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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
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564480 |
4apd ![]() ![]() |
18378 | cing | 4-filtered-FRED | STAR | entry | full | 164 |
data_FRED_restraints_with_modified_coordinates_PDB_code_4apd # This FRED archive file contains, for PDB entry <4apd>: # # - 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_4apd _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 4apd _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 3744.15 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 $LIRAGLUTIDE A . 1 1 2 . 2 $N_HEXADECANOYL_L_GLUTAMIC_ACID B . 1 1 stop_ loop_ _PDBX_nonpoly_scheme.Entity_assembly_ID _PDBX_nonpoly_scheme.Entity_ID _PDBX_nonpoly_scheme.Mon_ID _PDBX_nonpoly_scheme.Comp_index_ID _PDBX_nonpoly_scheme.Comp_ID _PDBX_nonpoly_scheme.Entry_ID _PDBX_nonpoly_scheme.Assembly_ID 2 2 . 1 . 1 1 stop_ save_ save_LIRAGLUTIDE _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name LIRAGLUTIDE _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code HAEGTFTSDVSSYLEGQAAKEFIAWLVRGRG _Entity.Number_of_monomers 31 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 HIS . 1 1 2 ALA . 1 1 3 GLU . 1 1 4 GLY . 1 1 5 THR . 1 1 6 PHE . 1 1 7 THR . 1 1 8 SER . 1 1 9 ASP . 1 1 10 VAL . 1 1 11 SER . 1 1 12 SER . 1 1 13 TYR . 1 1 14 LEU . 1 1 15 GLU . 1 1 16 GLY . 1 1 17 GLN . 1 1 18 ALA . 1 1 19 ALA . 1 1 20 LYS . 1 1 21 GLU . 1 1 22 PHE . 1 1 23 ILE . 1 1 24 ALA . 1 1 25 TRP . 1 1 26 LEU . 1 1 27 VAL . 1 1 28 ARG . 1 1 29 GLY . 1 1 30 ARG . 1 1 31 GLY . 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 HIS 1 1 1 1 ALA 2 2 1 1 GLU 3 3 1 1 GLY 4 4 1 1 THR 5 5 1 1 PHE 6 6 1 1 THR 7 7 1 1 SER 8 8 1 1 ASP 9 9 1 1 VAL 10 10 1 1 SER 11 11 1 1 SER 12 12 1 1 TYR 13 13 1 1 LEU 14 14 1 1 GLU 15 15 1 1 GLY 16 16 1 1 GLN 17 17 1 1 ALA 18 18 1 1 ALA 19 19 1 1 LYS 20 20 1 1 GLU 21 21 1 1 PHE 22 22 1 1 ILE 23 23 1 1 ALA 24 24 1 1 TRP 25 25 1 1 LEU 26 26 1 1 VAL 27 27 1 1 ARG 28 28 1 1 GLY 29 29 1 1 ARG 30 30 1 1 GLY 31 31 1 1 stop_ save_ save_N_HEXADECANOYL_L_GLUTAMIC_ACID _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "N HEXADECANOYL L GLUTAMIC ACID" _Entity.Type non-polymer loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . $. 1 2 stop_ save_ save_. _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID . _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 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 ALA HA A 8 . HA 1 1 1 1 2 1 1 3 GLU H A 9 . HN 1 1 2 1 1 1 1 3 GLU HA A 9 . HA 1 1 2 1 2 1 1 4 GLY H A 10 . HN 1 1 3 1 1 1 1 4 GLY QA A 10 . HA# 1 1 3 1 2 1 1 5 THR MG A 11 . HG2# 1 1 4 1 1 1 1 5 THR HA A 11 . HA 1 1 4 1 2 1 1 6 PHE H A 12 . HN 1 1 5 1 1 1 1 5 THR HB A 11 . HB 1 1 5 1 2 1 1 6 PHE H A 12 . HN 1 1 6 1 1 1 1 5 THR MG A 11 . HG2# 1 1 6 1 2 1 1 6 PHE H A 12 . HN 1 1 7 1 1 1 1 5 THR MG A 11 . HG2# 1 1 7 1 2 1 1 6 PHE QB A 12 . HB# 1 1 8 1 1 1 1 6 PHE HA A 12 . HA 1 1 8 1 2 1 1 7 THR H A 13 . HN 1 1 9 1 1 1 1 6 PHE HA A 12 . HA 1 1 9 1 2 1 1 7 THR MG A 13 . HG2# 1 1 10 1 1 1 1 6 PHE HA A 12 . HA 1 1 10 1 2 1 1 9 ASP QB A 15 . HB# 1 1 11 1 1 1 1 6 PHE HA A 12 . HA 1 1 11 1 2 1 1 10 VAL HB A 16 . HB 1 1 12 1 1 1 1 6 PHE QB A 12 . HB# 1 1 12 1 2 1 1 7 THR H A 13 . HN 1 1 13 1 1 1 1 6 PHE QD A 12 . HD# 1 1 13 1 2 1 1 10 VAL QG A 16 . HG# 1 1 14 1 1 1 1 6 PHE QE A 12 . HE# 1 1 14 1 2 1 1 10 VAL QG A 16 . HG# 1 1 15 1 1 1 1 7 THR HA A 13 . HA 1 1 15 1 2 1 1 10 VAL HB A 16 . HB# 1 1 16 1 1 1 1 7 THR HA A 13 . HA 1 1 16 1 2 1 1 10 VAL QG A 16 . HG# 1 1 17 1 1 1 1 7 THR MG A 13 . HG2# 1 1 17 1 2 1 1 8 SER HA A 14 . HA 1 1 18 1 1 1 1 8 SER HA A 14 . HA 1 1 18 1 2 1 1 9 ASP H A 15 . HN 1 1 19 1 1 1 1 8 SER HA A 14 . HA 1 1 19 1 2 1 1 10 VAL QG A 16 . HG# 1 1 20 1 1 1 1 8 SER QB A 14 . HB# 1 1 20 1 2 1 1 9 ASP H A 15 . HN 1 1 21 1 1 1 1 9 ASP H A 15 . HN 1 1 21 1 2 1 1 10 VAL H A 16 . HN 1 1 22 1 1 1 1 9 ASP HA A 15 . HA 1 1 22 1 2 1 1 12 SER QB A 18 . HB# 1 1 23 1 1 1 1 9 ASP QB A 15 . HB# 1 1 23 1 2 1 1 10 VAL H A 16 . HN 1 1 24 1 1 1 1 9 ASP QB A 15 . HB# 1 1 24 1 2 1 1 10 VAL QG A 16 . HG# 1 1 25 1 1 1 1 10 VAL HA A 16 . HA 1 1 25 1 2 1 1 13 TYR QB A 19 . HB# 1 1 26 1 1 1 1 10 VAL HA A 16 . HA 1 1 26 1 2 1 1 13 TYR QD A 19 . HD# 1 1 27 1 1 1 1 10 VAL HA A 16 . HA 1 1 27 1 2 1 1 13 TYR QE A 19 . HE# 1 1 28 1 1 1 1 10 VAL HA A 16 . HA 1 1 28 1 2 1 1 14 LEU QD A 20 . HD# 1 1 29 1 1 1 1 10 VAL QG A 16 . HG# 1 1 29 1 2 1 1 13 TYR QB A 19 . HB# 1 1 30 1 1 1 1 10 VAL QG A 16 . HG# 1 1 30 1 2 1 1 13 TYR QD A 19 . HD# 1 1 31 1 1 1 1 10 VAL QG A 16 . HG# 1 1 31 1 2 1 1 13 TYR QE A 19 . HE# 1 1 32 1 1 1 1 11 SER HA A 17 . HA 1 1 32 1 2 1 1 12 SER H A 18 . HN 1 1 33 1 1 1 1 11 SER HA A 17 . HA 1 1 33 1 2 1 1 14 LEU QB A 20 . HB# 1 1 34 1 1 1 1 11 SER QB A 17 . HB# 1 1 34 1 2 1 1 12 SER H A 18 . HN 1 1 35 1 1 1 1 12 SER H A 18 . HN 1 1 35 1 2 1 1 13 TYR H A 19 . HN 1 1 36 1 1 1 1 12 SER H A 18 . HN 1 1 36 1 2 1 1 13 TYR HA A 19 . HA 1 1 37 1 1 1 1 12 SER H A 18 . HN 1 1 37 1 2 1 1 13 TYR QD A 19 . HD# 1 1 38 1 1 1 1 13 TYR HA A 19 . HA 1 1 38 1 2 1 1 14 LEU QD A 20 . HD# 1 1 39 1 1 1 1 13 TYR HA A 19 . HA 1 1 39 1 2 1 1 14 LEU HG A 20 . HG 1 1 40 1 1 1 1 13 TYR QD A 19 . HD# 1 1 40 1 2 1 1 14 LEU QD A 20 . HD# 1 1 41 1 1 1 1 13 TYR QD A 19 . HD# 1 1 41 1 2 1 1 14 LEU HG A 20 . HG 1 1 42 1 1 1 1 13 TYR QE A 19 . HE# 1 1 42 1 2 1 1 14 LEU QD A 20 . HD# 1 1 43 1 1 1 1 13 TYR QE A 19 . HE# 1 1 43 1 2 1 1 14 LEU HG A 20 . HG 1 1 44 1 1 1 1 17 GLN HA A 23 . HA 1 1 44 1 2 1 1 18 ALA H A 24 . HN 1 1 45 1 1 1 1 17 GLN QB A 23 . HB# 1 1 45 1 2 1 1 18 ALA H A 24 . HN 1 1 46 1 1 1 1 17 GLN QE A 23 . HE2# 1 1 46 1 2 1 1 18 ALA H A 24 . HN 1 1 47 1 1 1 1 17 GLN QE A 23 . HE2# 1 1 47 1 2 1 1 21 GLU QG A 27 . HG# 1 1 48 1 1 1 1 17 GLN QG A 23 . HG# 1 1 48 1 2 1 1 18 ALA H A 24 . HN 1 1 49 1 1 1 1 18 ALA H A 24 . HN 1 1 49 1 2 1 1 19 ALA H A 25 . HN 1 1 50 1 1 1 1 18 ALA HA A 24 . HA 1 1 50 1 2 1 1 19 ALA H A 25 . HN 1 1 51 1 1 1 1 18 ALA HA A 24 . HA 1 1 51 1 2 1 1 21 GLU QB A 27 . HB# 1 1 52 1 1 1 1 18 ALA MB A 24 . HB# 1 1 52 1 2 1 1 21 GLU QB A 27 . HB# 1 1 53 1 1 1 1 18 ALA MB A 24 . HB# 1 1 53 1 2 1 1 21 GLU QG A 27 . HG# 1 1 54 1 1 1 1 19 ALA HA A 25 . HA 1 1 54 1 2 1 1 22 PHE QB A 28 . HB# 1 1 55 1 1 1 1 19 ALA HA A 25 . HA 1 1 55 1 2 1 1 22 PHE QD A 28 . HD# 1 1 56 1 1 1 1 19 ALA HA A 25 . HA 1 1 56 1 2 1 1 22 PHE QE A 28 . HE# 1 1 57 1 1 1 1 19 ALA MB A 25 . HB# 1 1 57 1 2 1 1 22 PHE QD A 28 . HD# 1 1 58 1 1 1 1 20 LYS HA A 26 . HA 1 1 58 1 2 1 1 21 GLU H A 27 . HN 1 1 59 1 1 1 1 20 LYS HA A 26 . HA 1 1 59 1 2 1 1 23 ILE HA A 29 . HA 1 1 60 1 1 1 1 20 LYS HA A 26 . HA 1 1 60 1 2 1 1 23 ILE HB A 29 . HB 1 1 61 1 1 1 1 21 GLU HA A 27 . HA 1 1 61 1 2 1 1 22 PHE H A 28 . HN 1 1 62 1 1 1 1 21 GLU HA A 27 . HA 1 1 62 1 2 1 1 24 ALA MB A 30 . HB# 1 1 63 1 1 1 1 21 GLU QB A 27 . HB# 1 1 63 1 2 1 1 22 PHE H A 28 . HN 1 1 64 1 1 1 1 21 GLU QB A 27 . HB# 1 1 64 1 2 1 1 22 PHE QB A 28 . HB# 1 1 65 1 1 1 1 21 GLU QG A 27 . HG# 1 1 65 1 2 1 1 24 ALA MB A 30 . HB# 1 1 66 1 1 1 1 22 PHE H A 28 . HN 1 1 66 1 2 1 1 23 ILE H A 29 . HN 1 1 67 1 1 1 1 22 PHE HA A 28 . HA 1 1 67 1 2 1 1 23 ILE H A 29 . HN 1 1 68 1 1 1 1 22 PHE HA A 28 . HA 1 1 68 1 2 1 1 25 TRP QB A 31 . HB# 1 1 69 1 1 1 1 22 PHE HA A 28 . HA 1 1 69 1 2 1 1 25 TRP HE3 A 31 . HE3 1 1 70 1 1 1 1 22 PHE HA A 28 . HA 1 1 70 1 2 1 1 25 TRP HZ3 A 31 . HZ3 1 1 71 1 1 1 1 22 PHE HA A 28 . HA 1 1 71 1 2 1 1 26 LEU QD A 32 . HD# 1 1 72 1 1 1 1 22 PHE QB A 28 . HB# 1 1 72 1 2 1 1 23 ILE H A 29 . HN 1 1 73 1 1 1 1 22 PHE QB A 28 . HB# 1 1 73 1 2 1 1 23 ILE HA A 29 . HA 1 1 74 1 1 1 1 22 PHE QB A 28 . HB# 1 1 74 1 2 1 1 23 ILE HB A 29 . HB 1 1 75 1 1 1 1 22 PHE QB A 28 . HB# 1 1 75 1 2 1 1 25 TRP HZ3 A 31 . HZ3 1 1 76 1 1 1 1 22 PHE QB A 28 . HB# 1 1 76 1 2 1 1 26 LEU QD A 32 . HD# 1 1 77 1 1 1 1 22 PHE QD A 28 . HD# 1 1 77 1 2 1 1 23 ILE H A 29 . HN 1 1 78 1 1 1 1 22 PHE QD A 28 . HD# 1 1 78 1 2 1 1 23 ILE HA A 29 . HA 1 1 79 1 1 1 1 22 PHE QD A 28 . HD# 1 1 79 1 2 1 1 23 ILE HB A 29 . HB 1 1 80 1 1 1 1 22 PHE QD A 28 . HD# 1 1 80 1 2 1 1 23 ILE QG A 29 . HG1# 1 1 81 1 1 1 1 22 PHE QD A 28 . HD# 1 1 81 1 2 1 1 25 TRP HE3 A 31 . HE3 1 1 82 1 1 1 1 22 PHE QD A 28 . HD# 1 1 82 1 2 1 1 26 LEU QB A 32 . HB# 1 1 83 1 1 1 1 22 PHE QD A 28 . HD# 1 1 83 1 2 1 1 26 LEU QD A 32 . HD# 1 1 84 1 1 1 1 22 PHE QD A 28 . HD# 1 1 84 1 2 1 1 26 LEU HG A 32 . HG 1 1 85 1 1 1 1 22 PHE QE A 28 . HE# 1 1 85 1 2 1 1 23 ILE H A 29 . HN 1 1 86 1 1 1 1 22 PHE QE A 28 . HE# 1 1 86 1 2 1 1 23 ILE HA A 29 . HA 1 1 87 1 1 1 1 22 PHE QE A 28 . HE# 1 1 87 1 2 1 1 23 ILE HB A 29 . HB 1 1 88 1 1 1 1 22 PHE QE A 28 . HE# 1 1 88 1 2 1 1 23 ILE QG A 29 . HG1# 1 1 89 1 1 1 1 22 PHE QE A 28 . HE# 1 1 89 1 2 1 1 25 TRP HZ3 A 31 . HZ3 1 1 90 1 1 1 1 22 PHE QE A 28 . HE# 1 1 90 1 2 1 1 26 LEU QB A 32 . HB# 1 1 91 1 1 1 1 22 PHE QE A 28 . HE# 1 1 91 1 2 1 1 26 LEU QD A 32 . HD# 1 1 92 1 1 1 1 22 PHE QE A 28 . HE# 1 1 92 1 2 1 1 26 LEU HG A 32 . HG 1 1 93 1 1 1 1 23 ILE H A 29 . HN 1 1 93 1 2 1 1 24 ALA H A 30 . HN 1 1 94 1 1 1 1 23 ILE HA A 29 . HA 1 1 94 1 2 1 1 24 ALA HA A 30 . HA 1 1 95 1 1 1 1 23 ILE HA A 29 . HA 1 1 95 1 2 1 1 26 LEU H A 32 . HN 1 1 96 1 1 1 1 23 ILE HA A 29 . HA 1 1 96 1 2 1 1 26 LEU HA A 32 . HA 1 1 97 1 1 1 1 23 ILE HA A 29 . HA 1 1 97 1 2 1 1 26 LEU QB A 32 . HB# 1 1 98 1 1 1 1 23 ILE HA A 29 . HA 1 1 98 1 2 1 1 26 LEU QD A 32 . HD# 1 1 99 1 1 1 1 23 ILE HA A 29 . HA 1 1 99 1 2 1 1 26 LEU HG A 32 . HG 1 1 100 1 1 1 1 23 ILE HA A 29 . HA 1 1 100 1 2 1 1 27 VAL HB A 33 . HB 1 1 101 1 1 1 1 23 ILE HA A 29 . HA 1 1 101 1 2 1 1 27 VAL QG A 33 . HG# 1 1 102 1 1 1 1 23 ILE HB A 29 . HB 1 1 102 1 2 1 1 24 ALA H A 30 . HN 1 1 103 1 1 1 1 23 ILE HB A 29 . HB 1 1 103 1 2 1 1 24 ALA HA A 30 . HA 1 1 104 1 1 1 1 23 ILE HB A 29 . HB 1 1 104 1 2 1 1 24 ALA MB A 30 . HB# 1 1 105 1 1 1 1 23 ILE HB A 29 . HB 1 1 105 1 2 1 1 26 LEU QD A 32 . HD# 1 1 106 1 1 1 1 23 ILE QG A 29 . HG1# 1 1 106 1 2 1 1 26 LEU QD A 32 . HD# 1 1 107 1 1 1 1 23 ILE MG A 29 . HG2# 1 1 107 1 2 1 1 24 ALA H A 30 . HN 1 1 108 1 1 1 1 24 ALA HA A 30 . HA 1 1 108 1 2 1 1 25 TRP H A 31 . HN 1 1 109 1 1 1 1 24 ALA HA A 30 . HA 1 1 109 1 2 1 1 26 LEU QD A 32 . HD# 1 1 110 1 1 1 1 24 ALA HA A 30 . HA 1 1 110 1 2 1 1 27 VAL HB A 33 . HB# 1 1 111 1 1 1 1 24 ALA HA A 30 . HA 1 1 111 1 2 1 1 27 VAL QG A 33 . HG# 1 1 112 1 1 1 1 24 ALA HA A 30 . HA 1 1 112 1 2 1 1 28 ARG H A 34 . HN 1 1 113 1 1 1 1 25 TRP HA A 31 . HA 1 1 113 1 2 1 1 26 LEU HA A 32 . HA 1 1 114 1 1 1 1 25 TRP HA A 31 . HA 1 1 114 1 2 1 1 28 ARG H A 34 . HN 1 1 115 1 1 1 1 25 TRP HA A 31 . HA 1 1 115 1 2 1 1 28 ARG QB A 34 . HB# 1 1 116 1 1 1 1 25 TRP HA A 31 . HA 1 1 116 1 2 1 1 28 ARG QD A 34 . HD# 1 1 117 1 1 1 1 25 TRP HA A 31 . HA 1 1 117 1 2 1 1 28 ARG QG A 34 . HG# 1 1 118 1 1 1 1 25 TRP QB A 31 . HB# 1 1 118 1 2 1 1 26 LEU H A 32 . HN 1 1 119 1 1 1 1 25 TRP QB A 31 . HB# 1 1 119 1 2 1 1 26 LEU QD A 32 . HD# 1 1 120 1 1 1 1 25 TRP QB A 31 . HB# 1 1 120 1 2 1 1 28 ARG H A 34 . HN 1 1 121 1 1 1 1 25 TRP HD1 A 31 . HD1 1 1 121 1 2 1 1 26 LEU HA A 32 . HA 1 1 122 1 1 1 1 25 TRP HD1 A 31 . HD1 1 1 122 1 2 1 1 30 ARG QB A 36 . HB# 1 1 123 1 1 1 1 25 TRP HE1 A 31 . HE1 1 1 123 1 2 1 1 26 LEU QB A 32 . HB# 1 1 124 1 1 1 1 25 TRP HE1 A 31 . HE1 1 1 124 1 2 1 1 30 ARG HA A 36 . HA 1 1 125 1 1 1 1 25 TRP HE1 A 31 . HE1 1 1 125 1 2 1 1 30 ARG QD A 36 . HD# 1 1 126 1 1 1 1 25 TRP HE3 A 31 . HE3 1 1 126 1 2 1 1 26 LEU HA A 32 . HA 1 1 127 1 1 1 1 25 TRP HE3 A 31 . HE3 1 1 127 1 2 1 1 26 LEU QB A 32 . HB# 1 1 128 1 1 1 1 25 TRP HE3 A 31 . HE3 1 1 128 1 2 1 1 26 LEU QD A 32 . HD# 1 1 129 1 1 1 1 25 TRP HE3 A 31 . HE3 1 1 129 1 2 1 1 26 LEU HG A 32 . HG 1 1 130 1 1 1 1 25 TRP HZ2 A 31 . HZ2 1 1 130 1 2 1 1 26 LEU H A 32 . HN 1 1 131 1 1 1 1 25 TRP HZ2 A 31 . HZ2 1 1 131 1 2 1 1 26 LEU HA A 32 . HA 1 1 132 1 1 1 1 25 TRP HZ2 A 31 . HZ2 1 1 132 1 2 1 1 26 LEU QB A 32 . HB# 1 1 133 1 1 1 1 25 TRP HZ2 A 31 . HZ2 1 1 133 1 2 1 1 26 LEU QD A 32 . HD# 1 1 134 1 1 1 1 25 TRP HZ2 A 31 . HZ2 1 1 134 1 2 1 1 26 LEU HG A 32 . HG 1 1 135 1 1 1 1 25 TRP HZ2 A 31 . HZ2 1 1 135 1 2 1 1 30 ARG QB A 36 . HB# 1 1 136 1 1 1 1 25 TRP HZ2 A 31 . HZ2 1 1 136 1 2 1 1 30 ARG QD A 36 . HD# 1 1 137 1 1 1 1 25 TRP HZ3 A 31 . HZ3 1 1 137 1 2 1 1 26 LEU H A 32 . HN 1 1 138 1 1 1 1 25 TRP HZ3 A 31 . HZ3 1 1 138 1 2 1 1 26 LEU QB A 32 . HB# 1 1 139 1 1 1 1 25 TRP HZ3 A 31 . HZ3 1 1 139 1 2 1 1 26 LEU HG A 32 . HG 1 1 140 1 1 1 1 26 LEU HA A 32 . HA 1 1 140 1 2 1 1 27 VAL H A 33 . HN 1 1 141 1 1 1 1 26 LEU HA A 32 . HA 1 1 141 1 2 1 1 27 VAL HA A 33 . HA 1 1 142 1 1 1 1 26 LEU HA A 32 . HA 1 1 142 1 2 1 1 27 VAL HB A 33 . HB 1 1 143 1 1 1 1 26 LEU HA A 32 . HA 1 1 143 1 2 1 1 27 VAL QG A 33 . HG# 1 1 144 1 1 1 1 26 LEU HA A 32 . HA 1 1 144 1 2 1 1 28 ARG H A 34 . HN 1 1 145 1 1 1 1 26 LEU HA A 32 . HA 1 1 145 1 2 1 1 30 ARG H A 36 . HN 1 1 146 1 1 1 1 26 LEU HA A 32 . HA 1 1 146 1 2 1 1 30 ARG QD A 36 . HD# 1 1 147 1 1 1 1 26 LEU QD A 32 . HD# 1 1 147 1 2 1 1 27 VAL HA A 33 . HA 1 1 148 1 1 1 1 26 LEU QD A 32 . HD# 1 1 148 1 2 1 1 27 VAL HB A 33 . HB 1 1 149 1 1 1 1 26 LEU QD A 32 . HD# 1 1 149 1 2 1 1 27 VAL QG A 33 . HG# 1 1 150 1 1 1 1 26 LEU QD A 32 . HD# 1 1 150 1 2 1 1 30 ARG QD A 36 . HD# 1 1 151 1 1 1 1 27 VAL H A 33 . HN 1 1 151 1 2 1 1 28 ARG H A 34 . HN 1 1 152 1 1 1 1 27 VAL HA A 33 . HA 1 1 152 1 2 1 1 28 ARG H A 34 . HN 1 1 153 1 1 1 1 27 VAL HA A 33 . HA 1 1 153 1 2 1 1 30 ARG QB A 36 . HB# 1 1 154 1 1 1 1 27 VAL HA A 33 . HA 1 1 154 1 2 1 1 30 ARG QD A 36 . HD# 1 1 155 1 1 1 1 27 VAL HB A 33 . HB 1 1 155 1 2 1 1 28 ARG H A 34 . HN 1 1 156 1 1 1 1 27 VAL QG A 33 . HG# 1 1 156 1 2 1 1 28 ARG H A 34 . HN 1 1 157 1 1 1 1 27 VAL QG A 33 . HG# 1 1 157 1 2 1 1 28 ARG HA A 34 . HA 1 1 158 1 1 1 1 28 ARG H A 34 . HN 1 1 158 1 2 1 1 29 GLY H A 35 . HN 1 1 159 1 1 1 1 28 ARG H A 34 . HN 1 1 159 1 2 1 1 29 GLY QA A 35 . HA# 1 1 160 1 1 1 1 28 ARG HA A 34 . HA 1 1 160 1 2 1 1 29 GLY H A 35 . HN 1 1 161 1 1 1 1 29 GLY QA A 35 . HA# 1 1 161 1 2 1 1 30 ARG H A 36 . HN 1 1 162 1 1 1 1 29 GLY QA A 35 . HA# 1 1 162 1 2 1 1 30 ARG QB A 36 . HB# 1 1 163 1 1 1 1 30 ARG HA A 36 . HA 1 1 163 1 2 1 1 31 GLY H A 37 . HN 1 1 164 1 1 1 1 30 ARG QB A 36 . HB# 1 1 164 1 2 1 1 31 GLY QA A 37 . HA# 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 . . . . . 4.0 1.0 6.0 1 1 2 1 . . . . . 4.0 1.0 6.0 1 1 3 1 . . . . . 4.0 1.0 6.5 1 1 4 1 . . . . . 4.0 1.0 6.0 1 1 5 1 . . . . . 4.0 1.0 6.0 1 1 6 1 . . . . . 4.0 1.0 6.5 1 1 7 1 . . . . . 4.0 1.0 6.5 1 1 8 1 . . . . . 4.0 1.0 6.0 1 1 9 1 . . . . . 4.0 1.0 6.5 1 1 10 1 . . . . . 4.0 1.0 5.0 1 1 11 1 . . . . . 4.0 1.0 6.0 1 1 12 1 . . . . . 4.0 1.0 6.0 1 1 13 1 . . . . . 4.0 1.0 6.5 1 1 14 1 . . . . . 4.0 1.0 6.5 1 1 15 1 . . . . . 4.0 1.0 5.0 1 1 16 1 . . . . . 4.0 1.0 6.5 1 1 17 1 . . . . . 4.0 1.0 6.5 1 1 18 1 . . . . . 4.0 1.0 6.0 1 1 19 1 . . . . . 4.0 1.0 6.5 1 1 20 1 . . . . . 4.0 1.0 6.0 1 1 21 1 . . . . . 4.0 1.0 6.0 1 1 22 1 . . . . . 4.0 1.0 5.0 1 1 23 1 . . . . . 4.0 1.0 6.0 1 1 24 1 . . . . . 4.0 1.0 6.5 1 1 25 1 . . . . . 4.0 1.0 5.0 1 1 26 1 . . . . . 4.0 1.0 6.0 1 1 27 1 . . . . . 4.0 1.0 6.0 1 1 28 1 . . . . . 4.0 1.0 6.5 1 1 29 1 . . . . . 4.0 1.0 6.5 1 1 30 1 . . . . . 4.0 1.0 6.5 1 1 31 1 . . . . . 4.0 1.0 6.5 1 1 32 1 . . . . . 