 PRO HG2 H 1.000 15.333 -4.052 1.00 . B B . 49 PRO HG2 1 1 13 9427 2 2 5 PRO HG3 H 1.793 16.288 -2.793 1.00 . B B . 49 PRO HG3 1 1 13 9428 2 2 5 PRO N N 1.522 13.153 -2.181 1.00 . B B . 49 PRO N 1 1 13 9429 2 2 5 PRO O O -0.414 12.446 -3.962 1.00 . B B . 49 PRO O 1 1 13 9430 2 2 6 TYR C C -4.459 12.976 -3.409 1.00 . B B . 50 TYR C 1 1 13 9431 2 2 6 TYR CA C -3.080 12.338 -3.595 1.00 . B B . 50 TYR CA 1 1 13 9432 2 2 6 TYR CB C -3.122 10.855 -3.230 1.00 . B B . 50 TYR CB 1 1 13 9433 2 2 6 TYR CD1 C -3.329 10.186 -5.650 1.00 . B B . 50 TYR CD1 1 1 13 9434 2 2 6 TYR CD2 C -4.901 9.270 -4.052 1.00 . B B . 50 TYR CD2 1 1 13 9435 2 2 6 TYR CE1 C -3.957 9.474 -6.679 1.00 . B B . 50 TYR CE1 1 1 13 9436 2 2 6 TYR CE2 C -5.533 8.558 -5.079 1.00 . B B . 50 TYR CE2 1 1 13 9437 2 2 6 TYR CG C -3.801 10.083 -4.337 1.00 . B B . 50 TYR CG 1 1 13 9438 2 2 6 TYR CZ C -5.059 8.659 -6.393 1.00 . B B . 50 TYR CZ 1 1 13 9439 2 2 6 TYR H H -2.415 13.353 -1.813 1.00 . B B . 50 TYR H 1 1 13 9440 2 2 6 TYR HA H -2.744 12.458 -4.613 1.00 . B B . 50 TYR HA 1 1 13 9441 2 2 6 TYR HB2 H -2.115 10.487 -3.099 1.00 . B B . 50 TYR HB2 1 1 13 9442 2 2 6 TYR HB3 H -3.676 10.724 -2.311 1.00 . B B . 50 TYR HB3 1 1 13 9443 2 2 6 TYR HD1 H -2.476 10.811 -5.870 1.00 . B B . 50 TYR HD1 1 1 13 9444 2 2 6 TYR HD2 H -5.264 9.189 -3.040 1.00 . B B . 50 TYR HD2 1 1 13 9445 2 2 6 TYR HE1 H -3.592 9.553 -7.692 1.00 . B B . 50 TYR HE1 1 1 13 9446 2 2 6 TYR HE2 H -6.382 7.929 -4.858 1.00 . B B . 50 TYR HE2 1 1 13 9447 2 2 6 TYR HH H -5.856 7.070 -7.088 1.00 . B B . 50 TYR HH 1 1 13 9448 2 2 6 TYR N N -2.102 12.947 -2.648 1.00 . B B . 50 TYR N 1 1 13 9449 2 2 6 TYR O O -4.647 14.084 -3.883 1.00 . B B . 50 TYR O 1 1 13 9450 2 2 6 TYR OXT O -5.305 12.345 -2.797 1.00 . B B . 50 TYR OXT 1 1 13 9451 2 2 6 TYR OH O -5.680 7.959 -7.406 1.00 . B B . 50 TYR OH 1 1 14 9452 1 1 1 PHE C C 3.368 -19.789 9.844 1.00 . A A . 5 PHE C 1 1 14 9453 1 1 1 PHE CA C 3.106 -21.103 10.585 1.00 . A A . 5 PHE CA 1 1 14 9454 1 1 1 PHE CB C 2.302 -22.064 9.709 1.00 . A A . 5 PHE CB 1 1 14 9455 1 1 1 PHE CD1 C 4.058 -23.469 8.569 1.00 . A A . 5 PHE CD1 1 1 14 9456 1 1 1 PHE CD2 C 2.776 -24.446 10.382 1.00 . A A . 5 PHE CD2 1 1 14 9457 1 1 1 PHE CE1 C 4.763 -24.669 8.421 1.00 . A A . 5 PHE CE1 1 1 14 9458 1 1 1 PHE CE2 C 3.482 -25.646 10.234 1.00 . A A . 5 PHE CE2 1 1 14 9459 1 1 1 PHE CG C 3.064 -23.358 9.550 1.00 . A A . 5 PHE CG 1 1 14 9460 1 1 1 PHE CZ C 4.475 -25.757 9.253 1.00 . A A . 5 PHE CZ 1 1 14 9461 1 1 1 PHE HA H 4.037 -21.562 10.879 1.00 . A A . 5 PHE HA 1 1 14 9462 1 1 1 PHE HB2 H 1.348 -22.262 10.176 1.00 . A A . 5 PHE HB2 1 1 14 9463 1 1 1 PHE HB3 H 2.144 -21.618 8.738 1.00 . A A . 5 PHE HB3 1 1 14 9464 1 1 1 PHE HD1 H 4.279 -22.630 7.927 1.00 . A A . 5 PHE HD1 1 1 14 9465 1 1 1 PHE HD2 H 2.011 -24.360 11.138 1.00 . A A . 5 PHE HD2 1 1 14 9466 1 1 1 PHE HE1 H 5.529 -24.755 7.665 1.00 . A A . 5 PHE HE1 1 1 14 9467 1 1 1 PHE HE2 H 3.260 -26.486 10.875 1.00 . A A . 5 PHE HE2 1 1 14 9468 1 1 1 PHE HZ H 5.020 -26.683 9.139 1.00 . A A . 5 PHE HZ 1 1 14 9469 1 1 1 PHE N N 2.248 -20.858 11.780 1.00 . A A . 5 PHE N 1 1 14 9470 1 1 1 PHE O O 2.780 -19.520 8.814 1.00 . A A . 5 PHE O 1 1 14 9471 1 1 2 GLU C C 3.247 -16.896 9.435 1.00 . A A . 6 GLU C 1 1 14 9472 1 1 2 GLU CA C 4.542 -17.675 9.681 1.00 . A A . 6 GLU CA 1 1 14 9473 1 1 2 GLU CB C 5.197 -18.062 8.355 1.00 . A A . 6 GLU CB 1 1 14 9474 1 1 2 GLU CD C 7.497 -18.121 7.378 1.00 . A A . 6 GLU CD 1 1 14 9475 1 1 2 GLU CG C 6.503 -17.282 8.185 1.00 . A A . 6 GLU CG 1 1 14 9476 1 1 2 GLU H H 4.708 -19.207 11.189 1.00 . A A . 6 GLU H 1 1 14 9477 1 1 2 GLU HA H 5.228 -17.089 10.274 1.00 . A A . 6 GLU HA 1 1 14 9478 1 1 2 GLU HB2 H 5.408 -19.120 8.353 1.00 . A A . 6 GLU HB2 1 1 14 9479 1 1 2 GLU HB3 H 4.528 -17.825 7.540 1.00 . A A . 6 GLU HB3 1 1 14 9480 1 1 2 GLU HG2 H 6.305 -16.358 7.661 1.00 . A A . 6 GLU HG2 1 1 14 9481 1 1 2 GLU HG3 H 6.921 -17.064 9.157 1.00 . A A . 6 GLU HG3 1 1 14 9482 1 1 2 GLU N N 4.245 -18.971 10.358 1.00 . A A . 6 GLU N 1 1 14 9483 1 1 2 GLU O O 2.166 -17.358 9.741 1.00 . A A . 6 GLU O 1 1 14 9484 1 1 2 GLU OE1 O 7.053 -18.876 6.529 1.00 . A A . 6 GLU OE1 1 1 14 9485 1 1 2 GLU OE2 O 8.684 -17.995 7.624 1.00 . A A . 6 GLU OE2 1 1 14 9486 1 1 3 ILE C C 1.355 -15.492 7.421 1.00 . A A . 7 ILE C 1 1 14 9487 1 1 3 ILE CA C 2.123 -14.912 8.615 1.00 . A A . 7 ILE CA 1 1 14 9488 1 1 3 ILE CB C 2.634 -13.508 8.293 1.00 . A A . 7 ILE CB 1 1 14 9489 1 1 3 ILE CD1 C 2.996 -12.755 5.939 1.00 . A A . 7 ILE CD1 1 1 14 9490 1 1 3 ILE CG1 C 3.580 -13.574 7.092 1.00 . A A . 7 ILE CG1 1 1 14 9491 1 1 3 ILE CG2 C 3.387 -12.949 9.502 1.00 . A A . 7 ILE CG2 1 1 14 9492 1 1 3 ILE H H 4.231 -15.364 8.642 1.00 . A A . 7 ILE H 1 1 14 9493 1 1 3 ILE HA H 1.493 -14.884 9.491 1.00 . A A . 7 ILE HA 1 1 14 9494 1 1 3 ILE HB H 1.797 -12.865 8.062 1.00 . A A . 7 ILE HB 1 1 14 9495 1 1 3 ILE HD11 H 2.586 -13.422 5.194 1.00 . A A . 7 ILE HD11 1 1 14 9496 1 1 3 ILE HD12 H 3.775 -12.154 5.493 1.00 . A A . 7 ILE HD12 1 1 14 9497 1 1 3 ILE HD13 H 2.215 -12.111 6.314 1.00 . A A . 7 ILE HD13 1 1 14 9498 1 1 3 ILE HG12 H 4.543 -13.171 7.368 1.00 . A A . 7 ILE HG12 1 1 14 9499 1 1 3 ILE HG13 H 3.695 -14.601 6.781 1.00 . A A . 7 ILE HG13 1 1 14 9500 1 1 3 ILE HG21 H 4.212 -13.601 9.745 1.00 . A A . 7 ILE HG21 1 1 14 9501 1 1 3 ILE HG22 H 2.716 -12.888 10.347 1.00 . A A . 7 ILE HG22 1 1 14 9502 1 1 3 ILE HG23 H 3.762 -11.964 9.268 1.00 . A A . 7 ILE HG23 1 1 14 9503 1 1 3 ILE N N 3.348 -15.719 8.882 1.00 . A A . 7 ILE N 1 1 14 9504 1 1 3 ILE O O 1.927 -16.177 6.595 1.00 . A A . 7 ILE O 1 1 14 9505 1 1 4 PRO C C -0.434 -14.970 4.952 1.00 . A A . 8 PRO C 1 1 14 9506 1 1 4 PRO CA C -0.764 -15.710 6.253 1.00 . A A . 8 PRO CA 1 1 14 9507 1 1 4 PRO CB C -2.187 -15.401 6.707 1.00 . A A . 8 PRO CB 1 1 14 9508 1 1 4 PRO CD C -0.697 -14.387 8.313 1.00 . A A . 8 PRO CD 1 1 14 9509 1 1 4 PRO CG C -2.050 -14.257 7.661 1.00 . A A . 8 PRO CG 1 1 14 9510 1 1 4 PRO HA H -0.636 -16.773 6.131 1.00 . A A . 8 PRO HA 1 1 14 9511 1 1 4 PRO HB2 H -2.797 -15.115 5.863 1.00 . A A . 8 PRO HB2 1 1 14 9512 1 1 4 PRO HB3 H -2.615 -16.258 7.208 1.00 . A A . 8 PRO HB3 1 1 14 9513 1 1 4 PRO HD2 H -0.242 -13.416 8.438 1.00 . A A . 8 PRO HD2 1 1 14 9514 1 1 4 PRO HD3 H -0.784 -14.891 9.264 1.00 . A A . 8 PRO HD3 1 1 14 9515 1 1 4 PRO HG2 H -2.111 -13.322 7.123 1.00 . A A . 8 PRO HG2 1 1 14 9516 1 1 4 PRO HG3 H -2.827 -14.304 8.408 1.00 . A A . 8 PRO HG3 1 1 14 9517 1 1 4 PRO N N 0.077 -15.202 7.364 1.00 . A A . 8 PRO N 1 1 14 9518 1 1 4 PRO O O 0.481 -14.173 4.897 1.00 . A A . 8 PRO O 1 1 14 9519 1 1 5 ASP C C -2.189 -14.415 1.798 1.00 . A A . 9 ASP C 1 1 14 9520 1 1 5 ASP CA C -0.900 -14.539 2.614 1.00 . A A . 9 ASP CA 1 1 14 9521 1 1 5 ASP CB C 0.108 -15.435 1.893 1.00 . A A . 9 ASP CB 1 1 14 9522 1 1 5 ASP CG C 0.464 -14.817 0.540 1.00 . A A . 9 ASP CG 1 1 14 9523 1 1 5 ASP H H -1.906 -15.875 3.974 1.00 . A A . 9 ASP H 1 1 14 9524 1 1 5 ASP HA H -0.469 -13.567 2.788 1.00 . A A . 9 ASP HA 1 1 14 9525 1 1 5 ASP HB2 H 1.000 -15.528 2.493 1.00 . A A . 9 ASP HB2 1 1 14 9526 1 1 5 ASP HB3 H -0.326 -16.412 1.739 1.00 . A A . 9 ASP HB3 1 1 14 9527 1 1 5 ASP N N -1.173 -15.228 3.908 1.00 . A A . 9 ASP N 1 1 14 9528 1 1 5 ASP O O -2.222 -14.714 0.621 1.00 . A A . 9 ASP O 1 1 14 9529 1 1 5 ASP OD1 O 0.277 -13.621 0.390 1.00 . A A . 9 ASP OD1 1 1 14 9530 1 1 5 ASP OD2 O 0.917 -15.549 -0.324 1.00 . A A . 9 ASP OD2 1 1 14 9531 1 1 6 ASP C C -4.429 -12.714 0.636 1.00 . A A . 10 ASP C 1 1 14 9532 1 1 6 ASP CA C -4.538 -13.834 1.674 1.00 . A A . 10 ASP CA 1 1 14 9533 1 1 6 ASP CB C -5.574 -13.478 2.741 1.00 . A A . 10 ASP CB 1 1 14 9534 1 1 6 ASP CG C -6.372 -14.729 3.113 1.00 . A A . 10 ASP CG 1 1 14 9535 1 1 6 ASP H H -3.206 -13.740 3.365 1.00 . A A . 10 ASP H 1 1 14 9536 1 1 6 ASP HA H -4.805 -14.764 1.198 1.00 . A A . 10 ASP HA 1 1 14 9537 1 1 6 ASP HB2 H -5.070 -13.098 3.617 1.00 . A A . 10 ASP HB2 1 1 14 9538 1 1 6 ASP HB3 H -6.243 -12.724 2.356 1.00 . A A . 10 ASP HB3 1 1 14 9539 1 1 6 ASP N N -3.252 -13.976 2.415 1.00 . A A . 10 ASP N 1 1 14 9540 1 1 6 ASP O O -4.226 -12.958 -0.537 1.00 . A A . 10 ASP O 1 1 14 9541 1 1 6 ASP OD1 O -5.771 -15.786 3.208 1.00 . A A . 10 ASP OD1 1 1 14 9542 1 1 6 ASP OD2 O -7.572 -14.608 3.298 1.00 . A A . 10 ASP OD2 1 1 14 9543 1 1 7 VAL C C -3.522 -9.271 0.643 1.00 . A A . 11 VAL C 1 1 14 9544 1 1 7 VAL CA C -4.465 -10.352 0.095 1.00 . A A . 11 VAL CA 1 1 14 9545 1 1 7 VAL CB C -5.889 -9.810 -0.023 1.00 . A A . 11 VAL CB 1 1 14 9546 1 1 7 VAL CG1 C -6.384 -9.371 1.357 1.00 . A A . 11 VAL CG1 1 1 14 9547 1 1 7 VAL CG2 C -5.903 -8.613 -0.975 1.00 . A A . 11 VAL CG2 1 1 14 9548 1 1 7 VAL H H -4.726 -11.309 2.008 1.00 . A A . 11 VAL H 1 1 14 9549 1 1 7 VAL HA H -4.122 -10.702 -0.865 1.00 . A A . 11 VAL HA 1 1 14 9550 1 1 7 VAL HB H -6.537 -10.583 -0.408 1.00 . A A . 11 VAL HB 1 1 14 9551 1 1 7 VAL HG11 H -6.617 -8.316 1.336 1.00 . A A . 11 VAL HG11 1 1 14 9552 1 1 7 VAL HG12 H -5.613 -9.555 2.091 1.00 . A A . 11 VAL HG12 1 1 14 9553 1 1 7 VAL HG13 H -7.270 -9.930 1.618 1.00 . A A . 11 VAL HG13 1 1 14 9554 1 1 7 VAL HG21 H -6.880 -8.152 -0.961 1.00 . A A . 11 VAL HG21 1 1 14 9555 1 1 7 VAL HG22 H -5.678 -8.949 -1.978 1.00 . A A . 11 VAL HG22 1 1 14 9556 1 1 7 VAL HG23 H -5.161 -7.895 -0.661 1.00 . A A . 11 VAL HG23 1 1 14 9557 1 1 7 VAL N N -4.562 -11.486 1.059 1.00 . A A . 11 VAL N 1 1 14 9558 1 1 7 VAL O O -3.490 -9.028 1.832 1.00 . A A . 11 VAL O 1 1 14 9559 1 1 8 PRO C C -2.593 -6.317 0.559 1.00 . A A . 12 PRO C 1 1 14 9560 1 1 8 PRO CA C -1.833 -7.590 0.171 1.00 . A A . 12 PRO CA 1 1 14 9561 1 1 8 PRO CB C -0.981 -7.358 -1.074 1.00 . A A . 12 PRO CB 1 1 14 9562 1 1 8 PRO CD C -2.749 -8.878 -1.700 1.00 . A A . 12 PRO CD 1 1 14 9563 1 1 8 PRO CG C -1.840 -7.794 -2.218 1.00 . A A . 12 PRO CG 1 1 14 9564 1 1 8 PRO HA H -1.212 -7.929 0.985 1.00 . A A . 12 PRO HA 1 1 14 9565 1 1 8 PRO HB2 H -0.733 -6.312 -1.169 1.00 . A A . 12 PRO HB2 1 1 14 9566 1 1 8 PRO HB3 H -0.082 -7.955 -1.031 1.00 . A A . 12 PRO HB3 1 1 14 9567 1 1 8 PRO HD2 H -3.740 -8.775 -2.120 1.00 . A A . 12 PRO HD2 1 1 14 9568 1 1 8 PRO HD3 H -2.343 -9.853 -1.923 1.00 . A A . 12 PRO HD3 1 1 14 9569 1 1 8 PRO HG2 H -2.428 -6.962 -2.577 1.00 . A A . 12 PRO HG2 1 1 14 9570 1 1 8 PRO HG3 H -1.223 -8.181 -3.015 1.00 . A A . 12 PRO HG3 1 1 14 9571 1 1 8 PRO N N -2.780 -8.653 -0.246 1.00 . A A . 12 PRO N 1 1 14 9572 1 1 8 PRO O O -2.276 -5.667 1.535 1.00 . A A . 12 PRO O 1 1 14 9573 1 1 9 LEU C C -5.858 -4.948 -0.216 1.00 . A A . 13 LEU C 1 1 14 9574 1 1 9 LEU CA C -4.376 -4.733 0.129 1.00 . A A . 13 LEU CA 1 1 14 9575 1 1 9 LEU CB C -3.769 -3.634 -0.744 1.00 . A A . 13 LEU CB 1 1 14 9576 1 1 9 LEU CD1 C -1.290 -3.977 -0.772 1.00 . A A . 13 LEU CD1 1 1 14 9577 1 1 9 LEU CD2 C -2.227 -1.691 -0.409 1.00 . A A . 13 LEU CD2 1 1 14 9578 1 1 9 LEU CG C -2.435 -3.184 -0.139 1.00 . A A . 13 LEU CG 1 1 14 9579 1 1 9 LEU H H -3.834 -6.502 -0.979 1.00 . A A . 13 LEU H 1 1 14 9580 1 1 9 LEU HA H -4.265 -4.482 1.172 1.00 . A A . 13 LEU HA 1 1 14 9581 1 1 9 LEU HB2 H -3.601 -4.016 -1.741 1.00 . A A . 13 LEU HB2 1 1 14 9582 1 1 9 LEU HB3 H -4.445 -2.794 -0.790 1.00 . A A . 13 LEU HB3 1 1 14 9583 1 1 9 LEU HD11 H -0.590 -3.295 -1.231 1.00 . A A . 13 LEU HD11 1 1 14 9584 1 1 9 LEU HD12 H -1.685 -4.645 -1.523 1.00 . A A . 13 LEU HD12 1 1 14 9585 1 1 9 LEU HD13 H -0.786 -4.553 -0.009 1.00 . A A . 13 LEU HD13 1 1 14 9586 1 1 9 LEU HD21 H -2.886 -1.116 0.225 1.00 . A A . 13 LEU HD21 1 1 14 9587 1 1 9 LEU HD22 H -2.449 -1.480 -1.445 1.00 . A A . 13 LEU HD22 1 1 14 9588 1 1 9 LEU HD23 H -1.203 -1.427 -0.199 1.00 . A A . 13 LEU HD23 1 1 14 9589 1 1 9 LEU HG H -2.447 -3.358 0.927 1.00 . A A . 13 LEU HG 1 1 14 9590 1 1 9 LEU N N -3.594 -5.961 -0.196 1.00 . A A . 13 LEU N 1 1 14 9591 1 1 9 LEU O O -6.177 -5.716 -1.102 1.00 . A A . 13 LEU O 1 1 14 9592 1 1 10 PRO C C -8.582 -3.722 -1.055 1.00 . A A . 14 PRO C 1 1 14 9593 1 1 10 PRO CA C -8.179 -4.404 0.257 1.00 . A A . 14 PRO CA 1 1 14 9594 1 1 10 PRO CB C -8.814 -3.711 1.459 1.00 . A A . 14 PRO CB 1 1 14 9595 1 1 10 PRO CD C -6.432 -3.317 1.586 1.00 . A A . 14 PRO CD 1 1 14 9596 1 1 10 PRO CG C -7.780 -2.744 1.943 1.00 . A A . 14 PRO CG 1 1 14 9597 1 1 10 PRO HA H -8.462 -5.443 0.243 1.00 . A A . 14 PRO HA 1 1 14 9598 1 1 10 PRO HB2 H -9.708 -3.185 1.159 1.00 . A A . 14 PRO HB2 1 1 14 9599 1 1 10 PRO HB3 H -9.042 -4.432 2.230 1.00 . A A . 14 PRO HB3 1 1 14 9600 1 1 10 PRO HD2 H -5.768 -2.537 1.240 1.00 . A A . 14 PRO HD2 1 1 14 9601 1 1 10 PRO HD3 H -6.002 -3.831 2.432 1.00 . A A . 14 PRO HD3 1 1 14 9602 1 1 10 PRO HG2 H -7.915 -1.791 1.460 1.00 . A A . 14 PRO HG2 1 1 14 9603 1 1 10 PRO HG3 H -7.858 -2.630 3.014 1.00 . A A . 14 PRO HG3 1 1 14 9604 1 1 10 PRO N N -6.722 -4.266 0.500 1.00 . A A . 14 PRO N 1 1 14 9605 1 1 10 PRO O O -7.748 -3.359 -1.860 1.00 . A A . 14 PRO O 1 1 14 9606 1 1 11 ALA C C -10.035 -1.406 -2.515 1.00 . A A . 15 ALA C 1 1 14 9607 1 1 11 ALA CA C -10.321 -2.911 -2.543 1.00 . A A . 15 ALA CA 1 1 14 9608 1 1 11 ALA CB C -11.826 -3.170 -2.590 1.00 . A A . 15 ALA CB 1 1 14 9609 1 1 11 ALA H H -10.515 -3.867 -0.620 1.00 . A A . 15 ALA H 1 1 14 9610 1 1 11 ALA HA H -9.844 -3.368 -3.395 1.00 . A A . 15 ALA HA 1 1 14 9611 1 1 11 ALA HB1 H -12.311 -2.623 -1.795 1.00 . A A . 15 ALA HB1 1 1 14 9612 1 1 11 ALA HB2 H -12.014 -4.226 -2.468 1.00 . A A . 15 ALA HB2 1 1 14 9613 1 1 11 ALA HB3 H -12.218 -2.842 -3.542 1.00 . A A . 15 ALA HB3 1 1 14 9614 1 1 11 ALA N N -9.858 -3.558 -1.280 1.00 . A A . 15 ALA N 1 1 14 9615 1 1 11 ALA O O -9.673 -0.851 -1.498 1.00 . A A . 15 ALA O 1 1 14 9616 1 1 12 GLY C C -8.448 0.996 -3.445 1.00 . A A . 16 GLY C 1 1 14 9617 1 1 12 GLY CA C -9.940 0.722 -3.673 1.00 . A A . 16 GLY CA 1 1 14 9618 1 1 12 GLY H H -10.493 -1.215 -4.437 1.00 . A A . 16 GLY H 1 1 14 9619 1 1 12 GLY HA2 H -10.231 1.108 -4.639 1.00 . A A . 16 GLY HA2 1 1 14 9620 1 1 12 GLY HA3 H -10.516 1.211 -2.903 1.00 . A A . 16 GLY HA3 1 1 14 9621 1 1 12 GLY N N -10.199 -0.746 -3.629 1.00 . A A . 16 GLY N 1 1 14 9622 1 1 12 GLY O O -8.051 2.114 -3.186 1.00 . A A . 16 GLY O 1 1 14 9623 1 1 13 TRP C C -5.372 -0.072 -4.589 1.00 . A A . 17 TRP C 1 1 14 9624 1 1 13 TRP CA C -6.163 0.205 -3.309 1.00 . A A . 17 TRP CA 1 1 14 9625 1 1 13 TRP CB C -5.788 -0.803 -2.230 1.00 . A A . 17 TRP CB 1 1 14 9626 1 1 13 TRP CD1 C -6.944 -0.192 -0.077 1.00 . A A . 17 TRP CD1 1 1 14 9627 1 1 13 TRP CD2 C -4.876 0.668 -0.234 1.00 . A A . 17 TRP CD2 1 1 14 9628 1 1 13 TRP CE2 C -5.392 1.091 1.013 1.00 . A A . 17 TRP CE2 1 1 14 9629 1 1 13 TRP CE3 C -3.580 1.072 -0.589 1.00 . A A . 17 TRP CE3 1 1 14 9630 1 1 13 TRP CG C -5.876 -0.143 -0.900 1.00 . A A . 17 TRP CG 1 1 14 9631 1 1 13 TRP CH2 C -3.350 2.281 1.504 1.00 . A A . 17 TRP CH2 1 1 14 9632 1 1 13 TRP CZ2 C -4.641 1.889 1.879 1.00 . A A . 17 TRP CZ2 1 1 14 9633 1 1 13 TRP CZ3 C -2.825 1.873 0.275 1.00 . A A . 17 TRP CZ3 1 1 14 9634 1 1 13 TRP H H -7.954 -0.908 -3.731 1.00 . A A . 17 TRP H 1 1 14 9635 1 1 13 TRP HA H -5.975 1.206 -2.957 1.00 . A A . 17 TRP HA 1 1 14 9636 1 1 13 TRP HB2 H -6.469 -1.639 -2.265 1.00 . A A . 17 TRP HB2 1 1 14 9637 1 1 13 TRP HB3 H -4.779 -1.153 -2.395 1.00 . A A . 17 TRP HB3 1 1 14 9638 1 1 13 TRP HD1 H -7.867 -0.718 -0.277 1.00 . A A . 17 TRP HD1 1 1 14 9639 1 1 13 TRP HE1 H -7.271 0.668 1.822 1.00 . A A . 17 TRP HE1 1 1 14 9640 1 1 13 TRP HE3 H -3.164 0.763 -1.537 1.00 . A A . 17 TRP HE3 1 1 14 9641 1 1 13 TRP HH2 H -2.753 2.897 2.160 1.00 . A A . 17 TRP HH2 1 1 14 9642 1 1 13 TRP HZ2 H -5.052 2.202 2.828 1.00 . A A . 17 TRP HZ2 1 1 14 9643 1 1 13 TRP HZ3 H -1.837 2.178 -0.010 1.00 . A A . 17 TRP HZ3 1 1 14 9644 1 1 13 TRP N N -7.620 -0.011 -3.530 1.00 . A A . 17 TRP N 1 1 14 9645 1 1 13 TRP NE1 N -6.661 0.542 1.065 1.00 . A A . 17 TRP NE1 1 1 14 9646 1 1 13 TRP O O -5.693 -0.968 -5.343 1.00 . A A . 17 TRP O 1 1 14 9647 1 1 14 GLU C C -2.040 0.400 -5.767 1.00 . A A . 18 GLU C 1 1 14 9648 1 1 14 GLU CA C -3.538 0.447 -6.077 1.00 . A A . 18 GLU CA 1 1 14 9649 1 1 14 GLU CB C -3.833 1.636 -6.991 1.00 . A A . 18 GLU CB 1 1 14 9650 1 1 14 GLU CD C -6.220 1.155 -7.547 1.00 . A A . 18 GLU CD 1 1 14 9651 1 1 14 GLU CG C -4.794 1.205 -8.098 1.00 . A A . 18 GLU CG 1 1 14 9652 1 1 14 GLU H H -4.090 1.408 -4.221 1.00 . A A . 18 GLU H 1 1 14 9653 1 1 14 GLU HA H -3.850 -0.466 -6.556 1.00 . A A . 18 GLU HA 1 1 14 9654 1 1 14 GLU HB2 H -4.274 2.433 -6.415 1.00 . A A . 18 GLU HB2 1 1 14 9655 1 1 14 GLU HB3 H -2.911 1.984 -7.433 1.00 . A A . 18 GLU HB3 1 1 14 9656 1 1 14 GLU HG2 H -4.745 1.915 -8.912 1.00 . A A . 18 GLU HG2 1 1 14 9657 1 1 14 GLU HG3 H -4.511 0.226 -8.458 1.00 . A A . 18 GLU HG3 1 1 14 9658 1 1 14 GLU N N -4.338 0.686 -4.842 1.00 . A A . 18 GLU N 1 1 14 9659 1 1 14 GLU O O -1.373 1.422 -5.759 1.00 . A A . 18 GLU O 1 1 14 9660 1 1 14 GLU OE1 O -6.521 1.942 -6.665 1.00 . A A . 18 GLU OE1 1 1 14 9661 1 1 14 GLU OE2 O -6.988 0.331 -8.017 1.00 . A A . 18 GLU OE2 1 1 14 9662 1 1 15 MET C C 0.704 -0.497 -6.571 1.00 . A A . 19 MET C 1 1 14 9663 1 1 15 MET CA C -0.033 -0.835 -5.282 1.00 . A A . 19 MET CA 1 1 14 9664 1 1 15 MET CB C 0.287 -2.267 -4.859 1.00 . A A . 19 MET CB 1 1 14 9665 1 1 15 MET CE C -2.054 -3.984 -4.044 1.00 . A A . 19 MET CE 1 1 14 9666 1 1 15 MET CG C -0.205 -3.266 -5.914 1.00 . A A . 19 MET CG 1 1 14 9667 1 1 15 MET H H -2.026 -1.581 -5.567 1.00 . A A . 19 MET H 1 1 14 9668 1 1 15 MET HA H 0.243 -0.145 -4.500 1.00 . A A . 19 MET HA 1 1 14 9669 1 1 15 MET HB2 H 1.351 -2.360 -4.763 1.00 . A A . 19 MET HB2 1 1 14 9670 1 1 15 MET HB3 H -0.169 -2.476 -3.906 1.00 . A A . 19 MET HB3 1 1 14 9671 1 1 15 MET HE1 H -2.796 -4.716 -3.762 1.00 . A A . 19 MET HE1 1 1 14 9672 1 1 15 MET HE2 H -2.529 -3.180 -4.582 1.00 . A A . 19 MET HE2 1 1 14 9673 1 1 15 MET HE3 H -1.576 -3.588 -3.158 1.00 . A A . 19 MET HE3 1 1 14 9674 1 1 15 MET HG2 H -0.999 -2.827 -6.495 1.00 . A A . 19 MET HG2 1 1 14 9675 1 1 15 MET HG3 H 0.614 -3.523 -6.569 1.00 . A A . 19 MET HG3 1 1 14 9676 1 1 15 MET N N -1.491 -0.766 -5.542 1.00 . A A . 19 MET N 1 1 14 9677 1 1 15 MET O O 0.520 -1.128 -7.593 1.00 . A A . 19 MET O 1 1 14 9678 1 1 15 MET SD S -0.808 -4.767 -5.098 1.00 . A A . 19 MET SD 1 1 14 9679 1 1 16 ALA C C 3.542 1.621 -7.270 1.00 . A A . 20 ALA C 1 1 14 9680 1 1 16 ALA CA C 2.280 0.898 -7.737 1.00 . A A . 20 ALA CA 1 1 14 9681 1 1 16 ALA CB C 1.314 1.808 -8.506 1.00 . A A . 20 ALA CB 1 1 14 9682 1 1 16 ALA H H 1.653 0.985 -5.687 1.00 . A A . 20 ALA H 1 1 14 9683 1 1 16 ALA HA H 2.535 0.032 -8.329 1.00 . A A . 20 ALA HA 1 1 14 9684 1 1 16 ALA HB1 H 0.484 2.072 -7.864 1.00 . A A . 20 ALA HB1 1 1 14 9685 1 1 16 ALA HB2 H 0.941 1.284 -9.374 1.00 . A A . 20 ALA HB2 1 1 14 9686 1 1 16 ALA HB3 H 1.822 2.704 -8.820 1.00 . A A . 20 ALA HB3 1 1 14 9687 1 1 16 ALA N N 1.525 0.494 -6.527 1.00 . A A . 20 ALA N 1 1 14 9688 1 1 16 ALA O O 4.041 1.325 -6.201 1.00 . A A . 20 ALA O 1 1 14 9689 1 1 17 LYS C C 5.220 4.730 -7.556 1.00 . A A . 21 LYS C 1 1 14 9690 1 1 17 LYS CA C 5.326 3.211 -7.527 1.00 . A A . 21 LYS CA 1 1 14 9691 1 1 17 LYS CB C 6.441 2.725 -8.452 1.00 . A A . 21 LYS CB 1 1 14 9692 1 1 17 LYS CD C 7.379 3.006 -10.750 1.00 . A A . 21 LYS CD 1 1 14 9693 1 1 17 LYS CE C 7.143 1.994 -11.873 1.00 . A A . 21 LYS CE 1 1 14 9694 1 1 17 LYS CG C 6.115 3.120 -9.894 1.00 . A A . 21 LYS CG 1 1 14 9695 1 1 17 LYS H H 3.701 2.782 -8.888 1.00 . A A . 21 LYS H 1 1 14 9696 1 1 17 LYS HA H 5.522 2.896 -6.521 1.00 . A A . 21 LYS HA 1 1 14 9697 1 1 17 LYS HB2 H 7.376 3.178 -8.157 1.00 . A A . 21 LYS HB2 1 1 14 9698 1 1 17 LYS HB3 H 6.524 1.651 -8.382 1.00 . A A . 21 LYS HB3 1 1 14 9699 1 1 17 LYS HD2 H 7.612 3.970 -11.177 1.00 . A A . 21 LYS HD2 1 1 14 9700 1 1 17 LYS HD3 H 8.202 2.676 -10.135 1.00 . A A . 21 LYS HD3 1 1 14 9701 1 1 17 LYS HE2 H 7.656 1.068 -11.659 1.00 . A A . 21 LYS HE2 1 1 14 9702 1 1 17 LYS HE3 H 6.086 1.819 -12.006 1.00 . A A . 21 LYS HE3 1 1 14 9703 1 1 17 LYS HG2 H 5.356 2.461 -10.284 1.00 . A A . 21 LYS HG2 1 1 14 9704 1 1 17 LYS HG3 H 5.757 4.139 -9.917 1.00 . A A . 21 LYS HG3 1 1 14 9705 1 1 17 LYS HZ1 H 7.073 3.372 -13.434 1.00 . A A . 21 LYS HZ1 1 1 14 9706 1 1 17 LYS HZ2 H 7.852 1.914 -13.831 1.00 . A A . 21 LYS HZ2 1 1 14 9707 1 1 17 LYS HZ3 H 8.637 3.062 -12.856 1.00 . A A . 21 LYS HZ3 1 1 14 9708 1 1 17 LYS N N 4.086 2.544 -8.020 1.00 . A A . 21 LYS N 1 1 14 9709 1 1 17 LYS NZ N 7.719 2.633 -13.090 1.00 . A A . 21 LYS NZ 1 1 14 9710 1 1 17 LYS O O 4.433 5.309 -8.280 1.00 . A A . 21 LYS O 1 1 14 9711 1 1 18 THR C C 7.421 7.416 -6.844 1.00 . A A . 22 THR C 1 1 14 9712 1 1 18 THR CA C 6.003 6.862 -6.689 1.00 . A A . 22 THR CA 1 1 14 9713 1 1 18 THR CB C 5.438 7.194 -5.302 1.00 . A A . 22 THR CB 1 1 14 9714 1 1 18 THR CG2 C 6.221 6.438 -4.220 1.00 . A A . 22 THR CG2 1 1 14 9715 1 1 18 THR H H 6.644 4.864 -6.174 1.00 . A A . 22 THR H 1 1 14 9716 1 1 18 THR HA H 5.356 7.261 -7.454 1.00 . A A . 22 THR HA 1 1 14 9717 1 1 18 THR HB H 4.405 6.901 -5.261 1.00 . A A . 22 THR HB 1 1 14 9718 1 1 18 THR HG1 H 5.449 8.745 -4.127 1.00 . A A . 22 THR HG1 1 1 14 9719 1 1 18 THR HG21 H 6.111 5.373 -4.370 1.00 . A A . 22 THR HG21 1 1 14 9720 1 1 18 THR HG22 H 5.837 6.703 -3.244 1.00 . A A . 22 THR HG22 1 1 14 9721 1 1 18 THR HG23 H 7.266 6.703 -4.280 1.00 . A A . 22 THR HG23 1 1 14 9722 1 1 18 THR N N 6.023 5.372 -6.750 1.00 . A A . 22 THR N 1 1 14 9723 1 1 18 THR O O 8.315 6.741 -7.316 1.00 . A A . 22 THR O 1 1 14 9724 1 1 18 THR OG1 O 5.537 8.593 -5.071 1.00 . A A . 22 THR OG1 1 1 14 9725 1 1 19 SER C C 10.011 8.413 -5.793 1.00 . A A . 23 SER C 1 1 14 9726 1 1 19 SER CA C 8.989 9.245 -6.573 1.00 . A A . 23 SER CA 1 1 14 9727 1 1 19 SER CB C 8.857 10.640 -5.965 1.00 . A A . 23 SER CB 1 1 14 9728 1 1 19 SER H H 6.892 9.163 -6.073 1.00 . A A . 23 SER H 1 1 14 9729 1 1 19 SER HA H 9.275 9.319 -7.610 1.00 . A A . 23 SER HA 1 1 14 9730 1 1 19 SER HB2 H 7.929 11.088 -6.288 1.00 . A A . 23 SER HB2 1 1 14 9731 1 1 19 SER HB3 H 8.866 10.567 -4.888 1.00 . A A . 23 SER HB3 1 1 14 9732 1 1 19 SER HG H 9.622 12.344 -6.506 1.00 . A A . 23 SER HG 1 1 14 9733 1 1 19 SER N N 7.631 8.640 -6.450 1.00 . A A . 23 SER N 1 1 14 9734 1 1 19 SER O O 9.674 7.424 -5.173 1.00 . A A . 23 SER O 1 1 14 9735 1 1 19 SER OG O 9.945 11.447 -6.393 1.00 . A A . 23 SER OG 1 1 14 9736 1 1 20 SER C C 12.679 6.750 -5.816 1.00 . A A . 24 SER C 1 1 14 9737 1 1 20 SER CA C 12.354 8.064 -5.105 1.00 . A A . 24 SER CA 1 1 14 9738 1 1 20 SER CB C 11.839 7.800 -3.683 1.00 . A A . 24 SER CB 1 1 14 9739 1 1 20 SER H H 11.494 9.600 -6.347 1.00 . A A . 24 SER H 1 1 14 9740 1 1 20 SER HA H 13.236 8.671 -5.059 1.00 . A A . 24 SER HA 1 1 14 9741 1 1 20 SER HB2 H 10.983 8.429 -3.487 1.00 . A A . 24 SER HB2 1 1 14 9742 1 1 20 SER HB3 H 11.551 6.763 -3.590 1.00 . A A . 24 SER HB3 1 1 14 9743 1 1 20 SER HG H 13.656 7.617 -3.015 1.00 . A A . 24 SER HG 1 1 14 9744 1 1 20 SER N N 11.263 8.809 -5.830 1.00 . A A . 24 SER N 1 1 14 9745 1 1 20 SER O O 13.812 6.478 -6.157 1.00 . A A . 24 SER O 1 1 14 9746 1 1 20 SER OG O 12.867 8.091 -2.747 1.00 . A A . 24 SER OG 1 1 14 9747 1 1 21 GLY C C 11.426 3.495 -5.849 1.00 . A A . 25 GLY C 1 1 14 9748 1 1 21 GLY CA C 11.935 4.638 -6.728 1.00 . A A . 25 GLY CA 1 1 14 9749 1 1 21 GLY H H 10.797 6.184 -5.755 1.00 . A A . 25 GLY H 1 1 14 9750 1 1 21 GLY HA2 H 11.410 4.628 -7.673 1.00 . A A . 25 GLY HA2 1 1 14 9751 1 1 21 GLY HA3 H 12.993 4.514 -6.904 1.00 . A A . 25 GLY HA3 1 1 14 9752 1 1 21 GLY N N 11.694 5.938 -6.040 1.00 . A A . 25 GLY N 1 1 14 9753 1 1 21 GLY O O 12.023 2.439 -5.780 1.00 . A A . 25 GLY O 1 1 14 9754 1 1 22 GLN C C 8.310 2.359 -4.638 1.00 . A A . 26 GLN C 1 1 14 9755 1 1 22 GLN CA C 9.780 2.620 -4.300 1.00 . A A . 26 GLN CA 1 1 14 9756 1 1 22 GLN CB C 9.915 3.160 -2.876 1.00 . A A . 26 GLN CB 1 1 14 9757 1 1 22 GLN CD C 11.768 2.235 -1.478 1.00 . A A . 26 GLN CD 1 1 14 9758 1 1 22 GLN CG C 11.398 3.293 -2.520 1.00 . A A . 26 GLN CG 1 1 14 9759 1 1 22 GLN H H 9.860 4.555 -5.244 1.00 . A A . 26 GLN H 1 1 14 9760 1 1 22 GLN HA H 10.358 1.715 -4.408 1.00 . A A . 26 GLN HA 1 1 14 9761 1 1 22 GLN HB2 H 9.443 4.129 -2.812 1.00 . A A . 26 GLN HB2 1 1 14 9762 1 1 22 GLN HB3 H 9.440 2.480 -2.186 1.00 . A A . 26 GLN HB3 1 1 14 9763 1 1 22 GLN HE21 H 13.088 1.333 -2.655 1.00 . A A . 26 GLN HE21 1 1 14 9764 1 1 22 GLN HE22 H 12.906 0.649 -1.112 1.00 . A A . 26 GLN HE22 1 1 14 9765 1 1 22 GLN HG2 H 11.995 3.147 -3.408 1.00 . A A . 26 GLN HG2 1 1 14 9766 1 1 22 GLN HG3 H 11.585 4.278 -2.118 1.00 . A A . 26 GLN HG3 1 1 14 9767 1 1 22 GLN N N 10.326 3.697 -5.175 1.00 . A A . 26 GLN N 1 1 14 9768 1 1 22 GLN NE2 N 12.662 1.330 -1.773 1.00 . A A . 26 GLN NE2 1 1 14 9769 1 1 22 GLN O O 7.626 3.210 -5.192 1.00 . A A . 26 GLN O 1 1 14 9770 1 1 22 GLN OE1 O 11.241 2.233 -0.384 1.00 . A A . 26 GLN OE1 1 1 14 9771 1 1 23 ARG C C 5.479 1.457 -3.543 1.00 . A A . 27 ARG C 1 1 14 9772 1 1 23 ARG CA C 6.388 0.892 -4.618 1.00 . A A . 27 ARG CA 1 1 14 9773 1 1 23 ARG CB C 6.248 -0.630 -4.645 1.00 . A A . 27 ARG CB 1 1 14 9774 1 1 23 ARG CD C 7.349 -1.309 -6.780 1.00 . A A . 27 ARG CD 1 1 14 9775 1 1 23 ARG CG C 6.005 -1.073 -6.086 1.00 . A A . 27 ARG CG 1 1 14 9776 1 1 23 ARG CZ C 6.735 -3.495 -7.680 1.00 . A A . 27 ARG CZ 1 1 14 9777 1 1 23 ARG H H 8.374 0.523 -3.867 1.00 . A A . 27 ARG H 1 1 14 9778 1 1 23 ARG HA H 6.123 1.300 -5.580 1.00 . A A . 27 ARG HA 1 1 14 9779 1 1 23 ARG HB2 H 7.139 -1.093 -4.260 1.00 . A A . 27 ARG HB2 1 1 14 9780 1 1 23 ARG HB3 H 5.401 -0.924 -4.034 1.00 . A A . 27 ARG HB3 1 1 14 9781 1 1 23 ARG HD2 H 7.743 -0.379 -7.160 1.00 . A A . 27 ARG HD2 1 1 14 9782 1 1 23 ARG HD3 H 8.049 -1.767 -6.098 1.00 . A A . 27 ARG HD3 1 1 14 9783 1 1 23 ARG HE H 7.056 -1.905 -8.829 1.00 . A A . 27 ARG HE 1 1 14 9784 1 1 23 ARG HG2 H 5.429 -1.986 -6.091 1.00 . A A . 27 ARG HG2 1 1 14 9785 1 1 23 ARG HG3 H 5.459 -0.294 -6.605 1.00 . A A . 27 ARG HG3 1 1 14 9786 1 1 23 ARG HH11 H 6.901 -3.381 -5.679 1.00 . A A . 27 ARG HH11 1 1 14 9787 1 1 23 ARG HH12 H 6.467 -4.933 -6.307 1.00 . A A . 27 ARG HH12 1 1 14 9788 1 1 23 ARG HH21 H 6.492 -3.929 -9.619 1.00 . A A . 27 ARG HH21 1 1 14 9789 1 1 23 ARG HH22 H 6.237 -5.243 -8.521 1.00 . A A . 27 ARG HH22 1 1 14 9790 1 1 23 ARG N N 7.812 1.193 -4.311 1.00 . A A . 27 ARG N 1 1 14 9791 1 1 23 ARG NE N 7.035 -2.239 -7.907 1.00 . A A . 27 ARG NE 1 1 14 9792 1 1 23 ARG NH1 N 6.699 -3.972 -6.460 1.00 . A A . 27 ARG NH1 1 1 14 9793 1 1 23 ARG NH2 N 6.468 -4.284 -8.685 1.00 . A A . 27 ARG NH2 1 1 14 9794 1 1 23 ARG O O 5.531 1.054 -2.397 1.00 . A A . 27 ARG O 1 1 14 9795 1 1 24 TYR C C 2.324 2.265 -3.103 1.00 . A A . 28 TYR C 1 1 14 9796 1 1 24 TYR CA C 3.676 2.899 -2.905 1.00 . A A . 28 TYR CA 1 1 14 9797 1 1 24 TYR CB C 3.635 4.435 -3.084 1.00 . A A . 28 TYR CB 1 1 14 9798 1 1 24 TYR CD1 C 2.512 4.030 -5.347 1.00 . A A . 28 TYR CD1 1 1 14 9799 1 1 24 TYR CD2 C 2.296 6.208 -4.303 1.00 . A A . 28 TYR CD2 1 1 14 9800 1 1 24 TYR CE1 C 1.782 4.484 -6.441 1.00 . A A . 28 TYR CE1 1 1 14 9801 1 1 24 TYR CE2 C 1.555 6.649 -5.401 1.00 . A A . 28 TYR CE2 1 1 14 9802 1 1 24 TYR CG C 2.782 4.887 -4.268 1.00 . A A . 28 TYR CG 1 1 14 9803 1 1 24 TYR CZ C 1.304 5.789 -6.471 1.00 . A A . 28 TYR CZ 1 1 14 9804 1 1 24 TYR H H 4.577 2.631 -4.847 1.00 . A A . 28 TYR H 1 1 14 9805 1 1 24 TYR HA H 4.027 2.658 -1.913 1.00 . A A . 28 TYR HA 1 1 14 9806 1 1 24 TYR HB2 H 3.238 4.877 -2.182 1.00 . A A . 28 TYR HB2 1 1 14 9807 1 1 24 TYR HB3 H 4.645 4.793 -3.230 1.00 . A A . 28 TYR HB3 1 1 14 9808 1 1 24 TYR HD1 H 2.855 3.023 -5.332 1.00 . A A . 28 TYR HD1 1 1 14 9809 1 1 24 TYR HD2 H 2.473 6.879 -3.474 1.00 . A A . 28 TYR HD2 1 1 14 9810 1 1 24 TYR HE1 H 1.579 3.816 -7.260 1.00 . A A . 28 TYR HE1 1 1 14 9811 1 1 24 TYR HE2 H 1.178 7.655 -5.423 1.00 . A A . 28 TYR HE2 1 1 14 9812 1 1 24 TYR HH H 0.914 7.115 -7.786 1.00 . A A . 28 TYR HH 1 1 14 9813 1 1 24 TYR N N 4.620 2.351 -3.910 1.00 . A A . 28 TYR N 1 1 14 9814 1 1 24 TYR O O 2.114 1.474 -4.005 1.00 . A A . 28 TYR O 1 1 14 9815 1 1 24 TYR OH O 0.595 6.236 -7.564 1.00 . A A . 28 TYR OH 1 1 14 9816 1 1 25 PHE C C -0.919 3.143 -2.421 1.00 . A A . 29 PHE C 1 1 14 9817 1 1 25 PHE CA C 0.078 2.009 -2.384 1.00 . A A . 29 PHE CA 1 1 14 9818 1 1 25 PHE CB C -0.036 1.097 -1.168 1.00 . A A . 29 PHE CB 1 1 14 9819 1 1 25 PHE CD1 C 2.324 0.166 -1.116 1.00 . A A . 29 PHE CD1 1 1 14 9820 1 1 25 PHE CD2 C 0.518 -1.235 -1.913 1.00 . A A . 29 PHE CD2 1 1 14 9821 1 1 25 PHE CE1 C 3.234 -0.868 -1.373 1.00 . A A . 29 PHE CE1 1 1 14 9822 1 1 25 PHE CE2 C 1.429 -2.263 -2.174 1.00 . A A . 29 PHE CE2 1 1 14 9823 1 1 25 PHE CG C 0.959 -0.022 -1.385 1.00 . A A . 29 PHE CG 1 1 14 9824 1 1 25 PHE CZ C 2.785 -2.081 -1.905 1.00 . A A . 29 PHE CZ 1 1 14 9825 1 1 25 PHE H H 1.618 3.225 -1.549 1.00 . A A . 29 PHE H 1 1 14 9826 1 1 25 PHE HA H 0.008 1.424 -3.288 1.00 . A A . 29 PHE HA 1 1 14 9827 1 1 25 PHE HB2 H 0.200 1.646 -0.265 1.00 . A A . 29 PHE HB2 1 1 14 9828 1 1 25 PHE HB3 H -1.037 0.695 -1.102 1.00 . A A . 29 PHE HB3 1 1 14 9829 1 1 25 PHE HD1 H 2.678 1.105 -0.709 1.00 . A A . 29 PHE HD1 1 1 14 9830 1 1 25 PHE HD2 H -0.527 -1.374 -2.123 1.00 . A A . 29 PHE HD2 1 1 14 9831 1 1 25 PHE HE1 H 4.283 -0.725 -1.173 1.00 . A A . 29 PHE HE1 1 1 14 9832 1 1 25 PHE HE2 H 1.079 -3.198 -2.590 1.00 . A A . 29 PHE HE2 1 1 14 9833 1 1 25 PHE HZ H 3.486 -2.875 -2.115 1.00 . A A . 29 PHE HZ 1 1 14 9834 1 1 25 PHE N N 1.416 2.590 -2.266 1.00 . A A . 29 PHE N 1 1 14 9835 1 1 25 PHE O O -1.265 3.739 -1.414 1.00 . A A . 29 PHE O 1 1 14 9836 1 1 26 LEU C C -3.636 4.225 -3.202 1.00 . A A . 30 LEU C 1 1 14 9837 1 1 26 LEU CA C -2.278 4.589 -3.798 1.00 . A A . 30 LEU CA 1 1 14 9838 1 1 26 LEU CB C -2.343 4.789 -5.319 1.00 . A A . 30 LEU CB 1 1 14 9839 1 1 26 LEU CD1 C -2.005 6.396 -7.189 1.00 . A A . 30 LEU CD1 1 1 14 9840 1 1 26 LEU CD2 C -2.641 7.252 -4.946 1.00 . A A . 30 LEU CD2 1 1 14 9841 1 1 26 LEU CG C -1.847 6.187 -5.686 1.00 . A A . 30 LEU CG 1 1 14 9842 1 1 26 LEU H H -0.999 2.977 -4.395 1.00 . A A . 30 LEU H 1 1 14 9843 1 1 26 LEU HA H -1.891 5.481 -3.328 1.00 . A A . 30 LEU HA 1 1 14 9844 1 1 26 LEU HB2 H -1.706 4.062 -5.803 1.00 . A A . 30 LEU HB2 1 1 14 9845 1 1 26 LEU HB3 H -3.352 4.667 -5.660 1.00 . A A . 30 LEU HB3 1 1 14 9846 1 1 26 LEU HD11 H -1.664 5.513 -7.711 1.00 . A A . 30 LEU HD11 1 1 14 9847 1 1 26 LEU HD12 H -1.415 7.245 -7.497 1.00 . A A . 30 LEU HD12 1 1 14 9848 1 1 26 LEU HD13 H -3.043 6.575 -7.421 1.00 . A A . 30 LEU HD13 1 1 14 9849 1 1 26 LEU HD21 H -3.425 7.620 -5.584 1.00 . A A . 30 LEU HD21 1 1 14 9850 1 1 26 LEU HD22 H -1.977 8.064 -4.682 1.00 . A A . 30 LEU HD22 1 1 14 9851 1 1 26 LEU HD23 H -3.067 6.834 -4.050 1.00 . A A . 30 LEU HD23 1 1 14 9852 1 1 26 LEU HG H -0.813 6.278 -5.419 1.00 . A A . 30 LEU HG 1 1 14 9853 1 1 26 LEU N N -1.335 3.468 -3.612 1.00 . A A . 30 LEU N 1 1 14 9854 1 1 26 LEU O O -4.370 3.408 -3.730 1.00 . A A . 30 LEU O 1 1 14 9855 1 1 27 ASN C C -6.391 5.262 -2.100 1.00 . A A . 31 ASN C 1 1 14 9856 1 1 27 ASN CA C -5.239 4.534 -1.399 1.00 . A A . 31 ASN CA 1 1 14 9857 1 1 27 ASN CB C -5.020 5.078 0.019 1.00 . A A . 31 ASN CB 1 1 14 9858 1 1 27 ASN CG C -6.330 5.095 0.801 1.00 . A A . 31 ASN CG 1 1 14 9859 1 1 27 ASN H H -3.324 5.458 -1.688 1.00 . A A . 31 ASN H 1 1 14 9860 1 1 27 ASN HA H -5.424 3.473 -1.363 1.00 . A A . 31 ASN HA 1 1 14 9861 1 1 27 ASN HB2 H -4.313 4.449 0.538 1.00 . A A . 31 ASN HB2 1 1 14 9862 1 1 27 ASN HB3 H -4.627 6.081 -0.042 1.00 . A A . 31 ASN HB3 1 1 14 9863 1 1 27 ASN HD21 H -5.577 4.085 2.333 1.00 . A A . 31 ASN HD21 1 1 14 9864 1 1 27 ASN HD22 H -7.205 4.525 2.483 1.00 . A A . 31 ASN HD22 1 1 14 9865 1 1 27 ASN N N -3.951 4.820 -2.087 1.00 . A A . 31 ASN N 1 1 14 9866 1 1 27 ASN ND2 N -6.376 4.520 1.971 1.00 . A A . 31 ASN ND2 1 1 14 9867 1 1 27 ASN O O -6.526 6.466 -2.004 1.00 . A A . 31 ASN O 1 1 14 9868 1 1 27 ASN OD1 O -7.313 5.646 0.358 1.00 . A A . 31 ASN OD1 1 1 14 9869 1 1 28 HIS C C -9.544 5.336 -2.515 1.00 . A A . 32 HIS C 1 1 14 9870 1 1 28 HIS CA C -8.373 5.193 -3.486 1.00 . A A . 32 HIS CA 1 1 14 9871 1 1 28 HIS CB C -8.735 4.254 -4.637 1.00 . A A . 32 HIS CB 1 1 14 9872 1 1 28 HIS CD2 C -8.366 5.166 -7.074 1.00 . A A . 32 HIS CD2 1 1 14 9873 1 1 28 HIS CE1 C -10.089 6.475 -7.185 1.00 . A A . 32 HIS CE1 1 1 14 9874 1 1 28 HIS CG C -9.022 5.063 -5.872 1.00 . A A . 32 HIS CG 1 1 14 9875 1 1 28 HIS H H -7.107 3.569 -2.853 1.00 . A A . 32 HIS H 1 1 14 9876 1 1 28 HIS HA H -8.083 6.155 -3.869 1.00 . A A . 32 HIS HA 1 1 14 9877 1 1 28 HIS HB2 H -7.911 3.584 -4.828 1.00 . A A . 32 HIS HB2 1 1 14 9878 1 1 28 HIS HB3 H -9.610 3.680 -4.371 1.00 . A A . 32 HIS HB3 1 1 14 9879 1 1 28 HIS HD1 H -10.792 6.059 -5.271 1.00 . A A . 32 HIS HD1 1 1 14 9880 1 1 28 HIS HD2 H -7.462 4.635 -7.337 1.00 . A A . 32 HIS HD2 1 1 14 9881 1 1 28 HIS HE1 H -10.823 7.183 -7.541 1.00 . A A . 32 HIS HE1 1 1 14 9882 1 1 28 HIS N N -7.226 4.540 -2.794 1.00 . A A . 32 HIS N 1 1 14 9883 1 1 28 HIS ND1 N -10.118 5.906 -5.966 1.00 . A A . 32 HIS ND1 1 1 14 9884 1 1 28 HIS NE2 N -9.041 6.060 -7.901 1.00 . A A . 32 HIS NE2 1 1 14 9885 1 1 28 HIS O O -10.353 6.235 -2.622 1.00 . A A . 32 HIS O 1 1 14 9886 1 1 29 ILE C C -10.809 5.917 0.051 1.00 . A A . 33 ILE C 1 1 14 9887 1 1 29 ILE CA C -10.743 4.519 -0.570 1.00 . A A . 33 ILE CA 1 1 14 9888 1 1 29 ILE CB C -10.405 3.465 0.491 1.00 . A A . 33 ILE CB 1 1 14 9889 1 1 29 ILE CD1 C -8.680 2.622 2.098 1.00 . A A . 33 ILE CD1 1 1 14 9890 1 1 29 ILE CG1 C -9.002 3.704 1.063 1.00 . A A . 33 ILE CG1 1 1 14 9891 1 1 29 ILE CG2 C -10.468 2.074 -0.142 1.00 . A A . 33 ILE CG2 1 1 14 9892 1 1 29 ILE H H -8.963 3.739 -1.506 1.00 . A A . 33 ILE H 1 1 14 9893 1 1 29 ILE HA H -11.681 4.276 -1.043 1.00 . A A . 33 ILE HA 1 1 14 9894 1 1 29 ILE HB H -11.125 3.527 1.287 1.00 . A A . 33 ILE HB 1 1 14 9895 1 1 29 ILE HD11 H -7.624 2.634 2.316 1.00 . A A . 33 ILE HD11 1 1 14 9896 1 1 29 ILE HD12 H -8.954 1.654 1.705 1.00 . A A . 33 ILE HD12 1 1 14 9897 1 1 29 ILE HD13 H -9.236 2.813 3.003 1.00 . A A . 33 ILE HD13 1 1 14 9898 1 1 29 ILE HG12 H -8.272 3.671 0.270 1.00 . A A . 33 ILE HG12 1 1 14 9899 1 1 29 ILE HG13 H -8.970 4.669 1.544 1.00 . A A . 33 ILE HG13 1 1 14 9900 1 1 29 ILE HG21 H -9.527 1.855 -0.626 1.00 . A A . 33 ILE HG21 1 1 14 9901 1 1 29 ILE HG22 H -11.263 2.045 -0.872 1.00 . A A . 33 ILE HG22 1 1 14 9902 1 1 29 ILE HG23 H -10.657 1.338 0.626 1.00 . A A . 33 ILE HG23 1 1 14 9903 1 1 29 ILE N N -9.632 4.449 -1.564 1.00 . A A . 33 ILE N 1 1 14 9904 1 1 29 ILE O O -11.871 6.476 0.243 1.00 . A A . 33 ILE O 1 1 14 9905 1 1 30 ASP C C -8.610 8.724 0.261 1.00 . A A . 34 ASP C 1 1 14 9906 1 1 30 ASP CA C -9.656 7.846 0.965 1.00 . A A . 34 ASP CA 1 1 14 9907 1 1 30 ASP CB C -9.271 7.623 2.427 1.00 . A A . 34 ASP CB 1 1 14 9908 1 1 30 ASP CG C -10.528 7.323 3.246 1.00 . A A . 34 ASP CG 1 1 14 9909 1 1 30 ASP H H -8.842 6.007 0.191 1.00 . A A . 34 ASP H 1 1 14 9910 1 1 30 ASP HA H -10.631 8.301 0.907 1.00 . A A . 34 ASP HA 1 1 14 9911 1 1 30 ASP HB2 H -8.589 6.788 2.498 1.00 . A A . 34 ASP HB2 1 1 14 9912 1 1 30 ASP HB3 H -8.793 8.511 2.815 1.00 . A A . 34 ASP HB3 1 1 14 9913 1 1 30 ASP N N -9.680 6.483 0.360 1.00 . A A . 34 ASP N 1 1 14 9914 1 1 30 ASP O O -8.197 9.744 0.776 1.00 . A A . 34 ASP O 1 1 14 9915 1 1 30 ASP OD1 O -11.159 6.313 2.978 1.00 . A A . 34 ASP OD1 1 1 14 9916 1 1 30 ASP OD2 O -10.840 8.108 4.126 1.00 . A A . 34 ASP OD2 1 1 14 9917 1 1 31 GLN C C -5.913 9.361 -0.805 1.00 . A A . 35 GLN C 1 1 14 9918 1 1 31 GLN CA C -7.171 9.147 -1.655 1.00 . A A . 35 GLN CA 1 1 14 9919 1 1 31 GLN CB C -7.855 10.484 -1.941 1.00 . A A . 35 GLN CB 1 1 14 9920 1 1 31 GLN CD C -10.329 10.834 -1.859 1.00 . A A . 35 GLN CD 1 1 14 9921 1 1 31 GLN CG C -9.178 10.237 -2.672 1.00 . A A . 35 GLN CG 1 1 14 9922 1 1 31 GLN H H -8.534 7.513 -1.311 1.00 . A A . 35 GLN H 1 1 14 9923 1 1 31 GLN HA H -6.916 8.663 -2.584 1.00 . A A . 35 GLN HA 1 1 14 9924 1 1 31 GLN HB2 H -8.049 10.997 -1.011 1.00 . A A . 35 GLN HB2 1 1 14 9925 1 1 31 GLN HB3 H -7.212 11.091 -2.561 1.00 . A A . 35 GLN HB3 1 1 14 9926 1 1 31 GLN HE21 H -10.140 12.643 -2.655 1.00 . A A . 35 GLN HE21 1 1 14 9927 1 1 31 GLN HE22 H -11.376 12.482 -1.503 1.00 . A A . 35 GLN HE22 1 1 14 9928 1 1 31 GLN HG2 H -9.144 10.704 -3.645 1.00 . A A . 35 GLN HG2 1 1 14 9929 1 1 31 GLN HG3 H -9.332 9.175 -2.788 1.00 . A A . 35 GLN HG3 1 1 14 9930 1 1 31 GLN N N -8.185 8.336 -0.912 1.00 . A A . 35 GLN N 1 1 14 9931 1 1 31 GLN NE2 N -10.641 12.091 -2.019 1.00 . A A . 35 GLN NE2 1 1 14 9932 1 1 31 GLN O O -5.780 10.350 -0.113 1.00 . A A . 35 GLN O 1 1 14 9933 1 1 31 GLN OE1 O -10.950 10.150 -1.071 1.00 . A A . 35 GLN OE1 1 1 14 9934 1 1 32 THR C C -2.633 7.711 -0.686 1.00 . A A . 36 THR C 1 1 14 9935 1 1 32 THR CA C -3.726 8.591 -0.074 1.00 . A A . 36 THR CA 1 1 14 9936 1 1 32 THR CB C -4.066 8.113 1.344 1.00 . A A . 36 THR CB 1 1 14 9937 1 1 32 THR CG2 C -3.231 8.897 2.359 1.00 . A A . 36 THR CG2 1 1 14 9938 1 1 32 THR H H -5.112 7.659 -1.436 1.00 . A A . 36 THR H 1 1 14 9939 1 1 32 THR HA H -3.413 9.623 -0.051 1.00 . A A . 36 THR HA 1 1 14 9940 1 1 32 THR HB H -3.836 7.063 1.434 1.00 . A A . 36 THR HB 1 1 14 9941 1 1 32 THR HG1 H -5.708 7.725 2.310 1.00 . A A . 36 THR HG1 1 1 14 9942 1 1 32 THR HG21 H -2.424 9.402 1.848 1.00 . A A . 36 THR HG21 1 1 14 9943 1 1 32 THR HG22 H -2.823 8.215 3.091 1.00 . A A . 36 THR HG22 1 1 14 9944 1 1 32 THR HG23 H -3.857 9.625 2.853 1.00 . A A . 36 THR HG23 1 1 14 9945 1 1 32 THR N N -4.986 8.444 -0.864 1.00 . A A . 36 THR N 1 1 14 9946 1 1 32 THR O O -2.831 7.094 -1.712 1.00 . A A . 36 THR O 1 1 14 9947 1 1 32 THR OG1 O -5.447 8.321 1.605 1.00 . A A . 36 THR OG1 1 1 14 9948 1 1 33 THR C C 0.545 6.316 0.470 1.00 . A A . 37 THR C 1 1 14 9949 1 1 33 THR CA C -0.395 6.787 -0.635 1.00 . A A . 37 THR CA 1 1 14 9950 1 1 33 THR CB C 0.372 7.676 -1.615 1.00 . A A . 37 THR CB 1 1 14 9951 1 1 33 THR CG2 C -0.573 8.175 -2.701 1.00 . A A . 37 THR CG2 1 1 14 9952 1 1 33 THR H H -1.337 8.141 0.758 1.00 . A A . 37 THR H 1 1 14 9953 1 1 33 THR HA H -0.813 5.942 -1.158 1.00 . A A . 37 THR HA 1 1 14 9954 1 1 33 THR HB H 1.167 7.103 -2.074 1.00 . A A . 37 THR HB 1 1 14 9955 1 1 33 THR HG1 H 0.246 9.136 -0.337 1.00 . A A . 37 THR HG1 1 1 14 9956 1 1 33 THR HG21 H -1.146 7.344 -3.078 1.00 . A A . 37 THR HG21 1 1 14 9957 1 1 33 THR HG22 H -0.001 8.613 -3.505 1.00 . A A . 37 THR HG22 1 1 14 9958 1 1 33 THR HG23 H -1.241 8.915 -2.289 1.00 . A A . 37 THR HG23 1 1 14 9959 1 1 33 THR N N -1.483 7.641 -0.072 1.00 . A A . 37 THR N 1 1 14 9960 1 1 33 THR O O 1.238 7.102 1.086 1.00 . A A . 37 THR O 1 1 14 9961 1 1 33 THR OG1 O 0.925 8.783 -0.917 1.00 . A A . 37 THR OG1 1 1 14 9962 1 1 34 THR C C 2.582 3.646 1.098 1.00 . A A . 38 THR C 1 1 14 9963 1 1 34 THR CA C 1.522 4.525 1.759 1.00 . A A . 38 THR CA 1 1 14 9964 1 1 34 THR CB C 0.652 3.717 2.729 1.00 . A A . 38 THR CB 1 1 14 9965 1 1 34 THR CG2 C 0.078 2.491 2.017 1.00 . A A . 38 THR CG2 1 1 14 9966 1 1 34 THR H H 0.041 4.415 0.183 1.00 . A A . 38 THR H 1 1 14 9967 1 1 34 THR HA H 1.989 5.348 2.280 1.00 . A A . 38 THR HA 1 1 14 9968 1 1 34 THR HB H -0.159 4.334 3.083 1.00 . A A . 38 THR HB 1 1 14 9969 1 1 34 THR HG1 H 2.238 2.883 3.486 1.00 . A A . 38 THR HG1 1 1 14 9970 1 1 34 THR HG21 H -0.592 1.969 2.684 1.00 . A A . 38 THR HG21 1 1 14 9971 1 1 34 THR HG22 H 0.882 1.834 1.724 1.00 . A A . 38 THR HG22 1 1 14 9972 1 1 34 THR HG23 H -0.463 2.811 1.142 1.00 . A A . 38 THR HG23 1 1 14 9973 1 1 34 THR N N 0.596 5.038 0.709 1.00 . A A . 38 THR N 1 1 14 9974 1 1 34 THR O O 2.364 3.107 0.036 1.00 . A A . 38 THR O 1 1 14 9975 1 1 34 THR OG1 O 1.442 3.296 3.830 1.00 . A A . 38 THR OG1 1 1 14 9976 1 1 35 TRP C C 4.630 1.200 1.543 1.00 . A A . 39 TRP C 1 1 14 9977 1 1 35 TRP CA C 4.781 2.648 1.067 1.00 . A A . 39 TRP CA 1 1 14 9978 1 1 35 TRP CB C 6.136 3.214 1.525 1.00 . A A . 39 TRP CB 1 1 14 9979 1 1 35 TRP CD1 C 5.702 5.551 2.399 1.00 . A A . 39 TRP CD1 1 1 14 9980 1 1 35 TRP CD2 C 6.680 5.568 0.370 1.00 . A A . 39 TRP CD2 1 1 14 9981 1 1 35 TRP CE2 C 6.503 6.921 0.752 1.00 . A A . 39 TRP CE2 1 1 14 9982 1 1 35 TRP CE3 C 7.280 5.310 -0.878 1.00 . A A . 39 TRP CE3 1 1 14 9983 1 1 35 TRP CG C 6.161 4.715 1.439 1.00 . A A . 39 TRP CG 1 1 14 9984 1 1 35 TRP CH2 C 7.503 7.698 -1.297 1.00 . A A . 39 TRP CH2 1 1 14 9985 1 1 35 TRP CZ2 C 6.907 7.972 -0.066 1.00 . A A . 39 TRP CZ2 1 1 14 9986 1 1 35 TRP CZ3 C 7.687 6.370 -1.703 1.00 . A A . 39 TRP CZ3 1 1 14 9987 1 1 35 TRP H H 3.898 3.942 2.557 1.00 . A A . 39 TRP H 1 1 14 9988 1 1 35 TRP HA H 4.704 2.695 -0.009 1.00 . A A . 39 TRP HA 1 1 14 9989 1 1 35 TRP HB2 H 6.316 2.918 2.547 1.00 . A A . 39 TRP HB2 1 1 14 9990 1 1 35 TRP HB3 H 6.917 2.812 0.897 1.00 . A A . 39 TRP HB3 1 1 14 9991 1 1 35 TRP HD1 H 5.249 5.249 3.331 1.00 . A A . 39 TRP HD1 1 1 14 9992 1 1 35 TRP HE1 H 5.659 7.656 2.506 1.00 . A A . 39 TRP HE1 1 1 14 9993 1 1 35 TRP HE3 H 7.423 4.295 -1.211 1.00 . A A . 39 TRP HE3 1 1 14 9994 1 1 35 TRP HH2 H 7.818 8.509 -1.938 1.00 . A A . 39 TRP HH2 1 1 14 9995 1 1 35 TRP HZ2 H 6.763 8.993 0.255 1.00 . A A . 39 TRP HZ2 1 1 14 9996 1 1 35 TRP HZ3 H 8.151 6.160 -2.655 1.00 . A A . 39 TRP HZ3 1 1 14 9997 1 1 35 TRP N N 3.729 3.498 1.700 1.00 . A A . 39 TRP N 1 1 14 9998 1 1 35 TRP NE1 N 5.904 6.857 1.991 1.00 . A A . 39 TRP NE1 1 1 14 9999 1 1 35 TRP O O 4.776 0.266 0.780 1.00 . A A . 39 TRP O 1 1 14 10000 1 1 36 GLN C C 3.717 -0.331 4.790 1.00 . A A . 40 GLN C 1 1 14 10001 1 1 36 GLN CA C 4.171 -0.376 3.328 1.00 . A A . 40 GLN CA 1 1 14 10002 1 1 36 GLN CB C 5.557 -1.011 3.215 1.00 . A A . 40 GLN CB 1 1 14 10003 1 1 36 GLN CD C 6.316 -3.145 4.269 1.00 . A A . 40 GLN CD 1 1 14 10004 1 1 36 GLN CG C 5.419 -2.534 3.191 1.00 . A A . 40 GLN CG 1 1 14 10005 1 1 36 GLN H H 4.220 1.777 3.398 1.00 . A A . 40 GLN H 1 1 14 10006 1 1 36 GLN HA H 3.463 -0.927 2.730 1.00 . A A . 40 GLN HA 1 1 14 10007 1 1 36 GLN HB2 H 6.033 -0.677 2.304 1.00 . A A . 40 GLN HB2 1 1 14 10008 1 1 36 GLN HB3 H 6.158 -0.718 4.064 1.00 . A A . 40 GLN HB3 1 1 14 10009 1 1 36 GLN HE21 H 6.880 -4.674 3.136 1.00 . A A . 40 GLN HE21 1 1 14 10010 1 1 36 GLN HE22 H 7.544 -4.646 4.696 1.00 . A A . 40 GLN HE22 1 1 14 10011 1 1 36 GLN HG2 H 4.391 -2.806 3.381 1.00 . A A . 40 GLN HG2 1 1 14 10012 1 1 36 GLN HG3 H 5.717 -2.907 2.222 1.00 . A A . 40 GLN HG3 1 1 14 10013 1 1 36 GLN N N 4.333 1.009 2.800 1.00 . A A . 40 GLN N 1 1 14 10014 1 1 36 GLN NE2 N 6.967 -4.246 4.013 1.00 . A A . 40 GLN NE2 1 1 14 10015 1 1 36 GLN O O 4.284 0.371 5.603 1.00 . A A . 40 GLN O 1 1 14 10016 1 1 36 GLN OE1 O 6.425 -2.615 5.357 1.00 . A A . 40 GLN OE1 1 1 14 10017 1 1 37 ASP C C 1.046 -2.067 6.706 1.00 . A A . 41 ASP C 1 1 14 10018 1 1 37 ASP CA C 2.212 -1.080 6.543 1.00 . A A . 41 ASP CA 1 1 14 10019 1 1 37 ASP CB C 1.749 0.353 6.817 1.00 . A A . 41 ASP CB 1 1 14 10020 1 1 37 ASP CG C 2.700 1.014 7.819 1.00 . A A . 41 ASP CG 1 1 14 10021 1 1 37 ASP H H 2.261 -1.641 4.459 1.00 . A A . 41 ASP H 1 1 14 10022 1 1 37 ASP HA H 3.016 -1.338 7.214 1.00 . A A . 41 ASP HA 1 1 14 10023 1 1 37 ASP HB2 H 1.751 0.916 5.896 1.00 . A A . 41 ASP HB2 1 1 14 10024 1 1 37 ASP HB3 H 0.750 0.337 7.226 1.00 . A A . 41 ASP HB3 1 1 14 10025 1 1 37 ASP N N 2.700 -1.078 5.131 1.00 . A A . 41 ASP N 1 1 14 10026 1 1 37 ASP O O 1.134 -2.994 7.487 1.00 . A A . 41 ASP O 1 1 14 10027 1 1 37 ASP OD1 O 2.936 0.421 8.859 1.00 . A A . 41 ASP OD1 1 1 14 10028 1 1 37 ASP OD2 O 3.173 2.099 7.528 1.00 . A A . 41 ASP OD2 1 1 14 10029 1 1 38 PRO C C -0.888 -4.089 5.396 1.00 . A A . 42 PRO C 1 1 14 10030 1 1 38 PRO CA C -1.194 -2.739 6.051 1.00 . A A . 42 PRO CA 1 1 14 10031 1 1 38 PRO CB C -2.276 -1.991 5.277 1.00 . A A . 42 PRO CB 1 1 14 10032 1 1 38 PRO CD C -0.222 -0.755 4.995 1.00 . A A . 42 PRO CD 1 1 14 10033 1 1 38 PRO CG C -1.529 -1.103 4.332 1.00 . A A . 42 PRO CG 1 1 14 10034 1 1 38 PRO HA H -1.498 -2.872 7.076 1.00 . A A . 42 PRO HA 1 1 14 10035 1 1 38 PRO HB2 H -2.895 -2.685 4.730 1.00 . A A . 42 PRO HB2 1 1 14 10036 1 1 38 PRO HB3 H -2.878 -1.399 5.950 1.00 . A A . 42 PRO HB3 1 1 14 10037 1 1 38 PRO HD2 H 0.575 -0.737 4.268 1.00 . A A . 42 PRO HD2 1 1 14 10038 1 1 38 PRO HD3 H -0.296 0.197 5.501 1.00 . A A . 42 PRO HD3 1 1 14 10039 1 1 38 PRO HG2 H -1.345 -1.625 3.404 1.00 . A A . 42 PRO HG2 1 1 14 10040 1 1 38 PRO HG3 H -2.099 -0.205 4.143 1.00 . A A . 42 PRO HG3 1 1 14 10041 1 1 38 PRO N N -0.015 -1.842 5.965 1.00 . A A . 42 PRO N 1 1 14 10042 1 1 38 PRO O O -0.280 -4.157 4.347 1.00 . A A . 42 PRO O 1 1 14 10043 1 1 39 ARG C C 0.456 -6.673 5.135 1.00 . A A . 43 ARG C 1 1 14 10044 1 1 39 ARG CA C -1.038 -6.509 5.421 1.00 . A A . 43 ARG CA 1 1 14 10045 1 1 39 ARG CB C -1.841 -6.538 4.120 1.00 . A A . 43 ARG CB 1 1 14 10046 1 1 39 ARG CD C -3.333 -8.494 4.559 1.00 . A A . 43 ARG CD 1 1 14 10047 1 1 39 ARG CG C -3.278 -6.971 4.417 1.00 . A A . 43 ARG CG 1 1 14 10048 1 1 39 ARG CZ C -4.697 -8.406 6.585 1.00 . A A . 43 ARG CZ 1 1 14 10049 1 1 39 ARG H H -1.795 -5.087 6.854 1.00 . A A . 43 ARG H 1 1 14 10050 1 1 39 ARG HA H -1.383 -7.285 6.085 1.00 . A A . 43 ARG HA 1 1 14 10051 1 1 39 ARG HB2 H -1.846 -5.555 3.677 1.00 . A A . 43 ARG HB2 1 1 14 10052 1 1 39 ARG HB3 H -1.388 -7.241 3.435 1.00 . A A . 43 ARG HB3 1 1 14 10053 1 1 39 ARG HD2 H -4.153 -8.895 3.982 1.00 . A A . 43 ARG HD2 1 1 14 10054 1 1 39 ARG HD3 H -2.399 -8.935 4.246 1.00 . A A . 43 ARG HD3 1 1 14 10055 1 1 39 ARG HE H -2.849 -9.140 6.555 1.00 . A A . 43 ARG HE 1 1 14 10056 1 1 39 ARG HG2 H -3.610 -6.512 5.337 1.00 . A A . 43 ARG HG2 1 1 14 10057 1 1 39 ARG HG3 H -3.922 -6.662 3.607 1.00 . A A . 43 ARG HG3 1 1 14 10058 1 1 39 ARG HH11 H -5.554 -7.688 4.915 1.00 . A A . 43 ARG HH11 1 1 14 10059 1 1 39 ARG HH12 H -6.525 -7.621 6.344 1.00 . A A . 43 ARG HH12 1 1 14 10060 1 1 39 ARG HH21 H -4.128 -9.042 8.396 1.00 . A A . 43 ARG HH21 1 1 14 10061 1 1 39 ARG HH22 H -5.727 -8.381 8.301 1.00 . A A . 43 ARG HH22 1 1 14 10062 1 1 39 ARG N N -1.305 -5.164 6.008 1.00 . A A . 43 ARG N 1 1 14 10063 1 1 39 ARG NE N -3.559 -8.733 6.016 1.00 . A A . 43 ARG NE 1 1 14 10064 1 1 39 ARG NH1 N -5.667 -7.862 5.892 1.00 . A A . 43 ARG NH1 1 1 14 10065 1 1 39 ARG NH2 N -4.864 -8.626 7.860 1.00 . A A . 43 ARG NH2 1 1 14 10066 1 1 39 ARG O O 1.245 -5.778 5.370 1.00 . A A . 43 ARG O 1 1 14 10067 1 1 40 LYS C C 2.774 -7.037 3.267 1.00 . A A . 44 LYS C 1 1 14 10068 1 1 40 LYS CA C 2.298 -8.028 4.333 1.00 . A A . 44 LYS CA 1 1 14 10069 1 1 40 LYS CB C 2.382 -9.462 3.808 1.00 . A A . 44 LYS CB 1 1 14 10070 1 1 40 LYS CD C 2.426 -9.221 1.323 1.00 . A A . 44 LYS CD 1 1 14 10071 1 1 40 LYS CE C 2.011 -10.066 0.116 1.00 . A A . 