NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
609158 | 5kk9 | 30123 | cing | 4-filtered-FRED | STAR | entry | full | 177 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5kk9 # This FRED archive file contains, for PDB entry <5kk9>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_5kk9 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 5kk9 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2591.97 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 $Gap_junction_beta_1_protein A . 1 1 stop_ save_ save_Gap_junction_beta_1_protein _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Gap junction beta 1 protein" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code XMNWTGLYTLLSRVNRHSTAIGR _Entity.Number_of_monomers 23 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 ACE $ACE 1 1 2 MET . 1 1 3 ASN . 1 1 4 TRP . 1 1 5 THR . 1 1 6 GLY . 1 1 7 LEU . 1 1 8 TYR . 1 1 9 THR . 1 1 10 LEU . 1 1 11 LEU . 1 1 12 SER . 1 1 13 ARG . 1 1 14 VAL . 1 1 15 ASN . 1 1 16 ARG . 1 1 17 HIS . 1 1 18 SER . 1 1 19 THR . 1 1 20 ALA . 1 1 21 ILE . 1 1 22 GLY . 1 1 23 ARG . 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 ACE 1 1 1 1 MET 2 2 1 1 ASN 3 3 1 1 TRP 4 4 1 1 THR 5 5 1 1 GLY 6 6 1 1 LEU 7 7 1 1 TYR 8 8 1 1 THR 9 9 1 1 LEU 10 10 1 1 LEU 11 11 1 1 SER 12 12 1 1 ARG 13 13 1 1 VAL 14 14 1 1 ASN 15 15 1 1 ARG 16 16 1 1 HIS 17 17 1 1 SER 18 18 1 1 THR 19 19 1 1 ALA 20 20 1 1 ILE 21 21 1 1 GLY 22 22 1 1 ARG 23 23 1 1 stop_ save_ save_ACE _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID ACE _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 2 MET HA . 1 . HA 1 1 1 1 2 1 1 2 MET QB . 1 . HB# 1 1 2 1 1 1 1 2 MET HA . 1 . HA 1 1 2 1 2 1 1 2 MET QG . 1 . HG# 1 1 3 1 1 1 1 2 MET HA . 1 . HA 1 1 3 1 2 1 1 3 ASN H . 2 . HN 1 1 4 1 1 1 1 2 MET QB . 1 . HB# 1 1 4 1 2 1 1 3 ASN H . 2 . HN 1 1 5 1 1 1 1 2 MET QB . 1 . HB# 1 1 5 1 2 1 1 4 TRP HD1 . 3 . HD1 1 1 6 1 1 1 1 2 MET QB . 1 . HB# 1 1 6 1 2 1 1 4 TRP HZ2 . 3 . HZ2 1 1 7 1 1 1 1 2 MET QG . 1 . HG# 1 1 7 1 2 1 1 4 TRP HZ2 . 3 . HZ2 1 1 8 1 1 1 1 3 ASN H . 2 . HN 1 1 8 1 2 1 1 3 ASN QB . 2 . HB# 1 1 9 1 1 1 1 3 ASN HA . 2 . HA 1 1 9 1 2 1 1 3 ASN QB . 2 . HB# 1 1 10 1 1 1 1 3 ASN QB . 2 . HB# 1 1 10 1 2 1 1 3 ASN QD . 2 . HD2# 1 1 11 1 1 1 1 3 ASN QB . 2 . HB# 1 1 11 1 2 1 1 4 TRP H . 3 . HN 1 1 12 1 1 1 1 3 ASN QD . 2 . HD2# 1 1 12 1 2 1 1 6 GLY QA . 5 . HA# 1 1 13 1 1 1 1 4 TRP H . 3 . HN 1 1 13 1 2 1 1 4 TRP HA . 3 . HA 1 1 14 1 1 1 1 4 TRP H . 3 . HN 1 1 14 1 2 1 1 4 TRP QB . 3 . HB# 1 1 15 1 1 1 1 4 TRP H . 3 . HN 1 1 15 1 2 1 1 4 TRP HD1 . 3 . HD1 1 1 16 1 1 1 1 4 TRP H . 3 . HN 1 1 16 1 2 1 1 4 TRP HE3 . 3 . HE3 1 1 17 1 1 1 1 4 TRP H . 3 . HN 1 1 17 1 2 1 1 5 THR H . 4 . HN 1 1 18 1 1 1 1 4 TRP HA . 3 . HA 1 1 18 1 2 1 1 4 TRP HD1 . 3 . HD1 1 1 19 1 1 1 1 4 TRP HA . 3 . HA 1 1 19 1 2 1 1 4 TRP HE3 . 3 . HE3 1 1 20 1 1 1 1 4 TRP HA . 3 . HA 1 1 20 1 2 1 1 5 THR H . 4 . HN 1 1 21 1 1 1 1 4 TRP HA . 3 . HA 1 1 21 1 2 1 1 7 LEU H . 6 . HN 1 1 22 1 1 1 1 4 TRP HA . 3 . HA 1 1 22 1 2 1 1 7 LEU QB . 6 . HB# 1 1 23 1 1 1 1 4 TRP HA . 3 . HA 1 1 23 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1 24 1 1 1 1 4 TRP QB . 3 . HB# 1 1 24 1 2 1 1 4 TRP HD1 . 3 . HD1 1 1 25 1 1 1 1 4 TRP QB . 3 . HB# 1 1 25 1 2 1 1 4 TRP HE3 . 3 . HE3 1 1 26 1 1 1 1 4 TRP QB . 3 . HB# 1 1 26 1 2 1 1 5 THR H . 4 . HN 1 1 27 1 1 1 1 4 TRP QB . 3 . HB# 1 1 27 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1 28 1 1 1 1 4 TRP QB . 3 . HB# 1 1 28 1 2 1 1 8 TYR HD1 . 7 . HD1 1 1 29 1 1 1 1 4 TRP HD1 . 3 . HD1 1 1 29 1 2 1 1 5 THR H . 4 . HN 1 1 30 1 1 1 1 4 TRP HD1 . 3 . HD1 1 1 30 1 2 1 1 5 THR HA . 4 . HA 1 1 31 1 1 1 1 4 TRP HD1 . 3 . HD1 1 1 31 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1 32 1 1 1 1 4 TRP HE3 . 3 . HE3 1 1 32 1 2 1 1 5 THR HA . 4 . HA 1 1 33 1 1 1 1 4 TRP HE3 . 3 . HE3 1 1 33 1 2 1 1 5 THR HG1 . 4 . HG1 1 1 34 1 1 1 1 4 TRP HE3 . 3 . HE3 1 1 34 1 2 1 1 7 LEU QB . 6 . HB# 1 1 35 1 1 1 1 4 TRP HE3 . 3 . HE3 1 1 35 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1 36 1 1 1 1 4 TRP HE3 . 3 . HE3 1 1 36 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1 37 1 1 1 1 4 TRP HH2 . 3 . HH2 1 1 37 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1 38 1 1 1 1 4 TRP HH2 . 3 . HH2 1 1 38 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1 39 1 1 1 1 4 TRP HZ2 . 3 . HZ2 1 1 39 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1 40 1 1 1 1 4 TRP HZ2 . 3 . HZ2 1 1 40 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1 41 1 1 1 1 4 TRP HZ3 . 3 . HZ3 1 1 41 1 2 1 1 5 THR HA . 4 . HA 1 1 42 1 1 1 1 4 TRP HZ3 . 3 . HZ3 1 1 42 1 2 1 1 5 THR HG1 . 4 . HG1 1 1 43 1 1 1 1 4 TRP HZ3 . 3 . HZ3 1 1 43 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1 44 1 1 1 1 4 TRP HZ3 . 3 . HZ3 1 1 44 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1 45 1 1 1 1 5 THR H . 4 . HN 1 1 45 1 2 1 1 5 THR HA . 4 . HA 1 1 46 1 1 1 1 5 THR H . 4 . HN 1 1 46 1 2 1 1 5 THR HG1 . 4 . HG1 1 1 47 1 1 1 1 5 THR H . 4 . HN 1 1 47 1 2 1 1 6 GLY H . 5 . HN 1 1 48 1 1 1 1 5 THR HA . 4 . HA 1 1 48 1 2 1 1 5 THR HG1 . 4 . HG1 1 1 49 1 1 1 1 5 THR HA . 4 . HA 1 1 49 1 2 1 1 6 GLY H . 5 . HN 1 1 50 1 1 1 1 5 THR HB . 4 . HB 1 1 50 1 2 1 1 8 TYR QE . 7 . HE1 1 1 51 1 1 1 1 5 THR HG1 . 4 . HG1 1 1 51 1 2 1 1 6 GLY H . 5 . HN 1 1 52 1 1 1 1 6 GLY H . 5 . HN 1 1 52 1 2 1 1 6 GLY QA . 5 . HA# 1 1 53 1 1 1 1 6 GLY H . 5 . HN 1 1 53 1 2 1 1 7 LEU H . 6 . HN 1 1 54 1 1 1 1 6 GLY QA . 5 . HA# 1 1 54 1 2 1 1 7 LEU H . 6 . HN 1 1 55 1 1 1 1 7 LEU H . 6 . HN 1 1 55 1 2 1 1 7 LEU HA . 6 . HA 1 1 56 1 1 1 1 7 LEU H . 6 . HN 1 1 56 1 2 1 1 7 LEU QB . 6 . HB# 1 1 57 1 1 1 1 7 LEU H . 6 . HN 1 1 57 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1 58 1 1 1 1 7 LEU H . 6 . HN 1 1 58 1 2 1 1 7 LEU MD2 . 6 . HD2# 1 1 59 1 1 1 1 7 LEU H . 6 . HN 1 1 59 1 2 1 1 8 TYR H . 7 . HN 1 1 60 1 1 1 1 7 LEU H . 6 . HN 1 1 60 1 2 1 1 14 VAL QG . 13 . HG1# 1 1 61 1 1 1 1 7 LEU HA . 6 . HA 1 1 61 1 2 1 1 7 LEU QB . 6 . HB# 1 1 62 1 1 1 1 7 LEU HA . 6 . HA 1 1 62 1 2 1 1 7 LEU MD1 . 6 . HD1# 1 1 63 1 1 1 1 7 LEU HA . 6 . HA 1 1 63 1 2 1 1 8 TYR H . 7 . HN 1 1 64 1 1 1 1 7 LEU QB . 6 . HB# 1 1 64 1 2 1 1 8 TYR H . 7 . HN 1 1 65 1 1 1 1 7 LEU QB . 6 . HB# 1 1 65 1 2 1 1 11 LEU H . 10 . HN 1 1 66 1 1 1 1 7 LEU MD1 . 6 . HD1# 1 1 66 1 2 1 1 8 TYR H . 7 . HN 1 1 67 1 1 1 1 7 LEU MD1 . 6 . HD1# 1 1 67 1 2 1 1 8 TYR QE . 7 . HE1 1 1 68 1 1 1 1 7 LEU MD2 . 6 . HD2# 1 1 68 1 2 1 1 8 TYR H . 7 . HN 1 1 69 1 1 1 1 7 LEU MD2 . 6 . HD2# 1 1 69 1 2 1 1 8 TYR QE . 7 . HE1 1 1 70 1 1 1 1 7 LEU HG . 6 . HG 1 1 70 1 2 1 1 8 TYR HD1 . 7 . HD1 1 1 71 1 1 1 1 8 TYR H . 7 . HN 1 1 71 1 2 1 1 8 TYR HA . 7 . HA 1 1 72 1 1 1 1 8 TYR H . 7 . HN 1 1 72 1 2 1 1 8 TYR QB . 7 . HB# 1 1 73 1 1 1 1 8 TYR H . 7 . HN 1 1 73 1 2 1 1 8 TYR HD1 . 7 . HD1 1 1 74 1 1 1 1 8 TYR H . 7 . HN 1 1 74 1 2 1 1 9 THR H . 8 . HN 1 1 75 1 1 1 1 8 TYR H . 7 . HN 1 1 75 1 2 1 1 9 THR HG1 . 8 . HG1 1 1 76 1 1 1 1 8 TYR H . 7 . HN 1 1 76 1 2 1 1 11 LEU QD . 10 . HD2# 1 1 77 1 1 1 1 8 TYR HA . 7 . HA 1 1 77 1 2 1 1 8 TYR HD1 . 7 . HD1 1 1 78 1 1 1 1 8 TYR HA . 7 . HA 1 1 78 1 2 1 1 8 TYR QE . 7 . HE1 1 1 79 1 1 1 1 8 TYR HA . 7 . HA 1 1 79 1 2 1 1 9 THR H . 8 . HN 1 1 80 1 1 1 1 8 TYR HA . 7 . HA 1 1 80 1 2 1 1 11 LEU H . 10 . HN 1 1 81 1 1 1 1 8 TYR HA . 7 . HA 1 1 81 1 2 1 1 11 LEU HG . 10 . HG 1 1 82 1 1 1 1 8 TYR QB . 7 . HB# 1 1 82 1 2 1 1 8 TYR HD1 . 7 . HD1 1 1 83 1 1 1 1 8 TYR QB . 7 . HB# 1 1 83 1 2 1 1 9 THR H . 8 . HN 1 1 84 1 1 1 1 8 TYR QB . 7 . HB# 1 1 84 1 2 1 1 9 THR HA . 8 . HA 1 1 85 1 1 1 1 8 TYR HD1 . 7 . HD1 1 1 85 1 2 1 1 9 THR H . 8 . HN 1 1 86 1 1 1 1 8 TYR HD1 . 7 . HD1 1 1 86 1 2 1 1 9 THR HG1 . 8 . HG1 1 1 87 1 1 1 1 8 TYR QE . 7 . HE1 1 1 87 1 2 1 1 9 THR HG1 . 8 . HG1 1 1 88 1 1 1 1 8 TYR QE . 7 . HE1 1 1 88 1 2 1 1 10 LEU QB . 9 . HB# 1 1 89 1 1 1 1 8 TYR QE . 7 . HE1 1 1 89 1 2 1 1 11 LEU QD . 10 . HD2# 1 1 90 1 1 1 1 9 THR H . 8 . HN 1 1 90 1 2 1 1 9 THR HA . 8 . HA 1 1 91 1 1 1 1 9 THR H . 8 . HN 1 1 91 1 2 1 1 9 THR HG1 . 8 . HG1 1 1 92 1 1 1 1 9 THR H . 8 . HN 1 1 92 1 2 1 1 10 LEU H . 9 . HN 1 1 93 1 1 1 1 9 THR HA . 8 . HA 1 1 93 1 2 1 1 10 LEU H . 9 . HN 1 1 94 1 1 1 1 9 THR HB . 8 . HB 1 1 94 1 2 1 1 9 THR HG1 . 8 . HG1 1 1 95 1 1 1 1 9 THR HB . 8 . HB 1 1 95 1 2 1 1 10 LEU QD . 9 . HD2# 1 1 96 1 1 1 1 9 THR HG1 . 8 . HG1 1 1 96 1 2 1 1 10 LEU H . 9 . HN 1 1 97 1 1 1 1 9 THR HG1 . 8 . HG1 1 1 97 1 2 1 1 11 LEU H . 10 . HN 1 1 98 1 1 1 1 9 THR HG1 . 8 . HG1 1 1 98 1 2 1 1 13 ARG QD . 12 . HD# 1 1 99 1 1 1 1 10 LEU H . 9 . HN 1 1 99 1 2 1 1 10 LEU QB . 9 . HB# 1 1 100 1 1 1 1 10 LEU H . 9 . HN 1 1 100 1 2 1 1 10 LEU QD . 9 . HD1# 1 1 101 1 1 1 1 10 LEU HA . 9 . HA 1 1 101 1 2 1 1 10 LEU QB . 9 . HB# 1 1 102 1 1 1 1 10 LEU HA . 9 . HA 1 1 102 1 2 1 1 10 LEU QD . 9 . HD1# 1 1 103 1 1 1 1 10 LEU HA . 9 . HA 1 1 103 1 2 1 1 11 LEU H . 10 . HN 1 1 104 1 1 1 1 10 LEU QB . 9 . HB# 1 1 104 1 2 1 1 10 LEU QD . 9 . HD1# 1 1 105 1 1 1 1 10 LEU QB . 9 . HB# 1 1 105 1 2 1 1 14 VAL H . 13 . HN 1 1 106 1 1 1 1 11 LEU H . 10 . HN 1 1 106 1 2 1 1 11 LEU QB . 10 . HB# 1 1 107 1 1 1 1 11 LEU H . 10 . HN 1 1 107 1 2 1 1 11 LEU QD . 10 . HD2# 1 1 108 1 1 1 1 11 LEU H . 10 . HN 1 1 108 1 2 1 1 11 LEU HG . 10 . HG 1 1 109 1 1 1 1 11 LEU HA . 10 . HA 1 1 109 1 2 1 1 11 LEU QB . 10 . HB# 1 1 110 1 1 1 1 11 LEU HA . 10 . HA 1 1 110 1 2 1 1 11 LEU QD . 10 . HD1# 1 1 111 1 1 1 1 11 LEU HA . 10 . HA 1 1 111 1 2 1 1 12 SER H . 11 . HN 1 1 112 1 1 1 1 11 LEU HA . 10 . HA 1 1 112 1 2 1 1 14 VAL H . 13 . HN 1 1 113 1 1 1 1 11 LEU QB . 10 . HB# 1 1 113 1 2 1 1 12 SER H . 11 . HN 1 1 114 1 1 1 1 11 LEU QB . 10 . HB# 1 1 114 1 2 1 1 14 VAL H . 13 . HN 1 1 115 1 1 1 1 11 LEU QD . 10 . HD2# 1 1 115 1 2 1 1 12 SER H . 11 . HN 1 1 116 1 1 1 1 11 LEU QD . 10 . HD2# 1 1 116 1 2 1 1 13 ARG QB . 12 . HB# 1 1 117 1 1 1 1 12 SER H . 11 . HN 1 1 117 1 2 1 1 12 SER HA . 11 . HA 1 1 118 1 1 1 1 12 SER H . 11 . HN 1 1 118 1 2 1 1 12 SER QB . 11 . HB# 1 1 119 1 1 1 1 12 SER QB . 11 . HB# 1 1 119 1 2 1 1 13 ARG H . 12 . HN 1 1 120 1 1 1 1 13 ARG H . 12 . HN 1 1 120 1 2 1 1 13 ARG QB . 12 . HB# 1 1 121 1 1 1 1 13 ARG H . 12 . HN 1 1 121 1 2 1 1 14 VAL H . 13 . HN 1 1 122 1 1 1 1 13 ARG HA . 12 . HA 1 1 122 1 2 1 1 13 ARG QB . 12 . HB# 1 1 123 1 1 1 1 13 ARG HA . 12 . HA 1 1 123 1 2 1 1 13 ARG QD . 12 . HD# 1 1 124 1 1 1 1 13 ARG HA . 12 . HA 1 1 124 1 2 1 1 13 ARG QG . 12 . HG# 1 1 125 1 1 1 1 13 ARG HA . 12 . HA 1 1 125 1 2 1 1 14 VAL H . 13 . HN 1 1 126 1 1 1 1 13 ARG HA . 12 . HA 1 1 126 1 2 1 1 14 VAL QG . 13 . HG2# 1 1 127 1 1 1 1 13 ARG QB . 12 . HB# 1 1 127 1 2 1 1 14 VAL H . 13 . HN 1 1 128 1 1 1 1 14 VAL H . 13 . HN 1 1 128 1 2 1 1 14 VAL HA . 13 . HA 1 1 129 1 1 1 1 14 VAL H . 13 . HN 1 1 129 1 2 1 1 14 VAL HB . 13 . HB 1 1 130 1 1 1 1 14 VAL H . 13 . HN 1 1 130 1 2 1 1 14 VAL QG . 13 . HG1# 1 1 131 1 1 1 1 14 VAL H . 13 . HN 1 1 131 1 2 1 1 15 ASN H . 14 . HN 1 1 132 1 1 1 1 14 VAL HA . 13 . HA 1 1 132 1 2 1 1 14 VAL HB . 13 . HB 1 1 133 1 1 1 1 14 VAL HA . 13 . HA 1 1 133 1 2 1 1 14 VAL QG . 13 . HG1# 1 1 134 1 1 1 1 14 VAL HA . 13 . HA 1 1 134 1 2 1 1 15 ASN H . 14 . HN 1 1 135 1 1 1 1 14 VAL HB . 13 . HB 1 1 135 1 2 1 1 15 ASN H . 14 . HN 1 1 136 1 1 1 1 14 VAL HB . 13 . HB 1 1 136 1 2 1 1 16 ARG HA . 15 . HA 1 1 137 1 1 1 1 14 VAL QG . 13 . HG2# 1 1 137 1 2 1 1 15 ASN H . 14 . HN 1 1 138 1 1 1 1 14 VAL QG . 13 . HG1# 1 1 138 1 2 1 1 15 ASN HA . 14 . HA 1 1 139 1 1 1 1 14 VAL QG . 13 . HG1# 1 1 139 1 2 1 1 15 ASN QD . 14 . HD2# 1 1 140 1 1 1 1 15 ASN H . 14 . HN 1 1 140 1 2 1 1 15 ASN HA . 14 . HA 1 1 141 1 1 1 1 15 ASN H . 14 . HN 1 1 141 1 2 1 1 15 ASN QB . 14 . HB# 1 1 142 1 1 1 1 15 ASN HA . 14 . HA 1 1 142 1 2 1 1 15 ASN QB . 14 . HB# 1 1 143 1 1 1 1 15 ASN HA . 14 . HA 1 1 143 1 2 1 1 15 ASN QD . 14 . HD2# 1 1 144 1 1 1 1 16 ARG H . 15 . HN 1 1 144 1 2 1 1 16 ARG QB . 15 . HB# 1 1 145 1 1 1 1 16 ARG H . 15 . HN 1 1 145 1 2 1 1 16 ARG QG . 15 . HG# 1 1 146 1 1 1 1 16 ARG HA . 15 . HA 1 1 146 1 2 1 1 16 ARG QB . 15 . HB# 1 1 147 1 1 1 1 16 ARG HA . 15 . HA 1 1 147 1 2 1 1 16 ARG QD . 15 . HD# 1 1 148 1 1 1 1 16 ARG QG . 15 . HG# 1 1 148 1 2 1 1 17 HIS HD1 . 16 . HD1 1 1 149 1 1 1 1 17 HIS H . 16 . HN 1 1 149 1 2 1 1 17 HIS HA . 16 . HA 1 1 150 1 1 1 1 17 HIS HA . 16 . HA 1 1 150 1 2 1 1 17 HIS HD1 . 16 . HD1 1 1 151 1 1 1 1 17 HIS HA . 16 . HA 1 1 151 1 2 1 1 18 SER H . 17 . HN 1 1 152 1 1 1 1 18 SER H . 17 . HN 1 1 152 1 2 1 1 18 SER HA . 17 . HA 1 1 153 1 1 1 1 18 SER H . 17 . HN 1 1 153 1 2 1 1 18 SER QB . 17 . HB# 1 1 154 1 1 1 1 19 THR H . 18 . HN 1 1 154 1 2 1 1 19 THR HG1 . 18 . HG1 1 1 155 1 1 1 1 19 THR HA . 18 . HA 1 1 155 1 2 1 1 19 THR HG1 . 18 . HG1 1 1 156 1 1 1 1 19 THR HB . 18 . HB 1 1 156 1 2 1 1 19 THR HG1 . 18 . HG1 1 1 157 1 1 1 1 20 ALA H . 19 . HN 1 1 157 1 2 1 1 20 ALA HA . 19 . HA 1 1 158 1 1 1 1 20 ALA H . 19 . HN 1 1 158 1 2 1 1 20 ALA MB . 19 . HB# 1 1 159 1 1 1 1 20 ALA H . 19 . HN 1 1 159 1 2 1 1 21 ILE H . 20 . HN 1 1 160 1 1 1 1 20 ALA HA . 19 . HA 1 1 160 1 2 1 1 20 ALA MB . 19 . HB# 1 1 161 1 1 1 1 20 ALA HA . 19 . HA 1 1 161 1 2 1 1 21 ILE H . 20 . HN 1 1 162 1 1 1 1 20 ALA MB . 19 . HB# 1 1 162 1 2 1 1 21 ILE H . 20 . HN 1 1 163 1 1 1 1 21 ILE H . 20 . HN 1 1 163 1 2 1 1 21 ILE HA . 20 . HA 1 1 164 1 1 1 1 21 ILE H . 20 . HN 1 1 164 1 2 1 1 21 ILE HB . 20 . HB 1 1 165 1 1 1 1 21 ILE H . 20 . HN 1 1 165 1 2 1 1 21 ILE QG . 20 . HG1# 1 1 166 1 1 1 1 21 ILE H . 20 . HN 1 1 166 1 2 1 1 21 ILE MG . 20 . HG2# 1 1 167 1 1 1 1 21 ILE H . 20 . HN 1 1 167 1 2 1 1 22 GLY H . 21 . HN 1 1 168 1 1 1 1 21 ILE HA . 20 . HA 1 1 168 1 2 1 1 21 ILE HB . 20 . HB 1 1 169 1 1 1 1 21 ILE HA . 20 . HA 1 1 169 1 2 1 1 21 ILE MG . 20 . HG2# 1 1 170 1 1 1 1 21 ILE HA . 20 . HA 1 1 170 1 2 1 1 22 GLY H . 21 . HN 1 1 171 1 1 1 1 21 ILE HB . 20 . HB 1 1 171 1 2 1 1 22 GLY H . 21 . HN 1 1 172 1 1 1 1 21 ILE MG . 20 . HG2# 1 1 172 1 2 1 1 22 GLY H . 21 . HN 1 1 173 1 1 1 1 22 GLY H . 21 . HN 1 1 173 1 2 1 1 22 GLY QA . 21 . HA# 1 1 174 1 1 1 1 22 GLY H . 21 . HN 1 1 174 1 2 1 1 23 ARG H . 22 . HN 1 1 175 1 1 1 1 22 GLY QA . 21 . HA# 1 1 175 1 2 1 1 23 ARG H . 22 . HN 1 1 176 1 1 1 1 23 ARG H . 22 . HN 1 1 176 1 2 1 1 23 ARG HA . 22 . HA 1 1 177 1 1 1 1 23 ARG H . 22 . HN 1 1 177 1 2 1 1 23 ARG QB . 22 . HB# 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.4 1.8 3.0 1 1 2 1 . . . . . 3.4 1.8 5.0 1 1 3 1 . . . . . 2.4 1.8 3.0 1 1 4 1 . . . . . 3.4 1.8 5.0 1 1 5 1 . . . . . 3.4 1.8 5.0 1 1 6 1 . . . . . 3.4 1.8 5.0 1 1 7 1 . . . . . 3.4 1.8 5.0 1 1 8 1 . . . . . 3.4 1.8 5.0 1 1 9 1 . . . . . 2.4 1.8 3.0 1 1 10 1 . . . . . 2.75 1.8 3.7 1 1 11 1 . . . . . 2.75 1.8 3.7 1 1 12 1 . . . . . 3.4 1.8 5.0 1 1 13 1 . . . . . 2.4 1.8 3.0 1 1 14 1 . . . . . 2.75 1.8 3.7 1 1 15 1 . . . . . 2.75 1.8 3.7 1 1 16 1 . . . . . 3.4 1.8 5.0 1 1 17 1 . . . . . 2.75 1.8 3.7 1 1 18 1 . . . . . 2.75 1.8 4.2 1 1 19 1 . . . . . 2.75 1.8 4.2 1 1 20 1 . . . . . 2.75 1.8 3.7 1 1 21 1 . . . . . 3.4 1.8 5.0 1 1 22 1 . . . . . 3.4 1.8 5.0 1 1 23 1 . . . . . 3.4 1.8 5.0 1 1 24 1 . . . . . 2.75 1.8 3.0 1 1 25 1 . . . . . 2.75 1.8 3.7 1 1 26 1 . . . . . 3.4 1.8 5.0 1 1 27 1 . . . . . 3.4 1.8 5.0 1 1 28 1 . . . . . 3.4 1.8 5.0 1 1 29 1 . . . . . 3.4 1.8 5.0 1 1 30 1 . . . . . 3.4 1.8 5.5 1 1 31 1 . . . . . 3.4 1.8 5.0 1 1 32 1 . . . . . 3.4 1.8 5.0 1 1 33 1 . . . . . 3.4 1.8 5.0 1 1 34 1 . . . . . 3.4 1.8 5.0 1 1 35 1 . . . . . 2.75 1.8 3.7 1 1 36 1 . . . . . 3.4 1.8 5.0 1 1 37 1 . . . . . 3.4 1.8 5.0 1 1 38 1 . . . . . 3.4 1.8 5.0 1 1 39 1 . . . . . 3.4 1.8 5.0 1 1 40 1 . . . . . 3.4 1.8 5.0 1 1 41 1 . . . . . 2.75 1.8 3.7 1 1 42 1 . . . . . 3.4 1.8 5.0 1 1 43 1 . . . . . 2.75 1.8 3.7 1 1 44 1 . . . . . 3.4 1.8 5.0 1 1 45 1 . . . . . 2.4 1.8 3.0 1 1 46 1 . . . . . 2.75 1.8 3.7 1 1 47 1 . . . . . 3.4 1.8 5.0 1 1 48 1 . . . . . 2.4 1.8 3.0 1 1 49 1 . . . . . 2.75 1.8 3.7 1 1 50 1 . . . . . 3.4 1.8 5.0 1 1 51 1 . . . . . 3.4 1.8 5.0 1 1 52 1 . . . . . 2.4 1.8 3.0 1 1 53 1 . . . . . 2.75 1.8 3.7 1 1 54 1 . . . . . 2.4 1.8 3.0 1 1 55 1 . . . . . 2.4 1.8 3.0 1 1 56 1 . . . . . 2.4 1.8 3.0 1 1 57 1 . . . . . 3.4 1.8 5.0 1 1 58 1 . . . . . 3.4 1.8 5.0 1 1 59 1 . . . . . 2.4 1.8 3.0 1 1 60 1 . . . . . 3.4 1.8 5.0 1 1 61 1 . . . . . 2.4 1.8 3.0 1 1 62 1 . . . . . 2.75 1.8 3.7 1 1 63 1 . . . . . 2.4 1.8 3.0 1 1 64 1 . . . . . 2.75 1.8 3.7 1 1 65 1 . . . . . 3.4 1.8 5.0 1 1 66 1 . . . . . 3.4 1.8 5.0 1 1 67 1 . . . . . 3.4 1.8 5.0 1 1 68 1 . . . . . 3.4 1.8 5.0 1 1 69 1 . . . . . 3.4 1.8 5.0 1 1 70 1 . . . . . 3.4 1.8 5.0 1 1 71 1 . . . . . 2.75 1.8 3.7 1 1 72 1 . . . . . 2.4 1.8 3.0 1 1 73 1 . . . . . 2.75 1.8 3.7 1 1 74 1 . . . . . 2.75 1.8 3.7 1 1 75 1 . . . . . 3.4 1.8 5.0 1 1 76 1 . . . . . 3.4 1.8 5.0 1 1 77 1 . . . . . 2.75 1.8 3.7 1 1 78 1 . . . . . 3.4 1.8 5.5 1 1 79 1 . . . . . 2.75 1.8 3.7 1 1 80 1 . . . . . 3.4 1.8 5.0 1 1 81 1 . . . . . 3.4 1.8 5.0 1 1 82 1 . . . . . 2.4 1.8 3.0 1 1 83 1 . . . . . 3.4 1.8 3.7 1 1 84 1 . . . . . 3.4 1.8 5.0 1 1 85 1 . . . . . 3.4 1.8 5.0 1 1 86 1 . . . . . 3.4 1.8 5.0 1 1 87 1 . . . . . 3.4 1.8 5.0 1 1 88 1 . . . . . 3.4 1.8 5.0 1 1 89 1 . . . . . 3.4 1.8 5.0 1 1 90 1 . . . . . 2.4 1.8 3.0 1 1 91 1 . . . . . 2.75 1.8 3.7 1 1 92 1 . . . . . 2.75 1.8 3.7 1 1 93 1 . . . . . 2.4 1.8 3.0 1 1 94 1 . . . . . 2.4 1.8 3.0 1 1 95 1 . . . . . 3.4 1.8 5.0 1 1 96 1 . . . . . 2.75 1.8 3.7 1 1 97 1 . . . . . 3.4 1.8 5.0 1 1 98 1 . . . . . 3.4 1.8 5.0 1 1 99 1 . . . . . 2.4 1.8 3.0 1 1 100 1 . . . . . 3.4 1.8 5.0 1 1 101 1 . . . . . 2.4 1.8 3.0 1 1 102 1 . . . . . 2.4 1.8 3.0 1 1 103 1 . . . . . 2.4 1.8 3.0 1 1 104 1 . . . . . 2.4 1.8 3.0 1 1 105 1 . . . . . 3.4 1.8 5.0 1 1 106 1 . . . . . 2.75 1.8 3.7 1 1 107 1 . . . . . 2.75 1.8 3.7 1 1 108 1 . . . . . 2.4 1.8 3.0 1 1 109 1 . . . . . 2.4 1.8 3.0 1 1 110 1 . . . . . 2.4 1.8 4.0 1 1 111 1 . . . . . 2.4 1.8 3.5 1 1 112 1 . . . . . 3.4 1.8 5.0 1 1 113 1 . . . . . 3.4 1.8 5.0 1 1 114 1 . . . . . 3.4 1.8 5.0 1 1 115 1 . . . . . 3.4 1.8 5.0 1 1 116 1 . . . . . 3.4 1.8 5.0 1 1 117 1 . . . . . 2.4 1.8 3.0 1 1 118 1 . . . . . 2.4 1.8 3.0 1 1 119 1 . . . . . 3.4 1.8 5.0 1 1 120 1 . . . . . 3.4 1.8 5.0 1 1 121 1 . . . . . 2.75 1.8 3.7 1 1 122 1 . . . . . 2.4 1.8 3.0 1 1 123 1 . . . . . 3.4 1.8 5.0 1 1 124 1 . . . . . 2.75 1.8 3.7 1 1 125 1 . . . . . 2.4 1.8 3.0 1 1 126 1 . . . . . 3.4 1.8 5.0 1 1 127 1 . . . . . 3.4 1.8 5.0 1 1 128 1 . . . . . 2.4 1.8 3.0 1 1 129 1 . . . . . 2.4 1.8 3.0 1 1 130 1 . . . . . 2.75 1.8 3.0 1 1 131 1 . . . . . 2.75 1.8 3.7 1 1 132 1 . . . . . 2.4 1.8 3.0 1 1 133 1 . . . . . 2.4 1.8 3.0 1 1 134 1 . . . . . 2.4 1.8 3.0 1 1 135 1 . . . . . 3.4 1.8 5.0 1 1 136 1 . . . . . 3.4 1.8 5.0 1 1 137 1 . . . . . 3.4 1.8 5.0 1 1 138 1 . . . . . 3.4 1.8 5.0 1 1 139 1 . . . . . 3.4 1.8 5.0 1 1 140 1 . . . . . 2.75 1.8 3.7 1 1 141 1 . . . . . 2.75 1.8 3.7 1 1 142 1 . . . . . 2.4 1.8 3.0 1 1 143 1 . . . . . 3.4 1.8 5.0 1 1 144 1 . . . . . 3.4 1.8 5.0 1 1 145 1 . . . . . 3.4 1.8 5.0 1 1 146 1 . . . . . 2.4 1.8 3.0 1 1 147 1 . . . . . 3.4 1.8 5.0 1 1 148 1 . . . . . 3.4 1.8 5.0 1 1 149 1 . . . . . 2.75 1.8 3.7 1 1 150 1 . . . . . 3.4 1.8 5.0 1 1 151 1 . . . . . 2.75 1.8 3.7 1 1 152 1 . . . . . 2.4 1.8 3.0 1 1 153 1 . . . . . 3.4 1.8 5.0 1 1 154 1 . . . . . 3.4 1.8 5.0 1 1 155 1 . . . . . 2.4 1.8 3.0 1 1 156 1 . . . . . 2.4 1.8 3.0 1 1 157 1 . . . . . 2.4 1.8 3.0 1 1 158 1 . . . . . 2.75 1.8 3.7 1 1 159 1 . . . . . 3.4 1.8 5.0 1 1 160 1 . . . . . 2.4 1.8 3.0 1 1 161 1 . . . . . 2.4 1.8 3.0 1 1 162 1 . . . . . 3.4 1.8 5.0 1 1 163 1 . . . . . 2.4 1.8 3.0 1 1 164 1 . . . . . 2.75 1.8 3.7 1 1 165 1 . . . . . 3.4 1.8 5.0 1 1 166 1 . . . . . 3.4 1.8 5.0 1 1 167 1 . . . . . 3.4 1.8 5.0 1 1 168 1 . . . . . 2.75 1.8 3.7 1 1 169 1 . . . . . 2.75 1.8 3.7 1 1 170 1 . . . . . 2.4 1.8 3.0 1 1 171 1 . . . . . 3.4 1.8 5.0 1 1 172 1 . . . . . 3.4 1.8 5.0 1 1 173 1 . . . . . 2.4 1.8 3.0 1 1 174 1 . . . . . 3.4 1.8 5.0 1 1 175 1 . . . . . 2.4 1.8 3.0 1 1 176 1 . . . . . 2.4 1.8 3.0 1 1 177 1 . . . . . 3.4 1.8 5.0 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 ACE C C 3.822 2.650 12.172 1.00 . A A . 0 ACE C 1 1 1 2 1 1 1 ACE CH3 C 4.213 1.853 13.386 1.00 . A A . 0 ACE CH3 1 1 1 3 1 1 1 ACE H1 H 4.156 0.797 13.142 1.00 . A A . 0 ACE H1 1 1 1 4 1 1 1 ACE H2 H 3.537 2.071 14.191 1.00 . A A . 0 ACE H2 1 1 1 5 1 1 1 ACE H3 H 5.220 2.133 13.676 1.00 . A A . 0 ACE H3 1 1 1 6 1 1 1 ACE O O 2.661 2.647 11.761 1.00 . A A . 0 ACE O 1 1 1 7 1 1 2 MET C C 4.816 3.364 9.127 1.00 . A A . 1 MET C 1 1 1 8 1 1 2 MET CA C 4.548 4.157 10.402 1.00 . A A . 1 MET CA 1 1 1 9 1 1 2 MET CB C 5.420 5.417 10.430 1.00 . A A . 1 MET CB 1 1 1 10 1 1 2 MET CE C 9.476 5.983 11.246 1.00 . A A . 1 MET CE 1 1 1 11 1 1 2 MET CG C 6.876 5.147 10.775 1.00 . A A . 1 MET CG 1 1 1 12 1 1 2 MET H H 5.699 3.305 11.962 1.00 . A A . 1 MET H 1 1 1 13 1 1 2 MET HA H 3.509 4.451 10.415 1.00 . A A . 1 MET HA 1 1 1 14 1 1 2 MET HB2 H 5.387 5.885 9.456 1.00 . A A . 1 MET HB2 1 1 1 15 1 1 2 MET HB3 H 5.020 6.102 11.163 1.00 . A A . 1 MET HB3 1 1 1 16 1 1 2 MET HE1 H 9.421 5.466 12.193 1.00 . A A . 1 MET HE1 1 1 1 17 1 1 2 MET HE2 H 10.194 6.787 11.316 1.00 . A A . 1 MET HE2 1 1 1 18 1 1 2 MET HE3 H 9.785 5.291 10.476 1.00 . A A . 1 MET HE3 1 1 1 19 1 1 2 MET HG2 H 6.920 4.665 11.740 1.00 . A A . 1 MET HG2 1 1 1 20 1 1 2 MET HG3 H 7.293 4.489 10.027 1.00 . A A . 1 MET HG3 1 1 1 21 1 1 2 MET N N 4.794 3.343 11.587 1.00 . A A . 1 MET N 1 1 1 22 1 1 2 MET O O 5.952 3.287 8.658 1.00 . A A . 1 MET O 1 1 1 23 1 1 2 MET SD S 7.867 6.652 10.836 1.00 . A A . 1 MET SD 1 1 1 24 1 1 3 ASN C C 3.520 2.824 6.135 1.00 . A A . 2 ASN C 1 1 1 25 1 1 3 ASN CA C 3.899 1.989 7.345 1.00 . A A . 2 ASN CA 1 1 1 26 1 1 3 ASN CB C 3.030 0.729 7.394 1.00 . A A . 2 ASN CB 1 1 1 27 1 1 3 ASN CG C 3.353 -0.263 6.281 1.00 . A A . 2 ASN CG 1 1 1 28 1 1 3 ASN H H 2.884 2.853 8.991 1.00 . A A . 2 ASN H 1 1 1 29 1 1 3 ASN HA H 4.934 1.697 7.253 1.00 . A A . 2 ASN HA 1 1 1 30 1 1 3 ASN HB2 H 3.181 0.236 8.342 1.00 . A A . 2 ASN HB2 1 1 1 31 1 1 3 ASN HB3 H 1.993 1.015 7.304 1.00 . A A . 2 ASN HB3 1 1 1 32 1 1 3 ASN HD21 H 3.588 1.206 4.949 1.00 . A A . 2 ASN HD21 1 1 1 33 1 1 3 ASN HD22 H 3.825 -0.391 4.345 1.00 . A A . 2 ASN HD22 1 1 1 34 1 1 3 ASN N N 3.765 2.768 8.570 1.00 . A A . 2 ASN N 1 1 1 35 1 1 3 ASN ND2 N 3.615 0.236 5.070 1.00 . A A . 2 ASN ND2 1 1 1 36 1 1 3 ASN O O 2.414 3.359 6.049 1.00 . A A . 2 ASN O 1 1 1 37 1 1 3 ASN OD1 O 3.352 -1.473 6.504 1.00 . A A . 2 ASN OD1 1 1 1 38 1 1 4 TRP C C 5.280 3.284 2.947 1.00 . A A . 3 TRP C 1 1 1 39 1 1 4 TRP CA C 4.240 3.671 3.980 1.00 . A A . 3 TRP CA 1 1 1 40 1 1 4 TRP CB C 4.258 5.179 4.242 1.00 . A A . 3 TRP CB 1 1 1 41 1 1 4 TRP CD1 C 5.609 5.586 6.378 1.00 . A A . 3 TRP CD1 1 1 1 42 1 1 4 TRP CD2 C 6.596 6.306 4.515 1.00 . A A . 3 TRP CD2 1 1 1 43 1 1 4 TRP CE2 C 7.430 6.610 5.602 1.00 . A A . 3 TRP CE2 1 1 1 44 1 1 4 TRP CE3 C 7.004 6.654 3.233 1.00 . A A . 3 TRP CE3 1 1 1 45 1 1 4 TRP CG C 5.435 5.662 5.032 1.00 . A A . 3 TRP CG 1 1 1 46 1 1 4 TRP CH2 C 9.032 7.586 4.172 1.00 . A A . 3 TRP CH2 1 1 1 47 1 1 4 TRP CZ2 C 8.652 7.253 5.444 1.00 . A A . 3 TRP CZ2 1 1 1 48 1 1 4 TRP CZ3 C 8.220 7.290 3.070 1.00 . A A . 3 TRP CZ3 1 1 1 49 1 1 4 TRP H H 5.315 2.486 5.348 1.00 . A A . 3 TRP H 1 1 1 50 1 1 4 TRP HA H 3.273 3.404 3.593 1.00 . A A . 3 TRP HA 1 1 1 51 1 1 4 TRP HB2 H 4.264 5.697 3.294 1.00 . A A . 3 TRP HB2 1 1 1 52 1 1 4 TRP HB3 H 3.364 5.449 4.784 1.00 . A A . 3 TRP HB3 1 1 1 53 1 1 4 TRP HD1 H 4.903 5.140 7.051 1.00 . A A . 3 TRP HD1 1 1 1 54 1 1 4 TRP HE1 H 7.152 6.236 7.648 1.00 . A A . 3 TRP HE1 1 1 1 55 1 1 4 TRP HE3 H 6.387 6.422 2.377 1.00 . A A . 3 TRP HE3 1 1 1 56 1 1 4 TRP HH2 H 9.974 8.086 4.001 1.00 . A A . 3 TRP HH2 1 1 1 57 1 1 4 TRP HZ2 H 9.283 7.488 6.283 1.00 . A A . 3 TRP HZ2 1 1 1 58 1 1 4 TRP HZ3 H 8.553 7.569 2.081 1.00 . A A . 3 TRP HZ3 1 1 1 59 1 1 4 TRP N N 4.453 2.926 5.204 1.00 . A A . 3 TRP N 1 1 1 60 1 1 4 TRP NE1 N 6.804 6.162 6.734 1.00 . A A . 3 TRP NE1 1 1 1 61 1 1 4 TRP O O 4.960 2.605 1.972 1.00 . A A . 3 TRP O 1 1 1 62 1 1 5 THR C C 7.153 3.178 0.874 1.00 . A A . 4 THR C 1 1 1 63 1 1 5 THR CA C 7.640 3.405 2.304 1.00 . A A . 4 THR CA 1 1 1 64 1 1 5 THR CB C 8.449 2.179 2.773 1.00 . A A . 4 THR CB 1 1 1 65 1 1 5 THR CG2 C 9.807 2.126 2.086 1.00 . A A . 4 THR CG2 1 1 1 66 1 1 5 THR H H 6.707 4.154 4.034 1.00 . A A . 4 THR H 1 1 1 67 1 1 5 THR HA H 8.286 4.268 2.328 1.00 . A A . 4 THR HA 1 1 1 68 1 1 5 THR HB H 7.899 1.283 2.524 1.00 . A A . 4 THR HB 1 1 1 69 1 1 5 THR HG1 H 8.709 3.152 4.469 1.00 . A A . 4 THR HG1 1 1 1 70 1 1 5 THR HG21 H 10.356 1.267 2.441 1.00 . A A . 4 THR HG21 1 1 1 71 1 1 5 THR HG22 H 10.360 3.026 2.313 1.00 . A A . 4 THR HG22 1 1 1 72 1 1 5 THR HG23 H 9.668 2.048 1.018 1.00 . A A . 4 THR HG23 1 1 1 73 1 1 5 THR N N 6.527 3.677 3.202 1.00 . A A . 4 THR N 1 1 1 74 1 1 5 THR O O 7.635 2.288 0.172 1.00 . A A . 4 THR O 1 1 1 75 1 1 5 THR OG1 O 8.637 2.236 4.192 1.00 . A A . 4 THR OG1 1 1 1 76 1 1 6 GLY C C 4.813 5.048 -1.317 1.00 . A A . 5 GLY C 1 1 1 77 1 1 6 GLY CA C 5.636 3.849 -0.881 1.00 . A A . 5 GLY CA 1 1 1 78 1 1 6 GLY H H 5.862 4.701 1.041 1.00 . A A . 5 GLY H 1 1 1 79 1 1 6 GLY HA2 H 6.442 3.701 -1.583 1.00 . A A . 5 GLY HA2 1 1 1 80 1 1 6 GLY HA3 H 5.002 2.971 -0.886 1.00 . A A . 5 GLY HA3 1 1 1 81 1 1 6 GLY N N 6.193 3.995 0.447 1.00 . A A . 5 GLY N 1 1 1 82 1 1 6 GLY O O 3.988 4.945 -2.219 1.00 . A A . 5 GLY O 1 1 1 83 1 1 7 LEU C C 5.184 8.409 -1.729 1.00 . A A . 6 LEU C 1 1 1 84 1 1 7 LEU CA C 4.291 7.405 -1.009 1.00 . A A . 6 LEU CA 1 1 1 85 1 1 7 LEU CB C 3.726 8.044 0.256 1.00 . A A . 6 LEU CB 1 1 1 86 1 1 7 LEU CD1 C 5.702 9.247 1.249 1.00 . A A . 6 LEU CD1 1 1 1 87 1 1 7 LEU CD2 C 3.956 8.270 2.745 1.00 . A A . 6 LEU CD2 1 1 1 88 1 1 7 LEU CG C 4.703 8.114 1.432 1.00 . A A . 6 LEU CG 1 1 1 89 1 1 7 LEU H H 5.663 6.197 0.072 1.00 . A A . 6 LEU H 1 1 1 90 1 1 7 LEU HA H 3.476 7.134 -1.660 1.00 . A A . 6 LEU HA 1 1 1 91 1 1 7 LEU HB2 H 3.414 9.047 0.014 1.00 . A A . 6 LEU HB2 1 1 1 92 1 1 7 LEU HB3 H 2.861 7.478 0.564 1.00 . A A . 6 LEU HB3 1 1 1 93 1 1 7 LEU HD11 H 6.361 9.287 2.106 1.00 . A A . 6 LEU HD11 1 1 1 94 1 1 7 LEU HD12 H 5.172 10.184 1.159 1.00 . A A . 6 LEU HD12 1 1 1 95 1 1 7 LEU HD13 H 6.283 9.075 0.356 1.00 . A A . 6 LEU HD13 1 1 1 96 1 1 7 LEU HD21 H 3.406 9.199 2.738 1.00 . A A . 6 LEU HD21 1 1 1 97 1 1 7 LEU HD22 H 4.665 8.276 3.561 1.00 . A A . 6 LEU HD22 1 1 1 98 1 1 7 LEU HD23 H 3.271 7.445 2.869 1.00 . A A . 6 LEU HD23 1 1 1 99 1 1 7 LEU HG H 5.257 7.190 1.477 1.00 . A A . 6 LEU HG 1 1 1 100 1 1 7 LEU N N 5.022 6.183 -0.667 1.00 . A A . 6 LEU N 1 1 1 101 1 1 7 LEU O O 4.867 9.597 -1.797 1.00 . A A . 6 LEU O 1 1 1 102 1 1 8 TYR C C 7.797 8.156 -4.238 1.00 . A A . 7 TYR C 1 1 1 103 1 1 8 TYR CA C 7.238 8.793 -2.963 1.00 . A A . 7 TYR CA 1 1 1 104 1 1 8 TYR CB C 8.382 9.174 -2.021 1.00 . A A . 7 TYR CB 1 1 1 105 1 1 8 TYR CD1 C 8.316 7.041 -0.710 1.00 . A A . 7 TYR CD1 1 1 1 106 1 1 8 TYR CD2 C 10.430 7.782 -1.505 1.00 . A A . 7 TYR CD2 1 1 1 107 1 1 8 TYR CE1 C 8.898 5.941 -0.150 1.00 . A A . 7 TYR CE1 1 1 1 108 1 1 8 TYR CE2 C 11.032 6.673 -0.939 1.00 . A A . 7 TYR CE2 1 1 1 109 1 1 8 TYR CG C 9.060 7.981 -1.396 1.00 . A A . 7 TYR CG 1 1 1 110 1 1 8 TYR CZ C 10.259 5.753 -0.261 1.00 . A A . 7 TYR CZ 1 1 1 111 1 1 8 TYR H H 6.484 6.978 -2.184 1.00 . A A . 7 TYR H 1 1 1 112 1 1 8 TYR HA H 6.708 9.680 -3.230 1.00 . A A . 7 TYR HA 1 1 1 113 1 1 8 TYR HB2 H 9.124 9.732 -2.570 1.00 . A A . 7 TYR HB2 1 1 1 114 1 1 8 TYR HB3 H 7.989 9.784 -1.225 1.00 . A A . 7 TYR HB3 1 1 1 115 1 1 8 TYR HD1 H 7.252 7.186 -0.614 1.00 . A A . 7 TYR HD1 1 1 1 116 1 1 8 TYR HD2 H 11.028 8.508 -2.036 1.00 . A A . 7 TYR HD2 1 1 1 117 1 1 8 TYR HE1 H 8.281 5.234 0.365 1.00 . A A . 7 TYR HE1 1 1 1 118 1 1 8 TYR HE2 H 12.099 6.531 -1.029 1.00 . A A . 7 TYR HE2 1 1 1 119 1 1 8 TYR HH H 11.647 4.905 0.764 1.00 . A A . 7 TYR HH 1 1 1 120 1 1 8 TYR N N 6.292 7.928 -2.269 1.00 . A A . 7 TYR N 1 1 1 121 1 1 8 TYR O O 7.756 8.766 -5.307 1.00 . A A . 7 TYR O 1 1 1 122 1 1 8 TYR OH O 10.847 4.644 0.302 1.00 . A A . 7 TYR OH 1 1 1 123 1 1 9 THR C C 8.094 5.016 -5.672 1.00 . A A . 8 THR C 1 1 1 124 1 1 9 THR CA C 8.895 6.248 -5.282 1.00 . A A . 8 THR CA 1 1 1 125 1 1 9 THR CB C 10.339 5.806 -5.000 1.00 . A A . 8 THR CB 1 1 1 126 1 1 9 THR CG2 C 11.244 7.007 -4.769 1.00 . A A . 8 THR CG2 1 1 1 127 1 1 9 THR H H 8.312 6.490 -3.256 1.00 . A A . 8 THR H 1 1 1 128 1 1 9 THR HA H 8.906 6.937 -6.112 1.00 . A A . 8 THR HA 1 1 1 129 1 1 9 THR HB H 10.704 5.257 -5.856 1.00 . A A . 8 THR HB 1 1 1 130 1 1 9 THR HG1 H 9.576 4.391 -3.860 1.00 . A A . 8 THR HG1 1 1 1 131 1 1 9 THR HG21 H 10.814 7.641 -4.008 1.00 . A A . 8 THR HG21 1 1 1 132 1 1 9 THR HG22 H 11.344 7.565 -5.688 1.00 . A A . 8 THR HG22 1 1 1 133 1 1 9 THR HG23 H 12.217 6.668 -4.446 1.00 . A A . 8 THR HG23 1 1 1 134 1 1 9 THR N N 8.317 6.937 -4.128 1.00 . A A . 8 THR N 1 1 1 135 1 1 9 THR O O 8.592 4.146 -6.387 1.00 . A A . 8 THR O 1 1 1 136 1 1 9 THR OG1 O 10.362 4.947 -3.856 1.00 . A A . 8 THR OG1 1 1 1 137 1 1 10 LEU C C 4.574 4.215 -5.759 1.00 . A A . 9 LEU C 1 1 1 138 1 1 10 LEU CA C 6.011 3.797 -5.518 1.00 . A A . 9 LEU CA 1 1 1 139 1 1 10 LEU CB C 6.084 2.777 -4.384 1.00 . A A . 9 LEU CB 1 1 1 140 1 1 10 LEU CD1 C 7.505 1.371 -2.879 1.00 . A A . 9 LEU CD1 1 1 1 141 1 1 10 LEU CD2 C 7.837 1.267 -5.352 1.00 . A A . 9 LEU CD2 1 1 1 142 1 1 10 LEU CG C 7.466 2.156 -4.175 1.00 . A A . 9 LEU CG 1 1 1 143 1 1 10 LEU H H 6.503 5.670 -4.661 1.00 . A A . 9 LEU H 1 1 1 144 1 1 10 LEU HA H 6.385 3.345 -6.408 1.00 . A A . 9 LEU HA 1 1 1 145 1 1 10 LEU HB2 H 5.789 3.266 -3.468 1.00 . A A . 9 LEU HB2 1 1 1 146 1 1 10 LEU HB3 H 5.382 1.984 -4.593 1.00 . A A . 9 LEU HB3 1 1 1 147 1 1 10 LEU HD11 H 6.778 0.575 -2.920 1.00 . A A . 9 LEU HD11 1 1 1 148 1 1 10 LEU HD12 H 7.274 2.029 -2.055 1.00 . A A . 9 LEU HD12 1 1 1 149 1 1 10 LEU HD13 H 8.491 0.954 -2.742 1.00 . A A . 9 LEU HD13 1 1 1 150 1 1 10 LEU HD21 H 7.875 1.860 -6.254 1.00 . A A . 9 LEU HD21 1 1 1 151 1 1 10 LEU HD22 H 7.097 0.488 -5.464 1.00 . A A . 9 LEU HD22 1 1 1 152 1 1 10 LEU HD23 H 8.805 0.820 -5.175 1.00 . A A . 9 LEU HD23 1 1 1 153 1 1 10 LEU HG H 8.201 2.944 -4.109 1.00 . A A . 9 LEU HG 1 1 1 154 1 1 10 LEU N N 6.856 4.942 -5.212 1.00 . A A . 9 LEU N 1 1 1 155 1 1 10 LEU O O 4.018 3.981 -6.830 1.00 . A A . 9 LEU O 1 1 1 156 1 1 11 LEU C C 1.692 4.298 -5.445 1.00 . A A . 10 LEU C 1 1 1 157 1 1 11 LEU CA C 2.622 5.326 -4.801 1.00 . A A . 10 LEU CA 1 1 1 158 1 1 11 LEU CB C 2.545 6.659 -5.539 1.00 . A A . 10 LEU CB 1 1 1 159 1 1 11 LEU CD1 C 4.809 7.560 -4.925 1.00 . A A . 10 LEU CD1 1 1 1 160 1 1 11 LEU CD2 C 2.952 9.134 -5.503 1.00 . A A . 10 LEU CD2 1 1 1 161 1 1 11 LEU CG C 3.308 7.801 -4.863 1.00 . A A . 10 LEU CG 1 1 1 162 1 1 11 LEU H H 4.551 5.060 -3.974 1.00 . A A . 10 LEU H 1 1 1 163 1 1 11 LEU HA H 2.302 5.479 -3.782 1.00 . A A . 10 LEU HA 1 1 1 164 1 1 11 LEU HB2 H 2.944 6.522 -6.533 1.00 . A A . 10 LEU HB2 1 1 1 165 1 1 11 LEU HB3 H 1.506 6.943 -5.621 1.00 . A A . 10 LEU HB3 1 1 1 166 1 1 11 LEU HD11 H 5.093 6.843 -4.164 1.00 . A A . 10 LEU HD11 1 1 1 167 1 1 11 LEU HD12 H 5.331 8.490 -4.754 1.00 . A A . 10 LEU HD12 1 1 1 168 1 1 11 LEU HD13 H 5.072 7.173 -5.898 1.00 . A A . 10 LEU HD13 1 1 1 169 1 1 11 LEU HD21 H 3.217 9.113 -6.550 1.00 . A A . 10 LEU HD21 1 1 1 170 1 1 11 LEU HD22 H 3.496 9.927 -5.010 1.00 . A A . 10 LEU HD22 1 1 1 171 1 1 11 LEU HD23 H 1.891 9.310 -5.403 1.00 . A A . 10 LEU HD23 1 1 1 172 1 1 11 LEU HG H 3.025 7.841 -3.822 1.00 . A A . 10 LEU HG 1 1 1 173 1 1 11 LEU N N 4.006 4.859 -4.759 1.00 . A A . 10 LEU N 1 1 1 174 1 1 11 LEU O O 1.079 3.485 -4.752 1.00 . A A . 10 LEU O 1 1 1 175 1 1 12 SER C C 1.315 1.991 -7.468 1.00 . A A . 11 SER C 1 1 1 176 1 1 12 SER CA C 0.736 3.405 -7.501 1.00 . A A . 11 SER CA 1 1 1 177 1 1 12 SER CB C 0.568 3.865 -8.950 1.00 . A A . 11 SER CB 1 1 1 178 1 1 12 SER H H 2.101 5.008 -7.269 1.00 . A A . 11 SER H 1 1 1 179 1 1 12 SER HA H -0.231 3.396 -7.021 1.00 . A A . 11 SER HA 1 1 1 180 1 1 12 SER HB2 H 1.537 3.915 -9.424 1.00 . A A . 11 SER HB2 1 1 1 181 1 1 12 SER HB3 H -0.056 3.160 -9.479 1.00 . A A . 11 SER HB3 1 1 1 182 1 1 12 SER HG H -0.468 5.254 -9.864 1.00 . A A . 11 SER HG 1 1 1 183 1 1 12 SER N N 1.590 4.337 -6.770 1.00 . A A . 11 SER N 1 1 1 184 1 1 12 SER O O 0.771 1.074 -8.083 1.00 . A A . 11 SER O 1 1 1 185 1 1 12 SER OG O -0.037 5.145 -9.013 1.00 . A A . 11 SER OG 1 1 1 186 1 1 13 ARG C C 2.909 -0.029 -5.220 1.00 . A A . 12 ARG C 1 1 1 187 1 1 13 ARG CA C 3.074 0.527 -6.629 1.00 . A A . 12 ARG CA 1 1 1 188 1 1 13 ARG CB C 4.562 0.651 -6.963 1.00 . A A . 12 ARG CB 1 1 1 189 1 1 13 ARG CD C 6.329 1.557 -8.500 1.00 . A A . 12 ARG CD 1 1 1 190 1 1 13 ARG CG C 4.839 1.337 -8.290 1.00 . A A . 12 ARG CG 1 1 1 191 1 1 13 ARG CZ C 8.374 0.216 -8.774 1.00 . A A . 12 ARG CZ 1 1 1 192 1 1 13 ARG H H 2.802 2.594 -6.278 1.00 . A A . 12 ARG H 1 1 1 193 1 1 13 ARG HA H 2.607 -0.147 -7.328 1.00 . A A . 12 ARG HA 1 1 1 194 1 1 13 ARG HB2 H 5.046 1.219 -6.183 1.00 . A A . 12 ARG HB2 1 1 1 195 1 1 13 ARG HB3 H 4.995 -0.337 -6.997 1.00 . A A . 12 ARG HB3 1 1 1 196 1 1 13 ARG HD2 H 6.475 2.086 -9.430 1.00 . A A . 12 ARG HD2 1 1 1 197 1 1 13 ARG HD3 H 6.712 2.154 -7.683 1.00 . A A . 12 ARG HD3 1 1 1 198 1 1 13 ARG HE H 6.560 -0.530 -8.410 1.00 . A A . 12 ARG HE 1 1 1 199 1 1 13 ARG HG2 H 4.459 0.719 -9.090 1.00 . A A . 12 ARG HG2 1 1 1 200 1 1 13 ARG HG3 H 4.338 2.294 -8.302 1.00 . A A . 12 ARG HG3 1 1 1 201 1 1 13 ARG HH11 H 10.071 1.253 -9.136 1.00 . A A . 12 ARG HH11 1 1 1 202 1 1 13 ARG HH12 H 8.642 2.213 -8.946 1.00 . A A . 12 ARG HH12 1 1 1 203 1 1 13 ARG HH21 H 9.954 -1.028 -8.972 1.00 . A A . 12 ARG HH21 1 1 1 204 1 1 13 ARG HH22 H 8.436 -1.800 -8.658 1.00 . A A . 12 ARG HH22 1 1 1 205 1 1 13 ARG N N 2.419 1.825 -6.746 1.00 . A A . 12 ARG N 1 1 1 206 1 1 13 ARG NE N 7.066 0.298 -8.550 1.00 . A A . 12 ARG NE 1 1 1 207 1 1 13 ARG NH1 N 9.087 1.318 -8.968 1.00 . A A . 12 ARG NH1 1 1 1 208 1 1 13 ARG NH2 N 8.970 -0.968 -8.804 1.00 . A A . 12 ARG NH2 1 1 1 209 1 1 13 ARG O O 3.580 -0.988 -4.835 1.00 . A A . 12 ARG O 1 1 1 210 1 1 14 VAL C C 0.337 -0.379 -2.937 1.00 . A A . 13 VAL C 1 1 1 211 1 1 14 VAL CA C 1.753 0.164 -3.089 1.00 . A A . 13 VAL CA 1 1 1 212 1 1 14 VAL CB C 1.952 1.338 -2.115 1.00 . A A . 13 VAL CB 1 1 1 213 1 1 14 VAL CG1 C 2.199 0.837 -0.705 1.00 . A A . 13 VAL CG1 1 1 1 214 1 1 14 VAL CG2 C 3.095 2.223 -2.578 1.00 . A A . 13 VAL CG2 1 1 1 215 1 1 14 VAL H H 1.502 1.327 -4.830 1.00 . A A . 13 VAL H 1 1 1 216 1 1 14 VAL HA H 2.458 -0.613 -2.835 1.00 . A A . 13 VAL HA 1 1 1 217 1 1 14 VAL HB H 1.048 1.930 -2.108 1.00 . A A . 13 VAL HB 1 1 1 218 1 1 14 VAL HG11 H 1.299 0.382 -0.322 1.00 . A A . 13 VAL HG11 1 1 1 219 1 1 14 VAL HG12 H 2.483 1.668 -0.074 1.00 . A A . 13 VAL HG12 1 1 1 220 1 1 14 VAL HG13 H 2.995 0.108 -0.719 1.00 . A A . 13 VAL HG13 1 1 1 221 1 1 14 VAL HG21 H 3.280 2.987 -1.838 1.00 . A A . 13 VAL HG21 1 1 1 222 1 1 14 VAL HG22 H 2.834 2.687 -3.518 1.00 . A A . 13 VAL HG22 1 1 1 223 1 1 14 VAL HG23 H 3.984 1.624 -2.707 1.00 . A A . 13 VAL HG23 1 1 1 224 1 1 14 VAL N N 2.008 0.579 -4.459 1.00 . A A . 13 VAL N 1 1 1 225 1 1 14 VAL O O -0.580 0.350 -2.557 1.00 . A A . 13 VAL O 1 1 1 226 1 1 15 ASN C C -1.731 -2.110 -1.757 1.00 . A A . 14 ASN C 1 1 1 227 1 1 15 ASN CA C -1.138 -2.306 -3.148 1.00 . A A . 14 ASN CA 1 1 1 228 1 1 15 ASN CB C -1.019 -3.800 -3.460 1.00 . A A . 14 ASN CB 1 1 1 229 1 1 15 ASN CG C -0.737 -4.074 -4.927 1.00 . A A . 14 ASN CG 1 1 1 230 1 1 15 ASN H H 0.935 -2.178 -3.564 1.00 . A A . 14 ASN H 1 1 1 231 1 1 15 ASN HA H -1.793 -1.846 -3.873 1.00 . A A . 14 ASN HA 1 1 1 232 1 1 15 ASN HB2 H -0.214 -4.219 -2.876 1.00 . A A . 14 ASN HB2 1 1 1 233 1 1 15 ASN HB3 H -1.944 -4.290 -3.194 1.00 . A A . 14 ASN HB3 1 1 1 234 1 1 15 ASN HD21 H 0.282 -2.373 -5.087 1.00 . A A . 14 ASN HD21 1 1 1 235 1 1 15 ASN HD22 H 0.171 -3.320 -6.527 1.00 . A A . 14 ASN HD22 1 1 1 236 1 1 15 ASN N N 0.166 -1.658 -3.251 1.00 . A A . 14 ASN N 1 1 1 237 1 1 15 ASN ND2 N -0.022 -3.163 -5.579 1.00 . A A . 14 ASN ND2 1 1 1 238 1 1 15 ASN O O -1.313 -2.757 -0.796 1.00 . A A . 14 ASN O 1 1 1 239 1 1 15 ASN OD1 O -1.156 -5.097 -5.468 1.00 . A A . 14 ASN OD1 1 1 1 240 1 1 16 ARG C C -4.019 -2.175 0.183 1.00 . A A . 15 ARG C 1 1 1 241 1 1 16 ARG CA C -3.354 -0.924 -0.383 1.00 . A A . 15 ARG CA 1 1 1 242 1 1 16 ARG CB C -4.394 0.186 -0.556 1.00 . A A . 15 ARG CB 1 1 1 243 1 1 16 ARG CD C -2.822 2.095 -0.088 1.00 . A A . 15 ARG CD 1 1 1 244 1 1 16 ARG CG C -3.812 1.493 -1.073 1.00 . A A . 15 ARG CG 1 1 1 245 1 1 16 ARG CZ C -1.325 4.041 0.072 1.00 . A A . 15 ARG CZ 1 1 1 246 1 1 16 ARG H H -2.992 -0.727 -2.459 1.00 . A A . 15 ARG H 1 1 1 247 1 1 16 ARG HA H -2.595 -0.590 0.307 1.00 . A A . 15 ARG HA 1 1 1 248 1 1 16 ARG HB2 H -5.148 -0.148 -1.253 1.00 . A A . 15 ARG HB2 1 1 1 249 1 1 16 ARG HB3 H -4.859 0.378 0.400 1.00 . A A . 15 ARG HB3 1 1 1 250 1 1 16 ARG HD2 H -3.333 2.286 0.844 1.00 . A A . 15 ARG HD2 1 1 1 251 1 1 16 ARG HD3 H -2.024 1.386 0.078 1.00 . A A . 15 ARG HD3 1 1 1 252 1 1 16 ARG HE H -2.573 3.682 -1.443 1.00 . A A . 15 ARG HE 1 1 1 253 1 1 16 ARG HG2 H -3.305 1.304 -2.008 1.00 . A A . 15 ARG HG2 1 1 1 254 1 1 16 ARG HG3 H -4.617 2.195 -1.233 1.00 . A A . 15 ARG HG3 1 1 1 255 1 1 16 ARG HH11 H -1.219 2.761 1.633 1.00 . A A . 15 ARG HH11 1 1 1 256 1 1 16 ARG HH12 H -0.172 4.137 1.729 1.00 . A A . 15 ARG HH12 1 1 1 257 1 1 16 ARG HH21 H -1.197 5.496 -1.325 1.00 . A A . 15 ARG HH21 1 1 1 258 1 1 16 ARG HH22 H -0.160 5.692 0.048 1.00 . A A . 15 ARG HH22 1 1 1 259 1 1 16 ARG N N -2.704 -1.210 -1.657 1.00 . A A . 15 ARG N 1 1 1 260 1 1 16 ARG NE N -2.251 3.345 -0.581 1.00 . A A . 15 ARG NE 1 1 1 261 1 1 16 ARG NH1 N -0.868 3.611 1.240 1.00 . A A . 15 ARG NH1 1 1 1 262 1 1 16 ARG NH2 N -0.856 5.169 -0.444 1.00 . A A . 15 ARG NH2 1 1 1 263 1 1 16 ARG O O -5.001 -2.672 -0.371 1.00 . A A . 15 ARG O 1 1 1 264 1 1 17 HIS C C -4.007 -5.064 0.981 1.00 . A A . 16 HIS C 1 1 1 265 1 1 17 HIS CA C -4.011 -3.873 1.935 1.00 . A A . 16 HIS CA 1 1 1 266 1 1 17 HIS CB C -5.432 -3.613 2.441 1.00 . A A . 16 HIS CB 1 1 1 267 1 1 17 HIS CD2 C -5.223 -2.496 4.773 1.00 . A A . 16 HIS CD2 1 1 1 268 1 1 17 HIS CE1 C -5.916 -0.488 4.228 1.00 . A A . 16 HIS CE1 1 1 1 269 1 1 17 HIS CG C -5.516 -2.511 3.450 1.00 . A A . 16 HIS CG 1 1 1 270 1 1 17 HIS H H -2.693 -2.237 1.678 1.00 . A A . 16 HIS H 1 1 1 271 1 1 17 HIS HA H -3.377 -4.103 2.779 1.00 . A A . 16 HIS HA 1 1 1 272 1 1 17 HIS HB2 H -6.061 -3.346 1.604 1.00 . A A . 16 HIS HB2 1 1 1 273 1 1 17 HIS HB3 H -5.814 -4.513 2.900 1.00 . A A . 16 HIS HB3 1 1 1 274 1 1 17 HIS HD1 H -6.234 -0.929 2.256 1.00 . A A . 16 HIS HD1 1 1 1 275 1 1 17 HIS HD2 H -4.855 -3.327 5.357 1.00 . A A . 16 HIS HD2 1 1 1 276 1 1 17 HIS HE1 H -6.199 0.553 4.287 1.00 . A A . 16 HIS HE1 1 1 1 277 1 1 17 HIS HE2 H -5.362 -0.919 6.153 1.00 . A A . 16 HIS HE2 1 1 1 278 1 1 17 HIS N N -3.475 -2.680 1.288 1.00 . A A . 16 HIS N 1 1 1 279 1 1 17 HIS ND1 N -5.948 -1.238 3.141 1.00 . A A . 16 HIS ND1 1 1 1 280 1 1 17 HIS NE2 N -5.481 -1.228 5.231 1.00 . A A . 16 HIS NE2 1 1 1 281 1 1 17 HIS O O -3.472 -4.986 -0.125 1.00 . A A . 16 HIS O 1 1 1 282 1 1 18 SER C C -5.875 -7.338 -0.331 1.00 . A A . 17 SER C 1 1 1 283 1 1 18 SER CA C -4.672 -7.377 0.606 1.00 . A A . 17 SER CA 1 1 1 284 1 1 18 SER CB C -4.748 -8.615 1.501 1.00 . A A . 17 SER CB 1 1 1 285 1 1 18 SER H H -5.012 -6.169 2.311 1.00 . A A . 17 SER H 1 1 1 286 1 1 18 SER HA H -3.771 -7.428 0.013 1.00 . A A . 17 SER HA 1 1 1 287 1 1 18 SER HB2 H -5.631 -8.555 2.120 1.00 . A A . 17 SER HB2 1 1 1 288 1 1 18 SER HB3 H -4.800 -9.500 0.885 1.00 . A A . 17 SER HB3 1 1 1 289 1 1 18 SER HG H -3.162 -9.543 2.179 1.00 . A A . 17 SER HG 1 1 1 290 1 1 18 SER N N -4.605 -6.168 1.419 1.00 . A A . 17 SER N 1 1 1 291 1 1 18 SER O O -6.602 -6.345 -0.383 1.00 . A A . 17 SER O 1 1 1 292 1 1 18 SER OG O -3.610 -8.710 2.340 1.00 . A A . 17 SER OG 1 1 1 293 1 1 19 THR C C -8.530 -8.442 -1.275 1.00 . A A . 18 THR C 1 1 1 294 1 1 19 THR CA C -7.193 -8.517 -2.006 1.00 . A A . 18 THR CA 1 1 1 295 1 1 19 THR CB C -7.136 -9.824 -2.819 1.00 . A A . 18 THR CB 1 1 1 296 1 1 19 THR CG2 C -8.266 -9.882 -3.836 1.00 . A A . 18 THR CG2 1 1 1 297 1 1 19 THR H H -5.463 -9.183 -0.984 1.00 . A A . 18 THR H 1 1 1 298 1 1 19 THR HA H -7.122 -7.686 -2.693 1.00 . A A . 18 THR HA 1 1 1 299 1 1 19 THR HB H -7.239 -10.658 -2.140 1.00 . A A . 18 THR HB 1 1 1 300 1 1 19 THR HG1 H -5.454 -9.064 -3.515 1.00 . A A . 18 THR HG1 1 1 1 301 1 1 19 THR HG21 H -8.187 -9.043 -4.511 1.00 . A A . 18 THR HG21 1 1 1 302 1 1 19 THR HG22 H -9.215 -9.843 -3.322 1.00 . A A . 18 THR HG22 1 1 1 303 1 1 19 THR HG23 H -8.198 -10.803 -4.397 1.00 . A A . 18 THR HG23 1 1 1 304 1 1 19 THR N N -6.078 -8.424 -1.070 1.00 . A A . 18 THR N 1 1 1 305 1 1 19 THR O O -8.696 -9.025 -0.203 1.00 . A A . 18 THR O 1 1 1 306 1 1 19 THR OG1 O -5.877 -9.926 -3.495 1.00 . A A . 18 THR OG1 1 1 1 307 1 1 20 ALA C C -11.523 -8.910 -1.180 1.00 . A A . 19 ALA C 1 1 1 308 1 1 20 ALA CA C -10.803 -7.569 -1.268 1.00 . A A . 19 ALA CA 1 1 1 309 1 1 20 ALA CB C -11.630 -6.575 -2.070 1.00 . A A . 19 ALA CB 1 1 1 310 1 1 20 ALA H H -9.286 -7.280 -2.715 1.00 . A A . 19 ALA H 1 1 1 311 1 1 20 ALA HA H -10.676 -7.173 -0.270 1.00 . A A . 19 ALA HA 1 1 1 312 1 1 20 ALA HB1 H -12.585 -6.430 -1.587 1.00 . A A . 19 ALA HB1 1 1 1 313 1 1 20 ALA HB2 H -11.785 -6.958 -3.067 1.00 . A A . 19 ALA HB2 1 1 1 314 1 1 20 ALA HB3 H -11.106 -5.632 -2.123 1.00 . A A . 19 ALA HB3 1 1 1 315 1 1 20 ALA N N -9.480 -7.721 -1.862 1.00 . A A . 19 ALA N 1 1 1 316 1 1 20 ALA O O -11.257 -9.821 -1.964 1.00 . A A . 19 ALA O 1 1 1 317 1 1 21 ILE C C -14.633 -9.949 0.383 1.00 . A A . 20 ILE C 1 1 1 318 1 1 21 ILE CA C -13.195 -10.253 -0.027 1.00 . A A . 20 ILE CA 1 1 1 319 1 1 21 ILE CB C -12.541 -11.155 1.040 1.00 . A A . 20 ILE CB 1 1 1 320 1 1 21 ILE CD1 C -12.674 -13.461 2.120 1.00 . A A . 20 ILE CD1 1 1 1 321 1 1 21 ILE CG1 C -13.329 -12.460 1.193 1.00 . A A . 20 ILE CG1 1 1 1 322 1 1 21 ILE CG2 C -12.450 -10.421 2.370 1.00 . A A . 20 ILE CG2 1 1 1 323 1 1 21 ILE H H -12.602 -8.261 0.374 1.00 . A A . 20 ILE H 1 1 1 324 1 1 21 ILE HA H -13.204 -10.789 -0.965 1.00 . A A . 20 ILE HA 1 1 1 325 1 1 21 ILE HB H -11.537 -11.385 0.716 1.00 . A A . 20 ILE HB 1 1 1 326 1 1 21 ILE HD11 H -13.279 -14.354 2.171 1.00 . A A . 20 ILE HD11 1 1 1 327 1 1 21 ILE HD12 H -12.583 -13.032 3.107 1.00 . A A . 20 ILE HD12 1 1 1 328 1 1 21 ILE HD13 H -11.693 -13.711 1.745 1.00 . A A . 20 ILE HD13 1 1 1 329 1 1 21 ILE HG12 H -14.309 -12.236 1.587 1.00 . A A . 20 ILE HG12 1 1 1 330 1 1 21 ILE HG13 H -13.433 -12.925 0.224 1.00 . A A . 20 ILE HG13 1 1 1 331 1 1 21 ILE HG21 H -11.976 -11.059 3.102 1.00 . A A . 20 ILE HG21 1 1 1 332 1 1 21 ILE HG22 H -13.443 -10.162 2.708 1.00 . A A . 20 ILE HG22 1 1 1 333 1 1 21 ILE HG23 H -11.866 -9.521 2.246 1.00 . A A . 20 ILE HG23 1 1 1 334 1 1 21 ILE N N -12.435 -9.023 -0.220 1.00 . A A . 20 ILE N 1 1 1 335 1 1 21 ILE O O -14.890 -9.001 1.125 1.00 . A A . 20 ILE O 1 1 1 336 1 1 22 GLY C C -17.241 -10.681 1.704 1.00 . A A . 21 GLY C 1 1 1 337 1 1 22 GLY CA C -16.968 -10.562 0.217 1.00 . A A . 21 GLY CA 1 1 1 338 1 1 22 GLY H H -15.302 -11.497 -0.697 1.00 . A A . 21 GLY H 1 1 1 339 1 1 22 GLY HA2 H -17.268 -9.579 -0.115 1.00 . A A . 21 GLY HA2 1 1 1 340 1 1 22 GLY HA3 H -17.555 -11.302 -0.306 1.00 . A A . 21 GLY HA3 1 1 1 341 1 1 22 GLY N N -15.567 -10.759 -0.108 1.00 . A A . 21 GLY N 1 1 1 342 1 1 22 GLY O O -17.838 -9.788 2.305 1.00 . A A . 21 GLY O 1 1 1 343 1 1 23 ARG C C -15.977 -13.016 4.258 1.00 . A A . 22 ARG C 1 1 1 344 1 1 23 ARG CA C -17.003 -12.021 3.722 1.00 . A A . 22 ARG CA 1 1 1 345 1 1 23 ARG CB C -18.420 -12.537 3.983 1.00 . A A . 22 ARG CB 1 1 1 346 1 1 23 ARG CD C -20.147 -13.261 5.659 1.00 . A A . 22 ARG CD 1 1 1 347 1 1 23 ARG CG C -18.729 -12.753 5.455 1.00 . A A . 22 ARG CG 1 1 1 348 1 1 23 ARG CZ C -21.525 -15.201 5.029 1.00 . A A . 22 ARG CZ 1 1 1 349 1 1 23 ARG H H -16.334 -12.462 1.763 1.00 . A A . 22 ARG H 1 1 1 350 1 1 23 ARG HA H -16.873 -11.079 4.234 1.00 . A A . 22 ARG HA 1 1 1 351 1 1 23 ARG HB2 H -19.128 -11.823 3.589 1.00 . A A . 22 ARG HB2 1 1 1 352 1 1 23 ARG HB3 H -18.547 -13.478 3.469 1.00 . A A . 22 ARG HB3 1 1 1 353 1 1 23 ARG HD2 H -20.323 -13.386 6.717 1.00 . A A . 22 ARG HD2 1 1 1 354 1 1 23 ARG HD3 H -20.838 -12.531 5.263 1.00 . A A . 22 ARG HD3 1 1 1 355 1 1 23 ARG HE H -19.627 -14.922 4.480 1.00 . A A . 22 ARG HE 1 1 1 356 1 1 23 ARG HG2 H -18.036 -13.478 5.856 1.00 . A A . 22 ARG HG2 1 1 1 357 1 1 23 ARG HG3 H -18.615 -11.815 5.978 1.00 . A A . 22 ARG HG3 1 1 1 358 1 1 23 ARG HH11 H -23.418 -15.211 5.737 1.00 . A A . 22 ARG HH11 1 1 1 359 1 1 23 ARG HH12 H -22.464 -13.838 6.190 1.00 . A A . 22 ARG HH12 1 1 1 360 1 1 23 ARG HH21 H -20.876 -16.732 3.880 1.00 . A A . 22 ARG HH21 1 1 1 361 1 1 23 ARG HH22 H -22.516 -16.855 4.424 1.00 . A A . 22 ARG HH22 1 1 1 362 1 1 23 ARG N N -16.803 -11.787 2.297 1.00 . A A . 22 ARG N 1 1 1 363 1 1 23 ARG NE N -20.372 -14.539 4.987 1.00 . A A . 22 ARG NE 1 1 1 364 1 1 23 ARG NH1 N -22.553 -14.710 5.708 1.00 . A A . 22 ARG NH1 1 1 1 365 1 1 23 ARG NH2 N -21.649 -16.358 4.392 1.00 . A A . 22 ARG NH2 1 1 1 366 1 1 23 ARG O O -14.920 -12.568 4.750 1.00 . A A . 22 ARG O 1 1 1 367 1 1 23 ARG OXT O -16.240 -14.235 4.182 1.00 . A A . 22 ARG OXT 1 1 2 368 1 1 1 ACE C C 2.661 -0.022 10.727 1.00 . A A . 0 ACE C 1 1 2 369 1 1 1 ACE CH3 C 2.746 -1.087 11.786 1.00 . A A . 0 ACE CH3 1 1 2 370 1 1 1 ACE H1 H 3.152 -1.989 11.339 1.00 . A A . 0 ACE H1 1 1 2 371 1 1 1 ACE H2 H 1.764 -1.290 12.168 1.00 . A A . 0 ACE H2 1 1 2 372 1 1 1 ACE H3 H 3.381 -0.729 12.590 1.00 . A A . 0 ACE H3 1 1 2 373 1 1 1 ACE O O 1.723 0.774 10.705 1.00 . A A . 0 ACE O 1 1 2 374 1 1 2 MET C C 4.357 0.402 7.518 1.00 . A A . 1 MET C 1 1 2 375 1 1 2 MET CA C 3.687 0.981 8.760 1.00 . A A . 1 MET CA 1 1 2 376 1 1 2 MET CB C 4.424 2.247 9.213 1.00 . A A . 1 MET CB 1 1 2 377 1 1 2 MET CE C 7.612 1.050 11.637 1.00 . A A . 1 MET CE 1 1 2 378 1 1 2 MET CG C 5.833 1.991 9.731 1.00 . A A . 1 MET CG 1 1 2 379 1 1 2 MET H H 4.369 -0.662 9.907 1.00 . A A . 1 MET H 1 1 2 380 1 1 2 MET HA H 2.668 1.240 8.514 1.00 . A A . 1 MET HA 1 1 2 381 1 1 2 MET HB2 H 4.493 2.927 8.376 1.00 . A A . 1 MET HB2 1 1 2 382 1 1 2 MET HB3 H 3.855 2.718 10.000 1.00 . A A . 1 MET HB3 1 1 2 383 1 1 2 MET HE1 H 8.050 2.037 11.636 1.00 . A A . 1 MET HE1 1 1 2 384 1 1 2 MET HE2 H 8.066 0.455 10.858 1.00 . A A . 1 MET HE2 1 1 2 385 1 1 2 MET HE3 H 7.783 0.581 12.593 1.00 . A A . 1 MET HE3 1 1 2 386 1 1 2 MET HG2 H 6.354 1.366 9.023 1.00 . A A . 1 MET HG2 1 1 2 387 1 1 2 MET HG3 H 6.346 2.937 9.818 1.00 . A A . 1 MET HG3 1 1 2 388 1 1 2 MET N N 3.648 0.000 9.837 1.00 . A A . 1 MET N 1 1 2 389 1 1 2 MET O O 5.488 -0.082 7.578 1.00 . A A . 1 MET O 1 1 2 390 1 1 2 MET SD S 5.850 1.177 11.341 1.00 . A A . 1 MET SD 1 1 2 391 1 1 3 ASN C C 4.106 0.991 4.041 1.00 . A A . 2 ASN C 1 1 2 392 1 1 3 ASN CA C 4.183 -0.066 5.136 1.00 . A A . 2 ASN CA 1 1 2 393 1 1 3 ASN CB C 3.420 -1.318 4.697 1.00 . A A . 2 ASN CB 1 1 2 394 1 1 3 ASN CG C 4.130 -2.067 3.581 1.00 . A A . 2 ASN CG 1 1 2 395 1 1 3 ASN H H 2.752 0.840 6.407 1.00 . A A . 2 ASN H 1 1 2 396 1 1 3 ASN HA H 5.219 -0.324 5.298 1.00 . A A . 2 ASN HA 1 1 2 397 1 1 3 ASN HB2 H 3.315 -1.983 5.541 1.00 . A A . 2 ASN HB2 1 1 2 398 1 1 3 ASN HB3 H 2.440 -1.031 4.345 1.00 . A A . 2 ASN HB3 1 1 2 399 1 1 3 ASN HD21 H 4.365 -2.102 1.604 1.00 . A A . 2 ASN HD21 1 1 2 400 1 1 3 ASN HD22 H 3.325 -0.863 2.213 1.00 . A A . 2 ASN HD22 1 1 2 401 1 1 3 ASN N N 3.651 0.450 6.392 1.00 . A A . 2 ASN N 1 1 2 402 1 1 3 ASN ND2 N 3.918 -1.634 2.341 1.00 . A A . 2 ASN ND2 1 1 2 403 1 1 3 ASN O O 4.414 0.716 2.883 1.00 . A A . 2 ASN O 1 1 2 404 1 1 3 ASN OD1 O 4.871 -3.018 3.833 1.00 . A A . 2 ASN OD1 1 1 2 405 1 1 4 TRP C C 4.842 3.385 2.602 1.00 . A A . 3 TRP C 1 1 2 406 1 1 4 TRP CA C 3.590 3.287 3.442 1.00 . A A . 3 TRP CA 1 1 2 407 1 1 4 TRP CB C 3.371 4.624 4.128 1.00 . A A . 3 TRP CB 1 1 2 408 1 1 4 TRP CD1 C 4.474 4.693 6.423 1.00 . A A . 3 TRP CD1 1 1 2 409 1 1 4 TRP CD2 C 5.679 5.640 4.804 1.00 . A A . 3 TRP CD2 1 1 2 410 1 1 4 TRP CE2 C 6.384 5.764 6.010 1.00 . A A . 3 TRP CE2 1 1 2 411 1 1 4 TRP CE3 C 6.241 6.155 3.641 1.00 . A A . 3 TRP CE3 1 1 2 412 1 1 4 TRP CG C 4.454 4.968 5.096 1.00 . A A . 3 TRP CG 1 1 2 413 1 1 4 TRP CH2 C 8.156 6.882 4.926 1.00 . A A . 3 TRP CH2 1 1 2 414 1 1 4 TRP CZ2 C 7.625 6.386 6.083 1.00 . A A . 3 TRP CZ2 1 1 2 415 1 1 4 TRP CZ3 C 7.475 6.770 3.710 1.00 . A A . 3 TRP CZ3 1 1 2 416 1 1 4 TRP H H 3.481 2.375 5.350 1.00 . A A . 3 TRP H 1 1 2 417 1 1 4 TRP HA H 2.749 3.077 2.804 1.00 . A A . 3 TRP HA 1 1 2 418 1 1 4 TRP HB2 H 3.345 5.403 3.374 1.00 . A A . 3 TRP HB2 1 1 2 419 1 1 4 TRP HB3 H 2.433 4.606 4.661 1.00 . A A . 3 TRP HB3 1 1 2 420 1 1 4 TRP HD1 H 3.688 4.176 6.937 1.00 . A A . 3 TRP HD1 1 1 2 421 1 1 4 TRP HE1 H 5.868 5.114 7.938 1.00 . A A . 3 TRP HE1 1 1 2 422 1 1 4 TRP HE3 H 5.728 6.072 2.695 1.00 . A A . 3 TRP HE3 1 1 2 423 1 1 4 TRP HH2 H 9.119 7.372 4.937 1.00 . A A . 3 TRP HH2 1 1 2 424 1 1 4 TRP HZ2 H 8.156 6.482 7.009 1.00 . A A . 3 TRP HZ2 1 1 2 425 1 1 4 TRP HZ3 H 7.925 7.176 2.815 1.00 . A A . 3 TRP HZ3 1 1 2 426 1 1 4 TRP N N 3.702 2.204 4.411 1.00 . A A . 3 TRP N 1 1 2 427 1 1 4 TRP NE1 N 5.627 5.178 6.990 1.00 . A A . 3 TRP NE1 1 1 2 428 1 1 4 TRP O O 4.800 3.899 1.486 1.00 . A A . 3 TRP O 1 1 2 429 1 1 5 THR C C 7.053 2.782 0.975 1.00 . A A . 4 THR C 1 1 2 430 1 1 5 THR CA C 7.239 2.939 2.477 1.00 . A A . 4 THR CA 1 1 2 431 1 1 5 THR CB C 8.191 1.842 2.988 1.00 . A A . 4 THR CB 1 1 2 432 1 1 5 THR CG2 C 9.573 1.994 2.372 1.00 . A A . 4 THR CG2 1 1 2 433 1 1 5 THR H H 5.905 2.508 4.055 1.00 . A A . 4 THR H 1 1 2 434 1 1 5 THR HA H 7.683 3.902 2.685 1.00 . A A . 4 THR HA 1 1 2 435 1 1 5 THR HB H 7.791 0.880 2.704 1.00 . A A . 4 THR HB 1 1 2 436 1 1 5 THR HG1 H 8.215 2.819 4.703 1.00 . A A . 4 THR HG1 1 1 2 437 1 1 5 THR HG21 H 10.220 1.211 2.738 1.00 . A A . 4 THR HG21 1 1 2 438 1 1 5 THR HG22 H 9.985 2.956 2.643 1.00 . A A . 4 THR HG22 1 1 2 439 1 1 5 THR HG23 H 9.499 1.925 1.296 1.00 . A A . 4 THR HG23 1 1 2 440 1 1 5 THR N N 5.955 2.900 3.159 1.00 . A A . 4 THR N 1 1 2 441 1 1 5 THR O O 7.074 1.671 0.443 1.00 . A A . 4 THR O 1 1 2 442 1 1 5 THR OG1 O 8.293 1.905 4.416 1.00 . A A . 4 THR OG1 1 1 2 443 1 1 6 GLY C C 5.580 4.898 -1.542 1.00 . A A . 5 GLY C 1 1 2 444 1 1 6 GLY CA C 6.640 3.894 -1.124 1.00 . A A . 5 GLY CA 1 1 2 445 1 1 6 GLY H H 6.878 4.759 0.784 1.00 . A A . 5 GLY H 1 1 2 446 1 1 6 GLY HA2 H 7.566 4.127 -1.628 1.00 . A A . 5 GLY HA2 1 1 2 447 1 1 6 GLY HA3 H 6.319 2.903 -1.416 1.00 . A A . 5 GLY HA3 1 1 2 448 1 1 6 GLY N N 6.862 3.907 0.302 1.00 . A A . 5 GLY N 1 1 2 449 1 1 6 GLY O O 5.208 4.967 -2.707 1.00 . A A . 5 GLY O 1 1 2 450 1 1 7 LEU C C 4.643 7.940 -1.478 1.00 . A A . 6 LEU C 1 1 2 451 1 1 7 LEU CA C 4.060 6.679 -0.850 1.00 . A A . 6 LEU CA 1 1 2 452 1 1 7 LEU CB C 3.320 7.014 0.448 1.00 . A A . 6 LEU CB 1 1 2 453 1 1 7 LEU CD1 C 3.411 7.998 2.761 1.00 . A A . 6 LEU CD1 1 1 2 454 1 1 7 LEU CD2 C 5.432 8.134 1.323 1.00 . A A . 6 LEU CD2 1 1 2 455 1 1 7 LEU CG C 3.910 8.137 1.331 1.00 . A A . 6 LEU CG 1 1 2 456 1 1 7 LEU H H 5.430 5.579 0.331 1.00 . A A . 6 LEU H 1 1 2 457 1 1 7 LEU HA H 3.360 6.244 -1.545 1.00 . A A . 6 LEU HA 1 1 2 458 1 1 7 LEU HB2 H 2.313 7.292 0.183 1.00 . A A . 6 LEU HB2 1 1 2 459 1 1 7 LEU HB3 H 3.279 6.114 1.038 1.00 . A A . 6 LEU HB3 1 1 2 460 1 1 7 LEU HD11 H 3.648 8.895 3.313 1.00 . A A . 6 LEU HD11 1 1 2 461 1 1 7 LEU HD12 H 3.896 7.151 3.229 1.00 . A A . 6 LEU HD12 1 1 2 462 1 1 7 LEU HD13 H 2.343 7.846 2.758 1.00 . A A . 6 LEU HD13 1 1 2 463 1 1 7 LEU HD21 H 5.789 7.122 1.201 1.00 . A A . 6 LEU HD21 1 1 2 464 1 1 7 LEU HD22 H 5.798 8.530 2.261 1.00 . A A . 6 LEU HD22 1 1 2 465 1 1 7 LEU HD23 H 5.791 8.745 0.510 1.00 . A A . 6 LEU HD23 1 1 2 466 1 1 7 LEU HG H 3.578 9.093 0.954 1.00 . A A . 6 LEU HG 1 1 2 467 1 1 7 LEU N N 5.094 5.681 -0.583 1.00 . A A . 6 LEU N 1 1 2 468 1 1 7 LEU O O 4.007 8.995 -1.495 1.00 . A A . 6 LEU O 1 1 2 469 1 1 8 TYR C C 7.033 8.574 -4.028 1.00 . A A . 7 TYR C 1 1 2 470 1 1 8 TYR CA C 6.537 8.931 -2.629 1.00 . A A . 7 TYR CA 1 1 2 471 1 1 8 TYR CB C 7.707 9.384 -1.754 1.00 . A A . 7 TYR CB 1 1 2 472 1 1 8 TYR CD1 C 8.041 7.213 -0.544 1.00 . A A . 7 TYR CD1 1 1 2 473 1 1 8 TYR CD2 C 9.932 8.196 -1.600 1.00 . A A . 7 TYR CD2 1 1 2 474 1 1 8 TYR CE1 C 8.807 6.167 -0.122 1.00 . A A . 7 TYR CE1 1 1 2 475 1 1 8 TYR CE2 C 10.718 7.141 -1.174 1.00 . A A . 7 TYR CE2 1 1 2 476 1 1 8 TYR CG C 8.580 8.247 -1.289 1.00 . A A . 7 TYR CG 1 1 2 477 1 1 8 TYR CZ C 10.149 6.126 -0.434 1.00 . A A . 7 TYR CZ 1 1 2 478 1 1 8 TYR H H 6.290 6.945 -1.962 1.00 . A A . 7 TYR H 1 1 2 479 1 1 8 TYR HA H 5.835 9.735 -2.704 1.00 . A A . 7 TYR HA 1 1 2 480 1 1 8 TYR HB2 H 8.325 10.070 -2.314 1.00 . A A . 7 TYR HB2 1 1 2 481 1 1 8 TYR HB3 H 7.320 9.882 -0.880 1.00 . A A . 7 TYR HB3 1 1 2 482 1 1 8 TYR HD1 H 6.988 7.236 -0.292 1.00 . A A . 7 TYR HD1 1 1 2 483 1 1 8 TYR HD2 H 10.370 8.995 -2.180 1.00 . A A . 7 TYR HD2 1 1 2 484 1 1 8 TYR HE1 H 8.346 5.383 0.445 1.00 . A A . 7 TYR HE1 1 1 2 485 1 1 8 TYR HE2 H 11.769 7.115 -1.423 1.00 . A A . 7 TYR HE2 1 1 2 486 1 1 8 TYR HH H 11.750 5.402 0.344 1.00 . A A . 7 TYR HH 1 1 2 487 1 1 8 TYR N N 5.848 7.814 -2.004 1.00 . A A . 7 TYR N 1 1 2 488 1 1 8 TYR O O 7.098 9.433 -4.908 1.00 . A A . 7 TYR O 1 1 2 489 1 1 8 TYR OH O 10.922 5.070 -0.009 1.00 . A A . 7 TYR OH 1 1 2 490 1 1 9 THR C C 7.420 5.430 -5.846 1.00 . A A . 8 THR C 1 1 2 491 1 1 9 THR CA C 7.877 6.851 -5.531 1.00 . A A . 8 THR CA 1 1 2 492 1 1 9 THR CB C 9.414 6.894 -5.594 1.00 . A A . 8 THR CB 1 1 2 493 1 1 9 THR CG2 C 9.930 8.312 -5.397 1.00 . A A . 8 THR CG2 1 1 2 494 1 1 9 THR H H 7.306 6.661 -3.497 1.00 . A A . 8 THR H 1 1 2 495 1 1 9 THR HA H 7.486 7.515 -6.284 1.00 . A A . 8 THR HA 1 1 2 496 1 1 9 THR HB H 9.729 6.545 -6.567 1.00 . A A . 8 THR HB 1 1 2 497 1 1 9 THR HG1 H 9.320 5.361 -4.357 1.00 . A A . 8 THR HG1 1 1 2 498 1 1 9 THR HG21 H 11.007 8.317 -5.472 1.00 . A A . 8 THR HG21 1 1 2 499 1 1 9 THR HG22 H 9.636 8.671 -4.421 1.00 . A A . 8 THR HG22 1 1 2 500 1 1 9 THR HG23 H 9.513 8.956 -6.157 1.00 . A A . 8 THR HG23 1 1 2 501 1 1 9 THR N N 7.382 7.304 -4.233 1.00 . A A . 8 THR N 1 1 2 502 1 1 9 THR O O 7.900 4.814 -6.798 1.00 . A A . 8 THR O 1 1 2 503 1 1 9 THR OG1 O 9.965 6.035 -4.589 1.00 . A A . 8 THR OG1 1 1 2 504 1 1 10 LEU C C 4.487 3.488 -4.923 1.00 . A A . 9 LEU C 1 1 2 505 1 1 10 LEU CA C 5.975 3.566 -5.250 1.00 . A A . 9 LEU CA 1 1 2 506 1 1 10 LEU CB C 6.751 2.570 -4.389 1.00 . A A . 9 LEU CB 1 1 2 507 1 1 10 LEU CD1 C 8.944 1.636 -3.633 1.00 . A A . 9 LEU CD1 1 1 2 508 1 1 10 LEU CD2 C 8.489 1.913 -6.074 1.00 . A A . 9 LEU CD2 1 1 2 509 1 1 10 LEU CG C 8.249 2.483 -4.684 1.00 . A A . 9 LEU CG 1 1 2 510 1 1 10 LEU H H 6.135 5.467 -4.323 1.00 . A A . 9 LEU H 1 1 2 511 1 1 10 LEU HA H 6.116 3.311 -6.286 1.00 . A A . 9 LEU HA 1 1 2 512 1 1 10 LEU HB2 H 6.626 2.849 -3.354 1.00 . A A . 9 LEU HB2 1 1 2 513 1 1 10 LEU HB3 H 6.319 1.591 -4.533 1.00 . A A . 9 LEU HB3 1 1 2 514 1 1 10 LEU HD11 H 8.814 2.091 -2.663 1.00 . A A . 9 LEU HD11 1 1 2 515 1 1 10 LEU HD12 H 9.997 1.571 -3.865 1.00 . A A . 9 LEU HD12 1 1 2 516 1 1 10 LEU HD13 H 8.513 0.647 -3.629 1.00 . A A . 9 LEU HD13 1 1 2 517 1 1 10 LEU HD21 H 9.552 1.834 -6.252 1.00 . A A . 9 LEU HD21 1 1 2 518 1 1 10 LEU HD22 H 8.048 2.564 -6.812 1.00 . A A . 9 LEU HD22 1 1 2 519 1 1 10 LEU HD23 H 8.039 0.933 -6.144 1.00 . A A . 9 LEU HD23 1 1 2 520 1 1 10 LEU HG H 8.676 3.473 -4.652 1.00 . A A . 9 LEU HG 1 1 2 521 1 1 10 LEU N N 6.489 4.920 -5.052 1.00 . A A . 9 LEU N 1 1 2 522 1 1 10 LEU O O 3.934 2.403 -4.768 1.00 . A A . 9 LEU O 1 1 2 523 1 1 11 LEU C C 1.634 3.709 -5.288 1.00 . A A . 10 LEU C 1 1 2 524 1 1 11 LEU CA C 2.434 4.745 -4.505 1.00 . A A . 10 LEU CA 1 1 2 525 1 1 11 LEU CB C 1.922 6.152 -4.830 1.00 . A A . 10 LEU CB 1 1 2 526 1 1 11 LEU CD1 C 3.996 7.513 -4.393 1.00 . A A . 10 LEU CD1 1 1 2 527 1 1 11 LEU CD2 C 1.739 8.565 -4.168 1.00 . A A . 10 LEU CD2 1 1 2 528 1 1 11 LEU CG C 2.543 7.283 -4.002 1.00 . A A . 10 LEU CG 1 1 2 529 1 1 11 LEU H H 4.374 5.472 -4.903 1.00 . A A . 10 LEU H 1 1 2 530 1 1 11 LEU HA H 2.304 4.561 -3.451 1.00 . A A . 10 LEU HA 1 1 2 531 1 1 11 LEU HB2 H 2.117 6.350 -5.873 1.00 . A A . 10 LEU HB2 1 1 2 532 1 1 11 LEU HB3 H 0.853 6.167 -4.674 1.00 . A A . 10 LEU HB3 1 1 2 533 1 1 11 LEU HD11 H 4.133 7.271 -5.436 1.00 . A A . 10 LEU HD11 1 1 2 534 1 1 11 LEU HD12 H 4.639 6.884 -3.786 1.00 . A A . 10 LEU HD12 1 1 2 535 1 1 11 LEU HD13 H 4.253 8.549 -4.228 1.00 . A A . 10 LEU HD13 1 1 2 536 1 1 11 LEU HD21 H 2.192 9.351 -3.582 1.00 . A A . 10 LEU HD21 1 1 2 537 1 1 11 LEU HD22 H 0.727 8.401 -3.829 1.00 . A A . 10 LEU HD22 1 1 2 538 1 1 11 LEU HD23 H 1.728 8.850 -5.209 1.00 . A A . 10 LEU HD23 1 1 2 539 1 1 11 LEU HG H 2.520 7.007 -2.960 1.00 . A A . 10 LEU HG 1 1 2 540 1 1 11 LEU N N 3.859 4.650 -4.805 1.00 . A A . 10 LEU N 1 1 2 541 1 1 11 LEU O O 1.126 2.744 -4.718 1.00 . A A . 10 LEU O 1 1 2 542 1 1 12 SER C C 1.518 1.652 -7.537 1.00 . A A . 11 SER C 1 1 2 543 1 1 12 SER CA C 0.795 2.992 -7.458 1.00 . A A . 11 SER CA 1 1 2 544 1 1 12 SER CB C 0.636 3.585 -8.859 1.00 . A A . 11 SER CB 1 1 2 545 1 1 12 SER H H 1.947 4.707 -6.990 1.00 . A A . 11 SER H 1 1 2 546 1 1 12 SER HA H -0.183 2.837 -7.025 1.00 . A A . 11 SER HA 1 1 2 547 1 1 12 SER HB2 H 1.612 3.759 -9.287 1.00 . A A . 11 SER HB2 1 1 2 548 1 1 12 SER HB3 H 0.089 2.891 -9.480 1.00 . A A . 11 SER HB3 1 1 2 549 1 1 12 SER HG H -1.011 4.644 -8.906 1.00 . A A . 11 SER HG 1 1 2 550 1 1 12 SER N N 1.526 3.915 -6.596 1.00 . A A . 11 SER N 1 1 2 551 1 1 12 SER O O 0.986 0.673 -8.059 1.00 . A A . 11 SER O 1 1 2 552 1 1 12 SER OG O -0.071 4.812 -8.817 1.00 . A A . 11 SER OG 1 1 2 553 1 1 13 ARG C C 3.489 -0.275 -5.649 1.00 . A A . 12 ARG C 1 1 2 554 1 1 13 ARG CA C 3.553 0.416 -7.007 1.00 . A A . 12 ARG CA 1 1 2 555 1 1 13 ARG CB C 5.002 0.770 -7.346 1.00 . A A . 12 ARG CB 1 1 2 556 1 1 13 ARG CD C 6.580 1.935 -8.918 1.00 . A A . 12 ARG CD 1 1 2 557 1 1 13 ARG CG C 5.168 1.408 -8.716 1.00 . A A . 12 ARG CG 1 1 2 558 1 1 13 ARG CZ C 7.852 3.198 -10.603 1.00 . A A . 12 ARG CZ 1 1 2 559 1 1 13 ARG H H 3.101 2.442 -6.612 1.00 . A A . 12 ARG H 1 1 2 560 1 1 13 ARG HA H 3.164 -0.252 -7.758 1.00 . A A . 12 ARG HA 1 1 2 561 1 1 13 ARG HB2 H 5.373 1.463 -6.604 1.00 . A A . 12 ARG HB2 1 1 2 562 1 1 13 ARG HB3 H 5.598 -0.130 -7.317 1.00 . A A . 12 ARG HB3 1 1 2 563 1 1 13 ARG HD2 H 6.792 2.666 -8.150 1.00 . A A . 12 ARG HD2 1 1 2 564 1 1 13 ARG HD3 H 7.273 1.112 -8.832 1.00 . A A . 12 ARG HD3 1 1 2 565 1 1 13 ARG HE H 5.999 2.504 -10.857 1.00 . A A . 12 ARG HE 1 1 2 566 1 1 13 ARG HG2 H 4.957 0.670 -9.474 1.00 . A A . 12 ARG HG2 1 1 2 567 1 1 13 ARG HG3 H 4.471 2.229 -8.806 1.00 . A A . 12 ARG HG3 1 1 2 568 1 1 13 ARG HH11 H 9.713 3.772 -10.060 1.00 . A A . 12 ARG HH11 1 1 2 569 1 1 13 ARG HH12 H 8.831 2.885 -8.863 1.00 . A A . 12 ARG HH12 1 1 2 570 1 1 13 ARG HH21 H 7.152 3.673 -12.439 1.00 . A A . 12 ARG HH21 1 1 2 571 1 1 13 ARG HH22 H 8.758 4.221 -12.093 1.00 . A A . 12 ARG HH22 1 1 2 572 1 1 13 ARG N N 2.738 1.624 -7.010 1.00 . A A . 12 ARG N 1 1 2 573 1 1 13 ARG NE N 6.748 2.561 -10.227 1.00 . A A . 12 ARG NE 1 1 2 574 1 1 13 ARG NH1 N 8.884 3.293 -9.775 1.00 . A A . 12 ARG NH1 1 1 2 575 1 1 13 ARG NH2 N 7.927 3.742 -11.811 1.00 . A A . 12 ARG NH2 1 1 2 576 1 1 13 ARG O O 4.249 -1.203 -5.372 1.00 . A A . 12 ARG O 1 1 2 577 1 1 14 VAL C C 0.918 -0.345 -3.083 1.00 . A A . 13 VAL C 1 1 2 578 1 1 14 VAL CA C 2.391 -0.357 -3.475 1.00 . A A . 13 VAL CA 1 1 2 579 1 1 14 VAL CB C 3.194 0.448 -2.433 1.00 . A A . 13 VAL CB 1 1 2 580 1 1 14 VAL CG1 C 2.874 -0.020 -1.025 1.00 . A A . 13 VAL CG1 1 1 2 581 1 1 14 VAL CG2 C 4.685 0.339 -2.710 1.00 . A A . 13 VAL CG2 1 1 2 582 1 1 14 VAL H H 1.993 0.919 -5.101 1.00 . A A . 13 VAL H 1 1 2 583 1 1 14 VAL HA H 2.751 -1.375 -3.474 1.00 . A A . 13 VAL HA 1 1 2 584 1 1 14 VAL HB H 2.910 1.486 -2.516 1.00 . A A . 13 VAL HB 1 1 2 585 1 1 14 VAL HG11 H 1.819 0.110 -0.837 1.00 . A A . 13 VAL HG11 1 1 2 586 1 1 14 VAL HG12 H 3.440 0.566 -0.315 1.00 . A A . 13 VAL HG12 1 1 2 587 1 1 14 VAL HG13 H 3.133 -1.062 -0.923 1.00 . A A . 13 VAL HG13 1 1 2 588 1 1 14 VAL HG21 H 4.888 0.669 -3.718 1.00 . A A . 13 VAL HG21 1 1 2 589 1 1 14 VAL HG22 H 5.000 -0.687 -2.596 1.00 . A A . 13 VAL HG22 1 1 2 590 1 1 14 VAL HG23 H 5.227 0.961 -2.013 1.00 . A A . 13 VAL HG23 1 1 2 591 1 1 14 VAL N N 2.571 0.189 -4.810 1.00 . A A . 13 VAL N 1 1 2 592 1 1 14 VAL O O 0.373 0.699 -2.725 1.00 . A A . 13 VAL O 1 1 2 593 1 1 15 ASN C C -1.418 -0.999 -1.456 1.00 . A A . 14 ASN C 1 1 2 594 1 1 15 ASN CA C -1.130 -1.638 -2.813 1.00 . A A . 14 ASN CA 1 1 2 595 1 1 15 ASN CB C -1.545 -3.112 -2.801 1.00 . A A . 14 ASN CB 1 1 2 596 1 1 15 ASN CG C -0.456 -4.031 -2.270 1.00 . A A . 14 ASN CG 1 1 2 597 1 1 15 ASN H H 0.770 -2.297 -3.478 1.00 . A A . 14 ASN H 1 1 2 598 1 1 15 ASN HA H -1.704 -1.121 -3.567 1.00 . A A . 14 ASN HA 1 1 2 599 1 1 15 ASN HB2 H -2.419 -3.226 -2.177 1.00 . A A . 14 ASN HB2 1 1 2 600 1 1 15 ASN HB3 H -1.785 -3.418 -3.808 1.00 . A A . 14 ASN HB3 1 1 2 601 1 1 15 ASN HD21 H 1.101 -4.087 -1.035 1.00 . A A . 14 ASN HD21 1 1 2 602 1 1 15 ASN HD22 H 0.276 -2.574 -1.132 1.00 . A A . 14 ASN HD22 1 1 2 603 1 1 15 ASN N N 0.281 -1.508 -3.166 1.00 . A A . 14 ASN N 1 1 2 604 1 1 15 ASN ND2 N 0.392 -3.511 -1.391 1.00 . A A . 14 ASN ND2 1 1 2 605 1 1 15 ASN O O -1.220 -1.616 -0.410 1.00 . A A . 14 ASN O 1 1 2 606 1 1 15 ASN OD1 O -0.379 -5.199 -2.652 1.00 . A A . 14 ASN OD1 1 1 2 607 1 1 16 ARG C C -3.201 0.213 0.592 1.00 . A A . 15 ARG C 1 1 2 608 1 1 16 ARG CA C -2.197 0.978 -0.265 1.00 . A A . 15 ARG CA 1 1 2 609 1 1 16 ARG CB C -2.751 2.364 -0.605 1.00 . A A . 15 ARG CB 1 1 2 610 1 1 16 ARG CD C -1.700 3.592 1.324 1.00 . A A . 15 ARG CD 1 1 2 611 1 1 16 ARG CG C -2.998 3.240 0.613 1.00 . A A . 15 ARG CG 1 1 2 612 1 1 16 ARG CZ C -0.947 5.048 3.158 1.00 . A A . 15 ARG CZ 1 1 2 613 1 1 16 ARG H H -2.026 0.682 -2.353 1.00 . A A . 15 ARG H 1 1 2 614 1 1 16 ARG HA H -1.279 1.094 0.293 1.00 . A A . 15 ARG HA 1 1 2 615 1 1 16 ARG HB2 H -2.047 2.872 -1.249 1.00 . A A . 15 ARG HB2 1 1 2 616 1 1 16 ARG HB3 H -3.686 2.245 -1.132 1.00 . A A . 15 ARG HB3 1 1 2 617 1 1 16 ARG HD2 H -1.227 2.679 1.652 1.00 . A A . 15 ARG HD2 1 1 2 618 1 1 16 ARG HD3 H -1.052 4.102 0.628 1.00 . A A . 15 ARG HD3 1 1 2 619 1 1 16 ARG HE H -2.850 4.595 2.769 1.00 . A A . 15 ARG HE 1 1 2 620 1 1 16 ARG HG2 H -3.481 4.154 0.296 1.00 . A A . 15 ARG HG2 1 1 2 621 1 1 16 ARG HG3 H -3.641 2.711 1.301 1.00 . A A . 15 ARG HG3 1 1 2 622 1 1 16 ARG HH11 H 0.537 4.296 2.010 1.00 . A A . 15 ARG HH11 1 1 2 623 1 1 16 ARG HH12 H 1.050 5.322 3.306 1.00 . A A . 15 ARG HH12 1 1 2 624 1 1 16 ARG HH21 H -0.496 6.262 4.709 1.00 . A A . 15 ARG HH21 1 1 2 625 1 1 16 ARG HH22 H -2.184 5.949 4.478 1.00 . A A . 15 ARG HH22 1 1 2 626 1 1 16 ARG N N -1.886 0.245 -1.486 1.00 . A A . 15 ARG N 1 1 2 627 1 1 16 ARG NE N -1.925 4.453 2.481 1.00 . A A . 15 ARG NE 1 1 2 628 1 1 16 ARG NH1 N 0.317 4.874 2.795 1.00 . A A . 15 ARG NH1 1 1 2 629 1 1 16 ARG NH2 N -1.233 5.816 4.200 1.00 . A A . 15 ARG NH2 1 1 2 630 1 1 16 ARG O O -2.905 -0.165 1.726 1.00 . A A . 15 ARG O 1 1 2 631 1 1 17 HIS C C -5.187 -2.236 0.722 1.00 . A A . 16 HIS C 1 1 2 632 1 1 17 HIS CA C -5.440 -0.732 0.754 1.00 . A A . 16 HIS CA 1 1 2 633 1 1 17 HIS CB C -6.807 -0.419 0.144 1.00 . A A . 16 HIS CB 1 1 2 634 1 1 17 HIS CD2 C -7.640 1.793 1.212 1.00 . A A . 16 HIS CD2 1 1 2 635 1 1 17 HIS CE1 C -7.451 3.089 -0.548 1.00 . A A . 16 HIS CE1 1 1 2 636 1 1 17 HIS CG C -7.167 1.033 0.195 1.00 . A A . 16 HIS CG 1 1 2 637 1 1 17 HIS H H -4.567 0.315 -0.866 1.00 . A A . 16 HIS H 1 1 2 638 1 1 17 HIS HA H -5.430 -0.400 1.782 1.00 . A A . 16 HIS HA 1 1 2 639 1 1 17 HIS HB2 H -6.810 -0.726 -0.891 1.00 . A A . 16 HIS HB2 1 1 2 640 1 1 17 HIS HB3 H -7.567 -0.968 0.680 1.00 . A A . 16 HIS HB3 1 1 2 641 1 1 17 HIS HD1 H -6.746 1.619 -1.785 1.00 . A A . 16 HIS HD1 1 1 2 642 1 1 17 HIS HD2 H -7.846 1.462 2.220 1.00 . A A . 16 HIS HD2 1 1 2 643 1 1 17 HIS HE1 H -7.475 3.952 -1.195 1.00 . A A . 16 HIS HE1 1 1 2 644 1 1 17 HIS HE2 H -8.137 3.834 1.233 1.00 . A A . 16 HIS HE2 1 1 2 645 1 1 17 HIS N N -4.390 -0.012 0.042 1.00 . A A . 16 HIS N 1 1 2 646 1 1 17 HIS ND1 N -7.061 1.874 -0.893 1.00 . A A . 16 HIS ND1 1 1 2 647 1 1 17 HIS NE2 N -7.807 3.066 0.722 1.00 . A A . 16 HIS NE2 1 1 2 648 1 1 17 HIS O O -5.062 -2.830 -0.349 1.00 . A A . 16 HIS O 1 1 2 649 1 1 18 SER C C -6.173 -5.022 2.325 1.00 . A A . 17 SER C 1 1 2 650 1 1 18 SER CA C -4.879 -4.280 2.008 1.00 . A A . 17 SER CA 1 1 2 651 1 1 18 SER CB C -3.835 -4.566 3.089 1.00 . A A . 17 SER CB 1 1 2 652 1 1 18 SER H H -5.224 -2.316 2.719 1.00 . A A . 17 SER H 1 1 2 653 1 1 18 SER HA H -4.504 -4.625 1.057 1.00 . A A . 17 SER HA 1 1 2 654 1 1 18 SER HB2 H -2.908 -4.075 2.832 1.00 . A A . 17 SER HB2 1 1 2 655 1 1 18 SER HB3 H -4.190 -4.192 4.038 1.00 . A A . 17 SER HB3 1 1 2 656 1 1 18 SER HG H -3.581 -6.201 4.139 1.00 . A A . 17 SER HG 1 1 2 657 1 1 18 SER N N -5.115 -2.845 1.901 1.00 . A A . 17 SER N 1 1 2 658 1 1 18 SER O O -6.631 -5.853 1.541 1.00 . A A . 17 SER O 1 1 2 659 1 1 18 SER OG O -3.595 -5.959 3.210 1.00 . A A . 17 SER OG 1 1 2 660 1 1 19 THR C C -9.070 -4.312 4.216 1.00 . A A . 18 THR C 1 1 2 661 1 1 19 THR CA C -7.999 -5.352 3.902 1.00 . A A . 18 THR CA 1 1 2 662 1 1 19 THR CB C -7.782 -6.241 5.140 1.00 . A A . 18 THR CB 1 1 2 663 1 1 19 THR CG2 C -7.207 -5.433 6.294 1.00 . A A . 18 THR CG2 1 1 2 664 1 1 19 THR H H -6.343 -4.044 4.062 1.00 . A A . 18 THR H 1 1 2 665 1 1 19 THR HA H -8.345 -5.977 3.092 1.00 . A A . 18 THR HA 1 1 2 666 1 1 19 THR HB H -7.082 -7.023 4.885 1.00 . A A . 18 THR HB 1 1 2 667 1 1 19 THR HG1 H -9.641 -6.147 5.795 1.00 . A A . 18 THR HG1 1 1 2 668 1 1 19 THR HG21 H -7.060 -6.078 7.148 1.00 . A A . 18 THR HG21 1 1 2 669 1 1 19 THR HG22 H -7.892 -4.640 6.555 1.00 . A A . 18 THR HG22 1 1 2 670 1 1 19 THR HG23 H -6.259 -5.007 5.998 1.00 . A A . 18 THR HG23 1 1 2 671 1 1 19 THR N N -6.757 -4.715 3.480 1.00 . A A . 18 THR N 1 1 2 672 1 1 19 THR O O -8.766 -3.141 4.440 1.00 . A A . 18 THR O 1 1 2 673 1 1 19 THR OG1 O -9.022 -6.836 5.541 1.00 . A A . 18 THR OG1 1 1 2 674 1 1 20 ALA C C -12.409 -4.489 5.512 1.00 . A A . 19 ALA C 1 1 2 675 1 1 20 ALA CA C -11.443 -3.858 4.516 1.00 . A A . 19 ALA CA 1 1 2 676 1 1 20 ALA CB C -12.170 -3.495 3.230 1.00 . A A . 19 ALA CB 1 1 2 677 1 1 20 ALA H H -10.504 -5.695 4.043 1.00 . A A . 19 ALA H 1 1 2 678 1 1 20 ALA HA H -11.043 -2.950 4.944 1.00 . A A . 19 ALA HA 1 1 2 679 1 1 20 ALA HB1 H -12.953 -2.784 3.447 1.00 . A A . 19 ALA HB1 1 1 2 680 1 1 20 ALA HB2 H -12.602 -4.385 2.797 1.00 . A A . 19 ALA HB2 1 1 2 681 1 1 20 ALA HB3 H -11.470 -3.058 2.532 1.00 . A A . 19 ALA HB3 1 1 2 682 1 1 20 ALA N N -10.325 -4.750 4.230 1.00 . A A . 19 ALA N 1 1 2 683 1 1 20 ALA O O -12.360 -5.694 5.761 1.00 . A A . 19 ALA O 1 1 2 684 1 1 21 ILE C C -15.641 -3.543 6.769 1.00 . A A . 20 ILE C 1 1 2 685 1 1 21 ILE CA C -14.266 -4.145 7.048 1.00 . A A . 20 ILE CA 1 1 2 686 1 1 21 ILE CB C -13.830 -3.808 8.492 1.00 . A A . 