NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
434977 | 2jyd | cing | 4-filtered-FRED | STAR | entry | full | 205 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2jyd # This FRED archive file contains, for PDB entry <2jyd>: # # - 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_2jyd _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2jyd _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all other bound" _Assembly.Molecular_mass 4708.62 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 $F5_domain_of_Myelin_transcription_factor_1 A . 1 1 2 . 2 $ZINC_ION B . 1 1 stop_ loop_ _PDBX_nonpoly_scheme.Entity_assembly_ID _PDBX_nonpoly_scheme.Entity_ID _PDBX_nonpoly_scheme.Mon_ID _PDBX_nonpoly_scheme.Comp_index_ID _PDBX_nonpoly_scheme.Comp_ID _PDBX_nonpoly_scheme.Entry_ID _PDBX_nonpoly_scheme.Assembly_ID 2 2 ZN 1 ZN 1 1 stop_ save_ save_F5_domain_of_Myelin_transcription_factor_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "F5 domain of Myelin transcription factor 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GSMAAHSADLKCPTPGCDGSGHITGNYASHRSLSGCPRAKKSGLRV _Entity.Number_of_monomers 46 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 SER . 1 1 3 MET . 1 1 4 ALA . 1 1 5 ALA . 1 1 6 HIS . 1 1 7 SER . 1 1 8 ALA . 1 1 9 ASP . 1 1 10 LEU . 1 1 11 LYS . 1 1 12 CYS . 1 1 13 PRO . 1 1 14 THR . 1 1 15 PRO . 1 1 16 GLY . 1 1 17 CYS . 1 1 18 ASP . 1 1 19 GLY . 1 1 20 SER . 1 1 21 GLY . 1 1 22 HIS . 1 1 23 ILE . 1 1 24 THR . 1 1 25 GLY . 1 1 26 ASN . 1 1 27 TYR . 1 1 28 ALA . 1 1 29 SER . 1 1 30 HIS . 1 1 31 ARG . 1 1 32 SER . 1 1 33 LEU . 1 1 34 SER . 1 1 35 GLY . 1 1 36 CYS . 1 1 37 PRO . 1 1 38 ARG . 1 1 39 ALA . 1 1 40 LYS . 1 1 41 LYS . 1 1 42 SER . 1 1 43 GLY . 1 1 44 LEU . 1 1 45 ARG . 1 1 46 VAL . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 SER 2 2 1 1 MET 3 3 1 1 ALA 4 4 1 1 ALA 5 5 1 1 HIS 6 6 1 1 SER 7 7 1 1 ALA 8 8 1 1 ASP 9 9 1 1 LEU 10 10 1 1 LYS 11 11 1 1 CYS 12 12 1 1 PRO 13 13 1 1 THR 14 14 1 1 PRO 15 15 1 1 GLY 16 16 1 1 CYS 17 17 1 1 ASP 18 18 1 1 GLY 19 19 1 1 SER 20 20 1 1 GLY 21 21 1 1 HIS 22 22 1 1 ILE 23 23 1 1 THR 24 24 1 1 GLY 25 25 1 1 ASN 26 26 1 1 TYR 27 27 1 1 ALA 28 28 1 1 SER 29 29 1 1 HIS 30 30 1 1 ARG 31 31 1 1 SER 32 32 1 1 LEU 33 33 1 1 SER 34 34 1 1 GLY 35 35 1 1 CYS 36 36 1 1 PRO 37 37 1 1 ARG 38 38 1 1 ALA 39 39 1 1 LYS 40 40 1 1 LYS 41 41 1 1 SER 42 42 1 1 GLY 43 43 1 1 LEU 44 44 1 1 ARG 45 45 1 1 VAL 46 46 1 1 stop_ save_ save_ZINC_ION _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "ZINC ION" _Entity.Type non-polymer 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 ZN $ZN 1 2 stop_ save_ save_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID ZN _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 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 8 ALA H . 8 . HN 1 1 1 1 2 1 1 9 ASP H . 9 . HN 1 1 2 1 1 1 1 8 ALA HA . 8 . HA 1 1 2 1 2 1 1 9 ASP H . 9 . HN 1 1 3 1 1 1 1 8 ALA MB . 8 . HB# 1 1 3 1 2 1 1 9 ASP H . 9 . HN 1 1 4 1 1 1 1 9 ASP HA . 9 . HA 1 1 4 1 2 1 1 10 LEU H . 10 . HN 1 1 5 1 1 1 1 9 ASP HA . 9 . HA 1 1 5 1 2 1 1 11 LYS H . 11 . HN 1 1 6 1 1 1 1 9 ASP HA . 9 . HA 1 1 6 1 2 1 1 12 CYS H . 12 . HN 1 1 7 1 1 1 1 9 ASP QB . 9 . HB2 1 1 7 1 2 1 1 10 LEU H . 10 . HN 1 1 8 1 1 1 1 9 ASP QB . 9 . HB2 1 1 8 1 2 1 1 11 LYS H . 11 . HN 1 1 9 1 1 1 1 10 LEU H . 10 . HN 1 1 9 1 2 1 1 11 LYS H . 11 . HN 1 1 10 1 1 1 1 10 LEU QB . 10 . HB# 1 1 10 1 2 1 1 11 LYS H . 11 . HN 1 1 11 1 1 1 1 10 LEU QD . 10 . HD1# 1 1 11 1 2 1 1 11 LYS H . 11 . HN 1 1 12 1 1 1 1 10 LEU HG . 10 . HG 1 1 12 1 2 1 1 11 LYS H . 11 . HN 1 1 13 1 1 1 1 11 LYS H . 11 . HN 1 1 13 1 2 1 1 11 LYS QD . 11 . HD# 1 1 14 1 1 1 1 11 LYS H . 11 . HN 1 1 14 1 2 1 1 11 LYS QE . 11 . HE# 1 1 15 1 1 1 1 11 LYS H . 11 . HN 1 1 15 1 2 1 1 12 CYS H . 12 . HN 1 1 16 1 1 1 1 11 LYS HA . 11 . HA 1 1 16 1 2 1 1 11 LYS QE . 11 . HE# 1 1 17 1 1 1 1 11 LYS HA . 11 . HA 1 1 17 1 2 1 1 12 CYS H . 12 . HN 1 1 18 1 1 1 1 11 LYS QB . 11 . HB# 1 1 18 1 2 1 1 12 CYS H . 12 . HN 1 1 19 1 1 1 1 11 LYS QD . 11 . HD# 1 1 19 1 2 1 1 12 CYS H . 12 . HN 1 1 20 1 1 1 1 11 LYS QE . 11 . HE# 1 1 20 1 2 1 1 18 ASP H . 18 . HN 1 1 21 1 1 1 1 11 LYS QG . 11 . HG2 1 1 21 1 2 1 1 12 CYS H . 12 . HN 1 1 22 1 1 1 1 12 CYS H . 12 . HN 1 1 22 1 2 1 1 13 PRO QD . 13 . HD2 1 1 23 1 1 1 1 12 CYS H . 12 . HN 1 1 23 1 2 1 1 30 HIS HD2 . 30 . HD2 1 1 24 1 1 1 1 12 CYS HA . 12 . HA 1 1 24 1 2 1 1 13 PRO QD . 13 . HD2 1 1 25 1 1 1 1 12 CYS HA . 12 . HA 1 1 25 1 2 1 1 14 THR H . 14 . HN 1 1 26 1 1 1 1 12 CYS HA . 12 . HA 1 1 26 1 2 1 1 30 HIS HD2 . 30 . HD2 1 1 27 1 1 1 1 12 CYS HA . 12 . HA 1 1 27 1 2 1 1 33 LEU HG . 33 . HG 1 1 28 1 1 1 1 12 CYS QB . 12 . HB2 1 1 28 1 2 1 1 14 THR H . 14 . HN 1 1 29 1 1 1 1 12 CYS QB . 12 . HB2 1 1 29 1 2 1 1 30 HIS HD2 . 30 . HD2 1 1 30 1 1 1 1 12 CYS QB . 12 . HB2 1 1 30 1 2 1 1 32 SER H . 32 . HN 1 1 31 1 1 1 1 13 PRO HA . 13 . HA 1 1 31 1 2 1 1 14 THR H . 14 . HN 1 1 32 1 1 1 1 13 PRO QB . 13 . HB2 1 1 32 1 2 1 1 14 THR H . 14 . HN 1 1 33 1 1 1 1 13 PRO QB . 13 . HB2 1 1 33 1 2 1 1 33 LEU H . 33 . HN 1 1 34 1 1 1 1 13 PRO QB . 13 . HB2 1 1 34 1 2 1 1 33 LEU QD . 33 . HD2# 1 1 35 1 1 1 1 13 PRO QG . 13 . HG# 1 1 35 1 2 1 1 14 THR H . 14 . HN 1 1 36 1 1 1 1 13 PRO QG . 13 . HG# 1 1 36 1 2 1 1 33 LEU H . 33 . HN 1 1 37 1 1 1 1 13 PRO QG . 13 . HG# 1 1 37 1 2 1 1 33 LEU QD . 33 . HD2# 1 1 38 1 1 1 1 14 THR H . 14 . HN 1 1 38 1 2 1 1 33 LEU QD . 33 . HD1# 1 1 39 1 1 1 1 14 THR HA . 14 . HA 1 1 39 1 2 1 1 17 CYS H . 17 . HN 1 1 40 1 1 1 1 14 THR MG . 14 . HG2# 1 1 40 1 2 1 1 15 PRO QD . 15 . HD# 1 1 41 1 1 1 1 14 THR MG . 14 . HG2# 1 1 41 1 2 1 1 17 CYS H . 17 . HN 1 1 42 1 1 1 1 14 THR MG . 14 . HG2# 1 1 42 1 2 1 1 17 CYS QB . 17 . HB2 1 1 43 1 1 1 1 14 THR MG . 14 . HG2# 1 1 43 1 2 1 1 18 ASP H . 18 . HN 1 1 44 1 1 1 1 14 THR MG . 14 . HG2# 1 1 44 1 2 1 1 33 LEU QB . 33 . HB# 1 1 45 1 1 1 1 14 THR MG . 14 . HG2# 1 1 45 1 2 1 1 39 ALA H . 39 . HN 1 1 46 1 1 1 1 14 THR MG . 14 . HG2# 1 1 46 1 2 1 1 39 ALA HA . 39 . HA 1 1 47 1 1 1 1 14 THR MG . 14 . HG2# 1 1 47 1 2 1 1 40 LYS H . 40 . HN 1 1 48 1 1 1 1 15 PRO QB . 15 . HB2 1 1 48 1 2 1 1 16 GLY H . 16 . HN 1 1 49 1 1 1 1 16 GLY H . 16 . HN 1 1 49 1 2 1 1 17 CYS H . 17 . HN 1 1 50 1 1 1 1 16 GLY QA . 16 . HA1 1 1 50 1 2 1 1 17 CYS H . 17 . HN 1 1 51 1 1 1 1 17 CYS HA . 17 . HA 1 1 51 1 2 1 1 18 ASP H . 18 . HN 1 1 52 1 1 1 1 17 CYS HA . 17 . HA 1 1 52 1 2 1 1 19 GLY H . 19 . HN 1 1 53 1 1 1 1 17 CYS QB . 17 . HB2 1 1 53 1 2 1 1 18 ASP H . 18 . HN 1 1 54 1 1 1 1 17 CYS QB . 17 . HB2 1 1 54 1 2 1 1 33 LEU QD . 33 . HD1# 1 1 55 1 1 1 1 18 ASP H . 18 . HN 1 1 55 1 2 1 1 19 GLY H . 19 . HN 1 1 56 1 1 1 1 18 ASP H . 18 . HN 1 1 56 1 2 1 1 20 SER H . 20 . HN 1 1 57 1 1 1 1 18 ASP H . 18 . HN 1 1 57 1 2 1 1 38 ARG QD . 38 . HD2 1 1 58 1 1 1 1 18 ASP HA . 18 . HA 1 1 58 1 2 1 1 19 GLY H . 19 . HN 1 1 59 1 1 1 1 18 ASP QB . 18 . HB2 1 1 59 1 2 1 1 19 GLY H . 19 . HN 1 1 60 1 1 1 1 19 GLY H . 19 . HN 1 1 60 1 2 1 1 20 SER H . 20 . HN 1 1 61 1 1 1 1 19 GLY QA . 19 . HA2 1 1 61 1 2 1 1 30 HIS H . 30 . HN 1 1 62 1 1 1 1 20 SER HA . 20 . HA 1 1 62 1 2 1 1 21 GLY H . 21 . HN 1 1 63 1 1 1 1 20 SER HA . 20 . HA 1 1 63 1 2 1 1 29 SER HA . 29 . HA 1 1 64 1 1 1 1 20 SER HA . 20 . HA 1 1 64 1 2 1 1 30 HIS H . 30 . HN 1 1 65 1 1 1 1 20 SER QB . 20 . HB# 1 1 65 1 2 1 1 21 GLY H . 21 . HN 1 1 66 1 1 1 1 21 GLY H . 21 . HN 1 1 66 1 2 1 1 22 HIS H . 22 . HN 1 1 67 1 1 1 1 21 GLY H . 21 . HN 1 1 67 1 2 1 1 29 SER HA . 29 . HA 1 1 68 1 1 1 1 21 GLY H . 21 . HN 1 1 68 1 2 1 1 29 SER QB . 29 . HB2 1 1 69 1 1 1 1 21 GLY H . 21 . HN 1 1 69 1 2 1 1 30 HIS H . 30 . HN 1 1 70 1 1 1 1 21 GLY QA . 21 . HA2 1 1 70 1 2 1 1 22 HIS H . 22 . HN 1 1 71 1 1 1 1 21 GLY QA . 21 . HA2 1 1 71 1 2 1 1 29 SER HA . 29 . HA 1 1 72 1 1 1 1 21 GLY QA . 21 . HA2 1 1 72 1 2 1 1 37 PRO QG . 37 . HG# 1 1 73 1 1 1 1 22 HIS H . 22 . HN 1 1 73 1 2 1 1 23 ILE H . 23 . HN 1 1 74 1 1 1 1 22 HIS H . 22 . HN 1 1 74 1 2 1 1 37 PRO HA . 37 . HA 1 1 75 1 1 1 1 22 HIS HA . 22 . HA 1 1 75 1 2 1 1 23 ILE H . 23 . HN 1 1 76 1 1 1 1 22 HIS HA . 22 . HA 1 1 76 1 2 1 1 23 ILE HB . 23 . HB 1 1 77 1 1 1 1 22 HIS QB . 22 . HB2 1 1 77 1 2 1 1 23 ILE H . 23 . HN 1 1 78 1 1 1 1 22 HIS QB . 22 . HB2 1 1 78 1 2 1 1 24 THR H . 24 . HN 1 1 79 1 1 1 1 22 HIS QB . 22 . HB2 1 1 79 1 2 1 1 25 GLY H . 25 . HN 1 1 80 1 1 1 1 22 HIS HD2 . 22 . HD2 1 1 80 1 2 1 1 30 HIS HA . 30 . HA 1 1 81 1 1 1 1 22 HIS HE1 . 22 . HE1 1 1 81 1 2 1 1 24 THR H . 24 . HN 1 1 82 1 1 1 1 22 HIS HE1 . 22 . HE1 1 1 82 1 2 1 1 24 THR HB . 24 . HB 1 1 83 1 1 1 1 22 HIS HE1 . 22 . HE1 1 1 83 1 2 1 1 27 TYR QD . 27 . HD# 1 1 84 1 1 1 1 22 HIS HE1 . 22 . HE1 1 1 84 1 2 1 1 27 TYR QE . 27 . HE# 1 1 85 1 1 1 1 22 HIS HE1 . 22 . HE1 1 1 85 1 2 1 1 30 HIS QB . 30 . HB2 1 1 86 1 1 1 1 23 ILE H . 23 . HN 1 1 86 1 2 1 1 24 THR H . 24 . HN 1 1 87 1 1 1 1 23 ILE H . 23 . HN 1 1 87 1 2 1 1 35 GLY H . 35 . HN 1 1 88 1 1 1 1 23 ILE H . 23 . HN 1 1 88 1 2 1 1 36 CYS H . 36 . HN 1 1 89 1 1 1 1 23 ILE H . 23 . HN 1 1 89 1 2 1 1 36 CYS QB . 36 . HB2 1 1 90 1 1 1 1 23 ILE H . 23 . HN 1 1 90 1 2 1 1 37 PRO QD . 37 . HD2 1 1 91 1 1 1 1 23 ILE HA . 23 . HA 1 1 91 1 2 1 1 24 THR H . 24 . HN 1 1 92 1 1 1 1 23 ILE HA . 23 . HA 1 1 92 1 2 1 1 24 THR MG . 24 . HG2# 1 1 93 1 1 1 1 23 ILE HA . 23 . HA 1 1 93 1 2 1 1 25 GLY H . 25 . HN 1 1 94 1 1 1 1 23 ILE HB . 23 . HB 1 1 94 1 2 1 1 24 THR H . 24 . HN 1 1 95 1 1 1 1 23 ILE MD . 23 . HD1# 1 1 95 1 2 1 1 24 THR H . 24 . HN 1 1 96 1 1 1 1 23 ILE MD . 23 . HD1# 1 1 96 1 2 1 1 25 GLY H . 25 . HN 1 1 97 1 1 1 1 23 ILE MG . 23 . HG2# 1 1 97 1 2 1 1 24 THR H . 24 . HN 1 1 98 1 1 1 1 23 ILE MG . 23 . HG2# 1 1 98 1 2 1 1 25 GLY H . 25 . HN 1 1 99 1 1 1 1 24 THR H . 24 . HN 1 1 99 1 2 1 1 25 GLY H . 25 . HN 1 1 100 1 1 1 1 24 THR HA . 24 . HA 1 1 100 1 2 1 1 25 GLY H . 25 . HN 1 1 101 1 1 1 1 24 THR HA . 24 . HA 1 1 101 1 2 1 1 26 ASN H . 26 . HN 1 1 102 1 1 1 1 24 THR HA . 24 . HA 1 1 102 1 2 1 1 26 ASN QD . 26 . HD22 1 1 103 1 1 1 1 24 THR HA . 24 . HA 1 1 103 1 2 1 1 27 TYR QD . 27 . HD# 1 1 104 1 1 1 1 24 THR HB . 24 . HB 1 1 104 1 2 1 1 25 GLY H . 25 . HN 1 1 105 1 1 1 1 24 THR HB . 24 . HB 1 1 105 1 2 1 1 26 ASN H . 26 . HN 1 1 106 1 1 1 1 24 THR HB . 24 . HB 1 1 106 1 2 1 1 27 TYR QD . 27 . HD# 1 1 107 1 1 1 1 24 THR MG . 24 . HG2# 1 1 107 1 2 1 1 25 GLY H . 25 . HN 1 1 108 1 1 1 1 24 THR MG . 24 . HG2# 1 1 108 1 2 1 1 26 ASN QD . 26 . HD21 1 1 109 1 1 1 1 24 THR MG . 24 . HG2# 1 1 109 1 2 1 1 27 TYR HA . 27 . HA 1 1 110 1 1 1 1 24 THR MG . 24 . HG2# 1 1 110 1 2 1 1 27 TYR QD . 27 . HD# 1 1 111 1 1 1 1 24 THR MG . 24 . HG2# 1 1 111 1 2 1 1 27 TYR QE . 27 . HE# 1 1 112 1 1 1 1 25 GLY H . 25 . HN 1 1 112 1 2 1 1 26 ASN H . 26 . HN 1 1 113 1 1 1 1 25 GLY H . 25 . HN 1 1 113 1 2 1 1 27 TYR H . 27 . HN 1 1 114 1 1 1 1 25 GLY QA . 25 . HA2 1 1 114 1 2 1 1 26 ASN H . 26 . HN 1 1 115 1 1 1 1 25 GLY QA . 25 . HA2 1 1 115 1 2 1 1 27 TYR H . 27 . HN 1 1 116 1 1 1 1 26 ASN H . 26 . HN 1 1 116 1 2 1 1 27 TYR H . 27 . HN 1 1 117 1 1 1 1 26 ASN H . 26 . HN 1 1 117 1 2 1 1 27 TYR QD . 27 . HD# 1 1 118 1 1 1 1 26 ASN HA . 26 . HA 1 1 118 1 2 1 1 27 TYR H . 27 . HN 1 1 119 1 1 1 1 26 ASN QB . 26 . HB2 1 1 119 1 2 1 1 27 TYR H . 27 . HN 1 1 120 1 1 1 1 26 ASN QB . 26 . HB2 1 1 120 1 2 1 1 27 TYR QD . 27 . HD# 1 1 121 1 1 1 1 26 ASN QB . 26 . HB2 1 1 121 1 2 1 1 27 TYR QE . 27 . HE# 1 1 122 1 1 1 1 27 TYR H . 27 . HN 1 1 122 1 2 1 1 28 ALA H . 28 . HN 1 1 123 1 1 1 1 27 TYR HA . 27 . HA 1 1 123 1 2 1 1 27 TYR QE . 27 . HE# 1 1 124 1 1 1 1 27 TYR HA . 27 . HA 1 1 124 1 2 1 1 28 ALA H . 28 . HN 1 1 125 1 1 1 1 27 TYR HA . 27 . HA 1 1 125 1 2 1 1 28 ALA MB . 28 . HB# 1 1 126 1 1 1 1 27 TYR HA . 27 . HA 1 1 126 1 2 1 1 29 SER H . 29 . HN 1 1 127 1 1 1 1 27 TYR QB . 27 . HB2 1 1 127 1 2 1 1 28 ALA H . 28 . HN 1 1 128 1 1 1 1 27 TYR QB . 27 . HB2 1 1 128 1 2 1 1 29 SER H . 29 . HN 1 1 129 1 1 1 1 27 TYR QD . 27 . HD# 1 1 129 1 2 1 1 28 ALA H . 28 . HN 1 1 130 1 1 1 1 27 TYR QD . 27 . HD# 1 1 130 1 2 1 1 29 SER H . 29 . HN 1 1 131 1 1 1 1 28 ALA H . 28 . HN 1 1 131 1 2 1 1 29 SER H . 29 . HN 1 1 132 1 1 1 1 28 ALA HA . 28 . HA 1 1 132 1 2 1 1 29 SER H . 29 . HN 1 1 133 1 1 1 1 28 ALA MB . 28 . HB# 1 1 133 1 2 1 1 29 SER H . 29 . HN 1 1 134 1 1 1 1 29 SER H . 29 . HN 1 1 134 1 2 1 1 30 HIS H . 30 . HN 1 1 135 1 1 1 1 29 SER HA . 29 . HA 1 1 135 1 2 1 1 30 HIS H . 30 . HN 1 1 136 1 1 1 1 29 SER QB . 29 . HB2 1 1 136 1 2 1 1 30 HIS H . 30 . HN 1 1 137 1 1 1 1 29 SER QB . 29 . HB2 1 1 137 1 2 1 1 31 ARG HE . 31 . HE 1 1 138 1 1 1 1 30 HIS H . 30 . HN 1 1 138 1 2 1 1 30 HIS HE1 . 30 . HE1 1 1 139 1 1 1 1 30 HIS HA . 30 . HA 1 1 139 1 2 1 1 32 SER H . 32 . HN 1 1 140 1 1 1 1 30 HIS HA . 30 . HA 1 1 140 1 2 1 1 35 GLY H . 35 . HN 1 1 141 1 1 1 1 30 HIS QB . 30 . HB2 1 1 141 1 2 1 1 32 SER H . 32 . HN 1 1 142 1 1 1 1 30 HIS HD2 . 30 . HD2 1 1 142 1 2 1 1 32 SER H . 32 . HN 1 1 143 1 1 1 1 30 HIS HD2 . 30 . HD2 1 1 143 1 2 1 1 32 SER HA . 32 . HA 1 1 144 1 1 1 1 30 HIS HD2 . 30 . HD2 1 1 144 1 2 1 1 33 LEU QD . 33 . HD1# 1 1 145 1 1 1 1 30 HIS HD2 . 30 . HD2 1 1 145 1 2 1 1 37 PRO QD . 37 . HD2 1 1 146 1 1 1 1 31 ARG HA . 31 . HA 1 1 146 1 2 1 1 31 ARG HE . 31 . HE 1 1 147 1 1 1 1 31 ARG HA . 31 . HA 1 1 147 1 2 1 1 32 SER H . 32 . HN 1 1 148 1 1 1 1 32 SER H . 32 . HN 1 1 148 1 2 1 1 33 LEU H . 33 . HN 1 1 149 1 1 1 1 32 SER HA . 32 . HA 1 1 149 1 2 1 1 33 LEU H . 33 . HN 1 1 150 1 1 1 1 32 SER QB . 32 . HB2 1 1 150 1 2 1 1 33 LEU H . 33 . HN 1 1 151 1 1 1 1 33 LEU H . 33 . HN 1 1 151 1 2 1 1 34 SER H . 34 . HN 1 1 152 1 1 1 1 33 LEU HA . 33 . HA 1 1 152 1 2 1 1 34 SER H . 34 . HN 1 1 153 1 1 1 1 33 LEU QB . 33 . HB# 1 1 153 1 2 1 1 34 SER H . 34 . HN 1 1 154 1 1 1 1 33 LEU QD . 33 . HD1# 1 1 154 1 2 1 1 34 SER H . 34 . HN 1 1 155 1 1 1 1 33 LEU QD . 33 . HD1# 1 1 155 1 2 1 1 36 CYS QB . 36 . HB2 1 1 156 1 1 1 1 33 LEU QD . 33 . HD1# 1 1 156 1 2 1 1 39 ALA MB . 39 . HB# 1 1 157 1 1 1 1 33 LEU QD . 33 . HD1# 1 1 157 1 2 1 1 40 LYS QE . 40 . HE# 1 1 158 1 1 1 1 33 LEU HG . 33 . HG 1 1 158 1 2 1 1 34 SER H . 34 . HN 1 1 159 1 1 1 1 34 SER H . 34 . HN 1 1 159 1 2 1 1 35 GLY H . 35 . HN 1 1 160 1 1 1 1 34 SER HA . 34 . HA 1 1 160 1 2 1 1 35 GLY H . 35 . HN 1 1 161 1 1 1 1 34 SER QB . 34 . HB# 1 1 161 1 2 1 1 35 GLY H . 35 . HN 1 1 162 1 1 1 1 34 SER QB . 34 . HB# 1 1 162 1 2 1 1 36 CYS H . 36 . HN 1 1 163 1 1 1 1 35 GLY QA . 35 . HA# 1 1 163 1 2 1 1 36 CYS H . 36 . HN 1 1 164 1 1 1 1 36 CYS H . 36 . HN 1 1 164 1 2 1 1 39 ALA MB . 39 . HB# 1 1 165 1 1 1 1 36 CYS HA . 36 . HA 1 1 165 1 2 1 1 37 PRO QD . 37 . HD2 1 1 166 1 1 1 1 37 PRO HA . 37 . HA 1 1 166 1 2 1 1 38 ARG H . 38 . HN 1 1 167 1 1 1 1 37 PRO HA . 37 . HA 1 1 167 1 2 1 1 38 ARG QG . 38 . HG# 1 1 168 1 1 1 1 37 PRO QB . 37 . HB# 1 1 168 1 2 1 1 38 ARG H . 38 . HN 1 1 169 1 1 1 1 37 PRO QB . 37 . HB# 1 1 169 1 2 1 1 38 ARG QB . 38 . HB2 1 1 170 1 1 1 1 37 PRO QB . 37 . HB# 1 1 170 1 2 1 1 38 ARG HE . 38 . HE 1 1 171 1 1 1 1 37 PRO QD . 37 . HD2 1 1 171 1 2 1 1 38 ARG H . 38 . HN 1 1 172 1 1 1 1 37 PRO QD . 37 . HD2 1 1 172 1 2 1 1 38 ARG QB . 38 . HB2 1 1 173 1 1 1 1 37 PRO QD . 37 . HD2 1 1 173 1 2 1 1 38 ARG QG . 38 . HG# 1 1 174 1 1 1 1 37 PRO QG . 37 . HG# 1 1 174 1 2 1 1 38 ARG H . 38 . HN 1 1 175 1 1 1 1 37 PRO QG . 37 . HG# 1 1 175 1 2 1 1 38 ARG QB . 38 . HB2 1 1 176 1 1 1 1 37 PRO QG . 37 . HG# 1 1 176 1 2 1 1 38 ARG HE . 38 . HE 1 1 177 1 1 1 1 38 ARG H . 38 . HN 1 1 177 1 2 1 1 39 ALA H . 39 . HN 1 1 178 1 1 1 1 38 ARG HA . 38 . HA 1 1 178 1 2 1 1 38 ARG HE . 38 . HE 1 1 179 1 1 1 1 38 ARG HA . 38 . HA 1 1 179 1 2 1 1 39 ALA H . 39 . HN 1 1 180 1 1 1 1 38 ARG QB . 38 . HB2 1 1 180 1 2 1 1 39 ALA H . 39 . HN 1 1 181 1 1 1 1 38 ARG QB . 38 . HB2 1 1 181 1 2 1 1 40 LYS H . 40 . HN 1 1 182 1 1 1 1 39 ALA H . 39 . HN 1 1 182 1 2 1 1 40 LYS H . 40 . HN 1 1 183 1 1 1 1 39 ALA HA . 39 . HA 1 1 183 1 2 1 1 40 LYS H . 40 . HN 1 1 184 1 1 1 1 39 ALA MB . 39 . HB# 1 1 184 1 2 1 1 40 LYS H . 40 . HN 1 1 185 1 1 1 1 39 ALA MB . 39 . HB# 1 1 185 1 2 1 1 40 LYS HA . 40 . HA 1 1 186 1 1 1 1 40 LYS H . 40 . HN 1 1 186 1 2 1 1 40 LYS QD . 40 . HD# 1 1 187 1 1 1 1 40 LYS H . 40 . HN 1 1 187 1 2 1 1 40 LYS QZ . 40 . HZ# 1 1 188 1 1 1 1 40 LYS HA . 40 . HA 1 1 188 1 2 1 1 40 LYS QE . 40 . HE# 1 1 189 1 1 1 1 40 LYS HA . 40 . HA 1 1 189 1 2 1 1 41 LYS H . 41 . 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 . . . . . 6.0 5.9 6.1 1 1 2 1 . . . . . 6.0 5.9 6.1 1 1 3 1 . . . . . 6.0 5.9 6.1 1 1 4 1 . . . . . 6.0 5.9 6.1 1 1 5 1 . . . . . 6.0 5.9 6.1 1 1 6 1 . . . . . 6.0 5.9 6.1 1 1 7 1 . . . . . 6.0 5.9 6.1 1 1 8 1 . . . . . 6.0 5.9 6.1 1 1 9 1 . . . . . 6.0 5.9 6.1 1 1 10 1 . . . . . 6.0 5.9 6.1 1 1 11 1 . . . . . 6.0 5.9 6.1 1 1 12 1 . . . . . 6.0 5.9 6.1 1 1 13 1 . . . . . 6.0 5.9 6.1 1 1 14 1 . . . . . 6.0 5.9 6.1 1 1 15 1 . . . . . 6.0 5.9 6.1 1 1 16 1 . . . . . 6.0 5.9 6.1 1 1 17 1 . . . . . 6.0 5.9 6.1 1 1 18 1 . . . . . 6.0 5.9 6.1 1 1 19 1 . . . . . 6.0 5.9 6.1 1 1 20 1 . . . . . 6.0 5.9 6.1 1 1 21 1 . . . . . 6.0 5.9 6.1 1 1 22 1 . . . . . 6.0 5.9 6.1 1 1 23 1 . . . . . 6.0 5.9 6.1 1 1 24 1 . . . . . 6.0 5.9 6.1 1 1 25 1 . . . . . 6.0 5.9 6.1 1 1 26 1 . . . . . 6.0 5.9 6.1 1 1 27 1 . . . . . 6.0 5.9 6.1 1 1 28 1 . . . . . 6.0 5.9 6.1 1 1 29 1 . . . . . 6.0 5.9 6.1 1 1 30 1 . . . . . 6.0 5.9 6.1 1 1 31 1 . . . . . 6.0 5.9 6.1 1 1 32 1 . . . . . 6.0 5.9 6.1 1 1 33 1 . . . . . 6.0 5.9 6.1 1 1 34 1 . . . . . 6.0 5.9 6.1 1 1 35 1 . . . . . 6.0 5.9 6.1 1 1 36 1 . . . . . 6.0 5.9 6.1 1 1 37 1 . . . . . 6.0 5.9 6.1 1 1 38 1 . . . . . 6.0 5.9 6.1 1 1 39 1 . . . . . 6.0 5.9 6.1 1 1 40 1 . . . . . 6.0 5.9 6.1 1 1 41 1 . . . . . 6.0 5.9 6.1 1 1 42 1 . . . . . 6.0 5.9 6.1 1 1 43 1 . . . . . 6.0 5.9 6.1 1 1 44 1 . . . . . 6.0 5.9 6.1 1 1 45 1 . . . . . 6.0 5.9 6.1 1 1 46 1 . . . . . 6.0 5.9 6.1 1 1 47 1 . . . . . 6.0 5.9 6.1 1 1 48 1 . . . . . 6.0 5.9 6.1 1 1 49 1 . . . . . 6.0 5.9 6.1 1 1 50 1 . . . . . 6.0 5.9 6.1 1 1 51 1 . . . . . 6.0 5.9 6.1 1 1 52 1 . . . . . 6.0 5.9 6.1 1 1 53 1 . . . . . 6.0 5.9 6.1 1 1 54 1 . . . . . 6.0 5.9 6.1 1 1 55 1 . . . . . 6.0 5.9 6.1 1 1 56 1 . . . . . 6.0 5.9 6.1 1 1 57 1 . . . . . 6.0 5.9 6.1 1 1 58 1 . . . . . 6.0 5.9 6.1 1 1 59 1 . . . . . 6.0 5.9 6.1 1 1 60 1 . . . . . 6.0 5.9 6.1 1 1 61 1 . . . . . 6.0 5.9 6.1 1 1 62 1 . . . . . 6.0 5.9 6.1 1 1 63 1 . . . . . 6.0 5.9 6.1 1 1 64 1 . . . . . 6.0 5.9 6.1 1 1 65 1 . . . . . 6.0 5.9 6.1 1 1 66 1 . . . . . 6.0 5.9 6.1 1 1 67 1 . . . . . 6.0 5.9 6.1 1 1 68 1 . . . . . 6.0 5.9 6.1 1 1 69 1 . . . . . 6.0 5.9 6.1 1 1 70 1 . . . . . 6.0 5.9 6.1 1 1 71 1 . . . . . 6.0 5.9 6.1 1 1 72 1 . . . . . 6.0 5.9 6.1 1 1 73 1 . . . . . 6.0 5.9 6.1 1 1 74 1 . . . . . 6.0 5.9 6.1 1 1 75 1 . . . . . 6.0 5.9 6.1 1 1 76 1 . . . . . 6.0 5.9 6.1 1 1 77 1 . . . . . 6.0 5.9 6.1 1 1 78 1 . . . . . 6.0 5.9 6.1 1 1 79 1 . . . . . 6.0 5.9 6.1 1 1 80 1 . . . . . 6.0 5.9 6.1 1 1 81 1 . . . . . 6.0 5.9 6.1 1 1 82 1 . . . . . 6.0 5.9 6.1 1 1 83 1 . . . . . 6.0 5.9 6.1 1 1 84 1 . . . . . 6.0 5.9 6.1 1 1 85 1 . . . . . 6.0 5.9 6.1 1 1 86 1 . . . . . 6.0 5.9 6.1 1 1 87 1 . . . . . 6.0 5.9 6.1 1 1 88 1 . . . . . 6.0 5.9 6.1 1 1 89 1 . . . . . 6.0 5.9 6.1 1 1 90 1 . . . . . 6.0 5.9 6.1 1 1 91 1 . . . . . 6.0 5.9 6.1 1 1 92 1 . . . . . 6.0 5.9 6.1 1 1 93 1 . . . . . 6.0 5.9 6.1 1 1 94 1 . . . . . 6.0 5.9 6.1 1 1 95 1 . . . . . 6.0 5.9 6.1 1 1 96 1 . . . . . 6.0 5.9 6.1 1 1 97 1 . . . . . 6.0 5.9 6.1 1 1 98 1 . . . . . 6.0 5.9 6.1 1 1 99 1 . . . . . 6.0 5.9 6.1 1 1 100 1 . . . . . 6.0 5.9 6.1 1 1 101 1 . . . . . 6.0 5.9 6.1 1 1 102 1 . . . . . 6.0 5.9 6.1 1 1 103 1 . . . . . 6.0 5.9 6.1 1 1 104 1 . . . . . 6.0 5.9 6.1 1 1 105 1 . . . . . 6.0 5.9 6.1 1 1 106 1 . . . . . 6.0 5.9 6.1 1 1 107 1 . . . . . 6.0 5.9 6.1 1 1 108 1 . . . . . 6.0 5.9 6.1 1 1 109 1 . . . . . 6.0 5.9 6.1 1 1 110 1 . . . . . 6.0 5.9 6.1 1 1 111 1 . . . . . 6.0 5.9 6.1 1 1 112 1 . . . . . 6.0 5.9 6.1 1 1 113 1 . . . . . 6.0 5.9 6.1 1 1 114 1 . . . . . 6.0 5.9 6.1 1 1 115 1 . . . . . 6.0 5.9 6.1 1 1 116 1 . . . . . 6.0 5.9 6.1 1 1 117 1 . . . . . 6.0 5.9 6.1 1 1 118 1 . . . . . 6.0 5.9 6.1 1 1 119 1 . . . . . 6.0 5.9 6.1 1 1 120 1 . . . . . 6.0 5.9 6.1 1 1 121 1 . . . . . 6.0 5.9 6.1 1 1 122 1 . . . . . 6.0 5.9 6.1 1 1 123 1 . . . . . 6.0 5.9 6.1 1 1 124 1 . . . . . 6.0 5.9 6.1 1 1 125 1 . . . . . 6.0 5.9 6.1 1 1 126 1 . . . . . 6.0 5.9 6.1 1 1 127 1 . . . . . 6.0 5.9 6.1 1 1 128 1 . . . . . 6.0 5.9 6.1 1 1 129 1 . . . . . 6.0 5.9 6.1 1 1 130 1 . . . . . 6.0 5.9 6.1 1 1 131 1 . . . . . 6.0 5.9 6.1 1 1 132 1 . . . . . 6.0 5.9 6.1 1 1 133 1 . . . . . 6.0 5.9 6.1 1 1 134 1 . . . . . 6.0 5.9 6.1 1 1 135 1 . . . . . 6.0 5.9 6.1 1 1 136 1 . . . . . 6.0 5.9 6.1 1 1 137 1 . . . . . 6.0 5.9 6.1 1 1 138 1 . . . . . 6.0 5.9 6.1 1 1 139 1 . . . . . 6.0 5.9 6.1 1 1 140 1 . . . . . 6.0 5.9 6.1 1 1 141 1 . . . . . 6.0 5.9 6.1 1 1 142 1 . . . . . 6.0 5.9 6.1 1 1 143 1 . . . . . 6.0 5.9 6.1 1 1 144 1 . . . . . 6.0 5.9 6.1 1 1 145 1 . . . . . 6.0 5.9 6.1 1 1 146 1 . . . . . 6.0 5.9 6.1 1 1 147 1 . . . . . 6.0 5.9 6.1 1 1 148 1 . . . . . 6.0 5.9 6.1 1 1 149 1 . . . . . 6.0 5.9 6.1 1 1 150 1 . . . . . 6.0 5.9 6.1 1 1 151 1 . . . . . 6.0 5.9 6.1 1 1 152 1 . . . . . 6.0 5.9 6.1 1 1 153 1 . . . . . 6.0 5.9 6.1 1 1 154 1 . . . . . 6.0 5.9 6.1 1 1 155 1 . . . . . 6.0 5.9 6.1 1 1 156 1 . . . . . 6.0 5.9 6.1 1 1 157 1 . . . . . 6.0 5.9 6.1 1 1 158 1 . . . . . 6.0 5.9 6.1 1 1 159 1 . . . . . 6.0 5.9 6.1 1 1 160 1 . . . . . 6.0 5.9 6.1 1 1 161 1 . . . . . 6.0 5.9 6.1 1 1 162 1 . . . . . 6.0 5.9 6.1 1 1 163 1 . . . . . 6.0 5.9 6.1 1 1 164 1 . . . . . 6.0 5.9 6.1 1 1 165 1 . . . . . 6.0 5.9 6.1 1 1 166 1 . . . . . 6.0 5.9 6.1 1 1 167 1 . . . . . 6.0 5.9 6.1 1 1 168 1 . . . . . 6.0 5.9 6.1 1 1 169 1 . . . . . 6.0 5.9 6.1 1 1 170 1 . . . . . 6.0 5.9 6.1 1 1 171 1 . . . . . 6.0 5.9 6.1 1 1 172 1 . . . . . 6.0 5.9 6.1 1 1 173 1 . . . . . 6.0 5.9 6.1 1 1 174 1 . . . . . 6.0 5.9 6.1 1 1 175 1 . . . . . 6.0 5.9 6.1 1 1 176 1 . . . . . 6.0 5.9 6.1 1 1 177 1 . . . . . 6.0 5.9 6.1 1 1 178 1 . . . . . 6.0 5.9 6.1 1 1 179 1 . . . . . 6.0 5.9 6.1 1 1 180 1 . . . . . 6.0 5.9 6.1 1 1 181 1 . . . . . 6.0 5.9 6.1 1 1 182 1 . . . . . 6.0 5.9 6.1 1 1 183 1 . . . . . 6.0 5.9 6.1 1 1 184 1 . . . . . 6.0 5.9 6.1 1 1 185 1 . . . . . 6.0 5.9 6.1 1 1 186 1 . . . . . 6.0 5.9 6.1 1 1 187 1 . . . . . 6.0 5.9 6.1 1 1 188 1 . . . . . 6.0 5.9 6.1 1 1 189 1 . . . . . 6.0 5.9 6.1 1 1 stop_ save_ save_CNS/XPLOR_dihedral_2 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 9 ASP C 1 1 10 LEU N 1 1 10 LEU CA 1 1 10 LEU C -100.0 -20.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 2 . 1 1 9 ASP C 1 1 10 LEU N 1 1 10 LEU CA 1 1 10 LEU C -100.0 -20.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 3 . 1 1 15 PRO C 1 1 16 GLY N 1 1 16 GLY CA 1 1 16 GLY C -160.0 -80.0 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 4 . 1 1 21 GLY C 1 1 22 HIS N 1 1 22 HIS CA 1 1 22 HIS C -160.0 -80.0 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 5 . 1 1 29 SER C 1 1 30 HIS N 1 1 30 HIS CA 1 1 30 HIS C -160.0 -80.0 . 29 . C . 30 . N . 30 . CA . 30 . C 1 1 6 . 1 1 30 HIS C 1 1 31 ARG N 1 1 31 ARG CA 1 1 31 ARG C -160.0 -80.0 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 7 . 1 1 32 SER C 1 1 33 LEU N 1 1 33 LEU CA 1 1 33 LEU C -160.0 -80.0 . 32 . C . 33 . N . 33 . CA . 33 . C 1 1 8 . 1 1 33 LEU C 1 1 34 SER N 1 1 34 SER CA 1 1 34 SER C -160.0 -80.0 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1 9 . 1 1 36 CYS C 1 1 37 PRO N 1 1 37 PRO CA 1 1 37 PRO C -100.0 -20.0 . 36 . C . 37 . N . 37 . CA . 37 . C 1 1 10 . 1 1 38 ARG C 1 1 39 ALA N 1 1 39 ALA CA 1 1 39 ALA C -100.0 -20.0 . 38 . C . 39 . N . 39 . CA . 39 . C 1 1 11 . 1 1 9 ASP CG 1 1 9 ASP CB 1 1 9 ASP CA 1 1 9 ASP N -210.0 -150.0 . 9 . CG . 9 . CB . 9 . CA . 9 . N 1 1 12 . 1 1 22 HIS CG 1 1 22 HIS CB 1 1 22 HIS CA 1 1 22 HIS N -89.99999 -30.0 . 22 . CG . 22 . CB . 22 . CA . 22 . N 1 1 13 . 1 1 26 ASN CG 1 1 26 ASN CB 1 1 26 ASN CA 1 1 26 ASN N -89.99999 -30.0 . 26 . CG . 26 . CB . 26 . CA . 26 . N 1 1 14 . 1 1 27 TYR CG 1 1 27 TYR CB 1 1 27 TYR CA 1 1 27 TYR N -89.99999 -30.0 . 27 . CG . 27 . CB . 27 . CA . 27 . N 1 1 15 . 1 1 38 ARG CG 1 1 38 ARG CB 1 1 38 ARG CA 1 1 38 ARG N -89.99999 -30.0 . 38 . CG . 38 . CB . 38 . CA . 38 . N 1 1 16 . 1 1 18 ASP CG 1 1 18 ASP CB 1 1 18 ASP CA 1 1 18 ASP N 30.0 89.99999 . 18 . CG . 18 . CB . 18 . CA . 18 . N 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C 1.676 11.267 3.727 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 0.657 10.642 2.801 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H 1.017 12.062 1.316 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H 0.071 10.754 0.800 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H 1.740 10.558 1.018 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H -0.331 10.962 3.099 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H 0.719 9.567 2.884 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N 0.885 11.030 1.390 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O 2.497 12.075 3.293 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 SER C C 3.863 10.499 5.977 1.00 . A A . 2 SER C 1 1 1 11 1 1 2 SER CA C 2.613 11.372 5.965 1.00 . A A . 2 SER CA 1 1 1 12 1 1 2 SER CB C 1.981 11.409 7.358 1.00 . A A . 2 SER CB 1 1 1 13 1 1 2 SER H H 1.002 10.185 5.272 1.00 . A A . 2 SER H 1 1 1 14 1 1 2 SER HA H 2.887 12.373 5.674 1.00 . A A . 2 SER HA 1 1 1 15 1 1 2 SER HB2 H 2.622 10.889 8.053 1.00 . A A . 2 SER HB2 1 1 1 16 1 1 2 SER HB3 H 1.868 12.435 7.672 1.00 . A A . 2 SER HB3 1 1 1 17 1 1 2 SER HG H 0.174 11.122 6.623 1.00 . A A . 2 SER HG 1 1 1 18 1 1 2 SER N N 1.656 10.868 4.991 1.00 . A A . 2 SER N 1 1 1 19 1 1 2 SER O O 4.989 10.996 6.036 1.00 . A A . 2 SER O 1 1 1 20 1 1 2 SER OG O 0.703 10.784 7.363 1.00 . A A . 2 SER OG 1 1 1 21 1 1 3 MET C C 4.662 7.390 4.572 1.00 . A A . 3 MET C 1 1 1 22 1 1 3 MET CA C 4.751 8.244 5.829 1.00 . A A . 3 MET CA 1 1 1 23 1 1 3 MET CB C 4.720 7.355 7.075 1.00 . A A . 3 MET CB 1 1 1 24 1 1 3 MET CE C 6.660 3.760 6.741 1.00 . A A . 3 MET CE 1 1 1 25 1 1 3 MET CG C 5.885 6.383 7.160 1.00 . A A . 3 MET CG 1 1 1 26 1 1 3 MET H H 2.733 8.866 5.771 1.00 . A A . 3 MET H 1 1 1 27 1 1 3 MET HA H 5.677 8.800 5.811 1.00 . A A . 3 MET HA 1 1 1 28 1 1 3 MET HB2 H 4.741 7.985 7.952 1.00 . A A . 3 MET HB2 1 1 1 29 1 1 3 MET HB3 H 3.802 6.786 7.073 1.00 . A A . 3 MET HB3 1 1 1 30 1 1 3 MET HE1 H 6.280 2.795 6.444 1.00 . A A . 3 MET HE1 1 1 1 31 1 1 3 MET HE2 H 7.007 4.295 5.868 1.00 . A A . 3 MET HE2 1 1 1 32 1 1 3 MET HE3 H 7.480 3.627 7.430 1.00 . A A . 3 MET HE3 1 1 1 33 1 1 3 MET HG2 H 6.404 6.381 6.215 1.00 . A A . 3 MET HG2 1 1 1 34 1 1 3 MET HG3 H 6.558 6.718 7.937 1.00 . A A . 3 MET HG3 1 1 1 35 1 1 3 MET N N 3.655 9.197 5.864 1.00 . A A . 3 MET N 1 1 1 36 1 1 3 MET O O 3.853 6.465 4.503 1.00 . A A . 3 MET O 1 1 1 37 1 1 3 MET SD S 5.357 4.698 7.534 1.00 . A A . 3 MET SD 1 1 1 38 1 1 4 ALA C C 6.524 5.952 2.276 1.00 . A A . 4 ALA C 1 1 1 39 1 1 4 ALA CA C 5.439 7.028 2.296 1.00 . A A . 4 ALA CA 1 1 1 40 1 1 4 ALA CB C 5.622 8.002 1.142 1.00 . A A . 4 ALA CB 1 1 1 41 1 1 4 ALA H H 6.040 8.520 3.672 1.00 . A A . 4 ALA H 1 1 1 42 1 1 4 ALA HA H 4.474 6.554 2.188 1.00 . A A . 4 ALA HA 1 1 1 43 1 1 4 ALA HB1 H 5.845 8.986 1.531 1.00 . A A . 4 ALA HB1 1 1 1 44 1 1 4 ALA HB2 H 6.436 7.669 0.516 1.00 . A A . 4 ALA HB2 1 1 1 45 1 1 4 ALA HB3 H 4.713 8.044 0.559 1.00 . A A . 4 ALA HB3 1 1 1 46 1 1 4 ALA N N 5.448 7.743 3.565 1.00 . A A . 4 ALA N 1 1 1 47 1 1 4 ALA O O 6.822 5.342 3.305 1.00 . A A . 4 ALA O 1 1 1 48 1 1 5 ALA C C 9.429 5.351 0.377 1.00 . A A . 5 ALA C 1 1 1 49 1 1 5 ALA CA C 8.178 4.737 0.984 1.00 . A A . 5 ALA CA 1 1 1 50 1 1 5 ALA CB C 7.695 3.578 0.124 1.00 . A A . 5 ALA CB 1 1 1 51 1 1 5 ALA H H 6.868 6.261 0.332 1.00 . A A . 5 ALA H 1 1 1 52 1 1 5 ALA HA H 8.410 4.356 1.968 1.00 . A A . 5 ALA HA 1 1 1 53 1 1 5 ALA HB1 H 6.663 3.363 0.356 1.00 . A A . 5 ALA HB1 1 1 1 54 1 1 5 ALA HB2 H 7.782 3.844 -0.919 1.00 . A A . 5 ALA HB2 1 1 1 55 1 1 5 ALA HB3 H 8.299 2.706 0.324 1.00 . A A . 5 ALA HB3 1 1 1 56 1 1 5 ALA N N 7.127 5.733 1.117 1.00 . A A . 5 ALA N 1 1 1 57 1 1 5 ALA O O 9.479 6.556 0.124 1.00 . A A . 5 ALA O 1 1 1 58 1 1 6 HIS C C 11.370 5.453 -1.945 1.00 . A A . 6 HIS C 1 1 1 59 1 1 6 HIS CA C 11.655 4.959 -0.530 1.00 . A A . 6 HIS CA 1 1 1 60 1 1 6 HIS CB C 12.682 3.824 -0.561 1.00 . A A . 6 HIS CB 1 1 1 61 1 1 6 HIS CD2 C 14.960 3.557 -1.772 1.00 . A A . 6 HIS CD2 1 1 1 62 1 1 6 HIS CE1 C 15.780 5.546 -1.359 1.00 . A A . 6 HIS CE1 1 1 1 63 1 1 6 HIS CG C 14.039 4.235 -1.049 1.00 . A A . 6 HIS CG 1 1 1 64 1 1 6 HIS H H 10.313 3.554 0.324 1.00 . A A . 6 HIS H 1 1 1 65 1 1 6 HIS HA H 12.049 5.778 0.053 1.00 . A A . 6 HIS HA 1 1 1 66 1 1 6 HIS HB2 H 12.798 3.426 0.436 1.00 . A A . 6 HIS HB2 1 1 1 67 1 1 6 HIS HB3 H 12.319 3.042 -1.213 1.00 . A A . 6 HIS HB3 1 1 1 68 1 1 6 HIS HD1 H 14.156 6.205 -0.292 1.00 . A A . 6 HIS HD1 1 1 1 69 1 1 6 HIS HD2 H 14.868 2.545 -2.138 1.00 . A A . 6 HIS HD2 1 1 1 70 1 1 6 HIS HE1 H 16.441 6.399 -1.329 1.00 . A A . 6 HIS HE1 1 1 1 71 1 1 6 HIS HE2 H 16.924 4.112 -2.276 1.00 . A A . 6 HIS HE2 1 1 1 72 1 1 6 HIS N N 10.420 4.511 0.103 1.00 . A A . 6 HIS N 1 1 1 73 1 1 6 HIS ND1 N 14.584 5.477 -0.806 1.00 . A A . 6 HIS ND1 1 1 1 74 1 1 6 HIS NE2 N 16.033 4.394 -1.951 1.00 . A A . 6 HIS NE2 1 1 1 75 1 1 6 HIS O O 12.032 6.362 -2.444 1.00 . A A . 6 HIS O 1 1 1 76 1 1 7 SER C C 8.969 6.539 -3.796 1.00 . A A . 7 SER C 1 1 1 77 1 1 7 SER CA C 9.892 5.321 -3.876 1.00 . A A . 7 SER CA 1 1 1 78 1 1 7 SER CB C 9.181 4.158 -4.568 1.00 . A A . 7 SER CB 1 1 1 79 1 1 7 SER H H 9.806 4.223 -2.077 1.00 . A A . 7 SER H 1 1 1 80 1 1 7 SER HA H 10.770 5.585 -4.444 1.00 . A A . 7 SER HA 1 1 1 81 1 1 7 SER HB2 H 8.112 4.311 -4.518 1.00 . A A . 7 SER HB2 1 1 1 82 1 1 7 SER HB3 H 9.492 4.111 -5.602 1.00 . A A . 7 SER HB3 1 1 1 83 1 1 7 SER HG H 9.340 2.198 -4.554 1.00 . A A . 7 SER HG 1 1 1 84 1 1 7 SER N N 10.323 4.907 -2.549 1.00 . A A . 7 SER N 1 1 1 85 1 1 7 SER O O 8.048 6.686 -4.601 1.00 . A A . 7 SER O 1 1 1 86 1 1 7 SER OG O 9.497 2.925 -3.936 1.00 . A A . 7 SER OG 1 1 1 87 1 1 8 ALA C C 6.981 8.337 -2.380 1.00 . A A . 8 ALA C 1 1 1 88 1 1 8 ALA CA C 8.461 8.629 -2.611 1.00 . A A . 8 ALA CA 1 1 1 89 1 1 8 ALA CB C 8.645 9.575 -3.792 1.00 . A A . 8 ALA CB 1 1 1 90 1 1 8 ALA H H 9.972 7.210 -2.207 1.00 . A A . 8 ALA H 1 1 1 91 1 1 8 ALA HA H 8.854 9.118 -1.733 1.00 . A A . 8 ALA HA 1 1 1 92 1 1 8 ALA HB1 H 9.636 9.453 -4.202 1.00 . A A . 8 ALA HB1 1 1 1 93 1 1 8 ALA HB2 H 7.911 9.351 -4.553 1.00 . A A . 8 ALA HB2 1 1 1 94 1 1 8 ALA HB3 H 8.517 10.594 -3.458 1.00 . A A . 8 ALA HB3 1 1 1 95 1 1 8 ALA N N 9.231 7.404 -2.816 1.00 . A A . 8 ALA N 1 1 1 96 1 1 8 ALA O O 6.602 7.212 -2.046 1.00 . A A . 8 ALA O 1 1 1 97 1 1 9 ASP C C 4.098 8.838 -3.807 1.00 . A A . 9 ASP C 1 1 1 98 1 1 9 ASP CA C 4.703 9.201 -2.464 1.00 . A A . 9 ASP CA 1 1 1 99 1 1 9 ASP CB C 4.079 10.499 -1.937 1.00 . A A . 9 ASP CB 1 1 1 100 1 1 9 ASP CG C 2.835 10.268 -1.098 1.00 . A A . 9 ASP CG 1 1 1 101 1 1 9 ASP H H 6.510 10.208 -2.902 1.00 . A A . 9 ASP H 1 1 1 102 1 1 9 ASP HA H 4.509 8.394 -1.770 1.00 . A A . 9 ASP HA 1 1 1 103 1 1 9 ASP HB2 H 4.806 11.015 -1.328 1.00 . A A . 9 ASP HB2 1 1 1 104 1 1 9 ASP HB3 H 3.811 11.126 -2.776 1.00 . A A . 9 ASP HB3 1 1 1 105 1 1 9 ASP N N 6.148 9.346 -2.602 1.00 . A A . 9 ASP N 1 1 1 106 1 1 9 ASP O O 2.996 9.259 -4.149 1.00 . A A . 9 ASP O 1 1 1 107 1 1 9 ASP OD1 O 2.974 10.060 0.126 1.00 . A A . 9 ASP OD1 1 1 1 108 1 1 9 ASP OD2 O 1.712 10.335 -1.647 1.00 . A A . 9 ASP OD2 1 1 1 109 1 1 10 LEU C C 3.641 6.171 -5.551 1.00 . A A . 10 LEU C 1 1 1 110 1 1 10 LEU CA C 4.331 7.497 -5.812 1.00 . A A . 10 LEU CA 1 1 1 111 1 1 10 LEU CB C 5.479 7.320 -6.810 1.00 . A A . 10 LEU CB 1 1 1 112 1 1 10 LEU CD1 C 7.695 8.087 -7.689 1.00 . A A . 10 LEU CD1 1 1 1 113 1 1 10 LEU CD2 C 5.835 9.732 -7.404 1.00 . A A . 10 LEU CD2 1 1 1 114 1 1 10 LEU CG C 6.485 8.471 -6.854 1.00 . A A . 10 LEU CG 1 1 1 115 1 1 10 LEU H H 5.675 7.690 -4.191 1.00 . A A . 10 LEU H 1 1 1 116 1 1 10 LEU HA H 3.612 8.198 -6.209 1.00 . A A . 10 LEU HA 1 1 1 117 1 1 10 LEU HB2 H 6.011 6.414 -6.558 1.00 . A A . 10 LEU HB2 1 1 1 118 1 1 10 LEU HB3 H 5.055 7.205 -7.797 1.00 . A A . 10 LEU HB3 1 1 1 119 1 1 10 LEU HD11 H 8.590 8.476 -7.226 1.00 . A A . 10 LEU HD11 1 1 1 120 1 1 10 LEU HD12 H 7.761 7.010 -7.752 1.00 . A A . 10 LEU HD12 1 1 1 121 1 1 10 LEU HD13 H 7.593 8.500 -8.681 1.00 . A A . 10 LEU HD13 1 1 1 122 1 1 10 LEU HD21 H 6.555 10.278 -7.998 1.00 . A A . 10 LEU HD21 1 1 1 123 1 1 10 LEU HD22 H 4.990 9.461 -8.020 1.00 . A A . 10 LEU HD22 1 1 1 124 1 1 10 LEU HD23 H 5.501 10.351 -6.584 1.00 . A A . 10 LEU HD23 1 1 1 125 1 1 10 LEU HG H 6.827 8.680 -5.850 1.00 . A A . 10 LEU HG 1 1 1 126 1 1 10 LEU N N 4.820 8.016 -4.546 1.00 . A A . 10 LEU N 1 1 1 127 1 1 10 LEU O O 2.611 5.854 -6.149 1.00 . A A . 10 LEU O 1 1 1 128 1 1 11 LYS C C 3.541 4.336 -2.484 1.00 . A A . 11 LYS C 1 1 1 129 1 1 11 LYS CA C 3.459 4.328 -4.002 1.00 . A A . 11 LYS CA 1 1 1 130 1 1 11 LYS CB C 4.087 3.054 -4.585 1.00 . A A . 11 LYS CB 1 1 1 131 1 1 11 LYS CD C 5.793 1.684 -3.310 1.00 . A A . 11 LYS CD 1 1 1 132 1 1 11 LYS CE C 4.804 0.546 -3.541 1.00 . A A . 11 LYS CE 1 1 1 133 1 1 11 LYS CG C 5.562 2.865 -4.250 1.00 . A A . 11 LYS CG 1 1 1 134 1 1 11 LYS H H 4.815 5.908 -3.968 1.00 . A A . 11 LYS H 1 1 1 135 1 1 11 LYS HA H 2.419 4.373 -4.292 1.00 . A A . 11 LYS HA 1 1 1 136 1 1 11 LYS HB2 H 3.545 2.200 -4.209 1.00 . A A . 11 LYS HB2 1 1 1 137 1 1 11 LYS HB3 H 3.988 3.083 -5.660 1.00 . A A . 11 LYS HB3 1 1 1 138 1 1 11 LYS HD2 H 6.795 1.310 -3.458 1.00 . A A . 11 LYS HD2 1 1 1 139 1 1 11 LYS HD3 H 5.688 2.031 -2.291 1.00 . A A . 11 LYS HD3 1 1 1 140 1 1 11 LYS HE2 H 4.073 0.863 -4.268 1.00 . A A . 11 LYS HE2 1 1 1 141 1 1 11 LYS HE3 H 5.342 -0.310 -3.925 1.00 . A A . 11 LYS HE3 1 1 1 142 1 1 11 LYS HG2 H 6.108 2.692 -5.165 1.00 . A A . 11 LYS HG2 1 1 1 143 1 1 11 LYS HG3 H 5.929 3.765 -3.777 1.00 . A A . 11 LYS HG3 1 1 1 144 1 1 11 LYS HZ1 H 3.102 0.449 -2.322 1.00 . A A . 11 LYS HZ1 1 1 1 145 1 1 11 LYS HZ2 H 4.551 0.618 -1.468 1.00 . A A . 11 LYS HZ2 1 1 1 146 1 1 11 LYS HZ3 H 4.145 -0.878 -2.156 1.00 . A A . 11 LYS HZ3 1 1 1 147 1 1 11 LYS N N 4.104 5.508 -4.506 1.00 . A A . 11 LYS N 1 1 1 148 1 1 11 LYS NZ N 4.103 0.156 -2.288 1.00 . A A . 11 LYS NZ 1 1 1 149 1 1 11 LYS O O 3.929 5.336 -1.880 1.00 . A A . 11 LYS O 1 1 1 150 1 1 12 CYS C C 4.116 2.522 0.210 1.00 . A A . 12 CYS C 1 1 1 151 1 1 12 CYS CA C 2.903 3.194 -0.448 1.00 . A A . 12 CYS CA 1 1 1 152 1 1 12 CYS CB C 1.634 2.408 -0.166 1.00 . A A . 12 CYS CB 1 1 1 153 1 1 12 CYS H H 2.657 2.583 -2.434 1.00 . A A . 12 CYS H 1 1 1 154 1 1 12 CYS HA H 2.795 4.193 -0.057 1.00 . A A . 12 CYS HA 1 1 1 155 1 1 12 CYS HB2 H 1.621 2.104 0.869 1.00 . A A . 12 CYS HB2 1 1 1 156 1 1 12 CYS HB3 H 0.779 3.041 -0.358 1.00 . A A . 12 CYS HB3 1 1 1 157 1 1 12 CYS N N 3.045 3.281 -1.887 1.00 . A A . 12 CYS N 1 1 1 158 1 1 12 CYS O O 4.967 1.954 -0.473 1.00 . A A . 12 CYS O 1 1 1 159 1 1 12 CYS SG S 1.461 0.921 -1.198 1.00 . A A . 12 CYS SG 1 1 1 160 1 1 13 PRO C C 5.536 0.537 2.080 1.00 . A A . 13 PRO C 1 1 1 161 1 1 13 PRO CA C 5.349 2.038 2.301 1.00 . A A . 13 PRO CA 1 1 1 162 1 1 13 PRO CB C 4.970 2.305 3.759 1.00 . A A . 13 PRO CB 1 1 1 163 1 1 13 PRO CD C 3.279 3.317 2.425 1.00 . A A . 13 PRO CD 1 1 1 164 1 1 13 PRO CG C 4.040 3.460 3.708 1.00 . A A . 13 PRO CG 1 1 1 165 1 1 13 PRO HA H 6.272 2.550 2.070 1.00 . A A . 13 PRO HA 1 1 1 166 1 1 13 PRO HB2 H 4.489 1.430 4.172 1.00 . A A . 13 PRO HB2 1 1 1 167 1 1 13 PRO HB3 H 5.852 2.539 4.332 1.00 . A A . 13 PRO HB3 1 1 1 168 1 1 13 PRO HD2 H 2.381 2.736 2.580 1.00 . A A . 13 PRO HD2 1 1 1 169 1 1 13 PRO HD3 H 3.035 4.288 2.020 1.00 . A A . 13 PRO HD3 1 1 1 170 1 1 13 PRO HG2 H 3.366 3.427 4.551 1.00 . A A . 13 PRO HG2 1 1 1 171 1 1 13 PRO HG3 H 4.601 4.383 3.709 1.00 . A A . 13 PRO HG3 1 1 1 172 1 1 13 PRO N N 4.220 2.604 1.547 1.00 . A A . 13 PRO N 1 1 1 173 1 1 13 PRO O O 6.665 0.061 1.948 1.00 . A A . 13 PRO O 1 1 1 174 1 1 14 THR C C 5.110 -2.103 0.655 1.00 . A A . 14 THR C 1 1 1 175 1 1 14 THR CA C 4.487 -1.663 1.982 1.00 . A A . 14 THR CA 1 1 1 176 1 1 14 THR CB C 3.080 -2.274 2.117 1.00 . A A . 14 THR CB 1 1 1 177 1 1 14 THR CG2 C 3.157 -3.750 2.487 1.00 . A A . 14 THR CG2 1 1 1 178 1 1 14 THR H H 3.569 0.223 2.259 1.00 . A A . 14 THR H 1 1 1 179 1 1 14 THR HA H 5.094 -2.041 2.792 1.00 . A A . 14 THR HA 1 1 1 180 1 1 14 THR HB H 2.570 -2.181 1.171 1.00 . A A . 14 THR HB 1 1 1 181 1 1 14 THR HG1 H 1.510 -1.227 2.734 1.00 . A A . 14 THR HG1 1 1 1 182 1 1 14 THR HG21 H 4.154 -3.983 2.833 1.00 . A A . 14 THR HG21 1 1 1 183 1 1 14 THR HG22 H 2.928 -4.350 1.619 1.00 . A A . 14 THR HG22 1 1 1 184 1 1 14 THR HG23 H 2.445 -3.964 3.271 1.00 . A A . 14 THR HG23 1 1 1 185 1 1 14 THR N N 4.436 -0.209 2.105 1.00 . A A . 14 THR N 1 1 1 186 1 1 14 THR O O 4.615 -1.762 -0.419 1.00 . A A . 14 THR O 1 1 1 187 1 1 14 THR OG1 O 2.342 -1.566 3.119 1.00 . A A . 14 THR OG1 1 1 1 188 1 1 15 PRO C C 6.220 -4.342 -1.255 1.00 . A A . 15 PRO C 1 1 1 189 1 1 15 PRO CA C 6.980 -3.272 -0.476 1.00 . A A . 15 PRO CA 1 1 1 190 1 1 15 PRO CB C 8.280 -3.852 0.095 1.00 . A A . 15 PRO CB 1 1 1 191 1 1 15 PRO CD C 6.959 -3.182 1.949 1.00 . A A . 15 PRO CD 1 1 1 192 1 1 15 PRO CG C 8.373 -3.300 1.473 1.00 . A A . 15 PRO CG 1 1 1 193 1 1 15 PRO HA H 7.211 -2.445 -1.130 1.00 . A A . 15 PRO HA 1 1 1 194 1 1 15 PRO HB2 H 8.221 -4.930 0.106 1.00 . A A . 15 PRO HB2 1 1 1 195 1 1 15 PRO HB3 H 9.116 -3.538 -0.510 1.00 . A A . 15 PRO HB3 1 1 1 196 1 1 15 PRO HD2 H 6.609 -4.128 2.338 1.00 . A A . 15 PRO HD2 1 1 1 197 1 1 15 PRO HD3 H 6.868 -2.404 2.693 1.00 . A A . 15 PRO HD3 1 1 1 198 1 1 15 PRO HG2 H 8.930 -3.975 2.102 1.00 . A A . 15 PRO HG2 1 1 1 199 1 1 15 PRO HG3 H 8.843 -2.328 1.447 1.00 . A A . 15 PRO HG3 1 1 1 200 1 1 15 PRO N N 6.246 -2.821 0.717 1.00 . A A . 15 PRO N 1 1 1 201 1 1 15 PRO O O 6.324 -4.427 -2.480 1.00 . A A . 15 PRO O 1 1 1 202 1 1 16 GLY C C 3.438 -5.692 -1.801 1.00 . A A . 16 GLY C 1 1 1 203 1 1 16 GLY CA C 4.710 -6.221 -1.177 1.00 . A A . 16 GLY CA 1 1 1 204 1 1 16 GLY H H 5.453 -5.084 0.440 1.00 . A A . 16 GLY H 1 1 1 205 1 1 16 GLY HA2 H 5.317 -6.671 -1.943 1.00 . A A . 16 GLY HA2 1 1 1 206 1 1 16 GLY HA3 H 4.455 -6.971 -0.442 1.00 . A A . 16 GLY HA3 1 1 1 207 1 1 16 GLY N N 5.469 -5.170 -0.536 1.00 . A A . 16 GLY N 1 1 1 208 1 1 16 GLY O O 2.949 -6.237 -2.792 1.00 . A A . 16 GLY O 1 1 1 209 1 1 17 CYS C C 2.296 -2.913 -2.945 1.00 . A A . 17 CYS C 1 1 1 210 1 1 17 CYS CA C 1.832 -3.881 -1.860 1.00 . A A . 17 CYS CA 1 1 1 211 1 1 17 CYS CB C 1.081 -3.157 -0.746 1.00 . A A . 17 CYS CB 1 1 1 212 1 1 17 CYS H H 3.474 -4.127 -0.575 1.00 . A A . 17 CYS H 1 1 1 213 1 1 17 CYS HA H 1.185 -4.623 -2.303 1.00 . A A . 17 CYS HA 1 1 1 214 1 1 17 CYS HB2 H 0.806 -3.875 0.008 1.00 . A A . 17 CYS HB2 1 1 1 215 1 1 17 CYS HB3 H 1.739 -2.421 -0.306 1.00 . A A . 17 CYS HB3 1 1 1 216 1 1 17 CYS N N 2.975 -4.562 -1.294 1.00 . A A . 17 CYS N 1 1 1 217 1 1 17 CYS O O 3.483 -2.592 -3.040 1.00 . A A . 17 CYS O 1 1 1 218 1 1 17 CYS SG S -0.438 -2.296 -1.259 1.00 . A A . 17 CYS SG 1 1 1 219 1 1 18 ASP C C 1.189 -0.223 -4.725 1.00 . A A . 18 ASP C 1 1 1 220 1 1 18 ASP CA C 1.726 -1.638 -4.920 1.00 . A A . 18 ASP CA 1 1 1 221 1 1 18 ASP CB C 1.212 -2.238 -6.237 1.00 . A A . 18 ASP CB 1 1 1 222 1 1 18 ASP CG C -0.183 -1.769 -6.601 1.00 . A A . 18 ASP CG 1 1 1 223 1 1 18 ASP H H 0.450 -2.787 -3.679 1.00 . A A . 18 ASP H 1 1 1 224 1 1 18 ASP HA H 2.804 -1.588 -4.963 1.00 . A A . 18 ASP HA 1 1 1 225 1 1 18 ASP HB2 H 1.883 -1.960 -7.037 1.00 . A A . 18 ASP HB2 1 1 1 226 1 1 18 ASP HB3 H 1.196 -3.315 -6.149 1.00 . A A . 18 ASP HB3 1 1 1 227 1 1 18 ASP N N 1.377 -2.496 -3.796 1.00 . A A . 18 ASP N 1 1 1 228 1 1 18 ASP O O 1.854 0.750 -5.074 1.00 . A A . 18 ASP O 1 1 1 229 1 1 18 ASP OD1 O -1.150 -2.194 -5.932 1.00 . A A . 18 ASP OD1 1 1 1 230 1 1 18 ASP OD2 O -0.318 -0.957 -7.539 1.00 . A A . 18 ASP OD2 1 1 1 231 1 1 19 GLY C C -1.964 1.338 -4.527 1.00 . A A . 19 GLY C 1 1 1 232 1 1 19 GLY CA C -0.579 1.201 -3.930 1.00 . A A . 19 GLY CA 1 1 1 233 1 1 19 GLY H H -0.485 -0.913 -3.876 1.00 . A A . 19 GLY H 1 1 1 234 1 1 19 GLY HA2 H -0.641 1.377 -2.866 1.00 . A A . 19 GLY HA2 1 1 1 235 1 1 19 GLY HA3 H 0.067 1.946 -4.370 1.00 . A A . 19 GLY HA3 1 1 1 236 1 1 19 GLY N N 0.000 -0.107 -4.153 1.00 . A A . 19 GLY N 1 1 1 237 1 1 19 GLY O O -2.712 2.240 -4.166 1.00 . A A . 19 GLY O 1 1 1 238 1 1 20 SER C C -4.618 -0.422 -5.145 1.00 . A A . 20 SER C 1 1 1 239 1 1 20 SER CA C -3.667 0.434 -5.975 1.00 . A A . 20 SER CA 1 1 1 240 1 1 20 SER CB C -3.618 -0.060 -7.421 1.00 . A A . 20 SER CB 1 1 1 241 1 1 20 SER H H -1.723 -0.320 -5.617 1.00 . A A . 20 SER H 1 1 1 242 1 1 20 SER HA H -4.019 1.455 -5.964 1.00 . A A . 20 SER HA 1 1 1 243 1 1 20 SER HB2 H -3.608 -1.140 -7.431 1.00 . A A . 20 SER HB2 1 1 1 244 1 1 20 SER HB3 H -4.488 0.298 -7.952 1.00 . A A . 20 SER HB3 1 1 1 245 1 1 20 SER HG H -1.700 -0.172 -7.867 1.00 . A A . 20 SER HG 1 1 1 246 1 1 20 SER N N -2.336 0.416 -5.394 1.00 . A A . 20 SER N 1 1 1 247 1 1 20 SER O O -4.236 -1.479 -4.640 1.00 . A A . 20 SER O 1 1 1 248 1 1 20 SER OG O -2.451 0.415 -8.078 1.00 . A A . 20 SER OG 1 1 1 249 1 1 21 GLY C C -6.814 -0.195 -2.714 1.00 . A A . 21 GLY C 1 1 1 250 1 1 21 GLY CA C -6.810 -0.648 -4.159 1.00 . A A . 21 GLY CA 1 1 1 251 1 1 21 GLY H H -6.073 0.934 -5.353 1.00 . A A . 21 GLY H 1 1 1 252 1 1 21 GLY HA2 H -7.792 -0.490 -4.576 1.00 . A A . 21 GLY HA2 1 1 1 253 1 1 21 GLY HA3 H -6.582 -1.703 -4.192 1.00 . A A . 21 GLY HA3 1 1 1 254 1 1 21 GLY N N -5.836 0.067 -4.957 1.00 . A A . 21 GLY N 1 1 1 255 1 1 21 GLY O O -6.181 0.799 -2.371 1.00 . A A . 21 GLY O 1 1 1 256 1 1 22 HIS C C -8.042 -1.955 0.263 1.00 . A A . 22 HIS C 1 1 1 257 1 1 22 HIS CA C -7.607 -0.680 -0.438 1.00 . A A . 22 HIS CA 1 1 1 258 1 1 22 HIS CB C -8.619 0.430 -0.105 1.00 . A A . 22 HIS CB 1 1 1 259 1 1 22 HIS CD2 C -7.727 2.753 -0.885 1.00 . A A . 22 HIS CD2 1 1 1 260 1 1 22 HIS CE1 C -7.399 3.627 1.094 1.00 . A A . 22 HIS CE1 1 1 1 261 1 1 22 HIS CG C -8.049 1.811 0.035 1.00 . A A . 22 HIS CG 1 1 1 262 1 1 22 HIS H H -8.005 -1.713 -2.236 1.00 . A A . 22 HIS H 1 1 1 263 1 1 22 HIS HA H -6.627 -0.394 -0.084 1.00 . A A . 22 HIS HA 1 1 1 264 1 1 22 HIS HB2 H -9.363 0.465 -0.886 1.00 . A A . 22 HIS HB2 1 1 1 265 1 1 22 HIS HB3 H -9.106 0.184 0.828 1.00 . A A . 22 HIS HB3 1 1 1 266 1 1 22 HIS HD1 H -7.964 1.960 2.138 1.00 . A A . 22 HIS HD1 1 1 1 267 1 1 22 HIS HD2 H -7.794 2.649 -1.959 1.00 . A A . 22 HIS HD2 1 1 1 268 1 1 22 HIS HE1 H -7.162 4.323 1.884 1.00 . A A . 22 HIS HE1 1 1 1 269 1 1 22 HIS HE2 H -7.268 4.783 -0.588 1.00 . A A . 22 HIS HE2 1 1 1 270 1 1 22 HIS N N -7.523 -0.933 -1.876 1.00 . A A . 22 HIS N 1 1 1 271 1 1 22 HIS ND1 N -7.827 2.392 1.262 1.00 . A A . 22 HIS ND1 1 1 1 272 1 1 22 HIS NE2 N -7.328 3.874 -0.199 1.00 . A A . 22 HIS NE2 1 1 1 273 1 1 22 HIS O O -8.792 -2.741 -0.313 1.00 . A A . 22 HIS O 1 1 1 274 1 1 23 ILE C C -9.652 -3.112 2.483 1.00 . A A . 23 ILE C 1 1 1 275 1 1 23 ILE CA C -8.144 -3.237 2.332 1.00 . A A . 23 ILE CA 1 1 1 276 1 1 23 ILE CB C -7.442 -3.294 3.722 1.00 . A A . 23 ILE CB 1 1 1 277 1 1 23 ILE CD1 C -8.061 -5.743 4.113 1.00 . A A . 23 ILE CD1 1 1 1 278 1 1 23 ILE CG1 C -6.952 -4.717 4.015 1.00 . A A . 23 ILE CG1 1 1 1 279 1 1 23 ILE CG2 C -8.349 -2.799 4.846 1.00 . A A . 23 ILE CG2 1 1 1 280 1 1 23 ILE H H -7.126 -1.411 1.963 1.00 . A A . 23 ILE H 1 1 1 281 1 1 23 ILE HA H -7.917 -4.148 1.795 1.00 . A A . 23 ILE HA 1 1 1 282 1 1 23 ILE HB H -6.587 -2.636 3.683 1.00 . A A . 23 ILE HB 1 1 1 283 1 1 23 ILE HD11 H -8.912 -5.407 3.535 1.00 . A A . 23 ILE HD11 1 1 1 284 1 1 23 ILE HD12 H -7.712 -6.688 3.726 1.00 . A A . 23 ILE HD12 1 1 1 285 1 1 23 ILE HD13 H -8.352 -5.861 5.147 1.00 . A A . 23 ILE HD13 1 1 1 286 1 1 23 ILE HG12 H -6.287 -5.027 3.223 1.00 . A A . 23 ILE HG12 1 1 1 287 1 1 23 ILE HG13 H -6.413 -4.718 4.951 1.00 . A A . 23 ILE HG13 1 1 1 288 1 1 23 ILE HG21 H -9.084 -2.118 4.443 1.00 . A A . 23 ILE HG21 1 1 1 289 1 1 23 ILE HG22 H -8.849 -3.640 5.302 1.00 . A A . 23 ILE HG22 1 1 1 290 1 1 23 ILE HG23 H -7.754 -2.288 5.588 1.00 . A A . 23 ILE HG23 1 1 1 291 1 1 23 ILE N N -7.665 -2.111 1.532 1.00 . A A . 23 ILE N 1 1 1 292 1 1 23 ILE O O -10.386 -4.099 2.543 1.00 . A A . 23 ILE O 1 1 1 293 1 1 24 THR C C -12.211 -2.078 1.182 1.00 . A A . 24 THR C 1 1 1 294 1 1 24 THR CA C -11.484 -1.524 2.403 1.00 . A A . 24 THR CA 1 1 1 295 1 1 24 THR CB C -11.613 -0.001 2.389 1.00 . A A . 24 THR CB 1 1 1 296 1 1 24 THR CG2 C -12.892 0.419 3.051 1.00 . A A . 24 THR CG2 1 1 1 297 1 1 24 THR H H -9.434 -1.154 2.282 1.00 . A A . 24 THR H 1 1 1 298 1 1 24 THR HA H -11.938 -1.903 3.306 1.00 . A A . 24 THR HA 1 1 1 299 1 1 24 THR HB H -11.632 0.334 1.362 1.00 . A A . 24 THR HB 1 1 1 300 1 1 24 THR HG1 H -10.678 0.683 3.999 1.00 . A A . 24 THR HG1 1 1 1 301 1 1 24 THR HG21 H -13.401 1.127 2.419 1.00 . A A . 24 THR HG21 1 1 1 302 1 1 24 THR HG22 H -12.672 0.868 4.004 1.00 . A A . 24 THR HG22 1 1 1 303 1 1 24 THR HG23 H -13.512 -0.452 3.191 1.00 . A A . 24 THR HG23 1 1 1 304 1 1 24 THR N N -10.090 -1.872 2.398 1.00 . A A . 24 THR N 1 1 1 305 1 1 24 THR O O -13.208 -2.789 1.300 1.00 . A A . 24 THR O 1 1 1 306 1 1 24 THR OG1 O -10.489 0.596 3.047 1.00 . A A . 24 THR OG1 1 1 1 307 1 1 25 GLY C C -13.520 -0.924 -1.536 1.00 . A A . 25 GLY C 1 1 1 308 1 1 25 GLY CA C -12.471 -1.963 -1.213 1.00 . A A . 25 GLY CA 1 1 1 309 1 1 25 GLY H H -11.040 -0.992 0.001 1.00 . A A . 25 GLY H 1 1 1 310 1 1 25 GLY HA2 H -11.756 -2.011 -2.021 1.00 . A A . 25 GLY HA2 1 1 1 311 1 1 25 GLY HA3 H -12.950 -2.924 -1.102 1.00 . A A . 25 GLY HA3 1 1 1 312 1 1 25 GLY N N -11.777 -1.632 0.016 1.00 . A A . 25 GLY N 1 1 1 313 1 1 25 GLY O O -14.678 -1.248 -1.788 1.00 . A A . 25 GLY O 1 1 1 314 1 1 26 ASN C C -13.391 2.623 -2.274 1.00 . A A . 26 ASN C 1 1 1 315 1 1 26 ASN CA C -14.061 1.455 -1.563 1.00 . A A . 26 ASN CA 1 1 1 316 1 1 26 ASN CB C -14.581 1.916 -0.195 1.00 . A A . 26 ASN CB 1 1 1 317 1 1 26 ASN CG C -15.867 1.243 0.214 1.00 . A A . 26 ASN CG 1 1 1 318 1 1 26 ASN H H -12.214 0.524 -1.121 1.00 . A A . 26 ASN H 1 1 1 319 1 1 26 ASN HA H -14.894 1.112 -2.159 1.00 . A A . 26 ASN HA 1 1 1 320 1 1 26 ASN HB2 H -13.836 1.697 0.554 1.00 . A A . 26 ASN HB2 1 1 1 321 1 1 26 ASN HB3 H -14.753 2.975 -0.216 1.00 . A A . 26 ASN HB3 1 1 1 322 1 1 26 ASN HD21 H -14.862 -0.283 0.970 1.00 . A A . 26 ASN HD21 1 1 1 323 1 1 26 ASN HD22 H -16.576 -0.373 1.085 1.00 . A A . 26 ASN HD22 1 1 1 324 1 1 26 ASN N N -13.135 0.339 -1.398 1.00 . A A . 26 ASN N 1 1 1 325 1 1 26 ASN ND2 N -15.756 0.081 0.818 1.00 . A A . 26 ASN ND2 1 1 1 326 1 1 26 ASN O O -13.969 3.705 -2.389 1.00 . A A . 26 ASN O 1 1 1 327 1 1 26 ASN OD1 O -16.957 1.776 0.006 1.00 . A A . 26 ASN OD1 1 1 1 328 1 1 27 TYR C C -10.643 2.900 -4.580 1.00 . A A . 27 TYR C 1 1 1 329 1 1 27 TYR CA C -11.385 3.467 -3.376 1.00 . A A . 27 TYR CA 1 1 1 330 1 1 27 TYR CB C -10.383 4.108 -2.405 1.00 . A A . 27 TYR CB 1 1 1 331 1 1 27 TYR CD1 C -11.075 3.597 -0.028 1.00 . A A . 27 TYR CD1 1 1 1 332 1 1 27 TYR CD2 C -11.449 5.798 -0.862 1.00 . A A . 27 TYR CD2 1 1 1 333 1 1 27 TYR CE1 C -11.620 3.959 1.185 1.00 . A A . 27 TYR CE1 1 1 1 334 1 1 27 TYR CE2 C -11.996 6.167 0.352 1.00 . A A . 27 TYR CE2 1 1 1 335 1 1 27 TYR CG C -10.981 4.509 -1.072 1.00 . A A . 27 TYR CG 1 1 1 336 1 1 27 TYR CZ C -12.076 5.244 1.373 1.00 . A A . 27 TYR CZ 1 1 1 337 1 1 27 TYR H H -11.743 1.532 -2.597 1.00 . A A . 27 TYR H 1 1 1 338 1 1 27 TYR HA H -12.080 4.223 -3.716 1.00 . A A . 27 TYR HA 1 1 1 339 1 1 27 TYR HB2 H -9.583 3.410 -2.212 1.00 . A A . 27 TYR HB2 1 1 1 340 1 1 27 TYR HB3 H -9.971 4.995 -2.863 1.00 . A A . 27 TYR HB3 1 1 1 341 1 1 27 TYR HD1 H -10.717 2.589 -0.175 1.00 . A A . 27 TYR HD1 1 1 1 342 1 1 27 TYR HD2 H -11.384 6.517 -1.665 1.00 . A A . 27 TYR HD2 1 1 1 343 1 1 27 TYR HE1 H -11.688 3.236 1.982 1.00 . A A . 27 TYR HE1 1 1 1 344 1 1 27 TYR HE2 H -12.356 7.176 0.498 1.00 . A A . 27 TYR HE2 1 1 1 345 1 1 27 TYR HH H -12.675 6.573 2.637 1.00 . A A . 27 TYR HH 1 1 1 346 1 1 27 TYR N N -12.153 2.417 -2.714 1.00 . A A . 27 TYR N 1 1 1 347 1 1 27 TYR O O -10.748 1.707 -4.878 1.00 . A A . 27 TYR O 1 1 1 348 1 1 27 TYR OH O -12.619 5.604 2.586 1.00 . A A . 27 TYR OH 1 1 1 349 1 1 28 ALA C C -7.662 3.021 -6.046 1.00 . A A . 28 ALA C 1 1 1 350 1 1 28 ALA CA C -9.111 3.321 -6.410 1.00 . A A . 28 ALA CA 1 1 1 351 1 1 28 ALA CB C -9.172 4.384 -7.495 1.00 . A A . 28 ALA CB 1 1 1 352 1 1 28 ALA H H -9.807 4.677 -4.941 1.00 . A A . 28 ALA H 1 1 1 353 1 1 28 ALA HA H -9.567 2.420 -6.798 1.00 . A A . 28 ALA HA 1 1 1 354 1 1 28 ALA HB1 H -8.926 5.345 -7.069 1.00 . A A . 28 ALA HB1 1 1 1 355 1 1 28 ALA HB2 H -8.464 4.142 -8.274 1.00 . A A . 28 ALA HB2 1 1 1 356 1 1 28 ALA HB3 H -10.168 4.418 -7.911 1.00 . A A . 28 ALA HB3 1 1 1 357 1 1 28 ALA N N -9.873 3.742 -5.246 1.00 . A A . 28 ALA N 1 1 1 358 1 1 28 ALA O O -7.073 2.065 -6.552 1.00 . A A . 28 ALA O 1 1 1 359 1 1 29 SER C C -5.367 4.382 -3.477 1.00 . A A . 29 SER C 1 1 1 360 1 1 29 SER CA C -5.682 3.669 -4.793 1.00 . A A . 29 SER CA 1 1 1 361 1 1 29 SER CB C -4.747 4.182 -5.899 1.00 . A A . 29 SER CB 1 1 1 362 1 1 29 SER H H -7.594 4.591 -4.796 1.00 . A A . 29 SER H 1 1 1 363 1 1 29 SER HA H -5.512 2.611 -4.660 1.00 . A A . 29 SER HA 1 1 1 364 1 1 29 SER HB2 H -4.004 4.832 -5.464 1.00 . A A . 29 SER HB2 1 1 1 365 1 1 29 SER HB3 H -4.256 3.340 -6.365 1.00 . A A . 29 SER HB3 1 1 1 366 1 1 29 SER HG H -6.147 5.447 -6.472 1.00 . A A . 29 SER HG 1 1 1 367 1 1 29 SER N N -7.078 3.846 -5.180 1.00 . A A . 29 SER N 1 1 1 368 1 1 29 SER O O -6.213 5.081 -2.917 1.00 . A A . 29 SER O 1 1 1 369 1 1 29 SER OG O -5.459 4.905 -6.895 1.00 . A A . 29 SER OG 1 1 1 370 1 1 30 HIS C C -2.161 5.039 -1.880 1.00 . A A . 30 HIS C 1 1 1 371 1 1 30 HIS CA C -3.665 4.789 -1.761 1.00 . A A . 30 HIS CA 1 1 1 372 1 1 30 HIS CB C -3.947 3.869 -0.570 1.00 . A A . 30 HIS CB 1 1 1 373 1 1 30 HIS CD2 C -2.081 2.109 -0.280 1.00 . A A . 30 HIS CD2 1 1 1 374 1 1 30 HIS CE1 C -2.989 0.433 -1.301 1.00 . A A . 30 HIS CE1 1 1 1 375 1 1 30 HIS CG C -3.301 2.525 -0.693 1.00 . A A . 30 HIS CG 1 1 1 376 1 1 30 HIS H H -3.529 3.596 -3.493 1.00 . A A . 30 HIS H 1 1 1 377 1 1 30 HIS HA H -4.174 5.731 -1.622 1.00 . A A . 30 HIS HA 1 1 1 378 1 1 30 HIS HB2 H -3.571 4.333 0.325 1.00 . A A . 30 HIS HB2 1 1 1 379 1 1 30 HIS HB3 H -5.011 3.722 -0.476 1.00 . A A . 30 HIS HB3 1 1 1 380 1 1 30 HIS HD1 H -4.764 1.418 -1.756 1.00 . A A . 30 HIS HD1 1 1 1 381 1 1 30 HIS HD2 H -1.364 2.688 0.276 1.00 . A A . 30 HIS HD2 1 1 1 382 1 1 30 HIS HE1 H -3.154 -0.547 -1.725 1.00 . A A . 30 HIS HE1 1 1 1 383 1 1 30 HIS N N -4.145 4.182 -2.995 1.00 . A A . 30 HIS N 1 1 1 384 1 1 30 HIS ND1 N -3.870 1.444 -1.340 1.00 . A A . 30 HIS ND1 1 1 1 385 1 1 30 HIS NE2 N -1.906 0.802 -0.672 1.00 . A A . 30 HIS NE2 1 1 1 386 1 1 30 HIS O O -1.552 4.658 -2.881 1.00 . A A . 30 HIS O 1 1 1 387 1 1 31 ARG C C 0.465 5.759 0.527 1.00 . A A . 31 ARG C 1 1 1 388 1 1 31 ARG CA C -0.125 5.921 -0.871 1.00 . A A . 31 ARG CA 1 1 1 389 1 1 31 ARG CB C 0.169 7.335 -1.389 1.00 . A A . 31 ARG CB 1 1 1 390 1 1 31 ARG CD C 0.262 8.001 -3.817 1.00 . A A . 31 ARG CD 1 1 1 391 1 1 31 ARG CG C -0.634 7.732 -2.620 1.00 . A A . 31 ARG CG 1 1 1 392 1 1 31 ARG CZ C -0.979 6.962 -5.691 1.00 . A A . 31 ARG CZ 1 1 1 393 1 1 31 ARG H H -2.089 5.916 -0.080 1.00 . A A . 31 ARG H 1 1 1 394 1 1 31 ARG HA H 0.342 5.203 -1.529 1.00 . A A . 31 ARG HA 1 1 1 395 1 1 31 ARG HB2 H -0.049 8.044 -0.604 1.00 . A A . 31 ARG HB2 1 1 1 396 1 1 31 ARG HB3 H 1.219 7.401 -1.636 1.00 . A A . 31 ARG HB3 1 1 1 397 1 1 31 ARG HD2 H 0.035 8.982 -4.209 1.00 . A A . 31 ARG HD2 1 1 1 398 1 1 31 ARG HD3 H 1.291 7.977 -3.490 1.00 . A A . 31 ARG HD3 1 1 1 399 1 1 31 ARG HE H 0.800 6.351 -5.003 1.00 . A A . 31 ARG HE 1 1 1 400 1 1 31 ARG HG2 H -1.314 6.930 -2.866 1.00 . A A . 31 ARG HG2 1 1 1 401 1 1 31 ARG HG3 H -1.198 8.627 -2.397 1.00 . A A . 31 ARG HG3 1 1 1 402 1 1 31 ARG HH11 H -1.936 8.539 -4.839 1.00 . A A . 31 ARG HH11 1 1 1 403 1 1 31 ARG HH12 H -2.774 7.787 -6.162 1.00 . A A . 31 ARG HH12 1 1 1 404 1 1 31 ARG HH21 H -0.305 5.363 -6.744 1.00 . A A . 31 ARG HH21 1 1 1 405 1 1 31 ARG HH22 H -1.847 5.998 -7.254 1.00 . A A . 31 ARG HH22 1 1 1 406 1 1 31 ARG N N -1.561 5.651 -0.862 1.00 . A A . 31 ARG N 1 1 1 407 1 1 31 ARG NE N 0.081 7.013 -4.881 1.00 . A A . 31 ARG NE 1 1 1 408 1 1 31 ARG NH1 N -1.974 7.833 -5.554 1.00 . A A . 31 ARG NH1 1 1 1 409 1 1 31 ARG NH2 N -1.048 6.033 -6.635 1.00 . A A . 31 ARG NH2 1 1 1 410 1 1 31 ARG O O 1.500 6.341 0.849 1.00 . A A . 31 ARG O 1 1 1 411 1 1 32 SER C C -0.206 3.402 3.223 1.00 . A A . 32 SER C 1 1 1 412 1 1 32 SER CA C 0.247 4.771 2.728 1.00 . A A . 32 SER CA 1 1 1 413 1 1 32 SER CB C -0.283 5.860 3.653 1.00 . A A . 32 SER CB 1 1 1 414 1 1 32 SER H H -1.047 4.583 1.084 1.00 . A A . 32 SER H 1 1 1 415 1 1 32 SER HA H 1.326 4.807 2.724 1.00 . A A . 32 SER HA 1 1 1 416 1 1 32 SER HB2 H -1.343 5.722 3.790 1.00 . A A . 32 SER HB2 1 1 1 417 1 1 32 SER HB3 H 0.211 5.782 4.604 1.00 . A A . 32 SER HB3 1 1 1 418 1 1 32 SER HG H 0.473 7.069 2.304 1.00 . A A . 32 SER HG 1 1 1 419 1 1 32 SER N N -0.214 5.001 1.372 1.00 . A A . 32 SER N 1 1 1 420 1 1 32 SER O O -0.999 2.727 2.563 1.00 . A A . 32 SER O 1 1 1 421 1 1 32 SER OG O -0.048 7.154 3.117 1.00 . A A . 32 SER OG 1 1 1 422 1 1 33 LEU C C -1.471 1.697 5.543 1.00 . A A . 33 LEU C 1 1 1 423 1 1 33 LEU CA C -0.061 1.713 4.972 1.00 . A A . 33 LEU CA 1 1 1 424 1 1 33 LEU CB C 0.926 1.375 6.083 1.00 . A A . 33 LEU CB 1 1 1 425 1 1 33 LEU CD1 C 3.330 0.771 6.342 1.00 . A A . 33 LEU CD1 1 1 1 426 1 1 33 LEU CD2 C 1.605 -1.025 6.120 1.00 . A A . 33 LEU CD2 1 1 1 427 1 1 33 LEU CG C 2.011 0.378 5.704 1.00 . A A . 33 LEU CG 1 1 1 428 1 1 33 LEU H H 0.905 3.592 4.879 1.00 . A A . 33 LEU H 1 1 1 429 1 1 33 LEU HA H 0.016 0.974 4.191 1.00 . A A . 33 LEU HA 1 1 1 430 1 1 33 LEU HB2 H 1.403 2.291 6.400 1.00 . A A . 33 LEU HB2 1 1 1 431 1 1 33 LEU HB3 H 0.373 0.971 6.918 1.00 . A A . 33 LEU HB3 1 1 1 432 1 1 33 LEU HD11 H 4.145 0.366 5.760 1.00 . A A . 33 LEU HD11 1 1 1 433 1 1 33 LEU HD12 H 3.406 1.849 6.368 1.00 . A A . 33 LEU HD12 1 1 1 434 1 1 33 LEU HD13 H 3.374 0.381 7.347 1.00 . A A . 33 LEU HD13 1 1 1 435 1 1 33 LEU HD21 H 1.257 -1.011 7.142 1.00 . A A . 33 LEU HD21 1 1 1 436 1 1 33 LEU HD22 H 0.814 -1.377 5.475 1.00 . A A . 33 LEU HD22 1 1 1 437 1 1 33 LEU HD23 H 2.455 -1.685 6.039 1.00 . A A . 33 LEU HD23 1 1 1 438 1 1 33 LEU HG H 2.141 0.387 4.630 1.00 . A A . 33 LEU HG 1 1 1 439 1 1 33 LEU N N 0.265 3.013 4.404 1.00 . A A . 33 LEU N 1 1 1 440 1 1 33 LEU O O -1.943 0.672 6.038 1.00 . A A . 33 LEU O 1 1 1 441 1 1 34 SER C C -4.480 2.387 4.998 1.00 . A A . 34 SER C 1 1 1 442 1 1 34 SER CA C -3.488 2.951 6.005 1.00 . A A . 34 SER CA 1 1 1 443 1 1 34 SER CB C -3.799 4.417 6.289 1.00 . A A . 34 SER CB 1 1 1 444 1 1 34 SER H H -1.706 3.629 5.111 1.00 . A A . 34 SER H 1 1 1 445 1 1 34 SER HA H -3.552 2.387 6.923 1.00 . A A . 34 SER HA 1 1 1 446 1 1 34 SER HB2 H -4.701 4.701 5.765 1.00 . A A . 34 SER HB2 1 1 1 447 1 1 34 SER HB3 H -3.940 4.555 7.351 1.00 . A A . 34 SER HB3 1 1 1 448 1 1 34 SER HG H -2.202 5.521 6.619 1.00 . A A . 34 SER HG 1 1 1 449 1 1 34 SER N N -2.137 2.836 5.493 1.00 . A A . 34 SER N 1 1 1 450 1 1 34 SER O O -5.611 2.042 5.345 1.00 . A A . 34 SER O 1 1 1 451 1 1 34 SER OG O -2.731 5.249 5.855 1.00 . A A . 34 SER OG 1 1 1 452 1 1 35 GLY C C -4.470 0.523 2.101 1.00 . A A . 35 GLY C 1 1 1 453 1 1 35 GLY CA C -4.920 1.841 2.694 1.00 . A A . 35 GLY CA 1 1 1 454 1 1 35 GLY H H -3.144 2.628 3.526 1.00 . A A . 35 GLY H 1 1 1 455 1 1 35 GLY HA2 H -5.914 1.719 3.097 1.00 . A A . 35 GLY HA2 1 1 1 456 1 1 35 GLY HA3 H -4.952 2.582 1.908 1.00 . A A . 35 GLY HA3 1 1 1 457 1 1 35 GLY N N -4.051 2.316 3.743 1.00 . A A . 35 GLY N 1 1 1 458 1 1 35 GLY O O -5.178 -0.052 1.276 1.00 . A A . 35 GLY O 1 1 1 459 1 1 36 CYS C C -3.627 -2.363 2.224 1.00 . A A . 36 CYS C 1 1 1 460 1 1 36 CYS CA C -2.716 -1.166 1.959 1.00 . A A . 36 CYS CA 1 1 1 461 1 1 36 CYS CB C -1.347 -1.431 2.587 1.00 . A A . 36 CYS CB 1 1 1 462 1 1 36 CYS H H -2.750 0.594 3.123 1.00 . A A . 36 CYS H 1 1 1 463 1 1 36 CYS HA H -2.596 -1.049 0.893 1.00 . A A . 36 CYS HA 1 1 1 464 1 1 36 CYS HB2 H -1.413 -1.266 3.654 1.00 . A A . 36 CYS HB2 1 1 1 465 1 1 36 CYS HB3 H -1.070 -2.460 2.403 1.00 . A A . 36 CYS HB3 1 1 1 466 1 1 36 CYS N N -3.279 0.070 2.486 1.00 . A A . 36 CYS N 1 1 1 467 1 1 36 CYS O O -3.747 -2.829 3.358 1.00 . A A . 36 CYS O 1 1 1 468 1 1 36 CYS SG S -0.008 -0.378 1.954 1.00 . A A . 36 CYS SG 1 1 1 469 1 1 37 PRO C C -4.124 -5.374 1.454 1.00 . A A . 37 PRO C 1 1 1 470 1 1 37 PRO CA C -5.013 -4.147 1.281 1.00 . A A . 37 PRO CA 1 1 1 471 1 1 37 PRO CB C -5.773 -4.184 -0.042 1.00 . A A . 37 PRO CB 1 1 1 472 1 1 37 PRO CD C -4.087 -2.487 -0.234 1.00 . A A . 37 PRO CD 1 1 1 473 1 1 37 PRO CG C -4.861 -3.518 -1.017 1.00 . A A . 37 PRO CG 1 1 1 474 1 1 37 PRO HA H -5.710 -4.084 2.106 1.00 . A A . 37 PRO HA 1 1 1 475 1 1 37 PRO HB2 H -5.978 -5.207 -0.316 1.00 . A A . 37 PRO HB2 1 1 1 476 1 1 37 PRO HB3 H -6.708 -3.637 0.064 1.00 . A A . 37 PRO HB3 1 1 1 477 1 1 37 PRO HD2 H -3.052 -2.468 -0.543 1.00 . A A . 37 PRO HD2 1 1 1 478 1 1 37 PRO HD3 H -4.533 -1.512 -0.361 1.00 . A A . 37 PRO HD3 1 1 1 479 1 1 37 PRO HG2 H -4.187 -4.246 -1.446 1.00 . A A . 37 PRO HG2 1 1 1 480 1 1 37 PRO HG3 H -5.441 -3.038 -1.795 1.00 . A A . 37 PRO HG3 1 1 1 481 1 1 37 PRO N N -4.211 -2.937 1.166 1.00 . A A . 37 PRO N 1 1 1 482 1 1 37 PRO O O -4.577 -6.446 1.859 1.00 . A A . 37 PRO O 1 1 1 483 1 1 38 ARG C C -0.883 -5.805 2.574 1.00 . A A . 38 ARG C 1 1 1 484 1 1 38 ARG CA C -1.838 -6.206 1.454 1.00 . A A . 38 ARG CA 1 1 1 485 1 1 38 ARG CB C -1.044 -6.462 0.173 1.00 . A A . 38 ARG CB 1 1 1 486 1 1 38 ARG CD C -1.577 -6.193 -2.253 1.00 . A A . 38 ARG CD 1 1 1 487 1 1 38 ARG CG C -1.888 -6.958 -0.984 1.00 . A A . 38 ARG CG 1 1 1 488 1 1 38 ARG CZ C -2.778 -4.738 -3.832 1.00 . A A . 38 ARG CZ 1 1 1 489 1 1 38 ARG H H -2.526 -4.268 0.996 1.00 . A A . 38 ARG H 1 1 1 490 1 1 38 ARG HA H -2.354 -7.111 1.735 1.00 . A A . 38 ARG HA 1 1 1 491 1 1 38 ARG HB2 H -0.567 -5.542 -0.131 1.00 . A A . 38 ARG HB2 1 1 1 492 1 1 38 ARG HB3 H -0.283 -7.200 0.377 1.00 . A A . 38 ARG HB3 1 1 1 493 1 1 38 ARG HD2 H -0.938 -5.358 -2.007 1.00 . A A . 38 ARG HD2 1 1 1 494 1 1 38 ARG HD3 H -1.063 -6.850 -2.936 1.00 . A A . 38 ARG HD3 1 1 1 495 1 1 38 ARG HE H -3.648 -6.087 -2.620 1.00 . A A . 38 ARG HE 1 1 1 496 1 1 38 ARG HG2 H -1.683 -8.006 -1.147 1.00 . A A . 38 ARG HG2 1 1 1 497 1 1 38 ARG HG3 H -2.932 -6.825 -0.740 1.00 . A A . 38 ARG HG3 1 1 1 498 1 1 38 ARG HH11 H -0.774 -4.477 -3.772 1.00 . A A . 38 ARG HH11 1 1 1 499 1 1 38 ARG HH12 H -1.614 -3.455 -4.903 1.00 . A A . 38 ARG HH12 1 1 1 500 1 1 38 ARG HH21 H -4.787 -4.762 -4.130 1.00 . A A . 38 ARG HH21 1 1 1 501 1 1 38 ARG HH22 H -3.899 -3.626 -5.105 1.00 . A A . 38 ARG HH22 1 1 1 502 1 1 38 ARG N N -2.829 -5.168 1.244 1.00 . A A . 38 ARG N 1 1 1 503 1 1 38 ARG NE N -2.784 -5.687 -2.898 1.00 . A A . 38 ARG NE 1 1 1 504 1 1 38 ARG NH1 N -1.629 -4.181 -4.197 1.00 . A A . 38 ARG NH1 1 1 1 505 1 1 38 ARG NH2 N -3.911 -4.345 -4.399 1.00 . A A . 38 ARG NH2 1 1 1 506 1 1 38 ARG O O 0.238 -6.312 2.649 1.00 . A A . 38 ARG O 1 1 1 507 1 1 39 ALA C C -0.030 -5.531 5.407 1.00 . A A . 39 ALA C 1 1 1 508 1 1 39 ALA CA C -0.503 -4.386 4.531 1.00 . A A . 39 ALA CA 1 1 1 509 1 1 39 ALA CB C -1.263 -3.380 5.373 1.00 . A A . 39 ALA CB 1 1 1 510 1 1 39 ALA H H -2.224 -4.504 3.299 1.00 . A A . 39 ALA H 1 1 1 511 1 1 39 ALA HA H 0.358 -3.888 4.108 1.00 . A A . 39 ALA HA 1 1 1 512 1 1 39 ALA HB1 H -1.364 -2.455 4.827 1.00 . A A . 39 ALA HB1 1 1 1 513 1 1 39 ALA HB2 H -2.240 -3.771 5.609 1.00 . A A . 39 ALA HB2 1 1 1 514 1 1 39 ALA HB3 H -0.717 -3.201 6.287 1.00 . A A . 39 ALA HB3 1 1 1 515 1 1 39 ALA N N -1.327 -4.879 3.428 1.00 . A A . 39 ALA N 1 1 1 516 1 1 39 ALA O O -0.806 -6.083 6.195 1.00 . A A . 39 ALA O 1 1 1 517 1 1 40 LYS C C 0.921 -8.288 5.804 1.00 . A A . 40 LYS C 1 1 1 518 1 1 40 LYS CA C 1.832 -7.061 5.887 1.00 . A A . 40 LYS CA 1 1 1 519 1 1 40 LYS CB C 2.141 -6.714 7.346 1.00 . A A . 40 LYS CB 1 1 1 520 1 1 40 LYS CD C 3.087 -4.379 7.352 1.00 . A A . 40 LYS CD 1 1 1 521 1 1 40 LYS CE C 3.130 -3.640 8.679 1.00 . A A . 40 LYS CE 1 1 1 522 1 1 40 LYS CG C 3.391 -5.861 7.523 1.00 . A A . 40 LYS CG 1 1 1 523 1 1 40 LYS H H 1.750 -5.440 4.533 1.00 . A A . 40 LYS H 1 1 1 524 1 1 40 LYS HA H 2.759 -7.286 5.378 1.00 . A A . 40 LYS HA 1 1 1 525 1 1 40 LYS HB2 H 1.303 -6.177 7.760 1.00 . A A . 40 LYS HB2 1 1 1 526 1 1 40 LYS HB3 H 2.278 -7.632 7.900 1.00 . A A . 40 LYS HB3 1 1 1 527 1 1 40 LYS HD2 H 3.820 -3.946 6.687 1.00 . A A . 40 LYS HD2 1 1 1 528 1 1 40 LYS HD3 H 2.102 -4.271 6.922 1.00 . A A . 40 LYS HD3 1 1 1 529 1 1 40 LYS HE2 H 3.580 -4.283 9.420 1.00 . A A . 40 LYS HE2 1 1 1 530 1 1 40 LYS HE3 H 3.731 -2.751 8.563 1.00 . A A . 40 LYS HE3 1 1 1 531 1 1 40 LYS HG2 H 3.787 -6.023 8.514 1.00 . A A . 40 LYS HG2 1 1 1 532 1 1 40 LYS HG3 H 4.125 -6.156 6.788 1.00 . A A . 40 LYS HG3 1 1 1 533 1 1 40 LYS HZ1 H 1.045 -3.638 8.505 1.00 . A A . 40 LYS HZ1 1 1 1 534 1 1 40 LYS HZ2 H 1.685 -2.208 9.162 1.00 . A A . 40 LYS HZ2 1 1 1 535 1 1 40 LYS HZ3 H 1.601 -3.616 10.105 1.00 . A A . 40 LYS HZ3 1 1 1 536 1 1 40 LYS N N 1.226 -5.918 5.204 1.00 . A A . 40 LYS N 1 1 1 537 1 1 40 LYS NZ N 1.773 -3.248 9.143 1.00 . A A . 40 LYS NZ 1 1 1 538 1 1 40 LYS O O 0.789 -9.051 6.762 1.00 . A A . 40 LYS O 1 1 1 539 1 1 41 LYS C C -0.020 -10.708 3.822 1.00 . A A . 41 LYS C 1 1 1 540 1 1 41 LYS CA C -0.706 -9.510 4.461 1.00 . A A . 41 LYS CA 1 1 1 541 1 1 41 LYS CB C -1.857 -9.030 3.575 1.00 . A A . 41 LYS CB 1 1 1 542 1 1 41 LYS CD C -4.096 -10.108 3.278 1.00 . A A . 41 LYS CD 1 1 1 543 1 1 41 LYS CE C -5.560 -9.713 3.365 1.00 . A A . 41 LYS CE 1 1 1 544 1 1 41 LYS CG C -3.231 -9.248 4.182 1.00 . A A . 41 LYS CG 1 1 1 545 1 1 41 LYS H H 0.368 -7.757 3.959 1.00 . A A . 41 LYS H 1 1 1 546 1 1 41 LYS HA H -1.099 -9.803 5.423 1.00 . A A . 41 LYS HA 1 1 1 547 1 1 41 LYS HB2 H -1.736 -7.974 3.388 1.00 . A A . 41 LYS HB2 1 1 1 548 1 1 41 LYS HB3 H -1.816 -9.560 2.635 1.00 . A A . 41 LYS HB3 1 1 1 549 1 1 41 LYS HD2 H -3.761 -9.990 2.258 1.00 . A A . 41 LYS HD2 1 1 1 550 1 1 41 LYS HD3 H -3.991 -11.142 3.576 1.00 . A A . 41 LYS HD3 1 1 1 551 1 1 41 LYS HE2 H -6.161 -10.607 3.325 1.00 . A A . 41 LYS HE2 1 1 1 552 1 1 41 LYS HE3 H -5.728 -9.210 4.307 1.00 . A A . 41 LYS HE3 1 1 1 553 1 1 41 LYS HG2 H -3.120 -9.741 5.137 1.00 . A A . 41 LYS HG2 1 1 1 554 1 1 41 LYS HG3 H -3.710 -8.289 4.320 1.00 . A A . 41 LYS HG3 1 1 1 555 1 1 41 LYS HZ1 H -6.991 -8.620 2.303 1.00 . A A . 41 LYS HZ1 1 1 1 556 1 1 41 LYS HZ2 H -5.751 -9.247 1.334 1.00 . A A . 41 LYS HZ2 1 1 1 557 1 1 41 LYS HZ3 H -5.457 -7.902 2.321 1.00 . A A . 41 LYS HZ3 1 1 1 558 1 1 41 LYS N N 0.248 -8.428 4.668 1.00 . A A . 41 LYS N 1 1 1 559 1 1 41 LYS NZ N -5.967 -8.809 2.255 1.00 . A A . 41 LYS NZ 1 1 1 560 1 1 41 LYS O O -0.204 -10.972 2.633 1.00 . A A . 41 LYS O 1 1 1 561 1 1 42 SER C C 2.675 -12.124 3.169 1.00 . A A . 42 SER C 1 1 1 562 1 1 42 SER CA C 1.582 -12.547 4.155 1.00 . A A . 42 SER CA 1 1 1 563 1 1 42 SER CB C 0.665 -13.610 3.537 1.00 . A A . 42 SER CB 1 1 1 564 1 1 42 SER H H 0.917 -11.095 5.542 1.00 . A A . 42 SER H 1 1 1 565 1 1 42 SER HA H 2.061 -12.973 5.023 1.00 . A A . 42 SER HA 1 1 1 566 1 1 42 SER HB2 H 0.290 -13.253 2.588 1.00 . A A . 42 SER HB2 1 1 1 567 1 1 42 SER HB3 H 1.225 -14.522 3.385 1.00 . A A . 42 SER HB3 1 1 1 568 1 1 42 SER HG H -0.253 -13.528 5.276 1.00 . A A . 42 SER HG 1 1 1 569 1 1 42 SER N N 0.806 -11.393 4.615 1.00 . A A . 42 SER N 1 1 1 570 1 1 42 SER O O 3.860 -12.146 3.508 1.00 . A A . 42 SER O 1 1 1 571 1 1 42 SER OG O -0.437 -13.887 4.391 1.00 . A A . 42 SER OG 1 1 1 572 1 1 43 GLY C C 3.605 -9.667 1.358 1.00 . A A . 43 GLY C 1 1 1 573 1 1 43 GLY CA C 3.222 -11.098 1.049 1.00 . A A . 43 GLY CA 1 1 1 574 1 1 43 GLY H H 1.306 -11.521 1.843 1.00 . A A . 43 GLY H 1 1 1 575 1 1 43 GLY HA2 H 4.111 -11.711 1.066 1.00 . A A . 43 GLY HA2 1 1 1 576 1 1 43 GLY HA3 H 2.784 -11.140 0.064 1.00 . A A . 43 GLY HA3 1 1 1 577 1 1 43 GLY N N 2.271 -11.621 2.009 1.00 . A A . 43 GLY N 1 1 1 578 1 1 43 GLY O O 3.215 -8.742 0.643 1.00 . A A . 43 GLY O 1 1 1 579 1 1 44 LEU C C 5.918 -7.634 2.153 1.00 . A A . 44 LEU C 1 1 1 580 1 1 44 LEU CA C 4.705 -8.152 2.916 1.00 . A A . 44 LEU CA 1 1 1 581 1 1 44 LEU CB C 4.997 -8.156 4.422 1.00 . A A . 44 LEU CB 1 1 1 582 1 1 44 LEU CD1 C 6.895 -9.519 5.331 1.00 . A A . 44 LEU CD1 1 1 1 583 1 1 44 LEU CD2 C 4.599 -9.804 6.269 1.00 . A A . 44 LEU CD2 1 1 1 584 1 1 44 LEU CG C 5.409 -9.506 5.018 1.00 . A A . 44 LEU CG 1 1 1 585 1 1 44 LEU H H 4.569 -10.266 3.000 1.00 . A A . 44 LEU H 1 1 1 586 1 1 44 LEU HA H 3.874 -7.489 2.727 1.00 . A A . 44 LEU HA 1 1 1 587 1 1 44 LEU HB2 H 5.791 -7.449 4.612 1.00 . A A . 44 LEU HB2 1 1 1 588 1 1 44 LEU HB3 H 4.109 -7.818 4.936 1.00 . A A . 44 LEU HB3 1 1 1 589 1 1 44 LEU HD11 H 7.436 -9.023 4.538 1.00 . A A . 44 LEU HD11 1 1 1 590 1 1 44 LEU HD12 H 7.071 -9.005 6.264 1.00 . A A . 44 LEU HD12 1 1 1 591 1 1 44 LEU HD13 H 7.236 -10.541 5.415 1.00 . A A . 44 LEU HD13 1 1 1 592 1 1 44 LEU HD21 H 4.062 -8.915 6.571 1.00 . A A . 44 LEU HD21 1 1 1 593 1 1 44 LEU HD22 H 3.896 -10.596 6.064 1.00 . A A . 44 LEU HD22 1 1 1 594 1 1 44 LEU HD23 H 5.263 -10.110 7.064 1.00 . A A . 44 LEU HD23 1 1 1 595 1 1 44 LEU HG H 5.214 -10.289 4.299 1.00 . A A . 44 LEU HG 1 1 1 596 1 1 44 LEU N N 4.321 -9.482 2.459 1.00 . A A . 44 LEU N 1 1 1 597 1 1 44 LEU O O 6.046 -6.432 1.916 1.00 . A A . 44 LEU O 1 1 1 598 1 1 45 ARG C C 8.397 -9.220 0.047 1.00 . A A . 45 ARG C 1 1 1 599 1 1 45 ARG CA C 8.022 -8.156 1.069 1.00 . A A . 45 ARG CA 1 1 1 600 1 1 45 ARG CB C 9.177 -7.931 2.045 1.00 . A A . 45 ARG CB 1 1 1 601 1 1 45 ARG CD C 11.196 -6.559 2.636 1.00 . A A . 45 ARG CD 1 1 1 602 1 1 45 ARG CG C 10.211 -6.939 1.542 1.00 . A A . 45 ARG CG 1 1 1 603 1 1 45 ARG CZ C 11.604 -4.122 2.629 1.00 . A A . 45 ARG CZ 1 1 1 604 1 1 45 ARG H H 6.673 -9.482 2.016 1.00 . A A . 45 ARG H 1 1 1 605 1 1 45 ARG HA H 7.819 -7.231 0.549 1.00 . A A . 45 ARG HA 1 1 1 606 1 1 45 ARG HB2 H 8.778 -7.561 2.978 1.00 . A A . 45 ARG HB2 1 1 1 607 1 1 45 ARG HB3 H 9.673 -8.874 2.226 1.00 . A A . 45 ARG HB3 1 1 1 608 1 1 45 ARG HD2 H 11.080 -7.245 3.461 1.00 . A A . 45 ARG HD2 1 1 1 609 1 1 45 ARG HD3 H 12.200 -6.640 2.241 1.00 . A A . 45 ARG HD3 1 1 1 610 1 1 45 ARG HE H 10.339 -5.072 3.858 1.00 . A A . 45 ARG HE 1 1 1 611 1 1 45 ARG HG2 H 10.755 -7.387 0.724 1.00 . A A . 45 ARG HG2 1 1 1 612 1 1 45 ARG HG3 H 9.705 -6.049 1.197 1.00 . A A . 45 ARG HG3 1 1 1 613 1 1 45 ARG HH11 H 12.663 -5.155 1.232 1.00 . A A . 45 ARG HH11 1 1 1 614 1 1 45 ARG HH12 H 12.943 -3.438 1.264 1.00 . A A . 45 ARG HH12 1 1 1 615 1 1 45 ARG HH21 H 10.687 -2.821 3.889 1.00 . A A . 45 ARG HH21 1 1 1 616 1 1 45 ARG HH22 H 11.811 -2.106 2.769 1.00 . A A . 45 ARG HH22 1 1 1 617 1 1 45 ARG N N 6.817 -8.536 1.787 1.00 . A A . 45 ARG N 1 1 1 618 1 1 45 ARG NE N 10.985 -5.194 3.121 1.00 . A A . 45 ARG NE 1 1 1 619 1 1 45 ARG NH1 N 12.470 -4.247 1.630 1.00 . A A . 45 ARG NH1 1 1 1 620 1 1 45 ARG NH2 N 11.347 -2.922 3.137 1.00 . A A . 45 ARG NH2 1 1 1 621 1 1 45 ARG O O 8.802 -10.328 0.407 1.00 . A A . 45 ARG O 1 1 1 622 1 1 46 VAL C C 9.546 -9.114 -3.275 1.00 . A A . 46 VAL C 1 1 1 623 1 1 46 VAL CA C 8.588 -9.792 -2.306 1.00 . A A . 46 VAL CA 1 1 1 624 1 1 46 VAL CB C 7.335 -10.265 -3.078 1.00 . A A . 46 VAL CB 1 1 1 625 1 1 46 VAL CG1 C 7.685 -11.404 -4.024 1.00 . A A . 46 VAL CG1 1 1 1 626 1 1 46 VAL CG2 C 6.231 -10.685 -2.117 1.00 . A A . 46 VAL CG2 1 1 1 627 1 1 46 VAL H H 7.932 -7.981 -1.446 1.00 . A A . 46 VAL H 1 1 1 628 1 1 46 VAL HA H 9.074 -10.657 -1.875 1.00 . A A . 46 VAL HA 1 1 1 629 1 1 46 VAL HB H 6.970 -9.437 -3.670 1.00 . A A . 46 VAL HB 1 1 1 630 1 1 46 VAL HG11 H 6.800 -11.984 -4.233 1.00 . A A . 46 VAL HG11 1 1 1 631 1 1 46 VAL HG12 H 8.076 -10.998 -4.945 1.00 . A A . 46 VAL HG12 1 1 1 632 1 1 46 VAL HG13 H 8.431 -12.037 -3.565 1.00 . A A . 46 VAL HG13 1 1 1 633 1 1 46 VAL HG21 H 5.831 -11.640 -2.424 1.00 . A A . 46 VAL HG21 1 1 1 634 1 1 46 VAL HG22 H 6.635 -10.769 -1.118 1.00 . A A . 46 VAL HG22 1 1 1 635 1 1 46 VAL HG23 H 5.445 -9.945 -2.127 1.00 . A A . 46 VAL HG23 1 1 1 636 1 1 46 VAL N N 8.251 -8.880 -1.225 1.00 . A A . 46 VAL N 1 1 1 637 1 1 46 VAL O O 10.665 -9.633 -3.469 1.00 . A A . 46 VAL O 1 1 1 638 1 1 46 VAL OXT O 9.185 -8.047 -3.814 1.00 . A A . 46 VAL OXT 1 1 1 639 2 2 1 ZN ZN ZN -0.289 -0.216 -0.308 1.00 . B A . 47 ZN ZN 1 1 2 640 1 1 1 GLY C C 3.771 11.712 -5.310 1.00 . A A . 1 GLY C 1 1 2 641 1 1 1 GLY CA C 3.336 12.551 -6.491 1.00 . A A . 1 GLY CA 1 1 2 642 1 1 1 GLY H1 H 5.125 13.602 -6.271 1.00 . A A . 1 GLY H1 1 1 2 643 1 1 1 GLY H2 H 3.738 14.570 -6.166 1.00 . A A . 1 GLY H2 1 1 2 644 1 1 1 GLY H3 H 4.259 13.996 -7.675 1.00 . A A . 1 GLY H3 1 1 2 645 1 1 1 GLY HA2 H 2.310 12.854 -6.345 1.00 . A A . 1 GLY HA2 1 1 2 646 1 1 1 GLY HA3 H 3.400 11.952 -7.388 1.00 . A A . 1 GLY HA3 1 1 2 647 1 1 1 GLY N N 4.172 13.763 -6.662 1.00 . A A . 1 GLY N 1 1 2 648 1 1 1 GLY O O 2.942 11.284 -4.506 1.00 . A A . 1 GLY O 1 1 2 649 1 1 2 SER C C 5.306 11.335 -2.764 1.00 . A A . 2 SER C 1 1 2 650 1 1 2 SER CA C 5.625 10.690 -4.113 1.00 . A A . 2 SER CA 1 1 2 651 1 1 2 SER CB C 7.135 10.548 -4.302 1.00 . A A . 2 SER CB 1 1 2 652 1 1 2 SER H H 5.682 11.833 -5.884 1.00 . A A . 2 SER H 1 1 2 653 1 1 2 SER HA H 5.173 9.711 -4.148 1.00 . A A . 2 SER HA 1 1 2 654 1 1 2 SER HB2 H 7.643 11.285 -3.697 1.00 . A A . 2 SER HB2 1 1 2 655 1 1 2 SER HB3 H 7.443 9.558 -4.002 1.00 . A A . 2 SER HB3 1 1 2 656 1 1 2 SER HG H 7.377 9.921 -6.155 1.00 . A A . 2 SER HG 1 1 2 657 1 1 2 SER N N 5.071 11.475 -5.205 1.00 . A A . 2 SER N 1 1 2 658 1 1 2 SER O O 5.422 12.555 -2.602 1.00 . A A . 2 SER O 1 1 2 659 1 1 2 SER OG O 7.497 10.749 -5.664 1.00 . A A . 2 SER OG 1 1 2 660 1 1 3 MET C C 5.729 11.192 0.371 1.00 . A A . 3 MET C 1 1 2 661 1 1 3 MET CA C 4.490 11.021 -0.497 1.00 . A A . 3 MET CA 1 1 2 662 1 1 3 MET CB C 3.492 10.067 0.171 1.00 . A A . 3 MET CB 1 1 2 663 1 1 3 MET CE C 1.432 9.210 3.394 1.00 . A A . 3 MET CE 1 1 2 664 1 1 3 MET CG C 3.052 10.508 1.558 1.00 . A A . 3 MET CG 1 1 2 665 1 1 3 MET H H 4.787 9.558 -1.999 1.00 . A A . 3 MET H 1 1 2 666 1 1 3 MET HA H 4.021 11.985 -0.628 1.00 . A A . 3 MET HA 1 1 2 667 1 1 3 MET HB2 H 2.614 9.990 -0.455 1.00 . A A . 3 MET HB2 1 1 2 668 1 1 3 MET HB3 H 3.947 9.092 0.256 1.00 . A A . 3 MET HB3 1 1 2 669 1 1 3 MET HE1 H 2.421 9.323 3.811 1.00 . A A . 3 MET HE1 1 1 2 670 1 1 3 MET HE2 H 0.697 9.567 4.101 1.00 . A A . 3 MET HE2 1 1 2 671 1 1 3 MET HE3 H 1.250 8.169 3.179 1.00 . A A . 3 MET HE3 1 1 2 672 1 1 3 MET HG2 H 3.649 9.983 2.292 1.00 . A A . 3 MET HG2 1 1 2 673 1 1 3 MET HG3 H 3.218 11.571 1.653 1.00 . A A . 3 MET HG3 1 1 2 674 1 1 3 MET N N 4.864 10.523 -1.813 1.00 . A A . 3 MET N 1 1 2 675 1 1 3 MET O O 5.958 12.260 0.940 1.00 . A A . 3 MET O 1 1 2 676 1 1 3 MET SD S 1.310 10.161 1.880 1.00 . A A . 3 MET SD 1 1 2 677 1 1 4 ALA C C 8.931 10.746 0.264 1.00 . A A . 4 ALA C 1 1 2 678 1 1 4 ALA CA C 7.809 10.214 1.150 1.00 . A A . 4 ALA CA 1 1 2 679 1 1 4 ALA CB C 8.163 8.840 1.696 1.00 . A A . 4 ALA CB 1 1 2 680 1 1 4 ALA H H 6.337 9.349 -0.106 1.00 . A A . 4 ALA H 1 1 2 681 1 1 4 ALA HA H 7.673 10.887 1.984 1.00 . A A . 4 ALA HA 1 1 2 682 1 1 4 ALA HB1 H 7.610 8.662 2.608 1.00 . A A . 4 ALA HB1 1 1 2 683 1 1 4 ALA HB2 H 7.909 8.085 0.967 1.00 . A A . 4 ALA HB2 1 1 2 684 1 1 4 ALA HB3 H 9.222 8.798 1.903 1.00 . A A . 4 ALA HB3 1 1 2 685 1 1 4 ALA N N 6.557 10.161 0.411 1.00 . A A . 4 ALA N 1 1 2 686 1 1 4 ALA O O 8.782 10.836 -0.956 1.00 . A A . 4 ALA O 1 1 2 687 1 1 5 ALA C C 12.056 10.672 -0.472 1.00 . A A . 5 ALA C 1 1 2 688 1 1 5 ALA CA C 11.151 11.734 0.155 1.00 . A A . 5 ALA CA 1 1 2 689 1 1 5 ALA CB C 11.952 12.643 1.074 1.00 . A A . 5 ALA CB 1 1 2 690 1 1 5 ALA H H 10.081 11.081 1.866 1.00 . A A . 5 ALA H 1 1 2 691 1 1 5 ALA HA H 10.740 12.345 -0.636 1.00 . A A . 5 ALA HA 1 1 2 692 1 1 5 ALA HB1 H 12.027 13.626 0.632 1.00 . A A . 5 ALA HB1 1 1 2 693 1 1 5 ALA HB2 H 11.457 12.714 2.033 1.00 . A A . 5 ALA HB2 1 1 2 694 1 1 5 ALA HB3 H 12.942 12.234 1.212 1.00 . A A . 5 ALA HB3 1 1 2 695 1 1 5 ALA N N 10.034 11.140 0.883 1.00 . A A . 5 ALA N 1 1 2 696 1 1 5 ALA O O 13.272 10.669 -0.261 1.00 . A A . 5 ALA O 1 1 2 697 1 1 6 HIS C C 11.518 8.588 -3.430 1.00 . A A . 6 HIS C 1 1 2 698 1 1 6 HIS CA C 12.255 8.905 -2.133 1.00 . A A . 6 HIS CA 1 1 2 699 1 1 6 HIS CB C 12.580 7.633 -1.324 1.00 . A A . 6 HIS CB 1 1 2 700 1 1 6 HIS CD2 C 10.350 6.894 -0.220 1.00 . A A . 6 HIS CD2 1 1 2 701 1 1 6 HIS CE1 C 10.187 4.908 -1.121 1.00 . A A . 6 HIS CE1 1 1 2 702 1 1 6 HIS CG C 11.418 6.731 -1.035 1.00 . A A . 6 HIS CG 1 1 2 703 1 1 6 HIS H H 10.530 9.993 -1.567 1.00 . A A . 6 HIS H 1 1 2 704 1 1 6 HIS HA H 13.186 9.391 -2.392 1.00 . A A . 6 HIS HA 1 1 2 705 1 1 6 HIS HB2 H 13.308 7.054 -1.870 1.00 . A A . 6 HIS HB2 1 1 2 706 1 1 6 HIS HB3 H 13.011 7.928 -0.377 1.00 . A A . 6 HIS HB3 1 1 2 707 1 1 6 HIS HD1 H 11.915 5.056 -2.215 1.00 . A A . 6 HIS HD1 1 1 2 708 1 1 6 HIS HD2 H 10.128 7.766 0.379 1.00 . A A . 6 HIS HD2 1 1 2 709 1 1 6 HIS HE1 H 9.833 3.920 -1.376 1.00 . A A . 6 HIS HE1 1 1 2 710 1 1 6 HIS HE2 H 8.658 5.670 0.005 1.00 . A A . 6 HIS HE2 1 1 2 711 1 1 6 HIS N N 11.481 9.860 -1.350 1.00 . A A . 6 HIS N 1 1 2 712 1 1 6 HIS ND1 N 11.286 5.477 -1.584 1.00 . A A . 6 HIS ND1 1 1 2 713 1 1 6 HIS NE2 N 9.600 5.747 -0.291 1.00 . A A . 6 HIS NE2 1 1 2 714 1 1 6 HIS O O 10.290 8.583 -3.463 1.00 . A A . 6 HIS O 1 1 2 715 1 1 7 SER C C 10.768 7.238 -6.037 1.00 . A A . 7 SER C 1 1 2 716 1 1 7 SER CA C 11.688 8.449 -5.860 1.00 . A A . 7 SER CA 1 1 2 717 1 1 7 SER CB C 12.817 8.410 -6.884 1.00 . A A . 7 SER CB 1 1 2 718 1 1 7 SER H H 13.235 8.703 -4.442 1.00 . A A . 7 SER H 1 1 2 719 1 1 7 SER HA H 11.109 9.347 -6.022 1.00 . A A . 7 SER HA 1 1 2 720 1 1 7 SER HB2 H 12.778 7.478 -7.427 1.00 . A A . 7 SER HB2 1 1 2 721 1 1 7 SER HB3 H 12.705 9.236 -7.573 1.00 . A A . 7 SER HB3 1 1 2 722 1 1 7 SER HG H 14.463 9.385 -6.434 1.00 . A A . 7 SER HG 1 1 2 723 1 1 7 SER N N 12.267 8.536 -4.521 1.00 . A A . 7 SER N 1 1 2 724 1 1 7 SER O O 9.811 7.288 -6.811 1.00 . A A . 7 SER O 1 1 2 725 1 1 7 SER OG O 14.077 8.516 -6.242 1.00 . A A . 7 SER OG 1 1 2 726 1 1 8 ALA C C 8.938 5.027 -4.696 1.00 . A A . 8 ALA C 1 1 2 727 1 1 8 ALA CA C 10.262 4.932 -5.454 1.00 . A A . 8 ALA CA 1 1 2 728 1 1 8 ALA CB C 11.060 3.732 -4.972 1.00 . A A . 8 ALA CB 1 1 2 729 1 1 8 ALA H H 11.838 6.157 -4.732 1.00 . A A . 8 ALA H 1 1 2 730 1 1 8 ALA HA H 10.051 4.788 -6.504 1.00 . A A . 8 ALA HA 1 1 2 731 1 1 8 ALA HB1 H 10.391 2.902 -4.803 1.00 . A A . 8 ALA HB1 1 1 2 732 1 1 8 ALA HB2 H 11.789 3.461 -5.722 1.00 . A A . 8 ALA HB2 1 1 2 733 1 1 8 ALA HB3 H 11.565 3.982 -4.051 1.00 . A A . 8 ALA HB3 1 1 2 734 1 1 8 ALA N N 11.054 6.153 -5.326 1.00 . A A . 8 ALA N 1 1 2 735 1 1 8 ALA O O 8.149 4.083 -4.694 1.00 . A A . 8 ALA O 1 1 2 736 1 1 9 ASP C C 6.301 6.822 -4.323 1.00 . A A . 9 ASP C 1 1 2 737 1 1 9 ASP CA C 7.414 6.394 -3.375 1.00 . A A . 9 ASP CA 1 1 2 738 1 1 9 ASP CB C 7.587 7.439 -2.272 1.00 . A A . 9 ASP CB 1 1 2 739 1 1 9 ASP CG C 6.680 7.183 -1.082 1.00 . A A . 9 ASP CG 1 1 2 740 1 1 9 ASP H H 9.301 6.928 -4.183 1.00 . A A . 9 ASP H 1 1 2 741 1 1 9 ASP HA H 7.137 5.455 -2.924 1.00 . A A . 9 ASP HA 1 1 2 742 1 1 9 ASP HB2 H 8.610 7.424 -1.928 1.00 . A A . 9 ASP HB2 1 1 2 743 1 1 9 ASP HB3 H 7.357 8.415 -2.672 1.00 . A A . 9 ASP HB3 1 1 2 744 1 1 9 ASP N N 8.665 6.185 -4.101 1.00 . A A . 9 ASP N 1 1 2 745 1 1 9 ASP O O 5.526 7.727 -4.031 1.00 . A A . 9 ASP O 1 1 2 746 1 1 9 ASP OD1 O 6.957 6.236 -0.312 1.00 . A A . 9 ASP OD1 1 1 2 747 1 1 9 ASP OD2 O 5.709 7.939 -0.898 1.00 . A A . 9 ASP OD2 1 1 2 748 1 1 10 LEU C C 3.894 5.518 -6.001 1.00 . A A . 10 LEU C 1 1 2 749 1 1 10 LEU CA C 5.108 6.347 -6.394 1.00 . A A . 10 LEU CA 1 1 2 750 1 1 10 LEU CB C 5.560 5.983 -7.811 1.00 . A A . 10 LEU CB 1 1 2 751 1 1 10 LEU CD1 C 5.170 3.945 -9.225 1.00 . A A . 10 LEU CD1 1 1 2 752 1 1 10 LEU CD2 C 7.414 4.337 -8.186 1.00 . A A . 10 LEU CD2 1 1 2 753 1 1 10 LEU CG C 5.912 4.508 -8.020 1.00 . A A . 10 LEU CG 1 1 2 754 1 1 10 LEU H H 6.803 5.362 -5.586 1.00 . A A . 10 LEU H 1 1 2 755 1 1 10 LEU HA H 4.848 7.396 -6.357 1.00 . A A . 10 LEU HA 1 1 2 756 1 1 10 LEU HB2 H 4.766 6.244 -8.495 1.00 . A A . 10 LEU HB2 1 1 2 757 1 1 10 LEU HB3 H 6.430 6.576 -8.052 1.00 . A A . 10 LEU HB3 1 1 2 758 1 1 10 LEU HD11 H 5.568 4.380 -10.129 1.00 . A A . 10 LEU HD11 1 1 2 759 1 1 10 LEU HD12 H 5.294 2.871 -9.255 1.00 . A A . 10 LEU HD12 1 1 2 760 1 1 10 LEU HD13 H 4.122 4.184 -9.141 1.00 . A A . 10 LEU HD13 1 1 2 761 1 1 10 LEU HD21 H 7.826 5.217 -8.656 1.00 . A A . 10 LEU HD21 1 1 2 762 1 1 10 LEU HD22 H 7.869 4.199 -7.216 1.00 . A A . 10 LEU HD22 1 1 2 763 1 1 10 LEU HD23 H 7.612 3.472 -8.803 1.00 . A A . 10 LEU HD23 1 1 2 764 1 1 10 LEU HG H 5.607 3.947 -7.149 1.00 . A A . 10 LEU HG 1 1 2 765 1 1 10 LEU N N 6.186 6.111 -5.437 1.00 . A A . 10 LEU N 1 1 2 766 1 1 10 LEU O O 2.898 5.439 -6.725 1.00 . A A . 10 LEU O 1 1 2 767 1 1 11 LYS C C 2.969 4.242 -2.777 1.00 . A A . 11 LYS C 1 1 2 768 1 1 11 LYS CA C 2.983 4.052 -4.289 1.00 . A A . 11 LYS CA 1 1 2 769 1 1 11 LYS CB C 3.260 2.593 -4.678 1.00 . A A . 11 LYS CB 1 1 2 770 1 1 11 LYS CD C 4.503 0.642 -3.706 1.00 . A A . 11 LYS CD 1 1 2 771 1 1 11 LYS CE C 5.746 -0.148 -4.062 1.00 . A A . 11 LYS CE 1 1 2 772 1 1 11 LYS CG C 4.603 2.075 -4.195 1.00 . A A . 11 LYS CG 1 1 2 773 1 1 11 LYS H H 4.827 5.031 -4.320 1.00 . A A . 11 LYS H 1 1 2 774 1 1 11 LYS HA H 2.030 4.357 -4.691 1.00 . A A . 11 LYS HA 1 1 2 775 1 1 11 LYS HB2 H 2.486 1.962 -4.273 1.00 . A A . 11 LYS HB2 1 1 2 776 1 1 11 LYS HB3 H 3.241 2.516 -5.754 1.00 . A A . 11 LYS HB3 1 1 2 777 1 1 11 LYS HD2 H 4.385 0.643 -2.633 1.00 . A A . 11 LYS HD2 1 1 2 778 1 1 11 LYS HD3 H 3.645 0.173 -4.165 1.00 . A A . 11 LYS HD3 1 1 2 779 1 1 11 LYS HE2 H 5.655 -0.503 -5.078 1.00 . A A . 11 LYS HE2 1 1 2 780 1 1 11 LYS HE3 H 6.604 0.502 -3.983 1.00 . A A . 11 LYS HE3 1 1 2 781 1 1 11 LYS HG2 H 5.309 2.116 -5.012 1.00 . A A . 11 LYS HG2 1 1 2 782 1 1 11 LYS HG3 H 4.951 2.698 -3.386 1.00 . A A . 11 LYS HG3 1 1 2 783 1 1 11 LYS HZ1 H 5.358 -1.195 -2.298 1.00 . A A . 11 LYS HZ1 1 1 2 784 1 1 11 LYS HZ2 H 6.940 -1.394 -2.886 1.00 . A A . 11 LYS HZ2 1 1 2 785 1 1 11 LYS HZ3 H 5.646 -2.189 -3.641 1.00 . A A . 11 LYS HZ3 1 1 2 786 1 1 11 LYS N N 4.011 4.897 -4.843 1.00 . A A . 11 LYS N 1 1 2 787 1 1 11 LYS NZ N 5.936 -1.312 -3.160 1.00 . A A . 11 LYS NZ 1 1 2 788 1 1 11 LYS O O 3.442 5.262 -2.279 1.00 . A A . 11 LYS O 1 1 2 789 1 1 12 CYS C C 3.806 2.919 -0.029 1.00 . A A . 12 CYS C 1 1 2 790 1 1 12 CYS CA C 2.455 3.335 -0.609 1.00 . A A . 12 CYS CA 1 1 2 791 1 1 12 CYS CB C 1.361 2.420 -0.082 1.00 . A A . 12 CYS CB 1 1 2 792 1 1 12 CYS H H 2.142 2.460 -2.491 1.00 . A A . 12 CYS H 1 1 2 793 1 1 12 CYS HA H 2.239 4.353 -0.321 1.00 . A A . 12 CYS HA 1 1 2 794 1 1 12 CYS HB2 H 1.392 2.413 0.997 1.00 . A A . 12 CYS HB2 1 1 2 795 1 1 12 CYS HB3 H 0.399 2.792 -0.408 1.00 . A A . 12 CYS HB3 1 1 2 796 1 1 12 CYS N N 2.474 3.265 -2.052 1.00 . A A . 12 CYS N 1 1 2 797 1 1 12 CYS O O 4.653 2.357 -0.730 1.00 . A A . 12 CYS O 1 1 2 798 1 1 12 CYS SG S 1.516 0.704 -0.653 1.00 . A A . 12 CYS SG 1 1 2 799 1 1 13 PRO C C 5.495 1.311 2.010 1.00 . A A . 13 PRO C 1 1 2 800 1 1 13 PRO CA C 5.261 2.824 1.971 1.00 . A A . 13 PRO CA 1 1 2 801 1 1 13 PRO CB C 5.007 3.339 3.391 1.00 . A A . 13 PRO CB 1 1 2 802 1 1 13 PRO CD C 3.108 3.939 2.135 1.00 . A A . 13 PRO CD 1 1 2 803 1 1 13 PRO CG C 4.005 4.417 3.229 1.00 . A A . 13 PRO CG 1 1 2 804 1 1 13 PRO HA H 6.126 3.317 1.551 1.00 . A A . 13 PRO HA 1 1 2 805 1 1 13 PRO HB2 H 4.625 2.536 4.004 1.00 . A A . 13 PRO HB2 1 1 2 806 1 1 13 PRO HB3 H 5.917 3.710 3.809 1.00 . A A . 13 PRO HB3 1 1 2 807 1 1 13 PRO HD2 H 2.337 3.295 2.531 1.00 . A A . 13 PRO HD2 1 1 2 808 1 1 13 PRO HD3 H 2.671 4.776 1.609 1.00 . A A . 13 PRO HD3 1 1 2 809 1 1 13 PRO HG2 H 3.450 4.547 4.147 1.00 . A A . 13 PRO HG2 1 1 2 810 1 1 13 PRO HG3 H 4.493 5.338 2.943 1.00 . A A . 13 PRO HG3 1 1 2 811 1 1 13 PRO N N 4.027 3.192 1.265 1.00 . A A . 13 PRO N 1 1 2 812 1 1 13 PRO O O 6.560 0.842 2.419 1.00 . A A . 13 PRO O 1 1 2 813 1 1 14 THR C C 5.124 -1.528 0.527 1.00 . A A . 14 THR C 1 1 2 814 1 1 14 THR CA C 4.478 -0.893 1.766 1.00 . A A . 14 THR CA 1 1 2 815 1 1 14 THR CB C 3.048 -1.437 1.938 1.00 . A A . 14 THR CB 1 1 2 816 1 1 14 THR CG2 C 3.054 -2.861 2.478 1.00 . A A . 14 THR CG2 1 1 2 817 1 1 14 THR H H 3.616 1.009 1.446 1.00 . A A . 14 THR H 1 1 2 818 1 1 14 THR HA H 5.049 -1.170 2.637 1.00 . A A . 14 THR HA 1 1 2 819 1 1 14 THR HB H 2.560 -1.437 0.972 1.00 . A A . 14 THR HB 1 1 2 820 1 1 14 THR HG1 H 1.461 -0.360 2.426 1.00 . A A . 14 THR HG1 1 1 2 821 1 1 14 THR HG21 H 2.121 -3.056 2.991 1.00 . A A . 14 THR HG21 1 1 2 822 1 1 14 THR HG22 H 3.875 -2.982 3.168 1.00 . A A . 14 THR HG22 1 1 2 823 1 1 14 THR HG23 H 3.164 -3.556 1.659 1.00 . A A . 14 THR HG23 1 1 2 824 1 1 14 THR N N 4.453 0.563 1.690 1.00 . A A . 14 THR N 1 1 2 825 1 1 14 THR O O 4.727 -1.263 -0.605 1.00 . A A . 14 THR O 1 1 2 826 1 1 14 THR OG1 O 2.314 -0.588 2.832 1.00 . A A . 14 THR OG1 1 1 2 827 1 1 15 PRO C C 6.183 -4.136 -0.991 1.00 . A A . 15 PRO C 1 1 2 828 1 1 15 PRO CA C 6.936 -2.963 -0.361 1.00 . A A . 15 PRO CA 1 1 2 829 1 1 15 PRO CB C 8.214 -3.467 0.323 1.00 . A A . 15 PRO CB 1 1 2 830 1 1 15 PRO CD C 6.832 -2.563 2.021 1.00 . A A . 15 PRO CD 1 1 2 831 1 1 15 PRO CG C 8.261 -2.746 1.618 1.00 . A A . 15 PRO CG 1 1 2 832 1 1 15 PRO HA H 7.196 -2.249 -1.126 1.00 . A A . 15 PRO HA 1 1 2 833 1 1 15 PRO HB2 H 8.149 -4.535 0.467 1.00 . A A . 15 PRO HB2 1 1 2 834 1 1 15 PRO HB3 H 9.069 -3.234 -0.289 1.00 . A A . 15 PRO HB3 1 1 2 835 1 1 15 PRO HD2 H 6.450 -3.457 2.493 1.00 . A A . 15 PRO HD2 1 1 2 836 1 1 15 PRO HD3 H 6.722 -1.709 2.673 1.00 . A A . 15 PRO HD3 1 1 2 837 1 1 15 PRO HG2 H 8.793 -3.333 2.349 1.00 . A A . 15 PRO HG2 1 1 2 838 1 1 15 PRO HG3 H 8.737 -1.785 1.482 1.00 . A A . 15 PRO HG3 1 1 2 839 1 1 15 PRO N N 6.187 -2.326 0.731 1.00 . A A . 15 PRO N 1 1 2 840 1 1 15 PRO O O 6.280 -4.373 -2.197 1.00 . A A . 15 PRO O 1 1 2 841 1 1 16 GLY C C 3.445 -5.665 -1.356 1.00 . A A . 16 GLY C 1 1 2 842 1 1 16 GLY CA C 4.735 -6.047 -0.662 1.00 . A A . 16 GLY CA 1 1 2 843 1 1 16 GLY H H 5.432 -4.674 0.788 1.00 . A A . 16 GLY H 1 1 2 844 1 1 16 GLY HA2 H 5.366 -6.574 -1.358 1.00 . A A . 16 GLY HA2 1 1 2 845 1 1 16 GLY HA3 H 4.509 -6.700 0.169 1.00 . A A . 16 GLY HA3 1 1 2 846 1 1 16 GLY N N 5.454 -4.888 -0.167 1.00 . A A . 16 GLY N 1 1 2 847 1 1 16 GLY O O 2.867 -6.453 -2.103 1.00 . A A . 16 GLY O 1 1 2 848 1 1 17 CYS C C 2.231 -2.971 -2.898 1.00 . A A . 17 CYS C 1 1 2 849 1 1 17 CYS CA C 1.832 -3.894 -1.743 1.00 . A A . 17 CYS CA 1 1 2 850 1 1 17 CYS CB C 1.061 -3.161 -0.652 1.00 . A A . 17 CYS CB 1 1 2 851 1 1 17 CYS H H 3.542 -3.863 -0.536 1.00 . A A . 17 CYS H 1 1 2 852 1 1 17 CYS HA H 1.237 -4.711 -2.123 1.00 . A A . 17 CYS HA 1 1 2 853 1 1 17 CYS HB2 H 0.822 -3.866 0.125 1.00 . A A . 17 CYS HB2 1 1 2 854 1 1 17 CYS HB3 H 1.705 -2.398 -0.234 1.00 . A A . 17 CYS HB3 1 1 2 855 1 1 17 CYS N N 3.022 -4.437 -1.130 1.00 . A A . 17 CYS N 1 1 2 856 1 1 17 CYS O O 3.380 -2.529 -2.969 1.00 . A A . 17 CYS O 1 1 2 857 1 1 17 CYS SG S -0.487 -2.348 -1.144 1.00 . A A . 17 CYS SG 1 1 2 858 1 1 18 ASP C C 1.187 -0.645 -5.053 1.00 . A A . 18 ASP C 1 1 2 859 1 1 18 ASP CA C 1.708 -2.078 -5.094 1.00 . A A . 18 ASP CA 1 1 2 860 1 1 18 ASP CB C 1.180 -2.795 -6.342 1.00 . A A . 18 ASP CB 1 1 2 861 1 1 18 ASP CG C -0.196 -2.318 -6.772 1.00 . A A . 18 ASP CG 1 1 2 862 1 1 18 ASP H H 0.492 -3.278 -3.836 1.00 . A A . 18 ASP H 1 1 2 863 1 1 18 ASP HA H 2.787 -2.047 -5.145 1.00 . A A . 18 ASP HA 1 1 2 864 1 1 18 ASP HB2 H 1.865 -2.625 -7.157 1.00 . A A . 18 ASP HB2 1 1 2 865 1 1 18 ASP HB3 H 1.126 -3.854 -6.140 1.00 . A A . 18 ASP HB3 1 1 2 866 1 1 18 ASP N N 1.352 -2.813 -3.880 1.00 . A A . 18 ASP N 1 1 2 867 1 1 18 ASP O O 1.565 0.183 -5.882 1.00 . A A . 18 ASP O 1 1 2 868 1 1 18 ASP OD1 O -1.153 -2.432 -5.981 1.00 . A A . 18 ASP OD1 1 1 2 869 1 1 18 ASP OD2 O -0.325 -1.830 -7.916 1.00 . A A . 18 ASP OD2 1 1 2 870 1 1 19 GLY C C -1.558 1.182 -4.463 1.00 . A A . 19 GLY C 1 1 2 871 1 1 19 GLY CA C -0.158 1.002 -3.907 1.00 . A A . 19 GLY CA 1 1 2 872 1 1 19 GLY H H 0.113 -1.044 -3.418 1.00 . A A . 19 GLY H 1 1 2 873 1 1 19 GLY HA2 H -0.170 1.246 -2.854 1.00 . A A . 19 GLY HA2 1 1 2 874 1 1 19 GLY HA3 H 0.508 1.685 -4.414 1.00 . A A . 19 GLY HA3 1 1 2 875 1 1 19 GLY N N 0.350 -0.349 -4.069 1.00 . A A . 19 GLY N 1 1 2 876 1 1 19 GLY O O -2.239 2.161 -4.152 1.00 . A A . 19 GLY O 1 1 2 877 1 1 20 SER C C -4.319 -0.535 -5.012 1.00 . A A . 20 SER C 1 1 2 878 1 1 20 SER CA C -3.342 0.297 -5.838 1.00 . A A . 20 SER CA 1 1 2 879 1 1 20 SER CB C -3.320 -0.184 -7.290 1.00 . A A . 20 SER CB 1 1 2 880 1 1 20 SER H H -1.434 -0.540 -5.474 1.00 . A A . 20 SER H 1 1 2 881 1 1 20 SER HA H -3.661 1.329 -5.816 1.00 . A A . 20 SER HA 1 1 2 882 1 1 20 SER HB2 H -3.463 -1.253 -7.317 1.00 . A A . 20 SER HB2 1 1 2 883 1 1 20 SER HB3 H -4.114 0.299 -7.839 1.00 . A A . 20 SER HB3 1 1 2 884 1 1 20 SER HG H -1.501 -0.654 -7.881 1.00 . A A . 20 SER HG 1 1 2 885 1 1 20 SER N N -2.007 0.233 -5.267 1.00 . A A . 20 SER N 1 1 2 886 1 1 20 SER O O -3.952 -1.574 -4.452 1.00 . A A . 20 SER O 1 1 2 887 1 1 20 SER OG O -2.080 0.128 -7.909 1.00 . A A . 20 SER OG 1 1 2 888 1 1 21 GLY C C -6.629 -0.261 -2.711 1.00 . A A . 21 GLY C 1 1 2 889 1 1 21 GLY CA C -6.566 -0.740 -4.140 1.00 . A A . 21 GLY CA 1 1 2 890 1 1 21 GLY H H -5.759 0.813 -5.328 1.00 . A A . 21 GLY H 1 1 2 891 1 1 21 GLY HA2 H -7.526 -0.576 -4.609 1.00 . A A . 21 GLY HA2 1 1 2 892 1 1 21 GLY HA3 H -6.348 -1.798 -4.145 1.00 . A A . 21 GLY HA3 1 1 2 893 1 1 21 GLY N N -5.547 -0.047 -4.901 1.00 . A A . 21 GLY N 1 1 2 894 1 1 21 GLY O O -5.936 0.677 -2.347 1.00 . A A . 21 GLY O 1 1 2 895 1 1 22 HIS C C -8.084 -1.855 0.249 1.00 . A A . 22 HIS C 1 1 2 896 1 1 22 HIS CA C -7.562 -0.627 -0.474 1.00 . A A . 22 HIS CA 1 1 2 897 1 1 22 HIS CB C -8.517 0.547 -0.201 1.00 . A A . 22 HIS CB 1 1 2 898 1 1 22 HIS CD2 C -7.342 2.744 -0.967 1.00 . A A . 22 HIS CD2 1 1 2 899 1 1 22 HIS CE1 C -7.237 3.734 0.979 1.00 . A A . 22 HIS CE1 1 1 2 900 1 1 22 HIS CG C -7.871 1.895 -0.055 1.00 . A A . 22 HIS CG 1 1 2 901 1 1 22 HIS H H -7.962 -1.673 -2.274 1.00 . A A . 22 HIS H 1 1 2 902 1 1 22 HIS HA H -6.580 -0.384 -0.097 1.00 . A A . 22 HIS HA 1 1 2 903 1 1 22 HIS HB2 H -9.221 0.615 -1.018 1.00 . A A . 22 HIS HB2 1 1 2 904 1 1 22 HIS HB3 H -9.062 0.343 0.709 1.00 . A A . 22 HIS HB3 1 1 2 905 1 1 22 HIS HD1 H -8.097 2.200 2.021 1.00 . A A . 22 HIS HD1 1 1 2 906 1 1 22 HIS HD2 H -7.244 2.560 -2.028 1.00 . A A . 22 HIS HD2 1 1 2 907 1 1 22 HIS HE1 H -7.044 4.459 1.754 1.00 . A A . 22 HIS HE1 1 1 2 908 1 1 22 HIS HE2 H -6.771 4.754 -0.731 1.00 . A A . 22 HIS HE2 1 1 2 909 1 1 22 HIS N N -7.441 -0.921 -1.903 1.00 . A A . 22 HIS N 1 1 2 910 1 1 22 HIS ND1 N -7.785 2.548 1.155 1.00 . A A . 22 HIS ND1 1 1 2 911 1 1 22 HIS NE2 N -6.958 3.882 -0.300 1.00 . A A . 22 HIS NE2 1 1 2 912 1 1 22 HIS O O -8.886 -2.603 -0.306 1.00 . A A . 22 HIS O 1 1 2 913 1 1 23 ILE C C -9.711 -2.890 2.604 1.00 . A A . 23 ILE C 1 1 2 914 1 1 23 ILE CA C -8.221 -3.108 2.320 1.00 . A A . 23 ILE CA 1 1 2 915 1 1 23 ILE CB C -7.409 -3.262 3.635 1.00 . A A . 23 ILE CB 1 1 2 916 1 1 23 ILE CD1 C -8.106 -5.594 4.433 1.00 . A A . 23 ILE CD1 1 1 2 917 1 1 23 ILE CG1 C -7.012 -4.729 3.841 1.00 . A A . 23 ILE CG1 1 1 2 918 1 1 23 ILE CG2 C -8.164 -2.724 4.845 1.00 . A A . 23 ILE CG2 1 1 2 919 1 1 23 ILE H H -7.108 -1.356 1.920 1.00 . A A . 23 ILE H 1 1 2 920 1 1 23 ILE HA H -8.111 -4.018 1.748 1.00 . A A . 23 ILE HA 1 1 2 921 1 1 23 ILE HB H -6.508 -2.676 3.531 1.00 . A A . 23 ILE HB 1 1 2 922 1 1 23 ILE HD11 H -7.906 -6.630 4.205 1.00 . A A . 23 ILE HD11 1 1 2 923 1 1 23 ILE HD12 H -8.131 -5.460 5.505 1.00 . A A . 23 ILE HD12 1 1 2 924 1 1 23 ILE HD13 H -9.057 -5.309 4.012 1.00 . A A . 23 ILE HD13 1 1 2 925 1 1 23 ILE HG12 H -6.738 -5.155 2.888 1.00 . A A . 23 ILE HG12 1 1 2 926 1 1 23 ILE HG13 H -6.161 -4.772 4.505 1.00 . A A . 23 ILE HG13 1 1 2 927 1 1 23 ILE HG21 H -9.228 -2.790 4.665 1.00 . A A . 23 ILE HG21 1 1 2 928 1 1 23 ILE HG22 H -7.910 -3.310 5.716 1.00 . A A . 23 ILE HG22 1 1 2 929 1 1 23 ILE HG23 H -7.891 -1.693 5.011 1.00 . A A . 23 ILE HG23 1 1 2 930 1 1 23 ILE N N -7.707 -2.014 1.509 1.00 . A A . 23 ILE N 1 1 2 931 1 1 23 ILE O O -10.467 -3.841 2.818 1.00 . A A . 23 ILE O 1 1 2 932 1 1 24 THR C C -12.338 -1.499 1.401 1.00 . A A . 24 THR C 1 1 2 933 1 1 24 THR CA C -11.532 -1.267 2.684 1.00 . A A . 24 THR CA 1 1 2 934 1 1 24 THR CB C -11.667 0.209 3.130 1.00 . A A . 24 THR CB 1 1 2 935 1 1 24 THR CG2 C -11.398 1.164 1.978 1.00 . A A . 24 THR CG2 1 1 2 936 1 1 24 THR H H -9.484 -0.931 2.288 1.00 . A A . 24 THR H 1 1 2 937 1 1 24 THR HA H -11.938 -1.888 3.465 1.00 . A A . 24 THR HA 1 1 2 938 1 1 24 THR HB H -10.939 0.399 3.908 1.00 . A A . 24 THR HB 1 1 2 939 1 1 24 THR HG1 H -12.900 0.812 4.553 1.00 . A A . 24 THR HG1 1 1 2 940 1 1 24 THR HG21 H -12.337 1.513 1.574 1.00 . A A . 24 THR HG21 1 1 2 941 1 1 24 THR HG22 H -10.844 0.651 1.208 1.00 . A A . 24 THR HG22 1 1 2 942 1 1 24 THR HG23 H -10.822 2.006 2.335 1.00 . A A . 24 THR HG23 1 1 2 943 1 1 24 THR N N -10.135 -1.632 2.504 1.00 . A A . 24 THR N 1 1 2 944 1 1 24 THR O O -13.553 -1.679 1.446 1.00 . A A . 24 THR O 1 1 2 945 1 1 24 THR OG1 O -12.977 0.452 3.653 1.00 . A A . 24 THR OG1 1 1 2 946 1 1 25 GLY C C -13.206 -0.659 -1.458 1.00 . A A . 25 GLY C 1 1 2 947 1 1 25 GLY CA C -12.309 -1.801 -1.006 1.00 . A A . 25 GLY CA 1 1 2 948 1 1 25 GLY H H -10.672 -1.460 0.294 1.00 . A A . 25 GLY H 1 1 2 949 1 1 25 GLY HA2 H -11.556 -1.969 -1.762 1.00 . A A . 25 GLY HA2 1 1 2 950 1 1 25 GLY HA3 H -12.908 -2.695 -0.909 1.00 . A A . 25 GLY HA3 1 1 2 951 1 1 25 GLY N N -11.647 -1.542 0.264 1.00 . A A . 25 GLY N 1 1 2 952 1 1 25 GLY O O -14.159 -0.872 -2.204 1.00 . A A . 25 GLY O 1 1 2 953 1 1 26 ASN C C -13.125 2.726 -2.051 1.00 . A A . 26 ASN C 1 1 2 954 1 1 26 ASN CA C -13.828 1.677 -1.191 1.00 . A A . 26 ASN CA 1 1 2 955 1 1 26 ASN CB C -14.274 2.319 0.124 1.00 . A A . 26 ASN CB 1 1 2 956 1 1 26 ASN CG C -15.455 1.608 0.746 1.00 . A A . 26 ASN CG 1 1 2 957 1 1 26 ASN H H -12.283 0.606 -0.228 1.00 . A A . 26 ASN H 1 1 2 958 1 1 26 ASN HA H -14.699 1.320 -1.719 1.00 . A A . 26 ASN HA 1 1 2 959 1 1 26 ASN HB2 H -13.455 2.289 0.827 1.00 . A A . 26 ASN HB2 1 1 2 960 1 1 26 ASN HB3 H -14.549 3.349 -0.058 1.00 . A A . 26 ASN HB3 1 1 2 961 1 1 26 ASN HD21 H -14.294 0.910 2.206 1.00 . A A . 26 ASN HD21 1 1 2 962 1 1 26 ASN HD22 H -15.950 0.435 2.261 1.00 . A A . 26 ASN HD22 1 1 2 963 1 1 26 ASN N N -12.970 0.530 -0.917 1.00 . A A . 26 ASN N 1 1 2 964 1 1 26 ASN ND2 N -15.212 0.918 1.849 1.00 . A A . 26 ASN ND2 1 1 2 965 1 1 26 ASN O O -13.661 3.811 -2.269 1.00 . A A . 26 ASN O 1 1 2 966 1 1 26 ASN OD1 O -16.577 1.684 0.247 1.00 . A A . 26 ASN OD1 1 1 2 967 1 1 27 TYR C C -10.445 2.813 -4.422 1.00 . A A . 27 TYR C 1 1 2 968 1 1 27 TYR CA C -11.102 3.436 -3.191 1.00 . A A . 27 TYR CA 1 1 2 969 1 1 27 TYR CB C -10.029 4.022 -2.279 1.00 . A A . 27 TYR CB 1 1 2 970 1 1 27 TYR CD1 C -10.946 4.214 0.069 1.00 . A A . 27 TYR CD1 1 1 2 971 1 1 27 TYR CD2 C -10.710 6.208 -1.216 1.00 . A A . 27 TYR CD2 1 1 2 972 1 1 27 TYR CE1 C -11.440 4.949 1.127 1.00 . A A . 27 TYR CE1 1 1 2 973 1 1 27 TYR CE2 C -11.202 6.951 -0.159 1.00 . A A . 27 TYR CE2 1 1 2 974 1 1 27 TYR CG C -10.572 4.830 -1.120 1.00 . A A . 27 TYR CG 1 1 2 975 1 1 27 TYR CZ C -11.568 6.317 1.008 1.00 . A A . 27 TYR CZ 1 1 2 976 1 1 27 TYR H H -11.475 1.602 -2.210 1.00 . A A . 27 TYR H 1 1 2 977 1 1 27 TYR HA H -11.765 4.228 -3.508 1.00 . A A . 27 TYR HA 1 1 2 978 1 1 27 TYR HB2 H -9.439 3.216 -1.870 1.00 . A A . 27 TYR HB2 1 1 2 979 1 1 27 TYR HB3 H -9.395 4.660 -2.860 1.00 . A A . 27 TYR HB3 1 1 2 980 1 1 27 TYR HD1 H -10.847 3.139 0.162 1.00 . A A . 27 TYR HD1 1 1 2 981 1 1 27 TYR HD2 H -10.425 6.702 -2.133 1.00 . A A . 27 TYR HD2 1 1 2 982 1 1 27 TYR HE1 H -11.726 4.451 2.041 1.00 . A A . 27 TYR HE1 1 1 2 983 1 1 27 TYR HE2 H -11.301 8.022 -0.253 1.00 . A A . 27 TYR HE2 1 1 2 984 1 1 27 TYR HH H -12.340 7.918 1.750 1.00 . A A . 27 TYR HH 1 1 2 985 1 1 27 TYR N N -11.889 2.455 -2.455 1.00 . A A . 27 TYR N 1 1 2 986 1 1 27 TYR O O -10.690 1.651 -4.749 1.00 . A A . 27 TYR O 1 1 2 987 1 1 27 TYR OH O -12.059 7.051 2.065 1.00 . A A . 27 TYR OH 1 1 2 988 1 1 28 ALA C C -7.412 2.843 -5.957 1.00 . A A . 28 ALA C 1 1 2 989 1 1 28 ALA CA C -8.883 3.114 -6.267 1.00 . A A . 28 ALA CA 1 1 2 990 1 1 28 ALA CB C -9.008 4.124 -7.398 1.00 . A A . 28 ALA CB 1 1 2 991 1 1 28 ALA H H -9.428 4.505 -4.766 1.00 . A A . 28 ALA H 1 1 2 992 1 1 28 ALA HA H -9.347 2.192 -6.585 1.00 . A A . 28 ALA HA 1 1 2 993 1 1 28 ALA HB1 H -8.952 3.612 -8.347 1.00 . A A . 28 ALA HB1 1 1 2 994 1 1 28 ALA HB2 H -9.957 4.635 -7.320 1.00 . A A . 28 ALA HB2 1 1 2 995 1 1 28 ALA HB3 H -8.206 4.845 -7.328 1.00 . A A . 28 ALA HB3 1 1 2 996 1 1 28 ALA N N -9.589 3.586 -5.082 1.00 . A A . 28 ALA N 1 1 2 997 1 1 28 ALA O O -6.861 1.821 -6.369 1.00 . A A . 28 ALA O 1 1 2 998 1 1 29 SER C C -5.084 4.355 -3.545 1.00 . A A . 29 SER C 1 1 2 999 1 1 29 SER CA C -5.382 3.597 -4.835 1.00 . A A . 29 SER CA 1 1 2 1000 1 1 29 SER CB C -4.474 4.103 -5.961 1.00 . A A . 29 SER CB 1 1 2 1001 1 1 29 SER H H -7.283 4.532 -4.887 1.00 . A A . 29 SER H 1 1 2 1002 1 1 29 SER HA H -5.192 2.546 -4.675 1.00 . A A . 29 SER HA 1 1 2 1003 1 1 29 SER HB2 H -3.700 4.728 -5.543 1.00 . A A . 29 SER HB2 1 1 2 1004 1 1 29 SER HB3 H -4.022 3.259 -6.463 1.00 . A A . 29 SER HB3 1 1 2 1005 1 1 29 SER HG H -5.407 4.298 -7.683 1.00 . A A . 29 SER HG 1 1 2 1006 1 1 29 SER N N -6.786 3.746 -5.208 1.00 . A A . 29 SER N 1 1 2 1007 1 1 29 SER O O -5.961 5.027 -3.001 1.00 . A A . 29 SER O 1 1 2 1008 1 1 29 SER OG O -5.207 4.862 -6.912 1.00 . A A . 29 SER OG 1 1 2 1009 1 1 30 HIS C C -1.958 5.186 -1.828 1.00 . A A . 30 HIS C 1 1 2 1010 1 1 30 HIS CA C -3.451 4.852 -1.798 1.00 . A A . 30 HIS CA 1 1 2 1011 1 1 30 HIS CB C -3.758 3.950 -0.600 1.00 . A A . 30 HIS CB 1 1 2 1012 1 1 30 HIS CD2 C -2.022 2.092 -0.157 1.00 . A A . 30 HIS CD2 1 1 2 1013 1 1 30 HIS CE1 C -2.879 0.501 -1.349 1.00 . A A . 30 HIS CE1 1 1 2 1014 1 1 30 HIS CG C -3.155 2.585 -0.704 1.00 . A A . 30 HIS CG 1 1 2 1015 1 1 30 HIS H H -3.224 3.613 -3.498 1.00 . A A . 30 HIS H 1 1 2 1016 1 1 30 HIS HA H -4.012 5.771 -1.700 1.00 . A A . 30 HIS HA 1 1 2 1017 1 1 30 HIS HB2 H -3.375 4.412 0.293 1.00 . A A . 30 HIS HB2 1 1 2 1018 1 1 30 HIS HB3 H -4.828 3.835 -0.509 1.00 . A A . 30 HIS HB3 1 1 2 1019 1 1 30 HIS HD1 H -4.533 1.589 -1.965 1.00 . A A . 30 HIS HD1 1 1 2 1020 1 1 30 HIS HD2 H -1.347 2.617 0.504 1.00 . A A . 30 HIS HD2 1 1 2 1021 1 1 30 HIS HE1 H -3.035 -0.450 -1.834 1.00 . A A . 30 HIS HE1 1 1 2 1022 1 1 30 HIS N N -3.865 4.202 -3.038 1.00 . A A . 30 HIS N 1 1 2 1023 1 1 30 HIS ND1 N -3.691 1.559 -1.458 1.00 . A A . 30 HIS ND1 1 1 2 1024 1 1 30 HIS NE2 N -1.869 0.787 -0.575 1.00 . A A . 30 HIS NE2 1 1 2 1025 1 1 30 HIS O O -1.244 4.787 -2.750 1.00 . A A . 30 HIS O 1 1 2 1026 1 1 31 ARG C C 0.447 6.099 0.690 1.00 . A A . 31 ARG C 1 1 2 1027 1 1 31 ARG CA C -0.092 6.317 -0.726 1.00 . A A . 31 ARG CA 1 1 2 1028 1 1 31 ARG CB C 0.085 7.794 -1.105 1.00 . A A . 31 ARG CB 1 1 2 1029 1 1 31 ARG CD C 0.739 7.766 -3.533 1.00 . A A . 31 ARG CD 1 1 2 1030 1 1 31 ARG CG C -0.337 8.130 -2.526 1.00 . A A . 31 ARG CG 1 1 2 1031 1 1 31 ARG CZ C -0.405 7.253 -5.664 1.00 . A A . 31 ARG CZ 1 1 2 1032 1 1 31 ARG H H -2.124 6.223 -0.123 1.00 . A A . 31 ARG H 1 1 2 1033 1 1 31 ARG HA H 0.474 5.706 -1.415 1.00 . A A . 31 ARG HA 1 1 2 1034 1 1 31 ARG HB2 H -0.501 8.397 -0.428 1.00 . A A . 31 ARG HB2 1 1 2 1035 1 1 31 ARG HB3 H 1.126 8.057 -0.993 1.00 . A A . 31 ARG HB3 1 1 2 1036 1 1 31 ARG HD2 H 1.094 8.669 -4.006 1.00 . A A . 31 ARG HD2 1 1 2 1037 1 1 31 ARG HD3 H 1.556 7.287 -3.012 1.00 . A A . 31 ARG HD3 1 1 2 1038 1 1 31 ARG HE H 0.355 5.895 -4.403 1.00 . A A . 31 ARG HE 1 1 2 1039 1 1 31 ARG HG2 H -1.236 7.581 -2.764 1.00 . A A . 31 ARG HG2 1 1 2 1040 1 1 31 ARG HG3 H -0.532 9.191 -2.591 1.00 . A A . 31 ARG HG3 1 1 2 1041 1 1 31 ARG HH11 H -0.205 9.248 -5.297 1.00 . A A . 31 ARG HH11 1 1 2 1042 1 1 31 ARG HH12 H -1.046 8.838 -6.767 1.00 . A A . 31 ARG HH12 1 1 2 1043 1 1 31 ARG HH21 H -0.716 5.362 -6.322 1.00 . A A . 31 ARG HH21 1 1 2 1044 1 1 31 ARG HH22 H -1.359 6.619 -7.342 1.00 . A A . 31 ARG HH22 1 1 2 1045 1 1 31 ARG N N -1.496 5.923 -0.818 1.00 . A A . 31 ARG N 1 1 2 1046 1 1 31 ARG NE N 0.232 6.859 -4.560 1.00 . A A . 31 ARG NE 1 1 2 1047 1 1 31 ARG NH1 N -0.566 8.548 -5.930 1.00 . A A . 31 ARG NH1 1 1 2 1048 1 1 31 ARG NH2 N -0.860 6.343 -6.513 1.00 . A A . 31 ARG NH2 1 1 2 1049 1 1 31 ARG O O 1.530 6.574 1.029 1.00 . A A . 31 ARG O 1 1 2 1050 1 1 32 SER C C -0.100 3.731 3.307 1.00 . A A . 32 SER C 1 1 2 1051 1 1 32 SER CA C 0.064 5.200 2.922 1.00 . A A . 32 SER CA 1 1 2 1052 1 1 32 SER CB C -0.769 6.083 3.848 1.00 . A A . 32 SER CB 1 1 2 1053 1 1 32 SER H H -1.192 5.083 1.223 1.00 . A A . 32 SER H 1 1 2 1054 1 1 32 SER HA H 1.104 5.473 3.018 1.00 . A A . 32 SER HA 1 1 2 1055 1 1 32 SER HB2 H -1.570 5.498 4.274 1.00 . A A . 32 SER HB2 1 1 2 1056 1 1 32 SER HB3 H -0.139 6.464 4.636 1.00 . A A . 32 SER HB3 1 1 2 1057 1 1 32 SER HG H -0.898 7.253 2.279 1.00 . A A . 32 SER HG 1 1 2 1058 1 1 32 SER N N -0.331 5.427 1.534 1.00 . A A . 32 SER N 1 1 2 1059 1 1 32 SER O O -0.660 2.944 2.547 1.00 . A A . 32 SER O 1 1 2 1060 1 1 32 SER OG O -1.327 7.179 3.139 1.00 . A A . 32 SER OG 1 1 2 1061 1 1 33 LEU C C -0.991 1.587 5.479 1.00 . A A . 33 LEU C 1 1 2 1062 1 1 33 LEU CA C 0.386 1.971 4.935 1.00 . A A . 33 LEU CA 1 1 2 1063 1 1 33 LEU CB C 1.423 1.746 6.042 1.00 . A A . 33 LEU CB 1 1 2 1064 1 1 33 LEU CD1 C 3.584 2.798 6.737 1.00 . A A . 33 LEU CD1 1 1 2 1065 1 1 33 LEU CD2 C 3.598 0.679 5.419 1.00 . A A . 33 LEU CD2 1 1 2 1066 1 1 33 LEU CG C 2.881 1.995 5.655 1.00 . A A . 33 LEU CG 1 1 2 1067 1 1 33 LEU H H 0.925 4.023 5.010 1.00 . A A . 33 LEU H 1 1 2 1068 1 1 33 LEU HA H 0.624 1.338 4.097 1.00 . A A . 33 LEU HA 1 1 2 1069 1 1 33 LEU HB2 H 1.178 2.398 6.868 1.00 . A A . 33 LEU HB2 1 1 2 1070 1 1 33 LEU HB3 H 1.336 0.724 6.381 1.00 . A A . 33 LEU HB3 1 1 2 1071 1 1 33 LEU HD11 H 4.206 2.140 7.329 1.00 . A A . 33 LEU HD11 1 1 2 1072 1 1 33 LEU HD12 H 4.200 3.559 6.282 1.00 . A A . 33 LEU HD12 1 1 2 1073 1 1 33 LEU HD13 H 2.847 3.266 7.375 1.00 . A A . 33 LEU HD13 1 1 2 1074 1 1 33 LEU HD21 H 2.889 -0.057 5.065 1.00 . A A . 33 LEU HD21 1 1 2 1075 1 1 33 LEU HD22 H 4.372 0.818 4.678 1.00 . A A . 33 LEU HD22 1 1 2 1076 1 1 33 LEU HD23 H 4.039 0.338 6.344 1.00 . A A . 33 LEU HD23 1 1 2 1077 1 1 33 LEU HG H 2.913 2.565 4.739 1.00 . A A . 33 LEU HG 1 1 2 1078 1 1 33 LEU N N 0.423 3.360 4.477 1.00 . A A . 33 LEU N 1 1 2 1079 1 1 33 LEU O O -1.174 0.476 5.989 1.00 . A A . 33 LEU O 1 1 2 1080 1 1 34 SER C C -4.162 1.533 5.074 1.00 . A A . 34 SER C 1 1 2 1081 1 1 34 SER CA C -3.246 2.309 6.021 1.00 . A A . 34 SER CA 1 1 2 1082 1 1 34 SER CB C -3.878 3.655 6.367 1.00 . A A . 34 SER CB 1 1 2 1083 1 1 34 SER H H -1.701 3.410 5.096 1.00 . A A . 34 SER H 1 1 2 1084 1 1 34 SER HA H -3.124 1.740 6.930 1.00 . A A . 34 SER HA 1 1 2 1085 1 1 34 SER HB2 H -4.686 3.858 5.677 1.00 . A A . 34 SER HB2 1 1 2 1086 1 1 34 SER HB3 H -4.266 3.621 7.374 1.00 . A A . 34 SER HB3 1 1 2 1087 1 1 34 SER HG H -3.384 5.554 6.338 1.00 . A A . 34 SER HG 1 1 2 1088 1 1 34 SER N N -1.926 2.524 5.449 1.00 . A A . 34 SER N 1 1 2 1089 1 1 34 SER O O -4.787 0.548 5.471 1.00 . A A . 34 SER O 1 1 2 1090 1 1 34 SER OG O -2.924 4.703 6.278 1.00 . A A . 34 SER OG 1 1 2 1091 1 1 35 GLY C C -4.639 0.318 2.068 1.00 . A A . 35 GLY C 1 1 2 1092 1 1 35 GLY CA C -5.235 1.429 2.910 1.00 . A A . 35 GLY CA 1 1 2 1093 1 1 35 GLY H H -3.803 2.835 3.596 1.00 . A A . 35 GLY H 1 1 2 1094 1 1 35 GLY HA2 H -6.072 1.029 3.463 1.00 . A A . 35 GLY HA2 1 1 2 1095 1 1 35 GLY HA3 H -5.598 2.204 2.251 1.00 . A A . 35 GLY HA3 1 1 2 1096 1 1 35 GLY N N -4.295 2.020 3.847 1.00 . A A . 35 GLY N 1 1 2 1097 1 1 35 GLY O O -5.061 0.108 0.933 1.00 . A A . 35 GLY O 1 1 2 1098 1 1 36 CYS C C -3.939 -2.765 1.926 1.00 . A A . 36 CYS C 1 1 2 1099 1 1 36 CYS CA C -3.057 -1.520 1.932 1.00 . A A . 36 CYS CA 1 1 2 1100 1 1 36 CYS CB C -1.718 -1.848 2.592 1.00 . A A . 36 CYS CB 1 1 2 1101 1 1 36 CYS H H -3.425 -0.222 3.554 1.00 . A A . 36 CYS H 1 1 2 1102 1 1 36 CYS HA H -2.879 -1.211 0.913 1.00 . A A . 36 CYS HA 1 1 2 1103 1 1 36 CYS HB2 H -1.851 -1.882 3.664 1.00 . A A . 36 CYS HB2 1 1 2 1104 1 1 36 CYS HB3 H -1.377 -2.814 2.244 1.00 . A A . 36 CYS HB3 1 1 2 1105 1 1 36 CYS N N -3.692 -0.416 2.632 1.00 . A A . 36 CYS N 1 1 2 1106 1 1 36 CYS O O -4.151 -3.384 2.967 1.00 . A A . 36 CYS O 1 1 2 1107 1 1 36 CYS SG S -0.410 -0.638 2.237 1.00 . A A . 36 CYS SG 1 1 2 1108 1 1 37 PRO C C -4.200 -5.656 0.817 1.00 . A A . 37 PRO C 1 1 2 1109 1 1 37 PRO CA C -5.118 -4.459 0.593 1.00 . A A . 37 PRO CA 1 1 2 1110 1 1 37 PRO CB C -5.621 -4.419 -0.848 1.00 . A A . 37 PRO CB 1 1 2 1111 1 1 37 PRO CD C -4.132 -2.555 -0.562 1.00 . A A . 37 PRO CD 1 1 2 1112 1 1 37 PRO CG C -4.656 -3.544 -1.571 1.00 . A A . 37 PRO CG 1 1 2 1113 1 1 37 PRO HA H -5.954 -4.509 1.275 1.00 . A A . 37 PRO HA 1 1 2 1114 1 1 37 PRO HB2 H -5.630 -5.419 -1.257 1.00 . A A . 37 PRO HB2 1 1 2 1115 1 1 37 PRO HB3 H -6.619 -4.006 -0.873 1.00 . A A . 37 PRO HB3 1 1 2 1116 1 1 37 PRO HD2 H -3.074 -2.387 -0.712 1.00 . A A . 37 PRO HD2 1 1 2 1117 1 1 37 PRO HD3 H -4.675 -1.625 -0.635 1.00 . A A . 37 PRO HD3 1 1 2 1118 1 1 37 PRO HG2 H -3.846 -4.140 -1.964 1.00 . A A . 37 PRO HG2 1 1 2 1119 1 1 37 PRO HG3 H -5.162 -3.026 -2.372 1.00 . A A . 37 PRO HG3 1 1 2 1120 1 1 37 PRO N N -4.380 -3.205 0.736 1.00 . A A . 37 PRO N 1 1 2 1121 1 1 37 PRO O O -4.636 -6.715 1.266 1.00 . A A . 37 PRO O 1 1 2 1122 1 1 38 ARG C C -1.316 -6.062 2.383 1.00 . A A . 38 ARG C 1 1 2 1123 1 1 38 ARG CA C -1.886 -6.391 1.011 1.00 . A A . 38 ARG CA 1 1 2 1124 1 1 38 ARG CB C -0.766 -6.393 -0.031 1.00 . A A . 38 ARG CB 1 1 2 1125 1 1 38 ARG CD C -0.894 -6.113 -2.502 1.00 . A A . 38 ARG CD 1 1 2 1126 1 1 38 ARG CG C -1.152 -7.047 -1.339 1.00 . A A . 38 ARG CG 1 1 2 1127 1 1 38 ARG CZ C -2.480 -4.816 -3.879 1.00 . A A . 38 ARG CZ 1 1 2 1128 1 1 38 ARG H H -2.622 -4.494 0.468 1.00 . A A . 38 ARG H 1 1 2 1129 1 1 38 ARG HA H -2.353 -7.364 1.038 1.00 . A A . 38 ARG HA 1 1 2 1130 1 1 38 ARG HB2 H -0.481 -5.372 -0.236 1.00 . A A . 38 ARG HB2 1 1 2 1131 1 1 38 ARG HB3 H 0.088 -6.918 0.371 1.00 . A A . 38 ARG HB3 1 1 2 1132 1 1 38 ARG HD2 H -0.619 -5.144 -2.112 1.00 . A A . 38 ARG HD2 1 1 2 1133 1 1 38 ARG HD3 H -0.078 -6.508 -3.090 1.00 . A A . 38 ARG HD3 1 1 2 1134 1 1 38 ARG HE H -2.565 -6.799 -3.582 1.00 . A A . 38 ARG HE 1 1 2 1135 1 1 38 ARG HG2 H -0.570 -7.948 -1.475 1.00 . A A . 38 ARG HG2 1 1 2 1136 1 1 38 ARG HG3 H -2.204 -7.294 -1.313 1.00 . A A . 38 ARG HG3 1 1 2 1137 1 1 38 ARG HH11 H -1.220 -3.657 -2.778 1.00 . A A . 38 ARG HH11 1 1 2 1138 1 1 38 ARG HH12 H -2.239 -2.801 -3.898 1.00 . A A . 38 ARG HH12 1 1 2 1139 1 1 38 ARG HH21 H -3.919 -5.667 -5.037 1.00 . A A . 38 ARG HH21 1 1 2 1140 1 1 38 ARG HH22 H -3.794 -3.935 -5.151 1.00 . A A . 38 ARG HH22 1 1 2 1141 1 1 38 ARG N N -2.903 -5.408 0.675 1.00 . A A . 38 ARG N 1 1 2 1142 1 1 38 ARG NE N -2.070 -5.970 -3.356 1.00 . A A . 38 ARG NE 1 1 2 1143 1 1 38 ARG NH1 N -1.938 -3.668 -3.484 1.00 . A A . 38 ARG NH1 1 1 2 1144 1 1 38 ARG NH2 N -3.475 -4.803 -4.758 1.00 . A A . 38 ARG NH2 1 1 2 1145 1 1 38 ARG O O -0.097 -5.961 2.555 1.00 . A A . 38 ARG O 1 1 2 1146 1 1 39 ALA C C -0.751 -6.043 5.254 1.00 . A A . 39 ALA C 1 1 2 1147 1 1 39 ALA CA C -1.864 -5.224 4.617 1.00 . A A . 39 ALA CA 1 1 2 1148 1 1 39 ALA CB C -3.086 -5.201 5.516 1.00 . A A . 39 ALA CB 1 1 2 1149 1 1 39 ALA H H -3.162 -5.680 3.018 1.00 . A A . 39 ALA H 1 1 2 1150 1 1 39 ALA HA H -1.516 -4.206 4.507 1.00 . A A . 39 ALA HA 1 1 2 1151 1 1 39 ALA HB1 H -3.770 -4.440 5.172 1.00 . A A . 39 ALA HB1 1 1 2 1152 1 1 39 ALA HB2 H -3.574 -6.164 5.487 1.00 . A A . 39 ALA HB2 1 1 2 1153 1 1 39 ALA HB3 H -2.784 -4.981 6.530 1.00 . A A . 39 ALA HB3 1 1 2 1154 1 1 39 ALA N N -2.220 -5.714 3.291 1.00 . A A . 39 ALA N 1 1 2 1155 1 1 39 ALA O O -0.893 -7.247 5.481 1.00 . A A . 39 ALA O 1 1 2 1156 1 1 40 LYS C C 1.220 -6.760 7.335 1.00 . A A . 40 LYS C 1 1 2 1157 1 1 40 LYS CA C 1.553 -5.951 6.084 1.00 . A A . 40 LYS CA 1 1 2 1158 1 1 40 LYS CB C 2.557 -4.841 6.423 1.00 . A A . 40 LYS CB 1 1 2 1159 1 1 40 LYS CD C 1.103 -2.824 6.962 1.00 . A A . 40 LYS CD 1 1 2 1160 1 1 40 LYS CE C 1.627 -2.147 5.705 1.00 . A A . 40 LYS CE 1 1 2 1161 1 1 40 LYS CG C 2.081 -3.867 7.501 1.00 . A A . 40 LYS CG 1 1 2 1162 1 1 40 LYS H H 0.387 -4.425 5.236 1.00 . A A . 40 LYS H 1 1 2 1163 1 1 40 LYS HA H 1.996 -6.608 5.350 1.00 . A A . 40 LYS HA 1 1 2 1164 1 1 40 LYS HB2 H 3.473 -5.298 6.769 1.00 . A A . 40 LYS HB2 1 1 2 1165 1 1 40 LYS HB3 H 2.766 -4.276 5.526 1.00 . A A . 40 LYS HB3 1 1 2 1166 1 1 40 LYS HD2 H 0.165 -3.308 6.734 1.00 . A A . 40 LYS HD2 1 1 2 1167 1 1 40 LYS HD3 H 0.944 -2.072 7.722 1.00 . A A . 40 LYS HD3 1 1 2 1168 1 1 40 LYS HE2 H 2.362 -1.411 5.988 1.00 . A A . 40 LYS HE2 1 1 2 1169 1 1 40 LYS HE3 H 2.093 -2.894 5.080 1.00 . A A . 40 LYS HE3 1 1 2 1170 1 1 40 LYS HG2 H 1.592 -4.429 8.282 1.00 . A A . 40 LYS HG2 1 1 2 1171 1 1 40 LYS HG3 H 2.942 -3.360 7.910 1.00 . A A . 40 LYS HG3 1 1 2 1172 1 1 40 LYS HZ1 H 0.954 -0.923 4.144 1.00 . A A . 40 LYS HZ1 1 1 2 1173 1 1 40 LYS HZ2 H 0.006 -0.829 5.543 1.00 . A A . 40 LYS HZ2 1 1 2 1174 1 1 40 LYS HZ3 H -0.110 -2.178 4.529 1.00 . A A . 40 LYS HZ3 1 1 2 1175 1 1 40 LYS N N 0.360 -5.363 5.493 1.00 . A A . 40 LYS N 1 1 2 1176 1 1 40 LYS NZ N 0.544 -1.475 4.929 1.00 . A A . 40 LYS NZ 1 1 2 1177 1 1 40 LYS O O 0.378 -6.364 8.143 1.00 . A A . 40 LYS O 1 1 2 1178 1 1 41 LYS C C 2.928 -9.356 9.130 1.00 . A A . 41 LYS C 1 1 2 1179 1 1 41 LYS CA C 1.616 -8.790 8.604 1.00 . A A . 41 LYS CA 1 1 2 1180 1 1 41 LYS CB C 0.680 -9.934 8.202 1.00 . A A . 41 LYS CB 1 1 2 1181 1 1 41 LYS CD C -1.532 -10.701 9.111 1.00 . A A . 41 LYS CD 1 1 2 1182 1 1 41 LYS CE C -3.004 -10.366 9.271 1.00 . A A . 41 LYS CE 1 1 2 1183 1 1 41 LYS CG C -0.796 -9.605 8.360 1.00 . A A . 41 LYS CG 1 1 2 1184 1 1 41 LYS H H 2.515 -8.175 6.785 1.00 . A A . 41 LYS H 1 1 2 1185 1 1 41 LYS HA H 1.149 -8.208 9.386 1.00 . A A . 41 LYS HA 1 1 2 1186 1 1 41 LYS HB2 H 0.859 -10.183 7.168 1.00 . A A . 41 LYS HB2 1 1 2 1187 1 1 41 LYS HB3 H 0.900 -10.798 8.814 1.00 . A A . 41 LYS HB3 1 1 2 1188 1 1 41 LYS HD2 H -1.441 -11.626 8.561 1.00 . A A . 41 LYS HD2 1 1 2 1189 1 1 41 LYS HD3 H -1.087 -10.816 10.090 1.00 . A A . 41 LYS HD3 1 1 2 1190 1 1 41 LYS HE2 H -3.265 -9.602 8.553 1.00 . A A . 41 LYS HE2 1 1 2 1191 1 1 41 LYS HE3 H -3.585 -11.255 9.078 1.00 . A A . 41 LYS HE3 1 1 2 1192 1 1 41 LYS HG2 H -0.891 -8.681 8.911 1.00 . A A . 41 LYS HG2 1 1 2 1193 1 1 41 LYS HG3 H -1.238 -9.490 7.379 1.00 . A A . 41 LYS HG3 1 1 2 1194 1 1 41 LYS HZ1 H -4.332 -9.655 10.717 1.00 . A A . 41 LYS HZ1 1 1 2 1195 1 1 41 LYS HZ2 H -2.768 -9.007 10.842 1.00 . A A . 41 LYS HZ2 1 1 2 1196 1 1 41 LYS HZ3 H -3.069 -10.599 11.344 1.00 . A A . 41 LYS HZ3 1 1 2 1197 1 1 41 LYS N N 1.862 -7.908 7.472 1.00 . A A . 41 LYS N 1 1 2 1198 1 1 41 LYS NZ N -3.315 -9.872 10.636 1.00 . A A . 41 LYS NZ 1 1 2 1199 1 1 41 LYS O O 3.341 -9.061 10.251 1.00 . A A . 41 LYS O 1 1 2 1200 1 1 42 SER C C 5.988 -9.718 8.649 1.00 . A A . 42 SER C 1 1 2 1201 1 1 42 SER CA C 4.865 -10.753 8.651 1.00 . A A . 42 SER CA 1 1 2 1202 1 1 42 SER CB C 5.172 -11.877 7.666 1.00 . A A . 42 SER CB 1 1 2 1203 1 1 42 SER H H 3.220 -10.320 7.403 1.00 . A A . 42 SER H 1 1 2 1204 1 1 42 SER HA H 4.772 -11.167 9.643 1.00 . A A . 42 SER HA 1 1 2 1205 1 1 42 SER HB2 H 5.963 -11.566 7.002 1.00 . A A . 42 SER HB2 1 1 2 1206 1 1 42 SER HB3 H 5.481 -12.759 8.209 1.00 . A A . 42 SER HB3 1 1 2 1207 1 1 42 SER HG H 4.270 -12.788 6.172 1.00 . A A . 42 SER HG 1 1 2 1208 1 1 42 SER N N 3.594 -10.143 8.294 1.00 . A A . 42 SER N 1 1 2 1209 1 1 42 SER O O 7.019 -9.901 9.300 1.00 . A A . 42 SER O 1 1 2 1210 1 1 42 SER OG O 4.019 -12.192 6.897 1.00 . A A . 42 SER OG 1 1 2 1211 1 1 43 GLY C C 6.173 -6.318 7.223 1.00 . A A . 43 GLY C 1 1 2 1212 1 1 43 GLY CA C 6.744 -7.553 7.883 1.00 . A A . 43 GLY CA 1 1 2 1213 1 1 43 GLY H H 4.917 -8.525 7.460 1.00 . A A . 43 GLY H 1 1 2 1214 1 1 43 GLY HA2 H 7.057 -7.304 8.887 1.00 . A A . 43 GLY HA2 1 1 2 1215 1 1 43 GLY HA3 H 7.602 -7.889 7.319 1.00 . A A . 43 GLY HA3 1 1 2 1216 1 1 43 GLY N N 5.768 -8.621 7.940 1.00 . A A . 43 GLY N 1 1 2 1217 1 1 43 GLY O O 5.499 -6.419 6.196 1.00 . A A . 43 GLY O 1 1 2 1218 1 1 44 LEU C C 6.614 -3.464 6.082 1.00 . A A . 44 LEU C 1 1 2 1219 1 1 44 LEU CA C 5.830 -3.922 7.306 1.00 . A A . 44 LEU CA 1 1 2 1220 1 1 44 LEU CB C 5.804 -2.809 8.364 1.00 . A A . 44 LEU CB 1 1 2 1221 1 1 44 LEU CD1 C 7.446 -1.836 9.983 1.00 . A A . 44 LEU CD1 1 1 2 1222 1 1 44 LEU CD2 C 5.717 -3.454 10.785 1.00 . A A . 44 LEU CD2 1 1 2 1223 1 1 44 LEU CG C 6.626 -3.067 9.627 1.00 . A A . 44 LEU CG 1 1 2 1224 1 1 44 LEU H H 6.893 -5.145 8.679 1.00 . A A . 44 LEU H 1 1 2 1225 1 1 44 LEU HA H 4.815 -4.134 6.999 1.00 . A A . 44 LEU HA 1 1 2 1226 1 1 44 LEU HB2 H 6.170 -1.902 7.904 1.00 . A A . 44 LEU HB2 1 1 2 1227 1 1 44 LEU HB3 H 4.777 -2.649 8.656 1.00 . A A . 44 LEU HB3 1 1 2 1228 1 1 44 LEU HD11 H 7.757 -1.337 9.078 1.00 . A A . 44 LEU HD11 1 1 2 1229 1 1 44 LEU HD12 H 6.846 -1.163 10.578 1.00 . A A . 44 LEU HD12 1 1 2 1230 1 1 44 LEU HD13 H 8.318 -2.134 10.547 1.00 . A A . 44 LEU HD13 1 1 2 1231 1 1 44 LEU HD21 H 5.883 -2.779 11.610 1.00 . A A . 44 LEU HD21 1 1 2 1232 1 1 44 LEU HD22 H 4.686 -3.393 10.470 1.00 . A A . 44 LEU HD22 1 1 2 1233 1 1 44 LEU HD23 H 5.940 -4.464 11.095 1.00 . A A . 44 LEU HD23 1 1 2 1234 1 1 44 LEU HG H 7.308 -3.884 9.445 1.00 . A A . 44 LEU HG 1 1 2 1235 1 1 44 LEU N N 6.382 -5.160 7.837 1.00 . A A . 44 LEU N 1 1 2 1236 1 1 44 LEU O O 6.076 -3.427 4.974 1.00 . A A . 44 LEU O 1 1 2 1237 1 1 45 ARG C C 10.217 -3.151 5.465 1.00 . A A . 45 ARG C 1 1 2 1238 1 1 45 ARG CA C 8.768 -2.804 5.160 1.00 . A A . 45 ARG CA 1 1 2 1239 1 1 45 ARG CB C 8.650 -1.305 4.847 1.00 . A A . 45 ARG CB 1 1 2 1240 1 1 45 ARG CD C 7.364 0.688 5.639 1.00 . A A . 45 ARG CD 1 1 2 1241 1 1 45 ARG CG C 8.308 -0.431 6.041 1.00 . A A . 45 ARG CG 1 1 2 1242 1 1 45 ARG CZ C 8.144 2.988 5.175 1.00 . A A . 45 ARG CZ 1 1 2 1243 1 1 45 ARG H H 8.299 -3.320 7.161 1.00 . A A . 45 ARG H 1 1 2 1244 1 1 45 ARG HA H 8.456 -3.365 4.292 1.00 . A A . 45 ARG HA 1 1 2 1245 1 1 45 ARG HB2 H 9.590 -0.963 4.442 1.00 . A A . 45 ARG HB2 1 1 2 1246 1 1 45 ARG HB3 H 7.880 -1.168 4.099 1.00 . A A . 45 ARG HB3 1 1 2 1247 1 1 45 ARG HD2 H 7.246 0.670 4.565 1.00 . A A . 45 ARG HD2 1 1 2 1248 1 1 45 ARG HD3 H 6.406 0.519 6.109 1.00 . A A . 45 ARG HD3 1 1 2 1249 1 1 45 ARG HE H 7.959 2.176 7.005 1.00 . A A . 45 ARG HE 1 1 2 1250 1 1 45 ARG HG2 H 7.834 -1.038 6.797 1.00 . A A . 45 ARG HG2 1 1 2 1251 1 1 45 ARG HG3 H 9.218 -0.001 6.434 1.00 . A A . 45 ARG HG3 1 1 2 1252 1 1 45 ARG HH11 H 7.851 1.863 3.507 1.00 . A A . 45 ARG HH11 1 1 2 1253 1 1 45 ARG HH12 H 8.278 3.523 3.217 1.00 . A A . 45 ARG HH12 1 1 2 1254 1 1 45 ARG HH21 H 8.542 4.354 6.622 1.00 . A A . 45 ARG HH21 1 1 2 1255 1 1 45 ARG HH22 H 8.685 4.933 4.987 1.00 . A A . 45 ARG HH22 1 1 2 1256 1 1 45 ARG N N 7.902 -3.191 6.267 1.00 . A A . 45 ARG N 1 1 2 1257 1 1 45 ARG NE N 7.863 2.004 6.035 1.00 . A A . 45 ARG NE 1 1 2 1258 1 1 45 ARG NH1 N 8.096 2.770 3.863 1.00 . A A . 45 ARG NH1 1 1 2 1259 1 1 45 ARG NH2 N 8.491 4.183 5.630 1.00 . A A . 45 ARG NH2 1 1 2 1260 1 1 45 ARG O O 11.019 -2.285 5.815 1.00 . A A . 45 ARG O 1 1 2 1261 1 1 46 VAL C C 12.719 -4.746 4.213 1.00 . A A . 46 VAL C 1 1 2 1262 1 1 46 VAL CA C 11.923 -4.865 5.505 1.00 . A A . 46 VAL CA 1 1 2 1263 1 1 46 VAL CB C 11.989 -6.320 6.021 1.00 . A A . 46 VAL CB 1 1 2 1264 1 1 46 VAL CG1 C 12.006 -6.348 7.544 1.00 . A A . 46 VAL CG1 1 1 2 1265 1 1 46 VAL CG2 C 10.832 -7.151 5.480 1.00 . A A . 46 VAL CG2 1 1 2 1266 1 1 46 VAL H H 9.888 -5.055 4.975 1.00 . A A . 46 VAL H 1 1 2 1267 1 1 46 VAL HA H 12.373 -4.224 6.248 1.00 . A A . 46 VAL HA 1 1 2 1268 1 1 46 VAL HB H 12.911 -6.760 5.668 1.00 . A A . 46 VAL HB 1 1 2 1269 1 1 46 VAL HG11 H 11.835 -7.358 7.887 1.00 . A A . 46 VAL HG11 1 1 2 1270 1 1 46 VAL HG12 H 12.967 -6.006 7.899 1.00 . A A . 46 VAL HG12 1 1 2 1271 1 1 46 VAL HG13 H 11.230 -5.701 7.926 1.00 . A A . 46 VAL HG13 1 1 2 1272 1 1 46 VAL HG21 H 9.911 -6.827 5.939 1.00 . A A . 46 VAL HG21 1 1 2 1273 1 1 46 VAL HG22 H 10.766 -7.022 4.409 1.00 . A A . 46 VAL HG22 1 1 2 1274 1 1 46 VAL HG23 H 11.002 -8.192 5.709 1.00 . A A . 46 VAL HG23 1 1 2 1275 1 1 46 VAL N N 10.557 -4.417 5.295 1.00 . A A . 46 VAL N 1 1 2 1276 1 1 46 VAL O O 12.094 -4.615 3.135 1.00 . A A . 46 VAL O 1 1 2 1277 1 1 46 VAL OXT O 13.964 -4.760 4.273 1.00 . A A . 46 VAL OXT 1 1 2 1278 2 2 1 ZN ZN ZN -0.384 -0.333 -0.060 1.00 . B A . 47 ZN ZN 1 1 3 1279 1 1 1 GLY C C 23.499 15.912 7.079 1.00 . A A . 1 GLY C 1 1 3 1280 1 1 1 GLY CA C 24.933 16.108 6.644 1.00 . A A . 1 GLY CA 1 1 3 1281 1 1 1 GLY H1 H 26.220 15.225 8.025 1.00 . A A . 1 GLY H1 1 1 3 1282 1 1 1 GLY H2 H 25.347 16.543 8.637 1.00 . A A . 1 GLY H2 1 1 3 1283 1 1 1 GLY H3 H 26.653 16.807 7.588 1.00 . A A . 1 GLY H3 1 1 3 1284 1 1 1 GLY HA2 H 25.008 17.026 6.082 1.00 . A A . 1 GLY HA2 1 1 3 1285 1 1 1 GLY HA3 H 25.224 15.281 6.011 1.00 . A A . 1 GLY HA3 1 1 3 1286 1 1 1 GLY N N 25.853 16.175 7.801 1.00 . A A . 1 GLY N 1 1 3 1287 1 1 1 GLY O O 23.195 14.993 7.840 1.00 . A A . 1 GLY O 1 1 3 1288 1 1 2 SER C C 20.406 16.237 5.680 1.00 . A A . 2 SER C 1 1 3 1289 1 1 2 SER CA C 21.199 16.662 6.912 1.00 . A A . 2 SER CA 1 1 3 1290 1 1 2 SER CB C 20.677 18.003 7.437 1.00 . A A . 2 SER CB 1 1 3 1291 1 1 2 SER H H 22.911 17.462 5.959 1.00 . A A . 2 SER H 1 1 3 1292 1 1 2 SER HA H 21.084 15.912 7.680 1.00 . A A . 2 SER HA 1 1 3 1293 1 1 2 SER HB2 H 20.369 18.617 6.604 1.00 . A A . 2 SER HB2 1 1 3 1294 1 1 2 SER HB3 H 19.832 17.828 8.086 1.00 . A A . 2 SER HB3 1 1 3 1295 1 1 2 SER HG H 22.527 18.637 7.696 1.00 . A A . 2 SER HG 1 1 3 1296 1 1 2 SER N N 22.612 16.764 6.590 1.00 . A A . 2 SER N 1 1 3 1297 1 1 2 SER O O 20.830 16.484 4.549 1.00 . A A . 2 SER O 1 1 3 1298 1 1 2 SER OG O 21.679 18.697 8.168 1.00 . A A . 2 SER OG 1 1 3 1299 1 1 3 MET C C 17.849 16.421 4.066 1.00 . A A . 3 MET C 1 1 3 1300 1 1 3 MET CA C 18.396 15.204 4.804 1.00 . A A . 3 MET CA 1 1 3 1301 1 1 3 MET CB C 17.250 14.328 5.319 1.00 . A A . 3 MET CB 1 1 3 1302 1 1 3 MET CE C 13.781 15.400 4.958 1.00 . A A . 3 MET CE 1 1 3 1303 1 1 3 MET CG C 16.237 15.066 6.181 1.00 . A A . 3 MET CG 1 1 3 1304 1 1 3 MET H H 18.954 15.475 6.826 1.00 . A A . 3 MET H 1 1 3 1305 1 1 3 MET HA H 18.997 14.627 4.117 1.00 . A A . 3 MET HA 1 1 3 1306 1 1 3 MET HB2 H 16.727 13.907 4.474 1.00 . A A . 3 MET HB2 1 1 3 1307 1 1 3 MET HB3 H 17.668 13.525 5.906 1.00 . A A . 3 MET HB3 1 1 3 1308 1 1 3 MET HE1 H 14.346 16.315 4.862 1.00 . A A . 3 MET HE1 1 1 3 1309 1 1 3 MET HE2 H 13.714 14.915 3.995 1.00 . A A . 3 MET HE2 1 1 3 1310 1 1 3 MET HE3 H 12.787 15.626 5.318 1.00 . A A . 3 MET HE3 1 1 3 1311 1 1 3 MET HG2 H 16.582 15.059 7.204 1.00 . A A . 3 MET HG2 1 1 3 1312 1 1 3 MET HG3 H 16.163 16.086 5.834 1.00 . A A . 3 MET HG3 1 1 3 1313 1 1 3 MET N N 19.253 15.623 5.901 1.00 . A A . 3 MET N 1 1 3 1314 1 1 3 MET O O 17.563 17.456 4.673 1.00 . A A . 3 MET O 1 1 3 1315 1 1 3 MET SD S 14.600 14.312 6.118 1.00 . A A . 3 MET SD 1 1 3 1316 1 1 4 ALA C C 15.836 17.213 1.554 1.00 . A A . 4 ALA C 1 1 3 1317 1 1 4 ALA CA C 17.294 17.415 1.930 1.00 . A A . 4 ALA CA 1 1 3 1318 1 1 4 ALA CB C 18.156 17.546 0.687 1.00 . A A . 4 ALA CB 1 1 3 1319 1 1 4 ALA H H 18.030 15.470 2.321 1.00 . A A . 4 ALA H 1 1 3 1320 1 1 4 ALA HA H 17.385 18.325 2.504 1.00 . A A . 4 ALA HA 1 1 3 1321 1 1 4 ALA HB1 H 17.881 16.779 -0.022 1.00 . A A . 4 ALA HB1 1 1 3 1322 1 1 4 ALA HB2 H 18.001 18.518 0.242 1.00 . A A . 4 ALA HB2 1 1 3 1323 1 1 4 ALA HB3 H 19.195 17.432 0.955 1.00 . A A . 4 ALA HB3 1 1 3 1324 1 1 4 ALA N N 17.762 16.315 2.754 1.00 . A A . 4 ALA N 1 1 3 1325 1 1 4 ALA O O 15.049 18.159 1.539 1.00 . A A . 4 ALA O 1 1 3 1326 1 1 5 ALA C C 13.800 14.193 1.302 1.00 . A A . 5 ALA C 1 1 3 1327 1 1 5 ALA CA C 14.109 15.632 0.923 1.00 . A A . 5 ALA CA 1 1 3 1328 1 1 5 ALA CB C 13.879 15.850 -0.565 1.00 . A A . 5 ALA CB 1 1 3 1329 1 1 5 ALA H H 16.149 15.251 1.324 1.00 . A A . 5 ALA H 1 1 3 1330 1 1 5 ALA HA H 13.448 16.290 1.469 1.00 . A A . 