44 LYS CE 1 1 14 10072 1 1 40 LYS CG C 1.556 -9.589 2.526 1.00 . A A . 44 LYS CG 1 1 14 10073 1 1 40 LYS H H 0.203 -8.519 4.451 1.00 . A A . 44 LYS H 1 1 14 10074 1 1 40 LYS HA H 2.887 -7.930 5.230 1.00 . A A . 44 LYS HA 1 1 14 10075 1 1 40 LYS HB2 H 3.411 -9.710 3.599 1.00 . A A . 44 LYS HB2 1 1 14 10076 1 1 40 LYS HB3 H 1.993 -10.141 4.554 1.00 . A A . 44 LYS HB3 1 1 14 10077 1 1 40 LYS HD2 H 2.294 -8.173 1.091 1.00 . A A . 44 LYS HD2 1 1 14 10078 1 1 40 LYS HD3 H 3.463 -9.410 1.556 1.00 . A A . 44 LYS HD3 1 1 14 10079 1 1 40 LYS HE2 H 1.969 -11.110 0.387 1.00 . A A . 44 LYS HE2 1 1 14 10080 1 1 40 LYS HE3 H 1.055 -9.735 -0.264 1.00 . A A . 44 LYS HE3 1 1 14 10081 1 1 40 LYS HG2 H 1.206 -10.605 2.421 1.00 . A A . 44 LYS HG2 1 1 14 10082 1 1 40 LYS HG3 H 0.710 -8.919 2.577 1.00 . A A . 44 LYS HG3 1 1 14 10083 1 1 40 LYS HZ1 H 3.934 -10.362 -0.625 1.00 . A A . 44 LYS HZ1 1 1 14 10084 1 1 40 LYS HZ2 H 3.299 -8.818 -0.943 1.00 . A A . 44 LYS HZ2 1 1 14 10085 1 1 40 LYS HZ3 H 2.753 -10.163 -1.826 1.00 . A A . 44 LYS HZ3 1 1 14 10086 1 1 40 LYS N N 0.853 -7.809 4.631 1.00 . A A . 44 LYS N 1 1 14 10087 1 1 40 LYS NZ N 3.081 -9.835 -0.896 1.00 . A A . 44 LYS NZ 1 1 14 10088 1 1 40 LYS O O 1.928 -6.448 2.615 1.00 . A A . 44 LYS O 1 1 14 10089 1 1 40 LYS OXT O 3.976 -6.886 3.123 1.00 . A A . 44 LYS OXT 1 1 14 10090 2 2 1 ACE C C 8.209 14.322 0.524 1.00 . B B . 45 ACE C 1 1 14 10091 2 2 1 ACE CH3 C 7.237 15.277 1.220 1.00 . B B . 45 ACE CH3 1 1 14 10092 2 2 1 ACE H1 H 6.242 14.856 1.199 1.00 . B B . 45 ACE H1 1 1 14 10093 2 2 1 ACE H2 H 7.236 16.228 0.709 1.00 . B B . 45 ACE H2 1 1 14 10094 2 2 1 ACE H3 H 7.546 15.420 2.245 1.00 . B B . 45 ACE H3 1 1 14 10095 2 2 1 ACE O O 8.874 14.695 -0.423 1.00 . B B . 45 ACE O 1 1 14 10096 2 2 2 PRO C C 6.993 11.376 -0.213 1.00 . B B . 46 PRO C 1 1 14 10097 2 2 2 PRO CA C 8.376 11.957 0.097 1.00 . B B . 46 PRO CA 1 1 14 10098 2 2 2 PRO CB C 9.224 10.954 0.870 1.00 . B B . 46 PRO CB 1 1 14 10099 2 2 2 PRO CD C 8.739 12.777 2.367 1.00 . B B . 46 PRO CD 1 1 14 10100 2 2 2 PRO CG C 9.009 11.298 2.306 1.00 . B B . 46 PRO CG 1 1 14 10101 2 2 2 PRO HA H 8.881 12.246 -0.812 1.00 . B B . 46 PRO HA 1 1 14 10102 2 2 2 PRO HB2 H 8.889 9.946 0.666 1.00 . B B . 46 PRO HB2 1 1 14 10103 2 2 2 PRO HB3 H 10.266 11.066 0.616 1.00 . B B . 46 PRO HB3 1 1 14 10104 2 2 2 PRO HD2 H 7.982 12.991 3.108 1.00 . B B . 46 PRO HD2 1 1 14 10105 2 2 2 PRO HD3 H 9.646 13.319 2.582 1.00 . B B . 46 PRO HD3 1 1 14 10106 2 2 2 PRO HG2 H 8.162 10.748 2.692 1.00 . B B . 46 PRO HG2 1 1 14 10107 2 2 2 PRO HG3 H 9.894 11.066 2.877 1.00 . B B . 46 PRO HG3 1 1 14 10108 2 2 2 PRO N N 8.256 13.117 1.020 1.00 . B B . 46 PRO N 1 1 14 10109 2 2 2 PRO O O 6.648 11.144 -1.355 1.00 . B B . 46 PRO O 1 1 14 10110 2 2 3 LEU C C 4.082 11.437 -0.464 1.00 . B B . 47 LEU C 1 1 14 10111 2 2 3 LEU CA C 4.839 10.577 0.559 1.00 . B B . 47 LEU CA 1 1 14 10112 2 2 3 LEU CB C 4.150 10.631 1.923 1.00 . B B . 47 LEU CB 1 1 14 10113 2 2 3 LEU CD1 C 2.579 8.823 2.633 1.00 . B B . 47 LEU CD1 1 1 14 10114 2 2 3 LEU CD2 C 1.736 11.151 2.296 1.00 . B B . 47 LEU CD2 1 1 14 10115 2 2 3 LEU CG C 2.723 10.094 1.796 1.00 . B B . 47 LEU CG 1 1 14 10116 2 2 3 LEU H H 6.496 11.337 1.709 1.00 . B B . 47 LEU H 1 1 14 10117 2 2 3 LEU HA H 4.910 9.556 0.225 1.00 . B B . 47 LEU HA 1 1 14 10118 2 2 3 LEU HB2 H 4.700 10.024 2.627 1.00 . B B . 47 LEU HB2 1 1 14 10119 2 2 3 LEU HB3 H 4.122 11.651 2.273 1.00 . B B . 47 LEU HB3 1 1 14 10120 2 2 3 LEU HD11 H 1.532 8.592 2.761 1.00 . B B . 47 LEU HD11 1 1 14 10121 2 2 3 LEU HD12 H 3.034 8.976 3.601 1.00 . B B . 47 LEU HD12 1 1 14 10122 2 2 3 LEU HD13 H 3.071 8.003 2.131 1.00 . B B . 47 LEU HD13 1 1 14 10123 2 2 3 LEU HD21 H 1.303 11.668 1.453 1.00 . B B . 47 LEU HD21 1 1 14 10124 2 2 3 LEU HD22 H 2.255 11.858 2.926 1.00 . B B . 47 LEU HD22 1 1 14 10125 2 2 3 LEU HD23 H 0.953 10.669 2.864 1.00 . B B . 47 LEU HD23 1 1 14 10126 2 2 3 LEU HG H 2.514 9.868 0.759 1.00 . B B . 47 LEU HG 1 1 14 10127 2 2 3 LEU N N 6.200 11.141 0.795 1.00 . B B . 47 LEU N 1 1 14 10128 2 2 3 LEU O O 3.877 12.614 -0.242 1.00 . B B . 47 LEU O 1 1 14 10129 2 2 4 PRO C C 1.526 11.912 -2.128 1.00 . B B . 48 PRO C 1 1 14 10130 2 2 4 PRO CA C 2.946 11.574 -2.611 1.00 . B B . 48 PRO CA 1 1 14 10131 2 2 4 PRO CB C 2.904 10.597 -3.782 1.00 . B B . 48 PRO CB 1 1 14 10132 2 2 4 PRO CD C 3.879 9.416 -1.924 1.00 . B B . 48 PRO CD 1 1 14 10133 2 2 4 PRO CG C 3.041 9.244 -3.162 1.00 . B B . 48 PRO CG 1 1 14 10134 2 2 4 PRO HA H 3.484 12.464 -2.892 1.00 . B B . 48 PRO HA 1 1 14 10135 2 2 4 PRO HB2 H 1.962 10.675 -4.305 1.00 . B B . 48 PRO HB2 1 1 14 10136 2 2 4 PRO HB3 H 3.726 10.784 -4.458 1.00 . B B . 48 PRO HB3 1 1 14 10137 2 2 4 PRO HD2 H 3.526 8.769 -1.134 1.00 . B B . 48 PRO HD2 1 1 14 10138 2 2 4 PRO HD3 H 4.919 9.220 -2.140 1.00 . B B . 48 PRO HD3 1 1 14 10139 2 2 4 PRO HG2 H 2.066 8.861 -2.899 1.00 . B B . 48 PRO HG2 1 1 14 10140 2 2 4 PRO HG3 H 3.529 8.570 -3.849 1.00 . B B . 48 PRO HG3 1 1 14 10141 2 2 4 PRO N N 3.685 10.828 -1.560 1.00 . B B . 48 PRO N 1 1 14 10142 2 2 4 PRO O O 0.755 11.021 -1.828 1.00 . B B . 48 PRO O 1 1 14 10143 2 2 5 PRO C C -1.181 13.275 -2.668 1.00 . B B . 49 PRO C 1 1 14 10144 2 2 5 PRO CA C -0.128 13.615 -1.610 1.00 . B B . 49 PRO CA 1 1 14 10145 2 2 5 PRO CB C 0.011 15.124 -1.443 1.00 . B B . 49 PRO CB 1 1 14 10146 2 2 5 PRO CD C 2.072 14.336 -2.407 1.00 . B B . 49 PRO CD 1 1 14 10147 2 2 5 PRO CG C 1.133 15.511 -2.351 1.00 . B B . 49 PRO CG 1 1 14 10148 2 2 5 PRO HA H -0.374 13.157 -0.666 1.00 . B B . 49 PRO HA 1 1 14 10149 2 2 5 PRO HB2 H -0.901 15.621 -1.741 1.00 . B B . 49 PRO HB2 1 1 14 10150 2 2 5 PRO HB3 H 0.255 15.369 -0.420 1.00 . B B . 49 PRO HB3 1 1 14 10151 2 2 5 PRO HD2 H 2.481 14.223 -3.400 1.00 . B B . 49 PRO HD2 1 1 14 10152 2 2 5 PRO HD3 H 2.864 14.448 -1.680 1.00 . B B . 49 PRO HD3 1 1 14 10153 2 2 5 PRO HG2 H 0.752 15.726 -3.339 1.00 . B B . 49 PRO HG2 1 1 14 10154 2 2 5 PRO HG3 H 1.647 16.376 -1.956 1.00 . B B . 49 PRO HG3 1 1 14 10155 2 2 5 PRO N N 1.220 13.187 -2.066 1.00 . B B . 49 PRO N 1 1 14 10156 2 2 5 PRO O O -1.296 13.939 -3.680 1.00 . B B . 49 PRO O 1 1 14 10157 2 2 6 TYR C C -4.372 12.344 -2.965 1.00 . B B . 50 TYR C 1 1 14 10158 2 2 6 TYR CA C -2.996 11.863 -3.434 1.00 . B B . 50 TYR CA 1 1 14 10159 2 2 6 TYR CB C -2.951 10.335 -3.483 1.00 . B B . 50 TYR CB 1 1 14 10160 2 2 6 TYR CD1 C -3.799 10.264 -5.855 1.00 . B B . 50 TYR CD1 1 1 14 10161 2 2 6 TYR CD2 C -4.935 8.941 -4.171 1.00 . B B . 50 TYR CD2 1 1 14 10162 2 2 6 TYR CE1 C -4.696 9.802 -6.825 1.00 . B B . 50 TYR CE1 1 1 14 10163 2 2 6 TYR CE2 C -5.832 8.477 -5.140 1.00 . B B . 50 TYR CE2 1 1 14 10164 2 2 6 TYR CG C -3.918 9.836 -4.528 1.00 . B B . 50 TYR CG 1 1 14 10165 2 2 6 TYR CZ C -5.713 8.908 -6.468 1.00 . B B . 50 TYR CZ 1 1 14 10166 2 2 6 TYR H H -1.841 11.724 -1.619 1.00 . B B . 50 TYR H 1 1 14 10167 2 2 6 TYR HA H -2.764 12.269 -4.404 1.00 . B B . 50 TYR HA 1 1 14 10168 2 2 6 TYR HB2 H -1.951 10.015 -3.735 1.00 . B B . 50 TYR HB2 1 1 14 10169 2 2 6 TYR HB3 H -3.226 9.935 -2.519 1.00 . B B . 50 TYR HB3 1 1 14 10170 2 2 6 TYR HD1 H -3.014 10.954 -6.131 1.00 . B B . 50 TYR HD1 1 1 14 10171 2 2 6 TYR HD2 H -5.026 8.608 -3.147 1.00 . B B . 50 TYR HD2 1 1 14 10172 2 2 6 TYR HE1 H -4.604 10.133 -7.848 1.00 . B B . 50 TYR HE1 1 1 14 10173 2 2 6 TYR HE2 H -6.616 7.787 -4.865 1.00 . B B . 50 TYR HE2 1 1 14 10174 2 2 6 TYR HH H -7.233 9.149 -7.598 1.00 . B B . 50 TYR HH 1 1 14 10175 2 2 6 TYR N N -1.951 12.246 -2.442 1.00 . B B . 50 TYR N 1 1 14 10176 2 2 6 TYR O O -4.933 13.205 -3.622 1.00 . B B . 50 TYR O 1 1 14 10177 2 2 6 TYR OXT O -4.841 11.844 -1.957 1.00 . B B . 50 TYR OXT 1 1 14 10178 2 2 6 TYR OH O -6.596 8.451 -7.423 1.00 . B B . 50 TYR OH 1 1 15 10179 1 1 1 PHE C C -1.393 -8.981 18.435 1.00 . A A . 5 PHE C 1 1 15 10180 1 1 1 PHE CA C -1.741 -10.389 18.928 1.00 . A A . 5 PHE CA 1 1 15 10181 1 1 1 PHE CB C -2.434 -10.325 20.288 1.00 . A A . 5 PHE CB 1 1 15 10182 1 1 1 PHE CD1 C -0.498 -10.343 21.903 1.00 . A A . 5 PHE CD1 1 1 15 10183 1 1 1 PHE CD2 C -1.730 -8.279 21.583 1.00 . A A . 5 PHE CD2 1 1 15 10184 1 1 1 PHE CE1 C 0.338 -9.701 22.824 1.00 . A A . 5 PHE CE1 1 1 15 10185 1 1 1 PHE CE2 C -0.894 -7.638 22.504 1.00 . A A . 5 PHE CE2 1 1 15 10186 1 1 1 PHE CG C -1.532 -9.632 21.282 1.00 . A A . 5 PHE CG 1 1 15 10187 1 1 1 PHE CZ C 0.140 -8.348 23.125 1.00 . A A . 5 PHE CZ 1 1 15 10188 1 1 1 PHE HA H -2.373 -10.892 18.215 1.00 . A A . 5 PHE HA 1 1 15 10189 1 1 1 PHE HB2 H -3.358 -9.775 20.195 1.00 . A A . 5 PHE HB2 1 1 15 10190 1 1 1 PHE HB3 H -2.644 -11.327 20.632 1.00 . A A . 5 PHE HB3 1 1 15 10191 1 1 1 PHE HD1 H -0.345 -11.388 21.671 1.00 . A A . 5 PHE HD1 1 1 15 10192 1 1 1 PHE HD2 H -2.529 -7.731 21.104 1.00 . A A . 5 PHE HD2 1 1 15 10193 1 1 1 PHE HE1 H 1.136 -10.250 23.304 1.00 . A A . 5 PHE HE1 1 1 15 10194 1 1 1 PHE HE2 H -1.047 -6.595 22.736 1.00 . A A . 5 PHE HE2 1 1 15 10195 1 1 1 PHE HZ H 0.785 -7.853 23.836 1.00 . A A . 5 PHE HZ 1 1 15 10196 1 1 1 PHE N N -0.495 -11.174 19.165 1.00 . A A . 5 PHE N 1 1 15 10197 1 1 1 PHE O O -1.912 -7.998 18.922 1.00 . A A . 5 PHE O 1 1 15 10198 1 1 2 GLU C C -0.512 -7.416 15.471 1.00 . A A . 6 GLU C 1 1 15 10199 1 1 2 GLU CA C -0.137 -7.533 16.951 1.00 . A A . 6 GLU CA 1 1 15 10200 1 1 2 GLU CB C 1.380 -7.455 17.129 1.00 . A A . 6 GLU CB 1 1 15 10201 1 1 2 GLU CD C 1.894 -5.225 18.129 1.00 . A A . 6 GLU CD 1 1 15 10202 1 1 2 GLU CG C 1.854 -6.031 16.831 1.00 . A A . 6 GLU CG 1 1 15 10203 1 1 2 GLU H H -0.109 -9.685 17.093 1.00 . A A . 6 GLU H 1 1 15 10204 1 1 2 GLU HA H -0.617 -6.757 17.525 1.00 . A A . 6 GLU HA 1 1 15 10205 1 1 2 GLU HB2 H 1.637 -7.715 18.144 1.00 . A A . 6 GLU HB2 1 1 15 10206 1 1 2 GLU HB3 H 1.856 -8.144 16.448 1.00 . A A . 6 GLU HB3 1 1 15 10207 1 1 2 GLU HG2 H 2.841 -6.064 16.396 1.00 . A A . 6 GLU HG2 1 1 15 10208 1 1 2 GLU HG3 H 1.171 -5.562 16.137 1.00 . A A . 6 GLU HG3 1 1 15 10209 1 1 2 GLU N N -0.517 -8.878 17.474 1.00 . A A . 6 GLU N 1 1 15 10210 1 1 2 GLU O O 0.335 -7.230 14.620 1.00 . A A . 6 GLU O 1 1 15 10211 1 1 2 GLU OE1 O 1.007 -5.409 18.947 1.00 . A A . 6 GLU OE1 1 1 15 10212 1 1 2 GLU OE2 O 2.812 -4.437 18.286 1.00 . A A . 6 GLU OE2 1 1 15 10213 1 1 3 ILE C C -1.405 -8.399 12.866 1.00 . A A . 7 ILE C 1 1 15 10214 1 1 3 ILE CA C -2.203 -7.415 13.733 1.00 . A A . 7 ILE CA 1 1 15 10215 1 1 3 ILE CB C -1.892 -5.974 13.334 1.00 . A A . 7 ILE CB 1 1 15 10216 1 1 3 ILE CD1 C -2.348 -3.572 13.852 1.00 . A A . 7 ILE CD1 1 1 15 10217 1 1 3 ILE CG1 C -2.657 -5.016 14.251 1.00 . A A . 7 ILE CG1 1 1 15 10218 1 1 3 ILE CG2 C -2.321 -5.741 11.884 1.00 . A A . 7 ILE CG2 1 1 15 10219 1 1 3 ILE H H -2.441 -7.672 15.860 1.00 . A A . 7 ILE H 1 1 15 10220 1 1 3 ILE HA H -3.261 -7.604 13.643 1.00 . A A . 7 ILE HA 1 1 15 10221 1 1 3 ILE HB H -0.831 -5.794 13.428 1.00 . A A . 7 ILE HB 1 1 15 10222 1 1 3 ILE HD11 H -3.022 -3.262 13.068 1.00 . A A . 7 ILE HD11 1 1 15 10223 1 1 3 ILE HD12 H -1.329 -3.507 13.497 1.00 . A A . 7 ILE HD12 1 1 15 10224 1 1 3 ILE HD13 H -2.471 -2.927 14.710 1.00 . A A . 7 ILE HD13 1 1 15 10225 1 1 3 ILE HG12 H -3.718 -5.196 14.154 1.00 . A A . 7 ILE HG12 1 1 15 10226 1 1 3 ILE HG13 H -2.357 -5.180 15.274 1.00 . A A . 7 ILE HG13 1 1 15 10227 1 1 3 ILE HG21 H -3.006 -4.907 11.840 1.00 . A A . 7 ILE HG21 1 1 15 10228 1 1 3 ILE HG22 H -2.811 -6.629 11.507 1.00 . A A . 7 ILE HG22 1 1 15 10229 1 1 3 ILE HG23 H -1.453 -5.527 11.281 1.00 . A A . 7 ILE HG23 1 1 15 10230 1 1 3 ILE N N -1.775 -7.523 15.158 1.00 . A A . 7 ILE N 1 1 15 10231 1 1 3 ILE O O -0.309 -8.092 12.439 1.00 . A A . 7 ILE O 1 1 15 10232 1 1 4 PRO C C -1.306 -10.167 10.328 1.00 . A A . 8 PRO C 1 1 15 10233 1 1 4 PRO CA C -1.302 -10.581 11.803 1.00 . A A . 8 PRO CA 1 1 15 10234 1 1 4 PRO CB C -2.147 -11.833 12.017 1.00 . A A . 8 PRO CB 1 1 15 10235 1 1 4 PRO CD C -3.298 -10.009 13.102 1.00 . A A . 8 PRO CD 1 1 15 10236 1 1 4 PRO CG C -3.502 -11.325 12.398 1.00 . A A . 8 PRO CG 1 1 15 10237 1 1 4 PRO HA H -0.296 -10.749 12.151 1.00 . A A . 8 PRO HA 1 1 15 10238 1 1 4 PRO HB2 H -2.205 -12.408 11.106 1.00 . A A . 8 PRO HB2 1 1 15 10239 1 1 4 PRO HB3 H -1.734 -12.432 12.815 1.00 . A A . 8 PRO HB3 1 1 15 10240 1 1 4 PRO HD2 H -4.066 -9.305 12.818 1.00 . A A . 8 PRO HD2 1 1 15 10241 1 1 4 PRO HD3 H -3.289 -10.149 14.173 1.00 . A A . 8 PRO HD3 1 1 15 10242 1 1 4 PRO HG2 H -4.103 -11.180 11.513 1.00 . A A . 8 PRO HG2 1 1 15 10243 1 1 4 PRO HG3 H -3.986 -12.026 13.061 1.00 . A A . 8 PRO HG3 1 1 15 10244 1 1 4 PRO N N -1.982 -9.554 12.630 1.00 . A A . 8 PRO N 1 1 15 10245 1 1 4 PRO O O -0.469 -10.590 9.556 1.00 . A A . 8 PRO O 1 1 15 10246 1 1 5 ASP C C -2.143 -10.061 7.552 1.00 . A A . 9 ASP C 1 1 15 10247 1 1 5 ASP CA C -2.304 -8.881 8.518 1.00 . A A . 9 ASP CA 1 1 15 10248 1 1 5 ASP CB C -1.141 -7.906 8.382 1.00 . A A . 9 ASP CB 1 1 15 10249 1 1 5 ASP CG C -1.188 -7.236 7.008 1.00 . A A . 9 ASP CG 1 1 15 10250 1 1 5 ASP H H -2.892 -9.003 10.581 1.00 . A A . 9 ASP H 1 1 15 10251 1 1 5 ASP HA H -3.234 -8.368 8.331 1.00 . A A . 9 ASP HA 1 1 15 10252 1 1 5 ASP HB2 H -1.217 -7.155 9.154 1.00 . A A . 9 ASP HB2 1 1 15 10253 1 1 5 ASP HB3 H -0.210 -8.441 8.493 1.00 . A A . 9 ASP HB3 1 1 15 10254 1 1 5 ASP N N -2.238 -9.337 9.937 1.00 . A A . 9 ASP N 1 1 15 10255 1 1 5 ASP O O -1.089 -10.274 6.988 1.00 . A A . 9 ASP O 1 1 15 10256 1 1 5 ASP OD1 O -1.810 -7.797 6.118 1.00 . A A . 9 ASP OD1 1 1 15 10257 1 1 5 ASP OD2 O -0.603 -6.177 6.866 1.00 . A A . 9 ASP OD2 1 1 15 10258 1 1 6 ASP C C -3.471 -11.572 5.012 1.00 . A A . 10 ASP C 1 1 15 10259 1 1 6 ASP CA C -3.085 -11.993 6.432 1.00 . A A . 10 ASP CA 1 1 15 10260 1 1 6 ASP CB C -4.084 -13.015 6.976 1.00 . A A . 10 ASP CB 1 1 15 10261 1 1 6 ASP CG C -3.754 -14.400 6.415 1.00 . A A . 10 ASP CG 1 1 15 10262 1 1 6 ASP H H -4.022 -10.640 7.824 1.00 . A A . 10 ASP H 1 1 15 10263 1 1 6 ASP HA H -2.090 -12.406 6.447 1.00 . A A . 10 ASP HA 1 1 15 10264 1 1 6 ASP HB2 H -4.021 -13.040 8.055 1.00 . A A . 10 ASP HB2 1 1 15 10265 1 1 6 ASP HB3 H -5.084 -12.735 6.682 1.00 . A A . 10 ASP HB3 1 1 15 10266 1 1 6 ASP N N -3.180 -10.829 7.360 1.00 . A A . 10 ASP N 1 1 15 10267 1 1 6 ASP O O -2.818 -11.925 4.050 1.00 . A A . 10 ASP O 1 1 15 10268 1 1 6 ASP OD1 O -2.579 -14.699 6.282 1.00 . A A . 10 ASP OD1 1 1 15 10269 1 1 6 ASP OD2 O -4.682 -15.137 6.128 1.00 . A A . 10 ASP OD2 1 1 15 10270 1 1 7 VAL C C -4.156 -9.134 3.086 1.00 . A A . 11 VAL C 1 1 15 10271 1 1 7 VAL CA C -4.952 -10.375 3.514 1.00 . A A . 11 VAL CA 1 1 15 10272 1 1 7 VAL CB C -6.437 -10.036 3.655 1.00 . A A . 11 VAL CB 1 1 15 10273 1 1 7 VAL CG1 C -6.966 -9.495 2.325 1.00 . A A . 11 VAL CG1 1 1 15 10274 1 1 7 VAL CG2 C -7.214 -11.298 4.038 1.00 . A A . 11 VAL CG2 1 1 15 10275 1 1 7 VAL H H -5.040 -10.543 5.660 1.00 . A A . 11 VAL H 1 1 15 10276 1 1 7 VAL HA H -4.823 -11.172 2.800 1.00 . A A . 11 VAL HA 1 1 15 10277 1 1 7 VAL HB H -6.563 -9.288 4.424 1.00 . A A . 11 VAL HB 1 1 15 10278 1 1 7 VAL HG11 H -6.270 -8.770 1.929 1.00 . A A . 11 VAL HG11 1 1 15 10279 1 1 7 VAL HG12 H -7.925 -9.023 2.485 1.00 . A A . 11 VAL HG12 1 1 15 10280 1 1 7 VAL HG13 H -7.077 -10.309 1.624 1.00 . A A . 11 VAL HG13 1 1 15 10281 1 1 7 VAL HG21 H -7.219 -11.983 3.204 1.00 . A A . 11 VAL HG21 1 1 15 10282 1 1 7 VAL HG22 H -8.229 -11.031 4.291 1.00 . A A . 11 VAL HG22 1 1 15 10283 1 1 7 VAL HG23 H -6.741 -11.767 4.887 1.00 . A A . 11 VAL HG23 1 1 15 10284 1 1 7 VAL N N -4.527 -10.817 4.872 1.00 . A A . 11 VAL N 1 1 15 10285 1 1 7 VAL O O -3.837 -8.295 3.905 1.00 . A A . 11 VAL O 1 1 15 10286 1 1 8 PRO C C -3.966 -6.644 1.277 1.00 . A A . 12 PRO C 1 1 15 10287 1 1 8 PRO CA C -3.088 -7.901 1.285 1.00 . A A . 12 PRO CA 1 1 15 10288 1 1 8 PRO CB C -2.728 -8.328 -0.137 1.00 . A A . 12 PRO CB 1 1 15 10289 1 1 8 PRO CD C -4.197 -10.018 0.751 1.00 . A A . 12 PRO CD 1 1 15 10290 1 1 8 PRO CG C -3.777 -9.319 -0.516 1.00 . A A . 12 PRO CG 1 1 15 10291 1 1 8 PRO HA H -2.192 -7.740 1.863 1.00 . A A . 12 PRO HA 1 1 15 10292 1 1 8 PRO HB2 H -2.754 -7.485 -0.808 1.00 . A A . 12 PRO HB2 1 1 15 10293 1 1 8 PRO HB3 H -1.752 -8.790 -0.154 1.00 . A A . 12 PRO HB3 1 1 15 10294 1 1 8 PRO HD2 H -5.259 -10.214 0.742 1.00 . A A . 12 PRO HD2 1 1 15 10295 1 1 8 PRO HD3 H -3.642 -10.936 0.878 1.00 . A A . 12 PRO HD3 1 1 15 10296 1 1 8 PRO HG2 H -4.622 -8.806 -0.952 1.00 . A A . 12 PRO HG2 1 1 15 10297 1 1 8 PRO HG3 H -3.373 -10.031 -1.218 1.00 . A A . 12 PRO HG3 1 1 15 10298 1 1 8 PRO N N -3.856 -9.058 1.811 1.00 . A A . 12 PRO N 1 1 15 10299 1 1 8 PRO O O -4.951 -6.561 1.984 1.00 . A A . 12 PRO O 1 1 15 10300 1 1 9 LEU C C -5.876 -4.748 0.021 1.00 . A A . 13 LEU C 1 1 15 10301 1 1 9 LEU CA C -4.434 -4.419 0.440 1.00 . A A . 13 LEU CA 1 1 15 10302 1 1 9 LEU CB C -3.750 -3.542 -0.611 1.00 . A A . 13 LEU CB 1 1 15 10303 1 1 9 LEU CD1 C -1.308 -4.012 -0.886 1.00 . A A . 13 LEU CD1 1 1 15 10304 1 1 9 LEU CD2 C -2.084 -1.691 -0.388 1.00 . A A . 13 LEU CD2 1 1 15 10305 1 1 9 LEU CG C -2.343 -3.176 -0.129 1.00 . A A . 13 LEU CG 1 1 15 10306 1 1 9 LEU H H -2.820 -5.750 -0.075 1.00 . A A . 13 LEU H 1 1 15 10307 1 1 9 LEU HA H -4.419 -3.926 1.398 1.00 . A A . 13 LEU HA 1 1 15 10308 1 1 9 LEU HB2 H -3.682 -4.084 -1.544 1.00 . A A . 13 LEU HB2 1 1 15 10309 1 1 9 LEU HB3 H -4.326 -2.641 -0.758 1.00 . A A . 13 LEU HB3 1 1 15 10310 1 1 9 LEU HD11 H -0.766 -4.632 -0.187 1.00 . A A . 13 LEU HD11 1 1 15 10311 1 1 9 LEU HD12 H -0.616 -3.355 -1.392 1.00 . A A . 13 LEU HD12 1 1 15 10312 1 1 9 LEU HD13 H -1.808 -4.637 -1.610 1.00 . A A . 13 LEU HD13 1 1 15 10313 1 1 9 LEU HD21 H -2.736 -1.098 0.237 1.00 . A A . 13 LEU HD21 1 1 15 10314 1 1 9 LEU HD22 H -2.279 -1.466 -1.426 1.00 . A A . 13 LEU HD22 1 1 15 10315 1 1 9 LEU HD23 H -1.055 -1.460 -0.155 1.00 . A A . 13 LEU HD23 1 1 15 10316 1 1 9 LEU HG H -2.263 -3.377 0.929 1.00 . A A . 13 LEU HG 1 1 15 10317 1 1 9 LEU N N -3.618 -5.666 0.486 1.00 . A A . 13 LEU N 1 1 15 10318 1 1 9 LEU O O -6.092 -5.580 -0.837 1.00 . A A . 13 LEU O 1 1 15 10319 1 1 10 PRO C C -8.618 -3.724 -1.032 1.00 . A A . 14 PRO C 1 1 15 10320 1 1 10 PRO CA C -8.254 -4.332 0.328 1.00 . A A . 14 PRO CA 1 1 15 10321 1 1 10 PRO CB C -9.001 -3.626 1.456 1.00 . A A . 14 PRO CB 1 1 15 10322 1 1 10 PRO CD C -6.661 -3.067 1.695 1.00 . A A . 14 PRO CD 1 1 15 10323 1 1 10 PRO CG C -8.062 -2.567 1.941 1.00 . A A . 14 PRO CG 1 1 15 10324 1 1 10 PRO HA H -8.473 -5.387 0.344 1.00 . A A . 14 PRO HA 1 1 15 10325 1 1 10 PRO HB2 H -9.910 -3.177 1.082 1.00 . A A . 14 PRO HB2 1 1 15 10326 1 1 10 PRO HB3 H -9.224 -4.323 2.250 1.00 . A A . 14 PRO HB3 1 1 15 10327 1 1 10 PRO HD2 H -6.028 -2.265 1.346 1.00 . A A . 14 PRO HD2 1 1 15 10328 1 1 10 PRO HD3 H -6.252 -3.509 2.592 1.00 . A A . 14 PRO HD3 1 1 15 10329 1 1 10 PRO HG2 H -8.227 -1.649 1.397 1.00 . A A . 14 PRO HG2 1 1 15 10330 1 1 10 PRO HG3 H -8.212 -2.400 2.999 1.00 . A A . 14 PRO HG3 1 1 15 10331 1 1 10 PRO N N -6.823 -4.088 0.647 1.00 . A A . 14 PRO N 1 1 15 10332 1 1 10 PRO O O -7.760 -3.412 -1.833 1.00 . A A . 14 PRO O 1 1 15 10333 1 1 11 ALA C C -10.046 -1.463 -2.620 1.00 . A A . 15 ALA C 1 1 15 10334 1 1 11 ALA CA C -10.309 -2.971 -2.602 1.00 . A A . 15 ALA CA 1 1 15 10335 1 1 11 ALA CB C -11.808 -3.254 -2.695 1.00 . A A . 15 ALA CB 1 1 15 10336 1 1 11 ALA H H -10.562 -3.816 -0.634 1.00 . A A . 15 ALA H 1 1 15 10337 1 1 11 ALA HA H -9.792 -3.455 -3.416 1.00 . A A . 15 ALA HA 1 1 15 10338 1 1 11 ALA HB1 H -12.231 -2.691 -3.515 1.00 . A A . 15 ALA HB1 1 1 15 10339 1 1 11 ALA HB2 H -12.288 -2.963 -1.772 1.00 . A A . 15 ALA HB2 1 1 15 10340 1 1 11 ALA HB3 H -11.966 -4.309 -2.864 1.00 . A A . 15 ALA HB3 1 1 15 10341 1 1 11 ALA N N -9.886 -3.555 -1.295 1.00 . A A . 15 ALA N 1 1 15 10342 1 1 11 ALA O O -9.681 -0.874 -1.624 1.00 . A A . 15 ALA O 1 1 15 10343 1 1 12 GLY C C -8.497 0.929 -3.589 1.00 . A A . 16 GLY C 1 1 15 10344 1 1 12 GLY CA C -9.981 0.635 -3.834 1.00 . A A . 16 GLY CA 1 1 15 10345 1 1 12 GLY H H -10.519 -1.327 -4.545 1.00 . A A . 16 GLY H 1 1 15 10346 1 1 12 GLY HA2 H -10.262 0.991 -4.814 1.00 . A A . 16 GLY HA2 1 1 15 10347 1 1 12 GLY HA3 H -10.575 1.141 -3.084 1.00 . A A . 16 GLY HA3 1 1 15 10348 1 1 12 GLY N N -10.225 -0.833 -3.750 1.00 . A A . 16 GLY N 1 1 15 10349 1 1 12 GLY O O -8.112 2.057 -3.350 1.00 . A A . 16 GLY O 1 1 15 10350 1 1 13 TRP C C -5.400 -0.090 -4.676 1.00 . A A . 17 TRP C 1 1 15 10351 1 1 13 TRP CA C -6.206 0.157 -3.400 1.00 . A A . 17 TRP CA 1 1 15 10352 1 1 13 TRP CB C -5.831 -0.865 -2.334 1.00 . A A . 17 TRP CB 1 1 15 10353 1 1 13 TRP CD1 C -6.973 -0.268 -0.168 1.00 . A A . 17 TRP CD1 1 1 15 10354 1 1 13 TRP CD2 C -4.901 0.582 -0.328 1.00 . A A . 17 TRP CD2 1 1 15 10355 1 1 13 TRP CE2 C -5.409 0.994 0.926 1.00 . A A . 17 TRP CE2 1 1 15 10356 1 1 13 TRP CE3 C -3.606 0.983 -0.687 1.00 . A A . 17 TRP CE3 1 1 15 10357 1 1 13 TRP CG C -5.908 -0.218 -0.997 1.00 . A A . 17 TRP CG 1 1 15 10358 1 1 13 TRP CH2 C -3.360 2.171 1.417 1.00 . A A . 17 TRP CH2 1 1 15 10359 1 1 13 TRP CZ2 C -4.650 1.779 1.794 1.00 . A A . 17 TRP CZ2 1 1 15 10360 1 1 13 TRP CZ3 C -2.843 1.772 0.180 1.00 . A A . 17 TRP CZ3 1 1 15 10361 1 1 13 TRP H H -7.982 -0.977 -3.824 1.00 . A A . 17 TRP H 1 1 15 10362 1 1 13 TRP HA H -6.035 1.155 -3.030 1.00 . A A . 17 TRP HA 1 1 15 10363 1 1 13 TRP HB2 H -6.518 -1.698 -2.374 1.00 . A A . 17 TRP HB2 1 1 15 10364 1 1 13 TRP HB3 H -4.825 -1.217 -2.508 1.00 . A A . 17 TRP HB3 1 1 15 10365 1 1 13 TRP HD1 H -7.900 -0.787 -0.368 1.00 . A A . 17 TRP HD1 1 1 15 10366 1 1 13 TRP HE1 H -7.285 0.571 1.742 1.00 . A A . 17 TRP HE1 1 1 15 10367 1 1 13 TRP HE3 H -3.196 0.682 -1.640 1.00 . A A . 17 TRP HE3 1 1 15 10368 1 1 13 TRP HH2 H -2.760 2.778 2.078 1.00 . A A . 17 TRP HH2 1 1 15 10369 1 1 13 TRP HZ2 H -5.054 2.083 2.748 1.00 . A A . 17 TRP HZ2 1 1 15 10370 1 1 13 TRP HZ3 H -1.853 2.077 -0.109 1.00 . A A . 17 TRP HZ3 1 1 15 10371 1 1 13 TRP N N -7.658 -0.073 -3.639 1.00 . A A . 17 TRP N 1 1 15 10372 1 1 13 TRP NE1 N -6.680 0.450 0.979 1.00 . A A . 17 TRP NE1 1 1 15 10373 1 1 13 TRP O O -5.741 -0.936 -5.480 1.00 . A A . 17 TRP O 1 1 15 10374 1 1 14 GLU C C -2.023 0.413 -5.786 1.00 . A A . 18 GLU C 1 1 15 10375 1 1 14 GLU CA C -3.519 0.429 -6.104 1.00 . A A . 18 GLU CA 1 1 15 10376 1 1 14 GLU CB C -3.834 1.621 -7.008 1.00 . A A . 18 GLU CB 1 1 15 10377 1 1 14 GLU CD C -6.154 0.917 -7.618 1.00 . A A . 18 GLU CD 1 1 15 10378 1 1 14 GLU CG C -4.742 1.169 -8.153 1.00 . A A . 18 GLU CG 1 1 15 10379 1 1 14 GLU H H -4.072 1.321 -4.216 1.00 . A A . 18 GLU H 1 1 15 10380 1 1 14 GLU HA H -3.808 -0.486 -6.595 1.00 . A A . 18 GLU HA 1 1 15 10381 1 1 14 GLU HB2 H -4.328 2.389 -6.435 1.00 . A A . 18 GLU HB2 1 1 15 10382 1 1 14 GLU HB3 H -2.915 2.014 -7.415 1.00 . A A . 18 GLU HB3 1 1 15 10383 1 1 14 GLU HG2 H -4.776 1.940 -8.910 1.00 . A A . 18 GLU HG2 1 1 15 10384 1 1 14 GLU HG3 H -4.351 0.259 -8.583 1.00 . A A . 18 GLU HG3 1 1 15 10385 1 1 14 GLU N N -4.334 0.640 -4.874 1.00 . A A . 18 GLU N 1 1 15 10386 1 1 14 GLU O O -1.377 1.447 -5.771 1.00 . A A . 18 GLU O 1 1 15 10387 1 1 14 GLU OE1 O -6.703 1.817 -7.006 1.00 . A A . 18 GLU OE1 1 1 15 10388 1 1 14 GLU OE2 O -6.660 -0.172 -7.832 1.00 . A A . 18 GLU OE2 1 1 15 10389 1 1 15 MET C C 0.737 -0.384 -6.571 1.00 . A A . 19 MET C 1 1 15 10390 1 1 15 MET CA C 0.009 -0.781 -5.296 1.00 . A A . 19 MET CA 1 1 15 10391 1 1 15 MET CB C 0.363 -2.216 -4.914 1.00 . A A . 19 MET CB 1 1 15 10392 1 1 15 MET CE C -1.937 -4.029 -4.179 1.00 . A A . 19 MET CE 1 1 15 10393 1 1 15 MET CG C -0.097 -3.192 -6.004 1.00 . A A . 19 MET CG 1 1 15 10394 1 1 15 MET H H -1.966 -1.570 -5.591 1.00 . A A . 19 MET H 1 1 15 10395 1 1 15 MET HA H 0.263 -0.107 -4.491 1.00 . A A . 19 MET HA 1 1 15 10396 1 1 15 MET HB2 H 1.428 -2.286 -4.814 1.00 . A A . 19 MET HB2 1 1 15 10397 1 1 15 MET HB3 H -0.095 -2.469 -3.971 1.00 . A A . 19 MET HB3 1 1 15 10398 1 1 15 MET HE1 H -2.441 -3.233 -4.705 1.00 . A A . 19 MET HE1 1 1 15 10399 1 1 15 MET HE2 H -1.486 -3.635 -3.284 1.00 . A A . 19 MET HE2 1 1 15 10400 1 1 15 MET HE3 H -2.648 -4.798 -3.912 1.00 . A A . 19 MET HE3 1 1 15 10401 1 1 15 MET HG2 H -0.904 -2.757 -6.571 1.00 . A A . 19 MET HG2 1 1 15 10402 1 1 15 MET HG3 H 0.730 -3.401 -6.667 1.00 . A A . 19 MET HG3 1 1 15 10403 1 1 15 MET N N -1.449 -0.743 -5.563 1.00 . A A . 19 MET N 1 1 15 10404 1 1 15 MET O O 0.558 -0.979 -7.615 1.00 . A A . 19 MET O 1 1 15 10405 1 1 15 MET SD S -0.656 -4.738 -5.243 1.00 . A A . 19 MET SD 1 1 15 10406 1 1 16 ALA C C 3.575 1.740 -7.220 1.00 . A A . 20 ALA C 1 1 15 10407 1 1 16 ALA CA C 2.287 1.071 -7.696 1.00 . A A . 20 ALA CA 1 1 15 10408 1 1 16 ALA CB C 1.329 2.050 -8.388 1.00 . A A . 20 ALA CB 1 1 15 10409 1 1 16 ALA H H 1.673 1.080 -5.640 1.00 . A A . 20 ALA H 1 1 15 10410 1 1 16 ALA HA H 2.509 0.237 -8.345 1.00 . A A . 20 ALA HA 1 1 15 10411 1 1 16 ALA HB1 H 1.856 2.948 -8.663 1.00 . A A . 20 ALA HB1 1 1 15 10412 1 1 16 ALA HB2 H 0.523 2.300 -7.711 1.00 . A A . 20 ALA HB2 1 1 15 10413 1 1 16 ALA HB3 H 0.920 1.585 -9.274 1.00 . A A . 20 ALA HB3 1 1 15 10414 1 1 16 ALA N N 1.548 0.617 -6.496 1.00 . A A . 20 ALA N 1 1 15 10415 1 1 16 ALA O O 4.077 1.396 -6.171 1.00 . A A . 20 ALA O 1 1 15 10416 1 1 17 LYS C C 5.279 4.815 -7.403 1.00 . A A . 21 LYS C 1 1 15 10417 1 1 17 LYS CA C 5.386 3.301 -7.455 1.00 . A A . 21 LYS CA 1 1 15 10418 1 1 17 LYS CB C 6.477 2.857 -8.433 1.00 . A A . 21 LYS CB 1 1 15 10419 1 1 17 LYS CD C 7.038 2.716 -10.864 1.00 . A A . 21 LYS CD 1 1 15 10420 1 1 17 LYS CE C 8.524 2.849 -10.526 1.00 . A A . 21 LYS CE 1 1 15 10421 1 1 17 LYS CG C 6.207 3.458 -9.814 1.00 . A A . 21 LYS CG 1 1 15 10422 1 1 17 LYS H H 3.732 2.949 -8.799 1.00 . A A . 21 LYS H 1 1 15 10423 1 1 17 LYS HA H 5.602 2.932 -6.471 1.00 . A A . 21 LYS HA 1 1 15 10424 1 1 17 LYS HB2 H 7.438 3.194 -8.075 1.00 . A A . 21 LYS HB2 1 1 15 10425 1 1 17 LYS HB3 H 6.478 1.779 -8.504 1.00 . A A . 21 LYS HB3 1 1 15 10426 1 1 17 LYS HD2 H 6.762 1.673 -10.869 1.00 . A A . 21 LYS HD2 1 1 15 10427 1 1 17 LYS HD3 H 6.851 3.145 -11.838 1.00 . A A . 21 LYS HD3 1 1 15 10428 1 1 17 LYS HE2 H 8.808 3.890 -10.484 1.00 . A A . 21 LYS HE2 1 1 15 10429 1 1 17 LYS HE3 H 8.740 2.362 -9.586 1.00 . A A . 21 LYS HE3 1 1 15 10430 1 1 17 LYS HG2 H 5.159 3.362 -10.051 1.00 . A A . 21 LYS HG2 1 1 15 10431 1 1 17 LYS HG3 H 6.480 4.503 -9.812 1.00 . A A . 21 LYS HG3 1 1 15 10432 1 1 17 LYS HZ1 H 9.052 1.139 -11.590 1.00 . A A . 21 LYS HZ1 1 1 15 10433 1 1 17 LYS HZ2 H 10.255 2.339 -11.564 1.00 . A A . 21 LYS HZ2 1 1 15 10434 1 1 17 LYS HZ3 H 8.885 2.526 -12.550 1.00 . A A . 21 LYS HZ3 1 1 15 10435 1 1 17 LYS N N 4.128 2.672 -7.948 1.00 . A A . 21 LYS N 1 1 15 10436 1 1 17 LYS NZ N 9.232 2.162 -11.642 1.00 . A A . 21 LYS NZ 1 1 15 10437 1 1 17 LYS O O 4.432 5.420 -8.031 1.00 . A A . 21 LYS O 1 1 15 10438 1 1 18 THR C C 7.444 7.544 -6.835 1.00 . A A . 22 THR C 1 1 15 10439 1 1 18 THR CA C 6.085 6.919 -6.517 1.00 . A A . 22 THR CA 1 1 15 10440 1 1 18 THR CB C 5.676 7.226 -5.066 1.00 . A A . 22 THR CB 1 1 15 10441 1 1 18 THR CG2 C 6.396 6.293 -4.076 1.00 . A A . 22 THR CG2 1 1 15 10442 1 1 18 THR H H 6.807 4.908 -6.128 1.00 . A A . 22 THR H 1 1 15 10443 1 1 18 THR HA H 5.338 7.313 -7.190 1.00 . A A . 22 THR HA 1 1 15 10444 1 1 18 THR HB H 4.611 7.095 -4.967 1.00 . A A . 22 THR HB 1 1 15 10445 1 1 18 THR HG1 H 6.951 8.610 -4.569 1.00 . A A . 22 THR HG1 1 1 15 10446 1 1 18 THR HG21 H 6.207 5.263 -4.343 1.00 . A A . 22 THR HG21 1 1 15 10447 1 1 18 THR HG22 H 6.029 6.476 -3.077 1.00 . A A . 22 THR HG22 1 1 15 10448 1 1 18 THR HG23 H 7.459 6.483 -4.107 1.00 . A A . 22 THR HG23 1 1 15 10449 1 1 18 THR N N 6.135 5.431 -6.636 1.00 . A A . 22 THR N 1 1 15 10450 1 1 18 THR O O 8.404 6.862 -7.137 1.00 . A A . 22 THR O 1 1 15 10451 1 1 18 THR OG1 O 6.012 8.574 -4.767 1.00 . A A . 22 THR OG1 1 1 15 10452 1 1 19 SER C C 9.835 9.261 -5.979 1.00 . A A . 23 SER C 1 1 15 10453 1 1 19 SER CA C 8.807 9.541 -7.075 1.00 . A A . 23 SER CA 1 1 15 10454 1 1 19 SER CB C 8.451 11.028 -7.109 1.00 . A A . 23 SER CB 1 1 15 10455 1 1 19 SER H H 6.727 9.366 -6.529 1.00 . A A . 23 SER H 1 1 15 10456 1 1 19 SER HA H 9.185 9.232 -8.036 1.00 . A A . 23 SER HA 1 1 15 10457 1 1 19 SER HB2 H 8.129 11.344 -6.128 1.00 . A A . 23 SER HB2 1 1 15 10458 1 1 19 SER HB3 H 9.320 11.599 -7.404 1.00 . A A . 23 SER HB3 1 1 15 10459 1 1 19 SER HG H 7.224 12.185 -8.076 1.00 . A A . 23 SER HG 1 1 15 10460 1 1 19 SER N N 7.522 8.844 -6.773 1.00 . A A . 23 SER N 1 1 15 10461 1 1 19 SER O O 9.943 9.988 -5.011 1.00 . A A . 23 SER O 1 1 15 10462 1 1 19 SER OG O 7.404 11.243 -8.043 1.00 . A A . 23 SER OG 1 1 15 10463 1 1 20 SER C C 12.362 6.592 -5.494 1.00 . A A . 24 SER C 1 1 15 10464 1 1 20 SER CA C 11.633 7.875 -5.101 1.00 . A A . 24 SER CA 1 1 15 10465 1 1 20 SER CB C 10.863 7.669 -3.793 1.00 . A A . 24 SER CB 1 1 15 10466 1 1 20 SER H H 10.496 7.645 -6.921 1.00 . A A . 24 SER H 1 1 15 10467 1 1 20 SER HA H 12.331 8.684 -4.996 1.00 . A A . 24 SER HA 1 1 15 10468 1 1 20 SER HB2 H 9.828 7.459 -4.014 1.00 . A A . 24 SER HB2 1 1 15 10469 1 1 20 SER HB3 H 11.291 6.838 -3.251 1.00 . A A . 24 SER HB3 1 1 15 10470 1 1 20 SER HG H 10.408 9.521 -3.415 1.00 . A A . 24 SER HG 1 1 15 10471 1 1 20 SER N N 10.599 8.212 -6.128 1.00 . A A . 24 SER N 1 1 15 10472 1 1 20 SER O O 13.538 6.424 -5.236 1.00 . A A . 24 SER O 1 1 15 10473 1 1 20 SER OG O 10.950 8.845 -3.002 1.00 . A A . 24 SER OG 1 1 15 10474 1 1 21 GLY C C 11.729 3.269 -5.671 1.00 . A A . 25 GLY C 1 1 15 10475 1 1 21 GLY CA C 12.302 4.402 -6.521 1.00 . A A . 25 GLY CA 1 1 15 10476 1 1 21 GLY H H 10.722 5.844 -6.299 1.00 . A A . 25 GLY H 1 1 15 10477 1 1 21 GLY HA2 H 12.093 4.213 -7.565 1.00 . A A . 25 GLY HA2 1 1 15 10478 1 1 21 GLY HA3 H 13.369 4.463 -6.371 1.00 . A A . 25 GLY HA3 1 1 15 10479 1 1 21 GLY N N 11.667 5.683 -6.109 1.00 . A A . 25 GLY N 1 1 15 10480 1 1 21 GLY O O 12.365 2.256 -5.455 1.00 . A A . 25 GLY O 1 1 15 10481 1 1 22 GLN C C 8.432 2.204 -4.677 1.00 . A A . 26 GLN C 1 1 15 10482 1 1 22 GLN CA C 9.917 2.370 -4.338 1.00 . A A . 26 GLN CA 1 1 15 10483 1 1 22 GLN CB C 10.086 2.858 -2.900 1.00 . A A . 26 GLN CB 1 1 15 10484 1 1 22 GLN CD C 11.721 2.129 -1.157 1.00 . A A . 26 GLN CD 1 1 15 10485 1 1 22 GLN CG C 11.567 2.813 -2.518 1.00 . A A . 26 GLN CG 1 1 15 10486 1 1 22 GLN H H 10.035 4.260 -5.364 1.00 . A A . 26 GLN H 1 1 15 10487 1 1 22 GLN HA H 10.440 1.436 -4.474 1.00 . A A . 26 GLN HA 1 1 15 10488 1 1 22 GLN HB2 H 9.725 3.872 -2.819 1.00 . A A . 26 GLN HB2 1 1 15 10489 1 1 22 GLN HB3 H 9.523 2.220 -2.235 1.00 . A A . 26 GLN HB3 1 1 15 10490 1 1 22 GLN HE21 H 13.048 0.807 -1.816 1.00 . A A . 26 GLN HE21 1 1 15 10491 1 1 22 GLN HE22 H 12.646 0.675 -0.171 1.00 . A A . 26 GLN HE22 1 1 15 10492 1 1 22 GLN HG2 H 12.116 2.258 -3.264 1.00 . A A . 26 GLN HG2 1 1 15 10493 1 1 22 GLN HG3 H 11.955 3.820 -2.461 1.00 . A A . 26 GLN HG3 1 1 15 10494 1 1 22 GLN N N 10.531 3.434 -5.180 1.00 . A A . 26 GLN N 1 1 15 10495 1 1 22 GLN NE2 N 12.540 1.120 -1.038 1.00 . A A . 26 GLN NE2 1 1 15 10496 1 1 22 GLN O O 7.789 3.111 -5.196 1.00 . A A . 26 GLN O 1 1 15 10497 1 1 22 GLN OE1 O 11.091 2.517 -0.194 1.00 . A A . 26 GLN OE1 1 1 15 10498 1 1 23 ARG C C 5.575 1.359 -3.564 1.00 . A A . 27 ARG C 1 1 15 10499 1 1 23 ARG CA C 6.445 0.820 -4.683 1.00 . A A . 27 ARG CA 1 1 15 10500 1 1 23 ARG CB C 6.249 -0.693 -4.781 1.00 . A A . 27 ARG CB 1 1 15 10501 1 1 23 ARG CD C 7.298 -1.286 -6.970 1.00 . A A . 27 ARG CD 1 1 15 10502 1 1 23 ARG CG C 5.973 -1.059 -6.238 1.00 . A A . 27 ARG CG 1 1 15 10503 1 1 23 ARG CZ C 8.610 -3.301 -7.393 1.00 . A A . 27 ARG CZ 1 1 15 10504 1 1 23 ARG H H 8.417 0.343 -3.969 1.00 . A A . 27 ARG H 1 1 15 10505 1 1 23 ARG HA H 6.180 1.284 -5.620 1.00 . A A . 27 ARG HA 1 1 15 10506 1 1 23 ARG HB2 H 7.133 -1.204 -4.433 1.00 . A A . 27 ARG HB2 1 1 15 10507 1 1 23 ARG HB3 H 5.403 -0.988 -4.172 1.00 . A A . 27 ARG HB3 1 1 15 10508 1 1 23 ARG HD2 H 7.192 -1.054 -8.019 1.00 . A A . 27 ARG HD2 1 1 15 10509 1 1 23 ARG HD3 H 8.079 -0.684 -6.528 1.00 . A A . 27 ARG HD3 1 1 15 10510 1 1 23 ARG HE H 7.017 -3.277 -6.203 1.00 . A A . 27 ARG HE 1 1 15 10511 1 1 23 ARG HG2 H 5.378 -1.959 -6.279 1.00 . A A . 27 ARG HG2 1 1 15 10512 1 1 23 ARG HG3 H 5.434 -0.245 -6.708 1.00 . A A . 27 ARG HG3 1 1 15 10513 1 1 23 ARG HH11 H 9.233 -1.634 -8.326 1.00 . A A . 27 ARG HH11 1 1 15 10514 1 1 23 ARG HH12 H 10.168 -3.056 -8.632 1.00 . A A . 27 ARG HH12 1 1 15 10515 1 1 23 ARG HH21 H 8.247 -5.109 -6.615 1.00 . A A . 27 ARG HH21 1 1 15 10516 1 1 23 ARG HH22 H 9.615 -5.010 -7.671 1.00 . A A . 27 ARG HH22 1 1 15 10517 1 1 23 ARG N N 7.882 1.050 -4.385 1.00 . A A . 27 ARG N 1 1 15 10518 1 1 23 ARG NE N 7.593 -2.738 -6.785 1.00 . A A . 27 ARG NE 1 1 15 10519 1 1 23 ARG NH1 N 9.398 -2.608 -8.178 1.00 . A A . 27 ARG NH1 1 1 15 10520 1 1 23 ARG NH2 N 8.843 -4.573 -7.212 1.00 . A A . 27 ARG NH2 1 1 15 10521 1 1 23 ARG O O 5.643 0.909 -2.437 1.00 . A A . 27 ARG O 1 1 15 10522 1 1 24 TYR C C 2.446 2.234 -3.046 1.00 . A A . 28 TYR C 1 1 15 10523 1 1 24 TYR CA C 3.823 2.817 -2.831 1.00 . A A . 28 TYR CA 1 1 15 10524 1 1 24 TYR CB C 3.846 4.355 -2.939 1.00 . A A . 28 TYR CB 1 1 15 10525 1 1 24 TYR CD1 C 2.654 4.110 -5.194 1.00 . A A . 28 TYR CD1 1 1 15 10526 1 1 24 TYR CD2 C 2.551 6.228 -4.024 1.00 . A A . 28 TYR CD2 1 1 15 10527 1 1 24 TYR CE1 C 1.901 4.652 -6.235 1.00 . A A . 28 TYR CE1 1 1 15 10528 1 1 24 TYR CE2 C 1.791 6.761 -5.065 1.00 . A A . 28 TYR CE2 1 1 15 10529 1 1 24 TYR CG C 2.987 4.896 -4.078 1.00 . A A . 28 TYR CG 1 1 15 10530 1 1 24 TYR CZ C 1.469 5.976 -6.172 1.00 . A A . 28 TYR CZ 1 1 15 10531 1 1 24 TYR H H 4.675 2.605 -4.798 1.00 . A A . 28 TYR H 1 1 15 10532 1 1 24 TYR HA H 4.176 2.514 -1.857 1.00 . A A . 28 TYR HA 1 1 15 10533 1 1 24 TYR HB2 H 3.489 4.771 -2.010 1.00 . A A . 28 TYR HB2 1 1 15 10534 1 1 24 TYR HB3 H 4.866 4.675 -3.091 1.00 . A A . 28 TYR HB3 1 1 15 10535 1 1 24 TYR HD1 H 2.968 3.088 -5.250 1.00 . A A . 28 TYR HD1 1 1 15 10536 1 1 24 TYR HD2 H 2.791 6.841 -3.168 1.00 . A A . 28 TYR HD2 1 1 15 10537 1 1 24 TYR HE1 H 1.650 4.042 -7.086 1.00 . A A . 28 TYR HE1 1 1 15 10538 1 1 24 TYR HE2 H 1.456 7.783 -5.013 1.00 . A A . 28 TYR HE2 1 1 15 10539 1 1 24 TYR HH H 1.154 7.331 -7.477 1.00 . A A . 28 TYR HH 1 1 15 10540 1 1 24 TYR N N 4.730 2.288 -3.875 1.00 . A A . 28 TYR N 1 1 15 10541 1 1 24 TYR O O 2.216 1.482 -3.975 1.00 . A A . 28 TYR O 1 1 15 10542 1 1 24 TYR OH O 0.732 6.512 -7.207 1.00 . A A . 28 TYR OH 1 1 15 10543 1 1 25 PHE C C -0.819 3.115 -2.392 1.00 . A A . 29 PHE C 1 1 15 10544 1 1 25 PHE CA C 0.190 1.987 -2.343 1.00 . A A . 29 PHE CA 1 1 15 10545 1 1 25 PHE CB C 0.051 1.055 -1.147 1.00 . A A . 29 PHE CB 1 1 15 10546 1 1 25 PHE CD1 C 2.403 0.101 -1.098 1.00 . A A . 29 PHE CD1 1 1 15 10547 1 1 25 PHE CD2 C 0.591 -1.264 -1.943 1.00 . A A . 29 PHE CD2 1 1 15 10548 1 1 25 PHE CE1 C 3.306 -0.934 -1.375 1.00 . A A . 29 PHE CE1 1 1 15 10549 1 1 25 PHE CE2 C 1.495 -2.293 -2.224 1.00 . A A . 29 PHE CE2 1 1 15 10550 1 1 25 PHE CG C 1.037 -0.069 -1.382 1.00 . A A . 29 PHE CG 1 1 15 10551 1 1 25 PHE CZ C 2.851 -2.130 -1.941 1.00 . A A . 29 PHE CZ 1 1 15 10552 1 1 25 PHE H H 1.752 3.145 -1.446 1.00 . A A . 29 PHE H 1 1 15 10553 1 1 25 PHE HA H 0.135 1.412 -3.255 1.00 . A A . 29 PHE HA 1 1 15 10554 1 1 25 PHE HB2 H 0.283 1.581 -0.231 1.00 . A A . 29 PHE HB2 1 1 15 10555 1 1 25 PHE HB3 H -0.954 0.661 -1.101 1.00 . A A . 29 PHE HB3 1 1 15 10556 1 1 25 PHE HD1 H 2.762 1.027 -0.664 1.00 . A A . 29 PHE HD1 1 1 15 10557 1 1 25 PHE HD2 H -0.452 -1.391 -2.165 1.00 . A A . 29 PHE HD2 1 1 15 10558 1 1 25 PHE HE1 H 4.355 -0.805 -1.165 1.00 . A A . 29 PHE HE1 1 1 15 10559 1 1 25 PHE HE2 H 1.141 -3.215 -2.668 1.00 . A A . 29 PHE HE2 1 1 15 10560 1 1 25 PHE HZ H 3.545 -2.923 -2.166 1.00 . A A . 29 PHE HZ 1 1 15 10561 1 1 25 PHE N N 1.540 2.548 -2.193 1.00 . A A . 29 PHE N 1 1 15 10562 1 1 25 PHE O O -1.183 3.713 -1.395 1.00 . A A . 29 PHE O 1 1 15 10563 1 1 26 LEU C C -3.564 4.143 -3.262 1.00 . A A . 30 LEU C 1 1 15 10564 1 1 26 LEU CA C -2.189 4.528 -3.810 1.00 . A A . 30 LEU CA 1 1 15 10565 1 1 26 LEU CB C -2.189 4.699 -5.338 1.00 . A A . 30 LEU CB 1 1 15 10566 1 1 26 LEU CD1 C -1.123 6.963 -4.991 1.00 . A A . 30 LEU CD1 1 1 15 10567 1 1 26 LEU CD2 C -1.906 6.275 -7.240 1.00 . A A . 30 LEU CD2 1 1 15 10568 1 1 26 LEU CG C -2.196 6.179 -5.746 1.00 . A A . 30 LEU CG 1 1 15 10569 1 1 26 LEU H H -0.882 2.921 -4.361 1.00 . A A . 30 LEU H 1 1 15 10570 1 1 26 LEU HA H -1.842 5.425 -3.332 1.00 . A A . 30 LEU HA 1 1 15 10571 1 1 26 LEU HB2 H -1.304 4.231 -5.742 1.00 . A A . 30 LEU HB2 1 1 15 10572 1 1 26 LEU HB3 H -3.054 4.218 -5.751 1.00 . A A . 30 LEU HB3 1 1 15 10573 1 1 26 LEU HD11 H -0.510 6.283 -4.418 1.00 . A A . 30 LEU HD11 1 1 15 10574 1 1 26 LEU HD12 H -1.601 7.665 -4.328 1.00 . A A . 30 LEU HD12 1 1 15 10575 1 1 26 LEU HD13 H -0.503 7.501 -5.694 1.00 . A A . 30 LEU HD13 1 1 15 10576 1 1 26 LEU HD21 H -1.301 5.431 -7.540 1.00 . A A . 30 LEU HD21 1 1 15 10577 1 1 26 LEU HD22 H -1.367 7.189 -7.440 1.00 . A A . 30 LEU HD22 1 1 15 10578 1 1 26 LEU HD23 H -2.832 6.271 -7.789 1.00 . A A . 30 LEU HD23 1 1 15 10579 1 1 26 LEU HG H -3.164 6.604 -5.540 1.00 . A A . 30 LEU HG 1 1 15 10580 1 1 26 LEU N N -1.231 3.422 -3.588 1.00 . A A . 30 LEU N 1 1 15 10581 1 1 26 LEU O O -4.287 3.349 -3.834 1.00 . A A . 30 LEU O 1 1 15 10582 1 1 27 ASN C C -6.322 5.206 -2.167 1.00 . A A . 31 ASN C 1 1 15 10583 1 1 27 ASN CA C -5.204 4.414 -1.483 1.00 . A A . 31 ASN CA 1 1 15 10584 1 1 27 ASN CB C -4.995 4.885 -0.034 1.00 . A A . 31 ASN CB 1 1 15 10585 1 1 27 ASN CG C -6.318 4.932 0.730 1.00 . A A . 31 ASN CG 1 1 15 10586 1 1 27 ASN H H -3.279 5.330 -1.708 1.00 . A A . 31 ASN H 1 1 15 10587 1 1 27 ASN HA H -5.414 3.358 -1.504 1.00 . A A . 31 ASN HA 1 1 15 10588 1 1 27 ASN HB2 H -4.329 4.201 0.468 1.00 . A A . 31 ASN HB2 1 1 15 10589 1 1 27 ASN HB3 H -4.553 5.871 -0.041 1.00 . A A . 31 ASN HB3 1 1 15 10590 1 1 27 ASN HD21 H -5.592 3.950 2.292 1.00 . A A . 31 ASN HD21 1 1 15 10591 1 1 27 ASN HD22 H -7.220 4.400 2.411 1.00 . A A . 31 ASN HD22 1 1 15 10592 1 1 27 ASN N N -3.901 4.706 -2.136 1.00 . A A . 31 ASN N 1 1 15 10593 1 1 27 ASN ND2 N -6.383 4.381 1.910 1.00 . A A . 31 ASN ND2 1 1 15 10594 1 1 27 ASN O O -6.371 6.418 -2.094 1.00 . A A . 31 ASN O 1 1 15 10595 1 1 27 ASN OD1 O -7.290 5.487 0.266 1.00 . A A . 31 ASN OD1 1 1 15 10596 1 1 28 HIS C C -9.520 5.377 -2.515 1.00 . A A . 32 HIS C 1 1 15 10597 1 1 28 HIS CA C -8.349 5.242 -3.489 1.00 . A A . 32 HIS CA 1 1 15 10598 1 1 28 HIS CB C -8.732 4.360 -4.678 1.00 . A A . 32 HIS CB 1 1 15 10599 1 1 28 HIS CD2 C -8.205 5.286 -7.081 1.00 . A A . 32 HIS CD2 1 1 15 10600 1 1 28 HIS CE1 C -9.796 6.751 -7.210 1.00 . A A . 32 HIS CE1 1 1 15 10601 1 1 28 HIS CG C -8.905 5.218 -5.901 1.00 . A A . 32 HIS CG 1 1 15 10602 1 1 28 HIS H H -7.177 3.550 -2.855 1.00 . A A . 32 HIS H 1 1 15 10603 1 1 28 HIS HA H -8.029 6.210 -3.828 1.00 . A A . 32 HIS HA 1 1 15 10604 1 1 28 HIS HB2 H -7.952 3.636 -4.854 1.00 . A A . 32 HIS HB2 1 1 15 10605 1 1 28 HIS HB3 H -9.659 3.848 -4.464 1.00 . A A . 32 HIS HB3 1 1 15 10606 1 1 28 HIS HD1 H -10.593 6.362 -5.328 1.00 . A A . 32 HIS HD1 1 1 15 10607 1 1 28 HIS HD2 H -7.347 4.680 -7.331 1.00 . A A . 32 HIS HD2 1 1 15 10608 1 1 28 HIS HE1 H -10.451 7.531 -7.571 1.00 . A A . 32 HIS HE1 1 1 15 10609 1 1 28 HIS N N -7.229 4.528 -2.817 1.00 . A A . 32 HIS N 1 1 15 10610 1 1 28 HIS ND1 N -9.915 6.161 -6.006 1.00 . A A . 32 HIS ND1 1 1 15 10611 1 1 28 HIS NE2 N -8.769 6.254 -7.906 1.00 . A A . 32 HIS NE2 1 1 15 10612 1 1 28 HIS O O -10.307 6.300 -2.591 1.00 . A A . 32 HIS O 1 1 15 10613 1 1 29 ILE C C -10.768 5.889 0.077 1.00 . A A . 33 ILE C 1 1 15 10614 1 1 29 ILE CA C -10.737 4.517 -0.603 1.00 . A A . 33 ILE CA 1 1 15 10615 1 1 29 ILE CB C -10.428 3.413 0.415 1.00 . A A . 33 ILE CB 1 1 15 10616 1 1 29 ILE CD1 C -8.744 2.478 2.003 1.00 . A A . 33 ILE CD1 1 1 15 10617 1 1 29 ILE CG1 C -9.021 3.590 0.992 1.00 . A A . 33 ILE CG1 1 1 15 10618 1 1 29 ILE CG2 C -10.528 2.048 -0.267 1.00 . A A . 33 ILE CG2 1 1 15 10619 1 1 29 ILE H H -8.977 3.732 -1.566 1.00 . A A . 33 ILE H 1 1 15 10620 1 1 29 ILE HA H -11.682 4.317 -1.083 1.00 . A A . 33 ILE HA 1 1 15 10621 1 1 29 ILE HB H -11.143 3.463 1.217 1.00 . A A . 33 ILE HB 1 1 15 10622 1 1 29 ILE HD11 H -9.017 1.524 1.573 1.00 . A A . 33 ILE HD11 1 1 15 10623 1 1 29 ILE HD12 H -9.328 2.649 2.896 1.00 . A A . 33 ILE HD12 1 1 15 10624 1 1 29 ILE HD13 H -7.696 2.472 2.256 1.00 . A A . 33 ILE HD13 1 1 15 10625 1 1 29 ILE HG12 H -8.290 3.544 0.200 1.00 . A A . 33 ILE HG12 1 1 15 10626 1 1 29 ILE HG13 H -8.952 4.542 1.491 1.00 . A A . 33 ILE HG13 1 1 15 10627 1 1 29 ILE HG21 H -10.338 1.269 0.457 1.00 . A A . 33 ILE HG21 1 1 15 10628 1 1 29 ILE HG22 H -9.797 1.988 -1.060 1.00 . A A . 33 ILE HG22 1 1 15 10629 1 1 29 ILE HG23 H -11.519 1.923 -0.678 1.00 . A A . 33 ILE HG23 1 1 15 10630 1 1 29 ILE N N -9.629 4.459 -1.598 1.00 . A A . 33 ILE N 1 1 15 10631 1 1 29 ILE O O -11.817 6.460 0.306 1.00 . A A . 33 ILE O 1 1 15 10632 1 1 30 ASP C C -8.436 8.596 0.460 1.00 . A A . 34 ASP C 1 1 15 10633 1 1 30 ASP CA C -9.566 7.751 1.062 1.00 . A A . 34 ASP CA 1 1 15 10634 1 1 30 ASP CB C -9.283 7.450 2.534 1.00 . A A . 34 ASP CB 1 1 15 10635 1 1 30 ASP CG C -10.028 8.455 3.414 1.00 . A A . 34 ASP CG 1 1 15 10636 1 1 30 ASP H H -8.797 5.932 0.201 1.00 . A A . 34 ASP H 1 1 15 10637 1 1 30 ASP HA H -10.511 8.262 0.966 1.00 . A A . 34 ASP HA 1 1 15 10638 1 1 30 ASP HB2 H -9.616 6.449 2.766 1.00 . A A . 34 ASP HB2 1 1 15 10639 1 1 30 ASP HB3 H -8.221 7.526 2.718 1.00 . A A . 34 ASP HB3 1 1 15 10640 1 1 30 ASP N N -9.623 6.417 0.397 1.00 . A A . 34 ASP N 1 1 15 10641 1 1 30 ASP O O -7.773 9.340 1.155 1.00 . A A . 34 ASP O 1 1 15 10642 1 1 30 ASP OD1 O -10.059 9.620 3.051 1.00 . A A . 34 ASP OD1 1 1 15 10643 1 1 30 ASP OD2 O -10.553 8.043 4.436 1.00 . A A . 34 ASP OD2 1 1 15 10644 1 1 31 GLN C C -5.900 9.459 -0.677 1.00 . A A . 35 GLN C 1 1 15 10645 1 1 31 GLN CA C -7.154 9.265 -1.545 1.00 . A A . 35 GLN CA 1 1 15 10646 1 1 31 GLN CB C -7.784 10.620 -1.910 1.00 . A A . 35 GLN CB 1 1 15 10647 1 1 31 GLN CD C -8.888 12.681 -1.031 1.00 . A A . 35 GLN CD 1 1 15 10648 1 1 31 GLN CG C -8.464 11.251 -0.691 1.00 . A A . 35 GLN CG 1 1 15 10649 1 1 31 GLN H H -8.796 7.876 -1.354 1.00 . A A . 35 GLN H 1 1 15 10650 1 1 31 GLN HA H -6.883 8.750 -2.453 1.00 . A A . 35 GLN HA 1 1 15 10651 1 1 31 GLN HB2 H -7.013 11.283 -2.269 1.00 . A A . 35 GLN HB2 1 1 15 10652 1 1 31 GLN HB3 H -8.518 10.471 -2.688 1.00 . A A . 35 GLN HB3 1 1 15 10653 1 1 31 GLN HE21 H -7.436 13.516 0.034 1.00 . A A . 35 GLN HE21 1 1 15 10654 1 1 31 GLN HE22 H -8.473 14.602 -0.755 1.00 . A A . 35 GLN HE22 1 1 15 10655 1 1 31 GLN HG2 H -9.336 10.672 -0.424 1.00 . A A . 35 GLN HG2 1 1 15 10656 1 1 31 GLN HG3 H -7.776 11.269 0.140 1.00 . A A . 35 GLN HG3 1 1 15 10657 1 1 31 GLN N N -8.231 8.484 -0.834 1.00 . A A . 35 GLN N 1 1 15 10658 1 1 31 GLN NE2 N -8.209 13.683 -0.542 1.00 . A A . 35 GLN NE2 1 1 15 10659 1 1 31 GLN O O -5.790 10.405 0.074 1.00 . A A . 35 GLN O 1 1 15 10660 1 1 31 GLN OE1 O -9.848 12.889 -1.746 1.00 . A A . 35 GLN OE1 1 1 15 10661 1 1 32 THR C C -2.626 7.745 -0.537 1.00 . A A . 36 THR C 1 1 15 10662 1 1 32 THR CA C -3.694 8.696 0.014 1.00 . A A . 36 THR CA 1 1 15 10663 1 1 32 THR CB C -4.079 8.296 1.444 1.00 . A A . 36 THR CB 1 1 15 10664 1 1 32 THR CG2 C -4.478 9.543 2.236 1.00 . A A . 36 THR CG2 1 1 15 10665 1 1 32 THR H H -5.059 7.814 -1.410 1.00 . A A . 36 THR H 1 1 15 10666 1 1 32 THR HA H -3.338 9.713 -0.002 1.00 . A A . 36 THR HA 1 1 15 10667 1 1 32 THR HB H -3.235 7.827 1.924 1.00 . A A . 36 THR HB 1 1 15 10668 1 1 32 THR HG1 H -5.445 7.218 2.316 1.00 . A A . 36 THR HG1 1 1 15 10669 1 1 32 THR HG21 H -5.546 9.542 2.397 1.00 . A A . 36 THR HG21 1 1 15 10670 1 1 32 THR HG22 H -4.198 10.427 1.681 1.00 . A A . 36 THR HG22 1 1 15 10671 1 1 32 THR HG23 H -3.970 9.542 3.189 1.00 . A A . 36 THR HG23 1 1 15 10672 1 1 32 THR N N -4.951 8.568 -0.788 1.00 . A A . 36 THR N 1 1 15 10673 1 1 32 THR O O -2.913 6.896 -1.352 1.00 . A A . 36 THR O 1 1 15 10674 1 1 32 THR OG1 O -5.170 7.385 1.411 1.00 . A A . 36 THR OG1 1 1 15 10675 1 1 33 THR C C 0.506 6.415 0.528 1.00 . A A . 37 THR C 1 1 15 10676 1 1 33 THR CA C -0.336 6.958 -0.623 1.00 . A A . 37 THR CA 1 1 15 10677 1 1 33 THR CB C 0.555 7.804 -1.541 1.00 . A A . 37 THR CB 1 1 15 10678 1 1 33 THR CG2 C -0.294 8.589 -2.537 1.00 . A A . 37 THR CG2 1 1 15 10679 1 1 33 THR H H -1.178 8.566 0.553 1.00 . A A . 37 THR H 1 1 15 10680 1 1 33 THR HA H -0.775 6.150 -1.183 1.00 . A A . 37 THR HA 1 1 15 10681 1 1 33 THR HB H 1.224 7.151 -2.086 1.00 . A A . 37 THR HB 1 1 15 10682 1 1 33 THR HG1 H 0.730 9.407 -0.457 1.00 . A A . 37 THR HG1 1 1 15 10683 1 1 33 THR HG21 H -0.281 9.636 -2.274 1.00 . A A . 37 THR HG21 1 1 15 10684 1 1 33 THR HG22 H -1.307 8.224 -2.513 1.00 . A A . 37 THR HG22 1 1 15 10685 1 1 33 THR HG23 H 0.112 8.463 -3.531 1.00 . A A . 37 THR HG23 1 1 15 10686 1 1 33 THR N N -1.400 7.874 -0.107 1.00 . A A . 37 THR N 1 1 15 10687 1 1 33 THR O O 1.183 7.155 1.214 1.00 . A A . 37 THR O 1 1 15 10688 1 1 33 THR OG1 O 1.316 8.704 -0.753 1.00 . A A . 37 THR OG1 1 1 15 10689 1 1 34 THR C C 2.342 3.581 1.228 1.00 . A A . 38 THR C 1 1 15 10690 1 1 34 THR CA C 1.329 4.555 1.828 1.00 . A A . 38 THR CA 1 1 15 10691 1 1 34 THR CB C 0.355 3.833 2.760 1.00 . A A . 38 THR CB 1 1 15 10692 1 1 34 THR CG2 C -0.327 2.691 2.010 1.00 . A A . 38 THR CG2 1 1 15 10693 1 1 34 THR H H -0.039 4.541 0.156 1.00 . A A . 38 THR H 1 1 15 10694 1 1 34 THR HA H 1.839 5.342 2.364 1.00 . A A . 38 THR HA 1 1 15 10695 1 1 34 THR HB H -0.395 4.527 3.106 1.00 . A A . 38 THR HB 1 1 15 10696 1 1 34 THR HG1 H 0.915 3.894 4.623 1.00 . A A . 38 THR HG1 1 1 15 10697 1 1 34 THR HG21 H -1.015 2.186 2.672 1.00 . A A . 38 THR HG21 1 1 15 10698 1 1 34 THR HG22 H 0.419 1.990 1.666 1.00 . A A . 38 THR HG22 1 1 15 10699 1 1 34 THR HG23 H -0.865 3.090 1.167 1.00 . A A . 38 THR HG23 1 1 15 10700 1 1 34 THR N N 0.497 5.129 0.733 1.00 . A A . 38 THR N 1 1 15 10701 1 1 34 THR O O 2.009 2.767 0.393 1.00 . A A . 38 THR O 1 1 15 10702 1 1 34 THR OG1 O 1.066 3.312 3.874 1.00 . A A . 38 THR OG1 1 1 15 10703 1 1 35 TRP C C 4.249 1.292 1.420 1.00 . A A . 39 TRP C 1 1 15 10704 1 1 35 TRP CA C 4.601 2.738 1.064 1.00 . A A . 39 TRP CA 1 1 15 10705 1 1 35 TRP CB C 5.937 3.130 1.711 1.00 . A A . 39 TRP CB 1 1 15 10706 1 1 35 TRP CD1 C 5.893 5.520 2.556 1.00 . A A . 39 TRP CD1 1 1 15 10707 1 1 35 TRP CD2 C 6.814 5.354 0.506 1.00 . A A . 39 TRP CD2 1 1 15 10708 1 1 35 TRP CE2 C 6.857 6.722 0.869 1.00 . A A . 39 TRP CE2 1 1 15 10709 1 1 35 TRP CE3 C 7.339 4.991 -0.751 1.00 . A A . 