20 ILE CB 1 1 2 687 1 1 21 ILE CD1 C -14.169 -4.464 10.933 1.00 . A A . 20 ILE CD1 1 1 2 688 1 1 21 ILE CG1 C -14.651 -4.613 9.506 1.00 . A A . 20 ILE CG1 1 1 2 689 1 1 21 ILE CG2 C -13.966 -2.313 8.755 1.00 . A A . 20 ILE CG2 1 1 2 690 1 1 21 ILE H H -13.276 -2.718 5.840 1.00 . A A . 20 ILE H 1 1 2 691 1 1 21 ILE HA H -14.330 -5.219 6.954 1.00 . A A . 20 ILE HA 1 1 2 692 1 1 21 ILE HB H -12.788 -4.070 8.597 1.00 . A A . 20 ILE HB 1 1 2 693 1 1 21 ILE HD11 H -13.144 -4.794 11.004 1.00 . A A . 20 ILE HD11 1 1 2 694 1 1 21 ILE HD12 H -14.787 -5.064 11.586 1.00 . A A . 20 ILE HD12 1 1 2 695 1 1 21 ILE HD13 H -14.235 -3.427 11.229 1.00 . A A . 20 ILE HD13 1 1 2 696 1 1 21 ILE HG12 H -15.679 -4.286 9.469 1.00 . A A . 20 ILE HG12 1 1 2 697 1 1 21 ILE HG13 H -14.601 -5.661 9.248 1.00 . A A . 20 ILE HG13 1 1 2 698 1 1 21 ILE HG21 H -13.620 -2.091 9.754 1.00 . A A . 20 ILE HG21 1 1 2 699 1 1 21 ILE HG22 H -15.002 -2.024 8.660 1.00 . A A . 20 ILE HG22 1 1 2 700 1 1 21 ILE HG23 H -13.372 -1.766 8.038 1.00 . A A . 20 ILE HG23 1 1 2 701 1 1 21 ILE N N -13.286 -3.668 6.080 1.00 . A A . 20 ILE N 1 1 2 702 1 1 21 ILE O O -16.537 -3.579 7.613 1.00 . A A . 20 ILE O 1 1 2 703 1 1 22 GLY C C -17.262 -1.024 5.809 1.00 . A A . 21 GLY C 1 1 2 704 1 1 22 GLY CA C -17.064 -2.393 5.188 1.00 . A A . 21 GLY CA 1 1 2 705 1 1 22 GLY H H -15.055 -3.011 4.935 1.00 . A A . 21 GLY H 1 1 2 706 1 1 22 GLY HA2 H -17.094 -2.296 4.113 1.00 . A A . 21 GLY HA2 1 1 2 707 1 1 22 GLY HA3 H -17.869 -3.039 5.505 1.00 . A A . 21 GLY HA3 1 1 2 708 1 1 22 GLY N N -15.801 -2.998 5.569 1.00 . A A . 21 GLY N 1 1 2 709 1 1 22 GLY O O -16.567 -0.070 5.457 1.00 . A A . 21 GLY O 1 1 2 710 1 1 23 ARG C C -17.915 0.346 8.817 1.00 . A A . 22 ARG C 1 1 2 711 1 1 23 ARG CA C -18.499 0.334 7.408 1.00 . A A . 22 ARG CA 1 1 2 712 1 1 23 ARG CB C -20.009 0.571 7.466 1.00 . A A . 22 ARG CB 1 1 2 713 1 1 23 ARG CD C -22.163 0.885 6.210 1.00 . A A . 22 ARG CD 1 1 2 714 1 1 23 ARG CG C -20.668 0.639 6.098 1.00 . A A . 22 ARG CG 1 1 2 715 1 1 23 ARG CZ C -23.694 2.607 7.077 1.00 . A A . 22 ARG CZ 1 1 2 716 1 1 23 ARG H H -18.730 -1.725 6.973 1.00 . A A . 22 ARG H 1 1 2 717 1 1 23 ARG HA H -18.041 1.126 6.835 1.00 . A A . 22 ARG HA 1 1 2 718 1 1 23 ARG HB2 H -20.467 -0.233 8.023 1.00 . A A . 22 ARG HB2 1 1 2 719 1 1 23 ARG HB3 H -20.196 1.504 7.978 1.00 . A A . 22 ARG HB3 1 1 2 720 1 1 23 ARG HD2 H -22.586 0.914 5.217 1.00 . A A . 22 ARG HD2 1 1 2 721 1 1 23 ARG HD3 H -22.608 0.072 6.767 1.00 . A A . 22 ARG HD3 1 1 2 722 1 1 23 ARG HE H -21.705 2.669 7.224 1.00 . A A . 22 ARG HE 1 1 2 723 1 1 23 ARG HG2 H -20.222 1.444 5.534 1.00 . A A . 22 ARG HG2 1 1 2 724 1 1 23 ARG HG3 H -20.504 -0.297 5.584 1.00 . A A . 22 ARG HG3 1 1 2 725 1 1 23 ARG HH11 H -25.664 2.269 6.780 1.00 . A A . 22 ARG HH11 1 1 2 726 1 1 23 ARG HH12 H -24.603 1.048 6.164 1.00 . A A . 22 ARG HH12 1 1 2 727 1 1 23 ARG HH21 H -24.808 4.107 7.845 1.00 . A A . 22 ARG HH21 1 1 2 728 1 1 23 ARG HH22 H -23.096 4.282 8.036 1.00 . A A . 22 ARG HH22 1 1 2 729 1 1 23 ARG N N -18.210 -0.928 6.735 1.00 . A A . 22 ARG N 1 1 2 730 1 1 23 ARG NE N -22.462 2.143 6.889 1.00 . A A . 22 ARG NE 1 1 2 731 1 1 23 ARG NH1 N -24.739 1.918 6.637 1.00 . A A . 22 ARG NH1 1 1 2 732 1 1 23 ARG NH2 N -23.882 3.760 7.704 1.00 . A A . 22 ARG NH2 1 1 2 733 1 1 23 ARG O O -18.610 -0.107 9.749 1.00 . A A . 22 ARG O 1 1 2 734 1 1 23 ARG OXT O -16.765 0.808 8.975 1.00 . A A . 22 ARG OXT 1 1 3 735 1 1 1 ACE C C 5.547 1.011 11.018 1.00 . A A . 0 ACE C 1 1 3 736 1 1 1 ACE CH3 C 5.887 0.177 12.222 1.00 . A A . 0 ACE CH3 1 1 3 737 1 1 1 ACE H1 H 6.429 -0.705 11.893 1.00 . A A . 0 ACE H1 1 1 3 738 1 1 1 ACE H2 H 4.984 -0.124 12.716 1.00 . A A . 0 ACE H2 1 1 3 739 1 1 1 ACE H3 H 6.488 0.775 12.900 1.00 . A A . 0 ACE H3 1 1 3 740 1 1 1 ACE O O 4.461 0.886 10.450 1.00 . A A . 0 ACE O 1 1 3 741 1 1 2 MET C C 6.592 2.005 8.165 1.00 . A A . 1 MET C 1 1 3 742 1 1 2 MET CA C 6.272 2.738 9.463 1.00 . A A . 1 MET CA 1 1 3 743 1 1 2 MET CB C 7.142 3.993 9.573 1.00 . A A . 1 MET CB 1 1 3 744 1 1 2 MET CE C 8.582 4.054 12.430 1.00 . A A . 1 MET CE 1 1 3 745 1 1 2 MET CG C 6.676 4.975 10.638 1.00 . A A . 1 MET CG 1 1 3 746 1 1 2 MET H H 7.322 1.924 11.111 1.00 . A A . 1 MET H 1 1 3 747 1 1 2 MET HA H 5.234 3.032 9.450 1.00 . A A . 1 MET HA 1 1 3 748 1 1 2 MET HB2 H 8.153 3.695 9.809 1.00 . A A . 1 MET HB2 1 1 3 749 1 1 2 MET HB3 H 7.140 4.503 8.622 1.00 . A A . 1 MET HB3 1 1 3 750 1 1 2 MET HE1 H 8.897 3.361 11.664 1.00 . A A . 1 MET HE1 1 1 3 751 1 1 2 MET HE2 H 8.821 3.650 13.402 1.00 . A A . 1 MET HE2 1 1 3 752 1 1 2 MET HE3 H 9.094 4.996 12.296 1.00 . A A . 1 MET HE3 1 1 3 753 1 1 2 MET HG2 H 7.278 5.870 10.569 1.00 . A A . 1 MET HG2 1 1 3 754 1 1 2 MET HG3 H 5.642 5.223 10.449 1.00 . A A . 1 MET HG3 1 1 3 755 1 1 2 MET N N 6.478 1.871 10.617 1.00 . A A . 1 MET N 1 1 3 756 1 1 2 MET O O 7.758 1.786 7.837 1.00 . A A . 1 MET O 1 1 3 757 1 1 2 MET SD S 6.813 4.313 12.310 1.00 . A A . 1 MET SD 1 1 3 758 1 1 3 ASN C C 5.232 1.782 5.005 1.00 . A A . 2 ASN C 1 1 3 759 1 1 3 ASN CA C 5.728 0.925 6.165 1.00 . A A . 2 ASN CA 1 1 3 760 1 1 3 ASN CB C 4.987 -0.414 6.177 1.00 . A A . 2 ASN CB 1 1 3 761 1 1 3 ASN CG C 5.571 -1.419 5.194 1.00 . A A . 2 ASN CG 1 1 3 762 1 1 3 ASN H H 4.644 1.821 7.747 1.00 . A A . 2 ASN H 1 1 3 763 1 1 3 ASN HA H 6.784 0.741 6.033 1.00 . A A . 2 ASN HA 1 1 3 764 1 1 3 ASN HB2 H 5.041 -0.837 7.169 1.00 . A A . 2 ASN HB2 1 1 3 765 1 1 3 ASN HB3 H 3.952 -0.247 5.918 1.00 . A A . 2 ASN HB3 1 1 3 766 1 1 3 ASN HD21 H 6.277 0.045 4.038 1.00 . A A . 2 ASN HD21 1 1 3 767 1 1 3 ASN HD22 H 6.592 -1.560 3.490 1.00 . A A . 2 ASN HD22 1 1 3 768 1 1 3 ASN N N 5.550 1.625 7.430 1.00 . A A . 2 ASN N 1 1 3 769 1 1 3 ASN ND2 N 6.212 -0.928 4.134 1.00 . A A . 2 ASN ND2 1 1 3 770 1 1 3 ASN O O 4.925 1.272 3.927 1.00 . A A . 2 ASN O 1 1 3 771 1 1 3 ASN OD1 O 5.454 -2.628 5.390 1.00 . A A . 2 ASN OD1 1 1 3 772 1 1 4 TRP C C 5.732 4.073 3.090 1.00 . A A . 3 TRP C 1 1 3 773 1 1 4 TRP CA C 4.698 3.995 4.185 1.00 . A A . 3 TRP CA 1 1 3 774 1 1 4 TRP CB C 4.470 5.398 4.719 1.00 . A A . 3 TRP CB 1 1 3 775 1 1 4 TRP CD1 C 5.970 5.933 6.705 1.00 . A A . 3 TRP CD1 1 1 3 776 1 1 4 TRP CD2 C 6.741 6.705 4.759 1.00 . A A . 3 TRP CD2 1 1 3 777 1 1 4 TRP CE2 C 7.634 7.085 5.774 1.00 . A A . 3 TRP CE2 1 1 3 778 1 1 4 TRP CE3 C 7.024 7.071 3.445 1.00 . A A . 3 TRP CE3 1 1 3 779 1 1 4 TRP CG C 5.674 5.984 5.383 1.00 . A A . 3 TRP CG 1 1 3 780 1 1 4 TRP CH2 C 9.037 8.164 4.213 1.00 . A A . 3 TRP CH2 1 1 3 781 1 1 4 TRP CZ2 C 8.785 7.818 5.511 1.00 . A A . 3 TRP CZ2 1 1 3 782 1 1 4 TRP CZ3 C 8.169 7.795 3.183 1.00 . A A . 3 TRP CZ3 1 1 3 783 1 1 4 TRP H H 5.381 3.444 6.111 1.00 . A A . 3 TRP H 1 1 3 784 1 1 4 TRP HA H 3.777 3.617 3.779 1.00 . A A . 3 TRP HA 1 1 3 785 1 1 4 TRP HB2 H 4.206 6.044 3.892 1.00 . A A . 3 TRP HB2 1 1 3 786 1 1 4 TRP HB3 H 3.662 5.381 5.434 1.00 . A A . 3 TRP HB3 1 1 3 787 1 1 4 TRP HD1 H 5.358 5.439 7.433 1.00 . A A . 3 TRP HD1 1 1 3 788 1 1 4 TRP HE1 H 7.555 6.719 7.837 1.00 . A A . 3 TRP HE1 1 1 3 789 1 1 4 TRP HE3 H 6.369 6.788 2.638 1.00 . A A . 3 TRP HE3 1 1 3 790 1 1 4 TRP HH2 H 9.922 8.732 3.966 1.00 . A A . 3 TRP HH2 1 1 3 791 1 1 4 TRP HZ2 H 9.457 8.114 6.291 1.00 . A A . 3 TRP HZ2 1 1 3 792 1 1 4 TRP HZ3 H 8.402 8.087 2.169 1.00 . A A . 3 TRP HZ3 1 1 3 793 1 1 4 TRP N N 5.143 3.087 5.230 1.00 . A A . 3 TRP N 1 1 3 794 1 1 4 TRP NE1 N 7.141 6.606 6.956 1.00 . A A . 3 TRP NE1 1 1 3 795 1 1 4 TRP O O 5.433 4.513 1.983 1.00 . A A . 3 TRP O 1 1 3 796 1 1 5 THR C C 7.608 3.316 1.083 1.00 . A A . 4 THR C 1 1 3 797 1 1 5 THR CA C 8.060 3.694 2.489 1.00 . A A . 4 THR CA 1 1 3 798 1 1 5 THR CB C 9.201 2.755 2.926 1.00 . A A . 4 THR CB 1 1 3 799 1 1 5 THR CG2 C 10.395 2.879 1.991 1.00 . A A . 4 THR CG2 1 1 3 800 1 1 5 THR H H 7.105 3.318 4.330 1.00 . A A . 4 THR H 1 1 3 801 1 1 5 THR HA H 8.438 4.706 2.483 1.00 . A A . 4 THR HA 1 1 3 802 1 1 5 THR HB H 8.841 1.737 2.894 1.00 . A A . 4 THR HB 1 1 3 803 1 1 5 THR HG1 H 10.010 3.937 4.283 1.00 . A A . 4 THR HG1 1 1 3 804 1 1 5 THR HG21 H 10.093 2.623 0.986 1.00 . A A . 4 THR HG21 1 1 3 805 1 1 5 THR HG22 H 11.177 2.208 2.314 1.00 . A A . 4 THR HG22 1 1 3 806 1 1 5 THR HG23 H 10.762 3.895 2.009 1.00 . A A . 4 THR HG23 1 1 3 807 1 1 5 THR N N 6.950 3.658 3.424 1.00 . A A . 4 THR N 1 1 3 808 1 1 5 THR O O 7.708 2.160 0.673 1.00 . A A . 4 THR O 1 1 3 809 1 1 5 THR OG1 O 9.606 3.066 4.265 1.00 . A A . 4 THR OG1 1 1 3 810 1 1 6 GLY C C 5.720 5.176 -1.500 1.00 . A A . 5 GLY C 1 1 3 811 1 1 6 GLY CA C 6.623 4.064 -0.989 1.00 . A A . 5 GLY CA 1 1 3 812 1 1 6 GLY H H 7.040 5.203 0.737 1.00 . A A . 5 GLY H 1 1 3 813 1 1 6 GLY HA2 H 7.473 3.974 -1.648 1.00 . A A . 5 GLY HA2 1 1 3 814 1 1 6 GLY HA3 H 6.072 3.133 -1.000 1.00 . A A . 5 GLY HA3 1 1 3 815 1 1 6 GLY N N 7.097 4.303 0.354 1.00 . A A . 5 GLY N 1 1 3 816 1 1 6 GLY O O 5.583 5.355 -2.702 1.00 . A A . 5 GLY O 1 1 3 817 1 1 7 LEU C C 4.900 8.139 -1.740 1.00 . A A . 6 LEU C 1 1 3 818 1 1 7 LEU CA C 4.213 7.035 -0.941 1.00 . A A . 6 LEU CA 1 1 3 819 1 1 7 LEU CB C 3.604 7.643 0.323 1.00 . A A . 6 LEU CB 1 1 3 820 1 1 7 LEU CD1 C 5.564 9.023 1.116 1.00 . A A . 6 LEU CD1 1 1 3 821 1 1 7 LEU CD2 C 3.878 8.209 2.761 1.00 . A A . 6 LEU CD2 1 1 3 822 1 1 7 LEU CG C 4.599 7.896 1.461 1.00 . A A . 6 LEU CG 1 1 3 823 1 1 7 LEU H H 5.297 5.759 0.366 1.00 . A A . 6 LEU H 1 1 3 824 1 1 7 LEU HA H 3.422 6.618 -1.542 1.00 . A A . 6 LEU HA 1 1 3 825 1 1 7 LEU HB2 H 3.148 8.584 0.056 1.00 . A A . 6 LEU HB2 1 1 3 826 1 1 7 LEU HB3 H 2.837 6.977 0.684 1.00 . A A . 6 LEU HB3 1 1 3 827 1 1 7 LEU HD11 H 6.138 8.752 0.243 1.00 . A A . 6 LEU HD11 1 1 3 828 1 1 7 LEU HD12 H 6.234 9.191 1.950 1.00 . A A . 6 LEU HD12 1 1 3 829 1 1 7 LEU HD13 H 5.006 9.926 0.916 1.00 . A A . 6 LEU HD13 1 1 3 830 1 1 7 LEU HD21 H 3.209 7.397 3.005 1.00 . A A . 6 LEU HD21 1 1 3 831 1 1 7 LEU HD22 H 3.312 9.121 2.651 1.00 . A A . 6 LEU HD22 1 1 3 832 1 1 7 LEU HD23 H 4.605 8.327 3.555 1.00 . A A . 6 LEU HD23 1 1 3 833 1 1 7 LEU HG H 5.181 7.002 1.614 1.00 . A A . 6 LEU HG 1 1 3 834 1 1 7 LEU N N 5.125 5.937 -0.582 1.00 . A A . 6 LEU N 1 1 3 835 1 1 7 LEU O O 4.346 9.225 -1.913 1.00 . A A . 6 LEU O 1 1 3 836 1 1 8 TYR C C 7.494 8.233 -4.232 1.00 . A A . 7 TYR C 1 1 3 837 1 1 8 TYR CA C 6.854 8.846 -2.985 1.00 . A A . 7 TYR CA 1 1 3 838 1 1 8 TYR CB C 7.926 9.472 -2.092 1.00 . A A . 7 TYR CB 1 1 3 839 1 1 8 TYR CD1 C 8.257 7.442 -0.660 1.00 . A A . 7 TYR CD1 1 1 3 840 1 1 8 TYR CD2 C 10.186 8.451 -1.619 1.00 . A A . 7 TYR CD2 1 1 3 841 1 1 8 TYR CE1 C 9.033 6.482 -0.085 1.00 . A A . 7 TYR CE1 1 1 3 842 1 1 8 TYR CE2 C 10.983 7.486 -1.034 1.00 . A A . 7 TYR CE2 1 1 3 843 1 1 8 TYR CG C 8.810 8.445 -1.436 1.00 . A A . 7 TYR CG 1 1 3 844 1 1 8 TYR CZ C 10.399 6.499 -0.267 1.00 . A A . 7 TYR CZ 1 1 3 845 1 1 8 TYR H H 6.482 6.988 -2.059 1.00 . A A . 7 TYR H 1 1 3 846 1 1 8 TYR HA H 6.168 9.606 -3.287 1.00 . A A . 7 TYR HA 1 1 3 847 1 1 8 TYR HB2 H 8.548 10.124 -2.685 1.00 . A A . 7 TYR HB2 1 1 3 848 1 1 8 TYR HB3 H 7.445 10.042 -1.313 1.00 . A A . 7 TYR HB3 1 1 3 849 1 1 8 TYR HD1 H 7.184 7.426 -0.498 1.00 . A A . 7 TYR HD1 1 1 3 850 1 1 8 TYR HD2 H 10.635 9.228 -2.221 1.00 . A A . 7 TYR HD2 1 1 3 851 1 1 8 TYR HE1 H 8.562 5.717 0.495 1.00 . A A . 7 TYR HE1 1 1 3 852 1 1 8 TYR HE2 H 12.053 7.505 -1.180 1.00 . A A . 7 TYR HE2 1 1 3 853 1 1 8 TYR HH H 10.776 4.668 0.182 1.00 . A A . 7 TYR HH 1 1 3 854 1 1 8 TYR N N 6.096 7.865 -2.226 1.00 . A A . 7 TYR N 1 1 3 855 1 1 8 TYR O O 7.607 8.892 -5.266 1.00 . A A . 7 TYR O 1 1 3 856 1 1 8 TYR OH O 11.182 5.527 0.315 1.00 . A A . 7 TYR OH 1 1 3 857 1 1 9 THR C C 7.775 5.010 -5.607 1.00 . A A . 8 THR C 1 1 3 858 1 1 9 THR CA C 8.534 6.280 -5.256 1.00 . A A . 8 THR CA 1 1 3 859 1 1 9 THR CB C 9.990 5.898 -4.946 1.00 . A A . 8 THR CB 1 1 3 860 1 1 9 THR CG2 C 10.849 7.138 -4.746 1.00 . A A . 8 THR CG2 1 1 3 861 1 1 9 THR H H 7.792 6.498 -3.282 1.00 . A A . 8 THR H 1 1 3 862 1 1 9 THR HA H 8.526 6.942 -6.107 1.00 . A A . 8 THR HA 1 1 3 863 1 1 9 THR HB H 10.383 5.335 -5.779 1.00 . A A . 8 THR HB 1 1 3 864 1 1 9 THR HG1 H 9.307 4.447 -3.801 1.00 . A A . 8 THR HG1 1 1 3 865 1 1 9 THR HG21 H 11.819 6.847 -4.371 1.00 . A A . 8 THR HG21 1 1 3 866 1 1 9 THR HG22 H 10.370 7.797 -4.038 1.00 . A A . 8 THR HG22 1 1 3 867 1 1 9 THR HG23 H 10.966 7.649 -5.690 1.00 . A A . 8 THR HG23 1 1 3 868 1 1 9 THR N N 7.909 6.973 -4.131 1.00 . A A . 8 THR N 1 1 3 869 1 1 9 THR O O 8.278 4.152 -6.332 1.00 . A A . 8 THR O 1 1 3 870 1 1 9 THR OG1 O 10.032 5.078 -3.773 1.00 . A A . 8 THR OG1 1 1 3 871 1 1 10 LEU C C 4.273 4.110 -5.493 1.00 . A A . 9 LEU C 1 1 3 872 1 1 10 LEU CA C 5.735 3.729 -5.336 1.00 . A A . 9 LEU CA 1 1 3 873 1 1 10 LEU CB C 5.911 2.724 -4.197 1.00 . A A . 9 LEU CB 1 1 3 874 1 1 10 LEU CD1 C 7.415 1.202 -2.891 1.00 . A A . 9 LEU CD1 1 1 3 875 1 1 10 LEU CD2 C 7.551 1.237 -5.384 1.00 . A A . 9 LEU CD2 1 1 3 876 1 1 10 LEU CG C 7.292 2.064 -4.134 1.00 . A A . 9 LEU CG 1 1 3 877 1 1 10 LEU H H 6.210 5.629 -4.541 1.00 . A A . 9 LEU H 1 1 3 878 1 1 10 LEU HA H 6.066 3.279 -6.244 1.00 . A A . 9 LEU HA 1 1 3 879 1 1 10 LEU HB2 H 5.740 3.238 -3.261 1.00 . A A . 9 LEU HB2 1 1 3 880 1 1 10 LEU HB3 H 5.167 1.949 -4.306 1.00 . A A . 9 LEU HB3 1 1 3 881 1 1 10 LEU HD11 H 6.650 0.440 -2.907 1.00 . A A . 9 LEU HD11 1 1 3 882 1 1 10 LEU HD12 H 7.292 1.819 -2.014 1.00 . A A . 9 LEU HD12 1 1 3 883 1 1 10 LEU HD13 H 8.388 0.738 -2.873 1.00 . A A . 9 LEU HD13 1 1 3 884 1 1 10 LEU HD21 H 8.505 0.740 -5.295 1.00 . A A . 9 LEU HD21 1 1 3 885 1 1 10 LEU HD22 H 7.561 1.884 -6.248 1.00 . A A . 9 LEU HD22 1 1 3 886 1 1 10 LEU HD23 H 6.770 0.499 -5.495 1.00 . A A . 9 LEU HD23 1 1 3 887 1 1 10 LEU HG H 8.048 2.833 -4.082 1.00 . A A . 9 LEU HG 1 1 3 888 1 1 10 LEU N N 6.561 4.900 -5.093 1.00 . A A . 9 LEU N 1 1 3 889 1 1 10 LEU O O 3.684 3.932 -6.557 1.00 . A A . 9 LEU O 1 1 3 890 1 1 11 LEU C C 1.397 4.026 -4.997 1.00 . A A . 10 LEU C 1 1 3 891 1 1 11 LEU CA C 2.322 5.083 -4.397 1.00 . A A . 10 LEU CA 1 1 3 892 1 1 11 LEU CB C 2.167 6.414 -5.130 1.00 . A A . 10 LEU CB 1 1 3 893 1 1 11 LEU CD1 C 4.463 7.385 -4.781 1.00 . A A . 10 LEU CD1 1 1 3 894 1 1 11 LEU CD2 C 2.498 8.901 -5.097 1.00 . A A . 10 LEU CD2 1 1 3 895 1 1 11 LEU CG C 2.972 7.571 -4.530 1.00 . A A . 10 LEU CG 1 1 3 896 1 1 11 LEU H H 4.272 4.800 -3.642 1.00 . A A . 10 LEU H 1 1 3 897 1 1 11 LEU HA H 2.050 5.225 -3.362 1.00 . A A . 10 LEU HA 1 1 3 898 1 1 11 LEU HB2 H 2.481 6.277 -6.154 1.00 . A A . 10 LEU HB2 1 1 3 899 1 1 11 LEU HB3 H 1.123 6.687 -5.123 1.00 . A A . 10 LEU HB3 1 1 3 900 1 1 11 LEU HD11 H 4.903 6.835 -3.957 1.00 . A A . 10 LEU HD11 1 1 3 901 1 1 11 LEU HD12 H 4.939 8.351 -4.859 1.00 . A A . 10 LEU HD12 1 1 3 902 1 1 11 LEU HD13 H 4.610 6.836 -5.698 1.00 . A A . 10 LEU HD13 1 1 3 903 1 1 11 LEU HD21 H 1.453 9.041 -4.861 1.00 . A A . 10 LEU HD21 1 1 3 904 1 1 11 LEU HD22 H 2.629 8.902 -6.169 1.00 . A A . 10 LEU HD22 1 1 3 905 1 1 11 LEU HD23 H 3.075 9.704 -4.663 1.00 . A A . 10 LEU HD23 1 1 3 906 1 1 11 LEU HG H 2.818 7.587 -3.462 1.00 . A A . 10 LEU HG 1 1 3 907 1 1 11 LEU N N 3.718 4.656 -4.428 1.00 . A A . 10 LEU N 1 1 3 908 1 1 11 LEU O O 0.858 3.182 -4.280 1.00 . A A . 10 LEU O 1 1 3 909 1 1 12 SER C C 1.005 1.734 -7.030 1.00 . A A . 11 SER C 1 1 3 910 1 1 12 SER CA C 0.360 3.118 -7.005 1.00 . A A . 11 SER CA 1 1 3 911 1 1 12 SER CB C 0.080 3.590 -8.432 1.00 . A A . 11 SER CB 1 1 3 912 1 1 12 SER H H 1.668 4.773 -6.832 1.00 . A A . 11 SER H 1 1 3 913 1 1 12 SER HA H -0.573 3.057 -6.465 1.00 . A A . 11 SER HA 1 1 3 914 1 1 12 SER HB2 H -0.556 2.872 -8.929 1.00 . A A . 11 SER HB2 1 1 3 915 1 1 12 SER HB3 H -0.416 4.549 -8.401 1.00 . A A . 11 SER HB3 1 1 3 916 1 1 12 SER HG H 1.076 3.836 -10.101 1.00 . A A . 11 SER HG 1 1 3 917 1 1 12 SER N N 1.215 4.076 -6.313 1.00 . A A . 11 SER N 1 1 3 918 1 1 12 SER O O 0.442 0.787 -7.579 1.00 . A A . 11 SER O 1 1 3 919 1 1 12 SER OG O 1.282 3.722 -9.171 1.00 . A A . 11 SER OG 1 1 3 920 1 1 13 ARG C C 2.862 -0.235 -4.984 1.00 . A A . 12 ARG C 1 1 3 921 1 1 13 ARG CA C 2.914 0.364 -6.385 1.00 . A A . 12 ARG CA 1 1 3 922 1 1 13 ARG CB C 4.371 0.573 -6.803 1.00 . A A . 12 ARG CB 1 1 3 923 1 1 13 ARG CD C 5.989 1.630 -8.411 1.00 . A A . 12 ARG CD 1 1 3 924 1 1 13 ARG CG C 4.529 1.316 -8.121 1.00 . A A . 12 ARG CG 1 1 3 925 1 1 13 ARG CZ C 8.112 0.423 -8.718 1.00 . A A . 12 ARG CZ 1 1 3 926 1 1 13 ARG H H 2.581 2.419 -6.011 1.00 . A A . 12 ARG H 1 1 3 927 1 1 13 ARG HA H 2.440 -0.317 -7.071 1.00 . A A . 12 ARG HA 1 1 3 928 1 1 13 ARG HB2 H 4.875 1.138 -6.034 1.00 . A A . 12 ARG HB2 1 1 3 929 1 1 13 ARG HB3 H 4.847 -0.391 -6.900 1.00 . A A . 12 ARG HB3 1 1 3 930 1 1 13 ARG HD2 H 6.047 2.191 -9.330 1.00 . A A . 12 ARG HD2 1 1 3 931 1 1 13 ARG HD3 H 6.385 2.226 -7.600 1.00 . A A . 12 ARG HD3 1 1 3 932 1 1 13 ARG HE H 6.327 -0.442 -8.497 1.00 . A A . 12 ARG HE 1 1 3 933 1 1 13 ARG HG2 H 4.138 0.701 -8.918 1.00 . A A . 12 ARG HG2 1 1 3 934 1 1 13 ARG HG3 H 3.974 2.241 -8.071 1.00 . A A . 12 ARG HG3 1 1 3 935 1 1 13 ARG HH11 H 8.277 2.438 -8.701 1.00 . A A . 12 ARG HH11 1 1 3 936 1 1 13 ARG HH12 H 9.761 1.573 -8.916 1.00 . A A . 12 ARG HH12 1 1 3 937 1 1 13 ARG HH21 H 8.278 -1.589 -8.779 1.00 . A A . 12 ARG HH21 1 1 3 938 1 1 13 ARG HH22 H 9.763 -0.716 -8.961 1.00 . A A . 12 ARG HH22 1 1 3 939 1 1 13 ARG N N 2.187 1.628 -6.432 1.00 . A A . 12 ARG N 1 1 3 940 1 1 13 ARG NE N 6.793 0.418 -8.542 1.00 . A A . 12 ARG NE 1 1 3 941 1 1 13 ARG NH1 N 8.770 1.572 -8.783 1.00 . A A . 12 ARG NH1 1 1 3 942 1 1 13 ARG NH2 N 8.771 -0.721 -8.829 1.00 . A A . 12 ARG NH2 1 1 3 943 1 1 13 ARG O O 3.578 -1.188 -4.677 1.00 . A A . 12 ARG O 1 1 3 944 1 1 14 VAL C C 0.526 -0.850 -2.575 1.00 . A A . 13 VAL C 1 1 3 945 1 1 14 VAL CA C 1.858 -0.132 -2.771 1.00 . A A . 13 VAL CA 1 1 3 946 1 1 14 VAL CB C 1.951 1.038 -1.775 1.00 . A A . 13 VAL CB 1 1 3 947 1 1 14 VAL CG1 C 2.036 0.522 -0.350 1.00 . A A . 13 VAL CG1 1 1 3 948 1 1 14 VAL CG2 C 3.143 1.926 -2.102 1.00 . A A . 13 VAL CG2 1 1 3 949 1 1 14 VAL H H 1.461 1.082 -4.452 1.00 . A A . 13 VAL H 1 1 3 950 1 1 14 VAL HA H 2.664 -0.822 -2.561 1.00 . A A . 13 VAL HA 1 1 3 951 1 1 14 VAL HB H 1.053 1.631 -1.866 1.00 . A A . 13 VAL HB 1 1 3 952 1 1 14 VAL HG11 H 2.908 -0.107 -0.248 1.00 . A A . 13 VAL HG11 1 1 3 953 1 1 14 VAL HG12 H 1.150 -0.050 -0.123 1.00 . A A . 13 VAL HG12 1 1 3 954 1 1 14 VAL HG13 H 2.112 1.357 0.331 1.00 . A A . 13 VAL HG13 1 1 3 955 1 1 14 VAL HG21 H 3.188 2.742 -1.396 1.00 . A A . 13 VAL HG21 1 1 3 956 1 1 14 VAL HG22 H 3.035 2.320 -3.101 1.00 . A A . 13 VAL HG22 1 1 3 957 1 1 14 VAL HG23 H 4.052 1.346 -2.040 1.00 . A A . 13 VAL HG23 1 1 3 958 1 1 14 VAL N N 2.007 0.333 -4.142 1.00 . A A . 13 VAL N 1 1 3 959 1 1 14 VAL O O -0.356 -0.359 -1.871 1.00 . A A . 13 VAL O 1 1 3 960 1 1 15 ASN C C -2.067 -1.954 -3.415 1.00 . A A . 14 ASN C 1 1 3 961 1 1 15 ASN CA C -0.834 -2.804 -3.113 1.00 . A A . 14 ASN CA 1 1 3 962 1 1 15 ASN CB C -0.957 -3.437 -1.724 1.00 . A A . 14 ASN CB 1 1 3 963 1 1 15 ASN CG C 0.055 -4.543 -1.488 1.00 . A A . 14 ASN CG 1 1 3 964 1 1 15 ASN H H 1.129 -2.345 -3.758 1.00 . A A . 14 ASN H 1 1 3 965 1 1 15 ASN HA H -0.772 -3.592 -3.849 1.00 . A A . 14 ASN HA 1 1 3 966 1 1 15 ASN HB2 H -0.805 -2.673 -0.975 1.00 . A A . 14 ASN HB2 1 1 3 967 1 1 15 ASN HB3 H -1.947 -3.852 -1.612 1.00 . A A . 14 ASN HB3 1 1 3 968 1 1 15 ASN HD21 H 1.373 -3.642 -2.676 1.00 . A A . 14 ASN HD21 1 1 3 969 1 1 15 ASN HD22 H 1.894 -5.128 -1.970 1.00 . A A . 14 ASN HD22 1 1 3 970 1 1 15 ASN N N 0.389 -2.012 -3.210 1.00 . A A . 14 ASN N 1 1 3 971 1 1 15 ASN ND2 N 1.225 -4.425 -2.107 1.00 . A A . 14 ASN ND2 1 1 3 972 1 1 15 ASN O O -2.464 -1.812 -4.572 1.00 . A A . 14 ASN O 1 1 3 973 1 1 15 ASN OD1 O -0.211 -5.495 -0.755 1.00 . A A . 14 ASN OD1 1 1 3 974 1 1 16 ARG C C -4.260 0.060 -1.181 1.00 . A A . 15 ARG C 1 1 3 975 1 1 16 ARG CA C -3.847 -0.546 -2.520 1.00 . A A . 15 ARG CA 1 1 3 976 1 1 16 ARG CB C -5.006 -1.357 -3.108 1.00 . A A . 15 ARG CB 1 1 3 977 1 1 16 ARG CD C -6.456 -3.405 -2.973 1.00 . A A . 15 ARG CD 1 1 3 978 1 1 16 ARG CG C -5.325 -2.623 -2.328 1.00 . A A . 15 ARG CG 1 1 3 979 1 1 16 ARG CZ C -6.901 -4.611 -5.071 1.00 . A A . 15 ARG CZ 1 1 3 980 1 1 16 ARG H H -2.296 -1.534 -1.472 1.00 . A A . 15 ARG H 1 1 3 981 1 1 16 ARG HA H -3.598 0.254 -3.201 1.00 . A A . 15 ARG HA 1 1 3 982 1 1 16 ARG HB2 H -5.892 -0.738 -3.124 1.00 . A A . 15 ARG HB2 1 1 3 983 1 1 16 ARG HB3 H -4.757 -1.638 -4.121 1.00 . A A . 15 ARG HB3 1 1 3 984 1 1 16 ARG HD2 H -6.652 -4.286 -2.379 1.00 . A A . 15 ARG HD2 1 1 3 985 1 1 16 ARG HD3 H -7.339 -2.784 -2.996 1.00 . A A . 15 ARG HD3 1 1 3 986 1 1 16 ARG HE H -5.292 -3.483 -4.721 1.00 . A A . 15 ARG HE 1 1 3 987 1 1 16 ARG HG2 H -4.443 -3.245 -2.294 1.00 . A A . 15 ARG HG2 1 1 3 988 1 1 16 ARG HG3 H -5.615 -2.351 -1.323 1.00 . A A . 15 ARG HG3 1 1 3 989 1 1 16 ARG HH11 H -8.322 -4.833 -3.650 1.00 . A A . 15 ARG HH11 1 1 3 990 1 1 16 ARG HH12 H -8.620 -5.674 -5.135 1.00 . A A . 15 ARG HH12 1 1 3 991 1 1 16 ARG HH21 H -7.115 -5.535 -6.856 1.00 . A A . 15 ARG HH21 1 1 3 992 1 1 16 ARG HH22 H -5.676 -4.588 -6.678 1.00 . A A . 15 ARG HH22 1 1 3 993 1 1 16 ARG N N -2.664 -1.386 -2.369 1.00 . A A . 15 ARG N 1 1 3 994 1 1 16 ARG NE N -6.130 -3.816 -4.336 1.00 . A A . 15 ARG NE 1 1 3 995 1 1 16 ARG NH1 N -8.041 -5.077 -4.579 1.00 . A A . 15 ARG NH1 1 1 3 996 1 1 16 ARG NH2 N -6.534 -4.938 -6.303 1.00 . A A . 15 ARG NH2 1 1 3 997 1 1 16 ARG O O -4.575 -0.659 -0.232 1.00 . A A . 15 ARG O 1 1 3 998 1 1 17 HIS C C -5.393 3.367 -0.205 1.00 . A A . 16 HIS C 1 1 3 999 1 1 17 HIS CA C -4.624 2.090 0.113 1.00 . A A . 16 HIS CA 1 1 3 1000 1 1 17 HIS CB C -3.379 2.425 0.939 1.00 . A A . 16 HIS CB 1 1 3 1001 1 1 17 HIS CD2 C -1.392 0.757 0.927 1.00 . A A . 16 HIS CD2 1 1 3 1002 1 1 17 HIS CE1 C -2.123 -0.623 2.466 1.00 . A A . 16 HIS CE1 1 1 3 1003 1 1 17 HIS CG C -2.591 1.220 1.352 1.00 . A A . 16 HIS CG 1 1 3 1004 1 1 17 HIS H H -3.986 1.907 -1.897 1.00 . A A . 16 HIS H 1 1 3 1005 1 1 17 HIS HA H -5.260 1.435 0.690 1.00 . A A . 16 HIS HA 1 1 3 1006 1 1 17 HIS HB2 H -2.730 3.061 0.355 1.00 . A A . 16 HIS HB2 1 1 3 1007 1 1 17 HIS HB3 H -3.680 2.949 1.834 1.00 . A A . 16 HIS HB3 1 1 3 1008 1 1 17 HIS HD1 H -3.864 0.394 2.814 1.00 . A A . 16 HIS HD1 1 1 3 1009 1 1 17 HIS HD2 H -0.762 1.206 0.172 1.00 . A A . 16 HIS HD2 1 1 3 1010 1 1 17 HIS HE1 H -2.194 -1.456 3.150 1.00 . A A . 16 HIS HE1 1 1 3 1011 1 1 17 HIS HE2 H -0.324 -0.945 1.539 1.00 . A A . 16 HIS HE2 1 1 3 1012 1 1 17 HIS N N -4.250 1.387 -1.109 1.00 . A A . 16 HIS N 1 1 3 1013 1 1 17 HIS ND1 N -3.024 0.333 2.315 1.00 . A A . 16 HIS ND1 1 1 3 1014 1 1 17 HIS NE2 N -1.126 -0.389 1.634 1.00 . A A . 16 HIS NE2 1 1 3 1015 1 1 17 HIS O O -6.119 3.894 0.637 1.00 . A A . 16 HIS O 1 1 3 1016 1 1 18 SER C C -7.418 4.876 -1.896 1.00 . A A . 17 SER C 1 1 3 1017 1 1 18 SER CA C -5.906 5.078 -1.861 1.00 . A A . 17 SER CA 1 1 3 1018 1 1 18 SER CB C -5.405 5.503 -3.243 1.00 . A A . 17 SER CB 1 1 3 1019 1 1 18 SER H H -4.637 3.396 -2.057 1.00 . A A . 17 SER H 1 1 3 1020 1 1 18 SER HA H -5.675 5.856 -1.149 1.00 . A A . 17 SER HA 1 1 3 1021 1 1 18 SER HB2 H -4.341 5.685 -3.196 1.00 . A A . 17 SER HB2 1 1 3 1022 1 1 18 SER HB3 H -5.604 4.715 -3.954 1.00 . A A . 17 SER HB3 1 1 3 1023 1 1 18 SER HG H -6.956 6.483 -3.929 1.00 . A A . 17 SER HG 1 1 3 1024 1 1 18 SER N N -5.229 3.861 -1.429 1.00 . A A . 17 SER N 1 1 3 1025 1 1 18 SER O O -7.902 3.783 -2.188 1.00 . A A . 17 SER O 1 1 3 1026 1 1 18 SER OG O -6.052 6.685 -3.679 1.00 . A A . 17 SER OG 1 1 3 1027 1 1 19 THR C C -10.215 7.028 -2.397 1.00 . A A . 18 THR C 1 1 3 1028 1 1 19 THR CA C -9.615 5.881 -1.589 1.00 . A A . 18 THR CA 1 1 3 1029 1 1 19 THR CB C -10.175 5.931 -0.155 1.00 . A A . 18 THR CB 1 1 3 1030 1 1 19 THR CG2 C -9.697 7.180 0.572 1.00 . A A . 18 THR CG2 1 1 3 1031 1 1 19 THR H H -7.713 6.783 -1.370 1.00 . A A . 18 THR H 1 1 3 1032 1 1 19 THR HA H -9.912 4.944 -2.037 1.00 . A A . 18 THR HA 1 1 3 1033 1 1 19 THR HB H -9.823 5.063 0.384 1.00 . A A . 18 THR HB 1 1 3 1034 1 1 19 THR HG1 H -11.906 5.767 -1.087 1.00 . A A . 18 THR HG1 1 1 3 1035 1 1 19 THR HG21 H -10.034 8.057 0.039 1.00 . A A . 18 THR HG21 1 1 3 1036 1 1 19 THR HG22 H -8.617 7.178 0.618 1.00 . A A . 18 THR HG22 1 1 3 1037 1 1 19 THR HG23 H -10.099 7.189 1.573 1.00 . A A . 18 THR HG23 1 1 3 1038 1 1 19 THR N N -8.158 5.939 -1.594 1.00 . A A . 18 THR N 1 1 3 1039 1 1 19 THR O O -11.324 6.917 -2.919 1.00 . A A . 18 THR O 1 1 3 1040 1 1 19 THR OG1 O -11.607 5.911 -0.186 1.00 . A A . 18 THR OG1 1 1 3 1041 1 1 20 ALA C C -9.381 9.285 -4.663 1.00 . A A . 19 ALA C 1 1 3 1042 1 1 20 ALA CA C -9.930 9.293 -3.240 1.00 . A A . 19 ALA CA 1 1 3 1043 1 1 20 ALA CB C -9.522 10.570 -2.521 1.00 . A A . 19 ALA CB 1 1 3 1044 1 1 20 ALA H H -8.596 8.152 -2.058 1.00 . A A . 19 ALA H 1 1 3 1045 1 1 20 ALA HA H -11.009 9.260 -3.281 1.00 . A A . 19 ALA HA 1 1 3 1046 1 1 20 ALA HB1 H -9.913 11.424 -3.055 1.00 . A A . 19 ALA HB1 1 1 3 1047 1 1 20 ALA HB2 H -8.444 10.632 -2.484 1.00 . A A . 19 ALA HB2 1 1 3 1048 1 1 20 ALA HB3 H -9.918 10.560 -1.517 1.00 . A A . 19 ALA HB3 1 1 3 1049 1 1 20 ALA N N -9.472 8.126 -2.496 1.00 . A A . 19 ALA N 1 1 3 1050 1 1 20 ALA O O -8.169 9.327 -4.872 1.00 . A A . 19 ALA O 1 1 3 1051 1 1 21 ILE C C -9.494 10.614 -7.515 1.00 . A A . 20 ILE C 1 1 3 1052 1 1 21 ILE CA C -9.891 9.219 -7.043 1.00 . A A . 20 ILE CA 1 1 3 1053 1 1 21 ILE CB C -11.027 8.682 -7.938 1.00 . A A . 20 ILE CB 1 1 3 1054 1 1 21 ILE CD1 C -11.588 7.999 -10.330 1.00 . A A . 20 ILE CD1 1 1 3 1055 1 1 21 ILE CG1 C -10.581 8.648 -9.403 1.00 . A A . 20 ILE CG1 1 1 3 1056 1 1 21 ILE CG2 C -12.278 9.532 -7.774 1.00 . A A . 20 ILE CG2 1 1 3 1057 1 1 21 ILE H H -11.236 9.201 -5.409 1.00 . A A . 20 ILE H 1 1 3 1058 1 1 21 ILE HA H -9.040 8.560 -7.144 1.00 . A A . 20 ILE HA 1 1 3 1059 1 1 21 ILE HB H -11.261 7.678 -7.618 1.00 . A A . 20 ILE HB 1 1 3 1060 1 1 21 ILE HD11 H -11.200 8.001 -11.338 1.00 . A A . 20 ILE HD11 1 1 3 1061 1 1 21 ILE HD12 H -12.514 8.553 -10.300 1.00 . A A . 20 ILE HD12 1 1 3 1062 1 1 21 ILE HD13 H -11.765 6.983 -10.014 1.00 . A A . 20 ILE HD13 1 1 3 1063 1 1 21 ILE HG12 H -10.419 9.659 -9.746 1.00 . A A . 20 ILE HG12 1 1 3 1064 1 1 21 ILE HG13 H -9.657 8.094 -9.478 1.00 . A A . 20 ILE HG13 1 1 3 1065 1 1 21 ILE HG21 H -12.063 10.549 -8.066 1.00 . A A . 20 ILE HG21 1 1 3 1066 1 1 21 ILE HG22 H -12.595 9.513 -6.741 1.00 . A A . 20 ILE HG22 1 1 3 1067 1 1 21 ILE HG23 H -13.066 9.138 -8.399 1.00 . A A . 20 ILE HG23 1 1 3 1068 1 1 21 ILE N N -10.283 9.232 -5.639 1.00 . A A . 20 ILE N 1 1 3 1069 1 1 21 ILE O O -10.131 11.606 -7.158 1.00 . A A . 20 ILE O 1 1 3 1070 1 1 22 GLY C C -7.351 11.844 -10.204 1.00 . A A . 21 GLY C 1 1 3 1071 1 1 22 GLY CA C -7.971 11.960 -8.825 1.00 . A A . 21 GLY CA 1 1 3 1072 1 1 22 GLY H H -7.966 9.860 -8.565 1.00 . A A . 21 GLY H 1 1 3 1073 1 1 22 GLY HA2 H -8.807 12.642 -8.875 1.00 . A A . 21 GLY HA2 1 1 3 1074 1 1 22 GLY HA3 H -7.234 12.361 -8.144 1.00 . A A . 21 GLY HA3 1 1 3 1075 1 1 22 GLY N N -8.436 10.683 -8.316 1.00 . A A . 21 GLY N 1 1 3 1076 1 1 22 GLY O O -7.655 10.915 -10.952 1.00 . A A . 21 GLY O 1 1 3 1077 1 1 23 ARG C C -4.488 12.041 -11.771 1.00 . A A . 22 ARG C 1 1 3 1078 1 1 23 ARG CA C -5.816 12.791 -11.840 1.00 . A A . 22 ARG CA 1 1 3 1079 1 1 23 ARG CB C -5.582 14.227 -12.315 1.00 . A A . 22 ARG CB 1 1 3 1080 1 1 23 ARG CD C -4.743 15.761 -14.121 1.00 . A A . 22 ARG CD 1 1 3 1081 1 1 23 ARG CG C -4.940 14.317 -13.690 1.00 . A A . 22 ARG CG 1 1 3 1082 1 1 23 ARG CZ C -3.448 17.734 -13.424 1.00 . A A . 22 ARG CZ 1 1 3 1083 1 1 23 ARG H H -6.279 13.505 -9.901 1.00 . A A . 22 ARG H 1 1 3 1084 1 1 23 ARG HA H -6.463 12.289 -12.542 1.00 . A A . 22 ARG HA 1 1 3 1085 1 1 23 ARG HB2 H -6.532 14.741 -12.351 1.00 . A A . 22 ARG HB2 1 1 3 1086 1 1 23 ARG HB3 H -4.938 14.729 -11.607 1.00 . A A . 22 ARG HB3 1 1 3 1087 1 1 23 ARG HD2 H -4.310 15.773 -15.110 1.00 . A A . 22 ARG HD2 1 1 3 1088 1 1 23 ARG HD3 H -5.706 16.251 -14.145 1.00 . A A . 22 ARG HD3 1 1 3 1089 1 1 23 ARG HE H -3.569 16.028 -12.398 1.00 . A A . 22 ARG HE 1 1 3 1090 1 1 23 ARG HG2 H -3.979 13.827 -13.660 1.00 . A A . 22 ARG HG2 1 1 3 1091 1 1 23 ARG HG3 H -5.577 13.821 -14.407 1.00 . A A . 22 ARG HG3 1 1 3 1092 1 1 23 ARG HH11 H -3.516 19.323 -14.674 1.00 . A A . 22 ARG HH11 1 1 3 1093 1 1 23 ARG HH12 H -4.433 17.942 -15.177 1.00 . A A . 22 ARG HH12 1 1 3 1094 1 1 23 ARG HH21 H -2.336 19.264 -12.711 1.00 . A A . 22 ARG HH21 1 1 3 1095 1 1 23 ARG HH22 H -2.359 17.840 -11.726 1.00 . A A . 22 ARG HH22 1 1 3 1096 1 1 23 ARG N N -6.480 12.791 -10.541 1.00 . A A . 22 ARG N 1 1 3 1097 1 1 23 ARG NE N -3.864 16.489 -13.210 1.00 . A A . 22 ARG NE 1 1 3 1098 1 1 23 ARG NH1 N -3.830 18.386 -14.514 1.00 . A A . 22 ARG NH1 1 1 3 1099 1 1 23 ARG NH2 N -2.648 18.329 -12.549 1.00 . A A . 22 ARG NH2 1 1 3 1100 1 1 23 ARG O O -4.478 10.830 -12.075 1.00 . A A . 22 ARG O 1 1 3 1101 1 1 23 ARG OXT O -3.470 12.671 -11.414 1.00 . A A . 22 ARG OXT 1 1 4 1102 1 1 1 ACE C C 2.806 0.555 11.221 1.00 . A A . 0 ACE C 1 1 4 1103 1 1 1 ACE CH3 C 3.377 0.006 12.500 1.00 . A A . 0 ACE CH3 1 1 4 1104 1 1 1 ACE H1 H 4.440 -0.158 12.364 1.00 . A A . 0 ACE H1 1 1 4 1105 1 1 1 ACE H2 H 2.899 -0.926 12.734 1.00 . A A . 0 ACE H2 1 1 4 1106 1 1 1 ACE H3 H 3.191 0.718 13.297 1.00 . A A . 0 ACE H3 1 1 4 1107 1 1 1 ACE O O 2.148 -0.160 10.465 1.00 . A A . 0 ACE O 1 1 4 1108 1 1 2 MET C C 3.276 1.952 8.527 1.00 . A A . 1 MET C 1 1 4 1109 1 1 2 MET CA C 2.563 2.490 9.764 1.00 . A A . 1 MET CA 1 1 4 1110 1 1 2 MET CB C 2.764 4.006 9.861 1.00 . A A . 1 MET CB 1 1 4 1111 1 1 2 MET CE C -0.389 5.594 7.634 1.00 . A A . 1 MET CE 1 1 4 1112 1 1 2 MET CG C 1.982 4.792 8.822 1.00 . A A . 1 MET CG 1 1 4 1113 1 1 2 MET H H 3.590 2.354 11.610 1.00 . A A . 1 MET H 1 1 4 1114 1 1 2 MET HA H 1.508 2.280 9.679 1.00 . A A . 1 MET HA 1 1 4 1115 1 1 2 MET HB2 H 2.454 4.336 10.841 1.00 . A A . 1 MET HB2 1 1 4 1116 1 1 2 MET HB3 H 3.815 4.228 9.731 1.00 . A A . 1 MET HB3 1 1 4 1117 1 1 2 MET HE1 H 0.019 5.222 6.706 1.00 . A A . 1 MET HE1 1 1 4 1118 1 1 2 MET HE2 H -0.075 6.616 7.780 1.00 . A A . 1 MET HE2 1 1 4 1119 1 1 2 MET HE3 H -1.468 5.552 7.594 1.00 . A A . 1 MET HE3 1 1 4 1120 1 1 2 MET HG2 H 2.221 5.840 8.929 1.00 . A A . 1 MET HG2 1 1 4 1121 1 1 2 MET HG3 H 2.276 4.456 7.840 1.00 . A A . 1 MET HG3 1 1 4 1122 1 1 2 MET N N 3.058 1.836 10.969 1.00 . A A . 1 MET N 1 1 4 1123 1 1 2 MET O O 4.443 2.265 8.289 1.00 . A A . 1 MET O 1 1 4 1124 1 1 2 MET SD S 0.199 4.586 8.992 1.00 . A A . 1 MET SD 1 1 4 1125 1 1 3 ASN C C 2.869 1.439 5.321 1.00 . A A . 2 ASN C 1 1 4 1126 1 1 3 ASN CA C 3.153 0.568 6.534 1.00 . A A . 2 ASN CA 1 1 4 1127 1 1 3 ASN CB C 2.627 -0.849 6.283 1.00 . A A . 2 ASN CB 1 1 4 1128 1 1 3 ASN CG C 2.858 -1.319 4.850 1.00 . A A . 2 ASN CG 1 1 4 1129 1 1 3 ASN H H 1.648 0.919 7.983 1.00 . A A . 2 ASN H 1 1 4 1130 1 1 3 ASN HA H 4.222 0.519 6.677 1.00 . A A . 2 ASN HA 1 1 4 1131 1 1 3 ASN HB2 H 3.128 -1.535 6.950 1.00 . A A . 2 ASN HB2 1 1 4 1132 1 1 3 ASN HB3 H 1.566 -0.872 6.481 1.00 . A A . 2 ASN HB3 1 1 4 1133 1 1 3 ASN HD21 H 4.073 -1.099 3.281 1.00 . A A . 2 ASN HD21 1 1 4 1134 1 1 3 ASN HD22 H 4.476 -0.165 4.678 1.00 . A A . 2 ASN HD22 1 1 4 1135 1 1 3 ASN N N 2.573 1.139 7.743 1.00 . A A . 2 ASN N 1 1 4 1136 1 1 3 ASN ND2 N 3.910 -0.809 4.205 1.00 . A A . 2 ASN ND2 1 1 4 1137 1 1 3 ASN O O 1.721 1.769 5.025 1.00 . A A . 2 ASN O 1 1 4 1138 1 1 3 ASN OD1 O 2.096 -2.132 4.327 1.00 . A A . 2 ASN OD1 1 1 4 1139 1 1 4 TRP C C 5.146 2.536 2.657 1.00 . A A . 3 TRP C 1 1 4 1140 1 1 4 TRP CA C 3.845 2.610 3.429 1.00 . A A . 3 TRP CA 1 1 4 1141 1 1 4 TRP CB C 3.482 4.058 3.765 1.00 . A A . 3 TRP CB 1 1 4 1142 1 1 4 TRP CD1 C 4.217 4.502 6.177 1.00 . A A . 3 TRP CD1 1 1 4 1143 1 1 4 TRP CD2 C 5.395 5.602 4.639 1.00 . A A . 3 TRP CD2 1 1 4 1144 1 1 4 TRP CE2 C 5.886 5.953 5.907 1.00 . A A . 3 TRP CE2 1 1 4 1145 1 1 4 TRP CE3 C 5.980 6.161 3.509 1.00 . A A . 3 TRP CE3 1 1 4 1146 1 1 4 TRP CG C 4.324 4.683 4.834 1.00 . A A . 3 TRP CG 1 1 4 1147 1 1 4 TRP CH2 C 7.496 7.385 4.946 1.00 . A A . 3 TRP CH2 1 1 4 1148 1 1 4 TRP CZ2 C 6.936 6.847 6.073 1.00 . A A . 3 TRP CZ2 1 1 4 1149 1 1 4 TRP CZ3 C 7.028 7.046 3.670 1.00 . A A . 3 TRP CZ3 1 1 4 1150 1 1 4 TRP H H 4.821 1.516 4.937 1.00 . A A . 3 TRP H 1 1 4 1151 1 1 4 TRP HA H 3.068 2.199 2.810 1.00 . A A . 3 TRP HA 1 1 4 1152 1 1 4 TRP HB2 H 3.585 4.658 2.873 1.00 . A A . 3 TRP HB2 1 1 4 1153 1 1 4 TRP HB3 H 2.454 4.092 4.095 1.00 . A A . 3 TRP HB3 1 1 4 1154 1 1 4 TRP HD1 H 3.500 3.852 6.642 1.00 . A A . 3 TRP HD1 1 1 4 1155 1 1 4 TRP HE1 H 5.265 5.317 7.806 1.00 . A A . 3 TRP HE1 1 1 4 1156 1 1 4 TRP HE3 H 5.630 5.898 2.522 1.00 . A A . 3 TRP HE3 1 1 4 1157 1 1 4 TRP HH2 H 8.316 8.083 5.028 1.00 . A A . 3 TRP HH2 1 1 4 1158 1 1 4 TRP HZ2 H 7.302 7.116 7.050 1.00 . A A . 3 TRP HZ2 1 1 4 1159 1 1 4 TRP HZ3 H 7.494 7.492 2.804 1.00 . A A . 3 TRP HZ3 1 1 4 1160 1 1 4 TRP N N 3.937 1.802 4.627 1.00 . A A . 3 TRP N 1 1 4 1161 1 1 4 TRP NE1 N 5.148 5.270 6.834 1.00 . A A . 3 TRP NE1 1 1 4 1162 1 1 4 TRP O O 5.212 1.885 1.615 1.00 . A A . 3 TRP O 1 1 4 1163 1 1 5 THR C C 7.409 3.134 1.065 1.00 . A A . 4 THR C 1 1 4 1164 1 1 5 THR CA C 7.496 3.199 2.590 1.00 . A A . 4 THR CA 1 1 4 1165 1 1 5 THR CB C 8.384 2.057 3.116 1.00 . A A . 4 THR CB 1 1 4 1166 1 1 5 THR CG2 C 7.986 0.714 2.515 1.00 . A A . 4 THR CG2 1 1 4 1167 1 1 5 THR H H 6.074 3.591 4.071 1.00 . A A . 4 THR H 1 1 4 1168 1 1 5 THR HA H 7.949 4.134 2.877 1.00 . A A . 4 THR HA 1 1 4 1169 1 1 5 THR HB H 8.269 2.000 4.190 1.00 . A A . 4 THR HB 1 1 4 1170 1 1 5 THR HG1 H 9.898 3.282 2.939 1.00 . A A . 4 THR HG1 1 1 4 1171 1 1 5 THR HG21 H 8.587 -0.069 2.954 1.00 . A A . 4 THR HG21 1 1 4 1172 1 1 5 THR HG22 H 8.147 0.736 1.448 1.00 . A A . 4 THR HG22 1 1 4 1173 1 1 5 THR HG23 H 6.943 0.523 2.719 1.00 . A A . 4 THR HG23 1 1 4 1174 1 1 5 THR N N 6.186 3.159 3.206 1.00 . A A . 4 THR N 1 1 4 1175 1 1 5 THR O O 8.316 2.633 0.400 1.00 . A A . 4 THR O 1 1 4 1176 1 1 5 THR OG1 O 9.747 2.343 2.813 1.00 . A A . 4 THR OG1 1 1 4 1177 1 1 6 GLY C C 5.044 4.581 -1.404 1.00 . A A . 5 GLY C 1 1 4 1178 1 1 6 GLY CA C 6.128 3.633 -0.917 1.00 . A A . 5 GLY CA 1 1 4 1179 1 1 6 GLY H H 5.650 4.097 1.089 1.00 . A A . 5 GLY H 1 1 4 1180 1 1 6 GLY HA2 H 7.058 3.886 -1.402 1.00 . A A . 5 GLY HA2 1 1 4 1181 1 1 6 GLY HA3 H 5.854 2.623 -1.192 1.00 . A A . 5 GLY HA3 1 1 4 1182 1 1 6 GLY N N 6.322 3.672 0.515 1.00 . A A . 5 GLY N 1 1 4 1183 1 1 6 GLY O O 4.374 4.302 -2.396 1.00 . A A . 5 GLY O 1 1 4 1184 1 1 7 LEU C C 4.481 7.960 -1.623 1.00 . A A . 6 LEU C 1 1 4 1185 1 1 7 LEU CA C 3.847 6.679 -1.091 1.00 . A A . 6 LEU CA 1 1 4 1186 1 1 7 LEU CB C 2.953 7.007 0.091 1.00 . A A . 6 LEU CB 1 1 4 1187 1 1 7 LEU CD1 C 4.457 8.501 1.451 1.00 . A A . 6 LEU CD1 1 1 4 1188 1 1 7 LEU CD2 C 2.711 7.123 2.581 1.00 . A A . 6 LEU CD2 1 1 4 1189 1 1 7 LEU CG C 3.685 7.190 1.421 1.00 . A A . 6 LEU CG 1 1 4 1190 1 1 7 LEU H H 5.398 5.848 0.099 1.00 . A A . 6 LEU H 1 1 4 1191 1 1 7 LEU HA H 3.245 6.242 -1.872 1.00 . A A . 6 LEU HA 1 1 4 1192 1 1 7 LEU HB2 H 2.424 7.918 -0.137 1.00 . A A . 6 LEU HB2 1 1 4 1193 1 1 7 LEU HB3 H 2.237 6.210 0.198 1.00 . A A . 6 LEU HB3 1 1 4 1194 1 1 7 LEU HD11 H 3.776 9.323 1.293 1.00 . A A . 6 LEU HD11 1 1 4 1195 1 1 7 LEU HD12 H 5.205 8.496 0.673 1.00 . A A . 6 LEU HD12 1 1 4 1196 1 1 7 LEU HD13 H 4.939 8.612 2.413 1.00 . A A . 6 LEU HD13 1 1 4 1197 1 1 7 LEU HD21 H 3.255 7.227 3.510 1.00 . A A . 6 LEU HD21 1 1 4 1198 1 1 7 LEU HD22 H 2.201 6.172 2.566 1.00 . A A . 6 LEU HD22 1 1 4 1199 1 1 7 LEU HD23 H 1.991 7.921 2.492 1.00 . A A . 6 LEU HD23 1 1 4 1200 1 1 7 LEU HG H 4.394 6.386 1.540 1.00 . A A . 6 LEU HG 1 1 4 1201 1 1 7 LEU N N 4.859 5.694 -0.704 1.00 . A A . 6 LEU N 1 1 4 1202 1 1 7 LEU O O 3.880 9.034 -1.571 1.00 . A A . 6 LEU O 1 1 4 1203 1 1 8 TYR C C 6.974 8.627 -4.074 1.00 . A A . 7 TYR C 1 1 4 1204 1 1 8 TYR CA C 6.418 8.961 -2.694 1.00 . A A . 7 TYR CA 1 1 4 1205 1 1 8 TYR CB C 7.553 9.372 -1.757 1.00 . A A . 7 TYR CB 1 1 4 1206 1 1 8 TYR CD1 C 7.697 7.212 -0.506 1.00 . A A . 7 TYR CD1 1 1 4 1207 1 1 8 TYR CD2 C 9.701 8.070 -1.454 1.00 . A A . 7 TYR CD2 1 1 4 1208 1 1 8 TYR CE1 C 8.371 6.129 -0.025 1.00 . A A . 7 TYR CE1 1 1 4 1209 1 1 8 TYR CE2 C 10.398 6.978 -0.968 1.00 . A A . 7 TYR CE2 1 1 4 1210 1 1 8 TYR CG C 8.338 8.200 -1.226 1.00 . A A . 7 TYR CG 1 1 4 1211 1 1 8 TYR CZ C 9.726 6.008 -0.253 1.00 . A A . 7 TYR CZ 1 1 4 1212 1 1 8 TYR H H 6.107 6.953 -2.128 1.00 . A A . 7 TYR H 1 1 4 1213 1 1 8 TYR HA H 5.728 9.775 -2.783 1.00 . A A . 7 TYR HA 1 1 4 1214 1 1 8 TYR HB2 H 8.235 10.019 -2.287 1.00 . A A . 7 TYR HB2 1 1 4 1215 1 1 8 TYR HB3 H 7.138 9.901 -0.915 1.00 . A A . 7 TYR HB3 1 1 4 1216 1 1 8 TYR HD1 H 6.638 7.304 -0.322 1.00 . A A . 7 TYR HD1 1 1 4 1217 1 1 8 TYR HD2 H 10.218 8.835 -2.013 1.00 . A A . 7 TYR HD2 1 1 4 1218 1 1 8 TYR HE1 H 7.831 5.383 0.520 1.00 . A A . 7 TYR HE1 1 1 4 1219 1 1 8 TYR HE2 H 11.459 6.888 -1.151 1.00 . A A . 7 TYR HE2 1 1 4 1220 1 1 8 TYR HH H 11.233 5.203 0.629 1.00 . A A . 7 TYR HH 1 1 4 1221 1 1 8 TYR N N 5.687 7.830 -2.139 1.00 . A A . 7 TYR N 1 1 4 1222 1 1 8 TYR O O 7.024 9.483 -4.957 1.00 . A A . 7 TYR O 1 1 4 1223 1 1 8 TYR OH O 10.409 4.914 0.230 1.00 . A A . 7 TYR OH 1 1 4 1224 1 1 9 THR C C 7.497 5.509 -5.843 1.00 . A A . 8 THR C 1 1 4 1225 1 1 9 THR CA C 7.944 6.928 -5.523 1.00 . A A . 8 THR CA 1 1 4 1226 1 1 9 THR CB C 9.483 6.970 -5.512 1.00 . A A . 8 THR CB 1 1 4 1227 1 1 9 THR CG2 C 9.988 8.394 -5.336 1.00 . A A . 8 THR CG2 1 1 4 1228 1 1 9 THR H H 7.323 6.742 -3.508 1.00 . A A . 8 THR H 1 1 4 1229 1 1 9 THR HA H 7.588 7.589 -6.295 1.00 . A A . 8 THR HA 1 1 4 1230 1 1 9 THR HB H 9.845 6.590 -6.457 1.00 . A A . 8 THR HB 1 1 4 1231 1 1 9 THR HG1 H 9.311 5.505 -4.203 1.00 . A A . 8 THR HG1 1 1 4 1232 1 1 9 THR HG21 H 9.625 8.792 -4.399 1.00 . A A . 8 THR HG21 1 1 4 1233 1 1 9 THR HG22 H 9.629 9.008 -6.150 1.00 . A A . 8 THR HG22 1 1 4 1234 1 1 9 THR HG23 H 11.067 8.396 -5.333 1.00 . A A . 8 THR HG23 1 1 4 1235 1 1 9 THR N N 7.390 7.377 -4.251 1.00 . A A . 8 THR N 1 1 4 1236 1 1 9 THR O O 7.992 4.886 -6.782 1.00 . A A . 8 THR O 1 1 4 1237 1 1 9 THR OG1 O 9.984 6.145 -4.454 1.00 . A A . 8 THR OG1 1 1 4 1238 1 1 10 LEU C C 4.532 3.611 -5.003 1.00 . A A . 9 LEU C 1 1 4 1239 1 1 10 LEU CA C 6.037 3.657 -5.247 1.00 . A A . 9 LEU CA 1 1 4 1240 1 1 10 LEU CB C 6.748 2.685 -4.307 1.00 . A A . 9 LEU CB 1 1 4 1241 1 1 10 LEU CD1 C 8.882 1.801 -3.355 1.00 . A A . 9 LEU CD1 1 1 4 1242 1 1 10 LEU CD2 C 8.630 2.024 -5.830 1.00 . A A . 9 LEU CD2 1 1 4 1243 1 1 10 LEU CG C 8.266 2.615 -4.476 1.00 . A A . 9 LEU CG 1 1 4 1244 1 1 10 LEU H H 6.193 5.563 -4.336 1.00 . A A . 9 LEU H 1 1 4 1245 1 1 10 LEU HA H 6.236 3.366 -6.265 1.00 . A A . 9 LEU HA 1 1 4 1246 1 1 10 LEU HB2 H 6.533 2.977 -3.292 1.00 . A A . 9 LEU HB2 1 1 4 1247 1 1 10 LEU HB3 H 6.343 1.697 -4.472 1.00 . A A . 9 LEU HB3 1 1 4 1248 1 1 10 LEU HD11 H 8.653 2.263 -2.408 1.00 . A A . 9 LEU HD11 1 1 4 1249 1 1 10 LEU HD12 H 9.953 1.759 -3.488 1.00 . A A . 9 LEU HD12 1 1 4 1250 1 1 10 LEU HD13 H 8.477 0.801 -3.375 1.00 . A A . 9 LEU HD13 1 1 4 1251 1 1 10 LEU HD21 H 9.705 1.976 -5.924 1.00 . A A . 9 LEU HD21 1 1 4 1252 1 1 10 LEU HD22 H 8.229 2.648 -6.615 1.00 . A A . 9 LEU HD22 1 1 4 1253 1 1 10 LEU HD23 H 8.217 1.030 -5.912 1.00 . A A . 9 LEU HD23 1 1 4 1254 1 1 10 LEU HG H 8.674 3.614 -4.427 1.00 . A A . 9 LEU HG 1 1 4 1255 1 1 10 LEU N N 6.554 5.008 -5.057 1.00 . A A . 9 LEU N 1 1 4 1256 1 1 10 LEU O O 3.967 2.550 -4.747 1.00 . A A . 9 LEU O 1 1 4 1257 1 1 11 LEU C C 1.695 3.745 -5.500 1.00 . A A . 10 LEU C 1 1 4 1258 1 1 11 LEU CA C 2.455 4.906 -4.865 1.00 . A A . 10 LEU CA 1 1 4 1259 1 1 11 LEU CB C 1.948 6.232 -5.445 1.00 . A A . 10 LEU CB 1 1 4 1260 1 1 11 LEU CD1 C 2.409 8.530 -6.338 1.00 . A A . 10 LEU CD1 1 1 4 1261 1 1 11 LEU CD2 C 3.780 7.635 -4.448 1.00 . A A . 10 LEU CD2 1 1 4 1262 1 1 11 LEU CG C 3.028 7.284 -5.722 1.00 . A A . 10 LEU CG 1 1 4 1263 1 1 11 LEU H H 4.422 5.584 -5.253 1.00 . A A . 10 LEU H 1 1 4 1264 1 1 11 LEU HA H 2.273 4.899 -3.802 1.00 . A A . 10 LEU HA 1 1 4 1265 1 1 11 LEU HB2 H 1.437 6.022 -6.372 1.00 . A A . 10 LEU HB2 1 1 4 1266 1 1 11 LEU HB3 H 1.238 6.654 -4.750 1.00 . A A . 10 LEU HB3 1 1 4 1267 1 1 11 LEU HD11 H 1.686 8.948 -5.653 1.00 . A A . 10 LEU HD11 1 1 4 1268 1 1 11 LEU HD12 H 1.920 8.269 -7.264 1.00 . A A . 10 LEU HD12 1 1 4 1269 1 1 11 LEU HD13 H 3.183 9.257 -6.532 1.00 . A A . 10 LEU HD13 1 1 4 1270 1 1 11 LEU HD21 H 4.572 8.332 -4.678 1.00 . A A . 10 LEU HD21 1 1 4 1271 1 1 11 LEU HD22 H 4.208 6.738 -4.016 1.00 . A A . 10 LEU HD22 1 1 4 1272 1 1 11 LEU HD23 H 3.100 8.084 -3.740 1.00 . A A . 10 LEU HD23 1 1 4 1273 1 1 11 LEU HG H 3.741 6.883 -6.427 1.00 . A A . 10 LEU HG 1 1 4 1274 1 1 11 LEU N N 3.899 4.779 -5.072 1.00 . A A . 10 LEU N 1 1 4 1275 1 1 11 LEU O O 1.258 2.825 -4.808 1.00 . A A . 10 LEU O 1 1 4 1276 1 1 12 SER C C 1.630 1.440 -7.493 1.00 . A A . 11 SER C 1 1 4 1277 1 1 12 SER CA C 0.837 2.741 -7.545 1.00 . A A . 11 SER CA 1 1 4 1278 1 1 12 SER CB C 0.608 3.156 -8.999 1.00 . A A . 11 SER CB 1 1 4 1279 1 1 12 SER H H 1.904 4.556 -7.315 1.00 . A A . 11 SER H 1 1 4 1280 1 1 12 SER HA H -0.119 2.587 -7.067 1.00 . A A . 11 SER HA 1 1 4 1281 1 1 12 SER HB2 H 0.087 2.366 -9.520 1.00 . A A . 11 SER HB2 1 1 4 1282 1 1 12 SER HB3 H 0.013 4.057 -9.026 1.00 . A A . 11 SER HB3 1 1 4 1283 1 1 12 SER HG H 1.862 2.913 -10.485 1.00 . A A . 11 SER HG 1 1 4 1284 1 1 12 SER N N 1.539 3.793 -6.819 1.00 . A A . 11 SER N 1 1 4 1285 1 1 12 SER O O 1.152 0.387 -7.916 1.00 . A A . 11 SER O 1 1 4 1286 1 1 12 SER OG O 1.837 3.404 -9.660 1.00 . A A . 11 SER OG 1 1 4 1287 1 1 13 ARG C C 3.613 -0.248 -5.462 1.00 . A A . 12 ARG C 1 1 4 1288 1 1 13 ARG CA C 3.725 0.374 -6.849 1.00 . A A . 12 ARG CA 1 1 4 1289 1 1 13 ARG CB C 5.170 0.794 -7.119 1.00 . A A . 12 ARG CB 1 1 4 1290 1 1 13 ARG CD C 6.809 1.850 -8.705 1.00 . A A . 12 ARG CD 1 1 4 1291 1 1 13 ARG CG C 5.402 1.298 -8.534 1.00 . A A . 12 ARG CG 1 1 4 1292 1 1 13 ARG CZ C 8.178 2.917 -10.448 1.00 . A A . 12 ARG CZ 1 1 4 1293 1 1 13 ARG H H 3.165 2.401 -6.654 1.00 . A A . 12 ARG H 1 1 4 1294 1 1 13 ARG HA H 3.422 -0.353 -7.583 1.00 . A A . 12 ARG HA 1 1 4 1295 1 1 13 ARG HB2 H 5.433 1.586 -6.431 1.00 . A A . 12 ARG HB2 1 1 4 1296 1 1 13 ARG HB3 H 5.819 -0.051 -6.948 1.00 . A A . 12 ARG HB3 1 1 4 1297 1 1 13 ARG HD2 H 6.947 2.669 -8.012 1.00 . A A . 12 ARG HD2 1 1 4 1298 1 1 13 ARG HD3 H 7.518 1.068 -8.479 1.00 . A A . 12 ARG HD3 1 1 4 1299 1 1 13 ARG HE H 6.332 2.209 -10.720 1.00 . A A . 12 ARG HE 1 1 4 1300 1 1 13 ARG HG2 H 5.261 0.481 -9.225 1.00 . A A . 12 ARG HG2 1 1 4 1301 1 1 13 ARG HG3 H 4.691 2.082 -8.748 1.00 . A A . 12 ARG HG3 1 1 4 1302 1 1 13 ARG HH11 H 10.014 3.539 -9.876 1.00 . A A . 12 ARG HH11 1 1 4 1303 1 1 13 ARG HH12 H 9.065 2.791 -8.636 1.00 . A A . 12 ARG HH12 1 1 4 1304 1 1 13 ARG HH21 H 9.169 3.766 -11.992 1.00 . A A . 12 ARG HH21 1 1 4 1305 1 1 13 ARG HH22 H 7.578 3.190 -12.358 1.00 . A A . 12 ARG HH22 1 1 4 1306 1 1 13 ARG N N 2.846 1.530 -6.969 1.00 . A A . 12 ARG N 1 1 4 1307 1 1 13 ARG NE N 7.049 2.330 -10.062 1.00 . A A . 12 ARG NE 1 1 4 1308 1 1 13 ARG NH1 N 9.166 3.097 -9.582 1.00 . A A . 12 ARG NH1 1 1 4 1309 1 1 13 ARG NH2 N 8.320 3.324 -11.703 1.00 . A A . 12 ARG NH2 1 1 4 1310 1 1 13 ARG O O 4.370 -1.152 -5.108 1.00 . A A . 12 ARG O 1 1 4 1311 1 1 14 VAL C C 0.944 -0.197 -2.993 1.00 . A A . 13 VAL C 1 1 4 1312 1 1 14 VAL CA C 2.429 -0.233 -3.334 1.00 . A A . 13 VAL CA 1 1 4 1313 1 1 14 VAL CB C 3.200 0.618 -2.305 1.00 . A A . 13 VAL CB 1 1 4 1314 1 1 14 VAL CG1 C 2.848 0.200 -0.889 1.00 . A A . 13 VAL CG1 1 1 4 1315 1 1 14 VAL CG2 C 4.698 0.514 -2.541 1.00 . A A . 13 VAL CG2 1 1 4 1316 1 1 14 VAL H H 2.086 0.954 -5.037 1.00 . A A . 13 VAL H 1 1 4 1317 1 1 14 VAL HA H 2.783 -1.251 -3.272 1.00 . A A . 13 VAL HA 1 1 4 1318 1 1 14 VAL HB H 2.907 1.650 -2.432 1.00 . A A . 13 VAL HB 1 1 4 1319 1 1 14 VAL HG11 H 1.786 0.320 -0.734 1.00 . A A . 13 VAL HG11 1 1 4 1320 1 1 14 VAL HG12 H 3.387 0.820 -0.187 1.00 . A A . 13 VAL HG12 1 1 4 1321 1 1 14 VAL HG13 H 3.120 -0.833 -0.741 1.00 . A A . 13 VAL HG13 1 1 4 1322 1 1 14 VAL HG21 H 5.219 1.127 -1.823 1.00 . A A . 13 VAL HG21 1 1 4 1323 1 1 14 VAL HG22 H 4.927 0.855 -3.540 1.00 . A A . 13 VAL HG22 1 1 4 1324 1 1 14 VAL HG23 H 5.009 -0.514 -2.432 1.00 . A A . 13 VAL HG23 1 1 4 1325 1 1 14 VAL N N 2.658 0.248 -4.687 1.00 . A A . 13 VAL N 1 1 4 1326 1 1 14 VAL O O 0.394 0.865 -2.697 1.00 . A A . 13 VAL O 1 1 4 1327 1 1 15 ASN C C -1.436 -0.761 -1.419 1.00 . A A . 14 ASN C 1 1 4 1328 1 1 15 ASN CA C -1.121 -1.460 -2.738 1.00 . A A . 14 ASN CA 1 1 4 1329 1 1 15 ASN CB C -1.551 -2.927 -2.668 1.00 . A A . 14 ASN CB 1 1 4 1330 1 1 15 ASN CG C -1.571 -3.600 -4.029 1.00 . A A . 14 ASN CG 1 1 4 1331 1 1 15 ASN H H 0.793 -2.162 -3.310 1.00 . A A . 14 ASN H 1 1 4 1332 1 1 15 ASN HA H -1.669 -0.971 -3.530 1.00 . A A . 14 ASN HA 1 1 4 1333 1 1 15 ASN HB2 H -0.864 -3.466 -2.033 1.00 . A A . 14 ASN HB2 1 1 4 1334 1 1 15 ASN HB3 H -2.544 -2.984 -2.246 1.00 . A A . 14 ASN HB3 1 1 4 1335 1 1 15 ASN HD21 H -0.681 -3.591 -5.807 1.00 . A A . 14 ASN HD21 1 1 4 1336 1 1 15 ASN HD22 H -0.073 -2.454 -4.659 1.00 . A A . 14 ASN HD22 1 1 4 1337 1 1 15 ASN N N 0.301 -1.357 -3.048 1.00 . A A . 14 ASN N 1 1 4 1338 1 1 15 ASN ND2 N -0.685 -3.171 -4.921 1.00 . A A . 14 ASN ND2 1 1 4 1339 1 1 15 ASN O O -1.180 -1.301 -0.342 1.00 . A A . 14 ASN O 1 1 4 1340 1 1 15 ASN OD1 O -2.375 -4.499 -4.275 1.00 . A A . 14 ASN OD1 1 1 4 1341 1 1 16 ARG C C -3.245 0.441 0.599 1.00 . A A . 15 ARG C 1 1 4 1342 1 1 16 ARG CA C -2.329 1.229 -0.333 1.00 . A A . 15 ARG CA 1 1 4 1343 1 1 16 ARG CB C -3.004 2.539 -0.748 1.00 . A A . 15 ARG CB 1 1 4 1344 1 1 16 ARG CD C -3.924 4.772 -0.053 1.00 . A A . 15 ARG CD 1 1 4 1345 1 1 16 ARG CG C -3.299 3.468 0.418 1.00 . A A . 15 ARG CG 1 1 4 1346 1 1 16 ARG CZ C -4.768 6.873 0.910 1.00 . A A . 15 ARG CZ 1 1 4 1347 1 1 16 ARG H H -2.164 0.819 -2.402 1.00 . A A . 15 ARG H 1 1 4 1348 1 1 16 ARG HA H -1.411 1.457 0.189 1.00 . A A . 15 ARG HA 1 1 4 1349 1 1 16 ARG HB2 H -2.357 3.059 -1.439 1.00 . A A . 15 ARG HB2 1 1 4 1350 1 1 16 ARG HB3 H -3.936 2.309 -1.242 1.00 . A A . 15 ARG HB3 1 1 4 1351 1 1 16 ARG HD2 H -3.246 5.250 -0.745 1.00 . A A . 15 ARG HD2 1 1 4 1352 1 1 16 ARG HD3 H -4.853 4.550 -0.556 1.00 . A A . 15 ARG HD3 1 1 4 1353 1 1 16 ARG HE H -3.925 5.395 1.953 1.00 . A A . 15 ARG HE 1 1 4 1354 1 1 16 ARG HG2 H -3.983 2.976 1.094 1.00 . A A . 15 ARG HG2 1 1 4 1355 1 1 16 ARG HG3 H -2.376 3.688 0.934 1.00 . A A . 15 ARG HG3 1 1 4 1356 1 1 16 ARG HH11 H -4.981 6.715 -1.093 1.00 . A A . 15 ARG HH11 1 1 4 1357 1 1 16 ARG HH12 H -5.571 8.187 -0.398 1.00 . A A . 15 ARG HH12 1 1 4 1358 1 1 16 ARG HH21 H -4.700 7.330 2.878 1.00 . A A . 15 ARG HH21 1 1 4 1359 1 1 16 ARG HH22 H -5.412 8.537 1.859 1.00 . A A . 15 ARG HH22 1 1 4 1360 1 1 16 ARG N N -1.985 0.446 -1.515 1.00 . A A . 15 ARG N 1 1 4 1361 1 1 16 ARG NE N -4.190 5.684 1.055 1.00 . A A . 15 ARG NE 1 1 4 1362 1 1 16 ARG NH1 N -5.137 7.293 -0.293 1.00 . A A . 15 ARG NH1 1 1 4 1363 1 1 16 ARG NH2 N -4.977 7.643 1.969 1.00 . A A . 15 ARG NH2 1 1 4 1364 1 1 16 ARG O O -2.856 0.085 1.711 1.00 . A A . 15 ARG O 1 1 4 1365 1 1 17 HIS C C -5.739 -1.923 0.283 1.00 . A A . 16 HIS C 1 1 4 1366 1 1 17 HIS CA C -5.433 -0.575 0.928 1.00 . A A . 16 HIS CA 1 1 4 1367 1 1 17 HIS CB C -6.725 0.230 1.088 1.00 . A A . 16 HIS CB 1 1 4 1368 1 1 17 HIS CD2 C -6.318 1.724 3.170 1.00 . A A . 16 HIS CD2 1 1 4 1369 1 1 17 HIS CE1 C -6.417 3.681 2.185 1.00 . A A . 16 HIS CE1 1 1 4 1370 1 1 17 HIS CG C -6.546 1.505 1.853 1.00 . A A . 16 HIS CG 1 1 4 1371 1 1 17 HIS H H -4.713 0.483 -0.758 1.00 . A A . 16 HIS H 1 1 4 1372 1 1 17 HIS HA H -5.004 -0.746 1.904 1.00 . A A . 16 HIS HA 1 1 4 1373 1 1 17 HIS HB2 H -7.107 0.482 0.109 1.00 . A A . 16 HIS HB2 1 1 4 1374 1 1 17 HIS HB3 H -7.453 -0.371 1.611 1.00 . A A . 16 HIS HB3 1 1 4 1375 1 1 17 HIS HD1 H -6.757 2.928 0.312 1.00 . A A . 16 HIS HD1 1 1 4 1376 1 1 17 HIS HD2 H -6.215 0.969 3.937 1.00 . A A . 16 HIS HD2 1 1 4 1377 1 1 17 HIS HE1 H -6.410 4.747 2.014 1.00 . A A . 16 HIS HE1 1 1 4 1378 1 1 17 HIS HE2 H -6.085 3.539 4.201 1.00 . A A . 16 HIS HE2 1 1 4 1379 1 1 17 HIS N N -4.463 0.172 0.136 1.00 . A A . 16 HIS N 1 1 4 1380 1 1 17 HIS ND1 N -6.603 2.751 1.264 1.00 . A A . 16 HIS ND1 1 1 4 1381 1 1 17 HIS NE2 N -6.243 3.083 3.348 1.00 . A A . 16 HIS NE2 1 1 4 1382 1 1 17 HIS O O -6.458 -2.745 0.854 1.00 . A A . 16 HIS O 1 1 4 1383 1 1 18 SER C C -6.879 -3.612 -1.931 1.00 . A A . 17 SER C 1 1 4 1384 1 1 18 SER CA C -5.398 -3.388 -1.641 1.00 . A A . 17 SER CA 1 1 4 1385 1 1 18 SER CB C -4.835 -4.573 -0.853 1.00 . A A . 17 SER CB 1 1 4 1386 1 1 18 SER H H -4.625 -1.446 -1.307 1.00 . A A . 17 SER H 1 1 4 1387 1 1 18 SER HA H -4.870 -3.310 -2.579 1.00 . A A . 17 SER HA 1 1 4 1388 1 1 18 SER HB2 H -5.336 -4.640 0.102 1.00 . A A . 17 SER HB2 1 1 4 1389 1 1 18 SER HB3 H -4.998 -5.484 -1.410 1.00 . A A . 17 SER HB3 1 1 4 1390 1 1 18 SER HG H -3.218 -3.489 -0.638 1.00 . A A . 17 SER HG 1 1 4 1391 1 1 18 SER N N -5.188 -2.141 -0.908 1.00 . A A . 17 SER N 1 1 4 1392 1 1 18 SER O O -7.632 -4.056 -1.064 1.00 . A A . 17 SER O 1 1 4 1393 1 1 18 SER OG O -3.444 -4.422 -0.626 1.00 . A A . 17 SER OG 1 1 4 1394 1 1 19 THR C C -8.792 -4.346 -4.803 1.00 . A A . 18 THR C 1 1 4 1395 1 1 19 THR CA C -8.681 -3.466 -3.562 1.00 . A A . 18 THR CA 1 1 4 1396 1 1 19 THR CB C -9.349 -2.107 -3.849 1.00 . A A . 18 THR CB 1 1 4 1397 1 1 19 THR CG2 C -8.574 -1.334 -4.907 1.00 . A A . 18 THR CG2 1 1 4 1398 1 1 19 THR H H -6.642 -2.950 -3.802 1.00 . A A . 18 THR H 1 1 4 1399 1 1 19 THR HA H -9.212 -3.938 -2.749 1.00 . A A . 18 THR HA 1 1 4 1400 1 1 19 THR HB H -9.358 -1.528 -2.938 1.00 . A A . 18 THR HB 1 1 4 1401 1 1 19 THR HG1 H -10.695 -2.822 -5.102 1.00 . A A . 18 THR HG1 1 1 4 1402 1 1 19 THR HG21 H -9.063 -0.390 -5.093 1.00 . A A . 18 THR HG21 1 1 4 1403 1 1 19 THR HG22 H -8.541 -1.909 -5.820 1.00 . A A . 18 THR HG22 1 1 4 1404 1 1 19 THR HG23 H -7.568 -1.156 -4.557 1.00 . A A . 18 THR HG23 1 1 4 1405 1 1 19 THR N N -7.291 -3.300 -3.156 1.00 . A A . 18 THR N 1 1 4 1406 1 1 19 THR O O -9.800 -5.021 -5.009 1.00 . A A . 18 THR O 1 1 4 1407 1 1 19 THR OG1 O -10.696 -2.308 -4.291 1.00 . A A . 18 THR OG1 1 1 4 1408 1 1 20 ALA C C -6.298 -5.382 -7.315 1.00 . A A . 19 ALA C 1 1 4 1409 1 1 20 ALA CA C -7.727 -5.132 -6.846 1.00 . A A . 19 ALA CA 1 1 4 1410 1 1 20 ALA CB C -8.531 -4.443 -7.939 1.00 . A A . 19 ALA CB 1 1 4 1411 1 1 20 ALA H H -6.973 -3.776 -5.407 1.00 . A A . 19 ALA H 1 1 4 1412 1 1 20 ALA HA H -8.196 -6.081 -6.631 1.00 . A A . 19 ALA HA 1 1 4 1413 1 1 20 ALA HB1 H -9.539 -4.273 -7.592 1.00 . A A . 19 ALA HB1 1 1 4 1414 1 1 20 ALA HB2 H -8.553 -5.070 -8.819 1.00 . A A . 19 ALA HB2 1 1 4 1415 1 1 20 ALA HB3 H -8.069 -3.497 -8.183 1.00 . A A . 19 ALA HB3 1 1 4 1416 1 1 20 ALA N N -7.748 -4.334 -5.626 1.00 . A A . 19 ALA N 1 1 4 1417 1 1 20 ALA O O -5.563 -4.444 -7.625 1.00 . A A . 19 ALA O 1 1 4 1418 1 1 21 ILE C C -4.529 -7.292 -9.298 1.00 . A A . 20 ILE C 1 1 4 1419 1 1 21 ILE CA C -4.570 -7.027 -7.798 1.00 . A A . 20 ILE CA 1 1 4 1420 1 1 21 ILE CB C -4.068 -8.279 -7.051 1.00 . A A . 20 ILE CB 1 1 4 1421 1 1 21 ILE CD1 C -4.553 -10.752 -6.665 1.00 . A A . 20 ILE CD1 1 1 4 1422 1 1 21 ILE CG1 C -5.037 -9.447 -7.257 1.00 . A A . 20 ILE CG1 1 1 4 1423 1 1 21 ILE CG2 C -3.896 -7.975 -5.569 1.00 . A A . 20 ILE CG2 1 1 4 1424 1 1 21 ILE H H -6.544 -7.356 -7.106 1.00 . A A . 20 ILE H 1 1 4 1425 1 1 21 ILE HA H -3.905 -6.207 -7.568 1.00 . A A . 20 ILE HA 1 1 4 1426 1 1 21 ILE HB H -3.102 -8.546 -7.453 1.00 . A A . 20 ILE HB 1 1 4 1427 1 1 21 ILE HD11 H -5.282 -11.526 -6.855 1.00 . A A . 20 ILE HD11 1 1 4 1428 1 1 21 ILE HD12 H -4.420 -10.636 -5.599 1.00 . A A . 20 ILE HD12 1 1 4 1429 1 1 21 ILE HD13 H -3.611 -11.025 -7.116 1.00 . A A . 20 ILE HD13 1 1 4 1430 1 1 21 ILE HG12 H -5.983 -9.205 -6.797 1.00 . A A . 20 ILE HG12 1 1 4 1431 1 1 21 ILE HG13 H -5.186 -9.599 -8.316 1.00 . A A . 20 ILE HG13 1 1 4 1432 1 1 21 ILE HG21 H -4.848 -7.685 -5.149 1.00 . A A . 20 ILE HG21 1 1 4 1433 1 1 21 ILE HG22 H -3.187 -7.170 -5.447 1.00 . A A . 20 ILE HG22 1 1 4 1434 1 1 21 ILE HG23 H -3.532 -8.856 -5.061 1.00 . A A . 20 ILE HG23 1 1 4 1435 1 1 21 ILE N N -5.911 -6.653 -7.366 1.00 . A A . 20 ILE N 1 1 4 1436 1 1 21 ILE O O -5.557 -7.564 -9.919 1.00 . A A . 20 ILE O 1 1 4 1437 1 1 22 GLY C C -3.163 -6.158 -12.100 1.00 . A A . 21 GLY C 1 1 4 1438 1 1 22 GLY CA C -3.178 -7.444 -11.299 1.00 . A A . 21 GLY CA 1 1 4 1439 1 1 22 GLY H H -2.550 -6.990 -9.329 1.00 . A A . 21 GLY H 1 1 4 1440 1 1 22 GLY HA2 H -2.251 -7.971 -11.467 1.00 . A A . 21 GLY HA2 1 1 4 1441 1 1 22 GLY HA3 H -3.997 -8.059 -11.643 1.00 . A A . 21 GLY HA3 1 1 4 1442 1 1 22 GLY N N -3.333 -7.211 -9.875 1.00 . A A . 21 GLY N 1 1 4 1443 1 1 22 GLY O O -4.010 -5.286 -11.904 1.00 . A A . 21 GLY O 1 1 4 1444 1 1 23 ARG C C -3.028 -4.913 -15.026 1.00 . A A . 22 ARG C 1 1 4 1445 1 1 23 ARG CA C -2.072 -4.848 -13.839 1.00 . A A . 22 ARG CA 1 1 4 1446 1 1 23 ARG CB C -0.632 -4.691 -14.338 1.00 . A A . 22 ARG CB 1 1 4 1447 1 1 23 ARG CD C 0.650 -5.517 -12.330 1.00 . A A . 22 ARG CD 1 1 4 1448 1 1 23 ARG CG C 0.366 -4.335 -13.243 1.00 . A A . 22 ARG CG 1 1 4 1449 1 1 23 ARG CZ C 2.127 -6.083 -10.445 1.00 . A A . 22 ARG CZ 1 1 4 1450 1 1 23 ARG H H -1.553 -6.769 -13.116 1.00 . A A . 22 ARG H 1 1 4 1451 1 1 23 ARG HA H -2.329 -3.992 -13.234 1.00 . A A . 22 ARG HA 1 1 4 1452 1 1 23 ARG HB2 H -0.317 -5.619 -14.790 1.00 . A A . 22 ARG HB2 1 1 4 1453 1 1 23 ARG HB3 H -0.606 -3.911 -15.084 1.00 . A A . 22 ARG HB3 1 1 4 1454 1 1 23 ARG HD2 H -0.267 -5.801 -11.835 1.00 . A A . 22 ARG HD2 1 1 4 1455 1 1 23 ARG HD3 H 1.005 -6.342 -12.930 1.00 . A A . 22 ARG HD3 1 1 4 1456 1 1 23 ARG HE H 1.993 -4.280 -11.288 1.00 . A A . 22 ARG HE 1 1 4 1457 1 1 23 ARG HG2 H 1.291 -4.019 -13.703 1.00 . A A . 22 ARG HG2 1 1 4 1458 1 1 23 ARG HG3 H -0.039 -3.526 -12.652 1.00 . A A . 22 ARG HG3 1 1 4 1459 1 1 23 ARG HH11 H 2.048 -7.997 -9.801 1.00 . A A . 22 ARG HH11 1 1 4 1460 1 1 23 ARG HH12 H 1.001 -7.617 -11.128 1.00 . A A . 22 ARG HH12 1 1 4 1461 1 1 23 ARG HH21 H 3.395 -6.381 -8.899 1.00 . A A . 22 ARG HH21 1 1 4 1462 1 1 23 ARG HH22 H 3.372 -4.773 -9.541 1.00 . A A . 22 ARG HH22 1 1 4 1463 1 1 23 ARG N N -2.197 -6.038 -13.005 1.00 . A A . 22 ARG N 1 1 4 1464 1 1 23 ARG NE N 1.654 -5.198 -11.318 1.00 . A A . 22 ARG NE 1 1 4 1465 1 1 23 ARG NH1 N 1.690 -7.335 -10.459 1.00 . A A . 22 ARG NH1 1 1 4 1466 1 1 23 ARG NH2 N 3.040 -5.715 -9.556 1.00 . A A . 22 ARG NH2 1 1 4 1467 1 1 23 ARG O O -4.163 -4.406 -14.899 1.00 . A A . 22 ARG O 1 1 4 1468 1 1 23 ARG OXT O -2.635 -5.470 -16.073 1.00 . A A . 22 ARG OXT 1 1 5 1469 1 1 1 ACE C C 1.927 0.625 10.419 1.00 . A A . 0 ACE C 1 1 5 1470 1 1 1 ACE CH3 C 1.673 -0.149 11.683 1.00 . A A . 0 ACE CH3 1 1 5 1471 1 1 1 ACE H1 H 1.947 0.471 12.531 1.00 . A A . 0 ACE H1 1 1 5 1472 1 1 1 ACE H2 H 2.271 -1.040 11.684 1.00 . A A . 0 ACE H2 1 1 5 1473 1 1 1 ACE H3 H 0.622 -0.419 11.720 1.00 . A A . 0 ACE H3 1 1 5 1474 1 1 1 ACE O O 1.076 0.679 9.529 1.00 . A A . 0 ACE O 1 1 5 1475 1 1 2 MET C C 4.288 1.174 8.174 1.00 . A A . 1 MET C 1 1 5 1476 1 1 2 MET CA C 3.478 2.015 9.157 1.00 . A A . 1 MET CA 1 1 5 1477 1 1 2 MET CB C 4.282 3.249 9.569 1.00 . A A . 1 MET CB 1 1 5 1478 1 1 2 MET CE C 4.394 3.420 12.754 1.00 . A A . 1 MET CE 1 1 5 1479 1 1 2 MET CG C 3.462 4.304 10.297 1.00 . A A . 1 MET CG 1 1 5 1480 1 1 2 MET H H 3.741 1.152 11.072 1.00 . A A . 1 MET H 1 1 5 1481 1 1 2 MET HA H 2.567 2.335 8.671 1.00 . A A . 1 MET HA 1 1 5 1482 1 1 2 MET HB2 H 5.086 2.939 10.220 1.00 . A A . 1 MET HB2 1 1 5 1483 1 1 2 MET HB3 H 4.704 3.702 8.683 1.00 . A A . 1 MET HB3 1 1 5 1484 1 1 2 MET HE1 H 4.184 3.073 13.755 1.00 . A A . 1 MET HE1 1 1 5 1485 1 1 2 MET HE2 H 4.974 4.331 12.804 1.00 . A A . 1 MET HE2 1 1 5 1486 1 1 2 MET HE3 H 4.953 2.665 12.222 1.00 . A A . 1 MET HE3 1 1 5 1487 1 1 2 MET HG2 H 4.079 5.176 10.450 1.00 . A A . 1 MET HG2 1 1 5 1488 1 1 2 MET HG3 H 2.615 4.569 9.680 1.00 . A A . 1 MET HG3 1 1 5 1489 1 1 2 MET N N 3.106 1.232 10.330 1.00 . A A . 1 MET N 1 1 5 1490 1 1 2 MET O O 5.453 0.865 8.422 1.00 . A A . 1 MET O 1 1 5 1491 1 1 2 MET SD S 2.854 3.738 11.897 1.00 . A A . 1 MET SD 1 1 5 1492 1 1 3 ASN C C 4.404 0.764 4.725 1.00 . A A . 2 ASN C 1 1 5 1493 1 1 3 ASN CA C 4.328 0.005 6.039 1.00 . A A . 2 ASN CA 1 1 5 1494 1 1 3 ASN CB C 3.580 -1.306 5.804 1.00 . A A . 2 ASN CB 1 1 5 1495 1 1 3 ASN CG C 2.414 -1.140 4.842 1.00 . A A . 2 ASN CG 1 1 5 1496 1 1 3 ASN H H 2.732 1.079 6.922 1.00 . A A . 2 ASN H 1 1 5 1497 1 1 3 ASN HA H 5.329 -0.213 6.380 1.00 . A A . 2 ASN HA 1 1 5 1498 1 1 3 ASN HB2 H 4.262 -2.035 5.392 1.00 . A A . 2 ASN HB2 1 1 5 1499 1 1 3 ASN HB3 H 3.197 -1.668 6.746 1.00 . A A . 2 ASN HB3 1 1 5 1500 1 1 3 ASN HD21 H 1.981 -0.946 2.905 1.00 . A A . 2 ASN HD21 1 1 5 1501 1 1 3 ASN HD22 H 3.660 -1.094 3.282 1.00 . A A . 2 ASN HD22 1 1 5 1502 1 1 3 ASN N N 3.663 0.806 7.060 1.00 . A A . 2 ASN N 1 1 5 1503 1 1 3 ASN ND2 N 2.716 -1.053 3.546 1.00 . A A . 2 ASN ND2 1 1 5 1504 1 1 3 ASN O O 5.008 0.287 3.764 1.00 . A A . 2 ASN O 1 1 5 1505 1 1 3 ASN OD1 O 1.257 -1.074 5.259 1.00 . A A . 2 ASN OD1 1 1 5 1506 1 1 4 TRP C C 5.036 2.622 2.695 1.00 . A A . 3 TRP C 1 1 5 1507 1 1 4 TRP CA C 3.750 2.754 3.489 1.00 . A A . 3 TRP CA 1 1 5 1508 1 1 4 TRP CB C 3.461 4.217 3.833 1.00 . A A . 3 TRP CB 1 1 5 1509 1 1 4 TRP CD1 C 4.293 4.658 6.217 1.00 . A A . 3 TRP CD1 1 1 5 1510 1 1 4 TRP CD2 C 5.475 5.666 4.623 1.00 . A A . 3 TRP CD2 1 1 5 1511 1 1 4 TRP CE2 C 6.028 6.013 5.864 1.00 . A A . 3 TRP CE2 1 1 5 1512 1 1 4 TRP CE3 C 6.045 6.168 3.464 1.00 . A A . 3 TRP CE3 1 1 5 1513 1 1 4 TRP CG C 4.365 4.811 4.868 1.00 . A A . 3 TRP CG 1 1 5 1514 1 1 4 TRP CH2 C 7.678 7.336 4.815 1.00 . A A . 3 TRP CH2 1 1 5 1515 1 1 4 TRP CZ2 C 7.133 6.851 5.974 1.00 . A A . 3 TRP CZ2 1 1 5 1516 1 1 4 TRP CZ3 C 7.144 6.998 3.565 1.00 . A A . 3 TRP CZ3 1 1 5 1517 1 1 4 TRP H H 3.347 2.273 5.501 1.00 . A A . 3 TRP H 1 1 5 1518 1 1 4 TRP HA H 2.947 2.391 2.874 1.00 . A A . 3 TRP HA 1 1 5 1519 1 1 4 TRP HB2 H 3.557 4.809 2.935 1.00 . A A . 3 TRP HB2 1 1 5 1520 1 1 4 TRP HB3 H 2.447 4.295 4.198 1.00 . A A . 3 TRP HB3 1 1 5 1521 1 1 4 TRP HD1 H 3.558 4.055 6.715 1.00 . A A . 3 TRP HD1 1 1 5 1522 1 1 4 TRP HE1 H 5.439 5.443 7.796 1.00 . A A . 3 TRP HE1 1 1 5 1523 1 1 4 TRP HE3 H 5.642 5.903 2.499 1.00 . A A . 3 TRP HE3 1 1 5 1524 1 1 4 TRP HH2 H 8.537 7.988 4.851 1.00 . A A . 3 TRP HH2 1 1 5 1525 1 1 4 TRP HZ2 H 7.551 7.121 6.929 1.00 . A A . 3 TRP HZ2 1 1 5 1526 1 1 4 TRP HZ3 H 7.601 7.398 2.673 1.00 . A A . 3 TRP HZ3 1 1 5 1527 1 1 4 TRP N N 3.783 1.940 4.692 1.00 . A A . 3 TRP N 1 1 5 1528 1 1 4 TRP NE1 N 5.286 5.385 6.829 1.00 . A A . 3 TRP NE1 1 1 5 1529 1 1 4 TRP O O 5.049 1.968 1.652 1.00 . A A . 3 TRP O 1 1 5 1530 1 1 5 THR C C 7.257 3.013 1.047 1.00 . A A . 4 THR C 1 1 5 1531 1 1 5 THR CA C 7.415 3.174 2.560 1.00 . A A . 4 THR CA 1 1 5 1532 1 1 5 THR CB C 8.302 2.041 3.110 1.00 . A A . 4 THR CB 1 1 5 1533 1 1 5 THR CG2 C 9.758 2.243 2.710 1.00 . A A . 4 THR CG2 1 1 5 1534 1 1 5 THR H H 6.043 3.632 4.089 1.00 . A A . 4 THR H 1 1 5 1535 1 1 5 THR HA H 7.895 4.116 2.771 1.00 . A A . 4 THR HA 1 1 5 1536 1 1 5 THR HB H 7.958 1.100 2.705 1.00 . A A . 4 THR HB 1 1 5 1537 1 1 5 THR HG1 H 8.052 2.888 4.873 1.00 . A A . 4 THR HG1 1 1 5 1538 1 1 5 THR HG21 H 10.358 1.446 3.125 1.00 . A A . 4 THR HG21 1 1 5 1539 1 1 5 THR HG22 H 10.107 3.192 3.090 1.00 . A A . 4 THR HG22 1 1 5 1540 1 1 5 THR HG23 H 9.840 2.233 1.634 1.00 . A A . 4 THR HG23 1 1 5 1541 1 1 5 THR N N 6.117 3.196 3.219 1.00 . A A . 4 THR N 1 1 5 1542 1 1 5 THR O O 8.027 2.305 0.398 1.00 . A A . 4 THR O 1 1 5 1543 1 1 5 THR OG1 O 8.204 2.001 4.539 1.00 . A A . 4 THR OG1 1 1 5 1544 1 1 6 GLY C C 4.955 4.587 -1.417 1.00 . A A . 5 GLY C 1 1 5 1545 1 1 6 GLY CA C 5.985 3.584 -0.928 1.00 . A A . 5 GLY CA 1 1 5 1546 1 1 6 GLY H H 5.681 4.255 1.054 1.00 . A A . 5 GLY H 1 1 5 1547 1 1 6 GLY HA2 H 6.908 3.735 -1.467 1.00 . A A . 5 GLY HA2 1 1 5 1548 1 1 6 GLY HA3 H 5.620 2.585 -1.132 1.00 . A A . 5 GLY HA3 1 1 5 1549 1 1 6 GLY N N 6.249 3.685 0.492 1.00 . A A . 5 GLY N 1 1 5 1550 1 1 6 GLY O O 4.255 4.334 -2.395 1.00 . A A . 5 GLY O 1 1 5 1551 1 1 7 LEU C C 4.596 8.006 -1.652 1.00 . A A . 6 LEU C 1 1 5 1552 1 1 7 LEU CA C 3.896 6.762 -1.117 1.00 . A A . 6 LEU CA 1 1 5 1553 1 1 7 LEU CB C 3.033 7.143 0.072 1.00 . A A . 6 LEU CB 1 1 5 1554 1 1 7 LEU CD1 C 4.609 8.588 1.403 1.00 . A A . 6 LEU CD1 1 1 5 1555 1 1 7 LEU CD2 C 2.835 7.278 2.567 1.00 . A A . 6 LEU CD2 1 1 5 1556 1 1 7 LEU CG C 3.791 7.306 1.391 1.00 . A A . 6 LEU CG 1 1 5 1557 1 1 7 LEU H H 5.413 5.853 0.059 1.00 . A A . 6 LEU H 1 1 5 1558 1 1 7 LEU HA H 3.264 6.360 -1.892 1.00 . A A . 6 LEU HA 1 1 5 1559 1 1 7 LEU HB2 H 2.543 8.074 -0.159 1.00 . A A . 6 LEU HB2 1 1 5 1560 1 1 7 LEU HB3 H 2.283 6.378 0.197 1.00 . A A . 6 LEU HB3 1 1 5 1561 1 1 7 LEU HD11 H 5.344 8.555 0.612 1.00 . A A . 6 LEU HD11 1 1 5 1562 1 1 7 LEU HD12 H 5.112 8.686 2.356 1.00 . A A . 6 LEU HD12 1 1 5 1563 1 1 7 LEU HD13 H 3.956 9.434 1.252 1.00 . A A . 6 LEU HD13 1 1 5 1564 1 1 7 LEU HD21 H 2.150 8.110 2.493 1.00 . A A . 6 LEU HD21 1 1 5 1565 1 1 7 LEU HD22 H 3.398 7.353 3.487 1.00 . A A . 6 LEU HD22 1 1 5 1566 1 1 7 LEU HD23 H 2.281 6.353 2.557 1.00 . A A . 6 LEU HD23 1 1 5 1567 1 1 7 LEU HG H 4.473 6.478 1.502 1.00 . A A . 6 LEU HG 1 1 5 1568 1 1 7 LEU N N 4.852 5.721 -0.733 1.00 . A A . 6 LEU N 1 1 5 1569 1 1 7 LEU O O 4.049 9.109 -1.608 1.00 . A A . 6 LEU O 1 1 5 1570 1 1 8 TYR C C 7.107 8.560 -4.108 1.00 . A A . 7 TYR C 1 1 5 1571 1 1 8 TYR CA C 6.581 8.910 -2.720 1.00 . A A . 7 TYR CA 1 1 5 1572 1 1 8 TYR CB C 7.746 9.255 -1.791 1.00 . A A . 7 TYR CB 1 1 5 1573 1 1 8 TYR CD1 C 7.790 7.082 -0.554 1.00 . A A . 7 TYR CD1 1 1 5 1574 1 1 8 TYR CD2 C 9.823 7.838 -1.524 1.00 . A A . 7 TYR CD2 1 1 5 1575 1 1 8 TYR CE1 C 8.413 5.961 -0.089 1.00 . A A . 7 TYR CE1 1 1 5 1576 1 1 8 TYR CE2 C 10.469 6.708 -1.055 1.00 . A A . 7 TYR CE2 1 1 5 1577 1 1 8 TYR CG C 8.472 8.039 -1.277 1.00 . A A . 7 TYR CG 1 1 5 1578 1 1 8 TYR CZ C 9.756 5.769 -0.336 1.00 . A A . 7 TYR CZ 1 1 5 1579 1 1 8 TYR H H 6.174 6.919 -2.151 1.00 . A A . 7 TYR H 1 1 5 1580 1 1 8 TYR HA H 5.934 9.761 -2.797 1.00 . A A . 7 TYR HA 1 1 5 1581 1 1 8 TYR HB2 H 8.455 9.869 -2.322 1.00 . A A . 7 TYR HB2 1 1 5 1582 1 1 8 TYR HB3 H 7.366 9.797 -0.940 1.00 . A A . 7 TYR HB3 1 1 5 1583 1 1 8 TYR HD1 H 6.739 7.228 -0.355 1.00 . A A . 7 TYR HD1 1 1 5 1584 1 1 8 TYR HD2 H 10.373 8.578 -2.086 1.00 . A A . 7 TYR HD2 1 1 5 1585 1 1 8 TYR HE1 H 7.842 5.240 0.460 1.00 . A A . 7 TYR HE1 1 1 5 1586 1 1 8 TYR HE2 H 11.520 6.564 -1.252 1.00 . A A . 7 TYR HE2 1 1 5 1587 1 1 8 TYR HH H 11.228 4.881 0.524 1.00 . A A . 7 TYR HH 1 1 5 1588 1 1 8 TYR N N 5.796 7.817 -2.165 1.00 . A A . 7 TYR N 1 1 5 1589 1 1 8 TYR O O 7.128 9.403 -5.005 1.00 . A A . 7 TYR O 1 1 5 1590 1 1 8 TYR OH O 10.385 4.639 0.132 1.00 . A A . 7 TYR OH 1 1 5 1591 1 1 9 THR C C 7.556 5.443 -5.870 1.00 . A A . 8 THR C 1 1 5 1592 1 1 9 THR CA C 8.052 6.847 -5.555 1.00 . A A . 8 THR CA 1 1 5 1593 1 1 9 THR CB C 9.591 6.839 -5.560 1.00 . A A . 8 THR CB 1 1 5 1594 1 1 9 THR CG2 C 10.143 8.241 -5.347 1.00 . A A . 8 THR CG2 1 1 5 1595 1 1 9 THR H H 7.482 6.687 -3.523 1.00 . A A . 8 THR H 1 1 5 1596 1 1 9 THR HA H 7.709 7.520 -6.323 1.00 . A A . 8 THR HA 1 1 5 1597 1 1 9 THR HB H 9.931 6.476 -6.518 1.00 . A A . 8 THR HB 1 1 5 1598 1 1 9 THR HG1 H 9.367 5.379 -4.254 1.00 . A A . 8 THR HG1 1 1 5 1599 1 1 9 THR HG21 H 9.802 8.621 -4.394 1.00 . A A . 8 THR HG21 1 1 5 1600 1 1 9 THR HG22 H 9.795 8.890 -6.138 1.00 . A A . 8 THR HG22 1 1 5 1601 1 1 9 THR HG23 H 11.222 8.208 -5.355 1.00 . A A . 8 THR HG23 1 1 5 1602 1 1 9 THR N N 7.527 7.311 -4.277 1.00 . A A . 8 THR N 1 1 5 1603 1 1 9 THR O O 8.030 4.801 -6.806 1.00 . A A . 8 THR O 1 1 5 1604 1 1 9 THR OG1 O 10.074 5.969 -4.531 1.00 . A A . 8 THR OG1 1 1 5 1605 1 1 10 LEU C C 4.531 3.646 -5.007 1.00 . A A . 9 LEU C 1 1 5 1606 1 1 10 LEU CA C 6.035 3.646 -5.264 1.00 . A A . 9 LEU CA 1 1 5 1607 1 1 10 LEU CB C 6.726 2.654 -4.331 1.00 . A A . 9 LEU CB 1 1 5 1608 1 1 10 LEU CD1 C 8.849 1.708 -3.408 1.00 . A A . 9 LEU CD1 1 1 5 1609 1 1 10 LEU CD2 C 8.557 1.913 -5.879 1.00 . A A . 9 LEU CD2 1 1 5 1610 1 1 10 LEU CG C 8.238 2.531 -4.527 1.00 . A A . 9 LEU CG 1 1 5 1611 1 1 10 LEU H H 6.253 5.550 -4.365 1.00 . A A . 9 LEU H 1 1 5 1612 1 1 10 LEU HA H 6.215 3.348 -6.284 1.00 . A A . 9 LEU HA 1 1 5 1613 1 1 10 LEU HB2 H 6.540 2.960 -3.314 1.00 . A A . 9 LEU HB2 1 1 5 1614 1 1 10 LEU HB3 H 6.285 1.681 -4.484 1.00 . A A . 9 LEU HB3 1 1 5 1615 1 1 10 LEU HD11 H 8.659 2.193 -2.461 1.00 . A A . 9 LEU HD11 1 1 5 1616 1 1 10 LEU HD12 H 9.914 1.625 -3.563 1.00 . A A . 9 LEU HD12 1 1 5 1617 1 1 10 LEU HD13 H 8.406 0.725 -3.405 1.00 . A A . 9 LEU HD13 1 1 5 1618 1 1 10 LEU HD21 H 8.089 0.942 -5.951 1.00 . A A . 9 LEU HD21 1 1 5 1619 1 1 10 LEU HD22 H 9.626 1.806 -5.983 1.00 . A A . 9 LEU HD22 1 1 5 1620 1 1 10 LEU HD23 H 8.181 2.552 -6.664 1.00 . A A . 9 LEU HD23 1 1 5 1621 1 1 10 LEU HG H 8.681 3.516 -4.496 1.00 . A A . 9 LEU HG 1 1 5 1622 1 1 10 LEU N N 6.596 4.979 -5.083 1.00 . A A . 9 LEU N 1 1 5 1623 1 1 10 LEU O O 3.937 2.600 -4.747 1.00 . A A . 9 LEU O 1 1 5 1624 1 1 11 LEU C C 1.695 3.855 -5.459 1.00 . A A . 10 LEU C 1 1 5 1625 1 1 11 LEU CA C 2.495 5.002 -4.846 1.00 . A A . 10 LEU CA 1 1 5 1626 1 1 11 LEU CB C 2.019 6.336 -5.435 1.00 . A A . 10 LEU CB 1 1 5 1627 1 1 11 LEU CD1 C 2.535 8.607 -6.366 1.00 . A A . 10 LEU CD1 1 1 5 1628 1 1 11 LEU CD2 C 3.899 7.701 -4.478 1.00 . A A . 10 LEU CD2 1 1 5 1629 1 1 11 LEU CG C 3.125 7.353 -5.738 1.00 . A A . 10 LEU CG 1 1 5 1630 1 1 11 LEU H H 4.477 5.621 -5.252 1.00 . A A . 10 LEU H 1 1 5 1631 1 1 11 LEU HA H 2.325 5.011 -3.782 1.00 . A A . 10 LEU HA 1 1 5 1632 1 1 11 LEU HB2 H 1.489 6.131 -6.353 1.00 . A A . 10 LEU HB2 1 1 5 1633 1 1 11 LEU HB3 H 1.330 6.785 -4.736 1.00 . A A . 10 LEU HB3 1 1 5 1634 1 1 11 LEU HD11 H 3.326 9.315 -6.569 1.00 . A A . 10 LEU HD11 1 1 5 1635 1 1 11 LEU HD12 H 1.823 9.050 -5.685 1.00 . A A . 10 LEU HD12 1 1 5 1636 1 1 11 LEU HD13 H 2.037 8.349 -7.289 1.00 . A A . 10 LEU HD13 1 1 5 1637 1 1 11 LEU HD21 H 4.715 8.362 -4.727 1.00 . A A . 10 LEU HD21 1 1 5 1638 1 1 11 LEU HD22 H 4.295 6.796 -4.030 1.00 . A A . 10 LEU HD22 1 1 5 1639 1 1 11 LEU HD23 H 3.243 8.189 -3.775 1.00 . A A . 10 LEU HD23 1 1 5 1640 1 1 11 LEU HG H 3.818 6.923 -6.444 1.00 . A A . 10 LEU HG 1 1 5 1641 1 1 11 LEU N N 3.932 4.831 -5.067 1.00 . A A . 10 LEU N 1 1 5 1642 1 1 11 LEU O O 1.253 2.949 -4.754 1.00 . A A . 10 LEU O 1 1 5 1643 1 1 12 SER C C 1.555 1.554 -7.471 1.00 . A A . 11 SER C 1 1 5 1644 1 1 12 SER CA C 0.773 2.861 -7.479 1.00 . A A . 11 SER CA 1 1 5 1645 1 1 12 SER CB C 0.486 3.292 -8.919 1.00 . A A . 11 SER CB 1 1 5 1646 1 1 12 SER H H 1.887 4.651 -7.283 1.00 . A A . 11 SER H 1 1 5 1647 1 1 12 SER HA H -0.164 2.712 -6.963 1.00 . A A . 11 SER HA 1 1 5 1648 1 1 12 SER HB2 H -0.061 2.510 -9.424 1.00 . A A . 11 SER HB2 1 1 5 1649 1 1 12 SER HB3 H -0.103 4.196 -8.912 1.00 . A A . 11 SER HB3 1 1 5 1650 1 1 12 SER HG H 2.062 4.375 -9.343 1.00 . A A . 11 SER HG 1 1 5 1651 1 1 12 SER N N 1.514 3.901 -6.776 1.00 . A A . 