5 ALA HA 1 1 3 1331 1 1 5 ALA HB1 H 14.819 15.770 -1.090 1.00 . A A . 5 ALA HB1 1 1 3 1332 1 1 5 ALA HB2 H 13.194 15.102 -0.938 1.00 . A A . 5 ALA HB2 1 1 3 1333 1 1 5 ALA HB3 H 13.461 16.834 -0.725 1.00 . A A . 5 ALA HB3 1 1 3 1334 1 1 5 ALA N N 15.476 15.969 1.277 1.00 . A A . 5 ALA N 1 1 3 1335 1 1 5 ALA O O 14.670 13.324 1.233 1.00 . A A . 5 ALA O 1 1 3 1336 1 1 6 HIS C C 10.945 12.196 1.208 1.00 . A A . 6 HIS C 1 1 3 1337 1 1 6 HIS CA C 12.139 12.606 2.054 1.00 . A A . 6 HIS CA 1 1 3 1338 1 1 6 HIS CB C 11.785 12.538 3.540 1.00 . A A . 6 HIS CB 1 1 3 1339 1 1 6 HIS CD2 C 11.050 10.283 4.587 1.00 . A A . 6 HIS CD2 1 1 3 1340 1 1 6 HIS CE1 C 13.031 9.404 4.888 1.00 . A A . 6 HIS CE1 1 1 3 1341 1 1 6 HIS CG C 11.961 11.177 4.140 1.00 . A A . 6 HIS CG 1 1 3 1342 1 1 6 HIS H H 11.906 14.679 1.711 1.00 . A A . 6 HIS H 1 1 3 1343 1 1 6 HIS HA H 12.958 11.931 1.855 1.00 . A A . 6 HIS HA 1 1 3 1344 1 1 6 HIS HB2 H 12.416 13.223 4.085 1.00 . A A . 6 HIS HB2 1 1 3 1345 1 1 6 HIS HB3 H 10.752 12.826 3.671 1.00 . A A . 6 HIS HB3 1 1 3 1346 1 1 6 HIS HD1 H 14.070 10.996 4.114 1.00 . A A . 6 HIS HD1 1 1 3 1347 1 1 6 HIS HD2 H 9.975 10.405 4.577 1.00 . A A . 6 HIS HD2 1 1 3 1348 1 1 6 HIS HE1 H 13.824 8.720 5.154 1.00 . A A . 6 HIS HE1 1 1 3 1349 1 1 6 HIS HE2 H 11.337 8.310 5.258 1.00 . A A . 6 HIS HE2 1 1 3 1350 1 1 6 HIS N N 12.564 13.944 1.693 1.00 . A A . 6 HIS N 1 1 3 1351 1 1 6 HIS ND1 N 13.194 10.595 4.343 1.00 . A A . 6 HIS ND1 1 1 3 1352 1 1 6 HIS NE2 N 11.740 9.189 5.047 1.00 . A A . 6 HIS NE2 1 1 3 1353 1 1 6 HIS O O 9.796 12.447 1.571 1.00 . A A . 6 HIS O 1 1 3 1354 1 1 7 SER C C 9.807 9.716 -0.599 1.00 . A A . 7 SER C 1 1 3 1355 1 1 7 SER CA C 10.181 11.172 -0.853 1.00 . A A . 7 SER CA 1 1 3 1356 1 1 7 SER CB C 10.647 11.360 -2.299 1.00 . A A . 7 SER CB 1 1 3 1357 1 1 7 SER H H 12.165 11.441 -0.181 1.00 . A A . 7 SER H 1 1 3 1358 1 1 7 SER HA H 9.313 11.792 -0.681 1.00 . A A . 7 SER HA 1 1 3 1359 1 1 7 SER HB2 H 10.861 10.395 -2.734 1.00 . A A . 7 SER HB2 1 1 3 1360 1 1 7 SER HB3 H 9.868 11.847 -2.865 1.00 . A A . 7 SER HB3 1 1 3 1361 1 1 7 SER HG H 11.584 13.068 -2.592 1.00 . A A . 7 SER HG 1 1 3 1362 1 1 7 SER N N 11.224 11.599 0.063 1.00 . A A . 7 SER N 1 1 3 1363 1 1 7 SER O O 10.170 8.825 -1.366 1.00 . A A . 7 SER O 1 1 3 1364 1 1 7 SER OG O 11.823 12.158 -2.355 1.00 . A A . 7 SER OG 1 1 3 1365 1 1 8 ALA C C 7.193 7.961 0.727 1.00 . A A . 8 ALA C 1 1 3 1366 1 1 8 ALA CA C 8.699 8.128 0.865 1.00 . A A . 8 ALA CA 1 1 3 1367 1 1 8 ALA CB C 9.141 7.812 2.287 1.00 . A A . 8 ALA CB 1 1 3 1368 1 1 8 ALA H H 8.842 10.229 1.076 1.00 . A A . 8 ALA H 1 1 3 1369 1 1 8 ALA HA H 9.192 7.438 0.197 1.00 . A A . 8 ALA HA 1 1 3 1370 1 1 8 ALA HB1 H 8.614 6.937 2.640 1.00 . A A . 8 ALA HB1 1 1 3 1371 1 1 8 ALA HB2 H 10.204 7.624 2.300 1.00 . A A . 8 ALA HB2 1 1 3 1372 1 1 8 ALA HB3 H 8.915 8.651 2.929 1.00 . A A . 8 ALA HB3 1 1 3 1373 1 1 8 ALA N N 9.102 9.477 0.498 1.00 . A A . 8 ALA N 1 1 3 1374 1 1 8 ALA O O 6.621 6.968 1.175 1.00 . A A . 8 ALA O 1 1 3 1375 1 1 9 ASP C C 4.778 8.794 -1.571 1.00 . A A . 9 ASP C 1 1 3 1376 1 1 9 ASP CA C 5.112 8.903 -0.095 1.00 . A A . 9 ASP CA 1 1 3 1377 1 1 9 ASP CB C 4.461 10.147 0.514 1.00 . A A . 9 ASP CB 1 1 3 1378 1 1 9 ASP CG C 3.049 9.895 1.008 1.00 . A A . 9 ASP CG 1 1 3 1379 1 1 9 ASP H H 7.067 9.702 -0.249 1.00 . A A . 9 ASP H 1 1 3 1380 1 1 9 ASP HA H 4.739 8.025 0.407 1.00 . A A . 9 ASP HA 1 1 3 1381 1 1 9 ASP HB2 H 5.057 10.483 1.348 1.00 . A A . 9 ASP HB2 1 1 3 1382 1 1 9 ASP HB3 H 4.428 10.925 -0.234 1.00 . A A . 9 ASP HB3 1 1 3 1383 1 1 9 ASP N N 6.555 8.938 0.097 1.00 . A A . 9 ASP N 1 1 3 1384 1 1 9 ASP O O 3.745 9.279 -2.035 1.00 . A A . 9 ASP O 1 1 3 1385 1 1 9 ASP OD1 O 2.817 8.866 1.681 1.00 . A A . 9 ASP OD1 1 1 3 1386 1 1 9 ASP OD2 O 2.166 10.736 0.738 1.00 . A A . 9 ASP OD2 1 1 3 1387 1 1 10 LEU C C 4.827 6.358 -3.795 1.00 . A A . 10 LEU C 1 1 3 1388 1 1 10 LEU CA C 5.371 7.772 -3.690 1.00 . A A . 10 LEU CA 1 1 3 1389 1 1 10 LEU CB C 6.649 7.914 -4.525 1.00 . A A . 10 LEU CB 1 1 3 1390 1 1 10 LEU CD1 C 8.918 8.953 -4.755 1.00 . A A . 10 LEU CD1 1 1 3 1391 1 1 10 LEU CD2 C 6.880 10.401 -4.704 1.00 . A A . 10 LEU CD2 1 1 3 1392 1 1 10 LEU CG C 7.519 9.124 -4.182 1.00 . A A . 10 LEU CG 1 1 3 1393 1 1 10 LEU H H 6.381 7.651 -1.836 1.00 . A A . 10 LEU H 1 1 3 1394 1 1 10 LEU HA H 4.625 8.463 -4.056 1.00 . A A . 10 LEU HA 1 1 3 1395 1 1 10 LEU HB2 H 7.241 7.022 -4.391 1.00 . A A . 10 LEU HB2 1 1 3 1396 1 1 10 LEU HB3 H 6.367 7.985 -5.564 1.00 . A A . 10 LEU HB3 1 1 3 1397 1 1 10 LEU HD11 H 8.954 8.054 -5.355 1.00 . A A . 10 LEU HD11 1 1 3 1398 1 1 10 LEU HD12 H 9.163 9.806 -5.370 1.00 . A A . 10 LEU HD12 1 1 3 1399 1 1 10 LEU HD13 H 9.630 8.875 -3.947 1.00 . A A . 10 LEU HD13 1 1 3 1400 1 1 10 LEU HD21 H 6.927 10.412 -5.783 1.00 . A A . 10 LEU HD21 1 1 3 1401 1 1 10 LEU HD22 H 5.848 10.443 -4.388 1.00 . A A . 10 LEU HD22 1 1 3 1402 1 1 10 LEU HD23 H 7.411 11.257 -4.312 1.00 . A A . 10 LEU HD23 1 1 3 1403 1 1 10 LEU HG H 7.607 9.205 -3.108 1.00 . A A . 10 LEU HG 1 1 3 1404 1 1 10 LEU N N 5.622 8.077 -2.291 1.00 . A A . 10 LEU N 1 1 3 1405 1 1 10 LEU O O 3.644 6.154 -4.068 1.00 . A A . 10 LEU O 1 1 3 1406 1 1 11 LYS C C 5.005 3.791 -1.717 1.00 . A A . 11 LYS C 1 1 3 1407 1 1 11 LYS CA C 5.202 4.051 -3.195 1.00 . A A . 11 LYS CA 1 1 3 1408 1 1 11 LYS CB C 6.221 3.080 -3.780 1.00 . A A . 11 LYS CB 1 1 3 1409 1 1 11 LYS CD C 4.530 1.745 -5.048 1.00 . A A . 11 LYS CD 1 1 3 1410 1 1 11 LYS CE C 4.604 0.473 -5.871 1.00 . A A . 11 LYS CE 1 1 3 1411 1 1 11 LYS CG C 5.821 2.535 -5.136 1.00 . A A . 11 LYS CG 1 1 3 1412 1 1 11 LYS H H 6.504 5.667 -2.988 1.00 . A A . 11 LYS H 1 1 3 1413 1 1 11 LYS HA H 4.257 3.935 -3.703 1.00 . A A . 11 LYS HA 1 1 3 1414 1 1 11 LYS HB2 H 7.167 3.589 -3.885 1.00 . A A . 11 LYS HB2 1 1 3 1415 1 1 11 LYS HB3 H 6.340 2.249 -3.101 1.00 . A A . 11 LYS HB3 1 1 3 1416 1 1 11 LYS HD2 H 4.349 1.486 -4.015 1.00 . A A . 11 LYS HD2 1 1 3 1417 1 1 11 LYS HD3 H 3.719 2.358 -5.416 1.00 . A A . 11 LYS HD3 1 1 3 1418 1 1 11 LYS HE2 H 4.006 0.600 -6.760 1.00 . A A . 11 LYS HE2 1 1 3 1419 1 1 11 LYS HE3 H 5.632 0.302 -6.154 1.00 . A A . 11 LYS HE3 1 1 3 1420 1 1 11 LYS HG2 H 5.683 3.359 -5.821 1.00 . A A . 11 LYS HG2 1 1 3 1421 1 1 11 LYS HG3 H 6.606 1.890 -5.498 1.00 . A A . 11 LYS HG3 1 1 3 1422 1 1 11 LYS HZ1 H 3.344 -1.175 -5.654 1.00 . A A . 11 LYS HZ1 1 1 3 1423 1 1 11 LYS HZ2 H 3.746 -0.425 -4.185 1.00 . A A . 11 LYS HZ2 1 1 3 1424 1 1 11 LYS HZ3 H 4.882 -1.395 -4.985 1.00 . A A . 11 LYS HZ3 1 1 3 1425 1 1 11 LYS N N 5.640 5.412 -3.361 1.00 . A A . 11 LYS N 1 1 3 1426 1 1 11 LYS NZ N 4.108 -0.709 -5.122 1.00 . A A . 11 LYS NZ 1 1 3 1427 1 1 11 LYS O O 5.843 4.177 -0.898 1.00 . A A . 11 LYS O 1 1 3 1428 1 1 12 CYS C C 4.363 2.301 0.827 1.00 . A A . 12 CYS C 1 1 3 1429 1 1 12 CYS CA C 3.405 3.176 0.003 1.00 . A A . 12 CYS CA 1 1 3 1430 1 1 12 CYS CB C 1.977 2.631 0.037 1.00 . A A . 12 CYS CB 1 1 3 1431 1 1 12 CYS H H 3.174 3.153 -2.088 1.00 . A A . 12 CYS H 1 1 3 1432 1 1 12 CYS HA H 3.399 4.168 0.434 1.00 . A A . 12 CYS HA 1 1 3 1433 1 1 12 CYS HB2 H 1.758 2.268 1.028 1.00 . A A . 12 CYS HB2 1 1 3 1434 1 1 12 CYS HB3 H 1.295 3.433 -0.196 1.00 . A A . 12 CYS HB3 1 1 3 1435 1 1 12 CYS N N 3.826 3.311 -1.382 1.00 . A A . 12 CYS N 1 1 3 1436 1 1 12 CYS O O 5.231 1.612 0.277 1.00 . A A . 12 CYS O 1 1 3 1437 1 1 12 CYS SG S 1.656 1.278 -1.137 1.00 . A A . 12 CYS SG 1 1 3 1438 1 1 13 PRO C C 5.359 0.277 2.900 1.00 . A A . 13 PRO C 1 1 3 1439 1 1 13 PRO CA C 5.244 1.787 3.091 1.00 . A A . 13 PRO CA 1 1 3 1440 1 1 13 PRO CB C 4.655 2.105 4.463 1.00 . A A . 13 PRO CB 1 1 3 1441 1 1 13 PRO CD C 3.401 3.364 2.876 1.00 . A A . 13 PRO CD 1 1 3 1442 1 1 13 PRO CG C 3.951 3.396 4.273 1.00 . A A . 13 PRO CG 1 1 3 1443 1 1 13 PRO HA H 6.227 2.227 3.017 1.00 . A A . 13 PRO HA 1 1 3 1444 1 1 13 PRO HB2 H 3.975 1.319 4.759 1.00 . A A . 13 PRO HB2 1 1 3 1445 1 1 13 PRO HB3 H 5.448 2.194 5.189 1.00 . A A . 13 PRO HB3 1 1 3 1446 1 1 13 PRO HD2 H 2.389 2.988 2.879 1.00 . A A . 13 PRO HD2 1 1 3 1447 1 1 13 PRO HD3 H 3.436 4.349 2.433 1.00 . A A . 13 PRO HD3 1 1 3 1448 1 1 13 PRO HG2 H 3.151 3.488 4.992 1.00 . A A . 13 PRO HG2 1 1 3 1449 1 1 13 PRO HG3 H 4.649 4.212 4.379 1.00 . A A . 13 PRO HG3 1 1 3 1450 1 1 13 PRO N N 4.304 2.437 2.166 1.00 . A A . 13 PRO N 1 1 3 1451 1 1 13 PRO O O 6.409 -0.305 3.169 1.00 . A A . 13 PRO O 1 1 3 1452 1 1 14 THR C C 4.908 -2.188 0.919 1.00 . A A . 14 THR C 1 1 3 1453 1 1 14 THR CA C 4.278 -1.796 2.260 1.00 . A A . 14 THR CA 1 1 3 1454 1 1 14 THR CB C 2.851 -2.354 2.346 1.00 . A A . 14 THR CB 1 1 3 1455 1 1 14 THR CG2 C 2.876 -3.856 2.576 1.00 . A A . 14 THR CG2 1 1 3 1456 1 1 14 THR H H 3.473 0.158 2.259 1.00 . A A . 14 THR H 1 1 3 1457 1 1 14 THR HA H 4.860 -2.237 3.056 1.00 . A A . 14 THR HA 1 1 3 1458 1 1 14 THR HB H 2.342 -2.155 1.414 1.00 . A A . 14 THR HB 1 1 3 1459 1 1 14 THR HG1 H 1.408 -1.184 3.043 1.00 . A A . 14 THR HG1 1 1 3 1460 1 1 14 THR HG21 H 2.762 -4.061 3.630 1.00 . A A . 14 THR HG21 1 1 3 1461 1 1 14 THR HG22 H 3.818 -4.256 2.231 1.00 . A A . 14 THR HG22 1 1 3 1462 1 1 14 THR HG23 H 2.066 -4.317 2.030 1.00 . A A . 14 THR HG23 1 1 3 1463 1 1 14 THR N N 4.284 -0.356 2.456 1.00 . A A . 14 THR N 1 1 3 1464 1 1 14 THR O O 4.379 -1.867 -0.145 1.00 . A A . 14 THR O 1 1 3 1465 1 1 14 THR OG1 O 2.140 -1.712 3.417 1.00 . A A . 14 THR OG1 1 1 3 1466 1 1 15 PRO C C 6.089 -4.298 -1.067 1.00 . A A . 15 PRO C 1 1 3 1467 1 1 15 PRO CA C 6.824 -3.246 -0.244 1.00 . A A . 15 PRO CA 1 1 3 1468 1 1 15 PRO CB C 8.132 -3.826 0.314 1.00 . A A . 15 PRO CB 1 1 3 1469 1 1 15 PRO CD C 6.811 -3.210 2.188 1.00 . A A . 15 PRO CD 1 1 3 1470 1 1 15 PRO CG C 8.226 -3.300 1.700 1.00 . A A . 15 PRO CG 1 1 3 1471 1 1 15 PRO HA H 7.043 -2.391 -0.864 1.00 . A A . 15 PRO HA 1 1 3 1472 1 1 15 PRO HB2 H 8.083 -4.905 0.304 1.00 . A A . 15 PRO HB2 1 1 3 1473 1 1 15 PRO HB3 H 8.962 -3.494 -0.287 1.00 . A A . 15 PRO HB3 1 1 3 1474 1 1 15 PRO HD2 H 6.480 -4.163 2.578 1.00 . A A . 15 PRO HD2 1 1 3 1475 1 1 15 PRO HD3 H 6.713 -2.436 2.936 1.00 . A A . 15 PRO HD3 1 1 3 1476 1 1 15 PRO HG2 H 8.796 -3.981 2.313 1.00 . A A . 15 PRO HG2 1 1 3 1477 1 1 15 PRO HG3 H 8.683 -2.322 1.690 1.00 . A A . 15 PRO HG3 1 1 3 1478 1 1 15 PRO N N 6.076 -2.855 0.963 1.00 . A A . 15 PRO N 1 1 3 1479 1 1 15 PRO O O 6.232 -4.365 -2.288 1.00 . A A . 15 PRO O 1 1 3 1480 1 1 16 GLY C C 3.247 -5.688 -1.603 1.00 . A A . 16 GLY C 1 1 3 1481 1 1 16 GLY CA C 4.568 -6.176 -1.050 1.00 . A A . 16 GLY CA 1 1 3 1482 1 1 16 GLY H H 5.246 -5.029 0.583 1.00 . A A . 16 GLY H 1 1 3 1483 1 1 16 GLY HA2 H 5.167 -6.562 -1.856 1.00 . A A . 16 GLY HA2 1 1 3 1484 1 1 16 GLY HA3 H 4.377 -6.970 -0.343 1.00 . A A . 16 GLY HA3 1 1 3 1485 1 1 16 GLY N N 5.306 -5.124 -0.384 1.00 . A A . 16 GLY N 1 1 3 1486 1 1 16 GLY O O 2.519 -6.435 -2.258 1.00 . A A . 16 GLY O 1 1 3 1487 1 1 17 CYS C C 1.954 -3.215 -3.209 1.00 . A A . 17 CYS C 1 1 3 1488 1 1 17 CYS CA C 1.728 -3.818 -1.829 1.00 . A A . 17 CYS CA 1 1 3 1489 1 1 17 CYS CB C 1.276 -2.757 -0.829 1.00 . A A . 17 CYS CB 1 1 3 1490 1 1 17 CYS H H 3.587 -3.876 -0.850 1.00 . A A . 17 CYS H 1 1 3 1491 1 1 17 CYS HA H 0.973 -4.586 -1.900 1.00 . A A . 17 CYS HA 1 1 3 1492 1 1 17 CYS HB2 H 1.167 -3.218 0.140 1.00 . A A . 17 CYS HB2 1 1 3 1493 1 1 17 CYS HB3 H 2.035 -1.990 -0.769 1.00 . A A . 17 CYS HB3 1 1 3 1494 1 1 17 CYS N N 2.950 -4.427 -1.351 1.00 . A A . 17 CYS N 1 1 3 1495 1 1 17 CYS O O 3.092 -2.937 -3.597 1.00 . A A . 17 CYS O 1 1 3 1496 1 1 17 CYS SG S -0.301 -1.937 -1.215 1.00 . A A . 17 CYS SG 1 1 3 1497 1 1 18 ASP C C 0.559 -0.987 -5.266 1.00 . A A . 18 ASP C 1 1 3 1498 1 1 18 ASP CA C 0.963 -2.457 -5.285 1.00 . A A . 18 ASP CA 1 1 3 1499 1 1 18 ASP CB C 0.095 -3.245 -6.273 1.00 . A A . 18 ASP CB 1 1 3 1500 1 1 18 ASP CG C -1.313 -2.704 -6.386 1.00 . A A . 18 ASP CG 1 1 3 1501 1 1 18 ASP H H -0.005 -3.258 -3.578 1.00 . A A . 18 ASP H 1 1 3 1502 1 1 18 ASP HA H 1.994 -2.524 -5.598 1.00 . A A . 18 ASP HA 1 1 3 1503 1 1 18 ASP HB2 H 0.553 -3.211 -7.250 1.00 . A A . 18 ASP HB2 1 1 3 1504 1 1 18 ASP HB3 H 0.036 -4.273 -5.948 1.00 . A A . 18 ASP HB3 1 1 3 1505 1 1 18 ASP N N 0.875 -3.025 -3.949 1.00 . A A . 18 ASP N 1 1 3 1506 1 1 18 ASP O O 1.007 -0.203 -6.102 1.00 . A A . 18 ASP O 1 1 3 1507 1 1 18 ASP OD1 O -2.144 -3.017 -5.514 1.00 . A A . 18 ASP OD1 1 1 3 1508 1 1 18 ASP OD2 O -1.597 -1.971 -7.358 1.00 . A A . 18 ASP OD2 1 1 3 1509 1 1 19 GLY C C -1.890 1.165 -4.680 1.00 . A A . 19 GLY C 1 1 3 1510 1 1 19 GLY CA C -0.548 0.798 -4.071 1.00 . A A . 19 GLY CA 1 1 3 1511 1 1 19 GLY H H -0.445 -1.257 -3.559 1.00 . A A . 19 GLY H 1 1 3 1512 1 1 19 GLY HA2 H -0.580 1.015 -3.013 1.00 . A A . 19 GLY HA2 1 1 3 1513 1 1 19 GLY HA3 H 0.217 1.408 -4.526 1.00 . A A . 19 GLY HA3 1 1 3 1514 1 1 19 GLY N N -0.197 -0.599 -4.247 1.00 . A A . 19 GLY N 1 1 3 1515 1 1 19 GLY O O -2.575 2.069 -4.192 1.00 . A A . 19 GLY O 1 1 3 1516 1 1 20 SER C C -4.638 -0.095 -6.022 1.00 . A A . 20 SER C 1 1 3 1517 1 1 20 SER CA C -3.500 0.824 -6.446 1.00 . A A . 20 SER CA 1 1 3 1518 1 1 20 SER CB C -3.291 0.760 -7.959 1.00 . A A . 20 SER CB 1 1 3 1519 1 1 20 SER H H -1.684 -0.205 -6.120 1.00 . A A . 20 SER H 1 1 3 1520 1 1 20 SER HA H -3.759 1.834 -6.173 1.00 . A A . 20 SER HA 1 1 3 1521 1 1 20 SER HB2 H -3.929 -0.005 -8.377 1.00 . A A . 20 SER HB2 1 1 3 1522 1 1 20 SER HB3 H -3.537 1.715 -8.398 1.00 . A A . 20 SER HB3 1 1 3 1523 1 1 20 SER HG H -1.755 -0.467 -7.993 1.00 . A A . 20 SER HG 1 1 3 1524 1 1 20 SER N N -2.265 0.498 -5.757 1.00 . A A . 20 SER N 1 1 3 1525 1 1 20 SER O O -5.101 -0.937 -6.795 1.00 . A A . 20 SER O 1 1 3 1526 1 1 20 SER OG O -1.940 0.449 -8.269 1.00 . A A . 20 SER OG 1 1 3 1527 1 1 21 GLY C C -6.443 -0.405 -2.827 1.00 . A A . 21 GLY C 1 1 3 1528 1 1 21 GLY CA C -6.219 -0.669 -4.295 1.00 . A A . 21 GLY CA 1 1 3 1529 1 1 21 GLY H H -4.709 0.800 -4.247 1.00 . A A . 21 GLY H 1 1 3 1530 1 1 21 GLY HA2 H -7.112 -0.406 -4.842 1.00 . A A . 21 GLY HA2 1 1 3 1531 1 1 21 GLY HA3 H -6.012 -1.720 -4.437 1.00 . A A . 21 GLY HA3 1 1 3 1532 1 1 21 GLY N N -5.109 0.104 -4.804 1.00 . A A . 21 GLY N 1 1 3 1533 1 1 21 GLY O O -5.788 0.454 -2.250 1.00 . A A . 21 GLY O 1 1 3 1534 1 1 22 HIS C C -8.160 -2.353 -0.267 1.00 . A A . 22 HIS C 1 1 3 1535 1 1 22 HIS CA C -7.641 -1.025 -0.799 1.00 . A A . 22 HIS CA 1 1 3 1536 1 1 22 HIS CB C -8.689 0.070 -0.531 1.00 . A A . 22 HIS CB 1 1 3 1537 1 1 22 HIS CD2 C -7.577 2.378 -1.004 1.00 . A A . 22 HIS CD2 1 1 3 1538 1 1 22 HIS CE1 C -7.650 3.188 1.027 1.00 . A A . 22 HIS CE1 1 1 3 1539 1 1 22 HIS CG C -8.132 1.431 -0.212 1.00 . A A . 22 HIS CG 1 1 3 1540 1 1 22 HIS H H -7.840 -1.825 -2.752 1.00 . A A . 22 HIS H 1 1 3 1541 1 1 22 HIS HA H -6.721 -0.773 -0.292 1.00 . A A . 22 HIS HA 1 1 3 1542 1 1 22 HIS HB2 H -9.319 0.175 -1.401 1.00 . A A . 22 HIS HB2 1 1 3 1543 1 1 22 HIS HB3 H -9.301 -0.236 0.304 1.00 . A A . 22 HIS HB3 1 1 3 1544 1 1 22 HIS HD1 H -8.514 1.535 1.865 1.00 . A A . 22 HIS HD1 1 1 3 1545 1 1 22 HIS HD2 H -7.422 2.309 -2.068 1.00 . A A . 22 HIS HD2 1 1 3 1546 1 1 22 HIS HE1 H -7.552 3.850 1.874 1.00 . A A . 22 HIS HE1 1 1 3 1547 1 1 22 HIS HE2 H -7.099 4.376 -0.541 1.00 . A A . 22 HIS HE2 1 1 3 1548 1 1 22 HIS N N -7.352 -1.145 -2.225 1.00 . A A . 22 HIS N 1 1 3 1549 1 1 22 HIS ND1 N -8.159 1.973 1.054 1.00 . A A . 22 HIS ND1 1 1 3 1550 1 1 22 HIS NE2 N -7.287 3.460 -0.209 1.00 . A A . 22 HIS NE2 1 1 3 1551 1 1 22 HIS O O -8.920 -3.040 -0.945 1.00 . A A . 22 HIS O 1 1 3 1552 1 1 23 ILE C C -9.762 -3.630 2.049 1.00 . A A . 23 ILE C 1 1 3 1553 1 1 23 ILE CA C -8.329 -3.898 1.602 1.00 . A A . 23 ILE CA 1 1 3 1554 1 1 23 ILE CB C -7.444 -4.348 2.802 1.00 . A A . 23 ILE CB 1 1 3 1555 1 1 23 ILE CD1 C -8.167 -6.722 2.207 1.00 . A A . 23 ILE CD1 1 1 3 1556 1 1 23 ILE CG1 C -7.038 -5.815 2.646 1.00 . A A . 23 ILE CG1 1 1 3 1557 1 1 23 ILE CG2 C -8.137 -4.132 4.142 1.00 . A A . 23 ILE CG2 1 1 3 1558 1 1 23 ILE H H -7.209 -2.095 1.482 1.00 . A A . 23 ILE H 1 1 3 1559 1 1 23 ILE HA H -8.333 -4.688 0.863 1.00 . A A . 23 ILE HA 1 1 3 1560 1 1 23 ILE HB H -6.551 -3.741 2.795 1.00 . A A . 23 ILE HB 1 1 3 1561 1 1 23 ILE HD11 H -9.053 -6.130 2.022 1.00 . A A . 23 ILE HD11 1 1 3 1562 1 1 23 ILE HD12 H -7.881 -7.236 1.301 1.00 . A A . 23 ILE HD12 1 1 3 1563 1 1 23 ILE HD13 H -8.373 -7.447 2.982 1.00 . A A . 23 ILE HD13 1 1 3 1564 1 1 23 ILE HG12 H -6.255 -5.883 1.909 1.00 . A A . 23 ILE HG12 1 1 3 1565 1 1 23 ILE HG13 H -6.668 -6.182 3.592 1.00 . A A . 23 ILE HG13 1 1 3 1566 1 1 23 ILE HG21 H -7.487 -4.461 4.941 1.00 . A A . 23 ILE HG21 1 1 3 1567 1 1 23 ILE HG22 H -8.358 -3.081 4.268 1.00 . A A . 23 ILE HG22 1 1 3 1568 1 1 23 ILE HG23 H -9.055 -4.699 4.169 1.00 . A A . 23 ILE HG23 1 1 3 1569 1 1 23 ILE N N -7.800 -2.692 0.969 1.00 . A A . 23 ILE N 1 1 3 1570 1 1 23 ILE O O -10.565 -4.541 2.263 1.00 . A A . 23 ILE O 1 1 3 1571 1 1 24 THR C C -12.398 -2.196 1.382 1.00 . A A . 24 THR C 1 1 3 1572 1 1 24 THR CA C -11.363 -1.849 2.436 1.00 . A A . 24 THR CA 1 1 3 1573 1 1 24 THR CB C -11.233 -0.337 2.526 1.00 . A A . 24 THR CB 1 1 3 1574 1 1 24 THR CG2 C -11.578 0.145 3.898 1.00 . A A . 24 THR CG2 1 1 3 1575 1 1 24 THR H H -9.395 -1.696 1.834 1.00 . A A . 24 THR H 1 1 3 1576 1 1 24 THR HA H -11.662 -2.233 3.397 1.00 . A A . 24 THR HA 1 1 3 1577 1 1 24 THR HB H -11.892 0.111 1.812 1.00 . A A . 24 THR HB 1 1 3 1578 1 1 24 THR HG1 H -9.328 -0.099 3.008 1.00 . A A . 24 THR HG1 1 1 3 1579 1 1 24 THR HG21 H -12.494 -0.320 4.215 1.00 . A A . 24 THR HG21 1 1 3 1580 1 1 24 THR HG22 H -11.695 1.215 3.880 1.00 . A A . 24 THR HG22 1 1 3 1581 1 1 24 THR HG23 H -10.781 -0.125 4.572 1.00 . A A . 24 THR HG23 1 1 3 1582 1 1 24 THR N N -10.072 -2.352 2.091 1.00 . A A . 24 THR N 1 1 3 1583 1 1 24 THR O O -13.313 -2.987 1.608 1.00 . A A . 24 THR O 1 1 3 1584 1 1 24 THR OG1 O -9.883 0.040 2.219 1.00 . A A . 24 THR OG1 1 1 3 1585 1 1 25 GLY C C -13.957 -0.442 -1.107 1.00 . A A . 25 GLY C 1 1 3 1586 1 1 25 GLY CA C -13.194 -1.718 -0.843 1.00 . A A . 25 GLY CA 1 1 3 1587 1 1 25 GLY H H -11.512 -0.919 0.159 1.00 . A A . 25 GLY H 1 1 3 1588 1 1 25 GLY HA2 H -12.659 -2.002 -1.738 1.00 . A A . 25 GLY HA2 1 1 3 1589 1 1 25 GLY HA3 H -13.894 -2.498 -0.586 1.00 . A A . 25 GLY HA3 1 1 3 1590 1 1 25 GLY N N -12.253 -1.551 0.244 1.00 . A A . 25 GLY N 1 1 3 1591 1 1 25 GLY O O -15.009 -0.448 -1.747 1.00 . A A . 25 GLY O 1 1 3 1592 1 1 26 ASN C C -13.378 2.892 -1.529 1.00 . A A . 26 ASN C 1 1 3 1593 1 1 26 ASN CA C -14.142 1.935 -0.622 1.00 . A A . 26 ASN CA 1 1 3 1594 1 1 26 ASN CB C -14.287 2.568 0.770 1.00 . A A . 26 ASN CB 1 1 3 1595 1 1 26 ASN CG C -14.719 1.584 1.844 1.00 . A A . 26 ASN CG 1 1 3 1596 1 1 26 ASN H H -12.662 0.570 0.023 1.00 . A A . 26 ASN H 1 1 3 1597 1 1 26 ASN HA H -15.125 1.766 -1.035 1.00 . A A . 26 ASN HA 1 1 3 1598 1 1 26 ASN HB2 H -13.337 2.984 1.065 1.00 . A A . 26 ASN HB2 1 1 3 1599 1 1 26 ASN HB3 H -15.015 3.362 0.722 1.00 . A A . 26 ASN HB3 1 1 3 1600 1 1 26 ASN HD21 H -16.093 0.808 0.641 1.00 . A A . 26 ASN HD21 1 1 3 1601 1 1 26 ASN HD22 H -15.997 0.107 2.225 1.00 . A A . 26 ASN HD22 1 1 3 1602 1 1 26 ASN N N -13.463 0.649 -0.533 1.00 . A A . 26 ASN N 1 1 3 1603 1 1 26 ASN ND2 N -15.700 0.751 1.537 1.00 . A A . 26 ASN ND2 1 1 3 1604 1 1 26 ASN O O -13.888 3.950 -1.899 1.00 . A A . 26 ASN O 1 1 3 1605 1 1 26 ASN OD1 O -14.172 1.577 2.946 1.00 . A A . 26 ASN OD1 1 1 3 1606 1 1 27 TYR C C -10.504 2.668 -3.623 1.00 . A A . 27 TYR C 1 1 3 1607 1 1 27 TYR CA C -11.241 3.446 -2.547 1.00 . A A . 27 TYR CA 1 1 3 1608 1 1 27 TYR CB C -10.230 4.099 -1.614 1.00 . A A . 27 TYR CB 1 1 3 1609 1 1 27 TYR CD1 C -11.220 4.302 0.695 1.00 . A A . 27 TYR CD1 1 1 3 1610 1 1 27 TYR CD2 C -11.070 6.273 -0.640 1.00 . A A . 27 TYR CD2 1 1 3 1611 1 1 27 TYR CE1 C -11.794 5.029 1.715 1.00 . A A . 27 TYR CE1 1 1 3 1612 1 1 27 TYR CE2 C -11.644 7.009 0.379 1.00 . A A . 27 TYR CE2 1 1 3 1613 1 1 27 TYR CG C -10.850 4.909 -0.499 1.00 . A A . 27 TYR CG 1 1 3 1614 1 1 27 TYR CZ C -12.005 6.381 1.555 1.00 . A A . 27 TYR CZ 1 1 3 1615 1 1 27 TYR H H -11.747 1.750 -1.422 1.00 . A A . 27 TYR H 1 1 3 1616 1 1 27 TYR HA H -11.844 4.211 -3.014 1.00 . A A . 27 TYR HA 1 1 3 1617 1 1 27 TYR HB2 H -9.627 3.327 -1.164 1.00 . A A . 27 TYR HB2 1 1 3 1618 1 1 27 TYR HB3 H -9.594 4.744 -2.188 1.00 . A A . 27 TYR HB3 1 1 3 1619 1 1 27 TYR HD1 H -11.053 3.240 0.819 1.00 . A A . 27 TYR HD1 1 1 3 1620 1 1 27 TYR HD2 H -10.790 6.759 -1.562 1.00 . A A . 27 TYR HD2 1 1 3 1621 1 1 27 TYR HE1 H -12.078 4.537 2.632 1.00 . A A . 27 TYR HE1 1 1 3 1622 1 1 27 TYR HE2 H -11.809 8.069 0.254 1.00 . A A . 27 TYR HE2 1 1 3 1623 1 1 27 TYR HH H -12.379 6.688 3.425 1.00 . A A . 27 TYR HH 1 1 3 1624 1 1 27 TYR N N -12.117 2.570 -1.791 1.00 . A A . 27 TYR N 1 1 3 1625 1 1 27 TYR O O -10.213 1.485 -3.455 1.00 . A A . 27 TYR O 1 1 3 1626 1 1 27 TYR OH O -12.583 7.107 2.570 1.00 . A A . 27 TYR OH 1 1 3 1627 1 1 28 ALA C C -8.032 2.573 -5.611 1.00 . A A . 28 ALA C 1 1 3 1628 1 1 28 ALA CA C -9.533 2.713 -5.847 1.00 . A A . 28 ALA CA 1 1 3 1629 1 1 28 ALA CB C -9.790 3.501 -7.120 1.00 . A A . 28 ALA CB 1 1 3 1630 1 1 28 ALA H H -10.472 4.287 -4.787 1.00 . A A . 28 ALA H 1 1 3 1631 1 1 28 ALA HA H -9.957 1.729 -5.975 1.00 . A A . 28 ALA HA 1 1 3 1632 1 1 28 ALA HB1 H -8.894 4.038 -7.398 1.00 . A A . 28 ALA HB1 1 1 3 1633 1 1 28 ALA HB2 H -10.063 2.823 -7.912 1.00 . A A . 28 ALA HB2 1 1 3 1634 1 1 28 ALA HB3 H -10.593 4.204 -6.954 1.00 . A A . 28 ALA HB3 1 1 3 1635 1 1 28 ALA N N -10.202 3.342 -4.719 1.00 . A A . 28 ALA N 1 1 3 1636 1 1 28 ALA O O -7.411 1.630 -6.096 1.00 . A A . 28 ALA O 1 1 3 1637 1 1 29 SER C C -5.658 4.319 -3.419 1.00 . A A . 29 SER C 1 1 3 1638 1 1 29 SER CA C -6.008 3.522 -4.671 1.00 . A A . 29 SER CA 1 1 3 1639 1 1 29 SER CB C -5.258 4.096 -5.880 1.00 . A A . 29 SER CB 1 1 3 1640 1 1 29 SER H H -7.977 4.287 -4.584 1.00 . A A . 29 SER H 1 1 3 1641 1 1 29 SER HA H -5.705 2.495 -4.528 1.00 . A A . 29 SER HA 1 1 3 1642 1 1 29 SER HB2 H -4.540 4.828 -5.540 1.00 . A A . 29 SER HB2 1 1 3 1643 1 1 29 SER HB3 H -4.744 3.297 -6.390 1.00 . A A . 29 SER HB3 1 1 3 1644 1 1 29 SER HG H -5.651 4.996 -7.581 1.00 . A A . 29 SER HG 1 1 3 1645 1 1 29 SER N N -7.443 3.535 -4.914 1.00 . A A . 29 SER N 1 1 3 1646 1 1 29 SER O O -6.513 5.003 -2.853 1.00 . A A . 29 SER O 1 1 3 1647 1 1 29 SER OG O -6.146 4.721 -6.792 1.00 . A A . 29 SER OG 1 1 3 1648 1 1 30 HIS C C -2.481 5.513 -2.192 1.00 . A A . 30 HIS C 1 1 3 1649 1 1 30 HIS CA C -3.891 5.019 -1.888 1.00 . A A . 30 HIS CA 1 1 3 1650 1 1 30 HIS CB C -3.886 4.177 -0.602 1.00 . A A . 30 HIS CB 1 1 3 1651 1 1 30 HIS CD2 C -1.984 2.455 -0.272 1.00 . A A . 30 HIS CD2 1 1 3 1652 1 1 30 HIS CE1 C -2.800 0.794 -1.390 1.00 . A A . 30 HIS CE1 1 1 3 1653 1 1 30 HIS CG C -3.192 2.856 -0.739 1.00 . A A . 30 HIS CG 1 1 3 1654 1 1 30 HIS H H -3.753 3.721 -3.544 1.00 . A A . 30 HIS H 1 1 3 1655 1 1 30 HIS HA H -4.537 5.873 -1.752 1.00 . A A . 30 HIS HA 1 1 3 1656 1 1 30 HIS HB2 H -3.381 4.731 0.172 1.00 . A A . 30 HIS HB2 1 1 3 1657 1 1 30 HIS HB3 H -4.901 3.993 -0.294 1.00 . A A . 30 HIS HB3 1 1 3 1658 1 1 30 HIS HD1 H -4.579 1.737 -1.880 1.00 . A A . 30 HIS HD1 1 1 3 1659 1 1 30 HIS HD2 H -1.310 3.035 0.334 1.00 . A A . 30 HIS HD2 1 1 3 1660 1 1 30 HIS HE1 H -2.906 -0.158 -1.890 1.00 . A A . 30 HIS HE1 1 1 3 1661 1 1 30 HIS N N -4.391 4.256 -3.022 1.00 . A A . 30 HIS N 1 1 3 1662 1 1 30 HIS ND1 N -3.700 1.784 -1.443 1.00 . A A . 30 HIS ND1 1 1 3 1663 1 1 30 HIS NE2 N -1.759 1.163 -0.692 1.00 . A A . 30 HIS NE2 1 1 3 1664 1 1 30 HIS O O -2.055 5.527 -3.350 1.00 . A A . 30 HIS O 1 1 3 1665 1 1 31 ARG C C 0.427 6.008 -0.075 1.00 . A A . 31 ARG C 1 1 3 1666 1 1 31 ARG CA C -0.404 6.379 -1.295 1.00 . A A . 31 ARG CA 1 1 3 1667 1 1 31 ARG CB C -0.425 7.895 -1.470 1.00 . A A . 31 ARG CB 1 1 3 1668 1 1 31 ARG CD C 0.633 9.941 -2.466 1.00 . A A . 31 ARG CD 1 1 3 1669 1 1 31 ARG CG C 0.700 8.427 -2.337 1.00 . A A . 31 ARG CG 1 1 3 1670 1 1 31 ARG CZ C -0.728 11.347 -0.959 1.00 . A A . 31 ARG CZ 1 1 3 1671 1 1 31 ARG H H -2.144 5.811 -0.252 1.00 . A A . 31 ARG H 1 1 3 1672 1 1 31 ARG HA H 0.031 5.925 -2.172 1.00 . A A . 31 ARG HA 1 1 3 1673 1 1 31 ARG HB2 H -1.365 8.178 -1.921 1.00 . A A . 31 ARG HB2 1 1 3 1674 1 1 31 ARG HB3 H -0.352 8.357 -0.497 1.00 . A A . 31 ARG HB3 1 1 3 1675 1 1 31 ARG HD2 H 1.583 10.298 -2.836 1.00 . A A . 31 ARG HD2 1 1 3 1676 1 1 31 ARG HD3 H -0.143 10.195 -3.172 1.00 . A A . 31 ARG HD3 1 1 3 1677 1 1 31 ARG HE H 1.005 10.464 -0.457 1.00 . A A . 31 ARG HE 1 1 3 1678 1 1 31 ARG HG2 H 1.645 8.155 -1.893 1.00 . A A . 31 ARG HG2 1 1 3 1679 1 1 31 ARG HG3 H 0.621 7.987 -3.320 1.00 . A A . 31 ARG HG3 1 1 3 1680 1 1 31 ARG HH11 H -1.502 11.126 -2.827 1.00 . A A . 31 ARG HH11 1 1 3 1681 1 1 31 ARG HH12 H -2.442 12.107 -1.736 1.00 . A A . 31 ARG HH12 1 1 3 1682 1 1 31 ARG HH21 H -0.241 11.749 0.974 1.00 . A A . 31 ARG HH21 1 1 3 1683 1 1 31 ARG HH22 H -1.711 12.480 0.404 1.00 . A A . 31 ARG HH22 1 1 3 1684 1 1 31 ARG N N -1.758 5.882 -1.151 1.00 . A A . 31 ARG N 1 1 3 1685 1 1 31 ARG NE N 0.347 10.595 -1.189 1.00 . A A . 31 ARG NE 1 1 3 1686 1 1 31 ARG NH1 N -1.626 11.543 -1.916 1.00 . A A . 31 ARG NH1 1 1 3 1687 1 1 31 ARG NH2 N -0.911 11.901 0.235 1.00 . A A . 31 ARG NH2 1 1 3 1688 1 1 31 ARG O O 1.646 5.878 -0.158 1.00 . A A . 31 ARG O 1 1 3 1689 1 1 32 SER C C -0.253 4.321 2.963 1.00 . A A . 32 SER C 1 1 3 1690 1 1 32 SER CA C 0.426 5.524 2.309 1.00 . A A . 32 SER CA 1 1 3 1691 1 1 32 SER CB C 0.411 6.736 3.247 1.00 . A A . 32 SER CB 1 1 3 1692 1 1 32 SER H H -1.218 5.995 1.070 1.00 . A A . 32 SER H 1 1 3 1693 1 1 32 SER HA H 1.450 5.268 2.079 1.00 . A A . 32 SER HA 1 1 3 1694 1 1 32 SER HB2 H -0.445 6.670 3.901 1.00 . A A . 32 SER HB2 1 1 3 1695 1 1 32 SER HB3 H 1.315 6.745 3.836 1.00 . A A . 32 SER HB3 1 1 3 1696 1 1 32 SER HG H 1.193 8.135 2.093 1.00 . A A . 32 SER HG 1 1 3 1697 1 1 32 SER N N -0.243 5.859 1.063 1.00 . A A . 32 SER N 1 1 3 1698 1 1 32 SER O O -1.166 3.732 2.381 1.00 . A A . 32 SER O 1 1 3 1699 1 1 32 SER OG O 0.332 7.952 2.511 1.00 . A A . 32 SER OG 1 1 3 1700 1 1 33 LEU C C -1.682 3.050 5.498 1.00 . A A . 33 LEU C 1 1 3 1701 1 1 33 LEU CA C -0.327 2.778 4.855 1.00 . A A . 33 LEU CA 1 1 3 1702 1 1 33 LEU CB C 0.659 2.336 5.933 1.00 . A A . 33 LEU CB 1 1 3 1703 1 1 33 LEU CD1 C 2.354 0.699 6.754 1.00 . A A . 33 LEU CD1 1 1 3 1704 1 1 33 LEU CD2 C 0.274 -0.116 5.645 1.00 . A A . 33 LEU CD2 1 1 3 1705 1 1 33 LEU CG C 1.316 0.988 5.684 1.00 . A A . 33 LEU CG 1 1 3 1706 1 1 33 LEU H H 0.951 4.429 4.560 1.00 . A A . 33 LEU H 1 1 3 1707 1 1 33 LEU HA H -0.435 1.986 4.132 1.00 . A A . 33 LEU HA 1 1 3 1708 1 1 33 LEU HB2 H 1.435 3.083 6.008 1.00 . A A . 33 LEU HB2 1 1 3 1709 1 1 33 LEU HB3 H 0.136 2.289 6.874 1.00 . A A . 33 LEU HB3 1 1 3 1710 1 1 33 LEU HD11 H 3.341 0.856 6.346 1.00 . A A . 33 LEU HD11 1 1 3 1711 1 1 33 LEU HD12 H 2.199 1.358 7.594 1.00 . A A . 33 LEU HD12 1 1 3 1712 1 1 33 LEU HD13 H 2.257 -0.327 7.079 1.00 . A A . 33 LEU HD13 1 1 3 1713 1 1 33 LEU HD21 H 0.524 -0.872 6.374 1.00 . A A . 33 LEU HD21 1 1 3 1714 1 1 33 LEU HD22 H -0.696 0.299 5.875 1.00 . A A . 33 LEU HD22 1 1 3 1715 1 1 33 LEU HD23 H 0.252 -0.558 4.659 1.00 . A A . 33 LEU HD23 1 1 3 1716 1 1 33 LEU HG H 1.814 1.018 4.728 1.00 . A A . 33 LEU HG 1 1 3 1717 1 1 33 LEU N N 0.195 3.951 4.162 1.00 . A A . 33 LEU N 1 1 3 1718 1 1 33 LEU O O -1.935 2.656 6.637 1.00 . A A . 33 LEU O 1 1 3 1719 1 1 34 SER C C -4.917 3.045 4.530 1.00 . A A . 34 SER C 1 1 3 1720 1 1 34 SER CA C -3.905 3.943 5.232 1.00 . A A . 34 SER CA 1 1 3 1721 1 1 34 SER CB C -4.249 5.410 5.001 1.00 . A A . 34 SER CB 1 1 3 1722 1 1 34 SER H H -2.320 3.937 3.837 1.00 . A A . 34 SER H 1 1 3 1723 1 1 34 SER HA H -3.928 3.734 6.291 1.00 . A A . 34 SER HA 1 1 3 1724 1 1 34 SER HB2 H -4.949 5.483 4.181 1.00 . A A . 34 SER HB2 1 1 3 1725 1 1 34 SER HB3 H -4.694 5.818 5.894 1.00 . A A . 34 SER HB3 1 1 3 1726 1 1 34 SER HG H -2.426 6.049 5.381 1.00 . A A . 34 SER HG 1 1 3 1727 1 1 34 SER N N -2.567 3.670 4.750 1.00 . A A . 34 SER N 1 1 3 1728 1 1 34 SER O O -6.088 2.996 4.904 1.00 . A A . 34 SER O 1 1 3 1729 1 1 34 SER OG O -3.089 6.164 4.679 1.00 . A A . 34 SER OG 1 1 3 1730 1 1 35 GLY C C -4.580 0.399 2.003 1.00 . A A . 35 GLY C 1 1 3 1731 1 1 35 GLY CA C -5.332 1.467 2.761 1.00 . A A . 35 GLY CA 1 1 3 1732 1 1 35 GLY H H -3.512 2.400 3.259 1.00 . A A . 35 GLY H 1 1 3 1733 1 1 35 GLY HA2 H -6.022 0.993 3.443 1.00 . A A . 35 GLY HA2 1 1 3 1734 1 1 35 GLY HA3 H -5.891 2.064 2.057 1.00 . A A . 35 GLY HA3 1 1 3 1735 1 1 35 GLY N N -4.455 2.334 3.507 1.00 . A A . 35 GLY N 1 1 3 1736 1 1 35 GLY O O -5.090 -0.124 1.013 1.00 . A A . 35 GLY O 1 1 3 1737 1 1 36 CYS C C -3.318 -2.344 1.996 1.00 . A A . 36 CYS C 1 1 3 1738 1 1 36 CYS CA C -2.585 -1.009 1.894 1.00 . A A . 36 CYS CA 1 1 3 1739 1 1 36 CYS CB C -1.234 -1.130 2.608 1.00 . A A . 36 CYS CB 1 1 3 1740 1 1 36 CYS H H -3.065 0.489 3.308 1.00 . A A . 36 CYS H 1 1 3 1741 1 1 36 CYS HA H -2.420 -0.772 0.853 1.00 . A A . 36 CYS HA 1 1 3 1742 1 1 36 CYS HB2 H -1.377 -0.932 3.660 1.00 . A A . 36 CYS HB2 1 1 3 1743 1 1 36 CYS HB3 H -0.868 -2.142 2.487 1.00 . A A . 36 CYS HB3 1 1 3 1744 1 1 36 CYS N N -3.387 0.057 2.489 1.00 . A A . 36 CYS N 1 1 3 1745 1 1 36 CYS O O -3.512 -2.870 3.094 1.00 . A A . 36 CYS O 1 1 3 1746 1 1 36 CYS SG S 0.064 0.005 2.011 1.00 . A A . 36 CYS SG 1 1 3 1747 1 1 37 PRO C C -3.627 -5.349 0.891 1.00 . A A . 37 PRO C 1 1 3 1748 1 1 37 PRO CA C -4.542 -4.132 0.856 1.00 . A A . 37 PRO CA 1 1 3 1749 1 1 37 PRO CB C -5.310 -4.046 -0.459 1.00 . A A . 37 PRO CB 1 1 3 1750 1 1 37 PRO CD C -3.700 -2.279 -0.479 1.00 . A A . 37 PRO CD 1 1 3 1751 1 1 37 PRO CG C -4.408 -3.276 -1.360 1.00 . A A . 37 PRO CG 1 1 3 1752 1 1 37 PRO HA H -5.236 -4.184 1.679 1.00 . A A . 37 PRO HA 1 1 3 1753 1 1 37 PRO HB2 H -5.504 -5.040 -0.834 1.00 . A A . 37 PRO HB2 1 1 3 1754 1 1 37 PRO HB3 H -6.248 -3.524 -0.292 1.00 . A A . 37 PRO HB3 1 1 3 1755 1 1 37 PRO HD2 H -2.668 -2.163 -0.782 1.00 . A A . 37 PRO HD2 1 1 3 1756 1 1 37 PRO HD3 H -4.208 -1.328 -0.507 1.00 . A A . 37 PRO HD3 1 1 3 1757 1 1 37 PRO HG2 H -3.694 -3.943 -1.820 1.00 . A A . 37 PRO HG2 1 1 3 1758 1 1 37 PRO HG3 H -4.988 -2.766 -2.113 1.00 . A A . 37 PRO HG3 1 1 3 1759 1 1 37 PRO N N -3.791 -2.880 0.867 1.00 . A A . 37 PRO N 1 1 3 1760 1 1 37 PRO O O -4.058 -6.456 1.205 1.00 . A A . 37 PRO O 1 1 3 1761 1 1 38 ARG C C -0.410 -5.884 1.937 1.00 . A A . 38 ARG C 1 1 3 1762 1 1 38 ARG CA C -1.341 -6.169 0.768 1.00 . A A . 38 ARG CA 1 1 3 1763 1 1 38 ARG CB C -0.528 -6.280 -0.527 1.00 . A A . 38 ARG CB 1 1 3 1764 1 1 38 ARG CD C -1.087 -6.885 -2.890 1.00 . A A . 38 ARG CD 1 1 3 1765 1 1 38 ARG CG C -1.292 -5.879 -1.773 1.00 . A A . 38 ARG CG 1 1 3 1766 1 1 38 ARG CZ C -2.549 -8.239 -4.349 1.00 . A A . 38 ARG CZ 1 1 3 1767 1 1 38 ARG H H -2.044 -4.192 0.509 1.00 . A A . 38 ARG H 1 1 3 1768 1 1 38 ARG HA H -1.856 -7.102 0.947 1.00 . A A . 38 ARG HA 1 1 3 1769 1 1 38 ARG HB2 H 0.341 -5.649 -0.447 1.00 . A A . 38 ARG HB2 1 1 3 1770 1 1 38 ARG HB3 H -0.205 -7.304 -0.645 1.00 . A A . 38 ARG HB3 1 1 3 1771 1 1 38 ARG HD2 H -0.369 -6.486 -3.590 1.00 . A A . 38 ARG HD2 1 1 3 1772 1 1 38 ARG HD3 H -0.705 -7.802 -2.466 1.00 . A A . 38 ARG HD3 1 1 3 1773 1 1 38 ARG HE H -3.072 -6.509 -3.481 1.00 . A A . 38 ARG HE 1 1 3 1774 1 1 38 ARG HG2 H -2.344 -5.824 -1.538 1.00 . A A . 38 ARG HG2 1 1 3 1775 1 1 38 ARG HG3 H -0.942 -4.912 -2.104 1.00 . A A . 38 ARG HG3 1 1 3 1776 1 1 38 ARG HH11 H -0.704 -9.033 -4.064 1.00 . A A . 38 ARG HH11 1 1 3 1777 1 1 38 ARG HH12 H -1.758 -9.957 -5.092 1.00 . A A . 38 ARG HH12 1 1 3 1778 1 1 38 ARG HH21 H -4.449 -7.719 -4.807 1.00 . A A . 38 ARG HH21 1 1 3 1779 1 1 38 ARG HH22 H -3.905 -9.220 -5.498 1.00 . A A . 38 ARG HH22 1 1 3 1780 1 1 38 ARG N N -2.340 -5.116 0.671 1.00 . A A . 38 ARG N 1 1 3 1781 1 1 38 ARG NE N -2.335 -7.167 -3.590 1.00 . A A . 38 ARG NE 1 1 3 1782 1 1 38 ARG NH1 N -1.595 -9.146 -4.514 1.00 . A A . 38 ARG NH1 1 1 3 1783 1 1 38 ARG NH2 N -3.725 -8.402 -4.934 1.00 . A A . 38 ARG NH2 1 1 3 1784 1 1 38 ARG O O 0.789 -6.164 1.873 1.00 . A A . 38 ARG O 1 1 3 1785 1 1 39 ALA C C 0.297 -6.028 4.943 1.00 . A A . 39 ALA C 1 1 3 1786 1 1 39 ALA CA C -0.155 -4.835 4.119 1.00 . A A . 39 ALA CA 1 1 3 1787 1 1 39 ALA CB C -0.924 -3.866 4.990 1.00 . A A . 39 ALA CB 1 1 3 1788 1 1 39 ALA H H -1.899 -4.998 2.929 1.00 . A A . 39 ALA H 1 1 3 1789 1 1 39 ALA HA H 0.718 -4.321 3.746 1.00 . A A . 39 ALA HA 1 1 3 1790 1 1 39 ALA HB1 H -1.302 -3.058 4.381 1.00 . A A . 39 ALA HB1 1 1 3 1791 1 1 39 ALA HB2 H -1.744 -4.379 5.464 1.00 . A A . 39 ALA HB2 1 1 3 1792 1 1 39 ALA HB3 H -0.261 -3.470 5.744 1.00 . A A . 39 ALA HB3 1 1 3 1793 1 1 39 ALA N N -0.950 -5.244 2.968 1.00 . A A . 39 ALA N 1 1 3 1794 1 1 39 ALA O O -0.365 -6.423 5.904 1.00 . A A . 39 ALA O 1 1 3 1795 1 1 40 LYS C C 1.069 -8.807 5.518 1.00 . A A . 40 LYS C 1 1 3 1796 1 1 40 LYS CA C 2.077 -7.691 5.254 1.00 . A A . 40 LYS CA 1 1 3 1797 1 1 40 LYS CB C 2.715 -7.225 6.566 1.00 . A A . 40 LYS CB 1 1 3 1798 1 1 40 LYS CD C 3.322 -4.799 6.809 1.00 . A A . 40 LYS CD 1 1 3 1799 1 1 40 LYS CE C 4.003 -3.699 6.015 1.00 . A A . 40 LYS CE 1 1 3 1800 1 1 40 LYS CG C 3.800 -6.176 6.377 1.00 . A A . 40 LYS CG 1 1 3 1801 1 1 40 LYS H H 1.908 -6.161 3.800 1.00 . A A . 40 LYS H 1 1 3 1802 1 1 40 LYS HA H 2.853 -8.076 4.608 1.00 . A A . 40 LYS HA 1 1 3 1803 1 1 40 LYS HB2 H 1.945 -6.804 7.195 1.00 . A A . 40 LYS HB2 1 1 3 1804 1 1 40 LYS HB3 H 3.149 -8.077 7.065 1.00 . A A . 40 LYS HB3 1 1 3 1805 1 1 40 LYS HD2 H 2.256 -4.735 6.653 1.00 . A A . 40 LYS HD2 1 1 3 1806 1 1 40 LYS HD3 H 3.543 -4.663 7.857 1.00 . A A . 40 LYS HD3 1 1 3 1807 1 1 40 LYS HE2 H 4.988 -3.540 6.423 1.00 . A A . 40 LYS HE2 1 1 3 1808 1 1 40 LYS HE3 H 4.087 -4.017 4.985 1.00 . A A . 40 LYS HE3 1 1 3 1809 1 1 40 LYS HG2 H 4.661 -6.449 6.969 1.00 . A A . 40 LYS HG2 1 1 3 1810 1 1 40 LYS HG3 H 4.076 -6.140 5.332 1.00 . A A . 40 LYS HG3 1 1 3 1811 1 1 40 LYS HZ1 H 3.898 -1.633 6.298 1.00 . A A . 40 LYS HZ1 1 1 3 1812 1 1 40 LYS HZ2 H 2.507 -2.467 6.800 1.00 . A A . 40 LYS HZ2 1 1 3 1813 1 1 40 LYS HZ3 H 2.799 -2.225 5.146 1.00 . A A . 40 LYS HZ3 1 1 3 1814 1 1 40 LYS N N 1.451 -6.561 4.566 1.00 . A A . 40 LYS N 1 1 3 1815 1 1 40 LYS NZ N 3.248 -2.419 6.067 1.00 . A A . 40 LYS NZ 1 1 3 1816 1 1 40 LYS O O 0.901 -9.252 6.654 1.00 . A A . 40 LYS O 1 1 3 1817 1 1 41 LYS C C 0.113 -11.672 4.614 1.00 . A A . 41 LYS C 1 1 3 1818 1 1 41 LYS CA C -0.580 -10.320 4.582 1.00 . A A . 41 LYS CA 1 1 3 1819 1 1 41 LYS CB C -1.575 -10.261 3.423 1.00 . A A . 41 LYS CB 1 1 3 1820 1 1 41 LYS CD C -3.772 -9.063 3.281 1.00 . A A . 41 LYS CD 1 1 3 1821 1 1 41 LYS CE C -4.422 -9.422 1.953 1.00 . A A . 41 LYS CE 1 1 3 1822 1 1 41 LYS CG C -3.023 -10.244 3.871 1.00 . A A . 41 LYS CG 1 1 3 1823 1 1 41 LYS H H 0.613 -8.884 3.574 1.00 . A A . 41 LYS H 1 1 3 1824 1 1 41 LYS HA H -1.111 -10.178 5.510 1.00 . A A . 41 LYS HA 1 1 3 1825 1 1 41 LYS HB2 H -1.387 -9.368 2.847 1.00 . A A . 41 LYS HB2 1 1 3 1826 1 1 41 LYS HB3 H -1.426 -11.124 2.792 1.00 . A A . 41 LYS HB3 1 1 3 1827 1 1 41 LYS HD2 H -4.540 -8.754 3.975 1.00 . A A . 41 LYS HD2 1 1 3 1828 1 1 41 LYS HD3 H -3.078 -8.251 3.125 1.00 . A A . 41 LYS HD3 1 1 3 1829 1 1 41 LYS HE2 H -4.388 -8.558 1.306 1.00 . A A . 41 LYS HE2 1 1 3 1830 1 1 41 LYS HE3 H -3.868 -10.231 1.502 1.00 . A A . 41 LYS HE3 1 1 3 1831 1 1 41 LYS HG2 H -3.501 -11.158 3.551 1.00 . A A . 41 LYS HG2 1 1 3 1832 1 1 41 LYS HG3 H -3.055 -10.176 4.949 1.00 . A A . 41 LYS HG3 1 1 3 1833 1 1 41 LYS HZ1 H -5.901 -10.885 2.174 1.00 . A A . 41 LYS HZ1 1 1 3 1834 1 1 41 LYS HZ2 H -6.413 -9.512 1.320 1.00 . A A . 41 LYS HZ2 1 1 3 1835 1 1 41 LYS HZ3 H -6.226 -9.444 3.006 1.00 . A A . 41 LYS HZ3 1 1 3 1836 1 1 41 LYS N N 0.411 -9.259 4.463 1.00 . A A . 41 LYS N 1 1 3 1837 1 1 41 LYS NZ N -5.837 -9.843 2.125 1.00 . A A . 41 LYS NZ 1 1 3 1838 1 1 41 LYS O O 0.184 -12.322 5.654 1.00 . A A . 41 LYS O 1 1 3 1839 1 1 42 SER C C 3.032 -12.829 3.407 1.00 . A A . 42 SER C 1 1 3 1840 1 1 42 SER CA C 1.559 -13.216 3.422 1.00 . A A . 42 SER CA 1 1 3 1841 1 1 42 SER CB C 1.188 -13.997 2.164 1.00 . A A . 42 SER CB 1 1 3 1842 1 1 42 SER H H 0.740 -11.392 2.746 1.00 . A A . 42 SER H 1 1 3 1843 1 1 42 SER HA H 1.359 -13.823 4.293 1.00 . A A . 42 SER HA 1 1 3 1844 1 1 42 SER HB2 H 1.828 -13.693 1.349 1.00 . A A . 42 SER HB2 1 1 3 1845 1 1 42 SER HB3 H 1.312 -15.055 2.347 1.00 . A A . 42 SER HB3 1 1 3 1846 1 1 42 SER HG H -0.743 -14.024 2.535 1.00 . A A . 42 SER HG 1 1 3 1847 1 1 42 SER N N 0.747 -12.013 3.507 1.00 . A A . 42 SER N 1 1 3 1848 1 1 42 SER O O 3.814 -13.302 2.579 1.00 . A A . 42 SER O 1 1 3 1849 1 1 42 SER OG O -0.161 -13.749 1.805 1.00 . A A . 42 SER OG 1 1 3 1850 1 1 43 GLY C C 4.688 -10.001 3.404 1.00 . A A . 43 GLY C 1 1 3 1851 1 1 43 GLY CA C 4.677 -11.267 4.231 1.00 . A A . 43 GLY CA 1 1 3 1852 1 1 43 GLY H H 2.657 -11.452 4.796 1.00 . A A . 43 GLY H 1 1 3 1853 1 1 43 GLY HA2 H 4.973 -11.035 5.242 1.00 . A A . 43 GLY HA2 1 1 3 1854 1 1 43 GLY HA3 H 5.377 -11.972 3.806 1.00 . A A . 43 GLY HA3 1 1 3 1855 1 1 43 GLY N N 3.358 -11.854 4.244 1.00 . A A . 43 GLY N 1 1 3 1856 1 1 43 GLY O O 3.633 -9.536 2.968 1.00 . A A . 43 GLY O 1 1 3 1857 1 1 44 LEU C C 6.653 -8.577 1.008 1.00 . A A . 44 LEU C 1 1 3 1858 1 1 44 LEU CA C 5.965 -8.261 2.331 1.00 . A A . 44 LEU CA 1 1 3 1859 1 1 44 LEU CB C 6.722 -7.152 3.073 1.00 . A A . 44 LEU CB 1 1 3 1860 1 1 44 LEU CD1 C 9.234 -7.198 3.072 1.00 . A A . 44 LEU CD1 1 1 3 1861 1 1 44 LEU CD2 C 7.986 -7.008 5.229 1.00 . A A . 44 LEU CD2 1 1 3 1862 1 1 44 LEU CG C 7.976 -7.599 3.828 1.00 . A A . 44 LEU CG 1 1 3 1863 1 1 44 LEU H H 6.682 -9.879 3.500 1.00 . A A . 44 LEU H 1 1 3 1864 1 1 44 LEU HA H 4.957 -7.920 2.127 1.00 . A A . 44 LEU HA 1 1 3 1865 1 1 44 LEU HB2 H 7.011 -6.402 2.353 1.00 . A A . 44 LEU HB2 1 1 3 1866 1 1 44 LEU HB3 H 6.047 -6.703 3.783 1.00 . A A . 44 LEU HB3 1 1 3 1867 1 1 44 LEU HD11 H 9.420 -7.909 2.280 1.00 . A A . 44 LEU HD11 1 1 3 1868 1 1 44 LEU HD12 H 9.099 -6.215 2.649 1.00 . A A . 44 LEU HD12 1 1 3 1869 1 1 44 LEU HD13 H 10.073 -7.186 3.750 1.00 . A A . 44 LEU HD13 1 1 3 1870 1 1 44 LEU HD21 H 9.005 -6.911 5.572 1.00 . A A . 44 LEU HD21 1 1 3 1871 1 1 44 LEU HD22 H 7.517 -6.035 5.213 1.00 . A A . 44 LEU HD22 1 1 3 1872 1 1 44 LEU HD23 H 7.441 -7.657 5.898 1.00 . A A . 44 LEU HD23 1 1 3 1873 1 1 44 LEU HG H 7.970 -8.677 3.919 1.00 . A A . 44 LEU HG 1 1 3 1874 1 1 44 LEU N N 5.861 -9.455 3.149 1.00 . A A . 44 LEU N 1 1 3 1875 1 1 44 LEU O O 7.081 -7.677 0.288 1.00 . A A . 44 LEU O 1 1 3 1876 1 1 45 ARG C C 6.467 -11.361 -1.224 1.00 . A A . 45 ARG C 1 1 3 1877 1 1 45 ARG CA C 7.338 -10.302 -0.560 1.00 . A A . 45 ARG CA 1 1 3 1878 1 1 45 ARG CB C 8.742 -10.857 -0.304 1.00 . A A . 45 ARG CB 1 1 3 1879 1 1 45 ARG CD C 10.322 -8.915 -0.485 1.00 . A A . 45 ARG CD 1 1 3 1880 1 1 45 ARG CG C 9.816 -10.190 -1.141 1.00 . A A . 45 ARG CG 1 1 3 1881 1 1 45 ARG CZ C 12.601 -9.041 0.446 1.00 . A A . 45 ARG CZ 1 1 3 1882 1 1 45 ARG H H 6.353 -10.536 1.296 1.00 . A A . 45 ARG H 1 1 3 1883 1 1 45 ARG HA H 7.411 -9.447 -1.215 1.00 . A A . 45 ARG HA 1 1 3 1884 1 1 45 ARG HB2 H 8.989 -10.716 0.739 1.00 . A A . 45 ARG HB2 1 1 3 1885 1 1 45 ARG HB3 H 8.744 -11.913 -0.527 1.00 . A A . 45 ARG HB3 1 1 3 1886 1 1 45 ARG HD2 H 10.795 -8.301 -1.237 1.00 . A A . 45 ARG HD2 1 1 3 1887 1 1 45 ARG HD3 H 9.480 -8.383 -0.066 1.00 . A A . 45 ARG HD3 1 1 3 1888 1 1 45 ARG HE H 10.928 -9.515 1.440 1.00 . A A . 45 ARG HE 1 1 3 1889 1 1 45 ARG HG2 H 10.642 -10.874 -1.260 1.00 . A A . 45 ARG HG2 1 1 3 1890 1 1 45 ARG HG3 H 9.405 -9.948 -2.110 1.00 . A A . 45 ARG HG3 1 1 3 1891 1 1 45 ARG HH11 H 12.507 -8.383 -1.470 1.00 . A A . 45 ARG HH11 1 1 3 1892 1 1 45 ARG HH12 H 14.107 -8.509 -0.805 1.00 . A A . 45 ARG HH12 1 1 3 1893 1 1 45 ARG HH21 H 13.023 -9.613 2.345 1.00 . A A . 45 ARG HH21 1 1 3 1894 1 1 45 ARG HH22 H 14.404 -9.186 1.368 1.00 . A A . 45 ARG HH22 1 1 3 1895 1 1 45 ARG N N 6.732 -9.860 0.685 1.00 . A A . 45 ARG N 1 1 3 1896 1 1 45 ARG NE N 11.287 -9.192 0.577 1.00 . A A . 45 ARG NE 1 1 3 1897 1 1 45 ARG NH1 N 13.112 -8.607 -0.699 1.00 . A A . 45 ARG NH1 1 1 3 1898 1 1 45 ARG NH2 N 13.404 -9.302 1.464 1.00 . A A . 45 ARG NH2 1 1 3 1899 1 1 45 ARG O O 6.848 -12.527 -1.316 1.00 . A A . 45 ARG O 1 1 3 1900 1 1 46 VAL C C 3.401 -11.047 -3.182 1.00 . A A . 46 VAL C 1 1 3 1901 1 1 46 VAL CA C 4.345 -11.854 -2.297 1.00 . A A . 46 VAL CA 1 1 3 1902 1 1 46 VAL CB C 3.545 -12.667 -1.246 1.00 . A A . 46 VAL CB 1 1 3 1903 1 1 46 VAL CG1 C 2.674 -11.758 -0.395 1.00 . A A . 46 VAL CG1 1 1 3 1904 1 1 46 VAL CG2 C 2.705 -13.754 -1.906 1.00 . A A . 46 VAL CG2 1 1 3 1905 1 1 46 VAL H H 5.042 -10.009 -1.555 1.00 . A A . 46 VAL H 1 1 3 1906 1 1 46 VAL HA H 4.905 -12.543 -2.914 1.00 . A A . 46 VAL HA 1 1 3 1907 1 1 46 VAL HB H 4.256 -13.150 -0.590 1.00 . A A . 46 VAL HB 1 1 3 1908 1 1 46 VAL HG11 H 1.660 -11.776 -0.769 1.00 . A A . 46 VAL HG11 1 1 3 1909 1 1 46 VAL HG12 H 2.687 -12.101 0.628 1.00 . A A . 46 VAL HG12 1 1 3 1910 1 1 46 VAL HG13 H 3.056 -10.749 -0.440 1.00 . A A . 46 VAL HG13 1 1 3 1911 1 1 46 VAL HG21 H 3.302 -14.646 -2.027 1.00 . A A . 46 VAL HG21 1 1 3 1912 1 1 46 VAL HG22 H 1.851 -13.975 -1.283 1.00 . A A . 46 VAL HG22 1 1 3 1913 1 1 46 VAL HG23 H 2.367 -13.412 -2.873 1.00 . A A . 46 VAL HG23 1 1 3 1914 1 1 46 VAL N N 5.288 -10.952 -1.659 1.00 . A A . 46 VAL N 1 1 3 1915 1 1 46 VAL O O 2.753 -11.632 -4.077 1.00 . A A . 46 VAL O 1 1 3 1916 1 1 46 VAL OXT O 3.328 -9.813 -2.988 1.00 . A A . 46 VAL OXT 1 1 3 1917 2 2 1 ZN ZN ZN -0.145 0.149 -0.275 1.00 . B A . 47 ZN ZN 1 1 4 1918 1 1 1 GLY C C -12.964 18.329 -4.198 1.00 . A A . 1 GLY C 1 1 4 1919 1 1 1 GLY CA C -13.888 19.488 -3.909 1.00 . A A . 1 GLY CA 1 1 4 1920 1 1 1 GLY H1 H -13.534 20.869 -5.428 1.00 . A A . 1 GLY H1 1 1 4 1921 1 1 1 GLY H2 H -12.299 20.786 -4.273 1.00 . A A . 1 GLY H2 1 1 4 1922 1 1 1 GLY H3 H -13.756 21.569 -3.899 1.00 . A A . 1 GLY H3 1 1 4 1923 1 1 1 GLY HA2 H -14.035 19.562 -2.842 1.00 . A A . 1 GLY HA2 1 1 4 1924 1 1 1 GLY HA3 H -14.839 19.305 -4.387 1.00 . A A . 1 GLY HA3 1 1 4 1925 1 1 1 GLY N N -13.332 20.767 -4.411 1.00 . A A . 1 GLY N 1 1 4 1926 1 1 1 GLY O O -11.847 18.539 -4.679 1.00 . A A . 1 GLY O 1 1 4 1927 1 1 2 SER C C -11.278 16.002 -3.486 1.00 . A A . 2 SER C 1 1 4 1928 1 1 2 SER CA C -12.651 15.898 -4.147 1.00 . A A . 2 SER CA 1 1 4 1929 1 1 2 SER CB C -12.518 15.636 -5.652 1.00 . A A . 2 SER CB 1 1 4 1930 1 1 2 SER H H -14.340 17.026 -3.544 1.00 . A A . 2 SER H 1 1 4 1931 1 1 2 SER HA H -13.186 15.075 -3.696 1.00 . A A . 2 SER HA 1 1 4 1932 1 1 2 SER HB2 H -11.783 16.307 -6.070 1.00 . A A . 2 SER HB2 1 1 4 1933 1 1 2 SER HB3 H -12.209 14.614 -5.812 1.00 . A A . 2 SER HB3 1 1 4 1934 1 1 2 SER HG H -14.481 15.503 -5.756 1.00 . A A . 2 SER HG 1 1 4 1935 1 1 2 SER N N -13.432 17.111 -3.918 1.00 . A A . 2 SER N 1 1 4 1936 1 1 2 SER O O -10.269 16.251 -4.151 1.00 . A A . 2 SER O 1 1 4 1937 1 1 2 SER OG O -13.761 15.844 -6.313 1.00 . A A . 2 SER OG 1 1 4 1938 1 1 3 MET C C -8.967 15.054 -1.872 1.00 . A A . 3 MET C 1 1 4 1939 1 1 3 MET CA C -10.048 16.005 -1.370 1.00 . A A . 3 MET CA 1 1 4 1940 1 1 3 MET CB C -10.348 15.727 0.107 1.00 . A A . 3 MET CB 1 1 4 1941 1 1 3 MET CE C -8.154 14.939 3.397 1.00 . A A . 3 MET CE 1 1 4 1942 1 1 3 MET CG C -9.161 15.966 1.029 1.00 . A A . 3 MET CG 1 1 4 1943 1 1 3 MET H H -12.122 15.714 -1.695 1.00 . A A . 3 MET H 1 1 4 1944 1 1 3 MET HA H -9.694 17.020 -1.471 1.00 . A A . 3 MET HA 1 1 4 1945 1 1 3 MET HB2 H -11.158 16.368 0.423 1.00 . A A . 3 MET HB2 1 1 4 1946 1 1 3 MET HB3 H -10.656 14.698 0.209 1.00 . A A . 3 MET HB3 1 1 4 1947 1 1 3 MET HE1 H -7.474 14.237 3.856 1.00 . A A . 3 MET HE1 1 1 4 1948 1 1 3 MET HE2 H -7.711 15.925 3.401 1.00 . A A . 3 MET HE2 1 1 4 1949 1 1 3 MET HE3 H -9.079 14.961 3.956 1.00 . A A . 3 MET HE3 1 1 4 1950 1 1 3 MET HG2 H -8.384 16.467 0.472 1.00 . A A . 3 MET HG2 1 1 4 1951 1 1 3 MET HG3 H -9.479 16.597 1.847 1.00 . A A . 3 MET HG3 1 1 4 1952 1 1 3 MET N N -11.269 15.878 -2.161 1.00 . A A . 3 MET N 1 1 4 1953 1 1 3 MET O O -9.113 13.834 -1.773 1.00 . A A . 3 MET O 1 1 4 1954 1 1 3 MET SD S -8.486 14.435 1.710 1.00 . A A . 3 MET SD 1 1 4 1955 1 1 4 ALA C C -7.359 13.844 -4.060 1.00 . A A . 4 ALA C 1 1 4 1956 1 1 4 ALA CA C -6.825 14.853 -3.048 1.00 . A A . 4 ALA CA 1 1 4 1957 1 1 4 ALA CB C -6.015 14.161 -1.963 1.00 . A A . 4 ALA CB 1 1 4 1958 1 1 4 ALA H H -7.900 16.605 -2.542 1.00 . A A . 4 ALA H 1 1 4 1959 1 1 4 ALA HA H -6.173 15.544 -3.563 1.00 . A A . 4 ALA HA 1 1 4 1960 1 1 4 ALA HB1 H -5.015 14.565 -1.947 1.00 . A A . 4 ALA HB1 1 1 4 1961 1 1 4 ALA HB2 H -6.486 14.323 -1.005 1.00 . A A . 4 ALA HB2 1 1 4 1962 1 1 4 ALA HB3 H -5.973 13.101 -2.168 1.00 . A A . 4 ALA HB3 1 1 4 1963 1 1 4 ALA N N -7.918 15.627 -2.464 1.00 . A A . 4 ALA N 1 1 4 1964 1 1 4 ALA O O -7.303 12.632 -3.839 1.00 . A A . 4 ALA O 1 1 4 1965 1 1 5 ALA C C -7.673 12.583 -6.808 1.00 . A A . 5 ALA C 1 1 4 1966 1 1 5 ALA CA C -8.640 13.545 -6.124 1.00 . A A . 5 ALA CA 1 1 4 1967 1 1 5 ALA CB C -9.321 14.431 -7.159 1.00 . A A . 5 ALA CB 1 1 4 1968 1 1 5 ALA H H -8.050 15.343 -5.179 1.00 . A A . 5 ALA H 1 1 4 1969 1 1 5 ALA HA H -9.405 12.970 -5.625 1.00 . A A . 5 ALA HA 1 1 4 1970 1 1 5 ALA HB1 H -9.517 13.858 -8.052 1.00 . A A . 5 ALA HB1 1 1 4 1971 1 1 5 ALA HB2 H -10.254 14.802 -6.758 1.00 . A A . 5 ALA HB2 1 1 4 1972 1 1 5 ALA HB3 H -8.678 15.265 -7.399 1.00 . A A . 5 ALA HB3 1 1 4 1973 1 1 5 ALA N N -7.973 14.367 -5.117 1.00 . A A . 5 ALA N 1 1 4 1974 1 1 5 ALA O O -8.050 11.469 -7.174 1.00 . A A . 5 ALA O 1 1 4 1975 1 1 6 HIS C C -4.538 11.509 -6.524 1.00 . A A . 6 HIS C 1 1 4 1976 1 1 6 HIS CA C -5.419 12.162 -7.580 1.00 . A A . 6 HIS CA 1 1 4 1977 1 1 6 HIS CB C -4.559 12.984 -8.543 1.00 . A A . 6 HIS CB 1 1 4 1978 1 1 6 HIS CD2 C -3.875 11.288 -10.384 1.00 . A A . 6 HIS CD2 1 1 4 1979 1 1 6 HIS CE1 C -4.841 12.263 -12.091 1.00 . A A . 6 HIS CE1 1 1 4 1980 1 1 6 HIS CG C -4.482 12.405 -9.922 1.00 . A A . 6 HIS CG 1 1 4 1981 1 1 6 HIS H H -6.172 13.884 -6.608 1.00 . A A . 6 HIS H 1 1 4 1982 1 1 6 HIS HA H -5.927 11.388 -8.136 1.00 . A A . 6 HIS HA 1 1 4 1983 1 1 6 HIS HB2 H -4.973 13.979 -8.622 1.00 . A A . 6 HIS HB2 1 1 4 1984 1 1 6 HIS HB3 H -3.555 13.047 -8.150 1.00 . A A . 6 HIS HB3 1 1 4 1985 1 1 6 HIS HD1 H -5.601 13.834 -11.012 1.00 . A A . 6 HIS HD1 1 1 4 1986 1 1 6 HIS HD2 H -3.305 10.580 -9.798 1.00 . A A . 6 HIS HD2 1 1 4 1987 1 1 6 HIS HE1 H -5.185 12.479 -13.091 1.00 . A A . 6 HIS HE1 1 1 4 1988 1 1 6 HIS HE2 H -3.928 10.439 -12.307 1.00 . A A . 6 HIS HE2 1 1 4 1989 1 1 6 HIS N N -6.428 13.002 -6.956 1.00 . A A . 6 HIS N 1 1 4 1990 1 1 6 HIS ND1 N -5.077 12.993 -11.018 1.00 . A A . 6 HIS ND1 1 1 4 1991 1 1 6 HIS NE2 N -4.112 11.223 -11.733 1.00 . A A . 6 HIS NE2 1 1 4 1992 1 1 6 HIS O O -3.665 12.157 -5.944 1.00 . A A . 6 HIS O 1 1 4 1993 1 1 7 SER C C -2.603 9.262 -5.773 1.00 . A A . 7 SER C 1 1 4 1994 1 1 7 SER CA C -4.023 9.494 -5.267 1.00 . A A . 7 SER CA 1 1 4 1995 1 1 7 SER CB C -4.710 8.162 -4.959 1.00 . A A . 7 SER CB 1 1 4 1996 1 1 7 SER H H -5.534 9.783 -6.715 1.00 . A A . 7 SER H 1 1 4 1997 1 1 7 SER HA H -3.980 10.086 -4.366 1.00 . A A . 7 SER HA 1 1 4 1998 1 1 7 SER HB2 H -4.137 7.356 -5.393 1.00 . A A . 7 SER HB2 1 1 4 1999 1 1 7 SER HB3 H -4.770 8.027 -3.889 1.00 . A A . 7 SER HB3 1 1 4 2000 1 1 7 SER HG H -6.220 7.240 -5.817 1.00 . A A . 7 SER HG 1 1 4 2001 1 1 7 SER N N -4.796 10.235 -6.252 1.00 . A A . 7 SER N 1 1 4 2002 1 1 7 SER O O -1.636 9.591 -5.085 1.00 . A A . 7 SER O 1 1 4 2003 1 1 7 SER OG O -6.026 8.133 -5.502 1.00 . A A . 7 SER OG 1 1 4 2004 1 1 8 ALA C C -0.438 7.412 -7.027 1.00 . A A . 8 ALA C 1 1 4 2005 1 1 8 ALA CA C -1.224 8.542 -7.685 1.00 . A A . 8 ALA CA 1 1 4 2006 1 1 8 ALA CB C -0.396 9.820 -7.739 1.00 . A A . 8 ALA CB 1 1 4 2007 1 1 8 ALA H H -3.331 8.561 -7.500 1.00 . A A . 8 ALA H 1 1 4 2008 1 1 8 ALA HA H -1.444 8.250 -8.702 1.00 . A A . 8 ALA HA 1 1 4 2009 1 1 8 ALA HB1 H -0.584 10.330 -8.672 1.00 . A A . 8 ALA HB1 1 1 4 2010 1 1 8 ALA HB2 H -0.673 10.463 -6.916 1.00 . A A . 8 ALA HB2 1 1 4 2011 1 1 8 ALA HB3 H 0.653 9.573 -7.669 1.00 . A A . 8 ALA HB3 1 1 4 2012 1 1 8 ALA N N -2.505 8.770 -7.012 1.00 . A A . 8 ALA N 1 1 4 2013 1 1 8 ALA O O 0.015 7.523 -5.886 1.00 . A A . 8 ALA O 1 1 4 2014 1 1 9 ASP C C 1.953 5.373 -7.368 1.00 . A A . 9 ASP C 1 1 4 2015 1 1 9 ASP CA C 0.444 5.160 -7.260 1.00 . A A . 9 ASP CA 1 1 4 2016 1 1 9 ASP CB C 0.020 3.902 -8.030 1.00 . A A . 9 ASP CB 1 1 4 2017 1 1 9 ASP CG C 0.836 2.671 -7.670 1.00 . A A . 9 ASP CG 1 1 4 2018 1 1 9 ASP H H -0.658 6.292 -8.666 1.00 . A A . 9 ASP H 1 1 4 2019 1 1 9 ASP HA H 0.186 5.035 -6.218 1.00 . A A . 9 ASP HA 1 1 4 2020 1 1 9 ASP HB2 H -1.018 3.694 -7.819 1.00 . A A . 9 ASP HB2 1 1 4 2021 1 1 9 ASP HB3 H 0.134 4.087 -9.088 1.00 . A A . 9 ASP HB3 1 1 4 2022 1 1 9 ASP N N -0.279 6.319 -7.759 1.00 . A A . 9 ASP N 1 1 4 2023 1 1 9 ASP O O 2.605 4.900 -8.301 1.00 . A A . 9 ASP O 1 1 4 2024 1 1 9 ASP OD1 O 1.277 2.547 -6.506 1.00 . A A . 9 ASP OD1 1 1 4 2025 1 1 9 ASP OD2 O 1.036 1.814 -8.561 1.00 . A A . 9 ASP OD2 1 1 4 2026 1 1 10 LEU C C 4.528 5.279 -5.289 1.00 . A A . 10 LEU C 1 1 4 2027 1 1 10 LEU CA C 3.951 6.259 -6.304 1.00 . A A . 10 LEU CA 1 1 4 2028 1 1 10 LEU CB C 4.294 7.704 -5.920 1.00 . A A . 10 LEU CB 1 1 4 2029 1 1 10 LEU CD1 C 4.494 8.661 -3.610 1.00 . A A . 10 LEU CD1 1 1 4 2030 1 1 10 LEU CD2 C 2.685 9.455 -5.139 1.00 . A A . 10 LEU CD2 1 1 4 2031 1 1 10 LEU CG C 3.530 8.264 -4.718 1.00 . A A . 10 LEU CG 1 1 4 2032 1 1 10 LEU H H 1.937 6.408 -5.663 1.00 . A A . 10 LEU H 1 1 4 2033 1 1 10 LEU HA H 4.371 6.042 -7.276 1.00 . A A . 10 LEU HA 1 1 4 2034 1 1 10 LEU HB2 H 5.351 7.754 -5.701 1.00 . A A . 10 LEU HB2 1 1 4 2035 1 1 10 LEU HB3 H 4.091 8.336 -6.771 1.00 . A A . 10 LEU HB3 1 1 4 2036 1 1 10 LEU HD11 H 5.372 9.114 -4.043 1.00 . A A . 10 LEU HD11 1 1 4 2037 1 1 10 LEU HD12 H 4.012 9.365 -2.950 1.00 . A A . 10 LEU HD12 1 1 4 2038 1 1 10 LEU HD13 H 4.781 7.782 -3.052 1.00 . A A . 10 LEU HD13 1 1 4 2039 1 1 10 LEU HD21 H 3.249 10.364 -4.999 1.00 . A A . 10 LEU HD21 1 1 4 2040 1 1 10 LEU HD22 H 2.416 9.354 -6.181 1.00 . A A . 10 LEU HD22 1 1 4 2041 1 1 10 LEU HD23 H 1.788 9.490 -4.537 1.00 . A A . 10 LEU HD23 1 1 4 2042 1 1 10 LEU HG H 2.870 7.502 -4.332 1.00 . A A . 10 LEU HG 1 1 4 2043 1 1 10 LEU N N 2.510 6.067 -6.386 1.00 . A A . 10 LEU N 1 1 4 2044 1 1 10 LEU O O 5.653 5.445 -4.809 1.00 . A A . 10 LEU O 1 1 4 2045 1 1 11 LYS C C 4.107 3.694 -2.619 1.00 . A A . 11 LYS C 1 1 4 2046 1 1 11 LYS CA C 4.073 3.193 -4.062 1.00 . A A . 11 LYS CA 1 1 4 2047 1 1 11 LYS CB C 5.380 2.510 -4.447 1.00 . A A . 11 LYS CB 1 1 4 2048 1 1 11 LYS CD C 4.167 0.357 -4.903 1.00 . A A . 11 LYS CD 1 1 4 2049 1 1 11 LYS CE C 3.619 -0.526 -6.013 1.00 . A A . 11 LYS CE 1 1 4 2050 1 1 11 LYS CG C 5.170 1.374 -5.434 1.00 . A A . 11 LYS CG 1 1 4 2051 1 1 11 LYS H H 2.876 4.185 -5.471 1.00 . A A . 11 LYS H 1 1 4 2052 1 1 11 LYS HA H 3.283 2.458 -4.129 1.00 . A A . 11 LYS HA 1 1 4 2053 1 1 11 LYS HB2 H 6.038 3.239 -4.897 1.00 . A A . 11 LYS HB2 1 1 4 2054 1 1 11 LYS HB3 H 5.846 2.111 -3.559 1.00 . A A . 11 LYS HB3 1 1 4 2055 1 1 11 LYS HD2 H 4.655 -0.267 -4.170 1.00 . A A . 11 LYS HD2 1 1 4 2056 1 1 11 LYS HD3 H 3.347 0.887 -4.439 1.00 . A A . 11 LYS HD3 1 1 4 2057 1 1 11 LYS HE2 H 4.443 -0.873 -6.619 1.00 . A A . 11 LYS HE2 1 1 4 2058 1 1 11 LYS HE3 H 3.121 -1.374 -5.566 1.00 . A A . 11 LYS HE3 1 1 4 2059 1 1 11 LYS HG2 H 4.798 1.780 -6.363 1.00 . A A . 11 LYS HG2 1 1 4 2060 1 1 11 LYS HG3 H 6.111 0.885 -5.605 1.00 . A A . 11 LYS HG3 1 1 4 2061 1 1 11 LYS HZ1 H 3.101 0.440 -7.793 1.00 . A A . 11 LYS HZ1 1 1 4 2062 1 1 11 LYS HZ2 H 2.328 1.079 -6.426 1.00 . A A . 11 LYS HZ2 1 1 4 2063 1 1 11 LYS HZ3 H 1.821 -0.401 -7.073 1.00 . A A . 11 LYS HZ3 1 1 4 2064 1 1 11 LYS N N 3.732 4.250 -5.003 1.00 . A A . 11 LYS N 1 1 4 2065 1 1 11 LYS NZ N 2.651 0.197 -6.884 1.00 . A A . 11 LYS NZ 1 1 4 2066 1 1 11 LYS O O 4.375 4.866 -2.345 1.00 . A A . 11 LYS O 1 1 4 2067 1 1 12 CYS C C 4.442 2.561 0.548 1.00 . A A . 12 CYS C 1 1 4 2068 1 1 12 CYS CA C 3.372 3.191 -0.358 1.00 . A A . 12 CYS CA 1 1 4 2069 1 1 12 CYS CB C 1.985 2.655 -0.055 1.00 . A A . 12 CYS CB 1 1 4 2070 1 1 12 CYS H H 3.251 1.990 -2.067 1.00 . A A . 12 CYS H 1 1 4 2071 1 1 12 CYS HA H 3.382 4.264 -0.255 1.00 . A A . 12 CYS HA 1 1 4 2072 1 1 12 CYS HB2 H 1.938 2.314 0.969 1.00 . A A . 12 CYS HB2 1 1 4 2073 1 1 12 CYS HB3 H 1.257 3.436 -0.208 1.00 . A A . 12 CYS HB3 1 1 4 2074 1 1 12 CYS N N 3.616 2.845 -1.741 1.00 . A A . 12 CYS N 1 1 4 2075 1 1 12 CYS O O 5.422 2.007 0.043 1.00 . A A . 12 CYS O 1 1 4 2076 1 1 12 CYS SG S 1.555 1.267 -1.146 1.00 . A A . 12 CYS SG 1 1 4 2077 1 1 13 PRO C C 5.445 0.566 2.648 1.00 . A A . 13 PRO C 1 1 4 2078 1 1 13 PRO CA C 5.273 2.074 2.831 1.00 . A A . 13 PRO CA 1 1 4 2079 1 1 13 PRO CB C 4.666 2.362 4.207 1.00 . A A . 13 PRO CB 1 1 4 2080 1 1 13 PRO CD C 3.220 3.366 2.605 1.00 . A A . 13 PRO CD 1 1 4 2081 1 1 13 PRO CG C 3.756 3.518 3.995 1.00 . A A . 13 PRO CG 1 1 4 2082 1 1 13 PRO HA H 6.236 2.558 2.752 1.00 . A A . 13 PRO HA 1 1 4 2083 1 1 13 PRO HB2 H 4.125 1.493 4.552 1.00 . A A . 13 PRO HB2 1 1 4 2084 1 1 13 PRO HB3 H 5.448 2.603 4.905 1.00 . A A . 13 PRO HB3 1 1 4 2085 1 1 13 PRO HD2 H 2.312 2.779 2.612 1.00 . A A . 13 PRO HD2 1 1 4 2086 1 1 13 PRO HD3 H 3.041 4.334 2.161 1.00 . A A . 13 PRO HD3 1 1 4 2087 1 1 13 PRO HG2 H 2.950 3.487 4.713 1.00 . A A . 13 PRO HG2 1 1 4 2088 1 1 13 PRO HG3 H 4.307 4.443 4.085 1.00 . A A . 13 PRO HG3 1 1 4 2089 1 1 13 PRO N N 4.300 2.654 1.892 1.00 . A A . 13 PRO N 1 1 4 2090 1 1 13 PRO O O 6.475 -0.001 3.013 1.00 . A A . 13 PRO O 1 1 4 2091 1 1 14 THR C C 4.906 -1.922 0.563 1.00 . A A . 14 THR C 1 1 4 2092 1 1 14 THR CA C 4.422 -1.525 1.957 1.00 . A A . 14 THR CA 1 1 4 2093 1 1 14 THR CB C 3.020 -2.113 2.191 1.00 . A A . 14 THR CB 1 1 4 2094 1 1 14 THR CG2 C 3.105 -3.593 2.526 1.00 . A A . 14 THR CG2 1 1 4 2095 1 1 14 THR H H 3.604 0.419 1.901 1.00 . A A . 14 THR H 1 1 4 2096 1 1 14 THR HA H 5.092 -1.946 2.692 1.00 . A A . 14 THR HA 1 1 4 2097 1 1 14 THR HB H 2.439 -1.995 1.289 1.00 . A A . 14 THR HB 1 1 4 2098 1 1 14 THR HG1 H 1.559 -0.992 2.928 1.00 . A A . 14 THR HG1 1 1 4 2099 1 1 14 THR HG21 H 3.179 -3.716 3.595 1.00 . A A . 14 THR HG21 1 1 4 2100 1 1 14 THR HG22 H 3.979 -4.019 2.054 1.00 . A A . 14 THR HG22 1 1 4 2101 1 1 14 THR HG23 H 2.220 -4.095 2.165 1.00 . A A . 14 THR HG23 1 1 4 2102 1 1 14 THR N N 4.412 -0.082 2.133 1.00 . A A . 14 THR N 1 1 4 2103 1 1 14 THR O O 4.242 -1.659 -0.437 1.00 . A A . 14 THR O 1 1 4 2104 1 1 14 THR OG1 O 2.375 -1.411 3.262 1.00 . A A . 14 THR OG1 1 1 4 2105 1 1 15 PRO C C 5.894 -4.102 -1.453 1.00 . A A . 15 PRO C 1 1 4 2106 1 1 15 PRO CA C 6.680 -2.964 -0.804 1.00 . A A . 15 PRO CA 1 1 4 2107 1 1 15 PRO CB C 8.087 -3.438 -0.419 1.00 . A A . 15 PRO CB 1 1 4 2108 1 1 15 PRO CD C 7.004 -2.809 1.597 1.00 . A A . 15 PRO CD 1 1 4 2109 1 1 15 PRO CG C 8.338 -2.836 0.917 1.00 . A A . 15 PRO CG 1 1 4 2110 1 1 15 PRO HA H 6.756 -2.140 -1.497 1.00 . A A . 15 PRO HA 1 1 4 2111 1 1 15 PRO HB2 H 8.108 -4.518 -0.378 1.00 . A A . 15 PRO HB2 1 1 4 2112 1 1 15 PRO HB3 H 8.799 -3.087 -1.147 1.00 . A A . 15 PRO HB3 1 1 4 2113 1 1 15 PRO HD2 H 6.788 -3.764 2.054 1.00 . A A . 15 PRO HD2 1 1 4 2114 1 1 15 PRO HD3 H 6.964 -2.016 2.329 1.00 . A A . 15 PRO HD3 1 1 4 2115 1 1 15 PRO HG2 H 9.034 -3.445 1.471 1.00 . A A . 15 PRO HG2 1 1 4 2116 1 1 15 PRO HG3 H 8.720 -1.833 0.800 1.00 . A A . 15 PRO HG3 1 1 4 2117 1 1 15 PRO N N 6.096 -2.538 0.475 1.00 . A A . 15 PRO N 1 1 4 2118 1 1 15 PRO O O 5.859 -4.225 -2.677 1.00 . A A . 15 PRO O 1 1 4 2119 1 1 16 GLY C C 3.105 -5.666 -1.549 1.00 . A A . 16 GLY C 1 1 4 2120 1 1 16 GLY CA C 4.510 -6.063 -1.134 1.00 . A A . 16 GLY CA 1 1 4 2121 1 1 16 GLY H H 5.361 -4.811 0.340 1.00 . A A . 16 GLY H 1 1 4 2122 1 1 16 GLY HA2 H 5.024 -6.471 -1.987 1.00 . A A . 16 GLY HA2 1 1 4 2123 1 1 16 GLY HA3 H 4.447 -6.821 -0.368 1.00 . A A . 16 GLY HA3 1 1 4 2124 1 1 16 GLY N N 5.274 -4.941 -0.626 1.00 . A A . 16 GLY N 1 1 4 2125 1 1 16 GLY O O 2.324 -6.493 -2.021 1.00 . A A . 16 GLY O 1 1 4 2126 1 1 17 CYS C C 1.520 -3.513 -3.276 1.00 . A A . 17 CYS C 1 1 4 2127 1 1 17 CYS CA C 1.516 -3.849 -1.789 1.00 . A A . 17 CYS CA 1 1 4 2128 1 1 17 CYS CB C 1.236 -2.607 -0.948 1.00 . A A . 17 CYS CB 1 1 4 2129 1 1 17 CYS H H 3.483 -3.777 -1.051 1.00 . A A . 17 CYS H 1 1 4 2130 1 1 17 CYS HA H 0.761 -4.595 -1.593 1.00 . A A . 17 CYS HA 1 1 4 2131 1 1 17 CYS HB2 H 1.352 -2.863 0.094 1.00 . A A . 17 CYS HB2 1 1 4 2132 1 1 17 CYS HB3 H 1.960 -1.848 -1.203 1.00 . A A . 17 CYS HB3 1 1 4 2133 1 1 17 CYS N N 2.802 -4.388 -1.400 1.00 . A A . 17 CYS N 1 1 4 2134 1 1 17 CYS O O 2.572 -3.509 -3.921 1.00 . A A . 17 CYS O 1 1 4 2135 1 1 17 CYS SG S -0.416 -1.871 -1.139 1.00 . A A . 17 CYS SG 1 1 4 2136 1 1 18 ASP C C -0.061 -1.422 -5.409 1.00 . A A . 18 ASP C 1 1 4 2137 1 1 18 ASP CA C 0.230 -2.906 -5.230 1.00 . A A . 18 ASP CA 1 1 4 2138 1 1 18 ASP CB C -0.851 -3.759 -5.901 1.00 . A A . 18 ASP CB 1 1 4 2139 1 1 18 ASP CG C -2.221 -3.112 -5.890 1.00 . A A . 18 ASP CG 1 1 4 2140 1 1 18 ASP H H -0.455 -3.232 -3.251 1.00 . A A . 18 ASP H 1 1 4 2141 1 1 18 ASP HA H 1.182 -3.124 -5.694 1.00 . A A . 18 ASP HA 1 1 4 2142 1 1 18 ASP HB2 H -0.571 -3.932 -6.929 1.00 . A A . 18 ASP HB2 1 1 4 2143 1 1 18 ASP HB3 H -0.918 -4.708 -5.388 1.00 . A A . 18 ASP HB3 1 1 4 2144 1 1 18 ASP N N 0.348 -3.235 -3.819 1.00 . A A . 18 ASP N 1 1 4 2145 1 1 18 ASP O O 0.080 -0.880 -6.506 1.00 . A A . 18 ASP O 1 1 4 2146 1 1 18 ASP OD1 O -2.851 -3.057 -4.815 1.00 . A A . 18 ASP OD1 1 1 4 2147 1 1 18 ASP OD2 O -2.685 -2.682 -6.972 1.00 . A A . 18 ASP OD2 1 1 4 2148 1 1 19 GLY C C -1.915 1.112 -4.855 1.00 . A A . 19 GLY C 1 1 4 2149 1 1 19 GLY CA C -0.550 0.694 -4.336 1.00 . A A . 19 GLY CA 1 1 4 2150 1 1 19 GLY H H -0.371 -1.223 -3.442 1.00 . A A . 19 GLY H 1 1 4 2151 1 1 19 GLY HA2 H -0.429 1.080 -3.336 1.00 . A A . 19 GLY HA2 1 1 4 2152 1 1 19 GLY HA3 H 0.210 1.127 -4.970 1.00 . A A . 19 GLY HA3 1 1 4 2153 1 1 19 GLY N N -0.362 -0.748 -4.305 1.00 . A A . 19 GLY N 1 1 4 2154 1 1 19 GLY O O -2.566 1.987 -4.280 1.00 . A A . 19 GLY O 1 1 4 2155 1 1 20 SER C C -4.740 -0.060 -6.047 1.00 . A A . 20 SER C 1 1 4 2156 1 1 20 SER CA C -3.628 0.860 -6.545 1.00 . A A . 20 SER CA 1 1 4 2157 1 1 20 SER CB C -3.531 0.816 -8.068 1.00 . A A . 20 SER CB 1 1 4 2158 1 1 20 SER H H -1.792 -0.181 -6.376 1.00 . A A . 20 SER H 1 1 4 2159 1 1 20 SER HA H -3.860 1.869 -6.236 1.00 . A A . 20 SER HA 1 1 4 2160 1 1 20 SER HB2 H -4.029 -0.069 -8.436 1.00 . A A . 20 SER HB2 1 1 4 2161 1 1 20 SER HB3 H -4.006 1.693 -8.484 1.00 . A A . 20 SER HB3 1 1 4 2162 1 1 20 SER HG H -1.622 1.188 -7.811 1.00 . A A . 20 SER HG 1 1 4 2163 1 1 20 SER N N -2.349 0.510 -5.951 1.00 . A A . 20 SER N 1 1 4 2164 1 1 20 SER O O -5.392 -0.762 -6.827 1.00 . A A . 20 SER O 1 1 4 2165 1 1 20 SER OG O -2.177 0.786 -8.491 1.00 . A A . 20 SER OG 1 1 4 2166 1 1 21 GLY C C -6.366 -0.302 -2.752 1.00 . A A . 21 GLY C 1 1 4 2167 1 1 21 GLY CA C -6.079 -0.746 -4.167 1.00 . A A . 21 GLY CA 1 1 4 2168 1 1 21 GLY H H -4.495 0.649 -4.203 1.00 . A A . 21 GLY H 1 1 4 2169 1 1 21 GLY HA2 H -6.971 -0.622 -4.764 1.00 . A A . 21 GLY HA2 1 1 4 2170 1 1 21 GLY HA3 H -5.805 -1.791 -4.156 1.00 . A A . 21 GLY HA3 1 1 4 2171 1 1 21 GLY N N -5.005 0.020 -4.756 1.00 . A A . 21 GLY N 1 1 4 2172 1 1 21 GLY O O -5.815 0.691 -2.295 1.00 . A A . 21 GLY O 1 1 4 2173 1 1 22 HIS C C -8.053 -2.088 -0.018 1.00 . A A . 22 HIS C 1 1 4 2174 1 1 22 HIS CA C -7.511 -0.821 -0.647 1.00 . A A . 22 HIS CA 1 1 4 2175 1 1 22 HIS CB C -8.561 0.292 -0.477 1.00 . A A . 22 HIS CB 1 1 4 2176 1 1 22 HIS CD2 C -7.472 2.604 -1.007 1.00 . A A . 22 HIS CD2 1 1 4 2177 1 1 22 HIS CE1 C -7.547 3.444 1.014 1.00 . A A . 22 HIS CE1 1 1 4 2178 1 1 22 HIS CG C -8.009 1.662 -0.195 1.00 . A A . 22 HIS CG 1 1 4 2179 1 1 22 HIS H H -7.552 -1.877 -2.483 1.00 . A A . 22 HIS H 1 1 4 2180 1 1 22 HIS HA H -6.601 -0.537 -0.139 1.00 . A A . 22 HIS HA 1 1 4 2181 1 1 22 HIS HB2 H -9.152 0.360 -1.378 1.00 . A A . 22 HIS HB2 1 1 4 2182 1 1 22 HIS HB3 H -9.212 0.028 0.345 1.00 . A A . 22 HIS HB3 1 1 4 2183 1 1 22 HIS HD1 H -8.365 1.780 1.883 1.00 . A A . 22 HIS HD1 1 1 4 2184 1 1 22 HIS HD2 H -7.303 2.511 -2.071 1.00 . A A . 22 HIS HD2 1 1 4 2185 1 1 22 HIS HE1 H -7.468 4.124 1.850 1.00 . A A . 22 HIS HE1 1 1 4 2186 1 1 22 HIS HE2 H -6.931 4.597 -0.566 1.00 . A A . 22 HIS HE2 1 1 4 2187 1 1 22 HIS N N -7.185 -1.067 -2.053 1.00 . A A . 22 HIS N 1 1 4 2188 1 1 22 HIS ND1 N -8.036 2.222 1.064 1.00 . A A . 22 HIS ND1 1 1 4 2189 1 1 22 HIS NE2 N -7.195 3.702 -0.227 1.00 . A A . 22 HIS NE2 1 1 4 2190 1 1 22 HIS O O -8.803 -2.823 -0.655 1.00 . A A . 22 HIS O 1 1 4 2191 1 1 23 ILE C C -9.844 -3.229 2.163 1.00 . A A . 23 ILE C 1 1 4 2192 1 1 23 ILE CA C -8.338 -3.425 1.979 1.00 . A A . 23 ILE CA 1 1 4 2193 1 1 23 ILE CB C -7.628 -3.654 3.342 1.00 . A A . 23 ILE CB 1 1 4 2194 1 1 23 ILE CD1 C -7.643 -6.136 2.707 1.00 . A A . 23 ILE CD1 1 1 4 2195 1 1 23 ILE CG1 C -6.871 -4.986 3.326 1.00 . A A . 23 ILE CG1 1 1 4 2196 1 1 23 ILE CG2 C -8.604 -3.613 4.515 1.00 . A A . 23 ILE CG2 1 1 4 2197 1 1 23 ILE H H -7.231 -1.633 1.750 1.00 . A A . 23 ILE H 1 1 4 2198 1 1 23 ILE HA H -8.179 -4.303 1.367 1.00 . A A . 23 ILE HA 1 1 4 2199 1 1 23 ILE HB H -6.917 -2.855 3.481 1.00 . A A . 23 ILE HB 1 1 4 2200 1 1 23 ILE HD11 H -8.624 -5.796 2.412 1.00 . A A . 23 ILE HD11 1 1 4 2201 1 1 23 ILE HD12 H -7.113 -6.498 1.837 1.00 . A A . 23 ILE HD12 1 1 4 2202 1 1 23 ILE HD13 H -7.738 -6.936 3.427 1.00 . A A . 23 ILE HD13 1 1 4 2203 1 1 23 ILE HG12 H -5.956 -4.864 2.766 1.00 . A A . 23 ILE HG12 1 1 4 2204 1 1 23 ILE HG13 H -6.627 -5.262 4.342 1.00 . A A . 23 ILE HG13 1 1 4 2205 1 1 23 ILE HG21 H -8.074 -3.334 5.415 1.00 . A A . 23 ILE HG21 1 1 4 2206 1 1 23 ILE HG22 H -9.378 -2.887 4.314 1.00 . A A . 23 ILE HG22 1 1 4 2207 1 1 23 ILE HG23 H -9.050 -4.589 4.647 1.00 . A A . 23 ILE HG23 1 1 4 2208 1 1 23 ILE N N -7.774 -2.290 1.261 1.00 . A A . 23 ILE N 1 1 4 2209 1 1 23 ILE O O -10.618 -4.184 2.096 1.00 . A A . 23 ILE O 1 1 4 2210 1 1 24 THR C C -12.347 -1.781 1.008 1.00 . A A . 24 THR C 1 1 4 2211 1 1 24 THR CA C -11.668 -1.638 2.373 1.00 . A A . 24 THR CA 1 1 4 2212 1 1 24 THR CB C -11.874 -0.204 2.923 1.00 . A A . 24 THR CB 1 1 4 2213 1 1 24 THR CG2 C -11.423 0.849 1.920 1.00 . A A . 24 THR CG2 1 1 4 2214 1 1 24 THR H H -9.591 -1.247 2.270 1.00 . A A . 24 THR H 1 1 4 2215 1 1 24 THR HA H -12.126 -2.331 3.062 1.00 . A A . 24 THR HA 1 1 4 2216 1 1 24 THR HB H -11.281 -0.095 3.822 1.00 . A A . 24 THR HB 1 1 4 2217 1 1 24 THR HG1 H -13.363 -0.045 4.210 1.00 . A A . 24 THR HG1 1 1 4 2218 1 1 24 THR HG21 H -10.525 1.330 2.280 1.00 . A A . 24 THR HG21 1 1 4 2219 1 1 24 THR HG22 H -12.203 1.587 1.802 1.00 . A A . 24 THR HG22 1 1 4 2220 1 1 24 THR HG23 H -11.226 0.380 0.969 1.00 . A A . 24 THR HG23 1 1 4 2221 1 1 24 THR N N -10.255 -1.971 2.278 1.00 . A A . 24 THR N 1 1 4 2222 1 1 24 THR O O -13.554 -2.001 0.922 1.00 . A A . 24 THR O 1 1 4 2223 1 1 24 THR OG1 O -13.249 0.007 3.249 1.00 . A A . 24 THR OG1 1 1 4 2224 1 1 25 GLY C C -12.984 -0.775 -1.845 1.00 . A A . 25 GLY C 1 1 4 2225 1 1 25 GLY CA C -12.065 -1.903 -1.405 1.00 . A A . 25 GLY CA 1 1 4 2226 1 1 25 GLY H H -10.583 -1.625 0.079 1.00 . A A . 25 GLY H 1 1 4 2227 1 1 25 GLY HA2 H -11.234 -1.960 -2.093 1.00 . A A . 25 GLY HA2 1 1 4 2228 1 1 25 GLY HA3 H -12.613 -2.832 -1.442 1.00 . A A . 25 GLY HA3 1 1 4 2229 1 1 25 GLY N N -11.547 -1.721 -0.057 1.00 . A A . 25 GLY N 1 1 4 2230 1 1 25 GLY O O -13.656 -0.879 -2.868 1.00 . A A . 25 GLY O 1 1 4 2231 1 1 26 ASN C C -13.338 2.487 -2.053 1.00 . A A . 26 ASN C 1 1 4 2232 1 1 26 ASN CA C -14.002 1.363 -1.272 1.00 . A A . 26 ASN CA 1 1 4 2233 1 1 26 ASN CB C -14.531 1.906 0.058 1.00 . A A . 26 ASN CB 1 1 4 2234 1 1 26 ASN CG C -15.728 1.128 0.562 1.00 . A A . 26 ASN CG 1 1 4 2235 1 1 26 ASN H H -12.579 0.243 -0.183 1.00 . A A . 26 ASN H 1 1 4 2236 1 1 26 ASN HA H -14.830 0.980 -1.848 1.00 . A A . 26 ASN HA 1 1 4 2237 1 1 26 ASN HB2 H -13.748 1.847 0.801 1.00 . A A . 26 ASN HB2 1 1 4 2238 1 1 26 ASN HB3 H -14.820 2.939 -0.070 1.00 . A A . 26 ASN HB3 1 1 4 2239 1 1 26 ASN HD21 H -14.687 0.494 2.137 1.00 . A A . 26 ASN HD21 1 1 4 2240 1 1 26 ASN HD22 H -16.317 -0.075 2.024 1.00 . A A . 26 ASN HD22 1 1 4 2241 1 1 26 ASN N N -13.075 0.263 -1.024 1.00 . A A . 26 ASN N 1 1 4 2242 1 1 26 ASN ND2 N -15.565 0.454 1.688 1.00 . A A . 26 ASN ND2 1 1 4 2243 1 1 26 ASN O O -13.939 3.536 -2.282 1.00 . A A . 26 ASN O 1 1 4 2244 1 1 26 ASN OD1 O -16.794 1.134 -0.055 1.00 . A A . 26 ASN OD1 1 1 4 2245 1 1 27 TYR C C -10.645 2.758 -4.334 1.00 . A A . 27 TYR C 1 1 4 2246 1 1 27 TYR CA C -11.314 3.322 -3.086 1.00 . A A . 27 TYR CA 1 1 4 2247 1 1 27 TYR CB C -10.258 3.890 -2.145 1.00 . A A . 27 TYR CB 1 1 4 2248 1 1 27 TYR CD1 C -11.304 4.064 0.147 1.00 . A A . 27 TYR CD1 1 1 4 2249 1 1 27 TYR CD2 C -10.863 6.079 -1.047 1.00 . A A . 27 TYR CD2 1 1 4 2250 1 1 27 TYR CE1 C -11.813 4.794 1.200 1.00 . A A . 27 TYR CE1 1 1 4 2251 1 1 27 TYR CE2 C -11.371 6.816 0.004 1.00 . A A . 27 TYR CE2 1 1 4 2252 1 1 27 TYR CG C -10.820 4.693 -0.994 1.00 . A A . 27 TYR CG 1 1 4 2253 1 1 27 TYR CZ C -11.845 6.167 1.125 1.00 . A A . 27 TYR CZ 1 1 4 2254 1 1 27 TYR H H -11.632 1.460 -2.162 1.00 . A A . 27 TYR H 1 1 4 2255 1 1 27 TYR HA H -11.994 4.109 -3.374 1.00 . A A . 27 TYR HA 1 1 4 2256 1 1 27 TYR HB2 H -9.688 3.072 -1.727 1.00 . A A . 27 TYR HB2 1 1 4 2257 1 1 27 TYR HB3 H -9.597 4.525 -2.706 1.00 . A A . 27 TYR HB3 1 1 4 2258 1 1 27 TYR HD1 H -11.280 2.984 0.204 1.00 . A A . 27 TYR HD1 1 1 4 2259 1 1 27 TYR HD2 H -10.492 6.583 -1.929 1.00 . A A . 27 TYR HD2 1 1 4 2260 1 1 27 TYR HE1 H -12.184 4.288 2.078 1.00 . A A . 27 TYR HE1 1 1 4 2261 1 1 27 TYR HE2 H -11.397 7.895 -0.054 1.00 . A A . 27 TYR HE2 1 1 4 2262 1 1 27 TYR HH H -12.108 7.831 2.064 1.00 . A A . 27 TYR HH 1 1 4 2263 1 1 27 TYR N N -12.074 2.295 -2.402 1.00 . A A . 27 TYR N 1 1 4 2264 1 1 27 TYR O O -10.984 1.661 -4.788 1.00 . A A . 27 TYR O 1 1 4 2265 1 1 27 TYR OH O -12.343 6.896 2.181 1.00 . A A . 27 TYR OH 1 1 4 2266 1 1 28 ALA C C -7.465 2.938 -5.769 1.00 . A A . 28 ALA C 1 1 4 2267 1 1 28 ALA CA C -8.959 3.062 -6.052 1.00 . A A . 28 ALA CA 1 1 4 2268 1 1 28 ALA CB C -9.203 4.029 -7.200 1.00 . A A . 28 ALA CB 1 1 4 2269 1 1 28 ALA H H -9.448 4.358 -4.454 1.00 . A A . 28 ALA H 1 1 4 2270 1 1 28 ALA HA H -9.342 2.095 -6.340 1.00 . A A . 28 ALA HA 1 1 4 2271 1 1 28 ALA HB1 H -8.968 5.033 -6.880 1.00 . A A . 28 ALA HB1 1 1 4 2272 1 1 28 ALA HB2 H -8.574 3.760 -8.037 1.00 . A A . 28 ALA HB2 1 1 4 2273 1 1 28 ALA HB3 H -10.239 3.979 -7.498 1.00 . A A . 28 ALA HB3 1 1 4 2274 1 1 28 ALA N N -9.683 3.494 -4.869 1.00 . A A . 28 ALA N 1 1 4 2275 1 1 28 ALA O O -6.801 2.053 -6.301 1.00 . A A . 28 ALA O 1 1 4 2276 1 1 29 SER C C -5.264 4.582 -3.318 1.00 . A A . 29 SER C 1 1 4 2277 1 1 29 SER CA C -5.508 3.864 -4.647 1.00 . A A . 29 SER CA 1 1 4 2278 1 1 29 SER CB C -4.718 4.543 -5.774 1.00 . A A . 29 SER CB 1 1 4 2279 1 1 29 SER H H -7.507 4.564 -4.594 1.00 . A A . 29 SER H 1 1 4 2280 1 1 29 SER HA H -5.181 2.839 -4.556 1.00 . A A . 29 SER HA 1 1 4 2281 1 1 29 SER HB2 H -3.961 5.182 -5.346 1.00 . A A . 29 SER HB2 1 1 4 2282 1 1 29 SER HB3 H -4.246 3.787 -6.384 1.00 . A A . 29 SER HB3 1 1 4 2283 1 1 29 SER HG H -5.914 4.777 -7.320 1.00 . A A . 29 SER HG 1 1 4 2284 1 1 29 SER N N -6.932 3.854 -4.966 1.00 . A A . 29 SER N 1 1 4 2285 1 1 29 SER O O -6.207 5.040 -2.676 1.00 . A A . 29 SER O 1 1 4 2286 1 1 29 SER OG O -5.569 5.329 -6.598 1.00 . A A . 29 SER OG 1 1 4 2287 1 1 30 HIS C C -2.186 5.727 -1.679 1.00 . A A . 30 HIS C 1 1 4 2288 1 1 30 HIS CA C -3.646 5.280 -1.632 1.00 . A A . 30 HIS CA 1 1 4 2289 1 1 30 HIS CB C -3.867 4.326 -0.454 1.00 . A A . 30 HIS CB 1 1 4 2290 1 1 30 HIS CD2 C -2.006 2.557 -0.153 1.00 . A A . 30 HIS CD2 1 1 4 2291 1 1 30 HIS CE1 C -2.839 0.951 -1.343 1.00 . A A . 30 HIS CE1 1 1 4 2292 1 1 30 HIS CG C -3.200 2.998 -0.622 1.00 . A A . 30 HIS CG 1 1 4 2293 1 1 30 HIS H H -3.296 4.226 -3.424 1.00 . A A . 30 HIS H 1 1 4 2294 1 1 30 HIS HA H -4.274 6.149 -1.510 1.00 . A A . 30 HIS HA 1 1 4 2295 1 1 30 HIS HB2 H -3.473 4.780 0.438 1.00 . A A . 30 HIS HB2 1 1 4 2296 1 1 30 HIS HB3 H -4.925 4.154 -0.328 1.00 . A A . 30 HIS HB3 1 1 4 2297 1 1 30 HIS HD1 H -4.583 1.956 -1.841 1.00 . A A . 30 HIS HD1 1 1 4 2298 1 1 30 HIS HD2 H -1.319 3.110 0.471 1.00 . A A . 30 HIS HD2 1 1 4 2299 1 1 30 HIS HE1 H -2.960 0.012 -1.867 1.00 . A A . 30 HIS HE1 1 1 4 2300 1 1 30 HIS N N -4.007 4.637 -2.888 1.00 . A A . 30 HIS N 1 1 4 2301 1 1 30 HIS ND1 N -3.719 1.961 -1.375 1.00 . A A . 30 HIS ND1 1 1 4 2302 1 1 30 HIS NE2 N -1.804 1.274 -0.619 1.00 . A A . 30 HIS NE2 1 1 4 2303 1 1 30 HIS O O -1.606 5.839 -2.757 1.00 . A A . 30 HIS O 1 1 4 2304 1 1 31 ARG C C 0.418 5.950 0.916 1.00 . A A . 31 ARG C 1 1 4 2305 1 1 31 ARG CA C -0.195 6.357 -0.422 1.00 . A A . 31 ARG CA 1 1 4 2306 1 1 31 ARG CB C -0.080 7.869 -0.600 1.00 . A A . 31 ARG CB 1 1 4 2307 1 1 31 ARG CD C 0.807 9.785 -1.950 1.00 . A A . 31 ARG CD 1 1 4 2308 1 1 31 ARG CG C 0.623 8.279 -1.881 1.00 . A A . 31 ARG CG 1 1 4 2309 1 1 31 ARG CZ C -0.704 11.582 -2.713 1.00 . A A . 31 ARG CZ 1 1 4 2310 1 1 31 ARG H H -2.102 5.814 0.319 1.00 . A A . 31 ARG H 1 1 4 2311 1 1 31 ARG HA H 0.345 5.866 -1.217 1.00 . A A . 31 ARG HA 1 1 4 2312 1 1 31 ARG HB2 H -1.071 8.297 -0.607 1.00 . A A . 31 ARG HB2 1 1 4 2313 1 1 31 ARG HB3 H 0.472 8.277 0.234 1.00 . A A . 31 ARG HB3 1 1 4 2314 1 1 31 ARG HD2 H 0.623 10.204 -0.971 1.00 . A A . 31 ARG HD2 1 1 4 2315 1 1 31 ARG HD3 H 1.823 9.997 -2.247 1.00 . A A . 31 ARG HD3 1 1 4 2316 1 1 31 ARG HE H -0.270 9.925 -3.755 1.00 . A A . 31 ARG HE 1 1 4 2317 1 1 31 ARG HG2 H 1.592 7.805 -1.916 1.00 . A A . 31 ARG HG2 1 1 4 2318 1 1 31 ARG HG3 H 0.030 7.957 -2.725 1.00 . A A . 31 ARG HG3 1 1 4 2319 1 1 31 ARG HH11 H -0.021 11.817 -0.816 1.00 . A A . 31 ARG HH11 1 1 4 2320 1 1 31 ARG HH12 H -1.012 13.109 -1.418 1.00 . A A . 31 ARG HH12 1 1 4 2321 1 1 31 ARG HH21 H -1.595 11.615 -4.533 1.00 . A A . 31 ARG HH21 1 1 4 2322 1 1 31 ARG HH22 H -1.906 13.002 -3.527 1.00 . A A . 31 ARG HH22 1 1 4 2323 1 1 31 ARG N N -1.591 5.944 -0.508 1.00 . A A . 31 ARG N 1 1 4 2324 1 1 31 ARG NE N -0.106 10.406 -2.909 1.00 . A A . 31 ARG NE 1 1 4 2325 1 1 31 ARG NH1 N -0.569 12.222 -1.558 1.00 . A A . 31 ARG NH1 1 1 4 2326 1 1 31 ARG NH2 N -1.465 12.105 -3.666 1.00 . A A . 31 ARG NH2 1 1 4 2327 1 1 31 ARG O O 1.639 5.977 1.087 1.00 . A A . 31 ARG O 1 1 4 2328 1 1 32 SER C C -0.519 3.886 3.602 1.00 . A A . 32 SER C 1 1 4 2329 1 1 32 SER CA C 0.023 5.259 3.212 1.00 . A A . 32 SER CA 1 1 4 2330 1 1 32 SER CB C -0.430 6.319 4.218 1.00 . A A . 32 SER CB 1 1 4 2331 1 1 32 SER H H -1.397 5.661 1.702 1.00 . A A . 32 SER H 1 1 4 2332 1 1 32 SER HA H 1.102 5.219 3.200 1.00 . A A . 32 SER HA 1 1 4 2333 1 1 32 SER HB2 H -1.154 5.887 4.893 1.00 . A A . 32 SER HB2 1 1 4 2334 1 1 32 SER HB3 H 0.423 6.668 4.782 1.00 . A A . 32 SER HB3 1 1 4 2335 1 1 32 SER HG H -0.342 7.909 3.055 1.00 . A A . 32 SER HG 1 1 4 2336 1 1 32 SER N N -0.432 5.625 1.879 1.00 . A A . 32 SER N 1 1 4 2337 1 1 32 SER O O -1.336 3.310 2.881 1.00 . A A . 32 SER O 1 1 4 2338 1 1 32 SER OG O -1.026 7.429 3.555 1.00 . A A . 32 SER OG 1 1 4 2339 1 1 33 LEU C C -1.894 2.052 5.779 1.00 . A A . 33 LEU C 1 1 4 2340 1 1 33 LEU CA C -0.480 2.048 5.207 1.00 . A A . 33 LEU CA 1 1 4 2341 1 1 33 LEU CB C 0.491 1.550 6.276 1.00 . A A . 33 LEU CB 1 1 4 2342 1 1 33 LEU CD1 C 2.749 0.544 6.584 1.00 . A A . 33 LEU CD1 1 1 4 2343 1 1 33 LEU CD2 C 0.810 -0.908 5.985 1.00 . A A . 33 LEU CD2 1 1 4 2344 1 1 33 LEU CG C 1.447 0.461 5.814 1.00 . A A . 33 LEU CG 1 1 4 2345 1 1 33 LEU H H 0.590 3.867 5.272 1.00 . A A . 33 LEU H 1 1 4 2346 1 1 33 LEU HA H -0.444 1.382 4.361 1.00 . A A . 33 LEU HA 1 1 4 2347 1 1 33 LEU HB2 H 1.076 2.390 6.620 1.00 . A A . 33 LEU HB2 1 1 4 2348 1 1 33 LEU HB3 H -0.081 1.166 7.107 1.00 . A A . 33 LEU HB3 1 1 4 2349 1 1 33 LEU HD11 H 3.186 1.523 6.452 1.00 . A A . 33 LEU HD11 1 1 4 2350 1 1 33 LEU HD12 H 2.557 0.375 7.634 1.00 . A A . 33 LEU HD12 1 1 4 2351 1 1 33 LEU HD13 H 3.434 -0.208 6.220 1.00 . A A . 33 LEU HD13 1 1 4 2352 1 1 33 LEU HD21 H 0.040 -1.041 5.240 1.00 . A A . 33 LEU HD21 1 1 4 2353 1 1 33 LEU HD22 H 1.565 -1.670 5.866 1.00 . A A . 33 LEU HD22 1 1 4 2354 1 1 33 LEU HD23 H 0.375 -0.981 6.971 1.00 . A A . 33 LEU HD23 1 1 4 2355 1 1 33 LEU HG H 1.665 0.607 4.767 1.00 . A A . 33 LEU HG 1 1 4 2356 1 1 33 LEU N N -0.080 3.374 4.750 1.00 . A A . 33 LEU N 1 1 4 2357 1 1 33 LEU O O -2.374 1.038 6.284 1.00 . A A . 33 LEU O 1 1 4 2358 1 1 34 SER C C -4.900 2.667 5.083 1.00 . A A . 34 SER C 1 1 4 2359 1 1 34 SER CA C -3.947 3.296 6.096 1.00 . A A . 34 SER CA 1 1 4 2360 1 1 34 SER CB C -4.284 4.771 6.298 1.00 . A A . 34 SER CB 1 1 4 2361 1 1 34 SER H H -2.150 3.944 5.209 1.00 . A A . 34 SER H 1 1 4 2362 1 1 34 SER HA H -4.039 2.778 7.038 1.00 . A A . 34 SER HA 1 1 4 2363 1 1 34 SER HB2 H -5.121 5.039 5.671 1.00 . A A . 34 SER HB2 1 1 4 2364 1 1 34 SER HB3 H -4.538 4.941 7.333 1.00 . A A . 34 SER HB3 1 1 4 2365 1 1 34 SER HG H -2.648 5.766 6.754 1.00 . A A . 34 SER HG 1 1 4 2366 1 1 34 SER N N -2.575 3.176 5.644 1.00 . A A . 34 SER N 1 1 4 2367 1 1 34 SER O O -6.072 2.420 5.385 1.00 . A A . 34 SER O 1 1 4 2368 1 1 34 SER OG O -3.175 5.592 5.957 1.00 . A A . 34 SER OG 1 1 4 2369 1 1 35 GLY C C -4.525 0.706 2.089 1.00 . A A . 35 GLY C 1 1 4 2370 1 1 35 GLY CA C -5.211 1.831 2.839 1.00 . A A . 35 GLY CA 1 1 4 2371 1 1 35 GLY H H -3.448 2.618 3.702 1.00 . A A . 35 GLY H 1 1 4 2372 1 1 35 GLY HA2 H -6.116 1.446 3.285 1.00 . A A . 35 GLY HA2 1 1 4 2373 1 1 35 GLY HA3 H -5.473 2.608 2.136 1.00 . A A . 35 GLY HA3 1 1 4 2374 1 1 35 GLY N N -4.388 2.406 3.881 1.00 . A A . 35 GLY N 1 1 4 2375 1 1 35 GLY O O -5.033 0.250 1.064 1.00 . A A . 35 GLY O 1 1 4 2376 1 1 36 CYS C C -3.447 -2.165 2.092 1.00 . A A . 36 CYS C 1 1 4 2377 1 1 36 CYS CA C -2.654 -0.856 1.995 1.00 . A A . 36 CYS CA 1 1 4 2378 1 1 36 CYS CB C -1.294 -1.028 2.682 1.00 . A A . 36 CYS CB 1 1 4 2379 1 1 36 CYS H H -3.049 0.636 3.436 1.00 . A A . 36 CYS H 1 1 4 2380 1 1 36 CYS HA H -2.499 -0.614 0.954 1.00 . A A . 36 CYS HA 1 1 4 2381 1 1 36 CYS HB2 H -1.410 -0.837 3.739 1.00 . A A . 36 CYS HB2 1 1 4 2382 1 1 36 CYS HB3 H -0.955 -2.046 2.539 1.00 . A A . 36 CYS HB3 1 1 4 2383 1 1 36 CYS N N -3.390 0.243 2.608 1.00 . A A . 36 CYS N 1 1 4 2384 1 1 36 CYS O O -3.719 -2.655 3.191 1.00 . A A . 36 CYS O 1 1 4 2385 1 1 36 CYS SG S 0.020 0.079 2.067 1.00 . A A . 36 CYS SG 1 1 4 2386 1 1 37 PRO C C -3.625 -5.205 1.095 1.00 . A A . 37 PRO C 1 1 4 2387 1 1 37 PRO CA C -4.559 -4.015 0.901 1.00 . A A . 37 PRO CA 1 1 4 2388 1 1 37 PRO CB C -5.147 -4.027 -0.507 1.00 . A A . 37 PRO CB 1 1 4 2389 1 1 37 PRO CD C -3.614 -2.194 -0.407 1.00 . A A . 37 PRO CD 1 1 4 2390 1 1 37 PRO CG C -4.169 -3.253 -1.321 1.00 . A A . 37 PRO CG 1 1 4 2391 1 1 37 PRO HA H -5.352 -4.051 1.632 1.00 . A A . 37 PRO HA 1 1 4 2392 1 1 37 PRO HB2 H -5.233 -5.047 -0.856 1.00 . A A . 37 PRO HB2 1 1 4 2393 1 1 37 PRO HB3 H -6.118 -3.556 -0.502 1.00 . A A . 37 PRO HB3 1 1 4 2394 1 1 37 PRO HD2 H -2.562 -2.048 -0.594 1.00 . A A . 37 PRO HD2 1 1 4 2395 1 1 37 PRO HD3 H -4.153 -1.269 -0.537 1.00 . A A . 37 PRO HD3 1 1 4 2396 1 1 37 PRO HG2 H -3.379 -3.903 -1.666 1.00 . A A . 37 PRO HG2 1 1 4 2397 1 1 37 PRO HG3 H -4.672 -2.795 -2.159 1.00 . A A . 37 PRO HG3 1 1 4 2398 1 1 37 PRO N N -3.835 -2.743 0.944 1.00 . A A . 37 PRO N 1 1 4 2399 1 1 37 PRO O O -4.062 -6.354 1.132 1.00 . A A . 37 PRO O 1 1 4 2400 1 1 38 ARG C C -0.294 -5.566 2.340 1.00 . A A . 38 ARG C 1 1 4 2401 1 1 38 ARG CA C -1.319 -5.956 1.289 1.00 . A A . 38 ARG CA 1 1 4 2402 1 1 38 ARG CB C -0.617 -6.186 -0.044 1.00 . A A . 38 ARG CB 1 1 4 2403 1 1 38 ARG CD C -1.310 -6.804 -2.360 1.00 . A A . 38 ARG CD 1 1 4 2404 1 1 38 ARG CG C -1.279 -7.240 -0.909 1.00 . A A . 38 ARG CG 1 1 4 2405 1 1 38 ARG CZ C -2.583 -7.471 -4.359 1.00 . A A . 38 ARG CZ 1 1 4 2406 1 1 38 ARG H H -2.044 -3.985 1.076 1.00 . A A . 38 ARG H 1 1 4 2407 1 1 38 ARG HA H -1.810 -6.868 1.596 1.00 . A A . 38 ARG HA 1 1 4 2408 1 1 38 ARG HB2 H -0.605 -5.257 -0.597 1.00 . A A . 38 ARG HB2 1 1 4 2409 1 1 38 ARG HB3 H 0.399 -6.493 0.147 1.00 . A A . 38 ARG HB3 1 1 4 2410 1 1 38 ARG HD2 H -1.275 -5.726 -2.397 1.00 . A A . 38 ARG HD2 1 1 4 2411 1 1 38 ARG HD3 H -0.443 -7.209 -2.862 1.00 . A A . 38 ARG HD3 1 1 4 2412 1 1 38 ARG HE H -3.308 -7.444 -2.487 1.00 . A A . 38 ARG HE 1 1 4 2413 1 1 38 ARG HG2 H -0.722 -8.162 -0.830 1.00 . A A . 38 ARG HG2 1 1 4 2414 1 1 38 ARG HG3 H -2.291 -7.393 -0.564 1.00 . A A . 38 ARG HG3 1 1 4 2415 1 1 38 ARG HH11 H -0.665 -6.894 -4.724 1.00 . A A . 38 ARG HH11 1 1 4 2416 1 1 38 ARG HH12 H -1.576 -7.385 -6.124 1.00 . A A . 38 ARG HH12 1 1 4 2417 1 1 38 ARG HH21 H -4.504 -8.130 -4.313 1.00 . A A . 38 ARG HH21 1 1 4 2418 1 1 38 ARG HH22 H -3.770 -8.076 -5.891 1.00 . A A . 38 ARG HH22 1 1 4 2419 1 1 38 ARG N N -2.331 -4.921 1.155 1.00 . A A . 38 ARG N 1 1 4 2420 1 1 38 ARG NE N -2.512 -7.265 -3.044 1.00 . A A . 38 ARG NE 1 1 4 2421 1 1 38 ARG NH1 N -1.527 -7.231 -5.129 1.00 . A A . 38 ARG NH1 1 1 4 2422 1 1 38 ARG NH2 N -3.706 -7.929 -4.898 1.00 . A A . 38 ARG NH2 1 1 4 2423 1 1 38 ARG O O 0.910 -5.711 2.127 1.00 . A A . 38 ARG O 1 1 4 2424 1 1 39 ALA C C 0.949 -5.826 5.047 1.00 . A A . 39 ALA C 1 1 4 2425 1 1 39 ALA CA C 0.088 -4.666 4.567 1.00 . A A . 39 ALA CA 1 1 4 2426 1 1 39 ALA CB C -0.738 -4.116 5.719 1.00 . A A . 39 ALA CB 1 1 4 2427 1 1 39 ALA H H -1.752 -5.014 3.583 1.00 . A A . 39 ALA H 1 1 4 2428 1 1 39 ALA HA H 0.731 -3.876 4.206 1.00 . A A . 39 ALA HA 1 1 4 2429 1 1 39 ALA HB1 H -0.211 -3.293 6.178 1.00 . A A . 39 ALA HB1 1 1 4 2430 1 1 39 ALA HB2 H -1.692 -3.773 5.349 1.00 . A A . 39 ALA HB2 1 1 4 2431 1 1 39 ALA HB3 H -0.896 -4.894 6.452 1.00 . A A . 39 ALA HB3 1 1 4 2432 1 1 39 ALA N N -0.780 -5.078 3.472 1.00 . A A . 39 ALA N 1 1 4 2433 1 1 39 ALA O O 0.514 -6.977 5.030 1.00 . A A . 39 ALA O 1 1 4 2434 1 1 40 LYS C C 2.671 -7.013 7.390 1.00 . A A . 40 LYS C 1 1 4 2435 1 1 40 LYS CA C 3.082 -6.532 5.997 1.00 . A A . 40 LYS CA 1 1 4 2436 1 1 40 LYS CB C 4.503 -5.972 6.045 1.00 . A A . 40 LYS CB 1 1 4 2437 1 1 40 LYS CD C 6.061 -4.921 4.384 1.00 . A A . 40 LYS CD 1 1 4 2438 1 1 40 LYS CE C 7.083 -4.548 5.445 1.00 . A A . 40 LYS CE 1 1 4 2439 1 1 40 LYS CG C 5.286 -6.173 4.761 1.00 . A A . 40 LYS CG 1 1 4 2440 1 1 40 LYS H H 2.435 -4.578 5.503 1.00 . A A . 40 LYS H 1 1 4 2441 1 1 40 LYS HA H 3.056 -7.368 5.313 1.00 . A A . 40 LYS HA 1 1 4 2442 1 1 40 LYS HB2 H 4.451 -4.912 6.245 1.00 . A A . 40 LYS HB2 1 1 4 2443 1 1 40 LYS HB3 H 5.040 -6.454 6.848 1.00 . A A . 40 LYS HB3 1 1 4 2444 1 1 40 LYS HD2 H 6.575 -5.097 3.452 1.00 . A A . 40 LYS HD2 1 1 4 2445 1 1 40 LYS HD3 H 5.365 -4.105 4.265 1.00 . A A . 40 LYS HD3 1 1 4 2446 1 1 40 LYS HE2 H 7.015 -5.255 6.258 1.00 . A A . 40 LYS HE2 1 1 4 2447 1 1 40 LYS HE3 H 8.069 -4.595 5.008 1.00 . A A . 40 LYS HE3 1 1 4 2448 1 1 40 LYS HG2 H 5.982 -6.988 4.897 1.00 . A A . 40 LYS HG2 1 1 4 2449 1 1 40 LYS HG3 H 4.597 -6.414 3.963 1.00 . A A . 40 LYS HG3 1 1 4 2450 1 1 40 LYS HZ1 H 7.006 -3.163 7.007 1.00 . A A . 40 LYS HZ1 1 1 4 2451 1 1 40 LYS HZ2 H 5.876 -2.871 5.773 1.00 . A A . 40 LYS HZ2 1 1 4 2452 1 1 40 LYS HZ3 H 7.513 -2.504 5.529 1.00 . A A . 40 LYS HZ3 1 1 4 2453 1 1 40 LYS N N 2.157 -5.517 5.499 1.00 . A A . 40 LYS N 1 1 4 2454 1 1 40 LYS NZ N 6.853 -3.179 5.975 1.00 . A A . 40 LYS NZ 1 1 4 2455 1 1 40 LYS O O 3.504 -7.158 8.285 1.00 . A A . 40 LYS O 1 1 4 2456 1 1 41 LYS C C -0.236 -8.746 8.584 1.00 . A A . 41 LYS C 1 1 4 2457 1 1 41 LYS CA C 0.834 -7.694 8.829 1.00 . A A . 41 LYS CA 1 1 4 2458 1 1 41 LYS CB C 0.237 -6.511 9.596 1.00 . A A . 41 LYS CB 1 1 4 2459 1 1 41 LYS CD C 1.126 -6.002 11.887 1.00 . A A . 41 LYS CD 1 1 4 2460 1 1 41 LYS CE C 2.469 -5.917 12.590 1.00 . A A . 41 LYS CE 1 1 4 2461 1 1 41 LYS CG C 1.258 -5.725 10.399 1.00 . A A . 41 LYS CG 1 1 4 2462 1 1 41 LYS H H 0.771 -7.123 6.798 1.00 . A A . 41 LYS H 1 1 4 2463 1 1 41 LYS HA H 1.634 -8.130 9.408 1.00 . A A . 41 LYS HA 1 1 4 2464 1 1 41 LYS HB2 H -0.229 -5.838 8.893 1.00 . A A . 41 LYS HB2 1 1 4 2465 1 1 41 LYS HB3 H -0.514 -6.884 10.278 1.00 . A A . 41 LYS HB3 1 1 4 2466 1 1 41 LYS HD2 H 0.456 -5.276 12.320 1.00 . A A . 41 LYS HD2 1 1 4 2467 1 1 41 LYS HD3 H 0.720 -6.996 12.024 1.00 . A A . 41 LYS HD3 1 1 4 2468 1 1 41 LYS HE2 H 3.000 -5.053 12.220 1.00 . A A . 41 LYS HE2 1 1 4 2469 1 1 41 LYS HE3 H 2.299 -5.806 13.652 1.00 . A A . 41 LYS HE3 1 1 4 2470 1 1 41 LYS HG2 H 2.249 -6.007 10.078 1.00 . A A . 41 LYS HG2 1 1 4 2471 1 1 41 LYS HG3 H 1.107 -4.669 10.223 1.00 . A A . 41 LYS HG3 1 1 4 2472 1 1 41 LYS HZ1 H 3.886 -7.328 13.197 1.00 . A A . 41 LYS HZ1 1 1 4 2473 1 1 41 LYS HZ2 H 3.929 -6.982 11.539 1.00 . A A . 41 LYS HZ2 1 1 4 2474 1 1 41 LYS HZ3 H 2.692 -7.955 12.167 1.00 . A A . 41 LYS HZ3 1 1 4 2475 1 1 41 LYS N N 1.381 -7.248 7.562 1.00 . A A . 41 LYS N 1 1 4 2476 1 1 41 LYS NZ N 3.301 -7.129 12.358 1.00 . A A . 41 LYS NZ 1 1 4 2477 1 1 41 LYS O O -1.412 -8.413 8.426 1.00 . A A . 41 LYS O 1 1 4 2478 1 1 42 SER C C -1.229 -11.111 6.769 1.00 . A A . 42 SER C 1 1 4 2479 1 1 42 SER CA C -0.693 -11.137 8.206 1.00 . A A . 42 SER CA 1 1 4 2480 1 1 42 SER CB C -1.853 -11.170 9.208 1.00 . A A . 42 SER CB 1 1 4 2481 1 1 42 SER H H 1.163 -10.176 8.569 1.00 . A A . 42 SER H 1 1 4 2482 1 1 42 SER HA H -0.109 -12.037 8.331 1.00 . A A . 42 SER HA 1 1 4 2483 1 1 42 SER HB2 H -2.551 -10.381 8.969 1.00 . A A . 42 SER HB2 1 1 4 2484 1 1 42 SER HB3 H -2.355 -12.124 9.143 1.00 . A A . 42 SER HB3 1 1 4 2485 1 1 42 SER HG H -1.322 -11.845 10.977 1.00 . A A . 42 SER HG 1 1 4 2486 1 1 42 SER N N 0.198 -10.003 8.475 1.00 . A A . 42 SER N 1 1 4 2487 1 1 42 SER O O -0.953 -12.018 5.979 1.00 . A A . 42 SER O 1 1 4 2488 1 1 42 SER OG O -1.391 -10.982 10.540 1.00 . A A . 42 SER OG 1 1 4 2489 1 1 43 GLY C C -1.590 -9.378 4.078 1.00 . A A . 43 GLY C 1 1 4 2490 1 1 43 GLY CA C -2.552 -9.959 5.096 1.00 . A A . 43 GLY CA 1 1 4 2491 1 1 43 GLY H H -2.132 -9.353 7.085 1.00 . A A . 43 GLY H 1 1 4 2492 1 1 43 GLY HA2 H -2.852 -10.944 4.767 1.00 . A A . 43 GLY HA2 1 1 4 2493 1 1 43 GLY HA3 H -3.427 -9.329 5.148 1.00 . A A . 43 GLY HA3 1 1 4 2494 1 1 43 GLY N N -1.975 -10.068 6.425 1.00 . A A . 43 GLY N 1 1 4 2495 1 1 43 GLY O O -1.975 -8.546 3.255 1.00 . A A . 43 GLY O 1 1 4 2496 1 1 44 LEU C C 0.414 -10.015 1.795 1.00 . A A . 44 LEU C 1 1 4 2497 1 1 44 LEU CA C 0.658 -9.384 3.156 1.00 . A A . 44 LEU CA 1 1 4 2498 1 1 44 LEU CB C 2.071 -9.722 3.646 1.00 . A A . 44 LEU CB 1 1 4 2499 1 1 44 LEU CD1 C 2.248 -12.121 4.351 1.00 . A A . 44 LEU CD1 1 1 4 2500 1 1 44 LEU CD2 C 3.320 -10.332 5.730 1.00 . A A . 44 LEU CD2 1 1 4 2501 1 1 44 LEU CG C 2.143 -10.684 4.835 1.00 . A A . 44 LEU CG 1 1 4 2502 1 1 44 LEU H H -0.106 -10.517 4.773 1.00 . A A . 44 LEU H 1 1 4 2503 1 1 44 LEU HA H 0.565 -8.311 3.064 1.00 . A A . 44 LEU HA 1 1 4 2504 1 1 44 LEU HB2 H 2.619 -10.160 2.823 1.00 . A A . 44 LEU HB2 1 1 4 2505 1 1 44 LEU HB3 H 2.559 -8.800 3.928 1.00 . A A . 44 LEU HB3 1 1 4 2506 1 1 44 LEU HD11 H 1.692 -12.231 3.431 1.00 . A A . 44 LEU HD11 1 1 4 2507 1 1 44 LEU HD12 H 3.285 -12.369 4.177 1.00 . A A . 44 LEU HD12 1 1 4 2508 1 1 44 LEU HD13 H 1.839 -12.784 5.100 1.00 . A A . 44 LEU HD13 1 1 4 2509 1 1 44 LEU HD21 H 3.495 -9.268 5.693 1.00 . A A . 44 LEU HD21 1 1 4 2510 1 1 44 LEU HD22 H 3.101 -10.626 6.746 1.00 . A A . 44 LEU HD22 1 1 4 2511 1 1 44 LEU HD23 H 4.201 -10.854 5.388 1.00 . A A . 44 LEU HD23 1 1 4 2512 1 1 44 LEU HG H 1.239 -10.593 5.419 1.00 . A A . 44 LEU HG 1 1 4 2513 1 1 44 LEU N N -0.347 -9.840 4.108 1.00 . A A . 44 LEU N 1 1 4 2514 1 1 44 LEU O O 0.637 -9.394 0.755 1.00 . A A . 44 LEU O 1 1 4 2515 1 1 45 ARG C C -1.808 -12.649 0.813 1.00 . A A . 45 ARG C 1 1 4 2516 1 1 45 ARG CA C -0.477 -11.938 0.610 1.00 . A A . 45 ARG CA 1 1 4 2517 1 1 45 ARG CB C 0.608 -12.953 0.234 1.00 . A A . 45 ARG CB 1 1 4 2518 1 1 45 ARG CD C -0.211 -13.576 -2.064 1.00 . A A . 45 ARG CD 1 1 4 2519 1 1 45 ARG CG C 0.928 -12.982 -1.252 1.00 . A A . 45 ARG CG 1 1 4 2520 1 1 45 ARG CZ C -1.557 -15.635 -1.823 1.00 . A A . 45 ARG CZ 1 1 4 2521 1 1 45 ARG H H -0.317 -11.636 2.685 1.00 . A A . 45 ARG H 1 1 4 2522 1 1 45 ARG HA H -0.580 -11.215 -0.186 1.00 . A A . 45 ARG HA 1 1 4 2523 1 1 45 ARG HB2 H 1.513 -12.710 0.771 1.00 . A A . 45 ARG HB2 1 1 4 2524 1 1 45 ARG HB3 H 0.279 -13.939 0.530 1.00 . A A . 45 ARG HB3 1 1 4 2525 1 1 45 ARG HD2 H -1.128 -13.062 -1.807 1.00 . A A . 45 ARG HD2 1 1 4 2526 1 1 45 ARG HD3 H -0.001 -13.431 -3.112 1.00 . A A . 45 ARG HD3 1 1 4 2527 1 1 45 ARG HE H 0.437 -15.527 -1.613 1.00 . A A . 45 ARG HE 1 1 4 2528 1 1 45 ARG HG2 H 1.108 -11.972 -1.590 1.00 . A A . 45 ARG HG2 1 1 4 2529 1 1 45 ARG HG3 H 1.817 -13.578 -1.405 1.00 . A A . 45 ARG HG3 1 1 4 2530 1 1 45 ARG HH11 H -2.644 -13.970 -2.236 1.00 . A A . 45 ARG HH11 1 1 4 2531 1 1 45 ARG HH12 H -3.562 -15.436 -2.081 1.00 . A A . 45 ARG HH12 1 1 4 2532 1 1 45 ARG HH21 H -0.780 -17.456 -1.378 1.00 . A A . 45 ARG HH21 1 1 4 2533 1 1 45 ARG HH22 H -2.506 -17.415 -1.594 1.00 . A A . 45 ARG HH22 1 1 4 2534 1 1 45 ARG N N -0.115 -11.227 1.820 1.00 . A A . 45 ARG N 1 1 4 2535 1 1 45 ARG NE N -0.380 -15.005 -1.806 1.00 . A A . 45 ARG NE 1 1 4 2536 1 1 45 ARG NH1 N -2.676 -14.959 -2.066 1.00 . A A . 45 ARG NH1 1 1 4 2537 1 1 45 ARG NH2 N -1.618 -16.938 -1.577 1.00 . A A . 45 ARG NH2 1 1 4 2538 1 1 45 ARG O O -1.847 -13.801 1.242 1.00 . A A . 45 ARG O 1 1 4 2539 1 1 46 VAL C C -4.809 -12.846 -0.672 1.00 . A A . 46 VAL C 1 1 4 2540 1 1 46 VAL CA C -4.223 -12.515 0.691 1.00 . A A . 46 VAL CA 1 1 4 2541 1 1 46 VAL CB C -5.185 -11.569 1.447 1.00 . A A . 46 VAL CB 1 1 4 2542 1 1 46 VAL CG1 C -5.426 -12.078 2.859 1.00 . A A . 46 VAL CG1 1 1 4 2543 1 1 46 VAL CG2 C -4.649 -10.143 1.475 1.00 . A A . 46 VAL CG2 1 1 4 2544 1 1 46 VAL H H -2.801 -11.031 0.201 1.00 . A A . 46 VAL H 1 1 4 2545 1 1 46 VAL HA H -4.129 -13.429 1.261 1.00 . A A . 46 VAL HA 1 1 4 2546 1 1 46 VAL HB H -6.132 -11.563 0.926 1.00 . A A . 46 VAL HB 1 1 4 2547 1 1 46 VAL HG11 H -4.502 -12.040 3.417 1.00 . A A . 46 VAL HG11 1 1 4 2548 1 1 46 VAL HG12 H -6.167 -11.461 3.342 1.00 . A A . 46 VAL HG12 1 1 4 2549 1 1 46 VAL HG13 H -5.780 -13.098 2.817 1.00 . A A . 46 VAL HG13 1 1 4 2550 1 1 46 VAL HG21 H -5.467 -9.448 1.351 1.00 . A A . 46 VAL HG21 1 1 4 2551 1 1 46 VAL HG22 H -4.161 -9.960 2.419 1.00 . A A . 46 VAL HG22 1 1 4 2552 1 1 46 VAL HG23 H -3.940 -10.010 0.672 1.00 . A A . 46 VAL HG23 1 1 4 2553 1 1 46 VAL N N -2.893 -11.948 0.538 1.00 . A A . 46 VAL N 1 1 4 2554 1 1 46 VAL O O -5.907 -13.439 -0.727 1.00 . A A . 46 VAL O 1 1 4 2555 1 1 46 VAL OXT O -4.161 -12.515 -1.689 1.00 . A A . 46 VAL OXT 1 1 4 2556 2 2 1 ZN ZN ZN -0.221 0.220 -0.220 1.00 . B A . 47 ZN ZN 1 1 5 2557 1 1 1 GLY C C 2.854 3.860 -15.860 1.00 . A A . 1 GLY C 1 1 5 2558 1 1 1 GLY CA C 4.321 4.222 -15.873 1.00 . A A . 1 GLY CA 1 1 5 2559 1 1 1 GLY H1 H 3.662 5.987 -14.982 1.00 . A A . 1 GLY H1 1 1 5 2560 1 1 1 GLY H2 H 5.000 6.187 -15.999 1.00 . A A . 1 GLY H2 1 1 5 2561 1 1 1 GLY H3 H 5.201 5.487 -14.469 1.00 . A A . 1 GLY H3 1 1 5 2562 1 1 1 GLY HA2 H 4.673 4.214 -16.894 1.00 . A A . 1 GLY HA2 1 1 5 2563 1 1 1 GLY HA3 H 4.871 3.486 -15.306 1.00 . A A . 1 GLY HA3 1 1 5 2564 1 1 1 GLY N N 4.564 5.561 -15.291 1.00 . A A . 1 GLY N 1 1 5 2565 1 1 1 GLY O O 2.200 3.952 -14.822 1.00 . A A . 1 GLY O 1 1 5 2566 1 1 2 SER C C 0.635 1.789 -16.468 1.00 . A A . 2 SER C 1 1 5 2567 1 1 2 SER CA C 0.919 3.134 -17.140 1.00 . A A . 2 SER CA 1 1 5 2568 1 1 2 SER CB C 0.532 3.091 -18.618 1.00 . A A . 2 SER CB 1 1 5 2569 1 1 2 SER H H 2.891 3.465 -17.819 1.00 . A A . 2 SER H 1 1 5 2570 1 1 2 SER HA H 0.343 3.901 -16.646 1.00 . A A . 2 SER HA 1 1 5 2571 1 1 2 SER HB2 H 0.448 2.063 -18.938 1.00 . A A . 2 SER HB2 1 1 5 2572 1 1 2 SER HB3 H -0.416 3.591 -18.757 1.00 . A A . 2 SER HB3 1 1 5 2573 1 1 2 SER HG H 1.481 4.697 -19.255 1.00 . A A . 2 SER HG 1 1 5 2574 1 1 2 SER N N 2.326 3.484 -17.018 1.00 . A A . 2 SER N 1 1 5 2575 1 1 2 SER O O -0.440 1.577 -15.906 1.00 . A A . 2 SER O 1 1 5 2576 1 1 2 SER OG O 1.515 3.740 -19.417 1.00 . A A . 2 SER OG 1 1 5 2577 1 1 3 MET C C 2.174 -0.286 -14.391 1.00 . A A . 3 MET C 1 1 5 2578 1 1 3 MET CA C 1.519 -0.361 -15.765 1.00 . A A . 3 MET CA 1 1 5 2579 1 1 3 MET CB C 2.150 -1.481 -16.599 1.00 . A A . 3 MET CB 1 1 5 2580 1 1 3 MET CE C 0.590 -5.352 -16.700 1.00 . A A . 3 MET CE 1 1 5 2581 1 1 3 MET CG C 1.720 -2.876 -16.170 1.00 . A A . 3 MET CG 1 1 5 2582 1 1 3 MET H H 2.506 1.176 -16.837 1.00 . A A . 3 MET H 1 1 5 2583 1 1 3 MET HA H 0.467 -0.569 -15.637 1.00 . A A . 3 MET HA 1 1 5 2584 1 1 3 MET HB2 H 1.871 -1.343 -17.634 1.00 . A A . 3 MET HB2 1 1 5 2585 1 1 3 MET HB3 H 3.225 -1.416 -16.514 1.00 . A A . 3 MET HB3 1 1 5 2586 1 1 3 MET HE1 H -0.325 -5.822 -17.030 1.00 . A A . 3 MET HE1 1 1 5 2587 1 1 3 MET HE2 H 1.434 -5.946 -17.017 1.00 . A A . 3 MET HE2 1 1 5 2588 1 1 3 MET HE3 H 0.589 -5.276 -15.623 1.00 . A A . 3 MET HE3 1 1 5 2589 1 1 3 MET HG2 H 2.603 -3.472 -15.988 1.00 . A A . 3 MET HG2 1 1 5 2590 1 1 3 MET HG3 H 1.148 -2.796 -15.258 1.00 . A A . 3 MET HG3 1 1 5 2591 1 1 3 MET N N 1.639 0.920 -16.444 1.00 . A A . 3 MET N 1 1 5 2592 1 1 3 MET O O 3.289 -0.773 -14.186 1.00 . A A . 3 MET O 1 1 5 2593 1 1 3 MET SD S 0.710 -3.711 -17.412 1.00 . A A . 3 MET SD 1 1 5 2594 1 1 4 ALA C C 0.848 0.762 -11.151 1.00 . A A . 4 ALA C 1 1 5 2595 1 1 4 ALA CA C 2.009 0.586 -12.126 1.00 . A A . 4 ALA CA 1 1 5 2596 1 1 4 ALA CB C 2.931 1.798 -12.100 1.00 . A A . 4 ALA CB 1 1 5 2597 1 1 4 ALA H H 0.635 0.788 -13.716 1.00 . A A . 4 ALA H 1 1 5 2598 1 1 4 ALA HA H 2.580 -0.286 -11.848 1.00 . A A . 4 ALA HA 1 1 5 2599 1 1 4 ALA HB1 H 2.882 2.309 -13.050 1.00 . A A . 4 ALA HB1 1 1 5 2600 1 1 4 ALA HB2 H 2.622 2.469 -11.313 1.00 . A A . 4 ALA HB2 1 1 5 2601 1 1 4 ALA HB3 H 3.946 1.475 -11.917 1.00 . A A . 4 ALA HB3 1 1 5 2602 1 1 4 ALA N N 1.498 0.386 -13.472 1.00 . A A . 4 ALA N 1 1 5 2603 1 1 4 ALA O O -0.221 0.187 -11.358 1.00 . A A . 4 ALA O 1 1 5 2604 1 1 5 ALA C C -1.020 2.960 -9.985 1.00 . A A . 5 ALA C 1 1 5 2605 1 1 5 ALA CA C -0.077 2.002 -9.276 1.00 . A A . 5 ALA CA 1 1 5 2606 1 1 5 ALA CB C 0.454 2.623 -7.993 1.00 . A A . 5 ALA CB 1 1 5 2607 1 1 5 ALA H H 1.858 2.142 -10.118 1.00 . A A . 5 ALA H 1 1 5 2608 1 1 5 ALA HA H -0.615 1.099 -9.022 1.00 . A A . 5 ALA HA 1 1 5 2609 1 1 5 ALA HB1 H -0.353 2.728 -7.284 1.00 . A A . 5 ALA HB1 1 1 5 2610 1 1 5 ALA HB2 H 1.221 1.987 -7.576 1.00 . A A . 5 ALA HB2 1 1 5 2611 1 1 5 ALA HB3 H 0.872 3.596 -8.211 1.00 . A A . 5 ALA HB3 1 1 5 2612 1 1 5 ALA N N 1.014 1.649 -10.174 1.00 . A A . 5 ALA N 1 1 5 2613 1 1 5 ALA O O -0.854 4.183 -9.906 1.00 . A A . 5 ALA O 1 1 5 2614 1 1 6 HIS C C -1.846 3.984 -12.680 1.00 . A A . 6 HIS C 1 1 5 2615 1 1 6 HIS CA C -2.711 3.140 -11.747 1.00 . A A . 6 HIS CA 1 1 5 2616 1 1 6 HIS CB C -3.721 4.015 -10.998 1.00 . A A . 6 HIS CB 1 1 5 2617 1 1 6 HIS CD2 C -6.200 3.598 -11.637 1.00 . A A . 6 HIS CD2 1 1 5 2618 1 1 6 HIS CE1 C -6.359 5.047 -13.267 1.00 . A A . 6 HIS CE1 1 1 5 2619 1 1 6 HIS CG C -4.998 4.211 -11.755 1.00 . A A . 6 HIS CG 1 1 5 2620 1 1 6 HIS H H -1.829 1.405 -10.931 1.00 . A A . 6 HIS H 1 1 5 2621 1 1 6 HIS HA H -3.254 2.423 -12.347 1.00 . A A . 6 HIS HA 1 1 5 2622 1 1 6 HIS HB2 H -3.961 3.550 -10.054 1.00 . A A . 6 HIS HB2 1 1 5 2623 1 1 6 HIS HB3 H -3.284 4.986 -10.819 1.00 . A A . 6 HIS HB3 1 1 5 2624 1 1 6 HIS HD1 H -4.422 5.704 -13.137 1.00 . A A . 6 HIS HD1 1 1 5 2625 1 1 6 HIS HD2 H -6.458 2.827 -10.925 1.00 . A A . 6 HIS HD2 1 1 5 2626 1 1 6 HIS HE1 H -6.751 5.641 -14.081 1.00 . A A . 6 HIS HE1 1 1 5 2627 1 1 6 HIS HE2 H -7.869 3.717 -12.902 1.00 . A A . 6 HIS HE2 1 1 5 2628 1 1 6 HIS N N -1.868 2.384 -10.831 1.00 . A A . 6 HIS N 1 1 5 2629 1 1 6 HIS ND1 N -5.132 5.113 -12.788 1.00 . A A . 6 HIS ND1 1 1 5 2630 1 1 6 HIS NE2 N -7.030 4.134 -12.591 1.00 . A A . 6 HIS NE2 1 1 5 2631 1 1 6 HIS O O -1.193 3.450 -13.572 1.00 . A A . 6 HIS O 1 1 5 2632 1 1 7 SER C C -0.167 7.108 -12.353 1.00 . A A . 7 SER C 1 1 5 2633 1 1 7 SER CA C -0.984 6.179 -13.248 1.00 . A A . 7 SER CA 1 1 5 2634 1 1 7 SER CB C -1.881 6.992 -14.191 1.00 . A A . 7 SER CB 1 1 5 2635 1 1 7 SER H H -2.315 5.662 -11.692 1.00 . A A . 7 SER H 1 1 5 2636 1 1 7 SER HA H -0.310 5.574 -13.836 1.00 . A A . 7 SER HA 1 1 5 2637 1 1 7 SER HB2 H -1.995 7.992 -13.801 1.00 . A A . 7 SER HB2 1 1 5 2638 1 1 7 SER HB3 H -1.423 7.040 -15.169 1.00 . A A . 7 SER HB3 1 1 5 2639 1 1 7 SER HG H -3.326 6.184 -15.250 1.00 . A A . 7 SER HG 1 1 5 2640 1 1 7 SER N N -1.799 5.288 -12.441 1.00 . A A . 7 SER N 1 1 5 2641 1 1 7 SER O O 0.249 8.189 -12.771 1.00 . A A . 7 SER O 1 1 5 2642 1 1 7 SER OG O -3.168 6.400 -14.316 1.00 . A A . 7 SER OG 1 1 5 2643 1 1 8 ALA C C 1.991 6.902 -9.661 1.00 . A A . 8 ALA C 1 1 5 2644 1 1 8 ALA CA C 0.694 7.551 -10.125 1.00 . A A . 8 ALA CA 1 1 5 2645 1 1 8 ALA CB C -0.210 7.836 -8.936 1.00 . A A . 8 ALA CB 1 1 5 2646 1 1 8 ALA H H -0.399 5.866 -10.803 1.00 . A A . 8 ALA H 1 1 5 2647 1 1 8 ALA HA H 0.927 8.492 -10.602 1.00 . A A . 8 ALA HA 1 1 5 2648 1 1 8 ALA HB1 H -0.242 8.900 -8.757 1.00 . A A . 8 ALA HB1 1 1 5 2649 1 1 8 ALA HB2 H -1.205 7.474 -9.144 1.00 . A A . 8 ALA HB2 1 1 5 2650 1 1 8 ALA HB3 H 0.180 7.336 -8.062 1.00 . A A . 8 ALA HB3 1 1 5 2651 1 1 8 ALA N N -0.002 6.716 -11.095 1.00 . A A . 8 ALA N 1 1 5 2652 1 1 8 ALA O O 3.070 7.481 -9.810 1.00 . A A . 8 ALA O 1 1 5 2653 1 1 9 ASP C C 3.858 5.771 -7.626 1.00 . A A . 9 ASP C 1 1 5 2654 1 1 9 ASP CA C 3.010 4.939 -8.581 1.00 . A A . 9 ASP CA 1 1 5 2655 1 1 9 ASP CB C 3.871 4.410 -9.720 1.00 . A A . 9 ASP CB 1 1 5 2656 1 1 9 ASP CG C 4.746 3.247 -9.284 1.00 . A A . 9 ASP CG 1 1 5 2657 1 1 9 ASP H H 0.976 5.304 -9.034 1.00 . A A . 9 ASP H 1 1 5 2658 1 1 9 ASP HA H 2.613 4.099 -8.033 1.00 . A A . 9 ASP HA 1 1 5 2659 1 1 9 ASP HB2 H 3.226 4.075 -10.514 1.00 . A A . 9 ASP HB2 1 1 5 2660 1 1 9 ASP HB3 H 4.504 5.202 -10.083 1.00 . A A . 9 ASP HB3 1 1 5 2661 1 1 9 ASP N N 1.868 5.700 -9.097 1.00 . A A . 9 ASP N 1 1 5 2662 1 1 9 ASP O O 5.052 5.974 -7.841 1.00 . A A . 9 ASP O 1 1 5 2663 1 1 9 ASP OD1 O 4.232 2.116 -9.203 1.00 . A A . 9 ASP OD1 1 1 5 2664 1 1 9 ASP OD2 O 5.946 3.458 -9.011 1.00 . A A . 9 ASP OD2 1 1 5 2665 1 1 10 LEU C C 4.690 6.054 -4.587 1.00 . A A . 10 LEU C 1 1 5 2666 1 1 10 LEU CA C 3.939 6.985 -5.528 1.00 . A A . 10 LEU CA 1 1 5 2667 1 1 10 LEU CB C 2.948 7.837 -4.735 1.00 . A A . 10 LEU CB 1 1 5 2668 1 1 10 LEU CD1 C 2.175 7.465 -2.383 1.00 . A A . 10 LEU CD1 1 1 5 2669 1 1 10 LEU CD2 C 0.562 7.238 -4.280 1.00 . A A . 10 LEU CD2 1 1 5 2670 1 1 10 LEU CG C 2.002 7.047 -3.833 1.00 . A A . 10 LEU CG 1 1 5 2671 1 1 10 LEU H H 2.295 5.996 -6.426 1.00 . A A . 10 LEU H 1 1 5 2672 1 1 10 LEU HA H 4.648 7.632 -6.022 1.00 . A A . 10 LEU HA 1 1 5 2673 1 1 10 LEU HB2 H 3.508 8.527 -4.119 1.00 . A A . 10 LEU HB2 1 1 5 2674 1 1 10 LEU HB3 H 2.353 8.404 -5.434 1.00 . A A . 10 LEU HB3 1 1 5 2675 1 1 10 LEU HD11 H 1.238 7.339 -1.858 1.00 . A A . 10 LEU HD11 1 1 5 2676 1 1 10 LEU HD12 H 2.933 6.852 -1.919 1.00 . A A . 10 LEU HD12 1 1 5 2677 1 1 10 LEU HD13 H 2.474 8.503 -2.340 1.00 . A A . 10 LEU HD13 1 1 5 2678 1 1 10 LEU HD21 H 0.081 6.275 -4.362 1.00 . A A . 10 LEU HD21 1 1 5 2679 1 1 10 LEU HD22 H 0.037 7.843 -3.556 1.00 . A A . 10 LEU HD22 1 1 5 2680 1 1 10 LEU HD23 H 0.547 7.731 -5.241 1.00 . A A . 10 LEU HD23 1 1 5 2681 1 1 10 LEU HG H 2.239 5.996 -3.907 1.00 . A A . 10 LEU HG 1 1 5 2682 1 1 10 LEU N N 3.239 6.215 -6.550 1.00 . A A . 10 LEU N 1 1 5 2683 1 1 10 LEU O O 5.585 6.483 -3.860 1.00 . A A . 10 LEU O 1 1 5 2684 1 1 11 LYS C C 4.601 3.965 -2.313 1.00 . A A . 11 LYS C 1 1 5 2685 1 1 11 LYS CA C 4.902 3.737 -3.789 1.00 . A A . 11 LYS CA 1 1 5 2686 1 1 11 LYS CB C 6.408 3.637 -4.029 1.00 . A A . 11 LYS CB 1 1 5 2687 1 1 11 LYS CD C 6.255 1.388 -5.126 1.00 . A A . 11 LYS CD 1 1 5 2688 1 1 11 LYS CE C 5.881 0.793 -6.474 1.00 . A A . 11 LYS CE 1 1 5 2689 1 1 11 LYS CG C 6.755 2.818 -5.257 1.00 . A A . 11 LYS CG 1 1 5 2690 1 1 11 LYS H H 3.596 4.520 -5.240 1.00 . A A . 11 LYS H 1 1 5 2691 1 1 11 LYS HA H 4.450 2.800 -4.079 1.00 . A A . 11 LYS HA 1 1 5 2692 1 1 11 LYS HB2 H 6.811 4.631 -4.156 1.00 . A A . 11 LYS HB2 1 1 5 2693 1 1 11 LYS HB3 H 6.870 3.173 -3.171 1.00 . A A . 11 LYS HB3 1 1 5 2694 1 1 11 LYS HD2 H 7.032 0.786 -4.682 1.00 . A A . 11 LYS HD2 1 1 5 2695 1 1 11 LYS HD3 H 5.382 1.385 -4.484 1.00 . A A . 11 LYS HD3 1 1 5 2696 1 1 11 LYS HE2 H 5.955 -0.281 -6.411 1.00 . A A . 11 LYS HE2 1 1 5 2697 1 1 11 LYS HE3 H 4.861 1.069 -6.702 1.00 . A A . 11 LYS HE3 1 1 5 2698 1 1 11 LYS HG2 H 6.294 3.272 -6.123 1.00 . A A . 11 LYS HG2 1 1 5 2699 1 1 11 LYS HG3 H 7.826 2.810 -5.382 1.00 . A A . 11 LYS HG3 1 1 5 2700 1 1 11 LYS HZ1 H 6.917 0.512 -8.268 1.00 . A A . 11 LYS HZ1 1 1 5 2701 1 1 11 LYS HZ2 H 7.692 1.559 -7.188 1.00 . A A . 11 LYS HZ2 1 1 5 2702 1 1 11 LYS HZ3 H 6.332 2.090 -8.056 1.00 . A A . 11 LYS HZ3 1 1 5 2703 1 1 11 LYS N N 4.307 4.775 -4.624 1.00 . A A . 11 LYS N 1 1 5 2704 1 1 11 LYS NZ N 6.765 1.271 -7.570 1.00 . A A . 11 LYS NZ 1 1 5 2705 1 1 11 LYS O O 5.121 4.885 -1.682 1.00 . A A . 11 LYS O 1 1 5 2706 1 1 12 CYS C C 4.369 2.461 0.499 1.00 . A A . 12 CYS C 1 1 5 2707 1 1 12 CYS CA C 3.344 3.188 -0.390 1.00 . A A . 12 CYS CA 1 1 5 2708 1 1 12 CYS CB C 1.948 2.576 -0.288 1.00 . A A . 12 CYS CB 1 1 5 2709 1 1 12 CYS H H 3.382 2.391 -2.332 1.00 . A A . 12 CYS H 1 1 5 2710 1 1 12 CYS HA H 3.300 4.229 -0.105 1.00 . A A . 12 CYS HA 1 1 5 2711 1 1 12 CYS HB2 H 1.777 2.232 0.720 1.00 . A A . 12 CYS HB2 1 1 5 2712 1 1 12 CYS HB3 H 1.216 3.331 -0.532 1.00 . A A . 12 CYS HB3 1 1 5 2713 1 1 12 CYS N N 3.751 3.111 -1.777 1.00 . A A . 12 CYS N 1 1 5 2714 1 1 12 CYS O O 5.449 2.107 0.021 1.00 . A A . 12 CYS O 1 1 5 2715 1 1 12 CYS SG S 1.686 1.172 -1.414 1.00 . A A . 12 CYS SG 1 1 5 2716 1 1 13 PRO C C 5.306 0.242 2.515 1.00 . A A . 13 PRO C 1 1 5 2717 1 1 13 PRO CA C 5.111 1.744 2.735 1.00 . A A . 13 PRO CA 1 1 5 2718 1 1 13 PRO CB C 4.518 1.990 4.127 1.00 . A A . 13 PRO CB 1 1 5 2719 1 1 13 PRO CD C 2.986 2.909 2.546 1.00 . A A . 13 PRO CD 1 1 5 2720 1 1 13 PRO CG C 3.506 3.065 3.942 1.00 . A A . 13 PRO CG 1 1 5 2721 1 1 13 PRO HA H 6.067 2.239 2.662 1.00 . A A . 13 PRO HA 1 1 5 2722 1 1 13 PRO HB2 H 4.063 1.079 4.491 1.00 . A A . 13 PRO HB2 1 1 5 2723 1 1 13 PRO HB3 H 5.301 2.298 4.801 1.00 . A A . 13 PRO HB3 1 1 5 2724 1 1 13 PRO HD2 H 2.144 2.231 2.531 1.00 . A A . 13 PRO HD2 1 1 5 2725 1 1 13 PRO HD3 H 2.707 3.868 2.138 1.00 . A A . 13 PRO HD3 1 1 5 2726 1 1 13 PRO HG2 H 2.706 2.945 4.657 1.00 . A A . 13 PRO HG2 1 1 5 2727 1 1 13 PRO HG3 H 3.974 4.031 4.060 1.00 . A A . 13 PRO HG3 1 1 5 2728 1 1 13 PRO N N 4.131 2.342 1.820 1.00 . A A . 13 PRO N 1 1 5 2729 1 1 13 PRO O O 6.348 -0.309 2.867 1.00 . A A . 13 PRO O 1 1 5 2730 1 1 14 THR C C 5.041 -2.323 0.643 1.00 . A A . 14 THR C 1 1 5 2731 1 1 14 THR CA C 4.303 -1.883 1.913 1.00 . A A . 14 THR CA 1 1 5 2732 1 1 14 THR CB C 2.881 -2.469 1.913 1.00 . A A . 14 THR CB 1 1 5 2733 1 1 14 THR CG2 C 2.924 -3.985 2.018 1.00 . A A . 14 THR CG2 1 1 5 2734 1 1 14 THR H H 3.431 0.043 1.876 1.00 . A A . 14 THR H 1 1 5 2735 1 1 14 THR HA H 4.827 -2.282 2.769 1.00 . A A . 14 THR HA 1 1 5 2736 1 1 14 THR HB H 2.394 -2.200 0.987 1.00 . A A . 14 THR HB 1 1 5 2737 1 1 14 THR HG1 H 1.376 -1.418 2.670 1.00 . A A . 14 THR HG1 1 1 5 2738 1 1 14 THR HG21 H 2.851 -4.276 3.056 1.00 . A A . 14 THR HG21 1 1 5 2739 1 1 14 THR HG22 H 3.856 -4.347 1.608 1.00 . A A . 14 THR HG22 1 1 5 2740 1 1 14 THR HG23 H 2.099 -4.409 1.466 1.00 . A A . 14 THR HG23 1 1 5 2741 1 1 14 THR N N 4.268 -0.433 2.053 1.00 . A A . 14 THR N 1 1 5 2742 1 1 14 THR O O 4.682 -1.930 -0.468 1.00 . A A . 14 THR O 1 1 5 2743 1 1 14 THR OG1 O 2.134 -1.928 3.013 1.00 . A A . 14 THR OG1 1 1 5 2744 1 1 15 PRO C C 6.167 -4.556 -1.239 1.00 . A A . 15 PRO C 1 1 5 2745 1 1 15 PRO CA C 6.933 -3.616 -0.312 1.00 . A A . 15 PRO CA 1 1 5 2746 1 1 15 PRO CB C 8.073 -4.374 0.381 1.00 . A A . 15 PRO CB 1 1 5 2747 1 1 15 PRO CD C 6.641 -3.574 2.102 1.00 . A A . 15 PRO CD 1 1 5 2748 1 1 15 PRO CG C 8.074 -3.873 1.780 1.00 . A A . 15 PRO CG 1 1 5 2749 1 1 15 PRO HA H 7.340 -2.798 -0.885 1.00 . A A . 15 PRO HA 1 1 5 2750 1 1 15 PRO HB2 H 7.878 -5.436 0.343 1.00 . A A . 15 PRO HB2 1 1 5 2751 1 1 15 PRO HB3 H 9.007 -4.158 -0.113 1.00 . A A . 15 PRO HB3 1 1 5 2752 1 1 15 PRO HD2 H 6.135 -4.463 2.444 1.00 . A A . 15 PRO HD2 1 1 5 2753 1 1 15 PRO HD3 H 6.573 -2.787 2.839 1.00 . A A . 15 PRO HD3 1 1 5 2754 1 1 15 PRO HG2 H 8.460 -4.633 2.441 1.00 . A A . 15 PRO HG2 1 1 5 2755 1 1 15 PRO HG3 H 8.668 -2.976 1.846 1.00 . A A . 15 PRO HG3 1 1 5 2756 1 1 15 PRO N N 6.110 -3.128 0.806 1.00 . A A . 15 PRO N 1 1 5 2757 1 1 15 PRO O O 6.311 -4.493 -2.461 1.00 . A A . 15 PRO O 1 1 5 2758 1 1 16 GLY C C 3.363 -5.802 -2.045 1.00 . A A . 16 GLY C 1 1 5 2759 1 1 16 GLY CA C 4.613 -6.402 -1.436 1.00 . A A . 16 GLY CA 1 1 5 2760 1 1 16 GLY H H 5.316 -5.468 0.328 1.00 . A A . 16 GLY H 1 1 5 2761 1 1 16 GLY HA2 H 5.246 -6.770 -2.226 1.00 . A A . 16 GLY HA2 1 1 5 2762 1 1 16 GLY HA3 H 4.331 -7.228 -0.801 1.00 . A A . 16 GLY HA3 1 1 5 2763 1 1 16 GLY N N 5.365 -5.441 -0.652 1.00 . A A . 16 GLY N 1 1 5 2764 1 1 16 GLY O O 2.679 -6.437 -2.852 1.00 . A A . 16 GLY O 1 1 5 2765 1 1 17 CYS C C 2.366 -3.134 -3.535 1.00 . A A . 17 CYS C 1 1 5 2766 1 1 17 CYS CA C 1.966 -3.828 -2.232 1.00 . A A . 17 CYS CA 1 1 5 2767 1 1 17 CYS CB C 1.490 -2.811 -1.198 1.00 . A A . 17 CYS CB 1 1 5 2768 1 1 17 CYS H H 3.702 -4.099 -1.078 1.00 . A A . 17 CYS H 1 1 5 2769 1 1 17 CYS HA H 1.172 -4.531 -2.433 1.00 . A A . 17 CYS HA 1 1 5 2770 1 1 17 CYS HB2 H 1.449 -3.290 -0.231 1.00 . A A . 17 CYS HB2 1 1 5 2771 1 1 17 CYS HB3 H 2.203 -1.999 -1.154 1.00 . A A . 17 CYS HB3 1 1 5 2772 1 1 17 CYS N N 3.094 -4.557 -1.693 1.00 . A A . 17 CYS N 1 1 5 2773 1 1 17 CYS O O 3.380 -3.480 -4.147 1.00 . A A . 17 CYS O 1 1 5 2774 1 1 17 CYS SG S -0.149 -2.087 -1.509 1.00 . A A . 17 CYS SG 1 1 5 2775 1 1 18 ASP C C 1.331 -0.050 -5.139 1.00 . A A . 18 ASP C 1 1 5 2776 1 1 18 ASP CA C 1.780 -1.509 -5.233 1.00 . A A . 18 ASP CA 1 1 5 2777 1 1 18 ASP CB C 1.058 -2.224 -6.377 1.00 . A A . 18 ASP CB 1 1 5 2778 1 1 18 ASP CG C -0.338 -1.694 -6.635 1.00 . A A . 18 ASP CG 1 1 5 2779 1 1 18 ASP H H 0.721 -2.021 -3.476 1.00 . A A . 18 ASP H 1 1 5 2780 1 1 18 ASP HA H 2.845 -1.533 -5.421 1.00 . A A . 18 ASP HA 1 1 5 2781 1 1 18 ASP HB2 H 1.637 -2.120 -7.283 1.00 . A A . 18 ASP HB2 1 1 5 2782 1 1 18 ASP HB3 H 0.978 -3.271 -6.123 1.00 . A A . 18 ASP HB3 1 1 5 2783 1 1 18 ASP N N 1.538 -2.209 -3.982 1.00 . A A . 18 ASP N 1 1 5 2784 1 1 18 ASP O O 1.973 0.841 -5.700 1.00 . A A . 18 ASP O 1 1 5 2785 1 1 18 ASP OD1 O -1.240 -1.952 -5.808 1.00 . A A . 18 ASP OD1 1 1 5 2786 1 1 18 ASP OD2 O -0.541 -1.010 -7.657 1.00 . A A . 18 ASP OD2 1 1 5 2787 1 1 19 GLY C C -1.720 1.673 -4.735 1.00 . A A . 19 GLY C 1 1 5 2788 1 1 19 GLY CA C -0.279 1.536 -4.276 1.00 . A A . 19 GLY CA 1 1 5 2789 1 1 19 GLY H H -0.241 -0.563 -4.015 1.00 . A A . 19 GLY H 1 1 5 2790 1 1 19 GLY HA2 H -0.217 1.816 -3.234 1.00 . A A . 19 GLY HA2 1 1 5 2791 1 1 19 GLY HA3 H 0.338 2.211 -4.854 1.00 . A A . 19 GLY HA3 1 1 5 2792 1 1 19 GLY N N 0.233 0.186 -4.428 1.00 . A A . 19 GLY N 1 1 5 2793 1 1 19 GLY O O -2.368 2.694 -4.480 1.00 . A A . 19 GLY O 1 1 5 2794 1 1 20 SER C C -4.491 -0.270 -5.016 1.00 . A A . 20 SER C 1 1 5 2795 1 1 20 SER CA C -3.613 0.653 -5.855 1.00 . A A . 20 SER CA 1 1 5 2796 1 1 20 SER CB C -3.664 0.243 -7.327 1.00 . A A . 20 SER CB 1 1 5 2797 1 1 20 SER H H -1.689 -0.164 -5.534 1.00 . A A . 20 SER H 1 1 5 2798 1 1 20 SER HA H -3.982 1.664 -5.762 1.00 . A A . 20 SER HA 1 1 5 2799 1 1 20 SER HB2 H -3.711 -0.834 -7.398 1.00 . A A . 20 SER HB2 1 1 5 2800 1 1 20 SER HB3 H -4.539 0.674 -7.791 1.00 . A A . 20 SER HB3 1 1 5 2801 1 1 20 SER HG H -1.756 0.126 -7.784 1.00 . A A . 20 SER HG 1 1 5 2802 1 1 20 SER N N -2.239 0.639 -5.381 1.00 . A A . 20 SER N 1 1 5 2803 1 1 20 SER O O -4.015 -1.254 -4.442 1.00 . A A . 20 SER O 1 1 5 2804 1 1 20 SER OG O -2.510 0.695 -8.016 1.00 . A A . 20 SER OG 1 1 5 2805 1 1 21 GLY C C -6.754 -0.270 -2.704 1.00 . A A . 21 GLY C 1 1 5 2806 1 1 21 GLY CA C -6.708 -0.705 -4.150 1.00 . A A . 21 GLY CA 1 1 5 2807 1 1 21 GLY H H -6.073 0.886 -5.390 1.00 . A A . 21 GLY H 1 1 5 2808 1 1 21 GLY HA2 H -7.692 -0.593 -4.582 1.00 . A A . 21 GLY HA2 1 1 5 2809 1 1 21 GLY HA3 H -6.423 -1.745 -4.193 1.00 . A A . 21 GLY HA3 1 1 5 2810 1 1 21 GLY N N -5.766 0.077 -4.924 1.00 . A A . 21 GLY N 1 1 5 2811 1 1 21 GLY O O -6.040 0.643 -2.307 1.00 . A A . 21 GLY O 1 1 5 2812 1 1 22 HIS C C -8.145 -1.952 0.228 1.00 . A A . 22 HIS C 1 1 5 2813 1 1 22 HIS CA C -7.680 -0.691 -0.480 1.00 . A A . 22 HIS CA 1 1 5 2814 1 1 22 HIS CB C -8.684 0.437 -0.176 1.00 . A A . 22 HIS CB 1 1 5 2815 1 1 22 HIS CD2 C -7.578 2.659 -0.962 1.00 . A A . 22 HIS CD2 1 1 5 2816 1 1 22 HIS CE1 C -7.534 3.689 0.966 1.00 . A A . 22 HIS CE1 1 1 5 2817 1 1 22 HIS CG C -8.093 1.812 -0.041 1.00 . A A . 22 HIS CG 1 1 5 2818 1 1 22 HIS H H -8.093 -1.690 -2.303 1.00 . A A . 22 HIS H 1 1 5 2819 1 1 22 HIS HA H -6.702 -0.416 -0.109 1.00 . A A . 22 HIS HA 1 1 5 2820 1 1 22 HIS HB2 H -9.410 0.477 -0.972 1.00 . A A . 22 HIS HB2 1 1 5 2821 1 1 22 HIS HB3 H -9.194 0.207 0.749 1.00 . A A . 22 HIS HB3 1 1 5 2822 1 1 22 HIS HD1 H -8.339 2.142 2.035 1.00 . A A . 22 HIS HD1 1 1 5 2823 1 1 22 HIS HD2 H -7.452 2.458 -2.016 1.00 . A A . 22 HIS HD2 1 1 5 2824 1 1 22 HIS HE1 H -7.373 4.436 1.729 1.00 . A A . 22 HIS HE1 1 1 5 2825 1 1 22 HIS HE2 H -6.994 4.673 -0.749 1.00 . A A . 22 HIS HE2 1 1 5 2826 1 1 22 HIS N N -7.570 -0.946 -1.916 1.00 . A A . 22 HIS N 1 1 5 2827 1 1 22 HIS ND1 N -8.046 2.490 1.158 1.00 . A A . 22 HIS ND1 1 1 5 2828 1 1 22 HIS NE2 N -7.243 3.819 -0.310 1.00 . A A . 22 HIS NE2 1 1 5 2829 1 1 22 HIS O O -8.981 -2.681 -0.299 1.00 . A A . 22 HIS O 1 1 5 2830 1 1 23 ILE C C -9.737 -2.901 2.633 1.00 . A A . 23 ILE C 1 1 5 2831 1 1 23 ILE CA C -8.272 -3.190 2.308 1.00 . A A . 23 ILE CA 1 1 5 2832 1 1 23 ILE CB C -7.434 -3.379 3.604 1.00 . A A . 23 ILE CB 1 1 5 2833 1 1 23 ILE CD1 C -8.085 -5.822 4.009 1.00 . A A . 23 ILE CD1 1 1 5 2834 1 1 23 ILE CG1 C -6.968 -4.835 3.730 1.00 . A A . 23 ILE CG1 1 1 5 2835 1 1 23 ILE CG2 C -8.199 -2.952 4.854 1.00 . A A . 23 ILE CG2 1 1 5 2836 1 1 23 ILE H H -7.184 -1.417 1.898 1.00 . A A . 23 ILE H 1 1 5 2837 1 1 23 ILE HA H -8.218 -4.103 1.730 1.00 . A A . 23 ILE HA 1 1 5 2838 1 1 23 ILE HB H -6.563 -2.747 3.526 1.00 . A A . 23 ILE HB 1 1 5 2839 1 1 23 ILE HD11 H -7.726 -6.828 3.847 1.00 . A A . 23 ILE HD11 1 1 5 2840 1 1 23 ILE HD12 H -8.411 -5.717 5.034 1.00 . A A . 23 ILE HD12 1 1 5 2841 1 1 23 ILE HD13 H -8.913 -5.623 3.345 1.00 . A A . 23 ILE HD13 1 1 5 2842 1 1 23 ILE HG12 H -6.491 -5.133 2.808 1.00 . A A . 23 ILE HG12 1 1 5 2843 1 1 23 ILE HG13 H -6.253 -4.906 4.537 1.00 . A A . 23 ILE HG13 1 1 5 2844 1 1 23 ILE HG21 H -8.625 -1.972 4.698 1.00 . A A . 23 ILE HG21 1 1 5 2845 1 1 23 ILE HG22 H -8.989 -3.661 5.054 1.00 . A A . 23 ILE HG22 1 1 5 2846 1 1 23 ILE HG23 H -7.521 -2.920 5.696 1.00 . A A . 23 ILE HG23 1 1 5 2847 1 1 23 ILE N N -7.747 -2.109 1.483 1.00 . A A . 23 ILE N 1 1 5 2848 1 1 23 ILE O O -10.572 -3.804 2.689 1.00 . A A . 23 ILE O 1 1 5 2849 1 1 24 THR C C -12.246 -1.355 1.594 1.00 . A A . 24 THR C 1 1 5 2850 1 1 24 THR CA C -11.423 -1.158 2.882 1.00 . A A . 24 THR CA 1 1 5 2851 1 1 24 THR CB C -11.434 0.325 3.340 1.00 . A A . 24 THR CB 1 1 5 2852 1 1 24 THR CG2 C -11.762 1.276 2.199 1.00 . A A . 24 THR CG2 1 1 5 2853 1 1 24 THR H H -9.348 -0.947 2.568 1.00 . A A . 24 THR H 1 1 5 2854 1 1 24 THR HA H -11.863 -1.755 3.668 1.00 . A A . 24 THR HA 1 1 5 2855 1 1 24 THR HB H -10.445 0.568 3.702 1.00 . A A . 24 THR HB 1 1 5 2856 1 1 24 THR HG1 H -13.254 0.251 4.125 1.00 . A A . 24 THR HG1 1 1 5 2857 1 1 24 THR HG21 H -11.098 1.083 1.369 1.00 . A A . 24 THR HG21 1 1 5 2858 1 1 24 THR HG22 H -11.635 2.296 2.533 1.00 . A A . 24 THR HG22 1 1 5 2859 1 1 24 THR HG23 H -12.782 1.122 1.884 1.00 . A A . 24 THR HG23 1 1 5 2860 1 1 24 THR N N -10.056 -1.613 2.692 1.00 . A A . 24 THR N 1 1 5 2861 1 1 24 THR O O -13.474 -1.384 1.629 1.00 . A A . 24 THR O 1 1 5 2862 1 1 24 THR OG1 O -12.363 0.515 4.413 1.00 . A A . 24 THR OG1 1 1 5 2863 1 1 25 GLY C C -13.090 -0.884 -1.353 1.00 . A A . 25 GLY C 1 1 5 2864 1 1 25 GLY CA C -12.197 -1.971 -0.773 1.00 . A A . 25 GLY CA 1 1 5 2865 1 1 25 GLY H H -10.571 -1.697 0.555 1.00 . A A . 25 GLY H 1 1 5 2866 1 1 25 GLY HA2 H -11.433 -2.206 -1.499 1.00 . A A . 25 GLY HA2 1 1 5 2867 1 1 25 GLY HA3 H -12.795 -2.855 -0.609 1.00 . A A . 25 GLY HA3 1 1 5 2868 1 1 25 GLY N N -11.546 -1.614 0.486 1.00 . A A . 25 GLY N 1 1 5 2869 1 1 25 GLY O O -13.899 -1.152 -2.233 1.00 . A A . 25 GLY O 1 1 5 2870 1 1 26 ASN C C -13.216 2.456 -2.021 1.00 . A A . 26 ASN C 1 1 5 2871 1 1 26 ASN CA C -13.924 1.389 -1.197 1.00 . A A . 26 ASN CA 1 1 5 2872 1 1 26 ASN CB C -14.548 2.026 0.046 1.00 . A A . 26 ASN CB 1 1 5 2873 1 1 26 ASN CG C -15.843 1.352 0.451 1.00 . A A . 26 ASN CG 1 1 5 2874 1 1 26 ASN H H -12.434 0.447 -0.027 1.00 . A A . 26 ASN H 1 1 5 2875 1 1 26 ASN HA H -14.708 0.952 -1.795 1.00 . A A . 26 ASN HA 1 1 5 2876 1 1 26 ASN HB2 H -13.853 1.950 0.868 1.00 . A A . 26 ASN HB2 1 1 5 2877 1 1 26 ASN HB3 H -14.749 3.069 -0.152 1.00 . A A . 26 ASN HB3 1 1 5 2878 1 1 26 ASN HD21 H -14.838 -0.224 1.141 1.00 . A A . 26 ASN HD21 1 1 5 2879 1 1 26 ASN HD22 H -16.556 -0.290 1.301 1.00 . A A . 26 ASN HD22 1 1 5 2880 1 1 26 ASN N N -13.017 0.316 -0.798 1.00 . A A . 26 ASN N 1 1 5 2881 1 1 26 ASN ND2 N -15.738 0.160 1.016 1.00 . A A . 26 ASN ND2 1 1 5 2882 1 1 26 ASN O O -13.750 3.546 -2.232 1.00 . A A . 26 ASN O 1 1 5 2883 1 1 26 ASN OD1 O -16.925 1.896 0.253 1.00 . A A . 26 ASN OD1 1 1 5 2884 1 1 27 TYR C C -10.518 2.345 -4.415 1.00 . A A . 27 TYR C 1 1 5 2885 1 1 27 TYR CA C -11.247 3.083 -3.300 1.00 . A A . 27 TYR CA 1 1 5 2886 1 1 27 TYR CB C -10.227 3.850 -2.450 1.00 . A A . 27 TYR CB 1 1 5 2887 1 1 27 TYR CD1 C -11.139 4.075 -0.103 1.00 . A A . 27 TYR CD1 1 1 5 2888 1 1 27 TYR CD2 C -11.061 6.026 -1.469 1.00 . A A . 27 TYR CD2 1 1 5 2889 1 1 27 TYR CE1 C -11.681 4.813 0.927 1.00 . A A . 27 TYR CE1 1 1 5 2890 1 1 27 TYR CE2 C -11.598 6.774 -0.438 1.00 . A A . 27 TYR CE2 1 1 5 2891 1 1 27 TYR CG C -10.825 4.665 -1.322 1.00 . A A . 27 TYR CG 1 1 5 2892 1 1 27 TYR CZ C -11.905 6.161 0.758 1.00 . A A . 27 TYR CZ 1 1 5 2893 1 1 27 TYR H H -11.653 1.250 -2.325 1.00 . A A . 27 TYR H 1 1 5 2894 1 1 27 TYR HA H -11.939 3.785 -3.741 1.00 . A A . 27 TYR HA 1 1 5 2895 1 1 27 TYR HB2 H -9.536 3.146 -2.013 1.00 . A A . 27 TYR HB2 1 1 5 2896 1 1 27 TYR HB3 H -9.679 4.527 -3.089 1.00 . A A . 27 TYR HB3 1 1 5 2897 1 1 27 TYR HD1 H -10.964 3.017 0.030 1.00 . A A . 27 TYR HD1 1 1 5 2898 1 1 27 TYR HD2 H -10.822 6.502 -2.409 1.00 . A A . 27 TYR HD2 1 1 5 2899 1 1 27 TYR HE1 H -11.927 4.334 1.864 1.00 . A A . 27 TYR HE1 1 1 5 2900 1 1 27 TYR HE2 H -11.775 7.830 -0.573 1.00 . A A . 27 TYR HE2 1 1 5 2901 1 1 27 TYR HH H -12.910 6.308 2.399 1.00 . A A . 27 TYR HH 1 1 5 2902 1 1 27 TYR N N -12.014 2.144 -2.491 1.00 . A A . 27 TYR N 1 1 5 2903 1 1 27 TYR O O -10.530 1.114 -4.464 1.00 . A A . 27 TYR O 1 1 5 2904 1 1 27 TYR OH O -12.432 6.900 1.792 1.00 . A A . 27 TYR OH 1 1 5 2905 1 1 28 ALA C C -7.610 2.564 -6.116 1.00 . A A . 28 ALA C 1 1 5 2906 1 1 28 ALA CA C -9.107 2.527 -6.386 1.00 . A A . 28 ALA CA 1 1 5 2907 1 1 28 ALA CB C -9.421 3.260 -7.679 1.00 . A A . 28 ALA CB 1 1 5 2908 1 1 28 ALA H H -9.860 4.080 -5.163 1.00 . A A . 28 ALA H 1 1 5 2909 1 1 28 ALA HA H -9.417 1.499 -6.502 1.00 . A A . 28 ALA HA 1 1 5 2910 1 1 28 ALA HB1 H -8.835 2.838 -8.482 1.00 . A A . 28 ALA HB1 1 1 5 2911 1 1 28 ALA HB2 H -10.471 3.157 -7.907 1.00 . A A . 28 ALA HB2 1 1 5 2912 1 1 28 ALA HB3 H -9.176 4.307 -7.568 1.00 . A A . 28 ALA HB3 1 1 5 2913 1 1 28 ALA N N -9.857 3.101 -5.280 1.00 . A A . 28 ALA N 1 1 5 2914 1 1 28 ALA O O -6.851 1.796 -6.703 1.00 . A A . 28 ALA O 1 1 5 2915 1 1 29 SER C C -5.585 4.269 -3.564 1.00 . A A . 29 SER C 1 1 5 2916 1 1 29 SER CA C -5.765 3.602 -4.922 1.00 . A A . 29 SER CA 1 1 5 2917 1 1 29 SER CB C -5.046 4.407 -6.010 1.00 . A A . 29 SER CB 1 1 5 2918 1 1 29 SER H H -7.829 4.087 -4.832 1.00 . A A . 29 SER H 1 1 5 2919 1 1 29 SER HA H -5.344 2.610 -4.881 1.00 . A A . 29 SER HA 1 1 5 2920 1 1 29 SER HB2 H -4.334 5.074 -5.550 1.00 . A A . 29 SER HB2 1 1 5 2921 1 1 29 SER HB3 H -4.528 3.728 -6.673 1.00 . A A . 29 SER HB3 1 1 5 2922 1 1 29 SER HG H -6.418 5.803 -6.184 1.00 . A A . 29 SER HG 1 1 5 2923 1 1 29 SER N N -7.182 3.471 -5.247 1.00 . A A . 29 SER N 1 1 5 2924 1 1 29 SER O O -6.533 4.829 -3.015 1.00 . A A . 29 SER O 1 1 5 2925 1 1 29 SER OG O -5.968 5.174 -6.770 1.00 . A A . 29 SER OG 1 1 5 2926 1 1 30 HIS C C -2.738 5.532 -1.763 1.00 . A A . 30 HIS C 1 1 5 2927 1 1 30 HIS CA C -4.076 4.807 -1.726 1.00 . A A . 30 HIS CA 1 1 5 2928 1 1 30 HIS CB C -4.065 3.772 -0.598 1.00 . A A . 30 HIS CB 1 1 5 2929 1 1 30 HIS CD2 C -2.032 2.190 -0.425 1.00 . A A . 30 HIS CD2 1 1 5 2930 1 1 30 HIS CE1 C -2.724 0.570 -1.687 1.00 . A A . 30 HIS CE1 1 1 5 2931 1 1 30 HIS CG C -3.254 2.548 -0.885 1.00 . A A . 30 HIS CG 1 1 5 2932 1 1 30 HIS H H -3.658 3.723 -3.505 1.00 . A A . 30 HIS H 1 1 5 2933 1 1 30 HIS HA H -4.849 5.531 -1.523 1.00 . A A . 30 HIS HA 1 1 5 2934 1 1 30 HIS HB2 H -3.656 4.231 0.288 1.00 . A A . 30 HIS HB2 1 1 5 2935 1 1 30 HIS HB3 H -5.078 3.463 -0.394 1.00 . A A . 30 HIS HB3 1 1 5 2936 1 1 30 HIS HD1 H -4.549 1.446 -2.150 1.00 . A A . 30 HIS HD1 1 1 5 2937 1 1 30 HIS HD2 H -1.399 2.770 0.229 1.00 . A A . 30 HIS HD2 1 1 5 2938 1 1 30 HIS HE1 H -2.775 -0.364 -2.226 1.00 . A A . 30 HIS HE1 1 1 5 2939 1 1 30 HIS N N -4.376 4.192 -3.018 1.00 . A A . 30 HIS N 1 1 5 2940 1 1 30 HIS ND1 N -3.681 1.507 -1.689 1.00 . A A . 30 HIS ND1 1 1 5 2941 1 1 30 HIS NE2 N -1.721 0.947 -0.938 1.00 . A A . 30 HIS NE2 1 1 5 2942 1 1 30 HIS O O -2.258 5.910 -2.834 1.00 . A A . 30 HIS O 1 1 5 2943 1 1 31 ARG C C -0.044 5.856 0.677 1.00 . A A . 31 ARG C 1 1 5 2944 1 1 31 ARG CA C -0.882 6.423 -0.468 1.00 . A A . 31 ARG CA 1 1 5 2945 1 1 31 ARG CB C -1.132 7.914 -0.228 1.00 . A A . 31 ARG CB 1 1 5 2946 1 1 31 ARG CD C -0.358 10.021 -1.359 1.00 . A A . 31 ARG CD 1 1 5 2947 1 1 31 ARG CG C -1.168 8.743 -1.501 1.00 . A A . 31 ARG CG 1 1 5 2948 1 1 31 ARG CZ C -1.659 12.105 -1.151 1.00 . A A . 31 ARG CZ 1 1 5 2949 1 1 31 ARG H H -2.577 5.381 0.224 1.00 . A A . 31 ARG H 1 1 5 2950 1 1 31 ARG HA H -0.340 6.302 -1.395 1.00 . A A . 31 ARG HA 1 1 5 2951 1 1 31 ARG HB2 H -2.078 8.030 0.280 1.00 . A A . 31 ARG HB2 1 1 5 2952 1 1 31 ARG HB3 H -0.345 8.300 0.404 1.00 . A A . 31 ARG HB3 1 1 5 2953 1 1 31 ARG HD2 H 0.567 9.794 -0.850 1.00 . A A . 31 ARG HD2 1 1 5 2954 1 1 31 ARG HD3 H -0.141 10.405 -2.345 1.00 . A A . 31 ARG HD3 1 1 5 2955 1 1 31 ARG HE H -1.129 10.925 0.382 1.00 . A A . 31 ARG HE 1 1 5 2956 1 1 31 ARG HG2 H -0.756 8.158 -2.310 1.00 . A A . 31 ARG HG2 1 1 5 2957 1 1 31 ARG HG3 H -2.192 8.999 -1.724 1.00 . A A . 31 ARG HG3 1 1 5 2958 1 1 31 ARG HH11 H -1.173 11.603 -3.059 1.00 . A A . 31 ARG HH11 1 1 5 2959 1 1 31 ARG HH12 H -2.080 13.077 -2.885 1.00 . A A . 31 ARG HH12 1 1 5 2960 1 1 31 ARG HH21 H -2.319 12.853 0.619 1.00 . A A . 31 ARG HH21 1 1 5 2961 1 1 31 ARG HH22 H -2.712 13.799 -0.790 1.00 . A A . 31 ARG HH22 1 1 5 2962 1 1 31 ARG N N -2.145 5.719 -0.588 1.00 . A A . 31 ARG N 1 1 5 2963 1 1 31 ARG NE N -1.077 11.043 -0.601 1.00 . A A . 31 ARG NE 1 1 5 2964 1 1 31 ARG NH1 N -1.631 12.276 -2.468 1.00 . A A . 31 ARG NH1 1 1 5 2965 1 1 31 ARG NH2 N -2.279 12.988 -0.384 1.00 . A A . 31 ARG NH2 1 1 5 2966 1 1 31 ARG O O 1.182 5.960 0.668 1.00 . A A . 31 ARG O 1 1 5 2967 1 1 32 SER C C -0.535 3.489 3.328 1.00 . A A . 32 SER C 1 1 5 2968 1 1 32 SER CA C -0.005 4.853 2.885 1.00 . A A . 32 SER CA 1 1 5 2969 1 1 32 SER CB C -0.138 5.872 4.019 1.00 . A A . 32 SER CB 1 1 5 2970 1 1 32 SER H H -1.694 5.336 1.696 1.00 . A A . 32 SER H 1 1 5 2971 1 1 32 SER HA H 1.038 4.751 2.629 1.00 . A A . 32 SER HA 1 1 5 2972 1 1 32 SER HB2 H -0.885 5.532 4.720 1.00 . A A . 32 SER HB2 1 1 5 2973 1 1 32 SER HB3 H 0.810 5.969 4.522 1.00 . A A . 32 SER HB3 1 1 5 2974 1 1 32 SER HG H 0.132 7.450 2.876 1.00 . A A . 32 SER HG 1 1 5 2975 1 1 32 SER N N -0.708 5.337 1.704 1.00 . A A . 32 SER N 1 1 5 2976 1 1 32 SER O O -1.310 2.852 2.613 1.00 . A A . 32 SER O 1 1 5 2977 1 1 32 SER OG O -0.524 7.144 3.521 1.00 . A A . 32 SER OG 1 1 5 2978 1 1 33 LEU C C -1.920 1.736 5.555 1.00 . A A . 33 LEU C 1 1 5 2979 1 1 33 LEU CA C -0.488 1.740 5.043 1.00 . A A . 33 LEU CA 1 1 5 2980 1 1 33 LEU CB C 0.456 1.347 6.181 1.00 . A A . 33 LEU CB 1 1 5 2981 1 1 33 LEU CD1 C 2.701 0.394 6.745 1.00 . A A . 33 LEU CD1 1 1 5 2982 1 1 33 LEU CD2 C 0.873 -1.107 5.940 1.00 . A A . 33 LEU CD2 1 1 5 2983 1 1 33 LEU CG C 1.489 0.278 5.833 1.00 . A A . 33 LEU CG 1 1 5 2984 1 1 33 LEU H H 0.504 3.601 5.035 1.00 . A A . 