39 TRP CE3 1 1 15 10710 1 1 35 TRP CG C 6.190 4.607 1.598 1.00 . A A . 39 TRP CG 1 1 15 10711 1 1 35 TRP CH2 C 7.918 7.308 -1.213 1.00 . A A . 39 TRP CH2 1 1 15 10712 1 1 35 TRP CZ2 C 7.399 7.687 0.024 1.00 . A A . 39 TRP CZ2 1 1 15 10713 1 1 35 TRP CZ3 C 7.886 5.963 -1.601 1.00 . A A . 39 TRP CZ3 1 1 15 10714 1 1 35 TRP H H 3.831 4.329 2.300 1.00 . A A . 39 TRP H 1 1 15 10715 1 1 35 TRP HA H 4.658 2.854 -0.008 1.00 . A A . 39 TRP HA 1 1 15 10716 1 1 35 TRP HB2 H 5.918 2.854 2.755 1.00 . A A . 39 TRP HB2 1 1 15 10717 1 1 35 TRP HB3 H 6.738 2.596 1.220 1.00 . A A . 39 TRP HB3 1 1 15 10718 1 1 35 TRP HD1 H 5.420 5.305 3.503 1.00 . A A . 39 TRP HD1 1 1 15 10719 1 1 35 TRP HE1 H 6.176 7.610 2.625 1.00 . A A . 39 TRP HE1 1 1 15 10720 1 1 35 TRP HE3 H 7.316 3.962 -1.071 1.00 . A A . 39 TRP HE3 1 1 15 10721 1 1 35 TRP HH2 H 8.343 8.051 -1.873 1.00 . A A . 39 TRP HH2 1 1 15 10722 1 1 35 TRP HZ2 H 7.420 8.720 0.330 1.00 . A A . 39 TRP HZ2 1 1 15 10723 1 1 35 TRP HZ3 H 8.291 5.671 -2.559 1.00 . A A . 39 TRP HZ3 1 1 15 10724 1 1 35 TRP N N 3.579 3.663 1.631 1.00 . A A . 39 TRP N 1 1 15 10725 1 1 35 TRP NE1 N 6.282 6.774 2.120 1.00 . A A . 39 TRP NE1 1 1 15 10726 1 1 35 TRP O O 4.515 0.374 0.670 1.00 . A A . 39 TRP O 1 1 15 10727 1 1 36 GLN C C 2.468 -0.281 4.262 1.00 . A A . 40 GLN C 1 1 15 10728 1 1 36 GLN CA C 3.284 -0.306 2.966 1.00 . A A . 40 GLN CA 1 1 15 10729 1 1 36 GLN CB C 4.618 -1.020 3.185 1.00 . A A . 40 GLN CB 1 1 15 10730 1 1 36 GLN CD C 4.711 -3.258 4.291 1.00 . A A . 40 GLN CD 1 1 15 10731 1 1 36 GLN CG C 4.430 -2.525 2.979 1.00 . A A . 40 GLN CG 1 1 15 10732 1 1 36 GLN H H 3.446 1.836 3.153 1.00 . A A . 40 GLN H 1 1 15 10733 1 1 36 GLN HA H 2.729 -0.793 2.180 1.00 . A A . 40 GLN HA 1 1 15 10734 1 1 36 GLN HB2 H 5.346 -0.648 2.479 1.00 . A A . 40 GLN HB2 1 1 15 10735 1 1 36 GLN HB3 H 4.965 -0.835 4.190 1.00 . A A . 40 GLN HB3 1 1 15 10736 1 1 36 GLN HE21 H 6.663 -2.896 4.241 1.00 . A A . 40 GLN HE21 1 1 15 10737 1 1 36 GLN HE22 H 6.125 -3.786 5.583 1.00 . A A . 40 GLN HE22 1 1 15 10738 1 1 36 GLN HG2 H 3.416 -2.722 2.667 1.00 . A A . 40 GLN HG2 1 1 15 10739 1 1 36 GLN HG3 H 5.114 -2.872 2.219 1.00 . A A . 40 GLN HG3 1 1 15 10740 1 1 36 GLN N N 3.652 1.081 2.562 1.00 . A A . 40 GLN N 1 1 15 10741 1 1 36 GLN NE2 N 5.935 -3.318 4.742 1.00 . A A . 40 GLN NE2 1 1 15 10742 1 1 36 GLN O O 2.118 0.768 4.767 1.00 . A A . 40 GLN O 1 1 15 10743 1 1 36 GLN OE1 O 3.809 -3.782 4.915 1.00 . A A . 40 GLN OE1 1 1 15 10744 1 1 37 ASP C C 0.084 -0.650 5.916 1.00 . A A . 41 ASP C 1 1 15 10745 1 1 37 ASP CA C 1.373 -1.470 6.067 1.00 . A A . 41 ASP CA 1 1 15 10746 1 1 37 ASP CB C 2.281 -0.846 7.126 1.00 . A A . 41 ASP CB 1 1 15 10747 1 1 37 ASP CG C 1.916 -1.403 8.504 1.00 . A A . 41 ASP CG 1 1 15 10748 1 1 37 ASP H H 2.455 -2.263 4.381 1.00 . A A . 41 ASP H 1 1 15 10749 1 1 37 ASP HA H 1.142 -2.489 6.334 1.00 . A A . 41 ASP HA 1 1 15 10750 1 1 37 ASP HB2 H 3.310 -1.087 6.903 1.00 . A A . 41 ASP HB2 1 1 15 10751 1 1 37 ASP HB3 H 2.154 0.225 7.125 1.00 . A A . 41 ASP HB3 1 1 15 10752 1 1 37 ASP N N 2.164 -1.428 4.804 1.00 . A A . 41 ASP N 1 1 15 10753 1 1 37 ASP O O -0.208 0.195 6.736 1.00 . A A . 41 ASP O 1 1 15 10754 1 1 37 ASP OD1 O 1.661 -2.592 8.592 1.00 . A A . 41 ASP OD1 1 1 15 10755 1 1 37 ASP OD2 O 1.898 -0.629 9.447 1.00 . A A . 41 ASP OD2 1 1 15 10756 1 1 38 PRO C C -3.002 -0.663 5.592 1.00 . A A . 42 PRO C 1 1 15 10757 1 1 38 PRO CA C -1.919 -0.196 4.616 1.00 . A A . 42 PRO CA 1 1 15 10758 1 1 38 PRO CB C -2.279 -0.576 3.184 1.00 . A A . 42 PRO CB 1 1 15 10759 1 1 38 PRO CD C -0.380 -1.928 3.820 1.00 . A A . 42 PRO CD 1 1 15 10760 1 1 38 PRO CG C -1.608 -1.891 2.948 1.00 . A A . 42 PRO CG 1 1 15 10761 1 1 38 PRO HA H -1.767 0.869 4.691 1.00 . A A . 42 PRO HA 1 1 15 10762 1 1 38 PRO HB2 H -3.350 -0.675 3.081 1.00 . A A . 42 PRO HB2 1 1 15 10763 1 1 38 PRO HB3 H -1.904 0.165 2.493 1.00 . A A . 42 PRO HB3 1 1 15 10764 1 1 38 PRO HD2 H -0.256 -2.906 4.259 1.00 . A A . 42 PRO HD2 1 1 15 10765 1 1 38 PRO HD3 H 0.495 -1.653 3.252 1.00 . A A . 42 PRO HD3 1 1 15 10766 1 1 38 PRO HG2 H -2.275 -2.697 3.218 1.00 . A A . 42 PRO HG2 1 1 15 10767 1 1 38 PRO HG3 H -1.326 -1.979 1.910 1.00 . A A . 42 PRO HG3 1 1 15 10768 1 1 38 PRO N N -0.651 -0.927 4.864 1.00 . A A . 42 PRO N 1 1 15 10769 1 1 38 PRO O O -2.762 -1.480 6.459 1.00 . A A . 42 PRO O 1 1 15 10770 1 1 39 ARG C C -4.856 -0.395 7.838 1.00 . A A . 43 ARG C 1 1 15 10771 1 1 39 ARG CA C -5.293 -0.563 6.379 1.00 . A A . 43 ARG CA 1 1 15 10772 1 1 39 ARG CB C -5.541 -2.037 6.060 1.00 . A A . 43 ARG CB 1 1 15 10773 1 1 39 ARG CD C -7.308 -3.772 5.721 1.00 . A A . 43 ARG CD 1 1 15 10774 1 1 39 ARG CG C -7.039 -2.272 5.858 1.00 . A A . 43 ARG CG 1 1 15 10775 1 1 39 ARG CZ C -7.870 -5.473 7.381 1.00 . A A . 43 ARG CZ 1 1 15 10776 1 1 39 ARG H H -4.368 0.511 4.754 1.00 . A A . 43 ARG H 1 1 15 10777 1 1 39 ARG HA H -6.186 0.011 6.184 1.00 . A A . 43 ARG HA 1 1 15 10778 1 1 39 ARG HB2 H -5.010 -2.305 5.160 1.00 . A A . 43 ARG HB2 1 1 15 10779 1 1 39 ARG HB3 H -5.188 -2.647 6.879 1.00 . A A . 43 ARG HB3 1 1 15 10780 1 1 39 ARG HD2 H -8.070 -3.950 4.978 1.00 . A A . 43 ARG HD2 1 1 15 10781 1 1 39 ARG HD3 H -6.398 -4.293 5.460 1.00 . A A . 43 ARG HD3 1 1 15 10782 1 1 39 ARG HE H -8.039 -3.523 7.729 1.00 . A A . 43 ARG HE 1 1 15 10783 1 1 39 ARG HG2 H -7.582 -1.886 6.709 1.00 . A A . 43 ARG HG2 1 1 15 10784 1 1 39 ARG HG3 H -7.366 -1.763 4.963 1.00 . A A . 43 ARG HG3 1 1 15 10785 1 1 39 ARG HH11 H -7.213 -6.156 5.609 1.00 . A A . 43 ARG HH11 1 1 15 10786 1 1 39 ARG HH12 H -7.610 -7.366 6.778 1.00 . A A . 43 ARG HH12 1 1 15 10787 1 1 39 ARG HH21 H -8.546 -5.113 9.231 1.00 . A A . 43 ARG HH21 1 1 15 10788 1 1 39 ARG HH22 H -8.359 -6.784 8.814 1.00 . A A . 43 ARG HH22 1 1 15 10789 1 1 39 ARG N N -4.194 -0.148 5.459 1.00 . A A . 43 ARG N 1 1 15 10790 1 1 39 ARG NE N -7.785 -4.199 7.070 1.00 . A A . 43 ARG NE 1 1 15 10791 1 1 39 ARG NH1 N -7.538 -6.404 6.521 1.00 . A A . 43 ARG NH1 1 1 15 10792 1 1 39 ARG NH2 N -8.291 -5.817 8.568 1.00 . A A . 43 ARG NH2 1 1 15 10793 1 1 39 ARG O O -5.310 -1.099 8.717 1.00 . A A . 43 ARG O 1 1 15 10794 1 1 40 LYS C C -2.688 2.032 9.596 1.00 . A A . 44 LYS C 1 1 15 10795 1 1 40 LYS CA C -3.511 0.744 9.501 1.00 . A A . 44 LYS CA 1 1 15 10796 1 1 40 LYS CB C -2.641 -0.472 9.817 1.00 . A A . 44 LYS CB 1 1 15 10797 1 1 40 LYS CD C -1.258 -1.523 11.612 1.00 . A A . 44 LYS CD 1 1 15 10798 1 1 40 LYS CE C -0.587 -1.148 12.935 1.00 . A A . 44 LYS CE 1 1 15 10799 1 1 40 LYS CG C -2.402 -0.549 11.326 1.00 . A A . 44 LYS CG 1 1 15 10800 1 1 40 LYS H H -3.622 1.090 7.376 1.00 . A A . 44 LYS H 1 1 15 10801 1 1 40 LYS HA H -4.352 0.783 10.175 1.00 . A A . 44 LYS HA 1 1 15 10802 1 1 40 LYS HB2 H -3.143 -1.369 9.485 1.00 . A A . 44 LYS HB2 1 1 15 10803 1 1 40 LYS HB3 H -1.694 -0.380 9.306 1.00 . A A . 44 LYS HB3 1 1 15 10804 1 1 40 LYS HD2 H -1.649 -2.528 11.678 1.00 . A A . 44 LYS HD2 1 1 15 10805 1 1 40 LYS HD3 H -0.533 -1.472 10.813 1.00 . A A . 44 LYS HD3 1 1 15 10806 1 1 40 LYS HE2 H -0.319 -0.102 12.938 1.00 . A A . 44 LYS HE2 1 1 15 10807 1 1 40 LYS HE3 H -1.242 -1.371 13.765 1.00 . A A . 44 LYS HE3 1 1 15 10808 1 1 40 LYS HG2 H -2.143 0.430 11.700 1.00 . A A . 44 LYS HG2 1 1 15 10809 1 1 40 LYS HG3 H -3.300 -0.896 11.816 1.00 . A A . 44 LYS HG3 1 1 15 10810 1 1 40 LYS HZ1 H 0.973 -2.050 13.980 1.00 . A A . 44 LYS HZ1 1 1 15 10811 1 1 40 LYS HZ2 H 1.378 -1.580 12.399 1.00 . A A . 44 LYS HZ2 1 1 15 10812 1 1 40 LYS HZ3 H 0.413 -2.954 12.658 1.00 . A A . 44 LYS HZ3 1 1 15 10813 1 1 40 LYS N N -3.976 0.532 8.099 1.00 . A A . 44 LYS N 1 1 15 10814 1 1 40 LYS NZ N 0.637 -1.998 12.998 1.00 . A A . 44 LYS NZ 1 1 15 10815 1 1 40 LYS O O -1.551 2.019 9.155 1.00 . A A . 44 LYS O 1 1 15 10816 1 1 40 LYS OXT O -3.211 3.010 10.107 1.00 . A A . 44 LYS OXT 1 1 15 10817 2 2 1 ACE C C 9.007 11.087 4.086 1.00 . B B . 45 ACE C 1 1 15 10818 2 2 1 ACE CH3 C 9.816 12.311 4.520 1.00 . B B . 45 ACE CH3 1 1 15 10819 2 2 1 ACE H1 H 10.477 12.038 5.328 1.00 . B B . 45 ACE H1 1 1 15 10820 2 2 1 ACE H2 H 9.145 13.088 4.852 1.00 . B B . 45 ACE H2 1 1 15 10821 2 2 1 ACE H3 H 10.399 12.672 3.685 1.00 . B B . 45 ACE H3 1 1 15 10822 2 2 1 ACE O O 8.181 10.593 4.828 1.00 . B B . 45 ACE O 1 1 15 10823 2 2 2 PRO C C 7.514 10.986 1.178 1.00 . B B . 46 PRO C 1 1 15 10824 2 2 2 PRO CA C 8.873 11.452 1.708 1.00 . B B . 46 PRO CA 1 1 15 10825 2 2 2 PRO CB C 9.974 11.182 0.686 1.00 . B B . 46 PRO CB 1 1 15 10826 2 2 2 PRO CD C 10.371 9.721 2.557 1.00 . B B . 46 PRO CD 1 1 15 10827 2 2 2 PRO CG C 10.533 9.854 1.067 1.00 . B B . 46 PRO CG 1 1 15 10828 2 2 2 PRO HA H 8.847 12.499 1.957 1.00 . B B . 46 PRO HA 1 1 15 10829 2 2 2 PRO HB2 H 9.557 11.147 -0.312 1.00 . B B . 46 PRO HB2 1 1 15 10830 2 2 2 PRO HB3 H 10.740 11.939 0.750 1.00 . B B . 46 PRO HB3 1 1 15 10831 2 2 2 PRO HD2 H 10.107 8.703 2.816 1.00 . B B . 46 PRO HD2 1 1 15 10832 2 2 2 PRO HD3 H 11.272 10.021 3.066 1.00 . B B . 46 PRO HD3 1 1 15 10833 2 2 2 PRO HG2 H 9.991 9.067 0.561 1.00 . B B . 46 PRO HG2 1 1 15 10834 2 2 2 PRO HG3 H 11.581 9.806 0.811 1.00 . B B . 46 PRO HG3 1 1 15 10835 2 2 2 PRO N N 9.273 10.642 2.889 1.00 . B B . 46 PRO N 1 1 15 10836 2 2 2 PRO O O 7.293 10.916 -0.015 1.00 . B B . 46 PRO O 1 1 15 10837 2 2 3 LEU C C 4.687 11.157 0.537 1.00 . B B . 47 LEU C 1 1 15 10838 2 2 3 LEU CA C 5.250 10.203 1.612 1.00 . B B . 47 LEU CA 1 1 15 10839 2 2 3 LEU CB C 4.399 10.245 2.884 1.00 . B B . 47 LEU CB 1 1 15 10840 2 2 3 LEU CD1 C 2.350 9.751 1.528 1.00 . B B . 47 LEU CD1 1 1 15 10841 2 2 3 LEU CD2 C 3.635 7.879 2.576 1.00 . B B . 47 LEU CD2 1 1 15 10842 2 2 3 LEU CG C 3.177 9.330 2.743 1.00 . B B . 47 LEU CG 1 1 15 10843 2 2 3 LEU H H 6.802 10.730 3.014 1.00 . B B . 47 LEU H 1 1 15 10844 2 2 3 LEU HA H 5.306 9.194 1.240 1.00 . B B . 47 LEU HA 1 1 15 10845 2 2 3 LEU HB2 H 4.997 9.911 3.721 1.00 . B B . 47 LEU HB2 1 1 15 10846 2 2 3 LEU HB3 H 4.070 11.256 3.061 1.00 . B B . 47 LEU HB3 1 1 15 10847 2 2 3 LEU HD11 H 1.371 9.299 1.583 1.00 . B B . 47 LEU HD11 1 1 15 10848 2 2 3 LEU HD12 H 2.846 9.425 0.625 1.00 . B B . 47 LEU HD12 1 1 15 10849 2 2 3 LEU HD13 H 2.249 10.826 1.515 1.00 . B B . 47 LEU HD13 1 1 15 10850 2 2 3 LEU HD21 H 4.374 7.649 3.328 1.00 . B B . 47 LEU HD21 1 1 15 10851 2 2 3 LEU HD22 H 4.063 7.748 1.594 1.00 . B B . 47 LEU HD22 1 1 15 10852 2 2 3 LEU HD23 H 2.788 7.219 2.691 1.00 . B B . 47 LEU HD23 1 1 15 10853 2 2 3 LEU HG H 2.568 9.409 3.632 1.00 . B B . 47 LEU HG 1 1 15 10854 2 2 3 LEU N N 6.601 10.666 2.057 1.00 . B B . 47 LEU N 1 1 15 10855 2 2 3 LEU O O 4.462 12.319 0.809 1.00 . B B . 47 LEU O 1 1 15 10856 2 2 4 PRO C C 2.478 11.822 -1.537 1.00 . B B . 48 PRO C 1 1 15 10857 2 2 4 PRO CA C 3.954 11.465 -1.768 1.00 . B B . 48 PRO CA 1 1 15 10858 2 2 4 PRO CB C 4.094 10.558 -2.988 1.00 . B B . 48 PRO CB 1 1 15 10859 2 2 4 PRO CD C 4.725 9.247 -1.077 1.00 . B B . 48 PRO CD 1 1 15 10860 2 2 4 PRO CG C 4.083 9.171 -2.433 1.00 . B B . 48 PRO CG 1 1 15 10861 2 2 4 PRO HA H 4.547 12.355 -1.900 1.00 . B B . 48 PRO HA 1 1 15 10862 2 2 4 PRO HB2 H 3.261 10.699 -3.661 1.00 . B B . 48 PRO HB2 1 1 15 10863 2 2 4 PRO HB3 H 5.028 10.752 -3.496 1.00 . B B . 48 PRO HB3 1 1 15 10864 2 2 4 PRO HD2 H 4.256 8.554 -0.394 1.00 . B B . 48 PRO HD2 1 1 15 10865 2 2 4 PRO HD3 H 5.784 9.054 -1.149 1.00 . B B . 48 PRO HD3 1 1 15 10866 2 2 4 PRO HG2 H 3.067 8.819 -2.342 1.00 . B B . 48 PRO HG2 1 1 15 10867 2 2 4 PRO HG3 H 4.648 8.511 -3.072 1.00 . B B . 48 PRO HG3 1 1 15 10868 2 2 4 PRO N N 4.485 10.635 -0.653 1.00 . B B . 48 PRO N 1 1 15 10869 2 2 4 PRO O O 1.755 11.075 -0.910 1.00 . B B . 48 PRO O 1 1 15 10870 2 2 5 PRO C C -0.224 12.628 -2.900 1.00 . B B . 49 PRO C 1 1 15 10871 2 2 5 PRO CA C 0.669 13.395 -1.917 1.00 . B B . 49 PRO CA 1 1 15 10872 2 2 5 PRO CB C 0.717 14.876 -2.275 1.00 . B B . 49 PRO CB 1 1 15 10873 2 2 5 PRO CD C 2.880 13.922 -2.826 1.00 . B B . 49 PRO CD 1 1 15 10874 2 2 5 PRO CG C 1.914 15.031 -3.163 1.00 . B B . 49 PRO CG 1 1 15 10875 2 2 5 PRO HA H 0.328 13.266 -0.903 1.00 . B B . 49 PRO HA 1 1 15 10876 2 2 5 PRO HB2 H -0.180 15.165 -2.802 1.00 . B B . 49 PRO HB2 1 1 15 10877 2 2 5 PRO HB3 H 0.834 15.474 -1.382 1.00 . B B . 49 PRO HB3 1 1 15 10878 2 2 5 PRO HD2 H 3.259 13.465 -3.729 1.00 . B B . 49 PRO HD2 1 1 15 10879 2 2 5 PRO HD3 H 3.691 14.297 -2.222 1.00 . B B . 49 PRO HD3 1 1 15 10880 2 2 5 PRO HG2 H 1.615 14.955 -4.197 1.00 . B B . 49 PRO HG2 1 1 15 10881 2 2 5 PRO HG3 H 2.380 15.988 -2.985 1.00 . B B . 49 PRO HG3 1 1 15 10882 2 2 5 PRO N N 2.076 12.955 -2.062 1.00 . B B . 49 PRO N 1 1 15 10883 2 2 5 PRO O O 0.159 11.603 -3.428 1.00 . B B . 49 PRO O 1 1 15 10884 2 2 6 TYR C C -3.009 13.437 -5.016 1.00 . B B . 50 TYR C 1 1 15 10885 2 2 6 TYR CA C -2.314 12.419 -4.108 1.00 . B B . 50 TYR CA 1 1 15 10886 2 2 6 TYR CB C -3.336 11.697 -3.229 1.00 . B B . 50 TYR CB 1 1 15 10887 2 2 6 TYR CD1 C -4.447 10.657 -5.245 1.00 . B B . 50 TYR CD1 1 1 15 10888 2 2 6 TYR CD2 C -3.844 9.231 -3.379 1.00 . B B . 50 TYR CD2 1 1 15 10889 2 2 6 TYR CE1 C -4.962 9.547 -5.925 1.00 . B B . 50 TYR CE1 1 1 15 10890 2 2 6 TYR CE2 C -4.357 8.122 -4.061 1.00 . B B . 50 TYR CE2 1 1 15 10891 2 2 6 TYR CG C -3.887 10.499 -3.970 1.00 . B B . 50 TYR CG 1 1 15 10892 2 2 6 TYR CZ C -4.917 8.280 -5.334 1.00 . B B . 50 TYR CZ 1 1 15 10893 2 2 6 TYR H H -1.696 13.950 -2.722 1.00 . B B . 50 TYR H 1 1 15 10894 2 2 6 TYR HA H -1.762 11.703 -4.697 1.00 . B B . 50 TYR HA 1 1 15 10895 2 2 6 TYR HB2 H -2.858 11.367 -2.319 1.00 . B B . 50 TYR HB2 1 1 15 10896 2 2 6 TYR HB3 H -4.144 12.372 -2.988 1.00 . B B . 50 TYR HB3 1 1 15 10897 2 2 6 TYR HD1 H -4.483 11.633 -5.703 1.00 . B B . 50 TYR HD1 1 1 15 10898 2 2 6 TYR HD2 H -3.411 9.107 -2.398 1.00 . B B . 50 TYR HD2 1 1 15 10899 2 2 6 TYR HE1 H -5.394 9.669 -6.908 1.00 . B B . 50 TYR HE1 1 1 15 10900 2 2 6 TYR HE2 H -4.322 7.144 -3.605 1.00 . B B . 50 TYR HE2 1 1 15 10901 2 2 6 TYR HH H -6.141 7.489 -6.568 1.00 . B B . 50 TYR HH 1 1 15 10902 2 2 6 TYR N N -1.405 13.120 -3.154 1.00 . B B . 50 TYR N 1 1 15 10903 2 2 6 TYR O O -2.700 13.458 -6.196 1.00 . B B . 50 TYR O 1 1 15 10904 2 2 6 TYR OXT O -3.838 14.179 -4.515 1.00 . B B . 50 TYR OXT 1 1 15 10905 2 2 6 TYR OH O -5.424 7.186 -6.007 1.00 . B B . 50 TYR OH 1 1 16 10906 1 1 1 PHE C C 9.300 -6.880 8.335 1.00 . A A . 5 PHE C 1 1 16 10907 1 1 1 PHE CA C 9.345 -6.300 9.751 1.00 . A A . 5 PHE CA 1 1 16 10908 1 1 1 PHE CB C 10.525 -5.340 9.902 1.00 . A A . 5 PHE CB 1 1 16 10909 1 1 1 PHE CD1 C 12.195 -6.284 8.265 1.00 . A A . 5 PHE CD1 1 1 16 10910 1 1 1 PHE CD2 C 12.618 -6.535 10.640 1.00 . A A . 5 PHE CD2 1 1 16 10911 1 1 1 PHE CE1 C 13.387 -6.961 7.982 1.00 . A A . 5 PHE CE1 1 1 16 10912 1 1 1 PHE CE2 C 13.810 -7.212 10.356 1.00 . A A . 5 PHE CE2 1 1 16 10913 1 1 1 PHE CG C 11.811 -6.071 9.595 1.00 . A A . 5 PHE CG 1 1 16 10914 1 1 1 PHE CZ C 14.194 -7.425 9.027 1.00 . A A . 5 PHE CZ 1 1 16 10915 1 1 1 PHE HA H 8.423 -5.789 9.979 1.00 . A A . 5 PHE HA 1 1 16 10916 1 1 1 PHE HB2 H 10.407 -4.516 9.214 1.00 . A A . 5 PHE HB2 1 1 16 10917 1 1 1 PHE HB3 H 10.558 -4.965 10.914 1.00 . A A . 5 PHE HB3 1 1 16 10918 1 1 1 PHE HD1 H 11.572 -5.927 7.459 1.00 . A A . 5 PHE HD1 1 1 16 10919 1 1 1 PHE HD2 H 12.322 -6.370 11.665 1.00 . A A . 5 PHE HD2 1 1 16 10920 1 1 1 PHE HE1 H 13.683 -7.126 6.956 1.00 . A A . 5 PHE HE1 1 1 16 10921 1 1 1 PHE HE2 H 14.433 -7.571 11.162 1.00 . A A . 5 PHE HE2 1 1 16 10922 1 1 1 PHE HZ H 15.113 -7.949 8.807 1.00 . A A . 5 PHE HZ 1 1 16 10923 1 1 1 PHE N N 9.599 -7.383 10.743 1.00 . A A . 5 PHE N 1 1 16 10924 1 1 1 PHE O O 8.726 -6.301 7.434 1.00 . A A . 5 PHE O 1 1 16 10925 1 1 2 GLU C C 8.456 -8.788 6.271 1.00 . A A . 6 GLU C 1 1 16 10926 1 1 2 GLU CA C 9.893 -8.636 6.775 1.00 . A A . 6 GLU CA 1 1 16 10927 1 1 2 GLU CB C 10.545 -10.008 6.955 1.00 . A A . 6 GLU CB 1 1 16 10928 1 1 2 GLU CD C 8.839 -11.820 7.165 1.00 . A A . 6 GLU CD 1 1 16 10929 1 1 2 GLU CG C 9.719 -10.839 7.940 1.00 . A A . 6 GLU CG 1 1 16 10930 1 1 2 GLU H H 10.359 -8.472 8.872 1.00 . A A . 6 GLU H 1 1 16 10931 1 1 2 GLU HA H 10.473 -8.041 6.087 1.00 . A A . 6 GLU HA 1 1 16 10932 1 1 2 GLU HB2 H 10.588 -10.515 6.004 1.00 . A A . 6 GLU HB2 1 1 16 10933 1 1 2 GLU HB3 H 11.545 -9.883 7.344 1.00 . A A . 6 GLU HB3 1 1 16 10934 1 1 2 GLU HG2 H 10.382 -11.388 8.592 1.00 . A A . 6 GLU HG2 1 1 16 10935 1 1 2 GLU HG3 H 9.094 -10.183 8.529 1.00 . A A . 6 GLU HG3 1 1 16 10936 1 1 2 GLU N N 9.901 -8.021 8.132 1.00 . A A . 6 GLU N 1 1 16 10937 1 1 2 GLU O O 7.613 -9.362 6.932 1.00 . A A . 6 GLU O 1 1 16 10938 1 1 2 GLU OE1 O 9.299 -12.328 6.155 1.00 . A A . 6 GLU OE1 1 1 16 10939 1 1 2 GLU OE2 O 7.719 -12.047 7.592 1.00 . A A . 6 GLU OE2 1 1 16 10940 1 1 3 ILE C C 6.701 -9.571 3.576 1.00 . A A . 7 ILE C 1 1 16 10941 1 1 3 ILE CA C 6.786 -8.394 4.559 1.00 . A A . 7 ILE CA 1 1 16 10942 1 1 3 ILE CB C 6.537 -7.071 3.833 1.00 . A A . 7 ILE CB 1 1 16 10943 1 1 3 ILE CD1 C 5.442 -6.146 5.881 1.00 . A A . 7 ILE CD1 1 1 16 10944 1 1 3 ILE CG1 C 6.549 -5.925 4.847 1.00 . A A . 7 ILE CG1 1 1 16 10945 1 1 3 ILE CG2 C 5.176 -7.118 3.135 1.00 . A A . 7 ILE CG2 1 1 16 10946 1 1 3 ILE H H 8.863 -7.821 4.586 1.00 . A A . 7 ILE H 1 1 16 10947 1 1 3 ILE HA H 6.073 -8.514 5.359 1.00 . A A . 7 ILE HA 1 1 16 10948 1 1 3 ILE HB H 7.313 -6.913 3.098 1.00 . A A . 7 ILE HB 1 1 16 10949 1 1 3 ILE HD11 H 5.320 -5.252 6.474 1.00 . A A . 7 ILE HD11 1 1 16 10950 1 1 3 ILE HD12 H 5.709 -6.973 6.523 1.00 . A A . 7 ILE HD12 1 1 16 10951 1 1 3 ILE HD13 H 4.515 -6.371 5.373 1.00 . A A . 7 ILE HD13 1 1 16 10952 1 1 3 ILE HG12 H 7.506 -5.895 5.345 1.00 . A A . 7 ILE HG12 1 1 16 10953 1 1 3 ILE HG13 H 6.381 -4.990 4.334 1.00 . A A . 7 ILE HG13 1 1 16 10954 1 1 3 ILE HG21 H 5.248 -7.730 2.247 1.00 . A A . 7 ILE HG21 1 1 16 10955 1 1 3 ILE HG22 H 4.878 -6.117 2.858 1.00 . A A . 7 ILE HG22 1 1 16 10956 1 1 3 ILE HG23 H 4.441 -7.540 3.805 1.00 . A A . 7 ILE HG23 1 1 16 10957 1 1 3 ILE N N 8.169 -8.278 5.105 1.00 . A A . 7 ILE N 1 1 16 10958 1 1 3 ILE O O 7.158 -9.468 2.455 1.00 . A A . 7 ILE O 1 1 16 10959 1 1 4 PRO C C 4.943 -11.603 2.063 1.00 . A A . 8 PRO C 1 1 16 10960 1 1 4 PRO CA C 5.983 -11.854 3.159 1.00 . A A . 8 PRO CA 1 1 16 10961 1 1 4 PRO CB C 5.511 -12.943 4.119 1.00 . A A . 8 PRO CB 1 1 16 10962 1 1 4 PRO CD C 5.537 -10.877 5.361 1.00 . A A . 8 PRO CD 1 1 16 10963 1 1 4 PRO CG C 4.846 -12.209 5.239 1.00 . A A . 8 PRO CG 1 1 16 10964 1 1 4 PRO HA H 6.933 -12.124 2.729 1.00 . A A . 8 PRO HA 1 1 16 10965 1 1 4 PRO HB2 H 4.807 -13.598 3.627 1.00 . A A . 8 PRO HB2 1 1 16 10966 1 1 4 PRO HB3 H 6.356 -13.507 4.489 1.00 . A A . 8 PRO HB3 1 1 16 10967 1 1 4 PRO HD2 H 4.825 -10.099 5.596 1.00 . A A . 8 PRO HD2 1 1 16 10968 1 1 4 PRO HD3 H 6.315 -10.921 6.109 1.00 . A A . 8 PRO HD3 1 1 16 10969 1 1 4 PRO HG2 H 3.800 -12.063 5.012 1.00 . A A . 8 PRO HG2 1 1 16 10970 1 1 4 PRO HG3 H 4.950 -12.764 6.159 1.00 . A A . 8 PRO HG3 1 1 16 10971 1 1 4 PRO N N 6.119 -10.656 4.026 1.00 . A A . 8 PRO N 1 1 16 10972 1 1 4 PRO O O 4.545 -10.482 1.817 1.00 . A A . 8 PRO O 1 1 16 10973 1 1 5 ASP C C 2.259 -13.329 0.597 1.00 . A A . 9 ASP C 1 1 16 10974 1 1 5 ASP CA C 3.488 -12.456 0.325 1.00 . A A . 9 ASP CA 1 1 16 10975 1 1 5 ASP CB C 4.190 -12.905 -0.957 1.00 . A A . 9 ASP CB 1 1 16 10976 1 1 5 ASP CG C 3.234 -12.755 -2.142 1.00 . A A . 9 ASP CG 1 1 16 10977 1 1 5 ASP H H 4.834 -13.535 1.618 1.00 . A A . 9 ASP H 1 1 16 10978 1 1 5 ASP HA H 3.204 -11.419 0.245 1.00 . A A . 9 ASP HA 1 1 16 10979 1 1 5 ASP HB2 H 5.065 -12.292 -1.121 1.00 . A A . 9 ASP HB2 1 1 16 10980 1 1 5 ASP HB3 H 4.487 -13.937 -0.862 1.00 . A A . 9 ASP HB3 1 1 16 10981 1 1 5 ASP N N 4.499 -12.638 1.404 1.00 . A A . 9 ASP N 1 1 16 10982 1 1 5 ASP O O 1.974 -14.258 -0.130 1.00 . A A . 9 ASP O 1 1 16 10983 1 1 5 ASP OD1 O 2.525 -11.762 -2.184 1.00 . A A . 9 ASP OD1 1 1 16 10984 1 1 5 ASP OD2 O 3.228 -13.635 -2.987 1.00 . A A . 9 ASP OD2 1 1 16 10985 1 1 6 ASP C C -0.922 -13.216 1.313 1.00 . A A . 10 ASP C 1 1 16 10986 1 1 6 ASP CA C 0.320 -13.849 1.951 1.00 . A A . 10 ASP CA 1 1 16 10987 1 1 6 ASP CB C 0.215 -13.836 3.478 1.00 . A A . 10 ASP CB 1 1 16 10988 1 1 6 ASP CG C 0.712 -15.172 4.034 1.00 . A A . 10 ASP CG 1 1 16 10989 1 1 6 ASP H H 1.774 -12.280 2.214 1.00 . A A . 10 ASP H 1 1 16 10990 1 1 6 ASP HA H 0.448 -14.861 1.600 1.00 . A A . 10 ASP HA 1 1 16 10991 1 1 6 ASP HB2 H 0.819 -13.034 3.872 1.00 . A A . 10 ASP HB2 1 1 16 10992 1 1 6 ASP HB3 H -0.815 -13.687 3.766 1.00 . A A . 10 ASP HB3 1 1 16 10993 1 1 6 ASP N N 1.528 -13.036 1.639 1.00 . A A . 10 ASP N 1 1 16 10994 1 1 6 ASP O O -1.325 -13.585 0.226 1.00 . A A . 10 ASP O 1 1 16 10995 1 1 6 ASP OD1 O 1.865 -15.496 3.803 1.00 . A A . 10 ASP OD1 1 1 16 10996 1 1 6 ASP OD2 O -0.070 -15.848 4.682 1.00 . A A . 10 ASP OD2 1 1 16 10997 1 1 7 VAL C C -2.381 -10.270 0.778 1.00 . A A . 11 VAL C 1 1 16 10998 1 1 7 VAL CA C -2.743 -11.625 1.400 1.00 . A A . 11 VAL CA 1 1 16 10999 1 1 7 VAL CB C -3.680 -11.439 2.588 1.00 . A A . 11 VAL CB 1 1 16 11000 1 1 7 VAL CG1 C -4.041 -12.805 3.174 1.00 . A A . 11 VAL CG1 1 1 16 11001 1 1 7 VAL CG2 C -3.000 -10.583 3.659 1.00 . A A . 11 VAL CG2 1 1 16 11002 1 1 7 VAL H H -1.204 -11.984 2.846 1.00 . A A . 11 VAL H 1 1 16 11003 1 1 7 VAL HA H -3.200 -12.268 0.666 1.00 . A A . 11 VAL HA 1 1 16 11004 1 1 7 VAL HB H -4.573 -10.946 2.259 1.00 . A A . 11 VAL HB 1 1 16 11005 1 1 7 VAL HG11 H -5.084 -13.011 2.991 1.00 . A A . 11 VAL HG11 1 1 16 11006 1 1 7 VAL HG12 H -3.853 -12.803 4.237 1.00 . A A . 11 VAL HG12 1 1 16 11007 1 1 7 VAL HG13 H -3.436 -13.568 2.703 1.00 . A A . 11 VAL HG13 1 1 16 11008 1 1 7 VAL HG21 H -3.748 -10.164 4.314 1.00 . A A . 11 VAL HG21 1 1 16 11009 1 1 7 VAL HG22 H -2.447 -9.785 3.185 1.00 . A A . 11 VAL HG22 1 1 16 11010 1 1 7 VAL HG23 H -2.322 -11.198 4.233 1.00 . A A . 11 VAL HG23 1 1 16 11011 1 1 7 VAL N N -1.534 -12.271 1.974 1.00 . A A . 11 VAL N 1 1 16 11012 1 1 7 VAL O O -1.476 -9.602 1.237 1.00 . A A . 11 VAL O 1 1 16 11013 1 1 8 PRO C C -3.510 -7.474 -0.173 1.00 . A A . 12 PRO C 1 1 16 11014 1 1 8 PRO CA C -2.844 -8.621 -0.942 1.00 . A A . 12 PRO CA 1 1 16 11015 1 1 8 PRO CB C -3.494 -8.814 -2.309 1.00 . A A . 12 PRO CB 1 1 16 11016 1 1 8 PRO CD C -4.205 -10.650 -0.878 1.00 . A A . 12 PRO CD 1 1 16 11017 1 1 8 PRO CG C -4.565 -9.838 -2.100 1.00 . A A . 12 PRO CG 1 1 16 11018 1 1 8 PRO HA H -1.786 -8.448 -1.053 1.00 . A A . 12 PRO HA 1 1 16 11019 1 1 8 PRO HB2 H -3.930 -7.892 -2.657 1.00 . A A . 12 PRO HB2 1 1 16 11020 1 1 8 PRO HB3 H -2.766 -9.174 -3.020 1.00 . A A . 12 PRO HB3 1 1 16 11021 1 1 8 PRO HD2 H -5.047 -10.707 -0.204 1.00 . A A . 12 PRO HD2 1 1 16 11022 1 1 8 PRO HD3 H -3.879 -11.639 -1.161 1.00 . A A . 12 PRO HD3 1 1 16 11023 1 1 8 PRO HG2 H -5.513 -9.344 -1.944 1.00 . A A . 12 PRO HG2 1 1 16 11024 1 1 8 PRO HG3 H -4.626 -10.481 -2.963 1.00 . A A . 12 PRO HG3 1 1 16 11025 1 1 8 PRO N N -3.101 -9.907 -0.255 1.00 . A A . 12 PRO N 1 1 16 11026 1 1 8 PRO O O -3.808 -7.591 0.998 1.00 . A A . 12 PRO O 1 1 16 11027 1 1 9 LEU C C -5.926 -5.273 -0.354 1.00 . A A . 13 LEU C 1 1 16 11028 1 1 9 LEU CA C -4.407 -5.224 -0.130 1.00 . A A . 13 LEU CA 1 1 16 11029 1 1 9 LEU CB C -3.804 -3.974 -0.776 1.00 . A A . 13 LEU CB 1 1 16 11030 1 1 9 LEU CD1 C -1.398 -4.609 -1.036 1.00 . A A . 13 LEU CD1 1 1 16 11031 1 1 9 LEU CD2 C -2.007 -2.279 -0.379 1.00 . A A . 13 LEU CD2 1 1 16 11032 1 1 9 LEU CG C -2.386 -3.756 -0.239 1.00 . A A . 13 LEU CG 1 1 16 11033 1 1 9 LEU H H -3.513 -6.295 -1.768 1.00 . A A . 13 LEU H 1 1 16 11034 1 1 9 LEU HA H -4.180 -5.241 0.925 1.00 . A A . 13 LEU HA 1 1 16 11035 1 1 9 LEU HB2 H -3.766 -4.106 -1.848 1.00 . A A . 13 LEU HB2 1 1 16 11036 1 1 9 LEU HB3 H -4.415 -3.115 -0.541 1.00 . A A . 13 LEU HB3 1 1 16 11037 1 1 9 LEU HD11 H -0.580 -3.991 -1.377 1.00 . A A . 13 LEU HD11 1 1 16 11038 1 1 9 LEU HD12 H -1.901 -5.043 -1.888 1.00 . A A . 13 LEU HD12 1 1 16 11039 1 1 9 LEU HD13 H -1.013 -5.398 -0.406 1.00 . A A . 13 LEU HD13 1 1 16 11040 1 1 9 LEU HD21 H -0.949 -2.161 -0.200 1.00 . A A . 13 LEU HD21 1 1 16 11041 1 1 9 LEU HD22 H -2.563 -1.695 0.341 1.00 . A A . 13 LEU HD22 1 1 16 11042 1 1 9 LEU HD23 H -2.244 -1.940 -1.377 1.00 . A A . 13 LEU HD23 1 1 16 11043 1 1 9 LEU HG H -2.348 -4.039 0.802 1.00 . A A . 13 LEU HG 1 1 16 11044 1 1 9 LEU N N -3.754 -6.370 -0.824 1.00 . A A . 13 LEU N 1 1 16 11045 1 1 9 LEU O O -6.396 -5.992 -1.212 1.00 . A A . 13 LEU O 1 1 16 11046 1 1 10 PRO C C -8.546 -3.748 -0.977 1.00 . A A . 14 PRO C 1 1 16 11047 1 1 10 PRO CA C -8.129 -4.485 0.299 1.00 . A A . 14 PRO CA 1 1 16 11048 1 1 10 PRO CB C -8.588 -3.733 1.545 1.00 . A A . 14 PRO CB 1 1 16 11049 1 1 10 PRO CD C -6.175 -3.607 1.489 1.00 . A A . 14 PRO CD 1 1 16 11050 1 1 10 PRO CG C -7.420 -2.886 1.942 1.00 . A A . 14 PRO CG 1 1 16 11051 1 1 10 PRO HA H -8.526 -5.487 0.307 1.00 . A A . 14 PRO HA 1 1 16 11052 1 1 10 PRO HB2 H -9.440 -3.110 1.315 1.00 . A A . 14 PRO HB2 1 1 16 11053 1 1 10 PRO HB3 H -8.832 -4.427 2.335 1.00 . A A . 14 PRO HB3 1 1 16 11054 1 1 10 PRO HD2 H -5.455 -2.906 1.095 1.00 . A A . 14 PRO HD2 1 1 16 11055 1 1 10 PRO HD3 H -5.748 -4.174 2.304 1.00 . A A . 14 PRO HD3 1 1 16 11056 1 1 10 PRO HG2 H -7.483 -1.923 1.459 1.00 . A A . 14 PRO HG2 1 1 16 11057 1 1 10 PRO HG3 H -7.403 -2.761 3.014 1.00 . A A . 14 PRO HG3 1 1 16 11058 1 1 10 PRO N N -6.650 -4.508 0.429 1.00 . A A . 14 PRO N 1 1 16 11059 1 1 10 PRO O O -7.816 -2.936 -1.503 1.00 . A A . 14 PRO O 1 1 16 11060 1 1 11 ALA C C -10.029 -1.837 -2.612 1.00 . A A . 15 ALA C 1 1 16 11061 1 1 11 ALA CA C -10.182 -3.357 -2.729 1.00 . A A . 15 ALA CA 1 1 16 11062 1 1 11 ALA CB C -11.657 -3.738 -2.857 1.00 . A A . 15 ALA CB 1 1 16 11063 1 1 11 ALA H H -10.290 -4.697 -1.042 1.00 . A A . 15 ALA H 1 1 16 11064 1 1 11 ALA HA H -9.634 -3.725 -3.581 1.00 . A A . 15 ALA HA 1 1 16 11065 1 1 11 ALA HB1 H -11.738 -4.782 -3.118 1.00 . A A . 15 ALA HB1 1 1 16 11066 1 1 11 ALA HB2 H -12.118 -3.138 -3.625 1.00 . A A . 15 ALA HB2 1 1 16 11067 1 1 11 ALA HB3 H -12.156 -3.564 -1.915 1.00 . A A . 15 ALA HB3 1 1 16 11068 1 1 11 ALA N N -9.717 -4.033 -1.481 1.00 . A A . 15 ALA N 1 1 16 11069 1 1 11 ALA O O -9.898 -1.295 -1.532 1.00 . A A . 15 ALA O 1 1 16 11070 1 1 12 GLY C C -8.437 0.724 -3.481 1.00 . A A . 16 GLY C 1 1 16 11071 1 1 12 GLY CA C -9.908 0.338 -3.684 1.00 . A A . 16 GLY CA 1 1 16 11072 1 1 12 GLY H H -10.156 -1.604 -4.580 1.00 . A A . 16 GLY H 1 1 16 11073 1 1 12 GLY HA2 H -10.262 0.754 -4.615 1.00 . A A . 16 GLY HA2 1 1 16 11074 1 1 12 GLY HA3 H -10.496 0.732 -2.868 1.00 . A A . 16 GLY HA3 1 1 16 11075 1 1 12 GLY N N -10.048 -1.146 -3.721 1.00 . A A . 16 GLY N 1 1 16 11076 1 1 12 GLY O O -8.124 1.862 -3.195 1.00 . A A . 16 GLY O 1 1 16 11077 1 1 13 TRP C C -5.297 -0.116 -4.711 1.00 . A A . 17 TRP C 1 1 16 11078 1 1 13 TRP CA C -6.091 0.120 -3.425 1.00 . A A . 17 TRP CA 1 1 16 11079 1 1 13 TRP CB C -5.623 -0.839 -2.337 1.00 . A A . 17 TRP CB 1 1 16 11080 1 1 13 TRP CD1 C -6.828 -0.273 -0.195 1.00 . A A . 17 TRP CD1 1 1 16 11081 1 1 13 TRP CD2 C -4.808 0.695 -0.343 1.00 . A A . 17 TRP CD2 1 1 16 11082 1 1 13 TRP CE2 C -5.356 1.098 0.896 1.00 . A A . 17 TRP CE2 1 1 16 11083 1 1 13 TRP CE3 C -3.533 1.166 -0.692 1.00 . A A . 17 TRP CE3 1 1 16 11084 1 1 13 TRP CG C -5.757 -0.174 -1.012 1.00 . A A . 17 TRP CG 1 1 16 11085 1 1 13 TRP CH2 C -3.387 2.400 1.395 1.00 . A A . 17 TRP CH2 1 1 16 11086 1 1 13 TRP CZ2 C -4.657 1.940 1.761 1.00 . A A . 17 TRP CZ2 1 1 16 11087 1 1 13 TRP CZ3 C -2.830 2.012 0.172 1.00 . A A . 17 TRP CZ3 1 1 16 11088 1 1 13 TRP H H -7.798 -1.124 -3.842 1.00 . A A . 17 TRP H 1 1 16 11089 1 1 13 TRP HA H -5.977 1.139 -3.091 1.00 . A A . 17 TRP HA 1 1 16 11090 1 1 13 TRP HB2 H -6.227 -1.731 -2.358 1.00 . A A . 17 TRP HB2 1 1 16 11091 1 1 13 TRP HB3 H -4.588 -1.098 -2.507 1.00 . A A . 17 TRP HB3 1 1 16 11092 1 1 13 TRP HD1 H -7.720 -0.847 -0.398 1.00 . A A . 17 TRP HD1 1 1 16 11093 1 1 13 TRP HE1 H -7.211 0.579 1.695 1.00 . A A . 17 TRP HE1 1 1 16 11094 1 1 13 TRP HE3 H -3.093 0.874 -1.634 1.00 . A A . 17 TRP HE3 1 1 16 11095 1 1 13 TRP HH2 H -2.834 3.051 2.053 1.00 . A A . 17 TRP HH2 1 1 16 11096 1 1 13 TRP HZ2 H -5.093 2.237 2.704 1.00 . A A . 17 TRP HZ2 1 1 16 11097 1 1 13 TRP HZ3 H -1.856 2.369 -0.109 1.00 . A A . 17 TRP HZ3 1 1 16 11098 1 1 13 TRP N N -7.532 -0.208 -3.620 1.00 . A A . 17 TRP N 1 1 16 11099 1 1 13 TRP NE1 N -6.592 0.481 0.943 1.00 . A A . 17 TRP NE1 1 1 16 11100 1 1 13 TRP O O -5.613 -0.991 -5.493 1.00 . A A . 17 TRP O 1 1 16 11101 1 1 14 GLU C C -1.959 0.436 -5.841 1.00 . A A . 18 GLU C 1 1 16 11102 1 1 14 GLU CA C -3.452 0.456 -6.166 1.00 . A A . 18 GLU CA 1 1 16 11103 1 1 14 GLU CB C -3.767 1.658 -7.055 1.00 . A A . 18 GLU CB 1 1 16 11104 1 1 14 GLU CD C -6.099 1.078 -7.736 1.00 . A A . 18 GLU CD 1 1 16 11105 1 1 14 GLU CG C -4.653 1.217 -8.219 1.00 . A A . 18 GLU CG 1 1 16 11106 1 1 14 GLU H H -4.022 1.352 -4.288 1.00 . A A . 18 GLU H 1 1 16 11107 1 1 14 GLU HA H -3.741 -0.455 -6.668 1.00 . A A . 18 GLU HA 1 1 16 11108 1 1 14 GLU HB2 H -4.275 2.413 -6.478 1.00 . A A . 18 GLU HB2 1 1 16 11109 1 1 14 GLU HB3 H -2.845 2.067 -7.444 1.00 . A A . 18 GLU HB3 1 1 16 11110 1 1 14 GLU HG2 H -4.607 1.955 -9.007 1.00 . A A . 18 GLU HG2 1 1 16 11111 1 1 14 GLU HG3 H -4.305 0.267 -8.596 1.00 . A A . 18 GLU HG3 1 1 16 11112 1 1 14 GLU N N -4.264 0.651 -4.932 1.00 . A A . 18 GLU N 1 1 16 11113 1 1 14 GLU O O -1.297 1.457 -5.889 1.00 . A A . 18 GLU O 1 1 16 11114 1 1 14 GLU OE1 O -6.536 1.929 -6.980 1.00 . A A . 18 GLU OE1 1 1 16 11115 1 1 14 GLU OE2 O -6.745 0.119 -8.131 1.00 . A A . 18 GLU OE2 1 1 16 11116 1 1 15 MET C C 0.801 -0.355 -6.506 1.00 . A A . 19 MET C 1 1 16 11117 1 1 15 MET CA C 0.049 -0.752 -5.244 1.00 . A A . 19 MET CA 1 1 16 11118 1 1 15 MET CB C 0.385 -2.191 -4.864 1.00 . A A . 19 MET CB 1 1 16 11119 1 1 15 MET CE C -1.923 -4.019 -4.169 1.00 . A A . 19 MET CE 1 1 16 11120 1 1 15 MET CG C -0.071 -3.154 -5.967 1.00 . A A . 19 MET CG 1 1 16 11121 1 1 15 MET H H -1.937 -1.530 -5.506 1.00 . A A . 19 MET H 1 1 16 11122 1 1 15 MET HA H 0.294 -0.084 -4.432 1.00 . A A . 19 MET HA 1 1 16 11123 1 1 15 MET HB2 H 1.448 -2.273 -4.746 1.00 . A A . 19 MET HB2 1 1 16 11124 1 1 15 MET HB3 H -0.094 -2.444 -3.932 1.00 . A A . 19 MET HB3 1 1 16 11125 1 1 15 MET HE1 H -2.636 -4.795 -3.923 1.00 . A A . 19 MET HE1 1 1 16 11126 1 1 15 MET HE2 H -2.430 -3.224 -4.692 1.00 . A A . 19 MET HE2 1 1 16 11127 1 1 15 MET HE3 H -1.481 -3.628 -3.264 1.00 . A A . 19 MET HE3 1 1 16 11128 1 1 15 MET HG2 H -0.881 -2.713 -6.527 1.00 . A A . 19 MET HG2 1 1 16 11129 1 1 15 MET HG3 H 0.756 -3.351 -6.632 1.00 . A A . 19 MET HG3 1 1 16 11130 1 1 15 MET N N -1.406 -0.710 -5.530 1.00 . A A . 19 MET N 1 1 16 11131 1 1 15 MET O O 0.631 -0.943 -7.556 1.00 . A A . 19 MET O 1 1 16 11132 1 1 15 MET SD S -0.625 -4.710 -5.225 1.00 . A A . 19 MET SD 1 1 16 11133 1 1 16 ALA C C 3.699 1.723 -7.152 1.00 . A A . 20 ALA C 1 1 16 11134 1 1 16 ALA CA C 2.378 1.087 -7.610 1.00 . A A . 20 ALA CA 1 1 16 11135 1 1 16 ALA CB C 1.427 2.070 -8.307 1.00 . A A . 20 ALA CB 1 1 16 11136 1 1 16 ALA H H 1.736 1.099 -5.559 1.00 . A A . 20 ALA H 1 1 16 11137 1 1 16 ALA HA H 2.576 0.246 -8.259 1.00 . A A . 20 ALA HA 1 1 16 11138 1 1 16 ALA HB1 H 1.981 2.730 -8.953 1.00 . A A . 20 ALA HB1 1 1 16 11139 1 1 16 ALA HB2 H 0.897 2.645 -7.564 1.00 . A A . 20 ALA HB2 1 1 16 11140 1 1 16 ALA HB3 H 0.711 1.514 -8.895 1.00 . A A . 20 ALA HB3 1 1 16 11141 1 1 16 ALA N N 1.620 0.641 -6.416 1.00 . A A . 20 ALA N 1 1 16 11142 1 1 16 ALA O O 4.477 1.075 -6.477 1.00 . A A . 20 ALA O 1 1 16 11143 1 1 17 LYS C C 5.237 5.064 -6.919 1.00 . A A . 21 LYS C 1 1 16 11144 1 1 17 LYS CA C 5.277 3.541 -7.006 1.00 . A A . 21 LYS CA 1 1 16 11145 1 1 17 LYS CB C 6.308 3.097 -8.046 1.00 . A A . 21 LYS CB 1 1 16 11146 1 1 17 LYS CD C 8.231 1.566 -8.489 1.00 . A A . 21 LYS CD 1 1 16 11147 1 1 17 LYS CE C 7.721 0.607 -9.567 1.00 . A A . 21 LYS CE 1 1 16 11148 1 1 17 LYS CG C 7.095 1.896 -7.519 1.00 . A A . 21 LYS CG 1 1 16 11149 1 1 17 LYS H H 3.365 3.501 -8.008 1.00 . A A . 21 LYS H 1 1 16 11150 1 1 17 LYS HA H 5.527 3.134 -6.046 1.00 . A A . 21 LYS HA 1 1 16 11151 1 1 17 LYS HB2 H 5.801 2.821 -8.959 1.00 . A A . 21 LYS HB2 1 1 16 11152 1 1 17 LYS HB3 H 6.989 3.911 -8.248 1.00 . A A . 21 LYS HB3 1 1 16 11153 1 1 17 LYS HD2 H 8.583 2.475 -8.954 1.00 . A A . 21 LYS HD2 1 1 16 11154 1 1 17 LYS HD3 H 9.043 1.101 -7.949 1.00 . A A . 21 LYS HD3 1 1 16 11155 1 1 17 LYS HE2 H 6.843 0.082 -9.216 1.00 . A A . 21 LYS HE2 1 1 16 11156 1 1 17 LYS HE3 H 7.498 1.147 -10.476 1.00 . A A . 21 LYS HE3 1 1 16 11157 1 1 17 LYS HG2 H 7.507 2.133 -6.551 1.00 . A A . 21 LYS HG2 1 1 16 11158 1 1 17 LYS HG3 H 6.437 1.044 -7.432 1.00 . A A . 21 LYS HG3 1 1 16 11159 1 1 17 LYS HZ1 H 8.890 -1.020 -8.999 1.00 . A A . 21 LYS HZ1 1 1 16 11160 1 1 17 LYS HZ2 H 9.737 0.179 -9.854 1.00 . A A . 21 LYS HZ2 1 1 16 11161 1 1 17 LYS HZ3 H 8.681 -0.870 -10.675 1.00 . A A . 21 LYS HZ3 1 1 16 11162 1 1 17 LYS N N 3.983 2.965 -7.477 1.00 . A A . 21 LYS N 1 1 16 11163 1 1 17 LYS NZ N 8.841 -0.349 -9.790 1.00 . A A . 21 LYS NZ 1 1 16 11164 1 1 17 LYS O O 4.405 5.720 -7.516 1.00 . A A . 21 LYS O 1 1 16 11165 1 1 18 THR C C 7.651 7.587 -5.965 1.00 . A A . 22 THR C 1 1 16 11166 1 1 18 THR CA C 6.201 7.109 -6.029 1.00 . A A . 22 THR CA 1 1 16 11167 1 1 18 THR CB C 5.496 7.413 -4.710 1.00 . A A . 22 THR CB 1 1 16 11168 1 1 18 THR CG2 C 6.179 6.647 -3.573 1.00 . A A . 22 THR CG2 1 1 16 11169 1 1 18 THR H H 6.814 5.063 -5.705 1.00 . A A . 22 THR H 1 1 16 11170 1 1 18 THR HA H 5.681 7.585 -6.845 1.00 . A A . 22 THR HA 1 1 16 11171 1 1 18 THR HB H 4.469 7.112 -4.778 1.00 . A A . 22 THR HB 1 1 16 11172 1 1 18 THR HG1 H 4.899 9.243 -4.988 1.00 . A A . 22 THR HG1 1 1 16 11173 1 1 18 THR HG21 H 5.524 6.613 -2.714 1.00 . A A . 22 THR HG21 1 1 16 11174 1 1 18 THR HG22 H 7.096 7.148 -3.306 1.00 . A A . 22 THR HG22 1 1 16 11175 1 1 18 THR HG23 H 6.400 5.640 -3.895 1.00 . A A . 22 THR HG23 1 1 16 11176 1 1 18 THR N N 6.151 5.625 -6.172 1.00 . A A . 22 THR N 1 1 16 11177 1 1 18 THR O O 8.570 6.859 -6.274 1.00 . A A . 22 THR O 1 1 16 11178 1 1 18 THR OG1 O 5.566 8.808 -4.451 1.00 . A A . 22 THR OG1 1 1 16 11179 1 1 19 SER C C 10.066 9.033 -6.696 1.00 . A A . 23 SER C 1 1 16 11180 1 1 19 SER CA C 9.234 9.370 -5.445 1.00 . A A . 23 SER CA 1 1 16 11181 1 1 19 SER CB C 9.828 8.718 -4.193 1.00 . A A . 23 SER CB 1 1 16 11182 1 1 19 SER H H 7.079 9.363 -5.302 1.00 . A A . 23 SER H 1 1 16 11183 1 1 19 SER HA H 9.190 10.439 -5.309 1.00 . A A . 23 SER HA 1 1 16 11184 1 1 19 SER HB2 H 9.475 7.699 -4.117 1.00 . A A . 23 SER HB2 1 1 16 11185 1 1 19 SER HB3 H 10.905 8.723 -4.262 1.00 . A A . 23 SER HB3 1 1 16 11186 1 1 19 SER HG H 8.464 9.511 -3.055 1.00 . A A . 23 SER HG 1 1 16 11187 1 1 19 SER N N 7.849 8.810 -5.552 1.00 . A A . 23 SER N 1 1 16 11188 1 1 19 SER O O 10.049 9.761 -7.669 1.00 . A A . 23 SER O 1 1 16 11189 1 1 19 SER OG O 9.423 9.446 -3.045 1.00 . A A . 23 SER OG 1 1 16 11190 1 1 20 SER C C 11.882 6.076 -7.896 1.00 . A A . 24 SER C 1 1 16 11191 1 1 20 SER CA C 11.608 7.580 -7.879 1.00 . A A . 24 SER CA 1 1 16 11192 1 1 20 SER CB C 12.912 8.362 -7.719 1.00 . A A . 24 SER CB 1 1 16 11193 1 1 20 SER H H 10.794 7.360 -5.899 1.00 . A A . 24 SER H 1 1 16 11194 1 1 20 SER HA H 11.108 7.878 -8.779 1.00 . A A . 24 SER HA 1 1 16 11195 1 1 20 SER HB2 H 12.810 9.069 -6.909 1.00 . A A . 24 SER HB2 1 1 16 11196 1 1 20 SER HB3 H 13.717 7.678 -7.500 1.00 . A A . 24 SER HB3 1 1 16 11197 1 1 20 SER HG H 13.852 8.555 -9.410 1.00 . A A . 24 SER HG 1 1 16 11198 1 1 20 SER N N 10.790 7.942 -6.685 1.00 . A A . 24 SER N 1 1 16 11199 1 1 20 SER O O 11.818 5.432 -8.925 1.00 . A A . 24 SER O 1 1 16 11200 1 1 20 SER OG O 13.197 9.059 -8.923 1.00 . A A . 24 SER OG 1 1 16 11201 1 1 21 GLY C C 11.878 3.483 -5.402 1.00 . A A . 25 GLY C 1 1 16 11202 1 1 21 GLY CA C 12.460 4.055 -6.697 1.00 . A A . 25 GLY CA 1 1 16 11203 1 1 21 GLY H H 12.223 6.062 -5.953 1.00 . A A . 25 GLY H 1 1 16 11204 1 1 21 GLY HA2 H 12.004 3.564 -7.545 1.00 . A A . 25 GLY HA2 1 1 16 11205 1 1 21 GLY HA3 H 13.528 3.890 -6.717 1.00 . A A . 25 GLY HA3 1 1 16 11206 1 1 21 GLY N N 12.181 5.517 -6.762 1.00 . A A . 25 GLY N 1 1 16 11207 1 1 21 GLY O O 12.599 3.154 -4.480 1.00 . A A . 25 GLY O 1 1 16 11208 1 1 22 GLN C C 8.474 2.503 -4.341 1.00 . A A . 26 GLN C 1 1 16 11209 1 1 22 GLN CA C 9.954 2.806 -4.091 1.00 . A A . 26 GLN CA 1 1 16 11210 1 1 22 GLN CB C 10.108 3.908 -3.043 1.00 . A A . 26 GLN CB 1 1 16 11211 1 1 22 GLN CD C 11.675 3.958 -1.098 1.00 . A A . 26 GLN CD 1 1 16 11212 1 1 22 GLN CG C 10.436 3.281 -1.687 1.00 . A A . 26 GLN CG 1 1 16 11213 1 1 22 GLN H H 10.019 3.629 -6.082 1.00 . A A . 26 GLN H 1 1 16 11214 1 1 22 GLN HA H 10.473 1.916 -3.770 1.00 . A A . 26 GLN HA 1 1 16 11215 1 1 22 GLN HB2 H 10.906 4.574 -3.335 1.00 . A A . 26 GLN HB2 1 1 16 11216 1 1 22 GLN HB3 H 9.185 4.465 -2.968 1.00 . A A . 26 GLN HB3 1 1 16 11217 1 1 22 GLN HE21 H 12.688 3.910 -2.804 1.00 . A A . 26 GLN HE21 1 1 16 11218 1 1 22 GLN HE22 H 13.508 4.612 -1.494 1.00 . A A . 26 GLN HE22 1 1 16 11219 1 1 22 GLN HG2 H 9.600 3.413 -1.017 1.00 . A A . 26 GLN HG2 1 1 16 11220 1 1 22 GLN HG3 H 10.630 2.225 -1.816 1.00 . A A . 26 GLN HG3 1 1 16 11221 1 1 22 GLN N N 10.581 3.359 -5.327 1.00 . A A . 26 GLN N 1 1 16 11222 1 1 22 GLN NE2 N 12.709 4.178 -1.862 1.00 . A A . 26 GLN NE2 1 1 16 11223 1 1 22 GLN O O 7.717 3.363 -4.765 1.00 . A A . 26 GLN O 1 1 16 11224 1 1 22 GLN OE1 O 11.701 4.291 0.070 1.00 . A A . 26 GLN OE1 1 1 16 11225 1 1 23 ARG C C 5.736 1.642 -3.303 1.00 . A A . 27 ARG C 1 1 16 11226 1 1 23 ARG CA C 6.623 0.941 -4.314 1.00 . A A . 27 ARG CA 1 1 16 11227 1 1 23 ARG CB C 6.495 -0.572 -4.117 1.00 . A A . 27 ARG CB 1 1 16 11228 1 1 23 ARG CD C 5.181 -2.259 -5.405 1.00 . A A . 27 ARG CD 1 1 16 11229 1 1 23 ARG CG C 6.326 -1.247 -5.476 1.00 . A A . 27 ARG CG 1 1 16 11230 1 1 23 ARG CZ C 5.128 -4.670 -5.794 1.00 . A A . 27 ARG CZ 1 1 16 11231 1 1 23 ARG H H 8.678 0.612 -3.746 1.00 . A A . 27 ARG H 1 1 16 11232 1 1 23 ARG HA H 6.328 1.205 -5.315 1.00 . A A . 27 ARG HA 1 1 16 11233 1 1 23 ARG HB2 H 7.368 -0.959 -3.621 1.00 . A A . 27 ARG HB2 1 1 16 11234 1 1 23 ARG HB3 H 5.621 -0.780 -3.508 1.00 . A A . 27 ARG HB3 1 1 16 11235 1 1 23 ARG HD2 H 4.860 -2.392 -4.384 1.00 . A A . 27 ARG HD2 1 1 16 11236 1 1 23 ARG HD3 H 4.355 -1.936 -6.021 1.00 . A A . 27 ARG HD3 1 1 16 11237 1 1 23 ARG HE H 6.623 -3.509 -6.400 1.00 . A A . 27 ARG HE 1 1 16 11238 1 1 23 ARG HG2 H 6.098 -0.497 -6.221 1.00 . A A . 27 ARG HG2 1 1 16 11239 1 1 23 ARG HG3 H 7.239 -1.755 -5.741 1.00 . A A . 27 ARG HG3 1 1 16 11240 1 1 23 ARG HH11 H 3.551 -3.902 -4.811 1.00 . A A . 27 ARG HH11 1 1 16 11241 1 1 23 ARG HH12 H 3.505 -5.608 -5.081 1.00 . A A . 27 ARG HH12 1 1 16 11242 1 1 23 ARG HH21 H 6.541 -5.726 -6.739 1.00 . A A . 27 ARG HH21 1 1 16 11243 1 1 23 ARG HH22 H 5.184 -6.637 -6.165 1.00 . A A . 27 ARG HH22 1 1 16 11244 1 1 23 ARG N N 8.054 1.288 -4.085 1.00 . A A . 27 ARG N 1 1 16 11245 1 1 23 ARG NE N 5.760 -3.528 -5.938 1.00 . A A . 27 ARG NE 1 1 16 11246 1 1 23 ARG NH1 N 3.970 -4.729 -5.181 1.00 . A A . 27 ARG NH1 1 1 16 11247 1 1 23 ARG NH2 N 5.659 -5.763 -6.270 1.00 . A A . 27 ARG NH2 1 1 16 11248 1 1 23 ARG O O 5.979 1.615 -2.114 1.00 . A A . 27 ARG O 1 1 16 11249 1 1 24 TYR C C 2.344 2.335 -3.105 1.00 . A A . 28 TYR C 1 1 16 11250 1 1 24 TYR CA C 3.729 2.864 -2.825 1.00 . A A . 28 TYR CA 1 1 16 11251 1 1 24 TYR CB C 3.852 4.394 -2.997 1.00 . A A . 28 TYR CB 1 1 16 11252 1 1 24 TYR CD1 C 2.713 4.249 -5.264 1.00 . A A . 28 TYR CD1 1 1 16 11253 1 1 24 TYR CD2 C 2.392 6.238 -3.923 1.00 . A A . 28 TYR CD2 1 1 16 11254 1 1 24 TYR CE1 C 1.935 4.809 -6.278 1.00 . A A . 28 TYR CE1 1 1 16 11255 1 1 24 TYR CE2 C 1.603 6.790 -4.934 1.00 . A A . 28 TYR CE2 1 1 16 11256 1 1 24 TYR CG C 2.948 4.960 -4.084 1.00 . A A . 28 TYR CG 1 1 16 11257 1 1 24 TYR CZ C 1.380 6.077 -6.113 1.00 . A A . 28 TYR CZ 1 1 16 11258 1 1 24 TYR H H 4.481 2.179 -4.726 1.00 . A A . 28 TYR H 1 1 16 11259 1 1 24 TYR HA H 3.998 2.594 -1.814 1.00 . A A . 28 TYR HA 1 1 16 11260 1 1 24 TYR HB2 H 3.603 4.868 -2.060 1.00 . A A . 28 TYR HB2 1 1 16 11261 1 1 24 TYR HB3 H 4.873 4.628 -3.240 1.00 . A A . 28 TYR HB3 1 1 16 11262 1 1 24 TYR HD1 H 3.119 3.270 -5.389 1.00 . A A . 28 TYR HD1 1 1 16 11263 1 1 24 TYR HD2 H 2.558 6.792 -3.011 1.00 . A A . 28 TYR HD2 1 1 16 11264 1 1 24 TYR HE1 H 1.759 4.258 -7.186 1.00 . A A . 28 TYR HE1 1 1 16 11265 1 1 24 TYR HE2 H 1.170 7.767 -4.805 1.00 . A A . 28 TYR HE2 1 1 16 11266 1 1 24 TYR HH H 1.169 7.296 -7.564 1.00 . A A . 28 TYR HH 1 1 16 11267 1 1 24 TYR N N 4.675 2.219 -3.765 1.00 . A A . 28 TYR N 1 1 16 11268 1 1 24 TYR O O 2.111 1.642 -4.078 1.00 . A A . 28 TYR O 1 1 16 11269 1 1 24 TYR OH O 0.628 6.635 -7.123 1.00 . A A . 28 TYR OH 1 1 16 11270 1 1 25 PHE C C -0.906 3.234 -2.477 1.00 . A A . 29 PHE C 1 1 16 11271 1 1 25 PHE CA C 0.081 2.088 -2.424 1.00 . A A . 29 PHE CA 1 1 16 11272 1 1 25 PHE CB C -0.108 1.146 -1.237 1.00 . A A . 29 PHE CB 1 1 16 11273 1 1 25 PHE CD1 C 2.257 0.236 -1.107 1.00 . A A . 29 PHE CD1 1 1 16 11274 1 1 25 PHE CD2 C 0.487 -1.205 -1.919 1.00 . A A . 29 PHE CD2 1 1 16 11275 1 1 25 PHE CE1 C 3.187 -0.791 -1.317 1.00 . A A . 29 PHE CE1 1 1 16 11276 1 1 25 PHE CE2 C 1.420 -2.228 -2.132 1.00 . A A . 29 PHE CE2 1 1 16 11277 1 1 25 PHE CG C 0.901 0.026 -1.408 1.00 . A A . 29 PHE CG 1 1 16 11278 1 1 25 PHE CZ C 2.767 -2.021 -1.832 1.00 . A A . 29 PHE CZ 1 1 16 11279 1 1 25 PHE H H 1.666 3.153 -1.456 1.00 . A A . 29 PHE H 1 1 16 11280 1 1 25 PHE HA H 0.030 1.523 -3.342 1.00 . A A . 29 PHE HA 1 1 16 11281 1 1 25 PHE HB2 H 0.070 1.674 -0.310 1.00 . A A . 29 PHE HB2 1 1 16 11282 1 1 25 PHE HB3 H -1.110 0.744 -1.244 1.00 . A A . 29 PHE HB3 1 1 16 11283 1 1 25 PHE HD1 H 2.586 1.187 -0.711 1.00 . A A . 29 PHE HD1 1 1 16 11284 1 1 25 PHE HD2 H -0.550 -1.366 -2.151 1.00 . A A . 29 PHE HD2 1 1 16 11285 1 1 25 PHE HE1 H 4.229 -0.630 -1.092 1.00 . A A . 29 PHE HE1 1 1 16 11286 1 1 25 PHE HE2 H 1.095 -3.177 -2.535 1.00 . A A . 29 PHE HE2 1 1 16 11287 1 1 25 PHE HZ H 3.484 -2.811 -2.005 1.00 . A A . 29 PHE HZ 1 1 16 11288 1 1 25 PHE N N 1.441 2.616 -2.241 1.00 . A A . 29 PHE N 1 1 16 11289 1 1 25 PHE O O -1.188 3.899 -1.497 1.00 . A A . 29 PHE O 1 1 16 11290 1 1 26 LEU C C -3.741 4.177 -3.418 1.00 . A A . 30 LEU C 1 1 16 11291 1 1 26 LEU CA C -2.345 4.585 -3.893 1.00 . A A . 30 LEU CA 1 1 16 11292 1 1 26 LEU CB C -2.282 4.771 -5.417 1.00 . A A . 30 LEU CB 1 1 16 11293 1 1 26 LEU CD1 C -1.334 7.078 -5.019 1.00 . A A . 30 LEU CD1 1 1 16 11294 1 1 26 LEU CD2 C -1.971 6.347 -7.302 1.00 . A A . 30 LEU CD2 1 1 16 11295 1 1 26 LEU CG C -2.333 6.247 -5.824 1.00 . A A . 30 LEU CG 1 1 16 11296 1 1 26 LEU H H -1.105 2.918 -4.417 1.00 . A A . 30 LEU H 1 1 16 11297 1 1 26 LEU HA H -2.023 5.476 -3.386 1.00 . A A . 30 LEU HA 1 1 16 11298 1 1 26 LEU HB2 H -1.362 4.341 -5.782 1.00 . A A . 30 LEU HB2 1 1 16 11299 1 1 26 LEU HB3 H -3.107 4.255 -5.871 1.00 . A A . 30 LEU HB3 1 1 16 11300 1 1 26 LEU HD11 H -0.735 6.427 -4.402 1.00 . A A . 30 LEU HD11 1 1 16 11301 1 1 26 LEU HD12 H -1.875 7.773 -4.396 1.00 . A A . 30 LEU HD12 1 1 16 11302 1 1 26 LEU HD13 H -0.693 7.626 -5.693 1.00 . A A . 30 LEU HD13 1 1 16 11303 1 1 26 LEU HD21 H -1.528 7.311 -7.498 1.00 . A A . 30 LEU HD21 1 1 16 11304 1 1 26 LEU HD22 H -2.857 6.224 -7.902 1.00 . A A . 30 LEU HD22 1 1 16 11305 1 1 26 LEU HD23 H -1.258 5.570 -7.545 1.00 . A A . 30 LEU HD23 1 1 16 11306 1 1 26 LEU HG H -3.327 6.632 -5.670 1.00 . A A . 30 LEU HG 1 1 16 11307 1 1 26 LEU N N -1.393 3.474 -3.658 1.00 . A A . 30 LEU N 1 1 16 11308 1 1 26 LEU O O -4.411 3.365 -4.029 1.00 . A A . 30 LEU O 1 1 16 11309 1 1 27 ASN C C -6.585 5.227 -2.453 1.00 . A A . 31 ASN C 1 1 16 11310 1 1 27 ASN CA C -5.506 4.390 -1.766 1.00 . A A . 31 ASN CA 1 1 16 11311 1 1 27 ASN CB C -5.417 4.748 -0.281 1.00 . A A . 31 ASN CB 1 1 16 11312 1 1 27 ASN CG C -6.731 4.410 0.413 1.00 . A A . 31 ASN CG 1 1 16 11313 1 1 27 ASN H H -3.598 5.372 -1.844 1.00 . A A . 31 ASN H 1 1 16 11314 1 1 27 ASN HA H -5.709 3.338 -1.881 1.00 . A A . 31 ASN HA 1 1 16 11315 1 1 27 ASN HB2 H -4.623 4.182 0.179 1.00 . A A . 31 ASN HB2 1 1 16 11316 1 1 27 ASN HB3 H -5.214 5.804 -0.178 1.00 . A A . 31 ASN HB3 1 1 16 11317 1 1 27 ASN HD21 H -5.856 4.019 2.146 1.00 . A A . 31 ASN HD21 1 1 16 11318 1 1 27 ASN HD22 H -7.536 3.834 2.123 1.00 . A A . 31 ASN HD22 1 1 16 11319 1 1 27 ASN N N -4.167 4.731 -2.317 1.00 . A A . 31 ASN N 1 1 16 11320 1 1 27 ASN ND2 N -6.707 4.060 1.666 1.00 . A A . 31 ASN ND2 1 1 16 11321 1 1 27 ASN O O -6.700 6.417 -2.222 1.00 . A A . 31 ASN O 1 1 16 11322 1 1 27 ASN OD1 O -7.786 4.470 -0.187 1.00 . A A . 31 ASN OD1 1 1 16 11323 1 1 28 HIS C C -9.700 5.475 -3.113 1.00 . A A . 32 HIS C 1 1 16 11324 1 1 28 HIS CA C -8.453 5.360 -4.001 1.00 . A A . 32 HIS CA 1 1 16 11325 1 1 28 HIS CB C -8.758 4.530 -5.247 1.00 . A A . 32 HIS CB 1 1 16 11326 1 1 28 HIS CD2 C -6.844 5.041 -6.975 1.00 . A A . 32 HIS CD2 1 1 16 11327 1 1 28 HIS CE1 C -7.920 6.442 -8.231 1.00 . A A . 32 HIS CE1 1 1 16 11328 1 1 28 HIS CG C -8.104 5.164 -6.445 1.00 . A A . 32 HIS CG 1 1 16 11329 1 1 28 HIS H H -7.258 3.651 -3.458 1.00 . A A . 32 HIS H 1 1 16 11330 1 1 28 HIS HA H -8.104 6.339 -4.288 1.00 . A A . 32 HIS HA 1 1 16 11331 1 1 28 HIS HB2 H -8.373 3.529 -5.117 1.00 . A A . 32 HIS HB2 1 1 16 11332 1 1 28 HIS HB3 H -9.826 4.487 -5.400 1.00 . A A . 32 HIS HB3 1 1 16 11333 1 1 28 HIS HD1 H -9.699 6.366 -7.153 1.00 . A A . 32 HIS HD1 1 1 16 11334 1 1 28 HIS HD2 H -6.060 4.414 -6.576 1.00 . A A . 32 HIS HD2 1 1 16 11335 1 1 28 HIS HE1 H -8.168 7.140 -9.016 1.00 . A A . 32 HIS HE1 1 1 16 11336 1 1 28 HIS N N -7.375 4.610 -3.294 1.00 . A A . 32 HIS N 1 1 16 11337 1 1 28 HIS ND1 N -8.772 6.063 -7.261 1.00 . A A . 32 HIS ND1 1 1 16 11338 1 1 28 HIS NE2 N -6.730 5.848 -8.102 1.00 . A A . 32 HIS NE2 1 1 16 11339 1 1 28 HIS O O -10.682 6.082 -3.491 1.00 . A A . 32 HIS O 1 1 16 11340 1 1 29 ILE C C -10.706 6.278 -0.194 1.00 . A A . 33 ILE C 1 1 16 11341 1 1 29 ILE CA C -10.857 5.015 -1.028 1.00 . A A . 33 ILE CA 1 1 16 11342 1 1 29 ILE CB C -10.864 3.781 -0.093 1.00 . A A . 33 ILE CB 1 1 16 11343 1 1 29 ILE CD1 C -10.385 1.299 0.071 1.00 . A A . 33 ILE CD1 1 1 16 11344 1 1 29 ILE CG1 C -10.126 2.582 -0.728 1.00 . A A . 33 ILE CG1 1 1 16 11345 1 1 29 ILE CG2 C -12.322 3.400 0.192 1.00 . A A . 33 ILE CG2 1 1 16 11346 1 1 29 ILE H H -8.866 4.441 -1.634 1.00 . A A . 33 ILE H 1 1 16 11347 1 1 29 ILE HA H -11.769 5.052 -1.605 1.00 . A A . 33 ILE HA 1 1 16 11348 1 1 29 ILE HB H -10.382 4.044 0.839 1.00 . A A . 