11 SER N 1 1 5 1652 1 1 12 SER O O 1.056 0.512 -7.898 1.00 . A A . 11 SER O 1 1 5 1653 1 1 12 SER OG O 1.687 3.538 -9.628 1.00 . A A . 11 SER OG 1 1 5 1654 1 1 13 ARG C C 3.571 -0.191 -5.529 1.00 . A A . 12 ARG C 1 1 5 1655 1 1 13 ARG CA C 3.657 0.458 -6.905 1.00 . A A . 12 ARG CA 1 1 5 1656 1 1 13 ARG CB C 5.100 0.871 -7.199 1.00 . A A . 12 ARG CB 1 1 5 1657 1 1 13 ARG CD C 6.723 1.932 -8.799 1.00 . A A . 12 ARG CD 1 1 5 1658 1 1 13 ARG CG C 5.297 1.448 -8.592 1.00 . A A . 12 ARG CG 1 1 5 1659 1 1 13 ARG CZ C 8.966 0.962 -9.075 1.00 . A A . 12 ARG CZ 1 1 5 1660 1 1 13 ARG H H 3.122 2.487 -6.661 1.00 . A A . 12 ARG H 1 1 5 1661 1 1 13 ARG HA H 3.331 -0.250 -7.648 1.00 . A A . 12 ARG HA 1 1 5 1662 1 1 13 ARG HB2 H 5.398 1.620 -6.479 1.00 . A A . 12 ARG HB2 1 1 5 1663 1 1 13 ARG HB3 H 5.739 0.007 -7.095 1.00 . A A . 12 ARG HB3 1 1 5 1664 1 1 13 ARG HD2 H 6.793 2.400 -9.770 1.00 . A A . 12 ARG HD2 1 1 5 1665 1 1 13 ARG HD3 H 6.959 2.658 -8.032 1.00 . A A . 12 ARG HD3 1 1 5 1666 1 1 13 ARG HE H 7.368 -0.029 -8.409 1.00 . A A . 12 ARG HE 1 1 5 1667 1 1 13 ARG HG2 H 5.077 0.683 -9.322 1.00 . A A . 12 ARG HG2 1 1 5 1668 1 1 13 ARG HG3 H 4.621 2.280 -8.724 1.00 . A A . 12 ARG HG3 1 1 5 1669 1 1 13 ARG HH11 H 10.393 2.213 -9.772 1.00 . A A . 12 ARG HH11 1 1 5 1670 1 1 13 ARG HH12 H 8.819 2.913 -9.584 1.00 . A A . 12 ARG HH12 1 1 5 1671 1 1 13 ARG HH21 H 10.743 0.014 -9.242 1.00 . A A . 12 ARG HH21 1 1 5 1672 1 1 13 ARG HH22 H 9.436 -0.958 -8.652 1.00 . A A . 12 ARG HH22 1 1 5 1673 1 1 13 ARG N N 2.787 1.624 -6.981 1.00 . A A . 12 ARG N 1 1 5 1674 1 1 13 ARG NE N 7.688 0.839 -8.730 1.00 . A A . 12 ARG NE 1 1 5 1675 1 1 13 ARG NH1 N 9.431 2.125 -9.513 1.00 . A A . 12 ARG NH1 1 1 5 1676 1 1 13 ARG NH2 N 9.783 -0.080 -8.982 1.00 . A A . 12 ARG NH2 1 1 5 1677 1 1 13 ARG O O 4.343 -1.093 -5.204 1.00 . A A . 12 ARG O 1 1 5 1678 1 1 14 VAL C C 0.936 -0.233 -3.024 1.00 . A A . 13 VAL C 1 1 5 1679 1 1 14 VAL CA C 2.415 -0.236 -3.385 1.00 . A A . 13 VAL CA 1 1 5 1680 1 1 14 VAL CB C 3.185 0.606 -2.349 1.00 . A A . 13 VAL CB 1 1 5 1681 1 1 14 VAL CG1 C 2.854 0.163 -0.935 1.00 . A A . 13 VAL CG1 1 1 5 1682 1 1 14 VAL CG2 C 4.680 0.523 -2.603 1.00 . A A . 13 VAL CG2 1 1 5 1683 1 1 14 VAL H H 2.034 0.983 -5.058 1.00 . A A . 13 VAL H 1 1 5 1684 1 1 14 VAL HA H 2.788 -1.249 -3.348 1.00 . A A . 13 VAL HA 1 1 5 1685 1 1 14 VAL HB H 2.879 1.636 -2.456 1.00 . A A . 13 VAL HB 1 1 5 1686 1 1 14 VAL HG11 H 3.157 -0.864 -0.799 1.00 . A A . 13 VAL HG11 1 1 5 1687 1 1 14 VAL HG12 H 1.791 0.251 -0.772 1.00 . A A . 13 VAL HG12 1 1 5 1688 1 1 14 VAL HG13 H 3.380 0.791 -0.230 1.00 . A A . 13 VAL HG13 1 1 5 1689 1 1 14 VAL HG21 H 4.895 0.887 -3.596 1.00 . A A . 13 VAL HG21 1 1 5 1690 1 1 14 VAL HG22 H 5.003 -0.504 -2.518 1.00 . A A . 13 VAL HG22 1 1 5 1691 1 1 14 VAL HG23 H 5.203 1.126 -1.877 1.00 . A A . 13 VAL HG23 1 1 5 1692 1 1 14 VAL N N 2.619 0.276 -4.731 1.00 . A A . 13 VAL N 1 1 5 1693 1 1 14 VAL O O 0.375 0.809 -2.687 1.00 . A A . 13 VAL O 1 1 5 1694 1 1 15 ASN C C -1.390 -0.949 -1.404 1.00 . A A . 14 ASN C 1 1 5 1695 1 1 15 ASN CA C -1.107 -1.531 -2.783 1.00 . A A . 14 ASN CA 1 1 5 1696 1 1 15 ASN CB C -1.535 -3.001 -2.829 1.00 . A A . 14 ASN CB 1 1 5 1697 1 1 15 ASN CG C -1.561 -3.562 -4.240 1.00 . A A . 14 ASN CG 1 1 5 1698 1 1 15 ASN H H 0.807 -2.190 -3.407 1.00 . A A . 14 ASN H 1 1 5 1699 1 1 15 ASN HA H -1.670 -0.977 -3.518 1.00 . A A . 14 ASN HA 1 1 5 1700 1 1 15 ASN HB2 H -0.843 -3.588 -2.242 1.00 . A A . 14 ASN HB2 1 1 5 1701 1 1 15 ASN HB3 H -2.524 -3.093 -2.408 1.00 . A A . 14 ASN HB3 1 1 5 1702 1 1 15 ASN HD21 H -0.074 -2.359 -4.787 1.00 . A A . 14 ASN HD21 1 1 5 1703 1 1 15 ASN HD22 H -0.683 -3.406 -6.018 1.00 . A A . 14 ASN HD22 1 1 5 1704 1 1 15 ASN N N 0.308 -1.400 -3.111 1.00 . A A . 14 ASN N 1 1 5 1705 1 1 15 ASN ND2 N -0.684 -3.058 -5.102 1.00 . A A . 14 ASN ND2 1 1 5 1706 1 1 15 ASN O O -1.197 -1.614 -0.385 1.00 . A A . 14 ASN O 1 1 5 1707 1 1 15 ASN OD1 O -2.360 -4.445 -4.551 1.00 . A A . 14 ASN OD1 1 1 5 1708 1 1 16 ARG C C -3.260 0.272 0.632 1.00 . A A . 15 ARG C 1 1 5 1709 1 1 16 ARG CA C -2.141 0.983 -0.125 1.00 . A A . 15 ARG CA 1 1 5 1710 1 1 16 ARG CB C -2.535 2.436 -0.392 1.00 . A A . 15 ARG CB 1 1 5 1711 1 1 16 ARG CD C -4.125 4.044 -1.490 1.00 . A A . 15 ARG CD 1 1 5 1712 1 1 16 ARG CG C -3.781 2.583 -1.249 1.00 . A A . 15 ARG CG 1 1 5 1713 1 1 16 ARG CZ C -4.548 6.079 -0.173 1.00 . A A . 15 ARG CZ 1 1 5 1714 1 1 16 ARG H H -1.975 0.778 -2.225 1.00 . A A . 15 ARG H 1 1 5 1715 1 1 16 ARG HA H -1.245 0.968 0.479 1.00 . A A . 15 ARG HA 1 1 5 1716 1 1 16 ARG HB2 H -2.713 2.928 0.552 1.00 . A A . 15 ARG HB2 1 1 5 1717 1 1 16 ARG HB3 H -1.718 2.932 -0.897 1.00 . A A . 15 ARG HB3 1 1 5 1718 1 1 16 ARG HD2 H -3.303 4.511 -2.013 1.00 . A A . 15 ARG HD2 1 1 5 1719 1 1 16 ARG HD3 H -5.015 4.095 -2.099 1.00 . A A . 15 ARG HD3 1 1 5 1720 1 1 16 ARG HE H -4.383 4.241 0.587 1.00 . A A . 15 ARG HE 1 1 5 1721 1 1 16 ARG HG2 H -3.612 2.101 -2.200 1.00 . A A . 15 ARG HG2 1 1 5 1722 1 1 16 ARG HG3 H -4.609 2.107 -0.744 1.00 . A A . 15 ARG HG3 1 1 5 1723 1 1 16 ARG HH11 H -4.368 6.381 -2.163 1.00 . A A . 15 ARG HH11 1 1 5 1724 1 1 16 ARG HH12 H -4.666 7.803 -1.220 1.00 . A A . 15 ARG HH12 1 1 5 1725 1 1 16 ARG HH21 H -4.898 7.648 1.052 1.00 . A A . 15 ARG HH21 1 1 5 1726 1 1 16 ARG HH22 H -4.776 6.108 1.835 1.00 . A A . 15 ARG HH22 1 1 5 1727 1 1 16 ARG N N -1.841 0.301 -1.378 1.00 . A A . 15 ARG N 1 1 5 1728 1 1 16 ARG NE N -4.362 4.764 -0.242 1.00 . A A . 15 ARG NE 1 1 5 1729 1 1 16 ARG NH1 N -4.526 6.815 -1.276 1.00 . A A . 15 ARG NH1 1 1 5 1730 1 1 16 ARG NH2 N -4.758 6.659 1.001 1.00 . A A . 15 ARG NH2 1 1 5 1731 1 1 16 ARG O O -3.747 -0.774 0.204 1.00 . A A . 15 ARG O 1 1 5 1732 1 1 17 HIS C C -5.771 1.327 2.932 1.00 . A A . 16 HIS C 1 1 5 1733 1 1 17 HIS CA C -4.726 0.275 2.577 1.00 . A A . 16 HIS CA 1 1 5 1734 1 1 17 HIS CB C -4.141 -0.331 3.853 1.00 . A A . 16 HIS CB 1 1 5 1735 1 1 17 HIS CD2 C -3.271 -2.773 3.757 1.00 . A A . 16 HIS CD2 1 1 5 1736 1 1 17 HIS CE1 C -1.259 -2.366 2.987 1.00 . A A . 16 HIS CE1 1 1 5 1737 1 1 17 HIS CG C -3.160 -1.433 3.596 1.00 . A A . 16 HIS CG 1 1 5 1738 1 1 17 HIS H H -3.238 1.685 2.047 1.00 . A A . 16 HIS H 1 1 5 1739 1 1 17 HIS HA H -5.199 -0.507 2.002 1.00 . A A . 16 HIS HA 1 1 5 1740 1 1 17 HIS HB2 H -3.632 0.442 4.410 1.00 . A A . 16 HIS HB2 1 1 5 1741 1 1 17 HIS HB3 H -4.943 -0.733 4.454 1.00 . A A . 16 HIS HB3 1 1 5 1742 1 1 17 HIS HD1 H -1.504 -0.337 2.893 1.00 . A A . 16 HIS HD1 1 1 5 1743 1 1 17 HIS HD2 H -4.138 -3.306 4.122 1.00 . A A . 16 HIS HD2 1 1 5 1744 1 1 17 HIS HE1 H -0.248 -2.500 2.631 1.00 . A A . 16 HIS HE1 1 1 5 1745 1 1 17 HIS HE2 H -1.862 -4.284 3.380 1.00 . A A . 16 HIS HE2 1 1 5 1746 1 1 17 HIS N N -3.664 0.851 1.759 1.00 . A A . 16 HIS N 1 1 5 1747 1 1 17 HIS ND1 N -1.888 -1.211 3.113 1.00 . A A . 16 HIS ND1 1 1 5 1748 1 1 17 HIS NE2 N -2.076 -3.328 3.372 1.00 . A A . 16 HIS NE2 1 1 5 1749 1 1 17 HIS O O -5.478 2.522 2.963 1.00 . A A . 16 HIS O 1 1 5 1750 1 1 18 SER C C -7.983 2.207 5.010 1.00 . A A . 17 SER C 1 1 5 1751 1 1 18 SER CA C -8.082 1.775 3.551 1.00 . A A . 17 SER CA 1 1 5 1752 1 1 18 SER CB C -9.432 1.100 3.299 1.00 . A A . 17 SER CB 1 1 5 1753 1 1 18 SER H H -7.164 -0.090 3.157 1.00 . A A . 17 SER H 1 1 5 1754 1 1 18 SER HA H -8.006 2.650 2.923 1.00 . A A . 17 SER HA 1 1 5 1755 1 1 18 SER HB2 H -9.513 0.841 2.254 1.00 . A A . 17 SER HB2 1 1 5 1756 1 1 18 SER HB3 H -9.501 0.204 3.898 1.00 . A A . 17 SER HB3 1 1 5 1757 1 1 18 SER HG H -11.339 1.513 3.474 1.00 . A A . 17 SER HG 1 1 5 1758 1 1 18 SER N N -6.992 0.874 3.198 1.00 . A A . 17 SER N 1 1 5 1759 1 1 18 SER O O -8.131 1.392 5.921 1.00 . A A . 17 SER O 1 1 5 1760 1 1 18 SER OG O -10.506 1.959 3.640 1.00 . A A . 17 SER OG 1 1 5 1761 1 1 19 THR C C -8.580 5.195 6.784 1.00 . A A . 18 THR C 1 1 5 1762 1 1 19 THR CA C -7.611 4.037 6.573 1.00 . A A . 18 THR CA 1 1 5 1763 1 1 19 THR CB C -6.177 4.520 6.860 1.00 . A A . 18 THR CB 1 1 5 1764 1 1 19 THR CG2 C -6.048 5.018 8.293 1.00 . A A . 18 THR CG2 1 1 5 1765 1 1 19 THR H H -7.621 4.094 4.457 1.00 . A A . 18 THR H 1 1 5 1766 1 1 19 THR HA H -7.850 3.248 7.272 1.00 . A A . 18 THR HA 1 1 5 1767 1 1 19 THR HB H -5.947 5.335 6.189 1.00 . A A . 18 THR HB 1 1 5 1768 1 1 19 THR HG1 H -5.284 2.837 7.372 1.00 . A A . 18 THR HG1 1 1 5 1769 1 1 19 THR HG21 H -6.291 4.216 8.975 1.00 . A A . 18 THR HG21 1 1 5 1770 1 1 19 THR HG22 H -6.727 5.842 8.449 1.00 . A A . 18 THR HG22 1 1 5 1771 1 1 19 THR HG23 H -5.034 5.347 8.470 1.00 . A A . 18 THR HG23 1 1 5 1772 1 1 19 THR N N -7.730 3.495 5.225 1.00 . A A . 18 THR N 1 1 5 1773 1 1 19 THR O O -8.401 6.276 6.221 1.00 . A A . 18 THR O 1 1 5 1774 1 1 19 THR OG1 O -5.246 3.453 6.637 1.00 . A A . 18 THR OG1 1 1 5 1775 1 1 20 ALA C C -11.293 6.460 6.609 1.00 . A A . 19 ALA C 1 1 5 1776 1 1 20 ALA CA C -10.609 5.982 7.886 1.00 . A A . 19 ALA CA 1 1 5 1777 1 1 20 ALA CB C -9.974 7.155 8.618 1.00 . A A . 19 ALA CB 1 1 5 1778 1 1 20 ALA H H -9.694 4.078 8.013 1.00 . A A . 19 ALA H 1 1 5 1779 1 1 20 ALA HA H -11.353 5.543 8.536 1.00 . A A . 19 ALA HA 1 1 5 1780 1 1 20 ALA HB1 H -9.491 6.798 9.518 1.00 . A A . 19 ALA HB1 1 1 5 1781 1 1 20 ALA HB2 H -10.737 7.872 8.880 1.00 . A A . 19 ALA HB2 1 1 5 1782 1 1 20 ALA HB3 H -9.241 7.625 7.980 1.00 . A A . 19 ALA HB3 1 1 5 1783 1 1 20 ALA N N -9.607 4.961 7.597 1.00 . A A . 19 ALA N 1 1 5 1784 1 1 20 ALA O O -11.073 5.909 5.530 1.00 . A A . 19 ALA O 1 1 5 1785 1 1 21 ILE C C -12.567 9.534 5.447 1.00 . A A . 20 ILE C 1 1 5 1786 1 1 21 ILE CA C -12.844 8.041 5.597 1.00 . A A . 20 ILE CA 1 1 5 1787 1 1 21 ILE CB C -14.364 7.818 5.725 1.00 . A A . 20 ILE CB 1 1 5 1788 1 1 21 ILE CD1 C -16.128 6.034 6.179 1.00 . A A . 20 ILE CD1 1 1 5 1789 1 1 21 ILE CG1 C -14.668 6.329 5.908 1.00 . A A . 20 ILE CG1 1 1 5 1790 1 1 21 ILE CG2 C -15.086 8.369 4.503 1.00 . A A . 20 ILE CG2 1 1 5 1791 1 1 21 ILE H H -12.263 7.883 7.625 1.00 . A A . 20 ILE H 1 1 5 1792 1 1 21 ILE HA H -12.500 7.531 4.708 1.00 . A A . 20 ILE HA 1 1 5 1793 1 1 21 ILE HB H -14.712 8.359 6.593 1.00 . A A . 20 ILE HB 1 1 5 1794 1 1 21 ILE HD11 H -16.263 4.969 6.297 1.00 . A A . 20 ILE HD11 1 1 5 1795 1 1 21 ILE HD12 H -16.725 6.383 5.350 1.00 . A A . 20 ILE HD12 1 1 5 1796 1 1 21 ILE HD13 H -16.436 6.539 7.083 1.00 . A A . 20 ILE HD13 1 1 5 1797 1 1 21 ILE HG12 H -14.384 5.798 5.012 1.00 . A A . 20 ILE HG12 1 1 5 1798 1 1 21 ILE HG13 H -14.094 5.952 6.742 1.00 . A A . 20 ILE HG13 1 1 5 1799 1 1 21 ILE HG21 H -16.148 8.206 4.609 1.00 . A A . 20 ILE HG21 1 1 5 1800 1 1 21 ILE HG22 H -14.731 7.862 3.618 1.00 . A A . 20 ILE HG22 1 1 5 1801 1 1 21 ILE HG23 H -14.891 9.427 4.415 1.00 . A A . 20 ILE HG23 1 1 5 1802 1 1 21 ILE N N -12.127 7.488 6.739 1.00 . A A . 20 ILE N 1 1 5 1803 1 1 21 ILE O O -12.839 10.319 6.356 1.00 . A A . 20 ILE O 1 1 5 1804 1 1 22 GLY C C -11.866 11.686 2.581 1.00 . A A . 21 GLY C 1 1 5 1805 1 1 22 GLY CA C -11.724 11.314 4.044 1.00 . A A . 21 GLY CA 1 1 5 1806 1 1 22 GLY H H -11.834 9.245 3.607 1.00 . A A . 21 GLY H 1 1 5 1807 1 1 22 GLY HA2 H -12.395 11.927 4.627 1.00 . A A . 21 GLY HA2 1 1 5 1808 1 1 22 GLY HA3 H -10.710 11.512 4.357 1.00 . A A . 21 GLY HA3 1 1 5 1809 1 1 22 GLY N N -12.028 9.917 4.293 1.00 . A A . 21 GLY N 1 1 5 1810 1 1 22 GLY O O -12.023 10.816 1.725 1.00 . A A . 21 GLY O 1 1 5 1811 1 1 23 ARG C C -10.563 13.650 0.285 1.00 . A A . 22 ARG C 1 1 5 1812 1 1 23 ARG CA C -11.936 13.469 0.925 1.00 . A A . 22 ARG CA 1 1 5 1813 1 1 23 ARG CB C -12.703 14.793 0.899 1.00 . A A . 22 ARG CB 1 1 5 1814 1 1 23 ARG CD C -14.830 16.029 1.416 1.00 . A A . 22 ARG CD 1 1 5 1815 1 1 23 ARG CG C -14.112 14.690 1.461 1.00 . A A . 22 ARG CG 1 1 5 1816 1 1 23 ARG CZ C -15.537 17.694 -0.252 1.00 . A A . 22 ARG CZ 1 1 5 1817 1 1 23 ARG H H -11.685 13.628 3.021 1.00 . A A . 22 ARG H 1 1 5 1818 1 1 23 ARG HA H -12.488 12.733 0.361 1.00 . A A . 22 ARG HA 1 1 5 1819 1 1 23 ARG HB2 H -12.160 15.522 1.481 1.00 . A A . 22 ARG HB2 1 1 5 1820 1 1 23 ARG HB3 H -12.770 15.137 -0.122 1.00 . A A . 22 ARG HB3 1 1 5 1821 1 1 23 ARG HD2 H -15.819 15.907 1.830 1.00 . A A . 22 ARG HD2 1 1 5 1822 1 1 23 ARG HD3 H -14.275 16.740 2.012 1.00 . A A . 22 ARG HD3 1 1 5 1823 1 1 23 ARG HE H -14.566 16.001 -0.669 1.00 . A A . 22 ARG HE 1 1 5 1824 1 1 23 ARG HG2 H -14.670 13.974 0.878 1.00 . A A . 22 ARG HG2 1 1 5 1825 1 1 23 ARG HG3 H -14.056 14.357 2.487 1.00 . A A . 22 ARG HG3 1 1 5 1826 1 1 23 ARG HH11 H -16.013 18.154 1.657 1.00 . A A . 22 ARG HH11 1 1 5 1827 1 1 23 ARG HH12 H -16.503 19.315 0.470 1.00 . A A . 22 ARG HH12 1 1 5 1828 1 1 23 ARG HH21 H -15.208 17.526 -2.239 1.00 . A A . 22 ARG HH21 1 1 5 1829 1 1 23 ARG HH22 H -16.046 18.958 -1.745 1.00 . A A . 22 ARG HH22 1 1 5 1830 1 1 23 ARG N N -11.811 12.983 2.293 1.00 . A A . 22 ARG N 1 1 5 1831 1 1 23 ARG NE N -14.946 16.542 0.054 1.00 . A A . 22 ARG NE 1 1 5 1832 1 1 23 ARG NH1 N -16.060 18.450 0.704 1.00 . A A . 22 ARG NH1 1 1 5 1833 1 1 23 ARG NH2 N -15.602 18.092 -1.516 1.00 . A A . 22 ARG NH2 1 1 5 1834 1 1 23 ARG O O -9.981 14.747 0.431 1.00 . A A . 22 ARG O 1 1 5 1835 1 1 23 ARG OXT O -10.079 12.694 -0.357 1.00 . A A . 22 ARG OXT 1 1 6 1836 1 1 1 ACE C C 3.367 1.343 11.719 1.00 . A A . 0 ACE C 1 1 6 1837 1 1 1 ACE CH3 C 3.987 0.668 12.912 1.00 . A A . 0 ACE CH3 1 1 6 1838 1 1 1 ACE H1 H 4.384 1.430 13.575 1.00 . A A . 0 ACE H1 1 1 6 1839 1 1 1 ACE H2 H 4.785 0.027 12.586 1.00 . A A . 0 ACE H2 1 1 6 1840 1 1 1 ACE H3 H 3.227 0.074 13.410 1.00 . A A . 0 ACE H3 1 1 6 1841 1 1 1 ACE O O 2.211 1.087 11.379 1.00 . A A . 0 ACE O 1 1 6 1842 1 1 2 MET C C 4.044 2.211 8.617 1.00 . A A . 1 MET C 1 1 6 1843 1 1 2 MET CA C 3.655 2.935 9.900 1.00 . A A . 1 MET CA 1 1 6 1844 1 1 2 MET CB C 4.230 4.354 9.871 1.00 . A A . 1 MET CB 1 1 6 1845 1 1 2 MET CE C 2.222 6.342 12.943 1.00 . A A . 1 MET CE 1 1 6 1846 1 1 2 MET CG C 3.949 5.161 11.126 1.00 . A A . 1 MET CG 1 1 6 1847 1 1 2 MET H H 5.048 2.374 11.392 1.00 . A A . 1 MET H 1 1 6 1848 1 1 2 MET HA H 2.579 2.992 9.960 1.00 . A A . 1 MET HA 1 1 6 1849 1 1 2 MET HB2 H 5.301 4.291 9.744 1.00 . A A . 1 MET HB2 1 1 6 1850 1 1 2 MET HB3 H 3.808 4.882 9.030 1.00 . A A . 1 MET HB3 1 1 6 1851 1 1 2 MET HE1 H 2.732 5.790 13.718 1.00 . A A . 1 MET HE1 1 1 6 1852 1 1 2 MET HE2 H 1.211 6.554 13.259 1.00 . A A . 1 MET HE2 1 1 6 1853 1 1 2 MET HE3 H 2.744 7.270 12.758 1.00 . A A . 1 MET HE3 1 1 6 1854 1 1 2 MET HG2 H 4.394 4.656 11.970 1.00 . A A . 1 MET HG2 1 1 6 1855 1 1 2 MET HG3 H 4.398 6.138 11.015 1.00 . A A . 1 MET HG3 1 1 6 1856 1 1 2 MET N N 4.136 2.213 11.073 1.00 . A A . 1 MET N 1 1 6 1857 1 1 2 MET O O 5.202 2.251 8.202 1.00 . A A . 1 MET O 1 1 6 1858 1 1 2 MET SD S 2.185 5.368 11.441 1.00 . A A . 1 MET SD 1 1 6 1859 1 1 3 ASN C C 3.040 1.709 5.545 1.00 . A A . 2 ASN C 1 1 6 1860 1 1 3 ASN CA C 3.349 0.835 6.746 1.00 . A A . 2 ASN CA 1 1 6 1861 1 1 3 ASN CB C 2.549 -0.465 6.650 1.00 . A A . 2 ASN CB 1 1 6 1862 1 1 3 ASN CG C 2.483 -1.007 5.225 1.00 . A A . 2 ASN CG 1 1 6 1863 1 1 3 ASN H H 2.174 1.533 8.367 1.00 . A A . 2 ASN H 1 1 6 1864 1 1 3 ASN HA H 4.402 0.596 6.732 1.00 . A A . 2 ASN HA 1 1 6 1865 1 1 3 ASN HB2 H 3.014 -1.211 7.276 1.00 . A A . 2 ASN HB2 1 1 6 1866 1 1 3 ASN HB3 H 1.541 -0.287 6.994 1.00 . A A . 2 ASN HB3 1 1 6 1867 1 1 3 ASN HD21 H 4.205 -0.113 4.748 1.00 . A A . 2 ASN HD21 1 1 6 1868 1 1 3 ASN HD22 H 3.455 -1.012 3.477 1.00 . A A . 2 ASN HD22 1 1 6 1869 1 1 3 ASN N N 3.078 1.546 7.989 1.00 . A A . 2 ASN N 1 1 6 1870 1 1 3 ASN ND2 N 3.484 -0.679 4.402 1.00 . A A . 2 ASN ND2 1 1 6 1871 1 1 3 ASN O O 1.904 2.135 5.337 1.00 . A A . 2 ASN O 1 1 6 1872 1 1 3 ASN OD1 O 1.540 -1.710 4.865 1.00 . A A . 2 ASN OD1 1 1 6 1873 1 1 4 TRP C C 5.204 2.624 2.725 1.00 . A A . 3 TRP C 1 1 6 1874 1 1 4 TRP CA C 3.950 2.763 3.562 1.00 . A A . 3 TRP CA 1 1 6 1875 1 1 4 TRP CB C 3.662 4.229 3.898 1.00 . A A . 3 TRP CB 1 1 6 1876 1 1 4 TRP CD1 C 4.520 4.662 6.273 1.00 . A A . 3 TRP CD1 1 1 6 1877 1 1 4 TRP CD2 C 5.658 5.717 4.674 1.00 . A A . 3 TRP CD2 1 1 6 1878 1 1 4 TRP CE2 C 6.218 6.061 5.914 1.00 . A A . 3 TRP CE2 1 1 6 1879 1 1 4 TRP CE3 C 6.205 6.249 3.513 1.00 . A A . 3 TRP CE3 1 1 6 1880 1 1 4 TRP CG C 4.570 4.832 4.924 1.00 . A A . 3 TRP CG 1 1 6 1881 1 1 4 TRP CH2 C 7.824 7.437 4.867 1.00 . A A . 3 TRP CH2 1 1 6 1882 1 1 4 TRP CZ2 C 7.302 6.923 6.024 1.00 . A A . 3 TRP CZ2 1 1 6 1883 1 1 4 TRP CZ3 C 7.286 7.104 3.617 1.00 . A A . 3 TRP CZ3 1 1 6 1884 1 1 4 TRP H H 4.948 1.606 5.003 1.00 . A A . 3 TRP H 1 1 6 1885 1 1 4 TRP HA H 3.127 2.379 2.988 1.00 . A A . 3 TRP HA 1 1 6 1886 1 1 4 TRP HB2 H 3.752 4.815 2.996 1.00 . A A . 3 TRP HB2 1 1 6 1887 1 1 4 TRP HB3 H 2.650 4.308 4.268 1.00 . A A . 3 TRP HB3 1 1 6 1888 1 1 4 TRP HD1 H 3.807 4.037 6.772 1.00 . A A . 3 TRP HD1 1 1 6 1889 1 1 4 TRP HE1 H 5.667 5.454 7.845 1.00 . A A . 3 TRP HE1 1 1 6 1890 1 1 4 TRP HE3 H 5.800 5.989 2.546 1.00 . A A . 3 TRP HE3 1 1 6 1891 1 1 4 TRP HH2 H 8.668 8.109 4.904 1.00 . A A . 3 TRP HH2 1 1 6 1892 1 1 4 TRP HZ2 H 7.722 7.190 6.980 1.00 . A A . 3 TRP HZ2 1 1 6 1893 1 1 4 TRP HZ3 H 7.724 7.528 2.726 1.00 . A A . 3 TRP HZ3 1 1 6 1894 1 1 4 TRP N N 4.070 1.966 4.762 1.00 . A A . 3 TRP N 1 1 6 1895 1 1 4 TRP NE1 N 5.503 5.405 6.880 1.00 . A A . 3 TRP NE1 1 1 6 1896 1 1 4 TRP O O 5.195 1.926 1.712 1.00 . A A . 3 TRP O 1 1 6 1897 1 1 5 THR C C 7.368 3.102 0.985 1.00 . A A . 4 THR C 1 1 6 1898 1 1 5 THR CA C 7.558 3.219 2.497 1.00 . A A . 4 THR CA 1 1 6 1899 1 1 5 THR CB C 8.443 2.068 3.009 1.00 . A A . 4 THR CB 1 1 6 1900 1 1 5 THR CG2 C 7.971 0.719 2.480 1.00 . A A . 4 THR CG2 1 1 6 1901 1 1 5 THR H H 6.238 3.709 4.040 1.00 . A A . 4 THR H 1 1 6 1902 1 1 5 THR HA H 8.054 4.150 2.720 1.00 . A A . 4 THR HA 1 1 6 1903 1 1 5 THR HB H 8.392 2.051 4.090 1.00 . A A . 4 THR HB 1 1 6 1904 1 1 5 THR HG1 H 9.982 3.237 2.709 1.00 . A A . 4 THR HG1 1 1 6 1905 1 1 5 THR HG21 H 6.936 0.568 2.750 1.00 . A A . 4 THR HG21 1 1 6 1906 1 1 5 THR HG22 H 8.574 -0.067 2.910 1.00 . A A . 4 THR HG22 1 1 6 1907 1 1 5 THR HG23 H 8.069 0.699 1.404 1.00 . A A . 4 THR HG23 1 1 6 1908 1 1 5 THR N N 6.287 3.241 3.189 1.00 . A A . 4 THR N 1 1 6 1909 1 1 5 THR O O 8.216 2.555 0.278 1.00 . A A . 4 THR O 1 1 6 1910 1 1 5 THR OG1 O 9.793 2.301 2.617 1.00 . A A . 4 THR OG1 1 1 6 1911 1 1 6 GLY C C 4.884 4.548 -1.359 1.00 . A A . 5 GLY C 1 1 6 1912 1 1 6 GLY CA C 5.954 3.565 -0.918 1.00 . A A . 5 GLY CA 1 1 6 1913 1 1 6 GLY H H 5.641 4.112 1.097 1.00 . A A . 5 GLY H 1 1 6 1914 1 1 6 GLY HA2 H 6.856 3.748 -1.481 1.00 . A A . 5 GLY HA2 1 1 6 1915 1 1 6 GLY HA3 H 5.608 2.561 -1.127 1.00 . A A . 5 GLY HA3 1 1 6 1916 1 1 6 GLY N N 6.257 3.648 0.493 1.00 . A A . 5 GLY N 1 1 6 1917 1 1 6 GLY O O 4.107 4.257 -2.265 1.00 . A A . 5 GLY O 1 1 6 1918 1 1 7 LEU C C 4.497 7.986 -1.632 1.00 . A A . 6 LEU C 1 1 6 1919 1 1 7 LEU CA C 3.844 6.734 -1.053 1.00 . A A . 6 LEU CA 1 1 6 1920 1 1 7 LEU CB C 3.038 7.109 0.179 1.00 . A A . 6 LEU CB 1 1 6 1921 1 1 7 LEU CD1 C 4.722 8.511 1.422 1.00 . A A . 6 LEU CD1 1 1 6 1922 1 1 7 LEU CD2 C 2.949 7.285 2.679 1.00 . A A . 6 LEU CD2 1 1 6 1923 1 1 7 LEU CG C 3.856 7.260 1.464 1.00 . A A . 6 LEU CG 1 1 6 1924 1 1 7 LEU H H 5.452 5.866 0.029 1.00 . A A . 6 LEU H 1 1 6 1925 1 1 7 LEU HA H 3.178 6.317 -1.792 1.00 . A A . 6 LEU HA 1 1 6 1926 1 1 7 LEU HB2 H 2.541 8.044 -0.021 1.00 . A A . 6 LEU HB2 1 1 6 1927 1 1 7 LEU HB3 H 2.291 6.347 0.335 1.00 . A A . 6 LEU HB3 1 1 6 1928 1 1 7 LEU HD11 H 5.424 8.437 0.606 1.00 . A A . 6 LEU HD11 1 1 6 1929 1 1 7 LEU HD12 H 5.262 8.605 2.355 1.00 . A A . 6 LEU HD12 1 1 6 1930 1 1 7 LEU HD13 H 4.095 9.378 1.281 1.00 . A A . 6 LEU HD13 1 1 6 1931 1 1 7 LEU HD21 H 2.287 8.135 2.616 1.00 . A A . 6 LEU HD21 1 1 6 1932 1 1 7 LEU HD22 H 3.553 7.361 3.573 1.00 . A A . 6 LEU HD22 1 1 6 1933 1 1 7 LEU HD23 H 2.368 6.376 2.711 1.00 . A A . 6 LEU HD23 1 1 6 1934 1 1 7 LEU HG H 4.512 6.408 1.560 1.00 . A A . 6 LEU HG 1 1 6 1935 1 1 7 LEU N N 4.831 5.707 -0.710 1.00 . A A . 6 LEU N 1 1 6 1936 1 1 7 LEU O O 3.902 9.064 -1.637 1.00 . A A . 6 LEU O 1 1 6 1937 1 1 8 TYR C C 6.946 8.597 -4.107 1.00 . A A . 7 TYR C 1 1 6 1938 1 1 8 TYR CA C 6.461 8.939 -2.703 1.00 . A A . 7 TYR CA 1 1 6 1939 1 1 8 TYR CB C 7.652 9.306 -1.815 1.00 . A A . 7 TYR CB 1 1 6 1940 1 1 8 TYR CD1 C 7.793 7.126 -0.603 1.00 . A A . 7 TYR CD1 1 1 6 1941 1 1 8 TYR CD2 C 9.774 7.940 -1.634 1.00 . A A . 7 TYR CD2 1 1 6 1942 1 1 8 TYR CE1 C 8.456 6.017 -0.170 1.00 . A A . 7 TYR CE1 1 1 6 1943 1 1 8 TYR CE2 C 10.460 6.821 -1.197 1.00 . A A . 7 TYR CE2 1 1 6 1944 1 1 8 TYR CG C 8.426 8.106 -1.339 1.00 . A A . 7 TYR CG 1 1 6 1945 1 1 8 TYR CZ C 9.794 5.859 -0.464 1.00 . A A . 7 TYR CZ 1 1 6 1946 1 1 8 TYR H H 6.125 6.949 -2.078 1.00 . A A . 7 TYR H 1 1 6 1947 1 1 8 TYR HA H 5.799 9.779 -2.758 1.00 . A A . 7 TYR HA 1 1 6 1948 1 1 8 TYR HB2 H 8.327 9.941 -2.369 1.00 . A A . 7 TYR HB2 1 1 6 1949 1 1 8 TYR HB3 H 7.293 9.835 -0.947 1.00 . A A . 7 TYR HB3 1 1 6 1950 1 1 8 TYR HD1 H 6.747 7.246 -0.368 1.00 . A A . 7 TYR HD1 1 1 6 1951 1 1 8 TYR HD2 H 10.285 8.698 -2.207 1.00 . A A . 7 TYR HD2 1 1 6 1952 1 1 8 TYR HE1 H 7.921 5.279 0.390 1.00 . A A . 7 TYR HE1 1 1 6 1953 1 1 8 TYR HE2 H 11.508 6.703 -1.431 1.00 . A A . 7 TYR HE2 1 1 6 1954 1 1 8 TYR HH H 9.931 3.960 -0.195 1.00 . A A . 7 TYR HH 1 1 6 1955 1 1 8 TYR N N 5.713 7.831 -2.121 1.00 . A A . 7 TYR N 1 1 6 1956 1 1 8 TYR O O 6.932 9.440 -5.003 1.00 . A A . 7 TYR O 1 1 6 1957 1 1 8 TYR OH O 10.466 4.740 -0.029 1.00 . A A . 7 TYR OH 1 1 6 1958 1 1 9 THR C C 7.427 5.464 -5.864 1.00 . A A . 8 THR C 1 1 6 1959 1 1 9 THR CA C 7.867 6.893 -5.584 1.00 . A A . 8 THR CA 1 1 6 1960 1 1 9 THR CB C 9.403 6.958 -5.656 1.00 . A A . 8 THR CB 1 1 6 1961 1 1 9 THR CG2 C 9.895 8.391 -5.516 1.00 . A A . 8 THR CG2 1 1 6 1962 1 1 9 THR H H 7.360 6.726 -3.536 1.00 . A A . 8 THR H 1 1 6 1963 1 1 9 THR HA H 7.460 7.540 -6.344 1.00 . A A . 8 THR HA 1 1 6 1964 1 1 9 THR HB H 9.719 6.575 -6.615 1.00 . A A . 8 THR HB 1 1 6 1965 1 1 9 THR HG1 H 9.329 5.491 -4.340 1.00 . A A . 8 THR HG1 1 1 6 1966 1 1 9 THR HG21 H 9.482 8.993 -6.313 1.00 . A A . 8 THR HG21 1 1 6 1967 1 1 9 THR HG22 H 10.973 8.409 -5.576 1.00 . A A . 8 THR HG22 1 1 6 1968 1 1 9 THR HG23 H 9.580 8.790 -4.564 1.00 . A A . 8 THR HG23 1 1 6 1969 1 1 9 THR N N 7.376 7.352 -4.290 1.00 . A A . 8 THR N 1 1 6 1970 1 1 9 THR O O 7.902 4.830 -6.805 1.00 . A A . 8 THR O 1 1 6 1971 1 1 9 THR OG1 O 9.972 6.149 -4.620 1.00 . A A . 8 THR OG1 1 1 6 1972 1 1 10 LEU C C 4.516 3.534 -4.915 1.00 . A A . 9 LEU C 1 1 6 1973 1 1 10 LEU CA C 6.013 3.604 -5.195 1.00 . A A . 9 LEU CA 1 1 6 1974 1 1 10 LEU CB C 6.768 2.658 -4.264 1.00 . A A . 9 LEU CB 1 1 6 1975 1 1 10 LEU CD1 C 8.952 1.819 -3.382 1.00 . A A . 9 LEU CD1 1 1 6 1976 1 1 10 LEU CD2 C 8.585 1.963 -5.847 1.00 . A A . 9 LEU CD2 1 1 6 1977 1 1 10 LEU CG C 8.277 2.594 -4.497 1.00 . A A . 9 LEU CG 1 1 6 1978 1 1 10 LEU H H 6.163 5.527 -4.321 1.00 . A A . 9 LEU H 1 1 6 1979 1 1 10 LEU HA H 6.190 3.302 -6.213 1.00 . A A . 9 LEU HA 1 1 6 1980 1 1 10 LEU HB2 H 6.596 2.975 -3.247 1.00 . A A . 9 LEU HB2 1 1 6 1981 1 1 10 LEU HB3 H 6.362 1.665 -4.387 1.00 . A A . 9 LEU HB3 1 1 6 1982 1 1 10 LEU HD11 H 10.015 1.780 -3.563 1.00 . A A . 9 LEU HD11 1 1 6 1983 1 1 10 LEU HD12 H 8.553 0.815 -3.351 1.00 . A A . 9 LEU HD12 1 1 6 1984 1 1 10 LEU HD13 H 8.764 2.311 -2.439 1.00 . A A . 9 LEU HD13 1 1 6 1985 1 1 10 LEU HD21 H 8.158 0.973 -5.889 1.00 . A A . 9 LEU HD21 1 1 6 1986 1 1 10 LEU HD22 H 9.656 1.899 -5.979 1.00 . A A . 9 LEU HD22 1 1 6 1987 1 1 10 LEU HD23 H 8.163 2.572 -6.633 1.00 . A A . 9 LEU HD23 1 1 6 1988 1 1 10 LEU HG H 8.679 3.595 -4.498 1.00 . A A . 9 LEU HG 1 1 6 1989 1 1 10 LEU N N 6.513 4.965 -5.043 1.00 . A A . 9 LEU N 1 1 6 1990 1 1 10 LEU O O 3.963 2.456 -4.710 1.00 . A A . 9 LEU O 1 1 6 1991 1 1 11 LEU C C 1.675 3.708 -5.407 1.00 . A A . 10 LEU C 1 1 6 1992 1 1 11 LEU CA C 2.437 4.795 -4.655 1.00 . A A . 10 LEU CA 1 1 6 1993 1 1 11 LEU CB C 1.925 6.175 -5.074 1.00 . A A . 10 LEU CB 1 1 6 1994 1 1 11 LEU CD1 C 3.961 7.581 -4.607 1.00 . A A . 10 LEU CD1 1 1 6 1995 1 1 11 LEU CD2 C 1.685 8.614 -4.542 1.00 . A A . 10 LEU CD2 1 1 6 1996 1 1 11 LEU CG C 2.493 7.353 -4.276 1.00 . A A . 10 LEU CG 1 1 6 1997 1 1 11 LEU H H 4.384 5.516 -5.032 1.00 . A A . 10 LEU H 1 1 6 1998 1 1 11 LEU HA H 2.269 4.666 -3.597 1.00 . A A . 10 LEU HA 1 1 6 1999 1 1 11 LEU HB2 H 2.171 6.324 -6.116 1.00 . A A . 10 LEU HB2 1 1 6 2000 1 1 11 LEU HB3 H 0.851 6.183 -4.971 1.00 . A A . 10 LEU HB3 1 1 6 2001 1 1 11 LEU HD11 H 4.142 7.329 -5.642 1.00 . A A . 10 LEU HD11 1 1 6 2002 1 1 11 LEU HD12 H 4.577 6.957 -3.968 1.00 . A A . 10 LEU HD12 1 1 6 2003 1 1 11 LEU HD13 H 4.210 8.617 -4.440 1.00 . A A . 10 LEU HD13 1 1 6 2004 1 1 11 LEU HD21 H 2.097 9.432 -3.970 1.00 . A A . 10 LEU HD21 1 1 6 2005 1 1 11 LEU HD22 H 0.658 8.452 -4.251 1.00 . A A . 10 LEU HD22 1 1 6 2006 1 1 11 LEU HD23 H 1.729 8.854 -5.595 1.00 . A A . 10 LEU HD23 1 1 6 2007 1 1 11 LEU HG H 2.423 7.128 -3.223 1.00 . A A . 10 LEU HG 1 1 6 2008 1 1 11 LEU N N 3.874 4.697 -4.897 1.00 . A A . 10 LEU N 1 1 6 2009 1 1 11 LEU O O 1.160 2.767 -4.803 1.00 . A A . 10 LEU O 1 1 6 2010 1 1 12 SER C C 1.667 1.542 -7.562 1.00 . A A . 11 SER C 1 1 6 2011 1 1 12 SER CA C 0.915 2.869 -7.561 1.00 . A A . 11 SER CA 1 1 6 2012 1 1 12 SER CB C 0.775 3.394 -8.991 1.00 . A A . 11 SER CB 1 1 6 2013 1 1 12 SER H H 2.032 4.621 -7.148 1.00 . A A . 11 SER H 1 1 6 2014 1 1 12 SER HA H -0.069 2.713 -7.143 1.00 . A A . 11 SER HA 1 1 6 2015 1 1 12 SER HB2 H 0.209 4.314 -8.981 1.00 . A A . 11 SER HB2 1 1 6 2016 1 1 12 SER HB3 H 1.756 3.579 -9.402 1.00 . A A . 11 SER HB3 1 1 6 2017 1 1 12 SER HG H -0.617 2.056 -9.325 1.00 . A A . 11 SER HG 1 1 6 2018 1 1 12 SER N N 1.607 3.845 -6.727 1.00 . A A . 11 SER N 1 1 6 2019 1 1 12 SER O O 1.174 0.535 -8.071 1.00 . A A . 11 SER O 1 1 6 2020 1 1 12 SER OG O 0.104 2.456 -9.816 1.00 . A A . 11 SER OG 1 1 6 2021 1 1 13 ARG C C 3.605 -0.270 -5.527 1.00 . A A . 12 ARG C 1 1 6 2022 1 1 13 ARG CA C 3.700 0.367 -6.909 1.00 . A A . 12 ARG CA 1 1 6 2023 1 1 13 ARG CB C 5.153 0.733 -7.216 1.00 . A A . 12 ARG CB 1 1 6 2024 1 1 13 ARG CD C 6.777 1.834 -8.790 1.00 . A A . 12 ARG CD 1 1 6 2025 1 1 13 ARG CG C 5.348 1.353 -8.591 1.00 . A A . 12 ARG CG 1 1 6 2026 1 1 13 ARG CZ C 9.027 0.868 -9.035 1.00 . A A . 12 ARG CZ 1 1 6 2027 1 1 13 ARG H H 3.195 2.396 -6.604 1.00 . A A . 12 ARG H 1 1 6 2028 1 1 13 ARG HA H 3.347 -0.337 -7.644 1.00 . A A . 12 ARG HA 1 1 6 2029 1 1 13 ARG HB2 H 5.496 1.442 -6.475 1.00 . A A . 12 ARG HB2 1 1 6 2030 1 1 13 ARG HB3 H 5.759 -0.159 -7.156 1.00 . A A . 12 ARG HB3 1 1 6 2031 1 1 13 ARG HD2 H 6.850 2.318 -9.753 1.00 . A A . 12 ARG HD2 1 1 6 2032 1 1 13 ARG HD3 H 7.015 2.545 -8.011 1.00 . A A . 12 ARG HD3 1 1 6 2033 1 1 13 ARG HE H 7.404 -0.146 -8.467 1.00 . A A . 12 ARG HE 1 1 6 2034 1 1 13 ARG HG2 H 5.119 0.614 -9.344 1.00 . A A . 12 ARG HG2 1 1 6 2035 1 1 13 ARG HG3 H 4.678 2.194 -8.694 1.00 . A A . 12 ARG HG3 1 1 6 2036 1 1 13 ARG HH11 H 10.478 2.143 -9.630 1.00 . A A . 12 ARG HH11 1 1 6 2037 1 1 13 ARG HH12 H 8.901 2.840 -9.461 1.00 . A A . 12 ARG HH12 1 1 6 2038 1 1 13 ARG HH21 H 9.477 -1.071 -8.685 1.00 . A A . 12 ARG HH21 1 1 6 2039 1 1 13 ARG HH22 H 10.805 -0.080 -9.189 1.00 . A A . 12 ARG HH22 1 1 6 2040 1 1 13 ARG N N 2.864 1.557 -6.987 1.00 . A A . 12 ARG N 1 1 6 2041 1 1 13 ARG NE N 7.737 0.736 -8.737 1.00 . A A . 12 ARG NE 1 1 6 2042 1 1 13 ARG NH1 N 9.508 2.047 -9.405 1.00 . A A . 12 ARG NH1 1 1 6 2043 1 1 13 ARG NH2 N 9.835 -0.180 -8.964 1.00 . A A . 12 ARG NH2 1 1 6 2044 1 1 13 ARG O O 4.365 -1.178 -5.192 1.00 . A A . 12 ARG O 1 1 6 2045 1 1 14 VAL C C 0.962 -0.247 -3.030 1.00 . A A . 13 VAL C 1 1 6 2046 1 1 14 VAL CA C 2.443 -0.276 -3.384 1.00 . A A . 13 VAL CA 1 1 6 2047 1 1 14 VAL CB C 3.224 0.570 -2.358 1.00 . A A . 13 VAL CB 1 1 6 2048 1 1 14 VAL CG1 C 2.863 0.173 -0.938 1.00 . A A . 13 VAL CG1 1 1 6 2049 1 1 14 VAL CG2 C 4.719 0.438 -2.591 1.00 . A A . 13 VAL CG2 1 1 6 2050 1 1 14 VAL H H 2.081 0.926 -5.071 1.00 . A A . 13 VAL H 1 1 6 2051 1 1 14 VAL HA H 2.802 -1.294 -3.334 1.00 . A A . 13 VAL HA 1 1 6 2052 1 1 14 VAL HB H 2.949 1.605 -2.496 1.00 . A A . 13 VAL HB 1 1 6 2053 1 1 14 VAL HG11 H 3.396 0.808 -0.243 1.00 . A A . 13 VAL HG11 1 1 6 2054 1 1 14 VAL HG12 H 3.138 -0.857 -0.771 1.00 . A A . 13 VAL HG12 1 1 6 2055 1 1 14 VAL HG13 H 1.800 0.293 -0.792 1.00 . A A . 13 VAL HG13 1 1 6 2056 1 1 14 VAL HG21 H 5.250 1.055 -1.882 1.00 . A A . 13 VAL HG21 1 1 6 2057 1 1 14 VAL HG22 H 4.955 0.757 -3.595 1.00 . A A . 13 VAL HG22 1 1 6 2058 1 1 14 VAL HG23 H 5.013 -0.594 -2.462 1.00 . A A . 13 VAL HG23 1 1 6 2059 1 1 14 VAL N N 2.657 0.216 -4.735 1.00 . A A . 13 VAL N 1 1 6 2060 1 1 14 VAL O O 0.406 0.813 -2.745 1.00 . A A . 13 VAL O 1 1 6 2061 1 1 15 ASN C C -1.413 -0.779 -1.453 1.00 . A A . 14 ASN C 1 1 6 2062 1 1 15 ASN CA C -1.090 -1.527 -2.743 1.00 . A A . 14 ASN CA 1 1 6 2063 1 1 15 ASN CB C -1.492 -2.999 -2.618 1.00 . A A . 14 ASN CB 1 1 6 2064 1 1 15 ASN CG C -0.595 -3.770 -1.668 1.00 . A A . 14 ASN CG 1 1 6 2065 1 1 15 ASN H H 0.826 -2.217 -3.323 1.00 . A A . 14 ASN H 1 1 6 2066 1 1 15 ASN HA H -1.648 -1.080 -3.551 1.00 . A A . 14 ASN HA 1 1 6 2067 1 1 15 ASN HB2 H -2.506 -3.058 -2.251 1.00 . A A . 14 ASN HB2 1 1 6 2068 1 1 15 ASN HB3 H -1.439 -3.464 -3.591 1.00 . A A . 14 ASN HB3 1 1 6 2069 1 1 15 ASN HD21 H 0.660 -4.185 -3.154 1.00 . A A . 14 ASN HD21 1 1 6 2070 1 1 15 ASN HD22 H 1.096 -4.816 -1.605 1.00 . A A . 14 ASN HD22 1 1 6 2071 1 1 15 ASN N N 0.328 -1.414 -3.066 1.00 . A A . 14 ASN N 1 1 6 2072 1 1 15 ASN ND2 N 0.497 -4.312 -2.196 1.00 . A A . 14 ASN ND2 1 1 6 2073 1 1 15 ASN O O -1.170 -1.279 -0.353 1.00 . A A . 14 ASN O 1 1 6 2074 1 1 15 ASN OD1 O -0.879 -3.879 -0.475 1.00 . A A . 14 ASN OD1 1 1 6 2075 1 1 16 ARG C C -3.314 0.542 0.449 1.00 . A A . 15 ARG C 1 1 6 2076 1 1 16 ARG CA C -2.307 1.252 -0.451 1.00 . A A . 15 ARG CA 1 1 6 2077 1 1 16 ARG CB C -2.877 2.592 -0.919 1.00 . A A . 15 ARG CB 1 1 6 2078 1 1 16 ARG CD C -4.606 3.808 -2.280 1.00 . A A . 15 ARG CD 1 1 6 2079 1 1 16 ARG CG C -4.111 2.455 -1.796 1.00 . A A . 15 ARG CG 1 1 6 2080 1 1 16 ARG CZ C -3.840 5.630 -3.747 1.00 . A A . 15 ARG CZ 1 1 6 2081 1 1 16 ARG H H -2.124 0.766 -2.501 1.00 . A A . 15 ARG H 1 1 6 2082 1 1 16 ARG HA H -1.403 1.434 0.112 1.00 . A A . 15 ARG HA 1 1 6 2083 1 1 16 ARG HB2 H -3.141 3.180 -0.053 1.00 . A A . 15 ARG HB2 1 1 6 2084 1 1 16 ARG HB3 H -2.119 3.116 -1.481 1.00 . A A . 15 ARG HB3 1 1 6 2085 1 1 16 ARG HD2 H -5.496 3.661 -2.873 1.00 . A A . 15 ARG HD2 1 1 6 2086 1 1 16 ARG HD3 H -4.843 4.419 -1.420 1.00 . A A . 15 ARG HD3 1 1 6 2087 1 1 16 ARG HE H -2.712 4.099 -3.146 1.00 . A A . 15 ARG HE 1 1 6 2088 1 1 16 ARG HG2 H -3.866 1.845 -2.653 1.00 . A A . 15 ARG HG2 1 1 6 2089 1 1 16 ARG HG3 H -4.896 1.980 -1.225 1.00 . A A . 15 ARG HG3 1 1 6 2090 1 1 16 ARG HH11 H -5.768 5.775 -3.153 1.00 . A A . 15 ARG HH11 1 1 6 2091 1 1 16 ARG HH12 H -5.212 7.049 -4.187 1.00 . A A . 15 ARG HH12 1 1 6 2092 1 1 16 ARG HH21 H -1.973 5.771 -4.507 1.00 . A A . 15 ARG HH21 1 1 6 2093 1 1 16 ARG HH22 H -3.056 7.046 -4.956 1.00 . A A . 15 ARG HH22 1 1 6 2094 1 1 16 ARG N N -1.955 0.425 -1.598 1.00 . A A . 15 ARG N 1 1 6 2095 1 1 16 ARG NE N -3.606 4.499 -3.089 1.00 . A A . 15 ARG NE 1 1 6 2096 1 1 16 ARG NH1 N -5.039 6.197 -3.690 1.00 . A A . 15 ARG NH1 1 1 6 2097 1 1 16 ARG NH2 N -2.878 6.196 -4.462 1.00 . A A . 15 ARG NH2 1 1 6 2098 1 1 16 ARG O O -3.288 0.698 1.670 1.00 . A A . 15 ARG O 1 1 6 2099 1 1 17 HIS C C -4.783 -2.417 0.817 1.00 . A A . 16 HIS C 1 1 6 2100 1 1 17 HIS CA C -5.216 -0.974 0.581 1.00 . A A . 16 HIS CA 1 1 6 2101 1 1 17 HIS CB C -6.549 -0.942 -0.171 1.00 . A A . 16 HIS CB 1 1 6 2102 1 1 17 HIS CD2 C -6.537 -2.678 -2.098 1.00 . A A . 16 HIS CD2 1 1 6 2103 1 1 17 HIS CE1 C -6.209 -1.297 -3.770 1.00 . A A . 16 HIS CE1 1 1 6 2104 1 1 17 HIS CG C -6.453 -1.429 -1.584 1.00 . A A . 16 HIS CG 1 1 6 2105 1 1 17 HIS H H -4.167 -0.322 -1.139 1.00 . A A . 16 HIS H 1 1 6 2106 1 1 17 HIS HA H -5.341 -0.488 1.536 1.00 . A A . 16 HIS HA 1 1 6 2107 1 1 17 HIS HB2 H -7.260 -1.566 0.348 1.00 . A A . 16 HIS HB2 1 1 6 2108 1 1 17 HIS HB3 H -6.916 0.073 -0.194 1.00 . A A . 16 HIS HB3 1 1 6 2109 1 1 17 HIS HD1 H -6.143 0.387 -2.609 1.00 . A A . 16 HIS HD1 1 1 6 2110 1 1 17 HIS HD2 H -6.697 -3.591 -1.543 1.00 . A A . 16 HIS HD2 1 1 6 2111 1 1 17 HIS HE1 H -6.060 -0.905 -4.765 1.00 . A A . 16 HIS HE1 1 1 6 2112 1 1 17 HIS HE2 H -6.397 -3.311 -4.097 1.00 . A A . 16 HIS HE2 1 1 6 2113 1 1 17 HIS N N -4.199 -0.239 -0.163 1.00 . A A . 16 HIS N 1 1 6 2114 1 1 17 HIS ND1 N -6.246 -0.587 -2.657 1.00 . A A . 16 HIS ND1 1 1 6 2115 1 1 17 HIS NE2 N -6.382 -2.568 -3.458 1.00 . A A . 16 HIS NE2 1 1 6 2116 1 1 17 HIS O O -3.728 -2.843 0.345 1.00 . A A . 16 HIS O 1 1 6 2117 1 1 18 SER C C -4.015 -4.693 2.639 1.00 . A A . 17 SER C 1 1 6 2118 1 1 18 SER CA C -5.318 -4.561 1.856 1.00 . A A . 17 SER CA 1 1 6 2119 1 1 18 SER CB C -5.243 -5.389 0.570 1.00 . A A . 17 SER CB 1 1 6 2120 1 1 18 SER H H -6.432 -2.761 1.894 1.00 . A A . 17 SER H 1 1 6 2121 1 1 18 SER HA H -6.126 -4.937 2.466 1.00 . A A . 17 SER HA 1 1 6 2122 1 1 18 SER HB2 H -4.468 -4.988 -0.068 1.00 . A A . 17 SER HB2 1 1 6 2123 1 1 18 SER HB3 H -5.010 -6.414 0.818 1.00 . A A . 17 SER HB3 1 1 6 2124 1 1 18 SER HG H -6.323 -5.581 -1.052 1.00 . A A . 17 SER HG 1 1 6 2125 1 1 18 SER N N -5.607 -3.163 1.549 1.00 . A A . 17 SER N 1 1 6 2126 1 1 18 SER O O -2.926 -4.633 2.068 1.00 . A A . 17 SER O 1 1 6 2127 1 1 18 SER OG O -6.473 -5.357 -0.131 1.00 . A A . 17 SER OG 1 1 6 2128 1 1 19 THR C C -2.219 -6.307 4.523 1.00 . A A . 18 THR C 1 1 6 2129 1 1 19 THR CA C -2.969 -5.012 4.814 1.00 . A A . 18 THR CA 1 1 6 2130 1 1 19 THR CB C -3.365 -4.984 6.298 1.00 . A A . 18 THR CB 1 1 6 2131 1 1 19 THR CG2 C -3.934 -3.628 6.686 1.00 . A A . 18 THR CG2 1 1 6 2132 1 1 19 THR H H -5.031 -4.911 4.347 1.00 . A A . 18 THR H 1 1 6 2133 1 1 19 THR HA H -2.317 -4.182 4.625 1.00 . A A . 18 THR HA 1 1 6 2134 1 1 19 THR HB H -2.486 -5.178 6.897 1.00 . A A . 18 THR HB 1 1 6 2135 1 1 19 THR HG1 H -4.552 -6.420 5.707 1.00 . A A . 18 THR HG1 1 1 6 2136 1 1 19 THR HG21 H -3.189 -2.863 6.517 1.00 . A A . 18 THR HG21 1 1 6 2137 1 1 19 THR HG22 H -4.209 -3.638 7.731 1.00 . A A . 18 THR HG22 1 1 6 2138 1 1 19 THR HG23 H -4.807 -3.418 6.087 1.00 . A A . 18 THR HG23 1 1 6 2139 1 1 19 THR N N -4.136 -4.872 3.951 1.00 . A A . 18 THR N 1 1 6 2140 1 1 19 THR O O -0.994 -6.312 4.402 1.00 . A A . 18 THR O 1 1 6 2141 1 1 19 THR OG1 O -4.332 -6.001 6.542 1.00 . A A . 18 THR OG1 1 1 6 2142 1 1 20 ALA C C -1.352 -9.092 5.203 1.00 . A A . 19 ALA C 1 1 6 2143 1 1 20 ALA CA C -2.376 -8.712 4.140 1.00 . A A . 19 ALA CA 1 1 6 2144 1 1 20 ALA CB C -1.736 -8.721 2.758 1.00 . A A . 19 ALA CB 1 1 6 2145 1 1 20 ALA H H -3.936 -7.334 4.527 1.00 . A A . 19 ALA H 1 1 6 2146 1 1 20 ALA HA H -3.173 -9.441 4.146 1.00 . A A . 19 ALA HA 1 1 6 2147 1 1 20 ALA HB1 H -1.356 -9.709 2.545 1.00 . A A . 19 ALA HB1 1 1 6 2148 1 1 20 ALA HB2 H -0.926 -8.009 2.732 1.00 . A A . 19 ALA HB2 1 1 6 2149 1 1 20 ALA HB3 H -2.476 -8.452 2.018 1.00 . A A . 19 ALA HB3 1 1 6 2150 1 1 20 ALA N N -2.965 -7.405 4.417 1.00 . A A . 19 ALA N 1 1 6 2151 1 1 20 ALA O O -0.483 -9.933 4.970 1.00 . A A . 19 ALA O 1 1 6 2152 1 1 21 ILE C C -1.040 -9.916 8.319 1.00 . A A . 20 ILE C 1 1 6 2153 1 1 21 ILE CA C -0.548 -8.746 7.475 1.00 . A A . 20 ILE CA 1 1 6 2154 1 1 21 ILE CB C -0.371 -7.510 8.379 1.00 . A A . 20 ILE CB 1 1 6 2155 1 1 21 ILE CD1 C 0.168 -5.019 8.339 1.00 . A A . 20 ILE CD1 1 1 6 2156 1 1 21 ILE CG1 C 0.098 -6.311 7.552 1.00 . A A . 20 ILE CG1 1 1 6 2157 1 1 21 ILE CG2 C 0.616 -7.810 9.499 1.00 . A A . 20 ILE CG2 1 1 6 2158 1 1 21 ILE H H -2.181 -7.817 6.499 1.00 . A A . 20 ILE H 1 1 6 2159 1 1 21 ILE HA H 0.415 -8.999 7.053 1.00 . A A . 20 ILE HA 1 1 6 2160 1 1 21 ILE HB H -1.325 -7.279 8.826 1.00 . A A . 20 ILE HB 1 1 6 2161 1 1 21 ILE HD11 H 0.501 -4.221 7.692 1.00 . A A . 20 ILE HD11 1 1 6 2162 1 1 21 ILE HD12 H 0.863 -5.132 9.158 1.00 . A A . 20 ILE HD12 1 1 6 2163 1 1 21 ILE HD13 H -0.811 -4.782 8.728 1.00 . A A . 20 ILE HD13 1 1 6 2164 1 1 21 ILE HG12 H 1.086 -6.514 7.164 1.00 . A A . 20 ILE HG12 1 1 6 2165 1 1 21 ILE HG13 H -0.584 -6.160 6.729 1.00 . A A . 20 ILE HG13 1 1 6 2166 1 1 21 ILE HG21 H 0.245 -8.629 10.097 1.00 . A A . 20 ILE HG21 1 1 6 2167 1 1 21 ILE HG22 H 0.733 -6.935 10.121 1.00 . A A . 20 ILE HG22 1 1 6 2168 1 1 21 ILE HG23 H 1.572 -8.079 9.074 1.00 . A A . 20 ILE HG23 1 1 6 2169 1 1 21 ILE N N -1.464 -8.473 6.373 1.00 . A A . 20 ILE N 1 1 6 2170 1 1 21 ILE O O -2.083 -9.830 8.970 1.00 . A A . 20 ILE O 1 1 6 2171 1 1 22 GLY C C 0.512 -13.110 9.324 1.00 . A A . 21 GLY C 1 1 6 2172 1 1 22 GLY CA C -0.661 -12.184 9.071 1.00 . A A . 21 GLY CA 1 1 6 2173 1 1 22 GLY H H 0.533 -11.021 7.765 1.00 . A A . 21 GLY H 1 1 6 2174 1 1 22 GLY HA2 H -1.065 -11.864 10.020 1.00 . A A . 21 GLY HA2 1 1 6 2175 1 1 22 GLY HA3 H -1.423 -12.725 8.531 1.00 . A A . 21 GLY HA3 1 1 6 2176 1 1 22 GLY N N -0.285 -11.011 8.303 1.00 . A A . 21 GLY N 1 1 6 2177 1 1 22 GLY O O 0.789 -14.005 8.525 1.00 . A A . 21 GLY O 1 1 6 2178 1 1 23 ARG C C 1.910 -15.115 11.223 1.00 . A A . 22 ARG C 1 1 6 2179 1 1 23 ARG CA C 2.352 -13.719 10.797 1.00 . A A . 22 ARG CA 1 1 6 2180 1 1 23 ARG CB C 3.151 -13.056 11.921 1.00 . A A . 22 ARG CB 1 1 6 2181 1 1 23 ARG CD C 5.163 -13.120 13.427 1.00 . A A . 22 ARG CD 1 1 6 2182 1 1 23 ARG CG C 4.411 -13.817 12.305 1.00 . A A . 22 ARG CG 1 1 6 2183 1 1 23 ARG CZ C 4.805 -12.484 15.777 1.00 . A A . 22 ARG CZ 1 1 6 2184 1 1 23 ARG H H 0.932 -12.168 11.037 1.00 . A A . 22 ARG H 1 1 6 2185 1 1 23 ARG HA H 2.982 -13.805 9.923 1.00 . A A . 22 ARG HA 1 1 6 2186 1 1 23 ARG HB2 H 3.439 -12.063 11.606 1.00 . A A . 22 ARG HB2 1 1 6 2187 1 1 23 ARG HB3 H 2.522 -12.977 12.796 1.00 . A A . 22 ARG HB3 1 1 6 2188 1 1 23 ARG HD2 H 6.054 -13.687 13.651 1.00 . A A . 22 ARG HD2 1 1 6 2189 1 1 23 ARG HD3 H 5.441 -12.131 13.096 1.00 . A A . 22 ARG HD3 1 1 6 2190 1 1 23 ARG HE H 3.433 -13.334 14.603 1.00 . A A . 22 ARG HE 1 1 6 2191 1 1 23 ARG HG2 H 4.134 -14.808 12.631 1.00 . A A . 22 ARG HG2 1 1 6 2192 1 1 23 ARG HG3 H 5.055 -13.885 11.441 1.00 . A A . 22 ARG HG3 1 1 6 2193 1 1 23 ARG HH11 H 6.652 -12.080 15.063 1.00 . A A . 22 ARG HH11 1 1 6 2194 1 1 23 ARG HH12 H 6.383 -11.638 16.715 1.00 . A A . 22 ARG HH12 1 1 6 2195 1 1 23 ARG HH21 H 4.347 -12.022 17.690 1.00 . A A . 22 ARG HH21 1 1 6 2196 1 1 23 ARG HH22 H 3.070 -12.756 16.778 1.00 . A A . 22 ARG HH22 1 1 6 2197 1 1 23 ARG N N 1.203 -12.896 10.439 1.00 . A A . 22 ARG N 1 1 6 2198 1 1 23 ARG NE N 4.356 -13.005 14.638 1.00 . A A . 22 ARG NE 1 1 6 2199 1 1 23 ARG NH1 N 6.049 -12.030 15.858 1.00 . A A . 22 ARG NH1 1 1 6 2200 1 1 23 ARG NH2 N 4.009 -12.414 16.834 1.00 . A A . 22 ARG NH2 1 1 6 2201 1 1 23 ARG O O 1.867 -16.011 10.355 1.00 . A A . 22 ARG O 1 1 6 2202 1 1 23 ARG OXT O 1.611 -15.300 12.421 1.00 . A A . 22 ARG OXT 1 1 7 2203 1 1 1 ACE C C 7.123 -1.651 9.614 1.00 . A A . 0 ACE C 1 1 7 2204 1 1 1 ACE CH3 C 7.820 -2.560 10.588 1.00 . A A . 0 ACE CH3 1 1 7 2205 1 1 1 ACE H1 H 7.736 -2.134 11.583 1.00 . A A . 0 ACE H1 1 1 7 2206 1 1 1 ACE H2 H 8.857 -2.644 10.321 1.00 . A A . 0 ACE H2 1 1 7 2207 1 1 1 ACE H3 H 7.356 -3.540 10.542 1.00 . A A . 0 ACE H3 1 1 7 2208 1 1 1 ACE O O 5.978 -1.892 9.233 1.00 . A A . 0 ACE O 1 1 7 2209 1 1 2 MET C C 7.594 -0.018 6.821 1.00 . A A . 1 MET C 1 1 7 2210 1 1 2 MET CA C 7.256 0.367 8.257 1.00 . A A . 1 MET CA 1 1 7 2211 1 1 2 MET CB C 7.780 1.775 8.552 1.00 . A A . 1 MET CB 1 1 7 2212 1 1 2 MET CE C 7.173 2.441 12.630 1.00 . A A . 1 MET CE 1 1 7 2213 1 1 2 MET CG C 7.277 2.360 9.862 1.00 . A A . 1 MET CG 1 1 7 2214 1 1 2 MET H H 8.724 -0.455 9.540 1.00 . A A . 1 MET H 1 1 7 2215 1 1 2 MET HA H 6.182 0.361 8.376 1.00 . A A . 1 MET HA 1 1 7 2216 1 1 2 MET HB2 H 8.860 1.743 8.588 1.00 . A A . 1 MET HB2 1 1 7 2217 1 1 2 MET HB3 H 7.477 2.433 7.751 1.00 . A A . 1 MET HB3 1 1 7 2218 1 1 2 MET HE1 H 7.501 3.468 12.565 1.00 . A A . 1 MET HE1 1 1 7 2219 1 1 2 MET HE2 H 7.471 2.027 13.582 1.00 . A A . 1 MET HE2 1 1 7 2220 1 1 2 MET HE3 H 6.097 2.401 12.541 1.00 . A A . 1 MET HE3 1 1 7 2221 1 1 2 MET HG2 H 7.583 3.395 9.918 1.00 . A A . 1 MET HG2 1 1 7 2222 1 1 2 MET HG3 H 6.199 2.303 9.875 1.00 . A A . 1 MET HG3 1 1 7 2223 1 1 2 MET N N 7.815 -0.594 9.202 1.00 . A A . 1 MET N 1 1 7 2224 1 1 2 MET O O 8.738 0.117 6.387 1.00 . A A . 1 MET O 1 1 7 2225 1 1 2 MET SD S 7.917 1.491 11.307 1.00 . A A . 1 MET SD 1 1 7 2226 1 1 3 ASN C C 6.000 0.005 3.765 1.00 . A A . 2 ASN C 1 1 7 2227 1 1 3 ASN CA C 6.792 -0.902 4.702 1.00 . A A . 2 ASN CA 1 1 7 2228 1 1 3 ASN CB C 6.372 -2.359 4.496 1.00 . A A . 2 ASN CB 1 1 7 2229 1 1 3 ASN CG C 7.071 -3.011 3.313 1.00 . A A . 2 ASN CG 1 1 7 2230 1 1 3 ASN H H 5.706 -0.593 6.493 1.00 . A A . 2 ASN H 1 1 7 2231 1 1 3 ASN HA H 7.843 -0.803 4.475 1.00 . A A . 2 ASN HA 1 1 7 2232 1 1 3 ASN HB2 H 6.611 -2.923 5.386 1.00 . A A . 2 ASN HB2 1 1 7 2233 1 1 3 ASN HB3 H 5.307 -2.399 4.326 1.00 . A A . 2 ASN HB3 1 1 7 2234 1 1 3 ASN HD21 H 7.932 -2.609 1.563 1.00 . A A . 2 ASN HD21 1 1 7 2235 1 1 3 ASN HD22 H 7.315 -1.245 2.422 1.00 . A A . 2 ASN HD22 1 1 7 2236 1 1 3 ASN N N 6.594 -0.502 6.091 1.00 . A A . 2 ASN N 1 1 7 2237 1 1 3 ASN ND2 N 7.481 -2.207 2.334 1.00 . A A . 2 ASN ND2 1 1 7 2238 1 1 3 ASN O O 5.700 -0.366 2.629 1.00 . A A . 2 ASN O 1 1 7 2239 1 1 3 ASN OD1 O 7.248 -4.229 3.282 1.00 . A A . 2 ASN OD1 1 1 7 2240 1 1 4 TRP C C 5.808 2.764 2.391 1.00 . A A . 3 TRP C 1 1 7 2241 1 1 4 TRP CA C 4.910 2.143 3.431 1.00 . A A . 3 TRP CA 1 1 7 2242 1 1 4 TRP CB C 4.312 3.254 4.275 1.00 . A A . 3 TRP CB 1 1 7 2243 1 1 4 TRP CD1 C 5.771 3.835 6.276 1.00 . A A . 3 TRP CD1 1 1 7 2244 1 1 4 TRP CD2 C 6.032 5.207 4.539 1.00 . A A . 3 TRP CD2 1 1 7 2245 1 1 4 TRP CE2 C 6.860 5.651 5.581 1.00 . A A . 3 TRP CE2 1 1 7 2246 1 1 4 TRP CE3 C 6.035 5.910 3.338 1.00 . A A . 3 TRP CE3 1 1 7 2247 1 1 4 TRP CG C 5.329 4.058 5.016 1.00 . A A . 3 TRP CG 1 1 7 2248 1 1 4 TRP CH2 C 7.657 7.439 4.264 1.00 . A A . 3 TRP CH2 1 1 7 2249 1 1 4 TRP CZ2 C 7.675 6.768 5.454 1.00 . A A . 3 TRP CZ2 1 1 7 2250 1 1 4 TRP CZ3 C 6.848 7.016 3.209 1.00 . A A . 3 TRP CZ3 1 1 7 2251 1 1 4 TRP H H 5.904 1.435 5.162 1.00 . A A . 3 TRP H 1 1 7 2252 1 1 4 TRP HA H 4.117 1.613 2.936 1.00 . A A . 3 TRP HA 1 1 7 2253 1 1 4 TRP HB2 H 3.773 3.928 3.625 1.00 . A A . 3 TRP HB2 1 1 7 2254 1 1 4 TRP HB3 H 3.629 2.828 4.995 1.00 . A A . 3 TRP HB3 1 1 7 2255 1 1 4 TRP HD1 H 5.435 3.023 6.890 1.00 . A A . 3 TRP HD1 1 1 7 2256 1 1 4 TRP HE1 H 7.131 4.861 7.505 1.00 . A A . 3 TRP HE1 1 1 7 2257 1 1 4 TRP HE3 H 5.423 5.596 2.513 1.00 . A A . 3 TRP HE3 1 1 7 2258 1 1 4 TRP HH2 H 8.279 8.309 4.124 1.00 . A A . 3 TRP HH2 1 1 7 2259 1 1 4 TRP HZ2 H 8.295 7.108 6.256 1.00 . A A . 3 TRP HZ2 1 1 7 2260 1 1 4 TRP HZ3 H 6.861 7.569 2.283 1.00 . A A . 3 TRP HZ3 1 1 7 2261 1 1 4 TRP N N 5.654 1.194 4.246 1.00 . A A . 3 TRP N 1 1 7 2262 1 1 4 TRP NE1 N 6.681 4.798 6.638 1.00 . A A . 3 TRP NE1 1 1 7 2263 1 1 4 TRP O O 5.338 3.495 1.524 1.00 . A A . 3 TRP O 1 1 7 2264 1 1 5 THR C C 7.617 2.776 0.132 1.00 . A A . 4 THR C 1 1 7 2265 1 1 5 THR CA C 8.068 3.029 1.568 1.00 . A A . 4 THR CA 1 1 7 2266 1 1 5 THR CB C 9.468 2.420 1.785 1.00 . A A . 4 THR CB 1 1 7 2267 1 1 5 THR CG2 C 10.482 3.023 0.825 1.00 . A A . 4 THR CG2 1 1 7 2268 1 1 5 THR H H 7.408 1.903 3.225 1.00 . A A . 4 THR H 1 1 7 2269 1 1 5 THR HA H 8.124 4.094 1.748 1.00 . A A . 4 THR HA 1 1 7 2270 1 1 5 THR HB H 9.412 1.355 1.606 1.00 . A A . 4 THR HB 1 1 7 2271 1 1 5 THR HG1 H 9.546 3.487 3.442 1.00 . A A . 4 THR HG1 1 1 7 2272 1 1 5 THR HG21 H 11.432 2.522 0.943 1.00 . A A . 4 THR HG21 1 1 7 2273 1 1 5 THR HG22 H 10.602 4.074 1.043 1.00 . A A . 4 THR HG22 1 1 7 2274 1 1 5 THR HG23 H 10.135 2.902 -0.190 1.00 . A A . 4 THR HG23 1 1 7 2275 1 1 5 THR N N 7.101 2.487 2.500 1.00 . A A . 4 THR N 1 1 7 2276 1 1 5 THR O O 8.041 1.812 -0.506 1.00 . A A . 4 THR O 1 1 7 2277 1 1 5 THR OG1 O 9.893 2.645 3.134 1.00 . A A . 4 THR OG1 1 1 7 2278 1 1 6 GLY C C 4.871 4.177 -1.890 1.00 . A A . 5 GLY C 1 1 7 2279 1 1 6 GLY CA C 6.221 3.497 -1.703 1.00 . A A . 5 GLY CA 1 1 7 2280 1 1 6 GLY H H 6.451 4.396 0.194 1.00 . A A . 5 GLY H 1 1 7 2281 1 1 6 GLY HA2 H 6.927 3.923 -2.400 1.00 . A A . 5 GLY HA2 1 1 7 2282 1 1 6 GLY HA3 H 6.112 2.442 -1.916 1.00 . A A . 5 GLY HA3 1 1 7 2283 1 1 6 GLY N N 6.742 3.645 -0.361 1.00 . A A . 5 GLY N 1 1 7 2284 1 1 6 GLY O O 4.092 3.780 -2.753 1.00 . A A . 5 GLY O 1 1 7 2285 1 1 7 LEU C C 3.590 7.376 -1.571 1.00 . A A . 6 LEU C 1 1 7 2286 1 1 7 LEU CA C 3.327 5.934 -1.161 1.00 . A A . 6 LEU CA 1 1 7 2287 1 1 7 LEU CB C 2.595 5.922 0.183 1.00 . A A . 6 LEU CB 1 1 7 2288 1 1 7 LEU CD1 C 3.901 7.710 1.409 1.00 . A A . 6 LEU CD1 1 1 7 2289 1 1 7 LEU CD2 C 2.740 5.926 2.698 1.00 . A A . 6 LEU CD2 1 1 7 2290 1 1 7 LEU CG C 3.465 6.250 1.403 1.00 . A A . 6 LEU CG 1 1 7 2291 1 1 7 LEU H H 5.225 5.423 -0.365 1.00 . A A . 6 LEU H 1 1 7 2292 1 1 7 LEU HA H 2.712 5.461 -1.908 1.00 . A A . 6 LEU HA 1 1 7 2293 1 1 7 LEU HB2 H 1.795 6.644 0.133 1.00 . A A . 6 LEU HB2 1 1 7 2294 1 1 7 LEU HB3 H 2.166 4.943 0.325 1.00 . A A . 6 LEU HB3 1 1 7 2295 1 1 7 LEU HD11 H 3.029 8.346 1.410 1.00 . A A . 6 LEU HD11 1 1 7 2296 1 1 7 LEU HD12 H 4.496 7.912 0.531 1.00 . A A . 6 LEU HD12 1 1 7 2297 1 1 7 LEU HD13 H 4.491 7.904 2.296 1.00 . A A . 6 LEU HD13 1 1 7 2298 1 1 7 LEU HD21 H 1.882 6.572 2.802 1.00 . A A . 6 LEU HD21 1 1 7 2299 1 1 7 LEU HD22 H 3.415 6.081 3.534 1.00 . A A . 6 LEU HD22 1 1 7 2300 1 1 7 LEU HD23 H 2.418 4.895 2.682 1.00 . A A . 6 LEU HD23 1 1 7 2301 1 1 7 LEU HG H 4.354 5.643 1.363 1.00 . A A . 6 LEU HG 1 1 7 2302 1 1 7 LEU N N 4.585 5.186 -1.066 1.00 . A A . 6 LEU N 1 1 7 2303 1 1 7 LEU O O 2.714 8.234 -1.466 1.00 . A A . 6 LEU O 1 1 7 2304 1 1 8 TYR C C 5.969 8.982 -3.763 1.00 . A A . 7 TYR C 1 1 7 2305 1 1 8 TYR CA C 5.204 8.968 -2.436 1.00 . A A . 7 TYR CA 1 1 7 2306 1 1 8 TYR CB C 6.068 9.575 -1.331 1.00 . A A . 7 TYR CB 1 1 7 2307 1 1 8 TYR CD1 C 6.892 7.399 -0.395 1.00 . A A . 7 TYR CD1 1 1 7 2308 1 1 8 TYR CD2 C 8.514 9.030 -1.009 1.00 . A A . 7 TYR CD2 1 1 7 2309 1 1 8 TYR CE1 C 7.883 6.539 -0.025 1.00 . A A . 7 TYR CE1 1 1 7 2310 1 1 8 TYR CE2 C 9.525 8.167 -0.630 1.00 . A A . 7 TYR CE2 1 1 7 2311 1 1 8 TYR CG C 7.181 8.658 -0.894 1.00 . A A . 7 TYR CG 1 1 7 2312 1 1 8 TYR CZ C 9.204 6.919 -0.139 1.00 . A A . 7 TYR CZ 1 1 7 2313 1 1 8 TYR H H 5.435 6.896 -2.116 1.00 . A A . 7 TYR H 1 1 7 2314 1 1 8 TYR HA H 4.317 9.556 -2.537 1.00 . A A . 7 TYR HA 1 1 7 2315 1 1 8 TYR HB2 H 6.509 10.494 -1.685 1.00 . A A . 7 TYR HB2 1 1 7 2316 1 1 8 TYR HB3 H 5.449 9.777 -0.472 1.00 . A A . 7 TYR HB3 1 1 7 2317 1 1 8 TYR HD1 H 5.859 7.094 -0.291 1.00 . A A . 7 TYR HD1 1 1 7 2318 1 1 8 TYR HD2 H 8.756 10.009 -1.395 1.00 . A A . 7 TYR HD2 1 1 7 2319 1 1 8 TYR HE1 H 7.615 5.571 0.344 1.00 . A A . 7 TYR HE1 1 1 7 2320 1 1 8 TYR HE2 H 10.557 8.472 -0.721 1.00 . A A . 7 TYR HE2 1 1 7 2321 1 1 8 TYR HH H 10.856 6.522 0.757 1.00 . A A . 7 TYR HH 1 1 7 2322 1 1 8 TYR N N 4.798 7.627 -2.043 1.00 . A A . 7 TYR N 1 1 7 2323 1 1 8 TYR O O 5.618 9.730 -4.676 1.00 . A A . 7 TYR O 1 1 7 2324 1 1 8 TYR OH O 10.203 6.052 0.235 1.00 . A A . 7 TYR OH 1 1 7 2325 1 1 9 THR C C 7.572 6.863 -5.911 1.00 . A A . 8 THR C 1 1 7 2326 1 1 9 THR CA C 7.828 8.113 -5.081 1.00 . A A . 8 THR CA 1 1 7 2327 1 1 9 THR CB C 9.329 8.190 -4.750 1.00 . A A . 8 THR CB 1 1 7 2328 1 1 9 THR CG2 C 9.703 9.577 -4.247 1.00 . A A . 8 THR CG2 1 1 7 2329 1 1 9 THR H H 7.236 7.569 -3.117 1.00 . A A . 8 THR H 1 1 7 2330 1 1 9 THR HA H 7.571 8.971 -5.673 1.00 . A A . 8 THR HA 1 1 7 2331 1 1 9 THR HB H 9.891 7.987 -5.650 1.00 . A A . 8 THR HB 1 1 7 2332 1 1 9 THR HG1 H 9.128 6.423 -3.890 1.00 . A A . 8 THR HG1 1 1 7 2333 1 1 9 THR HG21 H 9.083 9.833 -3.401 1.00 . A A . 8 THR HG21 1 1 7 2334 1 1 9 THR HG22 H 9.550 10.299 -5.036 1.00 . A A . 8 THR HG22 1 1 7 2335 1 1 9 THR HG23 H 10.741 9.584 -3.949 1.00 . A A . 8 THR HG23 1 1 7 2336 1 1 9 THR N N 7.012 8.158 -3.867 1.00 . A A . 8 THR N 1 1 7 2337 1 1 9 THR O O 8.114 6.715 -7.008 1.00 . A A . 8 THR O 1 1 7 2338 1 1 9 THR OG1 O 9.664 7.209 -3.759 1.00 . A A . 8 THR OG1 1 1 7 2339 1 1 10 LEU C C 4.924 4.593 -6.261 1.00 . A A . 9 LEU C 1 1 7 2340 1 1 10 LEU CA C 6.424 4.732 -6.093 1.00 . A A . 9 LEU CA 1 1 7 2341 1 1 10 LEU CB C 6.982 3.517 -5.347 1.00 . A A . 9 LEU CB 1 1 7 2342 1 1 10 LEU CD1 C 8.781 3.083 -7.051 1.00 . A A . 9 LEU CD1 1 1 7 2343 1 1 10 LEU CD2 C 9.338 4.303 -4.937 1.00 . A A . 9 LEU CD2 1 1 7 2344 1 1 10 LEU CG C 8.472 3.223 -5.566 1.00 . A A . 9 LEU CG 1 1 7 2345 1 1 10 LEU H H 6.347 6.152 -4.519 1.00 . A A . 9 LEU H 1 1 7 2346 1 1 10 LEU HA H 6.869 4.783 -7.063 1.00 . A A . 9 LEU HA 1 1 7 2347 1 1 10 LEU HB2 H 6.822 3.668 -4.290 1.00 . A A . 9 LEU HB2 1 1 7 2348 1 1 10 LEU HB3 H 6.420 2.650 -5.656 1.00 . A A . 9 LEU HB3 1 1 7 2349 1 1 10 LEU HD11 H 9.830 2.862 -7.181 1.00 . A A . 9 LEU HD11 1 1 7 2350 1 1 10 LEU HD12 H 8.542 4.007 -7.557 1.00 . A A . 9 LEU HD12 1 1 7 2351 1 1 10 LEU HD13 H 8.189 2.281 -7.467 1.00 . A A . 9 LEU HD13 1 1 7 2352 1 1 10 LEU HD21 H 10.372 3.991 -4.954 1.00 . A A . 9 LEU HD21 1 1 7 2353 1 1 10 LEU HD22 H 9.027 4.465 -3.915 1.00 . A A . 9 LEU HD22 1 1 7 2354 1 1 10 LEU HD23 H 9.230 5.221 -5.495 1.00 . A A . 9 LEU HD23 1 1 7 2355 1 1 10 LEU HG H 8.717 2.286 -5.090 1.00 . A A . 9 LEU HG 1 1 7 2356 1 1 10 LEU N N 6.750 5.971 -5.391 1.00 . A A . 9 LEU N 1 1 7 2357 1 1 10 LEU O O 4.425 4.357 -7.361 1.00 . A A . 9 LEU O 1 1 7 2358 1 1 11 LEU C C 2.270 3.266 -5.441 1.00 . A A . 10 LEU C 1 1 7 2359 1 1 11 LEU CA C 2.768 4.670 -5.111 1.00 . A A . 10 LEU CA 1 1 7 2360 1 1 11 LEU CB C 2.162 5.705 -6.056 1.00 . A A . 10 LEU CB 1 1 7 2361 1 1 11 LEU CD1 C 2.063 8.104 -6.790 1.00 . A A . 10 LEU CD1 1 1 7 2362 1 1 11 LEU CD2 C 3.171 7.508 -4.620 1.00 . A A . 10 LEU CD2 1 1 7 2363 1 1 11 LEU CG C 2.881 7.058 -6.047 1.00 . A A . 10 LEU CG 1 1 7 2364 1 1 11 LEU H H 4.713 4.958 -4.335 1.00 . A A . 10 LEU H 1 1 7 2365 1 1 11 LEU HA H 2.462 4.908 -4.104 1.00 . A A . 10 LEU HA 1 1 7 2366 1 1 11 LEU HB2 H 2.191 5.308 -7.060 1.00 . A A . 10 LEU HB2 1 1 7 2367 1 1 11 LEU HB3 H 1.131 5.864 -5.775 1.00 . A A . 10 LEU HB3 1 1 7 2368 1 1 11 LEU HD11 H 1.103 8.218 -6.310 1.00 . A A . 10 LEU HD11 1 1 7 2369 1 1 11 LEU HD12 H 1.921 7.790 -7.813 1.00 . A A . 10 LEU HD12 1 1 7 2370 1 1 11 LEU HD13 H 2.588 9.049 -6.773 1.00 . A A . 10 LEU HD13 1 1 7 2371 1 1 11 LEU HD21 H 3.575 8.510 -4.631 1.00 . A A . 10 LEU HD21 1 1 7 2372 1 1 11 LEU HD22 H 3.893 6.837 -4.164 1.00 . A A . 10 LEU HD22 1 1 7 2373 1 1 11 LEU HD23 H 2.258 7.494 -4.044 1.00 . A A . 10 LEU HD23 1 1 7 2374 1 1 11 LEU HG H 3.828 6.952 -6.556 1.00 . A A . 10 LEU HG 1 1 7 2375 1 1 11 LEU N N 4.227 4.756 -5.154 1.00 . A A . 10 LEU N 1 1 7 2376 1 1 11 LEU O O 1.738 2.572 -4.575 1.00 . A A . 10 LEU O 1 1 7 2377 1 1 12 SER C C 2.722 0.439 -6.316 1.00 . A A . 11 SER C 1 1 7 2378 1 1 12 SER CA C 2.007 1.524 -7.120 1.00 . A A . 11 SER CA 1 1 7 2379 1 1 12 SER CB C 2.280 1.333 -8.613 1.00 . A A . 11 SER CB 1 1 7 2380 1 1 12 SER H H 2.842 3.456 -7.345 1.00 . A A . 11 SER H 1 1 7 2381 1 1 12 SER HA H 0.944 1.445 -6.944 1.00 . A A . 11 SER HA 1 1 7 2382 1 1 12 SER HB2 H 1.958 0.346 -8.912 1.00 . A A . 11 SER HB2 1 1 7 2383 1 1 12 SER HB3 H 1.734 2.076 -9.174 1.00 . A A . 11 SER HB3 1 1 7 2384 1 1 12 SER HG H 4.035 2.163 -8.353 1.00 . A A . 11 SER HG 1 1 7 2385 1 1 12 SER N N 2.434 2.853 -6.693 1.00 . A A . 11 SER N 1 1 7 2386 1 1 12 SER O O 2.366 -0.738 -6.388 1.00 . A A . 11 SER O 1 1 7 2387 1 1 12 SER OG O 3.661 1.468 -8.900 1.00 . A A . 11 SER OG 1 1 7 2388 1 1 13 ARG C C 3.784 -0.364 -3.417 1.00 . A A . 12 ARG C 1 1 7 2389 1 1 13 ARG CA C 4.504 -0.081 -4.731 1.00 . A A . 12 ARG CA 1 1 7 2390 1 1 13 ARG CB C 5.894 0.501 -4.461 1.00 . A A . 12 ARG CB 1 1 7 2391 1 1 13 ARG CD C 8.193 0.210 -3.497 1.00 . A A . 12 ARG CD 1 1 7 2392 1 1 13 ARG CG C 6.840 -0.442 -3.735 1.00 . A A . 12 ARG CG 1 1 7 2393 1 1 13 ARG CZ C 10.364 -0.354 -2.485 1.00 . A A . 12 ARG CZ 1 1 7 2394 1 1 13 ARG H H 3.968 1.797 -5.544 1.00 . A A . 12 ARG H 1 1 7 2395 1 1 13 ARG HA H 4.603 -1.002 -5.277 1.00 . A A . 12 ARG HA 1 1 7 2396 1 1 13 ARG HB2 H 6.344 0.770 -5.405 1.00 . A A . 12 ARG HB2 1 1 7 2397 1 1 13 ARG HB3 H 5.784 1.394 -3.862 1.00 . A A . 12 ARG HB3 1 1 7 2398 1 1 13 ARG HD2 H 8.634 0.455 -4.453 1.00 . A A . 12 ARG HD2 1 1 7 2399 1 1 13 ARG HD3 H 8.048 1.117 -2.927 1.00 . A A . 12 ARG HD3 1 1 7 2400 1 1 13 ARG HE H 8.758 -1.537 -2.473 1.00 . A A . 12 ARG HE 1 1 7 2401 1 1 13 ARG HG2 H 6.407 -0.710 -2.783 1.00 . A A . 12 ARG HG2 1 1 7 2402 1 1 13 ARG HG3 H 6.978 -1.330 -4.335 1.00 . A A . 12 ARG HG3 1 1 7 2403 1 1 13 ARG HH11 H 10.289 1.460 -3.374 1.00 . A A . 12 ARG HH11 1 1 7 2404 1 1 13 ARG HH12 H 11.811 1.048 -2.657 1.00 . A A . 12 ARG HH12 1 1 7 2405 1 1 13 ARG HH21 H 12.077 -0.969 -1.606 1.00 . A A . 12 ARG HH21 1 1 7 2406 1 1 13 ARG HH22 H 10.758 -2.088 -1.525 1.00 . A A . 12 ARG HH22 1 1 7 2407 1 1 13 ARG N N 3.732 0.846 -5.553 1.00 . A A . 12 ARG N 1 1 7 2408 1 1 13 ARG NE N 9.104 -0.669 -2.768 1.00 . A A . 12 ARG NE 1 1 7 2409 1 1 13 ARG NH1 N 10.862 0.814 -2.870 1.00 . A A . 12 ARG NH1 1 1 7 2410 1 1 13 ARG NH2 N 11.129 -1.207 -1.818 1.00 . A A . 12 ARG NH2 1 1 7 2411 1 1 13 ARG O O 4.270 -1.115 -2.571 1.00 . A A . 12 ARG O 1 1 7 2412 1 1 14 VAL C C 0.325 0.078 -2.401 1.00 . A A . 13 VAL C 1 1 7 2413 1 1 14 VAL CA C 1.810 0.072 -2.064 1.00 . A A . 13 VAL CA 1 1 7 2414 1 1 14 VAL CB C 2.092 1.187 -1.041 1.00 . A A . 13 VAL CB 1 1 7 2415 1 1 14 VAL CG1 C 1.209 1.020 0.183 1.00 . A A . 13 VAL CG1 1 1 7 2416 1 1 14 VAL CG2 C 3.561 1.201 -0.649 1.00 . A A . 13 VAL CG2 1 1 7 2417 1 1 14 VAL H H 2.275 0.798 -3.984 1.00 . A A . 13 VAL H 1 1 7 2418 1 1 14 VAL HA H 2.066 -0.877 -1.615 1.00 . A A . 13 VAL HA 1 1 7 2419 1 1 14 VAL HB H 1.854 2.135 -1.498 1.00 . A A . 13 VAL HB 1 1 7 2420 1 1 14 VAL HG11 H 1.400 0.058 0.634 1.00 . A A . 13 VAL HG11 1 1 7 2421 1 1 14 VAL HG12 H 0.173 1.079 -0.114 1.00 . A A . 13 VAL HG12 1 1 7 2422 1 1 14 VAL HG13 H 1.427 1.802 0.894 1.00 . A A . 13 VAL HG13 1 1 7 2423 1 1 14 VAL HG21 H 3.734 1.985 0.073 1.00 . A A . 13 VAL HG21 1 1 7 2424 1 1 14 VAL HG22 H 4.165 1.379 -1.526 1.00 . A A . 13 VAL HG22 1 1 7 2425 1 1 14 VAL HG23 H 3.827 0.247 -0.216 1.00 . A A . 13 VAL HG23 1 1 7 2426 1 1 14 VAL N N 2.612 0.236 -3.264 1.00 . A A . 13 VAL N 1 1 7 2427 1 1 14 VAL O O -0.264 1.135 -2.626 1.00 . A A . 13 VAL O 1 1 7 2428 1 1 15 ASN C C -2.524 -0.373 -1.815 1.00 . A A . 14 ASN C 1 1 7 2429 1 1 15 ASN CA C -1.689 -1.241 -2.751 1.00 . A A . 14 ASN CA 1 1 7 2430 1 1 15 ASN CB C -2.121 -2.704 -2.631 1.00 . A A . 14 ASN CB 1 1 7 2431 1 1 15 ASN CG C -1.300 -3.621 -3.518 1.00 . A A . 14 ASN CG 1 1 7 2432 1 1 15 ASN H H 0.261 -1.914 -2.276 1.00 . A A . 14 ASN H 1 1 7 2433 1 1 15 ASN HA H -1.845 -0.911 -3.766 1.00 . A A . 14 ASN HA 1 1 7 2434 1 1 15 ASN HB2 H -2.003 -3.025 -1.607 1.00 . A A . 14 ASN HB2 1 1 7 2435 1 1 15 ASN HB3 H -3.158 -2.791 -2.916 1.00 . A A . 14 ASN HB3 1 1 7 2436 1 1 15 ASN HD21 H 0.381 -4.680 -3.552 1.00 . A A . 14 ASN HD21 1 1 7 2437 1 1 15 ASN HD22 H 0.071 -3.812 -2.091 1.00 . A A . 14 ASN HD22 1 1 7 2438 1 1 15 ASN N N -0.270 -1.108 -2.447 1.00 . A A . 14 ASN N 1 1 7 2439 1 1 15 ASN ND2 N -0.168 -4.086 -3.001 1.00 . A A . 14 ASN ND2 1 1 7 2440 1 1 15 ASN O O -2.859 -0.783 -0.704 1.00 . A A . 14 ASN O 1 1 7 2441 1 1 15 ASN OD1 O -1.678 -3.905 -4.655 1.00 . A A . 14 ASN OD1 1 1 7 2442 1 1 16 ARG C C -5.017 1.194 -1.172 1.00 . A A . 15 ARG C 1 1 7 2443 1 1 16 ARG CA C -3.635 1.766 -1.472 1.00 . A A . 15 ARG CA 1 1 7 2444 1 1 16 ARG CB C -3.769 3.105 -2.201 1.00 . A A . 15 ARG CB 1 1 7 2445 1 1 16 ARG CD C -4.608 5.475 -2.161 1.00 . A A . 15 ARG CD 1 1 7 2446 1 1 16 ARG CG C -4.541 4.152 -1.414 1.00 . A A . 15 ARG CG 1 1 7 2447 1 1 16 ARG CZ C -3.071 7.231 -2.943 1.00 . A A . 15 ARG CZ 1 1 7 2448 1 1 16 ARG H H -2.550 1.102 -3.164 1.00 . A A . 15 ARG H 1 1 7 2449 1 1 16 ARG HA H -3.112 1.925 -0.541 1.00 . A A . 15 ARG HA 1 1 7 2450 1 1 16 ARG HB2 H -2.782 3.493 -2.402 1.00 . A A . 15 ARG HB2 1 1 7 2451 1 1 16 ARG HB3 H -4.280 2.942 -3.139 1.00 . A A . 15 ARG HB3 1 1 7 2452 1 1 16 ARG HD2 H -5.103 5.314 -3.107 1.00 . A A . 15 ARG HD2 1 1 7 2453 1 1 16 ARG HD3 H -5.177 6.177 -1.572 1.00 . A A . 15 ARG HD3 1 1 7 2454 1 1 16 ARG HE H -2.507 5.482 -2.166 1.00 . A A . 15 ARG HE 1 1 7 2455 1 1 16 ARG HG2 H -5.546 3.793 -1.245 1.00 . A A . 15 ARG HG2 1 1 7 2456 1 1 16 ARG HG3 H -4.049 4.311 -0.466 1.00 . A A . 15 ARG HG3 1 1 7 2457 1 1 16 ARG HH11 H -5.034 7.674 -3.139 1.00 . A A . 15 ARG HH11 1 1 7 2458 1 1 16 ARG HH12 H -3.938 8.899 -3.684 1.00 . A A . 15 ARG HH12 1 1 7 2459 1 1 16 ARG HH21 H -1.056 7.090 -2.881 1.00 . A A . 15 ARG HH21 1 1 7 2460 1 1 16 ARG HH22 H -1.677 8.567 -3.538 1.00 . A A . 15 ARG HH22 1 1 7 2461 1 1 16 ARG N N -2.848 0.834 -2.270 1.00 . A A . 15 ARG N 1 1 7 2462 1 1 16 ARG NE N -3.281 6.030 -2.409 1.00 . A A . 15 ARG NE 1 1 7 2463 1 1 16 ARG NH1 N -4.099 7.997 -3.284 1.00 . A A . 15 ARG NH1 1 1 7 2464 1 1 16 ARG NH2 N -1.833 7.664 -3.136 1.00 . A A . 15 ARG NH2 1 1 7 2465 1 1 16 ARG O O -5.767 0.846 -2.083 1.00 . A A . 15 ARG O 1 1 7 2466 1 1 17 HIS C C -7.723 1.641 0.424 1.00 . A A . 16 HIS C 1 1 7 2467 1 1 17 HIS CA C -6.638 0.575 0.535 1.00 . A A . 16 HIS CA 1 1 7 2468 1 1 17 HIS CB C -6.557 0.061 1.973 1.00 . A A . 16 HIS CB 1 1 7 2469 1 1 17 HIS CD2 C -5.650 -2.369 1.926 1.00 . A A . 16 HIS CD2 1 1 7 2470 1 1 17 HIS CE1 C -3.640 -1.974 2.707 1.00 . A A . 16 HIS CE1 1 1 7 2471 1 1 17 HIS CG C -5.559 -1.038 2.161 1.00 . A A . 16 HIS CG 1 1 7 2472 1 1 17 HIS H H -4.705 1.397 0.793 1.00 . A A . 16 HIS H 1 1 7 2473 1 1 17 HIS HA H -6.890 -0.247 -0.118 1.00 . A A . 16 HIS HA 1 1 7 2474 1 1 17 HIS HB2 H -6.281 0.877 2.624 1.00 . A A . 16 HIS HB2 1 1 7 2475 1 1 17 HIS HB3 H -7.526 -0.315 2.269 1.00 . A A . 16 HIS HB3 1 1 7 2476 1 1 17 HIS HD1 H -3.914 0.042 2.915 1.00 . A A . 16 HIS HD1 1 1 7 2477 1 1 17 HIS HD2 H -6.513 -2.893 1.538 1.00 . A A . 16 HIS HD2 1 1 7 2478 1 1 17 HIS HE1 H -2.625 -2.114 3.050 1.00 . A A . 16 HIS HE1 1 1 7 2479 1 1 17 HIS HE2 H -4.217 -3.877 2.212 1.00 . A A . 16 HIS HE2 1 1 7 2480 1 1 17 HIS N N -5.347 1.103 0.113 1.00 . A A . 16 HIS N 1 1 7 2481 1 1 17 HIS ND1 N -4.286 -0.825 2.650 1.00 . A A . 16 HIS ND1 1 1 7 2482 1 1 17 HIS NE2 N -4.445 -2.926 2.274 1.00 . A A . 16 HIS NE2 1 1 7 2483 1 1 17 HIS O O -7.473 2.820 0.679 1.00 . A A . 16 HIS O 1 1 7 2484 1 1 18 SER C C -9.690 3.334 -0.966 1.00 . A A . 17 SER C 1 1 7 2485 1 1 18 SER CA C -10.060 2.124 -0.111 1.00 . A A . 17 SER CA 1 1 7 2486 1 1 18 SER CB C -10.564 2.583 1.261 1.00 . A A . 17 SER CB 1 1 7 2487 1 1 18 SER H H -9.053 0.262 -0.150 1.00 . A A . 17 SER H 1 1 7 2488 1 1 18 SER HA H -10.851 1.580 -0.607 1.00 . A A . 17 SER HA 1 1 7 2489 1 1 18 SER HB2 H -11.458 3.174 1.134 1.00 . A A . 17 SER HB2 1 1 7 2490 1 1 18 SER HB3 H -10.787 1.718 1.868 1.00 . A A . 17 SER HB3 1 1 7 2491 1 1 18 SER HG H -9.988 4.194 2.215 1.00 . A A . 17 SER HG 1 1 7 2492 1 1 18 SER N N -8.925 1.215 0.038 1.00 . A A . 17 SER N 1 1 7 2493 1 1 18 SER O O -8.663 3.338 -1.643 1.00 . A A . 17 SER O 1 1 7 2494 1 1 18 SER OG O -9.592 3.367 1.931 1.00 . A A . 17 SER OG 1 1 7 2495 1 1 19 THR C C -9.823 6.706 -0.809 1.00 . A A . 18 THR C 1 1 7 2496 1 1 19 THR CA C -10.303 5.570 -1.706 1.00 . A A . 18 THR CA 1 1 7 2497 1 1 19 THR CB C -11.574 6.022 -2.451 1.00 . A A . 18 THR CB 1 1 7 2498 1 1 19 THR CG2 C -12.726 6.235 -1.480 1.00 . A A . 18 THR CG2 1 1 7 2499 1 1 19 THR H H -11.346 4.291 -0.382 1.00 . A A . 18 THR H 1 1 7 2500 1 1 19 THR HA H -9.538 5.356 -2.439 1.00 . A A . 18 THR HA 1 1 7 2501 1 1 19 THR HB H -11.854 5.250 -3.154 1.00 . A A . 18 THR HB 1 1 7 2502 1 1 19 THR HG1 H -10.541 7.123 -3.721 1.00 . A A . 18 THR HG1 1 1 7 2503 1 1 19 THR HG21 H -13.605 6.542 -2.026 1.00 . A A . 18 THR HG21 1 1 7 2504 1 1 19 THR HG22 H -12.458 7.000 -0.768 1.00 . A A . 18 THR HG22 1 1 7 2505 1 1 19 THR HG23 H -12.931 5.312 -0.957 1.00 . A A . 18 THR HG23 1 1 7 2506 1 1 19 THR N N -10.540 4.356 -0.935 1.00 . A A . 18 THR N 1 1 7 2507 1 1 19 THR O O -9.131 7.617 -1.262 1.00 . A A . 18 THR O 1 1 7 2508 1 1 19 THR OG1 O -11.318 7.234 -3.168 1.00 . A A . 18 THR OG1 1 1 7 2509 1 1 20 ALA C C -8.889 7.088 2.502 1.00 . A A . 19 ALA C 1 1 7 2510 1 1 20 ALA CA C -9.804 7.667 1.427 1.00 . A A . 19 ALA CA 1 1 7 2511 1 1 20 ALA CB C -11.036 8.293 2.062 1.00 . A A . 19 ALA CB 1 1 7 2512 1 1 20 ALA H H -10.747 5.893 0.766 1.00 . A A . 19 ALA H 1 1 7 2513 1 1 20 ALA HA H -9.271 8.441 0.894 1.00 . A A . 19 ALA HA 1 1 7 2514 1 1 20 ALA HB1 H -11.673 8.698 1.289 1.00 . A A . 19 ALA HB1 1 1 7 2515 1 1 20 ALA HB2 H -10.734 9.085 2.731 1.00 . A A . 19 ALA HB2 1 1 7 2516 1 1 20 ALA HB3 H -11.577 7.540 2.617 1.00 . A A . 19 ALA HB3 1 1 7 2517 1 1 20 ALA N N -10.196 6.645 0.465 1.00 . A A . 19 ALA N 1 1 7 2518 1 1 20 ALA O O -8.609 5.890 2.511 1.00 . A A . 19 ALA O 1 1 7 2519 1 1 21 ILE C C -8.341 7.204 5.749 1.00 . A A . 20 ILE C 1 1 7 2520 1 1 21 ILE CA C -7.546 7.520 4.485 1.00 . A A . 20 ILE CA 1 1 7 2521 1 1 21 ILE CB C -6.487 8.595 4.804 1.00 . A A . 20 ILE CB 1 1 7 2522 1 1 21 ILE CD1 C -4.402 9.054 6.199 1.00 . A A . 20 ILE CD1 1 1 7 2523 1 1 21 ILE CG1 C -5.559 8.116 5.924 1.00 . A A . 20 ILE CG1 1 1 7 2524 1 1 21 ILE CG2 C -7.161 9.907 5.187 1.00 . A A . 20 ILE CG2 1 1 7 2525 1 1 21 ILE H H -8.687 8.890 3.344 1.00 . A A . 20 ILE H 1 1 7 2526 1 1 21 ILE HA H -7.034 6.625 4.162 1.00 . A A . 20 ILE HA 1 1 7 2527 1 1 21 ILE HB H -5.904 8.768 3.912 1.00 . A A . 20 ILE HB 1 1 7 2528 1 1 21 ILE HD11 H -3.807 9.164 5.305 1.00 . A A . 20 ILE HD11 1 1 7 2529 1 1 21 ILE HD12 H -3.791 8.648 6.992 1.00 . A A . 20 ILE HD12 1 1 7 2530 1 1 21 ILE HD13 H -4.786 10.019 6.497 1.00 . A A . 20 ILE HD13 1 1 7 2531 1 1 21 ILE HG12 H -6.128 8.015 6.836 1.00 . A A . 20 ILE HG12 1 1 7 2532 1 1 21 ILE HG13 H -5.147 7.155 5.653 1.00 . A A . 20 ILE HG13 1 1 7 2533 1 1 21 ILE HG21 H -6.408 10.653 5.389 1.00 . A A . 20 ILE HG21 1 1 7 2534 1 1 21 ILE HG22 H -7.765 9.756 6.069 1.00 . A A . 20 ILE HG22 1 1 7 2535 1 1 21 ILE HG23 H -7.789 10.239 4.374 1.00 . A A . 20 ILE HG23 1 1 7 2536 1 1 21 ILE N N -8.429 7.947 3.405 1.00 . A A . 20 ILE N 1 1 7 2537 1 1 21 ILE O O -9.296 7.906 6.086 1.00 . A A . 20 ILE O 1 1 7 2538 1 1 22 GLY C C -8.099 6.479 8.882 1.00 . A A . 21 GLY C 1 1 7 2539 1 1 22 GLY CA C -8.628 5.753 7.662 1.00 . A A . 21 GLY CA 1 1 7 2540 1 1 22 GLY H H -7.176 5.621 6.126 1.00 . A A . 21 GLY H 1 1 7 2541 1 1 22 GLY HA2 H -9.680 5.970 7.555 1.00 . A A . 21 GLY HA2 1 1 7 2542 1 1 22 GLY HA3 H -8.503 4.690 7.806 1.00 . A A . 21 GLY HA3 1 1 7 2543 1 1 22 GLY N N -7.942 6.143 6.443 1.00 . A A . 21 GLY N 1 1 7 2544 1 1 22 GLY O O -8.783 7.330 9.450 1.00 . A A . 21 GLY O 1 1 7 2545 1 1 23 ARG C C -4.750 6.924 10.245 1.00 . A A . 22 ARG C 1 1 7 2546 1 1 23 ARG CA C -6.255 6.769 10.446 1.00 . A A . 22 ARG CA 1 1 7 2547 1 1 23 ARG CB C -6.541 5.949 11.708 1.00 . A A . 22 ARG CB 1 1 7 2548 1 1 23 ARG CD C -6.636 3.691 12.808 1.00 . A A . 22 ARG CD 1 1 7 2549 1 1 23 ARG CG C -6.320 4.455 11.532 1.00 . A A . 22 ARG CG 1 1 7 2550 1 1 23 ARG CZ C -8.554 3.295 14.299 1.00 . A A . 22 ARG CZ 1 1 7 2551 1 1 23 ARG H H -6.383 5.458 8.790 1.00 . A A . 22 ARG H 1 1 7 2552 1 1 23 ARG HA H -6.690 7.751 10.563 1.00 . A A . 22 ARG HA 1 1 7 2553 1 1 23 ARG HB2 H -5.896 6.296 12.501 1.00 . A A . 22 ARG HB2 1 1 7 2554 1 1 23 ARG HB3 H -7.570 6.107 11.999 1.00 . A A . 22 ARG HB3 1 1 7 2555 1 1 23 ARG HD2 H -6.454 2.641 12.638 1.00 . A A . 22 ARG HD2 1 1 7 2556 1 1 23 ARG HD3 H -5.987 4.045 13.595 1.00 . A A . 22 ARG HD3 1 1 7 2557 1 1 23 ARG HE H -8.592 4.448 12.670 1.00 . A A . 22 ARG HE 1 1 7 2558 1 1 23 ARG HG2 H -6.962 4.096 10.742 1.00 . A A . 22 ARG HG2 1 1 7 2559 1 1 23 ARG HG3 H -5.287 4.282 11.268 1.00 . A A . 22 ARG HG3 1 1 7 2560 1 1 23 ARG HH11 H -8.213 2.076 15.875 1.00 . A A . 22 ARG HH11 1 1 7 2561 1 1 23 ARG HH12 H -6.853 2.344 14.837 1.00 . A A . 22 ARG HH12 1 1 7 2562 1 1 23 ARG HH21 H -10.222 3.075 15.418 1.00 . A A . 22 ARG HH21 1 1 7 2563 1 1 23 ARG HH22 H -10.388 4.101 14.032 1.00 . A A . 22 ARG HH22 1 1 7 2564 1 1 23 ARG N N -6.877 6.143 9.285 1.00 . A A . 22 ARG N 1 1 7 2565 1 1 23 ARG NE N -8.026 3.870 13.223 1.00 . A A . 22 ARG NE 1 1 7 2566 1 1 23 ARG NH1 N -7.812 2.507 15.067 1.00 . A A . 22 ARG NH1 1 1 7 2567 1 1 23 ARG NH2 N -9.826 3.508 14.609 1.00 . A A . 22 ARG NH2 1 1 7 2568 1 1 23 ARG O O -4.005 5.977 10.575 1.00 . A A . 22 ARG O 1 1 7 2569 1 1 23 ARG OXT O -4.328 7.993 9.757 1.00 . A A . 22 ARG OXT 1 1 8 2570 1 1 1 ACE C C 1.996 2.545 9.067 1.00 . A A . 0 ACE C 1 1 8 2571 1 1 1 ACE CH3 C 0.962 1.722 9.787 1.00 . A A . 0 ACE CH3 1 1 8 2572 1 1 1 ACE H1 H 1.467 1.074 10.495 1.00 . A A . 0 ACE H1 1 1 8 2573 1 1 1 ACE H2 H 0.423 1.125 9.077 1.00 . A A . 0 ACE H2 1 1 8 2574 1 1 1 ACE H3 H 0.274 2.392 10.293 1.00 . A A . 0 ACE H3 1 1 8 2575 1 1 1 ACE O O 1.672 3.543 8.421 1.00 . A A . 0 ACE O 1 1 8 2576 1 1 2 MET C C 4.715 2.185 7.196 1.00 . A A . 1 MET C 1 1 8 2577 1 1 2 MET CA C 4.352 2.839 8.526 1.00 . A A . 1 MET CA 1 1 8 2578 1 1 2 MET CB C 5.579 2.873 9.439 1.00 . A A . 1 MET CB 1 1 8 2579 1 1 2 MET CE C 4.292 4.823 12.901 1.00 . A A . 1 MET CE 1 1 8 2580 1 1 2 MET CG C 5.468 3.874 10.578 1.00 . A A . 1 MET CG 1 1 8 2581 1 1 2 MET H H 3.449 1.328 9.703 1.00 . A A . 1 MET H 1 1 8 2582 1 1 2 MET HA H 4.027 3.850 8.338 1.00 . A A . 1 MET HA 1 1 8 2583 1 1 2 MET HB2 H 5.725 1.892 9.865 1.00 . A A . 1 MET HB2 1 1 8 2584 1 1 2 MET HB3 H 6.446 3.131 8.848 1.00 . A A . 1 MET HB3 1 1 8 2585 1 1 2 MET HE1 H 4.182 5.773 12.399 1.00 . A A . 1 MET HE1 1 1 8 2586 1 1 2 MET HE2 H 5.268 4.770 13.359 1.00 . A A . 1 MET HE2 1 1 8 2587 1 1 2 MET HE3 H 3.531 4.727 13.661 1.00 . A A . 1 MET HE3 1 1 8 2588 1 1 2 MET HG2 H 6.394 3.872 11.133 1.00 . A A . 1 MET HG2 1 1 8 2589 1 1 2 MET HG3 H 5.303 4.857 10.160 1.00 . A A . 1 MET HG3 1 1 8 2590 1 1 2 MET N N 3.254 2.130 9.175 1.00 . A A . 1 MET N 1 1 8 2591 1 1 2 MET O O 5.831 2.346 6.701 1.00 . A A . 1 MET O 1 1 8 2592 1 1 2 MET SD S 4.118 3.496 11.711 1.00 . A A . 1 MET SD 1 1 8 2593 1 1 3 ASN C C 4.064 1.792 4.203 1.00 . A A . 2 ASN C 1 1 8 2594 1 1 3 ASN CA C 3.997 0.784 5.343 1.00 . A A . 2 ASN CA 1 1 8 2595 1 1 3 ASN CB C 2.891 -0.237 5.059 1.00 . A A . 2 ASN CB 1 1 8 2596 1 1 3 ASN CG C 3.222 -1.130 3.876 1.00 . A A . 2 ASN CG 1 1 8 2597 1 1 3 ASN H H 2.894 1.369 7.055 1.00 . A A . 2 ASN H 1 1 8 2598 1 1 3 ASN HA H 4.943 0.268 5.409 1.00 . A A . 2 ASN HA 1 1 8 2599 1 1 3 ASN HB2 H 2.753 -0.860 5.930 1.00 . A A . 2 ASN HB2 1 1 8 2600 1 1 3 ASN HB3 H 1.972 0.288 4.845 1.00 . A A . 2 ASN HB3 1 1 8 2601 1 1 3 ASN HD21 H 2.627 0.281 2.601 1.00 . A A . 2 ASN HD21 1 1 8 2602 1 1 3 ASN HD22 H 3.202 -1.182 1.885 1.00 . A A . 2 ASN HD22 1 1 8 2603 1 1 3 ASN N N 3.766 1.456 6.618 1.00 . A A . 2 ASN N 1 1 8 2604 1 1 3 ASN ND2 N 2.992 -0.627 2.665 1.00 . A A . 2 ASN ND2 1 1 8 2605 1 1 3 ASN O O 4.308 1.421 3.056 1.00 . A A . 2 ASN O 1 1 8 2606 1 1 3 ASN OD1 O 3.692 -2.255 4.047 1.00 . A A . 2 ASN OD1 1 1 8 2607 1 1 4 TRP C C 5.098 3.956 2.610 1.00 . A A . 3 TRP C 1 1 8 2608 1 1 4 TRP CA C 3.890 4.113 3.506 1.00 . A A . 3 TRP CA 1 1 8 2609 1 1 4 TRP CB C 3.939 5.496 4.133 1.00 . A A . 3 TRP CB 1 1 8 2610 1 1 4 TRP CD1 C 5.161 5.484 6.368 1.00 . A A . 