33 LEU H 1 1 5 2985 1 1 33 LEU HA H -0.397 1.023 4.243 1.00 . A A . 33 LEU HA 1 1 5 2986 1 1 33 LEU HB2 H 0.980 2.233 6.506 1.00 . A A . 33 LEU HB2 1 1 5 2987 1 1 33 LEU HB3 H -0.143 0.981 7.003 1.00 . A A . 33 LEU HB3 1 1 5 2988 1 1 33 LEU HD11 H 3.296 -0.505 6.673 1.00 . A A . 33 LEU HD11 1 1 5 2989 1 1 33 LEU HD12 H 3.297 1.244 6.445 1.00 . A A . 33 LEU HD12 1 1 5 2990 1 1 33 LEU HD13 H 2.373 0.528 7.767 1.00 . A A . 33 LEU HD13 1 1 5 2991 1 1 33 LEU HD21 H 0.887 -1.429 6.971 1.00 . A A . 33 LEU HD21 1 1 5 2992 1 1 33 LEU HD22 H -0.148 -1.076 5.587 1.00 . A A . 33 LEU HD22 1 1 5 2993 1 1 33 LEU HD23 H 1.440 -1.802 5.339 1.00 . A A . 33 LEU HD23 1 1 5 2994 1 1 33 LEU HG H 1.819 0.424 4.814 1.00 . A A . 33 LEU HG 1 1 5 2995 1 1 33 LEU N N -0.120 3.054 4.521 1.00 . A A . 33 LEU N 1 1 5 2996 1 1 33 LEU O O -2.475 0.685 5.874 1.00 . A A . 33 LEU O 1 1 5 2997 1 1 34 SER C C -4.834 2.603 4.784 1.00 . A A . 34 SER C 1 1 5 2998 1 1 34 SER CA C -3.931 3.029 5.938 1.00 . A A . 34 SER CA 1 1 5 2999 1 1 34 SER CB C -4.216 4.473 6.326 1.00 . A A . 34 SER CB 1 1 5 3000 1 1 34 SER H H -2.058 3.699 5.247 1.00 . A A . 34 SER H 1 1 5 3001 1 1 34 SER HA H -4.106 2.384 6.787 1.00 . A A . 34 SER HA 1 1 5 3002 1 1 34 SER HB2 H -4.972 4.876 5.668 1.00 . A A . 34 SER HB2 1 1 5 3003 1 1 34 SER HB3 H -4.567 4.512 7.346 1.00 . A A . 34 SER HB3 1 1 5 3004 1 1 34 SER HG H -2.375 4.943 6.851 1.00 . A A . 34 SER HG 1 1 5 3005 1 1 34 SER N N -2.540 2.903 5.551 1.00 . A A . 34 SER N 1 1 5 3006 1 1 34 SER O O -6.053 2.485 4.936 1.00 . A A . 34 SER O 1 1 5 3007 1 1 34 SER OG O -3.039 5.261 6.214 1.00 . A A . 34 SER OG 1 1 5 3008 1 1 35 GLY C C -4.440 0.699 1.832 1.00 . A A . 35 GLY C 1 1 5 3009 1 1 35 GLY CA C -4.964 1.976 2.457 1.00 . A A . 35 GLY CA 1 1 5 3010 1 1 35 GLY H H -3.247 2.494 3.569 1.00 . A A . 35 GLY H 1 1 5 3011 1 1 35 GLY HA2 H -5.997 1.825 2.737 1.00 . A A . 35 GLY HA2 1 1 5 3012 1 1 35 GLY HA3 H -4.914 2.768 1.724 1.00 . A A . 35 GLY HA3 1 1 5 3013 1 1 35 GLY N N -4.220 2.377 3.626 1.00 . A A . 35 GLY N 1 1 5 3014 1 1 35 GLY O O -5.114 0.106 0.992 1.00 . A A . 35 GLY O 1 1 5 3015 1 1 36 CYS C C -3.498 -2.146 1.913 1.00 . A A . 36 CYS C 1 1 5 3016 1 1 36 CYS CA C -2.609 -0.922 1.691 1.00 . A A . 36 CYS CA 1 1 5 3017 1 1 36 CYS CB C -1.250 -1.169 2.364 1.00 . A A . 36 CYS CB 1 1 5 3018 1 1 36 CYS H H -2.749 0.808 2.900 1.00 . A A . 36 CYS H 1 1 5 3019 1 1 36 CYS HA H -2.461 -0.782 0.631 1.00 . A A . 36 CYS HA 1 1 5 3020 1 1 36 CYS HB2 H -1.345 -0.964 3.420 1.00 . A A . 36 CYS HB2 1 1 5 3021 1 1 36 CYS HB3 H -0.983 -2.209 2.231 1.00 . A A . 36 CYS HB3 1 1 5 3022 1 1 36 CYS N N -3.233 0.286 2.229 1.00 . A A . 36 CYS N 1 1 5 3023 1 1 36 CYS O O -3.697 -2.577 3.050 1.00 . A A . 36 CYS O 1 1 5 3024 1 1 36 CYS SG S 0.137 -0.157 1.737 1.00 . A A . 36 CYS SG 1 1 5 3025 1 1 37 PRO C C -3.934 -5.170 1.223 1.00 . A A . 37 PRO C 1 1 5 3026 1 1 37 PRO CA C -4.821 -3.963 0.933 1.00 . A A . 37 PRO CA 1 1 5 3027 1 1 37 PRO CB C -5.474 -4.078 -0.443 1.00 . A A . 37 PRO CB 1 1 5 3028 1 1 37 PRO CD C -3.867 -2.296 -0.561 1.00 . A A . 37 PRO CD 1 1 5 3029 1 1 37 PRO CG C -4.547 -3.370 -1.368 1.00 . A A . 37 PRO CG 1 1 5 3030 1 1 37 PRO HA H -5.581 -3.883 1.697 1.00 . A A . 37 PRO HA 1 1 5 3031 1 1 37 PRO HB2 H -5.582 -5.119 -0.708 1.00 . A A . 37 PRO HB2 1 1 5 3032 1 1 37 PRO HB3 H -6.447 -3.603 -0.421 1.00 . A A . 37 PRO HB3 1 1 5 3033 1 1 37 PRO HD2 H -2.823 -2.227 -0.826 1.00 . A A . 37 PRO HD2 1 1 5 3034 1 1 37 PRO HD3 H -4.357 -1.345 -0.715 1.00 . A A . 37 PRO HD3 1 1 5 3035 1 1 37 PRO HG2 H -3.815 -4.066 -1.752 1.00 . A A . 37 PRO HG2 1 1 5 3036 1 1 37 PRO HG3 H -5.106 -2.929 -2.180 1.00 . A A . 37 PRO HG3 1 1 5 3037 1 1 37 PRO N N -4.025 -2.744 0.834 1.00 . A A . 37 PRO N 1 1 5 3038 1 1 37 PRO O O -4.367 -6.149 1.827 1.00 . A A . 37 PRO O 1 1 5 3039 1 1 38 ARG C C -0.802 -5.535 2.399 1.00 . A A . 38 ARG C 1 1 5 3040 1 1 38 ARG CA C -1.655 -6.026 1.236 1.00 . A A . 38 ARG CA 1 1 5 3041 1 1 38 ARG CB C -0.758 -6.309 0.030 1.00 . A A . 38 ARG CB 1 1 5 3042 1 1 38 ARG CD C -1.225 -6.135 -2.416 1.00 . A A . 38 ARG CD 1 1 5 3043 1 1 38 ARG CG C -1.488 -6.917 -1.148 1.00 . A A . 38 ARG CG 1 1 5 3044 1 1 38 ARG CZ C -2.593 -4.680 -3.857 1.00 . A A . 38 ARG CZ 1 1 5 3045 1 1 38 ARG H H -2.356 -4.164 0.534 1.00 . A A . 38 ARG H 1 1 5 3046 1 1 38 ARG HA H -2.168 -6.931 1.521 1.00 . A A . 38 ARG HA 1 1 5 3047 1 1 38 ARG HB2 H -0.308 -5.383 -0.297 1.00 . A A . 38 ARG HB2 1 1 5 3048 1 1 38 ARG HB3 H 0.022 -6.990 0.331 1.00 . A A . 38 ARG HB3 1 1 5 3049 1 1 38 ARG HD2 H -0.669 -5.244 -2.165 1.00 . A A . 38 ARG HD2 1 1 5 3050 1 1 38 ARG HD3 H -0.641 -6.747 -3.085 1.00 . A A . 38 ARG HD3 1 1 5 3051 1 1 38 ARG HE H -3.242 -6.354 -2.970 1.00 . A A . 38 ARG HE 1 1 5 3052 1 1 38 ARG HG2 H -1.148 -7.932 -1.287 1.00 . A A . 38 ARG HG2 1 1 5 3053 1 1 38 ARG HG3 H -2.550 -6.914 -0.946 1.00 . A A . 38 ARG HG3 1 1 5 3054 1 1 38 ARG HH11 H -0.750 -3.954 -3.445 1.00 . A A . 38 ARG HH11 1 1 5 3055 1 1 38 ARG HH12 H -1.681 -3.010 -4.572 1.00 . A A . 38 ARG HH12 1 1 5 3056 1 1 38 ARG HH21 H -4.505 -5.091 -4.387 1.00 . A A . 38 ARG HH21 1 1 5 3057 1 1 38 ARG HH22 H -3.837 -3.642 -5.076 1.00 . A A . 38 ARG HH22 1 1 5 3058 1 1 38 ARG N N -2.654 -5.021 0.910 1.00 . A A . 38 ARG N 1 1 5 3059 1 1 38 ARG NE N -2.465 -5.753 -3.085 1.00 . A A . 38 ARG NE 1 1 5 3060 1 1 38 ARG NH1 N -1.597 -3.811 -3.960 1.00 . A A . 38 ARG NH1 1 1 5 3061 1 1 38 ARG NH2 N -3.735 -4.453 -4.491 1.00 . A A . 38 ARG NH2 1 1 5 3062 1 1 38 ARG O O 0.415 -5.702 2.389 1.00 . A A . 38 ARG O 1 1 5 3063 1 1 39 ALA C C 0.308 -4.968 5.065 1.00 . A A . 39 ALA C 1 1 5 3064 1 1 39 ALA CA C -0.781 -4.122 4.416 1.00 . A A . 39 ALA CA 1 1 5 3065 1 1 39 ALA CB C -1.805 -3.706 5.460 1.00 . A A . 39 ALA CB 1 1 5 3066 1 1 39 ALA H H -2.404 -4.640 3.173 1.00 . A A . 39 ALA H 1 1 5 3067 1 1 39 ALA HA H -0.329 -3.224 4.024 1.00 . A A . 39 ALA HA 1 1 5 3068 1 1 39 ALA HB1 H -2.788 -4.031 5.151 1.00 . A A . 39 ALA HB1 1 1 5 3069 1 1 39 ALA HB2 H -1.558 -4.161 6.409 1.00 . A A . 39 ALA HB2 1 1 5 3070 1 1 39 ALA HB3 H -1.796 -2.632 5.564 1.00 . A A . 39 ALA HB3 1 1 5 3071 1 1 39 ALA N N -1.449 -4.803 3.306 1.00 . A A . 39 ALA N 1 1 5 3072 1 1 39 ALA O O 0.072 -6.109 5.476 1.00 . A A . 39 ALA O 1 1 5 3073 1 1 40 LYS C C 2.357 -5.077 7.358 1.00 . A A . 40 LYS C 1 1 5 3074 1 1 40 LYS CA C 2.602 -5.019 5.852 1.00 . A A . 40 LYS CA 1 1 5 3075 1 1 40 LYS CB C 3.893 -4.263 5.514 1.00 . A A . 40 LYS CB 1 1 5 3076 1 1 40 LYS CD C 5.863 -3.202 6.634 1.00 . A A . 40 LYS CD 1 1 5 3077 1 1 40 LYS CE C 5.505 -2.399 7.880 1.00 . A A . 40 LYS CE 1 1 5 3078 1 1 40 LYS CG C 5.022 -4.463 6.506 1.00 . A A . 40 LYS CG 1 1 5 3079 1 1 40 LYS H H 1.595 -3.446 4.901 1.00 . A A . 40 LYS H 1 1 5 3080 1 1 40 LYS HA H 2.670 -6.027 5.469 1.00 . A A . 40 LYS HA 1 1 5 3081 1 1 40 LYS HB2 H 4.240 -4.590 4.545 1.00 . A A . 40 LYS HB2 1 1 5 3082 1 1 40 LYS HB3 H 3.672 -3.207 5.466 1.00 . A A . 40 LYS HB3 1 1 5 3083 1 1 40 LYS HD2 H 6.905 -3.480 6.686 1.00 . A A . 40 LYS HD2 1 1 5 3084 1 1 40 LYS HD3 H 5.696 -2.586 5.762 1.00 . A A . 40 LYS HD3 1 1 5 3085 1 1 40 LYS HE2 H 6.402 -1.935 8.263 1.00 . A A . 40 LYS HE2 1 1 5 3086 1 1 40 LYS HE3 H 4.794 -1.632 7.606 1.00 . A A . 40 LYS HE3 1 1 5 3087 1 1 40 LYS HG2 H 4.603 -4.711 7.470 1.00 . A A . 40 LYS HG2 1 1 5 3088 1 1 40 LYS HG3 H 5.651 -5.272 6.163 1.00 . A A . 40 LYS HG3 1 1 5 3089 1 1 40 LYS HZ1 H 5.504 -4.093 9.107 1.00 . A A . 40 LYS HZ1 1 1 5 3090 1 1 40 LYS HZ2 H 3.953 -3.556 8.670 1.00 . A A . 40 LYS HZ2 1 1 5 3091 1 1 40 LYS HZ3 H 4.843 -2.712 9.842 1.00 . A A . 40 LYS HZ3 1 1 5 3092 1 1 40 LYS N N 1.487 -4.371 5.204 1.00 . A A . 40 LYS N 1 1 5 3093 1 1 40 LYS NZ N 4.910 -3.249 8.948 1.00 . A A . 40 LYS NZ 1 1 5 3094 1 1 40 LYS O O 2.432 -4.062 8.057 1.00 . A A . 40 LYS O 1 1 5 3095 1 1 41 LYS C C 2.039 -7.882 9.635 1.00 . A A . 41 LYS C 1 1 5 3096 1 1 41 LYS CA C 1.668 -6.461 9.236 1.00 . A A . 41 LYS CA 1 1 5 3097 1 1 41 LYS CB C 0.180 -6.208 9.495 1.00 . A A . 41 LYS CB 1 1 5 3098 1 1 41 LYS CD C -0.659 -4.200 10.758 1.00 . A A . 41 LYS CD 1 1 5 3099 1 1 41 LYS CE C -2.078 -4.114 11.299 1.00 . A A . 41 LYS CE 1 1 5 3100 1 1 41 LYS CG C -0.109 -5.615 10.864 1.00 . A A . 41 LYS CG 1 1 5 3101 1 1 41 LYS H H 1.893 -7.003 7.206 1.00 . A A . 41 LYS H 1 1 5 3102 1 1 41 LYS HA H 2.254 -5.766 9.818 1.00 . A A . 41 LYS HA 1 1 5 3103 1 1 41 LYS HB2 H -0.191 -5.525 8.746 1.00 . A A . 41 LYS HB2 1 1 5 3104 1 1 41 LYS HB3 H -0.351 -7.143 9.412 1.00 . A A . 41 LYS HB3 1 1 5 3105 1 1 41 LYS HD2 H -0.027 -3.533 11.325 1.00 . A A . 41 LYS HD2 1 1 5 3106 1 1 41 LYS HD3 H -0.662 -3.900 9.719 1.00 . A A . 41 LYS HD3 1 1 5 3107 1 1 41 LYS HE2 H -2.769 -4.328 10.496 1.00 . A A . 41 LYS HE2 1 1 5 3108 1 1 41 LYS HE3 H -2.196 -4.851 12.078 1.00 . A A . 41 LYS HE3 1 1 5 3109 1 1 41 LYS HG2 H -0.834 -6.237 11.369 1.00 . A A . 41 LYS HG2 1 1 5 3110 1 1 41 LYS HG3 H 0.808 -5.593 11.435 1.00 . A A . 41 LYS HG3 1 1 5 3111 1 1 41 LYS HZ1 H -2.770 -2.863 12.821 1.00 . A A . 41 LYS HZ1 1 1 5 3112 1 1 41 LYS HZ2 H -3.098 -2.287 11.259 1.00 . A A . 41 LYS HZ2 1 1 5 3113 1 1 41 LYS HZ3 H -1.525 -2.185 11.891 1.00 . A A . 41 LYS HZ3 1 1 5 3114 1 1 41 LYS N N 1.980 -6.252 7.829 1.00 . A A . 41 LYS N 1 1 5 3115 1 1 41 LYS NZ N -2.387 -2.770 11.854 1.00 . A A . 41 LYS NZ 1 1 5 3116 1 1 41 LYS O O 2.808 -8.101 10.571 1.00 . A A . 41 LYS O 1 1 5 3117 1 1 42 SER C C 3.006 -10.615 7.977 1.00 . A A . 42 SER C 1 1 5 3118 1 1 42 SER CA C 1.959 -10.228 9.016 1.00 . A A . 42 SER CA 1 1 5 3119 1 1 42 SER CB C 0.719 -11.114 8.892 1.00 . A A . 42 SER CB 1 1 5 3120 1 1 42 SER H H 1.050 -8.584 8.050 1.00 . A A . 42 SER H 1 1 5 3121 1 1 42 SER HA H 2.381 -10.337 10.004 1.00 . A A . 42 SER HA 1 1 5 3122 1 1 42 SER HB2 H 0.775 -11.683 7.977 1.00 . A A . 42 SER HB2 1 1 5 3123 1 1 42 SER HB3 H 0.675 -11.789 9.735 1.00 . A A . 42 SER HB3 1 1 5 3124 1 1 42 SER HG H -0.473 -9.787 8.068 1.00 . A A . 42 SER HG 1 1 5 3125 1 1 42 SER N N 1.590 -8.834 8.833 1.00 . A A . 42 SER N 1 1 5 3126 1 1 42 SER O O 3.000 -11.723 7.438 1.00 . A A . 42 SER O 1 1 5 3127 1 1 42 SER OG O -0.467 -10.329 8.871 1.00 . A A . 42 SER OG 1 1 5 3128 1 1 43 GLY C C 4.861 -8.585 5.686 1.00 . A A . 43 GLY C 1 1 5 3129 1 1 43 GLY CA C 4.792 -9.817 6.558 1.00 . A A . 43 GLY CA 1 1 5 3130 1 1 43 GLY H H 3.711 -8.751 8.018 1.00 . A A . 43 GLY H 1 1 5 3131 1 1 43 GLY HA2 H 5.764 -10.002 6.991 1.00 . A A . 43 GLY HA2 1 1 5 3132 1 1 43 GLY HA3 H 4.503 -10.664 5.954 1.00 . A A . 43 GLY HA3 1 1 5 3133 1 1 43 GLY N N 3.826 -9.639 7.617 1.00 . A A . 43 GLY N 1 1 5 3134 1 1 43 GLY O O 3.950 -7.758 5.718 1.00 . A A . 43 GLY O 1 1 5 3135 1 1 44 LEU C C 5.420 -7.406 2.779 1.00 . A A . 44 LEU C 1 1 5 3136 1 1 44 LEU CA C 6.135 -7.242 4.117 1.00 . A A . 44 LEU CA 1 1 5 3137 1 1 44 LEU CB C 7.625 -6.962 3.887 1.00 . A A . 44 LEU CB 1 1 5 3138 1 1 44 LEU CD1 C 9.991 -7.322 4.632 1.00 . A A . 44 LEU CD1 1 1 5 3139 1 1 44 LEU CD2 C 8.374 -6.161 6.146 1.00 . A A . 44 LEU CD2 1 1 5 3140 1 1 44 LEU CG C 8.539 -7.239 5.083 1.00 . A A . 44 LEU CG 1 1 5 3141 1 1 44 LEU H H 6.672 -9.098 5.003 1.00 . A A . 44 LEU H 1 1 5 3142 1 1 44 LEU HA H 5.699 -6.404 4.642 1.00 . A A . 44 LEU HA 1 1 5 3143 1 1 44 LEU HB2 H 7.960 -7.570 3.059 1.00 . A A . 44 LEU HB2 1 1 5 3144 1 1 44 LEU HB3 H 7.734 -5.923 3.616 1.00 . A A . 44 LEU HB3 1 1 5 3145 1 1 44 LEU HD11 H 10.618 -7.566 5.476 1.00 . A A . 44 LEU HD11 1 1 5 3146 1 1 44 LEU HD12 H 10.090 -8.087 3.876 1.00 . A A . 44 LEU HD12 1 1 5 3147 1 1 44 LEU HD13 H 10.294 -6.369 4.221 1.00 . A A . 44 LEU HD13 1 1 5 3148 1 1 44 LEU HD21 H 7.389 -5.722 6.065 1.00 . A A . 44 LEU HD21 1 1 5 3149 1 1 44 LEU HD22 H 8.492 -6.599 7.126 1.00 . A A . 44 LEU HD22 1 1 5 3150 1 1 44 LEU HD23 H 9.122 -5.396 6.002 1.00 . A A . 44 LEU HD23 1 1 5 3151 1 1 44 LEU HG H 8.271 -8.189 5.522 1.00 . A A . 44 LEU HG 1 1 5 3152 1 1 44 LEU N N 5.952 -8.426 4.951 1.00 . A A . 44 LEU N 1 1 5 3153 1 1 44 LEU O O 5.443 -6.512 1.935 1.00 . A A . 44 LEU O 1 1 5 3154 1 1 45 ARG C C 2.797 -9.699 1.734 1.00 . A A . 45 ARG C 1 1 5 3155 1 1 45 ARG CA C 3.986 -8.807 1.408 1.00 . A A . 45 ARG CA 1 1 5 3156 1 1 45 ARG CB C 4.871 -9.474 0.348 1.00 . A A . 45 ARG CB 1 1 5 3157 1 1 45 ARG CD C 6.921 -10.918 0.487 1.00 . A A . 45 ARG CD 1 1 5 3158 1 1 45 ARG CG C 5.434 -10.819 0.776 1.00 . A A . 45 ARG CG 1 1 5 3159 1 1 45 ARG CZ C 8.677 -11.387 2.157 1.00 . A A . 45 ARG CZ 1 1 5 3160 1 1 45 ARG H H 4.722 -9.181 3.352 1.00 . A A . 45 ARG H 1 1 5 3161 1 1 45 ARG HA H 3.619 -7.866 1.024 1.00 . A A . 45 ARG HA 1 1 5 3162 1 1 45 ARG HB2 H 4.287 -9.623 -0.547 1.00 . A A . 45 ARG HB2 1 1 5 3163 1 1 45 ARG HB3 H 5.698 -8.814 0.121 1.00 . A A . 45 ARG HB3 1 1 5 3164 1 1 45 ARG HD2 H 7.057 -11.333 -0.501 1.00 . A A . 45 ARG HD2 1 1 5 3165 1 1 45 ARG HD3 H 7.349 -9.926 0.521 1.00 . A A . 45 ARG HD3 1 1 5 3166 1 1 45 ARG HE H 7.252 -12.679 1.592 1.00 . A A . 45 ARG HE 1 1 5 3167 1 1 45 ARG HG2 H 5.275 -10.944 1.836 1.00 . A A . 45 ARG HG2 1 1 5 3168 1 1 45 ARG HG3 H 4.919 -11.603 0.239 1.00 . A A . 45 ARG HG3 1 1 5 3169 1 1 45 ARG HH11 H 8.799 -9.535 1.325 1.00 . A A . 45 ARG HH11 1 1 5 3170 1 1 45 ARG HH12 H 10.019 -9.907 2.514 1.00 . A A . 45 ARG HH12 1 1 5 3171 1 1 45 ARG HH21 H 8.851 -13.142 3.157 1.00 . A A . 45 ARG HH21 1 1 5 3172 1 1 45 ARG HH22 H 10.027 -11.932 3.569 1.00 . A A . 45 ARG HH22 1 1 5 3173 1 1 45 ARG N N 4.749 -8.534 2.615 1.00 . A A . 45 ARG N 1 1 5 3174 1 1 45 ARG NE N 7.610 -11.767 1.456 1.00 . A A . 45 ARG NE 1 1 5 3175 1 1 45 ARG NH1 N 9.203 -10.180 1.987 1.00 . A A . 45 ARG NH1 1 1 5 3176 1 1 45 ARG NH2 N 9.231 -12.222 3.025 1.00 . A A . 45 ARG NH2 1 1 5 3177 1 1 45 ARG O O 2.789 -10.378 2.761 1.00 . A A . 45 ARG O 1 1 5 3178 1 1 46 VAL C C 0.338 -11.265 -0.302 1.00 . A A . 46 VAL C 1 1 5 3179 1 1 46 VAL CA C 0.650 -10.565 1.012 1.00 . A A . 46 VAL CA 1 1 5 3180 1 1 46 VAL CB C -0.589 -9.760 1.477 1.00 . A A . 46 VAL CB 1 1 5 3181 1 1 46 VAL CG1 C -1.853 -10.600 1.372 1.00 . A A . 46 VAL CG1 1 1 5 3182 1 1 46 VAL CG2 C -0.402 -9.258 2.903 1.00 . A A . 46 VAL CG2 1 1 5 3183 1 1 46 VAL H H 1.911 -9.191 0.023 1.00 . A A . 46 VAL H 1 1 5 3184 1 1 46 VAL HA H 0.880 -11.309 1.762 1.00 . A A . 46 VAL HA 1 1 5 3185 1 1 46 VAL HB H -0.700 -8.904 0.828 1.00 . A A . 46 VAL HB 1 1 5 3186 1 1 46 VAL HG11 H -2.719 -9.962 1.466 1.00 . A A . 46 VAL HG11 1 1 5 3187 1 1 46 VAL HG12 H -1.876 -11.098 0.413 1.00 . A A . 46 VAL HG12 1 1 5 3188 1 1 46 VAL HG13 H -1.862 -11.338 2.162 1.00 . A A . 46 VAL HG13 1 1 5 3189 1 1 46 VAL HG21 H 0.237 -9.940 3.444 1.00 . A A . 46 VAL HG21 1 1 5 3190 1 1 46 VAL HG22 H 0.052 -8.278 2.882 1.00 . A A . 46 VAL HG22 1 1 5 3191 1 1 46 VAL HG23 H -1.363 -9.198 3.394 1.00 . A A . 46 VAL HG23 1 1 5 3192 1 1 46 VAL N N 1.820 -9.719 0.846 1.00 . A A . 46 VAL N 1 1 5 3193 1 1 46 VAL O O 0.312 -10.579 -1.346 1.00 . A A . 46 VAL O 1 1 5 3194 1 1 46 VAL OXT O 0.145 -12.500 -0.292 1.00 . A A . 46 VAL OXT 1 1 5 3195 2 2 1 ZN ZN ZN -0.074 -0.002 -0.550 1.00 . B A . 47 ZN ZN 1 1 6 3196 1 1 1 GLY C C 9.340 23.255 0.329 1.00 . A A . 1 GLY C 1 1 6 3197 1 1 1 GLY CA C 10.315 24.409 0.270 1.00 . A A . 1 GLY CA 1 1 6 3198 1 1 1 GLY H1 H 11.122 25.837 1.556 1.00 . A A . 1 GLY H1 1 1 6 3199 1 1 1 GLY H2 H 10.307 24.570 2.345 1.00 . A A . 1 GLY H2 1 1 6 3200 1 1 1 GLY H3 H 9.424 25.781 1.556 1.00 . A A . 1 GLY H3 1 1 6 3201 1 1 1 GLY HA2 H 10.056 25.046 -0.561 1.00 . A A . 1 GLY HA2 1 1 6 3202 1 1 1 GLY HA3 H 11.313 24.020 0.118 1.00 . A A . 1 GLY HA3 1 1 6 3203 1 1 1 GLY N N 10.292 25.205 1.516 1.00 . A A . 1 GLY N 1 1 6 3204 1 1 1 GLY O O 8.757 22.983 1.378 1.00 . A A . 1 GLY O 1 1 6 3205 1 1 2 SER C C 9.007 20.197 -1.287 1.00 . A A . 2 SER C 1 1 6 3206 1 1 2 SER CA C 8.247 21.452 -0.867 1.00 . A A . 2 SER CA 1 1 6 3207 1 1 2 SER CB C 7.116 21.755 -1.852 1.00 . A A . 2 SER CB 1 1 6 3208 1 1 2 SER H H 9.650 22.852 -1.602 1.00 . A A . 2 SER H 1 1 6 3209 1 1 2 SER HA H 7.827 21.295 0.116 1.00 . A A . 2 SER HA 1 1 6 3210 1 1 2 SER HB2 H 7.294 21.226 -2.776 1.00 . A A . 2 SER HB2 1 1 6 3211 1 1 2 SER HB3 H 6.177 21.435 -1.430 1.00 . A A . 2 SER HB3 1 1 6 3212 1 1 2 SER HG H 7.359 23.312 -3.028 1.00 . A A . 2 SER HG 1 1 6 3213 1 1 2 SER N N 9.156 22.583 -0.792 1.00 . A A . 2 SER N 1 1 6 3214 1 1 2 SER O O 9.411 20.060 -2.442 1.00 . A A . 2 SER O 1 1 6 3215 1 1 2 SER OG O 7.043 23.146 -2.129 1.00 . A A . 2 SER OG 1 1 6 3216 1 1 3 MET C C 9.147 17.029 -1.163 1.00 . A A . 3 MET C 1 1 6 3217 1 1 3 MET CA C 10.046 18.116 -0.587 1.00 . A A . 3 MET CA 1 1 6 3218 1 1 3 MET CB C 10.734 17.626 0.694 1.00 . A A . 3 MET CB 1 1 6 3219 1 1 3 MET CE C 9.513 14.170 2.694 1.00 . A A . 3 MET CE 1 1 6 3220 1 1 3 MET CG C 9.909 16.645 1.516 1.00 . A A . 3 MET CG 1 1 6 3221 1 1 3 MET H H 8.978 19.520 0.594 1.00 . A A . 3 MET H 1 1 6 3222 1 1 3 MET HA H 10.802 18.361 -1.319 1.00 . A A . 3 MET HA 1 1 6 3223 1 1 3 MET HB2 H 11.659 17.139 0.425 1.00 . A A . 3 MET HB2 1 1 6 3224 1 1 3 MET HB3 H 10.959 18.481 1.314 1.00 . A A . 3 MET HB3 1 1 6 3225 1 1 3 MET HE1 H 9.931 13.738 3.593 1.00 . A A . 3 MET HE1 1 1 6 3226 1 1 3 MET HE2 H 8.698 14.826 2.956 1.00 . A A . 3 MET HE2 1 1 6 3227 1 1 3 MET HE3 H 9.148 13.382 2.051 1.00 . A A . 3 MET HE3 1 1 6 3228 1 1 3 MET HG2 H 9.667 17.107 2.462 1.00 . A A . 3 MET HG2 1 1 6 3229 1 1 3 MET HG3 H 8.997 16.423 0.980 1.00 . A A . 3 MET HG3 1 1 6 3230 1 1 3 MET N N 9.280 19.328 -0.325 1.00 . A A . 3 MET N 1 1 6 3231 1 1 3 MET O O 7.932 17.043 -0.948 1.00 . A A . 3 MET O 1 1 6 3232 1 1 3 MET SD S 10.781 15.097 1.835 1.00 . A A . 3 MET SD 1 1 6 3233 1 1 4 ALA C C 7.889 15.555 -3.420 1.00 . A A . 4 ALA C 1 1 6 3234 1 1 4 ALA CA C 9.020 15.011 -2.546 1.00 . A A . 4 ALA CA 1 1 6 3235 1 1 4 ALA CB C 8.490 14.033 -1.503 1.00 . A A . 4 ALA CB 1 1 6 3236 1 1 4 ALA H H 10.726 16.155 -2.032 1.00 . A A . 4 ALA H 1 1 6 3237 1 1 4 ALA HA H 9.716 14.479 -3.180 1.00 . A A . 4 ALA HA 1 1 6 3238 1 1 4 ALA HB1 H 7.448 13.826 -1.698 1.00 . A A . 4 ALA HB1 1 1 6 3239 1 1 4 ALA HB2 H 9.055 13.114 -1.553 1.00 . A A . 4 ALA HB2 1 1 6 3240 1 1 4 ALA HB3 H 8.594 14.465 -0.518 1.00 . A A . 4 ALA HB3 1 1 6 3241 1 1 4 ALA N N 9.751 16.101 -1.903 1.00 . A A . 4 ALA N 1 1 6 3242 1 1 4 ALA O O 8.074 16.528 -4.151 1.00 . A A . 4 ALA O 1 1 6 3243 1 1 5 ALA C C 4.360 15.571 -3.117 1.00 . A A . 5 ALA C 1 1 6 3244 1 1 5 ALA CA C 5.552 15.437 -4.042 1.00 . A A . 5 ALA CA 1 1 6 3245 1 1 5 ALA CB C 5.236 14.489 -5.188 1.00 . A A . 5 ALA CB 1 1 6 3246 1 1 5 ALA H H 6.598 14.236 -2.660 1.00 . A A . 5 ALA H 1 1 6 3247 1 1 5 ALA HA H 5.787 16.406 -4.457 1.00 . A A . 5 ALA HA 1 1 6 3248 1 1 5 ALA HB1 H 4.240 14.683 -5.555 1.00 . A A . 5 ALA HB1 1 1 6 3249 1 1 5 ALA HB2 H 5.950 14.637 -5.985 1.00 . A A . 5 ALA HB2 1 1 6 3250 1 1 5 ALA HB3 H 5.299 13.469 -4.838 1.00 . A A . 5 ALA HB3 1 1 6 3251 1 1 5 ALA N N 6.709 14.970 -3.300 1.00 . A A . 5 ALA N 1 1 6 3252 1 1 5 ALA O O 4.242 14.840 -2.133 1.00 . A A . 5 ALA O 1 1 6 3253 1 1 6 HIS C C 1.316 15.532 -2.875 1.00 . A A . 6 HIS C 1 1 6 3254 1 1 6 HIS CA C 2.267 16.696 -2.650 1.00 . A A . 6 HIS CA 1 1 6 3255 1 1 6 HIS CB C 1.589 18.013 -3.037 1.00 . A A . 6 HIS CB 1 1 6 3256 1 1 6 HIS CD2 C 1.295 18.739 -0.569 1.00 . A A . 6 HIS CD2 1 1 6 3257 1 1 6 HIS CE1 C -0.421 20.072 -0.829 1.00 . A A . 6 HIS CE1 1 1 6 3258 1 1 6 HIS CG C 0.973 18.734 -1.883 1.00 . A A . 6 HIS CG 1 1 6 3259 1 1 6 HIS H H 3.624 17.051 -4.237 1.00 . A A . 6 HIS H 1 1 6 3260 1 1 6 HIS HA H 2.548 16.728 -1.607 1.00 . A A . 6 HIS HA 1 1 6 3261 1 1 6 HIS HB2 H 2.322 18.669 -3.484 1.00 . A A . 6 HIS HB2 1 1 6 3262 1 1 6 HIS HB3 H 0.810 17.809 -3.757 1.00 . A A . 6 HIS HB3 1 1 6 3263 1 1 6 HIS HD1 H -0.574 19.798 -2.855 1.00 . A A . 6 HIS HD1 1 1 6 3264 1 1 6 HIS HD2 H 2.099 18.186 -0.105 1.00 . A A . 6 HIS HD2 1 1 6 3265 1 1 6 HIS HE1 H -1.228 20.759 -0.625 1.00 . A A . 6 HIS HE1 1 1 6 3266 1 1 6 HIS HE2 H 0.526 19.929 0.981 1.00 . A A . 6 HIS HE2 1 1 6 3267 1 1 6 HIS N N 3.475 16.498 -3.435 1.00 . A A . 6 HIS N 1 1 6 3268 1 1 6 HIS ND1 N -0.107 19.580 -2.011 1.00 . A A . 6 HIS ND1 1 1 6 3269 1 1 6 HIS NE2 N 0.414 19.578 0.065 1.00 . A A . 6 HIS NE2 1 1 6 3270 1 1 6 HIS O O 0.905 14.856 -1.933 1.00 . A A . 6 HIS O 1 1 6 3271 1 1 7 SER C C 1.138 12.903 -4.851 1.00 . A A . 7 SER C 1 1 6 3272 1 1 7 SER CA C 0.246 14.093 -4.505 1.00 . A A . 7 SER CA 1 1 6 3273 1 1 7 SER CB C -0.640 14.457 -5.697 1.00 . A A . 7 SER CB 1 1 6 3274 1 1 7 SER H H 1.498 15.754 -4.847 1.00 . A A . 7 SER H 1 1 6 3275 1 1 7 SER HA H -0.378 13.840 -3.662 1.00 . A A . 7 SER HA 1 1 6 3276 1 1 7 SER HB2 H -0.686 13.620 -6.379 1.00 . A A . 7 SER HB2 1 1 6 3277 1 1 7 SER HB3 H -1.636 14.698 -5.351 1.00 . A A . 7 SER HB3 1 1 6 3278 1 1 7 SER HG H 0.745 15.332 -6.785 1.00 . A A . 7 SER HG 1 1 6 3279 1 1 7 SER N N 1.066 15.233 -4.138 1.00 . A A . 7 SER N 1 1 6 3280 1 1 7 SER O O 1.128 12.412 -5.980 1.00 . A A . 7 SER O 1 1 6 3281 1 1 7 SER OG O -0.108 15.580 -6.384 1.00 . A A . 7 SER OG 1 1 6 3282 1 1 8 ALA C C 2.254 10.047 -4.023 1.00 . A A . 8 ALA C 1 1 6 3283 1 1 8 ALA CA C 2.923 11.415 -4.115 1.00 . A A . 8 ALA CA 1 1 6 3284 1 1 8 ALA CB C 4.062 11.523 -3.121 1.00 . A A . 8 ALA CB 1 1 6 3285 1 1 8 ALA H H 1.957 12.956 -3.028 1.00 . A A . 8 ALA H 1 1 6 3286 1 1 8 ALA HA H 3.332 11.535 -5.108 1.00 . A A . 8 ALA HA 1 1 6 3287 1 1 8 ALA HB1 H 4.964 11.124 -3.563 1.00 . A A . 8 ALA HB1 1 1 6 3288 1 1 8 ALA HB2 H 4.214 12.558 -2.860 1.00 . A A . 8 ALA HB2 1 1 6 3289 1 1 8 ALA HB3 H 3.815 10.959 -2.235 1.00 . A A . 8 ALA HB3 1 1 6 3290 1 1 8 ALA N N 1.963 12.493 -3.895 1.00 . A A . 8 ALA N 1 1 6 3291 1 1 8 ALA O O 2.734 9.144 -3.335 1.00 . A A . 8 ALA O 1 1 6 3292 1 1 9 ASP C C 0.992 7.763 -5.962 1.00 . A A . 9 ASP C 1 1 6 3293 1 1 9 ASP CA C 0.442 8.634 -4.841 1.00 . A A . 9 ASP CA 1 1 6 3294 1 1 9 ASP CB C -1.046 8.914 -5.076 1.00 . A A . 9 ASP CB 1 1 6 3295 1 1 9 ASP CG C -1.954 7.841 -4.504 1.00 . A A . 9 ASP CG 1 1 6 3296 1 1 9 ASP H H 0.888 10.643 -5.336 1.00 . A A . 9 ASP H 1 1 6 3297 1 1 9 ASP HA H 0.565 8.108 -3.900 1.00 . A A . 9 ASP HA 1 1 6 3298 1 1 9 ASP HB2 H -1.304 9.857 -4.615 1.00 . A A . 9 ASP HB2 1 1 6 3299 1 1 9 ASP HB3 H -1.224 8.980 -6.139 1.00 . A A . 9 ASP HB3 1 1 6 3300 1 1 9 ASP N N 1.178 9.891 -4.773 1.00 . A A . 9 ASP N 1 1 6 3301 1 1 9 ASP O O 0.254 7.294 -6.826 1.00 . A A . 9 ASP O 1 1 6 3302 1 1 9 ASP OD1 O -2.133 6.794 -5.158 1.00 . A A . 9 ASP OD1 1 1 6 3303 1 1 9 ASP OD2 O -2.523 8.061 -3.414 1.00 . A A . 9 ASP OD2 1 1 6 3304 1 1 10 LEU C C 2.850 5.197 -6.275 1.00 . A A . 10 LEU C 1 1 6 3305 1 1 10 LEU CA C 2.920 6.599 -6.851 1.00 . A A . 10 LEU CA 1 1 6 3306 1 1 10 LEU CB C 4.372 7.005 -7.118 1.00 . A A . 10 LEU CB 1 1 6 3307 1 1 10 LEU CD1 C 6.018 8.894 -6.998 1.00 . A A . 10 LEU CD1 1 1 6 3308 1 1 10 LEU CD2 C 4.299 8.854 -8.811 1.00 . A A . 10 LEU CD2 1 1 6 3309 1 1 10 LEU CG C 4.595 8.500 -7.362 1.00 . A A . 10 LEU CG 1 1 6 3310 1 1 10 LEU H H 2.819 7.881 -5.173 1.00 . A A . 10 LEU H 1 1 6 3311 1 1 10 LEU HA H 2.361 6.628 -7.775 1.00 . A A . 10 LEU HA 1 1 6 3312 1 1 10 LEU HB2 H 4.969 6.709 -6.267 1.00 . A A . 10 LEU HB2 1 1 6 3313 1 1 10 LEU HB3 H 4.722 6.465 -7.986 1.00 . A A . 10 LEU HB3 1 1 6 3314 1 1 10 LEU HD11 H 6.299 9.782 -7.548 1.00 . A A . 10 LEU HD11 1 1 6 3315 1 1 10 LEU HD12 H 6.077 9.093 -5.939 1.00 . A A . 10 LEU HD12 1 1 6 3316 1 1 10 LEU HD13 H 6.690 8.087 -7.251 1.00 . A A . 10 LEU HD13 1 1 6 3317 1 1 10 LEU HD21 H 3.601 8.137 -9.220 1.00 . A A . 10 LEU HD21 1 1 6 3318 1 1 10 LEU HD22 H 3.870 9.843 -8.858 1.00 . A A . 10 LEU HD22 1 1 6 3319 1 1 10 LEU HD23 H 5.214 8.829 -9.382 1.00 . A A . 10 LEU HD23 1 1 6 3320 1 1 10 LEU HG H 3.922 9.065 -6.735 1.00 . A A . 10 LEU HG 1 1 6 3321 1 1 10 LEU N N 2.289 7.510 -5.911 1.00 . A A . 10 LEU N 1 1 6 3322 1 1 10 LEU O O 2.457 4.245 -6.955 1.00 . A A . 10 LEU O 1 1 6 3323 1 1 11 LYS C C 3.122 4.194 -2.729 1.00 . A A . 11 LYS C 1 1 6 3324 1 1 11 LYS CA C 2.907 3.905 -4.213 1.00 . A A . 11 LYS CA 1 1 6 3325 1 1 11 LYS CB C 3.841 2.789 -4.703 1.00 . A A . 11 LYS CB 1 1 6 3326 1 1 11 LYS CD C 5.951 2.420 -3.410 1.00 . A A . 11 LYS CD 1 1 6 3327 1 1 11 LYS CE C 5.772 0.909 -3.464 1.00 . A A . 11 LYS CE 1 1 6 3328 1 1 11 LYS CG C 5.320 3.113 -4.601 1.00 . A A . 11 LYS CG 1 1 6 3329 1 1 11 LYS H H 3.309 5.937 -4.480 1.00 . A A . 11 LYS H 1 1 6 3330 1 1 11 LYS HA H 1.885 3.587 -4.350 1.00 . A A . 11 LYS HA 1 1 6 3331 1 1 11 LYS HB2 H 3.654 1.903 -4.117 1.00 . A A . 11 LYS HB2 1 1 6 3332 1 1 11 LYS HB3 H 3.613 2.576 -5.737 1.00 . A A . 11 LYS HB3 1 1 6 3333 1 1 11 LYS HD2 H 7.004 2.648 -3.388 1.00 . A A . 11 LYS HD2 1 1 6 3334 1 1 11 LYS HD3 H 5.480 2.791 -2.510 1.00 . A A . 11 LYS HD3 1 1 6 3335 1 1 11 LYS HE2 H 4.830 0.684 -3.949 1.00 . A A . 11 LYS HE2 1 1 6 3336 1 1 11 LYS HE3 H 6.581 0.481 -4.037 1.00 . A A . 11 LYS HE3 1 1 6 3337 1 1 11 LYS HG2 H 5.815 2.784 -5.504 1.00 . A A . 11 LYS HG2 1 1 6 3338 1 1 11 LYS HG3 H 5.439 4.182 -4.492 1.00 . A A . 11 LYS HG3 1 1 6 3339 1 1 11 LYS HZ1 H 6.727 -0.029 -1.858 1.00 . A A . 11 LYS HZ1 1 1 6 3340 1 1 11 LYS HZ2 H 5.107 -0.489 -2.055 1.00 . A A . 11 LYS HZ2 1 1 6 3341 1 1 11 LYS HZ3 H 5.481 1.026 -1.398 1.00 . A A . 11 LYS HZ3 1 1 6 3342 1 1 11 LYS N N 3.087 5.120 -4.971 1.00 . A A . 11 LYS N 1 1 6 3343 1 1 11 LYS NZ N 5.771 0.313 -2.102 1.00 . A A . 11 LYS NZ 1 1 6 3344 1 1 11 LYS O O 3.473 5.313 -2.342 1.00 . A A . 11 LYS O 1 1 6 3345 1 1 12 CYS C C 4.093 2.876 0.141 1.00 . A A . 12 CYS C 1 1 6 3346 1 1 12 CYS CA C 2.766 3.367 -0.466 1.00 . A A . 12 CYS CA 1 1 6 3347 1 1 12 CYS CB C 1.602 2.543 0.080 1.00 . A A . 12 CYS CB 1 1 6 3348 1 1 12 CYS H H 2.385 2.427 -2.305 1.00 . A A . 12 CYS H 1 1 6 3349 1 1 12 CYS HA H 2.616 4.407 -0.219 1.00 . A A . 12 CYS HA 1 1 6 3350 1 1 12 CYS HB2 H 1.453 2.787 1.121 1.00 . A A . 12 CYS HB2 1 1 6 3351 1 1 12 CYS HB3 H 0.708 2.779 -0.476 1.00 . A A . 12 CYS HB3 1 1 6 3352 1 1 12 CYS N N 2.763 3.228 -1.916 1.00 . A A . 12 CYS N 1 1 6 3353 1 1 12 CYS O O 4.991 2.453 -0.587 1.00 . A A . 12 CYS O 1 1 6 3354 1 1 12 CYS SG S 1.881 0.755 -0.040 1.00 . A A . 12 CYS SG 1 1 6 3355 1 1 13 PRO C C 5.556 0.885 2.105 1.00 . A A . 13 PRO C 1 1 6 3356 1 1 13 PRO CA C 5.447 2.410 2.153 1.00 . A A . 13 PRO CA 1 1 6 3357 1 1 13 PRO CB C 5.264 2.872 3.600 1.00 . A A . 13 PRO CB 1 1 6 3358 1 1 13 PRO CD C 3.265 3.444 2.458 1.00 . A A . 13 PRO CD 1 1 6 3359 1 1 13 PRO CG C 3.791 2.959 3.775 1.00 . A A . 13 PRO CG 1 1 6 3360 1 1 13 PRO HA H 6.343 2.851 1.739 1.00 . A A . 13 PRO HA 1 1 6 3361 1 1 13 PRO HB2 H 5.703 2.150 4.274 1.00 . A A . 13 PRO HB2 1 1 6 3362 1 1 13 PRO HB3 H 5.728 3.829 3.734 1.00 . A A . 13 PRO HB3 1 1 6 3363 1 1 13 PRO HD2 H 2.279 3.045 2.276 1.00 . A A . 13 PRO HD2 1 1 6 3364 1 1 13 PRO HD3 H 3.250 4.523 2.432 1.00 . A A . 13 PRO HD3 1 1 6 3365 1 1 13 PRO HG2 H 3.388 1.984 4.008 1.00 . A A . 13 PRO HG2 1 1 6 3366 1 1 13 PRO HG3 H 3.556 3.664 4.557 1.00 . A A . 13 PRO HG3 1 1 6 3367 1 1 13 PRO N N 4.241 2.907 1.484 1.00 . A A . 13 PRO N 1 1 6 3368 1 1 13 PRO O O 6.631 0.323 2.309 1.00 . A A . 13 PRO O 1 1 6 3369 1 1 14 THR C C 5.026 -1.823 0.625 1.00 . A A . 14 THR C 1 1 6 3370 1 1 14 THR CA C 4.372 -1.235 1.880 1.00 . A A . 14 THR CA 1 1 6 3371 1 1 14 THR CB C 2.912 -1.731 1.997 1.00 . A A . 14 THR CB 1 1 6 3372 1 1 14 THR CG2 C 2.804 -3.233 1.768 1.00 . A A . 14 THR CG2 1 1 6 3373 1 1 14 THR H H 3.598 0.738 1.760 1.00 . A A . 14 THR H 1 1 6 3374 1 1 14 THR HA H 4.913 -1.588 2.745 1.00 . A A . 14 THR HA 1 1 6 3375 1 1 14 THR HB H 2.316 -1.225 1.253 1.00 . A A . 14 THR HB 1 1 6 3376 1 1 14 THR HG1 H 1.490 -1.074 3.214 1.00 . A A . 14 THR HG1 1 1 6 3377 1 1 14 THR HG21 H 1.787 -3.550 1.946 1.00 . A A . 14 THR HG21 1 1 6 3378 1 1 14 THR HG22 H 3.465 -3.750 2.447 1.00 . A A . 14 THR HG22 1 1 6 3379 1 1 14 THR HG23 H 3.081 -3.465 0.750 1.00 . A A . 14 THR HG23 1 1 6 3380 1 1 14 THR N N 4.427 0.225 1.889 1.00 . A A . 14 THR N 1 1 6 3381 1 1 14 THR O O 4.622 -1.529 -0.500 1.00 . A A . 14 THR O 1 1 6 3382 1 1 14 THR OG1 O 2.401 -1.417 3.300 1.00 . A A . 14 THR OG1 1 1 6 3383 1 1 15 PRO C C 6.040 -4.279 -1.059 1.00 . A A . 15 PRO C 1 1 6 3384 1 1 15 PRO CA C 6.848 -3.230 -0.299 1.00 . A A . 15 PRO CA 1 1 6 3385 1 1 15 PRO CB C 8.043 -3.894 0.400 1.00 . A A . 15 PRO CB 1 1 6 3386 1 1 15 PRO CD C 6.697 -2.948 2.111 1.00 . A A . 15 PRO CD 1 1 6 3387 1 1 15 PRO CG C 8.116 -3.245 1.736 1.00 . A A . 15 PRO CG 1 1 6 3388 1 1 15 PRO HA H 7.205 -2.481 -0.988 1.00 . A A . 15 PRO HA 1 1 6 3389 1 1 15 PRO HB2 H 7.866 -4.954 0.488 1.00 . A A . 15 PRO HB2 1 1 6 3390 1 1 15 PRO HB3 H 8.941 -3.720 -0.169 1.00 . A A . 15 PRO HB3 1 1 6 3391 1 1 15 PRO HD2 H 6.232 -3.817 2.554 1.00 . A A . 15 PRO HD2 1 1 6 3392 1 1 15 PRO HD3 H 6.647 -2.103 2.780 1.00 . A A . 15 PRO HD3 1 1 6 3393 1 1 15 PRO HG2 H 8.565 -3.918 2.450 1.00 . A A . 15 PRO HG2 1 1 6 3394 1 1 15 PRO HG3 H 8.684 -2.329 1.668 1.00 . A A . 15 PRO HG3 1 1 6 3395 1 1 15 PRO N N 6.091 -2.627 0.809 1.00 . A A . 15 PRO N 1 1 6 3396 1 1 15 PRO O O 6.307 -4.563 -2.228 1.00 . A A . 15 PRO O 1 1 6 3397 1 1 16 GLY C C 3.141 -5.480 -1.714 1.00 . A A . 16 GLY C 1 1 6 3398 1 1 16 GLY CA C 4.341 -5.991 -0.948 1.00 . A A . 16 GLY CA 1 1 6 3399 1 1 16 GLY H H 5.019 -4.719 0.596 1.00 . A A . 16 GLY H 1 1 6 3400 1 1 16 GLY HA2 H 4.975 -6.544 -1.619 1.00 . A A . 16 GLY HA2 1 1 6 3401 1 1 16 GLY HA3 H 3.999 -6.651 -0.164 1.00 . A A . 16 GLY HA3 1 1 6 3402 1 1 16 GLY N N 5.119 -4.923 -0.355 1.00 . A A . 16 GLY N 1 1 6 3403 1 1 16 GLY O O 2.484 -6.236 -2.433 1.00 . A A . 16 GLY O 1 1 6 3404 1 1 17 CYS C C 2.172 -3.214 -3.717 1.00 . A A . 17 CYS C 1 1 6 3405 1 1 17 CYS CA C 1.774 -3.559 -2.288 1.00 . A A . 17 CYS CA 1 1 6 3406 1 1 17 CYS CB C 1.385 -2.265 -1.583 1.00 . A A . 17 CYS CB 1 1 6 3407 1 1 17 CYS H H 3.457 -3.638 -1.025 1.00 . A A . 17 CYS H 1 1 6 3408 1 1 17 CYS HA H 0.933 -4.233 -2.298 1.00 . A A . 17 CYS HA 1 1 6 3409 1 1 17 CYS HB2 H 2.231 -1.917 -1.012 1.00 . A A . 17 CYS HB2 1 1 6 3410 1 1 17 CYS HB3 H 1.145 -1.524 -2.332 1.00 . A A . 17 CYS HB3 1 1 6 3411 1 1 17 CYS N N 2.874 -4.191 -1.585 1.00 . A A . 17 CYS N 1 1 6 3412 1 1 17 CYS O O 3.360 -3.164 -4.050 1.00 . A A . 17 CYS O 1 1 6 3413 1 1 17 CYS SG S -0.028 -2.360 -0.439 1.00 . A A . 17 CYS SG 1 1 6 3414 1 1 18 ASP C C 1.043 -0.732 -5.797 1.00 . A A . 18 ASP C 1 1 6 3415 1 1 18 ASP CA C 1.426 -2.207 -5.797 1.00 . A A . 18 ASP CA 1 1 6 3416 1 1 18 ASP CB C 0.634 -2.961 -6.870 1.00 . A A . 18 ASP CB 1 1 6 3417 1 1 18 ASP CG C -0.752 -2.390 -7.096 1.00 . A A . 18 ASP CG 1 1 6 3418 1 1 18 ASP H H 0.288 -2.711 -4.094 1.00 . A A . 18 ASP H 1 1 6 3419 1 1 18 ASP HA H 2.481 -2.292 -6.010 1.00 . A A . 18 ASP HA 1 1 6 3420 1 1 18 ASP HB2 H 1.175 -2.909 -7.802 1.00 . A A . 18 ASP HB2 1 1 6 3421 1 1 18 ASP HB3 H 0.535 -3.996 -6.576 1.00 . A A . 18 ASP HB3 1 1 6 3422 1 1 18 ASP N N 1.187 -2.774 -4.478 1.00 . A A . 18 ASP N 1 1 6 3423 1 1 18 ASP O O 1.349 0.007 -6.732 1.00 . A A . 18 ASP O 1 1 6 3424 1 1 18 ASP OD1 O -1.612 -2.534 -6.205 1.00 . A A . 18 ASP OD1 1 1 6 3425 1 1 18 ASP OD2 O -0.992 -1.801 -8.167 1.00 . A A . 18 ASP OD2 1 1 6 3426 1 1 19 GLY C C -1.480 1.289 -4.819 1.00 . A A . 19 GLY C 1 1 6 3427 1 1 19 GLY CA C 0.002 1.082 -4.584 1.00 . A A . 19 GLY CA 1 1 6 3428 1 1 19 GLY H H 0.212 -0.932 -3.989 1.00 . A A . 19 GLY H 1 1 6 3429 1 1 19 GLY HA2 H 0.248 1.420 -3.589 1.00 . A A . 19 GLY HA2 1 1 6 3430 1 1 19 GLY HA3 H 0.554 1.673 -5.300 1.00 . A A . 19 GLY HA3 1 1 6 3431 1 1 19 GLY N N 0.397 -0.304 -4.718 1.00 . A A . 19 GLY N 1 1 6 3432 1 1 19 GLY O O -2.059 2.268 -4.355 1.00 . A A . 19 GLY O 1 1 6 3433 1 1 20 SER C C -4.365 -0.407 -4.979 1.00 . A A . 20 SER C 1 1 6 3434 1 1 20 SER CA C -3.509 0.502 -5.860 1.00 . A A . 20 SER CA 1 1 6 3435 1 1 20 SER CB C -3.732 0.171 -7.336 1.00 . A A . 20 SER CB 1 1 6 3436 1 1 20 SER H H -1.600 -0.395 -5.884 1.00 . A A . 20 SER H 1 1 6 3437 1 1 20 SER HA H -3.796 1.527 -5.684 1.00 . A A . 20 SER HA 1 1 6 3438 1 1 20 SER HB2 H -4.052 -0.856 -7.428 1.00 . A A . 20 SER HB2 1 1 6 3439 1 1 20 SER HB3 H -4.492 0.824 -7.741 1.00 . A A . 20 SER HB3 1 1 6 3440 1 1 20 SER HG H -2.032 -0.490 -8.087 1.00 . A A . 20 SER HG 1 1 6 3441 1 1 20 SER N N -2.101 0.375 -5.540 1.00 . A A . 20 SER N 1 1 6 3442 1 1 20 SER O O -3.924 -1.477 -4.555 1.00 . A A . 20 SER O 1 1 6 3443 1 1 20 SER OG O -2.534 0.345 -8.081 1.00 . A A . 20 SER OG 1 1 6 3444 1 1 21 GLY C C -6.534 -0.470 -2.500 1.00 . A A . 21 GLY C 1 1 6 3445 1 1 21 GLY CA C -6.535 -0.785 -3.982 1.00 . A A . 21 GLY CA 1 1 6 3446 1 1 21 GLY H H -5.889 0.876 -5.121 1.00 . A A . 21 GLY H 1 1 6 3447 1 1 21 GLY HA2 H -7.528 -0.615 -4.370 1.00 . A A . 21 GLY HA2 1 1 6 3448 1 1 21 GLY HA3 H -6.283 -1.828 -4.114 1.00 . A A . 21 GLY HA3 1 1 6 3449 1 1 21 GLY N N -5.597 0.022 -4.737 1.00 . A A . 21 GLY N 1 1 6 3450 1 1 21 GLY O O -5.644 0.210 -2.000 1.00 . A A . 21 GLY O 1 1 6 3451 1 1 22 HIS C C -8.285 -2.079 0.237 1.00 . A A . 22 HIS C 1 1 6 3452 1 1 22 HIS CA C -7.681 -0.822 -0.365 1.00 . A A . 22 HIS CA 1 1 6 3453 1 1 22 HIS CB C -8.585 0.366 -0.014 1.00 . A A . 22 HIS CB 1 1 6 3454 1 1 22 HIS CD2 C -7.057 2.419 -0.482 1.00 . A A . 22 HIS CD2 1 1 6 3455 1 1 22 HIS CE1 C -7.299 3.420 1.445 1.00 . A A . 22 HIS CE1 1 1 6 3456 1 1 22 HIS CG C -7.872 1.652 0.275 1.00 . A A . 22 HIS CG 1 1 6 3457 1 1 22 HIS H H -8.217 -1.506 -2.289 1.00 . A A . 22 HIS H 1 1 6 3458 1 1 22 HIS HA H -6.697 -0.662 0.054 1.00 . A A . 22 HIS HA 1 1 6 3459 1 1 22 HIS HB2 H -9.257 0.547 -0.838 1.00 . A A . 22 HIS HB2 1 1 6 3460 1 1 22 HIS HB3 H -9.167 0.109 0.860 1.00 . A A . 22 HIS HB3 1 1 6 3461 1 1 22 HIS HD1 H -8.531 2.004 2.250 1.00 . A A . 22 HIS HD1 1 1 6 3462 1 1 22 HIS HD2 H -6.743 2.213 -1.493 1.00 . A A . 22 HIS HD2 1 1 6 3463 1 1 22 HIS HE1 H -7.220 4.136 2.249 1.00 . A A . 22 HIS HE1 1 1 6 3464 1 1 22 HIS HE2 H -6.340 4.355 -0.096 1.00 . A A . 22 HIS HE2 1 1 6 3465 1 1 22 HIS N N -7.542 -0.975 -1.808 1.00 . A A . 22 HIS N 1 1 6 3466 1 1 22 HIS ND1 N -7.999 2.309 1.478 1.00 . A A . 22 HIS ND1 1 1 6 3467 1 1 22 HIS NE2 N -6.717 3.515 0.269 1.00 . A A . 22 HIS NE2 1 1 6 3468 1 1 22 HIS O O -9.026 -2.796 -0.434 1.00 . A A . 22 HIS O 1 1 6 3469 1 1 23 ILE C C -10.263 -3.060 2.311 1.00 . A A . 23 ILE C 1 1 6 3470 1 1 23 ILE CA C -8.760 -3.332 2.259 1.00 . A A . 23 ILE CA 1 1 6 3471 1 1 23 ILE CB C -8.177 -3.478 3.691 1.00 . A A . 23 ILE CB 1 1 6 3472 1 1 23 ILE CD1 C -7.569 -5.881 3.095 1.00 . A A . 23 ILE CD1 1 1 6 3473 1 1 23 ILE CG1 C -7.118 -4.582 3.727 1.00 . A A . 23 ILE CG1 1 1 6 3474 1 1 23 ILE CG2 C -9.268 -3.753 4.718 1.00 . A A . 23 ILE CG2 1 1 6 3475 1 1 23 ILE H H -7.594 -1.584 2.047 1.00 . A A . 23 ILE H 1 1 6 3476 1 1 23 ILE HA H -8.584 -4.252 1.720 1.00 . A A . 23 ILE HA 1 1 6 3477 1 1 23 ILE HB H -7.708 -2.541 3.956 1.00 . A A . 23 ILE HB 1 1 6 3478 1 1 23 ILE HD11 H -6.933 -6.112 2.254 1.00 . A A . 23 ILE HD11 1 1 6 3479 1 1 23 ILE HD12 H -7.505 -6.677 3.823 1.00 . A A . 23 ILE HD12 1 1 6 3480 1 1 23 ILE HD13 H -8.589 -5.781 2.757 1.00 . A A . 23 ILE HD13 1 1 6 3481 1 1 23 ILE HG12 H -6.241 -4.244 3.199 1.00 . A A . 23 ILE HG12 1 1 6 3482 1 1 23 ILE HG13 H -6.855 -4.787 4.756 1.00 . A A . 23 ILE HG13 1 1 6 3483 1 1 23 ILE HG21 H -10.016 -4.399 4.282 1.00 . A A . 23 ILE HG21 1 1 6 3484 1 1 23 ILE HG22 H -8.838 -4.233 5.585 1.00 . A A . 23 ILE HG22 1 1 6 3485 1 1 23 ILE HG23 H -9.726 -2.820 5.011 1.00 . A A . 23 ILE HG23 1 1 6 3486 1 1 23 ILE N N -8.101 -2.255 1.538 1.00 . A A . 23 ILE N 1 1 6 3487 1 1 23 ILE O O -11.081 -3.967 2.161 1.00 . A A . 23 ILE O 1 1 6 3488 1 1 24 THR C C -12.675 -1.546 1.108 1.00 . A A . 24 THR C 1 1 6 3489 1 1 24 THR CA C -12.004 -1.363 2.475 1.00 . A A . 24 THR CA 1 1 6 3490 1 1 24 THR CB C -12.126 0.112 2.930 1.00 . A A . 24 THR CB 1 1 6 3491 1 1 24 THR CG2 C -11.567 1.062 1.883 1.00 . A A . 24 THR CG2 1 1 6 3492 1 1 24 THR H H -9.903 -1.106 2.534 1.00 . A A . 24 THR H 1 1 6 3493 1 1 24 THR HA H -12.517 -1.976 3.196 1.00 . A A . 24 THR HA 1 1 6 3494 1 1 24 THR HB H -11.557 0.237 3.840 1.00 . A A . 24 THR HB 1 1 6 3495 1 1 24 THR HG1 H -13.917 -0.298 3.664 1.00 . A A . 24 THR HG1 1 1 6 3496 1 1 24 THR HG21 H -10.544 0.793 1.663 1.00 . A A . 24 THR HG21 1 1 6 3497 1 1 24 THR HG22 H -11.599 2.074 2.259 1.00 . A A . 24 THR HG22 1 1 6 3498 1 1 24 THR HG23 H -12.158 0.993 0.982 1.00 . A A . 24 THR HG23 1 1 6 3499 1 1 24 THR N N -10.611 -1.785 2.447 1.00 . A A . 24 THR N 1 1 6 3500 1 1 24 THR O O -13.900 -1.603 1.015 1.00 . A A . 24 THR O 1 1 6 3501 1 1 24 THR OG1 O -13.494 0.440 3.193 1.00 . A A . 24 THR OG1 1 1 6 3502 1 1 25 GLY C C -13.260 -0.681 -1.707 1.00 . A A . 25 GLY C 1 1 6 3503 1 1 25 GLY CA C -12.403 -1.857 -1.282 1.00 . A A . 25 GLY CA 1 1 6 3504 1 1 25 GLY H H -10.898 -1.681 0.197 1.00 . A A . 25 GLY H 1 1 6 3505 1 1 25 GLY HA2 H -11.584 -1.964 -1.976 1.00 . A A . 25 GLY HA2 1 1 6 3506 1 1 25 GLY HA3 H -13.002 -2.755 -1.303 1.00 . A A . 25 GLY HA3 1 1 6 3507 1 1 25 GLY N N -11.867 -1.674 0.058 1.00 . A A . 25 GLY N 1 1 6 3508 1 1 25 GLY O O -14.302 -0.852 -2.340 1.00 . A A . 25 GLY O 1 1 6 3509 1 1 26 ASN C C -12.875 2.810 -2.038 1.00 . A A . 26 ASN C 1 1 6 3510 1 1 26 ASN CA C -13.701 1.693 -1.422 1.00 . A A . 26 ASN CA 1 1 6 3511 1 1 26 ASN CB C -14.275 2.157 -0.082 1.00 . A A . 26 ASN CB 1 1 6 3512 1 1 26 ASN CG C -15.600 1.504 0.244 1.00 . A A . 26 ASN CG 1 1 6 3513 1 1 26 ASN H H -12.127 0.540 -0.622 1.00 . A A . 26 ASN H 1 1 6 3514 1 1 26 ASN HA H -14.513 1.445 -2.089 1.00 . A A . 26 ASN HA 1 1 6 3515 1 1 26 ASN HB2 H -13.575 1.911 0.702 1.00 . A A . 26 ASN HB2 1 1 6 3516 1 1 26 ASN HB3 H -14.418 3.226 -0.104 1.00 . A A . 26 ASN HB3 1 1 6 3517 1 1 26 ASN HD21 H -14.945 1.040 2.062 1.00 . A A . 26 ASN HD21 1 1 6 3518 1 1 26 ASN HD22 H -16.566 0.559 1.696 1.00 . A A . 26 ASN HD22 1 1 6 3519 1 1 26 ASN N N -12.895 0.497 -1.222 1.00 . A A . 26 ASN N 1 1 6 3520 1 1 26 ASN ND2 N -15.716 0.980 1.452 1.00 . A A . 26 ASN ND2 1 1 6 3521 1 1 26 ASN O O -13.306 3.958 -2.088 1.00 . A A . 26 ASN O 1 1 6 3522 1 1 26 ASN OD1 O -16.509 1.459 -0.585 1.00 . A A . 26 ASN OD1 1 1 6 3523 1 1 27 TYR C C -10.157 2.851 -4.332 1.00 . A A . 27 TYR C 1 1 6 3524 1 1 27 TYR CA C -10.768 3.431 -3.070 1.00 . A A . 27 TYR CA 1 1 6 3525 1 1 27 TYR CB C -9.654 3.788 -2.089 1.00 . A A . 27 TYR CB 1 1 6 3526 1 1 27 TYR CD1 C -10.791 4.176 0.138 1.00 . A A . 27 TYR CD1 1 1 6 3527 1 1 27 TYR CD2 C -9.791 6.041 -0.959 1.00 . A A . 27 TYR CD2 1 1 6 3528 1 1 27 TYR CE1 C -11.186 4.995 1.179 1.00 . A A . 27 TYR CE1 1 1 6 3529 1 1 27 TYR CE2 C -10.179 6.864 0.079 1.00 . A A . 27 TYR CE2 1 1 6 3530 1 1 27 TYR CG C -10.091 4.686 -0.950 1.00 . A A . 27 TYR CG 1 1 6 3531 1 1 27 TYR CZ C -10.876 6.337 1.145 1.00 . A A . 27 TYR CZ 1 1 6 3532 1 1 27 TYR H H -11.387 1.536 -2.412 1.00 . A A . 27 TYR H 1 1 6 3533 1 1 27 TYR HA H -11.329 4.320 -3.318 1.00 . A A . 27 TYR HA 1 1 6 3534 1 1 27 TYR HB2 H -9.260 2.879 -1.663 1.00 . A A . 27 TYR HB2 1 1 6 3535 1 1 27 TYR HB3 H -8.869 4.286 -2.626 1.00 . A A . 27 TYR HB3 1 1 6 3536 1 1 27 TYR HD1 H -11.032 3.121 0.163 1.00 . A A . 27 TYR HD1 1 1 6 3537 1 1 27 TYR HD2 H -9.249 6.454 -1.798 1.00 . A A . 27 TYR HD2 1 1 6 3538 1 1 27 TYR HE1 H -11.736 4.582 2.012 1.00 . A A . 27 TYR HE1 1 1 6 3539 1 1 27 TYR HE2 H -9.937 7.917 0.053 1.00 . A A . 27 TYR HE2 1 1 6 3540 1 1 27 TYR HH H -11.934 7.779 1.865 1.00 . A A . 27 TYR HH 1 1 6 3541 1 1 27 TYR N N -11.672 2.467 -2.475 1.00 . A A . 27 TYR N 1 1 6 3542 1 1 27 TYR O O -10.269 1.651 -4.581 1.00 . A A . 27 TYR O 1 1 6 3543 1 1 27 TYR OH O -11.261 7.157 2.184 1.00 . A A . 27 TYR OH 1 1 6 3544 1 1 28 ALA C C -7.307 2.933 -5.999 1.00 . A A . 28 ALA C 1 1 6 3545 1 1 28 ALA CA C -8.774 3.225 -6.283 1.00 . A A . 28 ALA CA 1 1 6 3546 1 1 28 ALA CB C -8.907 4.262 -7.388 1.00 . A A . 28 ALA CB 1 1 6 3547 1 1 28 ALA H H -9.349 4.617 -4.798 1.00 . A A . 28 ALA H 1 1 6 3548 1 1 28 ALA HA H -9.255 2.316 -6.613 1.00 . A A . 28 ALA HA 1 1 6 3549 1 1 28 ALA HB1 H -9.205 3.774 -8.305 1.00 . A A . 28 ALA HB1 1 1 6 3550 1 1 28 ALA HB2 H -9.653 4.992 -7.109 1.00 . A A . 28 ALA HB2 1 1 6 3551 1 1 28 ALA HB3 H -7.958 4.755 -7.535 1.00 . A A . 28 ALA HB3 1 1 6 3552 1 1 28 ALA N N -9.450 3.680 -5.080 1.00 . A A . 28 ALA N 1 1 6 3553 1 1 28 ALA O O -6.730 1.995 -6.548 1.00 . A A . 28 ALA O 1 1 6 3554 1 1 29 SER C C -4.977 4.240 -3.463 1.00 . A A . 29 SER C 1 1 6 3555 1 1 29 SER CA C -5.298 3.569 -4.794 1.00 . A A . 29 SER CA 1 1 6 3556 1 1 29 SER CB C -4.414 4.152 -5.904 1.00 . A A . 29 SER CB 1 1 6 3557 1 1 29 SER H H -7.218 4.460 -4.705 1.00 . A A . 29 SER H 1 1 6 3558 1 1 29 SER HA H -5.100 2.513 -4.707 1.00 . A A . 29 SER HA 1 1 6 3559 1 1 29 SER HB2 H -3.615 4.726 -5.458 1.00 . A A . 29 SER HB2 1 1 6 3560 1 1 29 SER HB3 H -3.992 3.343 -6.484 1.00 . A A . 29 SER HB3 1 1 6 3561 1 1 29 SER HG H -4.532 5.484 -7.338 1.00 . A A . 29 SER HG 1 1 6 3562 1 1 29 SER N N -6.705 3.733 -5.130 1.00 . A A . 29 SER N 1 1 6 3563 1 1 29 SER O O -5.862 4.802 -2.812 1.00 . A A . 29 SER O 1 1 6 3564 1 1 29 SER OG O -5.152 4.999 -6.774 1.00 . A A . 29 SER OG 1 1 6 3565 1 1 30 HIS C C -1.754 4.914 -1.829 1.00 . A A . 30 HIS C 1 1 6 3566 1 1 30 HIS CA C -3.267 4.702 -1.792 1.00 . A A . 30 HIS CA 1 1 6 3567 1 1 30 HIS CB C -3.640 3.790 -0.620 1.00 . A A . 30 HIS CB 1 1 6 3568 1 1 30 HIS CD2 C -1.866 2.051 0.102 1.00 . A A . 30 HIS CD2 1 1 6 3569 1 1 30 HIS CE1 C -2.419 0.405 -1.196 1.00 . A A . 30 HIS CE1 1 1 6 3570 1 1 30 HIS CG C -2.935 2.468 -0.622 1.00 . A A . 30 HIS CG 1 1 6 3571 1 1 30 HIS H H -3.089 3.601 -3.578 1.00 . A A . 30 HIS H 1 1 6 3572 1 1 30 HIS HA H -3.753 5.659 -1.667 1.00 . A A . 30 HIS HA 1 1 6 3573 1 1 30 HIS HB2 H -3.395 4.290 0.297 1.00 . A A . 30 HIS HB2 1 1 6 3574 1 1 30 HIS HB3 H -4.703 3.599 -0.647 1.00 . A A . 30 HIS HB3 1 1 6 3575 1 1 30 HIS HD1 H -4.028 1.380 -2.073 1.00 . A A . 30 HIS HD1 1 1 6 3576 1 1 30 HIS HD2 H -1.336 2.626 0.846 1.00 . A A . 30 HIS HD2 1 1 6 3577 1 1 30 HIS HE1 H -2.437 -0.557 -1.689 1.00 . A A . 30 HIS HE1 1 1 6 3578 1 1 30 HIS N N -3.725 4.122 -3.043 1.00 . A A . 30 HIS N 1 1 6 3579 1 1 30 HIS ND1 N -3.277 1.406 -1.442 1.00 . A A . 30 HIS ND1 1 1 6 3580 1 1 30 HIS NE2 N -1.559 0.758 -0.273 1.00 . A A . 30 HIS NE2 1 1 6 3581 1 1 30 HIS O O -1.060 4.321 -2.655 1.00 . A A . 30 HIS O 1 1 6 3582 1 1 31 ARG C C 0.646 5.856 0.669 1.00 . A A . 31 ARG C 1 1 6 3583 1 1 31 ARG CA C 0.202 5.891 -0.788 1.00 . A A . 31 ARG CA 1 1 6 3584 1 1 31 ARG CB C 0.627 7.210 -1.446 1.00 . A A . 31 ARG CB 1 1 6 3585 1 1 31 ARG CD C 0.392 9.176 0.093 1.00 . A A . 31 ARG CD 1 1 6 3586 1 1 31 ARG CG C -0.219 8.411 -1.065 1.00 . A A . 31 ARG CG 1 1 6 3587 1 1 31 ARG CZ C 2.458 10.532 0.137 1.00 . A A . 31 ARG CZ 1 1 6 3588 1 1 31 ARG H H -1.831 6.103 -0.224 1.00 . A A . 31 ARG H 1 1 6 3589 1 1 31 ARG HA H 0.679 5.075 -1.312 1.00 . A A . 31 ARG HA 1 1 6 3590 1 1 31 ARG HB2 H 1.650 7.422 -1.169 1.00 . A A . 31 ARG HB2 1 1 6 3591 1 1 31 ARG HB3 H 0.577 7.094 -2.512 1.00 . A A . 31 ARG HB3 1 1 6 3592 1 1 31 ARG HD2 H -0.085 10.142 0.166 1.00 . A A . 31 ARG HD2 1 1 6 3593 1 1 31 ARG HD3 H 0.210 8.616 0.994 1.00 . A A . 31 ARG HD3 1 1 6 3594 1 1 31 ARG HE H 2.379 8.575 -0.280 1.00 . A A . 31 ARG HE 1 1 6 3595 1 1 31 ARG HG2 H -0.297 9.070 -1.917 1.00 . A A . 31 ARG HG2 1 1 6 3596 1 1 31 ARG HG3 H -1.204 8.070 -0.780 1.00 . A A . 31 ARG HG3 1 1 6 3597 1 1 31 ARG HH11 H 0.749 11.603 0.382 1.00 . A A . 31 ARG HH11 1 1 6 3598 1 1 31 ARG HH12 H 2.227 12.515 0.533 1.00 . A A . 31 ARG HH12 1 1 6 3599 1 1 31 ARG HH21 H 4.318 9.763 -0.122 1.00 . A A . 31 ARG HH21 1 1 6 3600 1 1 31 ARG HH22 H 4.267 11.468 0.228 1.00 . A A . 31 ARG HH22 1 1 6 3601 1 1 31 ARG N N -1.237 5.692 -0.892 1.00 . A A . 31 ARG N 1 1 6 3602 1 1 31 ARG NE N 1.837 9.368 -0.055 1.00 . A A . 31 ARG NE 1 1 6 3603 1 1 31 ARG NH1 N 1.755 11.638 0.364 1.00 . A A . 31 ARG NH1 1 1 6 3604 1 1 31 ARG NH2 N 3.785 10.592 0.073 1.00 . A A . 31 ARG NH2 1 1 6 3605 1 1 31 ARG O O 1.763 6.259 1.001 1.00 . A A . 31 ARG O 1 1 6 3606 1 1 32 SER C C -0.442 3.917 3.507 1.00 . A A . 32 SER C 1 1 6 3607 1 1 32 SER CA C 0.106 5.224 2.944 1.00 . A A . 32 SER CA 1 1 6 3608 1 1 32 SER CB C -0.464 6.416 3.716 1.00 . A A . 32 SER CB 1 1 6 3609 1 1 32 SER H H -1.070 4.992 1.203 1.00 . A A . 32 SER H 1 1 6 3610 1 1 32 SER HA H 1.177 5.223 3.044 1.00 . A A . 32 SER HA 1 1 6 3611 1 1 32 SER HB2 H -1.227 6.067 4.390 1.00 . A A . 32 SER HB2 1 1 6 3612 1 1 32 SER HB3 H 0.325 6.886 4.280 1.00 . A A . 32 SER HB3 1 1 6 3613 1 1 32 SER HG H -1.691 7.905 3.325 1.00 . A A . 32 SER HG 1 1 6 3614 1 1 32 SER N N -0.212 5.338 1.529 1.00 . A A . 32 SER N 1 1 6 3615 1 1 32 SER O O -1.327 3.303 2.910 1.00 . A A . 32 SER O 1 1 6 3616 1 1 32 SER OG O -1.034 7.377 2.839 1.00 . A A . 32 SER OG 1 1 6 3617 1 1 33 LEU C C -1.613 2.319 6.002 1.00 . A A . 33 LEU C 1 1 6 3618 1 1 33 LEU CA C -0.286 2.217 5.252 1.00 . A A . 33 LEU CA 1 1 6 3619 1 1 33 LEU CB C 0.801 1.763 6.220 1.00 . A A . 33 LEU CB 1 1 6 3620 1 1 33 LEU CD1 C 2.968 0.538 6.420 1.00 . A A . 33 LEU CD1 1 1 6 3621 1 1 33 LEU CD2 C 0.839 -0.726 6.072 1.00 . A A . 33 LEU CD2 1 1 6 3622 1 1 33 LEU CG C 1.599 0.554 5.763 1.00 . A A . 33 LEU CG 1 1 6 3623 1 1 33 LEU H H 0.843 3.989 5.039 1.00 . A A . 33 LEU H 1 1 6 3624 1 1 33 LEU HA H -0.383 1.486 4.466 1.00 . A A . 33 LEU HA 1 1 6 3625 1 1 33 LEU HB2 H 1.485 2.586 6.369 1.00 . A A . 33 LEU HB2 1 1 6 3626 1 1 33 LEU HB3 H 0.338 1.526 7.166 1.00 . A A . 33 LEU HB3 1 1 6 3627 1 1 33 LEU HD11 H 3.485 1.462 6.201 1.00 . A A . 33 LEU HD11 1 1 6 3628 1 1 33 LEU HD12 H 2.851 0.436 7.489 1.00 . A A . 33 LEU HD12 1 1 6 3629 1 1 33 LEU HD13 H 3.541 -0.295 6.039 1.00 . A A . 33 LEU HD13 1 1 6 3630 1 1 33 LEU HD21 H 0.065 -0.873 5.334 1.00 . A A . 33 LEU HD21 1 1 6 3631 1 1 33 LEU HD22 H 1.522 -1.564 6.050 1.00 . A A . 33 LEU HD22 1 1 6 3632 1 1 33 LEU HD23 H 0.395 -0.652 7.052 1.00 . A A . 33 LEU HD23 1 1 6 3633 1 1 33 LEU HG H 1.741 0.614 4.693 1.00 . A A . 33 LEU HG 1 1 6 3634 1 1 33 LEU N N 0.101 3.484 4.640 1.00 . A A . 33 LEU N 1 1 6 3635 1 1 33 LEU O O -1.821 1.642 7.009 1.00 . A A . 33 LEU O 1 1 6 3636 1 1 34 SER C C -4.840 2.412 5.444 1.00 . A A . 34 SER C 1 1 6 3637 1 1 34 SER CA C -3.816 3.319 6.116 1.00 . A A . 34 SER CA 1 1 6 3638 1 1 34 SER CB C -4.251 4.780 6.002 1.00 . A A . 34 SER CB 1 1 6 3639 1 1 34 SER H H -2.297 3.657 4.694 1.00 . A A . 34 SER H 1 1 6 3640 1 1 34 SER HA H -3.737 3.050 7.157 1.00 . A A . 34 SER HA 1 1 6 3641 1 1 34 SER HB2 H -5.204 4.830 5.494 1.00 . A A . 34 SER HB2 1 1 6 3642 1 1 34 SER HB3 H -4.345 5.205 6.990 1.00 . A A . 34 SER HB3 1 1 6 3643 1 1 34 SER HG H -2.954 6.251 5.821 1.00 . A A . 34 SER HG 1 1 6 3644 1 1 34 SER N N -2.512 3.149 5.504 1.00 . A A . 34 SER N 1 1 6 3645 1 1 34 SER O O -5.890 2.109 6.012 1.00 . A A . 34 SER O 1 1 6 3646 1 1 34 SER OG O -3.296 5.535 5.265 1.00 . A A . 34 SER OG 1 1 6 3647 1 1 35 GLY C C -4.816 0.136 2.639 1.00 . A A . 35 GLY C 1 1 6 3648 1 1 35 GLY CA C -5.488 1.213 3.456 1.00 . A A . 35 GLY CA 1 1 6 3649 1 1 35 GLY H H -3.719 2.326 3.787 1.00 . A A . 35 GLY H 1 1 6 3650 1 1 35 GLY HA2 H -6.176 0.748 4.142 1.00 . A A . 35 GLY HA2 1 1 6 3651 1 1 35 GLY HA3 H -6.043 1.857 2.793 1.00 . A A . 35 GLY HA3 1 1 6 3652 1 1 35 GLY N N -4.552 2.020 4.208 1.00 . A A . 35 GLY N 1 1 6 3653 1 1 35 GLY O O -5.347 -0.276 1.607 1.00 . A A . 35 GLY O 1 1 6 3654 1 1 36 CYS C C -3.718 -2.671 2.358 1.00 . A A . 36 CYS C 1 1 6 3655 1 1 36 CYS CA C -2.917 -1.371 2.413 1.00 . A A . 36 CYS CA 1 1 6 3656 1 1 36 CYS CB C -1.585 -1.627 3.122 1.00 . A A . 36 CYS CB 1 1 6 3657 1 1 36 CYS H H -3.293 0.053 3.929 1.00 . A A . 36 CYS H 1 1 6 3658 1 1 36 CYS HA H -2.721 -1.035 1.407 1.00 . A A . 36 CYS HA 1 1 6 3659 1 1 36 CYS HB2 H -1.749 -1.628 4.191 1.00 . A A . 36 CYS HB2 1 1 6 3660 1 1 36 CYS HB3 H -1.207 -2.594 2.821 1.00 . A A . 36 CYS HB3 1 1 6 3661 1 1 36 CYS N N -3.659 -0.324 3.101 1.00 . A A . 36 CYS N 1 1 6 3662 1 1 36 CYS O O -3.975 -3.299 3.388 1.00 . A A . 36 CYS O 1 1 6 3663 1 1 36 CYS SG S -0.299 -0.392 2.766 1.00 . A A . 36 CYS SG 1 1 6 3664 1 1 37 PRO C C -3.807 -5.564 1.039 1.00 . A A . 37 PRO C 1 1 6 3665 1 1 37 PRO CA C -4.769 -4.386 0.953 1.00 . A A . 37 PRO CA 1 1 6 3666 1 1 37 PRO CB C -5.351 -4.256 -0.451 1.00 . A A . 37 PRO CB 1 1 6 3667 1 1 37 PRO CD C -3.799 -2.445 -0.137 1.00 . A A . 37 PRO CD 1 1 6 3668 1 1 37 PRO CG C -4.410 -3.354 -1.173 1.00 . A A . 37 PRO CG 1 1 6 3669 1 1 37 PRO HA H -5.566 -4.517 1.670 1.00 . A A . 37 PRO HA 1 1 6 3670 1 1 37 PRO HB2 H -5.402 -5.230 -0.914 1.00 . A A . 37 PRO HB2 1 1 6 3671 1 1 37 PRO HB3 H -6.341 -3.827 -0.395 1.00 . A A . 37 PRO HB3 1 1 6 3672 1 1 37 PRO HD2 H -2.735 -2.351 -0.298 1.00 . A A . 37 PRO HD2 1 1 6 3673 1 1 37 PRO HD3 H -4.271 -1.475 -0.167 1.00 . A A . 37 PRO HD3 1 1 6 3674 1 1 37 PRO HG2 H -3.643 -3.941 -1.654 1.00 . A A . 37 PRO HG2 1 1 6 3675 1 1 37 PRO HG3 H -4.953 -2.774 -1.906 1.00 . A A . 37 PRO HG3 1 1 6 3676 1 1 37 PRO N N -4.075 -3.121 1.144 1.00 . A A . 37 PRO N 1 1 6 3677 1 1 37 PRO O O -4.221 -6.722 1.090 1.00 . A A . 37 PRO O 1 1 6 3678 1 1 38 ARG C C -0.573 -5.895 2.402 1.00 . A A . 38 ARG C 1 1 6 3679 1 1 38 ARG CA C -1.485 -6.260 1.242 1.00 . A A . 38 ARG CA 1 1 6 3680 1 1 38 ARG CB C -0.662 -6.393 -0.037 1.00 . A A . 38 ARG CB 1 1 6 3681 1 1 38 ARG CD C -1.272 -6.424 -2.450 1.00 . A A . 38 ARG CD 1 1 6 3682 1 1 38 ARG CG C -1.352 -7.174 -1.135 1.00 . A A . 38 ARG CG 1 1 6 3683 1 1 38 ARG CZ C -2.795 -5.139 -3.905 1.00 . A A . 38 ARG CZ 1 1 6 3684 1 1 38 ARG H H -2.258 -4.302 1.066 1.00 . A A . 38 ARG H 1 1 6 3685 1 1 38 ARG HA H -1.967 -7.203 1.456 1.00 . A A . 38 ARG HA 1 1 6 3686 1 1 38 ARG HB2 H -0.447 -5.409 -0.421 1.00 . A A . 38 ARG HB2 1 1 6 3687 1 1 38 ARG HB3 H 0.270 -6.887 0.202 1.00 . A A . 38 ARG HB3 1 1 6 3688 1 1 38 ARG HD2 H -0.691 -5.526 -2.297 1.00 . A A . 38 ARG HD2 1 1 6 3689 1 1 38 ARG HD3 H -0.779 -7.048 -3.174 1.00 . A A . 38 ARG HD3 1 1 6 3690 1 1 38 ARG HE H -3.375 -6.496 -2.544 1.00 . A A . 38 ARG HE 1 1 6 3691 1 1 38 ARG HG2 H -0.869 -8.134 -1.247 1.00 . A A . 38 ARG HG2 1 1 6 3692 1 1 38 ARG HG3 H -2.390 -7.315 -0.871 1.00 . A A . 38 ARG HG3 1 1 6 3693 1 1 38 ARG HH11 H -0.822 -4.849 -4.278 1.00 . A A . 38 ARG HH11 1 1 6 3694 1 1 38 ARG HH12 H -1.908 -3.871 -5.225 1.00 . A A . 38 ARG HH12 1 1 6 3695 1 1 38 ARG HH21 H -4.823 -5.257 -3.834 1.00 . A A . 38 ARG HH21 1 1 6 3696 1 1 38 ARG HH22 H -4.177 -4.128 -4.993 1.00 . A A . 38 ARG HH22 1 1 6 3697 1 1 38 ARG N N -2.520 -5.250 1.092 1.00 . A A . 38 ARG N 1 1 6 3698 1 1 38 ARG NE N -2.594 -6.051 -2.953 1.00 . A A . 38 ARG NE 1 1 6 3699 1 1 38 ARG NH1 N -1.759 -4.578 -4.517 1.00 . A A . 38 ARG NH1 1 1 6 3700 1 1 38 ARG NH2 N -4.028 -4.815 -4.270 1.00 . A A . 38 ARG NH2 1 1 6 3701 1 1 38 ARG O O 0.650 -6.040 2.317 1.00 . A A . 38 ARG O 1 1 6 3702 1 1 39 ALA C C 0.372 -6.212 5.196 1.00 . A A . 39 ALA C 1 1 6 3703 1 1 39 ALA CA C -0.426 -5.029 4.672 1.00 . A A . 39 ALA CA 1 1 6 3704 1 1 39 ALA CB C -1.364 -4.498 5.745 1.00 . A A . 39 ALA CB 1 1 6 3705 1 1 39 ALA H H -2.151 -5.330 3.491 1.00 . A A . 39 ALA H 1 1 6 3706 1 1 39 ALA HA H 0.258 -4.237 4.394 1.00 . A A . 39 ALA HA 1 1 6 3707 1 1 39 ALA HB1 H -1.411 -3.420 5.684 1.00 . A A . 39 ALA HB1 1 1 6 3708 1 1 39 ALA HB2 H -2.350 -4.910 5.595 1.00 . A A . 39 ALA HB2 1 1 6 3709 1 1 39 ALA HB3 H -0.998 -4.788 6.718 1.00 . A A . 39 ALA HB3 1 1 6 3710 1 1 39 ALA N N -1.175 -5.414 3.484 1.00 . A A . 39 ALA N 1 1 6 3711 1 1 39 ALA O O -0.047 -7.359 5.047 1.00 . A A . 39 ALA O 1 1 6 3712 1 1 40 LYS C C 1.826 -7.904 7.172 1.00 . A A . 40 LYS C 1 1 6 3713 1 1 40 LYS CA C 2.483 -6.958 6.173 1.00 . A A . 40 LYS CA 1 1 6 3714 1 1 40 LYS CB C 3.720 -6.319 6.807 1.00 . A A . 40 LYS CB 1 1 6 3715 1 1 40 LYS CD C 5.246 -4.611 5.770 1.00 . A A . 40 LYS CD 1 1 6 3716 1 1 40 LYS CE C 4.390 -3.850 4.771 1.00 . A A . 40 LYS CE 1 1 6 3717 1 1 40 LYS CG C 4.855 -6.079 5.825 1.00 . A A . 40 LYS CG 1 1 6 3718 1 1 40 LYS H H 1.843 -4.989 5.745 1.00 . A A . 40 LYS H 1 1 6 3719 1 1 40 LYS HA H 2.789 -7.528 5.310 1.00 . A A . 40 LYS HA 1 1 6 3720 1 1 40 LYS HB2 H 3.438 -5.370 7.236 1.00 . A A . 40 LYS HB2 1 1 6 3721 1 1 40 LYS HB3 H 4.080 -6.968 7.591 1.00 . A A . 40 LYS HB3 1 1 6 3722 1 1 40 LYS HD2 H 5.113 -4.175 6.748 1.00 . A A . 40 LYS HD2 1 1 6 3723 1 1 40 LYS HD3 H 6.281 -4.536 5.475 1.00 . A A . 40 LYS HD3 1 1 6 3724 1 1 40 LYS HE2 H 4.936 -3.761 3.844 1.00 . A A . 40 LYS HE2 1 1 6 3725 1 1 40 LYS HE3 H 3.481 -4.407 4.601 1.00 . A A . 40 LYS HE3 1 1 6 3726 1 1 40 LYS HG2 H 5.714 -6.657 6.135 1.00 . A A . 40 LYS HG2 1 1 6 3727 1 1 40 LYS HG3 H 4.542 -6.397 4.842 1.00 . A A . 40 LYS HG3 1 1 6 3728 1 1 40 LYS HZ1 H 4.845 -1.841 5.117 1.00 . A A . 40 LYS HZ1 1 1 6 3729 1 1 40 LYS HZ2 H 3.806 -2.519 6.272 1.00 . A A . 40 LYS HZ2 1 1 6 3730 1 1 40 LYS HZ3 H 3.217 -2.122 4.731 1.00 . A A . 40 LYS HZ3 1 1 6 3731 1 1 40 LYS N N 1.558 -5.926 5.715 1.00 . A A . 40 LYS N 1 1 6 3732 1 1 40 LYS NZ N 4.039 -2.491 5.255 1.00 . A A . 40 LYS NZ 1 1 6 3733 1 1 40 LYS O O 1.752 -7.616 8.369 1.00 . A A . 40 LYS O 1 1 6 3734 1 1 41 LYS C C 1.910 -11.020 7.997 1.00 . A A . 41 LYS C 1 1 6 3735 1 1 41 LYS CA C 0.812 -10.082 7.516 1.00 . A A . 41 LYS CA 1 1 6 3736 1 1 41 LYS CB C -0.245 -10.867 6.739 1.00 . A A . 41 LYS CB 1 1 6 3737 1 1 41 LYS CD C -2.112 -9.639 5.601 1.00 . A A . 41 LYS CD 1 1 6 3738 1 1 41 LYS CE C -3.392 -8.845 5.808 1.00 . A A . 41 LYS CE 1 1 6 3739 1 1 41 LYS CG C -1.652 -10.309 6.883 1.00 . A A . 41 LYS CG 1 1 6 3740 1 1 41 LYS H H 1.513 -9.231 5.716 1.00 . A A . 41 LYS H 1 1 6 3741 1 1 41 LYS HA H 0.351 -9.602 8.366 1.00 . A A . 41 LYS HA 1 1 6 3742 1 1 41 LYS HB2 H 0.017 -10.862 5.692 1.00 . A A . 41 LYS HB2 1 1 6 3743 1 1 41 LYS HB3 H -0.250 -11.887 7.094 1.00 . A A . 41 LYS HB3 1 1 6 3744 1 1 41 LYS HD2 H -1.335 -8.970 5.261 1.00 . A A . 41 LYS HD2 1 1 6 3745 1 1 41 LYS HD3 H -2.287 -10.398 4.854 1.00 . A A . 41 LYS HD3 1 1 6 3746 1 1 41 LYS HE2 H -4.074 -9.434 6.404 1.00 . A A . 41 LYS HE2 1 1 6 3747 1 1 41 LYS HE3 H -3.152 -7.933 6.333 1.00 . A A . 41 LYS HE3 1 1 6 3748 1 1 41 LYS HG2 H -2.328 -11.117 7.119 1.00 . A A . 41 LYS HG2 1 1 6 3749 1 1 41 LYS HG3 H -1.662 -9.582 7.682 1.00 . A A . 41 LYS HG3 1 1 6 3750 1 1 41 LYS HZ1 H -3.526 -8.920 3.717 1.00 . A A . 41 LYS HZ1 1 1 6 3751 1 1 41 LYS HZ2 H -4.079 -7.464 4.395 1.00 . A A . 41 LYS HZ2 1 1 6 3752 1 1 41 LYS HZ3 H -5.032 -8.863 4.503 1.00 . A A . 41 LYS HZ3 1 1 6 3753 1 1 41 LYS N N 1.395 -9.052 6.676 1.00 . A A . 41 LYS N 1 1 6 3754 1 1 41 LYS NZ N -4.052 -8.499 4.517 1.00 . A A . 41 LYS NZ 1 1 6 3755 1 1 41 LYS O O 3.093 -10.759 7.766 1.00 . A A . 41 LYS O 1 1 6 3756 1 1 42 SER C C 3.216 -13.704 7.811 1.00 . A A . 42 SER C 1 1 6 3757 1 1 42 SER CA C 2.487 -13.138 9.024 1.00 . A A . 42 SER CA 1 1 6 3758 1 1 42 SER CB C 1.774 -14.249 9.793 1.00 . A A . 42 SER CB 1 1 6 3759 1 1 42 SER H H 0.568 -12.313 8.721 1.00 . A A . 42 SER H 1 1 6 3760 1 1 42 SER HA H 3.205 -12.659 9.674 1.00 . A A . 42 SER HA 1 1 6 3761 1 1 42 SER HB2 H 1.776 -15.154 9.204 1.00 . A A . 42 SER HB2 1 1 6 3762 1 1 42 SER HB3 H 2.289 -14.423 10.727 1.00 . A A . 42 SER HB3 1 1 6 3763 1 1 42 SER HG H 0.398 -13.420 10.928 1.00 . A A . 42 SER HG 1 1 6 3764 1 1 42 SER N N 1.524 -12.136 8.598 1.00 . A A . 42 SER N 1 1 6 3765 1 1 42 SER O O 4.440 -13.818 7.803 1.00 . A A . 42 SER O 1 1 6 3766 1 1 42 SER OG O 0.430 -13.882 10.073 1.00 . A A . 42 SER OG 1 1 6 3767 1 1 43 GLY C C 2.875 -13.283 4.414 1.00 . A A . 43 GLY C 1 1 6 3768 1 1 43 GLY CA C 3.053 -14.333 5.487 1.00 . A A . 43 GLY CA 1 1 6 3769 1 1 43 GLY H H 1.501 -13.712 6.779 1.00 . A A . 43 GLY H 1 1 6 3770 1 1 43 GLY HA2 H 4.108 -14.516 5.634 1.00 . A A . 43 GLY HA2 1 1 6 3771 1 1 43 GLY HA3 H 2.578 -15.246 5.161 1.00 . A A . 43 GLY HA3 1 1 6 3772 1 1 43 GLY N N 2.465 -13.917 6.739 1.00 . A A . 43 GLY N 1 1 6 3773 1 1 43 GLY O O 1.971 -13.389 3.591 1.00 . A A . 43 GLY O 1 1 6 3774 1 1 44 LEU C C 3.782 -11.666 2.066 1.00 . A A . 44 LEU C 1 1 6 3775 1 1 44 LEU CA C 3.620 -11.144 3.488 1.00 . A A . 44 LEU CA 1 1 6 3776 1 1 44 LEU CB C 4.679 -10.076 3.768 1.00 . A A . 44 LEU CB 1 1 6 3777 1 1 44 LEU CD1 C 7.155 -10.394 4.019 1.00 . A A . 44 LEU CD1 1 1 6 3778 1 1 44 LEU CD2 C 5.782 -9.631 5.966 1.00 . A A . 44 LEU CD2 1 1 6 3779 1 1 44 LEU CG C 5.805 -10.493 4.716 1.00 . A A . 44 LEU CG 1 1 6 3780 1 1 44 LEU H H 4.368 -12.192 5.176 1.00 . A A . 44 LEU H 1 1 6 3781 1 1 44 LEU HA H 2.640 -10.699 3.583 1.00 . A A . 44 LEU HA 1 1 6 3782 1 1 44 LEU HB2 H 5.121 -9.789 2.826 1.00 . A A . 44 LEU HB2 1 1 6 3783 1 1 44 LEU HB3 H 4.186 -9.214 4.190 1.00 . A A . 44 LEU HB3 1 1 6 3784 1 1 44 LEU HD11 H 7.900 -10.915 4.602 1.00 . A A . 44 LEU HD11 1 1 6 3785 1 1 44 LEU HD12 H 7.086 -10.843 3.039 1.00 . A A . 44 LEU HD12 1 1 6 3786 1 1 44 LEU HD13 H 7.434 -9.357 3.921 1.00 . A A . 44 LEU HD13 1 1 6 3787 1 1 44 LEU HD21 H 6.645 -9.857 6.575 1.00 . A A . 44 LEU HD21 1 1 6 3788 1 1 44 LEU HD22 H 5.804 -8.588 5.685 1.00 . A A . 44 LEU HD22 1 1 6 3789 1 1 44 LEU HD23 H 4.882 -9.834 6.527 1.00 . A A . 44 LEU HD23 1 1 6 3790 1 1 44 LEU HG H 5.659 -11.521 5.015 1.00 . A A . 44 LEU HG 1 1 6 3791 1 1 44 LEU N N 3.706 -12.241 4.456 1.00 . A A . 44 LEU N 1 1 6 3792 1 1 44 LEU O O 3.063 -11.257 1.155 1.00 . A A . 44 LEU O 1 1 6 3793 1 1 45 ARG C C 4.293 -14.802 0.847 1.00 . A A . 45 ARG C 1 1 6 3794 1 1 45 ARG CA C 4.751 -13.369 0.651 1.00 . A A . 45 ARG CA 1 1 6 3795 1 1 45 ARG CB C 6.188 -13.344 0.110 1.00 . A A . 45 ARG CB 1 1 6 3796 1 1 45 ARG CD C 7.706 -14.216 1.915 1.00 . A A . 45 ARG CD 1 1 6 3797 1 1 45 ARG CG C 7.242 -12.991 1.145 1.00 . A A . 45 ARG CG 1 1 6 3798 1 1 45 ARG CZ C 7.598 -14.412 4.372 1.00 . A A . 45 ARG CZ 1 1 6 3799 1 1 45 ARG H H 5.090 -13.024 2.703 1.00 . A A . 45 ARG H 1 1 6 3800 1 1 45 ARG HA H 4.093 -12.888 -0.060 1.00 . A A . 45 ARG HA 1 1 6 3801 1 1 45 ARG HB2 H 6.424 -14.319 -0.292 1.00 . A A . 45 ARG HB2 1 1 6 3802 1 1 45 ARG HB3 H 6.243 -12.617 -0.688 1.00 . A A . 45 ARG HB3 1 1 6 3803 1 1 45 ARG HD2 H 6.893 -14.925 1.963 1.00 . A A . 45 ARG HD2 1 1 6 3804 1 1 45 ARG HD3 H 8.541 -14.660 1.392 1.00 . A A . 45 ARG HD3 1 1 6 3805 1 1 45 ARG HE H 8.828 -13.187 3.366 1.00 . A A . 45 ARG HE 1 1 6 3806 1 1 45 ARG HG2 H 8.093 -12.554 0.641 1.00 . A A . 45 ARG HG2 1 1 6 3807 1 1 45 ARG HG3 H 6.826 -12.276 1.838 1.00 . A A . 45 ARG HG3 1 1 6 3808 1 1 45 ARG HH11 H 6.387 -15.720 3.394 1.00 . A A . 45 ARG HH11 1 1 6 3809 1 1 45 ARG HH12 H 6.310 -15.781 5.133 1.00 . A A . 45 ARG HH12 1 1 6 3810 1 1 45 ARG HH21 H 8.690 -13.262 5.647 1.00 . A A . 45 ARG HH21 1 1 6 3811 1 1 45 ARG HH22 H 7.602 -14.398 6.399 1.00 . A A . 45 ARG HH22 1 1 6 3812 1 1 45 ARG N N 4.634 -12.665 1.915 1.00 . A A . 45 ARG N 1 1 6 3813 1 1 45 ARG NE N 8.119 -13.874 3.272 1.00 . A A . 45 ARG NE 1 1 6 3814 1 1 45 ARG NH1 N 6.690 -15.376 4.289 1.00 . A A . 45 ARG NH1 1 1 6 3815 1 1 45 ARG NH2 N 7.993 -13.990 5.567 1.00 . A A . 45 ARG NH2 1 1 6 3816 1 1 45 ARG O O 4.340 -15.323 1.964 1.00 . A A . 45 ARG O 1 1 6 3817 1 1 46 VAL C C 4.566 -17.759 -0.239 1.00 . A A . 46 VAL C 1 1 6 3818 1 1 46 VAL CA C 3.386 -16.807 -0.136 1.00 . A A . 46 VAL CA 1 1 6 3819 1 1 46 VAL CB C 2.351 -17.144 -1.228 1.00 . A A . 46 VAL CB 1 1 6 3820 1 1 46 VAL CG1 C 0.942 -17.075 -0.659 1.00 . A A . 46 VAL CG1 1 1 6 3821 1 1 46 VAL CG2 C 2.493 -16.212 -2.423 1.00 . A A . 46 VAL CG2 1 1 6 3822 1 1 46 VAL H H 3.819 -14.969 -1.079 1.00 . A A . 46 VAL H 1 1 6 3823 1 1 46 VAL HA H 2.915 -16.944 0.828 1.00 . A A . 46 VAL HA 1 1 6 3824 1 1 46 VAL HB H 2.531 -18.154 -1.563 1.00 . A A . 46 VAL HB 1 1 6 3825 1 1 46 VAL HG11 H 0.421 -16.232 -1.087 1.00 . A A . 46 VAL HG11 1 1 6 3826 1 1 46 VAL HG12 H 0.413 -17.984 -0.898 1.00 . A A . 46 VAL HG12 1 1 6 3827 1 1 46 VAL HG13 H 0.993 -16.959 0.415 1.00 . A A . 46 VAL HG13 1 1 6 3828 1 1 46 VAL HG21 H 1.975 -16.635 -3.271 1.00 . A A . 46 VAL HG21 1 1 6 3829 1 1 46 VAL HG22 H 2.066 -15.250 -2.182 1.00 . A A . 46 VAL HG22 1 1 6 3830 1 1 46 VAL HG23 H 3.539 -16.093 -2.664 1.00 . A A . 46 VAL HG23 1 1 6 3831 1 1 46 VAL N N 3.839 -15.432 -0.217 1.00 . A A . 46 VAL N 1 1 6 3832 1 1 46 VAL O O 4.720 -18.617 0.652 1.00 . A A . 46 VAL O 1 1 6 3833 1 1 46 VAL OXT O 5.355 -17.624 -1.199 1.00 . A A . 46 VAL OXT 1 1 6 3834 2 2 1 ZN ZN ZN -0.077 -0.285 0.489 1.00 . B A . 47 ZN ZN 1 1 7 3835 1 1 1 GLY C C 11.971 12.845 -15.162 1.00 . A A . 1 GLY C 1 1 7 3836 1 1 1 GLY CA C 12.640 13.074 -16.497 1.00 . A A . 1 GLY CA 1 1 7 3837 1 1 1 GLY H1 H 13.929 11.489 -16.088 1.00 . A A . 1 GLY H1 1 1 7 3838 1 1 1 GLY H2 H 14.690 13.003 -16.130 1.00 . A A . 1 GLY H2 1 1 7 3839 1 1 1 GLY H3 H 14.220 12.250 -17.575 1.00 . A A . 1 GLY H3 1 1 7 3840 1 1 1 GLY HA2 H 12.774 14.135 -16.646 1.00 . A A . 1 GLY HA2 1 1 7 3841 1 1 1 GLY HA3 H 12.004 12.687 -17.279 1.00 . A A . 1 GLY HA3 1 1 7 3842 1 1 1 GLY N N 13.960 12.408 -16.579 1.00 . A A . 1 GLY N 1 1 7 3843 1 1 1 GLY O O 12.645 12.694 -14.142 1.00 . A A . 1 GLY O 1 1 7 3844 1 1 2 SER C C 9.655 11.070 -13.721 1.00 . A A . 2 SER C 1 1 7 3845 1 1 2 SER CA C 9.894 12.561 -13.948 1.00 . A A . 2 SER CA 1 1 7 3846 1 1 2 SER CB C 8.563 13.310 -14.011 1.00 . A A . 2 SER CB 1 1 7 3847 1 1 2 SER H H 10.164 12.891 -16.016 1.00 . A A . 2 SER H 1 1 7 3848 1 1 2 SER HA H 10.474 12.949 -13.124 1.00 . A A . 2 SER HA 1 1 7 3849 1 1 2 SER HB2 H 7.760 12.604 -14.159 1.00 . A A . 2 SER HB2 1 1 7 3850 1 1 2 SER HB3 H 8.407 13.844 -13.086 1.00 . A A . 2 SER HB3 1 1 7 3851 1 1 2 SER HG H 9.153 14.978 -14.868 1.00 . A A . 2 SER HG 1 1 7 3852 1 1 2 SER N N 10.649 12.789 -15.167 1.00 . A A . 2 SER N 1 1 7 3853 1 1 2 SER O O 8.714 10.491 -14.274 1.00 . A A . 2 SER O 1 1 7 3854 1 1 2 SER OG O 8.556 14.241 -15.083 1.00 . A A . 2 SER OG 1 1 7 3855 1 1 3 MET C C 10.736 8.140 -13.745 1.00 . A A . 3 MET C 1 1 7 3856 1 1 3 MET CA C 10.426 9.046 -12.552 1.00 . A A . 3 MET CA 1 1 7 3857 1 1 3 MET CB C 9.042 8.715 -11.974 1.00 . A A . 3 MET CB 1 1 7 3858 1 1 3 MET CE C 6.259 6.960 -11.355 1.00 . A A . 3 MET CE 1 1 7 3859 1 1 3 MET CG C 8.993 7.396 -11.217 1.00 . A A . 3 MET CG 1 1 7 3860 1 1 3 MET H H 11.255 10.996 -12.524 1.00 . A A . 3 MET H 1 1 7 3861 1 1 3 MET HA H 11.168 8.860 -11.789 1.00 . A A . 3 MET HA 1 1 7 3862 1 1 3 MET HB2 H 8.750 9.503 -11.296 1.00 . A A . 3 MET HB2 1 1 7 3863 1 1 3 MET HB3 H 8.329 8.667 -12.785 1.00 . A A . 3 MET HB3 1 1 7 3864 1 1 3 MET HE1 H 5.844 7.573 -12.142 1.00 . A A . 3 MET HE1 1 1 7 3865 1 1 3 MET HE2 H 5.562 6.175 -11.104 1.00 . A A . 3 MET HE2 1 1 7 3866 1 1 3 MET HE3 H 6.443 7.570 -10.483 1.00 . A A . 3 MET HE3 1 1 7 3867 1 1 3 MET HG2 H 9.972 6.942 -11.245 1.00 . A A . 3 MET HG2 1 1 7 3868 1 1 3 MET HG3 H 8.720 7.596 -10.190 1.00 . A A . 3 MET HG3 1 1 7 3869 1 1 3 MET N N 10.520 10.465 -12.907 1.00 . A A . 3 MET N 1 1 7 3870 1 1 3 MET O O 11.880 7.703 -13.907 1.00 . A A . 3 MET O 1 1 7 3871 1 1 3 MET SD S 7.801 6.237 -11.916 1.00 . A A . 3 MET SD 1 1 7 3872 1 1 4 ALA C C 10.170 5.480 -15.167 1.00 . A A . 4 ALA C 1 1 7 3873 1 1 4 ALA CA C 9.810 6.883 -15.655 1.00 . A A . 4 ALA CA 1 1 7 3874 1 1 4 ALA CB C 10.815 7.376 -16.687 1.00 . A A . 4 ALA CB 1 1 7 3875 1 1 4 ALA H H 8.814 8.165 -14.297 1.00 . A A . 4 ALA H 1 1 7 3876 1 1 4 ALA HA H 8.843 6.836 -16.131 1.00 . A A . 4 ALA HA 1 1 7 3877 1 1 4 ALA HB1 H 10.556 6.983 -17.658 1.00 . A A . 4 ALA HB1 1 1 7 3878 1 1 4 ALA HB2 H 10.797 8.457 -16.721 1.00 . A A . 4 ALA HB2 1 1 7 3879 1 1 4 ALA HB3 H 11.806 7.043 -16.416 1.00 . A A . 4 ALA HB3 1 1 7 3880 1 1 4 ALA N N 9.700 7.812 -14.526 1.00 . A A . 4 ALA N 1 1 7 3881 1 1 4 ALA O O 9.291 4.696 -14.812 1.00 . A A . 4 ALA O 1 1 7 3882 1 1 5 ALA C C 12.681 4.270 -13.151 1.00 . A A . 5 ALA C 1 1 7 3883 1 1 5 ALA CA C 11.927 3.979 -14.441 1.00 . A A . 5 ALA CA 1 1 7 3884 1 1 5 ALA CB C 12.807 3.231 -15.427 1.00 . A A . 5 ALA CB 1 1 7 3885 1 1 5 ALA H H 12.108 5.935 -15.201 1.00 . A A . 5 ALA H 1 1 7 3886 1 1 5 ALA HA H 11.066 3.365 -14.216 1.00 . A A . 5 ALA HA 1 1 7 3887 1 1 5 ALA HB1 H 12.562 2.180 -15.402 1.00 . A A . 5 ALA HB1 1 1 7 3888 1 1 5 ALA HB2 H 12.642 3.617 -16.422 1.00 . A A . 5 ALA HB2 1 1 7 3889 1 1 5 ALA HB3 H 13.844 3.365 -15.156 1.00 . A A . 5 ALA HB3 1 1 7 3890 1 1 5 ALA N N 11.458 5.224 -15.019 1.00 . A A . 5 ALA N 1 1 7 3891 1 1 5 ALA O O 13.915 4.328 -13.138 1.00 . A A . 5 ALA O 1 1 7 3892 1 1 6 HIS C C 11.616 4.392 -9.664 1.00 . A A . 6 HIS C 1 1 7 3893 1 1 6 HIS CA C 12.508 4.875 -10.800 1.00 . A A . 6 HIS CA 1 1 7 3894 1 1 6 HIS CB C 12.708 6.385 -10.695 1.00 . A A . 6 HIS CB 1 1 7 3895 1 1 6 HIS CD2 C 14.526 7.993 -9.790 1.00 . A A . 6 HIS CD2 1 1 7 3896 1 1 6 HIS CE1 C 16.078 6.513 -9.341 1.00 . A A . 6 HIS CE1 1 1 7 3897 1 1 6 HIS CG C 14.032 6.778 -10.114 1.00 . A A . 6 HIS CG 1 1 7 3898 1 1 6 HIS H H 10.948 4.483 -12.173 1.00 . A A . 6 HIS H 1 1 7 3899 1 1 6 HIS HA H 13.466 4.386 -10.724 1.00 . A A . 6 HIS HA 1 1 7 3900 1 1 6 HIS HB2 H 12.637 6.821 -11.680 1.00 . A A . 6 HIS HB2 1 1 7 3901 1 1 6 HIS HB3 H 11.932 6.799 -10.067 1.00 . A A . 6 HIS HB3 1 1 7 3902 1 1 6 HIS HD1 H 14.979 4.890 -9.944 1.00 . A A . 6 HIS HD1 1 1 7 3903 1 1 6 HIS HD2 H 14.017 8.941 -9.894 1.00 . A A . 6 HIS HD2 1 1 7 3904 1 1 6 HIS HE1 H 17.007 6.063 -9.029 1.00 . A A . 6 HIS HE1 1 1 7 3905 1 1 6 HIS HE2 H 16.351 8.492 -8.872 1.00 . A A . 6 HIS HE2 1 1 7 3906 1 1 6 HIS N N 11.929 4.525 -12.088 1.00 . A A . 6 HIS N 1 1 7 3907 1 1 6 HIS ND1 N 15.030 5.871 -9.819 1.00 . A A . 6 HIS ND1 1 1 7 3908 1 1 6 HIS NE2 N 15.798 7.802 -9.314 1.00 . A A . 6 HIS NE2 1 1 7 3909 1 1 6 HIS O O 10.545 4.947 -9.422 1.00 . A A . 6 HIS O 1 1 7 3910 1 1 7 SER C C 11.564 3.542 -6.594 1.00 . A A . 7 SER C 1 1 7 3911 1 1 7 SER CA C 11.296 2.773 -7.885 1.00 . A A . 7 SER CA 1 1 7 3912 1 1 7 SER CB C 11.664 1.299 -7.720 1.00 . A A . 7 SER CB 1 1 7 3913 1 1 7 SER H H 12.913 2.935 -9.237 1.00 . A A . 7 SER H 1 1 7 3914 1 1 7 SER HA H 10.247 2.852 -8.125 1.00 . A A . 7 SER HA 1 1 7 3915 1 1 7 SER HB2 H 12.316 1.184 -6.866 1.00 . A A . 7 SER HB2 1 1 7 3916 1 1 7 SER HB3 H 10.766 0.718 -7.571 1.00 . A A . 7 SER HB3 1 1 7 3917 1 1 7 SER HG H 11.905 1.189 -9.671 1.00 . A A . 7 SER HG 1 1 7 3918 1 1 7 SER N N 12.054 3.344 -8.986 1.00 . A A . 7 SER N 1 1 7 3919 1 1 7 SER O O 12.477 3.215 -5.836 1.00 . A A . 7 SER O 1 1 7 3920 1 1 7 SER OG O 12.332 0.819 -8.879 1.00 . A A . 7 SER OG 1 1 7 3921 1 1 8 ALA C C 9.751 5.367 -4.300 1.00 . A A . 8 ALA C 1 1 7 3922 1 1 8 ALA CA C 10.973 5.458 -5.216 1.00 . A A . 8 ALA CA 1 1 7 3923 1 1 8 ALA CB C 11.220 6.896 -5.653 1.00 . A A . 8 ALA CB 1 1 7 3924 1 1 8 ALA H H 10.119 4.842 -7.052 1.00 . A A . 8 ALA H 1 1 7 3925 1 1 8 ALA HA H 11.842 5.113 -4.676 1.00 . A A . 8 ALA HA 1 1 7 3926 1 1 8 ALA HB1 H 11.729 7.430 -4.863 1.00 . A A . 8 ALA HB1 1 1 7 3927 1 1 8 ALA HB2 H 11.830 6.902 -6.544 1.00 . A A . 8 ALA HB2 1 1 7 3928 1 1 8 ALA HB3 H 10.275 7.377 -5.860 1.00 . A A . 8 ALA HB3 1 1 7 3929 1 1 8 ALA N N 10.802 4.607 -6.386 1.00 . A A . 8 ALA N 1 1 7 3930 1 1 8 ALA O O 9.058 4.350 -4.279 1.00 . A A . 8 ALA O 1 1 7 3931 1 1 9 ASP C C 7.232 7.361 -3.267 1.00 . A A . 9 ASP C 1 1 7 3932 1 1 9 ASP CA C 8.327 6.491 -2.665 1.00 . A A . 9 ASP CA 1 1 7 3933 1 1 9 ASP CB C 8.734 7.037 -1.295 1.00 . A A . 9 ASP CB 1 1 7 3934 1 1 9 ASP CG C 7.701 6.757 -0.222 1.00 . A A . 9 ASP CG 1 1 7 3935 1 1 9 ASP H H 10.073 7.221 -3.618 1.00 . A A . 9 ASP H 1 1 7 3936 1 1 9 ASP HA H 7.942 5.485 -2.545 1.00 . A A . 9 ASP HA 1 1 7 3937 1 1 9 ASP HB2 H 9.666 6.582 -0.997 1.00 . A A . 9 ASP HB2 1 1 7 3938 1 1 9 ASP HB3 H 8.871 8.106 -1.368 1.00 . A A . 9 ASP HB3 1 1 7 3939 1 1 9 ASP N N 9.483 6.437 -3.558 1.00 . A A . 9 ASP N 1 1 7 3940 1 1 9 ASP O O 6.911 8.437 -2.757 1.00 . A A . 9 ASP O 1 1 7 3941 1 1 9 ASP OD1 O 7.639 5.609 0.262 1.00 . A A . 9 ASP OD1 1 1 7 3942 1 1 9 ASP OD2 O 6.966 7.689 0.168 1.00 . A A . 9 ASP OD2 1 1 7 3943 1 1 10 LEU C C 4.240 6.907 -4.525 1.00 . A A . 10 LEU C 1 1 7 3944 1 1 10 LEU CA C 5.533 7.551 -4.989 1.00 . A A . 10 LEU CA 1 1 7 3945 1 1 10 LEU CB C 5.652 7.463 -6.512 1.00 . A A . 10 LEU CB 1 1 7 3946 1 1 10 LEU CD1 C 7.666 6.717 -7.796 1.00 . A A . 10 LEU CD1 1 1 7 3947 1 1 10 LEU CD2 C 6.845 9.068 -8.018 1.00 . A A . 10 LEU CD2 1 1 7 3948 1 1 10 LEU CG C 7.006 7.883 -7.079 1.00 . A A . 10 LEU CG 1 1 7 3949 1 1 10 LEU H H 6.939 6.001 -4.694 1.00 . A A . 10 LEU H 1 1 7 3950 1 1 10 LEU HA H 5.542 8.588 -4.686 1.00 . A A . 10 LEU HA 1 1 7 3951 1 1 10 LEU HB2 H 5.462 6.440 -6.807 1.00 . A A . 10 LEU HB2 1 1 7 3952 1 1 10 LEU HB3 H 4.892 8.093 -6.950 1.00 . A A . 10 LEU HB3 1 1 7 3953 1 1 10 LEU HD11 H 8.739 6.781 -7.679 1.00 . A A . 10 LEU HD11 1 1 7 3954 1 1 10 LEU HD12 H 7.315 5.788 -7.370 1.00 . A A . 10 LEU HD12 1 1 7 3955 1 1 10 LEU HD13 H 7.416 6.750 -8.845 1.00 . A A . 10 LEU HD13 1 1 7 3956 1 1 10 LEU HD21 H 6.785 8.714 -9.036 1.00 . A A . 10 LEU HD21 1 1 7 3957 1 1 10 LEU HD22 H 5.942 9.603 -7.768 1.00 . A A . 10 LEU HD22 1 1 7 3958 1 1 10 LEU HD23 H 7.695 9.727 -7.915 1.00 . A A . 10 LEU HD23 1 1 7 3959 1 1 10 LEU HG H 7.651 8.184 -6.263 1.00 . A A . 10 LEU HG 1 1 7 3960 1 1 10 LEU N N 6.649 6.876 -4.348 1.00 . A A . 10 LEU N 1 1 7 3961 1 1 10 LEU O O 3.220 7.572 -4.340 1.00 . A A . 10 LEU O 1 1 7 3962 1 1 11 LYS C C 3.404 4.723 -2.175 1.00 . A A . 11 LYS C 1 1 7 3963 1 1 11 LYS CA C 3.232 4.865 -3.687 1.00 . A A . 11 LYS CA 1 1 7 3964 1 1 11 LYS CB C 3.133 3.496 -4.380 1.00 . A A . 11 LYS CB 1 1 7 3965 1 1 11 LYS CD C 3.832 1.087 -4.227 1.00 . A A . 11 LYS CD 1 1 7 3966 1 1 11 LYS CE C 4.610 0.148 -3.324 1.00 . A A . 11 LYS CE 1 1 7 3967 1 1 11 LYS CG C 4.264 2.532 -4.045 1.00 . A A . 11 LYS CG 1 1 7 3968 1 1 11 LYS H H 5.204 5.170 -4.350 1.00 . A A . 11 LYS H 1 1 7 3969 1 1 11 LYS HA H 2.326 5.416 -3.876 1.00 . A A . 11 LYS HA 1 1 7 3970 1 1 11 LYS HB2 H 2.200 3.032 -4.107 1.00 . A A . 11 LYS HB2 1 1 7 3971 1 1 11 LYS HB3 H 3.137 3.654 -5.449 1.00 . A A . 11 LYS HB3 1 1 7 3972 1 1 11 LYS HD2 H 2.780 1.005 -3.995 1.00 . A A . 11 LYS HD2 1 1 7 3973 1 1 11 LYS HD3 H 3.995 0.800 -5.256 1.00 . A A . 11 LYS HD3 1 1 7 3974 1 1 11 LYS HE2 H 4.420 -0.869 -3.633 1.00 . A A . 11 LYS HE2 1 1 7 3975 1 1 11 LYS HE3 H 5.665 0.361 -3.426 1.00 . A A . 11 LYS HE3 1 1 7 3976 1 1 11 LYS HG2 H 5.102 2.733 -4.696 1.00 . A A . 11 LYS HG2 1 1 7 3977 1 1 11 LYS HG3 H 4.561 2.683 -3.017 1.00 . A A . 11 LYS HG3 1 1 7 3978 1 1 11 LYS HZ1 H 3.203 0.507 -1.811 1.00 . A A . 11 LYS HZ1 1 1 7 3979 1 1 11 LYS HZ2 H 4.761 1.074 -1.456 1.00 . A A . 11 LYS HZ2 1 1 7 3980 1 1 11 LYS HZ3 H 4.427 -0.584 -1.378 1.00 . A A . 11 LYS HZ3 1 1 7 3981 1 1 11 LYS N N 4.336 5.618 -4.239 1.00 . A A . 11 LYS N 1 1 7 3982 1 1 11 LYS NZ N 4.223 0.296 -1.896 1.00 . A A . 11 LYS NZ 1 1 7 3983 1 1 11 LYS O O 4.013 5.576 -1.526 1.00 . A A . 11 LYS O 1 1 7 3984 1 1 12 CYS C C 4.166 2.832 0.275 1.00 . A A . 12 CYS C 1 1 7 3985 1 1 12 CYS CA C 2.840 3.454 -0.188 1.00 . A A . 12 CYS CA 1 1 7 3986 1 1 12 CYS CB C 1.667 2.547 0.160 1.00 . A A . 12 CYS CB 1 1 7 3987 1 1 12 CYS H H 2.342 3.059 -2.187 1.00 . A A . 12 CYS H 1 1 7 3988 1 1 12 CYS HA H 2.706 4.404 0.302 1.00 . A A . 12 CYS HA 1 1 7 3989 1 1 12 CYS HB2 H 1.737 2.253 1.194 1.00 . A A . 12 CYS HB2 1 1 7 3990 1 1 12 CYS HB3 H 0.746 3.093 0.010 1.00 . A A . 12 CYS HB3 1 1 7 3991 1 1 12 CYS N N 2.826 3.681 -1.619 1.00 . A A . 12 CYS N 1 1 7 3992 1 1 12 CYS O O 5.023 2.495 -0.546 1.00 . A A . 12 CYS O 1 1 7 3993 1 1 12 CYS SG S 1.586 1.039 -0.851 1.00 . A A . 12 CYS SG 1 1 7 3994 1 1 13 PRO C C 5.697 0.657 2.071 1.00 . A A . 13 PRO C 1 1 7 3995 1 1 13 PRO CA C 5.609 2.183 2.178 1.00 . A A . 13 PRO CA 1 1 7 3996 1 1 13 PRO CB C 5.531 2.603 3.657 1.00 . A A . 13 PRO CB 1 1 7 3997 1 1 13 PRO CD C 3.465 3.207 2.645 1.00 . A A . 13 PRO CD 1 1 7 3998 1 1 13 PRO CG C 4.407 3.576 3.743 1.00 . A A . 13 PRO CG 1 1 7 3999 1 1 13 PRO HA H 6.483 2.623 1.724 1.00 . A A . 13 PRO HA 1 1 7 4000 1 1 13 PRO HB2 H 5.344 1.734 4.269 1.00 . A A . 13 PRO HB2 1 1 7 4001 1 1 13 PRO HB3 H 6.458 3.058 3.951 1.00 . A A . 13 PRO HB3 1 1 7 4002 1 1 13 PRO HD2 H 2.793 2.428 2.971 1.00 . A A . 13 PRO HD2 1 1 7 4003 1 1 13 PRO HD3 H 2.914 4.073 2.309 1.00 . A A . 13 PRO HD3 1 1 7 4004 1 1 13 PRO HG2 H 3.918 3.491 4.704 1.00 . A A . 13 PRO HG2 1 1 7 4005 1 1 13 PRO HG3 H 4.777 4.579 3.598 1.00 . A A . 13 PRO HG3 1 1 7 4006 1 1 13 PRO N N 4.373 2.723 1.600 1.00 . A A . 13 PRO N 1 1 7 4007 1 1 13 PRO O O 6.789 0.094 2.015 1.00 . A A . 13 PRO O 1 1 7 4008 1 1 14 THR C C 5.149 -2.073 0.857 1.00 . A A . 14 THR C 1 1 7 4009 1 1 14 THR CA C 4.480 -1.465 2.095 1.00 . A A . 14 THR CA 1 1 7 4010 1 1 14 THR CB C 3.017 -1.932 2.161 1.00 . A A . 14 THR CB 1 1 7 4011 1 1 14 THR CG2 C 2.923 -3.376 2.636 1.00 . A A . 14 THR CG2 1 1 7 4012 1 1 14 THR H H 3.712 0.506 2.207 1.00 . A A . 14 THR H 1 1 7 4013 1 1 14 THR HA H 4.985 -1.827 2.978 1.00 . A A . 14 THR HA 1 1 7 4014 1 1 14 THR HB H 2.587 -1.862 1.171 1.00 . A A . 14 THR HB 1 1 7 4015 1 1 14 THR HG1 H 1.381 -0.957 2.721 1.00 . A A . 14 THR HG1 1 1 7 4016 1 1 14 THR HG21 H 2.620 -3.395 3.672 1.00 . A A . 14 THR HG21 1 1 7 4017 1 1 14 THR HG22 H 3.887 -3.852 2.534 1.00 . A A . 14 THR HG22 1 1 7 4018 1 1 14 THR HG23 H 2.196 -3.906 2.039 1.00 . A A . 14 THR HG23 1 1 7 4019 1 1 14 THR N N 4.545 -0.003 2.108 1.00 . A A . 14 THR N 1 1 7 4020 1 1 14 THR O O 4.791 -1.751 -0.277 1.00 . A A . 14 THR O 1 1 7 4021 1 1 14 THR OG1 O 2.291 -1.078 3.050 1.00 . A A . 14 THR OG1 1 1 7 4022 1 1 15 PRO C C 6.128 -4.556 -0.817 1.00 . A A . 15 PRO C 1 1 7 4023 1 1 15 PRO CA C 6.940 -3.538 -0.024 1.00 . A A . 15 PRO CA 1 1 7 4024 1 1 15 PRO CB C 8.100 -4.239 0.698 1.00 . A A . 15 PRO CB 1 1 7 4025 1 1 15 PRO CD C 6.718 -3.285 2.378 1.00 . A A . 15 PRO CD 1 1 7 4026 1 1 15 PRO CG C 8.141 -3.621 2.047 1.00 . A A . 15 PRO CG 1 1 7 4027 1 1 15 PRO HA H 7.335 -2.792 -0.695 1.00 . A A . 15 PRO HA 1 1 7 4028 1 1 15 PRO HB2 H 7.905 -5.299 0.755 1.00 . A A . 15 PRO HB2 1 1 7 4029 1 1 15 PRO HB3 H 9.021 -4.068 0.161 1.00 . A A . 15 PRO HB3 1 1 7 4030 1 1 15 PRO HD2 H 6.209 -4.145 2.788 1.00 . A A . 15 PRO HD2 1 1 7 4031 1 1 15 PRO HD3 H 6.672 -2.449 3.061 1.00 . A A . 15 PRO HD3 1 1 7 4032 1 1 15 PRO HG2 H 8.542 -4.323 2.760 1.00 . A A . 15 PRO HG2 1 1 7 4033 1 1 15 PRO HG3 H 8.741 -2.724 2.018 1.00 . A A . 15 PRO HG3 1 1 7 4034 1 1 15 PRO N N 6.171 -2.921 1.066 1.00 . A A . 15 PRO N 1 1 7 4035 1 1 15 PRO O O 6.299 -4.691 -2.027 1.00 . A A . 15 PRO O 1 1 7 4036 1 1 16 GLY C C 3.217 -5.813 -1.385 1.00 . A A . 16 GLY C 1 1 7 4037 1 1 16 GLY CA C 4.496 -6.342 -0.768 1.00 . A A . 16 GLY CA 1 1 7 4038 1 1 16 GLY H H 5.223 -5.193 0.850 1.00 . A A . 16 GLY H 1 1 7 4039 1 1 16 GLY HA2 H 5.096 -6.791 -1.541 1.00 . A A . 16 GLY HA2 1 1 7 4040 1 1 16 GLY HA3 H 4.247 -7.097 -0.037 1.00 . A A . 16 GLY HA3 1 1 7 4041 1 1 16 GLY N N 5.278 -5.306 -0.122 1.00 . A A . 16 GLY N 1 1 7 4042 1 1 16 GLY O O 2.466 -6.562 -2.008 1.00 . A A . 16 GLY O 1 1 7 4043 1 1 17 CYS C C 2.142 -3.188 -3.094 1.00 . A A . 17 CYS C 1 1 7 4044 1 1 17 CYS CA C 1.803 -3.875 -1.776 1.00 . A A . 17 CYS CA 1 1 7 4045 1 1 17 CYS CB C 1.263 -2.869 -0.763 1.00 . A A . 17 CYS CB 1 1 7 4046 1 1 17 CYS H H 3.631 -3.976 -0.737 1.00 . A A . 17 CYS H 1 1 7 4047 1 1 17 CYS HA H 1.058 -4.635 -1.956 1.00 . A A . 17 CYS HA 1 1 7 4048 1 1 17 CYS HB2 H 1.150 -3.362 0.189 1.00 . A A . 17 CYS HB2 1 1 7 4049 1 1 17 CYS HB3 H 1.979 -2.067 -0.656 1.00 . A A . 17 CYS HB3 1 1 7 4050 1 1 17 CYS N N 2.982 -4.519 -1.226 1.00 . A A . 17 CYS N 1 1 7 4051 1 1 17 CYS O O 3.308 -2.900 -3.371 1.00 . A A . 17 CYS O 1 1 7 4052 1 1 17 CYS SG S -0.347 -2.118 -1.178 1.00 . A A . 17 CYS SG 1 1 7 4053 1 1 18 ASP C C 0.928 -0.843 -5.159 1.00 . A A . 18 ASP C 1 1 7 4054 1 1 18 ASP CA C 1.330 -2.314 -5.205 1.00 . A A . 18 ASP CA 1 1 7 4055 1 1 18 ASP CB C 0.544 -3.049 -6.298 1.00 . A A . 18 ASP CB 1 1 7 4056 1 1 18 ASP CG C -0.849 -2.490 -6.499 1.00 . A A . 18 ASP CG 1 1 7 4057 1 1 18 ASP H H 0.221 -3.195 -3.629 1.00 . A A . 18 ASP H 1 1 7 4058 1 1 18 ASP HA H 2.384 -2.375 -5.435 1.00 . A A . 18 ASP HA 1 1 7 4059 1 1 18 ASP HB2 H 1.080 -2.968 -7.232 1.00 . A A . 18 ASP HB2 1 1 7 4060 1 1 18 ASP HB3 H 0.456 -4.092 -6.028 1.00 . A A . 18 ASP HB3 1 1 7 4061 1 1 18 ASP N N 1.128 -2.946 -3.909 1.00 . A A . 18 ASP N 1 1 7 4062 1 1 18 ASP O O 1.319 -0.058 -6.022 1.00 . A A . 18 ASP O 1 1 7 4063 1 1 18 ASP OD1 O -1.614 -2.422 -5.520 1.00 . A A . 18 ASP OD1 1 1 7 4064 1 1 18 ASP OD2 O -1.187 -2.116 -7.642 1.00 . A A . 18 ASP OD2 1 1 7 4065 1 1 19 GLY C C -1.571 1.245 -4.430 1.00 . A A . 19 GLY C 1 1 7 4066 1 1 19 GLY CA C -0.175 0.926 -3.928 1.00 . A A . 19 GLY CA 1 1 7 4067 1 1 19 GLY H H -0.039 -1.132 -3.428 1.00 . A A . 19 GLY H 1 1 7 4068 1 1 19 GLY HA2 H -0.125 1.160 -2.876 1.00 . A A . 19 GLY HA2 1 1 7 4069 1 1 19 GLY HA3 H 0.534 1.547 -4.455 1.00 . A A . 19 GLY HA3 1 1 7 4070 1 1 19 GLY N N 0.201 -0.466 -4.112 1.00 . A A . 19 GLY N 1 1 7 4071 1 1 19 GLY O O -2.055 2.367 -4.267 1.00 . A A . 19 GLY O 1 1 7 4072 1 1 20 SER C C -4.612 -0.324 -4.730 1.00 . A A . 20 SER C 1 1 7 4073 1 1 20 SER CA C -3.589 0.480 -5.519 1.00 . A A . 20 SER CA 1 1 7 4074 1 1 20 SER CB C -3.662 0.115 -6.999 1.00 . A A . 20 SER CB 1 1 7 4075 1 1 20 SER H H -1.830 -0.627 -5.094 1.00 . A A . 20 SER H 1 1 7 4076 1 1 20 SER HA H -3.818 1.529 -5.409 1.00 . A A . 20 SER HA 1 1 7 4077 1 1 20 SER HB2 H -4.009 -0.903 -7.100 1.00 . A A . 20 SER HB2 1 1 7 4078 1 1 20 SER HB3 H -4.348 0.781 -7.501 1.00 . A A . 20 SER HB3 1 1 7 4079 1 1 20 SER HG H -1.948 -0.639 -7.579 1.00 . A A . 20 SER HG 1 1 7 4080 1 1 20 SER N N -2.242 0.266 -5.012 1.00 . A A . 20 SER N 1 1 7 4081 1 1 20 SER O O -4.279 -1.330 -4.098 1.00 . A A . 20 SER O 1 1 7 4082 1 1 20 SER OG O -2.389 0.225 -7.609 1.00 . A A . 20 SER OG 1 1 7 4083 1 1 21 GLY C C -6.884 -0.326 -2.579 1.00 . A A . 21 GLY C 1 1 7 4084 1 1 21 GLY CA C -6.927 -0.553 -4.073 1.00 . A A . 21 GLY CA 1 1 7 4085 1 1 21 GLY H H -6.056 0.936 -5.291 1.00 . A A . 21 GLY H 1 1 7 4086 1 1 21 GLY HA2 H -7.875 -0.199 -4.452 1.00 . A A . 21 GLY HA2 1 1 7 4087 1 1 21 GLY HA3 H -6.848 -1.612 -4.266 1.00 . A A . 21 GLY HA3 1 1 7 4088 1 1 21 GLY N N -5.857 0.130 -4.768 1.00 . A A . 21 GLY N 1 1 7 4089 1 1 21 GLY O O -5.989 0.342 -2.070 1.00 . A A . 21 GLY O 1 1 7 4090 1 1 22 HIS C C -8.402 -2.184 0.106 1.00 . A A . 22 HIS C 1 1 7 4091 1 1 22 HIS CA C -7.884 -0.861 -0.425 1.00 . A A . 22 HIS CA 1 1 7 4092 1 1 22 HIS CB C -8.803 0.266 0.068 1.00 . A A . 22 HIS CB 1 1 7 4093 1 1 22 HIS CD2 C -7.339 2.365 -0.422 1.00 . A A . 22 HIS CD2 1 1 7 4094 1 1 22 HIS CE1 C -7.546 3.344 1.519 1.00 . A A . 22 HIS CE1 1 1 7 4095 1 1 22 HIS CG C -8.113 1.569 0.353 1.00 . A A . 22 HIS CG 1 1 7 4096 1 1 22 HIS H H -8.499 -1.466 -2.358 1.00 . A A . 22 HIS H 1 1 7 4097 1 1 22 HIS HA H -6.883 -0.698 -0.056 1.00 . A A . 22 HIS HA 1 1 7 4098 1 1 22 HIS HB2 H -9.559 0.453 -0.679 1.00 . A A . 22 HIS HB2 1 1 7 4099 1 1 22 HIS HB3 H -9.286 -0.057 0.980 1.00 . A A . 22 HIS HB3 1 1 7 4100 1 1 22 HIS HD1 H -8.732 1.895 2.349 1.00 . A A . 22 HIS HD1 1 1 7 4101 1 1 22 HIS HD2 H -7.059 2.179 -1.450 1.00 . A A . 22 HIS HD2 1 1 7 4102 1 1 22 HIS HE1 H -7.457 4.053 2.329 1.00 . A A . 22 HIS HE1 1 1 7 4103 1 1 22 HIS HE2 H -6.683 4.324 -0.051 1.00 . A A . 22 HIS HE2 1 1 7 4104 1 1 22 HIS N N -7.833 -0.914 -1.880 1.00 . A A . 22 HIS N 1 1 7 4105 1 1 22 HIS ND1 N -8.220 2.214 1.562 1.00 . A A . 22 HIS ND1 1 1 7 4106 1 1 22 HIS NE2 N -7.000 3.465 0.326 1.00 . A A . 22 HIS NE2 1 1 7 4107 1 1 22 HIS O O -9.174 -2.858 -0.572 1.00 . A A . 22 HIS O 1 1 7 4108 1 1 23 ILE C C -10.187 -3.415 2.204 1.00 . A A . 23 ILE C 1 1 7 4109 1 1 23 ILE CA C -8.691 -3.652 2.010 1.00 . A A . 23 ILE CA 1 1 7 4110 1 1 23 ILE CB C -7.993 -3.962 3.365 1.00 . A A . 23 ILE CB 1 1 7 4111 1 1 23 ILE CD1 C -7.762 -6.371 2.545 1.00 . A A . 23 ILE CD1 1 1 7 4112 1 1 23 ILE CG1 C -7.094 -5.198 3.230 1.00 . A A . 23 ILE CG1 1 1 7 4113 1 1 23 ILE CG2 C -8.996 -4.154 4.500 1.00 . A A . 23 ILE CG2 1 1 7 4114 1 1 23 ILE H H -7.581 -1.845 1.898 1.00 . A A . 23 ILE H 1 1 7 4115 1 1 23 ILE HA H -8.554 -4.500 1.351 1.00 . A A . 23 ILE HA 1 1 7 4116 1 1 23 ILE HB H -7.376 -3.114 3.617 1.00 . A A . 23 ILE HB 1 1 7 4117 1 1 23 ILE HD11 H -7.374 -7.295 2.948 1.00 . A A . 23 ILE HD11 1 1 7 4118 1 1 23 ILE HD12 H -8.828 -6.326 2.712 1.00 . A A . 23 ILE HD12 1 1 7 4119 1 1 23 ILE HD13 H -7.563 -6.330 1.484 1.00 . A A . 23 ILE HD13 1 1 7 4120 1 1 23 ILE HG12 H -6.219 -4.935 2.654 1.00 . A A . 23 ILE HG12 1 1 7 4121 1 1 23 ILE HG13 H -6.786 -5.520 4.214 1.00 . A A . 23 ILE HG13 1 1 7 4122 1 1 23 ILE HG21 H -9.867 -3.542 4.316 1.00 . A A . 23 ILE HG21 1 1 7 4123 1 1 23 ILE HG22 H -9.292 -5.193 4.549 1.00 . A A . 23 ILE HG22 1 1 7 4124 1 1 23 ILE HG23 H -8.542 -3.862 5.434 1.00 . A A . 23 ILE HG23 1 1 7 4125 1 1 23 ILE N N -8.108 -2.482 1.362 1.00 . A A . 23 ILE N 1 1 7 4126 1 1 23 ILE O O -11.005 -4.330 2.079 1.00 . A A . 23 ILE O 1 1 7 4127 1 1 24 THR C C -12.620 -1.736 1.162 1.00 . A A . 24 THR C 1 1 7 4128 1 1 24 THR CA C -11.917 -1.736 2.529 1.00 . A A . 24 THR CA 1 1 7 4129 1 1 24 THR CB C -12.005 -0.344 3.202 1.00 . A A . 24 THR CB 1 1 7 4130 1 1 24 THR CG2 C -12.225 0.768 2.186 1.00 . A A . 24 THR CG2 1 1 7 4131 1 1 24 THR H H -9.825 -1.469 2.446 1.00 . A A . 24 THR H 1 1 7 4132 1 1 24 THR HA H -12.413 -2.448 3.170 1.00 . A A . 24 THR HA 1 1 7 4133 1 1 24 THR HB H -11.071 -0.159 3.710 1.00 . A A . 24 THR HB 1 1 7 4134 1 1 24 THR HG1 H -12.743 -0.762 4.988 1.00 . A A . 24 THR HG1 1 1 7 4135 1 1 24 THR HG21 H -12.097 1.727 2.666 1.00 . A A . 24 THR HG21 1 1 7 4136 1 1 24 THR HG22 H -13.223 0.697 1.782 1.00 . A A . 24 THR HG22 1 1 7 4137 1 1 24 THR HG23 H -11.504 0.667 1.384 1.00 . A A . 24 THR HG23 1 1 7 4138 1 1 24 THR N N -10.532 -2.150 2.402 1.00 . A A . 24 THR N 1 1 7 4139 1 1 24 THR O O -13.837 -1.902 1.080 1.00 . A A . 24 THR O 1 1 7 4140 1 1 24 THR OG1 O -13.057 -0.336 4.173 1.00 . A A . 24 THR OG1 1 1 7 4141 1 1 25 GLY C C -12.983 -0.536 -1.816 1.00 . A A . 25 GLY C 1 1 7 4142 1 1 25 GLY CA C -12.367 -1.811 -1.260 1.00 . A A . 25 GLY CA 1 1 7 4143 1 1 25 GLY H H -10.858 -1.663 0.217 1.00 . A A . 25 GLY H 1 1 7 4144 1 1 25 GLY HA2 H -11.569 -2.119 -1.918 1.00 . A A . 25 GLY HA2 1 1 7 4145 1 1 25 GLY HA3 H -13.122 -2.583 -1.252 1.00 . A A . 25 GLY HA3 1 1 7 4146 1 1 25 GLY N N -11.828 -1.675 0.089 1.00 . A A . 25 GLY N 1 1 7 4147 1 1 25 GLY O O -13.271 -0.452 -3.007 1.00 . A A . 25 GLY O 1 1 7 4148 1 1 26 ASN C C -13.129 2.651 -2.034 1.00 . A A . 26 ASN C 1 1 7 4149 1 1 26 ASN CA C -14.012 1.622 -1.335 1.00 . A A . 26 ASN CA 1 1 7 4150 1 1 26 ASN CB C -14.666 2.261 -0.111 1.00 . A A . 26 ASN CB 1 1 7 4151 1 1 26 ASN CG C -16.062 1.730 0.123 1.00 . A A . 26 ASN CG 1 1 7 4152 1 1 26 ASN H H -13.112 0.254 0.010 1.00 . A A . 26 ASN H 1 1 7 4153 1 1 26 ASN HA H -14.789 1.319 -2.020 1.00 . A A . 26 ASN HA 1 1 7 4154 1 1 26 ASN HB2 H -14.070 2.047 0.763 1.00 . A A . 26 ASN HB2 1 1 7 4155 1 1 26 ASN HB3 H -14.721 3.330 -0.251 1.00 . A A . 26 ASN HB3 1 1 7 4156 1 1 26 ASN HD21 H -15.558 1.135 1.947 1.00 . A A . 26 ASN HD21 1 1 7 4157 1 1 26 ASN HD22 H -17.182 0.781 1.462 1.00 . A A . 26 ASN HD22 1 1 7 4158 1 1 26 ASN N N -13.278 0.418 -0.941 1.00 . A A . 26 ASN N 1 1 7 4159 1 1 26 ASN ND2 N -16.290 1.167 1.297 1.00 . A A . 26 ASN ND2 1 1 7 4160 1 1 26 ASN O O -13.602 3.718 -2.420 1.00 . A A . 26 ASN O 1 1 7 4161 1 1 26 ASN OD1 O -16.931 1.828 -0.743 1.00 . A A . 26 ASN OD1 1 1 7 4162 1 1 27 TYR C C -10.200 2.598 -3.953 1.00 . A A . 27 TYR C 1 1 7 4163 1 1 27 TYR CA C -10.920 3.274 -2.799 1.00 . A A . 27 TYR CA 1 1 7 4164 1 1 27 TYR CB C -9.908 3.778 -1.777 1.00 . A A . 27 TYR CB 1 1 7 4165 1 1 27 TYR CD1 C -11.148 3.971 0.420 1.00 . A A . 27 TYR CD1 1 1 7 4166 1 1 27 TYR CD2 C -10.476 5.977 -0.680 1.00 . A A . 27 TYR CD2 1 1 7 4167 1 1 27 TYR CE1 C -11.719 4.714 1.434 1.00 . A A . 27 TYR CE1 1 1 7 4168 1 1 27 TYR CE2 C -11.040 6.727 0.333 1.00 . A A . 27 TYR CE2 1 1 7 4169 1 1 27 TYR CG C -10.519 4.589 -0.656 1.00 . A A . 27 TYR CG 1 1 7 4170 1 1 27 TYR CZ C -11.660 6.092 1.386 1.00 . A A . 27 TYR CZ 1 1 7 4171 1 1 27 TYR H H -11.514 1.498 -1.845 1.00 . A A . 27 TYR H 1 1 7 4172 1 1 27 TYR HA H -11.485 4.111 -3.181 1.00 . A A . 27 TYR HA 1 1 7 4173 1 1 27 TYR HB2 H -9.401 2.933 -1.340 1.00 . A A . 27 TYR HB2 1 1 7 4174 1 1 27 TYR HB3 H -9.185 4.393 -2.280 1.00 . A A . 27 TYR HB3 1 1 7 4175 1 1 27 TYR HD1 H -11.191 2.890 0.456 1.00 . A A . 27 TYR HD1 1 1 7 4176 1 1 27 TYR HD2 H -9.990 6.472 -1.509 1.00 . A A . 27 TYR HD2 1 1 7 4177 1 1 27 TYR HE1 H -12.203 4.216 2.261 1.00 . A A . 27 TYR HE1 1 1 7 4178 1 1 27 TYR HE2 H -10.992 7.806 0.298 1.00 . A A . 27 TYR HE2 1 1 7 4179 1 1 27 TYR HH H -12.862 7.467 2.009 1.00 . A A . 27 TYR HH 1 1 7 4180 1 1 27 TYR N N -11.847 2.353 -2.171 1.00 . A A . 27 TYR N 1 1 7 4181 1 1 27 TYR O O -10.056 1.375 -3.975 1.00 . A A . 27 TYR O 1 1 7 4182 1 1 27 TYR OH O -12.231 6.837 2.391 1.00 . A A . 27 TYR OH 1 1 7 4183 1 1 28 ALA C C -7.633 2.736 -5.936 1.00 . A A . 28 ALA C 1 1 7 4184 1 1 28 ALA CA C -9.141 2.871 -6.115 1.00 . A A . 28 ALA CA 1 1 7 4185 1 1 28 ALA CB C -9.453 3.760 -7.308 1.00 . A A . 28 ALA CB 1 1 7 4186 1 1 28 ALA H H -9.943 4.365 -4.847 1.00 . A A . 28 ALA H 1 1 7 4187 1 1 28 ALA HA H -9.556 1.894 -6.311 1.00 . A A . 28 ALA HA 1 1 7 4188 1 1 28 ALA HB1 H -10.241 4.451 -7.047 1.00 . A A . 28 ALA HB1 1 1 7 4189 1 1 28 ALA HB2 H -8.567 4.312 -7.588 1.00 . A A . 28 ALA HB2 1 1 7 4190 1 1 28 ALA HB3 H -9.771 3.147 -8.139 1.00 . A A . 28 ALA HB3 1 1 7 4191 1 1 28 ALA N N -9.781 3.394 -4.920 1.00 . A A . 28 ALA N 1 1 7 4192 1 1 28 ALA O O -7.002 1.880 -6.555 1.00 . A A . 28 ALA O 1 1 7 4193 1 1 29 SER C C -5.254 4.338 -3.612 1.00 . A A . 29 SER C 1 1 7 4194 1 1 29 SER CA C -5.610 3.573 -4.879 1.00 . A A . 29 SER CA 1 1 7 4195 1 1 29 SER CB C -4.865 4.172 -6.081 1.00 . A A . 29 SER CB 1 1 7 4196 1 1 29 SER H H -7.605 4.263 -4.641 1.00 . A A . 29 SER H 1 1 7 4197 1 1 29 SER HA H -5.306 2.545 -4.756 1.00 . A A . 29 SER HA 1 1 7 4198 1 1 29 SER HB2 H -4.145 4.896 -5.730 1.00 . A A . 29 SER HB2 1 1 7 4199 1 1 29 SER HB3 H -4.352 3.382 -6.610 1.00 . A A . 29 SER HB3 1 1 7 4200 1 1 29 SER HG H -6.049 4.187 -7.654 1.00 . A A . 29 SER HG 1 1 7 4201 1 1 29 SER N N -7.053 3.591 -5.106 1.00 . A A . 29 SER N 1 1 7 4202 1 1 29 SER O O -6.121 4.939 -2.982 1.00 . A A . 29 SER O 1 1 7 4203 1 1 29 SER OG O -5.760 4.816 -6.976 1.00 . A A . 29 SER OG 1 1 7 4204 1 1 30 HIS C C -2.022 5.303 -2.204 1.00 . A A . 30 HIS C 1 1 7 4205 1 1 30 HIS CA C -3.506 4.979 -2.046 1.00 . A A . 30 HIS CA 1 1 7 4206 1 1 30 HIS CB C -3.742 4.135 -0.792 1.00 . A A . 30 HIS CB 1 1 7 4207 1 1 30 HIS CD2 C -1.968 2.318 -0.355 1.00 . A A . 30 HIS CD2 1 1 7 4208 1 1 30 HIS CE1 C -2.897 0.636 -1.353 1.00 . A A . 30 HIS CE1 1 1 7 4209 1 1 30 HIS CG C -3.141 2.766 -0.853 1.00 . A A . 30 HIS CG 1 1 7 4210 1 1 30 HIS H H -3.347 3.755 -3.756 1.00 . A A . 30 HIS H 1 1 7 4211 1 1 30 HIS HA H -4.056 5.903 -1.959 1.00 . A A . 30 HIS HA 1 1 7 4212 1 1 30 HIS HB2 H -3.309 4.646 0.050 1.00 . A A . 30 HIS HB2 1 1 7 4213 1 1 30 HIS HB3 H -4.803 4.027 -0.631 1.00 . A A . 30 HIS HB3 1 1 7 4214 1 1 30 HIS HD1 H -4.606 1.666 -1.929 1.00 . A A . 30 HIS HD1 1 1 7 4215 1 1 30 HIS HD2 H -1.251 2.893 0.208 1.00 . A A . 30 HIS HD2 1 1 7 4216 1 1 30 HIS HE1 H -3.079 -0.353 -1.748 1.00 . A A . 30 HIS HE1 1 1 7 4217 1 1 30 HIS N N -3.988 4.283 -3.230 1.00 . A A . 30 HIS N 1 1 7 4218 1 1 30 HIS ND1 N -3.727 1.681 -1.487 1.00 . A A . 30 HIS ND1 1 1 7 4219 1 1 30 HIS NE2 N -1.834 0.987 -0.680 1.00 . A A . 30 HIS NE2 1 1 7 4220 1 1 30 HIS O O -1.460 5.119 -3.283 1.00 . A A . 30 HIS O 1 1 7 4221 1 1 31 ARG C C 0.670 6.128 0.177 1.00 . A A . 31 ARG C 1 1 7 4222 1 1 31 ARG CA C 0.019 6.164 -1.201 1.00 . A A . 31 ARG CA 1 1 7 4223 1 1 31 ARG CB C 0.171 7.564 -1.802 1.00 . A A . 31 ARG CB 1 1 7 4224 1 1 31 ARG CD C -0.037 9.711 -0.486 1.00 . A A . 31 ARG CD 1 1 7 4225 1 1 31 ARG CG C -0.777 8.592 -1.204 1.00 . A A . 31 ARG CG 1 1 7 4226 1 1 31 ARG CZ C 2.186 10.706 -0.885 1.00 . A A . 31 ARG CZ 1 1 7 4227 1 1 31 ARG H H -1.890 5.930 -0.304 1.00 . A A . 31 ARG H 1 1 7 4228 1 1 31 ARG HA H 0.521 5.454 -1.840 1.00 . A A . 31 ARG HA 1 1 7 4229 1 1 31 ARG HB2 H 1.183 7.902 -1.638 1.00 . A A . 31 ARG HB2 1 1 7 4230 1 1 31 ARG HB3 H -0.012 7.512 -2.864 1.00 . A A . 31 ARG HB3 1 1 7 4231 1 1 31 ARG HD2 H -0.386 10.654 -0.874 1.00 . A A . 31 ARG HD2 1 1 7 4232 1 1 31 ARG HD3 H -0.262 9.654 0.570 1.00 . A A . 31 ARG HD3 1 1 7 4233 1 1 31 ARG HE H 1.837 8.754 -0.597 1.00 . A A . 31 ARG HE 1 1 7 4234 1 1 31 ARG HG2 H -1.368 9.021 -1.998 1.00 . A A . 31 ARG HG2 1 1 7 4235 1 1 31 ARG HG3 H -1.426 8.095 -0.500 1.00 . A A . 31 ARG HG3 1 1 7 4236 1 1 31 ARG HH11 H 0.643 12.032 -0.905 1.00 . A A . 31 ARG HH11 1 1 7 4237 1 1 31 ARG HH12 H 2.219 12.717 -1.174 1.00 . A A . 31 ARG HH12 1 1 7 4238 1 1 31 ARG HH21 H 3.914 9.639 -0.934 1.00 . A A . 31 ARG HH21 1 1 7 4239 1 1 31 ARG HH22 H 4.089 11.358 -1.151 1.00 . A A . 31 ARG HH22 1 1 7 4240 1 1 31 ARG N N -1.392 5.791 -1.141 1.00 . A A . 31 ARG N 1 1 7 4241 1 1 31 ARG NE N 1.415 9.641 -0.664 1.00 . A A . 31 ARG NE 1 1 7 4242 1 1 31 ARG NH1 N 1.640 11.914 -0.996 1.00 . A A . 31 ARG NH1 1 1 7 4243 1 1 31 ARG NH2 N 3.497 10.559 -1.006 1.00 . A A . 31 ARG NH2 1 1 7 4244 1 1 31 ARG O O 1.779 6.635 0.358 1.00 . A A . 31 ARG O 1 1 7 4245 1 1 32 SER C C 0.055 4.162 3.183 1.00 . A A . 32 SER C 1 1 7 4246 1 1 32 SER CA C 0.523 5.443 2.502 1.00 . A A . 32 SER CA 1 1 7 4247 1 1 32 SER CB C 0.098 6.660 3.328 1.00 . A A . 32 SER CB 1 1 7 4248 1 1 32 SER H H -0.885 5.133 0.950 1.00 . A A . 32 SER H 1 1 7 4249 1 1 32 SER HA H 1.596 5.428 2.435 1.00 . A A . 32 SER HA 1 1 7 4250 1 1 32 SER HB2 H -0.575 6.340 4.104 1.00 . A A . 32 SER HB2 1 1 7 4251 1 1 32 SER HB3 H 0.974 7.107 3.775 1.00 . A A . 32 SER HB3 1 1 7 4252 1 1 32 SER HG H -1.296 7.218 2.060 1.00 . A A . 32 SER HG 1 1 7 4253 1 1 32 SER N N -0.011 5.535 1.148 1.00 . A A . 32 SER N 1 1 7 4254 1 1 32 SER O O -0.878 3.507 2.707 1.00 . A A . 32 SER O 1 1 7 4255 1 1 32 SER OG O -0.555 7.633 2.524 1.00 . A A . 32 SER OG 1 1 7 4256 1 1 33 LEU C C -0.880 2.787 5.847 1.00 . A A . 33 LEU C 1 1 7 4257 1 1 33 LEU CA C 0.379 2.590 5.014 1.00 . A A . 33 LEU CA 1 1 7 4258 1 1 33 LEU CB C 1.538 2.191 5.927 1.00 . A A . 33 LEU CB 1 1 7 4259 1 1 33 LEU CD1 C 3.637 0.855 6.158 1.00 . A A . 33 LEU CD1 1 1 7 4260 1 1 33 LEU CD2 C 1.433 -0.305 5.903 1.00 . A A . 33 LEU CD2 1 1 7 4261 1 1 33 LEU CG C 2.259 0.916 5.520 1.00 . A A . 33 LEU CG 1 1 7 4262 1 1 33 LEU H H 1.493 4.328 4.579 1.00 . A A . 33 LEU H 1 1 7 4263 1 1 33 LEU HA H 0.210 1.804 4.297 1.00 . A A . 33 LEU HA 1 1 7 4264 1 1 33 LEU HB2 H 2.254 3.000 5.939 1.00 . A A . 33 LEU HB2 1 1 7 4265 1 1 33 LEU HB3 H 1.153 2.059 6.928 1.00 . A A . 33 LEU HB3 1 1 7 4266 1 1 33 LEU HD11 H 3.534 0.662 7.216 1.00 . A A . 33 LEU HD11 1 1 7 4267 1 1 33 LEU HD12 H 4.212 0.064 5.701 1.00 . A A . 33 LEU HD12 1 1 7 4268 1 1 33 LEU HD13 H 4.142 1.799 6.011 1.00 . A A . 33 LEU HD13 1 1 7 4269 1 1 33 LEU HD21 H 1.578 -0.520 6.951 1.00 . A A . 33 LEU HD21 1 1 7 4270 1 1 33 LEU HD22 H 0.388 -0.103 5.717 1.00 . A A . 33 LEU HD22 1 1 7 4271 1 1 33 LEU HD23 H 1.747 -1.153 5.313 1.00 . A A . 33 LEU HD23 1 1 7 4272 1 1 33 LEU HG H 2.386 0.917 4.447 1.00 . A A . 33 LEU HG 1 1 7 4273 1 1 33 LEU N N 0.712 3.799 4.285 1.00 . A A . 33 LEU N 1 1 7 4274 1 1 33 LEU O O -0.829 2.896 7.075 1.00 . A A . 33 LEU O 1 1 7 4275 1 1 34 SER C C -4.313 2.064 5.238 1.00 . A A . 34 SER C 1 1 7 4276 1 1 34 SER CA C -3.287 3.021 5.825 1.00 . A A . 34 SER CA 1 1 7 4277 1 1 34 SER CB C -3.765 4.466 5.679 1.00 . A A . 34 SER CB 1 1 7 4278 1 1 34 SER H H -1.976 2.782 4.187 1.00 . A A . 34 SER H 1 1 7 4279 1 1 34 SER HA H -3.157 2.795 6.872 1.00 . A A . 34 SER HA 1 1 7 4280 1 1 34 SER HB2 H -4.781 4.472 5.314 1.00 . A A . 34 SER HB2 1 1 7 4281 1 1 34 SER HB3 H -3.724 4.955 6.642 1.00 . A A . 34 SER HB3 1 1 7 4282 1 1 34 SER HG H -2.306 5.717 5.264 1.00 . A A . 34 SER HG 1 1 7 4283 1 1 34 SER N N -2.009 2.847 5.167 1.00 . A A . 34 SER N 1 1 7 4284 1 1 34 SER O O -4.927 1.274 5.958 1.00 . A A . 34 SER O 1 1 7 4285 1 1 34 SER OG O -2.947 5.182 4.766 1.00 . A A . 34 SER OG 1 1 7 4286 1 1 35 GLY C C -4.783 0.311 2.292 1.00 . A A . 35 GLY C 1 1 7 4287 1 1 35 GLY CA C -5.437 1.278 3.253 1.00 . A A . 35 GLY CA 1 1 7 4288 1 1 35 GLY H H -3.962 2.778 3.402 1.00 . A A . 35 GLY H 1 1 7 4289 1 1 35 GLY HA2 H -5.982 0.718 3.997 1.00 . A A . 35 GLY HA2 1 1 7 4290 1 1 35 GLY HA3 H -6.131 1.899 2.704 1.00 . A A . 35 GLY HA3 1 1 7 4291 1 1 35 GLY N N -4.480 2.128 3.923 1.00 . A A . 35 GLY N 1 1 7 4292 1 1 35 GLY O O -5.335 0.021 1.229 1.00 . A A . 35 GLY O 1 1 7 4293 1 1 36 CYS C C -3.787 -2.545 1.897 1.00 . A A . 36 CYS C 1 1 7 4294 1 1 36 CYS CA C -2.969 -1.255 1.911 1.00 . A A . 36 CYS CA 1 1 7 4295 1 1 36 CYS CB C -1.582 -1.540 2.502 1.00 . A A . 36 CYS CB 1 1 7 4296 1 1 36 CYS H H -3.290 -0.007 3.577 1.00 . A A . 36 CYS H 1 1 7 4297 1 1 36 CYS HA H -2.859 -0.889 0.900 1.00 . A A . 36 CYS HA 1 1 7 4298 1 1 36 CYS HB2 H -1.665 -1.585 3.579 1.00 . A A . 36 CYS HB2 1 1 7 4299 1 1 36 CYS HB3 H -1.236 -2.496 2.134 1.00 . A A . 36 CYS HB3 1 1 7 4300 1 1 36 CYS N N -3.647 -0.240 2.697 1.00 . A A . 36 CYS N 1 1 7 4301 1 1 36 CYS O O -3.973 -3.177 2.939 1.00 . A A . 36 CYS O 1 1 7 4302 1 1 36 CYS SG S -0.311 -0.298 2.106 1.00 . A A . 36 CYS SG 1 1 7 4303 1 1 37 PRO C C -3.949 -5.412 0.647 1.00 . A A . 37 PRO C 1 1 7 4304 1 1 37 PRO CA C -4.945 -4.260 0.590 1.00 . A A . 37 PRO CA 1 1 7 4305 1 1 37 PRO CB C -5.600 -4.159 -0.783 1.00 . A A . 37 PRO CB 1 1 7 4306 1 1 37 PRO CD C -4.067 -2.324 -0.589 1.00 . A A . 37 PRO CD 1 1 7 4307 1 1 37 PRO CG C -4.671 -3.301 -1.570 1.00 . A A . 37 PRO CG 1 1 7 4308 1 1 37 PRO HA H -5.698 -4.384 1.356 1.00 . A A . 37 PRO HA 1 1 7 4309 1 1 37 PRO HB2 H -5.696 -5.144 -1.216 1.00 . A A . 37 PRO HB2 1 1 7 4310 1 1 37 PRO HB3 H -6.575 -3.700 -0.689 1.00 . A A . 37 PRO HB3 1 1 7 4311 1 1 37 PRO HD2 H -3.018 -2.169 -0.800 1.00 . A A . 37 PRO HD2 1 1 7 4312 1 1 37 PRO HD3 H -4.600 -1.386 -0.620 1.00 . A A . 37 PRO HD3 1 1 7 4313 1 1 37 PRO HG2 H -3.898 -3.913 -2.019 1.00 . A A . 37 PRO HG2 1 1 7 4314 1 1 37 PRO HG3 H -5.222 -2.771 -2.336 1.00 . A A . 37 PRO HG3 1 1 7 4315 1 1 37 PRO N N -4.247 -2.987 0.718 1.00 . A A . 37 PRO N 1 1 7 4316 1 1 37 PRO O O -4.305 -6.564 0.902 1.00 . A A . 37 PRO O 1 1 7 4317 1 1 38 ARG C C -0.758 -5.649 1.882 1.00 . A A . 38 ARG C 1 1 7 4318 1 1 38 ARG CA C -1.578 -5.989 0.649 1.00 . A A . 38 ARG CA 1 1 7 4319 1 1 38 ARG CB C -0.687 -5.946 -0.591 1.00 . A A . 38 ARG CB 1 1 7 4320 1 1 38 ARG CD C -0.767 -6.650 -2.996 1.00 . A A . 38 ARG CD 1 1 7 4321 1 1 38 ARG CG C -1.459 -5.873 -1.895 1.00 . A A . 38 ARG CG 1 1 7 4322 1 1 38 ARG CZ C -1.458 -7.430 -5.238 1.00 . A A . 38 ARG CZ 1 1 7 4323 1 1 38 ARG H H -2.470 -4.098 0.408 1.00 . A A . 38 ARG H 1 1 7 4324 1 1 38 ARG HA H -1.991 -6.981 0.757 1.00 . A A . 38 ARG HA 1 1 7 4325 1 1 38 ARG HB2 H -0.046 -5.078 -0.529 1.00 . A A . 38 ARG HB2 1 1 7 4326 1 1 38 ARG HB3 H -0.072 -6.833 -0.606 1.00 . A A . 38 ARG HB3 1 1 7 4327 1 1 38 ARG HD2 H -0.095 -5.986 -3.518 1.00 . A A . 38 ARG HD2 1 1 7 4328 1 1 38 ARG HD3 H -0.205 -7.457 -2.552 1.00 . A A . 38 ARG HD3 1 1 7 4329 1 1 38 ARG HE H -2.623 -7.422 -3.609 1.00 . A A . 38 ARG HE 1 1 7 4330 1 1 38 ARG HG2 H -2.446 -6.285 -1.742 1.00 . A A . 38 ARG HG2 1 1 7 4331 1 1 38 ARG HG3 H -1.542 -4.839 -2.196 1.00 . A A . 38 ARG HG3 1 1 7 4332 1 1 38 ARG HH11 H 0.438 -6.694 -5.167 1.00 . A A . 38 ARG HH11 1 1 7 4333 1 1 38 ARG HH12 H -0.082 -7.277 -6.727 1.00 . A A . 38 ARG HH12 1 1 7 4334 1 1 38 ARG HH21 H -3.280 -8.226 -5.638 1.00 . A A . 38 ARG HH21 1 1 7 4335 1 1 38 ARG HH22 H -2.187 -8.144 -6.988 1.00 . A A . 38 ARG HH22 1 1 7 4336 1 1 38 ARG N N -2.678 -5.051 0.520 1.00 . A A . 38 ARG N 1 1 7 4337 1 1 38 ARG NE N -1.725 -7.205 -3.952 1.00 . A A . 38 ARG NE 1 1 7 4338 1 1 38 ARG NH1 N -0.275 -7.110 -5.749 1.00 . A A . 38 ARG NH1 1 1 7 4339 1 1 38 ARG NH2 N -2.380 -7.976 -6.019 1.00 . A A . 38 ARG NH2 1 1 7 4340 1 1 38 ARG O O 0.461 -5.827 1.897 1.00 . A A . 38 ARG O 1 1 7 4341 1 1 39 ALA C C 0.036 -5.826 4.721 1.00 . A A . 39 ALA C 1 1 7 4342 1 1 39 ALA CA C -0.773 -4.686 4.120 1.00 . A A . 39 ALA CA 1 1 7 4343 1 1 39 ALA CB C -1.798 -4.177 5.123 1.00 . A A . 39 ALA CB 1 1 7 4344 1 1 39 ALA H H -2.392 -4.949 2.788 1.00 . A A . 39 ALA H 1 1 7 4345 1 1 39 ALA HA H -0.106 -3.871 3.879 1.00 . A A . 39 ALA HA 1 1 7 4346 1 1 39 ALA HB1 H -1.304 -3.561 5.861 1.00 . A A . 39 ALA HB1 1 1 7 4347 1 1 39 ALA HB2 H -2.547 -3.592 4.610 1.00 . A A . 39 ALA HB2 1 1 7 4348 1 1 39 ALA HB3 H -2.268 -5.017 5.613 1.00 . A A . 39 ALA HB3 1 1 7 4349 1 1 39 ALA N N -1.429 -5.104 2.889 1.00 . A A . 39 ALA N 1 1 7 4350 1 1 39 ALA O O -0.441 -6.959 4.810 1.00 . A A . 39 ALA O 1 1 7 4351 1 1 40 LYS C C 1.633 -7.235 6.769 1.00 . A A . 40 LYS C 1 1 7 4352 1 1 40 LYS CA C 2.218 -6.539 5.547 1.00 . A A . 40 LYS CA 1 1 7 4353 1 1 40 LYS CB C 3.560 -5.899 5.907 1.00 . A A . 40 LYS CB 1 1 7 4354 1 1 40 LYS CD C 4.233 -4.058 7.478 1.00 . A A . 40 LYS CD 1 1 7 4355 1 1 40 LYS CE C 4.084 -2.587 7.815 1.00 . A A . 40 LYS CE 1 1 7 4356 1 1 40 LYS CG C 3.478 -4.412 6.213 1.00 . A A . 40 LYS CG 1 1 7 4357 1 1 40 LYS H H 1.629 -4.641 4.827 1.00 . A A . 40 LYS H 1 1 7 4358 1 1 40 LYS HA H 2.377 -7.275 4.775 1.00 . A A . 40 LYS HA 1 1 7 4359 1 1 40 LYS HB2 H 3.959 -6.401 6.775 1.00 . A A . 40 LYS HB2 1 1 7 4360 1 1 40 LYS HB3 H 4.243 -6.037 5.080 1.00 . A A . 40 LYS HB3 1 1 7 4361 1 1 40 LYS HD2 H 3.842 -4.646 8.295 1.00 . A A . 40 LYS HD2 1 1 7 4362 1 1 40 LYS HD3 H 5.279 -4.282 7.336 1.00 . A A . 40 LYS HD3 1 1 7 4363 1 1 40 LYS HE2 H 5.062 -2.179 8.026 1.00 . A A . 40 LYS HE2 1 1 7 4364 1 1 40 LYS HE3 H 3.657 -2.074 6.966 1.00 . A A . 40 LYS HE3 1 1 7 4365 1 1 40 LYS HG2 H 3.907 -3.859 5.390 1.00 . A A . 40 LYS HG2 1 1 7 4366 1 1 40 LYS HG3 H 2.443 -4.134 6.336 1.00 . A A . 40 LYS HG3 1 1 7 4367 1 1 40 LYS HZ1 H 2.405 -3.041 8.970 1.00 . A A . 40 LYS HZ1 1 1 7 4368 1 1 40 LYS HZ2 H 2.843 -1.402 9.002 1.00 . A A . 40 LYS HZ2 1 1 7 4369 1 1 40 LYS HZ3 H 3.754 -2.534 9.872 1.00 . A A . 40 LYS HZ3 1 1 7 4370 1 1 40 LYS N N 1.294 -5.539 5.024 1.00 . A A . 40 LYS N 1 1 7 4371 1 1 40 LYS NZ N 3.212 -2.376 8.995 1.00 . A A . 40 LYS NZ 1 1 7 4372 1 1 40 LYS O O 1.375 -6.606 7.797 1.00 . A A . 40 LYS O 1 1 7 4373 1 1 41 LYS C C 1.757 -10.426 8.102 1.00 . A A . 41 LYS C 1 1 7 4374 1 1 41 LYS CA C 0.802 -9.317 7.700 1.00 . A A . 41 LYS CA 1 1 7 4375 1 1 41 LYS CB C -0.533 -9.918 7.249 1.00 . A A . 41 LYS CB 1 1 7 4376 1 1 41 LYS CD C -2.500 -8.439 6.705 1.00 . A A . 41 LYS CD 1 1 7 4377 1 1 41 LYS CE C -2.777 -9.315 5.489 1.00 . A A . 41 LYS CE 1 1 7 4378 1 1 41 LYS CG C -1.755 -9.196 7.796 1.00 . A A . 41 LYS CG 1 1 7 4379 1 1 41 LYS H H 1.597 -8.963 5.773 1.00 . A A . 41 LYS H 1 1 7 4380 1 1 41 LYS HA H 0.634 -8.669 8.547 1.00 . A A . 41 LYS HA 1 1 7 4381 1 1 41 LYS HB2 H -0.580 -9.891 6.171 1.00 . A A . 41 LYS HB2 1 1 7 4382 1 1 41 LYS HB3 H -0.577 -10.948 7.574 1.00 . A A . 41 LYS HB3 1 1 7 4383 1 1 41 LYS HD2 H -3.441 -8.089 7.102 1.00 . A A . 41 LYS HD2 1 1 7 4384 1 1 41 LYS HD3 H -1.901 -7.594 6.397 1.00 . A A . 41 LYS HD3 1 1 7 4385 1 1 41 LYS HE2 H -2.116 -9.018 4.689 1.00 . A A . 41 LYS HE2 1 1 7 4386 1 1 41 LYS HE3 H -2.581 -10.345 5.752 1.00 . A A . 41 LYS HE3 1 1 7 4387 1 1 41 LYS HG2 H -2.423 -9.921 8.235 1.00 . A A . 41 LYS HG2 1 1 7 4388 1 1 41 LYS HG3 H -1.437 -8.494 8.553 1.00 . A A . 41 LYS HG3 1 1 7 4389 1 1 41 LYS HZ1 H -4.525 -8.216 5.164 1.00 . A A . 41 LYS HZ1 1 1 7 4390 1 1 41 LYS HZ2 H -4.793 -9.844 5.560 1.00 . A A . 41 LYS HZ2 1 1 7 4391 1 1 41 LYS HZ3 H -4.248 -9.431 4.011 1.00 . A A . 41 LYS HZ3 1 1 7 4392 1 1 41 LYS N N 1.387 -8.525 6.631 1.00 . A A . 41 LYS N 1 1 7 4393 1 1 41 LYS NZ N -4.181 -9.192 5.023 1.00 . A A . 41 LYS NZ 1 1 7 4394 1 1 41 LYS O O 2.388 -10.370 9.158 1.00 . A A . 41 LYS O 1 1 7 4395 1 1 42 SER C C 4.157 -12.263 6.893 1.00 . A A . 42 SER C 1 1 7 4396 1 1 42 SER CA C 2.772 -12.537 7.469 1.00 . A A . 42 SER CA 1 1 7 4397 1 1 42 SER CB C 2.170 -13.792 6.840 1.00 . A A . 42 SER CB 1 1 7 4398 1 1 42 SER H H 1.373 -11.384 6.395 1.00 . A A . 42 SER H 1 1 7 4399 1 1 42 SER HA H 2.855 -12.679 8.536 1.00 . A A . 42 SER HA 1 1 7 4400 1 1 42 SER HB2 H 2.814 -14.139 6.045 1.00 . A A . 42 SER HB2 1 1 7 4401 1 1 42 SER HB3 H 2.077 -14.561 7.592 1.00 . A A . 42 SER HB3 1 1 7 4402 1 1 42 SER HG H 0.204 -13.746 6.958 1.00 . A A . 42 SER HG 1 1 7 4403 1 1 42 SER N N 1.888 -11.412 7.231 1.00 . A A . 42 SER N 1 1 7 4404 1 1 42 SER O O 5.142 -12.890 7.284 1.00 . A A . 42 SER O 1 1 7 4405 1 1 42 SER OG O 0.883 -13.515 6.303 1.00 . A A . 42 SER OG 1 1 7 4406 1 1 43 GLY C C 5.651 -9.489 5.119 1.00 . A A . 43 GLY C 1 1 7 4407 1 1 43 GLY CA C 5.493 -10.976 5.356 1.00 . A A . 43 GLY CA 1 1 7 4408 1 1 43 GLY H H 3.406 -10.848 5.690 1.00 . A A . 43 GLY H 1 1 7 4409 1 1 43 GLY HA2 H 6.291 -11.312 6.002 1.00 . A A . 43 GLY HA2 1 1 7 4410 1 1 43 GLY HA3 H 5.570 -11.492 4.410 1.00 . A A . 43 GLY HA3 1 1 7 4411 1 1 43 GLY N N 4.227 -11.315 5.967 1.00 . A A . 43 GLY N 1 1 7 4412 1 1 43 GLY O O 5.266 -8.975 4.066 1.00 . A A . 43 GLY O 1 1 7 4413 1 1 44 LEU C C 7.807 -7.231 5.019 1.00 . A A . 44 LEU C 1 1 7 4414 1 1 44 LEU CA C 6.573 -7.385 5.894 1.00 . A A . 44 LEU CA 1 1 7 4415 1 1 44 LEU CB C 6.790 -6.687 7.243 1.00 . A A . 44 LEU CB 1 1 7 4416 1 1 44 LEU CD1 C 7.713 -7.331 9.482 1.00 . A A . 44 LEU CD1 1 1 7 4417 1 1 44 LEU CD2 C 5.241 -7.263 9.128 1.00 . A A . 44 LEU CD2 1 1 7 4418 1 1 44 LEU CG C 6.586 -7.557 8.485 1.00 . A A . 44 LEU CG 1 1 7 4419 1 1 44 LEU H H 6.615 -9.278 6.863 1.00 . A A . 44 LEU H 1 1 7 4420 1 1 44 LEU HA H 5.731 -6.932 5.391 1.00 . A A . 44 LEU HA 1 1 7 4421 1 1 44 LEU HB2 H 7.799 -6.301 7.264 1.00 . A A . 44 LEU HB2 1 1 7 4422 1 1 44 LEU HB3 H 6.104 -5.852 7.301 1.00 . A A . 44 LEU HB3 1 1 7 4423 1 1 44 LEU HD11 H 8.482 -6.725 9.025 1.00 . A A . 44 LEU HD11 1 1 7 4424 1 1 44 LEU HD12 H 7.327 -6.826 10.354 1.00 . A A . 44 LEU HD12 1 1 7 4425 1 1 44 LEU HD13 H 8.132 -8.284 9.775 1.00 . A A . 44 LEU HD13 1 1 7 4426 1 1 44 LEU HD21 H 5.388 -6.667 10.016 1.00 . A A . 44 LEU HD21 1 1 7 4427 1 1 44 LEU HD22 H 4.619 -6.719 8.430 1.00 . A A . 44 LEU HD22 1 1 7 4428 1 1 44 LEU HD23 H 4.757 -8.191 9.392 1.00 . A A . 44 LEU HD23 1 1 7 4429 1 1 44 LEU HG H 6.601 -8.597 8.196 1.00 . A A . 44 LEU HG 1 1 7 4430 1 1 44 LEU N N 6.278 -8.802 6.064 1.00 . A A . 44 LEU N 1 1 7 4431 1 1 44 LEU O O 7.747 -6.661 3.929 1.00 . A A . 44 LEU O 1 1 7 4432 1 1 45 ARG C C 10.371 -9.489 4.372 1.00 . A A . 45 ARG C 1 1 7 4433 1 1 45 ARG CA C 10.065 -8.017 4.611 1.00 . A A . 45 ARG CA 1 1 7 4434 1 1 45 ARG CB C 11.246 -7.328 5.307 1.00 . A A . 45 ARG CB 1 1 7 4435 1 1 45 ARG CD C 13.610 -8.176 5.486 1.00 . A A . 45 ARG CD 1 1 7 4436 1 1 45 ARG CG C 12.577 -7.504 4.592 1.00 . A A . 45 ARG CG 1 1 7 4437 1 1 45 ARG CZ C 13.428 -10.342 6.667 1.00 . A A . 45 ARG CZ 1 1 7 4438 1 1 45 ARG H H 8.792 -8.464 6.226 1.00 . A A . 45 ARG H 1 1 7 4439 1 1 45 ARG HA H 9.875 -7.537 3.663 1.00 . A A . 45 ARG HA 1 1 7 4440 1 1 45 ARG HB2 H 11.040 -6.269 5.374 1.00 . A A . 45 ARG HB2 1 1 7 4441 1 1 45 ARG HB3 H 11.343 -7.729 6.306 1.00 . A A . 45 ARG HB3 1 1 7 4442 1 1 45 ARG HD2 H 14.595 -7.962 5.099 1.00 . A A . 45 ARG HD2 1 1 7 4443 1 1 45 ARG HD3 H 13.520 -7.774 6.484 1.00 . A A . 45 ARG HD3 1 1 7 4444 1 1 45 ARG HE H 13.266 -10.093 4.682 1.00 . A A . 45 ARG HE 1 1 7 4445 1 1 45 ARG HG2 H 12.425 -8.115 3.714 1.00 . A A . 45 ARG HG2 1 1 7 4446 1 1 45 ARG HG3 H 12.948 -6.533 4.297 1.00 . A A . 45 ARG HG3 1 1 7 4447 1 1 45 ARG HH11 H 13.914 -8.778 7.872 1.00 . A A . 45 ARG HH11 1 1 7 4448 1 1 45 ARG HH12 H 13.689 -10.306 8.680 1.00 . A A . 45 ARG HH12 1 1 7 4449 1 1 45 ARG HH21 H 12.979 -12.091 5.735 1.00 . A A . 45 ARG HH21 1 1 7 4450 1 1 45 ARG HH22 H 13.168 -12.198 7.465 1.00 . A A . 45 ARG HH22 1 1 7 4451 1 1 45 ARG N N 8.865 -7.913 5.420 1.00 . A A . 45 ARG N 1 1 7 4452 1 1 45 ARG NE N 13.424 -9.626 5.543 1.00 . A A . 45 ARG NE 1 1 7 4453 1 1 45 ARG NH1 N 13.699 -9.763 7.831 1.00 . A A . 45 ARG NH1 1 1 7 4454 1 1 45 ARG NH2 N 13.172 -11.647 6.619 1.00 . A A . 45 ARG NH2 1 1 7 4455 1 1 45 ARG O O 10.309 -10.293 5.302 1.00 . A A . 45 ARG O 1 1 7 4456 1 1 46 VAL C C 12.179 -11.716 3.414 1.00 . A A . 46 VAL C 1 1 7 4457 1 1 46 VAL CA C 10.884 -11.236 2.765 1.00 . A A . 46 VAL CA 1 1 7 4458 1 1 46 VAL CB C 10.970 -11.425 1.234 1.00 . A A . 46 VAL CB 1 1 7 4459 1 1 46 VAL CG1 C 11.210 -12.885 0.884 1.00 . A A . 46 VAL CG1 1 1 7 4460 1 1 46 VAL CG2 C 9.703 -10.917 0.562 1.00 . A A . 46 VAL CG2 1 1 7 4461 1 1 46 VAL H H 10.604 -9.165 2.413 1.00 . A A . 46 VAL H 1 1 7 4462 1 1 46 VAL HA H 10.064 -11.837 3.137 1.00 . A A . 46 VAL HA 1 1 7 4463 1 1 46 VAL HB H 11.805 -10.847 0.864 1.00 . A A . 46 VAL HB 1 1 7 4464 1 1 46 VAL HG11 H 12.217 -13.162 1.164 1.00 . A A . 46 VAL HG11 1 1 7 4465 1 1 46 VAL HG12 H 10.505 -13.504 1.418 1.00 . A A . 46 VAL HG12 1 1 7 4466 1 1 46 VAL HG13 H 11.081 -13.027 -0.178 1.00 . A A . 46 VAL HG13 1 1 7 4467 1 1 46 VAL HG21 H 9.756 -9.843 0.457 1.00 . A A . 46 VAL HG21 1 1 7 4468 1 1 46 VAL HG22 H 9.607 -11.369 -0.415 1.00 . A A . 46 VAL HG22 1 1 7 4469 1 1 46 VAL HG23 H 8.847 -11.179 1.165 1.00 . A A . 46 VAL HG23 1 1 7 4470 1 1 46 VAL N N 10.621 -9.848 3.122 1.00 . A A . 46 VAL N 1 1 7 4471 1 1 46 VAL O O 12.147 -12.736 4.135 1.00 . A A . 46 VAL O 1 1 7 4472 1 1 46 VAL OXT O 13.215 -11.043 3.243 1.00 . A A . 46 VAL OXT 1 1 7 4473 2 2 1 ZN ZN ZN -0.297 -0.074 -0.169 1.00 . B A . 47 ZN ZN 1 1 8 4474 1 1 1 GLY C C 5.202 14.551 -17.129 1.00 . A A . 1 GLY C 1 1 8 4475 1 1 1 GLY CA C 5.214 13.293 -17.966 1.00 . A A . 1 GLY CA 1 1 8 4476 1 1 1 GLY H1 H 5.158 11.602 -16.749 1.00 . A A . 1 GLY H1 1 1 8 4477 1 1 1 GLY H2 H 4.042 11.573 -18.024 1.00 . A A . 1 GLY H2 1 1 8 4478 1 1 1 GLY H3 H 3.754 12.549 -16.673 1.00 . A A . 1 GLY H3 1 1 8 4479 1 1 1 GLY HA2 H 6.239 12.998 -18.138 1.00 . A A . 1 GLY HA2 1 1 8 4480 1 1 1 GLY HA3 H 4.746 13.501 -18.917 1.00 . A A . 1 GLY HA3 1 1 8 4481 1 1 1 GLY N N 4.493 12.178 -17.309 1.00 . A A . 1 GLY N 1 1 8 4482 1 1 1 GLY O O 5.330 14.486 -15.905 1.00 . A A . 1 GLY O 1 1 8 4483 1 1 2 SER C C 3.705 17.146 -16.339 1.00 . A A . 2 SER C 1 1 8 4484 1 1 2 SER CA C 5.016 16.979 -17.100 1.00 . A A . 2 SER CA 1 1 8 4485 1 1 2 SER CB C 5.187 18.108 -18.114 1.00 . A A . 2 SER CB 1 1 8 4486 1 1 2 SER H H 4.971 15.682 -18.762 1.00 . A A . 2 SER H 1 1 8 4487 1 1 2 SER HA H 5.836 17.008 -16.396 1.00 . A A . 2 SER HA 1 1 8 4488 1 1 2 SER HB2 H 4.236 18.592 -18.275 1.00 . A A . 2 SER HB2 1 1 8 4489 1 1 2 SER HB3 H 5.898 18.826 -17.732 1.00 . A A . 2 SER HB3 1 1 8 4490 1 1 2 SER HG H 6.402 18.156 -19.656 1.00 . A A . 2 SER HG 1 1 8 4491 1 1 2 SER N N 5.053 15.696 -17.784 1.00 . A A . 2 SER N 1 1 8 4492 1 1 2 SER O O 2.682 17.531 -16.911 1.00 . A A . 2 SER O 1 1 8 4493 1 1 2 SER OG O 5.664 17.607 -19.356 1.00 . A A . 2 SER OG 1 1 8 4494 1 1 3 MET C C 2.693 17.985 -13.180 1.00 . A A . 3 MET C 1 1 8 4495 1 1 3 MET CA C 2.542 16.893 -14.229 1.00 . A A . 3 MET CA 1 1 8 4496 1 1 3 MET CB C 2.270 15.547 -13.553 1.00 . A A . 3 MET CB 1 1 8 4497 1 1 3 MET CE C -1.173 13.913 -13.037 1.00 . A A . 3 MET CE 1 1 8 4498 1 1 3 MET CG C 1.032 15.545 -12.671 1.00 . A A . 3 MET CG 1 1 8 4499 1 1 3 MET H H 4.575 16.501 -14.663 1.00 . A A . 3 MET H 1 1 8 4500 1 1 3 MET HA H 1.706 17.138 -14.867 1.00 . A A . 3 MET HA 1 1 8 4501 1 1 3 MET HB2 H 2.141 14.794 -14.315 1.00 . A A . 3 MET HB2 1 1 8 4502 1 1 3 MET HB3 H 3.121 15.285 -12.940 1.00 . A A . 3 MET HB3 1 1 8 4503 1 1 3 MET HE1 H -1.977 14.110 -12.342 1.00 . A A . 3 MET HE1 1 1 8 4504 1 1 3 MET HE2 H -1.553 13.349 -13.876 1.00 . A A . 3 MET HE2 1 1 8 4505 1 1 3 MET HE3 H -0.399 13.346 -12.542 1.00 . A A . 3 MET HE3 1 1 8 4506 1 1 3 MET HG2 H 1.074 14.689 -12.016 1.00 . A A . 3 MET HG2 1 1 8 4507 1 1 3 MET HG3 H 1.027 16.450 -12.079 1.00 . A A . 3 MET HG3 1 1 8 4508 1 1 3 MET N N 3.730 16.815 -15.060 1.00 . A A . 3 MET N 1 1 8 4509 1 1 3 MET O O 3.609 17.951 -12.355 1.00 . A A . 3 MET O 1 1 8 4510 1 1 3 MET SD S -0.499 15.468 -13.621 1.00 . A A . 3 MET SD 1 1 8 4511 1 1 4 ALA C C 1.151 19.601 -10.934 1.00 . A A . 4 ALA C 1 1 8 4512 1 1 4 ALA CA C 1.785 20.036 -12.251 1.00 . A A . 4 ALA CA 1 1 8 4513 1 1 4 ALA CB C 1.054 21.237 -12.826 1.00 . A A . 4 ALA CB 1 1 8 4514 1 1 4 ALA H H 1.075 18.907 -13.891 1.00 . A A . 4 ALA H 1 1 8 4515 1 1 4 ALA HA H 2.811 20.319 -12.070 1.00 . A A . 4 ALA HA 1 1 8 4516 1 1 4 ALA HB1 H 1.406 21.427 -13.829 1.00 . A A . 4 ALA HB1 1 1 8 4517 1 1 4 ALA HB2 H -0.007 21.037 -12.848 1.00 . A A . 4 ALA HB2 1 1 8 4518 1 1 4 ALA HB3 H 1.243 22.103 -12.208 1.00 . A A . 4 ALA HB3 1 1 8 4519 1 1 4 ALA N N 1.782 18.943 -13.208 1.00 . A A . 4 ALA N 1 1 8 4520 1 1 4 ALA O O 0.206 20.218 -10.449 1.00 . A A . 4 ALA O 1 1 8 4521 1 1 5 ALA C C 2.227 17.137 -8.447 1.00 . A A . 5 ALA C 1 1 8 4522 1 1 5 ALA CA C 1.160 17.974 -9.132 1.00 . A A . 5 ALA CA 1 1 8 4523 1 1 5 ALA CB C -0.086 17.137 -9.380 1.00 . A A . 5 ALA CB 1 1 8 4524 1 1 5 ALA H H 2.421 18.070 -10.818 1.00 . A A . 5 ALA H 1 1 8 4525 1 1 5 ALA HA H 0.893 18.799 -8.491 1.00 . A A . 5 ALA HA 1 1 8 4526 1 1 5 ALA HB1 H -0.905 17.532 -8.798 1.00 . A A . 5 ALA HB1 1 1 8 4527 1 1 5 ALA HB2 H -0.339 17.170 -10.430 1.00 . A A . 5 ALA HB2 1 1 8 4528 1 1 5 ALA HB3 H 0.104 16.115 -9.088 1.00 . A A . 5 ALA HB3 1 1 8 4529 1 1 5 ALA N N 1.668 18.518 -10.377 1.00 . A A . 5 ALA N 1 1 8 4530 1 1 5 ALA O O 3.028 16.471 -9.110 1.00 . A A . 5 ALA O 1 1 8 4531 1 1 6 HIS C C 2.789 14.955 -6.283 1.00 . A A . 6 HIS C 1 1 8 4532 1 1 6 HIS CA C 3.188 16.421 -6.336 1.00 . A A . 6 HIS CA 1 1 8 4533 1 1 6 HIS CB C 3.270 16.994 -4.921 1.00 . A A . 6 HIS CB 1 1 8 4534 1 1 6 HIS CD2 C 5.084 17.997 -3.370 1.00 . A A . 6 HIS CD2 1 1 8 4535 1 1 6 HIS CE1 C 6.753 18.021 -4.784 1.00 . A A . 6 HIS CE1 1 1 8 4536 1 1 6 HIS CG C 4.629 17.496 -4.543 1.00 . A A . 6 HIS CG 1 1 8 4537 1 1 6 HIS H H 1.553 17.723 -6.663 1.00 . A A . 6 HIS H 1 1 8 4538 1 1 6 HIS HA H 4.153 16.506 -6.809 1.00 . A A . 6 HIS HA 1 1 8 4539 1 1 6 HIS HB2 H 2.579 17.818 -4.836 1.00 . A A . 6 HIS HB2 1 1 8 4540 1 1 6 HIS HB3 H 2.991 16.225 -4.216 1.00 . A A . 6 HIS HB3 1 1 8 4541 1 1 6 HIS HD1 H 5.694 17.234 -6.355 1.00 . A A . 6 HIS HD1 1 1 8 4542 1 1 6 HIS HD2 H 4.510 18.124 -2.463 1.00 . A A . 6 HIS HD2 1 1 8 4543 1 1 6 HIS HE1 H 7.733 18.167 -5.215 1.00 . A A . 6 HIS HE1 1 1 8 4544 1 1 6 HIS HE2 H 6.957 18.832 -2.912 1.00 . A A . 6 HIS HE2 1 1 8 4545 1 1 6 HIS N N 2.231 17.176 -7.126 1.00 . A A . 6 HIS N 1 1 8 4546 1 1 6 HIS ND1 N 5.702 17.526 -5.409 1.00 . A A . 6 HIS ND1 1 1 8 4547 1 1 6 HIS NE2 N 6.405 18.314 -3.547 1.00 . A A . 6 HIS NE2 1 1 8 4548 1 1 6 HIS O O 1.888 14.576 -5.533 1.00 . A A . 6 HIS O 1 1 8 4549 1 1 7 SER C C 3.533 11.967 -6.025 1.00 . A A . 7 SER C 1 1 8 4550 1 1 7 SER CA C 3.065 12.744 -7.252 1.00 . A A . 7 SER CA 1 1 8 4551 1 1 7 SER CB C 3.695 12.168 -8.519 1.00 . A A . 7 SER CB 1 1 8 4552 1 1 7 SER H H 4.058 14.535 -7.762 1.00 . A A . 7 SER H 1 1 8 4553 1 1 7 SER HA H 1.991 12.664 -7.328 1.00 . A A . 7 SER HA 1 1 8 4554 1 1 7 SER HB2 H 4.591 11.622 -8.260 1.00 . A A . 7 SER HB2 1 1 8 4555 1 1 7 SER HB3 H 2.993 11.500 -8.997 1.00 . A A . 7 SER HB3 1 1 8 4556 1 1 7 SER HG H 3.309 13.317 -10.064 1.00 . A A . 7 SER HG 1 1 8 4557 1 1 7 SER N N 3.401 14.155 -7.142 1.00 . A A . 7 SER N 1 1 8 4558 1 1 7 SER O O 4.668 11.491 -5.971 1.00 . A A . 7 SER O 1 1 8 4559 1 1 7 SER OG O 4.034 13.205 -9.430 1.00 . A A . 7 SER OG 1 1 8 4560 1 1 8 ALA C C 2.236 9.760 -3.852 1.00 . A A . 8 ALA C 1 1 8 4561 1 1 8 ALA CA C 2.954 11.103 -3.827 1.00 . A A . 8 ALA CA 1 1 8 4562 1 1 8 ALA CB C 2.553 11.899 -2.595 1.00 . A A . 8 ALA CB 1 1 8 4563 1 1 8 ALA H H 1.766 12.268 -5.138 1.00 . A A . 8 ALA H 1 1 8 4564 1 1 8 ALA HA H 4.021 10.934 -3.792 1.00 . A A . 8 ALA HA 1 1 8 4565 1 1 8 ALA HB1 H 3.427 12.375 -2.173 1.00 . A A . 8 ALA HB1 1 1 8 4566 1 1 8 ALA HB2 H 1.833 12.653 -2.874 1.00 . A A . 8 ALA HB2 1 1 8 4567 1 1 8 ALA HB3 H 2.115 11.236 -1.862 1.00 . A A . 8 ALA HB3 1 1 8 4568 1 1 8 ALA N N 2.653 11.850 -5.039 1.00 . A A . 8 ALA N 1 1 8 4569 1 1 8 ALA O O 2.701 8.775 -3.272 1.00 . A A . 8 ALA O 1 1 8 4570 1 1 9 ASP C C 0.950 7.625 -5.859 1.00 . A A . 9 ASP C 1 1 8 4571 1 1 9 ASP CA C 0.353 8.490 -4.757 1.00 . A A . 9 ASP CA 1 1 8 4572 1 1 9 ASP CB C -1.103 8.838 -5.092 1.00 . A A . 9 ASP CB 1 1 8 4573 1 1 9 ASP CG C -2.088 7.757 -4.685 1.00 . A A . 9 ASP CG 1 1 8 4574 1 1 9 ASP H H 0.844 10.525 -5.060 1.00 . A A . 9 ASP H 1 1 8 4575 1 1 9 ASP HA H 0.384 7.940 -3.830 1.00 . A A . 9 ASP HA 1 1 8 4576 1 1 9 ASP HB2 H -1.372 9.747 -4.577 1.00 . A A . 9 ASP HB2 1 1 8 4577 1 1 9 ASP HB3 H -1.192 8.997 -6.158 1.00 . A A . 9 ASP HB3 1 1 8 4578 1 1 9 ASP N N 1.133 9.713 -4.589 1.00 . A A . 9 ASP N 1 1 8 4579 1 1 9 ASP O O 0.234 7.041 -6.671 1.00 . A A . 9 ASP O 1 1 8 4580 1 1 9 ASP OD1 O -2.446 7.695 -3.496 1.00 . A A . 9 ASP OD1 1 1 8 4581 1 1 9 ASP OD2 O -2.545 6.992 -5.564 1.00 . A A . 9 ASP OD2 1 1 8 4582 1 1 10 LEU C C 2.961 5.236 -6.323 1.00 . A A . 10 LEU C 1 1 8 4583 1 1 10 LEU CA C 2.964 6.676 -6.817 1.00 . A A . 10 LEU CA 1 1 8 4584 1 1 10 LEU CB C 4.396 7.175 -7.053 1.00 . A A . 10 LEU CB 1 1 8 4585 1 1 10 LEU CD1 C 6.512 6.125 -6.219 1.00 . A A . 10 LEU CD1 1 1 8 4586 1 1 10 LEU CD2 C 5.854 8.398 -5.419 1.00 . A A . 10 LEU CD2 1 1 8 4587 1 1 10 LEU CG C 5.349 7.036 -5.865 1.00 . A A . 10 LEU CG 1 1 8 4588 1 1 10 LEU H H 2.782 7.973 -5.155 1.00 . A A . 10 LEU H 1 1 8 4589 1 1 10 LEU HA H 2.418 6.723 -7.747 1.00 . A A . 10 LEU HA 1 1 8 4590 1 1 10 LEU HB2 H 4.812 6.626 -7.885 1.00 . A A . 10 LEU HB2 1 1 8 4591 1 1 10 LEU HB3 H 4.351 8.221 -7.326 1.00 . A A . 10 LEU HB3 1 1 8 4592 1 1 10 LEU HD11 H 6.953 6.449 -7.151 1.00 . A A . 10 LEU HD11 1 1 8 4593 1 1 10 LEU HD12 H 7.255 6.168 -5.436 1.00 . A A . 10 LEU HD12 1 1 8 4594 1 1 10 LEU HD13 H 6.156 5.111 -6.323 1.00 . A A . 10 LEU HD13 1 1 8 4595 1 1 10 LEU HD21 H 5.905 9.060 -6.271 1.00 . A A . 10 LEU HD21 1 1 8 4596 1 1 10 LEU HD22 H 5.179 8.808 -4.683 1.00 . A A . 10 LEU HD22 1 1 8 4597 1 1 10 LEU HD23 H 6.838 8.293 -4.986 1.00 . A A . 10 LEU HD23 1 1 8 4598 1 1 10 LEU HG H 4.818 6.589 -5.039 1.00 . A A . 10 LEU HG 1 1 8 4599 1 1 10 LEU N N 2.271 7.517 -5.856 1.00 . A A . 10 LEU N 1 1 8 4600 1 1 10 LEU O O 2.723 4.306 -7.095 1.00 . A A . 10 LEU O 1 1 8 4601 1 1 11 LYS C C 3.238 4.000 -2.840 1.00 . A A . 11 LYS C 1 1 8 4602 1 1 11 LYS CA C 2.997 3.801 -4.337 1.00 . A A . 11 LYS CA 1 1 8 4603 1 1 11 LYS CB C 3.966 2.770 -4.946 1.00 . A A . 11 LYS CB 1 1 8 4604 1 1 11 LYS CD C 5.686 1.900 -3.335 1.00 . A A . 11 LYS CD 1 1 8 4605 1 1 11 LYS CE C 5.031 0.543 -3.562 1.00 . A A . 11 LYS CE 1 1 8 4606 1 1 11 LYS CG C 5.403 2.874 -4.464 1.00 . A A . 11 LYS CG 1 1 8 4607 1 1 11 LYS H H 3.195 5.880 -4.446 1.00 . A A . 11 LYS H 1 1 8 4608 1 1 11 LYS HA H 1.985 3.447 -4.472 1.00 . A A . 11 LYS HA 1 1 8 4609 1 1 11 LYS HB2 H 3.606 1.779 -4.711 1.00 . A A . 11 LYS HB2 1 1 8 4610 1 1 11 LYS HB3 H 3.965 2.891 -6.019 1.00 . A A . 11 LYS HB3 1 1 8 4611 1 1 11 LYS HD2 H 6.752 1.764 -3.246 1.00 . A A . 11 LYS HD2 1 1 8 4612 1 1 11 LYS HD3 H 5.297 2.322 -2.417 1.00 . A A . 11 LYS HD3 1 1 8 4613 1 1 11 LYS HE2 H 4.523 0.557 -4.516 1.00 . A A . 11 LYS HE2 1 1 8 4614 1 1 11 LYS HE3 H 5.797 -0.217 -3.574 1.00 . A A . 11 LYS HE3 1 1 8 4615 1 1 11 LYS HG2 H 6.066 2.654 -5.286 1.00 . A A . 11 LYS HG2 1 1 8 4616 1 1 11 LYS HG3 H 5.581 3.880 -4.113 1.00 . A A . 11 LYS HG3 1 1 8 4617 1 1 11 LYS HZ1 H 3.094 0.120 -2.898 1.00 . A A . 11 LYS HZ1 1 1 8 4618 1 1 11 LYS HZ2 H 4.025 0.981 -1.781 1.00 . A A . 11 LYS HZ2 1 1 8 4619 1 1 11 LYS HZ3 H 4.304 -0.670 -2.020 1.00 . A A . 11 LYS HZ3 1 1 8 4620 1 1 11 LYS N N 3.098 5.083 -5.005 1.00 . A A . 11 LYS N 1 1 8 4621 1 1 11 LYS NZ N 4.045 0.222 -2.494 1.00 . A A . 11 LYS NZ 1 1 8 4622 1 1 11 LYS O O 3.703 5.061 -2.418 1.00 . A A . 11 LYS O 1 1 8 4623 1 1 12 CYS C C 3.987 2.732 0.078 1.00 . A A . 12 CYS C 1 1 8 4624 1 1 12 CYS CA C 2.692 3.208 -0.601 1.00 . A A . 12 CYS CA 1 1 8 4625 1 1 12 CYS CB C 1.518 2.381 -0.113 1.00 . A A . 12 CYS CB 1 1 8 4626 1 1 12 CYS H H 2.227 2.344 -2.457 1.00 . A A . 12 CYS H 1 1 8 4627 1 1 12 CYS HA H 2.520 4.245 -0.359 1.00 . A A . 12 CYS HA 1 1 8 4628 1 1 12 CYS HB2 H 1.557 2.302 0.962 1.00 . A A . 12 CYS HB2 1 1 8 4629 1 1 12 CYS HB3 H 0.598 2.867 -0.401 1.00 . A A . 12 CYS HB3 1 1 8 4630 1 1 12 CYS N N 2.733 3.072 -2.051 1.00 . A A . 12 CYS N 1 1 8 4631 1 1 12 CYS O O 4.861 2.154 -0.566 1.00 . A A . 12 CYS O 1 1 8 4632 1 1 12 CYS SG S 1.506 0.700 -0.808 1.00 . A A . 12 CYS SG 1 1 8 4633 1 1 13 PRO C C 5.512 1.000 2.150 1.00 . A A . 13 PRO C 1 1 8 4634 1 1 13 PRO CA C 5.269 2.512 2.198 1.00 . A A . 13 PRO CA 1 1 8 4635 1 1 13 PRO CB C 4.903 2.931 3.628 1.00 . A A . 13 PRO CB 1 1 8 4636 1 1 13 PRO CD C 3.112 3.641 2.246 1.00 . A A . 13 PRO CD 1 1 8 4637 1 1 13 PRO CG C 3.897 4.009 3.467 1.00 . A A . 13 PRO CG 1 1 8 4638 1 1 13 PRO HA H 6.165 3.029 1.890 1.00 . A A . 13 PRO HA 1 1 8 4639 1 1 13 PRO HB2 H 4.492 2.088 4.160 1.00 . A A . 13 PRO HB2 1 1 8 4640 1 1 13 PRO HB3 H 5.782 3.289 4.140 1.00 . A A . 13 PRO HB3 1 1 8 4641 1 1 13 PRO HD2 H 2.293 2.989 2.506 1.00 . A A . 13 PRO HD2 1 1 8 4642 1 1 13 PRO HD3 H 2.747 4.529 1.748 1.00 . A A . 