33 ILE HB 1 1 16 11349 1 1 29 ILE HD11 H -11.070 0.668 -0.473 1.00 . A A . 33 ILE HD11 1 1 16 11350 1 1 29 ILE HD12 H -10.811 1.552 1.031 1.00 . A A . 33 ILE HD12 1 1 16 11351 1 1 29 ILE HD13 H -9.452 0.775 0.219 1.00 . A A . 33 ILE HD13 1 1 16 11352 1 1 29 ILE HG12 H -10.468 2.452 -1.743 1.00 . A A . 33 ILE HG12 1 1 16 11353 1 1 29 ILE HG13 H -9.065 2.786 -0.731 1.00 . A A . 33 ILE HG13 1 1 16 11354 1 1 29 ILE HG21 H -12.362 2.744 1.050 1.00 . A A . 33 ILE HG21 1 1 16 11355 1 1 29 ILE HG22 H -12.737 2.894 -0.665 1.00 . A A . 33 ILE HG22 1 1 16 11356 1 1 29 ILE HG23 H -12.894 4.293 0.397 1.00 . A A . 33 ILE HG23 1 1 16 11357 1 1 29 ILE N N -9.668 4.912 -1.932 1.00 . A A . 33 ILE N 1 1 16 11358 1 1 29 ILE O O -11.506 7.191 -0.259 1.00 . A A . 33 ILE O 1 1 16 11359 1 1 30 ASP C C -8.478 8.511 0.678 1.00 . A A . 34 ASP C 1 1 16 11360 1 1 30 ASP CA C -9.415 7.542 1.414 1.00 . A A . 34 ASP CA 1 1 16 11361 1 1 30 ASP CB C -8.749 7.014 2.686 1.00 . A A . 34 ASP CB 1 1 16 11362 1 1 30 ASP CG C -9.396 7.666 3.909 1.00 . A A . 34 ASP CG 1 1 16 11363 1 1 30 ASP H H -9.029 5.583 0.592 1.00 . A A . 34 ASP H 1 1 16 11364 1 1 30 ASP HA H -10.346 8.029 1.660 1.00 . A A . 34 ASP HA 1 1 16 11365 1 1 30 ASP HB2 H -8.876 5.943 2.739 1.00 . A A . 34 ASP HB2 1 1 16 11366 1 1 30 ASP HB3 H -7.696 7.251 2.666 1.00 . A A . 34 ASP HB3 1 1 16 11367 1 1 30 ASP N N -9.661 6.336 0.577 1.00 . A A . 34 ASP N 1 1 16 11368 1 1 30 ASP O O -7.966 9.449 1.255 1.00 . A A . 34 ASP O 1 1 16 11369 1 1 30 ASP OD1 O -10.421 7.170 4.348 1.00 . A A . 34 ASP OD1 1 1 16 11370 1 1 30 ASP OD2 O -8.856 8.651 4.386 1.00 . A A . 34 ASP OD2 1 1 16 11371 1 1 31 GLN C C -6.032 9.415 -0.610 1.00 . A A . 35 GLN C 1 1 16 11372 1 1 31 GLN CA C -7.344 9.195 -1.366 1.00 . A A . 35 GLN CA 1 1 16 11373 1 1 31 GLN CB C -8.113 10.511 -1.500 1.00 . A A . 35 GLN CB 1 1 16 11374 1 1 31 GLN CD C -10.576 10.851 -1.249 1.00 . A A . 35 GLN CD 1 1 16 11375 1 1 31 GLN CG C -9.482 10.243 -2.129 1.00 . A A . 35 GLN CG 1 1 16 11376 1 1 31 GLN H H -8.669 7.529 -1.044 1.00 . A A . 35 GLN H 1 1 16 11377 1 1 31 GLN HA H -7.151 8.784 -2.344 1.00 . A A . 35 GLN HA 1 1 16 11378 1 1 31 GLN HB2 H -8.245 10.951 -0.523 1.00 . A A . 35 GLN HB2 1 1 16 11379 1 1 31 GLN HB3 H -7.555 11.190 -2.129 1.00 . A A . 35 GLN HB3 1 1 16 11380 1 1 31 GLN HE21 H -11.807 11.193 -2.767 1.00 . A A . 35 GLN HE21 1 1 16 11381 1 1 31 GLN HE22 H -12.389 11.661 -1.243 1.00 . A A . 35 GLN HE22 1 1 16 11382 1 1 31 GLN HG2 H -9.520 10.690 -3.111 1.00 . A A . 35 GLN HG2 1 1 16 11383 1 1 31 GLN HG3 H -9.639 9.178 -2.212 1.00 . A A . 35 GLN HG3 1 1 16 11384 1 1 31 GLN N N -8.248 8.290 -0.594 1.00 . A A . 35 GLN N 1 1 16 11385 1 1 31 GLN NE2 N -11.682 11.269 -1.800 1.00 . A A . 35 GLN NE2 1 1 16 11386 1 1 31 GLN O O -5.796 10.467 -0.049 1.00 . A A . 35 GLN O 1 1 16 11387 1 1 31 GLN OE1 O -10.422 10.948 -0.047 1.00 . A A . 35 GLN OE1 1 1 16 11388 1 1 32 THR C C -2.822 7.645 -0.430 1.00 . A A . 36 THR C 1 1 16 11389 1 1 32 THR CA C -3.880 8.594 0.140 1.00 . A A . 36 THR CA 1 1 16 11390 1 1 32 THR CB C -4.194 8.234 1.592 1.00 . A A . 36 THR CB 1 1 16 11391 1 1 32 THR CG2 C -4.813 9.442 2.297 1.00 . A A . 36 THR CG2 1 1 16 11392 1 1 32 THR H H -5.385 7.584 -1.046 1.00 . A A . 36 THR H 1 1 16 11393 1 1 32 THR HA H -3.540 9.615 0.079 1.00 . A A . 36 THR HA 1 1 16 11394 1 1 32 THR HB H -3.283 7.955 2.101 1.00 . A A . 36 THR HB 1 1 16 11395 1 1 32 THR HG1 H -4.793 6.513 2.273 1.00 . A A . 36 THR HG1 1 1 16 11396 1 1 32 THR HG21 H -4.432 10.351 1.855 1.00 . A A . 36 THR HG21 1 1 16 11397 1 1 32 THR HG22 H -4.559 9.417 3.346 1.00 . A A . 36 THR HG22 1 1 16 11398 1 1 32 THR HG23 H -5.887 9.411 2.187 1.00 . A A . 36 THR HG23 1 1 16 11399 1 1 32 THR N N -5.176 8.430 -0.587 1.00 . A A . 36 THR N 1 1 16 11400 1 1 32 THR O O -3.106 6.823 -1.278 1.00 . A A . 36 THR O 1 1 16 11401 1 1 32 THR OG1 O -5.107 7.146 1.623 1.00 . A A . 36 THR OG1 1 1 16 11402 1 1 33 THR C C 0.355 6.351 0.648 1.00 . A A . 37 THR C 1 1 16 11403 1 1 33 THR CA C -0.535 6.843 -0.492 1.00 . A A . 37 THR CA 1 1 16 11404 1 1 33 THR CB C 0.304 7.680 -1.462 1.00 . A A . 37 THR CB 1 1 16 11405 1 1 33 THR CG2 C -0.600 8.417 -2.446 1.00 . A A . 37 THR CG2 1 1 16 11406 1 1 33 THR H H -1.390 8.416 0.714 1.00 . A A . 37 THR H 1 1 16 11407 1 1 33 THR HA H -0.973 6.009 -1.012 1.00 . A A . 37 THR HA 1 1 16 11408 1 1 33 THR HB H 0.967 7.027 -2.013 1.00 . A A . 37 THR HB 1 1 16 11409 1 1 33 THR HG1 H 0.493 9.347 -0.479 1.00 . A A . 37 THR HG1 1 1 16 11410 1 1 33 THR HG21 H -0.131 8.434 -3.419 1.00 . A A . 37 THR HG21 1 1 16 11411 1 1 33 THR HG22 H -0.755 9.427 -2.103 1.00 . A A . 37 THR HG22 1 1 16 11412 1 1 33 THR HG23 H -1.548 7.906 -2.511 1.00 . A A . 37 THR HG23 1 1 16 11413 1 1 33 THR N N -1.602 7.748 0.030 1.00 . A A . 37 THR N 1 1 16 11414 1 1 33 THR O O 0.912 7.132 1.394 1.00 . A A . 37 THR O 1 1 16 11415 1 1 33 THR OG1 O 1.072 8.623 -0.727 1.00 . A A . 37 THR OG1 1 1 16 11416 1 1 34 THR C C 2.472 3.642 1.220 1.00 . A A . 38 THR C 1 1 16 11417 1 1 34 THR CA C 1.403 4.537 1.849 1.00 . A A . 38 THR CA 1 1 16 11418 1 1 34 THR CB C 0.494 3.740 2.788 1.00 . A A . 38 THR CB 1 1 16 11419 1 1 34 THR CG2 C -0.091 2.539 2.049 1.00 . A A . 38 THR CG2 1 1 16 11420 1 1 34 THR H H 0.074 4.451 0.143 1.00 . A A . 38 THR H 1 1 16 11421 1 1 34 THR HA H 1.867 5.352 2.385 1.00 . A A . 38 THR HA 1 1 16 11422 1 1 34 THR HB H -0.311 4.372 3.132 1.00 . A A . 38 THR HB 1 1 16 11423 1 1 34 THR HG1 H 1.224 3.972 4.575 1.00 . A A . 38 THR HG1 1 1 16 11424 1 1 34 THR HG21 H -0.487 2.864 1.103 1.00 . A A . 38 THR HG21 1 1 16 11425 1 1 34 THR HG22 H -0.885 2.103 2.640 1.00 . A A . 38 THR HG22 1 1 16 11426 1 1 34 THR HG23 H 0.681 1.803 1.884 1.00 . A A . 38 THR HG23 1 1 16 11427 1 1 34 THR N N 0.517 5.067 0.771 1.00 . A A . 38 THR N 1 1 16 11428 1 1 34 THR O O 2.323 3.183 0.108 1.00 . A A . 38 THR O 1 1 16 11429 1 1 34 THR OG1 O 1.249 3.287 3.903 1.00 . A A . 38 THR OG1 1 1 16 11430 1 1 35 TRP C C 4.396 1.078 1.732 1.00 . A A . 39 TRP C 1 1 16 11431 1 1 35 TRP CA C 4.618 2.535 1.315 1.00 . A A . 39 TRP CA 1 1 16 11432 1 1 35 TRP CB C 5.958 3.044 1.876 1.00 . A A . 39 TRP CB 1 1 16 11433 1 1 35 TRP CD1 C 5.528 5.329 2.881 1.00 . A A . 39 TRP CD1 1 1 16 11434 1 1 35 TRP CD2 C 6.584 5.456 0.896 1.00 . A A . 39 TRP CD2 1 1 16 11435 1 1 35 TRP CE2 C 6.413 6.785 1.355 1.00 . A A . 39 TRP CE2 1 1 16 11436 1 1 35 TRP CE3 C 7.227 5.266 -0.344 1.00 . A A . 39 TRP CE3 1 1 16 11437 1 1 35 TRP CG C 6.012 4.546 1.886 1.00 . A A . 39 TRP CG 1 1 16 11438 1 1 35 TRP CH2 C 7.502 7.671 -0.602 1.00 . A A . 39 TRP CH2 1 1 16 11439 1 1 35 TRP CZ2 C 6.862 7.878 0.621 1.00 . A A . 39 TRP CZ2 1 1 16 11440 1 1 35 TRP CZ3 C 7.682 6.367 -1.084 1.00 . A A . 39 TRP CZ3 1 1 16 11441 1 1 35 TRP H H 3.663 3.779 2.803 1.00 . A A . 39 TRP H 1 1 16 11442 1 1 35 TRP HA H 4.611 2.619 0.239 1.00 . A A . 39 TRP HA 1 1 16 11443 1 1 35 TRP HB2 H 6.080 2.680 2.885 1.00 . A A . 39 TRP HB2 1 1 16 11444 1 1 35 TRP HB3 H 6.763 2.667 1.263 1.00 . A A . 39 TRP HB3 1 1 16 11445 1 1 35 TRP HD1 H 5.036 4.974 3.774 1.00 . A A . 39 TRP HD1 1 1 16 11446 1 1 35 TRP HE1 H 5.513 7.422 3.118 1.00 . A A . 39 TRP HE1 1 1 16 11447 1 1 35 TRP HE3 H 7.369 4.271 -0.733 1.00 . A A . 39 TRP HE3 1 1 16 11448 1 1 35 TRP HH2 H 7.853 8.515 -1.179 1.00 . A A . 39 TRP HH2 1 1 16 11449 1 1 35 TRP HZ2 H 6.720 8.879 0.999 1.00 . A A . 39 TRP HZ2 1 1 16 11450 1 1 35 TRP HZ3 H 8.180 6.209 -2.029 1.00 . A A . 39 TRP HZ3 1 1 16 11451 1 1 35 TRP N N 3.551 3.397 1.909 1.00 . A A . 39 TRP N 1 1 16 11452 1 1 35 TRP NE1 N 5.765 6.654 2.564 1.00 . A A . 39 TRP NE1 1 1 16 11453 1 1 35 TRP O O 4.487 0.173 0.927 1.00 . A A . 39 TRP O 1 1 16 11454 1 1 36 GLN C C 2.404 -0.923 3.306 1.00 . A A . 40 GLN C 1 1 16 11455 1 1 36 GLN CA C 3.882 -0.551 3.451 1.00 . A A . 40 GLN CA 1 1 16 11456 1 1 36 GLN CB C 4.292 -0.546 4.923 1.00 . A A . 40 GLN CB 1 1 16 11457 1 1 36 GLN CD C 4.002 -1.826 7.049 1.00 . A A . 40 GLN CD 1 1 16 11458 1 1 36 GLN CG C 4.059 -1.933 5.524 1.00 . A A . 40 GLN CG 1 1 16 11459 1 1 36 GLN H H 4.040 1.593 3.615 1.00 . A A . 40 GLN H 1 1 16 11460 1 1 36 GLN HA H 4.500 -1.239 2.898 1.00 . A A . 40 GLN HA 1 1 16 11461 1 1 36 GLN HB2 H 5.338 -0.289 5.005 1.00 . A A . 40 GLN HB2 1 1 16 11462 1 1 36 GLN HB3 H 3.701 0.182 5.460 1.00 . A A . 40 GLN HB3 1 1 16 11463 1 1 36 GLN HE21 H 4.937 -3.552 7.347 1.00 . A A . 40 GLN HE21 1 1 16 11464 1 1 36 GLN HE22 H 4.487 -2.719 8.755 1.00 . A A . 40 GLN HE22 1 1 16 11465 1 1 36 GLN HG2 H 3.126 -2.334 5.155 1.00 . A A . 40 GLN HG2 1 1 16 11466 1 1 36 GLN HG3 H 4.869 -2.590 5.239 1.00 . A A . 40 GLN HG3 1 1 16 11467 1 1 36 GLN N N 4.108 0.847 2.983 1.00 . A A . 40 GLN N 1 1 16 11468 1 1 36 GLN NE2 N 4.518 -2.778 7.778 1.00 . A A . 40 GLN NE2 1 1 16 11469 1 1 36 GLN O O 1.530 -0.080 3.381 1.00 . A A . 40 GLN O 1 1 16 11470 1 1 36 GLN OE1 O 3.483 -0.867 7.582 1.00 . A A . 40 GLN OE1 1 1 16 11471 1 1 37 ASP C C -0.030 -2.510 4.305 1.00 . A A . 41 ASP C 1 1 16 11472 1 1 37 ASP CA C 0.693 -2.603 2.954 1.00 . A A . 41 ASP CA 1 1 16 11473 1 1 37 ASP CB C 0.761 -4.055 2.481 1.00 . A A . 41 ASP CB 1 1 16 11474 1 1 37 ASP CG C 1.557 -4.130 1.176 1.00 . A A . 41 ASP CG 1 1 16 11475 1 1 37 ASP H H 2.833 -2.844 3.046 1.00 . A A . 41 ASP H 1 1 16 11476 1 1 37 ASP HA H 0.194 -1.996 2.215 1.00 . A A . 41 ASP HA 1 1 16 11477 1 1 37 ASP HB2 H 1.245 -4.658 3.234 1.00 . A A . 41 ASP HB2 1 1 16 11478 1 1 37 ASP HB3 H -0.240 -4.426 2.314 1.00 . A A . 41 ASP HB3 1 1 16 11479 1 1 37 ASP N N 2.115 -2.179 3.102 1.00 . A A . 41 ASP N 1 1 16 11480 1 1 37 ASP O O 0.560 -2.756 5.337 1.00 . A A . 41 ASP O 1 1 16 11481 1 1 37 ASP OD1 O 2.708 -3.724 1.184 1.00 . A A . 41 ASP OD1 1 1 16 11482 1 1 37 ASP OD2 O 1.004 -4.591 0.193 1.00 . A A . 41 ASP OD2 1 1 16 11483 1 1 38 PRO C C -2.396 -3.419 6.079 1.00 . A A . 42 PRO C 1 1 16 11484 1 1 38 PRO CA C -2.091 -2.033 5.500 1.00 . A A . 42 PRO CA 1 1 16 11485 1 1 38 PRO CB C -3.372 -1.343 5.040 1.00 . A A . 42 PRO CB 1 1 16 11486 1 1 38 PRO CD C -2.088 -1.840 3.058 1.00 . A A . 42 PRO CD 1 1 16 11487 1 1 38 PRO CG C -3.488 -1.674 3.586 1.00 . A A . 42 PRO CG 1 1 16 11488 1 1 38 PRO HA H -1.579 -1.420 6.224 1.00 . A A . 42 PRO HA 1 1 16 11489 1 1 38 PRO HB2 H -4.222 -1.729 5.583 1.00 . A A . 42 PRO HB2 1 1 16 11490 1 1 38 PRO HB3 H -3.292 -0.275 5.177 1.00 . A A . 42 PRO HB3 1 1 16 11491 1 1 38 PRO HD2 H -2.044 -2.654 2.349 1.00 . A A . 42 PRO HD2 1 1 16 11492 1 1 38 PRO HD3 H -1.742 -0.923 2.605 1.00 . A A . 42 PRO HD3 1 1 16 11493 1 1 38 PRO HG2 H -4.041 -2.592 3.461 1.00 . A A . 42 PRO HG2 1 1 16 11494 1 1 38 PRO HG3 H -3.986 -0.870 3.064 1.00 . A A . 42 PRO HG3 1 1 16 11495 1 1 38 PRO N N -1.292 -2.156 4.255 1.00 . A A . 42 PRO N 1 1 16 11496 1 1 38 PRO O O -1.829 -4.412 5.667 1.00 . A A . 42 PRO O 1 1 16 11497 1 1 39 ARG C C -2.355 -5.520 8.110 1.00 . A A . 43 ARG C 1 1 16 11498 1 1 39 ARG CA C -3.627 -4.813 7.632 1.00 . A A . 43 ARG CA 1 1 16 11499 1 1 39 ARG CB C -4.290 -5.605 6.504 1.00 . A A . 43 ARG CB 1 1 16 11500 1 1 39 ARG CD C -5.914 -7.502 6.425 1.00 . A A . 43 ARG CD 1 1 16 11501 1 1 39 ARG CG C -5.667 -6.092 6.963 1.00 . A A . 43 ARG CG 1 1 16 11502 1 1 39 ARG CZ C -8.331 -7.292 6.148 1.00 . A A . 43 ARG CZ 1 1 16 11503 1 1 39 ARG H H -3.733 -2.680 7.347 1.00 . A A . 43 ARG H 1 1 16 11504 1 1 39 ARG HA H -4.318 -4.688 8.449 1.00 . A A . 43 ARG HA 1 1 16 11505 1 1 39 ARG HB2 H -4.402 -4.972 5.638 1.00 . A A . 43 ARG HB2 1 1 16 11506 1 1 39 ARG HB3 H -3.674 -6.455 6.251 1.00 . A A . 43 ARG HB3 1 1 16 11507 1 1 39 ARG HD2 H -5.802 -7.520 5.350 1.00 . A A . 43 ARG HD2 1 1 16 11508 1 1 39 ARG HD3 H -5.236 -8.204 6.886 1.00 . A A . 43 ARG HD3 1 1 16 11509 1 1 39 ARG HE H -7.497 -8.418 7.559 1.00 . A A . 43 ARG HE 1 1 16 11510 1 1 39 ARG HG2 H -5.702 -6.107 8.042 1.00 . A A . 43 ARG HG2 1 1 16 11511 1 1 39 ARG HG3 H -6.427 -5.424 6.586 1.00 . A A . 43 ARG HG3 1 1 16 11512 1 1 39 ARG HH11 H -7.204 -6.251 4.850 1.00 . A A . 43 ARG HH11 1 1 16 11513 1 1 39 ARG HH12 H -8.914 -6.096 4.648 1.00 . A A . 43 ARG HH12 1 1 16 11514 1 1 39 ARG HH21 H -9.714 -8.200 7.276 1.00 . A A . 43 ARG HH21 1 1 16 11515 1 1 39 ARG HH22 H -10.326 -7.191 6.009 1.00 . A A . 43 ARG HH22 1 1 16 11516 1 1 39 ARG N N -3.287 -3.492 7.029 1.00 . A A . 43 ARG N 1 1 16 11517 1 1 39 ARG NE N -7.323 -7.814 6.806 1.00 . A A . 43 ARG NE 1 1 16 11518 1 1 39 ARG NH1 N -8.131 -6.484 5.137 1.00 . A A . 43 ARG NH1 1 1 16 11519 1 1 39 ARG NH2 N -9.552 -7.584 6.506 1.00 . A A . 43 ARG NH2 1 1 16 11520 1 1 39 ARG O O -2.318 -6.727 8.245 1.00 . A A . 43 ARG O 1 1 16 11521 1 1 40 LYS C C 0.377 -4.809 10.180 1.00 . A A . 44 LYS C 1 1 16 11522 1 1 40 LYS CA C -0.047 -5.410 8.837 1.00 . A A . 44 LYS CA 1 1 16 11523 1 1 40 LYS CB C 0.983 -5.083 7.755 1.00 . A A . 44 LYS CB 1 1 16 11524 1 1 40 LYS CD C 1.909 -7.403 7.688 1.00 . A A . 44 LYS CD 1 1 16 11525 1 1 40 LYS CE C 2.356 -8.261 8.874 1.00 . A A . 44 LYS CE 1 1 16 11526 1 1 40 LYS CG C 2.235 -5.935 7.970 1.00 . A A . 44 LYS CG 1 1 16 11527 1 1 40 LYS H H -1.364 -3.807 8.252 1.00 . A A . 44 LYS H 1 1 16 11528 1 1 40 LYS HA H -0.166 -6.477 8.923 1.00 . A A . 44 LYS HA 1 1 16 11529 1 1 40 LYS HB2 H 0.564 -5.298 6.784 1.00 . A A . 44 LYS HB2 1 1 16 11530 1 1 40 LYS HB3 H 1.245 -4.037 7.811 1.00 . A A . 44 LYS HB3 1 1 16 11531 1 1 40 LYS HD2 H 0.845 -7.513 7.545 1.00 . A A . 44 LYS HD2 1 1 16 11532 1 1 40 LYS HD3 H 2.428 -7.722 6.797 1.00 . A A . 44 LYS HD3 1 1 16 11533 1 1 40 LYS HE2 H 2.051 -7.804 9.803 1.00 . A A . 44 LYS HE2 1 1 16 11534 1 1 40 LYS HE3 H 1.945 -9.257 8.791 1.00 . A A . 44 LYS HE3 1 1 16 11535 1 1 40 LYS HG2 H 3.015 -5.604 7.300 1.00 . A A . 44 LYS HG2 1 1 16 11536 1 1 40 LYS HG3 H 2.571 -5.830 8.991 1.00 . A A . 44 LYS HG3 1 1 16 11537 1 1 40 LYS HZ1 H 4.219 -7.335 8.827 1.00 . A A . 44 LYS HZ1 1 1 16 11538 1 1 40 LYS HZ2 H 4.117 -8.737 7.872 1.00 . A A . 44 LYS HZ2 1 1 16 11539 1 1 40 LYS HZ3 H 4.225 -8.863 9.563 1.00 . A A . 44 LYS HZ3 1 1 16 11540 1 1 40 LYS N N -1.314 -4.779 8.368 1.00 . A A . 44 LYS N 1 1 16 11541 1 1 40 LYS NZ N 3.841 -8.302 8.777 1.00 . A A . 44 LYS NZ 1 1 16 11542 1 1 40 LYS O O 1.518 -4.389 10.286 1.00 . A A . 44 LYS O 1 1 16 11543 1 1 40 LYS OXT O -0.446 -4.778 11.080 1.00 . A A . 44 LYS OXT 1 1 16 11544 2 2 1 ACE C C 6.719 15.129 1.910 1.00 . B B . 45 ACE C 1 1 16 11545 2 2 1 ACE CH3 C 7.395 16.115 0.954 1.00 . B B . 45 ACE CH3 1 1 16 11546 2 2 1 ACE H1 H 6.772 16.256 0.083 1.00 . B B . 45 ACE H1 1 1 16 11547 2 2 1 ACE H2 H 8.354 15.724 0.652 1.00 . B B . 45 ACE H2 1 1 16 11548 2 2 1 ACE H3 H 7.534 17.063 1.455 1.00 . B B . 45 ACE H3 1 1 16 11549 2 2 1 ACE O O 5.535 15.224 2.166 1.00 . B B . 45 ACE O 1 1 16 11550 2 2 2 PRO C C 6.286 12.292 1.402 1.00 . B B . 46 PRO C 1 1 16 11551 2 2 2 PRO CA C 7.656 12.914 1.691 1.00 . B B . 46 PRO CA 1 1 16 11552 2 2 2 PRO CB C 8.447 12.049 2.665 1.00 . B B . 46 PRO CB 1 1 16 11553 2 2 2 PRO CD C 7.881 14.090 3.820 1.00 . B B . 46 PRO CD 1 1 16 11554 2 2 2 PRO CG C 8.158 12.622 4.013 1.00 . B B . 46 PRO CG 1 1 16 11555 2 2 2 PRO HA H 8.214 13.047 0.778 1.00 . B B . 46 PRO HA 1 1 16 11556 2 2 2 PRO HB2 H 8.112 11.021 2.611 1.00 . B B . 46 PRO HB2 1 1 16 11557 2 2 2 PRO HB3 H 9.503 12.114 2.456 1.00 . B B . 46 PRO HB3 1 1 16 11558 2 2 2 PRO HD2 H 7.068 14.406 4.460 1.00 . B B . 46 PRO HD2 1 1 16 11559 2 2 2 PRO HD3 H 8.768 14.671 4.018 1.00 . B B . 46 PRO HD3 1 1 16 11560 2 2 2 PRO HG2 H 7.293 12.134 4.442 1.00 . B B . 46 PRO HG2 1 1 16 11561 2 2 2 PRO HG3 H 9.011 12.496 4.659 1.00 . B B . 46 PRO HG3 1 1 16 11562 2 2 2 PRO N N 7.503 14.210 2.406 1.00 . B B . 46 PRO N 1 1 16 11563 2 2 2 PRO O O 5.262 12.841 1.756 1.00 . B B . 46 PRO O 1 1 16 11564 2 2 3 LEU C C 4.117 11.352 -0.486 1.00 . B B . 47 LEU C 1 1 16 11565 2 2 3 LEU CA C 4.968 10.470 0.445 1.00 . B B . 47 LEU CA 1 1 16 11566 2 2 3 LEU CB C 4.262 10.269 1.791 1.00 . B B . 47 LEU CB 1 1 16 11567 2 2 3 LEU CD1 C 3.059 8.357 2.858 1.00 . B B . 47 LEU CD1 1 1 16 11568 2 2 3 LEU CD2 C 1.799 10.008 1.470 1.00 . B B . 47 LEU CD2 1 1 16 11569 2 2 3 LEU CG C 3.124 9.259 1.625 1.00 . B B . 47 LEU CG 1 1 16 11570 2 2 3 LEU H H 7.109 10.729 0.495 1.00 . B B . 47 LEU H 1 1 16 11571 2 2 3 LEU HA H 5.159 9.512 -0.012 1.00 . B B . 47 LEU HA 1 1 16 11572 2 2 3 LEU HB2 H 4.970 9.894 2.516 1.00 . B B . 47 LEU HB2 1 1 16 11573 2 2 3 LEU HB3 H 3.860 11.210 2.132 1.00 . B B . 47 LEU HB3 1 1 16 11574 2 2 3 LEU HD11 H 3.463 7.384 2.614 1.00 . B B . 47 LEU HD11 1 1 16 11575 2 2 3 LEU HD12 H 2.031 8.251 3.173 1.00 . B B . 47 LEU HD12 1 1 16 11576 2 2 3 LEU HD13 H 3.637 8.796 3.656 1.00 . B B . 47 LEU HD13 1 1 16 11577 2 2 3 LEU HD21 H 1.723 10.768 2.234 1.00 . B B . 47 LEU HD21 1 1 16 11578 2 2 3 LEU HD22 H 0.978 9.312 1.573 1.00 . B B . 47 LEU HD22 1 1 16 11579 2 2 3 LEU HD23 H 1.758 10.471 0.496 1.00 . B B . 47 LEU HD23 1 1 16 11580 2 2 3 LEU HG H 3.301 8.656 0.747 1.00 . B B . 47 LEU HG 1 1 16 11581 2 2 3 LEU N N 6.265 11.147 0.765 1.00 . B B . 47 LEU N 1 1 16 11582 2 2 3 LEU O O 3.922 12.520 -0.218 1.00 . B B . 47 LEU O 1 1 16 11583 2 2 4 PRO C C 1.415 11.817 -1.919 1.00 . B B . 48 PRO C 1 1 16 11584 2 2 4 PRO CA C 2.801 11.533 -2.521 1.00 . B B . 48 PRO CA 1 1 16 11585 2 2 4 PRO CB C 2.689 10.599 -3.724 1.00 . B B . 48 PRO CB 1 1 16 11586 2 2 4 PRO CD C 3.808 9.367 -1.978 1.00 . B B . 48 PRO CD 1 1 16 11587 2 2 4 PRO CG C 2.896 9.227 -3.168 1.00 . B B . 48 PRO CG 1 1 16 11588 2 2 4 PRO HA H 3.296 12.445 -2.808 1.00 . B B . 48 PRO HA 1 1 16 11589 2 2 4 PRO HB2 H 1.709 10.679 -4.170 1.00 . B B . 48 PRO HB2 1 1 16 11590 2 2 4 PRO HB3 H 3.454 10.829 -4.450 1.00 . B B . 48 PRO HB3 1 1 16 11591 2 2 4 PRO HD2 H 3.505 8.696 -1.189 1.00 . B B . 48 PRO HD2 1 1 16 11592 2 2 4 PRO HD3 H 4.833 9.182 -2.263 1.00 . B B . 48 PRO HD3 1 1 16 11593 2 2 4 PRO HG2 H 1.949 8.806 -2.861 1.00 . B B . 48 PRO HG2 1 1 16 11594 2 2 4 PRO HG3 H 3.356 8.594 -3.913 1.00 . B B . 48 PRO HG3 1 1 16 11595 2 2 4 PRO N N 3.634 10.767 -1.560 1.00 . B B . 48 PRO N 1 1 16 11596 2 2 4 PRO O O 0.737 10.905 -1.489 1.00 . B B . 48 PRO O 1 1 16 11597 2 2 5 PRO C C -1.412 13.015 -2.287 1.00 . B B . 49 PRO C 1 1 16 11598 2 2 5 PRO CA C -0.289 13.449 -1.343 1.00 . B B . 49 PRO CA 1 1 16 11599 2 2 5 PRO CB C -0.220 14.970 -1.245 1.00 . B B . 49 PRO CB 1 1 16 11600 2 2 5 PRO CD C 1.774 14.246 -2.396 1.00 . B B . 49 PRO CD 1 1 16 11601 2 2 5 PRO CG C 0.789 15.379 -2.269 1.00 . B B . 49 PRO CG 1 1 16 11602 2 2 5 PRO HA H -0.424 13.020 -0.364 1.00 . B B . 49 PRO HA 1 1 16 11603 2 2 5 PRO HB2 H -1.183 15.405 -1.472 1.00 . B B . 49 PRO HB2 1 1 16 11604 2 2 5 PRO HB3 H 0.104 15.268 -0.259 1.00 . B B . 49 PRO HB3 1 1 16 11605 2 2 5 PRO HD2 H 2.060 14.106 -3.429 1.00 . B B . 49 PRO HD2 1 1 16 11606 2 2 5 PRO HD3 H 2.643 14.428 -1.782 1.00 . B B . 49 PRO HD3 1 1 16 11607 2 2 5 PRO HG2 H 0.302 15.552 -3.218 1.00 . B B . 49 PRO HG2 1 1 16 11608 2 2 5 PRO HG3 H 1.300 16.275 -1.947 1.00 . B B . 49 PRO HG3 1 1 16 11609 2 2 5 PRO N N 1.033 13.073 -1.904 1.00 . B B . 49 PRO N 1 1 16 11610 2 2 5 PRO O O -1.329 13.185 -3.488 1.00 . B B . 49 PRO O 1 1 16 11611 2 2 6 TYR C C -4.930 12.445 -2.017 1.00 . B B . 50 TYR C 1 1 16 11612 2 2 6 TYR CA C -3.593 12.013 -2.624 1.00 . B B . 50 TYR CA 1 1 16 11613 2 2 6 TYR CB C -3.488 10.488 -2.662 1.00 . B B . 50 TYR CB 1 1 16 11614 2 2 6 TYR CD1 C -3.870 10.542 -5.154 1.00 . B B . 50 TYR CD1 1 1 16 11615 2 2 6 TYR CD2 C -5.075 8.912 -3.825 1.00 . B B . 50 TYR CD2 1 1 16 11616 2 2 6 TYR CE1 C -4.493 10.060 -6.310 1.00 . B B . 50 TYR CE1 1 1 16 11617 2 2 6 TYR CE2 C -5.699 8.429 -4.981 1.00 . B B . 50 TYR CE2 1 1 16 11618 2 2 6 TYR CG C -4.161 9.969 -3.911 1.00 . B B . 50 TYR CG 1 1 16 11619 2 2 6 TYR CZ C -5.407 9.003 -6.224 1.00 . B B . 50 TYR CZ 1 1 16 11620 2 2 6 TYR H H -2.514 12.329 -0.786 1.00 . B B . 50 TYR H 1 1 16 11621 2 2 6 TYR HA H -3.483 12.415 -3.618 1.00 . B B . 50 TYR HA 1 1 16 11622 2 2 6 TYR HB2 H -2.449 10.199 -2.666 1.00 . B B . 50 TYR HB2 1 1 16 11623 2 2 6 TYR HB3 H -3.976 10.072 -1.793 1.00 . B B . 50 TYR HB3 1 1 16 11624 2 2 6 TYR HD1 H -3.164 11.357 -5.220 1.00 . B B . 50 TYR HD1 1 1 16 11625 2 2 6 TYR HD2 H -5.300 8.469 -2.866 1.00 . B B . 50 TYR HD2 1 1 16 11626 2 2 6 TYR HE1 H -4.269 10.503 -7.268 1.00 . B B . 50 TYR HE1 1 1 16 11627 2 2 6 TYR HE2 H -6.403 7.615 -4.914 1.00 . B B . 50 TYR HE2 1 1 16 11628 2 2 6 TYR HH H -5.376 8.018 -7.859 1.00 . B B . 50 TYR HH 1 1 16 11629 2 2 6 TYR N N -2.464 12.456 -1.755 1.00 . B B . 50 TYR N 1 1 16 11630 2 2 6 TYR O O -4.980 12.627 -0.812 1.00 . B B . 50 TYR O 1 1 16 11631 2 2 6 TYR OXT O -5.882 12.586 -2.768 1.00 . B B . 50 TYR OXT 1 1 16 11632 2 2 6 TYR OH O -6.022 8.529 -7.364 1.00 . B B . 50 TYR OH 1 1 17 11633 1 1 1 PHE C C 2.468 -18.329 10.952 1.00 . A A . 5 PHE C 1 1 17 11634 1 1 1 PHE CA C 3.392 -18.802 9.825 1.00 . A A . 5 PHE CA 1 1 17 11635 1 1 1 PHE CB C 2.683 -19.835 8.950 1.00 . A A . 5 PHE CB 1 1 17 11636 1 1 1 PHE CD1 C 4.468 -21.381 8.067 1.00 . A A . 5 PHE CD1 1 1 17 11637 1 1 1 PHE CD2 C 3.630 -19.623 6.624 1.00 . A A . 5 PHE CD2 1 1 17 11638 1 1 1 PHE CE1 C 5.333 -21.804 7.051 1.00 . A A . 5 PHE CE1 1 1 17 11639 1 1 1 PHE CE2 C 4.495 -20.046 5.606 1.00 . A A . 5 PHE CE2 1 1 17 11640 1 1 1 PHE CG C 3.616 -20.291 7.853 1.00 . A A . 5 PHE CG 1 1 17 11641 1 1 1 PHE CZ C 5.347 -21.136 5.821 1.00 . A A . 5 PHE CZ 1 1 17 11642 1 1 1 PHE HA H 3.712 -17.966 9.223 1.00 . A A . 5 PHE HA 1 1 17 11643 1 1 1 PHE HB2 H 2.397 -20.684 9.555 1.00 . A A . 5 PHE HB2 1 1 17 11644 1 1 1 PHE HB3 H 1.802 -19.392 8.510 1.00 . A A . 5 PHE HB3 1 1 17 11645 1 1 1 PHE HD1 H 4.458 -21.896 9.017 1.00 . A A . 5 PHE HD1 1 1 17 11646 1 1 1 PHE HD2 H 2.973 -18.782 6.458 1.00 . A A . 5 PHE HD2 1 1 17 11647 1 1 1 PHE HE1 H 5.992 -22.645 7.216 1.00 . A A . 5 PHE HE1 1 1 17 11648 1 1 1 PHE HE2 H 4.505 -19.530 4.658 1.00 . A A . 5 PHE HE2 1 1 17 11649 1 1 1 PHE HZ H 6.014 -21.461 5.036 1.00 . A A . 5 PHE HZ 1 1 17 11650 1 1 1 PHE N N 4.572 -19.518 10.391 1.00 . A A . 5 PHE N 1 1 17 11651 1 1 1 PHE O O 2.059 -19.100 11.796 1.00 . A A . 5 PHE O 1 1 17 11652 1 1 2 GLU C C -0.195 -16.444 11.527 1.00 . A A . 6 GLU C 1 1 17 11653 1 1 2 GLU CA C 1.243 -16.547 12.043 1.00 . A A . 6 GLU CA 1 1 17 11654 1 1 2 GLU CB C 1.791 -15.161 12.380 1.00 . A A . 6 GLU CB 1 1 17 11655 1 1 2 GLU CD C 1.941 -14.851 14.855 1.00 . A A . 6 GLU CD 1 1 17 11656 1 1 2 GLU CG C 1.075 -14.614 13.615 1.00 . A A . 6 GLU CG 1 1 17 11657 1 1 2 GLU H H 2.480 -16.461 10.281 1.00 . A A . 6 GLU H 1 1 17 11658 1 1 2 GLU HA H 1.287 -17.181 12.914 1.00 . A A . 6 GLU HA 1 1 17 11659 1 1 2 GLU HB2 H 2.851 -15.231 12.580 1.00 . A A . 6 GLU HB2 1 1 17 11660 1 1 2 GLU HB3 H 1.627 -14.495 11.545 1.00 . A A . 6 GLU HB3 1 1 17 11661 1 1 2 GLU HG2 H 0.904 -13.554 13.493 1.00 . A A . 6 GLU HG2 1 1 17 11662 1 1 2 GLU HG3 H 0.129 -15.119 13.736 1.00 . A A . 6 GLU HG3 1 1 17 11663 1 1 2 GLU N N 2.139 -17.067 10.972 1.00 . A A . 6 GLU N 1 1 17 11664 1 1 2 GLU O O -1.113 -16.987 12.108 1.00 . A A . 6 GLU O 1 1 17 11665 1 1 2 GLU OE1 O 2.724 -15.785 14.835 1.00 . A A . 6 GLU OE1 1 1 17 11666 1 1 2 GLU OE2 O 1.805 -14.092 15.801 1.00 . A A . 6 GLU OE2 1 1 17 11667 1 1 3 ILE C C -1.789 -15.979 8.398 1.00 . A A . 7 ILE C 1 1 17 11668 1 1 3 ILE CA C -1.777 -15.615 9.889 1.00 . A A . 7 ILE CA 1 1 17 11669 1 1 3 ILE CB C -2.138 -14.143 10.083 1.00 . A A . 7 ILE CB 1 1 17 11670 1 1 3 ILE CD1 C -1.478 -11.794 9.542 1.00 . A A . 7 ILE CD1 1 1 17 11671 1 1 3 ILE CG1 C -1.099 -13.267 9.376 1.00 . A A . 7 ILE CG1 1 1 17 11672 1 1 3 ILE CG2 C -2.148 -13.812 11.577 1.00 . A A . 7 ILE CG2 1 1 17 11673 1 1 3 ILE H H 0.356 -15.320 9.987 1.00 . A A . 7 ILE H 1 1 17 11674 1 1 3 ILE HA H -2.465 -16.239 10.436 1.00 . A A . 7 ILE HA 1 1 17 11675 1 1 3 ILE HB H -3.116 -13.954 9.665 1.00 . A A . 7 ILE HB 1 1 17 11676 1 1 3 ILE HD11 H -0.620 -11.175 9.325 1.00 . A A . 7 ILE HD11 1 1 17 11677 1 1 3 ILE HD12 H -1.803 -11.617 10.557 1.00 . A A . 7 ILE HD12 1 1 17 11678 1 1 3 ILE HD13 H -2.279 -11.549 8.860 1.00 . A A . 7 ILE HD13 1 1 17 11679 1 1 3 ILE HG12 H -0.127 -13.439 9.812 1.00 . A A . 7 ILE HG12 1 1 17 11680 1 1 3 ILE HG13 H -1.073 -13.517 8.326 1.00 . A A . 7 ILE HG13 1 1 17 11681 1 1 3 ILE HG21 H -1.332 -13.144 11.804 1.00 . A A . 7 ILE HG21 1 1 17 11682 1 1 3 ILE HG22 H -2.038 -14.722 12.148 1.00 . A A . 7 ILE HG22 1 1 17 11683 1 1 3 ILE HG23 H -3.085 -13.338 11.833 1.00 . A A . 7 ILE HG23 1 1 17 11684 1 1 3 ILE N N -0.397 -15.751 10.440 1.00 . A A . 7 ILE N 1 1 17 11685 1 1 3 ILE O O -0.759 -15.978 7.756 1.00 . A A . 7 ILE O 1 1 17 11686 1 1 4 PRO C C -2.917 -15.417 5.573 1.00 . A A . 8 PRO C 1 1 17 11687 1 1 4 PRO CA C -3.094 -16.652 6.461 1.00 . A A . 8 PRO CA 1 1 17 11688 1 1 4 PRO CB C -4.515 -17.197 6.360 1.00 . A A . 8 PRO CB 1 1 17 11689 1 1 4 PRO CD C -4.258 -16.313 8.591 1.00 . A A . 8 PRO CD 1 1 17 11690 1 1 4 PRO CG C -5.257 -16.556 7.490 1.00 . A A . 8 PRO CG 1 1 17 11691 1 1 4 PRO HA H -2.383 -17.419 6.198 1.00 . A A . 8 PRO HA 1 1 17 11692 1 1 4 PRO HB2 H -4.957 -16.915 5.415 1.00 . A A . 8 PRO HB2 1 1 17 11693 1 1 4 PRO HB3 H -4.516 -18.270 6.471 1.00 . A A . 8 PRO HB3 1 1 17 11694 1 1 4 PRO HD2 H -4.448 -15.365 9.073 1.00 . A A . 8 PRO HD2 1 1 17 11695 1 1 4 PRO HD3 H -4.280 -17.117 9.310 1.00 . A A . 8 PRO HD3 1 1 17 11696 1 1 4 PRO HG2 H -5.685 -15.619 7.167 1.00 . A A . 8 PRO HG2 1 1 17 11697 1 1 4 PRO HG3 H -6.036 -17.217 7.842 1.00 . A A . 8 PRO HG3 1 1 17 11698 1 1 4 PRO N N -2.961 -16.283 7.892 1.00 . A A . 8 PRO N 1 1 17 11699 1 1 4 PRO O O -2.366 -15.494 4.493 1.00 . A A . 8 PRO O 1 1 17 11700 1 1 5 ASP C C -3.630 -13.266 3.761 1.00 . A A . 9 ASP C 1 1 17 11701 1 1 5 ASP CA C -3.233 -13.028 5.223 1.00 . A A . 9 ASP CA 1 1 17 11702 1 1 5 ASP CB C -1.755 -12.675 5.333 1.00 . A A . 9 ASP CB 1 1 17 11703 1 1 5 ASP CG C -1.500 -11.315 4.680 1.00 . A A . 9 ASP CG 1 1 17 11704 1 1 5 ASP H H -3.802 -14.241 6.903 1.00 . A A . 9 ASP H 1 1 17 11705 1 1 5 ASP HA H -3.829 -12.238 5.650 1.00 . A A . 9 ASP HA 1 1 17 11706 1 1 5 ASP HB2 H -1.478 -12.634 6.377 1.00 . A A . 9 ASP HB2 1 1 17 11707 1 1 5 ASP HB3 H -1.167 -13.432 4.835 1.00 . A A . 9 ASP HB3 1 1 17 11708 1 1 5 ASP N N -3.374 -14.278 6.027 1.00 . A A . 9 ASP N 1 1 17 11709 1 1 5 ASP O O -2.791 -13.345 2.884 1.00 . A A . 9 ASP O 1 1 17 11710 1 1 5 ASP OD1 O -2.429 -10.525 4.623 1.00 . A A . 9 ASP OD1 1 1 17 11711 1 1 5 ASP OD2 O -0.381 -11.086 4.249 1.00 . A A . 9 ASP OD2 1 1 17 11712 1 1 6 ASP C C -4.781 -12.532 1.165 1.00 . A A . 10 ASP C 1 1 17 11713 1 1 6 ASP CA C -5.350 -13.612 2.089 1.00 . A A . 10 ASP CA 1 1 17 11714 1 1 6 ASP CB C -6.875 -13.525 2.142 1.00 . A A . 10 ASP CB 1 1 17 11715 1 1 6 ASP CG C -7.480 -14.669 1.326 1.00 . A A . 10 ASP CG 1 1 17 11716 1 1 6 ASP H H -5.562 -13.314 4.213 1.00 . A A . 10 ASP H 1 1 17 11717 1 1 6 ASP HA H -5.049 -14.592 1.755 1.00 . A A . 10 ASP HA 1 1 17 11718 1 1 6 ASP HB2 H -7.205 -13.600 3.168 1.00 . A A . 10 ASP HB2 1 1 17 11719 1 1 6 ASP HB3 H -7.195 -12.579 1.728 1.00 . A A . 10 ASP HB3 1 1 17 11720 1 1 6 ASP N N -4.902 -13.381 3.492 1.00 . A A . 10 ASP N 1 1 17 11721 1 1 6 ASP O O -4.096 -12.820 0.206 1.00 . A A . 10 ASP O 1 1 17 11722 1 1 6 ASP OD1 O -7.330 -14.651 0.116 1.00 . A A . 10 ASP OD1 1 1 17 11723 1 1 6 ASP OD2 O -8.082 -15.544 1.927 1.00 . A A . 10 ASP OD2 1 1 17 11724 1 1 7 VAL C C -3.929 -9.080 1.455 1.00 . A A . 11 VAL C 1 1 17 11725 1 1 7 VAL CA C -4.535 -10.191 0.588 1.00 . A A . 11 VAL CA 1 1 17 11726 1 1 7 VAL CB C -5.753 -9.671 -0.177 1.00 . A A . 11 VAL CB 1 1 17 11727 1 1 7 VAL CG1 C -6.836 -9.248 0.817 1.00 . A A . 11 VAL CG1 1 1 17 11728 1 1 7 VAL CG2 C -5.346 -8.468 -1.030 1.00 . A A . 11 VAL CG2 1 1 17 11729 1 1 7 VAL H H -5.615 -11.077 2.229 1.00 . A A . 11 VAL H 1 1 17 11730 1 1 7 VAL HA H -3.802 -10.574 -0.104 1.00 . A A . 11 VAL HA 1 1 17 11731 1 1 7 VAL HB H -6.137 -10.452 -0.816 1.00 . A A . 11 VAL HB 1 1 17 11732 1 1 7 VAL HG11 H -6.442 -9.296 1.823 1.00 . A A . 11 VAL HG11 1 1 17 11733 1 1 7 VAL HG12 H -7.684 -9.912 0.730 1.00 . A A . 11 VAL HG12 1 1 17 11734 1 1 7 VAL HG13 H -7.149 -8.237 0.601 1.00 . A A . 11 VAL HG13 1 1 17 11735 1 1 7 VAL HG21 H -6.231 -7.982 -1.412 1.00 . A A . 11 VAL HG21 1 1 17 11736 1 1 7 VAL HG22 H -4.734 -8.803 -1.854 1.00 . A A . 11 VAL HG22 1 1 17 11737 1 1 7 VAL HG23 H -4.784 -7.771 -0.425 1.00 . A A . 11 VAL HG23 1 1 17 11738 1 1 7 VAL N N -5.060 -11.289 1.450 1.00 . A A . 11 VAL N 1 1 17 11739 1 1 7 VAL O O -4.422 -8.801 2.530 1.00 . A A . 11 VAL O 1 1 17 11740 1 1 8 PRO C C -3.071 -6.120 1.697 1.00 . A A . 12 PRO C 1 1 17 11741 1 1 8 PRO CA C -2.207 -7.385 1.713 1.00 . A A . 12 PRO CA 1 1 17 11742 1 1 8 PRO CB C -0.905 -7.164 0.948 1.00 . A A . 12 PRO CB 1 1 17 11743 1 1 8 PRO CD C -2.211 -8.743 -0.325 1.00 . A A . 12 PRO CD 1 1 17 11744 1 1 8 PRO CG C -1.184 -7.646 -0.439 1.00 . A A . 12 PRO CG 1 1 17 11745 1 1 8 PRO HA H -1.996 -7.693 2.725 1.00 . A A . 12 PRO HA 1 1 17 11746 1 1 8 PRO HB2 H -0.651 -6.114 0.938 1.00 . A A . 12 PRO HB2 1 1 17 11747 1 1 8 PRO HB3 H -0.108 -7.741 1.393 1.00 . A A . 12 PRO HB3 1 1 17 11748 1 1 8 PRO HD2 H -2.921 -8.683 -1.138 1.00 . A A . 12 PRO HD2 1 1 17 11749 1 1 8 PRO HD3 H -1.732 -9.711 -0.311 1.00 . A A . 12 PRO HD3 1 1 17 11750 1 1 8 PRO HG2 H -1.574 -6.837 -1.039 1.00 . A A . 12 PRO HG2 1 1 17 11751 1 1 8 PRO HG3 H -0.280 -8.033 -0.884 1.00 . A A . 12 PRO HG3 1 1 17 11752 1 1 8 PRO N N -2.875 -8.476 0.961 1.00 . A A . 12 PRO N 1 1 17 11753 1 1 8 PRO O O -3.322 -5.516 2.721 1.00 . A A . 12 PRO O 1 1 17 11754 1 1 9 LEU C C -5.805 -4.866 0.051 1.00 . A A . 13 LEU C 1 1 17 11755 1 1 9 LEU CA C -4.374 -4.492 0.465 1.00 . A A . 13 LEU CA 1 1 17 11756 1 1 9 LEU CB C -3.712 -3.622 -0.607 1.00 . A A . 13 LEU CB 1 1 17 11757 1 1 9 LEU CD1 C -1.334 -4.148 -1.188 1.00 . A A . 13 LEU CD1 1 1 17 11758 1 1 9 LEU CD2 C -1.938 -1.881 -0.330 1.00 . A A . 13 LEU CD2 1 1 17 11759 1 1 9 LEU CG C -2.247 -3.377 -0.233 1.00 . A A . 13 LEU CG 1 1 17 11760 1 1 9 LEU H H -3.313 -6.217 -0.271 1.00 . A A . 13 LEU H 1 1 17 11761 1 1 9 LEU HA H -4.374 -3.974 1.411 1.00 . A A . 13 LEU HA 1 1 17 11762 1 1 9 LEU HB2 H -3.761 -4.127 -1.560 1.00 . A A . 13 LEU HB2 1 1 17 11763 1 1 9 LEU HB3 H -4.230 -2.677 -0.674 1.00 . A A . 13 LEU HB3 1 1 17 11764 1 1 9 LEU HD11 H -0.571 -3.487 -1.570 1.00 . A A . 13 LEU HD11 1 1 17 11765 1 1 9 LEU HD12 H -1.916 -4.537 -2.010 1.00 . A A . 13 LEU HD12 1 1 17 11766 1 1 9 LEU HD13 H -0.868 -4.967 -0.659 1.00 . A A . 13 LEU HD13 1 1 17 11767 1 1 9 LEU HD21 H -2.121 -1.542 -1.339 1.00 . A A . 13 LEU HD21 1 1 17 11768 1 1 9 LEU HD22 H -0.902 -1.710 -0.076 1.00 . A A . 13 LEU HD22 1 1 17 11769 1 1 9 LEU HD23 H -2.571 -1.336 0.353 1.00 . A A . 13 LEU HD23 1 1 17 11770 1 1 9 LEU HG H -2.074 -3.713 0.779 1.00 . A A . 13 LEU HG 1 1 17 11771 1 1 9 LEU N N -3.527 -5.716 0.544 1.00 . A A . 13 LEU N 1 1 17 11772 1 1 9 LEU O O -5.996 -5.706 -0.806 1.00 . A A . 13 LEU O 1 1 17 11773 1 1 10 PRO C C -8.570 -3.934 -1.006 1.00 . A A . 14 PRO C 1 1 17 11774 1 1 10 PRO CA C -8.194 -4.526 0.356 1.00 . A A . 14 PRO CA 1 1 17 11775 1 1 10 PRO CB C -8.963 -3.841 1.482 1.00 . A A . 14 PRO CB 1 1 17 11776 1 1 10 PRO CD C -6.644 -3.210 1.723 1.00 . A A . 14 PRO CD 1 1 17 11777 1 1 10 PRO CG C -8.060 -2.753 1.967 1.00 . A A . 14 PRO CG 1 1 17 11778 1 1 10 PRO HA H -8.378 -5.587 0.374 1.00 . A A . 14 PRO HA 1 1 17 11779 1 1 10 PRO HB2 H -9.885 -3.423 1.105 1.00 . A A . 14 PRO HB2 1 1 17 11780 1 1 10 PRO HB3 H -9.167 -4.542 2.278 1.00 . A A . 14 PRO HB3 1 1 17 11781 1 1 10 PRO HD2 H -6.037 -2.386 1.373 1.00 . A A . 14 PRO HD2 1 1 17 11782 1 1 10 PRO HD3 H -6.223 -3.635 2.620 1.00 . A A . 14 PRO HD3 1 1 17 11783 1 1 10 PRO HG2 H -8.254 -1.842 1.421 1.00 . A A . 14 PRO HG2 1 1 17 11784 1 1 10 PRO HG3 H -8.216 -2.590 3.022 1.00 . A A . 14 PRO HG3 1 1 17 11785 1 1 10 PRO N N -6.772 -4.235 0.676 1.00 . A A . 14 PRO N 1 1 17 11786 1 1 10 PRO O O -7.719 -3.611 -1.810 1.00 . A A . 14 PRO O 1 1 17 11787 1 1 11 ALA C C -10.027 -1.718 -2.624 1.00 . A A . 15 ALA C 1 1 17 11788 1 1 11 ALA CA C -10.272 -3.230 -2.586 1.00 . A A . 15 ALA CA 1 1 17 11789 1 1 11 ALA CB C -11.768 -3.532 -2.674 1.00 . A A . 15 ALA CB 1 1 17 11790 1 1 11 ALA H H -10.513 -4.067 -0.614 1.00 . A A . 15 ALA H 1 1 17 11791 1 1 11 ALA HA H -9.751 -3.716 -3.395 1.00 . A A . 15 ALA HA 1 1 17 11792 1 1 11 ALA HB1 H -11.912 -4.585 -2.871 1.00 . A A . 15 ALA HB1 1 1 17 11793 1 1 11 ALA HB2 H -12.207 -2.953 -3.473 1.00 . A A . 15 ALA HB2 1 1 17 11794 1 1 11 ALA HB3 H -12.244 -3.273 -1.740 1.00 . A A . 15 ALA HB3 1 1 17 11795 1 1 11 ALA N N -9.841 -3.796 -1.274 1.00 . A A . 15 ALA N 1 1 17 11796 1 1 11 ALA O O -9.685 -1.109 -1.630 1.00 . A A . 15 ALA O 1 1 17 11797 1 1 12 GLY C C -8.502 0.688 -3.610 1.00 . A A . 16 GLY C 1 1 17 11798 1 1 12 GLY CA C -9.977 0.361 -3.873 1.00 . A A . 16 GLY CA 1 1 17 11799 1 1 12 GLY H H -10.475 -1.622 -4.556 1.00 . A A . 16 GLY H 1 1 17 11800 1 1 12 GLY HA2 H -10.245 0.694 -4.865 1.00 . A A . 16 GLY HA2 1 1 17 11801 1 1 12 GLY HA3 H -10.592 0.870 -3.146 1.00 . A A . 16 GLY HA3 1 1 17 11802 1 1 12 GLY N N -10.200 -1.110 -3.766 1.00 . A A . 16 GLY N 1 1 17 11803 1 1 12 GLY O O -8.141 1.828 -3.395 1.00 . A A . 16 GLY O 1 1 17 11804 1 1 13 TRP C C -5.375 -0.286 -4.624 1.00 . A A . 17 TRP C 1 1 17 11805 1 1 13 TRP CA C -6.201 -0.035 -3.360 1.00 . A A . 17 TRP CA 1 1 17 11806 1 1 13 TRP CB C -5.819 -1.031 -2.271 1.00 . A A . 17 TRP CB 1 1 17 11807 1 1 13 TRP CD1 C -7.012 -0.440 -0.129 1.00 . A A . 17 TRP CD1 1 1 17 11808 1 1 13 TRP CD2 C -4.961 0.463 -0.266 1.00 . A A . 17 TRP CD2 1 1 17 11809 1 1 13 TRP CE2 C -5.499 0.876 0.974 1.00 . A A . 17 TRP CE2 1 1 17 11810 1 1 13 TRP CE3 C -3.673 0.896 -0.608 1.00 . A A . 17 TRP CE3 1 1 17 11811 1 1 13 TRP CG C -5.936 -0.370 -0.943 1.00 . A A . 17 TRP CG 1 1 17 11812 1 1 13 TRP CH2 C -3.492 2.112 1.486 1.00 . A A . 17 TRP CH2 1 1 17 11813 1 1 13 TRP CZ2 C -4.775 1.692 1.847 1.00 . A A . 17 TRP CZ2 1 1 17 11814 1 1 13 TRP CZ3 C -2.945 1.714 0.261 1.00 . A A . 17 TRP CZ3 1 1 17 11815 1 1 13 TRP H H -7.949 -1.214 -3.785 1.00 . A A . 17 TRP H 1 1 17 11816 1 1 13 TRP HA H -6.056 0.973 -3.005 1.00 . A A . 17 TRP HA 1 1 17 11817 1 1 13 TRP HB2 H -6.484 -1.882 -2.312 1.00 . A A . 17 TRP HB2 1 1 17 11818 1 1 13 TRP HB3 H -4.802 -1.362 -2.423 1.00 . A A . 17 TRP HB3 1 1 17 11819 1 1 13 TRP HD1 H -7.923 -0.983 -0.338 1.00 . A A . 17 TRP HD1 1 1 17 11820 1 1 13 TRP HE1 H -7.373 0.412 1.767 1.00 . A A . 17 TRP HE1 1 1 17 11821 1 1 13 TRP HE3 H -3.240 0.595 -1.551 1.00 . A A . 17 TRP HE3 1 1 17 11822 1 1 13 TRP HH2 H -2.920 2.743 2.150 1.00 . A A . 17 TRP HH2 1 1 17 11823 1 1 13 TRP HZ2 H -5.205 1.995 2.790 1.00 . A A . 17 TRP HZ2 1 1 17 11824 1 1 13 TRP HZ3 H -1.960 2.040 -0.013 1.00 . A A . 17 TRP HZ3 1 1 17 11825 1 1 13 TRP N N -7.646 -0.300 -3.617 1.00 . A A . 17 TRP N 1 1 17 11826 1 1 13 TRP NE1 N -6.755 0.299 1.013 1.00 . A A . 17 TRP NE1 1 1 17 11827 1 1 13 TRP O O -5.694 -1.143 -5.423 1.00 . A A . 17 TRP O 1 1 17 11828 1 1 14 GLU C C -1.990 0.328 -5.721 1.00 . A A . 18 GLU C 1 1 17 11829 1 1 14 GLU CA C -3.481 0.239 -6.037 1.00 . A A . 18 GLU CA 1 1 17 11830 1 1 14 GLU CB C -3.849 1.380 -6.986 1.00 . A A . 18 GLU CB 1 1 17 11831 1 1 14 GLU CD C -2.600 0.224 -8.818 1.00 . A A . 18 GLU CD 1 1 17 11832 1 1 14 GLU CG C -3.939 0.849 -8.418 1.00 . A A . 18 GLU CG 1 1 17 11833 1 1 14 GLU H H -4.067 1.146 -4.164 1.00 . A A . 18 GLU H 1 1 17 11834 1 1 14 GLU HA H -3.716 -0.707 -6.494 1.00 . A A . 18 GLU HA 1 1 17 11835 1 1 14 GLU HB2 H -4.793 1.804 -6.696 1.00 . A A . 18 GLU HB2 1 1 17 11836 1 1 14 GLU HB3 H -3.087 2.144 -6.936 1.00 . A A . 18 GLU HB3 1 1 17 11837 1 1 14 GLU HG2 H -4.717 0.104 -8.478 1.00 . A A . 18 GLU HG2 1 1 17 11838 1 1 14 GLU HG3 H -4.168 1.664 -9.089 1.00 . A A . 18 GLU HG3 1 1 17 11839 1 1 14 GLU N N -4.313 0.453 -4.816 1.00 . A A . 18 GLU N 1 1 17 11840 1 1 14 GLU O O -1.428 1.409 -5.698 1.00 . A A . 18 GLU O 1 1 17 11841 1 1 14 GLU OE1 O -1.670 0.972 -9.066 1.00 . A A . 18 GLU OE1 1 1 17 11842 1 1 14 GLU OE2 O -2.530 -0.993 -8.870 1.00 . A A . 18 GLU OE2 1 1 17 11843 1 1 15 MET C C 0.775 -0.077 -6.510 1.00 . A A . 19 MET C 1 1 17 11844 1 1 15 MET CA C 0.141 -0.688 -5.272 1.00 . A A . 19 MET CA 1 1 17 11845 1 1 15 MET CB C 0.663 -2.100 -5.057 1.00 . A A . 19 MET CB 1 1 17 11846 1 1 15 MET CE C -1.466 -4.214 -4.517 1.00 . A A . 19 MET CE 1 1 17 11847 1 1 15 MET CG C 0.266 -3.001 -6.230 1.00 . A A . 19 MET CG 1 1 17 11848 1 1 15 MET H H -1.759 -1.652 -5.566 1.00 . A A . 19 MET H 1 1 17 11849 1 1 15 MET HA H 0.338 -0.079 -4.407 1.00 . A A . 19 MET HA 1 1 17 11850 1 1 15 MET HB2 H 1.731 -2.051 -4.998 1.00 . A A . 19 MET HB2 1 1 17 11851 1 1 15 MET HB3 H 0.274 -2.501 -4.132 1.00 . A A . 19 MET HB3 1 1 17 11852 1 1 15 MET HE1 H -1.066 -3.802 -3.601 1.00 . A A . 19 MET HE1 1 1 17 11853 1 1 15 MET HE2 H -2.049 -5.090 -4.289 1.00 . A A . 19 MET HE2 1 1 17 11854 1 1 15 MET HE3 H -2.094 -3.482 -5.004 1.00 . A A . 19 MET HE3 1 1 17 11855 1 1 15 MET HG2 H -0.604 -2.596 -6.724 1.00 . A A . 19 MET HG2 1 1 17 11856 1 1 15 MET HG3 H 1.083 -3.051 -6.933 1.00 . A A . 19 MET HG3 1 1 17 11857 1 1 15 MET N N -1.319 -0.783 -5.520 1.00 . A A . 19 MET N 1 1 17 11858 1 1 15 MET O O 0.712 -0.625 -7.593 1.00 . A A . 19 MET O 1 1 17 11859 1 1 15 MET SD S -0.104 -4.665 -5.619 1.00 . A A . 19 MET SD 1 1 17 11860 1 1 16 ALA C C 3.373 2.208 -7.161 1.00 . A A . 20 ALA C 1 1 17 11861 1 1 16 ALA CA C 1.971 1.736 -7.530 1.00 . A A . 20 ALA CA 1 1 17 11862 1 1 16 ALA CB C 1.032 2.909 -7.826 1.00 . A A . 20 ALA CB 1 1 17 11863 1 1 16 ALA H H 1.378 1.482 -5.480 1.00 . A A . 20 ALA H 1 1 17 11864 1 1 16 ALA HA H 2.006 1.069 -8.377 1.00 . A A . 20 ALA HA 1 1 17 11865 1 1 16 ALA HB1 H 0.663 3.319 -6.896 1.00 . A A . 20 ALA HB1 1 1 17 11866 1 1 16 ALA HB2 H 0.194 2.559 -8.416 1.00 . A A . 20 ALA HB2 1 1 17 11867 1 1 16 ALA HB3 H 1.562 3.672 -8.372 1.00 . A A . 20 ALA HB3 1 1 17 11868 1 1 16 ALA N N 1.356 1.061 -6.363 1.00 . A A . 20 ALA N 1 1 17 11869 1 1 16 ALA O O 3.909 1.817 -6.142 1.00 . A A . 20 ALA O 1 1 17 11870 1 1 17 LYS C C 5.452 4.990 -7.529 1.00 . A A . 21 LYS C 1 1 17 11871 1 1 17 LYS CA C 5.365 3.472 -7.628 1.00 . A A . 21 LYS CA 1 1 17 11872 1 1 17 LYS CB C 6.255 2.947 -8.753 1.00 . A A . 21 LYS CB 1 1 17 11873 1 1 17 LYS CD C 8.403 1.759 -9.224 1.00 . A A . 21 LYS CD 1 1 17 11874 1 1 17 LYS CE C 9.894 2.083 -9.115 1.00 . A A . 21 LYS CE 1 1 17 11875 1 1 17 LYS CG C 7.626 2.571 -8.186 1.00 . A A . 21 LYS CG 1 1 17 11876 1 1 17 LYS H H 3.557 3.325 -8.799 1.00 . A A . 21 LYS H 1 1 17 11877 1 1 17 LYS HA H 5.657 3.034 -6.692 1.00 . A A . 21 LYS HA 1 1 17 11878 1 1 17 LYS HB2 H 5.799 2.075 -9.197 1.00 . A A . 21 LYS HB2 1 1 17 11879 1 1 17 LYS HB3 H 6.376 3.713 -9.505 1.00 . A A . 21 LYS HB3 1 1 17 11880 1 1 17 LYS HD2 H 8.250 0.705 -9.045 1.00 . A A . 21 LYS HD2 1 1 17 11881 1 1 17 LYS HD3 H 8.051 2.010 -10.215 1.00 . A A . 21 LYS HD3 1 1 17 11882 1 1 17 LYS HE2 H 10.041 3.149 -9.020 1.00 . A A . 21 LYS HE2 1 1 17 11883 1 1 17 LYS HE3 H 10.331 1.566 -8.273 1.00 . A A . 21 LYS HE3 1 1 17 11884 1 1 17 LYS HG2 H 8.176 3.469 -7.948 1.00 . A A . 21 LYS HG2 1 1 17 11885 1 1 17 LYS HG3 H 7.495 1.980 -7.291 1.00 . A A . 21 LYS HG3 1 1 17 11886 1 1 17 LYS HZ1 H 9.923 1.938 -11.192 1.00 . A A . 21 LYS HZ1 1 1 17 11887 1 1 17 LYS HZ2 H 10.489 0.550 -10.391 1.00 . A A . 21 LYS HZ2 1 1 17 11888 1 1 17 LYS HZ3 H 11.462 1.939 -10.477 1.00 . A A . 21 LYS HZ3 1 1 17 11889 1 1 17 LYS N N 3.989 3.023 -7.972 1.00 . A A . 21 LYS N 1 1 17 11890 1 1 17 LYS NZ N 10.486 1.590 -10.390 1.00 . A A . 21 LYS NZ 1 1 17 11891 1 1 17 LYS O O 4.903 5.718 -8.332 1.00 . A A . 21 LYS O 1 1 17 11892 1 1 18 THR C C 7.752 7.302 -6.161 1.00 . A A . 22 THR C 1 1 17 11893 1 1 18 THR CA C 6.282 6.933 -6.347 1.00 . A A . 22 THR CA 1 1 17 11894 1 1 18 THR CB C 5.503 7.239 -5.071 1.00 . A A . 22 THR CB 1 1 17 11895 1 1 18 THR CG2 C 6.100 6.423 -3.914 1.00 . A A . 22 THR CG2 1 1 17 11896 1 1 18 THR H H 6.576 4.848 -5.901 1.00 . A A . 22 THR H 1 1 17 11897 1 1 18 THR HA H 5.855 7.466 -7.181 1.00 . A A . 22 THR HA 1 1 17 11898 1 1 18 THR HB H 4.465 6.967 -5.206 1.00 . A A . 22 THR HB 1 1 17 11899 1 1 18 THR HG1 H 5.566 8.756 -3.838 1.00 . A A . 22 THR HG1 1 1 17 11900 1 1 18 THR HG21 H 6.007 5.369 -4.129 1.00 . A A . 22 THR HG21 1 1 17 11901 1 1 18 THR HG22 H 5.576 6.651 -2.998 1.00 . A A . 22 THR HG22 1 1 17 11902 1 1 18 THR HG23 H 7.143 6.673 -3.805 1.00 . A A . 22 THR HG23 1 1 17 11903 1 1 18 THR N N 6.145 5.465 -6.533 1.00 . A A . 22 THR N 1 1 17 11904 1 1 18 THR O O 8.638 6.535 -6.480 1.00 . A A . 22 THR O 1 1 17 11905 1 1 18 THR OG1 O 5.601 8.633 -4.789 1.00 . A A . 22 THR OG1 1 1 17 11906 1 1 19 SER C C 10.313 8.578 -6.602 1.00 . A A . 23 SER C 1 1 17 11907 1 1 19 SER CA C 9.417 8.921 -5.398 1.00 . A A . 23 SER CA 1 1 17 11908 1 1 19 SER CB C 9.858 8.164 -4.139 1.00 . A A . 23 SER CB 1 1 17 11909 1 1 19 SER H H 7.261 9.055 -5.378 1.00 . A A . 23 SER H 1 1 17 11910 1 1 19 SER HA H 9.441 9.983 -5.209 1.00 . A A . 23 SER HA 1 1 17 11911 1 1 19 SER HB2 H 10.862 8.458 -3.872 1.00 . A A . 23 SER HB2 1 1 17 11912 1 1 19 SER HB3 H 9.189 8.405 -3.326 1.00 . A A . 23 SER HB3 1 1 17 11913 1 1 19 SER HG H 10.252 6.591 -5.216 1.00 . A A . 23 SER HG 1 1 17 11914 1 1 19 SER N N 8.006 8.471 -5.633 1.00 . A A . 23 SER N 1 1 17 11915 1 1 19 SER O O 9.874 8.604 -7.734 1.00 . A A . 23 SER O 1 1 17 11916 1 1 19 SER OG O 9.820 6.764 -4.378 1.00 . A A . 23 SER OG 1 1 17 11917 1 1 20 SER C C 12.595 6.392 -7.638 1.00 . A A . 24 SER C 1 1 17 11918 1 1 20 SER CA C 12.460 7.910 -7.508 1.00 . A A . 24 SER CA 1 1 17 11919 1 1 20 SER CB C 13.806 8.543 -7.152 1.00 . A A . 24 SER CB 1 1 17 11920 1 1 20 SER H H 11.900 8.235 -5.455 1.00 . A A . 24 SER H 1 1 17 11921 1 1 20 SER HA H 12.085 8.333 -8.423 1.00 . A A . 24 SER HA 1 1 17 11922 1 1 20 SER HB2 H 13.708 9.618 -7.139 1.00 . A A . 24 SER HB2 1 1 17 11923 1 1 20 SER HB3 H 14.118 8.198 -6.176 1.00 . A A . 24 SER HB3 1 1 17 11924 1 1 20 SER HG H 15.289 7.440 -7.758 1.00 . A A . 24 SER HG 1 1 17 11925 1 1 20 SER N N 11.558 8.254 -6.371 1.00 . A A . 24 SER N 1 1 17 11926 1 1 20 SER O O 12.939 5.875 -8.683 1.00 . A A . 24 SER O 1 1 17 11927 1 1 20 SER OG O 14.776 8.166 -8.119 1.00 . A A . 24 SER OG 1 1 17 11928 1 1 21 GLY C C 11.811 3.577 -5.387 1.00 . A A . 25 GLY C 1 1 17 11929 1 1 21 GLY CA C 12.436 4.189 -6.644 1.00 . A A . 25 GLY CA 1 1 17 11930 1 1 21 GLY H H 12.050 6.112 -5.754 1.00 . A A . 25 GLY H 1 1 17 11931 1 1 21 GLY HA2 H 11.915 3.824 -7.518 1.00 . A A . 25 GLY HA2 1 1 17 11932 1 1 21 GLY HA3 H 13.477 3.906 -6.702 1.00 . A A . 25 GLY HA3 1 1 17 11933 1 1 21 GLY N N 12.326 5.673 -6.585 1.00 . A A . 25 GLY N 1 1 17 11934 1 1 21 GLY O O 12.484 3.327 -4.406 1.00 . A A . 25 GLY O 1 1 17 11935 1 1 22 GLN C C 8.383 2.460 -4.519 1.00 . A A . 26 GLN C 1 1 17 11936 1 1 22 GLN CA C 9.859 2.736 -4.214 1.00 . A A . 26 GLN CA 1 1 17 11937 1 1 22 GLN CB C 9.988 3.792 -3.116 1.00 . A A . 26 GLN CB 1 1 17 11938 1 1 22 GLN CD C 10.374 2.853 -0.832 1.00 . A A . 26 GLN CD 1 1 17 11939 1 1 22 GLN CG C 11.054 3.353 -2.109 1.00 . A A . 26 GLN CG 1 1 17 11940 1 1 22 GLN H H 10.004 3.540 -6.211 1.00 . A A . 26 GLN H 1 1 17 11941 1 1 22 GLN HA H 10.360 1.828 -3.915 1.00 . A A . 26 GLN HA 1 1 17 11942 1 1 22 GLN HB2 H 10.275 4.736 -3.555 1.00 . A A . 26 GLN HB2 1 1 17 11943 1 1 22 GLN HB3 H 9.041 3.904 -2.611 1.00 . A A . 26 GLN HB3 1 1 17 11944 1 1 22 GLN HE21 H 10.322 0.961 -1.434 1.00 . A A . 26 GLN HE21 1 1 17 11945 1 1 22 GLN HE22 H 9.661 1.252 0.101 1.00 . A A . 26 GLN HE22 1 1 17 11946 1 1 22 GLN HG2 H 11.648 2.559 -2.535 1.00 . A A . 26 GLN HG2 1 1 17 11947 1 1 22 GLN HG3 H 11.690 4.192 -1.871 1.00 . A A . 26 GLN HG3 1 1 17 11948 1 1 22 GLN N N 10.528 3.332 -5.408 1.00 . A A . 26 GLN N 1 1 17 11949 1 1 22 GLN NE2 N 10.096 1.583 -0.711 1.00 . A A . 26 GLN NE2 1 1 17 11950 1 1 22 GLN O O 7.682 3.304 -5.048 1.00 . A A . 26 GLN O 1 1 17 11951 1 1 22 GLN OE1 O 10.093 3.624 0.062 1.00 . A A . 26 GLN OE1 1 1 17 11952 1 1 23 ARG C C 5.585 1.506 -3.359 1.00 . A A . 27 ARG C 1 1 17 11953 1 1 23 ARG CA C 6.472 0.978 -4.470 1.00 . A A . 27 ARG CA 1 1 17 11954 1 1 23 ARG CB C 6.354 -0.545 -4.524 1.00 . A A . 27 ARG CB 1 1 17 11955 1 1 23 ARG CD C 7.512 -1.100 -6.666 1.00 . A A . 27 ARG CD 1 1 17 11956 1 1 23 ARG CG C 6.153 -0.970 -5.977 1.00 . A A . 27 ARG CG 1 1 17 11957 1 1 23 ARG CZ C 9.201 -2.863 -6.623 1.00 . A A . 27 ARG CZ 1 1 17 11958 1 1 23 ARG H H 8.480 0.618 -3.766 1.00 . A A . 27 ARG H 1 1 17 11959 1 1 23 ARG HA H 6.177 1.400 -5.416 1.00 . A A . 27 ARG HA 1 1 17 11960 1 1 23 ARG HB2 H 7.245 -1.000 -4.127 1.00 . A A . 27 ARG HB2 1 1 17 11961 1 1 23 ARG HB3 H 5.500 -0.860 -3.936 1.00 . A A . 27 ARG HB3 1 1 17 11962 1 1 23 ARG HD2 H 7.404 -0.983 -7.735 1.00 . A A . 27 ARG HD2 1 1 17 11963 1 1 23 ARG HD3 H 8.203 -0.367 -6.275 1.00 . A A . 27 ARG HD3 1 1 17 11964 1 1 23 ARG HE H 7.362 -3.107 -5.906 1.00 . A A . 27 ARG HE 1 1 17 11965 1 1 23 ARG HG2 H 5.641 -1.921 -6.007 1.00 . A A . 27 ARG HG2 1 1 17 11966 1 1 23 ARG HG3 H 5.557 -0.222 -6.484 1.00 . A A . 27 ARG HG3 1 1 17 11967 1 1 23 ARG HH11 H 9.775 -1.116 -7.435 1.00 . A A . 27 ARG HH11 1 1 17 11968 1 1 23 ARG HH12 H 10.976 -2.359 -7.408 1.00 . A A . 27 ARG HH12 1 1 17 11969 1 1 23 ARG HH21 H 8.939 -4.705 -5.883 1.00 . A A . 27 ARG HH21 1 1 17 11970 1 1 23 ARG HH22 H 10.509 -4.377 -6.537 1.00 . A A . 27 ARG HH22 1 1 17 11971 1 1 23 ARG N N 7.904 1.287 -4.192 1.00 . A A . 27 ARG N 1 1 17 11972 1 1 23 ARG NE N 7.977 -2.480 -6.339 1.00 . A A . 27 ARG NE 1 1 17 11973 1 1 23 ARG NH1 N 10.049 -2.048 -7.200 1.00 . A A . 27 ARG NH1 1 1 17 11974 1 1 23 ARG NH2 N 9.579 -4.076 -6.324 1.00 . A A . 27 ARG NH2 1 1 17 11975 1 1 23 ARG O O 5.732 1.148 -2.206 1.00 . A A . 27 ARG O 1 1 17 11976 1 1 24 TYR C C 2.343 2.200 -2.909 1.00 . A A . 28 TYR C 1 1 17 11977 1 1 24 TYR CA C 3.703 2.821 -2.663 1.00 . A A . 28 TYR CA 1 1 17 11978 1 1 24 TYR CB C 3.668 4.356 -2.793 1.00 . A A . 28 TYR CB 1 1 17 11979 1 1 24 TYR CD1 C 3.389 4.773 -5.265 1.00 . A A . 28 TYR CD1 1 1 17 11980 1 1 24 TYR CD2 C 1.498 5.183 -3.806 1.00 . A A . 28 TYR CD2 1 1 17 11981 1 1 24 TYR CE1 C 2.623 5.162 -6.364 1.00 . A A . 28 TYR CE1 1 1 17 11982 1 1 24 TYR CE2 C 0.737 5.573 -4.910 1.00 . A A . 28 TYR CE2 1 1 17 11983 1 1 24 TYR CG C 2.832 4.783 -3.984 1.00 . A A . 28 TYR CG 1 1 17 11984 1 1 24 TYR CZ C 1.303 5.561 -6.190 1.00 . A A . 28 TYR CZ 1 1 17 11985 1 1 24 TYR H H 4.507 2.560 -4.642 1.00 . A A . 28 TYR H 1 1 17 11986 1 1 24 TYR HA H 4.053 2.538 -1.681 1.00 . A A . 28 TYR HA 1 1 17 11987 1 1 24 TYR HB2 H 3.243 4.777 -1.894 1.00 . A A . 