3 TRP CD1 1 1 8 2611 1 1 4 TRP CD2 C 6.419 6.131 4.646 1.00 . A A . 3 TRP CD2 1 1 8 2612 1 1 4 TRP CE2 C 7.201 6.190 5.810 1.00 . A A . 3 TRP CE2 1 1 8 2613 1 1 4 TRP CE3 C 6.996 6.485 3.431 1.00 . A A . 3 TRP CE3 1 1 8 2614 1 1 4 TRP CG C 5.116 5.693 5.029 1.00 . A A . 3 TRP CG 1 1 8 2615 1 1 4 TRP CH2 C 9.074 6.936 4.583 1.00 . A A . 3 TRP CH2 1 1 8 2616 1 1 4 TRP CZ2 C 8.531 6.593 5.790 1.00 . A A . 3 TRP CZ2 1 1 8 2617 1 1 4 TRP CZ3 C 8.318 6.882 3.408 1.00 . A A . 3 TRP CZ3 1 1 8 2618 1 1 4 TRP H H 3.683 3.311 5.453 1.00 . A A . 3 TRP H 1 1 8 2619 1 1 4 TRP HA H 2.997 4.028 2.913 1.00 . A A . 3 TRP HA 1 1 8 2620 1 1 4 TRP HB2 H 4.000 6.235 3.342 1.00 . A A . 3 TRP HB2 1 1 8 2621 1 1 4 TRP HB3 H 3.042 5.660 4.710 1.00 . A A . 3 TRP HB3 1 1 8 2622 1 1 4 TRP HD1 H 4.329 5.135 6.946 1.00 . A A . 3 TRP HD1 1 1 8 2623 1 1 4 TRP HE1 H 6.687 5.732 7.793 1.00 . A A . 3 TRP HE1 1 1 8 2624 1 1 4 TRP HE3 H 6.425 6.444 2.517 1.00 . A A . 3 TRP HE3 1 1 8 2625 1 1 4 TRP HH2 H 10.103 7.253 4.522 1.00 . A A . 3 TRP HH2 1 1 8 2626 1 1 4 TRP HZ2 H 9.121 6.643 6.684 1.00 . A A . 3 TRP HZ2 1 1 8 2627 1 1 4 TRP HZ3 H 8.780 7.161 2.473 1.00 . A A . 3 TRP HZ3 1 1 8 2628 1 1 4 TRP N N 3.856 3.068 4.521 1.00 . A A . 3 TRP N 1 1 8 2629 1 1 4 TRP NE1 N 6.410 5.791 6.855 1.00 . A A . 3 TRP NE1 1 1 8 2630 1 1 4 TRP O O 5.077 4.398 1.465 1.00 . A A . 3 TRP O 1 1 8 2631 1 1 5 THR C C 7.101 2.923 0.937 1.00 . A A . 4 THR C 1 1 8 2632 1 1 5 THR CA C 7.387 3.126 2.419 1.00 . A A . 4 THR CA 1 1 8 2633 1 1 5 THR CB C 8.172 1.915 2.956 1.00 . A A . 4 THR CB 1 1 8 2634 1 1 5 THR CG2 C 9.535 1.815 2.289 1.00 . A A . 4 THR CG2 1 1 8 2635 1 1 5 THR H H 6.085 3.014 4.078 1.00 . A A . 4 THR H 1 1 8 2636 1 1 5 THR HA H 7.992 4.011 2.548 1.00 . A A . 4 THR HA 1 1 8 2637 1 1 5 THR HB H 7.613 1.018 2.735 1.00 . A A . 4 THR HB 1 1 8 2638 1 1 5 THR HG1 H 8.702 2.891 4.586 1.00 . A A . 4 THR HG1 1 1 8 2639 1 1 5 THR HG21 H 9.407 1.699 1.222 1.00 . A A . 4 THR HG21 1 1 8 2640 1 1 5 THR HG22 H 10.066 0.960 2.683 1.00 . A A . 4 THR HG22 1 1 8 2641 1 1 5 THR HG23 H 10.101 2.712 2.488 1.00 . A A . 4 THR HG23 1 1 8 2642 1 1 5 THR N N 6.149 3.337 3.155 1.00 . A A . 4 THR N 1 1 8 2643 1 1 5 THR O O 6.934 1.796 0.470 1.00 . A A . 4 THR O 1 1 8 2644 1 1 5 THR OG1 O 8.338 2.028 4.374 1.00 . A A . 4 THR OG1 1 1 8 2645 1 1 6 GLY C C 5.859 5.135 -1.635 1.00 . A A . 5 GLY C 1 1 8 2646 1 1 6 GLY CA C 6.744 3.978 -1.202 1.00 . A A . 5 GLY CA 1 1 8 2647 1 1 6 GLY H H 7.206 4.893 0.642 1.00 . A A . 5 GLY H 1 1 8 2648 1 1 6 GLY HA2 H 7.667 4.010 -1.759 1.00 . A A . 5 GLY HA2 1 1 8 2649 1 1 6 GLY HA3 H 6.233 3.048 -1.414 1.00 . A A . 5 GLY HA3 1 1 8 2650 1 1 6 GLY N N 7.041 4.029 0.211 1.00 . A A . 5 GLY N 1 1 8 2651 1 1 6 GLY O O 5.493 5.240 -2.799 1.00 . A A . 5 GLY O 1 1 8 2652 1 1 7 LEU C C 5.411 8.268 -1.708 1.00 . A A . 6 LEU C 1 1 8 2653 1 1 7 LEU CA C 4.662 7.159 -0.976 1.00 . A A . 6 LEU CA 1 1 8 2654 1 1 7 LEU CB C 4.064 7.686 0.329 1.00 . A A . 6 LEU CB 1 1 8 2655 1 1 7 LEU CD1 C 4.466 8.735 2.580 1.00 . A A . 6 LEU CD1 1 1 8 2656 1 1 7 LEU CD2 C 6.389 8.442 1.035 1.00 . A A . 6 LEU CD2 1 1 8 2657 1 1 7 LEU CG C 4.895 8.721 1.122 1.00 . A A . 6 LEU CG 1 1 8 2658 1 1 7 LEU H H 5.847 5.875 0.221 1.00 . A A . 6 LEU H 1 1 8 2659 1 1 7 LEU HA H 3.859 6.815 -1.609 1.00 . A A . 6 LEU HA 1 1 8 2660 1 1 7 LEU HB2 H 3.112 8.134 0.091 1.00 . A A . 6 LEU HB2 1 1 8 2661 1 1 7 LEU HB3 H 3.888 6.839 0.970 1.00 . A A . 6 LEU HB3 1 1 8 2662 1 1 7 LEU HD11 H 4.842 7.848 3.072 1.00 . A A . 6 LEU HD11 1 1 8 2663 1 1 7 LEU HD12 H 3.388 8.751 2.640 1.00 . A A . 6 LEU HD12 1 1 8 2664 1 1 7 LEU HD13 H 4.869 9.612 3.066 1.00 . A A . 6 LEU HD13 1 1 8 2665 1 1 7 LEU HD21 H 6.552 7.378 0.946 1.00 . A A . 6 LEU HD21 1 1 8 2666 1 1 7 LEU HD22 H 6.874 8.804 1.933 1.00 . A A . 6 LEU HD22 1 1 8 2667 1 1 7 LEU HD23 H 6.802 8.946 0.175 1.00 . A A . 6 LEU HD23 1 1 8 2668 1 1 7 LEU HG H 4.716 9.704 0.713 1.00 . A A . 6 LEU HG 1 1 8 2669 1 1 7 LEU N N 5.521 6.010 -0.692 1.00 . A A . 6 LEU N 1 1 8 2670 1 1 7 LEU O O 4.962 9.415 -1.751 1.00 . A A . 6 LEU O 1 1 8 2671 1 1 8 TYR C C 7.710 8.374 -4.415 1.00 . A A . 7 TYR C 1 1 8 2672 1 1 8 TYR CA C 7.366 8.871 -3.012 1.00 . A A . 7 TYR CA 1 1 8 2673 1 1 8 TYR CB C 8.646 9.164 -2.230 1.00 . A A . 7 TYR CB 1 1 8 2674 1 1 8 TYR CD1 C 8.695 7.026 -0.919 1.00 . A A . 7 TYR CD1 1 1 8 2675 1 1 8 TYR CD2 C 10.658 7.639 -2.115 1.00 . A A . 7 TYR CD2 1 1 8 2676 1 1 8 TYR CE1 C 9.308 5.892 -0.476 1.00 . A A . 7 TYR CE1 1 1 8 2677 1 1 8 TYR CE2 C 11.289 6.493 -1.670 1.00 . A A . 7 TYR CE2 1 1 8 2678 1 1 8 TYR CG C 9.350 7.923 -1.744 1.00 . A A . 7 TYR CG 1 1 8 2679 1 1 8 TYR CZ C 10.607 5.619 -0.848 1.00 . A A . 7 TYR CZ 1 1 8 2680 1 1 8 TYR H H 6.836 6.987 -2.223 1.00 . A A . 7 TYR H 1 1 8 2681 1 1 8 TYR HA H 6.802 9.776 -3.095 1.00 . A A . 7 TYR HA 1 1 8 2682 1 1 8 TYR HB2 H 9.331 9.711 -2.859 1.00 . A A . 7 TYR HB2 1 1 8 2683 1 1 8 TYR HB3 H 8.400 9.761 -1.367 1.00 . A A . 7 TYR HB3 1 1 8 2684 1 1 8 TYR HD1 H 7.676 7.230 -0.619 1.00 . A A . 7 TYR HD1 1 1 8 2685 1 1 8 TYR HD2 H 11.185 8.330 -2.759 1.00 . A A . 7 TYR HD2 1 1 8 2686 1 1 8 TYR HE1 H 8.761 5.221 0.155 1.00 . A A . 7 TYR HE1 1 1 8 2687 1 1 8 TYR HE2 H 12.307 6.285 -1.965 1.00 . A A . 7 TYR HE2 1 1 8 2688 1 1 8 TYR HH H 10.622 3.731 -0.487 1.00 . A A . 7 TYR HH 1 1 8 2689 1 1 8 TYR N N 6.543 7.914 -2.290 1.00 . A A . 7 TYR N 1 1 8 2690 1 1 8 TYR O O 7.837 9.168 -5.348 1.00 . A A . 7 TYR O 1 1 8 2691 1 1 8 TYR OH O 11.224 4.473 -0.401 1.00 . A A . 7 TYR OH 1 1 8 2692 1 1 9 THR C C 7.498 5.134 -6.068 1.00 . A A . 8 THR C 1 1 8 2693 1 1 9 THR CA C 8.194 6.472 -5.860 1.00 . A A . 8 THR CA 1 1 8 2694 1 1 9 THR CB C 9.712 6.260 -6.005 1.00 . A A . 8 THR CB 1 1 8 2695 1 1 9 THR CG2 C 10.466 7.573 -5.849 1.00 . A A . 8 THR CG2 1 1 8 2696 1 1 9 THR H H 7.743 6.472 -3.788 1.00 . A A . 8 THR H 1 1 8 2697 1 1 9 THR HA H 7.871 7.156 -6.627 1.00 . A A . 8 THR HA 1 1 8 2698 1 1 9 THR HB H 9.912 5.861 -6.988 1.00 . A A . 8 THR HB 1 1 8 2699 1 1 9 THR HG1 H 9.418 4.802 -4.709 1.00 . A A . 8 THR HG1 1 1 8 2700 1 1 9 THR HG21 H 10.141 8.266 -6.610 1.00 . A A . 8 THR HG21 1 1 8 2701 1 1 9 THR HG22 H 11.526 7.394 -5.955 1.00 . A A . 8 THR HG22 1 1 8 2702 1 1 9 THR HG23 H 10.268 7.989 -4.873 1.00 . A A . 8 THR HG23 1 1 8 2703 1 1 9 THR N N 7.860 7.059 -4.564 1.00 . A A . 8 THR N 1 1 8 2704 1 1 9 THR O O 7.783 4.419 -7.029 1.00 . A A . 8 THR O 1 1 8 2705 1 1 9 THR OG1 O 10.164 5.324 -5.020 1.00 . A A . 8 THR OG1 1 1 8 2706 1 1 10 LEU C C 4.406 3.713 -4.788 1.00 . A A . 9 LEU C 1 1 8 2707 1 1 10 LEU CA C 5.849 3.544 -5.251 1.00 . A A . 9 LEU CA 1 1 8 2708 1 1 10 LEU CB C 6.541 2.471 -4.410 1.00 . A A . 9 LEU CB 1 1 8 2709 1 1 10 LEU CD1 C 8.624 1.226 -3.807 1.00 . A A . 9 LEU CD1 1 1 8 2710 1 1 10 LEU CD2 C 7.989 1.487 -6.208 1.00 . A A . 9 LEU CD2 1 1 8 2711 1 1 10 LEU CG C 7.972 2.136 -4.832 1.00 . A A . 9 LEU CG 1 1 8 2712 1 1 10 LEU H H 6.389 5.426 -4.441 1.00 . A A . 9 LEU H 1 1 8 2713 1 1 10 LEU HA H 5.849 3.228 -6.281 1.00 . A A . 9 LEU HA 1 1 8 2714 1 1 10 LEU HB2 H 6.560 2.805 -3.384 1.00 . A A . 9 LEU HB2 1 1 8 2715 1 1 10 LEU HB3 H 5.952 1.567 -4.463 1.00 . A A . 9 LEU HB3 1 1 8 2716 1 1 10 LEU HD11 H 9.630 0.993 -4.122 1.00 . A A . 9 LEU HD11 1 1 8 2717 1 1 10 LEU HD12 H 8.052 0.316 -3.723 1.00 . A A . 9 LEU HD12 1 1 8 2718 1 1 10 LEU HD13 H 8.651 1.726 -2.851 1.00 . A A . 9 LEU HD13 1 1 8 2719 1 1 10 LEU HD21 H 7.400 0.583 -6.187 1.00 . A A . 9 LEU HD21 1 1 8 2720 1 1 10 LEU HD22 H 9.007 1.249 -6.482 1.00 . A A . 9 LEU HD22 1 1 8 2721 1 1 10 LEU HD23 H 7.573 2.171 -6.933 1.00 . A A . 9 LEU HD23 1 1 8 2722 1 1 10 LEU HG H 8.549 3.048 -4.885 1.00 . A A . 9 LEU HG 1 1 8 2723 1 1 10 LEU N N 6.582 4.804 -5.170 1.00 . A A . 9 LEU N 1 1 8 2724 1 1 10 LEU O O 3.734 2.738 -4.468 1.00 . A A . 9 LEU O 1 1 8 2725 1 1 11 LEU C C 1.576 4.328 -4.931 1.00 . A A . 10 LEU C 1 1 8 2726 1 1 11 LEU CA C 2.590 5.294 -4.327 1.00 . A A . 10 LEU CA 1 1 8 2727 1 1 11 LEU CB C 2.253 6.728 -4.742 1.00 . A A . 10 LEU CB 1 1 8 2728 1 1 11 LEU CD1 C 4.535 7.785 -4.574 1.00 . A A . 10 LEU CD1 1 1 8 2729 1 1 11 LEU CD2 C 2.482 9.189 -4.319 1.00 . A A . 10 LEU CD2 1 1 8 2730 1 1 11 LEU CG C 3.097 7.820 -4.074 1.00 . A A . 10 LEU CG 1 1 8 2731 1 1 11 LEU H H 4.562 5.688 -4.964 1.00 . A A . 10 LEU H 1 1 8 2732 1 1 11 LEU HA H 2.541 5.221 -3.253 1.00 . A A . 10 LEU HA 1 1 8 2733 1 1 11 LEU HB2 H 2.382 6.808 -5.812 1.00 . A A . 10 LEU HB2 1 1 8 2734 1 1 11 LEU HB3 H 1.215 6.912 -4.509 1.00 . A A . 10 LEU HB3 1 1 8 2735 1 1 11 LEU HD11 H 5.114 7.101 -3.960 1.00 . A A . 10 LEU HD11 1 1 8 2736 1 1 11 LEU HD12 H 4.963 8.774 -4.507 1.00 . A A . 10 LEU HD12 1 1 8 2737 1 1 11 LEU HD13 H 4.554 7.452 -5.600 1.00 . A A . 10 LEU HD13 1 1 8 2738 1 1 11 LEU HD21 H 3.087 9.946 -3.841 1.00 . A A . 10 LEU HD21 1 1 8 2739 1 1 11 LEU HD22 H 1.483 9.215 -3.910 1.00 . A A . 10 LEU HD22 1 1 8 2740 1 1 11 LEU HD23 H 2.440 9.380 -5.382 1.00 . A A . 10 LEU HD23 1 1 8 2741 1 1 11 LEU HG H 3.112 7.647 -3.011 1.00 . A A . 10 LEU HG 1 1 8 2742 1 1 11 LEU N N 3.953 4.962 -4.739 1.00 . A A . 10 LEU N 1 1 8 2743 1 1 11 LEU O O 0.925 3.568 -4.215 1.00 . A A . 10 LEU O 1 1 8 2744 1 1 12 SER C C 1.131 2.090 -7.086 1.00 . A A . 11 SER C 1 1 8 2745 1 1 12 SER CA C 0.521 3.481 -6.954 1.00 . A A . 11 SER CA 1 1 8 2746 1 1 12 SER CB C 0.191 4.046 -8.338 1.00 . A A . 11 SER CB 1 1 8 2747 1 1 12 SER H H 1.982 5.003 -6.767 1.00 . A A . 11 SER H 1 1 8 2748 1 1 12 SER HA H -0.385 3.413 -6.372 1.00 . A A . 11 SER HA 1 1 8 2749 1 1 12 SER HB2 H -0.221 5.038 -8.230 1.00 . A A . 11 SER HB2 1 1 8 2750 1 1 12 SER HB3 H 1.094 4.093 -8.929 1.00 . A A . 11 SER HB3 1 1 8 2751 1 1 12 SER HG H -1.073 3.690 -9.792 1.00 . A A . 11 SER HG 1 1 8 2752 1 1 12 SER N N 1.445 4.365 -6.252 1.00 . A A . 11 SER N 1 1 8 2753 1 1 12 SER O O 0.779 1.320 -7.980 1.00 . A A . 11 SER O 1 1 8 2754 1 1 12 SER OG O -0.752 3.231 -9.011 1.00 . A A . 11 SER OG 1 1 8 2755 1 1 13 ARG C C 2.823 -0.061 -4.748 1.00 . A A . 12 ARG C 1 1 8 2756 1 1 13 ARG CA C 2.737 0.498 -6.165 1.00 . A A . 12 ARG CA 1 1 8 2757 1 1 13 ARG CB C 4.145 0.666 -6.740 1.00 . A A . 12 ARG CB 1 1 8 2758 1 1 13 ARG CD C 5.574 1.559 -8.605 1.00 . A A . 12 ARG CD 1 1 8 2759 1 1 13 ARG CG C 4.165 1.191 -8.167 1.00 . A A . 12 ARG CG 1 1 8 2760 1 1 13 ARG CZ C 6.720 2.451 -10.591 1.00 . A A . 12 ARG CZ 1 1 8 2761 1 1 13 ARG H H 2.261 2.435 -5.482 1.00 . A A . 12 ARG H 1 1 8 2762 1 1 13 ARG HA H 2.178 -0.186 -6.779 1.00 . A A . 12 ARG HA 1 1 8 2763 1 1 13 ARG HB2 H 4.692 1.362 -6.119 1.00 . A A . 12 ARG HB2 1 1 8 2764 1 1 13 ARG HB3 H 4.646 -0.290 -6.724 1.00 . A A . 12 ARG HB3 1 1 8 2765 1 1 13 ARG HD2 H 5.960 2.316 -7.936 1.00 . A A . 12 ARG HD2 1 1 8 2766 1 1 13 ARG HD3 H 6.196 0.678 -8.546 1.00 . A A . 12 ARG HD3 1 1 8 2767 1 1 13 ARG HE H 4.755 2.137 -10.452 1.00 . A A . 12 ARG HE 1 1 8 2768 1 1 13 ARG HG2 H 3.781 0.428 -8.827 1.00 . A A . 12 ARG HG2 1 1 8 2769 1 1 13 ARG HG3 H 3.539 2.069 -8.226 1.00 . A A . 12 ARG HG3 1 1 8 2770 1 1 13 ARG HH11 H 8.725 2.662 -10.437 1.00 . A A . 12 ARG HH11 1 1 8 2771 1 1 13 ARG HH12 H 7.934 2.033 -9.030 1.00 . A A . 12 ARG HH12 1 1 8 2772 1 1 13 ARG HH21 H 5.788 2.964 -12.308 1.00 . A A . 12 ARG HH21 1 1 8 2773 1 1 13 ARG HH22 H 7.505 3.191 -12.301 1.00 . A A . 12 ARG HH22 1 1 8 2774 1 1 13 ARG N N 2.046 1.780 -6.174 1.00 . A A . 12 ARG N 1 1 8 2775 1 1 13 ARG NE N 5.607 2.072 -9.972 1.00 . A A . 12 ARG NE 1 1 8 2776 1 1 13 ARG NH1 N 7.889 2.376 -9.968 1.00 . A A . 12 ARG NH1 1 1 8 2777 1 1 13 ARG NH2 N 6.667 2.906 -11.836 1.00 . A A . 12 ARG NH2 1 1 8 2778 1 1 13 ARG O O 3.477 -1.076 -4.509 1.00 . A A . 12 ARG O 1 1 8 2779 1 1 14 VAL C C 1.164 -0.944 -2.191 1.00 . A A . 13 VAL C 1 1 8 2780 1 1 14 VAL CA C 2.158 0.187 -2.419 1.00 . A A . 13 VAL CA 1 1 8 2781 1 1 14 VAL CB C 1.818 1.360 -1.474 1.00 . A A . 13 VAL CB 1 1 8 2782 1 1 14 VAL CG1 C 1.999 0.953 -0.022 1.00 . A A . 13 VAL CG1 1 1 8 2783 1 1 14 VAL CG2 C 2.669 2.578 -1.795 1.00 . A A . 13 VAL CG2 1 1 8 2784 1 1 14 VAL H H 1.646 1.403 -4.075 1.00 . A A . 13 VAL H 1 1 8 2785 1 1 14 VAL HA H 3.144 -0.168 -2.183 1.00 . A A . 13 VAL HA 1 1 8 2786 1 1 14 VAL HB H 0.782 1.624 -1.622 1.00 . A A . 13 VAL HB 1 1 8 2787 1 1 14 VAL HG11 H 1.863 1.816 0.612 1.00 . A A . 13 VAL HG11 1 1 8 2788 1 1 14 VAL HG12 H 2.992 0.555 0.118 1.00 . A A . 13 VAL HG12 1 1 8 2789 1 1 14 VAL HG13 H 1.268 0.199 0.231 1.00 . A A . 13 VAL HG13 1 1 8 2790 1 1 14 VAL HG21 H 2.481 3.350 -1.065 1.00 . A A . 13 VAL HG21 1 1 8 2791 1 1 14 VAL HG22 H 2.417 2.943 -2.778 1.00 . A A . 13 VAL HG22 1 1 8 2792 1 1 14 VAL HG23 H 3.713 2.304 -1.768 1.00 . A A . 13 VAL HG23 1 1 8 2793 1 1 14 VAL N N 2.155 0.609 -3.815 1.00 . A A . 13 VAL N 1 1 8 2794 1 1 14 VAL O O 1.092 -1.521 -1.105 1.00 . A A . 13 VAL O 1 1 8 2795 1 1 15 ASN C C -1.560 -2.075 -2.020 1.00 . A A . 14 ASN C 1 1 8 2796 1 1 15 ASN CA C -0.586 -2.320 -3.167 1.00 . A A . 14 ASN CA 1 1 8 2797 1 1 15 ASN CB C 0.085 -3.687 -3.004 1.00 . A A . 14 ASN CB 1 1 8 2798 1 1 15 ASN CG C 1.018 -4.013 -4.153 1.00 . A A . 14 ASN CG 1 1 8 2799 1 1 15 ASN H H 0.550 -0.781 -4.073 1.00 . A A . 14 ASN H 1 1 8 2800 1 1 15 ASN HA H -1.135 -2.309 -4.094 1.00 . A A . 14 ASN HA 1 1 8 2801 1 1 15 ASN HB2 H 0.658 -3.692 -2.088 1.00 . A A . 14 ASN HB2 1 1 8 2802 1 1 15 ASN HB3 H -0.675 -4.450 -2.953 1.00 . A A . 14 ASN HB3 1 1 8 2803 1 1 15 ASN HD21 H 2.906 -3.826 -4.747 1.00 . A A . 14 ASN HD21 1 1 8 2804 1 1 15 ASN HD22 H 2.537 -3.159 -3.197 1.00 . A A . 14 ASN HD22 1 1 8 2805 1 1 15 ASN N N 0.417 -1.264 -3.233 1.00 . A A . 14 ASN N 1 1 8 2806 1 1 15 ASN ND2 N 2.281 -3.627 -4.019 1.00 . A A . 14 ASN ND2 1 1 8 2807 1 1 15 ASN O O -1.344 -2.535 -0.898 1.00 . A A . 14 ASN O 1 1 8 2808 1 1 15 ASN OD1 O 0.608 -4.607 -5.151 1.00 . A A . 14 ASN OD1 1 1 8 2809 1 1 16 ARG C C -4.841 -1.962 -1.422 1.00 . A A . 15 ARG C 1 1 8 2810 1 1 16 ARG CA C -3.638 -1.031 -1.300 1.00 . A A . 15 ARG CA 1 1 8 2811 1 1 16 ARG CB C -4.090 0.425 -1.433 1.00 . A A . 15 ARG CB 1 1 8 2812 1 1 16 ARG CD C -3.462 2.858 -1.410 1.00 . A A . 15 ARG CD 1 1 8 2813 1 1 16 ARG CG C -2.963 1.429 -1.262 1.00 . A A . 15 ARG CG 1 1 8 2814 1 1 16 ARG CZ C -4.567 4.267 -3.097 1.00 . A A . 15 ARG CZ 1 1 8 2815 1 1 16 ARG H H -2.748 -1.003 -3.219 1.00 . A A . 15 ARG H 1 1 8 2816 1 1 16 ARG HA H -3.188 -1.170 -0.328 1.00 . A A . 15 ARG HA 1 1 8 2817 1 1 16 ARG HB2 H -4.525 0.566 -2.412 1.00 . A A . 15 ARG HB2 1 1 8 2818 1 1 16 ARG HB3 H -4.840 0.627 -0.683 1.00 . A A . 15 ARG HB3 1 1 8 2819 1 1 16 ARG HD2 H -4.204 3.046 -0.648 1.00 . A A . 15 ARG HD2 1 1 8 2820 1 1 16 ARG HD3 H -2.629 3.532 -1.274 1.00 . A A . 15 ARG HD3 1 1 8 2821 1 1 16 ARG HE H -4.078 2.349 -3.353 1.00 . A A . 15 ARG HE 1 1 8 2822 1 1 16 ARG HG2 H -2.532 1.309 -0.280 1.00 . A A . 15 ARG HG2 1 1 8 2823 1 1 16 ARG HG3 H -2.210 1.243 -2.014 1.00 . A A . 15 ARG HG3 1 1 8 2824 1 1 16 ARG HH11 H -4.161 5.200 -1.351 1.00 . A A . 15 ARG HH11 1 1 8 2825 1 1 16 ARG HH12 H -4.939 6.177 -2.551 1.00 . A A . 15 ARG HH12 1 1 8 2826 1 1 16 ARG HH21 H -5.103 3.628 -4.939 1.00 . A A . 15 ARG HH21 1 1 8 2827 1 1 16 ARG HH22 H -5.474 5.283 -4.590 1.00 . A A . 15 ARG HH22 1 1 8 2828 1 1 16 ARG N N -2.632 -1.342 -2.307 1.00 . A A . 15 ARG N 1 1 8 2829 1 1 16 ARG NE N -4.057 3.098 -2.721 1.00 . A A . 15 ARG NE 1 1 8 2830 1 1 16 ARG NH1 N -4.554 5.299 -2.266 1.00 . A A . 15 ARG NH1 1 1 8 2831 1 1 16 ARG NH2 N -5.091 4.404 -4.308 1.00 . A A . 15 ARG NH2 1 1 8 2832 1 1 16 ARG O O -5.164 -2.701 -0.491 1.00 . A A . 15 ARG O 1 1 8 2833 1 1 17 HIS C C -6.260 -4.122 -3.363 1.00 . A A . 16 HIS C 1 1 8 2834 1 1 17 HIS CA C -6.670 -2.756 -2.820 1.00 . A A . 16 HIS CA 1 1 8 2835 1 1 17 HIS CB C -7.620 -2.066 -3.801 1.00 . A A . 16 HIS CB 1 1 8 2836 1 1 17 HIS CD2 C -6.832 -2.502 -6.235 1.00 . A A . 16 HIS CD2 1 1 8 2837 1 1 17 HIS CE1 C -5.960 -0.533 -6.647 1.00 . A A . 16 HIS CE1 1 1 8 2838 1 1 17 HIS CG C -6.990 -1.747 -5.122 1.00 . A A . 16 HIS CG 1 1 8 2839 1 1 17 HIS H H -5.193 -1.310 -3.279 1.00 . A A . 16 HIS H 1 1 8 2840 1 1 17 HIS HA H -7.180 -2.895 -1.879 1.00 . A A . 16 HIS HA 1 1 8 2841 1 1 17 HIS HB2 H -8.467 -2.710 -3.985 1.00 . A A . 16 HIS HB2 1 1 8 2842 1 1 17 HIS HB3 H -7.965 -1.140 -3.366 1.00 . A A . 16 HIS HB3 1 1 8 2843 1 1 17 HIS HD1 H -6.391 0.250 -4.806 1.00 . A A . 16 HIS HD1 1 1 8 2844 1 1 17 HIS HD2 H -7.153 -3.527 -6.365 1.00 . A A . 16 HIS HD2 1 1 8 2845 1 1 17 HIS HE1 H -5.469 0.290 -7.146 1.00 . A A . 16 HIS HE1 1 1 8 2846 1 1 17 HIS HE2 H -5.940 -2.007 -8.071 1.00 . A A . 16 HIS HE2 1 1 8 2847 1 1 17 HIS N N -5.500 -1.919 -2.576 1.00 . A A . 16 HIS N 1 1 8 2848 1 1 17 HIS ND1 N -6.432 -0.518 -5.413 1.00 . A A . 16 HIS ND1 1 1 8 2849 1 1 17 HIS NE2 N -6.190 -1.725 -7.166 1.00 . A A . 16 HIS NE2 1 1 8 2850 1 1 17 HIS O O -7.099 -4.886 -3.841 1.00 . A A . 16 HIS O 1 1 8 2851 1 1 18 SER C C -5.095 -6.865 -3.028 1.00 . A A . 17 SER C 1 1 8 2852 1 1 18 SER CA C -4.448 -5.697 -3.767 1.00 . A A . 17 SER CA 1 1 8 2853 1 1 18 SER CB C -2.929 -5.750 -3.596 1.00 . A A . 17 SER CB 1 1 8 2854 1 1 18 SER H H -4.349 -3.772 -2.892 1.00 . A A . 17 SER H 1 1 8 2855 1 1 18 SER HA H -4.686 -5.775 -4.818 1.00 . A A . 17 SER HA 1 1 8 2856 1 1 18 SER HB2 H -2.561 -6.698 -3.959 1.00 . A A . 17 SER HB2 1 1 8 2857 1 1 18 SER HB3 H -2.477 -4.948 -4.161 1.00 . A A . 17 SER HB3 1 1 8 2858 1 1 18 SER HG H -3.290 -5.213 -1.746 1.00 . A A . 17 SER HG 1 1 8 2859 1 1 18 SER N N -4.968 -4.423 -3.284 1.00 . A A . 17 SER N 1 1 8 2860 1 1 18 SER O O -5.156 -6.874 -1.799 1.00 . A A . 17 SER O 1 1 8 2861 1 1 18 SER OG O -2.564 -5.610 -2.235 1.00 . A A . 17 SER OG 1 1 8 2862 1 1 19 THR C C -7.451 -8.631 -2.398 1.00 . A A . 18 THR C 1 1 8 2863 1 1 19 THR CA C -6.222 -9.021 -3.214 1.00 . A A . 18 THR CA 1 1 8 2864 1 1 19 THR CB C -5.253 -9.817 -2.319 1.00 . A A . 18 THR CB 1 1 8 2865 1 1 19 THR CG2 C -5.922 -11.070 -1.773 1.00 . A A . 18 THR CG2 1 1 8 2866 1 1 19 THR H H -5.495 -7.774 -4.764 1.00 . A A . 18 THR H 1 1 8 2867 1 1 19 THR HA H -6.532 -9.660 -4.029 1.00 . A A . 18 THR HA 1 1 8 2868 1 1 19 THR HB H -4.958 -9.193 -1.487 1.00 . A A . 18 THR HB 1 1 8 2869 1 1 19 THR HG1 H -4.185 -9.898 -3.976 1.00 . A A . 18 THR HG1 1 1 8 2870 1 1 19 THR HG21 H -6.780 -10.790 -1.180 1.00 . A A . 18 THR HG21 1 1 8 2871 1 1 19 THR HG22 H -5.221 -11.613 -1.157 1.00 . A A . 18 THR HG22 1 1 8 2872 1 1 19 THR HG23 H -6.240 -11.695 -2.594 1.00 . A A . 18 THR HG23 1 1 8 2873 1 1 19 THR N N -5.576 -7.844 -3.789 1.00 . A A . 18 THR N 1 1 8 2874 1 1 19 THR O O -7.338 -8.220 -1.243 1.00 . A A . 18 THR O 1 1 8 2875 1 1 19 THR OG1 O -4.085 -10.183 -3.064 1.00 . A A . 18 THR OG1 1 1 8 2876 1 1 20 ALA C C -10.480 -9.647 -1.657 1.00 . A A . 19 ALA C 1 1 8 2877 1 1 20 ALA CA C -9.876 -8.426 -2.341 1.00 . A A . 19 ALA CA 1 1 8 2878 1 1 20 ALA CB C -10.862 -7.835 -3.337 1.00 . A A . 19 ALA CB 1 1 8 2879 1 1 20 ALA H H -8.650 -9.095 -3.931 1.00 . A A . 19 ALA H 1 1 8 2880 1 1 20 ALA HA H -9.663 -7.675 -1.594 1.00 . A A . 19 ALA HA 1 1 8 2881 1 1 20 ALA HB1 H -11.764 -7.540 -2.820 1.00 . A A . 19 ALA HB1 1 1 8 2882 1 1 20 ALA HB2 H -11.104 -8.576 -4.087 1.00 . A A . 19 ALA HB2 1 1 8 2883 1 1 20 ALA HB3 H -10.421 -6.973 -3.813 1.00 . A A . 19 ALA HB3 1 1 8 2884 1 1 20 ALA N N -8.625 -8.763 -3.009 1.00 . A A . 19 ALA N 1 1 8 2885 1 1 20 ALA O O -10.147 -10.785 -1.988 1.00 . A A . 19 ALA O 1 1 8 2886 1 1 21 ILE C C -13.259 -10.976 -0.707 1.00 . A A . 20 ILE C 1 1 8 2887 1 1 21 ILE CA C -12.021 -10.481 0.034 1.00 . A A . 20 ILE CA 1 1 8 2888 1 1 21 ILE CB C -12.427 -10.032 1.452 1.00 . A A . 20 ILE CB 1 1 8 2889 1 1 21 ILE CD1 C -10.093 -10.483 2.387 1.00 . A A . 20 ILE CD1 1 1 8 2890 1 1 21 ILE CG1 C -11.214 -9.480 2.208 1.00 . A A . 20 ILE CG1 1 1 8 2891 1 1 21 ILE CG2 C -13.057 -11.188 2.218 1.00 . A A . 20 ILE CG2 1 1 8 2892 1 1 21 ILE H H -11.592 -8.474 -0.480 1.00 . A A . 20 ILE H 1 1 8 2893 1 1 21 ILE HA H -11.317 -11.296 0.124 1.00 . A A . 20 ILE HA 1 1 8 2894 1 1 21 ILE HB H -13.167 -9.251 1.358 1.00 . A A . 20 ILE HB 1 1 8 2895 1 1 21 ILE HD11 H -10.458 -11.336 2.941 1.00 . A A . 20 ILE HD11 1 1 8 2896 1 1 21 ILE HD12 H -9.281 -10.022 2.929 1.00 . A A . 20 ILE HD12 1 1 8 2897 1 1 21 ILE HD13 H -9.742 -10.807 1.419 1.00 . A A . 20 ILE HD13 1 1 8 2898 1 1 21 ILE HG12 H -10.816 -8.634 1.667 1.00 . A A . 20 ILE HG12 1 1 8 2899 1 1 21 ILE HG13 H -11.527 -9.157 3.190 1.00 . A A . 20 ILE HG13 1 1 8 2900 1 1 21 ILE HG21 H -13.945 -11.520 1.700 1.00 . A A . 20 ILE HG21 1 1 8 2901 1 1 21 ILE HG22 H -13.322 -10.860 3.212 1.00 . A A . 20 ILE HG22 1 1 8 2902 1 1 21 ILE HG23 H -12.352 -12.003 2.284 1.00 . A A . 20 ILE HG23 1 1 8 2903 1 1 21 ILE N N -11.369 -9.402 -0.699 1.00 . A A . 20 ILE N 1 1 8 2904 1 1 21 ILE O O -14.086 -10.181 -1.153 1.00 . A A . 20 ILE O 1 1 8 2905 1 1 22 GLY C C -14.279 -14.311 -1.932 1.00 . A A . 21 GLY C 1 1 8 2906 1 1 22 GLY CA C -14.520 -12.873 -1.519 1.00 . A A . 21 GLY CA 1 1 8 2907 1 1 22 GLY H H -12.689 -12.878 -0.455 1.00 . A A . 21 GLY H 1 1 8 2908 1 1 22 GLY HA2 H -15.377 -12.837 -0.863 1.00 . A A . 21 GLY HA2 1 1 8 2909 1 1 22 GLY HA3 H -14.729 -12.287 -2.402 1.00 . A A . 21 GLY HA3 1 1 8 2910 1 1 22 GLY N N -13.380 -12.294 -0.832 1.00 . A A . 21 GLY N 1 1 8 2911 1 1 22 GLY O O -13.469 -15.012 -1.324 1.00 . A A . 21 GLY O 1 1 8 2912 1 1 23 ARG C C -13.901 -16.168 -4.663 1.00 . A A . 22 ARG C 1 1 8 2913 1 1 23 ARG CA C -14.843 -16.118 -3.464 1.00 . A A . 22 ARG CA 1 1 8 2914 1 1 23 ARG CB C -16.212 -16.687 -3.847 1.00 . A A . 22 ARG CB 1 1 8 2915 1 1 23 ARG CD C -15.701 -19.065 -3.204 1.00 . A A . 22 ARG CD 1 1 8 2916 1 1 23 ARG CG C -16.166 -18.135 -4.313 1.00 . A A . 22 ARG CG 1 1 8 2917 1 1 23 ARG CZ C -16.307 -19.605 -0.880 1.00 . A A . 22 ARG CZ 1 1 8 2918 1 1 23 ARG H H -15.613 -14.147 -3.412 1.00 . A A . 22 ARG H 1 1 8 2919 1 1 23 ARG HA H -14.426 -16.718 -2.668 1.00 . A A . 22 ARG HA 1 1 8 2920 1 1 23 ARG HB2 H -16.867 -16.629 -2.990 1.00 . A A . 22 ARG HB2 1 1 8 2921 1 1 23 ARG HB3 H -16.626 -16.089 -4.646 1.00 . A A . 22 ARG HB3 1 1 8 2922 1 1 23 ARG HD2 H -15.692 -20.078 -3.580 1.00 . A A . 22 ARG HD2 1 1 8 2923 1 1 23 ARG HD3 H -14.701 -18.782 -2.909 1.00 . A A . 22 ARG HD3 1 1 8 2924 1 1 23 ARG HE H -17.402 -18.485 -2.115 1.00 . A A . 22 ARG HE 1 1 8 2925 1 1 23 ARG HG2 H -17.155 -18.433 -4.628 1.00 . A A . 22 ARG HG2 1 1 8 2926 1 1 23 ARG HG3 H -15.481 -18.213 -5.144 1.00 . A A . 22 ARG HG3 1 1 8 2927 1 1 23 ARG HH11 H -14.554 -20.395 -1.503 1.00 . A A . 22 ARG HH11 1 1 8 2928 1 1 23 ARG HH12 H -14.995 -20.766 0.130 1.00 . A A . 22 ARG HH12 1 1 8 2929 1 1 23 ARG HH21 H -16.949 -19.954 1.004 1.00 . A A . 22 ARG HH21 1 1 8 2930 1 1 23 ARG HH22 H -17.993 -18.967 0.034 1.00 . A A . 22 ARG HH22 1 1 8 2931 1 1 23 ARG N N -14.984 -14.754 -2.969 1.00 . A A . 22 ARG N 1 1 8 2932 1 1 23 ARG NE N -16.575 -19.002 -2.035 1.00 . A A . 22 ARG NE 1 1 8 2933 1 1 23 ARG NH1 N -15.194 -20.313 -0.739 1.00 . A A . 22 ARG NH1 1 1 8 2934 1 1 23 ARG NH2 N -17.152 -19.500 0.136 1.00 . A A . 22 ARG NH2 1 1 8 2935 1 1 23 ARG O O -12.689 -16.382 -4.453 1.00 . A A . 22 ARG O 1 1 8 2936 1 1 23 ARG OXT O -14.384 -15.992 -5.801 1.00 . A A . 22 ARG OXT 1 1 9 2937 1 1 1 ACE C C 2.866 0.895 10.936 1.00 . A A . 0 ACE C 1 1 9 2938 1 1 1 ACE CH3 C 3.027 0.040 12.163 1.00 . A A . 0 ACE CH3 1 1 9 2939 1 1 1 ACE H1 H 3.776 0.491 12.806 1.00 . A A . 0 ACE H1 1 1 9 2940 1 1 1 ACE H2 H 3.349 -0.943 11.875 1.00 . A A . 0 ACE H2 1 1 9 2941 1 1 1 ACE H3 H 2.068 -0.027 12.668 1.00 . A A . 0 ACE H3 1 1 9 2942 1 1 1 ACE O O 1.765 1.033 10.403 1.00 . A A . 0 ACE O 1 1 9 2943 1 1 2 MET C C 4.343 1.546 8.050 1.00 . A A . 1 MET C 1 1 9 2944 1 1 2 MET CA C 3.952 2.333 9.298 1.00 . A A . 1 MET CA 1 1 9 2945 1 1 2 MET CB C 4.898 3.522 9.489 1.00 . A A . 1 MET CB 1 1 9 2946 1 1 2 MET CE C 8.963 3.727 10.422 1.00 . A A . 1 MET CE 1 1 9 2947 1 1 2 MET CG C 6.334 3.122 9.787 1.00 . A A . 1 MET CG 1 1 9 2948 1 1 2 MET H H 4.817 1.330 10.949 1.00 . A A . 1 MET H 1 1 9 2949 1 1 2 MET HA H 2.944 2.703 9.174 1.00 . A A . 1 MET HA 1 1 9 2950 1 1 2 MET HB2 H 4.894 4.118 8.590 1.00 . A A . 1 MET HB2 1 1 9 2951 1 1 2 MET HB3 H 4.538 4.125 10.310 1.00 . A A . 1 MET HB3 1 1 9 2952 1 1 2 MET HE1 H 9.260 3.178 9.541 1.00 . A A . 1 MET HE1 1 1 9 2953 1 1 2 MET HE2 H 8.860 3.046 11.254 1.00 . A A . 1 MET HE2 1 1 9 2954 1 1 2 MET HE3 H 9.714 4.468 10.655 1.00 . A A . 1 MET HE3 1 1 9 2955 1 1 2 MET HG2 H 6.342 2.476 10.652 1.00 . A A . 1 MET HG2 1 1 9 2956 1 1 2 MET HG3 H 6.728 2.587 8.935 1.00 . A A . 1 MET HG3 1 1 9 2957 1 1 2 MET N N 3.970 1.478 10.480 1.00 . A A . 1 MET N 1 1 9 2958 1 1 2 MET O O 5.406 0.927 8.003 1.00 . A A . 1 MET O 1 1 9 2959 1 1 2 MET SD S 7.397 4.540 10.118 1.00 . A A . 1 MET SD 1 1 9 2960 1 1 3 ASN C C 3.737 1.817 4.612 1.00 . A A . 2 ASN C 1 1 9 2961 1 1 3 ASN CA C 3.736 0.858 5.797 1.00 . A A . 2 ASN CA 1 1 9 2962 1 1 3 ASN CB C 2.693 -0.239 5.570 1.00 . A A . 2 ASN CB 1 1 9 2963 1 1 3 ASN CG C 3.107 -1.214 4.480 1.00 . A A . 2 ASN CG 1 1 9 2964 1 1 3 ASN H H 2.642 2.076 7.140 1.00 . A A . 2 ASN H 1 1 9 2965 1 1 3 ASN HA H 4.712 0.403 5.875 1.00 . A A . 2 ASN HA 1 1 9 2966 1 1 3 ASN HB2 H 2.554 -0.790 6.488 1.00 . A A . 2 ASN HB2 1 1 9 2967 1 1 3 ASN HB3 H 1.757 0.217 5.283 1.00 . A A . 2 ASN HB3 1 1 9 2968 1 1 3 ASN HD21 H 2.392 0.000 3.073 1.00 . A A . 2 ASN HD21 1 1 9 2969 1 1 3 ASN HD22 H 3.098 -1.470 2.506 1.00 . A A . 2 ASN HD22 1 1 9 2970 1 1 3 ASN N N 3.475 1.570 7.043 1.00 . A A . 2 ASN N 1 1 9 2971 1 1 3 ASN ND2 N 2.837 -0.860 3.227 1.00 . A A . 2 ASN ND2 1 1 9 2972 1 1 3 ASN O O 3.820 1.388 3.461 1.00 . A A . 2 ASN O 1 1 9 2973 1 1 3 ASN OD1 O 3.671 -2.271 4.762 1.00 . A A . 2 ASN OD1 1 1 9 2974 1 1 4 TRP C C 4.795 3.882 2.873 1.00 . A A . 3 TRP C 1 1 9 2975 1 1 4 TRP CA C 3.643 4.110 3.826 1.00 . A A . 3 TRP CA 1 1 9 2976 1 1 4 TRP CB C 3.754 5.520 4.381 1.00 . A A . 3 TRP CB 1 1 9 2977 1 1 4 TRP CD1 C 5.102 5.559 6.540 1.00 . A A . 3 TRP CD1 1 1 9 2978 1 1 4 TRP CD2 C 6.269 6.125 4.728 1.00 . A A . 3 TRP CD2 1 1 9 2979 1 1 4 TRP CE2 C 7.116 6.207 5.844 1.00 . A A . 3 TRP CE2 1 1 9 2980 1 1 4 TRP CE3 C 6.781 6.428 3.471 1.00 . A A . 3 TRP CE3 1 1 9 2981 1 1 4 TRP CG C 4.983 5.726 5.201 1.00 . A A . 3 TRP CG 1 1 9 2982 1 1 4 TRP CH2 C 8.929 6.874 4.489 1.00 . A A . 3 TRP CH2 1 1 9 2983 1 1 4 TRP CZ2 C 8.449 6.582 5.735 1.00 . A A . 3 TRP CZ2 1 1 9 2984 1 1 4 TRP CZ3 C 8.107 6.798 3.360 1.00 . A A . 3 TRP CZ3 1 1 9 2985 1 1 4 TRP H H 3.598 3.407 5.823 1.00 . A A . 3 TRP H 1 1 9 2986 1 1 4 TRP HA H 2.715 4.016 3.288 1.00 . A A . 3 TRP HA 1 1 9 2987 1 1 4 TRP HB2 H 3.788 6.219 3.554 1.00 . A A . 3 TRP HB2 1 1 9 2988 1 1 4 TRP HB3 H 2.895 5.732 4.999 1.00 . A A . 3 TRP HB3 1 1 9 2989 1 1 4 TRP HD1 H 4.297 5.245 7.176 1.00 . A A . 3 TRP HD1 1 1 9 2990 1 1 4 TRP HE1 H 6.710 5.824 7.866 1.00 . A A . 3 TRP HE1 1 1 9 2991 1 1 4 TRP HE3 H 6.158 6.370 2.591 1.00 . A A . 3 TRP HE3 1 1 9 2992 1 1 4 TRP HH2 H 9.960 7.169 4.361 1.00 . A A . 3 TRP HH2 1 1 9 2993 1 1 4 TRP HZ2 H 9.088 6.648 6.594 1.00 . A A . 3 TRP HZ2 1 1 9 2994 1 1 4 TRP HZ3 H 8.521 7.037 2.392 1.00 . A A . 3 TRP HZ3 1 1 9 2995 1 1 4 TRP N N 3.650 3.115 4.890 1.00 . A A . 3 TRP N 1 1 9 2996 1 1 4 TRP NE1 N 6.380 5.858 6.943 1.00 . A A . 3 TRP NE1 1 1 9 2997 1 1 4 TRP O O 4.761 4.353 1.738 1.00 . A A . 3 TRP O 1 1 9 2998 1 1 5 THR C C 6.601 2.641 1.104 1.00 . A A . 4 THR C 1 1 9 2999 1 1 5 THR CA C 6.997 2.886 2.553 1.00 . A A . 4 THR CA 1 1 9 3000 1 1 5 THR CB C 7.768 1.664 3.081 1.00 . A A . 4 THR CB 1 1 9 3001 1 1 5 THR CG2 C 9.072 1.475 2.321 1.00 . A A . 4 THR CG2 1 1 9 3002 1 1 5 THR H H 5.776 2.838 4.275 1.00 . A A . 4 THR H 1 1 9 3003 1 1 5 THR HA H 7.642 3.750 2.608 1.00 . A A . 4 THR HA 1 1 9 3004 1 1 5 THR HB H 7.157 0.784 2.941 1.00 . A A . 4 THR HB 1 1 9 3005 1 1 5 THR HG1 H 8.546 2.632 4.614 1.00 . A A . 4 THR HG1 1 1 9 3006 1 1 5 THR HG21 H 8.858 1.326 1.272 1.00 . A A . 4 THR HG21 1 1 9 3007 1 1 5 THR HG22 H 9.594 0.612 2.708 1.00 . A A . 4 THR HG22 1 1 9 3008 1 1 5 THR HG23 H 9.690 2.353 2.441 1.00 . A A . 4 THR HG23 1 1 9 3009 1 1 5 THR N N 5.820 3.173 3.355 1.00 . A A . 4 THR N 1 1 9 3010 1 1 5 THR O O 6.331 1.510 0.700 1.00 . A A . 4 THR O 1 1 9 3011 1 1 5 THR OG1 O 8.046 1.824 4.478 1.00 . A A . 4 THR OG1 1 1 9 3012 1 1 6 GLY C C 5.193 4.745 -1.412 1.00 . A A . 5 GLY C 1 1 9 3013 1 1 6 GLY CA C 6.161 3.634 -1.050 1.00 . A A . 5 GLY CA 1 1 9 3014 1 1 6 GLY H H 6.812 4.584 0.717 1.00 . A A . 5 GLY H 1 1 9 3015 1 1 6 GLY HA2 H 7.037 3.706 -1.677 1.00 . A A . 5 GLY HA2 1 1 9 3016 1 1 6 GLY HA3 H 5.681 2.679 -1.216 1.00 . A A . 5 GLY HA3 1 1 9 3017 1 1 6 GLY N N 6.562 3.718 0.335 1.00 . A A . 5 GLY N 1 1 9 3018 1 1 6 GLY O O 4.353 4.588 -2.292 1.00 . A A . 5 GLY O 1 1 9 3019 1 1 7 LEU C C 5.215 8.130 -1.644 1.00 . A A . 6 LEU C 1 1 9 3020 1 1 7 LEU CA C 4.440 7.021 -0.943 1.00 . A A . 6 LEU CA 1 1 9 3021 1 1 7 LEU CB C 3.869 7.516 0.398 1.00 . A A . 6 LEU CB 1 1 9 3022 1 1 7 LEU CD1 C 4.230 8.665 2.607 1.00 . A A . 6 LEU CD1 1 1 9 3023 1 1 7 LEU CD2 C 6.164 8.385 1.076 1.00 . A A . 6 LEU CD2 1 1 9 3024 1 1 7 LEU CG C 4.661 8.610 1.149 1.00 . A A . 6 LEU CG 1 1 9 3025 1 1 7 LEU H H 5.975 5.914 -0.001 1.00 . A A . 6 LEU H 1 1 9 3026 1 1 7 LEU HA H 3.629 6.706 -1.580 1.00 . A A . 6 LEU HA 1 1 9 3027 1 1 7 LEU HB2 H 2.876 7.894 0.214 1.00 . A A . 6 LEU HB2 1 1 9 3028 1 1 7 LEU HB3 H 3.788 6.662 1.052 1.00 . A A . 6 LEU HB3 1 1 9 3029 1 1 7 LEU HD11 H 4.631 7.807 3.132 1.00 . A A . 6 LEU HD11 1 1 9 3030 1 1 7 LEU HD12 H 3.153 8.653 2.667 1.00 . A A . 6 LEU HD12 1 1 9 3031 1 1 7 LEU HD13 H 4.608 9.569 3.061 1.00 . A A . 6 LEU HD13 1 1 9 3032 1 1 7 LEU HD21 H 6.368 7.325 1.044 1.00 . A A . 6 LEU HD21 1 1 9 3033 1 1 7 LEU HD22 H 6.635 8.812 1.952 1.00 . A A . 6 LEU HD22 1 1 9 3034 1 1 7 LEU HD23 H 6.559 8.857 0.190 1.00 . A A . 6 LEU HD23 1 1 9 3035 1 1 7 LEU HG H 4.447 9.570 0.703 1.00 . A A . 6 LEU HG 1 1 9 3036 1 1 7 LEU N N 5.303 5.866 -0.708 1.00 . A A . 6 LEU N 1 1 9 3037 1 1 7 LEU O O 4.773 9.277 -1.708 1.00 . A A . 6 LEU O 1 1 9 3038 1 1 8 TYR C C 7.694 8.238 -4.226 1.00 . A A . 7 TYR C 1 1 9 3039 1 1 8 TYR CA C 7.249 8.712 -2.842 1.00 . A A . 7 TYR CA 1 1 9 3040 1 1 8 TYR CB C 8.472 8.974 -1.960 1.00 . A A . 7 TYR CB 1 1 9 3041 1 1 8 TYR CD1 C 8.403 6.785 -0.722 1.00 . A A . 7 TYR CD1 1 1 9 3042 1 1 8 TYR CD2 C 10.462 7.429 -1.725 1.00 . A A . 7 TYR CD2 1 1 9 3043 1 1 8 TYR CE1 C 8.970 5.627 -0.273 1.00 . A A . 7 TYR CE1 1 1 9 3044 1 1 8 TYR CE2 C 11.048 6.261 -1.271 1.00 . A A . 7 TYR CE2 1 1 9 3045 1 1 8 TYR CG C 9.129 7.709 -1.455 1.00 . A A . 7 TYR CG 1 1 9 3046 1 1 8 TYR CZ C 10.296 5.361 -0.545 1.00 . A A . 7 TYR CZ 1 1 9 3047 1 1 8 TYR H H 6.636 6.825 -2.122 1.00 . A A . 7 TYR H 1 1 9 3048 1 1 8 TYR HA H 6.703 9.623 -2.948 1.00 . A A . 7 TYR HA 1 1 9 3049 1 1 8 TYR HB2 H 9.205 9.528 -2.525 1.00 . A A . 7 TYR HB2 1 1 9 3050 1 1 8 TYR HB3 H 8.169 9.553 -1.103 1.00 . A A . 7 TYR HB3 1 1 9 3051 1 1 8 TYR HD1 H 7.364 6.986 -0.499 1.00 . A A . 7 TYR HD1 1 1 9 3052 1 1 8 TYR HD2 H 11.045 8.139 -2.294 1.00 . A A . 7 TYR HD2 1 1 9 3053 1 1 8 TYR HE1 H 8.369 4.935 0.283 1.00 . A A . 7 TYR HE1 1 1 9 3054 1 1 8 TYR HE2 H 12.087 6.058 -1.486 1.00 . A A . 7 TYR HE2 1 1 9 3055 1 1 8 TYR HH H 10.271 3.461 -0.254 1.00 . A A . 7 TYR HH 1 1 9 3056 1 1 8 TYR N N 6.369 7.762 -2.179 1.00 . A A . 7 TYR N 1 1 9 3057 1 1 8 TYR O O 7.484 8.931 -5.223 1.00 . A A . 7 TYR O 1 1 9 3058 1 1 8 TYR OH O 10.869 4.195 -0.093 1.00 . A A . 7 TYR OH 1 1 9 3059 1 1 9 THR C C 8.020 5.284 -5.984 1.00 . A A . 8 THR C 1 1 9 3060 1 1 9 THR CA C 8.798 6.518 -5.555 1.00 . A A . 8 THR CA 1 1 9 3061 1 1 9 THR CB C 10.282 6.133 -5.453 1.00 . A A . 8 THR CB 1 1 9 3062 1 1 9 THR CG2 C 11.145 7.353 -5.165 1.00 . A A . 8 THR CG2 1 1 9 3063 1 1 9 THR H H 8.437 6.543 -3.465 1.00 . A A . 8 THR H 1 1 9 3064 1 1 9 THR HA H 8.695 7.281 -6.309 1.00 . A A . 8 THR HA 1 1 9 3065 1 1 9 THR HB H 10.591 5.703 -6.395 1.00 . A A . 8 THR HB 1 1 9 3066 1 1 9 THR HG1 H 9.649 4.637 -4.337 1.00 . A A . 8 THR HG1 1 1 9 3067 1 1 9 THR HG21 H 10.804 7.828 -4.258 1.00 . A A . 8 THR HG21 1 1 9 3068 1 1 9 THR HG22 H 11.069 8.049 -5.988 1.00 . A A . 8 THR HG22 1 1 9 3069 1 1 9 THR HG23 H 12.173 7.046 -5.047 1.00 . A A . 8 THR HG23 1 1 9 3070 1 1 9 THR N N 8.309 7.060 -4.288 1.00 . A A . 8 THR N 1 1 9 3071 1 1 9 THR O O 8.492 4.501 -6.809 1.00 . A A . 8 THR O 1 1 9 3072 1 1 9 THR OG1 O 10.453 5.158 -4.419 1.00 . A A . 8 THR OG1 1 1 9 3073 1 1 10 LEU C C 4.541 4.318 -5.863 1.00 . A A . 9 LEU C 1 1 9 3074 1 1 10 LEU CA C 6.011 3.954 -5.770 1.00 . A A . 9 LEU CA 1 1 9 3075 1 1 10 LEU CB C 6.223 2.854 -4.732 1.00 . A A . 9 LEU CB 1 1 9 3076 1 1 10 LEU CD1 C 7.845 1.466 -3.424 1.00 . A A . 9 LEU CD1 1 1 9 3077 1 1 10 LEU CD2 C 7.959 1.486 -5.919 1.00 . A A . 9 LEU CD2 1 1 9 3078 1 1 10 LEU CG C 7.649 2.302 -4.674 1.00 . A A . 9 LEU CG 1 1 9 3079 1 1 10 LEU H H 6.492 5.774 -4.798 1.00 . A A . 9 LEU H 1 1 9 3080 1 1 10 LEU HA H 6.332 3.593 -6.720 1.00 . A A . 9 LEU HA 1 1 9 3081 1 1 10 LEU HB2 H 5.972 3.251 -3.759 1.00 . A A . 9 LEU HB2 1 1 9 3082 1 1 10 LEU HB3 H 5.550 2.039 -4.955 1.00 . A A . 9 LEU HB3 1 1 9 3083 1 1 10 LEU HD11 H 7.703 2.087 -2.553 1.00 . A A . 9 LEU HD11 1 1 9 3084 1 1 10 LEU HD12 H 8.845 1.060 -3.418 1.00 . A A . 9 LEU HD12 1 1 9 3085 1 1 10 LEU HD13 H 7.127 0.661 -3.414 1.00 . A A . 9 LEU HD13 1 1 9 3086 1 1 10 LEU HD21 H 8.955 1.074 -5.841 1.00 . A A . 9 LEU HD21 1 1 9 3087 1 1 10 LEU HD22 H 7.902 2.122 -6.790 1.00 . A A . 9 LEU HD22 1 1 9 3088 1 1 10 LEU HD23 H 7.243 0.683 -6.011 1.00 . A A . 9 LEU HD23 1 1 9 3089 1 1 10 LEU HG H 8.344 3.127 -4.634 1.00 . A A . 9 LEU HG 1 1 9 3090 1 1 10 LEU N N 6.828 5.112 -5.435 1.00 . A A . 9 LEU N 1 1 9 3091 1 1 10 LEU O O 3.909 4.133 -6.901 1.00 . A A . 9 LEU O 1 1 9 3092 1 1 11 LEU C C 1.692 4.246 -5.318 1.00 . A A . 10 LEU C 1 1 9 3093 1 1 11 LEU CA C 2.631 5.265 -4.670 1.00 . A A . 10 LEU CA 1 1 9 3094 1 1 11 LEU CB C 2.438 6.646 -5.290 1.00 . A A . 10 LEU CB 1 1 9 3095 1 1 11 LEU CD1 C 4.711 7.582 -4.770 1.00 . A A . 10 LEU CD1 1 1 9 3096 1 1 11 LEU CD2 C 2.771 9.126 -5.108 1.00 . A A . 10 LEU CD2 1 1 9 3097 1 1 11 LEU CG C 3.212 7.766 -4.589 1.00 . A A . 10 LEU CG 1 1 9 3098 1 1 11 LEU H H 4.632 5.036 -4.026 1.00 . A A . 10 LEU H 1 1 9 3099 1 1 11 LEU HA H 2.391 5.325 -3.620 1.00 . A A . 10 LEU HA 1 1 9 3100 1 1 11 LEU HB2 H 2.756 6.605 -6.321 1.00 . A A . 10 LEU HB2 1 1 9 3101 1 1 11 LEU HB3 H 1.386 6.888 -5.262 1.00 . A A . 10 LEU HB3 1 1 9 3102 1 1 11 LEU HD11 H 5.215 8.517 -4.575 1.00 . A A . 10 LEU HD11 1 1 9 3103 1 1 11 LEU HD12 H 4.918 7.265 -5.781 1.00 . A A . 10 LEU HD12 1 1 9 3104 1 1 11 LEU HD13 H 5.071 6.830 -4.076 1.00 . A A . 10 LEU HD13 1 1 9 3105 1 1 11 LEU HD21 H 2.962 9.185 -6.169 1.00 . A A . 10 LEU HD21 1 1 9 3106 1 1 11 LEU HD22 H 3.324 9.902 -4.599 1.00 . A A . 10 LEU HD22 1 1 9 3107 1 1 11 LEU HD23 H 1.715 9.256 -4.924 1.00 . A A . 10 LEU HD23 1 1 9 3108 1 1 11 LEU HG H 3.003 7.724 -3.532 1.00 . A A . 10 LEU HG 1 1 9 3109 1 1 11 LEU N N 4.032 4.862 -4.776 1.00 . A A . 10 LEU N 1 1 9 3110 1 1 11 LEU O O 1.182 3.350 -4.647 1.00 . A A . 10 LEU O 1 1 9 3111 1 1 12 SER C C 1.196 2.077 -7.424 1.00 . A A . 11 SER C 1 1 9 3112 1 1 12 SER CA C 0.592 3.479 -7.352 1.00 . A A . 11 SER CA 1 1 9 3113 1 1 12 SER CB C 0.335 4.009 -8.765 1.00 . A A . 11 SER CB 1 1 9 3114 1 1 12 SER H H 1.900 5.126 -7.102 1.00 . A A . 11 SER H 1 1 9 3115 1 1 12 SER HA H -0.347 3.426 -6.822 1.00 . A A . 11 SER HA 1 1 9 3116 1 1 12 SER HB2 H -0.110 4.990 -8.703 1.00 . A A . 11 SER HB2 1 1 9 3117 1 1 12 SER HB3 H 1.273 4.071 -9.298 1.00 . A A . 11 SER HB3 1 1 9 3118 1 1 12 SER HG H -1.212 2.814 -8.885 1.00 . A A . 11 SER HG 1 1 9 3119 1 1 12 SER N N 1.467 4.390 -6.621 1.00 . A A . 11 SER N 1 1 9 3120 1 1 12 SER O O 0.605 1.165 -8.001 1.00 . A A . 11 SER O 1 1 9 3121 1 1 12 SER OG O -0.540 3.154 -9.480 1.00 . A A . 11 SER OG 1 1 9 3122 1 1 13 ARG C C 3.020 0.009 -5.435 1.00 . A A . 12 ARG C 1 1 9 3123 1 1 13 ARG CA C 3.065 0.630 -6.826 1.00 . A A . 12 ARG CA 1 1 9 3124 1 1 13 ARG CB C 4.521 0.807 -7.263 1.00 . A A . 12 ARG CB 1 1 9 3125 1 1 13 ARG CD C 6.153 1.843 -8.867 1.00 . A A . 12 ARG CD 1 1 9 3126 1 1 13 ARG CG C 4.686 1.579 -8.562 1.00 . A A . 12 ARG CG 1 1 9 3127 1 1 13 ARG CZ C 8.209 0.562 -9.300 1.00 . A A . 12 ARG CZ 1 1 9 3128 1 1 13 ARG H H 2.795 2.681 -6.388 1.00 . A A . 12 ARG H 1 1 9 3129 1 1 13 ARG HA H 2.560 -0.022 -7.519 1.00 . A A . 12 ARG HA 1 1 9 3130 1 1 13 ARG HB2 H 5.055 1.335 -6.488 1.00 . A A . 12 ARG HB2 1 1 9 3131 1 1 13 ARG HB3 H 4.966 -0.169 -7.391 1.00 . A A . 12 ARG HB3 1 1 9 3132 1 1 13 ARG HD2 H 6.219 2.444 -9.762 1.00 . A A . 12 ARG HD2 1 1 9 3133 1 1 13 ARG HD3 H 6.589 2.385 -8.039 1.00 . A A . 12 ARG HD3 1 1 9 3134 1 1 13 ARG HE H 6.401 -0.237 -9.030 1.00 . A A . 12 ARG HE 1 1 9 3135 1 1 13 ARG HG2 H 4.257 1.003 -9.370 1.00 . A A . 12 ARG HG2 1 1 9 3136 1 1 13 ARG HG3 H 4.170 2.524 -8.477 1.00 . A A . 12 ARG HG3 1 1 9 3137 1 1 13 ARG HH11 H 8.460 2.567 -9.230 1.00 . A A . 12 ARG HH11 1 1 9 3138 1 1 13 ARG HH12 H 9.897 1.649 -9.534 1.00 . A A . 12 ARG HH12 1 1 9 3139 1 1 13 ARG HH21 H 8.288 -1.453 -9.430 1.00 . A A . 12 ARG HH21 1 1 9 3140 1 1 13 ARG HH22 H 9.799 -0.636 -9.648 1.00 . A A . 12 ARG HH22 1 1 9 3141 1 1 13 ARG N N 2.377 1.917 -6.833 1.00 . A A . 12 ARG N 1 1 9 3142 1 1 13 ARG NE N 6.900 0.606 -9.069 1.00 . A A . 12 ARG NE 1 1 9 3143 1 1 13 ARG NH1 N 8.913 1.685 -9.360 1.00 . A A . 12 ARG NH1 1 1 9 3144 1 1 13 ARG NH2 N 8.815 -0.605 -9.474 1.00 . A A . 12 ARG NH2 1 1 9 3145 1 1 13 ARG O O 3.765 -0.925 -5.135 1.00 . A A . 12 ARG O 1 1 9 3146 1 1 14 VAL C C 0.562 -0.393 -2.951 1.00 . A A . 13 VAL C 1 1 9 3147 1 1 14 VAL CA C 1.992 0.047 -3.230 1.00 . A A . 13 VAL CA 1 1 9 3148 1 1 14 VAL CB C 2.391 1.136 -2.220 1.00 . A A . 13 VAL CB 1 1 9 3149 1 1 14 VAL CG1 C 2.509 0.564 -0.820 1.00 . A A . 13 VAL CG1 1 1 9 3150 1 1 14 VAL CG2 C 3.691 1.796 -2.642 1.00 . A A . 13 VAL CG2 1 1 9 3151 1 1 14 VAL H H 1.565 1.263 -4.898 1.00 . A A . 13 VAL H 1 1 9 3152 1 1 14 VAL HA H 2.654 -0.797 -3.101 1.00 . A A . 13 VAL HA 1 1 9 3153 1 1 14 VAL HB H 1.616 1.888 -2.211 1.00 . A A . 13 VAL HB 1 1 9 3154 1 1 14 VAL HG11 H 3.185 -0.276 -0.832 1.00 . A A . 13 VAL HG11 1 1 9 3155 1 1 14 VAL HG12 H 1.536 0.241 -0.481 1.00 . A A . 13 VAL HG12 1 1 9 3156 1 1 14 VAL HG13 H 2.890 1.326 -0.154 1.00 . A A . 13 VAL HG13 1 1 9 3157 1 1 14 VAL HG21 H 4.456 1.042 -2.758 1.00 . A A . 13 VAL HG21 1 1 9 3158 1 1 14 VAL HG22 H 3.995 2.503 -1.886 1.00 . A A . 13 VAL HG22 1 1 9 3159 1 1 14 VAL HG23 H 3.547 2.310 -3.580 1.00 . A A . 13 VAL HG23 1 1 9 3160 1 1 14 VAL N N 2.136 0.532 -4.594 1.00 . A A . 13 VAL N 1 1 9 3161 1 1 14 VAL O O -0.263 0.397 -2.490 1.00 . A A . 13 VAL O 1 1 9 3162 1 1 15 ASN C C -1.493 -2.016 -1.571 1.00 . A A . 14 ASN C 1 1 9 3163 1 1 15 ASN CA C -1.060 -2.208 -3.022 1.00 . A A . 14 ASN CA 1 1 9 3164 1 1 15 ASN CB C -1.093 -3.694 -3.391 1.00 . A A . 14 ASN CB 1 1 9 3165 1 1 15 ASN CG C 0.196 -4.421 -3.044 1.00 . A A . 14 ASN CG 1 1 9 3166 1 1 15 ASN H H 0.968 -2.229 -3.627 1.00 . A A . 14 ASN H 1 1 9 3167 1 1 15 ASN HA H -1.748 -1.675 -3.661 1.00 . A A . 14 ASN HA 1 1 9 3168 1 1 15 ASN HB2 H -1.904 -4.170 -2.861 1.00 . A A . 14 ASN HB2 1 1 9 3169 1 1 15 ASN HB3 H -1.260 -3.788 -4.454 1.00 . A A . 14 ASN HB3 1 1 9 3170 1 1 15 ASN HD21 H 1.727 -4.403 -1.775 1.00 . A A . 14 ASN HD21 1 1 9 3171 1 1 15 ASN HD22 H 0.547 -3.166 -1.541 1.00 . A A . 14 ASN HD22 1 1 9 3172 1 1 15 ASN N N 0.271 -1.656 -3.246 1.00 . A A . 14 ASN N 1 1 9 3173 1 1 15 ASN ND2 N 0.893 -3.949 -2.016 1.00 . A A . 14 ASN ND2 1 1 9 3174 1 1 15 ASN O O -1.131 -2.800 -0.693 1.00 . A A . 14 ASN O 1 1 9 3175 1 1 15 ASN OD1 O 0.562 -5.397 -3.697 1.00 . A A . 14 ASN OD1 1 1 9 3176 1 1 16 ARG C C -3.471 -1.856 0.626 1.00 . A A . 15 ARG C 1 1 9 3177 1 1 16 ARG CA C -2.750 -0.658 0.014 1.00 . A A . 15 ARG CA 1 1 9 3178 1 1 16 ARG CB C -3.687 0.552 -0.021 1.00 . A A . 15 ARG CB 1 1 9 3179 1 1 16 ARG CD C -5.096 2.188 1.266 1.00 . A A . 15 ARG CD 1 1 9 3180 1 1 16 ARG CG C -4.191 0.971 1.352 1.00 . A A . 15 ARG CG 1 1 9 3181 1 1 16 ARG CZ C -6.317 3.691 2.784 1.00 . A A . 15 ARG CZ 1 1 9 3182 1 1 16 ARG H H -2.525 -0.379 -2.071 1.00 . A A . 15 ARG H 1 1 9 3183 1 1 16 ARG HA H -1.891 -0.419 0.623 1.00 . A A . 15 ARG HA 1 1 9 3184 1 1 16 ARG HB2 H -3.159 1.388 -0.457 1.00 . A A . 15 ARG HB2 1 1 9 3185 1 1 16 ARG HB3 H -4.541 0.314 -0.637 1.00 . A A . 15 ARG HB3 1 1 9 3186 1 1 16 ARG HD2 H -4.540 3.003 0.824 1.00 . A A . 15 ARG HD2 1 1 9 3187 1 1 16 ARG HD3 H -5.941 1.949 0.638 1.00 . A A . 15 ARG HD3 1 1 9 3188 1 1 16 ARG HE H -5.350 2.040 3.347 1.00 . A A . 15 ARG HE 1 1 9 3189 1 1 16 ARG HG2 H -4.744 0.152 1.786 1.00 . A A . 15 ARG HG2 1 1 9 3190 1 1 16 ARG HG3 H -3.343 1.207 1.979 1.00 . A A . 15 ARG HG3 1 1 9 3191 1 1 16 ARG HH11 H -7.202 5.291 1.922 1.00 . A A . 15 ARG HH11 1 1 9 3192 1 1 16 ARG HH12 H -6.347 4.245 0.840 1.00 . A A . 15 ARG HH12 1 1 9 3193 1 1 16 ARG HH21 H -6.472 3.413 4.780 1.00 . A A . 15 ARG HH21 1 1 9 3194 1 1 16 ARG HH22 H -7.274 4.819 4.162 1.00 . A A . 15 ARG HH22 1 1 9 3195 1 1 16 ARG N N -2.269 -0.964 -1.328 1.00 . A A . 15 ARG N 1 1 9 3196 1 1 16 ARG NE N -5.583 2.602 2.579 1.00 . A A . 15 ARG NE 1 1 9 3197 1 1 16 ARG NH1 N -6.649 4.473 1.764 1.00 . A A . 15 ARG NH1 1 1 9 3198 1 1 16 ARG NH2 N -6.721 3.999 4.008 1.00 . A A . 15 ARG NH2 1 1 9 3199 1 1 16 ARG O O -3.375 -2.101 1.828 1.00 . A A . 15 ARG O 1 1 9 3200 1 1 17 HIS C C -4.154 -5.054 -0.034 1.00 . A A . 16 HIS C 1 1 9 3201 1 1 17 HIS CA C -4.928 -3.770 0.254 1.00 . A A . 16 HIS CA 1 1 9 3202 1 1 17 HIS CB C -6.306 -3.830 -0.410 1.00 . A A . 16 HIS CB 1 1 9 3203 1 1 17 HIS CD2 C -7.911 -2.325 0.964 1.00 . A A . 16 HIS CD2 1 1 9 3204 1 1 17 HIS CE1 C -8.128 -0.688 -0.477 1.00 . A A . 16 HIS CE1 1 1 9 3205 1 1 17 HIS CG C -7.162 -2.636 -0.120 1.00 . A A . 16 HIS CG 1 1 9 3206 1 1 17 HIS H H -4.228 -2.354 -1.157 1.00 . A A . 16 HIS H 1 1 9 3207 1 1 17 HIS HA H -5.059 -3.677 1.322 1.00 . A A . 16 HIS HA 1 1 9 3208 1 1 17 HIS HB2 H -6.179 -3.896 -1.480 1.00 . A A . 16 HIS HB2 1 1 9 3209 1 1 17 HIS HB3 H -6.829 -4.706 -0.060 1.00 . A A . 16 HIS HB3 1 1 9 3210 1 1 17 HIS HD1 H -6.902 -1.519 -1.889 1.00 . A A . 16 HIS HD1 1 1 9 3211 1 1 17 HIS HD2 H -8.024 -2.923 1.858 1.00 . A A . 16 HIS HD2 1 1 9 3212 1 1 17 HIS HE1 H -8.433 0.237 -0.944 1.00 . A A . 16 HIS HE1 1 1 9 3213 1 1 17 HIS HE2 H -9.102 -0.633 1.324 1.00 . A A . 16 HIS HE2 1 1 9 3214 1 1 17 HIS N N -4.191 -2.600 -0.209 1.00 . A A . 16 HIS N 1 1 9 3215 1 1 17 HIS ND1 N -7.320 -1.590 -1.006 1.00 . A A . 16 HIS ND1 1 1 9 3216 1 1 17 HIS NE2 N -8.501 -1.110 0.715 1.00 . A A . 16 HIS NE2 1 1 9 3217 1 1 17 HIS O O -3.484 -5.594 0.845 1.00 . A A . 16 HIS O 1 1 9 3218 1 1 18 SER C C -3.360 -6.800 -3.183 1.00 . A A . 17 SER C 1 1 9 3219 1 1 18 SER CA C -3.556 -6.755 -1.671 1.00 . A A . 17 SER CA 1 1 9 3220 1 1 18 SER CB C -4.338 -7.987 -1.210 1.00 . A A . 17 SER CB 1 1 9 3221 1 1 18 SER H H -4.797 -5.058 -1.929 1.00 . A A . 17 SER H 1 1 9 3222 1 1 18 SER HA H -2.587 -6.757 -1.194 1.00 . A A . 17 SER HA 1 1 9 3223 1 1 18 SER HB2 H -5.325 -7.969 -1.647 1.00 . A A . 17 SER HB2 1 1 9 3224 1 1 18 SER HB3 H -3.819 -8.880 -1.529 1.00 . A A . 17 SER HB3 1 1 9 3225 1 1 18 SER HG H -3.659 -8.366 0.588 1.00 . A A . 17 SER HG 1 1 9 3226 1 1 18 SER N N -4.248 -5.535 -1.270 1.00 . A A . 17 SER N 1 1 9 3227 1 1 18 SER O O -2.268 -6.536 -3.684 1.00 . A A . 17 SER O 1 1 9 3228 1 1 18 SER OG O -4.465 -8.015 0.201 1.00 . A A . 17 SER OG 1 1 9 3229 1 1 19 THR C C -5.761 -7.080 -5.970 1.00 . A A . 18 THR C 1 1 9 3230 1 1 19 THR CA C -4.370 -7.218 -5.359 1.00 . A A . 18 THR CA 1 1 9 3231 1 1 19 THR CB C -3.746 -8.549 -5.826 1.00 . A A . 18 THR CB 1 1 9 3232 1 1 19 THR CG2 C -3.656 -8.604 -7.344 1.00 . A A . 18 THR CG2 1 1 9 3233 1 1 19 THR H H -5.268 -7.338 -3.447 1.00 . A A . 18 THR H 1 1 9 3234 1 1 19 THR HA H -3.749 -6.409 -5.715 1.00 . A A . 18 THR HA 1 1 9 3235 1 1 19 THR HB H -4.372 -9.361 -5.488 1.00 . A A . 18 THR HB 1 1 9 3236 1 1 19 THR HG1 H -2.504 -8.753 -4.307 1.00 . A A . 18 THR HG1 1 1 9 3237 1 1 19 THR HG21 H -3.047 -7.785 -7.699 1.00 . A A . 18 THR HG21 1 1 9 3238 1 1 19 THR HG22 H -4.647 -8.523 -7.767 1.00 . A A . 18 THR HG22 1 1 9 3239 1 1 19 THR HG23 H -3.211 -9.540 -7.645 1.00 . A A . 18 THR HG23 1 1 9 3240 1 1 19 THR N N -4.426 -7.138 -3.904 1.00 . A A . 18 THR N 1 1 9 3241 1 1 19 THR O O -6.075 -6.071 -6.599 1.00 . A A . 18 THR O 1 1 9 3242 1 1 19 THR OG1 O -2.437 -8.701 -5.263 1.00 . A A . 18 THR OG1 1 1 9 3243 1 1 20 ALA C C -8.930 -8.713 -5.321 1.00 . A A . 19 ALA C 1 1 9 3244 1 1 20 ALA CA C -7.948 -8.095 -6.311 1.00 . A A . 19 ALA CA 1 1 9 3245 1 1 20 ALA CB C -7.997 -8.838 -7.637 1.00 . A A . 19 ALA CB 1 1 9 3246 1 1 20 ALA H H -6.281 -8.878 -5.267 1.00 . A A . 19 ALA H 1 1 9 3247 1 1 20 ALA HA H -8.231 -7.068 -6.488 1.00 . A A . 19 ALA HA 1 1 9 3248 1 1 20 ALA HB1 H -8.995 -8.776 -8.047 1.00 . A A . 19 ALA HB1 1 1 9 3249 1 1 20 ALA HB2 H -7.736 -9.873 -7.480 1.00 . A A . 19 ALA HB2 1 1 9 3250 1 1 20 ALA HB3 H -7.296 -8.390 -8.327 1.00 . A A . 19 ALA HB3 1 1 9 3251 1 1 20 ALA N N -6.590 -8.102 -5.778 1.00 . A A . 19 ALA N 1 1 9 3252 1 1 20 ALA O O -8.545 -9.130 -4.228 1.00 . A A . 19 ALA O 1 1 9 3253 1 1 21 ILE C C -11.694 -10.692 -5.382 1.00 . A A . 20 ILE C 1 1 9 3254 1 1 21 ILE CA C -11.238 -9.334 -4.859 1.00 . A A . 20 ILE CA 1 1 9 3255 1 1 21 ILE CB C -12.459 -8.397 -4.764 1.00 . A A . 20 ILE CB 1 1 9 3256 1 1 21 ILE CD1 C -13.137 -5.982 -4.309 1.00 . A A . 20 ILE CD1 1 1 9 3257 1 1 21 ILE CG1 C -12.024 -7.007 -4.289 1.00 . A A . 20 ILE CG1 1 1 9 3258 1 1 21 ILE CG2 C -13.504 -8.982 -3.824 1.00 . A A . 20 ILE CG2 1 1 9 3259 1 1 21 ILE H H -10.442 -8.419 -6.594 1.00 . A A . 20 ILE H 1 1 9 3260 1 1 21 ILE HA H -10.827 -9.459 -3.868 1.00 . A A . 20 ILE HA 1 1 9 3261 1 1 21 ILE HB H -12.899 -8.313 -5.746 1.00 . A A . 20 ILE HB 1 1 9 3262 1 1 21 ILE HD11 H -13.933 -6.300 -3.652 1.00 . A A . 20 ILE HD11 1 1 9 3263 1 1 21 ILE HD12 H -13.519 -5.884 -5.315 1.00 . A A . 20 ILE HD12 1 1 9 3264 1 1 21 ILE HD13 H -12.754 -5.028 -3.975 1.00 . A A . 20 ILE HD13 1 1 9 3265 1 1 21 ILE HG12 H -11.658 -7.079 -3.276 1.00 . A A . 20 ILE HG12 1 1 9 3266 1 1 21 ILE HG13 H -11.231 -6.648 -4.929 1.00 . A A . 20 ILE HG13 1 1 9 3267 1 1 21 ILE HG21 H -14.352 -8.316 -3.769 1.00 . A A . 20 ILE HG21 1 1 9 3268 1 1 21 ILE HG22 H -13.076 -9.102 -2.840 1.00 . A A . 20 ILE HG22 1 1 9 3269 1 1 21 ILE HG23 H -13.825 -9.944 -4.198 1.00 . A A . 20 ILE HG23 1 1 9 3270 1 1 21 ILE N N -10.199 -8.768 -5.712 1.00 . A A . 20 ILE N 1 1 9 3271 1 1 21 ILE O O -11.921 -10.862 -6.580 1.00 . A A . 20 ILE O 1 1 9 3272 1 1 22 GLY C C -11.094 -13.869 -5.283 1.00 . A A . 21 GLY C 1 1 9 3273 1 1 22 GLY CA C -12.254 -12.987 -4.863 1.00 . A A . 21 GLY CA 1 1 9 3274 1 1 22 GLY H H -11.631 -11.460 -3.535 1.00 . A A . 21 GLY H 1 1 9 3275 1 1 22 GLY HA2 H -12.758 -13.448 -4.027 1.00 . A A . 21 GLY HA2 1 1 9 3276 1 1 22 GLY HA3 H -12.946 -12.904 -5.688 1.00 . A A . 21 GLY HA3 1 1 9 3277 1 1 22 GLY N N -11.826 -11.655 -4.476 1.00 . A A . 21 GLY N 1 1 9 3278 1 1 22 GLY O O -10.334 -13.518 -6.186 1.00 . A A . 21 GLY O 1 1 9 3279 1 1 23 ARG C C -10.199 -17.342 -4.390 1.00 . A A . 22 ARG C 1 1 9 3280 1 1 23 ARG CA C -9.884 -15.953 -4.936 1.00 . A A . 22 ARG CA 1 1 9 3281 1 1 23 ARG CB C -8.559 -15.450 -4.358 1.00 . A A . 22 ARG CB 1 1 9 3282 1 1 23 ARG CD C -6.079 -15.777 -4.119 1.00 . A A . 22 ARG CD 1 1 9 3283 1 1 23 ARG CG C -7.369 -16.333 -4.698 1.00 . A A . 22 ARG CG 1 1 9 3284 1 1 23 ARG CZ C -5.180 -15.101 -1.930 1.00 . A A . 22 ARG CZ 1 1 9 3285 1 1 23 ARG H H -11.596 -15.240 -3.917 1.00 . A A . 22 ARG H 1 1 9 3286 1 1 23 ARG HA H -9.796 -16.013 -6.011 1.00 . A A . 22 ARG HA 1 1 9 3287 1 1 23 ARG HB2 H -8.365 -14.459 -4.742 1.00 . A A . 22 ARG HB2 1 1 9 3288 1 1 23 ARG HB3 H -8.645 -15.398 -3.282 1.00 . A A . 22 ARG HB3 1 1 9 3289 1 1 23 ARG HD2 H -5.266 -16.435 -4.390 1.00 . A A . 22 ARG HD2 1 1 9 3290 1 1 23 ARG HD3 H -5.904 -14.798 -4.539 1.00 . A A . 22 ARG HD3 1 1 9 3291 1 1 23 ARG HE H -6.923 -16.031 -2.211 1.00 . A A . 22 ARG HE 1 1 9 3292 1 1 23 ARG HG2 H -7.539 -17.320 -4.292 1.00 . A A . 22 ARG HG2 1 1 9 3293 1 1 23 ARG HG3 H -7.275 -16.394 -5.772 1.00 . A A . 22 ARG HG3 1 1 9 3294 1 1 23 ARG HH11 H -3.385 -14.173 -1.961 1.00 . A A . 22 ARG HH11 1 1 9 3295 1 1 23 ARG HH12 H -4.003 -14.641 -3.509 1.00 . A A . 22 ARG HH12 1 1 9 3296 1 1 23 ARG HH21 H -6.117 -15.419 -0.168 1.00 . A A . 22 ARG HH21 1 1 9 3297 1 1 23 ARG HH22 H -4.587 -14.614 -0.062 1.00 . A A . 22 ARG HH22 1 1 9 3298 1 1 23 ARG N N -10.958 -15.017 -4.626 1.00 . A A . 22 ARG N 1 1 9 3299 1 1 23 ARG NE N -6.134 -15.666 -2.664 1.00 . A A . 22 ARG NE 1 1 9 3300 1 1 23 ARG NH1 N -4.101 -14.597 -2.515 1.00 . A A . 22 ARG NH1 1 1 9 3301 1 1 23 ARG NH2 N -5.304 -15.040 -0.612 1.00 . A A . 22 ARG NH2 1 1 9 3302 1 1 23 ARG O O -10.776 -18.156 -5.141 1.00 . A A . 22 ARG O 1 1 9 3303 1 1 23 ARG OXT O -9.866 -17.605 -3.215 1.00 . A A . 22 ARG OXT 1 1 10 3304 1 1 1 ACE C C 3.018 1.910 11.520 1.00 . A A . 0 ACE C 1 1 10 3305 1 1 1 ACE CH3 C 3.108 0.981 12.699 1.00 . A A . 0 ACE CH3 1 1 10 3306 1 1 1 ACE H1 H 2.384 0.184 12.568 1.00 . A A . 0 ACE H1 1 1 10 3307 1 1 1 ACE H2 H 2.886 1.521 13.599 1.00 . A A . 0 ACE H2 1 1 10 3308 1 1 1 ACE H3 H 4.117 0.585 12.755 1.00 . A A . 0 ACE H3 1 1 10 3309 1 1 1 ACE O O 2.108 2.735 11.432 1.00 . A A . 0 ACE O 1 1 10 3310 1 1 2 MET C C 4.486 1.836 8.194 1.00 . A A . 1 MET C 1 1 10 3311 1 1 2 MET CA C 3.999 2.623 9.407 1.00 . A A . 1 MET CA 1 1 10 3312 1 1 2 MET CB C 4.894 3.847 9.634 1.00 . A A . 1 MET CB 1 1 10 3313 1 1 2 MET CE C 8.109 2.616 12.005 1.00 . A A . 1 MET CE 1 1 10 3314 1 1 2 MET CG C 6.303 3.507 10.101 1.00 . A A . 1 MET CG 1 1 10 3315 1 1 2 MET H H 4.668 1.106 10.724 1.00 . A A . 1 MET H 1 1 10 3316 1 1 2 MET HA H 2.990 2.958 9.218 1.00 . A A . 1 MET HA 1 1 10 3317 1 1 2 MET HB2 H 4.972 4.398 8.709 1.00 . A A . 1 MET HB2 1 1 10 3318 1 1 2 MET HB3 H 4.436 4.479 10.380 1.00 . A A . 1 MET HB3 1 1 10 3319 1 1 2 MET HE1 H 8.298 2.244 13.001 1.00 . A A . 1 MET HE1 1 1 10 3320 1 1 2 MET HE2 H 8.653 3.538 11.855 1.00 . A A . 1 MET HE2 1 1 10 3321 1 1 2 MET HE3 H 8.432 1.885 11.280 1.00 . A A . 1 MET HE3 1 1 10 3322 1 1 2 MET HG2 H 6.703 2.738 9.459 1.00 . A A . 1 MET HG2 1 1 10 3323 1 1 2 MET HG3 H 6.915 4.393 10.023 1.00 . A A . 1 MET HG3 1 1 10 3324 1 1 2 MET N N 3.970 1.782 10.599 1.00 . A A . 1 MET N 1 1 10 3325 1 1 2 MET O O 5.601 1.315 8.185 1.00 . A A . 1 MET O 1 1 10 3326 1 1 2 MET SD S 6.355 2.920 11.806 1.00 . A A . 1 MET SD 1 1 10 3327 1 1 3 ASN C C 3.790 1.923 4.732 1.00 . A A . 2 ASN C 1 1 10 3328 1 1 3 ASN CA C 3.988 1.032 5.952 1.00 . A A . 2 ASN CA 1 1 10 3329 1 1 3 ASN CB C 3.144 -0.237 5.813 1.00 . A A . 2 ASN CB 1 1 10 3330 1 1 3 ASN CG C 3.802 -1.290 4.934 1.00 . A A . 2 ASN CG 1 1 10 3331 1 1 3 ASN H H 2.761 2.180 7.240 1.00 . A A . 2 ASN H 1 1 10 3332 1 1 3 ASN HA H 5.030 0.756 6.016 1.00 . A A . 2 ASN HA 1 1 10 3333 1 1 3 ASN HB2 H 2.984 -0.662 6.793 1.00 . A A . 2 ASN HB2 1 1 10 3334 1 1 3 ASN HB3 H 2.190 0.022 5.378 1.00 . A A . 2 ASN HB3 1 1 10 3335 1 1 3 ASN HD21 H 4.813 0.105 3.929 1.00 . A A . 2 ASN HD21 1 1 10 3336 1 1 3 ASN HD22 H 5.083 -1.523 3.427 1.00 . A A . 2 ASN HD22 1 1 10 3337 1 1 3 ASN N N 3.640 1.751 7.172 1.00 . A A . 2 ASN N 1 1 10 3338 1 1 3 ASN ND2 N 4.652 -0.858 4.004 1.00 . A A . 2 ASN ND2 1 1 10 3339 1 1 3 ASN O O 3.600 1.436 3.617 1.00 . A A . 2 ASN O 1 1 10 3340 1 1 3 ASN OD1 O 3.552 -2.485 5.094 1.00 . A A . 2 ASN OD1 1 1 10 3341 1 1 4 TRP C C 4.817 4.041 2.880 1.00 . A A . 3 TRP C 1 1 10 3342 1 1 4 TRP CA C 3.665 4.171 3.845 1.00 . A A . 3 TRP CA 1 1 10 3343 1 1 4 TRP CB C 3.623 5.606 4.338 1.00 . A A . 3 TRP CB 1 1 10 3344 1 1 4 TRP CD1 C 4.905 5.918 6.514 1.00 . A A . 3 TRP CD1 1 1 10 3345 1 1 4 TRP CD2 C 6.065 6.481 4.694 1.00 . A A . 3 TRP CD2 1 1 10 3346 1 1 4 TRP CE2 C 6.864 6.723 5.823 1.00 . A A . 3 TRP CE2 1 1 10 3347 1 1 4 TRP CE3 C 6.588 6.753 3.432 1.00 . A A . 3 TRP CE3 1 1 10 3348 1 1 4 TRP CG C 4.808 5.984 5.164 1.00 . A A . 3 TRP CG 1 1 10 3349 1 1 4 TRP CH2 C 8.643 7.485 4.472 1.00 . A A . 3 TRP CH2 1 1 10 3350 1 1 4 TRP CZ2 C 8.155 7.227 5.722 1.00 . A A . 3 TRP CZ2 1 1 10 3351 1 1 4 TRP CZ3 C 7.872 7.250 3.332 1.00 . A A . 3 TRP CZ3 1 1 10 3352 1 1 4 TRP H H 3.956 3.571 5.854 1.00 . A A . 3 TRP H 1 1 10 3353 1 1 4 TRP HA H 2.745 3.944 3.337 1.00 . A A . 3 TRP HA 1 1 10 3354 1 1 4 TRP HB2 H 3.597 6.266 3.480 1.00 . A A . 3 TRP HB2 1 1 10 3355 1 1 4 TRP HB3 H 2.734 5.755 4.932 1.00 . A A . 3 TRP HB3 1 1 10 3356 1 1 4 TRP HD1 H 4.119 5.566 7.151 1.00 . A A . 3 TRP HD1 1 1 10 3357 1 1 4 TRP HE1 H 6.436 6.436 7.856 1.00 . A A . 3 TRP HE1 1 1 10 3358 1 1 4 TRP HE3 H 6.009 6.570 2.543 1.00 . A A . 3 TRP HE3 1 1 10 3359 1 1 4 TRP HH2 H 9.641 7.875 4.350 1.00 . A A . 3 TRP HH2 1 1 10 3360 1 1 4 TRP HZ2 H 8.756 7.418 6.590 1.00 . A A . 3 TRP HZ2 1 1 10 3361 1 1 4 TRP HZ3 H 8.291 7.467 2.360 1.00 . A A . 3 TRP HZ3 1 1 10 3362 1 1 4 TRP N N 3.824 3.233 4.944 1.00 . A A . 3 TRP N 1 1 10 3363 1 1 4 TRP NE1 N 6.133 6.374 6.926 1.00 . A A . 3 TRP NE1 1 1 10 3364 1 1 4 TRP O O 4.702 4.425 1.718 1.00 . A A . 3 TRP O 1 1 10 3365 1 1 5 THR C C 6.803 3.032 1.143 1.00 . A A . 4 THR C 1 1 10 3366 1 1 5 THR CA C 7.135 3.338 2.599 1.00 . A A . 4 THR CA 1 1 10 3367 1 1 5 THR CB C 8.025 2.214 3.165 1.00 . A A . 4 THR CB 1 1 10 3368 1 1 5 THR CG2 C 9.326 2.105 2.382 1.00 . A A . 4 THR CG2 1 1 10 3369 1 1 5 THR H H 5.930 3.224 4.326 1.00 . A A . 4 THR H 1 1 10 3370 1 1 5 THR HA H 7.683 4.266 2.654 1.00 . A A . 4 THR HA 1 1 10 3371 1 1 5 THR HB H 7.493 1.278 3.086 1.00 . A A . 4 THR HB 1 1 10 3372 1 1 5 THR HG1 H 8.018 3.351 4.778 1.00 . A A . 4 THR HG1 1 1 10 3373 1 1 5 THR HG21 H 9.932 1.313 2.799 1.00 . A A . 4 THR HG21 1 1 10 3374 1 1 5 THR HG22 H 9.862 3.040 2.442 1.00 . A A . 4 THR HG22 1 1 10 3375 1 1 5 THR HG23 H 9.105 1.882 1.348 1.00 . A A . 4 THR HG23 1 1 10 3376 1 1 5 THR N N 5.927 3.510 3.388 1.00 . A A . 4 THR N 1 1 10 3377 1 1 5 THR O O 6.718 1.872 0.742 1.00 . A A . 4 THR O 1 1 10 3378 1 1 5 THR OG1 O 8.318 2.469 4.545 1.00 . A A . 4 THR OG1 1 1 10 3379 1 1 6 GLY C C 5.511 5.108 -1.608 1.00 . A A . 5 GLY C 1 1 10 3380 1 1 6 GLY CA C 6.270 3.921 -1.035 1.00 . A A . 5 GLY CA 1 1 10 3381 1 1 6 GLY H H 6.694 4.987 0.738 1.00 . A A . 5 GLY H 1 1 10 3382 1 1 6 GLY HA2 H 7.181 3.784 -1.598 1.00 . A A . 5 GLY HA2 1 1 10 3383 1 1 6 GLY HA3 H 5.660 3.033 -1.136 1.00 . A A . 5 GLY HA3 1 1 10 3384 1 1 6 GLY N N 6.606 4.088 0.361 1.00 . A A . 5 GLY N 1 1 10 3385 1 1 6 GLY O O 5.264 5.165 -2.806 1.00 . A A . 5 GLY O 1 1 10 3386 1 1 7 LEU C C 5.305 8.251 -1.897 1.00 . A A . 6 LEU C 1 1 10 3387 1 1 7 LEU CA C 4.399 7.244 -1.201 1.00 . A A . 6 LEU CA 1 1 10 3388 1 1 7 LEU CB C 3.722 7.920 -0.015 1.00 . A A . 6 LEU CB 1 1 10 3389 1 1 7 LEU CD1 C 5.756 8.995 1.027 1.00 . A A . 6 LEU CD1 1 1 10 3390 1 1 7 LEU CD2 C 3.767 8.487 2.438 1.00 . A A . 6 LEU CD2 1 1 10 3391 1 1 7 LEU CG C 4.590 8.040 1.243 1.00 . A A . 6 LEU CG 1 1 10 3392 1 1 7 LEU H H 5.355 5.961 0.194 1.00 . A A . 6 LEU H 1 1 10 3393 1 1 7 LEU HA H 3.644 6.919 -1.897 1.00 . A A . 6 LEU HA 1 1 10 3394 1 1 7 LEU HB2 H 3.427 8.910 -0.321 1.00 . A A . 6 LEU HB2 1 1 10 3395 1 1 7 LEU HB3 H 2.837 7.356 0.231 1.00 . A A . 6 LEU HB3 1 1 10 3396 1 1 7 LEU HD11 H 6.377 8.630 0.223 1.00 . A A . 6 LEU HD11 1 1 10 3397 1 1 7 LEU HD12 H 6.342 9.057 1.934 1.00 . A A . 6 LEU HD12 1 1 10 3398 1 1 7 LEU HD13 H 5.377 9.975 0.776 1.00 . A A . 6 LEU HD13 1 1 10 3399 1 1 7 LEU HD21 H 2.947 7.800 2.588 1.00 . A A . 6 LEU HD21 1 1 10 3400 1 1 7 LEU HD22 H 3.381 9.479 2.260 1.00 . A A . 6 LEU HD22 1 1 10 3401 1 1 7 LEU HD23 H 4.395 8.495 3.321 1.00 . A A . 6 LEU HD23 1 1 10 3402 1 1 7 LEU HG H 4.998 7.069 1.471 1.00 . A A . 6 LEU HG 1 1 10 3403 1 1 7 LEU N N 5.138 6.059 -0.756 1.00 . A A . 6 LEU N 1 1 10 3404 1 1 7 LEU O O 4.932 9.409 -2.085 1.00 . A A . 6 LEU O 1 1 10 3405 1 1 8 TYR C C 8.066 7.995 -4.168 1.00 . A A . 7 TYR C 1 1 10 3406 1 1 8 TYR CA C 7.451 8.667 -2.942 1.00 . A A . 7 TYR CA 1 1 10 3407 1 1 8 TYR CB C 8.545 9.079 -1.958 1.00 . A A . 7 TYR CB 1 1 10 3408 1 1 8 TYR CD1 C 8.376 7.044 -0.506 1.00 . A A . 7 TYR CD1 1 1 10 3409 1 1 8 TYR CD2 C 10.530 7.655 -1.315 1.00 . A A . 7 TYR CD2 1 1 10 3410 1 1 8 TYR CE1 C 8.911 5.967 0.134 1.00 . A A . 7 TYR CE1 1 1 10 3411 1 1 8 TYR CE2 C 11.083 6.568 -0.665 1.00 . A A . 7 TYR CE2 1 1 10 3412 1 1 8 TYR CG C 9.166 7.909 -1.241 1.00 . A A . 7 TYR CG 1 1 10 3413 1 1 8 TYR CZ C 10.267 5.724 0.060 1.00 . A A . 7 TYR CZ 1 1 10 3414 1 1 8 TYR H H 6.720 6.877 -2.096 1.00 . A A . 7 TYR H 1 1 10 3415 1 1 8 TYR HA H 6.925 9.544 -3.257 1.00 . A A . 7 TYR HA 1 1 10 3416 1 1 8 TYR HB2 H 9.326 9.598 -2.491 1.00 . A A . 7 TYR HB2 1 1 10 3417 1 1 8 TYR HB3 H 8.120 9.734 -1.215 1.00 . A A . 7 TYR HB3 1 1 10 3418 1 1 8 TYR HD1 H 7.311 7.227 -0.435 1.00 . A A . 7 TYR HD1 1 1 10 3419 1 1 8 TYR HD2 H 11.161 8.322 -1.882 1.00 . A A . 7 TYR HD2 1 1 10 3420 1 1 8 TYR HE1 H 8.264 5.319 0.683 1.00 . A A . 7 TYR HE1 1 1 10 3421 1 1 8 TYR HE2 H 12.145 6.383 -0.727 1.00 . A A . 7 TYR HE2 1 1 10 3422 1 1 8 TYR HH H 11.607 4.899 1.165 1.00 . A A . 7 TYR HH 1 1 10 3423 1 1 8 TYR N N 6.486 7.804 -2.279 1.00 . A A . 7 TYR N 1 1 10 3424 1 1 8 TYR O O 8.540 8.673 -5.080 1.00 . A A . 7 TYR O 1 1 10 3425 1 1 8 TYR OH O 10.807 4.635 0.706 1.00 . A A . 7 TYR OH 1 1 10 3426 1 1 9 THR C C 7.834 4.657 -5.615 1.00 . A A . 8 THR C 1 1 10 3427 1 1 9 THR CA C 8.625 5.921 -5.315 1.00 . A A . 8 THR CA 1 1 10 3428 1 1 9 THR CB C 10.085 5.518 -5.048 1.00 . A A . 8 THR CB 1 1 10 3429 1 1 9 THR CG2 C 10.941 6.733 -4.719 1.00 . A A . 8 THR CG2 1 1 10 3430 1 1 9 THR H H 7.669 6.173 -3.439 1.00 . A A . 8 THR H 1 1 10 3431 1 1 9 THR HA H 8.600 6.561 -6.181 1.00 . A A . 8 THR HA 1 1 10 3432 1 1 9 THR HB H 10.480 5.047 -5.938 1.00 . A A . 8 THR HB 1 1 10 3433 1 1 9 THR HG1 H 9.302 4.098 -3.925 1.00 . A A . 8 THR HG1 1 1 10 3434 1 1 9 THR HG21 H 10.513 7.257 -3.878 1.00 . A A . 8 THR HG21 1 1 10 3435 1 1 9 THR HG22 H 10.975 7.391 -5.574 1.00 . A A . 8 THR HG22 1 1 10 3436 1 1 9 THR HG23 H 11.942 6.411 -4.473 1.00 . A A . 8 THR HG23 1 1 10 3437 1 1 9 THR N N 8.059 6.664 -4.190 1.00 . A A . 8 THR N 1 1 10 3438 1 1 9 THR O O 8.214 3.870 -6.482 1.00 . A A . 8 THR O 1 1 10 3439 1 1 9 THR OG1 O 10.133 4.583 -3.966 1.00 . A A . 8 THR OG1 1 1 10 3440 1 1 10 LEU C C 4.419 3.616 -5.008 1.00 . A A . 9 LEU C 1 1 10 3441 1 1 10 LEU CA C 5.903 3.283 -5.094 1.00 . A A . 9 LEU CA 1 1 10 3442 1 1 10 LEU CB C 6.255 2.213 -4.060 1.00 . A A . 9 LEU CB 1 1 10 3443 1 1 10 LEU CD1 C 7.990 0.868 -2.867 1.00 . A A . 9 LEU CD1 1 1 10 3444 1 1 10 LEU CD2 C 8.061 1.047 -5.355 1.00 . A A . 9 LEU CD2 1 1 10 3445 1 1 10 LEU CG C 7.717 1.765 -4.059 1.00 . A A . 9 LEU CG 1 1 10 3446 1 1 10 LEU H H 6.470 5.142 -4.249 1.00 . A A . 9 LEU H 1 1 10 3447 1 1 10 LEU HA H 6.111 2.894 -6.075 1.00 . A A . 9 LEU HA 1 1 10 3448 1 1 10 LEU HB2 H 6.018 2.599 -3.081 1.00 . A A . 9 LEU HB2 1 1 10 3449 1 1 10 LEU HB3 H 5.636 1.348 -4.245 1.00 . A A . 9 LEU HB3 1 1 10 3450 1 1 10 LEU HD11 H 7.351 0.000 -2.918 1.00 . A A . 9 LEU HD11 1 1 10 3451 1 1 10 LEU HD12 H 7.788 1.411 -1.955 1.00 . A A . 9 LEU HD12 1 1 10 3452 1 1 10 LEU HD13 H 9.023 0.556 -2.879 1.00 . A A . 9 LEU HD13 1 1 10 3453 1 1 10 LEU HD21 H 7.457 0.156 -5.445 1.00 . A A . 9 LEU HD21 1 1 10 3454 1 1 10 LEU HD22 H 9.106 0.775 -5.350 1.00 . A A . 9 LEU HD22 1 1 10 3455 1 1 10 LEU HD23 H 7.863 1.701 -6.192 1.00 . A A . 9 LEU HD23 1 1 10 3456 1 1 10 LEU HG H 8.355 2.633 -3.977 1.00 . A A . 9 LEU HG 1 1 10 3457 1 1 10 LEU N N 6.733 4.467 -4.905 1.00 . A A . 9 LEU N 1 1 10 3458 1 1 10 LEU O O 3.580 2.722 -4.966 1.00 . A A . 9 LEU O 1 1 10 3459 1 1 11 LEU C C 1.901 4.712 -6.019 1.00 . A A . 10 LEU C 1 1 10 3460 1 1 11 LEU CA C 2.715 5.347 -4.898 1.00 . A A . 10 LEU CA 1 1 10 3461 1 1 11 LEU CB C 2.629 6.869 -4.977 1.00 . A A . 10 LEU CB 1 1 10 3462 1 1 11 LEU CD1 C 3.264 8.845 -6.368 1.00 . A A . 10 LEU CD1 1 1 10 3463 1 1 11 LEU CD2 C 4.951 7.808 -4.847 1.00 . A A . 10 LEU CD2 1 1 10 3464 1 1 11 LEU CG C 3.757 7.548 -5.754 1.00 . A A . 10 LEU CG 1 1 10 3465 1 1 11 LEU H H 4.820 5.566 -4.975 1.00 . A A . 10 LEU H 1 1 10 3466 1 1 11 LEU HA H 2.312 5.022 -3.952 1.00 . A A . 10 LEU HA 1 1 10 3467 1 1 11 LEU HB2 H 1.691 7.128 -5.445 1.00 . A A . 10 LEU HB2 1 1 10 3468 1 1 11 LEU HB3 H 2.628 7.258 -3.970 1.00 . A A . 10 LEU HB3 1 1 10 3469 1 1 11 LEU HD11 H 2.444 8.636 -7.040 1.00 . A A . 10 LEU HD11 1 1 10 3470 1 1 11 LEU HD12 H 4.068 9.314 -6.915 1.00 . A A . 10 LEU HD12 1 1 10 3471 1 1 11 LEU HD13 H 2.928 9.508 -5.585 1.00 . A A . 10 LEU HD13 1 1 10 3472 1 1 11 LEU HD21 H 5.016 7.034 -4.092 1.00 . A A . 10 LEU HD21 1 1 10 3473 1 1 11 LEU HD22 H 4.836 8.768 -4.366 1.00 . A A . 10 LEU HD22 1 1 10 3474 1 1 11 LEU HD23 H 5.857 7.809 -5.435 1.00 . A A . 10 LEU HD23 1 1 10 3475 1 1 11 LEU HG H 4.081 6.899 -6.553 1.00 . A A . 10 LEU HG 1 1 10 3476 1 1 11 LEU N N 4.104 4.903 -4.968 1.00 . A A . 10 LEU N 1 1 10 3477 1 1 11 LEU O O 2.393 4.552 -7.137 1.00 . A A . 10 LEU O 1 1 10 3478 1 1 12 SER C C 0.416 2.389 -7.144 1.00 . A A . 11 SER C 1 1 10 3479 1 1 12 SER CA C -0.212 3.705 -6.697 1.00 . A A . 11 SER CA 1 1 10 3480 1 1 12 SER CB C -0.442 4.622 -7.903 1.00 . A A . 11 SER CB 1 1 10 3481 1 1 12 SER H H 0.314 4.520 -4.812 1.00 . A A . 11 SER H 1 1 10 3482 1 1 12 SER HA H -1.159 3.499 -6.221 1.00 . A A . 11 SER HA 1 1 10 3483 1 1 12 SER HB2 H -0.884 5.549 -7.568 1.00 . A A . 11 SER HB2 1 1 10 3484 1 1 12 SER HB3 H 0.504 4.826 -8.382 1.00 . A A . 11 SER HB3 1 1 10 3485 1 1 12 SER HG H -1.917 3.430 -8.391 1.00 . A A . 11 SER HG 1 1 10 3486 1 1 12 SER N N 0.655 4.350 -5.716 1.00 . A A . 11 SER N 1 1 10 3487 1 1 12 SER O O -0.050 1.743 -8.083 1.00 . A A . 11 SER O 1 1 10 3488 1 1 12 SER OG O -1.310 4.018 -8.846 1.00 . A A . 11 SER OG 1 1 10 3489 1 1 13 ARG C C 2.481 0.017 -5.437 1.00 . A A . 12 ARG C 1 1 10 3490 1 1 13 ARG CA C 2.214 0.784 -6.731 1.00 . A A . 12 ARG CA 1 1 10 3491 1 1 13 ARG CB C 3.531 1.135 -7.442 1.00 . A A . 12 ARG CB 1 1 10 3492 1 1 13 ARG CD C 5.889 0.468 -7.990 1.00 . A A . 12 ARG CD 1 1 10 3493 1 1 13 ARG CG C 4.504 -0.023 -7.597 1.00 . A A . 12 ARG CG 1 1 10 3494 1 1 13 ARG CZ C 8.084 -0.471 -8.588 1.00 . A A . 12 ARG CZ 1 1 10 3495 1 1 13 ARG H H 1.786 2.579 -5.712 1.00 . A A . 12 ARG H 1 1 10 3496 1 1 13 ARG HA H 1.608 0.177 -7.376 1.00 . A A . 12 ARG HA 1 1 10 3497 1 1 13 ARG HB2 H 3.299 1.510 -8.428 1.00 . A A . 12 ARG HB2 1 1 10 3498 1 1 13 ARG HB3 H 4.027 1.915 -6.884 1.00 . A A . 12 ARG HB3 1 1 10 3499 1 1 13 ARG HD2 H 5.810 1.037 -8.904 1.00 . A A . 12 ARG HD2 1 1 10 3500 1 1 13 ARG HD3 H 6.270 1.106 -7.202 1.00 . A A . 12 ARG HD3 1 1 10 3501 1 1 13 ARG HE H 6.494 -1.545 -8.039 1.00 . A A . 12 ARG HE 1 1 10 3502 1 1 13 ARG HG2 H 4.574 -0.552 -6.659 1.00 . A A . 12 ARG HG2 1 1 10 3503 1 1 13 ARG HG3 H 4.137 -0.690 -8.363 1.00 . A A . 12 ARG HG3 1 1 10 3504 1 1 13 ARG HH11 H 7.970 1.544 -8.687 1.00 . A A . 12 ARG HH11 1 1 10 3505 1 1 13 ARG HH12 H 9.508 0.866 -9.104 1.00 . A A . 12 ARG HH12 1 1 10 3506 1 1 13 ARG HH21 H 8.515 -2.445 -8.587 1.00 . A A . 12 ARG HH21 1 1 10 3507 1 1 13 ARG HH22 H 9.818 -1.401 -9.048 1.00 . A A . 12 ARG HH22 1 1 10 3508 1 1 13 ARG N N 1.480 2.009 -6.446 1.00 . A A . 12 ARG N 1 1 10 3509 1 1 13 ARG NE N 6.823 -0.635 -8.198 1.00 . A A . 12 ARG NE 1 1 10 3510 1 1 13 ARG NH1 N 8.559 0.746 -8.811 1.00 . A A . 12 ARG NH1 1 1 10 3511 1 1 13 ARG NH2 N 8.870 -1.525 -8.755 1.00 . A A . 12 ARG NH2 1 1 10 3512 1 1 13 ARG O O 2.987 -1.106 -5.451 1.00 . A A . 12 ARG O 1 1 10 3513 1 1 14 VAL C C 1.360 -1.140 -2.784 1.00 . A A . 13 VAL C 1 1 10 3514 1 1 14 VAL CA C 2.313 0.028 -3.005 1.00 . A A . 13 VAL CA 1 1 10 3515 1 1 14 VAL CB C 2.119 1.064 -1.879 1.00 . A A . 13 VAL CB 1 1 10 3516 1 1 14 VAL CG1 C 2.505 0.477 -0.532 1.00 . A A . 13 VAL CG1 1 1 10 3517 1 1 14 VAL CG2 C 2.917 2.327 -2.162 1.00 . A A . 13 VAL CG2 1 1 10 3518 1 1 14 VAL H H 1.694 1.513 -4.381 1.00 . A A . 13 VAL H 1 1 10 3519 1 1 14 VAL HA H 3.322 -0.338 -2.962 1.00 . A A . 13 VAL HA 1 1 10 3520 1 1 14 VAL HB H 1.073 1.329 -1.841 1.00 . A A . 13 VAL HB 1 1 10 3521 1 1 14 VAL HG11 H 2.460 1.250 0.222 1.00 . A A . 13 VAL HG11 1 1 10 3522 1 1 14 VAL HG12 H 3.508 0.083 -0.587 1.00 . A A . 13 VAL HG12 1 1 10 3523 1 1 14 VAL HG13 H 1.817 -0.316 -0.276 1.00 . A A . 13 VAL HG13 1 1 10 3524 1 1 14 VAL HG21 H 2.842 2.996 -1.318 1.00 . A A . 13 VAL HG21 1 1 10 3525 1 1 14 VAL HG22 H 2.522 2.812 -3.042 1.00 . A A . 13 VAL HG22 1 1 10 3526 1 1 14 VAL HG23 H 3.952 2.068 -2.326 1.00 . A A . 13 VAL HG23 1 1 10 3527 1 1 14 VAL N N 2.114 0.631 -4.319 1.00 . A A . 13 VAL N 1 1 10 3528 1 1 14 VAL O O 1.459 -1.864 -1.792 1.00 . A A . 13 VAL O 1 1 10 3529 1 1 15 ASN C C -1.310 -2.329 -2.327 1.00 . A A . 14 ASN C 1 1 10 3530 1 1 15 ASN CA C -0.539 -2.394 -3.643 1.00 . A A . 14 ASN CA 1 1 10 3531 1 1 15 ASN CB C 0.140 -3.759 -3.781 1.00 . A A . 14 ASN CB 1 1 10 3532 1 1 15 ASN CG C 0.811 -3.942 -5.129 1.00 . A A . 14 ASN CG 1 1 10 3533 1 1 15 ASN H H 0.443 -0.723 -4.496 1.00 . A A . 14 ASN H 1 1 10 3534 1 1 15 ASN HA H -1.234 -2.263 -4.457 1.00 . A A . 14 ASN HA 1 1 10 3535 1 1 15 ASN HB2 H 0.889 -3.860 -3.010 1.00 . A A . 14 ASN HB2 1 1 10 3536 1 1 15 ASN HB3 H -0.601 -4.536 -3.662 1.00 . A A . 14 ASN HB3 1 1 10 3537 1 1 15 ASN HD21 H 2.554 -3.716 -6.058 1.00 . A A . 14 ASN HD21 1 1 10 3538 1 1 15 ASN HD22 H 2.530 -3.268 -4.391 1.00 . A A . 14 ASN HD22 1 1 10 3539 1 1 15 ASN N N 0.447 -1.321 -3.723 1.00 . A A . 14 ASN N 1 1 10 3540 1 1 15 ASN ND2 N 2.094 -3.608 -5.199 1.00 . A A . 14 ASN ND2 1 1 10 3541 1 1 15 ASN O O -1.871 -3.328 -1.874 1.00 . A A . 14 ASN O 1 1 10 3542 1 1 15 ASN OD1 O 0.186 -4.382 -6.092 1.00 . A A . 14 ASN OD1 1 1 10 3543 1 1 16 ARG C C -3.549 -1.080 -0.635 1.00 . A A . 15 ARG C 1 1 10 3544 1 1 16 ARG CA C -2.039 -0.951 -0.457 1.00 . A A . 15 ARG CA 1 1 10 3545 1 1 16 ARG CB C -1.698 0.421 0.130 1.00 . A A . 15 ARG CB 1 1 10 3546 1 1 16 ARG CD C -2.019 2.076 1.994 1.00 . A A . 15 ARG CD 1 1 10 3547 1 1 16 ARG CG C -2.399 0.709 1.447 1.00 . A A . 15 ARG CG 1 1 10 3548 1 1 16 ARG CZ C -2.136 4.437 1.315 1.00 . A A . 15 ARG CZ 1 1 10 3549 1 1 16 ARG H H -0.882 -0.386 -2.137 1.00 . A A . 15 ARG H 1 1 10 3550 1 1 16 ARG HA H -1.703 -1.715 0.226 1.00 . A A . 15 ARG HA 1 1 10 3551 1 1 16 ARG HB2 H -0.632 0.475 0.295 1.00 . A A . 15 ARG HB2 1 1 10 3552 1 1 16 ARG HB3 H -1.983 1.185 -0.579 1.00 . A A . 15 ARG HB3 1 1 10 3553 1 1 16 ARG HD2 H -2.539 2.233 2.927 1.00 . A A . 15 ARG HD2 1 1 10 3554 1 1 16 ARG HD3 H -0.954 2.096 2.170 1.00 . A A . 15 ARG HD3 1 1 10 3555 1 1 16 ARG HE H -2.796 2.902 0.225 1.00 . A A . 15 ARG HE 1 1 10 3556 1 1 16 ARG HG2 H -3.467 0.680 1.290 1.00 . A A . 15 ARG HG2 1 1 10 3557 1 1 16 ARG HG3 H -2.118 -0.047 2.166 1.00 . A A . 15 ARG HG3 1 1 10 3558 1 1 16 ARG HH11 H -1.385 5.774 2.631 1.00 . A A . 15 ARG HH11 1 1 10 3559 1 1 16 ARG HH12 H -1.295 4.117 3.124 1.00 . A A . 15 ARG HH12 1 1 10 3560 1 1 16 ARG HH21 H -2.918 5.083 -0.434 1.00 . A A . 15 ARG HH21 1 1 10 3561 1 1 16 ARG HH22 H -2.307 6.324 0.609 1.00 . A A . 15 ARG HH22 1 1 10 3562 1 1 16 ARG N N -1.341 -1.146 -1.722 1.00 . A A . 15 ARG N 1 1 10 3563 1 1 16 ARG NE N -2.367 3.152 1.070 1.00 . A A . 15 ARG NE 1 1 10 3564 1 1 16 ARG NH1 N -1.558 4.807 2.450 1.00 . A A . 