4.0 1.0 6.0 1 1 33 1 . . . . . 4.0 1.0 5.0 1 1 34 1 . . . . . 4.0 1.0 6.0 1 1 35 1 . . . . . 4.0 1.0 6.0 1 1 36 1 . . . . . 4.0 1.0 6.0 1 1 37 1 . . . . . 4.0 1.0 6.0 1 1 38 1 . . . . . 4.0 1.0 6.5 1 1 39 1 . . . . . 4.0 1.0 6.0 1 1 40 1 . . . . . 4.0 1.0 6.5 1 1 41 1 . . . . . 4.0 1.0 6.0 1 1 42 1 . . . . . 4.0 1.0 6.5 1 1 43 1 . . . . . 4.0 1.0 6.0 1 1 44 1 . . . . . 4.0 1.0 6.0 1 1 45 1 . . . . . 3.0 1.0 4.0 1 1 46 1 . . . . . 4.0 1.0 6.0 1 1 47 1 . . . . . 4.0 1.0 6.0 1 1 48 1 . . . . . 4.0 1.0 6.0 1 1 49 1 . . . . . 4.0 1.0 6.0 1 1 50 1 . . . . . 4.0 1.0 6.0 1 1 51 1 . . . . . 4.0 1.0 5.0 1 1 52 1 . . . . . 4.0 1.0 6.5 1 1 53 1 . . . . . 4.0 1.0 6.5 1 1 54 1 . . . . . 4.0 1.0 5.0 1 1 55 1 . . . . . 4.0 1.0 5.0 1 1 56 1 . . . . . 4.0 1.0 6.0 1 1 57 1 . . . . . 4.0 1.0 5.5 1 1 58 1 . . . . . 4.0 1.0 6.0 1 1 59 1 . . . . . 4.0 1.0 6.0 1 1 60 1 . . . . . 3.3 1.0 3.6 1 1 61 1 . . . . . 4.0 1.0 6.0 1 1 62 1 . . . . . 4.0 1.0 6.5 1 1 63 1 . . . . . 4.0 1.0 6.0 1 1 64 1 . . . . . 4.0 1.0 6.0 1 1 65 1 . . . . . 4.0 1.0 6.5 1 1 66 1 . . . . . 4.0 1.0 6.0 1 1 67 1 . . . . . 4.0 1.0 6.0 1 1 68 1 . . . . . 4.0 1.0 5.0 1 1 69 1 . . . . . 3.0 1.0 3.3 1 1 70 1 . . . . . 4.0 1.0 6.0 1 1 71 1 . . . . . 4.0 1.0 6.5 1 1 72 1 . . . . . 4.0 1.0 6.0 1 1 73 1 . . . . . 4.0 1.0 6.0 1 1 74 1 . . . . . 4.0 1.0 6.0 1 1 75 1 . . . . . 4.0 1.0 5.0 1 1 76 1 . . . . . 4.0 1.0 6.5 1 1 77 1 . . . . . 4.0 1.0 6.0 1 1 78 1 . . . . . 4.0 1.0 6.0 1 1 79 1 . . . . . 4.0 1.0 6.0 1 1 80 1 . . . . . 4.0 1.0 6.0 1 1 81 1 . . . . . 4.0 1.0 5.0 1 1 82 1 . . . . . 4.0 1.0 6.0 1 1 83 1 . . . . . 4.0 1.0 6.5 1 1 84 1 . . . . . 4.0 1.0 6.0 1 1 85 1 . . . . . 4.0 1.0 6.0 1 1 86 1 . . . . . 4.0 1.0 6.0 1 1 87 1 . . . . . 4.0 1.0 6.0 1 1 88 1 . . . . . 4.0 1.0 6.0 1 1 89 1 . . . . . 4.0 1.0 6.0 1 1 90 1 . . . . . 4.0 1.0 6.0 1 1 91 1 . . . . . 4.0 1.0 6.5 1 1 92 1 . . . . . 4.0 1.0 6.0 1 1 93 1 . . . . . 4.0 1.0 6.0 1 1 94 1 . . . . . 4.0 1.0 6.0 1 1 95 1 . . . . . 4.0 1.0 6.0 1 1 96 1 . . . . . 4.0 1.0 6.0 1 1 97 1 . . . . . 4.0 1.0 5.0 1 1 98 1 . . . . . 4.0 1.0 6.5 1 1 99 1 . . . . . 4.0 1.0 6.0 1 1 100 1 . . . . . 4.0 1.0 6.0 1 1 101 1 . . . . . 4.0 1.0 6.5 1 1 102 1 . . . . . 4.0 1.0 6.0 1 1 103 1 . . . . . 4.0 1.0 6.0 1 1 104 1 . . . . . 4.0 1.0 6.5 1 1 105 1 . . . . . 4.0 1.0 6.5 1 1 106 1 . . . . . 4.0 1.0 6.5 1 1 107 1 . . . . . 3.0 1.0 4.0 1 1 108 1 . . . . . 4.0 1.0 6.0 1 1 109 1 . . . . . 4.0 1.0 6.5 1 1 110 1 . . . . . 4.0 1.0 5.0 1 1 111 1 . . . . . 4.0 1.0 6.5 1 1 112 1 . . . . . 4.0 1.0 6.0 1 1 113 1 . . . . . 4.0 1.0 6.0 1 1 114 1 . . . . . 4.0 1.0 5.0 1 1 115 1 . . . . . 4.0 1.0 5.0 1 1 116 1 . . . . . 4.0 1.0 6.0 1 1 117 1 . . . . . 4.0 1.0 6.0 1 1 118 1 . . . . . 4.0 1.0 6.0 1 1 119 1 . . . . . 4.0 1.0 6.5 1 1 120 1 . . . . . 4.0 1.0 6.0 1 1 121 1 . . . . . 4.0 1.0 6.0 1 1 122 1 . . . . . 4.0 1.0 6.0 1 1 123 1 . . . . . 4.0 1.0 6.0 1 1 124 1 . . . . . 4.0 1.0 6.0 1 1 125 1 . . . . . 4.0 1.0 6.0 1 1 126 1 . . . . . 4.0 1.0 6.0 1 1 127 1 . . . . . 4.0 1.0 6.0 1 1 128 1 . . . . . 4.0 1.0 6.5 1 1 129 1 . . . . . 4.0 1.0 6.0 1 1 130 1 . . . . . 4.0 1.0 6.0 1 1 131 1 . . . . . 4.0 1.0 6.0 1 1 132 1 . . . . . 4.0 1.0 6.0 1 1 133 1 . . . . . 4.0 1.0 6.5 1 1 134 1 . . . . . 4.0 1.0 6.0 1 1 135 1 . . . . . 4.0 1.0 6.0 1 1 136 1 . . . . . 4.0 1.0 6.0 1 1 137 1 . . . . . 4.0 1.0 6.0 1 1 138 1 . . . . . 4.0 1.0 6.0 1 1 139 1 . . . . . 4.0 1.0 6.0 1 1 140 1 . . . . . 4.0 1.0 6.0 1 1 141 1 . . . . . 4.0 1.0 6.0 1 1 142 1 . . . . . 4.0 1.0 6.0 1 1 143 1 . . . . . 4.0 1.0 6.5 1 1 144 1 . . . . . 4.0 1.0 6.0 1 1 145 1 . . . . . 4.0 1.0 5.0 1 1 146 1 . . . . . 4.0 1.0 6.0 1 1 147 1 . . . . . 4.0 1.0 6.5 1 1 148 1 . . . . . 4.0 1.0 6.5 1 1 149 1 . . . . . 4.0 1.0 6.5 1 1 150 1 . . . . . 4.0 1.0 6.5 1 1 151 1 . . . . . 4.0 1.0 6.0 1 1 152 1 . . . . . 4.0 1.0 6.0 1 1 153 1 . . . . . 4.0 1.0 5.0 1 1 154 1 . . . . . 4.0 1.0 6.0 1 1 155 1 . . . . . 4.0 1.0 6.0 1 1 156 1 . . . . . 4.0 1.0 6.5 1 1 157 1 . . . . . 4.0 1.0 6.5 1 1 158 1 . . . . . 4.0 1.0 6.0 1 1 159 1 . . . . . 4.0 1.0 6.0 1 1 160 1 . . . . . 4.0 1.0 6.0 1 1 161 1 . . . . . 4.0 1.0 6.0 1 1 162 1 . . . . . 4.0 1.0 6.0 1 1 163 1 . . . . . 4.0 1.0 6.0 1 1 164 1 . . . . . 4.0 1.0 6.0 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 HIS C C -28.122 -4.045 3.785 1.00 . A A . 7 HIS C 1 1 1 2 1 1 1 HIS CA C -28.798 -5.274 4.384 1.00 . A A . 7 HIS CA 1 1 1 3 1 1 1 HIS CB C -29.589 -6.020 3.308 1.00 . A A . 7 HIS CB 1 1 1 4 1 1 1 HIS CD2 C -28.346 -7.398 1.495 1.00 . A A . 7 HIS CD2 1 1 1 5 1 1 1 HIS CE1 C -27.923 -9.188 2.688 1.00 . A A . 7 HIS CE1 1 1 1 6 1 1 1 HIS CG C -28.856 -7.192 2.732 1.00 . A A . 7 HIS CG 1 1 1 7 1 1 1 HIS H1 H -29.257 -4.175 6.062 1.00 . A A . 7 HIS H1 1 1 1 8 1 1 1 HIS H2 H -30.594 -4.515 5.041 1.00 . A A . 7 HIS H2 1 1 1 9 1 1 1 HIS H3 H -29.937 -5.751 6.030 1.00 . A A . 7 HIS H3 1 1 1 10 1 1 1 HIS HA H -28.042 -5.929 4.789 1.00 . A A . 7 HIS HA 1 1 1 11 1 1 1 HIS HB2 H -30.511 -6.383 3.735 1.00 . A A . 7 HIS HB2 1 1 1 12 1 1 1 HIS HB3 H -29.815 -5.340 2.500 1.00 . A A . 7 HIS HB3 1 1 1 13 1 1 1 HIS HD1 H -28.816 -8.491 4.392 1.00 . A A . 7 HIS HD1 1 1 1 14 1 1 1 HIS HD2 H -28.384 -6.709 0.663 1.00 . A A . 7 HIS HD2 1 1 1 15 1 1 1 HIS HE1 H -27.574 -10.166 2.986 1.00 . A A . 7 HIS HE1 1 1 1 16 1 1 1 HIS HE2 H -27.402 -9.101 0.709 1.00 . A A . 7 HIS HE2 1 1 1 17 1 1 1 HIS N N -29.730 -4.895 5.478 1.00 . A A . 7 HIS N 1 1 1 18 1 1 1 HIS ND1 N -28.575 -8.333 3.455 1.00 . A A . 7 HIS ND1 1 1 1 19 1 1 1 HIS NE2 N -27.772 -8.646 1.494 1.00 . A A . 7 HIS NE2 1 1 1 20 1 1 1 HIS O O -28.764 -3.235 3.116 1.00 . A A . 7 HIS O 1 1 1 21 1 1 2 ALA C C -24.785 -3.249 2.821 1.00 . A A . 8 ALA C 1 1 1 22 1 1 2 ALA CA C -26.060 -2.781 3.515 1.00 . A A . 8 ALA CA 1 1 1 23 1 1 2 ALA CB C -25.726 -1.814 4.641 1.00 . A A . 8 ALA CB 1 1 1 24 1 1 2 ALA H H -26.366 -4.590 4.570 1.00 . A A . 8 ALA H 1 1 1 25 1 1 2 ALA HA H -26.678 -2.261 2.797 1.00 . A A . 8 ALA HA 1 1 1 26 1 1 2 ALA HB1 H -25.137 -2.323 5.389 1.00 . A A . 8 ALA HB1 1 1 1 27 1 1 2 ALA HB2 H -25.164 -0.981 4.245 1.00 . A A . 8 ALA HB2 1 1 1 28 1 1 2 ALA HB3 H -26.640 -1.451 5.087 1.00 . A A . 8 ALA HB3 1 1 1 29 1 1 2 ALA N N -26.823 -3.911 4.030 1.00 . A A . 8 ALA N 1 1 1 30 1 1 2 ALA O O -24.435 -4.428 2.874 1.00 . A A . 8 ALA O 1 1 1 31 1 1 3 GLU C C -21.661 -2.561 2.411 1.00 . A A . 9 GLU C 1 1 1 32 1 1 3 GLU CA C -22.858 -2.634 1.468 1.00 . A A . 9 GLU CA 1 1 1 33 1 1 3 GLU CB C -22.655 -1.675 0.294 1.00 . A A . 9 GLU CB 1 1 1 34 1 1 3 GLU CD C -22.207 -2.624 -2.005 1.00 . A A . 9 GLU CD 1 1 1 35 1 1 3 GLU CG C -23.259 -2.173 -1.010 1.00 . A A . 9 GLU CG 1 1 1 36 1 1 3 GLU H H -24.425 -1.394 2.167 1.00 . A A . 9 GLU H 1 1 1 37 1 1 3 GLU HA H -22.941 -3.641 1.089 1.00 . A A . 9 GLU HA 1 1 1 38 1 1 3 GLU HB2 H -23.111 -0.726 0.536 1.00 . A A . 9 GLU HB2 1 1 1 39 1 1 3 GLU HB3 H -21.596 -1.527 0.142 1.00 . A A . 9 GLU HB3 1 1 1 40 1 1 3 GLU HG2 H -23.909 -3.008 -0.795 1.00 . A A . 9 GLU HG2 1 1 1 41 1 1 3 GLU HG3 H -23.835 -1.374 -1.453 1.00 . A A . 9 GLU HG3 1 1 1 42 1 1 3 GLU N N -24.095 -2.317 2.172 1.00 . A A . 9 GLU N 1 1 1 43 1 1 3 GLU O O -21.780 -2.100 3.547 1.00 . A A . 9 GLU O 1 1 1 44 1 1 3 GLU OE1 O -21.105 -3.017 -1.567 1.00 . A A . 9 GLU OE1 1 1 1 45 1 1 3 GLU OE2 O -22.486 -2.584 -3.222 1.00 . A A . 9 GLU OE2 1 1 1 46 1 1 4 GLY C C -18.307 -1.962 2.276 1.00 . A A . 10 GLY C 1 1 1 47 1 1 4 GLY CA C -19.307 -2.996 2.746 1.00 . A A . 10 GLY CA 1 1 1 48 1 1 4 GLY H H -20.474 -3.374 1.021 1.00 . A A . 10 GLY H 1 1 1 49 1 1 4 GLY HA2 H -19.579 -2.777 3.768 1.00 . A A . 10 GLY HA2 1 1 1 50 1 1 4 GLY HA3 H -18.842 -3.970 2.710 1.00 . A A . 10 GLY HA3 1 1 1 51 1 1 4 GLY N N -20.509 -3.019 1.933 1.00 . A A . 10 GLY N 1 1 1 52 1 1 4 GLY O O -18.511 -1.308 1.253 1.00 . A A . 10 GLY O 1 1 1 53 1 1 5 THR C C -15.424 -1.308 1.438 1.00 . A A . 11 THR C 1 1 1 54 1 1 5 THR CA C -16.181 -0.857 2.686 1.00 . A A . 11 THR CA 1 1 1 55 1 1 5 THR CB C -15.226 -0.683 3.876 1.00 . A A . 11 THR CB 1 1 1 56 1 1 5 THR CG2 C -13.770 -0.534 3.485 1.00 . A A . 11 THR CG2 1 1 1 57 1 1 5 THR H H -17.118 -2.368 3.829 1.00 . A A . 11 THR H 1 1 1 58 1 1 5 THR HA H -16.659 0.089 2.478 1.00 . A A . 11 THR HA 1 1 1 59 1 1 5 THR HB H -15.308 -1.551 4.515 1.00 . A A . 11 THR HB 1 1 1 60 1 1 5 THR HG1 H -15.365 0.308 5.560 1.00 . A A . 11 THR HG1 1 1 1 61 1 1 5 THR HG21 H -13.657 0.323 2.839 1.00 . A A . 11 THR HG21 1 1 1 62 1 1 5 THR HG22 H -13.171 -0.399 4.373 1.00 . A A . 11 THR HG22 1 1 1 63 1 1 5 THR HG23 H -13.447 -1.423 2.964 1.00 . A A . 11 THR HG23 1 1 1 64 1 1 5 THR N N -17.222 -1.815 3.026 1.00 . A A . 11 THR N 1 1 1 65 1 1 5 THR O O -14.862 -2.403 1.403 1.00 . A A . 11 THR O 1 1 1 66 1 1 5 THR OG1 O -15.581 0.459 4.636 1.00 . A A . 11 THR OG1 1 1 1 67 1 1 6 PHE C C -14.657 0.458 -1.735 1.00 . A A . 12 PHE C 1 1 1 68 1 1 6 PHE CA C -14.727 -0.769 -0.831 1.00 . A A . 12 PHE CA 1 1 1 69 1 1 6 PHE CB C -15.438 -1.915 -1.556 1.00 . A A . 12 PHE CB 1 1 1 70 1 1 6 PHE CD1 C -13.427 -3.260 -2.224 1.00 . A A . 12 PHE CD1 1 1 1 71 1 1 6 PHE CD2 C -15.130 -4.329 -0.941 1.00 . A A . 12 PHE CD2 1 1 1 72 1 1 6 PHE CE1 C -12.699 -4.434 -2.242 1.00 . A A . 12 PHE CE1 1 1 1 73 1 1 6 PHE CE2 C -14.406 -5.506 -0.956 1.00 . A A . 12 PHE CE2 1 1 1 74 1 1 6 PHE CG C -14.649 -3.194 -1.574 1.00 . A A . 12 PHE CG 1 1 1 75 1 1 6 PHE CZ C -13.189 -5.559 -1.607 1.00 . A A . 12 PHE CZ 1 1 1 76 1 1 6 PHE H H -15.880 0.400 0.505 1.00 . A A . 12 PHE H 1 1 1 77 1 1 6 PHE HA H -13.722 -1.078 -0.588 1.00 . A A . 12 PHE HA 1 1 1 78 1 1 6 PHE HB2 H -16.379 -2.114 -1.065 1.00 . A A . 12 PHE HB2 1 1 1 79 1 1 6 PHE HB3 H -15.626 -1.626 -2.580 1.00 . A A . 12 PHE HB3 1 1 1 80 1 1 6 PHE HD1 H -16.081 -4.288 -0.432 1.00 . A A . 12 PHE HD1 1 1 1 81 1 1 6 PHE HD2 H -13.043 -2.381 -2.721 1.00 . A A . 12 PHE HD2 1 1 1 82 1 1 6 PHE HE1 H -14.791 -6.384 -0.458 1.00 . A A . 12 PHE HE1 1 1 1 83 1 1 6 PHE HE2 H -11.748 -4.473 -2.752 1.00 . A A . 12 PHE HE2 1 1 1 84 1 1 6 PHE HZ H -12.622 -6.478 -1.620 1.00 . A A . 12 PHE HZ 1 1 1 85 1 1 6 PHE N N -15.414 -0.457 0.417 1.00 . A A . 12 PHE N 1 1 1 86 1 1 6 PHE O O -13.601 0.782 -2.274 1.00 . A A . 12 PHE O 1 1 1 87 1 1 7 THR C C -14.719 3.294 -2.427 1.00 . A A . 13 THR C 1 1 1 88 1 1 7 THR CA C -15.861 2.329 -2.737 1.00 . A A . 13 THR CA 1 1 1 89 1 1 7 THR CB C -17.204 3.035 -2.543 1.00 . A A . 13 THR CB 1 1 1 90 1 1 7 THR CG2 C -17.438 3.494 -1.121 1.00 . A A . 13 THR CG2 1 1 1 91 1 1 7 THR H H -16.600 0.827 -1.439 1.00 . A A . 13 THR H 1 1 1 92 1 1 7 THR HA H -15.778 2.013 -3.766 1.00 . A A . 13 THR HA 1 1 1 93 1 1 7 THR HB H -17.999 2.352 -2.806 1.00 . A A . 13 THR HB 1 1 1 94 1 1 7 THR HG1 H -17.119 3.915 -4.290 1.00 . A A . 13 THR HG1 1 1 1 95 1 1 7 THR HG21 H -17.288 2.665 -0.445 1.00 . A A . 13 THR HG21 1 1 1 96 1 1 7 THR HG22 H -16.745 4.286 -0.879 1.00 . A A . 13 THR HG22 1 1 1 97 1 1 7 THR HG23 H -18.450 3.859 -1.022 1.00 . A A . 13 THR HG23 1 1 1 98 1 1 7 THR N N -15.790 1.136 -1.896 1.00 . A A . 13 THR N 1 1 1 99 1 1 7 THR O O -14.221 3.987 -3.314 1.00 . A A . 13 THR O 1 1 1 100 1 1 7 THR OG1 O -17.298 4.172 -3.383 1.00 . A A . 13 THR OG1 1 1 1 101 1 1 8 SER C C -11.876 3.517 -0.846 1.00 . A A . 14 SER C 1 1 1 102 1 1 8 SER CA C -13.229 4.215 -0.737 1.00 . A A . 14 SER CA 1 1 1 103 1 1 8 SER CB C -13.460 4.682 0.701 1.00 . A A . 14 SER CB 1 1 1 104 1 1 8 SER H H -14.747 2.759 -0.501 1.00 . A A . 14 SER H 1 1 1 105 1 1 8 SER HA H -13.228 5.076 -1.389 1.00 . A A . 14 SER HA 1 1 1 106 1 1 8 SER HB2 H -14.509 4.594 0.941 1.00 . A A . 14 SER HB2 1 1 1 107 1 1 8 SER HB3 H -12.884 4.064 1.374 1.00 . A A . 14 SER HB3 1 1 1 108 1 1 8 SER HG H -13.557 6.421 1.597 1.00 . A A . 14 SER HG 1 1 1 109 1 1 8 SER N N -14.310 3.334 -1.163 1.00 . A A . 14 SER N 1 1 1 110 1 1 8 SER O O -10.925 4.066 -1.402 1.00 . A A . 14 SER O 1 1 1 111 1 1 8 SER OG O -13.066 6.032 0.869 1.00 . A A . 14 SER OG 1 1 1 112 1 1 9 ASP C C -10.107 1.268 -1.770 1.00 . A A . 15 ASP C 1 1 1 113 1 1 9 ASP CA C -10.559 1.532 -0.336 1.00 . A A . 15 ASP CA 1 1 1 114 1 1 9 ASP CB C -10.745 0.206 0.403 1.00 . A A . 15 ASP CB 1 1 1 115 1 1 9 ASP CG C -9.425 -0.415 0.817 1.00 . A A . 15 ASP CG 1 1 1 116 1 1 9 ASP H H -12.588 1.922 0.127 1.00 . A A . 15 ASP H 1 1 1 117 1 1 9 ASP HA H -9.798 2.109 0.167 1.00 . A A . 15 ASP HA 1 1 1 118 1 1 9 ASP HB2 H -11.335 0.375 1.291 1.00 . A A . 15 ASP HB2 1 1 1 119 1 1 9 ASP HB3 H -11.263 -0.489 -0.242 1.00 . A A . 15 ASP HB3 1 1 1 120 1 1 9 ASP N N -11.797 2.305 -0.306 1.00 . A A . 15 ASP N 1 1 1 121 1 1 9 ASP O O -8.911 1.168 -2.044 1.00 . A A . 15 ASP O 1 1 1 122 1 1 9 ASP OD1 O -8.816 0.079 1.789 1.00 . A A . 15 ASP OD1 1 1 1 123 1 1 9 ASP OD2 O -9.001 -1.395 0.169 1.00 . A A . 15 ASP OD2 1 1 1 124 1 1 10 VAL C C -9.893 2.002 -4.678 1.00 . A A . 16 VAL C 1 1 1 125 1 1 10 VAL CA C -10.764 0.897 -4.083 1.00 . A A . 16 VAL CA 1 1 1 126 1 1 10 VAL CB C -12.045 0.759 -4.925 1.00 . A A . 16 VAL CB 1 1 1 127 1 1 10 VAL CG1 C -12.729 -0.571 -4.641 1.00 . A A . 16 VAL CG1 1 1 1 128 1 1 10 VAL CG2 C -12.987 1.926 -4.663 1.00 . A A . 16 VAL CG2 1 1 1 129 1 1 10 VAL H H -12.004 1.240 -2.401 1.00 . A A . 16 VAL H 1 1 1 130 1 1 10 VAL HA H -10.226 -0.038 -4.136 1.00 . A A . 16 VAL HA 1 1 1 131 1 1 10 VAL HB H -11.768 0.777 -5.968 1.00 . A A . 16 VAL HB 1 1 1 132 1 1 10 VAL HG11 H -12.101 -1.168 -3.995 1.00 . A A . 16 VAL HG11 1 1 1 133 1 1 10 VAL HG12 H -13.678 -0.394 -4.157 1.00 . A A . 16 VAL HG12 1 1 1 134 1 1 10 VAL HG13 H -12.891 -1.097 -5.570 1.00 . A A . 16 VAL HG13 1 1 1 135 1 1 10 VAL HG21 H -12.633 2.492 -3.814 1.00 . A A . 16 VAL HG21 1 1 1 136 1 1 10 VAL HG22 H -13.018 2.565 -5.533 1.00 . A A . 16 VAL HG22 1 1 1 137 1 1 10 VAL HG23 H -13.979 1.551 -4.457 1.00 . A A . 16 VAL HG23 1 1 1 138 1 1 10 VAL N N -11.068 1.153 -2.680 1.00 . A A . 16 VAL N 1 1 1 139 1 1 10 VAL O O -9.244 1.808 -5.705 1.00 . A A . 16 VAL O 1 1 1 140 1 1 11 SER C C -7.693 4.280 -3.895 1.00 . A A . 17 SER C 1 1 1 141 1 1 11 SER CA C -9.094 4.291 -4.505 1.00 . A A . 17 SER CA 1 1 1 142 1 1 11 SER CB C -9.797 5.608 -4.169 1.00 . A A . 17 SER CB 1 1 1 143 1 1 11 SER H H -10.425 3.264 -3.222 1.00 . A A . 17 SER H 1 1 1 144 1 1 11 SER HA H -9.005 4.207 -5.578 1.00 . A A . 17 SER HA 1 1 1 145 1 1 11 SER HB2 H -10.865 5.451 -4.157 1.00 . A A . 17 SER HB2 1 1 1 146 1 1 11 SER HB3 H -9.472 5.949 -3.197 1.00 . A A . 17 SER HB3 1 1 1 147 1 1 11 SER HG H -8.664 7.030 -4.898 1.00 . A A . 17 SER HG 1 1 1 148 1 1 11 SER N N -9.886 3.162 -4.033 1.00 . A A . 17 SER N 1 1 1 149 1 1 11 SER O O -6.778 4.923 -4.411 1.00 . A A . 17 SER O 1 1 1 150 1 1 11 SER OG O -9.494 6.607 -5.128 1.00 . A A . 17 SER OG 1 1 1 151 1 1 12 SER C C -5.388 2.334 -2.607 1.00 . A A . 18 SER C 1 1 1 152 1 1 12 SER CA C -6.248 3.491 -2.099 1.00 . A A . 18 SER CA 1 1 1 153 1 1 12 SER CB C -6.463 3.350 -0.592 1.00 . A A . 18 SER CB 1 1 1 154 1 1 12 SER H H -8.301 3.082 -2.411 1.00 . A A . 18 SER H 1 1 1 155 1 1 12 SER HA H -5.724 4.416 -2.288 1.00 . A A . 18 SER HA 1 1 1 156 1 1 12 SER HB2 H -5.573 3.671 -0.071 1.00 . A A . 18 SER HB2 1 1 1 157 1 1 12 SER HB3 H -7.298 3.967 -0.291 1.00 . A A . 18 SER HB3 1 1 1 158 1 1 12 SER HG H -6.282 1.790 0.578 1.00 . A A . 18 SER HG 1 1 1 159 1 1 12 SER N N -7.534 3.563 -2.785 1.00 . A A . 18 SER N 1 1 1 160 1 1 12 SER O O -4.161 2.434 -2.632 1.00 . A A . 