28 TYR HB2 1 1 17 11988 1 1 24 TYR HB3 H 4.674 4.723 -2.914 1.00 . A A . 28 TYR HB3 1 1 17 11989 1 1 24 TYR HD1 H 4.408 4.466 -5.403 1.00 . A A . 28 TYR HD1 1 1 17 11990 1 1 24 TYR HD2 H 1.058 5.194 -2.818 1.00 . A A . 28 TYR HD2 1 1 17 11991 1 1 24 TYR HE1 H 3.047 5.154 -7.351 1.00 . A A . 28 TYR HE1 1 1 17 11992 1 1 24 TYR HE2 H -0.289 5.875 -4.775 1.00 . A A . 28 TYR HE2 1 1 17 11993 1 1 24 TYR HH H 0.897 5.472 -8.050 1.00 . A A . 28 TYR HH 1 1 17 11994 1 1 24 TYR N N 4.632 2.317 -3.700 1.00 . A A . 28 TYR N 1 1 17 11995 1 1 24 TYR O O 2.160 1.425 -3.828 1.00 . A A . 28 TYR O 1 1 17 11996 1 1 24 TYR OH O 0.567 5.947 -7.285 1.00 . A A . 28 TYR OH 1 1 17 11997 1 1 25 PHE C C -0.960 3.050 -2.345 1.00 . A A . 29 PHE C 1 1 17 11998 1 1 25 PHE CA C 0.064 1.934 -2.279 1.00 . A A . 29 PHE CA 1 1 17 11999 1 1 25 PHE CB C -0.084 0.988 -1.092 1.00 . A A . 29 PHE CB 1 1 17 12000 1 1 25 PHE CD1 C 2.296 0.134 -0.882 1.00 . A A . 29 PHE CD1 1 1 17 12001 1 1 25 PHE CD2 C 0.624 -1.277 -1.925 1.00 . A A . 29 PHE CD2 1 1 17 12002 1 1 25 PHE CE1 C 3.269 -0.843 -1.128 1.00 . A A . 29 PHE CE1 1 1 17 12003 1 1 25 PHE CE2 C 1.595 -2.256 -2.160 1.00 . A A . 29 PHE CE2 1 1 17 12004 1 1 25 PHE CG C 0.967 -0.085 -1.283 1.00 . A A . 29 PHE CG 1 1 17 12005 1 1 25 PHE CZ C 2.917 -2.039 -1.766 1.00 . A A . 29 PHE CZ 1 1 17 12006 1 1 25 PHE H H 1.573 3.140 -1.358 1.00 . A A . 29 PHE H 1 1 17 12007 1 1 25 PHE HA H 0.040 1.369 -3.195 1.00 . A A . 29 PHE HA 1 1 17 12008 1 1 25 PHE HB2 H 0.082 1.519 -0.166 1.00 . A A . 29 PHE HB2 1 1 17 12009 1 1 25 PHE HB3 H -1.069 0.546 -1.093 1.00 . A A . 29 PHE HB3 1 1 17 12010 1 1 25 PHE HD1 H 2.572 1.057 -0.387 1.00 . A A . 29 PHE HD1 1 1 17 12011 1 1 25 PHE HD2 H -0.392 -1.443 -2.232 1.00 . A A . 29 PHE HD2 1 1 17 12012 1 1 25 PHE HE1 H 4.291 -0.675 -0.829 1.00 . A A . 29 PHE HE1 1 1 17 12013 1 1 25 PHE HE2 H 1.325 -3.176 -2.657 1.00 . A A . 29 PHE HE2 1 1 17 12014 1 1 25 PHE HZ H 3.668 -2.789 -1.963 1.00 . A A . 29 PHE HZ 1 1 17 12015 1 1 25 PHE N N 1.400 2.519 -2.097 1.00 . A A . 29 PHE N 1 1 17 12016 1 1 25 PHE O O -1.354 3.640 -1.355 1.00 . A A . 29 PHE O 1 1 17 12017 1 1 26 LEU C C -3.699 4.051 -3.295 1.00 . A A . 30 LEU C 1 1 17 12018 1 1 26 LEU CA C -2.312 4.456 -3.798 1.00 . A A . 30 LEU CA 1 1 17 12019 1 1 26 LEU CB C -2.281 4.614 -5.333 1.00 . A A . 30 LEU CB 1 1 17 12020 1 1 26 LEU CD1 C -2.540 7.122 -4.811 1.00 . A A . 30 LEU CD1 1 1 17 12021 1 1 26 LEU CD2 C -2.013 6.348 -7.110 1.00 . A A . 30 LEU CD2 1 1 17 12022 1 1 26 LEU CG C -2.762 5.997 -5.830 1.00 . A A . 30 LEU CG 1 1 17 12023 1 1 26 LEU H H -0.968 2.866 -4.314 1.00 . A A . 30 LEU H 1 1 17 12024 1 1 26 LEU HA H -1.976 5.356 -3.318 1.00 . A A . 30 LEU HA 1 1 17 12025 1 1 26 LEU HB2 H -1.269 4.455 -5.677 1.00 . A A . 30 LEU HB2 1 1 17 12026 1 1 26 LEU HB3 H -2.914 3.854 -5.768 1.00 . A A . 30 LEU HB3 1 1 17 12027 1 1 26 LEU HD11 H -1.486 7.293 -4.687 1.00 . A A . 30 LEU HD11 1 1 17 12028 1 1 26 LEU HD12 H -2.979 6.851 -3.865 1.00 . A A . 30 LEU HD12 1 1 17 12029 1 1 26 LEU HD13 H -3.006 8.026 -5.173 1.00 . A A . 30 LEU HD13 1 1 17 12030 1 1 26 LEU HD21 H -1.252 7.083 -6.891 1.00 . A A . 30 LEU HD21 1 1 17 12031 1 1 26 LEU HD22 H -2.704 6.748 -7.835 1.00 . A A . 30 LEU HD22 1 1 17 12032 1 1 26 LEU HD23 H -1.547 5.458 -7.507 1.00 . A A . 30 LEU HD23 1 1 17 12033 1 1 26 LEU HG H -3.794 5.934 -6.053 1.00 . A A . 30 LEU HG 1 1 17 12034 1 1 26 LEU N N -1.346 3.358 -3.551 1.00 . A A . 30 LEU N 1 1 17 12035 1 1 26 LEU O O -4.338 3.168 -3.838 1.00 . A A . 30 LEU O 1 1 17 12036 1 1 27 ASN C C -6.583 5.160 -2.391 1.00 . A A . 31 ASN C 1 1 17 12037 1 1 27 ASN CA C -5.496 4.341 -1.694 1.00 . A A . 31 ASN CA 1 1 17 12038 1 1 27 ASN CB C -5.413 4.713 -0.213 1.00 . A A . 31 ASN CB 1 1 17 12039 1 1 27 ASN CG C -6.728 4.364 0.479 1.00 . A A . 31 ASN CG 1 1 17 12040 1 1 27 ASN H H -3.619 5.385 -1.828 1.00 . A A . 31 ASN H 1 1 17 12041 1 1 27 ASN HA H -5.690 3.286 -1.799 1.00 . A A . 31 ASN HA 1 1 17 12042 1 1 27 ASN HB2 H -4.613 4.159 0.255 1.00 . A A . 31 ASN HB2 1 1 17 12043 1 1 27 ASN HB3 H -5.224 5.772 -0.117 1.00 . A A . 31 ASN HB3 1 1 17 12044 1 1 27 ASN HD21 H -5.841 3.854 2.177 1.00 . A A . 31 ASN HD21 1 1 17 12045 1 1 27 ASN HD22 H -7.528 3.711 2.165 1.00 . A A . 31 ASN HD22 1 1 17 12046 1 1 27 ASN N N -4.158 4.684 -2.252 1.00 . A A . 31 ASN N 1 1 17 12047 1 1 27 ASN ND2 N -6.697 3.942 1.710 1.00 . A A . 31 ASN ND2 1 1 17 12048 1 1 27 ASN O O -6.707 6.353 -2.178 1.00 . A A . 31 ASN O 1 1 17 12049 1 1 27 ASN OD1 O -7.787 4.477 -0.104 1.00 . A A . 31 ASN OD1 1 1 17 12050 1 1 28 HIS C C -9.681 5.424 -3.018 1.00 . A A . 32 HIS C 1 1 17 12051 1 1 28 HIS CA C -8.460 5.250 -3.932 1.00 . A A . 32 HIS CA 1 1 17 12052 1 1 28 HIS CB C -8.809 4.361 -5.126 1.00 . A A . 32 HIS CB 1 1 17 12053 1 1 28 HIS CD2 C -7.740 5.029 -7.433 1.00 . A A . 32 HIS CD2 1 1 17 12054 1 1 28 HIS CE1 C -9.056 6.678 -7.924 1.00 . A A . 32 HIS CE1 1 1 17 12055 1 1 28 HIS CG C -8.639 5.141 -6.400 1.00 . A A . 32 HIS CG 1 1 17 12056 1 1 28 HIS H H -7.247 3.562 -3.365 1.00 . A A . 32 HIS H 1 1 17 12057 1 1 28 HIS HA H -8.107 6.209 -4.278 1.00 . A A . 32 HIS HA 1 1 17 12058 1 1 28 HIS HB2 H -8.152 3.503 -5.139 1.00 . A A . 32 HIS HB2 1 1 17 12059 1 1 28 HIS HB3 H -9.832 4.029 -5.041 1.00 . A A . 32 HIS HB3 1 1 17 12060 1 1 28 HIS HD1 H -10.219 6.538 -6.205 1.00 . A A . 32 HIS HD1 1 1 17 12061 1 1 28 HIS HD2 H -6.947 4.297 -7.490 1.00 . A A . 32 HIS HD2 1 1 17 12062 1 1 28 HIS HE1 H -9.518 7.508 -8.436 1.00 . A A . 32 HIS HE1 1 1 17 12063 1 1 28 HIS N N -7.371 4.523 -3.217 1.00 . A A . 32 HIS N 1 1 17 12064 1 1 28 HIS ND1 N -9.468 6.200 -6.736 1.00 . A A . 32 HIS ND1 1 1 17 12065 1 1 28 HIS NE2 N -8.005 5.999 -8.393 1.00 . A A . 32 HIS NE2 1 1 17 12066 1 1 28 HIS O O -10.643 6.072 -3.378 1.00 . A A . 32 HIS O 1 1 17 12067 1 1 29 ILE C C -10.564 6.247 -0.039 1.00 . A A . 33 ILE C 1 1 17 12068 1 1 29 ILE CA C -10.812 5.021 -0.906 1.00 . A A . 33 ILE CA 1 1 17 12069 1 1 29 ILE CB C -10.891 3.762 -0.006 1.00 . A A . 33 ILE CB 1 1 17 12070 1 1 29 ILE CD1 C -10.498 1.265 0.129 1.00 . A A . 33 ILE CD1 1 1 17 12071 1 1 29 ILE CG1 C -10.192 2.547 -0.655 1.00 . A A . 33 ILE CG1 1 1 17 12072 1 1 29 ILE CG2 C -12.369 3.437 0.237 1.00 . A A . 33 ILE CG2 1 1 17 12073 1 1 29 ILE H H -8.862 4.359 -1.555 1.00 . A A . 33 ILE H 1 1 17 12074 1 1 29 ILE HA H -11.726 5.136 -1.466 1.00 . A A . 33 ILE HA 1 1 17 12075 1 1 29 ILE HB H -10.420 3.981 0.945 1.00 . A A . 33 ILE HB 1 1 17 12076 1 1 29 ILE HD11 H -9.704 0.551 -0.025 1.00 . A A . 33 ILE HD11 1 1 17 12077 1 1 29 ILE HD12 H -11.432 0.846 -0.216 1.00 . A A . 33 ILE HD12 1 1 17 12078 1 1 29 ILE HD13 H -10.574 1.497 1.182 1.00 . A A . 33 ILE HD13 1 1 17 12079 1 1 29 ILE HG12 H -10.535 2.440 -1.672 1.00 . A A . 33 ILE HG12 1 1 17 12080 1 1 29 ILE HG13 H -9.124 2.713 -0.653 1.00 . A A . 33 ILE HG13 1 1 17 12081 1 1 29 ILE HG21 H -12.887 4.327 0.559 1.00 . A A . 33 ILE HG21 1 1 17 12082 1 1 29 ILE HG22 H -12.448 2.679 1.003 1.00 . A A . 33 ILE HG22 1 1 17 12083 1 1 29 ILE HG23 H -12.812 3.072 -0.677 1.00 . A A . 33 ILE HG23 1 1 17 12084 1 1 29 ILE N N -9.647 4.863 -1.836 1.00 . A A . 33 ILE N 1 1 17 12085 1 1 29 ILE O O -11.297 7.215 -0.076 1.00 . A A . 33 ILE O 1 1 17 12086 1 1 30 ASP C C -8.398 8.426 0.795 1.00 . A A . 34 ASP C 1 1 17 12087 1 1 30 ASP CA C -9.185 7.377 1.596 1.00 . A A . 34 ASP CA 1 1 17 12088 1 1 30 ASP CB C -8.323 6.804 2.720 1.00 . A A . 34 ASP CB 1 1 17 12089 1 1 30 ASP CG C -8.123 7.866 3.802 1.00 . A A . 34 ASP CG 1 1 17 12090 1 1 30 ASP H H -8.935 5.417 0.725 1.00 . A A . 34 ASP H 1 1 17 12091 1 1 30 ASP HA H -10.084 7.810 2.004 1.00 . A A . 34 ASP HA 1 1 17 12092 1 1 30 ASP HB2 H -8.816 5.942 3.147 1.00 . A A . 34 ASP HB2 1 1 17 12093 1 1 30 ASP HB3 H -7.363 6.509 2.323 1.00 . A A . 34 ASP HB3 1 1 17 12094 1 1 30 ASP N N -9.516 6.212 0.730 1.00 . A A . 34 ASP N 1 1 17 12095 1 1 30 ASP O O -7.934 9.409 1.337 1.00 . A A . 34 ASP O 1 1 17 12096 1 1 30 ASP OD1 O -8.992 8.711 3.942 1.00 . A A . 34 ASP OD1 1 1 17 12097 1 1 30 ASP OD2 O -7.106 7.816 4.474 1.00 . A A . 34 ASP OD2 1 1 17 12098 1 1 31 GLN C C -6.123 9.495 -0.690 1.00 . A A . 35 GLN C 1 1 17 12099 1 1 31 GLN CA C -7.489 9.213 -1.316 1.00 . A A . 35 GLN CA 1 1 17 12100 1 1 31 GLN CB C -8.353 10.476 -1.311 1.00 . A A . 35 GLN CB 1 1 17 12101 1 1 31 GLN CD C -10.731 11.230 -1.438 1.00 . A A . 35 GLN CD 1 1 17 12102 1 1 31 GLN CG C -9.738 10.149 -1.872 1.00 . A A . 35 GLN CG 1 1 17 12103 1 1 31 GLN H H -8.624 7.431 -0.917 1.00 . A A . 35 GLN H 1 1 17 12104 1 1 31 GLN HA H -7.375 8.851 -2.326 1.00 . A A . 35 GLN HA 1 1 17 12105 1 1 31 GLN HB2 H -8.450 10.841 -0.300 1.00 . A A . 35 GLN HB2 1 1 17 12106 1 1 31 GLN HB3 H -7.886 11.233 -1.923 1.00 . A A . 35 GLN HB3 1 1 17 12107 1 1 31 GLN HE21 H -10.604 12.233 -3.146 1.00 . A A . 35 GLN HE21 1 1 17 12108 1 1 31 GLN HE22 H -11.657 12.898 -1.991 1.00 . A A . 35 GLN HE22 1 1 17 12109 1 1 31 GLN HG2 H -9.691 10.117 -2.951 1.00 . A A . 35 GLN HG2 1 1 17 12110 1 1 31 GLN HG3 H -10.063 9.191 -1.496 1.00 . A A . 35 GLN HG3 1 1 17 12111 1 1 31 GLN N N -8.245 8.226 -0.492 1.00 . A A . 35 GLN N 1 1 17 12112 1 1 31 GLN NE2 N -11.022 12.200 -2.261 1.00 . A A . 35 GLN NE2 1 1 17 12113 1 1 31 GLN O O -5.860 10.583 -0.217 1.00 . A A . 35 GLN O 1 1 17 12114 1 1 31 GLN OE1 O -11.248 11.190 -0.340 1.00 . A A . 35 GLN OE1 1 1 17 12115 1 1 32 THR C C -2.879 7.757 -0.631 1.00 . A A . 36 THR C 1 1 17 12116 1 1 32 THR CA C -3.897 8.758 -0.078 1.00 . A A . 36 THR CA 1 1 17 12117 1 1 32 THR CB C -4.078 8.547 1.429 1.00 . A A . 36 THR CB 1 1 17 12118 1 1 32 THR CG2 C -3.121 9.464 2.190 1.00 . A A . 36 THR CG2 1 1 17 12119 1 1 32 THR H H -5.475 7.650 -1.069 1.00 . A A . 36 THR H 1 1 17 12120 1 1 32 THR HA H -3.571 9.768 -0.268 1.00 . A A . 36 THR HA 1 1 17 12121 1 1 32 THR HB H -3.855 7.520 1.676 1.00 . A A . 36 THR HB 1 1 17 12122 1 1 32 THR HG1 H -5.935 8.043 1.717 1.00 . A A . 36 THR HG1 1 1 17 12123 1 1 32 THR HG21 H -2.436 8.866 2.775 1.00 . A A . 36 THR HG21 1 1 17 12124 1 1 32 THR HG22 H -3.686 10.108 2.849 1.00 . A A . 36 THR HG22 1 1 17 12125 1 1 32 THR HG23 H -2.563 10.066 1.488 1.00 . A A . 36 THR HG23 1 1 17 12126 1 1 32 THR N N -5.246 8.526 -0.681 1.00 . A A . 36 THR N 1 1 17 12127 1 1 32 THR O O -3.186 6.950 -1.484 1.00 . A A . 36 THR O 1 1 17 12128 1 1 32 THR OG1 O -5.418 8.845 1.802 1.00 . A A . 36 THR OG1 1 1 17 12129 1 1 33 THR C C 0.244 6.373 0.530 1.00 . A A . 37 THR C 1 1 17 12130 1 1 33 THR CA C -0.623 6.856 -0.631 1.00 . A A . 37 THR CA 1 1 17 12131 1 1 33 THR CB C 0.242 7.657 -1.607 1.00 . A A . 37 THR CB 1 1 17 12132 1 1 33 THR CG2 C -0.634 8.306 -2.674 1.00 . A A . 37 THR CG2 1 1 17 12133 1 1 33 THR H H -1.445 8.462 0.549 1.00 . A A . 37 THR H 1 1 17 12134 1 1 33 THR HA H -1.077 6.021 -1.140 1.00 . A A . 37 THR HA 1 1 17 12135 1 1 33 THR HB H 0.951 6.995 -2.085 1.00 . A A . 37 THR HB 1 1 17 12136 1 1 33 THR HG1 H 0.300 9.292 -0.557 1.00 . A A . 37 THR HG1 1 1 17 12137 1 1 33 THR HG21 H -1.592 7.813 -2.700 1.00 . A A . 37 THR HG21 1 1 17 12138 1 1 33 THR HG22 H -0.153 8.213 -3.637 1.00 . A A . 37 THR HG22 1 1 17 12139 1 1 33 THR HG23 H -0.771 9.351 -2.440 1.00 . A A . 37 THR HG23 1 1 17 12140 1 1 33 THR N N -1.667 7.804 -0.144 1.00 . A A . 37 THR N 1 1 17 12141 1 1 33 THR O O 0.936 7.148 1.161 1.00 . A A . 37 THR O 1 1 17 12142 1 1 33 THR OG1 O 0.945 8.665 -0.893 1.00 . A A . 37 THR OG1 1 1 17 12143 1 1 34 THR C C 2.202 3.711 1.309 1.00 . A A . 38 THR C 1 1 17 12144 1 1 34 THR CA C 1.097 4.583 1.908 1.00 . A A . 38 THR CA 1 1 17 12145 1 1 34 THR CB C 0.170 3.772 2.823 1.00 . A A . 38 THR CB 1 1 17 12146 1 1 34 THR CG2 C -0.318 2.516 2.100 1.00 . A A . 38 THR CG2 1 1 17 12147 1 1 34 THR H H -0.310 4.483 0.267 1.00 . A A . 38 THR H 1 1 17 12148 1 1 34 THR HA H 1.530 5.406 2.458 1.00 . A A . 38 THR HA 1 1 17 12149 1 1 34 THR HB H -0.682 4.376 3.097 1.00 . A A . 38 THR HB 1 1 17 12150 1 1 34 THR HG1 H 0.623 3.995 4.701 1.00 . A A . 38 THR HG1 1 1 17 12151 1 1 34 THR HG21 H 0.485 1.796 2.050 1.00 . A A . 38 THR HG21 1 1 17 12152 1 1 34 THR HG22 H -0.628 2.779 1.105 1.00 . A A . 38 THR HG22 1 1 17 12153 1 1 34 THR HG23 H -1.151 2.092 2.638 1.00 . A A . 38 THR HG23 1 1 17 12154 1 1 34 THR N N 0.239 5.099 0.803 1.00 . A A . 38 THR N 1 1 17 12155 1 1 34 THR O O 1.996 3.037 0.322 1.00 . A A . 38 THR O 1 1 17 12156 1 1 34 THR OG1 O 0.878 3.397 3.995 1.00 . A A . 38 THR OG1 1 1 17 12157 1 1 35 TRP C C 4.342 1.446 1.804 1.00 . A A . 39 TRP C 1 1 17 12158 1 1 35 TRP CA C 4.473 2.891 1.315 1.00 . A A . 39 TRP CA 1 1 17 12159 1 1 35 TRP CB C 5.779 3.511 1.832 1.00 . A A . 39 TRP CB 1 1 17 12160 1 1 35 TRP CD1 C 5.237 5.918 2.421 1.00 . A A . 39 TRP CD1 1 1 17 12161 1 1 35 TRP CD2 C 6.447 5.753 0.530 1.00 . A A . 39 TRP CD2 1 1 17 12162 1 1 35 TRP CE2 C 6.222 7.133 0.757 1.00 . A A . 39 TRP CE2 1 1 17 12163 1 1 35 TRP CE3 C 7.191 5.386 -0.608 1.00 . A A . 39 TRP CE3 1 1 17 12164 1 1 35 TRP CG C 5.806 4.997 1.606 1.00 . A A . 39 TRP CG 1 1 17 12165 1 1 35 TRP CH2 C 7.457 7.725 -1.225 1.00 . A A . 39 TRP CH2 1 1 17 12166 1 1 35 TRP CZ2 C 6.718 8.107 -0.105 1.00 . A A . 39 TRP CZ2 1 1 17 12167 1 1 35 TRP CZ3 C 7.691 6.367 -1.476 1.00 . A A . 39 TRP CZ3 1 1 17 12168 1 1 35 TRP H H 3.522 4.271 2.676 1.00 . A A . 39 TRP H 1 1 17 12169 1 1 35 TRP HA H 4.448 2.922 0.236 1.00 . A A . 39 TRP HA 1 1 17 12170 1 1 35 TRP HB2 H 5.871 3.313 2.889 1.00 . A A . 39 TRP HB2 1 1 17 12171 1 1 35 TRP HB3 H 6.613 3.060 1.314 1.00 . A A . 39 TRP HB3 1 1 17 12172 1 1 35 TRP HD1 H 4.678 5.699 3.320 1.00 . A A . 39 TRP HD1 1 1 17 12173 1 1 35 TRP HE1 H 5.171 8.022 2.313 1.00 . A A . 39 TRP HE1 1 1 17 12174 1 1 35 TRP HE3 H 7.371 4.347 -0.822 1.00 . A A . 39 TRP HE3 1 1 17 12175 1 1 35 TRP HH2 H 7.846 8.474 -1.898 1.00 . A A . 39 TRP HH2 1 1 17 12176 1 1 35 TRP HZ2 H 6.533 9.153 0.096 1.00 . A A . 39 TRP HZ2 1 1 17 12177 1 1 35 TRP HZ3 H 8.265 6.073 -2.342 1.00 . A A . 39 TRP HZ3 1 1 17 12178 1 1 35 TRP N N 3.370 3.721 1.882 1.00 . A A . 39 TRP N 1 1 17 12179 1 1 35 TRP NE1 N 5.479 7.181 1.914 1.00 . A A . 39 TRP NE1 1 1 17 12180 1 1 35 TRP O O 4.466 0.509 1.041 1.00 . A A . 39 TRP O 1 1 17 12181 1 1 36 GLN C C 2.611 -0.723 3.179 1.00 . A A . 40 GLN C 1 1 17 12182 1 1 36 GLN CA C 3.953 -0.125 3.608 1.00 . A A . 40 GLN CA 1 1 17 12183 1 1 36 GLN CB C 4.010 0.032 5.127 1.00 . A A . 40 GLN CB 1 1 17 12184 1 1 36 GLN CD C 5.659 0.299 6.985 1.00 . A A . 40 GLN CD 1 1 17 12185 1 1 36 GLN CG C 5.402 -0.358 5.628 1.00 . A A . 40 GLN CG 1 1 17 12186 1 1 36 GLN H H 3.995 2.030 3.670 1.00 . A A . 40 GLN H 1 1 17 12187 1 1 36 GLN HA H 4.769 -0.744 3.270 1.00 . A A . 40 GLN HA 1 1 17 12188 1 1 36 GLN HB2 H 3.807 1.060 5.392 1.00 . A A . 40 GLN HB2 1 1 17 12189 1 1 36 GLN HB3 H 3.272 -0.611 5.584 1.00 . A A . 40 GLN HB3 1 1 17 12190 1 1 36 GLN HE21 H 6.005 2.095 6.212 1.00 . A A . 40 GLN HE21 1 1 17 12191 1 1 36 GLN HE22 H 6.117 2.000 7.902 1.00 . A A . 40 GLN HE22 1 1 17 12192 1 1 36 GLN HG2 H 5.461 -1.431 5.731 1.00 . A A . 40 GLN HG2 1 1 17 12193 1 1 36 GLN HG3 H 6.147 -0.022 4.920 1.00 . A A . 40 GLN HG3 1 1 17 12194 1 1 36 GLN N N 4.092 1.259 3.071 1.00 . A A . 40 GLN N 1 1 17 12195 1 1 36 GLN NE2 N 5.951 1.570 7.037 1.00 . A A . 40 GLN NE2 1 1 17 12196 1 1 36 GLN O O 1.960 -0.232 2.279 1.00 . A A . 40 GLN O 1 1 17 12197 1 1 36 GLN OE1 O 5.592 -0.350 8.010 1.00 . A A . 40 GLN OE1 1 1 17 12198 1 1 37 ASP C C -0.008 -2.540 4.680 1.00 . A A . 41 ASP C 1 1 17 12199 1 1 37 ASP CA C 0.893 -2.412 3.443 1.00 . A A . 41 ASP CA 1 1 17 12200 1 1 37 ASP CB C 1.262 -3.793 2.902 1.00 . A A . 41 ASP CB 1 1 17 12201 1 1 37 ASP CG C 2.173 -3.637 1.683 1.00 . A A . 41 ASP CG 1 1 17 12202 1 1 37 ASP H H 2.733 -2.166 4.538 1.00 . A A . 41 ASP H 1 1 17 12203 1 1 37 ASP HA H 0.402 -1.834 2.676 1.00 . A A . 41 ASP HA 1 1 17 12204 1 1 37 ASP HB2 H 1.777 -4.355 3.667 1.00 . A A . 41 ASP HB2 1 1 17 12205 1 1 37 ASP HB3 H 0.362 -4.318 2.614 1.00 . A A . 41 ASP HB3 1 1 17 12206 1 1 37 ASP N N 2.193 -1.783 3.816 1.00 . A A . 41 ASP N 1 1 17 12207 1 1 37 ASP O O 0.473 -2.795 5.766 1.00 . A A . 41 ASP O 1 1 17 12208 1 1 37 ASP OD1 O 3.310 -3.232 1.868 1.00 . A A . 41 ASP OD1 1 1 17 12209 1 1 37 ASP OD2 O 1.720 -3.923 0.588 1.00 . A A . 41 ASP OD2 1 1 17 12210 1 1 38 PRO C C -2.427 -3.922 6.027 1.00 . A A . 42 PRO C 1 1 17 12211 1 1 38 PRO CA C -2.254 -2.461 5.602 1.00 . A A . 42 PRO CA 1 1 17 12212 1 1 38 PRO CB C -3.550 -1.907 5.019 1.00 . A A . 42 PRO CB 1 1 17 12213 1 1 38 PRO CD C -1.962 -2.048 3.206 1.00 . A A . 42 PRO CD 1 1 17 12214 1 1 38 PRO CG C -3.429 -2.115 3.541 1.00 . A A . 42 PRO CG 1 1 17 12215 1 1 38 PRO HA H -1.934 -1.855 6.434 1.00 . A A . 42 PRO HA 1 1 17 12216 1 1 38 PRO HB2 H -4.399 -2.452 5.405 1.00 . A A . 42 PRO HB2 1 1 17 12217 1 1 38 PRO HB3 H -3.644 -0.855 5.243 1.00 . A A . 42 PRO HB3 1 1 17 12218 1 1 38 PRO HD2 H -1.712 -2.785 2.456 1.00 . A A . 42 PRO HD2 1 1 17 12219 1 1 38 PRO HD3 H -1.695 -1.058 2.869 1.00 . A A . 42 PRO HD3 1 1 17 12220 1 1 38 PRO HG2 H -3.826 -3.082 3.272 1.00 . A A . 42 PRO HG2 1 1 17 12221 1 1 38 PRO HG3 H -3.962 -1.337 3.015 1.00 . A A . 42 PRO HG3 1 1 17 12222 1 1 38 PRO N N -1.290 -2.360 4.478 1.00 . A A . 42 PRO N 1 1 17 12223 1 1 38 PRO O O -2.015 -4.832 5.336 1.00 . A A . 42 PRO O 1 1 17 12224 1 1 39 ARG C C -1.901 -6.305 7.637 1.00 . A A . 43 ARG C 1 1 17 12225 1 1 39 ARG CA C -3.236 -5.554 7.626 1.00 . A A . 43 ARG CA 1 1 17 12226 1 1 39 ARG CB C -4.193 -6.177 6.610 1.00 . A A . 43 ARG CB 1 1 17 12227 1 1 39 ARG CD C -6.577 -5.481 6.889 1.00 . A A . 43 ARG CD 1 1 17 12228 1 1 39 ARG CG C -5.519 -6.510 7.297 1.00 . A A . 43 ARG CG 1 1 17 12229 1 1 39 ARG CZ C -8.314 -4.347 8.177 1.00 . A A . 43 ARG CZ 1 1 17 12230 1 1 39 ARG H H -3.361 -3.404 7.701 1.00 . A A . 43 ARG H 1 1 17 12231 1 1 39 ARG HA H -3.682 -5.564 8.607 1.00 . A A . 43 ARG HA 1 1 17 12232 1 1 39 ARG HB2 H -4.369 -5.479 5.805 1.00 . A A . 43 ARG HB2 1 1 17 12233 1 1 39 ARG HB3 H -3.758 -7.081 6.212 1.00 . A A . 43 ARG HB3 1 1 17 12234 1 1 39 ARG HD2 H -6.112 -4.640 6.395 1.00 . A A . 43 ARG HD2 1 1 17 12235 1 1 39 ARG HD3 H -7.315 -5.935 6.245 1.00 . A A . 43 ARG HD3 1 1 17 12236 1 1 39 ARG HE H -6.779 -5.286 9.023 1.00 . A A . 43 ARG HE 1 1 17 12237 1 1 39 ARG HG2 H -5.842 -7.495 6.999 1.00 . A A . 43 ARG HG2 1 1 17 12238 1 1 39 ARG HG3 H -5.386 -6.483 8.368 1.00 . A A . 43 ARG HG3 1 1 17 12239 1 1 39 ARG HH11 H -8.517 -4.282 6.178 1.00 . A A . 43 ARG HH11 1 1 17 12240 1 1 39 ARG HH12 H -9.751 -3.477 7.083 1.00 . A A . 43 ARG HH12 1 1 17 12241 1 1 39 ARG HH21 H -8.394 -4.234 10.175 1.00 . A A . 43 ARG HH21 1 1 17 12242 1 1 39 ARG HH22 H -9.686 -3.449 9.328 1.00 . A A . 43 ARG HH22 1 1 17 12243 1 1 39 ARG N N -3.035 -4.152 7.159 1.00 . A A . 43 ARG N 1 1 17 12244 1 1 39 ARG NE N -7.203 -5.047 8.172 1.00 . A A . 43 ARG NE 1 1 17 12245 1 1 39 ARG NH1 N -8.906 -4.011 7.056 1.00 . A A . 43 ARG NH1 1 1 17 12246 1 1 39 ARG NH2 N -8.839 -3.981 9.315 1.00 . A A . 43 ARG NH2 1 1 17 12247 1 1 39 ARG O O -0.843 -5.708 7.660 1.00 . A A . 43 ARG O 1 1 17 12248 1 1 40 LYS C C -0.964 -9.864 7.300 1.00 . A A . 44 LYS C 1 1 17 12249 1 1 40 LYS CA C -0.677 -8.396 7.628 1.00 . A A . 44 LYS CA 1 1 17 12250 1 1 40 LYS CB C -0.134 -8.259 9.051 1.00 . A A . 44 LYS CB 1 1 17 12251 1 1 40 LYS CD C -1.678 -7.609 10.905 1.00 . A A . 44 LYS CD 1 1 17 12252 1 1 40 LYS CE C -1.037 -7.691 12.293 1.00 . A A . 44 LYS CE 1 1 17 12253 1 1 40 LYS CG C -1.180 -8.771 10.045 1.00 . A A . 44 LYS CG 1 1 17 12254 1 1 40 LYS H H -2.807 -8.071 7.599 1.00 . A A . 44 LYS H 1 1 17 12255 1 1 40 LYS HA H 0.030 -7.982 6.923 1.00 . A A . 44 LYS HA 1 1 17 12256 1 1 40 LYS HB2 H 0.771 -8.841 9.148 1.00 . A A . 44 LYS HB2 1 1 17 12257 1 1 40 LYS HB3 H 0.080 -7.221 9.256 1.00 . A A . 44 LYS HB3 1 1 17 12258 1 1 40 LYS HD2 H -1.407 -6.674 10.438 1.00 . A A . 44 LYS HD2 1 1 17 12259 1 1 40 LYS HD3 H -2.752 -7.665 11.001 1.00 . A A . 44 LYS HD3 1 1 17 12260 1 1 40 LYS HE2 H -1.733 -8.110 13.004 1.00 . A A . 44 LYS HE2 1 1 17 12261 1 1 40 LYS HE3 H -0.134 -8.283 12.256 1.00 . A A . 44 LYS HE3 1 1 17 12262 1 1 40 LYS HG2 H -2.011 -9.201 9.504 1.00 . A A . 44 LYS HG2 1 1 17 12263 1 1 40 LYS HG3 H -0.734 -9.524 10.678 1.00 . A A . 44 LYS HG3 1 1 17 12264 1 1 40 LYS HZ1 H -0.349 -6.242 13.621 1.00 . A A . 44 LYS HZ1 1 1 17 12265 1 1 40 LYS HZ2 H -1.581 -5.702 12.584 1.00 . A A . 44 LYS HZ2 1 1 17 12266 1 1 40 LYS HZ3 H -0.001 -5.910 11.995 1.00 . A A . 44 LYS HZ3 1 1 17 12267 1 1 40 LYS N N -1.942 -7.609 7.618 1.00 . A A . 44 LYS N 1 1 17 12268 1 1 40 LYS NZ N -0.717 -6.280 12.649 1.00 . A A . 44 LYS NZ 1 1 17 12269 1 1 40 LYS O O -2.125 -10.196 7.129 1.00 . A A . 44 LYS O 1 1 17 12270 1 1 40 LYS OXT O -0.016 -10.630 7.225 1.00 . A A . 44 LYS OXT 1 1 17 12271 2 2 1 ACE C C 6.581 14.309 3.020 1.00 . B B . 45 ACE C 1 1 17 12272 2 2 1 ACE CH3 C 7.618 15.320 3.519 1.00 . B B . 45 ACE CH3 1 1 17 12273 2 2 1 ACE H1 H 7.536 16.232 2.947 1.00 . B B . 45 ACE H1 1 1 17 12274 2 2 1 ACE H2 H 8.609 14.907 3.398 1.00 . B B . 45 ACE H2 1 1 17 12275 2 2 1 ACE H3 H 7.441 15.530 4.562 1.00 . B B . 45 ACE H3 1 1 17 12276 2 2 1 ACE O O 5.540 14.685 2.520 1.00 . B B . 45 ACE O 1 1 17 12277 2 2 2 PRO C C 6.461 11.565 1.243 1.00 . B B . 46 PRO C 1 1 17 12278 2 2 2 PRO CA C 7.529 12.328 2.033 1.00 . B B . 46 PRO CA 1 1 17 12279 2 2 2 PRO CB C 8.501 11.359 2.696 1.00 . B B . 46 PRO CB 1 1 17 12280 2 2 2 PRO CD C 7.243 12.420 4.455 1.00 . B B . 46 PRO CD 1 1 17 12281 2 2 2 PRO CG C 7.958 11.153 4.070 1.00 . B B . 46 PRO CG 1 1 17 12282 2 2 2 PRO HA H 8.064 13.009 1.391 1.00 . B B . 46 PRO HA 1 1 17 12283 2 2 2 PRO HB2 H 8.526 10.423 2.154 1.00 . B B . 46 PRO HB2 1 1 17 12284 2 2 2 PRO HB3 H 9.487 11.791 2.750 1.00 . B B . 46 PRO HB3 1 1 17 12285 2 2 2 PRO HD2 H 6.345 12.192 5.012 1.00 . B B . 46 PRO HD2 1 1 17 12286 2 2 2 PRO HD3 H 7.893 13.063 5.028 1.00 . B B . 46 PRO HD3 1 1 17 12287 2 2 2 PRO HG2 H 7.266 10.320 4.072 1.00 . B B . 46 PRO HG2 1 1 17 12288 2 2 2 PRO HG3 H 8.764 10.966 4.763 1.00 . B B . 46 PRO HG3 1 1 17 12289 2 2 2 PRO N N 6.909 13.056 3.172 1.00 . B B . 46 PRO N 1 1 17 12290 2 2 2 PRO O O 6.600 11.336 0.058 1.00 . B B . 46 PRO O 1 1 17 12291 2 2 3 LEU C C 3.818 11.260 -0.014 1.00 . B B . 47 LEU C 1 1 17 12292 2 2 3 LEU CA C 4.326 10.424 1.169 1.00 . B B . 47 LEU CA 1 1 17 12293 2 2 3 LEU CB C 3.204 10.213 2.195 1.00 . B B . 47 LEU CB 1 1 17 12294 2 2 3 LEU CD1 C 3.384 10.519 4.670 1.00 . B B . 47 LEU CD1 1 1 17 12295 2 2 3 LEU CD2 C 3.194 8.221 3.710 1.00 . B B . 47 LEU CD2 1 1 17 12296 2 2 3 LEU CG C 3.770 9.622 3.491 1.00 . B B . 47 LEU CG 1 1 17 12297 2 2 3 LEU H H 5.306 11.368 2.844 1.00 . B B . 47 LEU H 1 1 17 12298 2 2 3 LEU HA H 4.699 9.471 0.828 1.00 . B B . 47 LEU HA 1 1 17 12299 2 2 3 LEU HB2 H 2.734 11.158 2.409 1.00 . B B . 47 LEU HB2 1 1 17 12300 2 2 3 LEU HB3 H 2.472 9.532 1.786 1.00 . B B . 47 LEU HB3 1 1 17 12301 2 2 3 LEU HD11 H 3.388 11.552 4.352 1.00 . B B . 47 LEU HD11 1 1 17 12302 2 2 3 LEU HD12 H 4.094 10.386 5.472 1.00 . B B . 47 LEU HD12 1 1 17 12303 2 2 3 LEU HD13 H 2.396 10.253 5.015 1.00 . B B . 47 LEU HD13 1 1 17 12304 2 2 3 LEU HD21 H 2.295 8.291 4.303 1.00 . B B . 47 LEU HD21 1 1 17 12305 2 2 3 LEU HD22 H 3.920 7.610 4.224 1.00 . B B . 47 LEU HD22 1 1 17 12306 2 2 3 LEU HD23 H 2.961 7.775 2.754 1.00 . B B . 47 LEU HD23 1 1 17 12307 2 2 3 LEU HG H 4.847 9.564 3.424 1.00 . B B . 47 LEU HG 1 1 17 12308 2 2 3 LEU N N 5.399 11.172 1.889 1.00 . B B . 47 LEU N 1 1 17 12309 2 2 3 LEU O O 3.658 12.459 0.108 1.00 . B B . 47 LEU O 1 1 17 12310 2 2 4 PRO C C 1.619 11.727 -2.153 1.00 . B B . 48 PRO C 1 1 17 12311 2 2 4 PRO CA C 3.089 11.326 -2.331 1.00 . B B . 48 PRO CA 1 1 17 12312 2 2 4 PRO CB C 3.236 10.299 -3.448 1.00 . B B . 48 PRO CB 1 1 17 12313 2 2 4 PRO CD C 3.739 9.167 -1.375 1.00 . B B . 48 PRO CD 1 1 17 12314 2 2 4 PRO CG C 3.185 8.971 -2.763 1.00 . B B . 48 PRO CG 1 1 17 12315 2 2 4 PRO HA H 3.700 12.189 -2.537 1.00 . B B . 48 PRO HA 1 1 17 12316 2 2 4 PRO HB2 H 2.423 10.390 -4.153 1.00 . B B . 48 PRO HB2 1 1 17 12317 2 2 4 PRO HB3 H 4.184 10.426 -3.952 1.00 . B B . 48 PRO HB3 1 1 17 12318 2 2 4 PRO HD2 H 3.172 8.593 -0.656 1.00 . B B . 48 PRO HD2 1 1 17 12319 2 2 4 PRO HD3 H 4.782 8.892 -1.342 1.00 . B B . 48 PRO HD3 1 1 17 12320 2 2 4 PRO HG2 H 2.165 8.627 -2.707 1.00 . B B . 48 PRO HG2 1 1 17 12321 2 2 4 PRO HG3 H 3.785 8.254 -3.302 1.00 . B B . 48 PRO HG3 1 1 17 12322 2 2 4 PRO N N 3.579 10.608 -1.128 1.00 . B B . 48 PRO N 1 1 17 12323 2 2 4 PRO O O 0.851 11.001 -1.551 1.00 . B B . 48 PRO O 1 1 17 12324 2 2 5 PRO C C -1.049 12.547 -3.498 1.00 . B B . 49 PRO C 1 1 17 12325 2 2 5 PRO CA C -0.131 13.358 -2.578 1.00 . B B . 49 PRO CA 1 1 17 12326 2 2 5 PRO CB C -0.047 14.810 -3.040 1.00 . B B . 49 PRO CB 1 1 17 12327 2 2 5 PRO CD C 2.121 13.813 -3.428 1.00 . B B . 49 PRO CD 1 1 17 12328 2 2 5 PRO CG C 1.161 14.864 -3.923 1.00 . B B . 49 PRO CG 1 1 17 12329 2 2 5 PRO HA H -0.474 13.312 -1.557 1.00 . B B . 49 PRO HA 1 1 17 12330 2 2 5 PRO HB2 H -0.930 15.077 -3.597 1.00 . B B . 49 PRO HB2 1 1 17 12331 2 2 5 PRO HB3 H 0.080 15.466 -2.191 1.00 . B B . 49 PRO HB3 1 1 17 12332 2 2 5 PRO HD2 H 2.599 13.316 -4.259 1.00 . B B . 49 PRO HD2 1 1 17 12333 2 2 5 PRO HD3 H 2.859 14.252 -2.773 1.00 . B B . 49 PRO HD3 1 1 17 12334 2 2 5 PRO HG2 H 0.880 14.656 -4.944 1.00 . B B . 49 PRO HG2 1 1 17 12335 2 2 5 PRO HG3 H 1.619 15.841 -3.858 1.00 . B B . 49 PRO HG3 1 1 17 12336 2 2 5 PRO N N 1.266 12.872 -2.686 1.00 . B B . 49 PRO N 1 1 17 12337 2 2 5 PRO O O -0.687 11.490 -3.976 1.00 . B B . 49 PRO O 1 1 17 12338 2 2 6 TYR C C -3.861 13.255 -5.606 1.00 . B B . 50 TYR C 1 1 17 12339 2 2 6 TYR CA C -3.171 12.288 -4.639 1.00 . B B . 50 TYR CA 1 1 17 12340 2 2 6 TYR CB C -4.192 11.653 -3.696 1.00 . B B . 50 TYR CB 1 1 17 12341 2 2 6 TYR CD1 C -5.338 10.479 -5.611 1.00 . B B . 50 TYR CD1 1 1 17 12342 2 2 6 TYR CD2 C -4.726 9.188 -3.651 1.00 . B B . 50 TYR CD2 1 1 17 12343 2 2 6 TYR CE1 C -5.869 9.327 -6.203 1.00 . B B . 50 TYR CE1 1 1 17 12344 2 2 6 TYR CE2 C -5.258 8.037 -4.243 1.00 . B B . 50 TYR CE2 1 1 17 12345 2 2 6 TYR CG C -4.765 10.409 -4.335 1.00 . B B . 50 TYR CG 1 1 17 12346 2 2 6 TYR CZ C -5.830 8.106 -5.519 1.00 . B B . 50 TYR CZ 1 1 17 12347 2 2 6 TYR H H -2.506 13.888 -3.355 1.00 . B B . 50 TYR H 1 1 17 12348 2 2 6 TYR HA H -2.644 11.522 -5.185 1.00 . B B . 50 TYR HA 1 1 17 12349 2 2 6 TYR HB2 H -3.708 11.388 -2.767 1.00 . B B . 50 TYR HB2 1 1 17 12350 2 2 6 TYR HB3 H -4.988 12.355 -3.500 1.00 . B B . 50 TYR HB3 1 1 17 12351 2 2 6 TYR HD1 H -5.368 11.420 -6.139 1.00 . B B . 50 TYR HD1 1 1 17 12352 2 2 6 TYR HD2 H -4.284 9.135 -2.667 1.00 . B B . 50 TYR HD2 1 1 17 12353 2 2 6 TYR HE1 H -6.311 9.381 -7.188 1.00 . B B . 50 TYR HE1 1 1 17 12354 2 2 6 TYR HE2 H -5.229 7.095 -3.716 1.00 . B B . 50 TYR HE2 1 1 17 12355 2 2 6 TYR HH H -7.267 7.154 -6.340 1.00 . B B . 50 TYR HH 1 1 17 12356 2 2 6 TYR N N -2.233 13.033 -3.749 1.00 . B B . 50 TYR N 1 1 17 12357 2 2 6 TYR O O -3.318 13.485 -6.673 1.00 . B B . 50 TYR O 1 1 17 12358 2 2 6 TYR OXT O -4.921 13.751 -5.260 1.00 . B B . 50 TYR OXT 1 1 17 12359 2 2 6 TYR OH O -6.355 6.971 -6.102 1.00 . B B . 50 TYR OH 1 1 18 12360 1 1 1 PHE C C -6.327 -5.027 16.505 1.00 . A A . 5 PHE C 1 1 18 12361 1 1 1 PHE CA C -6.756 -6.116 17.494 1.00 . A A . 5 PHE CA 1 1 18 12362 1 1 1 PHE CB C -8.208 -5.904 17.926 1.00 . A A . 5 PHE CB 1 1 18 12363 1 1 1 PHE CD1 C -8.181 -7.178 20.101 1.00 . A A . 5 PHE CD1 1 1 18 12364 1 1 1 PHE CD2 C -9.530 -8.023 18.272 1.00 . A A . 5 PHE CD2 1 1 18 12365 1 1 1 PHE CE1 C -8.590 -8.253 20.900 1.00 . A A . 5 PHE CE1 1 1 18 12366 1 1 1 PHE CE2 C -9.939 -9.096 19.071 1.00 . A A . 5 PHE CE2 1 1 18 12367 1 1 1 PHE CG C -8.650 -7.063 18.788 1.00 . A A . 5 PHE CG 1 1 18 12368 1 1 1 PHE CZ C -9.471 -9.211 20.384 1.00 . A A . 5 PHE CZ 1 1 18 12369 1 1 1 PHE HA H -6.642 -7.092 17.053 1.00 . A A . 5 PHE HA 1 1 18 12370 1 1 1 PHE HB2 H -8.286 -4.987 18.488 1.00 . A A . 5 PHE HB2 1 1 18 12371 1 1 1 PHE HB3 H -8.840 -5.847 17.052 1.00 . A A . 5 PHE HB3 1 1 18 12372 1 1 1 PHE HD1 H -7.502 -6.439 20.498 1.00 . A A . 5 PHE HD1 1 1 18 12373 1 1 1 PHE HD2 H -9.893 -7.934 17.259 1.00 . A A . 5 PHE HD2 1 1 18 12374 1 1 1 PHE HE1 H -8.228 -8.340 21.913 1.00 . A A . 5 PHE HE1 1 1 18 12375 1 1 1 PHE HE2 H -10.618 -9.837 18.673 1.00 . A A . 5 PHE HE2 1 1 18 12376 1 1 1 PHE HZ H -9.786 -10.039 21.000 1.00 . A A . 5 PHE HZ 1 1 18 12377 1 1 1 PHE N N -5.960 -6.013 18.749 1.00 . A A . 5 PHE N 1 1 18 12378 1 1 1 PHE O O -6.776 -3.901 16.575 1.00 . A A . 5 PHE O 1 1 18 12379 1 1 2 GLU C C -5.500 -4.708 13.194 1.00 . A A . 6 GLU C 1 1 18 12380 1 1 2 GLU CA C -5.004 -4.339 14.595 1.00 . A A . 6 GLU CA 1 1 18 12381 1 1 2 GLU CB C -3.477 -4.389 14.654 1.00 . A A . 6 GLU CB 1 1 18 12382 1 1 2 GLU CD C -3.009 -2.195 15.754 1.00 . A A . 6 GLU CD 1 1 18 12383 1 1 2 GLU CG C -2.914 -2.982 14.445 1.00 . A A . 6 GLU CG 1 1 18 12384 1 1 2 GLU H H -5.112 -6.271 15.547 1.00 . A A . 6 GLU H 1 1 18 12385 1 1 2 GLU HA H -5.352 -3.358 14.873 1.00 . A A . 6 GLU HA 1 1 18 12386 1 1 2 GLU HB2 H -3.165 -4.762 15.618 1.00 . A A . 6 GLU HB2 1 1 18 12387 1 1 2 GLU HB3 H -3.108 -5.043 13.877 1.00 . A A . 6 GLU HB3 1 1 18 12388 1 1 2 GLU HG2 H -1.879 -3.050 14.141 1.00 . A A . 6 GLU HG2 1 1 18 12389 1 1 2 GLU HG3 H -3.482 -2.476 13.678 1.00 . A A . 6 GLU HG3 1 1 18 12390 1 1 2 GLU N N -5.462 -5.356 15.586 1.00 . A A . 6 GLU N 1 1 18 12391 1 1 2 GLU O O -5.823 -3.850 12.395 1.00 . A A . 6 GLU O 1 1 18 12392 1 1 2 GLU OE1 O -2.149 -2.382 16.599 1.00 . A A . 6 GLU OE1 1 1 18 12393 1 1 2 GLU OE2 O -3.939 -1.417 15.887 1.00 . A A . 6 GLU OE2 1 1 18 12394 1 1 3 ILE C C -7.387 -7.129 11.663 1.00 . A A . 7 ILE C 1 1 18 12395 1 1 3 ILE CA C -6.039 -6.394 11.540 1.00 . A A . 7 ILE CA 1 1 18 12396 1 1 3 ILE CB C -4.939 -7.318 11.007 1.00 . A A . 7 ILE CB 1 1 18 12397 1 1 3 ILE CD1 C -4.938 -6.337 8.711 1.00 . A A . 7 ILE CD1 1 1 18 12398 1 1 3 ILE CG1 C -5.185 -7.608 9.525 1.00 . A A . 7 ILE CG1 1 1 18 12399 1 1 3 ILE CG2 C -4.928 -8.634 11.790 1.00 . A A . 7 ILE CG2 1 1 18 12400 1 1 3 ILE H H -5.299 -6.650 13.548 1.00 . A A . 7 ILE H 1 1 18 12401 1 1 3 ILE HA H -6.140 -5.535 10.896 1.00 . A A . 7 ILE HA 1 1 18 12402 1 1 3 ILE HB H -3.980 -6.831 11.122 1.00 . A A . 7 ILE HB 1 1 18 12403 1 1 3 ILE HD11 H -3.929 -5.992 8.878 1.00 . A A . 7 ILE HD11 1 1 18 12404 1 1 3 ILE HD12 H -5.635 -5.572 9.016 1.00 . A A . 7 ILE HD12 1 1 18 12405 1 1 3 ILE HD13 H -5.076 -6.551 7.660 1.00 . A A . 7 ILE HD13 1 1 18 12406 1 1 3 ILE HG12 H -4.508 -8.381 9.196 1.00 . A A . 7 ILE HG12 1 1 18 12407 1 1 3 ILE HG13 H -6.205 -7.935 9.387 1.00 . A A . 7 ILE HG13 1 1 18 12408 1 1 3 ILE HG21 H -5.430 -8.493 12.736 1.00 . A A . 7 ILE HG21 1 1 18 12409 1 1 3 ILE HG22 H -3.908 -8.941 11.966 1.00 . A A . 7 ILE HG22 1 1 18 12410 1 1 3 ILE HG23 H -5.442 -9.395 11.221 1.00 . A A . 7 ILE HG23 1 1 18 12411 1 1 3 ILE N N -5.564 -5.974 12.890 1.00 . A A . 7 ILE N 1 1 18 12412 1 1 3 ILE O O -7.603 -7.860 12.610 1.00 . A A . 7 ILE O 1 1 18 12413 1 1 4 PRO C C -9.519 -8.989 10.210 1.00 . A A . 8 PRO C 1 1 18 12414 1 1 4 PRO CA C -9.590 -7.546 10.736 1.00 . A A . 8 PRO CA 1 1 18 12415 1 1 4 PRO CB C -10.428 -6.663 9.818 1.00 . A A . 8 PRO CB 1 1 18 12416 1 1 4 PRO CD C -8.088 -6.040 9.532 1.00 . A A . 8 PRO CD 1 1 18 12417 1 1 4 PRO CG C -9.452 -6.008 8.883 1.00 . A A . 8 PRO CG 1 1 18 12418 1 1 4 PRO HA H -9.995 -7.527 11.733 1.00 . A A . 8 PRO HA 1 1 18 12419 1 1 4 PRO HB2 H -11.131 -7.264 9.262 1.00 . A A . 8 PRO HB2 1 1 18 12420 1 1 4 PRO HB3 H -10.951 -5.914 10.396 1.00 . A A . 8 PRO HB3 1 1 18 12421 1 1 4 PRO HD2 H -7.361 -6.462 8.856 1.00 . A A . 8 PRO HD2 1 1 18 12422 1 1 4 PRO HD3 H -7.790 -5.048 9.835 1.00 . A A . 8 PRO HD3 1 1 18 12423 1 1 4 PRO HG2 H -9.424 -6.549 7.950 1.00 . A A . 8 PRO HG2 1 1 18 12424 1 1 4 PRO HG3 H -9.749 -4.986 8.705 1.00 . A A . 8 PRO HG3 1 1 18 12425 1 1 4 PRO N N -8.256 -6.903 10.708 1.00 . A A . 8 PRO N 1 1 18 12426 1 1 4 PRO O O -9.352 -9.921 10.970 1.00 . A A . 8 PRO O 1 1 18 12427 1 1 5 ASP C C -8.207 -10.905 7.864 1.00 . A A . 9 ASP C 1 1 18 12428 1 1 5 ASP CA C -9.613 -10.564 8.372 1.00 . A A . 9 ASP CA 1 1 18 12429 1 1 5 ASP CB C -10.605 -10.535 7.213 1.00 . A A . 9 ASP CB 1 1 18 12430 1 1 5 ASP CG C -10.152 -9.510 6.173 1.00 . A A . 9 ASP CG 1 1 18 12431 1 1 5 ASP H H -9.800 -8.431 8.320 1.00 . A A . 9 ASP H 1 1 18 12432 1 1 5 ASP HA H -9.932 -11.279 9.112 1.00 . A A . 9 ASP HA 1 1 18 12433 1 1 5 ASP HB2 H -10.649 -11.507 6.760 1.00 . A A . 9 ASP HB2 1 1 18 12434 1 1 5 ASP HB3 H -11.584 -10.267 7.583 1.00 . A A . 9 ASP HB3 1 1 18 12435 1 1 5 ASP N N -9.657 -9.184 8.924 1.00 . A A . 9 ASP N 1 1 18 12436 1 1 5 ASP O O -8.046 -11.625 6.901 1.00 . A A . 9 ASP O 1 1 18 12437 1 1 5 ASP OD1 O -10.293 -8.327 6.436 1.00 . A A . 9 ASP OD1 1 1 18 12438 1 1 5 ASP OD2 O -9.673 -9.924 5.130 1.00 . A A . 9 ASP OD2 1 1 18 12439 1 1 6 ASP C C -5.650 -10.406 6.557 1.00 . A A . 10 ASP C 1 1 18 12440 1 1 6 ASP CA C -5.801 -10.700 8.053 1.00 . A A . 10 ASP CA 1 1 18 12441 1 1 6 ASP CB C -5.617 -12.193 8.327 1.00 . A A . 10 ASP CB 1 1 18 12442 1 1 6 ASP CG C -4.248 -12.642 7.812 1.00 . A A . 10 ASP CG 1 1 18 12443 1 1 6 ASP H H -7.339 -9.819 9.282 1.00 . A A . 10 ASP H 1 1 18 12444 1 1 6 ASP HA H -5.087 -10.132 8.624 1.00 . A A . 10 ASP HA 1 1 18 12445 1 1 6 ASP HB2 H -5.677 -12.373 9.390 1.00 . A A . 10 ASP HB2 1 1 18 12446 1 1 6 ASP HB3 H -6.392 -12.749 7.822 1.00 . A A . 10 ASP HB3 1 1 18 12447 1 1 6 ASP N N -7.190 -10.396 8.504 1.00 . A A . 10 ASP N 1 1 18 12448 1 1 6 ASP O O -5.406 -11.292 5.762 1.00 . A A . 10 ASP O 1 1 18 12449 1 1 6 ASP OD1 O -3.255 -12.221 8.383 1.00 . A A . 10 ASP OD1 1 1 18 12450 1 1 6 ASP OD2 O -4.216 -13.399 6.856 1.00 . A A . 10 ASP OD2 1 1 18 12451 1 1 7 VAL C C -4.700 -7.635 4.545 1.00 . A A . 11 VAL C 1 1 18 12452 1 1 7 VAL CA C -5.657 -8.824 4.721 1.00 . A A . 11 VAL CA 1 1 18 12453 1 1 7 VAL CB C -7.069 -8.447 4.272 1.00 . A A . 11 VAL CB 1 1 18 12454 1 1 7 VAL CG1 C -7.596 -7.308 5.148 1.00 . A A . 11 VAL CG1 1 1 18 12455 1 1 7 VAL CG2 C -7.034 -7.991 2.810 1.00 . A A . 11 VAL CG2 1 1 18 12456 1 1 7 VAL H H -5.990 -8.467 6.821 1.00 . A A . 11 VAL H 1 1 18 12457 1 1 7 VAL HA H -5.309 -9.678 4.163 1.00 . A A . 11 VAL HA 1 1 18 12458 1 1 7 VAL HB H -7.717 -9.304 4.365 1.00 . A A . 11 VAL HB 1 1 18 12459 1 1 7 VAL HG11 H -6.929 -6.462 5.078 1.00 . A A . 11 VAL HG11 1 1 18 12460 1 1 7 VAL HG12 H -7.650 -7.639 6.174 1.00 . A A . 11 VAL HG12 1 1 18 12461 1 1 7 VAL HG13 H -8.580 -7.020 4.809 1.00 . A A . 11 VAL HG13 1 1 18 12462 1 1 7 VAL HG21 H -7.976 -7.529 2.555 1.00 . A A . 11 VAL HG21 1 1 18 12463 1 1 7 VAL HG22 H -6.866 -8.846 2.172 1.00 . A A . 11 VAL HG22 1 1 18 12464 1 1 7 VAL HG23 H -6.235 -7.278 2.675 1.00 . A A . 11 VAL HG23 1 1 18 12465 1 1 7 VAL N N -5.793 -9.168 6.166 1.00 . A A . 11 VAL N 1 1 18 12466 1 1 7 VAL O O -4.721 -6.709 5.331 1.00 . A A . 11 VAL O 1 1 18 12467 1 1 8 PRO C C -3.646 -5.363 2.699 1.00 . A A . 12 PRO C 1 1 18 12468 1 1 8 PRO CA C -2.924 -6.601 3.252 1.00 . A A . 12 PRO CA 1 1 18 12469 1 1 8 PRO CB C -1.968 -7.201 2.223 1.00 . A A . 12 PRO CB 1 1 18 12470 1 1 8 PRO CD C -3.789 -8.772 2.516 1.00 . A A . 12 PRO CD 1 1 18 12471 1 1 8 PRO CG C -2.749 -8.281 1.540 1.00 . A A . 12 PRO CG 1 1 18 12472 1 1 8 PRO HA H -2.384 -6.351 4.152 1.00 . A A . 12 PRO HA 1 1 18 12473 1 1 8 PRO HB2 H -1.667 -6.447 1.509 1.00 . A A . 12 PRO HB2 1 1 18 12474 1 1 8 PRO HB3 H -1.103 -7.618 2.716 1.00 . A A . 12 PRO HB3 1 1 18 12475 1 1 8 PRO HD2 H -4.736 -8.914 2.018 1.00 . A A . 12 PRO HD2 1 1 18 12476 1 1 8 PRO HD3 H -3.465 -9.691 2.981 1.00 . A A . 12 PRO HD3 1 1 18 12477 1 1 8 PRO HG2 H -3.230 -7.888 0.657 1.00 . A A . 12 PRO HG2 1 1 18 12478 1 1 8 PRO HG3 H -2.090 -9.092 1.268 1.00 . A A . 12 PRO HG3 1 1 18 12479 1 1 8 PRO N N -3.887 -7.696 3.516 1.00 . A A . 12 PRO N 1 1 18 12480 1 1 8 PRO O O -4.033 -4.482 3.440 1.00 . A A . 12 PRO O 1 1 18 12481 1 1 9 LEU C C -5.965 -4.474 0.423 1.00 . A A . 13 LEU C 1 1 18 12482 1 1 9 LEU CA C -4.529 -4.100 0.827 1.00 . A A . 13 LEU CA 1 1 18 12483 1 1 9 LEU CB C -3.707 -3.727 -0.408 1.00 . A A . 13 LEU CB 1 1 18 12484 1 1 9 LEU CD1 C -1.321 -4.310 -0.882 1.00 . A A . 13 LEU CD1 1 1 18 12485 1 1 9 LEU CD2 C -1.923 -1.993 -0.167 1.00 . A A . 13 LEU CD2 1 1 18 12486 1 1 9 LEU CG C -2.253 -3.477 0.002 1.00 . A A . 13 LEU CG 1 1 18 12487 1 1 9 LEU H H -3.517 -5.999 0.820 1.00 . A A . 13 LEU H 1 1 18 12488 1 1 9 LEU HA H -4.527 -3.282 1.530 1.00 . A A . 13 LEU HA 1 1 18 12489 1 1 9 LEU HB2 H -3.745 -4.537 -1.122 1.00 . A A . 13 LEU HB2 1 1 18 12490 1 1 9 LEU HB3 H -4.114 -2.833 -0.856 1.00 . A A . 13 LEU HB3 1 1 18 12491 1 1 9 LEU HD11 H -0.564 -3.669 -1.311 1.00 . A A . 13 LEU HD11 1 1 18 12492 1 1 9 LEU HD12 H -1.891 -4.770 -1.675 1.00 . A A . 13 LEU HD12 1 1 18 12493 1 1 9 LEU HD13 H -0.848 -5.075 -0.285 1.00 . A A . 13 LEU HD13 1 1 18 12494 1 1 9 LEU HD21 H -0.866 -1.838 -0.005 1.00 . A A . 13 LEU HD21 1 1 18 12495 1 1 9 LEU HD22 H -2.486 -1.414 0.550 1.00 . A A . 13 LEU HD22 1 1 18 12496 1 1 9 LEU HD23 H -2.184 -1.678 -1.167 1.00 . A A . 13 LEU HD23 1 1 18 12497 1 1 9 LEU HG H -2.116 -3.761 1.036 1.00 . A A . 13 LEU HG 1 1 18 12498 1 1 9 LEU N N -3.833 -5.283 1.408 1.00 . A A . 13 LEU N 1 1 18 12499 1 1 9 LEU O O -6.159 -5.346 -0.400 1.00 . A A . 13 LEU O 1 1 18 12500 1 1 10 PRO C C -8.700 -3.577 -0.709 1.00 . A A . 14 PRO C 1 1 18 12501 1 1 10 PRO CA C -8.351 -4.097 0.689 1.00 . A A . 14 PRO CA 1 1 18 12502 1 1 10 PRO CB C -9.127 -3.340 1.764 1.00 . A A . 14 PRO CB 1 1 18 12503 1 1 10 PRO CD C -6.803 -2.739 2.017 1.00 . A A . 14 PRO CD 1 1 18 12504 1 1 10 PRO CG C -8.214 -2.240 2.201 1.00 . A A . 14 PRO CG 1 1 18 12505 1 1 10 PRO HA H -8.552 -5.154 0.765 1.00 . A A . 14 PRO HA 1 1 18 12506 1 1 10 PRO HB2 H -10.038 -2.930 1.353 1.00 . A A . 14 PRO HB2 1 1 18 12507 1 1 10 PRO HB3 H -9.352 -3.993 2.596 1.00 . A A . 14 PRO HB3 1 1 18 12508 1 1 10 PRO HD2 H -6.167 -1.949 1.649 1.00 . A A . 14 PRO HD2 1 1 18 12509 1 1 10 PRO HD3 H -6.418 -3.136 2.944 1.00 . A A . 14 PRO HD3 1 1 18 12510 1 1 10 PRO HG2 H -8.376 -1.363 1.593 1.00 . A A . 14 PRO HG2 1 1 18 12511 1 1 10 PRO HG3 H -8.389 -2.006 3.240 1.00 . A A . 14 PRO HG3 1 1 18 12512 1 1 10 PRO N N -6.931 -3.807 1.013 1.00 . A A . 14 PRO N 1 1 18 12513 1 1 10 PRO O O -7.832 -3.315 -1.517 1.00 . A A . 14 PRO O 1 1 18 12514 1 1 11 ALA C C -10.072 -1.438 -2.478 1.00 . A A . 15 ALA C 1 1 18 12515 1 1 11 ALA CA C -10.365 -2.936 -2.352 1.00 . A A . 15 ALA CA 1 1 18 12516 1 1 11 ALA CB C -11.869 -3.198 -2.438 1.00 . A A . 15 ALA CB 1 1 18 12517 1 1 11 ALA H H -10.650 -3.656 -0.339 1.00 . A A . 15 ALA H 1 1 18 12518 1 1 11 ALA HA H -9.852 -3.487 -3.123 1.00 . A A . 15 ALA HA 1 1 18 12519 1 1 11 ALA HB1 H -12.404 -2.373 -1.989 1.00 . A A . 15 ALA HB1 1 1 18 12520 1 1 11 ALA HB2 H -12.107 -4.110 -1.910 1.00 . A A . 15 ALA HB2 1 1 18 12521 1 1 11 ALA HB3 H -12.158 -3.294 -3.473 1.00 . A A . 15 ALA HB3 1 1 18 12522 1 1 11 ALA N N -9.964 -3.433 -1.003 1.00 . A A . 15 ALA N 1 1 18 12523 1 1 11 ALA O O -9.721 -0.779 -1.518 1.00 . A A . 15 ALA O 1 1 18 12524 1 1 12 GLY C C -8.463 0.857 -3.611 1.00 . A A . 16 GLY C 1 1 18 12525 1 1 12 GLY CA C -9.948 0.558 -3.852 1.00 . A A . 16 GLY CA 1 1 18 12526 1 1 12 GLY H H -10.500 -1.445 -4.417 1.00 . A A . 16 GLY H 1 1 18 12527 1 1 12 GLY HA2 H -10.211 0.840 -4.860 1.00 . A A . 16 GLY HA2 1 1 18 12528 1 1 12 GLY HA3 H -10.544 1.130 -3.155 1.00 . A A . 16 GLY HA3 1 1 18 12529 1 1 12 GLY N N -10.216 -0.895 -3.658 1.00 . A A . 16 GLY N 1 1 18 12530 1 1 12 GLY O O -8.066 1.998 -3.479 1.00 . A A . 16 GLY O 1 1 18 12531 1 1 13 TRP C C -5.380 -0.187 -4.583 1.00 . A A . 17 TRP C 1 1 18 12532 1 1 13 TRP CA C -6.185 0.084 -3.310 1.00 . A A . 17 TRP CA 1 1 18 12533 1 1 13 TRP CB C -5.808 -0.917 -2.223 1.00 . A A . 17 TRP CB 1 1 18 12534 1 1 13 TRP CD1 C -6.915 -0.303 -0.041 1.00 . A A . 17 TRP CD1 1 1 18 12535 1 1 13 TRP CD2 C -4.872 0.600 -0.269 1.00 . A A . 17 TRP CD2 1 1 18 12536 1 1 13 TRP CE2 C -5.359 1.025 0.988 1.00 . A A . 17 TRP CE2 1 1 18 12537 1 1 13 TRP CE3 C -3.598 1.030 -0.667 1.00 . A A . 17 TRP CE3 1 1 18 12538 1 1 13 TRP CG C -5.872 -0.242 -0.897 1.00 . A A . 17 TRP CG 1 1 18 12539 1 1 13 TRP CH2 C -3.336 2.268 1.408 1.00 . A A . 17 TRP CH2 1 1 18 12540 1 1 13 TRP CZ2 C -4.604 1.851 1.823 1.00 . A A . 17 TRP CZ2 1 1 18 12541 1 1 13 TRP CZ3 C -2.836 1.858 0.167 1.00 . A A . 17 TRP CZ3 1 1 18 12542 1 1 13 TRP H H -7.970 -1.069 -3.648 1.00 . A A . 17 TRP H 1 1 18 12543 1 1 13 TRP HA H -6.018 1.089 -2.960 1.00 . A A . 17 TRP HA 1 1 18 12544 1 1 13 TRP HB2 H -6.498 -1.747 -2.240 1.00 . A A . 17 TRP HB2 1 1 18 12545 1 1 13 TRP HB3 H -4.805 -1.278 -2.395 1.00 . A A . 17 TRP HB3 1 1 18 12546 1 1 13 TRP HD1 H -7.831 -0.850 -0.206 1.00 . A A . 17 TRP HD1 1 1 18 12547 1 1 13 TRP HE1 H -7.200 0.568 1.859 1.00 . A A . 17 TRP HE1 1 1 18 12548 1 1 13 TRP HE3 H -3.201 0.721 -1.622 1.00 . A A . 17 TRP HE3 1 1 18 12549 1 1 13 TRP HH2 H -2.739 2.906 2.041 1.00 . A A . 17 TRP HH2 1 1 18 12550 1 1 13 TRP HZ2 H -4.996 2.164 2.779 1.00 . A A . 17 TRP HZ2 1 1 18 12551 1 1 13 TRP HZ3 H -1.863 2.183 -0.150 1.00 . A A . 17 TRP HZ3 1 1 18 12552 1 1 13 TRP N N -7.638 -0.154 -3.547 1.00 . A A . 17 TRP N 1 1 18 12553 1 1 13 TRP NE1 N -6.613 0.448 1.083 1.00 . A A . 17 TRP NE1 1 1 18 12554 1 1 13 TRP O O -5.711 -1.056 -5.363 1.00 . A A . 17 TRP O 1 1 18 12555 1 1 14 GLU C C -2.011 0.327 -5.716 1.00 . A A . 18 GLU C 1 1 18 12556 1 1 14 GLU CA C -3.508 0.319 -6.029 1.00 . A A . 18 GLU CA 1 1 18 12557 1 1 14 GLU CB C -3.838 1.484 -6.961 1.00 . A A . 18 GLU CB 1 1 18 12558 1 1 14 GLU CD C -6.187 1.152 -7.747 1.00 . A A . 18 GLU CD 1 1 18 12559 1 1 14 GLU CG C -4.711 0.988 -8.114 1.00 . A A . 18 GLU CG 1 1 18 12560 1 1 14 GLU H H -4.065 1.252 -4.163 1.00 . A A . 18 GLU H 1 1 18 12561 1 1 14 GLU HA H -3.789 -0.611 -6.497 1.00 . A A . 18 GLU HA 1 1 18 12562 1 1 14 GLU HB2 H -4.363 2.249 -6.412 1.00 . A A . 18 GLU HB2 1 1 18 12563 1 1 14 GLU HB3 H -2.923 1.896 -7.358 1.00 . A A . 18 GLU HB3 1 1 18 12564 1 1 14 GLU HG2 H -4.493 1.563 -9.003 1.00 . A A . 18 GLU HG2 1 1 18 12565 1 1 14 GLU HG3 H -4.499 -0.055 -8.301 1.00 . A A . 18 GLU HG3 1 1 18 12566 1 1 14 GLU N N -4.322 0.550 -4.801 1.00 . A A . 18 GLU N 1 1 18 12567 1 1 14 GLU O O -1.383 1.373 -5.693 1.00 . A A . 18 GLU O 1 1 18 12568 1 1 14 GLU OE1 O -6.733 0.242 -7.146 1.00 . A A . 18 GLU OE1 1 1 18 12569 1 1 14 GLU OE2 O -6.747 2.185 -8.076 1.00 . A A . 18 GLU OE2 1 1 18 12570 1 1 15 MET C C 0.759 -0.423 -6.513 1.00 . A A . 19 MET C 1 1 18 12571 1 1 15 MET CA C 0.039 -0.839 -5.238 1.00 . A A . 19 MET CA 1 1 18 12572 1 1 15 MET CB C 0.406 -2.275 -4.869 1.00 . A A . 19 MET CB 1 1 18 12573 1 1 15 MET CE C -1.870 -4.147 -4.192 1.00 . A A . 19 MET CE 1 1 18 12574 1 1 15 MET CG C -0.025 -3.239 -5.981 1.00 . A A . 19 MET CG 1 1 18 12575 1 1 15 MET H H -1.924 -1.655 -5.539 1.00 . A A . 19 MET H 1 1 18 12576 1 1 15 MET HA H 0.285 -0.170 -4.428 1.00 . A A . 19 MET HA 1 1 18 12577 1 1 15 MET HB2 H 1.470 -2.334 -4.748 1.00 . A A . 19 MET HB2 1 1 18 12578 1 1 15 MET HB3 H -0.069 -2.545 -3.941 1.00 . A A . 19 MET HB3 1 1 18 12579 1 1 15 MET HE1 H -2.574 -4.933 -3.959 1.00 . A A . 19 MET HE1 1 1 18 12580 1 1 15 MET HE2 H -2.381 -3.349 -4.707 1.00 . A A . 19 MET HE2 1 1 18 12581 1 1 15 MET HE3 H -1.436 -3.763 -3.280 1.00 . A A . 19 MET HE3 1 1 18 12582 1 1 15 MET HG2 H -0.837 -2.809 -6.546 1.00 . A A . 19 MET HG2 1 1 18 12583 1 1 15 MET HG3 H 0.812 -3.420 -6.639 1.00 . A A . 19 MET HG3 1 1 18 12584 1 1 15 MET N N -1.420 -0.820 -5.502 1.00 . A A . 19 MET N 1 1 18 12585 1 1 15 MET O O 0.567 -0.997 -7.567 1.00 . A A . 19 MET O 1 1 18 12586 1 1 15 MET SD S -0.559 -4.810 -5.250 1.00 . A A . 19 MET SD 1 1 18 12587 1 1 16 ALA C C 3.586 1.729 -7.163 1.00 . A A . 20 ALA C 1 1 18 12588 1 1 16 ALA CA C 2.303 1.046 -7.632 1.00 . A A . 20 ALA CA 1 1 18 12589 1 1 16 ALA CB C 1.327 2.016 -8.309 1.00 . A A . 20 ALA CB 1 1 18 12590 1 1 16 ALA H H 1.713 1.026 -5.568 1.00 . A A . 20 ALA H 1 1 18 12591 1 1 16 ALA HA H 2.530 0.218 -8.287 1.00 . A A . 20 ALA HA 1 1 18 12592 1 1 16 ALA HB1 H 1.855 2.890 -8.651 1.00 . A A . 20 ALA HB1 1 1 18 12593 1 1 16 ALA HB2 H 0.566 2.311 -7.601 1.00 . A A . 20 ALA HB2 1 1 18 12594 1 1 16 ALA HB3 H 0.859 1.525 -9.151 1.00 . A A . 20 ALA HB3 1 1 18 12595 1 1 16 ALA N N 1.575 0.575 -6.430 1.00 . A A . 20 ALA N 1 1 18 12596 1 1 16 ALA O O 4.092 1.399 -6.110 1.00 . A A . 20 ALA O 1 1 18 12597 1 1 17 LYS C C 5.273 4.814 -7.381 1.00 . A A . 21 LYS C 1 1 18 12598 1 1 17 LYS CA C 5.389 3.298 -7.416 1.00 . A A . 21 LYS CA 1 1 18 12599 1 1 17 LYS CB C 6.477 2.855 -8.394 1.00 . A A . 21 LYS CB 1 1 18 12600 1 1 17 LYS CD C 7.959 0.961 -9.072 1.00 . A A . 21 LYS CD 1 1 18 12601 1 1 17 LYS CE C 9.334 0.867 -8.408 1.00 . A A . 21 LYS CE 1 1 18 12602 1 1 17 LYS CG C 6.929 1.435 -8.046 1.00 . A A . 21 LYS CG 1 1 18 12603 1 1 17 LYS H H 3.737 2.921 -8.755 1.00 . A A . 21 LYS H 1 1 18 12604 1 1 17 LYS HA H 5.613 2.941 -6.430 1.00 . A A . 21 LYS HA 1 1 18 12605 1 1 17 LYS HB2 H 6.084 2.871 -9.399 1.00 . A A . 21 LYS HB2 1 1 18 12606 1 1 17 LYS HB3 H 7.319 3.527 -8.324 1.00 . A A . 21 LYS HB3 1 1 18 12607 1 1 17 LYS HD2 H 7.674 -0.009 -9.448 1.00 . A A . 21 LYS HD2 1 1 18 12608 1 1 17 LYS HD3 H 8.002 1.666 -9.891 1.00 . A A . 21 LYS HD3 1 1 18 12609 1 1 17 LYS HE2 H 9.518 1.739 -7.800 1.00 . A A . 21 LYS HE2 1 1 18 12610 1 1 17 LYS HE3 H 9.402 -0.032 -7.812 1.00 . A A . 21 LYS HE3 1 1 18 12611 1 1 17 LYS HG2 H 7.371 1.430 -7.061 1.00 . A A . 21 LYS HG2 1 1 18 12612 1 1 17 LYS HG3 H 6.075 0.772 -8.060 1.00 . A A . 21 LYS HG3 1 1 18 12613 1 1 17 LYS HZ1 H 10.127 -0.044 -10.105 1.00 . A A . 21 LYS HZ1 1 1 18 12614 1 1 17 LYS HZ2 H 11.273 0.789 -9.166 1.00 . A A . 21 LYS HZ2 1 1 18 12615 1 1 17 LYS HZ3 H 10.181 1.650 -10.142 1.00 . A A . 21 LYS HZ3 1 1 18 12616 1 1 17 LYS N N 4.134 2.658 -7.901 1.00 . A A . 21 LYS N 1 1 18 12617 1 1 17 LYS NZ N 10.302 0.812 -9.540 1.00 . A A . 21 LYS NZ 1 1 18 12618 1 1 17 LYS O O 4.423 5.406 -8.016 1.00 . A A . 21 LYS O 1 1 18 12619 1 1 18 THR C C 7.429 7.563 -6.861 1.00 . A A . 22 THR C 1 1 18 12620 1 1 18 THR CA C 6.074 6.937 -6.532 1.00 . A A . 22 THR CA 1 1 18 12621 1 1 18 THR CB C 5.664 7.268 -5.085 1.00 . A A . 22 THR CB 1 1 18 12622 1 1 18 THR CG2 C 6.403 6.371 -4.079 1.00 . A A . 22 THR CG2 1 1 18 12623 1 1 18 THR H H 6.810 4.934 -6.115 1.00 . A A . 22 THR H 1 1 18 12624 1 1 18 THR HA H 5.325 7.315 -7.209 1.00 . A A . 22 THR HA 1 1 18 12625 1 1 18 THR HB H 4.603 7.121 -4.980 1.00 . A A . 