13 PRO HD3 1 1 8 4643 1 1 13 PRO HG2 H 3.254 4.047 4.334 1.00 . A A . 13 PRO HG2 1 1 8 4644 1 1 13 PRO HG3 H 4.393 4.956 3.322 1.00 . A A . 13 PRO HG3 1 1 8 4645 1 1 13 PRO N N 4.101 2.939 1.408 1.00 . A A . 13 PRO N 1 1 8 4646 1 1 13 PRO O O 6.638 0.538 2.338 1.00 . A A . 13 PRO O 1 1 8 4647 1 1 14 THR C C 5.167 -1.729 0.632 1.00 . A A . 14 THR C 1 1 8 4648 1 1 14 THR CA C 4.538 -1.220 1.933 1.00 . A A . 14 THR CA 1 1 8 4649 1 1 14 THR CB C 3.150 -1.856 2.121 1.00 . A A . 14 THR CB 1 1 8 4650 1 1 14 THR CG2 C 3.257 -3.355 2.358 1.00 . A A . 14 THR CG2 1 1 8 4651 1 1 14 THR H H 3.570 0.659 1.836 1.00 . A A . 14 THR H 1 1 8 4652 1 1 14 THR HA H 5.161 -1.522 2.760 1.00 . A A . 14 THR HA 1 1 8 4653 1 1 14 THR HB H 2.566 -1.687 1.227 1.00 . A A . 14 THR HB 1 1 8 4654 1 1 14 THR HG1 H 1.594 -0.967 2.967 1.00 . A A . 14 THR HG1 1 1 8 4655 1 1 14 THR HG21 H 3.360 -3.547 3.416 1.00 . A A . 14 THR HG21 1 1 8 4656 1 1 14 THR HG22 H 4.121 -3.742 1.836 1.00 . A A . 14 THR HG22 1 1 8 4657 1 1 14 THR HG23 H 2.367 -3.842 1.990 1.00 . A A . 14 THR HG23 1 1 8 4658 1 1 14 THR N N 4.447 0.235 1.951 1.00 . A A . 14 THR N 1 1 8 4659 1 1 14 THR O O 4.723 -1.378 -0.460 1.00 . A A . 14 THR O 1 1 8 4660 1 1 14 THR OG1 O 2.490 -1.243 3.236 1.00 . A A . 14 THR OG1 1 1 8 4661 1 1 15 PRO C C 6.281 -4.063 -1.193 1.00 . A A . 15 PRO C 1 1 8 4662 1 1 15 PRO CA C 7.027 -2.969 -0.429 1.00 . A A . 15 PRO CA 1 1 8 4663 1 1 15 PRO CB C 8.319 -3.535 0.177 1.00 . A A . 15 PRO CB 1 1 8 4664 1 1 15 PRO CD C 6.978 -2.797 1.993 1.00 . A A . 15 PRO CD 1 1 8 4665 1 1 15 PRO CG C 8.398 -2.936 1.535 1.00 . A A . 15 PRO CG 1 1 8 4666 1 1 15 PRO HA H 7.271 -2.162 -1.103 1.00 . A A . 15 PRO HA 1 1 8 4667 1 1 15 PRO HB2 H 8.257 -4.612 0.223 1.00 . A A . 15 PRO HB2 1 1 8 4668 1 1 15 PRO HB3 H 9.164 -3.244 -0.428 1.00 . A A . 15 PRO HB3 1 1 8 4669 1 1 15 PRO HD2 H 6.620 -3.727 2.414 1.00 . A A . 15 PRO HD2 1 1 8 4670 1 1 15 PRO HD3 H 6.883 -1.992 2.704 1.00 . A A . 15 PRO HD3 1 1 8 4671 1 1 15 PRO HG2 H 8.948 -3.590 2.192 1.00 . A A . 15 PRO HG2 1 1 8 4672 1 1 15 PRO HG3 H 8.870 -1.967 1.480 1.00 . A A . 15 PRO HG3 1 1 8 4673 1 1 15 PRO N N 6.279 -2.479 0.738 1.00 . A A . 15 PRO N 1 1 8 4674 1 1 15 PRO O O 6.388 -4.162 -2.417 1.00 . A A . 15 PRO O 1 1 8 4675 1 1 16 GLY C C 3.536 -5.520 -1.712 1.00 . A A . 16 GLY C 1 1 8 4676 1 1 16 GLY CA C 4.829 -5.993 -1.085 1.00 . A A . 16 GLY CA 1 1 8 4677 1 1 16 GLY H H 5.533 -4.800 0.511 1.00 . A A . 16 GLY H 1 1 8 4678 1 1 16 GLY HA2 H 5.449 -6.438 -1.845 1.00 . A A . 16 GLY HA2 1 1 8 4679 1 1 16 GLY HA3 H 4.601 -6.737 -0.336 1.00 . A A . 16 GLY HA3 1 1 8 4680 1 1 16 GLY N N 5.555 -4.903 -0.464 1.00 . A A . 16 GLY N 1 1 8 4681 1 1 16 GLY O O 3.219 -5.873 -2.847 1.00 . A A . 16 GLY O 1 1 8 4682 1 1 17 CYS C C 2.048 -3.024 -2.645 1.00 . A A . 17 CYS C 1 1 8 4683 1 1 17 CYS CA C 1.662 -3.996 -1.531 1.00 . A A . 17 CYS CA 1 1 8 4684 1 1 17 CYS CB C 0.949 -3.278 -0.385 1.00 . A A . 17 CYS CB 1 1 8 4685 1 1 17 CYS H H 3.219 -4.323 -0.162 1.00 . A A . 17 CYS H 1 1 8 4686 1 1 17 CYS HA H 1.016 -4.765 -1.931 1.00 . A A . 17 CYS HA 1 1 8 4687 1 1 17 CYS HB2 H 0.687 -4.000 0.373 1.00 . A A . 17 CYS HB2 1 1 8 4688 1 1 17 CYS HB3 H 1.630 -2.557 0.047 1.00 . A A . 17 CYS HB3 1 1 8 4689 1 1 17 CYS N N 2.857 -4.629 -1.012 1.00 . A A . 17 CYS N 1 1 8 4690 1 1 17 CYS O O 3.114 -2.404 -2.593 1.00 . A A . 17 CYS O 1 1 8 4691 1 1 17 CYS SG S -0.572 -2.392 -0.841 1.00 . A A . 17 CYS SG 1 1 8 4692 1 1 18 ASP C C 1.191 -0.746 -4.701 1.00 . A A . 18 ASP C 1 1 8 4693 1 1 18 ASP CA C 1.624 -2.200 -4.880 1.00 . A A . 18 ASP CA 1 1 8 4694 1 1 18 ASP CB C 1.012 -2.790 -6.160 1.00 . A A . 18 ASP CB 1 1 8 4695 1 1 18 ASP CG C -0.349 -2.212 -6.500 1.00 . A A . 18 ASP CG 1 1 8 4696 1 1 18 ASP H H 0.484 -3.581 -3.750 1.00 . A A . 18 ASP H 1 1 8 4697 1 1 18 ASP HA H 2.702 -2.223 -4.971 1.00 . A A . 18 ASP HA 1 1 8 4698 1 1 18 ASP HB2 H 1.677 -2.596 -6.987 1.00 . A A . 18 ASP HB2 1 1 8 4699 1 1 18 ASP HB3 H 0.908 -3.858 -6.036 1.00 . A A . 18 ASP HB3 1 1 8 4700 1 1 18 ASP N N 1.268 -2.996 -3.713 1.00 . A A . 18 ASP N 1 1 8 4701 1 1 18 ASP O O 1.906 0.174 -5.096 1.00 . A A . 18 ASP O 1 1 8 4702 1 1 18 ASP OD1 O -1.344 -2.590 -5.847 1.00 . A A . 18 ASP OD1 1 1 8 4703 1 1 18 ASP OD2 O -0.430 -1.376 -7.419 1.00 . A A . 18 ASP OD2 1 1 8 4704 1 1 19 GLY C C -1.808 1.028 -4.392 1.00 . A A . 19 GLY C 1 1 8 4705 1 1 19 GLY CA C -0.433 0.793 -3.797 1.00 . A A . 19 GLY CA 1 1 8 4706 1 1 19 GLY H H -0.441 -1.323 -3.703 1.00 . A A . 19 GLY H 1 1 8 4707 1 1 19 GLY HA2 H -0.484 0.952 -2.730 1.00 . A A . 19 GLY HA2 1 1 8 4708 1 1 19 GLY HA3 H 0.261 1.502 -4.225 1.00 . A A . 19 GLY HA3 1 1 8 4709 1 1 19 GLY N N 0.056 -0.549 -4.044 1.00 . A A . 19 GLY N 1 1 8 4710 1 1 19 GLY O O -2.482 1.998 -4.046 1.00 . A A . 19 GLY O 1 1 8 4711 1 1 20 SER C C -4.589 -0.608 -5.033 1.00 . A A . 20 SER C 1 1 8 4712 1 1 20 SER CA C -3.581 0.210 -5.831 1.00 . A A . 20 SER CA 1 1 8 4713 1 1 20 SER CB C -3.553 -0.266 -7.285 1.00 . A A . 20 SER CB 1 1 8 4714 1 1 20 SER H H -1.696 -0.672 -5.445 1.00 . A A . 20 SER H 1 1 8 4715 1 1 20 SER HA H -3.879 1.248 -5.806 1.00 . A A . 20 SER HA 1 1 8 4716 1 1 20 SER HB2 H -3.531 -1.345 -7.307 1.00 . A A . 20 SER HB2 1 1 8 4717 1 1 20 SER HB3 H -4.438 0.087 -7.794 1.00 . A A . 20 SER HB3 1 1 8 4718 1 1 20 SER HG H -1.630 -0.299 -7.704 1.00 . A A . 20 SER HG 1 1 8 4719 1 1 20 SER N N -2.255 0.113 -5.239 1.00 . A A . 20 SER N 1 1 8 4720 1 1 20 SER O O -4.301 -1.729 -4.606 1.00 . A A . 20 SER O 1 1 8 4721 1 1 20 SER OG O -2.409 0.228 -7.960 1.00 . A A . 20 SER OG 1 1 8 4722 1 1 21 GLY C C -6.781 -0.332 -2.597 1.00 . A A . 21 GLY C 1 1 8 4723 1 1 21 GLY CA C -6.791 -0.718 -4.061 1.00 . A A . 21 GLY CA 1 1 8 4724 1 1 21 GLY H H -5.928 0.873 -5.157 1.00 . A A . 21 GLY H 1 1 8 4725 1 1 21 GLY HA2 H -7.755 -0.472 -4.484 1.00 . A A . 21 GLY HA2 1 1 8 4726 1 1 21 GLY HA3 H -6.633 -1.783 -4.144 1.00 . A A . 21 GLY HA3 1 1 8 4727 1 1 21 GLY N N -5.762 -0.034 -4.812 1.00 . A A . 21 GLY N 1 1 8 4728 1 1 21 GLY O O -6.027 0.547 -2.194 1.00 . A A . 21 GLY O 1 1 8 4729 1 1 22 HIS C C -8.252 -1.990 0.315 1.00 . A A . 22 HIS C 1 1 8 4730 1 1 22 HIS CA C -7.731 -0.741 -0.376 1.00 . A A . 22 HIS CA 1 1 8 4731 1 1 22 HIS CB C -8.691 0.420 -0.072 1.00 . A A . 22 HIS CB 1 1 8 4732 1 1 22 HIS CD2 C -7.465 2.603 -0.799 1.00 . A A . 22 HIS CD2 1 1 8 4733 1 1 22 HIS CE1 C -7.454 3.600 1.146 1.00 . A A . 22 HIS CE1 1 1 8 4734 1 1 22 HIS CG C -8.050 1.766 0.090 1.00 . A A . 22 HIS CG 1 1 8 4735 1 1 22 HIS H H -8.194 -1.686 -2.214 1.00 . A A . 22 HIS H 1 1 8 4736 1 1 22 HIS HA H -6.747 -0.506 0.003 1.00 . A A . 22 HIS HA 1 1 8 4737 1 1 22 HIS HB2 H -9.407 0.498 -0.878 1.00 . A A . 22 HIS HB2 1 1 8 4738 1 1 22 HIS HB3 H -9.222 0.196 0.842 1.00 . A A . 22 HIS HB3 1 1 8 4739 1 1 22 HIS HD1 H -8.368 2.072 2.154 1.00 . A A . 22 HIS HD1 1 1 8 4740 1 1 22 HIS HD2 H -7.314 2.413 -1.853 1.00 . A A . 22 HIS HD2 1 1 8 4741 1 1 22 HIS HE1 H -7.311 4.332 1.927 1.00 . A A . 22 HIS HE1 1 1 8 4742 1 1 22 HIS HE2 H -6.842 4.596 -0.532 1.00 . A A . 22 HIS HE2 1 1 8 4743 1 1 22 HIS N N -7.623 -0.984 -1.813 1.00 . A A . 22 HIS N 1 1 8 4744 1 1 22 HIS ND1 N -8.021 2.422 1.299 1.00 . A A . 22 HIS ND1 1 1 8 4745 1 1 22 HIS NE2 N -7.104 3.738 -0.115 1.00 . A A . 22 HIS NE2 1 1 8 4746 1 1 22 HIS O O -8.906 -2.816 -0.318 1.00 . A A . 22 HIS O 1 1 8 4747 1 1 23 ILE C C -10.224 -2.902 2.475 1.00 . A A . 23 ILE C 1 1 8 4748 1 1 23 ILE CA C -8.711 -3.114 2.413 1.00 . A A . 23 ILE CA 1 1 8 4749 1 1 23 ILE CB C -8.099 -3.188 3.841 1.00 . A A . 23 ILE CB 1 1 8 4750 1 1 23 ILE CD1 C -7.646 -5.663 3.418 1.00 . A A . 23 ILE CD1 1 1 8 4751 1 1 23 ILE CG1 C -7.097 -4.344 3.925 1.00 . A A . 23 ILE CG1 1 1 8 4752 1 1 23 ILE CG2 C -9.171 -3.338 4.916 1.00 . A A . 23 ILE CG2 1 1 8 4753 1 1 23 ILE H H -7.686 -1.291 2.099 1.00 . A A . 23 ILE H 1 1 8 4754 1 1 23 ILE HA H -8.513 -4.048 1.907 1.00 . A A . 23 ILE HA 1 1 8 4755 1 1 23 ILE HB H -7.576 -2.261 4.026 1.00 . A A . 23 ILE HB 1 1 8 4756 1 1 23 ILE HD11 H -7.450 -6.439 4.144 1.00 . A A . 23 ILE HD11 1 1 8 4757 1 1 23 ILE HD12 H -8.712 -5.574 3.265 1.00 . A A . 23 ILE HD12 1 1 8 4758 1 1 23 ILE HD13 H -7.169 -5.917 2.483 1.00 . A A . 23 ILE HD13 1 1 8 4759 1 1 23 ILE HG12 H -6.229 -4.099 3.332 1.00 . A A . 23 ILE HG12 1 1 8 4760 1 1 23 ILE HG13 H -6.798 -4.479 4.954 1.00 . A A . 23 ILE HG13 1 1 8 4761 1 1 23 ILE HG21 H -9.920 -4.042 4.582 1.00 . A A . 23 ILE HG21 1 1 8 4762 1 1 23 ILE HG22 H -8.718 -3.698 5.828 1.00 . A A . 23 ILE HG22 1 1 8 4763 1 1 23 ILE HG23 H -9.633 -2.380 5.094 1.00 . A A . 23 ILE HG23 1 1 8 4764 1 1 23 ILE N N -8.109 -2.042 1.632 1.00 . A A . 23 ILE N 1 1 8 4765 1 1 23 ILE O O -11.003 -3.851 2.398 1.00 . A A . 23 ILE O 1 1 8 4766 1 1 24 THR C C -12.627 -1.440 1.080 1.00 . A A . 24 THR C 1 1 8 4767 1 1 24 THR CA C -12.038 -1.288 2.488 1.00 . A A . 24 THR CA 1 1 8 4768 1 1 24 THR CB C -12.260 0.149 3.022 1.00 . A A . 24 THR CB 1 1 8 4769 1 1 24 THR CG2 C -12.134 1.187 1.918 1.00 . A A . 24 THR CG2 1 1 8 4770 1 1 24 THR H H -9.955 -0.924 2.517 1.00 . A A . 24 THR H 1 1 8 4771 1 1 24 THR HA H -12.550 -1.971 3.149 1.00 . A A . 24 THR HA 1 1 8 4772 1 1 24 THR HB H -11.501 0.354 3.767 1.00 . A A . 24 THR HB 1 1 8 4773 1 1 24 THR HG1 H -13.836 -0.629 3.936 1.00 . A A . 24 THR HG1 1 1 8 4774 1 1 24 THR HG21 H -11.388 0.865 1.206 1.00 . A A . 24 THR HG21 1 1 8 4775 1 1 24 THR HG22 H -11.839 2.134 2.346 1.00 . A A . 24 THR HG22 1 1 8 4776 1 1 24 THR HG23 H -13.085 1.296 1.419 1.00 . A A . 24 THR HG23 1 1 8 4777 1 1 24 THR N N -10.628 -1.638 2.504 1.00 . A A . 24 THR N 1 1 8 4778 1 1 24 THR O O -13.835 -1.614 0.913 1.00 . A A . 24 THR O 1 1 8 4779 1 1 24 THR OG1 O -13.548 0.253 3.640 1.00 . A A . 24 THR OG1 1 1 8 4780 1 1 25 GLY C C -13.060 -0.614 -1.866 1.00 . A A . 25 GLY C 1 1 8 4781 1 1 25 GLY CA C -12.165 -1.706 -1.294 1.00 . A A . 25 GLY CA 1 1 8 4782 1 1 25 GLY H H -10.794 -1.419 0.289 1.00 . A A . 25 GLY H 1 1 8 4783 1 1 25 GLY HA2 H -11.283 -1.786 -1.911 1.00 . A A . 25 GLY HA2 1 1 8 4784 1 1 25 GLY HA3 H -12.695 -2.648 -1.331 1.00 . A A . 25 GLY HA3 1 1 8 4785 1 1 25 GLY N N -11.747 -1.464 0.080 1.00 . A A . 25 GLY N 1 1 8 4786 1 1 25 GLY O O -13.791 -0.850 -2.829 1.00 . A A . 25 GLY O 1 1 8 4787 1 1 26 ASN C C -13.161 2.767 -2.352 1.00 . A A . 26 ASN C 1 1 8 4788 1 1 26 ASN CA C -13.925 1.659 -1.637 1.00 . A A . 26 ASN CA 1 1 8 4789 1 1 26 ASN CB C -14.614 2.241 -0.401 1.00 . A A . 26 ASN CB 1 1 8 4790 1 1 26 ASN CG C -15.935 1.568 -0.103 1.00 . A A . 26 ASN CG 1 1 8 4791 1 1 26 ASN H H -12.494 0.661 -0.443 1.00 . A A . 26 ASN H 1 1 8 4792 1 1 26 ASN HA H -14.677 1.265 -2.302 1.00 . A A . 26 ASN HA 1 1 8 4793 1 1 26 ASN HB2 H -13.967 2.113 0.455 1.00 . A A . 26 ASN HB2 1 1 8 4794 1 1 26 ASN HB3 H -14.789 3.296 -0.556 1.00 . A A . 26 ASN HB3 1 1 8 4795 1 1 26 ASN HD21 H -14.992 -0.070 0.515 1.00 . A A . 26 ASN HD21 1 1 8 4796 1 1 26 ASN HD22 H -16.715 -0.125 0.575 1.00 . A A . 26 ASN HD22 1 1 8 4797 1 1 26 ASN N N -13.048 0.556 -1.240 1.00 . A A . 26 ASN N 1 1 8 4798 1 1 26 ASN ND2 N -15.875 0.336 0.378 1.00 . A A . 26 ASN ND2 1 1 8 4799 1 1 26 ASN O O -13.667 3.879 -2.499 1.00 . A A . 26 ASN O 1 1 8 4800 1 1 26 ASN OD1 O -16.999 2.152 -0.297 1.00 . A A . 26 ASN OD1 1 1 8 4801 1 1 27 TYR C C -10.396 2.986 -4.578 1.00 . A A . 27 TYR C 1 1 8 4802 1 1 27 TYR CA C -11.072 3.519 -3.318 1.00 . A A . 27 TYR CA 1 1 8 4803 1 1 27 TYR CB C -10.011 3.982 -2.321 1.00 . A A . 27 TYR CB 1 1 8 4804 1 1 27 TYR CD1 C -11.151 4.047 -0.070 1.00 . A A . 27 TYR CD1 1 1 8 4805 1 1 27 TYR CD2 C -10.517 6.116 -1.066 1.00 . A A . 27 TYR CD2 1 1 8 4806 1 1 27 TYR CE1 C -11.667 4.721 1.015 1.00 . A A . 27 TYR CE1 1 1 8 4807 1 1 27 TYR CE2 C -11.032 6.798 0.022 1.00 . A A . 27 TYR CE2 1 1 8 4808 1 1 27 TYR CG C -10.570 4.730 -1.129 1.00 . A A . 27 TYR CG 1 1 8 4809 1 1 27 TYR CZ C -11.606 6.094 1.059 1.00 . A A . 27 TYR CZ 1 1 8 4810 1 1 27 TYR H H -11.528 1.622 -2.513 1.00 . A A . 27 TYR H 1 1 8 4811 1 1 27 TYR HA H -11.699 4.356 -3.581 1.00 . A A . 27 TYR HA 1 1 8 4812 1 1 27 TYR HB2 H -9.477 3.122 -1.948 1.00 . A A . 27 TYR HB2 1 1 8 4813 1 1 27 TYR HB3 H -9.322 4.630 -2.827 1.00 . A A . 27 TYR HB3 1 1 8 4814 1 1 27 TYR HD1 H -11.201 2.970 -0.104 1.00 . A A . 27 TYR HD1 1 1 8 4815 1 1 27 TYR HD2 H -10.070 6.664 -1.883 1.00 . A A . 27 TYR HD2 1 1 8 4816 1 1 27 TYR HE1 H -12.117 4.168 1.826 1.00 . A A . 27 TYR HE1 1 1 8 4817 1 1 27 TYR HE2 H -10.982 7.877 0.056 1.00 . A A . 27 TYR HE2 1 1 8 4818 1 1 27 TYR HH H -13.097 6.751 2.088 1.00 . A A . 27 TYR HH 1 1 8 4819 1 1 27 TYR N N -11.912 2.504 -2.707 1.00 . A A . 27 TYR N 1 1 8 4820 1 1 27 TYR O O -10.574 1.824 -4.951 1.00 . A A . 27 TYR O 1 1 8 4821 1 1 27 TYR OH O -12.127 6.765 2.144 1.00 . A A . 27 TYR OH 1 1 8 4822 1 1 28 ALA C C -7.401 3.057 -6.008 1.00 . A A . 28 ALA C 1 1 8 4823 1 1 28 ALA CA C -8.828 3.436 -6.373 1.00 . A A . 28 ALA CA 1 1 8 4824 1 1 28 ALA CB C -8.833 4.565 -7.392 1.00 . A A . 28 ALA CB 1 1 8 4825 1 1 28 ALA H H -9.430 4.722 -4.809 1.00 . A A . 28 ALA H 1 1 8 4826 1 1 28 ALA HA H -9.317 2.581 -6.813 1.00 . A A . 28 ALA HA 1 1 8 4827 1 1 28 ALA HB1 H -9.662 4.433 -8.069 1.00 . A A . 28 ALA HB1 1 1 8 4828 1 1 28 ALA HB2 H -8.933 5.511 -6.880 1.00 . A A . 28 ALA HB2 1 1 8 4829 1 1 28 ALA HB3 H -7.907 4.552 -7.949 1.00 . A A . 28 ALA HB3 1 1 8 4830 1 1 28 ALA N N -9.571 3.822 -5.188 1.00 . A A . 28 ALA N 1 1 8 4831 1 1 28 ALA O O -6.877 2.041 -6.470 1.00 . A A . 28 ALA O 1 1 8 4832 1 1 29 SER C C -5.105 4.346 -3.434 1.00 . A A . 29 SER C 1 1 8 4833 1 1 29 SER CA C -5.410 3.618 -4.737 1.00 . A A . 29 SER CA 1 1 8 4834 1 1 29 SER CB C -4.439 4.070 -5.831 1.00 . A A . 29 SER CB 1 1 8 4835 1 1 29 SER H H -7.251 4.656 -4.809 1.00 . A A . 29 SER H 1 1 8 4836 1 1 29 SER HA H -5.295 2.556 -4.579 1.00 . A A . 29 SER HA 1 1 8 4837 1 1 29 SER HB2 H -3.427 4.014 -5.457 1.00 . A A . 29 SER HB2 1 1 8 4838 1 1 29 SER HB3 H -4.543 3.422 -6.690 1.00 . A A . 29 SER HB3 1 1 8 4839 1 1 29 SER HG H -3.947 5.965 -5.987 1.00 . A A . 29 SER HG 1 1 8 4840 1 1 29 SER N N -6.778 3.865 -5.158 1.00 . A A . 29 SER N 1 1 8 4841 1 1 29 SER O O -5.954 5.060 -2.896 1.00 . A A . 29 SER O 1 1 8 4842 1 1 29 SER OG O -4.703 5.404 -6.230 1.00 . A A . 29 SER OG 1 1 8 4843 1 1 30 HIS C C -1.940 5.036 -1.771 1.00 . A A . 30 HIS C 1 1 8 4844 1 1 30 HIS CA C -3.449 4.791 -1.704 1.00 . A A . 30 HIS CA 1 1 8 4845 1 1 30 HIS CB C -3.794 3.919 -0.493 1.00 . A A . 30 HIS CB 1 1 8 4846 1 1 30 HIS CD2 C -2.014 2.101 -0.057 1.00 . A A . 30 HIS CD2 1 1 8 4847 1 1 30 HIS CE1 C -2.940 0.434 -1.080 1.00 . A A . 30 HIS CE1 1 1 8 4848 1 1 30 HIS CG C -3.193 2.551 -0.547 1.00 . A A . 30 HIS CG 1 1 8 4849 1 1 30 HIS H H -3.277 3.548 -3.396 1.00 . A A . 30 HIS H 1 1 8 4850 1 1 30 HIS HA H -3.956 5.741 -1.615 1.00 . A A . 30 HIS HA 1 1 8 4851 1 1 30 HIS HB2 H -3.434 4.403 0.398 1.00 . A A . 30 HIS HB2 1 1 8 4852 1 1 30 HIS HB3 H -4.867 3.809 -0.429 1.00 . A A . 30 HIS HB3 1 1 8 4853 1 1 30 HIS HD1 H -4.643 1.469 -1.652 1.00 . A A . 30 HIS HD1 1 1 8 4854 1 1 30 HIS HD2 H -1.297 2.672 0.511 1.00 . A A . 30 HIS HD2 1 1 8 4855 1 1 30 HIS HE1 H -3.122 -0.549 -1.489 1.00 . A A . 30 HIS HE1 1 1 8 4856 1 1 30 HIS N N -3.896 4.151 -2.929 1.00 . A A . 30 HIS N 1 1 8 4857 1 1 30 HIS ND1 N -3.772 1.476 -1.193 1.00 . A A . 30 HIS ND1 1 1 8 4858 1 1 30 HIS NE2 N -1.877 0.774 -0.406 1.00 . A A . 30 HIS NE2 1 1 8 4859 1 1 30 HIS O O -1.266 4.532 -2.670 1.00 . A A . 30 HIS O 1 1 8 4860 1 1 31 ARG C C 0.556 5.962 0.641 1.00 . A A . 31 ARG C 1 1 8 4861 1 1 31 ARG CA C 0.020 6.069 -0.780 1.00 . A A . 31 ARG CA 1 1 8 4862 1 1 31 ARG CB C 0.316 7.462 -1.344 1.00 . A A . 31 ARG CB 1 1 8 4863 1 1 31 ARG CD C 0.261 9.534 0.079 1.00 . A A . 31 ARG CD 1 1 8 4864 1 1 31 ARG CG C -0.553 8.559 -0.755 1.00 . A A . 31 ARG CG 1 1 8 4865 1 1 31 ARG CZ C -0.863 10.787 1.889 1.00 . A A . 31 ARG CZ 1 1 8 4866 1 1 31 ARG H H -1.992 6.147 -0.108 1.00 . A A . 31 ARG H 1 1 8 4867 1 1 31 ARG HA H 0.517 5.331 -1.393 1.00 . A A . 31 ARG HA 1 1 8 4868 1 1 31 ARG HB2 H 1.348 7.706 -1.146 1.00 . A A . 31 ARG HB2 1 1 8 4869 1 1 31 ARG HB3 H 0.159 7.444 -2.413 1.00 . A A . 31 ARG HB3 1 1 8 4870 1 1 31 ARG HD2 H 1.277 9.171 0.149 1.00 . A A . 31 ARG HD2 1 1 8 4871 1 1 31 ARG HD3 H 0.254 10.497 -0.409 1.00 . A A . 31 ARG HD3 1 1 8 4872 1 1 31 ARG HE H -0.221 8.894 2.028 1.00 . A A . 31 ARG HE 1 1 8 4873 1 1 31 ARG HG2 H -1.025 9.100 -1.562 1.00 . A A . 31 ARG HG2 1 1 8 4874 1 1 31 ARG HG3 H -1.310 8.108 -0.131 1.00 . A A . 31 ARG HG3 1 1 8 4875 1 1 31 ARG HH11 H -0.619 11.847 0.175 1.00 . A A . 31 ARG HH11 1 1 8 4876 1 1 31 ARG HH12 H -1.417 12.695 1.460 1.00 . A A . 31 ARG HH12 1 1 8 4877 1 1 31 ARG HH21 H -1.260 10.007 3.715 1.00 . A A . 31 ARG HH21 1 1 8 4878 1 1 31 ARG HH22 H -1.774 11.650 3.484 1.00 . A A . 31 ARG HH22 1 1 8 4879 1 1 31 ARG N N -1.411 5.785 -0.817 1.00 . A A . 31 ARG N 1 1 8 4880 1 1 31 ARG NE N -0.285 9.679 1.429 1.00 . A A . 31 ARG NE 1 1 8 4881 1 1 31 ARG NH1 N -0.974 11.861 1.114 1.00 . A A . 31 ARG NH1 1 1 8 4882 1 1 31 ARG NH2 N -1.337 10.817 3.127 1.00 . A A . 31 ARG NH2 1 1 8 4883 1 1 31 ARG O O 1.713 6.287 0.905 1.00 . A A . 31 ARG O 1 1 8 4884 1 1 32 SER C C -0.323 3.979 3.452 1.00 . A A . 32 SER C 1 1 8 4885 1 1 32 SER CA C 0.094 5.354 2.941 1.00 . A A . 32 SER CA 1 1 8 4886 1 1 32 SER CB C -0.543 6.459 3.785 1.00 . A A . 32 SER CB 1 1 8 4887 1 1 32 SER H H -1.198 5.252 1.277 1.00 . A A . 32 SER H 1 1 8 4888 1 1 32 SER HA H 1.169 5.440 2.999 1.00 . A A . 32 SER HA 1 1 8 4889 1 1 32 SER HB2 H -1.334 6.037 4.389 1.00 . A A . 32 SER HB2 1 1 8 4890 1 1 32 SER HB3 H 0.205 6.895 4.427 1.00 . A A . 32 SER HB3 1 1 8 4891 1 1 32 SER HG H -1.762 7.095 2.380 1.00 . A A . 32 SER HG 1 1 8 4892 1 1 32 SER N N -0.291 5.508 1.550 1.00 . A A . 32 SER N 1 1 8 4893 1 1 32 SER O O -1.095 3.279 2.799 1.00 . A A . 32 SER O 1 1 8 4894 1 1 32 SER OG O -1.092 7.482 2.964 1.00 . A A . 32 SER OG 1 1 8 4895 1 1 33 LEU C C -1.447 2.192 5.825 1.00 . A A . 33 LEU C 1 1 8 4896 1 1 33 LEU CA C -0.063 2.275 5.177 1.00 . A A . 33 LEU CA 1 1 8 4897 1 1 33 LEU CB C 1.001 1.958 6.227 1.00 . A A . 33 LEU CB 1 1 8 4898 1 1 33 LEU CD1 C 3.365 1.198 6.499 1.00 . A A . 33 LEU CD1 1 1 8 4899 1 1 33 LEU CD2 C 1.547 -0.475 6.133 1.00 . A A . 33 LEU CD2 1 1 8 4900 1 1 33 LEU CG C 2.037 0.924 5.810 1.00 . A A . 33 LEU CG 1 1 8 4901 1 1 33 LEU H H 0.852 4.180 5.060 1.00 . A A . 33 LEU H 1 1 8 4902 1 1 33 LEU HA H 0.000 1.549 4.382 1.00 . A A . 33 LEU HA 1 1 8 4903 1 1 33 LEU HB2 H 1.516 2.875 6.470 1.00 . A A . 33 LEU HB2 1 1 8 4904 1 1 33 LEU HB3 H 0.501 1.598 7.115 1.00 . A A . 33 LEU HB3 1 1 8 4905 1 1 33 LEU HD11 H 3.890 0.266 6.651 1.00 . A A . 33 LEU HD11 1 1 8 4906 1 1 33 LEU HD12 H 3.964 1.852 5.881 1.00 . A A . 33 LEU HD12 1 1 8 4907 1 1 33 LEU HD13 H 3.185 1.670 7.453 1.00 . A A . 33 LEU HD13 1 1 8 4908 1 1 33 LEU HD21 H 0.504 -0.562 5.865 1.00 . A A . 33 LEU HD21 1 1 8 4909 1 1 33 LEU HD22 H 2.124 -1.197 5.574 1.00 . A A . 33 LEU HD22 1 1 8 4910 1 1 33 LEU HD23 H 1.662 -0.662 7.190 1.00 . A A . 33 LEU HD23 1 1 8 4911 1 1 33 LEU HG H 2.191 0.995 4.744 1.00 . A A . 33 LEU HG 1 1 8 4912 1 1 33 LEU N N 0.198 3.593 4.610 1.00 . A A . 33 LEU N 1 1 8 4913 1 1 33 LEU O O -1.721 1.282 6.610 1.00 . A A . 33 LEU O 1 1 8 4914 1 1 34 SER C C -4.658 2.476 5.232 1.00 . A A . 34 SER C 1 1 8 4915 1 1 34 SER CA C -3.636 3.196 6.107 1.00 . A A . 34 SER CA 1 1 8 4916 1 1 34 SER CB C -4.065 4.646 6.309 1.00 . A A . 34 SER CB 1 1 8 4917 1 1 34 SER H H -2.025 3.873 4.923 1.00 . A A . 34 SER H 1 1 8 4918 1 1 34 SER HA H -3.591 2.706 7.068 1.00 . A A . 34 SER HA 1 1 8 4919 1 1 34 SER HB2 H -4.987 4.818 5.776 1.00 . A A . 34 SER HB2 1 1 8 4920 1 1 34 SER HB3 H -4.217 4.832 7.361 1.00 . A A . 34 SER HB3 1 1 8 4921 1 1 34 SER HG H -3.516 6.255 5.317 1.00 . A A . 34 SER HG 1 1 8 4922 1 1 34 SER N N -2.305 3.152 5.522 1.00 . A A . 34 SER N 1 1 8 4923 1 1 34 SER O O -5.819 2.326 5.620 1.00 . A A . 34 SER O 1 1 8 4924 1 1 34 SER OG O -3.080 5.546 5.817 1.00 . A A . 34 SER OG 1 1 8 4925 1 1 35 GLY C C -4.583 0.301 2.350 1.00 . A A . 35 GLY C 1 1 8 4926 1 1 35 GLY CA C -5.185 1.461 3.114 1.00 . A A . 35 GLY CA 1 1 8 4927 1 1 35 GLY H H -3.330 2.267 3.745 1.00 . A A . 35 GLY H 1 1 8 4928 1 1 35 GLY HA2 H -6.034 1.102 3.677 1.00 . A A . 35 GLY HA2 1 1 8 4929 1 1 35 GLY HA3 H -5.527 2.204 2.408 1.00 . A A . 35 GLY HA3 1 1 8 4930 1 1 35 GLY N N -4.252 2.086 4.030 1.00 . A A . 35 GLY N 1 1 8 4931 1 1 35 GLY O O -5.100 -0.078 1.301 1.00 . A A . 35 GLY O 1 1 8 4932 1 1 36 CYS C C -3.635 -2.666 2.296 1.00 . A A . 36 CYS C 1 1 8 4933 1 1 36 CYS CA C -2.809 -1.378 2.236 1.00 . A A . 36 CYS CA 1 1 8 4934 1 1 36 CYS CB C -1.451 -1.599 2.904 1.00 . A A . 36 CYS CB 1 1 8 4935 1 1 36 CYS H H -3.147 0.095 3.722 1.00 . A A . 36 CYS H 1 1 8 4936 1 1 36 CYS HA H -2.651 -1.120 1.200 1.00 . A A . 36 CYS HA 1 1 8 4937 1 1 36 CYS HB2 H -1.561 -1.490 3.974 1.00 . A A . 36 CYS HB2 1 1 8 4938 1 1 36 CYS HB3 H -1.107 -2.600 2.681 1.00 . A A . 36 CYS HB3 1 1 8 4939 1 1 36 CYS N N -3.498 -0.258 2.877 1.00 . A A . 36 CYS N 1 1 8 4940 1 1 36 CYS O O -3.838 -3.235 3.368 1.00 . A A . 36 CYS O 1 1 8 4941 1 1 36 CYS SG S -0.166 -0.430 2.358 1.00 . A A . 36 CYS SG 1 1 8 4942 1 1 37 PRO C C -4.034 -5.629 1.084 1.00 . A A . 37 PRO C 1 1 8 4943 1 1 37 PRO CA C -4.904 -4.372 1.056 1.00 . A A . 37 PRO CA 1 1 8 4944 1 1 37 PRO CB C -5.612 -4.231 -0.289 1.00 . A A . 37 PRO CB 1 1 8 4945 1 1 37 PRO CD C -3.953 -2.508 -0.181 1.00 . A A . 37 PRO CD 1 1 8 4946 1 1 37 PRO CG C -4.677 -3.431 -1.124 1.00 . A A . 37 PRO CG 1 1 8 4947 1 1 37 PRO HA H -5.635 -4.423 1.848 1.00 . A A . 37 PRO HA 1 1 8 4948 1 1 37 PRO HB2 H -5.784 -5.210 -0.712 1.00 . A A . 37 PRO HB2 1 1 8 4949 1 1 37 PRO HB3 H -6.554 -3.721 -0.153 1.00 . A A . 37 PRO HB3 1 1 8 4950 1 1 37 PRO HD2 H -2.910 -2.433 -0.449 1.00 . A A . 37 PRO HD2 1 1 8 4951 1 1 37 PRO HD3 H -4.413 -1.529 -0.190 1.00 . A A . 37 PRO HD3 1 1 8 4952 1 1 37 PRO HG2 H -3.976 -4.087 -1.620 1.00 . A A . 37 PRO HG2 1 1 8 4953 1 1 37 PRO HG3 H -5.234 -2.860 -1.853 1.00 . A A . 37 PRO HG3 1 1 8 4954 1 1 37 PRO N N -4.113 -3.147 1.138 1.00 . A A . 37 PRO N 1 1 8 4955 1 1 37 PRO O O -4.515 -6.721 1.381 1.00 . A A . 37 PRO O 1 1 8 4956 1 1 38 ARG C C -0.621 -6.256 1.728 1.00 . A A . 38 ARG C 1 1 8 4957 1 1 38 ARG CA C -1.808 -6.585 0.832 1.00 . A A . 38 ARG CA 1 1 8 4958 1 1 38 ARG CB C -1.314 -6.926 -0.577 1.00 . A A . 38 ARG CB 1 1 8 4959 1 1 38 ARG CD C -2.297 -6.895 -2.856 1.00 . A A . 38 ARG CD 1 1 8 4960 1 1 38 ARG CG C -2.383 -7.504 -1.475 1.00 . A A . 38 ARG CG 1 1 8 4961 1 1 38 ARG CZ C -3.536 -5.101 -4.002 1.00 . A A . 38 ARG CZ 1 1 8 4962 1 1 38 ARG H H -2.404 -4.565 0.602 1.00 . A A . 38 ARG H 1 1 8 4963 1 1 38 ARG HA H -2.328 -7.440 1.236 1.00 . A A . 38 ARG HA 1 1 8 4964 1 1 38 ARG HB2 H -0.936 -6.030 -1.047 1.00 . A A . 38 ARG HB2 1 1 8 4965 1 1 38 ARG HB3 H -0.511 -7.645 -0.499 1.00 . A A . 38 ARG HB3 1 1 8 4966 1 1 38 ARG HD2 H -1.465 -6.206 -2.878 1.00 . A A . 38 ARG HD2 1 1 8 4967 1 1 38 ARG HD3 H -2.126 -7.679 -3.570 1.00 . A A . 38 ARG HD3 1 1 8 4968 1 1 38 ARG HE H -4.367 -6.507 -2.827 1.00 . A A . 38 ARG HE 1 1 8 4969 1 1 38 ARG HG2 H -2.245 -8.573 -1.549 1.00 . A A . 38 ARG HG2 1 1 8 4970 1 1 38 ARG HG3 H -3.354 -7.289 -1.053 1.00 . A A . 38 ARG HG3 1 1 8 4971 1 1 38 ARG HH11 H -1.547 -5.142 -4.387 1.00 . A A . 38 ARG HH11 1 1 8 4972 1 1 38 ARG HH12 H -2.414 -3.832 -5.129 1.00 . A A . 38 ARG HH12 1 1 8 4973 1 1 38 ARG HH21 H -5.544 -4.818 -3.854 1.00 . A A . 38 ARG HH21 1 1 8 4974 1 1 38 ARG HH22 H -4.697 -3.663 -4.842 1.00 . A A . 38 ARG HH22 1 1 8 4975 1 1 38 ARG N N -2.744 -5.467 0.803 1.00 . A A . 38 ARG N 1 1 8 4976 1 1 38 ARG NE N -3.515 -6.176 -3.213 1.00 . A A . 38 ARG NE 1 1 8 4977 1 1 38 ARG NH1 N -2.412 -4.661 -4.552 1.00 . A A . 38 ARG NH1 1 1 8 4978 1 1 38 ARG NH2 N -4.683 -4.480 -4.253 1.00 . A A . 38 ARG NH2 1 1 8 4979 1 1 38 ARG O O 0.536 -6.436 1.344 1.00 . A A . 38 ARG O 1 1 8 4980 1 1 39 ALA C C 0.940 -6.508 4.309 1.00 . A A . 39 ALA C 1 1 8 4981 1 1 39 ALA CA C 0.104 -5.319 3.853 1.00 . A A . 39 ALA CA 1 1 8 4982 1 1 39 ALA CB C -0.530 -4.633 5.053 1.00 . A A . 39 ALA CB 1 1 8 4983 1 1 39 ALA H H -1.864 -5.583 3.135 1.00 . A A . 39 ALA H 1 1 8 4984 1 1 39 ALA HA H 0.748 -4.606 3.361 1.00 . A A . 39 ALA HA 1 1 8 4985 1 1 39 ALA HB1 H -1.107 -5.351 5.616 1.00 . A A . 39 ALA HB1 1 1 8 4986 1 1 39 ALA HB2 H 0.246 -4.223 5.683 1.00 . A A . 39 ALA HB2 1 1 8 4987 1 1 39 ALA HB3 H -1.174 -3.837 4.714 1.00 . A A . 39 ALA HB3 1 1 8 4988 1 1 39 ALA N N -0.923 -5.726 2.906 1.00 . A A . 39 ALA N 1 1 8 4989 1 1 39 ALA O O 0.442 -7.392 5.010 1.00 . A A . 39 ALA O 1 1 8 4990 1 1 40 LYS C C 2.569 -8.948 3.991 1.00 . A A . 40 LYS C 1 1 8 4991 1 1 40 LYS CA C 3.170 -7.564 4.252 1.00 . A A . 40 LYS CA 1 1 8 4992 1 1 40 LYS CB C 3.654 -7.450 5.712 1.00 . A A . 40 LYS CB 1 1 8 4993 1 1 40 LYS CD C 4.158 -5.033 6.227 1.00 . A A . 40 LYS CD 1 1 8 4994 1 1 40 LYS CE C 3.422 -3.702 6.245 1.00 . A A . 40 LYS CE 1 1 8 4995 1 1 40 LYS CG C 3.204 -6.195 6.448 1.00 . A A . 40 LYS CG 1 1 8 4996 1 1 40 LYS H H 2.526 -5.766 3.348 1.00 . A A . 40 LYS H 1 1 8 4997 1 1 40 LYS HA H 4.024 -7.441 3.601 1.00 . A A . 40 LYS HA 1 1 8 4998 1 1 40 LYS HB2 H 3.296 -8.305 6.264 1.00 . A A . 40 LYS HB2 1 1 8 4999 1 1 40 LYS HB3 H 4.733 -7.466 5.711 1.00 . A A . 40 LYS HB3 1 1 8 5000 1 1 40 LYS HD2 H 4.899 -5.036 7.012 1.00 . A A . 40 LYS HD2 1 1 8 5001 1 1 40 LYS HD3 H 4.643 -5.154 5.269 1.00 . A A . 40 LYS HD3 1 1 8 5002 1 1 40 LYS HE2 H 2.689 -3.701 5.451 1.00 . A A . 40 LYS HE2 1 1 8 5003 1 1 40 LYS HE3 H 2.922 -3.596 7.195 1.00 . A A . 40 LYS HE3 1 1 8 5004 1 1 40 LYS HG2 H 2.225 -5.912 6.088 1.00 . A A . 40 LYS HG2 1 1 8 5005 1 1 40 LYS HG3 H 3.152 -6.409 7.505 1.00 . A A . 40 LYS HG3 1 1 8 5006 1 1 40 LYS HZ1 H 4.550 -2.099 6.972 1.00 . A A . 40 LYS HZ1 1 1 8 5007 1 1 40 LYS HZ2 H 3.912 -1.847 5.423 1.00 . A A . 40 LYS HZ2 1 1 8 5008 1 1 40 LYS HZ3 H 5.244 -2.875 5.632 1.00 . A A . 40 LYS HZ3 1 1 8 5009 1 1 40 LYS N N 2.217 -6.503 3.914 1.00 . A A . 40 LYS N 1 1 8 5010 1 1 40 LYS NZ N 4.343 -2.551 6.053 1.00 . A A . 40 LYS NZ 1 1 8 5011 1 1 40 LYS O O 1.948 -9.176 2.950 1.00 . A A . 40 LYS O 1 1 8 5012 1 1 41 LYS C C 1.285 -11.477 6.054 1.00 . A A . 41 LYS C 1 1 8 5013 1 1 41 LYS CA C 2.146 -11.182 4.831 1.00 . A A . 41 LYS CA 1 1 8 5014 1 1 41 LYS CB C 3.253 -12.222 4.673 1.00 . A A . 41 LYS CB 1 1 8 5015 1 1 41 LYS CD C 4.455 -11.982 2.477 1.00 . A A . 41 LYS CD 1 1 8 5016 1 1 41 LYS CE C 5.048 -12.831 1.364 1.00 . A A . 41 LYS CE 1 1 8 5017 1 1 41 LYS CG C 3.391 -12.742 3.251 1.00 . A A . 41 LYS CG 1 1 8 5018 1 1 41 LYS H H 3.194 -9.610 5.769 1.00 . A A . 41 LYS H 1 1 8 5019 1 1 41 LYS HA H 1.517 -11.197 3.951 1.00 . A A . 41 LYS HA 1 1 8 5020 1 1 41 LYS HB2 H 4.193 -11.778 4.968 1.00 . A A . 41 LYS HB2 1 1 8 5021 1 1 41 LYS HB3 H 3.041 -13.059 5.322 1.00 . A A . 41 LYS HB3 1 1 8 5022 1 1 41 LYS HD2 H 4.006 -11.100 2.043 1.00 . A A . 41 LYS HD2 1 1 8 5023 1 1 41 LYS HD3 H 5.242 -11.690 3.156 1.00 . A A . 41 LYS HD3 1 1 8 5024 1 1 41 LYS HE2 H 6.091 -13.010 1.581 1.00 . A A . 41 LYS HE2 1 1 8 5025 1 1 41 LYS HE3 H 4.521 -13.774 1.326 1.00 . A A . 41 LYS HE3 1 1 8 5026 1 1 41 LYS HG2 H 3.664 -13.786 3.283 1.00 . A A . 41 LYS HG2 1 1 8 5027 1 1 41 LYS HG3 H 2.443 -12.630 2.746 1.00 . A A . 41 LYS HG3 1 1 8 5028 1 1 41 LYS HZ1 H 3.940 -12.081 -0.241 1.00 . A A . 41 LYS HZ1 1 1 8 5029 1 1 41 LYS HZ2 H 5.448 -12.717 -0.683 1.00 . A A . 41 LYS HZ2 1 1 8 5030 1 1 41 LYS HZ3 H 5.353 -11.205 0.088 1.00 . A A . 41 LYS HZ3 1 1 8 5031 1 1 41 LYS N N 2.719 -9.854 4.945 1.00 . A A . 41 LYS N 1 1 8 5032 1 1 41 LYS NZ N 4.939 -12.164 0.042 1.00 . A A . 41 LYS NZ 1 1 8 5033 1 1 41 LYS O O 0.605 -10.582 6.558 1.00 . A A . 41 LYS O 1 1 8 5034 1 1 42 SER C C 1.328 -12.497 9.028 1.00 . A A . 42 SER C 1 1 8 5035 1 1 42 SER CA C 0.623 -13.044 7.789 1.00 . A A . 42 SER CA 1 1 8 5036 1 1 42 SER CB C 0.463 -14.561 7.895 1.00 . A A . 42 SER CB 1 1 8 5037 1 1 42 SER H H 1.968 -13.358 6.179 1.00 . A A . 42 SER H 1 1 8 5038 1 1 42 SER HA H -0.354 -12.592 7.717 1.00 . A A . 42 SER HA 1 1 8 5039 1 1 42 SER HB2 H 1.385 -14.996 8.255 1.00 . A A . 42 SER HB2 1 1 8 5040 1 1 42 SER HB3 H -0.336 -14.788 8.585 1.00 . A A . 42 SER HB3 1 1 8 5041 1 1 42 SER HG H -0.103 -14.427 6.016 1.00 . A A . 42 SER HG 1 1 8 5042 1 1 42 SER N N 1.364 -12.693 6.581 1.00 . A A . 42 SER N 1 1 8 5043 1 1 42 SER O O 1.831 -13.252 9.860 1.00 . A A . 42 SER O 1 1 8 5044 1 1 42 SER OG O 0.152 -15.131 6.633 1.00 . A A . 42 SER OG 1 1 8 5045 1 1 43 GLY C C 2.530 -9.123 9.800 1.00 . A A . 43 GLY C 1 1 8 5046 1 1 43 GLY CA C 2.110 -10.523 10.184 1.00 . A A . 43 GLY CA 1 1 8 5047 1 1 43 GLY H H 1.041 -10.637 8.369 1.00 . A A . 43 GLY H 1 1 8 5048 1 1 43 GLY HA2 H 1.456 -10.477 11.044 1.00 . A A . 43 GLY HA2 1 1 8 5049 1 1 43 GLY HA3 H 2.988 -11.097 10.438 1.00 . A A . 43 GLY HA3 1 1 8 5050 1 1 43 GLY N N 1.416 -11.177 9.099 1.00 . A A . 43 GLY N 1 1 8 5051 1 1 43 GLY O O 3.571 -8.931 9.175 1.00 . A A . 43 GLY O 1 1 8 5052 1 1 44 LEU C C 2.767 -6.051 10.756 1.00 . A A . 44 LEU C 1 1 8 5053 1 1 44 LEU CA C 1.937 -6.767 9.701 1.00 . A A . 44 LEU CA 1 1 8 5054 1 1 44 LEU CB C 0.625 -6.007 9.462 1.00 . A A . 44 LEU CB 1 1 8 5055 1 1 44 LEU CD1 C -1.655 -5.766 10.456 1.00 . A A . 44 LEU CD1 1 1 8 5056 1 1 44 LEU CD2 C -1.245 -7.490 8.696 1.00 . A A . 44 LEU CD2 1 1 8 5057 1 1 44 LEU CG C -0.647 -6.746 9.880 1.00 . A A . 44 LEU CG 1 1 8 5058 1 1 44 LEU H H 0.836 -8.371 10.550 1.00 . A A . 44 LEU H 1 1 8 5059 1 1 44 LEU HA H 2.501 -6.785 8.779 1.00 . A A . 44 LEU HA 1 1 8 5060 1 1 44 LEU HB2 H 0.670 -5.077 10.008 1.00 . A A . 44 LEU HB2 1 1 8 5061 1 1 44 LEU HB3 H 0.553 -5.782 8.408 1.00 . A A . 44 LEU HB3 1 1 8 5062 1 1 44 LEU HD11 H -1.477 -4.783 10.044 1.00 . A A . 44 LEU HD11 1 1 8 5063 1 1 44 LEU HD12 H -2.655 -6.086 10.201 1.00 . A A . 44 LEU HD12 1 1 8 5064 1 1 44 LEU HD13 H -1.551 -5.728 11.531 1.00 . A A . 44 LEU HD13 1 1 8 5065 1 1 44 LEU HD21 H -1.911 -8.262 9.053 1.00 . A A . 44 LEU HD21 1 1 8 5066 1 1 44 LEU HD22 H -1.798 -6.798 8.078 1.00 . A A . 44 LEU HD22 1 1 8 5067 1 1 44 LEU HD23 H -0.454 -7.938 8.114 1.00 . A A . 44 LEU HD23 1 1 8 5068 1 1 44 LEU HG H -0.405 -7.468 10.645 1.00 . A A . 44 LEU HG 1 1 8 5069 1 1 44 LEU N N 1.679 -8.151 10.092 1.00 . A A . 44 LEU N 1 1 8 5070 1 1 44 LEU O O 3.236 -4.932 10.542 1.00 . A A . 44 LEU O 1 1 8 5071 1 1 45 ARG C C 4.936 -7.086 13.291 1.00 . A A . 45 ARG C 1 1 8 5072 1 1 45 ARG CA C 3.778 -6.158 12.957 1.00 . A A . 45 ARG CA 1 1 8 5073 1 1 45 ARG CB C 2.912 -5.924 14.197 1.00 . A A . 45 ARG CB 1 1 8 5074 1 1 45 ARG CD C 4.042 -4.158 15.586 1.00 . A A . 45 ARG CD 1 1 8 5075 1 1 45 ARG CG C 2.884 -4.473 14.652 1.00 . A A . 45 ARG CG 1 1 8 5076 1 1 45 ARG CZ C 6.159 -3.371 14.588 1.00 . A A . 45 ARG CZ 1 1 8 5077 1 1 45 ARG H H 2.601 -7.619 11.983 1.00 . A A . 45 ARG H 1 1 8 5078 1 1 45 ARG HA H 4.175 -5.213 12.620 1.00 . A A . 45 ARG HA 1 1 8 5079 1 1 45 ARG HB2 H 1.900 -6.230 13.977 1.00 . A A . 45 ARG HB2 1 1 8 5080 1 1 45 ARG HB3 H 3.294 -6.528 15.008 1.00 . A A . 45 ARG HB3 1 1 8 5081 1 1 45 ARG HD2 H 3.644 -3.809 16.527 1.00 . A A . 45 ARG HD2 1 1 8 5082 1 1 45 ARG HD3 H 4.611 -5.062 15.750 1.00 . A A . 45 ARG HD3 1 1 8 5083 1 1 45 ARG HE H 4.574 -2.209 14.997 1.00 . A A . 45 ARG HE 1 1 8 5084 1 1 45 ARG HG2 H 2.950 -3.831 13.785 1.00 . A A . 45 ARG HG2 1 1 8 5085 1 1 45 ARG HG3 H 1.953 -4.286 15.171 1.00 . A A . 45 ARG HG3 1 1 8 5086 1 1 45 ARG HH11 H 6.122 -5.352 15.013 1.00 . A A . 45 ARG HH11 1 1 8 5087 1 1 45 ARG HH12 H 7.592 -4.775 14.287 1.00 . A A . 45 ARG HH12 1 1 8 5088 1 1 45 ARG HH21 H 6.522 -1.439 14.079 1.00 . A A . 45 ARG HH21 1 1 8 5089 1 1 45 ARG HH22 H 7.824 -2.552 13.765 1.00 . A A . 45 ARG HH22 1 1 8 5090 1 1 45 ARG N N 2.976 -6.717 11.881 1.00 . A A . 45 ARG N 1 1 8 5091 1 1 45 ARG NE N 4.926 -3.132 15.036 1.00 . A A . 45 ARG NE 1 1 8 5092 1 1 45 ARG NH1 N 6.664 -4.595 14.636 1.00 . A A . 45 ARG NH1 1 1 8 5093 1 1 45 ARG NH2 N 6.892 -2.377 14.106 1.00 . A A . 45 ARG NH2 1 1 8 5094 1 1 45 ARG O O 5.421 -7.114 14.421 1.00 . A A . 45 ARG O 1 1 8 5095 1 1 46 VAL C C 7.810 -8.090 12.241 1.00 . A A . 46 VAL C 1 1 8 5096 1 1 46 VAL CA C 6.471 -8.783 12.480 1.00 . A A . 46 VAL CA 1 1 8 5097 1 1 46 VAL CB C 6.329 -10.006 11.542 1.00 . A A . 46 VAL CB 1 1 8 5098 1 1 46 VAL CG1 C 6.759 -9.665 10.122 1.00 . A A . 46 VAL CG1 1 1 8 5099 1 1 46 VAL CG2 C 7.117 -11.192 12.080 1.00 . A A . 46 VAL CG2 1 1 8 5100 1 1 46 VAL H H 4.954 -7.770 11.417 1.00 . A A . 46 VAL H 1 1 8 5101 1 1 46 VAL HA H 6.440 -9.135 13.501 1.00 . A A . 46 VAL HA 1 1 8 5102 1 1 46 VAL HB H 5.286 -10.284 11.513 1.00 . A A . 46 VAL HB 1 1 8 5103 1 1 46 VAL HG11 H 7.604 -8.993 10.154 1.00 . A A . 46 VAL HG11 1 1 8 5104 1 1 46 VAL HG12 H 7.040 -10.570 9.603 1.00 . A A . 46 VAL HG12 1 1 8 5105 1 1 46 VAL HG13 H 5.941 -9.190 9.600 1.00 . A A . 46 VAL HG13 1 1 8 5106 1 1 46 VAL HG21 H 7.565 -10.928 13.027 1.00 . A A . 46 VAL HG21 1 1 8 5107 1 1 46 VAL HG22 H 6.456 -12.034 12.219 1.00 . A A . 46 VAL HG22 1 1 8 5108 1 1 46 VAL HG23 H 7.894 -11.459 11.378 1.00 . A A . 46 VAL HG23 1 1 8 5109 1 1 46 VAL N N 5.374 -7.848 12.298 1.00 . A A . 46 VAL N 1 1 8 5110 1 1 46 VAL O O 8.847 -8.622 12.679 1.00 . A A . 46 VAL O 1 1 8 5111 1 1 46 VAL OXT O 7.813 -6.997 11.634 1.00 . A A . 46 VAL OXT 1 1 8 5112 2 2 1 ZN ZN ZN -0.340 -0.309 0.059 1.00 . B A . 47 ZN ZN 1 1 9 5113 1 1 1 GLY C C 15.063 17.469 -7.615 1.00 . A A . 1 GLY C 1 1 9 5114 1 1 1 GLY CA C 15.393 18.908 -7.945 1.00 . A A . 1 GLY CA 1 1 9 5115 1 1 1 GLY H1 H 16.723 18.438 -9.481 1.00 . A A . 1 GLY H1 1 1 9 5116 1 1 1 GLY H2 H 16.167 20.039 -9.513 1.00 . A A . 1 GLY H2 1 1 9 5117 1 1 1 GLY H3 H 15.148 18.783 -10.009 1.00 . A A . 1 GLY H3 1 1 9 5118 1 1 1 GLY HA2 H 16.150 19.259 -7.261 1.00 . A A . 1 GLY HA2 1 1 9 5119 1 1 1 GLY HA3 H 14.505 19.510 -7.828 1.00 . A A . 1 GLY HA3 1 1 9 5120 1 1 1 GLY N N 15.894 19.054 -9.331 1.00 . A A . 1 GLY N 1 1 9 5121 1 1 1 GLY O O 15.230 16.578 -8.452 1.00 . A A . 1 GLY O 1 1 9 5122 1 1 2 SER C C 12.778 15.581 -6.409 1.00 . A A . 2 SER C 1 1 9 5123 1 1 2 SER CA C 14.204 15.901 -5.976 1.00 . A A . 2 SER CA 1 1 9 5124 1 1 2 SER CB C 14.332 15.779 -4.456 1.00 . A A . 2 SER CB 1 1 9 5125 1 1 2 SER H H 14.444 17.993 -5.787 1.00 . A A . 2 SER H 1 1 9 5126 1 1 2 SER HA H 14.878 15.199 -6.445 1.00 . A A . 2 SER HA 1 1 9 5127 1 1 2 SER HB2 H 13.359 15.902 -4.004 1.00 . A A . 2 SER HB2 1 1 9 5128 1 1 2 SER HB3 H 14.724 14.804 -4.207 1.00 . A A . 2 SER HB3 1 1 9 5129 1 1 2 SER HG H 15.954 16.882 -4.545 1.00 . A A . 2 SER HG 1 1 9 5130 1 1 2 SER N N 14.578 17.237 -6.405 1.00 . A A . 2 SER N 1 1 9 5131 1 1 2 SER O O 11.823 15.820 -5.670 1.00 . A A . 2 SER O 1 1 9 5132 1 1 2 SER OG O 15.205 16.772 -3.940 1.00 . A A . 2 SER OG 1 1 9 5133 1 1 3 MET C C 10.846 13.426 -7.530 1.00 . A A . 3 MET C 1 1 9 5134 1 1 3 MET CA C 11.337 14.722 -8.154 1.00 . A A . 3 MET CA 1 1 9 5135 1 1 3 MET CB C 11.400 14.578 -9.676 1.00 . A A . 3 MET CB 1 1 9 5136 1 1 3 MET CE C 8.073 15.118 -12.034 1.00 . A A . 3 MET CE 1 1 9 5137 1 1 3 MET CG C 10.062 14.246 -10.314 1.00 . A A . 3 MET CG 1 1 9 5138 1 1 3 MET H H 13.439 14.912 -8.171 1.00 . A A . 3 MET H 1 1 9 5139 1 1 3 MET HA H 10.650 15.516 -7.902 1.00 . A A . 3 MET HA 1 1 9 5140 1 1 3 MET HB2 H 11.758 15.505 -10.100 1.00 . A A . 3 MET HB2 1 1 9 5141 1 1 3 MET HB3 H 12.096 13.790 -9.920 1.00 . A A . 3 MET HB3 1 1 9 5142 1 1 3 MET HE1 H 7.584 14.201 -11.745 1.00 . A A . 3 MET HE1 1 1 9 5143 1 1 3 MET HE2 H 7.329 15.859 -12.285 1.00 . A A . 3 MET HE2 1 1 9 5144 1 1 3 MET HE3 H 8.700 14.934 -12.893 1.00 . A A . 3 MET HE3 1 1 9 5145 1 1 3 MET HG2 H 10.241 13.715 -11.238 1.00 . A A . 3 MET HG2 1 1 9 5146 1 1 3 MET HG3 H 9.506 13.614 -9.637 1.00 . A A . 3 MET HG3 1 1 9 5147 1 1 3 MET N N 12.641 15.070 -7.623 1.00 . A A . 3 MET N 1 1 9 5148 1 1 3 MET O O 11.590 12.443 -7.447 1.00 . A A . 3 MET O 1 1 9 5149 1 1 3 MET SD S 9.078 15.714 -10.674 1.00 . A A . 3 MET SD 1 1 9 5150 1 1 4 ALA C C 8.644 11.238 -7.576 1.00 . A A . 4 ALA C 1 1 9 5151 1 1 4 ALA CA C 8.988 12.254 -6.494 1.00 . A A . 4 ALA CA 1 1 9 5152 1 1 4 ALA CB C 7.748 12.655 -5.711 1.00 . A A . 4 ALA CB 1 1 9 5153 1 1 4 ALA H H 9.061 14.253 -7.178 1.00 . A A . 4 ALA H 1 1 9 5154 1 1 4 ALA HA H 9.699 11.815 -5.810 1.00 . A A . 4 ALA HA 1 1 9 5155 1 1 4 ALA HB1 H 7.386 11.807 -5.150 1.00 . A A . 4 ALA HB1 1 1 9 5156 1 1 4 ALA HB2 H 7.996 13.459 -5.031 1.00 . A A . 4 ALA HB2 1 1 9 5157 1 1 4 ALA HB3 H 6.985 12.987 -6.398 1.00 . A A . 4 ALA HB3 1 1 9 5158 1 1 4 ALA N N 9.597 13.430 -7.089 1.00 . A A . 4 ALA N 1 1 9 5159 1 1 4 ALA O O 7.511 11.187 -8.061 1.00 . A A . 4 ALA O 1 1 9 5160 1 1 5 ALA C C 9.830 8.200 -8.827 1.00 . A A . 5 ALA C 1 1 9 5161 1 1 5 ALA CA C 9.499 9.639 -9.190 1.00 . A A . 5 ALA CA 1 1 9 5162 1 1 5 ALA CB C 10.370 10.101 -10.346 1.00 . A A . 5 ALA CB 1 1 9 5163 1 1 5 ALA H H 10.567 10.707 -7.704 1.00 . A A . 5 ALA H 1 1 9 5164 1 1 5 ALA HA H 8.469 9.689 -9.509 1.00 . A A . 5 ALA HA 1 1 9 5165 1 1 5 ALA HB1 H 11.320 10.446 -9.967 1.00 . A A . 5 ALA HB1 1 1 9 5166 1 1 5 ALA HB2 H 10.531 9.275 -11.026 1.00 . A A . 5 ALA HB2 1 1 9 5167 1 1 5 ALA HB3 H 9.876 10.907 -10.870 1.00 . A A . 5 ALA HB3 1 1 9 5168 1 1 5 ALA N N 9.662 10.538 -8.057 1.00 . A A . 5 ALA N 1 1 9 5169 1 1 5 ALA O O 9.556 7.281 -9.595 1.00 . A A . 5 ALA O 1 1 9 5170 1 1 6 HIS C C 10.324 6.429 -5.816 1.00 . A A . 6 HIS C 1 1 9 5171 1 1 6 HIS CA C 10.826 6.670 -7.228 1.00 . A A . 6 HIS CA 1 1 9 5172 1 1 6 HIS CB C 12.346 6.486 -7.285 1.00 . A A . 6 HIS CB 1 1 9 5173 1 1 6 HIS CD2 C 13.804 7.843 -8.939 1.00 . A A . 6 HIS CD2 1 1 9 5174 1 1 6 HIS CE1 C 13.326 6.745 -10.770 1.00 . A A . 6 HIS CE1 1 1 9 5175 1 1 6 HIS CG C 12.949 6.852 -8.605 1.00 . A A . 6 HIS CG 1 1 9 5176 1 1 6 HIS H H 10.650 8.778 -7.094 1.00 . A A . 6 HIS H 1 1 9 5177 1 1 6 HIS HA H 10.360 5.956 -7.892 1.00 . A A . 6 HIS HA 1 1 9 5178 1 1 6 HIS HB2 H 12.803 7.107 -6.529 1.00 . A A . 6 HIS HB2 1 1 9 5179 1 1 6 HIS HB3 H 12.582 5.451 -7.085 1.00 . A A . 6 HIS HB3 1 1 9 5180 1 1 6 HIS HD1 H 12.064 5.400 -9.866 1.00 . A A . 6 HIS HD1 1 1 9 5181 1 1 6 HIS HD2 H 14.238 8.567 -8.265 1.00 . A A . 6 HIS HD2 1 1 9 5182 1 1 6 HIS HE1 H 13.297 6.431 -11.802 1.00 . A A . 6 HIS HE1 1 1 9 5183 1 1 6 HIS HE2 H 14.403 8.480 -10.845 1.00 . A A . 6 HIS HE2 1 1 9 5184 1 1 6 HIS N N 10.445 8.004 -7.671 1.00 . A A . 6 HIS N 1 1 9 5185 1 1 6 HIS ND1 N 12.669 6.183 -9.776 1.00 . A A . 6 HIS ND1 1 1 9 5186 1 1 6 HIS NE2 N 14.024 7.758 -10.293 1.00 . A A . 6 HIS NE2 1 1 9 5187 1 1 6 HIS O O 10.784 7.073 -4.873 1.00 . A A . 6 HIS O 1 1 9 5188 1 1 7 SER C C 7.879 6.579 -3.981 1.00 . A A . 7 SER C 1 1 9 5189 1 1 7 SER CA C 8.621 5.327 -4.444 1.00 . A A . 7 SER CA 1 1 9 5190 1 1 7 SER CB C 9.610 4.828 -3.382 1.00 . A A . 7 SER CB 1 1 9 5191 1 1 7 SER H H 8.929 5.188 -6.531 1.00 . A A . 7 SER H 1 1 9 5192 1 1 7 SER HA H 7.890 4.552 -4.626 1.00 . A A . 7 SER HA 1 1 9 5193 1 1 7 SER HB2 H 10.212 5.655 -3.035 1.00 . A A . 7 SER HB2 1 1 9 5194 1 1 7 SER HB3 H 9.064 4.404 -2.552 1.00 . A A . 7 SER HB3 1 1 9 5195 1 1 7 SER HG H 10.037 3.446 -4.711 1.00 . A A . 7 SER HG 1 1 9 5196 1 1 7 SER N N 9.300 5.586 -5.708 1.00 . A A . 7 SER N 1 1 9 5197 1 1 7 SER O O 6.790 6.857 -4.478 1.00 . A A . 7 SER O 1 1 9 5198 1 1 7 SER OG O 10.466 3.835 -3.927 1.00 . A A . 7 SER OG 1 1 9 5199 1 1 8 ALA C C 6.506 8.604 -2.329 1.00 . A A . 8 ALA C 1 1 9 5200 1 1 8 ALA CA C 7.991 8.674 -2.694 1.00 . A A . 8 ALA CA 1 1 9 5201 1 1 8 ALA CB C 8.242 9.727 -3.761 1.00 . A A . 8 ALA CB 1 1 9 5202 1 1 8 ALA H H 9.437 7.134 -2.851 1.00 . A A . 8 ALA H 1 1 9 5203 1 1 8 ALA HA H 8.542 8.966 -1.812 1.00 . A A . 8 ALA HA 1 1 9 5204 1 1 8 ALA HB1 H 7.918 9.352 -4.721 1.00 . A A . 8 ALA HB1 1 1 9 5205 1 1 8 ALA HB2 H 7.689 10.621 -3.518 1.00 . A A . 8 ALA HB2 1 1 9 5206 1 1 8 ALA HB3 H 9.296 9.955 -3.800 1.00 . A A . 8 ALA HB3 1 1 9 5207 1 1 8 ALA N N 8.526 7.382 -3.134 1.00 . A A . 8 ALA N 1 1 9 5208 1 1 8 ALA O O 6.142 8.053 -1.293 1.00 . A A . 8 ALA O 1 1 9 5209 1 1 9 ASP C C 3.474 8.429 -4.057 1.00 . A A . 9 ASP C 1 1 9 5210 1 1 9 ASP CA C 4.212 9.141 -2.936 1.00 . A A . 9 ASP CA 1 1 9 5211 1 1 9 ASP CB C 3.689 10.569 -2.764 1.00 . A A . 9 ASP CB 1 1 9 5212 1 1 9 ASP CG C 2.501 10.654 -1.828 1.00 . A A . 9 ASP CG 1 1 9 5213 1 1 9 ASP H H 5.987 9.560 -4.019 1.00 . A A . 9 ASP H 1 1 9 5214 1 1 9 ASP HA H 4.053 8.590 -2.028 1.00 . A A . 9 ASP HA 1 1 9 5215 1 1 9 ASP HB2 H 4.479 11.189 -2.364 1.00 . A A . 9 ASP HB2 1 1 9 5216 1 1 9 ASP HB3 H 3.393 10.953 -3.729 1.00 . A A . 9 ASP HB3 1 1 9 5217 1 1 9 ASP N N 5.647 9.149 -3.188 1.00 . A A . 9 ASP N 1 1 9 5218 1 1 9 ASP O O 2.250 8.497 -4.171 1.00 . A A . 9 ASP O 1 1 9 5219 1 1 9 ASP OD1 O 2.535 10.023 -0.752 1.00 . A A . 9 ASP OD1 1 1 9 5220 1 1 9 ASP OD2 O 1.538 11.385 -2.152 1.00 . A A . 9 ASP OD2 1 1 9 5221 1 1 10 LEU C C 3.543 5.341 -5.237 1.00 . A A . 10 LEU C 1 1 9 5222 1 1 10 LEU CA C 3.664 6.743 -5.801 1.00 . A A . 10 LEU CA 1 1 9 5223 1 1 10 LEU CB C 4.551 6.709 -7.049 1.00 . A A . 10 LEU CB 1 1 9 5224 1 1 10 LEU CD1 C 6.279 8.151 -8.135 1.00 . A A . 10 LEU CD1 1 1 9 5225 1 1 10 LEU CD2 C 3.904 8.277 -8.897 1.00 . A A . 10 LEU CD2 1 1 9 5226 1 1 10 LEU CG C 4.826 8.062 -7.705 1.00 . A A . 10 LEU CG 1 1 9 5227 1 1 10 LEU H H 5.167 7.528 -4.531 1.00 . A A . 10 LEU H 1 1 9 5228 1 1 10 LEU HA H 2.684 7.103 -6.064 1.00 . A A . 10 LEU HA 1 1 9 5229 1 1 10 LEU HB2 H 5.500 6.271 -6.774 1.00 . A A . 10 LEU HB2 1 1 9 5230 1 1 10 LEU HB3 H 4.079 6.069 -7.780 1.00 . A A . 10 LEU HB3 1 1 9 5231 1 1 10 LEU HD11 H 6.364 7.890 -9.179 1.00 . A A . 10 LEU HD11 1 1 9 5232 1 1 10 LEU HD12 H 6.635 9.160 -7.988 1.00 . A A . 10 LEU HD12 1 1 9 5233 1 1 10 LEU HD13 H 6.873 7.470 -7.545 1.00 . A A . 10 LEU HD13 1 1 9 5234 1 1 10 LEU HD21 H 3.275 7.410 -9.025 1.00 . A A . 10 LEU HD21 1 1 9 5235 1 1 10 LEU HD22 H 3.288 9.147 -8.723 1.00 . A A . 10 LEU HD22 1 1 9 5236 1 1 10 LEU HD23 H 4.495 8.427 -9.788 1.00 . A A . 10 LEU HD23 1 1 9 5237 1 1 10 LEU HG H 4.639 8.849 -6.989 1.00 . A A . 10 LEU HG 1 1 9 5238 1 1 10 LEU N N 4.223 7.624 -4.780 1.00 . A A . 10 LEU N 1 1 9 5239 1 1 10 LEU O O 2.535 4.658 -5.423 1.00 . A A . 10 LEU O 1 1 9 5240 1 1 11 LYS C C 4.534 3.807 -2.381 1.00 . A A . 11 LYS C 1 1 9 5241 1 1 11 LYS CA C 4.587 3.646 -3.885 1.00 . A A . 11 LYS CA 1 1 9 5242 1 1 11 LYS CB C 5.831 2.868 -4.283 1.00 . A A . 11 LYS CB 1 1 9 5243 1 1 11 LYS CD C 4.492 0.757 -4.527 1.00 . A A . 11 LYS CD 1 1 9 5244 1 1 11 LYS CE C 5.091 -0.067 -3.398 1.00 . A A . 11 LYS CE 1 1 9 5245 1 1 11 LYS CG C 5.523 1.680 -5.167 1.00 . A A . 11 LYS CG 1 1 9 5246 1 1 11 LYS H H 5.331 5.524 -4.389 1.00 . A A . 11 LYS H 1 1 9 5247 1 1 11 LYS HA H 3.714 3.104 -4.210 1.00 . A A . 11 LYS HA 1 1 9 5248 1 1 11 LYS HB2 H 6.501 3.526 -4.816 1.00 . A A . 11 LYS HB2 1 1 9 5249 1 1 11 LYS HB3 H 6.321 2.510 -3.391 1.00 . A A . 11 LYS HB3 1 1 9 5250 1 1 11 LYS HD2 H 3.688 1.359 -4.128 1.00 . A A . 11 LYS HD2 1 1 9 5251 1 1 11 LYS HD3 H 4.103 0.090 -5.281 1.00 . A A . 11 LYS HD3 1 1 9 5252 1 1 11 LYS HE2 H 5.009 -1.113 -3.653 1.00 . A A . 11 LYS HE2 1 1 9 5253 1 1 11 LYS HE3 H 6.135 0.194 -3.294 1.00 . A A . 11 LYS HE3 1 1 9 5254 1 1 11 LYS HG2 H 5.135 2.037 -6.109 1.00 . A A . 11 LYS HG2 1 1 9 5255 1 1 11 LYS HG3 H 6.432 1.135 -5.337 1.00 . A A . 11 LYS HG3 1 1 9 5256 1 1 11 LYS HZ1 H 4.373 -0.712 -1.545 1.00 . A A . 11 LYS HZ1 1 1 9 5257 1 1 11 LYS HZ2 H 3.424 0.500 -2.252 1.00 . A A . 11 LYS HZ2 1 1 9 5258 1 1 11 LYS HZ3 H 4.915 0.892 -1.544 1.00 . A A . 11 LYS HZ3 1 1 9 5259 1 1 11 LYS N N 4.573 4.930 -4.521 1.00 . A A . 11 LYS N 1 1 9 5260 1 1 11 LYS NZ N 4.402 0.171 -2.099 1.00 . A A . 11 LYS NZ 1 1 9 5261 1 1 11 LYS O O 5.355 4.501 -1.782 1.00 . A A . 11 LYS O 1 1 9 5262 1 1 12 CYS C C 4.391 2.522 0.404 1.00 . A A . 12 CYS C 1 1 9 5263 1 1 12 CYS CA C 3.287 3.253 -0.373 1.00 . A A . 12 CYS CA 1 1 9 5264 1 1 12 CYS CB C 1.932 2.608 -0.136 1.00 . A A . 12 CYS CB 1 1 9 5265 1 1 12 CYS H H 2.887 2.713 -2.359 1.00 . A A . 12 CYS H 1 1 9 5266 1 1 12 CYS HA H 3.253 4.287 -0.068 1.00 . A A . 12 CYS HA 1 1 9 5267 1 1 12 CYS HB2 H 1.909 2.166 0.848 1.00 . A A . 12 CYS HB2 1 1 9 5268 1 1 12 CYS HB3 H 1.163 3.362 -0.206 1.00 . A A . 12 CYS HB3 1 1 9 5269 1 1 12 CYS N N 3.528 3.196 -1.798 1.00 . A A . 12 CYS N 1 1 9 5270 1 1 12 CYS O O 5.276 1.908 -0.197 1.00 . A A . 12 CYS O 1 1 9 5271 1 1 12 CYS SG S 1.552 1.311 -1.353 1.00 . A A . 12 CYS SG 1 1 9 5272 1 1 13 PRO C C 5.519 0.478 2.413 1.00 . A A . 13 PRO C 1 1 9 5273 1 1 13 PRO CA C 5.406 1.994 2.602 1.00 . A A . 13 PRO CA 1 1 9 5274 1 1 13 PRO CB C 4.926 2.314 4.028 1.00 . A A . 13 PRO CB 1 1 9 5275 1 1 13 PRO CD C 3.422 3.394 2.540 1.00 . A A . 13 PRO CD 1 1 9 5276 1 1 13 PRO CG C 3.506 2.743 3.882 1.00 . A A . 13 PRO CG 1 1 9 5277 1 1 13 PRO HA H 6.375 2.442 2.442 1.00 . A A . 13 PRO HA 1 1 9 5278 1 1 13 PRO HB2 H 5.011 1.431 4.645 1.00 . A A . 13 PRO HB2 1 1 9 5279 1 1 13 PRO HB3 H 5.530 3.104 4.442 1.00 . A A . 13 PRO HB3 1 1 9 5280 1 1 13 PRO HD2 H 2.422 3.306 2.137 1.00 . A A . 13 PRO HD2 1 1 9 5281 1 1 13 PRO HD3 H 3.719 4.431 2.602 1.00 . A A . 13 PRO HD3 1 1 9 5282 1 1 13 PRO HG2 H 2.854 1.882 3.925 1.00 . A A . 13 PRO HG2 1 1 9 5283 1 1 13 PRO HG3 H 3.251 3.449 4.659 1.00 . A A . 13 PRO HG3 1 1 9 5284 1 1 13 PRO N N 4.384 2.616 1.745 1.00 . A A . 13 PRO N 1 1 9 5285 1 1 13 PRO O O 6.583 -0.105 2.628 1.00 . A A . 13 PRO O 1 1 9 5286 1 1 14 THR C C 4.937 -2.131 0.695 1.00 . A A . 14 THR C 1 1 9 5287 1 1 14 THR CA C 4.333 -1.616 2.006 1.00 . A A . 14 THR CA 1 1 9 5288 1 1 14 THR CB C 2.880 -2.101 2.125 1.00 . A A . 14 THR CB 1 1 9 5289 1 1 14 THR CG2 C 2.828 -3.590 2.428 1.00 . A A . 14 THR CG2 1 1 9 5290 1 1 14 THR H H 3.564 0.354 2.038 1.00 . A A . 14 THR H 1 1 9 5291 1 1 14 THR HA H 4.893 -2.032 2.828 1.00 . A A . 14 THR HA 1 1 9 5292 1 1 14 THR HB H 2.376 -1.920 1.186 1.00 . A A . 14 THR HB 1 1 9 5293 1 1 14 THR HG1 H 1.412 -0.954 2.798 1.00 . A A . 14 THR HG1 1 1 9 5294 1 1 14 THR HG21 H 3.832 -3.986 2.469 1.00 . A A . 14 THR HG21 1 1 9 5295 1 1 14 THR HG22 H 2.273 -4.096 1.650 1.00 . A A . 14 THR HG22 1 1 9 5296 1 1 14 THR HG23 H 2.340 -3.748 3.379 1.00 . A A . 14 THR HG23 1 1 9 5297 1 1 14 THR N N 4.395 -0.162 2.112 1.00 . A A . 14 THR N 1 1 9 5298 1 1 14 THR O O 4.419 -1.866 -0.388 1.00 . A A . 14 THR O 1 1 9 5299 1 1 14 THR OG1 O 2.216 -1.372 3.163 1.00 . A A . 14 THR OG1 1 1 9 5300 1 1 15 PRO C C 5.954 -4.474 -1.127 1.00 . A A . 15 PRO C 1 1 9 5301 1 1 15 PRO CA C 6.762 -3.414 -0.387 1.00 . A A . 15 PRO CA 1 1 9 5302 1 1 15 PRO CB C 8.024 -4.046 0.213 1.00 . A A . 15 PRO CB 1 1 9 5303 1 1 15 PRO CD C 6.772 -3.177 2.031 1.00 . A A . 15 PRO CD 1 1 9 5304 1 1 15 PRO CG C 8.170 -3.410 1.546 1.00 . A A . 15 PRO CG 1 1 9 5305 1 1 15 PRO HA H 7.042 -2.630 -1.074 1.00 . A A . 15 PRO HA 1 1 9 5306 1 1 15 PRO HB2 H 7.886 -5.115 0.298 1.00 . A A . 15 PRO HB2 1 1 9 5307 1 1 15 PRO HB3 H 8.870 -3.836 -0.419 1.00 . A A . 15 PRO HB3 1 1 9 5308 1 1 15 PRO HD2 H 6.379 -4.066 2.502 1.00 . A A . 15 PRO HD2 1 1 9 5309 1 1 15 PRO HD3 H 6.739 -2.337 2.709 1.00 . A A . 15 PRO HD3 1 1 9 5310 1 1 15 PRO HG2 H 8.696 -4.074 2.212 1.00 . A A . 15 PRO HG2 1 1 9 5311 1 1 15 PRO HG3 H 8.697 -2.471 1.451 1.00 . A A . 15 PRO HG3 1 1 9 5312 1 1 15 PRO N N 6.055 -2.873 0.786 1.00 . A A . 15 PRO N 1 1 9 5313 1 1 15 PRO O O 6.092 -4.639 -2.341 1.00 . A A . 15 PRO O 1 1 9 5314 1 1 16 GLY C C 3.032 -5.664 -1.606 1.00 . A A . 16 GLY C 1 1 9 5315 1 1 16 GLY CA C 4.293 -6.227 -0.987 1.00 . A A . 16 GLY CA 1 1 9 5316 1 1 16 GLY H H 5.049 -5.019 0.568 1.00 . A A . 16 GLY H 1 1 9 5317 1 1 16 GLY HA2 H 4.866 -6.727 -1.748 1.00 . A A . 16 GLY HA2 1 1 9 5318 1 1 16 GLY HA3 H 4.022 -6.942 -0.226 1.00 . A A . 16 GLY HA3 1 1 9 5319 1 1 16 GLY N N 5.115 -5.193 -0.389 1.00 . A A . 16 GLY N 1 1 9 5320 1 1 16 GLY O O 2.177 -6.405 -2.088 1.00 . A A . 16 GLY O 1 1 9 5321 1 1 17 CYS C C 2.147 -2.971 -3.434 1.00 . A A . 17 CYS C 1 1 9 5322 1 1 17 CYS CA C 1.771 -3.665 -2.126 1.00 . A A . 17 CYS CA 1 1 9 5323 1 1 17 CYS CB C 1.273 -2.664 -1.096 1.00 . A A . 17 CYS CB 1 1 9 5324 1 1 17 CYS H H 3.633 -3.819 -1.164 1.00 . A A . 17 CYS H 1 1 9 5325 1 1 17 CYS HA H 0.999 -4.396 -2.319 1.00 . A A . 17 CYS HA 1 1 9 5326 1 1 17 CYS HB2 H 1.183 -3.161 -0.145 1.00 . A A . 17 CYS HB2 1 1 9 5327 1 1 17 CYS HB3 H 2.002 -1.870 -1.005 1.00 . A A . 17 CYS HB3 1 1 9 5328 1 1 17 CYS N N 2.918 -4.351 -1.577 1.00 . A A . 17 CYS N 1 1 9 5329 1 1 17 CYS O O 3.317 -2.944 -3.818 1.00 . A A . 17 CYS O 1 1 9 5330 1 1 17 CYS SG S -0.330 -1.896 -1.460 1.00 . A A . 17 CYS SG 1 1 9 5331 1 1 18 ASP C C 0.914 -0.252 -5.293 1.00 . A A . 18 ASP C 1 1 9 5332 1 1 18 ASP CA C 1.400 -1.699 -5.364 1.00 . A A . 18 ASP CA 1 1 9 5333 1 1 18 ASP CB C 0.718 -2.436 -6.526 1.00 . A A . 18 ASP CB 1 1 9 5334 1 1 18 ASP CG C -0.693 -1.948 -6.798 1.00 . A A . 18 ASP CG 1 1 9 5335 1 1 18 ASP H H 0.255 -2.407 -3.724 1.00 . A A . 18 ASP H 1 1 9 5336 1 1 18 ASP HA H 2.466 -1.694 -5.536 1.00 . A A . 18 ASP HA 1 1 9 5337 1 1 18 ASP HB2 H 1.304 -2.299 -7.422 1.00 . A A . 18 ASP HB2 1 1 9 5338 1 1 18 ASP HB3 H 0.673 -3.492 -6.292 1.00 . A A . 18 ASP HB3 1 1 9 5339 1 1 18 ASP N N 1.160 -2.393 -4.103 1.00 . A A . 18 ASP N 1 1 9 5340 1 1 18 ASP O O 1.347 0.595 -6.075 1.00 . A A . 18 ASP O 1 1 9 5341 1 1 18 ASP OD1 O -1.533 -2.007 -5.880 1.00 . A A . 18 ASP OD1 1 1 9 5342 1 1 18 ASP OD2 O -0.972 -1.510 -7.933 1.00 . A A . 18 ASP OD2 1 1 9 5343 1 1 19 GLY C C -1.815 1.626 -4.627 1.00 . A A . 19 GLY C 1 1 9 5344 1 1 19 GLY CA C -0.400 1.407 -4.128 1.00 . A A . 19 GLY CA 1 1 9 5345 1 1 19 GLY H H -0.208 -0.658 -3.683 1.00 . A A . 19 GLY H 1 1 9 5346 1 1 19 GLY HA2 H -0.364 1.643 -3.074 1.00 . A A . 19 GLY HA2 1 1 9 5347 1 1 19 GLY HA3 H 0.263 2.076 -4.656 1.00 . A A . 19 GLY HA3 1 1 9 5348 1 1 19 GLY N N 0.065 0.043 -4.314 1.00 . A A . 19 GLY N 1 1 9 5349 1 1 19 GLY O O -2.384 2.705 -4.444 1.00 . A A . 19 GLY O 1 1 9 5350 1 1 20 SER C C -4.695 -0.169 -4.901 1.00 . A A . 20 SER C 1 1 9 5351 1 1 20 SER CA C -3.755 0.698 -5.732 1.00 . A A . 20 SER CA 1 1 9 5352 1 1 20 SER CB C -3.802 0.282 -7.202 1.00 . A A . 20 SER CB 1 1 9 5353 1 1 20 SER H H -1.906 -0.242 -5.335 1.00 . A A . 20 SER H 1 1 9 5354 1 1 20 SER HA H -4.070 1.729 -5.647 1.00 . A A . 20 SER HA 1 1 9 5355 1 1 20 SER HB2 H -3.992 -0.778 -7.268 1.00 . A A . 20 SER HB2 1 1 9 5356 1 1 20 SER HB3 H -4.592 0.822 -7.702 1.00 . A A . 20 SER HB3 1 1 9 5357 1 1 20 SER HG H -1.982 -0.203 -7.772 1.00 . A A . 20 SER HG 1 1 9 5358 1 1 20 SER N N -2.396 0.605 -5.232 1.00 . A A . 20 SER N 1 1 9 5359 1 1 20 SER O O -4.297 -1.215 -4.384 1.00 . A A . 20 SER O 1 1 9 5360 1 1 20 SER OG O -2.572 0.570 -7.850 1.00 . A A . 20 SER OG 1 1 9 5361 1 1 21 GLY C C -6.865 -0.068 -2.503 1.00 . A A . 21 GLY C 1 1 9 5362 1 1 21 GLY CA C -6.902 -0.441 -3.966 1.00 . A A . 21 GLY CA 1 1 9 5363 1 1 21 GLY H H -6.176 1.151 -5.154 1.00 . A A . 21 GLY H 1 1 9 5364 1 1 21 GLY HA2 H -7.889 -0.241 -4.353 1.00 . A A . 21 GLY HA2 1 1 9 5365 1 1 21 GLY HA3 H -6.696 -1.496 -4.060 1.00 . A A . 21 GLY HA3 1 1 9 5366 1 1 21 GLY N N -5.928 0.294 -4.744 1.00 . A A . 21 GLY N 1 1 9 5367 1 1 21 GLY O O -6.130 0.827 -2.108 1.00 . A A . 21 GLY O 1 1 9 5368 1 1 22 HIS C C -8.123 -1.900 0.392 1.00 . A A . 22 HIS C 1 1 9 5369 1 1 22 HIS CA C -7.707 -0.591 -0.263 1.00 . A A . 22 HIS CA 1 1 9 5370 1 1 22 HIS CB C -8.707 0.511 0.151 1.00 . A A . 22 HIS CB 1 1 9 5371 1 1 22 HIS CD2 C -7.440 2.723 -0.437 1.00 . A A . 22 HIS CD2 1 1 9 5372 1 1 22 HIS CE1 C -7.704 3.750 1.476 1.00 . A A . 22 HIS CE1 1 1 9 5373 1 1 22 HIS CG C -8.121 1.882 0.378 1.00 . A A . 22 HIS CG 1 1 9 5374 1 1 22 HIS H H -8.196 -1.485 -2.118 1.00 . A A . 22 HIS H 1 1 9 5375 1 1 22 HIS HA H -6.717 -0.326 0.081 1.00 . A A . 22 HIS HA 1 1 9 5376 1 1 22 HIS HB2 H -9.454 0.604 -0.622 1.00 . A A . 22 HIS HB2 1 1 9 5377 1 1 22 HIS HB3 H -9.192 0.205 1.066 1.00 . A A . 22 HIS HB3 1 1 9 5378 1 1 22 HIS HD1 H -8.717 2.215 2.384 1.00 . A A . 22 HIS HD1 1 1 9 5379 1 1 22 HIS HD2 H -7.144 2.523 -1.457 1.00 . A A . 22 HIS HD2 1 1 9 5380 1 1 22 HIS HE1 H -7.672 4.495 2.257 1.00 . A A . 22 HIS HE1 1 1 9 5381 1 1 22 HIS HE2 H -6.950 4.748 -0.141 1.00 . A A . 22 HIS HE2 1 1 9 5382 1 1 22 HIS N N -7.651 -0.771 -1.714 1.00 . A A . 22 HIS N 1 1 9 5383 1 1 22 HIS ND1 N -8.266 2.559 1.571 1.00 . A A . 22 HIS ND1 1 1 9 5384 1 1 22 HIS NE2 N -7.196 3.879 0.268 1.00 . A A . 22 HIS NE2 1 1 9 5385 1 1 22 HIS O O -8.805 -2.715 -0.229 1.00 . A A . 22 HIS O 1 1 9 5386 1 1 23 ILE C C -9.828 -3.110 2.602 1.00 . A A . 23 ILE C 1 1 9 5387 1 1 23 ILE CA C -8.309 -3.187 2.441 1.00 . A A . 23 ILE CA 1 1 9 5388 1 1 23 ILE CB C -7.599 -3.271 3.825 1.00 . A A . 23 ILE CB 1 1 9 5389 1 1 23 ILE CD1 C -7.461 -5.820 3.632 1.00 . A A . 23 ILE CD1 1 1 9 5390 1 1 23 ILE CG1 C -6.718 -4.525 3.896 1.00 . A A . 23 ILE CG1 1 1 9 5391 1 1 23 ILE CG2 C -8.588 -3.252 4.992 1.00 . A A . 23 ILE CG2 1 1 9 5392 1 1 23 ILE H H -7.385 -1.304 2.150 1.00 . A A . 23 ILE H 1 1 9 5393 1 1 23 ILE HA H -8.064 -4.078 1.880 1.00 . A A . 23 ILE HA 1 1 9 5394 1 1 23 ILE HB H -6.966 -2.401 3.920 1.00 . A A . 23 ILE HB 1 1 9 5395 1 1 23 ILE HD11 H -7.133 -6.574 4.333 1.00 . A A . 23 ILE HD11 1 1 9 5396 1 1 23 ILE HD12 H -8.522 -5.658 3.751 1.00 . A A . 23 ILE HD12 1 1 9 5397 1 1 23 ILE HD13 H -7.259 -6.155 2.626 1.00 . A A . 23 ILE HD13 1 1 9 5398 1 1 23 ILE HG12 H -5.929 -4.444 3.161 1.00 . A A . 23 ILE HG12 1 1 9 5399 1 1 23 ILE HG13 H -6.276 -4.589 4.881 1.00 . A A . 23 ILE HG13 1 1 9 5400 1 1 23 ILE HG21 H -9.521 -3.694 4.679 1.00 . A A . 23 ILE HG21 1 1 9 5401 1 1 23 ILE HG22 H -8.180 -3.818 5.817 1.00 . A A . 23 ILE HG22 1 1 9 5402 1 1 23 ILE HG23 H -8.757 -2.232 5.304 1.00 . A A . 23 ILE HG23 1 1 9 5403 1 1 23 ILE N N -7.839 -2.037 1.678 1.00 . A A . 23 ILE N 1 1 9 5404 1 1 23 ILE O O -10.517 -4.133 2.654 1.00 . A A . 23 ILE O 1 1 9 5405 1 1 24 THR C C -12.517 -1.901 1.452 1.00 . A A . 24 THR C 1 1 9 5406 1 1 24 THR CA C -11.765 -1.636 2.761 1.00 . A A . 24 THR CA 1 1 9 5407 1 1 24 THR CB C -12.033 -0.191 3.250 1.00 . A A . 24 THR CB 1 1 9 5408 1 1 24 THR CG2 C -12.028 0.803 2.098 1.00 . A A . 24 THR CG2 1 1 9 5409 1 1 24 THR H H -9.725 -1.113 2.569 1.00 . A A . 24 THR H 1 1 9 5410 1 1 24 THR HA H -12.139 -2.313 3.509 1.00 . A A . 24 THR HA 1 1 9 5411 1 1 24 THR HB H -11.247 0.083 3.941 1.00 . A A . 24 THR HB 1 1 9 5412 1 1 24 THR HG1 H -13.415 -0.938 4.454 1.00 . A A . 24 THR HG1 1 1 9 5413 1 1 24 THR HG21 H -11.316 1.588 2.303 1.00 . A A . 24 THR HG21 1 1 9 5414 1 1 24 THR HG22 H -13.014 1.231 1.988 1.00 . A A . 24 THR HG22 1 1 9 5415 1 1 24 THR HG23 H -11.753 0.296 1.186 1.00 . A A . 24 THR HG23 1 1 9 5416 1 1 24 THR N N -10.338 -1.880 2.624 1.00 . A A . 24 THR N 1 1 9 5417 1 1 24 THR O O -13.739 -2.051 1.453 1.00 . A A . 24 THR O 1 1 9 5418 1 1 24 THR OG1 O -13.291 -0.124 3.935 1.00 . A A . 24 THR OG1 1 1 9 5419 1 1 25 GLY C C -13.373 -1.268 -1.390 1.00 . A A . 25 GLY C 1 1 9 5420 1 1 25 GLY CA C -12.382 -2.327 -0.934 1.00 . A A . 25 GLY CA 1 1 9 5421 1 1 25 GLY H H -10.799 -1.958 0.422 1.00 . A A . 25 GLY H 1 1 9 5422 1 1 25 GLY HA2 H -11.601 -2.412 -1.676 1.00 . A A . 25 GLY HA2 1 1 9 5423 1 1 25 GLY HA3 H -12.896 -3.273 -0.859 1.00 . A A . 25 GLY HA3 1 1 9 5424 1 1 25 GLY N N -11.775 -2.020 0.351 1.00 . A A . 25 GLY N 1 1 9 5425 1 1 25 GLY O O -14.488 -1.589 -1.800 1.00 . A A . 25 GLY O 1 1 9 5426 1 1 26 ASN C C -13.123 2.241 -2.303 1.00 . A A . 26 ASN C 1 1 9 5427 1 1 26 ASN CA C -13.873 1.097 -1.630 1.00 . A A . 26 ASN CA 1 1 9 5428 1 1 26 ASN CB C -14.582 1.621 -0.383 1.00 . A A . 26 ASN CB 1 1 9 5429 1 1 26 ASN CG C -15.885 0.911 -0.131 1.00 . A A . 26 ASN CG 1 1 9 5430 1 1 26 ASN H H -12.107 0.193 -0.899 1.00 . A A . 26 ASN H 1 1 9 5431 1 1 26 ASN HA H -14.613 0.715 -2.316 1.00 . A A . 26 ASN HA 1 1 9 5432 1 1 26 ASN HB2 H -13.944 1.474 0.475 1.00 . A A . 26 ASN HB2 1 1 9 5433 1 1 26 ASN HB3 H -14.786 2.671 -0.497 1.00 . A A . 26 ASN HB3 1 1 9 5434 1 1 26 ASN HD21 H -15.131 0.088 1.502 1.00 . A A . 26 ASN HD21 1 1 9 5435 1 1 26 ASN HD22 H -16.761 -0.325 1.127 1.00 . A A . 26 ASN HD22 1 1 9 5436 1 1 26 ASN N N -12.986 -0.003 -1.274 1.00 . A A . 26 ASN N 1 1 9 5437 1 1 26 ASN ND2 N -15.932 0.150 0.940 1.00 . A A . 26 ASN ND2 1 1 9 5438 1 1 26 ASN O O -13.700 3.298 -2.554 1.00 . A A . 26 ASN O 1 1 9 5439 1 1 26 ASN OD1 O -16.842 1.040 -0.896 1.00 . A A . 26 ASN OD1 1 1 9 5440 1 1 27 TYR C C -10.230 2.617 -4.316 1.00 . A A . 27 TYR C 1 1 9 5441 1 1 27 TYR CA C -11.031 3.127 -3.129 1.00 . A A . 27 TYR CA 1 1 9 5442 1 1 27 TYR CB C -10.085 3.720 -2.088 1.00 . A A . 27 TYR CB 1 1 9 5443 1 1 27 TYR CD1 C -11.343 3.829 0.109 1.00 . A A . 27 TYR CD1 1 1 9 5444 1 1 27 TYR CD2 C -10.882 5.870 -1.035 1.00 . A A . 27 TYR CD2 1 1 9 5445 1 1 27 TYR CE1 C -11.987 4.533 1.110 1.00 . A A . 27 TYR CE1 1 1 9 5446 1 1 27 TYR CE2 C -11.520 6.580 -0.037 1.00 . A A . 27 TYR CE2 1 1 9 5447 1 1 27 TYR CG C -10.780 4.487 -0.982 1.00 . A A . 27 TYR CG 1 1 9 5448 1 1 27 TYR CZ C -12.072 5.908 1.031 1.00 . A A . 27 TYR CZ 1 1 9 5449 1 1 27 TYR H H -11.398 1.218 -2.314 1.00 . A A . 27 TYR H 1 1 9 5450 1 1 27 TYR HA H -11.703 3.899 -3.471 1.00 . A A . 27 TYR HA 1 1 9 5451 1 1 27 TYR HB2 H -9.518 2.924 -1.635 1.00 . A A . 27 TYR HB2 1 1 9 5452 1 1 27 TYR HB3 H -9.407 4.391 -2.580 1.00 . A A . 27 TYR HB3 1 1 9 5453 1 1 27 TYR HD1 H -11.275 2.748 0.169 1.00 . A A . 27 TYR HD1 1 1 9 5454 1 1 27 TYR HD2 H -10.448 6.395 -1.874 1.00 . A A . 27 TYR HD2 1 1 9 5455 1 1 27 TYR HE1 H -12.417 4.005 1.949 1.00 . A A . 27 TYR HE1 1 1 9 5456 1 1 27 TYR HE2 H -11.586 7.656 -0.100 1.00 . A A . 27 TYR HE2 1 1 9 5457 1 1 27 TYR HH H -13.498 6.114 2.320 1.00 . A A . 27 TYR HH 1 1 9 5458 1 1 27 TYR N N -11.830 2.065 -2.545 1.00 . A A . 27 TYR N 1 1 9 5459 1 1 27 TYR O O -9.923 1.428 -4.412 1.00 . A A . 27 TYR O 1 1 9 5460 1 1 27 TYR OH O -12.719 6.615 2.021 1.00 . A A . 27 TYR OH 1 1 9 5461 1 1 28 ALA C C -7.647 3.019 -6.076 1.00 . A A . 28 ALA C 1 1 9 5462 1 1 28 ALA CA C -9.128 3.176 -6.396 1.00 . A A . 28 ALA CA 1 1 9 5463 1 1 28 ALA CB C -9.327 4.224 -7.479 1.00 . A A . 28 ALA CB 1 1 9 5464 1 1 28 ALA H H -10.164 4.459 -5.070 1.00 . A A . 28 ALA H 1 1 9 5465 1 1 28 ALA HA H -9.506 2.235 -6.769 1.00 . A A . 28 ALA HA 1 1 9 5466 1 1 28 ALA HB1 H -8.632 5.035 -7.325 1.00 . A A . 28 ALA HB1 1 1 9 5467 1 1 28 ALA HB2 H -9.151 3.780 -8.447 1.00 . A A . 28 ALA HB2 1 1 9 5468 1 1 28 ALA HB3 H -10.338 4.603 -7.434 1.00 . A A . 28 ALA HB3 1 1 9 5469 1 1 28 ALA N N -9.888 3.524 -5.210 1.00 . A A . 28 ALA N 1 1 9 5470 1 1 28 ALA O O -6.975 2.144 -6.629 1.00 . A A . 28 ALA O 1 1 9 5471 1 1 29 SER C C -5.417 4.541 -3.554 1.00 . A A . 29 SER C 1 1 9 5472 1 1 29 SER CA C -5.707 3.851 -4.886 1.00 . A A . 29 SER CA 1 1 9 5473 1 1 29 SER CB C -4.905 4.525 -6.005 1.00 . A A . 29 SER CB 1 1 9 5474 1 1 29 SER H H -7.701 4.570 -4.804 1.00 . A A . 29 SER H 1 1 9 5475 1 1 29 SER HA H -5.403 2.819 -4.815 1.00 . A A . 29 SER HA 1 1 9 5476 1 1 29 SER HB2 H -4.124 5.132 -5.571 1.00 . A A . 29 SER HB2 1 1 9 5477 1 1 29 SER HB3 H -4.465 3.767 -6.635 1.00 . A A . 29 SER HB3 1 1 9 5478 1 1 29 SER HG H -5.688 5.067 -7.729 1.00 . A A . 29 SER HG 1 1 9 5479 1 1 29 SER N N -7.126 3.877 -5.207 1.00 . A A . 29 SER N 1 1 9 5480 1 1 29 SER O O -6.313 5.095 -2.918 1.00 . A A . 29 SER O 1 1 9 5481 1 1 29 SER OG O -5.739 5.355 -6.805 1.00 . A A . 29 SER OG 1 1 9 5482 1 1 30 HIS C C -2.218 5.398 -1.997 1.00 . A A . 30 HIS C 1 1 9 5483 1 1 30 HIS CA C -3.710 5.080 -1.894 1.00 . A A . 30 HIS CA 1 1 9 5484 1 1 30 HIS CB C -3.965 4.132 -0.718 1.00 . A A . 30 HIS CB 1 1 9 5485 1 1 30 HIS CD2 C -2.037 2.430 -0.428 1.00 . A A . 30 HIS CD2 1 1 9 5486 1 1 30 HIS CE1 C -2.888 0.740 -1.479 1.00 . A A . 30 HIS CE1 1 1 9 5487 1 1 30 HIS CG C -3.267 2.813 -0.851 1.00 . A A . 30 HIS CG 1 1 9 5488 1 1 30 HIS H H -3.504 3.985 -3.679 1.00 . A A . 30 HIS H 1 1 9 5489 1 1 30 HIS HA H -4.261 5.996 -1.744 1.00 . A A . 30 HIS HA 1 1 9 5490 1 1 30 HIS HB2 H -3.619 4.600 0.187 1.00 . A A . 30 HIS HB2 1 1 9 5491 1 1 30 HIS HB3 H -5.026 3.942 -0.637 1.00 . A A . 30 HIS HB3 1 1 9 5492 1 1 30 HIS HD1 H -4.696 1.663 -1.917 1.00 . A A . 30 HIS HD1 1 1 9 5493 1 1 30 HIS HD2 H -1.342 3.023 0.141 1.00 . A A . 30 HIS HD2 1 1 9 5494 1 1 30 HIS HE1 H -3.018 -0.238 -1.919 1.00 . A A . 30 HIS HE1 1 1 9 5495 1 1 30 HIS N N -4.160 4.473 -3.135 1.00 . A A . 30 HIS N 1 1 9 5496 1 1 30 HIS ND1 N -3.797 1.722 -1.515 1.00 . A A . 30 HIS ND1 1 1 9 5497 1 1 30 HIS NE2 N -1.822 1.134 -0.833 1.00 . A A . 30 HIS NE2 1 1 9 5498 1 1 30 HIS O O -1.642 5.321 -3.082 1.00 . A A . 30 HIS O 1 1 9 5499 1 1 31 ARG C C 0.402 5.735 0.582 1.00 . A A . 31 ARG C 1 1 9 5500 1 1 31 ARG CA C -0.149 5.942 -0.828 1.00 . A A . 31 ARG CA 1 1 9 5501 1 1 31 ARG CB C 0.154 7.370 -1.307 1.00 . A A . 31 ARG CB 1 1 9 5502 1 1 31 ARG CD C -1.278 9.363 -1.885 1.00 . A A . 31 ARG CD 1 1 9 5503 1 1 31 ARG CG C -0.819 8.418 -0.784 1.00 . A A . 31 ARG CG 1 1 9 5504 1 1 31 ARG CZ C -2.630 8.726 -3.856 1.00 . A A . 31 ARG CZ 1 1 9 5505 1 1 31 ARG H H -2.086 5.677 -0.022 1.00 . A A . 31 ARG H 1 1 9 5506 1 1 31 ARG HA H 0.329 5.239 -1.494 1.00 . A A . 31 ARG HA 1 1 9 5507 1 1 31 ARG HB2 H 1.147 7.642 -0.983 1.00 . A A . 31 ARG HB2 1 1 9 5508 1 1 31 ARG HB3 H 0.120 7.388 -2.386 1.00 . A A . 31 ARG HB3 1 1 9 5509 1 1 31 ARG HD2 H -2.204 9.828 -1.579 1.00 . A A . 31 ARG HD2 1 1 9 5510 1 1 31 ARG HD3 H -0.524 10.124 -2.027 1.00 . A A . 31 ARG HD3 1 1 9 5511 1 1 31 ARG HE H -0.751 8.130 -3.506 1.00 . A A . 31 ARG HE 1 1 9 5512 1 1 31 ARG HG2 H -1.682 7.918 -0.369 1.00 . A A . 31 ARG HG2 1 1 9 5513 1 1 31 ARG HG3 H -0.329 8.993 -0.012 1.00 . A A . 31 ARG HG3 1 1 9 5514 1 1 31 ARG HH11 H -3.597 9.957 -2.555 1.00 . A A . 31 ARG HH11 1 1 9 5515 1 1 31 ARG HH12 H -4.513 9.489 -3.961 1.00 . A A . 31 ARG HH12 1 1 9 5516 1 1 31 ARG HH21 H -1.954 7.523 -5.341 1.00 . A A . 31 ARG HH21 1 1 9 5517 1 1 31 ARG HH22 H -3.584 8.101 -5.536 1.00 . A A . 31 ARG HH22 1 1 9 5518 1 1 31 ARG N N -1.585 5.680 -0.862 1.00 . A A . 31 ARG N 1 1 9 5519 1 1 31 ARG NE N -1.497 8.668 -3.155 1.00 . A A . 31 ARG NE 1 1 9 5520 1 1 31 ARG NH1 N -3.660 9.445 -3.421 1.00 . A A . 31 ARG NH1 1 1 9 5521 1 1 31 ARG NH2 N -2.732 8.063 -5.000 1.00 . A A . 31 ARG NH2 1 1 9 5522 1 1 31 ARG O O 1.514 6.157 0.892 1.00 . A A . 31 ARG O 1 1 9 5523 1 1 32 SER C C -0.489 3.460 3.262 1.00 . A A . 32 SER C 1 1 9 5524 1 1 32 SER CA C 0.016 4.824 2.804 1.00 . A A . 32 SER CA 1 1 9 5525 1 1 32 SER CB C -0.541 5.923 3.711 1.00 . A A . 32 SER CB 1 1 9 5526 1 1 32 SER H H -1.242 4.742 1.117 1.00 . A A . 32 SER H 1 1 9 5527 1 1 32 SER HA H 1.093 4.836 2.854 1.00 . A A . 32 SER HA 1 1 9 5528 1 1 32 SER HB2 H -1.086 5.470 4.526 1.00 . A A . 32 SER HB2 1 1 9 5529 1 1 32 SER HB3 H 0.275 6.510 4.107 1.00 . A A . 32 SER HB3 1 1 9 5530 1 1 32 SER HG H -0.995 7.645 2.884 1.00 . A A . 32 SER HG 1 1 9 5531 1 1 32 SER N N -0.380 5.075 1.426 1.00 . A A . 32 SER N 1 1 9 5532 1 1 32 SER O O -1.271 2.816 2.560 1.00 . A A . 32 SER O 1 1 9 5533 1 1 32 SER OG O -1.417 6.780 2.994 1.00 . A A . 32 SER OG 1 1 9 5534 1 1 33 LEU C C -1.933 1.791 5.484 1.00 . A A . 33 LEU C 1 1 9 5535 1 1 33 LEU CA C -0.490 1.760 5.007 1.00 . A A . 33 LEU CA 1 1 9 5536 1 1 33 LEU CB C 0.416 1.388 6.175 1.00 . A A . 33 LEU CB 1 1 9 5537 1 1 33 LEU CD1 C 2.736 0.611 6.657 1.00 . A A . 33 LEU CD1 1 1 9 5538 1 1 33 LEU CD2 C 0.938 -1.052 6.167 1.00 . A A . 33 LEU CD2 1 1 9 5539 1 1 33 LEU CG C 1.472 0.337 5.864 1.00 . A A . 33 LEU CG 1 1 9 5540 1 1 33 LEU H H 0.523 3.615 4.986 1.00 . A A . 33 LEU H 1 1 9 5541 1 1 33 LEU HA H -0.387 1.023 4.227 1.00 . A A . 33 LEU HA 1 1 9 5542 1 1 33 LEU HB2 H 0.919 2.285 6.510 1.00 . A A . 33 LEU HB2 1 1 9 5543 1 1 33 LEU HB3 H -0.203 1.021 6.979 1.00 . A A . 33 LEU HB3 1 1 9 5544 1 1 33 LEU HD11 H 3.249 -0.318 6.848 1.00 . A A . 33 LEU HD11 1 1 9 5545 1 1 33 LEU HD12 H 3.378 1.269 6.092 1.00 . A A . 33 LEU HD12 1 1 9 5546 1 1 33 LEU HD13 H 2.477 1.079 7.596 1.00 . A A . 33 LEU HD13 1 1 9 5547 1 1 33 LEU HD21 H 1.459 -1.460 7.021 1.00 . A A . 33 LEU HD21 1 1 9 5548 1 1 33 LEU HD22 H -0.118 -0.992 6.385 1.00 . A A . 33 LEU HD22 1 1 9 5549 1 1 33 LEU HD23 H 1.093 -1.691 5.310 1.00 . A A . 33 LEU HD23 1 1 9 5550 1 1 33 LEU HG H 1.716 0.384 4.813 1.00 . A A . 33 LEU HG 1 1 9 5551 1 1 33 LEU N N -0.094 3.053 4.465 1.00 . A A . 33 LEU N 1 1 9 5552 1 1 33 LEU O O -2.514 0.753 5.798 1.00 . A A . 33 LEU O 1 1 9 5553 1 1 34 SER C C -4.824 2.699 4.656 1.00 . A A . 34 SER C 1 1 9 5554 1 1 34 SER CA C -3.926 3.134 5.809 1.00 . A A . 34 SER CA 1 1 9 5555 1 1 34 SER CB C -4.188 4.593 6.157 1.00 . A A . 34 SER CB 1 1 9 5556 1 1 34 SER H H -2.025 3.753 5.146 1.00 . A A . 34 SER H 1 1 9 5557 1 1 34 SER HA H -4.130 2.515 6.672 1.00 . A A . 34 SER HA 1 1 9 5558 1 1 34 SER HB2 H -4.955 4.984 5.502 1.00 . A A . 34 SER HB2 1 1 9 5559 1 1 34 SER HB3 H -4.514 4.666 7.183 1.00 . A A . 34 SER HB3 1 1 9 5560 1 1 34 SER HG H -3.252 6.293 5.842 1.00 . A A . 34 SER HG 1 1 9 5561 1 1 34 SER N N -2.531 2.969 5.448 1.00 . A A . 34 SER N 1 1 9 5562 1 1 34 SER O O -6.051 2.648 4.784 1.00 . A A . 34 SER O 1 1 9 5563 1 1 34 SER OG O -3.008 5.368 5.997 1.00 . A A . 34 SER OG 1 1 9 5564 1 1 35 GLY C C -4.411 0.647 1.799 1.00 . A A . 35 GLY C 1 1 9 5565 1 1 35 GLY CA C -4.934 1.945 2.370 1.00 . A A . 35 GLY CA 1 1 9 5566 1 1 35 GLY H H -3.217 2.441 3.491 1.00 . A A . 35 GLY H 1 1 9 5567 1 1 35 GLY HA2 H -5.969 1.812 2.644 1.00 . A A . 35 GLY HA2 1 1 9 5568 1 1 35 GLY HA3 H -4.871 2.710 1.609 1.00 . A A . 35 GLY HA3 1 1 9 5569 1 1 35 GLY N N -4.196 2.381 3.529 1.00 . A A . 35 GLY N 1 1 9 5570 1 1 35 GLY O O -5.053 0.059 0.931 1.00 . A A . 35 GLY O 1 1 9 5571 1 1 36 CYS C C -3.431 -2.226 1.987 1.00 . A A . 36 CYS C 1 1 9 5572 1 1 36 CYS CA C -2.581 -0.978 1.742 1.00 . A A . 36 CYS CA 1 1 9 5573 1 1 36 CYS CB C -1.216 -1.163 2.407 1.00 . A A . 36 CYS CB 1 1 9 5574 1 1 36 CYS H H -2.753 0.774 2.913 1.00 . A A . 36 CYS H 1 1 9 5575 1 1 36 CYS HA H -2.439 -0.856 0.678 1.00 . A A . 36 CYS HA 1 1 9 5576 1 1 36 CYS HB2 H -1.319 -0.994 3.469 1.00 . A A . 36 CYS HB2 1 1 9 5577 1 1 36 CYS HB3 H -0.876 -2.176 2.239 1.00 . A A . 36 CYS HB3 1 1 9 5578 1 1 36 CYS N N -3.225 0.231 2.249 1.00 . A A . 36 CYS N 1 1 9 5579 1 1 36 CYS O O -3.548 -2.699 3.119 1.00 . A A . 36 CYS O 1 1 9 5580 1 1 36 CYS SG S 0.075 -0.037 1.797 1.00 . A A . 36 CYS SG 1 1 9 5581 1 1 37 PRO C C -3.840 -5.255 1.301 1.00 . A A . 37 PRO C 1 1 9 5582 1 1 37 PRO CA C -4.744 -4.058 1.018 1.00 . A A . 37 PRO CA 1 1 9 5583 1 1 37 PRO CB C -5.393 -4.187 -0.359 1.00 . A A . 37 PRO CB 1 1 9 5584 1 1 37 PRO CD C -3.891 -2.329 -0.469 1.00 . A A . 37 PRO CD 1 1 9 5585 1 1 37 PRO CG C -4.484 -3.447 -1.278 1.00 . A A . 37 PRO CG 1 1 9 5586 1 1 37 PRO HA H -5.510 -3.996 1.776 1.00 . A A . 37 PRO HA 1 1 9 5587 1 1 37 PRO HB2 H -5.465 -5.230 -0.629 1.00 . A A . 37 PRO HB2 1 1 9 5588 1 1 37 PRO HB3 H -6.379 -3.747 -0.340 1.00 . A A . 37 PRO HB3 1 1 9 5589 1 1 37 PRO HD2 H -2.863 -2.156 -0.749 1.00 . A A . 37 PRO HD2 1 1 9 5590 1 1 37 PRO HD3 H -4.471 -1.426 -0.596 1.00 . A A . 37 PRO HD3 1 1 9 5591 1 1 37 PRO HG2 H -3.706 -4.106 -1.633 1.00 . A A . 37 PRO HG2 1 1 9 5592 1 1 37 PRO HG3 H -5.048 -3.049 -2.109 1.00 . A A . 37 PRO HG3 1 1 9 5593 1 1 37 PRO N N -3.980 -2.816 0.920 1.00 . A A . 37 PRO N 1 1 9 5594 1 1 37 PRO O O -4.293 -6.296 1.779 1.00 . A A . 37 PRO O 1 1 9 5595 1 1 38 ARG C C -0.626 -5.746 2.387 1.00 . A A . 38 ARG C 1 1 9 5596 1 1 38 ARG CA C -1.569 -6.136 1.255 1.00 . A A . 38 ARG CA 1 1 9 5597 1 1 38 ARG CB C -0.760 -6.396 -0.015 1.00 . A A . 38 ARG CB 1 1 9 5598 1 1 38 ARG CD C -1.343 -6.201 -2.439 1.00 . A A . 38 ARG CD 1 1 9 5599 1 1 38 ARG CG C -1.583 -6.967 -1.153 1.00 . A A . 38 ARG CG 1 1 9 5600 1 1 38 ARG CZ C -2.702 -4.836 -3.974 1.00 . A A . 38 ARG CZ 1 1 9 5601 1 1 38 ARG H H -2.250 -4.219 0.683 1.00 . A A . 38 ARG H 1 1 9 5602 1 1 38 ARG HA H -2.098 -7.035 1.527 1.00 . A A . 38 ARG HA 1 1 9 5603 1 1 38 ARG HB2 H -0.325 -5.465 -0.344 1.00 . A A . 38 ARG HB2 1 1 9 5604 1 1 38 ARG HB3 H 0.034 -7.093 0.214 1.00 . A A . 38 ARG HB3 1 1 9 5605 1 1 38 ARG HD2 H -0.792 -5.302 -2.208 1.00 . A A . 38 ARG HD2 1 1 9 5606 1 1 38 ARG HD3 H -0.762 -6.817 -3.108 1.00 . A A . 38 ARG HD3 1 1 9 5607 1 1 38 ARG HE H -3.395 -6.384 -2.891 1.00 . A A . 38 ARG HE 1 1 9 5608 1 1 38 ARG HG2 H -1.309 -8.000 -1.303 1.00 . A A . 38 ARG HG2 1 1 9 5609 1 1 38 ARG HG3 H -2.631 -6.902 -0.898 1.00 . A A . 38 ARG HG3 1 1 9 5610 1 1 38 ARG HH11 H -0.803 -4.195 -3.722 1.00 . A A . 38 ARG HH11 1 1 9 5611 1 1 38 ARG HH12 H -1.742 -3.281 -4.868 1.00 . A A . 38 ARG HH12 1 1 9 5612 1 1 38 ARG HH21 H -4.660 -5.181 -4.395 1.00 . A A . 38 ARG HH21 1 1 9 5613 1 1 38 ARG HH22 H -3.926 -3.864 -5.265 1.00 . A A . 38 ARG HH22 1 1 9 5614 1 1 38 ARG N N -2.552 -5.087 1.026 1.00 . A A . 38 ARG N 1 1 9 5615 1 1 38 ARG NE N -2.594 -5.836 -3.101 1.00 . A A . 38 ARG NE 1 1 9 5616 1 1 38 ARG NH1 N -1.665 -4.044 -4.205 1.00 . A A . 38 ARG NH1 1 1 9 5617 1 1 38 ARG NH2 N -3.854 -4.606 -4.588 1.00 . A A . 38 ARG NH2 1 1 9 5618 1 1 38 ARG O O 0.588 -5.948 2.290 1.00 . A A . 38 ARG O 1 1 9 5619 1 1 39 ALA C C 0.512 -5.745 5.116 1.00 . A A . 39 ALA C 1 1 9 5620 1 1 39 ALA CA C -0.416 -4.663 4.571 1.00 . A A . 39 ALA CA 1 1 9 5621 1 1 39 ALA CB C -1.348 -4.170 5.669 1.00 . A A . 39 ALA CB 1 1 9 5622 1 1 39 ALA H H -2.156 -4.972 3.408 1.00 . A A . 39 ALA H 1 1 9 5623 1 1 39 ALA HA H 0.181 -3.826 4.239 1.00 . A A . 39 ALA HA 1 1 9 5624 1 1 39 ALA HB1 H -0.782 -3.621 6.406 1.00 . A A . 39 ALA HB1 1 1 9 5625 1 1 39 ALA HB2 H -2.100 -3.524 5.240 1.00 . A A . 39 ALA HB2 1 1 9 5626 1 1 39 ALA HB3 H -1.830 -5.015 6.142 1.00 . A A . 39 ALA HB3 1 1 9 5627 1 1 39 ALA N N -1.190 -5.139 3.427 1.00 . A A . 39 ALA N 1 1 9 5628 1 1 39 ALA O O 0.105 -6.894 5.305 1.00 . A A . 39 ALA O 1 1 9 5629 1 1 40 LYS C C 2.705 -6.287 7.413 1.00 . A A . 40 LYS C 1 1 9 5630 1 1 40 LYS CA C 2.746 -6.297 5.887 1.00 . A A . 40 LYS CA 1 1 9 5631 1 1 40 LYS CB C 4.152 -5.932 5.384 1.00 . A A . 40 LYS CB 1 1 9 5632 1 1 40 LYS CD C 5.066 -3.593 5.432 1.00 . A A . 40 LYS CD 1 1 9 5633 1 1 40 LYS CE C 4.520 -2.386 6.178 1.00 . A A . 40 LYS CE 1 1 9 5634 1 1 40 LYS CG C 4.858 -4.876 6.218 1.00 . A A . 40 LYS CG 1 1 9 5635 1 1 40 LYS H H 2.019 -4.443 5.186 1.00 . A A . 40 LYS H 1 1 9 5636 1 1 40 LYS HA H 2.493 -7.285 5.538 1.00 . A A . 40 LYS HA 1 1 9 5637 1 1 40 LYS HB2 H 4.761 -6.824 5.386 1.00 . A A . 40 LYS HB2 1 1 9 5638 1 1 40 LYS HB3 H 4.074 -5.566 4.370 1.00 . A A . 40 LYS HB3 1 1 9 5639 1 1 40 LYS HD2 H 6.124 -3.451 5.264 1.00 . A A . 40 LYS HD2 1 1 9 5640 1 1 40 LYS HD3 H 4.558 -3.676 4.482 1.00 . A A . 40 LYS HD3 1 1 9 5641 1 1 40 LYS HE2 H 4.536 -1.535 5.514 1.00 . A A . 40 LYS HE2 1 1 9 5642 1 1 40 LYS HE3 H 3.502 -2.592 6.474 1.00 . A A . 40 LYS HE3 1 1 9 5643 1 1 40 LYS HG2 H 4.256 -4.659 7.087 1.00 . A A . 40 LYS HG2 1 1 9 5644 1 1 40 LYS HG3 H 5.818 -5.259 6.529 1.00 . A A . 40 LYS HG3 1 1 9 5645 1 1 40 LYS HZ1 H 4.928 -1.233 7.874 1.00 . A A . 40 LYS HZ1 1 1 9 5646 1 1 40 LYS HZ2 H 6.310 -1.864 7.120 1.00 . A A . 40 LYS HZ2 1 1 9 5647 1 1 40 LYS HZ3 H 5.315 -2.875 8.046 1.00 . A A . 40 LYS HZ3 1 1 9 5648 1 1 40 LYS N N 1.761 -5.372 5.355 1.00 . A A . 40 LYS N 1 1 9 5649 1 1 40 LYS NZ N 5.322 -2.068 7.387 1.00 . A A . 40 LYS NZ 1 1 9 5650 1 1 40 LYS O O 2.256 -5.317 8.023 1.00 . A A . 40 LYS O 1 1 9 5651 1 1 41 LYS C C 4.704 -7.406 9.931 1.00 . A A . 41 LYS C 1 1 9 5652 1 1 41 LYS CA C 3.254 -7.439 9.470 1.00 . A A . 41 LYS CA 1 1 9 5653 1 1 41 LYS CB C 2.566 -8.717 9.959 1.00 . A A . 41 LYS CB 1 1 9 5654 1 1 41 LYS CD C 0.270 -9.182 9.067 1.00 . A A . 41 LYS CD 1 1 9 5655 1 1 41 LYS CE C -1.056 -9.728 9.563 1.00 . A A . 41 LYS CE 1 1 9 5656 1 1 41 LYS CG C 1.076 -8.555 10.192 1.00 . A A . 41 LYS CG 1 1 9 5657 1 1 41 LYS H H 3.574 -8.085 7.480 1.00 . A A . 41 LYS H 1 1 9 5658 1 1 41 LYS HA H 2.739 -6.583 9.878 1.00 . A A . 41 LYS HA 1 1 9 5659 1 1 41 LYS HB2 H 2.711 -9.495 9.222 1.00 . A A . 41 LYS HB2 1 1 9 5660 1 1 41 LYS HB3 H 3.023 -9.025 10.888 1.00 . A A . 41 LYS HB3 1 1 9 5661 1 1 41 LYS HD2 H 0.079 -8.432 8.314 1.00 . A A . 41 LYS HD2 1 1 9 5662 1 1 41 LYS HD3 H 0.844 -9.989 8.636 1.00 . A A . 41 LYS HD3 1 1 9 5663 1 1 41 LYS HE2 H -0.864 -10.469 10.324 1.00 . A A . 41 LYS HE2 1 1 9 5664 1 1 41 LYS HE3 H -1.630 -8.918 9.987 1.00 . A A . 41 LYS HE3 1 1 9 5665 1 1 41 LYS HG2 H 0.812 -9.035 11.123 1.00 . A A . 41 LYS HG2 1 1 9 5666 1 1 41 LYS HG3 H 0.844 -7.502 10.246 1.00 . A A . 41 LYS HG3 1 1 9 5667 1 1 41 LYS HZ1 H -2.124 -9.629 7.771 1.00 . A A . 41 LYS HZ1 1 1 9 5668 1 1 41 LYS HZ2 H -2.694 -10.814 8.848 1.00 . A A . 41 LYS HZ2 1 1 9 5669 1 1 41 LYS HZ3 H -1.260 -11.073 7.976 1.00 . A A . 41 LYS HZ3 1 1 9 5670 1 1 41 LYS N N 3.194 -7.351 8.022 1.00 . A A . 41 LYS N 1 1 9 5671 1 1 41 LYS NZ N -1.839 -10.354 8.465 1.00 . A A . 41 LYS NZ 1 1 9 5672 1 1 41 LYS O O 5.427 -6.449 9.651 1.00 . A A . 41 LYS O 1 1 9 5673 1 1 42 SER C C 7.404 -9.029 9.861 1.00 . A A . 42 SER C 1 1 9 5674 1 1 42 SER CA C 6.512 -8.597 11.018 1.00 . A A . 42 SER CA 1 1 9 5675 1 1 42 SER CB C 6.588 -9.603 12.163 1.00 . A A . 42 SER CB 1 1 9 5676 1 1 42 SER H H 4.527 -9.227 10.727 1.00 . A A . 42 SER H 1 1 9 5677 1 1 42 SER HA H 6.837 -7.629 11.373 1.00 . A A . 42 SER HA 1 1 9 5678 1 1 42 SER HB2 H 6.980 -10.538 11.794 1.00 . A A . 42 SER HB2 1 1 9 5679 1 1 42 SER HB3 H 7.236 -9.220 12.938 1.00 . A A . 42 SER HB3 1 1 9 5680 1 1 42 SER HG H 4.964 -9.000 13.091 1.00 . A A . 42 SER HG 1 1 9 5681 1 1 42 SER N N 5.140 -8.476 10.575 1.00 . A A . 42 SER N 1 1 9 5682 1 1 42 SER O O 7.408 -10.195 9.465 1.00 . A A . 42 SER O 1 1 9 5683 1 1 42 SER OG O 5.298 -9.828 12.714 1.00 . A A . 42 SER OG 1 1 9 5684 1 1 43 GLY C C 8.176 -7.910 6.830 1.00 . A A . 43 GLY C 1 1 9 5685 1 1 43 GLY CA C 8.886 -8.340 8.094 1.00 . A A . 43 GLY CA 1 1 9 5686 1 1 43 GLY H H 7.986 -7.139 9.586 1.00 . A A . 43 GLY H 1 1 9 5687 1 1 43 GLY HA2 H 9.823 -7.808 8.174 1.00 . A A . 43 GLY HA2 1 1 9 5688 1 1 43 GLY HA3 H 9.086 -9.400 8.041 1.00 . A A . 43 GLY HA3 1 1 9 5689 1 1 43 GLY N N 8.085 -8.066 9.266 1.00 . A A . 43 GLY N 1 1 9 5690 1 1 43 GLY O O 7.143 -8.476 6.472 1.00 . A A . 43 GLY O 1 1 9 5691 1 1 44 LEU C C 7.895 -7.297 3.916 1.00 . A A . 44 LEU C 1 1 9 5692 1 1 44 LEU CA C 8.036 -6.264 5.032 1.00 . A A . 44 LEU CA 1 1 9 5693 1 1 44 LEU CB C 8.830 -5.048 4.531 1.00 . A A . 44 LEU CB 1 1 9 5694 1 1 44 LEU CD1 C 11.222 -5.399 3.850 1.00 . A A . 44 LEU CD1 1 1 9 5695 1 1 44 LEU CD2 C 10.639 -3.571 5.444 1.00 . A A . 44 LEU CD2 1 1 9 5696 1 1 44 LEU CG C 10.294 -4.977 4.978 1.00 . A A . 44 LEU CG 1 1 9 5697 1 1 44 LEU H H 9.454 -6.393 6.605 1.00 . A A . 44 LEU H 1 1 9 5698 1 1 44 LEU HA H 7.048 -5.938 5.321 1.00 . A A . 44 LEU HA 1 1 9 5699 1 1 44 LEU HB2 H 8.807 -5.055 3.451 1.00 . A A . 44 LEU HB2 1 1 9 5700 1 1 44 LEU HB3 H 8.331 -4.156 4.876 1.00 . A A . 44 LEU HB3 1 1 9 5701 1 1 44 LEU HD11 H 10.899 -6.352 3.456 1.00 . A A . 44 LEU HD11 1 1 9 5702 1 1 44 LEU HD12 H 11.194 -4.658 3.065 1.00 . A A . 44 LEU HD12 1 1 9 5703 1 1 44 LEU HD13 H 12.230 -5.488 4.228 1.00 . A A . 44 LEU HD13 1 1 9 5704 1 1 44 LEU HD21 H 9.847 -3.195 6.075 1.00 . A A . 44 LEU HD21 1 1 9 5705 1 1 44 LEU HD22 H 11.562 -3.595 6.002 1.00 . A A . 44 LEU HD22 1 1 9 5706 1 1 44 LEU HD23 H 10.751 -2.927 4.584 1.00 . A A . 44 LEU HD23 1 1 9 5707 1 1 44 LEU HG H 10.446 -5.650 5.807 1.00 . A A . 44 LEU HG 1 1 9 5708 1 1 44 LEU N N 8.673 -6.843 6.215 1.00 . A A . 44 LEU N 1 1 9 5709 1 1 44 LEU O O 6.782 -7.676 3.547 1.00 . A A . 44 LEU O 1 1 9 5710 1 1 45 ARG C C 10.322 -9.593 2.478 1.00 . A A . 45 ARG C 1 1 9 5711 1 1 45 ARG CA C 9.049 -8.773 2.358 1.00 . A A . 45 ARG CA 1 1 9 5712 1 1 45 ARG CB C 8.981 -8.116 0.975 1.00 . A A . 45 ARG CB 1 1 9 5713 1 1 45 ARG CD C 7.460 -8.355 -1.019 1.00 . A A . 45 ARG CD 1 1 9 5714 1 1 45 ARG CG C 7.565 -7.952 0.443 1.00 . A A . 45 ARG CG 1 1 9 5715 1 1 45 ARG CZ C 5.826 -9.437 -2.522 1.00 . A A . 45 ARG CZ 1 1 9 5716 1 1 45 ARG H H 9.875 -7.448 3.777 1.00 . A A . 45 ARG H 1 1 9 5717 1 1 45 ARG HA H 8.196 -9.423 2.490 1.00 . A A . 45 ARG HA 1 1 9 5718 1 1 45 ARG HB2 H 9.434 -7.138 1.033 1.00 . A A . 45 ARG HB2 1 1 9 5719 1 1 45 ARG HB3 H 9.539 -8.720 0.275 1.00 . A A . 45 ARG HB3 1 1 9 5720 1 1 45 ARG HD2 H 7.542 -7.468 -1.631 1.00 . A A . 45 ARG HD2 1 1 9 5721 1 1 45 ARG HD3 H 8.267 -9.031 -1.256 1.00 . A A . 45 ARG HD3 1 1 9 5722 1 1 45 ARG HE H 5.566 -9.159 -0.554 1.00 . A A . 45 ARG HE 1 1 9 5723 1 1 45 ARG HG2 H 6.899 -8.571 1.025 1.00 . A A . 45 ARG HG2 1 1 9 5724 1 1 45 ARG HG3 H 7.276 -6.916 0.544 1.00 . A A . 45 ARG HG3 1 1 9 5725 1 1 45 ARG HH11 H 7.487 -8.739 -3.462 1.00 . A A . 45 ARG HH11 1 1 9 5726 1 1 45 ARG HH12 H 6.347 -9.574 -4.478 1.00 . A A . 45 ARG HH12 1 1 9 5727 1 1 45 ARG HH21 H 4.063 -10.220 -1.896 1.00 . A A . 45 ARG HH21 1 1 9 5728 1 1 45 ARG HH22 H 4.390 -10.382 -3.598 1.00 . A A . 45 ARG HH22 1 1 9 5729 1 1 45 ARG N N 9.024 -7.765 3.409 1.00 . A A . 45 ARG N 1 1 9 5730 1 1 45 ARG NE N 6.188 -9.015 -1.313 1.00 . A A . 45 ARG NE 1 1 9 5731 1 1 45 ARG NH1 N 6.613 -9.228 -3.570 1.00 . A A . 45 ARG NH1 1 1 9 5732 1 1 45 ARG NH2 N 4.668 -10.062 -2.684 1.00 . A A . 45 ARG NH2 1 1 9 5733 1 1 45 ARG O O 11.275 -9.169 3.138 1.00 . A A . 45 ARG O 1 1 9 5734 1 1 46 VAL C C 12.245 -11.568 0.543 1.00 . A A . 46 VAL C 1 1 9 5735 1 1 46 VAL CA C 11.520 -11.609 1.878 1.00 . A A . 46 VAL CA 1 1 9 5736 1 1 46 VAL CB C 11.172 -13.074 2.222 1.00 . A A . 46 VAL CB 1 1 9 5737 1 1 46 VAL CG1 C 11.353 -13.329 3.709 1.00 . A A . 46 VAL CG1 1 1 9 5738 1 1 46 VAL CG2 C 9.756 -13.422 1.786 1.00 . A A . 46 VAL CG2 1 1 9 5739 1 1 46 VAL H H 9.560 -11.034 1.327 1.00 . A A . 46 VAL H 1 1 9 5740 1 1 46 VAL HA H 12.183 -11.229 2.643 1.00 . A A . 46 VAL HA 1 1 9 5741 1 1 46 VAL HB H 11.857 -13.716 1.688 1.00 . A A . 46 VAL HB 1 1 9 5742 1 1 46 VAL HG11 H 11.420 -14.393 3.886 1.00 . A A . 46 VAL HG11 1 1 9 5743 1 1 46 VAL HG12 H 12.260 -12.852 4.049 1.00 . A A . 46 VAL HG12 1 1 9 5744 1 1 46 VAL HG13 H 10.510 -12.927 4.249 1.00 . A A . 46 VAL HG13 1 1 9 5745 1 1 46 VAL HG21 H 9.562 -14.463 1.997 1.00 . A A . 46 VAL HG21 1 1 9 5746 1 1 46 VAL HG22 H 9.050 -12.806 2.325 1.00 . A A . 46 VAL HG22 1 1 9 5747 1 1 46 VAL HG23 H 9.652 -13.244 0.724 1.00 . A A . 46 VAL HG23 1 1 9 5748 1 1 46 VAL N N 10.345 -10.752 1.845 1.00 . A A . 46 VAL N 1 1 9 5749 1 1 46 VAL O O 11.576 -11.716 -0.501 1.00 . A A . 46 VAL O 1 1 9 5750 1 1 46 VAL OXT O 13.475 -11.374 0.536 1.00 . A A . 46 VAL OXT 1 1 9 5751 2 2 1 ZN ZN ZN -0.202 0.153 -0.472 1.00 . B A . 47 ZN ZN 1 1 10 5752 1 1 1 GLY C C 20.366 16.777 4.600 1.00 . A A . 1 GLY C 1 1 10 5753 1 1 1 GLY CA C 21.046 17.785 5.499 1.00 . A A . 1 GLY CA 1 1 10 5754 1 1 1 GLY H1 H 19.132 18.110 6.246 1.00 . A A . 1 GLY H1 1 1 10 5755 1 1 1 GLY H2 H 20.001 19.533 5.935 1.00 . A A . 1 GLY H2 1 1 10 5756 1 1 1 GLY H3 H 20.372 18.594 7.296 1.00 . A A . 1 GLY H3 1 1 10 5757 1 1 1 GLY HA2 H 21.619 18.469 4.887 1.00 . A A . 1 GLY HA2 1 1 10 5758 1 1 1 GLY HA3 H 21.718 17.266 6.167 1.00 . A A . 1 GLY HA3 1 1 10 5759 1 1 1 GLY N N 20.071 18.558 6.299 1.00 . A A . 1 GLY N 1 1 10 5760 1 1 1 GLY O O 19.447 17.119 3.855 1.00 . A A . 1 GLY O 1 1 10 5761 1 1 2 SER C C 19.446 13.470 4.725 1.00 . A A . 2 SER C 1 1 10 5762 1 1 2 SER CA C 20.229 14.467 3.868 1.00 . A A . 2 SER CA 1 1 10 5763 1 1 2 SER CB C 21.349 13.754 3.109 1.00 . A A . 2 SER CB 1 1 10 5764 1 1 2 SER H H 21.514 15.312 5.321 1.00 . A A . 2 SER H 1 1 10 5765 1 1 2 SER HA H 19.554 14.919 3.154 1.00 . A A . 2 SER HA 1 1 10 5766 1 1 2 SER HB2 H 21.469 12.753 3.503 1.00 . A A . 2 SER HB2 1 1 10 5767 1 1 2 SER HB3 H 21.097 13.701 2.060 1.00 . A A . 2 SER HB3 1 1 10 5768 1 1 2 SER HG H 22.523 15.298 2.777 1.00 . A A . 2 SER HG 1 1 10 5769 1 1 2 SER N N 20.793 15.529 4.687 1.00 . A A . 2 SER N 1 1 10 5770 1 1 2 SER O O 19.440 12.268 4.452 1.00 . A A . 2 SER O 1 1 10 5771 1 1 2 SER OG O 22.578 14.451 3.250 1.00 . A A . 2 SER OG 1 1 10 5772 1 1 3 MET C C 16.478 13.246 6.257 1.00 . A A . 3 MET C 1 1 10 5773 1 1 3 MET CA C 17.956 13.131 6.617 1.00 . A A . 3 MET CA 1 1 10 5774 1 1 3 MET CB C 18.173 13.515 8.081 1.00 . A A . 3 MET CB 1 1 10 5775 1 1 3 MET CE C 17.560 10.961 11.296 1.00 . A A . 3 MET CE 1 1 10 5776 1 1 3 MET CG C 18.329 12.321 9.007 1.00 . A A . 3 MET CG 1 1 10 5777 1 1 3 MET H H 18.777 14.949 5.895 1.00 . A A . 3 MET H 1 1 10 5778 1 1 3 MET HA H 18.271 12.109 6.470 1.00 . A A . 3 MET HA 1 1 10 5779 1 1 3 MET HB2 H 19.066 14.120 8.154 1.00 . A A . 3 MET HB2 1 1 10 5780 1 1 3 MET HB3 H 17.327 14.096 8.418 1.00 . A A . 3 MET HB3 1 1 10 5781 1 1 3 MET HE1 H 18.471 10.509 10.927 1.00 . A A . 3 MET HE1 1 1 10 5782 1 1 3 MET HE2 H 17.776 11.528 12.189 1.00 . A A . 3 MET HE2 1 1 10 5783 1 1 3 MET HE3 H 16.845 10.185 11.526 1.00 . A A . 3 MET HE3 1 1 10 5784 1 1 3 MET HG2 H 18.495 11.437 8.408 1.00 . A A . 3 MET HG2 1 1 10 5785 1 1 3 MET HG3 H 19.185 12.487 9.644 1.00 . A A . 3 MET HG3 1 1 10 5786 1 1 3 MET N N 18.760 13.977 5.741 1.00 . A A . 3 MET N 1 1 10 5787 1 1 3 MET O O 15.600 12.812 7.008 1.00 . A A . 3 MET O 1 1 10 5788 1 1 3 MET SD S 16.880 12.049 10.049 1.00 . A A . 3 MET SD 1 1 10 5789 1 1 4 ALA C C 14.514 12.783 3.660 1.00 . A A . 4 ALA C 1 1 10 5790 1 1 4 ALA CA C 14.850 13.933 4.596 1.00 . A A . 4 ALA CA 1 1 10 5791 1 1 4 ALA CB C 14.663 15.269 3.894 1.00 . A A . 4 ALA CB 1 1 10 5792 1 1 4 ALA H H 16.955 14.089 4.511 1.00 . A A . 4 ALA H 1 1 10 5793 1 1 4 ALA HA H 14.183 13.901 5.445 1.00 . A A . 4 ALA HA 1 1 10 5794 1 1 4 ALA HB1 H 13.638 15.592 4.002 1.00 . A A . 4 ALA HB1 1 1 10 5795 1 1 4 ALA HB2 H 15.319 16.003 4.338 1.00 . A A . 4 ALA HB2 1 1 10 5796 1 1 4 ALA HB3 H 14.898 15.164 2.846 1.00 . A A . 4 ALA HB3 1 1 10 5797 1 1 4 ALA N N 16.211 13.800 5.084 1.00 . A A . 4 ALA N 1 1 10 5798 1 1 4 ALA O O 14.960 12.751 2.512 1.00 . A A . 4 ALA O 1 1 10 5799 1 1 5 ALA C C 11.862 10.676 3.133 1.00 . A A . 5 ALA C 1 1 10 5800 1 1 5 ALA CA C 13.363 10.668 3.382 1.00 . A A . 5 ALA CA 1 1 10 5801 1 1 5 ALA CB C 13.791 9.387 4.083 1.00 . A A . 5 ALA CB 1 1 10 5802 1 1 5 ALA H H 13.426 11.919 5.088 1.00 . A A . 5 ALA H 1 1 10 5803 1 1 5 ALA HA H 13.875 10.722 2.431 1.00 . A A . 5 ALA HA 1 1 10 5804 1 1 5 ALA HB1 H 14.380 8.788 3.406 1.00 . A A . 5 ALA HB1 1 1 10 5805 1 1 5 ALA HB2 H 14.383 9.630 4.954 1.00 . A A . 5 ALA HB2 1 1 10 5806 1 1 5 ALA HB3 H 12.916 8.831 4.386 1.00 . A A . 5 ALA HB3 1 1 10 5807 1 1 5 ALA N N 13.751 11.831 4.164 1.00 . A A . 5 ALA N 1 1 10 5808 1 1 5 ALA O O 11.160 9.711 3.436 1.00 . A A . 5 ALA O 1 1 10 5809 1 1 6 HIS C C 9.797 12.254 0.785 1.00 . A A . 6 HIS C 1 1 10 5810 1 1 6 HIS CA C 9.962 11.902 2.259 1.00 . A A . 6 HIS CA 1 1 10 5811 1 1 6 HIS CB C 9.301 12.958 3.151 1.00 . A A . 6 HIS CB 1 1 10 5812 1 1 6 HIS CD2 C 6.828 12.618 3.868 1.00 . A A . 6 HIS CD2 1 1 10 5813 1 1 6 HIS CE1 C 7.167 11.254 5.546 1.00 . A A . 6 HIS CE1 1 1 10 5814 1 1 6 HIS CG C 8.164 12.420 3.968 1.00 . A A . 6 HIS CG 1 1 10 5815 1 1 6 HIS H H 11.987 12.502 2.341 1.00 . A A . 6 HIS H 1 1 10 5816 1 1 6 HIS HA H 9.496 10.946 2.441 1.00 . A A . 6 HIS HA 1 1 10 5817 1 1 6 HIS HB2 H 10.037 13.360 3.830 1.00 . A A . 6 HIS HB2 1 1 10 5818 1 1 6 HIS HB3 H 8.915 13.754 2.530 1.00 . A A . 6 HIS HB3 1 1 10 5819 1 1 6 HIS HD1 H 9.208 11.231 5.372 1.00 . A A . 6 HIS HD1 1 1 10 5820 1 1 6 HIS HD2 H 6.325 13.240 3.141 1.00 . A A . 6 HIS HD2 1 1 10 5821 1 1 6 HIS HE1 H 6.999 10.598 6.389 1.00 . A A . 6 HIS HE1 1 1 10 5822 1 1 6 HIS HE2 H 5.290 11.968 5.146 1.00 . A A . 6 HIS HE2 1 1 10 5823 1 1 6 HIS N N 11.374 11.774 2.579 1.00 . A A . 6 HIS N 1 1 10 5824 1 1 6 HIS ND1 N 8.341 11.561 5.030 1.00 . A A . 6 HIS ND1 1 1 10 5825 1 1 6 HIS NE2 N 6.232 11.883 4.861 1.00 . A A . 6 HIS NE2 1 1 10 5826 1 1 6 HIS O O 10.706 12.011 -0.010 1.00 . A A . 6 HIS O 1 1 10 5827 1 1 7 SER C C 8.250 11.844 -1.819 1.00 . A A . 7 SER C 1 1 10 5828 1 1 7 SER CA C 8.321 13.116 -0.971 1.00 . A A . 7 SER CA 1 1 10 5829 1 1 7 SER CB C 9.356 14.097 -1.531 1.00 . A A . 7 SER CB 1 1 10 5830 1 1 7 SER H H 7.935 12.920 1.096 1.00 . A A . 7 SER H 1 1 10 5831 1 1 7 SER HA H 7.350 13.589 -0.984 1.00 . A A . 7 SER HA 1 1 10 5832 1 1 7 SER HB2 H 10.248 13.555 -1.809 1.00 . A A . 7 SER HB2 1 1 10 5833 1 1 7 SER HB3 H 8.949 14.594 -2.398 1.00 . A A . 7 SER HB3 1 1 10 5834 1 1 7 SER HG H 9.075 15.022 0.186 1.00 . A A . 7 SER HG 1 1 10 5835 1 1 7 SER N N 8.629 12.785 0.420 1.00 . A A . 7 SER N 1 1 10 5836 1 1 7 SER O O 8.393 10.737 -1.287 1.00 . A A . 7 SER O 1 1 10 5837 1 1 7 SER OG O 9.700 15.075 -0.558 1.00 . A A . 7 SER OG 1 1 10 5838 1 1 8 ALA C C 6.675 9.901 -3.369 1.00 . A A . 8 ALA C 1 1 10 5839 1 1 8 ALA CA C 7.691 10.853 -3.986 1.00 . A A . 8 ALA CA 1 1 10 5840 1 1 8 ALA CB C 8.998 10.134 -4.277 1.00 . A A . 8 ALA CB 1 1 10 5841 1 1 8 ALA H H 7.722 12.902 -3.442 1.00 . A A . 8 ALA H 1 1 10 5842 1 1 8 ALA HA H 7.295 11.226 -4.920 1.00 . A A . 8 ALA HA 1 1 10 5843 1 1 8 ALA HB1 H 9.421 10.513 -5.195 1.00 . A A . 8 ALA HB1 1 1 10 5844 1 1 8 ALA HB2 H 9.687 10.303 -3.464 1.00 . A A . 8 ALA HB2 1 1 10 5845 1 1 8 ALA HB3 H 8.810 9.075 -4.376 1.00 . A A . 8 ALA HB3 1 1 10 5846 1 1 8 ALA N N 7.910 11.996 -3.101 1.00 . A A . 8 ALA N 1 1 10 5847 1 1 8 ALA O O 6.924 8.702 -3.218 1.00 . A A . 8 ALA O 1 1 10 5848 1 1 9 ASP C C 3.504 9.220 -3.125 1.00 . A A . 9 ASP C 1 1 10 5849 1 1 9 ASP CA C 4.564 9.738 -2.167 1.00 . A A . 9 ASP CA 1 1 10 5850 1 1 9 ASP CB C 3.931 10.651 -1.114 1.00 . A A . 9 ASP CB 1 1 10 5851 1 1 9 ASP CG C 3.469 9.909 0.120 1.00 . A A . 9 ASP CG 1 1 10 5852 1 1 9 ASP H H 5.505 11.456 -2.974 1.00 . A A . 9 ASP H 1 1 10 5853 1 1 9 ASP HA H 5.028 8.891 -1.679 1.00 . A A . 9 ASP HA 1 1 10 5854 1 1 9 ASP HB2 H 4.653 11.392 -0.812 1.00 . A A . 9 ASP HB2 1 1 10 5855 1 1 9 ASP HB3 H 3.076 11.150 -1.553 1.00 . A A . 9 ASP HB3 1 1 10 5856 1 1 9 ASP N N 5.589 10.477 -2.895 1.00 . A A . 9 ASP N 1 1 10 5857 1 1 9 ASP O O 2.321 9.512 -2.984 1.00 . A A . 9 ASP O 1 1 10 5858 1 1 9 ASP OD1 O 4.308 9.240 0.764 1.00 . A A . 9 ASP OD1 1 1 10 5859 1 1 9 ASP OD2 O 2.282 10.020 0.478 1.00 . A A . 9 ASP OD2 1 1 10 5860 1 1 10 LEU C C 2.789 6.360 -4.594 1.00 . A A . 10 LEU C 1 1 10 5861 1 1 10 LEU CA C 3.028 7.791 -5.022 1.00 . A A . 10 LEU CA 1 1 10 5862 1 1 10 LEU CB C 3.591 7.846 -6.440 1.00 . A A . 10 LEU CB 1 1 10 5863 1 1 10 LEU CD1 C 4.816 9.280 -8.088 1.00 . A A . 10 LEU CD1 1 1 10 5864 1 1 10 LEU CD2 C 2.424 9.765 -7.543 1.00 . A A . 10 LEU CD2 1 1 10 5865 1 1 10 LEU CG C 3.751 9.256 -7.004 1.00 . A A . 10 LEU CG 1 1 10 5866 1 1 10 LEU H H 4.895 8.206 -4.130 1.00 . A A . 10 LEU H 1 1 10 5867 1 1 10 LEU HA H 2.093 8.319 -4.990 1.00 . A A . 10 LEU HA 1 1 10 5868 1 1 10 LEU HB2 H 4.560 7.366 -6.441 1.00 . A A . 10 LEU HB2 1 1 10 5869 1 1 10 LEU HB3 H 2.931 7.292 -7.092 1.00 . A A . 10 LEU HB3 1 1 10 5870 1 1 10 LEU HD11 H 4.909 10.282 -8.480 1.00 . A A . 10 LEU HD11 1 1 10 5871 1 1 10 LEU HD12 H 5.762 8.970 -7.667 1.00 . A A . 10 LEU HD12 1 1 10 5872 1 1 10 LEU HD13 H 4.536 8.605 -8.884 1.00 . A A . 10 LEU HD13 1 1 10 5873 1 1 10 LEU HD21 H 1.818 8.930 -7.862 1.00 . A A . 10 LEU HD21 1 1 10 5874 1 1 10 LEU HD22 H 1.907 10.311 -6.768 1.00 . A A . 10 LEU HD22 1 1 10 5875 1 1 10 LEU HD23 H 2.603 10.422 -8.383 1.00 . A A . 10 LEU HD23 1 1 10 5876 1 1 10 LEU HG H 4.070 9.916 -6.211 1.00 . A A . 10 LEU HG 1 1 10 5877 1 1 10 LEU N N 3.939 8.422 -4.085 1.00 . A A . 10 LEU N 1 1 10 5878 1 1 10 LEU O O 1.654 5.888 -4.544 1.00 . A A . 10 LEU O 1 1 10 5879 1 1 11 LYS C C 3.933 4.358 -2.185 1.00 . A A . 11 LYS C 1 1 10 5880 1 1 11 LYS CA C 3.775 4.375 -3.687 1.00 . A A . 11 LYS CA 1 1 10 5881 1 1 11 LYS CB C 4.822 3.491 -4.339 1.00 . A A . 11 LYS CB 1 1 10 5882 1 1 11 LYS CD C 3.372 1.454 -4.263 1.00 . A A . 11 LYS CD 1 1 10 5883 1 1 11 LYS CE C 4.211 0.351 -3.636 1.00 . A A . 11 LYS CE 1 1 10 5884 1 1 11 LYS CG C 4.203 2.373 -5.145 1.00 . A A . 11 LYS CG 1 1 10 5885 1 1 11 LYS H H 4.724 6.147 -4.204 1.00 . A A . 11 LYS H 1 1 10 5886 1 1 11 LYS HA H 2.796 3.993 -3.934 1.00 . A A . 11 LYS HA 1 1 10 5887 1 1 11 LYS HB2 H 5.433 4.094 -4.996 1.00 . A A . 11 LYS HB2 1 1 10 5888 1 1 11 LYS HB3 H 5.445 3.057 -3.572 1.00 . A A . 11 LYS HB3 1 1 10 5889 1 1 11 LYS HD2 H 2.925 2.043 -3.477 1.00 . A A . 11 LYS HD2 1 1 10 5890 1 1 11 LYS HD3 H 2.594 1.005 -4.863 1.00 . A A . 11 LYS HD3 1 1 10 5891 1 1 11 LYS HE2 H 3.818 -0.604 -3.953 1.00 . A A . 11 LYS HE2 1 1 10 5892 1 1 11 LYS HE3 H 5.228 0.451 -3.983 1.00 . A A . 11 LYS HE3 1 1 10 5893 1 1 11 LYS HG2 H 3.566 2.802 -5.904 1.00 . A A . 11 LYS HG2 1 1 10 5894 1 1 11 LYS HG3 H 4.988 1.810 -5.610 1.00 . A A . 11 LYS HG3 1 1 10 5895 1 1 11 LYS HZ1 H 4.350 -0.545 -1.752 1.00 . A A . 11 LYS HZ1 1 1 10 5896 1 1 11 LYS HZ2 H 3.289 0.776 -1.797 1.00 . A A . 11 LYS HZ2 1 1 10 5897 1 1 11 LYS HZ3 H 4.966 1.028 -1.806 1.00 . A A . 11 LYS HZ3 1 1 10 5898 1 1 11 LYS N N 3.858 5.707 -4.192 1.00 . A A . 11 LYS N 1 1 10 5899 1 1 11 LYS NZ N 4.201 0.407 -2.148 1.00 . A A . 11 LYS NZ 1 1 10 5900 1 1 11 LYS O O 4.869 4.929 -1.625 1.00 . A A . 11 LYS O 1 1 10 5901 1 1 12 CYS C C 4.213 2.878 0.406 1.00 . A A . 12 CYS C 1 1 10 5902 1 1 12 CYS CA C 2.927 3.528 -0.125 1.00 . A A . 12 CYS CA 1 1 10 5903 1 1 12 CYS CB C 1.718 2.648 0.185 1.00 . A A . 12 CYS CB 1 1 10 5904 1 1 12 CYS H H 2.262 3.351 -2.101 1.00 . A A . 12 CYS H 1 1 10 5905 1 1 12 CYS HA H 2.796 4.494 0.336 1.00 . A A . 12 CYS HA 1 1 10 5906 1 1 12 CYS HB2 H 1.637 2.511 1.252 1.00 . A A . 12 CYS HB2 1 1 10 5907 1 1 12 CYS HB3 H 0.825 3.140 -0.178 1.00 . A A . 12 CYS HB3 1 1 10 5908 1 1 12 CYS N N 2.981 3.709 -1.563 1.00 . A A . 12 CYS N 1 1 10 5909 1 1 12 CYS O O 5.029 2.369 -0.366 1.00 . A A . 12 CYS O 1 1 10 5910 1 1 12 CYS SG S 1.803 1.009 -0.604 1.00 . A A . 12 CYS SG 1 1 10 5911 1 1 13 PRO C C 5.725 0.815 2.203 1.00 . A A . 13 PRO C 1 1 10 5912 1 1 13 PRO CA C 5.621 2.336 2.358 1.00 . A A . 13 PRO CA 1 1 10 5913 1 1 13 PRO CB C 5.451 2.707 3.835 1.00 . A A . 13 PRO CB 1 1 10 5914 1 1 13 PRO CD C 3.520 3.514 2.722 1.00 . A A . 13 PRO CD 1 1 10 5915 1 1 13 PRO CG C 3.992 2.915 4.010 1.00 . A A . 13 PRO CG 1 1 10 5916 1 1 13 PRO HA H 6.519 2.797 1.973 1.00 . A A . 13 PRO HA 1 1 10 5917 1 1 13 PRO HB2 H 5.815 1.904 4.460 1.00 . A A . 13 PRO HB2 1 1 10 5918 1 1 13 PRO HB3 H 5.998 3.610 4.045 1.00 . A A . 13 PRO HB3 1 1 10 5919 1 1 13 PRO HD2 H 2.491 3.246 2.534 1.00 . A A . 13 PRO HD2 1 1 10 5920 1 1 13 PRO HD3 H 3.638 4.587 2.737 1.00 . A A . 13 PRO HD3 1 1 10 5921 1 1 13 PRO HG2 H 3.500 1.968 4.186 1.00 . A A . 13 PRO HG2 1 1 10 5922 1 1 13 PRO HG3 H 3.809 3.594 4.829 1.00 . A A . 13 PRO HG3 1 1 10 5923 1 1 13 PRO N N 4.418 2.901 1.730 1.00 . A A . 13 PRO N 1 1 10 5924 1 1 13 PRO O O 6.820 0.254 2.264 1.00 . A A . 13 PRO O 1 1 10 5925 1 1 14 THR C C 5.177 -1.863 0.766 1.00 . A A . 14 THR C 1 1 10 5926 1 1 14 THR CA C 4.522 -1.305 2.032 1.00 . A A . 14 THR CA 1 1 10 5927 1 1 14 THR CB C 3.067 -1.799 2.110 1.00 . A A . 14 THR CB 1 1 10 5928 1 1 14 THR CG2 C 3.012 -3.301 2.342 1.00 . A A . 14 THR CG2 1 1 10 5929 1 1 14 THR H H 3.742 0.661 2.113 1.00 . A A . 14 THR H 1 1 10 5930 1 1 14 THR HA H 5.049 -1.691 2.892 1.00 . A A . 14 THR HA 1 1 10 5931 1 1 14 THR HB H 2.574 -1.576 1.174 1.00 . A A . 14 THR HB 1 1 10 5932 1 1 14 THR HG1 H 1.515 -0.816 2.854 1.00 . A A . 14 THR HG1 1 1 10 5933 1 1 14 THR HG21 H 2.561 -3.783 1.486 1.00 . A A . 14 THR HG21 1 1 10 5934 1 1 14 THR HG22 H 2.423 -3.507 3.223 1.00 . A A . 14 THR HG22 1 1 10 5935 1 1 14 THR HG23 H 4.013 -3.681 2.481 1.00 . A A . 14 THR HG23 1 1 10 5936 1 1 14 THR N N 4.579 0.154 2.093 1.00 . A A . 14 THR N 1 1 10 5937 1 1 14 THR O O 4.752 -1.572 -0.353 1.00 . A A . 14 THR O 1 1 10 5938 1 1 14 THR OG1 O 2.386 -1.122 3.174 1.00 . A A . 14 THR OG1 1 1 10 5939 1 1 15 PRO C C 6.248 -4.350 -0.894 1.00 . A A . 15 PRO C 1 1 10 5940 1 1 15 PRO CA C 7.006 -3.228 -0.183 1.00 . A A . 15 PRO CA 1 1 10 5941 1 1 15 PRO CB C 8.272 -3.787 0.483 1.00 . A A . 15 PRO CB 1 1 10 5942 1 1 15 PRO CD C 6.871 -2.988 2.221 1.00 . A A . 15 PRO CD 1 1 10 5943 1 1 15 PRO CG C 8.306 -3.160 1.830 1.00 . A A . 15 PRO CG 1 1 10 5944 1 1 15 PRO HA H 7.284 -2.467 -0.896 1.00 . A A . 15 PRO HA 1 1 10 5945 1 1 15 PRO HB2 H 8.200 -4.863 0.552 1.00 . A A . 15 PRO HB2 1 1 10 5946 1 1 15 PRO HB3 H 9.139 -3.516 -0.097 1.00 . A A . 15 PRO HB3 1 1 10 5947 1 1 15 PRO HD2 H 6.472 -3.908 2.623 1.00 . A A . 15 PRO HD2 1 1 10 5948 1 1 15 PRO HD3 H 6.760 -2.179 2.927 1.00 . A A . 15 PRO HD3 1 1 10 5949 1 1 15 PRO HG2 H 8.815 -3.807 2.526 1.00 . A A . 15 PRO HG2 1 1 10 5950 1 1 15 PRO HG3 H 8.795 -2.201 1.773 1.00 . A A . 15 PRO HG3 1 1 10 5951 1 1 15 PRO N N 6.249 -2.656 0.934 1.00 . A A . 15 PRO N 1 1 10 5952 1 1 15 PRO O O 6.365 -4.515 -2.107 1.00 . A A . 15 PRO O 1 1 10 5953 1 1 16 GLY C C 3.421 -5.839 -1.275 1.00 . A A . 16 GLY C 1 1 10 5954 1 1 16 GLY CA C 4.759 -6.249 -0.694 1.00 . A A . 16 GLY CA 1 1 10 5955 1 1 16 GLY H H 5.443 -4.964 0.836 1.00 . A A . 16 GLY H 1 1 10 5956 1 1 16 GLY HA2 H 5.359 -6.690 -1.472 1.00 . A A . 16 GLY HA2 1 1 10 5957 1 1 16 GLY HA3 H 4.595 -6.982 0.080 1.00 . A A . 16 GLY HA3 1 1 10 5958 1 1 16 GLY N N 5.489 -5.130 -0.129 1.00 . A A . 16 GLY N 1 1 10 5959 1 1 16 GLY O O 2.652 -6.678 -1.744 1.00 . A A . 16 GLY O 1 1 10 5960 1 1 17 CYS C C 1.981 -3.766 -3.244 1.00 . A A . 17 CYS C 1 1 10 5961 1 1 17 CYS CA C 1.896 -4.009 -1.742 1.00 . A A . 17 CYS CA 1 1 10 5962 1 1 17 CYS CB C 1.596 -2.697 -1.028 1.00 . A A . 17 CYS CB 1 1 10 5963 1 1 17 CYS H H 3.798 -3.934 -0.838 1.00 . A A . 17 CYS H 1 1 10 5964 1 1 17 CYS HA H 1.109 -4.717 -1.536 1.00 . A A . 17 CYS HA 1 1 10 5965 1 1 17 CYS HB2 H 1.823 -2.813 0.020 1.00 . A A . 17 CYS HB2 1 1 10 5966 1 1 17 CYS HB3 H 2.232 -1.926 -1.438 1.00 . A A . 17 CYS HB3 1 1 10 5967 1 1 17 CYS N N 3.143 -4.547 -1.232 1.00 . A A . 17 CYS N 1 1 10 5968 1 1 17 CYS O O 2.995 -4.056 -3.880 1.00 . A A . 17 CYS O 1 1 10 5969 1 1 17 CYS SG S -0.125 -2.110 -1.145 1.00 . A A . 17 CYS SG 1 1 10 5970 1 1 18 ASP C C 0.642 -1.240 -5.276 1.00 . A A . 18 ASP C 1 1 10 5971 1 1 18 ASP CA C 0.930 -2.735 -5.172 1.00 . A A . 18 ASP CA 1 1 10 5972 1 1 18 ASP CB C -0.108 -3.547 -5.953 1.00 . A A . 18 ASP CB 1 1 10 5973 1 1 18 ASP CG C -1.472 -2.892 -5.996 1.00 . A A . 18 ASP CG 1 1 10 5974 1 1 18 ASP H H 0.202 -2.878 -3.188 1.00 . A A . 18 ASP H 1 1 10 5975 1 1 18 ASP HA H 1.910 -2.928 -5.585 1.00 . A A . 18 ASP HA 1 1 10 5976 1 1 18 ASP HB2 H 0.238 -3.677 -6.967 1.00 . A A . 18 ASP HB2 1 1 10 5977 1 1 18 ASP HB3 H -0.212 -4.515 -5.486 1.00 . A A . 18 ASP HB3 1 1 10 5978 1 1 18 ASP N N 0.949 -3.138 -3.775 1.00 . A A . 18 ASP N 1 1 10 5979 1 1 18 ASP O O 1.022 -0.587 -6.249 1.00 . A A . 18 ASP O 1 1 10 5980 1 1 18 ASP OD1 O -2.044 -2.631 -4.918 1.00 . A A . 18 ASP OD1 1 1 10 5981 1 1 18 ASP OD2 O -1.975 -2.633 -7.107 1.00 . A A . 18 ASP OD2 1 1 10 5982 1 1 19 GLY C C -1.538 1.165 -4.638 1.00 . A A . 19 GLY C 1 1 10 5983 1 1 19 GLY CA C -0.163 0.746 -4.153 1.00 . A A . 19 GLY CA 1 1 10 5984 1 1 19 GLY H H -0.158 -1.249 -3.441 1.00 . A A . 19 GLY H 1 1 10 5985 1 1 19 GLY HA2 H -0.043 1.069 -3.130 1.00 . A A . 19 GLY HA2 1 1 10 5986 1 1 19 GLY HA3 H 0.581 1.238 -4.760 1.00 . A A . 19 GLY HA3 1 1 10 5987 1 1 19 GLY N N 0.061 -0.685 -4.216 1.00 . A A . 19 GLY N 1 1 10 5988 1 1 19 GLY O O -1.862 2.355 -4.642 1.00 . A A . 19 GLY O 1 1 10 5989 1 1 20 SER C C -4.754 -0.112 -4.608 1.00 . A A . 20 SER C 1 1 10 5990 1 1 20 SER CA C -3.695 0.505 -5.514 1.00 . A A . 20 SER CA 1 1 10 5991 1 1 20 SER CB C -3.861 -0.002 -6.947 1.00 . A A . 20 SER CB 1 1 10 5992 1 1 20 SER H H -2.064 -0.737 -4.981 1.00 . A A . 20 SER H 1 1 10 5993 1 1 20 SER HA H -3.813 1.577 -5.507 1.00 . A A . 20 SER HA 1 1 10 5994 1 1 20 SER HB2 H -4.359 -0.960 -6.933 1.00 . A A . 20 SER HB2 1 1 10 5995 1 1 20 SER HB3 H -4.456 0.703 -7.511 1.00 . A A . 20 SER HB3 1 1 10 5996 1 1 20 SER HG H -2.262 -1.048 -7.415 1.00 . A A . 20 SER HG 1 1 10 5997 1 1 20 SER N N -2.358 0.203 -5.028 1.00 . A A . 20 SER N 1 1 10 5998 1 1 20 SER O O -4.490 -1.084 -3.903 1.00 . A A . 20 SER O 1 1 10 5999 1 1 20 SER OG O -2.603 -0.151 -7.586 1.00 . A A . 20 SER OG 1 1 10 6000 1 1 21 GLY C C -6.871 0.138 -2.361 1.00 . A A . 21 GLY C 1 1 10 6001 1 1 21 GLY CA C -7.057 -0.051 -3.854 1.00 . A A . 21 GLY CA 1 1 10 6002 1 1 21 GLY H H -6.098 1.225 -5.237 1.00 . A A . 21 GLY H 1 1 10 6003 1 1 21 GLY HA2 H -7.961 0.457 -4.157 1.00 . A A . 21 GLY HA2 1 1 10 6004 1 1 21 GLY HA3 H -7.169 -1.105 -4.058 1.00 . A A . 21 GLY HA3 1 1 10 6005 1 1 21 GLY N N -5.951 0.460 -4.640 1.00 . A A . 21 GLY N 1 1 10 6006 1 1 21 GLY O O -5.958 0.832 -1.923 1.00 . A A . 21 GLY O 1 1 10 6007 1 1 22 HIS C C -8.140 -1.869 0.390 1.00 . A A . 22 HIS C 1 1 10 6008 1 1 22 HIS CA C -7.665 -0.523 -0.133 1.00 . A A . 22 HIS CA 1 1 10 6009 1 1 22 HIS CB C -8.549 0.579 0.473 1.00 . A A . 22 HIS CB 1 1 10 6010 1 1 22 HIS CD2 C -6.918 2.585 0.168 1.00 . A A . 22 HIS CD2 1 1 10 6011 1 1 22 HIS CE1 C -7.360 3.625 2.038 1.00 . A A . 22 HIS CE1 1 1 10 6012 1 1 22 HIS CG C -7.847 1.856 0.824 1.00 . A A . 22 HIS CG 1 1 10 6013 1 1 22 HIS H H -8.396 -1.087 -2.028 1.00 . A A . 22 HIS H 1 1 10 6014 1 1 22 HIS HA H -6.639 -0.366 0.167 1.00 . A A . 22 HIS HA 1 1 10 6015 1 1 22 HIS HB2 H -9.324 0.825 -0.235 1.00 . A A . 22 HIS HB2 1 1 10 6016 1 1 22 HIS HB3 H -9.007 0.201 1.371 1.00 . A A . 22 HIS HB3 1 1 10 6017 1 1 22 HIS HD1 H -8.754 2.277 2.688 1.00 . A A . 22 HIS HD1 1 1 10 6018 1 1 22 HIS HD2 H -6.484 2.346 -0.789 1.00 . A A . 22 HIS HD2 1 1 10 6019 1 1 22 HIS HE1 H -7.346 4.343 2.844 1.00 . A A . 22 HIS HE1 1 1 10 6020 1 1 22 HIS HE2 H -6.219 4.516 0.597 1.00 . A A . 22 HIS HE2 1 1 10 6021 1 1 22 HIS N N -7.722 -0.519 -1.592 1.00 . A A . 22 HIS N 1 1 10 6022 1 1 22 HIS ND1 N -8.101 2.539 1.993 1.00 . A A . 22 HIS ND1 1 1 10 6023 1 1 22 HIS NE2 N -6.631 3.683 0.941 1.00 . A A . 22 HIS NE2 1 1 10 6024 1 1 22 HIS O O -8.996 -2.500 -0.234 1.00 . A A . 22 HIS O 1 1 10 6025 1 1 23 ILE C C -9.649 -3.308 2.501 1.00 . A A . 23 ILE C 1 1 10 6026 1 1 23 ILE CA C -8.158 -3.479 2.230 1.00 . A A . 23 ILE CA 1 1 10 6027 1 1 23 ILE CB C -7.375 -3.777 3.539 1.00 . A A . 23 ILE CB 1 1 10 6028 1 1 23 ILE CD1 C -7.721 -6.307 3.418 1.00 . A A . 23 ILE CD1 1 1 10 6029 1 1 23 ILE CG1 C -6.728 -5.165 3.472 1.00 . A A . 23 ILE CG1 1 1 10 6030 1 1 23 ILE CG2 C -8.258 -3.664 4.776 1.00 . A A . 23 ILE CG2 1 1 10 6031 1 1 23 ILE H H -7.027 -1.687 2.051 1.00 . A A . 23 ILE H 1 1 10 6032 1 1 23 ILE HA H -8.018 -4.305 1.545 1.00 . A A . 23 ILE HA 1 1 10 6033 1 1 23 ILE HB H -6.592 -3.039 3.627 1.00 . A A . 23 ILE HB 1 1 10 6034 1 1 23 ILE HD11 H -7.256 -7.162 2.950 1.00 . A A . 23 ILE HD11 1 1 10 6035 1 1 23 ILE HD12 H -8.026 -6.566 4.421 1.00 . A A . 23 ILE HD12 1 1 10 6036 1 1 23 ILE HD13 H -8.586 -6.007 2.844 1.00 . A A . 23 ILE HD13 1 1 10 6037 1 1 23 ILE HG12 H -6.111 -5.223 2.586 1.00 . A A . 23 ILE HG12 1 1 10 6038 1 1 23 ILE HG13 H -6.107 -5.304 4.344 1.00 . A A . 23 ILE HG13 1 1 10 6039 1 1 23 ILE HG21 H -8.392 -2.622 5.030 1.00 . A A . 23 ILE HG21 1 1 10 6040 1 1 23 ILE HG22 H -9.220 -4.110 4.572 1.00 . A A . 23 ILE HG22 1 1 10 6041 1 1 23 ILE HG23 H -7.789 -4.179 5.601 1.00 . A A . 23 ILE HG23 1 1 10 6042 1 1 23 ILE N N -7.668 -2.261 1.576 1.00 . A A . 23 ILE N 1 1 10 6043 1 1 23 ILE O O -10.439 -4.253 2.427 1.00 . A A . 23 ILE O 1 1 10 6044 1 1 24 THR C C -12.209 -2.165 1.471 1.00 . A A . 24 THR C 1 1 10 6045 1 1 24 THR CA C -11.377 -1.586 2.614 1.00 . A A . 24 THR CA 1 1 10 6046 1 1 24 THR CB C -11.367 -0.066 2.457 1.00 . A A . 24 THR CB 1 1 10 6047 1 1 24 THR CG2 C -12.667 0.528 2.912 1.00 . A A . 24 THR CG2 1 1 10 6048 1 1 24 THR H H -9.309 -1.363 2.500 1.00 . A A . 24 THR H 1 1 10 6049 1 1 24 THR HA H -11.818 -1.838 3.566 1.00 . A A . 24 THR HA 1 1 10 6050 1 1 24 THR HB H -11.240 0.163 1.408 1.00 . A A . 24 THR HB 1 1 10 6051 1 1 24 THR HG1 H -10.569 0.756 4.073 1.00 . A A . 24 THR HG1 1 1 10 6052 1 1 24 THR HG21 H -12.773 1.511 2.488 1.00 . A A . 24 THR HG21 1 1 10 6053 1 1 24 THR HG22 H -12.678 0.588 3.989 1.00 . A A . 24 THR HG22 1 1 10 6054 1 1 24 THR HG23 H -13.473 -0.102 2.572 1.00 . A A . 24 THR HG23 1 1 10 6055 1 1 24 THR N N -10.010 -2.042 2.580 1.00 . A A . 24 THR N 1 1 10 6056 1 1 24 THR O O -13.293 -2.710 1.680 1.00 . A A . 24 THR O 1 1 10 6057 1 1 24 THR OG1 O -10.271 0.498 3.185 1.00 . A A . 24 THR OG1 1 1 10 6058 1 1 25 GLY C C -13.338 -1.173 -1.449 1.00 . A A . 25 GLY C 1 1 10 6059 1 1 25 GLY CA C -12.486 -2.312 -0.925 1.00 . A A . 25 GLY CA 1 1 10 6060 1 1 25 GLY H H -10.907 -1.428 0.158 1.00 . A A . 25 GLY H 1 1 10 6061 1 1 25 GLY HA2 H -11.792 -2.617 -1.693 1.00 . A A . 25 GLY HA2 1 1 10 6062 1 1 25 GLY HA3 H -13.128 -3.144 -0.678 1.00 . A A . 25 GLY HA3 1 1 10 6063 1 1 25 GLY N N -11.743 -1.924 0.255 1.00 . A A . 25 GLY N 1 1 10 6064 1 1 25 GLY O O -14.336 -1.398 -2.130 1.00 . A A . 25 GLY O 1 1 10 6065 1 1 26 ASN C C -12.936 2.320 -2.010 1.00 . A A . 26 ASN C 1 1 10 6066 1 1 26 ASN CA C -13.788 1.220 -1.381 1.00 . A A . 26 ASN CA 1 1 10 6067 1 1 26 ASN CB C -14.464 1.759 -0.121 1.00 . A A . 26 ASN CB 1 1 10 6068 1 1 26 ASN CG C -15.825 1.146 0.101 1.00 . A A . 26 ASN CG 1 1 10 6069 1 1 26 ASN H H -12.245 0.142 -0.426 1.00 . A A . 26 ASN H 1 1 10 6070 1 1 26 ASN HA H -14.549 0.919 -2.084 1.00 . A A . 26 ASN HA 1 1 10 6071 1 1 26 ASN HB2 H -13.846 1.533 0.735 1.00 . A A . 26 ASN HB2 1 1 10 6072 1 1 26 ASN HB3 H -14.579 2.829 -0.203 1.00 . A A . 26 ASN HB3 1 1 10 6073 1 1 26 ASN HD21 H -15.358 0.756 1.987 1.00 . A A . 26 ASN HD21 1 1 10 6074 1 1 26 ASN HD22 H -16.936 0.270 1.481 1.00 . A A . 26 ASN HD22 1 1 10 6075 1 1 26 ASN N N -12.994 0.044 -1.042 1.00 . A A . 26 ASN N 1 1 10 6076 1 1 26 ASN ND2 N -16.062 0.680 1.308 1.00 . A A . 26 ASN ND2 1 1 10 6077 1 1 26 ASN O O -13.392 3.451 -2.161 1.00 . A A . 26 ASN O 1 1 10 6078 1 1 26 ASN OD1 O -16.654 1.092 -0.806 1.00 . A A . 26 ASN OD1 1 1 10 6079 1 1 27 TYR C C -10.206 2.511 -4.212 1.00 . A A . 27 TYR C 1 1 10 6080 1 1 27 TYR CA C -10.785 3.000 -2.898 1.00 . A A . 27 TYR CA 1 1 10 6081 1 1 27 TYR CB C -9.647 3.311 -1.923 1.00 . A A . 27 TYR CB 1 1 10 6082 1 1 27 TYR CD1 C -10.953 3.869 0.156 1.00 . A A . 27 TYR CD1 1 1 10 6083 1 1 27 TYR CD2 C -9.467 5.517 -0.709 1.00 . A A . 27 TYR CD2 1 1 10 6084 1 1 27 TYR CE1 C -11.309 4.719 1.183 1.00 . A A . 27 TYR CE1 1 1 10 6085 1 1 27 TYR CE2 C -9.814 6.375 0.316 1.00 . A A . 27 TYR CE2 1 1 10 6086 1 1 27 TYR CG C -10.030 4.252 -0.806 1.00 . A A . 27 TYR CG 1 1 10 6087 1 1 27 TYR CZ C -10.739 5.972 1.259 1.00 . A A . 27 TYR CZ 1 1 10 6088 1 1 27 TYR H H -11.362 1.093 -2.187 1.00 . A A . 27 TYR H 1 1 10 6089 1 1 27 TYR HA H -11.352 3.900 -3.078 1.00 . A A . 27 TYR HA 1 1 10 6090 1 1 27 TYR HB2 H -9.307 2.394 -1.476 1.00 . A A . 27 TYR HB2 1 1 10 6091 1 1 27 TYR HB3 H -8.830 3.757 -2.466 1.00 . A A . 27 TYR HB3 1 1 10 6092 1 1 27 TYR HD1 H -11.393 2.885 0.094 1.00 . A A . 27 TYR HD1 1 1 10 6093 1 1 27 TYR HD2 H -8.745 5.826 -1.449 1.00 . A A . 27 TYR HD2 1 1 10 6094 1 1 27 TYR HE1 H -12.037 4.401 1.917 1.00 . A A . 27 TYR HE1 1 1 10 6095 1 1 27 TYR HE2 H -9.364 7.356 0.376 1.00 . A A . 27 TYR HE2 1 1 10 6096 1 1 27 TYR HH H -11.660 7.523 1.931 1.00 . A A . 27 TYR HH 1 1 10 6097 1 1 27 TYR N N -11.688 2.007 -2.332 1.00 . A A . 27 TYR N 1 1 10 6098 1 1 27 TYR O O -10.283 1.321 -4.533 1.00 . A A . 27 TYR O 1 1 10 6099 1 1 27 TYR OH O -11.088 6.825 2.283 1.00 . A A . 27 TYR OH 1 1 10 6100 1 1 28 ALA C C -7.426 2.951 -6.014 1.00 . A A . 28 ALA C 1 1 10 6101 1 1 28 ALA CA C -8.935 3.070 -6.191 1.00 . A A . 28 ALA CA 1 1 10 6102 1 1 28 ALA CB C -9.263 4.107 -7.249 1.00 . A A . 28 ALA CB 1 1 10 6103 1 1 28 ALA H H -9.509 4.341 -4.604 1.00 . A A . 28 ALA H 1 1 10 6104 1 1 28 ALA HA H -9.328 2.118 -6.516 1.00 . A A . 28 ALA HA 1 1 10 6105 1 1 28 ALA HB1 H -10.335 4.182 -7.357 1.00 . A A . 28 ALA HB1 1 1 10 6106 1 1 28 ALA HB2 H -8.863 5.064 -6.952 1.00 . A A . 28 ALA HB2 1 1 10 6107 1 1 28 ALA HB3 H -8.827 3.811 -8.193 1.00 . A A . 28 ALA HB3 1 1 10 6108 1 1 28 ALA N N -9.573 3.414 -4.937 1.00 . A A . 28 ALA N 1 1 10 6109 1 1 28 ALA O O -6.769 2.170 -6.708 1.00 . A A . 28 ALA O 1 1 10 6110 1 1 29 SER C C -5.111 4.391 -3.500 1.00 . A A . 29 SER C 1 1 10 6111 1 1 29 SER CA C -5.442 3.695 -4.813 1.00 . A A . 29 SER CA 1 1 10 6112 1 1 29 SER CB C -4.685 4.373 -5.967 1.00 . A A . 29 SER CB 1 1 10 6113 1 1 29 SER H H -7.459 4.280 -4.510 1.00 . A A . 29 SER H 1 1 10 6114 1 1 29 SER HA H -5.124 2.669 -4.743 1.00 . A A . 29 SER HA 1 1 10 6115 1 1 29 SER HB2 H -3.890 4.981 -5.561 1.00 . A A . 29 SER HB2 1 1 10 6116 1 1 29 SER HB3 H -4.262 3.614 -6.609 1.00 . A A . 29 SER HB3 1 1 10 6117 1 1 29 SER HG H -5.731 4.767 -7.587 1.00 . A A . 29 SER HG 1 1 10 6118 1 1 29 SER N N -6.879 3.707 -5.065 1.00 . A A . 29 SER N 1 1 10 6119 1 1 29 SER O O -5.983 4.964 -2.847 1.00 . A A . 29 SER O 1 1 10 6120 1 1 29 SER OG O -5.543 5.201 -6.739 1.00 . A A . 29 SER OG 1 1 10 6121 1 1 30 HIS C C -1.875 5.290 -2.082 1.00 . A A . 30 HIS C 1 1 10 6122 1 1 30 HIS CA C -3.353 4.961 -1.917 1.00 . A A . 30 HIS CA 1 1 10 6123 1 1 30 HIS CB C -3.570 4.075 -0.690 1.00 . A A . 30 HIS CB 1 1 10 6124 1 1 30 HIS CD2 C -1.795 2.266 -0.232 1.00 . A A . 30 HIS CD2 1 1 10 6125 1 1 30 HIS CE1 C -2.630 0.623 -1.369 1.00 . A A . 30 HIS CE1 1 1 10 6126 1 1 30 HIS CG C -2.940 2.722 -0.786 1.00 . A A . 30 HIS CG 1 1 10 6127 1 1 30 HIS H H -3.208 3.822 -3.679 1.00 . A A . 30 HIS H 1 1 10 6128 1 1 30 HIS HA H -3.901 5.883 -1.788 1.00 . A A . 30 HIS HA 1 1 10 6129 1 1 30 HIS HB2 H -3.148 4.568 0.166 1.00 . A A . 30 HIS HB2 1 1 10 6130 1 1 30 HIS HB3 H -4.628 3.942 -0.534 1.00 . A A . 30 HIS HB3 1 1 10 6131 1 1 30 HIS HD1 H -4.315 1.663 -2.005 1.00 . A A . 30 HIS HD1 1 1 10 6132 1 1 30 HIS HD2 H -1.129 2.823 0.407 1.00 . A A . 30 HIS HD2 1 1 10 6133 1 1 30 HIS HE1 H -2.772 -0.344 -1.825 1.00 . A A . 30 HIS HE1 1 1 10 6134 1 1 30 HIS N N -3.844 4.317 -3.120 1.00 . A A . 30 HIS N 1 1 10 6135 1 1 30 HIS ND1 N -3.465 1.665 -1.507 1.00 . A A . 30 HIS ND1 1 1 10 6136 1 1 30 HIS NE2 N -1.619 0.953 -0.609 1.00 . A A . 30 HIS NE2 1 1 10 6137 1 1 30 HIS O O -1.265 4.933 -3.090 1.00 . A A . 30 HIS O 1 1 10 6138 1 1 31 ARG C C 0.769 6.288 0.140 1.00 . A A . 31 ARG C 1 1 10 6139 1 1 31 ARG CA C 0.063 6.464 -1.200 1.00 . A A . 31 ARG CA 1 1 10 6140 1 1 31 ARG CB C 0.131 7.937 -1.624 1.00 . A A . 31 ARG CB 1 1 10 6141 1 1 31 ARG CD C -0.575 8.666 -3.931 1.00 . A A . 31 ARG CD 1 1 10 6142 1 1 31 ARG CG C -1.025 8.394 -2.503 1.00 . A A . 31 ARG CG 1 1 10 6143 1 1 31 ARG CZ C -1.290 7.312 -5.871 1.00 . A A . 31 ARG CZ 1 1 10 6144 1 1 31 ARG H H -1.868 6.288 -0.348 1.00 . A A . 31 ARG H 1 1 10 6145 1 1 31 ARG HA H 0.565 5.860 -1.941 1.00 . A A . 31 ARG HA 1 1 10 6146 1 1 31 ARG HB2 H 0.143 8.553 -0.739 1.00 . A A . 31 ARG HB2 1 1 10 6147 1 1 31 ARG HB3 H 1.051 8.096 -2.171 1.00 . A A . 31 ARG HB3 1 1 10 6148 1 1 31 ARG HD2 H -1.243 9.391 -4.371 1.00 . A A . 31 ARG HD2 1 1 10 6149 1 1 31 ARG HD3 H 0.426 9.069 -3.906 1.00 . A A . 31 ARG HD3 1 1 10 6150 1 1 31 ARG HE H -0.011 6.705 -4.457 1.00 . A A . 31 ARG HE 1 1 10 6151 1 1 31 ARG HG2 H -1.782 7.624 -2.516 1.00 . A A . 31 ARG HG2 1 1 10 6152 1 1 31 ARG HG3 H -1.440 9.300 -2.086 1.00 . A A . 31 ARG HG3 1 1 10 6153 1 1 31 ARG HH11 H -2.077 9.187 -5.819 1.00 . A A . 31 ARG HH11 1 1 10 6154 1 1 31 ARG HH12 H -2.577 8.203 -7.164 1.00 . A A . 31 ARG HH12 1 1 10 6155 1 1 31 ARG HH21 H -0.660 5.413 -6.229 1.00 . A A . 31 ARG HH21 1 1 10 6156 1 1 31 ARG HH22 H -1.769 6.064 -7.406 1.00 . A A . 31 ARG HH22 1 1 10 6157 1 1 31 ARG N N -1.322 6.016 -1.120 1.00 . A A . 31 ARG N 1 1 10 6158 1 1 31 ARG NE N -0.579 7.456 -4.755 1.00 . A A . 31 ARG NE 1 1 10 6159 1 1 31 ARG NH1 N -2.042 8.310 -6.319 1.00 . A A . 31 ARG NH1 1 1 10 6160 1 1 31 ARG NH2 N -1.237 6.172 -6.554 1.00 . A A . 31 ARG NH2 1 1 10 6161 1 1 31 ARG O O 1.979 6.484 0.251 1.00 . A A . 31 ARG O 1 1 10 6162 1 1 32 SER C C -0.008 4.443 3.115 1.00 . A A . 32 SER C 1 1 10 6163 1 1 32 SER CA C 0.560 5.709 2.486 1.00 . A A . 32 SER CA 1 1 10 6164 1 1 32 SER CB C 0.247 6.923 3.366 1.00 . A A . 32 SER CB 1 1 10 6165 1 1 32 SER H H -0.948 5.734 1.002 1.00 . A A . 32 SER H 1 1 10 6166 1 1 32 SER HA H 1.631 5.605 2.394 1.00 . A A . 32 SER HA 1 1 10 6167 1 1 32 SER HB2 H -0.347 6.607 4.211 1.00 . A A . 32 SER HB2 1 1 10 6168 1 1 32 SER HB3 H 1.170 7.359 3.718 1.00 . A A . 32 SER HB3 1 1 10 6169 1 1 32 SER HG H -1.008 7.481 1.959 1.00 . A A . 32 SER HG 1 1 10 6170 1 1 32 SER N N 0.008 5.906 1.154 1.00 . A A . 32 SER N 1 1 10 6171 1 1 32 SER O O -0.848 3.771 2.511 1.00 . A A . 32 SER O 1 1 10 6172 1 1 32 SER OG O -0.479 7.911 2.645 1.00 . A A . 32 SER OG 1 1 10 6173 1 1 33 LEU C C -1.470 3.258 5.655 1.00 . A A . 33 LEU C 1 1 10 6174 1 1 33 LEU CA C -0.085 2.987 5.072 1.00 . A A . 33 LEU CA 1 1 10 6175 1 1 33 LEU CB C 0.884 2.616 6.198 1.00 . A A . 33 LEU CB 1 1 10 6176 1 1 33 LEU CD1 C 2.700 1.129 7.078 1.00 . A A . 33 LEU CD1 1 1 10 6177 1 1 33 LEU CD2 C 0.845 0.164 5.715 1.00 . A A . 33 LEU CD2 1 1 10 6178 1 1 33 LEU CG C 1.732 1.376 5.932 1.00 . A A . 33 LEU CG 1 1 10 6179 1 1 33 LEU H H 1.075 4.730 4.780 1.00 . A A . 33 LEU H 1 1 10 6180 1 1 33 LEU HA H -0.150 2.166 4.378 1.00 . A A . 33 LEU HA 1 1 10 6181 1 1 33 LEU HB2 H 1.548 3.452 6.363 1.00 . A A . 33 LEU HB2 1 1 10 6182 1 1 33 LEU HB3 H 0.313 2.447 7.097 1.00 . A A . 33 LEU HB3 1 1 10 6183 1 1 33 LEU HD11 H 2.490 0.170 7.528 1.00 . A A . 33 LEU HD11 1 1 10 6184 1 1 33 LEU HD12 H 3.713 1.137 6.701 1.00 . A A . 33 LEU HD12 1 1 10 6185 1 1 33 LEU HD13 H 2.586 1.907 7.819 1.00 . A A . 33 LEU HD13 1 1 10 6186 1 1 33 LEU HD21 H 0.641 0.054 4.660 1.00 . A A . 33 LEU HD21 1 1 10 6187 1 1 33 LEU HD22 H 1.345 -0.722 6.080 1.00 . A A . 33 LEU HD22 1 1 10 6188 1 1 33 LEU HD23 H -0.084 0.298 6.248 1.00 . A A . 33 LEU HD23 1 1 10 6189 1 1 33 LEU HG H 2.309 1.533 5.034 1.00 . A A . 33 LEU HG 1 1 10 6190 1 1 33 LEU N N 0.408 4.149 4.345 1.00 . A A . 33 LEU N 1 1 10 6191 1 1 33 LEU O O -1.712 3.064 6.845 1.00 . A A . 33 LEU O 1 1 10 6192 1 1 34 SER C C -4.647 2.883 5.064 1.00 . A A . 34 SER C 1 1 10 6193 1 1 34 SER CA C -3.715 4.079 5.227 1.00 . A A . 34 SER CA 1 1 10 6194 1 1 34 SER CB C -4.231 5.251 4.396 1.00 . A A . 34 SER CB 1 1 10 6195 1 1 34 SER H H -2.098 3.910 3.881 1.00 . A A . 34 SER H 1 1 10 6196 1 1 34 SER HA H -3.686 4.368 6.268 1.00 . A A . 34 SER HA 1 1 10 6197 1 1 34 SER HB2 H -4.874 4.871 3.616 1.00 . A A . 34 SER HB2 1 1 10 6198 1 1 34 SER HB3 H -4.787 5.922 5.031 1.00 . A A . 34 SER HB3 1 1 10 6199 1 1 34 SER HG H -3.178 6.885 4.100 1.00 . A A . 34 SER HG 1 1 10 6200 1 1 34 SER N N -2.365 3.743 4.811 1.00 . A A . 34 SER N 1 1 10 6201 1 1 34 SER O O -5.587 2.702 5.840 1.00 . A A . 34 SER O 1 1 10 6202 1 1 34 SER OG O -3.157 5.963 3.799 1.00 . A A . 34 SER OG 1 1 10 6203 1 1 35 GLY C C -4.738 0.054 2.684 1.00 . A A . 35 GLY C 1 1 10 6204 1 1 35 GLY CA C -5.281 0.975 3.749 1.00 . A A . 35 GLY CA 1 1 10 6205 1 1 35 GLY H H -3.664 2.293 3.423 1.00 . A A . 35 GLY H 1 1 10 6206 1 1 35 GLY HA2 H -5.425 0.413 4.655 1.00 . A A . 35 GLY HA2 1 1 10 6207 1 1 35 GLY HA3 H -6.239 1.354 3.421 1.00 . A A . 35 GLY HA3 1 1 10 6208 1 1 35 GLY N N -4.412 2.093 4.024 1.00 . A A . 35 GLY N 1 1 10 6209 1 1 35 GLY O O -5.440 -0.262 1.727 1.00 . A A . 35 GLY O 1 1 10 6210 1 1 36 CYS C C -3.749 -2.652 1.895 1.00 . A A . 36 CYS C 1 1 10 6211 1 1 36 CYS CA C -2.897 -1.381 1.974 1.00 . A A . 36 CYS CA 1 1 10 6212 1 1 36 CYS CB C -1.490 -1.740 2.468 1.00 . A A . 36 CYS CB 1 1 10 6213 1 1 36 CYS H H -3.016 -0.134 3.678 1.00 . A A . 36 CYS H 1 1 10 6214 1 1 36 CYS HA H -2.828 -0.935 0.993 1.00 . A A . 36 CYS HA 1 1 10 6215 1 1 36 CYS HB2 H -1.529 -1.945 3.529 1.00 . A A . 36 CYS HB2 1 1 10 6216 1 1 36 CYS HB3 H -1.150 -2.625 1.948 1.00 . A A . 36 CYS HB3 1 1 10 6217 1 1 36 CYS N N -3.507 -0.410 2.876 1.00 . A A . 36 CYS N 1 1 10 6218 1 1 36 CYS O O -3.868 -3.384 2.873 1.00 . A A . 36 CYS O 1 1 10 6219 1 1 36 CYS SG S -0.242 -0.439 2.208 1.00 . A A . 36 CYS SG 1 1 10 6220 1 1 37 PRO C C -4.284 -5.362 0.338 1.00 . A A . 37 PRO C 1 1 10 6221 1 1 37 PRO CA C -5.164 -4.138 0.539 1.00 . A A . 37 PRO CA 1 1 10 6222 1 1 37 PRO CB C -5.964 -3.816 -0.718 1.00 . A A . 37 PRO CB 1 1 10 6223 1 1 37 PRO CD C -4.276 -2.128 -0.502 1.00 . A A . 37 PRO CD 1 1 10 6224 1 1 37 PRO CG C -5.065 -2.929 -1.506 1.00 . A A . 37 PRO CG 1 1 10 6225 1 1 37 PRO HA H -5.832 -4.301 1.372 1.00 . A A . 37 PRO HA 1 1 10 6226 1 1 37 PRO HB2 H -6.195 -4.729 -1.246 1.00 . A A . 37 PRO HB2 1 1 10 6227 1 1 37 PRO HB3 H -6.887 -3.303 -0.444 1.00 . A A . 37 PRO HB3 1 1 10 6228 1 1 37 PRO HD2 H -3.252 -2.017 -0.829 1.00 . A A . 37 PRO HD2 1 1 10 6229 1 1 37 PRO HD3 H -4.730 -1.160 -0.354 1.00 . A A . 37 PRO HD3 1 1 10 6230 1 1 37 PRO HG2 H -4.400 -3.527 -2.112 1.00 . A A . 37 PRO HG2 1 1 10 6231 1 1 37 PRO HG3 H -5.652 -2.272 -2.130 1.00 . A A . 37 PRO HG3 1 1 10 6232 1 1 37 PRO N N -4.352 -2.936 0.728 1.00 . A A . 37 PRO N 1 1 10 6233 1 1 37 PRO O O -4.694 -6.493 0.595 1.00 . A A . 37 PRO O 1 1 10 6234 1 1 38 ARG C C -1.338 -6.205 1.412 1.00 . A A . 38 ARG C 1 1 10 6235 1 1 38 ARG CA C -1.995 -6.121 0.045 1.00 . A A . 38 ARG CA 1 1 10 6236 1 1 38 ARG CB C -0.961 -5.788 -1.030 1.00 . A A . 38 ARG CB 1 1 10 6237 1 1 38 ARG CD C -2.146 -5.410 -3.168 1.00 . A A . 38 ARG CD 1 1 10 6238 1 1 38 ARG CG C -1.281 -6.368 -2.390 1.00 . A A . 38 ARG CG 1 1 10 6239 1 1 38 ARG CZ C -4.450 -5.314 -4.069 1.00 . A A . 38 ARG CZ 1 1 10 6240 1 1 38 ARG H H -2.730 -4.155 0.072 1.00 . A A . 38 ARG H 1 1 10 6241 1 1 38 ARG HA H -2.469 -7.063 -0.186 1.00 . A A . 38 ARG HA 1 1 10 6242 1 1 38 ARG HB2 H -0.903 -4.715 -1.132 1.00 . A A . 38 ARG HB2 1 1 10 6243 1 1 38 ARG HB3 H -0.006 -6.157 -0.722 1.00 . A A . 38 ARG HB3 1 1 10 6244 1 1 38 ARG HD2 H -2.204 -4.492 -2.605 1.00 . A A . 38 ARG HD2 1 1 10 6245 1 1 38 ARG HD3 H -1.686 -5.219 -4.125 1.00 . A A . 38 ARG HD3 1 1 10 6246 1 1 38 ARG HE H -3.699 -6.819 -2.978 1.00 . A A . 38 ARG HE 1 1 10 6247 1 1 38 ARG HG2 H -0.361 -6.535 -2.932 1.00 . A A . 38 ARG HG2 1 1 10 6248 1 1 38 ARG HG3 H -1.808 -7.303 -2.264 1.00 . A A . 38 ARG HG3 1 1 10 6249 1 1 38 ARG HH11 H -3.326 -3.669 -4.516 1.00 . A A . 38 ARG HH11 1 1 10 6250 1 1 38 ARG HH12 H -4.956 -3.662 -5.135 1.00 . A A . 38 ARG HH12 1 1 10 6251 1 1 38 ARG HH21 H -5.830 -6.781 -3.796 1.00 . A A . 38 ARG HH21 1 1 10 6252 1 1 38 ARG HH22 H -6.358 -5.421 -4.739 1.00 . A A . 38 ARG HH22 1 1 10 6253 1 1 38 ARG N N -3.014 -5.093 0.086 1.00 . A A . 38 ARG N 1 1 10 6254 1 1 38 ARG NE N -3.495 -5.937 -3.377 1.00 . A A . 38 ARG NE 1 1 10 6255 1 1 38 ARG NH1 N -4.226 -4.123 -4.617 1.00 . A A . 38 ARG NH1 1 1 10 6256 1 1 38 ARG NH2 N -5.641 -5.883 -4.212 1.00 . A A . 38 ARG NH2 1 1 10 6257 1 1 38 ARG O O -0.112 -6.242 1.533 1.00 . A A . 38 ARG O 1 1 10 6258 1 1 39 ALA C C -0.811 -7.172 4.167 1.00 . A A . 39 ALA C 1 1 10 6259 1 1 39 ALA CA C -1.738 -6.020 3.818 1.00 . A A . 39 ALA CA 1 1 10 6260 1 1 39 ALA CB C -2.937 -6.008 4.749 1.00 . A A . 39 ALA CB 1 1 10 6261 1 1 39 ALA H H -3.133 -5.951 2.240 1.00 . A A . 39 ALA H 1 1 10 6262 1 1 39 ALA HA H -1.205 -5.089 3.952 1.00 . A A . 39 ALA HA 1 1 10 6263 1 1 39 ALA HB1 H -3.582 -5.181 4.493 1.00 . A A . 39 ALA HB1 1 1 10 6264 1 1 39 ALA HB2 H -3.481 -6.935 4.648 1.00 . A A . 39 ALA HB2 1 1 10 6265 1 1 39 ALA HB3 H -2.599 -5.899 5.770 1.00 . A A . 39 ALA HB3 1 1 10 6266 1 1 39 ALA N N -2.181 -6.083 2.434 1.00 . A A . 39 ALA N 1 1 10 6267 1 1 39 ALA O O -0.960 -8.286 3.658 1.00 . A A . 39 ALA O 1 1 10 6268 1 1 40 LYS C C 0.567 -9.110 5.949 1.00 . A A . 40 LYS C 1 1 10 6269 1 1 40 LYS CA C 1.192 -7.821 5.414 1.00 . A A . 40 LYS CA 1 1 10 6270 1 1 40 LYS CB C 2.086 -7.179 6.480 1.00 . A A . 40 LYS CB 1 1 10 6271 1 1 40 LYS CD C 3.411 -5.124 7.104 1.00 . A A . 40 LYS CD 1 1 10 6272 1 1 40 LYS CE C 4.139 -4.042 6.321 1.00 . A A . 40 LYS CE 1 1 10 6273 1 1 40 LYS CG C 2.220 -5.664 6.331 1.00 . A A . 40 LYS CG 1 1 10 6274 1 1 40 LYS H H 0.245 -5.942 5.312 1.00 . A A . 40 LYS H 1 1 10 6275 1 1 40 LYS HA H 1.797 -8.058 4.550 1.00 . A A . 40 LYS HA 1 1 10 6276 1 1 40 LYS HB2 H 1.671 -7.388 7.456 1.00 . A A . 40 LYS HB2 1 1 10 6277 1 1 40 LYS HB3 H 3.071 -7.614 6.417 1.00 . A A . 40 LYS HB3 1 1 10 6278 1 1 40 LYS HD2 H 3.063 -4.706 8.035 1.00 . A A . 40 LYS HD2 1 1 10 6279 1 1 40 LYS HD3 H 4.097 -5.934 7.304 1.00 . A A . 40 LYS HD3 1 1 10 6280 1 1 40 LYS HE2 H 5.126 -3.914 6.741 1.00 . A A . 40 LYS HE2 1 1 10 6281 1 1 40 LYS HE3 H 4.226 -4.357 5.290 1.00 . A A . 40 LYS HE3 1 1 10 6282 1 1 40 LYS HG2 H 2.349 -5.427 5.285 1.00 . A A . 40 LYS HG2 1 1 10 6283 1 1 40 LYS HG3 H 1.317 -5.189 6.698 1.00 . A A . 40 LYS HG3 1 1 10 6284 1 1 40 LYS HZ1 H 3.963 -2.008 5.861 1.00 . A A . 40 LYS HZ1 1 1 10 6285 1 1 40 LYS HZ2 H 3.297 -2.432 7.362 1.00 . A A . 40 LYS HZ2 1 1 10 6286 1 1 40 LYS HZ3 H 2.481 -2.830 5.930 1.00 . A A . 40 LYS HZ3 1 1 10 6287 1 1 40 LYS N N 0.174 -6.865 4.999 1.00 . A A . 40 LYS N 1 1 10 6288 1 1 40 LYS NZ N 3.420 -2.740 6.371 1.00 . A A . 40 LYS NZ 1 1 10 6289 1 1 40 LYS O O 0.937 -10.209 5.530 1.00 . A A . 