18 SER O 1 1 1 161 1 1 12 SER OG O -6.738 2.006 -0.238 1.00 . A A . 18 SER OG 1 1 1 162 1 1 13 TYR C C -4.347 0.446 -4.625 1.00 . A A . 19 TYR C 1 1 1 163 1 1 13 TYR CA C -5.290 0.065 -3.484 1.00 . A A . 19 TYR CA 1 1 1 164 1 1 13 TYR CB C -6.257 -1.045 -3.929 1.00 . A A . 19 TYR CB 1 1 1 165 1 1 13 TYR CD1 C -5.788 -1.416 -6.388 1.00 . A A . 19 TYR CD1 1 1 1 166 1 1 13 TYR CD2 C -7.902 -0.510 -5.770 1.00 . A A . 19 TYR CD2 1 1 1 167 1 1 13 TYR CE1 C -6.152 -1.369 -7.720 1.00 . A A . 19 TYR CE1 1 1 1 168 1 1 13 TYR CE2 C -8.274 -0.458 -7.100 1.00 . A A . 19 TYR CE2 1 1 1 169 1 1 13 TYR CG C -6.657 -0.987 -5.391 1.00 . A A . 19 TYR CG 1 1 1 170 1 1 13 TYR CZ C -7.395 -0.889 -8.071 1.00 . A A . 19 TYR CZ 1 1 1 171 1 1 13 TYR H H -7.003 1.198 -2.948 1.00 . A A . 19 TYR H 1 1 1 172 1 1 13 TYR HA H -4.694 -0.306 -2.662 1.00 . A A . 19 TYR HA 1 1 1 173 1 1 13 TYR HB2 H -5.794 -2.004 -3.756 1.00 . A A . 19 TYR HB2 1 1 1 174 1 1 13 TYR HB3 H -7.161 -0.978 -3.338 1.00 . A A . 19 TYR HB3 1 1 1 175 1 1 13 TYR HD1 H -4.814 -1.791 -6.109 1.00 . A A . 19 TYR HD1 1 1 1 176 1 1 13 TYR HD2 H -8.586 -0.173 -5.008 1.00 . A A . 19 TYR HD2 1 1 1 177 1 1 13 TYR HE1 H -5.463 -1.707 -8.480 1.00 . A A . 19 TYR HE1 1 1 1 178 1 1 13 TYR HE2 H -9.248 -0.082 -7.374 1.00 . A A . 19 TYR HE2 1 1 1 179 1 1 13 TYR HH H -8.170 0.008 -9.585 1.00 . A A . 19 TYR HH 1 1 1 180 1 1 13 TYR N N -6.025 1.232 -2.997 1.00 . A A . 19 TYR N 1 1 1 181 1 1 13 TYR O O -3.306 -0.182 -4.820 1.00 . A A . 19 TYR O 1 1 1 182 1 1 13 TYR OH O -7.762 -0.840 -9.396 1.00 . A A . 19 TYR OH 1 1 1 183 1 1 14 LEU C C -2.493 2.277 -6.055 1.00 . A A . 20 LEU C 1 1 1 184 1 1 14 LEU CA C -3.914 1.941 -6.501 1.00 . A A . 20 LEU CA 1 1 1 185 1 1 14 LEU CB C -4.560 3.167 -7.148 1.00 . A A . 20 LEU CB 1 1 1 186 1 1 14 LEU CD1 C -7.062 3.233 -6.993 1.00 . A A . 20 LEU CD1 1 1 1 187 1 1 14 LEU CD2 C -5.937 3.688 -9.179 1.00 . A A . 20 LEU CD2 1 1 1 188 1 1 14 LEU CG C -5.875 2.895 -7.881 1.00 . A A . 20 LEU CG 1 1 1 189 1 1 14 LEU H H -5.563 1.936 -5.174 1.00 . A A . 20 LEU H 1 1 1 190 1 1 14 LEU HA H -3.870 1.144 -7.228 1.00 . A A . 20 LEU HA 1 1 1 191 1 1 14 LEU HB2 H -4.746 3.899 -6.375 1.00 . A A . 20 LEU HB2 1 1 1 192 1 1 14 LEU HB3 H -3.859 3.586 -7.854 1.00 . A A . 20 LEU HB3 1 1 1 193 1 1 14 LEU HD11 H -6.901 4.194 -6.526 1.00 . A A . 20 LEU HD11 1 1 1 194 1 1 14 LEU HD12 H -7.961 3.269 -7.591 1.00 . A A . 20 LEU HD12 1 1 1 195 1 1 14 LEU HD13 H -7.168 2.476 -6.230 1.00 . A A . 20 LEU HD13 1 1 1 196 1 1 14 LEU HD21 H -5.325 4.574 -9.089 1.00 . A A . 20 LEU HD21 1 1 1 197 1 1 14 LEU HD22 H -5.571 3.078 -9.991 1.00 . A A . 20 LEU HD22 1 1 1 198 1 1 14 LEU HD23 H -6.959 3.976 -9.377 1.00 . A A . 20 LEU HD23 1 1 1 199 1 1 14 LEU HG H -5.932 1.845 -8.128 1.00 . A A . 20 LEU HG 1 1 1 200 1 1 14 LEU N N -4.722 1.477 -5.377 1.00 . A A . 20 LEU N 1 1 1 201 1 1 14 LEU O O -1.546 2.169 -6.834 1.00 . A A . 20 LEU O 1 1 1 202 1 1 15 GLU C C -0.432 1.869 -3.493 1.00 . A A . 21 GLU C 1 1 1 203 1 1 15 GLU CA C -1.046 3.041 -4.253 1.00 . A A . 21 GLU CA 1 1 1 204 1 1 15 GLU CB C -1.170 4.254 -3.328 1.00 . A A . 21 GLU CB 1 1 1 205 1 1 15 GLU CD C -1.124 6.586 -4.298 1.00 . A A . 21 GLU CD 1 1 1 206 1 1 15 GLU CG C -1.981 5.393 -3.924 1.00 . A A . 21 GLU CG 1 1 1 207 1 1 15 GLU H H -3.144 2.755 -4.225 1.00 . A A . 21 GLU H 1 1 1 208 1 1 15 GLU HA H -0.401 3.296 -5.080 1.00 . A A . 21 GLU HA 1 1 1 209 1 1 15 GLU HB2 H -1.646 3.944 -2.410 1.00 . A A . 21 GLU HB2 1 1 1 210 1 1 15 GLU HB3 H -0.180 4.623 -3.104 1.00 . A A . 21 GLU HB3 1 1 1 211 1 1 15 GLU HG2 H -2.481 5.036 -4.812 1.00 . A A . 21 GLU HG2 1 1 1 212 1 1 15 GLU HG3 H -2.717 5.710 -3.200 1.00 . A A . 21 GLU HG3 1 1 1 213 1 1 15 GLU N N -2.352 2.687 -4.799 1.00 . A A . 21 GLU N 1 1 1 214 1 1 15 GLU O O 0.789 1.758 -3.389 1.00 . A A . 21 GLU O 1 1 1 215 1 1 15 GLU OE1 O -0.147 6.402 -5.055 1.00 . A A . 21 GLU OE1 1 1 1 216 1 1 15 GLU OE2 O -1.429 7.705 -3.835 1.00 . A A . 21 GLU OE2 1 1 1 217 1 1 16 GLY C C -0.552 0.177 -0.757 1.00 . A A . 22 GLY C 1 1 1 218 1 1 16 GLY CA C -0.802 -0.149 -2.215 1.00 . A A . 22 GLY CA 1 1 1 219 1 1 16 GLY H H -2.248 1.138 -3.073 1.00 . A A . 22 GLY H 1 1 1 220 1 1 16 GLY HA2 H -1.536 -0.939 -2.277 1.00 . A A . 22 GLY HA2 1 1 1 221 1 1 16 GLY HA3 H 0.120 -0.492 -2.660 1.00 . A A . 22 GLY HA3 1 1 1 222 1 1 16 GLY N N -1.285 0.999 -2.961 1.00 . A A . 22 GLY N 1 1 1 223 1 1 16 GLY O O 0.327 0.976 -0.434 1.00 . A A . 22 GLY O 1 1 1 224 1 1 17 GLN C C -0.208 -1.180 2.193 1.00 . A A . 23 GLN C 1 1 1 225 1 1 17 GLN CA C -1.190 -0.197 1.560 1.00 . A A . 23 GLN CA 1 1 1 226 1 1 17 GLN CB C -2.551 -0.297 2.251 1.00 . A A . 23 GLN CB 1 1 1 227 1 1 17 GLN CD C -3.581 1.888 2.992 1.00 . A A . 23 GLN CD 1 1 1 228 1 1 17 GLN CG C -3.497 0.840 1.899 1.00 . A A . 23 GLN CG 1 1 1 229 1 1 17 GLN H H -2.019 -1.056 -0.188 1.00 . A A . 23 GLN H 1 1 1 230 1 1 17 GLN HA H -0.806 0.804 1.688 1.00 . A A . 23 GLN HA 1 1 1 231 1 1 17 GLN HB2 H -3.020 -1.227 1.965 1.00 . A A . 23 GLN HB2 1 1 1 232 1 1 17 GLN HB3 H -2.401 -0.293 3.320 1.00 . A A . 23 GLN HB3 1 1 1 233 1 1 17 GLN HE21 H -1.597 1.971 3.099 1.00 . A A . 23 GLN HE21 1 1 1 234 1 1 17 GLN HE22 H -2.452 3.014 4.179 1.00 . A A . 23 GLN HE22 1 1 1 235 1 1 17 GLN HG2 H -3.149 1.314 0.994 1.00 . A A . 23 GLN HG2 1 1 1 236 1 1 17 GLN HG3 H -4.484 0.433 1.734 1.00 . A A . 23 GLN HG3 1 1 1 237 1 1 17 GLN N N -1.331 -0.434 0.128 1.00 . A A . 23 GLN N 1 1 1 238 1 1 17 GLN NE2 N -2.427 2.336 3.472 1.00 . A A . 23 GLN NE2 1 1 1 239 1 1 17 GLN O O 0.944 -0.837 2.459 1.00 . A A . 23 GLN O 1 1 1 240 1 1 17 GLN OE1 O -4.670 2.290 3.400 1.00 . A A . 23 GLN OE1 1 1 1 241 1 1 18 ALA C C 1.457 -3.639 2.289 1.00 . A A . 24 ALA C 1 1 1 242 1 1 18 ALA CA C 0.153 -3.434 3.054 1.00 . A A . 24 ALA CA 1 1 1 243 1 1 18 ALA CB C -0.619 -4.742 3.138 1.00 . A A . 24 ALA CB 1 1 1 244 1 1 18 ALA H H -1.605 -2.609 2.212 1.00 . A A . 24 ALA H 1 1 1 245 1 1 18 ALA HA H 0.386 -3.118 4.060 1.00 . A A . 24 ALA HA 1 1 1 246 1 1 18 ALA HB1 H -1.581 -4.564 3.595 1.00 . A A . 24 ALA HB1 1 1 1 247 1 1 18 ALA HB2 H -0.760 -5.142 2.145 1.00 . A A . 24 ALA HB2 1 1 1 248 1 1 18 ALA HB3 H -0.063 -5.450 3.736 1.00 . A A . 24 ALA HB3 1 1 1 249 1 1 18 ALA N N -0.676 -2.400 2.441 1.00 . A A . 24 ALA N 1 1 1 250 1 1 18 ALA O O 2.543 -3.570 2.865 1.00 . A A . 24 ALA O 1 1 1 251 1 1 19 ALA C C 3.508 -2.967 0.256 1.00 . A A . 25 ALA C 1 1 1 252 1 1 19 ALA CA C 2.517 -4.121 0.150 1.00 . A A . 25 ALA CA 1 1 1 253 1 1 19 ALA CB C 2.095 -4.324 -1.298 1.00 . A A . 25 ALA CB 1 1 1 254 1 1 19 ALA H H 0.452 -3.946 0.588 1.00 . A A . 25 ALA H 1 1 1 255 1 1 19 ALA HA H 3.001 -5.026 0.488 1.00 . A A . 25 ALA HA 1 1 1 256 1 1 19 ALA HB1 H 1.312 -3.624 -1.546 1.00 . A A . 25 ALA HB1 1 1 1 257 1 1 19 ALA HB2 H 2.944 -4.160 -1.946 1.00 . A A . 25 ALA HB2 1 1 1 258 1 1 19 ALA HB3 H 1.732 -5.333 -1.428 1.00 . A A . 25 ALA HB3 1 1 1 259 1 1 19 ALA N N 1.345 -3.898 0.990 1.00 . A A . 25 ALA N 1 1 1 260 1 1 19 ALA O O 4.562 -3.099 0.876 1.00 . A A . 25 ALA O 1 1 1 261 1 1 20 LYS C C 4.554 -0.372 1.077 1.00 . A A . 26 LYS C 1 1 1 262 1 1 20 LYS CA C 4.033 -0.659 -0.330 1.00 . A A . 26 LYS CA 1 1 1 263 1 1 20 LYS CB C 3.289 0.563 -0.875 1.00 . A A . 26 LYS CB 1 1 1 264 1 1 20 LYS CD C 4.186 0.111 -3.195 1.00 . A A . 26 LYS CD 1 1 1 265 1 1 20 LYS CE C 2.932 -0.687 -3.521 1.00 . A A . 26 LYS CE 1 1 1 266 1 1 20 LYS CG C 3.925 1.163 -2.123 1.00 . A A . 26 LYS CG 1 1 1 267 1 1 20 LYS HA H 4.877 -0.864 -0.970 1.00 . A A . 26 LYS HA 1 1 1 268 1 1 20 LYS HB2 H 2.278 0.274 -1.117 1.00 . A A . 26 LYS HB2 1 1 1 269 1 1 20 LYS HD2 H 4.527 0.605 -4.092 1.00 . A A . 26 LYS HD2 1 1 1 270 1 1 20 LYS HE2 H 2.436 -0.948 -2.599 1.00 . A A . 26 LYS HE2 1 1 1 271 1 1 20 LYS HG2 H 3.262 1.912 -2.527 1.00 . A A . 26 LYS HG2 1 1 1 272 1 1 20 LYS HZ1 H 2.804 -2.033 -5.130 1.00 . A A . 26 LYS HZ1 1 1 1 273 1 1 20 LYS N N 3.166 -1.836 -0.353 1.00 . A A . 26 LYS N 1 1 1 274 1 1 20 LYS NZ N 3.233 -1.912 -4.259 1.00 . A A . 26 LYS NZ 1 1 1 275 1 1 20 LYS O O 5.610 0.234 1.240 1.00 . A A . 26 LYS O 1 1 1 276 1 1 21 GLU C C 5.697 -0.912 3.687 1.00 . A A . 27 GLU C 1 1 1 277 1 1 21 GLU CA C 4.214 -0.600 3.481 1.00 . A A . 27 GLU CA 1 1 1 278 1 1 21 GLU CB C 3.367 -1.466 4.415 1.00 . A A . 27 GLU CB 1 1 1 279 1 1 21 GLU CD C 4.457 -0.680 6.554 1.00 . A A . 27 GLU CD 1 1 1 280 1 1 21 GLU CG C 3.159 -0.853 5.790 1.00 . A A . 27 GLU CG 1 1 1 281 1 1 21 GLU H H 2.980 -1.291 1.904 1.00 . A A . 27 GLU H 1 1 1 282 1 1 21 GLU HA H 4.043 0.439 3.718 1.00 . A A . 27 GLU HA 1 1 1 283 1 1 21 GLU HB2 H 2.398 -1.621 3.964 1.00 . A A . 27 GLU HB2 1 1 1 284 1 1 21 GLU HB3 H 3.853 -2.422 4.541 1.00 . A A . 27 GLU HB3 1 1 1 285 1 1 21 GLU HG2 H 2.698 0.117 5.672 1.00 . A A . 27 GLU HG2 1 1 1 286 1 1 21 GLU HG3 H 2.504 -1.495 6.361 1.00 . A A . 27 GLU HG3 1 1 1 287 1 1 21 GLU N N 3.814 -0.812 2.091 1.00 . A A . 27 GLU N 1 1 1 288 1 1 21 GLU O O 6.339 -0.352 4.575 1.00 . A A . 27 GLU O 1 1 1 289 1 1 21 GLU OE1 O 4.933 -1.671 7.147 1.00 . A A . 27 GLU OE1 1 1 1 290 1 1 21 GLU OE2 O 4.998 0.445 6.559 1.00 . A A . 27 GLU OE2 1 1 1 291 1 1 22 PHE C C 8.552 -1.063 2.471 1.00 . A A . 28 PHE C 1 1 1 292 1 1 22 PHE CA C 7.640 -2.189 2.962 1.00 . A A . 28 PHE CA 1 1 1 293 1 1 22 PHE CB C 7.903 -3.484 2.173 1.00 . A A . 28 PHE CB 1 1 1 294 1 1 22 PHE CD1 C 9.070 -2.630 0.113 1.00 . A A . 28 PHE CD1 1 1 1 295 1 1 22 PHE CD2 C 7.010 -3.799 -0.155 1.00 . A A . 28 PHE CD2 1 1 1 296 1 1 22 PHE CE1 C 9.156 -2.459 -1.254 1.00 . A A . 28 PHE CE1 1 1 1 297 1 1 22 PHE CE2 C 7.091 -3.632 -1.523 1.00 . A A . 28 PHE CE2 1 1 1 298 1 1 22 PHE CG C 7.997 -3.300 0.680 1.00 . A A . 28 PHE CG 1 1 1 299 1 1 22 PHE CZ C 8.165 -2.960 -2.074 1.00 . A A . 28 PHE CZ 1 1 1 300 1 1 22 PHE H H 5.675 -2.225 2.175 1.00 . A A . 28 PHE H 1 1 1 301 1 1 22 PHE HA H 7.853 -2.370 4.005 1.00 . A A . 28 PHE HA 1 1 1 302 1 1 22 PHE HB2 H 8.833 -3.916 2.509 1.00 . A A . 28 PHE HB2 1 1 1 303 1 1 22 PHE HB3 H 7.100 -4.181 2.370 1.00 . A A . 28 PHE HB3 1 1 1 304 1 1 22 PHE HD1 H 9.846 -2.238 0.753 1.00 . A A . 28 PHE HD1 1 1 1 305 1 1 22 PHE HD2 H 6.172 -4.328 0.270 1.00 . A A . 28 PHE HD2 1 1 1 306 1 1 22 PHE HE1 H 9.998 -1.934 -1.680 1.00 . A A . 28 PHE HE1 1 1 1 307 1 1 22 PHE HE2 H 6.315 -4.026 -2.161 1.00 . A A . 28 PHE HE2 1 1 1 308 1 1 22 PHE HZ H 8.230 -2.828 -3.144 1.00 . A A . 28 PHE HZ 1 1 1 309 1 1 22 PHE N N 6.235 -1.809 2.863 1.00 . A A . 28 PHE N 1 1 1 310 1 1 22 PHE O O 9.630 -0.843 3.022 1.00 . A A . 28 PHE O 1 1 1 311 1 1 23 ILE C C 9.458 1.654 1.945 1.00 . A A . 29 ILE C 1 1 1 312 1 1 23 ILE CA C 8.893 0.743 0.857 1.00 . A A . 29 ILE CA 1 1 1 313 1 1 23 ILE CB C 8.046 1.583 -0.125 1.00 . A A . 29 ILE CB 1 1 1 314 1 1 23 ILE CD1 C 8.192 3.306 -1.989 1.00 . A A . 29 ILE CD1 1 1 1 315 1 1 23 ILE CG1 C 8.945 2.504 -0.950 1.00 . A A . 29 ILE CG1 1 1 1 316 1 1 23 ILE CG2 C 6.991 2.395 0.618 1.00 . A A . 29 ILE CG2 1 1 1 317 1 1 23 ILE H H 7.248 -0.583 1.030 1.00 . A A . 29 ILE H 1 1 1 318 1 1 23 ILE HA H 9.719 0.312 0.302 1.00 . A A . 29 ILE HA 1 1 1 319 1 1 23 ILE HB H 7.534 0.905 -0.791 1.00 . A A . 29 ILE HB 1 1 1 320 1 1 23 ILE HD11 H 7.492 2.663 -2.502 1.00 . A A . 29 ILE HD11 1 1 1 321 1 1 23 ILE HD12 H 7.656 4.109 -1.505 1.00 . A A . 29 ILE HD12 1 1 1 322 1 1 23 ILE HD13 H 8.891 3.718 -2.702 1.00 . A A . 29 ILE HD13 1 1 1 323 1 1 23 ILE HG12 H 9.440 3.199 -0.290 1.00 . A A . 29 ILE HG12 1 1 1 324 1 1 23 ILE HG13 H 9.686 1.908 -1.461 1.00 . A A . 29 ILE HG13 1 1 1 325 1 1 23 ILE HG21 H 6.901 2.028 1.629 1.00 . A A . 29 ILE HG21 1 1 1 326 1 1 23 ILE HG22 H 7.283 3.434 0.636 1.00 . A A . 29 ILE HG22 1 1 1 327 1 1 23 ILE HG23 H 6.041 2.296 0.113 1.00 . A A . 29 ILE HG23 1 1 1 328 1 1 23 ILE N N 8.114 -0.357 1.428 1.00 . A A . 29 ILE N 1 1 1 329 1 1 23 ILE O O 10.518 2.257 1.776 1.00 . A A . 29 ILE O 1 1 1 330 1 1 24 ALA C C 10.452 2.043 4.807 1.00 . A A . 30 ALA C 1 1 1 331 1 1 24 ALA CA C 9.172 2.583 4.176 1.00 . A A . 30 ALA CA 1 1 1 332 1 1 24 ALA CB C 8.068 2.678 5.218 1.00 . A A . 30 ALA CB 1 1 1 333 1 1 24 ALA H H 7.907 1.242 3.138 1.00 . A A . 30 ALA H 1 1 1 334 1 1 24 ALA HA H 9.362 3.575 3.795 1.00 . A A . 30 ALA HA 1 1 1 335 1 1 24 ALA HB1 H 7.490 1.766 5.215 1.00 . A A . 30 ALA HB1 1 1 1 336 1 1 24 ALA HB2 H 8.507 2.823 6.195 1.00 . A A . 30 ALA HB2 1 1 1 337 1 1 24 ALA HB3 H 7.425 3.513 4.985 1.00 . A A . 30 ALA HB3 1 1 1 338 1 1 24 ALA N N 8.743 1.748 3.062 1.00 . A A . 30 ALA N 1 1 1 339 1 1 24 ALA O O 11.316 2.809 5.233 1.00 . A A . 30 ALA O 1 1 1 340 1 1 25 TRP C C 13.012 0.497 4.699 1.00 . A A . 31 TRP C 1 1 1 341 1 1 25 TRP CA C 11.742 0.079 5.445 1.00 . A A . 31 TRP CA 1 1 1 342 1 1 25 TRP CB C 11.570 -1.453 5.434 1.00 . A A . 31 TRP CB 1 1 1 343 1 1 25 TRP CD1 C 13.977 -2.283 5.121 1.00 . A A . 31 TRP CD1 1 1 1 344 1 1 25 TRP CD2 C 12.566 -2.934 3.508 1.00 . A A . 31 TRP CD2 1 1 1 345 1 1 25 TRP CE2 C 13.845 -3.442 3.218 1.00 . A A . 31 TRP CE2 1 1 1 346 1 1 25 TRP CE3 C 11.514 -3.218 2.630 1.00 . A A . 31 TRP CE3 1 1 1 347 1 1 25 TRP CG C 12.671 -2.193 4.730 1.00 . A A . 31 TRP CG 1 1 1 348 1 1 25 TRP CH2 C 13.055 -4.476 1.249 1.00 . A A . 31 TRP CH2 1 1 1 349 1 1 25 TRP CZ2 C 14.101 -4.214 2.089 1.00 . A A . 31 TRP CZ2 1 1 1 350 1 1 25 TRP CZ3 C 11.771 -3.987 1.511 1.00 . A A . 31 TRP CZ3 1 1 1 351 1 1 25 TRP H H 9.844 0.161 4.509 1.00 . A A . 31 TRP H 1 1 1 352 1 1 25 TRP HA H 11.821 0.413 6.469 1.00 . A A . 31 TRP HA 1 1 1 353 1 1 25 TRP HB2 H 11.534 -1.808 6.452 1.00 . A A . 31 TRP HB2 1 1 1 354 1 1 25 TRP HB3 H 10.639 -1.697 4.943 1.00 . A A . 31 TRP HB3 1 1 1 355 1 1 25 TRP HD1 H 14.377 -1.825 6.013 1.00 . A A . 31 TRP HD1 1 1 1 356 1 1 25 TRP HE1 H 15.645 -3.237 4.276 1.00 . A A . 31 TRP HE1 1 1 1 357 1 1 25 TRP HE3 H 10.517 -2.851 2.814 1.00 . A A . 31 TRP HE3 1 1 1 358 1 1 25 TRP HH2 H 13.210 -5.072 0.361 1.00 . A A . 31 TRP HH2 1 1 1 359 1 1 25 TRP HZ2 H 15.085 -4.596 1.872 1.00 . A A . 31 TRP HZ2 1 1 1 360 1 1 25 TRP HZ3 H 10.972 -4.216 0.822 1.00 . A A . 31 TRP HZ3 1 1 1 361 1 1 25 TRP N N 10.567 0.720 4.864 1.00 . A A . 31 TRP N 1 1 1 362 1 1 25 TRP NE1 N 14.689 -3.030 4.216 1.00 . A A . 31 TRP NE1 1 1 1 363 1 1 25 TRP O O 13.917 1.095 5.281 1.00 . A A . 31 TRP O 1 1 1 364 1 1 26 LEU C C 14.533 1.994 2.624 1.00 . A A . 32 LEU C 1 1 1 365 1 1 26 LEU CA C 14.232 0.497 2.587 1.00 . A A . 32 LEU CA 1 1 1 366 1 1 26 LEU CB C 14.009 0.040 1.142 1.00 . A A . 32 LEU CB 1 1 1 367 1 1 26 LEU CD1 C 12.602 1.451 -0.381 1.00 . A A . 32 LEU CD1 1 1 1 368 1 1 26 LEU CD2 C 12.070 -0.972 -0.082 1.00 . A A . 32 LEU CD2 1 1 1 369 1 1 26 LEU CG C 12.602 0.283 0.592 1.00 . A A . 32 LEU CG 1 1 1 370 1 1 26 LEU H H 12.322 -0.316 3.008 1.00 . A A . 32 LEU H 1 1 1 371 1 1 26 LEU HA H 15.080 -0.033 2.991 1.00 . A A . 32 LEU HA 1 1 1 372 1 1 26 LEU HB2 H 14.716 0.559 0.511 1.00 . A A . 32 LEU HB2 1 1 1 373 1 1 26 LEU HB3 H 14.214 -1.019 1.088 1.00 . A A . 32 LEU HB3 1 1 1 374 1 1 26 LEU HD11 H 13.448 2.090 -0.176 1.00 . A A . 32 LEU HD11 1 1 1 375 1 1 26 LEU HD12 H 12.670 1.077 -1.392 1.00 . A A . 32 LEU HD12 1 1 1 376 1 1 26 LEU HD13 H 11.689 2.015 -0.266 1.00 . A A . 32 LEU HD13 1 1 1 377 1 1 26 LEU HD21 H 12.856 -1.430 -0.664 1.00 . A A . 32 LEU HD21 1 1 1 378 1 1 26 LEU HD22 H 11.728 -1.666 0.670 1.00 . A A . 32 LEU HD22 1 1 1 379 1 1 26 LEU HD23 H 11.247 -0.710 -0.731 1.00 . A A . 