22 THR HB 1 1 18 12626 1 1 18 THR HG1 H 5.991 8.750 -3.865 1.00 . A A . 22 THR HG1 1 1 18 12627 1 1 18 THR HG21 H 6.253 5.333 -4.335 1.00 . A A . 22 THR HG21 1 1 18 12628 1 1 18 THR HG22 H 6.016 6.553 -3.087 1.00 . A A . 22 THR HG22 1 1 18 12629 1 1 18 THR HG23 H 7.459 6.599 -4.101 1.00 . A A . 22 THR HG23 1 1 18 12630 1 1 18 THR N N 6.130 5.446 -6.626 1.00 . A A . 22 THR N 1 1 18 12631 1 1 18 THR O O 8.390 6.884 -7.161 1.00 . A A . 22 THR O 1 1 18 12632 1 1 18 THR OG1 O 5.976 8.629 -4.817 1.00 . A A . 22 THR OG1 1 1 18 12633 1 1 19 SER C C 9.824 9.286 -6.048 1.00 . A A . 23 SER C 1 1 18 12634 1 1 19 SER CA C 8.780 9.565 -7.131 1.00 . A A . 23 SER CA 1 1 18 12635 1 1 19 SER CB C 8.420 11.051 -7.158 1.00 . A A . 23 SER CB 1 1 18 12636 1 1 19 SER H H 6.704 9.386 -6.573 1.00 . A A . 23 SER H 1 1 18 12637 1 1 19 SER HA H 9.147 9.259 -8.096 1.00 . A A . 23 SER HA 1 1 18 12638 1 1 19 SER HB2 H 7.541 11.221 -6.554 1.00 . A A . 23 SER HB2 1 1 18 12639 1 1 19 SER HB3 H 9.245 11.627 -6.764 1.00 . A A . 23 SER HB3 1 1 18 12640 1 1 19 SER HG H 7.921 12.380 -8.485 1.00 . A A . 23 SER HG 1 1 18 12641 1 1 19 SER N N 7.499 8.866 -6.814 1.00 . A A . 23 SER N 1 1 18 12642 1 1 19 SER O O 9.950 10.019 -5.088 1.00 . A A . 23 SER O 1 1 18 12643 1 1 19 SER OG O 8.160 11.450 -8.495 1.00 . A A . 23 SER OG 1 1 18 12644 1 1 20 SER C C 12.328 6.593 -5.575 1.00 . A A . 24 SER C 1 1 18 12645 1 1 20 SER CA C 11.626 7.894 -5.187 1.00 . A A . 24 SER CA 1 1 18 12646 1 1 20 SER CB C 10.879 7.719 -3.862 1.00 . A A . 24 SER CB 1 1 18 12647 1 1 20 SER H H 10.460 7.660 -6.988 1.00 . A A . 24 SER H 1 1 18 12648 1 1 20 SER HA H 12.338 8.693 -5.107 1.00 . A A . 24 SER HA 1 1 18 12649 1 1 20 SER HB2 H 9.816 7.679 -4.050 1.00 . A A . 24 SER HB2 1 1 18 12650 1 1 20 SER HB3 H 11.195 6.799 -3.390 1.00 . A A . 24 SER HB3 1 1 18 12651 1 1 20 SER HG H 12.048 8.684 -2.646 1.00 . A A . 24 SER HG 1 1 18 12652 1 1 20 SER N N 10.578 8.230 -6.202 1.00 . A A . 24 SER N 1 1 18 12653 1 1 20 SER O O 13.504 6.410 -5.329 1.00 . A A . 24 SER O 1 1 18 12654 1 1 20 SER OG O 11.168 8.814 -3.007 1.00 . A A . 24 SER OG 1 1 18 12655 1 1 21 GLY C C 11.662 3.286 -5.679 1.00 . A A . 25 GLY C 1 1 18 12656 1 1 21 GLY CA C 12.216 4.392 -6.574 1.00 . A A . 25 GLY CA 1 1 18 12657 1 1 21 GLY H H 10.666 5.865 -6.350 1.00 . A A . 25 GLY H 1 1 18 12658 1 1 21 GLY HA2 H 11.970 4.182 -7.605 1.00 . A A . 25 GLY HA2 1 1 18 12659 1 1 21 GLY HA3 H 13.290 4.445 -6.463 1.00 . A A . 25 GLY HA3 1 1 18 12660 1 1 21 GLY N N 11.610 5.690 -6.171 1.00 . A A . 25 GLY N 1 1 18 12661 1 1 21 GLY O O 12.295 2.273 -5.460 1.00 . A A . 25 GLY O 1 1 18 12662 1 1 22 GLN C C 8.403 2.235 -4.599 1.00 . A A . 26 GLN C 1 1 18 12663 1 1 22 GLN CA C 9.886 2.440 -4.267 1.00 . A A . 26 GLN CA 1 1 18 12664 1 1 22 GLN CB C 10.044 2.995 -2.850 1.00 . A A . 26 GLN CB 1 1 18 12665 1 1 22 GLN CD C 11.752 1.692 -1.574 1.00 . A A . 26 GLN CD 1 1 18 12666 1 1 22 GLN CG C 11.516 2.931 -2.440 1.00 . A A . 26 GLN CG 1 1 18 12667 1 1 22 GLN H H 9.989 4.303 -5.341 1.00 . A A . 26 GLN H 1 1 18 12668 1 1 22 GLN HA H 10.424 1.511 -4.359 1.00 . A A . 26 GLN HA 1 1 18 12669 1 1 22 GLN HB2 H 9.706 4.020 -2.826 1.00 . A A . 26 GLN HB2 1 1 18 12670 1 1 22 GLN HB3 H 9.453 2.404 -2.164 1.00 . A A . 26 GLN HB3 1 1 18 12671 1 1 22 GLN HE21 H 10.213 2.063 -0.375 1.00 . A A . 26 GLN HE21 1 1 18 12672 1 1 22 GLN HE22 H 11.097 0.660 -0.009 1.00 . A A . 26 GLN HE22 1 1 18 12673 1 1 22 GLN HG2 H 12.135 2.876 -3.324 1.00 . A A . 26 GLN HG2 1 1 18 12674 1 1 22 GLN HG3 H 11.772 3.818 -1.877 1.00 . A A . 26 GLN HG3 1 1 18 12675 1 1 22 GLN N N 10.481 3.477 -5.155 1.00 . A A . 26 GLN N 1 1 18 12676 1 1 22 GLN NE2 N 10.955 1.452 -0.570 1.00 . A A . 26 GLN NE2 1 1 18 12677 1 1 22 GLN O O 7.741 3.117 -5.138 1.00 . A A . 26 GLN O 1 1 18 12678 1 1 22 GLN OE1 O 12.671 0.935 -1.814 1.00 . A A . 26 GLN OE1 1 1 18 12679 1 1 23 ARG C C 5.565 1.395 -3.480 1.00 . A A . 27 ARG C 1 1 18 12680 1 1 23 ARG CA C 6.446 0.807 -4.566 1.00 . A A . 27 ARG CA 1 1 18 12681 1 1 23 ARG CB C 6.273 -0.716 -4.571 1.00 . A A . 27 ARG CB 1 1 18 12682 1 1 23 ARG CD C 4.623 -2.133 -5.794 1.00 . A A . 27 ARG CD 1 1 18 12683 1 1 23 ARG CG C 5.793 -1.161 -5.950 1.00 . A A . 27 ARG CG 1 1 18 12684 1 1 23 ARG CZ C 4.562 -4.557 -5.493 1.00 . A A . 27 ARG CZ 1 1 18 12685 1 1 23 ARG H H 8.430 0.392 -3.844 1.00 . A A . 27 ARG H 1 1 18 12686 1 1 23 ARG HA H 6.177 1.210 -5.528 1.00 . A A . 27 ARG HA 1 1 18 12687 1 1 23 ARG HB2 H 7.205 -1.195 -4.334 1.00 . A A . 27 ARG HB2 1 1 18 12688 1 1 23 ARG HB3 H 5.534 -0.995 -3.833 1.00 . A A . 27 ARG HB3 1 1 18 12689 1 1 23 ARG HD2 H 3.970 -1.810 -4.995 1.00 . A A . 27 ARG HD2 1 1 18 12690 1 1 23 ARG HD3 H 4.073 -2.214 -6.721 1.00 . A A . 27 ARG HD3 1 1 18 12691 1 1 23 ARG HE H 6.199 -3.469 -5.191 1.00 . A A . 27 ARG HE 1 1 18 12692 1 1 23 ARG HG2 H 5.470 -0.296 -6.513 1.00 . A A . 27 ARG HG2 1 1 18 12693 1 1 23 ARG HG3 H 6.600 -1.651 -6.471 1.00 . A A . 27 ARG HG3 1 1 18 12694 1 1 23 ARG HH11 H 2.838 -3.699 -6.071 1.00 . A A . 27 ARG HH11 1 1 18 12695 1 1 23 ARG HH12 H 2.788 -5.415 -5.860 1.00 . A A . 27 ARG HH12 1 1 18 12696 1 1 23 ARG HH21 H 6.108 -5.695 -4.923 1.00 . A A . 27 ARG HH21 1 1 18 12697 1 1 23 ARG HH22 H 4.623 -6.538 -5.215 1.00 . A A . 27 ARG HH22 1 1 18 12698 1 1 23 ARG N N 7.879 1.078 -4.277 1.00 . A A . 27 ARG N 1 1 18 12699 1 1 23 ARG NE N 5.254 -3.442 -5.451 1.00 . A A . 27 ARG NE 1 1 18 12700 1 1 23 ARG NH1 N 3.297 -4.554 -5.836 1.00 . A A . 27 ARG NH1 1 1 18 12701 1 1 23 ARG NH2 N 5.143 -5.684 -5.187 1.00 . A A . 27 ARG NH2 1 1 18 12702 1 1 23 ARG O O 5.601 0.972 -2.340 1.00 . A A . 27 ARG O 1 1 18 12703 1 1 24 TYR C C 2.445 2.312 -3.046 1.00 . A A . 28 TYR C 1 1 18 12704 1 1 24 TYR CA C 3.819 2.890 -2.818 1.00 . A A . 28 TYR CA 1 1 18 12705 1 1 24 TYR CB C 3.859 4.425 -2.957 1.00 . A A . 28 TYR CB 1 1 18 12706 1 1 24 TYR CD1 C 2.695 4.155 -5.217 1.00 . A A . 28 TYR CD1 1 1 18 12707 1 1 24 TYR CD2 C 2.537 6.271 -4.051 1.00 . A A . 28 TYR CD2 1 1 18 12708 1 1 24 TYR CE1 C 1.935 4.677 -6.264 1.00 . A A . 28 TYR CE1 1 1 18 12709 1 1 24 TYR CE2 C 1.785 6.794 -5.105 1.00 . A A . 28 TYR CE2 1 1 18 12710 1 1 24 TYR CG C 3.000 4.950 -4.102 1.00 . A A . 28 TYR CG 1 1 18 12711 1 1 24 TYR CZ C 1.484 5.997 -6.211 1.00 . A A . 28 TYR CZ 1 1 18 12712 1 1 24 TYR H H 4.702 2.620 -4.760 1.00 . A A . 28 TYR H 1 1 18 12713 1 1 24 TYR HA H 4.152 2.606 -1.831 1.00 . A A . 28 TYR HA 1 1 18 12714 1 1 24 TYR HB2 H 3.512 4.865 -2.036 1.00 . A A . 28 TYR HB2 1 1 18 12715 1 1 24 TYR HB3 H 4.881 4.731 -3.122 1.00 . A A . 28 TYR HB3 1 1 18 12716 1 1 24 TYR HD1 H 3.022 3.137 -5.262 1.00 . A A . 28 TYR HD1 1 1 18 12717 1 1 24 TYR HD2 H 2.760 6.890 -3.195 1.00 . A A . 28 TYR HD2 1 1 18 12718 1 1 24 TYR HE1 H 1.705 4.062 -7.115 1.00 . A A . 28 TYR HE1 1 1 18 12719 1 1 24 TYR HE2 H 1.431 7.807 -5.060 1.00 . A A . 28 TYR HE2 1 1 18 12720 1 1 24 TYR HH H 1.176 6.251 -8.076 1.00 . A A . 28 TYR HH 1 1 18 12721 1 1 24 TYR N N 4.740 2.327 -3.830 1.00 . A A . 28 TYR N 1 1 18 12722 1 1 24 TYR O O 2.221 1.567 -3.982 1.00 . A A . 28 TYR O 1 1 18 12723 1 1 24 TYR OH O 0.754 6.517 -7.256 1.00 . A A . 28 TYR OH 1 1 18 12724 1 1 25 PHE C C -0.823 3.177 -2.411 1.00 . A A . 29 PHE C 1 1 18 12725 1 1 25 PHE CA C 0.191 2.050 -2.348 1.00 . A A . 29 PHE CA 1 1 18 12726 1 1 25 PHE CB C 0.050 1.119 -1.147 1.00 . A A . 29 PHE CB 1 1 18 12727 1 1 25 PHE CD1 C 2.408 0.160 -1.139 1.00 . A A . 29 PHE CD1 1 1 18 12728 1 1 25 PHE CD2 C 0.570 -1.232 -1.878 1.00 . A A . 29 PHE CD2 1 1 18 12729 1 1 25 PHE CE1 C 3.304 -0.884 -1.405 1.00 . A A . 29 PHE CE1 1 1 18 12730 1 1 25 PHE CE2 C 1.468 -2.273 -2.147 1.00 . A A . 29 PHE CE2 1 1 18 12731 1 1 25 PHE CG C 1.032 -0.017 -1.375 1.00 . A A . 29 PHE CG 1 1 18 12732 1 1 25 PHE CZ C 2.832 -2.099 -1.912 1.00 . A A . 29 PHE CZ 1 1 18 12733 1 1 25 PHE H H 1.749 3.202 -1.437 1.00 . A A . 29 PHE H 1 1 18 12734 1 1 25 PHE HA H 0.145 1.472 -3.258 1.00 . A A . 29 PHE HA 1 1 18 12735 1 1 25 PHE HB2 H 0.288 1.647 -0.234 1.00 . A A . 29 PHE HB2 1 1 18 12736 1 1 25 PHE HB3 H -0.956 0.732 -1.098 1.00 . A A . 29 PHE HB3 1 1 18 12737 1 1 25 PHE HD1 H 2.781 1.100 -0.752 1.00 . A A . 29 PHE HD1 1 1 18 12738 1 1 25 PHE HD2 H -0.480 -1.368 -2.062 1.00 . A A . 29 PHE HD2 1 1 18 12739 1 1 25 PHE HE1 H 4.359 -0.748 -1.230 1.00 . A A . 29 PHE HE1 1 1 18 12740 1 1 25 PHE HE2 H 1.103 -3.210 -2.544 1.00 . A A . 29 PHE HE2 1 1 18 12741 1 1 25 PHE HZ H 3.522 -2.902 -2.127 1.00 . A A . 29 PHE HZ 1 1 18 12742 1 1 25 PHE N N 1.539 2.615 -2.192 1.00 . A A . 29 PHE N 1 1 18 12743 1 1 25 PHE O O -1.173 3.800 -1.425 1.00 . A A . 29 PHE O 1 1 18 12744 1 1 26 LEU C C -3.610 4.138 -3.373 1.00 . A A . 30 LEU C 1 1 18 12745 1 1 26 LEU CA C -2.218 4.551 -3.854 1.00 . A A . 30 LEU CA 1 1 18 12746 1 1 26 LEU CB C -2.165 4.724 -5.380 1.00 . A A . 30 LEU CB 1 1 18 12747 1 1 26 LEU CD1 C -1.130 6.996 -5.021 1.00 . A A . 30 LEU CD1 1 1 18 12748 1 1 26 LEU CD2 C -1.882 6.294 -7.280 1.00 . A A . 30 LEU CD2 1 1 18 12749 1 1 26 LEU CG C -2.187 6.200 -5.789 1.00 . A A . 30 LEU CG 1 1 18 12750 1 1 26 LEU H H -0.912 2.929 -4.370 1.00 . A A . 30 LEU H 1 1 18 12751 1 1 26 LEU HA H -1.902 5.452 -3.360 1.00 . A A . 30 LEU HA 1 1 18 12752 1 1 26 LEU HB2 H -1.256 4.273 -5.751 1.00 . A A . 30 LEU HB2 1 1 18 12753 1 1 26 LEU HB3 H -3.005 4.224 -5.824 1.00 . A A . 30 LEU HB3 1 1 18 12754 1 1 26 LEU HD11 H -0.561 6.332 -4.389 1.00 . A A . 30 LEU HD11 1 1 18 12755 1 1 26 LEU HD12 H -1.623 7.739 -4.419 1.00 . A A . 30 LEU HD12 1 1 18 12756 1 1 26 LEU HD13 H -0.467 7.484 -5.719 1.00 . A A . 30 LEU HD13 1 1 18 12757 1 1 26 LEU HD21 H -2.792 6.165 -7.844 1.00 . A A . 30 LEU HD21 1 1 18 12758 1 1 26 LEU HD22 H -1.177 5.519 -7.549 1.00 . A A . 30 LEU HD22 1 1 18 12759 1 1 26 LEU HD23 H -1.452 7.261 -7.497 1.00 . A A . 30 LEU HD23 1 1 18 12760 1 1 26 LEU HG H -3.162 6.614 -5.593 1.00 . A A . 30 LEU HG 1 1 18 12761 1 1 26 LEU N N -1.253 3.452 -3.609 1.00 . A A . 30 LEU N 1 1 18 12762 1 1 26 LEU O O -4.258 3.286 -3.949 1.00 . A A . 30 LEU O 1 1 18 12763 1 1 27 ASN C C -6.482 5.239 -2.441 1.00 . A A . 31 ASN C 1 1 18 12764 1 1 27 ASN CA C -5.405 4.395 -1.760 1.00 . A A . 31 ASN CA 1 1 18 12765 1 1 27 ASN CB C -5.323 4.735 -0.272 1.00 . A A . 31 ASN CB 1 1 18 12766 1 1 27 ASN CG C -6.629 4.354 0.415 1.00 . A A . 31 ASN CG 1 1 18 12767 1 1 27 ASN H H -3.515 5.417 -1.858 1.00 . A A . 31 ASN H 1 1 18 12768 1 1 27 ASN HA H -5.608 3.344 -1.889 1.00 . A A . 31 ASN HA 1 1 18 12769 1 1 27 ASN HB2 H -4.514 4.183 0.182 1.00 . A A . 31 ASN HB2 1 1 18 12770 1 1 27 ASN HB3 H -5.148 5.794 -0.153 1.00 . A A . 31 ASN HB3 1 1 18 12771 1 1 27 ASN HD21 H -5.748 3.972 2.149 1.00 . A A . 31 ASN HD21 1 1 18 12772 1 1 27 ASN HD22 H -7.423 3.740 2.118 1.00 . A A . 31 ASN HD22 1 1 18 12773 1 1 27 ASN N N -4.063 4.740 -2.305 1.00 . A A . 31 ASN N 1 1 18 12774 1 1 27 ASN ND2 N -6.599 3.993 1.665 1.00 . A A . 31 ASN ND2 1 1 18 12775 1 1 27 ASN O O -6.575 6.434 -2.225 1.00 . A A . 31 ASN O 1 1 18 12776 1 1 27 ASN OD1 O -7.683 4.384 -0.190 1.00 . A A . 31 ASN OD1 1 1 18 12777 1 1 28 HIS C C -9.602 5.530 -3.048 1.00 . A A . 32 HIS C 1 1 18 12778 1 1 28 HIS CA C -8.374 5.377 -3.958 1.00 . A A . 32 HIS CA 1 1 18 12779 1 1 28 HIS CB C -8.720 4.530 -5.182 1.00 . A A . 32 HIS CB 1 1 18 12780 1 1 28 HIS CD2 C -6.840 4.832 -6.994 1.00 . A A . 32 HIS CD2 1 1 18 12781 1 1 28 HIS CE1 C -7.780 6.398 -8.163 1.00 . A A . 32 HIS CE1 1 1 18 12782 1 1 28 HIS CG C -8.046 5.106 -6.397 1.00 . A A . 32 HIS CG 1 1 18 12783 1 1 28 HIS H H -7.196 3.660 -3.411 1.00 . A A . 32 HIS H 1 1 18 12784 1 1 28 HIS HA H -8.015 6.345 -4.271 1.00 . A A . 32 HIS HA 1 1 18 12785 1 1 28 HIS HB2 H -8.377 3.518 -5.026 1.00 . A A . 32 HIS HB2 1 1 18 12786 1 1 28 HIS HB3 H -9.789 4.529 -5.330 1.00 . A A . 32 HIS HB3 1 1 18 12787 1 1 28 HIS HD1 H -9.497 6.527 -6.996 1.00 . A A . 32 HIS HD1 1 1 18 12788 1 1 28 HIS HD2 H -6.130 4.096 -6.651 1.00 . A A . 32 HIS HD2 1 1 18 12789 1 1 28 HIS HE1 H -7.969 7.144 -8.919 1.00 . A A . 32 HIS HE1 1 1 18 12790 1 1 28 HIS N N -7.296 4.624 -3.258 1.00 . A A . 32 HIS N 1 1 18 12791 1 1 28 HIS ND1 N -8.627 6.108 -7.160 1.00 . A A . 32 HIS ND1 1 1 18 12792 1 1 28 HIS NE2 N -6.674 5.649 -8.109 1.00 . A A . 32 HIS NE2 1 1 18 12793 1 1 28 HIS O O -10.556 6.199 -3.393 1.00 . A A . 32 HIS O 1 1 18 12794 1 1 29 ILE C C -10.526 6.303 -0.096 1.00 . A A . 33 ILE C 1 1 18 12795 1 1 29 ILE CA C -10.752 5.071 -0.958 1.00 . A A . 33 ILE CA 1 1 18 12796 1 1 29 ILE CB C -10.811 3.815 -0.054 1.00 . A A . 33 ILE CB 1 1 18 12797 1 1 29 ILE CD1 C -10.427 1.314 0.063 1.00 . A A . 33 ILE CD1 1 1 18 12798 1 1 29 ILE CG1 C -10.123 2.601 -0.715 1.00 . A A . 33 ILE CG1 1 1 18 12799 1 1 29 ILE CG2 C -12.285 3.488 0.220 1.00 . A A . 33 ILE CG2 1 1 18 12800 1 1 29 ILE H H -8.802 4.413 -1.613 1.00 . A A . 33 ILE H 1 1 18 12801 1 1 29 ILE HA H -11.668 5.169 -1.522 1.00 . A A . 33 ILE HA 1 1 18 12802 1 1 29 ILE HB H -10.322 4.037 0.886 1.00 . A A . 33 ILE HB 1 1 18 12803 1 1 29 ILE HD11 H -9.516 0.749 0.195 1.00 . A A . 33 ILE HD11 1 1 18 12804 1 1 29 ILE HD12 H -11.143 0.721 -0.488 1.00 . A A . 33 ILE HD12 1 1 18 12805 1 1 29 ILE HD13 H -10.838 1.567 1.029 1.00 . A A . 33 ILE HD13 1 1 18 12806 1 1 29 ILE HG12 H -10.473 2.503 -1.730 1.00 . A A . 33 ILE HG12 1 1 18 12807 1 1 29 ILE HG13 H -9.054 2.763 -0.718 1.00 . A A . 33 ILE HG13 1 1 18 12808 1 1 29 ILE HG21 H -12.394 3.144 1.238 1.00 . A A . 33 ILE HG21 1 1 18 12809 1 1 29 ILE HG22 H -12.613 2.714 -0.457 1.00 . A A . 33 ILE HG22 1 1 18 12810 1 1 29 ILE HG23 H -12.883 4.374 0.073 1.00 . A A . 33 ILE HG23 1 1 18 12811 1 1 29 ILE N N -9.582 4.933 -1.884 1.00 . A A . 33 ILE N 1 1 18 12812 1 1 29 ILE O O -11.253 7.274 -0.163 1.00 . A A . 33 ILE O 1 1 18 12813 1 1 30 ASP C C -8.298 8.436 0.800 1.00 . A A . 34 ASP C 1 1 18 12814 1 1 30 ASP CA C -9.185 7.440 1.564 1.00 . A A . 34 ASP CA 1 1 18 12815 1 1 30 ASP CB C -8.432 6.860 2.762 1.00 . A A . 34 ASP CB 1 1 18 12816 1 1 30 ASP CG C -9.354 6.840 3.982 1.00 . A A . 34 ASP CG 1 1 18 12817 1 1 30 ASP H H -8.922 5.472 0.716 1.00 . A A . 34 ASP H 1 1 18 12818 1 1 30 ASP HA H -10.092 7.919 1.895 1.00 . A A . 34 ASP HA 1 1 18 12819 1 1 30 ASP HB2 H -8.114 5.854 2.534 1.00 . A A . 34 ASP HB2 1 1 18 12820 1 1 30 ASP HB3 H -7.566 7.470 2.974 1.00 . A A . 34 ASP HB3 1 1 18 12821 1 1 30 ASP N N -9.498 6.268 0.701 1.00 . A A . 34 ASP N 1 1 18 12822 1 1 30 ASP O O -7.800 9.390 1.361 1.00 . A A . 34 ASP O 1 1 18 12823 1 1 30 ASP OD1 O -9.809 7.900 4.374 1.00 . A A . 34 ASP OD1 1 1 18 12824 1 1 30 ASP OD2 O -9.587 5.762 4.506 1.00 . A A . 34 ASP OD2 1 1 18 12825 1 1 31 GLN C C -5.906 9.383 -0.569 1.00 . A A . 35 GLN C 1 1 18 12826 1 1 31 GLN CA C -7.243 9.150 -1.273 1.00 . A A . 35 GLN CA 1 1 18 12827 1 1 31 GLN CB C -8.041 10.452 -1.351 1.00 . A A . 35 GLN CB 1 1 18 12828 1 1 31 GLN CD C -9.638 11.039 -3.181 1.00 . A A . 35 GLN CD 1 1 18 12829 1 1 31 GLN CG C -9.424 10.168 -1.942 1.00 . A A . 35 GLN CG 1 1 18 12830 1 1 31 GLN H H -8.504 7.445 -0.917 1.00 . A A . 35 GLN H 1 1 18 12831 1 1 31 GLN HA H -7.083 8.758 -2.265 1.00 . A A . 35 GLN HA 1 1 18 12832 1 1 31 GLN HB2 H -8.150 10.867 -0.361 1.00 . A A . 35 GLN HB2 1 1 18 12833 1 1 31 GLN HB3 H -7.519 11.157 -1.981 1.00 . A A . 35 GLN HB3 1 1 18 12834 1 1 31 GLN HE21 H -11.187 12.011 -2.408 1.00 . A A . 35 GLN HE21 1 1 18 12835 1 1 31 GLN HE22 H -10.750 12.479 -3.979 1.00 . A A . 35 GLN HE22 1 1 18 12836 1 1 31 GLN HG2 H -9.491 9.127 -2.217 1.00 . A A . 35 GLN HG2 1 1 18 12837 1 1 31 GLN HG3 H -10.183 10.397 -1.208 1.00 . A A . 35 GLN HG3 1 1 18 12838 1 1 31 GLN N N -8.096 8.219 -0.477 1.00 . A A . 35 GLN N 1 1 18 12839 1 1 31 GLN NE2 N -10.606 11.915 -3.190 1.00 . A A . 35 GLN NE2 1 1 18 12840 1 1 31 GLN O O -5.683 10.420 0.028 1.00 . A A . 35 GLN O 1 1 18 12841 1 1 31 GLN OE1 O -8.917 10.921 -4.153 1.00 . A A . 35 GLN OE1 1 1 18 12842 1 1 32 THR C C -2.635 7.693 -0.557 1.00 . A A . 36 THR C 1 1 18 12843 1 1 32 THR CA C -3.689 8.624 0.046 1.00 . A A . 36 THR CA 1 1 18 12844 1 1 32 THR CB C -3.919 8.276 1.523 1.00 . A A . 36 THR CB 1 1 18 12845 1 1 32 THR CG2 C -3.138 9.253 2.402 1.00 . A A . 36 THR CG2 1 1 18 12846 1 1 32 THR H H -5.207 7.602 -1.118 1.00 . A A . 36 THR H 1 1 18 12847 1 1 32 THR HA H -3.373 9.651 -0.040 1.00 . A A . 36 THR HA 1 1 18 12848 1 1 32 THR HB H -3.566 7.274 1.711 1.00 . A A . 36 THR HB 1 1 18 12849 1 1 32 THR HG1 H -5.554 7.555 2.295 1.00 . A A . 36 THR HG1 1 1 18 12850 1 1 32 THR HG21 H -2.910 10.143 1.836 1.00 . A A . 36 THR HG21 1 1 18 12851 1 1 32 THR HG22 H -2.219 8.788 2.728 1.00 . A A . 36 THR HG22 1 1 18 12852 1 1 32 THR HG23 H -3.734 9.516 3.263 1.00 . A A . 36 THR HG23 1 1 18 12853 1 1 32 THR N N -5.011 8.434 -0.630 1.00 . A A . 36 THR N 1 1 18 12854 1 1 32 THR O O -2.916 6.901 -1.433 1.00 . A A . 36 THR O 1 1 18 12855 1 1 32 THR OG1 O -5.304 8.360 1.836 1.00 . A A . 36 THR OG1 1 1 18 12856 1 1 33 THR C C 0.524 6.365 0.517 1.00 . A A . 37 THR C 1 1 18 12857 1 1 33 THR CA C -0.335 6.906 -0.624 1.00 . A A . 37 THR CA 1 1 18 12858 1 1 33 THR CB C 0.524 7.801 -1.523 1.00 . A A . 37 THR CB 1 1 18 12859 1 1 33 THR CG2 C -0.355 8.531 -2.535 1.00 . A A . 37 THR CG2 1 1 18 12860 1 1 33 THR H H -1.217 8.430 0.623 1.00 . A A . 37 THR H 1 1 18 12861 1 1 33 THR HA H -0.755 6.098 -1.200 1.00 . A A . 37 THR HA 1 1 18 12862 1 1 33 THR HB H 1.242 7.188 -2.053 1.00 . A A . 37 THR HB 1 1 18 12863 1 1 33 THR HG1 H 1.482 9.480 -1.277 1.00 . A A . 37 THR HG1 1 1 18 12864 1 1 33 THR HG21 H -1.333 8.077 -2.556 1.00 . A A . 37 THR HG21 1 1 18 12865 1 1 33 THR HG22 H 0.094 8.462 -3.516 1.00 . A A . 37 THR HG22 1 1 18 12866 1 1 33 THR HG23 H -0.445 9.569 -2.253 1.00 . A A . 37 THR HG23 1 1 18 12867 1 1 33 THR N N -1.418 7.785 -0.086 1.00 . A A . 37 THR N 1 1 18 12868 1 1 33 THR O O 1.246 7.099 1.162 1.00 . A A . 37 THR O 1 1 18 12869 1 1 33 THR OG1 O 1.214 8.748 -0.718 1.00 . A A . 37 THR OG1 1 1 18 12870 1 1 34 THR C C 2.359 3.573 1.229 1.00 . A A . 38 THR C 1 1 18 12871 1 1 34 THR CA C 1.323 4.513 1.845 1.00 . A A . 38 THR CA 1 1 18 12872 1 1 34 THR CB C 0.359 3.757 2.771 1.00 . A A . 38 THR CB 1 1 18 12873 1 1 34 THR CG2 C -0.214 2.534 2.050 1.00 . A A . 38 THR CG2 1 1 18 12874 1 1 34 THR H H -0.098 4.502 0.215 1.00 . A A . 38 THR H 1 1 18 12875 1 1 34 THR HA H 1.814 5.304 2.392 1.00 . A A . 38 THR HA 1 1 18 12876 1 1 34 THR HB H -0.451 4.410 3.056 1.00 . A A . 38 THR HB 1 1 18 12877 1 1 34 THR HG1 H 1.334 4.119 4.413 1.00 . A A . 38 THR HG1 1 1 18 12878 1 1 34 THR HG21 H -0.547 2.824 1.068 1.00 . A A . 38 THR HG21 1 1 18 12879 1 1 34 THR HG22 H -1.047 2.141 2.613 1.00 . A A . 38 THR HG22 1 1 18 12880 1 1 34 THR HG23 H 0.551 1.777 1.962 1.00 . A A . 38 THR HG23 1 1 18 12881 1 1 34 THR N N 0.477 5.087 0.759 1.00 . A A . 38 THR N 1 1 18 12882 1 1 34 THR O O 2.050 2.801 0.346 1.00 . A A . 38 THR O 1 1 18 12883 1 1 34 THR OG1 O 1.058 3.335 3.932 1.00 . A A . 38 THR OG1 1 1 18 12884 1 1 35 TRP C C 4.301 1.280 1.428 1.00 . A A . 39 TRP C 1 1 18 12885 1 1 35 TRP CA C 4.621 2.737 1.085 1.00 . A A . 39 TRP CA 1 1 18 12886 1 1 35 TRP CB C 5.958 3.148 1.722 1.00 . A A . 39 TRP CB 1 1 18 12887 1 1 35 TRP CD1 C 5.842 5.511 2.628 1.00 . A A . 39 TRP CD1 1 1 18 12888 1 1 35 TRP CD2 C 6.759 5.432 0.571 1.00 . A A . 39 TRP CD2 1 1 18 12889 1 1 35 TRP CE2 C 6.756 6.791 0.969 1.00 . A A . 39 TRP CE2 1 1 18 12890 1 1 35 TRP CE3 C 7.292 5.118 -0.696 1.00 . A A . 39 TRP CE3 1 1 18 12891 1 1 35 TRP CG C 6.164 4.635 1.645 1.00 . A A . 39 TRP CG 1 1 18 12892 1 1 35 TRP CH2 C 7.789 7.467 -1.100 1.00 . A A . 39 TRP CH2 1 1 18 12893 1 1 35 TRP CZ2 C 7.262 7.796 0.149 1.00 . A A . 39 TRP CZ2 1 1 18 12894 1 1 35 TRP CZ3 C 7.802 6.131 -1.522 1.00 . A A . 39 TRP CZ3 1 1 18 12895 1 1 35 TRP H H 3.816 4.264 2.380 1.00 . A A . 39 TRP H 1 1 18 12896 1 1 35 TRP HA H 4.666 2.866 0.015 1.00 . A A . 39 TRP HA 1 1 18 12897 1 1 35 TRP HB2 H 5.963 2.845 2.758 1.00 . A A . 39 TRP HB2 1 1 18 12898 1 1 35 TRP HB3 H 6.764 2.652 1.204 1.00 . A A . 39 TRP HB3 1 1 18 12899 1 1 35 TRP HD1 H 5.382 5.255 3.570 1.00 . A A . 39 TRP HD1 1 1 18 12900 1 1 35 TRP HE1 H 6.055 7.603 2.749 1.00 . A A . 39 TRP HE1 1 1 18 12901 1 1 35 TRP HE3 H 7.304 4.097 -1.041 1.00 . A A . 39 TRP HE3 1 1 18 12902 1 1 35 TRP HH2 H 8.184 8.240 -1.743 1.00 . A A . 39 TRP HH2 1 1 18 12903 1 1 35 TRP HZ2 H 7.247 8.824 0.480 1.00 . A A . 39 TRP HZ2 1 1 18 12904 1 1 35 TRP HZ3 H 8.213 5.877 -2.488 1.00 . A A . 39 TRP HZ3 1 1 18 12905 1 1 35 TRP N N 3.583 3.633 1.673 1.00 . A A . 39 TRP N 1 1 18 12906 1 1 35 TRP NE1 N 6.187 6.787 2.223 1.00 . A A . 39 TRP NE1 1 1 18 12907 1 1 35 TRP O O 4.512 0.385 0.634 1.00 . A A . 39 TRP O 1 1 18 12908 1 1 36 GLN C C 2.633 -0.367 4.287 1.00 . A A . 40 GLN C 1 1 18 12909 1 1 36 GLN CA C 3.459 -0.362 2.998 1.00 . A A . 40 GLN CA 1 1 18 12910 1 1 36 GLN CB C 4.810 -1.044 3.224 1.00 . A A . 40 GLN CB 1 1 18 12911 1 1 36 GLN CD C 5.739 -3.212 2.400 1.00 . A A . 40 GLN CD 1 1 18 12912 1 1 36 GLN CG C 4.622 -2.562 3.219 1.00 . A A . 40 GLN CG 1 1 18 12913 1 1 36 GLN H H 3.631 1.774 3.230 1.00 . A A . 40 GLN H 1 1 18 12914 1 1 36 GLN HA H 2.924 -0.859 2.205 1.00 . A A . 40 GLN HA 1 1 18 12915 1 1 36 GLN HB2 H 5.491 -0.762 2.435 1.00 . A A . 40 GLN HB2 1 1 18 12916 1 1 36 GLN HB3 H 5.214 -0.734 4.176 1.00 . A A . 40 GLN HB3 1 1 18 12917 1 1 36 GLN HE21 H 7.187 -2.216 3.323 1.00 . A A . 40 GLN HE21 1 1 18 12918 1 1 36 GLN HE22 H 7.702 -3.289 2.113 1.00 . A A . 40 GLN HE22 1 1 18 12919 1 1 36 GLN HG2 H 4.655 -2.932 4.233 1.00 . A A . 40 GLN HG2 1 1 18 12920 1 1 36 GLN HG3 H 3.665 -2.805 2.779 1.00 . A A . 40 GLN HG3 1 1 18 12921 1 1 36 GLN N N 3.794 1.036 2.605 1.00 . A A . 40 GLN N 1 1 18 12922 1 1 36 GLN NE2 N 6.979 -2.877 2.632 1.00 . A A . 40 GLN NE2 1 1 18 12923 1 1 36 GLN O O 2.693 -1.292 5.071 1.00 . A A . 40 GLN O 1 1 18 12924 1 1 36 GLN OE1 O 5.481 -4.031 1.542 1.00 . A A . 40 GLN OE1 1 1 18 12925 1 1 37 ASP C C -0.438 0.965 5.392 1.00 . A A . 41 ASP C 1 1 18 12926 1 1 37 ASP CA C 1.033 0.717 5.750 1.00 . A A . 41 ASP CA 1 1 18 12927 1 1 37 ASP CB C 1.594 1.891 6.552 1.00 . A A . 41 ASP CB 1 1 18 12928 1 1 37 ASP CG C 2.769 1.410 7.406 1.00 . A A . 41 ASP CG 1 1 18 12929 1 1 37 ASP H H 1.828 1.399 3.866 1.00 . A A . 41 ASP H 1 1 18 12930 1 1 37 ASP HA H 1.136 -0.197 6.313 1.00 . A A . 41 ASP HA 1 1 18 12931 1 1 37 ASP HB2 H 1.934 2.659 5.874 1.00 . A A . 41 ASP HB2 1 1 18 12932 1 1 37 ASP HB3 H 0.822 2.290 7.193 1.00 . A A . 41 ASP HB3 1 1 18 12933 1 1 37 ASP N N 1.862 0.663 4.511 1.00 . A A . 41 ASP N 1 1 18 12934 1 1 37 ASP O O -1.055 1.871 5.916 1.00 . A A . 41 ASP O 1 1 18 12935 1 1 37 ASP OD1 O 2.828 0.222 7.683 1.00 . A A . 41 ASP OD1 1 1 18 12936 1 1 37 ASP OD2 O 3.590 2.237 7.768 1.00 . A A . 41 ASP OD2 1 1 18 12937 1 1 38 PRO C C -3.313 -0.155 5.204 1.00 . A A . 42 PRO C 1 1 18 12938 1 1 38 PRO CA C -2.372 0.295 4.082 1.00 . A A . 42 PRO CA 1 1 18 12939 1 1 38 PRO CB C -2.485 -0.631 2.874 1.00 . A A . 42 PRO CB 1 1 18 12940 1 1 38 PRO CD C -0.290 -0.970 3.820 1.00 . A A . 42 PRO CD 1 1 18 12941 1 1 38 PRO CG C -1.403 -1.648 3.063 1.00 . A A . 42 PRO CG 1 1 18 12942 1 1 38 PRO HA H -2.581 1.311 3.790 1.00 . A A . 42 PRO HA 1 1 18 12943 1 1 38 PRO HB2 H -3.452 -1.110 2.858 1.00 . A A . 42 PRO HB2 1 1 18 12944 1 1 38 PRO HB3 H -2.324 -0.079 1.962 1.00 . A A . 42 PRO HB3 1 1 18 12945 1 1 38 PRO HD2 H 0.147 -1.647 4.540 1.00 . A A . 42 PRO HD2 1 1 18 12946 1 1 38 PRO HD3 H 0.462 -0.602 3.139 1.00 . A A . 42 PRO HD3 1 1 18 12947 1 1 38 PRO HG2 H -1.780 -2.484 3.634 1.00 . A A . 42 PRO HG2 1 1 18 12948 1 1 38 PRO HG3 H -1.043 -1.987 2.104 1.00 . A A . 42 PRO HG3 1 1 18 12949 1 1 38 PRO N N -0.957 0.149 4.504 1.00 . A A . 42 PRO N 1 1 18 12950 1 1 38 PRO O O -4.212 0.562 5.597 1.00 . A A . 42 PRO O 1 1 18 12951 1 1 39 ARG C C -3.368 -3.056 7.487 1.00 . A A . 43 ARG C 1 1 18 12952 1 1 39 ARG CA C -3.993 -1.829 6.819 1.00 . A A . 43 ARG CA 1 1 18 12953 1 1 39 ARG CB C -5.306 -2.204 6.132 1.00 . A A . 43 ARG CB 1 1 18 12954 1 1 39 ARG CD C -7.707 -2.506 6.751 1.00 . A A . 43 ARG CD 1 1 18 12955 1 1 39 ARG CG C -6.479 -1.608 6.913 1.00 . A A . 43 ARG CG 1 1 18 12956 1 1 39 ARG CZ C -10.039 -2.009 6.215 1.00 . A A . 43 ARG CZ 1 1 18 12957 1 1 39 ARG H H -2.379 -1.898 5.392 1.00 . A A . 43 ARG H 1 1 18 12958 1 1 39 ARG HA H -4.166 -1.050 7.543 1.00 . A A . 43 ARG HA 1 1 18 12959 1 1 39 ARG HB2 H -5.311 -1.814 5.124 1.00 . A A . 43 ARG HB2 1 1 18 12960 1 1 39 ARG HB3 H -5.403 -3.279 6.102 1.00 . A A . 43 ARG HB3 1 1 18 12961 1 1 39 ARG HD2 H -7.586 -3.160 5.901 1.00 . A A . 43 ARG HD2 1 1 18 12962 1 1 39 ARG HD3 H -7.874 -3.082 7.650 1.00 . A A . 43 ARG HD3 1 1 18 12963 1 1 39 ARG HE H -8.693 -0.598 6.602 1.00 . A A . 43 ARG HE 1 1 18 12964 1 1 39 ARG HG2 H -6.218 -1.540 7.958 1.00 . A A . 43 ARG HG2 1 1 18 12965 1 1 39 ARG HG3 H -6.701 -0.622 6.532 1.00 . A A . 43 ARG HG3 1 1 18 12966 1 1 39 ARG HH11 H -9.539 -3.956 6.247 1.00 . A A . 43 ARG HH11 1 1 18 12967 1 1 39 ARG HH12 H -11.189 -3.614 5.866 1.00 . A A . 43 ARG HH12 1 1 18 12968 1 1 39 ARG HH21 H -10.842 -0.179 6.104 1.00 . A A . 43 ARG HH21 1 1 18 12969 1 1 39 ARG HH22 H -11.925 -1.492 5.787 1.00 . A A . 43 ARG HH22 1 1 18 12970 1 1 39 ARG N N -3.111 -1.334 5.722 1.00 . A A . 43 ARG N 1 1 18 12971 1 1 39 ARG NE N -8.842 -1.563 6.522 1.00 . A A . 43 ARG NE 1 1 18 12972 1 1 39 ARG NH1 N -10.272 -3.294 6.100 1.00 . A A . 43 ARG NH1 1 1 18 12973 1 1 39 ARG NH2 N -11.010 -1.160 6.019 1.00 . A A . 43 ARG NH2 1 1 18 12974 1 1 39 ARG O O -4.058 -3.911 8.007 1.00 . A A . 43 ARG O 1 1 18 12975 1 1 40 LYS C C 0.099 -4.051 8.284 1.00 . A A . 44 LYS C 1 1 18 12976 1 1 40 LYS CA C -1.399 -4.322 8.115 1.00 . A A . 44 LYS CA 1 1 18 12977 1 1 40 LYS CB C -1.628 -5.481 7.144 1.00 . A A . 44 LYS CB 1 1 18 12978 1 1 40 LYS CD C 0.273 -7.068 7.476 1.00 . A A . 44 LYS CD 1 1 18 12979 1 1 40 LYS CE C 0.528 -8.577 7.509 1.00 . A A . 44 LYS CE 1 1 18 12980 1 1 40 LYS CG C -1.195 -6.792 7.804 1.00 . A A . 44 LYS CG 1 1 18 12981 1 1 40 LYS H H -1.526 -2.450 7.054 1.00 . A A . 44 LYS H 1 1 18 12982 1 1 40 LYS HA H -1.853 -4.543 9.067 1.00 . A A . 44 LYS HA 1 1 18 12983 1 1 40 LYS HB2 H -2.677 -5.536 6.889 1.00 . A A . 44 LYS HB2 1 1 18 12984 1 1 40 LYS HB3 H -1.047 -5.321 6.248 1.00 . A A . 44 LYS HB3 1 1 18 12985 1 1 40 LYS HD2 H 0.499 -6.687 6.490 1.00 . A A . 44 LYS HD2 1 1 18 12986 1 1 40 LYS HD3 H 0.904 -6.581 8.203 1.00 . A A . 44 LYS HD3 1 1 18 12987 1 1 40 LYS HE2 H -0.179 -9.091 6.877 1.00 . A A . 44 LYS HE2 1 1 18 12988 1 1 40 LYS HE3 H 1.540 -8.794 7.198 1.00 . A A . 44 LYS HE3 1 1 18 12989 1 1 40 LYS HG2 H -1.315 -6.713 8.875 1.00 . A A . 44 LYS HG2 1 1 18 12990 1 1 40 LYS HG3 H -1.806 -7.601 7.433 1.00 . A A . 44 LYS HG3 1 1 18 12991 1 1 40 LYS HZ1 H 0.740 -9.906 9.097 1.00 . A A . 44 LYS HZ1 1 1 18 12992 1 1 40 LYS HZ2 H -0.689 -8.988 9.147 1.00 . A A . 44 LYS HZ2 1 1 18 12993 1 1 40 LYS HZ3 H 0.797 -8.272 9.550 1.00 . A A . 44 LYS HZ3 1 1 18 12994 1 1 40 LYS N N -2.066 -3.149 7.479 1.00 . A A . 44 LYS N 1 1 18 12995 1 1 40 LYS NZ N 0.330 -8.965 8.934 1.00 . A A . 44 LYS NZ 1 1 18 12996 1 1 40 LYS O O 0.583 -4.190 9.395 1.00 . A A . 44 LYS O 1 1 18 12997 1 1 40 LYS OXT O 0.733 -3.709 7.301 1.00 . A A . 44 LYS OXT 1 1 18 12998 2 2 1 ACE C C 7.826 13.210 3.857 1.00 . B B . 45 ACE C 1 1 18 12999 2 2 1 ACE CH3 C 6.855 13.788 4.888 1.00 . B B . 45 ACE CH3 1 1 18 13000 2 2 1 ACE H1 H 6.977 13.271 5.827 1.00 . B B . 45 ACE H1 1 1 18 13001 2 2 1 ACE H2 H 5.840 13.661 4.537 1.00 . B B . 45 ACE H2 1 1 18 13002 2 2 1 ACE H3 H 7.058 14.839 5.026 1.00 . B B . 45 ACE H3 1 1 18 13003 2 2 1 ACE O O 8.298 13.914 2.986 1.00 . B B . 45 ACE O 1 1 18 13004 2 2 2 PRO C C 7.111 10.418 2.314 1.00 . B B . 46 PRO C 1 1 18 13005 2 2 2 PRO CA C 8.384 11.123 2.791 1.00 . B B . 46 PRO CA 1 1 18 13006 2 2 2 PRO CB C 9.418 10.107 3.271 1.00 . B B . 46 PRO CB 1 1 18 13007 2 2 2 PRO CD C 8.678 11.335 5.206 1.00 . B B . 46 PRO CD 1 1 18 13008 2 2 2 PRO CG C 9.194 9.998 4.742 1.00 . B B . 46 PRO CG 1 1 18 13009 2 2 2 PRO HA H 8.801 11.733 2.007 1.00 . B B . 46 PRO HA 1 1 18 13010 2 2 2 PRO HB2 H 9.254 9.153 2.791 1.00 . B B . 46 PRO HB2 1 1 18 13011 2 2 2 PRO HB3 H 10.416 10.464 3.073 1.00 . B B . 46 PRO HB3 1 1 18 13012 2 2 2 PRO HD2 H 7.920 11.201 5.966 1.00 . B B . 46 PRO HD2 1 1 18 13013 2 2 2 PRO HD3 H 9.486 11.944 5.578 1.00 . B B . 46 PRO HD3 1 1 18 13014 2 2 2 PRO HG2 H 8.467 9.226 4.947 1.00 . B B . 46 PRO HG2 1 1 18 13015 2 2 2 PRO HG3 H 10.124 9.776 5.241 1.00 . B B . 46 PRO HG3 1 1 18 13016 2 2 2 PRO N N 8.100 11.942 3.999 1.00 . B B . 46 PRO N 1 1 18 13017 2 2 2 PRO O O 6.817 9.309 2.710 1.00 . B B . 46 PRO O 1 1 18 13018 2 2 3 LEU C C 4.455 11.315 -0.114 1.00 . B B . 47 LEU C 1 1 18 13019 2 2 3 LEU CA C 5.100 10.424 0.959 1.00 . B B . 47 LEU CA 1 1 18 13020 2 2 3 LEU CB C 4.192 10.324 2.186 1.00 . B B . 47 LEU CB 1 1 18 13021 2 2 3 LEU CD1 C 2.450 8.698 2.936 1.00 . B B . 47 LEU CD1 1 1 18 13022 2 2 3 LEU CD2 C 1.800 10.683 1.563 1.00 . B B . 47 LEU CD2 1 1 18 13023 2 2 3 LEU CG C 2.884 9.630 1.803 1.00 . B B . 47 LEU CG 1 1 18 13024 2 2 3 LEU H H 6.608 11.952 1.155 1.00 . B B . 47 LEU H 1 1 18 13025 2 2 3 LEU HA H 5.305 9.441 0.571 1.00 . B B . 47 LEU HA 1 1 18 13026 2 2 3 LEU HB2 H 4.690 9.753 2.956 1.00 . B B . 47 LEU HB2 1 1 18 13027 2 2 3 LEU HB3 H 3.977 11.316 2.557 1.00 . B B . 47 LEU HB3 1 1 18 13028 2 2 3 LEU HD11 H 2.779 7.692 2.722 1.00 . B B . 47 LEU HD11 1 1 18 13029 2 2 3 LEU HD12 H 1.374 8.716 3.024 1.00 . B B . 47 LEU HD12 1 1 18 13030 2 2 3 LEU HD13 H 2.891 9.032 3.864 1.00 . B B . 47 LEU HD13 1 1 18 13031 2 2 3 LEU HD21 H 1.222 10.814 2.464 1.00 . B B . 47 LEU HD21 1 1 18 13032 2 2 3 LEU HD22 H 1.152 10.355 0.764 1.00 . B B . 47 LEU HD22 1 1 18 13033 2 2 3 LEU HD23 H 2.263 11.619 1.291 1.00 . B B . 47 LEU HD23 1 1 18 13034 2 2 3 LEU HG H 3.033 9.055 0.901 1.00 . B B . 47 LEU HG 1 1 18 13035 2 2 3 LEU N N 6.354 11.057 1.462 1.00 . B B . 47 LEU N 1 1 18 13036 2 2 3 LEU O O 4.288 12.500 0.096 1.00 . B B . 47 LEU O 1 1 18 13037 2 2 4 PRO C C 2.037 11.871 -1.962 1.00 . B B . 48 PRO C 1 1 18 13038 2 2 4 PRO CA C 3.481 11.499 -2.332 1.00 . B B . 48 PRO CA 1 1 18 13039 2 2 4 PRO CB C 3.508 10.539 -3.518 1.00 . B B . 48 PRO CB 1 1 18 13040 2 2 4 PRO CD C 4.269 9.303 -1.588 1.00 . B B . 48 PRO CD 1 1 18 13041 2 2 4 PRO CG C 3.554 9.174 -2.908 1.00 . B B . 48 PRO CG 1 1 18 13042 2 2 4 PRO HA H 4.059 12.381 -2.555 1.00 . B B . 48 PRO HA 1 1 18 13043 2 2 4 PRO HB2 H 2.617 10.655 -4.115 1.00 . B B . 48 PRO HB2 1 1 18 13044 2 2 4 PRO HB3 H 4.389 10.711 -4.118 1.00 . B B . 48 PRO HB3 1 1 18 13045 2 2 4 PRO HD2 H 3.805 8.673 -0.843 1.00 . B B . 48 PRO HD2 1 1 18 13046 2 2 4 PRO HD3 H 5.315 9.055 -1.700 1.00 . B B . 48 PRO HD3 1 1 18 13047 2 2 4 PRO HG2 H 2.550 8.809 -2.749 1.00 . B B . 48 PRO HG2 1 1 18 13048 2 2 4 PRO HG3 H 4.092 8.499 -3.555 1.00 . B B . 48 PRO HG3 1 1 18 13049 2 2 4 PRO N N 4.111 10.723 -1.235 1.00 . B B . 48 PRO N 1 1 18 13050 2 2 4 PRO O O 1.345 11.095 -1.333 1.00 . B B . 48 PRO O 1 1 18 13051 2 2 5 PRO C C -0.768 12.761 -2.930 1.00 . B B . 49 PRO C 1 1 18 13052 2 2 5 PRO CA C 0.249 13.512 -2.064 1.00 . B B . 49 PRO CA 1 1 18 13053 2 2 5 PRO CB C 0.279 14.993 -2.425 1.00 . B B . 49 PRO CB 1 1 18 13054 2 2 5 PRO CD C 2.388 14.051 -3.130 1.00 . B B . 49 PRO CD 1 1 18 13055 2 2 5 PRO CG C 1.377 15.125 -3.432 1.00 . B B . 49 PRO CG 1 1 18 13056 2 2 5 PRO HA H 0.026 13.388 -1.019 1.00 . B B . 49 PRO HA 1 1 18 13057 2 2 5 PRO HB2 H -0.665 15.294 -2.856 1.00 . B B . 49 PRO HB2 1 1 18 13058 2 2 5 PRO HB3 H 0.499 15.588 -1.551 1.00 . B B . 49 PRO HB3 1 1 18 13059 2 2 5 PRO HD2 H 2.768 13.621 -4.045 1.00 . B B . 49 PRO HD2 1 1 18 13060 2 2 5 PRO HD3 H 3.195 14.448 -2.532 1.00 . B B . 49 PRO HD3 1 1 18 13061 2 2 5 PRO HG2 H 0.982 14.990 -4.428 1.00 . B B . 49 PRO HG2 1 1 18 13062 2 2 5 PRO HG3 H 1.838 16.099 -3.348 1.00 . B B . 49 PRO HG3 1 1 18 13063 2 2 5 PRO N N 1.627 13.050 -2.367 1.00 . B B . 49 PRO N 1 1 18 13064 2 2 5 PRO O O -0.449 11.774 -3.563 1.00 . B B . 49 PRO O 1 1 18 13065 2 2 6 TYR C C -4.284 13.399 -3.881 1.00 . B B . 50 TYR C 1 1 18 13066 2 2 6 TYR CA C -3.023 12.535 -3.787 1.00 . B B . 50 TYR CA 1 1 18 13067 2 2 6 TYR CB C -3.321 11.232 -3.046 1.00 . B B . 50 TYR CB 1 1 18 13068 2 2 6 TYR CD1 C -3.402 9.719 -5.060 1.00 . B B . 50 TYR CD1 1 1 18 13069 2 2 6 TYR CD2 C -5.403 9.981 -3.717 1.00 . B B . 50 TYR CD2 1 1 18 13070 2 2 6 TYR CE1 C -4.088 8.845 -5.912 1.00 . B B . 50 TYR CE1 1 1 18 13071 2 2 6 TYR CE2 C -6.090 9.106 -4.568 1.00 . B B . 50 TYR CE2 1 1 18 13072 2 2 6 TYR CG C -4.060 10.287 -3.963 1.00 . B B . 50 TYR CG 1 1 18 13073 2 2 6 TYR CZ C -5.433 8.538 -5.665 1.00 . B B . 50 TYR CZ 1 1 18 13074 2 2 6 TYR H H -2.224 14.020 -2.445 1.00 . B B . 50 TYR H 1 1 18 13075 2 2 6 TYR HA H -2.639 12.320 -4.771 1.00 . B B . 50 TYR HA 1 1 18 13076 2 2 6 TYR HB2 H -2.392 10.776 -2.733 1.00 . B B . 50 TYR HB2 1 1 18 13077 2 2 6 TYR HB3 H -3.930 11.441 -2.179 1.00 . B B . 50 TYR HB3 1 1 18 13078 2 2 6 TYR HD1 H -2.366 9.955 -5.251 1.00 . B B . 50 TYR HD1 1 1 18 13079 2 2 6 TYR HD2 H -5.911 10.419 -2.871 1.00 . B B . 50 TYR HD2 1 1 18 13080 2 2 6 TYR HE1 H -3.580 8.406 -6.758 1.00 . B B . 50 TYR HE1 1 1 18 13081 2 2 6 TYR HE2 H -7.126 8.869 -4.377 1.00 . B B . 50 TYR HE2 1 1 18 13082 2 2 6 TYR HH H -6.551 7.021 -5.961 1.00 . B B . 50 TYR HH 1 1 18 13083 2 2 6 TYR N N -1.988 13.222 -2.962 1.00 . B B . 50 TYR N 1 1 18 13084 2 2 6 TYR O O -4.495 13.993 -4.925 1.00 . B B . 50 TYR O 1 1 18 13085 2 2 6 TYR OXT O -5.016 13.451 -2.907 1.00 . B B . 50 TYR OXT 1 1 18 13086 2 2 6 TYR OH O -6.108 7.676 -6.504 1.00 . B B . 50 TYR OH 1 1 19 13087 1 1 1 PHE C C 7.668 -13.064 13.196 1.00 . A A . 5 PHE C 1 1 19 13088 1 1 1 PHE CA C 7.765 -12.284 14.509 1.00 . A A . 5 PHE CA 1 1 19 13089 1 1 1 PHE CB C 9.225 -12.137 14.940 1.00 . A A . 5 PHE CB 1 1 19 13090 1 1 1 PHE CD1 C 9.157 -9.785 15.843 1.00 . A A . 5 PHE CD1 1 1 19 13091 1 1 1 PHE CD2 C 10.466 -10.233 13.851 1.00 . A A . 5 PHE CD2 1 1 19 13092 1 1 1 PHE CE1 C 9.528 -8.436 15.783 1.00 . A A . 5 PHE CE1 1 1 19 13093 1 1 1 PHE CE2 C 10.836 -8.884 13.792 1.00 . A A . 5 PHE CE2 1 1 19 13094 1 1 1 PHE CG C 9.626 -10.683 14.877 1.00 . A A . 5 PHE CG 1 1 19 13095 1 1 1 PHE CZ C 10.368 -7.986 14.759 1.00 . A A . 5 PHE CZ 1 1 19 13096 1 1 1 PHE HA H 7.312 -11.311 14.406 1.00 . A A . 5 PHE HA 1 1 19 13097 1 1 1 PHE HB2 H 9.340 -12.499 15.951 1.00 . A A . 5 PHE HB2 1 1 19 13098 1 1 1 PHE HB3 H 9.855 -12.713 14.277 1.00 . A A . 5 PHE HB3 1 1 19 13099 1 1 1 PHE HD1 H 8.509 -10.132 16.633 1.00 . A A . 5 PHE HD1 1 1 19 13100 1 1 1 PHE HD2 H 10.827 -10.925 13.106 1.00 . A A . 5 PHE HD2 1 1 19 13101 1 1 1 PHE HE1 H 9.167 -7.743 16.530 1.00 . A A . 5 PHE HE1 1 1 19 13102 1 1 1 PHE HE2 H 11.486 -8.536 13.002 1.00 . A A . 5 PHE HE2 1 1 19 13103 1 1 1 PHE HZ H 10.655 -6.946 14.714 1.00 . A A . 5 PHE HZ 1 1 19 13104 1 1 1 PHE N N 7.113 -13.047 15.612 1.00 . A A . 5 PHE N 1 1 19 13105 1 1 1 PHE O O 6.946 -14.035 13.091 1.00 . A A . 5 PHE O 1 1 19 13106 1 1 2 GLU C C 6.889 -13.497 10.411 1.00 . A A . 6 GLU C 1 1 19 13107 1 1 2 GLU CA C 8.338 -13.363 10.885 1.00 . A A . 6 GLU CA 1 1 19 13108 1 1 2 GLU CB C 8.939 -14.740 11.166 1.00 . A A . 6 GLU CB 1 1 19 13109 1 1 2 GLU CD C 9.727 -16.774 9.946 1.00 . A A . 6 GLU CD 1 1 19 13110 1 1 2 GLU CG C 9.665 -15.245 9.917 1.00 . A A . 6 GLU CG 1 1 19 13111 1 1 2 GLU H H 8.966 -11.860 12.296 1.00 . A A . 6 GLU H 1 1 19 13112 1 1 2 GLU HA H 8.931 -12.847 10.147 1.00 . A A . 6 GLU HA 1 1 19 13113 1 1 2 GLU HB2 H 9.640 -14.668 11.985 1.00 . A A . 6 GLU HB2 1 1 19 13114 1 1 2 GLU HB3 H 8.152 -15.431 11.428 1.00 . A A . 6 GLU HB3 1 1 19 13115 1 1 2 GLU HG2 H 9.130 -14.923 9.036 1.00 . A A . 6 GLU HG2 1 1 19 13116 1 1 2 GLU HG3 H 10.667 -14.844 9.896 1.00 . A A . 6 GLU HG3 1 1 19 13117 1 1 2 GLU N N 8.390 -12.646 12.192 1.00 . A A . 6 GLU N 1 1 19 13118 1 1 2 GLU O O 6.485 -14.522 9.899 1.00 . A A . 6 GLU O 1 1 19 13119 1 1 2 GLU OE1 O 8.824 -17.373 10.505 1.00 . A A . 6 GLU OE1 1 1 19 13120 1 1 2 GLU OE2 O 10.678 -17.317 9.408 1.00 . A A . 6 GLU OE2 1 1 19 13121 1 1 3 ILE C C 4.605 -12.737 8.618 1.00 . A A . 7 ILE C 1 1 19 13122 1 1 3 ILE CA C 4.679 -12.537 10.138 1.00 . A A . 7 ILE CA 1 1 19 13123 1 1 3 ILE CB C 4.077 -11.189 10.532 1.00 . A A . 7 ILE CB 1 1 19 13124 1 1 3 ILE CD1 C 4.081 -8.744 10.017 1.00 . A A . 7 ILE CD1 1 1 19 13125 1 1 3 ILE CG1 C 4.817 -10.067 9.798 1.00 . A A . 7 ILE CG1 1 1 19 13126 1 1 3 ILE CG2 C 4.217 -10.988 12.043 1.00 . A A . 7 ILE CG2 1 1 19 13127 1 1 3 ILE H H 6.448 -11.652 10.995 1.00 . A A . 7 ILE H 1 1 19 13128 1 1 3 ILE HA H 4.165 -13.335 10.650 1.00 . A A . 7 ILE HA 1 1 19 13129 1 1 3 ILE HB H 3.031 -11.170 10.261 1.00 . A A . 7 ILE HB 1 1 19 13130 1 1 3 ILE HD11 H 3.391 -8.847 10.841 1.00 . A A . 7 ILE HD11 1 1 19 13131 1 1 3 ILE HD12 H 3.536 -8.483 9.121 1.00 . A A . 7 ILE HD12 1 1 19 13132 1 1 3 ILE HD13 H 4.797 -7.967 10.241 1.00 . A A . 7 ILE HD13 1 1 19 13133 1 1 3 ILE HG12 H 5.823 -9.988 10.184 1.00 . A A . 7 ILE HG12 1 1 19 13134 1 1 3 ILE HG13 H 4.852 -10.290 8.743 1.00 . A A . 7 ILE HG13 1 1 19 13135 1 1 3 ILE HG21 H 4.889 -10.165 12.235 1.00 . A A . 7 ILE HG21 1 1 19 13136 1 1 3 ILE HG22 H 4.612 -11.888 12.489 1.00 . A A . 7 ILE HG22 1 1 19 13137 1 1 3 ILE HG23 H 3.249 -10.769 12.467 1.00 . A A . 7 ILE HG23 1 1 19 13138 1 1 3 ILE N N 6.103 -12.468 10.579 1.00 . A A . 7 ILE N 1 1 19 13139 1 1 3 ILE O O 5.428 -12.222 7.889 1.00 . A A . 7 ILE O 1 1 19 13140 1 1 4 PRO C C 2.942 -12.485 6.021 1.00 . A A . 8 PRO C 1 1 19 13141 1 1 4 PRO CA C 3.445 -13.742 6.735 1.00 . A A . 8 PRO CA 1 1 19 13142 1 1 4 PRO CB C 2.395 -14.848 6.689 1.00 . A A . 8 PRO CB 1 1 19 13143 1 1 4 PRO CD C 2.576 -14.143 8.990 1.00 . A A . 8 PRO CD 1 1 19 13144 1 1 4 PRO CG C 1.627 -14.707 7.965 1.00 . A A . 8 PRO CG 1 1 19 13145 1 1 4 PRO HA H 4.367 -14.088 6.298 1.00 . A A . 8 PRO HA 1 1 19 13146 1 1 4 PRO HB2 H 1.742 -14.711 5.839 1.00 . A A . 8 PRO HB2 1 1 19 13147 1 1 4 PRO HB3 H 2.872 -15.816 6.643 1.00 . A A . 8 PRO HB3 1 1 19 13148 1 1 4 PRO HD2 H 2.069 -13.425 9.619 1.00 . A A . 8 PRO HD2 1 1 19 13149 1 1 4 PRO HD3 H 3.004 -14.935 9.586 1.00 . A A . 8 PRO HD3 1 1 19 13150 1 1 4 PRO HG2 H 0.796 -14.034 7.821 1.00 . A A . 8 PRO HG2 1 1 19 13151 1 1 4 PRO HG3 H 1.268 -15.673 8.287 1.00 . A A . 8 PRO HG3 1 1 19 13152 1 1 4 PRO N N 3.616 -13.481 8.186 1.00 . A A . 8 PRO N 1 1 19 13153 1 1 4 PRO O O 2.859 -11.420 6.603 1.00 . A A . 8 PRO O 1 1 19 13154 1 1 5 ASP C C 1.263 -11.852 2.820 1.00 . A A . 9 ASP C 1 1 19 13155 1 1 5 ASP CA C 2.109 -11.407 4.016 1.00 . A A . 9 ASP CA 1 1 19 13156 1 1 5 ASP CB C 3.370 -10.684 3.543 1.00 . A A . 9 ASP CB 1 1 19 13157 1 1 5 ASP CG C 3.324 -9.227 4.006 1.00 . A A . 9 ASP CG 1 1 19 13158 1 1 5 ASP H H 2.680 -13.465 4.316 1.00 . A A . 9 ASP H 1 1 19 13159 1 1 5 ASP HA H 1.537 -10.764 4.666 1.00 . A A . 9 ASP HA 1 1 19 13160 1 1 5 ASP HB2 H 4.241 -11.167 3.958 1.00 . A A . 9 ASP HB2 1 1 19 13161 1 1 5 ASP HB3 H 3.420 -10.717 2.463 1.00 . A A . 9 ASP HB3 1 1 19 13162 1 1 5 ASP N N 2.606 -12.597 4.766 1.00 . A A . 9 ASP N 1 1 19 13163 1 1 5 ASP O O 1.300 -11.254 1.764 1.00 . A A . 9 ASP O 1 1 19 13164 1 1 5 ASP OD1 O 3.461 -9.000 5.197 1.00 . A A . 9 ASP OD1 1 1 19 13165 1 1 5 ASP OD2 O 3.156 -8.362 3.162 1.00 . A A . 9 ASP OD2 1 1 19 13166 1 1 6 ASP C C -1.392 -12.327 1.484 1.00 . A A . 10 ASP C 1 1 19 13167 1 1 6 ASP CA C -0.347 -13.384 1.856 1.00 . A A . 10 ASP CA 1 1 19 13168 1 1 6 ASP CB C -1.021 -14.640 2.401 1.00 . A A . 10 ASP CB 1 1 19 13169 1 1 6 ASP CG C -1.800 -14.293 3.672 1.00 . A A . 10 ASP CG 1 1 19 13170 1 1 6 ASP H H 0.481 -13.370 3.836 1.00 . A A . 10 ASP H 1 1 19 13171 1 1 6 ASP HA H 0.262 -13.632 1.002 1.00 . A A . 10 ASP HA 1 1 19 13172 1 1 6 ASP HB2 H -1.698 -15.031 1.662 1.00 . A A . 10 ASP HB2 1 1 19 13173 1 1 6 ASP HB3 H -0.271 -15.381 2.629 1.00 . A A . 10 ASP HB3 1 1 19 13174 1 1 6 ASP N N 0.500 -12.899 2.979 1.00 . A A . 10 ASP N 1 1 19 13175 1 1 6 ASP O O -1.811 -12.228 0.349 1.00 . A A . 10 ASP O 1 1 19 13176 1 1 6 ASP OD1 O -1.168 -13.905 4.641 1.00 . A A . 10 ASP OD1 1 1 19 13177 1 1 6 ASP OD2 O -3.012 -14.422 3.653 1.00 . A A . 10 ASP OD2 1 1 19 13178 1 1 7 VAL C C -2.141 -9.171 1.756 1.00 . A A . 11 VAL C 1 1 19 13179 1 1 7 VAL CA C -2.833 -10.491 2.134 1.00 . A A . 11 VAL CA 1 1 19 13180 1 1 7 VAL CB C -3.622 -10.327 3.432 1.00 . A A . 11 VAL CB 1 1 19 13181 1 1 7 VAL CG1 C -4.753 -9.320 3.215 1.00 . A A . 11 VAL CG1 1 1 19 13182 1 1 7 VAL CG2 C -4.212 -11.678 3.840 1.00 . A A . 11 VAL CG2 1 1 19 13183 1 1 7 VAL H H -1.465 -11.634 3.345 1.00 . A A . 11 VAL H 1 1 19 13184 1 1 7 VAL HA H -3.489 -10.819 1.346 1.00 . A A . 11 VAL HA 1 1 19 13185 1 1 7 VAL HB H -2.965 -9.970 4.211 1.00 . A A . 11 VAL HB 1 1 19 13186 1 1 7 VAL HG11 H -5.662 -9.847 2.967 1.00 . A A . 11 VAL HG11 1 1 19 13187 1 1 7 VAL HG12 H -4.491 -8.654 2.406 1.00 . A A . 11 VAL HG12 1 1 19 13188 1 1 7 VAL HG13 H -4.903 -8.747 4.117 1.00 . A A . 11 VAL HG13 1 1 19 13189 1 1 7 VAL HG21 H -4.652 -12.154 2.976 1.00 . A A . 11 VAL HG21 1 1 19 13190 1 1 7 VAL HG22 H -4.970 -11.527 4.594 1.00 . A A . 11 VAL HG22 1 1 19 13191 1 1 7 VAL HG23 H -3.429 -12.307 4.238 1.00 . A A . 11 VAL HG23 1 1 19 13192 1 1 7 VAL N N -1.815 -11.538 2.433 1.00 . A A . 11 VAL N 1 1 19 13193 1 1 7 VAL O O -1.530 -8.539 2.595 1.00 . A A . 11 VAL O 1 1 19 13194 1 1 8 PRO C C -2.442 -6.320 0.492 1.00 . A A . 12 PRO C 1 1 19 13195 1 1 8 PRO CA C -1.624 -7.537 0.039 1.00 . A A . 12 PRO CA 1 1 19 13196 1 1 8 PRO CB C -1.620 -7.677 -1.480 1.00 . A A . 12 PRO CB 1 1 19 13197 1 1 8 PRO CD C -2.970 -9.486 -0.579 1.00 . A A . 12 PRO CD 1 1 19 13198 1 1 8 PRO CG C -2.733 -8.630 -1.798 1.00 . A A . 12 PRO CG 1 1 19 13199 1 1 8 PRO HA H -0.611 -7.468 0.403 1.00 . A A . 12 PRO HA 1 1 19 13200 1 1 8 PRO HB2 H -1.804 -6.719 -1.945 1.00 . A A . 12 PRO HB2 1 1 19 13201 1 1 8 PRO HB3 H -0.676 -8.081 -1.817 1.00 . A A . 12 PRO HB3 1 1 19 13202 1 1 8 PRO HD2 H -4.025 -9.543 -0.358 1.00 . A A . 12 PRO HD2 1 1 19 13203 1 1 8 PRO HD3 H -2.561 -10.474 -0.726 1.00 . A A . 12 PRO HD3 1 1 19 13204 1 1 8 PRO HG2 H -3.630 -8.081 -2.041 1.00 . A A . 12 PRO HG2 1 1 19 13205 1 1 8 PRO HG3 H -2.451 -9.253 -2.633 1.00 . A A . 12 PRO HG3 1 1 19 13206 1 1 8 PRO N N -2.256 -8.793 0.504 1.00 . A A . 12 PRO N 1 1 19 13207 1 1 8 PRO O O -2.175 -5.735 1.523 1.00 . A A . 12 PRO O 1 1 19 13208 1 1 9 LEU C C -5.735 -5.005 -0.208 1.00 . A A . 13 LEU C 1 1 19 13209 1 1 9 LEU CA C -4.260 -4.755 0.138 1.00 . A A . 13 LEU CA 1 1 19 13210 1 1 9 LEU CB C -3.702 -3.587 -0.676 1.00 . A A . 13 LEU CB 1 1 19 13211 1 1 9 LEU CD1 C -1.243 -4.016 -0.853 1.00 . A A . 13 LEU CD1 1 1 19 13212 1 1 9 LEU CD2 C -2.076 -1.712 -0.372 1.00 . A A . 13 LEU CD2 1 1 19 13213 1 1 9 LEU CG C -2.321 -3.202 -0.133 1.00 . A A . 13 LEU CG 1 1 19 13214 1 1 9 LEU H H -3.644 -6.412 -1.089 1.00 . A A . 13 LEU H 1 1 19 13215 1 1 9 LEU HA H -4.149 -4.558 1.192 1.00 . A A . 13 LEU HA 1 1 19 13216 1 1 9 LEU HB2 H -3.612 -3.879 -1.712 1.00 . A A . 13 LEU HB2 1 1 19 13217 1 1 9 LEU HB3 H -4.368 -2.741 -0.597 1.00 . A A . 13 LEU HB3 1 1 19 13218 1 1 9 LEU HD11 H -0.503 -4.344 -0.137 1.00 . A A . 13 LEU HD11 1 1 19 13219 1 1 9 LEU HD12 H -0.769 -3.401 -1.602 1.00 . A A . 13 LEU HD12 1 1 19 13220 1 1 9 LEU HD13 H -1.695 -4.876 -1.323 1.00 . A A . 13 LEU HD13 1 1 19 13221 1 1 9 LEU HD21 H -1.031 -1.488 -0.206 1.00 . A A . 13 LEU HD21 1 1 19 13222 1 1 9 LEU HD22 H -2.678 -1.134 0.312 1.00 . A A . 13 LEU HD22 1 1 19 13223 1 1 9 LEU HD23 H -2.341 -1.459 -1.387 1.00 . A A . 13 LEU HD23 1 1 19 13224 1 1 9 LEU HG H -2.282 -3.409 0.927 1.00 . A A . 13 LEU HG 1 1 19 13225 1 1 9 LEU N N -3.436 -5.933 -0.262 1.00 . A A . 13 LEU N 1 1 19 13226 1 1 9 LEU O O -6.036 -5.779 -1.095 1.00 . A A . 13 LEU O 1 1 19 13227 1 1 10 PRO C C -8.485 -3.832 -1.046 1.00 . A A . 14 PRO C 1 1 19 13228 1 1 10 PRO CA C -8.068 -4.513 0.263 1.00 . A A . 14 PRO CA 1 1 19 13229 1 1 10 PRO CB C -8.720 -3.840 1.466 1.00 . A A . 14 PRO CB 1 1 19 13230 1 1 10 PRO CD C -6.347 -3.389 1.594 1.00 . A A . 14 PRO CD 1 1 19 13231 1 1 10 PRO CG C -7.710 -2.851 1.954 1.00 . A A . 14 PRO CG 1 1 19 13232 1 1 10 PRO HA H -8.327 -5.558 0.243 1.00 . A A . 14 PRO HA 1 1 19 13233 1 1 10 PRO HB2 H -9.626 -3.333 1.168 1.00 . A A . 14 PRO HB2 1 1 19 13234 1 1 10 PRO HB3 H -8.932 -4.568 2.234 1.00 . A A . 14 PRO HB3 1 1 19 13235 1 1 10 PRO HD2 H -5.706 -2.591 1.248 1.00 . A A . 14 PRO HD2 1 1 19 13236 1 1 10 PRO HD3 H -5.904 -3.892 2.439 1.00 . A A . 14 PRO HD3 1 1 19 13237 1 1 10 PRO HG2 H -7.868 -1.896 1.475 1.00 . A A . 14 PRO HG2 1 1 19 13238 1 1 10 PRO HG3 H -7.790 -2.741 3.026 1.00 . A A . 14 PRO HG3 1 1 19 13239 1 1 10 PRO N N -6.614 -4.343 0.507 1.00 . A A . 14 PRO N 1 1 19 13240 1 1 10 PRO O O -7.659 -3.484 -1.866 1.00 . A A . 14 PRO O 1 1 19 13241 1 1 11 ALA C C -9.942 -1.502 -2.488 1.00 . A A . 15 ALA C 1 1 19 13242 1 1 11 ALA CA C -10.235 -3.005 -2.511 1.00 . A A . 15 ALA CA 1 1 19 13243 1 1 11 ALA CB C -11.743 -3.257 -2.540 1.00 . A A . 15 ALA CB 1 1 19 13244 1 1 11 ALA H H -10.411 -3.949 -0.580 1.00 . A A . 15 ALA H 1 1 19 13245 1 1 11 ALA HA H -9.769 -3.466 -3.368 1.00 . A A . 15 ALA HA 1 1 19 13246 1 1 11 ALA HB1 H -12.029 -3.606 -3.521 1.00 . A A . 15 ALA HB1 1 1 19 13247 1 1 11 ALA HB2 H -12.265 -2.339 -2.318 1.00 . A A . 15 ALA HB2 1 1 19 13248 1 1 11 ALA HB3 H -11.997 -4.005 -1.804 1.00 . A A . 15 ALA HB3 1 1 19 13249 1 1 11 ALA N N -9.761 -3.652 -1.251 1.00 . A A . 15 ALA N 1 1 19 13250 1 1 11 ALA O O -9.566 -0.947 -1.476 1.00 . A A . 15 ALA O 1 1 19 13251 1 1 12 GLY C C -8.360 0.896 -3.427 1.00 . A A . 16 GLY C 1 1 19 13252 1 1 12 GLY CA C -9.852 0.625 -3.651 1.00 . A A . 16 GLY CA 1 1 19 13253 1 1 12 GLY H H -10.423 -1.310 -4.405 1.00 . A A . 16 GLY H 1 1 19 13254 1 1 12 GLY HA2 H -10.145 1.009 -4.618 1.00 . A A . 16 GLY HA2 1 1 19 13255 1 1 12 GLY HA3 H -10.426 1.118 -2.880 1.00 . A A . 16 GLY HA3 1 1 19 13256 1 1 12 GLY N N -10.117 -0.841 -3.601 1.00 . A A . 16 GLY N 1 1 19 13257 1 1 12 GLY O O -7.956 2.016 -3.189 1.00 . A A . 16 GLY O 1 1 19 13258 1 1 13 TRP C C -5.292 -0.188 -4.560 1.00 . A A . 17 TRP C 1 1 19 13259 1 1 13 TRP CA C -6.078 0.095 -3.278 1.00 . A A . 17 TRP CA 1 1 19 13260 1 1 13 TRP CB C -5.701 -0.911 -2.197 1.00 . A A . 17 TRP CB 1 1 19 13261 1 1 13 TRP CD1 C -6.853 -0.304 -0.037 1.00 . A A . 17 TRP CD1 1 1 19 13262 1 1 13 TRP CD2 C -4.792 0.572 -0.206 1.00 . A A . 17 TRP CD2 1 1 19 13263 1 1 13 TRP CE2 C -5.305 0.992 1.041 1.00 . A A . 17 TRP CE2 1 1 19 13264 1 1 13 TRP CE3 C -3.500 0.984 -0.568 1.00 . A A . 