40 LYS O 1 1 10 6290 1 1 41 LYS C C -2.502 -9.678 7.904 1.00 . A A . 41 LYS C 1 1 10 6291 1 1 41 LYS CA C -1.152 -10.116 7.342 1.00 . A A . 41 LYS CA 1 1 10 6292 1 1 41 LYS CB C -0.319 -10.821 8.417 1.00 . A A . 41 LYS CB 1 1 10 6293 1 1 41 LYS CD C -0.719 -13.242 8.959 1.00 . A A . 41 LYS CD 1 1 10 6294 1 1 41 LYS CE C 0.216 -14.291 9.540 1.00 . A A . 41 LYS CE 1 1 10 6295 1 1 41 LYS CG C 0.027 -12.261 8.070 1.00 . A A . 41 LYS CG 1 1 10 6296 1 1 41 LYS H H -0.725 -8.064 7.059 1.00 . A A . 41 LYS H 1 1 10 6297 1 1 41 LYS HA H -1.323 -10.802 6.525 1.00 . A A . 41 LYS HA 1 1 10 6298 1 1 41 LYS HB2 H 0.602 -10.274 8.556 1.00 . A A . 41 LYS HB2 1 1 10 6299 1 1 41 LYS HB3 H -0.872 -10.819 9.344 1.00 . A A . 41 LYS HB3 1 1 10 6300 1 1 41 LYS HD2 H -1.181 -12.697 9.769 1.00 . A A . 41 LYS HD2 1 1 10 6301 1 1 41 LYS HD3 H -1.481 -13.735 8.376 1.00 . A A . 41 LYS HD3 1 1 10 6302 1 1 41 LYS HE2 H -0.335 -15.210 9.676 1.00 . A A . 41 LYS HE2 1 1 10 6303 1 1 41 LYS HE3 H 1.027 -14.457 8.845 1.00 . A A . 41 LYS HE3 1 1 10 6304 1 1 41 LYS HG2 H -0.241 -12.447 7.040 1.00 . A A . 41 LYS HG2 1 1 10 6305 1 1 41 LYS HG3 H 1.089 -12.408 8.199 1.00 . A A . 41 LYS HG3 1 1 10 6306 1 1 41 LYS HZ1 H 0.575 -12.856 11.018 1.00 . A A . 41 LYS HZ1 1 1 10 6307 1 1 41 LYS HZ2 H 1.808 -14.006 10.864 1.00 . A A . 41 LYS HZ2 1 1 10 6308 1 1 41 LYS HZ3 H 0.347 -14.425 11.620 1.00 . A A . 41 LYS HZ3 1 1 10 6309 1 1 41 LYS N N -0.430 -8.967 6.812 1.00 . A A . 41 LYS N 1 1 10 6310 1 1 41 LYS NZ N 0.775 -13.867 10.850 1.00 . A A . 41 LYS NZ 1 1 10 6311 1 1 41 LYS O O -3.327 -9.118 7.181 1.00 . A A . 41 LYS O 1 1 10 6312 1 1 42 SER C C -3.869 -7.943 10.143 1.00 . A A . 42 SER C 1 1 10 6313 1 1 42 SER CA C -3.924 -9.445 9.873 1.00 . A A . 42 SER CA 1 1 10 6314 1 1 42 SER CB C -4.096 -10.225 11.178 1.00 . A A . 42 SER CB 1 1 10 6315 1 1 42 SER H H -1.994 -10.293 9.739 1.00 . A A . 42 SER H 1 1 10 6316 1 1 42 SER HA H -4.758 -9.655 9.220 1.00 . A A . 42 SER HA 1 1 10 6317 1 1 42 SER HB2 H -3.724 -9.635 12.004 1.00 . A A . 42 SER HB2 1 1 10 6318 1 1 42 SER HB3 H -5.143 -10.444 11.333 1.00 . A A . 42 SER HB3 1 1 10 6319 1 1 42 SER HG H -3.836 -12.066 10.533 1.00 . A A . 42 SER HG 1 1 10 6320 1 1 42 SER N N -2.702 -9.877 9.204 1.00 . A A . 42 SER N 1 1 10 6321 1 1 42 SER O O -3.800 -7.496 11.290 1.00 . A A . 42 SER O 1 1 10 6322 1 1 42 SER OG O -3.375 -11.447 11.125 1.00 . A A . 42 SER OG 1 1 10 6323 1 1 43 GLY C C -2.254 -5.369 8.478 1.00 . A A . 43 GLY C 1 1 10 6324 1 1 43 GLY CA C -3.532 -5.770 9.176 1.00 . A A . 43 GLY CA 1 1 10 6325 1 1 43 GLY H H -3.694 -7.620 8.189 1.00 . A A . 43 GLY H 1 1 10 6326 1 1 43 GLY HA2 H -4.364 -5.248 8.726 1.00 . A A . 43 GLY HA2 1 1 10 6327 1 1 43 GLY HA3 H -3.464 -5.500 10.218 1.00 . A A . 43 GLY HA3 1 1 10 6328 1 1 43 GLY N N -3.750 -7.188 9.069 1.00 . A A . 43 GLY N 1 1 10 6329 1 1 43 GLY O O -1.566 -6.215 7.900 1.00 . A A . 43 GLY O 1 1 10 6330 1 1 44 LEU C C 0.320 -3.242 8.875 1.00 . A A . 44 LEU C 1 1 10 6331 1 1 44 LEU CA C -0.749 -3.586 7.852 1.00 . A A . 44 LEU CA 1 1 10 6332 1 1 44 LEU CB C -1.087 -2.360 7.012 1.00 . A A . 44 LEU CB 1 1 10 6333 1 1 44 LEU CD1 C -2.326 -0.351 7.850 1.00 . A A . 44 LEU CD1 1 1 10 6334 1 1 44 LEU CD2 C -3.286 -1.719 5.992 1.00 . A A . 44 LEU CD2 1 1 10 6335 1 1 44 LEU CG C -2.465 -1.750 7.271 1.00 . A A . 44 LEU CG 1 1 10 6336 1 1 44 LEU H H -2.534 -3.457 8.976 1.00 . A A . 44 LEU H 1 1 10 6337 1 1 44 LEU HA H -0.376 -4.364 7.204 1.00 . A A . 44 LEU HA 1 1 10 6338 1 1 44 LEU HB2 H -0.340 -1.603 7.203 1.00 . A A . 44 LEU HB2 1 1 10 6339 1 1 44 LEU HB3 H -1.030 -2.642 5.971 1.00 . A A . 44 LEU HB3 1 1 10 6340 1 1 44 LEU HD11 H -1.819 0.283 7.137 1.00 . A A . 44 LEU HD11 1 1 10 6341 1 1 44 LEU HD12 H -3.305 0.052 8.058 1.00 . A A . 44 LEU HD12 1 1 10 6342 1 1 44 LEU HD13 H -1.752 -0.395 8.764 1.00 . A A . 44 LEU HD13 1 1 10 6343 1 1 44 LEU HD21 H -4.095 -1.011 6.103 1.00 . A A . 44 LEU HD21 1 1 10 6344 1 1 44 LEU HD22 H -2.657 -1.421 5.168 1.00 . A A . 44 LEU HD22 1 1 10 6345 1 1 44 LEU HD23 H -3.691 -2.702 5.799 1.00 . A A . 44 LEU HD23 1 1 10 6346 1 1 44 LEU HG H -2.989 -2.360 7.993 1.00 . A A . 44 LEU HG 1 1 10 6347 1 1 44 LEU N N -1.941 -4.088 8.510 1.00 . A A . 44 LEU N 1 1 10 6348 1 1 44 LEU O O 1.472 -2.997 8.525 1.00 . A A . 44 LEU O 1 1 10 6349 1 1 45 ARG C C 0.631 -3.961 12.369 1.00 . A A . 45 ARG C 1 1 10 6350 1 1 45 ARG CA C 0.865 -2.988 11.225 1.00 . A A . 45 ARG CA 1 1 10 6351 1 1 45 ARG CB C 0.701 -1.545 11.708 1.00 . A A . 45 ARG CB 1 1 10 6352 1 1 45 ARG CD C 2.250 -0.236 13.193 1.00 . A A . 45 ARG CD 1 1 10 6353 1 1 45 ARG CG C 2.009 -0.777 11.791 1.00 . A A . 45 ARG CG 1 1 10 6354 1 1 45 ARG CZ C 1.379 -1.268 15.262 1.00 . A A . 45 ARG CZ 1 1 10 6355 1 1 45 ARG H H -0.987 -3.506 10.357 1.00 . A A . 45 ARG H 1 1 10 6356 1 1 45 ARG HA H 1.869 -3.123 10.848 1.00 . A A . 45 ARG HA 1 1 10 6357 1 1 45 ARG HB2 H 0.043 -1.023 11.029 1.00 . A A . 45 ARG HB2 1 1 10 6358 1 1 45 ARG HB3 H 0.252 -1.556 12.691 1.00 . A A . 45 ARG HB3 1 1 10 6359 1 1 45 ARG HD2 H 3.225 0.230 13.225 1.00 . A A . 45 ARG HD2 1 1 10 6360 1 1 45 ARG HD3 H 1.492 0.503 13.413 1.00 . A A . 45 ARG HD3 1 1 10 6361 1 1 45 ARG HE H 2.787 -2.072 14.075 1.00 . A A . 45 ARG HE 1 1 10 6362 1 1 45 ARG HG2 H 2.822 -1.439 11.527 1.00 . A A . 45 ARG HG2 1 1 10 6363 1 1 45 ARG HG3 H 1.977 0.049 11.098 1.00 . A A . 45 ARG HG3 1 1 10 6364 1 1 45 ARG HH11 H 0.606 0.570 14.863 1.00 . A A . 45 ARG HH11 1 1 10 6365 1 1 45 ARG HH12 H -0.026 -0.214 16.283 1.00 . A A . 45 ARG HH12 1 1 10 6366 1 1 45 ARG HH21 H 1.954 -3.095 15.940 1.00 . A A . 45 ARG HH21 1 1 10 6367 1 1 45 ARG HH22 H 0.746 -2.289 16.901 1.00 . A A . 45 ARG HH22 1 1 10 6368 1 1 45 ARG N N -0.061 -3.267 10.141 1.00 . A A . 45 ARG N 1 1 10 6369 1 1 45 ARG NE N 2.192 -1.289 14.205 1.00 . A A . 45 ARG NE 1 1 10 6370 1 1 45 ARG NH1 N 0.592 -0.220 15.487 1.00 . A A . 45 ARG NH1 1 1 10 6371 1 1 45 ARG NH2 N 1.357 -2.296 16.101 1.00 . A A . 45 ARG NH2 1 1 10 6372 1 1 45 ARG O O -0.126 -3.676 13.296 1.00 . A A . 45 ARG O 1 1 10 6373 1 1 46 VAL C C 2.414 -6.689 13.735 1.00 . A A . 46 VAL C 1 1 10 6374 1 1 46 VAL CA C 1.060 -6.169 13.277 1.00 . A A . 46 VAL CA 1 1 10 6375 1 1 46 VAL CB C 0.201 -7.348 12.772 1.00 . A A . 46 VAL CB 1 1 10 6376 1 1 46 VAL CG1 C -1.230 -7.200 13.259 1.00 . A A . 46 VAL CG1 1 1 10 6377 1 1 46 VAL CG2 C 0.247 -7.455 11.254 1.00 . A A . 46 VAL CG2 1 1 10 6378 1 1 46 VAL H H 1.798 -5.322 11.485 1.00 . A A . 46 VAL H 1 1 10 6379 1 1 46 VAL HA H 0.555 -5.721 14.122 1.00 . A A . 46 VAL HA 1 1 10 6380 1 1 46 VAL HB H 0.602 -8.262 13.188 1.00 . A A . 46 VAL HB 1 1 10 6381 1 1 46 VAL HG11 H -1.309 -6.311 13.867 1.00 . A A . 46 VAL HG11 1 1 10 6382 1 1 46 VAL HG12 H -1.894 -7.117 12.412 1.00 . A A . 46 VAL HG12 1 1 10 6383 1 1 46 VAL HG13 H -1.500 -8.064 13.847 1.00 . A A . 46 VAL HG13 1 1 10 6384 1 1 46 VAL HG21 H -0.682 -7.094 10.838 1.00 . A A . 46 VAL HG21 1 1 10 6385 1 1 46 VAL HG22 H 1.067 -6.861 10.877 1.00 . A A . 46 VAL HG22 1 1 10 6386 1 1 46 VAL HG23 H 0.392 -8.487 10.970 1.00 . A A . 46 VAL HG23 1 1 10 6387 1 1 46 VAL N N 1.229 -5.138 12.266 1.00 . A A . 46 VAL N 1 1 10 6388 1 1 46 VAL O O 3.419 -5.975 13.529 1.00 . A A . 46 VAL O 1 1 10 6389 1 1 46 VAL OXT O 2.477 -7.800 14.300 1.00 . A A . 46 VAL OXT 1 1 10 6390 2 2 1 ZN ZN ZN -0.112 -0.116 -0.054 1.00 . B A . 47 ZN ZN 1 1 11 6391 1 1 1 GLY C C 5.931 15.933 -2.797 1.00 . A A . 1 GLY C 1 1 11 6392 1 1 1 GLY CA C 7.278 16.238 -2.176 1.00 . A A . 1 GLY CA 1 1 11 6393 1 1 1 GLY H1 H 7.494 17.705 -0.708 1.00 . A A . 1 GLY H1 1 1 11 6394 1 1 1 GLY H2 H 7.709 16.123 -0.137 1.00 . A A . 1 GLY H2 1 1 11 6395 1 1 1 GLY H3 H 6.153 16.697 -0.482 1.00 . A A . 1 GLY H3 1 1 11 6396 1 1 1 GLY HA2 H 7.773 16.993 -2.767 1.00 . A A . 1 GLY HA2 1 1 11 6397 1 1 1 GLY HA3 H 7.876 15.339 -2.181 1.00 . A A . 1 GLY HA3 1 1 11 6398 1 1 1 GLY N N 7.151 16.724 -0.781 1.00 . A A . 1 GLY N 1 1 11 6399 1 1 1 GLY O O 4.888 16.220 -2.203 1.00 . A A . 1 GLY O 1 1 11 6400 1 1 2 SER C C 4.014 13.847 -4.111 1.00 . A A . 2 SER C 1 1 11 6401 1 1 2 SER CA C 4.720 15.055 -4.720 1.00 . A A . 2 SER CA 1 1 11 6402 1 1 2 SER CB C 5.036 14.793 -6.192 1.00 . A A . 2 SER CB 1 1 11 6403 1 1 2 SER H H 6.814 15.183 -4.429 1.00 . A A . 2 SER H 1 1 11 6404 1 1 2 SER HA H 4.067 15.913 -4.649 1.00 . A A . 2 SER HA 1 1 11 6405 1 1 2 SER HB2 H 5.327 13.760 -6.319 1.00 . A A . 2 SER HB2 1 1 11 6406 1 1 2 SER HB3 H 4.160 14.996 -6.789 1.00 . A A . 2 SER HB3 1 1 11 6407 1 1 2 SER HG H 5.737 16.504 -6.851 1.00 . A A . 2 SER HG 1 1 11 6408 1 1 2 SER N N 5.949 15.369 -3.999 1.00 . A A . 2 SER N 1 1 11 6409 1 1 2 SER O O 2.784 13.804 -4.048 1.00 . A A . 2 SER O 1 1 11 6410 1 1 2 SER OG O 6.094 15.627 -6.637 1.00 . A A . 2 SER OG 1 1 11 6411 1 1 3 MET C C 3.350 10.908 -4.058 1.00 . A A . 3 MET C 1 1 11 6412 1 1 3 MET CA C 4.275 11.634 -3.079 1.00 . A A . 3 MET CA 1 1 11 6413 1 1 3 MET CB C 3.536 11.943 -1.775 1.00 . A A . 3 MET CB 1 1 11 6414 1 1 3 MET CE C 3.719 8.419 -1.185 1.00 . A A . 3 MET CE 1 1 11 6415 1 1 3 MET CG C 3.994 11.103 -0.594 1.00 . A A . 3 MET CG 1 1 11 6416 1 1 3 MET H H 5.778 12.965 -3.758 1.00 . A A . 3 MET H 1 1 11 6417 1 1 3 MET HA H 5.114 10.992 -2.860 1.00 . A A . 3 MET HA 1 1 11 6418 1 1 3 MET HB2 H 3.690 12.983 -1.527 1.00 . A A . 3 MET HB2 1 1 11 6419 1 1 3 MET HB3 H 2.479 11.772 -1.922 1.00 . A A . 3 MET HB3 1 1 11 6420 1 1 3 MET HE1 H 3.314 8.375 -2.185 1.00 . A A . 3 MET HE1 1 1 11 6421 1 1 3 MET HE2 H 4.777 8.629 -1.233 1.00 . A A . 3 MET HE2 1 1 11 6422 1 1 3 MET HE3 H 3.563 7.471 -0.690 1.00 . A A . 3 MET HE3 1 1 11 6423 1 1 3 MET HG2 H 4.982 10.719 -0.805 1.00 . A A . 3 MET HG2 1 1 11 6424 1 1 3 MET HG3 H 4.034 11.732 0.283 1.00 . A A . 3 MET HG3 1 1 11 6425 1 1 3 MET N N 4.803 12.863 -3.674 1.00 . A A . 3 MET N 1 1 11 6426 1 1 3 MET O O 2.321 10.352 -3.660 1.00 . A A . 3 MET O 1 1 11 6427 1 1 3 MET SD S 2.896 9.714 -0.262 1.00 . A A . 3 MET SD 1 1 11 6428 1 1 4 ALA C C 3.603 10.456 -7.757 1.00 . A A . 4 ALA C 1 1 11 6429 1 1 4 ALA CA C 2.927 10.310 -6.397 1.00 . A A . 4 ALA CA 1 1 11 6430 1 1 4 ALA CB C 1.523 10.905 -6.459 1.00 . A A . 4 ALA CB 1 1 11 6431 1 1 4 ALA H H 4.545 11.414 -5.576 1.00 . A A . 4 ALA H 1 1 11 6432 1 1 4 ALA HA H 2.837 9.260 -6.161 1.00 . A A . 4 ALA HA 1 1 11 6433 1 1 4 ALA HB1 H 1.283 11.157 -7.483 1.00 . A A . 4 ALA HB1 1 1 11 6434 1 1 4 ALA HB2 H 0.809 10.184 -6.090 1.00 . A A . 4 ALA HB2 1 1 11 6435 1 1 4 ALA HB3 H 1.481 11.796 -5.850 1.00 . A A . 4 ALA HB3 1 1 11 6436 1 1 4 ALA N N 3.717 10.944 -5.338 1.00 . A A . 4 ALA N 1 1 11 6437 1 1 4 ALA O O 3.066 10.013 -8.775 1.00 . A A . 4 ALA O 1 1 11 6438 1 1 5 ALA C C 6.311 10.158 -9.446 1.00 . A A . 5 ALA C 1 1 11 6439 1 1 5 ALA CA C 5.474 11.363 -9.026 1.00 . A A . 5 ALA CA 1 1 11 6440 1 1 5 ALA CB C 6.355 12.593 -8.873 1.00 . A A . 5 ALA CB 1 1 11 6441 1 1 5 ALA H H 5.141 11.439 -6.941 1.00 . A A . 5 ALA H 1 1 11 6442 1 1 5 ALA HA H 4.743 11.568 -9.795 1.00 . A A . 5 ALA HA 1 1 11 6443 1 1 5 ALA HB1 H 6.180 13.043 -7.905 1.00 . A A . 5 ALA HB1 1 1 11 6444 1 1 5 ALA HB2 H 7.392 12.304 -8.953 1.00 . A A . 5 ALA HB2 1 1 11 6445 1 1 5 ALA HB3 H 6.117 13.305 -9.649 1.00 . A A . 5 ALA HB3 1 1 11 6446 1 1 5 ALA N N 4.760 11.108 -7.780 1.00 . A A . 5 ALA N 1 1 11 6447 1 1 5 ALA O O 6.208 9.083 -8.856 1.00 . A A . 5 ALA O 1 1 11 6448 1 1 6 HIS C C 9.266 9.151 -9.994 1.00 . A A . 6 HIS C 1 1 11 6449 1 1 6 HIS CA C 8.052 9.282 -10.910 1.00 . A A . 6 HIS CA 1 1 11 6450 1 1 6 HIS CB C 8.502 9.549 -12.350 1.00 . A A . 6 HIS CB 1 1 11 6451 1 1 6 HIS CD2 C 8.161 7.104 -13.144 1.00 . A A . 6 HIS CD2 1 1 11 6452 1 1 6 HIS CE1 C 9.831 6.991 -14.556 1.00 . A A . 6 HIS CE1 1 1 11 6453 1 1 6 HIS CG C 8.790 8.302 -13.128 1.00 . A A . 6 HIS CG 1 1 11 6454 1 1 6 HIS H H 7.228 11.235 -10.861 1.00 . A A . 6 HIS H 1 1 11 6455 1 1 6 HIS HA H 7.496 8.355 -10.881 1.00 . A A . 6 HIS HA 1 1 11 6456 1 1 6 HIS HB2 H 7.726 10.091 -12.870 1.00 . A A . 6 HIS HB2 1 1 11 6457 1 1 6 HIS HB3 H 9.402 10.147 -12.334 1.00 . A A . 6 HIS HB3 1 1 11 6458 1 1 6 HIS HD1 H 10.488 8.905 -14.225 1.00 . A A . 6 HIS HD1 1 1 11 6459 1 1 6 HIS HD2 H 7.295 6.828 -12.559 1.00 . A A . 6 HIS HD2 1 1 11 6460 1 1 6 HIS HE1 H 10.534 6.625 -15.290 1.00 . A A . 6 HIS HE1 1 1 11 6461 1 1 6 HIS HE2 H 8.504 5.434 -14.376 1.00 . A A . 6 HIS HE2 1 1 11 6462 1 1 6 HIS N N 7.170 10.348 -10.442 1.00 . A A . 6 HIS N 1 1 11 6463 1 1 6 HIS ND1 N 9.831 8.197 -14.021 1.00 . A A . 6 HIS ND1 1 1 11 6464 1 1 6 HIS NE2 N 8.828 6.307 -14.040 1.00 . A A . 6 HIS NE2 1 1 11 6465 1 1 6 HIS O O 10.411 9.245 -10.434 1.00 . A A . 6 HIS O 1 1 11 6466 1 1 7 SER C C 10.124 7.431 -7.174 1.00 . A A . 7 SER C 1 1 11 6467 1 1 7 SER CA C 10.042 8.860 -7.713 1.00 . A A . 7 SER CA 1 1 11 6468 1 1 7 SER CB C 9.752 9.853 -6.586 1.00 . A A . 7 SER CB 1 1 11 6469 1 1 7 SER H H 8.059 8.923 -8.428 1.00 . A A . 7 SER H 1 1 11 6470 1 1 7 SER HA H 10.981 9.116 -8.179 1.00 . A A . 7 SER HA 1 1 11 6471 1 1 7 SER HB2 H 9.329 9.327 -5.742 1.00 . A A . 7 SER HB2 1 1 11 6472 1 1 7 SER HB3 H 10.669 10.337 -6.287 1.00 . A A . 7 SER HB3 1 1 11 6473 1 1 7 SER HG H 9.223 11.337 -7.760 1.00 . A A . 7 SER HG 1 1 11 6474 1 1 7 SER N N 8.998 8.965 -8.715 1.00 . A A . 7 SER N 1 1 11 6475 1 1 7 SER O O 9.568 6.508 -7.769 1.00 . A A . 7 SER O 1 1 11 6476 1 1 7 SER OG O 8.832 10.844 -7.019 1.00 . A A . 7 SER OG 1 1 11 6477 1 1 8 ALA C C 9.860 5.740 -4.366 1.00 . A A . 8 ALA C 1 1 11 6478 1 1 8 ALA CA C 10.928 5.935 -5.434 1.00 . A A . 8 ALA CA 1 1 11 6479 1 1 8 ALA CB C 12.317 5.766 -4.841 1.00 . A A . 8 ALA CB 1 1 11 6480 1 1 8 ALA H H 11.208 8.027 -5.599 1.00 . A A . 8 ALA H 1 1 11 6481 1 1 8 ALA HA H 10.795 5.189 -6.206 1.00 . A A . 8 ALA HA 1 1 11 6482 1 1 8 ALA HB1 H 12.476 6.518 -4.081 1.00 . A A . 8 ALA HB1 1 1 11 6483 1 1 8 ALA HB2 H 12.403 4.785 -4.399 1.00 . A A . 8 ALA HB2 1 1 11 6484 1 1 8 ALA HB3 H 13.057 5.879 -5.619 1.00 . A A . 8 ALA HB3 1 1 11 6485 1 1 8 ALA N N 10.801 7.250 -6.048 1.00 . A A . 8 ALA N 1 1 11 6486 1 1 8 ALA O O 9.751 4.674 -3.758 1.00 . A A . 8 ALA O 1 1 11 6487 1 1 9 ASP C C 6.741 7.369 -3.794 1.00 . A A . 9 ASP C 1 1 11 6488 1 1 9 ASP CA C 7.989 6.753 -3.184 1.00 . A A . 9 ASP CA 1 1 11 6489 1 1 9 ASP CB C 8.390 7.501 -1.913 1.00 . A A . 9 ASP CB 1 1 11 6490 1 1 9 ASP CG C 7.683 6.980 -0.675 1.00 . A A . 9 ASP CG 1 1 11 6491 1 1 9 ASP H H 9.219 7.598 -4.678 1.00 . A A . 9 ASP H 1 1 11 6492 1 1 9 ASP HA H 7.779 5.717 -2.940 1.00 . A A . 9 ASP HA 1 1 11 6493 1 1 9 ASP HB2 H 9.455 7.398 -1.762 1.00 . A A . 9 ASP HB2 1 1 11 6494 1 1 9 ASP HB3 H 8.148 8.546 -2.028 1.00 . A A . 9 ASP HB3 1 1 11 6495 1 1 9 ASP N N 9.073 6.782 -4.155 1.00 . A A . 9 ASP N 1 1 11 6496 1 1 9 ASP O O 6.185 8.340 -3.278 1.00 . A A . 9 ASP O 1 1 11 6497 1 1 9 ASP OD1 O 7.954 5.830 -0.267 1.00 . A A . 9 ASP OD1 1 1 11 6498 1 1 9 ASP OD2 O 6.875 7.729 -0.079 1.00 . A A . 9 ASP OD2 1 1 11 6499 1 1 10 LEU C C 3.906 6.428 -4.971 1.00 . A A . 10 LEU C 1 1 11 6500 1 1 10 LEU CA C 5.077 7.196 -5.556 1.00 . A A . 10 LEU CA 1 1 11 6501 1 1 10 LEU CB C 5.168 6.935 -7.060 1.00 . A A . 10 LEU CB 1 1 11 6502 1 1 10 LEU CD1 C 4.141 4.895 -8.100 1.00 . A A . 10 LEU CD1 1 1 11 6503 1 1 10 LEU CD2 C 6.582 5.351 -8.397 1.00 . A A . 10 LEU CD2 1 1 11 6504 1 1 10 LEU CG C 5.393 5.474 -7.457 1.00 . A A . 10 LEU CG 1 1 11 6505 1 1 10 LEU H H 6.784 5.989 -5.231 1.00 . A A . 10 LEU H 1 1 11 6506 1 1 10 LEU HA H 4.936 8.252 -5.378 1.00 . A A . 10 LEU HA 1 1 11 6507 1 1 10 LEU HB2 H 4.250 7.273 -7.517 1.00 . A A . 10 LEU HB2 1 1 11 6508 1 1 10 LEU HB3 H 5.984 7.522 -7.456 1.00 . A A . 10 LEU HB3 1 1 11 6509 1 1 10 LEU HD11 H 4.423 4.160 -8.839 1.00 . A A . 10 LEU HD11 1 1 11 6510 1 1 10 LEU HD12 H 3.528 4.428 -7.342 1.00 . A A . 10 LEU HD12 1 1 11 6511 1 1 10 LEU HD13 H 3.582 5.688 -8.576 1.00 . A A . 10 LEU HD13 1 1 11 6512 1 1 10 LEU HD21 H 7.171 6.256 -8.352 1.00 . A A . 10 LEU HD21 1 1 11 6513 1 1 10 LEU HD22 H 7.191 4.510 -8.101 1.00 . A A . 10 LEU HD22 1 1 11 6514 1 1 10 LEU HD23 H 6.229 5.203 -9.407 1.00 . A A . 10 LEU HD23 1 1 11 6515 1 1 10 LEU HG H 5.608 4.898 -6.568 1.00 . A A . 10 LEU HG 1 1 11 6516 1 1 10 LEU N N 6.300 6.777 -4.890 1.00 . A A . 10 LEU N 1 1 11 6517 1 1 10 LEU O O 2.745 6.837 -5.076 1.00 . A A . 10 LEU O 1 1 11 6518 1 1 11 LYS C C 3.472 4.404 -2.229 1.00 . A A . 11 LYS C 1 1 11 6519 1 1 11 LYS CA C 3.250 4.457 -3.739 1.00 . A A . 11 LYS CA 1 1 11 6520 1 1 11 LYS CB C 3.301 3.064 -4.381 1.00 . A A . 11 LYS CB 1 1 11 6521 1 1 11 LYS CD C 4.363 0.794 -4.245 1.00 . A A . 11 LYS CD 1 1 11 6522 1 1 11 LYS CE C 5.011 0.024 -3.112 1.00 . A A . 11 LYS CE 1 1 11 6523 1 1 11 LYS CG C 4.578 2.287 -4.090 1.00 . A A . 11 LYS CG 1 1 11 6524 1 1 11 LYS H H 5.177 5.054 -4.295 1.00 . A A . 11 LYS H 1 1 11 6525 1 1 11 LYS HA H 2.278 4.889 -3.923 1.00 . A A . 11 LYS HA 1 1 11 6526 1 1 11 LYS HB2 H 2.461 2.484 -4.033 1.00 . A A . 11 LYS HB2 1 1 11 6527 1 1 11 LYS HB3 H 3.219 3.181 -5.451 1.00 . A A . 11 LYS HB3 1 1 11 6528 1 1 11 LYS HD2 H 3.302 0.592 -4.241 1.00 . A A . 11 LYS HD2 1 1 11 6529 1 1 11 LYS HD3 H 4.792 0.472 -5.180 1.00 . A A . 11 LYS HD3 1 1 11 6530 1 1 11 LYS HE2 H 5.127 -1.007 -3.411 1.00 . A A . 11 LYS HE2 1 1 11 6531 1 1 11 LYS HE3 H 5.982 0.452 -2.914 1.00 . A A . 11 LYS HE3 1 1 11 6532 1 1 11 LYS HG2 H 5.346 2.604 -4.780 1.00 . A A . 11 LYS HG2 1 1 11 6533 1 1 11 LYS HG3 H 4.893 2.494 -3.078 1.00 . A A . 11 LYS HG3 1 1 11 6534 1 1 11 LYS HZ1 H 4.302 -0.808 -1.334 1.00 . A A . 11 LYS HZ1 1 1 11 6535 1 1 11 LYS HZ2 H 3.188 0.214 -2.097 1.00 . A A . 11 LYS HZ2 1 1 11 6536 1 1 11 LYS HZ3 H 4.511 0.870 -1.273 1.00 . A A . 11 LYS HZ3 1 1 11 6537 1 1 11 LYS N N 4.233 5.310 -4.350 1.00 . A A . 11 LYS N 1 1 11 6538 1 1 11 LYS NZ N 4.196 0.079 -1.872 1.00 . A A . 11 LYS NZ 1 1 11 6539 1 1 11 LYS O O 4.013 5.336 -1.636 1.00 . A A . 11 LYS O 1 1 11 6540 1 1 12 CYS C C 4.229 2.613 0.370 1.00 . A A . 12 CYS C 1 1 11 6541 1 1 12 CYS CA C 2.943 3.247 -0.168 1.00 . A A . 12 CYS CA 1 1 11 6542 1 1 12 CYS CB C 1.737 2.400 0.193 1.00 . A A . 12 CYS CB 1 1 11 6543 1 1 12 CYS H H 2.502 2.690 -2.136 1.00 . A A . 12 CYS H 1 1 11 6544 1 1 12 CYS HA H 2.824 4.233 0.252 1.00 . A A . 12 CYS HA 1 1 11 6545 1 1 12 CYS HB2 H 1.824 2.065 1.213 1.00 . A A . 12 CYS HB2 1 1 11 6546 1 1 12 CYS HB3 H 0.843 3.000 0.092 1.00 . A A . 12 CYS HB3 1 1 11 6547 1 1 12 CYS N N 2.961 3.365 -1.610 1.00 . A A . 12 CYS N 1 1 11 6548 1 1 12 CYS O O 5.075 2.161 -0.404 1.00 . A A . 12 CYS O 1 1 11 6549 1 1 12 CYS SG S 1.547 0.940 -0.873 1.00 . A A . 12 CYS SG 1 1 11 6550 1 1 13 PRO C C 5.625 0.461 2.207 1.00 . A A . 13 PRO C 1 1 11 6551 1 1 13 PRO CA C 5.575 1.987 2.347 1.00 . A A . 13 PRO CA 1 1 11 6552 1 1 13 PRO CB C 5.417 2.387 3.819 1.00 . A A . 13 PRO CB 1 1 11 6553 1 1 13 PRO CD C 3.469 3.159 2.704 1.00 . A A . 13 PRO CD 1 1 11 6554 1 1 13 PRO CG C 3.958 2.589 4.000 1.00 . A A . 13 PRO CG 1 1 11 6555 1 1 13 PRO HA H 6.487 2.410 1.953 1.00 . A A . 13 PRO HA 1 1 11 6556 1 1 13 PRO HB2 H 5.792 1.597 4.453 1.00 . A A . 13 PRO HB2 1 1 11 6557 1 1 13 PRO HB3 H 5.961 3.298 4.007 1.00 . A A . 13 PRO HB3 1 1 11 6558 1 1 13 PRO HD2 H 2.451 2.850 2.513 1.00 . A A . 13 PRO HD2 1 1 11 6559 1 1 13 PRO HD3 H 3.542 4.235 2.715 1.00 . A A . 13 PRO HD3 1 1 11 6560 1 1 13 PRO HG2 H 3.476 1.643 4.201 1.00 . A A . 13 PRO HG2 1 1 11 6561 1 1 13 PRO HG3 H 3.779 3.284 4.808 1.00 . A A . 13 PRO HG3 1 1 11 6562 1 1 13 PRO N N 4.394 2.577 1.707 1.00 . A A . 13 PRO N 1 1 11 6563 1 1 13 PRO O O 6.706 -0.120 2.110 1.00 . A A . 13 PRO O 1 1 11 6564 1 1 14 THR C C 5.040 -2.205 0.924 1.00 . A A . 14 THR C 1 1 11 6565 1 1 14 THR CA C 4.368 -1.637 2.178 1.00 . A A . 14 THR CA 1 1 11 6566 1 1 14 THR CB C 2.897 -2.085 2.218 1.00 . A A . 14 THR CB 1 1 11 6567 1 1 14 THR CG2 C 2.787 -3.592 2.362 1.00 . A A . 14 THR CG2 1 1 11 6568 1 1 14 THR H H 3.637 0.340 2.353 1.00 . A A . 14 THR H 1 1 11 6569 1 1 14 THR HA H 4.865 -2.040 3.048 1.00 . A A . 14 THR HA 1 1 11 6570 1 1 14 THR HB H 2.421 -1.791 1.293 1.00 . A A . 14 THR HB 1 1 11 6571 1 1 14 THR HG1 H 1.359 -1.112 3.009 1.00 . A A . 14 THR HG1 1 1 11 6572 1 1 14 THR HG21 H 3.496 -4.068 1.699 1.00 . A A . 14 THR HG21 1 1 11 6573 1 1 14 THR HG22 H 1.787 -3.908 2.101 1.00 . A A . 14 THR HG22 1 1 11 6574 1 1 14 THR HG23 H 3.001 -3.874 3.381 1.00 . A A . 14 THR HG23 1 1 11 6575 1 1 14 THR N N 4.461 -0.180 2.241 1.00 . A A . 14 THR N 1 1 11 6576 1 1 14 THR O O 4.701 -1.830 -0.193 1.00 . A A . 14 THR O 1 1 11 6577 1 1 14 THR OG1 O 2.226 -1.445 3.312 1.00 . A A . 14 THR OG1 1 1 11 6578 1 1 15 PRO C C 6.025 -4.514 -0.935 1.00 . A A . 15 PRO C 1 1 11 6579 1 1 15 PRO CA C 6.845 -3.620 -0.003 1.00 . A A . 15 PRO CA 1 1 11 6580 1 1 15 PRO CB C 7.930 -4.443 0.701 1.00 . A A . 15 PRO CB 1 1 11 6581 1 1 15 PRO CD C 6.593 -3.478 2.413 1.00 . A A . 15 PRO CD 1 1 11 6582 1 1 15 PRO CG C 7.995 -3.893 2.080 1.00 . A A . 15 PRO CG 1 1 11 6583 1 1 15 PRO HA H 7.311 -2.838 -0.583 1.00 . A A . 15 PRO HA 1 1 11 6584 1 1 15 PRO HB2 H 7.648 -5.486 0.706 1.00 . A A . 15 PRO HB2 1 1 11 6585 1 1 15 PRO HB3 H 8.870 -4.322 0.186 1.00 . A A . 15 PRO HB3 1 1 11 6586 1 1 15 PRO HD2 H 6.035 -4.312 2.813 1.00 . A A . 15 PRO HD2 1 1 11 6587 1 1 15 PRO HD3 H 6.596 -2.652 3.108 1.00 . A A . 15 PRO HD3 1 1 11 6588 1 1 15 PRO HG2 H 8.336 -4.656 2.762 1.00 . A A . 15 PRO HG2 1 1 11 6589 1 1 15 PRO HG3 H 8.655 -3.039 2.104 1.00 . A A . 15 PRO HG3 1 1 11 6590 1 1 15 PRO N N 6.058 -3.063 1.106 1.00 . A A . 15 PRO N 1 1 11 6591 1 1 15 PRO O O 6.170 -4.444 -2.154 1.00 . A A . 15 PRO O 1 1 11 6592 1 1 16 GLY C C 3.198 -5.713 -1.767 1.00 . A A . 16 GLY C 1 1 11 6593 1 1 16 GLY CA C 4.439 -6.330 -1.152 1.00 . A A . 16 GLY CA 1 1 11 6594 1 1 16 GLY H H 5.161 -5.429 0.619 1.00 . A A . 16 GLY H 1 1 11 6595 1 1 16 GLY HA2 H 5.070 -6.704 -1.941 1.00 . A A . 16 GLY HA2 1 1 11 6596 1 1 16 GLY HA3 H 4.144 -7.157 -0.522 1.00 . A A . 16 GLY HA3 1 1 11 6597 1 1 16 GLY N N 5.205 -5.386 -0.356 1.00 . A A . 16 GLY N 1 1 11 6598 1 1 16 GLY O O 2.619 -6.260 -2.707 1.00 . A A . 16 GLY O 1 1 11 6599 1 1 17 CYS C C 2.109 -2.946 -2.959 1.00 . A A . 17 CYS C 1 1 11 6600 1 1 17 CYS CA C 1.676 -3.827 -1.790 1.00 . A A . 17 CYS CA 1 1 11 6601 1 1 17 CYS CB C 1.065 -2.996 -0.667 1.00 . A A . 17 CYS CB 1 1 11 6602 1 1 17 CYS H H 3.352 -4.146 -0.558 1.00 . A A . 17 CYS H 1 1 11 6603 1 1 17 CYS HA H 0.950 -4.546 -2.140 1.00 . A A . 17 CYS HA 1 1 11 6604 1 1 17 CYS HB2 H 0.870 -3.642 0.175 1.00 . A A . 17 CYS HB2 1 1 11 6605 1 1 17 CYS HB3 H 1.776 -2.239 -0.369 1.00 . A A . 17 CYS HB3 1 1 11 6606 1 1 17 CYS N N 2.819 -4.551 -1.269 1.00 . A A . 17 CYS N 1 1 11 6607 1 1 17 CYS O O 3.284 -2.594 -3.076 1.00 . A A . 17 CYS O 1 1 11 6608 1 1 17 CYS SG S -0.494 -2.158 -1.079 1.00 . A A . 17 CYS SG 1 1 11 6609 1 1 18 ASP C C 1.021 -0.454 -4.945 1.00 . A A . 18 ASP C 1 1 11 6610 1 1 18 ASP CA C 1.510 -1.896 -5.061 1.00 . A A . 18 ASP CA 1 1 11 6611 1 1 18 ASP CB C 0.910 -2.559 -6.303 1.00 . A A . 18 ASP CB 1 1 11 6612 1 1 18 ASP CG C -0.464 -2.028 -6.649 1.00 . A A . 18 ASP CG 1 1 11 6613 1 1 18 ASP H H 0.271 -3.002 -3.739 1.00 . A A . 18 ASP H 1 1 11 6614 1 1 18 ASP HA H 2.585 -1.888 -5.157 1.00 . A A . 18 ASP HA 1 1 11 6615 1 1 18 ASP HB2 H 1.562 -2.385 -7.146 1.00 . A A . 18 ASP HB2 1 1 11 6616 1 1 18 ASP HB3 H 0.830 -3.623 -6.130 1.00 . A A . 18 ASP HB3 1 1 11 6617 1 1 18 ASP N N 1.183 -2.658 -3.860 1.00 . A A . 18 ASP N 1 1 11 6618 1 1 18 ASP O O 1.470 0.425 -5.680 1.00 . A A . 18 ASP O 1 1 11 6619 1 1 18 ASP OD1 O -1.400 -2.197 -5.841 1.00 . A A . 18 ASP OD1 1 1 11 6620 1 1 18 ASP OD2 O -0.614 -1.432 -7.736 1.00 . A A . 18 ASP OD2 1 1 11 6621 1 1 19 GLY C C -1.698 1.418 -4.408 1.00 . A A . 19 GLY C 1 1 11 6622 1 1 19 GLY CA C -0.345 1.148 -3.778 1.00 . A A . 19 GLY CA 1 1 11 6623 1 1 19 GLY H H -0.181 -0.938 -3.419 1.00 . A A . 19 GLY H 1 1 11 6624 1 1 19 GLY HA2 H -0.419 1.321 -2.713 1.00 . A A . 19 GLY HA2 1 1 11 6625 1 1 19 GLY HA3 H 0.375 1.839 -4.191 1.00 . A A . 19 GLY HA3 1 1 11 6626 1 1 19 GLY N N 0.129 -0.204 -3.998 1.00 . A A . 19 GLY N 1 1 11 6627 1 1 19 GLY O O -2.258 2.500 -4.242 1.00 . A A . 19 GLY O 1 1 11 6628 1 1 20 SER C C -4.604 -0.191 -4.850 1.00 . A A . 20 SER C 1 1 11 6629 1 1 20 SER CA C -3.572 0.573 -5.672 1.00 . A A . 20 SER CA 1 1 11 6630 1 1 20 SER CB C -3.567 0.085 -7.120 1.00 . A A . 20 SER CB 1 1 11 6631 1 1 20 SER H H -1.790 -0.438 -5.150 1.00 . A A . 20 SER H 1 1 11 6632 1 1 20 SER HA H -3.828 1.622 -5.656 1.00 . A A . 20 SER HA 1 1 11 6633 1 1 20 SER HB2 H -3.661 -0.991 -7.140 1.00 . A A . 20 SER HB2 1 1 11 6634 1 1 20 SER HB3 H -4.395 0.530 -7.652 1.00 . A A . 20 SER HB3 1 1 11 6635 1 1 20 SER HG H -1.735 -0.301 -7.721 1.00 . A A . 20 SER HG 1 1 11 6636 1 1 20 SER N N -2.253 0.429 -5.084 1.00 . A A . 20 SER N 1 1 11 6637 1 1 20 SER O O -4.267 -1.142 -4.144 1.00 . A A . 20 SER O 1 1 11 6638 1 1 20 SER OG O -2.359 0.449 -7.770 1.00 . A A . 20 SER OG 1 1 11 6639 1 1 21 GLY C C -6.856 0.081 -2.653 1.00 . A A . 21 GLY C 1 1 11 6640 1 1 21 GLY CA C -6.894 -0.337 -4.109 1.00 . A A . 21 GLY CA 1 1 11 6641 1 1 21 GLY H H -6.036 1.071 -5.433 1.00 . A A . 21 GLY H 1 1 11 6642 1 1 21 GLY HA2 H -7.847 -0.055 -4.529 1.00 . A A . 21 GLY HA2 1 1 11 6643 1 1 21 GLY HA3 H -6.789 -1.410 -4.166 1.00 . A A . 21 GLY HA3 1 1 11 6644 1 1 21 GLY N N -5.839 0.277 -4.887 1.00 . A A . 21 GLY N 1 1 11 6645 1 1 21 GLY O O -6.111 0.981 -2.280 1.00 . A A . 21 GLY O 1 1 11 6646 1 1 22 HIS C C -8.122 -1.676 0.303 1.00 . A A . 22 HIS C 1 1 11 6647 1 1 22 HIS CA C -7.684 -0.397 -0.386 1.00 . A A . 22 HIS CA 1 1 11 6648 1 1 22 HIS CB C -8.644 0.734 0.021 1.00 . A A . 22 HIS CB 1 1 11 6649 1 1 22 HIS CD2 C -7.284 2.893 -0.535 1.00 . A A . 22 HIS CD2 1 1 11 6650 1 1 22 HIS CE1 C -7.480 3.883 1.406 1.00 . A A . 22 HIS CE1 1 1 11 6651 1 1 22 HIS CG C -8.005 2.072 0.265 1.00 . A A . 22 HIS CG 1 1 11 6652 1 1 22 HIS H H -8.191 -1.324 -2.218 1.00 . A A . 22 HIS H 1 1 11 6653 1 1 22 HIS HA H -6.686 -0.148 -0.057 1.00 . A A . 22 HIS HA 1 1 11 6654 1 1 22 HIS HB2 H -9.377 0.864 -0.760 1.00 . A A . 22 HIS HB2 1 1 11 6655 1 1 22 HIS HB3 H -9.152 0.443 0.930 1.00 . A A . 22 HIS HB3 1 1 11 6656 1 1 22 HIS HD1 H -8.583 2.395 2.272 1.00 . A A . 22 HIS HD1 1 1 11 6657 1 1 22 HIS HD2 H -7.007 2.704 -1.561 1.00 . A A . 22 HIS HD2 1 1 11 6658 1 1 22 HIS HE1 H -7.405 4.605 2.204 1.00 . A A . 22 HIS HE1 1 1 11 6659 1 1 22 HIS HE2 H -6.651 4.869 -0.180 1.00 . A A . 22 HIS HE2 1 1 11 6660 1 1 22 HIS N N -7.641 -0.603 -1.835 1.00 . A A . 22 HIS N 1 1 11 6661 1 1 22 HIS ND1 N -8.105 2.726 1.474 1.00 . A A . 22 HIS ND1 1 1 11 6662 1 1 22 HIS NE2 N -6.972 4.013 0.199 1.00 . A A . 22 HIS NE2 1 1 11 6663 1 1 22 HIS O O -8.860 -2.470 -0.271 1.00 . A A . 22 HIS O 1 1 11 6664 1 1 23 ILE C C -9.687 -2.876 2.632 1.00 . A A . 23 ILE C 1 1 11 6665 1 1 23 ILE CA C -8.181 -2.961 2.362 1.00 . A A . 23 ILE CA 1 1 11 6666 1 1 23 ILE CB C -7.376 -3.052 3.691 1.00 . A A . 23 ILE CB 1 1 11 6667 1 1 23 ILE CD1 C -7.380 -5.578 3.284 1.00 . A A . 23 ILE CD1 1 1 11 6668 1 1 23 ILE CG1 C -6.599 -4.371 3.759 1.00 . A A . 23 ILE CG1 1 1 11 6669 1 1 23 ILE CG2 C -8.269 -2.903 4.918 1.00 . A A . 23 ILE CG2 1 1 11 6670 1 1 23 ILE H H -7.209 -1.120 1.988 1.00 . A A . 23 ILE H 1 1 11 6671 1 1 23 ILE HA H -7.981 -3.855 1.787 1.00 . A A . 23 ILE HA 1 1 11 6672 1 1 23 ILE HB H -6.669 -2.237 3.701 1.00 . A A . 23 ILE HB 1 1 11 6673 1 1 23 ILE HD11 H -8.381 -5.276 3.009 1.00 . A A . 23 ILE HD11 1 1 11 6674 1 1 23 ILE HD12 H -6.887 -6.012 2.428 1.00 . A A . 23 ILE HD12 1 1 11 6675 1 1 23 ILE HD13 H -7.431 -6.309 4.077 1.00 . A A . 23 ILE HD13 1 1 11 6676 1 1 23 ILE HG12 H -5.717 -4.288 3.144 1.00 . A A . 23 ILE HG12 1 1 11 6677 1 1 23 ILE HG13 H -6.302 -4.550 4.781 1.00 . A A . 23 ILE HG13 1 1 11 6678 1 1 23 ILE HG21 H -9.201 -2.440 4.631 1.00 . A A . 23 ILE HG21 1 1 11 6679 1 1 23 ILE HG22 H -8.465 -3.877 5.340 1.00 . A A . 23 ILE HG22 1 1 11 6680 1 1 23 ILE HG23 H -7.771 -2.285 5.652 1.00 . A A . 23 ILE HG23 1 1 11 6681 1 1 23 ILE N N -7.750 -1.819 1.566 1.00 . A A . 23 ILE N 1 1 11 6682 1 1 23 ILE O O -10.355 -3.884 2.866 1.00 . A A . 23 ILE O 1 1 11 6683 1 1 24 THR C C -12.425 -1.744 1.444 1.00 . A A . 24 THR C 1 1 11 6684 1 1 24 THR CA C -11.642 -1.431 2.725 1.00 . A A . 24 THR CA 1 1 11 6685 1 1 24 THR CB C -11.916 0.028 3.161 1.00 . A A . 24 THR CB 1 1 11 6686 1 1 24 THR CG2 C -11.683 0.994 2.013 1.00 . A A . 24 THR CG2 1 1 11 6687 1 1 24 THR H H -9.634 -0.902 2.340 1.00 . A A . 24 THR H 1 1 11 6688 1 1 24 THR HA H -11.986 -2.084 3.510 1.00 . A A . 24 THR HA 1 1 11 6689 1 1 24 THR HB H -11.235 0.283 3.962 1.00 . A A . 24 THR HB 1 1 11 6690 1 1 24 THR HG1 H -13.587 -0.708 3.925 1.00 . A A . 24 THR HG1 1 1 11 6691 1 1 24 THR HG21 H -12.635 1.313 1.615 1.00 . A A . 24 THR HG21 1 1 11 6692 1 1 24 THR HG22 H -11.116 0.500 1.239 1.00 . A A . 24 THR HG22 1 1 11 6693 1 1 24 THR HG23 H -11.136 1.851 2.371 1.00 . A A . 24 THR HG23 1 1 11 6694 1 1 24 THR N N -10.220 -1.664 2.540 1.00 . A A . 24 THR N 1 1 11 6695 1 1 24 THR O O -13.649 -1.858 1.472 1.00 . A A . 24 THR O 1 1 11 6696 1 1 24 THR OG1 O -13.261 0.161 3.634 1.00 . A A . 24 THR OG1 1 1 11 6697 1 1 25 GLY C C -13.326 -1.197 -1.385 1.00 . A A . 25 GLY C 1 1 11 6698 1 1 25 GLY CA C -12.334 -2.256 -0.935 1.00 . A A . 25 GLY CA 1 1 11 6699 1 1 25 GLY H H -10.724 -1.890 0.392 1.00 . A A . 25 GLY H 1 1 11 6700 1 1 25 GLY HA2 H -11.567 -2.360 -1.689 1.00 . A A . 25 GLY HA2 1 1 11 6701 1 1 25 GLY HA3 H -12.852 -3.198 -0.832 1.00 . A A . 25 GLY HA3 1 1 11 6702 1 1 25 GLY N N -11.702 -1.925 0.335 1.00 . A A . 25 GLY N 1 1 11 6703 1 1 25 GLY O O -14.380 -1.517 -1.935 1.00 . A A . 25 GLY O 1 1 11 6704 1 1 26 ASN C C -13.249 2.267 -2.168 1.00 . A A . 26 ASN C 1 1 11 6705 1 1 26 ASN CA C -13.930 1.161 -1.371 1.00 . A A . 26 ASN CA 1 1 11 6706 1 1 26 ASN CB C -14.464 1.753 -0.063 1.00 . A A . 26 ASN CB 1 1 11 6707 1 1 26 ASN CG C -15.742 1.103 0.407 1.00 . A A . 26 ASN CG 1 1 11 6708 1 1 26 ASN H H -12.192 0.238 -0.597 1.00 . A A . 26 ASN H 1 1 11 6709 1 1 26 ASN HA H -14.757 0.770 -1.943 1.00 . A A . 26 ASN HA 1 1 11 6710 1 1 26 ASN HB2 H -13.722 1.633 0.710 1.00 . A A . 26 ASN HB2 1 1 11 6711 1 1 26 ASN HB3 H -14.656 2.805 -0.204 1.00 . A A . 26 ASN HB3 1 1 11 6712 1 1 26 ASN HD21 H -14.870 0.570 2.108 1.00 . A A . 26 ASN HD21 1 1 11 6713 1 1 26 ASN HD22 H -16.531 0.145 1.943 1.00 . A A . 26 ASN HD22 1 1 11 6714 1 1 26 ASN N N -13.017 0.059 -1.085 1.00 . A A . 26 ASN N 1 1 11 6715 1 1 26 ASN ND2 N -15.709 0.541 1.602 1.00 . A A . 26 ASN ND2 1 1 11 6716 1 1 26 ASN O O -13.848 3.309 -2.420 1.00 . A A . 26 ASN O 1 1 11 6717 1 1 26 ASN OD1 O -16.756 1.114 -0.290 1.00 . A A . 26 ASN OD1 1 1 11 6718 1 1 27 TYR C C -10.557 2.597 -4.426 1.00 . A A . 27 TYR C 1 1 11 6719 1 1 27 TYR CA C -11.210 3.126 -3.153 1.00 . A A . 27 TYR CA 1 1 11 6720 1 1 27 TYR CB C -10.138 3.671 -2.212 1.00 . A A . 27 TYR CB 1 1 11 6721 1 1 27 TYR CD1 C -11.239 3.998 0.044 1.00 . A A . 27 TYR CD1 1 1 11 6722 1 1 27 TYR CD2 C -10.625 5.936 -1.203 1.00 . A A . 27 TYR CD2 1 1 11 6723 1 1 27 TYR CE1 C -11.730 4.799 1.054 1.00 . A A . 27 TYR CE1 1 1 11 6724 1 1 27 TYR CE2 C -11.116 6.743 -0.196 1.00 . A A . 27 TYR CE2 1 1 11 6725 1 1 27 TYR CG C -10.678 4.551 -1.104 1.00 . A A . 27 TYR CG 1 1 11 6726 1 1 27 TYR CZ C -11.667 6.169 0.929 1.00 . A A . 27 TYR CZ 1 1 11 6727 1 1 27 TYR H H -11.521 1.259 -2.216 1.00 . A A . 27 TYR H 1 1 11 6728 1 1 27 TYR HA H -11.888 3.923 -3.414 1.00 . A A . 27 TYR HA 1 1 11 6729 1 1 27 TYR HB2 H -9.619 2.842 -1.754 1.00 . A A . 27 TYR HB2 1 1 11 6730 1 1 27 TYR HB3 H -9.435 4.251 -2.785 1.00 . A A . 27 TYR HB3 1 1 11 6731 1 1 27 TYR HD1 H -11.288 2.921 0.138 1.00 . A A . 27 TYR HD1 1 1 11 6732 1 1 27 TYR HD2 H -10.194 6.383 -2.086 1.00 . A A . 27 TYR HD2 1 1 11 6733 1 1 27 TYR HE1 H -12.163 4.352 1.936 1.00 . A A . 27 TYR HE1 1 1 11 6734 1 1 27 TYR HE2 H -11.069 7.817 -0.292 1.00 . A A . 27 TYR HE2 1 1 11 6735 1 1 27 TYR HH H -12.974 6.588 2.286 1.00 . A A . 27 TYR HH 1 1 11 6736 1 1 27 TYR N N -11.975 2.087 -2.482 1.00 . A A . 27 TYR N 1 1 11 6737 1 1 27 TYR O O -10.757 1.440 -4.810 1.00 . A A . 27 TYR O 1 1 11 6738 1 1 27 TYR OH O -12.153 6.970 1.937 1.00 . A A . 27 TYR OH 1 1 11 6739 1 1 28 ALA C C -7.588 2.890 -6.057 1.00 . A A . 28 ALA C 1 1 11 6740 1 1 28 ALA CA C -9.082 3.070 -6.296 1.00 . A A . 28 ALA CA 1 1 11 6741 1 1 28 ALA CB C -9.323 4.117 -7.372 1.00 . A A . 28 ALA CB 1 1 11 6742 1 1 28 ALA H H -9.637 4.351 -4.706 1.00 . A A . 28 ALA H 1 1 11 6743 1 1 28 ALA HA H -9.497 2.133 -6.638 1.00 . A A . 28 ALA HA 1 1 11 6744 1 1 28 ALA HB1 H -9.976 4.886 -6.985 1.00 . A A . 28 ALA HB1 1 1 11 6745 1 1 28 ALA HB2 H -8.381 4.557 -7.664 1.00 . A A . 28 ALA HB2 1 1 11 6746 1 1 28 ALA HB3 H -9.784 3.652 -8.231 1.00 . A A . 28 ALA HB3 1 1 11 6747 1 1 28 ALA N N -9.766 3.443 -5.067 1.00 . A A . 28 ALA N 1 1 11 6748 1 1 28 ALA O O -6.961 2.016 -6.653 1.00 . A A . 28 ALA O 1 1 11 6749 1 1 29 SER C C -5.262 4.407 -3.599 1.00 . A A . 29 SER C 1 1 11 6750 1 1 29 SER CA C -5.592 3.650 -4.884 1.00 . A A . 29 SER CA 1 1 11 6751 1 1 29 SER CB C -4.777 4.220 -6.051 1.00 . A A . 29 SER CB 1 1 11 6752 1 1 29 SER H H -7.571 4.393 -4.730 1.00 . A A . 29 SER H 1 1 11 6753 1 1 29 SER HA H -5.330 2.614 -4.749 1.00 . A A . 29 SER HA 1 1 11 6754 1 1 29 SER HB2 H -4.024 4.889 -5.664 1.00 . A A . 29 SER HB2 1 1 11 6755 1 1 29 SER HB3 H -4.298 3.410 -6.581 1.00 . A A . 29 SER HB3 1 1 11 6756 1 1 29 SER HG H -5.372 4.676 -7.867 1.00 . A A . 29 SER HG 1 1 11 6757 1 1 29 SER N N -7.021 3.716 -5.182 1.00 . A A . 29 SER N 1 1 11 6758 1 1 29 SER O O -6.124 5.059 -3.009 1.00 . A A . 29 SER O 1 1 11 6759 1 1 29 SER OG O -5.599 4.937 -6.961 1.00 . A A . 29 SER OG 1 1 11 6760 1 1 30 HIS C C -2.044 5.312 -2.129 1.00 . A A . 30 HIS C 1 1 11 6761 1 1 30 HIS CA C -3.532 4.987 -1.976 1.00 . A A . 30 HIS CA 1 1 11 6762 1 1 30 HIS CB C -3.772 4.134 -0.727 1.00 . A A . 30 HIS CB 1 1 11 6763 1 1 30 HIS CD2 C -1.986 2.321 -0.290 1.00 . A A . 30 HIS CD2 1 1 11 6764 1 1 30 HIS CE1 C -2.923 0.639 -1.283 1.00 . A A . 30 HIS CE1 1 1 11 6765 1 1 30 HIS CG C -3.164 2.770 -0.787 1.00 . A A . 30 HIS CG 1 1 11 6766 1 1 30 HIS H H -3.376 3.744 -3.673 1.00 . A A . 30 HIS H 1 1 11 6767 1 1 30 HIS HA H -4.084 5.911 -1.884 1.00 . A A . 30 HIS HA 1 1 11 6768 1 1 30 HIS HB2 H -3.351 4.640 0.123 1.00 . A A . 30 HIS HB2 1 1 11 6769 1 1 30 HIS HB3 H -4.837 4.016 -0.579 1.00 . A A . 30 HIS HB3 1 1 11 6770 1 1 30 HIS HD1 H -4.622 1.676 -1.873 1.00 . A A . 30 HIS HD1 1 1 11 6771 1 1 30 HIS HD2 H -1.265 2.898 0.269 1.00 . A A . 30 HIS HD2 1 1 11 6772 1 1 30 HIS HE1 H -3.111 -0.350 -1.676 1.00 . A A . 30 HIS HE1 1 1 11 6773 1 1 30 HIS N N -4.011 4.301 -3.167 1.00 . A A . 30 HIS N 1 1 11 6774 1 1 30 HIS ND1 N -3.748 1.686 -1.415 1.00 . A A . 30 HIS ND1 1 1 11 6775 1 1 30 HIS NE2 N -1.858 0.986 -0.612 1.00 . A A . 30 HIS NE2 1 1 11 6776 1 1 30 HIS O O -1.492 5.179 -3.221 1.00 . A A . 30 HIS O 1 1 11 6777 1 1 31 ARG C C 0.689 5.881 0.275 1.00 . A A . 31 ARG C 1 1 11 6778 1 1 31 ARG CA C 0.034 6.030 -1.094 1.00 . A A . 31 ARG CA 1 1 11 6779 1 1 31 ARG CB C 0.236 7.456 -1.619 1.00 . A A . 31 ARG CB 1 1 11 6780 1 1 31 ARG CD C -1.202 9.513 -1.721 1.00 . A A . 31 ARG CD 1 1 11 6781 1 1 31 ARG CG C -0.492 8.520 -0.816 1.00 . A A . 31 ARG CG 1 1 11 6782 1 1 31 ARG CZ C -0.459 11.802 -2.273 1.00 . A A . 31 ARG CZ 1 1 11 6783 1 1 31 ARG H H -1.859 5.748 -0.179 1.00 . A A . 31 ARG H 1 1 11 6784 1 1 31 ARG HA H 0.504 5.340 -1.779 1.00 . A A . 31 ARG HA 1 1 11 6785 1 1 31 ARG HB2 H 1.292 7.686 -1.602 1.00 . A A . 31 ARG HB2 1 1 11 6786 1 1 31 ARG HB3 H -0.114 7.506 -2.640 1.00 . A A . 31 ARG HB3 1 1 11 6787 1 1 31 ARG HD2 H -1.690 8.968 -2.515 1.00 . A A . 31 ARG HD2 1 1 11 6788 1 1 31 ARG HD3 H -1.944 10.042 -1.141 1.00 . A A . 31 ARG HD3 1 1 11 6789 1 1 31 ARG HE H 0.514 10.127 -2.779 1.00 . A A . 31 ARG HE 1 1 11 6790 1 1 31 ARG HG2 H -1.221 8.040 -0.180 1.00 . A A . 31 ARG HG2 1 1 11 6791 1 1 31 ARG HG3 H 0.226 9.051 -0.207 1.00 . A A . 31 ARG HG3 1 1 11 6792 1 1 31 ARG HH11 H -2.140 11.719 -1.133 1.00 . A A . 31 ARG HH11 1 1 11 6793 1 1 31 ARG HH12 H -1.630 13.317 -1.594 1.00 . A A . 31 ARG HH12 1 1 11 6794 1 1 31 ARG HH21 H 1.194 12.222 -3.364 1.00 . A A . 31 ARG HH21 1 1 11 6795 1 1 31 ARG HH22 H 0.270 13.603 -2.859 1.00 . A A . 31 ARG HH22 1 1 11 6796 1 1 31 ARG N N -1.388 5.702 -1.040 1.00 . A A . 31 ARG N 1 1 11 6797 1 1 31 ARG NE N -0.279 10.483 -2.313 1.00 . A A . 31 ARG NE 1 1 11 6798 1 1 31 ARG NH1 N -1.490 12.319 -1.614 1.00 . A A . 31 ARG NH1 1 1 11 6799 1 1 31 ARG NH2 N 0.403 12.605 -2.878 1.00 . A A . 31 ARG NH2 1 1 11 6800 1 1 31 ARG O O 1.835 6.278 0.474 1.00 . A A . 31 ARG O 1 1 11 6801 1 1 32 SER C C -0.182 3.837 3.161 1.00 . A A . 32 SER C 1 1 11 6802 1 1 32 SER CA C 0.474 5.075 2.554 1.00 . A A . 32 SER CA 1 1 11 6803 1 1 32 SER CB C 0.218 6.311 3.422 1.00 . A A . 32 SER CB 1 1 11 6804 1 1 32 SER H H -0.939 4.973 0.991 1.00 . A A . 32 SER H 1 1 11 6805 1 1 32 SER HA H 1.538 4.906 2.482 1.00 . A A . 32 SER HA 1 1 11 6806 1 1 32 SER HB2 H -0.336 6.019 4.302 1.00 . A A . 32 SER HB2 1 1 11 6807 1 1 32 SER HB3 H 1.162 6.743 3.719 1.00 . A A . 32 SER HB3 1 1 11 6808 1 1 32 SER HG H -1.269 6.861 2.262 1.00 . A A . 32 SER HG 1 1 11 6809 1 1 32 SER N N -0.040 5.293 1.211 1.00 . A A . 32 SER N 1 1 11 6810 1 1 32 SER O O -1.086 3.258 2.556 1.00 . A A . 32 SER O 1 1 11 6811 1 1 32 SER OG O -0.531 7.291 2.715 1.00 . A A . 32 SER OG 1 1 11 6812 1 1 33 LEU C C -1.648 2.537 5.650 1.00 . A A . 33 LEU C 1 1 11 6813 1 1 33 LEU CA C -0.283 2.264 5.025 1.00 . A A . 33 LEU CA 1 1 11 6814 1 1 33 LEU CB C 0.686 1.803 6.111 1.00 . A A . 33 LEU CB 1 1 11 6815 1 1 33 LEU CD1 C 2.711 0.437 6.635 1.00 . A A . 33 LEU CD1 1 1 11 6816 1 1 33 LEU CD2 C 0.565 -0.690 6.014 1.00 . A A . 33 LEU CD2 1 1 11 6817 1 1 33 LEU CG C 1.450 0.527 5.790 1.00 . A A . 33 LEU CG 1 1 11 6818 1 1 33 LEU H H 0.976 3.947 4.791 1.00 . A A . 33 LEU H 1 1 11 6819 1 1 33 LEU HA H -0.383 1.486 4.286 1.00 . A A . 33 LEU HA 1 1 11 6820 1 1 33 LEU HB2 H 1.403 2.593 6.285 1.00 . A A . 33 LEU HB2 1 1 11 6821 1 1 33 LEU HB3 H 0.126 1.642 7.019 1.00 . A A . 33 LEU HB3 1 1 11 6822 1 1 33 LEU HD11 H 3.434 1.158 6.280 1.00 . A A . 33 LEU HD11 1 1 11 6823 1 1 33 LEU HD12 H 2.470 0.647 7.667 1.00 . A A . 33 LEU HD12 1 1 11 6824 1 1 33 LEU HD13 H 3.125 -0.557 6.557 1.00 . A A . 33 LEU HD13 1 1 11 6825 1 1 33 LEU HD21 H 0.754 -1.421 5.240 1.00 . A A . 33 LEU HD21 1 1 11 6826 1 1 33 LEU HD22 H 0.785 -1.123 6.980 1.00 . A A . 33 LEU HD22 1 1 11 6827 1 1 33 LEU HD23 H -0.473 -0.393 5.982 1.00 . A A . 33 LEU HD23 1 1 11 6828 1 1 33 LEU HG H 1.742 0.549 4.752 1.00 . A A . 33 LEU HG 1 1 11 6829 1 1 33 LEU N N 0.249 3.449 4.359 1.00 . A A . 33 LEU N 1 1 11 6830 1 1 33 LEU O O -1.999 1.967 6.683 1.00 . A A . 33 LEU O 1 1 11 6831 1 1 34 SER C C -4.779 2.748 4.913 1.00 . A A . 34 SER C 1 1 11 6832 1 1 34 SER CA C -3.752 3.724 5.468 1.00 . A A . 34 SER CA 1 1 11 6833 1 1 34 SER CB C -4.087 5.139 5.019 1.00 . A A . 34 SER CB 1 1 11 6834 1 1 34 SER H H -2.092 3.793 4.175 1.00 . A A . 34 SER H 1 1 11 6835 1 1 34 SER HA H -3.761 3.680 6.547 1.00 . A A . 34 SER HA 1 1 11 6836 1 1 34 SER HB2 H -4.916 5.108 4.328 1.00 . A A . 34 SER HB2 1 1 11 6837 1 1 34 SER HB3 H -4.352 5.738 5.878 1.00 . A A . 34 SER HB3 1 1 11 6838 1 1 34 SER HG H -2.341 6.035 5.043 1.00 . A A . 34 SER HG 1 1 11 6839 1 1 34 SER N N -2.422 3.385 5.002 1.00 . A A . 34 SER N 1 1 11 6840 1 1 34 SER O O -5.826 2.510 5.519 1.00 . A A . 34 SER O 1 1 11 6841 1 1 34 SER OG O -2.970 5.732 4.370 1.00 . A A . 34 SER OG 1 1 11 6842 1 1 35 GLY C C -4.718 0.269 2.235 1.00 . A A . 35 GLY C 1 1 11 6843 1 1 35 GLY CA C -5.407 1.297 3.101 1.00 . A A . 35 GLY CA 1 1 11 6844 1 1 35 GLY H H -3.636 2.430 3.303 1.00 . A A . 35 GLY H 1 1 11 6845 1 1 35 GLY HA2 H -5.978 0.784 3.858 1.00 . A A . 35 GLY HA2 1 1 11 6846 1 1 35 GLY HA3 H -6.085 1.871 2.486 1.00 . A A . 35 GLY HA3 1 1 11 6847 1 1 35 GLY N N -4.483 2.201 3.742 1.00 . A A . 35 GLY N 1 1 11 6848 1 1 35 GLY O O -5.220 -0.073 1.170 1.00 . A A . 35 GLY O 1 1 11 6849 1 1 36 CYS C C -3.627 -2.594 1.977 1.00 . A A . 36 CYS C 1 1 11 6850 1 1 36 CYS CA C -2.851 -1.274 1.992 1.00 . A A . 36 CYS CA 1 1 11 6851 1 1 36 CYS CB C -1.489 -1.491 2.652 1.00 . A A . 36 CYS CB 1 1 11 6852 1 1 36 CYS H H -3.260 0.060 3.580 1.00 . A A . 36 CYS H 1 1 11 6853 1 1 36 CYS HA H -2.705 -0.938 0.977 1.00 . A A . 36 CYS HA 1 1 11 6854 1 1 36 CYS HB2 H -1.603 -1.432 3.724 1.00 . A A . 36 CYS HB2 1 1 11 6855 1 1 36 CYS HB3 H -1.123 -2.476 2.388 1.00 . A A . 36 CYS HB3 1 1 11 6856 1 1 36 CYS N N -3.591 -0.243 2.709 1.00 . A A . 36 CYS N 1 1 11 6857 1 1 36 CYS O O -3.771 -3.246 3.010 1.00 . A A . 36 CYS O 1 1 11 6858 1 1 36 CYS SG S -0.222 -0.281 2.166 1.00 . A A . 36 CYS SG 1 1 11 6859 1 1 37 PRO C C -3.872 -5.484 0.710 1.00 . A A . 37 PRO C 1 1 11 6860 1 1 37 PRO CA C -4.825 -4.294 0.662 1.00 . A A . 37 PRO CA 1 1 11 6861 1 1 37 PRO CB C -5.485 -4.177 -0.710 1.00 . A A . 37 PRO CB 1 1 11 6862 1 1 37 PRO CD C -3.970 -2.331 -0.494 1.00 . A A . 37 PRO CD 1 1 11 6863 1 1 37 PRO CG C -4.587 -3.280 -1.489 1.00 . A A . 37 PRO CG 1 1 11 6864 1 1 37 PRO HA H -5.581 -4.405 1.426 1.00 . A A . 37 PRO HA 1 1 11 6865 1 1 37 PRO HB2 H -5.558 -5.157 -1.160 1.00 . A A . 37 PRO HB2 1 1 11 6866 1 1 37 PRO HB3 H -6.471 -3.751 -0.603 1.00 . A A . 37 PRO HB3 1 1 11 6867 1 1 37 PRO HD2 H -2.930 -2.162 -0.730 1.00 . A A . 37 PRO HD2 1 1 11 6868 1 1 37 PRO HD3 H -4.511 -1.397 -0.487 1.00 . A A . 37 PRO HD3 1 1 11 6869 1 1 37 PRO HG2 H -3.820 -3.865 -1.975 1.00 . A A . 37 PRO HG2 1 1 11 6870 1 1 37 PRO HG3 H -5.163 -2.732 -2.222 1.00 . A A . 37 PRO HG3 1 1 11 6871 1 1 37 PRO N N -4.107 -3.027 0.799 1.00 . A A . 37 PRO N 1 1 11 6872 1 1 37 PRO O O -4.283 -6.625 0.923 1.00 . A A . 37 PRO O 1 1 11 6873 1 1 38 ARG C C -0.580 -5.897 1.780 1.00 . A A . 38 ARG C 1 1 11 6874 1 1 38 ARG CA C -1.549 -6.212 0.645 1.00 . A A . 38 ARG CA 1 1 11 6875 1 1 38 ARG CB C -0.790 -6.292 -0.682 1.00 . A A . 38 ARG CB 1 1 11 6876 1 1 38 ARG CD C -1.326 -6.320 -3.129 1.00 . A A . 38 ARG CD 1 1 11 6877 1 1 38 ARG CG C -1.566 -6.986 -1.785 1.00 . A A . 38 ARG CG 1 1 11 6878 1 1 38 ARG CZ C -2.529 -6.060 -5.275 1.00 . A A . 38 ARG CZ 1 1 11 6879 1 1 38 ARG H H -2.319 -4.252 0.462 1.00 . A A . 38 ARG H 1 1 11 6880 1 1 38 ARG HA H -2.025 -7.161 0.841 1.00 . A A . 38 ARG HA 1 1 11 6881 1 1 38 ARG HB2 H -0.561 -5.290 -1.009 1.00 . A A . 38 ARG HB2 1 1 11 6882 1 1 38 ARG HB3 H 0.134 -6.830 -0.526 1.00 . A A . 38 ARG HB3 1 1 11 6883 1 1 38 ARG HD2 H -1.022 -5.297 -2.961 1.00 . A A . 38 ARG HD2 1 1 11 6884 1 1 38 ARG HD3 H -0.537 -6.849 -3.641 1.00 . A A . 38 ARG HD3 1 1 11 6885 1 1 38 ARG HE H -3.379 -6.554 -3.529 1.00 . A A . 38 ARG HE 1 1 11 6886 1 1 38 ARG HG2 H -1.250 -8.019 -1.841 1.00 . A A . 38 ARG HG2 1 1 11 6887 1 1 38 ARG HG3 H -2.620 -6.942 -1.553 1.00 . A A . 38 ARG HG3 1 1 11 6888 1 1 38 ARG HH11 H -0.523 -5.750 -5.404 1.00 . A A . 38 ARG HH11 1 1 11 6889 1 1 38 ARG HH12 H -1.404 -5.551 -6.893 1.00 . A A . 38 ARG HH12 1 1 11 6890 1 1 38 ARG HH21 H -4.528 -6.330 -5.476 1.00 . A A . 38 ARG HH21 1 1 11 6891 1 1 38 ARG HH22 H -3.691 -5.906 -6.941 1.00 . A A . 38 ARG HH22 1 1 11 6892 1 1 38 ARG N N -2.585 -5.193 0.575 1.00 . A A . 38 ARG N 1 1 11 6893 1 1 38 ARG NE N -2.525 -6.331 -3.968 1.00 . A A . 38 ARG NE 1 1 11 6894 1 1 38 ARG NH1 N -1.395 -5.767 -5.907 1.00 . A A . 38 ARG NH1 1 1 11 6895 1 1 38 ARG NH2 N -3.674 -6.101 -5.949 1.00 . A A . 38 ARG NH2 1 1 11 6896 1 1 38 ARG O O 0.621 -6.148 1.674 1.00 . A A . 38 ARG O 1 1 11 6897 1 1 39 ALA C C 0.352 -6.124 4.643 1.00 . A A . 39 ALA C 1 1 11 6898 1 1 39 ALA CA C -0.298 -4.912 3.989 1.00 . A A . 39 ALA CA 1 1 11 6899 1 1 39 ALA CB C -1.140 -4.157 5.005 1.00 . A A . 39 ALA CB 1 1 11 6900 1 1 39 ALA H H -2.067 -5.105 2.852 1.00 . A A . 39 ALA H 1 1 11 6901 1 1 39 ALA HA H 0.477 -4.249 3.635 1.00 . A A . 39 ALA HA 1 1 11 6902 1 1 39 ALA HB1 H -1.909 -4.809 5.393 1.00 . A A . 39 ALA HB1 1 1 11 6903 1 1 39 ALA HB2 H -0.509 -3.821 5.814 1.00 . A A . 39 ALA HB2 1 1 11 6904 1 1 39 ALA HB3 H -1.599 -3.304 4.528 1.00 . A A . 39 ALA HB3 1 1 11 6905 1 1 39 ALA N N -1.109 -5.304 2.845 1.00 . A A . 39 ALA N 1 1 11 6906 1 1 39 ALA O O -0.331 -6.960 5.237 1.00 . A A . 39 ALA O 1 1 11 6907 1 1 40 LYS C C 2.082 -8.658 4.318 1.00 . A A . 40 LYS C 1 1 11 6908 1 1 40 LYS CA C 2.452 -7.341 5.006 1.00 . A A . 40 LYS CA 1 1 11 6909 1 1 40 LYS CB C 2.276 -7.465 6.524 1.00 . A A . 40 LYS CB 1 1 11 6910 1 1 40 LYS CD C 2.304 -5.760 8.369 1.00 . A A . 40 LYS CD 1 1 11 6911 1 1 40 LYS CE C 2.918 -4.417 8.728 1.00 . A A . 40 LYS CE 1 1 11 6912 1 1 40 LYS CG C 3.126 -6.487 7.318 1.00 . A A . 40 LYS CG 1 1 11 6913 1 1 40 LYS H H 2.125 -5.536 3.958 1.00 . A A . 40 LYS H 1 1 11 6914 1 1 40 LYS HA H 3.489 -7.131 4.797 1.00 . A A . 40 LYS HA 1 1 11 6915 1 1 40 LYS HB2 H 1.238 -7.289 6.771 1.00 . A A . 40 LYS HB2 1 1 11 6916 1 1 40 LYS HB3 H 2.542 -8.468 6.825 1.00 . A A . 40 LYS HB3 1 1 11 6917 1 1 40 LYS HD2 H 1.308 -5.598 7.986 1.00 . A A . 40 LYS HD2 1 1 11 6918 1 1 40 LYS HD3 H 2.255 -6.372 9.257 1.00 . A A . 40 LYS HD3 1 1 11 6919 1 1 40 LYS HE2 H 2.856 -4.281 9.797 1.00 . A A . 40 LYS HE2 1 1 11 6920 1 1 40 LYS HE3 H 3.954 -4.418 8.426 1.00 . A A . 40 LYS HE3 1 1 11 6921 1 1 40 LYS HG2 H 3.919 -7.030 7.809 1.00 . A A . 40 LYS HG2 1 1 11 6922 1 1 40 LYS HG3 H 3.550 -5.762 6.639 1.00 . A A . 40 LYS HG3 1 1 11 6923 1 1 40 LYS HZ1 H 1.203 -3.507 7.955 1.00 . A A . 40 LYS HZ1 1 1 11 6924 1 1 40 LYS HZ2 H 2.626 -3.126 7.109 1.00 . A A . 40 LYS HZ2 1 1 11 6925 1 1 40 LYS HZ3 H 2.318 -2.415 8.619 1.00 . A A . 40 LYS HZ3 1 1 11 6926 1 1 40 LYS N N 1.668 -6.225 4.479 1.00 . A A . 40 LYS N 1 1 11 6927 1 1 40 LYS NZ N 2.219 -3.290 8.056 1.00 . A A . 40 LYS NZ 1 1 11 6928 1 1 40 LYS O O 1.075 -8.752 3.607 1.00 . A A . 40 LYS O 1 1 11 6929 1 1 41 LYS C C 1.976 -11.868 4.983 1.00 . A A . 41 LYS C 1 1 11 6930 1 1 41 LYS CA C 2.666 -10.980 3.954 1.00 . A A . 41 LYS CA 1 1 11 6931 1 1 41 LYS CB C 3.984 -11.616 3.509 1.00 . A A . 41 LYS CB 1 1 11 6932 1 1 41 LYS CD C 4.927 -12.147 1.247 1.00 . A A . 41 LYS CD 1 1 11 6933 1 1 41 LYS CE C 4.545 -12.631 -0.143 1.00 . A A . 41 LYS CE 1 1 11 6934 1 1 41 LYS CG C 3.857 -12.482 2.269 1.00 . A A . 41 LYS CG 1 1 11 6935 1 1 41 LYS H H 3.699 -9.533 5.090 1.00 . A A . 41 LYS H 1 1 11 6936 1 1 41 LYS HA H 2.020 -10.864 3.096 1.00 . A A . 41 LYS HA 1 1 11 6937 1 1 41 LYS HB2 H 4.695 -10.830 3.299 1.00 . A A . 41 LYS HB2 1 1 11 6938 1 1 41 LYS HB3 H 4.366 -12.227 4.312 1.00 . A A . 41 LYS HB3 1 1 11 6939 1 1 41 LYS HD2 H 5.058 -11.075 1.222 1.00 . A A . 41 LYS HD2 1 1 11 6940 1 1 41 LYS HD3 H 5.853 -12.618 1.540 1.00 . A A . 41 LYS HD3 1 1 11 6941 1 1 41 LYS HE2 H 3.627 -12.147 -0.437 1.00 . A A . 41 LYS HE2 1 1 11 6942 1 1 41 LYS HE3 H 5.332 -12.361 -0.833 1.00 . A A . 41 LYS HE3 1 1 11 6943 1 1 41 LYS HG2 H 3.957 -13.518 2.556 1.00 . A A . 41 LYS HG2 1 1 11 6944 1 1 41 LYS HG3 H 2.886 -12.321 1.826 1.00 . A A . 41 LYS HG3 1 1 11 6945 1 1 41 LYS HZ1 H 3.359 -14.343 0.042 1.00 . A A . 41 LYS HZ1 1 1 11 6946 1 1 41 LYS HZ2 H 4.982 -14.576 0.499 1.00 . A A . 41 LYS HZ2 1 1 11 6947 1 1 41 LYS HZ3 H 4.568 -14.467 -1.140 1.00 . A A . 41 LYS HZ3 1 1 11 6948 1 1 41 LYS N N 2.909 -9.668 4.523 1.00 . A A . 41 LYS N 1 1 11 6949 1 1 41 LYS NZ N 4.350 -14.106 -0.188 1.00 . A A . 41 LYS NZ 1 1 11 6950 1 1 41 LYS O O 1.819 -11.469 6.142 1.00 . A A . 41 LYS O 1 1 11 6951 1 1 42 SER C C 1.869 -14.283 6.686 1.00 . A A . 42 SER C 1 1 11 6952 1 1 42 SER CA C 0.992 -14.041 5.462 1.00 . A A . 42 SER CA 1 1 11 6953 1 1 42 SER CB C 0.768 -15.345 4.703 1.00 . A A . 42 SER CB 1 1 11 6954 1 1 42 SER H H 1.776 -13.333 3.641 1.00 . A A . 42 SER H 1 1 11 6955 1 1 42 SER HA H 0.039 -13.646 5.782 1.00 . A A . 42 SER HA 1 1 11 6956 1 1 42 SER HB2 H 1.498 -16.075 5.018 1.00 . A A . 42 SER HB2 1 1 11 6957 1 1 42 SER HB3 H -0.226 -15.714 4.907 1.00 . A A . 42 SER HB3 1 1 11 6958 1 1 42 SER HG H 0.026 -14.960 2.921 1.00 . A A . 42 SER HG 1 1 11 6959 1 1 42 SER N N 1.610 -13.073 4.573 1.00 . A A . 42 SER N 1 1 11 6960 1 1 42 SER O O 3.078 -14.496 6.560 1.00 . A A . 42 SER O 1 1 11 6961 1 1 42 SER OG O 0.901 -15.137 3.302 1.00 . A A . 42 SER OG 1 1 11 6962 1 1 43 GLY C C 2.610 -12.905 9.525 1.00 . A A . 43 GLY C 1 1 11 6963 1 1 43 GLY CA C 2.060 -14.242 9.083 1.00 . A A . 43 GLY CA 1 1 11 6964 1 1 43 GLY H H 0.338 -13.863 7.905 1.00 . A A . 43 GLY H 1 1 11 6965 1 1 43 GLY HA2 H 1.428 -14.636 9.863 1.00 . A A . 43 GLY HA2 1 1 11 6966 1 1 43 GLY HA3 H 2.882 -14.921 8.917 1.00 . A A . 43 GLY HA3 1 1 11 6967 1 1 43 GLY N N 1.290 -14.128 7.865 1.00 . A A . 43 GLY N 1 1 11 6968 1 1 43 GLY O O 3.761 -12.807 9.960 1.00 . A A . 43 GLY O 1 1 11 6969 1 1 44 LEU C C 2.313 -10.396 11.289 1.00 . A A . 44 LEU C 1 1 11 6970 1 1 44 LEU CA C 2.193 -10.526 9.775 1.00 . A A . 44 LEU CA 1 1 11 6971 1 1 44 LEU CB C 1.194 -9.492 9.244 1.00 . A A . 44 LEU CB 1 1 11 6972 1 1 44 LEU CD1 C -1.178 -9.431 10.057 1.00 . A A . 44 LEU CD1 1 1 11 6973 1 1 44 LEU CD2 C -0.704 -9.658 7.614 1.00 . A A . 44 LEU CD2 1 1 11 6974 1 1 44 LEU CG C -0.231 -10.006 9.016 1.00 . A A . 44 LEU CG 1 1 11 6975 1 1 44 LEU H H 0.890 -12.021 9.039 1.00 . A A . 44 LEU H 1 1 11 6976 1 1 44 LEU HA H 3.161 -10.335 9.334 1.00 . A A . 44 LEU HA 1 1 11 6977 1 1 44 LEU HB2 H 1.149 -8.676 9.950 1.00 . A A . 44 LEU HB2 1 1 11 6978 1 1 44 LEU HB3 H 1.570 -9.113 8.306 1.00 . A A . 44 LEU HB3 1 1 11 6979 1 1 44 LEU HD11 H -2.059 -10.052 10.124 1.00 . A A . 44 LEU HD11 1 1 11 6980 1 1 44 LEU HD12 H -0.684 -9.400 11.016 1.00 . A A . 44 LEU HD12 1 1 11 6981 1 1 44 LEU HD13 H -1.465 -8.430 9.768 1.00 . A A . 44 LEU HD13 1 1 11 6982 1 1 44 LEU HD21 H -0.335 -8.680 7.342 1.00 . A A . 44 LEU HD21 1 1 11 6983 1 1 44 LEU HD22 H -0.330 -10.391 6.915 1.00 . A A . 44 LEU HD22 1 1 11 6984 1 1 44 LEU HD23 H -1.785 -9.654 7.587 1.00 . A A . 44 LEU HD23 1 1 11 6985 1 1 44 LEU HG H -0.240 -11.080 9.115 1.00 . A A . 44 LEU HG 1 1 11 6986 1 1 44 LEU N N 1.792 -11.872 9.398 1.00 . A A . 44 LEU N 1 1 11 6987 1 1 44 LEU O O 3.124 -9.618 11.793 1.00 . A A . 44 LEU O 1 1 11 6988 1 1 45 ARG C C 1.005 -12.402 14.052 1.00 . A A . 45 ARG C 1 1 11 6989 1 1 45 ARG CA C 1.511 -11.096 13.466 1.00 . A A . 45 ARG CA 1 1 11 6990 1 1 45 ARG CB C 0.645 -9.935 13.958 1.00 . A A . 45 ARG CB 1 1 11 6991 1 1 45 ARG CD C 1.394 -7.579 14.395 1.00 . A A . 45 ARG CD 1 1 11 6992 1 1 45 ARG CG C 1.367 -9.006 14.917 1.00 . A A . 45 ARG CG 1 1 11 6993 1 1 45 ARG CZ C 3.059 -6.279 13.120 1.00 . A A . 45 ARG CZ 1 1 11 6994 1 1 45 ARG H H 0.870 -11.759 11.560 1.00 . A A . 45 ARG H 1 1 11 6995 1 1 45 ARG HA H 2.531 -10.938 13.788 1.00 . A A . 45 ARG HA 1 1 11 6996 1 1 45 ARG HB2 H 0.320 -9.356 13.107 1.00 . A A . 45 ARG HB2 1 1 11 6997 1 1 45 ARG HB3 H -0.221 -10.336 14.463 1.00 . A A . 45 ARG HB3 1 1 11 6998 1 1 45 ARG HD2 H 0.413 -7.328 14.017 1.00 . A A . 45 ARG HD2 1 1 11 6999 1 1 45 ARG HD3 H 1.644 -6.918 15.211 1.00 . A A . 45 ARG HD3 1 1 11 7000 1 1 45 ARG HE H 2.526 -8.169 12.719 1.00 . A A . 45 ARG HE 1 1 11 7001 1 1 45 ARG HG2 H 0.858 -9.021 15.871 1.00 . A A . 45 ARG HG2 1 1 11 7002 1 1 45 ARG HG3 H 2.382 -9.352 15.043 1.00 . A A . 45 ARG HG3 1 1 11 7003 1 1 45 ARG HH11 H 2.258 -5.302 14.710 1.00 . A A . 45 ARG HH11 1 1 11 7004 1 1 45 ARG HH12 H 3.423 -4.398 13.787 1.00 . A A . 45 ARG HH12 1 1 11 7005 1 1 45 ARG HH21 H 4.045 -6.973 11.481 1.00 . A A . 45 ARG HH21 1 1 11 7006 1 1 45 ARG HH22 H 4.437 -5.343 11.960 1.00 . A A . 45 ARG HH22 1 1 11 7007 1 1 45 ARG N N 1.502 -11.150 12.014 1.00 . A A . 45 ARG N 1 1 11 7008 1 1 45 ARG NE N 2.373 -7.403 13.324 1.00 . A A . 45 ARG NE 1 1 11 7009 1 1 45 ARG NH1 N 2.897 -5.245 13.935 1.00 . A A . 45 ARG NH1 1 1 11 7010 1 1 45 ARG NH2 N 3.910 -6.191 12.107 1.00 . A A . 45 ARG NH2 1 1 11 7011 1 1 45 ARG O O -0.007 -12.428 14.748 1.00 . A A . 45 ARG O 1 1 11 7012 1 1 46 VAL C C 1.593 -14.858 15.780 1.00 . A A . 46 VAL C 1 1 11 7013 1 1 46 VAL CA C 1.318 -14.791 14.285 1.00 . A A . 46 VAL CA 1 1 11 7014 1 1 46 VAL CB C 2.054 -15.955 13.586 1.00 . A A . 46 VAL CB 1 1 11 7015 1 1 46 VAL CG1 C 1.120 -17.144 13.414 1.00 . A A . 46 VAL CG1 1 1 11 7016 1 1 46 VAL CG2 C 2.624 -15.527 12.241 1.00 . A A . 46 VAL CG2 1 1 11 7017 1 1 46 VAL H H 2.516 -13.408 13.221 1.00 . A A . 46 VAL H 1 1 11 7018 1 1 46 VAL HA H 0.255 -14.911 14.119 1.00 . A A . 46 VAL HA 1 1 11 7019 1 1 46 VAL HB H 2.876 -16.263 14.218 1.00 . A A . 46 VAL HB 1 1 11 7020 1 1 46 VAL HG11 H 1.687 -18.060 13.489 1.00 . A A . 46 VAL HG11 1 1 11 7021 1 1 46 VAL HG12 H 0.366 -17.123 14.185 1.00 . A A . 46 VAL HG12 1 1 11 7022 1 1 46 VAL HG13 H 0.646 -17.092 12.445 1.00 . A A . 46 VAL HG13 1 1 11 7023 1 1 46 VAL HG21 H 1.969 -14.799 11.787 1.00 . A A . 46 VAL HG21 1 1 11 7024 1 1 46 VAL HG22 H 3.601 -15.089 12.388 1.00 . A A . 46 VAL HG22 1 1 11 7025 1 1 46 VAL HG23 H 2.711 -16.388 11.593 1.00 . A A . 46 VAL HG23 1 1 11 7026 1 1 46 VAL N N 1.707 -13.488 13.766 1.00 . A A . 46 VAL N 1 1 11 7027 1 1 46 VAL O O 2.731 -14.543 16.192 1.00 . A A . 46 VAL O 1 1 11 7028 1 1 46 VAL OXT O 0.669 -15.211 16.540 1.00 . A A . 46 VAL OXT 1 1 11 7029 2 2 1 ZN ZN ZN -0.321 -0.104 -0.118 1.00 . B A . 47 ZN ZN 1 1 12 7030 1 1 1 GLY C C 15.696 8.380 -4.548 1.00 . A A . 1 GLY C 1 1 12 7031 1 1 1 GLY CA C 15.861 7.345 -3.454 1.00 . A A . 1 GLY CA 1 1 12 7032 1 1 1 GLY H1 H 16.541 8.360 -1.765 1.00 . A A . 1 GLY H1 1 1 12 7033 1 1 1 GLY H2 H 15.389 7.163 -1.433 1.00 . A A . 1 GLY H2 1 1 12 7034 1 1 1 GLY H3 H 14.906 8.633 -2.124 1.00 . A A . 1 GLY H3 1 1 12 7035 1 1 1 GLY HA2 H 16.859 6.932 -3.515 1.00 . A A . 1 GLY HA2 1 1 12 7036 1 1 1 GLY HA3 H 15.145 6.553 -3.611 1.00 . A A . 1 GLY HA3 1 1 12 7037 1 1 1 GLY N N 15.660 7.914 -2.101 1.00 . A A . 1 GLY N 1 1 12 7038 1 1 1 GLY O O 16.660 9.042 -4.942 1.00 . A A . 1 GLY O 1 1 12 7039 1 1 2 SER C C 13.371 10.619 -5.638 1.00 . A A . 2 SER C 1 1 12 7040 1 1 2 SER CA C 14.190 9.431 -6.136 1.00 . A A . 2 SER CA 1 1 12 7041 1 1 2 SER CB C 13.439 8.706 -7.252 1.00 . A A . 2 SER CB 1 1 12 7042 1 1 2 SER H H 13.753 7.944 -4.698 1.00 . A A . 2 SER H 1 1 12 7043 1 1 2 SER HA H 15.131 9.791 -6.521 1.00 . A A . 2 SER HA 1 1 12 7044 1 1 2 SER HB2 H 12.388 8.653 -7.002 1.00 . A A . 2 SER HB2 1 1 12 7045 1 1 2 SER HB3 H 13.563 9.248 -8.178 1.00 . A A . 2 SER HB3 1 1 12 7046 1 1 2 SER HG H 13.780 7.109 -8.340 1.00 . A A . 2 SER HG 1 1 12 7047 1 1 2 SER N N 14.480 8.504 -5.054 1.00 . A A . 2 SER N 1 1 12 7048 1 1 2 SER O O 12.917 10.638 -4.489 1.00 . A A . 2 SER O 1 1 12 7049 1 1 2 SER OG O 13.934 7.386 -7.426 1.00 . A A . 2 SER OG 1 1 12 7050 1 1 3 MET C C 10.911 12.522 -6.422 1.00 . A A . 3 MET C 1 1 12 7051 1 1 3 MET CA C 12.394 12.778 -6.174 1.00 . A A . 3 MET CA 1 1 12 7052 1 1 3 MET CB C 12.869 13.975 -6.996 1.00 . A A . 3 MET CB 1 1 12 7053 1 1 3 MET CE C 13.213 18.020 -6.066 1.00 . A A . 3 MET CE 1 1 12 7054 1 1 3 MET CG C 12.787 15.294 -6.254 1.00 . A A . 3 MET CG 1 1 12 7055 1 1 3 MET H H 13.547 11.516 -7.416 1.00 . A A . 3 MET H 1 1 12 7056 1 1 3 MET HA H 12.540 12.991 -5.126 1.00 . A A . 3 MET HA 1 1 12 7057 1 1 3 MET HB2 H 13.897 13.813 -7.284 1.00 . A A . 3 MET HB2 1 1 12 7058 1 1 3 MET HB3 H 12.263 14.048 -7.887 1.00 . A A . 3 MET HB3 1 1 12 7059 1 1 3 MET HE1 H 14.004 18.754 -6.121 1.00 . A A . 3 MET HE1 1 1 12 7060 1 1 3 MET HE2 H 12.284 18.467 -6.390 1.00 . A A . 3 MET HE2 1 1 12 7061 1 1 3 MET HE3 H 13.112 17.673 -5.049 1.00 . A A . 3 MET HE3 1 1 12 7062 1 1 3 MET HG2 H 11.747 15.555 -6.123 1.00 . A A . 3 MET HG2 1 1 12 7063 1 1 3 MET HG3 H 13.252 15.177 -5.285 1.00 . A A . 3 MET HG3 1 1 12 7064 1 1 3 MET N N 13.175 11.599 -6.507 1.00 . A A . 3 MET N 1 1 12 7065 1 1 3 MET O O 10.418 12.684 -7.539 1.00 . A A . 3 MET O 1 1 12 7066 1 1 3 MET SD S 13.612 16.636 -7.131 1.00 . A A . 3 MET SD 1 1 12 7067 1 1 4 ALA C C 8.090 12.195 -4.179 1.00 . A A . 4 ALA C 1 1 12 7068 1 1 4 ALA CA C 8.800 11.789 -5.469 1.00 . A A . 4 ALA CA 1 1 12 7069 1 1 4 ALA CB C 8.592 10.309 -5.758 1.00 . A A . 4 ALA CB 1 1 12 7070 1 1 4 ALA H H 10.678 11.968 -4.521 1.00 . A A . 4 ALA H 1 1 12 7071 1 1 4 ALA HA H 8.389 12.357 -6.292 1.00 . A A . 4 ALA HA 1 1 12 7072 1 1 4 ALA HB1 H 8.190 10.189 -6.754 1.00 . A A . 4 ALA HB1 1 1 12 7073 1 1 4 ALA HB2 H 9.539 9.791 -5.687 1.00 . A A . 4 ALA HB2 1 1 12 7074 1 1 4 ALA HB3 H 7.901 9.894 -5.039 1.00 . A A . 4 ALA HB3 1 1 12 7075 1 1 4 ALA N N 10.218 12.092 -5.380 1.00 . A A . 4 ALA N 1 1 12 7076 1 1 4 ALA O O 7.902 11.381 -3.272 1.00 . A A . 4 ALA O 1 1 12 7077 1 1 5 ALA C C 5.645 14.009 -2.955 1.00 . A A . 5 ALA C 1 1 12 7078 1 1 5 ALA CA C 7.165 14.013 -2.859 1.00 . A A . 5 ALA CA 1 1 12 7079 1 1 5 ALA CB C 7.672 15.419 -2.591 1.00 . A A . 5 ALA CB 1 1 12 7080 1 1 5 ALA H H 8.021 14.098 -4.798 1.00 . A A . 5 ALA H 1 1 12 7081 1 1 5 ALA HA H 7.464 13.388 -2.032 1.00 . A A . 5 ALA HA 1 1 12 7082 1 1 5 ALA HB1 H 7.874 15.914 -3.531 1.00 . A A . 5 ALA HB1 1 1 12 7083 1 1 5 ALA HB2 H 6.924 15.975 -2.046 1.00 . A A . 5 ALA HB2 1 1 12 7084 1 1 5 ALA HB3 H 8.578 15.366 -2.009 1.00 . A A . 5 ALA HB3 1 1 12 7085 1 1 5 ALA N N 7.778 13.479 -4.068 1.00 . A A . 5 ALA N 1 1 12 7086 1 1 5 ALA O O 4.950 14.184 -1.950 1.00 . A A . 5 ALA O 1 1 12 7087 1 1 6 HIS C C 3.282 12.311 -4.849 1.00 . A A . 6 HIS C 1 1 12 7088 1 1 6 HIS CA C 3.685 13.688 -4.345 1.00 . A A . 6 HIS CA 1 1 12 7089 1 1 6 HIS CB C 3.180 14.780 -5.309 1.00 . A A . 6 HIS CB 1 1 12 7090 1 1 6 HIS CD2 C 5.254 15.966 -6.332 1.00 . A A . 6 HIS CD2 1 1 12 7091 1 1 6 HIS CE1 C 4.983 15.345 -8.413 1.00 . A A . 6 HIS CE1 1 1 12 7092 1 1 6 HIS CG C 4.146 15.188 -6.383 1.00 . A A . 6 HIS CG 1 1 12 7093 1 1 6 HIS H H 5.731 13.548 -4.900 1.00 . A A . 6 HIS H 1 1 12 7094 1 1 6 HIS HA H 3.224 13.841 -3.381 1.00 . A A . 6 HIS HA 1 1 12 7095 1 1 6 HIS HB2 H 2.287 14.426 -5.796 1.00 . A A . 6 HIS HB2 1 1 12 7096 1 1 6 HIS HB3 H 2.936 15.664 -4.734 1.00 . A A . 6 HIS HB3 1 1 12 7097 1 1 6 HIS HD1 H 3.287 14.246 -8.069 1.00 . A A . 6 HIS HD1 1 1 12 7098 1 1 6 HIS HD2 H 5.667 16.433 -5.449 1.00 . A A . 6 HIS HD2 1 1 12 7099 1 1 6 HIS HE1 H 5.124 15.225 -9.477 1.00 . A A . 6 HIS HE1 1 1 12 7100 1 1 6 HIS HE2 H 6.417 16.710 -7.907 1.00 . A A . 6 HIS HE2 1 1 12 7101 1 1 6 HIS N N 5.128 13.754 -4.147 1.00 . A A . 6 HIS N 1 1 12 7102 1 1 6 HIS ND1 N 4.005 14.816 -7.702 1.00 . A A . 6 HIS ND1 1 1 12 7103 1 1 6 HIS NE2 N 5.755 16.049 -7.605 1.00 . A A . 6 HIS NE2 1 1 12 7104 1 1 6 HIS O O 4.068 11.367 -4.770 1.00 . A A . 6 HIS O 1 1 12 7105 1 1 7 SER C C 2.280 10.382 -6.955 1.00 . A A . 7 SER C 1 1 12 7106 1 1 7 SER CA C 1.502 10.910 -5.750 1.00 . A A . 7 SER CA 1 1 12 7107 1 1 7 SER CB C 0.025 11.079 -6.101 1.00 . A A . 7 SER CB 1 1 12 7108 1 1 7 SER H H 1.439 12.963 -5.264 1.00 . A A . 7 SER H 1 1 12 7109 1 1 7 SER HA H 1.590 10.203 -4.940 1.00 . A A . 7 SER HA 1 1 12 7110 1 1 7 SER HB2 H -0.109 10.951 -7.164 1.00 . A A . 7 SER HB2 1 1 12 7111 1 1 7 SER HB3 H -0.557 10.338 -5.572 1.00 . A A . 7 SER HB3 1 1 12 7112 1 1 7 SER HG H -1.375 12.454 -5.969 1.00 . A A . 7 SER HG 1 1 12 7113 1 1 7 SER N N 2.038 12.186 -5.294 1.00 . A A . 7 SER N 1 1 12 7114 1 1 7 SER O O 2.058 10.805 -8.091 1.00 . A A . 7 SER O 1 1 12 7115 1 1 7 SER OG O -0.436 12.371 -5.733 1.00 . A A . 7 SER OG 1 1 12 7116 1 1 8 ALA C C 4.191 7.398 -7.505 1.00 . A A . 8 ALA C 1 1 12 7117 1 1 8 ALA CA C 4.034 8.889 -7.740 1.00 . A A . 8 ALA CA 1 1 12 7118 1 1 8 ALA CB C 5.397 9.558 -7.775 1.00 . A A . 8 ALA CB 1 1 12 7119 1 1 8 ALA H H 3.351 9.194 -5.763 1.00 . A A . 8 ALA H 1 1 12 7120 1 1 8 ALA HA H 3.546 9.053 -8.691 1.00 . A A . 8 ALA HA 1 1 12 7121 1 1 8 ALA HB1 H 5.274 10.625 -7.879 1.00 . A A . 8 ALA HB1 1 1 12 7122 1 1 8 ALA HB2 H 5.924 9.344 -6.858 1.00 . A A . 8 ALA HB2 1 1 12 7123 1 1 8 ALA HB3 H 5.963 9.177 -8.613 1.00 . A A . 8 ALA HB3 1 1 12 7124 1 1 8 ALA N N 3.208 9.474 -6.693 1.00 . A A . 8 ALA N 1 1 12 7125 1 1 8 ALA O O 3.845 6.898 -6.432 1.00 . A A . 8 ALA O 1 1 12 7126 1 1 9 ASP C C 6.188 4.927 -7.623 1.00 . A A . 9 ASP C 1 1 12 7127 1 1 9 ASP CA C 4.903 5.244 -8.379 1.00 . A A . 9 ASP CA 1 1 12 7128 1 1 9 ASP CB C 4.934 4.592 -9.762 1.00 . A A . 9 ASP CB 1 1 12 7129 1 1 9 ASP CG C 4.557 3.121 -9.728 1.00 . A A . 9 ASP CG 1 1 12 7130 1 1 9 ASP H H 4.966 7.142 -9.333 1.00 . A A . 9 ASP H 1 1 12 7131 1 1 9 ASP HA H 4.068 4.844 -7.819 1.00 . A A . 9 ASP HA 1 1 12 7132 1 1 9 ASP HB2 H 4.239 5.105 -10.409 1.00 . A A . 9 ASP HB2 1 1 12 7133 1 1 9 ASP HB3 H 5.929 4.680 -10.171 1.00 . A A . 9 ASP HB3 1 1 12 7134 1 1 9 ASP N N 4.709 6.687 -8.495 1.00 . A A . 9 ASP N 1 1 12 7135 1 1 9 ASP O O 6.978 4.078 -8.036 1.00 . A A . 9 ASP O 1 1 12 7136 1 1 9 ASP OD1 O 4.305 2.588 -8.630 1.00 . A A . 9 ASP OD1 1 1 12 7137 1 1 9 ASP OD2 O 4.504 2.490 -10.809 1.00 . A A . 9 ASP OD2 1 1 12 7138 1 1 10 LEU C C 7.092 4.206 -4.590 1.00 . A A . 10 LEU C 1 1 12 7139 1 1 10 LEU CA C 7.482 5.276 -5.599 1.00 . A A . 10 LEU CA 1 1 12 7140 1 1 10 LEU CB C 7.934 6.552 -4.877 1.00 . A A . 10 LEU CB 1 1 12 7141 1 1 10 LEU CD1 C 7.904 7.425 -2.529 1.00 . A A . 10 LEU CD1 1 1 12 7142 1 1 10 LEU CD2 C 6.125 8.120 -4.135 1.00 . A A . 10 LEU CD2 1 1 12 7143 1 1 10 LEU CG C 7.050 6.993 -3.710 1.00 . A A . 10 LEU CG 1 1 12 7144 1 1 10 LEU H H 5.650 6.169 -6.160 1.00 . A A . 10 LEU H 1 1 12 7145 1 1 10 LEU HA H 8.291 4.905 -6.211 1.00 . A A . 10 LEU HA 1 1 12 7146 1 1 10 LEU HB2 H 8.933 6.392 -4.502 1.00 . A A . 10 LEU HB2 1 1 12 7147 1 1 10 LEU HB3 H 7.965 7.357 -5.600 1.00 . A A . 10 LEU HB3 1 1 12 7148 1 1 10 LEU HD11 H 8.915 7.070 -2.669 1.00 . A A . 10 LEU HD11 1 1 12 7149 1 1 10 LEU HD12 H 7.907 8.503 -2.461 1.00 . A A . 10 LEU HD12 1 1 12 7150 1 1 10 LEU HD13 H 7.500 7.008 -1.619 1.00 . A A . 10 LEU HD13 1 1 12 7151 1 1 10 LEU HD21 H 5.397 7.742 -4.839 1.00 . A A . 10 LEU HD21 1 1 12 7152 1 1 10 LEU HD22 H 5.617 8.514 -3.268 1.00 . A A . 10 LEU HD22 1 1 12 7153 1 1 10 LEU HD23 H 6.703 8.904 -4.601 1.00 . A A . 10 LEU HD23 1 1 12 7154 1 1 10 LEU HG H 6.440 6.160 -3.391 1.00 . A A . 10 LEU HG 1 1 12 7155 1 1 10 LEU N N 6.349 5.551 -6.468 1.00 . A A . 10 LEU N 1 1 12 7156 1 1 10 LEU O O 7.882 3.839 -3.717 1.00 . A A . 10 LEU O 1 1 12 7157 1 1 11 LYS C C 4.952 3.237 -2.497 1.00 . A A . 11 LYS C 1 1 12 7158 1 1 11 LYS CA C 5.273 2.697 -3.883 1.00 . A A . 11 LYS CA 1 1 12 7159 1 1 11 LYS CB C 6.185 1.474 -3.783 1.00 . A A . 11 LYS CB 1 1 12 7160 1 1 11 LYS CD C 4.877 0.071 -5.402 1.00 . A A . 11 LYS CD 1 1 12 7161 1 1 11 LYS CE C 4.827 -0.403 -6.845 1.00 . A A . 11 LYS CE 1 1 12 7162 1 1 11 LYS CG C 6.236 0.661 -5.062 1.00 . A A . 11 LYS CG 1 1 12 7163 1 1 11 LYS H H 5.305 4.077 -5.468 1.00 . A A . 11 LYS H 1 1 12 7164 1 1 11 LYS HA H 4.346 2.393 -4.342 1.00 . A A . 11 LYS HA 1 1 12 7165 1 1 11 LYS HB2 H 7.189 1.804 -3.550 1.00 . A A . 11 LYS HB2 1 1 12 7166 1 1 11 LYS HB3 H 5.831 0.837 -2.989 1.00 . A A . 11 LYS HB3 1 1 12 7167 1 1 11 LYS HD2 H 4.686 -0.768 -4.750 1.00 . A A . 11 LYS HD2 1 1 12 7168 1 1 11 LYS HD3 H 4.119 0.827 -5.252 1.00 . A A . 11 LYS HD3 1 1 12 7169 1 1 11 LYS HE2 H 5.755 -0.137 -7.331 1.00 . A A . 11 LYS HE2 1 1 12 7170 1 1 11 LYS HE3 H 4.712 -1.477 -6.855 1.00 . A A . 11 LYS HE3 1 1 12 7171 1 1 11 LYS HG2 H 6.551 1.302 -5.873 1.00 . A A . 11 LYS HG2 1 1 12 7172 1 1 11 LYS HG3 H 6.948 -0.139 -4.939 1.00 . A A . 11 LYS HG3 1 1 12 7173 1 1 11 LYS HZ1 H 2.910 0.422 -6.949 1.00 . A A . 11 LYS HZ1 1 1 12 7174 1 1 11 LYS HZ2 H 3.359 -0.445 -8.331 1.00 . A A . 11 LYS HZ2 1 1 12 7175 1 1 11 LYS HZ3 H 4.009 1.100 -8.051 1.00 . A A . 11 LYS HZ3 1 1 12 7176 1 1 11 LYS N N 5.854 3.724 -4.739 1.00 . A A . 11 LYS N 1 1 12 7177 1 1 11 LYS NZ N 3.700 0.210 -7.593 1.00 . A A . 11 LYS NZ 1 1 12 7178 1 1 11 LYS O O 5.691 4.052 -1.932 1.00 . A A . 11 LYS O 1 1 12 7179 1 1 12 CYS C C 4.320 2.430 0.420 1.00 . A A . 12 CYS C 1 1 12 7180 1 1 12 CYS CA C 3.426 3.127 -0.615 1.00 . A A . 12 CYS CA 1 1 12 7181 1 1 12 CYS CB C 1.966 2.720 -0.456 1.00 . A A . 12 CYS CB 1 1 12 7182 1 1 12 CYS H H 3.312 2.107 -2.453 1.00 . A A . 12 CYS H 1 1 12 7183 1 1 12 CYS HA H 3.518 4.199 -0.507 1.00 . A A . 12 CYS HA 1 1 12 7184 1 1 12 CYS HB2 H 1.795 2.377 0.550 1.00 . A A . 12 CYS HB2 1 1 12 7185 1 1 12 CYS HB3 H 1.337 3.574 -0.656 1.00 . A A . 12 CYS HB3 1 1 12 7186 1 1 12 CYS N N 3.849 2.762 -1.952 1.00 . A A . 12 CYS N 1 1 12 7187 1 1 12 CYS O O 5.241 1.703 0.042 1.00 . A A . 12 CYS O 1 1 12 7188 1 1 12 CYS SG S 1.473 1.395 -1.594 1.00 . A A . 12 CYS SG 1 1 12 7189 1 1 13 PRO C C 5.112 0.624 2.734 1.00 . A A . 13 PRO C 1 1 12 7190 1 1 13 PRO CA C 5.004 2.153 2.776 1.00 . A A . 13 PRO CA 1 1 12 7191 1 1 13 PRO CB C 4.318 2.604 4.061 1.00 . A A . 13 PRO CB 1 1 12 7192 1 1 13 PRO CD C 3.182 3.693 2.273 1.00 . A A . 13 PRO CD 1 1 12 7193 1 1 13 PRO CG C 3.639 3.875 3.692 1.00 . A A . 13 PRO CG 1 1 12 7194 1 1 13 PRO HA H 5.997 2.577 2.734 1.00 . A A . 13 PRO HA 1 1 12 7195 1 1 13 PRO HB2 H 3.610 1.853 4.379 1.00 . A A . 13 PRO HB2 1 1 12 7196 1 1 13 PRO HB3 H 5.055 2.761 4.832 1.00 . A A . 13 PRO HB3 1 1 12 7197 1 1 13 PRO HD2 H 2.176 3.301 2.250 1.00 . A A . 13 PRO HD2 1 1 12 7198 1 1 13 PRO HD3 H 3.237 4.629 1.738 1.00 . A A . 13 PRO HD3 1 1 12 7199 1 1 13 PRO HG2 H 2.792 4.042 4.343 1.00 . A A . 13 PRO HG2 1 1 12 7200 1 1 13 PRO HG3 H 4.334 4.698 3.759 1.00 . A A . 13 PRO HG3 1 1 12 7201 1 1 13 PRO N N 4.143 2.713 1.724 1.00 . A A . 13 PRO N 1 1 12 7202 1 1 13 PRO O O 6.123 0.059 3.156 1.00 . A A . 13 PRO O 1 1 12 7203 1 1 14 THR C C 4.864 -1.968 0.878 1.00 . A A . 14 THR C 1 1 12 7204 1 1 14 THR CA C 4.091 -1.493 2.107 1.00 . A A . 14 THR CA 1 1 12 7205 1 1 14 THR CB C 2.660 -2.050 2.066 1.00 . A A . 14 THR CB 1 1 12 7206 1 1 14 THR CG2 C 2.667 -3.571 2.088 1.00 . A A . 14 THR CG2 1 1 12 7207 1 1 14 THR H H 3.319 0.466 1.873 1.00 . A A . 14 THR H 1 1 12 7208 1 1 14 THR HA H 4.574 -1.888 2.985 1.00 . A A . 14 THR HA 1 1 12 7209 1 1 14 THR HB H 2.182 -1.717 1.156 1.00 . A A . 14 THR HB 1 1 12 7210 1 1 14 THR HG1 H 1.231 -0.945 2.874 1.00 . A A . 14 THR HG1 1 1 12 7211 1 1 14 THR HG21 H 2.849 -3.914 3.094 1.00 . A A . 14 THR HG21 1 1 12 7212 1 1 14 THR HG22 H 3.449 -3.937 1.437 1.00 . A A . 14 THR HG22 1 1 12 7213 1 1 14 THR HG23 H 1.713 -3.940 1.747 1.00 . A A . 14 THR HG23 1 1 12 7214 1 1 14 THR N N 4.088 -0.038 2.214 1.00 . A A . 14 THR N 1 1 12 7215 1 1 14 THR O O 4.586 -1.558 -0.248 1.00 . A A . 14 THR O 1 1 12 7216 1 1 14 THR OG1 O 1.923 -1.558 3.192 1.00 . A A . 14 THR OG1 1 1 12 7217 1 1 15 PRO C C 6.057 -4.219 -0.939 1.00 . A A . 15 PRO C 1 1 12 7218 1 1 15 PRO CA C 6.779 -3.284 0.027 1.00 . A A . 15 PRO CA 1 1 12 7219 1 1 15 PRO CB C 7.882 -4.043 0.778 1.00 . A A . 15 PRO CB 1 1 12 7220 1 1 15 PRO CD C 6.376 -3.229 2.420 1.00 . A A . 15 PRO CD 1 1 12 7221 1 1 15 PRO CG C 7.823 -3.526 2.168 1.00 . A A . 15 PRO CG 1 1 12 7222 1 1 15 PRO HA H 7.218 -2.468 -0.523 1.00 . A A . 15 PRO HA 1 1 12 7223 1 1 15 PRO HB2 H 7.680 -5.104 0.744 1.00 . A A . 15 PRO HB2 1 1 12 7224 1 1 15 PRO HB3 H 8.839 -3.839 0.326 1.00 . A A . 15 PRO HB3 1 1 12 7225 1 1 15 PRO HD2 H 5.859 -4.121 2.742 1.00 . A A . 15 PRO HD2 1 1 12 7226 1 1 15 PRO HD3 H 6.272 -2.443 3.151 1.00 . A A . 15 PRO HD3 1 1 12 7227 1 1 15 PRO HG2 H 8.183 -4.277 2.854 1.00 . A A . 15 PRO HG2 1 1 12 7228 1 1 15 PRO HG3 H 8.412 -2.625 2.250 1.00 . A A . 15 PRO HG3 1 1 12 7229 1 1 15 PRO N N 5.906 -2.790 1.098 1.00 . A A . 15 PRO N 1 1 12 7230 1 1 15 PRO O O 6.259 -4.143 -2.155 1.00 . A A . 15 PRO O 1 1 12 7231 1 1 16 GLY C C 3.290 -5.560 -1.850 1.00 . A A . 16 GLY C 1 1 12 7232 1 1 16 GLY CA C 4.564 -6.101 -1.230 1.00 . A A . 16 GLY CA 1 1 12 7233 1 1 16 GLY H H 5.164 -5.183 0.580 1.00 . A A . 16 GLY H 1 1 12 7234 1 1 16 GLY HA2 H 5.231 -6.410 -2.016 1.00 . A A . 16 GLY HA2 1 1 12 7235 1 1 16 GLY HA3 H 4.318 -6.962 -0.625 1.00 . A A . 16 GLY HA3 1 1 12 7236 1 1 16 GLY N N 5.249 -5.128 -0.399 1.00 . A A . 16 GLY N 1 1 12 7237 1 1 16 GLY O O 2.528 -6.305 -2.471 1.00 . A A . 16 GLY O 1 1 12 7238 1 1 17 CYS C C 2.049 -3.142 -3.605 1.00 . A A . 17 CYS C 1 1 12 7239 1 1 17 CYS CA C 1.842 -3.634 -2.167 1.00 . A A . 17 CYS CA 1 1 12 7240 1 1 17 CYS CB C 1.486 -2.474 -1.252 1.00 . A A . 17 CYS CB 1 1 12 7241 1 1 17 CYS H H 3.673 -3.742 -1.122 1.00 . A A . 17 CYS H 1 1 12 7242 1 1 17 CYS HA H 1.042 -4.355 -2.152 1.00 . A A . 17 CYS HA 1 1 12 7243 1 1 17 CYS HB2 H 1.672 -2.768 -0.231 1.00 . A A . 17 CYS HB2 1 1 12 7244 1 1 17 CYS HB3 H 2.120 -1.633 -1.496 1.00 . A A . 17 CYS HB3 1 1 12 7245 1 1 17 CYS N N 3.040 -4.276 -1.654 1.00 . A A . 17 CYS N 1 1 12 7246 1 1 17 CYS O O 3.123 -3.320 -4.188 1.00 . A A . 17 CYS O 1 1 12 7247 1 1 17 CYS SG S -0.236 -1.907 -1.345 1.00 . A A . 17 CYS SG 1 1 12 7248 1 1 18 ASP C C 0.757 -0.484 -5.537 1.00 . A A . 18 ASP C 1 1 12 7249 1 1 18 ASP CA C 1.097 -1.973 -5.523 1.00 . A A . 18 ASP CA 1 1 12 7250 1 1 18 ASP CB C 0.165 -2.741 -6.476 1.00 . A A . 18 ASP CB 1 1 12 7251 1 1 18 ASP CG C -1.216 -2.123 -6.601 1.00 . A A . 18 ASP CG 1 1 12 7252 1 1 18 ASP H H 0.201 -2.376 -3.638 1.00 . A A . 18 ASP H 1 1 12 7253 1 1 18 ASP HA H 2.114 -2.094 -5.864 1.00 . A A . 18 ASP HA 1 1 12 7254 1 1 18 ASP HB2 H 0.610 -2.770 -7.460 1.00 . A A . 18 ASP HB2 1 1 12 7255 1 1 18 ASP HB3 H 0.052 -3.750 -6.110 1.00 . A A . 18 ASP HB3 1 1 12 7256 1 1 18 ASP N N 1.020 -2.511 -4.166 1.00 . A A . 18 ASP N 1 1 12 7257 1 1 18 ASP O O 1.245 0.265 -6.384 1.00 . A A . 18 ASP O 1 1 12 7258 1 1 18 ASP OD1 O -1.985 -2.170 -5.621 1.00 . A A . 18 ASP OD1 1 1 12 7259 1 1 18 ASP OD2 O -1.542 -1.591 -7.684 1.00 . A A . 18 ASP OD2 1 1 12 7260 1 1 19 GLY C C -1.775 1.682 -4.855 1.00 . A A . 19 GLY C 1 1 12 7261 1 1 19 GLY CA C -0.347 1.369 -4.450 1.00 . A A . 19 GLY CA 1 1 12 7262 1 1 19 GLY H H -0.336 -0.668 -3.872 1.00 . A A . 19 GLY H 1 1 12 7263 1 1 19 GLY HA2 H -0.197 1.686 -3.428 1.00 . A A . 19 GLY HA2 1 1 12 7264 1 1 19 GLY HA3 H 0.324 1.925 -5.088 1.00 . A A . 19 GLY HA3 1 1 12 7265 1 1 19 GLY N N -0.023 -0.043 -4.556 1.00 . A A . 19 GLY N 1 1 12 7266 1 1 19 GLY O O -2.250 2.803 -4.669 1.00 . A A . 19 GLY O 1 1 12 7267 1 1 20 SER C C -4.779 0.009 -4.959 1.00 . A A . 20 SER C 1 1 12 7268 1 1 20 SER CA C -3.855 0.884 -5.791 1.00 . A A . 20 SER CA 1 1 12 7269 1 1 20 SER CB C -4.016 0.564 -7.278 1.00 . A A . 20 SER CB 1 1 12 7270 1 1 20 SER H H -2.062 -0.193 -5.476 1.00 . A A . 20 SER H 1 1 12 7271 1 1 20 SER HA H -4.113 1.919 -5.626 1.00 . A A . 20 SER HA 1 1 12 7272 1 1 20 SER HB2 H -4.325 -0.464 -7.392 1.00 . A A . 20 SER HB2 1 1 12 7273 1 1 20 SER HB3 H -4.767 1.215 -7.706 1.00 . A A . 20 SER HB3 1 1 12 7274 1 1 20 SER HG H -2.230 -0.023 -7.843 1.00 . A A . 20 SER HG 1 1 12 7275 1 1 20 SER N N -2.474 0.696 -5.383 1.00 . A A . 20 SER N 1 1 12 7276 1 1 20 SER O O -4.331 -0.938 -4.313 1.00 . A A . 20 SER O 1 1 12 7277 1 1 20 SER OG O -2.795 0.756 -7.974 1.00 . A A . 20 SER OG 1 1 12 7278 1 1 21 GLY C C -6.895 -0.044 -2.650 1.00 . A A . 21 GLY C 1 1 12 7279 1 1 21 GLY CA C -7.000 -0.372 -4.119 1.00 . A A . 21 GLY CA 1 1 12 7280 1 1 21 GLY H H -6.333 1.189 -5.384 1.00 . A A . 21 GLY H 1 1 12 7281 1 1 21 GLY HA2 H -7.999 -0.148 -4.453 1.00 . A A . 21 GLY HA2 1 1 12 7282 1 1 21 GLY HA3 H -6.814 -1.428 -4.252 1.00 . A A . 21 GLY HA3 1 1 12 7283 1 1 21 GLY N N -6.048 0.377 -4.911 1.00 . A A . 21 GLY N 1 1 12 7284 1 1 21 GLY O O -6.203 0.891 -2.272 1.00 . A A . 21 GLY O 1 1 12 7285 1 1 22 HIS C C -8.032 -1.927 0.284 1.00 . A A . 22 HIS C 1 1 12 7286 1 1 22 HIS CA C -7.622 -0.619 -0.385 1.00 . A A . 22 HIS CA 1 1 12 7287 1 1 22 HIS CB C -8.622 0.473 0.041 1.00 . A A . 22 HIS CB 1 1 12 7288 1 1 22 HIS CD2 C -7.573 2.760 -0.667 1.00 . A A . 22 HIS CD2 1 1 12 7289 1 1 22 HIS CE1 C -7.605 3.732 1.294 1.00 . A A . 22 HIS CE1 1 1 12 7290 1 1 22 HIS CG C -8.069 1.863 0.219 1.00 . A A . 22 HIS CG 1 1 12 7291 1 1 22 HIS H H -8.157 -1.516 -2.231 1.00 . A A . 22 HIS H 1 1 12 7292 1 1 22 HIS HA H -6.624 -0.350 -0.063 1.00 . A A . 22 HIS HA 1 1 12 7293 1 1 22 HIS HB2 H -9.400 0.534 -0.704 1.00 . A A . 22 HIS HB2 1 1 12 7294 1 1 22 HIS HB3 H -9.070 0.178 0.981 1.00 . A A . 22 HIS HB3 1 1 12 7295 1 1 22 HIS HD1 H -8.354 2.113 2.300 1.00 . A A . 22 HIS HD1 1 1 12 7296 1 1 22 HIS HD2 H -7.414 2.597 -1.723 1.00 . A A . 22 HIS HD2 1 1 12 7297 1 1 22 HIS HE1 H -7.498 4.466 2.080 1.00 . A A . 22 HIS HE1 1 1 12 7298 1 1 22 HIS HE2 H -7.028 4.772 -0.372 1.00 . A A . 22 HIS HE2 1 1 12 7299 1 1 22 HIS N N -7.607 -0.798 -1.837 1.00 . A A . 22 HIS N 1 1 12 7300 1 1 22 HIS ND1 N -8.068 2.506 1.441 1.00 . A A . 22 HIS ND1 1 1 12 7301 1 1 22 HIS NE2 N -7.299 3.911 0.028 1.00 . A A . 22 HIS NE2 1 1 12 7302 1 1 22 HIS O O -8.687 -2.765 -0.338 1.00 . A A . 22 HIS O 1 1 12 7303 1 1 23 ILE C C -9.790 -3.025 2.559 1.00 . A A . 23 ILE C 1 1 12 7304 1 1 23 ILE CA C -8.282 -3.173 2.348 1.00 . A A . 23 ILE CA 1 1 12 7305 1 1 23 ILE CB C -7.534 -3.316 3.705 1.00 . A A . 23 ILE CB 1 1 12 7306 1 1 23 ILE CD1 C -7.463 -5.843 3.304 1.00 . A A . 23 ILE CD1 1 1 12 7307 1 1 23 ILE CG1 C -6.697 -4.601 3.720 1.00 . A A . 23 ILE CG1 1 1 12 7308 1 1 23 ILE CG2 C -8.490 -3.291 4.897 1.00 . A A . 23 ILE CG2 1 1 12 7309 1 1 23 ILE H H -7.352 -1.291 2.056 1.00 . A A . 23 ILE H 1 1 12 7310 1 1 23 ILE HA H -8.099 -4.063 1.764 1.00 . A A . 23 ILE HA 1 1 12 7311 1 1 23 ILE HB H -6.868 -2.473 3.805 1.00 . A A . 23 ILE HB 1 1 12 7312 1 1 23 ILE HD11 H -8.518 -5.615 3.253 1.00 . A A . 23 ILE HD11 1 1 12 7313 1 1 23 ILE HD12 H -7.117 -6.171 2.334 1.00 . A A . 23 ILE HD12 1 1 12 7314 1 1 23 ILE HD13 H -7.296 -6.626 4.030 1.00 . A A . 23 ILE HD13 1 1 12 7315 1 1 23 ILE HG12 H -5.864 -4.487 3.042 1.00 . A A . 23 ILE HG12 1 1 12 7316 1 1 23 ILE HG13 H -6.320 -4.762 4.719 1.00 . A A . 23 ILE HG13 1 1 12 7317 1 1 23 ILE HG21 H -7.949 -3.543 5.797 1.00 . A A . 23 ILE HG21 1 1 12 7318 1 1 23 ILE HG22 H -8.915 -2.303 4.997 1.00 . A A . 23 ILE HG22 1 1 12 7319 1 1 23 ILE HG23 H -9.281 -4.008 4.739 1.00 . A A . 23 ILE HG23 1 1 12 7320 1 1 23 ILE N N -7.789 -2.034 1.583 1.00 . A A . 23 ILE N 1 1 12 7321 1 1 23 ILE O O -10.527 -4.011 2.631 1.00 . A A . 23 ILE O 1 1 12 7322 1 1 24 THR C C -12.411 -1.808 1.413 1.00 . A A . 24 THR C 1 1 12 7323 1 1 24 THR CA C -11.668 -1.483 2.713 1.00 . A A . 24 THR CA 1 1 12 7324 1 1 24 THR CB C -11.898 -0.001 3.106 1.00 . A A . 24 THR CB 1 1 12 7325 1 1 24 THR CG2 C -11.508 0.939 1.979 1.00 . A A . 24 THR CG2 1 1 12 7326 1 1 24 THR H H -9.613 -1.036 2.497 1.00 . A A . 24 THR H 1 1 12 7327 1 1 24 THR HA H -12.061 -2.105 3.502 1.00 . A A . 24 THR HA 1 1 12 7328 1 1 24 THR HB H -11.280 0.223 3.964 1.00 . A A . 24 THR HB 1 1 12 7329 1 1 24 THR HG1 H -13.303 0.646 4.334 1.00 . A A . 24 THR HG1 1 1 12 7330 1 1 24 THR HG21 H -10.446 0.867 1.805 1.00 . A A . 24 THR HG21 1 1 12 7331 1 1 24 THR HG22 H -11.762 1.953 2.252 1.00 . A A . 24 THR HG22 1 1 12 7332 1 1 24 THR HG23 H -12.040 0.665 1.081 1.00 . A A . 24 THR HG23 1 1 12 7333 1 1 24 THR N N -10.250 -1.778 2.581 1.00 . A A . 24 THR N 1 1 12 7334 1 1 24 THR O O -13.614 -2.063 1.423 1.00 . A A . 24 THR O 1 1 12 7335 1 1 24 THR OG1 O -13.266 0.226 3.459 1.00 . A A . 24 THR OG1 1 1 12 7336 1 1 25 GLY C C -13.306 -1.158 -1.392 1.00 . A A . 25 GLY C 1 1 12 7337 1 1 25 GLY CA C -12.267 -2.181 -0.979 1.00 . A A . 25 GLY CA 1 1 12 7338 1 1 25 GLY H H -10.706 -1.706 0.367 1.00 . A A . 25 GLY H 1 1 12 7339 1 1 25 GLY HA2 H -11.489 -2.215 -1.729 1.00 . A A . 25 GLY HA2 1 1 12 7340 1 1 25 GLY HA3 H -12.735 -3.152 -0.914 1.00 . A A . 25 GLY HA3 1 1 12 7341 1 1 25 GLY N N -11.669 -1.858 0.306 1.00 . A A . 25 GLY N 1 1 12 7342 1 1 25 GLY O O -14.390 -1.516 -1.857 1.00 . A A . 25 GLY O 1 1 12 7343 1 1 26 ASN C C -13.356 2.352 -2.067 1.00 . A A . 26 ASN C 1 1 12 7344 1 1 26 ASN CA C -13.987 1.175 -1.329 1.00 . A A . 26 ASN CA 1 1 12 7345 1 1 26 ASN CB C -14.540 1.651 0.017 1.00 . A A . 26 ASN CB 1 1 12 7346 1 1 26 ASN CG C -15.707 0.816 0.492 1.00 . A A . 26 ASN CG 1 1 12 7347 1 1 26 ASN H H -12.182 0.311 -0.657 1.00 . A A . 26 ASN H 1 1 12 7348 1 1 26 ASN HA H -14.797 0.779 -1.923 1.00 . A A . 26 ASN HA 1 1 12 7349 1 1 26 ASN HB2 H -13.757 1.592 0.758 1.00 . A A . 26 ASN HB2 1 1 12 7350 1 1 26 ASN HB3 H -14.867 2.676 -0.071 1.00 . A A . 26 ASN HB3 1 1 12 7351 1 1 26 ASN HD21 H -14.892 0.675 2.298 1.00 . A A . 26 ASN HD21 1 1 12 7352 1 1 26 ASN HD22 H -16.404 -0.139 2.082 1.00 . A A . 26 ASN HD22 1 1 12 7353 1 1 26 ASN N N -13.023 0.106 -1.108 1.00 . A A . 26 ASN N 1 1 12 7354 1 1 26 ASN ND2 N -15.665 0.414 1.748 1.00 . A A . 26 ASN ND2 1 1 12 7355 1 1 26 ASN O O -13.975 3.405 -2.214 1.00 . A A . 26 ASN O 1 1 12 7356 1 1 26 ASN OD1 O -16.634 0.526 -0.265 1.00 . A A . 26 ASN OD1 1 1 12 7357 1 1 27 TYR C C -10.728 2.789 -4.410 1.00 . A A . 27 TYR C 1 1 12 7358 1 1 27 TYR CA C -11.381 3.275 -3.125 1.00 . A A . 27 TYR CA 1 1 12 7359 1 1 27 TYR CB C -10.317 3.845 -2.190 1.00 . A A . 27 TYR CB 1 1 12 7360 1 1 27 TYR CD1 C -11.382 4.017 0.094 1.00 . A A . 27 TYR CD1 1 1 12 7361 1 1 27 TYR CD2 C -10.907 6.033 -1.085 1.00 . A A . 27 TYR CD2 1 1 12 7362 1 1 27 TYR CE1 C -11.902 4.749 1.143 1.00 . A A . 27 TYR CE1 1 1 12 7363 1 1 27 TYR CE2 C -11.425 6.771 -0.038 1.00 . A A . 27 TYR CE2 1 1 12 7364 1 1 27 TYR CG C -10.877 4.646 -1.038 1.00 . A A . 27 TYR CG 1 1 12 7365 1 1 27 TYR CZ C -11.922 6.125 1.073 1.00 . A A . 27 TYR CZ 1 1 12 7366 1 1 27 TYR H H -11.636 1.352 -2.299 1.00 . A A . 27 TYR H 1 1 12 7367 1 1 27 TYR HA H -12.090 4.052 -3.365 1.00 . A A . 27 TYR HA 1 1 12 7368 1 1 27 TYR HB2 H -9.735 3.035 -1.780 1.00 . A A . 27 TYR HB2 1 1 12 7369 1 1 27 TYR HB3 H -9.668 4.487 -2.757 1.00 . A A . 27 TYR HB3 1 1 12 7370 1 1 27 TYR HD1 H -11.366 2.937 0.149 1.00 . A A . 27 TYR HD1 1 1 12 7371 1 1 27 TYR HD2 H -10.518 6.539 -1.957 1.00 . A A . 27 TYR HD2 1 1 12 7372 1 1 27 TYR HE1 H -12.288 4.240 2.013 1.00 . A A . 27 TYR HE1 1 1 12 7373 1 1 27 TYR HE2 H -11.438 7.850 -0.093 1.00 . A A . 27 TYR HE2 1 1 12 7374 1 1 27 TYR HH H -13.101 7.483 1.782 1.00 . A A . 27 TYR HH 1 1 12 7375 1 1 27 TYR N N -12.100 2.199 -2.467 1.00 . A A . 27 TYR N 1 1 12 7376 1 1 27 TYR O O -10.831 1.614 -4.767 1.00 . A A . 27 TYR O 1 1 12 7377 1 1 27 TYR OH O -12.437 6.856 2.120 1.00 . A A . 27 TYR OH 1 1 12 7378 1 1 28 ALA C C -7.850 3.132 -6.060 1.00 . A A . 28 ALA C 1 1 12 7379 1 1 28 ALA CA C -9.333 3.356 -6.315 1.00 . A A . 28 ALA CA 1 1 12 7380 1 1 28 ALA CB C -9.536 4.456 -7.345 1.00 . A A . 28 ALA CB 1 1 12 7381 1 1 28 ALA H H -9.947 4.603 -4.722 1.00 . A A . 28 ALA H 1 1 12 7382 1 1 28 ALA HA H -9.765 2.446 -6.704 1.00 . A A . 28 ALA HA 1 1 12 7383 1 1 28 ALA HB1 H -10.093 4.065 -8.183 1.00 . A A . 28 ALA HB1 1 1 12 7384 1 1 28 ALA HB2 H -10.084 5.272 -6.898 1.00 . A A . 28 ALA HB2 1 1 12 7385 1 1 28 ALA HB3 H -8.575 4.813 -7.686 1.00 . A A . 28 ALA HB3 1 1 12 7386 1 1 28 ALA N N -10.022 3.689 -5.080 1.00 . A A . 28 ALA N 1 1 12 7387 1 1 28 ALA O O -7.253 2.197 -6.596 1.00 . A A . 28 ALA O 1 1 12 7388 1 1 29 SER C C -5.528 4.522 -3.570 1.00 . A A . 29 SER C 1 1 12 7389 1 1 29 SER CA C -5.840 3.881 -4.918 1.00 . A A . 29 SER CA 1 1 12 7390 1 1 29 SER CB C -4.996 4.540 -6.015 1.00 . A A . 29 SER CB 1 1 12 7391 1 1 29 SER H H -7.794 4.700 -4.813 1.00 . A A . 29 SER H 1 1 12 7392 1 1 29 SER HA H -5.586 2.835 -4.867 1.00 . A A . 29 SER HA 1 1 12 7393 1 1 29 SER HB2 H -4.386 5.312 -5.576 1.00 . A A . 29 SER HB2 1 1 12 7394 1 1 29 SER HB3 H -4.358 3.796 -6.472 1.00 . A A . 29 SER HB3 1 1 12 7395 1 1 29 SER HG H -5.306 5.181 -7.846 1.00 . A A . 29 SER HG 1 1 12 7396 1 1 29 SER N N -7.261 3.982 -5.229 1.00 . A A . 29 SER N 1 1 12 7397 1 1 29 SER O O -6.420 5.029 -2.889 1.00 . A A . 29 SER O 1 1 12 7398 1 1 29 SER OG O -5.811 5.121 -7.018 1.00 . A A . 29 SER OG 1 1 12 7399 1 1 30 HIS C C -2.311 5.254 -1.960 1.00 . A A . 30 HIS C 1 1 12 7400 1 1 30 HIS CA C -3.811 4.983 -1.903 1.00 . A A . 30 HIS CA 1 1 12 7401 1 1 30 HIS CB C -4.104 3.995 -0.773 1.00 . A A . 30 HIS CB 1 1 12 7402 1 1 30 HIS CD2 C -2.115 2.378 -0.466 1.00 . A A . 30 HIS CD2 1 1 12 7403 1 1 30 HIS CE1 C -2.861 0.670 -1.565 1.00 . A A . 30 HIS CE1 1 1 12 7404 1 1 30 HIS CG C -3.354 2.706 -0.900 1.00 . A A . 30 HIS CG 1 1 12 7405 1 1 30 HIS H H -3.623 3.958 -3.734 1.00 . A A . 30 HIS H 1 1 12 7406 1 1 30 HIS HA H -4.337 5.908 -1.719 1.00 . A A . 30 HIS HA 1 1 12 7407 1 1 30 HIS HB2 H -3.828 4.448 0.160 1.00 . A A . 30 HIS HB2 1 1 12 7408 1 1 30 HIS HB3 H -5.158 3.769 -0.760 1.00 . A A . 30 HIS HB3 1 1 12 7409 1 1 30 HIS HD1 H -4.706 1.511 -2.012 1.00 . A A . 30 HIS HD1 1 1 12 7410 1 1 30 HIS HD2 H -1.459 2.995 0.130 1.00 . A A . 30 HIS HD2 1 1 12 7411 1 1 30 HIS HE1 H -2.932 -0.302 -2.033 1.00 . A A . 30 HIS HE1 1 1 12 7412 1 1 30 HIS N N -4.268 4.439 -3.172 1.00 . A A . 30 HIS N 1 1 12 7413 1 1 30 HIS ND1 N -3.819 1.604 -1.592 1.00 . A A . 30 HIS ND1 1 1 12 7414 1 1 30 HIS NE2 N -1.826 1.105 -0.897 1.00 . A A . 30 HIS NE2 1 1 12 7415 1 1 30 HIS O O -1.665 4.943 -2.955 1.00 . A A . 30 HIS O 1 1 12 7416 1 1 31 ARG C C 0.092 5.826 0.754 1.00 . A A . 31 ARG C 1 1 12 7417 1 1 31 ARG CA C -0.298 5.802 -0.712 1.00 . A A . 31 ARG CA 1 1 12 7418 1 1 31 ARG CB C 0.214 7.049 -1.434 1.00 . A A . 31 ARG CB 1 1 12 7419 1 1 31 ARG CD C 1.445 5.621 -3.099 1.00 . A A . 31 ARG CD 1 1 12 7420 1 1 31 ARG CG C 1.528 6.818 -2.159 1.00 . A A . 31 ARG CG 1 1 12 7421 1 1 31 ARG CZ C 0.867 5.783 -5.490 1.00 . A A . 31 ARG CZ 1 1 12 7422 1 1 31 ARG H H -2.300 5.801 -0.040 1.00 . A A . 31 ARG H 1 1 12 7423 1 1 31 ARG HA H 0.143 4.928 -1.164 1.00 . A A . 31 ARG HA 1 1 12 7424 1 1 31 ARG HB2 H -0.523 7.363 -2.156 1.00 . A A . 31 ARG HB2 1 1 12 7425 1 1 31 ARG HB3 H 0.359 7.838 -0.711 1.00 . A A . 31 ARG HB3 1 1 12 7426 1 1 31 ARG HD2 H 2.159 4.879 -2.782 1.00 . A A . 31 ARG HD2 1 1 12 7427 1 1 31 ARG HD3 H 0.449 5.209 -3.044 1.00 . A A . 31 ARG HD3 1 1 12 7428 1 1 31 ARG HE H 2.604 6.377 -4.682 1.00 . A A . 31 ARG HE 1 1 12 7429 1 1 31 ARG HG2 H 1.774 7.700 -2.731 1.00 . A A . 31 ARG HG2 1 1 12 7430 1 1 31 ARG HG3 H 2.299 6.634 -1.425 1.00 . A A . 31 ARG HG3 1 1 12 7431 1 1 31 ARG HH11 H -0.628 5.051 -4.320 1.00 . A A . 31 ARG HH11 1 1 12 7432 1 1 31 ARG HH12 H -0.975 5.134 -6.023 1.00 . A A . 31 ARG HH12 1 1 12 7433 1 1 31 ARG HH21 H 2.124 6.468 -6.918 1.00 . A A . 31 ARG HH21 1 1 12 7434 1 1 31 ARG HH22 H 0.571 5.933 -7.487 1.00 . A A . 31 ARG HH22 1 1 12 7435 1 1 31 ARG N N -1.744 5.675 -0.838 1.00 . A A . 31 ARG N 1 1 12 7436 1 1 31 ARG NE N 1.725 5.982 -4.487 1.00 . A A . 31 ARG NE 1 1 12 7437 1 1 31 ARG NH1 N -0.341 5.284 -5.260 1.00 . A A . 31 ARG NH1 1 1 12 7438 1 1 31 ARG NH2 N 1.215 6.088 -6.730 1.00 . A A . 31 ARG NH2 1 1 12 7439 1 1 31 ARG O O 0.974 6.572 1.176 1.00 . A A . 31 ARG O 1 1 12 7440 1 1 32 SER C C -0.765 3.530 3.442 1.00 . A A . 32 SER C 1 1 12 7441 1 1 32 SER CA C -0.374 4.919 2.956 1.00 . A A . 32 SER CA 1 1 12 7442 1 1 32 SER CB C -1.190 5.991 3.685 1.00 . A A . 32 SER CB 1 1 12 7443 1 1 32 SER H H -1.293 4.452 1.123 1.00 . A A . 32 SER H 1 1 12 7444 1 1 32 SER HA H 0.676 5.080 3.143 1.00 . A A . 32 SER HA 1 1 12 7445 1 1 32 SER HB2 H -1.785 5.523 4.453 1.00 . A A . 32 SER HB2 1 1 12 7446 1 1 32 SER HB3 H -0.519 6.707 4.135 1.00 . A A . 32 SER HB3 1 1 12 7447 1 1 32 SER HG H -2.918 6.806 3.209 1.00 . A A . 32 SER HG 1 1 12 7448 1 1 32 SER N N -0.603 5.014 1.527 1.00 . A A . 32 SER N 1 1 12 7449 1 1 32 SER O O -1.475 2.808 2.740 1.00 . A A . 32 SER O 1 1 12 7450 1 1 32 SER OG O -2.055 6.675 2.786 1.00 . A A . 32 SER OG 1 1 12 7451 1 1 33 LEU C C -2.148 1.833 5.668 1.00 . A A . 33 LEU C 1 1 12 7452 1 1 33 LEU CA C -0.693 1.880 5.228 1.00 . A A . 33 LEU CA 1 1 12 7453 1 1 33 LEU CB C 0.213 1.574 6.420 1.00 . A A . 33 LEU CB 1 1 12 7454 1 1 33 LEU CD1 C 2.412 2.481 7.196 1.00 . A A . 33 LEU CD1 1 1 12 7455 1 1 33 LEU CD2 C 2.308 0.261 6.053 1.00 . A A . 33 LEU CD2 1 1 12 7456 1 1 33 LEU CG C 1.710 1.655 6.132 1.00 . A A . 33 LEU CG 1 1 12 7457 1 1 33 LEU H H 0.165 3.820 5.192 1.00 . A A . 33 LEU H 1 1 12 7458 1 1 33 LEU HA H -0.533 1.141 4.461 1.00 . A A . 33 LEU HA 1 1 12 7459 1 1 33 LEU HB2 H -0.020 2.274 7.209 1.00 . A A . 33 LEU HB2 1 1 12 7460 1 1 33 LEU HB3 H -0.010 0.577 6.768 1.00 . A A . 33 LEU HB3 1 1 12 7461 1 1 33 LEU HD11 H 3.312 2.907 6.782 1.00 . A A . 33 LEU HD11 1 1 12 7462 1 1 33 LEU HD12 H 1.756 3.274 7.526 1.00 . A A . 33 LEU HD12 1 1 12 7463 1 1 33 LEU HD13 H 2.663 1.849 8.036 1.00 . A A . 33 LEU HD13 1 1 12 7464 1 1 33 LEU HD21 H 1.557 -0.434 5.704 1.00 . A A . 33 LEU HD21 1 1 12 7465 1 1 33 LEU HD22 H 3.140 0.267 5.365 1.00 . A A . 33 LEU HD22 1 1 12 7466 1 1 33 LEU HD23 H 2.651 -0.039 7.032 1.00 . A A . 33 LEU HD23 1 1 12 7467 1 1 33 LEU HG H 1.861 2.140 5.180 1.00 . A A . 33 LEU HG 1 1 12 7468 1 1 33 LEU N N -0.375 3.187 4.665 1.00 . A A . 33 LEU N 1 1 12 7469 1 1 33 LEU O O -2.696 0.765 5.931 1.00 . A A . 33 LEU O 1 1 12 7470 1 1 34 SER C C -5.013 2.626 4.659 1.00 . A A . 34 SER C 1 1 12 7471 1 1 34 SER CA C -4.217 3.082 5.880 1.00 . A A . 34 SER CA 1 1 12 7472 1 1 34 SER CB C -4.561 4.527 6.224 1.00 . A A . 34 SER CB 1 1 12 7473 1 1 34 SER H H -2.316 3.787 5.323 1.00 . A A . 34 SER H 1 1 12 7474 1 1 34 SER HA H -4.451 2.445 6.719 1.00 . A A . 34 SER HA 1 1 12 7475 1 1 34 SER HB2 H -5.212 4.929 5.461 1.00 . A A . 34 SER HB2 1 1 12 7476 1 1 34 SER HB3 H -5.061 4.560 7.180 1.00 . A A . 34 SER HB3 1 1 12 7477 1 1 34 SER HG H -3.633 6.247 6.454 1.00 . A A . 34 SER HG 1 1 12 7478 1 1 34 SER N N -2.796 2.984 5.611 1.00 . A A . 34 SER N 1 1 12 7479 1 1 34 SER O O -6.236 2.487 4.708 1.00 . A A . 34 SER O 1 1 12 7480 1 1 34 SER OG O -3.385 5.323 6.294 1.00 . A A . 34 SER OG 1 1 12 7481 1 1 35 GLY C C -4.360 0.659 1.828 1.00 . A A . 35 GLY C 1 1 12 7482 1 1 35 GLY CA C -4.940 1.953 2.350 1.00 . A A . 35 GLY CA 1 1 12 7483 1 1 35 GLY H H -3.329 2.519 3.587 1.00 . A A . 35 GLY H 1 1 12 7484 1 1 35 GLY HA2 H -5.994 1.811 2.541 1.00 . A A . 35 GLY HA2 1 1 12 7485 1 1 35 GLY HA3 H -4.821 2.716 1.598 1.00 . A A . 35 GLY HA3 1 1 12 7486 1 1 35 GLY N N -4.302 2.393 3.564 1.00 . A A . 35 GLY N 1 1 12 7487 1 1 35 GLY O O -4.993 -0.015 1.018 1.00 . A A . 35 GLY O 1 1 12 7488 1 1 36 CYS C C -3.179 -2.129 2.096 1.00 . A A . 36 CYS C 1 1 12 7489 1 1 36 CYS CA C -2.417 -0.838 1.795 1.00 . A A . 36 CYS CA 1 1 12 7490 1 1 36 CYS CB C -1.041 -0.898 2.461 1.00 . A A . 36 CYS CB 1 1 12 7491 1 1 36 CYS H H -2.678 0.961 2.866 1.00 . A A . 36 CYS H 1 1 12 7492 1 1 36 CYS HA H -2.284 -0.751 0.727 1.00 . A A . 36 CYS HA 1 1 12 7493 1 1 36 CYS HB2 H -1.146 -0.632 3.506 1.00 . A A . 36 CYS HB2 1 1 12 7494 1 1 36 CYS HB3 H -0.657 -1.907 2.385 1.00 . A A . 36 CYS HB3 1 1 12 7495 1 1 36 CYS N N -3.135 0.346 2.254 1.00 . A A . 36 CYS N 1 1 12 7496 1 1 36 CYS O O -3.283 -2.545 3.252 1.00 . A A . 36 CYS O 1 1 12 7497 1 1 36 CYS SG S 0.197 0.219 1.732 1.00 . A A . 36 CYS SG 1 1 12 7498 1 1 37 PRO C C -3.464 -5.241 1.350 1.00 . A A . 37 PRO C 1 1 12 7499 1 1 37 PRO CA C -4.418 -4.057 1.207 1.00 . A A . 37 PRO CA 1 1 12 7500 1 1 37 PRO CB C -5.211 -4.165 -0.095 1.00 . A A . 37 PRO CB 1 1 12 7501 1 1 37 PRO CD C -3.692 -2.334 -0.347 1.00 . A A . 37 PRO CD 1 1 12 7502 1 1 37 PRO CG C -4.385 -3.440 -1.097 1.00 . A A . 37 PRO CG 1 1 12 7503 1 1 37 PRO HA H -5.097 -4.035 2.047 1.00 . A A . 37 PRO HA 1 1 12 7504 1 1 37 PRO HB2 H -5.331 -5.205 -0.361 1.00 . A A . 37 PRO HB2 1 1 12 7505 1 1 37 PRO HB3 H -6.178 -3.702 0.030 1.00 . A A . 37 PRO HB3 1 1 12 7506 1 1 37 PRO HD2 H -2.682 -2.209 -0.701 1.00 . A A . 37 PRO HD2 1 1 12 7507 1 1 37 PRO HD3 H -4.242 -1.410 -0.452 1.00 . A A . 37 PRO HD3 1 1 12 7508 1 1 37 PRO HG2 H -3.656 -4.111 -1.530 1.00 . A A . 37 PRO HG2 1 1 12 7509 1 1 37 PRO HG3 H -5.021 -3.027 -1.866 1.00 . A A . 37 PRO HG3 1 1 12 7510 1 1 37 PRO N N -3.708 -2.791 1.056 1.00 . A A . 37 PRO N 1 1 12 7511 1 1 37 PRO O O -3.879 -6.346 1.698 1.00 . A A . 37 PRO O 1 1 12 7512 1 1 38 ARG C C -0.195 -5.822 2.264 1.00 . A A . 38 ARG C 1 1 12 7513 1 1 38 ARG CA C -1.187 -6.074 1.140 1.00 . A A . 38 ARG CA 1 1 12 7514 1 1 38 ARG CB C -0.435 -6.207 -0.184 1.00 . A A . 38 ARG CB 1 1 12 7515 1 1 38 ARG CD C -1.137 -6.549 -2.530 1.00 . A A . 38 ARG CD 1 1 12 7516 1 1 38 ARG CG C -1.077 -7.165 -1.153 1.00 . A A . 38 ARG CG 1 1 12 7517 1 1 38 ARG CZ C -2.844 -5.257 -3.732 1.00 . A A . 38 ARG CZ 1 1 12 7518 1 1 38 ARG H H -1.907 -4.113 0.786 1.00 . A A . 38 ARG H 1 1 12 7519 1 1 38 ARG HA H -1.707 -6.999 1.339 1.00 . A A . 38 ARG HA 1 1 12 7520 1 1 38 ARG HB2 H -0.387 -5.243 -0.664 1.00 . A A . 38 ARG HB2 1 1 12 7521 1 1 38 ARG HB3 H 0.570 -6.551 0.018 1.00 . A A . 38 ARG HB3 1 1 12 7522 1 1 38 ARG HD2 H -0.585 -5.622 -2.516 1.00 . A A . 38 ARG HD2 1 1 12 7523 1 1 38 ARG HD3 H -0.683 -7.222 -3.233 1.00 . A A . 38 ARG HD3 1 1 12 7524 1 1 38 ARG HE H -3.214 -6.874 -2.608 1.00 . A A . 38 ARG HE 1 1 12 7525 1 1 38 ARG HG2 H -0.494 -8.073 -1.194 1.00 . A A . 38 ARG HG2 1 1 12 7526 1 1 38 ARG HG3 H -2.080 -7.388 -0.820 1.00 . A A . 38 ARG HG3 1 1 12 7527 1 1 38 ARG HH11 H -0.947 -4.589 -3.958 1.00 . A A . 38 ARG HH11 1 1 12 7528 1 1 38 ARG HH12 H -2.158 -3.654 -4.785 1.00 . A A . 38 ARG HH12 1 1 12 7529 1 1 38 ARG HH21 H -4.829 -5.661 -3.681 1.00 . A A . 38 ARG HH21 1 1 12 7530 1 1 38 ARG HH22 H -4.366 -4.296 -4.661 1.00 . A A . 38 ARG HH22 1 1 12 7531 1 1 38 ARG N N -2.184 -5.013 1.067 1.00 . A A . 38 ARG N 1 1 12 7532 1 1 38 ARG NE N -2.507 -6.272 -2.944 1.00 . A A . 38 ARG NE 1 1 12 7533 1 1 38 ARG NH1 N -1.906 -4.440 -4.197 1.00 . A A . 38 ARG NH1 1 1 12 7534 1 1 38 ARG NH2 N -4.113 -5.053 -4.043 1.00 . A A . 38 ARG NH2 1 1 12 7535 1 1 38 ARG O O 0.961 -6.235 2.179 1.00 . A A . 38 ARG O 1 1 12 7536 1 1 39 ALA C C 0.817 -6.145 5.023 1.00 . A A . 39 ALA C 1 1 12 7537 1 1 39 ALA CA C 0.181 -4.871 4.477 1.00 . A A . 39 ALA CA 1 1 12 7538 1 1 39 ALA CB C -0.643 -4.183 5.553 1.00 . A A . 39 ALA CB 1 1 12 7539 1 1 39 ALA H H -1.590 -4.868 3.323 1.00 . A A . 39 ALA H 1 1 12 7540 1 1 39 ALA HA H 0.962 -4.193 4.164 1.00 . A A . 39 ALA HA 1 1 12 7541 1 1 39 ALA HB1 H -1.104 -3.300 5.141 1.00 . A A . 39 ALA HB1 1 1 12 7542 1 1 39 ALA HB2 H -1.409 -4.858 5.904 1.00 . A A . 39 ALA HB2 1 1 12 7543 1 1 39 ALA HB3 H -0.001 -3.905 6.375 1.00 . A A . 39 ALA HB3 1 1 12 7544 1 1 39 ALA N N -0.657 -5.161 3.318 1.00 . A A . 39 ALA N 1 1 12 7545 1 1 39 ALA O O 0.210 -7.218 4.977 1.00 . A A . 39 ALA O 1 1 12 7546 1 1 40 LYS C C 2.168 -7.619 7.365 1.00 . A A . 40 LYS C 1 1 12 7547 1 1 40 LYS CA C 2.760 -7.199 6.020 1.00 . A A . 40 LYS CA 1 1 12 7548 1 1 40 LYS CB C 4.274 -6.952 6.162 1.00 . A A . 40 LYS CB 1 1 12 7549 1 1 40 LYS CD C 4.434 -4.825 7.497 1.00 . A A . 40 LYS CD 1 1 12 7550 1 1 40 LYS CE C 5.356 -3.640 7.723 1.00 . A A . 40 LYS CE 1 1 12 7551 1 1 40 LYS CG C 4.702 -5.490 6.158 1.00 . A A . 40 LYS CG 1 1 12 7552 1 1 40 LYS H H 2.484 -5.157 5.498 1.00 . A A . 40 LYS H 1 1 12 7553 1 1 40 LYS HA H 2.609 -8.005 5.314 1.00 . A A . 40 LYS HA 1 1 12 7554 1 1 40 LYS HB2 H 4.607 -7.391 7.090 1.00 . A A . 40 LYS HB2 1 1 12 7555 1 1 40 LYS HB3 H 4.779 -7.451 5.346 1.00 . A A . 40 LYS HB3 1 1 12 7556 1 1 40 LYS HD2 H 3.411 -4.480 7.517 1.00 . A A . 40 LYS HD2 1 1 12 7557 1 1 40 LYS HD3 H 4.587 -5.547 8.287 1.00 . A A . 40 LYS HD3 1 1 12 7558 1 1 40 LYS HE2 H 5.393 -3.423 8.780 1.00 . A A . 40 LYS HE2 1 1 12 7559 1 1 40 LYS HE3 H 6.346 -3.897 7.374 1.00 . A A . 40 LYS HE3 1 1 12 7560 1 1 40 LYS HG2 H 5.761 -5.437 5.952 1.00 . A A . 40 LYS HG2 1 1 12 7561 1 1 40 LYS HG3 H 4.162 -4.965 5.387 1.00 . A A . 40 LYS HG3 1 1 12 7562 1 1 40 LYS HZ1 H 5.661 -2.023 6.433 1.00 . A A . 40 LYS HZ1 1 1 12 7563 1 1 40 LYS HZ2 H 4.542 -1.715 7.674 1.00 . A A . 40 LYS HZ2 1 1 12 7564 1 1 40 LYS HZ3 H 4.101 -2.684 6.353 1.00 . A A . 40 LYS HZ3 1 1 12 7565 1 1 40 LYS N N 2.050 -6.037 5.496 1.00 . A A . 40 LYS N 1 1 12 7566 1 1 40 LYS NZ N 4.884 -2.433 6.996 1.00 . A A . 40 LYS NZ 1 1 12 7567 1 1 40 LYS O O 1.874 -6.777 8.216 1.00 . A A . 40 LYS O 1 1 12 7568 1 1 41 LYS C C 2.417 -9.841 9.760 1.00 . A A . 41 LYS C 1 1 12 7569 1 1 41 LYS CA C 1.347 -9.435 8.751 1.00 . A A . 41 LYS CA 1 1 12 7570 1 1 41 LYS CB C 0.447 -10.632 8.428 1.00 . A A . 41 LYS CB 1 1 12 7571 1 1 41 LYS CD C -1.411 -9.537 7.123 1.00 . A A . 41 LYS CD 1 1 12 7572 1 1 41 LYS CE C -1.154 -10.364 5.873 1.00 . A A . 41 LYS CE 1 1 12 7573 1 1 41 LYS CG C -1.035 -10.296 8.390 1.00 . A A . 41 LYS CG 1 1 12 7574 1 1 41 LYS H H 2.206 -9.539 6.815 1.00 . A A . 41 LYS H 1 1 12 7575 1 1 41 LYS HA H 0.744 -8.649 9.183 1.00 . A A . 41 LYS HA 1 1 12 7576 1 1 41 LYS HB2 H 0.727 -11.026 7.463 1.00 . A A . 41 LYS HB2 1 1 12 7577 1 1 41 LYS HB3 H 0.602 -11.394 9.178 1.00 . A A . 41 LYS HB3 1 1 12 7578 1 1 41 LYS HD2 H -2.460 -9.279 7.164 1.00 . A A . 41 LYS HD2 1 1 12 7579 1 1 41 LYS HD3 H -0.820 -8.632 7.071 1.00 . A A . 41 LYS HD3 1 1 12 7580 1 1 41 LYS HE2 H -0.865 -9.700 5.071 1.00 . A A . 41 LYS HE2 1 1 12 7581 1 1 41 LYS HE3 H -0.346 -11.054 6.074 1.00 . A A . 41 LYS HE3 1 1 12 7582 1 1 41 LYS HG2 H -1.600 -11.214 8.431 1.00 . A A . 41 LYS HG2 1 1 12 7583 1 1 41 LYS HG3 H -1.274 -9.686 9.249 1.00 . A A . 41 LYS HG3 1 1 12 7584 1 1 41 LYS HZ1 H -2.136 -11.686 4.589 1.00 . A A . 41 LYS HZ1 1 1 12 7585 1 1 41 LYS HZ2 H -3.145 -10.487 5.236 1.00 . A A . 41 LYS HZ2 1 1 12 7586 1 1 41 LYS HZ3 H -2.649 -11.789 6.199 1.00 . A A . 41 LYS HZ3 1 1 12 7587 1 1 41 LYS N N 1.957 -8.915 7.533 1.00 . A A . 41 LYS N 1 1 12 7588 1 1 41 LYS NZ N -2.354 -11.134 5.446 1.00 . A A . 41 LYS NZ 1 1 12 7589 1 1 41 LYS O O 2.808 -9.048 10.618 1.00 . A A . 41 LYS O 1 1 12 7590 1 1 42 SER C C 5.311 -11.500 9.827 1.00 . A A . 42 SER C 1 1 12 7591 1 1 42 SER CA C 3.948 -11.567 10.508 1.00 . A A . 42 SER CA 1 1 12 7592 1 1 42 SER CB C 3.622 -13.004 10.913 1.00 . A A . 42 SER CB 1 1 12 7593 1 1 42 SER H H 2.583 -11.633 8.897 1.00 . A A . 42 SER H 1 1 12 7594 1 1 42 SER HA H 3.966 -10.946 11.391 1.00 . A A . 42 SER HA 1 1 12 7595 1 1 42 SER HB2 H 4.193 -13.689 10.304 1.00 . A A . 42 SER HB2 1 1 12 7596 1 1 42 SER HB3 H 3.871 -13.150 11.953 1.00 . A A . 42 SER HB3 1 1 12 7597 1 1 42 SER HG H 1.728 -12.720 11.341 1.00 . A A . 42 SER HG 1 1 12 7598 1 1 42 SER N N 2.912 -11.059 9.626 1.00 . A A . 42 SER N 1 1 12 7599 1 1 42 SER O O 6.304 -11.088 10.430 1.00 . A A . 42 SER O 1 1 12 7600 1 1 42 SER OG O 2.240 -13.274 10.732 1.00 . A A . 42 SER OG 1 1 12 7601 1 1 43 GLY C C 6.800 -10.326 7.276 1.00 . A A . 43 GLY C 1 1 12 7602 1 1 43 GLY CA C 6.548 -11.735 7.766 1.00 . A A . 43 GLY CA 1 1 12 7603 1 1 43 GLY H H 4.488 -12.076 8.099 1.00 . A A . 43 GLY H 1 1 12 7604 1 1 43 GLY HA2 H 7.380 -12.050 8.376 1.00 . A A . 43 GLY HA2 1 1 12 7605 1 1 43 GLY HA3 H 6.468 -12.392 6.912 1.00 . A A . 43 GLY HA3 1 1 12 7606 1 1 43 GLY N N 5.330 -11.825 8.541 1.00 . A A . 43 GLY N 1 1 12 7607 1 1 43 GLY O O 6.803 -10.070 6.074 1.00 . A A . 43 GLY O 1 1 12 7608 1 1 44 LEU C C 8.447 -7.852 7.032 1.00 . A A . 44 LEU C 1 1 12 7609 1 1 44 LEU CA C 7.200 -8.004 7.890 1.00 . A A . 44 LEU CA 1 1 12 7610 1 1 44 LEU CB C 7.333 -7.175 9.172 1.00 . A A . 44 LEU CB 1 1 12 7611 1 1 44 LEU CD1 C 7.279 -7.929 11.564 1.00 . A A . 44 LEU CD1 1 1 12 7612 1 1 44 LEU CD2 C 5.402 -6.565 10.644 1.00 . A A . 44 LEU CD2 1 1 12 7613 1 1 44 LEU CG C 6.442 -7.626 10.332 1.00 . A A . 44 LEU CG 1 1 12 7614 1 1 44 LEU H H 6.940 -9.677 9.159 1.00 . A A . 44 LEU H 1 1 12 7615 1 1 44 LEU HA H 6.348 -7.654 7.331 1.00 . A A . 44 LEU HA 1 1 12 7616 1 1 44 LEU HB2 H 8.361 -7.216 9.498 1.00 . A A . 44 LEU HB2 1 1 12 7617 1 1 44 LEU HB3 H 7.089 -6.148 8.938 1.00 . A A . 44 LEU HB3 1 1 12 7618 1 1 44 LEU HD11 H 7.213 -7.102 12.256 1.00 . A A . 44 LEU HD11 1 1 12 7619 1 1 44 LEU HD12 H 6.911 -8.826 12.040 1.00 . A A . 44 LEU HD12 1 1 12 7620 1 1 44 LEU HD13 H 8.309 -8.072 11.272 1.00 . A A . 44 LEU HD13 1 1 12 7621 1 1 44 LEU HD21 H 5.606 -5.677 10.063 1.00 . A A . 44 LEU HD21 1 1 12 7622 1 1 44 LEU HD22 H 4.421 -6.939 10.395 1.00 . A A . 44 LEU HD22 1 1 12 7623 1 1 44 LEU HD23 H 5.438 -6.323 11.696 1.00 . A A . 44 LEU HD23 1 1 12 7624 1 1 44 LEU HG H 5.924 -8.531 10.051 1.00 . A A . 44 LEU HG 1 1 12 7625 1 1 44 LEU N N 6.975 -9.405 8.216 1.00 . A A . 44 LEU N 1 1 12 7626 1 1 44 LEU O O 8.373 -7.429 5.880 1.00 . A A . 44 LEU O 1 1 12 7627 1 1 45 ARG C C 11.713 -9.395 7.265 1.00 . A A . 45 ARG C 1 1 12 7628 1 1 45 ARG CA C 10.826 -8.239 6.830 1.00 . A A . 45 ARG CA 1 1 12 7629 1 1 45 ARG CB C 11.544 -6.906 7.042 1.00 . A A . 45 ARG CB 1 1 12 7630 1 1 45 ARG CD C 11.635 -5.303 5.111 1.00 . A A . 45 ARG CD 1 1 12 7631 1 1 45 ARG CG C 12.334 -6.444 5.829 1.00 . A A . 45 ARG CG 1 1 12 7632 1 1 45 ARG CZ C 12.247 -4.478 2.859 1.00 . A A . 45 ARG CZ 1 1 12 7633 1 1 45 ARG H H 9.569 -8.643 8.481 1.00 . A A . 45 ARG H 1 1 12 7634 1 1 45 ARG HA H 10.595 -8.352 5.782 1.00 . A A . 45 ARG HA 1 1 12 7635 1 1 45 ARG HB2 H 10.813 -6.148 7.279 1.00 . A A . 45 ARG HB2 1 1 12 7636 1 1 45 ARG HB3 H 12.228 -7.008 7.870 1.00 . A A . 45 ARG HB3 1 1 12 7637 1 1 45 ARG HD2 H 10.781 -5.695 4.582 1.00 . A A . 45 ARG HD2 1 1 12 7638 1 1 45 ARG HD3 H 11.304 -4.583 5.845 1.00 . A A . 45 ARG HD3 1 1 12 7639 1 1 45 ARG HE H 13.373 -4.280 4.508 1.00 . A A . 45 ARG HE 1 1 12 7640 1 1 45 ARG HG2 H 13.309 -6.109 6.152 1.00 . A A . 45 ARG HG2 1 1 12 7641 1 1 45 ARG HG3 H 12.444 -7.276 5.147 1.00 . A A . 45 ARG HG3 1 1 12 7642 1 1 45 ARG HH11 H 10.469 -5.462 2.931 1.00 . A A . 45 ARG HH11 1 1 12 7643 1 1 45 ARG HH12 H 10.932 -4.866 1.361 1.00 . A A . 45 ARG HH12 1 1 12 7644 1 1 45 ARG HH21 H 13.955 -3.458 2.454 1.00 . A A . 45 ARG HH21 1 1 12 7645 1 1 45 ARG HH22 H 12.890 -3.701 1.096 1.00 . A A . 45 ARG HH22 1 1 12 7646 1 1 45 ARG N N 9.578 -8.266 7.569 1.00 . A A . 45 ARG N 1 1 12 7647 1 1 45 ARG NE N 12.522 -4.636 4.156 1.00 . A A . 45 ARG NE 1 1 12 7648 1 1 45 ARG NH1 N 11.126 -4.972 2.344 1.00 . A A . 45 ARG NH1 1 1 12 7649 1 1 45 ARG NH2 N 13.100 -3.833 2.075 1.00 . A A . 45 ARG NH2 1 1 12 7650 1 1 45 ARG O O 12.727 -9.204 7.939 1.00 . A A . 45 ARG O 1 1 12 7651 1 1 46 VAL C C 12.689 -12.385 5.971 1.00 . A A . 46 VAL C 1 1 12 7652 1 1 46 VAL CA C 12.066 -11.796 7.226 1.00 . A A . 46 VAL CA 1 1 12 7653 1 1 46 VAL CB C 11.184 -12.864 7.911 1.00 . A A . 46 VAL CB 1 1 12 7654 1 1 46 VAL CG1 C 12.049 -13.892 8.626 1.00 . A A . 46 VAL CG1 1 1 12 7655 1 1 46 VAL CG2 C 10.203 -12.221 8.882 1.00 . A A . 46 VAL CG2 1 1 12 7656 1 1 46 VAL H H 10.500 -10.685 6.339 1.00 . A A . 46 VAL H 1 1 12 7657 1 1 46 VAL HA H 12.853 -11.513 7.909 1.00 . A A . 46 VAL HA 1 1 12 7658 1 1 46 VAL HB H 10.615 -13.375 7.146 1.00 . A A . 46 VAL HB 1 1 12 7659 1 1 46 VAL HG11 H 12.295 -13.531 9.613 1.00 . A A . 46 VAL HG11 1 1 12 7660 1 1 46 VAL HG12 H 11.510 -14.824 8.707 1.00 . A A . 46 VAL HG12 1 1 12 7661 1 1 46 VAL HG13 H 12.957 -14.050 8.064 1.00 . A A . 46 VAL HG13 1 1 12 7662 1 1 46 VAL HG21 H 9.398 -12.908 9.089 1.00 . A A . 46 VAL HG21 1 1 12 7663 1 1 46 VAL HG22 H 10.714 -11.978 9.802 1.00 . A A . 46 VAL HG22 1 1 12 7664 1 1 46 VAL HG23 H 9.803 -11.319 8.443 1.00 . A A . 46 VAL HG23 1 1 12 7665 1 1 46 VAL N N 11.312 -10.598 6.889 1.00 . A A . 46 VAL N 1 1 12 7666 1 1 46 VAL O O 13.837 -12.019 5.651 1.00 . A A . 46 VAL O 1 1 12 7667 1 1 46 VAL OXT O 12.017 -13.189 5.290 1.00 . A A . 46 VAL OXT 1 1 12 7668 2 2 1 ZN ZN ZN -0.163 0.220 -0.536 1.00 . B A . 47 ZN ZN 1 1 13 7669 1 1 1 GLY C C 20.790 1.657 -14.448 1.00 . A A . 1 GLY C 1 1 13 7670 1 1 1 GLY CA C 21.747 2.626 -15.111 1.00 . A A . 1 GLY CA 1 1 13 7671 1 1 1 GLY H1 H 21.527 2.441 -17.178 1.00 . A A . 1 GLY H1 1 1 13 7672 1 1 1 GLY H2 H 22.266 1.105 -16.439 1.00 . A A . 1 GLY H2 1 1 13 7673 1 1 1 GLY H3 H 23.138 2.542 -16.658 1.00 . A A . 1 GLY H3 1 1 13 7674 1 1 1 GLY HA2 H 22.609 2.757 -14.474 1.00 . A A . 1 GLY HA2 1 1 13 7675 1 1 1 GLY HA3 H 21.253 3.579 -15.232 1.00 . A A . 1 GLY HA3 1 1 13 7676 1 1 1 GLY N N 22.201 2.148 -16.437 1.00 . A A . 1 GLY N 1 1 13 7677 1 1 1 GLY O O 19.779 1.269 -15.040 1.00 . A A . 1 GLY O 1 1 13 7678 1 1 2 SER C C 19.294 1.121 -11.582 1.00 . A A . 2 SER C 1 1 13 7679 1 1 2 SER CA C 20.262 0.344 -12.473 1.00 . A A . 2 SER CA 1 1 13 7680 1 1 2 SER CB C 21.131 -0.591 -11.628 1.00 . A A . 2 SER CB 1 1 13 7681 1 1 2 SER H H 21.934 1.601 -12.804 1.00 . A A . 2 SER H 1 1 13 7682 1 1 2 SER HA H 19.696 -0.242 -13.181 1.00 . A A . 2 SER HA 1 1 13 7683 1 1 2 SER HB2 H 21.003 -0.350 -10.583 1.00 . A A . 2 SER HB2 1 1 13 7684 1 1 2 SER HB3 H 20.829 -1.615 -11.798 1.00 . A A . 2 SER HB3 1 1 13 7685 1 1 2 SER HG H 22.974 -0.031 -11.226 1.00 . A A . 2 SER HG 1 1 13 7686 1 1 2 SER N N 21.106 1.261 -13.222 1.00 . A A . 2 SER N 1 1 13 7687 1 1 2 SER O O 19.710 1.807 -10.650 1.00 . A A . 2 SER O 1 1 13 7688 1 1 2 SER OG O 22.506 -0.457 -11.963 1.00 . A A . 2 SER OG 1 1 13 7689 1 1 3 MET C C 16.576 0.925 -9.910 1.00 . A A . 3 MET C 1 1 13 7690 1 1 3 MET CA C 16.989 1.740 -11.127 1.00 . A A . 3 MET CA 1 1 13 7691 1 1 3 MET CB C 15.771 2.024 -12.005 1.00 . A A . 3 MET CB 1 1 13 7692 1 1 3 MET CE C 12.689 4.491 -10.690 1.00 . A A . 3 MET CE 1 1 13 7693 1 1 3 MET CG C 15.004 3.268 -11.598 1.00 . A A . 3 MET CG 1 1 13 7694 1 1 3 MET H H 17.737 0.469 -12.647 1.00 . A A . 3 MET H 1 1 13 7695 1 1 3 MET HA H 17.411 2.677 -10.792 1.00 . A A . 3 MET HA 1 1 13 7696 1 1 3 MET HB2 H 16.100 2.148 -13.028 1.00 . A A . 3 MET HB2 1 1 13 7697 1 1 3 MET HB3 H 15.100 1.180 -11.952 1.00 . A A . 3 MET HB3 1 1 13 7698 1 1 3 MET HE1 H 11.955 4.529 -11.480 1.00 . A A . 3 MET HE1 1 1 13 7699 1 1 3 MET HE2 H 12.202 4.648 -9.739 1.00 . A A . 3 MET HE2 1 1 13 7700 1 1 3 MET HE3 H 13.427 5.262 -10.847 1.00 . A A . 3 MET HE3 1 1 13 7701 1 1 3 MET HG2 H 15.638 3.874 -10.968 1.00 . A A . 3 MET HG2 1 1 13 7702 1 1 3 MET HG3 H 14.749 3.823 -12.489 1.00 . A A . 3 MET HG3 1 1 13 7703 1 1 3 MET N N 18.010 1.034 -11.891 1.00 . A A . 3 MET N 1 1 13 7704 1 1 3 MET O O 16.770 -0.291 -9.873 1.00 . A A . 3 MET O 1 1 13 7705 1 1 3 MET SD S 13.488 2.888 -10.697 1.00 . A A . 3 MET SD 1 1 13 7706 1 1 4 ALA C C 14.473 0.016 -7.905 1.00 . A A . 4 ALA C 1 1 13 7707 1 1 4 ALA CA C 15.641 0.961 -7.660 1.00 . A A . 4 ALA CA 1 1 13 7708 1 1 4 ALA CB C 15.276 2.010 -6.621 1.00 . A A . 4 ALA CB 1 1 13 7709 1 1 4 ALA H H 15.971 2.586 -8.974 1.00 . A A . 4 ALA H 1 1 13 7710 1 1 4 ALA HA H 16.481 0.391 -7.286 1.00 . A A . 4 ALA HA 1 1 13 7711 1 1 4 ALA HB1 H 16.008 2.005 -5.829 1.00 . A A . 4 ALA HB1 1 1 13 7712 1 1 4 ALA HB2 H 15.256 2.986 -7.086 1.00 . A A . 4 ALA HB2 1 1 13 7713 1 1 4 ALA HB3 H 14.301 1.788 -6.212 1.00 . A A . 4 ALA HB3 1 1 13 7714 1 1 4 ALA N N 16.051 1.607 -8.898 1.00 . A A . 4 ALA N 1 1 13 7715 1 1 4 ALA O O 14.480 -1.119 -7.429 1.00 . A A . 4 ALA O 1 1 13 7716 1 1 5 ALA C C 11.576 -0.844 -7.913 1.00 . A A . 5 ALA C 1 1 13 7717 1 1 5 ALA CA C 12.356 -0.318 -9.120 1.00 . A A . 5 ALA CA 1 1 13 7718 1 1 5 ALA CB C 12.777 -1.459 -10.037 1.00 . A A . 5 ALA CB 1 1 13 7719 1 1 5 ALA H H 13.627 1.372 -9.102 1.00 . A A . 5 ALA H 1 1 13 7720 1 1 5 ALA HA H 11.704 0.333 -9.686 1.00 . A A . 5 ALA HA 1 1 13 7721 1 1 5 ALA HB1 H 13.813 -1.702 -9.858 1.00 . A A . 5 ALA HB1 1 1 13 7722 1 1 5 ALA HB2 H 12.164 -2.326 -9.837 1.00 . A A . 5 ALA HB2 1 1 13 7723 1 1 5 ALA HB3 H 12.651 -1.158 -11.068 1.00 . A A . 5 ALA HB3 1 1 13 7724 1 1 5 ALA N N 13.520 0.476 -8.718 1.00 . A A . 5 ALA N 1 1 13 7725 1 1 5 ALA O O 10.668 -0.177 -7.415 1.00 . A A . 5 ALA O 1 1 13 7726 1 1 6 HIS C C 11.621 -1.826 -5.024 1.00 . A A . 6 HIS C 1 1 13 7727 1 1 6 HIS CA C 11.293 -2.628 -6.280 1.00 . A A . 6 HIS CA 1 1 13 7728 1 1 6 HIS CB C 11.751 -4.079 -6.108 1.00 . A A . 6 HIS CB 1 1 13 7729 1 1 6 HIS CD2 C 9.654 -5.609 -6.004 1.00 . A A . 6 HIS CD2 1 1 13 7730 1 1 6 HIS CE1 C 9.739 -6.119 -3.876 1.00 . A A . 6 HIS CE1 1 1 13 7731 1 1 6 HIS CG C 10.728 -4.974 -5.476 1.00 . A A . 6 HIS CG 1 1 13 7732 1 1 6 HIS H H 12.684 -2.509 -7.873 1.00 . A A . 6 HIS H 1 1 13 7733 1 1 6 HIS HA H 10.227 -2.608 -6.443 1.00 . A A . 6 HIS HA 1 1 13 7734 1 1 6 HIS HB2 H 11.995 -4.488 -7.076 1.00 . A A . 6 HIS HB2 1 1 13 7735 1 1 6 HIS HB3 H 12.634 -4.095 -5.485 1.00 . A A . 6 HIS HB3 1 1 13 7736 1 1 6 HIS HD1 H 11.427 -5.017 -3.484 1.00 . A A . 6 HIS HD1 1 1 13 7737 1 1 6 HIS HD2 H 9.324 -5.565 -7.034 1.00 . A A . 6 HIS HD2 1 1 13 7738 1 1 6 HIS HE1 H 9.503 -6.537 -2.909 1.00 . A A . 6 HIS HE1 1 1 13 7739 1 1 6 HIS HE2 H 8.257 -6.890 -5.074 1.00 . A A . 6 HIS HE2 1 1 13 7740 1 1 6 HIS N N 11.940 -2.031 -7.442 1.00 . A A . 6 HIS N 1 1 13 7741 1 1 6 HIS ND1 N 10.751 -5.315 -4.143 1.00 . A A . 6 HIS ND1 1 1 13 7742 1 1 6 HIS NE2 N 9.059 -6.313 -4.987 1.00 . A A . 6 HIS NE2 1 1 13 7743 1 1 6 HIS O O 10.775 -1.635 -4.151 1.00 . A A . 6 HIS O 1 1 13 7744 1 1 7 SER C C 13.062 0.971 -4.089 1.00 . A A . 7 SER C 1 1 13 7745 1 1 7 SER CA C 13.290 -0.517 -3.836 1.00 . A A . 7 SER CA 1 1 13 7746 1 1 7 SER CB C 14.771 -0.780 -3.570 1.00 . A A . 7 SER CB 1 1 13 7747 1 1 7 SER H H 13.463 -1.476 -5.713 1.00 . A A . 7 SER H 1 1 13 7748 1 1 7 SER HA H 12.718 -0.816 -2.972 1.00 . A A . 7 SER HA 1 1 13 7749 1 1 7 SER HB2 H 15.363 -0.002 -4.028 1.00 . A A . 7 SER HB2 1 1 13 7750 1 1 7 SER HB3 H 14.947 -0.787 -2.504 1.00 . A A . 7 SER HB3 1 1 13 7751 1 1 7 SER HG H 15.396 -2.626 -3.376 1.00 . A A . 7 SER HG 1 1 13 7752 1 1 7 SER N N 12.844 -1.318 -4.966 1.00 . A A . 7 SER N 1 1 13 7753 1 1 7 SER O O 13.828 1.815 -3.622 1.00 . A A . 7 SER O 1 1 13 7754 1 1 7 SER OG O 15.163 -2.032 -4.106 1.00 . A A . 7 SER OG 1 1 13 7755 1 1 8 ALA C C 10.491 3.132 -4.316 1.00 . A A . 8 ALA C 1 1 13 7756 1 1 8 ALA CA C 11.687 2.669 -5.136 1.00 . A A . 8 ALA CA 1 1 13 7757 1 1 8 ALA CB C 11.414 2.834 -6.621 1.00 . A A . 8 ALA CB 1 1 13 7758 1 1 8 ALA H H 11.441 0.572 -5.183 1.00 . A A . 8 ALA H 1 1 13 7759 1 1 8 ALA HA H 12.543 3.278 -4.881 1.00 . A A . 8 ALA HA 1 1 13 7760 1 1 8 ALA HB1 H 12.247 3.341 -7.086 1.00 . A A . 8 ALA HB1 1 1 13 7761 1 1 8 ALA HB2 H 11.286 1.862 -7.074 1.00 . A A . 8 ALA HB2 1 1 13 7762 1 1 8 ALA HB3 H 10.513 3.417 -6.759 1.00 . A A . 8 ALA HB3 1 1 13 7763 1 1 8 ALA N N 12.014 1.287 -4.833 1.00 . A A . 8 ALA N 1 1 13 7764 1 1 8 ALA O O 9.626 2.331 -3.956 1.00 . A A . 8 ALA O 1 1 13 7765 1 1 9 ASP C C 8.381 5.688 -4.048 1.00 . A A . 9 ASP C 1 1 13 7766 1 1 9 ASP CA C 9.411 4.990 -3.168 1.00 . A A . 9 ASP CA 1 1 13 7767 1 1 9 ASP CB C 9.998 5.980 -2.156 1.00 . A A . 9 ASP CB 1 1 13 7768 1 1 9 ASP CG C 9.034 6.328 -1.034 1.00 . A A . 9 ASP CG 1 1 13 7769 1 1 9 ASP H H 11.216 4.991 -4.280 1.00 . A A . 9 ASP H 1 1 13 7770 1 1 9 ASP HA H 8.923 4.184 -2.635 1.00 . A A . 9 ASP HA 1 1 13 7771 1 1 9 ASP HB2 H 10.886 5.551 -1.715 1.00 . A A . 9 ASP HB2 1 1 13 7772 1 1 9 ASP HB3 H 10.263 6.891 -2.670 1.00 . A A . 9 ASP HB3 1 1 13 7773 1 1 9 ASP N N 10.475 4.413 -3.984 1.00 . A A . 9 ASP N 1 1 13 7774 1 1 9 ASP O O 7.902 6.779 -3.736 1.00 . A A . 9 ASP O 1 1 13 7775 1 1 9 ASP OD1 O 8.004 5.641 -0.882 1.00 . A A . 9 ASP OD1 1 1 13 7776 1 1 9 ASP OD2 O 9.306 7.300 -0.295 1.00 . A A . 9 ASP OD2 1 1 13 7777 1 1 10 LEU C C 5.618 4.906 -5.575 1.00 . A A . 10 LEU C 1 1 13 7778 1 1 10 LEU CA C 6.944 5.523 -5.990 1.00 . A A . 10 LEU CA 1 1 13 7779 1 1 10 LEU CB C 7.244 5.201 -7.459 1.00 . A A . 10 LEU CB 1 1 13 7780 1 1 10 LEU CD1 C 8.797 3.940 -8.968 1.00 . A A . 10 LEU CD1 1 1 13 7781 1 1 10 LEU CD2 C 9.489 6.154 -8.042 1.00 . A A . 10 LEU CD2 1 1 13 7782 1 1 10 LEU CG C 8.707 4.878 -7.776 1.00 . A A . 10 LEU CG 1 1 13 7783 1 1 10 LEU H H 8.369 4.125 -5.292 1.00 . A A . 10 LEU H 1 1 13 7784 1 1 10 LEU HA H 6.889 6.594 -5.862 1.00 . A A . 10 LEU HA 1 1 13 7785 1 1 10 LEU HB2 H 6.643 4.353 -7.747 1.00 . A A . 10 LEU HB2 1 1 13 7786 1 1 10 LEU HB3 H 6.950 6.050 -8.058 1.00 . A A . 10 LEU HB3 1 1 13 7787 1 1 10 LEU HD11 H 8.463 4.454 -9.855 1.00 . A A . 10 LEU HD11 1 1 13 7788 1 1 10 LEU HD12 H 9.821 3.622 -9.099 1.00 . A A . 10 LEU HD12 1 1 13 7789 1 1 10 LEU HD13 H 8.172 3.076 -8.793 1.00 . A A . 10 LEU HD13 1 1 13 7790 1 1 10 LEU HD21 H 8.804 6.981 -8.145 1.00 . A A . 10 LEU HD21 1 1 13 7791 1 1 10 LEU HD22 H 10.160 6.343 -7.215 1.00 . A A . 10 LEU HD22 1 1 13 7792 1 1 10 LEU HD23 H 10.061 6.042 -8.951 1.00 . A A . 10 LEU HD23 1 1 13 7793 1 1 10 LEU HG H 9.152 4.383 -6.925 1.00 . A A . 10 LEU HG 1 1 13 7794 1 1 10 LEU N N 7.992 5.016 -5.120 1.00 . A A . 10 LEU N 1 1 13 7795 1 1 10 LEU O O 4.583 5.138 -6.196 1.00 . A A . 10 LEU O 1 1 13 7796 1 1 11 LYS C C 4.359 3.769 -2.500 1.00 . A A . 11 LYS C 1 1 13 7797 1 1 11 LYS CA C 4.506 3.448 -3.987 1.00 . A A . 11 LYS CA 1 1 13 7798 1 1 11 LYS CB C 4.626 1.936 -4.227 1.00 . A A . 11 LYS CB 1 1 13 7799 1 1 11 LYS CD C 5.393 -0.059 -2.904 1.00 . A A . 11 LYS CD 1 1 13 7800 1 1 11 LYS CE C 6.437 -1.128 -3.186 1.00 . A A . 11 LYS CE 1 1 13 7801 1 1 11 LYS CG C 5.789 1.284 -3.489 1.00 . A A . 11 LYS CG 1 1 13 7802 1 1 11 LYS H H 6.531 3.982 -4.067 1.00 . A A . 11 LYS H 1 1 13 7803 1 1 11 LYS HA H 3.640 3.824 -4.512 1.00 . A A . 11 LYS HA 1 1 13 7804 1 1 11 LYS HB2 H 3.712 1.452 -3.918 1.00 . A A . 11 LYS HB2 1 1 13 7805 1 1 11 LYS HB3 H 4.765 1.767 -5.286 1.00 . A A . 11 LYS HB3 1 1 13 7806 1 1 11 LYS HD2 H 5.283 0.046 -1.836 1.00 . A A . 11 LYS HD2 1 1 13 7807 1 1 11 LYS HD3 H 4.451 -0.365 -3.336 1.00 . A A . 11 LYS HD3 1 1 13 7808 1 1 11 LYS HE2 H 6.201 -2.001 -2.597 1.00 . A A . 11 LYS HE2 1 1 13 7809 1 1 11 LYS HE3 H 6.400 -1.381 -4.235 1.00 . A A . 11 LYS HE3 1 1 13 7810 1 1 11 LYS HG2 H 6.606 1.138 -4.179 1.00 . A A . 11 LYS HG2 1 1 13 7811 1 1 11 LYS HG3 H 6.105 1.937 -2.686 1.00 . A A . 11 LYS HG3 1 1 13 7812 1 1 11 LYS HZ1 H 7.840 -0.319 -1.865 1.00 . A A . 11 LYS HZ1 1 1 13 7813 1 1 11 LYS HZ2 H 8.106 0.092 -3.485 1.00 . A A . 11 LYS HZ2 1 1 13 7814 1 1 11 LYS HZ3 H 8.487 -1.462 -2.935 1.00 . A A . 11 LYS HZ3 1 1 13 7815 1 1 11 LYS N N 5.673 4.115 -4.516 1.00 . A A . 11 LYS N 1 1 13 7816 1 1 11 LYS NZ N 7.812 -0.671 -2.846 1.00 . A A . 11 LYS NZ 1 1 13 7817 1 1 11 LYS O O 4.904 4.760 -2.010 1.00 . A A . 11 LYS O 1 1 13 7818 1 1 12 CYS C C 4.408 2.438 0.450 1.00 . A A . 12 CYS C 1 1 13 7819 1 1 12 CYS CA C 3.337 3.144 -0.393 1.00 . A A . 12 CYS CA 1 1 13 7820 1 1 12 CYS CB C 1.951 2.576 -0.122 1.00 . A A . 12 CYS CB 1 1 13 7821 1 1 12 CYS H H 3.183 2.197 -2.253 1.00 . A A . 12 CYS H 1 1 13 7822 1 1 12 CYS HA H 3.345 4.201 -0.179 1.00 . A A . 12 CYS HA 1 1 13 7823 1 1 12 CYS HB2 H 1.908 2.178 0.878 1.00 . A A . 12 CYS HB2 1 1 13 7824 1 1 12 CYS HB3 H 1.215 3.361 -0.229 1.00 . A A . 12 CYS HB3 1 1 13 7825 1 1 12 CYS N N 3.602 2.954 -1.803 1.00 . A A . 12 CYS N 1 1 13 7826 1 1 12 CYS O O 5.349 1.860 -0.098 1.00 . A A . 12 CYS O 1 1 13 7827 1 1 12 CYS SG S 1.519 1.253 -1.285 1.00 . A A . 12 CYS SG 1 1 13 7828 1 1 13 PRO C C 5.405 0.428 2.602 1.00 . A A . 13 PRO C 1 1 13 7829 1 1 13 PRO CA C 5.340 1.957 2.688 1.00 . A A . 13 PRO CA 1 1 13 7830 1 1 13 PRO CB C 4.869 2.384 4.078 1.00 . A A . 13 PRO CB 1 1 13 7831 1 1 13 PRO CD C 3.359 3.364 2.531 1.00 . A A . 13 PRO CD 1 1 13 7832 1 1 13 PRO CG C 4.037 3.592 3.845 1.00 . A A . 13 PRO CG 1 1 13 7833 1 1 13 PRO HA H 6.322 2.362 2.501 1.00 . A A . 13 PRO HA 1 1 13 7834 1 1 13 PRO HB2 H 4.294 1.588 4.526 1.00 . A A . 13 PRO HB2 1 1 13 7835 1 1 13 PRO HB3 H 5.720 2.609 4.696 1.00 . A A . 13 PRO HB3 1 1 13 7836 1 1 13 PRO HD2 H 2.433 2.827 2.669 1.00 . A A . 13 PRO HD2 1 1 13 7837 1 1 13 PRO HD3 H 3.182 4.304 2.030 1.00 . A A . 13 PRO HD3 1 1 13 7838 1 1 13 PRO HG2 H 3.307 3.695 4.634 1.00 . A A . 13 PRO HG2 1 1 13 7839 1 1 13 PRO HG3 H 4.666 4.468 3.794 1.00 . A A . 13 PRO HG3 1 1 13 7840 1 1 13 PRO N N 4.337 2.548 1.789 1.00 . A A . 13 PRO N 1 1 13 7841 1 1 13 PRO O O 6.434 -0.174 2.916 1.00 . A A . 13 PRO O 1 1 13 7842 1 1 14 THR C C 5.030 -2.187 0.947 1.00 . A A . 14 THR C 1 1 13 7843 1 1 14 THR CA C 4.229 -1.653 2.137 1.00 . A A . 14 THR CA 1 1 13 7844 1 1 14 THR CB C 2.768 -2.131 2.031 1.00 . A A . 14 THR CB 1 1 13 7845 1 1 14 THR CG2 C 2.686 -3.650 1.975 1.00 . A A . 14 THR CG2 1 1 13 7846 1 1 14 THR H H 3.498 0.333 2.024 1.00 . A A . 14 THR H 1 1 13 7847 1 1 14 THR HA H 4.648 -2.057 3.043 1.00 . A A . 14 THR HA 1 1 13 7848 1 1 14 THR HB H 2.336 -1.728 1.126 1.00 . A A . 14 THR HB 1 1 13 7849 1 1 14 THR HG1 H 1.254 -1.142 2.841 1.00 . A A . 14 THR HG1 1 1 13 7850 1 1 14 THR HG21 H 2.712 -3.975 0.946 1.00 . A A . 14 THR HG21 1 1 13 7851 1 1 14 THR HG22 H 1.766 -3.980 2.434 1.00 . A A . 14 THR HG22 1 1 13 7852 1 1 14 THR HG23 H 3.524 -4.075 2.508 1.00 . A A . 14 THR HG23 1 1 13 7853 1 1 14 THR N N 4.300 -0.197 2.224 1.00 . A A . 14 THR N 1 1 13 7854 1 1 14 THR O O 4.810 -1.786 -0.195 1.00 . A A . 14 THR O 1 1 13 7855 1 1 14 THR OG1 O 2.023 -1.654 3.158 1.00 . A A . 14 THR OG1 1 1 13 7856 1 1 15 PRO C C 6.208 -4.493 -0.798 1.00 . A A . 15 PRO C 1 1 13 7857 1 1 15 PRO CA C 6.933 -3.572 0.179 1.00 . A A . 15 PRO CA 1 1 13 7858 1 1 15 PRO CB C 7.977 -4.364 0.977 1.00 . A A . 15 PRO CB 1 1 13 7859 1 1 15 PRO CD C 6.460 -3.451 2.561 1.00 . A A . 15 PRO CD 1 1 13 7860 1 1 15 PRO CG C 7.899 -3.815 2.355 1.00 . A A . 15 PRO CG 1 1 13 7861 1 1 15 PRO HA H 7.421 -2.781 -0.369 1.00 . A A . 15 PRO HA 1 1 13 7862 1 1 15 PRO HB2 H 7.730 -5.417 0.955 1.00 . A A . 15 PRO HB2 1 1 13 7863 1 1 15 PRO HB3 H 8.955 -4.211 0.550 1.00 . A A . 15 PRO HB3 1 1 13 7864 1 1 15 PRO HD2 H 5.895 -4.309 2.898 1.00 . A A . 15 PRO HD2 1 1 13 7865 1 1 15 PRO HD3 H 6.372 -2.636 3.265 1.00 . A A . 15 PRO HD3 1 1 13 7866 1 1 15 PRO HG2 H 8.207 -4.565 3.068 1.00 . A A . 15 PRO HG2 1 1 13 7867 1 1 15 PRO HG3 H 8.523 -2.937 2.436 1.00 . A A . 15 PRO HG3 1 1 13 7868 1 1 15 PRO N N 6.039 -3.034 1.216 1.00 . A A . 15 PRO N 1 1 13 7869 1 1 15 PRO O O 6.525 -4.528 -1.987 1.00 . A A . 15 PRO O 1 1 13 7870 1 1 16 GLY C C 3.284 -5.557 -1.771 1.00 . A A . 16 GLY C 1 1 13 7871 1 1 16 GLY CA C 4.507 -6.179 -1.122 1.00 . A A . 16 GLY CA 1 1 13 7872 1 1 16 GLY H H 5.036 -5.185 0.663 1.00 . A A . 16 GLY H 1 1 13 7873 1 1 16 GLY HA2 H 5.166 -6.538 -1.893 1.00 . A A . 16 GLY HA2 1 1 13 7874 1 1 16 GLY HA3 H 4.193 -7.017 -0.514 1.00 . A A . 16 GLY HA3 1 1 13 7875 1 1 16 GLY N N 5.237 -5.243 -0.290 1.00 . A A . 16 GLY N 1 1 13 7876 1 1 16 GLY O O 2.471 -6.254 -2.380 1.00 . A A . 16 GLY O 1 1 13 7877 1 1 17 CYS C C 2.408 -2.815 -3.468 1.00 . A A . 17 CYS C 1 1 13 7878 1 1 17 CYS CA C 2.010 -3.535 -2.178 1.00 . A A . 17 CYS CA 1 1 13 7879 1 1 17 CYS CB C 1.507 -2.545 -1.135 1.00 . A A . 17 CYS CB 1 1 13 7880 1 1 17 CYS H H 3.818 -3.754 -1.114 1.00 . A A . 17 CYS H 1 1 13 7881 1 1 17 CYS HA H 1.231 -4.249 -2.395 1.00 . A A . 17 CYS HA 1 1 13 7882 1 1 17 CYS HB2 H 1.598 -2.997 -0.160 1.00 . A A . 17 CYS HB2 1 1 13 7883 1 1 17 CYS HB3 H 2.133 -1.664 -1.169 1.00 . A A . 17 CYS HB3 1 1 13 7884 1 1 17 CYS N N 3.143 -4.253 -1.624 1.00 . A A . 17 CYS N 1 1 13 7885 1 1 17 CYS O O 3.519 -2.997 -3.979 1.00 . A A . 17 CYS O 1 1 13 7886 1 1 17 CYS SG S -0.221 -1.999 -1.314 1.00 . A A . 17 CYS SG 1 1 13 7887 1 1 18 ASP C C 1.146 0.087 -5.225 1.00 . A A . 18 ASP C 1 1 13 7888 1 1 18 ASP CA C 1.711 -1.335 -5.272 1.00 . A A . 18 ASP CA 1 1 13 7889 1 1 18 ASP CB C 1.087 -2.118 -6.433 1.00 . A A . 18 ASP CB 1 1 13 7890 1 1 18 ASP CG C -0.344 -1.709 -6.736 1.00 . A A . 18 ASP CG 1 1 13 7891 1 1 18 ASP H H 0.607 -1.969 -3.578 1.00 . A A . 18 ASP H 1 1 13 7892 1 1 18 ASP HA H 2.778 -1.279 -5.424 1.00 . A A . 18 ASP HA 1 1 13 7893 1 1 18 ASP HB2 H 1.680 -1.965 -7.322 1.00 . A A . 18 ASP HB2 1 1 13 7894 1 1 18 ASP HB3 H 1.092 -3.165 -6.177 1.00 . A A . 18 ASP HB3 1 1 13 7895 1 1 18 ASP N N 1.480 -2.040 -4.015 1.00 . A A . 18 ASP N 1 1 13 7896 1 1 18 ASP O O 1.584 0.965 -5.977 1.00 . A A . 18 ASP O 1 1 13 7897 1 1 18 ASP OD1 O -1.186 -1.748 -5.818 1.00 . A A . 18 ASP OD1 1 1 13 7898 1 1 18 ASP OD2 O -0.638 -1.363 -7.899 1.00 . A A . 18 ASP OD2 1 1 13 7899 1 1 19 GLY C C -1.826 1.707 -4.713 1.00 . A A . 19 GLY C 1 1 13 7900 1 1 19 GLY CA C -0.399 1.634 -4.196 1.00 . A A . 19 GLY CA 1 1 13 7901 1 1 19 GLY H H -0.109 -0.414 -3.753 1.00 . A A . 19 GLY H 1 1 13 7902 1 1 19 GLY HA2 H -0.395 1.908 -3.151 1.00 . A A . 19 GLY HA2 1 1 13 7903 1 1 19 GLY HA3 H 0.208 2.343 -4.742 1.00 . A A . 19 GLY HA3 1 1 13 7904 1 1 19 GLY N N 0.188 0.314 -4.335 1.00 . A A . 19 GLY N 1 1 13 7905 1 1 19 GLY O O -2.505 2.715 -4.535 1.00 . A A . 19 GLY O 1 1 13 7906 1 1 20 SER C C -4.545 -0.272 -4.985 1.00 . A A . 20 SER C 1 1 13 7907 1 1 20 SER CA C -3.654 0.608 -5.853 1.00 . A A . 20 SER CA 1 1 13 7908 1 1 20 SER CB C -3.652 0.092 -7.291 1.00 . A A . 20 SER CB 1 1 13 7909 1 1 20 SER H H -1.727 -0.158 -5.433 1.00 . A A . 20 SER H 1 1 13 7910 1 1 20 SER HA H -4.041 1.617 -5.840 1.00 . A A . 20 SER HA 1 1 13 7911 1 1 20 SER HB2 H -3.686 -0.988 -7.284 1.00 . A A . 20 SER HB2 1 1 13 7912 1 1 20 SER HB3 H -4.516 0.477 -7.814 1.00 . A A . 20 SER HB3 1 1 13 7913 1 1 20 SER HG H -1.782 -0.169 -7.857 1.00 . A A . 20 SER HG 1 1 13 7914 1 1 20 SER N N -2.298 0.641 -5.333 1.00 . A A . 20 SER N 1 1 13 7915 1 1 20 SER O O -4.089 -1.264 -4.413 1.00 . A A . 20 SER O 1 1 13 7916 1 1 20 SER OG O -2.480 0.504 -7.979 1.00 . A A . 20 SER OG 1 1 13 7917 1 1 21 GLY C C -6.842 -0.279 -2.689 1.00 . A A . 21 GLY C 1 1 13 7918 1 1 21 GLY CA C -6.764 -0.699 -4.144 1.00 . A A . 21 GLY CA 1 1 13 7919 1 1 21 GLY H H -6.125 0.880 -5.395 1.00 . A A . 21 GLY H 1 1 13 7920 1 1 21 GLY HA2 H -7.740 -0.593 -4.591 1.00 . A A . 21 GLY HA2 1 1 13 7921 1 1 21 GLY HA3 H -6.471 -1.738 -4.192 1.00 . A A . 21 GLY HA3 1 1 13 7922 1 1 21 GLY N N -5.817 0.087 -4.905 1.00 . A A . 