32 LEU HD23 1 1 1 380 1 1 26 LEU HG H 11.942 0.529 1.407 1.00 . A A . 32 LEU HG 1 1 1 381 1 1 26 LEU N N 13.072 0.168 3.411 1.00 . A A . 32 LEU N 1 1 1 382 1 1 26 LEU O O 15.651 2.401 2.937 1.00 . A A . 32 LEU O 1 1 1 383 1 1 27 VAL C C 14.186 4.754 3.669 1.00 . A A . 33 VAL C 1 1 1 384 1 1 27 VAL CA C 13.702 4.260 2.307 1.00 . A A . 33 VAL CA 1 1 1 385 1 1 27 VAL CB C 12.388 4.984 1.940 1.00 . A A . 33 VAL CB 1 1 1 386 1 1 27 VAL CG1 C 12.559 6.495 2.024 1.00 . A A . 33 VAL CG1 1 1 1 387 1 1 27 VAL CG2 C 11.920 4.572 0.551 1.00 . A A . 33 VAL CG2 1 1 1 388 1 1 27 VAL H H 12.661 2.429 2.065 1.00 . A A . 33 VAL H 1 1 1 389 1 1 27 VAL HA H 14.444 4.508 1.562 1.00 . A A . 33 VAL HA 1 1 1 390 1 1 27 VAL HB H 11.629 4.691 2.652 1.00 . A A . 33 VAL HB 1 1 1 391 1 1 27 VAL HG11 H 13.579 6.755 1.780 1.00 . A A . 33 VAL HG11 1 1 1 392 1 1 27 VAL HG12 H 11.889 6.972 1.325 1.00 . A A . 33 VAL HG12 1 1 1 393 1 1 27 VAL HG13 H 12.332 6.828 3.026 1.00 . A A . 33 VAL HG13 1 1 1 394 1 1 27 VAL HG21 H 12.628 3.879 0.121 1.00 . A A . 33 VAL HG21 1 1 1 395 1 1 27 VAL HG22 H 10.952 4.099 0.622 1.00 . A A . 33 VAL HG22 1 1 1 396 1 1 27 VAL HG23 H 11.847 5.446 -0.080 1.00 . A A . 33 VAL HG23 1 1 1 397 1 1 27 VAL N N 13.532 2.810 2.306 1.00 . A A . 33 VAL N 1 1 1 398 1 1 27 VAL O O 14.882 5.765 3.761 1.00 . A A . 33 VAL O 1 1 1 399 1 1 28 ARG C C 15.295 3.458 6.600 1.00 . A A . 34 ARG C 1 1 1 400 1 1 28 ARG CA C 14.214 4.401 6.077 1.00 . A A . 34 ARG CA 1 1 1 401 1 1 28 ARG CB C 13.003 4.381 7.012 1.00 . A A . 34 ARG CB 1 1 1 402 1 1 28 ARG CD C 10.611 5.085 7.331 1.00 . A A . 34 ARG CD 1 1 1 403 1 1 28 ARG CG C 11.929 5.389 6.637 1.00 . A A . 34 ARG CG 1 1 1 404 1 1 28 ARG CZ C 10.882 5.721 9.699 1.00 . A A . 34 ARG CZ 1 1 1 405 1 1 28 ARG H H 13.261 3.237 4.587 1.00 . A A . 34 ARG H 1 1 1 406 1 1 28 ARG HA H 14.615 5.403 6.043 1.00 . A A . 34 ARG HA 1 1 1 407 1 1 28 ARG HB2 H 12.564 3.395 6.993 1.00 . A A . 34 ARG HB2 1 1 1 408 1 1 28 ARG HB3 H 13.335 4.598 8.016 1.00 . A A . 34 ARG HB3 1 1 1 409 1 1 28 ARG HD2 H 9.806 5.227 6.625 1.00 . A A . 34 ARG HD2 1 1 1 410 1 1 28 ARG HD3 H 10.620 4.056 7.661 1.00 . A A . 34 ARG HD3 1 1 1 411 1 1 28 ARG HE H 9.833 6.751 8.349 1.00 . A A . 34 ARG HE 1 1 1 412 1 1 28 ARG HG2 H 12.257 6.375 6.928 1.00 . A A . 34 ARG HG2 1 1 1 413 1 1 28 ARG HG3 H 11.778 5.359 5.568 1.00 . A A . 34 ARG HG3 1 1 1 414 1 1 28 ARG HH11 H 11.833 4.012 9.182 1.00 . A A . 34 ARG HH11 1 1 1 415 1 1 28 ARG HH12 H 12.005 4.485 10.838 1.00 . A A . 34 ARG HH12 1 1 1 416 1 1 28 ARG HH21 H 10.060 7.371 10.526 1.00 . A A . 34 ARG HH21 1 1 1 417 1 1 28 ARG HH22 H 10.999 6.390 11.602 1.00 . A A . 34 ARG HH22 1 1 1 418 1 1 28 ARG N N 13.815 4.034 4.723 1.00 . A A . 34 ARG N 1 1 1 419 1 1 28 ARG NE N 10.385 5.953 8.485 1.00 . A A . 34 ARG NE 1 1 1 420 1 1 28 ARG NH1 N 11.635 4.651 9.924 1.00 . A A . 34 ARG NH1 1 1 1 421 1 1 28 ARG NH2 N 10.626 6.563 10.690 1.00 . A A . 34 ARG NH2 1 1 1 422 1 1 28 ARG O O 15.143 2.848 7.659 1.00 . A A . 34 ARG O 1 1 1 423 1 1 29 GLY C C 18.062 1.699 5.092 1.00 . A A . 35 GLY C 1 1 1 424 1 1 29 GLY CA C 17.475 2.475 6.255 1.00 . A A . 35 GLY CA 1 1 1 425 1 1 29 GLY H H 16.452 3.854 5.017 1.00 . A A . 35 GLY H 1 1 1 426 1 1 29 GLY HA2 H 18.254 3.076 6.702 1.00 . A A . 35 GLY HA2 1 1 1 427 1 1 29 GLY HA3 H 17.108 1.775 6.991 1.00 . A A . 35 GLY HA3 1 1 1 428 1 1 29 GLY N N 16.386 3.344 5.851 1.00 . A A . 35 GLY N 1 1 1 429 1 1 29 GLY O O 18.226 0.482 5.169 1.00 . A A . 35 GLY O 1 1 1 430 1 1 30 ARG C C 19.641 2.809 1.942 1.00 . A A . 36 ARG C 1 1 1 431 1 1 30 ARG CA C 18.950 1.776 2.827 1.00 . A A . 36 ARG CA 1 1 1 432 1 1 30 ARG CB C 17.862 1.051 2.033 1.00 . A A . 36 ARG CB 1 1 1 433 1 1 30 ARG CD C 17.300 -0.504 0.141 1.00 . A A . 36 ARG CD 1 1 1 434 1 1 30 ARG CG C 18.407 0.062 1.016 1.00 . A A . 36 ARG CG 1 1 1 435 1 1 30 ARG CZ C 18.183 -2.686 -0.590 1.00 . A A . 36 ARG CZ 1 1 1 436 1 1 30 ARG H H 18.224 3.374 4.011 1.00 . A A . 36 ARG H 1 1 1 437 1 1 30 ARG HA H 19.683 1.055 3.157 1.00 . A A . 36 ARG HA 1 1 1 438 1 1 30 ARG HB2 H 17.228 0.512 2.722 1.00 . A A . 36 ARG HB2 1 1 1 439 1 1 30 ARG HB3 H 17.267 1.784 1.508 1.00 . A A . 36 ARG HB3 1 1 1 440 1 1 30 ARG HD2 H 16.592 -1.024 0.770 1.00 . A A . 36 ARG HD2 1 1 1 441 1 1 30 ARG HD3 H 16.803 0.312 -0.362 1.00 . A A . 36 ARG HD3 1 1 1 442 1 1 30 ARG HE H 17.895 -1.111 -1.781 1.00 . A A . 36 ARG HE 1 1 1 443 1 1 30 ARG HG2 H 19.126 0.566 0.387 1.00 . A A . 36 ARG HG2 1 1 1 444 1 1 30 ARG HG3 H 18.891 -0.749 1.540 1.00 . A A . 36 ARG HG3 1 1 1 445 1 1 30 ARG HH11 H 17.744 -2.577 1.382 1.00 . A A . 36 ARG HH11 1 1 1 446 1 1 30 ARG HH12 H 18.367 -4.100 0.843 1.00 . A A . 36 ARG HH12 1 1 1 447 1 1 30 ARG HH21 H 18.714 -3.113 -2.492 1.00 . A A . 36 ARG HH21 1 1 1 448 1 1 30 ARG HH22 H 18.919 -4.405 -1.356 1.00 . A A . 36 ARG HH22 1 1 1 449 1 1 30 ARG N N 18.378 2.406 4.012 1.00 . A A . 36 ARG N 1 1 1 450 1 1 30 ARG NE N 17.816 -1.435 -0.860 1.00 . A A . 36 ARG NE 1 1 1 451 1 1 30 ARG NH1 N 18.091 -3.160 0.647 1.00 . A A . 36 ARG NH1 1 1 1 452 1 1 30 ARG NH2 N 18.643 -3.465 -1.559 1.00 . A A . 36 ARG NH2 1 1 1 453 1 1 30 ARG O O 19.569 2.738 0.715 1.00 . A A . 36 ARG O 1 1 1 454 1 1 31 GLY C C 20.294 6.139 1.892 1.00 . A A . 37 GLY C 1 1 1 455 1 1 31 GLY CA C 21.004 4.802 1.828 1.00 . A A . 37 GLY CA 1 1 1 456 1 1 31 GLY H H 20.333 3.774 3.553 1.00 . A A . 37 GLY H 1 1 1 457 1 1 31 GLY HA2 H 21.999 4.915 2.233 1.00 . A A . 37 GLY HA2 1 1 1 458 1 1 31 GLY HA3 H 21.081 4.496 0.795 1.00 . A A . 37 GLY HA3 1 1 1 459 1 1 31 GLY N N 20.310 3.768 2.573 1.00 . A A . 37 GLY N 1 1 1 460 1 1 31 GLY O O 19.798 6.497 2.981 1.00 . A A . 37 GLY O 1 1 1 461 1 1 31 GLY OXT O 20.234 6.830 0.853 1.00 . A A . 37 GLY OXT 1 1 1 462 2 2 1 . C02 C 8.110 -5.841 -3.197 1.00 . B A . 1038 D6M C02 1 1 1 463 2 2 1 . C04 C 6.144 -5.881 -4.652 1.00 . B A . 1038 D6M C04 1 1 1 464 2 2 1 . C05 C 5.791 -4.400 -4.812 1.00 . B A . 1038 D6M C05 1 1 1 465 2 2 1 . C06 C 4.309 -4.115 -4.626 1.00 . B A . 1038 D6M C06 1 1 1 466 2 2 1 . C07 C 4.044 -2.864 -3.812 1.00 . B A . 1038 D6M C07 1 1 1 467 2 2 1 . C09 C 6.999 -6.349 -5.829 1.00 . B A . 1038 D6M C09 1 1 1 468 2 2 1 . C12 C 8.799 -6.129 -1.877 1.00 . B A . 1038 D6M C12 1 1 1 469 2 2 1 . C13 C 10.091 -5.342 -1.703 1.00 . B A . 1038 D6M C13 1 1 1 470 2 2 1 . C14 C 11.300 -6.261 -1.584 1.00 . B A . 1038 D6M C14 1 1 1 471 2 2 1 . C15 C 12.280 -6.051 -2.729 1.00 . B A . 1038 D6M C15 1 1 1 472 2 2 1 . C16 C 13.539 -5.337 -2.264 1.00 . B A . 1038 D6M C16 1 1 1 473 2 2 1 . C17 C 13.272 -3.869 -1.972 1.00 . B A . 1038 D6M C17 1 1 1 474 2 2 1 . C18 C 13.317 -3.030 -3.240 1.00 . B A . 1038 D6M C18 1 1 1 475 2 2 1 . C19 C 12.110 -2.113 -3.343 1.00 . B A . 1038 D6M C19 1 1 1 476 2 2 1 . C20 C 12.446 -0.826 -4.078 1.00 . B A . 1038 D6M C20 1 1 1 477 2 2 1 . C21 C 11.223 -0.245 -4.768 1.00 . B A . 1038 D6M C21 1 1 1 478 2 2 1 . C22 C 11.294 1.271 -4.841 1.00 . B A . 1038 D6M C22 1 1 1 479 2 2 1 . C23 C 11.059 1.908 -3.480 1.00 . B A . 1038 D6M C23 1 1 1 480 2 2 1 . C24 C 12.030 3.051 -3.223 1.00 . B A . 1038 D6M C24 1 1 1 481 2 2 1 . C25 C 11.315 4.284 -2.697 1.00 . B A . 1038 D6M C25 1 1 1 482 2 2 1 . C26 C 12.260 5.455 -2.540 1.00 . B A . 1038 D6M C26 1 1 1 483 2 2 1 . H03 H 6.263 -6.287 -2.584 1.00 . B A . 1038 D6M H03 1 1 1 484 2 2 1 . H04 H 5.230 -6.454 -4.644 1.00 . B A . 1038 D6M H04 1 1 1 485 2 2 1 . HP21 H 9.024 -7.184 -1.829 1.00 . B A . 1038 D6M HP21 1 1 1 486 2 2 1 . HP22 H 8.126 -5.869 -1.074 1.00 . B A . 1038 D6M HP22 1 1 1 487 2 2 1 . HP31 H 10.016 -4.745 -0.806 1.00 . B A . 1038 D6M HP31 1 1 1 488 2 2 1 . HP32 H 10.225 -4.695 -2.556 1.00 . B A . 1038 D6M HP32 1 1 1 489 2 2 1 . HP41 H 10.963 -7.288 -1.593 1.00 . B A . 1038 D6M HP41 1 1 1 490 2 2 1 . HP42 H 11.803 -6.056 -0.651 1.00 . B A . 1038 D6M HP42 1 1 1 491 2 2 1 . HP51 H 11.802 -5.458 -3.495 1.00 . B A . 1038 D6M HP51 1 1 1 492 2 2 1 . HP52 H 12.554 -7.013 -3.135 1.00 . B A . 1038 D6M HP52 1 1 1 493 2 2 1 . HP61 H 14.289 -5.411 -3.037 1.00 . B A . 1038 D6M HP61 1 1 1 494 2 2 1 . HP62 H 13.899 -5.813 -1.364 1.00 . B A . 1038 D6M HP62 1 1 1 495 2 2 1 . HP71 H 14.023 -3.507 -1.285 1.00 . B A . 1038 D6M HP71 1 1 1 496 2 2 1 . HP72 H 12.295 -3.774 -1.523 1.00 . B A . 1038 D6M HP72 1 1 1 497 2 2 1 . HP81 H 13.332 -3.689 -4.097 1.00 . B A . 1038 D6M HP81 1 1 1 498 2 2 1 . HP82 H 14.213 -2.429 -3.231 1.00 . B A . 1038 D6M HP82 1 1 1 499 2 2 1 . HP91 H 11.771 -1.870 -2.348 1.00 . B A . 1038 D6M HP91 1 1 1 500 2 2 1 . HP92 H 11.324 -2.626 -3.877 1.00 . B A . 1038 D6M HP92 1 1 1 501 2 2 1 . HPA1 H 13.203 -1.033 -4.819 1.00 . B A . 1038 D6M HPA1 1 1 1 502 2 2 1 . HPA2 H 12.821 -0.105 -3.367 1.00 . B A . 1038 D6M HPA2 1 1 1 503 2 2 1 . HPB1 H 10.340 -0.529 -4.214 1.00 . B A . 1038 D6M HPB1 1 1 1 504 2 2 1 . HPB2 H 11.164 -0.642 -5.770 1.00 . B A . 1038 D6M HPB2 1 1 1 505 2 2 1 . HPC1 H 10.539 1.624 -5.529 1.00 . B A . 1038 D6M HPC1 1 1 1 506 2 2 1 . HPC2 H 12.271 1.559 -5.199 1.00 . B A . 1038 D6M HPC2 1 1 1 507 2 2 1 . HPD1 H 11.188 1.157 -2.713 1.00 . B A . 1038 D6M HPD1 1 1 1 508 2 2 1 . HPD2 H 10.051 2.291 -3.443 1.00 . B A . 1038 D6M HPD2 1 1 1 509 2 2 1 . HPE1 H 12.529 3.302 -4.148 1.00 . B A . 1038 D6M HPE1 1 1 1 510 2 2 1 . HPE2 H 12.760 2.733 -2.494 1.00 . B A . 1038 D6M HPE2 1 1 1 511 2 2 1 . HPF1 H 10.882 4.058 -1.732 1.00 . B A . 1038 D6M HPF1 1 1 1 512 2 2 1 . HPF2 H 10.536 4.565 -3.389 1.00 . B A . 1038 D6M HPF2 1 1 1 513 2 2 1 . HPG1 H 12.778 5.627 -3.472 1.00 . B A . 1038 D6M HPG1 1 1 1 514 2 2 1 . HPG2 H 12.979 5.237 -1.764 1.00 . B A . 1038 D6M HPG2 1 1 1 515 2 2 1 . HPG3 H 11.698 6.338 -2.273 1.00 . B A . 1038 D6M HPG3 1 1 1 516 2 2 1 . HQ21 H 3.854 -3.996 -5.598 1.00 . B A . 1038 D6M HQ21 1 1 1 517 2 2 1 . HQ22 H 3.858 -4.955 -4.120 1.00 . B A . 1038 D6M HQ22 1 1 1 518 2 2 1 . HQ31 H 6.342 -3.830 -4.080 1.00 . B A . 1038 D6M HQ31 1 1 1 519 2 2 1 . HQ32 H 6.077 -4.074 -5.802 1.00 . B A . 1038 D6M HQ32 1 1 1 520 2 2 1 . N03 N 6.816 -6.109 -3.374 1.00 . B A . 1038 D6M N03 1 1 1 521 2 2 1 . O01 O 8.786 -5.384 -4.119 1.00 . B A . 1038 D6M O01 1 1 1 522 2 2 1 . O08 O 4.597 -2.749 -2.718 1.00 . B A . 1038 D6M O08 1 1 1 523 2 2 1 . O10 O 7.898 -7.188 -5.610 1.00 . B A . 1038 D6M O10 1 1 1 524 2 2 1 . O11 O 6.762 -5.872 -6.959 1.00 . B A . 1038 D6M O11 1 1 2 525 1 1 1 HIS C C -29.332 -1.684 0.389 1.00 . A A . 7 HIS C 1 1 2 526 1 1 1 HIS CA C -30.453 -2.277 -0.458 1.00 . A A . 7 HIS CA 1 1 2 527 1 1 1 HIS CB C -30.225 -1.953 -1.936 1.00 . A A . 7 HIS CB 1 1 2 528 1 1 1 HIS CD2 C -32.268 -2.733 -3.331 1.00 . A A . 7 HIS CD2 1 1 2 529 1 1 1 HIS CE1 C -31.387 -4.540 -4.206 1.00 . A A . 7 HIS CE1 1 1 2 530 1 1 1 HIS CG C -31.000 -2.833 -2.867 1.00 . A A . 7 HIS CG 1 1 2 531 1 1 1 HIS H1 H -31.805 -1.710 0.985 1.00 . A A . 7 HIS H1 1 1 2 532 1 1 1 HIS H2 H -31.863 -0.779 -0.452 1.00 . A A . 7 HIS H2 1 1 2 533 1 1 1 HIS H3 H -32.508 -2.369 -0.435 1.00 . A A . 7 HIS H3 1 1 2 534 1 1 1 HIS HA H -30.465 -3.348 -0.326 1.00 . A A . 7 HIS HA 1 1 2 535 1 1 1 HIS HB2 H -30.519 -0.932 -2.123 1.00 . A A . 7 HIS HB2 1 1 2 536 1 1 1 HIS HB3 H -29.175 -2.068 -2.164 1.00 . A A . 7 HIS HB3 1 1 2 537 1 1 1 HIS HD1 H -29.570 -4.322 -3.292 1.00 . A A . 7 HIS HD1 1 1 2 538 1 1 1 HIS HD2 H -32.978 -1.954 -3.093 1.00 . A A . 7 HIS HD2 1 1 2 539 1 1 1 HIS HE1 H -31.258 -5.448 -4.777 1.00 . A A . 7 HIS HE1 1 1 2 540 1 1 1 HIS HE2 H -33.285 -3.954 -4.704 1.00 . A A . 7 HIS HE2 1 1 2 541 1 1 1 HIS N N -31.776 -1.735 -0.054 1.00 . A A . 7 HIS N 1 1 2 542 1 1 1 HIS ND1 N -30.476 -3.976 -3.434 1.00 . A A . 7 HIS ND1 1 1 2 543 1 1 1 HIS NE2 N -32.483 -3.806 -4.161 1.00 . A A . 7 HIS NE2 1 1 2 544 1 1 1 HIS O O -28.945 -0.530 0.205 1.00 . A A . 7 HIS O 1 1 2 545 1 1 2 ALA C C -26.377 -2.225 1.531 1.00 . A A . 8 ALA C 1 1 2 546 1 1 2 ALA CA C -27.737 -2.035 2.193 1.00 . A A . 8 ALA CA 1 1 2 547 1 1 2 ALA CB C -27.789 -2.783 3.517 1.00 . A A . 8 ALA CB 1 1 2 548 1 1 2 ALA H H -29.164 -3.391 1.416 1.00 . A A . 8 ALA H 1 1 2 549 1 1 2 ALA HA H -27.884 -0.984 2.395 1.00 . A A . 8 ALA HA 1 1 2 550 1 1 2 ALA HB1 H -28.241 -3.752 3.365 1.00 . A A . 8 ALA HB1 1 1 2 551 1 1 2 ALA HB2 H -26.787 -2.908 3.899 1.00 . A A . 8 ALA HB2 1 1 2 552 1 1 2 ALA HB3 H -28.377 -2.219 4.226 1.00 . A A . 8 ALA HB3 1 1 2 553 1 1 2 ALA N N -28.814 -2.481 1.318 1.00 . A A . 8 ALA N 1 1 2 554 1 1 2 ALA O O -26.269 -2.861 0.482 1.00 . A A . 8 ALA O 1 1 2 555 1 1 3 GLU C C -22.963 -1.274 2.632 1.00 . A A . 9 GLU C 1 1 2 556 1 1 3 GLU CA C -23.986 -1.777 1.619 1.00 . A A . 9 GLU CA 1 1 2 557 1 1 3 GLU CB C -23.862 -0.987 0.315 1.00 . A A . 9 GLU CB 1 1 2 558 1 1 3 GLU CD C -22.187 -0.645 -1.544 1.00 . A A . 9 GLU CD 1 1 2 559 1 1 3 GLU CG C -22.961 -1.650 -0.714 1.00 . A A . 9 GLU CG 1 1 2 560 1 1 3 GLU H H -25.489 -1.174 2.982 1.00 . A A . 9 GLU H 1 1 2 561 1 1 3 GLU HA H -23.792 -2.820 1.418 1.00 . A A . 9 GLU HA 1 1 2 562 1 1 3 GLU HB2 H -24.845 -0.874 -0.118 1.00 . A A . 9 GLU HB2 1 1 2 563 1 1 3 GLU HB3 H -23.461 -0.009 0.536 1.00 . A A . 9 GLU HB3 1 1 2 564 1 1 3 GLU HG2 H -22.257 -2.287 -0.201 1.00 . A A . 9 GLU HG2 1 1 2 565 1 1 3 GLU HG3 H -23.571 -2.248 -1.376 1.00 . A A . 9 GLU HG3 1 1 2 566 1 1 3 GLU N N -25.340 -1.669 2.149 1.00 . A A . 9 GLU N 1 1 2 567 1 1 3 GLU O O -23.213 -0.310 3.355 1.00 . A A . 9 GLU O 1 1 2 568 1 1 3 GLU OE1 O -22.809 0.030 -2.392 1.00 . A A . 9 GLU OE1 1 1 2 569 1 1 3 GLU OE2 O -20.959 -0.532 -1.347 1.00 . A A . 9 GLU OE2 1 1 2 570 1 1 4 GLY C C -19.839 -0.491 3.022 1.00 . A A . 10 GLY C 1 1 2 571 1 1 4 GLY CA C -20.766 -1.540 3.605 1.00 . A A . 10 GLY CA 1 1 2 572 1 1 4 GLY H H -21.668 -2.694 2.077 1.00 . A A . 10 GLY H 1 1 2 573 1 1 4 GLY HA2 H -21.223 -1.143 4.499 1.00 . A A . 10 GLY HA2 1 1 2 574 1 1 4 GLY HA3 H -20.185 -2.412 3.867 1.00 . A A . 10 GLY HA3 1 1 2 575 1 1 4 GLY N N -21.810 -1.934 2.678 1.00 . A A . 10 GLY N 1 1 2 576 1 1 4 GLY O O -20.114 0.070 1.962 1.00 . A A . 10 GLY O 1 1 2 577 1 1 5 THR C C -17.027 0.269 2.025 1.00 . A A . 11 THR C 1 1 2 578 1 1 5 THR CA C -17.767 0.765 3.263 1.00 . A A . 11 THR CA 1 1 2 579 1 1 5 THR CB C -16.767 1.079 4.377 1.00 . A A . 11 THR CB 1 1 2 580 1 1 5 THR CG2 C -16.350 2.533 4.414 1.00 . A A . 11 THR CG2 1 1 2 581 1 1 5 THR H H -18.574 -0.705 4.556 1.00 . A A . 11 THR H 1 1 2 582 1 1 5 THR HA H -18.306 1.665 3.010 1.00 . A A . 11 THR HA 1 1 2 583 1 1 5 THR HB H -15.878 0.483 4.227 1.00 . A A . 11 THR HB 1 1 2 584 1 1 5 THR HG1 H -17.133 -0.167 5.843 1.00 . A A . 11 THR HG1 1 1 2 585 1 1 5 THR HG21 H -16.160 2.879 3.409 1.00 . A A . 11 THR HG21 1 1 2 586 1 1 5 THR HG22 H -17.140 3.123 4.854 1.00 . A A . 11 THR HG22 1 1 2 587 1 1 5 THR HG23 H -15.452 2.635 5.005 1.00 . A A . 11 THR HG23 1 1 2 588 1 1 5 THR N N -18.738 -0.225 3.718 1.00 . A A . 11 THR N 1 1 2 589 1 1 5 THR O O -16.670 -0.905 1.932 1.00 . A A . 11 THR O 1 1 2 590 1 1 5 THR OG1 O -17.310 0.755 5.645 1.00 . A A . 11 THR OG1 1 1 2 591 1 1 6 PHE C C -15.125 1.917 -0.568 1.00 . A A . 12 PHE C 1 1 2 592 1 1 6 PHE CA C -16.108 0.823 -0.159 1.00 . A A . 12 PHE CA 1 1 2 593 1 1 6 PHE CB C -17.114 0.578 -1.285 1.00 . A A . 12 PHE CB 1 1 2 594 1 1 6 PHE CD1 C -17.418 2.713 -2.568 1.00 . A A . 12 PHE CD1 1 1 2 595 1 1 6 PHE CD2 C -19.157 2.022 -1.090 1.00 . A A . 12 PHE CD2 1 1 2 596 1 1 6 PHE CE1 C -18.150 3.834 -2.910 1.00 . A A . 12 PHE CE1 1 1 2 597 1 1 6 PHE CE2 C -19.894 3.141 -1.429 1.00 . A A . 