15 ARG NH1 1 1 10 3565 1 1 16 ARG NH2 N -2.483 5.356 0.424 1.00 . A A . 15 ARG NH2 1 1 10 3566 1 1 16 ARG O O -4.156 -2.044 -0.167 1.00 . A A . 15 ARG O 1 1 10 3567 1 1 17 HIS C C -6.361 -0.098 -0.237 1.00 . A A . 16 HIS C 1 1 10 3568 1 1 17 HIS CA C -5.588 -0.103 -1.553 1.00 . A A . 16 HIS CA 1 1 10 3569 1 1 17 HIS CB C -5.988 -1.320 -2.391 1.00 . A A . 16 HIS CB 1 1 10 3570 1 1 17 HIS CD2 C -5.783 -0.957 -4.950 1.00 . A A . 16 HIS CD2 1 1 10 3571 1 1 17 HIS CE1 C -3.764 -1.766 -5.226 1.00 . A A . 16 HIS CE1 1 1 10 3572 1 1 17 HIS CG C -5.337 -1.359 -3.736 1.00 . A A . 16 HIS CG 1 1 10 3573 1 1 17 HIS H H -3.606 0.638 -1.658 1.00 . A A . 16 HIS H 1 1 10 3574 1 1 17 HIS HA H -5.831 0.794 -2.101 1.00 . A A . 16 HIS HA 1 1 10 3575 1 1 17 HIS HB2 H -5.711 -2.219 -1.861 1.00 . A A . 16 HIS HB2 1 1 10 3576 1 1 17 HIS HB3 H -7.058 -1.310 -2.539 1.00 . A A . 16 HIS HB3 1 1 10 3577 1 1 17 HIS HD1 H -3.479 -2.231 -3.254 1.00 . A A . 16 HIS HD1 1 1 10 3578 1 1 17 HIS HD2 H -6.745 -0.510 -5.163 1.00 . A A . 16 HIS HD2 1 1 10 3579 1 1 17 HIS HE1 H -2.837 -2.082 -5.681 1.00 . A A . 16 HIS HE1 1 1 10 3580 1 1 17 HIS HE2 H -4.827 -1.036 -6.818 1.00 . A A . 16 HIS HE2 1 1 10 3581 1 1 17 HIS N N -4.147 -0.103 -1.313 1.00 . A A . 16 HIS N 1 1 10 3582 1 1 17 HIS ND1 N -4.069 -1.862 -3.944 1.00 . A A . 16 HIS ND1 1 1 10 3583 1 1 17 HIS NE2 N -4.787 -1.220 -5.857 1.00 . A A . 16 HIS NE2 1 1 10 3584 1 1 17 HIS O O -5.787 0.121 0.830 1.00 . A A . 16 HIS O 1 1 10 3585 1 1 18 SER C C -8.023 -1.387 1.873 1.00 . A A . 17 SER C 1 1 10 3586 1 1 18 SER CA C -8.520 -0.360 0.861 1.00 . A A . 17 SER CA 1 1 10 3587 1 1 18 SER CB C -9.965 -0.674 0.467 1.00 . A A . 17 SER CB 1 1 10 3588 1 1 18 SER H H -8.065 -0.502 -1.202 1.00 . A A . 17 SER H 1 1 10 3589 1 1 18 SER HA H -8.485 0.620 1.313 1.00 . A A . 17 SER HA 1 1 10 3590 1 1 18 SER HB2 H -10.582 -0.686 1.353 1.00 . A A . 17 SER HB2 1 1 10 3591 1 1 18 SER HB3 H -10.323 0.086 -0.212 1.00 . A A . 17 SER HB3 1 1 10 3592 1 1 18 SER HG H -10.756 -2.451 0.238 1.00 . A A . 17 SER HG 1 1 10 3593 1 1 18 SER N N -7.667 -0.337 -0.322 1.00 . A A . 17 SER N 1 1 10 3594 1 1 18 SER O O -7.682 -2.514 1.512 1.00 . A A . 17 SER O 1 1 10 3595 1 1 18 SER OG O -10.058 -1.936 -0.171 1.00 . A A . 17 SER OG 1 1 10 3596 1 1 19 THR C C -8.641 -2.818 4.651 1.00 . A A . 18 THR C 1 1 10 3597 1 1 19 THR CA C -7.530 -1.872 4.207 1.00 . A A . 18 THR CA 1 1 10 3598 1 1 19 THR CB C -7.033 -1.073 5.427 1.00 . A A . 18 THR CB 1 1 10 3599 1 1 19 THR CG2 C -8.121 -0.143 5.945 1.00 . A A . 18 THR CG2 1 1 10 3600 1 1 19 THR H H -8.270 -0.079 3.364 1.00 . A A . 18 THR H 1 1 10 3601 1 1 19 THR HA H -6.705 -2.457 3.826 1.00 . A A . 18 THR HA 1 1 10 3602 1 1 19 THR HB H -6.184 -0.477 5.126 1.00 . A A . 18 THR HB 1 1 10 3603 1 1 19 THR HG1 H -6.345 -2.801 6.084 1.00 . A A . 18 THR HG1 1 1 10 3604 1 1 19 THR HG21 H -8.982 -0.724 6.242 1.00 . A A . 18 THR HG21 1 1 10 3605 1 1 19 THR HG22 H -8.405 0.548 5.165 1.00 . A A . 18 THR HG22 1 1 10 3606 1 1 19 THR HG23 H -7.748 0.408 6.796 1.00 . A A . 18 THR HG23 1 1 10 3607 1 1 19 THR N N -7.985 -0.988 3.140 1.00 . A A . 18 THR N 1 1 10 3608 1 1 19 THR O O -9.825 -2.512 4.504 1.00 . A A . 18 THR O 1 1 10 3609 1 1 19 THR OG1 O -6.630 -1.970 6.468 1.00 . A A . 18 THR OG1 1 1 10 3610 1 1 20 ALA C C -8.672 -5.731 6.857 1.00 . A A . 19 ALA C 1 1 10 3611 1 1 20 ALA CA C -9.215 -4.958 5.660 1.00 . A A . 19 ALA CA 1 1 10 3612 1 1 20 ALA CB C -9.576 -5.912 4.532 1.00 . A A . 19 ALA CB 1 1 10 3613 1 1 20 ALA H H -7.294 -4.153 5.283 1.00 . A A . 19 ALA H 1 1 10 3614 1 1 20 ALA HA H -10.112 -4.436 5.959 1.00 . A A . 19 ALA HA 1 1 10 3615 1 1 20 ALA HB1 H -8.695 -6.457 4.225 1.00 . A A . 19 ALA HB1 1 1 10 3616 1 1 20 ALA HB2 H -9.962 -5.350 3.694 1.00 . A A . 19 ALA HB2 1 1 10 3617 1 1 20 ALA HB3 H -10.327 -6.608 4.876 1.00 . A A . 19 ALA HB3 1 1 10 3618 1 1 20 ALA N N -8.252 -3.967 5.195 1.00 . A A . 19 ALA N 1 1 10 3619 1 1 20 ALA O O -7.593 -6.322 6.788 1.00 . A A . 19 ALA O 1 1 10 3620 1 1 21 ILE C C -10.233 -6.949 9.927 1.00 . A A . 20 ILE C 1 1 10 3621 1 1 21 ILE CA C -9.020 -6.425 9.164 1.00 . A A . 20 ILE CA 1 1 10 3622 1 1 21 ILE CB C -8.192 -5.511 10.091 1.00 . A A . 20 ILE CB 1 1 10 3623 1 1 21 ILE CD1 C -6.823 -7.424 11.072 1.00 . A A . 20 ILE CD1 1 1 10 3624 1 1 21 ILE CG1 C -7.758 -6.267 11.350 1.00 . A A . 20 ILE CG1 1 1 10 3625 1 1 21 ILE CG2 C -8.986 -4.267 10.462 1.00 . A A . 20 ILE CG2 1 1 10 3626 1 1 21 ILE H H -10.274 -5.235 7.944 1.00 . A A . 20 ILE H 1 1 10 3627 1 1 21 ILE HA H -8.401 -7.262 8.873 1.00 . A A . 20 ILE HA 1 1 10 3628 1 1 21 ILE HB H -7.311 -5.194 9.551 1.00 . A A . 20 ILE HB 1 1 10 3629 1 1 21 ILE HD11 H -5.931 -7.057 10.587 1.00 . A A . 20 ILE HD11 1 1 10 3630 1 1 21 ILE HD12 H -7.314 -8.139 10.428 1.00 . A A . 20 ILE HD12 1 1 10 3631 1 1 21 ILE HD13 H -6.555 -7.902 12.003 1.00 . A A . 20 ILE HD13 1 1 10 3632 1 1 21 ILE HG12 H -7.252 -5.585 12.015 1.00 . A A . 20 ILE HG12 1 1 10 3633 1 1 21 ILE HG13 H -8.635 -6.662 11.844 1.00 . A A . 20 ILE HG13 1 1 10 3634 1 1 21 ILE HG21 H -9.890 -4.559 10.978 1.00 . A A . 20 ILE HG21 1 1 10 3635 1 1 21 ILE HG22 H -9.244 -3.724 9.565 1.00 . A A . 20 ILE HG22 1 1 10 3636 1 1 21 ILE HG23 H -8.391 -3.638 11.106 1.00 . A A . 20 ILE HG23 1 1 10 3637 1 1 21 ILE N N -9.425 -5.723 7.951 1.00 . A A . 20 ILE N 1 1 10 3638 1 1 21 ILE O O -11.250 -6.264 10.041 1.00 . A A . 20 ILE O 1 1 10 3639 1 1 22 GLY C C -12.447 -8.980 10.339 1.00 . A A . 21 GLY C 1 1 10 3640 1 1 22 GLY CA C -11.212 -8.764 11.191 1.00 . A A . 21 GLY CA 1 1 10 3641 1 1 22 GLY H H -9.284 -8.667 10.320 1.00 . A A . 21 GLY H 1 1 10 3642 1 1 22 GLY HA2 H -10.887 -9.718 11.583 1.00 . A A . 21 GLY HA2 1 1 10 3643 1 1 22 GLY HA3 H -11.465 -8.117 12.016 1.00 . A A . 21 GLY HA3 1 1 10 3644 1 1 22 GLY N N -10.119 -8.168 10.444 1.00 . A A . 21 GLY N 1 1 10 3645 1 1 22 GLY O O -13.557 -9.087 10.860 1.00 . A A . 21 GLY O 1 1 10 3646 1 1 23 ARG C C -13.516 -10.726 7.752 1.00 . A A . 22 ARG C 1 1 10 3647 1 1 23 ARG CA C -13.361 -9.248 8.098 1.00 . A A . 22 ARG CA 1 1 10 3648 1 1 23 ARG CB C -13.143 -8.431 6.823 1.00 . A A . 22 ARG CB 1 1 10 3649 1 1 23 ARG CD C -14.308 -6.295 7.485 1.00 . A A . 22 ARG CD 1 1 10 3650 1 1 23 ARG CG C -12.993 -6.936 7.065 1.00 . A A . 22 ARG CG 1 1 10 3651 1 1 23 ARG CZ C -15.867 -6.346 9.388 1.00 . A A . 22 ARG CZ 1 1 10 3652 1 1 23 ARG H H -11.345 -8.952 8.671 1.00 . A A . 22 ARG H 1 1 10 3653 1 1 23 ARG HA H -14.264 -8.908 8.583 1.00 . A A . 22 ARG HA 1 1 10 3654 1 1 23 ARG HB2 H -12.247 -8.785 6.332 1.00 . A A . 22 ARG HB2 1 1 10 3655 1 1 23 ARG HB3 H -13.986 -8.583 6.164 1.00 . A A . 22 ARG HB3 1 1 10 3656 1 1 23 ARG HD2 H -14.196 -5.222 7.450 1.00 . A A . 22 ARG HD2 1 1 10 3657 1 1 23 ARG HD3 H -15.078 -6.600 6.793 1.00 . A A . 22 ARG HD3 1 1 10 3658 1 1 23 ARG HE H -14.076 -7.225 9.357 1.00 . A A . 22 ARG HE 1 1 10 3659 1 1 23 ARG HG2 H -12.263 -6.782 7.847 1.00 . A A . 22 ARG HG2 1 1 10 3660 1 1 23 ARG HG3 H -12.651 -6.468 6.155 1.00 . A A . 22 ARG HG3 1 1 10 3661 1 1 23 ARG HH11 H -16.527 -5.316 7.780 1.00 . A A . 22 ARG HH11 1 1 10 3662 1 1 23 ARG HH12 H -17.613 -5.360 9.129 1.00 . A A . 22 ARG HH12 1 1 10 3663 1 1 23 ARG HH21 H -17.029 -6.484 11.037 1.00 . A A . 22 ARG HH21 1 1 10 3664 1 1 23 ARG HH22 H -15.500 -7.292 11.137 1.00 . A A . 22 ARG HH22 1 1 10 3665 1 1 23 ARG N N -12.254 -9.044 9.026 1.00 . A A . 22 ARG N 1 1 10 3666 1 1 23 ARG NE N -14.706 -6.685 8.836 1.00 . A A . 22 ARG NE 1 1 10 3667 1 1 23 ARG NH1 N -16.740 -5.614 8.711 1.00 . A A . 22 ARG NH1 1 1 10 3668 1 1 23 ARG NH2 N -16.155 -6.739 10.622 1.00 . A A . 22 ARG NH2 1 1 10 3669 1 1 23 ARG O O -12.868 -11.176 6.784 1.00 . A A . 22 ARG O 1 1 10 3670 1 1 23 ARG OXT O -14.283 -11.420 8.452 1.00 . A A . 22 ARG OXT 1 1 11 3671 1 1 1 ACE C C 7.649 -1.976 9.280 1.00 . A A . 0 ACE C 1 1 11 3672 1 1 1 ACE CH3 C 8.393 -2.891 10.215 1.00 . A A . 0 ACE CH3 1 1 11 3673 1 1 1 ACE H1 H 8.403 -2.445 11.203 1.00 . A A . 0 ACE H1 1 1 11 3674 1 1 1 ACE H2 H 9.401 -3.014 9.868 1.00 . A A . 0 ACE H2 1 1 11 3675 1 1 1 ACE H3 H 7.894 -3.855 10.226 1.00 . A A . 0 ACE H3 1 1 11 3676 1 1 1 ACE O O 6.529 -2.271 8.866 1.00 . A A . 0 ACE O 1 1 11 3677 1 1 2 MET C C 7.983 -0.202 6.587 1.00 . A A . 1 MET C 1 1 11 3678 1 1 2 MET CA C 7.662 0.121 8.043 1.00 . A A . 1 MET CA 1 1 11 3679 1 1 2 MET CB C 8.145 1.535 8.376 1.00 . A A . 1 MET CB 1 1 11 3680 1 1 2 MET CE C 7.361 2.067 12.444 1.00 . A A . 1 MET CE 1 1 11 3681 1 1 2 MET CG C 7.593 2.082 9.682 1.00 . A A . 1 MET CG 1 1 11 3682 1 1 2 MET H H 9.165 -0.673 9.304 1.00 . A A . 1 MET H 1 1 11 3683 1 1 2 MET HA H 6.593 0.074 8.181 1.00 . A A . 1 MET HA 1 1 11 3684 1 1 2 MET HB2 H 9.223 1.528 8.441 1.00 . A A . 1 MET HB2 1 1 11 3685 1 1 2 MET HB3 H 7.847 2.200 7.578 1.00 . A A . 1 MET HB3 1 1 11 3686 1 1 2 MET HE1 H 7.630 1.632 13.395 1.00 . A A . 1 MET HE1 1 1 11 3687 1 1 2 MET HE2 H 6.292 2.004 12.307 1.00 . A A . 1 MET HE2 1 1 11 3688 1 1 2 MET HE3 H 7.666 3.103 12.425 1.00 . A A . 1 MET HE3 1 1 11 3689 1 1 2 MET HG2 H 7.890 3.117 9.777 1.00 . A A . 1 MET HG2 1 1 11 3690 1 1 2 MET HG3 H 6.515 2.022 9.655 1.00 . A A . 1 MET HG3 1 1 11 3691 1 1 2 MET N N 8.273 -0.851 8.942 1.00 . A A . 1 MET N 1 1 11 3692 1 1 2 MET O O 9.119 -0.033 6.142 1.00 . A A . 1 MET O 1 1 11 3693 1 1 2 MET SD S 8.185 1.178 11.126 1.00 . A A . 1 MET SD 1 1 11 3694 1 1 3 ASN C C 6.312 -0.100 3.562 1.00 . A A . 2 ASN C 1 1 11 3695 1 1 3 ASN CA C 7.160 -1.010 4.446 1.00 . A A . 2 ASN CA 1 1 11 3696 1 1 3 ASN CB C 6.791 -2.473 4.193 1.00 . A A . 2 ASN CB 1 1 11 3697 1 1 3 ASN CG C 7.478 -3.051 2.966 1.00 . A A . 2 ASN CG 1 1 11 3698 1 1 3 ASN H H 6.099 -0.789 6.265 1.00 . A A . 2 ASN H 1 1 11 3699 1 1 3 ASN HA H 8.201 -0.862 4.200 1.00 . A A . 2 ASN HA 1 1 11 3700 1 1 3 ASN HB2 H 7.077 -3.062 5.051 1.00 . A A . 2 ASN HB2 1 1 11 3701 1 1 3 ASN HB3 H 5.723 -2.548 4.051 1.00 . A A . 2 ASN HB3 1 1 11 3702 1 1 3 ASN HD21 H 7.623 -1.243 2.135 1.00 . A A . 2 ASN HD21 1 1 11 3703 1 1 3 ASN HD22 H 8.267 -2.548 1.207 1.00 . A A . 2 ASN HD22 1 1 11 3704 1 1 3 ASN N N 6.980 -0.670 5.853 1.00 . A A . 2 ASN N 1 1 11 3705 1 1 3 ASN ND2 N 7.824 -2.194 2.006 1.00 . A A . 2 ASN ND2 1 1 11 3706 1 1 3 ASN O O 5.986 -0.446 2.427 1.00 . A A . 2 ASN O 1 1 11 3707 1 1 3 ASN OD1 O 7.703 -4.258 2.882 1.00 . A A . 2 ASN OD1 1 1 11 3708 1 1 4 TRP C C 5.990 2.658 2.254 1.00 . A A . 3 TRP C 1 1 11 3709 1 1 4 TRP CA C 5.152 2.013 3.329 1.00 . A A . 3 TRP CA 1 1 11 3710 1 1 4 TRP CB C 4.588 3.106 4.217 1.00 . A A . 3 TRP CB 1 1 11 3711 1 1 4 TRP CD1 C 6.127 3.623 6.177 1.00 . A A . 3 TRP CD1 1 1 11 3712 1 1 4 TRP CD2 C 6.322 5.049 4.475 1.00 . A A . 3 TRP CD2 1 1 11 3713 1 1 4 TRP CE2 C 7.192 5.458 5.496 1.00 . A A . 3 TRP CE2 1 1 11 3714 1 1 4 TRP CE3 C 6.278 5.789 3.296 1.00 . A A . 3 TRP CE3 1 1 11 3715 1 1 4 TRP CG C 5.636 3.885 4.943 1.00 . A A . 3 TRP CG 1 1 11 3716 1 1 4 TRP CH2 C 7.942 7.285 4.205 1.00 . A A . 3 TRP CH2 1 1 11 3717 1 1 4 TRP CZ2 C 8.004 6.577 5.372 1.00 . A A . 3 TRP CZ2 1 1 11 3718 1 1 4 TRP CZ3 C 7.090 6.897 3.170 1.00 . A A . 3 TRP CZ3 1 1 11 3719 1 1 4 TRP H H 6.218 1.283 5.005 1.00 . A A . 3 TRP H 1 1 11 3720 1 1 4 TRP HA H 4.340 1.479 2.869 1.00 . A A . 3 TRP HA 1 1 11 3721 1 1 4 TRP HB2 H 4.033 3.800 3.602 1.00 . A A . 3 TRP HB2 1 1 11 3722 1 1 4 TRP HB3 H 3.927 2.667 4.948 1.00 . A A . 3 TRP HB3 1 1 11 3723 1 1 4 TRP HD1 H 5.814 2.793 6.778 1.00 . A A . 3 TRP HD1 1 1 11 3724 1 1 4 TRP HE1 H 7.538 4.607 7.383 1.00 . A A . 3 TRP HE1 1 1 11 3725 1 1 4 TRP HE3 H 5.633 5.499 2.487 1.00 . A A . 3 TRP HE3 1 1 11 3726 1 1 4 TRP HH2 H 8.559 8.159 4.068 1.00 . A A . 3 TRP HH2 1 1 11 3727 1 1 4 TRP HZ2 H 8.657 6.891 6.159 1.00 . A A . 3 TRP HZ2 1 1 11 3728 1 1 4 TRP HZ3 H 7.067 7.481 2.263 1.00 . A A . 3 TRP HZ3 1 1 11 3729 1 1 4 TRP N N 5.948 1.062 4.090 1.00 . A A . 3 TRP N 1 1 11 3730 1 1 4 TRP NE1 N 7.053 4.572 6.531 1.00 . A A . 3 TRP NE1 1 1 11 3731 1 1 4 TRP O O 5.468 3.379 1.406 1.00 . A A . 3 TRP O 1 1 11 3732 1 1 5 THR C C 7.693 2.776 -0.073 1.00 . A A . 4 THR C 1 1 11 3733 1 1 5 THR CA C 8.213 2.980 1.347 1.00 . A A . 4 THR CA 1 1 11 3734 1 1 5 THR CB C 9.620 2.361 1.473 1.00 . A A . 4 THR CB 1 1 11 3735 1 1 5 THR CG2 C 10.589 3.001 0.489 1.00 . A A . 4 THR CG2 1 1 11 3736 1 1 5 THR H H 7.641 1.832 3.021 1.00 . A A . 4 THR H 1 1 11 3737 1 1 5 THR HA H 8.283 4.037 1.557 1.00 . A A . 4 THR HA 1 1 11 3738 1 1 5 THR HB H 9.554 1.305 1.256 1.00 . A A . 4 THR HB 1 1 11 3739 1 1 5 THR HG1 H 9.778 3.360 3.167 1.00 . A A . 4 THR HG1 1 1 11 3740 1 1 5 THR HG21 H 11.548 2.511 0.559 1.00 . A A . 4 THR HG21 1 1 11 3741 1 1 5 THR HG22 H 10.702 4.048 0.726 1.00 . A A . 4 THR HG22 1 1 11 3742 1 1 5 THR HG23 H 10.203 2.898 -0.514 1.00 . A A . 4 THR HG23 1 1 11 3743 1 1 5 THR N N 7.293 2.411 2.311 1.00 . A A . 4 THR N 1 1 11 3744 1 1 5 THR O O 8.061 1.816 -0.751 1.00 . A A . 4 THR O 1 1 11 3745 1 1 5 THR OG1 O 10.110 2.534 2.808 1.00 . A A . 4 THR OG1 1 1 11 3746 1 1 6 GLY C C 4.901 4.280 -1.956 1.00 . A A . 5 GLY C 1 1 11 3747 1 1 6 GLY CA C 6.247 3.577 -1.834 1.00 . A A . 5 GLY CA 1 1 11 3748 1 1 6 GLY H H 6.578 4.426 0.074 1.00 . A A . 5 GLY H 1 1 11 3749 1 1 6 GLY HA2 H 6.933 4.012 -2.546 1.00 . A A . 5 GLY HA2 1 1 11 3750 1 1 6 GLY HA3 H 6.117 2.531 -2.069 1.00 . A A . 5 GLY HA3 1 1 11 3751 1 1 6 GLY N N 6.824 3.681 -0.510 1.00 . A A . 5 GLY N 1 1 11 3752 1 1 6 GLY O O 4.132 3.991 -2.870 1.00 . A A . 5 GLY O 1 1 11 3753 1 1 7 LEU C C 3.598 7.381 -1.462 1.00 . A A . 6 LEU C 1 1 11 3754 1 1 7 LEU CA C 3.348 5.938 -1.050 1.00 . A A . 6 LEU CA 1 1 11 3755 1 1 7 LEU CB C 2.682 5.917 0.327 1.00 . A A . 6 LEU CB 1 1 11 3756 1 1 7 LEU CD1 C 4.065 7.665 1.522 1.00 . A A . 6 LEU CD1 1 1 11 3757 1 1 7 LEU CD2 C 2.959 5.857 2.829 1.00 . A A . 6 LEU CD2 1 1 11 3758 1 1 7 LEU CG C 3.618 6.209 1.506 1.00 . A A . 6 LEU CG 1 1 11 3759 1 1 7 LEU H H 5.236 5.348 -0.297 1.00 . A A . 6 LEU H 1 1 11 3760 1 1 7 LEU HA H 2.692 5.475 -1.771 1.00 . A A . 6 LEU HA 1 1 11 3761 1 1 7 LEU HB2 H 1.895 6.654 0.330 1.00 . A A . 6 LEU HB2 1 1 11 3762 1 1 7 LEU HB3 H 2.243 4.943 0.474 1.00 . A A . 6 LEU HB3 1 1 11 3763 1 1 7 LEU HD11 H 4.611 7.885 0.617 1.00 . A A . 6 LEU HD11 1 1 11 3764 1 1 7 LEU HD12 H 4.706 7.833 2.378 1.00 . A A . 6 LEU HD12 1 1 11 3765 1 1 7 LEU HD13 H 3.200 8.307 1.588 1.00 . A A . 6 LEU HD13 1 1 11 3766 1 1 7 LEU HD21 H 2.110 6.503 2.992 1.00 . A A . 6 LEU HD21 1 1 11 3767 1 1 7 LEU HD22 H 3.676 5.990 3.632 1.00 . A A . 6 LEU HD22 1 1 11 3768 1 1 7 LEU HD23 H 2.631 4.829 2.805 1.00 . A A . 6 LEU HD23 1 1 11 3769 1 1 7 LEU HG H 4.500 5.596 1.404 1.00 . A A . 6 LEU HG 1 1 11 3770 1 1 7 LEU N N 4.604 5.187 -1.025 1.00 . A A . 6 LEU N 1 1 11 3771 1 1 7 LEU O O 2.746 8.251 -1.281 1.00 . A A . 6 LEU O 1 1 11 3772 1 1 8 TYR C C 5.892 8.964 -3.781 1.00 . A A . 7 TYR C 1 1 11 3773 1 1 8 TYR CA C 5.166 8.955 -2.433 1.00 . A A . 7 TYR CA 1 1 11 3774 1 1 8 TYR CB C 6.060 9.567 -1.355 1.00 . A A . 7 TYR CB 1 1 11 3775 1 1 8 TYR CD1 C 6.940 7.393 -0.462 1.00 . A A . 7 TYR CD1 1 1 11 3776 1 1 8 TYR CD2 C 8.521 9.051 -1.108 1.00 . A A . 7 TYR CD2 1 1 11 3777 1 1 8 TYR CE1 C 7.953 6.544 -0.128 1.00 . A A . 7 TYR CE1 1 1 11 3778 1 1 8 TYR CE2 C 9.555 8.200 -0.766 1.00 . A A . 7 TYR CE2 1 1 11 3779 1 1 8 TYR CG C 7.197 8.660 -0.958 1.00 . A A . 7 TYR CG 1 1 11 3780 1 1 8 TYR CZ C 9.265 6.944 -0.277 1.00 . A A . 7 TYR CZ 1 1 11 3781 1 1 8 TYR H H 5.394 6.879 -2.143 1.00 . A A . 7 TYR H 1 1 11 3782 1 1 8 TYR HA H 4.276 9.541 -2.512 1.00 . A A . 7 TYR HA 1 1 11 3783 1 1 8 TYR HB2 H 6.478 10.492 -1.720 1.00 . A A . 7 TYR HB2 1 1 11 3784 1 1 8 TYR HB3 H 5.468 9.760 -0.476 1.00 . A A . 7 TYR HB3 1 1 11 3785 1 1 8 TYR HD1 H 5.914 7.073 -0.331 1.00 . A A . 7 TYR HD1 1 1 11 3786 1 1 8 TYR HD2 H 8.739 10.037 -1.492 1.00 . A A . 7 TYR HD2 1 1 11 3787 1 1 8 TYR HE1 H 7.711 5.569 0.239 1.00 . A A . 7 TYR HE1 1 1 11 3788 1 1 8 TYR HE2 H 10.580 8.519 -0.883 1.00 . A A . 7 TYR HE2 1 1 11 3789 1 1 8 TYR HH H 10.951 6.563 0.565 1.00 . A A . 7 TYR HH 1 1 11 3790 1 1 8 TYR N N 4.772 7.619 -2.021 1.00 . A A . 7 TYR N 1 1 11 3791 1 1 8 TYR O O 5.515 9.706 -4.688 1.00 . A A . 7 TYR O 1 1 11 3792 1 1 8 TYR OH O 10.287 6.087 0.060 1.00 . A A . 7 TYR OH 1 1 11 3793 1 1 9 THR C C 7.526 6.779 -5.908 1.00 . A A . 8 THR C 1 1 11 3794 1 1 9 THR CA C 7.716 8.088 -5.146 1.00 . A A . 8 THR CA 1 1 11 3795 1 1 9 THR CB C 9.217 8.272 -4.857 1.00 . A A . 8 THR CB 1 1 11 3796 1 1 9 THR CG2 C 9.507 9.686 -4.377 1.00 . A A . 8 THR CG2 1 1 11 3797 1 1 9 THR H H 7.176 7.555 -3.164 1.00 . A A . 8 THR H 1 1 11 3798 1 1 9 THR HA H 7.395 8.904 -5.775 1.00 . A A . 8 THR HA 1 1 11 3799 1 1 9 THR HB H 9.767 8.099 -5.771 1.00 . A A . 8 THR HB 1 1 11 3800 1 1 9 THR HG1 H 9.196 6.489 -4.010 1.00 . A A . 8 THR HG1 1 1 11 3801 1 1 9 THR HG21 H 8.892 9.908 -3.517 1.00 . A A . 8 THR HG21 1 1 11 3802 1 1 9 THR HG22 H 9.285 10.388 -5.168 1.00 . A A . 8 THR HG22 1 1 11 3803 1 1 9 THR HG23 H 10.550 9.768 -4.106 1.00 . A A . 8 THR HG23 1 1 11 3804 1 1 9 THR N N 6.932 8.139 -3.911 1.00 . A A . 8 THR N 1 1 11 3805 1 1 9 THR O O 8.390 6.381 -6.690 1.00 . A A . 8 THR O 1 1 11 3806 1 1 9 THR OG1 O 9.646 7.327 -3.870 1.00 . A A . 8 THR OG1 1 1 11 3807 1 1 10 LEU C C 4.615 4.649 -6.491 1.00 . A A . 9 LEU C 1 1 11 3808 1 1 10 LEU CA C 6.112 4.859 -6.372 1.00 . A A . 9 LEU CA 1 1 11 3809 1 1 10 LEU CB C 6.753 3.689 -5.621 1.00 . A A . 9 LEU CB 1 1 11 3810 1 1 10 LEU CD1 C 6.618 2.089 -7.552 1.00 . A A . 9 LEU CD1 1 1 11 3811 1 1 10 LEU CD2 C 8.725 3.373 -7.146 1.00 . A A . 9 LEU CD2 1 1 11 3812 1 1 10 LEU CG C 7.528 2.696 -6.496 1.00 . A A . 9 LEU CG 1 1 11 3813 1 1 10 LEU H H 5.742 6.482 -5.059 1.00 . A A . 9 LEU H 1 1 11 3814 1 1 10 LEU HA H 6.527 4.917 -7.355 1.00 . A A . 9 LEU HA 1 1 11 3815 1 1 10 LEU HB2 H 7.434 4.092 -4.884 1.00 . A A . 9 LEU HB2 1 1 11 3816 1 1 10 LEU HB3 H 5.973 3.149 -5.107 1.00 . A A . 9 LEU HB3 1 1 11 3817 1 1 10 LEU HD11 H 6.226 2.873 -8.184 1.00 . A A . 9 LEU HD11 1 1 11 3818 1 1 10 LEU HD12 H 5.800 1.574 -7.070 1.00 . A A . 9 LEU HD12 1 1 11 3819 1 1 10 LEU HD13 H 7.180 1.389 -8.153 1.00 . A A . 9 LEU HD13 1 1 11 3820 1 1 10 LEU HD21 H 9.260 2.656 -7.749 1.00 . A A . 9 LEU HD21 1 1 11 3821 1 1 10 LEU HD22 H 9.380 3.759 -6.378 1.00 . A A . 9 LEU HD22 1 1 11 3822 1 1 10 LEU HD23 H 8.384 4.186 -7.770 1.00 . A A . 9 LEU HD23 1 1 11 3823 1 1 10 LEU HG H 7.896 1.894 -5.876 1.00 . A A . 9 LEU HG 1 1 11 3824 1 1 10 LEU N N 6.398 6.118 -5.690 1.00 . A A . 9 LEU N 1 1 11 3825 1 1 10 LEU O O 4.080 4.420 -7.578 1.00 . A A . 9 LEU O 1 1 11 3826 1 1 11 LEU C C 2.039 3.224 -5.788 1.00 . A A . 10 LEU C 1 1 11 3827 1 1 11 LEU CA C 2.509 4.576 -5.259 1.00 . A A . 10 LEU CA 1 1 11 3828 1 1 11 LEU CB C 1.822 5.719 -5.999 1.00 . A A . 10 LEU CB 1 1 11 3829 1 1 11 LEU CD1 C 1.611 8.200 -6.321 1.00 . A A . 10 LEU CD1 1 1 11 3830 1 1 11 LEU CD2 C 2.963 7.303 -4.408 1.00 . A A . 10 LEU CD2 1 1 11 3831 1 1 11 LEU CG C 2.520 7.076 -5.850 1.00 . A A . 10 LEU CG 1 1 11 3832 1 1 11 LEU H H 4.469 4.929 -4.548 1.00 . A A . 10 LEU H 1 1 11 3833 1 1 11 LEU HA H 2.248 4.640 -4.214 1.00 . A A . 10 LEU HA 1 1 11 3834 1 1 11 LEU HB2 H 1.778 5.470 -7.048 1.00 . A A . 10 LEU HB2 1 1 11 3835 1 1 11 LEU HB3 H 0.814 5.810 -5.623 1.00 . A A . 10 LEU HB3 1 1 11 3836 1 1 11 LEU HD11 H 0.710 8.207 -5.726 1.00 . A A . 10 LEU HD11 1 1 11 3837 1 1 11 LEU HD12 H 1.356 8.047 -7.359 1.00 . A A . 10 LEU HD12 1 1 11 3838 1 1 11 LEU HD13 H 2.121 9.146 -6.211 1.00 . A A . 10 LEU HD13 1 1 11 3839 1 1 11 LEU HD21 H 3.387 8.290 -4.312 1.00 . A A . 10 LEU HD21 1 1 11 3840 1 1 11 LEU HD22 H 3.710 6.564 -4.133 1.00 . A A . 10 LEU HD22 1 1 11 3841 1 1 11 LEU HD23 H 2.113 7.210 -3.749 1.00 . A A . 10 LEU HD23 1 1 11 3842 1 1 11 LEU HG H 3.405 7.082 -6.470 1.00 . A A . 10 LEU HG 1 1 11 3843 1 1 11 LEU N N 3.958 4.733 -5.355 1.00 . A A . 10 LEU N 1 1 11 3844 1 1 11 LEU O O 0.841 2.946 -5.826 1.00 . A A . 10 LEU O 1 1 11 3845 1 1 12 SER C C 3.142 0.028 -5.671 1.00 . A A . 11 SER C 1 1 11 3846 1 1 12 SER CA C 2.673 1.057 -6.688 1.00 . A A . 11 SER CA 1 1 11 3847 1 1 12 SER CB C 3.339 0.808 -8.042 1.00 . A A . 11 SER CB 1 1 11 3848 1 1 12 SER H H 3.923 2.672 -6.154 1.00 . A A . 11 SER H 1 1 11 3849 1 1 12 SER HA H 1.601 0.982 -6.796 1.00 . A A . 11 SER HA 1 1 11 3850 1 1 12 SER HB2 H 3.025 1.570 -8.741 1.00 . A A . 11 SER HB2 1 1 11 3851 1 1 12 SER HB3 H 4.411 0.848 -7.926 1.00 . A A . 11 SER HB3 1 1 11 3852 1 1 12 SER HG H 3.491 -1.143 -8.114 1.00 . A A . 11 SER HG 1 1 11 3853 1 1 12 SER N N 2.987 2.387 -6.192 1.00 . A A . 11 SER N 1 1 11 3854 1 1 12 SER O O 3.049 -1.180 -5.889 1.00 . A A . 11 SER O 1 1 11 3855 1 1 12 SER OG O 2.984 -0.462 -8.561 1.00 . A A . 11 SER OG 1 1 11 3856 1 1 13 ARG C C 3.247 -0.184 -2.250 1.00 . A A . 12 ARG C 1 1 11 3857 1 1 13 ARG CA C 4.149 -0.294 -3.471 1.00 . A A . 12 ARG CA 1 1 11 3858 1 1 13 ARG CB C 5.571 0.133 -3.104 1.00 . A A . 12 ARG CB 1 1 11 3859 1 1 13 ARG CD C 7.973 0.354 -3.803 1.00 . A A . 12 ARG CD 1 1 11 3860 1 1 13 ARG CG C 6.601 -0.187 -4.174 1.00 . A A . 12 ARG CG 1 1 11 3861 1 1 13 ARG CZ C 10.263 0.362 -4.705 1.00 . A A . 12 ARG CZ 1 1 11 3862 1 1 13 ARG H H 3.688 1.513 -4.454 1.00 . A A . 12 ARG H 1 1 11 3863 1 1 13 ARG HA H 4.158 -1.315 -3.810 1.00 . A A . 12 ARG HA 1 1 11 3864 1 1 13 ARG HB2 H 5.576 1.203 -2.940 1.00 . A A . 12 ARG HB2 1 1 11 3865 1 1 13 ARG HB3 H 5.861 -0.365 -2.191 1.00 . A A . 12 ARG HB3 1 1 11 3866 1 1 13 ARG HD2 H 7.915 1.430 -3.730 1.00 . A A . 12 ARG HD2 1 1 11 3867 1 1 13 ARG HD3 H 8.262 -0.056 -2.847 1.00 . A A . 12 ARG HD3 1 1 11 3868 1 1 13 ARG HE H 8.701 -0.531 -5.566 1.00 . A A . 12 ARG HE 1 1 11 3869 1 1 13 ARG HG2 H 6.666 -1.259 -4.288 1.00 . A A . 12 ARG HG2 1 1 11 3870 1 1 13 ARG HG3 H 6.289 0.259 -5.107 1.00 . A A . 12 ARG HG3 1 1 11 3871 1 1 13 ARG HH11 H 10.037 1.357 -2.960 1.00 . A A . 12 ARG HH11 1 1 11 3872 1 1 13 ARG HH12 H 11.643 1.351 -3.608 1.00 . A A . 12 ARG HH12 1 1 11 3873 1 1 13 ARG HH21 H 12.083 0.272 -5.580 1.00 . A A . 12 ARG HH21 1 1 11 3874 1 1 13 ARG HH22 H 10.811 -0.543 -6.427 1.00 . A A . 12 ARG HH22 1 1 11 3875 1 1 13 ARG N N 3.649 0.538 -4.553 1.00 . A A . 12 ARG N 1 1 11 3876 1 1 13 ARG NE N 8.986 0.001 -4.794 1.00 . A A . 12 ARG NE 1 1 11 3877 1 1 13 ARG NH1 N 10.682 1.082 -3.673 1.00 . A A . 12 ARG NH1 1 1 11 3878 1 1 13 ARG NH2 N 11.123 0.001 -5.648 1.00 . A A . 12 ARG NH2 1 1 11 3879 1 1 13 ARG O O 3.533 -0.752 -1.196 1.00 . A A . 12 ARG O 1 1 11 3880 1 1 14 VAL C C -0.099 0.011 -1.597 1.00 . A A . 13 VAL C 1 1 11 3881 1 1 14 VAL CA C 1.203 0.753 -1.325 1.00 . A A . 13 VAL CA 1 1 11 3882 1 1 14 VAL CB C 0.910 2.252 -1.125 1.00 . A A . 13 VAL CB 1 1 11 3883 1 1 14 VAL CG1 C 0.290 2.843 -2.377 1.00 . A A . 13 VAL CG1 1 1 11 3884 1 1 14 VAL CG2 C 0.012 2.474 0.078 1.00 . A A . 13 VAL CG2 1 1 11 3885 1 1 14 VAL H H 1.986 0.968 -3.275 1.00 . A A . 13 VAL H 1 1 11 3886 1 1 14 VAL HA H 1.639 0.367 -0.426 1.00 . A A . 13 VAL HA 1 1 11 3887 1 1 14 VAL HB H 1.843 2.760 -0.943 1.00 . A A . 13 VAL HB 1 1 11 3888 1 1 14 VAL HG11 H 0.234 3.916 -2.280 1.00 . A A . 13 VAL HG11 1 1 11 3889 1 1 14 VAL HG12 H -0.702 2.441 -2.510 1.00 . A A . 13 VAL HG12 1 1 11 3890 1 1 14 VAL HG13 H 0.900 2.589 -3.231 1.00 . A A . 13 VAL HG13 1 1 11 3891 1 1 14 VAL HG21 H -0.953 2.027 -0.109 1.00 . A A . 13 VAL HG21 1 1 11 3892 1 1 14 VAL HG22 H -0.106 3.533 0.249 1.00 . A A . 13 VAL HG22 1 1 11 3893 1 1 14 VAL HG23 H 0.458 2.016 0.948 1.00 . A A . 13 VAL HG23 1 1 11 3894 1 1 14 VAL N N 2.156 0.551 -2.407 1.00 . A A . 13 VAL N 1 1 11 3895 1 1 14 VAL O O -0.989 -0.048 -0.749 1.00 . A A . 13 VAL O 1 1 11 3896 1 1 15 ASN C C -2.613 -0.401 -3.114 1.00 . A A . 14 ASN C 1 1 11 3897 1 1 15 ASN CA C -1.383 -1.301 -3.193 1.00 . A A . 14 ASN CA 1 1 11 3898 1 1 15 ASN CB C -1.582 -2.541 -2.317 1.00 . A A . 14 ASN CB 1 1 11 3899 1 1 15 ASN CG C -0.542 -3.617 -2.576 1.00 . A A . 14 ASN CG 1 1 11 3900 1 1 15 ASN H H 0.571 -0.508 -3.396 1.00 . A A . 14 ASN H 1 1 11 3901 1 1 15 ASN HA H -1.245 -1.610 -4.217 1.00 . A A . 14 ASN HA 1 1 11 3902 1 1 15 ASN HB2 H -1.521 -2.252 -1.278 1.00 . A A . 14 ASN HB2 1 1 11 3903 1 1 15 ASN HB3 H -2.559 -2.959 -2.513 1.00 . A A . 14 ASN HB3 1 1 11 3904 1 1 15 ASN HD21 H 1.354 -3.882 -3.113 1.00 . A A . 14 ASN HD21 1 1 11 3905 1 1 15 ASN HD22 H 0.824 -2.241 -3.022 1.00 . A A . 14 ASN HD22 1 1 11 3906 1 1 15 ASN N N -0.190 -0.567 -2.784 1.00 . A A . 14 ASN N 1 1 11 3907 1 1 15 ASN ND2 N 0.667 -3.205 -2.940 1.00 . A A . 14 ASN ND2 1 1 11 3908 1 1 15 ASN O O -3.748 -0.871 -3.188 1.00 . A A . 14 ASN O 1 1 11 3909 1 1 15 ASN OD1 O -0.823 -4.808 -2.446 1.00 . A A . 14 ASN OD1 1 1 11 3910 1 1 16 ARG C C -4.376 1.571 -1.708 1.00 . A A . 15 ARG C 1 1 11 3911 1 1 16 ARG CA C -3.436 1.887 -2.869 1.00 . A A . 15 ARG CA 1 1 11 3912 1 1 16 ARG CB C -4.225 1.951 -4.178 1.00 . A A . 15 ARG CB 1 1 11 3913 1 1 16 ARG CD C -4.206 2.361 -6.657 1.00 . A A . 15 ARG CD 1 1 11 3914 1 1 16 ARG CG C -3.375 2.317 -5.385 1.00 . A A . 15 ARG CG 1 1 11 3915 1 1 16 ARG CZ C -3.890 2.796 -9.058 1.00 . A A . 15 ARG CZ 1 1 11 3916 1 1 16 ARG H H -1.439 1.202 -2.923 1.00 . A A . 15 ARG H 1 1 11 3917 1 1 16 ARG HA H -2.975 2.848 -2.690 1.00 . A A . 15 ARG HA 1 1 11 3918 1 1 16 ARG HB2 H -4.676 0.987 -4.361 1.00 . A A . 15 ARG HB2 1 1 11 3919 1 1 16 ARG HB3 H -5.007 2.690 -4.078 1.00 . A A . 15 ARG HB3 1 1 11 3920 1 1 16 ARG HD2 H -4.654 1.391 -6.813 1.00 . A A . 15 ARG HD2 1 1 11 3921 1 1 16 ARG HD3 H -4.983 3.101 -6.539 1.00 . A A . 15 ARG HD3 1 1 11 3922 1 1 16 ARG HE H -2.445 2.872 -7.684 1.00 . A A . 15 ARG HE 1 1 11 3923 1 1 16 ARG HG2 H -2.934 3.289 -5.221 1.00 . A A . 15 ARG HG2 1 1 11 3924 1 1 16 ARG HG3 H -2.595 1.579 -5.501 1.00 . A A . 15 ARG HG3 1 1 11 3925 1 1 16 ARG HH11 H -5.544 2.645 -10.210 1.00 . A A . 15 ARG HH11 1 1 11 3926 1 1 16 ARG HH12 H -5.784 2.335 -8.523 1.00 . A A . 15 ARG HH12 1 1 11 3927 1 1 16 ARG HH21 H -3.461 3.182 -10.995 1.00 . A A . 15 ARG HH21 1 1 11 3928 1 1 16 ARG HH22 H -2.119 3.280 -9.904 1.00 . A A . 15 ARG HH22 1 1 11 3929 1 1 16 ARG N N -2.368 0.899 -2.965 1.00 . A A . 15 ARG N 1 1 11 3930 1 1 16 ARG NE N -3.400 2.703 -7.826 1.00 . A A . 15 ARG NE 1 1 11 3931 1 1 16 ARG NH1 N -5.179 2.573 -9.282 1.00 . A A . 15 ARG NH1 1 1 11 3932 1 1 16 ARG NH2 N -3.092 3.112 -10.068 1.00 . A A . 15 ARG NH2 1 1 11 3933 1 1 16 ARG O O -4.165 0.611 -0.967 1.00 . A A . 15 ARG O 1 1 11 3934 1 1 17 HIS C C -5.721 2.212 0.882 1.00 . A A . 16 HIS C 1 1 11 3935 1 1 17 HIS CA C -6.392 2.207 -0.488 1.00 . A A . 16 HIS CA 1 1 11 3936 1 1 17 HIS CB C -7.158 0.898 -0.691 1.00 . A A . 16 HIS CB 1 1 11 3937 1 1 17 HIS CD2 C -9.118 1.382 -2.319 1.00 . A A . 16 HIS CD2 1 1 11 3938 1 1 17 HIS CE1 C -8.358 0.298 -4.067 1.00 . A A . 16 HIS CE1 1 1 11 3939 1 1 17 HIS CG C -7.924 0.844 -1.976 1.00 . A A . 16 HIS CG 1 1 11 3940 1 1 17 HIS H H -5.522 3.141 -2.178 1.00 . A A . 16 HIS H 1 1 11 3941 1 1 17 HIS HA H -7.090 3.030 -0.535 1.00 . A A . 16 HIS HA 1 1 11 3942 1 1 17 HIS HB2 H -6.459 0.075 -0.686 1.00 . A A . 16 HIS HB2 1 1 11 3943 1 1 17 HIS HB3 H -7.861 0.771 0.120 1.00 . A A . 16 HIS HB3 1 1 11 3944 1 1 17 HIS HD1 H -6.633 -0.326 -3.161 1.00 . A A . 16 HIS HD1 1 1 11 3945 1 1 17 HIS HD2 H -9.759 1.979 -1.685 1.00 . A A . 16 HIS HD2 1 1 11 3946 1 1 17 HIS HE1 H -8.272 -0.124 -5.057 1.00 . A A . 16 HIS HE1 1 1 11 3947 1 1 17 HIS HE2 H -10.158 1.276 -4.142 1.00 . A A . 16 HIS HE2 1 1 11 3948 1 1 17 HIS N N -5.414 2.392 -1.556 1.00 . A A . 16 HIS N 1 1 11 3949 1 1 17 HIS ND1 N -7.474 0.171 -3.092 1.00 . A A . 16 HIS ND1 1 1 11 3950 1 1 17 HIS NE2 N -9.364 1.028 -3.623 1.00 . A A . 16 HIS NE2 1 1 11 3951 1 1 17 HIS O O -4.527 2.490 0.999 1.00 . A A . 16 HIS O 1 1 11 3952 1 1 18 SER C C -5.871 0.437 3.784 1.00 . A A . 17 SER C 1 1 11 3953 1 1 18 SER CA C -5.981 1.872 3.279 1.00 . A A . 17 SER CA 1 1 11 3954 1 1 18 SER CB C -6.884 2.684 4.209 1.00 . A A . 17 SER CB 1 1 11 3955 1 1 18 SER H H -7.442 1.695 1.758 1.00 . A A . 17 SER H 1 1 11 3956 1 1 18 SER HA H -4.996 2.315 3.271 1.00 . A A . 17 SER HA 1 1 11 3957 1 1 18 SER HB2 H -6.921 3.709 3.868 1.00 . A A . 17 SER HB2 1 1 11 3958 1 1 18 SER HB3 H -7.879 2.266 4.197 1.00 . A A . 17 SER HB3 1 1 11 3959 1 1 18 SER HG H -6.925 3.254 6.083 1.00 . A A . 17 SER HG 1 1 11 3960 1 1 18 SER N N -6.498 1.905 1.916 1.00 . A A . 17 SER N 1 1 11 3961 1 1 18 SER O O -6.866 -0.285 3.854 1.00 . A A . 17 SER O 1 1 11 3962 1 1 18 SER OG O -6.397 2.664 5.539 1.00 . A A . 17 SER OG 1 1 11 3963 1 1 19 THR C C -3.606 -1.291 5.927 1.00 . A A . 18 THR C 1 1 11 3964 1 1 19 THR CA C -4.414 -1.318 4.634 1.00 . A A . 18 THR CA 1 1 11 3965 1 1 19 THR CB C -3.671 -2.177 3.594 1.00 . A A . 18 THR CB 1 1 11 3966 1 1 19 THR CG2 C -2.354 -1.526 3.195 1.00 . A A . 18 THR CG2 1 1 11 3967 1 1 19 THR H H -3.902 0.653 4.058 1.00 . A A . 18 THR H 1 1 11 3968 1 1 19 THR HA H -5.373 -1.778 4.830 1.00 . A A . 18 THR HA 1 1 11 3969 1 1 19 THR HB H -4.291 -2.267 2.713 1.00 . A A . 18 THR HB 1 1 11 3970 1 1 19 THR HG1 H -2.856 -3.414 4.896 1.00 . A A . 18 THR HG1 1 1 11 3971 1 1 19 THR HG21 H -1.855 -2.143 2.462 1.00 . A A . 18 THR HG21 1 1 11 3972 1 1 19 THR HG22 H -1.724 -1.425 4.067 1.00 . A A . 18 THR HG22 1 1 11 3973 1 1 19 THR HG23 H -2.547 -0.551 2.775 1.00 . A A . 18 THR HG23 1 1 11 3974 1 1 19 THR N N -4.656 0.031 4.135 1.00 . A A . 18 THR N 1 1 11 3975 1 1 19 THR O O -3.622 -2.248 6.700 1.00 . A A . 18 THR O 1 1 11 3976 1 1 19 THR OG1 O -3.422 -3.484 4.124 1.00 . A A . 18 THR OG1 1 1 11 3977 1 1 20 ALA C C -2.073 1.414 7.827 1.00 . A A . 19 ALA C 1 1 11 3978 1 1 20 ALA CA C -2.085 -0.035 7.353 1.00 . A A . 19 ALA CA 1 1 11 3979 1 1 20 ALA CB C -0.667 -0.520 7.091 1.00 . A A . 19 ALA CB 1 1 11 3980 1 1 20 ALA H H -2.928 0.541 5.499 1.00 . A A . 19 ALA H 1 1 11 3981 1 1 20 ALA HA H -2.514 -0.653 8.128 1.00 . A A . 19 ALA HA 1 1 11 3982 1 1 20 ALA HB1 H -0.091 -0.454 8.003 1.00 . A A . 19 ALA HB1 1 1 11 3983 1 1 20 ALA HB2 H -0.211 0.098 6.331 1.00 . A A . 19 ALA HB2 1 1 11 3984 1 1 20 ALA HB3 H -0.694 -1.545 6.754 1.00 . A A . 19 ALA HB3 1 1 11 3985 1 1 20 ALA N N -2.900 -0.188 6.154 1.00 . A A . 19 ALA N 1 1 11 3986 1 1 20 ALA O O -2.664 2.290 7.194 1.00 . A A . 19 ALA O 1 1 11 3987 1 1 21 ILE C C -0.150 3.781 8.879 1.00 . A A . 20 ILE C 1 1 11 3988 1 1 21 ILE CA C -1.304 3.004 9.504 1.00 . A A . 20 ILE CA 1 1 11 3989 1 1 21 ILE CB C -1.117 2.964 11.033 1.00 . A A . 20 ILE CB 1 1 11 3990 1 1 21 ILE CD1 C -2.061 1.947 13.173 1.00 . A A . 20 ILE CD1 1 1 11 3991 1 1 21 ILE CG1 C -2.244 2.156 11.685 1.00 . A A . 20 ILE CG1 1 1 11 3992 1 1 21 ILE CG2 C -1.071 4.376 11.599 1.00 . A A . 20 ILE CG2 1 1 11 3993 1 1 21 ILE H H -0.944 0.920 9.402 1.00 . A A . 20 ILE H 1 1 11 3994 1 1 21 ILE HA H -2.230 3.517 9.289 1.00 . A A . 20 ILE HA 1 1 11 3995 1 1 21 ILE HB H -0.172 2.486 11.246 1.00 . A A . 20 ILE HB 1 1 11 3996 1 1 21 ILE HD11 H -2.885 1.365 13.558 1.00 . A A . 20 ILE HD11 1 1 11 3997 1 1 21 ILE HD12 H -2.031 2.904 13.671 1.00 . A A . 20 ILE HD12 1 1 11 3998 1 1 21 ILE HD13 H -1.135 1.419 13.351 1.00 . A A . 20 ILE HD13 1 1 11 3999 1 1 21 ILE HG12 H -3.180 2.674 11.537 1.00 . A A . 20 ILE HG12 1 1 11 4000 1 1 21 ILE HG13 H -2.297 1.184 11.217 1.00 . A A . 20 ILE HG13 1 1 11 4001 1 1 21 ILE HG21 H -0.248 4.915 11.155 1.00 . A A . 20 ILE HG21 1 1 11 4002 1 1 21 ILE HG22 H -0.936 4.331 12.670 1.00 . A A . 20 ILE HG22 1 1 11 4003 1 1 21 ILE HG23 H -1.997 4.884 11.375 1.00 . A A . 20 ILE HG23 1 1 11 4004 1 1 21 ILE N N -1.394 1.660 8.944 1.00 . A A . 20 ILE N 1 1 11 4005 1 1 21 ILE O O 1.018 3.447 9.084 1.00 . A A . 20 ILE O 1 1 11 4006 1 1 22 GLY C C 0.791 6.927 8.207 1.00 . A A . 21 GLY C 1 1 11 4007 1 1 22 GLY CA C 0.534 5.625 7.474 1.00 . A A . 21 GLY CA 1 1 11 4008 1 1 22 GLY H H -1.432 5.034 7.991 1.00 . A A . 21 GLY H 1 1 11 4009 1 1 22 GLY HA2 H 1.454 5.061 7.432 1.00 . A A . 21 GLY HA2 1 1 11 4010 1 1 22 GLY HA3 H 0.217 5.849 6.465 1.00 . A A . 21 GLY HA3 1 1 11 4011 1 1 22 GLY N N -0.485 4.817 8.117 1.00 . A A . 21 GLY N 1 1 11 4012 1 1 22 GLY O O 1.600 6.976 9.134 1.00 . A A . 21 GLY O 1 1 11 4013 1 1 23 ARG C C -1.084 10.013 8.510 1.00 . A A . 22 ARG C 1 1 11 4014 1 1 23 ARG CA C 0.257 9.294 8.413 1.00 . A A . 22 ARG CA 1 1 11 4015 1 1 23 ARG CB C 1.252 10.144 7.617 1.00 . A A . 22 ARG CB 1 1 11 4016 1 1 23 ARG CD C 2.188 11.400 9.587 1.00 . A A . 22 ARG CD 1 1 11 4017 1 1 23 ARG CG C 1.515 11.513 8.228 1.00 . A A . 22 ARG CG 1 1 11 4018 1 1 23 ARG CZ C 4.267 10.508 10.554 1.00 . A A . 22 ARG CZ 1 1 11 4019 1 1 23 ARG H H -0.529 7.881 7.047 1.00 . A A . 22 ARG H 1 1 11 4020 1 1 23 ARG HA H 0.644 9.143 9.410 1.00 . A A . 22 ARG HA 1 1 11 4021 1 1 23 ARG HB2 H 2.192 9.615 7.556 1.00 . A A . 22 ARG HB2 1 1 11 4022 1 1 23 ARG HB3 H 0.865 10.288 6.619 1.00 . A A . 22 ARG HB3 1 1 11 4023 1 1 23 ARG HD2 H 2.341 12.394 9.981 1.00 . A A . 22 ARG HD2 1 1 11 4024 1 1 23 ARG HD3 H 1.540 10.846 10.250 1.00 . A A . 22 ARG HD3 1 1 11 4025 1 1 23 ARG HE H 3.767 10.403 8.625 1.00 . A A . 22 ARG HE 1 1 11 4026 1 1 23 ARG HG2 H 2.157 12.074 7.566 1.00 . A A . 22 ARG HG2 1 1 11 4027 1 1 23 ARG HG3 H 0.574 12.030 8.345 1.00 . A A . 22 ARG HG3 1 1 11 4028 1 1 23 ARG HH11 H 4.498 10.763 12.546 1.00 . A A . 22 ARG HH11 1 1 11 4029 1 1 23 ARG HH12 H 3.029 11.397 11.881 1.00 . A A . 22 ARG HH12 1 1 11 4030 1 1 23 ARG HH21 H 6.018 9.723 11.187 1.00 . A A . 22 ARG HH21 1 1 11 4031 1 1 23 ARG HH22 H 5.704 9.566 9.491 1.00 . A A . 22 ARG HH22 1 1 11 4032 1 1 23 ARG N N 0.101 7.985 7.790 1.00 . A A . 22 ARG N 1 1 11 4033 1 1 23 ARG NE N 3.476 10.720 9.505 1.00 . A A . 22 ARG NE 1 1 11 4034 1 1 23 ARG NH1 N 3.901 10.924 11.760 1.00 . A A . 22 ARG NH1 1 1 11 4035 1 1 23 ARG NH2 N 5.425 9.881 10.397 1.00 . A A . 22 ARG NH2 1 1 11 4036 1 1 23 ARG O O -1.461 10.698 7.535 1.00 . A A . 22 ARG O 1 1 11 4037 1 1 23 ARG OXT O -1.748 9.885 9.560 1.00 . A A . 22 ARG OXT 1 1 12 4038 1 1 1 ACE C C 3.701 3.661 12.196 1.00 . A A . 0 ACE C 1 1 12 4039 1 1 1 ACE CH3 C 4.257 2.831 13.322 1.00 . A A . 0 ACE CH3 1 1 12 4040 1 1 1 ACE H1 H 4.189 1.784 13.047 1.00 . A A . 0 ACE H1 1 1 12 4041 1 1 1 ACE H2 H 3.683 3.006 14.212 1.00 . A A . 0 ACE H2 1 1 12 4042 1 1 1 ACE H3 H 5.287 3.124 13.493 1.00 . A A . 0 ACE H3 1 1 12 4043 1 1 1 ACE O O 2.557 3.477 11.781 1.00 . A A . 0 ACE O 1 1 12 4044 1 1 2 MET C C 4.201 4.727 9.261 1.00 . A A . 1 MET C 1 1 12 4045 1 1 2 MET CA C 4.099 5.454 10.599 1.00 . A A . 1 MET CA 1 1 12 4046 1 1 2 MET CB C 4.961 6.719 10.570 1.00 . A A . 1 MET CB 1 1 12 4047 1 1 2 MET CE C 2.396 9.708 9.187 1.00 . A A . 1 MET CE 1 1 12 4048 1 1 2 MET CG C 4.369 7.842 9.734 1.00 . A A . 1 MET CG 1 1 12 4049 1 1 2 MET H H 5.415 4.683 12.065 1.00 . A A . 1 MET H 1 1 12 4050 1 1 2 MET HA H 3.070 5.733 10.766 1.00 . A A . 1 MET HA 1 1 12 4051 1 1 2 MET HB2 H 5.087 7.079 11.580 1.00 . A A . 1 MET HB2 1 1 12 4052 1 1 2 MET HB3 H 5.931 6.470 10.162 1.00 . A A . 1 MET HB3 1 1 12 4053 1 1 2 MET HE1 H 2.333 9.269 8.203 1.00 . A A . 1 MET HE1 1 1 12 4054 1 1 2 MET HE2 H 3.167 10.465 9.194 1.00 . A A . 1 MET HE2 1 1 12 4055 1 1 2 MET HE3 H 1.447 10.157 9.443 1.00 . A A . 1 MET HE3 1 1 12 4056 1 1 2 MET HG2 H 5.069 8.664 9.713 1.00 . A A . 1 MET HG2 1 1 12 4057 1 1 2 MET HG3 H 4.212 7.479 8.730 1.00 . A A . 1 MET HG3 1 1 12 4058 1 1 2 MET N N 4.515 4.584 11.692 1.00 . A A . 1 MET N 1 1 12 4059 1 1 2 MET O O 5.291 4.584 8.707 1.00 . A A . 1 MET O 1 1 12 4060 1 1 2 MET SD S 2.797 8.436 10.383 1.00 . A A . 1 MET SD 1 1 12 4061 1 1 3 ASN C C 2.886 4.512 6.308 1.00 . A A . 2 ASN C 1 1 12 4062 1 1 3 ASN CA C 3.042 3.550 7.477 1.00 . A A . 2 ASN CA 1 1 12 4063 1 1 3 ASN CB C 1.915 2.514 7.448 1.00 . A A . 2 ASN CB 1 1 12 4064 1 1 3 ASN CG C 1.691 1.932 6.058 1.00 . A A . 2 ASN CG 1 1 12 4065 1 1 3 ASN H H 2.225 4.403 9.236 1.00 . A A . 2 ASN H 1 1 12 4066 1 1 3 ASN HA H 3.987 3.037 7.376 1.00 . A A . 2 ASN HA 1 1 12 4067 1 1 3 ASN HB2 H 2.162 1.705 8.119 1.00 . A A . 2 ASN HB2 1 1 12 4068 1 1 3 ASN HB3 H 0.997 2.980 7.774 1.00 . A A . 2 ASN HB3 1 1 12 4069 1 1 3 ASN HD21 H 3.608 2.207 5.585 1.00 . A A . 2 ASN HD21 1 1 12 4070 1 1 3 ASN HD22 H 2.625 1.510 4.346 1.00 . A A . 2 ASN HD22 1 1 12 4071 1 1 3 ASN N N 3.064 4.263 8.750 1.00 . A A . 2 ASN N 1 1 12 4072 1 1 3 ASN ND2 N 2.750 1.877 5.249 1.00 . A A . 2 ASN ND2 1 1 12 4073 1 1 3 ASN O O 2.038 5.404 6.323 1.00 . A A . 2 ASN O 1 1 12 4074 1 1 3 ASN OD1 O 0.577 1.538 5.715 1.00 . A A . 2 ASN OD1 1 1 12 4075 1 1 4 TRP C C 4.738 4.630 3.115 1.00 . A A . 3 TRP C 1 1 12 4076 1 1 4 TRP CA C 3.702 5.124 4.093 1.00 . A A . 3 TRP CA 1 1 12 4077 1 1 4 TRP CB C 3.989 6.584 4.401 1.00 . A A . 3 TRP CB 1 1 12 4078 1 1 4 TRP CD1 C 5.368 6.836 6.525 1.00 . A A . 3 TRP CD1 1 1 12 4079 1 1 4 TRP CD2 C 6.563 6.982 4.649 1.00 . A A . 3 TRP CD2 1 1 12 4080 1 1 4 TRP CE2 C 7.426 7.165 5.740 1.00 . A A . 3 TRP CE2 1 1 12 4081 1 1 4 TRP CE3 C 7.090 7.023 3.361 1.00 . A A . 3 TRP CE3 1 1 12 4082 1 1 4 TRP CG C 5.248 6.793 5.176 1.00 . A A . 3 TRP CG 1 1 12 4083 1 1 4 TRP CH2 C 9.279 7.424 4.305 1.00 . A A . 3 TRP CH2 1 1 12 4084 1 1 4 TRP CZ2 C 8.787 7.388 5.580 1.00 . A A . 3 TRP CZ2 1 1 12 4085 1 1 4 TRP CZ3 C 8.443 7.241 3.199 1.00 . A A . 3 TRP CZ3 1 1 12 4086 1 1 4 TRP H H 4.366 3.577 5.362 1.00 . A A . 3 TRP H 1 1 12 4087 1 1 4 TRP HA H 2.727 5.044 3.645 1.00 . A A . 3 TRP HA 1 1 12 4088 1 1 4 TRP HB2 H 4.086 7.124 3.466 1.00 . A A . 3 TRP HB2 1 1 12 4089 1 1 4 TRP HB3 H 3.170 6.998 4.969 1.00 . A A . 3 TRP HB3 1 1 12 4090 1 1 4 TRP HD1 H 4.546 6.710 7.201 1.00 . A A . 3 TRP HD1 1 1 12 4091 1 1 4 TRP HE1 H 7.008 7.161 7.795 1.00 . A A . 3 TRP HE1 1 1 12 4092 1 1 4 TRP HE3 H 6.459 6.876 2.500 1.00 . A A . 3 TRP HE3 1 1 12 4093 1 1 4 TRP HH2 H 10.332 7.594 4.135 1.00 . A A . 3 TRP HH2 1 1 12 4094 1 1 4 TRP HZ2 H 9.437 7.536 6.420 1.00 . A A . 3 TRP HZ2 1 1 12 4095 1 1 4 TRP HZ3 H 8.869 7.277 2.207 1.00 . A A . 3 TRP HZ3 1 1 12 4096 1 1 4 TRP N N 3.718 4.308 5.297 1.00 . A A . 3 TRP N 1 1 12 4097 1 1 4 TRP NE1 N 6.672 7.074 6.879 1.00 . A A . 3 TRP NE1 1 1 12 4098 1 1 4 TRP O O 4.556 4.750 1.907 1.00 . A A . 3 TRP O 1 1 12 4099 1 1 5 THR C C 6.478 3.193 1.468 1.00 . A A . 4 THR C 1 1 12 4100 1 1 5 THR CA C 6.934 3.576 2.870 1.00 . A A . 4 THR CA 1 1 12 4101 1 1 5 THR CB C 7.598 2.357 3.542 1.00 . A A . 4 THR CB 1 1 12 4102 1 1 5 THR CG2 C 8.818 1.902 2.755 1.00 . A A . 4 THR CG2 1 1 12 4103 1 1 5 THR H H 5.883 4.028 4.640 1.00 . A A . 4 THR H 1 1 12 4104 1 1 5 THR HA H 7.666 4.367 2.805 1.00 . A A . 4 THR HA 1 1 12 4105 1 1 5 THR HB H 6.884 1.547 3.570 1.00 . A A . 4 THR HB 1 1 12 4106 1 1 5 THR HG1 H 8.308 3.591 4.908 1.00 . A A . 4 THR HG1 1 1 12 4107 1 1 5 THR HG21 H 9.256 1.040 3.236 1.00 . A A . 4 THR HG21 1 1 12 4108 1 1 5 THR HG22 H 9.543 2.702 2.720 1.00 . A A . 4 THR HG22 1 1 12 4109 1 1 5 THR HG23 H 8.522 1.641 1.750 1.00 . A A . 4 THR HG23 1 1 12 4110 1 1 5 THR N N 5.826 4.085 3.665 1.00 . A A . 4 THR N 1 1 12 4111 1 1 5 THR O O 6.175 2.032 1.194 1.00 . A A . 4 THR O 1 1 12 4112 1 1 5 THR OG1 O 7.986 2.687 4.880 1.00 . A A . 4 THR OG1 1 1 12 4113 1 1 6 GLY C C 5.514 5.220 -1.464 1.00 . A A . 5 GLY C 1 1 12 4114 1 1 6 GLY CA C 5.984 3.952 -0.767 1.00 . A A . 5 GLY CA 1 1 12 4115 1 1 6 GLY H H 6.691 5.087 0.867 1.00 . A A . 5 GLY H 1 1 12 4116 1 1 6 GLY HA2 H 6.799 3.524 -1.328 1.00 . A A . 5 GLY HA2 1 1 12 4117 1 1 6 GLY HA3 H 5.165 3.244 -0.742 1.00 . A A . 5 GLY HA3 1 1 12 4118 1 1 6 GLY N N 6.423 4.187 0.589 1.00 . A A . 5 GLY N 1 1 12 4119 1 1 6 GLY O O 5.259 5.211 -2.663 1.00 . A A . 5 GLY O 1 1 12 4120 1 1 7 LEU C C 6.050 8.294 -2.057 1.00 . A A . 6 LEU C 1 1 12 4121 1 1 7 LEU CA C 4.951 7.590 -1.274 1.00 . A A . 6 LEU CA 1 1 12 4122 1 1 7 LEU CB C 4.464 8.507 -0.160 1.00 . A A . 6 LEU CB 1 1 12 4123 1 1 7 LEU CD1 C 6.689 9.219 0.794 1.00 . A A . 6 LEU CD1 1 1 12 4124 1 1 7 LEU CD2 C 4.661 9.229 2.244 1.00 . A A . 6 LEU CD2 1 1 12 4125 1 1 7 LEU CG C 5.358 8.540 1.085 1.00 . A A . 6 LEU CG 1 1 12 4126 1 1 7 LEU H H 5.618 6.263 0.239 1.00 . A A . 6 LEU H 1 1 12 4127 1 1 7 LEU HA H 4.130 7.384 -1.940 1.00 . A A . 6 LEU HA 1 1 12 4128 1 1 7 LEU HB2 H 4.397 9.506 -0.559 1.00 . A A . 6 LEU HB2 1 1 12 4129 1 1 7 LEU HB3 H 3.479 8.184 0.133 1.00 . A A . 6 LEU HB3 1 1 12 4130 1 1 7 LEU HD11 H 6.513 10.228 0.456 1.00 . A A . 6 LEU HD11 1 1 12 4131 1 1 7 LEU HD12 H 7.216 8.668 0.029 1.00 . A A . 6 LEU HD12 1 1 12 4132 1 1 7 LEU HD13 H 7.285 9.240 1.697 1.00 . A A . 6 LEU HD13 1 1 12 4133 1 1 7 LEU HD21 H 4.467 10.259 1.987 1.00 . A A . 6 LEU HD21 1 1 12 4134 1 1 7 LEU HD22 H 5.298 9.188 3.119 1.00 . A A . 6 LEU HD22 1 1 12 4135 1 1 7 LEU HD23 H 3.729 8.727 2.454 1.00 . A A . 6 LEU HD23 1 1 12 4136 1 1 7 LEU HG H 5.565 7.525 1.384 1.00 . A A . 6 LEU HG 1 1 12 4137 1 1 7 LEU N N 5.402 6.313 -0.714 1.00 . A A . 6 LEU N 1 1 12 4138 1 1 7 LEU O O 5.950 9.486 -2.350 1.00 . A A . 6 LEU O 1 1 12 4139 1 1 8 TYR C C 8.566 7.241 -4.347 1.00 . A A . 7 TYR C 1 1 12 4140 1 1 8 TYR CA C 8.207 8.111 -3.145 1.00 . A A . 7 TYR CA 1 1 12 4141 1 1 8 TYR CB C 9.421 8.277 -2.234 1.00 . A A . 7 TYR CB 1 1 12 4142 1 1 8 TYR CD1 C 8.809 6.520 -0.561 1.00 . A A . 7 TYR CD1 1 1 12 4143 1 1 8 TYR CD2 C 10.948 6.372 -1.593 1.00 . A A . 7 TYR CD2 1 1 12 4144 1 1 8 TYR CE1 C 9.064 5.386 0.151 1.00 . A A . 7 TYR CE1 1 1 12 4145 1 1 8 TYR CE2 C 11.218 5.224 -0.873 1.00 . A A . 7 TYR CE2 1 1 12 4146 1 1 8 TYR CG C 9.738 7.037 -1.444 1.00 . A A . 7 TYR CG 1 1 12 4147 1 1 8 TYR CZ C 10.270 4.733 0.000 1.00 . A A . 7 TYR CZ 1 1 12 4148 1 1 8 TYR H H 7.110 6.620 -2.129 1.00 . A A . 7 TYR H 1 1 12 4149 1 1 8 TYR HA H 7.907 9.077 -3.494 1.00 . A A . 7 TYR HA 1 1 12 4150 1 1 8 TYR HB2 H 10.285 8.523 -2.832 1.00 . A A . 7 TYR HB2 1 1 12 4151 1 1 8 TYR HB3 H 9.229 9.074 -1.535 1.00 . A A . 7 TYR HB3 1 1 12 4152 1 1 8 TYR HD1 H 7.861 7.028 -0.430 1.00 . A A . 7 TYR HD1 1 1 12 4153 1 1 8 TYR HD2 H 11.684 6.765 -2.278 1.00 . A A . 7 TYR HD2 1 1 12 4154 1 1 8 TYR HE1 H 8.315 5.015 0.815 1.00 . A A . 7 TYR HE1 1 1 12 4155 1 1 8 TYR HE2 H 12.164 4.717 -0.996 1.00 . A A . 7 TYR HE2 1 1 12 4156 1 1 8 TYR HH H 11.410 3.633 1.089 1.00 . A A . 7 TYR HH 1 1 12 4157 1 1 8 TYR N N 7.089 7.556 -2.398 1.00 . A A . 7 TYR N 1 1 12 4158 1 1 8 TYR O O 9.083 7.740 -5.348 1.00 . A A . 7 TYR O 1 1 12 4159 1 1 8 TYR OH O 10.525 3.588 0.719 1.00 . A A . 7 TYR OH 1 1 12 4160 1 1 9 THR C C 7.567 3.897 -5.452 1.00 . A A . 8 THR C 1 1 12 4161 1 1 9 THR CA C 8.599 5.016 -5.342 1.00 . A A . 8 THR CA 1 1 12 4162 1 1 9 THR CB C 9.993 4.383 -5.166 1.00 . A A . 8 THR CB 1 1 12 4163 1 1 9 THR CG2 C 11.085 5.442 -5.204 1.00 . A A . 8 THR CG2 1 1 12 4164 1 1 9 THR H H 7.873 5.596 -3.435 1.00 . A A . 8 THR H 1 1 12 4165 1 1 9 THR HA H 8.598 5.580 -6.261 1.00 . A A . 8 THR HA 1 1 12 4166 1 1 9 THR HB H 10.159 3.687 -5.974 1.00 . A A . 8 THR HB 1 1 12 4167 1 1 9 THR HG1 H 9.165 3.407 -3.665 1.00 . A A . 8 THR HG1 1 1 12 4168 1 1 9 THR HG21 H 12.047 4.970 -5.073 1.00 . A A . 8 THR HG21 1 1 12 4169 1 1 9 THR HG22 H 10.923 6.155 -4.410 1.00 . A A . 8 THR HG22 1 1 12 4170 1 1 9 THR HG23 H 11.059 5.951 -6.156 1.00 . A A . 8 THR HG23 1 1 12 4171 1 1 9 THR N N 8.290 5.940 -4.252 1.00 . A A . 8 THR N 1 1 12 4172 1 1 9 THR O O 7.789 2.909 -6.153 1.00 . A A . 8 THR O 1 1 12 4173 1 1 9 THR OG1 O 10.050 3.675 -3.922 1.00 . A A . 8 THR OG1 1 1 12 4174 1 1 10 LEU C C 4.004 3.690 -4.669 1.00 . A A . 9 LEU C 1 1 12 4175 1 1 10 LEU CA C 5.382 3.050 -4.797 1.00 . A A . 9 LEU CA 1 1 12 4176 1 1 10 LEU CB C 5.584 2.022 -3.684 1.00 . A A . 9 LEU CB 1 1 12 4177 1 1 10 LEU CD1 C 6.988 0.246 -2.620 1.00 . A A . 9 LEU CD1 1 1 12 4178 1 1 10 LEU CD2 C 6.670 0.255 -5.098 1.00 . A A . 9 LEU CD2 1 1 12 4179 1 1 10 LEU CG C 6.806 1.116 -3.850 1.00 . A A . 9 LEU CG 1 1 12 4180 1 1 10 LEU H H 6.318 4.871 -4.240 1.00 . A A . 9 LEU H 1 1 12 4181 1 1 10 LEU HA H 5.439 2.546 -5.746 1.00 . A A . 9 LEU HA 1 1 12 4182 1 1 10 LEU HB2 H 5.681 2.550 -2.749 1.00 . A A . 9 LEU HB2 1 1 12 4183 1 1 10 LEU HB3 H 4.705 1.398 -3.635 1.00 . A A . 9 LEU HB3 1 1 12 4184 1 1 10 LEU HD11 H 7.853 -0.386 -2.751 1.00 . A A . 9 LEU HD11 1 1 12 4185 1 1 10 LEU HD12 H 6.111 -0.367 -2.481 1.00 . A A . 9 LEU HD12 1 1 12 4186 1 1 10 LEU HD13 H 7.130 0.875 -1.754 1.00 . A A . 9 LEU HD13 1 1 12 4187 1 1 10 LEU HD21 H 5.786 -0.360 -5.016 1.00 . A A . 9 LEU HD21 1 1 12 4188 1 1 10 LEU HD22 H 7.540 -0.376 -5.196 1.00 . A A . 9 LEU HD22 1 1 12 4189 1 1 10 LEU HD23 H 6.586 0.892 -5.966 1.00 . A A . 9 LEU HD23 1 1 12 4190 1 1 10 LEU HG H 7.689 1.729 -3.961 1.00 . A A . 9 LEU HG 1 1 12 4191 1 1 10 LEU N N 6.442 4.057 -4.768 1.00 . A A . 9 LEU N 1 1 12 4192 1 1 10 LEU O O 3.008 3.003 -4.448 1.00 . A A . 9 LEU O 1 1 12 4193 1 1 11 LEU C C 1.590 5.056 -5.434 1.00 . A A . 10 LEU C 1 1 12 4194 1 1 11 LEU CA C 2.726 5.773 -4.717 1.00 . A A . 10 LEU CA 1 1 12 4195 1 1 11 LEU CB C 2.918 7.161 -5.331 1.00 . A A . 10 LEU CB 1 1 12 4196 1 1 11 LEU CD1 C 5.363 7.568 -4.875 1.00 . A A . 10 LEU CD1 1 1 12 4197 1 1 11 LEU CD2 C 3.792 9.499 -5.093 1.00 . A A . 10 LEU CD2 1 1 12 4198 1 1 11 LEU CG C 3.943 8.058 -4.628 1.00 . A A . 10 LEU CG 1 1 12 4199 1 1 11 LEU H H 4.805 5.489 -4.936 1.00 . A A . 10 LEU H 1 1 12 4200 1 1 11 LEU HA H 2.469 5.882 -3.676 1.00 . A A . 10 LEU HA 1 1 12 4201 1 1 11 LEU HB2 H 3.229 7.032 -6.358 1.00 . A A . 10 LEU HB2 1 1 12 4202 1 1 11 LEU HB3 H 1.964 7.666 -5.324 1.00 . A A . 10 LEU HB3 1 1 12 4203 1 1 11 LEU HD11 H 5.411 7.060 -5.827 1.00 . A A . 10 LEU HD11 1 1 12 4204 1 1 11 LEU HD12 H 5.654 6.884 -4.083 1.00 . A A . 10 LEU HD12 1 1 12 4205 1 1 11 LEU HD13 H 6.038 8.410 -4.882 1.00 . A A . 10 LEU HD13 1 1 12 4206 1 1 11 LEU HD21 H 2.795 9.848 -4.865 1.00 . A A . 10 LEU HD21 1 1 12 4207 1 1 11 LEU HD22 H 3.956 9.552 -6.159 1.00 . A A . 10 LEU HD22 1 1 12 4208 1 1 11 LEU HD23 H 4.515 10.119 -4.585 1.00 . A A . 10 LEU HD23 1 1 12 4209 1 1 11 LEU HG H 3.762 8.031 -3.565 1.00 . A A . 10 LEU HG 1 1 12 4210 1 1 11 LEU N N 3.967 5.010 -4.800 1.00 . A A . 10 LEU N 1 1 12 4211 1 1 11 LEU O O 0.678 4.529 -4.801 1.00 . A A . 10 LEU O 1 1 12 4212 1 1 12 SER C C 0.861 2.880 -7.583 1.00 . A A . 11 SER C 1 1 12 4213 1 1 12 SER CA C 0.631 4.386 -7.566 1.00 . A A . 11 SER CA 1 1 12 4214 1 1 12 SER CB C 0.643 4.934 -8.994 1.00 . A A . 11 SER CB 1 1 12 4215 1 1 12 SER H H 2.398 5.494 -7.208 1.00 . A A . 11 SER H 1 1 12 4216 1 1 12 SER HA H -0.331 4.589 -7.119 1.00 . A A . 11 SER HA 1 1 12 4217 1 1 12 SER HB2 H -0.115 4.433 -9.577 1.00 . A A . 11 SER HB2 1 1 12 4218 1 1 12 SER HB3 H 0.439 5.994 -8.973 1.00 . A A . 11 SER HB3 1 1 12 4219 1 1 12 SER HG H 2.464 5.490 -9.459 1.00 . A A . 11 SER HG 1 1 12 4220 1 1 12 SER N N 1.650 5.046 -6.760 1.00 . A A . 11 SER N 1 1 12 4221 1 1 12 SER O O 0.112 2.131 -8.208 1.00 . A A . 11 SER O 1 1 12 4222 1 1 12 SER OG O 1.902 4.726 -9.610 1.00 . A A . 11 SER OG 1 1 12 4223 1 1 13 ARG C C 1.877 0.453 -5.453 1.00 . A A . 12 ARG C 1 1 12 4224 1 1 13 ARG CA C 2.250 1.033 -6.813 1.00 . A A . 12 ARG CA 1 1 12 4225 1 1 13 ARG CB C 3.747 0.839 -7.066 1.00 . A A . 12 ARG CB 1 1 12 4226 1 1 13 ARG CD C 5.742 1.328 -8.512 1.00 . A A . 12 ARG CD 1 1 12 4227 1 1 13 ARG CG C 4.236 1.477 -8.355 1.00 . A A . 12 ARG CG 1 1 12 4228 1 1 13 ARG CZ C 7.365 -0.473 -8.930 1.00 . A A . 12 ARG CZ 1 1 12 4229 1 1 13 ARG H H 2.464 3.097 -6.410 1.00 . A A . 12 ARG H 1 1 12 4230 1 1 13 ARG HA H 1.692 0.517 -7.577 1.00 . A A . 12 ARG HA 1 1 12 4231 1 1 13 ARG HB2 H 4.296 1.272 -6.244 1.00 . A A . 12 ARG HB2 1 1 12 4232 1 1 13 ARG HB3 H 3.957 -0.219 -7.111 1.00 . A A . 12 ARG HB3 1 1 12 4233 1 1 13 ARG HD2 H 6.047 1.822 -9.422 1.00 . A A . 12 ARG HD2 1 1 12 4234 1 1 13 ARG HD3 H 6.228 1.797 -7.668 1.00 . A A . 12 ARG HD3 1 1 12 4235 1 1 13 ARG HE H 5.480 -0.751 -8.338 1.00 . A A . 12 ARG HE 1 1 12 4236 1 1 13 ARG HG2 H 3.748 0.999 -9.191 1.00 . A A . 12 ARG HG2 1 1 12 4237 1 1 13 ARG HG3 H 3.989 2.528 -8.342 1.00 . A A . 12 ARG HG3 1 1 12 4238 1 1 13 ARG HH11 H 9.207 0.113 -9.522 1.00 . A A . 12 ARG HH11 1 1 12 4239 1 1 13 ARG HH12 H 8.077 1.394 -9.233 1.00 . A A . 12 ARG HH12 1 1 12 4240 1 1 13 ARG HH21 H 6.960 -2.442 -8.718 1.00 . A A . 12 ARG HH21 1 1 12 4241 1 1 13 ARG HH22 H 8.572 -2.068 -9.230 1.00 . A A . 12 ARG HH22 1 1 12 4242 1 1 13 ARG N N 1.908 2.447 -6.886 1.00 . A A . 12 ARG N 1 1 12 4243 1 1 13 ARG NE N 6.149 -0.073 -8.574 1.00 . A A . 12 ARG NE 1 1 12 4244 1 1 13 ARG NH1 N 8.293 0.418 -9.254 1.00 . A A . 12 ARG NH1 1 1 12 4245 1 1 13 ARG NH2 N 7.657 -1.768 -8.962 1.00 . A A . 12 ARG NH2 1 1 12 4246 1 1 13 ARG O O 2.335 -0.629 -5.083 1.00 . A A . 12 ARG O 1 1 12 4247 1 1 14 VAL C C -0.255 -0.510 -3.488 1.00 . A A . 13 VAL C 1 1 12 4248 1 1 14 VAL CA C 0.607 0.747 -3.405 1.00 . A A . 13 VAL CA 1 1 12 4249 1 1 14 VAL CB C -0.168 1.872 -2.700 1.00 . A A . 13 VAL CB 1 1 12 4250 1 1 14 VAL CG1 C 0.783 2.931 -2.173 1.00 . A A . 13 VAL CG1 1 1 12 4251 1 1 14 VAL CG2 C -1.198 2.485 -3.635 1.00 . A A . 13 VAL CG2 1 1 12 4252 1 1 14 VAL H H 0.714 2.030 -5.057 1.00 . A A . 13 VAL H 1 1 12 4253 1 1 14 VAL HA H 1.477 0.528 -2.817 1.00 . A A . 13 VAL HA 1 1 12 4254 1 1 14 VAL HB H -0.686 1.448 -1.868 1.00 . A A . 13 VAL HB 1 1 12 4255 1 1 14 VAL HG11 H 0.218 3.708 -1.682 1.00 . A A . 13 VAL HG11 1 1 12 4256 1 1 14 VAL HG12 H 1.341 3.354 -2.994 1.00 . A A . 13 VAL HG12 1 1 12 4257 1 1 14 VAL HG13 H 1.465 2.481 -1.467 1.00 . A A . 13 VAL HG13 1 1 12 4258 1 1 14 VAL HG21 H -1.751 3.249 -3.110 1.00 . A A . 13 VAL HG21 1 1 12 4259 1 1 14 VAL HG22 H -1.875 1.717 -3.975 1.00 . A A . 13 VAL HG22 1 1 12 4260 1 1 14 VAL HG23 H -0.696 2.923 -4.484 1.00 . A A . 13 VAL HG23 1 1 12 4261 1 1 14 VAL N N 1.044 1.178 -4.714 1.00 . A A . 13 VAL N 1 1 12 4262 1 1 14 VAL O O 0.197 -1.554 -3.960 1.00 . A A . 13 VAL O 1 1 12 4263 1 1 15 ASN C C -1.854 -2.717 -2.276 1.00 . A A . 14 ASN C 1 1 12 4264 1 1 15 ASN CA C -2.423 -1.523 -3.038 1.00 . A A . 14 ASN CA 1 1 12 4265 1 1 15 ASN CB C -2.751 -1.928 -4.477 1.00 . A A . 14 ASN CB 1 1 12 4266 1 1 15 ASN CG C -3.377 -0.795 -5.268 1.00 . A A . 14 ASN CG 1 1 12 4267 1 1 15 ASN H H -1.787 0.452 -2.664 1.00 . A A . 14 ASN H 1 1 12 4268 1 1 15 ASN HA H -3.327 -1.198 -2.549 1.00 . A A . 14 ASN HA 1 1 12 4269 1 1 15 ASN HB2 H -1.842 -2.231 -4.975 1.00 . A A . 14 ASN HB2 1 1 12 4270 1 1 15 ASN HB3 H -3.444 -2.756 -4.462 1.00 . A A . 14 ASN HB3 1 1 12 4271 1 1 15 ASN HD21 H -1.579 -0.178 -5.851 1.00 . A A . 14 ASN HD21 1 1 12 4272 1 1 15 ASN HD22 H -2.915 0.746 -6.437 1.00 . A A . 14 ASN HD22 1 1 12 4273 1 1 15 ASN N N -1.491 -0.404 -3.024 1.00 . A A . 14 ASN N 1 1 12 4274 1 1 15 ASN ND2 N -2.539 0.005 -5.918 1.00 . A A . 14 ASN ND2 1 1 12 4275 1 1 15 ASN O O -2.220 -3.863 -2.538 1.00 . A A . 14 ASN O 1 1 12 4276 1 1 15 ASN OD1 O -4.598 -0.640 -5.294 1.00 . A A . 14 ASN OD1 1 1 12 4277 1 1 16 ARG C C 0.531 -4.393 -1.374 1.00 . A A . 15 ARG C 1 1 12 4278 1 1 16 ARG CA C -0.334 -3.474 -0.516 1.00 . A A . 15 ARG CA 1 1 12 4279 1 1 16 ARG CB C -1.395 -4.289 0.231 1.00 . A A . 15 ARG CB 1 1 12 4280 1 1 16 ARG CD C -1.903 -6.073 1.925 1.00 . A A . 15 ARG CD 1 1 12 4281 1 1 16 ARG CG C -0.814 -5.357 1.142 1.00 . A A . 15 ARG CG 1 1 12 4282 1 1 16 ARG CZ C -4.004 -7.279 1.487 1.00 . A A . 15 ARG CZ 1 1 12 4283 1 1 16 ARG H H -0.721 -1.498 -1.169 1.00 . A A . 15 ARG H 1 1 12 4284 1 1 16 ARG HA H 0.300 -2.984 0.208 1.00 . A A . 15 ARG HA 1 1 12 4285 1 1 16 ARG HB2 H -1.990 -3.618 0.831 1.00 . A A . 15 ARG HB2 1 1 12 4286 1 1 16 ARG HB3 H -2.034 -4.773 -0.494 1.00 . A A . 15 ARG HB3 1 1 12 4287 1 1 16 ARG HD2 H -1.449 -6.853 2.517 1.00 . A A . 15 ARG HD2 1 1 12 4288 1 1 16 ARG HD3 H -2.386 -5.362 2.577 1.00 . A A . 15 ARG HD3 1 1 12 4289 1 1 16 ARG HE H -2.755 -6.613 0.081 1.00 . A A . 15 ARG HE 1 1 12 4290 1 1 16 ARG HG2 H -0.282 -6.081 0.541 1.00 . A A . 15 ARG HG2 1 1 12 4291 1 1 16 ARG HG3 H -0.132 -4.891 1.837 1.00 . A A . 15 ARG HG3 1 1 12 4292 1 1 16 ARG HH11 H -3.589 -6.985 3.444 1.00 . A A . 15 ARG HH11 1 1 12 4293 1 1 16 ARG HH12 H -5.064 -7.832 3.117 1.00 . A A . 15 ARG HH12 1 1 12 4294 1 1 16 ARG HH21 H -5.693 -8.253 0.957 1.00 . A A . 15 ARG HH21 1 1 12 4295 1 1 16 ARG HH22 H -4.696 -7.726 -0.358 1.00 . A A . 15 ARG HH22 1 1 12 4296 1 1 16 ARG N N -0.963 -2.434 -1.327 1.00 . A A . 15 ARG N 1 1 12 4297 1 1 16 ARG NE N -2.907 -6.670 1.047 1.00 . A A . 15 ARG NE 1 1 12 4298 1 1 16 ARG NH1 N -4.238 -7.373 2.790 1.00 . A A . 15 ARG NH1 1 1 12 4299 1 1 16 ARG NH2 N -4.869 -7.796 0.624 1.00 . A A . 15 ARG NH2 1 1 12 4300 1 1 16 ARG O O 1.750 -4.226 -1.442 1.00 . A A . 15 ARG O 1 1 12 4301 1 1 17 HIS C C 0.880 -5.701 -4.256 1.00 . A A . 16 HIS C 1 1 12 4302 1 1 17 HIS CA C 0.617 -6.305 -2.879 1.00 . A A . 16 HIS CA 1 1 12 4303 1 1 17 HIS CB C -0.175 -7.606 -3.023 1.00 . A A . 16 HIS CB 1 1 12 4304 1 1 17 HIS CD2 C 0.563 -9.065 -1.009 1.00 . A A . 16 HIS CD2 1 1 12 4305 1 1 17 HIS CE1 C -1.365 -9.176 0.029 1.00 . A A . 16 HIS CE1 1 1 12 4306 1 1 17 HIS CG C -0.332 -8.359 -1.739 1.00 . A A . 16 HIS CG 1 1 12 4307 1 1 17 HIS H H -1.073 -5.449 -1.933 1.00 . A A . 16 HIS H 1 1 12 4308 1 1 17 HIS HA H 1.564 -6.520 -2.408 1.00 . A A . 16 HIS HA 1 1 12 4309 1 1 17 HIS HB2 H -1.161 -7.379 -3.399 1.00 . A A . 16 HIS HB2 1 1 12 4310 1 1 17 HIS HB3 H 0.333 -8.251 -3.726 1.00 . A A . 16 HIS HB3 1 1 12 4311 1 1 17 HIS HD1 H -2.378 -8.039 -1.338 1.00 . A A . 16 HIS HD1 1 1 12 4312 1 1 17 HIS HD2 H 1.609 -9.209 -1.243 1.00 . A A . 16 HIS HD2 1 1 12 4313 1 1 17 HIS HE1 H -2.130 -9.416 0.752 1.00 . A A . 16 HIS HE1 1 1 12 4314 1 1 17 HIS HE2 H 0.290 -10.114 0.791 1.00 . A A . 16 HIS HE2 1 1 12 4315 1 1 17 HIS N N -0.101 -5.363 -2.028 1.00 . A A . 16 HIS N 1 1 12 4316 1 1 17 HIS ND1 N -1.532 -8.448 -1.062 1.00 . A A . 16 HIS ND1 1 1 12 4317 1 1 17 HIS NE2 N -0.104 -9.561 0.083 1.00 . A A . 16 HIS NE2 1 1 12 4318 1 1 17 HIS O O 2.014 -5.349 -4.582 1.00 . A A . 16 HIS O 1 1 12 4319 1 1 18 SER C C 0.902 -5.838 -7.259 1.00 . A A . 17 SER C 1 1 12 4320 1 1 18 SER CA C -0.067 -5.028 -6.402 1.00 . A A . 17 SER CA 1 1 12 4321 1 1 18 SER CB C 0.387 -3.568 -6.336 1.00 . A A . 17 SER CB 1 1 12 4322 1 1 18 SER H H -1.052 -5.889 -4.737 1.00 . A A . 17 SER H 1 1 12 4323 1 1 18 SER HA H -1.047 -5.069 -6.856 1.00 . A A . 17 SER HA 1 1 12 4324 1 1 18 SER HB2 H -0.309 -3.004 -5.733 1.00 . A A . 17 SER HB2 1 1 12 4325 1 1 18 SER HB3 H 1.370 -3.519 -5.891 1.00 . A A . 17 SER HB3 1 1 12 4326 1 1 18 SER HG H 0.507 -2.035 -7.549 1.00 . A A . 17 SER HG 1 1 12 4327 1 1 18 SER N N -0.176 -5.589 -5.058 1.00 . A A . 17 SER N 1 1 12 4328 1 1 18 SER O O 1.312 -5.399 -8.334 1.00 . A A . 17 SER O 1 1 12 4329 1 1 18 SER OG O 0.442 -2.990 -7.628 1.00 . A A . 17 SER OG 1 1 12 4330 1 1 19 THR C C 1.434 -9.024 -8.200 1.00 . A A . 18 THR C 1 1 12 4331 1 1 19 THR CA C 2.182 -7.895 -7.501 1.00 . A A . 18 THR CA 1 1 12 4332 1 1 19 THR CB C 3.241 -8.498 -6.560 1.00 . A A . 18 THR CB 1 1 12 4333 1 1 19 THR CG2 C 2.581 -9.253 -5.414 1.00 . A A . 18 THR CG2 1 1 12 4334 1 1 19 THR H H 0.899 -7.322 -5.918 1.00 . A A . 18 THR H 1 1 12 4335 1 1 19 THR HA H 2.690 -7.298 -8.245 1.00 . A A . 18 THR HA 1 1 12 4336 1 1 19 THR HB H 3.833 -7.695 -6.146 1.00 . A A . 18 THR HB 1 1 12 4337 1 1 19 THR HG1 H 4.292 -9.005 -8.150 1.00 . A A . 18 THR HG1 1 1 12 4338 1 1 19 THR HG21 H 3.343 -9.667 -4.770 1.00 . A A . 18 THR HG21 1 1 12 4339 1 1 19 THR HG22 H 1.973 -10.053 -5.812 1.00 . A A . 18 THR HG22 1 1 12 4340 1 1 19 THR HG23 H 1.959 -8.576 -4.848 1.00 . A A . 18 THR HG23 1 1 12 4341 1 1 19 THR N N 1.261 -7.025 -6.778 1.00 . A A . 18 THR N 1 1 12 4342 1 1 19 THR O O 1.880 -9.536 -9.228 1.00 . A A . 18 THR O 1 1 12 4343 1 1 19 THR OG1 O 4.098 -9.384 -7.289 1.00 . A A . 18 THR OG1 1 1 12 4344 1 1 20 ALA C C -1.733 -9.913 -8.936 1.00 . A A . 19 ALA C 1 1 12 4345 1 1 20 ALA CA C -0.520 -10.477 -8.205 1.00 . A A . 19 ALA CA 1 1 12 4346 1 1 20 ALA CB C -0.959 -11.444 -7.116 1.00 . A A . 19 ALA CB 1 1 12 4347 1 1 20 ALA H H -0.009 -8.964 -6.818 1.00 . A A . 19 ALA H 1 1 12 4348 1 1 20 ALA HA H 0.092 -11.022 -8.911 1.00 . A A . 19 ALA HA 1 1 12 4349 1 1 20 ALA HB1 H -0.091 -11.831 -6.606 1.00 . A A . 19 ALA HB1 1 1 12 4350 1 1 20 ALA HB2 H -1.510 -12.260 -7.559 1.00 . A A . 19 ALA HB2 1 1 12 4351 1 1 20 ALA HB3 H -1.591 -10.926 -6.409 1.00 . A A . 19 ALA HB3 1 1 12 4352 1 1 20 ALA N N 0.293 -9.410 -7.636 1.00 . A A . 19 ALA N 1 1 12 4353 1 1 20 ALA O O -2.609 -9.300 -8.325 1.00 . A A . 19 ALA O 1 1 12 4354 1 1 21 ILE C C -4.171 -10.395 -10.758 1.00 . A A . 20 ILE C 1 1 12 4355 1 1 21 ILE CA C -2.885 -9.635 -11.063 1.00 . A A . 20 ILE CA 1 1 12 4356 1 1 21 ILE CB C -2.571 -9.758 -12.567 1.00 . A A . 20 ILE CB 1 1 12 4357 1 1 21 ILE CD1 C -2.052 -11.444 -14.408 1.00 . A A . 20 ILE CD1 1 1 12 4358 1 1 21 ILE CG1 C -2.238 -11.210 -12.924 1.00 . A A . 20 ILE CG1 1 1 12 4359 1 1 21 ILE CG2 C -1.424 -8.833 -12.944 1.00 . A A . 20 ILE CG2 1 1 12 4360 1 1 21 ILE H H -1.051 -10.619 -10.678 1.00 . A A . 20 ILE H 1 1 12 4361 1 1 21 ILE HA H -3.032 -8.590 -10.833 1.00 . A A . 20 ILE HA 1 1 12 4362 1 1 21 ILE HB H -3.446 -9.450 -13.120 1.00 . A A . 20 ILE HB 1 1 12 4363 1 1 21 ILE HD11 H -2.962 -11.189 -14.930 1.00 . A A . 20 ILE HD11 1 1 12 4364 1 1 21 ILE HD12 H -1.817 -12.484 -14.581 1.00 . A A . 20 ILE HD12 1 1 12 4365 1 1 21 ILE HD13 H -1.244 -10.828 -14.772 1.00 . A A . 20 ILE HD13 1 1 12 4366 1 1 21 ILE HG12 H -1.322 -11.494 -12.428 1.00 . A A . 20 ILE HG12 1 1 12 4367 1 1 21 ILE HG13 H -3.040 -11.850 -12.586 1.00 . A A . 20 ILE HG13 1 1 12 4368 1 1 21 ILE HG21 H -0.540 -9.109 -12.386 1.00 . A A . 20 ILE HG21 1 1 12 4369 1 1 21 ILE HG22 H -1.692 -7.813 -12.711 1.00 . A A . 20 ILE HG22 1 1 12 4370 1 1 21 ILE HG23 H -1.223 -8.919 -14.002 1.00 . A A . 20 ILE HG23 1 1 12 4371 1 1 21 ILE N N -1.779 -10.123 -10.248 1.00 . A A . 20 ILE N 1 1 12 4372 1 1 21 ILE O O -4.139 -11.571 -10.396 1.00 . A A . 20 ILE O 1 1 12 4373 1 1 22 GLY C C -7.083 -10.079 -9.238 1.00 . A A . 21 GLY C 1 1 12 4374 1 1 22 GLY CA C -6.587 -10.340 -10.647 1.00 . A A . 21 GLY CA 1 1 12 4375 1 1 22 GLY H H -5.267 -8.779 -11.201 1.00 . A A . 21 GLY H 1 1 12 4376 1 1 22 GLY HA2 H -7.311 -9.955 -11.349 1.00 . A A . 21 GLY HA2 1 1 12 4377 1 1 22 GLY HA3 H -6.491 -11.405 -10.791 1.00 . A A . 21 GLY HA3 1 1 12 4378 1 1 22 GLY N N -5.303 -9.714 -10.909 1.00 . A A . 21 GLY N 1 1 12 4379 1 1 22 GLY O O -7.404 -8.944 -8.886 1.00 . A A . 21 GLY O 1 1 12 4380 1 1 23 ARG C C -6.620 -10.212 -6.209 1.00 . A A . 22 ARG C 1 1 12 4381 1 1 23 ARG CA C -7.608 -11.016 -7.052 1.00 . A A . 22 ARG CA 1 1 12 4382 1 1 23 ARG CB C -7.821 -12.405 -6.444 1.00 . A A . 22 ARG CB 1 1 12 4383 1 1 23 ARG CD C -6.958 -14.745 -6.116 1.00 . A A . 22 ARG CD 1 1 12 4384 1 1 23 ARG CG C -6.665 -13.365 -6.682 1.00 . A A . 22 ARG CG 1 1 12 4385 1 1 23 ARG CZ C -8.355 -16.670 -6.746 1.00 . A A . 22 ARG CZ 1 1 12 4386 1 1 23 ARG H H -6.875 -12.012 -8.772 1.00 . A A . 22 ARG H 1 1 12 4387 1 1 23 ARG HA H -8.553 -10.494 -7.068 1.00 . A A . 22 ARG HA 1 1 12 4388 1 1 23 ARG HB2 H -7.958 -12.301 -5.378 1.00 . A A . 22 ARG HB2 1 1 12 4389 1 1 23 ARG HB3 H -8.713 -12.840 -6.871 1.00 . A A . 22 ARG HB3 1 1 12 4390 1 1 23 ARG HD2 H -6.097 -15.376 -6.277 1.00 . A A . 22 ARG HD2 1 1 12 4391 1 1 23 ARG HD3 H -7.143 -14.653 -5.056 1.00 . A A . 22 ARG HD3 1 1 12 4392 1 1 23 ARG HE H -8.761 -14.769 -7.197 1.00 . A A . 22 ARG HE 1 1 12 4393 1 1 23 ARG HG2 H -6.496 -13.452 -7.747 1.00 . A A . 22 ARG HG2 1 1 12 4394 1 1 23 ARG HG3 H -5.779 -12.972 -6.206 1.00 . A A . 22 ARG HG3 1 1 12 4395 1 1 23 ARG HH11 H -6.693 -17.139 -5.697 1.00 . A A . 22 ARG HH11 1 1 12 4396 1 1 23 ARG HH12 H -7.687 -18.482 -6.150 1.00 . A A . 22 ARG HH12 1 1 12 4397 1 1 23 ARG HH21 H -10.076 -16.532 -7.797 1.00 . A A . 22 ARG HH21 1 1 12 4398 1 1 23 ARG HH22 H -9.611 -18.138 -7.342 1.00 . A A . 22 ARG HH22 1 1 12 4399 1 1 23 ARG N N -7.147 -11.133 -8.431 1.00 . A A . 22 ARG N 1 1 12 4400 1 1 23 ARG NE N -8.122 -15.361 -6.748 1.00 . A A . 22 ARG NE 1 1 12 4401 1 1 23 ARG NH1 N -7.509 -17.498 -6.149 1.00 . A A . 22 ARG NH1 1 1 12 4402 1 1 23 ARG NH2 N -9.436 -17.153 -7.344 1.00 . A A . 22 ARG NH2 1 1 12 4403 1 1 23 ARG O O -6.801 -8.981 -6.105 1.00 . A A . 22 ARG O 1 1 12 4404 1 1 23 ARG OXT O -5.674 -10.817 -5.661 1.00 . A A . 22 ARG OXT 1 1 13 4405 1 1 1 ACE C C 2.990 2.962 11.494 1.00 . A A . 0 ACE C 1 1 13 4406 1 1 1 ACE CH3 C 2.639 2.425 12.855 1.00 . A A . 0 ACE CH3 1 1 13 4407 1 1 1 ACE H1 H 2.958 3.143 13.604 1.00 . A A . 0 ACE H1 1 1 13 4408 1 1 1 ACE H2 H 3.148 1.494 13.014 1.00 . A A . 0 ACE H2 1 1 13 4409 1 1 1 ACE H3 H 1.567 2.264 12.899 1.00 . A A . 0 ACE H3 1 1 13 4410 1 1 1 ACE O O 2.113 3.345 10.720 1.00 . A A . 0 ACE O 1 1 13 4411 1 1 2 MET C C 4.942 2.347 8.914 1.00 . A A . 1 MET C 1 1 13 4412 1 1 2 MET CA C 4.759 3.492 9.906 1.00 . A A . 1 MET CA 1 1 13 4413 1 1 2 MET CB C 6.079 4.247 10.078 1.00 . A A . 1 MET CB 1 1 13 4414 1 1 2 MET CE C 5.416 7.013 13.139 1.00 . A A . 1 MET CE 1 1 13 4415 1 1 2 MET CG C 5.942 5.556 10.841 1.00 . A A . 1 MET CG 1 1 13 4416 1 1 2 MET H H 4.937 2.675 11.851 1.00 . A A . 1 MET H 1 1 13 4417 1 1 2 MET HA H 4.014 4.171 9.520 1.00 . A A . 1 MET HA 1 1 13 4418 1 1 2 MET HB2 H 6.774 3.616 10.613 1.00 . A A . 1 MET HB2 1 1 13 4419 1 1 2 MET HB3 H 6.485 4.466 9.102 1.00 . A A . 1 MET HB3 1 1 13 4420 1 1 2 MET HE1 H 5.148 7.030 14.184 1.00 . A A . 1 MET HE1 1 1 13 4421 1 1 2 MET HE2 H 4.675 7.552 12.568 1.00 . A A . 1 MET HE2 1 1 13 4422 1 1 2 MET HE3 H 6.382 7.478 13.007 1.00 . A A . 1 MET HE3 1 1 13 4423 1 1 2 MET HG2 H 6.887 6.079 10.801 1.00 . A A . 1 MET HG2 1 1 13 4424 1 1 2 MET HG3 H 5.181 6.156 10.365 1.00 . A A . 1 MET HG3 1 1 13 4425 1 1 2 MET N N 4.284 2.994 11.192 1.00 . A A . 1 MET N 1 1 13 4426 1 1 2 MET O O 5.778 1.468 9.113 1.00 . A A . 1 MET O 1 1 13 4427 1 1 2 MET SD S 5.489 5.316 12.570 1.00 . A A . 1 MET SD 1 1 13 4428 1 1 3 ASN C C 4.234 1.946 5.425 1.00 . A A . 2 ASN C 1 1 13 4429 1 1 3 ASN CA C 4.225 1.334 6.819 1.00 . A A . 2 ASN CA 1 1 13 4430 1 1 3 ASN CB C 3.038 0.374 6.937 1.00 . A A . 2 ASN CB 1 1 13 4431 1 1 3 ASN CG C 3.024 -0.669 5.832 1.00 . A A . 2 ASN CG 1 1 13 4432 1 1 3 ASN H H 3.504 3.097 7.743 1.00 . A A . 2 ASN H 1 1 13 4433 1 1 3 ASN HA H 5.140 0.782 6.965 1.00 . A A . 2 ASN HA 1 1 13 4434 1 1 3 ASN HB2 H 3.089 -0.136 7.887 1.00 . A A . 2 ASN HB2 1 1 13 4435 1 1 3 ASN HB3 H 2.119 0.939 6.885 1.00 . A A . 2 ASN HB3 1 1 13 4436 1 1 3 ASN HD21 H 2.292 0.662 4.538 1.00 . A A . 2 ASN HD21 1 1 13 4437 1 1 3 ASN HD22 H 2.567 -0.923 3.907 1.00 . A A . 2 ASN HD22 1 1 13 4438 1 1 3 ASN N N 4.152 2.368 7.845 1.00 . A A . 2 ASN N 1 1 13 4439 1 1 3 ASN ND2 N 2.582 -0.271 4.638 1.00 . A A . 2 ASN ND2 1 1 13 4440 1 1 3 ASN O O 4.527 1.259 4.447 1.00 . A A . 2 ASN O 1 1 13 4441 1 1 3 ASN OD1 O 3.423 -1.815 6.040 1.00 . A A . 2 ASN OD1 1 1 13 4442 1 1 4 TRP C C 4.912 3.389 3.099 1.00 . A A . 3 TRP C 1 1 13 4443 1 1 4 TRP CA C 3.872 3.930 4.064 1.00 . A A . 3 TRP CA 1 1 13 4444 1 1 4 TRP CB C 4.021 5.442 4.255 1.00 . A A . 3 TRP CB 1 1 13 4445 1 1 4 TRP CD1 C 5.401 5.861 6.374 1.00 . A A . 3 TRP CD1 1 1 13 4446 1 1 4 TRP CD2 C 6.442 6.376 4.475 1.00 . A A . 3 TRP CD2 1 1 13 4447 1 1 4 TRP CE2 C 7.302 6.677 5.540 1.00 . A A . 3 TRP CE2 1 1 13 4448 1 1 4 TRP CE3 C 6.868 6.603 3.176 1.00 . A A . 3 TRP CE3 1 1 13 4449 1 1 4 TRP CG C 5.233 5.867 5.025 1.00 . A A . 3 TRP CG 1 1 13 4450 1 1 4 TRP CH2 C 8.970 7.422 4.047 1.00 . A A . 3 TRP CH2 1 1 13 4451 1 1 4 TRP CZ2 C 8.573 7.204 5.338 1.00 . A A . 3 TRP CZ2 1 1 13 4452 1 1 4 TRP CZ3 C 8.130 7.122 2.968 1.00 . A A . 3 TRP CZ3 1 1 13 4453 1 1 4 TRP H H 3.750 3.745 6.160 1.00 . A A . 3 TRP H 1 1 13 4454 1 1 4 TRP HA H 2.904 3.744 3.636 1.00 . A A . 3 TRP HA 1 1 13 4455 1 1 4 TRP HB2 H 4.069 5.910 3.284 1.00 . A A . 3 TRP HB2 1 1 13 4456 1 1 4 TRP HB3 H 3.153 5.812 4.782 1.00 . A A . 3 TRP HB3 1 1 13 4457 1 1 4 TRP HD1 H 4.661 5.519 7.070 1.00 . A A . 3 TRP HD1 1 1 13 4458 1 1 4 TRP HE1 H 6.998 6.460 7.606 1.00 . A A . 3 TRP HE1 1 1 13 4459 1 1 4 TRP HE3 H 6.226 6.366 2.342 1.00 . A A . 3 TRP HE3 1 1 13 4460 1 1 4 TRP HH2 H 9.950 7.827 3.842 1.00 . A A . 3 TRP HH2 1 1 13 4461 1 1 4 TRP HZ2 H 9.229 7.442 6.158 1.00 . A A . 3 TRP HZ2 1 1 13 4462 1 1 4 TRP HZ3 H 8.477 7.307 1.963 1.00 . A A . 3 TRP HZ3 1 1 13 4463 1 1 4 TRP N N 3.927 3.240 5.343 1.00 . A A . 3 TRP N 1 1 13 4464 1 1 4 TRP NE1 N 6.643 6.357 6.697 1.00 . A A . 3 TRP NE1 1 1 13 4465 1 1 4 TRP O O 4.562 2.659 2.172 1.00 . A A . 3 TRP O 1 1 13 4466 1 1 5 THR C C 6.799 2.992 1.076 1.00 . A A . 4 THR C 1 1 13 4467 1 1 5 THR CA C 7.282 3.274 2.500 1.00 . A A . 4 THR CA 1 1 13 4468 1 1 5 THR CB C 7.971 2.018 3.070 1.00 . A A . 4 THR CB 1 1 13 4469 1 1 5 THR CG2 C 9.326 1.794 2.416 1.00 . A A . 4 THR CG2 1 1 13 4470 1 1 5 THR H H 6.385 4.224 4.151 1.00 . A A . 4 THR H 1 1 13 4471 1 1 5 THR HA H 8.001 4.078 2.481 1.00 . A A . 4 THR HA 1 1 13 4472 1 1 5 THR HB H 7.345 1.159 2.874 1.00 . A A . 4 THR HB 1 1 13 4473 1 1 5 THR HG1 H 8.279 3.088 4.698 1.00 . A A . 4 THR HG1 1 1 13 4474 1 1 5 THR HG21 H 9.195 1.651 1.353 1.00 . A A . 4 THR HG21 1 1 13 4475 1 1 5 THR HG22 H 9.792 0.918 2.841 1.00 . A A . 4 THR HG22 1 1 13 4476 1 1 5 THR HG23 H 9.956 2.655 2.588 1.00 . A A . 4 THR HG23 1 1 13 4477 1 1 5 THR N N 6.180 3.703 3.352 1.00 . A A . 4 THR N 1 1 13 4478 1 1 5 THR O O 7.243 2.045 0.430 1.00 . A A . 4 THR O 1 1 13 4479 1 1 5 THR OG1 O 8.145 2.161 4.484 1.00 . A A . 4 THR OG1 1 1 13 4480 1 1 6 GLY C C 4.542 4.850 -1.216 1.00 . A A . 5 GLY C 1 1 13 4481 1 1 6 GLY CA C 5.330 3.645 -0.731 1.00 . A A . 5 GLY CA 1 1 13 4482 1 1 6 GLY H H 5.585 4.586 1.146 1.00 . A A . 5 GLY H 1 1 13 4483 1 1 6 GLY HA2 H 6.135 3.450 -1.422 1.00 . A A . 5 GLY HA2 1 1 13 4484 1 1 6 GLY HA3 H 4.672 2.786 -0.705 1.00 . A A . 5 GLY HA3 1 1 13 4485 1 1 6 GLY N N 5.884 3.833 0.595 1.00 . A A . 5 GLY N 1 1 13 4486 1 1 6 GLY O O 3.598 4.706 -1.987 1.00 . A A . 5 GLY O 1 1 13 4487 1 1 7 LEU C C 5.202 8.201 -1.893 1.00 . A A . 6 LEU C 1 1 13 4488 1 1 7 LEU CA C 4.250 7.273 -1.145 1.00 . A A . 6 LEU CA 1 1 13 4489 1 1 7 LEU CB C 3.704 7.992 0.086 1.00 . A A . 6 LEU CB 1 1 13 4490 1 1 7 LEU CD1 C 5.760 9.119 1.009 1.00 . A A . 6 LEU CD1 1 1 13 4491 1 1 7 LEU CD2 C 3.941 8.389 2.555 1.00 . A A . 6 LEU CD2 1 1 13 4492 1 1 7 LEU CG C 4.678 8.080 1.264 1.00 . A A . 6 LEU CG 1 1 13 4493 1 1 7 LEU H H 5.648 6.075 -0.091 1.00 . A A . 6 LEU H 1 1 13 4494 1 1 7 LEU HA H 3.431 7.014 -1.796 1.00 . A A . 6 LEU HA 1 1 13 4495 1 1 7 LEU HB2 H 3.432 8.994 -0.205 1.00 . A A . 6 LEU HB2 1 1 13 4496 1 1 7 LEU HB3 H 2.817 7.474 0.414 1.00 . A A . 6 LEU HB3 1 1 13 4497 1 1 7 LEU HD11 H 6.403 9.189 1.877 1.00 . A A . 6 LEU HD11 1 1 13 4498 1 1 7 LEU HD12 H 5.301 10.079 0.823 1.00 . A A . 6 LEU HD12 1 1 13 4499 1 1 7 LEU HD13 H 6.346 8.827 0.151 1.00 . A A . 6 LEU HD13 1 1 13 4500 1 1 7 LEU HD21 H 3.188 7.635 2.728 1.00 . A A . 6 LEU HD21 1 1 13 4501 1 1 7 LEU HD22 H 3.472 9.358 2.479 1.00 . A A . 6 LEU HD22 1 1 13 4502 1 1 7 LEU HD23 H 4.645 8.392 3.376 1.00 . A A . 6 LEU HD23 1 1 13 4503 1 1 7 LEU HG H 5.162 7.123 1.383 1.00 . A A . 6 LEU HG 1 1 13 4504 1 1 7 LEU N N 4.919 6.034 -0.744 1.00 . A A . 6 LEU N 1 1 13 4505 1 1 7 LEU O O 4.933 9.394 -2.042 1.00 . A A . 6 LEU O 1 1 13 4506 1 1 8 TYR C C 7.831 7.700 -4.317 1.00 . A A . 7 TYR C 1 1 13 4507 1 1 8 TYR CA C 7.313 8.424 -3.074 1.00 . A A . 7 TYR CA 1 1 13 4508 1 1 8 TYR CB C 8.475 8.757 -2.135 1.00 . A A . 7 TYR CB 1 1 13 4509 1 1 8 TYR CD1 C 8.244 6.686 -0.746 1.00 . A A . 7 TYR CD1 1 1 13 4510 1 1 8 TYR CD2 C 10.414 7.249 -1.534 1.00 . A A . 