21 GLY N 1 1 13 7923 1 1 21 GLY O O -6.193 0.679 -2.278 1.00 . A A . 21 GLY O 1 1 13 7924 1 1 22 HIS C C -8.286 -2.091 0.176 1.00 . A A . 22 HIS C 1 1 13 7925 1 1 22 HIS CA C -7.775 -0.817 -0.475 1.00 . A A . 22 HIS CA 1 1 13 7926 1 1 22 HIS CB C -8.769 0.318 -0.174 1.00 . A A . 22 HIS CB 1 1 13 7927 1 1 22 HIS CD2 C -7.676 2.623 -0.731 1.00 . A A . 22 HIS CD2 1 1 13 7928 1 1 22 HIS CE1 C -7.570 3.403 1.311 1.00 . A A . 22 HIS CE1 1 1 13 7929 1 1 22 HIS CG C -8.161 1.665 0.095 1.00 . A A . 22 HIS CG 1 1 13 7930 1 1 22 HIS H H -8.049 -1.818 -2.318 1.00 . A A . 22 HIS H 1 1 13 7931 1 1 22 HIS HA H -6.810 -0.568 -0.056 1.00 . A A . 22 HIS HA 1 1 13 7932 1 1 22 HIS HB2 H -9.432 0.428 -1.019 1.00 . A A . 22 HIS HB2 1 1 13 7933 1 1 22 HIS HB3 H -9.355 0.044 0.692 1.00 . A A . 22 HIS HB3 1 1 13 7934 1 1 22 HIS HD1 H -8.335 1.729 2.202 1.00 . A A . 22 HIS HD1 1 1 13 7935 1 1 22 HIS HD2 H -7.604 2.565 -1.809 1.00 . A A . 22 HIS HD2 1 1 13 7936 1 1 22 HIS HE1 H -7.413 4.055 2.156 1.00 . A A . 22 HIS HE1 1 1 13 7937 1 1 22 HIS HE2 H -7.092 4.599 -0.280 1.00 . A A . 22 HIS HE2 1 1 13 7938 1 1 22 HIS N N -7.607 -1.035 -1.913 1.00 . A A . 22 HIS N 1 1 13 7939 1 1 22 HIS ND1 N -8.074 2.189 1.367 1.00 . A A . 22 HIS ND1 1 1 13 7940 1 1 22 HIS NE2 N -7.314 3.692 0.053 1.00 . A A . 22 HIS NE2 1 1 13 7941 1 1 22 HIS O O -8.992 -2.873 -0.458 1.00 . A A . 22 HIS O 1 1 13 7942 1 1 23 ILE C C -10.047 -3.242 2.405 1.00 . A A . 23 ILE C 1 1 13 7943 1 1 23 ILE CA C -8.536 -3.387 2.209 1.00 . A A . 23 ILE CA 1 1 13 7944 1 1 23 ILE CB C -7.807 -3.552 3.573 1.00 . A A . 23 ILE CB 1 1 13 7945 1 1 23 ILE CD1 C -7.627 -6.017 2.914 1.00 . A A . 23 ILE CD1 1 1 13 7946 1 1 23 ILE CG1 C -6.953 -4.823 3.564 1.00 . A A . 23 ILE CG1 1 1 13 7947 1 1 23 ILE CG2 C -8.781 -3.582 4.748 1.00 . A A . 23 ILE CG2 1 1 13 7948 1 1 23 ILE H H -7.508 -1.556 1.938 1.00 . A A . 23 ILE H 1 1 13 7949 1 1 23 ILE HA H -8.351 -4.275 1.621 1.00 . A A . 23 ILE HA 1 1 13 7950 1 1 23 ILE HB H -7.157 -2.698 3.706 1.00 . A A . 23 ILE HB 1 1 13 7951 1 1 23 ILE HD11 H -7.587 -5.914 1.840 1.00 . A A . 23 ILE HD11 1 1 13 7952 1 1 23 ILE HD12 H -7.116 -6.921 3.208 1.00 . A A . 23 ILE HD12 1 1 13 7953 1 1 23 ILE HD13 H -8.657 -6.068 3.234 1.00 . A A . 23 ILE HD13 1 1 13 7954 1 1 23 ILE HG12 H -6.038 -4.628 3.027 1.00 . A A . 23 ILE HG12 1 1 13 7955 1 1 23 ILE HG13 H -6.716 -5.092 4.582 1.00 . A A . 23 ILE HG13 1 1 13 7956 1 1 23 ILE HG21 H -8.232 -3.477 5.672 1.00 . A A . 23 ILE HG21 1 1 13 7957 1 1 23 ILE HG22 H -9.488 -2.770 4.655 1.00 . A A . 23 ILE HG22 1 1 13 7958 1 1 23 ILE HG23 H -9.311 -4.523 4.750 1.00 . A A . 23 ILE HG23 1 1 13 7959 1 1 23 ILE N N -8.017 -2.248 1.464 1.00 . A A . 23 ILE N 1 1 13 7960 1 1 23 ILE O O -10.781 -4.228 2.414 1.00 . A A . 23 ILE O 1 1 13 7961 1 1 24 THR C C -12.697 -1.992 1.369 1.00 . A A . 24 THR C 1 1 13 7962 1 1 24 THR CA C -11.920 -1.710 2.661 1.00 . A A . 24 THR CA 1 1 13 7963 1 1 24 THR CB C -12.135 -0.240 3.092 1.00 . A A . 24 THR CB 1 1 13 7964 1 1 24 THR CG2 C -11.704 0.720 1.998 1.00 . A A . 24 THR CG2 1 1 13 7965 1 1 24 THR H H -9.866 -1.254 2.467 1.00 . A A . 24 THR H 1 1 13 7966 1 1 24 THR HA H -12.302 -2.349 3.445 1.00 . A A . 24 THR HA 1 1 13 7967 1 1 24 THR HB H -11.530 -0.046 3.967 1.00 . A A . 24 THR HB 1 1 13 7968 1 1 24 THR HG1 H -13.727 -0.426 4.257 1.00 . A A . 24 THR HG1 1 1 13 7969 1 1 24 THR HG21 H -12.245 1.650 2.099 1.00 . A A . 24 THR HG21 1 1 13 7970 1 1 24 THR HG22 H -11.917 0.282 1.032 1.00 . A A . 24 THR HG22 1 1 13 7971 1 1 24 THR HG23 H -10.644 0.908 2.081 1.00 . A A . 24 THR HG23 1 1 13 7972 1 1 24 THR N N -10.504 -2.000 2.499 1.00 . A A . 24 THR N 1 1 13 7973 1 1 24 THR O O -13.898 -2.270 1.403 1.00 . A A . 24 THR O 1 1 13 7974 1 1 24 THR OG1 O -13.511 -0.004 3.409 1.00 . A A . 24 THR OG1 1 1 13 7975 1 1 25 GLY C C -13.634 -1.100 -1.400 1.00 . A A . 25 GLY C 1 1 13 7976 1 1 25 GLY CA C -12.640 -2.189 -1.043 1.00 . A A . 25 GLY CA 1 1 13 7977 1 1 25 GLY H H -11.041 -1.759 0.269 1.00 . A A . 25 GLY H 1 1 13 7978 1 1 25 GLY HA2 H -11.881 -2.236 -1.811 1.00 . A A . 25 GLY HA2 1 1 13 7979 1 1 25 GLY HA3 H -13.158 -3.135 -1.002 1.00 . A A . 25 GLY HA3 1 1 13 7980 1 1 25 GLY N N -12.000 -1.943 0.236 1.00 . A A . 25 GLY N 1 1 13 7981 1 1 25 GLY O O -14.733 -1.383 -1.877 1.00 . A A . 25 GLY O 1 1 13 7982 1 1 26 ASN C C -13.524 2.418 -2.013 1.00 . A A . 26 ASN C 1 1 13 7983 1 1 26 ASN CA C -14.196 1.262 -1.276 1.00 . A A . 26 ASN CA 1 1 13 7984 1 1 26 ASN CB C -14.716 1.752 0.078 1.00 . A A . 26 ASN CB 1 1 13 7985 1 1 26 ASN CG C -15.928 0.983 0.548 1.00 . A A . 26 ASN CG 1 1 13 7986 1 1 26 ASN H H -12.434 0.291 -0.629 1.00 . A A . 26 ASN H 1 1 13 7987 1 1 26 ASN HA H -15.030 0.913 -1.864 1.00 . A A . 26 ASN HA 1 1 13 7988 1 1 26 ASN HB2 H -13.936 1.640 0.816 1.00 . A A . 26 ASN HB2 1 1 13 7989 1 1 26 ASN HB3 H -14.983 2.794 0.003 1.00 . A A . 26 ASN HB3 1 1 13 7990 1 1 26 ASN HD21 H -15.079 0.691 2.320 1.00 . A A . 26 ASN HD21 1 1 13 7991 1 1 26 ASN HD22 H -16.663 0.027 2.117 1.00 . A A . 26 ASN HD22 1 1 13 7992 1 1 26 ASN N N -13.285 0.140 -1.080 1.00 . A A . 26 ASN N 1 1 13 7993 1 1 26 ASN ND2 N -15.885 0.519 1.784 1.00 . A A . 26 ASN ND2 1 1 13 7994 1 1 26 ASN O O -14.166 3.419 -2.321 1.00 . A A . 26 ASN O 1 1 13 7995 1 1 26 ASN OD1 O -16.890 0.797 -0.198 1.00 . A A . 26 ASN OD1 1 1 13 7996 1 1 27 TYR C C -10.835 2.818 -4.202 1.00 . A A . 27 TYR C 1 1 13 7997 1 1 27 TYR CA C -11.478 3.356 -2.931 1.00 . A A . 27 TYR CA 1 1 13 7998 1 1 27 TYR CB C -10.399 3.912 -2.002 1.00 . A A . 27 TYR CB 1 1 13 7999 1 1 27 TYR CD1 C -11.372 3.645 0.315 1.00 . A A . 27 TYR CD1 1 1 13 8000 1 1 27 TYR CD2 C -10.943 5.853 -0.464 1.00 . A A . 27 TYR CD2 1 1 13 8001 1 1 27 TYR CE1 C -11.846 4.150 1.509 1.00 . A A . 27 TYR CE1 1 1 13 8002 1 1 27 TYR CE2 C -11.415 6.370 0.732 1.00 . A A . 27 TYR CE2 1 1 13 8003 1 1 27 TYR CG C -10.919 4.483 -0.694 1.00 . A A . 27 TYR CG 1 1 13 8004 1 1 27 TYR CZ C -11.864 5.511 1.717 1.00 . A A . 27 TYR CZ 1 1 13 8005 1 1 27 TYR H H -11.753 1.483 -2.003 1.00 . A A . 27 TYR H 1 1 13 8006 1 1 27 TYR HA H -12.170 4.145 -3.190 1.00 . A A . 27 TYR HA 1 1 13 8007 1 1 27 TYR HB2 H -9.706 3.121 -1.763 1.00 . A A . 27 TYR HB2 1 1 13 8008 1 1 27 TYR HB3 H -9.870 4.690 -2.517 1.00 . A A . 27 TYR HB3 1 1 13 8009 1 1 27 TYR HD1 H -11.357 2.578 0.151 1.00 . A A . 27 TYR HD1 1 1 13 8010 1 1 27 TYR HD2 H -10.593 6.520 -1.237 1.00 . A A . 27 TYR HD2 1 1 13 8011 1 1 27 TYR HE1 H -12.197 3.476 2.275 1.00 . A A . 27 TYR HE1 1 1 13 8012 1 1 27 TYR HE2 H -11.422 7.438 0.893 1.00 . A A . 27 TYR HE2 1 1 13 8013 1 1 27 TYR HH H -13.072 6.617 2.746 1.00 . A A . 27 TYR HH 1 1 13 8014 1 1 27 TYR N N -12.224 2.299 -2.265 1.00 . A A . 27 TYR N 1 1 13 8015 1 1 27 TYR O O -10.999 1.645 -4.534 1.00 . A A . 27 TYR O 1 1 13 8016 1 1 27 TYR OH O -12.334 6.010 2.914 1.00 . A A . 27 TYR OH 1 1 13 8017 1 1 28 ALA C C -7.931 2.995 -5.881 1.00 . A A . 28 ALA C 1 1 13 8018 1 1 28 ALA CA C -9.417 3.243 -6.117 1.00 . A A . 28 ALA CA 1 1 13 8019 1 1 28 ALA CB C -9.614 4.289 -7.205 1.00 . A A . 28 ALA CB 1 1 13 8020 1 1 28 ALA H H -9.962 4.579 -4.568 1.00 . A A . 28 ALA H 1 1 13 8021 1 1 28 ALA HA H -9.875 2.324 -6.450 1.00 . A A . 28 ALA HA 1 1 13 8022 1 1 28 ALA HB1 H -10.544 4.810 -7.037 1.00 . A A . 28 ALA HB1 1 1 13 8023 1 1 28 ALA HB2 H -8.795 4.994 -7.177 1.00 . A A . 28 ALA HB2 1 1 13 8024 1 1 28 ALA HB3 H -9.640 3.805 -8.169 1.00 . A A . 28 ALA HB3 1 1 13 8025 1 1 28 ALA N N -10.083 3.658 -4.892 1.00 . A A . 28 ALA N 1 1 13 8026 1 1 28 ALA O O -7.386 1.975 -6.310 1.00 . A A . 28 ALA O 1 1 13 8027 1 1 29 SER C C -5.472 4.538 -3.639 1.00 . A A . 29 SER C 1 1 13 8028 1 1 29 SER CA C -5.853 3.800 -4.916 1.00 . A A . 29 SER CA 1 1 13 8029 1 1 29 SER CB C -5.033 4.334 -6.095 1.00 . A A . 29 SER CB 1 1 13 8030 1 1 29 SER H H -7.771 4.699 -4.841 1.00 . A A . 29 SER H 1 1 13 8031 1 1 29 SER HA H -5.630 2.750 -4.786 1.00 . A A . 29 SER HA 1 1 13 8032 1 1 29 SER HB2 H -4.298 5.033 -5.728 1.00 . A A . 29 SER HB2 1 1 13 8033 1 1 29 SER HB3 H -4.533 3.512 -6.585 1.00 . A A . 29 SER HB3 1 1 13 8034 1 1 29 SER HG H -6.180 5.833 -6.665 1.00 . A A . 29 SER HG 1 1 13 8035 1 1 29 SER N N -7.280 3.921 -5.190 1.00 . A A . 29 SER N 1 1 13 8036 1 1 29 SER O O -6.284 5.264 -3.066 1.00 . A A . 29 SER O 1 1 13 8037 1 1 29 SER OG O -5.856 4.998 -7.045 1.00 . A A . 29 SER OG 1 1 13 8038 1 1 30 HIS C C -2.224 5.233 -2.159 1.00 . A A . 30 HIS C 1 1 13 8039 1 1 30 HIS CA C -3.723 4.960 -1.992 1.00 . A A . 30 HIS CA 1 1 13 8040 1 1 30 HIS CB C -3.970 4.051 -0.780 1.00 . A A . 30 HIS CB 1 1 13 8041 1 1 30 HIS CD2 C -2.072 2.340 -0.421 1.00 . A A . 30 HIS CD2 1 1 13 8042 1 1 30 HIS CE1 C -2.893 0.636 -1.477 1.00 . A A . 30 HIS CE1 1 1 13 8043 1 1 30 HIS CG C -3.287 2.720 -0.876 1.00 . A A . 30 HIS CG 1 1 13 8044 1 1 30 HIS H H -3.645 3.734 -3.706 1.00 . A A . 30 HIS H 1 1 13 8045 1 1 30 HIS HA H -4.242 5.897 -1.851 1.00 . A A . 30 HIS HA 1 1 13 8046 1 1 30 HIS HB2 H -3.605 4.547 0.102 1.00 . A A . 30 HIS HB2 1 1 13 8047 1 1 30 HIS HB3 H -5.030 3.878 -0.676 1.00 . A A . 30 HIS HB3 1 1 13 8048 1 1 30 HIS HD1 H -4.693 1.559 -1.967 1.00 . A A . 30 HIS HD1 1 1 13 8049 1 1 30 HIS HD2 H -1.392 2.938 0.165 1.00 . A A . 30 HIS HD2 1 1 13 8050 1 1 30 HIS HE1 H -3.010 -0.343 -1.917 1.00 . A A . 30 HIS HE1 1 1 13 8051 1 1 30 HIS N N -4.240 4.331 -3.198 1.00 . A A . 30 HIS N 1 1 13 8052 1 1 30 HIS ND1 N -3.805 1.620 -1.543 1.00 . A A . 30 HIS ND1 1 1 13 8053 1 1 30 HIS NE2 N -1.843 1.039 -0.811 1.00 . A A . 30 HIS NE2 1 1 13 8054 1 1 30 HIS O O -1.679 5.040 -3.245 1.00 . A A . 30 HIS O 1 1 13 8055 1 1 31 ARG C C 0.503 5.759 0.274 1.00 . A A . 31 ARG C 1 1 13 8056 1 1 31 ARG CA C -0.106 5.836 -1.120 1.00 . A A . 31 ARG CA 1 1 13 8057 1 1 31 ARG CB C 0.215 7.190 -1.751 1.00 . A A . 31 ARG CB 1 1 13 8058 1 1 31 ARG CD C 2.528 7.624 -2.652 1.00 . A A . 31 ARG CD 1 1 13 8059 1 1 31 ARG CG C 1.138 7.083 -2.952 1.00 . A A . 31 ARG CG 1 1 13 8060 1 1 31 ARG CZ C 4.557 7.998 -4.022 1.00 . A A . 31 ARG CZ 1 1 13 8061 1 1 31 ARG H H -2.026 5.719 -0.225 1.00 . A A . 31 ARG H 1 1 13 8062 1 1 31 ARG HA H 0.327 5.057 -1.727 1.00 . A A . 31 ARG HA 1 1 13 8063 1 1 31 ARG HB2 H -0.706 7.653 -2.069 1.00 . A A . 31 ARG HB2 1 1 13 8064 1 1 31 ARG HB3 H 0.690 7.818 -1.010 1.00 . A A . 31 ARG HB3 1 1 13 8065 1 1 31 ARG HD2 H 2.435 8.478 -1.997 1.00 . A A . 31 ARG HD2 1 1 13 8066 1 1 31 ARG HD3 H 3.102 6.854 -2.158 1.00 . A A . 31 ARG HD3 1 1 13 8067 1 1 31 ARG HE H 2.679 8.366 -4.614 1.00 . A A . 31 ARG HE 1 1 13 8068 1 1 31 ARG HG2 H 1.221 6.043 -3.229 1.00 . A A . 31 ARG HG2 1 1 13 8069 1 1 31 ARG HG3 H 0.711 7.642 -3.769 1.00 . A A . 31 ARG HG3 1 1 13 8070 1 1 31 ARG HH11 H 4.928 7.201 -2.198 1.00 . A A . 31 ARG HH11 1 1 13 8071 1 1 31 ARG HH12 H 6.332 7.495 -3.173 1.00 . A A . 31 ARG HH12 1 1 13 8072 1 1 31 ARG HH21 H 4.514 8.759 -5.903 1.00 . A A . 31 ARG HH21 1 1 13 8073 1 1 31 ARG HH22 H 6.103 8.407 -5.284 1.00 . A A . 31 ARG HH22 1 1 13 8074 1 1 31 ARG N N -1.549 5.614 -1.078 1.00 . A A . 31 ARG N 1 1 13 8075 1 1 31 ARG NE N 3.230 8.036 -3.869 1.00 . A A . 31 ARG NE 1 1 13 8076 1 1 31 ARG NH1 N 5.332 7.532 -3.052 1.00 . A A . 31 ARG NH1 1 1 13 8077 1 1 31 ARG NH2 N 5.101 8.419 -5.157 1.00 . A A . 31 ARG NH2 1 1 13 8078 1 1 31 ARG O O 1.688 6.029 0.465 1.00 . A A . 31 ARG O 1 1 13 8079 1 1 32 SER C C -0.328 3.836 3.165 1.00 . A A . 32 SER C 1 1 13 8080 1 1 32 SER CA C 0.169 5.165 2.600 1.00 . A A . 32 SER CA 1 1 13 8081 1 1 32 SER CB C -0.306 6.326 3.477 1.00 . A A . 32 SER CB 1 1 13 8082 1 1 32 SER H H -1.217 5.088 1.013 1.00 . A A . 32 SER H 1 1 13 8083 1 1 32 SER HA H 1.249 5.154 2.581 1.00 . A A . 32 SER HA 1 1 13 8084 1 1 32 SER HB2 H -1.071 5.976 4.152 1.00 . A A . 32 SER HB2 1 1 13 8085 1 1 32 SER HB3 H 0.527 6.706 4.045 1.00 . A A . 32 SER HB3 1 1 13 8086 1 1 32 SER HG H -1.337 7.006 1.954 1.00 . A A . 32 SER HG 1 1 13 8087 1 1 32 SER N N -0.300 5.339 1.236 1.00 . A A . 32 SER N 1 1 13 8088 1 1 32 SER O O -1.161 3.167 2.549 1.00 . A A . 32 SER O 1 1 13 8089 1 1 32 SER OG O -0.841 7.380 2.692 1.00 . A A . 32 SER OG 1 1 13 8090 1 1 33 LEU C C -1.544 2.216 5.604 1.00 . A A . 33 LEU C 1 1 13 8091 1 1 33 LEU CA C -0.163 2.194 4.964 1.00 . A A . 33 LEU CA 1 1 13 8092 1 1 33 LEU CB C 0.872 1.859 6.034 1.00 . A A . 33 LEU CB 1 1 13 8093 1 1 33 LEU CD1 C 3.072 0.769 6.485 1.00 . A A . 33 LEU CD1 1 1 13 8094 1 1 33 LEU CD2 C 1.063 -0.628 5.987 1.00 . A A . 33 LEU CD2 1 1 13 8095 1 1 33 LEU CG C 1.775 0.682 5.701 1.00 . A A . 33 LEU CG 1 1 13 8096 1 1 33 LEU H H 0.856 4.029 4.771 1.00 . A A . 33 LEU H 1 1 13 8097 1 1 33 LEU HA H -0.141 1.430 4.202 1.00 . A A . 33 LEU HA 1 1 13 8098 1 1 33 LEU HB2 H 1.491 2.730 6.190 1.00 . A A . 33 LEU HB2 1 1 13 8099 1 1 33 LEU HB3 H 0.351 1.638 6.953 1.00 . A A . 33 LEU HB3 1 1 13 8100 1 1 33 LEU HD11 H 2.862 0.664 7.538 1.00 . A A . 33 LEU HD11 1 1 13 8101 1 1 33 LEU HD12 H 3.737 -0.019 6.168 1.00 . A A . 33 LEU HD12 1 1 13 8102 1 1 33 LEU HD13 H 3.536 1.726 6.302 1.00 . A A . 33 LEU HD13 1 1 13 8103 1 1 33 LEU HD21 H 0.883 -1.149 5.059 1.00 . A A . 33 LEU HD21 1 1 13 8104 1 1 33 LEU HD22 H 1.677 -1.239 6.633 1.00 . A A . 33 LEU HD22 1 1 13 8105 1 1 33 LEU HD23 H 0.122 -0.424 6.476 1.00 . A A . 33 LEU HD23 1 1 13 8106 1 1 33 LEU HG H 2.015 0.717 4.651 1.00 . A A . 33 LEU HG 1 1 13 8107 1 1 33 LEU N N 0.173 3.465 4.341 1.00 . A A . 33 LEU N 1 1 13 8108 1 1 33 LEU O O -1.903 1.309 6.350 1.00 . A A . 33 LEU O 1 1 13 8109 1 1 34 SER C C -4.655 2.637 4.969 1.00 . A A . 34 SER C 1 1 13 8110 1 1 34 SER CA C -3.651 3.371 5.856 1.00 . A A . 34 SER CA 1 1 13 8111 1 1 34 SER CB C -4.026 4.848 5.964 1.00 . A A . 34 SER CB 1 1 13 8112 1 1 34 SER H H -1.964 3.960 4.745 1.00 . A A . 34 SER H 1 1 13 8113 1 1 34 SER HA H -3.661 2.929 6.841 1.00 . A A . 34 SER HA 1 1 13 8114 1 1 34 SER HB2 H -4.856 5.056 5.303 1.00 . A A . 34 SER HB2 1 1 13 8115 1 1 34 SER HB3 H -4.309 5.073 6.980 1.00 . A A . 34 SER HB3 1 1 13 8116 1 1 34 SER HG H -2.887 6.437 6.203 1.00 . A A . 34 SER HG 1 1 13 8117 1 1 34 SER N N -2.312 3.250 5.319 1.00 . A A . 34 SER N 1 1 13 8118 1 1 34 SER O O -5.809 2.442 5.352 1.00 . A A . 34 SER O 1 1 13 8119 1 1 34 SER OG O -2.929 5.677 5.599 1.00 . A A . 34 SER OG 1 1 13 8120 1 1 35 GLY C C -4.501 0.500 2.062 1.00 . A A . 35 GLY C 1 1 13 8121 1 1 35 GLY CA C -5.134 1.634 2.835 1.00 . A A . 35 GLY CA 1 1 13 8122 1 1 35 GLY H H -3.308 2.478 3.488 1.00 . A A . 35 GLY H 1 1 13 8123 1 1 35 GLY HA2 H -5.979 1.249 3.387 1.00 . A A . 35 GLY HA2 1 1 13 8124 1 1 35 GLY HA3 H -5.490 2.375 2.134 1.00 . A A . 35 GLY HA3 1 1 13 8125 1 1 35 GLY N N -4.228 2.274 3.763 1.00 . A A . 35 GLY N 1 1 13 8126 1 1 35 GLY O O -5.077 0.031 1.081 1.00 . A A . 35 GLY O 1 1 13 8127 1 1 36 CYS C C -3.442 -2.373 2.040 1.00 . A A . 36 CYS C 1 1 13 8128 1 1 36 CYS CA C -2.649 -1.071 1.878 1.00 . A A . 36 CYS CA 1 1 13 8129 1 1 36 CYS CB C -1.252 -1.244 2.485 1.00 . A A . 36 CYS CB 1 1 13 8130 1 1 36 CYS H H -2.952 0.440 3.325 1.00 . A A . 36 CYS H 1 1 13 8131 1 1 36 CYS HA H -2.553 -0.845 0.827 1.00 . A A . 36 CYS HA 1 1 13 8132 1 1 36 CYS HB2 H -1.324 -1.147 3.560 1.00 . A A . 36 CYS HB2 1 1 13 8133 1 1 36 CYS HB3 H -0.885 -2.232 2.242 1.00 . A A . 36 CYS HB3 1 1 13 8134 1 1 36 CYS N N -3.338 0.041 2.516 1.00 . A A . 36 CYS N 1 1 13 8135 1 1 36 CYS O O -3.560 -2.901 3.148 1.00 . A A . 36 CYS O 1 1 13 8136 1 1 36 CYS SG S -0.017 -0.036 1.907 1.00 . A A . 36 CYS SG 1 1 13 8137 1 1 37 PRO C C -3.788 -5.382 1.076 1.00 . A A . 37 PRO C 1 1 13 8138 1 1 37 PRO CA C -4.720 -4.180 0.958 1.00 . A A . 37 PRO CA 1 1 13 8139 1 1 37 PRO CB C -5.443 -4.183 -0.385 1.00 . A A . 37 PRO CB 1 1 13 8140 1 1 37 PRO CD C -3.894 -2.349 -0.422 1.00 . A A . 37 PRO CD 1 1 13 8141 1 1 37 PRO CG C -4.576 -3.376 -1.287 1.00 . A A . 37 PRO CG 1 1 13 8142 1 1 37 PRO HA H -5.440 -4.203 1.764 1.00 . A A . 37 PRO HA 1 1 13 8143 1 1 37 PRO HB2 H -5.545 -5.198 -0.740 1.00 . A A . 37 PRO HB2 1 1 13 8144 1 1 37 PRO HB3 H -6.418 -3.734 -0.273 1.00 . A A . 37 PRO HB3 1 1 13 8145 1 1 37 PRO HD2 H -2.867 -2.219 -0.724 1.00 . A A . 37 PRO HD2 1 1 13 8146 1 1 37 PRO HD3 H -4.421 -1.407 -0.472 1.00 . A A . 37 PRO HD3 1 1 13 8147 1 1 37 PRO HG2 H -3.842 -4.014 -1.757 1.00 . A A . 37 PRO HG2 1 1 13 8148 1 1 37 PRO HG3 H -5.183 -2.888 -2.037 1.00 . A A . 37 PRO HG3 1 1 13 8149 1 1 37 PRO N N -3.976 -2.919 0.936 1.00 . A A . 37 PRO N 1 1 13 8150 1 1 37 PRO O O -4.228 -6.508 1.315 1.00 . A A . 37 PRO O 1 1 13 8151 1 1 38 ARG C C -0.564 -5.858 2.242 1.00 . A A . 38 ARG C 1 1 13 8152 1 1 38 ARG CA C -1.485 -6.161 1.069 1.00 . A A . 38 ARG CA 1 1 13 8153 1 1 38 ARG CB C -0.674 -6.280 -0.222 1.00 . A A . 38 ARG CB 1 1 13 8154 1 1 38 ARG CD C -1.318 -5.951 -2.618 1.00 . A A . 38 ARG CD 1 1 13 8155 1 1 38 ARG CG C -1.475 -6.825 -1.390 1.00 . A A . 38 ARG CG 1 1 13 8156 1 1 38 ARG CZ C -2.772 -4.485 -3.961 1.00 . A A . 38 ARG CZ 1 1 13 8157 1 1 38 ARG H H -2.210 -4.199 0.775 1.00 . A A . 38 ARG H 1 1 13 8158 1 1 38 ARG HA H -1.990 -7.097 1.257 1.00 . A A . 38 ARG HA 1 1 13 8159 1 1 38 ARG HB2 H -0.305 -5.303 -0.495 1.00 . A A . 38 ARG HB2 1 1 13 8160 1 1 38 ARG HB3 H 0.165 -6.938 -0.049 1.00 . A A . 38 ARG HB3 1 1 13 8161 1 1 38 ARG HD2 H -0.772 -5.061 -2.343 1.00 . A A . 38 ARG HD2 1 1 13 8162 1 1 38 ARG HD3 H -0.756 -6.499 -3.360 1.00 . A A . 38 ARG HD3 1 1 13 8163 1 1 38 ARG HE H -3.387 -6.134 -2.992 1.00 . A A . 38 ARG HE 1 1 13 8164 1 1 38 ARG HG2 H -1.130 -7.822 -1.620 1.00 . A A . 38 ARG HG2 1 1 13 8165 1 1 38 ARG HG3 H -2.520 -6.858 -1.113 1.00 . A A . 38 ARG HG3 1 1 13 8166 1 1 38 ARG HH11 H -0.849 -3.888 -3.789 1.00 . A A . 38 ARG HH11 1 1 13 8167 1 1 38 ARG HH12 H -1.846 -2.872 -4.790 1.00 . A A . 38 ARG HH12 1 1 13 8168 1 1 38 ARG HH21 H -4.753 -4.803 -4.292 1.00 . A A . 38 ARG HH21 1 1 13 8169 1 1 38 ARG HH22 H -4.089 -3.383 -5.045 1.00 . A A . 38 ARG HH22 1 1 13 8170 1 1 38 ARG N N -2.495 -5.123 0.942 1.00 . A A . 38 ARG N 1 1 13 8171 1 1 38 ARG NE N -2.606 -5.558 -3.191 1.00 . A A . 38 ARG NE 1 1 13 8172 1 1 38 ARG NH1 N -1.741 -3.686 -4.195 1.00 . A A . 38 ARG NH1 1 1 13 8173 1 1 38 ARG NH2 N -3.964 -4.203 -4.478 1.00 . A A . 38 ARG NH2 1 1 13 8174 1 1 38 ARG O O 0.536 -6.408 2.339 1.00 . A A . 38 ARG O 1 1 13 8175 1 1 39 ALA C C 0.007 -5.883 5.176 1.00 . A A . 39 ALA C 1 1 13 8176 1 1 39 ALA CA C -0.280 -4.647 4.339 1.00 . A A . 39 ALA CA 1 1 13 8177 1 1 39 ALA CB C -1.035 -3.617 5.162 1.00 . A A . 39 ALA CB 1 1 13 8178 1 1 39 ALA H H -1.930 -4.623 3.019 1.00 . A A . 39 ALA H 1 1 13 8179 1 1 39 ALA HA H 0.657 -4.210 4.025 1.00 . A A . 39 ALA HA 1 1 13 8180 1 1 39 ALA HB1 H -0.412 -3.283 5.980 1.00 . A A . 39 ALA HB1 1 1 13 8181 1 1 39 ALA HB2 H -1.291 -2.774 4.537 1.00 . A A . 39 ALA HB2 1 1 13 8182 1 1 39 ALA HB3 H -1.938 -4.060 5.554 1.00 . A A . 39 ALA HB3 1 1 13 8183 1 1 39 ALA N N -1.036 -5.002 3.145 1.00 . A A . 39 ALA N 1 1 13 8184 1 1 39 ALA O O -0.917 -6.507 5.705 1.00 . A A . 39 ALA O 1 1 13 8185 1 1 40 LYS C C 0.922 -8.701 5.448 1.00 . A A . 40 LYS C 1 1 13 8186 1 1 40 LYS CA C 1.725 -7.483 5.896 1.00 . A A . 40 LYS CA 1 1 13 8187 1 1 40 LYS CB C 1.633 -7.319 7.414 1.00 . A A . 40 LYS CB 1 1 13 8188 1 1 40 LYS CD C 3.284 -5.615 8.233 1.00 . A A . 40 LYS CD 1 1 13 8189 1 1 40 LYS CE C 2.964 -5.123 9.632 1.00 . A A . 40 LYS CE 1 1 13 8190 1 1 40 LYS CG C 2.983 -7.096 8.075 1.00 . A A . 40 LYS CG 1 1 13 8191 1 1 40 LYS H H 1.940 -5.733 4.726 1.00 . A A . 40 LYS H 1 1 13 8192 1 1 40 LYS HA H 2.758 -7.641 5.628 1.00 . A A . 40 LYS HA 1 1 13 8193 1 1 40 LYS HB2 H 1.001 -6.472 7.637 1.00 . A A . 40 LYS HB2 1 1 13 8194 1 1 40 LYS HB3 H 1.191 -8.211 7.836 1.00 . A A . 40 LYS HB3 1 1 13 8195 1 1 40 LYS HD2 H 4.333 -5.447 8.035 1.00 . A A . 40 LYS HD2 1 1 13 8196 1 1 40 LYS HD3 H 2.691 -5.060 7.521 1.00 . A A . 40 LYS HD3 1 1 13 8197 1 1 40 LYS HE2 H 3.149 -5.924 10.331 1.00 . A A . 40 LYS HE2 1 1 13 8198 1 1 40 LYS HE3 H 3.610 -4.288 9.862 1.00 . A A . 40 LYS HE3 1 1 13 8199 1 1 40 LYS HG2 H 2.979 -7.559 9.051 1.00 . A A . 40 LYS HG2 1 1 13 8200 1 1 40 LYS HG3 H 3.753 -7.547 7.463 1.00 . A A . 40 LYS HG3 1 1 13 8201 1 1 40 LYS HZ1 H 1.033 -4.864 8.867 1.00 . A A . 40 LYS HZ1 1 1 13 8202 1 1 40 LYS HZ2 H 1.503 -3.671 9.975 1.00 . A A . 40 LYS HZ2 1 1 13 8203 1 1 40 LYS HZ3 H 1.078 -5.220 10.524 1.00 . A A . 40 LYS HZ3 1 1 13 8204 1 1 40 LYS N N 1.278 -6.271 5.211 1.00 . A A . 40 LYS N 1 1 13 8205 1 1 40 LYS NZ N 1.549 -4.690 9.758 1.00 . A A . 40 LYS NZ 1 1 13 8206 1 1 40 LYS O O 0.623 -9.585 6.248 1.00 . A A . 40 LYS O 1 1 13 8207 1 1 41 LYS C C 0.472 -11.140 3.779 1.00 . A A . 41 LYS C 1 1 13 8208 1 1 41 LYS CA C -0.238 -9.806 3.598 1.00 . A A . 41 LYS CA 1 1 13 8209 1 1 41 LYS CB C -0.499 -9.554 2.110 1.00 . A A . 41 LYS CB 1 1 13 8210 1 1 41 LYS CD C -1.872 -11.356 1.024 1.00 . A A . 41 LYS CD 1 1 13 8211 1 1 41 LYS CE C -1.447 -11.306 -0.433 1.00 . A A . 41 LYS CE 1 1 13 8212 1 1 41 LYS CG C -1.884 -9.971 1.652 1.00 . A A . 41 LYS CG 1 1 13 8213 1 1 41 LYS H H 0.804 -7.963 3.591 1.00 . A A . 41 LYS H 1 1 13 8214 1 1 41 LYS HA H -1.182 -9.839 4.120 1.00 . A A . 41 LYS HA 1 1 13 8215 1 1 41 LYS HB2 H -0.381 -8.499 1.909 1.00 . A A . 41 LYS HB2 1 1 13 8216 1 1 41 LYS HB3 H 0.231 -10.104 1.531 1.00 . A A . 41 LYS HB3 1 1 13 8217 1 1 41 LYS HD2 H -1.179 -11.982 1.568 1.00 . A A . 41 LYS HD2 1 1 13 8218 1 1 41 LYS HD3 H -2.864 -11.777 1.087 1.00 . A A . 41 LYS HD3 1 1 13 8219 1 1 41 LYS HE2 H -2.324 -11.410 -1.055 1.00 . A A . 41 LYS HE2 1 1 13 8220 1 1 41 LYS HE3 H -0.982 -10.350 -0.625 1.00 . A A . 41 LYS HE3 1 1 13 8221 1 1 41 LYS HG2 H -2.548 -9.979 2.506 1.00 . A A . 41 LYS HG2 1 1 13 8222 1 1 41 LYS HG3 H -2.241 -9.258 0.923 1.00 . A A . 41 LYS HG3 1 1 13 8223 1 1 41 LYS HZ1 H 0.358 -12.326 -0.160 1.00 . A A . 41 LYS HZ1 1 1 13 8224 1 1 41 LYS HZ2 H -0.189 -12.315 -1.766 1.00 . A A . 41 LYS HZ2 1 1 13 8225 1 1 41 LYS HZ3 H -0.936 -13.324 -0.626 1.00 . A A . 41 LYS HZ3 1 1 13 8226 1 1 41 LYS N N 0.554 -8.719 4.167 1.00 . A A . 41 LYS N 1 1 13 8227 1 1 41 LYS NZ N -0.487 -12.391 -0.769 1.00 . A A . 41 LYS NZ 1 1 13 8228 1 1 41 LYS O O 1.474 -11.411 3.110 1.00 . A A . 41 LYS O 1 1 13 8229 1 1 42 SER C C 2.072 -13.014 5.490 1.00 . A A . 42 SER C 1 1 13 8230 1 1 42 SER CA C 0.610 -13.206 5.086 1.00 . A A . 42 SER CA 1 1 13 8231 1 1 42 SER CB C 0.504 -14.183 3.910 1.00 . A A . 42 SER CB 1 1 13 8232 1 1 42 SER H H -0.766 -11.611 5.278 1.00 . A A . 42 SER H 1 1 13 8233 1 1 42 SER HA H 0.070 -13.614 5.928 1.00 . A A . 42 SER HA 1 1 13 8234 1 1 42 SER HB2 H 1.328 -14.016 3.233 1.00 . A A . 42 SER HB2 1 1 13 8235 1 1 42 SER HB3 H 0.543 -15.196 4.283 1.00 . A A . 42 SER HB3 1 1 13 8236 1 1 42 SER HG H -1.265 -13.355 3.670 1.00 . A A . 42 SER HG 1 1 13 8237 1 1 42 SER N N -0.004 -11.928 4.742 1.00 . A A . 42 SER N 1 1 13 8238 1 1 42 SER O O 2.920 -13.864 5.219 1.00 . A A . 42 SER O 1 1 13 8239 1 1 42 SER OG O -0.716 -14.002 3.202 1.00 . A A . 42 SER OG 1 1 13 8240 1 1 43 GLY C C 4.532 -11.044 5.252 1.00 . A A . 43 GLY C 1 1 13 8241 1 1 43 GLY CA C 3.730 -11.540 6.442 1.00 . A A . 43 GLY CA 1 1 13 8242 1 1 43 GLY H H 1.652 -11.199 6.223 1.00 . A A . 43 GLY H 1 1 13 8243 1 1 43 GLY HA2 H 3.721 -10.775 7.204 1.00 . A A . 43 GLY HA2 1 1 13 8244 1 1 43 GLY HA3 H 4.204 -12.425 6.839 1.00 . A A . 43 GLY HA3 1 1 13 8245 1 1 43 GLY N N 2.366 -11.860 6.079 1.00 . A A . 43 GLY N 1 1 13 8246 1 1 43 GLY O O 4.632 -11.726 4.234 1.00 . A A . 43 GLY O 1 1 13 8247 1 1 44 LEU C C 7.106 -9.951 4.001 1.00 . A A . 44 LEU C 1 1 13 8248 1 1 44 LEU CA C 5.794 -9.223 4.256 1.00 . A A . 44 LEU CA 1 1 13 8249 1 1 44 LEU CB C 6.072 -7.758 4.572 1.00 . A A . 44 LEU CB 1 1 13 8250 1 1 44 LEU CD1 C 5.172 -5.547 5.276 1.00 . A A . 44 LEU CD1 1 1 13 8251 1 1 44 LEU CD2 C 4.283 -6.656 3.221 1.00 . A A . 44 LEU CD2 1 1 13 8252 1 1 44 LEU CG C 4.838 -6.868 4.616 1.00 . A A . 44 LEU CG 1 1 13 8253 1 1 44 LEU H H 4.901 -9.303 6.167 1.00 . A A . 44 LEU H 1 1 13 8254 1 1 44 LEU HA H 5.184 -9.280 3.367 1.00 . A A . 44 LEU HA 1 1 13 8255 1 1 44 LEU HB2 H 6.557 -7.706 5.537 1.00 . A A . 44 LEU HB2 1 1 13 8256 1 1 44 LEU HB3 H 6.746 -7.367 3.825 1.00 . A A . 44 LEU HB3 1 1 13 8257 1 1 44 LEU HD11 H 4.951 -5.614 6.332 1.00 . A A . 44 LEU HD11 1 1 13 8258 1 1 44 LEU HD12 H 6.221 -5.332 5.141 1.00 . A A . 44 LEU HD12 1 1 13 8259 1 1 44 LEU HD13 H 4.581 -4.759 4.831 1.00 . A A . 44 LEU HD13 1 1 13 8260 1 1 44 LEU HD21 H 3.879 -7.588 2.854 1.00 . A A . 44 LEU HD21 1 1 13 8261 1 1 44 LEU HD22 H 3.504 -5.912 3.252 1.00 . A A . 44 LEU HD22 1 1 13 8262 1 1 44 LEU HD23 H 5.074 -6.324 2.563 1.00 . A A . 44 LEU HD23 1 1 13 8263 1 1 44 LEU HG H 4.076 -7.353 5.208 1.00 . A A . 44 LEU HG 1 1 13 8264 1 1 44 LEU N N 5.052 -9.827 5.351 1.00 . A A . 44 LEU N 1 1 13 8265 1 1 44 LEU O O 7.624 -9.940 2.883 1.00 . A A . 44 LEU O 1 1 13 8266 1 1 45 ARG C C 8.738 -12.736 4.646 1.00 . A A . 45 ARG C 1 1 13 8267 1 1 45 ARG CA C 8.929 -11.249 4.941 1.00 . A A . 45 ARG CA 1 1 13 8268 1 1 45 ARG CB C 9.717 -11.064 6.238 1.00 . A A . 45 ARG CB 1 1 13 8269 1 1 45 ARG CD C 11.909 -11.418 7.417 1.00 . A A . 45 ARG CD 1 1 13 8270 1 1 45 ARG CG C 11.222 -11.222 6.075 1.00 . A A . 45 ARG CG 1 1 13 8271 1 1 45 ARG CZ C 10.619 -11.883 9.473 1.00 . A A . 45 ARG CZ 1 1 13 8272 1 1 45 ARG H H 7.191 -10.531 5.912 1.00 . A A . 45 ARG H 1 1 13 8273 1 1 45 ARG HA H 9.481 -10.802 4.129 1.00 . A A . 45 ARG HA 1 1 13 8274 1 1 45 ARG HB2 H 9.521 -10.074 6.625 1.00 . A A . 45 ARG HB2 1 1 13 8275 1 1 45 ARG HB3 H 9.378 -11.794 6.957 1.00 . A A . 45 ARG HB3 1 1 13 8276 1 1 45 ARG HD2 H 12.877 -11.865 7.250 1.00 . A A . 45 ARG HD2 1 1 13 8277 1 1 45 ARG HD3 H 12.036 -10.454 7.886 1.00 . A A . 45 ARG HD3 1 1 13 8278 1 1 45 ARG HE H 10.985 -13.214 8.017 1.00 . A A . 45 ARG HE 1 1 13 8279 1 1 45 ARG HG2 H 11.420 -12.081 5.452 1.00 . A A . 45 ARG HG2 1 1 13 8280 1 1 45 ARG HG3 H 11.618 -10.334 5.604 1.00 . A A . 45 ARG HG3 1 1 13 8281 1 1 45 ARG HH11 H 11.335 -9.986 9.345 1.00 . A A . 45 ARG HH11 1 1 13 8282 1 1 45 ARG HH12 H 10.415 -10.339 10.781 1.00 . A A . 45 ARG HH12 1 1 13 8283 1 1 45 ARG HH21 H 9.783 -13.678 9.887 1.00 . A A . 45 ARG HH21 1 1 13 8284 1 1 45 ARG HH22 H 9.509 -12.447 11.082 1.00 . A A . 45 ARG HH22 1 1 13 8285 1 1 45 ARG N N 7.650 -10.563 5.041 1.00 . A A . 45 ARG N 1 1 13 8286 1 1 45 ARG NE N 11.136 -12.279 8.312 1.00 . A A . 45 ARG NE 1 1 13 8287 1 1 45 ARG NH1 N 10.804 -10.637 9.900 1.00 . A A . 45 ARG NH1 1 1 13 8288 1 1 45 ARG NH2 N 9.918 -12.739 10.206 1.00 . A A . 45 ARG NH2 1 1 13 8289 1 1 45 ARG O O 9.688 -13.518 4.693 1.00 . A A . 45 ARG O 1 1 13 8290 1 1 46 VAL C C 6.782 -14.596 2.508 1.00 . A A . 46 VAL C 1 1 13 8291 1 1 46 VAL CA C 7.233 -14.503 3.961 1.00 . A A . 46 VAL CA 1 1 13 8292 1 1 46 VAL CB C 6.153 -15.126 4.873 1.00 . A A . 46 VAL CB 1 1 13 8293 1 1 46 VAL CG1 C 6.361 -16.628 4.994 1.00 . A A . 46 VAL CG1 1 1 13 8294 1 1 46 VAL CG2 C 6.158 -14.477 6.250 1.00 . A A . 46 VAL CG2 1 1 13 8295 1 1 46 VAL H H 6.799 -12.454 4.251 1.00 . A A . 46 VAL H 1 1 13 8296 1 1 46 VAL HA H 8.147 -15.068 4.078 1.00 . A A . 46 VAL HA 1 1 13 8297 1 1 46 VAL HB H 5.188 -14.954 4.418 1.00 . A A . 46 VAL HB 1 1 13 8298 1 1 46 VAL HG11 H 6.405 -17.064 4.007 1.00 . A A . 46 VAL HG11 1 1 13 8299 1 1 46 VAL HG12 H 7.287 -16.823 5.516 1.00 . A A . 46 VAL HG12 1 1 13 8300 1 1 46 VAL HG13 H 5.540 -17.063 5.544 1.00 . A A . 46 VAL HG13 1 1 13 8301 1 1 46 VAL HG21 H 5.659 -13.519 6.199 1.00 . A A . 46 VAL HG21 1 1 13 8302 1 1 46 VAL HG22 H 5.639 -15.115 6.949 1.00 . A A . 46 VAL HG22 1 1 13 8303 1 1 46 VAL HG23 H 7.176 -14.336 6.577 1.00 . A A . 46 VAL HG23 1 1 13 8304 1 1 46 VAL N N 7.519 -13.121 4.308 1.00 . A A . 46 VAL N 1 1 13 8305 1 1 46 VAL O O 6.174 -13.622 2.015 1.00 . A A . 46 VAL O 1 1 13 8306 1 1 46 VAL OXT O 7.056 -15.626 1.859 1.00 . A A . 46 VAL OXT 1 1 13 8307 2 2 1 ZN ZN ZN -0.212 0.087 -0.387 1.00 . B A . 47 ZN ZN 1 1 14 8308 1 1 1 GLY C C 14.856 9.947 -3.430 1.00 . A A . 1 GLY C 1 1 14 8309 1 1 1 GLY CA C 14.372 9.008 -2.349 1.00 . A A . 1 GLY CA 1 1 14 8310 1 1 1 GLY H1 H 12.546 8.057 -2.011 1.00 . A A . 1 GLY H1 1 1 14 8311 1 1 1 GLY H2 H 12.468 9.322 -3.133 1.00 . A A . 1 GLY H2 1 1 14 8312 1 1 1 GLY H3 H 12.599 9.668 -1.475 1.00 . A A . 1 GLY H3 1 1 14 8313 1 1 1 GLY HA2 H 14.798 9.311 -1.405 1.00 . A A . 1 GLY HA2 1 1 14 8314 1 1 1 GLY HA3 H 14.703 8.008 -2.580 1.00 . A A . 1 GLY HA3 1 1 14 8315 1 1 1 GLY N N 12.895 9.013 -2.233 1.00 . A A . 1 GLY N 1 1 14 8316 1 1 1 GLY O O 14.070 10.406 -4.258 1.00 . A A . 1 GLY O 1 1 14 8317 1 1 2 SER C C 17.136 10.396 -5.660 1.00 . A A . 2 SER C 1 1 14 8318 1 1 2 SER CA C 16.726 11.152 -4.396 1.00 . A A . 2 SER CA 1 1 14 8319 1 1 2 SER CB C 17.928 11.870 -3.779 1.00 . A A . 2 SER CB 1 1 14 8320 1 1 2 SER H H 16.721 9.857 -2.722 1.00 . A A . 2 SER H 1 1 14 8321 1 1 2 SER HA H 15.976 11.884 -4.657 1.00 . A A . 2 SER HA 1 1 14 8322 1 1 2 SER HB2 H 18.787 11.216 -3.800 1.00 . A A . 2 SER HB2 1 1 14 8323 1 1 2 SER HB3 H 18.144 12.764 -4.345 1.00 . A A . 2 SER HB3 1 1 14 8324 1 1 2 SER HG H 16.891 12.829 -2.414 1.00 . A A . 2 SER HG 1 1 14 8325 1 1 2 SER N N 16.143 10.248 -3.418 1.00 . A A . 2 SER N 1 1 14 8326 1 1 2 SER O O 18.323 10.152 -5.898 1.00 . A A . 2 SER O 1 1 14 8327 1 1 2 SER OG O 17.658 12.234 -2.434 1.00 . A A . 2 SER OG 1 1 14 8328 1 1 3 MET C C 16.523 10.258 -8.854 1.00 . A A . 3 MET C 1 1 14 8329 1 1 3 MET CA C 16.405 9.282 -7.693 1.00 . A A . 3 MET CA 1 1 14 8330 1 1 3 MET CB C 15.288 8.274 -7.968 1.00 . A A . 3 MET CB 1 1 14 8331 1 1 3 MET CE C 13.286 5.608 -8.236 1.00 . A A . 3 MET CE 1 1 14 8332 1 1 3 MET CG C 15.289 7.081 -7.026 1.00 . A A . 3 MET CG 1 1 14 8333 1 1 3 MET H H 15.221 10.223 -6.210 1.00 . A A . 3 MET H 1 1 14 8334 1 1 3 MET HA H 17.341 8.754 -7.582 1.00 . A A . 3 MET HA 1 1 14 8335 1 1 3 MET HB2 H 14.337 8.777 -7.872 1.00 . A A . 3 MET HB2 1 1 14 8336 1 1 3 MET HB3 H 15.391 7.907 -8.979 1.00 . A A . 3 MET HB3 1 1 14 8337 1 1 3 MET HE1 H 12.307 5.156 -8.188 1.00 . A A . 3 MET HE1 1 1 14 8338 1 1 3 MET HE2 H 13.317 6.313 -9.054 1.00 . A A . 3 MET HE2 1 1 14 8339 1 1 3 MET HE3 H 14.031 4.842 -8.395 1.00 . A A . 3 MET HE3 1 1 14 8340 1 1 3 MET HG2 H 15.873 6.288 -7.468 1.00 . A A . 3 MET HG2 1 1 14 8341 1 1 3 MET HG3 H 15.738 7.378 -6.088 1.00 . A A . 3 MET HG3 1 1 14 8342 1 1 3 MET N N 16.148 10.008 -6.457 1.00 . A A . 3 MET N 1 1 14 8343 1 1 3 MET O O 17.625 10.559 -9.316 1.00 . A A . 3 MET O 1 1 14 8344 1 1 3 MET SD S 13.627 6.462 -6.699 1.00 . A A . 3 MET SD 1 1 14 8345 1 1 4 ALA C C 15.340 13.223 -9.663 1.00 . A A . 4 ALA C 1 1 14 8346 1 1 4 ALA CA C 15.387 11.838 -10.294 1.00 . A A . 4 ALA CA 1 1 14 8347 1 1 4 ALA CB C 14.210 11.626 -11.232 1.00 . A A . 4 ALA CB 1 1 14 8348 1 1 4 ALA H H 14.554 10.596 -8.797 1.00 . A A . 4 ALA H 1 1 14 8349 1 1 4 ALA HA H 16.298 11.742 -10.864 1.00 . A A . 4 ALA HA 1 1 14 8350 1 1 4 ALA HB1 H 13.293 11.613 -10.662 1.00 . A A . 4 ALA HB1 1 1 14 8351 1 1 4 ALA HB2 H 14.175 12.431 -11.952 1.00 . A A . 4 ALA HB2 1 1 14 8352 1 1 4 ALA HB3 H 14.328 10.686 -11.749 1.00 . A A . 4 ALA HB3 1 1 14 8353 1 1 4 ALA N N 15.397 10.821 -9.256 1.00 . A A . 4 ALA N 1 1 14 8354 1 1 4 ALA O O 16.359 13.911 -9.582 1.00 . A A . 4 ALA O 1 1 14 8355 1 1 5 ALA C C 13.247 14.546 -7.087 1.00 . A A . 5 ALA C 1 1 14 8356 1 1 5 ALA CA C 14.031 14.812 -8.371 1.00 . A A . 5 ALA CA 1 1 14 8357 1 1 5 ALA CB C 13.346 15.866 -9.227 1.00 . A A . 5 ALA CB 1 1 14 8358 1 1 5 ALA H H 13.434 12.943 -9.147 1.00 . A A . 5 ALA H 1 1 14 8359 1 1 5 ALA HA H 15.017 15.173 -8.111 1.00 . A A . 5 ALA HA 1 1 14 8360 1 1 5 ALA HB1 H 13.782 15.864 -10.215 1.00 . A A . 5 ALA HB1 1 1 14 8361 1 1 5 ALA HB2 H 12.292 15.643 -9.297 1.00 . A A . 5 ALA HB2 1 1 14 8362 1 1 5 ALA HB3 H 13.480 16.839 -8.777 1.00 . A A . 5 ALA HB3 1 1 14 8363 1 1 5 ALA N N 14.187 13.572 -9.113 1.00 . A A . 5 ALA N 1 1 14 8364 1 1 5 ALA O O 13.766 13.918 -6.163 1.00 . A A . 5 ALA O 1 1 14 8365 1 1 6 HIS C C 10.517 13.182 -6.111 1.00 . A A . 6 HIS C 1 1 14 8366 1 1 6 HIS CA C 11.105 14.579 -5.945 1.00 . A A . 6 HIS CA 1 1 14 8367 1 1 6 HIS CB C 9.988 15.619 -5.797 1.00 . A A . 6 HIS CB 1 1 14 8368 1 1 6 HIS CD2 C 8.129 16.073 -4.040 1.00 . A A . 6 HIS CD2 1 1 14 8369 1 1 6 HIS CE1 C 9.138 15.256 -2.279 1.00 . A A . 6 HIS CE1 1 1 14 8370 1 1 6 HIS CG C 9.341 15.624 -4.441 1.00 . A A . 6 HIS CG 1 1 14 8371 1 1 6 HIS H H 11.568 15.298 -7.883 1.00 . A A . 6 HIS H 1 1 14 8372 1 1 6 HIS HA H 11.717 14.593 -5.054 1.00 . A A . 6 HIS HA 1 1 14 8373 1 1 6 HIS HB2 H 10.397 16.603 -5.969 1.00 . A A . 6 HIS HB2 1 1 14 8374 1 1 6 HIS HB3 H 9.221 15.420 -6.531 1.00 . A A . 6 HIS HB3 1 1 14 8375 1 1 6 HIS HD1 H 10.855 14.725 -3.265 1.00 . A A . 6 HIS HD1 1 1 14 8376 1 1 6 HIS HD2 H 7.379 16.541 -4.663 1.00 . A A . 6 HIS HD2 1 1 14 8377 1 1 6 HIS HE1 H 9.347 14.950 -1.266 1.00 . A A . 6 HIS HE1 1 1 14 8378 1 1 6 HIS HE2 H 7.284 16.112 -2.114 1.00 . A A . 6 HIS HE2 1 1 14 8379 1 1 6 HIS N N 11.964 14.894 -7.078 1.00 . A A . 6 HIS N 1 1 14 8380 1 1 6 HIS ND1 N 9.949 15.120 -3.310 1.00 . A A . 6 HIS ND1 1 1 14 8381 1 1 6 HIS NE2 N 8.030 15.830 -2.695 1.00 . A A . 6 HIS NE2 1 1 14 8382 1 1 6 HIS O O 9.304 13.009 -6.255 1.00 . A A . 6 HIS O 1 1 14 8383 1 1 7 SER C C 10.571 10.204 -4.968 1.00 . A A . 7 SER C 1 1 14 8384 1 1 7 SER CA C 10.990 10.806 -6.302 1.00 . A A . 7 SER CA 1 1 14 8385 1 1 7 SER CB C 12.143 10.006 -6.913 1.00 . A A . 7 SER CB 1 1 14 8386 1 1 7 SER H H 12.349 12.401 -6.041 1.00 . A A . 7 SER H 1 1 14 8387 1 1 7 SER HA H 10.149 10.783 -6.979 1.00 . A A . 7 SER HA 1 1 14 8388 1 1 7 SER HB2 H 12.755 9.597 -6.122 1.00 . A A . 7 SER HB2 1 1 14 8389 1 1 7 SER HB3 H 11.744 9.202 -7.515 1.00 . A A . 7 SER HB3 1 1 14 8390 1 1 7 SER HG H 12.374 11.334 -8.341 1.00 . A A . 7 SER HG 1 1 14 8391 1 1 7 SER N N 11.394 12.192 -6.131 1.00 . A A . 7 SER N 1 1 14 8392 1 1 7 SER O O 11.311 9.431 -4.360 1.00 . A A . 7 SER O 1 1 14 8393 1 1 7 SER OG O 12.949 10.838 -7.735 1.00 . A A . 7 SER OG 1 1 14 8394 1 1 8 ALA C C 7.395 10.111 -3.191 1.00 . A A . 8 ALA C 1 1 14 8395 1 1 8 ALA CA C 8.914 10.153 -3.201 1.00 . A A . 8 ALA CA 1 1 14 8396 1 1 8 ALA CB C 9.420 11.049 -2.082 1.00 . A A . 8 ALA CB 1 1 14 8397 1 1 8 ALA H H 8.876 11.257 -5.000 1.00 . A A . 8 ALA H 1 1 14 8398 1 1 8 ALA HA H 9.295 9.156 -3.034 1.00 . A A . 8 ALA HA 1 1 14 8399 1 1 8 ALA HB1 H 9.767 11.985 -2.498 1.00 . A A . 8 ALA HB1 1 1 14 8400 1 1 8 ALA HB2 H 8.618 11.242 -1.385 1.00 . A A . 8 ALA HB2 1 1 14 8401 1 1 8 ALA HB3 H 10.233 10.559 -1.568 1.00 . A A . 8 ALA HB3 1 1 14 8402 1 1 8 ALA N N 9.410 10.615 -4.485 1.00 . A A . 8 ALA N 1 1 14 8403 1 1 8 ALA O O 6.742 10.845 -3.936 1.00 . A A . 8 ALA O 1 1 14 8404 1 1 9 ASP C C 4.698 8.807 -3.422 1.00 . A A . 9 ASP C 1 1 14 8405 1 1 9 ASP CA C 5.411 9.140 -2.122 1.00 . A A . 9 ASP CA 1 1 14 8406 1 1 9 ASP CB C 4.828 10.403 -1.499 1.00 . A A . 9 ASP CB 1 1 14 8407 1 1 9 ASP CG C 3.541 10.127 -0.749 1.00 . A A . 9 ASP CG 1 1 14 8408 1 1 9 ASP H H 7.447 8.759 -1.728 1.00 . A A . 9 ASP H 1 1 14 8409 1 1 9 ASP HA H 5.257 8.317 -1.441 1.00 . A A . 9 ASP HA 1 1 14 8410 1 1 9 ASP HB2 H 5.545 10.818 -0.808 1.00 . A A . 9 ASP HB2 1 1 14 8411 1 1 9 ASP HB3 H 4.631 11.119 -2.277 1.00 . A A . 9 ASP HB3 1 1 14 8412 1 1 9 ASP N N 6.852 9.279 -2.308 1.00 . A A . 9 ASP N 1 1 14 8413 1 1 9 ASP O O 3.548 9.186 -3.631 1.00 . A A . 9 ASP O 1 1 14 8414 1 1 9 ASP OD1 O 3.525 9.198 0.088 1.00 . A A . 9 ASP OD1 1 1 14 8415 1 1 9 ASP OD2 O 2.540 10.844 -0.983 1.00 . A A . 9 ASP OD2 1 1 14 8416 1 1 10 LEU C C 4.252 6.032 -5.132 1.00 . A A . 10 LEU C 1 1 14 8417 1 1 10 LEU CA C 4.720 7.444 -5.424 1.00 . A A . 10 LEU CA 1 1 14 8418 1 1 10 LEU CB C 5.698 7.464 -6.595 1.00 . A A . 10 LEU CB 1 1 14 8419 1 1 10 LEU CD1 C 7.707 8.813 -7.238 1.00 . A A . 10 LEU CD1 1 1 14 8420 1 1 10 LEU CD2 C 5.457 9.417 -8.143 1.00 . A A . 10 LEU CD2 1 1 14 8421 1 1 10 LEU CG C 6.217 8.854 -6.953 1.00 . A A . 10 LEU CG 1 1 14 8422 1 1 10 LEU H H 6.223 7.641 -3.948 1.00 . A A . 10 LEU H 1 1 14 8423 1 1 10 LEU HA H 3.862 8.057 -5.662 1.00 . A A . 10 LEU HA 1 1 14 8424 1 1 10 LEU HB2 H 6.541 6.837 -6.345 1.00 . A A . 10 LEU HB2 1 1 14 8425 1 1 10 LEU HB3 H 5.203 7.050 -7.462 1.00 . A A . 10 LEU HB3 1 1 14 8426 1 1 10 LEU HD11 H 7.911 9.349 -8.152 1.00 . A A . 10 LEU HD11 1 1 14 8427 1 1 10 LEU HD12 H 8.239 9.277 -6.421 1.00 . A A . 10 LEU HD12 1 1 14 8428 1 1 10 LEU HD13 H 8.027 7.788 -7.342 1.00 . A A . 10 LEU HD13 1 1 14 8429 1 1 10 LEU HD21 H 6.052 9.302 -9.038 1.00 . A A . 10 LEU HD21 1 1 14 8430 1 1 10 LEU HD22 H 4.525 8.885 -8.259 1.00 . A A . 10 LEU HD22 1 1 14 8431 1 1 10 LEU HD23 H 5.254 10.465 -7.977 1.00 . A A . 10 LEU HD23 1 1 14 8432 1 1 10 LEU HG H 6.059 9.511 -6.112 1.00 . A A . 10 LEU HG 1 1 14 8433 1 1 10 LEU N N 5.342 7.984 -4.227 1.00 . A A . 10 LEU N 1 1 14 8434 1 1 10 LEU O O 3.232 5.571 -5.647 1.00 . A A . 10 LEU O 1 1 14 8435 1 1 11 LYS C C 4.340 4.223 -2.203 1.00 . A A . 11 LYS C 1 1 14 8436 1 1 11 LYS CA C 4.592 4.121 -3.693 1.00 . A A . 11 LYS CA 1 1 14 8437 1 1 11 LYS CB C 5.703 3.119 -3.964 1.00 . A A . 11 LYS CB 1 1 14 8438 1 1 11 LYS CD C 4.148 1.217 -4.409 1.00 . A A . 11 LYS CD 1 1 14 8439 1 1 11 LYS CE C 4.637 0.063 -3.549 1.00 . A A . 11 LYS CE 1 1 14 8440 1 1 11 LYS CG C 5.298 2.051 -4.946 1.00 . A A . 11 LYS CG 1 1 14 8441 1 1 11 LYS H H 5.714 5.845 -3.806 1.00 . A A . 11 LYS H 1 1 14 8442 1 1 11 LYS HA H 3.688 3.799 -4.187 1.00 . A A . 11 LYS HA 1 1 14 8443 1 1 11 LYS HB2 H 6.559 3.644 -4.363 1.00 . A A . 11 LYS HB2 1 1 14 8444 1 1 11 LYS HB3 H 5.981 2.642 -3.035 1.00 . A A . 11 LYS HB3 1 1 14 8445 1 1 11 LYS HD2 H 3.512 1.853 -3.810 1.00 . A A . 11 LYS HD2 1 1 14 8446 1 1 11 LYS HD3 H 3.585 0.823 -5.242 1.00 . A A . 11 LYS HD3 1 1 14 8447 1 1 11 LYS HE2 H 4.162 -0.845 -3.888 1.00 . A A . 11 LYS HE2 1 1 14 8448 1 1 11 LYS HE3 H 5.708 -0.027 -3.668 1.00 . A A . 11 LYS HE3 1 1 14 8449 1 1 11 LYS HG2 H 4.986 2.527 -5.864 1.00 . A A . 11 LYS HG2 1 1 14 8450 1 1 11 LYS HG3 H 6.145 1.418 -5.134 1.00 . A A . 11 LYS HG3 1 1 14 8451 1 1 11 LYS HZ1 H 3.333 0.575 -1.987 1.00 . A A . 11 LYS HZ1 1 1 14 8452 1 1 11 LYS HZ2 H 4.952 0.982 -1.699 1.00 . A A . 11 LYS HZ2 1 1 14 8453 1 1 11 LYS HZ3 H 4.457 -0.629 -1.584 1.00 . A A . 11 LYS HZ3 1 1 14 8454 1 1 11 LYS N N 4.954 5.403 -4.204 1.00 . A A . 11 LYS N 1 1 14 8455 1 1 11 LYS NZ N 4.324 0.263 -2.107 1.00 . A A . 11 LYS NZ 1 1 14 8456 1 1 11 LYS O O 4.884 5.092 -1.521 1.00 . A A . 11 LYS O 1 1 14 8457 1 1 12 CYS C C 4.235 2.610 0.491 1.00 . A A . 12 CYS C 1 1 14 8458 1 1 12 CYS CA C 3.133 3.306 -0.323 1.00 . A A . 12 CYS CA 1 1 14 8459 1 1 12 CYS CB C 1.811 2.564 -0.191 1.00 . A A . 12 CYS CB 1 1 14 8460 1 1 12 CYS H H 3.071 2.729 -2.337 1.00 . A A . 12 CYS H 1 1 14 8461 1 1 12 CYS HA H 3.013 4.318 0.031 1.00 . A A . 12 CYS HA 1 1 14 8462 1 1 12 CYS HB2 H 1.723 2.171 0.810 1.00 . A A . 12 CYS HB2 1 1 14 8463 1 1 12 CYS HB3 H 0.999 3.255 -0.373 1.00 . A A . 12 CYS HB3 1 1 14 8464 1 1 12 CYS N N 3.492 3.352 -1.723 1.00 . A A . 12 CYS N 1 1 14 8465 1 1 12 CYS O O 5.212 2.110 -0.081 1.00 . A A . 12 CYS O 1 1 14 8466 1 1 12 CYS SG S 1.627 1.181 -1.354 1.00 . A A . 12 CYS SG 1 1 14 8467 1 1 13 PRO C C 5.383 0.548 2.483 1.00 . A A . 13 PRO C 1 1 14 8468 1 1 13 PRO CA C 5.139 2.038 2.725 1.00 . A A . 13 PRO CA 1 1 14 8469 1 1 13 PRO CB C 4.551 2.251 4.123 1.00 . A A . 13 PRO CB 1 1 14 8470 1 1 13 PRO CD C 3.047 3.279 2.593 1.00 . A A . 13 PRO CD 1 1 14 8471 1 1 13 PRO CG C 3.612 3.391 3.975 1.00 . A A . 13 PRO CG 1 1 14 8472 1 1 13 PRO HA H 6.076 2.569 2.646 1.00 . A A . 13 PRO HA 1 1 14 8473 1 1 13 PRO HB2 H 4.037 1.356 4.442 1.00 . A A . 13 PRO HB2 1 1 14 8474 1 1 13 PRO HB3 H 5.344 2.483 4.820 1.00 . A A . 13 PRO HB3 1 1 14 8475 1 1 13 PRO HD2 H 2.150 2.677 2.598 1.00 . A A . 13 PRO HD2 1 1 14 8476 1 1 13 PRO HD3 H 2.839 4.261 2.191 1.00 . A A . 13 PRO HD3 1 1 14 8477 1 1 13 PRO HG2 H 2.824 3.317 4.711 1.00 . A A . 13 PRO HG2 1 1 14 8478 1 1 13 PRO HG3 H 4.145 4.322 4.087 1.00 . A A . 13 PRO HG3 1 1 14 8479 1 1 13 PRO N N 4.123 2.618 1.832 1.00 . A A . 13 PRO N 1 1 14 8480 1 1 13 PRO O O 6.510 0.073 2.625 1.00 . A A . 13 PRO O 1 1 14 8481 1 1 14 THR C C 5.158 -2.036 0.782 1.00 . A A . 14 THR C 1 1 14 8482 1 1 14 THR CA C 4.404 -1.643 2.053 1.00 . A A . 14 THR CA 1 1 14 8483 1 1 14 THR CB C 3.002 -2.278 2.033 1.00 . A A . 14 THR CB 1 1 14 8484 1 1 14 THR CG2 C 3.080 -3.789 2.190 1.00 . A A . 14 THR CG2 1 1 14 8485 1 1 14 THR H H 3.436 0.231 2.175 1.00 . A A . 14 THR H 1 1 14 8486 1 1 14 THR HA H 4.936 -2.036 2.906 1.00 . A A . 14 THR HA 1 1 14 8487 1 1 14 THR HB H 2.534 -2.054 1.087 1.00 . A A . 14 THR HB 1 1 14 8488 1 1 14 THR HG1 H 1.409 -1.314 2.709 1.00 . A A . 14 THR HG1 1 1 14 8489 1 1 14 THR HG21 H 2.202 -4.142 2.708 1.00 . A A . 14 THR HG21 1 1 14 8490 1 1 14 THR HG22 H 3.962 -4.045 2.760 1.00 . A A . 14 THR HG22 1 1 14 8491 1 1 14 THR HG23 H 3.134 -4.250 1.215 1.00 . A A . 14 THR HG23 1 1 14 8492 1 1 14 THR N N 4.317 -0.195 2.211 1.00 . A A . 14 THR N 1 1 14 8493 1 1 14 THR O O 4.728 -1.729 -0.332 1.00 . A A . 14 THR O 1 1 14 8494 1 1 14 THR OG1 O 2.209 -1.725 3.088 1.00 . A A . 14 THR OG1 1 1 14 8495 1 1 15 PRO C C 6.482 -4.199 -1.044 1.00 . A A . 15 PRO C 1 1 14 8496 1 1 15 PRO CA C 7.153 -3.130 -0.185 1.00 . A A . 15 PRO CA 1 1 14 8497 1 1 15 PRO CB C 8.403 -3.706 0.491 1.00 . A A . 15 PRO CB 1 1 14 8498 1 1 15 PRO CD C 6.927 -3.045 2.229 1.00 . A A . 15 PRO CD 1 1 14 8499 1 1 15 PRO CG C 8.378 -3.155 1.870 1.00 . A A . 15 PRO CG 1 1 14 8500 1 1 15 PRO HA H 7.431 -2.290 -0.806 1.00 . A A . 15 PRO HA 1 1 14 8501 1 1 15 PRO HB2 H 8.351 -4.784 0.494 1.00 . A A . 15 PRO HB2 1 1 14 8502 1 1 15 PRO HB3 H 9.283 -3.386 -0.042 1.00 . A A . 15 PRO HB3 1 1 14 8503 1 1 15 PRO HD2 H 6.554 -3.988 2.603 1.00 . A A . 15 PRO HD2 1 1 14 8504 1 1 15 PRO HD3 H 6.771 -2.258 2.950 1.00 . A A . 15 PRO HD3 1 1 14 8505 1 1 15 PRO HG2 H 8.887 -3.828 2.542 1.00 . A A . 15 PRO HG2 1 1 14 8506 1 1 15 PRO HG3 H 8.843 -2.181 1.884 1.00 . A A . 15 PRO HG3 1 1 14 8507 1 1 15 PRO N N 6.312 -2.706 0.939 1.00 . A A . 15 PRO N 1 1 14 8508 1 1 15 PRO O O 6.740 -4.292 -2.244 1.00 . A A . 15 PRO O 1 1 14 8509 1 1 16 GLY C C 3.668 -5.618 -1.757 1.00 . A A . 16 GLY C 1 1 14 8510 1 1 16 GLY CA C 4.967 -6.083 -1.126 1.00 . A A . 16 GLY CA 1 1 14 8511 1 1 16 GLY H H 5.503 -4.912 0.547 1.00 . A A . 16 GLY H 1 1 14 8512 1 1 16 GLY HA2 H 5.618 -6.452 -1.898 1.00 . A A . 16 GLY HA2 1 1 14 8513 1 1 16 GLY HA3 H 4.752 -6.883 -0.435 1.00 . A A . 16 GLY HA3 1 1 14 8514 1 1 16 GLY N N 5.645 -5.017 -0.415 1.00 . A A . 16 GLY N 1 1 14 8515 1 1 16 GLY O O 2.919 -6.414 -2.330 1.00 . A A . 16 GLY O 1 1 14 8516 1 1 17 CYS C C 2.516 -3.013 -3.508 1.00 . A A . 17 CYS C 1 1 14 8517 1 1 17 CYS CA C 2.202 -3.732 -2.196 1.00 . A A . 17 CYS CA 1 1 14 8518 1 1 17 CYS CB C 1.624 -2.769 -1.165 1.00 . A A . 17 CYS CB 1 1 14 8519 1 1 17 CYS H H 4.052 -3.751 -1.189 1.00 . A A . 17 CYS H 1 1 14 8520 1 1 17 CYS HA H 1.491 -4.523 -2.385 1.00 . A A . 17 CYS HA 1 1 14 8521 1 1 17 CYS HB2 H 1.580 -3.271 -0.210 1.00 . A A . 17 CYS HB2 1 1 14 8522 1 1 17 CYS HB3 H 2.282 -1.916 -1.081 1.00 . A A . 17 CYS HB3 1 1 14 8523 1 1 17 CYS N N 3.405 -4.327 -1.650 1.00 . A A . 17 CYS N 1 1 14 8524 1 1 17 CYS O O 3.669 -2.978 -3.942 1.00 . A A . 17 CYS O 1 1 14 8525 1 1 17 CYS SG S -0.044 -2.139 -1.517 1.00 . A A . 17 CYS SG 1 1 14 8526 1 1 18 ASP C C 1.054 -0.381 -5.402 1.00 . A A . 18 ASP C 1 1 14 8527 1 1 18 ASP CA C 1.669 -1.780 -5.424 1.00 . A A . 18 ASP CA 1 1 14 8528 1 1 18 ASP CB C 1.068 -2.613 -6.564 1.00 . A A . 18 ASP CB 1 1 14 8529 1 1 18 ASP CG C -0.380 -2.274 -6.867 1.00 . A A . 18 ASP CG 1 1 14 8530 1 1 18 ASP H H 0.598 -2.523 -3.748 1.00 . A A . 18 ASP H 1 1 14 8531 1 1 18 ASP HA H 2.732 -1.682 -5.592 1.00 . A A . 18 ASP HA 1 1 14 8532 1 1 18 ASP HB2 H 1.647 -2.452 -7.462 1.00 . A A . 18 ASP HB2 1 1 14 8533 1 1 18 ASP HB3 H 1.121 -3.657 -6.294 1.00 . A A . 18 ASP HB3 1 1 14 8534 1 1 18 ASP N N 1.492 -2.460 -4.143 1.00 . A A . 18 ASP N 1 1 14 8535 1 1 18 ASP O O 1.419 0.476 -6.207 1.00 . A A . 18 ASP O 1 1 14 8536 1 1 18 ASP OD1 O -1.209 -2.255 -5.933 1.00 . A A . 18 ASP OD1 1 1 14 8537 1 1 18 ASP OD2 O -0.704 -2.050 -8.052 1.00 . A A . 18 ASP OD2 1 1 14 8538 1 1 19 GLY C C -1.809 1.306 -4.801 1.00 . A A . 19 GLY C 1 1 14 8539 1 1 19 GLY CA C -0.387 1.201 -4.277 1.00 . A A . 19 GLY CA 1 1 14 8540 1 1 19 GLY H H -0.015 -0.827 -3.774 1.00 . A A . 19 GLY H 1 1 14 8541 1 1 19 GLY HA2 H -0.385 1.460 -3.228 1.00 . A A . 19 GLY HA2 1 1 14 8542 1 1 19 GLY HA3 H 0.231 1.907 -4.809 1.00 . A A . 19 GLY HA3 1 1 14 8543 1 1 19 GLY N N 0.187 -0.127 -4.429 1.00 . A A . 19 GLY N 1 1 14 8544 1 1 19 GLY O O -2.453 2.346 -4.660 1.00 . A A . 19 GLY O 1 1 14 8545 1 1 20 SER C C -4.596 -0.597 -5.029 1.00 . A A . 20 SER C 1 1 14 8546 1 1 20 SER CA C -3.672 0.231 -5.913 1.00 . A A . 20 SER CA 1 1 14 8547 1 1 20 SER CB C -3.681 -0.306 -7.342 1.00 . A A . 20 SER CB 1 1 14 8548 1 1 20 SER H H -1.768 -0.582 -5.464 1.00 . A A . 20 SER H 1 1 14 8549 1 1 20 SER HA H -4.024 1.255 -5.921 1.00 . A A . 20 SER HA 1 1 14 8550 1 1 20 SER HB2 H -3.794 -1.381 -7.322 1.00 . A A . 20 SER HB2 1 1 14 8551 1 1 20 SER HB3 H -4.503 0.134 -7.886 1.00 . A A . 20 SER HB3 1 1 14 8552 1 1 20 SER HG H -1.857 -0.739 -7.932 1.00 . A A . 20 SER HG 1 1 14 8553 1 1 20 SER N N -2.316 0.233 -5.385 1.00 . A A . 20 SER N 1 1 14 8554 1 1 20 SER O O -4.163 -1.553 -4.381 1.00 . A A . 20 SER O 1 1 14 8555 1 1 20 SER OG O -2.469 0.013 -8.008 1.00 . A A . 20 SER OG 1 1 14 8556 1 1 21 GLY C C -6.809 -0.374 -2.711 1.00 . A A . 21 GLY C 1 1 14 8557 1 1 21 GLY CA C -6.819 -0.890 -4.134 1.00 . A A . 21 GLY CA 1 1 14 8558 1 1 21 GLY H H -6.138 0.599 -5.474 1.00 . A A . 21 GLY H 1 1 14 8559 1 1 21 GLY HA2 H -7.806 -0.759 -4.550 1.00 . A A . 21 GLY HA2 1 1 14 8560 1 1 21 GLY HA3 H -6.579 -1.942 -4.125 1.00 . A A . 21 GLY HA3 1 1 14 8561 1 1 21 GLY N N -5.859 -0.196 -4.968 1.00 . A A . 21 GLY N 1 1 14 8562 1 1 21 GLY O O -6.134 0.608 -2.413 1.00 . A A . 21 GLY O 1 1 14 8563 1 1 22 HIS C C -8.022 -1.895 0.396 1.00 . A A . 22 HIS C 1 1 14 8564 1 1 22 HIS CA C -7.611 -0.685 -0.421 1.00 . A A . 22 HIS CA 1 1 14 8565 1 1 22 HIS CB C -8.615 0.444 -0.148 1.00 . A A . 22 HIS CB 1 1 14 8566 1 1 22 HIS CD2 C -7.653 2.687 -1.056 1.00 . A A . 22 HIS CD2 1 1 14 8567 1 1 22 HIS CE1 C -7.416 3.712 0.864 1.00 . A A . 22 HIS CE1 1 1 14 8568 1 1 22 HIS CG C -8.039 1.827 -0.085 1.00 . A A . 22 HIS CG 1 1 14 8569 1 1 22 HIS H H -8.072 -1.812 -2.150 1.00 . A A . 22 HIS H 1 1 14 8570 1 1 22 HIS HA H -6.622 -0.369 -0.112 1.00 . A A . 22 HIS HA 1 1 14 8571 1 1 22 HIS HB2 H -9.358 0.442 -0.931 1.00 . A A . 22 HIS HB2 1 1 14 8572 1 1 22 HIS HB3 H -9.104 0.250 0.795 1.00 . A A . 22 HIS HB3 1 1 14 8573 1 1 22 HIS HD1 H -8.062 2.140 2.006 1.00 . A A . 22 HIS HD1 1 1 14 8574 1 1 22 HIS HD2 H -7.659 2.499 -2.120 1.00 . A A . 22 HIS HD2 1 1 14 8575 1 1 22 HIS HE1 H -7.204 4.463 1.610 1.00 . A A . 22 HIS HE1 1 1 14 8576 1 1 22 HIS HE2 H -7.107 4.715 -0.896 1.00 . A A . 22 HIS HE2 1 1 14 8577 1 1 22 HIS N N -7.550 -1.035 -1.838 1.00 . A A . 22 HIS N 1 1 14 8578 1 1 22 HIS ND1 N -7.874 2.501 1.106 1.00 . A A . 22 HIS ND1 1 1 14 8579 1 1 22 HIS NE2 N -7.271 3.853 -0.438 1.00 . A A . 22 HIS NE2 1 1 14 8580 1 1 22 HIS O O -8.605 -2.839 -0.133 1.00 . A A . 22 HIS O 1 1 14 8581 1 1 23 ILE C C -9.858 -2.647 2.786 1.00 . A A . 23 ILE C 1 1 14 8582 1 1 23 ILE CA C -8.346 -2.814 2.614 1.00 . A A . 23 ILE CA 1 1 14 8583 1 1 23 ILE CB C -7.608 -2.735 3.982 1.00 . A A . 23 ILE CB 1 1 14 8584 1 1 23 ILE CD1 C -7.769 -5.178 4.713 1.00 . A A . 23 ILE CD1 1 1 14 8585 1 1 23 ILE CG1 C -6.869 -4.047 4.264 1.00 . A A . 23 ILE CG1 1 1 14 8586 1 1 23 ILE CG2 C -8.552 -2.392 5.132 1.00 . A A . 23 ILE CG2 1 1 14 8587 1 1 23 ILE H H -7.474 -0.969 2.075 1.00 . A A . 23 ILE H 1 1 14 8588 1 1 23 ILE HA H -8.147 -3.781 2.172 1.00 . A A . 23 ILE HA 1 1 14 8589 1 1 23 ILE HB H -6.879 -1.941 3.914 1.00 . A A . 23 ILE HB 1 1 14 8590 1 1 23 ILE HD11 H -7.185 -5.910 5.250 1.00 . A A . 23 ILE HD11 1 1 14 8591 1 1 23 ILE HD12 H -8.540 -4.788 5.362 1.00 . A A . 23 ILE HD12 1 1 14 8592 1 1 23 ILE HD13 H -8.224 -5.642 3.851 1.00 . A A . 23 ILE HD13 1 1 14 8593 1 1 23 ILE HG12 H -6.363 -4.365 3.366 1.00 . A A . 23 ILE HG12 1 1 14 8594 1 1 23 ILE HG13 H -6.137 -3.877 5.041 1.00 . A A . 23 ILE HG13 1 1 14 8595 1 1 23 ILE HG21 H -9.209 -1.590 4.831 1.00 . A A . 23 ILE HG21 1 1 14 8596 1 1 23 ILE HG22 H -9.140 -3.262 5.387 1.00 . A A . 23 ILE HG22 1 1 14 8597 1 1 23 ILE HG23 H -7.975 -2.082 5.990 1.00 . A A . 23 ILE HG23 1 1 14 8598 1 1 23 ILE N N -7.855 -1.794 1.703 1.00 . A A . 23 ILE N 1 1 14 8599 1 1 23 ILE O O -10.590 -3.611 3.010 1.00 . A A . 23 ILE O 1 1 14 8600 1 1 24 THR C C -12.499 -1.416 1.490 1.00 . A A . 24 THR C 1 1 14 8601 1 1 24 THR CA C -11.724 -1.080 2.767 1.00 . A A . 24 THR CA 1 1 14 8602 1 1 24 THR CB C -11.910 0.416 3.116 1.00 . A A . 24 THR CB 1 1 14 8603 1 1 24 THR CG2 C -11.500 1.311 1.956 1.00 . A A . 24 THR CG2 1 1 14 8604 1 1 24 THR H H -9.673 -0.688 2.468 1.00 . A A . 24 THR H 1 1 14 8605 1 1 24 THR HA H -12.127 -1.663 3.578 1.00 . A A . 24 THR HA 1 1 14 8606 1 1 24 THR HB H -11.279 0.651 3.962 1.00 . A A . 24 THR HB 1 1 14 8607 1 1 24 THR HG1 H -13.495 0.178 4.281 1.00 . A A . 24 THR HG1 1 1 14 8608 1 1 24 THR HG21 H -10.424 1.332 1.881 1.00 . A A . 24 THR HG21 1 1 14 8609 1 1 24 THR HG22 H -11.869 2.312 2.124 1.00 . A A . 24 THR HG22 1 1 14 8610 1 1 24 THR HG23 H -11.917 0.924 1.037 1.00 . A A . 24 THR HG23 1 1 14 8611 1 1 24 THR N N -10.313 -1.408 2.639 1.00 . A A . 24 THR N 1 1 14 8612 1 1 24 THR O O -13.695 -1.709 1.542 1.00 . A A . 24 THR O 1 1 14 8613 1 1 24 THR OG1 O -13.274 0.676 3.472 1.00 . A A . 24 THR OG1 1 1 14 8614 1 1 25 GLY C C -13.480 -0.630 -1.301 1.00 . A A . 25 GLY C 1 1 14 8615 1 1 25 GLY CA C -12.465 -1.691 -0.916 1.00 . A A . 25 GLY CA 1 1 14 8616 1 1 25 GLY H H -10.856 -1.198 0.370 1.00 . A A . 25 GLY H 1 1 14 8617 1 1 25 GLY HA2 H -11.713 -1.755 -1.689 1.00 . A A . 25 GLY HA2 1 1 14 8618 1 1 25 GLY HA3 H -12.965 -2.645 -0.837 1.00 . A A . 25 GLY HA3 1 1 14 8619 1 1 25 GLY N N -11.814 -1.394 0.350 1.00 . A A . 25 GLY N 1 1 14 8620 1 1 25 GLY O O -14.538 -0.937 -1.846 1.00 . A A . 25 GLY O 1 1 14 8621 1 1 26 ASN C C -13.464 2.821 -2.023 1.00 . A A . 26 ASN C 1 1 14 8622 1 1 26 ASN CA C -14.105 1.725 -1.182 1.00 . A A . 26 ASN CA 1 1 14 8623 1 1 26 ASN CB C -14.564 2.315 0.155 1.00 . A A . 26 ASN CB 1 1 14 8624 1 1 26 ASN CG C -15.837 1.681 0.669 1.00 . A A . 26 ASN CG 1 1 14 8625 1 1 26 ASN H H -12.347 0.782 -0.476 1.00 . A A . 26 ASN H 1 1 14 8626 1 1 26 ASN HA H -14.966 1.341 -1.707 1.00 . A A . 26 ASN HA 1 1 14 8627 1 1 26 ASN HB2 H -13.788 2.162 0.891 1.00 . A A . 26 ASN HB2 1 1 14 8628 1 1 26 ASN HB3 H -14.736 3.373 0.040 1.00 . A A . 26 ASN HB3 1 1 14 8629 1 1 26 ASN HD21 H -14.913 1.115 2.333 1.00 . A A . 26 ASN HD21 1 1 14 8630 1 1 26 ASN HD22 H -16.587 0.696 2.209 1.00 . A A . 26 ASN HD22 1 1 14 8631 1 1 26 ASN N N -13.184 0.614 -0.949 1.00 . A A . 26 ASN N 1 1 14 8632 1 1 26 ASN ND2 N -15.772 1.105 1.853 1.00 . A A . 26 ASN ND2 1 1 14 8633 1 1 26 ASN O O -14.107 3.814 -2.356 1.00 . A A . 26 ASN O 1 1 14 8634 1 1 26 ASN OD1 O -16.876 1.721 0.010 1.00 . A A . 26 ASN OD1 1 1 14 8635 1 1 27 TYR C C -10.936 3.018 -4.405 1.00 . A A . 27 TYR C 1 1 14 8636 1 1 27 TYR CA C -11.455 3.636 -3.113 1.00 . A A . 27 TYR CA 1 1 14 8637 1 1 27 TYR CB C -10.277 4.161 -2.294 1.00 . A A . 27 TYR CB 1 1 14 8638 1 1 27 TYR CD1 C -11.161 4.297 0.070 1.00 . A A . 27 TYR CD1 1 1 14 8639 1 1 27 TYR CD2 C -10.494 6.320 -0.995 1.00 . A A . 27 TYR CD2 1 1 14 8640 1 1 27 TYR CE1 C -11.490 5.000 1.213 1.00 . A A . 27 TYR CE1 1 1 14 8641 1 1 27 TYR CE2 C -10.814 7.031 0.147 1.00 . A A . 27 TYR CE2 1 1 14 8642 1 1 27 TYR CG C -10.657 4.942 -1.053 1.00 . A A . 27 TYR CG 1 1 14 8643 1 1 27 TYR CZ C -11.316 6.367 1.247 1.00 . A A . 27 TYR CZ 1 1 14 8644 1 1 27 TYR H H -11.733 1.829 -2.067 1.00 . A A . 27 TYR H 1 1 14 8645 1 1 27 TYR HA H -12.123 4.451 -3.349 1.00 . A A . 27 TYR HA 1 1 14 8646 1 1 27 TYR HB2 H -9.675 3.324 -1.977 1.00 . A A . 27 TYR HB2 1 1 14 8647 1 1 27 TYR HB3 H -9.679 4.800 -2.919 1.00 . A A . 27 TYR HB3 1 1 14 8648 1 1 27 TYR HD1 H -11.299 3.224 0.042 1.00 . A A . 27 TYR HD1 1 1 14 8649 1 1 27 TYR HD2 H -10.102 6.839 -1.859 1.00 . A A . 27 TYR HD2 1 1 14 8650 1 1 27 TYR HE1 H -11.886 4.478 2.070 1.00 . A A . 27 TYR HE1 1 1 14 8651 1 1 27 TYR HE2 H -10.679 8.101 0.171 1.00 . A A . 27 TYR HE2 1 1 14 8652 1 1 27 TYR HH H -12.224 7.802 2.164 1.00 . A A . 27 TYR HH 1 1 14 8653 1 1 27 TYR N N -12.192 2.648 -2.345 1.00 . A A . 27 TYR N 1 1 14 8654 1 1 27 TYR O O -11.249 1.869 -4.718 1.00 . A A . 27 TYR O 1 1 14 8655 1 1 27 TYR OH O -11.627 7.069 2.390 1.00 . A A . 27 TYR OH 1 1 14 8656 1 1 28 ALA C C -7.966 2.866 -6.014 1.00 . A A . 28 ALA C 1 1 14 8657 1 1 28 ALA CA C -9.424 3.219 -6.286 1.00 . A A . 28 ALA CA 1 1 14 8658 1 1 28 ALA CB C -9.530 4.232 -7.417 1.00 . A A . 28 ALA CB 1 1 14 8659 1 1 28 ALA H H -9.771 4.609 -4.734 1.00 . A A . 28 ALA H 1 1 14 8660 1 1 28 ALA HA H -9.954 2.325 -6.584 1.00 . A A . 28 ALA HA 1 1 14 8661 1 1 28 ALA HB1 H -8.716 4.082 -8.111 1.00 . A A . 28 ALA HB1 1 1 14 8662 1 1 28 ALA HB2 H -10.471 4.102 -7.932 1.00 . A A . 28 ALA HB2 1 1 14 8663 1 1 28 ALA HB3 H -9.477 5.231 -7.010 1.00 . A A . 28 ALA HB3 1 1 14 8664 1 1 28 ALA N N -10.056 3.734 -5.085 1.00 . A A . 28 ALA N 1 1 14 8665 1 1 28 ALA O O -7.516 1.759 -6.315 1.00 . A A . 28 ALA O 1 1 14 8666 1 1 29 SER C C -5.492 4.252 -3.744 1.00 . A A . 29 SER C 1 1 14 8667 1 1 29 SER CA C -5.847 3.557 -5.054 1.00 . A A . 29 SER CA 1 1 14 8668 1 1 29 SER CB C -4.946 4.062 -6.183 1.00 . A A . 29 SER CB 1 1 14 8669 1 1 29 SER H H -7.673 4.631 -5.117 1.00 . A A . 29 SER H 1 1 14 8670 1 1 29 SER HA H -5.703 2.494 -4.936 1.00 . A A . 29 SER HA 1 1 14 8671 1 1 29 SER HB2 H -4.158 4.672 -5.766 1.00 . A A . 29 SER HB2 1 1 14 8672 1 1 29 SER HB3 H -4.512 3.219 -6.700 1.00 . A A . 29 SER HB3 1 1 14 8673 1 1 29 SER HG H -6.174 4.249 -7.710 1.00 . A A . 29 SER HG 1 1 14 8674 1 1 29 SER N N -7.246 3.785 -5.388 1.00 . A A . 29 SER N 1 1 14 8675 1 1 29 SER O O -6.325 4.939 -3.155 1.00 . A A . 29 SER O 1 1 14 8676 1 1 29 SER OG O -5.681 4.841 -7.115 1.00 . A A . 29 SER OG 1 1 14 8677 1 1 30 HIS C C -2.339 4.985 -2.088 1.00 . A A . 30 HIS C 1 1 14 8678 1 1 30 HIS CA C -3.823 4.633 -2.017 1.00 . A A . 30 HIS CA 1 1 14 8679 1 1 30 HIS CB C -4.074 3.652 -0.869 1.00 . A A . 30 HIS CB 1 1 14 8680 1 1 30 HIS CD2 C -2.065 2.071 -0.528 1.00 . A A . 30 HIS CD2 1 1 14 8681 1 1 30 HIS CE1 C -2.771 0.343 -1.623 1.00 . A A . 30 HIS CE1 1 1 14 8682 1 1 30 HIS CG C -3.297 2.382 -0.990 1.00 . A A . 30 HIS CG 1 1 14 8683 1 1 30 HIS H H -3.653 3.464 -3.771 1.00 . A A . 30 HIS H 1 1 14 8684 1 1 30 HIS HA H -4.392 5.535 -1.845 1.00 . A A . 30 HIS HA 1 1 14 8685 1 1 30 HIS HB2 H -3.793 4.123 0.058 1.00 . A A . 30 HIS HB2 1 1 14 8686 1 1 30 HIS HB3 H -5.123 3.402 -0.838 1.00 . A A . 30 HIS HB3 1 1 14 8687 1 1 30 HIS HD1 H -4.613 1.161 -2.121 1.00 . A A . 30 HIS HD1 1 1 14 8688 1 1 30 HIS HD2 H -1.429 2.702 0.074 1.00 . A A . 30 HIS HD2 1 1 14 8689 1 1 30 HIS HE1 H -2.824 -0.636 -2.076 1.00 . A A . 30 HIS HE1 1 1 14 8690 1 1 30 HIS N N -4.272 4.045 -3.272 1.00 . A A . 30 HIS N 1 1 14 8691 1 1 30 HIS ND1 N -3.736 1.268 -1.682 1.00 . A A . 30 HIS ND1 1 1 14 8692 1 1 30 HIS NE2 N -1.754 0.794 -0.939 1.00 . A A . 30 HIS NE2 1 1 14 8693 1 1 30 HIS O O -1.706 4.810 -3.131 1.00 . A A . 30 HIS O 1 1 14 8694 1 1 31 ARG C C 0.179 5.594 0.527 1.00 . A A . 31 ARG C 1 1 14 8695 1 1 31 ARG CA C -0.353 5.748 -0.898 1.00 . A A . 31 ARG CA 1 1 14 8696 1 1 31 ARG CB C -0.102 7.171 -1.402 1.00 . A A . 31 ARG CB 1 1 14 8697 1 1 31 ARG CD C 1.084 7.132 -3.614 1.00 . A A . 31 ARG CD 1 1 14 8698 1 1 31 ARG CG C 1.229 7.336 -2.116 1.00 . A A . 31 ARG CG 1 1 14 8699 1 1 31 ARG CZ C 0.067 8.527 -5.375 1.00 . A A . 31 ARG CZ 1 1 14 8700 1 1 31 ARG H H -2.328 5.525 -0.156 1.00 . A A . 31 ARG H 1 1 14 8701 1 1 31 ARG HA H 0.170 5.054 -1.538 1.00 . A A . 31 ARG HA 1 1 14 8702 1 1 31 ARG HB2 H -0.890 7.443 -2.089 1.00 . A A . 31 ARG HB2 1 1 14 8703 1 1 31 ARG HB3 H -0.122 7.847 -0.559 1.00 . A A . 31 ARG HB3 1 1 14 8704 1 1 31 ARG HD2 H 1.985 6.674 -3.992 1.00 . A A . 31 ARG HD2 1 1 14 8705 1 1 31 ARG HD3 H 0.245 6.478 -3.794 1.00 . A A . 31 ARG HD3 1 1 14 8706 1 1 31 ARG HE H 1.331 9.193 -3.973 1.00 . A A . 31 ARG HE 1 1 14 8707 1 1 31 ARG HG2 H 1.605 8.333 -1.933 1.00 . A A . 31 ARG HG2 1 1 14 8708 1 1 31 ARG HG3 H 1.928 6.610 -1.728 1.00 . A A . 31 ARG HG3 1 1 14 8709 1 1 31 ARG HH11 H -0.371 6.548 -5.508 1.00 . A A . 31 ARG HH11 1 1 14 8710 1 1 31 ARG HH12 H -1.153 7.566 -6.688 1.00 . A A . 31 ARG HH12 1 1 14 8711 1 1 31 ARG HH21 H 0.348 10.525 -5.522 1.00 . A A . 31 ARG HH21 1 1 14 8712 1 1 31 ARG HH22 H -0.710 9.838 -6.720 1.00 . A A . 31 ARG HH22 1 1 14 8713 1 1 31 ARG N N -1.776 5.428 -0.966 1.00 . A A . 31 ARG N 1 1 14 8714 1 1 31 ARG NE N 0.864 8.392 -4.321 1.00 . A A . 31 ARG NE 1 1 14 8715 1 1 31 ARG NH1 N -0.528 7.466 -5.902 1.00 . A A . 31 ARG NH1 1 1 14 8716 1 1 31 ARG NH2 N -0.114 9.726 -5.914 1.00 . A A . 31 ARG NH2 1 1 14 8717 1 1 31 ARG O O 1.310 5.982 0.826 1.00 . A A . 31 ARG O 1 1 14 8718 1 1 32 SER C C -0.652 3.398 3.231 1.00 . A A . 32 SER C 1 1 14 8719 1 1 32 SER CA C -0.232 4.794 2.780 1.00 . A A . 32 SER CA 1 1 14 8720 1 1 32 SER CB C -0.858 5.867 3.677 1.00 . A A . 32 SER CB 1 1 14 8721 1 1 32 SER H H -1.508 4.699 1.107 1.00 . A A . 32 SER H 1 1 14 8722 1 1 32 SER HA H 0.846 4.872 2.834 1.00 . A A . 32 SER HA 1 1 14 8723 1 1 32 SER HB2 H -1.542 5.400 4.371 1.00 . A A . 32 SER HB2 1 1 14 8724 1 1 32 SER HB3 H -0.080 6.373 4.226 1.00 . A A . 32 SER HB3 1 1 14 8725 1 1 32 SER HG H -1.172 7.702 3.042 1.00 . A A . 32 SER HG 1 1 14 8726 1 1 32 SER N N -0.629 5.010 1.399 1.00 . A A . 32 SER N 1 1 14 8727 1 1 32 SER O O -1.410 2.719 2.534 1.00 . A A . 32 SER O 1 1 14 8728 1 1 32 SER OG O -1.570 6.828 2.907 1.00 . A A . 32 SER OG 1 1 14 8729 1 1 33 LEU C C -1.899 1.568 5.448 1.00 . A A . 33 LEU C 1 1 14 8730 1 1 33 LEU CA C -0.478 1.654 4.917 1.00 . A A . 33 LEU CA 1 1 14 8731 1 1 33 LEU CB C 0.496 1.305 6.036 1.00 . A A . 33 LEU CB 1 1 14 8732 1 1 33 LEU CD1 C 2.747 0.357 6.532 1.00 . A A . 33 LEU CD1 1 1 14 8733 1 1 33 LEU CD2 C 0.865 -1.159 5.900 1.00 . A A . 33 LEU CD2 1 1 14 8734 1 1 33 LEU CG C 1.492 0.211 5.694 1.00 . A A . 33 LEU CG 1 1 14 8735 1 1 33 LEU H H 0.423 3.562 4.914 1.00 . A A . 33 LEU H 1 1 14 8736 1 1 33 LEU HA H -0.357 0.949 4.110 1.00 . A A . 33 LEU HA 1 1 14 8737 1 1 33 LEU HB2 H 1.047 2.197 6.298 1.00 . A A . 33 LEU HB2 1 1 14 8738 1 1 33 LEU HB3 H -0.074 0.987 6.895 1.00 . A A . 33 LEU HB3 1 1 14 8739 1 1 33 LEU HD11 H 3.272 1.255 6.240 1.00 . A A . 33 LEU HD11 1 1 14 8740 1 1 33 LEU HD12 H 2.478 0.421 7.576 1.00 . A A . 33 LEU HD12 1 1 14 8741 1 1 33 LEU HD13 H 3.385 -0.499 6.374 1.00 . A A . 33 LEU HD13 1 1 14 8742 1 1 33 LEU HD21 H -0.066 -1.214 5.357 1.00 . A A . 33 LEU HD21 1 1 14 8743 1 1 33 LEU HD22 H 1.538 -1.924 5.539 1.00 . A A . 33 LEU HD22 1 1 14 8744 1 1 33 LEU HD23 H 0.677 -1.312 6.953 1.00 . A A . 33 LEU HD23 1 1 14 8745 1 1 33 LEU HG H 1.770 0.307 4.655 1.00 . A A . 33 LEU HG 1 1 14 8746 1 1 33 LEU N N -0.187 2.982 4.404 1.00 . A A . 33 LEU N 1 1 14 8747 1 1 33 LEU O O -2.381 0.489 5.796 1.00 . A A . 33 LEU O 1 1 14 8748 1 1 34 SER C C -4.847 2.217 4.641 1.00 . A A . 34 SER C 1 1 14 8749 1 1 34 SER CA C -3.996 2.730 5.795 1.00 . A A . 34 SER CA 1 1 14 8750 1 1 34 SER CB C -4.385 4.164 6.135 1.00 . A A . 34 SER CB 1 1 14 8751 1 1 34 SER H H -2.172 3.510 5.088 1.00 . A A . 34 SER H 1 1 14 8752 1 1 34 SER HA H -4.141 2.101 6.661 1.00 . A A . 34 SER HA 1 1 14 8753 1 1 34 SER HB2 H -5.193 4.479 5.492 1.00 . A A . 34 SER HB2 1 1 14 8754 1 1 34 SER HB3 H -4.701 4.215 7.167 1.00 . A A . 34 SER HB3 1 1 14 8755 1 1 34 SER HG H -2.927 5.292 6.817 1.00 . A A . 34 SER HG 1 1 14 8756 1 1 34 SER N N -2.597 2.690 5.421 1.00 . A A . 34 SER N 1 1 14 8757 1 1 34 SER O O -6.040 1.939 4.795 1.00 . A A . 34 SER O 1 1 14 8758 1 1 34 SER OG O -3.280 5.037 5.949 1.00 . A A . 34 SER OG 1 1 14 8759 1 1 35 GLY C C -4.402 0.362 1.753 1.00 . A A . 35 GLY C 1 1 14 8760 1 1 35 GLY CA C -4.924 1.675 2.295 1.00 . A A . 35 GLY CA 1 1 14 8761 1 1 35 GLY H H -3.272 2.365 3.413 1.00 . A A . 35 GLY H 1 1 14 8762 1 1 35 GLY HA2 H -5.969 1.560 2.538 1.00 . A A . 35 GLY HA2 1 1 14 8763 1 1 35 GLY HA3 H -4.827 2.432 1.530 1.00 . A A . 35 GLY HA3 1 1 14 8764 1 1 35 GLY N N -4.222 2.115 3.473 1.00 . A A . 35 GLY N 1 1 14 8765 1 1 35 GLY O O -5.071 -0.266 0.939 1.00 . A A . 35 GLY O 1 1 14 8766 1 1 36 CYS C C -3.395 -2.473 1.947 1.00 . A A . 36 CYS C 1 1 14 8767 1 1 36 CYS CA C -2.545 -1.233 1.670 1.00 . A A . 36 CYS CA 1 1 14 8768 1 1 36 CYS CB C -1.175 -1.412 2.333 1.00 . A A . 36 CYS CB 1 1 14 8769 1 1 36 CYS H H -2.695 0.560 2.777 1.00 . A A . 36 CYS H 1 1 14 8770 1 1 36 CYS HA H -2.408 -1.134 0.604 1.00 . A A . 36 CYS HA 1 1 14 8771 1 1 36 CYS HB2 H -1.282 -1.270 3.401 1.00 . A A . 36 CYS HB2 1 1 14 8772 1 1 36 CYS HB3 H -0.820 -2.416 2.141 1.00 . A A . 36 CYS HB3 1 1 14 8773 1 1 36 CYS N N -3.188 -0.014 2.157 1.00 . A A . 36 CYS N 1 1 14 8774 1 1 36 CYS O O -3.481 -2.934 3.088 1.00 . A A . 36 CYS O 1 1 14 8775 1 1 36 CYS SG S 0.109 -0.258 1.753 1.00 . A A . 36 CYS SG 1 1 14 8776 1 1 37 PRO C C -3.755 -5.510 1.215 1.00 . A A . 37 PRO C 1 1 14 8777 1 1 37 PRO CA C -4.706 -4.333 1.020 1.00 . A A . 37 PRO CA 1 1 14 8778 1 1 37 PRO CB C -5.439 -4.445 -0.316 1.00 . A A . 37 PRO CB 1 1 14 8779 1 1 37 PRO CD C -3.906 -2.612 -0.504 1.00 . A A . 37 PRO CD 1 1 14 8780 1 1 37 PRO CG C -4.569 -3.717 -1.283 1.00 . A A . 37 PRO CG 1 1 14 8781 1 1 37 PRO HA H -5.419 -4.302 1.831 1.00 . A A . 37 PRO HA 1 1 14 8782 1 1 37 PRO HB2 H -5.547 -5.485 -0.583 1.00 . A A . 37 PRO HB2 1 1 14 8783 1 1 37 PRO HB3 H -6.410 -3.983 -0.237 1.00 . A A . 37 PRO HB3 1 1 14 8784 1 1 37 PRO HD2 H -2.883 -2.479 -0.818 1.00 . A A . 37 PRO HD2 1 1 14 8785 1 1 37 PRO HD3 H -4.457 -1.691 -0.625 1.00 . A A . 37 PRO HD3 1 1 14 8786 1 1 37 PRO HG2 H -3.826 -4.390 -1.684 1.00 . A A . 37 PRO HG2 1 1 14 8787 1 1 37 PRO HG3 H -5.173 -3.304 -2.081 1.00 . A A . 37 PRO HG3 1 1 14 8788 1 1 37 PRO N N -3.970 -3.077 0.895 1.00 . A A . 37 PRO N 1 1 14 8789 1 1 37 PRO O O -4.173 -6.629 1.518 1.00 . A A . 37 PRO O 1 1 14 8790 1 1 38 ARG C C -0.593 -5.831 2.522 1.00 . A A . 38 ARG C 1 1 14 8791 1 1 38 ARG CA C -1.418 -6.213 1.306 1.00 . A A . 38 ARG CA 1 1 14 8792 1 1 38 ARG CB C -0.507 -6.304 0.087 1.00 . A A . 38 ARG CB 1 1 14 8793 1 1 38 ARG CD C -0.921 -6.212 -2.368 1.00 . A A . 38 ARG CD 1 1 14 8794 1 1 38 ARG CG C -1.147 -6.995 -1.094 1.00 . A A . 38 ARG CG 1 1 14 8795 1 1 38 ARG CZ C -2.397 -5.072 -3.970 1.00 . A A . 38 ARG CZ 1 1 14 8796 1 1 38 ARG H H -2.202 -4.295 0.905 1.00 . A A . 38 ARG H 1 1 14 8797 1 1 38 ARG HA H -1.888 -7.169 1.472 1.00 . A A . 38 ARG HA 1 1 14 8798 1 1 38 ARG HB2 H -0.227 -5.305 -0.217 1.00 . A A . 38 ARG HB2 1 1 14 8799 1 1 38 ARG HB3 H 0.386 -6.851 0.358 1.00 . A A . 38 ARG HB3 1 1 14 8800 1 1 38 ARG HD2 H -0.561 -5.226 -2.114 1.00 . A A . 38 ARG HD2 1 1 14 8801 1 1 38 ARG HD3 H -0.179 -6.723 -2.963 1.00 . A A . 38 ARG HD3 1 1 14 8802 1 1 38 ARG HE H -2.811 -6.816 -3.066 1.00 . A A . 38 ARG HE 1 1 14 8803 1 1 38 ARG HG2 H -0.716 -7.979 -1.203 1.00 . A A . 38 ARG HG2 1 1 14 8804 1 1 38 ARG HG3 H -2.209 -7.079 -0.918 1.00 . A A . 38 ARG HG3 1 1 14 8805 1 1 38 ARG HH11 H -0.726 -4.049 -3.470 1.00 . A A . 38 ARG HH11 1 1 14 8806 1 1 38 ARG HH12 H -1.719 -3.293 -4.684 1.00 . A A . 38 ARG HH12 1 1 14 8807 1 1 38 ARG HH21 H -4.167 -5.818 -4.622 1.00 . A A . 38 ARG HH21 1 1 14 8808 1 1 38 ARG HH22 H -3.692 -4.305 -5.333 1.00 . A A . 38 ARG HH22 1 1 14 8809 1 1 38 ARG N N -2.462 -5.224 1.091 1.00 . A A . 38 ARG N 1 1 14 8810 1 1 38 ARG NE N -2.146 -6.085 -3.148 1.00 . A A . 38 ARG NE 1 1 14 8811 1 1 38 ARG NH1 N -1.550 -4.056 -4.042 1.00 . A A . 38 ARG NH1 1 1 14 8812 1 1 38 ARG NH2 N -3.508 -5.062 -4.694 1.00 . A A . 38 ARG NH2 1 1 14 8813 1 1 38 ARG O O 0.621 -6.036 2.545 1.00 . A A . 38 ARG O 1 1 14 8814 1 1 39 ALA C C 0.331 -5.681 5.301 1.00 . A A . 39 ALA C 1 1 14 8815 1 1 39 ALA CA C -0.596 -4.650 4.667 1.00 . A A . 39 ALA CA 1 1 14 8816 1 1 39 ALA CB C -1.637 -4.189 5.675 1.00 . A A . 39 ALA CB 1 1 14 8817 1 1 39 ALA H H -2.199 -4.973 3.335 1.00 . A A . 39 ALA H 1 1 14 8818 1 1 39 ALA HA H -0.012 -3.791 4.376 1.00 . A A . 39 ALA HA 1 1 14 8819 1 1 39 ALA HB1 H -1.163 -4.023 6.631 1.00 . A A . 39 ALA HB1 1 1 14 8820 1 1 39 ALA HB2 H -2.088 -3.268 5.333 1.00 . A A . 39 ALA HB2 1 1 14 8821 1 1 39 ALA HB3 H -2.399 -4.946 5.777 1.00 . A A . 39 ALA HB3 1 1 14 8822 1 1 39 ALA N N -1.251 -5.173 3.475 1.00 . A A . 39 ALA N 1 1 14 8823 1 1 39 ALA O O 0.020 -6.876 5.340 1.00 . A A . 39 ALA O 1 1 14 8824 1 1 40 LYS C C 1.987 -6.782 7.554 1.00 . A A . 40 LYS C 1 1 14 8825 1 1 40 LYS CA C 2.516 -6.072 6.316 1.00 . A A . 40 LYS CA 1 1 14 8826 1 1 40 LYS CB C 3.752 -5.249 6.677 1.00 . A A . 40 LYS CB 1 1 14 8827 1 1 40 LYS CD C 4.464 -2.937 5.998 1.00 . A A . 40 LYS CD 1 1 14 8828 1 1 40 LYS CE C 5.657 -2.821 6.928 1.00 . A A . 40 LYS CE 1 1 14 8829 1 1 40 LYS CG C 4.251 -4.371 5.541 1.00 . A A . 40 LYS CG 1 1 14 8830 1 1 40 LYS H H 1.687 -4.257 5.622 1.00 . A A . 40 LYS H 1 1 14 8831 1 1 40 LYS HA H 2.788 -6.811 5.576 1.00 . A A . 40 LYS HA 1 1 14 8832 1 1 40 LYS HB2 H 3.514 -4.613 7.517 1.00 . A A . 40 LYS HB2 1 1 14 8833 1 1 40 LYS HB3 H 4.549 -5.921 6.960 1.00 . A A . 40 LYS HB3 1 1 14 8834 1 1 40 LYS HD2 H 4.633 -2.314 5.133 1.00 . A A . 40 LYS HD2 1 1 14 8835 1 1 40 LYS HD3 H 3.579 -2.602 6.519 1.00 . A A . 40 LYS HD3 1 1 14 8836 1 1 40 LYS HE2 H 5.954 -3.813 7.236 1.00 . A A . 40 LYS HE2 1 1 14 8837 1 1 40 LYS HE3 H 6.469 -2.353 6.394 1.00 . A A . 40 LYS HE3 1 1 14 8838 1 1 40 LYS HG2 H 5.189 -4.766 5.181 1.00 . A A . 40 LYS HG2 1 1 14 8839 1 1 40 LYS HG3 H 3.522 -4.383 4.744 1.00 . A A . 40 LYS HG3 1 1 14 8840 1 1 40 LYS HZ1 H 5.438 -0.998 7.925 1.00 . A A . 40 LYS HZ1 1 1 14 8841 1 1 40 LYS HZ2 H 5.996 -2.259 8.909 1.00 . A A . 40 LYS HZ2 1 1 14 8842 1 1 40 LYS HZ3 H 4.363 -2.202 8.450 1.00 . A A . 40 LYS HZ3 1 1 14 8843 1 1 40 LYS N N 1.494 -5.211 5.735 1.00 . A A . 40 LYS N 1 1 14 8844 1 1 40 LYS NZ N 5.341 -2.015 8.134 1.00 . A A . 40 LYS NZ 1 1 14 8845 1 1 40 LYS O O 1.886 -6.187 8.627 1.00 . A A . 40 LYS O 1 1 14 8846 1 1 41 LYS C C 2.195 -9.768 9.038 1.00 . A A . 41 LYS C 1 1 14 8847 1 1 41 LYS CA C 1.116 -8.838 8.501 1.00 . A A . 41 LYS CA 1 1 14 8848 1 1 41 LYS CB C -0.103 -9.644 8.047 1.00 . A A . 41 LYS CB 1 1 14 8849 1 1 41 LYS CD C -2.103 -8.301 7.342 1.00 . A A . 41 LYS CD 1 1 14 8850 1 1 41 LYS CE C -2.760 -7.017 7.820 1.00 . A A . 41 LYS CE 1 1 14 8851 1 1 41 LYS CG C -1.428 -9.040 8.482 1.00 . A A . 41 LYS CG 1 1 14 8852 1 1 41 LYS H H 1.747 -8.468 6.520 1.00 . A A . 41 LYS H 1 1 14 8853 1 1 41 LYS HA H 0.818 -8.158 9.285 1.00 . A A . 41 LYS HA 1 1 14 8854 1 1 41 LYS HB2 H -0.097 -9.707 6.968 1.00 . A A . 41 LYS HB2 1 1 14 8855 1 1 41 LYS HB3 H -0.034 -10.640 8.457 1.00 . A A . 41 LYS HB3 1 1 14 8856 1 1 41 LYS HD2 H -1.359 -8.059 6.595 1.00 . A A . 41 LYS HD2 1 1 14 8857 1 1 41 LYS HD3 H -2.856 -8.941 6.907 1.00 . A A . 41 LYS HD3 1 1 14 8858 1 1 41 LYS HE2 H -2.704 -6.976 8.897 1.00 . A A . 41 LYS HE2 1 1 14 8859 1 1 41 LYS HE3 H -2.225 -6.178 7.401 1.00 . A A . 41 LYS HE3 1 1 14 8860 1 1 41 LYS HG2 H -2.080 -9.832 8.818 1.00 . A A . 41 LYS HG2 1 1 14 8861 1 1 41 LYS HG3 H -1.252 -8.348 9.291 1.00 . A A . 41 LYS HG3 1 1 14 8862 1 1 41 LYS HZ1 H -4.758 -7.604 7.967 1.00 . A A . 41 LYS HZ1 1 1 14 8863 1 1 41 LYS HZ2 H -4.282 -7.176 6.395 1.00 . A A . 41 LYS HZ2 1 1 14 8864 1 1 41 LYS HZ3 H -4.548 -5.970 7.561 1.00 . A A . 41 LYS HZ3 1 1 14 8865 1 1 41 LYS N N 1.639 -8.050 7.399 1.00 . A A . 41 LYS N 1 1 14 8866 1 1 41 LYS NZ N -4.184 -6.937 7.405 1.00 . A A . 41 LYS NZ 1 1 14 8867 1 1 41 LYS O O 2.910 -9.425 9.981 1.00 . A A . 41 LYS O 1 1 14 8868 1 1 42 SER C C 4.760 -11.369 8.264 1.00 . A A . 42 SER C 1 1 14 8869 1 1 42 SER CA C 3.402 -11.855 8.761 1.00 . A A . 42 SER CA 1 1 14 8870 1 1 42 SER CB C 3.085 -13.233 8.185 1.00 . A A . 42 SER CB 1 1 14 8871 1 1 42 SER H H 1.798 -11.107 7.607 1.00 . A A . 42 SER H 1 1 14 8872 1 1 42 SER HA H 3.424 -11.918 9.839 1.00 . A A . 42 SER HA 1 1 14 8873 1 1 42 SER HB2 H 3.961 -13.628 7.689 1.00 . A A . 42 SER HB2 1 1 14 8874 1 1 42 SER HB3 H 2.794 -13.898 8.985 1.00 . A A . 42 SER HB3 1 1 14 8875 1 1 42 SER HG H 1.175 -13.302 7.703 1.00 . A A . 42 SER HG 1 1 14 8876 1 1 42 SER N N 2.364 -10.909 8.384 1.00 . A A . 42 SER N 1 1 14 8877 1 1 42 SER O O 5.765 -11.458 8.969 1.00 . A A . 42 SER O 1 1 14 8878 1 1 42 SER OG O 2.023 -13.152 7.245 1.00 . A A . 42 SER OG 1 1 14 8879 1 1 43 GLY C C 5.710 -8.798 5.994 1.00 . A A . 43 GLY C 1 1 14 8880 1 1 43 GLY CA C 5.959 -10.187 6.535 1.00 . A A . 43 GLY CA 1 1 14 8881 1 1 43 GLY H H 3.906 -10.646 6.611 1.00 . A A . 43 GLY H 1 1 14 8882 1 1 43 GLY HA2 H 6.714 -10.136 7.309 1.00 . A A . 43 GLY HA2 1 1 14 8883 1 1 43 GLY HA3 H 6.317 -10.816 5.734 1.00 . A A . 43 GLY HA3 1 1 14 8884 1 1 43 GLY N N 4.754 -10.764 7.084 1.00 . A A . 43 GLY N 1 1 14 8885 1 1 43 GLY O O 4.578 -8.320 6.018 1.00 . A A . 43 GLY O 1 1 14 8886 1 1 44 LEU C C 6.704 -6.930 3.355 1.00 . A A . 44 LEU C 1 1 14 8887 1 1 44 LEU CA C 6.629 -6.848 4.875 1.00 . A A . 44 LEU CA 1 1 14 8888 1 1 44 LEU CB C 7.729 -5.928 5.410 1.00 . A A . 44 LEU CB 1 1 14 8889 1 1 44 LEU CD1 C 10.166 -5.847 4.814 1.00 . A A . 44 LEU CD1 1 1 14 8890 1 1 44 LEU CD2 C 9.460 -6.620 7.088 1.00 . A A . 44 LEU CD2 1 1 14 8891 1 1 44 LEU CG C 9.099 -6.585 5.609 1.00 . A A . 44 LEU CG 1 1 14 8892 1 1 44 LEU H H 7.614 -8.640 5.421 1.00 . A A . 44 LEU H 1 1 14 8893 1 1 44 LEU HA H 5.667 -6.448 5.156 1.00 . A A . 44 LEU HA 1 1 14 8894 1 1 44 LEU HB2 H 7.845 -5.106 4.722 1.00 . A A . 44 LEU HB2 1 1 14 8895 1 1 44 LEU HB3 H 7.404 -5.535 6.362 1.00 . A A . 44 LEU HB3 1 1 14 8896 1 1 44 LEU HD11 H 11.084 -5.820 5.382 1.00 . A A . 44 LEU HD11 1 1 14 8897 1 1 44 LEU HD12 H 10.338 -6.361 3.878 1.00 . A A . 44 LEU HD12 1 1 14 8898 1 1 44 LEU HD13 H 9.835 -4.839 4.616 1.00 . A A . 44 LEU HD13 1 1 14 8899 1 1 44 LEU HD21 H 9.805 -5.645 7.398 1.00 . A A . 44 LEU HD21 1 1 14 8900 1 1 44 LEU HD22 H 8.589 -6.893 7.663 1.00 . A A . 44 LEU HD22 1 1 14 8901 1 1 44 LEU HD23 H 10.243 -7.346 7.251 1.00 . A A . 44 LEU HD23 1 1 14 8902 1 1 44 LEU HG H 9.060 -7.603 5.250 1.00 . A A . 44 LEU HG 1 1 14 8903 1 1 44 LEU N N 6.749 -8.176 5.460 1.00 . A A . 44 LEU N 1 1 14 8904 1 1 44 LEU O O 6.060 -6.161 2.643 1.00 . A A . 44 LEU O 1 1 14 8905 1 1 45 ARG C C 6.728 -9.353 1.054 1.00 . A A . 45 ARG C 1 1 14 8906 1 1 45 ARG CA C 7.569 -8.146 1.440 1.00 . A A . 45 ARG CA 1 1 14 8907 1 1 45 ARG CB C 9.033 -8.373 1.050 1.00 . A A . 45 ARG CB 1 1 14 8908 1 1 45 ARG CD C 10.677 -6.482 1.072 1.00 . A A . 45 ARG CD 1 1 14 8909 1 1 45 ARG CG C 9.637 -7.228 0.257 1.00 . A A . 45 ARG CG 1 1 14 8910 1 1 45 ARG CZ C 12.933 -5.640 0.550 1.00 . A A . 45 ARG CZ 1 1 14 8911 1 1 45 ARG H H 7.905 -8.519 3.495 1.00 . A A . 45 ARG H 1 1 14 8912 1 1 45 ARG HA H 7.195 -7.276 0.922 1.00 . A A . 45 ARG HA 1 1 14 8913 1 1 45 ARG HB2 H 9.616 -8.508 1.950 1.00 . A A . 45 ARG HB2 1 1 14 8914 1 1 45 ARG HB3 H 9.097 -9.270 0.453 1.00 . A A . 45 ARG HB3 1 1 14 8915 1 1 45 ARG HD2 H 10.176 -5.758 1.696 1.00 . A A . 45 ARG HD2 1 1 14 8916 1 1 45 ARG HD3 H 11.199 -7.193 1.696 1.00 . A A . 45 ARG HD3 1 1 14 8917 1 1 45 ARG HE H 11.325 -5.401 -0.618 1.00 . A A . 45 ARG HE 1 1 14 8918 1 1 45 ARG HG2 H 10.104 -7.624 -0.632 1.00 . A A . 45 ARG HG2 1 1 14 8919 1 1 45 ARG HG3 H 8.850 -6.543 -0.021 1.00 . A A . 45 ARG HG3 1 1 14 8920 1 1 45 ARG HH11 H 12.811 -6.692 2.288 1.00 . A A . 45 ARG HH11 1 1 14 8921 1 1 45 ARG HH12 H 14.374 -6.015 1.924 1.00 . A A . 45 ARG HH12 1 1 14 8922 1 1 45 ARG HH21 H 13.399 -4.589 -1.121 1.00 . A A . 45 ARG HH21 1 1 14 8923 1 1 45 ARG HH22 H 14.724 -4.887 -0.034 1.00 . A A . 45 ARG HH22 1 1 14 8924 1 1 45 ARG N N 7.454 -7.905 2.869 1.00 . A A . 45 ARG N 1 1 14 8925 1 1 45 ARG NE N 11.650 -5.789 0.231 1.00 . A A . 45 ARG NE 1 1 14 8926 1 1 45 ARG NH1 N 13.412 -6.164 1.671 1.00 . A A . 45 ARG NH1 1 1 14 8927 1 1 45 ARG NH2 N 13.748 -4.982 -0.264 1.00 . A A . 45 ARG NH2 1 1 14 8928 1 1 45 ARG O O 7.254 -10.385 0.631 1.00 . A A . 45 ARG O 1 1 14 8929 1 1 46 VAL C C 3.581 -9.947 -0.189 1.00 . A A . 46 VAL C 1 1 14 8930 1 1 46 VAL CA C 4.517 -10.336 0.946 1.00 . A A . 46 VAL CA 1 1 14 8931 1 1 46 VAL CB C 3.692 -10.779 2.180 1.00 . A A . 46 VAL CB 1 1 14 8932 1 1 46 VAL CG1 C 4.362 -11.956 2.872 1.00 . A A . 46 VAL CG1 1 1 14 8933 1 1 46 VAL CG2 C 3.500 -9.625 3.156 1.00 . A A . 46 VAL CG2 1 1 14 8934 1 1 46 VAL H H 5.060 -8.402 1.611 1.00 . A A . 46 VAL H 1 1 14 8935 1 1 46 VAL HA H 5.117 -11.176 0.622 1.00 . A A . 46 VAL HA 1 1 14 8936 1 1 46 VAL HB H 2.719 -11.101 1.840 1.00 . A A . 46 VAL HB 1 1 14 8937 1 1 46 VAL HG11 H 3.888 -12.129 3.827 1.00 . A A . 46 VAL HG11 1 1 14 8938 1 1 46 VAL HG12 H 4.265 -12.838 2.257 1.00 . A A . 46 VAL HG12 1 1 14 8939 1 1 46 VAL HG13 H 5.408 -11.736 3.025 1.00 . A A . 46 VAL HG13 1 1 14 8940 1 1 46 VAL HG21 H 2.520 -9.692 3.606 1.00 . A A . 46 VAL HG21 1 1 14 8941 1 1 46 VAL HG22 H 4.255 -9.676 3.926 1.00 . A A . 46 VAL HG22 1 1 14 8942 1 1 46 VAL HG23 H 3.588 -8.688 2.625 1.00 . A A . 46 VAL HG23 1 1 14 8943 1 1 46 VAL N N 5.425 -9.243 1.252 1.00 . A A . 46 VAL N 1 1 14 8944 1 1 46 VAL O O 2.434 -9.539 0.086 1.00 . A A . 46 VAL O 1 1 14 8945 1 1 46 VAL OXT O 4.005 -10.037 -1.361 1.00 . A A . 46 VAL OXT 1 1 14 8946 2 2 1 ZN ZN ZN -0.093 -0.086 -0.526 1.00 . B A . 47 ZN ZN 1 1 15 8947 1 1 1 GLY C C -2.206 9.869 6.377 1.00 . A A . 1 GLY C 1 1 15 8948 1 1 1 GLY CA C -2.954 9.884 7.692 1.00 . A A . 1 GLY CA 1 1 15 8949 1 1 1 GLY H1 H -2.928 10.951 9.481 1.00 . A A . 1 GLY H1 1 1 15 8950 1 1 1 GLY H2 H -3.208 11.908 8.114 1.00 . A A . 1 GLY H2 1 1 15 8951 1 1 1 GLY H3 H -1.646 11.328 8.435 1.00 . A A . 1 GLY H3 1 1 15 8952 1 1 1 GLY HA2 H -2.669 9.014 8.267 1.00 . A A . 1 GLY HA2 1 1 15 8953 1 1 1 GLY HA3 H -4.015 9.840 7.492 1.00 . A A . 1 GLY HA3 1 1 15 8954 1 1 1 GLY N N -2.664 11.100 8.486 1.00 . A A . 1 GLY N 1 1 15 8955 1 1 1 GLY O O -1.120 9.298 6.277 1.00 . A A . 1 GLY O 1 1 15 8956 1 1 2 SER C C -1.892 11.966 3.617 1.00 . A A . 2 SER C 1 1 15 8957 1 1 2 SER CA C -2.179 10.529 4.044 1.00 . A A . 2 SER CA 1 1 15 8958 1 1 2 SER CB C -3.107 9.846 3.043 1.00 . A A . 2 SER CB 1 1 15 8959 1 1 2 SER H H -3.657 10.928 5.498 1.00 . A A . 2 SER H 1 1 15 8960 1 1 2 SER HA H -1.249 9.984 4.091 1.00 . A A . 2 SER HA 1 1 15 8961 1 1 2 SER HB2 H -3.928 10.506 2.805 1.00 . A A . 2 SER HB2 1 1 15 8962 1 1 2 SER HB3 H -2.555 9.618 2.144 1.00 . A A . 2 SER HB3 1 1 15 8963 1 1 2 SER HG H -4.232 8.846 4.316 1.00 . A A . 2 SER HG 1 1 15 8964 1 1 2 SER N N -2.785 10.494 5.363 1.00 . A A . 2 SER N 1 1 15 8965 1 1 2 SER O O -2.799 12.704 3.227 1.00 . A A . 2 SER O 1 1 15 8966 1 1 2 SER OG O -3.627 8.636 3.583 1.00 . A A . 2 SER OG 1 1 15 8967 1 1 3 MET C C 0.002 13.796 1.796 1.00 . A A . 3 MET C 1 1 15 8968 1 1 3 MET CA C -0.206 13.698 3.302 1.00 . A A . 3 MET CA 1 1 15 8969 1 1 3 MET CB C 1.083 14.079 4.028 1.00 . A A . 3 MET CB 1 1 15 8970 1 1 3 MET CE C 3.544 14.215 5.775 1.00 . A A . 3 MET CE 1 1 15 8971 1 1 3 MET CG C 0.853 14.765 5.363 1.00 . A A . 3 MET CG 1 1 15 8972 1 1 3 MET H H 0.060 11.700 3.963 1.00 . A A . 3 MET H 1 1 15 8973 1 1 3 MET HA H -0.990 14.381 3.594 1.00 . A A . 3 MET HA 1 1 15 8974 1 1 3 MET HB2 H 1.665 13.187 4.198 1.00 . A A . 3 MET HB2 1 1 15 8975 1 1 3 MET HB3 H 1.647 14.751 3.398 1.00 . A A . 3 MET HB3 1 1 15 8976 1 1 3 MET HE1 H 3.508 13.519 4.951 1.00 . A A . 3 MET HE1 1 1 15 8977 1 1 3 MET HE2 H 3.726 15.211 5.398 1.00 . A A . 3 MET HE2 1 1 15 8978 1 1 3 MET HE3 H 4.341 13.933 6.449 1.00 . A A . 3 MET HE3 1 1 15 8979 1 1 3 MET HG2 H 0.996 15.827 5.233 1.00 . A A . 3 MET HG2 1 1 15 8980 1 1 3 MET HG3 H -0.161 14.575 5.679 1.00 . A A . 3 MET HG3 1 1 15 8981 1 1 3 MET N N -0.623 12.350 3.677 1.00 . A A . 3 MET N 1 1 15 8982 1 1 3 MET O O 1.095 14.112 1.321 1.00 . A A . 3 MET O 1 1 15 8983 1 1 3 MET SD S 1.981 14.184 6.648 1.00 . A A . 3 MET SD 1 1 15 8984 1 1 4 ALA C C -2.401 13.737 -0.967 1.00 . A A . 4 ALA C 1 1 15 8985 1 1 4 ALA CA C -1.006 13.520 -0.400 1.00 . A A . 4 ALA CA 1 1 15 8986 1 1 4 ALA CB C -0.406 12.225 -0.934 1.00 . A A . 4 ALA CB 1 1 15 8987 1 1 4 ALA H H -1.889 13.245 1.501 1.00 . A A . 4 ALA H 1 1 15 8988 1 1 4 ALA HA H -0.371 14.340 -0.705 1.00 . A A . 4 ALA HA 1 1 15 8989 1 1 4 ALA HB1 H -0.052 11.624 -0.109 1.00 . A A . 4 ALA HB1 1 1 15 8990 1 1 4 ALA HB2 H -1.158 11.678 -1.483 1.00 . A A . 4 ALA HB2 1 1 15 8991 1 1 4 ALA HB3 H 0.421 12.456 -1.591 1.00 . A A . 4 ALA HB3 1 1 15 8992 1 1 4 ALA N N -1.050 13.497 1.053 1.00 . A A . 4 ALA N 1 1 15 8993 1 1 4 ALA O O -3.090 12.781 -1.326 1.00 . A A . 4 ALA O 1 1 15 8994 1 1 5 ALA C C -4.388 14.986 -2.881 1.00 . A A . 5 ALA C 1 1 15 8995 1 1 5 ALA CA C -4.190 15.325 -1.411 1.00 . A A . 5 ALA CA 1 1 15 8996 1 1 5 ALA CB C -4.477 16.800 -1.170 1.00 . A A . 5 ALA CB 1 1 15 8997 1 1 5 ALA H H -2.261 15.701 -0.618 1.00 . A A . 5 ALA H 1 1 15 8998 1 1 5 ALA HA H -4.889 14.745 -0.824 1.00 . A A . 5 ALA HA 1 1 15 8999 1 1 5 ALA HB1 H -3.883 17.397 -1.845 1.00 . A A . 5 ALA HB1 1 1 15 9000 1 1 5 ALA HB2 H -5.525 16.996 -1.343 1.00 . A A . 5 ALA HB2 1 1 15 9001 1 1 5 ALA HB3 H -4.227 17.053 -0.149 1.00 . A A . 5 ALA HB3 1 1 15 9002 1 1 5 ALA N N -2.843 14.988 -0.968 1.00 . A A . 5 ALA N 1 1 15 9003 1 1 5 ALA O O -5.296 14.233 -3.241 1.00 . A A . 5 ALA O 1 1 15 9004 1 1 6 HIS C C -2.313 14.894 -5.737 1.00 . A A . 6 HIS C 1 1 15 9005 1 1 6 HIS CA C -3.648 15.348 -5.161 1.00 . A A . 6 HIS CA 1 1 15 9006 1 1 6 HIS CB C -4.110 16.631 -5.856 1.00 . A A . 6 HIS CB 1 1 15 9007 1 1 6 HIS CD2 C -6.220 15.816 -7.124 1.00 . A A . 6 HIS CD2 1 1 15 9008 1 1 6 HIS CE1 C -5.602 16.358 -9.151 1.00 . A A . 6 HIS CE1 1 1 15 9009 1 1 6 HIS CG C -4.993 16.382 -7.039 1.00 . A A . 6 HIS CG 1 1 15 9010 1 1 6 HIS H H -2.854 16.169 -3.379 1.00 . A A . 6 HIS H 1 1 15 9011 1 1 6 HIS HA H -4.381 14.574 -5.332 1.00 . A A . 6 HIS HA 1 1 15 9012 1 1 6 HIS HB2 H -4.658 17.238 -5.152 1.00 . A A . 6 HIS HB2 1 1 15 9013 1 1 6 HIS HB3 H -3.243 17.178 -6.198 1.00 . A A . 6 HIS HB3 1 1 15 9014 1 1 6 HIS HD1 H -3.791 17.146 -8.599 1.00 . A A . 6 HIS HD1 1 1 15 9015 1 1 6 HIS HD2 H -6.810 15.439 -6.302 1.00 . A A . 6 HIS HD2 1 1 15 9016 1 1 6 HIS HE1 H -5.598 16.493 -10.222 1.00 . A A . 6 HIS HE1 1 1 15 9017 1 1 6 HIS HE2 H -7.335 15.306 -8.834 1.00 . A A . 6 HIS HE2 1 1 15 9018 1 1 6 HIS N N -3.548 15.561 -3.727 1.00 . A A . 6 HIS N 1 1 15 9019 1 1 6 HIS ND1 N -4.637 16.710 -8.326 1.00 . A A . 6 HIS ND1 1 1 15 9020 1 1 6 HIS NE2 N -6.574 15.814 -8.450 1.00 . A A . 6 HIS NE2 1 1 15 9021 1 1 6 HIS O O -2.035 15.093 -6.918 1.00 . A A . 6 HIS O 1 1 15 9022 1 1 7 SER C C -0.353 12.467 -6.111 1.00 . A A . 7 SER C 1 1 15 9023 1 1 7 SER CA C -0.198 13.775 -5.339 1.00 . A A . 7 SER CA 1 1 15 9024 1 1 7 SER CB C 0.718 13.581 -4.133 1.00 . A A . 7 SER CB 1 1 15 9025 1 1 7 SER H H -1.770 14.138 -3.975 1.00 . A A . 7 SER H 1 1 15 9026 1 1 7 SER HA H 0.237 14.516 -5.993 1.00 . A A . 7 SER HA 1 1 15 9027 1 1 7 SER HB2 H 0.562 12.596 -3.717 1.00 . A A . 7 SER HB2 1 1 15 9028 1 1 7 SER HB3 H 1.746 13.684 -4.445 1.00 . A A . 7 SER HB3 1 1 15 9029 1 1 7 SER HG H 0.533 15.438 -3.518 1.00 . A A . 7 SER HG 1 1 15 9030 1 1 7 SER N N -1.495 14.275 -4.903 1.00 . A A . 7 SER N 1 1 15 9031 1 1 7 SER O O -1.384 11.797 -6.017 1.00 . A A . 7 SER O 1 1 15 9032 1 1 7 SER OG O 0.442 14.549 -3.132 1.00 . A A . 7 SER OG 1 1 15 9033 1 1 8 ALA C C 1.051 9.705 -6.921 1.00 . A A . 8 ALA C 1 1 15 9034 1 1 8 ALA CA C 0.629 10.933 -7.725 1.00 . A A . 8 ALA CA 1 1 15 9035 1 1 8 ALA CB C 1.531 11.110 -8.936 1.00 . A A . 8 ALA CB 1 1 15 9036 1 1 8 ALA H H 1.441 12.730 -6.952 1.00 . A A . 8 ALA H 1 1 15 9037 1 1 8 ALA HA H -0.383 10.789 -8.077 1.00 . A A . 8 ALA HA 1 1 15 9038 1 1 8 ALA HB1 H 1.051 10.691 -9.808 1.00 . A A . 8 ALA HB1 1 1 15 9039 1 1 8 ALA HB2 H 1.717 12.161 -9.096 1.00 . A A . 8 ALA HB2 1 1 15 9040 1 1 8 ALA HB3 H 2.469 10.602 -8.764 1.00 . A A . 8 ALA HB3 1 1 15 9041 1 1 8 ALA N N 0.655 12.133 -6.904 1.00 . A A . 8 ALA N 1 1 15 9042 1 1 8 ALA O O 1.295 9.791 -5.715 1.00 . A A . 8 ALA O 1 1 15 9043 1 1 9 ASP C C 2.950 7.265 -6.600 1.00 . A A . 9 ASP C 1 1 15 9044 1 1 9 ASP CA C 1.466 7.307 -6.937 1.00 . A A . 9 ASP CA 1 1 15 9045 1 1 9 ASP CB C 1.107 6.111 -7.821 1.00 . A A . 9 ASP CB 1 1 15 9046 1 1 9 ASP CG C 1.363 4.783 -7.130 1.00 . A A . 9 ASP CG 1 1 15 9047 1 1 9 ASP H H 0.870 8.553 -8.544 1.00 . A A . 9 ASP H 1 1 15 9048 1 1 9 ASP HA H 0.905 7.240 -6.016 1.00 . A A . 9 ASP HA 1 1 15 9049 1 1 9 ASP HB2 H 0.061 6.162 -8.083 1.00 . A A . 9 ASP HB2 1 1 15 9050 1 1 9 ASP HB3 H 1.702 6.147 -8.723 1.00 . A A . 9 ASP HB3 1 1 15 9051 1 1 9 ASP N N 1.107 8.561 -7.589 1.00 . A A . 9 ASP N 1 1 15 9052 1 1 9 ASP O O 3.772 6.842 -7.412 1.00 . A A . 9 ASP O 1 1 15 9053 1 1 9 ASP OD1 O 0.911 4.611 -5.978 1.00 . A A . 9 ASP OD1 1 1 15 9054 1 1 9 ASP OD2 O 2.002 3.904 -7.746 1.00 . A A . 9 ASP OD2 1 1 15 9055 1 1 10 LEU C C 4.881 6.278 -4.187 1.00 . A A . 10 LEU C 1 1 15 9056 1 1 10 LEU CA C 4.648 7.609 -4.895 1.00 . A A . 10 LEU CA 1 1 15 9057 1 1 10 LEU CB C 4.919 8.773 -3.937 1.00 . A A . 10 LEU CB 1 1 15 9058 1 1 10 LEU CD1 C 4.361 8.663 -1.491 1.00 . A A . 10 LEU CD1 1 1 15 9059 1 1 10 LEU CD2 C 3.356 10.449 -2.921 1.00 . A A . 10 LEU CD2 1 1 15 9060 1 1 10 LEU CG C 3.839 9.007 -2.877 1.00 . A A . 10 LEU CG 1 1 15 9061 1 1 10 LEU H H 2.569 7.990 -4.785 1.00 . A A . 10 LEU H 1 1 15 9062 1 1 10 LEU HA H 5.313 7.678 -5.744 1.00 . A A . 10 LEU HA 1 1 15 9063 1 1 10 LEU HB2 H 5.856 8.585 -3.432 1.00 . A A . 10 LEU HB2 1 1 15 9064 1 1 10 LEU HB3 H 5.020 9.677 -4.521 1.00 . A A . 10 LEU HB3 1 1 15 9065 1 1 10 LEU HD11 H 4.096 9.449 -0.801 1.00 . A A . 10 LEU HD11 1 1 15 9066 1 1 10 LEU HD12 H 3.923 7.731 -1.163 1.00 . A A . 10 LEU HD12 1 1 15 9067 1 1 10 LEU HD13 H 5.436 8.563 -1.527 1.00 . A A . 10 LEU HD13 1 1 15 9068 1 1 10 LEU HD21 H 3.574 10.873 -3.890 1.00 . A A . 10 LEU HD21 1 1 15 9069 1 1 10 LEU HD22 H 2.289 10.475 -2.749 1.00 . A A . 10 LEU HD22 1 1 15 9070 1 1 10 LEU HD23 H 3.858 11.021 -2.154 1.00 . A A . 10 LEU HD23 1 1 15 9071 1 1 10 LEU HG H 2.995 8.366 -3.083 1.00 . A A . 10 LEU HG 1 1 15 9072 1 1 10 LEU N N 3.276 7.666 -5.384 1.00 . A A . 10 LEU N 1 1 15 9073 1 1 10 LEU O O 5.951 6.037 -3.620 1.00 . A A . 10 LEU O 1 1 15 9074 1 1 11 LYS C C 3.921 4.184 -2.115 1.00 . A A . 11 LYS C 1 1 15 9075 1 1 11 LYS CA C 3.847 4.114 -3.633 1.00 . A A . 11 LYS CA 1 1 15 9076 1 1 11 LYS CB C 4.960 3.235 -4.183 1.00 . A A . 11 LYS CB 1 1 15 9077 1 1 11 LYS CD C 3.571 1.143 -4.328 1.00 . A A . 11 LYS CD 1 1 15 9078 1 1 11 LYS CE C 4.402 0.198 -3.474 1.00 . A A . 11 LYS CE 1 1 15 9079 1 1 11 LYS CG C 4.439 2.139 -5.091 1.00 . A A . 11 LYS CG 1 1 15 9080 1 1 11 LYS H H 3.071 5.689 -4.767 1.00 . A A . 11 LYS H 1 1 15 9081 1 1 11 LYS HA H 2.903 3.657 -3.893 1.00 . A A . 11 LYS HA 1 1 15 9082 1 1 11 LYS HB2 H 5.647 3.848 -4.746 1.00 . A A . 11 LYS HB2 1 1 15 9083 1 1 11 LYS HB3 H 5.485 2.775 -3.359 1.00 . A A . 11 LYS HB3 1 1 15 9084 1 1 11 LYS HD2 H 2.898 1.689 -3.684 1.00 . A A . 11 LYS HD2 1 1 15 9085 1 1 11 LYS HD3 H 3.000 0.564 -5.037 1.00 . A A . 11 LYS HD3 1 1 15 9086 1 1 11 LYS HE2 H 4.219 -0.817 -3.798 1.00 . A A . 11 LYS HE2 1 1 15 9087 1 1 11 LYS HE3 H 5.447 0.437 -3.610 1.00 . A A . 11 LYS HE3 1 1 15 9088 1 1 11 LYS HG2 H 3.846 2.588 -5.874 1.00 . A A . 11 LYS HG2 1 1 15 9089 1 1 11 LYS HG3 H 5.274 1.625 -5.524 1.00 . A A . 11 LYS HG3 1 1 15 9090 1 1 11 LYS HZ1 H 3.028 0.328 -1.892 1.00 . A A . 11 LYS HZ1 1 1 15 9091 1 1 11 LYS HZ2 H 4.458 1.186 -1.628 1.00 . A A . 11 LYS HZ2 1 1 15 9092 1 1 11 LYS HZ3 H 4.451 -0.501 -1.500 1.00 . A A . 11 LYS HZ3 1 1 15 9093 1 1 11 LYS N N 3.855 5.428 -4.250 1.00 . A A . 11 LYS N 1 1 15 9094 1 1 11 LYS NZ N 4.062 0.311 -2.028 1.00 . A A . 11 LYS NZ 1 1 15 9095 1 1 11 LYS O O 4.764 4.871 -1.533 1.00 . A A . 11 LYS O 1 1 15 9096 1 1 12 CYS C C 4.234 2.805 0.547 1.00 . A A . 12 CYS C 1 1 15 9097 1 1 12 CYS CA C 2.948 3.394 -0.036 1.00 . A A . 12 CYS CA 1 1 15 9098 1 1 12 CYS CB C 1.750 2.539 0.376 1.00 . A A . 12 CYS CB 1 1 15 9099 1 1 12 CYS H H 2.364 2.949 -2.012 1.00 . A A . 12 CYS H 1 1 15 9100 1 1 12 CYS HA H 2.815 4.398 0.338 1.00 . A A . 12 CYS HA 1 1 15 9101 1 1 12 CYS HB2 H 1.621 2.603 1.445 1.00 . A A . 12 CYS HB2 1 1 15 9102 1 1 12 CYS HB3 H 0.863 2.910 -0.115 1.00 . A A . 12 CYS HB3 1 1 15 9103 1 1 12 CYS N N 3.018 3.455 -1.483 1.00 . A A . 12 CYS N 1 1 15 9104 1 1 12 CYS O O 5.034 2.190 -0.170 1.00 . A A . 12 CYS O 1 1 15 9105 1 1 12 CYS SG S 1.934 0.784 -0.058 1.00 . A A . 12 CYS SG 1 1 15 9106 1 1 13 PRO C C 5.721 0.928 2.465 1.00 . A A . 13 PRO C 1 1 15 9107 1 1 13 PRO CA C 5.616 2.451 2.563 1.00 . A A . 13 PRO CA 1 1 15 9108 1 1 13 PRO CB C 5.385 2.868 4.019 1.00 . A A . 13 PRO CB 1 1 15 9109 1 1 13 PRO CD C 3.566 3.741 2.761 1.00 . A A . 13 PRO CD 1 1 15 9110 1 1 13 PRO CG C 3.941 3.210 4.108 1.00 . A A . 13 PRO CG 1 1 15 9111 1 1 13 PRO HA H 6.530 2.898 2.200 1.00 . A A . 13 PRO HA 1 1 15 9112 1 1 13 PRO HB2 H 5.635 2.048 4.676 1.00 . A A . 13 PRO HB2 1 1 15 9113 1 1 13 PRO HB3 H 5.998 3.719 4.249 1.00 . A A . 13 PRO HB3 1 1 15 9114 1 1 13 PRO HD2 H 2.525 3.542 2.550 1.00 . A A . 13 PRO HD2 1 1 15 9115 1 1 13 PRO HD3 H 3.770 4.799 2.698 1.00 . A A . 13 PRO HD3 1 1 15 9116 1 1 13 PRO HG2 H 3.368 2.324 4.336 1.00 . A A . 13 PRO HG2 1 1 15 9117 1 1 13 PRO HG3 H 3.788 3.964 4.866 1.00 . A A . 13 PRO HG3 1 1 15 9118 1 1 13 PRO N N 4.444 2.983 1.859 1.00 . A A . 13 PRO N 1 1 15 9119 1 1 13 PRO O O 6.818 0.371 2.518 1.00 . A A . 13 PRO O 1 1 15 9120 1 1 14 THR C C 5.234 -1.698 0.990 1.00 . A A . 14 THR C 1 1 15 9121 1 1 14 THR CA C 4.516 -1.189 2.245 1.00 . A A . 14 THR CA 1 1 15 9122 1 1 14 THR CB C 3.053 -1.682 2.244 1.00 . A A . 14 THR CB 1 1 15 9123 1 1 14 THR CG2 C 2.985 -3.197 2.361 1.00 . A A . 14 THR CG2 1 1 15 9124 1 1 14 THR H H 3.740 0.780 2.305 1.00 . A A . 14 THR H 1 1 15 9125 1 1 14 THR HA H 5.009 -1.600 3.112 1.00 . A A . 14 THR HA 1 1 15 9126 1 1 14 THR HB H 2.589 -1.386 1.314 1.00 . A A . 14 THR HB 1 1 15 9127 1 1 14 THR HG1 H 1.465 -0.779 3.024 1.00 . A A . 14 THR HG1 1 1 15 9128 1 1 14 THR HG21 H 3.945 -3.576 2.676 1.00 . A A . 14 THR HG21 1 1 15 9129 1 1 14 THR HG22 H 2.726 -3.621 1.401 1.00 . A A . 14 THR HG22 1 1 15 9130 1 1 14 THR HG23 H 2.234 -3.468 3.089 1.00 . A A . 14 THR HG23 1 1 15 9131 1 1 14 THR N N 4.575 0.269 2.340 1.00 . A A . 14 THR N 1 1 15 9132 1 1 14 THR O O 4.856 -1.365 -0.133 1.00 . A A . 14 THR O 1 1 15 9133 1 1 14 THR OG1 O 2.333 -1.087 3.339 1.00 . A A . 14 THR OG1 1 1 15 9134 1 1 15 PRO C C 6.421 -3.946 -0.825 1.00 . A A . 15 PRO C 1 1 15 9135 1 1 15 PRO CA C 7.156 -2.944 0.063 1.00 . A A . 15 PRO CA 1 1 15 9136 1 1 15 PRO CB C 8.337 -3.627 0.762 1.00 . A A . 15 PRO CB 1 1 15 9137 1 1 15 PRO CD C 6.906 -2.813 2.478 1.00 . A A . 15 PRO CD 1 1 15 9138 1 1 15 PRO CG C 8.344 -3.069 2.138 1.00 . A A . 15 PRO CG 1 1 15 9139 1 1 15 PRO HA H 7.520 -2.130 -0.543 1.00 . A A . 15 PRO HA 1 1 15 9140 1 1 15 PRO HB2 H 8.184 -4.696 0.772 1.00 . A A . 15 PRO HB2 1 1 15 9141 1 1 15 PRO HB3 H 9.253 -3.395 0.242 1.00 . A A . 15 PRO HB3 1 1 15 9142 1 1 15 PRO HD2 H 6.445 -3.706 2.876 1.00 . A A . 15 PRO HD2 1 1 15 9143 1 1 15 PRO HD3 H 6.821 -1.995 3.177 1.00 . A A . 15 PRO HD3 1 1 15 9144 1 1 15 PRO HG2 H 8.775 -3.784 2.821 1.00 . A A . 15 PRO HG2 1 1 15 9145 1 1 15 PRO HG3 H 8.902 -2.145 2.156 1.00 . A A . 15 PRO HG3 1 1 15 9146 1 1 15 PRO N N 6.329 -2.454 1.174 1.00 . A A . 15 PRO N 1 1 15 9147 1 1 15 PRO O O 6.495 -3.873 -2.053 1.00 . A A . 15 PRO O 1 1 15 9148 1 1 16 GLY C C 3.743 -5.571 -1.487 1.00 . A A . 16 GLY C 1 1 15 9149 1 1 16 GLY CA C 5.102 -5.972 -0.943 1.00 . A A . 16 GLY CA 1 1 15 9150 1 1 16 GLY H H 5.774 -4.946 0.778 1.00 . A A . 16 GLY H 1 1 15 9151 1 1 16 GLY HA2 H 5.736 -6.253 -1.767 1.00 . A A . 16 GLY HA2 1 1 15 9152 1 1 16 GLY HA3 H 4.978 -6.827 -0.293 1.00 . A A . 16 GLY HA3 1 1 15 9153 1 1 16 GLY N N 5.759 -4.913 -0.199 1.00 . A A . 16 GLY N 1 1 15 9154 1 1 16 GLY O O 3.042 -6.388 -2.086 1.00 . A A . 16 GLY O 1 1 15 9155 1 1 17 CYS C C 2.128 -3.531 -3.255 1.00 . A A . 17 CYS C 1 1 15 9156 1 1 17 CYS CA C 2.096 -3.804 -1.754 1.00 . A A . 17 CYS CA 1 1 15 9157 1 1 17 CYS CB C 1.765 -2.519 -1.013 1.00 . A A . 17 CYS CB 1 1 15 9158 1 1 17 CYS H H 3.978 -3.716 -0.800 1.00 . A A . 17 CYS H 1 1 15 9159 1 1 17 CYS HA H 1.336 -4.541 -1.542 1.00 . A A . 17 CYS HA 1 1 15 9160 1 1 17 CYS HB2 H 2.327 -2.495 -0.090 1.00 . A A . 17 CYS HB2 1 1 15 9161 1 1 17 CYS HB3 H 2.060 -1.679 -1.625 1.00 . A A . 17 CYS HB3 1 1 15 9162 1 1 17 CYS N N 3.372 -4.317 -1.282 1.00 . A A . 17 CYS N 1 1 15 9163 1 1 17 CYS O O 3.185 -3.247 -3.822 1.00 . A A . 17 CYS O 1 1 15 9164 1 1 17 CYS SG S 0.012 -2.300 -0.585 1.00 . A A . 17 CYS SG 1 1 15 9165 1 1 18 ASP C C 0.554 -1.628 -5.387 1.00 . A A . 18 ASP C 1 1 15 9166 1 1 18 ASP CA C 0.821 -3.127 -5.265 1.00 . A A . 18 ASP CA 1 1 15 9167 1 1 18 ASP CB C -0.293 -3.937 -5.943 1.00 . A A . 18 ASP CB 1 1 15 9168 1 1 18 ASP CG C -1.649 -3.256 -5.900 1.00 . A A . 18 ASP CG 1 1 15 9169 1 1 18 ASP H H 0.136 -3.621 -3.326 1.00 . A A . 18 ASP H 1 1 15 9170 1 1 18 ASP HA H 1.762 -3.351 -5.749 1.00 . A A . 18 ASP HA 1 1 15 9171 1 1 18 ASP HB2 H -0.030 -4.097 -6.977 1.00 . A A . 18 ASP HB2 1 1 15 9172 1 1 18 ASP HB3 H -0.378 -4.895 -5.450 1.00 . A A . 18 ASP HB3 1 1 15 9173 1 1 18 ASP N N 0.947 -3.489 -3.859 1.00 . A A . 18 ASP N 1 1 15 9174 1 1 18 ASP O O 1.094 -0.958 -6.269 1.00 . A A . 18 ASP O 1 1 15 9175 1 1 18 ASP OD1 O -2.259 -3.193 -4.812 1.00 . A A . 18 ASP OD1 1 1 15 9176 1 1 18 ASP OD2 O -2.107 -2.774 -6.957 1.00 . A A . 18 ASP OD2 1 1 15 9177 1 1 19 GLY C C -1.763 0.772 -4.926 1.00 . A A . 19 GLY C 1 1 15 9178 1 1 19 GLY CA C -0.416 0.339 -4.374 1.00 . A A . 19 GLY CA 1 1 15 9179 1 1 19 GLY H H -0.529 -1.666 -3.708 1.00 . A A . 19 GLY H 1 1 15 9180 1 1 19 GLY HA2 H -0.345 0.661 -3.347 1.00 . A A . 19 GLY HA2 1 1 15 9181 1 1 19 GLY HA3 H 0.362 0.828 -4.940 1.00 . A A . 19 GLY HA3 1 1 15 9182 1 1 19 GLY N N -0.192 -1.091 -4.428 1.00 . A A . 19 GLY N 1 1 15 9183 1 1 19 GLY O O -2.195 1.903 -4.691 1.00 . A A . 19 GLY O 1 1 15 9184 1 1 20 SER C C -4.867 -0.381 -5.710 1.00 . A A . 20 SER C 1 1 15 9185 1 1 20 SER CA C -3.658 0.301 -6.345 1.00 . A A . 20 SER CA 1 1 15 9186 1 1 20 SER CB C -3.591 -0.021 -7.841 1.00 . A A . 20 SER CB 1 1 15 9187 1 1 20 SER H H -2.021 -0.964 -5.890 1.00 . A A . 20 SER H 1 1 15 9188 1 1 20 SER HA H -3.768 1.369 -6.226 1.00 . A A . 20 SER HA 1 1 15 9189 1 1 20 SER HB2 H -4.287 -0.816 -8.068 1.00 . A A . 20 SER HB2 1 1 15 9190 1 1 20 SER HB3 H -3.851 0.858 -8.411 1.00 . A A . 20 SER HB3 1 1 15 9191 1 1 20 SER HG H -2.124 -1.331 -7.856 1.00 . A A . 20 SER HG 1 1 15 9192 1 1 20 SER N N -2.412 -0.081 -5.698 1.00 . A A . 20 SER N 1 1 15 9193 1 1 20 SER O O -5.460 -1.289 -6.293 1.00 . A A . 20 SER O 1 1 15 9194 1 1 20 SER OG O -2.284 -0.438 -8.209 1.00 . A A . 20 SER OG 1 1 15 9195 1 1 21 GLY C C -6.515 -0.132 -2.440 1.00 . A A . 21 GLY C 1 1 15 9196 1 1 21 GLY CA C -6.488 -0.383 -3.931 1.00 . A A . 21 GLY CA 1 1 15 9197 1 1 21 GLY H H -4.817 0.879 -4.165 1.00 . A A . 21 GLY H 1 1 15 9198 1 1 21 GLY HA2 H -7.345 0.095 -4.381 1.00 . A A . 21 GLY HA2 1 1 15 9199 1 1 21 GLY HA3 H -6.550 -1.447 -4.107 1.00 . A A . 21 GLY HA3 1 1 15 9200 1 1 21 GLY N N -5.288 0.123 -4.559 1.00 . A A . 21 GLY N 1 1 15 9201 1 1 21 GLY O O -5.587 0.448 -1.888 1.00 . A A . 21 GLY O 1 1 15 9202 1 1 22 HIS C C -8.377 -1.852 0.137 1.00 . A A . 22 HIS C 1 1 15 9203 1 1 22 HIS CA C -7.699 -0.575 -0.340 1.00 . A A . 22 HIS CA 1 1 15 9204 1 1 22 HIS CB C -8.547 0.626 0.104 1.00 . A A . 22 HIS CB 1 1 15 9205 1 1 22 HIS CD2 C -6.936 2.661 -0.224 1.00 . A A . 22 HIS CD2 1 1 15 9206 1 1 22 HIS CE1 C -7.225 3.591 1.734 1.00 . A A . 22 HIS CE1 1 1 15 9207 1 1 22 HIS CG C -7.791 1.874 0.475 1.00 . A A . 22 HIS CG 1 1 15 9208 1 1 22 HIS H H -8.226 -1.134 -2.308 1.00 . A A . 22 HIS H 1 1 15 9209 1 1 22 HIS HA H -6.714 -0.506 0.100 1.00 . A A . 22 HIS HA 1 1 15 9210 1 1 22 HIS HB2 H -9.217 0.886 -0.698 1.00 . A A . 22 HIS HB2 1 1 15 9211 1 1 22 HIS HB3 H -9.134 0.331 0.962 1.00 . A A . 22 HIS HB3 1 1 15 9212 1 1 22 HIS HD1 H -8.500 2.159 2.451 1.00 . A A . 22 HIS HD1 1 1 15 9213 1 1 22 HIS HD2 H -6.574 2.486 -1.225 1.00 . A A . 22 HIS HD2 1 1 15 9214 1 1 22 HIS HE1 H -7.153 4.266 2.571 1.00 . A A . 22 HIS HE1 1 1 15 9215 1 1 22 HIS HE2 H -6.229 4.580 0.248 1.00 . A A . 22 HIS HE2 1 1 15 9216 1 1 22 HIS N N -7.553 -0.631 -1.792 1.00 . A A . 22 HIS N 1 1 15 9217 1 1 22 HIS ND1 N -7.943 2.489 1.701 1.00 . A A . 22 HIS ND1 1 1 15 9218 1 1 22 HIS NE2 N -6.604 3.724 0.580 1.00 . A A . 22 HIS NE2 1 1 15 9219 1 1 22 HIS O O -9.258 -2.372 -0.546 1.00 . A A . 22 HIS O 1 1 15 9220 1 1 23 ILE C C -10.160 -3.154 2.232 1.00 . A A . 23 ILE C 1 1 15 9221 1 1 23 ILE CA C -8.696 -3.473 1.916 1.00 . A A . 23 ILE CA 1 1 15 9222 1 1 23 ILE CB C -7.944 -3.963 3.185 1.00 . A A . 23 ILE CB 1 1 15 9223 1 1 23 ILE CD1 C -8.468 -6.446 2.874 1.00 . A A . 23 ILE CD1 1 1 15 9224 1 1 23 ILE CG1 C -7.396 -5.377 2.961 1.00 . A A . 23 ILE CG1 1 1 15 9225 1 1 23 ILE CG2 C -8.823 -3.915 4.434 1.00 . A A . 23 ILE CG2 1 1 15 9226 1 1 23 ILE H H -7.383 -1.810 1.872 1.00 . A A . 23 ILE H 1 1 15 9227 1 1 23 ILE HA H -8.665 -4.263 1.178 1.00 . A A . 23 ILE HA 1 1 15 9228 1 1 23 ILE HB H -7.111 -3.295 3.348 1.00 . A A . 23 ILE HB 1 1 15 9229 1 1 23 ILE HD11 H -8.750 -6.589 1.840 1.00 . A A . 23 ILE HD11 1 1 15 9230 1 1 23 ILE HD12 H -8.084 -7.372 3.275 1.00 . A A . 23 ILE HD12 1 1 15 9231 1 1 23 ILE HD13 H -9.332 -6.136 3.444 1.00 . A A . 23 ILE HD13 1 1 15 9232 1 1 23 ILE HG12 H -6.837 -5.396 2.037 1.00 . A A . 23 ILE HG12 1 1 15 9233 1 1 23 ILE HG13 H -6.737 -5.633 3.779 1.00 . A A . 23 ILE HG13 1 1 15 9234 1 1 23 ILE HG21 H -9.795 -4.326 4.206 1.00 . A A . 23 ILE HG21 1 1 15 9235 1 1 23 ILE HG22 H -8.362 -4.497 5.220 1.00 . A A . 23 ILE HG22 1 1 15 9236 1 1 23 ILE HG23 H -8.931 -2.891 4.758 1.00 . A A . 23 ILE HG23 1 1 15 9237 1 1 23 ILE N N -8.044 -2.303 1.338 1.00 . A A . 23 ILE N 1 1 15 9238 1 1 23 ILE O O -11.019 -4.039 2.230 1.00 . A A . 23 ILE O 1 1 15 9239 1 1 24 THR C C -12.688 -1.516 1.485 1.00 . A A . 24 THR C 1 1 15 9240 1 1 24 THR CA C -11.792 -1.413 2.726 1.00 . A A . 24 THR CA 1 1 15 9241 1 1 24 THR CB C -11.791 0.039 3.264 1.00 . A A . 24 THR CB 1 1 15 9242 1 1 24 THR CG2 C -11.516 1.042 2.154 1.00 . A A . 24 THR CG2 1 1 15 9243 1 1 24 THR H H -9.708 -1.214 2.420 1.00 . A A . 24 THR H 1 1 15 9244 1 1 24 THR HA H -12.198 -2.053 3.496 1.00 . A A . 24 THR HA 1 1 15 9245 1 1 24 THR HB H -11.008 0.128 4.005 1.00 . A A . 24 THR HB 1 1 15 9246 1 1 24 THR HG1 H -13.230 -0.317 4.576 1.00 . A A . 24 THR HG1 1 1 15 9247 1 1 24 THR HG21 H -12.007 1.975 2.384 1.00 . A A . 24 THR HG21 1 1 15 9248 1 1 24 THR HG22 H -11.895 0.656 1.220 1.00 . A A . 24 THR HG22 1 1 15 9249 1 1 24 THR HG23 H -10.452 1.203 2.072 1.00 . A A . 24 THR HG23 1 1 15 9250 1 1 24 THR N N -10.440 -1.871 2.443 1.00 . A A . 24 THR N 1 1 15 9251 1 1 24 THR O O -13.910 -1.570 1.600 1.00 . A A . 24 THR O 1 1 15 9252 1 1 24 THR OG1 O -13.046 0.344 3.885 1.00 . A A . 24 THR OG1 1 1 15 9253 1 1 25 GLY C C -13.642 -0.535 -1.272 1.00 . A A . 25 GLY C 1 1 15 9254 1 1 25 GLY CA C -12.825 -1.769 -0.926 1.00 . A A . 25 GLY CA 1 1 15 9255 1 1 25 GLY H H -11.088 -1.649 0.282 1.00 . A A . 25 GLY H 1 1 15 9256 1 1 25 GLY HA2 H -12.136 -1.967 -1.734 1.00 . A A . 25 GLY HA2 1 1 15 9257 1 1 25 GLY HA3 H -13.491 -2.611 -0.822 1.00 . A A . 25 GLY HA3 1 1 15 9258 1 1 25 GLY N N -12.069 -1.615 0.307 1.00 . A A . 25 GLY N 1 1 15 9259 1 1 25 GLY O O -14.685 -0.629 -1.922 1.00 . A A . 25 GLY O 1 1 15 9260 1 1 26 ASN C C -13.060 2.876 -1.787 1.00 . A A . 26 ASN C 1 1 15 9261 1 1 26 ASN CA C -13.906 1.869 -1.021 1.00 . A A . 26 ASN CA 1 1 15 9262 1 1 26 ASN CB C -14.312 2.466 0.324 1.00 . A A . 26 ASN CB 1 1 15 9263 1 1 26 ASN CG C -15.667 1.985 0.791 1.00 . A A . 26 ASN CG 1 1 15 9264 1 1 26 ASN H H -12.359 0.629 -0.287 1.00 . A A . 26 ASN H 1 1 15 9265 1 1 26 ASN HA H -14.795 1.649 -1.593 1.00 . A A . 26 ASN HA 1 1 15 9266 1 1 26 ASN HB2 H -13.580 2.192 1.068 1.00 . A A . 26 ASN HB2 1 1 15 9267 1 1 26 ASN HB3 H -14.344 3.540 0.241 1.00 . A A . 26 ASN HB3 1 1 15 9268 1 1 26 ASN HD21 H -14.900 1.447 2.538 1.00 . A A . 26 ASN HD21 1 1 15 9269 1 1 26 ASN HD22 H -16.595 1.179 2.344 1.00 . A A . 26 ASN HD22 1 1 15 9270 1 1 26 ASN N N -13.182 0.622 -0.814 1.00 . A A . 26 ASN N 1 1 15 9271 1 1 26 ASN ND2 N -15.725 1.485 2.011 1.00 . A A . 26 ASN ND2 1 1 15 9272 1 1 26 ASN O O -13.495 3.997 -2.047 1.00 . A A . 26 ASN O 1 1 15 9273 1 1 26 ASN OD1 O -16.657 2.069 0.064 1.00 . A A . 26 ASN OD1 1 1 15 9274 1 1 27 TYR C C -10.391 2.720 -4.066 1.00 . A A . 27 TYR C 1 1 15 9275 1 1 27 TYR CA C -10.917 3.375 -2.798 1.00 . A A . 27 TYR CA 1 1 15 9276 1 1 27 TYR CB C -9.756 3.731 -1.874 1.00 . A A . 27 TYR CB 1 1 15 9277 1 1 27 TYR CD1 C -10.738 4.151 0.416 1.00 . A A . 27 TYR CD1 1 1 15 9278 1 1 27 TYR CD2 C -9.929 6.022 -0.821 1.00 . A A . 27 TYR CD2 1 1 15 9279 1 1 27 TYR CE1 C -11.103 4.987 1.452 1.00 . A A . 27 TYR CE1 1 1 15 9280 1 1 27 TYR CE2 C -10.291 6.866 0.212 1.00 . A A . 27 TYR CE2 1 1 15 9281 1 1 27 TYR CG C -10.146 4.653 -0.738 1.00 . A A . 27 TYR CG 1 1 15 9282 1 1 27 TYR CZ C -10.879 6.343 1.347 1.00 . A A . 27 TYR CZ 1 1 15 9283 1 1 27 TYR H H -11.536 1.584 -1.874 1.00 . A A . 27 TYR H 1 1 15 9284 1 1 27 TYR HA H -11.451 4.275 -3.061 1.00 . A A . 27 TYR HA 1 1 15 9285 1 1 27 TYR HB2 H -9.359 2.824 -1.445 1.00 . A A . 27 TYR HB2 1 1 15 9286 1 1 27 TYR HB3 H -8.984 4.212 -2.446 1.00 . A A . 27 TYR HB3 1 1 15 9287 1 1 27 TYR HD1 H -10.914 3.087 0.497 1.00 . A A . 27 TYR HD1 1 1 15 9288 1 1 27 TYR HD2 H -9.468 6.428 -1.709 1.00 . A A . 27 TYR HD2 1 1 15 9289 1 1 27 TYR HE1 H -11.561 4.577 2.339 1.00 . A A . 27 TYR HE1 1 1 15 9290 1 1 27 TYR HE2 H -10.117 7.929 0.128 1.00 . A A . 27 TYR HE2 1 1 15 9291 1 1 27 TYR HH H -11.639 7.986 2.024 1.00 . A A . 27 TYR HH 1 1 15 9292 1 1 27 TYR N N -11.837 2.488 -2.112 1.00 . A A . 27 TYR N 1 1 15 9293 1 1 27 TYR O O -10.594 1.526 -4.284 1.00 . A A . 27 TYR O 1 1 15 9294 1 1 27 TYR OH O -11.239 7.177 2.383 1.00 . A A . 27 TYR OH 1 1 15 9295 1 1 28 ALA C C -7.631 2.796 -5.987 1.00 . A A . 28 ALA C 1 1 15 9296 1 1 28 ALA CA C -9.138 2.979 -6.122 1.00 . A A . 28 ALA CA 1 1 15 9297 1 1 28 ALA CB C -9.465 3.910 -7.283 1.00 . A A . 28 ALA CB 1 1 15 9298 1 1 28 ALA H H -9.562 4.442 -4.647 1.00 . A A . 28 ALA H 1 1 15 9299 1 1 28 ALA HA H -9.591 2.020 -6.321 1.00 . A A . 28 ALA HA 1 1 15 9300 1 1 28 ALA HB1 H -9.613 4.913 -6.911 1.00 . A A . 28 ALA HB1 1 1 15 9301 1 1 28 ALA HB2 H -8.647 3.906 -7.988 1.00 . A A . 28 ALA HB2 1 1 15 9302 1 1 28 ALA HB3 H -10.366 3.573 -7.774 1.00 . A A . 28 ALA HB3 1 1 15 9303 1 1 28 ALA N N -9.705 3.495 -4.885 1.00 . A A . 28 ALA N 1 1 15 9304 1 1 28 ALA O O -7.044 1.907 -6.604 1.00 . A A . 28 ALA O 1 1 15 9305 1 1 29 SER C C -5.221 4.129 -3.562 1.00 . A A . 29 SER C 1 1 15 9306 1 1 29 SER CA C -5.582 3.533 -4.917 1.00 . A A . 29 SER CA 1 1 15 9307 1 1 29 SER CB C -4.833 4.259 -6.039 1.00 . A A . 29 SER CB 1 1 15 9308 1 1 29 SER H H -7.543 4.274 -4.642 1.00 . A A . 29 SER H 1 1 15 9309 1 1 29 SER HA H -5.302 2.492 -4.927 1.00 . A A . 29 SER HA 1 1 15 9310 1 1 29 SER HB2 H -3.949 4.727 -5.634 1.00 . A A . 29 SER HB2 1 1 15 9311 1 1 29 SER HB3 H -4.546 3.546 -6.800 1.00 . A A . 29 SER HB3 1 1 15 9312 1 1 29 SER HG H -6.009 5.828 -5.934 1.00 . A A . 29 SER HG 1 1 15 9313 1 1 29 SER N N -7.015 3.611 -5.142 1.00 . A A . 29 SER N 1 1 15 9314 1 1 29 SER O O -6.102 4.560 -2.815 1.00 . A A . 29 SER O 1 1 15 9315 1 1 29 SER OG O -5.650 5.256 -6.632 1.00 . A A . 29 SER OG 1 1 15 9316 1 1 30 HIS C C -1.940 4.879 -2.065 1.00 . A A . 30 HIS C 1 1 15 9317 1 1 30 HIS CA C -3.446 4.638 -1.967 1.00 . A A . 30 HIS CA 1 1 15 9318 1 1 30 HIS CB C -3.770 3.666 -0.825 1.00 . A A . 30 HIS CB 1 1 15 9319 1 1 30 HIS CD2 C -1.960 1.995 -0.006 1.00 . A A . 30 HIS CD2 1 1 15 9320 1 1 30 HIS CE1 C -2.168 0.495 -1.556 1.00 . A A . 30 HIS CE1 1 1 15 9321 1 1 30 HIS CG C -2.945 2.418 -0.841 1.00 . A A . 30 HIS CG 1 1 15 9322 1 1 30 HIS H H -3.288 3.722 -3.860 1.00 . A A . 30 HIS H 1 1 15 9323 1 1 30 HIS HA H -3.943 5.581 -1.784 1.00 . A A . 30 HIS HA 1 1 15 9324 1 1 30 HIS HB2 H -3.620 4.157 0.119 1.00 . A A . 30 HIS HB2 1 1 15 9325 1 1 30 HIS HB3 H -4.807 3.373 -0.904 1.00 . A A . 30 HIS HB3 1 1 15 9326 1 1 30 HIS HD1 H -3.707 1.452 -2.553 1.00 . A A . 30 HIS HD1 1 1 15 9327 1 1 30 HIS HD2 H -1.601 2.507 0.874 1.00 . A A . 30 HIS HD2 1 1 15 9328 1 1 30 HIS HE1 H -2.018 -0.384 -2.165 1.00 . A A . 30 HIS HE1 1 1 15 9329 1 1 30 HIS N N -3.936 4.104 -3.232 1.00 . A A . 30 HIS N 1 1 15 9330 1 1 30 HIS ND1 N -3.063 1.451 -1.816 1.00 . A A . 30 HIS ND1 1 1 15 9331 1 1 30 HIS NE2 N -1.489 0.783 -0.478 1.00 . A A . 30 HIS NE2 1 1 15 9332 1 1 30 HIS O O -1.292 4.360 -2.974 1.00 . A A . 30 HIS O 1 1 15 9333 1 1 31 ARG C C 0.584 6.058 0.299 1.00 . A A . 31 ARG C 1 1 15 9334 1 1 31 ARG CA C 0.047 5.919 -1.125 1.00 . A A . 31 ARG CA 1 1 15 9335 1 1 31 ARG CB C 0.361 7.187 -1.925 1.00 . A A . 31 ARG CB 1 1 15 9336 1 1 31 ARG CD C -0.692 9.183 -3.021 1.00 . A A . 31 ARG CD 1 1 15 9337 1 1 31 ARG CG C -0.697 8.272 -1.808 1.00 . A A . 31 ARG CG 1 1 15 9338 1 1 31 ARG CZ C -2.818 9.315 -4.277 1.00 . A A . 31 ARG CZ 1 1 15 9339 1 1 31 ARG H H -1.960 6.033 -0.428 1.00 . A A . 31 ARG H 1 1 15 9340 1 1 31 ARG HA H 0.543 5.084 -1.597 1.00 . A A . 31 ARG HA 1 1 15 9341 1 1 31 ARG HB2 H 1.299 7.594 -1.574 1.00 . A A . 31 ARG HB2 1 1 15 9342 1 1 31 ARG HB3 H 0.462 6.923 -2.967 1.00 . A A . 31 ARG HB3 1 1 15 9343 1 1 31 ARG HD2 H -0.960 10.179 -2.705 1.00 . A A . 31 ARG HD2 1 1 15 9344 1 1 31 ARG HD3 H 0.303 9.195 -3.443 1.00 . A A . 31 ARG HD3 1 1 15 9345 1 1 31 ARG HE H -1.366 7.967 -4.605 1.00 . A A . 31 ARG HE 1 1 15 9346 1 1 31 ARG HG2 H -1.667 7.806 -1.725 1.00 . A A . 31 ARG HG2 1 1 15 9347 1 1 31 ARG HG3 H -0.500 8.861 -0.924 1.00 . A A . 31 ARG HG3 1 1 15 9348 1 1 31 ARG HH11 H -2.643 10.687 -2.798 1.00 . A A . 31 ARG HH11 1 1 15 9349 1 1 31 ARG HH12 H -4.109 10.782 -3.726 1.00 . A A . 31 ARG HH12 1 1 15 9350 1 1 31 ARG HH21 H -3.296 8.091 -5.828 1.00 . A A . 31 ARG HH21 1 1 15 9351 1 1 31 ARG HH22 H -4.490 9.292 -5.429 1.00 . A A . 31 ARG HH22 1 1 15 9352 1 1 31 ARG N N -1.388 5.641 -1.131 1.00 . A A . 31 ARG N 1 1 15 9353 1 1 31 ARG NE N -1.636 8.742 -4.047 1.00 . A A . 31 ARG NE 1 1 15 9354 1 1 31 ARG NH1 N -3.219 10.342 -3.538 1.00 . A A . 31 ARG NH1 1 1 15 9355 1 1 31 ARG NH2 N -3.595 8.868 -5.257 1.00 . A A . 31 ARG NH2 1 1 15 9356 1 1 31 ARG O O 1.677 6.584 0.510 1.00 . A A . 31 ARG O 1 1 15 9357 1 1 32 SER C C -0.189 4.337 3.404 1.00 . A A . 32 SER C 1 1 15 9358 1 1 32 SER CA C 0.278 5.582 2.659 1.00 . A A . 32 SER CA 1 1 15 9359 1 1 32 SER CB C -0.261 6.840 3.346 1.00 . A A . 32 SER CB 1 1 15 9360 1 1 32 SER H H -0.999 5.094 1.045 1.00 . A A . 32 SER H 1 1 15 9361 1 1 32 SER HA H 1.357 5.611 2.669 1.00 . A A . 32 SER HA 1 1 15 9362 1 1 32 SER HB2 H -0.668 6.573 4.312 1.00 . A A . 32 SER HB2 1 1 15 9363 1 1 32 SER HB3 H 0.544 7.547 3.478 1.00 . A A . 32 SER HB3 1 1 15 9364 1 1 32 SER HG H -1.997 7.740 3.162 1.00 . A A . 32 SER HG 1 1 15 9365 1 1 32 SER N N -0.157 5.541 1.267 1.00 . A A . 32 SER N 1 1 15 9366 1 1 32 SER O O -1.055 3.602 2.919 1.00 . A A . 32 SER O 1 1 15 9367 1 1 32 SER OG O -1.283 7.450 2.574 1.00 . A A . 32 SER OG 1 1 15 9368 1 1 33 LEU C C -1.311 3.194 6.118 1.00 . A A . 33 LEU C 1 1 15 9369 1 1 33 LEU CA C 0.013 2.959 5.401 1.00 . A A . 33 LEU CA 1 1 15 9370 1 1 33 LEU CB C 1.110 2.672 6.427 1.00 . A A . 33 LEU CB 1 1 15 9371 1 1 33 LEU CD1 C 3.167 1.395 7.060 1.00 . A A . 33 LEU CD1 1 1 15 9372 1 1 33 LEU CD2 C 1.135 0.179 6.275 1.00 . A A . 33 LEU CD2 1 1 15 9373 1 1 33 LEU CG C 1.962 1.443 6.135 1.00 . A A . 33 LEU CG 1 1 15 9374 1 1 33 LEU H H 1.066 4.723 4.918 1.00 . A A . 33 LEU H 1 1 15 9375 1 1 33 LEU HA H -0.087 2.111 4.745 1.00 . A A . 33 LEU HA 1 1 15 9376 1 1 33 LEU HB2 H 1.763 3.532 6.473 1.00 . A A . 33 LEU HB2 1 1 15 9377 1 1 33 LEU HB3 H 0.646 2.540 7.392 1.00 . A A . 33 LEU HB3 1 1 15 9378 1 1 33 LEU HD11 H 3.421 0.367 7.270 1.00 . A A . 33 LEU HD11 1 1 15 9379 1 1 33 LEU HD12 H 4.004 1.882 6.583 1.00 . A A . 33 LEU HD12 1 1 15 9380 1 1 33 LEU HD13 H 2.932 1.905 7.983 1.00 . A A . 33 LEU HD13 1 1 15 9381 1 1 33 LEU HD21 H 0.527 0.045 5.391 1.00 . A A . 33 LEU HD21 1 1 15 9382 1 1 33 LEU HD22 H 1.793 -0.670 6.392 1.00 . A A . 33 LEU HD22 1 1 15 9383 1 1 33 LEU HD23 H 0.495 0.259 7.143 1.00 . A A . 33 LEU HD23 1 1 15 9384 1 1 33 LEU HG H 2.321 1.500 5.117 1.00 . A A . 33 LEU HG 1 1 15 9385 1 1 33 LEU N N 0.373 4.111 4.589 1.00 . A A . 33 LEU N 1 1 15 9386 1 1 33 LEU O O -1.353 3.381 7.335 1.00 . A A . 33 LEU O 1 1 15 9387 1 1 34 SER C C -4.695 2.376 5.337 1.00 . A A . 34 SER C 1 1 15 9388 1 1 34 SER CA C -3.719 3.409 5.895 1.00 . A A . 34 SER CA 1 1 15 9389 1 1 34 SER CB C -4.207 4.818 5.570 1.00 . A A . 34 SER CB 1 1 15 9390 1 1 34 SER H H -2.281 3.067 4.385 1.00 . A A . 34 SER H 1 1 15 9391 1 1 34 SER HA H -3.661 3.293 6.968 1.00 . A A . 34 SER HA 1 1 15 9392 1 1 34 SER HB2 H -4.508 4.860 4.535 1.00 . A A . 34 SER HB2 1 1 15 9393 1 1 34 SER HB3 H -5.050 5.061 6.200 1.00 . A A . 34 SER HB3 1 1 15 9394 1 1 34 SER HG H -2.385 5.321 6.091 1.00 . A A . 34 SER HG 1 1 15 9395 1 1 34 SER N N -2.387 3.204 5.351 1.00 . A A . 34 SER N 1 1 15 9396 1 1 34 SER O O -5.536 1.845 6.064 1.00 . A A . 34 SER O 1 1 15 9397 1 1 34 SER OG O -3.179 5.773 5.785 1.00 . A A . 34 SER OG 1 1 15 9398 1 1 35 GLY C C -4.766 0.238 2.441 1.00 . A A . 35 GLY C 1 1 15 9399 1 1 35 GLY CA C -5.473 1.145 3.422 1.00 . A A . 35 GLY CA 1 1 15 9400 1 1 35 GLY H H -3.895 2.545 3.511 1.00 . A A . 35 GLY H 1 1 15 9401 1 1 35 GLY HA2 H -5.928 0.538 4.192 1.00 . A A . 35 GLY HA2 1 1 15 9402 1 1 35 GLY HA3 H -6.250 1.685 2.900 1.00 . A A . 35 GLY HA3 1 1 15 9403 1 1 35 GLY N N -4.583 2.097 4.045 1.00 . A A . 35 GLY N 1 1 15 9404 1 1 35 GLY O O -5.147 0.161 1.275 1.00 . A A . 35 GLY O 1 1 15 9405 1 1 36 CYS C C -3.832 -2.699 1.881 1.00 . A A . 36 CYS C 1 1 15 9406 1 1 36 CYS CA C -3.022 -1.419 2.106 1.00 . A A . 36 CYS CA 1 1 15 9407 1 1 36 CYS CB C -1.690 -1.753 2.780 1.00 . A A . 36 CYS CB 1 1 15 9408 1 1 36 CYS H H -3.520 -0.375 3.872 1.00 . A A . 36 CYS H 1 1 15 9409 1 1 36 CYS HA H -2.826 -0.956 1.151 1.00 . A A . 36 CYS HA 1 1 15 9410 1 1 36 CYS HB2 H -1.860 -1.918 3.836 1.00 . A A . 36 CYS HB2 1 1 15 9411 1 1 36 CYS HB3 H -1.285 -2.654 2.337 1.00 . A A . 36 CYS HB3 1 1 15 9412 1 1 36 CYS N N -3.759 -0.473 2.925 1.00 . A A . 36 CYS N 1 1 15 9413 1 1 36 CYS O O -4.154 -3.412 2.833 1.00 . A A . 36 CYS O 1 1 15 9414 1 1 36 CYS SG S -0.441 -0.441 2.615 1.00 . A A . 36 CYS SG 1 1 15 9415 1 1 37 PRO C C -3.984 -5.438 0.262 1.00 . A A . 37 PRO C 1 1 15 9416 1 1 37 PRO CA C -4.900 -4.219 0.264 1.00 . A A . 37 PRO CA 1 1 15 9417 1 1 37 PRO CB C -5.415 -3.925 -1.143 1.00 . A A . 37 PRO CB 1 1 15 9418 1 1 37 PRO CD C -3.850 -2.191 -0.571 1.00 . A A . 37 PRO CD 1 1 15 9419 1 1 37 PRO CG C -4.423 -2.976 -1.723 1.00 . A A . 37 PRO CG 1 1 15 9420 1 1 37 PRO HA H -5.731 -4.390 0.930 1.00 . A A . 37 PRO HA 1 1 15 9421 1 1 37 PRO HB2 H -5.463 -4.842 -1.710 1.00 . A A . 37 PRO HB2 1 1 15 9422 1 1 37 PRO HB3 H -6.396 -3.479 -1.086 1.00 . A A . 37 PRO HB3 1 1 15 9423 1 1 37 PRO HD2 H -2.782 -2.083 -0.687 1.00 . A A . 37 PRO HD2 1 1 15 9424 1 1 37 PRO HD3 H -4.322 -1.221 -0.509 1.00 . A A . 37 PRO HD3 1 1 15 9425 1 1 37 PRO HG2 H -3.642 -3.529 -2.224 1.00 . A A . 37 PRO HG2 1 1 15 9426 1 1 37 PRO HG3 H -4.917 -2.313 -2.417 1.00 . A A . 37 PRO HG3 1 1 15 9427 1 1 37 PRO N N -4.168 -3.004 0.616 1.00 . A A . 37 PRO N 1 1 15 9428 1 1 37 PRO O O -4.421 -6.562 0.508 1.00 . A A . 37 PRO O 1 1 15 9429 1 1 38 ARG C C -0.778 -5.977 1.331 1.00 . A A . 38 ARG C 1 1 15 9430 1 1 38 ARG CA C -1.686 -6.234 0.140 1.00 . A A . 38 ARG CA 1 1 15 9431 1 1 38 ARG CB C -0.851 -6.288 -1.146 1.00 . A A . 38 ARG CB 1 1 15 9432 1 1 38 ARG CD C -1.315 -6.767 -3.553 1.00 . A A . 38 ARG CD 1 1 15 9433 1 1 38 ARG CG C -1.592 -5.839 -2.387 1.00 . A A . 38 ARG CG 1 1 15 9434 1 1 38 ARG CZ C -2.524 -7.678 -5.503 1.00 . A A . 38 ARG CZ 1 1 15 9435 1 1 38 ARG H H -2.402 -4.257 -0.029 1.00 . A A . 38 ARG H 1 1 15 9436 1 1 38 ARG HA H -2.193 -7.178 0.275 1.00 . A A . 38 ARG HA 1 1 15 9437 1 1 38 ARG HB2 H 0.015 -5.658 -1.028 1.00 . A A . 38 ARG HB2 1 1 15 9438 1 1 38 ARG HB3 H -0.520 -7.305 -1.299 1.00 . A A . 38 ARG HB3 1 1 15 9439 1 1 38 ARG HD2 H -0.492 -6.369 -4.125 1.00 . A A . 38 ARG HD2 1 1 15 9440 1 1 38 ARG HD3 H -1.047 -7.737 -3.164 1.00 . A A . 38 ARG HD3 1 1 15 9441 1 1 38 ARG HE H -3.278 -6.362 -4.187 1.00 . A A . 38 ARG HE 1 1 15 9442 1 1 38 ARG HG2 H -2.652 -5.839 -2.184 1.00 . A A . 38 ARG HG2 1 1 15 9443 1 1 38 ARG HG3 H -1.272 -4.842 -2.647 1.00 . A A . 38 ARG HG3 1 1 15 9444 1 1 38 ARG HH11 H -0.639 -8.396 -5.276 1.00 . A A . 38 ARG HH11 1 1 15 9445 1 1 38 ARG HH12 H -1.501 -8.991 -6.660 1.00 . A A . 38 ARG HH12 1 1 15 9446 1 1 38 ARG HH21 H -4.416 -7.146 -6.015 1.00 . A A . 38 ARG HH21 1 1 15 9447 1 1 38 ARG HH22 H -3.659 -8.312 -7.061 1.00 . A A . 38 ARG HH22 1 1 15 9448 1 1 38 ARG N N -2.693 -5.188 0.075 1.00 . A A . 38 ARG N 1 1 15 9449 1 1 38 ARG NE N -2.481 -6.902 -4.420 1.00 . A A . 38 ARG NE 1 1 15 9450 1 1 38 ARG NH1 N -1.474 -8.417 -5.838 1.00 . A A . 38 ARG NH1 1 1 15 9451 1 1 38 ARG NH2 N -3.618 -7.710 -6.254 1.00 . A A . 38 ARG NH2 1 1 15 9452 1 1 38 ARG O O 0.446 -5.992 1.205 1.00 . A A . 38 ARG O 1 1 15 9453 1 1 39 ALA C C 0.227 -6.342 4.159 1.00 . A A . 39 ALA C 1 1 15 9454 1 1 39 ALA CA C -0.651 -5.219 3.638 1.00 . A A . 39 ALA CA 1 1 15 9455 1 1 39 ALA CB C -1.590 -4.747 4.727 1.00 . A A . 39 ALA CB 1 1 15 9456 1 1 39 ALA H H -2.370 -5.548 2.460 1.00 . A A . 39 ALA H 1 1 15 9457 1 1 39 ALA HA H -0.018 -4.386 3.365 1.00 . A A . 39 ALA HA 1 1 15 9458 1 1 39 ALA HB1 H -1.017 -4.509 5.610 1.00 . A A . 39 ALA HB1 1 1 15 9459 1 1 39 ALA HB2 H -2.120 -3.869 4.391 1.00 . A A . 39 ALA HB2 1 1 15 9460 1 1 39 ALA HB3 H -2.296 -5.529 4.957 1.00 . A A . 39 ALA HB3 1 1 15 9461 1 1 39 ALA N N -1.391 -5.615 2.453 1.00 . A A . 39 ALA N 1 1 15 9462 1 1 39 ALA O O -0.240 -7.234 4.873 1.00 . A A . 39 ALA O 1 1 15 9463 1 1 40 LYS C C 2.119 -8.638 3.782 1.00 . A A . 40 LYS C 1 1 15 9464 1 1 40 LYS CA C 2.498 -7.231 4.241 1.00 . A A . 40 LYS CA 1 1 15 9465 1 1 40 LYS CB C 2.671 -7.180 5.765 1.00 . A A . 40 LYS CB 1 1 15 9466 1 1 40 LYS CD C 2.374 -4.857 6.678 1.00 . A A . 40 LYS CD 1 1 15 9467 1 1 40 LYS CE C 2.693 -3.508 6.049 1.00 . A A . 40 LYS CE 1 1 15 9468 1 1 40 LYS CG C 3.371 -5.922 6.252 1.00 . A A . 40 LYS CG 1 1 15 9469 1 1 40 LYS H H 1.777 -5.530 3.226 1.00 . A A . 40 LYS H 1 1 15 9470 1 1 40 LYS HA H 3.435 -6.962 3.777 1.00 . A A . 40 LYS HA 1 1 15 9471 1 1 40 LYS HB2 H 1.697 -7.229 6.229 1.00 . A A . 40 LYS HB2 1 1 15 9472 1 1 40 LYS HB3 H 3.253 -8.034 6.078 1.00 . A A . 40 LYS HB3 1 1 15 9473 1 1 40 LYS HD2 H 1.385 -5.162 6.371 1.00 . A A . 40 LYS HD2 1 1 15 9474 1 1 40 LYS HD3 H 2.406 -4.759 7.753 1.00 . A A . 40 LYS HD3 1 1 15 9475 1 1 40 LYS HE2 H 3.031 -2.836 6.823 1.00 . A A . 40 LYS HE2 1 1 15 9476 1 1 40 LYS HE3 H 3.481 -3.642 5.319 1.00 . A A . 40 LYS HE3 1 1 15 9477 1 1 40 LYS HG2 H 3.995 -6.174 7.097 1.00 . A A . 40 LYS HG2 1 1 15 9478 1 1 40 LYS HG3 H 3.983 -5.530 5.454 1.00 . A A . 40 LYS HG3 1 1 15 9479 1 1 40 LYS HZ1 H 0.816 -2.580 6.090 1.00 . A A . 40 LYS HZ1 1 1 15 9480 1 1 40 LYS HZ2 H 1.050 -3.609 4.769 1.00 . A A . 40 LYS HZ2 1 1 15 9481 1 1 40 LYS HZ3 H 1.800 -2.096 4.792 1.00 . A A . 40 LYS HZ3 1 1 15 9482 1 1 40 LYS N N 1.502 -6.261 3.811 1.00 . A A . 40 LYS N 1 1 15 9483 1 1 40 LYS NZ N 1.508 -2.909 5.378 1.00 . A A . 40 LYS NZ 1 1 15 9484 1 1 40 LYS O O 1.510 -8.807 2.723 1.00 . A A . 40 LYS O 1 1 15 9485 1 1 41 LYS C C 2.484 -11.894 5.477 1.00 . A A . 41 LYS C 1 1 15 9486 1 1 41 LYS CA C 2.190 -11.025 4.264 1.00 . A A . 41 LYS CA 1 1 15 9487 1 1 41 LYS CB C 3.036 -11.488 3.072 1.00 . A A . 41 LYS CB 1 1 15 9488 1 1 41 LYS CD C 2.142 -11.331 0.728 1.00 . A A . 41 LYS CD 1 1 15 9489 1 1 41 LYS CE C 0.696 -11.087 0.333 1.00 . A A . 41 LYS CE 1 1 15 9490 1 1 41 LYS CG C 2.235 -12.181 1.983 1.00 . A A . 41 LYS CG 1 1 15 9491 1 1 41 LYS H H 2.956 -9.433 5.410 1.00 . A A . 41 LYS H 1 1 15 9492 1 1 41 LYS HA H 1.142 -11.106 4.016 1.00 . A A . 41 LYS HA 1 1 15 9493 1 1 41 LYS HB2 H 3.522 -10.627 2.638 1.00 . A A . 41 LYS HB2 1 1 15 9494 1 1 41 LYS HB3 H 3.790 -12.175 3.427 1.00 . A A . 41 LYS HB3 1 1 15 9495 1 1 41 LYS HD2 H 2.620 -10.380 0.912 1.00 . A A . 41 LYS HD2 1 1 15 9496 1 1 41 LYS HD3 H 2.647 -11.841 -0.079 1.00 . A A . 41 LYS HD3 1 1 15 9497 1 1 41 LYS HE2 H 0.547 -11.439 -0.678 1.00 . A A . 41 LYS HE2 1 1 15 9498 1 1 41 LYS HE3 H 0.053 -11.641 1.003 1.00 . A A . 41 LYS HE3 1 1 15 9499 1 1 41 LYS HG2 H 2.715 -13.116 1.737 1.00 . A A . 41 LYS HG2 1 1 15 9500 1 1 41 LYS HG3 H 1.238 -12.373 2.351 1.00 . A A . 41 LYS HG3 1 1 15 9501 1 1 41 LYS HZ1 H 0.775 -9.132 -0.394 1.00 . A A . 41 LYS HZ1 1 1 15 9502 1 1 41 LYS HZ2 H 0.676 -9.236 1.298 1.00 . A A . 41 LYS HZ2 1 1 15 9503 1 1 41 LYS HZ3 H -0.700 -9.534 0.347 1.00 . A A . 41 LYS HZ3 1 1 15 9504 1 1 41 LYS N N 2.478 -9.636 4.579 1.00 . A A . 41 LYS N 1 1 15 9505 1 1 41 LYS NZ N 0.337 -9.648 0.402 1.00 . A A . 41 LYS NZ 1 1 15 9506 1 1 41 LYS O O 2.995 -11.399 6.480 1.00 . A A . 41 LYS O 1 1 15 9507 1 1 42 SER C C 4.055 -14.124 6.678 1.00 . A A . 42 SER C 1 1 15 9508 1 1 42 SER CA C 2.548 -14.131 6.423 1.00 . A A . 42 SER CA 1 1 15 9509 1 1 42 SER CB C 2.067 -15.527 6.032 1.00 . A A . 42 SER CB 1 1 15 9510 1 1 42 SER H H 1.850 -13.531 4.520 1.00 . A A . 42 SER H 1 1 15 9511 1 1 42 SER HA H 2.035 -13.814 7.321 1.00 . A A . 42 SER HA 1 1 15 9512 1 1 42 SER HB2 H 2.899 -16.100 5.650 1.00 . A A . 42 SER HB2 1 1 15 9513 1 1 42 SER HB3 H 1.655 -16.022 6.899 1.00 . A A . 42 SER HB3 1 1 15 9514 1 1 42 SER HG H 0.285 -14.998 5.395 1.00 . A A . 42 SER HG 1 1 15 9515 1 1 42 SER N N 2.226 -13.189 5.360 1.00 . A A . 42 SER N 1 1 15 9516 1 1 42 SER O O 4.506 -13.913 7.806 1.00 . A A . 42 SER O 1 1 15 9517 1 1 42 SER OG O 1.065 -15.446 5.031 1.00 . A A . 42 SER OG 1 1 15 9518 1 1 43 GLY C C 6.665 -12.715 4.975 1.00 . A A . 43 GLY C 1 1 15 9519 1 1 43 GLY CA C 6.246 -13.986 5.679 1.00 . A A . 43 GLY CA 1 1 15 9520 1 1 43 GLY H H 4.385 -14.205 4.705 1.00 . A A . 43 GLY H 1 1 15 9521 1 1 43 GLY HA2 H 6.534 -13.934 6.719 1.00 . A A . 43 GLY HA2 1 1 15 9522 1 1 43 GLY HA3 H 6.741 -14.828 5.216 1.00 . A A . 43 GLY HA3 1 1 15 9523 1 1 43 GLY N N 4.815 -14.167 5.593 1.00 . A A . 43 GLY N 1 1 15 9524 1 1 43 GLY O O 7.250 -12.761 3.892 1.00 . A A . 43 GLY O 1 1 15 9525 1 1 44 LEU C C 7.926 -9.965 4.740 1.00 . A A . 44 LEU C 1 1 15 9526 1 1 44 LEU CA C 6.444 -10.285 4.897 1.00 . A A . 44 LEU CA 1 1 15 9527 1 1 44 LEU CB C 5.757 -9.191 5.718 1.00 . A A . 44 LEU CB 1 1 15 9528 1 1 44 LEU CD1 C 6.956 -8.193 7.673 1.00 . A A . 44 LEU CD1 1 1 15 9529 1 1 44 LEU CD2 C 4.673 -9.149 7.980 1.00 . A A . 44 LEU CD2 1 1 15 9530 1 1 44 LEU CG C 5.986 -9.272 7.228 1.00 . A A . 44 LEU CG 1 1 15 9531 1 1 44 LEU H H 5.705 -11.629 6.346 1.00 . A A . 44 LEU H 1 1 15 9532 1 1 44 LEU HA H 5.993 -10.318 3.917 1.00 . A A . 44 LEU HA 1 1 15 9533 1 1 44 LEU HB2 H 6.114 -8.232 5.371 1.00 . A A . 44 LEU HB2 1 1 15 9534 1 1 44 LEU HB3 H 4.694 -9.247 5.533 1.00 . A A . 44 LEU HB3 1 1 15 9535 1 1 44 LEU HD11 H 6.809 -7.990 8.723 1.00 . A A . 44 LEU HD11 1 1 15 9536 1 1 44 LEU HD12 H 7.968 -8.532 7.508 1.00 . A A . 44 LEU HD12 1 1 15 9537 1 1 44 LEU HD13 H 6.780 -7.295 7.104 1.00 . A A . 44 LEU HD13 1 1 15 9538 1 1 44 LEU HD21 H 4.715 -9.744 8.881 1.00 . A A . 44 LEU HD21 1 1 15 9539 1 1 44 LEU HD22 H 4.504 -8.115 8.241 1.00 . A A . 44 LEU HD22 1 1 15 9540 1 1 44 LEU HD23 H 3.865 -9.498 7.354 1.00 . A A . 44 LEU HD23 1 1 15 9541 1 1 44 LEU HG H 6.421 -10.232 7.468 1.00 . A A . 44 LEU HG 1 1 15 9542 1 1 44 LEU N N 6.237 -11.584 5.526 1.00 . A A . 44 LEU N 1 1 15 9543 1 1 44 LEU O O 8.705 -10.084 5.689 1.00 . A A . 44 LEU O 1 1 15 9544 1 1 45 ARG C C 10.646 -10.306 3.383 1.00 . A A . 45 ARG C 1 1 15 9545 1 1 45 ARG CA C 9.669 -9.142 3.227 1.00 . A A . 45 ARG CA 1 1 15 9546 1 1 45 ARG CB C 10.096 -7.969 4.114 1.00 . A A . 45 ARG CB 1 1 15 9547 1 1 45 ARG CD C 11.324 -5.779 4.155 1.00 . A A . 45 ARG CD 1 1 15 9548 1 1 45 ARG CG C 10.444 -6.711 3.339 1.00 . A A . 45 ARG CG 1 1 15 9549 1 1 45 ARG CZ C 13.590 -6.667 4.585 1.00 . A A . 45 ARG CZ 1 1 15 9550 1 1 45 ARG H H 7.615 -9.472 2.829 1.00 . A A . 45 ARG H 1 1 15 9551 1 1 45 ARG HA H 9.688 -8.821 2.197 1.00 . A A . 45 ARG HA 1 1 15 9552 1 1 45 ARG HB2 H 9.290 -7.736 4.793 1.00 . A A . 45 ARG HB2 1 1 15 9553 1 1 45 ARG HB3 H 10.964 -8.265 4.686 1.00 . A A . 