12 PHE CE2 1 1 2 598 1 1 6 PHE CG C -17.912 1.796 -1.655 1.00 . A A . 12 PHE CG 1 1 2 599 1 1 6 PHE CZ C -19.390 4.048 -2.340 1.00 . A A . 12 PHE CZ 1 1 2 600 1 1 6 PHE H H -17.114 2.091 1.206 1.00 . A A . 12 PHE H 1 1 2 601 1 1 6 PHE HA H -15.556 -0.088 0.019 1.00 . A A . 12 PHE HA 1 1 2 602 1 1 6 PHE HB2 H -16.585 0.249 -2.166 1.00 . A A . 12 PHE HB2 1 1 2 603 1 1 6 PHE HB3 H -17.806 -0.193 -0.978 1.00 . A A . 12 PHE HB3 1 1 2 604 1 1 6 PHE HD1 H -19.552 1.313 -0.377 1.00 . A A . 12 PHE HD1 1 1 2 605 1 1 6 PHE HD2 H -16.449 2.547 -3.014 1.00 . A A . 12 PHE HD2 1 1 2 606 1 1 6 PHE HE1 H -20.863 3.306 -0.982 1.00 . A A . 12 PHE HE1 1 1 2 607 1 1 6 PHE HE2 H -17.753 4.542 -3.623 1.00 . A A . 12 PHE HE2 1 1 2 608 1 1 6 PHE HZ H -19.964 4.923 -2.606 1.00 . A A . 12 PHE HZ 1 1 2 609 1 1 6 PHE N N -16.803 1.171 1.075 1.00 . A A . 12 PHE N 1 1 2 610 1 1 6 PHE O O -14.007 1.629 -0.991 1.00 . A A . 12 PHE O 1 1 2 611 1 1 7 THR C C -13.283 4.140 -0.288 1.00 . A A . 13 THR C 1 1 2 612 1 1 7 THR CA C -14.711 4.314 -0.801 1.00 . A A . 13 THR CA 1 1 2 613 1 1 7 THR CB C -15.308 5.606 -0.242 1.00 . A A . 13 THR CB 1 1 2 614 1 1 7 THR CG2 C -15.628 5.527 1.235 1.00 . A A . 13 THR CG2 1 1 2 615 1 1 7 THR H H -16.455 3.337 -0.101 1.00 . A A . 13 THR H 1 1 2 616 1 1 7 THR HA H -14.686 4.379 -1.879 1.00 . A A . 13 THR HA 1 1 2 617 1 1 7 THR HB H -16.227 5.823 -0.768 1.00 . A A . 13 THR HB 1 1 2 618 1 1 7 THR HG1 H -14.812 7.494 -0.077 1.00 . A A . 13 THR HG1 1 1 2 619 1 1 7 THR HG21 H -15.845 4.504 1.502 1.00 . A A . 13 THR HG21 1 1 2 620 1 1 7 THR HG22 H -14.780 5.876 1.806 1.00 . A A . 13 THR HG22 1 1 2 621 1 1 7 THR HG23 H -16.486 6.146 1.451 1.00 . A A . 13 THR HG23 1 1 2 622 1 1 7 THR N N -15.551 3.172 -0.442 1.00 . A A . 13 THR N 1 1 2 623 1 1 7 THR O O -12.320 4.491 -0.970 1.00 . A A . 13 THR O 1 1 2 624 1 1 7 THR OG1 O -14.420 6.693 -0.432 1.00 . A A . 13 THR OG1 1 1 2 625 1 1 8 SER C C -11.301 1.993 1.154 1.00 . A A . 14 SER C 1 1 2 626 1 1 8 SER CA C -11.844 3.372 1.518 1.00 . A A . 14 SER CA 1 1 2 627 1 1 8 SER CB C -11.928 3.514 3.039 1.00 . A A . 14 SER CB 1 1 2 628 1 1 8 SER H H -13.958 3.333 1.412 1.00 . A A . 14 SER H 1 1 2 629 1 1 8 SER HA H -11.172 4.123 1.133 1.00 . A A . 14 SER HA 1 1 2 630 1 1 8 SER HB2 H -11.214 2.848 3.501 1.00 . A A . 14 SER HB2 1 1 2 631 1 1 8 SER HB3 H -11.701 4.533 3.316 1.00 . A A . 14 SER HB3 1 1 2 632 1 1 8 SER HG H -13.298 3.436 4.437 1.00 . A A . 14 SER HG 1 1 2 633 1 1 8 SER N N -13.154 3.594 0.917 1.00 . A A . 14 SER N 1 1 2 634 1 1 8 SER O O -10.088 1.781 1.126 1.00 . A A . 14 SER O 1 1 2 635 1 1 8 SER OG O -13.224 3.191 3.512 1.00 . A A . 14 SER OG 1 1 2 636 1 1 9 ASP C C -11.324 -0.374 -0.924 1.00 . A A . 15 ASP C 1 1 2 637 1 1 9 ASP CA C -11.814 -0.302 0.520 1.00 . A A . 15 ASP CA 1 1 2 638 1 1 9 ASP CB C -12.989 -1.261 0.719 1.00 . A A . 15 ASP CB 1 1 2 639 1 1 9 ASP CG C -12.550 -2.610 1.252 1.00 . A A . 15 ASP CG 1 1 2 640 1 1 9 ASP H H -13.157 1.285 0.921 1.00 . A A . 15 ASP H 1 1 2 641 1 1 9 ASP HA H -11.008 -0.597 1.175 1.00 . A A . 15 ASP HA 1 1 2 642 1 1 9 ASP HB2 H -13.685 -0.827 1.422 1.00 . A A . 15 ASP HB2 1 1 2 643 1 1 9 ASP HB3 H -13.487 -1.412 -0.227 1.00 . A A . 15 ASP HB3 1 1 2 644 1 1 9 ASP N N -12.205 1.057 0.879 1.00 . A A . 15 ASP N 1 1 2 645 1 1 9 ASP O O -10.538 -1.252 -1.277 1.00 . A A . 15 ASP O 1 1 2 646 1 1 9 ASP OD1 O -11.744 -2.639 2.205 1.00 . A A . 15 ASP OD1 1 1 2 647 1 1 9 ASP OD2 O -13.014 -3.639 0.717 1.00 . A A . 15 ASP OD2 1 1 2 648 1 1 10 VAL C C -9.882 0.601 -3.311 1.00 . A A . 16 VAL C 1 1 2 649 1 1 10 VAL CA C -11.401 0.588 -3.161 1.00 . A A . 16 VAL CA 1 1 2 650 1 1 10 VAL CB C -11.989 1.818 -3.880 1.00 . A A . 16 VAL CB 1 1 2 651 1 1 10 VAL CG1 C -11.671 1.776 -5.368 1.00 . A A . 16 VAL CG1 1 1 2 652 1 1 10 VAL CG2 C -13.492 1.902 -3.652 1.00 . A A . 16 VAL CG2 1 1 2 653 1 1 10 VAL H H -12.419 1.227 -1.418 1.00 . A A . 16 VAL H 1 1 2 654 1 1 10 VAL HA H -11.791 -0.300 -3.637 1.00 . A A . 16 VAL HA 1 1 2 655 1 1 10 VAL HB H -11.534 2.705 -3.463 1.00 . A A . 16 VAL HB 1 1 2 656 1 1 10 VAL HG11 H -10.773 1.197 -5.529 1.00 . A A . 16 VAL HG11 1 1 2 657 1 1 10 VAL HG12 H -12.493 1.319 -5.899 1.00 . A A . 16 VAL HG12 1 1 2 658 1 1 10 VAL HG13 H -11.521 2.781 -5.733 1.00 . A A . 16 VAL HG13 1 1 2 659 1 1 10 VAL HG21 H -13.851 0.959 -3.267 1.00 . A A . 16 VAL HG21 1 1 2 660 1 1 10 VAL HG22 H -13.704 2.685 -2.940 1.00 . A A . 16 VAL HG22 1 1 2 661 1 1 10 VAL HG23 H -13.987 2.121 -4.587 1.00 . A A . 16 VAL HG23 1 1 2 662 1 1 10 VAL N N -11.793 0.553 -1.756 1.00 . A A . 16 VAL N 1 1 2 663 1 1 10 VAL O O -9.286 -0.368 -3.781 1.00 . A A . 16 VAL O 1 1 2 664 1 1 11 SER C C -7.095 0.603 -2.449 1.00 . A A . 17 SER C 1 1 2 665 1 1 11 SER CA C -7.806 1.840 -2.996 1.00 . A A . 17 SER CA 1 1 2 666 1 1 11 SER CB C -7.345 3.084 -2.234 1.00 . A A . 17 SER CB 1 1 2 667 1 1 11 SER H H -9.785 2.442 -2.538 1.00 . A A . 17 SER H 1 1 2 668 1 1 11 SER HA H -7.550 1.955 -4.039 1.00 . A A . 17 SER HA 1 1 2 669 1 1 11 SER HB2 H -8.035 3.286 -1.428 1.00 . A A . 17 SER HB2 1 1 2 670 1 1 11 SER HB3 H -6.359 2.910 -1.829 1.00 . A A . 17 SER HB3 1 1 2 671 1 1 11 SER HG H -7.973 4.843 -2.825 1.00 . A A . 17 SER HG 1 1 2 672 1 1 11 SER N N -9.258 1.703 -2.906 1.00 . A A . 17 SER N 1 1 2 673 1 1 11 SER O O -5.973 0.293 -2.849 1.00 . A A . 17 SER O 1 1 2 674 1 1 11 SER OG O -7.295 4.215 -3.086 1.00 . A A . 17 SER OG 1 1 2 675 1 1 12 SER C C -7.000 -2.407 -1.957 1.00 . A A . 18 SER C 1 1 2 676 1 1 12 SER CA C -7.185 -1.295 -0.926 1.00 . A A . 18 SER CA 1 1 2 677 1 1 12 SER CB C -8.077 -1.788 0.215 1.00 . A A . 18 SER CB 1 1 2 678 1 1 12 SER H H -8.643 0.202 -1.248 1.00 . A A . 18 SER H 1 1 2 679 1 1 12 SER HA H -6.218 -1.033 -0.524 1.00 . A A . 18 SER HA 1 1 2 680 1 1 12 SER HB2 H -8.903 -2.349 -0.194 1.00 . A A . 18 SER HB2 1 1 2 681 1 1 12 SER HB3 H -7.500 -2.422 0.871 1.00 . A A . 18 SER HB3 1 1 2 682 1 1 12 SER HG H -8.048 -0.565 1.745 1.00 . A A . 18 SER HG 1 1 2 683 1 1 12 SER N N -7.754 -0.097 -1.530 1.00 . A A . 18 SER N 1 1 2 684 1 1 12 SER O O -5.933 -3.015 -2.039 1.00 . A A . 18 SER O 1 1 2 685 1 1 12 SER OG O -8.592 -0.701 0.965 1.00 . A A . 18 SER OG 1 1 2 686 1 1 13 TYR C C -6.894 -3.435 -4.779 1.00 . A A . 19 TYR C 1 1 2 687 1 1 13 TYR CA C -7.984 -3.728 -3.750 1.00 . A A . 19 TYR CA 1 1 2 688 1 1 13 TYR CB C -9.352 -3.904 -4.432 1.00 . A A . 19 TYR CB 1 1 2 689 1 1 13 TYR CD1 C -8.932 -3.346 -6.866 1.00 . A A . 19 TYR CD1 1 1 2 690 1 1 13 TYR CD2 C -10.415 -1.947 -5.631 1.00 . A A . 19 TYR CD2 1 1 2 691 1 1 13 TYR CE1 C -9.132 -2.571 -7.992 1.00 . A A . 19 TYR CE1 1 1 2 692 1 1 13 TYR CE2 C -10.621 -1.168 -6.754 1.00 . A A . 19 TYR CE2 1 1 2 693 1 1 13 TYR CG C -9.568 -3.047 -5.666 1.00 . A A . 19 TYR CG 1 1 2 694 1 1 13 TYR CZ C -9.977 -1.484 -7.931 1.00 . A A . 19 TYR CZ 1 1 2 695 1 1 13 TYR H H -8.874 -2.167 -2.624 1.00 . A A . 19 TYR H 1 1 2 696 1 1 13 TYR HA H -7.731 -4.647 -3.244 1.00 . A A . 19 TYR HA 1 1 2 697 1 1 13 TYR HB2 H -9.463 -4.935 -4.730 1.00 . A A . 19 TYR HB2 1 1 2 698 1 1 13 TYR HB3 H -10.129 -3.659 -3.722 1.00 . A A . 19 TYR HB3 1 1 2 699 1 1 13 TYR HD1 H -10.916 -1.701 -4.707 1.00 . A A . 19 TYR HD1 1 1 2 700 1 1 13 TYR HD2 H -8.271 -4.199 -6.911 1.00 . A A . 19 TYR HD2 1 1 2 701 1 1 13 TYR HE1 H -11.284 -0.317 -6.706 1.00 . A A . 19 TYR HE1 1 1 2 702 1 1 13 TYR HE2 H -8.627 -2.819 -8.914 1.00 . A A . 19 TYR HE2 1 1 2 703 1 1 13 TYR HH H -11.104 -0.751 -9.306 1.00 . A A . 19 TYR HH 1 1 2 704 1 1 13 TYR N N -8.045 -2.677 -2.737 1.00 . A A . 19 TYR N 1 1 2 705 1 1 13 TYR O O -6.317 -4.352 -5.363 1.00 . A A . 19 TYR O 1 1 2 706 1 1 13 TYR OH O -10.180 -0.710 -9.051 1.00 . A A . 19 TYR OH 1 1 2 707 1 1 14 LEU C C -4.200 -2.053 -5.428 1.00 . A A . 20 LEU C 1 1 2 708 1 1 14 LEU CA C -5.598 -1.747 -5.957 1.00 . A A . 20 LEU CA 1 1 2 709 1 1 14 LEU CB C -5.726 -0.255 -6.268 1.00 . A A . 20 LEU CB 1 1 2 710 1 1 14 LEU CD1 C -8.070 0.606 -6.511 1.00 . A A . 20 LEU CD1 1 1 2 711 1 1 14 LEU CD2 C -6.357 1.149 -8.250 1.00 . A A . 20 LEU CD2 1 1 2 712 1 1 14 LEU CG C -6.841 0.105 -7.254 1.00 . A A . 20 LEU CG 1 1 2 713 1 1 14 LEU H H -7.111 -1.466 -4.503 1.00 . A A . 20 LEU H 1 1 2 714 1 1 14 LEU HA H -5.756 -2.309 -6.865 1.00 . A A . 20 LEU HA 1 1 2 715 1 1 14 LEU HB2 H -5.908 0.271 -5.341 1.00 . A A . 20 LEU HB2 1 1 2 716 1 1 14 LEU HB3 H -4.788 0.088 -6.678 1.00 . A A . 20 LEU HB3 1 1 2 717 1 1 14 LEU HD11 H -7.819 1.500 -5.960 1.00 . A A . 20 LEU HD11 1 1 2 718 1 1 14 LEU HD12 H -8.853 0.828 -7.221 1.00 . A A . 20 LEU HD12 1 1 2 719 1 1 14 LEU HD13 H -8.411 -0.156 -5.826 1.00 . A A . 20 LEU HD13 1 1 2 720 1 1 14 LEU HD21 H -5.431 0.818 -8.697 1.00 . A A . 20 LEU HD21 1 1 2 721 1 1 14 LEU HD22 H -7.101 1.282 -9.021 1.00 . A A . 20 LEU HD22 1 1 2 722 1 1 14 LEU HD23 H -6.195 2.087 -7.740 1.00 . A A . 20 LEU HD23 1 1 2 723 1 1 14 LEU HG H -7.123 -0.780 -7.805 1.00 . A A . 20 LEU HG 1 1 2 724 1 1 14 LEU N N -6.618 -2.153 -4.997 1.00 . A A . 20 LEU N 1 1 2 725 1 1 14 LEU O O -3.566 -3.021 -5.847 1.00 . A A . 20 LEU O 1 1 2 726 1 1 15 GLU C C -2.377 -0.932 -2.470 1.00 . A A . 21 GLU C 1 1 2 727 1 1 15 GLU CA C -2.402 -1.406 -3.920 1.00 . A A . 21 GLU CA 1 1 2 728 1 1 15 GLU CB C -1.350 -0.651 -4.735 1.00 . A A . 21 GLU CB 1 1 2 729 1 1 15 GLU CD C -2.062 -0.365 -7.142 1.00 . A A . 21 GLU CD 1 1 2 730 1 1 15 GLU CG C -1.212 -1.152 -6.164 1.00 . A A . 21 GLU CG 1 1 2 731 1 1 15 GLU H H -4.277 -0.468 -4.211 1.00 . A A . 21 GLU H 1 1 2 732 1 1 15 GLU HA H -2.173 -2.461 -3.945 1.00 . A A . 21 GLU HA 1 1 2 733 1 1 15 GLU HB2 H -1.619 0.394 -4.768 1.00 . A A . 21 GLU HB2 1 1 2 734 1 1 15 GLU HB3 H -0.392 -0.752 -4.247 1.00 . A A . 21 GLU HB3 1 1 2 735 1 1 15 GLU HG2 H -0.178 -1.070 -6.462 1.00 . A A . 21 GLU HG2 1 1 2 736 1 1 15 GLU HG3 H -1.514 -2.189 -6.198 1.00 . A A . 21 GLU HG3 1 1 2 737 1 1 15 GLU N N -3.725 -1.222 -4.505 1.00 . A A . 21 GLU N 1 1 2 738 1 1 15 GLU O O -2.342 -1.741 -1.543 1.00 . A A . 21 GLU O 1 1 2 739 1 1 15 GLU OE1 O -2.138 0.873 -7.000 1.00 . A A . 21 GLU OE1 1 1 2 740 1 1 15 GLU OE2 O -2.651 -0.988 -8.050 1.00 . A A . 21 GLU OE2 1 1 2 741 1 1 16 GLY C C -1.077 0.667 -0.215 1.00 . A A . 22 GLY C 1 1 2 742 1 1 16 GLY CA C -2.378 0.941 -0.943 1.00 . A A . 22 GLY CA 1 1 2 743 1 1 16 GLY H H -2.426 0.980 -3.059 1.00 . A A . 22 GLY H 1 1 2 744 1 1 16 GLY HA2 H -2.522 2.010 -1.008 1.00 . A A . 22 GLY HA2 1 1 2 745 1 1 16 GLY HA3 H -3.192 0.514 -0.376 1.00 . A A . 22 GLY HA3 1 1 2 746 1 1 16 GLY N N -2.397 0.383 -2.282 1.00 . A A . 22 GLY N 1 1 2 747 1 1 16 GLY O O 0.004 0.940 -0.737 1.00 . A A . 22 GLY O 1 1 2 748 1 1 17 GLN C C 0.862 -1.248 1.126 1.00 . A A . 23 GLN C 1 1 2 749 1 1 17 GLN CA C -0.005 -0.185 1.799 1.00 . A A . 23 GLN CA 1 1 2 750 1 1 17 GLN CB C -0.426 -0.660 3.191 1.00 . A A . 23 GLN CB 1 1 2 751 1 1 17 GLN CD C 0.262 -0.880 5.611 1.00 . A A . 23 GLN CD 1 1 2 752 1 1 17 GLN CG C 0.460 -0.133 4.307 1.00 . A A . 23 GLN CG 1 1 2 753 1 1 17 GLN H H -2.071 -0.068 1.355 1.00 . A A . 23 GLN H 1 1 2 754 1 1 17 GLN HA H 0.574 0.720 1.900 1.00 . A A . 23 GLN HA 1 1 2 755 1 1 17 GLN HB2 H -1.438 -0.333 3.379 1.00 . A A . 23 GLN HB2 1 1 2 756 1 1 17 GLN HB3 H -0.396 -1.740 3.216 1.00 . A A . 23 GLN HB3 1 1 2 757 1 1 17 GLN HE21 H 1.203 -2.468 4.873 1.00 . A A . 23 GLN HE21 1 1 2 758 1 1 17 GLN HE22 H 0.636 -2.620 6.498 1.00 . A A . 23 GLN HE22 1 1 2 759 1 1 17 GLN HG2 H 1.493 -0.232 4.007 1.00 . A A . 23 GLN HG2 1 1 2 760 1 1 17 GLN HG3 H 0.232 0.911 4.468 1.00 . A A . 23 GLN HG3 1 1 2 761 1 1 17 GLN N N -1.181 0.126 0.994 1.00 . A A . 23 GLN N 1 1 2 762 1 1 17 GLN NE2 N 0.750 -2.114 5.666 1.00 . A A . 23 GLN NE2 1 1 2 763 1 1 17 GLN O O 2.044 -1.384 1.440 1.00 . A A . 23 GLN O 1 1 2 764 1 1 17 GLN OE1 O -0.321 -0.354 6.559 1.00 . A A . 23 GLN OE1 1 1 2 765 1 1 18 ALA C C 2.311 -2.531 -1.076 1.00 . A A . 24 ALA C 1 1 2 766 1 1 18 ALA CA C 0.992 -3.051 -0.510 1.00 . A A . 24 ALA CA 1 1 2 767 1 1 18 ALA CB C 0.128 -3.623 -1.624 1.00 . A A . 24 ALA CB 1 1 2 768 1 1 18 ALA H H -0.676 -1.849 -0.006 1.00 . A A . 24 ALA H 1 1 2 769 1 1 18 ALA HA H 1.203 -3.844 0.192 1.00 . A A . 24 ALA HA 1 1 2 770 1 1 18 ALA HB1 H -0.873 -3.789 -1.253 1.00 . A A . 24 ALA HB1 1 1 2 771 1 1 18 ALA HB2 H 0.095 -2.926 -2.448 1.00 . A A . 24 ALA HB2 1 1 2 772 1 1 18 ALA HB3 H 0.548 -4.559 -1.961 1.00 . A A . 24 ALA HB3 1 1 2 773 1 1 18 ALA N N 0.269 -2.001 0.202 1.00 . A A . 24 ALA N 1 1 2 774 1 1 18 ALA O O 3.371 -3.109 -0.839 1.00 . A A . 24 ALA O 1 1 2 775 1 1 19 ALA C C 4.321 -0.217 -1.355 1.00 . A A . 25 ALA C 1 1 2 776 1 1 19 ALA CA C 3.424 -0.835 -2.421 1.00 . A A . 25 ALA CA 1 1 2 777 1 1 19 ALA CB C 3.023 0.213 -3.449 1.00 . A A . 25 ALA CB 1 1 2 778 1 1 19 ALA H H 1.363 -1.018 -1.975 1.00 . A A . 25 ALA H 1 1 2 779 1 1 19 ALA HA H 3.972 -1.613 -2.931 1.00 . A A . 25 ALA HA 1 1 2 780 1 1 19 ALA HB1 H 2.354 -0.229 -4.172 1.00 . A A . 25 ALA HB1 1 1 2 781 1 1 19 ALA HB2 H 2.526 1.033 -2.952 1.00 . A A . 25 ALA HB2 1 1 2 782 1 1 19 ALA HB3 H 3.906 0.579 -3.952 1.00 . A A . 25 ALA HB3 1 1 2 783 1 1 19 ALA N N 2.237 -1.434 -1.823 1.00 . A A . 25 ALA N 1 1 2 784 1 1 19 ALA O O 5.545 -0.296 -1.439 1.00 . A A . 25 ALA O 1 1 2 785 1 1 20 LYS C C 5.564 0.139 1.259 1.00 . A A . 26 LYS C 1 1 2 786 1 1 20 LYS CA C 4.439 1.035 0.740 1.00 . A A . 26 LYS CA 1 1 2 787 1 1 20 LYS CB C 3.485 1.390 1.883 1.00 . A A . 26 LYS CB 1 1 2 788 1 1 20 LYS CD C 2.408 3.208 0.514 1.00 . A A . 26 LYS CD 1 1 2 789 1 1 20 LYS CE C 3.361 4.053 -0.317 1.00 . A A . 26 LYS CE 1 1 2 790 1 1 20 LYS CG C 3.017 2.837 1.859 1.00 . A A . 26 LYS CG 1 1 2 791 1 1 20 LYS HA H 4.873 1.945 0.354 1.00 . A A . 26 LYS HA 1 1 2 792 1 1 20 LYS HB2 H 2.615 0.753 1.821 1.00 . A A . 26 LYS HB2 1 1 2 793 1 1 20 LYS HD2 H 2.180 2.303 -0.029 1.00 . A A . 26 LYS HD2 1 1 2 794 1 1 20 LYS HE2 H 2.952 5.048 -0.409 1.00 . A A . 26 LYS HE2 1 1 2 795 1 1 20 LYS HG2 H 2.273 2.977 2.629 1.00 . A A . 26 LYS HG2 1 1 2 796 1 1 20 LYS HZ1 H 3.704 2.533 -1.729 1.00 . A A . 26 LYS HZ1 1 1 2 797 1 1 20 LYS N N 3.702 0.397 -0.351 1.00 . A A . 26 LYS N 1 1 2 798 1 1 20 LYS NZ N 3.560 3.500 -1.654 1.00 . A A . 26 LYS NZ 1 1 2 799 1 1 20 LYS O O 6.558 0.628 1.794 1.00 . A A . 26 LYS O 1 1 2 800 1 1 21 GLU C C 7.814 -1.712 1.149 1.00 . A A . 27 GLU C 1 1 2 801 1 1 21 GLU CA C 6.402 -2.133 1.558 1.00 . A A . 27 GLU CA 1 1 2 802 1 1 21 GLU CB C 6.094 -3.523 0.998 1.00 . A A . 27 GLU CB 1 1 2 803 1 1 21 GLU CD C 4.589 -5.545 1.154 1.00 . A A . 27 GLU CD 1 1 2 804 1 1 21 GLU CG C 5.155 -4.337 1.874 1.00 . A A . 27 GLU CG 1 1 2 805 1 1 21 GLU H H 4.585 -1.504 0.672 1.00 . A A . 27 GLU H 1 1 2 806 1 1 21 GLU HA H 6.352 -2.173 2.636 1.00 . A A . 27 GLU HA 1 1 2 807 1 1 21 GLU HB2 H 5.639 -3.413 0.025 1.00 . A A . 27 GLU HB2 1 1 2 808 1 1 21 GLU HB3 H 7.019 -4.070 0.894 1.00 . A A . 27 GLU HB3 1 1 2 809 1 1 21 GLU HG2 H 5.699 -4.677 2.743 1.00 . A A . 27 GLU HG2 1 1 2 810 1 1 21 GLU HG3 H 4.337 -3.705 2.186 1.00 . A A . 27 GLU HG3 1 1 2 811 1 1 21 GLU N N 5.401 -1.172 1.102 1.00 . A A . 27 GLU N 1 1 2 812 1 1 21 GLU O O 8.788 -2.037 1.829 1.00 . A A . 27 GLU O 1 1 2 813 1 1 21 GLU OE1 O 5.319 -6.548 1.013 1.00 . A A . 27 GLU OE1 1 1 2 814 1 1 21 GLU OE2 O 3.415 -5.488 0.732 1.00 . A A . 27 GLU OE2 1 1 2 815 1 1 22 PHE C C 9.854 0.450 0.529 1.00 . A A . 