17 TRP CE3 1 1 19 13265 1 1 13 TRP CG C -5.788 -0.249 -0.867 1.00 . A A . 17 TRP CG 1 1 19 13266 1 1 13 TRP CH2 C -3.273 2.200 1.524 1.00 . A A . 17 TRP CH2 1 1 19 13267 1 1 13 TRP CZ2 C -4.559 1.798 1.903 1.00 . A A . 17 TRP CZ2 1 1 19 13268 1 1 13 TRP CZ3 C -2.750 1.794 0.293 1.00 . A A . 17 TRP CZ3 1 1 19 13269 1 1 13 TRP H H -7.874 -1.016 -3.681 1.00 . A A . 17 TRP H 1 1 19 13270 1 1 13 TRP HA H -5.887 1.098 -2.930 1.00 . A A . 17 TRP HA 1 1 19 13271 1 1 13 TRP HB2 H -6.385 -1.748 -2.229 1.00 . A A . 17 TRP HB2 1 1 19 13272 1 1 13 TRP HB3 H -4.693 -1.261 -2.362 1.00 . A A . 17 TRP HB3 1 1 19 13273 1 1 13 TRP HD1 H -7.772 -0.836 -0.232 1.00 . A A . 17 TRP HD1 1 1 19 13274 1 1 13 TRP HE1 H -7.174 0.556 1.863 1.00 . A A . 17 TRP HE1 1 1 19 13275 1 1 13 TRP HE3 H -3.084 0.678 -1.515 1.00 . A A . 17 TRP HE3 1 1 19 13276 1 1 13 TRP HH2 H -2.683 2.821 2.178 1.00 . A A . 17 TRP HH2 1 1 19 13277 1 1 13 TRP HZ2 H -4.968 2.108 2.852 1.00 . A A . 17 TRP HZ2 1 1 19 13278 1 1 13 TRP HZ3 H -1.763 2.106 0.004 1.00 . A A . 17 TRP HZ3 1 1 19 13279 1 1 13 TRP N N -7.537 -0.117 -3.495 1.00 . A A . 17 TRP N 1 1 19 13280 1 1 13 TRP NE1 N -6.568 0.433 1.100 1.00 . A A . 17 TRP NE1 1 1 19 13281 1 1 13 TRP O O -5.588 -1.117 -5.285 1.00 . A A . 17 TRP O 1 1 19 13282 1 1 14 GLU C C -1.998 0.339 -5.795 1.00 . A A . 18 GLU C 1 1 19 13283 1 1 14 GLU CA C -3.499 0.360 -6.090 1.00 . A A . 18 GLU CA 1 1 19 13284 1 1 14 GLU CB C -3.822 1.533 -7.014 1.00 . A A . 18 GLU CB 1 1 19 13285 1 1 14 GLU CD C -6.165 0.893 -7.602 1.00 . A A . 18 GLU CD 1 1 19 13286 1 1 14 GLU CG C -4.742 1.062 -8.140 1.00 . A A . 18 GLU CG 1 1 19 13287 1 1 14 GLU H H -4.064 1.352 -4.255 1.00 . A A . 18 GLU H 1 1 19 13288 1 1 14 GLU HA H -3.804 -0.564 -6.554 1.00 . A A . 18 GLU HA 1 1 19 13289 1 1 14 GLU HB2 H -4.308 2.314 -6.452 1.00 . A A . 18 GLU HB2 1 1 19 13290 1 1 14 GLU HB3 H -2.906 1.916 -7.440 1.00 . A A . 18 GLU HB3 1 1 19 13291 1 1 14 GLU HG2 H -4.741 1.793 -8.936 1.00 . A A . 18 GLU HG2 1 1 19 13292 1 1 14 GLU HG3 H -4.387 0.116 -8.522 1.00 . A A . 18 GLU HG3 1 1 19 13293 1 1 14 GLU N N -4.291 0.604 -4.850 1.00 . A A . 18 GLU N 1 1 19 13294 1 1 14 GLU O O -1.352 1.372 -5.776 1.00 . A A . 18 GLU O 1 1 19 13295 1 1 14 GLU OE1 O -6.845 1.896 -7.457 1.00 . A A . 18 GLU OE1 1 1 19 13296 1 1 14 GLU OE2 O -6.550 -0.236 -7.343 1.00 . A A . 18 GLU OE2 1 1 19 13297 1 1 15 MET C C 0.755 -0.462 -6.627 1.00 . A A . 19 MET C 1 1 19 13298 1 1 15 MET CA C 0.037 -0.866 -5.346 1.00 . A A . 19 MET CA 1 1 19 13299 1 1 15 MET CB C 0.390 -2.307 -4.984 1.00 . A A . 19 MET CB 1 1 19 13300 1 1 15 MET CE C -1.864 -4.183 -4.242 1.00 . A A . 19 MET CE 1 1 19 13301 1 1 15 MET CG C -0.077 -3.269 -6.085 1.00 . A A . 19 MET CG 1 1 19 13302 1 1 15 MET H H -1.945 -1.645 -5.627 1.00 . A A . 19 MET H 1 1 19 13303 1 1 15 MET HA H 0.305 -0.201 -4.540 1.00 . A A . 19 MET HA 1 1 19 13304 1 1 15 MET HB2 H 1.455 -2.381 -4.887 1.00 . A A . 19 MET HB2 1 1 19 13305 1 1 15 MET HB3 H -0.066 -2.570 -4.043 1.00 . A A . 19 MET HB3 1 1 19 13306 1 1 15 MET HE1 H -1.619 -4.438 -3.220 1.00 . A A . 19 MET HE1 1 1 19 13307 1 1 15 MET HE2 H -2.818 -4.609 -4.499 1.00 . A A . 19 MET HE2 1 1 19 13308 1 1 15 MET HE3 H -1.909 -3.107 -4.349 1.00 . A A . 19 MET HE3 1 1 19 13309 1 1 15 MET HG2 H -0.906 -2.838 -6.623 1.00 . A A . 19 MET HG2 1 1 19 13310 1 1 15 MET HG3 H 0.737 -3.446 -6.770 1.00 . A A . 19 MET HG3 1 1 19 13311 1 1 15 MET N N -1.426 -0.821 -5.594 1.00 . A A . 19 MET N 1 1 19 13312 1 1 15 MET O O 0.559 -1.043 -7.677 1.00 . A A . 19 MET O 1 1 19 13313 1 1 15 MET SD S -0.587 -4.841 -5.345 1.00 . A A . 19 MET SD 1 1 19 13314 1 1 16 ALA C C 3.580 1.694 -7.284 1.00 . A A . 20 ALA C 1 1 19 13315 1 1 16 ALA CA C 2.309 0.989 -7.755 1.00 . A A . 20 ALA CA 1 1 19 13316 1 1 16 ALA CB C 1.329 1.935 -8.461 1.00 . A A . 20 ALA CB 1 1 19 13317 1 1 16 ALA H H 1.717 0.983 -5.691 1.00 . A A . 20 ALA H 1 1 19 13318 1 1 16 ALA HA H 2.552 0.152 -8.392 1.00 . A A . 20 ALA HA 1 1 19 13319 1 1 16 ALA HB1 H 1.846 2.820 -8.791 1.00 . A A . 20 ALA HB1 1 1 19 13320 1 1 16 ALA HB2 H 0.542 2.213 -7.775 1.00 . A A . 20 ALA HB2 1 1 19 13321 1 1 16 ALA HB3 H 0.896 1.431 -9.313 1.00 . A A . 20 ALA HB3 1 1 19 13322 1 1 16 ALA N N 1.577 0.531 -6.550 1.00 . A A . 20 ALA N 1 1 19 13323 1 1 16 ALA O O 4.083 1.385 -6.223 1.00 . A A . 20 ALA O 1 1 19 13324 1 1 17 LYS C C 5.232 4.787 -7.487 1.00 . A A . 21 LYS C 1 1 19 13325 1 1 17 LYS CA C 5.375 3.272 -7.551 1.00 . A A . 21 LYS CA 1 1 19 13326 1 1 17 LYS CB C 6.455 2.864 -8.554 1.00 . A A . 21 LYS CB 1 1 19 13327 1 1 17 LYS CD C 8.813 3.259 -9.281 1.00 . A A . 21 LYS CD 1 1 19 13328 1 1 17 LYS CE C 8.792 4.396 -10.305 1.00 . A A . 21 LYS CE 1 1 19 13329 1 1 17 LYS CG C 7.780 3.539 -8.189 1.00 . A A . 21 LYS CG 1 1 19 13330 1 1 17 LYS H H 3.734 2.861 -8.896 1.00 . A A . 21 LYS H 1 1 19 13331 1 1 17 LYS HA H 5.618 2.901 -6.575 1.00 . A A . 21 LYS HA 1 1 19 13332 1 1 17 LYS HB2 H 6.580 1.792 -8.530 1.00 . A A . 21 LYS HB2 1 1 19 13333 1 1 17 LYS HB3 H 6.159 3.169 -9.546 1.00 . A A . 21 LYS HB3 1 1 19 13334 1 1 17 LYS HD2 H 9.795 3.191 -8.839 1.00 . A A . 21 LYS HD2 1 1 19 13335 1 1 17 LYS HD3 H 8.573 2.327 -9.773 1.00 . A A . 21 LYS HD3 1 1 19 13336 1 1 17 LYS HE2 H 8.236 5.238 -9.921 1.00 . A A . 21 LYS HE2 1 1 19 13337 1 1 17 LYS HE3 H 9.799 4.693 -10.558 1.00 . A A . 21 LYS HE3 1 1 19 13338 1 1 17 LYS HG2 H 7.629 4.604 -8.100 1.00 . A A . 21 LYS HG2 1 1 19 13339 1 1 17 LYS HG3 H 8.137 3.146 -7.249 1.00 . A A . 21 LYS HG3 1 1 19 13340 1 1 17 LYS HZ1 H 8.467 2.865 -11.680 1.00 . A A . 21 LYS HZ1 1 1 19 13341 1 1 17 LYS HZ2 H 8.290 4.425 -12.327 1.00 . A A . 21 LYS HZ2 1 1 19 13342 1 1 17 LYS HZ3 H 7.084 3.778 -11.322 1.00 . A A . 21 LYS HZ3 1 1 19 13343 1 1 17 LYS N N 4.126 2.615 -8.034 1.00 . A A . 21 LYS N 1 1 19 13344 1 1 17 LYS NZ N 8.106 3.822 -11.498 1.00 . A A . 21 LYS NZ 1 1 19 13345 1 1 17 LYS O O 4.412 5.382 -8.156 1.00 . A A . 21 LYS O 1 1 19 13346 1 1 18 THR C C 7.308 7.548 -6.855 1.00 . A A . 22 THR C 1 1 19 13347 1 1 18 THR CA C 5.960 6.899 -6.540 1.00 . A A . 22 THR CA 1 1 19 13348 1 1 18 THR CB C 5.547 7.192 -5.086 1.00 . A A . 22 THR CB 1 1 19 13349 1 1 18 THR CG2 C 6.253 6.245 -4.102 1.00 . A A . 22 THR CG2 1 1 19 13350 1 1 18 THR H H 6.695 4.896 -6.134 1.00 . A A . 22 THR H 1 1 19 13351 1 1 18 THR HA H 5.206 7.282 -7.209 1.00 . A A . 22 THR HA 1 1 19 13352 1 1 18 THR HB H 4.483 7.071 -4.993 1.00 . A A . 22 THR HB 1 1 19 13353 1 1 18 THR HG1 H 5.200 9.106 -5.108 1.00 . A A . 22 THR HG1 1 1 19 13354 1 1 18 THR HG21 H 5.902 6.445 -3.099 1.00 . A A . 22 THR HG21 1 1 19 13355 1 1 18 THR HG22 H 7.320 6.404 -4.147 1.00 . A A . 22 THR HG22 1 1 19 13356 1 1 18 THR HG23 H 6.032 5.221 -4.361 1.00 . A A . 22 THR HG23 1 1 19 13357 1 1 18 THR N N 6.037 5.411 -6.669 1.00 . A A . 22 THR N 1 1 19 13358 1 1 18 THR O O 8.280 6.882 -7.154 1.00 . A A . 22 THR O 1 1 19 13359 1 1 18 THR OG1 O 5.892 8.533 -4.768 1.00 . A A . 22 THR OG1 1 1 19 13360 1 1 19 SER C C 9.657 9.334 -5.979 1.00 . A A . 23 SER C 1 1 19 13361 1 1 19 SER CA C 8.639 9.564 -7.096 1.00 . A A . 23 SER CA 1 1 19 13362 1 1 19 SER CB C 8.254 11.043 -7.173 1.00 . A A . 23 SER CB 1 1 19 13363 1 1 19 SER H H 6.561 9.359 -6.555 1.00 . A A . 23 SER H 1 1 19 13364 1 1 19 SER HA H 9.038 9.240 -8.043 1.00 . A A . 23 SER HA 1 1 19 13365 1 1 19 SER HB2 H 7.474 11.249 -6.454 1.00 . A A . 23 SER HB2 1 1 19 13366 1 1 19 SER HB3 H 9.117 11.651 -6.952 1.00 . A A . 23 SER HB3 1 1 19 13367 1 1 19 SER HG H 7.400 12.222 -8.461 1.00 . A A . 23 SER HG 1 1 19 13368 1 1 19 SER N N 7.364 8.849 -6.795 1.00 . A A . 23 SER N 1 1 19 13369 1 1 19 SER O O 9.735 10.088 -5.028 1.00 . A A . 23 SER O 1 1 19 13370 1 1 19 SER OG O 7.784 11.342 -8.479 1.00 . A A . 23 SER OG 1 1 19 13371 1 1 20 SER C C 12.230 6.731 -5.384 1.00 . A A . 24 SER C 1 1 19 13372 1 1 20 SER CA C 11.465 8.007 -5.035 1.00 . A A . 24 SER CA 1 1 19 13373 1 1 20 SER CB C 10.679 7.817 -3.735 1.00 . A A . 24 SER CB 1 1 19 13374 1 1 20 SER H H 10.362 7.707 -6.864 1.00 . A A . 24 SER H 1 1 19 13375 1 1 20 SER HA H 12.145 8.832 -4.938 1.00 . A A . 24 SER HA 1 1 19 13376 1 1 20 SER HB2 H 9.625 7.742 -3.961 1.00 . A A . 24 SER HB2 1 1 19 13377 1 1 20 SER HB3 H 11.007 6.911 -3.246 1.00 . A A . 24 SER HB3 1 1 19 13378 1 1 20 SER HG H 11.783 8.837 -2.503 1.00 . A A . 24 SER HG 1 1 19 13379 1 1 20 SER N N 10.442 8.296 -6.087 1.00 . A A . 24 SER N 1 1 19 13380 1 1 20 SER O O 13.405 6.598 -5.107 1.00 . A A . 24 SER O 1 1 19 13381 1 1 20 SER OG O 10.904 8.927 -2.879 1.00 . A A . 24 SER OG 1 1 19 13382 1 1 21 GLY C C 11.658 3.385 -5.503 1.00 . A A . 25 GLY C 1 1 19 13383 1 1 21 GLY CA C 12.234 4.514 -6.356 1.00 . A A . 25 GLY CA 1 1 19 13384 1 1 21 GLY H H 10.619 5.927 -6.195 1.00 . A A . 25 GLY H 1 1 19 13385 1 1 21 GLY HA2 H 12.059 4.303 -7.401 1.00 . A A . 25 GLY HA2 1 1 19 13386 1 1 21 GLY HA3 H 13.296 4.598 -6.177 1.00 . A A . 25 GLY HA3 1 1 19 13387 1 1 21 GLY N N 11.565 5.791 -5.988 1.00 . A A . 25 GLY N 1 1 19 13388 1 1 21 GLY O O 12.306 2.389 -5.254 1.00 . A A . 25 GLY O 1 1 19 13389 1 1 22 GLN C C 8.359 2.274 -4.587 1.00 . A A . 26 GLN C 1 1 19 13390 1 1 22 GLN CA C 9.826 2.477 -4.203 1.00 . A A . 26 GLN CA 1 1 19 13391 1 1 22 GLN CB C 9.938 2.997 -2.769 1.00 . A A . 26 GLN CB 1 1 19 13392 1 1 22 GLN CD C 11.532 3.701 -0.978 1.00 . A A . 26 GLN CD 1 1 19 13393 1 1 22 GLN CG C 11.404 3.302 -2.450 1.00 . A A . 26 GLN CG 1 1 19 13394 1 1 22 GLN H H 9.940 4.354 -5.254 1.00 . A A . 26 GLN H 1 1 19 13395 1 1 22 GLN HA H 10.374 1.553 -4.302 1.00 . A A . 26 GLN HA 1 1 19 13396 1 1 22 GLN HB2 H 9.352 3.898 -2.666 1.00 . A A . 26 GLN HB2 1 1 19 13397 1 1 22 GLN HB3 H 9.569 2.248 -2.085 1.00 . A A . 26 GLN HB3 1 1 19 13398 1 1 22 GLN HE21 H 12.195 5.527 -1.384 1.00 . A A . 26 GLN HE21 1 1 19 13399 1 1 22 GLN HE22 H 12.046 5.159 0.267 1.00 . A A . 26 GLN HE22 1 1 19 13400 1 1 22 GLN HG2 H 12.003 2.425 -2.639 1.00 . A A . 26 GLN HG2 1 1 19 13401 1 1 22 GLN HG3 H 11.747 4.114 -3.074 1.00 . A A . 26 GLN HG3 1 1 19 13402 1 1 22 GLN N N 10.444 3.539 -5.046 1.00 . A A . 26 GLN N 1 1 19 13403 1 1 22 GLN NE2 N 11.960 4.895 -0.673 1.00 . A A . 26 GLN NE2 1 1 19 13404 1 1 22 GLN O O 7.702 3.172 -5.107 1.00 . A A . 26 GLN O 1 1 19 13405 1 1 22 GLN OE1 O 11.241 2.916 -0.097 1.00 . A A . 26 GLN OE1 1 1 19 13406 1 1 23 ARG C C 5.497 1.345 -3.579 1.00 . A A . 27 ARG C 1 1 19 13407 1 1 23 ARG CA C 6.412 0.837 -4.676 1.00 . A A . 27 ARG CA 1 1 19 13408 1 1 23 ARG CB C 6.258 -0.682 -4.791 1.00 . A A . 27 ARG CB 1 1 19 13409 1 1 23 ARG CD C 7.349 -1.263 -6.960 1.00 . A A . 27 ARG CD 1 1 19 13410 1 1 23 ARG CG C 6.011 -1.037 -6.255 1.00 . A A . 27 ARG CG 1 1 19 13411 1 1 23 ARG CZ C 7.959 -2.584 -8.922 1.00 . A A . 27 ARG CZ 1 1 19 13412 1 1 23 ARG H H 8.377 0.401 -3.912 1.00 . A A . 27 ARG H 1 1 19 13413 1 1 23 ARG HA H 6.166 1.301 -5.615 1.00 . A A . 27 ARG HA 1 1 19 13414 1 1 23 ARG HB2 H 7.147 -1.172 -4.435 1.00 . A A . 27 ARG HB2 1 1 19 13415 1 1 23 ARG HB3 H 5.411 -1.003 -4.196 1.00 . A A . 27 ARG HB3 1 1 19 13416 1 1 23 ARG HD2 H 7.702 -0.342 -7.401 1.00 . A A . 27 ARG HD2 1 1 19 13417 1 1 23 ARG HD3 H 8.079 -1.652 -6.265 1.00 . A A . 27 ARG HD3 1 1 19 13418 1 1 23 ARG HE H 6.175 -2.701 -8.051 1.00 . A A . 27 ARG HE 1 1 19 13419 1 1 23 ARG HG2 H 5.413 -1.935 -6.313 1.00 . A A . 27 ARG HG2 1 1 19 13420 1 1 23 ARG HG3 H 5.484 -0.219 -6.729 1.00 . A A . 27 ARG HG3 1 1 19 13421 1 1 23 ARG HH11 H 9.378 -1.348 -8.217 1.00 . A A . 27 ARG HH11 1 1 19 13422 1 1 23 ARG HH12 H 9.818 -2.279 -9.607 1.00 . A A . 27 ARG HH12 1 1 19 13423 1 1 23 ARG HH21 H 6.770 -3.899 -9.854 1.00 . A A . 27 ARG HH21 1 1 19 13424 1 1 23 ARG HH22 H 8.354 -3.712 -10.528 1.00 . A A . 27 ARG HH22 1 1 19 13425 1 1 23 ARG N N 7.835 1.100 -4.331 1.00 . A A . 27 ARG N 1 1 19 13426 1 1 23 ARG NE N 7.055 -2.270 -8.023 1.00 . A A . 27 ARG NE 1 1 19 13427 1 1 23 ARG NH1 N 9.143 -2.026 -8.913 1.00 . A A . 27 ARG NH1 1 1 19 13428 1 1 23 ARG NH2 N 7.672 -3.466 -9.839 1.00 . A A . 27 ARG NH2 1 1 19 13429 1 1 23 ARG O O 5.522 0.866 -2.462 1.00 . A A . 27 ARG O 1 1 19 13430 1 1 24 TYR C C 2.357 2.165 -3.115 1.00 . A A . 28 TYR C 1 1 19 13431 1 1 24 TYR CA C 3.715 2.777 -2.873 1.00 . A A . 28 TYR CA 1 1 19 13432 1 1 24 TYR CB C 3.687 4.317 -2.969 1.00 . A A . 28 TYR CB 1 1 19 13433 1 1 24 TYR CD1 C 2.604 4.033 -5.273 1.00 . A A . 28 TYR CD1 1 1 19 13434 1 1 24 TYR CD2 C 2.422 6.165 -4.136 1.00 . A A . 28 TYR CD2 1 1 19 13435 1 1 24 TYR CE1 C 1.907 4.554 -6.359 1.00 . A A . 28 TYR CE1 1 1 19 13436 1 1 24 TYR CE2 C 1.713 6.676 -5.224 1.00 . A A . 28 TYR CE2 1 1 19 13437 1 1 24 TYR CG C 2.872 4.836 -4.152 1.00 . A A . 28 TYR CG 1 1 19 13438 1 1 24 TYR CZ C 1.461 5.874 -6.338 1.00 . A A . 28 TYR CZ 1 1 19 13439 1 1 24 TYR H H 4.641 2.623 -4.814 1.00 . A A . 28 TYR H 1 1 19 13440 1 1 24 TYR HA H 4.058 2.482 -1.892 1.00 . A A . 28 TYR HA 1 1 19 13441 1 1 24 TYR HB2 H 3.263 4.711 -2.058 1.00 . A A . 28 TYR HB2 1 1 19 13442 1 1 24 TYR HB3 H 4.700 4.675 -3.063 1.00 . A A . 28 TYR HB3 1 1 19 13443 1 1 24 TYR HD1 H 2.923 3.014 -5.298 1.00 . A A . 28 TYR HD1 1 1 19 13444 1 1 24 TYR HD2 H 2.603 6.794 -3.277 1.00 . A A . 28 TYR HD2 1 1 19 13445 1 1 24 TYR HE1 H 1.703 3.931 -7.212 1.00 . A A . 28 TYR HE1 1 1 19 13446 1 1 24 TYR HE2 H 1.365 7.693 -5.206 1.00 . A A . 28 TYR HE2 1 1 19 13447 1 1 24 TYR HH H 1.436 6.707 -8.053 1.00 . A A . 28 TYR HH 1 1 19 13448 1 1 24 TYR N N 4.663 2.279 -3.898 1.00 . A A . 28 TYR N 1 1 19 13449 1 1 24 TYR O O 2.151 1.416 -4.051 1.00 . A A . 28 TYR O 1 1 19 13450 1 1 24 TYR OH O 0.786 6.388 -7.423 1.00 . A A . 28 TYR OH 1 1 19 13451 1 1 25 PHE C C -0.885 3.052 -2.449 1.00 . A A . 29 PHE C 1 1 19 13452 1 1 25 PHE CA C 0.096 1.904 -2.433 1.00 . A A . 29 PHE CA 1 1 19 13453 1 1 25 PHE CB C -0.052 0.956 -1.249 1.00 . A A . 29 PHE CB 1 1 19 13454 1 1 25 PHE CD1 C 2.320 0.065 -1.134 1.00 . A A . 29 PHE CD1 1 1 19 13455 1 1 25 PHE CD2 C 0.572 -1.348 -2.036 1.00 . A A . 29 PHE CD2 1 1 19 13456 1 1 25 PHE CE1 C 3.258 -0.943 -1.387 1.00 . A A . 29 PHE CE1 1 1 19 13457 1 1 25 PHE CE2 C 1.512 -2.350 -2.292 1.00 . A A . 29 PHE CE2 1 1 19 13458 1 1 25 PHE CG C 0.967 -0.142 -1.458 1.00 . A A . 29 PHE CG 1 1 19 13459 1 1 25 PHE CZ C 2.854 -2.150 -1.968 1.00 . A A . 29 PHE CZ 1 1 19 13460 1 1 25 PHE H H 1.640 3.068 -1.529 1.00 . A A . 29 PHE H 1 1 19 13461 1 1 25 PHE HA H 0.033 1.350 -3.358 1.00 . A A . 29 PHE HA 1 1 19 13462 1 1 25 PHE HB2 H 0.143 1.479 -0.321 1.00 . A A . 29 PHE HB2 1 1 19 13463 1 1 25 PHE HB3 H -1.048 0.537 -1.234 1.00 . A A . 29 PHE HB3 1 1 19 13464 1 1 25 PHE HD1 H 2.636 0.999 -0.687 1.00 . A A . 29 PHE HD1 1 1 19 13465 1 1 25 PHE HD2 H -0.462 -1.505 -2.287 1.00 . A A . 29 PHE HD2 1 1 19 13466 1 1 25 PHE HE1 H 4.297 -0.786 -1.145 1.00 . A A . 29 PHE HE1 1 1 19 13467 1 1 25 PHE HE2 H 1.198 -3.281 -2.747 1.00 . A A . 29 PHE HE2 1 1 19 13468 1 1 25 PHE HZ H 3.578 -2.923 -2.175 1.00 . A A . 29 PHE HZ 1 1 19 13469 1 1 25 PHE N N 1.441 2.466 -2.276 1.00 . A A . 29 PHE N 1 1 19 13470 1 1 25 PHE O O -1.215 3.639 -1.433 1.00 . A A . 29 PHE O 1 1 19 13471 1 1 26 LEU C C -3.620 4.152 -3.292 1.00 . A A . 30 LEU C 1 1 19 13472 1 1 26 LEU CA C -2.226 4.547 -3.783 1.00 . A A . 30 LEU CA 1 1 19 13473 1 1 26 LEU CB C -2.211 4.854 -5.287 1.00 . A A . 30 LEU CB 1 1 19 13474 1 1 26 LEU CD1 C -1.808 6.581 -7.034 1.00 . A A . 30 LEU CD1 1 1 19 13475 1 1 26 LEU CD2 C -2.498 7.297 -4.762 1.00 . A A . 30 LEU CD2 1 1 19 13476 1 1 26 LEU CG C -1.690 6.270 -5.543 1.00 . A A . 30 LEU CG 1 1 19 13477 1 1 26 LEU H H -0.979 2.926 -4.425 1.00 . A A . 30 LEU H 1 1 19 13478 1 1 26 LEU HA H -1.857 5.391 -3.227 1.00 . A A . 30 LEU HA 1 1 19 13479 1 1 26 LEU HB2 H -1.557 4.154 -5.788 1.00 . A A . 30 LEU HB2 1 1 19 13480 1 1 26 LEU HB3 H -3.205 4.763 -5.686 1.00 . A A . 30 LEU HB3 1 1 19 13481 1 1 26 LEU HD11 H -1.216 7.453 -7.268 1.00 . A A . 30 LEU HD11 1 1 19 13482 1 1 26 LEU HD12 H -2.841 6.767 -7.283 1.00 . A A . 30 LEU HD12 1 1 19 13483 1 1 26 LEU HD13 H -1.448 5.737 -7.605 1.00 . A A . 30 LEU HD13 1 1 19 13484 1 1 26 LEU HD21 H -2.756 6.904 -3.794 1.00 . A A . 30 LEU HD21 1 1 19 13485 1 1 26 LEU HD22 H -3.394 7.532 -5.309 1.00 . A A . 30 LEU HD22 1 1 19 13486 1 1 26 LEU HD23 H -1.904 8.192 -4.641 1.00 . A A . 30 LEU HD23 1 1 19 13487 1 1 26 LEU HG H -0.663 6.334 -5.243 1.00 . A A . 30 LEU HG 1 1 19 13488 1 1 26 LEU N N -1.304 3.405 -3.629 1.00 . A A . 30 LEU N 1 1 19 13489 1 1 26 LEU O O -4.327 3.387 -3.922 1.00 . A A . 30 LEU O 1 1 19 13490 1 1 27 ASN C C -6.425 5.140 -2.297 1.00 . A A . 31 ASN C 1 1 19 13491 1 1 27 ASN CA C -5.335 4.340 -1.582 1.00 . A A . 31 ASN CA 1 1 19 13492 1 1 27 ASN CB C -5.229 4.760 -0.115 1.00 . A A . 31 ASN CB 1 1 19 13493 1 1 27 ASN CG C -6.544 4.481 0.605 1.00 . A A . 31 ASN CG 1 1 19 13494 1 1 27 ASN H H -3.401 5.269 -1.672 1.00 . A A . 31 ASN H 1 1 19 13495 1 1 27 ASN HA H -5.530 3.282 -1.651 1.00 . A A . 31 ASN HA 1 1 19 13496 1 1 27 ASN HB2 H -4.441 4.200 0.365 1.00 . A A . 31 ASN HB2 1 1 19 13497 1 1 27 ASN HB3 H -5.005 5.815 -0.059 1.00 . A A . 31 ASN HB3 1 1 19 13498 1 1 27 ASN HD21 H -5.647 3.932 2.286 1.00 . A A . 31 ASN HD21 1 1 19 13499 1 1 27 ASN HD22 H -7.337 3.872 2.311 1.00 . A A . 31 ASN HD22 1 1 19 13500 1 1 27 ASN N N -4.002 4.665 -2.156 1.00 . A A . 31 ASN N 1 1 19 13501 1 1 27 ASN ND2 N -6.508 4.062 1.837 1.00 . A A . 31 ASN ND2 1 1 19 13502 1 1 27 ASN O O -6.569 6.331 -2.090 1.00 . A A . 31 ASN O 1 1 19 13503 1 1 27 ASN OD1 O -7.610 4.651 0.047 1.00 . A A . 31 ASN OD1 1 1 19 13504 1 1 28 HIS C C -9.514 5.369 -2.975 1.00 . A A . 32 HIS C 1 1 19 13505 1 1 28 HIS CA C -8.277 5.201 -3.868 1.00 . A A . 32 HIS CA 1 1 19 13506 1 1 28 HIS CB C -8.600 4.300 -5.060 1.00 . A A . 32 HIS CB 1 1 19 13507 1 1 28 HIS CD2 C -6.909 4.828 -7.002 1.00 . A A . 32 HIS CD2 1 1 19 13508 1 1 28 HIS CE1 C -8.139 6.215 -8.123 1.00 . A A . 32 HIS CE1 1 1 19 13509 1 1 28 HIS CG C -8.098 4.940 -6.325 1.00 . A A . 32 HIS CG 1 1 19 13510 1 1 28 HIS H H -7.050 3.532 -3.280 1.00 . A A . 32 HIS H 1 1 19 13511 1 1 28 HIS HA H -7.931 6.161 -4.217 1.00 . A A . 32 HIS HA 1 1 19 13512 1 1 28 HIS HB2 H -8.119 3.341 -4.927 1.00 . A A . 32 HIS HB2 1 1 19 13513 1 1 28 HIS HB3 H -9.669 4.160 -5.128 1.00 . A A . 32 HIS HB3 1 1 19 13514 1 1 28 HIS HD1 H -9.777 6.125 -6.843 1.00 . A A . 32 HIS HD1 1 1 19 13515 1 1 28 HIS HD2 H -6.077 4.208 -6.698 1.00 . A A . 32 HIS HD2 1 1 19 13516 1 1 28 HIS HE1 H -8.484 6.909 -8.875 1.00 . A A . 32 HIS HE1 1 1 19 13517 1 1 28 HIS N N -7.190 4.490 -3.134 1.00 . A A . 32 HIS N 1 1 19 13518 1 1 28 HIS ND1 N -8.867 5.830 -7.059 1.00 . A A . 32 HIS ND1 1 1 19 13519 1 1 28 HIS NE2 N -6.937 5.633 -8.136 1.00 . A A . 32 HIS NE2 1 1 19 13520 1 1 28 HIS O O -10.515 5.918 -3.390 1.00 . A A . 32 HIS O 1 1 19 13521 1 1 29 ILE C C -10.500 6.399 -0.112 1.00 . A A . 33 ILE C 1 1 19 13522 1 1 29 ILE CA C -10.634 5.070 -0.840 1.00 . A A . 33 ILE CA 1 1 19 13523 1 1 29 ILE CB C -10.603 3.915 0.189 1.00 . A A . 33 ILE CB 1 1 19 13524 1 1 29 ILE CD1 C -10.095 1.455 0.529 1.00 . A A . 33 ILE CD1 1 1 19 13525 1 1 29 ILE CG1 C -9.866 2.679 -0.370 1.00 . A A . 33 ILE CG1 1 1 19 13526 1 1 29 ILE CG2 C -12.050 3.543 0.541 1.00 . A A . 33 ILE CG2 1 1 19 13527 1 1 29 ILE H H -8.638 4.487 -1.424 1.00 . A A . 33 ILE H 1 1 19 13528 1 1 29 ILE HA H -11.552 5.042 -1.407 1.00 . A A . 33 ILE HA 1 1 19 13529 1 1 29 ILE HB H -10.102 4.256 1.086 1.00 . A A . 33 ILE HB 1 1 19 13530 1 1 29 ILE HD11 H -11.123 1.138 0.448 1.00 . A A . 33 ILE HD11 1 1 19 13531 1 1 29 ILE HD12 H -9.877 1.715 1.553 1.00 . A A . 33 ILE HD12 1 1 19 13532 1 1 29 ILE HD13 H -9.444 0.652 0.214 1.00 . A A . 33 ILE HD13 1 1 19 13533 1 1 29 ILE HG12 H -10.225 2.472 -1.363 1.00 . A A . 33 ILE HG12 1 1 19 13534 1 1 29 ILE HG13 H -8.807 2.890 -0.409 1.00 . A A . 33 ILE HG13 1 1 19 13535 1 1 29 ILE HG21 H -12.644 4.441 0.614 1.00 . A A . 33 ILE HG21 1 1 19 13536 1 1 29 ILE HG22 H -12.068 3.021 1.486 1.00 . A A . 33 ILE HG22 1 1 19 13537 1 1 29 ILE HG23 H -12.454 2.904 -0.231 1.00 . A A . 33 ILE HG23 1 1 19 13538 1 1 29 ILE N N -9.455 4.915 -1.749 1.00 . A A . 33 ILE N 1 1 19 13539 1 1 29 ILE O O -11.325 7.284 -0.234 1.00 . A A . 33 ILE O 1 1 19 13540 1 1 30 ASP C C -8.264 8.719 0.583 1.00 . A A . 34 ASP C 1 1 19 13541 1 1 30 ASP CA C -9.219 7.816 1.373 1.00 . A A . 34 ASP CA 1 1 19 13542 1 1 30 ASP CB C -8.587 7.398 2.700 1.00 . A A . 34 ASP CB 1 1 19 13543 1 1 30 ASP CG C -9.678 6.895 3.648 1.00 . A A . 34 ASP CG 1 1 19 13544 1 1 30 ASP H H -8.794 5.806 0.698 1.00 . A A . 34 ASP H 1 1 19 13545 1 1 30 ASP HA H -10.155 8.321 1.552 1.00 . A A . 34 ASP HA 1 1 19 13546 1 1 30 ASP HB2 H -7.871 6.608 2.526 1.00 . A A . 34 ASP HB2 1 1 19 13547 1 1 30 ASP HB3 H -8.087 8.245 3.144 1.00 . A A . 34 ASP HB3 1 1 19 13548 1 1 30 ASP N N -9.447 6.542 0.634 1.00 . A A . 34 ASP N 1 1 19 13549 1 1 30 ASP O O -7.703 9.658 1.112 1.00 . A A . 34 ASP O 1 1 19 13550 1 1 30 ASP OD1 O -10.085 5.753 3.499 1.00 . A A . 34 ASP OD1 1 1 19 13551 1 1 30 ASP OD2 O -10.088 7.657 4.507 1.00 . A A . 34 ASP OD2 1 1 19 13552 1 1 31 GLN C C -5.822 9.499 -0.782 1.00 . A A . 35 GLN C 1 1 19 13553 1 1 31 GLN CA C -7.148 9.276 -1.513 1.00 . A A . 35 GLN CA 1 1 19 13554 1 1 31 GLN CB C -7.875 10.606 -1.717 1.00 . A A . 35 GLN CB 1 1 19 13555 1 1 31 GLN CD C -9.806 11.632 -2.927 1.00 . A A . 35 GLN CD 1 1 19 13556 1 1 31 GLN CG C -9.273 10.350 -2.283 1.00 . A A . 35 GLN CG 1 1 19 13557 1 1 31 GLN H H -8.530 7.678 -1.090 1.00 . A A . 35 GLN H 1 1 19 13558 1 1 31 GLN HA H -6.975 8.804 -2.468 1.00 . A A . 35 GLN HA 1 1 19 13559 1 1 31 GLN HB2 H -7.955 11.119 -0.771 1.00 . A A . 35 GLN HB2 1 1 19 13560 1 1 31 GLN HB3 H -7.312 11.216 -2.410 1.00 . A A . 35 GLN HB3 1 1 19 13561 1 1 31 GLN HE21 H -11.361 11.770 -1.698 1.00 . A A . 35 GLN HE21 1 1 19 13562 1 1 31 GLN HE22 H -11.243 13.001 -2.860 1.00 . A A . 35 GLN HE22 1 1 19 13563 1 1 31 GLN HG2 H -9.223 9.569 -3.028 1.00 . A A . 35 GLN HG2 1 1 19 13564 1 1 31 GLN HG3 H -9.934 10.045 -1.486 1.00 . A A . 35 GLN HG3 1 1 19 13565 1 1 31 GLN N N -8.070 8.440 -0.683 1.00 . A A . 35 GLN N 1 1 19 13566 1 1 31 GLN NE2 N -10.894 12.180 -2.455 1.00 . A A . 35 GLN NE2 1 1 19 13567 1 1 31 GLN O O -5.512 10.595 -0.357 1.00 . A A . 35 GLN O 1 1 19 13568 1 1 31 GLN OE1 O -9.227 12.141 -3.865 1.00 . A A . 35 GLN OE1 1 1 19 13569 1 1 32 THR C C -2.696 7.662 -0.515 1.00 . A A . 36 THR C 1 1 19 13570 1 1 32 THR CA C -3.728 8.630 0.068 1.00 . A A . 36 THR CA 1 1 19 13571 1 1 32 THR CB C -4.018 8.287 1.529 1.00 . A A . 36 THR CB 1 1 19 13572 1 1 32 THR CG2 C -4.537 9.531 2.254 1.00 . A A . 36 THR CG2 1 1 19 13573 1 1 32 THR H H -5.303 7.592 -0.989 1.00 . A A . 36 THR H 1 1 19 13574 1 1 32 THR HA H -3.378 9.647 -0.010 1.00 . A A . 36 THR HA 1 1 19 13575 1 1 32 THR HB H -3.113 7.950 2.008 1.00 . A A . 36 THR HB 1 1 19 13576 1 1 32 THR HG1 H -5.845 7.644 1.352 1.00 . A A . 36 THR HG1 1 1 19 13577 1 1 32 THR HG21 H -3.776 10.296 2.245 1.00 . A A . 36 THR HG21 1 1 19 13578 1 1 32 THR HG22 H -4.781 9.277 3.275 1.00 . A A . 36 THR HG22 1 1 19 13579 1 1 32 THR HG23 H -5.421 9.898 1.752 1.00 . A A . 36 THR HG23 1 1 19 13580 1 1 32 THR N N -5.034 8.470 -0.636 1.00 . A A . 36 THR N 1 1 19 13581 1 1 32 THR O O -3.009 6.848 -1.354 1.00 . A A . 36 THR O 1 1 19 13582 1 1 32 THR OG1 O -4.997 7.260 1.588 1.00 . A A . 36 THR OG1 1 1 19 13583 1 1 33 THR C C 0.478 6.321 0.504 1.00 . A A . 37 THR C 1 1 19 13584 1 1 33 THR CA C -0.431 6.815 -0.618 1.00 . A A . 37 THR CA 1 1 19 13585 1 1 33 THR CB C 0.388 7.636 -1.615 1.00 . A A . 37 THR CB 1 1 19 13586 1 1 33 THR CG2 C -0.531 8.280 -2.647 1.00 . A A . 37 THR CG2 1 1 19 13587 1 1 33 THR H H -1.230 8.406 0.601 1.00 . A A . 37 THR H 1 1 19 13588 1 1 33 THR HA H -0.895 5.982 -1.122 1.00 . A A . 37 THR HA 1 1 19 13589 1 1 33 THR HB H 1.087 6.987 -2.119 1.00 . A A . 37 THR HB 1 1 19 13590 1 1 33 THR HG1 H 0.474 9.318 -0.643 1.00 . A A . 37 THR HG1 1 1 19 13591 1 1 33 THR HG21 H -0.638 9.332 -2.429 1.00 . A A . 37 THR HG21 1 1 19 13592 1 1 33 THR HG22 H -1.499 7.805 -2.615 1.00 . A A . 37 THR HG22 1 1 19 13593 1 1 33 THR HG23 H -0.106 8.161 -3.634 1.00 . A A . 37 THR HG23 1 1 19 13594 1 1 33 THR N N -1.469 7.743 -0.079 1.00 . A A . 37 THR N 1 1 19 13595 1 1 33 THR O O 1.102 7.101 1.196 1.00 . A A . 37 THR O 1 1 19 13596 1 1 33 THR OG1 O 1.101 8.646 -0.916 1.00 . A A . 37 THR OG1 1 1 19 13597 1 1 34 THR C C 2.525 3.588 1.111 1.00 . A A . 38 THR C 1 1 19 13598 1 1 34 THR CA C 1.477 4.507 1.744 1.00 . A A . 38 THR CA 1 1 19 13599 1 1 34 THR CB C 0.573 3.738 2.715 1.00 . A A . 38 THR CB 1 1 19 13600 1 1 34 THR CG2 C -0.018 2.513 2.021 1.00 . A A . 38 THR CG2 1 1 19 13601 1 1 34 THR H H 0.080 4.418 0.092 1.00 . A A . 38 THR H 1 1 19 13602 1 1 34 THR HA H 1.962 5.323 2.259 1.00 . A A . 38 THR HA 1 1 19 13603 1 1 34 THR HB H -0.228 4.382 3.043 1.00 . A A . 38 THR HB 1 1 19 13604 1 1 34 THR HG1 H 1.662 4.109 4.284 1.00 . A A . 38 THR HG1 1 1 19 13605 1 1 34 THR HG21 H 0.720 1.725 1.989 1.00 . A A . 38 THR HG21 1 1 19 13606 1 1 34 THR HG22 H -0.305 2.778 1.019 1.00 . A A . 38 THR HG22 1 1 19 13607 1 1 34 THR HG23 H -0.886 2.172 2.568 1.00 . A A . 38 THR HG23 1 1 19 13608 1 1 34 THR N N 0.579 5.035 0.677 1.00 . A A . 38 THR N 1 1 19 13609 1 1 34 THR O O 2.306 3.023 0.061 1.00 . A A . 38 THR O 1 1 19 13610 1 1 34 THR OG1 O 1.337 3.323 3.839 1.00 . A A . 38 THR OG1 1 1 19 13611 1 1 35 TRP C C 4.524 1.123 1.635 1.00 . A A . 39 TRP C 1 1 19 13612 1 1 35 TRP CA C 4.711 2.557 1.132 1.00 . A A . 39 TRP CA 1 1 19 13613 1 1 35 TRP CB C 6.067 3.111 1.606 1.00 . A A . 39 TRP CB 1 1 19 13614 1 1 35 TRP CD1 C 5.638 5.477 2.408 1.00 . A A . 39 TRP CD1 1 1 19 13615 1 1 35 TRP CD2 C 6.697 5.429 0.420 1.00 . A A . 39 TRP CD2 1 1 19 13616 1 1 35 TRP CE2 C 6.523 6.793 0.762 1.00 . A A . 39 TRP CE2 1 1 19 13617 1 1 35 TRP CE3 C 7.344 5.132 -0.796 1.00 . A A . 39 TRP CE3 1 1 19 13618 1 1 35 TRP CG C 6.120 4.610 1.485 1.00 . A A . 39 TRP CG 1 1 19 13619 1 1 35 TRP CH2 C 7.618 7.504 -1.265 1.00 . A A . 39 TRP CH2 1 1 19 13620 1 1 35 TRP CZ2 C 6.975 7.818 -0.066 1.00 . A A . 39 TRP CZ2 1 1 19 13621 1 1 35 TRP CZ3 C 7.800 6.164 -1.629 1.00 . A A . 39 TRP CZ3 1 1 19 13622 1 1 35 TRP H H 3.827 3.902 2.574 1.00 . A A . 39 TRP H 1 1 19 13623 1 1 35 TRP HA H 4.655 2.584 0.055 1.00 . A A . 39 TRP HA 1 1 19 13624 1 1 35 TRP HB2 H 6.219 2.835 2.639 1.00 . A A . 39 TRP HB2 1 1 19 13625 1 1 35 TRP HB3 H 6.853 2.680 1.006 1.00 . A A . 39 TRP HB3 1 1 19 13626 1 1 35 TRP HD1 H 5.143 5.204 3.328 1.00 . A A . 39 TRP HD1 1 1 19 13627 1 1 35 TRP HE1 H 5.620 7.582 2.459 1.00 . A A . 39 TRP HE1 1 1 19 13628 1 1 35 TRP HE3 H 7.485 4.105 -1.094 1.00 . A A . 39 TRP HE3 1 1 19 13629 1 1 35 TRP HH2 H 7.971 8.294 -1.911 1.00 . A A . 39 TRP HH2 1 1 19 13630 1 1 35 TRP HZ2 H 6.831 8.849 0.222 1.00 . A A . 39 TRP HZ2 1 1 19 13631 1 1 35 TRP HZ3 H 8.300 5.923 -2.555 1.00 . A A . 39 TRP HZ3 1 1 19 13632 1 1 35 TRP N N 3.662 3.438 1.728 1.00 . A A . 39 TRP N 1 1 19 13633 1 1 35 TRP NE1 N 5.873 6.769 1.975 1.00 . A A . 39 TRP NE1 1 1 19 13634 1 1 35 TRP O O 4.616 0.174 0.884 1.00 . A A . 39 TRP O 1 1 19 13635 1 1 36 GLN C C 3.669 -0.324 4.938 1.00 . A A . 40 GLN C 1 1 19 13636 1 1 36 GLN CA C 4.063 -0.409 3.461 1.00 . A A . 40 GLN CA 1 1 19 13637 1 1 36 GLN CB C 5.420 -1.100 3.307 1.00 . A A . 40 GLN CB 1 1 19 13638 1 1 36 GLN CD C 5.199 -3.565 3.647 1.00 . A A . 40 GLN CD 1 1 19 13639 1 1 36 GLN CG C 5.231 -2.446 2.605 1.00 . A A . 40 GLN CG 1 1 19 13640 1 1 36 GLN H H 4.188 1.742 3.492 1.00 . A A . 40 GLN H 1 1 19 13641 1 1 36 GLN HA H 3.312 -0.942 2.899 1.00 . A A . 40 GLN HA 1 1 19 13642 1 1 36 GLN HB2 H 6.075 -0.476 2.717 1.00 . A A . 40 GLN HB2 1 1 19 13643 1 1 36 GLN HB3 H 5.855 -1.260 4.282 1.00 . A A . 40 GLN HB3 1 1 19 13644 1 1 36 GLN HE21 H 3.216 -3.679 3.672 1.00 . A A . 40 GLN HE21 1 1 19 13645 1 1 36 GLN HE22 H 4.020 -4.757 4.710 1.00 . A A . 40 GLN HE22 1 1 19 13646 1 1 36 GLN HG2 H 4.299 -2.437 2.057 1.00 . A A . 40 GLN HG2 1 1 19 13647 1 1 36 GLN HG3 H 6.049 -2.613 1.920 1.00 . A A . 40 GLN HG3 1 1 19 13648 1 1 36 GLN N N 4.258 0.961 2.904 1.00 . A A . 40 GLN N 1 1 19 13649 1 1 36 GLN NE2 N 4.050 -4.039 4.042 1.00 . A A . 40 GLN NE2 1 1 19 13650 1 1 36 GLN O O 4.424 0.149 5.764 1.00 . A A . 40 GLN O 1 1 19 13651 1 1 36 GLN OE1 O 6.232 -4.012 4.106 1.00 . A A . 40 GLN OE1 1 1 19 13652 1 1 37 ASP C C 0.663 -1.362 6.863 1.00 . A A . 41 ASP C 1 1 19 13653 1 1 37 ASP CA C 2.053 -0.726 6.705 1.00 . A A . 41 ASP CA 1 1 19 13654 1 1 37 ASP CB C 2.009 0.762 7.064 1.00 . A A . 41 ASP CB 1 1 19 13655 1 1 37 ASP CG C 3.071 1.062 8.124 1.00 . A A . 41 ASP CG 1 1 19 13656 1 1 37 ASP H H 1.901 -1.162 4.598 1.00 . A A . 41 ASP H 1 1 19 13657 1 1 37 ASP HA H 2.767 -1.233 7.335 1.00 . A A . 41 ASP HA 1 1 19 13658 1 1 37 ASP HB2 H 2.207 1.352 6.181 1.00 . A A . 41 ASP HB2 1 1 19 13659 1 1 37 ASP HB3 H 1.033 1.011 7.452 1.00 . A A . 41 ASP HB3 1 1 19 13660 1 1 37 ASP N N 2.494 -0.780 5.278 1.00 . A A . 41 ASP N 1 1 19 13661 1 1 37 ASP O O 0.508 -2.318 7.596 1.00 . A A . 41 ASP O 1 1 19 13662 1 1 37 ASP OD1 O 3.234 0.248 9.018 1.00 . A A . 41 ASP OD1 1 1 19 13663 1 1 37 ASP OD2 O 3.705 2.100 8.023 1.00 . A A . 41 ASP OD2 1 1 19 13664 1 1 38 PRO C C -1.785 -2.702 5.543 1.00 . A A . 42 PRO C 1 1 19 13665 1 1 38 PRO CA C -1.691 -1.352 6.260 1.00 . A A . 42 PRO CA 1 1 19 13666 1 1 38 PRO CB C -2.537 -0.299 5.552 1.00 . A A . 42 PRO CB 1 1 19 13667 1 1 38 PRO CD C -0.229 0.341 5.263 1.00 . A A . 42 PRO CD 1 1 19 13668 1 1 38 PRO CG C -1.592 0.393 4.622 1.00 . A A . 42 PRO CG 1 1 19 13669 1 1 38 PRO HA H -2.000 -1.444 7.289 1.00 . A A . 42 PRO HA 1 1 19 13670 1 1 38 PRO HB2 H -3.335 -0.771 4.996 1.00 . A A . 42 PRO HB2 1 1 19 13671 1 1 38 PRO HB3 H -2.940 0.402 6.267 1.00 . A A . 42 PRO HB3 1 1 19 13672 1 1 38 PRO HD2 H 0.533 0.184 4.515 1.00 . A A . 42 PRO HD2 1 1 19 13673 1 1 38 PRO HD3 H -0.038 1.248 5.816 1.00 . A A . 42 PRO HD3 1 1 19 13674 1 1 38 PRO HG2 H -1.573 -0.119 3.670 1.00 . A A . 42 PRO HG2 1 1 19 13675 1 1 38 PRO HG3 H -1.896 1.420 4.483 1.00 . A A . 42 PRO HG3 1 1 19 13676 1 1 38 PRO N N -0.311 -0.812 6.172 1.00 . A A . 42 PRO N 1 1 19 13677 1 1 38 PRO O O -1.314 -2.861 4.435 1.00 . A A . 42 PRO O 1 1 19 13678 1 1 39 ARG C C -1.140 -5.516 5.075 1.00 . A A . 43 ARG C 1 1 19 13679 1 1 39 ARG CA C -2.514 -5.014 5.524 1.00 . A A . 43 ARG CA 1 1 19 13680 1 1 39 ARG CB C -3.426 -4.789 4.317 1.00 . A A . 43 ARG CB 1 1 19 13681 1 1 39 ARG CD C -5.867 -5.212 4.633 1.00 . A A . 43 ARG CD 1 1 19 13682 1 1 39 ARG CG C -4.521 -5.857 4.299 1.00 . A A . 43 ARG CG 1 1 19 13683 1 1 39 ARG CZ C -6.854 -7.131 5.776 1.00 . A A . 43 ARG CZ 1 1 19 13684 1 1 39 ARG H H -2.762 -3.525 7.063 1.00 . A A . 43 ARG H 1 1 19 13685 1 1 39 ARG HA H -2.970 -5.718 6.202 1.00 . A A . 43 ARG HA 1 1 19 13686 1 1 39 ARG HB2 H -3.877 -3.810 4.385 1.00 . A A . 43 ARG HB2 1 1 19 13687 1 1 39 ARG HB3 H -2.844 -4.855 3.409 1.00 . A A . 43 ARG HB3 1 1 19 13688 1 1 39 ARG HD2 H -5.740 -4.160 4.838 1.00 . A A . 43 ARG HD2 1 1 19 13689 1 1 39 ARG HD3 H -6.565 -5.355 3.821 1.00 . A A . 43 ARG HD3 1 1 19 13690 1 1 39 ARG HE H -6.266 -5.489 6.729 1.00 . A A . 43 ARG HE 1 1 19 13691 1 1 39 ARG HG2 H -4.570 -6.305 3.316 1.00 . A A . 43 ARG HG2 1 1 19 13692 1 1 39 ARG HG3 H -4.295 -6.618 5.030 1.00 . A A . 43 ARG HG3 1 1 19 13693 1 1 39 ARG HH11 H -6.658 -7.302 3.783 1.00 . A A . 43 ARG HH11 1 1 19 13694 1 1 39 ARG HH12 H -7.359 -8.664 4.584 1.00 . A A . 43 ARG HH12 1 1 19 13695 1 1 39 ARG HH21 H -7.179 -7.270 7.746 1.00 . A A . 43 ARG HH21 1 1 19 13696 1 1 39 ARG HH22 H -7.653 -8.648 6.811 1.00 . A A . 43 ARG HH22 1 1 19 13697 1 1 39 ARG N N -2.389 -3.676 6.168 1.00 . A A . 43 ARG N 1 1 19 13698 1 1 39 ARG NE N -6.341 -5.926 5.855 1.00 . A A . 43 ARG NE 1 1 19 13699 1 1 39 ARG NH1 N -6.964 -7.745 4.622 1.00 . A A . 43 ARG NH1 1 1 19 13700 1 1 39 ARG NH2 N -7.260 -7.731 6.863 1.00 . A A . 43 ARG NH2 1 1 19 13701 1 1 39 ARG O O -0.803 -5.473 3.909 1.00 . A A . 43 ARG O 1 1 19 13702 1 1 40 LYS C C 0.892 -7.819 4.861 1.00 . A A . 44 LYS C 1 1 19 13703 1 1 40 LYS CA C 1.010 -6.493 5.618 1.00 . A A . 44 LYS CA 1 1 19 13704 1 1 40 LYS CB C 1.740 -6.698 6.946 1.00 . A A . 44 LYS CB 1 1 19 13705 1 1 40 LYS CD C 3.430 -5.713 8.500 1.00 . A A . 44 LYS CD 1 1 19 13706 1 1 40 LYS CE C 3.321 -4.334 9.154 1.00 . A A . 44 LYS CE 1 1 19 13707 1 1 40 LYS CG C 2.849 -5.654 7.085 1.00 . A A . 44 LYS CG 1 1 19 13708 1 1 40 LYS H H -0.632 -6.015 6.928 1.00 . A A . 44 LYS H 1 1 19 13709 1 1 40 LYS HA H 1.532 -5.764 5.020 1.00 . A A . 44 LYS HA 1 1 19 13710 1 1 40 LYS HB2 H 1.039 -6.589 7.761 1.00 . A A . 44 LYS HB2 1 1 19 13711 1 1 40 LYS HB3 H 2.170 -7.687 6.972 1.00 . A A . 44 LYS HB3 1 1 19 13712 1 1 40 LYS HD2 H 2.880 -6.434 9.085 1.00 . A A . 44 LYS HD2 1 1 19 13713 1 1 40 LYS HD3 H 4.469 -6.006 8.450 1.00 . A A . 44 LYS HD3 1 1 19 13714 1 1 40 LYS HE2 H 4.222 -4.106 9.703 1.00 . A A . 44 LYS HE2 1 1 19 13715 1 1 40 LYS HE3 H 3.132 -3.578 8.406 1.00 . A A . 44 LYS HE3 1 1 19 13716 1 1 40 LYS HG2 H 3.629 -5.860 6.368 1.00 . A A . 44 LYS HG2 1 1 19 13717 1 1 40 LYS HG3 H 2.444 -4.670 6.903 1.00 . A A . 44 LYS HG3 1 1 19 13718 1 1 40 LYS HZ1 H 2.253 -5.309 10.653 1.00 . A A . 44 LYS HZ1 1 1 19 13719 1 1 40 LYS HZ2 H 1.278 -4.484 9.533 1.00 . A A . 44 LYS HZ2 1 1 19 13720 1 1 40 LYS HZ3 H 2.140 -3.618 10.713 1.00 . A A . 44 LYS HZ3 1 1 19 13721 1 1 40 LYS N N -0.342 -5.990 5.992 1.00 . A A . 44 LYS N 1 1 19 13722 1 1 40 LYS NZ N 2.160 -4.445 10.084 1.00 . A A . 44 LYS NZ 1 1 19 13723 1 1 40 LYS O O 0.808 -7.778 3.645 1.00 . A A . 44 LYS O 1 1 19 13724 1 1 40 LYS OXT O 0.885 -8.851 5.512 1.00 . A A . 44 LYS OXT 1 1 19 13725 2 2 1 ACE C C 8.564 10.294 4.927 1.00 . B B . 45 ACE C 1 1 19 13726 2 2 1 ACE CH3 C 9.445 11.364 5.573 1.00 . B B . 45 ACE CH3 1 1 19 13727 2 2 1 ACE H1 H 8.982 11.708 6.488 1.00 . B B . 45 ACE H1 1 1 19 13728 2 2 1 ACE H2 H 9.560 12.194 4.894 1.00 . B B . 45 ACE H2 1 1 19 13729 2 2 1 ACE H3 H 10.415 10.945 5.798 1.00 . B B . 45 ACE H3 1 1 19 13730 2 2 1 ACE O O 7.746 9.681 5.586 1.00 . B B . 45 ACE O 1 1 19 13731 2 2 2 PRO C C 6.763 10.272 2.198 1.00 . B B . 46 PRO C 1 1 19 13732 2 2 2 PRO CA C 8.044 10.964 2.674 1.00 . B B . 46 PRO CA 1 1 19 13733 2 2 2 PRO CB C 9.034 11.123 1.524 1.00 . B B . 46 PRO CB 1 1 19 13734 2 2 2 PRO CD C 9.983 9.534 3.063 1.00 . B B . 46 PRO CD 1 1 19 13735 2 2 2 PRO CG C 9.918 9.925 1.611 1.00 . B B . 46 PRO CG 1 1 19 13736 2 2 2 PRO HA H 7.820 11.927 3.105 1.00 . B B . 46 PRO HA 1 1 19 13737 2 2 2 PRO HB2 H 8.509 11.139 0.578 1.00 . B B . 46 PRO HB2 1 1 19 13738 2 2 2 PRO HB3 H 9.615 12.022 1.649 1.00 . B B . 46 PRO HB3 1 1 19 13739 2 2 2 PRO HD2 H 9.986 8.457 3.163 1.00 . B B . 46 PRO HD2 1 1 19 13740 2 2 2 PRO HD3 H 10.856 9.961 3.532 1.00 . B B . 46 PRO HD3 1 1 19 13741 2 2 2 PRO HG2 H 9.502 9.117 1.025 1.00 . B B . 46 PRO HG2 1 1 19 13742 2 2 2 PRO HG3 H 10.907 10.170 1.257 1.00 . B B . 46 PRO HG3 1 1 19 13743 2 2 2 PRO N N 8.763 10.106 3.651 1.00 . B B . 46 PRO N 1 1 19 13744 2 2 2 PRO O O 6.473 9.154 2.575 1.00 . B B . 46 PRO O 1 1 19 13745 2 2 3 LEU C C 4.078 11.221 -0.178 1.00 . B B . 47 LEU C 1 1 19 13746 2 2 3 LEU CA C 4.736 10.308 0.869 1.00 . B B . 47 LEU CA 1 1 19 13747 2 2 3 LEU CB C 3.845 10.181 2.105 1.00 . B B . 47 LEU CB 1 1 19 13748 2 2 3 LEU CD1 C 3.206 7.835 2.679 1.00 . B B . 47 LEU CD1 1 1 19 13749 2 2 3 LEU CD2 C 1.436 9.564 2.343 1.00 . B B . 47 LEU CD2 1 1 19 13750 2 2 3 LEU CG C 2.809 9.076 1.878 1.00 . B B . 47 LEU CG 1 1 19 13751 2 2 3 LEU H H 6.249 11.829 1.076 1.00 . B B . 47 LEU H 1 1 19 13752 2 2 3 LEU HA H 4.936 9.332 0.457 1.00 . B B . 47 LEU HA 1 1 19 13753 2 2 3 LEU HB2 H 4.453 9.932 2.962 1.00 . B B . 47 LEU HB2 1 1 19 13754 2 2 3 LEU HB3 H 3.339 11.117 2.282 1.00 . B B . 47 LEU HB3 1 1 19 13755 2 2 3 LEU HD11 H 3.957 8.099 3.407 1.00 . B B . 47 LEU HD11 1 1 19 13756 2 2 3 LEU HD12 H 3.603 7.086 2.008 1.00 . B B . 47 LEU HD12 1 1 19 13757 2 2 3 LEU HD13 H 2.337 7.439 3.184 1.00 . B B . 47 LEU HD13 1 1 19 13758 2 2 3 LEU HD21 H 0.854 9.872 1.486 1.00 . B B . 47 LEU HD21 1 1 19 13759 2 2 3 LEU HD22 H 1.558 10.401 3.013 1.00 . B B . 47 LEU HD22 1 1 19 13760 2 2 3 LEU HD23 H 0.923 8.763 2.854 1.00 . B B . 47 LEU HD23 1 1 19 13761 2 2 3 LEU HG H 2.769 8.830 0.828 1.00 . B B . 47 LEU HG 1 1 19 13762 2 2 3 LEU N N 5.997 10.927 1.369 1.00 . B B . 47 LEU N 1 1 19 13763 2 2 3 LEU O O 3.900 12.399 0.065 1.00 . B B . 47 LEU O 1 1 19 13764 2 2 4 PRO C C 1.656 11.819 -2.006 1.00 . B B . 48 PRO C 1 1 19 13765 2 2 4 PRO CA C 3.098 11.456 -2.391 1.00 . B B . 48 PRO CA 1 1 19 13766 2 2 4 PRO CB C 3.121 10.521 -3.597 1.00 . B B . 48 PRO CB 1 1 19 13767 2 2 4 PRO CD C 3.910 9.250 -1.706 1.00 . B B . 48 PRO CD 1 1 19 13768 2 2 4 PRO CG C 3.175 9.144 -3.016 1.00 . B B . 48 PRO CG 1 1 19 13769 2 2 4 PRO HA H 3.676 12.341 -2.599 1.00 . B B . 48 PRO HA 1 1 19 13770 2 2 4 PRO HB2 H 2.224 10.644 -4.186 1.00 . B B . 48 PRO HB2 1 1 19 13771 2 2 4 PRO HB3 H 3.996 10.707 -4.201 1.00 . B B . 48 PRO HB3 1 1 19 13772 2 2 4 PRO HD2 H 3.467 8.594 -0.970 1.00 . B B . 48 PRO HD2 1 1 19 13773 2 2 4 PRO HD3 H 4.956 9.017 -1.839 1.00 . B B . 48 PRO HD3 1 1 19 13774 2 2 4 PRO HG2 H 2.173 8.776 -2.848 1.00 . B B . 48 PRO HG2 1 1 19 13775 2 2 4 PRO HG3 H 3.705 8.482 -3.684 1.00 . B B . 48 PRO HG3 1 1 19 13776 2 2 4 PRO N N 3.738 10.657 -1.315 1.00 . B B . 48 PRO N 1 1 19 13777 2 2 4 PRO O O 0.931 10.991 -1.493 1.00 . B B . 48 PRO O 1 1 19 13778 2 2 5 PRO C C -1.107 12.912 -2.924 1.00 . B B . 49 PRO C 1 1 19 13779 2 2 5 PRO CA C -0.096 13.501 -1.934 1.00 . B B . 49 PRO CA 1 1 19 13780 2 2 5 PRO CB C -0.021 15.017 -2.078 1.00 . B B . 49 PRO CB 1 1 19 13781 2 2 5 PRO CD C 2.076 14.122 -2.881 1.00 . B B . 49 PRO CD 1 1 19 13782 2 2 5 PRO CG C 1.105 15.263 -3.031 1.00 . B B . 49 PRO CG 1 1 19 13783 2 2 5 PRO HA H -0.351 13.236 -0.922 1.00 . B B . 49 PRO HA 1 1 19 13784 2 2 5 PRO HB2 H -0.946 15.402 -2.481 1.00 . B B . 49 PRO HB2 1 1 19 13785 2 2 5 PRO HB3 H 0.190 15.474 -1.121 1.00 . B B . 49 PRO HB3 1 1 19 13786 2 2 5 PRO HD2 H 2.447 13.810 -3.847 1.00 . B B . 49 PRO HD2 1 1 19 13787 2 2 5 PRO HD3 H 2.894 14.401 -2.234 1.00 . B B . 49 PRO HD3 1 1 19 13788 2 2 5 PRO HG2 H 0.730 15.298 -4.043 1.00 . B B . 49 PRO HG2 1 1 19 13789 2 2 5 PRO HG3 H 1.594 16.196 -2.790 1.00 . B B . 49 PRO HG3 1 1 19 13790 2 2 5 PRO N N 1.279 13.049 -2.267 1.00 . B B . 49 PRO N 1 1 19 13791 2 2 5 PRO O O -0.839 12.793 -4.102 1.00 . B B . 49 PRO O 1 1 19 13792 2 2 6 TYR C C -4.698 12.398 -2.925 1.00 . B B . 50 TYR C 1 1 19 13793 2 2 6 TYR CA C -3.296 11.970 -3.367 1.00 . B B . 50 TYR CA 1 1 19 13794 2 2 6 TYR CB C -3.135 10.455 -3.247 1.00 . B B . 50 TYR CB 1 1 19 13795 2 2 6 TYR CD1 C -3.754 10.090 -5.661 1.00 . B B . 50 TYR CD1 1 1 19 13796 2 2 6 TYR CD2 C -4.935 8.836 -3.955 1.00 . B B . 50 TYR CD2 1 1 19 13797 2 2 6 TYR CE1 C -4.520 9.464 -6.652 1.00 . B B . 50 TYR CE1 1 1 19 13798 2 2 6 TYR CE2 C -5.701 8.211 -4.945 1.00 . B B . 50 TYR CE2 1 1 19 13799 2 2 6 TYR CG C -3.961 9.777 -4.313 1.00 . B B . 50 TYR CG 1 1 19 13800 2 2 6 TYR CZ C -5.494 8.524 -6.295 1.00 . B B . 50 TYR CZ 1 1 19 13801 2 2 6 TYR H H -2.466 12.654 -1.499 1.00 . B B . 50 TYR H 1 1 19 13802 2 2 6 TYR HA H -3.111 12.281 -4.384 1.00 . B B . 50 TYR HA 1 1 19 13803 2 2 6 TYR HB2 H -2.095 10.193 -3.375 1.00 . B B . 50 TYR HB2 1 1 19 13804 2 2 6 TYR HB3 H -3.471 10.133 -2.272 1.00 . B B . 50 TYR HB3 1 1 19 13805 2 2 6 TYR HD1 H -3.001 10.813 -5.938 1.00 . B B . 50 TYR HD1 1 1 19 13806 2 2 6 TYR HD2 H -5.093 8.591 -2.916 1.00 . B B . 50 TYR HD2 1 1 19 13807 2 2 6 TYR HE1 H -4.361 9.707 -7.692 1.00 . B B . 50 TYR HE1 1 1 19 13808 2 2 6 TYR HE2 H -6.452 7.486 -4.669 1.00 . B B . 50 TYR HE2 1 1 19 13809 2 2 6 TYR HH H -5.746 7.920 -8.087 1.00 . B B . 50 TYR HH 1 1 19 13810 2 2 6 TYR N N -2.269 12.547 -2.453 1.00 . B B . 50 TYR N 1 1 19 13811 2 2 6 TYR O O -5.645 12.059 -3.614 1.00 . B B . 50 TYR O 1 1 19 13812 2 2 6 TYR OXT O -4.800 13.058 -1.902 1.00 . B B . 50 TYR OXT 1 1 19 13813 2 2 6 TYR OH O -6.249 7.909 -7.271 1.00 . B B . 50 TYR OH 1 1 20 13814 1 1 1 PHE C C 2.685 -11.672 7.440 1.00 . A A . 5 PHE C 1 1 20 13815 1 1 1 PHE CA C 1.734 -10.860 8.325 1.00 . A A . 5 PHE CA 1 1 20 13816 1 1 1 PHE CB C 0.581 -10.297 7.496 1.00 . A A . 5 PHE CB 1 1 20 13817 1 1 1 PHE CD1 C -0.789 -9.973 9.587 1.00 . A A . 5 PHE CD1 1 1 20 13818 1 1 1 PHE CD2 C -1.826 -11.026 7.664 1.00 . A A . 5 PHE CD2 1 1 20 13819 1 1 1 PHE CE1 C -1.985 -10.101 10.303 1.00 . A A . 5 PHE CE1 1 1 20 13820 1 1 1 PHE CE2 C -3.022 -11.155 8.380 1.00 . A A . 5 PHE CE2 1 1 20 13821 1 1 1 PHE CG C -0.710 -10.435 8.268 1.00 . A A . 5 PHE CG 1 1 20 13822 1 1 1 PHE CZ C -3.101 -10.693 9.699 1.00 . A A . 5 PHE CZ 1 1 20 13823 1 1 1 PHE HA H 1.349 -11.472 9.125 1.00 . A A . 5 PHE HA 1 1 20 13824 1 1 1 PHE HB2 H 0.765 -9.253 7.286 1.00 . A A . 5 PHE HB2 1 1 20 13825 1 1 1 PHE HB3 H 0.504 -10.842 6.567 1.00 . A A . 5 PHE HB3 1 1 20 13826 1 1 1 PHE HD1 H 0.072 -9.518 10.053 1.00 . A A . 5 PHE HD1 1 1 20 13827 1 1 1 PHE HD2 H -1.764 -11.383 6.647 1.00 . A A . 5 PHE HD2 1 1 20 13828 1 1 1 PHE HE1 H -2.047 -9.745 11.320 1.00 . A A . 5 PHE HE1 1 1 20 13829 1 1 1 PHE HE2 H -3.884 -11.611 7.915 1.00 . A A . 5 PHE HE2 1 1 20 13830 1 1 1 PHE HZ H -4.024 -10.792 10.253 1.00 . A A . 5 PHE HZ 1 1 20 13831 1 1 1 PHE N N 2.437 -9.664 8.875 1.00 . A A . 5 PHE N 1 1 20 13832 1 1 1 PHE O O 3.889 -11.505 7.488 1.00 . A A . 5 PHE O 1 1 20 13833 1 1 2 GLU C C 2.263 -13.795 4.492 1.00 . A A . 6 GLU C 1 1 20 13834 1 1 2 GLU CA C 3.030 -13.371 5.748 1.00 . A A . 6 GLU CA 1 1 20 13835 1 1 2 GLU CB C 3.406 -14.593 6.584 1.00 . A A . 6 GLU CB 1 1 20 13836 1 1 2 GLU CD C 5.491 -15.707 7.393 1.00 . A A . 6 GLU CD 1 1 20 13837 1 1 2 GLU CG C 4.801 -15.079 6.182 1.00 . A A . 6 GLU CG 1 1 20 13838 1 1 2 GLU H H 1.184 -12.669 6.609 1.00 . A A . 6 GLU H 1 1 20 13839 1 1 2 GLU HA H 3.918 -12.821 5.478 1.00 . A A . 6 GLU HA 1 1 20 13840 1 1 2 GLU HB2 H 3.407 -14.326 7.630 1.00 . A A . 6 GLU HB2 1 1 20 13841 1 1 2 GLU HB3 H 2.687 -15.381 6.414 1.00 . A A . 6 GLU HB3 1 1 20 13842 1 1 2 GLU HG2 H 4.712 -15.815 5.396 1.00 . A A . 6 GLU HG2 1 1 20 13843 1 1 2 GLU HG3 H 5.384 -14.242 5.827 1.00 . A A . 6 GLU HG3 1 1 20 13844 1 1 2 GLU N N 2.156 -12.550 6.633 1.00 . A A . 6 GLU N 1 1 20 13845 1 1 2 GLU O O 2.299 -14.939 4.088 1.00 . A A . 6 GLU O 1 1 20 13846 1 1 2 GLU OE1 O 6.019 -14.960 8.202 1.00 . A A . 6 GLU OE1 1 1 20 13847 1 1 2 GLU OE2 O 5.483 -16.923 7.491 1.00 . A A . 6 GLU OE2 1 1 20 13848 1 1 3 ILE C C -0.125 -14.424 2.919 1.00 . A A . 7 ILE C 1 1 20 13849 1 1 3 ILE CA C 0.796 -13.230 2.644 1.00 . A A . 7 ILE CA 1 1 20 13850 1 1 3 ILE CB C 1.856 -13.598 1.605 1.00 . A A . 7 ILE CB 1 1 20 13851 1 1 3 ILE CD1 C 2.070 -11.189 0.981 1.00 . A A . 7 ILE CD1 1 1 20 13852 1 1 3 ILE CG1 C 2.833 -12.432 1.438 1.00 . A A . 7 ILE CG1 1 1 20 13853 1 1 3 ILE CG2 C 1.178 -13.887 0.265 1.00 . A A . 7 ILE CG2 1 1 20 13854 1 1 3 ILE H H 1.551 -11.961 4.215 1.00 . A A . 7 ILE H 1 1 20 13855 1 1 3 ILE HA H 0.226 -12.381 2.303 1.00 . A A . 7 ILE HA 1 1 20 13856 1 1 3 ILE HB H 2.393 -14.476 1.933 1.00 . A A . 7 ILE HB 1 1 20 13857 1 1 3 ILE HD11 H 2.091 -10.445 1.764 1.00 . A A . 7 ILE HD11 1 1 20 13858 1 1 3 ILE HD12 H 1.046 -11.453 0.763 1.00 . A A . 7 ILE HD12 1 1 20 13859 1 1 3 ILE HD13 H 2.535 -10.788 0.092 1.00 . A A . 7 ILE HD13 1 1 20 13860 1 1 3 ILE HG12 H 3.317 -12.232 2.383 1.00 . A A . 7 ILE HG12 1 1 20 13861 1 1 3 ILE HG13 H 3.579 -12.690 0.701 1.00 . A A . 7 ILE HG13 1 1 20 13862 1 1 3 ILE HG21 H 1.918 -13.884 -0.521 1.00 . A A . 7 ILE HG21 1 1 20 13863 1 1 3 ILE HG22 H 0.437 -13.127 0.065 1.00 . A A . 7 ILE HG22 1 1 20 13864 1 1 3 ILE HG23 H 0.699 -14.855 0.304 1.00 . A A . 7 ILE HG23 1 1 20 13865 1 1 3 ILE N N 1.567 -12.879 3.872 1.00 . A A . 7 ILE N 1 1 20 13866 1 1 3 ILE O O 0.302 -15.560 2.855 1.00 . A A . 7 ILE O 1 1 20 13867 1 1 4 PRO C C -2.715 -15.962 2.215 1.00 . A A . 8 PRO C 1 1 20 13868 1 1 4 PRO CA C -2.350 -15.207 3.502 1.00 . A A . 8 PRO CA 1 1 20 13869 1 1 4 PRO CB C -3.552 -14.458 4.076 1.00 . A A . 8 PRO CB 1 1 20 13870 1 1 4 PRO CD C -1.972 -12.793 3.316 1.00 . A A . 8 PRO CD 1 1 20 13871 1 1 4 PRO CG C -3.438 -13.065 3.537 1.00 . A A . 8 PRO CG 1 1 20 13872 1 1 4 PRO HA H -1.957 -15.888 4.239 1.00 . A A . 8 PRO HA 1 1 20 13873 1 1 4 PRO HB2 H -4.471 -14.915 3.743 1.00 . A A . 8 PRO HB2 1 1 20 13874 1 1 4 PRO HB3 H -3.505 -14.447 5.153 1.00 . A A . 8 PRO HB3 1 1 20 13875 1 1 4 PRO HD2 H -1.825 -12.241 2.399 1.00 . A A . 8 PRO HD2 1 1 20 13876 1 1 4 PRO HD3 H -1.558 -12.251 4.154 1.00 . A A . 8 PRO HD3 1 1 20 13877 1 1 4 PRO HG2 H -3.973 -12.983 2.604 1.00 . A A . 8 PRO HG2 1 1 20 13878 1 1 4 PRO HG3 H -3.839 -12.362 4.253 1.00 . A A . 8 PRO HG3 1 1 20 13879 1 1 4 PRO N N -1.369 -14.131 3.217 1.00 . A A . 8 PRO N 1 1 20 13880 1 1 4 PRO O O -2.109 -16.962 1.884 1.00 . A A . 8 PRO O 1 1 20 13881 1 1 5 ASP C C -3.320 -15.612 -0.964 1.00 . A A . 9 ASP C 1 1 20 13882 1 1 5 ASP CA C -4.080 -16.203 0.227 1.00 . A A . 9 ASP CA 1 1 20 13883 1 1 5 ASP CB C -5.581 -15.956 0.079 1.00 . A A . 9 ASP CB 1 1 20 13884 1 1 5 ASP CG C -6.287 -17.280 -0.229 1.00 . A A . 9 ASP CG 1 1 20 13885 1 1 5 ASP H H -4.176 -14.693 1.757 1.00 . A A . 9 ASP H 1 1 20 13886 1 1 5 ASP HA H -3.887 -17.260 0.312 1.00 . A A . 9 ASP HA 1 1 20 13887 1 1 5 ASP HB2 H -5.971 -15.547 0.999 1.00 . A A . 9 ASP HB2 1 1 20 13888 1 1 5 ASP HB3 H -5.755 -15.260 -0.727 1.00 . A A . 9 ASP HB3 1 1 20 13889 1 1 5 ASP N N -3.695 -15.499 1.483 1.00 . A A . 9 ASP N 1 1 20 13890 1 1 5 ASP O O -2.537 -16.284 -1.608 1.00 . A A . 9 ASP O 1 1 20 13891 1 1 5 ASP OD1 O -5.834 -17.976 -1.121 1.00 . A A . 9 ASP OD1 1 1 20 13892 1 1 5 ASP OD2 O -7.268 -17.572 0.434 1.00 . A A . 9 ASP OD2 1 1 20 13893 1 1 6 ASP C C -3.101 -12.222 -2.435 1.00 . A A . 10 ASP C 1 1 20 13894 1 1 6 ASP CA C -2.833 -13.731 -2.411 1.00 . A A . 10 ASP CA 1 1 20 13895 1 1 6 ASP CB C -3.420 -14.399 -3.656 1.00 . A A . 10 ASP CB 1 1 20 13896 1 1 6 ASP CG C -2.439 -14.258 -4.821 1.00 . A A . 10 ASP CG 1 1 20 13897 1 1 6 ASP H H -4.178 -13.837 -0.731 1.00 . A A . 10 ASP H 1 1 20 13898 1 1 6 ASP HA H -1.774 -13.925 -2.354 1.00 . A A . 10 ASP HA 1 1 20 13899 1 1 6 ASP HB2 H -3.592 -15.445 -3.453 1.00 . A A . 10 ASP HB2 1 1 20 13900 1 1 6 ASP HB3 H -4.355 -13.924 -3.911 1.00 . A A . 10 ASP HB3 1 1 20 13901 1 1 6 ASP N N -3.543 -14.363 -1.262 1.00 . A A . 10 ASP N 1 1 20 13902 1 1 6 ASP O O -2.191 -11.420 -2.369 1.00 . A A . 10 ASP O 1 1 20 13903 1 1 6 ASP OD1 O -1.257 -14.466 -4.603 1.00 . A A . 10 ASP OD1 1 1 20 13904 1 1 6 ASP OD2 O -2.886 -13.945 -5.912 1.00 . A A . 