7 TYR CD2 1 1 13 4511 1 1 8 TYR CE1 C 8.739 5.572 -0.136 1.00 . A A . 7 TYR CE1 1 1 13 4512 1 1 8 TYR CE2 C 10.930 6.123 -0.917 1.00 . A A . 7 TYR CE2 1 1 13 4513 1 1 8 TYR CG C 9.061 7.546 -1.454 1.00 . A A . 7 TYR CG 1 1 13 4514 1 1 8 TYR CZ C 10.086 5.285 -0.217 1.00 . A A . 7 TYR CZ 1 1 13 4515 1 1 8 TYR H H 6.451 6.694 -2.221 1.00 . A A . 7 TYR H 1 1 13 4516 1 1 8 TYR HA H 6.847 9.336 -3.377 1.00 . A A . 7 TYR HA 1 1 13 4517 1 1 8 TYR HB2 H 9.261 9.237 -2.698 1.00 . A A . 7 TYR HB2 1 1 13 4518 1 1 8 TYR HB3 H 8.122 9.427 -1.368 1.00 . A A . 7 TYR HB3 1 1 13 4519 1 1 8 TYR HD1 H 7.191 6.908 -0.671 1.00 . A A . 7 TYR HD1 1 1 13 4520 1 1 8 TYR HD2 H 11.068 7.910 -2.082 1.00 . A A . 7 TYR HD2 1 1 13 4521 1 1 8 TYR HE1 H 8.068 4.929 0.395 1.00 . A A . 7 TYR HE1 1 1 13 4522 1 1 8 TYR HE2 H 11.985 5.905 -0.984 1.00 . A A . 7 TYR HE2 1 1 13 4523 1 1 8 TYR HH H 11.391 4.385 0.870 1.00 . A A . 7 TYR HH 1 1 13 4524 1 1 8 TYR N N 6.306 7.646 -2.363 1.00 . A A . 7 TYR N 1 1 13 4525 1 1 8 TYR O O 7.909 8.288 -5.396 1.00 . A A . 7 TYR O 1 1 13 4526 1 1 8 TYR OH O 10.587 4.160 0.397 1.00 . A A . 7 TYR OH 1 1 13 4527 1 1 9 THR C C 7.744 4.513 -5.654 1.00 . A A . 8 THR C 1 1 13 4528 1 1 9 THR CA C 8.695 5.638 -5.285 1.00 . A A . 8 THR CA 1 1 13 4529 1 1 9 THR CB C 10.062 5.016 -4.959 1.00 . A A . 8 THR CB 1 1 13 4530 1 1 9 THR CG2 C 11.104 6.093 -4.697 1.00 . A A . 8 THR CG2 1 1 13 4531 1 1 9 THR H H 8.097 6.007 -3.284 1.00 . A A . 8 THR H 1 1 13 4532 1 1 9 THR HA H 8.810 6.294 -6.132 1.00 . A A . 8 THR HA 1 1 13 4533 1 1 9 THR HB H 10.381 4.424 -5.804 1.00 . A A . 8 THR HB 1 1 13 4534 1 1 9 THR HG1 H 9.150 3.619 -3.907 1.00 . A A . 8 THR HG1 1 1 13 4535 1 1 9 THR HG21 H 11.338 6.599 -5.623 1.00 . A A . 8 THR HG21 1 1 13 4536 1 1 9 THR HG22 H 11.999 5.639 -4.299 1.00 . A A . 8 THR HG22 1 1 13 4537 1 1 9 THR HG23 H 10.714 6.806 -3.988 1.00 . A A . 8 THR HG23 1 1 13 4538 1 1 9 THR N N 8.183 6.427 -4.166 1.00 . A A . 8 THR N 1 1 13 4539 1 1 9 THR O O 8.092 3.624 -6.430 1.00 . A A . 8 THR O 1 1 13 4540 1 1 9 THR OG1 O 9.940 4.163 -3.816 1.00 . A A . 8 THR OG1 1 1 13 4541 1 1 10 LEU C C 4.176 4.119 -5.584 1.00 . A A . 9 LEU C 1 1 13 4542 1 1 10 LEU CA C 5.554 3.527 -5.368 1.00 . A A . 9 LEU CA 1 1 13 4543 1 1 10 LEU CB C 5.527 2.523 -4.218 1.00 . A A . 9 LEU CB 1 1 13 4544 1 1 10 LEU CD1 C 6.797 1.020 -2.670 1.00 . A A . 9 LEU CD1 1 1 13 4545 1 1 10 LEU CD2 C 7.212 0.904 -5.128 1.00 . A A . 9 LEU CD2 1 1 13 4546 1 1 10 LEU CG C 6.856 1.812 -3.961 1.00 . A A . 9 LEU CG 1 1 13 4547 1 1 10 LEU H H 6.317 5.303 -4.509 1.00 . A A . 9 LEU H 1 1 13 4548 1 1 10 LEU HA H 5.847 3.017 -6.257 1.00 . A A . 9 LEU HA 1 1 13 4549 1 1 10 LEU HB2 H 5.241 3.046 -3.316 1.00 . A A . 9 LEU HB2 1 1 13 4550 1 1 10 LEU HB3 H 4.776 1.777 -4.434 1.00 . A A . 9 LEU HB3 1 1 13 4551 1 1 10 LEU HD11 H 6.627 1.693 -1.844 1.00 . A A . 9 LEU HD11 1 1 13 4552 1 1 10 LEU HD12 H 7.731 0.499 -2.525 1.00 . A A . 9 LEU HD12 1 1 13 4553 1 1 10 LEU HD13 H 5.990 0.306 -2.725 1.00 . A A . 9 LEU HD13 1 1 13 4554 1 1 10 LEU HD21 H 7.298 1.492 -6.029 1.00 . A A . 9 LEU HD21 1 1 13 4555 1 1 10 LEU HD22 H 6.437 0.161 -5.256 1.00 . A A . 9 LEU HD22 1 1 13 4556 1 1 10 LEU HD23 H 8.153 0.412 -4.928 1.00 . A A . 9 LEU HD23 1 1 13 4557 1 1 10 LEU HG H 7.639 2.549 -3.863 1.00 . A A . 9 LEU HG 1 1 13 4558 1 1 10 LEU N N 6.543 4.559 -5.102 1.00 . A A . 9 LEU N 1 1 13 4559 1 1 10 LEU O O 3.588 3.973 -6.654 1.00 . A A . 9 LEU O 1 1 13 4560 1 1 11 LEU C C 1.324 4.474 -5.160 1.00 . A A . 10 LEU C 1 1 13 4561 1 1 11 LEU CA C 2.373 5.433 -4.601 1.00 . A A . 10 LEU CA 1 1 13 4562 1 1 11 LEU CB C 2.420 6.721 -5.420 1.00 . A A . 10 LEU CB 1 1 13 4563 1 1 11 LEU CD1 C 4.812 7.373 -5.015 1.00 . A A . 10 LEU CD1 1 1 13 4564 1 1 11 LEU CD2 C 3.110 9.129 -5.543 1.00 . A A . 10 LEU CD2 1 1 13 4565 1 1 11 LEU CG C 3.358 7.792 -4.860 1.00 . A A . 10 LEU CG 1 1 13 4566 1 1 11 LEU H H 4.260 4.932 -3.783 1.00 . A A . 10 LEU H 1 1 13 4567 1 1 11 LEU HA H 2.104 5.679 -3.585 1.00 . A A . 10 LEU HA 1 1 13 4568 1 1 11 LEU HB2 H 2.742 6.476 -6.422 1.00 . A A . 10 LEU HB2 1 1 13 4569 1 1 11 LEU HB3 H 1.423 7.131 -5.470 1.00 . A A . 10 LEU HB3 1 1 13 4570 1 1 11 LEU HD11 H 5.446 8.245 -4.953 1.00 . A A . 10 LEU HD11 1 1 13 4571 1 1 11 LEU HD12 H 4.951 6.894 -5.972 1.00 . A A . 10 LEU HD12 1 1 13 4572 1 1 11 LEU HD13 H 5.075 6.682 -4.223 1.00 . A A . 10 LEU HD13 1 1 13 4573 1 1 11 LEU HD21 H 3.287 9.029 -6.604 1.00 . A A . 10 LEU HD21 1 1 13 4574 1 1 11 LEU HD22 H 3.780 9.872 -5.135 1.00 . A A . 10 LEU HD22 1 1 13 4575 1 1 11 LEU HD23 H 2.088 9.435 -5.376 1.00 . A A . 10 LEU HD23 1 1 13 4576 1 1 11 LEU HG H 3.161 7.911 -3.806 1.00 . A A . 10 LEU HG 1 1 13 4577 1 1 11 LEU N N 3.693 4.810 -4.568 1.00 . A A . 10 LEU N 1 1 13 4578 1 1 11 LEU O O 0.646 3.776 -4.406 1.00 . A A . 10 LEU O 1 1 13 4579 1 1 12 SER C C 0.888 2.207 -7.413 1.00 . A A . 11 SER C 1 1 13 4580 1 1 12 SER CA C 0.235 3.557 -7.132 1.00 . A A . 11 SER CA 1 1 13 4581 1 1 12 SER CB C -0.269 4.179 -8.437 1.00 . A A . 11 SER CB 1 1 13 4582 1 1 12 SER H H 1.742 5.040 -7.031 1.00 . A A . 11 SER H 1 1 13 4583 1 1 12 SER HA H -0.599 3.412 -6.463 1.00 . A A . 11 SER HA 1 1 13 4584 1 1 12 SER HB2 H 0.568 4.346 -9.100 1.00 . A A . 11 SER HB2 1 1 13 4585 1 1 12 SER HB3 H -0.972 3.507 -8.906 1.00 . A A . 11 SER HB3 1 1 13 4586 1 1 12 SER HG H -0.520 6.097 -8.749 1.00 . A A . 11 SER HG 1 1 13 4587 1 1 12 SER N N 1.188 4.447 -6.481 1.00 . A A . 11 SER N 1 1 13 4588 1 1 12 SER O O 0.424 1.440 -8.257 1.00 . A A . 11 SER O 1 1 13 4589 1 1 12 SER OG O -0.914 5.417 -8.196 1.00 . A A . 11 SER OG 1 1 13 4590 1 1 13 ARG C C 2.918 0.005 -5.495 1.00 . A A . 12 ARG C 1 1 13 4591 1 1 13 ARG CA C 2.709 0.681 -6.847 1.00 . A A . 12 ARG CA 1 1 13 4592 1 1 13 ARG CB C 4.059 0.968 -7.514 1.00 . A A . 12 ARG CB 1 1 13 4593 1 1 13 ARG CD C 6.246 0.090 -8.381 1.00 . A A . 12 ARG CD 1 1 13 4594 1 1 13 ARG CG C 4.862 -0.274 -7.868 1.00 . A A . 12 ARG CG 1 1 13 4595 1 1 13 ARG CZ C 8.250 -1.040 -9.253 1.00 . A A . 12 ARG CZ 1 1 13 4596 1 1 13 ARG H H 2.274 2.578 -6.023 1.00 . A A . 12 ARG H 1 1 13 4597 1 1 13 ARG HA H 2.130 0.029 -7.477 1.00 . A A . 12 ARG HA 1 1 13 4598 1 1 13 ARG HB2 H 3.884 1.524 -8.423 1.00 . A A . 12 ARG HB2 1 1 13 4599 1 1 13 ARG HB3 H 4.653 1.572 -6.845 1.00 . A A . 12 ARG HB3 1 1 13 4600 1 1 13 ARG HD2 H 6.139 0.706 -9.262 1.00 . A A . 12 ARG HD2 1 1 13 4601 1 1 13 ARG HD3 H 6.767 0.648 -7.614 1.00 . A A . 12 ARG HD3 1 1 13 4602 1 1 13 ARG HE H 6.632 -1.969 -8.547 1.00 . A A . 12 ARG HE 1 1 13 4603 1 1 13 ARG HG2 H 4.966 -0.889 -6.986 1.00 . A A . 12 ARG HG2 1 1 13 4604 1 1 13 ARG HG3 H 4.337 -0.825 -8.634 1.00 . A A . 12 ARG HG3 1 1 13 4605 1 1 13 ARG HH11 H 8.334 0.980 -9.290 1.00 . A A . 12 ARG HH11 1 1 13 4606 1 1 13 ARG HH12 H 9.737 0.167 -9.901 1.00 . A A . 12 ARG HH12 1 1 13 4607 1 1 13 ARG HH21 H 8.474 -3.047 -9.349 1.00 . A A . 12 ARG HH21 1 1 13 4608 1 1 13 ARG HH22 H 9.817 -2.121 -9.934 1.00 . A A . 12 ARG HH22 1 1 13 4609 1 1 13 ARG N N 1.967 1.927 -6.687 1.00 . A A . 12 ARG N 1 1 13 4610 1 1 13 ARG NE N 7.032 -1.092 -8.723 1.00 . A A . 12 ARG NE 1 1 13 4611 1 1 13 ARG NH1 N 8.820 0.132 -9.502 1.00 . A A . 12 ARG NH1 1 1 13 4612 1 1 13 ARG NH2 N 8.900 -2.161 -9.535 1.00 . A A . 12 ARG NH2 1 1 13 4613 1 1 13 ARG O O 3.582 -1.027 -5.393 1.00 . A A . 12 ARG O 1 1 13 4614 1 1 14 VAL C C 1.365 -0.969 -2.826 1.00 . A A . 13 VAL C 1 1 13 4615 1 1 14 VAL CA C 2.451 0.060 -3.110 1.00 . A A . 13 VAL CA 1 1 13 4616 1 1 14 VAL CB C 2.370 1.186 -2.062 1.00 . A A . 13 VAL CB 1 1 13 4617 1 1 14 VAL CG1 C 0.998 1.833 -2.085 1.00 . A A . 13 VAL CG1 1 1 13 4618 1 1 14 VAL CG2 C 2.690 0.656 -0.675 1.00 . A A . 13 VAL CG2 1 1 13 4619 1 1 14 VAL H H 1.800 1.397 -4.612 1.00 . A A . 13 VAL H 1 1 13 4620 1 1 14 VAL HA H 3.407 -0.416 -3.025 1.00 . A A . 13 VAL HA 1 1 13 4621 1 1 14 VAL HB H 3.100 1.938 -2.312 1.00 . A A . 13 VAL HB 1 1 13 4622 1 1 14 VAL HG11 H 0.280 1.168 -1.632 1.00 . A A . 13 VAL HG11 1 1 13 4623 1 1 14 VAL HG12 H 0.713 2.027 -3.108 1.00 . A A . 13 VAL HG12 1 1 13 4624 1 1 14 VAL HG13 H 1.028 2.762 -1.537 1.00 . A A . 13 VAL HG13 1 1 13 4625 1 1 14 VAL HG21 H 3.652 0.167 -0.691 1.00 . A A . 13 VAL HG21 1 1 13 4626 1 1 14 VAL HG22 H 1.929 -0.052 -0.379 1.00 . A A . 13 VAL HG22 1 1 13 4627 1 1 14 VAL HG23 H 2.713 1.477 0.026 1.00 . A A . 13 VAL HG23 1 1 13 4628 1 1 14 VAL N N 2.331 0.590 -4.461 1.00 . A A . 13 VAL N 1 1 13 4629 1 1 14 VAL O O 1.336 -1.589 -1.763 1.00 . A A . 13 VAL O 1 1 13 4630 1 1 15 ASN C C -1.484 -1.732 -2.451 1.00 . A A . 14 ASN C 1 1 13 4631 1 1 15 ASN CA C -0.624 -2.092 -3.658 1.00 . A A . 14 ASN CA 1 1 13 4632 1 1 15 ASN CB C -0.099 -3.524 -3.523 1.00 . A A . 14 ASN CB 1 1 13 4633 1 1 15 ASN CG C 0.732 -3.951 -4.716 1.00 . A A . 14 ASN CG 1 1 13 4634 1 1 15 ASN H H 0.585 -0.647 -4.626 1.00 . A A . 14 ASN H 1 1 13 4635 1 1 15 ASN HA H -1.226 -2.021 -4.548 1.00 . A A . 14 ASN HA 1 1 13 4636 1 1 15 ASN HB2 H 0.516 -3.593 -2.637 1.00 . A A . 14 ASN HB2 1 1 13 4637 1 1 15 ASN HB3 H -0.936 -4.200 -3.429 1.00 . A A . 14 ASN HB3 1 1 13 4638 1 1 15 ASN HD21 H 2.597 -3.976 -5.405 1.00 . A A . 14 ASN HD21 1 1 13 4639 1 1 15 ASN HD22 H 2.384 -3.277 -3.840 1.00 . A A . 14 ASN HD22 1 1 13 4640 1 1 15 ASN N N 0.483 -1.152 -3.794 1.00 . A A . 14 ASN N 1 1 13 4641 1 1 15 ASN ND2 N 2.036 -3.711 -4.647 1.00 . A A . 14 ASN ND2 1 1 13 4642 1 1 15 ASN O O -2.337 -2.511 -2.028 1.00 . A A . 14 ASN O 1 1 13 4643 1 1 15 ASN OD1 O 0.208 -4.492 -5.690 1.00 . A A . 14 ASN OD1 1 1 13 4644 1 1 16 ARG C C -1.843 -0.995 0.437 1.00 . A A . 15 ARG C 1 1 13 4645 1 1 16 ARG CA C -1.984 -0.046 -0.751 1.00 . A A . 15 ARG CA 1 1 13 4646 1 1 16 ARG CB C -3.463 0.152 -1.096 1.00 . A A . 15 ARG CB 1 1 13 4647 1 1 16 ARG CD C -3.240 2.539 -1.859 1.00 . A A . 15 ARG CD 1 1 13 4648 1 1 16 ARG CG C -3.700 1.138 -2.229 1.00 . A A . 15 ARG CG 1 1 13 4649 1 1 16 ARG CZ C -3.657 4.218 -0.109 1.00 . A A . 15 ARG CZ 1 1 13 4650 1 1 16 ARG H H -0.562 0.033 -2.311 1.00 . A A . 15 ARG H 1 1 13 4651 1 1 16 ARG HA H -1.558 0.910 -0.481 1.00 . A A . 15 ARG HA 1 1 13 4652 1 1 16 ARG HB2 H -3.884 -0.801 -1.381 1.00 . A A . 15 ARG HB2 1 1 13 4653 1 1 16 ARG HB3 H -3.979 0.514 -0.218 1.00 . A A . 15 ARG HB3 1 1 13 4654 1 1 16 ARG HD2 H -2.179 2.513 -1.655 1.00 . A A . 15 ARG HD2 1 1 13 4655 1 1 16 ARG HD3 H -3.429 3.198 -2.693 1.00 . A A . 15 ARG HD3 1 1 13 4656 1 1 16 ARG HE H -4.647 2.497 -0.299 1.00 . A A . 15 ARG HE 1 1 13 4657 1 1 16 ARG HG2 H -3.152 0.808 -3.099 1.00 . A A . 15 ARG HG2 1 1 13 4658 1 1 16 ARG HG3 H -4.756 1.165 -2.454 1.00 . A A . 15 ARG HG3 1 1 13 4659 1 1 16 ARG HH11 H -2.491 5.869 -0.171 1.00 . A A . 15 ARG HH11 1 1 13 4660 1 1 16 ARG HH12 H -2.184 4.698 -1.409 1.00 . A A . 15 ARG HH12 1 1 13 4661 1 1 16 ARG HH21 H -4.125 5.491 1.389 1.00 . A A . 15 ARG HH21 1 1 13 4662 1 1 16 ARG HH22 H -5.057 4.033 1.335 1.00 . A A . 15 ARG HH22 1 1 13 4663 1 1 16 ARG N N -1.249 -0.538 -1.911 1.00 . A A . 15 ARG N 1 1 13 4664 1 1 16 ARG NE N -3.936 3.051 -0.682 1.00 . A A . 15 ARG NE 1 1 13 4665 1 1 16 ARG NH1 N -2.699 4.991 -0.603 1.00 . A A . 15 ARG NH1 1 1 13 4666 1 1 16 ARG NH2 N -4.335 4.613 0.960 1.00 . A A . 15 ARG NH2 1 1 13 4667 1 1 16 ARG O O -0.973 -0.810 1.289 1.00 . A A . 15 ARG O 1 1 13 4668 1 1 17 HIS C C -2.846 -4.401 1.035 1.00 . A A . 16 HIS C 1 1 13 4669 1 1 17 HIS CA C -2.667 -2.985 1.572 1.00 . A A . 16 HIS CA 1 1 13 4670 1 1 17 HIS CB C -3.756 -2.673 2.600 1.00 . A A . 16 HIS CB 1 1 13 4671 1 1 17 HIS CD2 C -6.024 -3.655 1.806 1.00 . A A . 16 HIS CD2 1 1 13 4672 1 1 17 HIS CE1 C -6.965 -1.789 1.141 1.00 . A A . 16 HIS CE1 1 1 13 4673 1 1 17 HIS CG C -5.138 -2.652 2.024 1.00 . A A . 16 HIS CG 1 1 13 4674 1 1 17 HIS H H -3.370 -2.106 -0.220 1.00 . A A . 16 HIS H 1 1 13 4675 1 1 17 HIS HA H -1.702 -2.915 2.051 1.00 . A A . 16 HIS HA 1 1 13 4676 1 1 17 HIS HB2 H -3.733 -3.422 3.378 1.00 . A A . 16 HIS HB2 1 1 13 4677 1 1 17 HIS HB3 H -3.564 -1.703 3.035 1.00 . A A . 16 HIS HB3 1 1 13 4678 1 1 17 HIS HD1 H -5.372 -0.596 1.620 1.00 . A A . 16 HIS HD1 1 1 13 4679 1 1 17 HIS HD2 H -5.872 -4.703 2.024 1.00 . A A . 16 HIS HD2 1 1 13 4680 1 1 17 HIS HE1 H -7.677 -1.083 0.741 1.00 . A A . 16 HIS HE1 1 1 13 4681 1 1 17 HIS HE2 H -7.958 -3.574 0.994 1.00 . A A . 16 HIS HE2 1 1 13 4682 1 1 17 HIS N N -2.699 -2.010 0.488 1.00 . A A . 16 HIS N 1 1 13 4683 1 1 17 HIS ND1 N -5.758 -1.497 1.594 1.00 . A A . 16 HIS ND1 1 1 13 4684 1 1 17 HIS NE2 N -7.148 -3.090 1.257 1.00 . A A . 16 HIS NE2 1 1 13 4685 1 1 17 HIS O O -3.519 -4.613 0.027 1.00 . A A . 16 HIS O 1 1 13 4686 1 1 18 SER C C -2.368 -7.685 2.526 1.00 . A A . 17 SER C 1 1 13 4687 1 1 18 SER CA C -2.329 -6.765 1.309 1.00 . A A . 17 SER CA 1 1 13 4688 1 1 18 SER CB C -1.146 -7.135 0.413 1.00 . A A . 17 SER CB 1 1 13 4689 1 1 18 SER H H -1.715 -5.135 2.512 1.00 . A A . 17 SER H 1 1 13 4690 1 1 18 SER HA H -3.245 -6.888 0.751 1.00 . A A . 17 SER HA 1 1 13 4691 1 1 18 SER HB2 H -1.229 -8.172 0.122 1.00 . A A . 17 SER HB2 1 1 13 4692 1 1 18 SER HB3 H -1.156 -6.512 -0.469 1.00 . A A . 17 SER HB3 1 1 13 4693 1 1 18 SER HG H 0.802 -6.929 0.451 1.00 . A A . 17 SER HG 1 1 13 4694 1 1 18 SER N N -2.238 -5.368 1.717 1.00 . A A . 17 SER N 1 1 13 4695 1 1 18 SER O O -1.486 -7.632 3.384 1.00 . A A . 17 SER O 1 1 13 4696 1 1 18 SER OG O 0.085 -6.949 1.089 1.00 . A A . 17 SER OG 1 1 13 4697 1 1 19 THR C C -2.589 -10.634 3.572 1.00 . A A . 18 THR C 1 1 13 4698 1 1 19 THR CA C -3.549 -9.457 3.705 1.00 . A A . 18 THR CA 1 1 13 4699 1 1 19 THR CB C -4.991 -9.991 3.795 1.00 . A A . 18 THR CB 1 1 13 4700 1 1 19 THR CG2 C -5.401 -10.670 2.497 1.00 . A A . 18 THR CG2 1 1 13 4701 1 1 19 THR H H -4.066 -8.520 1.879 1.00 . A A . 18 THR H 1 1 13 4702 1 1 19 THR HA H -3.327 -8.925 4.618 1.00 . A A . 18 THR HA 1 1 13 4703 1 1 19 THR HB H -5.657 -9.159 3.974 1.00 . A A . 18 THR HB 1 1 13 4704 1 1 19 THR HG1 H -4.380 -10.783 5.496 1.00 . A A . 18 THR HG1 1 1 13 4705 1 1 19 THR HG21 H -6.414 -11.032 2.584 1.00 . A A . 18 THR HG21 1 1 13 4706 1 1 19 THR HG22 H -4.738 -11.499 2.298 1.00 . A A . 18 THR HG22 1 1 13 4707 1 1 19 THR HG23 H -5.341 -9.959 1.685 1.00 . A A . 18 THR HG23 1 1 13 4708 1 1 19 THR N N -3.395 -8.525 2.594 1.00 . A A . 18 THR N 1 1 13 4709 1 1 19 THR O O -2.417 -11.414 4.509 1.00 . A A . 18 THR O 1 1 13 4710 1 1 19 THR OG1 O -5.103 -10.920 4.880 1.00 . A A . 18 THR OG1 1 1 13 4711 1 1 20 ALA C C -1.694 -13.198 2.233 1.00 . A A . 19 ALA C 1 1 13 4712 1 1 20 ALA CA C -1.019 -11.833 2.136 1.00 . A A . 19 ALA CA 1 1 13 4713 1 1 20 ALA CB C 0.160 -11.754 3.095 1.00 . A A . 19 ALA CB 1 1 13 4714 1 1 20 ALA H H -2.149 -10.098 1.698 1.00 . A A . 19 ALA H 1 1 13 4715 1 1 20 ALA HA H -0.644 -11.703 1.132 1.00 . A A . 19 ALA HA 1 1 13 4716 1 1 20 ALA HB1 H 0.885 -12.513 2.837 1.00 . A A . 19 ALA HB1 1 1 13 4717 1 1 20 ALA HB2 H -0.185 -11.914 4.105 1.00 . A A . 19 ALA HB2 1 1 13 4718 1 1 20 ALA HB3 H 0.618 -10.779 3.022 1.00 . A A . 19 ALA HB3 1 1 13 4719 1 1 20 ALA N N -1.966 -10.754 2.402 1.00 . A A . 19 ALA N 1 1 13 4720 1 1 20 ALA O O -2.006 -13.673 3.326 1.00 . A A . 19 ALA O 1 1 13 4721 1 1 21 ILE C C -1.531 -16.253 1.222 1.00 . A A . 20 ILE C 1 1 13 4722 1 1 21 ILE CA C -2.553 -15.136 1.036 1.00 . A A . 20 ILE CA 1 1 13 4723 1 1 21 ILE CB C -3.298 -15.351 -0.296 1.00 . A A . 20 ILE CB 1 1 13 4724 1 1 21 ILE CD1 C -2.955 -15.530 -2.817 1.00 . A A . 20 ILE CD1 1 1 13 4725 1 1 21 ILE CG1 C -2.335 -15.194 -1.477 1.00 . A A . 20 ILE CG1 1 1 13 4726 1 1 21 ILE CG2 C -4.459 -14.374 -0.414 1.00 . A A . 20 ILE CG2 1 1 13 4727 1 1 21 ILE H H -1.642 -13.397 0.245 1.00 . A A . 20 ILE H 1 1 13 4728 1 1 21 ILE HA H -3.272 -15.184 1.839 1.00 . A A . 20 ILE HA 1 1 13 4729 1 1 21 ILE HB H -3.701 -16.353 -0.299 1.00 . A A . 20 ILE HB 1 1 13 4730 1 1 21 ILE HD11 H -3.788 -14.869 -3.003 1.00 . A A . 20 ILE HD11 1 1 13 4731 1 1 21 ILE HD12 H -3.303 -16.553 -2.805 1.00 . A A . 20 ILE HD12 1 1 13 4732 1 1 21 ILE HD13 H -2.216 -15.409 -3.594 1.00 . A A . 20 ILE HD13 1 1 13 4733 1 1 21 ILE HG12 H -1.992 -14.172 -1.517 1.00 . A A . 20 ILE HG12 1 1 13 4734 1 1 21 ILE HG13 H -1.488 -15.848 -1.330 1.00 . A A . 20 ILE HG13 1 1 13 4735 1 1 21 ILE HG21 H -4.082 -13.363 -0.398 1.00 . A A . 20 ILE HG21 1 1 13 4736 1 1 21 ILE HG22 H -5.137 -14.519 0.415 1.00 . A A . 20 ILE HG22 1 1 13 4737 1 1 21 ILE HG23 H -4.983 -14.549 -1.341 1.00 . A A . 20 ILE HG23 1 1 13 4738 1 1 21 ILE N N -1.915 -13.826 1.082 1.00 . A A . 20 ILE N 1 1 13 4739 1 1 21 ILE O O -1.784 -17.406 0.870 1.00 . A A . 20 ILE O 1 1 13 4740 1 1 22 GLY C C 1.239 -16.808 3.411 1.00 . A A . 21 GLY C 1 1 13 4741 1 1 22 GLY CA C 0.667 -16.884 2.010 1.00 . A A . 21 GLY CA 1 1 13 4742 1 1 22 GLY H H -0.239 -14.971 2.048 1.00 . A A . 21 GLY H 1 1 13 4743 1 1 22 GLY HA2 H 0.259 -17.872 1.852 1.00 . A A . 21 GLY HA2 1 1 13 4744 1 1 22 GLY HA3 H 1.461 -16.717 1.298 1.00 . A A . 21 GLY HA3 1 1 13 4745 1 1 22 GLY N N -0.379 -15.903 1.783 1.00 . A A . 21 GLY N 1 1 13 4746 1 1 22 GLY O O 1.556 -17.834 4.015 1.00 . A A . 21 GLY O 1 1 13 4747 1 1 23 ARG C C 3.306 -15.969 5.399 1.00 . A A . 22 ARG C 1 1 13 4748 1 1 23 ARG CA C 1.907 -15.373 5.269 1.00 . A A . 22 ARG CA 1 1 13 4749 1 1 23 ARG CB C 0.976 -15.982 6.321 1.00 . A A . 22 ARG CB 1 1 13 4750 1 1 23 ARG CD C 0.465 -16.350 8.754 1.00 . A A . 22 ARG CD 1 1 13 4751 1 1 23 ARG CG C 1.426 -15.732 7.751 1.00 . A A . 22 ARG CG 1 1 13 4752 1 1 23 ARG CZ C -0.407 -18.572 9.354 1.00 . A A . 22 ARG CZ 1 1 13 4753 1 1 23 ARG H H 1.097 -14.813 3.394 1.00 . A A . 22 ARG H 1 1 13 4754 1 1 23 ARG HA H 1.967 -14.307 5.432 1.00 . A A . 22 ARG HA 1 1 13 4755 1 1 23 ARG HB2 H -0.011 -15.563 6.197 1.00 . A A . 22 ARG HB2 1 1 13 4756 1 1 23 ARG HB3 H 0.926 -17.050 6.164 1.00 . A A . 22 ARG HB3 1 1 13 4757 1 1 23 ARG HD2 H 0.818 -16.134 9.752 1.00 . A A . 22 ARG HD2 1 1 13 4758 1 1 23 ARG HD3 H -0.512 -15.911 8.615 1.00 . A A . 22 ARG HD3 1 1 13 4759 1 1 23 ARG HE H 0.887 -18.213 7.878 1.00 . A A . 22 ARG HE 1 1 13 4760 1 1 23 ARG HG2 H 2.405 -16.166 7.891 1.00 . A A . 22 ARG HG2 1 1 13 4761 1 1 23 ARG HG3 H 1.473 -14.666 7.922 1.00 . A A . 22 ARG HG3 1 1 13 4762 1 1 23 ARG HH11 H -1.106 -17.052 10.491 1.00 . A A . 22 ARG HH11 1 1 13 4763 1 1 23 ARG HH12 H -1.708 -18.624 10.899 1.00 . A A . 22 ARG HH12 1 1 13 4764 1 1 23 ARG HH21 H 0.099 -20.285 8.411 1.00 . A A . 22 ARG HH21 1 1 13 4765 1 1 23 ARG HH22 H -1.024 -20.461 9.717 1.00 . A A . 22 ARG HH22 1 1 13 4766 1 1 23 ARG N N 1.370 -15.589 3.929 1.00 . A A . 22 ARG N 1 1 13 4767 1 1 23 ARG NE N 0.360 -17.798 8.592 1.00 . A A . 22 ARG NE 1 1 13 4768 1 1 23 ARG NH1 N -1.133 -18.038 10.328 1.00 . A A . 22 ARG NH1 1 1 13 4769 1 1 23 ARG NH2 N -0.447 -19.880 9.143 1.00 . A A . 22 ARG NH2 1 1 13 4770 1 1 23 ARG O O 4.284 -15.249 5.103 1.00 . A A . 22 ARG O 1 1 13 4771 1 1 23 ARG OXT O 3.414 -17.147 5.798 1.00 . A A . 22 ARG OXT 1 1 14 4772 1 1 1 ACE C C 4.949 1.659 11.509 1.00 . A A . 0 ACE C 1 1 14 4773 1 1 1 ACE CH3 C 4.424 1.021 12.767 1.00 . A A . 0 ACE CH3 1 1 14 4774 1 1 1 ACE H1 H 3.539 0.443 12.521 1.00 . A A . 0 ACE H1 1 1 14 4775 1 1 1 ACE H2 H 4.165 1.786 13.475 1.00 . A A . 0 ACE H2 1 1 14 4776 1 1 1 ACE H3 H 5.200 0.388 13.186 1.00 . A A . 0 ACE H3 1 1 14 4777 1 1 1 ACE O O 6.111 1.473 11.146 1.00 . A A . 0 ACE O 1 1 14 4778 1 1 2 MET C C 4.928 2.100 8.543 1.00 . A A . 1 MET C 1 1 14 4779 1 1 2 MET CA C 4.462 3.098 9.598 1.00 . A A . 1 MET CA 1 1 14 4780 1 1 2 MET CB C 5.563 4.130 9.861 1.00 . A A . 1 MET CB 1 1 14 4781 1 1 2 MET CE C 4.219 6.474 13.048 1.00 . A A . 1 MET CE 1 1 14 4782 1 1 2 MET CG C 5.104 5.322 10.689 1.00 . A A . 1 MET CG 1 1 14 4783 1 1 2 MET H H 3.177 2.524 11.180 1.00 . A A . 1 MET H 1 1 14 4784 1 1 2 MET HA H 3.587 3.610 9.228 1.00 . A A . 1 MET HA 1 1 14 4785 1 1 2 MET HB2 H 6.374 3.648 10.386 1.00 . A A . 1 MET HB2 1 1 14 4786 1 1 2 MET HB3 H 5.928 4.498 8.914 1.00 . A A . 1 MET HB3 1 1 14 4787 1 1 2 MET HE1 H 3.406 6.892 12.472 1.00 . A A . 1 MET HE1 1 1 14 4788 1 1 2 MET HE2 H 5.072 7.135 12.999 1.00 . A A . 1 MET HE2 1 1 14 4789 1 1 2 MET HE3 H 3.911 6.361 14.077 1.00 . A A . 1 MET HE3 1 1 14 4790 1 1 2 MET HG2 H 5.903 6.048 10.720 1.00 . A A . 1 MET HG2 1 1 14 4791 1 1 2 MET HG3 H 4.239 5.761 10.213 1.00 . A A . 1 MET HG3 1 1 14 4792 1 1 2 MET N N 4.088 2.419 10.836 1.00 . A A . 1 MET N 1 1 14 4793 1 1 2 MET O O 6.085 1.679 8.538 1.00 . A A . 1 MET O 1 1 14 4794 1 1 2 MET SD S 4.666 4.874 12.380 1.00 . A A . 1 MET SD 1 1 14 4795 1 1 3 ASN C C 4.338 1.464 5.228 1.00 . A A . 2 ASN C 1 1 14 4796 1 1 3 ASN CA C 4.334 0.778 6.586 1.00 . A A . 2 ASN CA 1 1 14 4797 1 1 3 ASN CB C 3.320 -0.369 6.566 1.00 . A A . 2 ASN CB 1 1 14 4798 1 1 3 ASN CG C 3.587 -1.358 5.442 1.00 . A A . 2 ASN CG 1 1 14 4799 1 1 3 ASN H H 3.111 2.093 7.707 1.00 . A A . 2 ASN H 1 1 14 4800 1 1 3 ASN HA H 5.318 0.376 6.779 1.00 . A A . 2 ASN HA 1 1 14 4801 1 1 3 ASN HB2 H 3.367 -0.899 7.505 1.00 . A A . 2 ASN HB2 1 1 14 4802 1 1 3 ASN HB3 H 2.329 0.037 6.434 1.00 . A A . 2 ASN HB3 1 1 14 4803 1 1 3 ASN HD21 H 3.341 -1.623 3.481 1.00 . A A . 2 ASN HD21 1 1 14 4804 1 1 3 ASN HD22 H 2.744 -0.130 4.115 1.00 . A A . 2 ASN HD22 1 1 14 4805 1 1 3 ASN N N 4.017 1.725 7.650 1.00 . A A . 2 ASN N 1 1 14 4806 1 1 3 ASN ND2 N 3.181 -1.002 4.223 1.00 . A A . 2 ASN ND2 1 1 14 4807 1 1 3 ASN O O 4.763 0.874 4.235 1.00 . A A . 2 ASN O 1 1 14 4808 1 1 3 ASN OD1 O 4.165 -2.422 5.663 1.00 . A A . 2 ASN OD1 1 1 14 4809 1 1 4 TRP C C 4.942 3.084 3.012 1.00 . A A . 3 TRP C 1 1 14 4810 1 1 4 TRP CA C 3.809 3.464 3.947 1.00 . A A . 3 TRP CA 1 1 14 4811 1 1 4 TRP CB C 3.797 4.970 4.213 1.00 . A A . 3 TRP CB 1 1 14 4812 1 1 4 TRP CD1 C 5.039 5.447 6.402 1.00 . A A . 3 TRP CD1 1 1 14 4813 1 1 4 TRP CD2 C 6.122 6.091 4.565 1.00 . A A . 3 TRP CD2 1 1 14 4814 1 1 4 TRP CE2 C 6.903 6.435 5.678 1.00 . A A . 3 TRP CE2 1 1 14 4815 1 1 4 TRP CE3 C 6.588 6.385 3.294 1.00 . A A . 3 TRP CE3 1 1 14 4816 1 1 4 TRP CG C 4.934 5.473 5.047 1.00 . A A . 3 TRP CG 1 1 14 4817 1 1 4 TRP CH2 C 8.574 7.348 4.282 1.00 . A A . 3 TRP CH2 1 1 14 4818 1 1 4 TRP CZ2 C 8.136 7.067 5.548 1.00 . A A . 3 TRP CZ2 1 1 14 4819 1 1 4 TRP CZ3 C 7.812 7.010 3.158 1.00 . A A . 3 TRP CZ3 1 1 14 4820 1 1 4 TRP H H 3.604 3.151 6.022 1.00 . A A . 3 TRP H 1 1 14 4821 1 1 4 TRP HA H 2.885 3.201 3.465 1.00 . A A . 3 TRP HA 1 1 14 4822 1 1 4 TRP HB2 H 3.833 5.489 3.265 1.00 . A A . 3 TRP HB2 1 1 14 4823 1 1 4 TRP HB3 H 2.879 5.227 4.720 1.00 . A A . 3 TRP HB3 1 1 14 4824 1 1 4 TRP HD1 H 4.297 5.030 7.055 1.00 . A A . 3 TRP HD1 1 1 14 4825 1 1 4 TRP HE1 H 6.524 6.142 7.720 1.00 . A A . 3 TRP HE1 1 1 14 4826 1 1 4 TRP HE3 H 6.009 6.118 2.424 1.00 . A A . 3 TRP HE3 1 1 14 4827 1 1 4 TRP HH2 H 9.524 7.837 4.134 1.00 . A A . 3 TRP HH2 1 1 14 4828 1 1 4 TRP HZ2 H 8.731 7.337 6.404 1.00 . A A . 3 TRP HZ2 1 1 14 4829 1 1 4 TRP HZ3 H 8.190 7.246 2.175 1.00 . A A . 3 TRP HZ3 1 1 14 4830 1 1 4 TRP N N 3.882 2.716 5.193 1.00 . A A . 3 TRP N 1 1 14 4831 1 1 4 TRP NE1 N 6.221 6.033 6.795 1.00 . A A . 3 TRP NE1 1 1 14 4832 1 1 4 TRP O O 4.702 2.441 1.991 1.00 . A A . 3 TRP O 1 1 14 4833 1 1 5 THR C C 6.993 2.899 1.138 1.00 . A A . 4 THR C 1 1 14 4834 1 1 5 THR CA C 7.357 3.161 2.600 1.00 . A A . 4 THR CA 1 1 14 4835 1 1 5 THR CB C 8.139 1.957 3.161 1.00 . A A . 4 THR CB 1 1 14 4836 1 1 5 THR CG2 C 9.543 1.897 2.574 1.00 . A A . 4 THR CG2 1 1 14 4837 1 1 5 THR H H 6.278 3.883 4.260 1.00 . A A . 4 THR H 1 1 14 4838 1 1 5 THR HA H 7.988 4.033 2.658 1.00 . A A . 4 THR HA 1 1 14 4839 1 1 5 THR HB H 7.615 1.049 2.902 1.00 . A A . 4 THR HB 1 1 14 4840 1 1 5 THR HG1 H 8.268 2.984 4.840 1.00 . A A . 4 THR HG1 1 1 14 4841 1 1 5 THR HG21 H 10.072 2.808 2.811 1.00 . A A . 4 THR HG21 1 1 14 4842 1 1 5 THR HG22 H 9.480 1.786 1.501 1.00 . A A . 4 THR HG22 1 1 14 4843 1 1 5 THR HG23 H 10.072 1.054 2.992 1.00 . A A . 4 THR HG23 1 1 14 4844 1 1 5 THR N N 6.167 3.436 3.398 1.00 . A A . 4 THR N 1 1 14 4845 1 1 5 THR O O 7.498 1.965 0.516 1.00 . A A . 4 THR O 1 1 14 4846 1 1 5 THR OG1 O 8.227 2.059 4.587 1.00 . A A . 4 THR OG1 1 1 14 4847 1 1 6 GLY C C 4.779 4.690 -1.260 1.00 . A A . 5 GLY C 1 1 14 4848 1 1 6 GLY CA C 5.674 3.563 -0.773 1.00 . A A . 5 GLY CA 1 1 14 4849 1 1 6 GLY H H 5.755 4.476 1.133 1.00 . A A . 5 GLY H 1 1 14 4850 1 1 6 GLY HA2 H 6.542 3.504 -1.410 1.00 . A A . 5 GLY HA2 1 1 14 4851 1 1 6 GLY HA3 H 5.125 2.631 -0.838 1.00 . A A . 5 GLY HA3 1 1 14 4852 1 1 6 GLY N N 6.110 3.737 0.597 1.00 . A A . 5 GLY N 1 1 14 4853 1 1 6 GLY O O 3.955 4.492 -2.149 1.00 . A A . 5 GLY O 1 1 14 4854 1 1 7 LEU C C 4.968 8.114 -1.731 1.00 . A A . 6 LEU C 1 1 14 4855 1 1 7 LEU CA C 4.126 7.035 -1.057 1.00 . A A . 6 LEU CA 1 1 14 4856 1 1 7 LEU CB C 3.441 7.623 0.165 1.00 . A A . 6 LEU CB 1 1 14 4857 1 1 7 LEU CD1 C 5.296 8.964 1.223 1.00 . A A . 6 LEU CD1 1 1 14 4858 1 1 7 LEU CD2 C 3.525 7.945 2.655 1.00 . A A . 6 LEU CD2 1 1 14 4859 1 1 7 LEU CG C 4.346 7.786 1.390 1.00 . A A . 6 LEU CG 1 1 14 4860 1 1 7 LEU H H 5.578 5.959 0.061 1.00 . A A . 6 LEU H 1 1 14 4861 1 1 7 LEU HA H 3.373 6.698 -1.752 1.00 . A A . 6 LEU HA 1 1 14 4862 1 1 7 LEU HB2 H 3.054 8.591 -0.105 1.00 . A A . 6 LEU HB2 1 1 14 4863 1 1 7 LEU HB3 H 2.617 6.982 0.429 1.00 . A A . 6 LEU HB3 1 1 14 4864 1 1 7 LEU HD11 H 5.884 9.080 2.124 1.00 . A A . 6 LEU HD11 1 1 14 4865 1 1 7 LEU HD12 H 4.725 9.864 1.047 1.00 . A A . 6 LEU HD12 1 1 14 4866 1 1 7 LEU HD13 H 5.952 8.782 0.386 1.00 . A A . 6 LEU HD13 1 1 14 4867 1 1 7 LEU HD21 H 2.937 8.848 2.592 1.00 . A A . 6 LEU HD21 1 1 14 4868 1 1 7 LEU HD22 H 4.188 8.003 3.507 1.00 . A A . 6 LEU HD22 1 1 14 4869 1 1 7 LEU HD23 H 2.869 7.094 2.766 1.00 . A A . 6 LEU HD23 1 1 14 4870 1 1 7 LEU HG H 4.943 6.896 1.496 1.00 . A A . 6 LEU HG 1 1 14 4871 1 1 7 LEU N N 4.930 5.872 -0.668 1.00 . A A . 6 LEU N 1 1 14 4872 1 1 7 LEU O O 4.557 9.272 -1.816 1.00 . A A . 6 LEU O 1 1 14 4873 1 1 8 TYR C C 7.329 8.215 -4.303 1.00 . A A . 7 TYR C 1 1 14 4874 1 1 8 TYR CA C 7.042 8.657 -2.873 1.00 . A A . 7 TYR CA 1 1 14 4875 1 1 8 TYR CB C 8.350 8.788 -2.089 1.00 . A A . 7 TYR CB 1 1 14 4876 1 1 8 TYR CD1 C 8.133 6.691 -0.744 1.00 . A A . 7 TYR CD1 1 1 14 4877 1 1 8 TYR CD2 C 10.119 6.983 -2.019 1.00 . A A . 7 TYR CD2 1 1 14 4878 1 1 8 TYR CE1 C 8.581 5.480 -0.304 1.00 . A A . 7 TYR CE1 1 1 14 4879 1 1 8 TYR CE2 C 10.585 5.759 -1.575 1.00 . A A . 7 TYR CE2 1 1 14 4880 1 1 8 TYR CG C 8.884 7.466 -1.605 1.00 . A A . 7 TYR CG 1 1 14 4881 1 1 8 TYR CZ C 9.809 5.009 -0.716 1.00 . A A . 7 TYR CZ 1 1 14 4882 1 1 8 TYR H H 6.396 6.794 -2.109 1.00 . A A . 7 TYR H 1 1 14 4883 1 1 8 TYR HA H 6.556 9.610 -2.897 1.00 . A A . 7 TYR HA 1 1 14 4884 1 1 8 TYR HB2 H 9.099 9.240 -2.719 1.00 . A A . 7 TYR HB2 1 1 14 4885 1 1 8 TYR HB3 H 8.181 9.412 -1.226 1.00 . A A . 7 TYR HB3 1 1 14 4886 1 1 8 TYR HD1 H 7.171 7.056 -0.415 1.00 . A A . 7 TYR HD1 1 1 14 4887 1 1 8 TYR HD2 H 10.719 7.578 -2.691 1.00 . A A . 7 TYR HD2 1 1 14 4888 1 1 8 TYR HE1 H 7.962 4.908 0.356 1.00 . A A . 7 TYR HE1 1 1 14 4889 1 1 8 TYR HE2 H 11.548 5.396 -1.903 1.00 . A A . 7 TYR HE2 1 1 14 4890 1 1 8 TYR HH H 11.181 3.862 -0.011 1.00 . A A . 7 TYR HH 1 1 14 4891 1 1 8 TYR N N 6.135 7.727 -2.209 1.00 . A A . 7 TYR N 1 1 14 4892 1 1 8 TYR O O 7.325 9.027 -5.228 1.00 . A A . 7 TYR O 1 1 14 4893 1 1 8 TYR OH O 10.260 3.787 -0.272 1.00 . A A . 7 TYR OH 1 1 14 4894 1 1 9 THR C C 7.204 5.005 -5.964 1.00 . A A . 8 THR C 1 1 14 4895 1 1 9 THR CA C 7.860 6.368 -5.794 1.00 . A A . 8 THR CA 1 1 14 4896 1 1 9 THR CB C 9.374 6.234 -6.041 1.00 . A A . 8 THR CB 1 1 14 4897 1 1 9 THR CG2 C 10.045 7.599 -6.063 1.00 . A A . 8 THR CG2 1 1 14 4898 1 1 9 THR H H 7.578 6.326 -3.697 1.00 . A A . 8 THR H 1 1 14 4899 1 1 9 THR HA H 7.453 7.042 -6.528 1.00 . A A . 8 THR HA 1 1 14 4900 1 1 9 THR HB H 9.526 5.759 -7.001 1.00 . A A . 8 THR HB 1 1 14 4901 1 1 9 THR HG1 H 9.272 5.020 -4.493 1.00 . A A . 8 THR HG1 1 1 14 4902 1 1 9 THR HG21 H 9.888 8.092 -5.115 1.00 . A A . 8 THR HG21 1 1 14 4903 1 1 9 THR HG22 H 9.619 8.197 -6.856 1.00 . A A . 8 THR HG22 1 1 14 4904 1 1 9 THR HG23 H 11.104 7.477 -6.234 1.00 . A A . 8 THR HG23 1 1 14 4905 1 1 9 THR N N 7.579 6.922 -4.476 1.00 . A A . 8 THR N 1 1 14 4906 1 1 9 THR O O 7.405 4.326 -6.970 1.00 . A A . 8 THR O 1 1 14 4907 1 1 9 THR OG1 O 9.965 5.423 -5.021 1.00 . A A . 8 THR OG1 1 1 14 4908 1 1 10 LEU C C 4.227 3.518 -4.746 1.00 . A A . 9 LEU C 1 1 14 4909 1 1 10 LEU CA C 5.720 3.333 -4.999 1.00 . A A . 9 LEU CA 1 1 14 4910 1 1 10 LEU CB C 6.304 2.364 -3.962 1.00 . A A . 9 LEU CB 1 1 14 4911 1 1 10 LEU CD1 C 7.620 1.104 -5.701 1.00 . A A . 9 LEU CD1 1 1 14 4912 1 1 10 LEU CD2 C 8.778 2.750 -4.216 1.00 . A A . 9 LEU CD2 1 1 14 4913 1 1 10 LEU CG C 7.657 1.728 -4.313 1.00 . A A . 9 LEU CG 1 1 14 4914 1 1 10 LEU H H 6.294 5.208 -4.201 1.00 . A A . 9 LEU H 1 1 14 4915 1 1 10 LEU HA H 5.850 2.914 -5.983 1.00 . A A . 9 LEU HA 1 1 14 4916 1 1 10 LEU HB2 H 6.420 2.900 -3.034 1.00 . A A . 9 LEU HB2 1 1 14 4917 1 1 10 LEU HB3 H 5.590 1.569 -3.806 1.00 . A A . 9 LEU HB3 1 1 14 4918 1 1 10 LEU HD11 H 6.846 0.352 -5.737 1.00 . A A . 9 LEU HD11 1 1 14 4919 1 1 10 LEU HD12 H 8.576 0.648 -5.916 1.00 . A A . 9 LEU HD12 1 1 14 4920 1 1 10 LEU HD13 H 7.415 1.869 -6.435 1.00 . A A . 9 LEU HD13 1 1 14 4921 1 1 10 LEU HD21 H 8.708 3.272 -3.274 1.00 . A A . 9 LEU HD21 1 1 14 4922 1 1 10 LEU HD22 H 8.693 3.456 -5.028 1.00 . A A . 9 LEU HD22 1 1 14 4923 1 1 10 LEU HD23 H 9.731 2.245 -4.278 1.00 . A A . 9 LEU HD23 1 1 14 4924 1 1 10 LEU HG H 7.868 0.940 -3.604 1.00 . A A . 9 LEU HG 1 1 14 4925 1 1 10 LEU N N 6.415 4.615 -4.969 1.00 . A A . 9 LEU N 1 1 14 4926 1 1 10 LEU O O 3.513 2.555 -4.484 1.00 . A A . 9 LEU O 1 1 14 4927 1 1 11 LEU C C 1.458 4.113 -5.338 1.00 . A A . 10 LEU C 1 1 14 4928 1 1 11 LEU CA C 2.363 5.090 -4.597 1.00 . A A . 10 LEU CA 1 1 14 4929 1 1 11 LEU CB C 2.073 6.516 -5.071 1.00 . A A . 10 LEU CB 1 1 14 4930 1 1 11 LEU CD1 C 4.293 7.622 -4.659 1.00 . A A . 10 LEU CD1 1 1 14 4931 1 1 11 LEU CD2 C 2.194 8.979 -4.623 1.00 . A A . 10 LEU CD2 1 1 14 4932 1 1 11 LEU CG C 2.810 7.623 -4.314 1.00 . A A . 10 LEU CG 1 1 14 4933 1 1 11 LEU H H 4.407 5.490 -4.964 1.00 . A A . 10 LEU H 1 1 14 4934 1 1 11 LEU HA H 2.157 5.025 -3.541 1.00 . A A . 10 LEU HA 1 1 14 4935 1 1 11 LEU HB2 H 2.341 6.582 -6.116 1.00 . A A . 10 LEU HB2 1 1 14 4936 1 1 11 LEU HB3 H 1.011 6.692 -4.980 1.00 . A A . 10 LEU HB3 1 1 14 4937 1 1 11 LEU HD11 H 4.820 6.954 -3.985 1.00 . A A . 10 LEU HD11 1 1 14 4938 1 1 11 LEU HD12 H 4.688 8.621 -4.553 1.00 . A A . 10 LEU HD12 1 1 14 4939 1 1 11 LEU HD13 H 4.428 7.286 -5.676 1.00 . A A . 10 LEU HD13 1 1 14 4940 1 1 11 LEU HD21 H 2.722 9.747 -4.077 1.00 . A A . 10 LEU HD21 1 1 14 4941 1 1 11 LEU HD22 H 1.155 8.978 -4.328 1.00 . A A . 10 LEU HD22 1 1 14 4942 1 1 11 LEU HD23 H 2.268 9.175 -5.682 1.00 . A A . 10 LEU HD23 1 1 14 4943 1 1 11 LEU HG H 2.718 7.446 -3.255 1.00 . A A . 10 LEU HG 1 1 14 4944 1 1 11 LEU N N 3.773 4.765 -4.803 1.00 . A A . 10 LEU N 1 1 14 4945 1 1 11 LEU O O 0.691 3.372 -4.725 1.00 . A A . 10 LEU O 1 1 14 4946 1 1 12 SER C C 1.445 1.890 -7.645 1.00 . A A . 11 SER C 1 1 14 4947 1 1 12 SER CA C 0.742 3.232 -7.489 1.00 . A A . 11 SER CA 1 1 14 4948 1 1 12 SER CB C 0.492 3.858 -8.863 1.00 . A A . 11 SER CB 1 1 14 4949 1 1 12 SER H H 2.163 4.751 -7.093 1.00 . A A . 11 SER H 1 1 14 4950 1 1 12 SER HA H -0.205 3.077 -6.993 1.00 . A A . 11 SER HA 1 1 14 4951 1 1 12 SER HB2 H 1.438 4.036 -9.353 1.00 . A A . 11 SER HB2 1 1 14 4952 1 1 12 SER HB3 H -0.102 3.183 -9.461 1.00 . A A . 11 SER HB3 1 1 14 4953 1 1 12 SER HG H -0.607 5.146 -7.879 1.00 . A A . 11 SER HG 1 1 14 4954 1 1 12 SER N N 1.544 4.125 -6.662 1.00 . A A . 11 SER N 1 1 14 4955 1 1 12 SER O O 1.086 1.081 -8.501 1.00 . A A . 11 SER O 1 1 14 4956 1 1 12 SER OG O -0.198 5.090 -8.746 1.00 . A A . 11 SER OG 1 1 14 4957 1 1 13 ARG C C 3.271 -0.224 -5.459 1.00 . A A . 12 ARG C 1 1 14 4958 1 1 13 ARG CA C 3.222 0.431 -6.836 1.00 . A A . 12 ARG CA 1 1 14 4959 1 1 13 ARG CB C 4.645 0.725 -7.314 1.00 . A A . 12 ARG CB 1 1 14 4960 1 1 13 ARG CD C 6.122 1.869 -8.990 1.00 . A A . 12 ARG CD 1 1 14 4961 1 1 13 ARG CG C 4.710 1.403 -8.672 1.00 . A A . 12 ARG CG 1 1 14 4962 1 1 13 ARG CZ C 7.307 3.103 -10.759 1.00 . A A . 12 ARG CZ 1 1 14 4963 1 1 13 ARG H H 2.675 2.351 -6.143 1.00 . A A . 12 ARG H 1 1 14 4964 1 1 13 ARG HA H 2.747 -0.242 -7.528 1.00 . A A . 12 ARG HA 1 1 14 4965 1 1 13 ARG HB2 H 5.124 1.372 -6.593 1.00 . A A . 12 ARG HB2 1 1 14 4966 1 1 13 ARG HB3 H 5.192 -0.203 -7.372 1.00 . A A . 12 ARG HB3 1 1 14 4967 1 1 13 ARG HD2 H 6.443 2.558 -8.220 1.00 . A A . 12 ARG HD2 1 1 14 4968 1 1 13 ARG HD3 H 6.778 1.011 -9.000 1.00 . A A . 12 ARG HD3 1 1 14 4969 1 1 13 ARG HE H 5.386 2.571 -10.830 1.00 . A A . 12 ARG HE 1 1 14 4970 1 1 13 ARG HG2 H 4.393 0.702 -9.430 1.00 . A A . 12 ARG HG2 1 1 14 4971 1 1 13 ARG HG3 H 4.050 2.259 -8.670 1.00 . A A . 12 ARG HG3 1 1 14 4972 1 1 13 ARG HH11 H 9.257 3.503 -10.406 1.00 . A A . 12 ARG HH11 1 1 14 4973 1 1 13 ARG HH12 H 8.439 2.635 -9.150 1.00 . A A . 12 ARG HH12 1 1 14 4974 1 1 13 ARG HH21 H 8.129 4.117 -12.303 1.00 . A A . 12 ARG HH21 1 1 14 4975 1 1 13 ARG HH22 H 6.455 3.715 -12.487 1.00 . A A . 12 ARG HH22 1 1 14 4976 1 1 13 ARG N N 2.448 1.665 -6.803 1.00 . A A . 12 ARG N 1 1 14 4977 1 1 13 ARG NE N 6.200 2.539 -10.286 1.00 . A A . 12 ARG NE 1 1 14 4978 1 1 13 ARG NH1 N 8.426 3.078 -10.047 1.00 . A A . 12 ARG NH1 1 1 14 4979 1 1 13 ARG NH2 N 7.296 3.693 -11.947 1.00 . A A . 12 ARG NH2 1 1 14 4980 1 1 13 ARG O O 4.012 -1.184 -5.244 1.00 . A A . 12 ARG O 1 1 14 4981 1 1 14 VAL C C 1.109 -0.917 -2.888 1.00 . A A . 13 VAL C 1 1 14 4982 1 1 14 VAL CA C 2.436 -0.230 -3.176 1.00 . A A . 13 VAL CA 1 1 14 4983 1 1 14 VAL CB C 2.668 0.888 -2.140 1.00 . A A . 13 VAL CB 1 1 14 4984 1 1 14 VAL CG1 C 1.522 1.881 -2.167 1.00 . A A . 13 VAL CG1 1 1 14 4985 1 1 14 VAL CG2 C 2.843 0.310 -0.749 1.00 . A A . 13 VAL CG2 1 1 14 4986 1 1 14 VAL H H 1.904 1.056 -4.769 1.00 . A A . 13 VAL H 1 1 14 4987 1 1 14 VAL HA H 3.224 -0.950 -3.080 1.00 . A A . 13 VAL HA 1 1 14 4988 1 1 14 VAL HB H 3.572 1.412 -2.402 1.00 . A A . 13 VAL HB 1 1 14 4989 1 1 14 VAL HG11 H 1.260 2.093 -3.191 1.00 . A A . 13 VAL HG11 1 1 14 4990 1 1 14 VAL HG12 H 1.824 2.793 -1.676 1.00 . A A . 13 VAL HG12 1 1 14 4991 1 1 14 VAL HG13 H 0.671 1.460 -1.656 1.00 . A A . 13 VAL HG13 1 1 14 4992 1 1 14 VAL HG21 H 1.924 -0.169 -0.443 1.00 . A A . 13 VAL HG21 1 1 14 4993 1 1 14 VAL HG22 H 3.084 1.105 -0.058 1.00 . A A . 13 VAL HG22 1 1 14 4994 1 1 14 VAL HG23 H 3.642 -0.415 -0.758 1.00 . A A . 13 VAL HG23 1 1 14 4995 1 1 14 VAL N N 2.475 0.297 -4.534 1.00 . A A . 13 VAL N 1 1 14 4996 1 1 14 VAL O O 0.947 -1.584 -1.865 1.00 . A A . 13 VAL O 1 1 14 4997 1 1 15 ASN C C -1.780 -0.933 -2.332 1.00 . A A . 14 ASN C 1 1 14 4998 1 1 15 ASN CA C -1.156 -1.345 -3.661 1.00 . A A . 14 ASN CA 1 1 14 4999 1 1 15 ASN CB C -1.081 -2.872 -3.755 1.00 . A A . 14 ASN CB 1 1 14 5000 1 1 15 ASN CG C -0.764 -3.361 -5.158 1.00 . A A . 14 ASN CG 1 1 14 5001 1 1 15 ASN H H 0.383 -0.239 -4.609 1.00 . A A . 14 ASN H 1 1 14 5002 1 1 15 ASN HA H -1.771 -0.973 -4.464 1.00 . A A . 14 ASN HA 1 1 14 5003 1 1 15 ASN HB2 H -0.308 -3.229 -3.089 1.00 . A A . 14 ASN HB2 1 1 14 5004 1 1 15 ASN HB3 H -2.030 -3.291 -3.455 1.00 . A A . 14 ASN HB3 1 1 14 5005 1 1 15 ASN HD21 H 0.310 -1.727 -5.524 1.00 . A A . 14 ASN HD21 1 1 14 5006 1 1 15 ASN HD22 H 0.213 -2.868 -6.817 1.00 . A A . 14 ASN HD22 1 1 14 5007 1 1 15 ASN N N 0.172 -0.758 -3.807 1.00 . A A . 14 ASN N 1 1 14 5008 1 1 15 ASN ND2 N -0.004 -2.572 -5.909 1.00 . A A . 14 ASN ND2 1 1 14 5009 1 1 15 ASN O O -2.749 -1.537 -1.872 1.00 . A A . 14 ASN O 1 1 14 5010 1 1 15 ASN OD1 O -1.199 -4.439 -5.562 1.00 . A A . 14 ASN OD1 1 1 14 5011 1 1 16 ARG C C -1.679 -0.476 0.618 1.00 . A A . 15 ARG C 1 1 14 5012 1 1 16 ARG CA C -1.691 0.618 -0.447 1.00 . A A . 15 ARG CA 1 1 14 5013 1 1 16 ARG CB C -3.102 1.194 -0.592 1.00 . A A . 15 ARG CB 1 1 14 5014 1 1 16 ARG CD C -4.602 2.904 -1.662 1.00 . A A . 15 ARG CD 1 1 14 5015 1 1 16 ARG CG C -3.191 2.344 -1.582 1.00 . A A . 15 ARG CG 1 1 14 5016 1 1 16 ARG CZ C -6.187 4.106 -0.213 1.00 . A A . 15 ARG CZ 1 1 14 5017 1 1 16 ARG H H -0.452 0.547 -2.157 1.00 . A A . 15 ARG H 1 1 14 5018 1 1 16 ARG HA H -1.019 1.408 -0.141 1.00 . A A . 15 ARG HA 1 1 14 5019 1 1 16 ARG HB2 H -3.766 0.409 -0.925 1.00 . A A . 15 ARG HB2 1 1 14 5020 1 1 16 ARG HB3 H -3.433 1.550 0.371 1.00 . A A . 15 ARG HB3 1 1 14 5021 1 1 16 ARG HD2 H -4.617 3.703 -2.387 1.00 . A A . 15 ARG HD2 1 1 14 5022 1 1 16 ARG HD3 H -5.270 2.117 -1.980 1.00 . A A . 15 ARG HD3 1 1 14 5023 1 1 16 ARG HE H -4.495 3.250 0.409 1.00 . A A . 15 ARG HE 1 1 14 5024 1 1 16 ARG HG2 H -2.519 3.130 -1.267 1.00 . A A . 15 ARG HG2 1 1 14 5025 1 1 16 ARG HG3 H -2.900 1.989 -2.559 1.00 . A A . 15 ARG HG3 1 1 14 5026 1 1 16 ARG HH11 H -6.714 4.028 -2.163 1.00 . A A . 15 ARG HH11 1 1 14 5027 1 1 16 ARG HH12 H -7.819 4.870 -1.128 1.00 . A A . 15 ARG HH12 1 1 14 5028 1 1 16 ARG HH21 H -7.381 5.057 1.111 1.00 . A A . 15 ARG HH21 1 1 14 5029 1 1 16 ARG HH22 H -5.943 4.357 1.777 1.00 . A A . 15 ARG HH22 1 1 14 5030 1 1 16 ARG N N -1.214 0.108 -1.726 1.00 . A A . 15 ARG N 1 1 14 5031 1 1 16 ARG NE N -5.059 3.421 -0.375 1.00 . A A . 15 ARG NE 1 1 14 5032 1 1 16 ARG NH1 N -6.971 4.355 -1.254 1.00 . A A . 15 ARG NH1 1 1 14 5033 1 1 16 ARG NH2 N -6.532 4.542 0.990 1.00 . A A . 15 ARG NH2 1 1 14 5034 1 1 16 ARG O O -1.182 -1.578 0.383 1.00 . A A . 15 ARG O 1 1 14 5035 1 1 17 HIS C C -0.879 -1.591 3.275 1.00 . A A . 16 HIS C 1 1 14 5036 1 1 17 HIS CA C -2.278 -1.114 2.894 1.00 . A A . 16 HIS CA 1 1 14 5037 1 1 17 HIS CB C -3.156 -2.311 2.525 1.00 . A A . 16 HIS CB 1 1 14 5038 1 1 17 HIS CD2 C -5.616 -1.671 3.040 1.00 . A A . 16 HIS CD2 1 1 14 5039 1 1 17 HIS CE1 C -6.339 -1.490 0.978 1.00 . A A . 16 HIS CE1 1 1 14 5040 1 1 17 HIS CG C -4.574 -1.943 2.219 1.00 . A A . 16 HIS CG 1 1 14 5041 1 1 17 HIS H H -2.601 0.736 1.915 1.00 . A A . 16 HIS H 1 1 14 5042 1 1 17 HIS HA H -2.715 -0.609 3.744 1.00 . A A . 16 HIS HA 1 1 14 5043 1 1 17 HIS HB2 H -2.742 -2.794 1.651 1.00 . A A . 16 HIS HB2 1 1 14 5044 1 1 17 HIS HB3 H -3.165 -3.011 3.347 1.00 . A A . 16 HIS HB3 1 1 14 5045 1 1 17 HIS HD1 H -4.545 -1.957 0.111 1.00 . A A . 16 HIS HD1 1 1 14 5046 1 1 17 HIS HD2 H -5.598 -1.672 4.120 1.00 . A A . 16 HIS HD2 1 1 14 5047 1 1 17 HIS HE1 H -6.980 -1.327 0.124 1.00 . A A . 16 HIS HE1 1 1 14 5048 1 1 17 HIS HE2 H -7.597 -1.162 2.562 1.00 . A A . 16 HIS HE2 1 1 14 5049 1 1 17 HIS N N -2.224 -0.161 1.790 1.00 . A A . 16 HIS N 1 1 14 5050 1 1 17 HIS ND1 N -5.061 -1.821 0.934 1.00 . A A . 16 HIS ND1 1 1 14 5051 1 1 17 HIS NE2 N -6.699 -1.393 2.244 1.00 . A A . 16 HIS NE2 1 1 14 5052 1 1 17 HIS O O 0.121 -1.070 2.780 1.00 . A A . 16 HIS O 1 1 14 5053 1 1 18 SER C C 0.670 -4.539 4.058 1.00 . A A . 17 SER C 1 1 14 5054 1 1 18 SER CA C 0.460 -3.130 4.603 1.00 . A A . 17 SER CA 1 1 14 5055 1 1 18 SER CB C 0.528 -3.145 6.131 1.00 . A A . 17 SER CB 1 1 14 5056 1 1 18 SER H H -1.648 -2.954 4.519 1.00 . A A . 17 SER H 1 1 14 5057 1 1 18 SER HA H 1.244 -2.491 4.224 1.00 . A A . 17 SER HA 1 1 14 5058 1 1 18 SER HB2 H 0.422 -2.137 6.505 1.00 . A A . 17 SER HB2 1 1 14 5059 1 1 18 SER HB3 H -0.272 -3.759 6.519 1.00 . A A . 17 SER HB3 1 1 14 5060 1 1 18 SER HG H 2.121 -3.105 7.271 1.00 . A A . 17 SER HG 1 1 14 5061 1 1 18 SER N N -0.816 -2.583 4.158 1.00 . A A . 17 SER N 1 1 14 5062 1 1 18 SER O O 0.177 -5.513 4.627 1.00 . A A . 17 SER O 1 1 14 5063 1 1 18 SER OG O 1.765 -3.671 6.582 1.00 . A A . 17 SER OG 1 1 14 5064 1 1 19 THR C C 0.412 -6.547 1.720 1.00 . A A . 18 THR C 1 1 14 5065 1 1 19 THR CA C 1.678 -5.919 2.306 1.00 . A A . 18 THR CA 1 1 14 5066 1 1 19 THR CB C 2.325 -6.907 3.298 1.00 . A A . 18 THR CB 1 1 14 5067 1 1 19 THR CG2 C 2.874 -8.128 2.574 1.00 . A A . 18 THR CG2 1 1 14 5068 1 1 19 THR H H 1.744 -3.815 2.534 1.00 . A A . 18 THR H 1 1 14 5069 1 1 19 THR HA H 2.378 -5.741 1.504 1.00 . A A . 18 THR HA 1 1 14 5070 1 1 19 THR HB H 1.574 -7.231 4.003 1.00 . A A . 18 THR HB 1 1 14 5071 1 1 19 THR HG1 H 3.555 -5.399 3.620 1.00 . A A . 18 THR HG1 1 1 14 5072 1 1 19 THR HG21 H 2.063 -8.656 2.094 1.00 . A A . 18 THR HG21 1 1 14 5073 1 1 19 THR HG22 H 3.357 -8.781 3.286 1.00 . A A . 18 THR HG22 1 1 14 5074 1 1 19 THR HG23 H 3.590 -7.814 1.830 1.00 . A A . 18 THR HG23 1 1 14 5075 1 1 19 THR N N 1.392 -4.633 2.941 1.00 . A A . 18 THR N 1 1 14 5076 1 1 19 THR O O 0.482 -7.540 0.993 1.00 . A A . 18 THR O 1 1 14 5077 1 1 19 THR OG1 O 3.386 -6.259 4.010 1.00 . A A . 18 THR OG1 1 1 14 5078 1 1 20 ALA C C -2.255 -7.907 1.975 1.00 . A A . 19 ALA C 1 1 14 5079 1 1 20 ALA CA C -2.020 -6.463 1.539 1.00 . A A . 19 ALA CA 1 1 14 5080 1 1 20 ALA CB C -2.085 -6.351 0.022 1.00 . A A . 19 ALA CB 1 1 14 5081 1 1 20 ALA H H -0.733 -5.168 2.606 1.00 . A A . 19 ALA H 1 1 14 5082 1 1 20 ALA HA H -2.802 -5.844 1.954 1.00 . A A . 19 ALA HA 1 1 14 5083 1 1 20 ALA HB1 H -3.059 -6.667 -0.321 1.00 . A A . 19 ALA HB1 1 1 14 5084 1 1 20 ALA HB2 H -1.326 -6.980 -0.417 1.00 . A A . 19 ALA HB2 1 1 14 5085 1 1 20 ALA HB3 H -1.917 -5.325 -0.269 1.00 . A A . 19 ALA HB3 1 1 14 5086 1 1 20 ALA N N -0.742 -5.961 2.033 1.00 . A A . 19 ALA N 1 1 14 5087 1 1 20 ALA O O -1.420 -8.502 2.657 1.00 . A A . 19 ALA O 1 1 14 5088 1 1 21 ILE C C -3.945 -10.000 3.428 1.00 . A A . 20 ILE C 1 1 14 5089 1 1 21 ILE CA C -3.760 -9.832 1.922 1.00 . A A . 20 ILE CA 1 1 14 5090 1 1 21 ILE CB C -2.699 -10.837 1.426 1.00 . A A . 20 ILE CB 1 1 14 5091 1 1 21 ILE CD1 C -1.357 -11.533 -0.627 1.00 . A A . 20 ILE CD1 1 1 14 5092 1 1 21 ILE CG1 C -2.480 -10.677 -0.080 1.00 . A A . 20 ILE CG1 1 1 14 5093 1 1 21 ILE CG2 C -3.123 -12.262 1.759 1.00 . A A . 20 ILE CG2 1 1 14 5094 1 1 21 ILE H H -4.022 -7.926 1.041 1.00 . A A . 20 ILE H 1 1 14 5095 1 1 21 ILE HA H -4.695 -10.062 1.430 1.00 . A A . 20 ILE HA 1 1 14 5096 1 1 21 ILE HB H -1.773 -10.633 1.943 1.00 . A A . 20 ILE HB 1 1 14 5097 1 1 21 ILE HD11 H -1.585 -12.576 -0.458 1.00 . A A . 20 ILE HD11 1 1 14 5098 1 1 21 ILE HD12 H -0.434 -11.281 -0.126 1.00 . A A . 20 ILE HD12 1 1 14 5099 1 1 21 ILE HD13 H -1.252 -11.356 -1.687 1.00 . A A . 20 ILE HD13 1 1 14 5100 1 1 21 ILE HG12 H -3.387 -10.948 -0.600 1.00 . A A . 20 ILE HG12 1 1 14 5101 1 1 21 ILE HG13 H -2.242 -9.646 -0.294 1.00 . A A . 20 ILE HG13 1 1 14 5102 1 1 21 ILE HG21 H -4.066 -12.477 1.280 1.00 . A A . 20 ILE HG21 1 1 14 5103 1 1 21 ILE HG22 H -3.229 -12.366 2.829 1.00 . A A . 20 ILE HG22 1 1 14 5104 1 1 21 ILE HG23 H -2.372 -12.953 1.403 1.00 . A A . 20 ILE HG23 1 1 14 5105 1 1 21 ILE N N -3.401 -8.458 1.579 1.00 . A A . 20 ILE N 1 1 14 5106 1 1 21 ILE O O -3.088 -9.606 4.219 1.00 . A A . 20 ILE O 1 1 14 5107 1 1 22 GLY C C -6.252 -9.726 5.805 1.00 . A A . 21 GLY C 1 1 14 5108 1 1 22 GLY CA C -5.351 -10.800 5.226 1.00 . A A . 21 GLY CA 1 1 14 5109 1 1 22 GLY H H -5.718 -10.883 3.142 1.00 . A A . 21 GLY H 1 1 14 5110 1 1 22 GLY HA2 H -5.830 -11.760 5.347 1.00 . A A . 21 GLY HA2 1 1 14 5111 1 1 22 GLY HA3 H -4.418 -10.804 5.770 1.00 . A A . 21 GLY HA3 1 1 14 5112 1 1 22 GLY N N -5.072 -10.589 3.817 1.00 . A A . 21 GLY N 1 1 14 5113 1 1 22 GLY O O -6.936 -9.016 5.069 1.00 . A A . 21 GLY O 1 1 14 5114 1 1 23 ARG C C -6.516 -7.209 7.605 1.00 . A A . 22 ARG C 1 1 14 5115 1 1 23 ARG CA C -7.075 -8.615 7.809 1.00 . A A . 22 ARG CA 1 1 14 5116 1 1 23 ARG CB C -7.174 -8.937 9.303 1.00 . A A . 22 ARG CB 1 1 14 5117 1 1 23 ARG CD C -5.996 -9.568 11.432 1.00 . A A . 22 ARG CD 1 1 14 5118 1 1 23 ARG CG C -5.837 -9.265 9.952 1.00 . A A . 22 ARG CG 1 1 14 5119 1 1 23 ARG CZ C -7.264 -11.107 12.875 1.00 . A A . 22 ARG CZ 1 1 14 5120 1 1 23 ARG H H -5.684 -10.204 7.662 1.00 . A A . 22 ARG H 1 1 14 5121 1 1 23 ARG HA H -8.063 -8.659 7.377 1.00 . A A . 22 ARG HA 1 1 14 5122 1 1 23 ARG HB2 H -7.598 -8.086 9.815 1.00 . A A . 22 ARG HB2 1 1 14 5123 1 1 23 ARG HB3 H -7.829 -9.787 9.432 1.00 . A A . 22 ARG HB3 1 1 14 5124 1 1 23 ARG HD2 H -5.023 -9.786 11.848 1.00 . A A . 22 ARG HD2 1 1 14 5125 1 1 23 ARG HD3 H -6.410 -8.699 11.923 1.00 . A A . 22 ARG HD3 1 1 14 5126 1 1 23 ARG HE H -7.197 -11.203 10.882 1.00 . A A . 22 ARG HE 1 1 14 5127 1 1 23 ARG HG2 H -5.412 -10.127 9.460 1.00 . A A . 22 ARG HG2 1 1 14 5128 1 1 23 ARG HG3 H -5.176 -8.419 9.837 1.00 . A A . 22 ARG HG3 1 1 14 5129 1 1 23 ARG HH11 H -7.141 -10.761 14.862 1.00 . A A . 22 ARG HH11 1 1 14 5130 1 1 23 ARG HH12 H -6.243 -9.669 13.862 1.00 . A A . 22 ARG HH12 1 1 14 5131 1 1 23 ARG HH21 H -8.383 -12.645 12.192 1.00 . A A . 22 ARG HH21 1 1 14 5132 1 1 23 ARG HH22 H -8.358 -12.452 13.913 1.00 . A A . 22 ARG HH22 1 1 14 5133 1 1 23 ARG N N -6.252 -9.609 7.129 1.00 . A A . 22 ARG N 1 1 14 5134 1 1 23 ARG NE N -6.878 -10.709 11.666 1.00 . A A . 22 ARG NE 1 1 14 5135 1 1 23 ARG NH1 N -6.848 -10.459 13.955 1.00 . A A . 22 ARG NH1 1 1 14 5136 1 1 23 ARG NH2 N -8.068 -12.153 13.003 1.00 . A A . 22 ARG NH2 1 1 14 5137 1 1 23 ARG O O -5.649 -6.792 8.402 1.00 . A A . 22 ARG O 1 1 14 5138 1 1 23 ARG OXT O -6.951 -6.534 6.649 1.00 . A A . 22 ARG OXT 1 1 15 5139 1 1 1 ACE C C 5.335 3.848 11.716 1.00 . A A . 0 ACE C 1 1 15 5140 1 1 1 ACE CH3 C 5.717 3.184 13.011 1.00 . A A . 0 ACE CH3 1 1 15 5141 1 1 1 ACE H1 H 5.515 3.871 13.827 1.00 . A A . 0 ACE H1 1 1 15 5142 1 1 1 ACE H2 H 6.763 2.945 12.997 1.00 . A A . 0 ACE H2 1 1 15 5143 1 1 1 ACE H3 H 5.138 2.272 13.118 1.00 . A A . 0 ACE H3 1 1 15 5144 1 1 1 ACE O O 6.199 4.238 10.930 1.00 . A A . 0 ACE O 1 1 15 5145 1 1 2 MET C C 3.970 3.839 9.033 1.00 . A A . 1 MET C 1 1 15 5146 1 1 2 MET CA C 3.516 4.605 10.272 1.00 . A A . 1 MET CA 1 1 15 5147 1 1 2 MET CB C 3.979 6.062 10.182 1.00 . A A . 1 MET CB 1 1 15 5148 1 1 2 MET CE C 0.820 8.055 8.317 1.00 . A A . 1 MET CE 1 1 15 5149 1 1 2 MET CG C 3.179 6.896 9.194 1.00 . A A . 1 MET CG 1 1 15 5150 1 1 2 MET H H 3.395 3.647 12.157 1.00 . A A . 1 MET H 1 1 15 5151 1 1 2 MET HA H 2.438 4.582 10.319 1.00 . A A . 1 MET HA 1 1 15 5152 1 1 2 MET HB2 H 3.894 6.517 11.157 1.00 . A A . 1 MET HB2 1 1 15 5153 1 1 2 MET HB3 H 5.017 6.080 9.875 1.00 . A A . 1 MET HB3 1 1 15 5154 1 1 2 MET HE1 H 1.347 8.997 8.300 1.00 . A A . 1 MET HE1 1 1 15 5155 1 1 2 MET HE2 H -0.235 8.234 8.461 1.00 . A A . 1 MET HE2 1 1 15 5156 1 1 2 MET HE3 H 0.972 7.541 7.379 1.00 . A A . 1 MET HE3 1 1 15 5157 1 1 2 MET HG2 H 3.611 7.884 9.145 1.00 . A A . 1 MET HG2 1 1 15 5158 1 1 2 MET HG3 H 3.237 6.430 8.221 1.00 . A A . 1 MET HG3 1 1 15 5159 1 1 2 MET N N 4.030 3.980 11.488 1.00 . A A . 1 MET N 1 1 15 5160 1 1 2 MET O O 5.109 3.982 8.590 1.00 . A A . 1 MET O 1 1 15 5161 1 1 2 MET SD S 1.444 7.047 9.659 1.00 . A A . 1 MET SD 1 1 15 5162 1 1 3 ASN C C 3.046 3.019 6.024 1.00 . A A . 2 ASN C 1 1 15 5163 1 1 3 ASN CA C 3.402 2.250 7.285 1.00 . A A . 2 ASN CA 1 1 15 5164 1 1 3 ASN CB C 2.677 0.900 7.288 1.00 . A A . 2 ASN CB 1 1 15 5165 1 1 3 ASN CG C 3.215 -0.068 6.239 1.00 . A A . 2 ASN CG 1 1 15 5166 1 1 3 ASN H H 2.183 2.947 8.872 1.00 . A A . 2 ASN H 1 1 15 5167 1 1 3 ASN HA H 4.468 2.073 7.291 1.00 . A A . 2 ASN HA 1 1 15 5168 1 1 3 ASN HB2 H 2.789 0.443 8.261 1.00 . A A . 2 ASN HB2 1 1 15 5169 1 1 3 ASN HB3 H 1.628 1.065 7.093 1.00 . A A . 2 ASN HB3 1 1 15 5170 1 1 3 ASN HD21 H 3.851 -0.181 4.349 1.00 . A A . 2 ASN HD21 1 1 15 5171 1 1 3 ASN HD22 H 3.356 1.384 4.875 1.00 . A A . 2 ASN HD22 1 1 15 5172 1 1 3 ASN N N 3.076 3.026 8.475 1.00 . A A . 2 ASN N 1 1 15 5173 1 1 3 ASN ND2 N 3.503 0.431 5.033 1.00 . A A . 2 ASN ND2 1 1 15 5174 1 1 3 ASN O O 1.918 3.484 5.857 1.00 . A A . 2 ASN O 1 1 15 5175 1 1 3 ASN OD1 O 3.356 -1.261 6.505 1.00 . A A . 2 ASN OD1 1 1 15 5176 1 1 4 TRP C C 5.005 3.519 2.956 1.00 . A A . 3 TRP C 1 1 15 5177 1 1 4 TRP CA C 3.845 3.829 3.879 1.00 . A A . 3 TRP CA 1 1 15 5178 1 1 4 TRP CB C 3.713 5.338 4.083 1.00 . A A . 3 TRP CB 1 1 15 5179 1 1 4 TRP CD1 C 4.857 5.957 6.284 1.00 . A A . 3 TRP CD1 1 1 15 5180 1 1 4 TRP CD2 C 5.962 6.611 4.461 1.00 . A A . 3 TRP CD2 1 1 15 5181 1 1 4 TRP CE2 C 6.682 7.030 5.592 1.00 . A A . 3 TRP CE2 1 1 15 5182 1 1 4 TRP CE3 C 6.461 6.902 3.197 1.00 . A A . 3 TRP CE3 1 1 15 5183 1 1 4 TRP CG C 4.793 5.938 4.926 1.00 . A A . 3 TRP CG 1 1 15 5184 1 1 4 TRP CH2 C 8.351 8.003 4.238 1.00 . A A . 3 TRP CH2 1 1 15 5185 1 1 4 TRP CZ2 C 7.879 7.728 5.492 1.00 . A A . 3 TRP CZ2 1 1 15 5186 1 1 4 TRP CZ3 C 7.654 7.594 3.094 1.00 . A A . 3 TRP CZ3 1 1 15 5187 1 1 4 TRP H H 4.900 2.756 5.353 1.00 . A A . 3 TRP H 1 1 15 5188 1 1 4 TRP HA H 2.941 3.462 3.426 1.00 . A A . 3 TRP HA 1 1 15 5189 1 1 4 TRP HB2 H 3.739 5.825 3.119 1.00 . A A . 3 TRP HB2 1 1 15 5190 1 1 4 TRP HB3 H 2.767 5.547 4.559 1.00 . A A . 3 TRP HB3 1 1 15 5191 1 1 4 TRP HD1 H 4.118 5.516 6.926 1.00 . A A . 3 TRP HD1 1 1 15 5192 1 1 4 TRP HE1 H 6.251 6.771 7.627 1.00 . A A . 3 TRP HE1 1 1 15 5193 1 1 4 TRP HE3 H 5.934 6.586 2.308 1.00 . A A . 3 TRP HE3 1 1 15 5194 1 1 4 TRP HH2 H 9.278 8.543 4.113 1.00 . A A . 3 TRP HH2 1 1 15 5195 1 1 4 TRP HZ2 H 8.422 8.050 6.364 1.00 . A A . 3 TRP HZ2 1 1 15 5196 1 1 4 TRP HZ3 H 8.057 7.830 2.120 1.00 . A A . 3 TRP HZ3 1 1 15 5197 1 1 4 TRP N N 4.024 3.142 5.144 1.00 . A A . 3 TRP N 1 1 15 5198 1 1 4 TRP NE1 N 5.986 6.620 6.696 1.00 . A A . 3 TRP NE1 1 1 15 5199 1 1 4 TRP O O 4.806 2.949 1.884 1.00 . A A . 3 TRP O 1 1 15 5200 1 1 5 THR C C 7.142 3.320 1.197 1.00 . A A . 4 THR C 1 1 15 5201 1 1 5 THR CA C 7.438 3.658 2.654 1.00 . A A . 4 THR CA 1 1 15 5202 1 1 5 THR CB C 8.298 2.541 3.276 1.00 . A A . 4 THR CB 1 1 15 5203 1 1 5 THR CG2 C 9.696 2.531 2.675 1.00 . A A . 4 THR CG2 1 1 15 5204 1 1 5 THR H H 6.273 4.276 4.299 1.00 . A A . 4 THR H 1 1 15 5205 1 1 5 THR HA H 7.999 4.580 2.697 1.00 . A A . 4 THR HA 1 1 15 5206 1 1 5 THR HB H 7.828 1.589 3.076 1.00 . A A . 4 THR HB 1 1 15 5207 1 1 5 THR HG1 H 8.440 3.668 4.889 1.00 . A A . 4 THR HG1 1 1 15 5208 1 1 5 THR HG21 H 9.629 2.363 1.610 1.00 . A A . 4 THR HG21 1 1 15 5209 1 1 5 THR HG22 H 10.278 1.742 3.128 1.00 . A A . 4 THR HG22 1 1 15 5210 1 1 5 THR HG23 H 10.174 3.482 2.861 1.00 . A A . 4 THR HG23 1 1 15 5211 1 1 5 THR N N 6.209 3.867 3.411 1.00 . A A . 4 THR N 1 1 15 5212 1 1 5 THR O O 7.567 2.282 0.687 1.00 . A A . 4 THR O 1 1 15 5213 1 1 5 THR OG1 O 8.391 2.729 4.694 1.00 . A A . 4 THR OG1 1 1 15 5214 1 1 6 GLY C C 5.380 5.156 -1.522 1.00 . A A . 5 GLY C 1 1 15 5215 1 1 6 GLY CA C 6.043 3.963 -0.849 1.00 . A A . 5 GLY CA 1 1 15 5216 1 1 6 GLY H H 6.104 5.018 0.984 1.00 . A A . 5 GLY H 1 1 15 5217 1 1 6 GLY HA2 H 6.933 3.701 -1.399 1.00 . A A . 5 GLY HA2 1 1 15 5218 1 1 6 GLY HA3 H 5.357 3.124 -0.876 1.00 . A A . 5 GLY HA3 1 1 15 5219 1 1 6 GLY N N 6.402 4.202 0.532 1.00 . A A . 5 GLY N 1 1 15 5220 1 1 6 GLY O O 5.367 5.250 -2.742 1.00 . A A . 5 GLY O 1 1 15 5221 1 1 7 LEU C C 5.097 8.226 -1.976 1.00 . A A . 6 LEU C 1 1 15 5222 1 1 7 LEU CA C 4.153 7.254 -1.264 1.00 . A A . 6 LEU CA 1 1 15 5223 1 1 7 LEU CB C 3.441 7.984 -0.135 1.00 . A A . 6 LEU CB 1 1 15 5224 1 1 7 LEU CD1 C 5.180 9.422 0.976 1.00 . A A . 6 LEU CD1 1 1 15 5225 1 1 7 LEU CD2 C 3.409 8.320 2.352 1.00 . A A . 6 LEU CD2 1 1 15 5226 1 1 7 LEU CG C 4.288 8.198 1.120 1.00 . A A . 6 LEU CG 1 1 15 5227 1 1 7 LEU H H 4.874 5.944 0.239 1.00 . A A . 6 LEU H 1 1 15 5228 1 1 7 LEU HA H 3.416 6.913 -1.972 1.00 . A A . 6 LEU HA 1 1 15 5229 1 1 7 LEU HB2 H 3.128 8.947 -0.507 1.00 . A A . 6 LEU HB2 1 1 15 5230 1 1 7 LEU HB3 H 2.565 7.415 0.133 1.00 . A A . 6 LEU HB3 1 1 15 5231 1 1 7 LEU HD11 H 5.844 9.287 0.135 1.00 . A A . 6 LEU HD11 1 1 15 5232 1 1 7 LEU HD12 H 5.765 9.548 1.877 1.00 . A A . 6 LEU HD12 1 1 15 5233 1 1 7 LEU HD13 H 4.569 10.298 0.818 1.00 . A A . 6 LEU HD13 1 1 15 5234 1 1 7 LEU HD21 H 2.789 7.440 2.438 1.00 . A A . 6 LEU HD21 1 1 15 5235 1 1 7 LEU HD22 H 2.784 9.196 2.264 1.00 . A A . 6 LEU HD22 1 1 15 5236 1 1 7 LEU HD23 H 4.034 8.407 3.229 1.00 . A A . 6 LEU HD23 1 1 15 5237 1 1 7 LEU HG H 4.926 7.340 1.255 1.00 . A A . 6 LEU HG 1 1 15 5238 1 1 7 LEU N N 4.835 6.071 -0.730 1.00 . A A . 6 LEU N 1 1 15 5239 1 1 7 LEU O O 4.753 9.391 -2.179 1.00 . A A . 6 LEU O 1 1 15 5240 1 1 8 TYR C C 7.887 7.873 -4.235 1.00 . A A . 7 TYR C 1 1 15 5241 1 1 8 TYR CA C 7.243 8.595 -3.049 1.00 . A A . 7 TYR CA 1 1 15 5242 1 1 8 TYR CB C 8.322 9.074 -2.078 1.00 . A A . 7 TYR CB 1 1 15 5243 1 1 8 TYR CD1 C 8.233 7.063 -0.602 1.00 . A A . 7 TYR CD1 1 1 15 5244 1 1 8 TYR CD2 C 10.365 7.756 -1.391 1.00 . A A . 7 TYR CD2 1 1 15 5245 1 1 8 TYR CE1 C 8.804 6.022 0.064 1.00 . A A . 7 TYR CE1 1 1 15 5246 1 1 8 TYR CE2 C 10.958 6.705 -0.716 1.00 . A A . 7 TYR CE2 1 1 15 5247 1 1 8 TYR CG C 8.991 7.948 -1.340 1.00 . A A . 7 TYR CG 1 1 15 5248 1 1 8 TYR CZ C 10.170 5.838 0.013 1.00 . A A . 7 TYR CZ 1 1 15 5249 1 1 8 TYR H H 6.495 6.829 -2.157 1.00 . A A . 7 TYR H 1 1 15 5250 1 1 8 TYR HA H 6.712 9.448 -3.419 1.00 . A A . 7 TYR HA 1 1 15 5251 1 1 8 TYR HB2 H 9.079 9.614 -2.624 1.00 . A A . 7 TYR HB2 1 1 15 5252 1 1 8 TYR HB3 H 7.870 9.725 -1.348 1.00 . A A . 7 TYR HB3 1 1 15 5253 1 1 8 TYR HD1 H 7.164 7.203 -0.553 1.00 . A A . 7 TYR HD1 1 1 15 5254 1 1 8 TYR HD2 H 10.974 8.441 -1.963 1.00 . A A . 7 TYR HD2 1 1 15 5255 1 1 8 TYR HE1 H 8.176 5.358 0.617 1.00 . A A . 7 TYR HE1 1 1 15 5256 1 1 8 TYR HE2 H 12.028 6.567 -0.760 1.00 . A A . 7 TYR HE2 1 1 15 5257 1 1 8 TYR HH H 10.235 3.989 0.534 1.00 . A A . 7 TYR HH 1 1 15 5258 1 1 8 TYR N N 6.271 7.753 -2.359 1.00 . A A . 7 TYR N 1 1 15 5259 1 1 8 TYR O O 8.349 8.515 -5.178 1.00 . A A . 7 TYR O 1 1 15 5260 1 1 8 TYR OH O 10.747 4.785 0.686 1.00 . A A . 7 TYR OH 1 1 15 5261 1 1 9 THR C C 7.731 4.462 -5.497 1.00 . A A . 8 THR C 1 1 15 5262 1 1 9 THR CA C 8.502 5.755 -5.270 1.00 . A A . 8 THR CA 1 1 15 5263 1 1 9 THR CB C 9.974 5.403 -4.985 1.00 . A A . 8 THR CB 1 1 15 5264 1 1 9 THR CG2 C 10.807 6.659 -4.774 1.00 . A A . 8 THR CG2 1 1 15 5265 1 1 9 THR H H 7.534 6.082 -3.411 1.00 . A A . 8 THR H 1 1 15 5266 1 1 9 THR HA H 8.461 6.346 -6.171 1.00 . A A . 8 THR HA 1 1 15 5267 1 1 9 THR HB H 10.371 4.865 -5.833 1.00 . A A . 8 THR HB 1 1 15 5268 1 1 9 THR HG1 H 9.292 3.985 -3.797 1.00 . A A . 8 THR HG1 1 1 15 5269 1 1 9 THR HG21 H 11.824 6.382 -4.541 1.00 . A A . 8 THR HG21 1 1 15 5270 1 1 9 THR HG22 H 10.394 7.233 -3.958 1.00 . A A . 8 THR HG22 1 1 15 5271 1 1 9 THR HG23 H 10.793 7.255 -5.675 1.00 . A A . 8 THR HG23 1 1 15 5272 1 1 9 THR N N 7.915 6.543 -4.188 1.00 . A A . 8 THR N 1 1 15 5273 1 1 9 THR O O 8.157 3.598 -6.264 1.00 . A A . 8 THR O 1 1 15 5274 1 1 9 THR OG1 O 10.055 4.568 -3.824 1.00 . A A . 8 THR OG1 1 1 15 5275 1 1 10 LEU C C 4.283 3.498 -4.717 1.00 . A A . 9 LEU C 1 1 15 5276 1 1 10 LEU CA C 5.751 3.153 -4.943 1.00 . A A . 9 LEU CA 1 1 15 5277 1 1 10 LEU CB C 6.192 2.089 -3.937 1.00 . A A . 9 LEU CB 1 1 15 5278 1 1 10 LEU CD1 C 7.962 0.561 -3.051 1.00 . A A . 9 LEU CD1 1 1 15 5279 1 1 10 LEU CD2 C 7.576 0.712 -5.515 1.00 . A A . 9 LEU CD2 1 1 15 5280 1 1 10 LEU CG C 7.568 1.474 -4.198 1.00 . A A . 9 LEU CG 1 1 15 5281 1 1 10 LEU H H 6.303 5.080 -4.260 1.00 . A A . 9 LEU H 1 1 15 5282 1 1 10 LEU HA H 5.866 2.762 -5.940 1.00 . A A . 9 LEU HA 1 1 15 5283 1 1 10 LEU HB2 H 6.201 2.534 -2.955 1.00 . A A . 9 LEU HB2 1 1 15 5284 1 1 10 LEU HB3 H 5.461 1.294 -3.945 1.00 . A A . 9 LEU HB3 1 1 15 5285 1 1 10 LEU HD11 H 8.933 0.133 -3.249 1.00 . A A . 9 LEU HD11 1 1 15 5286 1 1 10 LEU HD12 H 7.232 -0.229 -2.955 1.00 . A A . 9 LEU HD12 1 1 15 5287 1 1 10 LEU HD13 H 7.999 1.130 -2.136 1.00 . A A . 9 LEU HD13 1 1 15 5288 1 1 10 LEU HD21 H 7.376 1.396 -6.326 1.00 . A A . 9 LEU HD21 1 1 15 5289 1 1 10 LEU HD22 H 6.816 -0.053 -5.492 1.00 . A A . 9 LEU HD22 1 1 15 5290 1 1 10 LEU HD23 H 8.543 0.255 -5.660 1.00 . A A . 9 LEU HD23 1 1 15 5291 1 1 10 LEU HG H 8.302 2.264 -4.264 1.00 . A A . 9 LEU HG 1 1 15 5292 1 1 10 LEU N N 6.591 4.343 -4.832 1.00 . A A . 9 LEU N 1 1 15 5293 1 1 10 LEU O O 3.452 2.612 -4.534 1.00 . A A . 9 LEU O 1 1 15 5294 1 1 11 LEU C C 1.679 4.661 -5.561 1.00 . A A . 10 LEU C 1 1 15 5295 1 1 11 LEU CA C 2.614 5.268 -4.524 1.00 . A A . 10 LEU CA 1 1 15 5296 1 1 11 LEU CB C 2.555 6.796 -4.586 1.00 . A A . 10 LEU CB 1 1 15 5297 1 1 11 LEU CD1 C 3.004 8.848 -5.942 1.00 . A A . 10 LEU CD1 1 1 15 5298 1 1 11 LEU CD2 C 4.916 7.521 -5.040 1.00 . A A . 10 LEU CD2 1 1 15 5299 1 1 11 LEU CG C 3.501 7.456 -5.592 1.00 . A A . 10 LEU CG 1 1 15 5300 1 1 11 LEU H H 4.695 5.436 -4.854 1.00 . A A . 10 LEU H 1 1 15 5301 1 1 11 LEU HA H 2.294 4.948 -3.546 1.00 . A A . 10 LEU HA 1 1 15 5302 1 1 11 LEU HB2 H 1.545 7.083 -4.836 1.00 . A A . 10 LEU HB2 1 1 15 5303 1 1 11 LEU HB3 H 2.786 7.182 -3.605 1.00 . A A . 10 LEU HB3 1 1 15 5304 1 1 11 LEU HD11 H 2.016 8.777 -6.372 1.00 . A A . 10 LEU HD11 1 1 15 5305 1 1 11 LEU HD12 H 3.676 9.302 -6.654 1.00 . A A . 10 LEU HD12 1 1 15 5306 1 1 11 LEU HD13 H 2.964 9.449 -5.046 1.00 . A A . 10 LEU HD13 1 1 15 5307 1 1 11 LEU HD21 H 4.947 7.060 -4.060 1.00 . A A . 10 LEU HD21 1 1 15 5308 1 1 11 LEU HD22 H 5.226 8.552 -4.959 1.00 . A A . 10 LEU HD22 1 1 15 5309 1 1 11 LEU HD23 H 5.587 6.995 -5.703 1.00 . A A . 10 LEU HD23 1 1 15 5310 1 1 11 LEU HG H 3.525 6.871 -6.496 1.00 . A A . 10 LEU HG 1 1 15 5311 1 1 11 LEU N N 3.980 4.789 -4.722 1.00 . A A . 10 LEU N 1 1 15 5312 1 1 11 LEU O O 0.574 4.224 -5.239 1.00 . A A . 10 LEU O 1 1 15 5313 1 1 12 SER C C 1.684 2.585 -8.005 1.00 . A A . 11 SER C 1 1 15 5314 1 1 12 SER CA C 1.343 4.063 -7.889 1.00 . A A . 11 SER CA 1 1 15 5315 1 1 12 SER CB C 1.630 4.779 -9.210 1.00 . A A . 11 SER CB 1 1 15 5316 1 1 12 SER H H 2.999 5.039 -7.009 1.00 . A A . 11 SER H 1 1 15 5317 1 1 12 SER HA H 0.296 4.168 -7.643 1.00 . A A . 11 SER HA 1 1 15 5318 1 1 12 SER HB2 H 2.680 4.685 -9.447 1.00 . A A . 11 SER HB2 1 1 15 5319 1 1 12 SER HB3 H 1.042 4.331 -9.997 1.00 . A A . 11 SER HB3 1 1 15 5320 1 1 12 SER HG H 1.291 6.427 -8.206 1.00 . A A . 11 SER HG 1 1 15 5321 1 1 12 SER N N 2.124 4.648 -6.809 1.00 . A A . 11 SER N 1 1 15 5322 1 1 12 SER O O 1.359 1.928 -8.993 1.00 . A A . 11 SER O 1 1 15 5323 1 1 12 SER OG O 1.305 6.156 -9.127 1.00 . A A . 11 SER OG 1 1 15 5324 1 1 13 ARG C C 2.463 0.074 -5.550 1.00 . A A . 12 ARG C 1 1 15 5325 1 1 13 ARG CA C 2.765 0.686 -6.915 1.00 . A A . 12 ARG CA 1 1 15 5326 1 1 13 ARG CB C 4.267 0.595 -7.198 1.00 . A A . 12 ARG CB 1 1 15 5327 1 1 13 ARG CD C 6.179 1.317 -8.657 1.00 . A A . 12 ARG CD 1 1 15 5328 1 1 13 ARG CG C 4.670 1.161 -8.549 1.00 . A A . 12 ARG CG 1 1 15 5329 1 1 13 ARG CZ C 7.839 2.150 -10.271 1.00 . A A . 12 ARG CZ 1 1 15 5330 1 1 13 ARG H H 2.554 2.664 -6.211 1.00 . A A . 12 ARG H 1 1 15 5331 1 1 13 ARG HA H 2.226 0.143 -7.672 1.00 . A A . 12 ARG HA 1 1 15 5332 1 1 13 ARG HB2 H 4.796 1.145 -6.431 1.00 . A A . 12 ARG HB2 1 1 15 5333 1 1 13 ARG HB3 H 4.567 -0.441 -7.159 1.00 . A A . 12 ARG HB3 1 1 15 5334 1 1 13 ARG HD2 H 6.517 1.981 -7.873 1.00 . A A . 12 ARG HD2 1 1 15 5335 1 1 13 ARG HD3 H 6.639 0.349 -8.530 1.00 . A A . 12 ARG HD3 1 1 15 5336 1 1 13 ARG HE H 5.877 2.033 -10.610 1.00 . A A . 12 ARG HE 1 1 15 5337 1 1 13 ARG HG2 H 4.331 0.491 -9.325 1.00 . A A . 12 ARG HG2 1 1 15 5338 1 1 13 ARG HG3 H 4.207 2.129 -8.676 1.00 . A A . 12 ARG HG3 1 1 15 5339 1 1 13 ARG HH11 H 8.606 1.564 -8.495 1.00 . A A . 12 ARG HH11 1 1 15 5340 1 1 13 ARG HH12 H 9.761 2.152 -9.644 1.00 . A A . 12 ARG HH12 1 1 15 5341 1 1 13 ARG HH21 H 9.070 2.860 -11.708 1.00 . A A . 12 ARG HH21 1 1 15 5342 1 1 13 ARG HH22 H 7.390 2.809 -12.128 1.00 . A A . 12 ARG HH22 1 1 15 5343 1 1 13 ARG N N 2.344 2.078 -6.968 1.00 . A A . 12 ARG N 1 1 15 5344 1 1 13 ARG NE N 6.581 1.866 -9.949 1.00 . A A . 12 ARG NE 1 1 15 5345 1 1 13 ARG NH1 N 8.815 1.938 -9.399 1.00 . A A . 12 ARG NH1 1 1 15 5346 1 1 13 ARG NH2 N 8.123 2.647 -11.468 1.00 . A A . 12 ARG NH2 1 1 15 5347 1 1 13 ARG O O 2.935 -1.018 -5.231 1.00 . A A . 12 ARG O 1 1 15 5348 1 1 14 VAL C C -0.163 -0.025 -3.320 1.00 . A A . 13 VAL C 1 1 15 5349 1 1 14 VAL CA C 1.318 0.316 -3.419 1.00 . A A . 13 VAL CA 1 1 15 5350 1 1 14 VAL CB C 1.678 1.361 -2.344 1.00 . A A . 13 VAL CB 1 1 15 5351 1 1 14 VAL CG1 C 1.115 2.719 -2.712 1.00 . A A . 13 VAL CG1 1 1 15 5352 1 1 14 VAL CG2 C 1.194 0.927 -0.971 1.00 . A A . 13 VAL CG2 1 1 15 5353 1 1 14 VAL H H 1.318 1.633 -5.063 1.00 . A A . 13 VAL H 1 1 15 5354 1 1 14 VAL HA H 1.891 -0.574 -3.221 1.00 . A A . 13 VAL HA 1 1 15 5355 1 1 14 VAL HB H 2.749 1.442 -2.305 1.00 . A A . 13 VAL HB 1 1 15 5356 1 1 14 VAL HG11 H 1.463 3.458 -2.008 1.00 . A A . 13 VAL HG11 1 1 15 5357 1 1 14 VAL HG12 H 0.036 2.678 -2.689 1.00 . A A . 13 VAL HG12 1 1 15 5358 1 1 14 VAL HG13 H 1.443 2.983 -3.704 1.00 . A A . 13 VAL HG13 1 1 15 5359 1 1 14 VAL HG21 H 0.117 0.862 -0.973 1.00 . A A . 13 VAL HG21 1 1 15 5360 1 1 14 VAL HG22 H 1.510 1.654 -0.234 1.00 . A A . 13 VAL HG22 1 1 15 5361 1 1 14 VAL HG23 H 1.615 -0.036 -0.729 1.00 . A A . 13 VAL HG23 1 1 15 5362 1 1 14 VAL N N 1.673 0.781 -4.749 1.00 . A A . 13 VAL N 1 1 15 5363 1 1 14 VAL O O -0.996 0.821 -2.995 1.00 . A A . 13 VAL O 1 1 15 5364 1 1 15 ASN C C -2.276 -1.855 -2.076 1.00 . A A . 14 ASN C 1 1 15 5365 1 1 15 ASN CA C -1.859 -1.744 -3.538 1.00 . A A . 14 ASN CA 1 1 15 5366 1 1 15 ASN CB C -1.994 -3.098 -4.235 1.00 . A A . 14 ASN CB 1 1 15 5367 1 1 15 ASN CG C -1.655 -3.017 -5.709 1.00 . A A . 14 ASN CG 1 1 15 5368 1 1 15 ASN H H 0.218 -1.887 -3.917 1.00 . A A . 14 ASN H 1 1 15 5369 1 1 15 ASN HA H -2.493 -1.023 -4.033 1.00 . A A . 14 ASN HA 1 1 15 5370 1 1 15 ASN HB2 H -1.327 -3.806 -3.768 1.00 . A A . 14 ASN HB2 1 1 15 5371 1 1 15 ASN HB3 H -3.012 -3.448 -4.137 1.00 . A A . 14 ASN HB3 1 1 15 5372 1 1 15 ASN HD21 H -0.113 -2.915 -6.961 1.00 . A A . 14 ASN HD21 1 1 15 5373 1 1 15 ASN HD22 H 0.287 -2.981 -5.282 1.00 . A A . 14 ASN HD22 1 1 15 5374 1 1 15 ASN N N -0.485 -1.273 -3.621 1.00 . A A . 14 ASN N 1 1 15 5375 1 1 15 ASN ND2 N -0.363 -2.966 -6.015 1.00 . A A . 14 ASN ND2 1 1 15 5376 1 1 15 ASN O O -3.360 -2.346 -1.758 1.00 . A A . 14 ASN O 1 1 15 5377 1 1 15 ASN OD1 O -2.542 -2.984 -6.562 1.00 . A A . 14 ASN OD1 1 1 15 5378 1 1 16 ARG C C -1.745 -2.847 0.754 1.00 . A A . 15 ARG C 1 1 15 5379 1 1 16 ARG CA C -1.627 -1.415 0.242 1.00 . A A . 15 ARG CA 1 1 15 5380 1 1 16 ARG CB C -2.890 -0.627 0.596 1.00 . A A . 15 ARG CB 1 1 15 5381 1 1 16 ARG CD C -4.088 1.582 0.605 1.00 . A A . 15 ARG CD 1 1 15 5382 1 1 16 ARG CG C -2.827 0.839 0.197 1.00 . A A . 15 ARG CG 1 1 15 5383 1 1 16 ARG CZ C -6.524 1.347 0.338 1.00 . A A . 15 ARG CZ 1 1 15 5384 1 1 16 ARG H H -0.546 -1.024 -1.525 1.00 . A A . 15 ARG H 1 1 15 5385 1 1 16 ARG HA H -0.775 -0.943 0.715 1.00 . A A . 15 ARG HA 1 1 15 5386 1 1 16 ARG HB2 H -3.734 -1.077 0.094 1.00 . A A . 15 ARG HB2 1 1 15 5387 1 1 16 ARG HB3 H -3.048 -0.680 1.663 1.00 . A A . 15 ARG HB3 1 1 15 5388 1 1 16 ARG HD2 H -4.186 1.537 1.680 1.00 . A A . 15 ARG HD2 1 1 15 5389 1 1 16 ARG HD3 H -4.000 2.613 0.296 1.00 . A A . 15 ARG HD3 1 1 15 5390 1 1 16 ARG HE H -5.157 0.329 -0.702 1.00 . A A . 15 ARG HE 1 1 15 5391 1 1 16 ARG HG2 H -1.978 1.297 0.683 1.00 . A A . 15 ARG HG2 1 1 15 5392 1 1 16 ARG HG3 H -2.711 0.906 -0.875 1.00 . A A . 15 ARG HG3 1 1 15 5393 1 1 16 ARG HH11 H -7.662 2.514 1.533 1.00 . A A . 15 ARG HH11 1 1 15 5394 1 1 16 ARG HH12 H -5.951 2.691 1.735 1.00 . A A . 15 ARG HH12 1 1 15 5395 1 1 16 ARG HH21 H -7.409 0.089 -0.973 1.00 . A A . 15 ARG HH21 1 1 15 5396 1 1 16 ARG HH22 H -8.491 1.036 -0.006 1.00 . A A . 15 ARG HH22 1 1 15 5397 1 1 16 ARG N N -1.391 -1.391 -1.194 1.00 . A A . 15 ARG N 1 1 15 5398 1 1 16 ARG NE N -5.284 1.006 -0.004 1.00 . A A . 15 ARG NE 1 1 15 5399 1 1 16 ARG NH1 N -6.729 2.259 1.278 1.00 . A A . 15 ARG NH1 1 1 15 5400 1 1 16 ARG NH2 N -7.559 0.777 -0.264 1.00 . A A . 15 ARG NH2 1 1 15 5401 1 1 16 ARG O O -1.580 -3.803 -0.004 1.00 . A A . 15 ARG O 1 1 15 5402 1 1 17 HIS C C -3.635 -4.714 2.734 1.00 . A A . 16 HIS C 1 1 15 5403 1 1 17 HIS CA C -2.169 -4.300 2.660 1.00 . A A . 16 HIS CA 1 1 15 5404 1 1 17 HIS CB C -1.556 -4.297 4.062 1.00 . A A . 16 HIS CB 1 1 15 5405 1 1 17 HIS CD2 C 0.995 -4.750 3.931 1.00 . A A . 16 HIS CD2 1 1 15 5406 1 1 17 HIS CE1 C 1.700 -2.694 4.220 1.00 . A A . 16 HIS CE1 1 1 15 5407 1 1 17 HIS CG C -0.098 -3.961 4.075 1.00 . A A . 16 HIS CG 1 1 15 5408 1 1 17 HIS H H -2.149 -2.186 2.597 1.00 . A A . 16 HIS H 1 1 15 5409 1 1 17 HIS HA H -1.637 -5.012 2.046 1.00 . A A . 16 HIS HA 1 1 15 5410 1 1 17 HIS HB2 H -2.071 -3.569 4.671 1.00 . A A . 16 HIS HB2 1 1 15 5411 1 1 17 HIS HB3 H -1.676 -5.277 4.502 1.00 . A A . 16 HIS HB3 1 1 15 5412 1 1 17 HIS HD1 H -0.170 -1.878 4.387 1.00 . A A . 16 HIS HD1 1 1 15 5413 1 1 17 HIS HD2 H 0.998 -5.819 3.772 1.00 . A A . 16 HIS HD2 1 1 15 5414 1 1 17 HIS HE1 H 2.344 -1.834 4.333 1.00 . A A . 16 HIS HE1 1 1 15 5415 1 1 17 HIS HE2 H 3.030 -4.230 3.961 1.00 . A A . 16 HIS HE2 1 1 15 5416 1 1 17 HIS N N -2.030 -2.986 2.045 1.00 . A A . 16 HIS N 1 1 15 5417 1 1 17 HIS ND1 N 0.379 -2.680 4.256 1.00 . A A . 16 HIS ND1 1 1 15 5418 1 1 17 HIS NE2 N 2.098 -3.937 4.025 1.00 . A A . 16 HIS NE2 1 1 15 5419 1 1 17 HIS O O -4.521 -3.872 2.883 1.00 . A A . 16 HIS O 1 1 15 5420 1 1 18 SER C C -5.839 -6.362 4.075 1.00 . A A . 17 SER C 1 1 15 5421 1 1 18 SER CA C -5.242 -6.542 2.683 1.00 . A A . 17 SER CA 1 1 15 5422 1 1 18 SER CB C -5.254 -8.023 2.297 1.00 . A A . 17 SER CB 1 1 15 5423 1 1 18 SER H H -3.134 -6.637 2.510 1.00 . A A . 17 SER H 1 1 15 5424 1 1 18 SER HA H -5.841 -5.990 1.974 1.00 . A A . 17 SER HA 1 1 15 5425 1 1 18 SER HB2 H -4.634 -8.576 2.987 1.00 . A A . 17 SER HB2 1 1 15 5426 1 1 18 SER HB3 H -6.267 -8.396 2.343 1.00 . A A . 17 SER HB3 1 1 15 5427 1 1 18 SER HG H -5.356 -8.779 0.494 1.00 . A A . 17 SER HG 1 1 15 5428 1 1 18 SER N N -3.883 -6.016 2.628 1.00 . A A . 17 SER N 1 1 15 5429 1 1 18 SER O O -5.129 -6.047 5.030 1.00 . A A . 17 SER O 1 1 15 5430 1 1 18 SER OG O -4.757 -8.212 0.984 1.00 . A A . 17 SER OG 1 1 15 5431 1 1 19 THR C C -7.616 -7.647 6.343 1.00 . A A . 18 THR C 1 1 15 5432 1 1 19 THR CA C -7.841 -6.427 5.458 1.00 . A A . 18 THR CA 1 1 15 5433 1 1 19 THR CB C -9.354 -6.222 5.256 1.00 . A A . 18 THR CB 1 1 15 5434 1 1 19 THR CG2 C -9.954 -7.367 4.454 1.00 . A A . 18 THR CG2 1 1 15 5435 1 1 19 THR H H -7.660 -6.816 3.385 1.00 . A A . 18 THR H 1 1 15 5436 1 1 19 THR HA H -7.445 -5.554 5.958 1.00 . A A . 18 THR HA 1 1 15 5437 1 1 19 THR HB H -9.509 -5.302 4.712 1.00 . A A . 18 THR HB 1 1 15 5438 1 1 19 THR HG1 H -9.860 -6.936 7.025 1.00 . A A . 18 THR HG1 1 1 15 5439 1 1 19 THR HG21 H -11.013 -7.199 4.323 1.00 . A A . 18 THR HG21 1 1 15 5440 1 1 19 THR HG22 H -9.800 -8.297 4.981 1.00 . A A . 18 THR HG22 1 1 15 5441 1 1 19 THR HG23 H -9.475 -7.419 3.487 1.00 . A A . 18 THR HG23 1 1 15 5442 1 1 19 THR N N -7.148 -6.566 4.183 1.00 . A A . 18 THR N 1 1 15 5443 1 1 19 THR O O -7.463 -8.765 5.849 1.00 . A A . 18 THR O 1 1 15 5444 1 1 19 THR OG1 O -10.011 -6.130 6.526 1.00 . A A . 18 THR OG1 1 1 15 5445 1 1 20 ALA C C -8.717 -9.143 9.014 1.00 . A A . 19 ALA C 1 1 15 5446 1 1 20 ALA CA C -7.391 -8.508 8.609 1.00 . A A . 19 ALA CA 1 1 15 5447 1 1 20 ALA CB C -6.654 -7.994 9.837 1.00 . A A . 19 ALA CB 1 1 15 5448 1 1 20 ALA H H -7.725 -6.513 7.986 1.00 . A A . 19 ALA H 1 1 15 5449 1 1 20 ALA HA H -6.774 -9.258 8.136 1.00 . A A . 19 ALA HA 1 1 15 5450 1 1 20 ALA HB1 H -6.461 -8.815 10.511 1.00 . A A . 19 ALA HB1 1 1 15 5451 1 1 20 ALA HB2 H -7.260 -7.253 10.336 1.00 . A A . 19 ALA HB2 1 1 15 5452 1 1 20 ALA HB3 H -5.718 -7.548 9.534 1.00 . A A . 19 ALA HB3 1 1 15 5453 1 1 20 ALA N N -7.596 -7.427 7.653 1.00 . A A . 19 ALA N 1 1 15 5454 1 1 20 ALA O O -9.723 -8.451 9.177 1.00 . A A . 