28 PHE C 1 1 2 816 1 1 22 PHE CA C 9.218 -0.532 -0.451 1.00 . A A . 28 PHE CA 1 1 2 817 1 1 22 PHE CB C 9.073 0.103 -1.843 1.00 . A A . 28 PHE CB 1 1 2 818 1 1 22 PHE CD1 C 9.462 2.550 -1.423 1.00 . A A . 28 PHE CD1 1 1 2 819 1 1 22 PHE CD2 C 7.334 1.870 -2.251 1.00 . A A . 28 PHE CD2 1 1 2 820 1 1 22 PHE CE1 C 9.045 3.867 -1.419 1.00 . A A . 28 PHE CE1 1 1 2 821 1 1 22 PHE CE2 C 6.910 3.185 -2.250 1.00 . A A . 28 PHE CE2 1 1 2 822 1 1 22 PHE CG C 8.613 1.537 -1.837 1.00 . A A . 28 PHE CG 1 1 2 823 1 1 22 PHE CZ C 7.767 4.185 -1.834 1.00 . A A . 28 PHE CZ 1 1 2 824 1 1 22 PHE H H 7.111 -0.760 -0.466 1.00 . A A . 28 PHE H 1 1 2 825 1 1 22 PHE HA H 9.859 -1.398 -0.531 1.00 . A A . 28 PHE HA 1 1 2 826 1 1 22 PHE HB2 H 10.027 0.069 -2.343 1.00 . A A . 28 PHE HB2 1 1 2 827 1 1 22 PHE HB3 H 8.356 -0.470 -2.412 1.00 . A A . 28 PHE HB3 1 1 2 828 1 1 22 PHE HD1 H 6.664 1.091 -2.578 1.00 . A A . 28 PHE HD1 1 1 2 829 1 1 22 PHE HD2 H 10.461 2.301 -1.100 1.00 . A A . 28 PHE HD2 1 1 2 830 1 1 22 PHE HE1 H 5.909 3.429 -2.576 1.00 . A A . 28 PHE HE1 1 1 2 831 1 1 22 PHE HE2 H 9.719 4.646 -1.093 1.00 . A A . 28 PHE HE2 1 1 2 832 1 1 22 PHE HZ H 7.438 5.214 -1.832 1.00 . A A . 28 PHE HZ 1 1 2 833 1 1 22 PHE N N 7.921 -0.989 0.037 1.00 . A A . 28 PHE N 1 1 2 834 1 1 22 PHE O O 11.068 0.445 0.734 1.00 . A A . 28 PHE O 1 1 2 835 1 1 23 ILE C C 10.254 1.628 3.246 1.00 . A A . 29 ILE C 1 1 2 836 1 1 23 ILE CA C 9.481 2.283 2.097 1.00 . A A . 29 ILE CA 1 1 2 837 1 1 23 ILE CB C 8.289 3.096 2.654 1.00 . A A . 29 ILE CB 1 1 2 838 1 1 23 ILE CD1 C 6.690 4.125 0.961 1.00 . A A . 29 ILE CD1 1 1 2 839 1 1 23 ILE CG1 C 7.981 4.282 1.735 1.00 . A A . 29 ILE CG1 1 1 2 840 1 1 23 ILE CG2 C 8.558 3.579 4.075 1.00 . A A . 29 ILE CG2 1 1 2 841 1 1 23 ILE H H 8.063 1.238 0.925 1.00 . A A . 29 ILE H 1 1 2 842 1 1 23 ILE HA H 10.142 2.964 1.579 1.00 . A A . 29 ILE HA 1 1 2 843 1 1 23 ILE HB H 7.429 2.445 2.680 1.00 . A A . 29 ILE HB 1 1 2 844 1 1 23 ILE HD11 H 5.866 4.028 1.652 1.00 . A A . 29 ILE HD11 1 1 2 845 1 1 23 ILE HD12 H 6.537 4.994 0.338 1.00 . A A . 29 ILE HD12 1 1 2 846 1 1 23 ILE HD13 H 6.747 3.243 0.342 1.00 . A A . 29 ILE HD13 1 1 2 847 1 1 23 ILE HG12 H 7.903 5.180 2.329 1.00 . A A . 29 ILE HG12 1 1 2 848 1 1 23 ILE HG13 H 8.785 4.396 1.022 1.00 . A A . 29 ILE HG13 1 1 2 849 1 1 23 ILE HG21 H 9.493 4.117 4.101 1.00 . A A . 29 ILE HG21 1 1 2 850 1 1 23 ILE HG22 H 7.757 4.231 4.392 1.00 . A A . 29 ILE HG22 1 1 2 851 1 1 23 ILE HG23 H 8.613 2.728 4.739 1.00 . A A . 29 ILE HG23 1 1 2 852 1 1 23 ILE N N 9.020 1.290 1.133 1.00 . A A . 29 ILE N 1 1 2 853 1 1 23 ILE O O 11.008 2.290 3.955 1.00 . A A . 29 ILE O 1 1 2 854 1 1 24 ALA C C 12.242 -0.493 4.230 1.00 . A A . 30 ALA C 1 1 2 855 1 1 24 ALA CA C 10.739 -0.394 4.496 1.00 . A A . 30 ALA CA 1 1 2 856 1 1 24 ALA CB C 10.138 -1.783 4.652 1.00 . A A . 30 ALA CB 1 1 2 857 1 1 24 ALA H H 9.439 -0.150 2.847 1.00 . A A . 30 ALA H 1 1 2 858 1 1 24 ALA HA H 10.582 0.145 5.419 1.00 . A A . 30 ALA HA 1 1 2 859 1 1 24 ALA HB1 H 9.088 -1.751 4.405 1.00 . A A . 30 ALA HB1 1 1 2 860 1 1 24 ALA HB2 H 10.643 -2.470 3.990 1.00 . A A . 30 ALA HB2 1 1 2 861 1 1 24 ALA HB3 H 10.258 -2.114 5.673 1.00 . A A . 30 ALA HB3 1 1 2 862 1 1 24 ALA N N 10.057 0.331 3.432 1.00 . A A . 30 ALA N 1 1 2 863 1 1 24 ALA O O 13.023 -0.760 5.143 1.00 . A A . 30 ALA O 1 1 2 864 1 1 25 TRP C C 14.787 0.942 2.758 1.00 . A A . 31 TRP C 1 1 2 865 1 1 25 TRP CA C 14.049 -0.393 2.594 1.00 . A A . 31 TRP CA 1 1 2 866 1 1 25 TRP CB C 14.169 -0.923 1.151 1.00 . A A . 31 TRP CB 1 1 2 867 1 1 25 TRP CD1 C 16.248 0.307 0.277 1.00 . A A . 31 TRP CD1 1 1 2 868 1 1 25 TRP CD2 C 14.399 0.647 -0.939 1.00 . A A . 31 TRP CD2 1 1 2 869 1 1 25 TRP CE2 C 15.456 1.375 -1.517 1.00 . A A . 31 TRP CE2 1 1 2 870 1 1 25 TRP CE3 C 13.136 0.707 -1.534 1.00 . A A . 31 TRP CE3 1 1 2 871 1 1 25 TRP CG C 14.925 -0.027 0.210 1.00 . A A . 31 TRP CG 1 1 2 872 1 1 25 TRP CH2 C 14.041 2.190 -3.223 1.00 . A A . 31 TRP CH2 1 1 2 873 1 1 25 TRP CZ2 C 15.288 2.151 -2.662 1.00 . A A . 31 TRP CZ2 1 1 2 874 1 1 25 TRP CZ3 C 12.970 1.477 -2.670 1.00 . A A . 31 TRP CZ3 1 1 2 875 1 1 25 TRP H H 11.973 -0.106 2.282 1.00 . A A . 31 TRP H 1 1 2 876 1 1 25 TRP HA H 14.508 -1.112 3.257 1.00 . A A . 31 TRP HA 1 1 2 877 1 1 25 TRP HB2 H 14.675 -1.876 1.171 1.00 . A A . 31 TRP HB2 1 1 2 878 1 1 25 TRP HB3 H 13.176 -1.063 0.749 1.00 . A A . 31 TRP HB3 1 1 2 879 1 1 25 TRP HD1 H 16.926 -0.045 1.040 1.00 . A A . 31 TRP HD1 1 1 2 880 1 1 25 TRP HE1 H 17.463 1.533 -0.921 1.00 . A A . 31 TRP HE1 1 1 2 881 1 1 25 TRP HE3 H 12.298 0.165 -1.122 1.00 . A A . 31 TRP HE3 1 1 2 882 1 1 25 TRP HH2 H 13.865 2.779 -4.111 1.00 . A A . 31 TRP HH2 1 1 2 883 1 1 25 TRP HZ2 H 16.103 2.706 -3.101 1.00 . A A . 31 TRP HZ2 1 1 2 884 1 1 25 TRP HZ3 H 12.001 1.534 -3.143 1.00 . A A . 31 TRP HZ3 1 1 2 885 1 1 25 TRP N N 12.640 -0.299 2.973 1.00 . A A . 31 TRP N 1 1 2 886 1 1 25 TRP NE1 N 16.574 1.153 -0.756 1.00 . A A . 31 TRP NE1 1 1 2 887 1 1 25 TRP O O 15.743 1.033 3.529 1.00 . A A . 31 TRP O 1 1 2 888 1 1 26 LEU C C 15.071 3.828 3.500 1.00 . A A . 32 LEU C 1 1 2 889 1 1 26 LEU CA C 15.031 3.269 2.077 1.00 . A A . 32 LEU CA 1 1 2 890 1 1 26 LEU CB C 14.390 4.286 1.112 1.00 . A A . 32 LEU CB 1 1 2 891 1 1 26 LEU CD1 C 12.290 3.364 0.091 1.00 . A A . 32 LEU CD1 1 1 2 892 1 1 26 LEU CD2 C 12.285 4.114 2.474 1.00 . A A . 32 LEU CD2 1 1 2 893 1 1 26 LEU CG C 12.859 4.356 1.092 1.00 . A A . 32 LEU CG 1 1 2 894 1 1 26 LEU H H 13.617 1.836 1.399 1.00 . A A . 32 LEU H 1 1 2 895 1 1 26 LEU HA H 16.051 3.109 1.761 1.00 . A A . 32 LEU HA 1 1 2 896 1 1 26 LEU HB2 H 14.761 5.266 1.367 1.00 . A A . 32 LEU HB2 1 1 2 897 1 1 26 LEU HB3 H 14.723 4.049 0.112 1.00 . A A . 32 LEU HB3 1 1 2 898 1 1 26 LEU HD11 H 13.081 3.002 -0.549 1.00 . A A . 32 LEU HD11 1 1 2 899 1 1 26 LEU HD12 H 11.845 2.533 0.619 1.00 . A A . 32 LEU HD12 1 1 2 900 1 1 26 LEU HD13 H 11.537 3.853 -0.510 1.00 . A A . 32 LEU HD13 1 1 2 901 1 1 26 LEU HD21 H 12.789 4.747 3.188 1.00 . A A . 32 LEU HD21 1 1 2 902 1 1 26 LEU HD22 H 11.230 4.341 2.472 1.00 . A A . 32 LEU HD22 1 1 2 903 1 1 26 LEU HD23 H 12.432 3.081 2.741 1.00 . A A . 32 LEU HD23 1 1 2 904 1 1 26 LEU HG H 12.561 5.346 0.778 1.00 . A A . 32 LEU HG 1 1 2 905 1 1 26 LEU N N 14.368 1.966 2.014 1.00 . A A . 32 LEU N 1 1 2 906 1 1 26 LEU O O 15.879 4.706 3.803 1.00 . A A . 32 LEU O 1 1 2 907 1 1 27 VAL C C 15.265 3.102 6.590 1.00 . A A . 33 VAL C 1 1 2 908 1 1 27 VAL CA C 14.180 3.789 5.759 1.00 . A A . 33 VAL CA 1 1 2 909 1 1 27 VAL CB C 12.798 3.550 6.412 1.00 . A A . 33 VAL CB 1 1 2 910 1 1 27 VAL CG1 C 12.866 3.728 7.924 1.00 . A A . 33 VAL CG1 1 1 2 911 1 1 27 VAL CG2 C 11.755 4.484 5.812 1.00 . A A . 33 VAL CG2 1 1 2 912 1 1 27 VAL H H 13.588 2.621 4.095 1.00 . A A . 33 VAL H 1 1 2 913 1 1 27 VAL HA H 14.372 4.852 5.750 1.00 . A A . 33 VAL HA 1 1 2 914 1 1 27 VAL HB H 12.497 2.533 6.206 1.00 . A A . 33 VAL HB 1 1 2 915 1 1 27 VAL HG11 H 13.287 4.696 8.154 1.00 . A A . 33 VAL HG11 1 1 2 916 1 1 27 VAL HG12 H 11.871 3.661 8.339 1.00 . A A . 33 VAL HG12 1 1 2 917 1 1 27 VAL HG13 H 13.487 2.955 8.350 1.00 . A A . 33 VAL HG13 1 1 2 918 1 1 27 VAL HG21 H 12.190 5.031 4.990 1.00 . A A . 33 VAL HG21 1 1 2 919 1 1 27 VAL HG22 H 10.917 3.905 5.456 1.00 . A A . 33 VAL HG22 1 1 2 920 1 1 27 VAL HG23 H 11.417 5.179 6.566 1.00 . A A . 33 VAL HG23 1 1 2 921 1 1 27 VAL N N 14.209 3.322 4.377 1.00 . A A . 33 VAL N 1 1 2 922 1 1 27 VAL O O 15.654 3.599 7.647 1.00 . A A . 33 VAL O 1 1 2 923 1 1 28 ARG C C 18.096 1.228 6.032 1.00 . A A . 34 ARG C 1 1 2 924 1 1 28 ARG CA C 16.786 1.215 6.814 1.00 . A A . 34 ARG CA 1 1 2 925 1 1 28 ARG CB C 16.335 -0.228 7.049 1.00 . A A . 34 ARG CB 1 1 2 926 1 1 28 ARG CD C 15.084 -1.856 8.498 1.00 . A A . 34 ARG CD 1 1 2 927 1 1 28 ARG CG C 15.441 -0.396 8.267 1.00 . A A . 34 ARG CG 1 1 2 928 1 1 28 ARG CZ C 16.269 -4.014 8.597 1.00 . A A . 34 ARG CZ 1 1 2 929 1 1 28 ARG H H 15.402 1.611 5.263 1.00 . A A . 34 ARG H 1 1 2 930 1 1 28 ARG HA H 16.946 1.692 7.769 1.00 . A A . 34 ARG HA 1 1 2 931 1 1 28 ARG HB2 H 15.791 -0.569 6.181 1.00 . A A . 34 ARG HB2 1 1 2 932 1 1 28 ARG HB3 H 17.209 -0.849 7.182 1.00 . A A . 34 ARG HB3 1 1 2 933 1 1 28 ARG HD2 H 14.460 -1.926 9.377 1.00 . A A . 34 ARG HD2 1 1 2 934 1 1 28 ARG HD3 H 14.537 -2.219 7.640 1.00 . A A . 34 ARG HD3 1 1 2 935 1 1 28 ARG HE H 17.112 -2.231 8.901 1.00 . A A . 34 ARG HE 1 1 2 936 1 1 28 ARG HG2 H 15.960 -0.022 9.137 1.00 . A A . 34 ARG HG2 1 1 2 937 1 1 28 ARG HG3 H 14.533 0.169 8.116 1.00 . A A . 34 ARG HG3 1 1 2 938 1 1 28 ARG HH11 H 14.298 -4.160 8.169 1.00 . A A . 34 ARG HH11 1 1 2 939 1 1 28 ARG HH12 H 15.154 -5.663 8.244 1.00 . A A . 34 ARG HH12 1 1 2 940 1 1 28 ARG HH21 H 18.240 -4.207 9.000 1.00 . A A . 34 ARG HH21 1 1 2 941 1 1 28 ARG HH22 H 17.392 -5.690 8.717 1.00 . A A . 34 ARG HH22 1 1 2 942 1 1 28 ARG N N 15.749 1.960 6.109 1.00 . A A . 34 ARG N 1 1 2 943 1 1 28 ARG NE N 16.270 -2.686 8.691 1.00 . A A . 34 ARG NE 1 1 2 944 1 1 28 ARG NH1 N 15.148 -4.666 8.313 1.00 . A A . 34 ARG NH1 1 1 2 945 1 1 28 ARG NH2 N 17.392 -4.693 8.787 1.00 . A A . 34 ARG NH2 1 1 2 946 1 1 28 ARG O O 18.447 0.248 5.374 1.00 . A A . 34 ARG O 1 1 2 947 1 1 29 GLY C C 20.170 3.700 4.548 1.00 . A A . 35 GLY C 1 1 2 948 1 1 29 GLY CA C 20.084 2.453 5.408 1.00 . A A . 35 GLY CA 1 1 2 949 1 1 29 GLY H H 18.493 3.090 6.653 1.00 . A A . 35 GLY H 1 1 2 950 1 1 29 GLY HA2 H 20.884 2.476 6.133 1.00 . A A . 35 GLY HA2 1 1 2 951 1 1 29 GLY HA3 H 20.211 1.586 4.777 1.00 . A A . 35 GLY HA3 1 1 2 952 1 1 29 GLY N N 18.819 2.341 6.111 1.00 . A A . 35 GLY N 1 1 2 953 1 1 29 GLY O O 21.234 4.307 4.430 1.00 . A A . 35 GLY O 1 1 2 954 1 1 30 ARG C C 18.408 6.453 3.834 1.00 . A A . 36 ARG C 1 1 2 955 1 1 30 ARG CA C 19.007 5.264 3.091 1.00 . A A . 36 ARG CA 1 1 2 956 1 1 30 ARG CB C 18.197 4.979 1.825 1.00 . A A . 36 ARG CB 1 1 2 957 1 1 30 ARG CD C 18.806 2.557 1.524 1.00 . A A . 36 ARG CD 1 1 2 958 1 1 30 ARG CG C 18.838 3.948 0.910 1.00 . A A . 36 ARG CG 1 1 2 959 1 1 30 ARG CZ C 20.401 0.887 2.388 1.00 . A A . 36 ARG CZ 1 1 2 960 1 1 30 ARG H H 18.232 3.558 4.077 1.00 . A A . 36 ARG H 1 1 2 961 1 1 30 ARG HA H 20.022 5.504 2.810 1.00 . A A . 36 ARG HA 1 1 2 962 1 1 30 ARG HB2 H 17.222 4.618 2.110 1.00 . A A . 36 ARG HB2 1 1 2 963 1 1 30 ARG HB3 H 18.083 5.898 1.270 1.00 . A A . 36 ARG HB3 1 1 2 964 1 1 30 ARG HD2 H 18.156 2.571 2.386 1.00 . A A . 36 ARG HD2 1 1 2 965 1 1 30 ARG HD3 H 18.418 1.864 0.793 1.00 . A A . 36 ARG HD3 1 1 2 966 1 1 30 ARG HE H 20.868 2.760 1.880 1.00 . A A . 36 ARG HE 1 1 2 967 1 1 30 ARG HG2 H 18.301 3.928 -0.027 1.00 . A A . 36 ARG HG2 1 1 2 968 1 1 30 ARG HG3 H 19.866 4.229 0.732 1.00 . A A . 36 ARG HG3 1 1 2 969 1 1 30 ARG HH11 H 18.499 0.221 2.222 1.00 . A A . 36 ARG HH11 1 1 2 970 1 1 30 ARG HH12 H 19.641 -0.935 2.822 1.00 . A A . 36 ARG HH12 1 1 2 971 1 1 30 ARG HH21 H 22.371 1.242 2.669 1.00 . A A . 36 ARG HH21 1 1 2 972 1 1 30 ARG HH22 H 21.839 -0.355 3.076 1.00 . A A . 36 ARG HH22 1 1 2 973 1 1 30 ARG N N 19.049 4.082 3.945 1.00 . A A . 36 ARG N 1 1 2 974 1 1 30 ARG NE N 20.135 2.112 1.940 1.00 . A A . 36 ARG NE 1 1 2 975 1 1 30 ARG NH1 N 19.434 -0.016 2.485 1.00 . A A . 36 ARG NH1 1 1 2 976 1 1 30 ARG NH2 N 21.639 0.565 2.740 1.00 . A A . 36 ARG NH2 1 1 2 977 1 1 30 ARG O O 18.072 6.355 5.014 1.00 . A A . 36 ARG O 1 1 2 978 1 1 31 GLY C C 18.674 9.944 3.702 1.00 . A A . 37 GLY C 1 1 2 979 1 1 31 GLY CA C 17.718 8.769 3.743 1.00 . A A . 37 GLY CA 1 1 2 980 1 1 31 GLY H H 18.562 7.595 2.197 1.00 . A A . 37 GLY H 1 1 2 981 1 1 31 GLY HA2 H 16.813 9.037 3.218 1.00 . A A . 37 GLY HA2 1 1 2 982 1 1 31 GLY HA3 H 17.473 8.554 4.773 1.00 . A A . 37 GLY HA3 1 1 2 983 1 1 31 GLY N N 18.277 7.576 3.134 1.00 . A A . 37 GLY N 1 1 2 984 1 1 31 GLY O O 19.455 10.040 2.732 1.00 . A A . 37 GLY O 1 1 2 985 1 1 31 GLY OXT O 18.642 10.769 4.639 1.00 . A A . 37 GLY OXT 1 1 2 986 2 2 1 . C02 C 7.914 2.356 -5.820 1.00 . B A . 1038 D6M C02 1 1 2 987 2 2 1 . C04 C 5.680 3.327 -5.795 1.00 . B A . 1038 D6M C04 1 1 2 988 2 2 1 . C05 C 4.874 4.288 -4.917 1.00 . B A . 1038 D6M C05 1 1 2 989 2 2 1 . C06 C 3.768 3.607 -4.127 1.00 . B A . 1038 D6M C06 1 1 2 990 2 2 1 . C07 C 3.555 4.233 -2.763 1.00 . B A . 1038 D6M C07 1 1 2 991 2 2 1 . C09 C 5.641 3.788 -7.249 1.00 . B A . 1038 D6M C09 1 1 2 992 2 2 1 . C12 C 9.340 2.262 -5.314 1.00 . B A . 1038 D6M C12 1 1 2 993 2 2 1 . C13 C 10.036 3.613 -5.272 1.00 . B A . 1038 D6M C13 1 1 2 994 2 2 1 . C14 C 11.283 3.570 -4.404 1.00 . B A . 1038 D6M C14 1 1 2 995 2 2 1 . C15 C 11.912 4.947 -4.264 1.00 . B A . 1038 D6M C15 1 1 2 996 2 2 1 . C16 C 10.962 5.927 -3.594 1.00 . B A . 1038 D6M C16 1 1 2 997 2 2 1 . C17 C 11.689 6.819 -2.601 1.00 . B A . 1038 D6M C17 1 1 2 998 2 2 1 . C18 C 10.746 7.342 -1.528 1.00 . B A . 1038 D6M C18 1 1 2 999 2 2 1 . C19 C 11.464 7.541 -0.202 1.00 . B A . 1038 D6M C19 1 1 2 1000 2 2 1 . C20 C 10.662 6.972 0.957 1.00 . B A . 1038 D6M C20 1 1 2 1001 2 2 1 . C21 C 11.260 7.371 2.297 1.00 . B A . 1038 D6M C21 1 1 2 1002 2 2 1 . C22 C 10.341 6.999 3.451 1.00 . B A . 1038 D6M C22 1 1 2 1003 2 2 1 . C23 C 10.227 8.130 4.462 1.00 . B A . 1038 D6M C23 1 1 2 1004 2 2 1 . C24 C 11.016 7.830 5.727 1.00 . B A . 1038 D6M C24 1 1 2 1005 2 2 1 . C25 C 11.657 9.086 6.296 1.00 . B A . 1038 D6M C25 1 1 2 1006 2 2 1 . C26 C 10.622 10.138 6.636 1.00 . B A . 1038 D6M C26 1 1 2 1007 2 2 1 . H03 H 7.361 3.860 -4.623 1.00 . B A . 1038 D6M H03 1 1 2 1008 2 2 1 . H04 H 5.243 2.342 -5.731 1.00 . B A . 1038 D6M H04 1 1 2 1009 2 2 1 . HP21 H 9.895 1.605 -5.966 1.00 . B A . 1038 D6M HP21 1 1 2 1010 2 2 1 . HP22 H 9.325 1.849 -4.316 1.00 . B A . 1038 D6M HP22 1 1 2 1011 2 2 1 . HP31 H 9.353 4.347 -4.871 1.00 . B A . 1038 D6M HP31 1 1 2 1012 2 2 1 . HP32 H 10.319 3.893 -6.276 1.00 . B A . 1038 D6M HP32 1 1 2 1013 2 2 1 . HP41 H 12.001 2.900 -4.853 1.00 . B A . 1038 D6M HP41 1 1 2 1014 2 2 1 . HP42 H 11.014 3.208 -3.423 1.00 . B A . 1038 D6M HP42 1 1 2 1015 2 2 1 . HP51 H 12.164 5.318 -5.246 1.00 . B A . 1038 D6M HP51 1 1 2 1016 2 2 1 . HP52 H 12.808 4.864 -3.667 1.00 . B A . 1038 D6M HP52 1 1 2 1017 2 2 1 . HP61 H 10.196 5.372 -3.072 1.00 . B A . 1038 D6M HP61 1 1 2 1018 2 2 1 . HP62 H 10.506 6.547 -4.351 1.00 . B A . 1038 D6M HP62 1 1 2 1019 2 2 1 . HP71 H 12.118 7.657 -3.131 1.00 . B A . 1038 D6M HP71 1 1 2 1020 2 2 1 . HP72 H 12.475 6.249 -2.128 1.00 . B A . 1038 D6M HP72 1 1 2 1021 2 2 1 . HP81 H 9.945 6.631 -1.391 1.00 . B A . 1038 D6M HP81 1 1 2 1022 2 2 1 . HP82 H 10.339 8.288 -1.851 1.00 . B A . 1038 D6M HP82 1 1 2 1023 2 2 1 . HP91 H 11.613 8.599 -0.041 1.00 . B A . 1038 D6M HP91 1 1 2 1024 2 2 1 . HP92 H 12.422 7.044 -0.243 1.00 . B A . 1038 D6M HP92 1 1 2 1025 2 2 1 . HPA1 H 10.655 5.894 0.882 1.00 . B A . 1038 D6M HPA1 1 1 2 1026 2 2 1 . HPA2 H 9.651 7.345 0.900 1.00 . B A . 1038 D6M HPA2 1 1 2 1027 2 2 1 . HPB1 H 11.420 8.439 2.304 1.00 . B A . 1038 D6M HPB1 1 1 2 1028 2 2 1 . HPB2 H 12.204 6.863 2.424 1.00 . B A . 1038 D6M HPB2 1 1 2 1029 2 2 1 . HPC1 H 10.737 6.124 3.945 1.00 . B A . 1038 D6M HPC1 1 1 2 1030 2 2 1 . HPC2 H 9.359 6.780 3.060 1.00 . B A . 1038 D6M HPC2 1 1 2 1031 2 2 1 . HPD1 H 9.187 8.264 4.721 1.00 . B A . 1038 D6M HPD1 1 1 2 1032 2 2 1 . HPD2 H 10.609 9.037 4.019 1.00 . B A . 1038 D6M HPD2 1 1 2 1033 2 2 1 . HPE1 H 11.792 7.114 5.494 1.00 . B A . 