10 ASP OD2 1 1 20 13905 1 1 7 VAL C C -4.029 -9.670 -1.351 1.00 . A A . 11 VAL C 1 1 20 13906 1 1 7 VAL CA C -4.667 -10.378 -2.557 1.00 . A A . 11 VAL CA 1 1 20 13907 1 1 7 VAL CB C -6.191 -10.312 -2.470 1.00 . A A . 11 VAL CB 1 1 20 13908 1 1 7 VAL CG1 C -6.634 -8.850 -2.394 1.00 . A A . 11 VAL CG1 1 1 20 13909 1 1 7 VAL CG2 C -6.800 -10.967 -3.710 1.00 . A A . 11 VAL CG2 1 1 20 13910 1 1 7 VAL H H -5.062 -12.495 -2.583 1.00 . A A . 11 VAL H 1 1 20 13911 1 1 7 VAL HA H -4.333 -9.937 -3.481 1.00 . A A . 11 VAL HA 1 1 20 13912 1 1 7 VAL HB H -6.523 -10.836 -1.585 1.00 . A A . 11 VAL HB 1 1 20 13913 1 1 7 VAL HG11 H -7.507 -8.706 -3.014 1.00 . A A . 11 VAL HG11 1 1 20 13914 1 1 7 VAL HG12 H -5.835 -8.212 -2.744 1.00 . A A . 11 VAL HG12 1 1 20 13915 1 1 7 VAL HG13 H -6.872 -8.597 -1.371 1.00 . A A . 11 VAL HG13 1 1 20 13916 1 1 7 VAL HG21 H -7.849 -10.718 -3.770 1.00 . A A . 11 VAL HG21 1 1 20 13917 1 1 7 VAL HG22 H -6.687 -12.038 -3.644 1.00 . A A . 11 VAL HG22 1 1 20 13918 1 1 7 VAL HG23 H -6.294 -10.606 -4.593 1.00 . A A . 11 VAL HG23 1 1 20 13919 1 1 7 VAL N N -4.342 -11.833 -2.529 1.00 . A A . 11 VAL N 1 1 20 13920 1 1 7 VAL O O -4.388 -9.943 -0.223 1.00 . A A . 11 VAL O 1 1 20 13921 1 1 8 PRO C C -3.360 -6.990 0.077 1.00 . A A . 12 PRO C 1 1 20 13922 1 1 8 PRO CA C -2.424 -8.049 -0.523 1.00 . A A . 12 PRO CA 1 1 20 13923 1 1 8 PRO CB C -1.216 -7.409 -1.205 1.00 . A A . 12 PRO CB 1 1 20 13924 1 1 8 PRO CD C -2.595 -8.384 -2.943 1.00 . A A . 12 PRO CD 1 1 20 13925 1 1 8 PRO CG C -1.591 -7.297 -2.651 1.00 . A A . 12 PRO CG 1 1 20 13926 1 1 8 PRO HA H -2.093 -8.735 0.240 1.00 . A A . 12 PRO HA 1 1 20 13927 1 1 8 PRO HB2 H -1.026 -6.431 -0.790 1.00 . A A . 12 PRO HB2 1 1 20 13928 1 1 8 PRO HB3 H -0.347 -8.040 -1.093 1.00 . A A . 12 PRO HB3 1 1 20 13929 1 1 8 PRO HD2 H -3.400 -8.000 -3.552 1.00 . A A . 12 PRO HD2 1 1 20 13930 1 1 8 PRO HD3 H -2.118 -9.219 -3.433 1.00 . A A . 12 PRO HD3 1 1 20 13931 1 1 8 PRO HG2 H -2.030 -6.330 -2.844 1.00 . A A . 12 PRO HG2 1 1 20 13932 1 1 8 PRO HG3 H -0.716 -7.433 -3.268 1.00 . A A . 12 PRO HG3 1 1 20 13933 1 1 8 PRO N N -3.099 -8.783 -1.620 1.00 . A A . 12 PRO N 1 1 20 13934 1 1 8 PRO O O -4.057 -7.246 1.039 1.00 . A A . 12 PRO O 1 1 20 13935 1 1 9 LEU C C -5.737 -5.021 -0.338 1.00 . A A . 13 LEU C 1 1 20 13936 1 1 9 LEU CA C -4.284 -4.750 0.076 1.00 . A A . 13 LEU CA 1 1 20 13937 1 1 9 LEU CB C -3.780 -3.443 -0.541 1.00 . A A . 13 LEU CB 1 1 20 13938 1 1 9 LEU CD1 C -1.347 -3.830 -0.109 1.00 . A A . 13 LEU CD1 1 1 20 13939 1 1 9 LEU CD2 C -2.254 -1.503 -0.146 1.00 . A A . 13 LEU CD2 1 1 20 13940 1 1 9 LEU CG C -2.554 -2.953 0.235 1.00 . A A . 13 LEU CG 1 1 20 13941 1 1 9 LEU H H -2.823 -5.611 -1.249 1.00 . A A . 13 LEU H 1 1 20 13942 1 1 9 LEU HA H -4.199 -4.707 1.149 1.00 . A A . 13 LEU HA 1 1 20 13943 1 1 9 LEU HB2 H -3.509 -3.613 -1.572 1.00 . A A . 13 LEU HB2 1 1 20 13944 1 1 9 LEU HB3 H -4.560 -2.698 -0.490 1.00 . A A . 13 LEU HB3 1 1 20 13945 1 1 9 LEU HD11 H -1.282 -4.646 0.596 1.00 . A A . 13 LEU HD11 1 1 20 13946 1 1 9 LEU HD12 H -0.445 -3.237 -0.057 1.00 . A A . 13 LEU HD12 1 1 20 13947 1 1 9 LEU HD13 H -1.460 -4.225 -1.107 1.00 . A A . 13 LEU HD13 1 1 20 13948 1 1 9 LEU HD21 H -2.471 -1.353 -1.193 1.00 . A A . 13 LEU HD21 1 1 20 13949 1 1 9 LEU HD22 H -1.211 -1.291 0.038 1.00 . A A . 13 LEU HD22 1 1 20 13950 1 1 9 LEU HD23 H -2.866 -0.841 0.448 1.00 . A A . 13 LEU HD23 1 1 20 13951 1 1 9 LEU HG H -2.752 -3.014 1.295 1.00 . A A . 13 LEU HG 1 1 20 13952 1 1 9 LEU N N -3.388 -5.807 -0.476 1.00 . A A . 13 LEU N 1 1 20 13953 1 1 9 LEU O O -5.984 -5.781 -1.253 1.00 . A A . 13 LEU O 1 1 20 13954 1 1 10 PRO C C -8.466 -3.885 -1.268 1.00 . A A . 14 PRO C 1 1 20 13955 1 1 10 PRO CA C -8.098 -4.582 0.045 1.00 . A A . 14 PRO CA 1 1 20 13956 1 1 10 PRO CB C -8.810 -3.934 1.229 1.00 . A A . 14 PRO CB 1 1 20 13957 1 1 10 PRO CD C -6.455 -3.457 1.473 1.00 . A A . 14 PRO CD 1 1 20 13958 1 1 10 PRO CG C -7.837 -2.934 1.766 1.00 . A A . 14 PRO CG 1 1 20 13959 1 1 10 PRO HA H -8.340 -5.632 0.000 1.00 . A A . 14 PRO HA 1 1 20 13960 1 1 10 PRO HB2 H -9.712 -3.441 0.897 1.00 . A A . 14 PRO HB2 1 1 20 13961 1 1 10 PRO HB3 H -9.040 -4.676 1.979 1.00 . A A . 14 PRO HB3 1 1 20 13962 1 1 10 PRO HD2 H -5.799 -2.652 1.177 1.00 . A A . 14 PRO HD2 1 1 20 13963 1 1 10 PRO HD3 H -6.056 -3.976 2.332 1.00 . A A . 14 PRO HD3 1 1 20 13964 1 1 10 PRO HG2 H -7.981 -1.981 1.279 1.00 . A A . 14 PRO HG2 1 1 20 13965 1 1 10 PRO HG3 H -7.971 -2.827 2.832 1.00 . A A . 14 PRO HG3 1 1 20 13966 1 1 10 PRO N N -6.658 -4.392 0.353 1.00 . A A . 14 PRO N 1 1 20 13967 1 1 10 PRO O O -7.613 -3.425 -2.001 1.00 . A A . 14 PRO O 1 1 20 13968 1 1 11 ALA C C -9.973 -1.632 -2.744 1.00 . A A . 15 ALA C 1 1 20 13969 1 1 11 ALA CA C -10.162 -3.148 -2.840 1.00 . A A . 15 ALA CA 1 1 20 13970 1 1 11 ALA CB C -11.643 -3.496 -2.986 1.00 . A A . 15 ALA CB 1 1 20 13971 1 1 11 ALA H H -10.406 -4.191 -0.969 1.00 . A A . 15 ALA H 1 1 20 13972 1 1 11 ALA HA H -9.607 -3.545 -3.677 1.00 . A A . 15 ALA HA 1 1 20 13973 1 1 11 ALA HB1 H -11.752 -4.562 -3.110 1.00 . A A . 15 ALA HB1 1 1 20 13974 1 1 11 ALA HB2 H -12.048 -2.990 -3.850 1.00 . A A . 15 ALA HB2 1 1 20 13975 1 1 11 ALA HB3 H -12.175 -3.179 -2.101 1.00 . A A . 15 ALA HB3 1 1 20 13976 1 1 11 ALA N N -9.734 -3.810 -1.573 1.00 . A A . 15 ALA N 1 1 20 13977 1 1 11 ALA O O -9.685 -1.096 -1.692 1.00 . A A . 15 ALA O 1 1 20 13978 1 1 12 GLY C C -8.493 0.903 -3.566 1.00 . A A . 16 GLY C 1 1 20 13979 1 1 12 GLY CA C -9.963 0.544 -3.817 1.00 . A A . 16 GLY CA 1 1 20 13980 1 1 12 GLY H H -10.364 -1.390 -4.676 1.00 . A A . 16 GLY H 1 1 20 13981 1 1 12 GLY HA2 H -10.273 0.954 -4.768 1.00 . A A . 16 GLY HA2 1 1 20 13982 1 1 12 GLY HA3 H -10.574 0.964 -3.031 1.00 . A A . 16 GLY HA3 1 1 20 13983 1 1 12 GLY N N -10.133 -0.937 -3.839 1.00 . A A . 16 GLY N 1 1 20 13984 1 1 12 GLY O O -8.161 2.044 -3.320 1.00 . A A . 16 GLY O 1 1 20 13985 1 1 13 TRP C C -5.353 0.088 -4.656 1.00 . A A . 17 TRP C 1 1 20 13986 1 1 13 TRP CA C -6.168 0.240 -3.370 1.00 . A A . 17 TRP CA 1 1 20 13987 1 1 13 TRP CB C -5.737 -0.795 -2.338 1.00 . A A . 17 TRP CB 1 1 20 13988 1 1 13 TRP CD1 C -6.889 -0.340 -0.142 1.00 . A A . 17 TRP CD1 1 1 20 13989 1 1 13 TRP CD2 C -4.891 0.672 -0.311 1.00 . A A . 17 TRP CD2 1 1 20 13990 1 1 13 TRP CE2 C -5.409 1.014 0.959 1.00 . A A . 17 TRP CE2 1 1 20 13991 1 1 13 TRP CE3 C -3.637 1.178 -0.677 1.00 . A A . 17 TRP CE3 1 1 20 13992 1 1 13 TRP CG C -5.844 -0.190 -0.984 1.00 . A A . 17 TRP CG 1 1 20 13993 1 1 13 TRP CH2 C -3.450 2.335 1.451 1.00 . A A . 17 TRP CH2 1 1 20 13994 1 1 13 TRP CZ2 C -4.699 1.836 1.836 1.00 . A A . 17 TRP CZ2 1 1 20 13995 1 1 13 TRP CZ3 C -2.923 2.005 0.198 1.00 . A A . 17 TRP CZ3 1 1 20 13996 1 1 13 TRP H H -7.886 -0.978 -3.807 1.00 . A A . 17 TRP H 1 1 20 13997 1 1 13 TRP HA H -6.053 1.232 -2.965 1.00 . A A . 17 TRP HA 1 1 20 13998 1 1 13 TRP HB2 H -6.382 -1.660 -2.401 1.00 . A A . 17 TRP HB2 1 1 20 13999 1 1 13 TRP HB3 H -4.715 -1.090 -2.525 1.00 . A A . 17 TRP HB3 1 1 20 14000 1 1 13 TRP HD1 H -7.776 -0.922 -0.343 1.00 . A A . 17 TRP HD1 1 1 20 14001 1 1 13 TRP HE1 H -7.230 0.430 1.791 1.00 . A A . 17 TRP HE1 1 1 20 14002 1 1 13 TRP HE3 H -3.220 0.932 -1.642 1.00 . A A . 17 TRP HE3 1 1 20 14003 1 1 13 TRP HH2 H -2.889 2.972 2.117 1.00 . A A . 17 TRP HH2 1 1 20 14004 1 1 13 TRP HZ2 H -5.112 2.088 2.803 1.00 . A A . 17 TRP HZ2 1 1 20 14005 1 1 13 TRP HZ3 H -1.964 2.391 -0.098 1.00 . A A . 17 TRP HZ3 1 1 20 14006 1 1 13 TRP N N -7.608 -0.059 -3.616 1.00 . A A . 17 TRP N 1 1 20 14007 1 1 13 TRP NE1 N -6.633 0.373 1.017 1.00 . A A . 17 TRP NE1 1 1 20 14008 1 1 13 TRP O O -5.726 -0.639 -5.555 1.00 . A A . 17 TRP O 1 1 20 14009 1 1 14 GLU C C -1.933 0.496 -5.669 1.00 . A A . 18 GLU C 1 1 20 14010 1 1 14 GLU CA C -3.420 0.661 -5.993 1.00 . A A . 18 GLU CA 1 1 20 14011 1 1 14 GLU CB C -3.633 1.979 -6.741 1.00 . A A . 18 GLU CB 1 1 20 14012 1 1 14 GLU CD C -2.991 1.131 -8.998 1.00 . A A . 18 GLU CD 1 1 20 14013 1 1 14 GLU CG C -4.135 1.696 -8.154 1.00 . A A . 18 GLU CG 1 1 20 14014 1 1 14 GLU H H -3.959 1.362 -4.026 1.00 . A A . 18 GLU H 1 1 20 14015 1 1 14 GLU HA H -3.762 -0.161 -6.601 1.00 . A A . 18 GLU HA 1 1 20 14016 1 1 14 GLU HB2 H -4.355 2.578 -6.214 1.00 . A A . 18 GLU HB2 1 1 20 14017 1 1 14 GLU HB3 H -2.700 2.518 -6.797 1.00 . A A . 18 GLU HB3 1 1 20 14018 1 1 14 GLU HG2 H -4.939 0.978 -8.112 1.00 . A A . 18 GLU HG2 1 1 20 14019 1 1 14 GLU HG3 H -4.492 2.615 -8.598 1.00 . A A . 18 GLU HG3 1 1 20 14020 1 1 14 GLU N N -4.243 0.773 -4.757 1.00 . A A . 18 GLU N 1 1 20 14021 1 1 14 GLU O O -1.181 1.453 -5.705 1.00 . A A . 18 GLU O 1 1 20 14022 1 1 14 GLU OE1 O -2.289 1.917 -9.611 1.00 . A A . 18 GLU OE1 1 1 20 14023 1 1 14 GLU OE2 O -2.837 -0.079 -9.017 1.00 . A A . 18 GLU OE2 1 1 20 14024 1 1 15 MET C C 0.713 -0.491 -6.394 1.00 . A A . 19 MET C 1 1 20 14025 1 1 15 MET CA C -0.030 -0.862 -5.122 1.00 . A A . 19 MET CA 1 1 20 14026 1 1 15 MET CB C 0.214 -2.327 -4.779 1.00 . A A . 19 MET CB 1 1 20 14027 1 1 15 MET CE C -2.213 -3.939 -3.988 1.00 . A A . 19 MET CE 1 1 20 14028 1 1 15 MET CG C -0.364 -3.240 -5.869 1.00 . A A . 19 MET CG 1 1 20 14029 1 1 15 MET H H -2.077 -1.470 -5.381 1.00 . A A . 19 MET H 1 1 20 14030 1 1 15 MET HA H 0.277 -0.229 -4.305 1.00 . A A . 19 MET HA 1 1 20 14031 1 1 15 MET HB2 H 1.272 -2.484 -4.719 1.00 . A A . 19 MET HB2 1 1 20 14032 1 1 15 MET HB3 H -0.231 -2.558 -3.826 1.00 . A A . 19 MET HB3 1 1 20 14033 1 1 15 MET HE1 H -2.118 -2.867 -4.071 1.00 . A A . 19 MET HE1 1 1 20 14034 1 1 15 MET HE2 H -2.004 -4.239 -2.975 1.00 . A A . 19 MET HE2 1 1 20 14035 1 1 15 MET HE3 H -3.221 -4.237 -4.248 1.00 . A A . 19 MET HE3 1 1 20 14036 1 1 15 MET HG2 H -1.143 -2.723 -6.406 1.00 . A A . 19 MET HG2 1 1 20 14037 1 1 15 MET HG3 H 0.421 -3.511 -6.557 1.00 . A A . 19 MET HG3 1 1 20 14038 1 1 15 MET N N -1.480 -0.699 -5.388 1.00 . A A . 19 MET N 1 1 20 14039 1 1 15 MET O O 0.506 -1.069 -7.443 1.00 . A A . 19 MET O 1 1 20 14040 1 1 15 MET SD S -1.041 -4.741 -5.111 1.00 . A A . 19 MET SD 1 1 20 14041 1 1 16 ALA C C 3.620 1.556 -7.092 1.00 . A A . 20 ALA C 1 1 20 14042 1 1 16 ALA CA C 2.287 0.925 -7.525 1.00 . A A . 20 ALA CA 1 1 20 14043 1 1 16 ALA CB C 1.322 1.914 -8.195 1.00 . A A . 20 ALA CB 1 1 20 14044 1 1 16 ALA H H 1.685 0.943 -5.463 1.00 . A A . 20 ALA H 1 1 20 14045 1 1 16 ALA HA H 2.467 0.084 -8.178 1.00 . A A . 20 ALA HA 1 1 20 14046 1 1 16 ALA HB1 H 0.825 2.501 -7.437 1.00 . A A . 20 ALA HB1 1 1 20 14047 1 1 16 ALA HB2 H 0.579 1.362 -8.753 1.00 . A A . 20 ALA HB2 1 1 20 14048 1 1 16 ALA HB3 H 1.857 2.562 -8.866 1.00 . A A . 20 ALA HB3 1 1 20 14049 1 1 16 ALA N N 1.549 0.486 -6.316 1.00 . A A . 20 ALA N 1 1 20 14050 1 1 16 ALA O O 4.400 0.913 -6.414 1.00 . A A . 20 ALA O 1 1 20 14051 1 1 17 LYS C C 5.225 4.886 -7.042 1.00 . A A . 21 LYS C 1 1 20 14052 1 1 17 LYS CA C 5.211 3.362 -6.994 1.00 . A A . 21 LYS CA 1 1 20 14053 1 1 17 LYS CB C 6.251 2.785 -7.953 1.00 . A A . 21 LYS CB 1 1 20 14054 1 1 17 LYS CD C 7.070 3.729 -10.118 1.00 . A A . 21 LYS CD 1 1 20 14055 1 1 17 LYS CE C 6.829 3.690 -11.628 1.00 . A A . 21 LYS CE 1 1 20 14056 1 1 17 LYS CG C 5.863 3.129 -9.392 1.00 . A A . 21 LYS CG 1 1 20 14057 1 1 17 LYS H H 3.290 3.321 -7.978 1.00 . A A . 21 LYS H 1 1 20 14058 1 1 17 LYS HA H 5.425 3.037 -5.994 1.00 . A A . 21 LYS HA 1 1 20 14059 1 1 17 LYS HB2 H 7.220 3.209 -7.731 1.00 . A A . 21 LYS HB2 1 1 20 14060 1 1 17 LYS HB3 H 6.292 1.712 -7.838 1.00 . A A . 21 LYS HB3 1 1 20 14061 1 1 17 LYS HD2 H 7.207 4.752 -9.801 1.00 . A A . 21 LYS HD2 1 1 20 14062 1 1 17 LYS HD3 H 7.954 3.155 -9.878 1.00 . A A . 21 LYS HD3 1 1 20 14063 1 1 17 LYS HE2 H 6.516 2.702 -11.933 1.00 . A A . 21 LYS HE2 1 1 20 14064 1 1 17 LYS HE3 H 6.088 4.424 -11.910 1.00 . A A . 21 LYS HE3 1 1 20 14065 1 1 17 LYS HG2 H 5.546 2.232 -9.904 1.00 . A A . 21 LYS HG2 1 1 20 14066 1 1 17 LYS HG3 H 5.054 3.845 -9.386 1.00 . A A . 21 LYS HG3 1 1 20 14067 1 1 17 LYS HZ1 H 8.499 4.917 -11.829 1.00 . A A . 21 LYS HZ1 1 1 20 14068 1 1 17 LYS HZ2 H 8.041 4.129 -13.263 1.00 . A A . 21 LYS HZ2 1 1 20 14069 1 1 17 LYS HZ3 H 8.827 3.265 -12.030 1.00 . A A . 21 LYS HZ3 1 1 20 14070 1 1 17 LYS N N 3.909 2.787 -7.443 1.00 . A A . 21 LYS N 1 1 20 14071 1 1 17 LYS NZ N 8.148 4.025 -12.233 1.00 . A A . 21 LYS NZ 1 1 20 14072 1 1 17 LYS O O 4.437 5.516 -7.720 1.00 . A A . 21 LYS O 1 1 20 14073 1 1 18 THR C C 7.713 7.356 -6.104 1.00 . A A . 22 THR C 1 1 20 14074 1 1 18 THR CA C 6.251 6.954 -6.285 1.00 . A A . 22 THR CA 1 1 20 14075 1 1 18 THR CB C 5.431 7.398 -5.074 1.00 . A A . 22 THR CB 1 1 20 14076 1 1 18 THR CG2 C 5.971 6.722 -3.808 1.00 . A A . 22 THR CG2 1 1 20 14077 1 1 18 THR H H 6.758 4.924 -5.784 1.00 . A A . 22 THR H 1 1 20 14078 1 1 18 THR HA H 5.847 7.386 -7.186 1.00 . A A . 22 THR HA 1 1 20 14079 1 1 18 THR HB H 4.402 7.119 -5.215 1.00 . A A . 22 THR HB 1 1 20 14080 1 1 18 THR HG1 H 4.843 9.206 -5.482 1.00 . A A . 22 THR HG1 1 1 20 14081 1 1 18 THR HG21 H 5.157 6.526 -3.125 1.00 . A A . 22 THR HG21 1 1 20 14082 1 1 18 THR HG22 H 6.689 7.375 -3.334 1.00 . A A . 22 THR HG22 1 1 20 14083 1 1 18 THR HG23 H 6.454 5.790 -4.071 1.00 . A A . 22 THR HG23 1 1 20 14084 1 1 18 THR N N 6.137 5.471 -6.314 1.00 . A A . 22 THR N 1 1 20 14085 1 1 18 THR O O 8.616 6.580 -6.352 1.00 . A A . 22 THR O 1 1 20 14086 1 1 18 THR OG1 O 5.526 8.809 -4.937 1.00 . A A . 22 THR OG1 1 1 20 14087 1 1 19 SER C C 10.227 8.684 -6.672 1.00 . A A . 23 SER C 1 1 20 14088 1 1 19 SER CA C 9.359 9.019 -5.452 1.00 . A A . 23 SER CA 1 1 20 14089 1 1 19 SER CB C 9.837 8.251 -4.220 1.00 . A A . 23 SER CB 1 1 20 14090 1 1 19 SER H H 7.202 9.159 -5.465 1.00 . A A . 23 SER H 1 1 20 14091 1 1 19 SER HA H 9.381 10.079 -5.254 1.00 . A A . 23 SER HA 1 1 20 14092 1 1 19 SER HB2 H 10.204 7.280 -4.520 1.00 . A A . 23 SER HB2 1 1 20 14093 1 1 19 SER HB3 H 10.632 8.801 -3.737 1.00 . A A . 23 SER HB3 1 1 20 14094 1 1 19 SER HG H 8.327 8.940 -3.206 1.00 . A A . 23 SER HG 1 1 20 14095 1 1 19 SER N N 7.952 8.558 -5.664 1.00 . A A . 23 SER N 1 1 20 14096 1 1 19 SER O O 9.765 8.697 -7.796 1.00 . A A . 23 SER O 1 1 20 14097 1 1 19 SER OG O 8.757 8.088 -3.312 1.00 . A A . 23 SER OG 1 1 20 14098 1 1 20 SER C C 12.558 6.531 -7.733 1.00 . A A . 24 SER C 1 1 20 14099 1 1 20 SER CA C 12.370 8.048 -7.617 1.00 . A A . 24 SER CA 1 1 20 14100 1 1 20 SER CB C 13.701 8.730 -7.303 1.00 . A A . 24 SER CB 1 1 20 14101 1 1 20 SER H H 11.844 8.376 -5.554 1.00 . A A . 24 SER H 1 1 20 14102 1 1 20 SER HA H 11.960 8.446 -8.530 1.00 . A A . 24 SER HA 1 1 20 14103 1 1 20 SER HB2 H 13.562 9.802 -7.287 1.00 . A A . 24 SER HB2 1 1 20 14104 1 1 20 SER HB3 H 14.055 8.400 -6.337 1.00 . A A . 24 SER HB3 1 1 20 14105 1 1 20 SER HG H 14.361 8.774 -9.130 1.00 . A A . 24 SER HG 1 1 20 14106 1 1 20 SER N N 11.483 8.382 -6.464 1.00 . A A . 24 SER N 1 1 20 14107 1 1 20 SER O O 13.042 6.035 -8.732 1.00 . A A . 24 SER O 1 1 20 14108 1 1 20 SER OG O 14.653 8.392 -8.300 1.00 . A A . 24 SER OG 1 1 20 14109 1 1 21 GLY C C 11.814 3.664 -5.512 1.00 . A A . 25 GLY C 1 1 20 14110 1 1 21 GLY CA C 12.349 4.308 -6.795 1.00 . A A . 25 GLY CA 1 1 20 14111 1 1 21 GLY H H 11.796 6.201 -5.928 1.00 . A A . 25 GLY H 1 1 20 14112 1 1 21 GLY HA2 H 11.801 3.925 -7.643 1.00 . A A . 25 GLY HA2 1 1 20 14113 1 1 21 GLY HA3 H 13.396 4.068 -6.907 1.00 . A A . 25 GLY HA3 1 1 20 14114 1 1 21 GLY N N 12.185 5.788 -6.727 1.00 . A A . 25 GLY N 1 1 20 14115 1 1 21 GLY O O 12.547 3.430 -4.572 1.00 . A A . 25 GLY O 1 1 20 14116 1 1 22 GLN C C 8.470 2.447 -4.476 1.00 . A A . 26 GLN C 1 1 20 14117 1 1 22 GLN CA C 9.954 2.744 -4.247 1.00 . A A . 26 GLN CA 1 1 20 14118 1 1 22 GLN CB C 10.125 3.782 -3.137 1.00 . A A . 26 GLN CB 1 1 20 14119 1 1 22 GLN CD C 11.837 2.379 -1.977 1.00 . A A . 26 GLN CD 1 1 20 14120 1 1 22 GLN CG C 10.482 3.073 -1.829 1.00 . A A . 26 GLN CG 1 1 20 14121 1 1 22 GLN H H 9.968 3.572 -6.239 1.00 . A A . 26 GLN H 1 1 20 14122 1 1 22 GLN HA H 10.488 1.841 -3.996 1.00 . A A . 26 GLN HA 1 1 20 14123 1 1 22 GLN HB2 H 10.915 4.468 -3.401 1.00 . A A . 26 GLN HB2 1 1 20 14124 1 1 22 GLN HB3 H 9.202 4.327 -3.010 1.00 . A A . 26 GLN HB3 1 1 20 14125 1 1 22 GLN HE21 H 12.874 3.970 -1.395 1.00 . A A . 26 GLN HE21 1 1 20 14126 1 1 22 GLN HE22 H 13.802 2.604 -1.790 1.00 . A A . 26 GLN HE22 1 1 20 14127 1 1 22 GLN HG2 H 10.534 3.797 -1.028 1.00 . A A . 26 GLN HG2 1 1 20 14128 1 1 22 GLN HG3 H 9.725 2.337 -1.599 1.00 . A A . 26 GLN HG3 1 1 20 14129 1 1 22 GLN N N 10.539 3.376 -5.468 1.00 . A A . 26 GLN N 1 1 20 14130 1 1 22 GLN NE2 N 12.928 3.039 -1.697 1.00 . A A . 26 GLN NE2 1 1 20 14131 1 1 22 GLN O O 7.729 3.281 -4.965 1.00 . A A . 26 GLN O 1 1 20 14132 1 1 22 GLN OE1 O 11.905 1.226 -2.352 1.00 . A A . 26 GLN OE1 1 1 20 14133 1 1 23 ARG C C 5.721 1.686 -3.335 1.00 . A A . 27 ARG C 1 1 20 14134 1 1 23 ARG CA C 6.583 0.942 -4.337 1.00 . A A . 27 ARG CA 1 1 20 14135 1 1 23 ARG CB C 6.430 -0.567 -4.112 1.00 . A A . 27 ARG CB 1 1 20 14136 1 1 23 ARG CD C 7.894 -1.321 -5.988 1.00 . A A . 27 ARG CD 1 1 20 14137 1 1 23 ARG CG C 6.458 -1.278 -5.463 1.00 . A A . 27 ARG CG 1 1 20 14138 1 1 23 ARG CZ C 9.285 -3.151 -6.815 1.00 . A A . 27 ARG CZ 1 1 20 14139 1 1 23 ARG H H 8.627 0.602 -3.737 1.00 . A A . 27 ARG H 1 1 20 14140 1 1 23 ARG HA H 6.287 1.190 -5.344 1.00 . A A . 27 ARG HA 1 1 20 14141 1 1 23 ARG HB2 H 7.230 -0.932 -3.488 1.00 . A A . 27 ARG HB2 1 1 20 14142 1 1 23 ARG HB3 H 5.480 -0.765 -3.624 1.00 . A A . 27 ARG HB3 1 1 20 14143 1 1 23 ARG HD2 H 8.003 -0.666 -6.841 1.00 . A A . 27 ARG HD2 1 1 20 14144 1 1 23 ARG HD3 H 8.589 -1.043 -5.210 1.00 . A A . 27 ARG HD3 1 1 20 14145 1 1 23 ARG HE H 7.365 -3.376 -6.346 1.00 . A A . 27 ARG HE 1 1 20 14146 1 1 23 ARG HG2 H 6.085 -2.285 -5.350 1.00 . A A . 27 ARG HG2 1 1 20 14147 1 1 23 ARG HG3 H 5.833 -0.737 -6.162 1.00 . A A . 27 ARG HG3 1 1 20 14148 1 1 23 ARG HH11 H 10.196 -1.369 -6.627 1.00 . A A . 27 ARG HH11 1 1 20 14149 1 1 23 ARG HH12 H 11.188 -2.659 -7.213 1.00 . A A . 27 ARG HH12 1 1 20 14150 1 1 23 ARG HH21 H 8.673 -5.034 -7.109 1.00 . A A . 27 ARG HH21 1 1 20 14151 1 1 23 ARG HH22 H 10.335 -4.719 -7.484 1.00 . A A . 27 ARG HH22 1 1 20 14152 1 1 23 ARG N N 8.022 1.265 -4.129 1.00 . A A . 27 ARG N 1 1 20 14153 1 1 23 ARG NE N 8.111 -2.742 -6.395 1.00 . A A . 27 ARG NE 1 1 20 14154 1 1 23 ARG NH1 N 10.302 -2.327 -6.891 1.00 . A A . 27 ARG NH1 1 1 20 14155 1 1 23 ARG NH2 N 9.444 -4.399 -7.163 1.00 . A A . 27 ARG NH2 1 1 20 14156 1 1 23 ARG O O 6.028 1.765 -2.162 1.00 . A A . 27 ARG O 1 1 20 14157 1 1 24 TYR C C 2.297 2.370 -3.097 1.00 . A A . 28 TYR C 1 1 20 14158 1 1 24 TYR CA C 3.693 2.879 -2.849 1.00 . A A . 28 TYR CA 1 1 20 14159 1 1 24 TYR CB C 3.845 4.401 -3.072 1.00 . A A . 28 TYR CB 1 1 20 14160 1 1 24 TYR CD1 C 2.659 4.197 -5.312 1.00 . A A . 28 TYR CD1 1 1 20 14161 1 1 24 TYR CD2 C 2.439 6.257 -4.057 1.00 . A A . 28 TYR CD2 1 1 20 14162 1 1 24 TYR CE1 C 1.882 4.741 -6.338 1.00 . A A . 28 TYR CE1 1 1 20 14163 1 1 24 TYR CE2 C 1.650 6.793 -5.078 1.00 . A A . 28 TYR CE2 1 1 20 14164 1 1 24 TYR CG C 2.945 4.952 -4.170 1.00 . A A . 28 TYR CG 1 1 20 14165 1 1 24 TYR CZ C 1.377 6.037 -6.219 1.00 . A A . 28 TYR CZ 1 1 20 14166 1 1 24 TYR H H 4.372 2.067 -4.724 1.00 . A A . 28 TYR H 1 1 20 14167 1 1 24 TYR HA H 3.970 2.635 -1.834 1.00 . A A . 28 TYR HA 1 1 20 14168 1 1 24 TYR HB2 H 3.609 4.908 -2.147 1.00 . A A . 28 TYR HB2 1 1 20 14169 1 1 24 TYR HB3 H 4.869 4.610 -3.327 1.00 . A A . 28 TYR HB3 1 1 20 14170 1 1 24 TYR HD1 H 3.025 3.196 -5.398 1.00 . A A . 28 TYR HD1 1 1 20 14171 1 1 24 TYR HD2 H 2.642 6.842 -3.175 1.00 . A A . 28 TYR HD2 1 1 20 14172 1 1 24 TYR HE1 H 1.665 4.157 -7.216 1.00 . A A . 28 TYR HE1 1 1 20 14173 1 1 24 TYR HE2 H 1.256 7.792 -4.986 1.00 . A A . 28 TYR HE2 1 1 20 14174 1 1 24 TYR HH H 1.213 7.097 -7.796 1.00 . A A . 28 TYR HH 1 1 20 14175 1 1 24 TYR N N 4.615 2.188 -3.783 1.00 . A A . 28 TYR N 1 1 20 14176 1 1 24 TYR O O 2.041 1.656 -4.049 1.00 . A A . 28 TYR O 1 1 20 14177 1 1 24 TYR OH O 0.627 6.575 -7.240 1.00 . A A . 28 TYR OH 1 1 20 14178 1 1 25 PHE C C -0.955 3.303 -2.446 1.00 . A A . 29 PHE C 1 1 20 14179 1 1 25 PHE CA C 0.042 2.161 -2.380 1.00 . A A . 29 PHE CA 1 1 20 14180 1 1 25 PHE CB C -0.134 1.240 -1.175 1.00 . A A . 29 PHE CB 1 1 20 14181 1 1 25 PHE CD1 C 2.217 0.275 -1.126 1.00 . A A . 29 PHE CD1 1 1 20 14182 1 1 25 PHE CD2 C 0.377 -1.144 -1.805 1.00 . A A . 29 PHE CD2 1 1 20 14183 1 1 25 PHE CE1 C 3.111 -0.782 -1.343 1.00 . A A . 29 PHE CE1 1 1 20 14184 1 1 25 PHE CE2 C 1.273 -2.198 -2.026 1.00 . A A . 29 PHE CE2 1 1 20 14185 1 1 25 PHE CG C 0.843 0.092 -1.356 1.00 . A A . 29 PHE CG 1 1 20 14186 1 1 25 PHE CZ C 2.637 -2.017 -1.795 1.00 . A A . 29 PHE CZ 1 1 20 14187 1 1 25 PHE H H 1.654 3.231 -1.453 1.00 . A A . 29 PHE H 1 1 20 14188 1 1 25 PHE HA H -0.021 1.576 -3.285 1.00 . A A . 29 PHE HA 1 1 20 14189 1 1 25 PHE HB2 H 0.082 1.776 -0.261 1.00 . A A . 29 PHE HB2 1 1 20 14190 1 1 25 PHE HB3 H -1.146 0.861 -1.148 1.00 . A A . 29 PHE HB3 1 1 20 14191 1 1 25 PHE HD1 H 2.591 1.230 -0.781 1.00 . A A . 29 PHE HD1 1 1 20 14192 1 1 25 PHE HD2 H -0.674 -1.285 -1.985 1.00 . A A . 29 PHE HD2 1 1 20 14193 1 1 25 PHE HE1 H 4.166 -0.639 -1.171 1.00 . A A . 29 PHE HE1 1 1 20 14194 1 1 25 PHE HE2 H 0.907 -3.152 -2.379 1.00 . A A . 29 PHE HE2 1 1 20 14195 1 1 25 PHE HZ H 3.325 -2.829 -1.972 1.00 . A A . 29 PHE HZ 1 1 20 14196 1 1 25 PHE N N 1.410 2.681 -2.226 1.00 . A A . 29 PHE N 1 1 20 14197 1 1 25 PHE O O -1.293 3.934 -1.461 1.00 . A A . 29 PHE O 1 1 20 14198 1 1 26 LEU C C -3.762 4.204 -3.453 1.00 . A A . 30 LEU C 1 1 20 14199 1 1 26 LEU CA C -2.369 4.654 -3.893 1.00 . A A . 30 LEU CA 1 1 20 14200 1 1 26 LEU CB C -2.287 4.842 -5.414 1.00 . A A . 30 LEU CB 1 1 20 14201 1 1 26 LEU CD1 C -1.264 7.113 -5.025 1.00 . A A . 30 LEU CD1 1 1 20 14202 1 1 26 LEU CD2 C -1.994 6.430 -7.295 1.00 . A A . 30 LEU CD2 1 1 20 14203 1 1 26 LEU CG C -2.310 6.322 -5.808 1.00 . A A . 30 LEU CG 1 1 20 14204 1 1 26 LEU H H -1.076 3.022 -4.396 1.00 . A A . 30 LEU H 1 1 20 14205 1 1 26 LEU HA H -2.080 5.553 -3.380 1.00 . A A . 30 LEU HA 1 1 20 14206 1 1 26 LEU HB2 H -1.368 4.400 -5.772 1.00 . A A . 30 LEU HB2 1 1 20 14207 1 1 26 LEU HB3 H -3.117 4.342 -5.880 1.00 . A A . 30 LEU HB3 1 1 20 14208 1 1 26 LEU HD11 H -1.760 7.881 -4.455 1.00 . A A . 30 LEU HD11 1 1 20 14209 1 1 26 LEU HD12 H -0.567 7.572 -5.712 1.00 . A A . 30 LEU HD12 1 1 20 14210 1 1 26 LEU HD13 H -0.729 6.454 -4.359 1.00 . A A . 30 LEU HD13 1 1 20 14211 1 1 26 LEU HD21 H -2.907 6.380 -7.863 1.00 . A A . 30 LEU HD21 1 1 20 14212 1 1 26 LEU HD22 H -1.343 5.614 -7.580 1.00 . A A . 30 LEU HD22 1 1 20 14213 1 1 26 LEU HD23 H -1.496 7.368 -7.487 1.00 . A A . 30 LEU HD23 1 1 20 14214 1 1 26 LEU HG H -3.287 6.731 -5.616 1.00 . A A . 30 LEU HG 1 1 20 14215 1 1 26 LEU N N -1.399 3.562 -3.641 1.00 . A A . 30 LEU N 1 1 20 14216 1 1 26 LEU O O -4.387 3.369 -4.080 1.00 . A A . 30 LEU O 1 1 20 14217 1 1 27 ASN C C -6.675 5.188 -2.511 1.00 . A A . 31 ASN C 1 1 20 14218 1 1 27 ASN CA C -5.585 4.336 -1.861 1.00 . A A . 31 ASN CA 1 1 20 14219 1 1 27 ASN CB C -5.534 4.597 -0.356 1.00 . A A . 31 ASN CB 1 1 20 14220 1 1 27 ASN CG C -6.822 4.110 0.294 1.00 . A A . 31 ASN CG 1 1 20 14221 1 1 27 ASN H H -3.712 5.397 -1.870 1.00 . A A . 31 ASN H 1 1 20 14222 1 1 27 ASN HA H -5.761 3.289 -2.048 1.00 . A A . 31 ASN HA 1 1 20 14223 1 1 27 ASN HB2 H -4.701 4.065 0.077 1.00 . A A . 31 ASN HB2 1 1 20 14224 1 1 27 ASN HB3 H -5.416 5.656 -0.177 1.00 . A A . 31 ASN HB3 1 1 20 14225 1 1 27 ASN HD21 H -5.981 3.888 2.075 1.00 . A A . 31 ASN HD21 1 1 20 14226 1 1 27 ASN HD22 H -7.621 3.480 1.988 1.00 . A A . 31 ASN HD22 1 1 20 14227 1 1 27 ASN N N -4.242 4.738 -2.364 1.00 . A A . 31 ASN N 1 1 20 14228 1 1 27 ASN ND2 N -6.808 3.802 1.558 1.00 . A A . 31 ASN ND2 1 1 20 14229 1 1 27 ASN O O -6.773 6.378 -2.261 1.00 . A A . 31 ASN O 1 1 20 14230 1 1 27 ASN OD1 O -7.846 4.009 -0.351 1.00 . A A . 31 ASN OD1 1 1 20 14231 1 1 28 HIS C C -9.754 5.565 -3.012 1.00 . A A . 32 HIS C 1 1 20 14232 1 1 28 HIS CA C -8.598 5.348 -3.994 1.00 . A A . 32 HIS CA 1 1 20 14233 1 1 28 HIS CB C -9.073 4.475 -5.160 1.00 . A A . 32 HIS CB 1 1 20 14234 1 1 28 HIS CD2 C -6.691 4.631 -6.256 1.00 . A A . 32 HIS CD2 1 1 20 14235 1 1 28 HIS CE1 C -6.791 2.841 -7.472 1.00 . A A . 32 HIS CE1 1 1 20 14236 1 1 28 HIS CG C -7.915 4.061 -6.023 1.00 . A A . 32 HIS CG 1 1 20 14237 1 1 28 HIS H H -7.398 3.625 -3.507 1.00 . A A . 32 HIS H 1 1 20 14238 1 1 28 HIS HA H -8.233 6.292 -4.362 1.00 . A A . 32 HIS HA 1 1 20 14239 1 1 28 HIS HB2 H -9.563 3.595 -4.771 1.00 . A A . 32 HIS HB2 1 1 20 14240 1 1 28 HIS HB3 H -9.771 5.037 -5.758 1.00 . A A . 32 HIS HB3 1 1 20 14241 1 1 28 HIS HD1 H -8.701 2.285 -6.867 1.00 . A A . 32 HIS HD1 1 1 20 14242 1 1 28 HIS HD2 H -6.335 5.538 -5.802 1.00 . A A . 32 HIS HD2 1 1 20 14243 1 1 28 HIS HE1 H -6.544 2.056 -8.169 1.00 . A A . 32 HIS HE1 1 1 20 14244 1 1 28 HIS N N -7.499 4.584 -3.333 1.00 . A A . 32 HIS N 1 1 20 14245 1 1 28 HIS ND1 N -7.956 2.920 -6.807 1.00 . A A . 32 HIS ND1 1 1 20 14246 1 1 28 HIS NE2 N -5.982 3.860 -7.173 1.00 . A A . 32 HIS NE2 1 1 20 14247 1 1 28 HIS O O -10.611 6.401 -3.223 1.00 . A A . 32 HIS O 1 1 20 14248 1 1 29 ILE C C -10.534 6.172 -0.041 1.00 . A A . 33 ILE C 1 1 20 14249 1 1 29 ILE CA C -10.888 5.000 -0.940 1.00 . A A . 33 ILE CA 1 1 20 14250 1 1 29 ILE CB C -10.993 3.712 -0.082 1.00 . A A . 33 ILE CB 1 1 20 14251 1 1 29 ILE CD1 C -10.848 1.181 -0.110 1.00 . A A . 33 ILE CD1 1 1 20 14252 1 1 29 ILE CG1 C -10.458 2.476 -0.836 1.00 . A A . 33 ILE CG1 1 1 20 14253 1 1 29 ILE CG2 C -12.467 3.499 0.282 1.00 . A A . 33 ILE CG2 1 1 20 14254 1 1 29 ILE H H -9.077 4.169 -1.783 1.00 . A A . 33 ILE H 1 1 20 14255 1 1 29 ILE HA H -11.823 5.185 -1.446 1.00 . A A . 33 ILE HA 1 1 20 14256 1 1 29 ILE HB H -10.424 3.851 0.829 1.00 . A A . 33 ILE HB 1 1 20 14257 1 1 29 ILE HD11 H -11.109 1.407 0.914 1.00 . A A . 33 ILE HD11 1 1 20 14258 1 1 29 ILE HD12 H -10.016 0.494 -0.125 1.00 . A A . 33 ILE HD12 1 1 20 14259 1 1 29 ILE HD13 H -11.695 0.731 -0.605 1.00 . A A . 33 ILE HD13 1 1 20 14260 1 1 29 ILE HG12 H -10.863 2.467 -1.834 1.00 . A A . 33 ILE HG12 1 1 20 14261 1 1 29 ILE HG13 H -9.380 2.535 -0.886 1.00 . A A . 33 ILE HG13 1 1 20 14262 1 1 29 ILE HG21 H -12.535 3.069 1.271 1.00 . A A . 33 ILE HG21 1 1 20 14263 1 1 29 ILE HG22 H -12.920 2.828 -0.433 1.00 . A A . 33 ILE HG22 1 1 20 14264 1 1 29 ILE HG23 H -12.984 4.446 0.265 1.00 . A A . 33 ILE HG23 1 1 20 14265 1 1 29 ILE N N -9.782 4.824 -1.937 1.00 . A A . 33 ILE N 1 1 20 14266 1 1 29 ILE O O -11.171 7.208 -0.056 1.00 . A A . 33 ILE O 1 1 20 14267 1 1 30 ASP C C -8.315 8.192 0.816 1.00 . A A . 34 ASP C 1 1 20 14268 1 1 30 ASP CA C -9.065 7.124 1.624 1.00 . A A . 34 ASP CA 1 1 20 14269 1 1 30 ASP CB C -8.132 6.467 2.641 1.00 . A A . 34 ASP CB 1 1 20 14270 1 1 30 ASP CG C -8.896 5.390 3.413 1.00 . A A . 34 ASP CG 1 1 20 14271 1 1 30 ASP H H -8.998 5.172 0.704 1.00 . A A . 34 ASP H 1 1 20 14272 1 1 30 ASP HA H -9.915 7.557 2.127 1.00 . A A . 34 ASP HA 1 1 20 14273 1 1 30 ASP HB2 H -7.296 6.018 2.126 1.00 . A A . 34 ASP HB2 1 1 20 14274 1 1 30 ASP HB3 H -7.769 7.215 3.333 1.00 . A A . 34 ASP HB3 1 1 20 14275 1 1 30 ASP N N -9.499 6.017 0.729 1.00 . A A . 34 ASP N 1 1 20 14276 1 1 30 ASP O O -7.894 9.201 1.348 1.00 . A A . 34 ASP O 1 1 20 14277 1 1 30 ASP OD1 O -9.975 5.689 3.899 1.00 . A A . 34 ASP OD1 1 1 20 14278 1 1 30 ASP OD2 O -8.389 4.284 3.505 1.00 . A A . 34 ASP OD2 1 1 20 14279 1 1 31 GLN C C -6.061 9.304 -0.667 1.00 . A A . 35 GLN C 1 1 20 14280 1 1 31 GLN CA C -7.416 8.989 -1.297 1.00 . A A . 35 GLN CA 1 1 20 14281 1 1 31 GLN CB C -8.311 10.229 -1.296 1.00 . A A . 35 GLN CB 1 1 20 14282 1 1 31 GLN CD C -10.112 10.777 -2.940 1.00 . A A . 35 GLN CD 1 1 20 14283 1 1 31 GLN CG C -9.710 9.853 -1.789 1.00 . A A . 35 GLN CG 1 1 20 14284 1 1 31 GLN H H -8.482 7.168 -0.887 1.00 . A A . 35 GLN H 1 1 20 14285 1 1 31 GLN HA H -7.290 8.626 -2.305 1.00 . A A . 35 GLN HA 1 1 20 14286 1 1 31 GLN HB2 H -8.377 10.624 -0.293 1.00 . A A . 35 GLN HB2 1 1 20 14287 1 1 31 GLN HB3 H -7.889 10.977 -1.950 1.00 . A A . 35 GLN HB3 1 1 20 14288 1 1 31 GLN HE21 H -9.392 9.575 -4.346 1.00 . A A . 35 GLN HE21 1 1 20 14289 1 1 31 GLN HE22 H -10.097 11.010 -4.912 1.00 . A A . 35 GLN HE22 1 1 20 14290 1 1 31 GLN HG2 H -9.706 8.830 -2.134 1.00 . A A . 35 GLN HG2 1 1 20 14291 1 1 31 GLN HG3 H -10.417 9.958 -0.980 1.00 . A A . 35 GLN HG3 1 1 20 14292 1 1 31 GLN N N -8.141 7.983 -0.467 1.00 . A A . 35 GLN N 1 1 20 14293 1 1 31 GLN NE2 N -9.845 10.425 -4.168 1.00 . A A . 35 GLN NE2 1 1 20 14294 1 1 31 GLN O O -5.832 10.393 -0.181 1.00 . A A . 35 GLN O 1 1 20 14295 1 1 31 GLN OE1 O -10.672 11.833 -2.719 1.00 . A A . 35 GLN OE1 1 1 20 14296 1 1 32 THR C C -2.764 7.675 -0.617 1.00 . A A . 36 THR C 1 1 20 14297 1 1 32 THR CA C -3.821 8.626 -0.053 1.00 . A A . 36 THR CA 1 1 20 14298 1 1 32 THR CB C -4.001 8.383 1.450 1.00 . A A . 36 THR CB 1 1 20 14299 1 1 32 THR CG2 C -3.095 9.334 2.231 1.00 . A A . 36 THR CG2 1 1 20 14300 1 1 32 THR H H -5.364 7.480 -1.063 1.00 . A A . 36 THR H 1 1 20 14301 1 1 32 THR HA H -3.531 9.650 -0.223 1.00 . A A . 36 THR HA 1 1 20 14302 1 1 32 THR HB H -3.729 7.365 1.683 1.00 . A A . 36 THR HB 1 1 20 14303 1 1 32 THR HG1 H -5.810 7.765 1.819 1.00 . A A . 36 THR HG1 1 1 20 14304 1 1 32 THR HG21 H -2.825 10.172 1.605 1.00 . A A . 36 THR HG21 1 1 20 14305 1 1 32 THR HG22 H -2.201 8.811 2.536 1.00 . A A . 36 THR HG22 1 1 20 14306 1 1 32 THR HG23 H -3.618 9.694 3.106 1.00 . A A . 36 THR HG23 1 1 20 14307 1 1 32 THR N N -5.160 8.360 -0.667 1.00 . A A . 36 THR N 1 1 20 14308 1 1 32 THR O O -3.035 6.865 -1.480 1.00 . A A . 36 THR O 1 1 20 14309 1 1 32 THR OG1 O -5.356 8.610 1.818 1.00 . A A . 36 THR OG1 1 1 20 14310 1 1 33 THR C C 0.374 6.358 0.532 1.00 . A A . 37 THR C 1 1 20 14311 1 1 33 THR CA C -0.469 6.876 -0.631 1.00 . A A . 37 THR CA 1 1 20 14312 1 1 33 THR CB C 0.413 7.742 -1.537 1.00 . A A . 37 THR CB 1 1 20 14313 1 1 33 THR CG2 C -0.447 8.516 -2.533 1.00 . A A . 37 THR CG2 1 1 20 14314 1 1 33 THR H H -1.360 8.432 0.569 1.00 . A A . 37 THR H 1 1 20 14315 1 1 33 THR HA H -0.883 6.056 -1.194 1.00 . A A . 37 THR HA 1 1 20 14316 1 1 33 THR HB H 1.099 7.103 -2.079 1.00 . A A . 37 THR HB 1 1 20 14317 1 1 33 THR HG1 H 1.419 9.392 -1.280 1.00 . A A . 37 THR HG1 1 1 20 14318 1 1 33 THR HG21 H -1.421 8.059 -2.595 1.00 . A A . 37 THR HG21 1 1 20 14319 1 1 33 THR HG22 H 0.026 8.494 -3.506 1.00 . A A . 37 THR HG22 1 1 20 14320 1 1 33 THR HG23 H -0.546 9.538 -2.206 1.00 . A A . 37 THR HG23 1 1 20 14321 1 1 33 THR N N -1.553 7.771 -0.129 1.00 . A A . 37 THR N 1 1 20 14322 1 1 33 THR O O 1.119 7.100 1.140 1.00 . A A . 37 THR O 1 1 20 14323 1 1 33 THR OG1 O 1.152 8.653 -0.731 1.00 . A A . 37 THR OG1 1 1 20 14324 1 1 34 THR C C 2.166 3.594 1.357 1.00 . A A . 38 THR C 1 1 20 14325 1 1 34 THR CA C 1.129 4.553 1.942 1.00 . A A . 38 THR CA 1 1 20 14326 1 1 34 THR CB C 0.158 3.831 2.889 1.00 . A A . 38 THR CB 1 1 20 14327 1 1 34 THR CG2 C -0.379 2.559 2.234 1.00 . A A . 38 THR CG2 1 1 20 14328 1 1 34 THR H H -0.298 4.500 0.314 1.00 . A A . 38 THR H 1 1 20 14329 1 1 34 THR HA H 1.620 5.359 2.463 1.00 . A A . 38 THR HA 1 1 20 14330 1 1 34 THR HB H -0.668 4.486 3.123 1.00 . A A . 38 THR HB 1 1 20 14331 1 1 34 THR HG1 H 0.251 2.955 4.623 1.00 . A A . 38 THR HG1 1 1 20 14332 1 1 34 THR HG21 H -1.238 2.204 2.782 1.00 . A A . 38 THR HG21 1 1 20 14333 1 1 34 THR HG22 H 0.389 1.800 2.236 1.00 . A A . 38 THR HG22 1 1 20 14334 1 1 34 THR HG23 H -0.664 2.777 1.218 1.00 . A A . 38 THR HG23 1 1 20 14335 1 1 34 THR N N 0.292 5.094 0.832 1.00 . A A . 38 THR N 1 1 20 14336 1 1 34 THR O O 1.855 2.782 0.512 1.00 . A A . 38 THR O 1 1 20 14337 1 1 34 THR OG1 O 0.841 3.490 4.089 1.00 . A A . 38 THR OG1 1 1 20 14338 1 1 35 TRP C C 4.093 1.322 1.589 1.00 . A A . 39 TRP C 1 1 20 14339 1 1 35 TRP CA C 4.434 2.771 1.227 1.00 . A A . 39 TRP CA 1 1 20 14340 1 1 35 TRP CB C 5.768 3.171 1.881 1.00 . A A . 39 TRP CB 1 1 20 14341 1 1 35 TRP CD1 C 5.694 5.477 2.927 1.00 . A A . 39 TRP CD1 1 1 20 14342 1 1 35 TRP CD2 C 6.494 5.523 0.822 1.00 . A A . 39 TRP CD2 1 1 20 14343 1 1 35 TRP CE2 C 6.511 6.856 1.300 1.00 . A A . 39 TRP CE2 1 1 20 14344 1 1 35 TRP CE3 C 6.957 5.289 -0.490 1.00 . A A . 39 TRP CE3 1 1 20 14345 1 1 35 TRP CG C 5.964 4.661 1.878 1.00 . A A . 39 TRP CG 1 1 20 14346 1 1 35 TRP CH2 C 7.426 7.659 -0.778 1.00 . A A . 39 TRP CH2 1 1 20 14347 1 1 35 TRP CZ2 C 6.969 7.911 0.516 1.00 . A A . 39 TRP CZ2 1 1 20 14348 1 1 35 TRP CZ3 C 7.418 6.351 -1.280 1.00 . A A . 39 TRP CZ3 1 1 20 14349 1 1 35 TRP H H 3.627 4.348 2.464 1.00 . A A . 39 TRP H 1 1 20 14350 1 1 35 TRP HA H 4.494 2.882 0.156 1.00 . A A . 39 TRP HA 1 1 20 14351 1 1 35 TRP HB2 H 5.780 2.816 2.900 1.00 . A A . 39 TRP HB2 1 1 20 14352 1 1 35 TRP HB3 H 6.578 2.708 1.337 1.00 . A A . 39 TRP HB3 1 1 20 14353 1 1 35 TRP HD1 H 5.285 5.162 3.877 1.00 . A A . 39 TRP HD1 1 1 20 14354 1 1 35 TRP HE1 H 5.906 7.558 3.161 1.00 . A A . 39 TRP HE1 1 1 20 14355 1 1 35 TRP HE3 H 6.951 4.292 -0.896 1.00 . A A . 39 TRP HE3 1 1 20 14356 1 1 35 TRP HH2 H 7.783 8.472 -1.394 1.00 . A A . 39 TRP HH2 1 1 20 14357 1 1 35 TRP HZ2 H 6.974 8.915 0.908 1.00 . A A . 39 TRP HZ2 1 1 20 14358 1 1 35 TRP HZ3 H 7.774 6.158 -2.280 1.00 . A A . 39 TRP HZ3 1 1 20 14359 1 1 35 TRP N N 3.393 3.684 1.785 1.00 . A A . 39 TRP N 1 1 20 14360 1 1 35 TRP NE1 N 6.011 6.776 2.581 1.00 . A A . 39 TRP NE1 1 1 20 14361 1 1 35 TRP O O 4.204 0.428 0.775 1.00 . A A . 39 TRP O 1 1 20 14362 1 1 36 GLN C C 2.775 -0.295 4.649 1.00 . A A . 40 GLN C 1 1 20 14363 1 1 36 GLN CA C 3.331 -0.301 3.222 1.00 . A A . 40 GLN CA 1 1 20 14364 1 1 36 GLN CB C 4.647 -1.075 3.163 1.00 . A A . 40 GLN CB 1 1 20 14365 1 1 36 GLN CD C 6.001 -1.970 1.263 1.00 . A A . 40 GLN CD 1 1 20 14366 1 1 36 GLN CG C 4.635 -2.011 1.952 1.00 . A A . 40 GLN CG 1 1 20 14367 1 1 36 GLN H H 3.599 1.827 3.443 1.00 . A A . 40 GLN H 1 1 20 14368 1 1 36 GLN HA H 2.617 -0.732 2.539 1.00 . A A . 40 GLN HA 1 1 20 14369 1 1 36 GLN HB2 H 5.470 -0.382 3.074 1.00 . A A . 40 GLN HB2 1 1 20 14370 1 1 36 GLN HB3 H 4.764 -1.657 4.065 1.00 . A A . 40 GLN HB3 1 1 20 14371 1 1 36 GLN HE21 H 5.582 -0.338 0.213 1.00 . A A . 40 GLN HE21 1 1 20 14372 1 1 36 GLN HE22 H 7.131 -0.984 -0.038 1.00 . A A . 40 GLN HE22 1 1 20 14373 1 1 36 GLN HG2 H 4.426 -3.018 2.277 1.00 . A A . 40 GLN HG2 1 1 20 14374 1 1 36 GLN HG3 H 3.874 -1.690 1.257 1.00 . A A . 40 GLN HG3 1 1 20 14375 1 1 36 GLN N N 3.679 1.089 2.804 1.00 . A A . 40 GLN N 1 1 20 14376 1 1 36 GLN NE2 N 6.259 -1.018 0.409 1.00 . A A . 40 GLN NE2 1 1 20 14377 1 1 36 GLN O O 3.143 0.524 5.465 1.00 . A A . 40 GLN O 1 1 20 14378 1 1 36 GLN OE1 O 6.842 -2.813 1.505 1.00 . A A . 40 GLN OE1 1 1 20 14379 1 1 37 ASP C C 0.333 -2.434 6.458 1.00 . A A . 41 ASP C 1 1 20 14380 1 1 37 ASP CA C 1.311 -1.257 6.332 1.00 . A A . 41 ASP CA 1 1 20 14381 1 1 37 ASP CB C 0.581 0.076 6.518 1.00 . A A . 41 ASP CB 1 1 20 14382 1 1 37 ASP CG C 1.317 0.921 7.561 1.00 . A A . 41 ASP CG 1 1 20 14383 1 1 37 ASP H H 1.609 -1.862 4.282 1.00 . A A . 41 ASP H 1 1 20 14384 1 1 37 ASP HA H 2.098 -1.347 7.064 1.00 . A A . 41 ASP HA 1 1 20 14385 1 1 37 ASP HB2 H 0.554 0.607 5.578 1.00 . A A . 41 ASP HB2 1 1 20 14386 1 1 37 ASP HB3 H -0.428 -0.110 6.855 1.00 . A A . 41 ASP HB3 1 1 20 14387 1 1 37 ASP N N 1.891 -1.207 4.955 1.00 . A A . 41 ASP N 1 1 20 14388 1 1 37 ASP O O 0.529 -3.306 7.281 1.00 . A A . 41 ASP O 1 1 20 14389 1 1 37 ASP OD1 O 1.737 0.360 8.560 1.00 . A A . 41 ASP OD1 1 1 20 14390 1 1 37 ASP OD2 O 1.449 2.114 7.341 1.00 . A A . 41 ASP OD2 1 1 20 14391 1 1 38 PRO C C -1.099 -4.825 5.133 1.00 . A A . 42 PRO C 1 1 20 14392 1 1 38 PRO CA C -1.695 -3.522 5.685 1.00 . A A . 42 PRO CA 1 1 20 14393 1 1 38 PRO CB C -2.835 -3.006 4.808 1.00 . A A . 42 PRO CB 1 1 20 14394 1 1 38 PRO CD C -1.021 -1.423 4.613 1.00 . A A . 42 PRO CD 1 1 20 14395 1 1 38 PRO CG C -2.201 -2.016 3.884 1.00 . A A . 42 PRO CG 1 1 20 14396 1 1 38 PRO HA H -2.047 -3.667 6.694 1.00 . A A . 42 PRO HA 1 1 20 14397 1 1 38 PRO HB2 H -3.271 -3.819 4.244 1.00 . A A . 42 PRO HB2 1 1 20 14398 1 1 38 PRO HB3 H -3.587 -2.525 5.415 1.00 . A A . 42 PRO HB3 1 1 20 14399 1 1 38 PRO HD2 H -0.192 -1.286 3.937 1.00 . A A . 42 PRO HD2 1 1 20 14400 1 1 38 PRO HD3 H -1.295 -0.486 5.074 1.00 . A A . 42 PRO HD3 1 1 20 14401 1 1 38 PRO HG2 H -1.867 -2.507 2.982 1.00 . A A . 42 PRO HG2 1 1 20 14402 1 1 38 PRO HG3 H -2.907 -1.238 3.638 1.00 . A A . 42 PRO HG3 1 1 20 14403 1 1 38 PRO N N -0.694 -2.427 5.640 1.00 . A A . 42 PRO N 1 1 20 14404 1 1 38 PRO O O -0.573 -5.633 5.872 1.00 . A A . 42 PRO O 1 1 20 14405 1 1 39 ARG C C 0.529 -5.966 2.298 1.00 . A A . 43 ARG C 1 1 20 14406 1 1 39 ARG CA C -0.606 -6.295 3.271 1.00 . A A . 43 ARG CA 1 1 20 14407 1 1 39 ARG CB C -1.772 -6.952 2.532 1.00 . A A . 43 ARG CB 1 1 20 14408 1 1 39 ARG CD C -3.726 -7.205 4.069 1.00 . A A . 43 ARG CD 1 1 20 14409 1 1 39 ARG CG C -2.501 -7.908 3.479 1.00 . A A . 43 ARG CG 1 1 20 14410 1 1 39 ARG CZ C -5.700 -8.052 5.230 1.00 . A A . 43 ARG CZ 1 1 20 14411 1 1 39 ARG H H -1.598 -4.385 3.260 1.00 . A A . 43 ARG H 1 1 20 14412 1 1 39 ARG HA H -0.253 -6.944 4.057 1.00 . A A . 43 ARG HA 1 1 20 14413 1 1 39 ARG HB2 H -2.457 -6.189 2.192 1.00 . A A . 43 ARG HB2 1 1 20 14414 1 1 39 ARG HB3 H -1.396 -7.504 1.684 1.00 . A A . 43 ARG HB3 1 1 20 14415 1 1 39 ARG HD2 H -3.422 -6.472 4.801 1.00 . A A . 43 ARG HD2 1 1 20 14416 1 1 39 ARG HD3 H -4.305 -6.737 3.285 1.00 . A A . 43 ARG HD3 1 1 20 14417 1 1 39 ARG HE H -4.143 -9.198 4.766 1.00 . A A . 43 ARG HE 1 1 20 14418 1 1 39 ARG HG2 H -2.818 -8.784 2.932 1.00 . A A . 43 ARG HG2 1 1 20 14419 1 1 39 ARG HG3 H -1.836 -8.203 4.277 1.00 . A A . 43 ARG HG3 1 1 20 14420 1 1 39 ARG HH11 H -5.729 -6.100 4.757 1.00 . A A . 43 ARG HH11 1 1 20 14421 1 1 39 ARG HH12 H -7.130 -6.690 5.579 1.00 . A A . 43 ARG HH12 1 1 20 14422 1 1 39 ARG HH21 H -5.972 -9.942 5.833 1.00 . A A . 43 ARG HH21 1 1 20 14423 1 1 39 ARG HH22 H -7.270 -8.850 6.185 1.00 . A A . 43 ARG HH22 1 1 20 14424 1 1 39 ARG N N -1.173 -5.041 3.846 1.00 . A A . 43 ARG N 1 1 20 14425 1 1 39 ARG NE N -4.514 -8.292 4.719 1.00 . A A . 43 ARG NE 1 1 20 14426 1 1 39 ARG NH1 N -6.226 -6.852 5.184 1.00 . A A . 43 ARG NH1 1 1 20 14427 1 1 39 ARG NH2 N -6.366 -9.023 5.793 1.00 . A A . 43 ARG NH2 1 1 20 14428 1 1 39 ARG O O 0.581 -4.891 1.730 1.00 . A A . 43 ARG O 1 1 20 14429 1 1 40 LYS C C 3.277 -5.312 1.539 1.00 . A A . 44 LYS C 1 1 20 14430 1 1 40 LYS CA C 2.570 -6.618 1.165 1.00 . A A . 44 LYS CA 1 1 20 14431 1 1 40 LYS CB C 1.923 -6.501 -0.216 1.00 . A A . 44 LYS CB 1 1 20 14432 1 1 40 LYS CD C 2.406 -7.071 -2.600 1.00 . A A . 44 LYS CD 1 1 20 14433 1 1 40 LYS CE C 3.775 -6.611 -3.101 1.00 . A A . 44 LYS CE 1 1 20 14434 1 1 40 LYS CG C 2.526 -7.550 -1.152 1.00 . A A . 44 LYS CG 1 1 20 14435 1 1 40 LYS H H 1.379 -7.739 2.569 1.00 . A A . 44 LYS H 1 1 20 14436 1 1 40 LYS HA H 3.267 -7.440 1.177 1.00 . A A . 44 LYS HA 1 1 20 14437 1 1 40 LYS HB2 H 0.859 -6.665 -0.129 1.00 . A A . 44 LYS HB2 1 1 20 14438 1 1 40 LYS HB3 H 2.104 -5.514 -0.616 1.00 . A A . 44 LYS HB3 1 1 20 14439 1 1 40 LYS HD2 H 2.049 -7.881 -3.219 1.00 . A A . 44 LYS HD2 1 1 20 14440 1 1 40 LYS HD3 H 1.710 -6.247 -2.649 1.00 . A A . 44 LYS HD3 1 1 20 14441 1 1 40 LYS HE2 H 3.690 -5.671 -3.623 1.00 . A A . 44 LYS HE2 1 1 20 14442 1 1 40 LYS HE3 H 4.466 -6.522 -2.276 1.00 . A A . 44 LYS HE3 1 1 20 14443 1 1 40 LYS HG2 H 3.569 -7.696 -0.906 1.00 . A A . 44 LYS HG2 1 1 20 14444 1 1 40 LYS HG3 H 1.996 -8.484 -1.037 1.00 . A A . 44 LYS HG3 1 1 20 14445 1 1 40 LYS HZ1 H 5.017 -7.340 -4.608 1.00 . A A . 44 LYS HZ1 1 1 20 14446 1 1 40 LYS HZ2 H 3.431 -7.948 -4.661 1.00 . A A . 44 LYS HZ2 1 1 20 14447 1 1 40 LYS HZ3 H 4.523 -8.517 -3.490 1.00 . A A . 44 LYS HZ3 1 1 20 14448 1 1 40 LYS N N 1.439 -6.879 2.101 1.00 . A A . 44 LYS N 1 1 20 14449 1 1 40 LYS NZ N 4.220 -7.685 -4.035 1.00 . A A . 44 LYS NZ 1 1 20 14450 1 1 40 LYS O O 3.655 -4.586 0.635 1.00 . A A . 44 LYS O 1 1 20 14451 1 1 40 LYS OXT O 3.424 -5.059 2.724 1.00 . A A . 44 LYS OXT 1 1 20 14452 2 2 1 ACE C C 7.774 14.118 3.018 1.00 . B B . 45 ACE C 1 1 20 14453 2 2 1 ACE CH3 C 6.431 14.696 2.568 1.00 . B B . 45 ACE CH3 1 1 20 14454 2 2 1 ACE H1 H 6.593 15.643 2.077 1.00 . B B . 45 ACE H1 1 1 20 14455 2 2 1 ACE H2 H 5.794 14.840 3.429 1.00 . B B . 45 ACE H2 1 1 20 14456 2 2 1 ACE H3 H 5.956 14.010 1.882 1.00 . B B . 45 ACE H3 1 1 20 14457 2 2 1 ACE O O 8.778 14.801 3.016 1.00 . B B . 45 ACE O 1 1 20 14458 2 2 2 PRO C C 7.044 11.226 1.673 1.00 . B B . 46 PRO C 1 1 20 14459 2 2 2 PRO CA C 8.221 11.819 2.454 1.00 . B B . 46 PRO CA 1 1 20 14460 2 2 2 PRO CB C 8.852 10.768 3.362 1.00 . B B . 46 PRO CB 1 1 20 14461 2 2 2 PRO CD C 7.806 12.403 4.787 1.00 . B B . 46 PRO CD 1 1 20 14462 2 2 2 PRO CG C 8.180 10.949 4.682 1.00 . B B . 46 PRO CG 1 1 20 14463 2 2 2 PRO HA H 8.962 12.219 1.781 1.00 . B B . 46 PRO HA 1 1 20 14464 2 2 2 PRO HB2 H 8.666 9.776 2.974 1.00 . B B . 46 PRO HB2 1 1 20 14465 2 2 2 PRO HB3 H 9.912 10.942 3.460 1.00 . B B . 46 PRO HB3 1 1 20 14466 2 2 2 PRO HD2 H 6.843 12.510 5.268 1.00 . B B . 46 PRO HD2 1 1 20 14467 2 2 2 PRO HD3 H 8.563 12.950 5.326 1.00 . B B . 46 PRO HD3 1 1 20 14468 2 2 2 PRO HG2 H 7.294 10.331 4.731 1.00 . B B . 46 PRO HG2 1 1 20 14469 2 2 2 PRO HG3 H 8.857 10.689 5.480 1.00 . B B . 46 PRO HG3 1 1 20 14470 2 2 2 PRO N N 7.743 12.867 3.393 1.00 . B B . 46 PRO N 1 1 20 14471 2 2 2 PRO O O 7.067 11.145 0.462 1.00 . B B . 46 PRO O 1 1 20 14472 2 2 3 LEU C C 4.345 11.177 0.558 1.00 . B B . 47 LEU C 1 1 20 14473 2 2 3 LEU CA C 4.836 10.224 1.658 1.00 . B B . 47 LEU CA 1 1 20 14474 2 2 3 LEU CB C 3.776 10.062 2.749 1.00 . B B . 47 LEU CB 1 1 20 14475 2 2 3 LEU CD1 C 1.986 8.412 3.305 1.00 . B B . 47 LEU CD1 1 1 20 14476 2 2 3 LEU CD2 C 1.525 10.255 1.680 1.00 . B B . 47 LEU CD2 1 1 20 14477 2 2 3 LEU CG C 2.586 9.278 2.195 1.00 . B B . 47 LEU CG 1 1 20 14478 2 2 3 LEU H H 6.015 10.885 3.337 1.00 . B B . 47 LEU H 1 1 20 14479 2 2 3 LEU HA H 5.087 9.260 1.247 1.00 . B B . 47 LEU HA 1 1 20 14480 2 2 3 LEU HB2 H 4.201 9.526 3.585 1.00 . B B . 47 LEU HB2 1 1 20 14481 2 2 3 LEU HB3 H 3.445 11.037 3.076 1.00 . B B . 47 LEU HB3 1 1 20 14482 2 2 3 LEU HD11 H 0.920 8.323 3.155 1.00 . B B . 47 LEU HD11 1 1 20 14483 2 2 3 LEU HD12 H 2.177 8.872 4.262 1.00 . B B . 47 LEU HD12 1 1 20 14484 2 2 3 LEU HD13 H 2.436 7.431 3.280 1.00 . B B . 47 LEU HD13 1 1 20 14485 2 2 3 LEU HD21 H 1.953 10.872 0.903 1.00 . B B . 47 LEU HD21 1 1 20 14486 2 2 3 LEU HD22 H 1.189 10.881 2.493 1.00 . B B . 47 LEU HD22 1 1 20 14487 2 2 3 LEU HD23 H 0.688 9.700 1.280 1.00 . B B . 47 LEU HD23 1 1 20 14488 2 2 3 LEU HG H 2.916 8.646 1.383 1.00 . B B . 47 LEU HG 1 1 20 14489 2 2 3 LEU N N 6.013 10.811 2.360 1.00 . B B . 47 LEU N 1 1 20 14490 2 2 3 LEU O O 4.163 12.354 0.806 1.00 . B B . 47 LEU O 1 1 20 14491 2 2 4 PRO C C 2.199 11.849 -1.590 1.00 . B B . 48 PRO C 1 1 20 14492 2 2 4 PRO CA C 3.683 11.487 -1.760 1.00 . B B . 48 PRO CA 1 1 20 14493 2 2 4 PRO CB C 3.885 10.592 -2.981 1.00 . B B . 48 PRO CB 1 1 20 14494 2 2 4 PRO CD C 4.339 9.246 -1.027 1.00 . B B . 48 PRO CD 1 1 20 14495 2 2 4 PRO CG C 3.844 9.195 -2.449 1.00 . B B . 48 PRO CG 1 1 20 14496 2 2 4 PRO HA H 4.289 12.374 -1.849 1.00 . B B . 48 PRO HA 1 1 20 14497 2 2 4 PRO HB2 H 3.089 10.746 -3.694 1.00 . B B . 48 PRO HB2 1 1 20 14498 2 2 4 PRO HB3 H 4.843 10.792 -3.437 1.00 . B B . 48 PRO HB3 1 1 20 14499 2 2 4 PRO HD2 H 3.754 8.590 -0.399 1.00 . B B . 48 PRO HD2 1 1 20 14500 2 2 4 PRO HD3 H 5.385 8.978 -0.984 1.00 . B B . 48 PRO HD3 1 1 20 14501 2 2 4 PRO HG2 H 2.831 8.821 -2.472 1.00 . B B . 48 PRO HG2 1 1 20 14502 2 2 4 PRO HG3 H 4.484 8.557 -3.038 1.00 . B B . 48 PRO HG3 1 1 20 14503 2 2 4 PRO N N 4.149 10.649 -0.628 1.00 . B B . 48 PRO N 1 1 20 14504 2 2 4 PRO O O 1.404 11.013 -1.213 1.00 . B B . 48 PRO O 1 1 20 14505 2 2 5 PRO C C -0.384 12.979 -2.893 1.00 . B B . 49 PRO C 1 1 20 14506 2 2 5 PRO CA C 0.462 13.539 -1.745 1.00 . B B . 49 PRO CA 1 1 20 14507 2 2 5 PRO CB C 0.560 15.058 -1.839 1.00 . B B . 49 PRO CB 1 1 20 14508 2 2 5 PRO CD C 2.754 14.169 -2.333 1.00 . B B . 49 PRO CD 1 1 20 14509 2 2 5 PRO CG C 1.818 15.320 -2.603 1.00 . B B . 49 PRO CG 1 1 20 14510 2 2 5 PRO HA H 0.053 13.251 -0.791 1.00 . B B . 49 PRO HA 1 1 20 14511 2 2 5 PRO HB2 H -0.292 15.458 -2.371 1.00 . B B . 49 PRO HB2 1 1 20 14512 2 2 5 PRO HB3 H 0.623 15.491 -0.852 1.00 . B B . 49 PRO HB3 1 1 20 14513 2 2 5 PRO HD2 H 3.268 13.879 -3.238 1.00 . B B . 49 PRO HD2 1 1 20 14514 2 2 5 PRO HD3 H 3.463 14.431 -1.561 1.00 . B B . 49 PRO HD3 1 1 20 14515 2 2 5 PRO HG2 H 1.602 15.379 -3.661 1.00 . B B . 49 PRO HG2 1 1 20 14516 2 2 5 PRO HG3 H 2.267 16.244 -2.268 1.00 . B B . 49 PRO HG3 1 1 20 14517 2 2 5 PRO N N 1.869 13.088 -1.874 1.00 . B B . 49 PRO N 1 1 20 14518 2 2 5 PRO O O -0.028 13.088 -4.050 1.00 . B B . 49 PRO O 1 1 20 14519 2 2 6 TYR C C -2.821 12.925 -4.608 1.00 . B B . 50 TYR C 1 1 20 14520 2 2 6 TYR CA C -2.363 11.813 -3.661 1.00 . B B . 50 TYR CA 1 1 20 14521 2 2 6 TYR CB C -3.561 11.202 -2.933 1.00 . B B . 50 TYR CB 1 1 20 14522 2 2 6 TYR CD1 C -4.919 10.747 -5.007 1.00 . B B . 50 TYR CD1 1 1 20 14523 2 2 6 TYR CD2 C -4.321 8.885 -3.573 1.00 . B B . 50 TYR CD2 1 1 20 14524 2 2 6 TYR CE1 C -5.590 9.869 -5.868 1.00 . B B . 50 TYR CE1 1 1 20 14525 2 2 6 TYR CE2 C -4.991 8.008 -4.433 1.00 . B B . 50 TYR CE2 1 1 20 14526 2 2 6 TYR CG C -4.285 10.255 -3.860 1.00 . B B . 50 TYR CG 1 1 20 14527 2 2 6 TYR CZ C -5.627 8.499 -5.581 1.00 . B B . 50 TYR CZ 1 1 20 14528 2 2 6 TYR H H -1.771 12.298 -1.646 1.00 . B B . 50 TYR H 1 1 20 14529 2 2 6 TYR HA H -1.834 11.048 -4.207 1.00 . B B . 50 TYR HA 1 1 20 14530 2 2 6 TYR HB2 H -3.216 10.662 -2.063 1.00 . B B . 50 TYR HB2 1 1 20 14531 2 2 6 TYR HB3 H -4.234 11.987 -2.625 1.00 . B B . 50 TYR HB3 1 1 20 14532 2 2 6 TYR HD1 H -4.893 11.802 -5.229 1.00 . B B . 50 TYR HD1 1 1 20 14533 2 2 6 TYR HD2 H -3.832 8.506 -2.689 1.00 . B B . 50 TYR HD2 1 1 20 14534 2 2 6 TYR HE1 H -6.079 10.248 -6.752 1.00 . B B . 50 TYR HE1 1 1 20 14535 2 2 6 TYR HE2 H -5.018 6.951 -4.212 1.00 . B B . 50 TYR HE2 1 1 20 14536 2 2 6 TYR HH H -5.731 7.489 -7.198 1.00 . B B . 50 TYR HH 1 1 20 14537 2 2 6 TYR N N -1.500 12.378 -2.584 1.00 . B B . 50 TYR N 1 1 20 14538 2 2 6 TYR O O -3.433 13.867 -4.132 1.00 . B B . 50 TYR O 1 1 20 14539 2 2 6 TYR OXT O -2.553 12.815 -5.793 1.00 . B B . 50 TYR OXT 1 1 20 14540 2 2 6 TYR OH O -6.285 7.634 -6.428 1.00 . B B . 50 TYR OH 1 1 stop_ save_
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