45 ARG HB3 1 1 15 9554 1 1 45 ARG HD2 H 11.840 -5.113 3.480 1.00 . A A . 45 ARG HD2 1 1 15 9555 1 1 45 ARG HD3 H 10.699 -5.205 4.821 1.00 . A A . 45 ARG HD3 1 1 15 9556 1 1 45 ARG HE H 12.011 -6.910 5.793 1.00 . A A . 45 ARG HE 1 1 15 9557 1 1 45 ARG HG2 H 10.969 -6.988 2.437 1.00 . A A . 45 ARG HG2 1 1 15 9558 1 1 45 ARG HG3 H 9.530 -6.195 3.081 1.00 . A A . 45 ARG HG3 1 1 15 9559 1 1 45 ARG HH11 H 13.422 -5.581 2.876 1.00 . A A . 45 ARG HH11 1 1 15 9560 1 1 45 ARG HH12 H 14.995 -6.260 3.175 1.00 . A A . 45 ARG HH12 1 1 15 9561 1 1 45 ARG HH21 H 14.072 -7.801 6.197 1.00 . A A . 45 ARG HH21 1 1 15 9562 1 1 45 ARG HH22 H 15.381 -7.469 5.097 1.00 . A A . 45 ARG HH22 1 1 15 9563 1 1 45 ARG N N 8.297 -9.542 3.535 1.00 . A A . 45 ARG N 1 1 15 9564 1 1 45 ARG NE N 12.316 -6.509 4.947 1.00 . A A . 45 ARG NE 1 1 15 9565 1 1 45 ARG NH1 N 14.038 -6.122 3.461 1.00 . A A . 45 ARG NH1 1 1 15 9566 1 1 45 ARG NH2 N 14.409 -7.375 5.348 1.00 . A A . 45 ARG NH2 1 1 15 9567 1 1 45 ARG O O 11.856 -10.105 3.503 1.00 . A A . 45 ARG O 1 1 15 9568 1 1 46 VAL C C 10.932 -13.446 2.049 1.00 . A A . 46 VAL C 1 1 15 9569 1 1 46 VAL CA C 10.969 -12.711 3.383 1.00 . A A . 46 VAL CA 1 1 15 9570 1 1 46 VAL CB C 10.520 -13.669 4.511 1.00 . A A . 46 VAL CB 1 1 15 9571 1 1 46 VAL CG1 C 11.536 -14.784 4.706 1.00 . A A . 46 VAL CG1 1 1 15 9572 1 1 46 VAL CG2 C 10.310 -12.915 5.814 1.00 . A A . 46 VAL CG2 1 1 15 9573 1 1 46 VAL H H 9.167 -11.630 3.162 1.00 . A A . 46 VAL H 1 1 15 9574 1 1 46 VAL HA H 11.982 -12.396 3.582 1.00 . A A . 46 VAL HA 1 1 15 9575 1 1 46 VAL HB H 9.580 -14.115 4.223 1.00 . A A . 46 VAL HB 1 1 15 9576 1 1 46 VAL HG11 H 12.326 -14.684 3.978 1.00 . A A . 46 VAL HG11 1 1 15 9577 1 1 46 VAL HG12 H 11.952 -14.720 5.701 1.00 . A A . 46 VAL HG12 1 1 15 9578 1 1 46 VAL HG13 H 11.050 -15.741 4.582 1.00 . A A . 46 VAL HG13 1 1 15 9579 1 1 46 VAL HG21 H 11.049 -13.230 6.535 1.00 . A A . 46 VAL HG21 1 1 15 9580 1 1 46 VAL HG22 H 10.408 -11.855 5.637 1.00 . A A . 46 VAL HG22 1 1 15 9581 1 1 46 VAL HG23 H 9.322 -13.128 6.196 1.00 . A A . 46 VAL HG23 1 1 15 9582 1 1 46 VAL N N 10.130 -11.524 3.314 1.00 . A A . 46 VAL N 1 1 15 9583 1 1 46 VAL O O 9.872 -13.414 1.386 1.00 . A A . 46 VAL O 1 1 15 9584 1 1 46 VAL OXT O 11.962 -14.031 1.653 1.00 . A A . 46 VAL OXT 1 1 15 9585 2 2 1 ZN ZN ZN -0.064 -0.250 0.354 1.00 . B A . 47 ZN ZN 1 1 16 9586 1 1 1 GLY C C 15.854 -9.121 8.060 1.00 . A A . 1 GLY C 1 1 16 9587 1 1 1 GLY CA C 17.042 -9.887 7.522 1.00 . A A . 1 GLY CA 1 1 16 9588 1 1 1 GLY H1 H 17.983 -10.648 9.220 1.00 . A A . 1 GLY H1 1 1 16 9589 1 1 1 GLY H2 H 18.268 -9.001 8.957 1.00 . A A . 1 GLY H2 1 1 16 9590 1 1 1 GLY H3 H 19.058 -10.157 8.001 1.00 . A A . 1 GLY H3 1 1 16 9591 1 1 1 GLY HA2 H 17.379 -9.414 6.610 1.00 . A A . 1 GLY HA2 1 1 16 9592 1 1 1 GLY HA3 H 16.735 -10.899 7.300 1.00 . A A . 1 GLY HA3 1 1 16 9593 1 1 1 GLY N N 18.164 -9.926 8.490 1.00 . A A . 1 GLY N 1 1 16 9594 1 1 1 GLY O O 15.934 -8.544 9.144 1.00 . A A . 1 GLY O 1 1 16 9595 1 1 2 SER C C 13.770 -6.972 8.016 1.00 . A A . 2 SER C 1 1 16 9596 1 1 2 SER CA C 13.519 -8.449 7.696 1.00 . A A . 2 SER CA 1 1 16 9597 1 1 2 SER CB C 12.872 -9.155 8.893 1.00 . A A . 2 SER CB 1 1 16 9598 1 1 2 SER H H 14.769 -9.638 6.464 1.00 . A A . 2 SER H 1 1 16 9599 1 1 2 SER HA H 12.842 -8.504 6.857 1.00 . A A . 2 SER HA 1 1 16 9600 1 1 2 SER HB2 H 13.310 -8.781 9.806 1.00 . A A . 2 SER HB2 1 1 16 9601 1 1 2 SER HB3 H 11.811 -8.957 8.896 1.00 . A A . 2 SER HB3 1 1 16 9602 1 1 2 SER HG H 12.992 -10.856 7.908 1.00 . A A . 2 SER HG 1 1 16 9603 1 1 2 SER N N 14.754 -9.133 7.308 1.00 . A A . 2 SER N 1 1 16 9604 1 1 2 SER O O 13.846 -6.579 9.181 1.00 . A A . 2 SER O 1 1 16 9605 1 1 2 SER OG O 13.077 -10.561 8.829 1.00 . A A . 2 SER OG 1 1 16 9606 1 1 3 MET C C 13.086 -3.916 6.475 1.00 . A A . 3 MET C 1 1 16 9607 1 1 3 MET CA C 14.180 -4.742 7.148 1.00 . A A . 3 MET CA 1 1 16 9608 1 1 3 MET CB C 15.556 -4.387 6.568 1.00 . A A . 3 MET CB 1 1 16 9609 1 1 3 MET CE C 17.265 -1.859 4.247 1.00 . A A . 3 MET CE 1 1 16 9610 1 1 3 MET CG C 15.775 -2.896 6.348 1.00 . A A . 3 MET CG 1 1 16 9611 1 1 3 MET H H 13.867 -6.536 6.067 1.00 . A A . 3 MET H 1 1 16 9612 1 1 3 MET HA H 14.177 -4.529 8.207 1.00 . A A . 3 MET HA 1 1 16 9613 1 1 3 MET HB2 H 16.318 -4.740 7.247 1.00 . A A . 3 MET HB2 1 1 16 9614 1 1 3 MET HB3 H 15.672 -4.890 5.619 1.00 . A A . 3 MET HB3 1 1 16 9615 1 1 3 MET HE1 H 17.339 -1.607 3.197 1.00 . A A . 3 MET HE1 1 1 16 9616 1 1 3 MET HE2 H 17.495 -0.989 4.842 1.00 . A A . 3 MET HE2 1 1 16 9617 1 1 3 MET HE3 H 17.965 -2.647 4.477 1.00 . A A . 3 MET HE3 1 1 16 9618 1 1 3 MET HG2 H 15.050 -2.348 6.932 1.00 . A A . 3 MET HG2 1 1 16 9619 1 1 3 MET HG3 H 16.769 -2.641 6.680 1.00 . A A . 3 MET HG3 1 1 16 9620 1 1 3 MET N N 13.922 -6.165 6.978 1.00 . A A . 3 MET N 1 1 16 9621 1 1 3 MET O O 12.731 -4.164 5.320 1.00 . A A . 3 MET O 1 1 16 9622 1 1 3 MET SD S 15.602 -2.415 4.616 1.00 . A A . 3 MET SD 1 1 16 9623 1 1 4 ALA C C 12.049 -0.607 6.615 1.00 . A A . 4 ALA C 1 1 16 9624 1 1 4 ALA CA C 11.545 -2.047 6.653 1.00 . A A . 4 ALA CA 1 1 16 9625 1 1 4 ALA CB C 10.272 -2.150 7.480 1.00 . A A . 4 ALA CB 1 1 16 9626 1 1 4 ALA H H 12.915 -2.761 8.097 1.00 . A A . 4 ALA H 1 1 16 9627 1 1 4 ALA HA H 11.323 -2.369 5.646 1.00 . A A . 4 ALA HA 1 1 16 9628 1 1 4 ALA HB1 H 10.224 -1.322 8.172 1.00 . A A . 4 ALA HB1 1 1 16 9629 1 1 4 ALA HB2 H 9.414 -2.122 6.824 1.00 . A A . 4 ALA HB2 1 1 16 9630 1 1 4 ALA HB3 H 10.274 -3.079 8.030 1.00 . A A . 4 ALA HB3 1 1 16 9631 1 1 4 ALA N N 12.572 -2.927 7.189 1.00 . A A . 4 ALA N 1 1 16 9632 1 1 4 ALA O O 12.069 0.088 7.634 1.00 . A A . 4 ALA O 1 1 16 9633 1 1 5 ALA C C 12.095 2.056 4.553 1.00 . A A . 5 ALA C 1 1 16 9634 1 1 5 ALA CA C 13.068 1.150 5.292 1.00 . A A . 5 ALA CA 1 1 16 9635 1 1 5 ALA CB C 14.398 1.084 4.557 1.00 . A A . 5 ALA CB 1 1 16 9636 1 1 5 ALA H H 12.506 -0.796 4.679 1.00 . A A . 5 ALA H 1 1 16 9637 1 1 5 ALA HA H 13.248 1.556 6.277 1.00 . A A . 5 ALA HA 1 1 16 9638 1 1 5 ALA HB1 H 14.220 0.909 3.506 1.00 . A A . 5 ALA HB1 1 1 16 9639 1 1 5 ALA HB2 H 14.925 2.018 4.682 1.00 . A A . 5 ALA HB2 1 1 16 9640 1 1 5 ALA HB3 H 14.992 0.277 4.960 1.00 . A A . 5 ALA HB3 1 1 16 9641 1 1 5 ALA N N 12.514 -0.185 5.451 1.00 . A A . 5 ALA N 1 1 16 9642 1 1 5 ALA O O 11.188 1.582 3.869 1.00 . A A . 5 ALA O 1 1 16 9643 1 1 6 HIS C C 12.359 5.284 3.183 1.00 . A A . 6 HIS C 1 1 16 9644 1 1 6 HIS CA C 11.475 4.341 3.994 1.00 . A A . 6 HIS CA 1 1 16 9645 1 1 6 HIS CB C 10.633 5.128 5.009 1.00 . A A . 6 HIS CB 1 1 16 9646 1 1 6 HIS CD2 C 8.938 5.870 3.178 1.00 . A A . 6 HIS CD2 1 1 16 9647 1 1 6 HIS CE1 C 7.965 7.486 4.288 1.00 . A A . 6 HIS CE1 1 1 16 9648 1 1 6 HIS CG C 9.522 5.934 4.400 1.00 . A A . 6 HIS CG 1 1 16 9649 1 1 6 HIS H H 13.058 3.667 5.221 1.00 . A A . 6 HIS H 1 1 16 9650 1 1 6 HIS HA H 10.815 3.813 3.320 1.00 . A A . 6 HIS HA 1 1 16 9651 1 1 6 HIS HB2 H 10.191 4.433 5.708 1.00 . A A . 6 HIS HB2 1 1 16 9652 1 1 6 HIS HB3 H 11.280 5.806 5.547 1.00 . A A . 6 HIS HB3 1 1 16 9653 1 1 6 HIS HD1 H 9.076 7.243 5.995 1.00 . A A . 6 HIS HD1 1 1 16 9654 1 1 6 HIS HD2 H 9.187 5.178 2.386 1.00 . A A . 6 HIS HD2 1 1 16 9655 1 1 6 HIS HE1 H 7.312 8.305 4.549 1.00 . A A . 6 HIS HE1 1 1 16 9656 1 1 6 HIS HE2 H 7.501 7.145 2.316 1.00 . A A . 6 HIS HE2 1 1 16 9657 1 1 6 HIS N N 12.303 3.357 4.676 1.00 . A A . 6 HIS N 1 1 16 9658 1 1 6 HIS ND1 N 8.886 6.957 5.069 1.00 . A A . 6 HIS ND1 1 1 16 9659 1 1 6 HIS NE2 N 7.976 6.846 3.134 1.00 . A A . 6 HIS NE2 1 1 16 9660 1 1 6 HIS O O 12.326 6.502 3.362 1.00 . A A . 6 HIS O 1 1 16 9661 1 1 7 SER C C 13.338 5.882 0.173 1.00 . A A . 7 SER C 1 1 16 9662 1 1 7 SER CA C 14.052 5.483 1.459 1.00 . A A . 7 SER CA 1 1 16 9663 1 1 7 SER CB C 15.306 4.668 1.148 1.00 . A A . 7 SER CB 1 1 16 9664 1 1 7 SER H H 13.139 3.731 2.202 1.00 . A A . 7 SER H 1 1 16 9665 1 1 7 SER HA H 14.332 6.376 1.998 1.00 . A A . 7 SER HA 1 1 16 9666 1 1 7 SER HB2 H 15.285 4.352 0.114 1.00 . A A . 7 SER HB2 1 1 16 9667 1 1 7 SER HB3 H 16.183 5.276 1.323 1.00 . A A . 7 SER HB3 1 1 16 9668 1 1 7 SER HG H 15.341 3.797 2.909 1.00 . A A . 7 SER HG 1 1 16 9669 1 1 7 SER N N 13.159 4.709 2.304 1.00 . A A . 7 SER N 1 1 16 9670 1 1 7 SER O O 13.527 6.985 -0.343 1.00 . A A . 7 SER O 1 1 16 9671 1 1 7 SER OG O 15.374 3.518 1.980 1.00 . A A . 7 SER OG 1 1 16 9672 1 1 8 ALA C C 10.254 5.816 -0.995 1.00 . A A . 8 ALA C 1 1 16 9673 1 1 8 ALA CA C 11.614 5.303 -1.434 1.00 . A A . 8 ALA CA 1 1 16 9674 1 1 8 ALA CB C 11.463 4.065 -2.301 1.00 . A A . 8 ALA CB 1 1 16 9675 1 1 8 ALA H H 12.271 4.192 0.236 1.00 . A A . 8 ALA H 1 1 16 9676 1 1 8 ALA HA H 12.109 6.068 -2.016 1.00 . A A . 8 ALA HA 1 1 16 9677 1 1 8 ALA HB1 H 12.431 3.774 -2.683 1.00 . A A . 8 ALA HB1 1 1 16 9678 1 1 8 ALA HB2 H 11.052 3.261 -1.710 1.00 . A A . 8 ALA HB2 1 1 16 9679 1 1 8 ALA HB3 H 10.800 4.281 -3.124 1.00 . A A . 8 ALA HB3 1 1 16 9680 1 1 8 ALA N N 12.436 5.018 -0.274 1.00 . A A . 8 ALA N 1 1 16 9681 1 1 8 ALA O O 9.814 5.550 0.125 1.00 . A A . 8 ALA O 1 1 16 9682 1 1 9 ASP C C 7.568 7.513 -2.821 1.00 . A A . 9 ASP C 1 1 16 9683 1 1 9 ASP CA C 8.309 7.156 -1.545 1.00 . A A . 9 ASP CA 1 1 16 9684 1 1 9 ASP CB C 8.490 8.397 -0.668 1.00 . A A . 9 ASP CB 1 1 16 9685 1 1 9 ASP CG C 7.335 8.611 0.285 1.00 . A A . 9 ASP CG 1 1 16 9686 1 1 9 ASP H H 10.023 6.771 -2.736 1.00 . A A . 9 ASP H 1 1 16 9687 1 1 9 ASP HA H 7.732 6.414 -1.007 1.00 . A A . 9 ASP HA 1 1 16 9688 1 1 9 ASP HB2 H 9.394 8.291 -0.089 1.00 . A A . 9 ASP HB2 1 1 16 9689 1 1 9 ASP HB3 H 8.576 9.267 -1.302 1.00 . A A . 9 ASP HB3 1 1 16 9690 1 1 9 ASP N N 9.606 6.575 -1.862 1.00 . A A . 9 ASP N 1 1 16 9691 1 1 9 ASP O O 6.887 8.535 -2.902 1.00 . A A . 9 ASP O 1 1 16 9692 1 1 9 ASP OD1 O 6.859 7.623 0.881 1.00 . A A . 9 ASP OD1 1 1 16 9693 1 1 9 ASP OD2 O 6.921 9.776 0.474 1.00 . A A . 9 ASP OD2 1 1 16 9694 1 1 10 LEU C C 5.522 6.255 -4.873 1.00 . A A . 10 LEU C 1 1 16 9695 1 1 10 LEU CA C 6.937 6.782 -5.050 1.00 . A A . 10 LEU CA 1 1 16 9696 1 1 10 LEU CB C 7.651 6.040 -6.188 1.00 . A A . 10 LEU CB 1 1 16 9697 1 1 10 LEU CD1 C 7.291 3.806 -7.269 1.00 . A A . 10 LEU CD1 1 1 16 9698 1 1 10 LEU CD2 C 9.181 4.128 -5.661 1.00 . A A . 10 LEU CD2 1 1 16 9699 1 1 10 LEU CG C 7.755 4.525 -6.012 1.00 . A A . 10 LEU CG 1 1 16 9700 1 1 10 LEU H H 8.176 5.804 -3.641 1.00 . A A . 10 LEU H 1 1 16 9701 1 1 10 LEU HA H 6.891 7.836 -5.282 1.00 . A A . 10 LEU HA 1 1 16 9702 1 1 10 LEU HB2 H 7.118 6.240 -7.106 1.00 . A A . 10 LEU HB2 1 1 16 9703 1 1 10 LEU HB3 H 8.650 6.440 -6.278 1.00 . A A . 10 LEU HB3 1 1 16 9704 1 1 10 LEU HD11 H 6.322 3.361 -7.093 1.00 . A A . 10 LEU HD11 1 1 16 9705 1 1 10 LEU HD12 H 7.217 4.515 -8.082 1.00 . A A . 10 LEU HD12 1 1 16 9706 1 1 10 LEU HD13 H 8.000 3.035 -7.529 1.00 . A A . 10 LEU HD13 1 1 16 9707 1 1 10 LEU HD21 H 9.227 3.063 -5.490 1.00 . A A . 10 LEU HD21 1 1 16 9708 1 1 10 LEU HD22 H 9.839 4.389 -6.476 1.00 . A A . 10 LEU HD22 1 1 16 9709 1 1 10 LEU HD23 H 9.492 4.649 -4.766 1.00 . A A . 10 LEU HD23 1 1 16 9710 1 1 10 LEU HG H 7.113 4.220 -5.198 1.00 . A A . 10 LEU HG 1 1 16 9711 1 1 10 LEU N N 7.663 6.626 -3.798 1.00 . A A . 10 LEU N 1 1 16 9712 1 1 10 LEU O O 4.567 6.768 -5.461 1.00 . A A . 10 LEU O 1 1 16 9713 1 1 11 LYS C C 4.029 4.564 -2.119 1.00 . A A . 11 LYS C 1 1 16 9714 1 1 11 LYS CA C 4.105 4.729 -3.635 1.00 . A A . 11 LYS CA 1 1 16 9715 1 1 11 LYS CB C 3.881 3.402 -4.369 1.00 . A A . 11 LYS CB 1 1 16 9716 1 1 11 LYS CD C 4.243 0.929 -4.359 1.00 . A A . 11 LYS CD 1 1 16 9717 1 1 11 LYS CE C 4.526 -0.165 -3.343 1.00 . A A . 11 LYS CE 1 1 16 9718 1 1 11 LYS CG C 4.790 2.270 -3.914 1.00 . A A . 11 LYS CG 1 1 16 9719 1 1 11 LYS H H 6.188 4.948 -3.519 1.00 . A A . 11 LYS H 1 1 16 9720 1 1 11 LYS HA H 3.346 5.432 -3.941 1.00 . A A . 11 LYS HA 1 1 16 9721 1 1 11 LYS HB2 H 2.858 3.092 -4.229 1.00 . A A . 11 LYS HB2 1 1 16 9722 1 1 11 LYS HB3 H 4.053 3.562 -5.424 1.00 . A A . 11 LYS HB3 1 1 16 9723 1 1 11 LYS HD2 H 3.176 1.017 -4.492 1.00 . A A . 11 LYS HD2 1 1 16 9724 1 1 11 LYS HD3 H 4.704 0.663 -5.299 1.00 . A A . 11 LYS HD3 1 1 16 9725 1 1 11 LYS HE2 H 3.952 -1.040 -3.609 1.00 . A A . 11 LYS HE2 1 1 16 9726 1 1 11 LYS HE3 H 5.579 -0.406 -3.380 1.00 . A A . 11 LYS HE3 1 1 16 9727 1 1 11 LYS HG2 H 5.771 2.410 -4.344 1.00 . A A . 11 LYS HG2 1 1 16 9728 1 1 11 LYS HG3 H 4.857 2.285 -2.836 1.00 . A A . 11 LYS HG3 1 1 16 9729 1 1 11 LYS HZ1 H 4.764 1.040 -1.652 1.00 . A A . 11 LYS HZ1 1 1 16 9730 1 1 11 LYS HZ2 H 4.323 -0.554 -1.303 1.00 . A A . 11 LYS HZ2 1 1 16 9731 1 1 11 LYS HZ3 H 3.167 0.530 -1.904 1.00 . A A . 11 LYS HZ3 1 1 16 9732 1 1 11 LYS N N 5.391 5.278 -3.991 1.00 . A A . 11 LYS N 1 1 16 9733 1 1 11 LYS NZ N 4.171 0.241 -1.958 1.00 . A A . 11 LYS NZ 1 1 16 9734 1 1 11 LYS O O 4.679 5.305 -1.381 1.00 . A A . 11 LYS O 1 1 16 9735 1 1 12 CYS C C 4.179 2.671 0.392 1.00 . A A . 12 CYS C 1 1 16 9736 1 1 12 CYS CA C 2.997 3.413 -0.247 1.00 . A A . 12 CYS CA 1 1 16 9737 1 1 12 CYS CB C 1.705 2.629 -0.065 1.00 . A A . 12 CYS CB 1 1 16 9738 1 1 12 CYS H H 2.697 3.118 -2.303 1.00 . A A . 12 CYS H 1 1 16 9739 1 1 12 CYS HA H 2.892 4.375 0.231 1.00 . A A . 12 CYS HA 1 1 16 9740 1 1 12 CYS HB2 H 1.629 2.303 0.961 1.00 . A A . 12 CYS HB2 1 1 16 9741 1 1 12 CYS HB3 H 0.868 3.274 -0.293 1.00 . A A . 12 CYS HB3 1 1 16 9742 1 1 12 CYS N N 3.208 3.640 -1.666 1.00 . A A . 12 CYS N 1 1 16 9743 1 1 12 CYS O O 5.084 2.199 -0.307 1.00 . A A . 12 CYS O 1 1 16 9744 1 1 12 CYS SG S 1.573 1.157 -1.125 1.00 . A A . 12 CYS SG 1 1 16 9745 1 1 13 PRO C C 5.455 0.509 2.280 1.00 . A A . 13 PRO C 1 1 16 9746 1 1 13 PRO CA C 5.326 2.022 2.488 1.00 . A A . 13 PRO CA 1 1 16 9747 1 1 13 PRO CB C 4.970 2.324 3.952 1.00 . A A . 13 PRO CB 1 1 16 9748 1 1 13 PRO CD C 3.239 3.265 2.628 1.00 . A A . 13 PRO CD 1 1 16 9749 1 1 13 PRO CG C 4.012 3.458 3.895 1.00 . A A . 13 PRO CG 1 1 16 9750 1 1 13 PRO HA H 6.266 2.492 2.244 1.00 . A A . 13 PRO HA 1 1 16 9751 1 1 13 PRO HB2 H 4.520 1.453 4.403 1.00 . A A . 13 PRO HB2 1 1 16 9752 1 1 13 PRO HB3 H 5.858 2.595 4.494 1.00 . A A . 13 PRO HB3 1 1 16 9753 1 1 13 PRO HD2 H 2.390 2.618 2.799 1.00 . A A . 13 PRO HD2 1 1 16 9754 1 1 13 PRO HD3 H 2.918 4.216 2.231 1.00 . A A . 13 PRO HD3 1 1 16 9755 1 1 13 PRO HG2 H 3.352 3.424 4.749 1.00 . A A . 13 PRO HG2 1 1 16 9756 1 1 13 PRO HG3 H 4.549 4.395 3.869 1.00 . A A . 13 PRO HG3 1 1 16 9757 1 1 13 PRO N N 4.219 2.626 1.734 1.00 . A A . 13 PRO N 1 1 16 9758 1 1 13 PRO O O 6.563 -0.027 2.303 1.00 . A A . 13 PRO O 1 1 16 9759 1 1 14 THR C C 5.000 -2.157 0.827 1.00 . A A . 14 THR C 1 1 16 9760 1 1 14 THR CA C 4.323 -1.648 2.099 1.00 . A A . 14 THR CA 1 1 16 9761 1 1 14 THR CB C 2.890 -2.195 2.172 1.00 . A A . 14 THR CB 1 1 16 9762 1 1 14 THR CG2 C 2.886 -3.687 2.483 1.00 . A A . 14 THR CG2 1 1 16 9763 1 1 14 THR H H 3.466 0.286 2.242 1.00 . A A . 14 THR H 1 1 16 9764 1 1 14 THR HA H 4.867 -2.028 2.949 1.00 . A A . 14 THR HA 1 1 16 9765 1 1 14 THR HB H 2.409 -2.038 1.216 1.00 . A A . 14 THR HB 1 1 16 9766 1 1 14 THR HG1 H 1.331 -1.151 2.810 1.00 . A A . 14 THR HG1 1 1 16 9767 1 1 14 THR HG21 H 1.950 -4.119 2.161 1.00 . A A . 14 THR HG21 1 1 16 9768 1 1 14 THR HG22 H 3.005 -3.834 3.547 1.00 . A A . 14 THR HG22 1 1 16 9769 1 1 14 THR HG23 H 3.702 -4.164 1.960 1.00 . A A . 14 THR HG23 1 1 16 9770 1 1 14 THR N N 4.325 -0.186 2.184 1.00 . A A . 14 THR N 1 1 16 9771 1 1 14 THR O O 4.596 -1.820 -0.287 1.00 . A A . 14 THR O 1 1 16 9772 1 1 14 THR OG1 O 2.170 -1.486 3.182 1.00 . A A . 14 THR OG1 1 1 16 9773 1 1 15 PRO C C 6.122 -4.516 -0.938 1.00 . A A . 15 PRO C 1 1 16 9774 1 1 15 PRO CA C 6.875 -3.464 -0.131 1.00 . A A . 15 PRO CA 1 1 16 9775 1 1 15 PRO CB C 8.094 -4.095 0.552 1.00 . A A . 15 PRO CB 1 1 16 9776 1 1 15 PRO CD C 6.678 -3.306 2.283 1.00 . A A . 15 PRO CD 1 1 16 9777 1 1 15 PRO CG C 8.115 -3.508 1.917 1.00 . A A . 15 PRO CG 1 1 16 9778 1 1 15 PRO HA H 7.200 -2.672 -0.786 1.00 . A A . 15 PRO HA 1 1 16 9779 1 1 15 PRO HB2 H 7.978 -5.168 0.586 1.00 . A A . 15 PRO HB2 1 1 16 9780 1 1 15 PRO HB3 H 8.989 -3.844 0.005 1.00 . A A . 15 PRO HB3 1 1 16 9781 1 1 15 PRO HD2 H 6.250 -4.223 2.666 1.00 . A A . 15 PRO HD2 1 1 16 9782 1 1 15 PRO HD3 H 6.573 -2.506 2.998 1.00 . A A . 15 PRO HD3 1 1 16 9783 1 1 15 PRO HG2 H 8.590 -4.191 2.603 1.00 . A A . 15 PRO HG2 1 1 16 9784 1 1 15 PRO HG3 H 8.634 -2.561 1.901 1.00 . A A . 15 PRO HG3 1 1 16 9785 1 1 15 PRO N N 6.082 -2.940 0.989 1.00 . A A . 15 PRO N 1 1 16 9786 1 1 15 PRO O O 6.314 -4.640 -2.148 1.00 . A A . 15 PRO O 1 1 16 9787 1 1 16 GLY C C 3.235 -5.799 -1.521 1.00 . A A . 16 GLY C 1 1 16 9788 1 1 16 GLY CA C 4.520 -6.326 -0.921 1.00 . A A . 16 GLY CA 1 1 16 9789 1 1 16 GLY H H 5.187 -5.166 0.707 1.00 . A A . 16 GLY H 1 1 16 9790 1 1 16 GLY HA2 H 5.126 -6.751 -1.703 1.00 . A A . 16 GLY HA2 1 1 16 9791 1 1 16 GLY HA3 H 4.280 -7.097 -0.203 1.00 . A A . 16 GLY HA3 1 1 16 9792 1 1 16 GLY N N 5.280 -5.288 -0.258 1.00 . A A . 16 GLY N 1 1 16 9793 1 1 16 GLY O O 2.425 -6.565 -2.050 1.00 . A A . 16 GLY O 1 1 16 9794 1 1 17 CYS C C 2.211 -3.197 -3.320 1.00 . A A . 17 CYS C 1 1 16 9795 1 1 17 CYS CA C 1.877 -3.835 -1.976 1.00 . A A . 17 CYS CA 1 1 16 9796 1 1 17 CYS CB C 1.389 -2.781 -0.980 1.00 . A A . 17 CYS CB 1 1 16 9797 1 1 17 CYS H H 3.742 -3.943 -1.004 1.00 . A A . 17 CYS H 1 1 16 9798 1 1 17 CYS HA H 1.107 -4.580 -2.117 1.00 . A A . 17 CYS HA 1 1 16 9799 1 1 17 CYS HB2 H 1.352 -3.222 0.003 1.00 . A A . 17 CYS HB2 1 1 16 9800 1 1 17 CYS HB3 H 2.095 -1.963 -0.968 1.00 . A A . 17 CYS HB3 1 1 16 9801 1 1 17 CYS N N 3.052 -4.491 -1.435 1.00 . A A . 17 CYS N 1 1 16 9802 1 1 17 CYS O O 3.378 -3.160 -3.727 1.00 . A A . 17 CYS O 1 1 16 9803 1 1 17 CYS SG S -0.258 -2.076 -1.318 1.00 . A A . 17 CYS SG 1 1 16 9804 1 1 18 ASP C C 0.896 -0.584 -5.234 1.00 . A A . 18 ASP C 1 1 16 9805 1 1 18 ASP CA C 1.386 -2.028 -5.283 1.00 . A A . 18 ASP CA 1 1 16 9806 1 1 18 ASP CB C 0.667 -2.801 -6.398 1.00 . A A . 18 ASP CB 1 1 16 9807 1 1 18 ASP CG C -0.744 -2.311 -6.651 1.00 . A A . 18 ASP CG 1 1 16 9808 1 1 18 ASP H H 0.295 -2.715 -3.596 1.00 . A A . 18 ASP H 1 1 16 9809 1 1 18 ASP HA H 2.445 -2.023 -5.492 1.00 . A A . 18 ASP HA 1 1 16 9810 1 1 18 ASP HB2 H 1.227 -2.697 -7.315 1.00 . A A . 18 ASP HB2 1 1 16 9811 1 1 18 ASP HB3 H 0.621 -3.846 -6.128 1.00 . A A . 18 ASP HB3 1 1 16 9812 1 1 18 ASP N N 1.195 -2.679 -3.991 1.00 . A A . 18 ASP N 1 1 16 9813 1 1 18 ASP O O 1.260 0.234 -6.076 1.00 . A A . 18 ASP O 1 1 16 9814 1 1 18 ASP OD1 O -1.586 -2.399 -5.736 1.00 . A A . 18 ASP OD1 1 1 16 9815 1 1 18 ASP OD2 O -1.018 -1.837 -7.774 1.00 . A A . 18 ASP OD2 1 1 16 9816 1 1 19 GLY C C -1.715 1.365 -4.514 1.00 . A A . 19 GLY C 1 1 16 9817 1 1 19 GLY CA C -0.308 1.113 -4.004 1.00 . A A . 19 GLY CA 1 1 16 9818 1 1 19 GLY H H -0.060 -0.935 -3.513 1.00 . A A . 19 GLY H 1 1 16 9819 1 1 19 GLY HA2 H -0.275 1.343 -2.950 1.00 . A A . 19 GLY HA2 1 1 16 9820 1 1 19 GLY HA3 H 0.372 1.771 -4.523 1.00 . A A . 19 GLY HA3 1 1 16 9821 1 1 19 GLY N N 0.137 -0.257 -4.194 1.00 . A A . 19 GLY N 1 1 16 9822 1 1 19 GLY O O -2.261 2.457 -4.330 1.00 . A A . 19 GLY O 1 1 16 9823 1 1 20 SER C C -4.656 -0.277 -4.811 1.00 . A A . 20 SER C 1 1 16 9824 1 1 20 SER CA C -3.662 0.505 -5.664 1.00 . A A . 20 SER CA 1 1 16 9825 1 1 20 SER CB C -3.707 0.034 -7.120 1.00 . A A . 20 SER CB 1 1 16 9826 1 1 20 SER H H -1.846 -0.492 -5.248 1.00 . A A . 20 SER H 1 1 16 9827 1 1 20 SER HA H -3.924 1.551 -5.627 1.00 . A A . 20 SER HA 1 1 16 9828 1 1 20 SER HB2 H -3.882 -1.031 -7.145 1.00 . A A . 20 SER HB2 1 1 16 9829 1 1 20 SER HB3 H -4.506 0.543 -7.639 1.00 . A A . 20 SER HB3 1 1 16 9830 1 1 20 SER HG H -1.897 -0.464 -7.707 1.00 . A A . 20 SER HG 1 1 16 9831 1 1 20 SER N N -2.316 0.366 -5.139 1.00 . A A . 20 SER N 1 1 16 9832 1 1 20 SER O O -4.276 -1.190 -4.077 1.00 . A A . 20 SER O 1 1 16 9833 1 1 20 SER OG O -2.480 0.314 -7.781 1.00 . A A . 20 SER OG 1 1 16 9834 1 1 21 GLY C C -6.903 -0.105 -2.623 1.00 . A A . 21 GLY C 1 1 16 9835 1 1 21 GLY CA C -6.943 -0.521 -4.077 1.00 . A A . 21 GLY CA 1 1 16 9836 1 1 21 GLY H H -6.152 0.893 -5.432 1.00 . A A . 21 GLY H 1 1 16 9837 1 1 21 GLY HA2 H -7.909 -0.267 -4.486 1.00 . A A . 21 GLY HA2 1 1 16 9838 1 1 21 GLY HA3 H -6.809 -1.592 -4.140 1.00 . A A . 21 GLY HA3 1 1 16 9839 1 1 21 GLY N N -5.916 0.128 -4.864 1.00 . A A . 21 GLY N 1 1 16 9840 1 1 21 GLY O O -6.185 0.820 -2.262 1.00 . A A . 21 GLY O 1 1 16 9841 1 1 22 HIS C C -8.110 -1.866 0.360 1.00 . A A . 22 HIS C 1 1 16 9842 1 1 22 HIS CA C -7.678 -0.592 -0.347 1.00 . A A . 22 HIS CA 1 1 16 9843 1 1 22 HIS CB C -8.641 0.542 0.048 1.00 . A A . 22 HIS CB 1 1 16 9844 1 1 22 HIS CD2 C -7.389 2.744 -0.581 1.00 . A A . 22 HIS CD2 1 1 16 9845 1 1 22 HIS CE1 C -7.453 3.700 1.383 1.00 . A A . 22 HIS CE1 1 1 16 9846 1 1 22 HIS CG C -8.008 1.889 0.264 1.00 . A A . 22 HIS CG 1 1 16 9847 1 1 22 HIS H H -8.165 -1.573 -2.160 1.00 . A A . 22 HIS H 1 1 16 9848 1 1 22 HIS HA H -6.679 -0.337 -0.029 1.00 . A A . 22 HIS HA 1 1 16 9849 1 1 22 HIS HB2 H -9.379 0.656 -0.729 1.00 . A A . 22 HIS HB2 1 1 16 9850 1 1 22 HIS HB3 H -9.143 0.266 0.964 1.00 . A A . 22 HIS HB3 1 1 16 9851 1 1 22 HIS HD1 H -8.415 2.162 2.317 1.00 . A A . 22 HIS HD1 1 1 16 9852 1 1 22 HIS HD2 H -7.201 2.580 -1.631 1.00 . A A . 22 HIS HD2 1 1 16 9853 1 1 22 HIS HE1 H -7.332 4.411 2.186 1.00 . A A . 22 HIS HE1 1 1 16 9854 1 1 22 HIS HE2 H -6.809 4.741 -0.254 1.00 . A A . 22 HIS HE2 1 1 16 9855 1 1 22 HIS N N -7.646 -0.814 -1.793 1.00 . A A . 22 HIS N 1 1 16 9856 1 1 22 HIS ND1 N -8.027 2.522 1.485 1.00 . A A . 22 HIS ND1 1 1 16 9857 1 1 22 HIS NE2 N -7.055 3.865 0.140 1.00 . A A . 22 HIS NE2 1 1 16 9858 1 1 22 HIS O O -8.832 -2.677 -0.213 1.00 . A A . 22 HIS O 1 1 16 9859 1 1 23 ILE C C -9.766 -2.986 2.639 1.00 . A A . 23 ILE C 1 1 16 9860 1 1 23 ILE CA C -8.252 -3.092 2.448 1.00 . A A . 23 ILE CA 1 1 16 9861 1 1 23 ILE CB C -7.517 -3.148 3.818 1.00 . A A . 23 ILE CB 1 1 16 9862 1 1 23 ILE CD1 C -7.087 -5.655 3.610 1.00 . A A . 23 ILE CD1 1 1 16 9863 1 1 23 ILE CG1 C -6.489 -4.281 3.818 1.00 . A A . 23 ILE CG1 1 1 16 9864 1 1 23 ILE CG2 C -8.481 -3.315 4.987 1.00 . A A . 23 ILE CG2 1 1 16 9865 1 1 23 ILE H H -7.280 -1.248 2.069 1.00 . A A . 23 ILE H 1 1 16 9866 1 1 23 ILE HA H -8.035 -4.002 1.907 1.00 . A A . 23 ILE HA 1 1 16 9867 1 1 23 ILE HB H -6.999 -2.211 3.953 1.00 . A A . 23 ILE HB 1 1 16 9868 1 1 23 ILE HD11 H -6.728 -6.324 4.379 1.00 . A A . 23 ILE HD11 1 1 16 9869 1 1 23 ILE HD12 H -8.166 -5.592 3.663 1.00 . A A . 23 ILE HD12 1 1 16 9870 1 1 23 ILE HD13 H -6.798 -6.031 2.640 1.00 . A A . 23 ILE HD13 1 1 16 9871 1 1 23 ILE HG12 H -5.775 -4.110 3.027 1.00 . A A . 23 ILE HG12 1 1 16 9872 1 1 23 ILE HG13 H -5.971 -4.285 4.767 1.00 . A A . 23 ILE HG13 1 1 16 9873 1 1 23 ILE HG21 H -7.920 -3.475 5.894 1.00 . A A . 23 ILE HG21 1 1 16 9874 1 1 23 ILE HG22 H -9.082 -2.424 5.087 1.00 . A A . 23 ILE HG22 1 1 16 9875 1 1 23 ILE HG23 H -9.123 -4.164 4.805 1.00 . A A . 23 ILE HG23 1 1 16 9876 1 1 23 ILE N N -7.782 -1.974 1.639 1.00 . A A . 23 ILE N 1 1 16 9877 1 1 23 ILE O O -10.474 -3.992 2.696 1.00 . A A . 23 ILE O 1 1 16 9878 1 1 24 THR C C -12.381 -1.681 1.393 1.00 . A A . 24 THR C 1 1 16 9879 1 1 24 THR CA C -11.685 -1.490 2.746 1.00 . A A . 24 THR CA 1 1 16 9880 1 1 24 THR CB C -11.943 -0.060 3.276 1.00 . A A . 24 THR CB 1 1 16 9881 1 1 24 THR CG2 C -11.768 0.974 2.175 1.00 . A A . 24 THR CG2 1 1 16 9882 1 1 24 THR H H -9.640 -0.997 2.557 1.00 . A A . 24 THR H 1 1 16 9883 1 1 24 THR HA H -12.100 -2.191 3.453 1.00 . A A . 24 THR HA 1 1 16 9884 1 1 24 THR HB H -11.223 0.153 4.055 1.00 . A A . 24 THR HB 1 1 16 9885 1 1 24 THR HG1 H -13.527 -0.826 4.179 1.00 . A A . 24 THR HG1 1 1 16 9886 1 1 24 THR HG21 H -11.358 1.881 2.593 1.00 . A A . 24 THR HG21 1 1 16 9887 1 1 24 THR HG22 H -12.727 1.185 1.724 1.00 . A A . 24 THR HG22 1 1 16 9888 1 1 24 THR HG23 H -11.094 0.587 1.425 1.00 . A A . 24 THR HG23 1 1 16 9889 1 1 24 THR N N -10.258 -1.754 2.639 1.00 . A A . 24 THR N 1 1 16 9890 1 1 24 THR O O -13.608 -1.764 1.323 1.00 . A A . 24 THR O 1 1 16 9891 1 1 24 THR OG1 O -13.262 0.040 3.824 1.00 . A A . 24 THR OG1 1 1 16 9892 1 1 25 GLY C C -13.030 -0.951 -1.507 1.00 . A A . 25 GLY C 1 1 16 9893 1 1 25 GLY CA C -12.121 -2.059 -0.998 1.00 . A A . 25 GLY CA 1 1 16 9894 1 1 25 GLY H H -10.612 -1.814 0.466 1.00 . A A . 25 GLY H 1 1 16 9895 1 1 25 GLY HA2 H -11.298 -2.174 -1.688 1.00 . A A . 25 GLY HA2 1 1 16 9896 1 1 25 GLY HA3 H -12.681 -2.982 -0.971 1.00 . A A . 25 GLY HA3 1 1 16 9897 1 1 25 GLY N N -11.582 -1.806 0.331 1.00 . A A . 25 GLY N 1 1 16 9898 1 1 25 GLY O O -13.869 -1.178 -2.376 1.00 . A A . 25 GLY O 1 1 16 9899 1 1 26 ASN C C -13.130 2.416 -2.036 1.00 . A A . 26 ASN C 1 1 16 9900 1 1 26 ASN CA C -13.830 1.325 -1.239 1.00 . A A . 26 ASN CA 1 1 16 9901 1 1 26 ASN CB C -14.411 1.927 0.044 1.00 . A A . 26 ASN CB 1 1 16 9902 1 1 26 ASN CG C -15.667 1.218 0.507 1.00 . A A . 26 ASN CG 1 1 16 9903 1 1 26 ASN H H -12.295 0.330 -0.169 1.00 . A A . 26 ASN H 1 1 16 9904 1 1 26 ASN HA H -14.636 0.922 -1.831 1.00 . A A . 26 ASN HA 1 1 16 9905 1 1 26 ASN HB2 H -13.672 1.859 0.831 1.00 . A A . 26 ASN HB2 1 1 16 9906 1 1 26 ASN HB3 H -14.648 2.966 -0.129 1.00 . A A . 26 ASN HB3 1 1 16 9907 1 1 26 ASN HD21 H -15.293 1.738 2.387 1.00 . A A . 26 ASN HD21 1 1 16 9908 1 1 26 ASN HD22 H -16.727 0.801 2.131 1.00 . A A . 26 ASN HD22 1 1 16 9909 1 1 26 ASN N N -12.922 0.228 -0.912 1.00 . A A . 26 ASN N 1 1 16 9910 1 1 26 ASN ND2 N -15.922 1.258 1.803 1.00 . A A . 26 ASN ND2 1 1 16 9911 1 1 26 ASN O O -13.710 3.471 -2.299 1.00 . A A . 26 ASN O 1 1 16 9912 1 1 26 ASN OD1 O -16.396 0.631 -0.292 1.00 . A A . 26 ASN OD1 1 1 16 9913 1 1 27 TYR C C -10.308 2.595 -4.200 1.00 . A A . 27 TYR C 1 1 16 9914 1 1 27 TYR CA C -11.066 3.207 -3.032 1.00 . A A . 27 TYR CA 1 1 16 9915 1 1 27 TYR CB C -10.073 3.844 -2.065 1.00 . A A . 27 TYR CB 1 1 16 9916 1 1 27 TYR CD1 C -11.107 3.933 0.235 1.00 . A A . 27 TYR CD1 1 1 16 9917 1 1 27 TYR CD2 C -10.924 5.967 -0.995 1.00 . A A . 27 TYR CD2 1 1 16 9918 1 1 27 TYR CE1 C -11.696 4.611 1.280 1.00 . A A . 27 TYR CE1 1 1 16 9919 1 1 27 TYR CE2 C -11.511 6.655 0.049 1.00 . A A . 27 TYR CE2 1 1 16 9920 1 1 27 TYR CG C -10.716 4.596 -0.922 1.00 . A A . 27 TYR CG 1 1 16 9921 1 1 27 TYR CZ C -11.893 5.972 1.185 1.00 . A A . 27 TYR CZ 1 1 16 9922 1 1 27 TYR H H -11.429 1.370 -2.080 1.00 . A A . 27 TYR H 1 1 16 9923 1 1 27 TYR HA H -11.734 3.967 -3.406 1.00 . A A . 27 TYR HA 1 1 16 9924 1 1 27 TYR HB2 H -9.450 3.070 -1.644 1.00 . A A . 27 TYR HB2 1 1 16 9925 1 1 27 TYR HB3 H -9.453 4.530 -2.610 1.00 . A A . 27 TYR HB3 1 1 16 9926 1 1 27 TYR HD1 H -10.950 2.866 0.308 1.00 . A A . 27 TYR HD1 1 1 16 9927 1 1 27 TYR HD2 H -10.625 6.495 -1.886 1.00 . A A . 27 TYR HD2 1 1 16 9928 1 1 27 TYR HE1 H -11.997 4.077 2.167 1.00 . A A . 27 TYR HE1 1 1 16 9929 1 1 27 TYR HE2 H -11.667 7.721 -0.026 1.00 . A A . 27 TYR HE2 1 1 16 9930 1 1 27 TYR HH H -13.258 6.162 2.531 1.00 . A A . 27 TYR HH 1 1 16 9931 1 1 27 TYR N N -11.857 2.204 -2.345 1.00 . A A . 27 TYR N 1 1 16 9932 1 1 27 TYR O O -10.006 1.399 -4.192 1.00 . A A . 27 TYR O 1 1 16 9933 1 1 27 TYR OH O -12.475 6.650 2.229 1.00 . A A . 27 TYR OH 1 1 16 9934 1 1 28 ALA C C -7.779 2.790 -6.078 1.00 . A A . 28 ALA C 1 1 16 9935 1 1 28 ALA CA C -9.266 2.976 -6.365 1.00 . A A . 28 ALA CA 1 1 16 9936 1 1 28 ALA CB C -9.466 3.961 -7.505 1.00 . A A . 28 ALA CB 1 1 16 9937 1 1 28 ALA H H -10.259 4.369 -5.116 1.00 . A A . 28 ALA H 1 1 16 9938 1 1 28 ALA HA H -9.684 2.026 -6.668 1.00 . A A . 28 ALA HA 1 1 16 9939 1 1 28 ALA HB1 H -10.305 4.604 -7.283 1.00 . A A . 28 ALA HB1 1 1 16 9940 1 1 28 ALA HB2 H -8.576 4.560 -7.620 1.00 . A A . 28 ALA HB2 1 1 16 9941 1 1 28 ALA HB3 H -9.659 3.421 -8.419 1.00 . A A . 28 ALA HB3 1 1 16 9942 1 1 28 ALA N N -9.988 3.423 -5.182 1.00 . A A . 28 ALA N 1 1 16 9943 1 1 28 ALA O O -7.157 1.854 -6.581 1.00 . A A . 28 ALA O 1 1 16 9944 1 1 29 SER C C -5.471 4.364 -3.673 1.00 . A A . 29 SER C 1 1 16 9945 1 1 29 SER CA C -5.779 3.619 -4.968 1.00 . A A . 29 SER CA 1 1 16 9946 1 1 29 SER CB C -4.945 4.211 -6.112 1.00 . A A . 29 SER CB 1 1 16 9947 1 1 29 SER H H -7.739 4.420 -4.917 1.00 . A A . 29 SER H 1 1 16 9948 1 1 29 SER HA H -5.516 2.581 -4.842 1.00 . A A . 29 SER HA 1 1 16 9949 1 1 29 SER HB2 H -4.253 4.935 -5.709 1.00 . A A . 29 SER HB2 1 1 16 9950 1 1 29 SER HB3 H -4.390 3.419 -6.594 1.00 . A A . 29 SER HB3 1 1 16 9951 1 1 29 SER HG H -5.772 4.317 -7.896 1.00 . A A . 29 SER HG 1 1 16 9952 1 1 29 SER N N -7.202 3.686 -5.286 1.00 . A A . 29 SER N 1 1 16 9953 1 1 29 SER O O -6.330 5.057 -3.124 1.00 . A A . 29 SER O 1 1 16 9954 1 1 29 SER OG O -5.762 4.853 -7.082 1.00 . A A . 29 SER OG 1 1 16 9955 1 1 30 HIS C C -2.320 5.317 -2.150 1.00 . A A . 30 HIS C 1 1 16 9956 1 1 30 HIS CA C -3.781 4.904 -1.994 1.00 . A A . 30 HIS CA 1 1 16 9957 1 1 30 HIS CB C -3.947 4.006 -0.766 1.00 . A A . 30 HIS CB 1 1 16 9958 1 1 30 HIS CD2 C -2.043 2.301 -0.410 1.00 . A A . 30 HIS CD2 1 1 16 9959 1 1 30 HIS CE1 C -2.880 0.593 -1.444 1.00 . A A . 30 HIS CE1 1 1 16 9960 1 1 30 HIS CG C -3.255 2.684 -0.876 1.00 . A A . 30 HIS CG 1 1 16 9961 1 1 30 HIS H H -3.603 3.651 -3.686 1.00 . A A . 30 HIS H 1 1 16 9962 1 1 30 HIS HA H -4.381 5.792 -1.867 1.00 . A A . 30 HIS HA 1 1 16 9963 1 1 30 HIS HB2 H -3.542 4.516 0.091 1.00 . A A . 30 HIS HB2 1 1 16 9964 1 1 30 HIS HB3 H -4.999 3.822 -0.603 1.00 . A A . 30 HIS HB3 1 1 16 9965 1 1 30 HIS HD1 H -4.660 1.527 -1.962 1.00 . A A . 30 HIS HD1 1 1 16 9966 1 1 30 HIS HD2 H -1.356 2.908 0.164 1.00 . A A . 30 HIS HD2 1 1 16 9967 1 1 30 HIS HE1 H -3.009 -0.392 -1.865 1.00 . A A . 30 HIS HE1 1 1 16 9968 1 1 30 HIS N N -4.239 4.221 -3.198 1.00 . A A . 30 HIS N 1 1 16 9969 1 1 30 HIS ND1 N -3.776 1.585 -1.531 1.00 . A A . 30 HIS ND1 1 1 16 9970 1 1 30 HIS NE2 N -1.830 0.988 -0.779 1.00 . A A . 30 HIS NE2 1 1 16 9971 1 1 30 HIS O O -1.762 5.239 -3.248 1.00 . A A . 30 HIS O 1 1 16 9972 1 1 31 ARG C C 0.394 5.911 0.209 1.00 . A A . 31 ARG C 1 1 16 9973 1 1 31 ARG CA C -0.322 6.211 -1.098 1.00 . A A . 31 ARG CA 1 1 16 9974 1 1 31 ARG CB C -0.255 7.709 -1.375 1.00 . A A . 31 ARG CB 1 1 16 9975 1 1 31 ARG CD C 1.517 7.588 -3.142 1.00 . A A . 31 ARG CD 1 1 16 9976 1 1 31 ARG CG C 0.103 8.031 -2.808 1.00 . A A . 31 ARG CG 1 1 16 9977 1 1 31 ARG CZ C 2.809 9.618 -3.682 1.00 . A A . 31 ARG CZ 1 1 16 9978 1 1 31 ARG H H -2.211 5.833 -0.219 1.00 . A A . 31 ARG H 1 1 16 9979 1 1 31 ARG HA H 0.173 5.685 -1.897 1.00 . A A . 31 ARG HA 1 1 16 9980 1 1 31 ARG HB2 H -1.216 8.152 -1.156 1.00 . A A . 31 ARG HB2 1 1 16 9981 1 1 31 ARG HB3 H 0.492 8.150 -0.728 1.00 . A A . 31 ARG HB3 1 1 16 9982 1 1 31 ARG HD2 H 1.752 6.707 -2.561 1.00 . A A . 31 ARG HD2 1 1 16 9983 1 1 31 ARG HD3 H 1.564 7.348 -4.193 1.00 . A A . 31 ARG HD3 1 1 16 9984 1 1 31 ARG HE H 2.944 8.592 -1.963 1.00 . A A . 31 ARG HE 1 1 16 9985 1 1 31 ARG HG2 H -0.588 7.519 -3.461 1.00 . A A . 31 ARG HG2 1 1 16 9986 1 1 31 ARG HG3 H 0.023 9.096 -2.956 1.00 . A A . 31 ARG HG3 1 1 16 9987 1 1 31 ARG HH11 H 1.541 9.006 -5.150 1.00 . A A . 31 ARG HH11 1 1 16 9988 1 1 31 ARG HH12 H 2.448 10.451 -5.503 1.00 . A A . 31 ARG HH12 1 1 16 9989 1 1 31 ARG HH21 H 4.146 10.464 -2.415 1.00 . A A . 31 ARG HH21 1 1 16 9990 1 1 31 ARG HH22 H 3.944 11.286 -3.941 1.00 . A A . 31 ARG HH22 1 1 16 9991 1 1 31 ARG N N -1.709 5.769 -1.060 1.00 . A A . 31 ARG N 1 1 16 9992 1 1 31 ARG NE N 2.498 8.629 -2.845 1.00 . A A . 31 ARG NE 1 1 16 9993 1 1 31 ARG NH1 N 2.222 9.697 -4.872 1.00 . A A . 31 ARG NH1 1 1 16 9994 1 1 31 ARG NH2 N 3.702 10.525 -3.319 1.00 . A A . 31 ARG NH2 1 1 16 9995 1 1 31 ARG O O 1.603 6.118 0.325 1.00 . A A . 31 ARG O 1 1 16 9996 1 1 32 SER C C -0.304 3.949 3.102 1.00 . A A . 32 SER C 1 1 16 9997 1 1 32 SER CA C 0.188 5.278 2.537 1.00 . A A . 32 SER CA 1 1 16 9998 1 1 32 SER CB C -0.211 6.431 3.464 1.00 . A A . 32 SER CB 1 1 16 9999 1 1 32 SER H H -1.334 5.438 1.080 1.00 . A A . 32 SER H 1 1 16 10000 1 1 32 SER HA H 1.264 5.247 2.450 1.00 . A A . 32 SER HA 1 1 16 10001 1 1 32 SER HB2 H -0.887 6.063 4.222 1.00 . A A . 32 SER HB2 1 1 16 10002 1 1 32 SER HB3 H 0.673 6.833 3.937 1.00 . A A . 32 SER HB3 1 1 16 10003 1 1 32 SER HG H -1.623 7.109 2.271 1.00 . A A . 32 SER HG 1 1 16 10004 1 1 32 SER N N -0.365 5.513 1.213 1.00 . A A . 32 SER N 1 1 16 10005 1 1 32 SER O O -1.185 3.312 2.521 1.00 . A A . 32 SER O 1 1 16 10006 1 1 32 SER OG O -0.855 7.473 2.740 1.00 . A A . 32 SER OG 1 1 16 10007 1 1 33 LEU C C -1.514 2.434 5.599 1.00 . A A . 33 LEU C 1 1 16 10008 1 1 33 LEU CA C -0.155 2.305 4.911 1.00 . A A . 33 LEU CA 1 1 16 10009 1 1 33 LEU CB C 0.893 1.919 5.948 1.00 . A A . 33 LEU CB 1 1 16 10010 1 1 33 LEU CD1 C 2.985 0.648 6.441 1.00 . A A . 33 LEU CD1 1 1 16 10011 1 1 33 LEU CD2 C 0.903 -0.573 5.791 1.00 . A A . 33 LEU CD2 1 1 16 10012 1 1 33 LEU CG C 1.723 0.693 5.597 1.00 . A A . 33 LEU CG 1 1 16 10013 1 1 33 LEU H H 0.950 4.090 4.664 1.00 . A A . 33 LEU H 1 1 16 10014 1 1 33 LEU HA H -0.210 1.537 4.157 1.00 . A A . 33 LEU HA 1 1 16 10015 1 1 33 LEU HB2 H 1.560 2.756 6.083 1.00 . A A . 33 LEU HB2 1 1 16 10016 1 1 33 LEU HB3 H 0.387 1.728 6.883 1.00 . A A . 33 LEU HB3 1 1 16 10017 1 1 33 LEU HD11 H 3.609 1.496 6.201 1.00 . A A . 33 LEU HD11 1 1 16 10018 1 1 33 LEU HD12 H 2.720 0.682 7.487 1.00 . A A . 33 LEU HD12 1 1 16 10019 1 1 33 LEU HD13 H 3.525 -0.265 6.236 1.00 . A A . 33 LEU HD13 1 1 16 10020 1 1 33 LEU HD21 H -0.116 -0.308 6.029 1.00 . A A . 33 LEU HD21 1 1 16 10021 1 1 33 LEU HD22 H 0.921 -1.155 4.880 1.00 . A A . 33 LEU HD22 1 1 16 10022 1 1 33 LEU HD23 H 1.324 -1.154 6.598 1.00 . A A . 33 LEU HD23 1 1 16 10023 1 1 33 LEU HG H 2.011 0.755 4.559 1.00 . A A . 33 LEU HG 1 1 16 10024 1 1 33 LEU N N 0.231 3.555 4.262 1.00 . A A . 33 LEU N 1 1 16 10025 1 1 33 LEU O O -1.838 1.684 6.521 1.00 . A A . 33 LEU O 1 1 16 10026 1 1 34 SER C C -4.657 2.739 4.990 1.00 . A A . 34 SER C 1 1 16 10027 1 1 34 SER CA C -3.624 3.627 5.673 1.00 . A A . 34 SER CA 1 1 16 10028 1 1 34 SER CB C -3.983 5.094 5.468 1.00 . A A . 34 SER CB 1 1 16 10029 1 1 34 SER H H -1.983 3.951 4.403 1.00 . A A . 34 SER H 1 1 16 10030 1 1 34 SER HA H -3.606 3.407 6.730 1.00 . A A . 34 SER HA 1 1 16 10031 1 1 34 SER HB2 H -4.664 5.178 4.635 1.00 . A A . 34 SER HB2 1 1 16 10032 1 1 34 SER HB3 H -4.452 5.480 6.361 1.00 . A A . 34 SER HB3 1 1 16 10033 1 1 34 SER HG H -2.488 6.252 6.007 1.00 . A A . 34 SER HG 1 1 16 10034 1 1 34 SER N N -2.302 3.386 5.135 1.00 . A A . 34 SER N 1 1 16 10035 1 1 34 SER O O -5.778 2.586 5.478 1.00 . A A . 34 SER O 1 1 16 10036 1 1 34 SER OG O -2.822 5.863 5.188 1.00 . A A . 34 SER OG 1 1 16 10037 1 1 35 GLY C C -4.592 0.365 2.189 1.00 . A A . 35 GLY C 1 1 16 10038 1 1 35 GLY CA C -5.245 1.397 3.081 1.00 . A A . 35 GLY CA 1 1 16 10039 1 1 35 GLY H H -3.408 2.380 3.463 1.00 . A A . 35 GLY H 1 1 16 10040 1 1 35 GLY HA2 H -5.896 0.889 3.774 1.00 . A A . 35 GLY HA2 1 1 16 10041 1 1 35 GLY HA3 H -5.842 2.055 2.466 1.00 . A A . 35 GLY HA3 1 1 16 10042 1 1 35 GLY N N -4.300 2.197 3.830 1.00 . A A . 35 GLY N 1 1 16 10043 1 1 35 GLY O O -5.164 -0.015 1.167 1.00 . A A . 35 GLY O 1 1 16 10044 1 1 36 CYS C C -3.540 -2.478 1.896 1.00 . A A . 36 CYS C 1 1 16 10045 1 1 36 CYS CA C -2.738 -1.174 1.858 1.00 . A A . 36 CYS CA 1 1 16 10046 1 1 36 CYS CB C -1.346 -1.412 2.454 1.00 . A A . 36 CYS CB 1 1 16 10047 1 1 36 CYS H H -3.046 0.196 3.441 1.00 . A A . 36 CYS H 1 1 16 10048 1 1 36 CYS HA H -2.635 -0.850 0.833 1.00 . A A . 36 CYS HA 1 1 16 10049 1 1 36 CYS HB2 H -1.414 -1.372 3.531 1.00 . A A . 36 CYS HB2 1 1 16 10050 1 1 36 CYS HB3 H -1.003 -2.394 2.159 1.00 . A A . 36 CYS HB3 1 1 16 10051 1 1 36 CYS N N -3.428 -0.123 2.597 1.00 . A A . 36 CYS N 1 1 16 10052 1 1 36 CYS O O -3.665 -3.106 2.947 1.00 . A A . 36 CYS O 1 1 16 10053 1 1 36 CYS SG S -0.083 -0.203 1.939 1.00 . A A . 36 CYS SG 1 1 16 10054 1 1 37 PRO C C -3.848 -5.381 0.682 1.00 . A A . 37 PRO C 1 1 16 10055 1 1 37 PRO CA C -4.792 -4.191 0.657 1.00 . A A . 37 PRO CA 1 1 16 10056 1 1 37 PRO CB C -5.504 -4.092 -0.689 1.00 . A A . 37 PRO CB 1 1 16 10057 1 1 37 PRO CD C -3.925 -2.285 -0.573 1.00 . A A . 37 PRO CD 1 1 16 10058 1 1 37 PRO CG C -4.618 -3.232 -1.520 1.00 . A A . 37 PRO CG 1 1 16 10059 1 1 37 PRO HA H -5.517 -4.283 1.453 1.00 . A A . 37 PRO HA 1 1 16 10060 1 1 37 PRO HB2 H -5.609 -5.080 -1.115 1.00 . A A . 37 PRO HB2 1 1 16 10061 1 1 37 PRO HB3 H -6.477 -3.645 -0.555 1.00 . A A . 37 PRO HB3 1 1 16 10062 1 1 37 PRO HD2 H -2.886 -2.177 -0.844 1.00 . A A . 37 PRO HD2 1 1 16 10063 1 1 37 PRO HD3 H -4.418 -1.325 -0.577 1.00 . A A . 37 PRO HD3 1 1 16 10064 1 1 37 PRO HG2 H -3.892 -3.843 -2.033 1.00 . A A . 37 PRO HG2 1 1 16 10065 1 1 37 PRO HG3 H -5.212 -2.677 -2.234 1.00 . A A . 37 PRO HG3 1 1 16 10066 1 1 37 PRO N N -4.056 -2.933 0.742 1.00 . A A . 37 PRO N 1 1 16 10067 1 1 37 PRO O O -4.269 -6.527 0.828 1.00 . A A . 37 PRO O 1 1 16 10068 1 1 38 ARG C C -0.743 -5.955 1.959 1.00 . A A . 38 ARG C 1 1 16 10069 1 1 38 ARG CA C -1.524 -6.097 0.663 1.00 . A A . 38 ARG CA 1 1 16 10070 1 1 38 ARG CB C -0.580 -5.976 -0.534 1.00 . A A . 38 ARG CB 1 1 16 10071 1 1 38 ARG CD C -0.766 -6.510 -2.968 1.00 . A A . 38 ARG CD 1 1 16 10072 1 1 38 ARG CG C -1.283 -5.648 -1.836 1.00 . A A . 38 ARG CG 1 1 16 10073 1 1 38 ARG CZ C -1.837 -6.995 -5.136 1.00 . A A . 38 ARG CZ 1 1 16 10074 1 1 38 ARG H H -2.294 -4.139 0.542 1.00 . A A . 38 ARG H 1 1 16 10075 1 1 38 ARG HA H -2.001 -7.065 0.644 1.00 . A A . 38 ARG HA 1 1 16 10076 1 1 38 ARG HB2 H 0.137 -5.194 -0.335 1.00 . A A . 38 ARG HB2 1 1 16 10077 1 1 38 ARG HB3 H -0.054 -6.910 -0.656 1.00 . A A . 38 ARG HB3 1 1 16 10078 1 1 38 ARG HD2 H -0.093 -5.921 -3.572 1.00 . A A . 38 ARG HD2 1 1 16 10079 1 1 38 ARG HD3 H -0.232 -7.349 -2.547 1.00 . A A . 38 ARG HD3 1 1 16 10080 1 1 38 ARG HE H -2.645 -7.365 -3.343 1.00 . A A . 38 ARG HE 1 1 16 10081 1 1 38 ARG HG2 H -2.342 -5.821 -1.715 1.00 . A A . 38 ARG HG2 1 1 16 10082 1 1 38 ARG HG3 H -1.110 -4.609 -2.076 1.00 . A A . 38 ARG HG3 1 1 16 10083 1 1 38 ARG HH11 H 0.027 -6.199 -5.284 1.00 . A A . 38 ARG HH11 1 1 16 10084 1 1 38 ARG HH12 H -0.773 -6.509 -6.797 1.00 . A A . 38 ARG HH12 1 1 16 10085 1 1 38 ARG HH21 H -3.682 -7.808 -5.319 1.00 . A A . 38 ARG HH21 1 1 16 10086 1 1 38 ARG HH22 H -2.875 -7.451 -6.820 1.00 . A A . 38 ARG HH22 1 1 16 10087 1 1 38 ARG N N -2.559 -5.083 0.601 1.00 . A A . 38 ARG N 1 1 16 10088 1 1 38 ARG NE N -1.852 -7.007 -3.805 1.00 . A A . 38 ARG NE 1 1 16 10089 1 1 38 ARG NH1 N -0.776 -6.535 -5.790 1.00 . A A . 38 ARG NH1 1 1 16 10090 1 1 38 ARG NH2 N -2.882 -7.453 -5.811 1.00 . A A . 38 ARG NH2 1 1 16 10091 1 1 38 ARG O O 0.478 -6.120 1.985 1.00 . A A . 38 ARG O 1 1 16 10092 1 1 39 ALA C C -0.102 -6.706 4.747 1.00 . A A . 39 ALA C 1 1 16 10093 1 1 39 ALA CA C -0.858 -5.448 4.339 1.00 . A A . 39 ALA CA 1 1 16 10094 1 1 39 ALA CB C -1.928 -5.113 5.364 1.00 . A A . 39 ALA CB 1 1 16 10095 1 1 39 ALA H H -2.421 -5.480 2.923 1.00 . A A . 39 ALA H 1 1 16 10096 1 1 39 ALA HA H -0.165 -4.622 4.287 1.00 . A A . 39 ALA HA 1 1 16 10097 1 1 39 ALA HB1 H -2.702 -4.521 4.897 1.00 . A A . 39 ALA HB1 1 1 16 10098 1 1 39 ALA HB2 H -2.357 -6.027 5.748 1.00 . A A . 39 ALA HB2 1 1 16 10099 1 1 39 ALA HB3 H -1.487 -4.553 6.176 1.00 . A A . 39 ALA HB3 1 1 16 10100 1 1 39 ALA N N -1.459 -5.619 3.025 1.00 . A A . 39 ALA N 1 1 16 10101 1 1 39 ALA O O -0.619 -7.816 4.620 1.00 . A A . 39 ALA O 1 1 16 10102 1 1 40 LYS C C 1.751 -8.341 6.721 1.00 . A A . 40 LYS C 1 1 16 10103 1 1 40 LYS CA C 2.055 -7.667 5.377 1.00 . A A . 40 LYS CA 1 1 16 10104 1 1 40 LYS CB C 3.520 -7.224 5.337 1.00 . A A . 40 LYS CB 1 1 16 10105 1 1 40 LYS CD C 5.152 -5.355 5.710 1.00 . A A . 40 LYS CD 1 1 16 10106 1 1 40 LYS CE C 5.945 -4.927 6.931 1.00 . A A . 40 LYS CE 1 1 16 10107 1 1 40 LYS CG C 3.806 -5.938 6.098 1.00 . A A . 40 LYS CG 1 1 16 10108 1 1 40 LYS H H 1.548 -5.638 5.047 1.00 . A A . 40 LYS H 1 1 16 10109 1 1 40 LYS HA H 1.900 -8.394 4.593 1.00 . A A . 40 LYS HA 1 1 16 10110 1 1 40 LYS HB2 H 4.128 -8.007 5.765 1.00 . A A . 40 LYS HB2 1 1 16 10111 1 1 40 LYS HB3 H 3.811 -7.079 4.306 1.00 . A A . 40 LYS HB3 1 1 16 10112 1 1 40 LYS HD2 H 5.716 -6.102 5.171 1.00 . A A . 40 LYS HD2 1 1 16 10113 1 1 40 LYS HD3 H 4.991 -4.496 5.076 1.00 . A A . 40 LYS HD3 1 1 16 10114 1 1 40 LYS HE2 H 5.887 -5.709 7.674 1.00 . A A . 40 LYS HE2 1 1 16 10115 1 1 40 LYS HE3 H 6.973 -4.784 6.641 1.00 . A A . 40 LYS HE3 1 1 16 10116 1 1 40 LYS HG2 H 3.038 -5.217 5.873 1.00 . A A . 40 LYS HG2 1 1 16 10117 1 1 40 LYS HG3 H 3.807 -6.150 7.158 1.00 . A A . 40 LYS HG3 1 1 16 10118 1 1 40 LYS HZ1 H 6.202 -3.154 8.005 1.00 . A A . 40 LYS HZ1 1 1 16 10119 1 1 40 LYS HZ2 H 4.680 -3.869 8.207 1.00 . A A . 40 LYS HZ2 1 1 16 10120 1 1 40 LYS HZ3 H 5.040 -3.048 6.768 1.00 . A A . 40 LYS HZ3 1 1 16 10121 1 1 40 LYS N N 1.167 -6.536 5.099 1.00 . A A . 40 LYS N 1 1 16 10122 1 1 40 LYS NZ N 5.430 -3.663 7.517 1.00 . A A . 40 LYS NZ 1 1 16 10123 1 1 40 LYS O O 2.667 -8.652 7.484 1.00 . A A . 40 LYS O 1 1 16 10124 1 1 41 LYS C C 0.537 -8.896 9.403 1.00 . A A . 41 LYS C 1 1 16 10125 1 1 41 LYS CA C 0.022 -9.459 8.075 1.00 . A A . 41 LYS CA 1 1 16 10126 1 1 41 LYS CB C 0.436 -10.927 7.913 1.00 . A A . 41 LYS CB 1 1 16 10127 1 1 41 LYS CD C -1.756 -12.130 7.704 1.00 . A A . 41 LYS CD 1 1 16 10128 1 1 41 LYS CE C -2.909 -12.281 6.726 1.00 . A A . 41 LYS CE 1 1 16 10129 1 1 41 LYS CG C -0.478 -11.719 6.995 1.00 . A A . 41 LYS CG 1 1 16 10130 1 1 41 LYS H H -0.168 -8.473 6.214 1.00 . A A . 41 LYS H 1 1 16 10131 1 1 41 LYS HA H -1.056 -9.410 8.085 1.00 . A A . 41 LYS HA 1 1 16 10132 1 1 41 LYS HB2 H 1.437 -10.964 7.508 1.00 . A A . 41 LYS HB2 1 1 16 10133 1 1 41 LYS HB3 H 0.432 -11.400 8.884 1.00 . A A . 41 LYS HB3 1 1 16 10134 1 1 41 LYS HD2 H -1.594 -13.076 8.200 1.00 . A A . 41 LYS HD2 1 1 16 10135 1 1 41 LYS HD3 H -2.011 -11.376 8.435 1.00 . A A . 41 LYS HD3 1 1 16 10136 1 1 41 LYS HE2 H -2.663 -11.752 5.816 1.00 . A A . 41 LYS HE2 1 1 16 10137 1 1 41 LYS HE3 H -3.041 -13.329 6.507 1.00 . A A . 41 LYS HE3 1 1 16 10138 1 1 41 LYS HG2 H -0.731 -11.109 6.141 1.00 . A A . 41 LYS HG2 1 1 16 10139 1 1 41 LYS HG3 H 0.042 -12.606 6.664 1.00 . A A . 41 LYS HG3 1 1 16 10140 1 1 41 LYS HZ1 H -4.426 -12.219 8.163 1.00 . A A . 41 LYS HZ1 1 1 16 10141 1 1 41 LYS HZ2 H -4.954 -11.883 6.585 1.00 . A A . 41 LYS HZ2 1 1 16 10142 1 1 41 LYS HZ3 H -4.084 -10.713 7.455 1.00 . A A . 41 LYS HZ3 1 1 16 10143 1 1 41 LYS N N 0.479 -8.681 6.921 1.00 . A A . 41 LYS N 1 1 16 10144 1 1 41 LYS NZ N -4.180 -11.736 7.271 1.00 . A A . 41 LYS NZ 1 1 16 10145 1 1 41 LYS O O 0.170 -7.789 9.802 1.00 . A A . 41 LYS O 1 1 16 10146 1 1 42 SER C C 2.862 -8.080 11.199 1.00 . A A . 42 SER C 1 1 16 10147 1 1 42 SER CA C 1.919 -9.262 11.372 1.00 . A A . 42 SER CA 1 1 16 10148 1 1 42 SER CB C 2.645 -10.436 12.023 1.00 . A A . 42 SER CB 1 1 16 10149 1 1 42 SER H H 1.623 -10.546 9.726 1.00 . A A . 42 SER H 1 1 16 10150 1 1 42 SER HA H 1.098 -8.960 12.005 1.00 . A A . 42 SER HA 1 1 16 10151 1 1 42 SER HB2 H 3.636 -10.523 11.600 1.00 . A A . 42 SER HB2 1 1 16 10152 1 1 42 SER HB3 H 2.721 -10.266 13.088 1.00 . A A . 42 SER HB3 1 1 16 10153 1 1 42 SER HG H 0.988 -11.464 11.756 1.00 . A A . 42 SER HG 1 1 16 10154 1 1 42 SER N N 1.368 -9.672 10.092 1.00 . A A . 42 SER N 1 1 16 10155 1 1 42 SER O O 3.853 -8.159 10.465 1.00 . A A . 42 SER O 1 1 16 10156 1 1 42 SER OG O 1.941 -11.650 11.798 1.00 . A A . 42 SER OG 1 1 16 10157 1 1 43 GLY C C 3.133 -5.129 10.326 1.00 . A A . 43 GLY C 1 1 16 10158 1 1 43 GLY CA C 3.291 -5.767 11.689 1.00 . A A . 43 GLY CA 1 1 16 10159 1 1 43 GLY H H 1.677 -6.956 12.355 1.00 . A A . 43 GLY H 1 1 16 10160 1 1 43 GLY HA2 H 2.979 -5.061 12.445 1.00 . A A . 43 GLY HA2 1 1 16 10161 1 1 43 GLY HA3 H 4.332 -6.010 11.843 1.00 . A A . 43 GLY HA3 1 1 16 10162 1 1 43 GLY N N 2.507 -6.969 11.820 1.00 . A A . 43 GLY N 1 1 16 10163 1 1 43 GLY O O 4.117 -4.717 9.714 1.00 . A A . 43 GLY O 1 1 16 10164 1 1 44 LEU C C 2.110 -2.897 8.675 1.00 . A A . 44 LEU C 1 1 16 10165 1 1 44 LEU CA C 1.628 -4.337 8.590 1.00 . A A . 44 LEU CA 1 1 16 10166 1 1 44 LEU CB C 0.140 -4.382 8.213 1.00 . A A . 44 LEU CB 1 1 16 10167 1 1 44 LEU CD1 C -1.489 -3.223 9.728 1.00 . A A . 44 LEU CD1 1 1 16 10168 1 1 44 LEU CD2 C -1.914 -5.569 9.006 1.00 . A A . 44 LEU CD2 1 1 16 10169 1 1 44 LEU CG C -0.845 -4.551 9.370 1.00 . A A . 44 LEU CG 1 1 16 10170 1 1 44 LEU H H 1.138 -5.322 10.406 1.00 . A A . 44 LEU H 1 1 16 10171 1 1 44 LEU HA H 2.198 -4.847 7.827 1.00 . A A . 44 LEU HA 1 1 16 10172 1 1 44 LEU HB2 H -0.102 -3.464 7.698 1.00 . A A . 44 LEU HB2 1 1 16 10173 1 1 44 LEU HB3 H -0.003 -5.203 7.527 1.00 . A A . 44 LEU HB3 1 1 16 10174 1 1 44 LEU HD11 H -1.454 -2.564 8.874 1.00 . A A . 44 LEU HD11 1 1 16 10175 1 1 44 LEU HD12 H -2.517 -3.388 10.015 1.00 . A A . 44 LEU HD12 1 1 16 10176 1 1 44 LEU HD13 H -0.953 -2.774 10.552 1.00 . A A . 44 LEU HD13 1 1 16 10177 1 1 44 LEU HD21 H -1.497 -6.564 9.061 1.00 . A A . 44 LEU HD21 1 1 16 10178 1 1 44 LEU HD22 H -2.740 -5.485 9.697 1.00 . A A . 44 LEU HD22 1 1 16 10179 1 1 44 LEU HD23 H -2.264 -5.380 8.001 1.00 . A A . 44 LEU HD23 1 1 16 10180 1 1 44 LEU HG H -0.317 -4.915 10.239 1.00 . A A . 44 LEU HG 1 1 16 10181 1 1 44 LEU N N 1.890 -5.007 9.859 1.00 . A A . 44 LEU N 1 1 16 10182 1 1 44 LEU O O 2.889 -2.445 7.840 1.00 . A A . 44 LEU O 1 1 16 10183 1 1 45 ARG C C 3.161 -1.097 11.454 1.00 . A A . 45 ARG C 1 1 16 10184 1 1 45 ARG CA C 2.406 -0.983 10.142 1.00 . A A . 45 ARG CA 1 1 16 10185 1 1 45 ARG CB C 1.321 0.091 10.263 1.00 . A A . 45 ARG CB 1 1 16 10186 1 1 45 ARG CD C -0.866 1.009 9.469 1.00 . A A . 45 ARG CD 1 1 16 10187 1 1 45 ARG CG C 0.245 0.014 9.196 1.00 . A A . 45 ARG CG 1 1 16 10188 1 1 45 ARG CZ C -3.198 0.281 9.812 1.00 . A A . 45 ARG CZ 1 1 16 10189 1 1 45 ARG H H 1.359 -2.778 10.518 1.00 . A A . 45 ARG H 1 1 16 10190 1 1 45 ARG HA H 3.096 -0.710 9.356 1.00 . A A . 45 ARG HA 1 1 16 10191 1 1 45 ARG HB2 H 0.844 -0.007 11.227 1.00 . A A . 45 ARG HB2 1 1 16 10192 1 1 45 ARG HB3 H 1.788 1.062 10.202 1.00 . A A . 45 ARG HB3 1 1 16 10193 1 1 45 ARG HD2 H -0.457 1.845 10.017 1.00 . A A . 45 ARG HD2 1 1 16 10194 1 1 45 ARG HD3 H -1.263 1.356 8.527 1.00 . A A . 45 ARG HD3 1 1 16 10195 1 1 45 ARG HE H -1.728 0.118 11.167 1.00 . A A . 45 ARG HE 1 1 16 10196 1 1 45 ARG HG2 H 0.686 0.234 8.235 1.00 . A A . 45 ARG HG2 1 1 16 10197 1 1 45 ARG HG3 H -0.171 -0.984 9.186 1.00 . A A . 45 ARG HG3 1 1 16 10198 1 1 45 ARG HH11 H -2.804 1.011 7.958 1.00 . A A . 45 ARG HH11 1 1 16 10199 1 1 45 ARG HH12 H -4.464 0.566 8.246 1.00 . A A . 45 ARG HH12 1 1 16 10200 1 1 45 ARG HH21 H -3.877 -0.540 11.537 1.00 . A A . 45 ARG HH21 1 1 16 10201 1 1 45 ARG HH22 H -5.070 -0.339 10.290 1.00 . A A . 45 ARG HH22 1 1 16 10202 1 1 45 ARG N N 1.833 -2.278 9.813 1.00 . A A . 45 ARG N 1 1 16 10203 1 1 45 ARG NE N -1.948 0.419 10.253 1.00 . A A . 45 ARG NE 1 1 16 10204 1 1 45 ARG NH1 N -3.512 0.640 8.572 1.00 . A A . 45 ARG NH1 1 1 16 10205 1 1 45 ARG NH2 N -4.122 -0.242 10.604 1.00 . A A . 45 ARG NH2 1 1 16 10206 1 1 45 ARG O O 4.358 -1.377 11.471 1.00 . A A . 45 ARG O 1 1 16 10207 1 1 46 VAL C C 1.966 -1.893 14.757 1.00 . A A . 46 VAL C 1 1 16 10208 1 1 46 VAL CA C 2.985 -1.187 13.879 1.00 . A A . 46 VAL CA 1 1 16 10209 1 1 46 VAL CB C 3.398 0.144 14.555 1.00 . A A . 46 VAL CB 1 1 16 10210 1 1 46 VAL CG1 C 4.901 0.191 14.766 1.00 . A A . 46 VAL CG1 1 1 16 10211 1 1 46 VAL CG2 C 2.932 1.351 13.750 1.00 . A A . 46 VAL CG2 1 1 16 10212 1 1 46 VAL H H 1.456 -0.861 12.462 1.00 . A A . 46 VAL H 1 1 16 10213 1 1 46 VAL HA H 3.862 -1.812 13.786 1.00 . A A . 46 VAL HA 1 1 16 10214 1 1 46 VAL HB H 2.925 0.187 15.526 1.00 . A A . 46 VAL HB 1 1 16 10215 1 1 46 VAL HG11 H 5.119 0.085 15.818 1.00 . A A . 46 VAL HG11 1 1 16 10216 1 1 46 VAL HG12 H 5.368 -0.614 14.218 1.00 . A A . 46 VAL HG12 1 1 16 10217 1 1 46 VAL HG13 H 5.284 1.137 14.414 1.00 . A A . 46 VAL HG13 1 1 16 10218 1 1 46 VAL HG21 H 3.578 2.192 13.957 1.00 . A A . 46 VAL HG21 1 1 16 10219 1 1 46 VAL HG22 H 2.969 1.117 12.696 1.00 . A A . 46 VAL HG22 1 1 16 10220 1 1 46 VAL HG23 H 1.919 1.599 14.029 1.00 . A A . 46 VAL HG23 1 1 16 10221 1 1 46 VAL N N 2.426 -0.995 12.550 1.00 . A A . 46 VAL N 1 1 16 10222 1 1 46 VAL O O 0.777 -1.921 14.369 1.00 . A A . 46 VAL O 1 1 16 10223 1 1 46 VAL OXT O 2.345 -2.425 15.816 1.00 . A A . 46 VAL OXT 1 1 16 10224 2 2 1 ZN ZN ZN -0.218 -0.012 -0.335 1.00 . B A . 47 ZN ZN 1 1 17 10225 1 1 1 GLY C C 9.315 13.727 3.565 1.00 . A A . 1 GLY C 1 1 17 10226 1 1 1 GLY CA C 10.198 12.518 3.342 1.00 . A A . 1 GLY CA 1 1 17 10227 1 1 1 GLY H1 H 10.731 13.383 1.521 1.00 . A A . 1 GLY H1 1 1 17 10228 1 1 1 GLY H2 H 10.065 11.830 1.380 1.00 . A A . 1 GLY H2 1 1 17 10229 1 1 1 GLY H3 H 11.654 12.024 1.932 1.00 . A A . 1 GLY H3 1 1 17 10230 1 1 1 GLY HA2 H 9.632 11.626 3.567 1.00 . A A . 1 GLY HA2 1 1 17 10231 1 1 1 GLY HA3 H 11.044 12.574 4.013 1.00 . A A . 1 GLY HA3 1 1 17 10232 1 1 1 GLY N N 10.696 12.434 1.950 1.00 . A A . 1 GLY N 1 1 17 10233 1 1 1 GLY O O 9.411 14.391 4.598 1.00 . A A . 1 GLY O 1 1 17 10234 1 1 2 SER C C 6.271 14.758 3.443 1.00 . A A . 2 SER C 1 1 17 10235 1 1 2 SER CA C 7.549 15.153 2.710 1.00 . A A . 2 SER CA 1 1 17 10236 1 1 2 SER CB C 7.216 15.703 1.319 1.00 . A A . 2 SER CB 1 1 17 10237 1 1 2 SER H H 8.403 13.444 1.803 1.00 . A A . 2 SER H 1 1 17 10238 1 1 2 SER HA H 8.051 15.920 3.281 1.00 . A A . 2 SER HA 1 1 17 10239 1 1 2 SER HB2 H 6.324 15.221 0.948 1.00 . A A . 2 SER HB2 1 1 17 10240 1 1 2 SER HB3 H 7.046 16.767 1.388 1.00 . A A . 2 SER HB3 1 1 17 10241 1 1 2 SER HG H 7.930 15.523 -0.503 1.00 . A A . 2 SER HG 1 1 17 10242 1 1 2 SER N N 8.450 14.017 2.602 1.00 . A A . 2 SER N 1 1 17 10243 1 1 2 SER O O 5.944 15.328 4.486 1.00 . A A . 2 SER O 1 1 17 10244 1 1 2 SER OG O 8.276 15.468 0.404 1.00 . A A . 2 SER OG 1 1 17 10245 1 1 3 MET C C 4.535 12.272 4.548 1.00 . A A . 3 MET C 1 1 17 10246 1 1 3 MET CA C 4.295 13.349 3.497 1.00 . A A . 3 MET CA 1 1 17 10247 1 1 3 MET CB C 3.343 12.819 2.425 1.00 . A A . 3 MET CB 1 1 17 10248 1 1 3 MET CE C 0.409 14.996 3.673 1.00 . A A . 3 MET CE 1 1 17 10249 1 1 3 MET CG C 1.890 12.796 2.866 1.00 . A A . 3 MET CG 1 1 17 10250 1 1 3 MET H H 5.850 13.378 2.054 1.00 . A A . 3 MET H 1 1 17 10251 1 1 3 MET HA H 3.841 14.204 3.975 1.00 . A A . 3 MET HA 1 1 17 10252 1 1 3 MET HB2 H 3.424 13.443 1.547 1.00 . A A . 3 MET HB2 1 1 17 10253 1 1 3 MET HB3 H 3.635 11.811 2.167 1.00 . A A . 3 MET HB3 1 1 17 10254 1 1 3 MET HE1 H 1.156 15.716 3.966 1.00 . A A . 3 MET HE1 1 1 17 10255 1 1 3 MET HE2 H -0.529 15.502 3.493 1.00 . A A . 3 MET HE2 1 1 17 10256 1 1 3 MET HE3 H 0.278 14.271 4.462 1.00 . A A . 3 MET HE3 1 1 17 10257 1 1 3 MET HG2 H 1.445 11.867 2.547 1.00 . A A . 3 MET HG2 1 1 17 10258 1 1 3 MET HG3 H 1.854 12.859 3.944 1.00 . A A . 3 MET HG3 1 1 17 10259 1 1 3 MET N N 5.547 13.789 2.896 1.00 . A A . 3 MET N 1 1 17 10260 1 1 3 MET O O 4.132 12.415 5.704 1.00 . A A . 3 MET O 1 1 17 10261 1 1 3 MET SD S 0.935 14.161 2.176 1.00 . A A . 3 MET SD 1 1 17 10262 1 1 4 ALA C C 6.938 9.761 5.054 1.00 . A A . 4 ALA C 1 1 17 10263 1 1 4 ALA CA C 5.451 10.083 5.045 1.00 . A A . 4 ALA CA 1 1 17 10264 1 1 4 ALA CB C 4.641 8.859 4.636 1.00 . A A . 4 ALA CB 1 1 17 10265 1 1 4 ALA H H 5.477 11.130 3.205 1.00 . A A . 4 ALA H 1 1 17 10266 1 1 4 ALA HA H 5.144 10.377 6.039 1.00 . A A . 4 ALA HA 1 1 17 10267 1 1 4 ALA HB1 H 3.937 9.136 3.865 1.00 . A A . 4 ALA HB1 1 1 17 10268 1 1 4 ALA HB2 H 5.307 8.097 4.261 1.00 . A A . 4 ALA HB2 1 1 17 10269 1 1 4 ALA HB3 H 4.105 8.479 5.494 1.00 . A A . 4 ALA HB3 1 1 17 10270 1 1 4 ALA N N 5.176 11.189 4.142 1.00 . A A . 4 ALA N 1 1 17 10271 1 1 4 ALA O O 7.714 10.369 4.312 1.00 . A A . 4 ALA O 1 1 17 10272 1 1 5 ALA C C 9.041 7.536 4.657 1.00 . A A . 5 ALA C 1 1 17 10273 1 1 5 ALA CA C 8.708 8.332 5.912 1.00 . A A . 5 ALA CA 1 1 17 10274 1 1 5 ALA CB C 8.955 7.496 7.161 1.00 . A A . 5 ALA CB 1 1 17 10275 1 1 5 ALA H H 6.651 8.313 6.410 1.00 . A A . 5 ALA H 1 1 17 10276 1 1 5 ALA HA H 9.344 9.205 5.957 1.00 . A A . 5 ALA HA 1 1 17 10277 1 1 5 ALA HB1 H 9.982 7.610 7.474 1.00 . A A . 5 ALA HB1 1 1 17 10278 1 1 5 ALA HB2 H 8.298 7.828 7.951 1.00 . A A . 5 ALA HB2 1 1 17 10279 1 1 5 ALA HB3 H 8.758 6.457 6.941 1.00 . A A . 5 ALA HB3 1 1 17 10280 1 1 5 ALA N N 7.325 8.780 5.862 1.00 . A A . 5 ALA N 1 1 17 10281 1 1 5 ALA O O 8.879 6.316 4.617 1.00 . A A . 5 ALA O 1 1 17 10282 1 1 6 HIS C C 10.433 8.598 1.448 1.00 . A A . 6 HIS C 1 1 17 10283 1 1 6 HIS CA C 9.593 7.658 2.294 1.00 . A A . 6 HIS CA 1 1 17 10284 1 1 6 HIS CB C 8.262 7.373 1.590 1.00 . A A . 6 HIS CB 1 1 17 10285 1 1 6 HIS CD2 C 7.170 5.362 0.380 1.00 . A A . 6 HIS CD2 1 1 17 10286 1 1 6 HIS CE1 C 8.423 3.766 1.197 1.00 . A A . 6 HIS CE1 1 1 17 10287 1 1 6 HIS CG C 8.069 5.938 1.207 1.00 . A A . 6 HIS CG 1 1 17 10288 1 1 6 HIS H H 9.345 9.238 3.671 1.00 . A A . 6 HIS H 1 1 17 10289 1 1 6 HIS HA H 10.129 6.731 2.438 1.00 . A A . 6 HIS HA 1 1 17 10290 1 1 6 HIS HB2 H 7.452 7.650 2.249 1.00 . A A . 6 HIS HB2 1 1 17 10291 1 1 6 HIS HB3 H 8.205 7.969 0.690 1.00 . A A . 6 HIS HB3 1 1 17 10292 1 1 6 HIS HD1 H 9.609 5.005 2.324 1.00 . A A . 6 HIS HD1 1 1 17 10293 1 1 6 HIS HD2 H 6.408 5.871 -0.192 1.00 . A A . 6 HIS HD2 1 1 17 10294 1 1 6 HIS HE1 H 8.842 2.791 1.406 1.00 . A A . 6 HIS HE1 1 1 17 10295 1 1 6 HIS HE2 H 6.818 3.330 0.003 1.00 . A A . 6 HIS HE2 1 1 17 10296 1 1 6 HIS N N 9.354 8.258 3.595 1.00 . A A . 6 HIS N 1 1 17 10297 1 1 6 HIS ND1 N 8.842 4.908 1.703 1.00 . A A . 6 HIS ND1 1 1 17 10298 1 1 6 HIS NE2 N 7.410 4.012 0.393 1.00 . A A . 6 HIS NE2 1 1 17 10299 1 1 6 HIS O O 10.202 9.805 1.449 1.00 . A A . 6 HIS O 1 1 17 10300 1 1 7 SER C C 11.356 9.360 -1.355 1.00 . A A . 7 SER C 1 1 17 10301 1 1 7 SER CA C 12.198 8.837 -0.193 1.00 . A A . 7 SER CA 1 1 17 10302 1 1 7 SER CB C 13.364 7.992 -0.705 1.00 . A A . 7 SER CB 1 1 17 10303 1 1 7 SER H H 11.476 7.067 0.702 1.00 . A A . 7 SER H 1 1 17 10304 1 1 7 SER HA H 12.584 9.675 0.367 1.00 . A A . 7 SER HA 1 1 17 10305 1 1 7 SER HB2 H 13.169 7.687 -1.722 1.00 . A A . 7 SER HB2 1 1 17 10306 1 1 7 SER HB3 H 14.272 8.575 -0.670 1.00 . A A . 7 SER HB3 1 1 17 10307 1 1 7 SER HG H 13.582 7.091 1.033 1.00 . A A . 7 SER HG 1 1 17 10308 1 1 7 SER N N 11.371 8.043 0.699 1.00 . A A . 7 SER N 1 1 17 10309 1 1 7 SER O O 11.495 10.512 -1.773 1.00 . A A . 7 SER O 1 1 17 10310 1 1 7 SER OG O 13.535 6.830 0.098 1.00 . A A . 7 SER OG 1 1 17 10311 1 1 8 ALA C C 8.053 8.535 -2.426 1.00 . A A . 8 ALA C 1 1 17 10312 1 1 8 ALA CA C 9.466 8.936 -2.827 1.00 . A A . 8 ALA CA 1 1 17 10313 1 1 8 ALA CB C 9.846 8.307 -4.161 1.00 . A A . 8 ALA CB 1 1 17 10314 1 1 8 ALA H H 10.294 7.669 -1.352 1.00 . A A . 8 ALA H 1 1 17 10315 1 1 8 ALA HA H 9.512 10.011 -2.932 1.00 . A A . 8 ALA HA 1 1 17 10316 1 1 8 ALA HB1 H 10.554 8.943 -4.672 1.00 . A A . 8 ALA HB1 1 1 17 10317 1 1 8 ALA HB2 H 10.293 7.339 -3.988 1.00 . A A . 8 ALA HB2 1 1 17 10318 1 1 8 ALA HB3 H 8.961 8.193 -4.771 1.00 . A A . 8 ALA HB3 1 1 17 10319 1 1 8 ALA N N 10.407 8.543 -1.791 1.00 . A A . 8 ALA N 1 1 17 10320 1 1 8 ALA O O 7.868 7.601 -1.650 1.00 . A A . 8 ALA O 1 1 17 10321 1 1 9 ASP C C 4.889 8.583 -3.805 1.00 . A A . 9 ASP C 1 1 17 10322 1 1 9 ASP CA C 5.672 9.010 -2.571 1.00 . A A . 9 ASP CA 1 1 17 10323 1 1 9 ASP CB C 5.049 10.263 -1.945 1.00 . A A . 9 ASP CB 1 1 17 10324 1 1 9 ASP CG C 3.872 9.960 -1.037 1.00 . A A . 9 ASP CG 1 1 17 10325 1 1 9 ASP H H 7.278 10.027 -3.505 1.00 . A A . 9 ASP H 1 1 17 10326 1 1 9 ASP HA H 5.649 8.200 -1.856 1.00 . A A . 9 ASP HA 1 1 17 10327 1 1 9 ASP HB2 H 5.800 10.773 -1.361 1.00 . A A . 9 ASP HB2 1 1 17 10328 1 1 9 ASP HB3 H 4.710 10.918 -2.734 1.00 . A A . 9 ASP HB3 1 1 17 10329 1 1 9 ASP N N 7.066 9.269 -2.917 1.00 . A A . 9 ASP N 1 1 17 10330 1 1 9 ASP O O 3.702 8.877 -3.945 1.00 . A A . 9 ASP O 1 1 17 10331 1 1 9 ASP OD1 O 4.095 9.537 0.117 1.00 . A A . 9 ASP OD1 1 1 17 10332 1 1 9 ASP OD2 O 2.719 10.174 -1.464 1.00 . A A . 9 ASP OD2 1 1 17 10333 1 1 10 LEU C C 4.199 5.910 -5.377 1.00 . A A . 10 LEU C 1 1 17 10334 1 1 10 LEU CA C 4.866 7.207 -5.800 1.00 . A A . 10 LEU CA 1 1 17 10335 1 1 10 LEU CB C 5.860 6.947 -6.934 1.00 . A A . 10 LEU CB 1 1 17 10336 1 1 10 LEU CD1 C 7.690 7.788 -8.418 1.00 . A A . 10 LEU CD1 1 1 17 10337 1 1 10 LEU CD2 C 5.600 9.132 -8.139 1.00 . A A . 10 LEU CD2 1 1 17 10338 1 1 10 LEU CG C 6.581 8.187 -7.459 1.00 . A A . 10 LEU CG 1 1 17 10339 1 1 10 LEU H H 6.447 7.503 -4.423 1.00 . A A . 10 LEU H 1 1 17 10340 1 1 10 LEU HA H 4.110 7.899 -6.138 1.00 . A A . 10 LEU HA 1 1 17 10341 1 1 10 LEU HB2 H 6.603 6.246 -6.579 1.00 . A A . 10 LEU HB2 1 1 17 10342 1 1 10 LEU HB3 H 5.326 6.493 -7.756 1.00 . A A . 10 LEU HB3 1 1 17 10343 1 1 10 LEU HD11 H 7.565 6.753 -8.702 1.00 . A A . 10 LEU HD11 1 1 17 10344 1 1 10 LEU HD12 H 7.647 8.412 -9.297 1.00 . A A . 10 LEU HD12 1 1 17 10345 1 1 10 LEU HD13 H 8.647 7.913 -7.933 1.00 . A A . 10 LEU HD13 1 1 17 10346 1 1 10 LEU HD21 H 4.602 8.940 -7.771 1.00 . A A . 10 LEU HD21 1 1 17 10347 1 1 10 LEU HD22 H 5.872 10.153 -7.919 1.00 . A A . 10 LEU HD22 1 1 17 10348 1 1 10 LEU HD23 H 5.625 8.972 -9.207 1.00 . A A . 10 LEU HD23 1 1 17 10349 1 1 10 LEU HG H 7.031 8.711 -6.629 1.00 . A A . 10 LEU HG 1 1 17 10350 1 1 10 LEU N N 5.534 7.792 -4.647 1.00 . A A . 10 LEU N 1 1 17 10351 1 1 10 LEU O O 3.182 5.497 -5.936 1.00 . A A . 10 LEU O 1 1 17 10352 1 1 11 LYS C C 4.020 4.366 -2.228 1.00 . A A . 11 LYS C 1 1 17 10353 1 1 11 LYS CA C 4.195 4.144 -3.722 1.00 . A A . 11 LYS CA 1 1 17 10354 1 1 11 LYS CB C 5.120 2.952 -3.969 1.00 . A A . 11 LYS CB 1 1 17 10355 1 1 11 LYS CD C 3.428 1.539 -5.156 1.00 . A A . 11 LYS CD 1 1 17 10356 1 1 11 LYS CE C 3.454 0.126 -5.712 1.00 . A A . 11 LYS CE 1 1 17 10357 1 1 11 LYS CG C 4.793 2.195 -5.242 1.00 . A A . 11 LYS CG 1 1 17 10358 1 1 11 LYS H H 5.507 5.743 -3.893 1.00 . A A . 11 LYS H 1 1 17 10359 1 1 11 LYS HA H 3.232 3.950 -4.169 1.00 . A A . 11 LYS HA 1 1 17 10360 1 1 11 LYS HB2 H 6.139 3.307 -4.036 1.00 . A A . 11 LYS HB2 1 1 17 10361 1 1 11 LYS HB3 H 5.040 2.267 -3.137 1.00 . A A . 11 LYS HB3 1 1 17 10362 1 1 11 LYS HD2 H 3.121 1.503 -4.120 1.00 . A A . 11 LYS HD2 1 1 17 10363 1 1 11 LYS HD3 H 2.722 2.128 -5.722 1.00 . A A . 11 LYS HD3 1 1 17 10364 1 1 11 LYS HE2 H 2.463 -0.125 -6.063 1.00 . A A . 11 LYS HE2 1 1 17 10365 1 1 11 LYS HE3 H 4.146 0.092 -6.541 1.00 . A A . 11 LYS HE3 1 1 17 10366 1 1 11 LYS HG2 H 4.797 2.887 -6.069 1.00 . A A . 11 LYS HG2 1 1 17 10367 1 1 11 LYS HG3 H 5.541 1.435 -5.399 1.00 . A A . 11 LYS HG3 1 1 17 10368 1 1 11 LYS HZ1 H 4.882 -1.098 -4.802 1.00 . A A . 11 LYS HZ1 1 1 17 10369 1 1 11 LYS HZ2 H 3.321 -1.748 -4.797 1.00 . A A . 11 LYS HZ2 1 1 17 10370 1 1 11 LYS HZ3 H 3.715 -0.490 -3.730 1.00 . A A . 11 LYS HZ3 1 1 17 10371 1 1 11 LYS N N 4.741 5.327 -4.321 1.00 . A A . 11 LYS N 1 1 17 10372 1 1 11 LYS NZ N 3.870 -0.872 -4.691 1.00 . A A . 11 LYS NZ 1 1 17 10373 1 1 11 LYS O O 4.440 5.387 -1.679 1.00 . A A . 11 LYS O 1 1 17 10374 1 1 12 CYS C C 4.396 2.786 0.569 1.00 . A A . 12 CYS C 1 1 17 10375 1 1 12 CYS CA C 3.203 3.418 -0.158 1.00 . A A . 12 CYS CA 1 1 17 10376 1 1 12 CYS CB C 1.920 2.644 0.150 1.00 . A A . 12 CYS CB 1 1 17 10377 1 1 12 CYS H H 3.155 2.611 -2.090 1.00 . A A . 12 CYS H 1 1 17 10378 1 1 12 CYS HA H 3.091 4.445 0.154 1.00 . A A . 12 CYS HA 1 1 17 10379 1 1 12 CYS HB2 H 1.659 2.790 1.188 1.00 . A A . 12 CYS HB2 1 1 17 10380 1 1 12 CYS HB3 H 1.123 3.016 -0.474 1.00 . A A . 12 CYS HB3 1 1 17 10381 1 1 12 CYS N N 3.427 3.392 -1.588 1.00 . A A . 12 CYS N 1 1 17 10382 1 1 12 CYS O O 5.324 2.274 -0.071 1.00 . A A . 12 CYS O 1 1 17 10383 1 1 12 CYS SG S 2.073 0.858 -0.141 1.00 . A A . 12 CYS SG 1 1 17 10384 1 1 13 PRO C C 5.583 0.715 2.547 1.00 . A A . 13 PRO C 1 1 17 10385 1 1 13 PRO CA C 5.477 2.231 2.724 1.00 . A A . 13 PRO CA 1 1 17 10386 1 1 13 PRO CB C 5.063 2.560 4.164 1.00 . A A . 13 PRO CB 1 1 17 10387 1 1 13 PRO CD C 3.391 3.480 2.758 1.00 . A A . 13 PRO CD 1 1 17 10388 1 1 13 PRO CG C 3.604 2.837 4.089 1.00 . A A . 13 PRO CG 1 1 17 10389 1 1 13 PRO HA H 6.433 2.686 2.507 1.00 . A A . 13 PRO HA 1 1 17 10390 1 1 13 PRO HB2 H 5.272 1.716 4.804 1.00 . A A . 13 PRO HB2 1 1 17 10391 1 1 13 PRO HB3 H 5.604 3.422 4.506 1.00 . A A . 13 PRO HB3 1 1 17 10392 1 1 13 PRO HD2 H 2.394 3.281 2.394 1.00 . A A . 13 PRO HD2 1 1 17 10393 1 1 13 PRO HD3 H 3.571 4.544 2.816 1.00 . A A . 13 PRO HD3 1 1 17 10394 1 1 13 PRO HG2 H 3.048 1.912 4.155 1.00 . A A . 13 PRO HG2 1 1 17 10395 1 1 13 PRO HG3 H 3.315 3.509 4.883 1.00 . A A . 13 PRO HG3 1 1 17 10396 1 1 13 PRO N N 4.404 2.823 1.915 1.00 . A A . 13 PRO N 1 1 17 10397 1 1 13 PRO O O 6.632 0.122 2.808 1.00 . A A . 13 PRO O 1 1 17 10398 1 1 14 THR C C 5.041 -1.842 0.726 1.00 . A A . 14 THR C 1 1 17 10399 1 1 14 THR CA C 4.392 -1.349 2.025 1.00 . A A . 14 THR CA 1 1 17 10400 1 1 14 THR CB C 2.921 -1.811 2.091 1.00 . A A . 14 THR CB 1 1 17 10401 1 1 14 THR CG2 C 2.806 -3.317 1.922 1.00 . A A . 14 THR CG2 1 1 17 10402 1 1 14 THR H H 3.671 0.641 2.002 1.00 . A A . 14 THR H 1 1 17 10403 1 1 14 THR HA H 4.915 -1.789 2.859 1.00 . A A . 14 THR HA 1 1 17 10404 1 1 14 THR HB H 2.372 -1.330 1.295 1.00 . A A . 14 THR HB 1 1 17 10405 1 1 14 THR HG1 H 1.486 -1.005 3.203 1.00 . A A . 14 THR HG1 1 1 17 10406 1 1 14 THR HG21 H 3.173 -3.597 0.945 1.00 . A A . 14 THR HG21 1 1 17 10407 1 1 14 THR HG22 H 1.771 -3.612 2.016 1.00 . A A . 14 THR HG22 1 1 17 10408 1 1 14 THR HG23 H 3.392 -3.810 2.682 1.00 . A A . 14 THR HG23 1 1 17 10409 1 1 14 THR N N 4.475 0.100 2.164 1.00 . A A . 14 THR N 1 1 17 10410 1 1 14 THR O O 4.554 -1.570 -0.370 1.00 . A A . 14 THR O 1 1 17 10411 1 1 14 THR OG1 O 2.353 -1.427 3.353 1.00 . A A . 14 THR OG1 1 1 17 10412 1 1 15 PRO C C 6.136 -4.156 -1.084 1.00 . A A . 15 PRO C 1 1 17 10413 1 1 15 PRO CA C 6.910 -3.079 -0.325 1.00 . A A . 15 PRO CA 1 1 17 10414 1 1 15 PRO CB C 8.177 -3.682 0.295 1.00 . A A . 15 PRO CB 1 1 17 10415 1 1 15 PRO CD C 6.861 -2.877 2.095 1.00 . A A . 15 PRO CD 1 1 17 10416 1 1 15 PRO CG C 8.276 -3.063 1.641 1.00 . A A . 15 PRO CG 1 1 17 10417 1 1 15 PRO HA H 7.184 -2.284 -1.005 1.00 . A A . 15 PRO HA 1 1 17 10418 1 1 15 PRO HB2 H 8.072 -4.755 0.361 1.00 . A A . 15 PRO HB2 1 1 17 10419 1 1 15 PRO HB3 H 9.032 -3.438 -0.313 1.00 . A A . 15 PRO HB3 1 1 17 10420 1 1 15 PRO HD2 H 6.478 -3.787 2.532 1.00 . A A . 15 PRO HD2 1 1 17 10421 1 1 15 PRO HD3 H 6.789 -2.056 2.793 1.00 . A A . 15 PRO HD3 1 1 17 10422 1 1 15 PRO HG2 H 8.808 -3.722 2.310 1.00 . A A . 15 PRO HG2 1 1 17 10423 1 1 15 PRO HG3 H 8.776 -2.108 1.571 1.00 . A A . 15 PRO HG3 1 1 17 10424 1 1 15 PRO N N 6.171 -2.561 0.836 1.00 . A A . 15 PRO N 1 1 17 10425 1 1 15 PRO O O 6.344 -4.356 -2.283 1.00 . A A . 15 PRO O 1 1 17 10426 1 1 16 GLY C C 3.244 -5.542 -1.585 1.00 . A A . 16 GLY C 1 1 17 10427 1 1 16 GLY CA C 4.561 -5.984 -0.975 1.00 . A A . 16 GLY CA 1 1 17 10428 1 1 16 GLY H H 5.221 -4.736 0.598 1.00 . A A . 16 GLY H 1 1 17 10429 1 1 16 GLY HA2 H 5.171 -6.419 -1.745 1.00 . A A . 16 GLY HA2 1 1 17 10430 1 1 16 GLY HA3 H 4.362 -6.734 -0.221 1.00 . A A . 16 GLY HA3 1 1 17 10431 1 1 16 GLY N N 5.297 -4.894 -0.367 1.00 . A A . 16 GLY N 1 1 17 10432 1 1 16 GLY O O 2.479 -6.363 -2.090 1.00 . A A . 16 GLY O 1 1 17 10433 1 1 17 CYS C C 1.769 -3.569 -3.573 1.00 . A A . 17 CYS C 1 1 17 10434 1 1 17 CYS CA C 1.729 -3.704 -2.054 1.00 . A A . 17 CYS CA 1 1 17 10435 1 1 17 CYS CB C 1.470 -2.334 -1.454 1.00 . A A . 17 CYS CB 1 1 17 10436 1 1 17 CYS H H 3.606 -3.641 -1.086 1.00 . A A . 17 CYS H 1 1 17 10437 1 1 17 CYS HA H 0.926 -4.369 -1.778 1.00 . A A . 17 CYS HA 1 1 17 10438 1 1 17 CYS HB2 H 2.355 -2.008 -0.929 1.00 . A A . 17 CYS HB2 1 1 17 10439 1 1 17 CYS HB3 H 1.261 -1.637 -2.255 1.00 . A A . 17 CYS HB3 1 1 17 10440 1 1 17 CYS N N 2.969 -4.247 -1.524 1.00 . A A . 17 CYS N 1 1 17 10441 1 1 17 CYS O O 2.840 -3.418 -4.170 1.00 . A A . 17 CYS O 1 1 17 10442 1 1 17 CYS SG S 0.084 -2.257 -0.283 1.00 . A A . 17 CYS SG 1 1 17 10443 1 1 18 ASP C C 0.310 -1.642 -5.779 1.00 . A A . 18 ASP C 1 1 17 10444 1 1 18 ASP CA C 0.459 -3.148 -5.576 1.00 . A A . 18 ASP CA 1 1 17 10445 1 1 18 ASP CB C -0.743 -3.888 -6.167 1.00 . A A . 18 ASP CB 1 1 17 10446 1 1 18 ASP CG C -2.036 -3.127 -5.975 1.00 . A A . 18 ASP CG 1 1 17 10447 1 1 18 ASP H H -0.219 -3.450 -3.598 1.00 . A A . 18 ASP H 1 1 17 10448 1 1 18 ASP HA H 1.359 -3.481 -6.071 1.00 . A A . 18 ASP HA 1 1 17 10449 1 1 18 ASP HB2 H -0.585 -4.032 -7.226 1.00 . A A . 18 ASP HB2 1 1 17 10450 1 1 18 ASP HB3 H -0.837 -4.850 -5.687 1.00 . A A . 18 ASP HB3 1 1 17 10451 1 1 18 ASP N N 0.589 -3.442 -4.157 1.00 . A A . 18 ASP N 1 1 17 10452 1 1 18 ASP O O 0.810 -1.083 -6.754 1.00 . A A . 18 ASP O 1 1 17 10453 1 1 18 ASP OD1 O -2.448 -2.934 -4.814 1.00 . A A . 18 ASP OD1 1 1 17 10454 1 1 18 ASP OD2 O -2.627 -2.692 -6.982 1.00 . A A . 18 ASP OD2 1 1 17 10455 1 1 19 GLY C C -1.777 0.956 -5.358 1.00 . A A . 19 GLY C 1 1 17 10456 1 1 19 GLY CA C -0.433 0.466 -4.843 1.00 . A A . 19 GLY CA 1 1 17 10457 1 1 19 GLY H H -0.659 -1.478 -4.036 1.00 . A A . 19 GLY H 1 1 17 10458 1 1 19 GLY HA2 H -0.288 0.849 -3.844 1.00 . A A . 19 GLY HA2 1 1 17 10459 1 1 19 GLY HA3 H 0.346 0.860 -5.480 1.00 . A A . 19 GLY HA3 1 1 17 10460 1 1 19 GLY N N -0.315 -0.979 -4.808 1.00 . A A . 19 GLY N 1 1 17 10461 1 1 19 GLY O O -2.119 2.126 -5.183 1.00 . A A . 19 GLY O 1 1 17 10462 1 1 20 SER C C -4.974 -0.229 -5.940 1.00 . A A . 20 SER C 1 1 17 10463 1 1 20 SER CA C -3.800 0.491 -6.599 1.00 . A A . 20 SER CA 1 1 17 10464 1 1 20 SER CB C -3.780 0.208 -8.101 1.00 . A A . 20 SER CB 1 1 17 10465 1 1 20 SER H H -2.223 -0.838 -6.130 1.00 . A A . 20 SER H 1 1 17 10466 1 1 20 SER HA H -3.914 1.555 -6.444 1.00 . A A . 20 SER HA 1 1 17 10467 1 1 20 SER HB2 H -4.670 -0.337 -8.374 1.00 . A A . 20 SER HB2 1 1 17 10468 1 1 20 SER HB3 H -3.745 1.141 -8.640 1.00 . A A . 20 SER HB3 1 1 17 10469 1 1 20 SER HG H -2.679 -1.414 -7.963 1.00 . A A . 20 SER HG 1 1 17 10470 1 1 20 SER N N -2.533 0.088 -6.010 1.00 . A A . 20 SER N 1 1 17 10471 1 1 20 SER O O -5.540 -1.170 -6.501 1.00 . A A . 20 SER O 1 1 17 10472 1 1 20 SER OG O -2.646 -0.566 -8.450 1.00 . A A . 20 SER OG 1 1 17 10473 1 1 21 GLY C C -6.429 -0.082 -2.575 1.00 . A A . 21 GLY C 1 1 17 10474 1 1 21 GLY CA C -6.475 -0.348 -4.062 1.00 . A A . 21 GLY CA 1 1 17 10475 1 1 21 GLY H H -4.872 0.985 -4.362 1.00 . A A . 21 GLY H 1 1 17 10476 1 1 21 GLY HA2 H -7.387 0.066 -4.465 1.00 . A A . 21 GLY HA2 1 1 17 10477 1 1 21 GLY HA3 H -6.473 -1.416 -4.226 1.00 . A A . 21 GLY HA3 1 1 17 10478 1 1 21 GLY N N -5.351 0.233 -4.758 1.00 . A A . 21 GLY N 1 1 17 10479 1 1 21 GLY O O -5.558 0.642 -2.096 1.00 . A A . 21 GLY O 1 1 17 10480 1 1 22 HIS C C -7.908 -1.954 0.143 1.00 . A A . 22 HIS C 1 1 17 10481 1 1 22 HIS CA C -7.413 -0.626 -0.396 1.00 . A A . 22 HIS CA 1 1 17 10482 1 1 22 HIS CB C -8.374 0.480 0.068 1.00 . A A . 22 HIS CB 1 1 17 10483 1 1 22 HIS CD2 C -6.964 2.628 -0.368 1.00 . A A . 22 HIS CD2 1 1 17 10484 1 1 22 HIS CE1 C -7.354 3.641 1.530 1.00 . A A . 22 HIS CE1 1 1 17 10485 1 1 22 HIS CG C -7.748 1.811 0.371 1.00 . A A . 22 HIS CG 1 1 17 10486 1 1 22 HIS H H -7.964 -1.314 -2.316 1.00 . A A . 22 HIS H 1 1 17 10487 1 1 22 HIS HA H -6.423 -0.431 -0.013 1.00 . A A . 22 HIS HA 1 1 17 10488 1 1 22 HIS HB2 H -9.110 0.642 -0.704 1.00 . A A . 22 HIS HB2 1 1 17 10489 1 1 22 HIS HB3 H -8.880 0.143 0.962 1.00 . A A . 22 HIS HB3 1 1 17 10490 1 1 22 HIS HD1 H -8.482 2.137 2.327 1.00 . A A . 22 HIS HD1 1 1 17 10491 1 1 22 HIS HD2 H -6.572 2.424 -1.354 1.00 . A A . 22 HIS HD2 1 1 17 10492 1 1 22 HIS HE1 H -7.360 4.374 2.324 1.00 . A A . 22 HIS HE1 1 1 17 10493 1 1 22 HIS HE2 H -6.398 4.620 0.008 1.00 . A A . 22 HIS HE2 1 1 17 10494 1 1 22 HIS N N -7.340 -0.706 -1.852 1.00 . A A . 22 HIS N 1 1 17 10495 1 1 22 HIS ND1 N -7.967 2.477 1.559 1.00 . A A . 22 HIS ND1 1 1 17 10496 1 1 22 HIS NE2 N -6.738 3.763 0.374 1.00 . A A . 22 HIS NE2 1 1 17 10497 1 1 22 HIS O O -8.403 -2.785 -0.616 1.00 . A A . 22 HIS O 1 1 17 10498 1 1 23 ILE C C -10.048 -3.042 2.192 1.00 . A A . 23 ILE C 1 1 17 10499 1 1 23 ILE CA C -8.537 -3.252 2.082 1.00 . A A . 23 ILE CA 1 1 17 10500 1 1 23 ILE CB C -7.910 -3.526 3.476 1.00 . A A . 23 ILE CB 1 1 17 10501 1 1 23 ILE CD1 C -7.242 -5.841 2.630 1.00 . A A . 23 ILE CD1 1 1 17 10502 1 1 23 ILE CG1 C -6.812 -4.589 3.366 1.00 . A A . 23 ILE CG1 1 1 17 10503 1 1 23 ILE CG2 C -8.957 -3.957 4.496 1.00 . A A . 23 ILE CG2 1 1 17 10504 1 1 23 ILE H H -7.644 -1.337 2.022 1.00 . A A . 23 ILE H 1 1 17 10505 1 1 23 ILE HA H -8.348 -4.106 1.448 1.00 . A A . 23 ILE HA 1 1 17 10506 1 1 23 ILE HB H -7.468 -2.607 3.829 1.00 . A A . 23 ILE HB 1 1 17 10507 1 1 23 ILE HD11 H -6.924 -5.781 1.599 1.00 . A A . 23 ILE HD11 1 1 17 10508 1 1 23 ILE HD12 H -6.791 -6.704 3.097 1.00 . A A . 23 ILE HD12 1 1 17 10509 1 1 23 ILE HD13 H -8.319 -5.932 2.671 1.00 . A A . 23 ILE HD13 1 1 17 10510 1 1 23 ILE HG12 H -5.969 -4.170 2.838 1.00 . A A . 23 ILE HG12 1 1 17 10511 1 1 23 ILE HG13 H -6.501 -4.878 4.360 1.00 . A A . 23 ILE HG13 1 1 17 10512 1 1 23 ILE HG21 H -9.206 -4.997 4.338 1.00 . A A . 23 ILE HG21 1 1 17 10513 1 1 23 ILE HG22 H -8.563 -3.828 5.494 1.00 . A A . 23 ILE HG22 1 1 17 10514 1 1 23 ILE HG23 H -9.842 -3.349 4.377 1.00 . A A . 23 ILE HG23 1 1 17 10515 1 1 23 ILE N N -7.934 -2.088 1.457 1.00 . A A . 23 ILE N 1 1 17 10516 1 1 23 ILE O O -10.834 -3.974 2.020 1.00 . A A . 23 ILE O 1 1 17 10517 1 1 24 THR C C -12.649 -1.739 1.318 1.00 . A A . 24 THR C 1 1 17 10518 1 1 24 THR CA C -11.841 -1.425 2.581 1.00 . A A . 24 THR CA 1 1 17 10519 1 1 24 THR CB C -11.994 0.075 2.939 1.00 . A A . 24 THR CB 1 1 17 10520 1 1 24 THR CG2 C -11.333 0.967 1.902 1.00 . A A . 24 THR CG2 1 1 17 10521 1 1 24 THR H H -9.750 -1.102 2.571 1.00 . A A . 24 THR H 1 1 17 10522 1 1 24 THR HA H -12.247 -1.999 3.398 1.00 . A A . 24 THR HA 1 1 17 10523 1 1 24 THR HB H -11.516 0.252 3.892 1.00 . A A . 24 THR HB 1 1 17 10524 1 1 24 THR HG1 H -13.666 0.324 3.965 1.00 . A A . 24 THR HG1 1 1 17 10525 1 1 24 THR HG21 H -10.381 1.312 2.276 1.00 . A A . 24 THR HG21 1 1 17 10526 1 1 24 THR HG22 H -11.970 1.815 1.698 1.00 . A A . 24 THR HG22 1 1 17 10527 1 1 24 THR HG23 H -11.180 0.405 0.991 1.00 . A A . 24 THR HG23 1 1 17 10528 1 1 24 THR N N -10.437 -1.794 2.439 1.00 . A A . 24 THR N 1 1 17 10529 1 1 24 THR O O -13.813 -2.132 1.401 1.00 . A A . 24 THR O 1 1 17 10530 1 1 24 THR OG1 O -13.379 0.422 3.041 1.00 . A A . 24 THR OG1 1 1 17 10531 1 1 25 GLY C C -13.517 -0.603 -1.554 1.00 . A A . 25 GLY C 1 1 17 10532 1 1 25 GLY CA C -12.736 -1.820 -1.094 1.00 . A A . 25 GLY CA 1 1 17 10533 1 1 25 GLY H H -11.098 -1.287 0.136 1.00 . A A . 25 GLY H 1 1 17 10534 1 1 25 GLY HA2 H -12.015 -2.085 -1.855 1.00 . A A . 25 GLY HA2 1 1 17 10535 1 1 25 GLY HA3 H -13.419 -2.643 -0.958 1.00 . A A . 25 GLY HA3 1 1 17 10536 1 1 25 GLY N N -12.034 -1.573 0.152 1.00 . A A . 25 GLY N 1 1 17 10537 1 1 25 GLY O O -14.424 -0.707 -2.378 1.00 . A A . 25 GLY O 1 1 17 10538 1 1 26 ASN C C -13.080 2.754 -1.999 1.00 . A A . 26 ASN C 1 1 17 10539 1 1 26 ASN CA C -13.950 1.769 -1.228 1.00 . A A . 26 ASN CA 1 1 17 10540 1 1 26 ASN CB C -14.418 2.422 0.074 1.00 . A A . 26 ASN CB 1 1 17 10541 1 1 26 ASN CG C -15.739 1.864 0.550 1.00 . A A . 26 ASN CG 1 1 17 10542 1 1 26 ASN H H -12.585 0.525 -0.206 1.00 . A A . 26 ASN H 1 1 17 10543 1 1 26 ASN HA H -14.811 1.519 -1.826 1.00 . A A . 26 ASN HA 1 1 17 10544 1 1 26 ASN HB2 H -13.678 2.249 0.841 1.00 . A A . 26 ASN HB2 1 1 17 10545 1 1 26 ASN HB3 H -14.528 3.486 -0.081 1.00 . A A . 26 ASN HB3 1 1 17 10546 1 1 26 ASN HD21 H -14.787 0.697 1.851 1.00 . A A . 26 ASN HD21 1 1 17 10547 1 1 26 ASN HD22 H -16.510 0.553 1.821 1.00 . A A . 26 ASN HD22 1 1 17 10548 1 1 26 ASN N N -13.230 0.535 -0.939 1.00 . A A . 26 ASN N 1 1 17 10549 1 1 26 ASN ND2 N -15.676 0.950 1.505 1.00 . A A . 26 ASN ND2 1 1 17 10550 1 1 26 ASN O O -13.498 3.880 -2.259 1.00 . A A . 26 ASN O 1 1 17 10551 1 1 26 ASN OD1 O -16.805 2.248 0.067 1.00 . A A . 26 ASN OD1 1 1 17 10552 1 1 27 TYR C C -10.318 2.627 -4.207 1.00 . A A . 27 TYR C 1 1 17 10553 1 1 27 TYR CA C -10.905 3.260 -2.950 1.00 . A A . 27 TYR CA 1 1 17 10554 1 1 27 TYR CB C -9.776 3.629 -1.988 1.00 . A A . 27 TYR CB 1 1 17 10555 1 1 27 TYR CD1 C -10.909 4.220 0.196 1.00 . A A . 27 TYR CD1 1 1 17 10556 1 1 27 TYR CD2 C -9.848 5.965 -1.036 1.00 . A A . 27 TYR CD2 1 1 17 10557 1 1 27 TYR CE1 C -11.287 5.128 1.165 1.00 . A A . 27 TYR CE1 1 1 17 10558 1 1 27 TYR CE2 C -10.221 6.878 -0.068 1.00 . A A . 27 TYR CE2 1 1 17 10559 1 1 27 TYR CG C -10.185 4.623 -0.921 1.00 . A A . 27 TYR CG 1 1 17 10560 1 1 27 TYR CZ C -10.940 6.456 1.029 1.00 . A A . 27 TYR CZ 1 1 17 10561 1 1 27 TYR H H -11.544 1.470 -2.027 1.00 . A A . 27 TYR H 1 1 17 10562 1 1 27 TYR HA H -11.438 4.157 -3.226 1.00 . A A . 27 TYR HA 1 1 17 10563 1 1 27 TYR HB2 H -9.429 2.734 -1.493 1.00 . A A . 27 TYR HB2 1 1 17 10564 1 1 27 TYR HB3 H -8.964 4.057 -2.550 1.00 . A A . 27 TYR HB3 1 1 17 10565 1 1 27 TYR HD1 H -11.178 3.176 0.303 1.00 . A A . 27 TYR HD1 1 1 17 10566 1 1 27 TYR HD2 H -9.286 6.294 -1.896 1.00 . A A . 27 TYR HD2 1 1 17 10567 1 1 27 TYR HE1 H -11.852 4.796 2.022 1.00 . A A . 27 TYR HE1 1 1 17 10568 1 1 27 TYR HE2 H -9.950 7.917 -0.175 1.00 . A A . 27 TYR HE2 1 1 17 10569 1 1 27 TYR HH H -12.037 7.914 1.666 1.00 . A A . 27 TYR HH 1 1 17 10570 1 1 27 TYR N N -11.845 2.364 -2.293 1.00 . A A . 27 TYR N 1 1 17 10571 1 1 27 TYR O O -10.436 1.419 -4.418 1.00 . A A . 27 TYR O 1 1 17 10572 1 1 27 TYR OH O -11.307 7.363 1.998 1.00 . A A . 27 TYR OH 1 1 17 10573 1 1 28 ALA C C -7.532 2.878 -6.113 1.00 . A A . 28 ALA C 1 1 17 10574 1 1 28 ALA CA C -9.049 2.963 -6.254 1.00 . A A . 28 ALA CA 1 1 17 10575 1 1 28 ALA CB C -9.425 3.870 -7.416 1.00 . A A . 28 ALA CB 1 1 17 10576 1 1 28 ALA H H -9.590 4.396 -4.792 1.00 . A A . 28 ALA H 1 1 17 10577 1 1 28 ALA HA H -9.438 1.976 -6.458 1.00 . A A . 28 ALA HA 1 1 17 10578 1 1 28 ALA HB1 H -8.925 3.535 -8.311 1.00 . A A . 28 ALA HB1 1 1 17 10579 1 1 28 ALA HB2 H -10.496 3.835 -7.567 1.00 . A A . 28 ALA HB2 1 1 17 10580 1 1 28 ALA HB3 H -9.128 4.884 -7.193 1.00 . A A . 28 ALA HB3 1 1 17 10581 1 1 28 ALA N N -9.665 3.441 -5.023 1.00 . A A . 28 ALA N 1 1 17 10582 1 1 28 ALA O O -6.867 2.158 -6.859 1.00 . A A . 28 ALA O 1 1 17 10583 1 1 29 SER C C -5.235 4.145 -3.542 1.00 . A A . 29 SER C 1 1 17 10584 1 1 29 SER CA C -5.547 3.670 -4.957 1.00 . A A . 29 SER CA 1 1 17 10585 1 1 29 SER CB C -4.894 4.591 -5.986 1.00 . A A . 29 SER CB 1 1 17 10586 1 1 29 SER H H -7.565 4.208 -4.616 1.00 . A A . 29 SER H 1 1 17 10587 1 1 29 SER HA H -5.166 2.669 -5.086 1.00 . A A . 29 SER HA 1 1 17 10588 1 1 29 SER HB2 H -3.887 4.815 -5.677 1.00 . A A . 29 SER HB2 1 1 17 10589 1 1 29 SER HB3 H -4.872 4.094 -6.945 1.00 . A A . 29 SER HB3 1 1 17 10590 1 1 29 SER HG H -6.495 5.700 -5.720 1.00 . A A . 29 SER HG 1 1 17 10591 1 1 29 SER N N -6.984 3.635 -5.171 1.00 . A A . 29 SER N 1 1 17 10592 1 1 29 SER O O -6.149 4.494 -2.795 1.00 . A A . 29 SER O 1 1 17 10593 1 1 29 SER OG O -5.618 5.806 -6.115 1.00 . A A . 29 SER OG 1 1 17 10594 1 1 30 HIS C C -2.044 4.972 -1.877 1.00 . A A . 30 HIS C 1 1 17 10595 1 1 30 HIS CA C -3.530 4.623 -1.860 1.00 . A A . 30 HIS CA 1 1 17 10596 1 1 30 HIS CB C -3.819 3.555 -0.798 1.00 . A A . 30 HIS CB 1 1 17 10597 1 1 30 HIS CD2 C -1.920 2.006 0.030 1.00 . A A . 30 HIS CD2 1 1 17 10598 1 1 30 HIS CE1 C -1.961 0.528 -1.554 1.00 . A A . 30 HIS CE1 1 1 17 10599 1 1 30 HIS CG C -2.896 2.380 -0.835 1.00 . A A . 30 HIS CG 1 1 17 10600 1 1 30 HIS H H -3.268 3.888 -3.828 1.00 . A A . 30 HIS H 1 1 17 10601 1 1 30 HIS HA H -4.094 5.514 -1.626 1.00 . A A . 30 HIS HA 1 1 17 10602 1 1 30 HIS HB2 H -3.748 4.001 0.180 1.00 . A A . 30 HIS HB2 1 1 17 10603 1 1 30 HIS HB3 H -4.824 3.185 -0.941 1.00 . A A . 30 HIS HB3 1 1 17 10604 1 1 30 HIS HD1 H -3.527 1.398 -2.593 1.00 . A A . 30 HIS HD1 1 1 17 10605 1 1 30 HIS HD2 H -1.619 2.529 0.925 1.00 . A A . 30 HIS HD2 1 1 17 10606 1 1 30 HIS HE1 H -1.727 -0.333 -2.164 1.00 . A A . 30 HIS HE1 1 1 17 10607 1 1 30 HIS N N -3.953 4.159 -3.180 1.00 . A A . 30 HIS N 1 1 17 10608 1 1 30 HIS ND1 N -2.908 1.429 -1.837 1.00 . A A . 30 HIS ND1 1 1 17 10609 1 1 30 HIS NE2 N -1.350 0.842 -0.441 1.00 . A A . 30 HIS NE2 1 1 17 10610 1 1 30 HIS O O -1.346 4.671 -2.846 1.00 . A A . 30 HIS O 1 1 17 10611 1 1 31 ARG C C 0.356 5.880 0.725 1.00 . A A . 31 ARG C 1 1 17 10612 1 1 31 ARG CA C -0.154 5.965 -0.715 1.00 . A A . 31 ARG CA 1 1 17 10613 1 1 31 ARG CB C 0.058 7.383 -1.256 1.00 . A A . 31 ARG CB 1 1 17 10614 1 1 31 ARG CD C -0.988 9.609 -1.755 1.00 . A A . 31 ARG CD 1 1 17 10615 1 1 31 ARG CG C -1.071 8.344 -0.919 1.00 . A A . 31 ARG CG 1 1 17 10616 1 1 31 ARG CZ C -0.079 11.680 -0.766 1.00 . A A . 31 ARG CZ 1 1 17 10617 1 1 31 ARG H H -2.168 5.802 -0.056 1.00 . A A . 31 ARG H 1 1 17 10618 1 1 31 ARG HA H 0.410 5.273 -1.322 1.00 . A A . 31 ARG HA 1 1 17 10619 1 1 31 ARG HB2 H 0.973 7.779 -0.845 1.00 . A A . 31 ARG HB2 1 1 17 10620 1 1 31 ARG HB3 H 0.151 7.333 -2.331 1.00 . A A . 31 ARG HB3 1 1 17 10621 1 1 31 ARG HD2 H -0.821 9.336 -2.786 1.00 . A A . 31 ARG HD2 1 1 17 10622 1 1 31 ARG HD3 H -1.925 10.142 -1.671 1.00 . A A . 31 ARG HD3 1 1 17 10623 1 1 31 ARG HE H 1.027 10.146 -1.429 1.00 . A A . 31 ARG HE 1 1 17 10624 1 1 31 ARG HG2 H -2.016 7.859 -1.109 1.00 . A A . 31 ARG HG2 1 1 17 10625 1 1 31 ARG HG3 H -1.003 8.610 0.125 1.00 . A A . 31 ARG HG3 1 1 17 10626 1 1 31 ARG HH11 H -2.105 11.633 -0.874 1.00 . A A . 31 ARG HH11 1 1 17 10627 1 1 31 ARG HH12 H -1.430 13.070 -0.162 1.00 . A A . 31 ARG HH12 1 1 17 10628 1 1 31 ARG HH21 H 1.902 12.022 -0.523 1.00 . A A . 31 ARG HH21 1 1 17 10629 1 1 31 ARG HH22 H 0.854 13.298 0.030 1.00 . A A . 31 ARG HH22 1 1 17 10630 1 1 31 ARG N N -1.561 5.589 -0.804 1.00 . A A . 31 ARG N 1 1 17 10631 1 1 31 ARG NE N 0.097 10.481 -1.314 1.00 . A A . 31 ARG NE 1 1 17 10632 1 1 31 ARG NH1 N -1.300 12.166 -0.591 1.00 . A A . 31 ARG NH1 1 1 17 10633 1 1 31 ARG NH2 N 0.976 12.391 -0.390 1.00 . A A . 31 ARG NH2 1 1 17 10634 1 1 31 ARG O O 1.415 6.416 1.051 1.00 . A A . 31 ARG O 1 1 17 10635 1 1 32 SER C C -0.544 3.736 3.533 1.00 . A A . 32 SER C 1 1 17 10636 1 1 32 SER CA C -0.009 5.050 2.978 1.00 . A A . 32 SER CA 1 1 17 10637 1 1 32 SER CB C -0.532 6.229 3.806 1.00 . A A . 32 SER CB 1 1 17 10638 1 1 32 SER H H -1.226 4.792 1.272 1.00 . A A . 32 SER H 1 1 17 10639 1 1 32 SER HA H 1.069 5.035 3.025 1.00 . A A . 32 SER HA 1 1 17 10640 1 1 32 SER HB2 H -1.025 5.853 4.691 1.00 . A A . 32 SER HB2 1 1 17 10641 1 1 32 SER HB3 H 0.296 6.859 4.096 1.00 . A A . 32 SER HB3 1 1 17 10642 1 1 32 SER HG H -1.046 7.843 2.801 1.00 . A A . 32 SER HG 1 1 17 10643 1 1 32 SER N N -0.396 5.205 1.582 1.00 . A A . 32 SER N 1 1 17 10644 1 1 32 SER O O -1.385 3.090 2.904 1.00 . A A . 32 SER O 1 1 17 10645 1 1 32 SER OG O -1.462 7.007 3.063 1.00 . A A . 32 SER OG 1 1 17 10646 1 1 33 LEU C C -1.866 2.220 5.990 1.00 . A A . 33 LEU C 1 1 17 10647 1 1 33 LEU CA C -0.479 2.108 5.357 1.00 . A A . 33 LEU CA 1 1 17 10648 1 1 33 LEU CB C 0.537 1.722 6.435 1.00 . A A . 33 LEU CB 1 1 17 10649 1 1 33 LEU CD1 C 2.789 0.714 6.837 1.00 . A A . 33 LEU CD1 1 1 17 10650 1 1 33 LEU CD2 C 0.843 -0.760 6.312 1.00 . A A . 33 LEU CD2 1 1 17 10651 1 1 33 LEU CG C 1.490 0.592 6.057 1.00 . A A . 33 LEU CG 1 1 17 10652 1 1 33 LEU H H 0.609 3.915 5.162 1.00 . A A . 33 LEU H 1 1 17 10653 1 1 33 LEU HA H -0.497 1.345 4.600 1.00 . A A . 33 LEU HA 1 1 17 10654 1 1 33 LEU HB2 H 1.126 2.596 6.672 1.00 . A A . 33 LEU HB2 1 1 17 10655 1 1 33 LEU HB3 H -0.006 1.424 7.318 1.00 . A A . 33 LEU HB3 1 1 17 10656 1 1 33 LEU HD11 H 2.962 -0.196 7.391 1.00 . A A . 33 LEU HD11 1 1 17 10657 1 1 33 LEU HD12 H 3.607 0.881 6.152 1.00 . A A . 33 LEU HD12 1 1 17 10658 1 1 33 LEU HD13 H 2.719 1.546 7.524 1.00 . A A . 33 LEU HD13 1 1 17 10659 1 1 33 LEU HD21 H -0.230 -0.649 6.331 1.00 . A A . 33 LEU HD21 1 1 17 10660 1 1 33 LEU HD22 H 1.120 -1.446 5.525 1.00 . A A . 33 LEU HD22 1 1 17 10661 1 1 33 LEU HD23 H 1.182 -1.147 7.261 1.00 . A A . 33 LEU HD23 1 1 17 10662 1 1 33 LEU HG H 1.721 0.663 5.005 1.00 . A A . 33 LEU HG 1 1 17 10663 1 1 33 LEU N N -0.076 3.361 4.722 1.00 . A A . 33 LEU N 1 1 17 10664 1 1 33 LEU O O -2.269 1.369 6.784 1.00 . A A . 33 LEU O 1 1 17 10665 1 1 34 SER C C -4.948 2.606 5.409 1.00 . A A . 34 SER C 1 1 17 10666 1 1 34 SER CA C -3.936 3.481 6.139 1.00 . A A . 34 SER CA 1 1 17 10667 1 1 34 SER CB C -4.308 4.949 5.975 1.00 . A A . 34 SER CB 1 1 17 10668 1 1 34 SER H H -2.221 3.906 4.988 1.00 . A A . 34 SER H 1 1 17 10669 1 1 34 SER HA H -3.940 3.228 7.187 1.00 . A A . 34 SER HA 1 1 17 10670 1 1 34 SER HB2 H -5.087 5.034 5.233 1.00 . A A . 34 SER HB2 1 1 17 10671 1 1 34 SER HB3 H -4.662 5.338 6.919 1.00 . A A . 34 SER HB3 1 1 17 10672 1 1 34 SER HG H -3.487 6.455 5.011 1.00 . A A . 34 SER HG 1 1 17 10673 1 1 34 SER N N -2.595 3.262 5.624 1.00 . A A . 34 SER N 1 1 17 10674 1 1 34 SER O O -6.068 2.399 5.882 1.00 . A A . 34 SER O 1 1 17 10675 1 1 34 SER OG O -3.185 5.709 5.550 1.00 . A A . 34 SER OG 1 1 17 10676 1 1 35 GLY C C -4.703 0.333 2.567 1.00 . A A . 35 GLY C 1 1 17 10677 1 1 35 GLY CA C -5.449 1.294 3.458 1.00 . A A . 35 GLY CA 1 1 17 10678 1 1 35 GLY H H -3.659 2.323 3.905 1.00 . A A . 35 GLY H 1 1 17 10679 1 1 35 GLY HA2 H -6.087 0.732 4.126 1.00 . A A . 35 GLY HA2 1 1 17 10680 1 1 35 GLY HA3 H -6.064 1.933 2.843 1.00 . A A . 35 GLY HA3 1 1 17 10681 1 1 35 GLY N N -4.558 2.115 4.241 1.00 . A A . 35 GLY N 1 1 17 10682 1 1 35 GLY O O -5.113 0.087 1.436 1.00 . A A . 35 GLY O 1 1 17 10683 1 1 36 CYS C C -3.478 -2.472 2.167 1.00 . A A . 36 CYS C 1 1 17 10684 1 1 36 CYS CA C -2.771 -1.124 2.330 1.00 . A A . 36 CYS CA 1 1 17 10685 1 1 36 CYS CB C -1.445 -1.319 3.061 1.00 . A A . 36 CYS CB 1 1 17 10686 1 1 36 CYS H H -3.317 0.078 3.976 1.00 . A A . 36 CYS H 1 1 17 10687 1 1 36 CYS HA H -2.579 -0.704 1.354 1.00 . A A . 36 CYS HA 1 1 17 10688 1 1 36 CYS HB2 H -1.625 -1.299 4.127 1.00 . A A . 36 CYS HB2 1 1 17 10689 1 1 36 CYS HB3 H -1.030 -2.279 2.787 1.00 . A A . 36 CYS HB3 1 1 17 10690 1 1 36 CYS N N -3.596 -0.187 3.074 1.00 . A A . 36 CYS N 1 1 17 10691 1 1 36 CYS O O -3.708 -3.182 3.148 1.00 . A A . 36 CYS O 1 1 17 10692 1 1 36 CYS SG S -0.198 -0.050 2.689 1.00 . A A . 36 CYS SG 1 1 17 10693 1 1 37 PRO C C -3.515 -5.298 0.741 1.00 . A A . 37 PRO C 1 1 17 10694 1 1 37 PRO CA C -4.479 -4.121 0.639 1.00 . A A . 37 PRO CA 1 1 17 10695 1 1 37 PRO CB C -4.979 -3.954 -0.797 1.00 . A A . 37 PRO CB 1 1 17 10696 1 1 37 PRO CD C -3.582 -2.064 -0.302 1.00 . A A . 37 PRO CD 1 1 17 10697 1 1 37 PRO CG C -4.062 -2.957 -1.416 1.00 . A A . 37 PRO CG 1 1 17 10698 1 1 37 PRO HA H -5.320 -4.286 1.301 1.00 . A A . 37 PRO HA 1 1 17 10699 1 1 37 PRO HB2 H -4.931 -4.905 -1.309 1.00 . A A . 37 PRO HB2 1 1 17 10700 1 1 37 PRO HB3 H -5.997 -3.598 -0.788 1.00 . A A . 37 PRO HB3 1 1 17 10701 1 1 37 PRO HD2 H -2.532 -1.845 -0.421 1.00 . A A . 37 PRO HD2 1 1 17 10702 1 1 37 PRO HD3 H -4.155 -1.148 -0.283 1.00 . A A . 37 PRO HD3 1 1 17 10703 1 1 37 PRO HG2 H -3.227 -3.463 -1.876 1.00 . A A . 37 PRO HG2 1 1 17 10704 1 1 37 PRO HG3 H -4.601 -2.376 -2.152 1.00 . A A . 37 PRO HG3 1 1 17 10705 1 1 37 PRO N N -3.816 -2.851 0.922 1.00 . A A . 37 PRO N 1 1 17 10706 1 1 37 PRO O O -3.930 -6.449 0.875 1.00 . A A . 37 PRO O 1 1 17 10707 1 1 38 ARG C C -0.250 -5.652 2.000 1.00 . A A . 38 ARG C 1 1 17 10708 1 1 38 ARG CA C -1.198 -6.014 0.863 1.00 . A A . 38 ARG CA 1 1 17 10709 1 1 38 ARG CB C -0.421 -6.172 -0.446 1.00 . A A . 38 ARG CB 1 1 17 10710 1 1 38 ARG CD C -1.462 -6.463 -2.690 1.00 . A A . 38 ARG CD 1 1 17 10711 1 1 38 ARG CG C -1.048 -7.157 -1.410 1.00 . A A . 38 ARG CG 1 1 17 10712 1 1 38 ARG CZ C -3.497 -6.551 -4.089 1.00 . A A . 38 ARG CZ 1 1 17 10713 1 1 38 ARG H H -1.954 -4.050 0.656 1.00 . A A . 38 ARG H 1 1 17 10714 1 1 38 ARG HA H -1.685 -6.947 1.098 1.00 . A A . 38 ARG HA 1 1 17 10715 1 1 38 ARG HB2 H -0.365 -5.214 -0.938 1.00 . A A . 38 ARG HB2 1 1 17 10716 1 1 38 ARG HB3 H 0.579 -6.510 -0.222 1.00 . A A . 38 ARG HB3 1 1 17 10717 1 1 38 ARG HD2 H -1.140 -5.433 -2.638 1.00 . A A . 38 ARG HD2 1 1 17 10718 1 1 38 ARG HD3 H -0.974 -6.948 -3.521 1.00 . A A . 38 ARG HD3 1 1 17 10719 1 1 38 ARG HE H -3.477 -6.494 -2.091 1.00 . A A . 38 ARG HE 1 1 17 10720 1 1 38 ARG HG2 H -0.332 -7.932 -1.645 1.00 . A A . 38 ARG HG2 1 1 17 10721 1 1 38 ARG HG3 H -1.922 -7.596 -0.950 1.00 . A A . 38 ARG HG3 1 1 17 10722 1 1 38 ARG HH11 H -1.755 -6.596 -5.139 1.00 . A A . 38 ARG HH11 1 1 17 10723 1 1 38 ARG HH12 H -3.209 -6.657 -6.093 1.00 . A A . 38 ARG HH12 1 1 17 10724 1 1 38 ARG HH21 H -5.386 -6.576 -3.336 1.00 . A A . 38 ARG HH21 1 1 17 10725 1 1 38 ARG HH22 H -5.276 -6.604 -5.073 1.00 . A A . 38 ARG HH22 1 1 17 10726 1 1 38 ARG N N -2.225 -4.994 0.725 1.00 . A A . 38 ARG N 1 1 17 10727 1 1 38 ARG NE N -2.911 -6.502 -2.894 1.00 . A A . 38 ARG NE 1 1 17 10728 1 1 38 ARG NH1 N -2.762 -6.597 -5.196 1.00 . A A . 38 ARG NH1 1 1 17 10729 1 1 38 ARG NH2 N -4.824 -6.581 -4.175 1.00 . A A . 38 ARG NH2 1 1 17 10730 1 1 38 ARG O O 0.946 -5.931 1.939 1.00 . A A . 38 ARG O 1 1 17 10731 1 1 39 ALA C C 0.764 -5.631 4.819 1.00 . A A . 39 ALA C 1 1 17 10732 1 1 39 ALA CA C -0.018 -4.509 4.151 1.00 . A A . 39 ALA CA 1 1 17 10733 1 1 39 ALA CB C -0.936 -3.851 5.166 1.00 . A A . 39 ALA CB 1 1 17 10734 1 1 39 ALA H H -1.750 -4.762 2.968 1.00 . A A . 39 ALA H 1 1 17 10735 1 1 39 ALA HA H 0.676 -3.762 3.795 1.00 . A A . 39 ALA HA 1 1 17 10736 1 1 39 ALA HB1 H -0.563 -2.865 5.402 1.00 . A A . 39 ALA HB1 1 1 17 10737 1 1 39 ALA HB2 H -1.930 -3.770 4.752 1.00 . A A . 39 ALA HB2 1 1 17 10738 1 1 39 ALA HB3 H -0.969 -4.449 6.064 1.00 . A A . 39 ALA HB3 1 1 17 10739 1 1 39 ALA N N -0.797 -4.980 3.009 1.00 . A A . 39 ALA N 1 1 17 10740 1 1 39 ALA O O 0.177 -6.584 5.339 1.00 . A A . 39 ALA O 1 1 17 10741 1 1 40 LYS C C 2.798 -7.838 4.914 1.00 . A A . 40 LYS C 1 1 17 10742 1 1 40 LYS CA C 2.984 -6.431 5.486 1.00 . A A . 40 LYS CA 1 1 17 10743 1 1 40 LYS CB C 2.773 -6.428 7.003 1.00 . A A . 40 LYS CB 1 1 17 10744 1 1 40 LYS CD C 4.611 -4.960 7.897 1.00 . A A . 40 LYS CD 1 1 17 10745 1 1 40 LYS CE C 4.956 -3.637 8.564 1.00 . A A . 40 LYS CE 1 1 17 10746 1 1 40 LYS CG C 3.114 -5.102 7.666 1.00 . A A . 40 LYS CG 1 1 17 10747 1 1 40 LYS H H 2.470 -4.674 4.433 1.00 . A A . 40 LYS H 1 1 17 10748 1 1 40 LYS HA H 3.995 -6.111 5.279 1.00 . A A . 40 LYS HA 1 1 17 10749 1 1 40 LYS HB2 H 1.736 -6.652 7.210 1.00 . A A . 40 LYS HB2 1 1 17 10750 1 1 40 LYS HB3 H 3.392 -7.194 7.442 1.00 . A A . 40 LYS HB3 1 1 17 10751 1 1 40 LYS HD2 H 4.945 -5.768 8.531 1.00 . A A . 40 LYS HD2 1 1 17 10752 1 1 40 LYS HD3 H 5.119 -5.015 6.945 1.00 . A A . 40 LYS HD3 1 1 17 10753 1 1 40 LYS HE2 H 4.661 -3.684 9.600 1.00 . A A . 40 LYS HE2 1 1 17 10754 1 1 40 LYS HE3 H 6.024 -3.485 8.500 1.00 . A A . 40 LYS HE3 1 1 17 10755 1 1 40 LYS HG2 H 2.781 -4.295 7.030 1.00 . A A . 40 LYS HG2 1 1 17 10756 1 1 40 LYS HG3 H 2.605 -5.044 8.618 1.00 . A A . 40 LYS HG3 1 1 17 10757 1 1 40 LYS HZ1 H 4.854 -1.630 7.986 1.00 . A A . 40 LYS HZ1 1 1 17 10758 1 1 40 LYS HZ2 H 3.353 -2.308 8.392 1.00 . A A . 40 LYS HZ2 1 1 17 10759 1 1 40 LYS HZ3 H 4.086 -2.694 6.909 1.00 . A A . 40 LYS HZ3 1 1 17 10760 1 1 40 LYS N N 2.086 -5.476 4.844 1.00 . A A . 40 LYS N 1 1 17 10761 1 1 40 LYS NZ N 4.265 -2.489 7.919 1.00 . A A . 40 LYS NZ 1 1 17 10762 1 1 40 LYS O O 3.287 -8.131 3.825 1.00 . A A . 40 LYS O 1 1 17 10763 1 1 41 LYS C C 0.666 -10.647 6.038 1.00 . A A . 41 LYS C 1 1 17 10764 1 1 41 LYS CA C 1.746 -10.026 5.156 1.00 . A A . 41 LYS CA 1 1 17 10765 1 1 41 LYS CB C 3.011 -10.895 5.151 1.00 . A A . 41 LYS CB 1 1 17 10766 1 1 41 LYS CD C 4.502 -11.004 3.127 1.00 . A A . 41 LYS CD 1 1 17 10767 1 1 41 LYS CE C 4.313 -10.946 1.621 1.00 . A A . 41 LYS CE 1 1 17 10768 1 1 41 LYS CG C 3.276 -11.579 3.818 1.00 . A A . 41 LYS CG 1 1 17 10769 1 1 41 LYS H H 1.641 -8.360 6.454 1.00 . A A . 41 LYS H 1 1 17 10770 1 1 41 LYS HA H 1.366 -9.950 4.147 1.00 . A A . 41 LYS HA 1 1 17 10771 1 1 41 LYS HB2 H 3.860 -10.273 5.387 1.00 . A A . 41 LYS HB2 1 1 17 10772 1 1 41 LYS HB3 H 2.913 -11.659 5.908 1.00 . A A . 41 LYS HB3 1 1 17 10773 1 1 41 LYS HD2 H 4.676 -10.004 3.496 1.00 . A A . 41 LYS HD2 1 1 17 10774 1 1 41 LYS HD3 H 5.358 -11.625 3.350 1.00 . A A . 41 LYS HD3 1 1 17 10775 1 1 41 LYS HE2 H 4.682 -11.865 1.189 1.00 . A A . 41 LYS HE2 1 1 17 10776 1 1 41 LYS HE3 H 3.258 -10.848 1.409 1.00 . A A . 41 LYS HE3 1 1 17 10777 1 1 41 LYS HG2 H 3.435 -12.634 3.991 1.00 . A A . 41 LYS HG2 1 1 17 10778 1 1 41 LYS HG3 H 2.417 -11.444 3.178 1.00 . A A . 41 LYS HG3 1 1 17 10779 1 1 41 LYS HZ1 H 5.900 -10.140 0.523 1.00 . A A . 41 LYS HZ1 1 1 17 10780 1 1 41 LYS HZ2 H 5.312 -9.108 1.734 1.00 . A A . 41 LYS HZ2 1 1 17 10781 1 1 41 LYS HZ3 H 4.426 -9.329 0.303 1.00 . A A . 41 LYS HZ3 1 1 17 10782 1 1 41 LYS N N 2.049 -8.677 5.620 1.00 . A A . 41 LYS N 1 1 17 10783 1 1 41 LYS NZ N 5.038 -9.802 1.004 1.00 . A A . 41 LYS NZ 1 1 17 10784 1 1 41 LYS O O -0.459 -10.154 6.083 1.00 . A A . 41 LYS O 1 1 17 10785 1 1 42 SER C C 0.235 -11.708 9.107 1.00 . A A . 42 SER C 1 1 17 10786 1 1 42 SER CA C 0.096 -12.316 7.715 1.00 . A A . 42 SER CA 1 1 17 10787 1 1 42 SER CB C 0.364 -13.820 7.759 1.00 . A A . 42 SER CB 1 1 17 10788 1 1 42 SER H H 1.951 -11.997 6.755 1.00 . A A . 42 SER H 1 1 17 10789 1 1 42 SER HA H -0.906 -12.145 7.355 1.00 . A A . 42 SER HA 1 1 17 10790 1 1 42 SER HB2 H 0.618 -14.112 8.767 1.00 . A A . 42 SER HB2 1 1 17 10791 1 1 42 SER HB3 H -0.522 -14.351 7.442 1.00 . A A . 42 SER HB3 1 1 17 10792 1 1 42 SER HG H 1.078 -14.457 6.041 1.00 . A A . 42 SER HG 1 1 17 10793 1 1 42 SER N N 1.025 -11.678 6.791 1.00 . A A . 42 SER N 1 1 17 10794 1 1 42 SER O O 0.504 -12.404 10.086 1.00 . A A . 42 SER O 1 1 17 10795 1 1 42 SER OG O 1.437 -14.167 6.896 1.00 . A A . 42 SER OG 1 1 17 10796 1 1 43 GLY C C 1.111 -8.411 10.214 1.00 . A A . 43 GLY C 1 1 17 10797 1 1 43 GLY CA C 0.323 -9.686 10.415 1.00 . A A . 43 GLY CA 1 1 17 10798 1 1 43 GLY H H -0.025 -9.887 8.342 1.00 . A A . 43 GLY H 1 1 17 10799 1 1 43 GLY HA2 H -0.643 -9.443 10.836 1.00 . A A . 43 GLY HA2 1 1 17 10800 1 1 43 GLY HA3 H 0.857 -10.324 11.103 1.00 . A A . 43 GLY HA3 1 1 17 10801 1 1 43 GLY N N 0.131 -10.392 9.168 1.00 . A A . 43 GLY N 1 1 17 10802 1 1 43 GLY O O 2.114 -8.406 9.500 1.00 . A A . 43 GLY O 1 1 17 10803 1 1 44 LEU C C 2.370 -5.772 11.536 1.00 . A A . 44 LEU C 1 1 17 10804 1 1 44 LEU CA C 1.222 -6.009 10.560 1.00 . A A . 44 LEU CA 1 1 17 10805 1 1 44 LEU CB C 0.168 -4.909 10.710 1.00 . A A . 44 LEU CB 1 1 17 10806 1 1 44 LEU CD1 C -2.289 -4.396 10.764 1.00 . A A . 44 LEU CD1 1 1 17 10807 1 1 44 LEU CD2 C -1.194 -5.052 8.612 1.00 . A A . 44 LEU CD2 1 1 17 10808 1 1 44 LEU CG C -1.204 -5.244 10.119 1.00 . A A . 44 LEU CG 1 1 17 10809 1 1 44 LEU H H -0.231 -7.380 11.272 1.00 . A A . 44 LEU H 1 1 17 10810 1 1 44 LEU HA H 1.614 -5.983 9.554 1.00 . A A . 44 LEU HA 1 1 17 10811 1 1 44 LEU HB2 H 0.043 -4.703 11.762 1.00 . A A . 44 LEU HB2 1 1 17 10812 1 1 44 LEU HB3 H 0.537 -4.018 10.225 1.00 . A A . 44 LEU HB3 1 1 17 10813 1 1 44 LEU HD11 H -2.571 -4.834 11.710 1.00 . A A . 44 LEU HD11 1 1 17 10814 1 1 44 LEU HD12 H -1.917 -3.395 10.926 1.00 . A A . 44 LEU HD12 1 1 17 10815 1 1 44 LEU HD13 H -3.151 -4.359 10.113 1.00 . A A . 44 LEU HD13 1 1 17 10816 1 1 44 LEU HD21 H -1.382 -5.998 8.128 1.00 . A A . 44 LEU HD21 1 1 17 10817 1 1 44 LEU HD22 H -1.964 -4.346 8.335 1.00 . A A . 44 LEU HD22 1 1 17 10818 1 1 44 LEU HD23 H -0.233 -4.673 8.303 1.00 . A A . 44 LEU HD23 1 1 17 10819 1 1 44 LEU HG H -1.429 -6.281 10.319 1.00 . A A . 44 LEU HG 1 1 17 10820 1 1 44 LEU N N 0.610 -7.317 10.764 1.00 . A A . 44 LEU N 1 1 17 10821 1 1 44 LEU O O 3.293 -5.012 11.249 1.00 . A A . 44 LEU O 1 1 17 10822 1 1 45 ARG C C 4.443 -7.280 13.546 1.00 . A A . 45 ARG C 1 1 17 10823 1 1 45 ARG CA C 3.324 -6.256 13.722 1.00 . A A . 45 ARG CA 1 1 17 10824 1 1 45 ARG CB C 2.698 -6.392 15.114 1.00 . A A . 45 ARG CB 1 1 17 10825 1 1 45 ARG CD C 1.237 -7.774 16.620 1.00 . A A . 45 ARG CD 1 1 17 10826 1 1 45 ARG CG C 2.158 -7.782 15.412 1.00 . A A . 45 ARG CG 1 1 17 10827 1 1 45 ARG CZ C 0.782 -10.078 17.387 1.00 . A A . 45 ARG CZ 1 1 17 10828 1 1 45 ARG H H 1.529 -6.997 12.868 1.00 . A A . 45 ARG H 1 1 17 10829 1 1 45 ARG HA H 3.742 -5.265 13.621 1.00 . A A . 45 ARG HA 1 1 17 10830 1 1 45 ARG HB2 H 3.447 -6.156 15.857 1.00 . A A . 45 ARG HB2 1 1 17 10831 1 1 45 ARG HB3 H 1.885 -5.688 15.201 1.00 . A A . 45 ARG HB3 1 1 17 10832 1 1 45 ARG HD2 H 1.838 -7.695 17.513 1.00 . A A . 45 ARG HD2 1 1 17 10833 1 1 45 ARG HD3 H 0.580 -6.919 16.553 1.00 . A A . 45 ARG HD3 1 1 17 10834 1 1 45 ARG HE H -0.435 -8.992 16.219 1.00 . A A . 45 ARG HE 1 1 17 10835 1 1 45 ARG HG2 H 1.607 -8.136 14.554 1.00 . A A . 45 ARG HG2 1 1 17 10836 1 1 45 ARG HG3 H 2.988 -8.445 15.608 1.00 . A A . 45 ARG HG3 1 1 17 10837 1 1 45 ARG HH11 H 2.554 -9.318 18.029 1.00 . A A . 45 ARG HH11 1 1 17 10838 1 1 45 ARG HH12 H 2.194 -10.938 18.561 1.00 . A A . 45 ARG HH12 1 1 17 10839 1 1 45 ARG HH21 H -0.888 -11.136 16.924 1.00 . A A . 45 ARG HH21 1 1 17 10840 1 1 45 ARG HH22 H 0.261 -11.955 17.938 1.00 . A A . 45 ARG HH22 1 1 17 10841 1 1 45 ARG N N 2.303 -6.416 12.692 1.00 . A A . 45 ARG N 1 1 17 10842 1 1 45 ARG NE N 0.426 -8.990 16.703 1.00 . A A . 45 ARG NE 1 1 17 10843 1 1 45 ARG NH1 N 1.935 -10.112 18.043 1.00 . A A . 45 ARG NH1 1 1 17 10844 1 1 45 ARG NH2 N -0.011 -11.140 17.418 1.00 . A A . 45 ARG NH2 1 1 17 10845 1 1 45 ARG O O 5.253 -7.495 14.452 1.00 . A A . 45 ARG O 1 1 17 10846 1 1 46 VAL C C 6.420 -8.418 10.964 1.00 . A A . 46 VAL C 1 1 17 10847 1 1 46 VAL CA C 5.511 -8.898 12.085 1.00 . A A . 46 VAL CA 1 1 17 10848 1 1 46 VAL CB C 4.896 -10.256 11.688 1.00 . A A . 46 VAL CB 1 1 17 10849 1 1 46 VAL CG1 C 5.791 -11.398 12.139 1.00 . A A . 46 VAL CG1 1 1 17 10850 1 1 46 VAL CG2 C 3.497 -10.414 12.266 1.00 . A A . 46 VAL CG2 1 1 17 10851 1 1 46 VAL H H 3.843 -7.667 11.683 1.00 . A A . 46 VAL H 1 1 17 10852 1 1 46 VAL HA H 6.105 -9.042 12.978 1.00 . A A . 46 VAL HA 1 1 17 10853 1 1 46 VAL HB H 4.822 -10.293 10.610 1.00 . A A . 46 VAL HB 1 1 17 10854 1 1 46 VAL HG11 H 6.782 -11.020 12.341 1.00 . A A . 46 VAL HG11 1 1 17 10855 1 1 46 VAL HG12 H 5.385 -11.841 13.036 1.00 . A A . 46 VAL HG12 1 1 17 10856 1 1 46 VAL HG13 H 5.843 -12.144 11.360 1.00 . A A . 46 VAL HG13 1 1 17 10857 1 1 46 VAL HG21 H 3.024 -9.444 12.333 1.00 . A A . 46 VAL HG21 1 1 17 10858 1 1 46 VAL HG22 H 2.913 -11.056 11.624 1.00 . A A . 46 VAL HG22 1 1 17 10859 1 1 46 VAL HG23 H 3.562 -10.852 13.253 1.00 . A A . 46 VAL HG23 1 1 17 10860 1 1 46 VAL N N 4.492 -7.902 12.377 1.00 . A A . 46 VAL N 1 1 17 10861 1 1 46 VAL O O 7.604 -8.812 10.940 1.00 . A A . 46 VAL O 1 1 17 10862 1 1 46 VAL OXT O 5.953 -7.629 10.120 1.00 . A A . 46 VAL OXT 1 1 17 10863 2 2 1 ZN ZN ZN 0.099 -0.111 0.445 1.00 . B A . 47 ZN ZN 1 1 18 10864 1 1 1 GLY C C 9.944 19.241 -9.743 1.00 . A A . 1 GLY C 1 1 18 10865 1 1 1 GLY CA C 8.576 19.595 -10.287 1.00 . A A . 1 GLY CA 1 1 18 10866 1 1 1 GLY H1 H 9.021 21.523 -9.636 1.00 . A A . 1 GLY H1 1 1 18 10867 1 1 1 GLY H2 H 7.501 20.960 -9.136 1.00 . A A . 1 GLY H2 1 1 18 10868 1 1 1 GLY H3 H 7.735 21.450 -10.741 1.00 . A A . 1 GLY H3 1 1 18 10869 1 1 1 GLY HA2 H 7.848 18.904 -9.886 1.00 . A A . 1 GLY HA2 1 1 18 10870 1 1 1 GLY HA3 H 8.593 19.503 -11.364 1.00 . A A . 1 GLY HA3 1 1 18 10871 1 1 1 GLY N N 8.180 20.977 -9.925 1.00 . A A . 1 GLY N 1 1 18 10872 1 1 1 GLY O O 10.221 19.466 -8.562 1.00 . A A . 1 GLY O 1 1 18 10873 1 1 2 SER C C 12.164 17.358 -9.044 1.00 . A A . 2 SER C 1 1 18 10874 1 1 2 SER CA C 12.158 18.315 -10.238 1.00 . A A . 2 SER CA 1 1 18 10875 1 1 2 SER CB C 12.998 19.558 -9.927 1.00 . A A . 2 SER CB 1 1 18 10876 1 1 2 SER H H 10.500 18.550 -11.536 1.00 . A A . 2 SER H 1 1 18 10877 1 1 2 SER HA H 12.593 17.807 -11.085 1.00 . A A . 2 SER HA 1 1 18 10878 1 1 2 SER HB2 H 12.657 19.998 -9.003 1.00 . A A . 2 SER HB2 1 1 18 10879 1 1 2 SER HB3 H 14.036 19.274 -9.829 1.00 . A A . 2 SER HB3 1 1 18 10880 1 1 2 SER HG H 11.942 20.704 -11.133 1.00 . A A . 2 SER HG 1 1 18 10881 1 1 2 SER N N 10.799 18.701 -10.608 1.00 . A A . 2 SER N 1 1 18 10882 1 1 2 SER O O 12.727 17.658 -7.991 1.00 . A A . 2 SER O 1 1 18 10883 1 1 2 SER OG O 12.883 20.526 -10.961 1.00 . A A . 2 SER OG 1 1 18 10884 1 1 3 MET C C 12.065 13.927 -8.541 1.00 . A A . 3 MET C 1 1 18 10885 1 1 3 MET CA C 11.414 15.240 -8.130 1.00 . A A . 3 MET CA 1 1 18 10886 1 1 3 MET CB C 9.955 15.009 -7.741 1.00 . A A . 3 MET CB 1 1 18 10887 1 1 3 MET CE C 8.359 17.523 -6.437 1.00 . A A . 3 MET CE 1 1 18 10888 1 1 3 MET CG C 9.704 15.107 -6.246 1.00 . A A . 3 MET CG 1 1 18 10889 1 1 3 MET H H 11.037 16.046 -10.056 1.00 . A A . 3 MET H 1 1 18 10890 1 1 3 MET HA H 11.945 15.634 -7.278 1.00 . A A . 3 MET HA 1 1 18 10891 1 1 3 MET HB2 H 9.341 15.747 -8.236 1.00 . A A . 3 MET HB2 1 1 18 10892 1 1 3 MET HB3 H 9.658 14.025 -8.071 1.00 . A A . 3 MET HB3 1 1 18 10893 1 1 3 MET HE1 H 8.976 17.507 -7.322 1.00 . A A . 3 MET HE1 1 1 18 10894 1 1 3 MET HE2 H 7.404 17.971 -6.673 1.00 . A A . 3 MET HE2 1 1 18 10895 1 1 3 MET HE3 H 8.848 18.103 -5.666 1.00 . A A . 3 MET HE3 1 1 18 10896 1 1 3 MET HG2 H 9.733 14.115 -5.823 1.00 . A A . 3 MET HG2 1 1 18 10897 1 1 3 MET HG3 H 10.482 15.710 -5.801 1.00 . A A . 3 MET HG3 1 1 18 10898 1 1 3 MET N N 11.503 16.220 -9.202 1.00 . A A . 3 MET N 1 1 18 10899 1 1 3 MET O O 11.859 12.895 -7.898 1.00 . A A . 3 MET O 1 1 18 10900 1 1 3 MET SD S 8.108 15.848 -5.852 1.00 . A A . 3 MET SD 1 1 18 10901 1 1 4 ALA C C 12.690 11.688 -10.485 1.00 . A A . 4 ALA C 1 1 18 10902 1 1 4 ALA CA C 13.624 12.837 -10.091 1.00 . A A . 4 ALA CA 1 1 18 10903 1 1 4 ALA CB C 14.659 12.376 -9.071 1.00 . A A . 4 ALA CB 1 1 18 10904 1 1 4 ALA H H 13.012 14.860 -10.032 1.00 . A A . 4 ALA H 1 1 18 10905 1 1 4 ALA HA H 14.158 13.158 -10.975 1.00 . A A . 4 ALA HA 1 1 18 10906 1 1 4 ALA HB1 H 15.650 12.508 -9.479 1.00 . A A . 4 ALA HB1 1 1 18 10907 1 1 4 ALA HB2 H 14.562 12.962 -8.169 1.00 . A A . 4 ALA HB2 1 1 18 10908 1 1 4 ALA HB3 H 14.500 11.332 -8.844 1.00 . A A . 4 ALA HB3 1 1 18 10909 1 1 4 ALA N N 12.882 13.993 -9.590 1.00 . A A . 4 ALA N 1 1 18 10910 1 1 4 ALA O O 12.013 11.760 -11.510 1.00 . A A . 4 ALA O 1 1 18 10911 1 1 5 ALA C C 10.608 9.433 -9.052 1.00 . A A . 5 ALA C 1 1 18 10912 1 1 5 ALA CA C 11.822 9.475 -9.972 1.00 . A A . 5 ALA CA 1 1 18 10913 1 1 5 ALA CB C 12.630 8.191 -9.849 1.00 . A A . 5 ALA CB 1 1 18 10914 1 1 5 ALA H H 13.218 10.625 -8.870 1.00 . A A . 5 ALA H 1 1 18 10915 1 1 5 ALA HA H 11.482 9.560 -10.994 1.00 . A A . 5 ALA HA 1 1 18 10916 1 1 5 ALA HB1 H 12.803 7.976 -8.804 1.00 . A A . 5 ALA HB1 1 1 18 10917 1 1 5 ALA HB2 H 12.084 7.375 -10.299 1.00 . A A . 5 ALA HB2 1 1 18 10918 1 1 5 ALA HB3 H 13.577 8.312 -10.353 1.00 . A A . 5 ALA HB3 1 1 18 10919 1 1 5 ALA N N 12.660 10.631 -9.681 1.00 . A A . 5 ALA N 1 1 18 10920 1 1 5 ALA O O 9.509 9.057 -9.466 1.00 . A A . 5 ALA O 1 1 18 10921 1 1 6 HIS C C 8.938 11.136 -6.899 1.00 . A A . 6 HIS C 1 1 18 10922 1 1 6 HIS CA C 9.729 9.833 -6.821 1.00 . A A . 6 HIS CA 1 1 18 10923 1 1 6 HIS CB C 10.284 9.630 -5.405 1.00 . A A . 6 HIS CB 1 1 18 10924 1 1 6 HIS CD2 C 8.270 8.358 -4.355 1.00 . A A . 6 HIS CD2 1 1 18 10925 1 1 6 HIS CE1 C 8.057 9.555 -2.534 1.00 . A A . 6 HIS CE1 1 1 18 10926 1 1 6 HIS CG C 9.229 9.317 -4.381 1.00 . A A . 6 HIS CG 1 1 18 10927 1 1 6 HIS H H 11.706 10.123 -7.529 1.00 . A A . 6 HIS H 1 1 18 10928 1 1 6 HIS HA H 9.067 9.014 -7.059 1.00 . A A . 6 HIS HA 1 1 18 10929 1 1 6 HIS HB2 H 10.989 8.811 -5.417 1.00 . A A . 6 HIS HB2 1 1 18 10930 1 1 6 HIS HB3 H 10.793 10.530 -5.094 1.00 . A A . 6 HIS HB3 1 1 18 10931 1 1 6 HIS HD1 H 9.614 10.824 -2.946 1.00 . A A . 6 HIS HD1 1 1 18 10932 1 1 6 HIS HD2 H 8.097 7.601 -5.107 1.00 . A A . 6 HIS HD2 1 1 18 10933 1 1 6 HIS HE1 H 7.699 9.928 -1.586 1.00 . A A . 6 HIS HE1 1 1 18 10934 1 1 6 HIS HE2 H 6.844 7.928 -2.859 1.00 . A A . 6 HIS HE2 1 1 18 10935 1 1 6 HIS N N 10.807 9.828 -7.800 1.00 . A A . 6 HIS N 1 1 18 10936 1 1 6 HIS ND1 N 9.065 10.046 -3.225 1.00 . A A . 6 HIS ND1 1 1 18 10937 1 1 6 HIS NE2 N 7.556 8.531 -3.197 1.00 . A A . 6 HIS NE2 1 1 18 10938 1 1 6 HIS O O 8.895 11.911 -5.944 1.00 . A A . 6 HIS O 1 1 18 10939 1 1 7 SER C C 6.189 12.433 -7.452 1.00 . A A . 7 SER C 1 1 18 10940 1 1 7 SER CA C 7.492 12.555 -8.241 1.00 . A A . 7 SER CA 1 1 18 10941 1 1 7 SER CB C 7.201 12.750 -9.730 1.00 . A A . 7 SER CB 1 1 18 10942 1 1 7 SER H H 8.390 10.715 -8.776 1.00 . A A . 7 SER H 1 1 18 10943 1 1 7 SER HA H 8.047 13.407 -7.873 1.00 . A A . 7 SER HA 1 1 18 10944 1 1 7 SER HB2 H 6.132 12.784 -9.885 1.00 . A A . 7 SER HB2 1 1 18 10945 1 1 7 SER HB3 H 7.644 13.677 -10.066 1.00 . A A . 7 SER HB3 1 1 18 10946 1 1 7 SER HG H 7.154 10.909 -10.411 1.00 . A A . 7 SER HG 1 1 18 10947 1 1 7 SER N N 8.309 11.367 -8.044 1.00 . A A . 7 SER N 1 1 18 10948 1 1 7 SER O O 5.813 13.335 -6.703 1.00 . A A . 7 SER O 1 1 18 10949 1 1 7 SER OG O 7.740 11.679 -10.493 1.00 . A A . 7 SER OG 1 1 18 10950 1 1 8 ALA C C 4.561 9.740 -5.932 1.00 . A A . 8 ALA C 1 1 18 10951 1 1 8 ALA CA C 4.361 10.984 -6.786 1.00 . A A . 8 ALA CA 1 1 18 10952 1 1 8 ALA CB C 3.171 10.802 -7.715 1.00 . A A . 8 ALA CB 1 1 18 10953 1 1 8 ALA H H 5.948 10.562 -8.110 1.00 . A A . 8 ALA H 1 1 18 10954 1 1 8 ALA HA H 4.162 11.828 -6.141 1.00 . A A . 8 ALA HA 1 1 18 10955 1 1 8 ALA HB1 H 2.258 10.856 -7.143 1.00 . A A . 8 ALA HB1 1 1 18 10956 1 1 8 ALA HB2 H 3.176 11.583 -8.459 1.00 . A A . 8 ALA HB2 1 1 18 10957 1 1 8 ALA HB3 H 3.237 9.840 -8.201 1.00 . A A . 8 ALA HB3 1 1 18 10958 1 1 8 ALA N N 5.563 11.269 -7.549 1.00 . A A . 8 ALA N 1 1 18 10959 1 1 8 ALA O O 5.324 8.842 -6.299 1.00 . A A . 8 ALA O 1 1 18 10960 1 1 9 ASP C C 2.977 7.502 -4.263 1.00 . A A . 9 ASP C 1 1 18 10961 1 1 9 ASP CA C 3.983 8.569 -3.877 1.00 . A A . 9 ASP CA 1 1 18 10962 1 1 9 ASP CB C 3.748 9.034 -2.439 1.00 . A A . 9 ASP CB 1 1 18 10963 1 1 9 ASP CG C 4.540 8.226 -1.436 1.00 . A A . 9 ASP CG 1 1 18 10964 1 1 9 ASP H H 3.301 10.457 -4.559 1.00 . A A . 9 ASP H 1 1 18 10965 1 1 9 ASP HA H 4.971 8.141 -3.954 1.00 . A A . 9 ASP HA 1 1 18 10966 1 1 9 ASP HB2 H 4.040 10.069 -2.351 1.00 . A A . 9 ASP HB2 1 1 18 10967 1 1 9 ASP HB3 H 2.699 8.937 -2.203 1.00 . A A . 9 ASP HB3 1 1 18 10968 1 1 9 ASP N N 3.886 9.699 -4.794 1.00 . A A . 9 ASP N 1 1 18 10969 1 1 9 ASP O O 1.968 7.297 -3.590 1.00 . A A . 9 ASP O 1 1 18 10970 1 1 9 ASP OD1 O 5.481 7.514 -1.847 1.00 . A A . 9 ASP OD1 1 1 18 10971 1 1 9 ASP OD2 O 4.254 8.333 -0.226 1.00 . A A . 9 ASP OD2 1 1 18 10972 1 1 10 LEU C C 2.633 4.521 -5.144 1.00 . A A . 10 LEU C 1 1 18 10973 1 1 10 LEU CA C 2.376 5.814 -5.892 1.00 . A A . 10 LEU CA 1 1 18 10974 1 1 10 LEU CB C 2.610 5.608 -7.386 1.00 . A A . 10 LEU CB 1 1 18 10975 1 1 10 LEU CD1 C 3.747 6.918 -9.194 1.00 . A A . 10 LEU CD1 1 1 18 10976 1 1 10 LEU CD2 C 1.259 6.995 -8.973 1.00 . A A . 10 LEU CD2 1 1 18 10977 1 1 10 LEU CG C 2.578 6.885 -8.225 1.00 . A A . 10 LEU CG 1 1 18 10978 1 1 10 LEU H H 4.055 7.097 -5.886 1.00 . A A . 10 LEU H 1 1 18 10979 1 1 10 LEU HA H 1.355 6.113 -5.728 1.00 . A A . 10 LEU HA 1 1 18 10980 1 1 10 LEU HB2 H 3.575 5.139 -7.516 1.00 . A A . 10 LEU HB2 1 1 18 10981 1 1 10 LEU HB3 H 1.849 4.938 -7.759 1.00 . A A . 10 LEU HB3 1 1 18 10982 1 1 10 LEU HD11 H 4.354 6.034 -9.060 1.00 . A A . 10 LEU HD11 1 1 18 10983 1 1 10 LEU HD12 H 3.374 6.948 -10.206 1.00 . A A . 10 LEU HD12 1 1 18 10984 1 1 10 LEU HD13 H 4.346 7.798 -9.005 1.00 . A A . 10 LEU HD13 1 1 18 10985 1 1 10 LEU HD21 H 0.543 7.528 -8.364 1.00 . A A . 10 LEU HD21 1 1 18 10986 1 1 10 LEU HD22 H 1.414 7.532 -9.896 1.00 . A A . 10 LEU HD22 1 1 18 10987 1 1 10 LEU HD23 H 0.883 6.006 -9.189 1.00 . A A . 10 LEU HD23 1 1 18 10988 1 1 10 LEU HG H 2.664 7.740 -7.570 1.00 . A A . 10 LEU HG 1 1 18 10989 1 1 10 LEU N N 3.244 6.860 -5.385 1.00 . A A . 10 LEU N 1 1 18 10990 1 1 10 LEU O O 1.754 3.664 -5.037 1.00 . A A . 10 LEU O 1 1 18 10991 1 1 11 LYS C C 4.328 3.504 -2.379 1.00 . A A . 11 LYS C 1 1 18 10992 1 1 11 LYS CA C 4.208 3.219 -3.865 1.00 . A A . 11 LYS CA 1 1 18 10993 1 1 11 LYS CB C 5.502 2.624 -4.398 1.00 . A A . 11 LYS CB 1 1 18 10994 1 1 11 LYS CD C 4.414 0.358 -4.556 1.00 . A A . 11 LYS CD 1 1 18 10995 1 1 11 LYS CE C 5.049 -0.128 -3.261 1.00 . A A . 11 LYS CE 1 1 18 10996 1 1 11 LYS CG C 5.274 1.400 -5.263 1.00 . A A . 11 LYS CG 1 1 18 10997 1 1 11 LYS H H 4.489 5.122 -4.715 1.00 . A A . 11 LYS H 1 1 18 10998 1 1 11 LYS HA H 3.419 2.495 -4.005 1.00 . A A . 11 LYS HA 1 1 18 10999 1 1 11 LYS HB2 H 6.016 3.368 -4.987 1.00 . A A . 11 LYS HB2 1 1 18 11000 1 1 11 LYS HB3 H 6.126 2.339 -3.563 1.00 . A A . 11 LYS HB3 1 1 18 11001 1 1 11 LYS HD2 H 3.453 0.794 -4.330 1.00 . A A . 11 LYS HD2 1 1 18 11002 1 1 11 LYS HD3 H 4.280 -0.484 -5.218 1.00 . A A . 11 LYS HD3 1 1 18 11003 1 1 11 LYS HE2 H 5.290 -1.176 -3.363 1.00 . A A . 11 LYS HE2 1 1 18 11004 1 1 11 LYS HE3 H 5.955 0.434 -3.085 1.00 . A A . 11 LYS HE3 1 1 18 11005 1 1 11 LYS HG2 H 4.774 1.705 -6.169 1.00 . A A . 11 LYS HG2 1 1 18 11006 1 1 11 LYS HG3 H 6.226 0.968 -5.506 1.00 . A A . 11 LYS HG3 1 1 18 11007 1 1 11 LYS HZ1 H 4.123 -0.826 -1.522 1.00 . A A . 11 LYS HZ1 1 1 18 11008 1 1 11 LYS HZ2 H 3.170 0.248 -2.413 1.00 . A A . 11 LYS HZ2 1 1 18 11009 1 1 11 LYS HZ3 H 4.467 0.830 -1.494 1.00 . A A . 11 LYS HZ3 1 1 18 11010 1 1 11 LYS N N 3.838 4.398 -4.608 1.00 . A A . 11 LYS N 1 1 18 11011 1 1 11 LYS NZ N 4.138 0.044 -2.095 1.00 . A A . 11 LYS NZ 1 1 18 11012 1 1 11 LYS O O 5.326 4.043 -1.897 1.00 . A A . 11 LYS O 1 1 18 11013 1 1 12 CYS C C 4.372 2.443 0.475 1.00 . A A . 12 CYS C 1 1 18 11014 1 1 12 CYS CA C 3.199 3.148 -0.232 1.00 . A A . 12 CYS CA 1 1 18 11015 1 1 12 CYS CB C 1.889 2.469 0.119 1.00 . A A . 12 CYS CB 1 1 18 11016 1 1 12 CYS H H 2.563 2.668 -2.165 1.00 . A A . 12 CYS H 1 1 18 11017 1 1 12 CYS HA H 3.162 4.184 0.064 1.00 . A A . 12 CYS HA 1 1 18 11018 1 1 12 CYS HB2 H 1.936 2.074 1.120 1.00 . A A . 12 CYS HB2 1 1 18 11019 1 1 12 CYS HB3 H 1.087 3.187 0.056 1.00 . A A . 12 CYS HB3 1 1 18 11020 1 1 12 CYS N N 3.305 3.071 -1.679 1.00 . A A . 12 CYS N 1 1 18 11021 1 1 12 CYS O O 5.171 1.755 -0.169 1.00 . A A . 12 CYS O 1 1 18 11022 1 1 12 CYS SG S 1.509 1.106 -1.022 1.00 . A A . 12 CYS SG 1 1 18 11023 1 1 13 PRO C C 5.670 0.476 2.436 1.00 . A A . 13 PRO C 1 1 18 11024 1 1 13 PRO CA C 5.561 1.993 2.604 1.00 . A A . 13 PRO CA 1 1 18 11025 1 1 13 PRO CB C 5.192 2.337 4.055 1.00 . A A . 13 PRO CB 1 1 18 11026 1 1 13 PRO CD C 3.575 3.384 2.656 1.00 . A A . 13 PRO CD 1 1 18 11027 1 1 13 PRO CG C 3.770 2.771 4.007 1.00 . A A . 13 PRO CG 1 1 18 11028 1 1 13 PRO HA H 6.513 2.440 2.365 1.00 . A A . 13 PRO HA 1 1 18 11029 1 1 13 PRO HB2 H 5.314 1.463 4.675 1.00 . A A . 13 PRO HB2 1 1 18 11030 1 1 13 PRO HB3 H 5.830 3.128 4.412 1.00 . A A . 13 PRO HB3 1 1 18 11031 1 1 13 PRO HD2 H 2.548 3.276 2.335 1.00 . A A . 13 PRO HD2 1 1 18 11032 1 1 13 PRO HD3 H 3.865 4.423 2.662 1.00 . A A . 13 PRO HD3 1 1 18 11033 1 1 13 PRO HG2 H 3.122 1.916 4.129 1.00 . A A . 13 PRO HG2 1 1 18 11034 1 1 13 PRO HG3 H 3.583 3.499 4.784 1.00 . A A . 13 PRO HG3 1 1 18 11035 1 1 13 PRO N N 4.479 2.593 1.810 1.00 . A A . 13 PRO N 1 1 18 11036 1 1 13 PRO O O 6.771 -0.075 2.455 1.00 . A A . 13 PRO O 1 1 18 11037 1 1 14 THR C C 5.079 -2.084 0.791 1.00 . A A . 14 THR C 1 1 18 11038 1 1 14 THR CA C 4.503 -1.642 2.138 1.00 . A A . 14 THR CA 1 1 18 11039 1 1 14 THR CB C 3.068 -2.172 2.266 1.00 . A A . 14 THR CB 1 1 18 11040 1 1 14 THR CG2 C 3.066 -3.674 2.522 1.00 . A A . 14 THR CG2 1 1 18 11041 1 1 14 THR H H 3.687 0.303 2.295 1.00 . A A . 14 THR H 1 1 18 11042 1 1 14 THR HA H 5.096 -2.073 2.931 1.00 . A A . 14 THR HA 1 1 18 11043 1 1 14 THR HB H 2.544 -1.977 1.341 1.00 . A A . 14 THR HB 1 1 18 11044 1 1 14 THR HG1 H 1.567 -1.098 3.002 1.00 . A A . 14 THR HG1 1 1 18 11045 1 1 14 THR HG21 H 2.256 -4.132 1.972 1.00 . A A . 14 THR HG21 1 1 18 11046 1 1 14 THR HG22 H 2.934 -3.858 3.577 1.00 . A A . 14 THR HG22 1 1 18 11047 1 1 14 THR HG23 H 4.006 -4.096 2.198 1.00 . A A . 14 THR HG23 1 1 18 11048 1 1 14 THR N N 4.534 -0.191 2.287 1.00 . A A . 14 THR N 1 1 18 11049 1 1 14 THR O O 4.494 -1.823 -0.257 1.00 . A A . 14 THR O 1 1 18 11050 1 1 14 THR OG1 O 2.395 -1.493 3.337 1.00 . A A . 14 THR OG1 1 1 18 11051 1 1 15 PRO C C 6.134 -4.305 -1.141 1.00 . A A . 15 PRO C 1 1 18 11052 1 1 15 PRO CA C 6.913 -3.204 -0.431 1.00 . A A . 15 PRO CA 1 1 18 11053 1 1 15 PRO CB C 8.254 -3.750 0.066 1.00 . A A . 15 PRO CB 1 1 18 11054 1 1 15 PRO CD C 7.038 -3.079 1.990 1.00 . A A . 15 PRO CD 1 1 18 11055 1 1 15 PRO CG C 8.422 -3.172 1.425 1.00 . A A . 15 PRO CG 1 1 18 11056 1 1 15 PRO HA H 7.085 -2.383 -1.111 1.00 . A A . 15 PRO HA 1 1 18 11057 1 1 15 PRO HB2 H 8.215 -4.828 0.099 1.00 . A A . 15 PRO HB2 1 1 18 11058 1 1 15 PRO HB3 H 9.040 -3.432 -0.595 1.00 . A A . 15 PRO HB3 1 1 18 11059 1 1 15 PRO HD2 H 6.738 -4.026 2.415 1.00 . A A . 15 PRO HD2 1 1 18 11060 1 1 15 PRO HD3 H 6.974 -2.290 2.724 1.00 . A A . 15 PRO HD3 1 1 18 11061 1 1 15 PRO HG2 H 9.037 -3.822 2.028 1.00 . A A . 15 PRO HG2 1 1 18 11062 1 1 15 PRO HG3 H 8.865 -2.190 1.352 1.00 . A A . 15 PRO HG3 1 1 18 11063 1 1 15 PRO N N 6.244 -2.754 0.798 1.00 . A A . 15 PRO N 1 1 18 11064 1 1 15 PRO O O 6.277 -4.508 -2.346 1.00 . A A . 15 PRO O 1 1 18 11065 1 1 16 GLY C C 3.254 -5.633 -1.527 1.00 . A A . 16 GLY C 1 1 18 11066 1 1 16 GLY CA C 4.558 -6.118 -0.932 1.00 . A A . 16 GLY CA 1 1 18 11067 1 1 16 GLY H H 5.307 -4.855 0.581 1.00 . A A . 16 GLY H 1 1 18 11068 1 1 16 GLY HA2 H 5.134 -6.605 -1.702 1.00 . A A . 16 GLY HA2 1 1 18 11069 1 1 16 GLY HA3 H 4.341 -6.832 -0.152 1.00 . A A . 16 GLY HA3 1 1 18 11070 1 1 16 GLY N N 5.341 -5.037 -0.375 1.00 . A A . 16 GLY N 1 1 18 11071 1 1 16 GLY O O 2.574 -6.368 -2.245 1.00 . A A . 16 GLY O 1 1 18 11072 1 1 17 CYS C C 2.019 -3.046 -3.073 1.00 . A A . 17 CYS C 1 1 18 11073 1 1 17 CYS CA C 1.724 -3.765 -1.761 1.00 . A A . 17 CYS CA 1 1 18 11074 1 1 17 CYS CB C 1.185 -2.800 -0.707 1.00 . A A . 17 CYS CB 1 1 18 11075 1 1 17 CYS H H 3.542 -3.843 -0.712 1.00 . A A . 17 CYS H 1 1 18 11076 1 1 17 CYS HA H 0.994 -4.543 -1.939 1.00 . A A . 17 CYS HA 1 1 18 11077 1 1 17 CYS HB2 H 1.070 -3.333 0.224 1.00 . A A . 17 CYS HB2 1 1 18 11078 1 1 17 CYS HB3 H 1.903 -2.004 -0.567 1.00 . A A . 17 CYS HB3 1 1 18 11079 1 1 17 CYS N N 2.930 -4.382 -1.251 1.00 . A A . 17 CYS N 1 1 18 11080 1 1 17 CYS O O 3.178 -2.737 -3.373 1.00 . A A . 17 CYS O 1 1 18 11081 1 1 17 CYS SG S -0.418 -2.031 -1.089 1.00 . A A . 17 CYS SG 1 1 18 11082 1 1 18 ASP C C 0.779 -0.713 -5.106 1.00 . A A . 18 ASP C 1 1 18 11083 1 1 18 ASP CA C 1.163 -2.185 -5.166 1.00 . A A . 18 ASP CA 1 1 18 11084 1 1 18 ASP CB C 0.353 -2.920 -6.243 1.00 . A A . 18 ASP CB 1 1 18 11085 1 1 18 ASP CG C -1.048 -2.368 -6.436 1.00 . A A . 18 ASP CG 1 1 18 11086 1 1 18 ASP H H 0.090 -3.096 -3.581 1.00 . A A . 18 ASP H 1 1 18 11087 1 1 18 ASP HA H 2.212 -2.252 -5.414 1.00 . A A . 18 ASP HA 1 1 18 11088 1 1 18 ASP HB2 H 0.877 -2.845 -7.186 1.00 . A A . 18 ASP HB2 1 1 18 11089 1 1 18 ASP HB3 H 0.273 -3.962 -5.968 1.00 . A A . 18 ASP HB3 1 1 18 11090 1 1 18 ASP N N 0.987 -2.818 -3.867 1.00 . A A . 18 ASP N 1 1 18 11091 1 1 18 ASP O O 1.198 0.082 -5.947 1.00 . A A . 18 ASP O 1 1 18 11092 1 1 18 ASP OD1 O -1.804 -2.286 -5.449 1.00 . A A . 18 ASP OD1 1 1 18 11093 1 1 18 ASP OD2 O -1.400 -2.021 -7.587 1.00 . A A . 18 ASP OD2 1 1 18 11094 1 1 19 GLY C C -1.668 1.415 -4.353 1.00 . A A . 19 GLY C 1 1 18 11095 1 1 19 GLY CA C -0.280 1.058 -3.854 1.00 . A A . 19 GLY CA 1 1 18 11096 1 1 19 GLY H H -0.189 -1.007 -3.378 1.00 . A A . 19 GLY H 1 1 18 11097 1 1 19 GLY HA2 H -0.224 1.278 -2.799 1.00 . A A . 19 GLY HA2 1 1 18 11098 1 1 19 GLY HA3 H 0.444 1.669 -4.375 1.00 . A A . 19 GLY HA3 1 1 18 11099 1 1 19 GLY N N 0.059 -0.338 -4.056 1.00 . A A . 19 GLY N 1 1 18 11100 1 1 19 GLY O O -2.128 2.544 -4.174 1.00 . A A . 19 GLY O 1 1 18 11101 1 1 20 SER C C -4.722 -0.030 -4.592 1.00 . A A . 20 SER C 1 1 18 11102 1 1 20 SER CA C -3.695 0.692 -5.454 1.00 . A A . 20 SER CA 1 1 18 11103 1 1 20 SER CB C -3.809 0.236 -6.909 1.00 . A A . 20 SER CB 1 1 18 11104 1 1 20 SER H H -1.950 -0.437 -5.058 1.00 . A A . 20 SER H 1 1 18 11105 1 1 20 SER HA H -3.886 1.752 -5.405 1.00 . A A . 20 SER HA 1 1 18 11106 1 1 20 SER HB2 H -4.137 -0.794 -6.937 1.00 . A A . 20 SER HB2 1 1 18 11107 1 1 20 SER HB3 H -4.526 0.856 -7.425 1.00 . A A . 20 SER HB3 1 1 18 11108 1 1 20 SER HG H -2.091 -0.517 -7.489 1.00 . A A . 20 SER HG 1 1 18 11109 1 1 20 SER N N -2.351 0.457 -4.957 1.00 . A A . 20 SER N 1 1 18 11110 1 1 20 SER O O -4.380 -0.917 -3.809 1.00 . A A . 20 SER O 1 1 18 11111 1 1 20 SER OG O -2.560 0.334 -7.569 1.00 . A A . 20 SER OG 1 1 18 11112 1 1 21 GLY C C -6.955 0.073 -2.483 1.00 . A A . 21 GLY C 1 1 18 11113 1 1 21 GLY CA C -7.045 -0.226 -3.962 1.00 . A A . 21 GLY CA 1 1 18 11114 1 1 21 GLY H H -6.178 1.111 -5.346 1.00 . A A . 21 GLY H 1 1 18 11115 1 1 21 GLY HA2 H -7.990 0.139 -4.335 1.00 . A A . 21 GLY HA2 1 1 18 11116 1 1 21 GLY HA3 H -7.005 -1.295 -4.103 1.00 . A A . 21 GLY HA3 1 1 18 11117 1 1 21 GLY N N -5.975 0.381 -4.720 1.00 . A A . 21 GLY N 1 1 18 11118 1 1 21 GLY O O -6.196 0.939 -2.064 1.00 . A A . 21 GLY O 1 1 18 11119 1 1 22 HIS C C -8.160 -1.930 0.313 1.00 . A A . 22 HIS C 1 1 18 11120 1 1 22 HIS CA C -7.721 -0.587 -0.248 1.00 . A A . 22 HIS CA 1 1 18 11121 1 1 22 HIS CB C -8.699 0.501 0.238 1.00 . A A . 22 HIS CB 1 1 18 11122 1 1 22 HIS CD2 C -7.532 2.763 -0.348 1.00 . A A . 22 HIS CD2 1 1 18 11123 1 1 22 HIS CE1 C -7.579 3.655 1.648 1.00 . A A . 22 HIS CE1 1 1 18 11124 1 1 22 HIS CG C -8.101 1.858 0.487 1.00 . A A . 22 HIS CG 1 1 18 11125 1 1 22 HIS H H -8.261 -1.381 -2.129 1.00 . A A . 22 HIS H 1 1 18 11126 1 1 22 HIS HA H -6.722 -0.361 0.092 1.00 . A A . 22 HIS HA 1 1 18 11127 1 1 22 HIS HB2 H -9.474 0.624 -0.500 1.00 . A A . 22 HIS HB2 1 1 18 11128 1 1 22 HIS HB3 H -9.149 0.172 1.162 1.00 . A A . 22 HIS HB3 1 1 18 11129 1 1 22 HIS HD1 H -8.456 2.047 2.563 1.00 . A A . 22 HIS HD1 1 1 18 11130 1 1 22 HIS HD2 H -7.357 2.635 -1.408 1.00 . A A . 22 HIS HD2 1 1 18 11131 1 1 22 HIS HE1 H -7.464 4.348 2.465 1.00 . A A . 22 HIS HE1 1 1 18 11132 1 1 22 HIS HE2 H -6.950 4.753 0.031 1.00 . A A . 22 HIS HE2 1 1 18 11133 1 1 22 HIS N N -7.708 -0.683 -1.705 1.00 . A A . 22 HIS N 1 1 18 11134 1 1 22 HIS ND1 N -8.110 2.451 1.731 1.00 . A A . 22 HIS ND1 1 1 18 11135 1 1 22 HIS NE2 N -7.217 3.869 0.399 1.00 . A A . 22 HIS NE2 1 1 18 11136 1 1 22 HIS O O -8.917 -2.645 -0.343 1.00 . A A . 22 HIS O 1 1 18 11137 1 1 23 ILE C C -9.798 -3.290 2.402 1.00 . A A . 23 ILE C 1 1 18 11138 1 1 23 ILE CA C -8.296 -3.438 2.209 1.00 . A A . 23 ILE CA 1 1 18 11139 1 1 23 ILE CB C -7.580 -3.715 3.560 1.00 . A A . 23 ILE CB 1 1 18 11140 1 1 23 ILE CD1 C -8.079 -6.215 3.441 1.00 . A A . 23 ILE CD1 1 1 18 11141 1 1 23 ILE CG1 C -7.020 -5.141 3.578 1.00 . A A . 23 ILE CG1 1 1 18 11142 1 1 23 ILE CG2 C -8.503 -3.491 4.755 1.00 . A A . 23 ILE CG2 1 1 18 11143 1 1 23 ILE H H -7.270 -1.580 2.080 1.00 . A A . 23 ILE H 1 1 18 11144 1 1 23 ILE HA H -8.110 -4.271 1.545 1.00 . A A . 23 ILE HA 1 1 18 11145 1 1 23 ILE HB H -6.759 -3.020 3.647 1.00 . A A . 23 ILE HB 1 1 18 11146 1 1 23 ILE HD11 H -8.953 -5.931 4.009 1.00 . A A . 23 ILE HD11 1 1 18 11147 1 1 23 ILE HD12 H -8.346 -6.327 2.401 1.00 . A A . 23 ILE HD12 1 1 18 11148 1 1 23 ILE HD13 H -7.693 -7.151 3.818 1.00 . A A . 23 ILE HD13 1 1 18 11149 1 1 23 ILE HG12 H -6.323 -5.257 2.761 1.00 . A A . 23 ILE HG12 1 1 18 11150 1 1 23 ILE HG13 H -6.501 -5.303 4.511 1.00 . A A . 23 ILE HG13 1 1 18 11151 1 1 23 ILE HG21 H -8.117 -4.024 5.610 1.00 . A A . 23 ILE HG21 1 1 18 11152 1 1 23 ILE HG22 H -8.552 -2.435 4.980 1.00 . A A . 23 ILE HG22 1 1 18 11153 1 1 23 ILE HG23 H -9.491 -3.856 4.519 1.00 . A A . 23 ILE HG23 1 1 18 11154 1 1 23 ILE N N -7.795 -2.229 1.557 1.00 . A A . 23 ILE N 1 1 18 11155 1 1 23 ILE O O -10.554 -4.260 2.383 1.00 . A A . 23 ILE O 1 1 18 11156 1 1 24 THR C C -12.356 -2.193 1.240 1.00 . A A . 24 THR C 1 1 18 11157 1 1 24 THR CA C -11.596 -1.658 2.449 1.00 . A A . 24 THR CA 1 1 18 11158 1 1 24 THR CB C -11.690 -0.135 2.437 1.00 . A A . 24 THR CB 1 1 18 11159 1 1 24 THR CG2 C -12.954 0.319 3.107 1.00 . A A . 24 THR CG2 1 1 18 11160 1 1 24 THR H H -9.538 -1.327 2.341 1.00 . A A . 24 THR H 1 1 18 11161 1 1 24 THR HA H -12.041 -2.029 3.359 1.00 . A A . 24 THR HA 1 1 18 11162 1 1 24 THR HB H -11.705 0.199 1.410 1.00 . A A . 24 THR HB 1 1 18 11163 1 1 24 THR HG1 H -10.448 0.018 3.967 1.00 . A A . 24 THR HG1 1 1 18 11164 1 1 24 THR HG21 H -13.169 1.331 2.810 1.00 . A A . 24 THR HG21 1 1 18 11165 1 1 24 THR HG22 H -12.830 0.269 4.177 1.00 . A A . 24 THR HG22 1 1 18 11166 1 1 24 THR HG23 H -13.763 -0.327 2.803 1.00 . A A . 24 THR HG23 1 1 18 11167 1 1 24 THR N N -10.210 -2.036 2.421 1.00 . A A . 24 THR N 1 1 18 11168 1 1 24 THR O O -13.328 -2.937 1.373 1.00 . A A . 24 THR O 1 1 18 11169 1 1 24 THR OG1 O -10.545 0.426 3.091 1.00 . A A . 24 THR OG1 1 1 18 11170 1 1 25 GLY C C -13.541 -1.023 -1.642 1.00 . A A . 25 GLY C 1 1 18 11171 1 1 25 GLY CA C -12.610 -2.119 -1.162 1.00 . A A . 25 GLY CA 1 1 18 11172 1 1 25 GLY H H -11.176 -1.136 0.038 1.00 . A A . 25 GLY H 1 1 18 11173 1 1 25 GLY HA2 H -11.870 -2.313 -1.926 1.00 . A A . 