1038 D6M HPE1 1 1 2 1034 2 2 1 . HPE2 H 10.349 7.412 6.466 1.00 . B A . 1038 D6M HPE2 1 1 2 1035 2 2 1 . HPF1 H 12.339 9.497 5.566 1.00 . B A . 1038 D6M HPF1 1 1 2 1036 2 2 1 . HPF2 H 12.194 8.833 7.197 1.00 . B A . 1038 D6M HPF2 1 1 2 1037 2 2 1 . HPG1 H 10.926 10.666 7.527 1.00 . B A . 1038 D6M HPG1 1 1 2 1038 2 2 1 . HPG2 H 9.668 9.662 6.807 1.00 . B A . 1038 D6M HPG2 1 1 2 1039 2 2 1 . HPG3 H 10.535 10.835 5.816 1.00 . B A . 1038 D6M HPG3 1 1 2 1040 2 2 1 . HQ21 H 2.847 3.677 -4.686 1.00 . B A . 1038 D6M HQ21 1 1 2 1041 2 2 1 . HQ22 H 4.027 2.567 -3.992 1.00 . B A . 1038 D6M HQ22 1 1 2 1042 2 2 1 . HQ31 H 5.544 4.764 -4.218 1.00 . B A . 1038 D6M HQ31 1 1 2 1043 2 2 1 . HQ32 H 4.424 5.044 -5.544 1.00 . B A . 1038 D6M HQ32 1 1 2 1044 2 2 1 . N03 N 7.055 3.237 -5.316 1.00 . B A . 1038 D6M N03 1 1 2 1045 2 2 1 . O01 O 7.563 1.587 -6.715 1.00 . B A . 1038 D6M O01 1 1 2 1046 2 2 1 . O08 O 3.377 5.450 -2.702 1.00 . B A . 1038 D6M O08 1 1 2 1047 2 2 1 . O10 O 4.741 3.336 -7.989 1.00 . B A . 1038 D6M O10 1 1 2 1048 2 2 1 . O11 O 6.510 4.597 -7.637 1.00 . B A . 1038 D6M O11 1 1 3 1049 1 1 1 HIS C C -29.227 0.486 0.719 1.00 . A A . 7 HIS C 1 1 3 1050 1 1 1 HIS CA C -30.360 1.390 1.194 1.00 . A A . 7 HIS CA 1 1 3 1051 1 1 1 HIS CB C -31.057 0.774 2.409 1.00 . A A . 7 HIS CB 1 1 3 1052 1 1 1 HIS CD2 C -32.241 1.858 4.447 1.00 . A A . 7 HIS CD2 1 1 3 1053 1 1 1 HIS CE1 C -30.751 3.401 4.899 1.00 . A A . 7 HIS CE1 1 1 3 1054 1 1 1 HIS CG C -31.239 1.733 3.544 1.00 . A A . 7 HIS CG 1 1 3 1055 1 1 1 HIS H1 H -30.858 1.740 -0.771 1.00 . A A . 7 HIS H1 1 1 3 1056 1 1 1 HIS H2 H -31.962 0.742 0.079 1.00 . A A . 7 HIS H2 1 1 3 1057 1 1 1 HIS H3 H -31.933 2.432 0.374 1.00 . A A . 7 HIS H3 1 1 3 1058 1 1 1 HIS HA H -29.951 2.352 1.468 1.00 . A A . 7 HIS HA 1 1 3 1059 1 1 1 HIS HB2 H -32.034 0.421 2.114 1.00 . A A . 7 HIS HB2 1 1 3 1060 1 1 1 HIS HB3 H -30.472 -0.061 2.768 1.00 . A A . 7 HIS HB3 1 1 3 1061 1 1 1 HIS HD1 H -29.481 2.883 3.380 1.00 . A A . 7 HIS HD1 1 1 3 1062 1 1 1 HIS HD2 H -33.133 1.249 4.503 1.00 . A A . 7 HIS HD2 1 1 3 1063 1 1 1 HIS HE1 H -30.239 4.231 5.363 1.00 . A A . 7 HIS HE1 1 1 3 1064 1 1 1 HIS HE2 H -32.408 3.168 6.079 1.00 . A A . 7 HIS HE2 1 1 3 1065 1 1 1 HIS N N -31.369 1.594 0.122 1.00 . A A . 7 HIS N 1 1 3 1066 1 1 1 HIS ND1 N -30.322 2.715 3.854 1.00 . A A . 7 HIS ND1 1 1 3 1067 1 1 1 HIS NE2 N -31.913 2.902 5.276 1.00 . A A . 7 HIS NE2 1 1 3 1068 1 1 1 HIS O O -29.457 -0.652 0.310 1.00 . A A . 7 HIS O 1 1 3 1069 1 1 2 ALA C C -25.751 0.253 1.426 1.00 . A A . 8 ALA C 1 1 3 1070 1 1 2 ALA CA C -26.833 0.240 0.352 1.00 . A A . 8 ALA CA 1 1 3 1071 1 1 2 ALA CB C -26.289 0.795 -0.956 1.00 . A A . 8 ALA CB 1 1 3 1072 1 1 2 ALA H H -27.883 1.913 1.111 1.00 . A A . 8 ALA H 1 1 3 1073 1 1 2 ALA HA H -27.144 -0.781 0.180 1.00 . A A . 8 ALA HA 1 1 3 1074 1 1 2 ALA HB1 H -27.086 1.279 -1.501 1.00 . A A . 8 ALA HB1 1 1 3 1075 1 1 2 ALA HB2 H -25.510 1.513 -0.745 1.00 . A A . 8 ALA HB2 1 1 3 1076 1 1 2 ALA HB3 H -25.884 -0.011 -1.549 1.00 . A A . 8 ALA HB3 1 1 3 1077 1 1 2 ALA N N -28.003 1.000 0.776 1.00 . A A . 8 ALA N 1 1 3 1078 1 1 2 ALA O O -25.524 1.271 2.080 1.00 . A A . 8 ALA O 1 1 3 1079 1 1 3 GLU C C -22.662 -0.731 1.974 1.00 . A A . 9 GLU C 1 1 3 1080 1 1 3 GLU CA C -24.027 -1.003 2.597 1.00 . A A . 9 GLU CA 1 1 3 1081 1 1 3 GLU CB C -24.045 -2.396 3.227 1.00 . A A . 9 GLU CB 1 1 3 1082 1 1 3 GLU CD C -25.075 -3.919 4.960 1.00 . A A . 9 GLU CD 1 1 3 1083 1 1 3 GLU CG C -25.183 -2.604 4.213 1.00 . A A . 9 GLU CG 1 1 3 1084 1 1 3 GLU H H -25.313 -1.661 1.050 1.00 . A A . 9 GLU H 1 1 3 1085 1 1 3 GLU HA H -24.211 -0.267 3.366 1.00 . A A . 9 GLU HA 1 1 3 1086 1 1 3 GLU HB2 H -24.138 -3.132 2.443 1.00 . A A . 9 GLU HB2 1 1 3 1087 1 1 3 GLU HB3 H -23.112 -2.555 3.749 1.00 . A A . 9 GLU HB3 1 1 3 1088 1 1 3 GLU HG2 H -25.172 -1.798 4.931 1.00 . A A . 9 GLU HG2 1 1 3 1089 1 1 3 GLU HG3 H -26.118 -2.590 3.672 1.00 . A A . 9 GLU HG3 1 1 3 1090 1 1 3 GLU N N -25.086 -0.884 1.602 1.00 . A A . 9 GLU N 1 1 3 1091 1 1 3 GLU O O -22.239 -1.429 1.053 1.00 . A A . 9 GLU O 1 1 3 1092 1 1 3 GLU OE1 O -23.954 -4.463 5.044 1.00 . A A . 9 GLU OE1 1 1 3 1093 1 1 3 GLU OE2 O -26.111 -4.404 5.461 1.00 . A A . 9 GLU OE2 1 1 3 1094 1 1 4 GLY C C -19.636 0.814 3.058 1.00 . A A . 10 GLY C 1 1 3 1095 1 1 4 GLY CA C -20.668 0.636 1.961 1.00 . A A . 10 GLY CA 1 1 3 1096 1 1 4 GLY H H -22.365 0.811 3.215 1.00 . A A . 10 GLY H 1 1 3 1097 1 1 4 GLY HA2 H -20.337 -0.148 1.296 1.00 . A A . 10 GLY HA2 1 1 3 1098 1 1 4 GLY HA3 H -20.746 1.557 1.404 1.00 . A A . 10 GLY HA3 1 1 3 1099 1 1 4 GLY N N -21.977 0.290 2.481 1.00 . A A . 10 GLY N 1 1 3 1100 1 1 4 GLY O O -19.946 0.672 4.241 1.00 . A A . 10 GLY O 1 1 3 1101 1 1 5 THR C C -16.269 2.273 3.061 1.00 . A A . 11 THR C 1 1 3 1102 1 1 5 THR CA C -17.324 1.324 3.622 1.00 . A A . 11 THR CA 1 1 3 1103 1 1 5 THR CB C -16.682 -0.018 3.981 1.00 . A A . 11 THR CB 1 1 3 1104 1 1 5 THR CG2 C -15.969 -0.672 2.817 1.00 . A A . 11 THR CG2 1 1 3 1105 1 1 5 THR H H -18.221 1.226 1.707 1.00 . A A . 11 THR H 1 1 3 1106 1 1 5 THR HA H -17.746 1.761 4.514 1.00 . A A . 11 THR HA 1 1 3 1107 1 1 5 THR HB H -17.454 -0.695 4.318 1.00 . A A . 11 THR HB 1 1 3 1108 1 1 5 THR HG1 H -14.959 0.584 4.695 1.00 . A A . 11 THR HG1 1 1 3 1109 1 1 5 THR HG21 H -15.182 -0.021 2.466 1.00 . A A . 11 THR HG21 1 1 3 1110 1 1 5 THR HG22 H -15.544 -1.612 3.138 1.00 . A A . 11 THR HG22 1 1 3 1111 1 1 5 THR HG23 H -16.673 -0.850 2.018 1.00 . A A . 11 THR HG23 1 1 3 1112 1 1 5 THR N N -18.406 1.126 2.664 1.00 . A A . 11 THR N 1 1 3 1113 1 1 5 THR O O -16.249 2.557 1.863 1.00 . A A . 11 THR O 1 1 3 1114 1 1 5 THR OG1 O -15.742 0.140 5.029 1.00 . A A . 11 THR OG1 1 1 3 1115 1 1 6 PHE C C -12.967 3.008 3.623 1.00 . A A . 12 PHE C 1 1 3 1116 1 1 6 PHE CA C -14.335 3.676 3.524 1.00 . A A . 12 PHE CA 1 1 3 1117 1 1 6 PHE CB C -14.367 4.942 4.385 1.00 . A A . 12 PHE CB 1 1 3 1118 1 1 6 PHE CD1 C -12.607 4.690 6.157 1.00 . A A . 12 PHE CD1 1 1 3 1119 1 1 6 PHE CD2 C -14.897 4.523 6.804 1.00 . A A . 12 PHE CD2 1 1 3 1120 1 1 6 PHE CE1 C -12.219 4.480 7.466 1.00 . A A . 12 PHE CE1 1 1 3 1121 1 1 6 PHE CE2 C -14.514 4.312 8.115 1.00 . A A . 12 PHE CE2 1 1 3 1122 1 1 6 PHE CG C -13.949 4.714 5.811 1.00 . A A . 12 PHE CG 1 1 3 1123 1 1 6 PHE CZ C -13.173 4.291 8.446 1.00 . A A . 12 PHE CZ 1 1 3 1124 1 1 6 PHE H H -15.459 2.497 4.876 1.00 . A A . 12 PHE H 1 1 3 1125 1 1 6 PHE HA H -14.515 3.949 2.495 1.00 . A A . 12 PHE HA 1 1 3 1126 1 1 6 PHE HB2 H -13.701 5.675 3.958 1.00 . A A . 12 PHE HB2 1 1 3 1127 1 1 6 PHE HB3 H -15.372 5.337 4.392 1.00 . A A . 12 PHE HB3 1 1 3 1128 1 1 6 PHE HD1 H -11.860 4.838 5.391 1.00 . A A . 12 PHE HD1 1 1 3 1129 1 1 6 PHE HD2 H -15.945 4.539 6.545 1.00 . A A . 12 PHE HD2 1 1 3 1130 1 1 6 PHE HE1 H -11.170 4.463 7.722 1.00 . A A . 12 PHE HE1 1 1 3 1131 1 1 6 PHE HE2 H -15.262 4.165 8.879 1.00 . A A . 12 PHE HE2 1 1 3 1132 1 1 6 PHE HZ H -12.872 4.126 9.470 1.00 . A A . 12 PHE HZ 1 1 3 1133 1 1 6 PHE N N -15.393 2.760 3.934 1.00 . A A . 12 PHE N 1 1 3 1134 1 1 6 PHE O O -12.118 3.178 2.748 1.00 . A A . 12 PHE O 1 1 3 1135 1 1 7 THR C C -11.191 0.608 3.754 1.00 . A A . 13 THR C 1 1 3 1136 1 1 7 THR CA C -11.495 1.556 4.909 1.00 . A A . 13 THR CA 1 1 3 1137 1 1 7 THR CB C -11.532 0.779 6.226 1.00 . A A . 13 THR CB 1 1 3 1138 1 1 7 THR CG2 C -12.578 -0.314 6.248 1.00 . A A . 13 THR CG2 1 1 3 1139 1 1 7 THR H H -13.476 2.154 5.358 1.00 . A A . 13 THR H 1 1 3 1140 1 1 7 THR HA H -10.714 2.300 4.963 1.00 . A A . 13 THR HA 1 1 3 1141 1 1 7 THR HB H -11.754 1.465 7.031 1.00 . A A . 13 THR HB 1 1 3 1142 1 1 7 THR HG1 H -10.013 -0.357 5.735 1.00 . A A . 13 THR HG1 1 1 3 1143 1 1 7 THR HG21 H -12.334 -1.061 5.507 1.00 . A A . 13 THR HG21 1 1 3 1144 1 1 7 THR HG22 H -12.601 -0.771 7.226 1.00 . A A . 13 THR HG22 1 1 3 1145 1 1 7 THR HG23 H -13.546 0.110 6.027 1.00 . A A . 13 THR HG23 1 1 3 1146 1 1 7 THR N N -12.760 2.249 4.695 1.00 . A A . 13 THR N 1 1 3 1147 1 1 7 THR O O -10.048 0.501 3.310 1.00 . A A . 13 THR O 1 1 3 1148 1 1 7 THR OG1 O -10.277 0.177 6.489 1.00 . A A . 13 THR OG1 1 1 3 1149 1 1 8 SER C C -11.937 -0.277 0.839 1.00 . A A . 14 SER C 1 1 3 1150 1 1 8 SER CA C -12.064 -1.017 2.167 1.00 . A A . 14 SER CA 1 1 3 1151 1 1 8 SER CB C -13.251 -1.981 2.115 1.00 . A A . 14 SER CB 1 1 3 1152 1 1 8 SER H H -13.109 0.051 3.666 1.00 . A A . 14 SER H 1 1 3 1153 1 1 8 SER HA H -11.160 -1.581 2.338 1.00 . A A . 14 SER HA 1 1 3 1154 1 1 8 SER HB2 H -13.623 -2.142 3.116 1.00 . A A . 14 SER HB2 1 1 3 1155 1 1 8 SER HB3 H -14.032 -1.554 1.505 1.00 . A A . 14 SER HB3 1 1 3 1156 1 1 8 SER HG H -13.271 -3.332 0.697 1.00 . A A . 14 SER HG 1 1 3 1157 1 1 8 SER N N -12.222 -0.078 3.271 1.00 . A A . 14 SER N 1 1 3 1158 1 1 8 SER O O -11.269 -0.744 -0.083 1.00 . A A . 14 SER O 1 1 3 1159 1 1 8 SER OG O -12.870 -3.229 1.564 1.00 . A A . 14 SER OG 1 1 3 1160 1 1 9 ASP C C -11.139 2.231 -0.711 1.00 . A A . 15 ASP C 1 1 3 1161 1 1 9 ASP CA C -12.543 1.689 -0.465 1.00 . A A . 15 ASP CA 1 1 3 1162 1 1 9 ASP CB C -13.539 2.845 -0.367 1.00 . A A . 15 ASP CB 1 1 3 1163 1 1 9 ASP CG C -14.184 3.167 -1.701 1.00 . A A . 15 ASP CG 1 1 3 1164 1 1 9 ASP H H -13.099 1.202 1.518 1.00 . A A . 15 ASP H 1 1 3 1165 1 1 9 ASP HA H -12.821 1.055 -1.294 1.00 . A A . 15 ASP HA 1 1 3 1166 1 1 9 ASP HB2 H -14.318 2.584 0.334 1.00 . A A . 15 ASP HB2 1 1 3 1167 1 1 9 ASP HB3 H -13.024 3.727 -0.015 1.00 . A A . 15 ASP HB3 1 1 3 1168 1 1 9 ASP N N -12.583 0.882 0.749 1.00 . A A . 15 ASP N 1 1 3 1169 1 1 9 ASP O O -10.639 2.202 -1.835 1.00 . A A . 15 ASP O 1 1 3 1170 1 1 9 ASP OD1 O -13.443 3.398 -2.679 1.00 . A A . 15 ASP OD1 1 1 3 1171 1 1 9 ASP OD2 O -15.431 3.188 -1.767 1.00 . A A . 15 ASP OD2 1 1 3 1172 1 1 10 VAL C C -8.131 2.170 0.041 1.00 . A A . 16 VAL C 1 1 3 1173 1 1 10 VAL CA C -9.161 3.277 0.247 1.00 . A A . 16 VAL CA 1 1 3 1174 1 1 10 VAL CB C -8.791 4.091 1.504 1.00 . A A . 16 VAL CB 1 1 3 1175 1 1 10 VAL CG1 C -8.798 3.205 2.742 1.00 . A A . 16 VAL CG1 1 1 3 1176 1 1 10 VAL CG2 C -7.438 4.765 1.328 1.00 . A A . 16 VAL CG2 1 1 3 1177 1 1 10 VAL H H -10.959 2.724 1.219 1.00 . A A . 16 VAL H 1 1 3 1178 1 1 10 VAL HA H -9.136 3.940 -0.605 1.00 . A A . 16 VAL HA 1 1 3 1179 1 1 10 VAL HB H -9.536 4.861 1.640 1.00 . A A . 16 VAL HB 1 1 3 1180 1 1 10 VAL HG11 H -9.733 2.667 2.794 1.00 . A A . 16 VAL HG11 1 1 3 1181 1 1 10 VAL HG12 H -7.981 2.501 2.686 1.00 . A A . 16 VAL HG12 1 1 3 1182 1 1 10 VAL HG13 H -8.686 3.818 3.624 1.00 . A A . 16 VAL HG13 1 1 3 1183 1 1 10 VAL HG21 H -6.877 4.253 0.561 1.00 . A A . 16 VAL HG21 1 1 3 1184 1 1 10 VAL HG22 H -7.584 5.795 1.039 1.00 . A A . 16 VAL HG22 1 1 3 1185 1 1 10 VAL HG23 H -6.892 4.727 2.259 1.00 . A A . 16 VAL HG23 1 1 3 1186 1 1 10 VAL N N -10.508 2.727 0.348 1.00 . A A . 16 VAL N 1 1 3 1187 1 1 10 VAL O O -7.251 2.279 -0.811 1.00 . A A . 16 VAL O 1 1 3 1188 1 1 11 SER C C -7.311 -0.608 -0.688 1.00 . A A . 17 SER C 1 1 3 1189 1 1 11 SER CA C -7.326 -0.024 0.725 1.00 . A A . 17 SER CA 1 1 3 1190 1 1 11 SER CB C -7.709 -1.110 1.732 1.00 . A A . 17 SER CB 1 1 3 1191 1 1 11 SER H H -8.972 1.071 1.484 1.00 . A A . 17 SER H 1 1 3 1192 1 1 11 SER HA H -6.338 0.338 0.961 1.00 . A A . 17 SER HA 1 1 3 1193 1 1 11 SER HB2 H -8.297 -0.671 2.524 1.00 . A A . 17 SER HB2 1 1 3 1194 1 1 11 SER HB3 H -8.288 -1.872 1.233 1.00 . A A . 17 SER HB3 1 1 3 1195 1 1 11 SER HG H -6.219 -1.152 3.005 1.00 . A A . 17 SER HG 1 1 3 1196 1 1 11 SER N N -8.248 1.103 0.824 1.00 . A A . 17 SER N 1 1 3 1197 1 1 11 SER O O -6.368 -1.299 -1.072 1.00 . A A . 17 SER O 1 1 3 1198 1 1 11 SER OG O -6.557 -1.710 2.300 1.00 . A A . 17 SER OG 1 1 3 1199 1 1 12 SER C C -7.253 -0.474 -3.660 1.00 . A A . 18 SER C 1 1 3 1200 1 1 12 SER CA C -8.475 -0.838 -2.817 1.00 . A A . 18 SER CA 1 1 3 1201 1 1 12 SER CB C -9.741 -0.291 -3.479 1.00 . A A . 18 SER CB 1 1 3 1202 1 1 12 SER H H -9.088 0.216 -1.090 1.00 . A A . 18 SER H 1 1 3 1203 1 1 12 SER HA H -8.549 -1.914 -2.764 1.00 . A A . 18 SER HA 1 1 3 1204 1 1 12 SER HB2 H -10.433 0.032 -2.715 1.00 . A A . 18 SER HB2 1 1 3 1205 1 1 12 SER HB3 H -9.483 0.548 -4.108 1.00 . A A . 18 SER HB3 1 1 3 1206 1 1 12 SER HG H -9.708 -1.747 -4.789 1.00 . A A . 18 SER HG 1 1 3 1207 1 1 12 SER N N -8.363 -0.333 -1.453 1.00 . A A . 18 SER N 1 1 3 1208 1 1 12 SER O O -6.913 -1.184 -4.606 1.00 . A A . 18 SER O 1 1 3 1209 1 1 12 SER OG O -10.371 -1.281 -4.274 1.00 . A A . 18 SER OG 1 1 3 1210 1 1 13 TYR C C -4.212 0.192 -3.763 1.00 . A A . 19 TYR C 1 1 3 1211 1 1 13 TYR CA C -5.422 1.072 -4.073 1.00 . A A . 19 TYR CA 1 1 3 1212 1 1 13 TYR CB C -5.118 2.555 -3.794 1.00 . A A . 19 TYR CB 1 1 3 1213 1 1 13 TYR CD1 C -2.833 2.491 -2.702 1.00 . A A . 19 TYR CD1 1 1 3 1214 1 1 13 TYR CD2 C -4.650 3.399 -1.456 1.00 . A A . 19 TYR CD2 1 1 3 1215 1 1 13 TYR CE1 C -1.979 2.736 -1.644 1.00 . A A . 19 TYR CE1 1 1 3 1216 1 1 13 TYR CE2 C -3.802 3.647 -0.393 1.00 . A A . 19 TYR CE2 1 1 3 1217 1 1 13 TYR CG C -4.183 2.816 -2.627 1.00 . A A . 19 TYR CG 1 1 3 1218 1 1 13 TYR CZ C -2.468 3.314 -0.492 1.00 . A A . 19 TYR CZ 1 1 3 1219 1 1 13 TYR H H -6.911 1.169 -2.565 1.00 . A A . 19 TYR H 1 1 3 1220 1 1 13 TYR HA H -5.655 0.963 -5.122 1.00 . A A . 19 TYR HA 1 1 3 1221 1 1 13 TYR HB2 H -4.667 2.989 -4.673 1.00 . A A . 19 TYR HB2 1 1 3 1222 1 1 13 TYR HB3 H -6.048 3.067 -3.591 1.00 . A A . 19 TYR HB3 1 1 3 1223 1 1 13 TYR HD1 H -2.452 2.037 -3.605 1.00 . A A . 19 TYR HD1 1 1 3 1224 1 1 13 TYR HD2 H -5.694 3.661 -1.381 1.00 . A A . 19 TYR HD2 1 1 3 1225 1 1 13 TYR HE1 H -0.933 2.476 -1.723 1.00 . A A . 19 TYR HE1 1 1 3 1226 1 1 13 TYR HE2 H -4.186 4.099 0.510 1.00 . A A . 19 TYR HE2 1 1 3 1227 1 1 13 TYR HH H -1.023 2.817 0.675 1.00 . A A . 19 TYR HH 1 1 3 1228 1 1 13 TYR N N -6.597 0.635 -3.324 1.00 . A A . 19 TYR N 1 1 3 1229 1 1 13 TYR O O -3.481 -0.211 -4.668 1.00 . A A . 19 TYR O 1 1 3 1230 1 1 13 TYR OH O -1.620 3.560 0.563 1.00 . A A . 19 TYR OH 1 1 3 1231 1 1 14 LEU C C -3.252 -2.415 -2.120 1.00 . A A . 20 LEU C 1 1 3 1232 1 1 14 LEU CA C -2.882 -0.936 -2.067 1.00 . A A . 20 LEU CA 1 1 3 1233 1 1 14 LEU CB C -2.434 -0.562 -0.653 1.00 . A A . 20 LEU CB 1 1 3 1234 1 1 14 LEU CD1 C -3.096 -1.379 1.627 1.00 . A A . 20 LEU CD1 1 1 3 1235 1 1 14 LEU CD2 C -3.929 0.829 0.802 1.00 . A A . 20 LEU CD2 1 1 3 1236 1 1 14 LEU CG C -3.539 -0.587 0.407 1.00 . A A . 20 LEU CG 1 1 3 1237 1 1 14 LEU H H -4.621 0.246 -1.806 1.00 . A A . 20 LEU H 1 1 3 1238 1 1 14 LEU HA H -2.067 -0.758 -2.752 1.00 . A A . 20 LEU HA 1 1 3 1239 1 1 14 LEU HB2 H -1.657 -1.251 -0.352 1.00 . A A . 20 LEU HB2 1 1 3 1240 1 1 14 LEU HB3 H -2.015 0.433 -0.683 1.00 . A A . 20 LEU HB3 1 1 3 1241 1 1 14 LEU HD11 H -2.579 -2.272 1.308 1.00 . A A . 20 LEU HD11 1 1 3 1242 1 1 14 LEU HD12 H -2.433 -0.775 2.228 1.00 . A A . 20 LEU HD12 1 1 3 1243 1 1 14 LEU HD13 H -3.961 -1.654 2.212 1.00 . A A . 20 LEU HD13 1 1 3 1244 1 1 14 LEU HD21 H -3.038 1.407 0.998 1.00 . A A . 20 LEU HD21 1 1 3 1245 1 1 14 LEU HD22 H -4.486 1.287 -0.002 1.00 . A A . 20 LEU HD22 1 1 3 1246 1 1 14 LEU HD23 H -4.541 0.799 1.692 1.00 . A A . 20 LEU HD23 1 1 3 1247 1 1 14 LEU HG H -4.412 -1.071 -0.006 1.00 . A A . 20 LEU HG 1 1 3 1248 1 1 14 LEU N N -4.005 -0.103 -2.484 1.00 . A A . 20 LEU N 1 1 3 1249 1 1 14 LEU O O -4.173 -2.860 -1.435 1.00 . A A . 20 LEU O 1 1 3 1250 1 1 15 GLU C C -1.731 -5.252 -3.978 1.00 . A A . 