19 ALA O 1 1 15 5455 1 1 21 ILE C C -10.019 -11.308 11.076 1.00 . A A . 20 ILE C 1 1 15 5456 1 1 21 ILE CA C -9.913 -11.191 9.558 1.00 . A A . 20 ILE CA 1 1 15 5457 1 1 21 ILE CB C -9.938 -12.603 8.937 1.00 . A A . 20 ILE CB 1 1 15 5458 1 1 21 ILE CD1 C -11.395 -14.674 8.638 1.00 . A A . 20 ILE CD1 1 1 15 5459 1 1 21 ILE CG1 C -11.226 -13.335 9.326 1.00 . A A . 20 ILE CG1 1 1 15 5460 1 1 21 ILE CG2 C -8.714 -13.395 9.372 1.00 . A A . 20 ILE CG2 1 1 15 5461 1 1 21 ILE H H -7.878 -10.957 9.028 1.00 . A A . 20 ILE H 1 1 15 5462 1 1 21 ILE HA H -10.768 -10.643 9.189 1.00 . A A . 20 ILE HA 1 1 15 5463 1 1 21 ILE HB H -9.903 -12.497 7.863 1.00 . A A . 20 ILE HB 1 1 15 5464 1 1 21 ILE HD11 H -11.405 -14.529 7.568 1.00 . A A . 20 ILE HD11 1 1 15 5465 1 1 21 ILE HD12 H -12.327 -15.122 8.949 1.00 . A A . 20 ILE HD12 1 1 15 5466 1 1 21 ILE HD13 H -10.576 -15.323 8.907 1.00 . A A . 20 ILE HD13 1 1 15 5467 1 1 21 ILE HG12 H -11.224 -13.509 10.392 1.00 . A A . 20 ILE HG12 1 1 15 5468 1 1 21 ILE HG13 H -12.074 -12.719 9.066 1.00 . A A . 20 ILE HG13 1 1 15 5469 1 1 21 ILE HG21 H -7.819 -12.881 9.052 1.00 . A A . 20 ILE HG21 1 1 15 5470 1 1 21 ILE HG22 H -8.743 -14.378 8.925 1.00 . A A . 20 ILE HG22 1 1 15 5471 1 1 21 ILE HG23 H -8.709 -13.489 10.448 1.00 . A A . 20 ILE HG23 1 1 15 5472 1 1 21 ILE N N -8.711 -10.462 9.173 1.00 . A A . 20 ILE N 1 1 15 5473 1 1 21 ILE O O -9.021 -11.516 11.765 1.00 . A A . 20 ILE O 1 1 15 5474 1 1 22 GLY C C -11.368 -12.689 13.533 1.00 . A A . 21 GLY C 1 1 15 5475 1 1 22 GLY CA C -11.454 -11.264 13.024 1.00 . A A . 21 GLY CA 1 1 15 5476 1 1 22 GLY H H -11.996 -11.004 10.994 1.00 . A A . 21 GLY H 1 1 15 5477 1 1 22 GLY HA2 H -10.709 -10.667 13.528 1.00 . A A . 21 GLY HA2 1 1 15 5478 1 1 22 GLY HA3 H -12.432 -10.869 13.255 1.00 . A A . 21 GLY HA3 1 1 15 5479 1 1 22 GLY N N -11.238 -11.171 11.592 1.00 . A A . 21 GLY N 1 1 15 5480 1 1 22 GLY O O -12.288 -13.482 13.336 1.00 . A A . 21 GLY O 1 1 15 5481 1 1 23 ARG C C -10.133 -14.349 16.252 1.00 . A A . 22 ARG C 1 1 15 5482 1 1 23 ARG CA C -10.053 -14.354 14.727 1.00 . A A . 22 ARG CA 1 1 15 5483 1 1 23 ARG CB C -8.703 -14.912 14.267 1.00 . A A . 22 ARG CB 1 1 15 5484 1 1 23 ARG CD C -6.239 -14.536 13.943 1.00 . A A . 22 ARG CD 1 1 15 5485 1 1 23 ARG CG C -7.550 -13.930 14.416 1.00 . A A . 22 ARG CG 1 1 15 5486 1 1 23 ARG CZ C -3.865 -13.907 13.778 1.00 . A A . 22 ARG CZ 1 1 15 5487 1 1 23 ARG H H -9.560 -12.338 14.312 1.00 . A A . 22 ARG H 1 1 15 5488 1 1 23 ARG HA H -10.839 -14.986 14.343 1.00 . A A . 22 ARG HA 1 1 15 5489 1 1 23 ARG HB2 H -8.473 -15.792 14.850 1.00 . A A . 22 ARG HB2 1 1 15 5490 1 1 23 ARG HB3 H -8.777 -15.189 13.226 1.00 . A A . 22 ARG HB3 1 1 15 5491 1 1 23 ARG HD2 H -6.032 -15.418 14.531 1.00 . A A . 22 ARG HD2 1 1 15 5492 1 1 23 ARG HD3 H -6.338 -14.812 12.904 1.00 . A A . 22 ARG HD3 1 1 15 5493 1 1 23 ARG HE H -5.322 -12.703 14.415 1.00 . A A . 22 ARG HE 1 1 15 5494 1 1 23 ARG HG2 H -7.762 -13.050 13.827 1.00 . A A . 22 ARG HG2 1 1 15 5495 1 1 23 ARG HG3 H -7.455 -13.656 15.457 1.00 . A A . 22 ARG HG3 1 1 15 5496 1 1 23 ARG HH11 H -2.615 -15.342 13.097 1.00 . A A . 22 ARG HH11 1 1 15 5497 1 1 23 ARG HH12 H -4.282 -15.801 13.207 1.00 . A A . 22 ARG HH12 1 1 15 5498 1 1 23 ARG HH21 H -1.962 -13.234 13.703 1.00 . A A . 22 ARG HH21 1 1 15 5499 1 1 23 ARG HH22 H -3.132 -12.090 14.273 1.00 . A A . 22 ARG HH22 1 1 15 5500 1 1 23 ARG N N -10.257 -13.014 14.188 1.00 . A A . 22 ARG N 1 1 15 5501 1 1 23 ARG NE N -5.123 -13.603 14.080 1.00 . A A . 22 ARG NE 1 1 15 5502 1 1 23 ARG NH1 N -3.562 -15.116 13.323 1.00 . A A . 22 ARG NH1 1 1 15 5503 1 1 23 ARG NH2 N -2.908 -13.003 13.931 1.00 . A A . 22 ARG NH2 1 1 15 5504 1 1 23 ARG O O -9.092 -14.120 16.902 1.00 . A A . 22 ARG O 1 1 15 5505 1 1 23 ARG OXT O -11.241 -14.574 16.784 1.00 . A A . 22 ARG OXT 1 1 16 5506 1 1 1 ACE C C 2.911 2.073 10.840 1.00 . A A . 0 ACE C 1 1 16 5507 1 1 1 ACE CH3 C 2.586 1.477 12.182 1.00 . A A . 0 ACE CH3 1 1 16 5508 1 1 1 ACE H1 H 2.801 0.414 12.152 1.00 . A A . 0 ACE H1 1 1 16 5509 1 1 1 ACE H2 H 1.544 1.625 12.395 1.00 . A A . 0 ACE H2 1 1 16 5510 1 1 1 ACE H3 H 3.183 1.976 12.938 1.00 . A A . 0 ACE H3 1 1 16 5511 1 1 1 ACE O O 2.050 2.171 9.966 1.00 . A A . 0 ACE O 1 1 16 5512 1 1 2 MET C C 4.866 1.996 8.358 1.00 . A A . 1 MET C 1 1 16 5513 1 1 2 MET CA C 4.613 3.070 9.412 1.00 . A A . 1 MET CA 1 1 16 5514 1 1 2 MET CB C 5.886 3.890 9.635 1.00 . A A . 1 MET CB 1 1 16 5515 1 1 2 MET CE C 6.619 7.327 11.888 1.00 . A A . 1 MET CE 1 1 16 5516 1 1 2 MET CG C 5.681 5.102 10.528 1.00 . A A . 1 MET CG 1 1 16 5517 1 1 2 MET H H 4.807 2.370 11.401 1.00 . A A . 1 MET H 1 1 16 5518 1 1 2 MET HA H 3.831 3.725 9.060 1.00 . A A . 1 MET HA 1 1 16 5519 1 1 2 MET HB2 H 6.633 3.257 10.088 1.00 . A A . 1 MET HB2 1 1 16 5520 1 1 2 MET HB3 H 6.250 4.233 8.678 1.00 . A A . 1 MET HB3 1 1 16 5521 1 1 2 MET HE1 H 7.443 7.970 12.156 1.00 . A A . 1 MET HE1 1 1 16 5522 1 1 2 MET HE2 H 6.183 6.908 12.783 1.00 . A A . 1 MET HE2 1 1 16 5523 1 1 2 MET HE3 H 5.872 7.899 11.357 1.00 . A A . 1 MET HE3 1 1 16 5524 1 1 2 MET HG2 H 4.980 5.770 10.052 1.00 . A A . 1 MET HG2 1 1 16 5525 1 1 2 MET HG3 H 5.277 4.771 11.474 1.00 . A A . 1 MET HG3 1 1 16 5526 1 1 2 MET N N 4.167 2.476 10.667 1.00 . A A . 1 MET N 1 1 16 5527 1 1 2 MET O O 5.882 1.301 8.398 1.00 . A A . 1 MET O 1 1 16 5528 1 1 2 MET SD S 7.213 6.001 10.838 1.00 . A A . 1 MET SD 1 1 16 5529 1 1 3 ASN C C 4.178 1.555 4.996 1.00 . A A . 2 ASN C 1 1 16 5530 1 1 3 ASN CA C 4.058 0.879 6.352 1.00 . A A . 2 ASN CA 1 1 16 5531 1 1 3 ASN CB C 2.847 -0.057 6.334 1.00 . A A . 2 ASN CB 1 1 16 5532 1 1 3 ASN CG C 2.899 -1.043 5.176 1.00 . A A . 2 ASN CG 1 1 16 5533 1 1 3 ASN H H 3.144 2.445 7.445 1.00 . A A . 2 ASN H 1 1 16 5534 1 1 3 ASN HA H 4.950 0.299 6.535 1.00 . A A . 2 ASN HA 1 1 16 5535 1 1 3 ASN HB2 H 2.817 -0.615 7.257 1.00 . A A . 2 ASN HB2 1 1 16 5536 1 1 3 ASN HB3 H 1.946 0.531 6.241 1.00 . A A . 2 ASN HB3 1 1 16 5537 1 1 3 ASN HD21 H 2.405 0.395 3.883 1.00 . A A . 2 ASN HD21 1 1 16 5538 1 1 3 ASN HD22 H 2.654 -1.174 3.202 1.00 . A A . 2 ASN HD22 1 1 16 5539 1 1 3 ASN N N 3.934 1.865 7.419 1.00 . A A . 2 ASN N 1 1 16 5540 1 1 3 ASN ND2 N 2.623 -0.559 3.965 1.00 . A A . 2 ASN ND2 1 1 16 5541 1 1 3 ASN O O 4.628 0.938 4.030 1.00 . A A . 2 ASN O 1 1 16 5542 1 1 3 ASN OD1 O 3.201 -2.220 5.366 1.00 . A A . 2 ASN OD1 1 1 16 5543 1 1 4 TRP C C 5.004 3.159 2.830 1.00 . A A . 3 TRP C 1 1 16 5544 1 1 4 TRP CA C 3.821 3.572 3.684 1.00 . A A . 3 TRP CA 1 1 16 5545 1 1 4 TRP CB C 3.827 5.080 3.950 1.00 . A A . 3 TRP CB 1 1 16 5546 1 1 4 TRP CD1 C 4.894 5.491 6.243 1.00 . A A . 3 TRP CD1 1 1 16 5547 1 1 4 TRP CD2 C 6.122 6.171 4.515 1.00 . A A . 3 TRP CD2 1 1 16 5548 1 1 4 TRP CE2 C 6.817 6.479 5.695 1.00 . A A . 3 TRP CE2 1 1 16 5549 1 1 4 TRP CE3 C 6.690 6.493 3.293 1.00 . A A . 3 TRP CE3 1 1 16 5550 1 1 4 TRP CG C 4.896 5.552 4.885 1.00 . A A . 3 TRP CG 1 1 16 5551 1 1 4 TRP CH2 C 8.598 7.412 4.461 1.00 . A A . 3 TRP CH2 1 1 16 5552 1 1 4 TRP CZ2 C 8.060 7.103 5.680 1.00 . A A . 3 TRP CZ2 1 1 16 5553 1 1 4 TRP CZ3 C 7.925 7.109 3.271 1.00 . A A . 3 TRP CZ3 1 1 16 5554 1 1 4 TRP H H 3.477 3.277 5.742 1.00 . A A . 3 TRP H 1 1 16 5555 1 1 4 TRP HA H 2.925 3.335 3.137 1.00 . A A . 3 TRP HA 1 1 16 5556 1 1 4 TRP HB2 H 3.962 5.596 3.010 1.00 . A A . 3 TRP HB2 1 1 16 5557 1 1 4 TRP HB3 H 2.873 5.363 4.371 1.00 . A A . 3 TRP HB3 1 1 16 5558 1 1 4 TRP HD1 H 4.099 5.064 6.824 1.00 . A A . 3 TRP HD1 1 1 16 5559 1 1 4 TRP HE1 H 6.273 6.137 7.692 1.00 . A A . 3 TRP HE1 1 1 16 5560 1 1 4 TRP HE3 H 6.177 6.254 2.374 1.00 . A A . 3 TRP HE3 1 1 16 5561 1 1 4 TRP HH2 H 9.562 7.895 4.400 1.00 . A A . 3 TRP HH2 1 1 16 5562 1 1 4 TRP HZ2 H 8.587 7.344 6.587 1.00 . A A . 3 TRP HZ2 1 1 16 5563 1 1 4 TRP HZ3 H 8.381 7.367 2.328 1.00 . A A . 3 TRP HZ3 1 1 16 5564 1 1 4 TRP N N 3.783 2.827 4.930 1.00 . A A . 3 TRP N 1 1 16 5565 1 1 4 TRP NE1 N 6.044 6.056 6.743 1.00 . A A . 3 TRP NE1 1 1 16 5566 1 1 4 TRP O O 4.826 2.457 1.835 1.00 . A A . 3 TRP O 1 1 16 5567 1 1 5 THR C C 7.142 3.027 1.040 1.00 . A A . 4 THR C 1 1 16 5568 1 1 5 THR CA C 7.429 3.248 2.525 1.00 . A A . 4 THR CA 1 1 16 5569 1 1 5 THR CB C 8.135 2.009 3.108 1.00 . A A . 4 THR CB 1 1 16 5570 1 1 5 THR CG2 C 9.574 1.920 2.618 1.00 . A A . 4 THR CG2 1 1 16 5571 1 1 5 THR H H 6.270 4.039 4.095 1.00 . A A . 4 THR H 1 1 16 5572 1 1 5 THR HA H 8.083 4.098 2.638 1.00 . A A . 4 THR HA 1 1 16 5573 1 1 5 THR HB H 7.604 1.124 2.788 1.00 . A A . 4 THR HB 1 1 16 5574 1 1 5 THR HG1 H 8.152 2.994 4.817 1.00 . A A . 4 THR HG1 1 1 16 5575 1 1 5 THR HG21 H 10.111 2.809 2.916 1.00 . A A . 4 THR HG21 1 1 16 5576 1 1 5 THR HG22 H 9.584 1.836 1.542 1.00 . A A . 4 THR HG22 1 1 16 5577 1 1 5 THR HG23 H 10.048 1.052 3.052 1.00 . A A . 4 THR HG23 1 1 16 5578 1 1 5 THR N N 6.205 3.549 3.253 1.00 . A A . 4 THR N 1 1 16 5579 1 1 5 THR O O 7.734 2.159 0.399 1.00 . A A . 4 THR O 1 1 16 5580 1 1 5 THR OG1 O 8.124 2.074 4.538 1.00 . A A . 4 THR OG1 1 1 16 5581 1 1 6 GLY C C 4.975 4.830 -1.386 1.00 . A A . 5 GLY C 1 1 16 5582 1 1 6 GLY CA C 5.846 3.687 -0.890 1.00 . A A . 5 GLY CA 1 1 16 5583 1 1 6 GLY H H 5.803 4.517 1.052 1.00 . A A . 5 GLY H 1 1 16 5584 1 1 6 GLY HA2 H 6.740 3.640 -1.494 1.00 . A A . 5 GLY HA2 1 1 16 5585 1 1 6 GLY HA3 H 5.297 2.761 -1.001 1.00 . A A . 5 GLY HA3 1 1 16 5586 1 1 6 GLY N N 6.224 3.828 0.499 1.00 . A A . 5 GLY N 1 1 16 5587 1 1 6 GLY O O 4.132 4.638 -2.257 1.00 . A A . 5 GLY O 1 1 16 5588 1 1 7 LEU C C 5.267 8.251 -1.873 1.00 . A A . 6 LEU C 1 1 16 5589 1 1 7 LEU CA C 4.390 7.190 -1.218 1.00 . A A . 6 LEU CA 1 1 16 5590 1 1 7 LEU CB C 3.690 7.789 -0.012 1.00 . A A . 6 LEU CB 1 1 16 5591 1 1 7 LEU CD1 C 5.608 8.963 1.123 1.00 . A A . 6 LEU CD1 1 1 16 5592 1 1 7 LEU CD2 C 3.687 8.124 2.474 1.00 . A A . 6 LEU CD2 1 1 16 5593 1 1 7 LEU CG C 4.549 7.878 1.251 1.00 . A A . 6 LEU CG 1 1 16 5594 1 1 7 LEU H H 5.821 6.098 -0.094 1.00 . A A . 6 LEU H 1 1 16 5595 1 1 7 LEU HA H 3.646 6.868 -1.929 1.00 . A A . 6 LEU HA 1 1 16 5596 1 1 7 LEU HB2 H 3.365 8.782 -0.278 1.00 . A A . 6 LEU HB2 1 1 16 5597 1 1 7 LEU HB3 H 2.822 7.187 0.202 1.00 . A A . 6 LEU HB3 1 1 16 5598 1 1 7 LEU HD11 H 6.172 9.027 2.045 1.00 . A A . 6 LEU HD11 1 1 16 5599 1 1 7 LEU HD12 H 5.132 9.912 0.927 1.00 . A A . 6 LEU HD12 1 1 16 5600 1 1 7 LEU HD13 H 6.276 8.721 0.311 1.00 . A A . 6 LEU HD13 1 1 16 5601 1 1 7 LEU HD21 H 4.314 8.143 3.355 1.00 . A A . 6 LEU HD21 1 1 16 5602 1 1 7 LEU HD22 H 2.960 7.332 2.565 1.00 . A A . 6 LEU HD22 1 1 16 5603 1 1 7 LEU HD23 H 3.179 9.071 2.372 1.00 . A A . 6 LEU HD23 1 1 16 5604 1 1 7 LEU HG H 5.057 6.937 1.391 1.00 . A A . 6 LEU HG 1 1 16 5605 1 1 7 LEU N N 5.165 6.016 -0.816 1.00 . A A . 6 LEU N 1 1 16 5606 1 1 7 LEU O O 4.924 9.433 -1.893 1.00 . A A . 6 LEU O 1 1 16 5607 1 1 8 TYR C C 7.719 8.171 -4.448 1.00 . A A . 7 TYR C 1 1 16 5608 1 1 8 TYR CA C 7.328 8.710 -3.076 1.00 . A A . 7 TYR CA 1 1 16 5609 1 1 8 TYR CB C 8.575 8.907 -2.214 1.00 . A A . 7 TYR CB 1 1 16 5610 1 1 8 TYR CD1 C 8.308 6.831 -0.843 1.00 . A A . 7 TYR CD1 1 1 16 5611 1 1 8 TYR CD2 C 10.399 7.180 -1.919 1.00 . A A . 7 TYR CD2 1 1 16 5612 1 1 8 TYR CE1 C 8.756 5.652 -0.325 1.00 . A A . 7 TYR CE1 1 1 16 5613 1 1 8 TYR CE2 C 10.867 5.987 -1.397 1.00 . A A . 7 TYR CE2 1 1 16 5614 1 1 8 TYR CG C 9.110 7.619 -1.645 1.00 . A A . 7 TYR CG 1 1 16 5615 1 1 8 TYR CZ C 10.038 5.224 -0.599 1.00 . A A . 7 TYR CZ 1 1 16 5616 1 1 8 TYR H H 6.603 6.868 -2.345 1.00 . A A . 7 TYR H 1 1 16 5617 1 1 8 TYR HA H 6.836 9.654 -3.201 1.00 . A A . 7 TYR HA 1 1 16 5618 1 1 8 TYR HB2 H 9.352 9.358 -2.810 1.00 . A A . 7 TYR HB2 1 1 16 5619 1 1 8 TYR HB3 H 8.331 9.557 -1.389 1.00 . A A . 7 TYR HB3 1 1 16 5620 1 1 8 TYR HD1 H 7.305 7.162 -0.622 1.00 . A A . 7 TYR HD1 1 1 16 5621 1 1 8 TYR HD2 H 11.041 7.784 -2.543 1.00 . A A . 7 TYR HD2 1 1 16 5622 1 1 8 TYR HE1 H 8.096 5.069 0.284 1.00 . A A . 7 TYR HE1 1 1 16 5623 1 1 8 TYR HE2 H 11.872 5.657 -1.615 1.00 . A A . 7 TYR HE2 1 1 16 5624 1 1 8 TYR HH H 9.813 3.362 -0.180 1.00 . A A . 7 TYR HH 1 1 16 5625 1 1 8 TYR N N 6.390 7.815 -2.412 1.00 . A A . 7 TYR N 1 1 16 5626 1 1 8 TYR O O 7.814 8.922 -5.419 1.00 . A A . 7 TYR O 1 1 16 5627 1 1 8 TYR OH O 10.491 4.033 -0.078 1.00 . A A . 7 TYR OH 1 1 16 5628 1 1 9 THR C C 7.572 4.908 -5.949 1.00 . A A . 8 THR C 1 1 16 5629 1 1 9 THR CA C 8.326 6.216 -5.766 1.00 . A A . 8 THR CA 1 1 16 5630 1 1 9 THR CB C 9.836 5.926 -5.813 1.00 . A A . 8 THR CB 1 1 16 5631 1 1 9 THR CG2 C 10.641 7.212 -5.704 1.00 . A A . 8 THR CG2 1 1 16 5632 1 1 9 THR H H 7.854 6.320 -3.707 1.00 . A A . 8 THR H 1 1 16 5633 1 1 9 THR HA H 8.078 6.880 -6.578 1.00 . A A . 8 THR HA 1 1 16 5634 1 1 9 THR HB H 10.068 5.451 -6.754 1.00 . A A . 8 THR HB 1 1 16 5635 1 1 9 THR HG1 H 9.403 4.586 -4.432 1.00 . A A . 8 THR HG1 1 1 16 5636 1 1 9 THR HG21 H 11.696 6.979 -5.727 1.00 . A A . 8 THR HG21 1 1 16 5637 1 1 9 THR HG22 H 10.402 7.710 -4.775 1.00 . A A . 8 THR HG22 1 1 16 5638 1 1 9 THR HG23 H 10.398 7.860 -6.533 1.00 . A A . 8 THR HG23 1 1 16 5639 1 1 9 THR N N 7.946 6.863 -4.517 1.00 . A A . 8 THR N 1 1 16 5640 1 1 9 THR O O 7.871 4.124 -6.850 1.00 . A A . 8 THR O 1 1 16 5641 1 1 9 THR OG1 O 10.190 5.041 -4.744 1.00 . A A . 8 THR OG1 1 1 16 5642 1 1 10 LEU C C 4.331 3.759 -4.799 1.00 . A A . 9 LEU C 1 1 16 5643 1 1 10 LEU CA C 5.789 3.468 -5.138 1.00 . A A . 9 LEU CA 1 1 16 5644 1 1 10 LEU CB C 6.354 2.426 -4.174 1.00 . A A . 9 LEU CB 1 1 16 5645 1 1 10 LEU CD1 C 8.305 1.079 -3.376 1.00 . A A . 9 LEU CD1 1 1 16 5646 1 1 10 LEU CD2 C 7.799 1.199 -5.819 1.00 . A A . 9 LEU CD2 1 1 16 5647 1 1 10 LEU CG C 7.772 1.951 -4.497 1.00 . A A . 9 LEU CG 1 1 16 5648 1 1 10 LEU H H 6.396 5.358 -4.405 1.00 . A A . 9 LEU H 1 1 16 5649 1 1 10 LEU HA H 5.844 3.078 -6.142 1.00 . A A . 9 LEU HA 1 1 16 5650 1 1 10 LEU HB2 H 6.356 2.847 -3.182 1.00 . A A . 9 LEU HB2 1 1 16 5651 1 1 10 LEU HB3 H 5.699 1.567 -4.181 1.00 . A A . 9 LEU HB3 1 1 16 5652 1 1 10 LEU HD11 H 9.307 0.759 -3.615 1.00 . A A . 9 LEU HD11 1 1 16 5653 1 1 10 LEU HD12 H 7.667 0.215 -3.262 1.00 . A A . 9 LEU HD12 1 1 16 5654 1 1 10 LEU HD13 H 8.315 1.644 -2.456 1.00 . A A . 9 LEU HD13 1 1 16 5655 1 1 10 LEU HD21 H 7.122 0.359 -5.768 1.00 . A A . 9 LEU HD21 1 1 16 5656 1 1 10 LEU HD22 H 8.800 0.844 -6.011 1.00 . A A . 9 LEU HD22 1 1 16 5657 1 1 10 LEU HD23 H 7.493 1.861 -6.616 1.00 . A A . 9 LEU HD23 1 1 16 5658 1 1 10 LEU HG H 8.421 2.811 -4.588 1.00 . A A . 9 LEU HG 1 1 16 5659 1 1 10 LEU N N 6.590 4.684 -5.088 1.00 . A A . 9 LEU N 1 1 16 5660 1 1 10 LEU O O 3.596 2.871 -4.373 1.00 . A A . 9 LEU O 1 1 16 5661 1 1 11 LEU C C 1.551 4.401 -5.140 1.00 . A A . 10 LEU C 1 1 16 5662 1 1 11 LEU CA C 2.564 5.453 -4.703 1.00 . A A . 10 LEU CA 1 1 16 5663 1 1 11 LEU CB C 2.276 6.776 -5.422 1.00 . A A . 10 LEU CB 1 1 16 5664 1 1 11 LEU CD1 C 3.096 8.861 -6.551 1.00 . A A . 10 LEU CD1 1 1 16 5665 1 1 11 LEU CD2 C 4.394 7.887 -4.649 1.00 . A A . 10 LEU CD2 1 1 16 5666 1 1 11 LEU CG C 3.511 7.577 -5.847 1.00 . A A . 10 LEU CG 1 1 16 5667 1 1 11 LEU H H 4.587 5.676 -5.278 1.00 . A A . 10 LEU H 1 1 16 5668 1 1 11 LEU HA H 2.470 5.605 -3.640 1.00 . A A . 10 LEU HA 1 1 16 5669 1 1 11 LEU HB2 H 1.692 6.560 -6.305 1.00 . A A . 10 LEU HB2 1 1 16 5670 1 1 11 LEU HB3 H 1.682 7.393 -4.764 1.00 . A A . 10 LEU HB3 1 1 16 5671 1 1 11 LEU HD11 H 2.504 9.464 -5.880 1.00 . A A . 10 LEU HD11 1 1 16 5672 1 1 11 LEU HD12 H 2.512 8.618 -7.426 1.00 . A A . 10 LEU HD12 1 1 16 5673 1 1 11 LEU HD13 H 3.977 9.410 -6.848 1.00 . A A . 10 LEU HD13 1 1 16 5674 1 1 11 LEU HD21 H 3.851 8.506 -3.951 1.00 . A A . 10 LEU HD21 1 1 16 5675 1 1 11 LEU HD22 H 5.279 8.408 -4.979 1.00 . A A . 10 LEU HD22 1 1 16 5676 1 1 11 LEU HD23 H 4.683 6.964 -4.159 1.00 . A A . 10 LEU HD23 1 1 16 5677 1 1 11 LEU HG H 4.093 6.990 -6.541 1.00 . A A . 10 LEU HG 1 1 16 5678 1 1 11 LEU N N 3.933 5.016 -4.975 1.00 . A A . 10 LEU N 1 1 16 5679 1 1 11 LEU O O 0.995 3.680 -4.311 1.00 . A A . 10 LEU O 1 1 16 5680 1 1 12 SER C C 0.973 1.944 -6.931 1.00 . A A . 11 SER C 1 1 16 5681 1 1 12 SER CA C 0.371 3.343 -6.986 1.00 . A A . 11 SER CA 1 1 16 5682 1 1 12 SER CB C 0.005 3.700 -8.428 1.00 . A A . 11 SER CB 1 1 16 5683 1 1 12 SER H H 1.778 4.925 -7.055 1.00 . A A . 11 SER H 1 1 16 5684 1 1 12 SER HA H -0.520 3.366 -6.379 1.00 . A A . 11 SER HA 1 1 16 5685 1 1 12 SER HB2 H -0.690 2.968 -8.813 1.00 . A A . 11 SER HB2 1 1 16 5686 1 1 12 SER HB3 H -0.453 4.678 -8.449 1.00 . A A . 11 SER HB3 1 1 16 5687 1 1 12 SER HG H 0.889 3.865 -10.168 1.00 . A A . 11 SER HG 1 1 16 5688 1 1 12 SER N N 1.312 4.318 -6.444 1.00 . A A . 11 SER N 1 1 16 5689 1 1 12 SER O O 0.339 0.964 -7.319 1.00 . A A . 11 SER O 1 1 16 5690 1 1 12 SER OG O 1.154 3.719 -9.258 1.00 . A A . 11 SER OG 1 1 16 5691 1 1 13 ARG C C 2.935 0.124 -4.879 1.00 . A A . 12 ARG C 1 1 16 5692 1 1 13 ARG CA C 2.918 0.604 -6.326 1.00 . A A . 12 ARG CA 1 1 16 5693 1 1 13 ARG CB C 4.352 0.769 -6.831 1.00 . A A . 12 ARG CB 1 1 16 5694 1 1 13 ARG CD C 5.879 1.488 -8.691 1.00 . A A . 12 ARG CD 1 1 16 5695 1 1 13 ARG CG C 4.445 1.176 -8.292 1.00 . A A . 12 ARG CG 1 1 16 5696 1 1 13 ARG CZ C 7.137 2.111 -10.713 1.00 . A A . 12 ARG CZ 1 1 16 5697 1 1 13 ARG H H 2.652 2.692 -6.154 1.00 . A A . 12 ARG H 1 1 16 5698 1 1 13 ARG HA H 2.408 -0.125 -6.932 1.00 . A A . 12 ARG HA 1 1 16 5699 1 1 13 ARG HB2 H 4.841 1.529 -6.239 1.00 . A A . 12 ARG HB2 1 1 16 5700 1 1 13 ARG HB3 H 4.877 -0.166 -6.704 1.00 . A A . 12 ARG HB3 1 1 16 5701 1 1 13 ARG HD2 H 6.249 2.288 -8.066 1.00 . A A . 12 ARG HD2 1 1 16 5702 1 1 13 ARG HD3 H 6.482 0.604 -8.537 1.00 . A A . 12 ARG HD3 1 1 16 5703 1 1 13 ARG HE H 5.147 2.006 -10.592 1.00 . A A . 12 ARG HE 1 1 16 5704 1 1 13 ARG HG2 H 4.078 0.367 -8.905 1.00 . A A . 12 ARG HG2 1 1 16 5705 1 1 13 ARG HG3 H 3.838 2.056 -8.450 1.00 . A A . 12 ARG HG3 1 1 16 5706 1 1 13 ARG HH11 H 8.281 1.689 -9.101 1.00 . A A . 12 ARG HH11 1 1 16 5707 1 1 13 ARG HH12 H 9.150 2.131 -10.532 1.00 . A A . 12 ARG HH12 1 1 16 5708 1 1 13 ARG HH21 H 6.284 2.587 -12.482 1.00 . A A . 12 ARG HH21 1 1 16 5709 1 1 13 ARG HH22 H 8.014 2.641 -12.454 1.00 . A A . 12 ARG HH22 1 1 16 5710 1 1 13 ARG N N 2.206 1.869 -6.443 1.00 . A A . 12 ARG N 1 1 16 5711 1 1 13 ARG NE N 5.982 1.891 -10.091 1.00 . A A . 12 ARG NE 1 1 16 5712 1 1 13 ARG NH1 N 8.283 1.966 -10.062 1.00 . A A . 12 ARG NH1 1 1 16 5713 1 1 13 ARG NH2 N 7.146 2.476 -11.988 1.00 . A A . 12 ARG NH2 1 1 16 5714 1 1 13 ARG O O 3.675 -0.796 -4.527 1.00 . A A . 12 ARG O 1 1 16 5715 1 1 14 VAL C C 1.085 -0.763 -2.403 1.00 . A A . 13 VAL C 1 1 16 5716 1 1 14 VAL CA C 2.039 0.399 -2.634 1.00 . A A . 13 VAL CA 1 1 16 5717 1 1 14 VAL CB C 1.587 1.602 -1.785 1.00 . A A . 13 VAL CB 1 1 16 5718 1 1 14 VAL CG1 C 0.129 1.927 -2.060 1.00 . A A . 13 VAL CG1 1 1 16 5719 1 1 14 VAL CG2 C 1.805 1.324 -0.310 1.00 . A A . 13 VAL CG2 1 1 16 5720 1 1 14 VAL H H 1.543 1.467 -4.391 1.00 . A A . 13 VAL H 1 1 16 5721 1 1 14 VAL HA H 3.021 0.109 -2.315 1.00 . A A . 13 VAL HA 1 1 16 5722 1 1 14 VAL HB H 2.181 2.458 -2.060 1.00 . A A . 13 VAL HB 1 1 16 5723 1 1 14 VAL HG11 H -0.137 2.842 -1.553 1.00 . A A . 13 VAL HG11 1 1 16 5724 1 1 14 VAL HG12 H -0.491 1.122 -1.700 1.00 . A A . 13 VAL HG12 1 1 16 5725 1 1 14 VAL HG13 H -0.016 2.047 -3.123 1.00 . A A . 13 VAL HG13 1 1 16 5726 1 1 14 VAL HG21 H 1.201 0.480 -0.013 1.00 . A A . 13 VAL HG21 1 1 16 5727 1 1 14 VAL HG22 H 1.523 2.193 0.266 1.00 . A A . 13 VAL HG22 1 1 16 5728 1 1 14 VAL HG23 H 2.847 1.100 -0.137 1.00 . A A . 13 VAL HG23 1 1 16 5729 1 1 14 VAL N N 2.114 0.750 -4.047 1.00 . A A . 13 VAL N 1 1 16 5730 1 1 14 VAL O O 0.886 -1.209 -1.271 1.00 . A A . 13 VAL O 1 1 16 5731 1 1 15 ASN C C -1.593 -2.017 -2.477 1.00 . A A . 14 ASN C 1 1 16 5732 1 1 15 ASN CA C -0.437 -2.364 -3.409 1.00 . A A . 14 ASN CA 1 1 16 5733 1 1 15 ASN CB C 0.262 -3.639 -2.930 1.00 . A A . 14 ASN CB 1 1 16 5734 1 1 15 ASN CG C 1.220 -4.210 -3.961 1.00 . A A . 14 ASN CG 1 1 16 5735 1 1 15 ASN H H 0.733 -0.875 -4.355 1.00 . A A . 14 ASN H 1 1 16 5736 1 1 15 ASN HA H -0.827 -2.526 -4.399 1.00 . A A . 14 ASN HA 1 1 16 5737 1 1 15 ASN HB2 H 0.821 -3.419 -2.032 1.00 . A A . 14 ASN HB2 1 1 16 5738 1 1 15 ASN HB3 H -0.484 -4.387 -2.708 1.00 . A A . 14 ASN HB3 1 1 16 5739 1 1 15 ASN HD21 H 2.448 -3.685 -5.434 1.00 . A A . 14 ASN HD21 1 1 16 5740 1 1 15 ASN HD22 H 1.628 -2.387 -4.646 1.00 . A A . 14 ASN HD22 1 1 16 5741 1 1 15 ASN N N 0.509 -1.258 -3.484 1.00 . A A . 14 ASN N 1 1 16 5742 1 1 15 ASN ND2 N 1.826 -3.339 -4.761 1.00 . A A . 14 ASN ND2 1 1 16 5743 1 1 15 ASN O O -2.323 -2.899 -2.023 1.00 . A A . 14 ASN O 1 1 16 5744 1 1 15 ASN OD1 O 1.414 -5.423 -4.036 1.00 . A A . 14 ASN OD1 1 1 16 5745 1 1 16 ARG C C -2.983 -1.089 -0.092 1.00 . A A . 15 ARG C 1 1 16 5746 1 1 16 ARG CA C -2.804 -0.210 -1.330 1.00 . A A . 15 ARG CA 1 1 16 5747 1 1 16 ARG CB C -4.130 -0.086 -2.094 1.00 . A A . 15 ARG CB 1 1 16 5748 1 1 16 ARG CD C -6.043 -1.222 -3.262 1.00 . A A . 15 ARG CD 1 1 16 5749 1 1 16 ARG CG C -4.736 -1.417 -2.510 1.00 . A A . 15 ARG CG 1 1 16 5750 1 1 16 ARG CZ C -6.841 -0.167 -5.338 1.00 . A A . 15 ARG CZ 1 1 16 5751 1 1 16 ARG H H -1.128 -0.079 -2.615 1.00 . A A . 15 ARG H 1 1 16 5752 1 1 16 ARG HA H -2.501 0.776 -1.006 1.00 . A A . 15 ARG HA 1 1 16 5753 1 1 16 ARG HB2 H -4.843 0.427 -1.466 1.00 . A A . 15 ARG HB2 1 1 16 5754 1 1 16 ARG HB3 H -3.963 0.501 -2.985 1.00 . A A . 15 ARG HB3 1 1 16 5755 1 1 16 ARG HD2 H -6.436 -2.191 -3.534 1.00 . A A . 15 ARG HD2 1 1 16 5756 1 1 16 ARG HD3 H -6.746 -0.720 -2.613 1.00 . A A . 15 ARG HD3 1 1 16 5757 1 1 16 ARG HE H -4.970 -0.067 -4.651 1.00 . A A . 15 ARG HE 1 1 16 5758 1 1 16 ARG HG2 H -4.039 -1.935 -3.151 1.00 . A A . 15 ARG HG2 1 1 16 5759 1 1 16 ARG HG3 H -4.925 -2.008 -1.626 1.00 . A A . 15 ARG HG3 1 1 16 5760 1 1 16 ARG HH11 H -8.252 -1.192 -4.314 1.00 . A A . 15 ARG HH11 1 1 16 5761 1 1 16 ARG HH12 H -8.795 -0.442 -5.778 1.00 . A A . 15 ARG HH12 1 1 16 5762 1 1 16 ARG HH21 H -5.678 0.924 -6.579 1.00 . A A . 15 ARG HH21 1 1 16 5763 1 1 16 ARG HH22 H -7.332 0.760 -7.065 1.00 . A A . 15 ARG HH22 1 1 16 5764 1 1 16 ARG N N -1.748 -0.719 -2.207 1.00 . A A . 15 ARG N 1 1 16 5765 1 1 16 ARG NE N -5.865 -0.427 -4.474 1.00 . A A . 15 ARG NE 1 1 16 5766 1 1 16 ARG NH1 N -8.062 -0.640 -5.125 1.00 . A A . 15 ARG NH1 1 1 16 5767 1 1 16 ARG NH2 N -6.597 0.565 -6.415 1.00 . A A . 15 ARG NH2 1 1 16 5768 1 1 16 ARG O O -2.082 -1.835 0.289 1.00 . A A . 15 ARG O 1 1 16 5769 1 1 17 HIS C C -4.770 -3.211 1.370 1.00 . A A . 16 HIS C 1 1 16 5770 1 1 17 HIS CA C -4.446 -1.766 1.733 1.00 . A A . 16 HIS CA 1 1 16 5771 1 1 17 HIS CB C -5.618 -1.144 2.497 1.00 . A A . 16 HIS CB 1 1 16 5772 1 1 17 HIS CD2 C -4.662 0.747 3.995 1.00 . A A . 16 HIS CD2 1 1 16 5773 1 1 17 HIS CE1 C -5.471 2.464 2.896 1.00 . A A . 16 HIS CE1 1 1 16 5774 1 1 17 HIS CG C -5.363 0.263 2.941 1.00 . A A . 16 HIS CG 1 1 16 5775 1 1 17 HIS H H -4.824 -0.362 0.195 1.00 . A A . 16 HIS H 1 1 16 5776 1 1 17 HIS HA H -3.570 -1.753 2.364 1.00 . A A . 16 HIS HA 1 1 16 5777 1 1 17 HIS HB2 H -6.490 -1.139 1.862 1.00 . A A . 16 HIS HB2 1 1 16 5778 1 1 17 HIS HB3 H -5.820 -1.738 3.376 1.00 . A A . 16 HIS HB3 1 1 16 5779 1 1 17 HIS HD1 H -6.409 1.342 1.464 1.00 . A A . 16 HIS HD1 1 1 16 5780 1 1 17 HIS HD2 H -4.136 0.165 4.737 1.00 . A A . 16 HIS HD2 1 1 16 5781 1 1 17 HIS HE1 H -5.709 3.475 2.600 1.00 . A A . 16 HIS HE1 1 1 16 5782 1 1 17 HIS HE2 H -4.335 2.738 4.578 1.00 . A A . 16 HIS HE2 1 1 16 5783 1 1 17 HIS N N -4.149 -0.982 0.539 1.00 . A A . 16 HIS N 1 1 16 5784 1 1 17 HIS ND1 N -5.858 1.364 2.273 1.00 . A A . 16 HIS ND1 1 1 16 5785 1 1 17 HIS NE2 N -4.746 2.116 3.942 1.00 . A A . 16 HIS NE2 1 1 16 5786 1 1 17 HIS O O -5.579 -3.470 0.479 1.00 . A A . 16 HIS O 1 1 16 5787 1 1 18 SER C C -4.343 -6.359 3.119 1.00 . A A . 17 SER C 1 1 16 5788 1 1 18 SER CA C -4.352 -5.567 1.815 1.00 . A A . 17 SER CA 1 1 16 5789 1 1 18 SER CB C -3.280 -6.110 0.868 1.00 . A A . 17 SER CB 1 1 16 5790 1 1 18 SER H H -3.499 -3.877 2.763 1.00 . A A . 17 SER H 1 1 16 5791 1 1 18 SER HA H -5.320 -5.676 1.349 1.00 . A A . 17 SER HA 1 1 16 5792 1 1 18 SER HB2 H -2.306 -5.971 1.313 1.00 . A A . 17 SER HB2 1 1 16 5793 1 1 18 SER HB3 H -3.452 -7.163 0.700 1.00 . A A . 17 SER HB3 1 1 16 5794 1 1 18 SER HG H -2.734 -4.674 -0.347 1.00 . A A . 17 SER HG 1 1 16 5795 1 1 18 SER N N -4.132 -4.147 2.065 1.00 . A A . 17 SER N 1 1 16 5796 1 1 18 SER O O -3.987 -5.833 4.173 1.00 . A A . 17 SER O 1 1 16 5797 1 1 18 SER OG O -3.313 -5.438 -0.379 1.00 . A A . 17 SER OG 1 1 16 5798 1 1 19 THR C C -3.593 -9.454 4.220 1.00 . A A . 18 THR C 1 1 16 5799 1 1 19 THR CA C -4.775 -8.491 4.210 1.00 . A A . 18 THR CA 1 1 16 5800 1 1 19 THR CB C -6.085 -9.302 4.267 1.00 . A A . 18 THR CB 1 1 16 5801 1 1 19 THR CG2 C -6.133 -10.171 5.515 1.00 . A A . 18 THR CG2 1 1 16 5802 1 1 19 THR H H -5.009 -7.987 2.169 1.00 . A A . 18 THR H 1 1 16 5803 1 1 19 THR HA H -4.725 -7.866 5.090 1.00 . A A . 18 THR HA 1 1 16 5804 1 1 19 THR HB H -6.132 -9.942 3.397 1.00 . A A . 18 THR HB 1 1 16 5805 1 1 19 THR HG1 H -7.111 -7.763 4.953 1.00 . A A . 18 THR HG1 1 1 16 5806 1 1 19 THR HG21 H -5.297 -10.856 5.508 1.00 . A A . 18 THR HG21 1 1 16 5807 1 1 19 THR HG22 H -7.057 -10.731 5.527 1.00 . A A . 18 THR HG22 1 1 16 5808 1 1 19 THR HG23 H -6.079 -9.545 6.392 1.00 . A A . 18 THR HG23 1 1 16 5809 1 1 19 THR N N -4.738 -7.625 3.038 1.00 . A A . 18 THR N 1 1 16 5810 1 1 19 THR O O -3.318 -10.126 3.225 1.00 . A A . 18 THR O 1 1 16 5811 1 1 19 THR OG1 O -7.210 -8.415 4.256 1.00 . A A . 18 THR OG1 1 1 16 5812 1 1 20 ALA C C -2.039 -11.537 6.458 1.00 . A A . 19 ALA C 1 1 16 5813 1 1 20 ALA CA C -1.742 -10.395 5.491 1.00 . A A . 19 ALA CA 1 1 16 5814 1 1 20 ALA CB C -0.529 -9.606 5.962 1.00 . A A . 19 ALA CB 1 1 16 5815 1 1 20 ALA H H -3.163 -8.954 6.108 1.00 . A A . 19 ALA H 1 1 16 5816 1 1 20 ALA HA H -1.517 -10.810 4.520 1.00 . A A . 19 ALA HA 1 1 16 5817 1 1 20 ALA HB1 H 0.324 -10.264 6.031 1.00 . A A . 19 ALA HB1 1 1 16 5818 1 1 20 ALA HB2 H -0.733 -9.178 6.933 1.00 . A A . 19 ALA HB2 1 1 16 5819 1 1 20 ALA HB3 H -0.319 -8.815 5.257 1.00 . A A . 19 ALA HB3 1 1 16 5820 1 1 20 ALA N N -2.895 -9.515 5.350 1.00 . A A . 19 ALA N 1 1 16 5821 1 1 20 ALA O O -2.272 -11.313 7.646 1.00 . A A . 19 ALA O 1 1 16 5822 1 1 21 ILE C C -1.005 -14.525 7.311 1.00 . A A . 20 ILE C 1 1 16 5823 1 1 21 ILE CA C -2.299 -13.939 6.757 1.00 . A A . 20 ILE CA 1 1 16 5824 1 1 21 ILE CB C -3.046 -15.028 5.955 1.00 . A A . 20 ILE CB 1 1 16 5825 1 1 21 ILE CD1 C -4.358 -13.573 4.319 1.00 . A A . 20 ILE CD1 1 1 16 5826 1 1 21 ILE CG1 C -4.418 -14.518 5.499 1.00 . A A . 20 ILE CG1 1 1 16 5827 1 1 21 ILE CG2 C -3.201 -16.292 6.788 1.00 . A A . 20 ILE CG2 1 1 16 5828 1 1 21 ILE H H -1.836 -12.876 4.986 1.00 . A A . 20 ILE H 1 1 16 5829 1 1 21 ILE HA H -2.926 -13.635 7.582 1.00 . A A . 20 ILE HA 1 1 16 5830 1 1 21 ILE HB H -2.454 -15.271 5.085 1.00 . A A . 20 ILE HB 1 1 16 5831 1 1 21 ILE HD11 H -3.823 -12.678 4.599 1.00 . A A . 20 ILE HD11 1 1 16 5832 1 1 21 ILE HD12 H -5.362 -13.313 4.015 1.00 . A A . 20 ILE HD12 1 1 16 5833 1 1 21 ILE HD13 H -3.848 -14.055 3.497 1.00 . A A . 20 ILE HD13 1 1 16 5834 1 1 21 ILE HG12 H -5.031 -15.362 5.218 1.00 . A A . 20 ILE HG12 1 1 16 5835 1 1 21 ILE HG13 H -4.889 -13.995 6.319 1.00 . A A . 20 ILE HG13 1 1 16 5836 1 1 21 ILE HG21 H -2.224 -16.686 7.030 1.00 . A A . 20 ILE HG21 1 1 16 5837 1 1 21 ILE HG22 H -3.756 -17.029 6.225 1.00 . A A . 20 ILE HG22 1 1 16 5838 1 1 21 ILE HG23 H -3.731 -16.061 7.700 1.00 . A A . 20 ILE HG23 1 1 16 5839 1 1 21 ILE N N -2.030 -12.761 5.940 1.00 . A A . 20 ILE N 1 1 16 5840 1 1 21 ILE O O -0.072 -14.815 6.560 1.00 . A A . 20 ILE O 1 1 16 5841 1 1 22 GLY C C 1.159 -14.175 9.786 1.00 . A A . 21 GLY C 1 1 16 5842 1 1 22 GLY CA C 0.228 -15.250 9.260 1.00 . A A . 21 GLY CA 1 1 16 5843 1 1 22 GLY H H -1.730 -14.451 9.175 1.00 . A A . 21 GLY H 1 1 16 5844 1 1 22 GLY HA2 H -0.077 -15.881 10.082 1.00 . A A . 21 GLY HA2 1 1 16 5845 1 1 22 GLY HA3 H 0.762 -15.851 8.538 1.00 . A A . 21 GLY HA3 1 1 16 5846 1 1 22 GLY N N -0.956 -14.699 8.628 1.00 . A A . 21 GLY N 1 1 16 5847 1 1 22 GLY O O 2.177 -13.870 9.166 1.00 . A A . 21 GLY O 1 1 16 5848 1 1 23 ARG C C 2.606 -13.146 12.548 1.00 . A A . 22 ARG C 1 1 16 5849 1 1 23 ARG CA C 1.621 -12.555 11.544 1.00 . A A . 22 ARG CA 1 1 16 5850 1 1 23 ARG CB C 0.727 -11.523 12.235 1.00 . A A . 22 ARG CB 1 1 16 5851 1 1 23 ARG CD C -1.114 -9.825 12.025 1.00 . A A . 22 ARG CD 1 1 16 5852 1 1 23 ARG CG C -0.247 -10.834 11.291 1.00 . A A . 22 ARG CG 1 1 16 5853 1 1 23 ARG CZ C -0.843 -7.762 13.338 1.00 . A A . 22 ARG CZ 1 1 16 5854 1 1 23 ARG H H -0.014 -13.889 11.380 1.00 . A A . 22 ARG H 1 1 16 5855 1 1 23 ARG HA H 2.177 -12.067 10.758 1.00 . A A . 22 ARG HA 1 1 16 5856 1 1 23 ARG HB2 H 0.157 -12.018 13.008 1.00 . A A . 22 ARG HB2 1 1 16 5857 1 1 23 ARG HB3 H 1.351 -10.768 12.688 1.00 . A A . 22 ARG HB3 1 1 16 5858 1 1 23 ARG HD2 H -1.794 -9.373 11.318 1.00 . A A . 22 ARG HD2 1 1 16 5859 1 1 23 ARG HD3 H -1.679 -10.341 12.787 1.00 . A A . 22 ARG HD3 1 1 16 5860 1 1 23 ARG HE H 0.656 -8.827 12.563 1.00 . A A . 22 ARG HE 1 1 16 5861 1 1 23 ARG HG2 H 0.313 -10.322 10.524 1.00 . A A . 22 ARG HG2 1 1 16 5862 1 1 23 ARG HG3 H -0.884 -11.580 10.839 1.00 . A A . 22 ARG HG3 1 1 16 5863 1 1 23 ARG HH11 H -2.548 -6.899 13.995 1.00 . A A . 22 ARG HH11 1 1 16 5864 1 1 23 ARG HH12 H -2.758 -8.350 13.072 1.00 . A A . 22 ARG HH12 1 1 16 5865 1 1 23 ARG HH21 H -0.445 -6.085 14.395 1.00 . A A . 22 ARG HH21 1 1 16 5866 1 1 23 ARG HH22 H 0.942 -6.918 13.777 1.00 . A A . 22 ARG HH22 1 1 16 5867 1 1 23 ARG N N 0.809 -13.602 10.933 1.00 . A A . 22 ARG N 1 1 16 5868 1 1 23 ARG NE N -0.319 -8.774 12.655 1.00 . A A . 22 ARG NE 1 1 16 5869 1 1 23 ARG NH1 N -2.157 -7.662 13.481 1.00 . A A . 22 ARG NH1 1 1 16 5870 1 1 23 ARG NH2 N -0.051 -6.847 13.882 1.00 . A A . 22 ARG NH2 1 1 16 5871 1 1 23 ARG O O 2.228 -13.295 13.729 1.00 . A A . 22 ARG O 1 1 16 5872 1 1 23 ARG OXT O 3.746 -13.456 12.144 1.00 . A A . 22 ARG OXT 1 1 17 5873 1 1 1 ACE C C 7.191 -2.170 9.627 1.00 . A A . 0 ACE C 1 1 17 5874 1 1 1 ACE CH3 C 7.824 -2.777 10.849 1.00 . A A . 0 ACE CH3 1 1 17 5875 1 1 1 ACE H1 H 8.379 -3.661 10.549 1.00 . A A . 0 ACE H1 1 1 17 5876 1 1 1 ACE H2 H 7.060 -3.055 11.548 1.00 . A A . 0 ACE H2 1 1 17 5877 1 1 1 ACE H3 H 8.480 -2.041 11.302 1.00 . A A . 0 ACE H3 1 1 17 5878 1 1 1 ACE O O 6.464 -2.841 8.892 1.00 . A A . 0 ACE O 1 1 17 5879 1 1 2 MET C C 7.582 -0.640 6.959 1.00 . A A . 1 MET C 1 1 17 5880 1 1 2 MET CA C 6.913 -0.180 8.251 1.00 . A A . 1 MET CA 1 1 17 5881 1 1 2 MET CB C 7.090 1.329 8.425 1.00 . A A . 1 MET CB 1 1 17 5882 1 1 2 MET CE C 10.504 3.707 8.779 1.00 . A A . 1 MET CE 1 1 17 5883 1 1 2 MET CG C 8.544 1.770 8.490 1.00 . A A . 1 MET CG 1 1 17 5884 1 1 2 MET H H 8.050 -0.409 10.021 1.00 . A A . 1 MET H 1 1 17 5885 1 1 2 MET HA H 5.859 -0.406 8.197 1.00 . A A . 1 MET HA 1 1 17 5886 1 1 2 MET HB2 H 6.622 1.832 7.593 1.00 . A A . 1 MET HB2 1 1 17 5887 1 1 2 MET HB3 H 6.604 1.634 9.339 1.00 . A A . 1 MET HB3 1 1 17 5888 1 1 2 MET HE1 H 10.769 4.740 8.946 1.00 . A A . 1 MET HE1 1 1 17 5889 1 1 2 MET HE2 H 10.897 3.384 7.826 1.00 . A A . 1 MET HE2 1 1 17 5890 1 1 2 MET HE3 H 10.922 3.096 9.567 1.00 . A A . 1 MET HE3 1 1 17 5891 1 1 2 MET HG2 H 9.032 1.239 9.295 1.00 . A A . 1 MET HG2 1 1 17 5892 1 1 2 MET HG3 H 9.024 1.522 7.554 1.00 . A A . 1 MET HG3 1 1 17 5893 1 1 2 MET N N 7.464 -0.889 9.400 1.00 . A A . 1 MET N 1 1 17 5894 1 1 2 MET O O 8.750 -1.030 6.959 1.00 . A A . 1 MET O 1 1 17 5895 1 1 2 MET SD S 8.721 3.541 8.776 1.00 . A A . 1 MET SD 1 1 17 5896 1 1 3 ASN C C 6.885 -0.081 3.452 1.00 . A A . 2 ASN C 1 1 17 5897 1 1 3 ASN CA C 7.359 -1.008 4.563 1.00 . A A . 2 ASN CA 1 1 17 5898 1 1 3 ASN CB C 6.925 -2.440 4.240 1.00 . A A . 2 ASN CB 1 1 17 5899 1 1 3 ASN CG C 7.412 -2.901 2.877 1.00 . A A . 2 ASN CG 1 1 17 5900 1 1 3 ASN H H 5.911 -0.272 5.922 1.00 . A A . 2 ASN H 1 1 17 5901 1 1 3 ASN HA H 8.437 -0.971 4.612 1.00 . A A . 2 ASN HA 1 1 17 5902 1 1 3 ASN HB2 H 7.324 -3.108 4.989 1.00 . A A . 2 ASN HB2 1 1 17 5903 1 1 3 ASN HB3 H 5.846 -2.494 4.253 1.00 . A A . 2 ASN HB3 1 1 17 5904 1 1 3 ASN HD21 H 7.025 -2.746 0.926 1.00 . A A . 2 ASN HD21 1 1 17 5905 1 1 3 ASN HD22 H 5.965 -1.869 1.971 1.00 . A A . 2 ASN HD22 1 1 17 5906 1 1 3 ASN N N 6.835 -0.593 5.859 1.00 . A A . 2 ASN N 1 1 17 5907 1 1 3 ASN ND2 N 6.732 -2.462 1.818 1.00 . A A . 2 ASN ND2 1 1 17 5908 1 1 3 ASN O O 7.396 -0.145 2.333 1.00 . A A . 2 ASN O 1 1 17 5909 1 1 3 ASN OD1 O 8.400 -3.629 2.773 1.00 . A A . 2 ASN OD1 1 1 17 5910 1 1 4 TRP C C 6.430 2.122 1.772 1.00 . A A . 3 TRP C 1 1 17 5911 1 1 4 TRP CA C 5.371 1.699 2.773 1.00 . A A . 3 TRP CA 1 1 17 5912 1 1 4 TRP CB C 4.733 2.918 3.443 1.00 . A A . 3 TRP CB 1 1 17 5913 1 1 4 TRP CD1 C 5.894 3.347 5.684 1.00 . A A . 3 TRP CD1 1 1 17 5914 1 1 4 TRP CD2 C 6.372 4.836 4.099 1.00 . A A . 3 TRP CD2 1 1 17 5915 1 1 4 TRP CE2 C 7.054 5.206 5.268 1.00 . A A . 3 TRP CE2 1 1 17 5916 1 1 4 TRP CE3 C 6.518 5.612 2.960 1.00 . A A . 3 TRP CE3 1 1 17 5917 1 1 4 TRP CG C 5.631 3.655 4.387 1.00 . A A . 3 TRP CG 1 1 17 5918 1 1 4 TRP CH2 C 7.996 7.081 4.188 1.00 . A A . 3 TRP CH2 1 1 17 5919 1 1 4 TRP CZ2 C 7.871 6.330 5.326 1.00 . A A . 3 TRP CZ2 1 1 17 5920 1 1 4 TRP CZ3 C 7.328 6.729 3.008 1.00 . A A . 3 TRP CZ3 1 1 17 5921 1 1 4 TRP H H 5.588 0.825 4.682 1.00 . A A . 3 TRP H 1 1 17 5922 1 1 4 TRP HA H 4.604 1.170 2.238 1.00 . A A . 3 TRP HA 1 1 17 5923 1 1 4 TRP HB2 H 4.425 3.613 2.675 1.00 . A A . 3 TRP HB2 1 1 17 5924 1 1 4 TRP HB3 H 3.864 2.598 3.997 1.00 . A A . 3 TRP HB3 1 1 17 5925 1 1 4 TRP HD1 H 5.483 2.496 6.193 1.00 . A A . 3 TRP HD1 1 1 17 5926 1 1 4 TRP HE1 H 7.076 4.279 7.151 1.00 . A A . 3 TRP HE1 1 1 17 5927 1 1 4 TRP HE3 H 6.011 5.340 2.046 1.00 . A A . 3 TRP HE3 1 1 17 5928 1 1 4 TRP HH2 H 8.620 7.962 4.185 1.00 . A A . 3 TRP HH2 1 1 17 5929 1 1 4 TRP HZ2 H 8.387 6.614 6.226 1.00 . A A . 3 TRP HZ2 1 1 17 5930 1 1 4 TRP HZ3 H 7.451 7.345 2.130 1.00 . A A . 3 TRP HZ3 1 1 17 5931 1 1 4 TRP N N 5.922 0.787 3.764 1.00 . A A . 3 TRP N 1 1 17 5932 1 1 4 TRP NE1 N 6.745 4.280 6.229 1.00 . A A . 3 TRP NE1 1 1 17 5933 1 1 4 TRP O O 6.360 1.734 0.607 1.00 . A A . 3 TRP O 1 1 17 5934 1 1 5 THR C C 8.151 3.328 -0.064 1.00 . A A . 4 THR C 1 1 17 5935 1 1 5 THR CA C 8.516 3.369 1.419 1.00 . A A . 4 THR CA 1 1 17 5936 1 1 5 THR CB C 9.811 2.566 1.650 1.00 . A A . 4 THR CB 1 1 17 5937 1 1 5 THR CG2 C 11.019 3.314 1.102 1.00 . A A . 4 THR CG2 1 1 17 5938 1 1 5 THR H H 7.439 3.071 3.207 1.00 . A A . 4 THR H 1 1 17 5939 1 1 5 THR HA H 8.694 4.391 1.713 1.00 . A A . 4 THR HA 1 1 17 5940 1 1 5 THR HB H 9.729 1.619 1.138 1.00 . A A . 4 THR HB 1 1 17 5941 1 1 5 THR HG1 H 9.626 3.061 3.550 1.00 . A A . 4 THR HG1 1 1 17 5942 1 1 5 THR HG21 H 11.913 2.737 1.285 1.00 . A A . 4 THR HG21 1 1 17 5943 1 1 5 THR HG22 H 11.102 4.272 1.593 1.00 . A A . 4 THR HG22 1 1 17 5944 1 1 5 THR HG23 H 10.898 3.463 0.039 1.00 . A A . 4 THR HG23 1 1 17 5945 1 1 5 THR N N 7.428 2.865 2.251 1.00 . A A . 4 THR N 1 1 17 5946 1 1 5 THR O O 8.943 2.891 -0.900 1.00 . A A . 4 THR O 1 1 17 5947 1 1 5 THR OG1 O 9.995 2.329 3.051 1.00 . A A . 4 THR OG1 1 1 17 5948 1 1 6 GLY C C 5.135 4.428 -1.950 1.00 . A A . 5 GLY C 1 1 17 5949 1 1 6 GLY CA C 6.492 3.770 -1.761 1.00 . A A . 5 GLY CA 1 1 17 5950 1 1 6 GLY H H 6.361 4.146 0.316 1.00 . A A . 5 GLY H 1 1 17 5951 1 1 6 GLY HA2 H 7.217 4.281 -2.375 1.00 . A A . 5 GLY HA2 1 1 17 5952 1 1 6 GLY HA3 H 6.427 2.739 -2.082 1.00 . A A . 5 GLY HA3 1 1 17 5953 1 1 6 GLY N N 6.944 3.791 -0.386 1.00 . A A . 5 GLY N 1 1 17 5954 1 1 6 GLY O O 4.415 4.107 -2.891 1.00 . A A . 5 GLY O 1 1 17 5955 1 1 7 LEU C C 3.731 7.495 -1.544 1.00 . A A . 6 LEU C 1 1 17 5956 1 1 7 LEU CA C 3.507 6.048 -1.124 1.00 . A A . 6 LEU CA 1 1 17 5957 1 1 7 LEU CB C 2.800 6.016 0.228 1.00 . A A . 6 LEU CB 1 1 17 5958 1 1 7 LEU CD1 C 4.148 7.703 1.525 1.00 . A A . 6 LEU CD1 1 1 17 5959 1 1 7 LEU CD2 C 3.029 5.818 2.719 1.00 . A A . 6 LEU CD2 1 1 17 5960 1 1 7 LEU CG C 3.712 6.248 1.434 1.00 . A A . 6 LEU CG 1 1 17 5961 1 1 7 LEU H H 5.379 5.512 -0.291 1.00 . A A . 6 LEU H 1 1 17 5962 1 1 7 LEU HA H 2.889 5.558 -1.860 1.00 . A A . 6 LEU HA 1 1 17 5963 1 1 7 LEU HB2 H 2.039 6.780 0.227 1.00 . A A . 6 LEU HB2 1 1 17 5964 1 1 7 LEU HB3 H 2.325 5.055 0.339 1.00 . A A . 6 LEU HB3 1 1 17 5965 1 1 7 LEU HD11 H 3.275 8.336 1.595 1.00 . A A . 6 LEU HD11 1 1 17 5966 1 1 7 LEU HD12 H 4.715 7.966 0.645 1.00 . A A . 6 LEU HD12 1 1 17 5967 1 1 7 LEU HD13 H 4.762 7.840 2.405 1.00 . A A . 6 LEU HD13 1 1 17 5968 1 1 7 LEU HD21 H 3.702 5.970 3.551 1.00 . A A . 6 LEU HD21 1 1 17 5969 1 1 7 LEU HD22 H 2.766 4.773 2.654 1.00 . A A . 6 LEU HD22 1 1 17 5970 1 1 7 LEU HD23 H 2.136 6.407 2.865 1.00 . A A . 6 LEU HD23 1 1 17 5971 1 1 7 LEU HG H 4.600 5.646 1.316 1.00 . A A . 6 LEU HG 1 1 17 5972 1 1 7 LEU N N 4.779 5.332 -1.043 1.00 . A A . 6 LEU N 1 1 17 5973 1 1 7 LEU O O 2.895 8.365 -1.304 1.00 . A A . 6 LEU O 1 1 17 5974 1 1 8 TYR C C 5.969 9.061 -3.965 1.00 . A A . 7 TYR C 1 1 17 5975 1 1 8 TYR CA C 5.236 9.071 -2.620 1.00 . A A . 7 TYR CA 1 1 17 5976 1 1 8 TYR CB C 6.121 9.724 -1.558 1.00 . A A . 7 TYR CB 1 1 17 5977 1 1 8 TYR CD1 C 7.139 7.572 -0.781 1.00 . A A . 7 TYR CD1 1 1 17 5978 1 1 8 TYR CD2 C 8.612 9.369 -1.284 1.00 . A A . 7 TYR CD2 1 1 17 5979 1 1 8 TYR CE1 C 8.197 6.772 -0.471 1.00 . A A . 7 TYR CE1 1 1 17 5980 1 1 8 TYR CE2 C 9.694 8.570 -0.965 1.00 . A A . 7 TYR CE2 1 1 17 5981 1 1 8 TYR CG C 7.316 8.879 -1.193 1.00 . A A . 7 TYR CG 1 1 17 5982 1 1 8 TYR CZ C 9.481 7.268 -0.560 1.00 . A A . 7 TYR CZ 1 1 17 5983 1 1 8 TYR H H 5.479 6.997 -2.338 1.00 . A A . 7 TYR H 1 1 17 5984 1 1 8 TYR HA H 4.337 9.641 -2.715 1.00 . A A . 7 TYR HA 1 1 17 5985 1 1 8 TYR HB2 H 6.478 10.673 -1.923 1.00 . A A . 7 TYR HB2 1 1 17 5986 1 1 8 TYR HB3 H 5.538 9.877 -0.664 1.00 . A A . 7 TYR HB3 1 1 17 5987 1 1 8 TYR HD1 H 6.137 7.179 -0.700 1.00 . A A . 7 TYR HD1 1 1 17 5988 1 1 8 TYR HD2 H 8.768 10.389 -1.602 1.00 . A A . 7 TYR HD2 1 1 17 5989 1 1 8 TYR HE1 H 8.012 5.762 -0.167 1.00 . A A . 7 TYR HE1 1 1 17 5990 1 1 8 TYR HE2 H 10.697 8.964 -1.037 1.00 . A A . 7 TYR HE2 1 1 17 5991 1 1 8 TYR HH H 10.437 5.602 -0.658 1.00 . A A . 7 TYR HH 1 1 17 5992 1 1 8 TYR N N 4.867 7.734 -2.180 1.00 . A A . 7 TYR N 1 1 17 5993 1 1 8 TYR O O 5.702 9.900 -4.826 1.00 . A A . 7 TYR O 1 1 17 5994 1 1 8 TYR OH O 10.552 6.461 -0.247 1.00 . A A . 7 TYR OH 1 1 17 5995 1 1 9 THR C C 7.450 6.730 -6.139 1.00 . A A . 8 THR C 1 1 17 5996 1 1 9 THR CA C 7.670 8.036 -5.382 1.00 . A A . 8 THR CA 1 1 17 5997 1 1 9 THR CB C 9.176 8.187 -5.099 1.00 . A A . 8 THR CB 1 1 17 5998 1 1 9 THR CG2 C 9.502 9.602 -4.644 1.00 . A A . 8 THR CG2 1 1 17 5999 1 1 9 THR H H 7.050 7.457 -3.435 1.00 . A A . 8 THR H 1 1 17 6000 1 1 9 THR HA H 7.365 8.855 -6.013 1.00 . A A . 8 THR HA 1 1 17 6001 1 1 9 THR HB H 9.719 7.984 -6.010 1.00 . A A . 8 THR HB 1 1 17 6002 1 1 9 THR HG1 H 9.092 6.428 -4.202 1.00 . A A . 8 THR HG1 1 1 17 6003 1 1 9 THR HG21 H 8.889 9.859 -3.794 1.00 . A A . 8 THR HG21 1 1 17 6004 1 1 9 THR HG22 H 9.307 10.293 -5.450 1.00 . A A . 8 THR HG22 1 1 17 6005 1 1 9 THR HG23 H 10.544 9.659 -4.367 1.00 . A A . 8 THR HG23 1 1 17 6006 1 1 9 THR N N 6.891 8.113 -4.144 1.00 . A A . 8 THR N 1 1 17 6007 1 1 9 THR O O 8.234 6.381 -7.023 1.00 . A A . 8 THR O 1 1 17 6008 1 1 9 THR OG1 O 9.583 7.249 -4.094 1.00 . A A . 8 THR OG1 1 1 17 6009 1 1 10 LEU C C 4.586 4.499 -6.489 1.00 . A A . 9 LEU C 1 1 17 6010 1 1 10 LEU CA C 6.079 4.752 -6.470 1.00 . A A . 9 LEU CA 1 1 17 6011 1 1 10 LEU CB C 6.801 3.596 -5.778 1.00 . A A . 9 LEU CB 1 1 17 6012 1 1 10 LEU CD1 C 8.939 2.413 -5.230 1.00 . A A . 9 LEU CD1 1 1 17 6013 1 1 10 LEU CD2 C 8.582 3.326 -7.527 1.00 . A A . 9 LEU CD2 1 1 17 6014 1 1 10 LEU CG C 8.307 3.527 -6.043 1.00 . A A . 9 LEU CG 1 1 17 6015 1 1 10 LEU H H 5.790 6.348 -5.101 1.00 . A A . 9 LEU H 1 1 17 6016 1 1 10 LEU HA H 6.424 4.823 -7.478 1.00 . A A . 9 LEU HA 1 1 17 6017 1 1 10 LEU HB2 H 6.647 3.688 -4.713 1.00 . A A . 9 LEU HB2 1 1 17 6018 1 1 10 LEU HB3 H 6.353 2.670 -6.110 1.00 . A A . 9 LEU HB3 1 1 17 6019 1 1 10 LEU HD11 H 9.999 2.375 -5.434 1.00 . A A . 9 LEU HD11 1 1 17 6020 1 1 10 LEU HD12 H 8.486 1.471 -5.500 1.00 . A A . 9 LEU HD12 1 1 17 6021 1 1 10 LEU HD13 H 8.781 2.602 -4.179 1.00 . A A . 9 LEU HD13 1 1 17 6022 1 1 10 LEU HD21 H 9.647 3.264 -7.690 1.00 . A A . 9 LEU HD21 1 1 17 6023 1 1 10 LEU HD22 H 8.181 4.160 -8.084 1.00 . A A . 9 LEU HD22 1 1 17 6024 1 1 10 LEU HD23 H 8.112 2.412 -7.859 1.00 . A A . 9 LEU HD23 1 1 17 6025 1 1 10 LEU HG H 8.762 4.459 -5.742 1.00 . A A . 9 LEU HG 1 1 17 6026 1 1 10 LEU N N 6.385 6.017 -5.805 1.00 . A A . 9 LEU N 1 1 17 6027 1 1 10 LEU O O 4.007 4.137 -7.513 1.00 . A A . 9 LEU O 1 1 17 6028 1 1 11 LEU C C 2.107 3.118 -5.591 1.00 . A A . 10 LEU C 1 1 17 6029 1 1 11 LEU CA C 2.546 4.514 -5.160 1.00 . A A . 10 LEU CA 1 1 17 6030 1 1 11 LEU CB C 1.791 5.591 -5.934 1.00 . A A . 10 LEU CB 1 1 17 6031 1 1 11 LEU CD1 C 1.452 8.046 -6.341 1.00 . A A . 10 LEU CD1 1 1 17 6032 1 1 11 LEU CD2 C 2.933 7.288 -4.463 1.00 . A A . 10 LEU CD2 1 1 17 6033 1 1 11 LEU CG C 2.434 6.982 -5.872 1.00 . A A . 10 LEU CG 1 1 17 6034 1 1 11 LEU H H 4.520 5.000 -4.585 1.00 . A A . 10 LEU H 1 1 17 6035 1 1 11 LEU HA H 2.333 4.631 -4.109 1.00 . A A . 10 LEU HA 1 1 17 6036 1 1 11 LEU HB2 H 1.730 5.289 -6.970 1.00 . A A . 10 LEU HB2 1 1 17 6037 1 1 11 LEU HB3 H 0.790 5.660 -5.536 1.00 . A A . 10 LEU HB3 1 1 17 6038 1 1 11 LEU HD11 H 1.921 9.017 -6.286 1.00 . A A . 10 LEU HD11 1 1 17 6039 1 1 11 LEU HD12 H 0.578 8.032 -5.708 1.00 . A A . 10 LEU HD12 1 1 17 6040 1 1 11 LEU HD13 H 1.161 7.843 -7.361 1.00 . A A . 10 LEU HD13 1 1 17 6041 1 1 11 LEU HD21 H 2.115 7.204 -3.764 1.00 . A A . 10 LEU HD21 1 1 17 6042 1 1 11 LEU HD22 H 3.332 8.291 -4.430 1.00 . A A . 10 LEU HD22 1 1 17 6043 1 1 11 LEU HD23 H 3.714 6.584 -4.189 1.00 . A A . 10 LEU HD23 1 1 17 6044 1 1 11 LEU HG H 3.286 7.003 -6.535 1.00 . A A . 10 LEU HG 1 1 17 6045 1 1 11 LEU N N 3.981 4.700 -5.339 1.00 . A A . 10 LEU N 1 1 17 6046 1 1 11 LEU O O 0.914 2.845 -5.729 1.00 . A A . 10 LEU O 1 1 17 6047 1 1 12 SER C C 3.166 -0.057 -5.024 1.00 . A A . 11 SER C 1 1 17 6048 1 1 12 SER CA C 2.816 0.865 -6.183 1.00 . A A . 11 SER CA 1 1 17 6049 1 1 12 SER CB C 3.628 0.487 -7.423 1.00 . A A . 11 SER CB 1 1 17 6050 1 1 12 SER H H 4.012 2.530 -5.680 1.00 . A A . 11 SER H 1 1 17 6051 1 1 12 SER HA H 1.762 0.775 -6.401 1.00 . A A . 11 SER HA 1 1 17 6052 1 1 12 SER HB2 H 3.361 1.144 -8.239 1.00 . A A . 11 SER HB2 1 1 17 6053 1 1 12 SER HB3 H 4.680 0.591 -7.208 1.00 . A A . 11 SER HB3 1 1 17 6054 1 1 12 SER HG H 3.909 -1.446 -7.288 1.00 . A A . 11 SER HG 1 1 17 6055 1 1 12 SER N N 3.084 2.242 -5.796 1.00 . A A . 11 SER N 1 1 17 6056 1 1 12 SER O O 2.935 -1.266 -5.075 1.00 . A A . 11 SER O 1 1 17 6057 1 1 12 SER OG O 3.372 -0.850 -7.814 1.00 . A A . 11 SER OG 1 1 17 6058 1 1 13 ARG C C 3.098 0.010 -1.676 1.00 . A A . 12 ARG C 1 1 17 6059 1 1 13 ARG CA C 4.123 -0.188 -2.783 1.00 . A A . 12 ARG CA 1 1 17 6060 1 1 13 ARG CB C 5.493 0.296 -2.308 1.00 . A A . 12 ARG CB 1 1 17 6061 1 1 13 ARG CD C 7.971 0.409 -2.708 1.00 . A A . 12 ARG CD 1 1 17 6062 1 1 13 ARG CG C 6.643 -0.146 -3.198 1.00 . A A . 12 ARG CG 1 1 17 6063 1 1 13 ARG CZ C 10.372 0.028 -3.091 1.00 . A A . 12 ARG CZ 1 1 17 6064 1 1 13 ARG H H 3.883 1.508 -4.015 1.00 . A A . 12 ARG H 1 1 17 6065 1 1 13 ARG HA H 4.177 -1.233 -3.029 1.00 . A A . 12 ARG HA 1 1 17 6066 1 1 13 ARG HB2 H 5.485 1.378 -2.279 1.00 . A A . 12 ARG HB2 1 1 17 6067 1 1 13 ARG HB3 H 5.670 -0.080 -1.312 1.00 . A A . 12 ARG HB3 1 1 17 6068 1 1 13 ARG HD2 H 7.966 1.484 -2.834 1.00 . A A . 12 ARG HD2 1 1 17 6069 1 1 13 ARG HD3 H 8.081 0.171 -1.661 1.00 . A A . 12 ARG HD3 1 1 17 6070 1 1 13 ARG HE H 8.905 -0.680 -4.244 1.00 . A A . 12 ARG HE 1 1 17 6071 1 1 13 ARG HG2 H 6.692 -1.224 -3.197 1.00 . A A . 12 ARG HG2 1 1 17 6072 1 1 13 ARG HG3 H 6.464 0.209 -4.203 1.00 . A A . 12 ARG HG3 1 1 17 6073 1 1 13 ARG HH11 H 11.628 0.875 -1.752 1.00 . A A . 12 ARG HH11 1 1 17 6074 1 1 13 ARG HH12 H 9.941 1.153 -1.467 1.00 . A A . 12 ARG HH12 1 1 17 6075 1 1 13 ARG HH21 H 11.123 -1.052 -4.625 1.00 . A A . 12 ARG HH21 1 1 17 6076 1 1 13 ARG HH22 H 12.298 -0.378 -3.546 1.00 . A A . 12 ARG HH22 1 1 17 6077 1 1 13 ARG N N 3.728 0.541 -3.978 1.00 . A A . 12 ARG N 1 1 17 6078 1 1 13 ARG NE N 9.102 -0.147 -3.445 1.00 . A A . 12 ARG NE 1 1 17 6079 1 1 13 ARG NH1 N 10.671 0.744 -2.015 1.00 . A A . 12 ARG NH1 1 1 17 6080 1 1 13 ARG NH2 N 11.344 -0.512 -3.813 1.00 . A A . 12 ARG NH2 1 1 17 6081 1 1 13 ARG O O 3.283 -0.449 -0.549 1.00 . A A . 12 ARG O 1 1 17 6082 1 1 14 VAL C C -0.146 -0.077 -1.163 1.00 . A A . 13 VAL C 1 1 17 6083 1 1 14 VAL CA C 0.956 0.975 -1.062 1.00 . A A . 13 VAL CA 1 1 17 6084 1 1 14 VAL CB C 0.369 2.381 -1.301 1.00 . A A . 13 VAL CB 1 1 17 6085 1 1 14 VAL CG1 C -0.227 2.937 -0.018 1.00 . A A . 13 VAL CG1 1 1 17 6086 1 1 14 VAL CG2 C 1.433 3.321 -1.850 1.00 . A A . 13 VAL CG2 1 1 17 6087 1 1 14 VAL H H 1.928 1.022 -2.930 1.00 . A A . 13 VAL H 1 1 17 6088 1 1 14 VAL HA H 1.376 0.947 -0.070 1.00 . A A . 13 VAL HA 1 1 17 6089 1 1 14 VAL HB H -0.419 2.302 -2.035 1.00 . A A . 13 VAL HB 1 1 17 6090 1 1 14 VAL HG11 H 0.554 3.047 0.721 1.00 . A A . 13 VAL HG11 1 1 17 6091 1 1 14 VAL HG12 H -0.981 2.258 0.352 1.00 . A A . 13 VAL HG12 1 1 17 6092 1 1 14 VAL HG13 H -0.673 3.899 -0.216 1.00 . A A . 13 VAL HG13 1 1 17 6093 1 1 14 VAL HG21 H 1.005 4.301 -2.001 1.00 . A A . 13 VAL HG21 1 1 17 6094 1 1 14 VAL HG22 H 1.799 2.938 -2.791 1.00 . A A . 13 VAL HG22 1 1 17 6095 1 1 14 VAL HG23 H 2.249 3.390 -1.147 1.00 . A A . 13 VAL HG23 1 1 17 6096 1 1 14 VAL N N 2.017 0.696 -2.013 1.00 . A A . 13 VAL N 1 1 17 6097 1 1 14 VAL O O 0.132 -1.275 -1.225 1.00 . A A . 13 VAL O 1 1 17 6098 1 1 15 ASN C C -3.341 -0.271 -2.536 1.00 . A A . 14 ASN C 1 1 17 6099 1 1 15 ASN CA C -2.535 -0.529 -1.267 1.00 . A A . 14 ASN CA 1 1 17 6100 1 1 15 ASN CB C -3.431 -0.378 -0.033 1.00 . A A . 14 ASN CB 1 1 17 6101 1 1 15 ASN CG C -3.675 1.073 0.345 1.00 . A A . 14 ASN CG 1 1 17 6102 1 1 15 ASN H H -1.547 1.336 -1.131 1.00 . A A . 14 ASN H 1 1 17 6103 1 1 15 ASN HA H -2.155 -1.538 -1.299 1.00 . A A . 14 ASN HA 1 1 17 6104 1 1 15 ASN HB2 H -4.384 -0.843 -0.233 1.00 . A A . 14 ASN HB2 1 1 17 6105 1 1 15 ASN HB3 H -2.962 -0.873 0.804 1.00 . A A . 14 ASN HB3 1 1 17 6106 1 1 15 ASN HD21 H -3.850 2.898 -0.422 1.00 . A A . 14 ASN HD21 1 1 17 6107 1 1 15 ASN HD22 H -3.549 1.633 -1.559 1.00 . A A . 14 ASN HD22 1 1 17 6108 1 1 15 ASN N N -1.392 0.374 -1.177 1.00 . A A . 14 ASN N 1 1 17 6109 1 1 15 ASN ND2 N -3.693 1.957 -0.646 1.00 . A A . 14 ASN ND2 1 1 17 6110 1 1 15 ASN O O -4.383 -0.890 -2.758 1.00 . A A . 14 ASN O 1 1 17 6111 1 1 15 ASN OD1 O -3.850 1.394 1.520 1.00 . A A . 14 ASN OD1 1 1 17 6112 1 1 16 ARG C C -3.178 -0.013 -5.711 1.00 . A A . 15 ARG C 1 1 17 6113 1 1 16 ARG CA C -3.528 0.986 -4.612 1.00 . A A . 15 ARG CA 1 1 17 6114 1 1 16 ARG CB C -3.149 2.401 -5.052 1.00 . A A . 15 ARG CB 1 1 17 6115 1 1 16 ARG CD C -3.143 4.860 -4.530 1.00 . A A . 15 ARG CD 1 1 17 6116 1 1 16 ARG CG C -3.557 3.476 -4.058 1.00 . A A . 15 ARG CG 1 1 17 6117 1 1 16 ARG CZ C -3.190 7.180 -3.711 1.00 . A A . 15 ARG CZ 1 1 17 6118 1 1 16 ARG H H -2.020 1.105 -3.133 1.00 . A A . 15 ARG H 1 1 17 6119 1 1 16 ARG HA H -4.593 0.947 -4.433 1.00 . A A . 15 ARG HA 1 1 17 6120 1 1 16 ARG HB2 H -2.078 2.451 -5.184 1.00 . A A . 15 ARG HB2 1 1 17 6121 1 1 16 ARG HB3 H -3.629 2.613 -5.996 1.00 . A A . 15 ARG HB3 1 1 17 6122 1 1 16 ARG HD2 H -2.070 4.878 -4.653 1.00 . A A . 15 ARG HD2 1 1 17 6123 1 1 16 ARG HD3 H -3.617 5.058 -5.481 1.00 . A A . 15 ARG HD3 1 1 17 6124 1 1 16 ARG HE H -4.071 5.633 -2.809 1.00 . A A . 15 ARG HE 1 1 17 6125 1 1 16 ARG HG2 H -4.631 3.453 -3.938 1.00 . A A . 15 ARG HG2 1 1 17 6126 1 1 16 ARG HG3 H -3.084 3.273 -3.109 1.00 . A A . 15 ARG HG3 1 1 17 6127 1 1 16 ARG HH11 H -2.162 6.909 -5.431 1.00 . A A . 15 ARG HH11 1 1 17 6128 1 1 16 ARG HH12 H -2.204 8.536 -4.841 1.00 . A A . 15 ARG HH12 1 1 17 6129 1 1 16 ARG HH21 H -4.131 7.774 -2.024 1.00 . A A . 15 ARG HH21 1 1 17 6130 1 1 16 ARG HH22 H -3.323 9.028 -2.904 1.00 . A A . 15 ARG HH22 1 1 17 6131 1 1 16 ARG N N -2.853 0.646 -3.365 1.00 . A A . 15 ARG N 1 1 17 6132 1 1 16 ARG NE N -3.530 5.901 -3.582 1.00 . A A . 15 ARG NE 1 1 17 6133 1 1 16 ARG NH1 N -2.458 7.573 -4.745 1.00 . A A . 15 ARG NH1 1 1 17 6134 1 1 16 ARG NH2 N -3.580 8.067 -2.806 1.00 . A A . 15 ARG NH2 1 1 17 6135 1 1 16 ARG O O -2.202 -0.756 -5.599 1.00 . A A . 15 ARG O 1 1 17 6136 1 1 17 HIS C C -4.230 -0.314 -9.199 1.00 . A A . 16 HIS C 1 1 17 6137 1 1 17 HIS CA C -3.757 -0.933 -7.888 1.00 . A A . 16 HIS CA 1 1 17 6138 1 1 17 HIS CB C -4.481 -2.259 -7.645 1.00 . A A . 16 HIS CB 1 1 17 6139 1 1 17 HIS CD2 C -6.989 -2.303 -8.309 1.00 . A A . 16 HIS CD2 1 1 17 6140 1 1 17 HIS CE1 C -7.840 -1.662 -6.393 1.00 . A A . 16 HIS CE1 1 1 17 6141 1 1 17 HIS CG C -5.959 -2.107 -7.452 1.00 . A A . 16 HIS CG 1 1 17 6142 1 1 17 HIS H H -4.741 0.593 -6.801 1.00 . A A . 16 HIS H 1 1 17 6143 1 1 17 HIS HA H -2.696 -1.121 -7.956 1.00 . A A . 16 HIS HA 1 1 17 6144 1 1 17 HIS HB2 H -4.322 -2.910 -8.491 1.00 . A A . 16 HIS HB2 1 1 17 6145 1 1 17 HIS HB3 H -4.077 -2.724 -6.758 1.00 . A A . 16 HIS HB3 1 1 17 6146 1 1 17 HIS HD1 H -6.038 -1.483 -5.439 1.00 . A A . 16 HIS HD1 1 1 17 6147 1 1 17 HIS HD2 H -6.913 -2.623 -9.340 1.00 . A A . 16 HIS HD2 1 1 17 6148 1 1 17 HIS HE1 H -8.544 -1.381 -5.624 1.00 . A A . 16 HIS HE1 1 1 17 6149 1 1 17 HIS HE2 H -9.053 -2.074 -7.992 1.00 . A A . 16 HIS HE2 1 1 17 6150 1 1 17 HIS N N -3.981 -0.024 -6.770 1.00 . A A . 16 HIS N 1 1 17 6151 1 1 17 HIS ND1 N -6.526 -1.705 -6.260 1.00 . A A . 16 HIS ND1 1 1 17 6152 1 1 17 HIS NE2 N -8.146 -2.020 -7.626 1.00 . A A . 16 HIS NE2 1 1 17 6153 1 1 17 HIS O O -5.241 0.388 -9.235 1.00 . A A . 16 HIS O 1 1 17 6154 1 1 18 SER C C -4.359 -1.154 -12.499 1.00 . A A . 17 SER C 1 1 17 6155 1 1 18 SER CA C -3.836 -0.049 -11.588 1.00 . A A . 17 SER CA 1 1 17 6156 1 1 18 SER CB C -2.618 0.619 -12.225 1.00 . A A . 17 SER CB 1 1 17 6157 1 1 18 SER H H -2.698 -1.144 -10.179 1.00 . A A . 17 SER H 1 1 17 6158 1 1 18 SER HA H -4.613 0.690 -11.455 1.00 . A A . 17 SER HA 1 1 17 6159 1 1 18 SER HB2 H -2.286 1.433 -11.597 1.00 . A A . 17 SER HB2 1 1 17 6160 1 1 18 SER HB3 H -1.823 -0.105 -12.325 1.00 . A A . 17 SER HB3 1 1 17 6161 1 1 18 SER HG H -2.126 1.208 -14.028 1.00 . A A . 17 SER HG 1 1 17 6162 1 1 18 SER N N -3.493 -0.579 -10.272 1.00 . A A . 17 SER N 1 1 17 6163 1 1 18 SER O O -3.840 -2.271 -12.497 1.00 . A A . 17 SER O 1 1 17 6164 1 1 18 SER OG O -2.930 1.133 -13.509 1.00 . A A . 17 SER OG 1 1 17 6165 1 1 19 THR C C -5.097 -2.012 -15.418 1.00 . A A . 18 THR C 1 1 17 6166 1 1 19 THR CA C -5.982 -1.803 -14.193 1.00 . A A . 18 THR CA 1 1 17 6167 1 1 19 THR CB C -7.382 -1.355 -14.654 1.00 . A A . 18 THR CB 1 1 17 6168 1 1 19 THR CG2 C -8.024 -2.407 -15.546 1.00 . A A . 18 THR CG2 1 1 17 6169 1 1 19 THR H H -5.759 0.070 -13.232 1.00 . A A . 18 THR H 1 1 17 6170 1 1 19 THR HA H -6.082 -2.743 -13.668 1.00 . A A . 18 THR HA 1 1 17 6171 1 1 19 THR HB H -7.283 -0.438 -15.218 1.00 . A A . 18 THR HB 1 1 17 6172 1 1 19 THR HG1 H -8.569 -1.951 -13.195 1.00 . A A . 18 THR HG1 1 1 17 6173 1 1 19 THR HG21 H -7.395 -2.580 -16.408 1.00 . A A . 18 THR HG21 1 1 17 6174 1 1 19 THR HG22 H -8.993 -2.061 -15.872 1.00 . A A . 18 THR HG22 1 1 17 6175 1 1 19 THR HG23 H -8.137 -3.328 -14.993 1.00 . A A . 18 THR HG23 1 1 17 6176 1 1 19 THR N N -5.389 -0.837 -13.277 1.00 . A A . 18 THR N 1 1 17 6177 1 1 19 THR O O -4.955 -1.118 -16.253 1.00 . A A . 18 THR O 1 1 17 6178 1 1 19 THR OG1 O -8.220 -1.116 -13.516 1.00 . A A . 18 THR OG1 1 1 17 6179 1 1 20 ALA C C -4.395 -4.262 -17.729 1.00 . A A . 19 ALA C 1 1 17 6180 1 1 20 ALA CA C -3.629 -3.523 -16.637 1.00 . A A . 19 ALA CA 1 1 17 6181 1 1 20 ALA CB C -2.449 -4.356 -16.161 1.00 . A A . 19 ALA CB 1 1 17 6182 1 1 20 ALA H H -4.651 -3.865 -14.816 1.00 . A A . 19 ALA H 1 1 17 6183 1 1 20 ALA HA H -3.246 -2.597 -17.043 1.00 . A A . 19 ALA HA 1 1 17 6184 1 1 20 ALA HB1 H -1.919 -3.820 -15.387 1.00 . A A . 19 ALA HB1 1 1 17 6185 1 1 20 ALA HB2 H -1.782 -4.541 -16.991 1.00 . A A . 19 ALA HB2 1 1 17 6186 1 1 20 ALA HB3 H -2.807 -5.296 -15.769 1.00 . A A . 19 ALA HB3 1 1 17 6187 1 1 20 ALA N N -4.500 -3.196 -15.516 1.00 . A A . 19 ALA N 1 1 17 6188 1 1 20 ALA O O -5.040 -5.277 -17.470 1.00 . A A . 19 ALA O 1 1 17 6189 1 1 21 ILE C C -4.065 -5.273 -20.865 1.00 . A A . 20 ILE C 1 1 17 6190 1 1 21 ILE CA C -5.003 -4.356 -20.084 1.00 . A A . 20 ILE CA 1 1 17 6191 1 1 21 ILE CB C -5.577 -3.286 -21.037 1.00 . A A . 20 ILE CB 1 1 17 6192 1 1 21 ILE CD1 C -7.530 -4.742 -21.790 1.00 . A A . 20 ILE CD1 1 1 17 6193 1 1 21 ILE CG1 C -6.313 -3.945 -22.208 1.00 . A A . 20 ILE CG1 1 1 17 6194 1 1 21 ILE CG2 C -4.469 -2.376 -21.547 1.00 . A A . 20 ILE CG2 1 1 17 6195 1 1 21 ILE H H -3.786 -2.934 -19.096 1.00 . A A . 20 ILE H 1 1 17 6196 1 1 21 ILE HA H -5.824 -4.943 -19.699 1.00 . A A . 20 ILE HA 1 1 17 6197 1 1 21 ILE HB H -6.276 -2.681 -20.479 1.00 . A A . 20 ILE HB 1 1 17 6198 1 1 21 ILE HD11 H -7.232 -5.524 -21.108 1.00 . A A . 20 ILE HD11 1 1 17 6199 1 1 21 ILE HD12 H -7.990 -5.182 -22.663 1.00 . A A . 20 ILE HD12 1 1 17 6200 1 1 21 ILE HD13 H -8.238 -4.089 -21.301 1.00 . A A . 20 ILE HD13 1 1 17 6201 1 1 21 ILE HG12 H -6.640 -3.180 -22.896 1.00 . A A . 20 ILE HG12 1 1 17 6202 1 1 21 ILE HG13 H -5.637 -4.615 -22.717 1.00 . A A . 20 ILE HG13 1 1 17 6203 1 1 21 ILE HG21 H -3.995 -1.884 -20.711 1.00 . A A . 20 ILE HG21 1 1 17 6204 1 1 21 ILE HG22 H -4.888 -1.635 -22.211 1.00 . A A . 20 ILE HG22 1 1 17 6205 1 1 21 ILE HG23 H -3.737 -2.965 -22.080 1.00 . A A . 20 ILE HG23 1 1 17 6206 1 1 21 ILE N N -4.317 -3.745 -18.952 1.00 . A A . 20 ILE N 1 1 17 6207 1 1 21 ILE O O -2.894 -4.952 -21.069 1.00 . A A . 20 ILE O 1 1 17 6208 1 1 22 GLY C C -3.852 -7.118 -23.542 1.00 . A A . 21 GLY C 1 1 17 6209 1 1 22 GLY CA C -3.786 -7.365 -22.048 1.00 . A A . 21 GLY CA 1 1 17 6210 1 1 22 GLY H H -5.526 -6.620 -21.098 1.00 . A A . 21 GLY H 1 1 17 6211 1 1 22 GLY HA2 H -2.759 -7.284 -21.725 1.00 . A A . 21 GLY HA2 1 1 17 6212 1 1 22 GLY HA3 H -4.140 -8.363 -21.842 1.00 . A A . 21 GLY HA3 1 1 17 6213 1 1 22 GLY N N -4.588 -6.417 -21.295 1.00 . A A . 21 GLY N 1 1 17 6214 1 1 22 GLY O O -4.930 -6.899 -24.095 1.00 . A A . 21 GLY O 1 1 17 6215 1 1 23 ARG C C -2.734 -8.255 -26.395 1.00 . A A . 22 ARG C 1 1 17 6216 1 1 23 ARG CA C -2.625 -6.936 -25.637 1.00 . A A . 22 ARG CA 1 1 17 6217 1 1 23 ARG CB C -1.317 -6.229 -26.001 1.00 . A A . 22 ARG CB 1 1 17 6218 1 1 23 ARG CD C -2.197 -3.891 -25.693 1.00 . A A . 22 ARG CD 1 1 17 6219 1 1 23 ARG CG C -1.126 -4.895 -25.296 1.00 . A A . 22 ARG CG 1 1 17 6220 1 1 23 ARG CZ C -3.029 -2.778 -27.723 1.00 . A A . 22 ARG CZ 1 1 17 6221 1 1 23 ARG H H -1.871 -7.338 -23.700 1.00 . A A . 22 ARG H 1 1 17 6222 1 1 23 ARG HA H -3.455 -6.305 -25.916 1.00 . A A . 22 ARG HA 1 1 17 6223 1 1 23 ARG HB2 H -0.489 -6.871 -25.741 1.00 . A A . 22 ARG HB2 1 1 17 6224 1 1 23 ARG HB3 H -1.302 -6.052 -27.068 1.00 . A A . 22 ARG HB3 1 1 17 6225 1 1 23 ARG HD2 H -3.163 -4.285 -25.413 1.00 . A A . 22 ARG HD2 1 1 17 6226 1 1 23 ARG HD3 H -2.020 -2.967 -25.163 1.00 . A A . 22 ARG HD3 1 1 17 6227 1 1 23 ARG HE H -1.532 -4.096 -27.676 1.00 . A A . 22 ARG HE 1 1 17 6228 1 1 23 ARG HG2 H -1.173 -5.054 -24.229 1.00 . A A . 22 ARG HG2 1 1 17 6229 1 1 23 ARG HG3 H -0.157 -4.495 -25.560 1.00 . A A . 22 ARG HG3 1 1 17 6230 1 1 23 ARG HH11 H -4.563 -1.487 -27.460 1.00 . A A . 22 ARG HH11 1 1 17 6231 1 1 23 ARG HH12 H -3.989 -2.261 -26.020 1.00 . A A . 22 ARG HH12 1 1 17 6232 1 1 23 ARG HH21 H -3.591 -1.953 -29.480 1.00 . A A . 22 ARG HH21 1 1 17 6233 1 1 23 ARG HH22 H -2.281 -3.081 -29.576 1.00 . A A . 22 ARG HH22 1 1 17 6234 1 1 23 ARG N N -2.695 -7.156 -24.197 1.00 . A A . 22 ARG N 1 1 17 6235 1 1 23 ARG NE N -2.192 -3.622 -27.128 1.00 . A A . 22 ARG NE 1 1 17 6236 1 1 23 ARG NH1 N -3.935 -2.121 -27.009 1.00 . A A . 22 ARG NH1 1 1 17 6237 1 1 23 ARG NH2 N -2.962 -2.589 -29.033 1.00 . A A . 22 ARG NH2 1 1 17 6238 1 1 23 ARG O O -1.684 -8.894 -26.624 1.00 . A A . 22 ARG O 1 1 17 6239 1 1 23 ARG OXT O -3.867 -8.639 -26.754 1.00 . A A . 22 ARG OXT 1 1 18 6240 1 1 1 ACE C C 3.269 1.930 11.368 1.00 . A A . 0 ACE C 1 1 18 6241 1 1 1 ACE CH3 C 3.173 1.128 12.637 1.00 . A A . 0 ACE CH3 1 1 18 6242 1 1 1 ACE H1 H 3.647 0.164 12.476 1.00 . A A . 0 ACE H1 1 1 18 6243 1 1 1 ACE H2 H 2.141 0.979 12.890 1.00 . A A . 0 ACE H2 1 1 18 6244 1 1 1 ACE H3 H 3.666 1.676 13.433 1.00 . A A . 0 ACE H3 1 1 18 6245 1 1 1 ACE O O 2.425 2.785 11.096 1.00 . A A . 0 ACE O 1 1 18 6246 1 1 2 MET C C 4.885 1.393 8.204 1.00 . A A . 1 MET C 1 1 18 6247 1 1 2 MET CA C 4.511 2.364 9.319 1.00 . A A . 1 MET CA 1 1 18 6248 1 1 2 MET CB C 5.605 3.421 9.476 1.00 . A A . 1 MET CB 1 1 18 6249 1 1 2 MET CE C 5.826 6.873 11.813 1.00 . A A . 1 MET CE 1 1 18 6250 1 1 2 MET CG C 5.253 4.523 10.461 1.00 . A A . 1 MET CG 1 1 18 6251 1 1 2 MET H H 4.941 0.965 10.848 1.00 . A A . 1 MET H 1 1 18 6252 1 1 2 MET HA H 3.585 2.854 9.058 1.00 . A A . 1 MET HA 1 1 18 6253 1 1 2 MET HB2 H 6.509 2.938 9.818 1.00 . A A . 1 MET HB2 1 1 18 6254 1 1 2 MET HB3 H 5.792 3.874 8.514 1.00 . A A . 1 MET HB3 1 1 18 6255 1 1 2 MET HE1 H 4.905 7.265 11.405 1.00 . A A . 1 MET HE1 1 1 18 6256 1 1 2 MET HE2 H 6.507 7.687 12.010 1.00 . A A . 1 MET HE2 1 1 18 6257 1 1 2 MET HE3 H 5.616 6.348 12.733 1.00 . A A . 1 MET HE3 1 1 18 6258 1 1 2 MET HG2 H 4.360 5.024 10.116 1.00 . A A . 1 MET HG2 1 1 18 6259 1 1 2 MET HG3 H 5.064 4.077 11.427 1.00 . A A . 1 MET HG3 1 1 18 6260 1 1 2 MET N N 4.303 1.658 10.578 1.00 . A A . 1 MET N 1 1 18 6261 1 1 2 MET O O 6.001 0.874 8.170 1.00 . A A . 1 MET O 1 1 18 6262 1 1 2 MET SD S 6.567 5.745 10.636 1.00 . A A . 1 MET SD 1 1 18 6263 1 1 3 ASN C C 4.260 1.005 4.865 1.00 . A A . 2 ASN C 1 1 18 6264 1 1 3 ASN CA C 4.179 0.244 6.178 1.00 . A A . 2 ASN CA 1 1 18 6265 1 1 3 ASN CB C 3.061 -0.797 6.079 1.00 . A A . 2 ASN CB 1 1 18 6266 1 1 3 ASN CG C 3.225 -1.705 4.870 1.00 . A A . 2 ASN CG 1 1 18 6267 1 1 3 ASN H H 3.073 1.591 7.380 1.00 . A A . 2 ASN H 1 1 18 6268 1 1 3 ASN HA H 5.117 -0.263 6.349 1.00 . A A . 2 ASN HA 1 1 18 6269 1 1 3 ASN HB2 H 3.066 -1.409 6.969 1.00 . A A . 2 ASN HB2 1 1 18 6270 1 1 3 ASN HB3 H 2.111 -0.290 6.000 1.00 . A A . 2 ASN HB3 1 1 18 6271 1 1 3 ASN HD21 H 3.047 -1.738 2.885 1.00 . A A . 2 ASN HD21 1 1 18 6272 1 1 3 ASN HD22 H 2.665 -0.234 3.644 1.00 . A A . 2 ASN HD22 1 1 18 6273 1 1 3 ASN N N 3.944 1.150 7.297 1.00 . A A . 2 ASN N 1 1 18 6274 1 1 3 ASN ND2 N 2.949 -1.173 3.679 1.00 . A A . 2 ASN ND2 1 1 18 6275 1 1 3 ASN O O 4.803 0.496 3.884 1.00 . A A . 2 ASN O 1 1 18 6276 1 1 3 ASN OD1 O 3.612 -2.866 5.002 1.00 . A A . 2 ASN OD1 1 1 18 6277 1 1 4 TRP C C 4.960 2.810 2.816 1.00 . A A . 3 TRP C 1 1 18 6278 1 1 4 TRP CA C 3.715 3.041 3.654 1.00 . A A . 3 TRP CA 1 1 18 6279 1 1 4 TRP CB C 3.548 4.523 4.000 1.00 . A A . 3 TRP CB 1 1 18 6280 1 1 4 TRP CD1 C 4.515 4.924 6.340 1.00 . A A . 3 TRP CD1 1 1 18 6281 1 1 4 TRP CD2 C 5.705 5.815 4.682 1.00 . A A . 3 TRP CD2 1 1 18 6282 1 1 4 TRP CE2 C 6.336 6.132 5.894 1.00 . A A . 3 TRP CE2 1 1 18 6283 1 1 4 TRP CE3 C 6.264 6.256 3.493 1.00 . A A . 3 TRP CE3 1 1 18 6284 1 1 4 TRP CG C 4.542 5.055 4.987 1.00 . A A . 3 TRP CG 1 1 18 6285 1 1 4 TRP CH2 C 8.040 7.305 4.757 1.00 . A A . 3 TRP CH2 1 1 18 6286 1 1 4 TRP CZ2 C 7.508 6.880 5.945 1.00 . A A . 3 TRP CZ2 1 1 18 6287 1 1 4 TRP CZ3 C 7.429 6.996 3.536 1.00 . A A . 3 TRP CZ3 1 1 18 6288 1 1 4 TRP H H 3.354 2.594 5.680 1.00 . A A . 3 TRP H 1 1 18 6289 1 1 4 TRP HA H 2.866 2.739 3.067 1.00 . A A . 3 TRP HA 1 1 18 6290 1 1 4 TRP HB2 H 3.643 5.103 3.095 1.00 . A A . 3 TRP HB2 1 1 18 6291 1 1 4 TRP HB3 H 2.562 4.674 4.413 1.00 . A A . 3 TRP HB3 1 1 18 6292 1 1 4 TRP HD1 H 3.756 4.389 6.876 1.00 . A A . 3 TRP HD1 1 1 18 6293 1 1 4 TRP HE1 H 5.786 5.634 7.857 1.00 . A A . 3 TRP HE1 1 1 18 6294 1 1 4 TRP HE3 H 5.801 6.013 2.549 1.00 . A A . 3 TRP HE3 1 1 18 6295 1 1 4 TRP HH2 H 8.949 7.887 4.748 1.00 . A A . 3 TRP HH2 1 1 18 6296 1 1 4 TRP HZ2 H 7.987 7.126 6.877 1.00 . A A . 3 TRP HZ2 1 1 18 6297 1 1 4 TRP HZ3 H 7.878 7.348 2.620 1.00 . A A . 3 TRP HZ3 1 1 18 6298 1 1 4 TRP N N 3.728 2.227 4.855 1.00 . A A . 3 TRP N 1 1 18 6299 1 1 4 TRP NE1 N 5.588 5.577 6.899 1.00 . A A . 3 TRP NE1 1 1 18 6300 1 1 4 TRP O O 4.883 2.165 1.770 1.00 . A A . 3 TRP O 1 1 18 6301 1 1 5 THR C C 7.156 2.988 1.104 1.00 . A A . 4 THR C 1 1 18 6302 1 1 5 THR CA C 7.373 3.163 2.607 1.00 . A A . 4 THR CA 1 1 18 6303 1 1 5 THR CB C 8.197 1.979 3.152 1.00 . A A . 4 THR CB 1 1 18 6304 1 1 5 THR CG2 C 9.648 2.072 2.703 1.00 . A A . 4 THR CG2 1 1 18 6305 1 1 5 THR H H 6.091 3.720 4.182 1.00 . A A . 4 THR H 1 1 18 6306 1 1 5 THR HA H 7.925 4.072 2.785 1.00 . A A . 4 THR HA 1 1 18 6307 1 1 5 THR HB H 7.775 1.059 2.774 1.00 . A A . 4 THR HB 1 1 18 6308 1 1 5 THR HG1 H 8.065 2.870 4.907 1.00 . A A . 4 THR HG1 1 1 18 6309 1 1 5 THR HG21 H 10.204 1.240 3.109 1.00 . A A . 4 THR HG21 1 1 18 6310 1 1 5 THR HG22 H 10.077 2.997 3.057 1.00 . A A . 4 THR HG22 1 1 18 6311 1 1 5 THR HG23 H 9.694 2.044 1.625 1.00 . A A . 4 THR HG23 1 1 18 6312 1 1 5 THR N N 6.101 3.287 3.308 1.00 . A A . 4 THR N 1 1 18 6313 1 1 5 THR O O 7.842 2.203 0.449 1.00 . A A . 4 THR O 1 1 18 6314 1 1 5 THR OG1 O 8.143 1.970 4.583 1.00 . A A . 4 THR OG1 1 1 18 6315 1 1 6 GLY C C 4.881 4.673 -1.311 1.00 . A A . 5 GLY C 1 1 18 6316 1 1 6 GLY CA C 5.879 3.627 -0.845 1.00 . A A . 5 GLY CA 1 1 18 6317 1 1 6 GLY H H 5.694 4.359 1.129 1.00 . A A . 5 GLY H 1 1 18 6318 1 1 6 GLY HA2 H 6.788 3.730 -1.415 1.00 . A A . 5 GLY HA2 1 1 18 6319 1 1 6 GLY HA3 H 5.461 2.644 -1.025 1.00 . A A . 5 GLY HA3 1 1 18 6320 1 1 6 GLY N N 6.193 3.733 0.564 1.00 . A A . 5 GLY N 1 1 18 6321 1 1 6 GLY O O 4.110 4.428 -2.235 1.00 . A A . 5 GLY O 1 1 18 6322 1 1 7 LEU C C 4.715 8.103 -1.632 1.00 . A A . 6 LEU C 1 1 18 6323 1 1 7 LEU CA C 3.971 6.918 -1.027 1.00 . A A . 6 LEU CA 1 1 18 6324 1 1 7 LEU CB C 3.193 7.379 0.196 1.00 . A A . 6 LEU CB 1 1 18 6325 1 1 7 LEU CD1 C 4.983 8.678 1.403 1.00 . A A . 6 LEU CD1 1 1 18 6326 1 1 7 LEU CD2 C 3.120 7.631 2.692 1.00 . A A . 6 LEU CD2 1 1 18 6327 1 1 7 LEU CG C 4.021 7.501 1.478 1.00 . A A . 6 LEU CG 1 1 18 6328 1 1 7 LEU H H 5.501 5.960 0.086 1.00 . A A . 6 LEU H 1 1 18 6329 1 1 7 LEU HA H 3.276 6.534 -1.758 1.00 . A A . 6 LEU HA 1 1 18 6330 1 1 7 LEU HB2 H 2.764 8.343 -0.025 1.00 . A A . 6 LEU HB2 1 1 18 6331 1 1 7 LEU HB3 H 2.393 6.677 0.369 1.00 . A A . 6 LEU HB3 1 1 18 6332 1 1 7 LEU HD11 H 4.427 9.587 1.232 1.00 . A A . 6 LEU HD11 1 1 18 6333 1 1 7 LEU HD12 H 5.679 8.523 0.593 1.00 . A A . 6 LEU HD12 1 1 18 6334 1 1 7 LEU HD13 H 5.526 8.757 2.335 1.00 . A A . 6 LEU HD13 1 1 18 6335 1 1 7 LEU HD21 H 2.471 6.771 2.752 1.00 . A A . 6 LEU HD21 1 1 18 6336 1 1 7 LEU HD22 H 2.525 8.527 2.603 1.00 . A A . 6 LEU HD22 1 1 18 6337 1 1 7 LEU HD23 H 3.728 7.687 3.584 1.00 . A A . 6 LEU HD23 1 1 18 6338 1 1 7 LEU HG H 4.606 6.603 1.598 1.00 . A A . 6 LEU HG 1 1 18 6339 1 1 7 LEU N N 4.883 5.834 -0.663 1.00 . A A . 6 LEU N 1 1 18 6340 1 1 7 LEU O O 4.203 9.223 -1.667 1.00 . A A . 6 LEU O 1 1 18 6341 1 1 8 TYR C C 7.201 8.470 -4.113 1.00 . A A . 7 TYR C 1 1 18 6342 1 1 8 TYR CA C 6.750 8.875 -2.714 1.00 . A A . 7 TYR CA 1 1 18 6343 1 1 8 TYR CB C 7.969 9.157 -1.833 1.00 . A A . 7 TYR CB 1 1 18 6344 1 1 8 TYR CD1 C 7.921 7.018 -0.539 1.00 . A A . 7 TYR CD1 1 1 18 6345 1 1 8 TYR CD2 C 9.949 7.595 -1.639 1.00 . A A . 7 TYR CD2 1 1 18 6346 1 1 8 TYR CE1 C 8.485 5.864 -0.079 1.00 . A A . 7 TYR CE1 1 1 18 6347 1 1 8 TYR CE2 C 10.533 6.431 -1.175 1.00 . A A . 7 TYR CE2 1 1 18 6348 1 1 8 TYR CG C 8.631 7.904 -1.325 1.00 . A A . 7 TYR CG 1 1 18 6349 1 1 8 TYR CZ C 9.794 5.566 -0.394 1.00 . A A . 7 TYR CZ 1 1 18 6350 1 1 8 TYR H H 6.260 6.934 -2.043 1.00 . A A . 7 TYR H 1 1 18 6351 1 1 8 TYR HA H 6.158 9.764 -2.781 1.00 . A A . 7 TYR HA 1 1 18 6352 1 1 8 TYR HB2 H 8.697 9.714 -2.402 1.00 . A A . 7 TYR HB2 1 1 18 6353 1 1 8 TYR HB3 H 7.658 9.739 -0.979 1.00 . A A . 7 TYR HB3 1 1 18 6354 1 1 8 TYR HD1 H 6.897 7.249 -0.287 1.00 . A A . 7 TYR HD1 1 1 18 6355 1 1 8 TYR HD2 H 10.518 8.280 -2.251 1.00 . A A . 7 TYR HD2 1 1 18 6356 1 1 8 TYR HE1 H 7.895 5.201 0.519 1.00 . A A . 7 TYR HE1 1 1 18 6357 1 1 8 TYR HE2 H 11.558 6.203 -1.425 1.00 . A A . 7 TYR HE2 1 1 18 6358 1 1 8 TYR HH H 9.746 3.675 -0.046 1.00 . A A . 7 TYR HH 1 1 18 6359 1 1 8 TYR N N 5.917 7.843 -2.109 1.00 . A A . 7 TYR N 1 1 18 6360 1 1 8 TYR O O 7.249 9.298 -5.024 1.00 . A A . 7 TYR O 1 1 18 6361 1 1 8 TYR OH O 10.363 4.402 0.069 1.00 . A A . 7 TYR OH 1 1 18 6362 1 1 9 THR C C 7.463 5.270 -5.816 1.00 . A A . 8 THR C 1 1 18 6363 1 1 9 THR CA C 7.983 6.680 -5.567 1.00 . A A . 8 THR CA 1 1 18 6364 1 1 9 THR CB C 9.519 6.663 -5.658 1.00 . A A . 8 THR CB 1 1 18 6365 1 1 9 THR CG2 C 10.083 8.076 -5.633 1.00 . A A . 8 THR CG2 1 1 18 6366 1 1 9 THR H H 7.471 6.581 -3.515 1.00 . A A . 8 THR H 1 1 18 6367 1 1 9 THR HA H 7.603 7.333 -6.337 1.00 . A A . 8 THR HA 1 1 18 6368 1 1 9 THR HB H 9.805 6.194 -6.589 1.00 . A A . 8 THR HB 1 1 18 6369 1 1 9 THR HG1 H 9.380 5.343 -4.201 1.00 . A A . 8 THR HG1 1 1 18 6370 1 1 9 THR HG21 H 9.788 8.564 -4.715 1.00 . A A . 8 THR HG21 1 1 18 6371 1 1 9 THR HG22 H 9.699 8.632 -6.476 1.00 . A A . 8 THR HG22 1 1 18 6372 1 1 9 THR HG23 H 11.160 8.035 -5.690 1.00 . A A . 8 THR HG23 1 1 18 6373 1 1 9 THR N N 7.532 7.193 -4.278 1.00 . A A . 8 THR N 1 1 18 6374 1 1 9 THR O O 7.937 4.573 -6.712 1.00 . A A . 8 THR O 1 1 18 6375 1 1 9 THR OG1 O 10.063 5.907 -4.570 1.00 . A A . 8 THR OG1 1 1 18 6376 1 1 10 LEU C C 4.401 3.553 -4.894 1.00 . A A . 9 LEU C 1 1 18 6377 1 1 10 LEU CA C 5.903 3.527 -5.154 1.00 . A A . 9 LEU CA 1 1 18 6378 1 1 10 LEU CB C 6.588 2.554 -4.197 1.00 . A A . 9 LEU CB 1 1 18 6379 1 1 10 LEU CD1 C 8.700 1.516 -3.348 1.00 . A A . 9 LEU CD1 1 1 18 6380 1 1 10 LEU CD2 C 8.272 1.623 -5.807 1.00 . A A . 9 LEU CD2 1 1 18 6381 1 1 10 LEU CG C 8.075 2.323 -4.471 1.00 . A A . 9 LEU CG 1 1 18 6382 1 1 10 LEU H H 6.139 5.466 -4.334 1.00 . A A . 9 LEU H 1 1 18 6383 1 1 10 LEU HA H 6.072 3.197 -6.164 1.00 . A A . 9 LEU HA 1 1 18 6384 1 1 10 LEU HB2 H 6.483 2.935 -3.193 1.00 . A A . 9 LEU HB2 1 1 18 6385 1 1 10 LEU HB3 H 6.080 1.603 -4.258 1.00 . A A . 9 LEU HB3 1 1 18 6386 1 1 10 LEU HD11 H 8.206 0.559 -3.277 1.00 . A A . 9 LEU HD11 1 1 18 6387 1 1 10 LEU HD12 H 8.587 2.051 -2.417 1.00 . A A . 9 LEU HD12 1 1 18 6388 1 1 10 LEU HD13 H 9.749 1.367 -3.554 1.00 . A A . 9 LEU HD13 1 1 18 6389 1 1 10 LEU HD21 H 7.753 0.676 -5.797 1.00 . A A . 9 LEU HD21 1 1 18 6390 1 1 10 LEU HD22 H 9.326 1.455 -5.973 1.00 . A A . 9 LEU HD22 1 1 18 6391 1 1 10 LEU HD23 H 7.878 2.242 -6.599 1.00 . A A . 9 LEU HD23 1 1 18 6392 1 1 10 LEU HG H 8.578 3.277 -4.516 1.00 . A A . 9 LEU HG 1 1 18 6393 1 1 10 LEU N N 6.483 4.859 -5.021 1.00 . A A . 9 LEU N 1 1 18 6394 1 1 10 LEU O O 3.772 2.508 -4.734 1.00 . A A . 9 LEU O 1 1 18 6395 1 1 11 LEU C C 1.574 3.945 -5.379 1.00 . A A . 10 LEU C 1 1 18 6396 1 1 11 LEU CA C 2.416 4.960 -4.614 1.00 . A A . 10 LEU CA 1 1 18 6397 1 1 11 LEU CB C 2.010 6.375 -5.031 1.00 . A A . 10 LEU CB 1 1 18 6398 1 1 11 LEU CD1 C 4.132 7.649 -4.569 1.00 . A A . 10 LEU CD1 1 1 18 6399 1 1 11 LEU CD2 C 1.926 8.822 -4.489 1.00 . A A . 