25 GLY HA2 1 1 18 11174 1 1 25 GLY HA3 H -13.185 -3.017 -0.992 1.00 . A A . 25 GLY HA3 1 1 18 11175 1 1 25 GLY N N -11.936 -1.748 0.066 1.00 . A A . 25 GLY N 1 1 18 11176 1 1 25 GLY O O -14.569 -1.296 -2.259 1.00 . A A . 25 GLY O 1 1 18 11177 1 1 26 ASN C C -13.352 2.432 -2.350 1.00 . A A . 26 ASN C 1 1 18 11178 1 1 26 ASN CA C -14.097 1.351 -1.574 1.00 . A A . 26 ASN CA 1 1 18 11179 1 1 26 ASN CB C -14.637 1.957 -0.279 1.00 . A A . 26 ASN CB 1 1 18 11180 1 1 26 ASN CG C -15.928 1.313 0.172 1.00 . A A . 26 ASN CG 1 1 18 11181 1 1 26 ASN H H -12.454 0.355 -0.699 1.00 . A A . 26 ASN H 1 1 18 11182 1 1 26 ASN HA H -14.924 0.994 -2.169 1.00 . A A . 26 ASN HA 1 1 18 11183 1 1 26 ASN HB2 H -13.902 1.827 0.502 1.00 . A A . 26 ASN HB2 1 1 18 11184 1 1 26 ASN HB3 H -14.814 3.011 -0.425 1.00 . A A . 26 ASN HB3 1 1 18 11185 1 1 26 ASN HD21 H -15.323 1.394 2.063 1.00 . A A . 26 ASN HD21 1 1 18 11186 1 1 26 ASN HD22 H -16.872 0.672 1.792 1.00 . A A . 26 ASN HD22 1 1 18 11187 1 1 26 ASN N N -13.233 0.215 -1.266 1.00 . A A . 26 ASN N 1 1 18 11188 1 1 26 ASN ND2 N -16.057 1.108 1.469 1.00 . A A . 26 ASN ND2 1 1 18 11189 1 1 26 ASN O O -13.899 3.505 -2.606 1.00 . A A . 26 ASN O 1 1 18 11190 1 1 26 ASN OD1 O -16.810 1.025 -0.636 1.00 . A A . 26 ASN OD1 1 1 18 11191 1 1 27 TYR C C -10.559 2.676 -4.497 1.00 . A A . 27 TYR C 1 1 18 11192 1 1 27 TYR CA C -11.241 3.218 -3.247 1.00 . A A . 27 TYR CA 1 1 18 11193 1 1 27 TYR CB C -10.182 3.702 -2.258 1.00 . A A . 27 TYR CB 1 1 18 11194 1 1 27 TYR CD1 C -11.266 3.796 0.021 1.00 . A A . 27 TYR CD1 1 1 18 11195 1 1 27 TYR CD2 C -10.724 5.856 -1.050 1.00 . A A . 27 TYR CD2 1 1 18 11196 1 1 27 TYR CE1 C -11.764 4.486 1.107 1.00 . A A . 27 TYR CE1 1 1 18 11197 1 1 27 TYR CE2 C -11.215 6.554 0.036 1.00 . A A . 27 TYR CE2 1 1 18 11198 1 1 27 TYR CG C -10.737 4.466 -1.075 1.00 . A A . 27 TYR CG 1 1 18 11199 1 1 27 TYR CZ C -11.739 5.865 1.109 1.00 . A A . 27 TYR CZ 1 1 18 11200 1 1 27 TYR H H -11.660 1.362 -2.335 1.00 . A A . 27 TYR H 1 1 18 11201 1 1 27 TYR HA H -11.875 4.047 -3.521 1.00 . A A . 27 TYR HA 1 1 18 11202 1 1 27 TYR HB2 H -9.645 2.847 -1.873 1.00 . A A . 27 TYR HB2 1 1 18 11203 1 1 27 TYR HB3 H -9.493 4.345 -2.773 1.00 . A A . 27 TYR HB3 1 1 18 11204 1 1 27 TYR HD1 H -11.285 2.718 0.015 1.00 . A A . 27 TYR HD1 1 1 18 11205 1 1 27 TYR HD2 H -10.317 6.391 -1.894 1.00 . A A . 27 TYR HD2 1 1 18 11206 1 1 27 TYR HE1 H -12.179 3.945 1.947 1.00 . A A . 27 TYR HE1 1 1 18 11207 1 1 27 TYR HE2 H -11.194 7.633 0.039 1.00 . A A . 27 TYR HE2 1 1 18 11208 1 1 27 TYR HH H -11.676 7.343 2.348 1.00 . A A . 27 TYR HH 1 1 18 11209 1 1 27 TYR N N -12.073 2.203 -2.619 1.00 . A A . 27 TYR N 1 1 18 11210 1 1 27 TYR O O -10.620 1.479 -4.781 1.00 . A A . 27 TYR O 1 1 18 11211 1 1 27 TYR OH O -12.224 6.556 2.195 1.00 . A A . 27 TYR OH 1 1 18 11212 1 1 28 ALA C C -7.644 2.961 -6.065 1.00 . A A . 28 ALA C 1 1 18 11213 1 1 28 ALA CA C -9.119 3.167 -6.390 1.00 . A A . 28 ALA CA 1 1 18 11214 1 1 28 ALA CB C -9.281 4.217 -7.479 1.00 . A A . 28 ALA CB 1 1 18 11215 1 1 28 ALA H H -9.805 4.487 -4.886 1.00 . A A . 28 ALA H 1 1 18 11216 1 1 28 ALA HA H -9.531 2.237 -6.753 1.00 . A A . 28 ALA HA 1 1 18 11217 1 1 28 ALA HB1 H -8.776 3.886 -8.376 1.00 . A A . 28 ALA HB1 1 1 18 11218 1 1 28 ALA HB2 H -10.330 4.361 -7.689 1.00 . A A . 28 ALA HB2 1 1 18 11219 1 1 28 ALA HB3 H -8.849 5.149 -7.146 1.00 . A A . 28 ALA HB3 1 1 18 11220 1 1 28 ALA N N -9.856 3.552 -5.199 1.00 . A A . 28 ALA N 1 1 18 11221 1 1 28 ALA O O -7.002 2.061 -6.609 1.00 . A A . 28 ALA O 1 1 18 11222 1 1 29 SER C C -5.406 4.457 -3.517 1.00 . A A . 29 SER C 1 1 18 11223 1 1 29 SER CA C -5.689 3.712 -4.817 1.00 . A A . 29 SER CA 1 1 18 11224 1 1 29 SER CB C -4.824 4.283 -5.944 1.00 . A A . 29 SER CB 1 1 18 11225 1 1 29 SER H H -7.658 4.508 -4.789 1.00 . A A . 29 SER H 1 1 18 11226 1 1 29 SER HA H -5.444 2.671 -4.681 1.00 . A A . 29 SER HA 1 1 18 11227 1 1 29 SER HB2 H -3.984 4.813 -5.519 1.00 . A A . 29 SER HB2 1 1 18 11228 1 1 29 SER HB3 H -4.463 3.476 -6.565 1.00 . A A . 29 SER HB3 1 1 18 11229 1 1 29 SER HG H -5.531 4.897 -7.676 1.00 . A A . 29 SER HG 1 1 18 11230 1 1 29 SER N N -7.103 3.798 -5.184 1.00 . A A . 29 SER N 1 1 18 11231 1 1 29 SER O O -6.268 5.169 -3.003 1.00 . A A . 29 SER O 1 1 18 11232 1 1 29 SER OG O -5.568 5.183 -6.747 1.00 . A A . 29 SER OG 1 1 18 11233 1 1 30 HIS C C -2.296 5.477 -1.996 1.00 . A A . 30 HIS C 1 1 18 11234 1 1 30 HIS CA C -3.745 5.024 -1.821 1.00 . A A . 30 HIS CA 1 1 18 11235 1 1 30 HIS CB C -3.884 4.155 -0.564 1.00 . A A . 30 HIS CB 1 1 18 11236 1 1 30 HIS CD2 C -2.039 2.390 -0.216 1.00 . A A . 30 HIS CD2 1 1 18 11237 1 1 30 HIS CE1 C -2.945 0.704 -1.226 1.00 . A A . 30 HIS CE1 1 1 18 11238 1 1 30 HIS CG C -3.242 2.810 -0.669 1.00 . A A . 30 HIS CG 1 1 18 11239 1 1 30 HIS H H -3.540 3.732 -3.482 1.00 . A A . 30 HIS H 1 1 18 11240 1 1 30 HIS HA H -4.372 5.898 -1.715 1.00 . A A . 30 HIS HA 1 1 18 11241 1 1 30 HIS HB2 H -3.421 4.670 0.262 1.00 . A A . 30 HIS HB2 1 1 18 11242 1 1 30 HIS HB3 H -4.928 4.012 -0.345 1.00 . A A . 30 HIS HB3 1 1 18 11243 1 1 30 HIS HD1 H -4.701 1.693 -1.726 1.00 . A A . 30 HIS HD1 1 1 18 11244 1 1 30 HIS HD2 H -1.330 2.970 0.350 1.00 . A A . 30 HIS HD2 1 1 18 11245 1 1 30 HIS HE1 H -3.111 -0.282 -1.634 1.00 . A A . 30 HIS HE1 1 1 18 11246 1 1 30 HIS N N -4.186 4.307 -3.011 1.00 . A A . 30 HIS N 1 1 18 11247 1 1 30 HIS ND1 N -3.810 1.724 -1.308 1.00 . A A . 30 HIS ND1 1 1 18 11248 1 1 30 HIS NE2 N -1.873 1.072 -0.577 1.00 . A A . 30 HIS NE2 1 1 18 11249 1 1 30 HIS O O -1.808 5.572 -3.124 1.00 . A A . 30 HIS O 1 1 18 11250 1 1 31 ARG C C 0.538 5.777 0.347 1.00 . A A . 31 ARG C 1 1 18 11251 1 1 31 ARG CA C -0.197 6.129 -0.940 1.00 . A A . 31 ARG CA 1 1 18 11252 1 1 31 ARG CB C -0.073 7.635 -1.199 1.00 . A A . 31 ARG CB 1 1 18 11253 1 1 31 ARG CD C -1.301 9.820 -1.337 1.00 . A A . 31 ARG CD 1 1 18 11254 1 1 31 ARG CG C -1.229 8.460 -0.660 1.00 . A A . 31 ARG CG 1 1 18 11255 1 1 31 ARG CZ C -1.400 10.742 -3.626 1.00 . A A . 31 ARG CZ 1 1 18 11256 1 1 31 ARG H H -2.022 5.579 -0.012 1.00 . A A . 31 ARG H 1 1 18 11257 1 1 31 ARG HA H 0.269 5.598 -1.758 1.00 . A A . 31 ARG HA 1 1 18 11258 1 1 31 ARG HB2 H 0.836 7.990 -0.735 1.00 . A A . 31 ARG HB2 1 1 18 11259 1 1 31 ARG HB3 H -0.006 7.798 -2.265 1.00 . A A . 31 ARG HB3 1 1 18 11260 1 1 31 ARG HD2 H -2.228 10.297 -1.055 1.00 . A A . 31 ARG HD2 1 1 18 11261 1 1 31 ARG HD3 H -0.471 10.422 -0.997 1.00 . A A . 31 ARG HD3 1 1 18 11262 1 1 31 ARG HE H -1.082 8.817 -3.177 1.00 . A A . 31 ARG HE 1 1 18 11263 1 1 31 ARG HG2 H -2.153 7.931 -0.840 1.00 . A A . 31 ARG HG2 1 1 18 11264 1 1 31 ARG HG3 H -1.093 8.604 0.401 1.00 . A A . 31 ARG HG3 1 1 18 11265 1 1 31 ARG HH11 H -1.621 12.124 -2.153 1.00 . A A . 31 ARG HH11 1 1 18 11266 1 1 31 ARG HH12 H -1.722 12.744 -3.776 1.00 . A A . 31 ARG HH12 1 1 18 11267 1 1 31 ARG HH21 H -1.204 9.609 -5.298 1.00 . A A . 31 ARG HH21 1 1 18 11268 1 1 31 ARG HH22 H -1.456 11.309 -5.576 1.00 . A A . 31 ARG HH22 1 1 18 11269 1 1 31 ARG N N -1.598 5.717 -0.886 1.00 . A A . 31 ARG N 1 1 18 11270 1 1 31 ARG NE N -1.246 9.714 -2.794 1.00 . A A . 31 ARG NE 1 1 18 11271 1 1 31 ARG NH1 N -1.592 11.966 -3.148 1.00 . A A . 31 ARG NH1 1 1 18 11272 1 1 31 ARG NH2 N -1.352 10.538 -4.935 1.00 . A A . 31 ARG NH2 1 1 18 11273 1 1 31 ARG O O 1.767 5.762 0.385 1.00 . A A . 31 ARG O 1 1 18 11274 1 1 32 SER C C -0.213 3.948 3.268 1.00 . A A . 32 SER C 1 1 18 11275 1 1 32 SER CA C 0.391 5.228 2.698 1.00 . A A . 32 SER CA 1 1 18 11276 1 1 32 SER CB C 0.184 6.399 3.662 1.00 . A A . 32 SER CB 1 1 18 11277 1 1 32 SER H H -1.188 5.597 1.342 1.00 . A A . 32 SER H 1 1 18 11278 1 1 32 SER HA H 1.449 5.080 2.545 1.00 . A A . 32 SER HA 1 1 18 11279 1 1 32 SER HB2 H -0.748 6.266 4.189 1.00 . A A . 32 SER HB2 1 1 18 11280 1 1 32 SER HB3 H 0.997 6.426 4.372 1.00 . A A . 32 SER HB3 1 1 18 11281 1 1 32 SER HG H 0.848 7.651 2.296 1.00 . A A . 32 SER HG 1 1 18 11282 1 1 32 SER N N -0.207 5.541 1.412 1.00 . A A . 32 SER N 1 1 18 11283 1 1 32 SER O O -1.078 3.334 2.640 1.00 . A A . 32 SER O 1 1 18 11284 1 1 32 SER OG O 0.143 7.636 2.965 1.00 . A A . 32 SER OG 1 1 18 11285 1 1 33 LEU C C -1.675 2.579 5.723 1.00 . A A . 33 LEU C 1 1 18 11286 1 1 33 LEU CA C -0.289 2.360 5.127 1.00 . A A . 33 LEU CA 1 1 18 11287 1 1 33 LEU CB C 0.676 1.927 6.228 1.00 . A A . 33 LEU CB 1 1 18 11288 1 1 33 LEU CD1 C 2.727 0.611 6.776 1.00 . A A . 33 LEU CD1 1 1 18 11289 1 1 33 LEU CD2 C 0.620 -0.569 6.127 1.00 . A A . 33 LEU CD2 1 1 18 11290 1 1 33 LEU CG C 1.476 0.671 5.917 1.00 . A A . 33 LEU CG 1 1 18 11291 1 1 33 LEU H H 0.908 4.091 4.924 1.00 . A A . 33 LEU H 1 1 18 11292 1 1 33 LEU HA H -0.346 1.583 4.382 1.00 . A A . 33 LEU HA 1 1 18 11293 1 1 33 LEU HB2 H 1.370 2.736 6.409 1.00 . A A . 33 LEU HB2 1 1 18 11294 1 1 33 LEU HB3 H 0.109 1.754 7.130 1.00 . A A . 33 LEU HB3 1 1 18 11295 1 1 33 LEU HD11 H 3.391 -0.149 6.390 1.00 . A A . 33 LEU HD11 1 1 18 11296 1 1 33 LEU HD12 H 3.222 1.570 6.753 1.00 . A A . 33 LEU HD12 1 1 18 11297 1 1 33 LEU HD13 H 2.455 0.370 7.793 1.00 . A A . 33 LEU HD13 1 1 18 11298 1 1 33 LEU HD21 H 0.293 -0.612 7.155 1.00 . A A . 33 LEU HD21 1 1 18 11299 1 1 33 LEU HD22 H -0.242 -0.525 5.476 1.00 . A A . 33 LEU HD22 1 1 18 11300 1 1 33 LEU HD23 H 1.200 -1.451 5.896 1.00 . A A . 33 LEU HD23 1 1 18 11301 1 1 33 LEU HG H 1.782 0.701 4.882 1.00 . A A . 33 LEU HG 1 1 18 11302 1 1 33 LEU N N 0.208 3.569 4.475 1.00 . A A . 33 LEU N 1 1 18 11303 1 1 33 LEU O O -2.103 1.854 6.623 1.00 . A A . 33 LEU O 1 1 18 11304 1 1 34 SER C C -4.731 2.875 5.024 1.00 . A A . 34 SER C 1 1 18 11305 1 1 34 SER CA C -3.734 3.860 5.618 1.00 . A A . 34 SER CA 1 1 18 11306 1 1 34 SER CB C -4.085 5.275 5.176 1.00 . A A . 34 SER CB 1 1 18 11307 1 1 34 SER H H -2.003 4.067 4.442 1.00 . A A . 34 SER H 1 1 18 11308 1 1 34 SER HA H -3.765 3.801 6.694 1.00 . A A . 34 SER HA 1 1 18 11309 1 1 34 SER HB2 H -4.860 5.230 4.426 1.00 . A A . 34 SER HB2 1 1 18 11310 1 1 34 SER HB3 H -4.435 5.843 6.025 1.00 . A A . 34 SER HB3 1 1 18 11311 1 1 34 SER HG H -2.494 6.420 5.327 1.00 . A A . 34 SER HG 1 1 18 11312 1 1 34 SER N N -2.389 3.549 5.179 1.00 . A A . 34 SER N 1 1 18 11313 1 1 34 SER O O -5.793 2.619 5.597 1.00 . A A . 34 SER O 1 1 18 11314 1 1 34 SER OG O -2.949 5.927 4.623 1.00 . A A . 34 SER OG 1 1 18 11315 1 1 35 GLY C C -4.576 0.436 2.302 1.00 . A A . 35 GLY C 1 1 18 11316 1 1 35 GLY CA C -5.290 1.433 3.183 1.00 . A A . 35 GLY CA 1 1 18 11317 1 1 35 GLY H H -3.535 2.584 3.444 1.00 . A A . 35 GLY H 1 1 18 11318 1 1 35 GLY HA2 H -5.861 0.894 3.924 1.00 . A A . 35 GLY HA2 1 1 18 11319 1 1 35 GLY HA3 H -5.972 2.009 2.573 1.00 . A A . 35 GLY HA3 1 1 18 11320 1 1 35 GLY N N -4.392 2.342 3.856 1.00 . A A . 35 GLY N 1 1 18 11321 1 1 35 GLY O O -5.082 0.088 1.238 1.00 . A A . 35 GLY O 1 1 18 11322 1 1 36 CYS C C -3.478 -2.439 2.132 1.00 . A A . 36 CYS C 1 1 18 11323 1 1 36 CYS CA C -2.714 -1.115 2.077 1.00 . A A . 36 CYS CA 1 1 18 11324 1 1 36 CYS CB C -1.329 -1.299 2.708 1.00 . A A . 36 CYS CB 1 1 18 11325 1 1 36 CYS H H -3.141 0.210 3.667 1.00 . A A . 36 CYS H 1 1 18 11326 1 1 36 CYS HA H -2.604 -0.812 1.046 1.00 . A A . 36 CYS HA 1 1 18 11327 1 1 36 CYS HB2 H -1.414 -1.180 3.779 1.00 . A A . 36 CYS HB2 1 1 18 11328 1 1 36 CYS HB3 H -0.976 -2.299 2.488 1.00 . A A . 36 CYS HB3 1 1 18 11329 1 1 36 CYS N N -3.451 -0.074 2.782 1.00 . A A . 36 CYS N 1 1 18 11330 1 1 36 CYS O O -3.517 -3.098 3.173 1.00 . A A . 36 CYS O 1 1 18 11331 1 1 36 CYS SG S -0.061 -0.125 2.128 1.00 . A A . 36 CYS SG 1 1 18 11332 1 1 37 PRO C C -3.801 -5.319 0.756 1.00 . A A . 37 PRO C 1 1 18 11333 1 1 37 PRO CA C -4.768 -4.151 0.939 1.00 . A A . 37 PRO CA 1 1 18 11334 1 1 37 PRO CB C -5.658 -3.967 -0.284 1.00 . A A . 37 PRO CB 1 1 18 11335 1 1 37 PRO CD C -4.030 -2.205 -0.308 1.00 . A A . 37 PRO CD 1 1 18 11336 1 1 37 PRO CG C -4.852 -3.108 -1.198 1.00 . A A . 37 PRO CG 1 1 18 11337 1 1 37 PRO HA H -5.376 -4.315 1.817 1.00 . A A . 37 PRO HA 1 1 18 11338 1 1 37 PRO HB2 H -5.880 -4.928 -0.725 1.00 . A A . 37 PRO HB2 1 1 18 11339 1 1 37 PRO HB3 H -6.582 -3.474 0.010 1.00 . A A . 37 PRO HB3 1 1 18 11340 1 1 37 PRO HD2 H -3.018 -2.121 -0.680 1.00 . A A . 37 PRO HD2 1 1 18 11341 1 1 37 PRO HD3 H -4.488 -1.229 -0.243 1.00 . A A . 37 PRO HD3 1 1 18 11342 1 1 37 PRO HG2 H -4.206 -3.724 -1.807 1.00 . A A . 37 PRO HG2 1 1 18 11343 1 1 37 PRO HG3 H -5.508 -2.519 -1.822 1.00 . A A . 37 PRO HG3 1 1 18 11344 1 1 37 PRO N N -4.056 -2.881 1.005 1.00 . A A . 37 PRO N 1 1 18 11345 1 1 37 PRO O O -4.194 -6.485 0.757 1.00 . A A . 37 PRO O 1 1 18 11346 1 1 38 ARG C C -0.459 -5.819 1.620 1.00 . A A . 38 ARG C 1 1 18 11347 1 1 38 ARG CA C -1.475 -5.975 0.498 1.00 . A A . 38 ARG CA 1 1 18 11348 1 1 38 ARG CB C -0.776 -5.829 -0.850 1.00 . A A . 38 ARG CB 1 1 18 11349 1 1 38 ARG CD C -1.126 -6.011 -3.309 1.00 . A A . 38 ARG CD 1 1 18 11350 1 1 38 ARG CG C -1.408 -6.638 -1.959 1.00 . A A . 38 ARG CG 1 1 18 11351 1 1 38 ARG CZ C -2.144 -6.264 -5.534 1.00 . A A . 38 ARG CZ 1 1 18 11352 1 1 38 ARG H H -2.279 -4.032 0.659 1.00 . A A . 38 ARG H 1 1 18 11353 1 1 38 ARG HA H -1.926 -6.954 0.561 1.00 . A A . 38 ARG HA 1 1 18 11354 1 1 38 ARG HB2 H -0.797 -4.789 -1.140 1.00 . A A . 38 ARG HB2 1 1 18 11355 1 1 38 ARG HB3 H 0.252 -6.144 -0.746 1.00 . A A . 38 ARG HB3 1 1 18 11356 1 1 38 ARG HD2 H -0.903 -4.963 -3.167 1.00 . A A . 38 ARG HD2 1 1 18 11357 1 1 38 ARG HD3 H -0.272 -6.503 -3.749 1.00 . A A . 38 ARG HD3 1 1 18 11358 1 1 38 ARG HE H -3.165 -6.128 -3.814 1.00 . A A . 38 ARG HE 1 1 18 11359 1 1 38 ARG HG2 H -1.003 -7.639 -1.941 1.00 . A A . 38 ARG HG2 1 1 18 11360 1 1 38 ARG HG3 H -2.476 -6.675 -1.803 1.00 . A A . 38 ARG HG3 1 1 18 11361 1 1 38 ARG HH11 H -0.111 -6.192 -5.533 1.00 . A A . 38 ARG HH11 1 1 18 11362 1 1 38 ARG HH12 H -0.853 -6.384 -7.096 1.00 . A A . 38 ARG HH12 1 1 18 11363 1 1 38 ARG HH21 H -4.138 -6.386 -5.860 1.00 . A A . 38 ARG HH21 1 1 18 11364 1 1 38 ARG HH22 H -3.147 -6.497 -7.284 1.00 . A A . 38 ARG HH22 1 1 18 11365 1 1 38 ARG N N -2.525 -4.983 0.636 1.00 . A A . 38 ARG N 1 1 18 11366 1 1 38 ARG NE N -2.261 -6.134 -4.216 1.00 . A A . 38 ARG NE 1 1 18 11367 1 1 38 ARG NH1 N -0.942 -6.279 -6.099 1.00 . A A . 38 ARG NH1 1 1 18 11368 1 1 38 ARG NH2 N -3.230 -6.390 -6.285 1.00 . A A . 38 ARG NH2 1 1 18 11369 1 1 38 ARG O O 0.685 -6.267 1.501 1.00 . A A . 38 ARG O 1 1 18 11370 1 1 39 ALA C C 0.463 -6.259 4.433 1.00 . A A . 39 ALA C 1 1 18 11371 1 1 39 ALA CA C -0.008 -4.938 3.840 1.00 . A A . 39 ALA CA 1 1 18 11372 1 1 39 ALA CB C -0.713 -4.105 4.896 1.00 . A A . 39 ALA CB 1 1 18 11373 1 1 39 ALA H H -1.802 -4.834 2.727 1.00 . A A . 39 ALA H 1 1 18 11374 1 1 39 ALA HA H 0.851 -4.382 3.493 1.00 . A A . 39 ALA HA 1 1 18 11375 1 1 39 ALA HB1 H -1.482 -3.509 4.428 1.00 . A A . 39 ALA HB1 1 1 18 11376 1 1 39 ALA HB2 H -1.158 -4.757 5.633 1.00 . A A . 39 ALA HB2 1 1 18 11377 1 1 39 ALA HB3 H 0.004 -3.456 5.379 1.00 . A A . 39 ALA HB3 1 1 18 11378 1 1 39 ALA N N -0.880 -5.169 2.700 1.00 . A A . 39 ALA N 1 1 18 11379 1 1 39 ALA O O -0.337 -7.027 4.971 1.00 . A A . 39 ALA O 1 1 18 11380 1 1 40 LYS C C 1.724 -8.996 3.979 1.00 . A A . 40 LYS C 1 1 18 11381 1 1 40 LYS CA C 2.360 -7.798 4.685 1.00 . A A . 40 LYS CA 1 1 18 11382 1 1 40 LYS CB C 2.251 -7.951 6.205 1.00 . A A . 40 LYS CB 1 1 18 11383 1 1 40 LYS CD C 3.611 -6.028 7.099 1.00 . A A . 40 LYS CD 1 1 18 11384 1 1 40 LYS CE C 2.742 -5.521 8.237 1.00 . A A . 40 LYS CE 1 1 18 11385 1 1 40 LYS CG C 3.510 -7.539 6.954 1.00 . A A . 40 LYS CG 1 1 18 11386 1 1 40 LYS H H 2.300 -5.901 3.752 1.00 . A A . 40 LYS H 1 1 18 11387 1 1 40 LYS HA H 3.404 -7.763 4.415 1.00 . A A . 40 LYS HA 1 1 18 11388 1 1 40 LYS HB2 H 1.433 -7.340 6.558 1.00 . A A . 40 LYS HB2 1 1 18 11389 1 1 40 LYS HB3 H 2.042 -8.985 6.438 1.00 . A A . 40 LYS HB3 1 1 18 11390 1 1 40 LYS HD2 H 4.639 -5.764 7.298 1.00 . A A . 40 LYS HD2 1 1 18 11391 1 1 40 LYS HD3 H 3.289 -5.566 6.178 1.00 . A A . 40 LYS HD3 1 1 18 11392 1 1 40 LYS HE2 H 1.905 -6.191 8.360 1.00 . A A . 40 LYS HE2 1 1 18 11393 1 1 40 LYS HE3 H 3.329 -5.510 9.145 1.00 . A A . 40 LYS HE3 1 1 18 11394 1 1 40 LYS HG2 H 3.493 -7.983 7.938 1.00 . A A . 40 LYS HG2 1 1 18 11395 1 1 40 LYS HG3 H 4.373 -7.898 6.412 1.00 . A A . 40 LYS HG3 1 1 18 11396 1 1 40 LYS HZ1 H 2.683 -3.470 8.622 1.00 . A A . 40 LYS HZ1 1 1 18 11397 1 1 40 LYS HZ2 H 1.198 -4.118 8.124 1.00 . A A . 40 LYS HZ2 1 1 18 11398 1 1 40 LYS HZ3 H 2.439 -3.867 6.993 1.00 . A A . 40 LYS HZ3 1 1 18 11399 1 1 40 LYS N N 1.749 -6.544 4.244 1.00 . A A . 40 LYS N 1 1 18 11400 1 1 40 LYS NZ N 2.229 -4.152 7.975 1.00 . A A . 40 LYS NZ 1 1 18 11401 1 1 40 LYS O O 1.675 -10.097 4.526 1.00 . A A . 40 LYS O 1 1 18 11402 1 1 41 LYS C C 1.681 -10.433 1.009 1.00 . A A . 41 LYS C 1 1 18 11403 1 1 41 LYS CA C 0.655 -9.843 1.969 1.00 . A A . 41 LYS CA 1 1 18 11404 1 1 41 LYS CB C -0.552 -9.318 1.191 1.00 . A A . 41 LYS CB 1 1 18 11405 1 1 41 LYS CD C -2.536 -10.842 1.042 1.00 . A A . 41 LYS CD 1 1 18 11406 1 1 41 LYS CE C -3.322 -11.752 1.970 1.00 . A A . 41 LYS CE 1 1 18 11407 1 1 41 LYS CG C -1.887 -9.701 1.803 1.00 . A A . 41 LYS CG 1 1 18 11408 1 1 41 LYS H H 1.339 -7.878 2.369 1.00 . A A . 41 LYS H 1 1 18 11409 1 1 41 LYS HA H 0.329 -10.615 2.651 1.00 . A A . 41 LYS HA 1 1 18 11410 1 1 41 LYS HB2 H -0.496 -8.240 1.149 1.00 . A A . 41 LYS HB2 1 1 18 11411 1 1 41 LYS HB3 H -0.515 -9.712 0.186 1.00 . A A . 41 LYS HB3 1 1 18 11412 1 1 41 LYS HD2 H -3.206 -10.435 0.300 1.00 . A A . 41 LYS HD2 1 1 18 11413 1 1 41 LYS HD3 H -1.764 -11.420 0.553 1.00 . A A . 41 LYS HD3 1 1 18 11414 1 1 41 LYS HE2 H -3.014 -12.772 1.798 1.00 . A A . 41 LYS HE2 1 1 18 11415 1 1 41 LYS HE3 H -3.106 -11.478 2.991 1.00 . A A . 41 LYS HE3 1 1 18 11416 1 1 41 LYS HG2 H -1.728 -10.007 2.826 1.00 . A A . 41 LYS HG2 1 1 18 11417 1 1 41 LYS HG3 H -2.543 -8.843 1.777 1.00 . A A . 41 LYS HG3 1 1 18 11418 1 1 41 LYS HZ1 H -5.308 -11.955 2.591 1.00 . A A . 41 LYS HZ1 1 1 18 11419 1 1 41 LYS HZ2 H -5.069 -12.249 0.938 1.00 . A A . 41 LYS HZ2 1 1 18 11420 1 1 41 LYS HZ3 H -5.048 -10.658 1.529 1.00 . A A . 41 LYS HZ3 1 1 18 11421 1 1 41 LYS N N 1.258 -8.777 2.757 1.00 . A A . 41 LYS N 1 1 18 11422 1 1 41 LYS NZ N -4.787 -11.647 1.741 1.00 . A A . 41 LYS NZ 1 1 18 11423 1 1 41 LYS O O 2.440 -11.333 1.372 1.00 . A A . 41 LYS O 1 1 18 11424 1 1 42 SER C C 4.081 -9.581 -0.935 1.00 . A A . 42 SER C 1 1 18 11425 1 1 42 SER CA C 2.742 -10.273 -1.177 1.00 . A A . 42 SER CA 1 1 18 11426 1 1 42 SER CB C 2.216 -9.945 -2.574 1.00 . A A . 42 SER CB 1 1 18 11427 1 1 42 SER H H 1.177 -9.097 -0.389 1.00 . A A . 42 SER H 1 1 18 11428 1 1 42 SER HA H 2.876 -11.340 -1.089 1.00 . A A . 42 SER HA 1 1 18 11429 1 1 42 SER HB2 H 2.664 -9.025 -2.919 1.00 . A A . 42 SER HB2 1 1 18 11430 1 1 42 SER HB3 H 2.469 -10.747 -3.251 1.00 . A A . 42 SER HB3 1 1 18 11431 1 1 42 SER HG H 0.402 -10.601 -2.186 1.00 . A A . 42 SER HG 1 1 18 11432 1 1 42 SER N N 1.766 -9.854 -0.182 1.00 . A A . 42 SER N 1 1 18 11433 1 1 42 SER O O 4.658 -8.979 -1.840 1.00 . A A . 42 SER O 1 1 18 11434 1 1 42 SER OG O 0.805 -9.792 -2.551 1.00 . A A . 42 SER OG 1 1 18 11435 1 1 43 GLY C C 5.627 -8.361 2.098 1.00 . A A . 43 GLY C 1 1 18 11436 1 1 43 GLY CA C 5.743 -8.930 0.700 1.00 . A A . 43 GLY CA 1 1 18 11437 1 1 43 GLY H H 3.989 -10.067 0.999 1.00 . A A . 43 GLY H 1 1 18 11438 1 1 43 GLY HA2 H 6.567 -9.629 0.667 1.00 . A A . 43 GLY HA2 1 1 18 11439 1 1 43 GLY HA3 H 5.933 -8.124 0.006 1.00 . A A . 43 GLY HA3 1 1 18 11440 1 1 43 GLY N N 4.527 -9.612 0.314 1.00 . A A . 43 GLY N 1 1 18 11441 1 1 43 GLY O O 4.808 -7.475 2.347 1.00 . A A . 43 GLY O 1 1 18 11442 1 1 44 LEU C C 7.503 -7.886 4.910 1.00 . A A . 44 LEU C 1 1 18 11443 1 1 44 LEU CA C 6.237 -8.585 4.432 1.00 . A A . 44 LEU CA 1 1 18 11444 1 1 44 LEU CB C 5.965 -9.825 5.293 1.00 . A A . 44 LEU CB 1 1 18 11445 1 1 44 LEU CD1 C 6.855 -12.162 5.482 1.00 . A A . 44 LEU CD1 1 1 18 11446 1 1 44 LEU CD2 C 4.773 -11.726 4.166 1.00 . A A . 44 LEU CD2 1 1 18 11447 1 1 44 LEU CG C 6.128 -11.174 4.584 1.00 . A A . 44 LEU CG 1 1 18 11448 1 1 44 LEU H H 6.925 -9.714 2.785 1.00 . A A . 44 LEU H 1 1 18 11449 1 1 44 LEU HA H 5.405 -7.902 4.527 1.00 . A A . 44 LEU HA 1 1 18 11450 1 1 44 LEU HB2 H 6.641 -9.802 6.134 1.00 . A A . 44 LEU HB2 1 1 18 11451 1 1 44 LEU HB3 H 4.954 -9.761 5.665 1.00 . A A . 44 LEU HB3 1 1 18 11452 1 1 44 LEU HD11 H 6.960 -13.106 4.969 1.00 . A A . 44 LEU HD11 1 1 18 11453 1 1 44 LEU HD12 H 7.833 -11.773 5.725 1.00 . A A . 44 LEU HD12 1 1 18 11454 1 1 44 LEU HD13 H 6.290 -12.305 6.391 1.00 . A A . 44 LEU HD13 1 1 18 11455 1 1 44 LEU HD21 H 4.695 -11.708 3.089 1.00 . A A . 44 LEU HD21 1 1 18 11456 1 1 44 LEU HD22 H 4.673 -12.743 4.517 1.00 . A A . 44 LEU HD22 1 1 18 11457 1 1 44 LEU HD23 H 3.990 -11.119 4.594 1.00 . A A . 44 LEU HD23 1 1 18 11458 1 1 44 LEU HG H 6.723 -11.035 3.693 1.00 . A A . 44 LEU HG 1 1 18 11459 1 1 44 LEU N N 6.348 -8.957 3.033 1.00 . A A . 44 LEU N 1 1 18 11460 1 1 44 LEU O O 7.446 -6.789 5.468 1.00 . A A . 44 LEU O 1 1 18 11461 1 1 45 ARG C C 10.828 -7.737 3.868 1.00 . A A . 45 ARG C 1 1 18 11462 1 1 45 ARG CA C 9.927 -7.952 5.075 1.00 . A A . 45 ARG CA 1 1 18 11463 1 1 45 ARG CB C 10.618 -8.865 6.095 1.00 . A A . 45 ARG CB 1 1 18 11464 1 1 45 ARG CD C 11.436 -11.226 5.867 1.00 . A A . 45 ARG CD 1 1 18 11465 1 1 45 ARG CG C 10.219 -10.326 5.981 1.00 . A A . 45 ARG CG 1 1 18 11466 1 1 45 ARG CZ C 11.634 -12.520 3.784 1.00 . A A . 45 ARG CZ 1 1 18 11467 1 1 45 ARG H H 8.632 -9.368 4.177 1.00 . A A . 45 ARG H 1 1 18 11468 1 1 45 ARG HA H 9.734 -6.995 5.535 1.00 . A A . 45 ARG HA 1 1 18 11469 1 1 45 ARG HB2 H 11.685 -8.793 5.956 1.00 . A A . 45 ARG HB2 1 1 18 11470 1 1 45 ARG HB3 H 10.370 -8.524 7.090 1.00 . A A . 45 ARG HB3 1 1 18 11471 1 1 45 ARG HD2 H 12.250 -10.659 5.437 1.00 . A A . 45 ARG HD2 1 1 18 11472 1 1 45 ARG HD3 H 11.717 -11.562 6.855 1.00 . A A . 45 ARG HD3 1 1 18 11473 1 1 45 ARG HE H 10.620 -13.113 5.411 1.00 . A A . 45 ARG HE 1 1 18 11474 1 1 45 ARG HG2 H 9.657 -10.608 6.860 1.00 . A A . 45 ARG HG2 1 1 18 11475 1 1 45 ARG HG3 H 9.604 -10.455 5.101 1.00 . A A . 45 ARG HG3 1 1 18 11476 1 1 45 ARG HH11 H 12.678 -10.783 3.810 1.00 . A A . 45 ARG HH11 1 1 18 11477 1 1 45 ARG HH12 H 12.764 -11.678 2.323 1.00 . A A . 45 ARG HH12 1 1 18 11478 1 1 45 ARG HH21 H 10.722 -14.305 3.457 1.00 . A A . 45 ARG HH21 1 1 18 11479 1 1 45 ARG HH22 H 11.661 -13.690 2.125 1.00 . A A . 45 ARG HH22 1 1 18 11480 1 1 45 ARG N N 8.646 -8.513 4.665 1.00 . A A . 45 ARG N 1 1 18 11481 1 1 45 ARG NE N 11.178 -12.391 5.026 1.00 . A A . 45 ARG NE 1 1 18 11482 1 1 45 ARG NH1 N 12.420 -11.586 3.265 1.00 . A A . 45 ARG NH1 1 1 18 11483 1 1 45 ARG NH2 N 11.313 -13.587 3.065 1.00 . A A . 45 ARG NH2 1 1 18 11484 1 1 45 ARG O O 11.695 -8.559 3.563 1.00 . A A . 45 ARG O 1 1 18 11485 1 1 46 VAL C C 11.677 -4.773 2.010 1.00 . A A . 46 VAL C 1 1 18 11486 1 1 46 VAL CA C 11.407 -6.270 2.019 1.00 . A A . 46 VAL CA 1 1 18 11487 1 1 46 VAL CB C 10.714 -6.674 0.696 1.00 . A A . 46 VAL CB 1 1 18 11488 1 1 46 VAL CG1 C 11.467 -7.813 0.033 1.00 . A A . 46 VAL CG1 1 1 18 11489 1 1 46 VAL CG2 C 9.255 -7.055 0.923 1.00 . A A . 46 VAL CG2 1 1 18 11490 1 1 46 VAL H H 9.925 -6.000 3.497 1.00 . A A . 46 VAL H 1 1 18 11491 1 1 46 VAL HA H 12.349 -6.794 2.086 1.00 . A A . 46 VAL HA 1 1 18 11492 1 1 46 VAL HB H 10.740 -5.823 0.029 1.00 . A A . 46 VAL HB 1 1 18 11493 1 1 46 VAL HG11 H 11.728 -8.552 0.776 1.00 . A A . 46 VAL HG11 1 1 18 11494 1 1 46 VAL HG12 H 10.841 -8.266 -0.721 1.00 . A A . 46 VAL HG12 1 1 18 11495 1 1 46 VAL HG13 H 12.366 -7.431 -0.426 1.00 . A A . 46 VAL HG13 1 1 18 11496 1 1 46 VAL HG21 H 8.698 -6.183 1.236 1.00 . A A . 46 VAL HG21 1 1 18 11497 1 1 46 VAL HG22 H 8.834 -7.439 0.005 1.00 . A A . 46 VAL HG22 1 1 18 11498 1 1 46 VAL HG23 H 9.196 -7.813 1.690 1.00 . A A . 46 VAL HG23 1 1 18 11499 1 1 46 VAL N N 10.615 -6.623 3.188 1.00 . A A . 46 VAL N 1 1 18 11500 1 1 46 VAL O O 12.046 -4.229 0.948 1.00 . A A . 46 VAL O 1 1 18 11501 1 1 46 VAL OXT O 11.507 -4.144 3.077 1.00 . A A . 46 VAL OXT 1 1 18 11502 2 2 1 ZN ZN ZN -0.285 0.035 -0.153 1.00 . B A . 47 ZN ZN 1 1 19 11503 1 1 1 GLY C C 7.663 19.188 -16.579 1.00 . A A . 1 GLY C 1 1 19 11504 1 1 1 GLY CA C 7.587 20.091 -17.791 1.00 . A A . 1 GLY CA 1 1 19 11505 1 1 1 GLY H1 H 9.337 21.031 -17.160 1.00 . A A . 1 GLY H1 1 1 19 11506 1 1 1 GLY H2 H 7.963 22.020 -17.084 1.00 . A A . 1 GLY H2 1 1 19 11507 1 1 1 GLY H3 H 8.685 21.680 -18.581 1.00 . A A . 1 GLY H3 1 1 19 11508 1 1 1 GLY HA2 H 6.565 20.412 -17.925 1.00 . A A . 1 GLY HA2 1 1 19 11509 1 1 1 GLY HA3 H 7.899 19.538 -18.665 1.00 . A A . 1 GLY HA3 1 1 19 11510 1 1 1 GLY N N 8.450 21.288 -17.644 1.00 . A A . 1 GLY N 1 1 19 11511 1 1 1 GLY O O 7.622 19.668 -15.442 1.00 . A A . 1 GLY O 1 1 19 11512 1 1 2 SER C C 6.668 16.924 -14.849 1.00 . A A . 2 SER C 1 1 19 11513 1 1 2 SER CA C 7.893 16.887 -15.765 1.00 . A A . 2 SER CA 1 1 19 11514 1 1 2 SER CB C 9.177 17.093 -14.951 1.00 . A A . 2 SER CB 1 1 19 11515 1 1 2 SER H H 7.828 17.585 -17.763 1.00 . A A . 2 SER H 1 1 19 11516 1 1 2 SER HA H 7.935 15.918 -16.237 1.00 . A A . 2 SER HA 1 1 19 11517 1 1 2 SER HB2 H 9.019 17.874 -14.224 1.00 . A A . 2 SER HB2 1 1 19 11518 1 1 2 SER HB3 H 9.428 16.173 -14.443 1.00 . A A . 2 SER HB3 1 1 19 11519 1 1 2 SER HG H 10.188 16.998 -16.641 1.00 . A A . 2 SER HG 1 1 19 11520 1 1 2 SER N N 7.794 17.886 -16.826 1.00 . A A . 2 SER N 1 1 19 11521 1 1 2 SER O O 6.783 17.136 -13.643 1.00 . A A . 2 SER O 1 1 19 11522 1 1 2 SER OG O 10.265 17.463 -15.790 1.00 . A A . 2 SER OG 1 1 19 11523 1 1 3 MET C C 3.980 15.287 -14.112 1.00 . A A . 3 MET C 1 1 19 11524 1 1 3 MET CA C 4.254 16.686 -14.659 1.00 . A A . 3 MET CA 1 1 19 11525 1 1 3 MET CB C 3.080 17.151 -15.522 1.00 . A A . 3 MET CB 1 1 19 11526 1 1 3 MET CE C -0.465 18.519 -13.883 1.00 . A A . 3 MET CE 1 1 19 11527 1 1 3 MET CG C 2.110 18.060 -14.785 1.00 . A A . 3 MET CG 1 1 19 11528 1 1 3 MET H H 5.462 16.529 -16.399 1.00 . A A . 3 MET H 1 1 19 11529 1 1 3 MET HA H 4.372 17.367 -13.828 1.00 . A A . 3 MET HA 1 1 19 11530 1 1 3 MET HB2 H 3.468 17.689 -16.375 1.00 . A A . 3 MET HB2 1 1 19 11531 1 1 3 MET HB3 H 2.537 16.285 -15.870 1.00 . A A . 3 MET HB3 1 1 19 11532 1 1 3 MET HE1 H -1.528 18.506 -14.070 1.00 . A A . 3 MET HE1 1 1 19 11533 1 1 3 MET HE2 H -0.248 17.956 -12.986 1.00 . A A . 3 MET HE2 1 1 19 11534 1 1 3 MET HE3 H -0.135 19.541 -13.754 1.00 . A A . 3 MET HE3 1 1 19 11535 1 1 3 MET HG2 H 2.202 17.877 -13.724 1.00 . A A . 3 MET HG2 1 1 19 11536 1 1 3 MET HG3 H 2.370 19.086 -14.996 1.00 . A A . 3 MET HG3 1 1 19 11537 1 1 3 MET N N 5.495 16.702 -15.427 1.00 . A A . 3 MET N 1 1 19 11538 1 1 3 MET O O 3.114 15.094 -13.253 1.00 . A A . 3 MET O 1 1 19 11539 1 1 3 MET SD S 0.395 17.787 -15.274 1.00 . A A . 3 MET SD 1 1 19 11540 1 1 4 ALA C C 5.883 12.181 -14.449 1.00 . A A . 4 ALA C 1 1 19 11541 1 1 4 ALA CA C 4.581 12.931 -14.197 1.00 . A A . 4 ALA CA 1 1 19 11542 1 1 4 ALA CB C 3.421 12.254 -14.914 1.00 . A A . 4 ALA CB 1 1 19 11543 1 1 4 ALA H H 5.374 14.532 -15.328 1.00 . A A . 4 ALA H 1 1 19 11544 1 1 4 ALA HA H 4.373 12.928 -13.136 1.00 . A A . 4 ALA HA 1 1 19 11545 1 1 4 ALA HB1 H 3.804 11.521 -15.610 1.00 . A A . 4 ALA HB1 1 1 19 11546 1 1 4 ALA HB2 H 2.786 11.765 -14.189 1.00 . A A . 4 ALA HB2 1 1 19 11547 1 1 4 ALA HB3 H 2.848 12.996 -15.450 1.00 . A A . 4 ALA HB3 1 1 19 11548 1 1 4 ALA N N 4.714 14.314 -14.628 1.00 . A A . 4 ALA N 1 1 19 11549 1 1 4 ALA O O 5.882 10.998 -14.790 1.00 . A A . 4 ALA O 1 1 19 11550 1 1 5 ALA C C 8.828 11.641 -13.238 1.00 . A A . 5 ALA C 1 1 19 11551 1 1 5 ALA CA C 8.312 12.309 -14.505 1.00 . A A . 5 ALA CA 1 1 19 11552 1 1 5 ALA CB C 9.281 13.379 -14.984 1.00 . A A . 5 ALA CB 1 1 19 11553 1 1 5 ALA H H 6.927 13.818 -13.987 1.00 . A A . 5 ALA H 1 1 19 11554 1 1 5 ALA HA H 8.222 11.562 -15.279 1.00 . A A . 5 ALA HA 1 1 19 11555 1 1 5 ALA HB1 H 9.212 13.473 -16.057 1.00 . A A . 5 ALA HB1 1 1 19 11556 1 1 5 ALA HB2 H 9.033 14.323 -14.524 1.00 . A A . 5 ALA HB2 1 1 19 11557 1 1 5 ALA HB3 H 10.287 13.100 -14.713 1.00 . A A . 5 ALA HB3 1 1 19 11558 1 1 5 ALA N N 6.995 12.885 -14.281 1.00 . A A . 5 ALA N 1 1 19 11559 1 1 5 ALA O O 9.948 11.893 -12.791 1.00 . A A . 5 ALA O 1 1 19 11560 1 1 6 HIS C C 8.289 8.534 -11.779 1.00 . A A . 6 HIS C 1 1 19 11561 1 1 6 HIS CA C 8.357 10.024 -11.487 1.00 . A A . 6 HIS CA 1 1 19 11562 1 1 6 HIS CB C 7.410 10.374 -10.339 1.00 . A A . 6 HIS CB 1 1 19 11563 1 1 6 HIS CD2 C 8.640 12.432 -9.359 1.00 . A A . 6 HIS CD2 1 1 19 11564 1 1 6 HIS CE1 C 8.680 11.816 -7.260 1.00 . A A . 6 HIS CE1 1 1 19 11565 1 1 6 HIS CG C 8.032 11.226 -9.278 1.00 . A A . 6 HIS CG 1 1 19 11566 1 1 6 HIS H H 7.141 10.594 -13.117 1.00 . A A . 6 HIS H 1 1 19 11567 1 1 6 HIS HA H 9.368 10.284 -11.211 1.00 . A A . 6 HIS HA 1 1 19 11568 1 1 6 HIS HB2 H 6.560 10.910 -10.737 1.00 . A A . 6 HIS HB2 1 1 19 11569 1 1 6 HIS HB3 H 7.066 9.459 -9.876 1.00 . A A . 6 HIS HB3 1 1 19 11570 1 1 6 HIS HD1 H 7.707 10.038 -7.567 1.00 . A A . 6 HIS HD1 1 1 19 11571 1 1 6 HIS HD2 H 8.790 13.014 -10.257 1.00 . A A . 6 HIS HD2 1 1 19 11572 1 1 6 HIS HE1 H 8.862 11.803 -6.194 1.00 . A A . 6 HIS HE1 1 1 19 11573 1 1 6 HIS HE2 H 9.704 13.475 -7.881 1.00 . A A . 6 HIS HE2 1 1 19 11574 1 1 6 HIS N N 8.004 10.771 -12.682 1.00 . A A . 6 HIS N 1 1 19 11575 1 1 6 HIS ND1 N 8.074 10.868 -7.950 1.00 . A A . 6 HIS ND1 1 1 19 11576 1 1 6 HIS NE2 N 9.035 12.777 -8.091 1.00 . A A . 6 HIS NE2 1 1 19 11577 1 1 6 HIS O O 7.679 8.121 -12.763 1.00 . A A . 6 HIS O 1 1 19 11578 1 1 7 SER C C 7.640 5.684 -10.428 1.00 . A A . 7 SER C 1 1 19 11579 1 1 7 SER CA C 8.873 6.285 -11.105 1.00 . A A . 7 SER CA 1 1 19 11580 1 1 7 SER CB C 10.151 5.667 -10.548 1.00 . A A . 7 SER CB 1 1 19 11581 1 1 7 SER H H 9.351 8.105 -10.134 1.00 . A A . 7 SER H 1 1 19 11582 1 1 7 SER HA H 8.819 6.086 -12.166 1.00 . A A . 7 SER HA 1 1 19 11583 1 1 7 SER HB2 H 9.950 5.241 -9.576 1.00 . A A . 7 SER HB2 1 1 19 11584 1 1 7 SER HB3 H 10.493 4.893 -11.218 1.00 . A A . 7 SER HB3 1 1 19 11585 1 1 7 SER HG H 11.112 7.276 -11.147 1.00 . A A . 7 SER HG 1 1 19 11586 1 1 7 SER N N 8.896 7.726 -10.924 1.00 . A A . 7 SER N 1 1 19 11587 1 1 7 SER O O 6.758 6.418 -9.975 1.00 . A A . 7 SER O 1 1 19 11588 1 1 7 SER OG O 11.173 6.643 -10.418 1.00 . A A . 7 SER OG 1 1 19 11589 1 1 8 ALA C C 6.490 3.739 -8.209 1.00 . A A . 8 ALA C 1 1 19 11590 1 1 8 ALA CA C 6.448 3.671 -9.735 1.00 . A A . 8 ALA CA 1 1 19 11591 1 1 8 ALA CB C 6.401 2.224 -10.194 1.00 . A A . 8 ALA CB 1 1 19 11592 1 1 8 ALA H H 8.330 3.822 -10.704 1.00 . A A . 8 ALA H 1 1 19 11593 1 1 8 ALA HA H 5.548 4.159 -10.077 1.00 . A A . 8 ALA HA 1 1 19 11594 1 1 8 ALA HB1 H 7.391 1.908 -10.491 1.00 . A A . 8 ALA HB1 1 1 19 11595 1 1 8 ALA HB2 H 6.051 1.599 -9.386 1.00 . A A . 8 ALA HB2 1 1 19 11596 1 1 8 ALA HB3 H 5.727 2.135 -11.034 1.00 . A A . 8 ALA HB3 1 1 19 11597 1 1 8 ALA N N 7.589 4.358 -10.339 1.00 . A A . 8 ALA N 1 1 19 11598 1 1 8 ALA O O 5.763 3.022 -7.522 1.00 . A A . 8 ALA O 1 1 19 11599 1 1 9 ASP C C 6.458 5.955 -5.799 1.00 . A A . 9 ASP C 1 1 19 11600 1 1 9 ASP CA C 7.384 4.832 -6.239 1.00 . A A . 9 ASP CA 1 1 19 11601 1 1 9 ASP CB C 8.820 5.128 -5.818 1.00 . A A . 9 ASP CB 1 1 19 11602 1 1 9 ASP CG C 9.137 4.603 -4.432 1.00 . A A . 9 ASP CG 1 1 19 11603 1 1 9 ASP H H 7.819 5.224 -8.269 1.00 . A A . 9 ASP H 1 1 19 11604 1 1 9 ASP HA H 7.056 3.917 -5.770 1.00 . A A . 9 ASP HA 1 1 19 11605 1 1 9 ASP HB2 H 9.497 4.668 -6.522 1.00 . A A . 9 ASP HB2 1 1 19 11606 1 1 9 ASP HB3 H 8.974 6.197 -5.822 1.00 . A A . 9 ASP HB3 1 1 19 11607 1 1 9 ASP N N 7.298 4.644 -7.679 1.00 . A A . 9 ASP N 1 1 19 11608 1 1 9 ASP O O 6.712 6.653 -4.823 1.00 . A A . 9 ASP O 1 1 19 11609 1 1 9 ASP OD1 O 8.222 4.089 -3.754 1.00 . A A . 9 ASP OD1 1 1 19 11610 1 1 9 ASP OD2 O 10.315 4.670 -4.026 1.00 . A A . 9 ASP OD2 1 1 19 11611 1 1 10 LEU C C 3.226 6.283 -5.306 1.00 . A A . 10 LEU C 1 1 19 11612 1 1 10 LEU CA C 4.280 6.994 -6.135 1.00 . A A . 10 LEU CA 1 1 19 11613 1 1 10 LEU CB C 3.642 7.587 -7.398 1.00 . A A . 10 LEU CB 1 1 19 11614 1 1 10 LEU CD1 C 2.640 5.612 -8.591 1.00 . A A . 10 LEU CD1 1 1 19 11615 1 1 10 LEU CD2 C 3.528 7.537 -9.904 1.00 . A A . 10 LEU CD2 1 1 19 11616 1 1 10 LEU CG C 3.699 6.700 -8.648 1.00 . A A . 10 LEU CG 1 1 19 11617 1 1 10 LEU H H 5.165 5.395 -7.195 1.00 . A A . 10 LEU H 1 1 19 11618 1 1 10 LEU HA H 4.720 7.786 -5.548 1.00 . A A . 10 LEU HA 1 1 19 11619 1 1 10 LEU HB2 H 2.603 7.799 -7.182 1.00 . A A . 10 LEU HB2 1 1 19 11620 1 1 10 LEU HB3 H 4.140 8.516 -7.623 1.00 . A A . 10 LEU HB3 1 1 19 11621 1 1 10 LEU HD11 H 1.670 6.061 -8.443 1.00 . A A . 10 LEU HD11 1 1 19 11622 1 1 10 LEU HD12 H 2.644 5.057 -9.516 1.00 . A A . 10 LEU HD12 1 1 19 11623 1 1 10 LEU HD13 H 2.857 4.945 -7.769 1.00 . A A . 10 LEU HD13 1 1 19 11624 1 1 10 LEU HD21 H 3.557 6.893 -10.771 1.00 . A A . 10 LEU HD21 1 1 19 11625 1 1 10 LEU HD22 H 2.579 8.051 -9.867 1.00 . A A . 10 LEU HD22 1 1 19 11626 1 1 10 LEU HD23 H 4.327 8.259 -9.965 1.00 . A A . 10 LEU HD23 1 1 19 11627 1 1 10 LEU HG H 4.664 6.220 -8.696 1.00 . A A . 10 LEU HG 1 1 19 11628 1 1 10 LEU N N 5.331 6.045 -6.483 1.00 . A A . 10 LEU N 1 1 19 11629 1 1 10 LEU O O 2.048 6.639 -5.317 1.00 . A A . 10 LEU O 1 1 19 11630 1 1 11 LYS C C 3.004 4.433 -2.468 1.00 . A A . 11 LYS C 1 1 19 11631 1 1 11 LYS CA C 2.759 4.323 -3.970 1.00 . A A . 11 LYS CA 1 1 19 11632 1 1 11 LYS CB C 2.946 2.891 -4.486 1.00 . A A . 11 LYS CB 1 1 19 11633 1 1 11 LYS CD C 4.301 0.796 -4.333 1.00 . A A . 11 LYS CD 1 1 19 11634 1 1 11 LYS CE C 5.021 0.137 -3.175 1.00 . A A . 11 LYS CE 1 1 19 11635 1 1 11 LYS CG C 4.326 2.309 -4.225 1.00 . A A . 11 LYS CG 1 1 19 11636 1 1 11 LYS H H 4.586 4.935 -4.792 1.00 . A A . 11 LYS H 1 1 19 11637 1 1 11 LYS HA H 1.747 4.632 -4.173 1.00 . A A . 11 LYS HA 1 1 19 11638 1 1 11 LYS HB2 H 2.215 2.249 -4.027 1.00 . A A . 11 LYS HB2 1 1 19 11639 1 1 11 LYS HB3 H 2.783 2.890 -5.554 1.00 . A A . 11 LYS HB3 1 1 19 11640 1 1 11 LYS HD2 H 3.273 0.468 -4.332 1.00 . A A . 11 LYS HD2 1 1 19 11641 1 1 11 LYS HD3 H 4.775 0.502 -5.257 1.00 . A A . 11 LYS HD3 1 1 19 11642 1 1 11 LYS HE2 H 5.201 -0.899 -3.423 1.00 . A A . 11 LYS HE2 1 1 19 11643 1 1 11 LYS HE3 H 5.965 0.638 -3.023 1.00 . A A . 11 LYS HE3 1 1 19 11644 1 1 11 LYS HG2 H 5.019 2.705 -4.954 1.00 . A A . 11 LYS HG2 1 1 19 11645 1 1 11 LYS HG3 H 4.645 2.589 -3.231 1.00 . A A . 11 LYS HG3 1 1 19 11646 1 1 11 LYS HZ1 H 4.364 -0.668 -1.368 1.00 . A A . 11 LYS HZ1 1 1 19 11647 1 1 11 LYS HZ2 H 3.214 0.308 -2.133 1.00 . A A . 11 LYS HZ2 1 1 19 11648 1 1 11 LYS HZ3 H 4.536 1.014 -1.345 1.00 . A A . 11 LYS HZ3 1 1 19 11649 1 1 11 LYS N N 3.649 5.195 -4.695 1.00 . A A . 11 LYS N 1 1 19 11650 1 1 11 LYS NZ N 4.228 0.204 -1.922 1.00 . A A . 11 LYS NZ 1 1 19 11651 1 1 11 LYS O O 3.318 5.512 -1.962 1.00 . A A . 11 LYS O 1 1 19 11652 1 1 12 CYS C C 4.168 2.838 0.171 1.00 . A A . 12 CYS C 1 1 19 11653 1 1 12 CYS CA C 2.801 3.349 -0.310 1.00 . A A . 12 CYS CA 1 1 19 11654 1 1 12 CYS CB C 1.683 2.445 0.177 1.00 . A A . 12 CYS CB 1 1 19 11655 1 1 12 CYS H H 2.391 2.570 -2.210 1.00 . A A . 12 CYS H 1 1 19 11656 1 1 12 CYS HA H 2.636 4.354 0.053 1.00 . A A . 12 CYS HA 1 1 19 11657 1 1 12 CYS HB2 H 1.843 2.200 1.214 1.00 . A A . 12 CYS HB2 1 1 19 11658 1 1 12 CYS HB3 H 0.740 2.965 0.075 1.00 . A A . 12 CYS HB3 1 1 19 11659 1 1 12 CYS N N 2.733 3.361 -1.755 1.00 . A A . 12 CYS N 1 1 19 11660 1 1 12 CYS O O 5.011 2.453 -0.643 1.00 . A A . 12 CYS O 1 1 19 11661 1 1 12 CYS SG S 1.568 0.897 -0.768 1.00 . A A . 12 CYS SG 1 1 19 11662 1 1 13 PRO C C 5.781 0.794 2.033 1.00 . A A . 13 PRO C 1 1 19 11663 1 1 13 PRO CA C 5.672 2.323 2.062 1.00 . A A . 13 PRO CA 1 1 19 11664 1 1 13 PRO CB C 5.617 2.822 3.506 1.00 . A A . 13 PRO CB 1 1 19 11665 1 1 13 PRO CD C 3.489 3.296 2.548 1.00 . A A . 13 PRO CD 1 1 19 11666 1 1 13 PRO CG C 4.166 2.895 3.824 1.00 . A A . 13 PRO CG 1 1 19 11667 1 1 13 PRO HA H 6.525 2.755 1.559 1.00 . A A . 13 PRO HA 1 1 19 11668 1 1 13 PRO HB2 H 6.133 2.127 4.152 1.00 . A A . 13 PRO HB2 1 1 19 11669 1 1 13 PRO HB3 H 6.076 3.792 3.570 1.00 . A A . 13 PRO HB3 1 1 19 11670 1 1 13 PRO HD2 H 2.526 2.816 2.466 1.00 . A A . 13 PRO HD2 1 1 19 11671 1 1 13 PRO HD3 H 3.382 4.370 2.501 1.00 . A A . 13 PRO HD3 1 1 19 11672 1 1 13 PRO HG2 H 3.813 1.928 4.149 1.00 . A A . 13 PRO HG2 1 1 19 11673 1 1 13 PRO HG3 H 3.993 3.637 4.587 1.00 . A A . 13 PRO HG3 1 1 19 11674 1 1 13 PRO N N 4.408 2.813 1.496 1.00 . A A . 13 PRO N 1 1 19 11675 1 1 13 PRO O O 6.879 0.241 2.046 1.00 . A A . 13 PRO O 1 1 19 11676 1 1 14 THR C C 5.211 -1.976 0.848 1.00 . A A . 14 THR C 1 1 19 11677 1 1 14 THR CA C 4.570 -1.334 2.082 1.00 . A A . 14 THR CA 1 1 19 11678 1 1 14 THR CB C 3.109 -1.787 2.188 1.00 . A A . 14 THR CB 1 1 19 11679 1 1 14 THR CG2 C 3.009 -3.216 2.706 1.00 . A A . 14 THR CG2 1 1 19 11680 1 1 14 THR H H 3.796 0.636 2.079 1.00 . A A . 14 THR H 1 1 19 11681 1 1 14 THR HA H 5.093 -1.670 2.965 1.00 . A A . 14 THR HA 1 1 19 11682 1 1 14 THR HB H 2.658 -1.737 1.207 1.00 . A A . 14 THR HB 1 1 19 11683 1 1 14 THR HG1 H 1.481 -0.821 2.787 1.00 . A A . 14 THR HG1 1 1 19 11684 1 1 14 THR HG21 H 3.941 -3.493 3.173 1.00 . A A . 14 THR HG21 1 1 19 11685 1 1 14 THR HG22 H 2.806 -3.885 1.883 1.00 . A A . 14 THR HG22 1 1 19 11686 1 1 14 THR HG23 H 2.210 -3.281 3.430 1.00 . A A . 14 THR HG23 1 1 19 11687 1 1 14 THR N N 4.636 0.127 2.046 1.00 . A A . 14 THR N 1 1 19 11688 1 1 14 THR O O 4.772 -1.750 -0.275 1.00 . A A . 14 THR O 1 1 19 11689 1 1 14 THR OG1 O 2.413 -0.900 3.068 1.00 . A A . 14 THR OG1 1 1 19 11690 1 1 15 PRO C C 6.230 -4.393 -0.844 1.00 . A A . 15 PRO C 1 1 19 11691 1 1 15 PRO CA C 7.045 -3.361 -0.065 1.00 . A A . 15 PRO CA 1 1 19 11692 1 1 15 PRO CB C 8.229 -4.039 0.634 1.00 . A A . 15 PRO CB 1 1 19 11693 1 1 15 PRO CD C 6.927 -3.014 2.339 1.00 . A A . 15 PRO CD 1 1 19 11694 1 1 15 PRO CG C 8.332 -3.362 1.952 1.00 . A A . 15 PRO CG 1 1 19 11695 1 1 15 PRO HA H 7.413 -2.610 -0.749 1.00 . A A . 15 PRO HA 1 1 19 11696 1 1 15 PRO HB2 H 8.028 -5.094 0.748 1.00 . A A . 15 PRO HB2 1 1 19 11697 1 1 15 PRO HB3 H 9.126 -3.900 0.052 1.00 . A A . 15 PRO HB3 1 1 19 11698 1 1 15 PRO HD2 H 6.454 -3.847 2.840 1.00 . A A . 15 PRO HD2 1 1 19 11699 1 1 15 PRO HD3 H 6.914 -2.133 2.963 1.00 . A A . 15 PRO HD3 1 1 19 11700 1 1 15 PRO HG2 H 8.769 -4.030 2.676 1.00 . A A . 15 PRO HG2 1 1 19 11701 1 1 15 PRO HG3 H 8.929 -2.466 1.857 1.00 . A A . 15 PRO HG3 1 1 19 11702 1 1 15 PRO N N 6.292 -2.748 1.040 1.00 . A A . 15 PRO N 1 1 19 11703 1 1 15 PRO O O 6.364 -4.508 -2.064 1.00 . A A . 15 PRO O 1 1 19 11704 1 1 16 GLY C C 3.381 -5.704 -1.403 1.00 . A A . 16 GLY C 1 1 19 11705 1 1 16 GLY CA C 4.654 -6.223 -0.772 1.00 . A A . 16 GLY CA 1 1 19 11706 1 1 16 GLY H H 5.399 -5.077 0.837 1.00 . A A . 16 GLY H 1 1 19 11707 1 1 16 GLY HA2 H 5.261 -6.680 -1.536 1.00 . A A . 16 GLY HA2 1 1 19 11708 1 1 16 GLY HA3 H 4.399 -6.972 -0.035 1.00 . A A . 16 GLY HA3 1 1 19 11709 1 1 16 GLY N N 5.428 -5.176 -0.132 1.00 . A A . 16 GLY N 1 1 19 11710 1 1 16 GLY O O 2.738 -6.397 -2.191 1.00 . A A . 16 GLY O 1 1 19 11711 1 1 17 CYS C C 2.200 -3.005 -2.813 1.00 . A A . 17 CYS C 1 1 19 11712 1 1 17 CYS CA C 1.837 -3.848 -1.596 1.00 . A A . 17 CYS CA 1 1 19 11713 1 1 17 CYS CB C 1.196 -3.000 -0.505 1.00 . A A . 17 CYS CB 1 1 19 11714 1 1 17 CYS H H 3.595 -3.975 -0.450 1.00 . A A . 17 CYS H 1 1 19 11715 1 1 17 CYS HA H 1.148 -4.625 -1.896 1.00 . A A . 17 CYS HA 1 1 19 11716 1 1 17 CYS HB2 H 1.033 -3.620 0.364 1.00 . A A . 17 CYS HB2 1 1 19 11717 1 1 17 CYS HB3 H 1.874 -2.202 -0.241 1.00 . A A . 17 CYS HB3 1 1 19 11718 1 1 17 CYS N N 3.026 -4.479 -1.064 1.00 . A A . 17 CYS N 1 1 19 11719 1 1 17 CYS O O 3.344 -2.566 -2.955 1.00 . A A . 17 CYS O 1 1 19 11720 1 1 17 CYS SG S -0.401 -2.241 -0.934 1.00 . A A . 17 CYS SG 1 1 19 11721 1 1 18 ASP C C 0.989 -0.700 -4.898 1.00 . A A . 18 ASP C 1 1 19 11722 1 1 18 ASP CA C 1.509 -2.133 -4.968 1.00 . A A . 18 ASP CA 1 1 19 11723 1 1 18 ASP CB C 0.879 -2.872 -6.153 1.00 . A A . 18 ASP CB 1 1 19 11724 1 1 18 ASP CG C -0.524 -2.398 -6.474 1.00 . A A . 18 ASP CG 1 1 19 11725 1 1 18 ASP H H 0.372 -3.258 -3.577 1.00 . A A . 18 ASP H 1 1 19 11726 1 1 18 ASP HA H 2.579 -2.102 -5.108 1.00 . A A . 18 ASP HA 1 1 19 11727 1 1 18 ASP HB2 H 1.494 -2.725 -7.027 1.00 . A A . 18 ASP HB2 1 1 19 11728 1 1 18 ASP HB3 H 0.836 -3.927 -5.925 1.00 . A A . 18 ASP HB3 1 1 19 11729 1 1 18 ASP N N 1.250 -2.845 -3.722 1.00 . A A . 18 ASP N 1 1 19 11730 1 1 18 ASP O O 1.421 0.163 -5.662 1.00 . A A . 18 ASP O 1 1 19 11731 1 1 18 ASP OD1 O -1.408 -2.487 -5.599 1.00 . A A . 18 ASP OD1 1 1 19 11732 1 1 18 ASP OD2 O -0.743 -1.921 -7.610 1.00 . A A . 18 ASP OD2 1 1 19 11733 1 1 19 GLY C C -1.687 1.210 -4.367 1.00 . A A . 19 GLY C 1 1 19 11734 1 1 19 GLY CA C -0.345 0.926 -3.722 1.00 . A A . 19 GLY CA 1 1 19 11735 1 1 19 GLY H H -0.137 -1.144 -3.305 1.00 . A A . 19 GLY H 1 1 19 11736 1 1 19 GLY HA2 H -0.426 1.105 -2.661 1.00 . A A . 19 GLY HA2 1 1 19 11737 1 1 19 GLY HA3 H 0.382 1.607 -4.133 1.00 . A A . 19 GLY HA3 1 1 19 11738 1 1 19 GLY N N 0.125 -0.430 -3.929 1.00 . A A . 19 GLY N 1 1 19 11739 1 1 19 GLY O O -2.217 2.317 -4.241 1.00 . A A . 19 GLY O 1 1 19 11740 1 1 20 SER C C -4.638 -0.346 -4.830 1.00 . A A . 20 SER C 1 1 19 11741 1 1 20 SER CA C -3.574 0.384 -5.635 1.00 . A A . 20 SER CA 1 1 19 11742 1 1 20 SER CB C -3.552 -0.118 -7.079 1.00 . A A . 20 SER CB 1 1 19 11743 1 1 20 SER H H -1.822 -0.661 -5.064 1.00 . A A . 20 SER H 1 1 19 11744 1 1 20 SER HA H -3.803 1.440 -5.637 1.00 . A A . 20 SER HA 1 1 19 11745 1 1 20 SER HB2 H -3.716 -1.186 -7.089 1.00 . A A . 20 SER HB2 1 1 19 11746 1 1 20 SER HB3 H -4.332 0.372 -7.643 1.00 . A A . 20 SER HB3 1 1 19 11747 1 1 20 SER HG H -1.711 -0.608 -7.565 1.00 . A A . 20 SER HG 1 1 19 11748 1 1 20 SER N N -2.266 0.218 -5.020 1.00 . A A . 20 SER N 1 1 19 11749 1 1 20 SER O O -4.338 -1.291 -4.097 1.00 . A A . 20 SER O 1 1 19 11750 1 1 20 SER OG O -2.301 0.156 -7.692 1.00 . A A . 20 SER OG 1 1 19 11751 1 1 21 GLY C C -6.894 -0.142 -2.701 1.00 . A A . 21 GLY C 1 1 19 11752 1 1 21 GLY CA C -6.955 -0.460 -4.176 1.00 . A A . 21 GLY CA 1 1 19 11753 1 1 21 GLY H H -6.032 0.927 -5.480 1.00 . A A . 21 GLY H 1 1 19 11754 1 1 21 GLY HA2 H -7.893 -0.097 -4.568 1.00 . A A . 21 GLY HA2 1 1 19 11755 1 1 21 GLY HA3 H -6.914 -1.532 -4.303 1.00 . A A . 21 GLY HA3 1 1 19 11756 1 1 21 GLY N N -5.865 0.140 -4.916 1.00 . A A . 21 GLY N 1 1 19 11757 1 1 21 GLY O O -6.056 0.637 -2.261 1.00 . A A . 21 GLY O 1 1 19 11758 1 1 22 HIS C C -8.365 -1.872 0.139 1.00 . A A . 22 HIS C 1 1 19 11759 1 1 22 HIS CA C -7.827 -0.603 -0.496 1.00 . A A . 22 HIS CA 1 1 19 11760 1 1 22 HIS CB C -8.721 0.575 -0.084 1.00 . A A . 22 HIS CB 1 1 19 11761 1 1 22 HIS CD2 C -7.332 2.703 -0.672 1.00 . A A . 22 HIS CD2 1 1 19 11762 1 1 22 HIS CE1 C -7.340 3.625 1.311 1.00 . A A . 22 HIS CE1 1 1 19 11763 1 1 22 HIS CG C -8.007 1.872 0.160 1.00 . A A . 22 HIS CG 1 1 19 11764 1 1 22 HIS H H -8.405 -1.378 -2.375 1.00 . A A . 22 HIS H 1 1 19 11765 1 1 22 HIS HA H -6.819 -0.429 -0.141 1.00 . A A . 22 HIS HA 1 1 19 11766 1 1 22 HIS HB2 H -9.448 0.749 -0.862 1.00 . A A . 22 HIS HB2 1 1 19 11767 1 1 22 HIS HB3 H -9.244 0.313 0.826 1.00 . A A . 22 HIS HB3 1 1 19 11768 1 1 22 HIS HD1 H -8.382 2.120 2.224 1.00 . A A . 22 HIS HD1 1 1 19 11769 1 1 22 HIS HD2 H -7.150 2.547 -1.728 1.00 . A A . 22 HIS HD2 1 1 19 11770 1 1 22 HIS HE1 H -7.185 4.319 2.123 1.00 . A A . 22 HIS HE1 1 1 19 11771 1 1 22 HIS HE2 H -6.554 4.625 -0.295 1.00 . A A . 22 HIS HE2 1 1 19 11772 1 1 22 HIS N N -7.777 -0.758 -1.946 1.00 . A A . 22 HIS N 1 1 19 11773 1 1 22 HIS ND1 N -7.987 2.480 1.394 1.00 . A A . 22 HIS ND1 1 1 19 11774 1 1 22 HIS NE2 N -6.931 3.785 0.071 1.00 . A A . 22 HIS NE2 1 1 19 11775 1 1 22 HIS O O -9.134 -2.600 -0.487 1.00 . A A . 22 HIS O 1 1 19 11776 1 1 23 ILE C C -10.107 -2.958 2.408 1.00 . A A . 23 ILE C 1 1 19 11777 1 1 23 ILE CA C -8.614 -3.189 2.161 1.00 . A A . 23 ILE CA 1 1 19 11778 1 1 23 ILE CB C -7.847 -3.399 3.497 1.00 . A A . 23 ILE CB 1 1 19 11779 1 1 23 ILE CD1 C -8.004 -5.933 3.210 1.00 . A A . 23 ILE CD1 1 1 19 11780 1 1 23 ILE CG1 C -7.110 -4.741 3.481 1.00 . A A . 23 ILE CG1 1 1 19 11781 1 1 23 ILE CG2 C -8.765 -3.310 4.713 1.00 . A A . 23 ILE CG2 1 1 19 11782 1 1 23 ILE H H -7.505 -1.409 1.882 1.00 . A A . 23 ILE H 1 1 19 11783 1 1 23 ILE HA H -8.497 -4.079 1.560 1.00 . A A . 23 ILE HA 1 1 19 11784 1 1 23 ILE HB H -7.116 -2.608 3.584 1.00 . A A . 23 ILE HB 1 1 19 11785 1 1 23 ILE HD11 H -7.586 -6.523 2.408 1.00 . A A . 23 ILE HD11 1 1 19 11786 1 1 23 ILE HD12 H -8.078 -6.539 4.101 1.00 . A A . 23 ILE HD12 1 1 19 11787 1 1 23 ILE HD13 H -8.987 -5.588 2.928 1.00 . A A . 23 ILE HD13 1 1 19 11788 1 1 23 ILE HG12 H -6.354 -4.717 2.711 1.00 . A A . 23 ILE HG12 1 1 19 11789 1 1 23 ILE HG13 H -6.634 -4.894 4.440 1.00 . A A . 23 ILE HG13 1 1 19 11790 1 1 23 ILE HG21 H -9.445 -4.150 4.713 1.00 . A A . 23 ILE HG21 1 1 19 11791 1 1 23 ILE HG22 H -8.171 -3.330 5.614 1.00 . A A . 23 ILE HG22 1 1 19 11792 1 1 23 ILE HG23 H -9.330 -2.391 4.673 1.00 . A A . 23 ILE HG23 1 1 19 11793 1 1 23 ILE N N -8.059 -2.072 1.411 1.00 . A A . 23 ILE N 1 1 19 11794 1 1 23 ILE O O -10.904 -3.899 2.409 1.00 . A A . 23 ILE O 1 1 19 11795 1 1 24 THR C C -12.704 -1.588 1.466 1.00 . A A . 24 THR C 1 1 19 11796 1 1 24 THR CA C -11.878 -1.301 2.724 1.00 . A A . 24 THR CA 1 1 19 11797 1 1 24 THR CB C -12.005 0.201 3.101 1.00 . A A . 24 THR CB 1 1 19 11798 1 1 24 THR CG2 C -11.490 1.091 1.985 1.00 . A A . 24 THR CG2 1 1 19 11799 1 1 24 THR H H -9.799 -0.982 2.498 1.00 . A A . 24 THR H 1 1 19 11800 1 1 24 THR HA H -12.272 -1.884 3.541 1.00 . A A . 24 THR HA 1 1 19 11801 1 1 24 THR HB H -11.408 0.385 3.983 1.00 . A A . 24 THR HB 1 1 19 11802 1 1 24 THR HG1 H -13.748 -0.128 3.981 1.00 . A A . 24 THR HG1 1 1 19 11803 1 1 24 THR HG21 H -11.320 0.497 1.101 1.00 . A A . 24 THR HG21 1 1 19 11804 1 1 24 THR HG22 H -10.564 1.552 2.292 1.00 . A A . 24 THR HG22 1 1 19 11805 1 1 24 THR HG23 H -12.219 1.857 1.771 1.00 . A A . 24 THR HG23 1 1 19 11806 1 1 24 THR N N -10.484 -1.684 2.534 1.00 . A A . 24 THR N 1 1 19 11807 1 1 24 THR O O -13.916 -1.803 1.542 1.00 . A A . 24 THR O 1 1 19 11808 1 1 24 THR OG1 O -13.370 0.540 3.383 1.00 . A A . 24 THR OG1 1 1 19 11809 1 1 25 GLY C C -13.630 -0.704 -1.311 1.00 . A A . 25 GLY C 1 1 19 11810 1 1 25 GLY CA C -12.727 -1.859 -0.938 1.00 . A A . 25 GLY CA 1 1 19 11811 1 1 25 GLY H H -11.071 -1.475 0.316 1.00 . A A . 25 GLY H 1 1 19 11812 1 1 25 GLY HA2 H -11.996 -2.002 -1.722 1.00 . A A . 25 GLY HA2 1 1 19 11813 1 1 25 GLY HA3 H -13.324 -2.753 -0.844 1.00 . A A . 25 GLY HA3 1 1 19 11814 1 1 25 GLY N N -12.039 -1.613 0.313 1.00 . A A . 25 GLY N 1 1 19 11815 1 1 25 GLY O O -14.825 -0.890 -1.542 1.00 . A A . 25 GLY O 1 1 19 11816 1 1 26 ASN C C -13.072 2.790 -2.195 1.00 . A A . 26 ASN C 1 1 19 11817 1 1 26 ASN CA C -13.875 1.711 -1.475 1.00 . A A . 26 ASN CA 1 1 19 11818 1 1 26 ASN CB C -14.363 2.259 -0.130 1.00 . A A . 26 ASN CB 1 1 19 11819 1 1 26 ASN CG C -15.673 1.653 0.305 1.00 . A A . 26 ASN CG 1 1 19 11820 1 1 26 ASN H H -12.155 0.589 -0.972 1.00 . A A . 26 ASN H 1 1 19 11821 1 1 26 ASN HA H -14.730 1.446 -2.077 1.00 . A A . 26 ASN HA 1 1 19 11822 1 1 26 ASN HB2 H -13.623 2.047 0.626 1.00 . A A . 26 ASN HB2 1 1 19 11823 1 1 26 ASN HB3 H -14.496 3.325 -0.206 1.00 . A A . 26 ASN HB3 1 1 19 11824 1 1 26 ASN HD21 H -14.773 0.754 1.830 1.00 . A A . 26 ASN HD21 1 1 19 11825 1 1 26 ASN HD22 H -16.473 0.487 1.686 1.00 . A A . 26 ASN HD22 1 1 19 11826 1 1 26 ASN N N -13.084 0.504 -1.255 1.00 . A A . 26 ASN N 1 1 19 11827 1 1 26 ASN ND2 N -15.636 0.889 1.380 1.00 . A A . 26 ASN ND2 1 1 19 11828 1 1 26 ASN O O -13.517 3.933 -2.302 1.00 . A A . 26 ASN O 1 1 19 11829 1 1 26 ASN OD1 O -16.713 1.870 -0.316 1.00 . A A . 26 ASN OD1 1 1 19 11830 1 1 27 TYR C C -10.260 2.814 -4.443 1.00 . A A . 27 TYR C 1 1 19 11831 1 1 27 TYR CA C -10.980 3.426 -3.248 1.00 . A A . 27 TYR CA 1 1 19 11832 1 1 27 TYR CB C -9.953 3.926 -2.240 1.00 . A A . 27 TYR CB 1 1 19 11833 1 1 27 TYR CD1 C -10.739 6.055 -1.134 1.00 . A A . 27 TYR CD1 1 1 19 11834 1 1 27 TYR CD2 C -10.910 4.025 0.098 1.00 . A A . 27 TYR CD2 1 1 19 11835 1 1 27 TYR CE1 C -11.279 6.749 -0.071 1.00 . A A . 27 TYR CE1 1 1 19 11836 1 1 27 TYR CE2 C -11.452 4.713 1.165 1.00 . A A . 27 TYR CE2 1 1 19 11837 1 1 27 TYR CG C -10.543 4.683 -1.069 1.00 . A A . 27 TYR CG 1 1 19 11838 1 1 27 TYR CZ C -11.636 6.074 1.075 1.00 . A A . 27 TYR CZ 1 1 19 11839 1 1 27 TYR H H -11.527 1.546 -2.479 1.00 . A A . 27 TYR H 1 1 19 11840 1 1 27 TYR HA H -11.584 4.256 -3.581 1.00 . A A . 27 TYR HA 1 1 19 11841 1 1 27 TYR HB2 H -9.408 3.081 -1.846 1.00 . A A . 27 TYR HB2 1 1 19 11842 1 1 27 TYR HB3 H -9.268 4.575 -2.746 1.00 . A A . 27 TYR HB3 1 1 19 11843 1 1 27 TYR HD1 H -10.457 6.583 -2.034 1.00 . A A . 27 TYR HD1 1 1 19 11844 1 1 27 TYR HD2 H -10.770 2.954 0.165 1.00 . A A . 27 TYR HD2 1 1 19 11845 1 1 27 TYR HE1 H -11.425 7.816 -0.142 1.00 . A A . 27 TYR HE1 1 1 19 11846 1 1 27 TYR HE2 H -11.729 4.183 2.064 1.00 . A A . 27 TYR HE2 1 1 19 11847 1 1 27 TYR HH H -12.628 7.560 1.802 1.00 . A A . 27 TYR HH 1 1 19 11848 1 1 27 TYR N N -11.856 2.456 -2.617 1.00 . A A . 27 TYR N 1 1 19 11849 1 1 27 TYR O O -10.159 1.592 -4.555 1.00 . A A . 27 TYR O 1 1 19 11850 1 1 27 TYR OH O -12.178 6.764 2.136 1.00 . A A . 27 TYR OH 1 1 19 11851 1 1 28 ALA C C -7.536 2.899 -6.151 1.00 . A A . 28 ALA C 1 1 19 11852 1 1 28 ALA CA C -8.994 3.191 -6.482 1.00 . A A . 28 ALA CA 1 1 19 11853 1 1 28 ALA CB C -9.091 4.210 -7.607 1.00 . A A . 28 ALA CB 1 1 19 11854 1 1 28 ALA H H -9.795 4.629 -5.143 1.00 . A A . 28 ALA H 1 1 19 11855 1 1 28 ALA HA H -9.464 2.277 -6.815 1.00 . A A . 28 ALA HA 1 1 19 11856 1 1 28 ALA HB1 H -9.915 3.951 -8.255 1.00 . A A . 28 ALA HB1 1 1 19 11857 1 1 28 ALA HB2 H -9.256 5.192 -7.189 1.00 . A A . 28 ALA HB2 1 1 19 11858 1 1 28 ALA HB3 H -8.173 4.210 -8.176 1.00 . A A . 28 ALA HB3 1 1 19 11859 1 1 28 ALA N N -9.721 3.661 -5.308 1.00 . A A . 28 ALA N 1 1 19 11860 1 1 28 ALA O O -6.957 1.933 -6.652 1.00 . A A . 28 ALA O 1 1 19 11861 1 1 29 SER C C -5.246 4.323 -3.634 1.00 . A A . 29 SER C 1 1 19 11862 1 1 29 SER CA C -5.543 3.589 -4.939 1.00 . A A . 29 SER CA 1 1 19 11863 1 1 29 SER CB C -4.636 4.121 -6.052 1.00 . A A . 29 SER CB 1 1 19 11864 1 1 29 SER H H -7.452 4.500 -4.956 1.00 . A A . 29 SER H 1 1 19 11865 1 1 29 SER HA H -5.349 2.536 -4.800 1.00 . A A . 29 SER HA 1 1 19 11866 1 1 29 SER HB2 H -3.859 4.734 -5.618 1.00 . A A . 29 SER HB2 1 1 19 11867 1 1 29 SER HB3 H -4.187 3.290 -6.576 1.00 . A A . 29 SER HB3 1 1 19 11868 1 1 29 SER HG H -6.144 5.290 -6.543 1.00 . A A . 29 SER HG 1 1 19 11869 1 1 29 SER N N -6.942 3.743 -5.316 1.00 . A A . 29 SER N 1 1 19 11870 1 1 29 SER O O -6.106 5.021 -3.095 1.00 . A A . 29 SER O 1 1 19 11871 1 1 29 SER OG O -5.367 4.907 -6.983 1.00 . A A . 29 SER OG 1 1 19 11872 1 1 30 HIS C C -2.104 5.213 -2.034 1.00 . A A . 30 HIS C 1 1 19 11873 1 1 30 HIS CA C -3.582 4.843 -1.931 1.00 . A A . 30 HIS CA 1 1 19 11874 1 1 30 HIS CB C -3.829 3.969 -0.700 1.00 . A A . 30 HIS CB 1 1 19 11875 1 1 30 HIS CD2 C -2.014 2.202 -0.231 1.00 . A A . 30 HIS CD2 1 1 19 11876 1 1 30 HIS CE1 C -2.883 0.500 -1.249 1.00 . A A . 30 HIS CE1 1 1 19 11877 1 1 30 HIS CG C -3.186 2.623 -0.758 1.00 . A A . 30 HIS CG 1 1 19 11878 1 1 30 HIS H H -3.385 3.590 -3.621 1.00 . A A . 30 HIS H 1 1 19 11879 1 1 30 HIS HA H -4.158 5.752 -1.837 1.00 . A A . 30 HIS HA 1 1 19 11880 1 1 30 HIS HB2 H -3.441 4.477 0.167 1.00 . A A . 30 HIS HB2 1 1 19 11881 1 1 30 HIS HB3 H -4.889 3.826 -0.577 1.00 . A A . 30 HIS HB3 1 1 19 11882 1 1 30 HIS HD1 H -4.599 1.492 -1.870 1.00 . A A . 30 HIS HD1 1 1 19 11883 1 1 30 HIS HD2 H -1.327 2.792 0.357 1.00 . A A . 30 HIS HD2 1 1 19 11884 1 1 30 HIS HE1 H -3.037 -0.495 -1.645 1.00 . A A . 30 HIS HE1 1 1 19 11885 1 1 30 HIS N N -4.023 4.166 -3.141 1.00 . A A . 30 HIS N 1 1 19 11886 1 1 30 HIS ND1 N -3.730 1.526 -1.405 1.00 . A A . 30 HIS ND1 1 1 19 11887 1 1 30 HIS NE2 N -1.844 0.873 -0.551 1.00 . A A . 30 HIS NE2 1 1 19 11888 1 1 30 HIS O O -1.523 5.160 -3.121 1.00 . A A . 30 HIS O 1 1 19 11889 1 1 31 ARG C C 0.524 5.932 0.452 1.00 . A A . 31 ARG C 1 1 19 11890 1 1 31 ARG CA C -0.129 6.098 -0.920 1.00 . A A . 31 ARG CA 1 1 19 11891 1 1 31 ARG CB C -0.073 7.568 -1.335 1.00 . A A . 31 ARG CB 1 1 19 11892 1 1 31 ARG CD C 0.255 8.677 -3.562 1.00 . A A . 31 ARG CD 1 1 19 11893 1 1 31 ARG CG C 0.898 7.843 -2.465 1.00 . A A . 31 ARG CG 1 1 19 11894 1 1 31 ARG CZ C -1.697 8.202 -4.993 1.00 . A A . 31 ARG CZ 1 1 19 11895 1 1 31 ARG H H -2.037 5.706 -0.092 1.00 . A A . 31 ARG H 1 1 19 11896 1 1 31 ARG HA H 0.416 5.509 -1.639 1.00 . A A . 31 ARG HA 1 1 19 11897 1 1 31 ARG HB2 H -1.057 7.878 -1.654 1.00 . A A . 31 ARG HB2 1 1 19 11898 1 1 31 ARG HB3 H 0.223 8.162 -0.482 1.00 . A A . 31 ARG HB3 1 1 19 11899 1 1 31 ARG HD2 H -0.405 9.401 -3.108 1.00 . A A . 31 ARG HD2 1 1 19 11900 1 1 31 ARG HD3 H 1.032 9.192 -4.107 1.00 . A A . 31 ARG HD3 1 1 19 11901 1 1 31 ARG HE H -0.118 6.994 -4.762 1.00 . A A . 31 ARG HE 1 1 19 11902 1 1 31 ARG HG2 H 1.750 8.374 -2.072 1.00 . A A . 31 ARG HG2 1 1 19 11903 1 1 31 ARG HG3 H 1.219 6.902 -2.883 1.00 . A A . 31 ARG HG3 1 1 19 11904 1 1 31 ARG HH11 H -1.775 9.999 -4.038 1.00 . A A . 31 ARG HH11 1 1 19 11905 1 1 31 ARG HH12 H -3.139 9.632 -5.056 1.00 . A A . 31 ARG HH12 1 1 19 11906 1 1 31 ARG HH21 H -1.916 6.497 -6.071 1.00 . A A . 31 ARG HH21 1 1 19 11907 1 1 31 ARG HH22 H -3.228 7.639 -6.211 1.00 . A A . 31 ARG HH22 1 1 19 11908 1 1 31 ARG N N -1.514 5.638 -0.919 1.00 . A A . 31 ARG N 1 1 19 11909 1 1 31 ARG NE N -0.513 7.857 -4.493 1.00 . A A . 31 ARG NE 1 1 19 11910 1 1 31 ARG NH1 N -2.251 9.367 -4.667 1.00 . A A . 31 ARG NH1 1 1 19 11911 1 1 31 ARG NH2 N -2.331 7.382 -5.821 1.00 . A A . 31 ARG NH2 1 1 19 11912 1 1 31 ARG O O 1.643 6.395 0.674 1.00 . A A . 31 ARG O 1 1 19 11913 1 1 32 SER C C -0.131 3.742 3.297 1.00 . A A . 32 SER C 1 1 19 11914 1 1 32 SER CA C 0.365 5.062 2.715 1.00 . A A . 32 SER CA 1 1 19 11915 1 1 32 SER CB C -0.023 6.223 3.634 1.00 . A A . 32 SER CB 1 1 19 11916 1 1 32 SER H H -1.041 4.898 1.139 1.00 . A A . 32 SER H 1 1 19 11917 1 1 32 SER HA H 1.438 5.025 2.643 1.00 . A A . 32 SER HA 1 1 19 11918 1 1 32 SER HB2 H -0.717 5.868 4.377 1.00 . A A . 32 SER HB2 1 1 19 11919 1 1 32 SER HB3 H 0.863 6.601 4.123 1.00 . A A . 32 SER HB3 1 1 19 11920 1 1 32 SER HG H -1.200 6.911 2.219 1.00 . A A . 32 SER HG 1 1 19 11921 1 1 32 SER N N -0.169 5.274 1.372 1.00 . A A . 32 SER N 1 1 19 11922 1 1 32 SER O O -1.009 3.100 2.721 1.00 . A A . 32 SER O 1 1 19 11923 1 1 32 SER OG O -0.631 7.281 2.908 1.00 . A A . 32 SER OG 1 1 19 11924 1 1 33 LEU C C -1.229 2.185 5.848 1.00 . A A . 33 LEU C 1 1 19 11925 1 1 33 LEU CA C 0.098 2.092 5.099 1.00 . A A . 33 LEU CA 1 1 19 11926 1 1 33 LEU CB C 1.198 1.724 6.092 1.00 . A A . 33 LEU CB 1 1 19 11927 1 1 33 LEU CD1 C 3.397 0.587 6.404 1.00 . A A . 33 LEU CD1 1 1 19 11928 1 1 33 LEU CD2 C 1.334 -0.770 6.022 1.00 . A A . 33 LEU CD2 1 1 19 11929 1 1 33 LEU CG C 2.055 0.529 5.699 1.00 . A A . 33 LEU CG 1 1 19 11930 1 1 33 LEU H H 1.162 3.895 4.823 1.00 . A A . 33 LEU H 1 1 19 11931 1 1 33 LEU HA H 0.030 1.325 4.344 1.00 . A A . 33 LEU HA 1 1 19 11932 1 1 33 LEU HB2 H 1.847 2.580 6.213 1.00 . A A . 33 LEU HB2 1 1 19 11933 1 1 33 LEU HB3 H 0.736 1.508 7.043 1.00 . A A . 33 LEU HB3 1 1 19 11934 1 1 33 LEU HD11 H 3.618 1.608 6.674 1.00 . A A . 33 LEU HD11 1 1 19 11935 1 1 33 LEU HD12 H 3.362 -0.021 7.295 1.00 . A A . 33 LEU HD12 1 1 19 11936 1 1 33 LEU HD13 H 4.167 0.215 5.745 1.00 . A A . 33 LEU HD13 1 1 19 11937 1 1 33 LEU HD21 H 1.017 -0.759 7.054 1.00 . A A . 33 LEU HD21 1 1 19 11938 1 1 33 LEU HD22 H 0.471 -0.871 5.381 1.00 . A A . 33 LEU HD22 1 1 19 11939 1 1 33 LEU HD23 H 2.002 -1.604 5.859 1.00 . A A . 33 LEU HD23 1 1 19 11940 1 1 33 LEU HG H 2.234 0.565 4.635 1.00 . A A . 33 LEU HG 1 1 19 11941 1 1 33 LEU N N 0.437 3.351 4.439 1.00 . A A . 33 LEU N 1 1 19 11942 1 1 33 LEU O O -1.371 1.653 6.954 1.00 . A A . 33 LEU O 1 1 19 11943 1 1 34 SER C C -4.527 2.075 5.116 1.00 . A A . 34 SER C 1 1 19 11944 1 1 34 SER CA C -3.519 2.962 5.836 1.00 . A A . 34 SER CA 1 1 19 11945 1 1 34 SER CB C -3.961 4.424 5.793 1.00 . A A . 34 SER CB 1 1 19 11946 1 1 34 SER H H -2.045 3.196 4.341 1.00 . A A . 34 SER H 1 1 19 11947 1 1 34 SER HA H -3.449 2.644 6.865 1.00 . A A . 34 SER HA 1 1 19 11948 1 1 34 SER HB2 H -4.627 4.573 4.956 1.00 . A A . 34 SER HB2 1 1 19 11949 1 1 34 SER HB3 H -4.475 4.671 6.712 1.00 . A A . 34 SER HB3 1 1 19 11950 1 1 34 SER HG H -2.205 5.100 6.350 1.00 . A A . 34 SER HG 1 1 19 11951 1 1 34 SER N N -2.206 2.827 5.236 1.00 . A A . 34 SER N 1 1 19 11952 1 1 34 SER O O -5.314 1.371 5.749 1.00 . A A . 34 SER O 1 1 19 11953 1 1 34 SER OG O -2.840 5.287 5.648 1.00 . A A . 34 SER OG 1 1 19 11954 1 1 35 GLY C C -4.735 0.229 2.207 1.00 . A A . 35 GLY C 1 1 19 11955 1 1 35 GLY CA C -5.414 1.318 3.008 1.00 . A A . 35 GLY CA 1 1 19 11956 1 1 35 GLY H H -3.838 2.686 3.337 1.00 . A A . 35 GLY H 1 1 19 11957 1 1 35 GLY HA2 H -6.131 0.862 3.674 1.00 . A A . 35 GLY HA2 1 1 19 11958 1 1 35 GLY HA3 H -5.938 1.975 2.327 1.00 . A A . 35 GLY HA3 1 1 19 11959 1 1 35 GLY N N -4.488 2.103 3.790 1.00 . A A . 35 GLY N 1 1 19 11960 1 1 35 GLY O O -5.226 -0.156 1.145 1.00 . A A . 35 GLY O 1 1 19 11961 1 1 36 CYS C C -3.625 -2.656 2.094 1.00 . A A . 36 CYS C 1 1 19 11962 1 1 36 CYS CA C -2.863 -1.330 2.064 1.00 . A A . 36 CYS CA 1 1 19 11963 1 1 36 CYS CB C -1.513 -1.515 2.754 1.00 . A A . 36 CYS CB 1 1 19 11964 1 1 36 CYS H H -3.284 0.089 3.568 1.00 . A A . 36 CYS H 1 1 19 11965 1 1 36 CYS HA H -2.698 -1.040 1.038 1.00 . A A . 36 CYS HA 1 1 19 11966 1 1 36 CYS HB2 H -1.650 -1.440 3.825 1.00 . A A . 36 CYS HB2 1 1 19 11967 1 1 36 CYS HB3 H -1.125 -2.495 2.514 1.00 . A A . 36 CYS HB3 1 1 19 11968 1 1 36 CYS N N -3.614 -0.267 2.720 1.00 . A A . 36 CYS N 1 1 19 11969 1 1 36 CYS O O -3.739 -3.293 3.143 1.00 . A A . 36 CYS O 1 1 19 11970 1 1 36 CYS SG S -0.258 -0.289 2.276 1.00 . A A . 36 CYS SG 1 1 19 11971 1 1 37 PRO C C -3.716 -5.552 0.862 1.00 . A A . 37 PRO C 1 1 19 11972 1 1 37 PRO CA C -4.744 -4.426 0.825 1.00 . A A . 37 PRO CA 1 1 19 11973 1 1 37 PRO CB C -5.440 -4.364 -0.531 1.00 . A A . 37 PRO CB 1 1 19 11974 1 1 37 PRO CD C -3.981 -2.458 -0.379 1.00 . A A . 37 PRO CD 1 1 19 11975 1 1 37 PRO CG C -4.616 -3.427 -1.346 1.00 . A A . 37 PRO CG 1 1 19 11976 1 1 37 PRO HA H -5.473 -4.574 1.608 1.00 . A A . 37 PRO HA 1 1 19 11977 1 1 37 PRO HB2 H -5.464 -5.352 -0.968 1.00 . A A . 37 PRO HB2 1 1 19 11978 1 1 37 PRO HB3 H -6.446 -3.996 -0.405 1.00 . A A . 37 PRO HB3 1 1 19 11979 1 1 37 PRO HD2 H -2.945 -2.293 -0.634 1.00 . A A . 37 PRO HD2 1 1 19 11980 1 1 37 PRO HD3 H -4.520 -1.522 -0.380 1.00 . A A . 37 PRO HD3 1 1 19 11981 1 1 37 PRO HG2 H -3.853 -3.979 -1.878 1.00 . A A . 37 PRO HG2 1 1 19 11982 1 1 37 PRO HG3 H -5.249 -2.897 -2.043 1.00 . A A . 37 PRO HG3 1 1 19 11983 1 1 37 PRO N N -4.098 -3.126 0.930 1.00 . A A . 37 PRO N 1 1 19 11984 1 1 37 PRO O O -4.018 -6.676 1.263 1.00 . A A . 37 PRO O 1 1 19 11985 1 1 38 ARG C C -0.451 -5.789 1.754 1.00 . A A . 38 ARG C 1 1 19 11986 1 1 38 ARG CA C -1.370 -6.148 0.596 1.00 . A A . 38 ARG CA 1 1 19 11987 1 1 38 ARG CB C -0.581 -6.136 -0.711 1.00 . A A . 38 ARG CB 1 1 19 11988 1 1 38 ARG CD C -0.685 -6.679 -3.155 1.00 . A A . 38 ARG CD 1 1 19 11989 1 1 38 ARG CG C -1.119 -7.092 -1.761 1.00 . A A . 38 ARG CG 1 1 19 11990 1 1 38 ARG CZ C -1.661 -6.486 -5.418 1.00 . A A . 38 ARG CZ 1 1 19 11991 1 1 38 ARG H H -2.285 -4.270 0.310 1.00 . A A . 38 ARG H 1 1 19 11992 1 1 38 ARG HA H -1.775 -7.137 0.759 1.00 . A A . 38 ARG HA 1 1 19 11993 1 1 38 ARG HB2 H -0.603 -5.136 -1.121 1.00 . A A . 38 ARG HB2 1 1 19 11994 1 1 38 ARG HB3 H 0.445 -6.404 -0.498 1.00 . A A . 38 ARG HB3 1 1 19 11995 1 1 38 ARG HD2 H -0.311 -5.664 -3.116 1.00 . A A . 38 ARG HD2 1 1 19 11996 1 1 38 ARG HD3 H 0.104 -7.338 -3.481 1.00 . A A . 38 ARG HD3 1 1 19 11997 1 1 38 ARG HE H -2.677 -6.972 -3.762 1.00 . A A . 38 ARG HE 1 1 19 11998 1 1 38 ARG HG2 H -0.745 -8.083 -1.556 1.00 . A A . 38 ARG HG2 1 1 19 11999 1 1 38 ARG HG3 H -2.197 -7.093 -1.713 1.00 . A A . 38 ARG HG3 1 1 19 12000 1 1 38 ARG HH11 H 0.354 -6.215 -5.354 1.00 . A A . 38 ARG HH11 1 1 19 12001 1 1 38 ARG HH12 H -0.382 -6.018 -6.924 1.00 . A A . 38 ARG HH12 1 1 19 12002 1 1 38 ARG HH21 H -3.635 -6.740 -5.823 1.00 . A A . 38 ARG HH21 1 1 19 12003 1 1 38 ARG HH22 H -2.640 -6.315 -7.187 1.00 . A A . 38 ARG HH22 1 1 19 12004 1 1 38 ARG N N -2.475 -5.208 0.533 1.00 . A A . 38 ARG N 1 1 19 12005 1 1 38 ARG NE N -1.788 -6.741 -4.114 1.00 . A A . 38 ARG NE 1 1 19 12006 1 1 38 ARG NH1 N -0.470 -6.220 -5.939 1.00 . A A . 38 ARG NH1 1 1 19 12007 1 1 38 ARG NH2 N -2.727 -6.517 -6.207 1.00 . A A . 38 ARG NH2 1 1 19 12008 1 1 38 ARG O O 0.772 -5.813 1.620 1.00 . A A . 38 ARG O 1 1 19 12009 1 1 39 ALA C C 0.710 -6.002 4.492 1.00 . A A . 39 ALA C 1 1 19 12010 1 1 39 ALA CA C -0.312 -4.960 4.044 1.00 . A A . 39 ALA CA 1 1 19 12011 1 1 39 ALA CB C -1.266 -4.633 5.183 1.00 . A A . 39 ALA CB 1 1 19 12012 1 1 39 ALA H H -2.034 -5.355 2.887 1.00 . A A . 39 ALA H 1 1 19 12013 1 1 39 ALA HA H 0.211 -4.051 3.781 1.00 . A A . 39 ALA HA 1 1 19 12014 1 1 39 ALA HB1 H -1.913 -3.821 4.886 1.00 . A A . 39 ALA HB1 1 1 19 12015 1 1 39 ALA HB2 H -1.862 -5.502 5.417 1.00 . A A . 39 ALA HB2 1 1 19 12016 1 1 39 ALA HB3 H -0.699 -4.341 6.053 1.00 . A A . 39 ALA HB3 1 1 19 12017 1 1 39 ALA N N -1.057 -5.399 2.870 1.00 . A A . 39 ALA N 1 1 19 12018 1 1 39 ALA O O 0.535 -7.203 4.264 1.00 . A A . 39 ALA O 1 1 19 12019 1 1 40 LYS C C 2.441 -7.585 6.239 1.00 . A A . 40 LYS C 1 1 19 12020 1 1 40 LYS CA C 2.917 -6.317 5.543 1.00 . A A . 40 LYS CA 1 1 19 12021 1 1 40 LYS CB C 3.797 -5.509 6.500 1.00 . A A . 40 LYS CB 1 1 19 12022 1 1 40 LYS CD C 4.370 -3.102 6.076 1.00 . A A . 40 LYS CD 1 1 19 12023 1 1 40 LYS CE C 5.422 -2.410 6.929 1.00 . A A . 40 LYS CE 1 1 19 12024 1 1 40 LYS CG C 4.740 -4.549 5.795 1.00 . A A . 40 LYS CG 1 1 19 12025 1 1 40 LYS H H 1.870 -4.528 5.151 1.00 . A A . 40 LYS H 1 1 19 12026 1 1 40 LYS HA H 3.506 -6.598 4.682 1.00 . A A . 40 LYS HA 1 1 19 12027 1 1 40 LYS HB2 H 3.161 -4.936 7.159 1.00 . A A . 40 LYS HB2 1 1 19 12028 1 1 40 LYS HB3 H 4.391 -6.191 7.090 1.00 . A A . 40 LYS HB3 1 1 19 12029 1 1 40 LYS HD2 H 4.279 -2.575 5.138 1.00 . A A . 40 LYS HD2 1 1 19 12030 1 1 40 LYS HD3 H 3.423 -3.079 6.598 1.00 . A A . 40 LYS HD3 1 1 19 12031 1 1 40 LYS HE2 H 6.382 -2.858 6.726 1.00 . A A . 40 LYS HE2 1 1 19 12032 1 1 40 LYS HE3 H 5.451 -1.364 6.664 1.00 . A A . 40 LYS HE3 1 1 19 12033 1 1 40 LYS HG2 H 5.747 -4.727 6.145 1.00 . A A . 40 LYS HG2 1 1 19 12034 1 1 40 LYS HG3 H 4.689 -4.726 4.730 1.00 . A A . 40 LYS HG3 1 1 19 12035 1 1 40 LYS HZ1 H 5.217 -1.599 8.844 1.00 . A A . 40 LYS HZ1 1 1 19 12036 1 1 40 LYS HZ2 H 5.803 -3.192 8.828 1.00 . A A . 40 LYS HZ2 1 1 19 12037 1 1 40 LYS HZ3 H 4.161 -2.890 8.527 1.00 . A A . 40 LYS HZ3 1 1 19 12038 1 1 40 LYS N N 1.799 -5.498 5.074 1.00 . A A . 40 LYS N 1 1 19 12039 1 1 40 LYS NZ N 5.130 -2.531 8.381 1.00 . A A . 40 LYS NZ 1 1 19 12040 1 1 40 LYS O O 1.768 -7.527 7.274 1.00 . A A . 40 LYS O 1 1 19 12041 1 1 41 LYS C C 3.538 -10.817 6.623 1.00 . A A . 41 LYS C 1 1 19 12042 1 1 41 LYS CA C 2.333 -10.008 6.155 1.00 . A A . 41 LYS CA 1 1 19 12043 1 1 41 LYS CB C 1.553 -10.775 5.086 1.00 . A A . 41 LYS CB 1 1 19 12044 1 1 41 LYS CD C -0.905 -10.351 4.814 1.00 . A A . 41 LYS CD 1 1 19 12045 1 1 41 LYS CE C -1.937 -9.800 5.785 1.00 . A A . 41 LYS CE 1 1 19 12046 1 1 41 LYS CG C 0.156 -11.171 5.526 1.00 . A A . 41 LYS CG 1 1 19 12047 1 1 41 LYS H H 3.267 -8.690 4.804 1.00 . A A . 41 LYS H 1 1 19 12048 1 1 41 LYS HA H 1.685 -9.828 7.000 1.00 . A A . 41 LYS HA 1 1 19 12049 1 1 41 LYS HB2 H 1.468 -10.158 4.204 1.00 . A A . 41 LYS HB2 1 1 19 12050 1 1 41 LYS HB3 H 2.096 -11.676 4.835 1.00 . A A . 41 LYS HB3 1 1 19 12051 1 1 41 LYS HD2 H -0.426 -9.527 4.306 1.00 . A A . 41 LYS HD2 1 1 19 12052 1 1 41 LYS HD3 H -1.405 -10.980 4.091 1.00 . A A . 41 LYS HD3 1 1 19 12053 1 1 41 LYS HE2 H -1.452 -9.087 6.438 1.00 . A A . 41 LYS HE2 1 1 19 12054 1 1 41 LYS HE3 H -2.710 -9.300 5.222 1.00 . A A . 41 LYS HE3 1 1 19 12055 1 1 41 LYS HG2 H -0.001 -12.215 5.301 1.00 . A A . 41 LYS HG2 1 1 19 12056 1 1 41 LYS HG3 H 0.067 -11.012 6.591 1.00 . A A . 41 LYS HG3 1 1 19 12057 1 1 41 LYS HZ1 H -2.915 -10.469 7.507 1.00 . A A . 41 LYS HZ1 1 1 19 12058 1 1 41 LYS HZ2 H -1.854 -11.608 6.840 1.00 . A A . 41 LYS HZ2 1 1 19 12059 1 1 41 LYS HZ3 H -3.350 -11.307 6.100 1.00 . A A . 41 LYS HZ3 1 1 19 12060 1 1 41 LYS N N 2.755 -8.720 5.637 1.00 . A A . 41 LYS N 1 1 19 12061 1 1 41 LYS NZ N -2.555 -10.870 6.615 1.00 . A A . 41 LYS NZ 1 1 19 12062 1 1 41 LYS O O 4.582 -10.253 6.947 1.00 . A A . 41 LYS O 1 1 19 12063 1 1 42 SER C C 5.665 -12.988 6.339 1.00 . A A . 42 SER C 1 1 19 12064 1 1 42 SER CA C 4.407 -13.016 7.210 1.00 . A A . 42 SER CA 1 1 19 12065 1 1 42 SER CB C 3.847 -14.434 7.286 1.00 . A A . 42 SER CB 1 1 19 12066 1 1 42 SER H H 2.498 -12.511 6.475 1.00 . A A . 42 SER H 1 1 19 12067 1 1 42 SER HA H 4.666 -12.692 8.206 1.00 . A A . 42 SER HA 1 1 19 12068 1 1 42 SER HB2 H 4.340 -15.056 6.553 1.00 . A A . 42 SER HB2 1 1 19 12069 1 1 42 SER HB3 H 4.015 -14.835 8.274 1.00 . A A . 42 SER HB3 1 1 19 12070 1 1 42 SER HG H 1.969 -14.361 7.869 1.00 . A A . 42 SER HG 1 1 19 12071 1 1 42 SER N N 3.370 -12.127 6.707 1.00 . A A . 42 SER N 1 1 19 12072 1 1 42 SER O O 6.773 -13.183 6.835 1.00 . A A . 42 SER O 1 1 19 12073 1 1 42 SER OG O 2.450 -14.431 7.025 1.00 . A A . 42 SER OG 1 1 19 12074 1 1 43 GLY C C 7.096 -11.380 3.798 1.00 . A A . 43 GLY C 1 1 19 12075 1 1 43 GLY CA C 6.629 -12.780 4.134 1.00 . A A . 43 GLY CA 1 1 19 12076 1 1 43 GLY H H 4.582 -12.668 4.679 1.00 . A A . 43 GLY H 1 1 19 12077 1 1 43 GLY HA2 H 7.444 -13.319 4.594 1.00 . A A . 43 GLY HA2 1 1 19 12078 1 1 43 GLY HA3 H 6.351 -13.283 3.220 1.00 . A A . 43 GLY HA3 1 1 19 12079 1 1 43 GLY N N 5.493 -12.785 5.037 1.00 . A A . 43 GLY N 1 1 19 12080 1 1 43 GLY O O 8.222 -11.187 3.335 1.00 . A A . 43 GLY O 1 1 19 12081 1 1 44 LEU C C 6.927 -8.269 5.039 1.00 . A A . 44 LEU C 1 1 19 12082 1 1 44 LEU CA C 6.579 -9.013 3.758 1.00 . A A . 44 LEU CA 1 1 19 12083 1 1 44 LEU CB C 5.422 -8.299 3.050 1.00 . A A . 44 LEU CB 1 1 19 12084 1 1 44 LEU CD1 C 3.134 -8.530 2.054 1.00 . A A . 44 LEU CD1 1 1 19 12085 1 1 44 LEU CD2 C 5.103 -9.535 0.891 1.00 . A A . 44 LEU CD2 1 1 19 12086 1 1 44 LEU CG C 4.488 -9.199 2.240 1.00 . A A . 44 LEU CG 1 1 19 12087 1 1 44 LEU H H 5.372 -10.612 4.434 1.00 . A A . 44 LEU H 1 1 19 12088 1 1 44 LEU HA H 7.442 -9.009 3.108 1.00 . A A . 44 LEU HA 1 1 19 12089 1 1 44 LEU HB2 H 4.834 -7.791 3.799 1.00 . A A . 44 LEU HB2 1 1 19 12090 1 1 44 LEU HB3 H 5.840 -7.560 2.384 1.00 . A A . 44 LEU HB3 1 1 19 12091 1 1 44 LEU HD11 H 2.529 -9.126 1.389 1.00 . A A . 44 LEU HD11 1 1 19 12092 1 1 44 LEU HD12 H 2.639 -8.443 3.012 1.00 . A A . 44 LEU HD12 1 1 19 12093 1 1 44 LEU HD13 H 3.273 -7.545 1.630 1.00 . A A . 44 LEU HD13 1 1 19 12094 1 1 44 LEU HD21 H 5.698 -8.701 0.549 1.00 . A A . 44 LEU HD21 1 1 19 12095 1 1 44 LEU HD22 H 5.730 -10.408 0.991 1.00 . A A . 44 LEU HD22 1 1 19 12096 1 1 44 LEU HD23 H 4.318 -9.734 0.178 1.00 . A A . 44 LEU HD23 1 1 19 12097 1 1 44 LEU HG H 4.333 -10.123 2.777 1.00 . A A . 44 LEU HG 1 1 19 12098 1 1 44 LEU N N 6.242 -10.400 4.040 1.00 . A A . 44 LEU N 1 1 19 12099 1 1 44 LEU O O 6.114 -7.505 5.556 1.00 . A A . 44 LEU O 1 1 19 12100 1 1 45 ARG C C 7.686 -8.070 7.918 1.00 . A A . 45 ARG C 1 1 19 12101 1 1 45 ARG CA C 8.634 -7.847 6.744 1.00 . A A . 45 ARG CA 1 1 19 12102 1 1 45 ARG CB C 8.841 -6.346 6.511 1.00 . A A . 45 ARG CB 1 1 19 12103 1 1 45 ARG CD C 11.275 -5.985 7.054 1.00 . A A . 45 ARG CD 1 1 19 12104 1 1 45 ARG CG C 9.839 -5.710 7.469 1.00 . A A . 45 ARG CG 1 1 19 12105 1 1 45 ARG CZ C 12.020 -6.794 4.843 1.00 . A A . 45 ARG CZ 1 1 19 12106 1 1 45 ARG H H 8.736 -9.120 5.057 1.00 . A A . 45 ARG H 1 1 19 12107 1 1 45 ARG HA H 9.587 -8.292 6.986 1.00 . A A . 45 ARG HA 1 1 19 12108 1 1 45 ARG HB2 H 9.199 -6.197 5.504 1.00 . A A . 45 ARG HB2 1 1 19 12109 1 1 45 ARG HB3 H 7.894 -5.842 6.627 1.00 . A A . 45 ARG HB3 1 1 19 12110 1 1 45 ARG HD2 H 11.922 -5.282 7.556 1.00 . A A . 45 ARG HD2 1 1 19 12111 1 1 45 ARG HD3 H 11.536 -6.990 7.355 1.00 . A A . 45 ARG HD3 1 1 19 12112 1 1 45 ARG HE H 11.139 -5.022 5.188 1.00 . A A . 45 ARG HE 1 1 19 12113 1 1 45 ARG HG2 H 9.679 -4.644 7.482 1.00 . A A . 45 ARG HG2 1 1 19 12114 1 1 45 ARG HG3 H 9.678 -6.111 8.460 1.00 . A A . 45 ARG HG3 1 1 19 12115 1 1 45 ARG HH11 H 12.456 -8.052 6.380 1.00 . A A . 45 ARG HH11 1 1 19 12116 1 1 45 ARG HH12 H 12.926 -8.614 4.799 1.00 . A A . 45 ARG HH12 1 1 19 12117 1 1 45 ARG HH21 H 11.753 -5.762 3.120 1.00 . A A . 45 ARG HH21 1 1 19 12118 1 1 45 ARG HH22 H 12.498 -7.324 2.940 1.00 . A A . 45 ARG HH22 1 1 19 12119 1 1 45 ARG N N 8.143 -8.495 5.531 1.00 . A A . 45 ARG N 1 1 19 12120 1 1 45 ARG NE N 11.464 -5.857 5.612 1.00 . A A . 45 ARG NE 1 1 19 12121 1 1 45 ARG NH1 N 12.505 -7.907 5.384 1.00 . A A . 45 ARG NH1 1 1 19 12122 1 1 45 ARG NH2 N 12.103 -6.608 3.533 1.00 . A A . 45 ARG NH2 1 1 19 12123 1 1 45 ARG O O 7.074 -7.128 8.426 1.00 . A A . 45 ARG O 1 1 19 12124 1 1 46 VAL C C 7.363 -9.023 10.784 1.00 . A A . 46 VAL C 1 1 19 12125 1 1 46 VAL CA C 6.774 -9.644 9.516 1.00 . A A . 46 VAL CA 1 1 19 12126 1 1 46 VAL CB C 6.615 -11.176 9.686 1.00 . A A . 46 VAL CB 1 1 19 12127 1 1 46 VAL CG1 C 7.925 -11.825 10.099 1.00 . A A . 46 VAL CG1 1 1 19 12128 1 1 46 VAL CG2 C 5.521 -11.499 10.690 1.00 . A A . 46 VAL CG2 1 1 19 12129 1 1 46 VAL H H 8.139 -10.016 7.946 1.00 . A A . 46 VAL H 1 1 19 12130 1 1 46 VAL HA H 5.794 -9.220 9.348 1.00 . A A . 46 VAL HA 1 1 19 12131 1 1 46 VAL HB H 6.325 -11.592 8.732 1.00 . A A . 46 VAL HB 1 1 19 12132 1 1 46 VAL HG11 H 8.339 -12.363 9.260 1.00 . A A . 46 VAL HG11 1 1 19 12133 1 1 46 VAL HG12 H 8.619 -11.061 10.416 1.00 . A A . 46 VAL HG12 1 1 19 12134 1 1 46 VAL HG13 H 7.746 -12.510 10.914 1.00 . A A . 46 VAL HG13 1 1 19 12135 1 1 46 VAL HG21 H 5.503 -10.738 11.457 1.00 . A A . 46 VAL HG21 1 1 19 12136 1 1 46 VAL HG22 H 4.568 -11.525 10.187 1.00 . A A . 46 VAL HG22 1 1 19 12137 1 1 46 VAL HG23 H 5.717 -12.460 11.140 1.00 . A A . 46 VAL HG23 1 1 19 12138 1 1 46 VAL N N 7.601 -9.312 8.370 1.00 . A A . 46 VAL N 1 1 19 12139 1 1 46 VAL O O 6.585 -8.673 11.695 1.00 . A A . 46 VAL O 1 1 19 12140 1 1 46 VAL OXT O 8.600 -8.823 10.830 1.00 . A A . 46 VAL OXT 1 1 19 12141 2 2 1 ZN ZN ZN -0.300 -0.167 -0.010 1.00 . B A . 47 ZN ZN 1 1 20 12142 1 1 1 GLY C C 3.128 -5.614 -6.799 1.00 . A A . 1 GLY C 1 1 20 12143 1 1 1 GLY CA C 3.444 -6.818 -5.943 1.00 . A A . 1 GLY CA 1 1 20 12144 1 1 1 GLY H1 H 1.864 -8.068 -6.470 1.00 . A A . 1 GLY H1 1 1 20 12145 1 1 1 GLY H2 H 3.274 -8.892 -6.011 1.00 . A A . 1 GLY H2 1 1 20 12146 1 1 1 GLY H3 H 3.189 -8.140 -7.529 1.00 . A A . 1 GLY H3 1 1 20 12147 1 1 1 GLY HA2 H 3.013 -6.676 -4.963 1.00 . A A . 1 GLY HA2 1 1 20 12148 1 1 1 GLY HA3 H 4.517 -6.911 -5.845 1.00 . A A . 1 GLY HA3 1 1 20 12149 1 1 1 GLY N N 2.906 -8.066 -6.528 1.00 . A A . 1 GLY N 1 1 20 12150 1 1 1 GLY O O 1.965 -5.356 -7.107 1.00 . A A . 1 GLY O 1 1 20 12151 1 1 2 SER C C 4.045 -4.095 -9.522 1.00 . A A . 2 SER C 1 1 20 12152 1 1 2 SER CA C 3.979 -3.717 -8.045 1.00 . A A . 2 SER CA 1 1 20 12153 1 1 2 SER CB C 5.054 -2.681 -7.714 1.00 . A A . 2 SER CB 1 1 20 12154 1 1 2 SER H H 5.069 -5.159 -6.950 1.00 . A A . 2 SER H 1 1 20 12155 1 1 2 SER HA H 3.006 -3.298 -7.831 1.00 . A A . 2 SER HA 1 1 20 12156 1 1 2 SER HB2 H 5.508 -2.335 -8.630 1.00 . A A . 2 SER HB2 1 1 20 12157 1 1 2 SER HB3 H 4.602 -1.847 -7.196 1.00 . A A . 2 SER HB3 1 1 20 12158 1 1 2 SER HG H 5.913 -2.973 -5.963 1.00 . A A . 2 SER HG 1 1 20 12159 1 1 2 SER N N 4.157 -4.890 -7.207 1.00 . A A . 2 SER N 1 1 20 12160 1 1 2 SER O O 5.057 -4.612 -9.995 1.00 . A A . 2 SER O 1 1 20 12161 1 1 2 SER OG O 6.062 -3.244 -6.888 1.00 . A A . 2 SER OG 1 1 20 12162 1 1 3 MET C C 3.438 -2.991 -12.490 1.00 . A A . 3 MET C 1 1 20 12163 1 1 3 MET CA C 2.905 -4.156 -11.665 1.00 . A A . 3 MET CA 1 1 20 12164 1 1 3 MET CB C 1.471 -4.477 -12.089 1.00 . A A . 3 MET CB 1 1 20 12165 1 1 3 MET CE C 0.136 -4.609 -15.735 1.00 . A A . 3 MET CE 1 1 20 12166 1 1 3 MET CG C 1.392 -5.302 -13.362 1.00 . A A . 3 MET CG 1 1 20 12167 1 1 3 MET H H 2.179 -3.433 -9.813 1.00 . A A . 3 MET H 1 1 20 12168 1 1 3 MET HA H 3.526 -5.021 -11.841 1.00 . A A . 3 MET HA 1 1 20 12169 1 1 3 MET HB2 H 0.987 -5.027 -11.295 1.00 . A A . 3 MET HB2 1 1 20 12170 1 1 3 MET HB3 H 0.940 -3.552 -12.251 1.00 . A A . 3 MET HB3 1 1 20 12171 1 1 3 MET HE1 H 0.671 -5.351 -16.308 1.00 . A A . 3 MET HE1 1 1 20 12172 1 1 3 MET HE2 H -0.781 -4.352 -16.245 1.00 . A A . 3 MET HE2 1 1 20 12173 1 1 3 MET HE3 H 0.748 -3.725 -15.628 1.00 . A A . 3 MET HE3 1 1 20 12174 1 1 3 MET HG2 H 2.104 -4.910 -14.072 1.00 . A A . 3 MET HG2 1 1 20 12175 1 1 3 MET HG3 H 1.645 -6.325 -13.128 1.00 . A A . 3 MET HG3 1 1 20 12176 1 1 3 MET N N 2.962 -3.844 -10.244 1.00 . A A . 3 MET N 1 1 20 12177 1 1 3 MET O O 4.224 -3.184 -13.415 1.00 . A A . 3 MET O 1 1 20 12178 1 1 3 MET SD S -0.248 -5.269 -14.114 1.00 . A A . 3 MET SD 1 1 20 12179 1 1 4 ALA C C 4.188 0.361 -11.961 1.00 . A A . 4 ALA C 1 1 20 12180 1 1 4 ALA CA C 3.422 -0.591 -12.871 1.00 . A A . 4 ALA CA 1 1 20 12181 1 1 4 ALA CB C 2.212 0.106 -13.471 1.00 . A A . 4 ALA CB 1 1 20 12182 1 1 4 ALA H H 2.369 -1.698 -11.400 1.00 . A A . 4 ALA H 1 1 20 12183 1 1 4 ALA HA H 4.068 -0.898 -13.679 1.00 . A A . 4 ALA HA 1 1 20 12184 1 1 4 ALA HB1 H 1.314 -0.248 -12.988 1.00 . A A . 4 ALA HB1 1 1 20 12185 1 1 4 ALA HB2 H 2.303 1.173 -13.326 1.00 . A A . 4 ALA HB2 1 1 20 12186 1 1 4 ALA HB3 H 2.161 -0.109 -14.530 1.00 . A A . 4 ALA HB3 1 1 20 12187 1 1 4 ALA N N 3.003 -1.786 -12.149 1.00 . A A . 4 ALA N 1 1 20 12188 1 1 4 ALA O O 4.648 1.422 -12.391 1.00 . A A . 4 ALA O 1 1 20 12189 1 1 5 ALA C C 6.402 0.188 -9.425 1.00 . A A . 5 ALA C 1 1 20 12190 1 1 5 ALA CA C 5.037 0.794 -9.729 1.00 . A A . 5 ALA CA 1 1 20 12191 1 1 5 ALA CB C 4.214 0.942 -8.457 1.00 . A A . 5 ALA CB 1 1 20 12192 1 1 5 ALA H H 3.945 -0.879 -10.419 1.00 . A A . 5 ALA H 1 1 20 12193 1 1 5 ALA HA H 5.178 1.776 -10.157 1.00 . A A . 5 ALA HA 1 1 20 12194 1 1 5 ALA HB1 H 4.158 -0.010 -7.953 1.00 . A A . 5 ALA HB1 1 1 20 12195 1 1 5 ALA HB2 H 4.679 1.667 -7.807 1.00 . A A . 5 ALA HB2 1 1 20 12196 1 1 5 ALA HB3 H 3.218 1.273 -8.711 1.00 . A A . 5 ALA HB3 1 1 20 12197 1 1 5 ALA N N 4.324 -0.020 -10.701 1.00 . A A . 5 ALA N 1 1 20 12198 1 1 5 ALA O O 6.760 -0.858 -9.968 1.00 . A A . 5 ALA O 1 1 20 12199 1 1 6 HIS C C 8.663 0.490 -6.654 1.00 . A A . 6 HIS C 1 1 20 12200 1 1 6 HIS CA C 8.466 0.350 -8.157 1.00 . A A . 6 HIS CA 1 1 20 12201 1 1 6 HIS CB C 9.560 1.117 -8.903 1.00 . A A . 6 HIS CB 1 1 20 12202 1 1 6 HIS CD2 C 10.107 -0.565 -10.798 1.00 . A A . 6 HIS CD2 1 1 20 12203 1 1 6 HIS CE1 C 12.268 -0.697 -10.492 1.00 . A A . 6 HIS CE1 1 1 20 12204 1 1 6 HIS CG C 10.421 0.244 -9.760 1.00 . A A . 6 HIS CG 1 1 20 12205 1 1 6 HIS H H 6.801 1.652 -8.128 1.00 . A A . 6 HIS H 1 1 20 12206 1 1 6 HIS HA H 8.526 -0.696 -8.422 1.00 . A A . 6 HIS HA 1 1 20 12207 1 1 6 HIS HB2 H 9.102 1.859 -9.540 1.00 . A A . 6 HIS HB2 1 1 20 12208 1 1 6 HIS HB3 H 10.198 1.612 -8.184 1.00 . A A . 6 HIS HB3 1 1 20 12209 1 1 6 HIS HD1 H 12.321 0.612 -8.911 1.00 . A A . 6 HIS HD1 1 1 20 12210 1 1 6 HIS HD2 H 9.119 -0.727 -11.207 1.00 . A A . 6 HIS HD2 1 1 20 12211 1 1 6 HIS HE1 H 13.307 -0.973 -10.600 1.00 . A A . 6 HIS HE1 1 1 20 12212 1 1 6 HIS HE2 H 11.378 -1.605 -12.101 1.00 . A A . 6 HIS HE2 1 1 20 12213 1 1 6 HIS N N 7.149 0.836 -8.544 1.00 . A A . 6 HIS N 1 1 20 12214 1 1 6 HIS ND1 N 11.782 0.138 -9.594 1.00 . A A . 6 HIS ND1 1 1 20 12215 1 1 6 HIS NE2 N 11.272 -1.140 -11.235 1.00 . A A . 6 HIS NE2 1 1 20 12216 1 1 6 HIS O O 7.818 1.063 -5.964 1.00 . A A . 6 HIS O 1 1 20 12217 1 1 7 SER C C 10.682 1.337 -4.331 1.00 . A A . 7 SER C 1 1 20 12218 1 1 7 SER CA C 10.057 -0.003 -4.727 1.00 . A A . 7 SER CA 1 1 20 12219 1 1 7 SER CB C 10.993 -1.154 -4.368 1.00 . A A . 7 SER CB 1 1 20 12220 1 1 7 SER H H 10.391 -0.504 -6.750 1.00 . A A . 7 SER H 1 1 20 12221 1 1 7 SER HA H 9.127 -0.125 -4.194 1.00 . A A . 7 SER HA 1 1 20 12222 1 1 7 SER HB2 H 11.918 -0.754 -3.979 1.00 . A A . 7 SER HB2 1 1 20 12223 1 1 7 SER HB3 H 10.526 -1.777 -3.620 1.00 . A A . 7 SER HB3 1 1 20 12224 1 1 7 SER HG H 12.076 -2.481 -5.333 1.00 . A A . 7 SER HG 1 1 20 12225 1 1 7 SER N N 9.764 -0.045 -6.152 1.00 . A A . 7 SER N 1 1 20 12226 1 1 7 SER O O 11.852 1.408 -3.947 1.00 . A A . 7 SER O 1 1 20 12227 1 1 7 SER OG O 11.281 -1.951 -5.509 1.00 . A A . 7 SER OG 1 1 20 12228 1 1 8 ALA C C 9.160 4.488 -3.412 1.00 . A A . 8 ALA C 1 1 20 12229 1 1 8 ALA CA C 10.320 3.727 -4.037 1.00 . A A . 8 ALA CA 1 1 20 12230 1 1 8 ALA CB C 10.858 4.470 -5.251 1.00 . A A . 8 ALA CB 1 1 20 12231 1 1 8 ALA H H 8.951 2.256 -4.687 1.00 . A A . 8 ALA H 1 1 20 12232 1 1 8 ALA HA H 11.115 3.635 -3.312 1.00 . A A . 8 ALA HA 1 1 20 12233 1 1 8 ALA HB1 H 10.754 5.535 -5.097 1.00 . A A . 8 ALA HB1 1 1 20 12234 1 1 8 ALA HB2 H 11.902 4.227 -5.387 1.00 . A A . 8 ALA HB2 1 1 20 12235 1 1 8 ALA HB3 H 10.303 4.176 -6.131 1.00 . A A . 8 ALA HB3 1 1 20 12236 1 1 8 ALA N N 9.883 2.390 -4.407 1.00 . A A . 8 ALA N 1 1 20 12237 1 1 8 ALA O O 8.039 3.980 -3.369 1.00 . A A . 8 ALA O 1 1 20 12238 1 1 9 ASP C C 7.472 7.183 -3.333 1.00 . A A . 9 ASP C 1 1 20 12239 1 1 9 ASP CA C 8.381 6.515 -2.307 1.00 . A A . 9 ASP CA 1 1 20 12240 1 1 9 ASP CB C 9.009 7.562 -1.386 1.00 . A A . 9 ASP CB 1 1 20 12241 1 1 9 ASP CG C 8.109 7.916 -0.221 1.00 . A A . 9 ASP CG 1 1 20 12242 1 1 9 ASP H H 10.329 6.066 -3.024 1.00 . A A . 9 ASP H 1 1 20 12243 1 1 9 ASP HA H 7.774 5.846 -1.713 1.00 . A A . 9 ASP HA 1 1 20 12244 1 1 9 ASP HB2 H 9.939 7.176 -0.993 1.00 . A A . 9 ASP HB2 1 1 20 12245 1 1 9 ASP HB3 H 9.208 8.460 -1.952 1.00 . A A . 9 ASP HB3 1 1 20 12246 1 1 9 ASP N N 9.416 5.706 -2.950 1.00 . A A . 9 ASP N 1 1 20 12247 1 1 9 ASP O O 6.916 8.259 -3.097 1.00 . A A . 9 ASP O 1 1 20 12248 1 1 9 ASP OD1 O 7.365 7.029 0.252 1.00 . A A . 9 ASP OD1 1 1 20 12249 1 1 9 ASP OD2 O 8.137 9.083 0.227 1.00 . A A . 9 ASP OD2 1 1 20 12250 1 1 10 LEU C C 4.876 6.265 -5.034 1.00 . A A . 10 LEU C 1 1 20 12251 1 1 10 LEU CA C 6.224 6.871 -5.392 1.00 . A A . 10 LEU CA 1 1 20 12252 1 1 10 LEU CB C 6.651 6.416 -6.792 1.00 . A A . 10 LEU CB 1 1 20 12253 1 1 10 LEU CD1 C 5.638 4.763 -8.388 1.00 . A A . 10 LEU CD1 1 1 20 12254 1 1 10 LEU CD2 C 7.738 4.183 -7.165 1.00 . A A . 10 LEU CD2 1 1 20 12255 1 1 10 LEU CG C 6.416 4.932 -7.094 1.00 . A A . 10 LEU CG 1 1 20 12256 1 1 10 LEU H H 7.586 5.556 -4.462 1.00 . A A . 10 LEU H 1 1 20 12257 1 1 10 LEU HA H 6.151 7.948 -5.368 1.00 . A A . 10 LEU HA 1 1 20 12258 1 1 10 LEU HB2 H 6.108 7.002 -7.518 1.00 . A A . 10 LEU HB2 1 1 20 12259 1 1 10 LEU HB3 H 7.706 6.619 -6.905 1.00 . A A . 10 LEU HB3 1 1 20 12260 1 1 10 LEU HD11 H 4.999 5.620 -8.538 1.00 . A A . 10 LEU HD11 1 1 20 12261 1 1 10 LEU HD12 H 6.329 4.678 -9.214 1.00 . A A . 10 LEU HD12 1 1 20 12262 1 1 10 LEU HD13 H 5.034 3.870 -8.331 1.00 . A A . 10 LEU HD13 1 1 20 12263 1 1 10 LEU HD21 H 7.551 3.120 -7.139 1.00 . A A . 10 LEU HD21 1 1 20 12264 1 1 10 LEU HD22 H 8.245 4.435 -8.083 1.00 . A A . 10 LEU HD22 1 1 20 12265 1 1 10 LEU HD23 H 8.356 4.460 -6.325 1.00 . A A . 10 LEU HD23 1 1 20 12266 1 1 10 LEU HG H 5.830 4.498 -6.295 1.00 . A A . 10 LEU HG 1 1 20 12267 1 1 10 LEU N N 7.202 6.455 -4.402 1.00 . A A . 10 LEU N 1 1 20 12268 1 1 10 LEU O O 3.826 6.728 -5.476 1.00 . A A . 10 LEU O 1 1 20 12269 1 1 11 LYS C C 3.842 4.423 -2.194 1.00 . A A . 11 LYS C 1 1 20 12270 1 1 11 LYS CA C 3.743 4.576 -3.714 1.00 . A A . 11 LYS CA 1 1 20 12271 1 1 11 LYS CB C 3.580 3.218 -4.430 1.00 . A A . 11 LYS CB 1 1 20 12272 1 1 11 LYS CD C 5.380 1.668 -3.604 1.00 . A A . 11 LYS CD 1 1 20 12273 1 1 11 LYS CE C 4.507 0.441 -3.398 1.00 . A A . 11 LYS CE 1 1 20 12274 1 1 11 LYS CG C 4.891 2.523 -4.761 1.00 . A A . 11 LYS CG 1 1 20 12275 1 1 11 LYS H H 5.792 4.967 -3.832 1.00 . A A . 11 LYS H 1 1 20 12276 1 1 11 LYS HA H 2.893 5.203 -3.945 1.00 . A A . 11 LYS HA 1 1 20 12277 1 1 11 LYS HB2 H 3.001 2.556 -3.814 1.00 . A A . 11 LYS HB2 1 1 20 12278 1 1 11 LYS HB3 H 3.048 3.382 -5.357 1.00 . A A . 11 LYS HB3 1 1 20 12279 1 1 11 LYS HD2 H 6.391 1.347 -3.807 1.00 . A A . 11 LYS HD2 1 1 20 12280 1 1 11 LYS HD3 H 5.365 2.263 -2.701 1.00 . A A . 11 LYS HD3 1 1 20 12281 1 1 11 LYS HE2 H 3.584 0.575 -3.942 1.00 . A A . 11 LYS HE2 1 1 20 12282 1 1 11 LYS HE3 H 5.028 -0.425 -3.778 1.00 . A A . 11 LYS HE3 1 1 20 12283 1 1 11 LYS HG2 H 4.743 1.891 -5.624 1.00 . A A . 11 LYS HG2 1 1 20 12284 1 1 11 LYS HG3 H 5.638 3.272 -4.987 1.00 . A A . 11 LYS HG3 1 1 20 12285 1 1 11 LYS HZ1 H 4.786 0.854 -1.372 1.00 . A A . 11 LYS HZ1 1 1 20 12286 1 1 11 LYS HZ2 H 4.387 -0.759 -1.691 1.00 . A A . 11 LYS HZ2 1 1 20 12287 1 1 11 LYS HZ3 H 3.189 0.444 -1.771 1.00 . A A . 11 LYS HZ3 1 1 20 12288 1 1 11 LYS N N 4.927 5.246 -4.191 1.00 . A A . 11 LYS N 1 1 20 12289 1 1 11 LYS NZ N 4.195 0.230 -1.962 1.00 . A A . 11 LYS NZ 1 1 20 12290 1 1 11 LYS O O 4.596 5.150 -1.544 1.00 . A A . 11 LYS O 1 1 20 12291 1 1 12 CYS C C 4.246 2.714 0.364 1.00 . A A . 12 CYS C 1 1 20 12292 1 1 12 CYS CA C 2.970 3.359 -0.195 1.00 . A A . 12 CYS CA 1 1 20 12293 1 1 12 CYS CB C 1.750 2.499 0.111 1.00 . A A . 12 CYS CB 1 1 20 12294 1 1 12 CYS H H 2.426 3.040 -2.186 1.00 . A A . 12 CYS H 1 1 20 12295 1 1 12 CYS HA H 2.839 4.328 0.261 1.00 . A A . 12 CYS HA 1 1 20 12296 1 1 12 CYS HB2 H 1.826 2.114 1.113 1.00 . A A . 12 CYS HB2 1 1 20 12297 1 1 12 CYS HB3 H 0.863 3.109 0.032 1.00 . A A . 12 CYS HB3 1 1 20 12298 1 1 12 CYS N N 3.038 3.543 -1.630 1.00 . A A . 12 CYS N 1 1 20 12299 1 1 12 CYS O O 5.101 2.241 -0.387 1.00 . A A . 12 CYS O 1 1 20 12300 1 1 12 CYS SG S 1.549 1.093 -1.021 1.00 . A A . 12 CYS SG 1 1 20 12301 1 1 13 PRO C C 5.698 0.646 2.196 1.00 . A A . 13 PRO C 1 1 20 12302 1 1 13 PRO CA C 5.572 2.163 2.376 1.00 . A A . 13 PRO CA 1 1 20 12303 1 1 13 PRO CB C 5.322 2.491 3.856 1.00 . A A . 13 PRO CB 1 1 20 12304 1 1 13 PRO CD C 3.464 3.351 2.639 1.00 . A A . 13 PRO CD 1 1 20 12305 1 1 13 PRO CG C 4.302 3.574 3.857 1.00 . A A . 13 PRO CG 1 1 20 12306 1 1 13 PRO HA H 6.485 2.640 2.050 1.00 . A A . 13 PRO HA 1 1 20 12307 1 1 13 PRO HB2 H 4.959 1.609 4.363 1.00 . A A . 13 PRO HB2 1 1 20 12308 1 1 13 PRO HB3 H 6.234 2.822 4.317 1.00 . A A . 13 PRO HB3 1 1 20 12309 1 1 13 PRO HD2 H 2.638 2.688 2.857 1.00 . A A . 13 PRO HD2 1 1 20 12310 1 1 13 PRO HD3 H 3.102 4.291 2.254 1.00 . A A . 13 PRO HD3 1 1 20 12311 1 1 13 PRO HG2 H 3.694 3.507 4.748 1.00 . A A . 13 PRO HG2 1 1 20 12312 1 1 13 PRO HG3 H 4.791 4.536 3.803 1.00 . A A . 13 PRO HG3 1 1 20 12313 1 1 13 PRO N N 4.399 2.725 1.694 1.00 . A A . 13 PRO N 1 1 20 12314 1 1 13 PRO O O 6.798 0.095 2.270 1.00 . A A . 13 PRO O 1 1 20 12315 1 1 14 THR C C 5.183 -2.051 0.765 1.00 . A A . 14 THR C 1 1 20 12316 1 1 14 THR CA C 4.506 -1.484 2.016 1.00 . A A . 14 THR CA 1 1 20 12317 1 1 14 THR CB C 3.044 -1.954 2.063 1.00 . A A . 14 THR CB 1 1 20 12318 1 1 14 THR CG2 C 2.945 -3.414 2.475 1.00 . A A . 14 THR CG2 1 1 20 12319 1 1 14 THR H H 3.715 0.472 2.107 1.00 . A A . 14 THR H 1 1 20 12320 1 1 14 THR HA H 5.010 -1.871 2.890 1.00 . A A . 14 THR HA 1 1 20 12321 1 1 14 THR HB H 2.610 -1.840 1.080 1.00 . A A . 14 THR HB 1 1 20 12322 1 1 14 THR HG1 H 1.419 -0.987 2.657 1.00 . A A . 14 THR HG1 1 1 20 12323 1 1 14 THR HG21 H 3.687 -3.626 3.230 1.00 . A A . 14 THR HG21 1 1 20 12324 1 1 14 THR HG22 H 3.117 -4.043 1.614 1.00 . A A . 14 THR HG22 1 1 20 12325 1 1 14 THR HG23 H 1.960 -3.610 2.874 1.00 . A A . 14 THR HG23 1 1 20 12326 1 1 14 THR N N 4.560 -0.025 2.077 1.00 . A A . 14 THR N 1 1 20 12327 1 1 14 THR O O 4.754 -1.788 -0.359 1.00 . A A . 14 THR O 1 1 20 12328 1 1 14 THR OG1 O 2.323 -1.141 2.991 1.00 . A A . 14 THR OG1 1 1 20 12329 1 1 15 PRO C C 6.158 -4.482 -0.945 1.00 . A A . 15 PRO C 1 1 20 12330 1 1 15 PRO CA C 6.993 -3.478 -0.149 1.00 . A A . 15 PRO CA 1 1 20 12331 1 1 15 PRO CB C 8.150 -4.198 0.558 1.00 . A A . 15 PRO CB 1 1 20 12332 1 1 15 PRO CD C 6.812 -3.220 2.256 1.00 . A A . 15 PRO CD 1 1 20 12333 1 1 15 PRO CG C 8.226 -3.568 1.903 1.00 . A A . 15 PRO CG 1 1 20 12334 1 1 15 PRO HA H 7.393 -2.731 -0.820 1.00 . A A . 15 PRO HA 1 1 20 12335 1 1 15 PRO HB2 H 7.930 -5.253 0.630 1.00 . A A . 15 PRO HB2 1 1 20 12336 1 1 15 PRO HB3 H 9.063 -4.052 0.005 1.00 . A A . 15 PRO HB3 1 1 20 12337 1 1 15 PRO HD2 H 6.304 -4.074 2.677 1.00 . A A . 15 PRO HD2 1 1 20 12338 1 1 15 PRO HD3 H 6.784 -2.383 2.937 1.00 . A A . 15 PRO HD3 1 1 20 12339 1 1 15 PRO HG2 H 8.634 -4.269 2.613 1.00 . A A . 15 PRO HG2 1 1 20 12340 1 1 15 PRO HG3 H 8.833 -2.677 1.856 1.00 . A A . 15 PRO HG3 1 1 20 12341 1 1 15 PRO N N 6.243 -2.859 0.953 1.00 . A A . 15 PRO N 1 1 20 12342 1 1 15 PRO O O 6.332 -4.621 -2.158 1.00 . A A . 15 PRO O 1 1 20 12343 1 1 16 GLY C C 3.299 -5.681 -1.617 1.00 . A A . 16 GLY C 1 1 20 12344 1 1 16 GLY CA C 4.504 -6.251 -0.898 1.00 . A A . 16 GLY CA 1 1 20 12345 1 1 16 GLY H H 5.253 -5.119 0.728 1.00 . A A . 16 GLY H 1 1 20 12346 1 1 16 GLY HA2 H 5.125 -6.770 -1.609 1.00 . A A . 16 GLY HA2 1 1 20 12347 1 1 16 GLY HA3 H 4.164 -6.956 -0.152 1.00 . A A . 16 GLY HA3 1 1 20 12348 1 1 16 GLY N N 5.301 -5.226 -0.248 1.00 . A A . 16 GLY N 1 1 20 12349 1 1 16 GLY O O 2.786 -6.278 -2.568 1.00 . A A . 16 GLY O 1 1 20 12350 1 1 17 CYS C C 2.271 -2.928 -2.955 1.00 . A A . 17 CYS C 1 1 20 12351 1 1 17 CYS CA C 1.763 -3.814 -1.822 1.00 . A A . 17 CYS CA 1 1 20 12352 1 1 17 CYS CB C 1.024 -2.997 -0.764 1.00 . A A . 17 CYS CB 1 1 20 12353 1 1 17 CYS H H 3.353 -4.059 -0.466 1.00 . A A . 17 CYS H 1 1 20 12354 1 1 17 CYS HA H 1.095 -4.559 -2.228 1.00 . A A . 17 CYS HA 1 1 20 12355 1 1 17 CYS HB2 H 0.679 -3.664 0.008 1.00 . A A . 17 CYS HB2 1 1 20 12356 1 1 17 CYS HB3 H 1.714 -2.288 -0.330 1.00 . A A . 17 CYS HB3 1 1 20 12357 1 1 17 CYS N N 2.875 -4.502 -1.196 1.00 . A A . 17 CYS N 1 1 20 12358 1 1 17 CYS O O 3.477 -2.724 -3.099 1.00 . A A . 17 CYS O 1 1 20 12359 1 1 17 CYS SG S -0.422 -2.063 -1.357 1.00 . A A . 17 CYS SG 1 1 20 12360 1 1 18 ASP C C 1.102 -0.224 -4.839 1.00 . A A . 18 ASP C 1 1 20 12361 1 1 18 ASP CA C 1.728 -1.609 -4.924 1.00 . A A . 18 ASP CA 1 1 20 12362 1 1 18 ASP CB C 1.310 -2.294 -6.229 1.00 . A A . 18 ASP CB 1 1 20 12363 1 1 18 ASP CG C -0.082 -1.904 -6.682 1.00 . A A . 18 ASP CG 1 1 20 12364 1 1 18 ASP H H 0.407 -2.611 -3.596 1.00 . A A . 18 ASP H 1 1 20 12365 1 1 18 ASP HA H 2.802 -1.502 -4.916 1.00 . A A . 18 ASP HA 1 1 20 12366 1 1 18 ASP HB2 H 2.007 -2.022 -7.008 1.00 . A A . 18 ASP HB2 1 1 20 12367 1 1 18 ASP HB3 H 1.335 -3.364 -6.088 1.00 . A A . 18 ASP HB3 1 1 20 12368 1 1 18 ASP N N 1.357 -2.428 -3.774 1.00 . A A . 18 ASP N 1 1 20 12369 1 1 18 ASP O O 1.548 0.712 -5.505 1.00 . A A . 18 ASP O 1 1 20 12370 1 1 18 ASP OD1 O -1.052 -2.194 -5.954 1.00 . A A . 18 ASP OD1 1 1 20 12371 1 1 18 ASP OD2 O -0.211 -1.303 -7.768 1.00 . A A . 18 ASP OD2 1 1 20 12372 1 1 19 GLY C C -1.887 1.319 -4.531 1.00 . A A . 19 GLY C 1 1 20 12373 1 1 19 GLY CA C -0.546 1.207 -3.829 1.00 . A A . 19 GLY CA 1 1 20 12374 1 1 19 GLY H H -0.214 -0.856 -3.473 1.00 . A A . 19 GLY H 1 1 20 12375 1 1 19 GLY HA2 H -0.692 1.379 -2.771 1.00 . A A . 19 GLY HA2 1 1 20 12376 1 1 19 GLY HA3 H 0.114 1.970 -4.215 1.00 . A A . 19 GLY HA3 1 1 20 12377 1 1 19 GLY N N 0.085 -0.085 -4.003 1.00 . A A . 19 GLY N 1 1 20 12378 1 1 19 GLY O O -2.571 2.332 -4.405 1.00 . A A . 19 GLY O 1 1 20 12379 1 1 20 SER C C -4.602 -0.513 -5.112 1.00 . A A . 20 SER C 1 1 20 12380 1 1 20 SER CA C -3.576 0.272 -5.915 1.00 . A A . 20 SER CA 1 1 20 12381 1 1 20 SER CB C -3.442 -0.312 -7.320 1.00 . A A . 20 SER CB 1 1 20 12382 1 1 20 SER H H -1.722 -0.532 -5.282 1.00 . A A . 20 SER H 1 1 20 12383 1 1 20 SER HA H -3.908 1.296 -5.993 1.00 . A A . 20 SER HA 1 1 20 12384 1 1 20 SER HB2 H -3.340 -1.385 -7.253 1.00 . A A . 20 SER HB2 1 1 20 12385 1 1 20 SER HB3 H -4.322 -0.068 -7.897 1.00 . A A . 20 SER HB3 1 1 20 12386 1 1 20 SER HG H -1.547 -0.382 -7.831 1.00 . A A . 20 SER HG 1 1 20 12387 1 1 20 SER N N -2.288 0.274 -5.238 1.00 . A A . 20 SER N 1 1 20 12388 1 1 20 SER O O -4.320 -1.610 -4.628 1.00 . A A . 20 SER O 1 1 20 12389 1 1 20 SER OG O -2.303 0.214 -7.979 1.00 . A A . 20 SER OG 1 1 20 12390 1 1 21 GLY C C -6.814 -0.251 -2.763 1.00 . A A . 21 GLY C 1 1 20 12391 1 1 21 GLY CA C -6.840 -0.605 -4.234 1.00 . A A . 21 GLY CA 1 1 20 12392 1 1 21 GLY H H -5.960 0.924 -5.395 1.00 . A A . 21 GLY H 1 1 20 12393 1 1 21 GLY HA2 H -7.794 -0.316 -4.648 1.00 . A A . 21 GLY HA2 1 1 20 12394 1 1 21 GLY HA3 H -6.724 -1.674 -4.337 1.00 . A A . 21 GLY HA3 1 1 20 12395 1 1 21 GLY N N -5.789 0.053 -4.973 1.00 . A A . 21 GLY N 1 1 20 12396 1 1 21 GLY O O -6.044 0.606 -2.343 1.00 . A A . 21 GLY O 1 1 20 12397 1 1 22 HIS C C -8.257 -2.047 0.079 1.00 . A A . 22 HIS C 1 1 20 12398 1 1 22 HIS CA C -7.716 -0.765 -0.542 1.00 . A A . 22 HIS CA 1 1 20 12399 1 1 22 HIS CB C -8.643 0.404 -0.153 1.00 . A A . 22 HIS CB 1 1 20 12400 1 1 22 HIS CD2 C -7.388 2.603 -0.800 1.00 . A A . 22 HIS CD2 1 1 20 12401 1 1 22 HIS CE1 C -7.332 3.522 1.186 1.00 . A A . 22 HIS CE1 1 1 20 12402 1 1 22 HIS CG C -7.972 1.735 0.063 1.00 . A A . 22 HIS CG 1 1 20 12403 1 1 22 HIS H H -8.196 -1.638 -2.410 1.00 . A A . 22 HIS H 1 1 20 12404 1 1 22 HIS HA H -6.721 -0.579 -0.166 1.00 . A A . 22 HIS HA 1 1 20 12405 1 1 22 HIS HB2 H -9.376 0.537 -0.933 1.00 . A A . 22 HIS HB2 1 1 20 12406 1 1 22 HIS HB3 H -9.155 0.145 0.762 1.00 . A A . 22 HIS HB3 1 1 20 12407 1 1 22 HIS HD1 H -8.249 1.963 2.147 1.00 . A A . 22 HIS HD1 1 1 20 12408 1 1 22 HIS HD2 H -7.251 2.455 -1.862 1.00 . A A . 22 HIS HD2 1 1 20 12409 1 1 22 HIS HE1 H -7.159 4.218 1.992 1.00 . A A . 22 HIS HE1 1 1 20 12410 1 1 22 HIS HE2 H -6.708 4.571 -0.461 1.00 . A A . 22 HIS HE2 1 1 20 12411 1 1 22 HIS N N -7.637 -0.938 -1.992 1.00 . A A . 22 HIS N 1 1 20 12412 1 1 22 HIS ND1 N -7.915 2.343 1.300 1.00 . A A . 22 HIS ND1 1 1 20 12413 1 1 22 HIS NE2 N -7.003 3.704 -0.076 1.00 . A A . 22 HIS NE2 1 1 20 12414 1 1 22 HIS O O -9.068 -2.736 -0.538 1.00 . A A . 22 HIS O 1 1 20 12415 1 1 23 ILE C C -9.929 -3.221 2.346 1.00 . A A . 23 ILE C 1 1 20 12416 1 1 23 ILE CA C -8.450 -3.463 2.040 1.00 . A A . 23 ILE CA 1 1 20 12417 1 1 23 ILE CB C -7.654 -3.754 3.342 1.00 . A A . 23 ILE CB 1 1 20 12418 1 1 23 ILE CD1 C -7.598 -6.195 2.583 1.00 . A A . 23 ILE CD1 1 1 20 12419 1 1 23 ILE CG1 C -6.830 -5.036 3.188 1.00 . A A . 23 ILE CG1 1 1 20 12420 1 1 23 ILE CG2 C -8.562 -3.853 4.564 1.00 . A A . 23 ILE CG2 1 1 20 12421 1 1 23 ILE H H -7.310 -1.690 1.804 1.00 . A A . 23 ILE H 1 1 20 12422 1 1 23 ILE HA H -8.368 -4.324 1.391 1.00 . A A . 23 ILE HA 1 1 20 12423 1 1 23 ILE HB H -6.977 -2.928 3.505 1.00 . A A . 23 ILE HB 1 1 20 12424 1 1 23 ILE HD11 H -8.605 -6.203 2.972 1.00 . A A . 23 ILE HD11 1 1 20 12425 1 1 23 ILE HD12 H -7.629 -6.085 1.509 1.00 . A A . 23 ILE HD12 1 1 20 12426 1 1 23 ILE HD13 H -7.106 -7.124 2.836 1.00 . A A . 23 ILE HD13 1 1 20 12427 1 1 23 ILE HG12 H -5.980 -4.836 2.553 1.00 . A A . 23 ILE HG12 1 1 20 12428 1 1 23 ILE HG13 H -6.479 -5.345 4.161 1.00 . A A . 23 ILE HG13 1 1 20 12429 1 1 23 ILE HG21 H -8.161 -4.585 5.251 1.00 . A A . 23 ILE HG21 1 1 20 12430 1 1 23 ILE HG22 H -8.617 -2.891 5.052 1.00 . A A . 23 ILE HG22 1 1 20 12431 1 1 23 ILE HG23 H -9.551 -4.156 4.253 1.00 . A A . 23 ILE HG23 1 1 20 12432 1 1 23 ILE N N -7.900 -2.315 1.326 1.00 . A A . 23 ILE N 1 1 20 12433 1 1 23 ILE O O -10.736 -4.152 2.375 1.00 . A A . 23 ILE O 1 1 20 12434 1 1 24 THR C C -12.541 -1.799 1.531 1.00 . A A . 24 THR C 1 1 20 12435 1 1 24 THR CA C -11.659 -1.560 2.760 1.00 . A A . 24 THR CA 1 1 20 12436 1 1 24 THR CB C -11.739 -0.073 3.188 1.00 . A A . 24 THR CB 1 1 20 12437 1 1 24 THR CG2 C -11.326 0.848 2.050 1.00 . A A . 24 THR CG2 1 1 20 12438 1 1 24 THR H H -9.590 -1.255 2.449 1.00 . A A . 24 THR H 1 1 20 12439 1 1 24 THR HA H -12.026 -2.163 3.574 1.00 . A A . 24 THR HA 1 1 20 12440 1 1 24 THR HB H -11.057 0.082 4.013 1.00 . A A . 24 THR HB 1 1 20 12441 1 1 24 THR HG1 H -13.505 -0.530 3.966 1.00 . A A . 24 THR HG1 1 1 20 12442 1 1 24 THR HG21 H -10.256 0.786 1.903 1.00 . A A . 24 THR HG21 1 1 20 12443 1 1 24 THR HG22 H -11.596 1.864 2.295 1.00 . A A . 24 THR HG22 1 1 20 12444 1 1 24 THR HG23 H -11.832 0.549 1.143 1.00 . A A . 24 THR HG23 1 1 20 12445 1 1 24 THR N N -10.282 -1.951 2.503 1.00 . A A . 24 THR N 1 1 20 12446 1 1 24 THR O O -13.755 -1.959 1.653 1.00 . A A . 24 THR O 1 1 20 12447 1 1 24 THR OG1 O -13.068 0.262 3.613 1.00 . A A . 24 THR OG1 1 1 20 12448 1 1 25 GLY C C -13.627 -0.955 -1.173 1.00 . A A . 25 GLY C 1 1 20 12449 1 1 25 GLY CA C -12.666 -2.091 -0.869 1.00 . A A . 25 GLY CA 1 1 20 12450 1 1 25 GLY H H -10.947 -1.781 0.322 1.00 . A A . 25 GLY H 1 1 20 12451 1 1 25 GLY HA2 H -11.970 -2.191 -1.690 1.00 . A A . 25 GLY HA2 1 1 20 12452 1 1 25 GLY HA3 H -13.228 -3.007 -0.772 1.00 . A A . 25 GLY HA3 1 1 20 12453 1 1 25 GLY N N -11.921 -1.862 0.354 1.00 . A A . 25 GLY N 1 1 20 12454 1 1 25 GLY O O -14.795 -1.186 -1.489 1.00 . A A . 25 GLY O 1 1 20 12455 1 1 26 ASN C C -13.317 2.564 -1.876 1.00 . A A . 26 ASN C 1 1 20 12456 1 1 26 ASN CA C -14.020 1.444 -1.117 1.00 . A A . 26 ASN CA 1 1 20 12457 1 1 26 ASN CB C -14.437 1.953 0.264 1.00 . A A . 26 ASN CB 1 1 20 12458 1 1 26 ASN CG C -15.656 1.244 0.795 1.00 . A A . 26 ASN CG 1 1 20 12459 1 1 26 ASN H H -12.253 0.386 -0.639 1.00 . A A . 26 ASN H 1 1 20 12460 1 1 26 ASN HA H -14.900 1.146 -1.664 1.00 . A A . 26 ASN HA 1 1 20 12461 1 1 26 ASN HB2 H -13.626 1.799 0.958 1.00 . A A . 26 ASN HB2 1 1 20 12462 1 1 26 ASN HB3 H -14.656 3.008 0.204 1.00 . A A . 26 ASN HB3 1 1 20 12463 1 1 26 ASN HD21 H -14.701 0.826 2.483 1.00 . A A . 26 ASN HD21 1 1 20 12464 1 1 26 ASN HD22 H -16.324 0.252 2.367 1.00 . A A . 26 ASN HD22 1 1 20 12465 1 1 26 ASN N N -13.163 0.272 -0.972 1.00 . A A . 26 ASN N 1 1 20 12466 1 1 26 ASN ND2 N -15.551 0.723 2.002 1.00 . A A . 26 ASN ND2 1 1 20 12467 1 1 26 ASN O O -13.778 3.706 -1.864 1.00 . A A . 26 ASN O 1 1 20 12468 1 1 26 ASN OD1 O -16.685 1.162 0.125 1.00 . A A . 26 ASN OD1 1 1 20 12469 1 1 27 TYR C C -10.772 2.790 -4.408 1.00 . A A . 27 TYR C 1 1 20 12470 1 1 27 TYR CA C -11.354 3.298 -3.096 1.00 . A A . 27 TYR CA 1 1 20 12471 1 1 27 TYR CB C -10.224 3.743 -2.175 1.00 . A A . 27 TYR CB 1 1 20 12472 1 1 27 TYR CD1 C -11.078 3.945 0.195 1.00 . A A . 27 TYR CD1 1 1 20 12473 1 1 27 TYR CD2 C -10.763 5.940 -1.071 1.00 . A A . 27 TYR CD2 1 1 20 12474 1 1 27 TYR CE1 C -11.519 4.691 1.269 1.00 . A A . 27 TYR CE1 1 1 20 12475 1 1 27 TYR CE2 C -11.204 6.691 -0.002 1.00 . A A . 27 TYR CE2 1 1 20 12476 1 1 27 TYR CG C -10.693 4.558 -0.992 1.00 . A A . 27 TYR CG 1 1 20 12477 1 1 27 TYR CZ C -11.581 6.063 1.165 1.00 . A A . 27 TYR CZ 1 1 20 12478 1 1 27 TYR H H -11.781 1.368 -2.360 1.00 . A A . 27 TYR H 1 1 20 12479 1 1 27 TYR HA H -11.996 4.141 -3.299 1.00 . A A . 27 TYR HA 1 1 20 12480 1 1 27 TYR HB2 H -9.707 2.875 -1.797 1.00 . A A . 27 TYR HB2 1 1 20 12481 1 1 27 TYR HB3 H -9.534 4.343 -2.737 1.00 . A A . 27 TYR HB3 1 1 20 12482 1 1 27 TYR HD1 H -11.029 2.867 0.274 1.00 . A A . 27 TYR HD1 1 1 20 12483 1 1 27 TYR HD2 H -10.468 6.430 -1.985 1.00 . A A . 27 TYR HD2 1 1 20 12484 1 1 27 TYR HE1 H -11.816 4.198 2.183 1.00 . A A . 27 TYR HE1 1 1 20 12485 1 1 27 TYR HE2 H -11.252 7.767 -0.082 1.00 . A A . 27 TYR HE2 1 1 20 12486 1 1 27 TYR HH H -12.606 7.520 1.893 1.00 . A A . 27 TYR HH 1 1 20 12487 1 1 27 TYR N N -12.149 2.272 -2.440 1.00 . A A . 27 TYR N 1 1 20 12488 1 1 27 TYR O O -11.105 1.695 -4.862 1.00 . A A . 27 TYR O 1 1 20 12489 1 1 27 TYR OH O -12.029 6.813 2.227 1.00 . A A . 27 TYR OH 1 1 20 12490 1 1 28 ALA C C -7.728 2.915 -5.961 1.00 . A A . 28 ALA C 1 1 20 12491 1 1 28 ALA CA C -9.204 3.191 -6.215 1.00 . A A . 28 ALA CA 1 1 20 12492 1 1 28 ALA CB C -9.372 4.279 -7.264 1.00 . A A . 28 ALA CB 1 1 20 12493 1 1 28 ALA H H -9.623 4.420 -4.548 1.00 . A A . 28 ALA H 1 1 20 12494 1 1 28 ALA HA H -9.673 2.290 -6.585 1.00 . A A . 28 ALA HA 1 1 20 12495 1 1 28 ALA HB1 H -9.636 5.208 -6.780 1.00 . A A . 28 ALA HB1 1 1 20 12496 1 1 28 ALA HB2 H -8.444 4.406 -7.803 1.00 . A A . 28 ALA HB2 1 1 20 12497 1 1 28 ALA HB3 H -10.155 3.998 -7.956 1.00 . A A . 28 ALA HB3 1 1 20 12498 1 1 28 ALA N N -9.870 3.570 -4.982 1.00 . A A . 28 ALA N 1 1 20 12499 1 1 28 ALA O O -7.170 1.946 -6.476 1.00 . A A . 28 ALA O 1 1 20 12500 1 1 29 SER C C -5.315 4.392 -3.580 1.00 . A A . 29 SER C 1 1 20 12501 1 1 29 SER CA C -5.682 3.603 -4.832 1.00 . A A . 29 SER CA 1 1 20 12502 1 1 29 SER CB C -4.815 4.052 -6.019 1.00 . A A . 29 SER CB 1 1 20 12503 1 1 29 SER H H -7.598 4.508 -4.745 1.00 . A A . 29 SER H 1 1 20 12504 1 1 29 SER HA H -5.501 2.557 -4.643 1.00 . A A . 29 SER HA 1 1 20 12505 1 1 29 SER HB2 H -3.953 4.589 -5.650 1.00 . A A . 29 SER HB2 1 1 20 12506 1 1 29 SER HB3 H -4.487 3.183 -6.571 1.00 . A A . 29 SER HB3 1 1 20 12507 1 1 29 SER HG H -6.015 4.363 -7.549 1.00 . A A . 29 SER HG 1 1 20 12508 1 1 29 SER N N -7.098 3.760 -5.149 1.00 . A A . 29 SER N 1 1 20 12509 1 1 29 SER O O -6.173 5.022 -2.962 1.00 . A A . 29 SER O 1 1 20 12510 1 1 29 SER OG O -5.539 4.904 -6.898 1.00 . A A . 29 SER OG 1 1 20 12511 1 1 30 HIS C C -2.054 5.279 -2.174 1.00 . A A . 30 HIS C 1 1 20 12512 1 1 30 HIS CA C -3.548 5.000 -2.010 1.00 . A A . 30 HIS CA 1 1 20 12513 1 1 30 HIS CB C -3.801 4.158 -0.756 1.00 . A A . 30 HIS CB 1 1 20 12514 1 1 30 HIS CD2 C -1.996 2.352 -0.382 1.00 . A A . 30 HIS CD2 1 1 20 12515 1 1 30 HIS CE1 C -2.971 0.661 -1.316 1.00 . A A . 30 HIS CE1 1 1 20 12516 1 1 30 HIS CG C -3.200 2.789 -0.818 1.00 . A A . 30 HIS CG 1 1 20 12517 1 1 30 HIS H H -3.429 3.747 -3.702 1.00 . A A . 30 HIS H 1 1 20 12518 1 1 30 HIS HA H -4.072 5.940 -1.921 1.00 . A A . 30 HIS HA 1 1 20 12519 1 1 30 HIS HB2 H -3.376 4.664 0.091 1.00 . A A . 30 HIS HB2 1 1 20 12520 1 1 30 HIS HB3 H -4.866 4.050 -0.611 1.00 . A A . 30 HIS HB3 1 1 20 12521 1 1 30 HIS HD1 H -4.709 1.683 -1.816 1.00 . A A . 30 HIS HD1 1 1 20 12522 1 1 30 HIS HD2 H -1.252 2.936 0.135 1.00 . A A . 30 HIS HD2 1 1 20 12523 1 1 30 HIS HE1 H -3.173 -0.329 -1.692 1.00 . A A . 30 HIS HE1 1 1 20 12524 1 1 30 HIS N N -4.049 4.312 -3.191 1.00 . A A . 30 HIS N 1 1 20 12525 1 1 30 HIS ND1 N -3.812 1.700 -1.408 1.00 . A A . 30 HIS ND1 1 1 20 12526 1 1 30 HIS NE2 N -1.871 1.020 -0.706 1.00 . A A . 30 HIS NE2 1 1 20 12527 1 1 30 HIS O O -1.513 5.118 -3.269 1.00 . A A . 30 HIS O 1 1 20 12528 1 1 31 ARG C C 0.675 5.864 0.237 1.00 . A A . 31 ARG C 1 1 20 12529 1 1 31 ARG CA C 0.037 5.983 -1.144 1.00 . A A . 31 ARG CA 1 1 20 12530 1 1 31 ARG CB C 0.270 7.389 -1.698 1.00 . A A . 31 ARG CB 1 1 20 12531 1 1 31 ARG CD C 2.575 8.277 -2.171 1.00 . A A . 31 ARG CD 1 1 20 12532 1 1 31 ARG CG C 1.408 7.457 -2.701 1.00 . A A . 31 ARG CG 1 1 20 12533 1 1 31 ARG CZ C 2.711 10.347 -0.830 1.00 . A A . 31 ARG CZ 1 1 20 12534 1 1 31 ARG H H -1.874 5.791 -0.245 1.00 . A A . 31 ARG H 1 1 20 12535 1 1 31 ARG HA H 0.503 5.265 -1.803 1.00 . A A . 31 ARG HA 1 1 20 12536 1 1 31 ARG HB2 H -0.633 7.728 -2.185 1.00 . A A . 31 ARG HB2 1 1 20 12537 1 1 31 ARG HB3 H 0.501 8.053 -0.880 1.00 . A A . 31 ARG HB3 1 1 20 12538 1 1 31 ARG HD2 H 2.960 7.799 -1.283 1.00 . A A . 31 ARG HD2 1 1 20 12539 1 1 31 ARG HD3 H 3.348 8.309 -2.925 1.00 . A A . 31 ARG HD3 1 1 20 12540 1 1 31 ARG HE H 1.489 10.068 -2.400 1.00 . A A . 31 ARG HE 1 1 20 12541 1 1 31 ARG HG2 H 1.748 6.454 -2.905 1.00 . A A . 31 ARG HG2 1 1 20 12542 1 1 31 ARG HG3 H 1.043 7.909 -3.612 1.00 . A A . 31 ARG HG3 1 1 20 12543 1 1 31 ARG HH11 H 3.947 8.852 -0.220 1.00 . A A . 31 ARG HH11 1 1 20 12544 1 1 31 ARG HH12 H 4.053 10.328 0.695 1.00 . A A . 31 ARG HH12 1 1 20 12545 1 1 31 ARG HH21 H 1.604 12.016 -1.178 1.00 . A A . 31 ARG HH21 1 1 20 12546 1 1 31 ARG HH22 H 2.697 12.110 0.173 1.00 . A A . 31 ARG HH22 1 1 20 12547 1 1 31 ARG N N -1.391 5.684 -1.095 1.00 . A A . 31 ARG N 1 1 20 12548 1 1 31 ARG NE N 2.182 9.646 -1.835 1.00 . A A . 31 ARG NE 1 1 20 12549 1 1 31 ARG NH1 N 3.639 9.798 -0.054 1.00 . A A . 31 ARG NH1 1 1 20 12550 1 1 31 ARG NH2 N 2.308 11.591 -0.593 1.00 . A A . 31 ARG NH2 1 1 20 12551 1 1 31 ARG O O 1.821 6.260 0.437 1.00 . A A . 31 ARG O 1 1 20 12552 1 1 32 SER C C -0.087 3.792 3.113 1.00 . A A . 32 SER C 1 1 20 12553 1 1 32 SER CA C 0.438 5.099 2.530 1.00 . A A . 32 SER CA 1 1 20 12554 1 1 32 SER CB C 0.022 6.275 3.417 1.00 . A A . 32 SER CB 1 1 20 12555 1 1 32 SER H H -0.956 4.975 0.950 1.00 . A A . 32 SER H 1 1 20 12556 1 1 32 SER HA H 1.514 5.054 2.485 1.00 . A A . 32 SER HA 1 1 20 12557 1 1 32 SER HB2 H -0.595 5.915 4.224 1.00 . A A . 32 SER HB2 1 1 20 12558 1 1 32 SER HB3 H 0.906 6.744 3.821 1.00 . A A . 32 SER HB3 1 1 20 12559 1 1 32 SER HG H -0.090 7.881 2.289 1.00 . A A . 32 SER HG 1 1 20 12560 1 1 32 SER N N -0.061 5.293 1.176 1.00 . A A . 32 SER N 1 1 20 12561 1 1 32 SER O O -0.972 3.162 2.531 1.00 . A A . 32 SER O 1 1 20 12562 1 1 32 SER OG O -0.710 7.244 2.680 1.00 . A A . 32 SER OG 1 1 20 12563 1 1 33 LEU C C -1.280 2.268 5.628 1.00 . A A . 33 LEU C 1 1 20 12564 1 1 33 LEU CA C 0.066 2.142 4.913 1.00 . A A . 33 LEU CA 1 1 20 12565 1 1 33 LEU CB C 1.133 1.738 5.930 1.00 . A A . 33 LEU CB 1 1 20 12566 1 1 33 LEU CD1 C 3.353 0.627 6.180 1.00 . A A . 33 LEU CD1 1 1 20 12567 1 1 33 LEU CD2 C 1.281 -0.755 5.910 1.00 . A A . 33 LEU CD2 1 1 20 12568 1 1 33 LEU CG C 1.982 0.542 5.530 1.00 . A A . 33 LEU CG 1 1 20 12569 1 1 33 LEU H H 1.199 3.906 4.650 1.00 . A A . 33 LEU H 1 1 20 12570 1 1 33 LEU HA H -0.003 1.379 4.154 1.00 . A A . 33 LEU HA 1 1 20 12571 1 1 33 LEU HB2 H 1.790 2.583 6.087 1.00 . A A . 33 LEU HB2 1 1 20 12572 1 1 33 LEU HB3 H 0.643 1.508 6.864 1.00 . A A . 33 LEU HB3 1 1 20 12573 1 1 33 LEU HD11 H 3.425 1.542 6.751 1.00 . A A . 33 LEU HD11 1 1 20 12574 1 1 33 LEU HD12 H 3.493 -0.219 6.836 1.00 . A A . 33 LEU HD12 1 1 20 12575 1 1 33 LEU HD13 H 4.115 0.620 5.414 1.00 . A A . 33 LEU HD13 1 1 20 12576 1 1 33 LEU HD21 H 1.878 -1.595 5.588 1.00 . A A . 33 LEU HD21 1 1 20 12577 1 1 33 LEU HD22 H 1.150 -0.795 6.982 1.00 . A A . 33 LEU HD22 1 1 20 12578 1 1 33 LEU HD23 H 0.313 -0.797 5.429 1.00 . A A . 33 LEU HD23 1 1 20 12579 1 1 33 LEU HG H 2.118 0.554 4.459 1.00 . A A . 33 LEU HG 1 1 20 12580 1 1 33 LEU N N 0.456 3.391 4.265 1.00 . A A . 33 LEU N 1 1 20 12581 1 1 33 LEU O O -1.525 1.610 6.643 1.00 . A A . 33 LEU O 1 1 20 12582 1 1 34 SER C C -4.530 2.580 4.924 1.00 . A A . 34 SER C 1 1 20 12583 1 1 34 SER CA C -3.455 3.337 5.692 1.00 . A A . 34 SER CA 1 1 20 12584 1 1 34 SER CB C -3.770 4.831 5.695 1.00 . A A . 34 SER CB 1 1 20 12585 1 1 34 SER H H -1.895 3.620 4.300 1.00 . A A . 34 SER H 1 1 20 12586 1 1 34 SER HA H -3.429 2.979 6.709 1.00 . A A . 34 SER HA 1 1 20 12587 1 1 34 SER HB2 H -4.556 5.031 4.983 1.00 . A A . 34 SER HB2 1 1 20 12588 1 1 34 SER HB3 H -4.093 5.126 6.682 1.00 . A A . 34 SER HB3 1 1 20 12589 1 1 34 SER HG H -1.909 5.405 5.969 1.00 . A A . 34 SER HG 1 1 20 12590 1 1 34 SER N N -2.146 3.116 5.103 1.00 . A A . 34 SER N 1 1 20 12591 1 1 34 SER O O -5.645 2.397 5.413 1.00 . A A . 34 SER O 1 1 20 12592 1 1 34 SER OG O -2.626 5.592 5.340 1.00 . A A . 34 SER OG 1 1 20 12593 1 1 35 GLY C C -4.600 0.403 2.029 1.00 . A A . 35 GLY C 1 1 20 12594 1 1 35 GLY CA C -5.190 1.504 2.881 1.00 . A A . 35 GLY CA 1 1 20 12595 1 1 35 GLY H H -3.320 2.379 3.341 1.00 . A A . 35 GLY H 1 1 20 12596 1 1 35 GLY HA2 H -5.945 1.078 3.524 1.00 . A A . 35 GLY HA2 1 1 20 12597 1 1 35 GLY HA3 H -5.657 2.233 2.233 1.00 . A A . 35 GLY HA3 1 1 20 12598 1 1 35 GLY N N -4.209 2.177 3.702 1.00 . A A . 35 GLY N 1 1 20 12599 1 1 35 GLY O O -5.168 0.049 0.995 1.00 . A A . 35 GLY O 1 1 20 12600 1 1 36 CYS C C -3.702 -2.512 1.784 1.00 . A A . 36 CYS C 1 1 20 12601 1 1 36 CYS CA C -2.839 -1.252 1.766 1.00 . A A . 36 CYS CA 1 1 20 12602 1 1 36 CYS CB C -1.478 -1.549 2.399 1.00 . A A . 36 CYS CB 1 1 20 12603 1 1 36 CYS H H -3.093 0.155 3.317 1.00 . A A . 36 CYS H 1 1 20 12604 1 1 36 CYS HA H -2.689 -0.944 0.744 1.00 . A A . 36 CYS HA 1 1 20 12605 1 1 36 CYS HB2 H -1.583 -1.554 3.475 1.00 . A A . 36 CYS HB2 1 1 20 12606 1 1 36 CYS HB3 H -1.137 -2.521 2.066 1.00 . A A . 36 CYS HB3 1 1 20 12607 1 1 36 CYS N N -3.484 -0.159 2.475 1.00 . A A . 36 CYS N 1 1 20 12608 1 1 36 CYS O O -3.957 -3.087 2.846 1.00 . A A . 36 CYS O 1 1 20 12609 1 1 36 CYS SG S -0.191 -0.339 1.972 1.00 . A A . 36 CYS SG 1 1 20 12610 1 1 37 PRO C C -3.981 -5.439 0.716 1.00 . A A . 37 PRO C 1 1 20 12611 1 1 37 PRO CA C -4.879 -4.231 0.473 1.00 . A A . 37 PRO CA 1 1 20 12612 1 1 37 PRO CB C -5.376 -4.210 -0.973 1.00 . A A . 37 PRO CB 1 1 20 12613 1 1 37 PRO CD C -3.867 -2.361 -0.710 1.00 . A A . 37 PRO CD 1 1 20 12614 1 1 37 PRO CG C -4.394 -3.361 -1.705 1.00 . A A . 37 PRO CG 1 1 20 12615 1 1 37 PRO HA H -5.719 -4.259 1.152 1.00 . A A . 37 PRO HA 1 1 20 12616 1 1 37 PRO HB2 H -5.396 -5.216 -1.365 1.00 . A A . 37 PRO HB2 1 1 20 12617 1 1 37 PRO HB3 H -6.368 -3.784 -1.010 1.00 . A A . 37 PRO HB3 1 1 20 12618 1 1 37 PRO HD2 H -2.808 -2.199 -0.857 1.00 . A A . 37 PRO HD2 1 1 20 12619 1 1 37 PRO HD3 H -4.403 -1.429 -0.799 1.00 . A A . 37 PRO HD3 1 1 20 12620 1 1 37 PRO HG2 H -3.589 -3.975 -2.081 1.00 . A A . 37 PRO HG2 1 1 20 12621 1 1 37 PRO HG3 H -4.889 -2.851 -2.521 1.00 . A A . 37 PRO HG3 1 1 20 12622 1 1 37 PRO N N -4.126 -2.986 0.599 1.00 . A A . 37 PRO N 1 1 20 12623 1 1 37 PRO O O -4.454 -6.553 0.932 1.00 . A A . 37 PRO O 1 1 20 12624 1 1 38 ARG C C -0.899 -5.831 2.272 1.00 . A A . 38 ARG C 1 1 20 12625 1 1 38 ARG CA C -1.695 -6.212 1.033 1.00 . A A . 38 ARG CA 1 1 20 12626 1 1 38 ARG CB C -0.750 -6.409 -0.151 1.00 . A A . 38 ARG CB 1 1 20 12627 1 1 38 ARG CD C -1.076 -6.441 -2.626 1.00 . A A . 38 ARG CD 1 1 20 12628 1 1 38 ARG CG C -1.381 -7.142 -1.316 1.00 . A A . 38 ARG CG 1 1 20 12629 1 1 38 ARG CZ C -2.375 -5.218 -4.328 1.00 . A A . 38 ARG CZ 1 1 20 12630 1 1 38 ARG H H -2.373 -4.261 0.613 1.00 . A A . 38 ARG H 1 1 20 12631 1 1 38 ARG HA H -2.221 -7.135 1.223 1.00 . A A . 38 ARG HA 1 1 20 12632 1 1 38 ARG HB2 H -0.422 -5.441 -0.504 1.00 . A A . 38 ARG HB2 1 1 20 12633 1 1 38 ARG HB3 H 0.111 -6.971 0.180 1.00 . A A . 38 ARG HB3 1 1 20 12634 1 1 38 ARG HD2 H -0.583 -5.507 -2.409 1.00 . A A . 38 ARG HD2 1 1 20 12635 1 1 38 ARG HD3 H -0.417 -7.068 -3.207 1.00 . A A . 38 ARG HD3 1 1 20 12636 1 1 38 ARG HE H -3.080 -6.724 -3.214 1.00 . A A . 38 ARG HE 1 1 20 12637 1 1 38 ARG HG2 H -0.988 -8.148 -1.354 1.00 . A A . 38 ARG HG2 1 1 20 12638 1 1 38 ARG HG3 H -2.452 -7.174 -1.172 1.00 . A A . 38 ARG HG3 1 1 20 12639 1 1 38 ARG HH11 H -0.464 -4.589 -4.113 1.00 . A A . 38 ARG HH11 1 1 20 12640 1 1 38 ARG HH12 H -1.396 -3.713 -5.294 1.00 . A A . 38 ARG HH12 1 1 20 12641 1 1 38 ARG HH21 H -4.312 -5.611 -4.759 1.00 . A A . 38 ARG HH21 1 1 20 12642 1 1 38 ARG HH22 H -3.582 -4.342 -5.697 1.00 . A A . 38 ARG HH22 1 1 20 12643 1 1 38 ARG N N -2.678 -5.186 0.742 1.00 . A A . 38 ARG N 1 1 20 12644 1 1 38 ARG NE N -2.285 -6.169 -3.401 1.00 . A A . 38 ARG NE 1 1 20 12645 1 1 38 ARG NH1 N -1.325 -4.452 -4.602 1.00 . A A . 38 ARG NH1 1 1 20 12646 1 1 38 ARG NH2 N -3.515 -5.038 -4.976 1.00 . A A . 38 ARG NH2 1 1 20 12647 1 1 38 ARG O O 0.328 -5.953 2.295 1.00 . A A . 38 ARG O 1 1 20 12648 1 1 39 ALA C C -0.110 -6.011 5.118 1.00 . A A . 39 ALA C 1 1 20 12649 1 1 39 ALA CA C -0.987 -4.911 4.533 1.00 . A A . 39 ALA CA 1 1 20 12650 1 1 39 ALA CB C -2.050 -4.493 5.536 1.00 . A A . 39 ALA CB 1 1 20 12651 1 1 39 ALA H H -2.576 -5.238 3.179 1.00 . A A . 39 ALA H 1 1 20 12652 1 1 39 ALA HA H -0.370 -4.049 4.321 1.00 . A A . 39 ALA HA 1 1 20 12653 1 1 39 ALA HB1 H -2.125 -5.240 6.312 1.00 . A A . 39 ALA HB1 1 1 20 12654 1 1 39 ALA HB2 H -1.778 -3.544 5.973 1.00 . A A . 39 ALA HB2 1 1 20 12655 1 1 39 ALA HB3 H -3.000 -4.399 5.032 1.00 . A A . 39 ALA HB3 1 1 20 12656 1 1 39 ALA N N -1.607 -5.338 3.285 1.00 . A A . 39 ALA N 1 1 20 12657 1 1 39 ALA O O -0.435 -7.197 5.017 1.00 . A A . 39 ALA O 1 1 20 12658 1 1 40 LYS C C 1.488 -7.406 7.294 1.00 . A A . 40 LYS C 1 1 20 12659 1 1 40 LYS CA C 2.036 -6.561 6.145 1.00 . A A . 40 LYS CA 1 1 20 12660 1 1 40 LYS CB C 3.301 -5.823 6.605 1.00 . A A . 40 LYS CB 1 1 20 12661 1 1 40 LYS CD C 4.994 -4.255 5.594 1.00 . A A . 40 LYS CD 1 1 20 12662 1 1 40 LYS CE C 5.712 -3.520 6.718 1.00 . A A . 40 LYS CE 1 1 20 12663 1 1 40 LYS CG C 3.526 -4.481 5.922 1.00 . A A . 40 LYS CG 1 1 20 12664 1 1 40 LYS H H 1.264 -4.659 5.622 1.00 . A A . 40 LYS H 1 1 20 12665 1 1 40 LYS HA H 2.294 -7.217 5.329 1.00 . A A . 40 LYS HA 1 1 20 12666 1 1 40 LYS HB2 H 3.234 -5.650 7.668 1.00 . A A . 40 LYS HB2 1 1 20 12667 1 1 40 LYS HB3 H 4.159 -6.451 6.407 1.00 . A A . 40 LYS HB3 1 1 20 12668 1 1 40 LYS HD2 H 5.470 -5.213 5.442 1.00 . A A . 40 LYS HD2 1 1 20 12669 1 1 40 LYS HD3 H 5.064 -3.669 4.691 1.00 . A A . 40 LYS HD3 1 1 20 12670 1 1 40 LYS HE2 H 5.336 -3.880 7.664 1.00 . A A . 40 LYS HE2 1 1 20 12671 1 1 40 LYS HE3 H 6.770 -3.728 6.651 1.00 . A A . 40 LYS HE3 1 1 20 12672 1 1 40 LYS HG2 H 2.956 -4.453 5.004 1.00 . A A . 40 LYS HG2 1 1 20 12673 1 1 40 LYS HG3 H 3.189 -3.694 6.581 1.00 . A A . 40 LYS HG3 1 1 20 12674 1 1 40 LYS HZ1 H 5.993 -1.658 5.817 1.00 . A A . 40 LYS HZ1 1 1 20 12675 1 1 40 LYS HZ2 H 5.881 -1.594 7.508 1.00 . A A . 40 LYS HZ2 1 1 20 12676 1 1 40 LYS HZ3 H 4.486 -1.838 6.576 1.00 . A A . 40 LYS HZ3 1 1 20 12677 1 1 40 LYS N N 1.040 -5.612 5.648 1.00 . A A . 40 LYS N 1 1 20 12678 1 1 40 LYS NZ N 5.502 -2.053 6.648 1.00 . A A . 40 LYS NZ 1 1 20 12679 1 1 40 LYS O O 1.961 -8.516 7.522 1.00 . A A . 40 LYS O 1 1 20 12680 1 1 41 LYS C C 0.855 -7.719 10.293 1.00 . A A . 41 LYS C 1 1 20 12681 1 1 41 LYS CA C -0.136 -7.546 9.143 1.00 . A A . 41 LYS CA 1 1 20 12682 1 1 41 LYS CB C -0.730 -8.899 8.730 1.00 . A A . 41 LYS CB 1 1 20 12683 1 1 41 LYS CD C -3.063 -7.977 8.447 1.00 . A A . 41 LYS CD 1 1 20 12684 1 1 41 LYS CE C -3.989 -8.847 9.280 1.00 . A A . 41 LYS CE 1 1 20 12685 1 1 41 LYS CG C -1.942 -8.789 7.814 1.00 . A A . 41 LYS CG 1 1 20 12686 1 1 41 LYS H H 0.176 -5.977 7.758 1.00 . A A . 41 LYS H 1 1 20 12687 1 1 41 LYS HA H -0.937 -6.909 9.487 1.00 . A A . 41 LYS HA 1 1 20 12688 1 1 41 LYS HB2 H 0.029 -9.468 8.215 1.00 . A A . 41 LYS HB2 1 1 20 12689 1 1 41 LYS HB3 H -1.027 -9.435 9.620 1.00 . A A . 41 LYS HB3 1 1 20 12690 1 1 41 LYS HD2 H -2.633 -7.219 9.082 1.00 . A A . 41 LYS HD2 1 1 20 12691 1 1 41 LYS HD3 H -3.637 -7.506 7.662 1.00 . A A . 41 LYS HD3 1 1 20 12692 1 1 41 LYS HE2 H -3.648 -9.870 9.223 1.00 . A A . 41 LYS HE2 1 1 20 12693 1 1 41 LYS HE3 H -3.950 -8.511 10.305 1.00 . A A . 41 LYS HE3 1 1 20 12694 1 1 41 LYS HG2 H -1.640 -8.307 6.896 1.00 . A A . 41 LYS HG2 1 1 20 12695 1 1 41 LYS HG3 H -2.307 -9.782 7.595 1.00 . A A . 41 LYS HG3 1 1 20 12696 1 1 41 LYS HZ1 H -5.421 -8.554 7.786 1.00 . A A . 41 LYS HZ1 1 1 20 12697 1 1 41 LYS HZ2 H -5.918 -8.044 9.325 1.00 . A A . 41 LYS HZ2 1 1 20 12698 1 1 41 LYS HZ3 H -5.872 -9.698 8.957 1.00 . A A . 41 LYS HZ3 1 1 20 12699 1 1 41 LYS N N 0.494 -6.868 8.005 1.00 . A A . 41 LYS N 1 1 20 12700 1 1 41 LYS NZ N -5.396 -8.780 8.803 1.00 . A A . 41 LYS NZ 1 1 20 12701 1 1 41 LYS O O 0.908 -6.885 11.196 1.00 . A A . 41 LYS O 1 1 20 12702 1 1 42 SER C C 3.796 -7.842 11.066 1.00 . A A . 42 SER C 1 1 20 12703 1 1 42 SER CA C 2.751 -8.950 11.187 1.00 . A A . 42 SER CA 1 1 20 12704 1 1 42 SER CB C 3.395 -10.319 10.967 1.00 . A A . 42 SER CB 1 1 20 12705 1 1 42 SER H H 1.652 -9.332 9.426 1.00 . A A . 42 SER H 1 1 20 12706 1 1 42 SER HA H 2.311 -8.915 12.171 1.00 . A A . 42 SER HA 1 1 20 12707 1 1 42 SER HB2 H 4.433 -10.191 10.706 1.00 . A A . 42 SER HB2 1 1 20 12708 1 1 42 SER HB3 H 3.320 -10.903 11.873 1.00 . A A . 42 SER HB3 1 1 20 12709 1 1 42 SER HG H 1.918 -11.406 10.252 1.00 . A A . 42 SER HG 1 1 20 12710 1 1 42 SER N N 1.694 -8.743 10.209 1.00 . A A . 42 SER N 1 1 20 12711 1 1 42 SER O O 4.629 -7.856 10.157 1.00 . A A . 42 SER O 1 1 20 12712 1 1 42 SER OG O 2.744 -11.020 9.916 1.00 . A A . 42 SER OG 1 1 20 12713 1 1 43 GLY C C 4.115 -4.842 10.537 1.00 . A A . 43 GLY C 1 1 20 12714 1 1 43 GLY CA C 4.485 -5.640 11.768 1.00 . A A . 43 GLY CA 1 1 20 12715 1 1 43 GLY H H 2.907 -6.813 12.538 1.00 . A A . 43 GLY H 1 1 20 12716 1 1 43 GLY HA2 H 4.361 -5.021 12.645 1.00 . A A . 43 GLY HA2 1 1 20 12717 1 1 43 GLY HA3 H 5.519 -5.944 11.693 1.00 . A A . 43 GLY HA3 1 1 20 12718 1 1 43 GLY N N 3.652 -6.814 11.896 1.00 . A A . 43 GLY N 1 1 20 12719 1 1 43 GLY O O 4.901 -4.749 9.593 1.00 . A A . 43 GLY O 1 1 20 12720 1 1 44 LEU C C 2.883 -2.273 9.217 1.00 . A A . 44 LEU C 1 1 20 12721 1 1 44 LEU CA C 2.370 -3.702 9.300 1.00 . A A . 44 LEU CA 1 1 20 12722 1 1 44 LEU CB C 0.833 -3.719 9.237 1.00 . A A . 44 LEU CB 1 1 20 12723 1 1 44 LEU CD1 C -0.327 -2.040 10.698 1.00 . A A . 44 LEU CD1 1 1 20 12724 1 1 44 LEU CD2 C -1.112 -4.404 10.657 1.00 . A A . 44 LEU CD2 1 1 20 12725 1 1 44 LEU CG C 0.100 -3.492 10.562 1.00 . A A . 44 LEU CG 1 1 20 12726 1 1 44 LEU H H 2.256 -4.566 11.235 1.00 . A A . 44 LEU H 1 1 20 12727 1 1 44 LEU HA H 2.749 -4.244 8.446 1.00 . A A . 44 LEU HA 1 1 20 12728 1 1 44 LEU HB2 H 0.519 -2.951 8.545 1.00 . A A . 44 LEU HB2 1 1 20 12729 1 1 44 LEU HB3 H 0.523 -4.676 8.843 1.00 . A A . 44 LEU HB3 1 1 20 12730 1 1 44 LEU HD11 H 0.371 -1.408 10.171 1.00 . A A . 44 LEU HD11 1 1 20 12731 1 1 44 LEU HD12 H -1.314 -1.914 10.279 1.00 . A A . 44 LEU HD12 1 1 20 12732 1 1 44 LEU HD13 H -0.343 -1.765 11.743 1.00 . A A . 44 LEU HD13 1 1 20 12733 1 1 44 LEU HD21 H -1.808 -4.161 9.867 1.00 . A A . 44 LEU HD21 1 1 20 12734 1 1 44 LEU HD22 H -0.798 -5.432 10.556 1.00 . A A . 44 LEU HD22 1 1 20 12735 1 1 44 LEU HD23 H -1.591 -4.265 11.615 1.00 . A A . 44 LEU HD23 1 1 20 12736 1 1 44 LEU HG H 0.764 -3.726 11.382 1.00 . A A . 44 LEU HG 1 1 20 12737 1 1 44 LEU N N 2.869 -4.380 10.487 1.00 . A A . 44 LEU N 1 1 20 12738 1 1 44 LEU O O 3.263 -1.818 8.146 1.00 . A A . 44 LEU O 1 1 20 12739 1 1 45 ARG C C 4.379 0.076 11.416 1.00 . A A . 45 ARG C 1 1 20 12740 1 1 45 ARG CA C 3.340 -0.177 10.333 1.00 . A A . 45 ARG CA 1 1 20 12741 1 1 45 ARG CB C 2.150 0.766 10.511 1.00 . A A . 45 ARG CB 1 1 20 12742 1 1 45 ARG CD C 1.803 3.252 10.584 1.00 . A A . 45 ARG CD 1 1 20 12743 1 1 45 ARG CG C 2.304 2.079 9.761 1.00 . A A . 45 ARG CG 1 1 20 12744 1 1 45 ARG CZ C 2.891 5.063 11.864 1.00 . A A . 45 ARG CZ 1 1 20 12745 1 1 45 ARG H H 2.590 -1.974 11.175 1.00 . A A . 45 ARG H 1 1 20 12746 1 1 45 ARG HA H 3.793 0.017 9.373 1.00 . A A . 45 ARG HA 1 1 20 12747 1 1 45 ARG HB2 H 1.259 0.271 10.153 1.00 . A A . 45 ARG HB2 1 1 20 12748 1 1 45 ARG HB3 H 2.034 0.984 11.561 1.00 . A A . 45 ARG HB3 1 1 20 12749 1 1 45 ARG HD2 H 1.480 4.034 9.914 1.00 . A A . 45 ARG HD2 1 1 20 12750 1 1 45 ARG HD3 H 0.964 2.922 11.179 1.00 . A A . 45 ARG HD3 1 1 20 12751 1 1 45 ARG HE H 3.516 3.161 11.804 1.00 . A A . 45 ARG HE 1 1 20 12752 1 1 45 ARG HG2 H 3.349 2.232 9.532 1.00 . A A . 45 ARG HG2 1 1 20 12753 1 1 45 ARG HG3 H 1.737 2.026 8.843 1.00 . A A . 45 ARG HG3 1 1 20 12754 1 1 45 ARG HH11 H 1.214 5.623 10.861 1.00 . A A . 45 ARG HH11 1 1 20 12755 1 1 45 ARG HH12 H 2.012 6.892 11.746 1.00 . A A . 45 ARG HH12 1 1 20 12756 1 1 45 ARG HH21 H 4.550 4.814 13.006 1.00 . A A . 45 ARG HH21 1 1 20 12757 1 1 45 ARG HH22 H 3.897 6.427 12.979 1.00 . A A . 45 ARG HH22 1 1 20 12758 1 1 45 ARG N N 2.898 -1.565 10.336 1.00 . A A . 45 ARG N 1 1 20 12759 1 1 45 ARG NE N 2.833 3.788 11.476 1.00 . A A . 45 ARG NE 1 1 20 12760 1 1 45 ARG NH1 N 1.967 5.928 11.462 1.00 . A A . 45 ARG NH1 1 1 20 12761 1 1 45 ARG NH2 N 3.856 5.466 12.679 1.00 . A A . 45 ARG NH2 1 1 20 12762 1 1 45 ARG O O 4.451 1.166 11.984 1.00 . A A . 45 ARG O 1 1 20 12763 1 1 46 VAL C C 7.659 -1.113 11.831 1.00 . A A . 46 VAL C 1 1 20 12764 1 1 46 VAL CA C 6.367 -0.732 12.531 1.00 . A A . 46 VAL CA 1 1 20 12765 1 1 46 VAL CB C 6.211 -1.581 13.813 1.00 . A A . 46 VAL CB 1 1 20 12766 1 1 46 VAL CG1 C 5.705 -0.724 14.964 1.00 . A A . 46 VAL CG1 1 1 20 12767 1 1 46 VAL CG2 C 5.286 -2.767 13.582 1.00 . A A . 46 VAL CG2 1 1 20 12768 1 1 46 VAL H H 5.213 -1.696 11.054 1.00 . A A . 46 VAL H 1 1 20 12769 1 1 46 VAL HA H 6.417 0.311 12.815 1.00 . A A . 46 VAL HA 1 1 20 12770 1 1 46 VAL HB H 7.185 -1.962 14.083 1.00 . A A . 46 VAL HB 1 1 20 12771 1 1 46 VAL HG11 H 4.874 -1.220 15.446 1.00 . A A . 46 VAL HG11 1 1 20 12772 1 1 46 VAL HG12 H 6.501 -0.577 15.680 1.00 . A A . 46 VAL HG12 1 1 20 12773 1 1 46 VAL HG13 H 5.382 0.234 14.585 1.00 . A A . 46 VAL HG13 1 1 20 12774 1 1 46 VAL HG21 H 4.520 -2.493 12.871 1.00 . A A . 46 VAL HG21 1 1 20 12775 1 1 46 VAL HG22 H 5.857 -3.599 13.194 1.00 . A A . 46 VAL HG22 1 1 20 12776 1 1 46 VAL HG23 H 4.825 -3.053 14.516 1.00 . A A . 46 VAL HG23 1 1 20 12777 1 1 46 VAL N N 5.254 -0.894 11.613 1.00 . A A . 46 VAL N 1 1 20 12778 1 1 46 VAL O O 8.731 -0.608 12.229 1.00 . A A . 46 VAL O 1 1 20 12779 1 1 46 VAL OXT O 7.595 -1.905 10.869 1.00 . A A . 46 VAL OXT 1 1 20 12780 2 2 1 ZN ZN ZN -0.298 -0.044 -0.287 1.00 . B A . 47 ZN ZN 1 1 stop_ save_
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