10 LEU CD2 1 1 18 6400 1 1 11 LEU CG C 2.653 7.511 -4.231 1.00 . A A . 10 LEU CG 1 1 18 6401 1 1 11 LEU H H 4.420 5.541 -4.949 1.00 . A A . 10 LEU H 1 1 18 6402 1 1 11 LEU HA H 2.231 4.841 -3.559 1.00 . A A . 10 LEU HA 1 1 18 6403 1 1 11 LEU HB2 H 2.269 6.505 -6.071 1.00 . A A . 10 LEU HB2 1 1 18 6404 1 1 11 LEU HB3 H 0.938 6.459 -4.935 1.00 . A A . 10 LEU HB3 1 1 18 6405 1 1 11 LEU HD11 H 4.713 7.009 -3.915 1.00 . A A . 10 LEU HD11 1 1 18 6406 1 1 11 LEU HD12 H 4.438 8.675 -4.430 1.00 . A A . 10 LEU HD12 1 1 18 6407 1 1 11 LEU HD13 H 4.296 7.359 -5.596 1.00 . A A . 10 LEU HD13 1 1 18 6408 1 1 11 LEU HD21 H 0.893 8.726 -4.187 1.00 . A A . 10 LEU HD21 1 1 18 6409 1 1 11 LEU HD22 H 1.973 9.058 -5.541 1.00 . A A . 10 LEU HD22 1 1 18 6410 1 1 11 LEU HD23 H 2.395 9.612 -3.921 1.00 . A A . 10 LEU HD23 1 1 18 6411 1 1 11 LEU HG H 2.574 7.287 -3.179 1.00 . A A . 10 LEU HG 1 1 18 6412 1 1 11 LEU N N 3.846 4.759 -4.844 1.00 . A A . 10 LEU N 1 1 18 6413 1 1 11 LEU O O 0.985 3.040 -4.790 1.00 . A A . 10 LEU O 1 1 18 6414 1 1 12 SER C C 1.548 1.947 -7.857 1.00 . A A . 11 SER C 1 1 18 6415 1 1 12 SER CA C 0.746 3.205 -7.543 1.00 . A A . 11 SER CA 1 1 18 6416 1 1 12 SER CB C 0.347 3.910 -8.842 1.00 . A A . 11 SER CB 1 1 18 6417 1 1 12 SER H H 2.001 4.854 -7.105 1.00 . A A . 11 SER H 1 1 18 6418 1 1 12 SER HA H -0.147 2.926 -7.006 1.00 . A A . 11 SER HA 1 1 18 6419 1 1 12 SER HB2 H -0.218 4.800 -8.607 1.00 . A A . 11 SER HB2 1 1 18 6420 1 1 12 SER HB3 H 1.238 4.183 -9.389 1.00 . A A . 11 SER HB3 1 1 18 6421 1 1 12 SER HG H -1.126 2.649 -9.122 1.00 . A A . 11 SER HG 1 1 18 6422 1 1 12 SER N N 1.515 4.108 -6.695 1.00 . A A . 11 SER N 1 1 18 6423 1 1 12 SER O O 1.214 1.197 -8.773 1.00 . A A . 11 SER O 1 1 18 6424 1 1 12 SER OG O -0.448 3.068 -9.658 1.00 . A A . 11 SER OG 1 1 18 6425 1 1 13 ARG C C 3.374 -0.402 -6.097 1.00 . A A . 12 ARG C 1 1 18 6426 1 1 13 ARG CA C 3.460 0.557 -7.278 1.00 . A A . 12 ARG CA 1 1 18 6427 1 1 13 ARG CB C 4.909 0.997 -7.495 1.00 . A A . 12 ARG CB 1 1 18 6428 1 1 13 ARG CD C 6.547 2.312 -8.876 1.00 . A A . 12 ARG CD 1 1 18 6429 1 1 13 ARG CG C 5.102 1.863 -8.729 1.00 . A A . 12 ARG CG 1 1 18 6430 1 1 13 ARG CZ C 8.770 1.309 -9.204 1.00 . A A . 12 ARG CZ 1 1 18 6431 1 1 13 ARG H H 2.815 2.352 -6.365 1.00 . A A . 12 ARG H 1 1 18 6432 1 1 13 ARG HA H 3.114 0.045 -8.157 1.00 . A A . 12 ARG HA 1 1 18 6433 1 1 13 ARG HB2 H 5.234 1.560 -6.634 1.00 . A A . 12 ARG HB2 1 1 18 6434 1 1 13 ARG HB3 H 5.529 0.119 -7.596 1.00 . A A . 12 ARG HB3 1 1 18 6435 1 1 13 ARG HD2 H 6.629 2.940 -9.750 1.00 . A A . 12 ARG HD2 1 1 18 6436 1 1 13 ARG HD3 H 6.825 2.877 -7.998 1.00 . A A . 12 ARG HD3 1 1 18 6437 1 1 13 ARG HE H 7.077 0.279 -8.975 1.00 . A A . 12 ARG HE 1 1 18 6438 1 1 13 ARG HG2 H 4.822 1.295 -9.604 1.00 . A A . 12 ARG HG2 1 1 18 6439 1 1 13 ARG HG3 H 4.472 2.736 -8.647 1.00 . A A . 12 ARG HG3 1 1 18 6440 1 1 13 ARG HH11 H 10.306 2.609 -9.407 1.00 . A A . 12 ARG HH11 1 1 18 6441 1 1 13 ARG HH12 H 8.749 3.331 -9.178 1.00 . A A . 12 ARG HH12 1 1 18 6442 1 1 13 ARG HH21 H 10.518 0.329 -9.465 1.00 . A A . 12 ARG HH21 1 1 18 6443 1 1 13 ARG HH22 H 9.122 -0.680 -9.277 1.00 . A A . 12 ARG HH22 1 1 18 6444 1 1 13 ARG N N 2.605 1.721 -7.083 1.00 . A A . 12 ARG N 1 1 18 6445 1 1 13 ARG NE N 7.460 1.180 -9.019 1.00 . A A . 12 ARG NE 1 1 18 6446 1 1 13 ARG NH1 N 9.320 2.514 -9.268 1.00 . A A . 12 ARG NH1 1 1 18 6447 1 1 13 ARG NH2 N 9.533 0.231 -9.325 1.00 . A A . 12 ARG NH2 1 1 18 6448 1 1 13 ARG O O 3.937 -1.496 -6.132 1.00 . A A . 12 ARG O 1 1 18 6449 1 1 14 VAL C C 1.077 -1.340 -3.788 1.00 . A A . 13 VAL C 1 1 18 6450 1 1 14 VAL CA C 2.502 -0.793 -3.871 1.00 . A A . 13 VAL CA 1 1 18 6451 1 1 14 VAL CB C 2.837 0.024 -2.614 1.00 . A A . 13 VAL CB 1 1 18 6452 1 1 14 VAL CG1 C 4.327 0.319 -2.550 1.00 . A A . 13 VAL CG1 1 1 18 6453 1 1 14 VAL CG2 C 2.027 1.308 -2.574 1.00 . A A . 13 VAL CG2 1 1 18 6454 1 1 14 VAL H H 2.256 0.897 -5.081 1.00 . A A . 13 VAL H 1 1 18 6455 1 1 14 VAL HA H 3.188 -1.618 -3.929 1.00 . A A . 13 VAL HA 1 1 18 6456 1 1 14 VAL HB H 2.576 -0.560 -1.759 1.00 . A A . 13 VAL HB 1 1 18 6457 1 1 14 VAL HG11 H 4.540 0.911 -1.670 1.00 . A A . 13 VAL HG11 1 1 18 6458 1 1 14 VAL HG12 H 4.625 0.866 -3.431 1.00 . A A . 13 VAL HG12 1 1 18 6459 1 1 14 VAL HG13 H 4.877 -0.610 -2.498 1.00 . A A . 13 VAL HG13 1 1 18 6460 1 1 14 VAL HG21 H 0.979 1.067 -2.480 1.00 . A A . 13 VAL HG21 1 1 18 6461 1 1 14 VAL HG22 H 2.190 1.859 -3.485 1.00 . A A . 13 VAL HG22 1 1 18 6462 1 1 14 VAL HG23 H 2.338 1.904 -1.729 1.00 . A A . 13 VAL HG23 1 1 18 6463 1 1 14 VAL N N 2.670 0.017 -5.057 1.00 . A A . 13 VAL N 1 1 18 6464 1 1 14 VAL O O 0.538 -1.835 -4.778 1.00 . A A . 13 VAL O 1 1 18 6465 1 1 15 ASN C C -1.764 -0.665 -1.776 1.00 . A A . 14 ASN C 1 1 18 6466 1 1 15 ASN CA C -0.886 -1.741 -2.408 1.00 . A A . 14 ASN CA 1 1 18 6467 1 1 15 ASN CB C -0.874 -2.989 -1.522 1.00 . A A . 14 ASN CB 1 1 18 6468 1 1 15 ASN CG C -0.056 -4.119 -2.119 1.00 . A A . 14 ASN CG 1 1 18 6469 1 1 15 ASN H H 0.945 -0.839 -1.866 1.00 . A A . 14 ASN H 1 1 18 6470 1 1 15 ASN HA H -1.294 -1.999 -3.374 1.00 . A A . 14 ASN HA 1 1 18 6471 1 1 15 ASN HB2 H -0.454 -2.736 -0.560 1.00 . A A . 14 ASN HB2 1 1 18 6472 1 1 15 ASN HB3 H -1.887 -3.337 -1.387 1.00 . A A . 14 ASN HB3 1 1 18 6473 1 1 15 ASN HD21 H 0.498 -4.915 -3.855 1.00 . A A . 14 ASN HD21 1 1 18 6474 1 1 15 ASN HD22 H -0.521 -3.524 -3.960 1.00 . A A . 14 ASN HD22 1 1 18 6475 1 1 15 ASN N N 0.471 -1.250 -2.611 1.00 . A A . 14 ASN N 1 1 18 6476 1 1 15 ASN ND2 N -0.024 -4.193 -3.445 1.00 . A A . 14 ASN ND2 1 1 18 6477 1 1 15 ASN O O -2.939 -0.531 -2.117 1.00 . A A . 14 ASN O 1 1 18 6478 1 1 15 ASN OD1 O 0.539 -4.919 -1.396 1.00 . A A . 14 ASN OD1 1 1 18 6479 1 1 16 ARG C C -3.075 0.615 0.636 1.00 . A A . 15 ARG C 1 1 18 6480 1 1 16 ARG CA C -1.900 1.168 -0.166 1.00 . A A . 15 ARG CA 1 1 18 6481 1 1 16 ARG CB C -2.394 2.213 -1.169 1.00 . A A . 15 ARG CB 1 1 18 6482 1 1 16 ARG CD C -3.575 4.397 -1.556 1.00 . A A . 15 ARG CD 1 1 18 6483 1 1 16 ARG CG C -3.124 3.379 -0.521 1.00 . A A . 15 ARG CG 1 1 18 6484 1 1 16 ARG CZ C -2.584 5.833 -3.292 1.00 . A A . 15 ARG CZ 1 1 18 6485 1 1 16 ARG H H -0.240 -0.062 -0.631 1.00 . A A . 15 ARG H 1 1 18 6486 1 1 16 ARG HA H -1.208 1.640 0.517 1.00 . A A . 15 ARG HA 1 1 18 6487 1 1 16 ARG HB2 H -1.546 2.604 -1.711 1.00 . A A . 15 ARG HB2 1 1 18 6488 1 1 16 ARG HB3 H -3.068 1.737 -1.865 1.00 . A A . 15 ARG HB3 1 1 18 6489 1 1 16 ARG HD2 H -4.250 3.915 -2.247 1.00 . A A . 15 ARG HD2 1 1 18 6490 1 1 16 ARG HD3 H -4.091 5.200 -1.050 1.00 . A A . 15 ARG HD3 1 1 18 6491 1 1 16 ARG HE H -1.550 4.657 -2.053 1.00 . A A . 15 ARG HE 1 1 18 6492 1 1 16 ARG HG2 H -3.992 3.003 0.001 1.00 . A A . 15 ARG HG2 1 1 18 6493 1 1 16 ARG HG3 H -2.461 3.862 0.180 1.00 . A A . 15 ARG HG3 1 1 18 6494 1 1 16 ARG HH11 H -4.600 5.910 -3.179 1.00 . A A . 15 ARG HH11 1 1 18 6495 1 1 16 ARG HH12 H -3.886 6.915 -4.396 1.00 . A A . 15 ARG HH12 1 1 18 6496 1 1 16 ARG HH21 H -0.600 5.977 -3.653 1.00 . A A . 15 ARG HH21 1 1 18 6497 1 1 16 ARG HH22 H -1.611 6.952 -4.665 1.00 . A A . 15 ARG HH22 1 1 18 6498 1 1 16 ARG N N -1.180 0.099 -0.855 1.00 . A A . 15 ARG N 1 1 18 6499 1 1 16 ARG NE N -2.450 4.955 -2.302 1.00 . A A . 15 ARG NE 1 1 18 6500 1 1 16 ARG NH1 N -3.788 6.254 -3.652 1.00 . A A . 15 ARG NH1 1 1 18 6501 1 1 16 ARG NH2 N -1.511 6.291 -3.922 1.00 . A A . 15 ARG NH2 1 1 18 6502 1 1 16 ARG O O -4.083 0.195 0.070 1.00 . A A . 15 ARG O 1 1 18 6503 1 1 17 HIS C C -3.832 0.695 4.246 1.00 . A A . 16 HIS C 1 1 18 6504 1 1 17 HIS CA C -3.984 0.122 2.841 1.00 . A A . 16 HIS CA 1 1 18 6505 1 1 17 HIS CB C -3.948 -1.407 2.890 1.00 . A A . 16 HIS CB 1 1 18 6506 1 1 17 HIS CD2 C -2.215 -2.501 4.482 1.00 . A A . 16 HIS CD2 1 1 18 6507 1 1 17 HIS CE1 C -0.502 -2.534 3.113 1.00 . A A . 16 HIS CE1 1 1 18 6508 1 1 17 HIS CG C -2.621 -1.961 3.308 1.00 . A A . 16 HIS CG 1 1 18 6509 1 1 17 HIS H H -2.108 0.972 2.349 1.00 . A A . 16 HIS H 1 1 18 6510 1 1 17 HIS HA H -4.934 0.437 2.438 1.00 . A A . 16 HIS HA 1 1 18 6511 1 1 17 HIS HB2 H -4.689 -1.754 3.594 1.00 . A A . 16 HIS HB2 1 1 18 6512 1 1 17 HIS HB3 H -4.177 -1.798 1.911 1.00 . A A . 16 HIS HB3 1 1 18 6513 1 1 17 HIS HD1 H -1.498 -1.670 1.548 1.00 . A A . 16 HIS HD1 1 1 18 6514 1 1 17 HIS HD2 H -2.817 -2.634 5.368 1.00 . A A . 16 HIS HD2 1 1 18 6515 1 1 17 HIS HE1 H 0.488 -2.689 2.708 1.00 . A A . 16 HIS HE1 1 1 18 6516 1 1 17 HIS HE2 H -0.332 -3.264 5.020 1.00 . A A . 16 HIS HE2 1 1 18 6517 1 1 17 HIS N N -2.935 0.623 1.958 1.00 . A A . 16 HIS N 1 1 18 6518 1 1 17 HIS ND1 N -1.524 -1.995 2.472 1.00 . A A . 16 HIS ND1 1 1 18 6519 1 1 17 HIS NE2 N -0.894 -2.849 4.332 1.00 . A A . 16 HIS NE2 1 1 18 6520 1 1 17 HIS O O -2.718 0.840 4.751 1.00 . A A . 16 HIS O 1 1 18 6521 1 1 18 SER C C -5.699 0.666 7.190 1.00 . A A . 17 SER C 1 1 18 6522 1 1 18 SER CA C -4.952 1.577 6.221 1.00 . A A . 17 SER CA 1 1 18 6523 1 1 18 SER CB C -5.583 2.970 6.222 1.00 . A A . 17 SER CB 1 1 18 6524 1 1 18 SER H H -5.815 0.879 4.418 1.00 . A A . 17 SER H 1 1 18 6525 1 1 18 SER HA H -3.923 1.656 6.540 1.00 . A A . 17 SER HA 1 1 18 6526 1 1 18 SER HB2 H -6.604 2.901 5.877 1.00 . A A . 17 SER HB2 1 1 18 6527 1 1 18 SER HB3 H -5.568 3.369 7.226 1.00 . A A . 17 SER HB3 1 1 18 6528 1 1 18 SER HG H -4.533 4.589 5.884 1.00 . A A . 17 SER HG 1 1 18 6529 1 1 18 SER N N -4.959 1.019 4.873 1.00 . A A . 17 SER N 1 1 18 6530 1 1 18 SER O O -5.636 0.855 8.406 1.00 . A A . 17 SER O 1 1 18 6531 1 1 18 SER OG O -4.873 3.852 5.370 1.00 . A A . 17 SER OG 1 1 18 6532 1 1 19 THR C C -8.230 -0.548 8.282 1.00 . A A . 18 THR C 1 1 18 6533 1 1 19 THR CA C -7.168 -1.264 7.452 1.00 . A A . 18 THR CA 1 1 18 6534 1 1 19 THR CB C -6.252 -2.073 8.392 1.00 . A A . 18 THR CB 1 1 18 6535 1 1 19 THR CG2 C -7.054 -3.092 9.189 1.00 . A A . 18 THR CG2 1 1 18 6536 1 1 19 THR H H -6.412 -0.415 5.667 1.00 . A A . 18 THR H 1 1 18 6537 1 1 19 THR HA H -7.658 -1.955 6.782 1.00 . A A . 18 THR HA 1 1 18 6538 1 1 19 THR HB H -5.777 -1.390 9.082 1.00 . A A . 18 THR HB 1 1 18 6539 1 1 19 THR HG1 H -5.655 -3.288 6.956 1.00 . A A . 18 THR HG1 1 1 18 6540 1 1 19 THR HG21 H -7.549 -3.770 8.510 1.00 . A A . 18 THR HG21 1 1 18 6541 1 1 19 THR HG22 H -7.791 -2.580 9.789 1.00 . A A . 18 THR HG22 1 1 18 6542 1 1 19 THR HG23 H -6.388 -3.648 9.832 1.00 . A A . 18 THR HG23 1 1 18 6543 1 1 19 THR N N -6.405 -0.320 6.642 1.00 . A A . 18 THR N 1 1 18 6544 1 1 19 THR O O -7.934 0.014 9.336 1.00 . A A . 18 THR O 1 1 18 6545 1 1 19 THR OG1 O -5.241 -2.745 7.632 1.00 . A A . 18 THR OG1 1 1 18 6546 1 1 20 ALA C C -11.844 -0.762 8.396 1.00 . A A . 19 ALA C 1 1 18 6547 1 1 20 ALA CA C -10.573 0.074 8.492 1.00 . A A . 19 ALA CA 1 1 18 6548 1 1 20 ALA CB C -10.810 1.466 7.925 1.00 . A A . 19 ALA CB 1 1 18 6549 1 1 20 ALA H H -9.639 -1.035 6.950 1.00 . A A . 19 ALA H 1 1 18 6550 1 1 20 ALA HA H -10.300 0.176 9.531 1.00 . A A . 19 ALA HA 1 1 18 6551 1 1 20 ALA HB1 H -9.900 2.043 7.996 1.00 . A A . 19 ALA HB1 1 1 18 6552 1 1 20 ALA HB2 H -11.592 1.955 8.487 1.00 . A A . 19 ALA HB2 1 1 18 6553 1 1 20 ALA HB3 H -11.107 1.388 6.889 1.00 . A A . 19 ALA HB3 1 1 18 6554 1 1 20 ALA N N -9.466 -0.572 7.796 1.00 . A A . 19 ALA N 1 1 18 6555 1 1 20 ALA O O -12.327 -1.052 7.301 1.00 . A A . 19 ALA O 1 1 18 6556 1 1 21 ILE C C -14.838 -1.062 9.652 1.00 . A A . 20 ILE C 1 1 18 6557 1 1 21 ILE CA C -13.598 -1.950 9.597 1.00 . A A . 20 ILE CA 1 1 18 6558 1 1 21 ILE CB C -13.599 -2.895 10.815 1.00 . A A . 20 ILE CB 1 1 18 6559 1 1 21 ILE CD1 C -12.201 -4.643 12.036 1.00 . A A . 20 ILE CD1 1 1 18 6560 1 1 21 ILE CG1 C -12.351 -3.780 10.801 1.00 . A A . 20 ILE CG1 1 1 18 6561 1 1 21 ILE CG2 C -14.862 -3.746 10.824 1.00 . A A . 20 ILE CG2 1 1 18 6562 1 1 21 ILE H H -11.950 -0.883 10.389 1.00 . A A . 20 ILE H 1 1 18 6563 1 1 21 ILE HA H -13.636 -2.551 8.700 1.00 . A A . 20 ILE HA 1 1 18 6564 1 1 21 ILE HB H -13.595 -2.292 11.711 1.00 . A A . 20 ILE HB 1 1 18 6565 1 1 21 ILE HD11 H -11.296 -5.227 11.960 1.00 . A A . 20 ILE HD11 1 1 18 6566 1 1 21 ILE HD12 H -13.051 -5.304 12.118 1.00 . A A . 20 ILE HD12 1 1 18 6567 1 1 21 ILE HD13 H -12.149 -4.013 12.912 1.00 . A A . 20 ILE HD13 1 1 18 6568 1 1 21 ILE HG12 H -12.392 -4.435 9.943 1.00 . A A . 20 ILE HG12 1 1 18 6569 1 1 21 ILE HG13 H -11.475 -3.153 10.727 1.00 . A A . 20 ILE HG13 1 1 18 6570 1 1 21 ILE HG21 H -14.851 -4.398 11.686 1.00 . A A . 20 ILE HG21 1 1 18 6571 1 1 21 ILE HG22 H -14.901 -4.341 9.924 1.00 . A A . 20 ILE HG22 1 1 18 6572 1 1 21 ILE HG23 H -15.729 -3.104 10.870 1.00 . A A . 20 ILE HG23 1 1 18 6573 1 1 21 ILE N N -12.382 -1.147 9.549 1.00 . A A . 20 ILE N 1 1 18 6574 1 1 21 ILE O O -15.049 -0.334 10.621 1.00 . A A . 20 ILE O 1 1 18 6575 1 1 22 GLY C C -17.296 -0.024 7.131 1.00 . A A . 21 GLY C 1 1 18 6576 1 1 22 GLY CA C -16.863 -0.329 8.552 1.00 . A A . 21 GLY CA 1 1 18 6577 1 1 22 GLY H H -15.434 -1.731 7.861 1.00 . A A . 21 GLY H 1 1 18 6578 1 1 22 GLY HA2 H -17.658 -0.863 9.052 1.00 . A A . 21 GLY HA2 1 1 18 6579 1 1 22 GLY HA3 H -16.688 0.602 9.071 1.00 . A A . 21 GLY HA3 1 1 18 6580 1 1 22 GLY N N -15.654 -1.130 8.604 1.00 . A A . 21 GLY N 1 1 18 6581 1 1 22 GLY O O -17.717 -0.918 6.398 1.00 . A A . 21 GLY O 1 1 18 6582 1 1 23 ARG C C -16.701 2.823 4.925 1.00 . A A . 22 ARG C 1 1 18 6583 1 1 23 ARG CA C -17.575 1.666 5.400 1.00 . A A . 22 ARG CA 1 1 18 6584 1 1 23 ARG CB C -19.048 2.077 5.374 1.00 . A A . 22 ARG CB 1 1 18 6585 1 1 23 ARG CD C -21.011 2.883 4.027 1.00 . A A . 22 ARG CD 1 1 18 6586 1 1 23 ARG CG C -19.546 2.477 3.994 1.00 . A A . 22 ARG CG 1 1 18 6587 1 1 23 ARG CZ C -23.175 1.933 4.711 1.00 . A A . 22 ARG CZ 1 1 18 6588 1 1 23 ARG H H -16.849 1.910 7.374 1.00 . A A . 22 ARG H 1 1 18 6589 1 1 23 ARG HA H -17.433 0.827 4.735 1.00 . A A . 22 ARG HA 1 1 18 6590 1 1 23 ARG HB2 H -19.648 1.249 5.722 1.00 . A A . 22 ARG HB2 1 1 18 6591 1 1 23 ARG HB3 H -19.188 2.916 6.040 1.00 . A A . 22 ARG HB3 1 1 18 6592 1 1 23 ARG HD2 H -21.121 3.734 4.682 1.00 . A A . 22 ARG HD2 1 1 18 6593 1 1 23 ARG HD3 H -21.316 3.158 3.028 1.00 . A A . 22 ARG HD3 1 1 18 6594 1 1 23 ARG HE H -21.448 0.934 4.680 1.00 . A A . 22 ARG HE 1 1 18 6595 1 1 23 ARG HG2 H -18.959 3.311 3.639 1.00 . A A . 22 ARG HG2 1 1 18 6596 1 1 23 ARG HG3 H -19.429 1.639 3.323 1.00 . A A . 22 ARG HG3 1 1 18 6597 1 1 23 ARG HH11 H -23.241 3.875 4.154 1.00 . A A . 22 ARG HH11 1 1 18 6598 1 1 23 ARG HH12 H -24.756 3.190 4.639 1.00 . A A . 22 ARG HH12 1 1 18 6599 1 1 23 ARG HH21 H -24.868 1.001 5.302 1.00 . A A . 22 ARG HH21 1 1 18 6600 1 1 23 ARG HH22 H -23.439 0.024 5.320 1.00 . A A . 22 ARG HH22 1 1 18 6601 1 1 23 ARG N N -17.191 1.243 6.742 1.00 . A A . 22 ARG N 1 1 18 6602 1 1 23 ARG NE N -21.868 1.802 4.504 1.00 . A A . 22 ARG NE 1 1 18 6603 1 1 23 ARG NH1 N -23.772 3.095 4.483 1.00 . A A . 22 ARG NH1 1 1 18 6604 1 1 23 ARG NH2 N -23.885 0.902 5.146 1.00 . A A . 22 ARG NH2 1 1 18 6605 1 1 23 ARG O O -17.048 3.986 5.219 1.00 . A A . 22 ARG O 1 1 18 6606 1 1 23 ARG OXT O -15.678 2.556 4.261 1.00 . A A . 22 ARG OXT 1 1 19 6607 1 1 1 ACE C C 5.228 1.638 11.490 1.00 . A A . 0 ACE C 1 1 19 6608 1 1 1 ACE CH3 C 5.235 0.924 12.815 1.00 . A A . 0 ACE CH3 1 1 19 6609 1 1 1 ACE H1 H 4.213 0.670 13.077 1.00 . A A . 0 ACE H1 1 1 19 6610 1 1 1 ACE H2 H 5.647 1.571 13.566 1.00 . A A . 0 ACE H2 1 1 19 6611 1 1 1 ACE H3 H 5.850 0.034 12.728 1.00 . A A . 0 ACE H3 1 1 19 6612 1 1 1 ACE O O 4.170 1.881 10.909 1.00 . A A . 0 ACE O 1 1 19 6613 1 1 2 MET C C 6.835 1.689 8.595 1.00 . A A . 1 MET C 1 1 19 6614 1 1 2 MET CA C 6.549 2.673 9.726 1.00 . A A . 1 MET CA 1 1 19 6615 1 1 2 MET CB C 7.665 3.718 9.799 1.00 . A A . 1 MET CB 1 1 19 6616 1 1 2 MET CE C 6.887 5.993 13.217 1.00 . A A . 1 MET CE 1 1 19 6617 1 1 2 MET CG C 7.349 4.890 10.716 1.00 . A A . 1 MET CG 1 1 19 6618 1 1 2 MET H H 7.224 1.755 11.509 1.00 . A A . 1 MET H 1 1 19 6619 1 1 2 MET HA H 5.614 3.172 9.523 1.00 . A A . 1 MET HA 1 1 19 6620 1 1 2 MET HB2 H 8.564 3.242 10.158 1.00 . A A . 1 MET HB2 1 1 19 6621 1 1 2 MET HB3 H 7.845 4.105 8.807 1.00 . A A . 1 MET HB3 1 1 19 6622 1 1 2 MET HE1 H 7.687 6.688 13.005 1.00 . A A . 1 MET HE1 1 1 19 6623 1 1 2 MET HE2 H 6.796 5.863 14.284 1.00 . A A . 1 MET HE2 1 1 19 6624 1 1 2 MET HE3 H 5.960 6.381 12.820 1.00 . A A . 1 MET HE3 1 1 19 6625 1 1 2 MET HG2 H 8.124 5.635 10.606 1.00 . A A . 1 MET HG2 1 1 19 6626 1 1 2 MET HG3 H 6.401 5.315 10.421 1.00 . A A . 1 MET HG3 1 1 19 6627 1 1 2 MET N N 6.417 1.977 11.001 1.00 . A A . 1 MET N 1 1 19 6628 1 1 2 MET O O 7.886 1.050 8.566 1.00 . A A . 1 MET O 1 1 19 6629 1 1 2 MET SD S 7.250 4.415 12.453 1.00 . A A . 1 MET SD 1 1 19 6630 1 1 3 ASN C C 5.736 1.387 5.220 1.00 . A A . 2 ASN C 1 1 19 6631 1 1 3 ASN CA C 6.040 0.672 6.530 1.00 . A A . 2 ASN CA 1 1 19 6632 1 1 3 ASN CB C 5.107 -0.533 6.672 1.00 . A A . 2 ASN CB 1 1 19 6633 1 1 3 ASN CG C 5.184 -1.470 5.478 1.00 . A A . 2 ASN CG 1 1 19 6634 1 1 3 ASN H H 5.075 2.111 7.746 1.00 . A A . 2 ASN H 1 1 19 6635 1 1 3 ASN HA H 7.062 0.325 6.511 1.00 . A A . 2 ASN HA 1 1 19 6636 1 1 3 ASN HB2 H 5.377 -1.088 7.559 1.00 . A A . 2 ASN HB2 1 1 19 6637 1 1 3 ASN HB3 H 4.089 -0.183 6.767 1.00 . A A . 2 ASN HB3 1 1 19 6638 1 1 3 ASN HD21 H 4.562 -1.679 3.594 1.00 . A A . 2 ASN HD21 1 1 19 6639 1 1 3 ASN HD22 H 4.044 -0.240 4.397 1.00 . A A . 2 ASN HD22 1 1 19 6640 1 1 3 ASN N N 5.891 1.575 7.665 1.00 . A A . 2 ASN N 1 1 19 6641 1 1 3 ASN ND2 N 4.529 -1.092 4.379 1.00 . A A . 2 ASN ND2 1 1 19 6642 1 1 3 ASN O O 6.021 0.860 4.145 1.00 . A A . 2 ASN O 1 1 19 6643 1 1 3 ASN OD1 O 5.837 -2.511 5.534 1.00 . A A . 2 ASN OD1 1 1 19 6644 1 1 4 TRP C C 5.777 3.108 2.997 1.00 . A A . 3 TRP C 1 1 19 6645 1 1 4 TRP CA C 4.809 3.360 4.139 1.00 . A A . 3 TRP CA 1 1 19 6646 1 1 4 TRP CB C 4.722 4.852 4.468 1.00 . A A . 3 TRP CB 1 1 19 6647 1 1 4 TRP CD1 C 6.287 5.350 6.434 1.00 . A A . 3 TRP CD1 1 1 19 6648 1 1 4 TRP CD2 C 6.971 6.167 4.479 1.00 . A A . 3 TRP CD2 1 1 19 6649 1 1 4 TRP CE2 C 7.905 6.533 5.458 1.00 . A A . 3 TRP CE2 1 1 19 6650 1 1 4 TRP CE3 C 7.179 6.555 3.166 1.00 . A A . 3 TRP CE3 1 1 19 6651 1 1 4 TRP CG C 5.942 5.423 5.121 1.00 . A A . 3 TRP CG 1 1 19 6652 1 1 4 TRP CH2 C 9.222 7.654 3.851 1.00 . A A . 3 TRP CH2 1 1 19 6653 1 1 4 TRP CZ2 C 9.039 7.281 5.154 1.00 . A A . 3 TRP CZ2 1 1 19 6654 1 1 4 TRP CZ3 C 8.304 7.295 2.858 1.00 . A A . 3 TRP CZ3 1 1 19 6655 1 1 4 TRP H H 5.016 2.977 6.202 1.00 . A A . 3 TRP H 1 1 19 6656 1 1 4 TRP HA H 3.835 3.029 3.824 1.00 . A A . 3 TRP HA 1 1 19 6657 1 1 4 TRP HB2 H 4.554 5.400 3.551 1.00 . A A . 3 TRP HB2 1 1 19 6658 1 1 4 TRP HB3 H 3.886 5.014 5.132 1.00 . A A . 3 TRP HB3 1 1 19 6659 1 1 4 TRP HD1 H 5.709 4.840 7.180 1.00 . A A . 3 TRP HD1 1 1 19 6660 1 1 4 TRP HE1 H 7.918 6.121 7.515 1.00 . A A . 3 TRP HE1 1 1 19 6661 1 1 4 TRP HE3 H 6.478 6.273 2.395 1.00 . A A . 3 TRP HE3 1 1 19 6662 1 1 4 TRP HH2 H 10.090 8.234 3.569 1.00 . A A . 3 TRP HH2 1 1 19 6663 1 1 4 TRP HZ2 H 9.752 7.567 5.909 1.00 . A A . 3 TRP HZ2 1 1 19 6664 1 1 4 TRP HZ3 H 8.481 7.607 1.839 1.00 . A A . 3 TRP HZ3 1 1 19 6665 1 1 4 TRP N N 5.174 2.591 5.318 1.00 . A A . 3 TRP N 1 1 19 6666 1 1 4 TRP NE1 N 7.466 6.024 6.651 1.00 . A A . 3 TRP NE1 1 1 19 6667 1 1 4 TRP O O 5.411 2.465 2.014 1.00 . A A . 3 TRP O 1 1 19 6668 1 1 5 THR C C 7.459 3.163 0.768 1.00 . A A . 4 THR C 1 1 19 6669 1 1 5 THR CA C 8.056 3.425 2.151 1.00 . A A . 4 THR CA 1 1 19 6670 1 1 5 THR CB C 9.030 2.286 2.514 1.00 . A A . 4 THR CB 1 1 19 6671 1 1 5 THR CG2 C 10.309 2.381 1.694 1.00 . A A . 4 THR CG2 1 1 19 6672 1 1 5 THR H H 7.242 4.011 4.004 1.00 . A A . 4 THR H 1 1 19 6673 1 1 5 THR HA H 8.610 4.350 2.131 1.00 . A A . 4 THR HA 1 1 19 6674 1 1 5 THR HB H 8.553 1.340 2.302 1.00 . A A . 4 THR HB 1 1 19 6675 1 1 5 THR HG1 H 9.346 3.263 4.198 1.00 . A A . 4 THR HG1 1 1 19 6676 1 1 5 THR HG21 H 10.788 3.331 1.883 1.00 . A A . 4 THR HG21 1 1 19 6677 1 1 5 THR HG22 H 10.071 2.301 0.644 1.00 . A A . 4 THR HG22 1 1 19 6678 1 1 5 THR HG23 H 10.977 1.580 1.974 1.00 . A A . 4 THR HG23 1 1 19 6679 1 1 5 THR N N 7.015 3.570 3.163 1.00 . A A . 4 THR N 1 1 19 6680 1 1 5 THR O O 7.931 2.300 0.027 1.00 . A A . 4 THR O 1 1 19 6681 1 1 5 THR OG1 O 9.353 2.348 3.908 1.00 . A A . 4 THR OG1 1 1 19 6682 1 1 6 GLY C C 4.774 4.844 -1.180 1.00 . A A . 5 GLY C 1 1 19 6683 1 1 6 GLY CA C 5.758 3.734 -0.851 1.00 . A A . 5 GLY CA 1 1 19 6684 1 1 6 GLY H H 6.095 4.604 1.049 1.00 . A A . 5 GLY H 1 1 19 6685 1 1 6 GLY HA2 H 6.507 3.687 -1.627 1.00 . A A . 5 GLY HA2 1 1 19 6686 1 1 6 GLY HA3 H 5.224 2.792 -0.824 1.00 . A A . 5 GLY HA3 1 1 19 6687 1 1 6 GLY N N 6.417 3.919 0.426 1.00 . A A . 5 GLY N 1 1 19 6688 1 1 6 GLY O O 3.885 4.666 -2.005 1.00 . A A . 5 GLY O 1 1 19 6689 1 1 7 LEU C C 4.752 8.232 -1.535 1.00 . A A . 6 LEU C 1 1 19 6690 1 1 7 LEU CA C 4.038 7.128 -0.765 1.00 . A A . 6 LEU CA 1 1 19 6691 1 1 7 LEU CB C 3.531 7.681 0.563 1.00 . A A . 6 LEU CB 1 1 19 6692 1 1 7 LEU CD1 C 5.444 9.094 1.392 1.00 . A A . 6 LEU CD1 1 1 19 6693 1 1 7 LEU CD2 C 3.981 7.896 3.024 1.00 . A A . 6 LEU CD2 1 1 19 6694 1 1 7 LEU CG C 4.605 7.849 1.640 1.00 . A A . 6 LEU CG 1 1 19 6695 1 1 7 LEU H H 5.628 6.060 0.150 1.00 . A A . 6 LEU H 1 1 19 6696 1 1 7 LEU HA H 3.197 6.782 -1.347 1.00 . A A . 6 LEU HA 1 1 19 6697 1 1 7 LEU HB2 H 3.084 8.645 0.377 1.00 . A A . 6 LEU HB2 1 1 19 6698 1 1 7 LEU HB3 H 2.770 7.016 0.940 1.00 . A A . 6 LEU HB3 1 1 19 6699 1 1 7 LEU HD11 H 4.803 9.964 1.380 1.00 . A A . 6 LEU HD11 1 1 19 6700 1 1 7 LEU HD12 H 5.949 9.006 0.442 1.00 . A A . 6 LEU HD12 1 1 19 6701 1 1 7 LEU HD13 H 6.176 9.198 2.181 1.00 . A A . 6 LEU HD13 1 1 19 6702 1 1 7 LEU HD21 H 3.326 8.751 3.095 1.00 . A A . 6 LEU HD21 1 1 19 6703 1 1 7 LEU HD22 H 4.764 7.978 3.766 1.00 . A A . 6 LEU HD22 1 1 19 6704 1 1 7 LEU HD23 H 3.417 6.992 3.194 1.00 . A A . 6 LEU HD23 1 1 19 6705 1 1 7 LEU HG H 5.264 6.997 1.605 1.00 . A A . 6 LEU HG 1 1 19 6706 1 1 7 LEU N N 4.922 5.986 -0.524 1.00 . A A . 6 LEU N 1 1 19 6707 1 1 7 LEU O O 4.310 9.381 -1.543 1.00 . A A . 6 LEU O 1 1 19 6708 1 1 8 TYR C C 7.136 8.294 -4.272 1.00 . A A . 7 TYR C 1 1 19 6709 1 1 8 TYR CA C 6.635 8.846 -2.935 1.00 . A A . 7 TYR CA 1 1 19 6710 1 1 8 TYR CB C 7.816 9.319 -2.086 1.00 . A A . 7 TYR CB 1 1 19 6711 1 1 8 TYR CD1 C 8.081 7.160 -0.842 1.00 . A A . 7 TYR CD1 1 1 19 6712 1 1 8 TYR CD2 C 10.029 8.128 -1.801 1.00 . A A . 7 TYR CD2 1 1 19 6713 1 1 8 TYR CE1 C 8.818 6.111 -0.374 1.00 . A A . 7 TYR CE1 1 1 19 6714 1 1 8 TYR CE2 C 10.787 7.073 -1.328 1.00 . A A . 7 TYR CE2 1 1 19 6715 1 1 8 TYR CG C 8.663 8.187 -1.562 1.00 . A A . 7 TYR CG 1 1 19 6716 1 1 8 TYR CZ C 10.174 6.064 -0.614 1.00 . A A . 7 TYR CZ 1 1 19 6717 1 1 8 TYR H H 6.140 6.950 -2.146 1.00 . A A . 7 TYR H 1 1 19 6718 1 1 8 TYR HA H 5.999 9.681 -3.129 1.00 . A A . 7 TYR HA 1 1 19 6719 1 1 8 TYR HB2 H 8.446 9.962 -2.680 1.00 . A A . 7 TYR HB2 1 1 19 6720 1 1 8 TYR HB3 H 7.439 9.868 -1.239 1.00 . A A . 7 TYR HB3 1 1 19 6721 1 1 8 TYR HD1 H 7.021 7.195 -0.644 1.00 . A A . 7 TYR HD1 1 1 19 6722 1 1 8 TYR HD2 H 10.501 8.923 -2.361 1.00 . A A . 7 TYR HD2 1 1 19 6723 1 1 8 TYR HE1 H 8.325 5.334 0.171 1.00 . A A . 7 TYR HE1 1 1 19 6724 1 1 8 TYR HE2 H 11.849 7.042 -1.518 1.00 . A A . 7 TYR HE2 1 1 19 6725 1 1 8 TYR HH H 11.733 5.334 0.243 1.00 . A A . 7 TYR HH 1 1 19 6726 1 1 8 TYR N N 5.848 7.876 -2.186 1.00 . A A . 7 TYR N 1 1 19 6727 1 1 8 TYR O O 6.932 8.911 -5.318 1.00 . A A . 7 TYR O 1 1 19 6728 1 1 8 TYR OH O 10.918 5.006 -0.143 1.00 . A A . 7 TYR OH 1 1 19 6729 1 1 9 THR C C 7.634 5.219 -5.798 1.00 . A A . 8 THR C 1 1 19 6730 1 1 9 THR CA C 8.328 6.529 -5.457 1.00 . A A . 8 THR CA 1 1 19 6731 1 1 9 THR CB C 9.833 6.251 -5.321 1.00 . A A . 8 THR CB 1 1 19 6732 1 1 9 THR CG2 C 10.616 7.545 -5.157 1.00 . A A . 8 THR CG2 1 1 19 6733 1 1 9 THR H H 7.912 6.677 -3.381 1.00 . A A . 8 THR H 1 1 19 6734 1 1 9 THR HA H 8.183 7.225 -6.269 1.00 . A A . 8 THR HA 1 1 19 6735 1 1 9 THR HB H 10.172 5.751 -6.216 1.00 . A A . 8 THR HB 1 1 19 6736 1 1 9 THR HG1 H 9.335 4.766 -4.124 1.00 . A A . 8 THR HG1 1 1 19 6737 1 1 9 THR HG21 H 11.649 7.316 -4.942 1.00 . A A . 8 THR HG21 1 1 19 6738 1 1 9 THR HG22 H 10.197 8.121 -4.346 1.00 . A A . 8 THR HG22 1 1 19 6739 1 1 9 THR HG23 H 10.558 8.118 -6.072 1.00 . A A . 8 THR HG23 1 1 19 6740 1 1 9 THR N N 7.789 7.135 -4.240 1.00 . A A . 8 THR N 1 1 19 6741 1 1 9 THR O O 8.161 4.414 -6.565 1.00 . A A . 8 THR O 1 1 19 6742 1 1 9 THR OG1 O 10.061 5.395 -4.197 1.00 . A A . 8 THR OG1 1 1 19 6743 1 1 10 LEU C C 4.226 4.040 -5.594 1.00 . A A . 9 LEU C 1 1 19 6744 1 1 10 LEU CA C 5.715 3.780 -5.488 1.00 . A A . 9 LEU CA 1 1 19 6745 1 1 10 LEU CB C 6.000 2.762 -4.388 1.00 . A A . 9 LEU CB 1 1 19 6746 1 1 10 LEU CD1 C 7.700 1.495 -3.058 1.00 . A A . 9 LEU CD1 1 1 19 6747 1 1 10 LEU CD2 C 7.758 1.405 -5.555 1.00 . A A . 9 LEU CD2 1 1 19 6748 1 1 10 LEU CG C 7.446 2.265 -4.339 1.00 . A A . 9 LEU CG 1 1 19 6749 1 1 10 LEU H H 6.074 5.690 -4.645 1.00 . A A . 9 LEU H 1 1 19 6750 1 1 10 LEU HA H 6.055 3.383 -6.418 1.00 . A A . 9 LEU HA 1 1 19 6751 1 1 10 LEU HB2 H 5.764 3.215 -3.437 1.00 . A A . 9 LEU HB2 1 1 19 6752 1 1 10 LEU HB3 H 5.351 1.911 -4.534 1.00 . A A . 9 LEU HB3 1 1 19 6753 1 1 10 LEU HD11 H 7.039 0.642 -3.016 1.00 . A A . 9 LEU HD11 1 1 19 6754 1 1 10 LEU HD12 H 7.514 2.138 -2.212 1.00 . A A . 9 LEU HD12 1 1 19 6755 1 1 10 LEU HD13 H 8.725 1.158 -3.039 1.00 . A A . 9 LEU HD13 1 1 19 6756 1 1 10 LEU HD21 H 7.630 1.992 -6.453 1.00 . A A . 9 LEU HD21 1 1 19 6757 1 1 10 LEU HD22 H 7.087 0.560 -5.579 1.00 . A A . 9 LEU HD22 1 1 19 6758 1 1 10 LEU HD23 H 8.777 1.055 -5.496 1.00 . A A . 9 LEU HD23 1 1 19 6759 1 1 10 LEU HG H 8.112 3.116 -4.353 1.00 . A A . 9 LEU HG 1 1 19 6760 1 1 10 LEU N N 6.456 5.008 -5.237 1.00 . A A . 9 LEU N 1 1 19 6761 1 1 10 LEU O O 3.605 3.748 -6.612 1.00 . A A . 9 LEU O 1 1 19 6762 1 1 11 LEU C C 1.392 3.812 -5.024 1.00 . A A . 10 LEU C 1 1 19 6763 1 1 11 LEU CA C 2.262 4.932 -4.452 1.00 . A A . 10 LEU CA 1 1 19 6764 1 1 11 LEU CB C 1.977 6.251 -5.164 1.00 . A A . 10 LEU CB 1 1 19 6765 1 1 11 LEU CD1 C 4.167 7.403 -4.718 1.00 . A A . 10 LEU CD1 1 1 19 6766 1 1 11 LEU CD2 C 2.102 8.756 -5.123 1.00 . A A . 10 LEU CD2 1 1 19 6767 1 1 11 LEU CG C 2.659 7.469 -4.534 1.00 . A A . 10 LEU CG 1 1 19 6768 1 1 11 LEU H H 4.275 4.876 -3.805 1.00 . A A . 10 LEU H 1 1 19 6769 1 1 11 LEU HA H 2.020 5.048 -3.408 1.00 . A A . 10 LEU HA 1 1 19 6770 1 1 11 LEU HB2 H 2.310 6.165 -6.187 1.00 . A A . 10 LEU HB2 1 1 19 6771 1 1 11 LEU HB3 H 0.910 6.416 -5.161 1.00 . A A . 10 LEU HB3 1 1 19 6772 1 1 11 LEU HD11 H 4.590 6.701 -4.009 1.00 . A A . 10 LEU HD11 1 1 19 6773 1 1 11 LEU HD12 H 4.594 8.381 -4.550 1.00 . A A . 10 LEU HD12 1 1 19 6774 1 1 11 LEU HD13 H 4.395 7.079 -5.722 1.00 . A A . 10 LEU HD13 1 1 19 6775 1 1 11 LEU HD21 H 2.599 9.603 -4.671 1.00 . A A . 10 LEU HD21 1 1 19 6776 1 1 11 LEU HD22 H 1.042 8.814 -4.926 1.00 . A A . 10 LEU HD22 1 1 19 6777 1 1 11 LEU HD23 H 2.272 8.767 -6.190 1.00 . A A . 10 LEU HD23 1 1 19 6778 1 1 11 LEU HG H 2.458 7.470 -3.474 1.00 . A A . 10 LEU HG 1 1 19 6779 1 1 11 LEU N N 3.685 4.617 -4.539 1.00 . A A . 10 LEU N 1 1 19 6780 1 1 11 LEU O O 0.914 2.950 -4.286 1.00 . A A . 10 LEU O 1 1 19 6781 1 1 12 SER C C 1.149 1.496 -7.118 1.00 . A A . 11 SER C 1 1 19 6782 1 1 12 SER CA C 0.381 2.812 -7.000 1.00 . A A . 11 SER CA 1 1 19 6783 1 1 12 SER CB C -0.045 3.293 -8.388 1.00 . A A . 11 SER CB 1 1 19 6784 1 1 12 SER H H 1.589 4.546 -6.873 1.00 . A A . 11 SER H 1 1 19 6785 1 1 12 SER HA H -0.501 2.646 -6.400 1.00 . A A . 11 SER HA 1 1 19 6786 1 1 12 SER HB2 H -0.641 2.528 -8.865 1.00 . A A . 11 SER HB2 1 1 19 6787 1 1 12 SER HB3 H -0.630 4.195 -8.290 1.00 . A A . 11 SER HB3 1 1 19 6788 1 1 12 SER HG H 1.315 4.494 -9.126 1.00 . A A . 11 SER HG 1 1 19 6789 1 1 12 SER N N 1.188 3.830 -6.337 1.00 . A A . 11 SER N 1 1 19 6790 1 1 12 SER O O 0.704 0.565 -7.788 1.00 . A A . 11 SER O 1 1 19 6791 1 1 12 SER OG O 1.082 3.567 -9.202 1.00 . A A . 11 SER OG 1 1 19 6792 1 1 13 ARG C C 3.207 -0.409 -5.111 1.00 . A A . 12 ARG C 1 1 19 6793 1 1 13 ARG CA C 3.137 0.232 -6.491 1.00 . A A . 12 ARG CA 1 1 19 6794 1 1 13 ARG CB C 4.550 0.576 -6.970 1.00 . A A . 12 ARG CB 1 1 19 6795 1 1 13 ARG CD C 5.997 1.776 -8.636 1.00 . A A . 12 ARG CD 1 1 19 6796 1 1 13 ARG CG C 4.587 1.315 -8.297 1.00 . A A . 12 ARG CG 1 1 19 6797 1 1 13 ARG CZ C 7.140 3.093 -10.371 1.00 . A A . 12 ARG CZ 1 1 19 6798 1 1 13 ARG H H 2.603 2.203 -5.943 1.00 . A A . 12 ARG H 1 1 19 6799 1 1 13 ARG HA H 2.690 -0.468 -7.177 1.00 . A A . 12 ARG HA 1 1 19 6800 1 1 13 ARG HB2 H 5.026 1.196 -6.226 1.00 . A A . 12 ARG HB2 1 1 19 6801 1 1 13 ARG HB3 H 5.113 -0.339 -7.077 1.00 . A A . 12 ARG HB3 1 1 19 6802 1 1 13 ARG HD2 H 6.348 2.431 -7.851 1.00 . A A . 12 ARG HD2 1 1 19 6803 1 1 13 ARG HD3 H 6.641 0.910 -8.694 1.00 . A A . 12 ARG HD3 1 1 19 6804 1 1 13 ARG HE H 5.230 2.521 -10.445 1.00 . A A . 12 ARG HE 1 1 19 6805 1 1 13 ARG HG2 H 4.238 0.654 -9.076 1.00 . A A . 12 ARG HG2 1 1 19 6806 1 1 13 ARG HG3 H 3.941 2.179 -8.236 1.00 . A A . 12 ARG HG3 1 1 19 6807 1 1 13 ARG HH11 H 9.083 3.523 -10.019 1.00 . A A . 12 ARG HH11 1 1 19 6808 1 1 13 ARG HH12 H 8.294 2.596 -8.788 1.00 . A A . 12 ARG HH12 1 1 19 6809 1 1 13 ARG HH21 H 7.928 4.176 -11.885 1.00 . A A . 12 ARG HH21 1 1 19 6810 1 1 13 ARG HH22 H 6.261 3.743 -12.071 1.00 . A A . 12 ARG HH22 1 1 19 6811 1 1 13 ARG N N 2.305 1.429 -6.462 1.00 . A A . 12 ARG N 1 1 19 6812 1 1 13 ARG NE N 6.049 2.490 -9.909 1.00 . A A . 12 ARG NE 1 1 19 6813 1 1 13 ARG NH1 N 8.265 3.069 -9.669 1.00 . A A . 12 ARG NH1 1 1 19 6814 1 1 13 ARG NH2 N 7.107 3.722 -11.538 1.00 . A A . 12 ARG NH2 1 1 19 6815 1 1 13 ARG O O 3.993 -1.328 -4.878 1.00 . A A . 12 ARG O 1 1 19 6816 1 1 14 VAL C C 1.099 -1.290 -2.624 1.00 . A A . 13 VAL C 1 1 19 6817 1 1 14 VAL CA C 2.338 -0.423 -2.842 1.00 . A A . 13 VAL CA 1 1 19 6818 1 1 14 VAL CB C 2.358 0.745 -1.834 1.00 . A A . 13 VAL CB 1 1 19 6819 1 1 14 VAL CG1 C 2.906 0.294 -0.491 1.00 . A A . 13 VAL CG1 1 1 19 6820 1 1 14 VAL CG2 C 3.177 1.901 -2.381 1.00 . A A . 13 VAL CG2 1 1 19 6821 1 1 14 VAL H H 1.771 0.808 -4.455 1.00 . A A . 13 VAL H 1 1 19 6822 1 1 14 VAL HA H 3.216 -1.025 -2.680 1.00 . A A . 13 VAL HA 1 1 19 6823 1 1 14 VAL HB H 1.345 1.090 -1.689 1.00 . A A . 13 VAL HB 1 1 19 6824 1 1 14 VAL HG11 H 2.218 -0.398 -0.033 1.00 . A A . 13 VAL HG11 1 1 19 6825 1 1 14 VAL HG12 H 3.037 1.156 0.150 1.00 . A A . 13 VAL HG12 1 1 19 6826 1 1 14 VAL HG13 H 3.860 -0.189 -0.638 1.00 . A A . 13 VAL HG13 1 1 19 6827 1 1 14 VAL HG21 H 3.173 2.711 -1.668 1.00 . A A . 13 VAL HG21 1 1 19 6828 1 1 14 VAL HG22 H 2.748 2.237 -3.313 1.00 . A A . 13 VAL HG22 1 1 19 6829 1 1 14 VAL HG23 H 4.193 1.575 -2.550 1.00 . A A . 13 VAL HG23 1 1 19 6830 1 1 14 VAL N N 2.377 0.083 -4.203 1.00 . A A . 13 VAL N 1 1 19 6831 1 1 14 VAL O O 0.801 -2.170 -3.431 1.00 . A A . 13 VAL O 1 1 19 6832 1 1 15 ASN C C -2.012 -1.325 -2.044 1.00 . A A . 14 ASN C 1 1 19 6833 1 1 15 ASN CA C -0.820 -1.802 -1.219 1.00 . A A . 14 ASN CA 1 1 19 6834 1 1 15 ASN CB C -1.137 -1.697 0.275 1.00 . A A . 14 ASN CB 1 1 19 6835 1 1 15 ASN CG C -1.001 -0.282 0.811 1.00 . A A . 14 ASN CG 1 1 19 6836 1 1 15 ASN H H 0.667 -0.324 -0.937 1.00 . A A . 14 ASN H 1 1 19 6837 1 1 15 ASN HA H -0.625 -2.836 -1.461 1.00 . A A . 14 ASN HA 1 1 19 6838 1 1 15 ASN HB2 H -2.151 -2.028 0.445 1.00 . A A . 14 ASN HB2 1 1 19 6839 1 1 15 ASN HB3 H -0.460 -2.333 0.825 1.00 . A A . 14 ASN HB3 1 1 19 6840 1 1 15 ASN HD21 H -1.548 0.477 -0.945 1.00 . A A . 14 ASN HD21 1 1 19 6841 1 1 15 ASN HD22 H -1.194 1.628 0.293 1.00 . A A . 14 ASN HD22 1 1 19 6842 1 1 15 ASN N N 0.383 -1.039 -1.537 1.00 . A A . 14 ASN N 1 1 19 6843 1 1 15 ASN ND2 N -1.276 0.707 -0.033 1.00 . A A . 14 ASN ND2 1 1 19 6844 1 1 15 ASN O O -3.105 -1.881 -1.946 1.00 . A A . 14 ASN O 1 1 19 6845 1 1 15 ASN OD1 O -0.655 -0.080 1.974 1.00 . A A . 14 ASN OD1 1 1 19 6846 1 1 16 ARG C C -3.970 0.861 -2.864 1.00 . A A . 15 ARG C 1 1 19 6847 1 1 16 ARG CA C -2.839 0.269 -3.704 1.00 . A A . 15 ARG CA 1 1 19 6848 1 1 16 ARG CB C -3.392 -0.803 -4.650 1.00 . A A . 15 ARG CB 1 1 19 6849 1 1 16 ARG CD C -3.865 0.745 -6.577 1.00 . A A . 15 ARG CD 1 1 19 6850 1 1 16 ARG CG C -4.444 -0.284 -5.619 1.00 . A A . 15 ARG CG 1 1 19 6851 1 1 16 ARG CZ C -4.616 2.161 -8.444 1.00 . A A . 15 ARG CZ 1 1 19 6852 1 1 16 ARG H H -0.894 0.106 -2.883 1.00 . A A . 15 ARG H 1 1 19 6853 1 1 16 ARG HA H -2.397 1.059 -4.293 1.00 . A A . 15 ARG HA 1 1 19 6854 1 1 16 ARG HB2 H -2.575 -1.213 -5.225 1.00 . A A . 15 ARG HB2 1 1 19 6855 1 1 16 ARG HB3 H -3.836 -1.591 -4.060 1.00 . A A . 15 ARG HB3 1 1 19 6856 1 1 16 ARG HD2 H -3.464 1.567 -6.003 1.00 . A A . 15 ARG HD2 1 1 19 6857 1 1 16 ARG HD3 H -3.071 0.283 -7.145 1.00 . A A . 15 ARG HD3 1 1 19 6858 1 1 16 ARG HE H -5.784 0.913 -7.416 1.00 . A A . 15 ARG HE 1 1 19 6859 1 1 16 ARG HG2 H -4.832 -1.114 -6.189 1.00 . A A . 15 ARG HG2 1 1 19 6860 1 1 16 ARG HG3 H -5.243 0.173 -5.056 1.00 . A A . 15 ARG HG3 1 1 19 6861 1 1 16 ARG HH11 H -2.655 2.338 -7.984 1.00 . A A . 15 ARG HH11 1 1 19 6862 1 1 16 ARG HH12 H -3.202 3.328 -9.296 1.00 . A A . 15 ARG HH12 1 1 19 6863 1 1 16 ARG HH21 H -6.513 2.214 -9.140 1.00 . A A . 15 ARG HH21 1 1 19 6864 1 1 16 ARG HH22 H -5.395 3.257 -9.953 1.00 . A A . 15 ARG HH22 1 1 19 6865 1 1 16 ARG N N -1.789 -0.291 -2.854 1.00 . A A . 15 ARG N 1 1 19 6866 1 1 16 ARG NE N -4.872 1.258 -7.502 1.00 . A A . 15 ARG NE 1 1 19 6867 1 1 16 ARG NH1 N -3.391 2.649 -8.586 1.00 . A A . 15 ARG NH1 1 1 19 6868 1 1 16 ARG NH2 N -5.587 2.578 -9.244 1.00 . A A . 15 ARG NH2 1 1 19 6869 1 1 16 ARG O O -4.219 0.427 -1.740 1.00 . A A . 15 ARG O 1 1 19 6870 1 1 17 HIS C C -7.016 1.657 -2.788 1.00 . A A . 16 HIS C 1 1 19 6871 1 1 17 HIS CA C -5.756 2.511 -2.725 1.00 . A A . 16 HIS CA 1 1 19 6872 1 1 17 HIS CB C -6.028 3.887 -3.335 1.00 . A A . 16 HIS CB 1 1 19 6873 1 1 17 HIS CD2 C -4.382 5.558 -2.227 1.00 . A A . 16 HIS CD2 1 1 19 6874 1 1 17 HIS CE1 C -3.097 5.941 -3.962 1.00 . A A . 16 HIS CE1 1 1 19 6875 1 1 17 HIS CG C -4.859 4.821 -3.257 1.00 . A A . 16 HIS CG 1 1 19 6876 1 1 17 HIS H H -4.404 2.165 -4.318 1.00 . A A . 16 HIS H 1 1 19 6877 1 1 17 HIS HA H -5.469 2.636 -1.692 1.00 . A A . 16 HIS HA 1 1 19 6878 1 1 17 HIS HB2 H -6.288 3.767 -4.377 1.00 . A A . 16 HIS HB2 1 1 19 6879 1 1 17 HIS HB3 H -6.855 4.347 -2.814 1.00 . A A . 16 HIS HB3 1 1 19 6880 1 1 17 HIS HD1 H -4.118 4.698 -5.226 1.00 . A A . 16 HIS HD1 1 1 19 6881 1 1 17 HIS HD2 H -4.787 5.600 -1.225 1.00 . A A . 16 HIS HD2 1 1 19 6882 1 1 17 HIS HE1 H -2.312 6.329 -4.594 1.00 . A A . 16 HIS HE1 1 1 19 6883 1 1 17 HIS HE2 H -2.735 6.862 -2.168 1.00 . A A . 16 HIS HE2 1 1 19 6884 1 1 17 HIS N N -4.651 1.860 -3.420 1.00 . A A . 16 HIS N 1 1 19 6885 1 1 17 HIS ND1 N -4.033 5.083 -4.329 1.00 . A A . 16 HIS ND1 1 1 19 6886 1 1 17 HIS NE2 N -3.288 6.244 -2.692 1.00 . A A . 16 HIS NE2 1 1 19 6887 1 1 17 HIS O O -7.611 1.486 -3.852 1.00 . A A . 16 HIS O 1 1 19 6888 1 1 18 SER C C -9.829 1.104 -1.159 1.00 . A A . 17 SER C 1 1 19 6889 1 1 18 SER CA C -8.609 0.283 -1.562 1.00 . A A . 17 SER CA 1 1 19 6890 1 1 18 SER CB C -8.393 -0.854 -0.561 1.00 . A A . 17 SER CB 1 1 19 6891 1 1 18 SER H H -6.903 1.295 -0.824 1.00 . A A . 17 SER H 1 1 19 6892 1 1 18 SER HA H -8.781 -0.140 -2.540 1.00 . A A . 17 SER HA 1 1 19 6893 1 1 18 SER HB2 H -9.282 -1.466 -0.516 1.00 . A A . 17 SER HB2 1 1 19 6894 1 1 18 SER HB3 H -7.556 -1.457 -0.880 1.00 . A A . 17 SER HB3 1 1 19 6895 1 1 18 SER HG H -8.941 -0.290 1.234 1.00 . A A . 17 SER HG 1 1 19 6896 1 1 18 SER N N -7.419 1.122 -1.639 1.00 . A A . 17 SER N 1 1 19 6897 1 1 18 SER O O -10.962 0.748 -1.484 1.00 . A A . 17 SER O 1 1 19 6898 1 1 18 SER OG O -8.122 -0.348 0.736 1.00 . A A . 17 SER OG 1 1 19 6899 1 1 19 THR C C -11.615 2.351 0.939 1.00 . A A . 18 THR C 1 1 19 6900 1 1 19 THR CA C -10.658 3.085 0.002 1.00 . A A . 18 THR CA 1 1 19 6901 1 1 19 THR CB C -11.452 3.669 -1.185 1.00 . A A . 18 THR CB 1 1 19 6902 1 1 19 THR CG2 C -12.477 4.686 -0.705 1.00 . A A . 18 THR CG2 1 1 19 6903 1 1 19 THR H H -8.659 2.430 -0.228 1.00 . A A . 18 THR H 1 1 19 6904 1 1 19 THR HA H -10.207 3.905 0.541 1.00 . A A . 18 THR HA 1 1 19 6905 1 1 19 THR HB H -11.972 2.863 -1.683 1.00 . A A . 18 THR HB 1 1 19 6906 1 1 19 THR HG1 H -9.741 4.527 -1.665 1.00 . A A . 18 THR HG1 1 1 19 6907 1 1 19 THR HG21 H -11.976 5.470 -0.156 1.00 . A A . 18 THR HG21 1 1 19 6908 1 1 19 THR HG22 H -13.195 4.199 -0.064 1.00 . A A . 18 THR HG22 1 1 19 6909 1 1 19 THR HG23 H -12.985 5.114 -1.557 1.00 . A A . 18 THR HG23 1 1 19 6910 1 1 19 THR N N -9.585 2.205 -0.452 1.00 . A A . 18 THR N 1 1 19 6911 1 1 19 THR O O -11.459 2.399 2.158 1.00 . A A . 18 THR O 1 1 19 6912 1 1 19 THR OG1 O -10.557 4.293 -2.114 1.00 . A A . 18 THR OG1 1 1 19 6913 1 1 20 ALA C C -14.267 1.814 2.177 1.00 . A A . 19 ALA C 1 1 19 6914 1 1 20 ALA CA C -13.586 0.924 1.141 1.00 . A A . 19 ALA CA 1 1 19 6915 1 1 20 ALA CB C -12.922 -0.265 1.819 1.00 . A A . 19 ALA CB 1 1 19 6916 1 1 20 ALA H H -12.675 1.674 -0.618 1.00 . A A . 19 ALA H 1 1 19 6917 1 1 20 ALA HA H -14.334 0.547 0.460 1.00 . A A . 19 ALA HA 1 1 19 6918 1 1 20 ALA HB1 H -13.666 -0.839 2.349 1.00 . A A . 19 ALA HB1 1 1 19 6919 1 1 20 ALA HB2 H -12.176 0.089 2.516 1.00 . A A . 19 ALA HB2 1 1 19 6920 1 1 20 ALA HB3 H -12.450 -0.888 1.073 1.00 . A A . 19 ALA HB3 1 1 19 6921 1 1 20 ALA N N -12.605 1.673 0.359 1.00 . A A . 19 ALA N 1 1 19 6922 1 1 20 ALA O O -14.802 1.325 3.173 1.00 . A A . 19 ALA O 1 1 19 6923 1 1 21 ILE C C -15.698 5.104 2.081 1.00 . A A . 20 ILE C 1 1 19 6924 1 1 21 ILE CA C -14.866 4.077 2.844 1.00 . A A . 20 ILE CA 1 1 19 6925 1 1 21 ILE CB C -13.802 4.810 3.688 1.00 . A A . 20 ILE CB 1 1 19 6926 1 1 21 ILE CD1 C -15.328 5.100 5.711 1.00 . A A . 20 ILE CD1 1 1 19 6927 1 1 21 ILE CG1 C -14.465 5.781 4.670 1.00 . A A . 20 ILE CG1 1 1 19 6928 1 1 21 ILE CG2 C -12.822 5.546 2.788 1.00 . A A . 20 ILE CG2 1 1 19 6929 1 1 21 ILE H H -13.816 3.447 1.118 1.00 . A A . 20 ILE H 1 1 19 6930 1 1 21 ILE HA H -15.513 3.530 3.513 1.00 . A A . 20 ILE HA 1 1 19 6931 1 1 21 ILE HB H -13.249 4.070 4.247 1.00 . A A . 20 ILE HB 1 1 19 6932 1 1 21 ILE HD11 H -15.758 5.844 6.364 1.00 . A A . 20 ILE HD11 1 1 19 6933 1 1 21 ILE HD12 H -14.722 4.419 6.291 1.00 . A A . 20 ILE HD12 1 1 19 6934 1 1 21 ILE HD13 H -16.118 4.551 5.220 1.00 . A A . 20 ILE HD13 1 1 19 6935 1 1 21 ILE HG12 H -13.698 6.337 5.188 1.00 . A A . 20 ILE HG12 1 1 19 6936 1 1 21 ILE HG13 H -15.091 6.467 4.118 1.00 . A A . 20 ILE HG13 1 1 19 6937 1 1 21 ILE HG21 H -13.356 6.273 2.194 1.00 . A A . 20 ILE HG21 1 1 19 6938 1 1 21 ILE HG22 H -12.331 4.840 2.135 1.00 . A A . 20 ILE HG22 1 1 19 6939 1 1 21 ILE HG23 H -12.084 6.050 3.393 1.00 . A A . 20 ILE HG23 1 1 19 6940 1 1 21 ILE N N -14.251 3.120 1.932 1.00 . A A . 20 ILE N 1 1 19 6941 1 1 21 ILE O O -15.318 5.543 0.995 1.00 . A A . 20 ILE O 1 1 19 6942 1 1 22 GLY C C -17.853 7.722 2.833 1.00 . A A . 21 GLY C 1 1 19 6943 1 1 22 GLY CA C -17.706 6.451 2.018 1.00 . A A . 21 GLY CA 1 1 19 6944 1 1 22 GLY H H -17.088 5.095 3.522 1.00 . A A . 21 GLY H 1 1 19 6945 1 1 22 GLY HA2 H -17.297 6.703 1.051 1.00 . A A . 21 GLY HA2 1 1 19 6946 1 1 22 GLY HA3 H -18.682 6.010 1.881 1.00 . A A . 21 GLY HA3 1 1 19 6947 1 1 22 GLY N N -16.837 5.480 2.656 1.00 . A A . 21 GLY N 1 1 19 6948 1 1 22 GLY O O -18.727 7.817 3.693 1.00 . A A . 21 GLY O 1 1 19 6949 1 1 23 ARG C C -17.798 11.022 2.474 1.00 . A A . 22 ARG C 1 1 19 6950 1 1 23 ARG CA C -17.033 9.972 3.273 1.00 . A A . 22 ARG CA 1 1 19 6951 1 1 23 ARG CB C -15.610 10.465 3.556 1.00 . A A . 22 ARG CB 1 1 19 6952 1 1 23 ARG CD C -15.378 9.342 5.796 1.00 . A A . 22 ARG CD 1 1 19 6953 1 1 23 ARG CG C -14.789 9.505 4.403 1.00 . A A . 22 ARG CG 1 1 19 6954 1 1 23 ARG CZ C -14.924 8.079 7.859 1.00 . A A . 22 ARG CZ 1 1 19 6955 1 1 23 ARG H H -16.321 8.563 1.862 1.00 . A A . 22 ARG H 1 1 19 6956 1 1 23 ARG HA H -17.541 9.810 4.212 1.00 . A A . 22 ARG HA 1 1 19 6957 1 1 23 ARG HB2 H -15.099 10.609 2.617 1.00 . A A . 22 ARG HB2 1 1 19 6958 1 1 23 ARG HB3 H -15.667 11.410 4.075 1.00 . A A . 22 ARG HB3 1 1 19 6959 1 1 23 ARG HD2 H -15.399 10.308 6.279 1.00 . A A . 22 ARG HD2 1 1 19 6960 1 1 23 ARG HD3 H -16.385 8.964 5.705 1.00 . A A . 22 ARG HD3 1 1 19 6961 1 1 23 ARG HE H -13.790 8.032 6.218 1.00 . A A . 22 ARG HE 1 1 19 6962 1 1 23 ARG HG2 H -14.767 8.541 3.918 1.00 . A A . 22 ARG HG2 1 1 19 6963 1 1 23 ARG HG3 H -13.784 9.889 4.492 1.00 . A A . 22 ARG HG3 1 1 19 6964 1 1 23 ARG HH11 H -16.589 9.225 7.916 1.00 . A A . 22 ARG HH11 1 1 19 6965 1 1 23 ARG HH12 H -16.255 8.328 9.360 1.00 . A A . 22 ARG HH12 1 1 19 6966 1 1 23 ARG HH21 H -14.410 6.979 9.474 1.00 . A A . 22 ARG HH21 1 1 19 6967 1 1 23 ARG HH22 H -13.342 6.848 8.116 1.00 . A A . 22 ARG HH22 1 1 19 6968 1 1 23 ARG N N -16.995 8.701 2.560 1.00 . A A . 22 ARG N 1 1 19 6969 1 1 23 ARG NE N -14.598 8.418 6.615 1.00 . A A . 22 ARG NE 1 1 19 6970 1 1 23 ARG NH1 N -16.011 8.586 8.425 1.00 . A A . 22 ARG NH1 1 1 19 6971 1 1 23 ARG NH2 N -14.163 7.233 8.539 1.00 . A A . 22 ARG NH2 1 1 19 6972 1 1 23 ARG O O -17.166 11.711 1.645 1.00 . A A . 22 ARG O 1 1 19 6973 1 1 23 ARG OXT O -19.023 11.147 2.682 1.00 . A A . 22 ARG OXT 1 1 20 6974 1 1 1 ACE C C 4.212 -2.352 10.205 1.00 . A A . 0 ACE C 1 1 20 6975 1 1 1 ACE CH3 C 4.846 -3.396 11.083 1.00 . A A . 0 ACE CH3 1 1 20 6976 1 1 1 ACE H1 H 5.206 -2.917 11.988 1.00 . A A . 0 ACE H1 1 1 20 6977 1 1 1 ACE H2 H 5.670 -3.847 10.565 1.00 . A A . 0 ACE H2 1 1 20 6978 1 1 1 ACE H3 H 4.105 -4.154 11.312 1.00 . A A . 0 ACE H3 1 1 20 6979 1 1 1 ACE O O 2.993 -2.179 10.209 1.00 . A A . 0 ACE O 1 1 20 6980 1 1 2 MET C C 5.298 -0.634 7.215 1.00 . A A . 1 MET C 1 1 20 6981 1 1 2 MET CA C 4.555 -0.602 8.547 1.00 . A A . 1 MET CA 1 1 20 6982 1 1 2 MET CB C 4.702 0.780 9.196 1.00 . A A . 1 MET CB 1 1 20 6983 1 1 2 MET CE C 7.914 0.632 11.865 1.00 . A A . 1 MET CE 1 1 20 6984 1 1 2 MET CG C 6.059 1.019 9.843 1.00 . A A . 1 MET CG 1 1 20 6985 1 1 2 MET H H 6.003 -1.829 9.485 1.00 . A A . 1 MET H 1 1 20 6986 1 1 2 MET HA H 3.508 -0.791 8.363 1.00 . A A . 1 MET HA 1 1 20 6987 1 1 2 MET HB2 H 4.554 1.537 8.439 1.00 . A A . 1 MET HB2 1 1 20 6988 1 1 2 MET HB3 H 3.942 0.890 9.954 1.00 . A A . 1 MET HB3 1 1 20 6989 1 1 2 MET HE1 H 7.950 1.706 11.972 1.00 . A A . 1 MET HE1 1 1 20 6990 1 1 2 MET HE2 H 8.610 0.323 11.100 1.00 . A A . 1 MET HE2 1 1 20 6991 1 1 2 MET HE3 H 8.181 0.167 12.803 1.00 . A A . 1 MET HE3 1 1 20 6992 1 1 2 MET HG2 H 6.830 0.694 9.161 1.00 . A A . 1 MET HG2 1 1 20 6993 1 1 2 MET HG3 H 6.170 2.076 10.031 1.00 . A A . 1 MET HG3 1 1 20 6994 1 1 2 MET N N 5.041 -1.645 9.444 1.00 . A A . 1 MET N 1 1 20 6995 1 1 2 MET O O 6.334 0.011 7.055 1.00 . A A . 1 MET O 1 1 20 6996 1 1 2 MET SD S 6.258 0.133 11.401 1.00 . A A . 1 MET SD 1 1 20 6997 1 1 3 ASN C C 4.672 -0.613 3.937 1.00 . A A . 2 ASN C 1 1 20 6998 1 1 3 ASN CA C 5.386 -1.498 4.945 1.00 . A A . 2 ASN CA 1 1 20 6999 1 1 3 ASN CB C 5.393 -2.945 4.445 1.00 . A A . 2 ASN CB 1 1 20 7000 1 1 3 ASN CG C 5.641 -3.048 2.945 1.00 . A A . 2 ASN CG 1 1 20 7001 1 1 3 ASN H H 3.947 -1.897 6.448 1.00 . A A . 2 ASN H 1 1 20 7002 1 1 3 ASN HA H 6.407 -1.158 5.037 1.00 . A A . 2 ASN HA 1 1 20 7003 1 1 3 ASN HB2 H 6.172 -3.490 4.958 1.00 . A A . 2 ASN HB2 1 1 20 7004 1 1 3 ASN HB3 H 4.439 -3.399 4.665 1.00 . A A . 2 ASN HB3 1 1 20 7005 1 1 3 ASN HD21 H 6.700 -1.357 2.954 1.00 . A A . 2 ASN HD21 1 1 20 7006 1 1 3 ASN HD22 H 6.530 -2.123 1.415 1.00 . A A . 2 ASN HD22 1 1 20 7007 1 1 3 ASN N N 4.768 -1.396 6.262 1.00 . A A . 2 ASN N 1 1 20 7008 1 1 3 ASN ND2 N 6.365 -2.079 2.381 1.00 . A A . 2 ASN ND2 1 1 20 7009 1 1 3 ASN O O 3.461 -0.716 3.741 1.00 . A A . 2 ASN O 1 1 20 7010 1 1 3 ASN OD1 O 5.183 -3.989 2.297 1.00 . A A . 2 ASN OD1 1 1 20 7011 1 1 4 TRP C C 6.069 1.740 1.489 1.00 . A A . 3 TRP C 1 1 20 7012 1 1 4 TRP CA C 4.925 1.155 2.294 1.00 . A A . 3 TRP CA 1 1 20 7013 1 1 4 TRP CB C 4.075 2.260 2.925 1.00 . A A . 3 TRP CB 1 1 20 7014 1 1 4 TRP CD1 C 4.820 2.544 5.357 1.00 . A A . 3 TRP CD1 1 1 20 7015 1 1 4 TRP CD2 C 5.362 4.247 4.025 1.00 . A A . 3 TRP CD2 1 1 20 7016 1 1 4 TRP CE2 C 5.807 4.541 5.323 1.00 . A A . 3 TRP CE2 1 1 20 7017 1 1 4 TRP CE3 C 5.592 5.165 3.008 1.00 . A A . 3 TRP CE3 1 1 20 7018 1 1 4 TRP CG C 4.725 2.972 4.070 1.00 . A A . 3 TRP CG 1 1 20 7019 1 1 4 TRP CH2 C 6.684 6.613 4.611 1.00 . A A . 3 TRP CH2 1 1 20 7020 1 1 4 TRP CZ2 C 6.470 5.724 5.629 1.00 . A A . 3 TRP CZ2 1 1 20 7021 1 1 4 TRP CZ3 C 6.253 6.340 3.306 1.00 . A A . 3 TRP CZ3 1 1 20 7022 1 1 4 TRP H H 6.397 0.288 3.524 1.00 . A A . 3 TRP H 1 1 20 7023 1 1 4 TRP HA H 4.305 0.586 1.626 1.00 . A A . 3 TRP HA 1 1 20 7024 1 1 4 TRP HB2 H 3.845 2.996 2.168 1.00 . A A . 3 TRP HB2 1 1 20 7025 1 1 4 TRP HB3 H 3.154 1.828 3.285 1.00 . A A . 3 TRP HB3 1 1 20 7026 1 1 4 TRP HD1 H 4.439 1.604 5.707 1.00 . A A . 3 TRP HD1 1 1 20 7027 1 1 4 TRP HE1 H 5.647 3.411 7.083 1.00 . A A . 3 TRP HE1 1 1 20 7028 1 1 4 TRP HE3 H 5.269 4.958 1.997 1.00 . A A . 3 TRP HE3 1 1 20 7029 1 1 4 TRP HH2 H 7.197 7.544 4.803 1.00 . A A . 3 TRP HH2 1 1 20 7030 1 1 4 TRP HZ2 H 6.804 5.945 6.629 1.00 . A A . 3 TRP HZ2 1 1 20 7031 1 1 4 TRP HZ3 H 6.440 7.066 2.528 1.00 . A A . 3 TRP HZ3 1 1 20 7032 1 1 4 TRP N N 5.444 0.253 3.303 1.00 . A A . 3 TRP N 1 1 20 7033 1 1 4 TRP NE1 N 5.463 3.485 6.123 1.00 . A A . 3 TRP NE1 1 1 20 7034 1 1 4 TRP O O 6.238 1.399 0.319 1.00 . A A . 3 TRP O 1 1 20 7035 1 1 5 THR C C 7.838 3.306 0.001 1.00 . A A . 4 THR C 1 1 20 7036 1 1 5 THR CA C 8.007 3.239 1.518 1.00 . A A . 4 THR CA 1 1 20 7037 1 1 5 THR CB C 9.330 2.525 1.858 1.00 . A A . 4 THR CB 1 1 20 7038 1 1 5 THR CG2 C 10.526 3.409 1.533 1.00 . A A . 4 THR CG2 1 1 20 7039 1 1 5 THR H H 6.705 2.739 3.093 1.00 . A A . 4 THR H 1 1 20 7040 1 1 5 THR HA H 8.049 4.241 1.916 1.00 . A A . 4 THR HA 1 1 20 7041 1 1 5 THR HB H 9.397 1.621 1.270 1.00 . A A . 4 THR HB 1 1 20 7042 1 1 5 THR HG1 H 8.907 2.869 3.754 1.00 . A A . 4 THR HG1 1 1 20 7043 1 1 5 THR HG21 H 10.529 3.639 0.478 1.00 . A A . 4 THR HG21 1 1 20 7044 1 1 5 THR HG22 H 11.438 2.891 1.790 1.00 . A A . 4 THR HG22 1 1 20 7045 1 1 5 THR HG23 H 10.461 4.327 2.100 1.00 . A A . 4 THR HG23 1 1 20 7046 1 1 5 THR N N 6.872 2.576 2.145 1.00 . A A . 4 THR N 1 1 20 7047 1 1 5 THR O O 8.780 3.068 -0.754 1.00 . A A . 4 THR O 1 1 20 7048 1 1 5 THR OG1 O 9.355 2.186 3.249 1.00 . A A . 4 THR OG1 1 1 20 7049 1 1 6 GLY C C 4.998 4.315 -2.177 1.00 . A A . 5 GLY C 1 1 20 7050 1 1 6 GLY CA C 6.350 3.700 -1.857 1.00 . A A . 5 GLY CA 1 1 20 7051 1 1 6 GLY H H 5.916 3.840 0.208 1.00 . A A . 5 GLY H 1 1 20 7052 1 1 6 GLY HA2 H 7.122 4.283 -2.335 1.00 . A A . 5 GLY HA2 1 1 20 7053 1 1 6 GLY HA3 H 6.378 2.693 -2.250 1.00 . A A . 5 GLY HA3 1 1 20 7054 1 1 6 GLY N N 6.625 3.637 -0.438 1.00 . A A . 5 GLY N 1 1 20 7055 1 1 6 GLY O O 4.441 4.070 -3.243 1.00 . A A . 5 GLY O 1 1 20 7056 1 1 7 LEU C C 3.366 7.254 -1.670 1.00 . A A . 6 LEU C 1 1 20 7057 1 1 7 LEU CA C 3.173 5.760 -1.442 1.00 . A A . 6 LEU CA 1 1 20 7058 1 1 7 LEU CB C 2.280 5.541 -0.225 1.00 . A A . 6 LEU CB 1 1 20 7059 1 1 7 LEU CD1 C 3.199 7.183 1.450 1.00 . A A . 6 LEU CD1 1 1 20 7060 1 1 7 LEU CD2 C 2.191 5.036 2.229 1.00 . A A . 6 LEU CD2 1 1 20 7061 1 1 7 LEU CG C 2.980 5.712 1.124 1.00 . A A . 6 LEU CG 1 1 20 7062 1 1 7 LEU H H 4.935 5.218 -0.395 1.00 . A A . 6 LEU H 1 1 20 7063 1 1 7 LEU HA H 2.702 5.328 -2.312 1.00 . A A . 6 LEU HA 1 1 20 7064 1 1 7 LEU HB2 H 1.466 6.246 -0.277 1.00 . A A . 6 LEU HB2 1 1 20 7065 1 1 7 LEU HB3 H 1.877 4.542 -0.277 1.00 . A A . 6 LEU HB3 1 1 20 7066 1 1 7 LEU HD11 H 2.250 7.696 1.454 1.00 . A A . 6 LEU HD11 1 1 20 7067 1 1 7 LEU HD12 H 3.844 7.624 0.705 1.00 . A A . 6 LEU HD12 1 1 20 7068 1 1 7 LEU HD13 H 3.661 7.270 2.424 1.00 . A A . 6 LEU HD13 1 1 20 7069 1 1 7 LEU HD21 H 1.212 5.485 2.299 1.00 . A A . 6 LEU HD21 1 1 20 7070 1 1 7 LEU HD22 H 2.713 5.159 3.168 1.00 . A A . 6 LEU HD22 1 1 20 7071 1 1 7 LEU HD23 H 2.092 3.984 2.008 1.00 . A A . 6 LEU HD23 1 1 20 7072 1 1 7 LEU HG H 3.948 5.238 1.074 1.00 . A A . 6 LEU HG 1 1 20 7073 1 1 7 LEU N N 4.462 5.096 -1.245 1.00 . A A . 6 LEU N 1 1 20 7074 1 1 7 LEU O O 2.452 8.052 -1.465 1.00 . A A . 6 LEU O 1 1 20 7075 1 1 8 TYR C C 5.894 9.172 -3.501 1.00 . A A . 7 TYR C 1 1 20 7076 1 1 8 TYR CA C 4.908 9.009 -2.341 1.00 . A A . 7 TYR CA 1 1 20 7077 1 1 8 TYR CB C 5.510 9.604 -1.068 1.00 . A A . 7 TYR CB 1 1 20 7078 1 1 8 TYR CD1 C 6.614 7.466 -0.380 1.00 . A A . 7 TYR CD1 1 1 20 7079 1 1 8 TYR CD2 C 7.924 9.450 -0.321 1.00 . A A . 7 TYR CD2 1 1 20 7080 1 1 8 TYR CE1 C 7.680 6.731 0.042 1.00 . A A . 7 TYR CE1 1 1 20 7081 1 1 8 TYR CE2 C 9.013 8.715 0.114 1.00 . A A . 7 TYR CE2 1 1 20 7082 1 1 8 TYR CG C 6.706 8.831 -0.571 1.00 . A A . 7 TYR CG 1 1 20 7083 1 1 8 TYR CZ C 8.886 7.353 0.293 1.00 . A A . 7 TYR CZ 1 1 20 7084 1 1 8 TYR H H 5.236 6.929 -2.247 1.00 . A A . 7 TYR H 1 1 20 7085 1 1 8 TYR HA H 4.005 9.532 -2.572 1.00 . A A . 7 TYR HA 1 1 20 7086 1 1 8 TYR HB2 H 5.819 10.619 -1.258 1.00 . A A . 7 TYR HB2 1 1 20 7087 1 1 8 TYR HB3 H 4.763 9.592 -0.291 1.00 . A A . 7 TYR HB3 1 1 20 7088 1 1 8 TYR HD1 H 5.673 6.974 -0.564 1.00 . A A . 7 TYR HD1 1 1 20 7089 1 1 8 TYR HD2 H 8.013 10.516 -0.463 1.00 . A A . 7 TYR HD2 1 1 20 7090 1 1 8 TYR HE1 H 7.563 5.674 0.166 1.00 . A A . 7 TYR HE1 1 1 20 7091 1 1 8 TYR HE2 H 9.955 9.208 0.308 1.00 . A A . 7 TYR HE2 1 1 20 7092 1 1 8 TYR HH H 10.398 7.066 1.445 1.00 . A A . 7 TYR HH 1 1 20 7093 1 1 8 TYR N N 4.563 7.616 -2.104 1.00 . A A . 7 TYR N 1 1 20 7094 1 1 8 TYR O O 5.799 10.129 -4.270 1.00 . A A . 7 TYR O 1 1 20 7095 1 1 8 TYR OH O 9.965 6.612 0.719 1.00 . A A . 7 TYR OH 1 1 20 7096 1 1 9 THR C C 7.828 7.105 -5.611 1.00 . A A . 8 THR C 1 1 20 7097 1 1 9 THR CA C 7.848 8.318 -4.686 1.00 . A A . 8 THR CA 1 1 20 7098 1 1 9 THR CB C 9.262 8.456 -4.095 1.00 . A A . 8 THR CB 1 1 20 7099 1 1 9 THR CG2 C 9.443 9.816 -3.438 1.00 . A A . 8 THR CG2 1 1 20 7100 1 1 9 THR H H 6.858 7.485 -3.000 1.00 . A A . 8 THR H 1 1 20 7101 1 1 9 THR HA H 7.642 9.199 -5.270 1.00 . A A . 8 THR HA 1 1 20 7102 1 1 9 THR HB H 9.981 8.363 -4.897 1.00 . A A . 8 THR HB 1 1 20 7103 1 1 9 THR HG1 H 9.125 6.591 -3.456 1.00 . A A . 8 THR HG1 1 1 20 7104 1 1 9 THR HG21 H 8.658 9.974 -2.714 1.00 . A A . 8 THR HG21 1 1 20 7105 1 1 9 THR HG22 H 9.399 10.589 -4.191 1.00 . A A . 8 THR HG22 1 1 20 7106 1 1 9 THR HG23 H 10.402 9.851 -2.941 1.00 . A A . 8 THR HG23 1 1 20 7107 1 1 9 THR N N 6.839 8.239 -3.628 1.00 . A A . 8 THR N 1 1 20 7108 1 1 9 THR O O 8.766 6.889 -6.378 1.00 . A A . 8 THR O 1 1 20 7109 1 1 9 THR OG1 O 9.498 7.418 -3.134 1.00 . A A . 8 THR OG1 1 1 20 7110 1 1 10 LEU C C 5.175 4.843 -6.685 1.00 . A A . 9 LEU C 1 1 20 7111 1 1 10 LEU CA C 6.632 5.141 -6.393 1.00 . A A . 9 LEU CA 1 1 20 7112 1 1 10 LEU CB C 7.296 3.937 -5.724 1.00 . A A . 9 LEU CB 1 1 20 7113 1 1 10 LEU CD1 C 9.381 2.769 -4.978 1.00 . A A . 9 LEU CD1 1 1 20 7114 1 1 10 LEU CD2 C 9.321 3.896 -7.205 1.00 . A A . 9 LEU CD2 1 1 20 7115 1 1 10 LEU CG C 8.826 3.940 -5.767 1.00 . A A . 9 LEU CG 1 1 20 7116 1 1 10 LEU H H 6.038 6.554 -4.928 1.00 . A A . 9 LEU H 1 1 20 7117 1 1 10 LEU HA H 7.129 5.343 -7.316 1.00 . A A . 9 LEU HA 1 1 20 7118 1 1 10 LEU HB2 H 6.986 3.911 -4.687 1.00 . A A . 9 LEU HB2 1 1 20 7119 1 1 10 LEU HB3 H 6.942 3.040 -6.209 1.00 . A A . 9 LEU HB3 1 1 20 7120 1 1 10 LEU HD11 H 9.013 1.846 -5.399 1.00 . A A . 9 LEU HD11 1 1 20 7121 1 1 10 LEU HD12 H 9.065 2.847 -3.949 1.00 . A A . 9 LEU HD12 1 1 20 7122 1 1 10 LEU HD13 H 10.459 2.782 -5.025 1.00 . A A . 9 LEU HD13 1 1 20 7123 1 1 10 LEU HD21 H 8.961 4.765 -7.737 1.00 . A A . 9 LEU HD21 1 1 20 7124 1 1 10 LEU HD22 H 8.955 3.002 -7.686 1.00 . A A . 9 LEU HD22 1 1 20 7125 1 1 10 LEU HD23 H 10.401 3.892 -7.213 1.00 . A A . 9 LEU HD23 1 1 20 7126 1 1 10 LEU HG H 9.191 4.850 -5.315 1.00 . A A . 9 LEU HG 1 1 20 7127 1 1 10 LEU N N 6.759 6.327 -5.549 1.00 . A A . 9 LEU N 1 1 20 7128 1 1 10 LEU O O 4.793 4.549 -7.818 1.00 . A A . 9 LEU O 1 1 20 7129 1 1 11 LEU C C 2.635 3.331 -6.343 1.00 . A A . 10 LEU C 1 1 20 7130 1 1 11 LEU CA C 2.943 4.691 -5.725 1.00 . A A . 10 LEU CA 1 1 20 7131 1 1 11 LEU CB C 2.283 5.818 -6.514 1.00 . A A . 10 LEU CB 1 1 20 7132 1 1 11 LEU CD1 C 1.899 8.290 -6.722 1.00 . A A . 10 LEU CD1 1 1 20 7133 1 1 11 LEU CD2 C 3.093 7.381 -4.710 1.00 . A A . 10 LEU CD2 1 1 20 7134 1 1 11 LEU CG C 2.841 7.213 -6.207 1.00 . A A . 10 LEU CG 1 1 20 7135 1 1 11 LEU H H 4.772 5.179 -4.787 1.00 . A A . 10 LEU H 1 1 20 7136 1 1 11 LEU HA H 2.555 4.703 -4.718 1.00 . A A . 10 LEU HA 1 1 20 7137 1 1 11 LEU HB2 H 2.415 5.621 -7.567 1.00 . A A . 10 LEU HB2 1 1 20 7138 1 1 11 LEU HB3 H 1.226 5.817 -6.292 1.00 . A A . 10 LEU HB3 1 1 20 7139 1 1 11 LEU HD11 H 0.947 8.205 -6.219 1.00 . A A . 10 LEU HD11 1 1 20 7140 1 1 11 LEU HD12 H 1.757 8.168 -7.785 1.00 . A A . 10 LEU HD12 1 1 20 7141 1 1 11 LEU HD13 H 2.324 9.264 -6.526 1.00 . A A . 10 LEU HD13 1 1 20 7142 1 1 11 LEU HD21 H 2.180 7.186 -4.167 1.00 . A A . 10 LEU HD21 1 1 20 7143 1 1 11 LEU HD22 H 3.422 8.389 -4.511 1.00 . A A . 10 LEU HD22 1 1 20 7144 1 1 11 LEU HD23 H 3.860 6.683 -4.387 1.00 . A A . 10 LEU HD23 1 1 20 7145 1 1 11 LEU HG H 3.788 7.330 -6.715 1.00 . A A . 10 LEU HG 1 1 20 7146 1 1 11 LEU N N 4.379 4.930 -5.643 1.00 . A A . 10 LEU N 1 1 20 7147 1 1 11 LEU O O 1.497 3.051 -6.721 1.00 . A A . 10 LEU O 1 1 20 7148 1 1 12 SER C C 3.736 0.139 -5.863 1.00 . A A . 11 SER C 1 1 20 7149 1 1 12 SER CA C 3.513 1.150 -6.977 1.00 . A A . 11 SER CA 1 1 20 7150 1 1 12 SER CB C 4.509 0.915 -8.114 1.00 . A A . 11 SER CB 1 1 20 7151 1 1 12 SER H H 4.543 2.787 -6.129 1.00 . A A . 11 SER H 1 1 20 7152 1 1 12 SER HA H 2.506 1.046 -7.354 1.00 . A A . 11 SER HA 1 1 20 7153 1 1 12 SER HB2 H 4.335 1.637 -8.898 1.00 . A A . 11 SER HB2 1 1 20 7154 1 1 12 SER HB3 H 5.515 1.029 -7.737 1.00 . A A . 11 SER HB3 1 1 20 7155 1 1 12 SER HG H 3.571 -0.794 -8.310 1.00 . A A . 11 SER HG 1 1 20 7156 1 1 12 SER N N 3.659 2.493 -6.437 1.00 . A A . 11 SER N 1 1 20 7157 1 1 12 SER O O 3.681 -1.073 -6.075 1.00 . A A . 11 SER O 1 1 20 7158 1 1 12 SER OG O 4.370 -0.387 -8.655 1.00 . A A . 11 SER OG 1 1 20 7159 1 1 13 ARG C C 3.098 0.014 -2.483 1.00 . A A . 12 ARG C 1 1 20 7160 1 1 13 ARG CA C 4.229 -0.150 -3.488 1.00 . A A . 12 ARG CA 1 1 20 7161 1 1 13 ARG CB C 5.553 0.254 -2.841 1.00 . A A . 12 ARG CB 1 1 20 7162 1 1 13 ARG CD C 8.057 0.373 -3.009 1.00 . A A . 12 ARG CD 1 1 20 7163 1 1 13 ARG CG C 6.776 -0.127 -3.658 1.00 . A A . 12 ARG CG 1 1 20 7164 1 1 13 ARG CZ C 10.471 -0.070 -3.189 1.00 . A A . 12 ARG CZ 1 1 20 7165 1 1 13 ARG H H 4.014 1.642 -4.579 1.00 . A A . 12 ARG H 1 1 20 7166 1 1 13 ARG HA H 4.279 -1.179 -3.796 1.00 . A A . 12 ARG HA 1 1 20 7167 1 1 13 ARG HB2 H 5.556 1.327 -2.709 1.00 . A A . 12 ARG HB2 1 1 20 7168 1 1 13 ARG HB3 H 5.629 -0.221 -1.874 1.00 . A A . 12 ARG HB3 1 1 20 7169 1 1 13 ARG HD2 H 8.054 1.455 -3.022 1.00 . A A . 12 ARG HD2 1 1 20 7170 1 1 13 ARG HD3 H 8.087 0.027 -1.987 1.00 . A A . 12 ARG HD3 1 1 20 7171 1 1 13 ARG HE H 9.128 -0.471 -4.608 1.00 . A A . 12 ARG HE 1 1 20 7172 1 1 13 ARG HG2 H 6.822 -1.203 -3.740 1.00 . A A . 12 ARG HG2 1 1 20 7173 1 1 13 ARG HG3 H 6.690 0.308 -4.643 1.00 . A A . 12 ARG HG3 1 1 20 7174 1 1 13 ARG HH11 H 11.587 0.443 -1.584 1.00 . A A . 12 ARG HH11 1 1 20 7175 1 1 13 ARG HH12 H 9.891 0.762 -1.440 1.00 . A A . 12 ARG HH12 1 1 20 7176 1 1 13 ARG HH21 H 11.359 -0.896 -4.806 1.00 . A A . 12 ARG HH21 1 1 20 7177 1 1 13 ARG HH22 H 12.421 -0.500 -3.497 1.00 . A A . 12 ARG HH22 1 1 20 7178 1 1 13 ARG N N 3.988 0.667 -4.668 1.00 . A A . 12 ARG N 1 1 20 7179 1 1 13 ARG NE N 9.247 -0.105 -3.707 1.00 . A A . 12 ARG NE 1 1 20 7180 1 1 13 ARG NH1 N 10.666 0.418 -1.971 1.00 . A A . 12 ARG NH1 1 1 20 7181 1 1 13 ARG NH2 N 11.502 -0.526 -3.888 1.00 . A A . 12 ARG NH2 1 1 20 7182 1 1 13 ARG O O 3.127 -0.559 -1.395 1.00 . A A . 12 ARG O 1 1 20 7183 1 1 14 VAL C C -0.327 0.544 -2.634 1.00 . A A . 13 VAL C 1 1 20 7184 1 1 14 VAL CA C 0.964 1.065 -2.012 1.00 . A A . 13 VAL CA 1 1 20 7185 1 1 14 VAL CB C 0.827 2.571 -1.722 1.00 . A A . 13 VAL CB 1 1 20 7186 1 1 14 VAL CG1 C 0.914 3.373 -3.009 1.00 . A A . 13 VAL CG1 1 1 20 7187 1 1 14 VAL CG2 C -0.464 2.869 -0.977 1.00 . A A . 13 VAL CG2 1 1 20 7188 1 1 14 VAL H H 2.142 1.215 -3.744 1.00 . A A . 13 VAL H 1 1 20 7189 1 1 14 VAL HA H 1.128 0.559 -1.076 1.00 . A A . 13 VAL HA 1 1 20 7190 1 1 14 VAL HB H 1.648 2.863 -1.094 1.00 . A A . 13 VAL HB 1 1 20 7191 1 1 14 VAL HG11 H 1.840 3.143 -3.512 1.00 . A A . 13 VAL HG11 1 1 20 7192 1 1 14 VAL HG12 H 0.881 4.427 -2.779 1.00 . A A . 13 VAL HG12 1 1 20 7193 1 1 14 VAL HG13 H 0.084 3.117 -3.649 1.00 . A A . 13 VAL HG13 1 1 20 7194 1 1 14 VAL HG21 H -0.493 2.293 -0.065 1.00 . A A . 13 VAL HG21 1 1 20 7195 1 1 14 VAL HG22 H -1.306 2.606 -1.599 1.00 . A A . 13 VAL HG22 1 1 20 7196 1 1 14 VAL HG23 H -0.505 3.922 -0.741 1.00 . A A . 13 VAL HG23 1 1 20 7197 1 1 14 VAL N N 2.105 0.801 -2.865 1.00 . A A . 13 VAL N 1 1 20 7198 1 1 14 VAL O O -0.973 1.227 -3.428 1.00 . A A . 13 VAL O 1 1 20 7199 1 1 15 ASN C C -3.124 -0.492 -2.302 1.00 . A A . 14 ASN C 1 1 20 7200 1 1 15 ASN CA C -1.911 -1.291 -2.772 1.00 . A A . 14 ASN CA 1 1 20 7201 1 1 15 ASN CB C -2.021 -2.742 -2.296 1.00 . A A . 14 ASN CB 1 1 20 7202 1 1 15 ASN CG C -2.272 -2.856 -0.802 1.00 . A A . 14 ASN CG 1 1 20 7203 1 1 15 ASN H H -0.106 -1.187 -1.671 1.00 . A A . 14 ASN H 1 1 20 7204 1 1 15 ASN HA H -1.879 -1.273 -3.852 1.00 . A A . 14 ASN HA 1 1 20 7205 1 1 15 ASN HB2 H -2.838 -3.222 -2.814 1.00 . A A . 14 ASN HB2 1 1 20 7206 1 1 15 ASN HB3 H -1.102 -3.260 -2.527 1.00 . A A . 14 ASN HB3 1 1 20 7207 1 1 15 ASN HD21 H -1.222 -1.201 -0.462 1.00 . A A . 14 ASN HD21 1 1 20 7208 1 1 15 ASN HD22 H -1.890 -1.966 0.935 1.00 . A A . 14 ASN HD22 1 1 20 7209 1 1 15 ASN N N -0.686 -0.680 -2.274 1.00 . A A . 14 ASN N 1 1 20 7210 1 1 15 ASN ND2 N -1.741 -1.912 -0.032 1.00 . A A . 14 ASN ND2 1 1 20 7211 1 1 15 ASN O O -4.262 -0.800 -2.658 1.00 . A A . 14 ASN O 1 1 20 7212 1 1 15 ASN OD1 O -2.934 -3.787 -0.344 1.00 . A A . 14 ASN OD1 1 1 20 7213 1 1 16 ARG C C -4.823 0.637 -0.010 1.00 . A A . 15 ARG C 1 1 20 7214 1 1 16 ARG CA C -3.903 1.401 -0.958 1.00 . A A . 15 ARG CA 1 1 20 7215 1 1 16 ARG CB C -4.719 2.023 -2.094 1.00 . A A . 15 ARG CB 1 1 20 7216 1 1 16 ARG CD C -4.736 3.421 -4.182 1.00 . A A . 15 ARG CD 1 1 20 7217 1 1 16 ARG CG C -3.884 2.845 -3.062 1.00 . A A . 15 ARG CG 1 1 20 7218 1 1 16 ARG CZ C -4.437 4.740 -6.237 1.00 . A A . 15 ARG CZ 1 1 20 7219 1 1 16 ARG H H -1.930 0.707 -1.240 1.00 . A A . 15 ARG H 1 1 20 7220 1 1 16 ARG HA H -3.414 2.192 -0.405 1.00 . A A . 15 ARG HA 1 1 20 7221 1 1 16 ARG HB2 H -5.203 1.234 -2.649 1.00 . A A . 15 ARG HB2 1 1 20 7222 1 1 16 ARG HB3 H -5.474 2.667 -1.668 1.00 . A A . 15 ARG HB3 1 1 20 7223 1 1 16 ARG HD2 H -5.208 2.607 -4.713 1.00 . A A . 15 ARG HD2 1 1 20 7224 1 1 16 ARG HD3 H -5.495 4.056 -3.749 1.00 . A A . 15 ARG HD3 1 1 20 7225 1 1 16 ARG HE H -2.994 4.338 -4.918 1.00 . A A . 15 ARG HE 1 1 20 7226 1 1 16 ARG HG2 H -3.419 3.657 -2.523 1.00 . A A . 15 ARG HG2 1 1 20 7227 1 1 16 ARG HG3 H -3.122 2.212 -3.492 1.00 . A A . 15 ARG HG3 1 1 20 7228 1 1 16 ARG HH11 H -6.313 4.050 -5.940 1.00 . A A . 15 ARG HH11 1 1 20 7229 1 1 16 ARG HH12 H -6.084 4.981 -7.382 1.00 . A A . 15 ARG HH12 1 1 20 7230 1 1 16 ARG HH21 H -2.684 5.567 -6.814 1.00 . A A . 15 ARG HH21 1 1 20 7231 1 1 16 ARG HH22 H -4.022 5.843 -7.879 1.00 . A A . 15 ARG HH22 1 1 20 7232 1 1 16 ARG N N -2.860 0.533 -1.491 1.00 . A A . 15 ARG N 1 1 20 7233 1 1 16 ARG NE N -3.943 4.204 -5.125 1.00 . A A . 15 ARG NE 1 1 20 7234 1 1 16 ARG NH1 N -5.716 4.576 -6.545 1.00 . A A . 15 ARG NH1 1 1 20 7235 1 1 16 ARG NH2 N -3.650 5.440 -7.043 1.00 . A A . 15 ARG NH2 1 1 20 7236 1 1 16 ARG O O -4.839 -0.595 -0.003 1.00 . A A . 15 ARG O 1 1 20 7237 1 1 17 HIS C C -5.777 -0.132 2.722 1.00 . A A . 16 HIS C 1 1 20 7238 1 1 17 HIS CA C -6.513 0.780 1.745 1.00 . A A . 16 HIS CA 1 1 20 7239 1 1 17 HIS CB C -7.603 -0.007 1.013 1.00 . A A . 16 HIS CB 1 1 20 7240 1 1 17 HIS CD2 C -9.442 1.689 0.321 1.00 . A A . 16 HIS CD2 1 1 20 7241 1 1 17 HIS CE1 C -9.096 1.668 -1.844 1.00 . A A . 16 HIS CE1 1 1 20 7242 1 1 17 HIS CG C -8.422 0.831 0.080 1.00 . A A . 16 HIS CG 1 1 20 7243 1 1 17 HIS H H -5.526 2.356 0.732 1.00 . A A . 16 HIS H 1 1 20 7244 1 1 17 HIS HA H -6.974 1.582 2.301 1.00 . A A . 16 HIS HA 1 1 20 7245 1 1 17 HIS HB2 H -7.144 -0.795 0.436 1.00 . A A . 16 HIS HB2 1 1 20 7246 1 1 17 HIS HB3 H -8.272 -0.443 1.740 1.00 . A A . 16 HIS HB3 1 1 20 7247 1 1 17 HIS HD1 H -7.560 0.319 -1.774 1.00 . A A . 16 HIS HD1 1 1 20 7248 1 1 17 HIS HD2 H -9.862 1.930 1.287 1.00 . A A . 16 HIS HD2 1 1 20 7249 1 1 17 HIS HE1 H -9.180 1.878 -2.900 1.00 . A A . 16 HIS HE1 1 1 20 7250 1 1 17 HIS HE2 H -10.565 2.842 -1.029 1.00 . A A . 16 HIS HE2 1 1 20 7251 1 1 17 HIS N N -5.587 1.379 0.787 1.00 . A A . 16 HIS N 1 1 20 7252 1 1 17 HIS ND1 N -8.231 0.841 -1.286 1.00 . A A . 16 HIS ND1 1 1 20 7253 1 1 17 HIS NE2 N -9.842 2.195 -0.890 1.00 . A A . 16 HIS NE2 1 1 20 7254 1 1 17 HIS O O -5.518 -1.299 2.424 1.00 . A A . 16 HIS O 1 1 20 7255 1 1 18 SER C C -5.660 -0.686 6.079 1.00 . A A . 17 SER C 1 1 20 7256 1 1 18 SER CA C -4.736 -0.356 4.911 1.00 . A A . 17 SER CA 1 1 20 7257 1 1 18 SER CB C -3.520 0.425 5.414 1.00 . A A . 17 SER CB 1 1 20 7258 1 1 18 SER H H -5.675 1.344 4.068 1.00 . A A . 17 SER H 1 1 20 7259 1 1 18 SER HA H -4.399 -1.278 4.462 1.00 . A A . 17 SER HA 1 1 20 7260 1 1 18 SER HB2 H -3.009 -0.156 6.167 1.00 . A A . 17 SER HB2 1 1 20 7261 1 1 18 SER HB3 H -2.850 0.614 4.588 1.00 . A A . 17 SER HB3 1 1 20 7262 1 1 18 SER HG H -3.125 2.181 6.187 1.00 . A A . 17 SER HG 1 1 20 7263 1 1 18 SER N N -5.442 0.408 3.889 1.00 . A A . 17 SER N 1 1 20 7264 1 1 18 SER O O -6.361 0.184 6.594 1.00 . A A . 17 SER O 1 1 20 7265 1 1 18 SER OG O -3.907 1.665 5.979 1.00 . A A . 17 SER OG 1 1 20 7266 1 1 19 THR C C -6.017 -3.738 8.145 1.00 . A A . 18 THR C 1 1 20 7267 1 1 19 THR CA C -6.493 -2.397 7.597 1.00 . A A . 18 THR CA 1 1 20 7268 1 1 19 THR CB C -7.968 -2.523 7.171 1.00 . A A . 18 THR CB 1 1 20 7269 1 1 19 THR CG2 C -8.112 -3.475 5.992 1.00 . A A . 18 THR CG2 1 1 20 7270 1 1 19 THR H H -5.076 -2.599 6.039 1.00 . A A . 18 THR H 1 1 20 7271 1 1 19 THR HA H -6.430 -1.657 8.382 1.00 . A A . 18 THR HA 1 1 20 7272 1 1 19 THR HB H -8.326 -1.548 6.873 1.00 . A A . 18 THR HB 1 1 20 7273 1 1 19 THR HG1 H -8.231 -2.979 9.072 1.00 . A A . 18 THR HG1 1 1 20 7274 1 1 19 THR HG21 H -7.761 -4.455 6.276 1.00 . A A . 18 THR HG21 1 1 20 7275 1 1 19 THR HG22 H -7.527 -3.109 5.161 1.00 . A A . 18 THR HG22 1 1 20 7276 1 1 19 THR HG23 H -9.151 -3.534 5.702 1.00 . A A . 18 THR HG23 1 1 20 7277 1 1 19 THR N N -5.655 -1.951 6.491 1.00 . A A . 18 THR N 1 1 20 7278 1 1 19 THR O O -5.474 -4.562 7.407 1.00 . A A . 18 THR O 1 1 20 7279 1 1 19 THR OG1 O -8.758 -2.995 8.270 1.00 . A A . 18 THR OG1 1 1 20 7280 1 1 20 ALA C C -4.312 -5.406 9.992 1.00 . A A . 19 ALA C 1 1 20 7281 1 1 20 ALA CA C -5.818 -5.186 10.101 1.00 . A A . 19 ALA CA 1 1 20 7282 1 1 20 ALA CB C -6.571 -6.370 9.511 1.00 . A A . 19 ALA CB 1 1 20 7283 1 1 20 ALA H H -6.659 -3.248 9.973 1.00 . A A . 19 ALA H 1 1 20 7284 1 1 20 ALA HA H -6.083 -5.108 11.145 1.00 . A A . 19 ALA HA 1 1 20 7285 1 1 20 ALA HB1 H -6.305 -6.485 8.471 1.00 . A A . 19 ALA HB1 1 1 20 7286 1 1 20 ALA HB2 H -7.634 -6.199 9.594 1.00 . A A . 19 ALA HB2 1 1 20 7287 1 1 20 ALA HB3 H -6.309 -7.268 10.051 1.00 . A A . 19 ALA HB3 1 1 20 7288 1 1 20 ALA N N -6.223 -3.947 9.443 1.00 . A A . 19 ALA N 1 1 20 7289 1 1 20 ALA O O -3.810 -5.846 8.957 1.00 . A A . 19 ALA O 1 1 20 7290 1 1 21 ILE C C -1.761 -6.586 11.740 1.00 . A A . 20 ILE C 1 1 20 7291 1 1 21 ILE CA C -2.148 -5.257 11.098 1.00 . A A . 20 ILE CA 1 1 20 7292 1 1 21 ILE CB C -1.469 -4.108 11.868 1.00 . A A . 20 ILE CB 1 1 20 7293 1 1 21 ILE CD1 C -1.361 -1.567 12.054 1.00 . A A . 20 ILE CD1 1 1 20 7294 1 1 21 ILE CG1 C -1.874 -2.758 11.271 1.00 . A A . 20 ILE CG1 1 1 20 7295 1 1 21 ILE CG2 C 0.044 -4.275 11.844 1.00 . A A . 20 ILE CG2 1 1 20 7296 1 1 21 ILE H H -4.054 -4.747 11.862 1.00 . A A . 20 ILE H 1 1 20 7297 1 1 21 ILE HA H -1.789 -5.242 10.079 1.00 . A A . 20 ILE HA 1 1 20 7298 1 1 21 ILE HB H -1.794 -4.152 12.897 1.00 . A A . 20 ILE HB 1 1 20 7299 1 1 21 ILE HD11 H -0.281 -1.586 12.072 1.00 . A A . 20 ILE HD11 1 1 20 7300 1 1 21 ILE HD12 H -1.737 -1.613 13.066 1.00 . A A . 20 ILE HD12 1 1 20 7301 1 1 21 ILE HD13 H -1.699 -0.655 11.585 1.00 . A A . 20 ILE HD13 1 1 20 7302 1 1 21 ILE HG12 H -1.484 -2.684 10.267 1.00 . A A . 20 ILE HG12 1 1 20 7303 1 1 21 ILE HG13 H -2.951 -2.694 11.240 1.00 . A A . 20 ILE HG13 1 1 20 7304 1 1 21 ILE HG21 H 0.312 -5.208 12.317 1.00 . A A . 20 ILE HG21 1 1 20 7305 1 1 21 ILE HG22 H 0.506 -3.457 12.375 1.00 . A A . 20 ILE HG22 1 1 20 7306 1 1 21 ILE HG23 H 0.390 -4.280 10.821 1.00 . A A . 20 ILE HG23 1 1 20 7307 1 1 21 ILE N N -3.596 -5.094 11.068 1.00 . A A . 20 ILE N 1 1 20 7308 1 1 21 ILE O O -2.247 -6.930 12.816 1.00 . A A . 20 ILE O 1 1 20 7309 1 1 22 GLY C C 1.030 -8.861 11.351 1.00 . A A . 21 GLY C 1 1 20 7310 1 1 22 GLY CA C -0.445 -8.608 11.591 1.00 . A A . 21 GLY CA 1 1 20 7311 1 1 22 GLY H H -0.528 -7.000 10.218 1.00 . A A . 21 GLY H 1 1 20 7312 1 1 22 GLY HA2 H -0.635 -8.637 12.654 1.00 . A A . 21 GLY HA2 1 1 20 7313 1 1 22 GLY HA3 H -1.015 -9.392 11.114 1.00 . A A . 21 GLY HA3 1 1 20 7314 1 1 22 GLY N N -0.882 -7.327 11.071 1.00 . A A . 21 GLY N 1 1 20 7315 1 1 22 GLY O O 1.839 -7.934 11.382 1.00 . A A . 21 GLY O 1 1 20 7316 1 1 23 ARG C C 3.097 -10.430 9.374 1.00 . A A . 22 ARG C 1 1 20 7317 1 1 23 ARG CA C 2.769 -10.496 10.864 1.00 . A A . 22 ARG CA 1 1 20 7318 1 1 23 ARG CB C 3.044 -11.902 11.408 1.00 . A A . 22 ARG CB 1 1 20 7319 1 1 23 ARG CD C 2.289 -14.290 11.625 1.00 . A A . 22 ARG CD 1 1 20 7320 1 1 23 ARG CG C 1.987 -12.927 11.025 1.00 . A A . 22 ARG CG 1 1 20 7321 1 1 23 ARG CZ C 2.404 -15.336 13.850 1.00 . A A . 22 ARG CZ 1 1 20 7322 1 1 23 ARG H H 0.689 -10.815 11.098 1.00 . A A . 22 ARG H 1 1 20 7323 1 1 23 ARG HA H 3.396 -9.791 11.388 1.00 . A A . 22 ARG HA 1 1 20 7324 1 1 23 ARG HB2 H 3.996 -12.241 11.028 1.00 . A A . 22 ARG HB2 1 1 20 7325 1 1 23 ARG HB3 H 3.093 -11.853 12.485 1.00 . A A . 22 ARG HB3 1 1 20 7326 1 1 23 ARG HD2 H 1.528 -14.986 11.305 1.00 . A A . 22 ARG HD2 1 1 20 7327 1 1 23 ARG HD3 H 3.253 -14.620 11.269 1.00 . A A . 22 ARG HD3 1 1 20 7328 1 1 23 ARG HE H 2.253 -13.375 13.518 1.00 . A A . 22 ARG HE 1 1 20 7329 1 1 23 ARG HG2 H 1.026 -12.590 11.386 1.00 . A A . 22 ARG HG2 1 1 20 7330 1 1 23 ARG HG3 H 1.959 -13.016 9.949 1.00 . A A . 22 ARG HG3 1 1 20 7331 1 1 23 ARG HH11 H 2.554 -17.352 13.872 1.00 . A A . 22 ARG HH11 1 1 20 7332 1 1 23 ARG HH12 H 2.474 -16.633 12.300 1.00 . A A . 22 ARG HH12 1 1 20 7333 1 1 23 ARG HH21 H 2.357 -14.315 15.592 1.00 . A A . 22 ARG HH21 1 1 20 7334 1 1 23 ARG HH22 H 2.487 -16.035 15.744 1.00 . A A . 22 ARG HH22 1 1 20 7335 1 1 23 ARG N N 1.381 -10.121 11.110 1.00 . A A . 22 ARG N 1 1 20 7336 1 1 23 ARG NE N 2.311 -14.252 13.086 1.00 . A A . 22 ARG NE 1 1 20 7337 1 1 23 ARG NH1 N 2.483 -16.539 13.295 1.00 . A A . 22 ARG NH1 1 1 20 7338 1 1 23 ARG NH2 N 2.417 -15.219 15.170 1.00 . A A . 22 ARG NH2 1 1 20 7339 1 1 23 ARG O O 2.883 -11.440 8.671 1.00 . A A . 22 ARG O 1 1 20 7340 1 1 23 ARG OXT O 3.568 -9.365 8.922 1.00 . A A . 22 ARG OXT 1 1 stop_ save_
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