21 GLU C 1 1 3 1251 1 1 15 GLU CA C -2.781 -4.601 -3.082 1.00 . A A . 21 GLU CA 1 1 3 1252 1 1 15 GLU CB C -4.178 -4.839 -3.658 1.00 . A A . 21 GLU CB 1 1 3 1253 1 1 15 GLU CD C -4.251 -5.164 -6.162 1.00 . A A . 21 GLU CD 1 1 3 1254 1 1 15 GLU CG C -4.396 -4.186 -5.013 1.00 . A A . 21 GLU CG 1 1 3 1255 1 1 15 GLU H H -1.808 -2.759 -3.460 1.00 . A A . 21 GLU H 1 1 3 1256 1 1 15 GLU HA H -2.725 -5.047 -2.100 1.00 . A A . 21 GLU HA 1 1 3 1257 1 1 15 GLU HB2 H -4.334 -5.902 -3.766 1.00 . A A . 21 GLU HB2 1 1 3 1258 1 1 15 GLU HB3 H -4.910 -4.444 -2.970 1.00 . A A . 21 GLU HB3 1 1 3 1259 1 1 15 GLU HG2 H -5.392 -3.768 -5.041 1.00 . A A . 21 GLU HG2 1 1 3 1260 1 1 15 GLU HG3 H -3.672 -3.395 -5.138 1.00 . A A . 21 GLU HG3 1 1 3 1261 1 1 15 GLU N N -2.529 -3.172 -2.939 1.00 . A A . 21 GLU N 1 1 3 1262 1 1 15 GLU O O -1.571 -4.874 -5.139 1.00 . A A . 21 GLU O 1 1 3 1263 1 1 15 GLU OE1 O -4.739 -6.307 -6.034 1.00 . A A . 21 GLU OE1 1 1 3 1264 1 1 15 GLU OE2 O -3.648 -4.788 -7.189 1.00 . A A . 21 GLU OE2 1 1 3 1265 1 1 16 GLY C C 1.400 -6.659 -3.661 1.00 . A A . 22 GLY C 1 1 3 1266 1 1 16 GLY CA C 0.005 -6.920 -4.194 1.00 . A A . 22 GLY CA 1 1 3 1267 1 1 16 GLY H H -1.191 -6.490 -2.501 1.00 . A A . 22 GLY H 1 1 3 1268 1 1 16 GLY HA2 H -0.188 -7.982 -4.159 1.00 . A A . 22 GLY HA2 1 1 3 1269 1 1 16 GLY HA3 H -0.043 -6.590 -5.221 1.00 . A A . 22 GLY HA3 1 1 3 1270 1 1 16 GLY N N -1.019 -6.232 -3.431 1.00 . A A . 22 GLY N 1 1 3 1271 1 1 16 GLY O O 1.573 -5.925 -2.688 1.00 . A A . 22 GLY O 1 1 3 1272 1 1 17 GLN C C 4.364 -5.789 -4.430 1.00 . A A . 23 GLN C 1 1 3 1273 1 1 17 GLN CA C 3.785 -7.092 -3.885 1.00 . A A . 23 GLN CA 1 1 3 1274 1 1 17 GLN CB C 4.630 -8.276 -4.359 1.00 . A A . 23 GLN CB 1 1 3 1275 1 1 17 GLN CD C 7.129 -7.907 -4.327 1.00 . A A . 23 GLN CD 1 1 3 1276 1 1 17 GLN CG C 5.925 -8.450 -3.582 1.00 . A A . 23 GLN CG 1 1 3 1277 1 1 17 GLN H H 2.196 -7.835 -5.068 1.00 . A A . 23 GLN H 1 1 3 1278 1 1 17 GLN HA H 3.806 -7.057 -2.806 1.00 . A A . 23 GLN HA 1 1 3 1279 1 1 17 GLN HB2 H 4.050 -9.181 -4.256 1.00 . A A . 23 GLN HB2 1 1 3 1280 1 1 17 GLN HB3 H 4.876 -8.133 -5.401 1.00 . A A . 23 GLN HB3 1 1 3 1281 1 1 17 GLN HE21 H 6.944 -6.158 -3.399 1.00 . A A . 23 GLN HE21 1 1 3 1282 1 1 17 GLN HE22 H 8.251 -6.277 -4.522 1.00 . A A . 23 GLN HE22 1 1 3 1283 1 1 17 GLN HG2 H 5.838 -7.929 -2.641 1.00 . A A . 23 GLN HG2 1 1 3 1284 1 1 17 GLN HG3 H 6.080 -9.503 -3.397 1.00 . A A . 23 GLN HG3 1 1 3 1285 1 1 17 GLN N N 2.398 -7.262 -4.299 1.00 . A A . 23 GLN N 1 1 3 1286 1 1 17 GLN NE2 N 7.477 -6.654 -4.055 1.00 . A A . 23 GLN NE2 1 1 3 1287 1 1 17 GLN O O 5.321 -5.247 -3.878 1.00 . A A . 23 GLN O 1 1 3 1288 1 1 17 GLN OE1 O 7.740 -8.604 -5.136 1.00 . A A . 23 GLN OE1 1 1 3 1289 1 1 18 ALA C C 4.312 -2.917 -5.119 1.00 . A A . 24 ALA C 1 1 3 1290 1 1 18 ALA CA C 4.241 -4.052 -6.135 1.00 . A A . 24 ALA CA 1 1 3 1291 1 1 18 ALA CB C 3.330 -3.669 -7.290 1.00 . A A . 24 ALA CB 1 1 3 1292 1 1 18 ALA H H 3.021 -5.768 -5.913 1.00 . A A . 24 ALA H 1 1 3 1293 1 1 18 ALA HA H 5.230 -4.228 -6.532 1.00 . A A . 24 ALA HA 1 1 3 1294 1 1 18 ALA HB1 H 3.187 -4.524 -7.935 1.00 . A A . 24 ALA HB1 1 1 3 1295 1 1 18 ALA HB2 H 2.375 -3.346 -6.904 1.00 . A A . 24 ALA HB2 1 1 3 1296 1 1 18 ALA HB3 H 3.782 -2.866 -7.853 1.00 . A A . 24 ALA HB3 1 1 3 1297 1 1 18 ALA N N 3.780 -5.291 -5.516 1.00 . A A . 24 ALA N 1 1 3 1298 1 1 18 ALA O O 5.241 -2.110 -5.141 1.00 . A A . 24 ALA O 1 1 3 1299 1 1 19 ALA C C 4.188 -2.164 -2.027 1.00 . A A . 25 ALA C 1 1 3 1300 1 1 19 ALA CA C 3.287 -1.820 -3.207 1.00 . A A . 25 ALA CA 1 1 3 1301 1 1 19 ALA CB C 1.863 -1.594 -2.727 1.00 . A A . 25 ALA CB 1 1 3 1302 1 1 19 ALA H H 2.614 -3.530 -4.258 1.00 . A A . 25 ALA H 1 1 3 1303 1 1 19 ALA HA H 3.638 -0.901 -3.656 1.00 . A A . 25 ALA HA 1 1 3 1304 1 1 19 ALA HB1 H 1.386 -2.547 -2.556 1.00 . A A . 25 ALA HB1 1 1 3 1305 1 1 19 ALA HB2 H 1.883 -1.030 -1.806 1.00 . A A . 25 ALA HB2 1 1 3 1306 1 1 19 ALA HB3 H 1.313 -1.044 -3.476 1.00 . A A . 25 ALA HB3 1 1 3 1307 1 1 19 ALA N N 3.328 -2.859 -4.228 1.00 . A A . 25 ALA N 1 1 3 1308 1 1 19 ALA O O 4.567 -1.290 -1.259 1.00 . A A . 25 ALA O 1 1 3 1309 1 1 20 LYS C C 6.803 -3.349 -0.944 1.00 . A A . 26 LYS C 1 1 3 1310 1 1 20 LYS CA C 5.378 -3.882 -0.788 1.00 . A A . 26 LYS CA 1 1 3 1311 1 1 20 LYS CB C 5.395 -5.412 -0.716 1.00 . A A . 26 LYS CB 1 1 3 1312 1 1 20 LYS CD C 3.281 -5.966 0.528 1.00 . A A . 26 LYS CD 1 1 3 1313 1 1 20 LYS CE C 2.687 -5.440 1.825 1.00 . A A . 26 LYS CE 1 1 3 1314 1 1 20 LYS CG C 4.801 -5.966 0.569 1.00 . A A . 26 LYS CG 1 1 3 1315 1 1 20 LYS HA H 4.963 -3.495 0.131 1.00 . A A . 26 LYS HA 1 1 3 1316 1 1 20 LYS HB2 H 4.828 -5.805 -1.547 1.00 . A A . 26 LYS HB2 1 1 3 1317 1 1 20 LYS HD2 H 2.952 -5.338 -0.287 1.00 . A A . 26 LYS HD2 1 1 3 1318 1 1 20 LYS HE2 H 1.614 -5.550 1.785 1.00 . A A . 26 LYS HE2 1 1 3 1319 1 1 20 LYS HG2 H 5.146 -6.980 0.706 1.00 . A A . 26 LYS HG2 1 1 3 1320 1 1 20 LYS HZ1 H 3.335 -3.517 1.277 1.00 . A A . 26 LYS HZ1 1 1 3 1321 1 1 20 LYS N N 4.523 -3.439 -1.883 1.00 . A A . 26 LYS N 1 1 3 1322 1 1 20 LYS NZ N 3.011 -4.033 2.044 1.00 . A A . 26 LYS NZ 1 1 3 1323 1 1 20 LYS O O 7.573 -3.323 0.014 1.00 . A A . 26 LYS O 1 1 3 1324 1 1 21 GLU C C 8.795 -1.126 -1.716 1.00 . A A . 27 GLU C 1 1 3 1325 1 1 21 GLU CA C 8.491 -2.437 -2.449 1.00 . A A . 27 GLU CA 1 1 3 1326 1 1 21 GLU CB C 8.666 -2.246 -3.959 1.00 . A A . 27 GLU CB 1 1 3 1327 1 1 21 GLU CD C 8.013 -0.937 -6.020 1.00 . A A . 27 GLU CD 1 1 3 1328 1 1 21 GLU CG C 7.978 -1.004 -4.506 1.00 . A A . 27 GLU CG 1 1 3 1329 1 1 21 GLU H H 6.501 -3.005 -2.890 1.00 . A A . 27 GLU H 1 1 3 1330 1 1 21 GLU HA H 9.197 -3.183 -2.116 1.00 . A A . 27 GLU HA 1 1 3 1331 1 1 21 GLU HB2 H 9.720 -2.173 -4.181 1.00 . A A . 27 GLU HB2 1 1 3 1332 1 1 21 GLU HB3 H 8.260 -3.108 -4.468 1.00 . A A . 27 GLU HB3 1 1 3 1333 1 1 21 GLU HG2 H 6.947 -1.009 -4.185 1.00 . A A . 27 GLU HG2 1 1 3 1334 1 1 21 GLU HG3 H 8.474 -0.131 -4.109 1.00 . A A . 27 GLU HG3 1 1 3 1335 1 1 21 GLU N N 7.153 -2.945 -2.161 1.00 . A A . 27 GLU N 1 1 3 1336 1 1 21 GLU O O 9.859 -0.981 -1.116 1.00 . A A . 27 GLU O 1 1 3 1337 1 1 21 GLU OE1 O 7.126 -1.537 -6.662 1.00 . A A . 27 GLU OE1 1 1 3 1338 1 1 21 GLU OE2 O 8.928 -0.285 -6.564 1.00 . A A . 27 GLU OE2 1 1 3 1339 1 1 22 PHE C C 8.336 1.009 0.352 1.00 . A A . 28 PHE C 1 1 3 1340 1 1 22 PHE CA C 8.091 1.136 -1.148 1.00 . A A . 28 PHE CA 1 1 3 1341 1 1 22 PHE CB C 6.931 2.100 -1.434 1.00 . A A . 28 PHE CB 1 1 3 1342 1 1 22 PHE CD1 C 5.384 0.748 0.023 1.00 . A A . 28 PHE CD1 1 1 3 1343 1 1 22 PHE CD2 C 4.920 3.052 -0.320 1.00 . A A . 28 PHE CD2 1 1 3 1344 1 1 22 PHE CE1 C 4.270 0.642 0.830 1.00 . A A . 28 PHE CE1 1 1 3 1345 1 1 22 PHE CE2 C 3.808 2.956 0.481 1.00 . A A . 28 PHE CE2 1 1 3 1346 1 1 22 PHE CG C 5.720 1.953 -0.561 1.00 . A A . 28 PHE CG 1 1 3 1347 1 1 22 PHE CZ C 3.478 1.748 1.060 1.00 . A A . 28 PHE CZ 1 1 3 1348 1 1 22 PHE H H 7.053 -0.318 -2.296 1.00 . A A . 28 PHE H 1 1 3 1349 1 1 22 PHE HA H 8.986 1.553 -1.589 1.00 . A A . 28 PHE HA 1 1 3 1350 1 1 22 PHE HB2 H 7.285 3.107 -1.293 1.00 . A A . 28 PHE HB2 1 1 3 1351 1 1 22 PHE HB3 H 6.618 1.974 -2.457 1.00 . A A . 28 PHE HB3 1 1 3 1352 1 1 22 PHE HD1 H 5.173 3.998 -0.774 1.00 . A A . 28 PHE HD1 1 1 3 1353 1 1 22 PHE HD2 H 5.996 -0.118 -0.161 1.00 . A A . 28 PHE HD2 1 1 3 1354 1 1 22 PHE HE1 H 3.216 3.832 0.673 1.00 . A A . 28 PHE HE1 1 1 3 1355 1 1 22 PHE HE2 H 4.024 -0.302 1.286 1.00 . A A . 28 PHE HE2 1 1 3 1356 1 1 22 PHE HZ H 2.604 1.669 1.690 1.00 . A A . 28 PHE HZ 1 1 3 1357 1 1 22 PHE N N 7.877 -0.162 -1.788 1.00 . A A . 28 PHE N 1 1 3 1358 1 1 22 PHE O O 8.887 1.916 0.975 1.00 . A A . 28 PHE O 1 1 3 1359 1 1 23 ILE C C 9.634 -0.321 2.692 1.00 . A A . 29 ILE C 1 1 3 1360 1 1 23 ILE CA C 8.143 -0.330 2.353 1.00 . A A . 29 ILE CA 1 1 3 1361 1 1 23 ILE CB C 7.494 -1.652 2.813 1.00 . A A . 29 ILE CB 1 1 3 1362 1 1 23 ILE CD1 C 6.268 -2.729 4.767 1.00 . A A . 29 ILE CD1 1 1 3 1363 1 1 23 ILE CG1 C 7.132 -1.579 4.298 1.00 . A A . 29 ILE CG1 1 1 3 1364 1 1 23 ILE CG2 C 8.409 -2.840 2.541 1.00 . A A . 29 ILE CG2 1 1 3 1365 1 1 23 ILE H H 7.519 -0.814 0.394 1.00 . A A . 29 ILE H 1 1 3 1366 1 1 23 ILE HA H 7.664 0.483 2.880 1.00 . A A . 29 ILE HA 1 1 3 1367 1 1 23 ILE HB H 6.590 -1.789 2.237 1.00 . A A . 29 ILE HB 1 1 3 1368 1 1 23 ILE HD11 H 5.979 -3.331 3.918 1.00 . A A . 29 ILE HD11 1 1 3 1369 1 1 23 ILE HD12 H 6.825 -3.335 5.466 1.00 . A A . 29 ILE HD12 1 1 3 1370 1 1 23 ILE HD13 H 5.384 -2.341 5.251 1.00 . A A . 29 ILE HD13 1 1 3 1371 1 1 23 ILE HG12 H 8.038 -1.585 4.884 1.00 . A A . 29 ILE HG12 1 1 3 1372 1 1 23 ILE HG13 H 6.594 -0.660 4.486 1.00 . A A . 29 ILE HG13 1 1 3 1373 1 1 23 ILE HG21 H 9.092 -2.593 1.742 1.00 . A A . 29 ILE HG21 1 1 3 1374 1 1 23 ILE HG22 H 8.968 -3.076 3.434 1.00 . A A . 29 ILE HG22 1 1 3 1375 1 1 23 ILE HG23 H 7.814 -3.694 2.253 1.00 . A A . 29 ILE HG23 1 1 3 1376 1 1 23 ILE N N 7.942 -0.114 0.932 1.00 . A A . 29 ILE N 1 1 3 1377 1 1 23 ILE O O 10.021 -0.118 3.842 1.00 . A A . 29 ILE O 1 1 3 1378 1 1 24 ALA C C 12.470 0.873 1.858 1.00 . A A . 30 ALA C 1 1 3 1379 1 1 24 ALA CA C 11.909 -0.547 1.847 1.00 . A A . 30 ALA CA 1 1 3 1380 1 1 24 ALA CB C 12.563 -1.365 0.744 1.00 . A A . 30 ALA CB 1 1 3 1381 1 1 24 ALA H H 10.094 -0.687 0.779 1.00 . A A . 30 ALA H 1 1 3 1382 1 1 24 ALA HA H 12.128 -1.019 2.793 1.00 . A A . 30 ALA HA 1 1 3 1383 1 1 24 ALA HB1 H 11.966 -1.301 -0.154 1.00 . A A . 30 ALA HB1 1 1 3 1384 1 1 24 ALA HB2 H 13.552 -0.979 0.548 1.00 . A A . 30 ALA HB2 1 1 3 1385 1 1 24 ALA HB3 H 12.635 -2.397 1.056 1.00 . A A . 30 ALA HB3 1 1 3 1386 1 1 24 ALA N N 10.464 -0.536 1.673 1.00 . A A . 30 ALA N 1 1 3 1387 1 1 24 ALA O O 13.353 1.192 2.654 1.00 . A A . 30 ALA O 1 1 3 1388 1 1 25 TRP C C 12.013 3.891 2.141 1.00 . A A . 31 TRP C 1 1 3 1389 1 1 25 TRP CA C 12.413 3.106 0.892 1.00 . A A . 31 TRP CA 1 1 3 1390 1 1 25 TRP CB C 11.837 3.819 -0.347 1.00 . A A . 31 TRP CB 1 1 3 1391 1 1 25 TRP CD1 C 11.921 6.313 0.260 1.00 . A A . 31 TRP CD1 1 1 3 1392 1 1 25 TRP CD2 C 9.859 5.449 0.190 1.00 . A A . 31 TRP CD2 1 1 3 1393 1 1 25 TRP CE2 C 9.764 6.797 0.573 1.00 . A A . 31 TRP CE2 1 1 3 1394 1 1 25 TRP CE3 C 8.691 4.698 0.073 1.00 . A A . 31 TRP CE3 1 1 3 1395 1 1 25 TRP CG C 11.245 5.156 0.000 1.00 . A A . 31 TRP CG 1 1 3 1396 1 1 25 TRP CH2 C 7.415 6.645 0.728 1.00 . A A . 31 TRP CH2 1 1 3 1397 1 1 25 TRP CZ2 C 8.543 7.405 0.849 1.00 . A A . 31 TRP CZ2 1 1 3 1398 1 1 25 TRP CZ3 C 7.481 5.304 0.341 1.00 . A A . 31 TRP CZ3 1 1 3 1399 1 1 25 TRP H H 11.252 1.414 0.362 1.00 . A A . 31 TRP H 1 1 3 1400 1 1 25 TRP HA H 13.490 3.093 0.819 1.00 . A A . 31 TRP HA 1 1 3 1401 1 1 25 TRP HB2 H 12.623 3.972 -1.072 1.00 . A A . 31 TRP HB2 1 1 3 1402 1 1 25 TRP HB3 H 11.059 3.208 -0.781 1.00 . A A . 31 TRP HB3 1 1 3 1403 1 1 25 TRP HD1 H 12.994 6.418 0.202 1.00 . A A . 31 TRP HD1 1 1 3 1404 1 1 25 TRP HE1 H 11.277 8.225 0.849 1.00 . A A . 31 TRP HE1 1 1 3 1405 1 1 25 TRP HE3 H 8.723 3.663 -0.226 1.00 . A A . 31 TRP HE3 1 1 3 1406 1 1 25 TRP HH2 H 6.446 7.078 0.929 1.00 . A A . 31 TRP HH2 1 1 3 1407 1 1 25 TRP HZ2 H 8.476 8.431 1.163 1.00 . A A . 31 TRP HZ2 1 1 3 1408 1 1 25 TRP HZ3 H 6.570 4.738 0.258 1.00 . A A . 31 TRP HZ3 1 1 3 1409 1 1 25 TRP N N 11.954 1.723 0.972 1.00 . A A . 31 TRP N 1 1 3 1410 1 1 25 TRP NE1 N 11.036 7.305 0.612 1.00 . A A . 31 TRP NE1 1 1 3 1411 1 1 25 TRP O O 12.864 4.415 2.860 1.00 . A A . 31 TRP O 1 1 3 1412 1 1 26 LEU C C 10.854 4.338 4.796 1.00 . A A . 32 LEU C 1 1 3 1413 1 1 26 LEU CA C 10.180 4.765 3.489 1.00 . A A . 32 LEU CA 1 1 3 1414 1 1 26 LEU CB C 8.629 4.659 3.545 1.00 . A A . 32 LEU CB 1 1 3 1415 1 1 26 LEU CD1 C 8.392 2.324 4.382 1.00 . A A . 32 LEU CD1 1 1 3 1416 1 1 26 LEU CD2 C 8.468 4.238 6.020 1.00 . A A . 32 LEU CD2 1 1 3 1417 1 1 26 LEU CG C 8.033 3.775 4.640 1.00 . A A . 32 LEU CG 1 1 3 1418 1 1 26 LEU H H 10.076 3.587 1.738 1.00 . A A . 32 LEU H 1 1 3 1419 1 1 26 LEU HA H 10.439 5.798 3.311 1.00 . A A . 32 LEU HA 1 1 3 1420 1 1 26 LEU HB2 H 8.227 5.653 3.671 1.00 . A A . 32 LEU HB2 1 1 3 1421 1 1 26 LEU HB3 H 8.275 4.279 2.588 1.00 . A A . 32 LEU HB3 1 1 3 1422 1 1 26 LEU HD11 H 8.543 2.181 3.318 1.00 . A A . 32 LEU HD11 1 1 3 1423 1 1 26 LEU HD12 H 9.295 2.076 4.909 1.00 . A A . 32 LEU HD12 1 1 3 1424 1 1 26 LEU HD13 H 7.588 1.688 4.718 1.00 . A A . 32 LEU HD13 1 1 3 1425 1 1 26 LEU HD21 H 8.846 5.249 5.950 1.00 . A A . 32 LEU HD21 1 1 3 1426 1 1 26 LEU HD22 H 7.622 4.216 6.689 1.00 . A A . 32 LEU HD22 1 1 3 1427 1 1 26 LEU HD23 H 9.242 3.585 6.394 1.00 . A A . 32 LEU HD23 1 1 3 1428 1 1 26 LEU HG H 6.961 3.854 4.599 1.00 . A A . 32 LEU HG 1 1 3 1429 1 1 26 LEU N N 10.703 4.004 2.364 1.00 . A A . 32 LEU N 1 1 3 1430 1 1 26 LEU O O 10.987 5.137 5.723 1.00 . A A . 32 LEU O 1 1 3 1431 1 1 27 VAL C C 13.473 2.808 5.977 1.00 . A A . 33 VAL C 1 1 3 1432 1 1 27 VAL CA C 11.965 2.576 6.055 1.00 . A A . 33 VAL CA 1 1 3 1433 1 1 27 VAL CB C 11.683 1.069 6.267 1.00 . A A . 33 VAL CB 1 1 3 1434 1 1 27 VAL CG1 C 12.683 0.453 7.239 1.00 . A A . 33 VAL CG1 1 1 3 1435 1 1 27 VAL CG2 C 10.260 0.857 6.763 1.00 . A A . 33 VAL CG2 1 1 3 1436 1 1 27 VAL H H 11.175 2.493 4.089 1.00 . A A . 33 VAL H 1 1 3 1437 1 1 27 VAL HA H 11.575 3.115 6.907 1.00 . A A . 33 VAL HA 1 1 3 1438 1 1 27 VAL HB H 11.787 0.567 5.316 1.00 . A A . 33 VAL HB 1 1 3 1439 1 1 27 VAL HG11 H 12.821 1.115 8.082 1.00 . A A . 33 VAL HG11 1 1 3 1440 1 1 27 VAL HG12 H 12.308 -0.499 7.587 1.00 . A A . 33 VAL HG12 1 1 3 1441 1 1 27 VAL HG13 H 13.629 0.306 6.739 1.00 . A A . 33 VAL HG13 1 1 3 1442 1 1 27 VAL HG21 H 9.838 1.804 7.066 1.00 . A A . 33 VAL HG21 1 1 3 1443 1 1 27 VAL HG22 H 9.661 0.434 5.971 1.00 . A A . 33 VAL HG22 1 1 3 1444 1 1 27 VAL HG23 H 10.267 0.182 7.607 1.00 . A A . 33 VAL HG23 1 1 3 1445 1 1 27 VAL N N 11.295 3.085 4.861 1.00 . A A . 33 VAL N 1 1 3 1446 1 1 27 VAL O O 14.116 3.108 6.983 1.00 . A A . 33 VAL O 1 1 3 1447 1 1 28 ARG C C 15.769 4.249 4.049 1.00 . A A . 34 ARG C 1 1 3 1448 1 1 28 ARG CA C 15.466 2.852 4.581 1.00 . A A . 34 ARG CA 1 1 3 1449 1 1 28 ARG CB C 16.011 1.798 3.617 1.00 . A A . 34 ARG CB 1 1 3 1450 1 1 28 ARG CD C 18.210 2.575 2.681 1.00 . A A . 34 ARG CD 1 1 3 1451 1 1 28 ARG CG C 17.523 1.649 3.672 1.00 . A A . 34 ARG CG 1 1 3 1452 1 1 28 ARG CZ C 19.583 1.085 1.279 1.00 . A A . 34 ARG CZ 1 1 3 1453 1 1 28 ARG H H 13.471 2.419 4.015 1.00 . A A . 34 ARG H 1 1 3 1454 1 1 28 ARG HA H 15.950 2.733 5.539 1.00 . A A . 34 ARG HA 1 1 3 1455 1 1 28 ARG HB2 H 15.568 0.843 3.857 1.00 . A A . 34 ARG HB2 1 1 3 1456 1 1 28 ARG HB3 H 15.734 2.071 2.609 1.00 . A A . 34 ARG HB3 1 1 3 1457 1 1 28 ARG HD2 H 17.552 3.404 2.467 1.00 . A A . 34 ARG HD2 1 1 3 1458 1 1 28 ARG HD3 H 19.121 2.946 3.128 1.00 . A A . 34 ARG HD3 1 1 3 1459 1 1 28 ARG HE H 17.947 2.049 0.664 1.00 . A A . 34 ARG HE 1 1 3 1460 1 1 28 ARG HG2 H 17.862 1.889 4.668 1.00 . A A . 34 ARG HG2 1 1 3 1461 1 1 28 ARG HG3 H 17.783 0.627 3.436 1.00 . A A . 34 ARG HG3 1 1 3 1462 1 1 28 ARG HH11 H 20.239 1.284 3.182 1.00 . A A . 34 ARG HH11 1 1 3 1463 1 1 28 ARG HH12 H 21.188 0.243 2.175 1.00 . A A . 34 ARG HH12 1 1 3 1464 1 1 28 ARG HH21 H 19.193 0.680 -0.662 1.00 . A A . 34 ARG HH21 1 1 3 1465 1 1 28 ARG HH22 H 20.594 -0.100 -0.008 1.00 . A A . 34 ARG HH22 1 1 3 1466 1 1 28 ARG N N 14.033 2.663 4.781 1.00 . A A . 34 ARG N 1 1 3 1467 1 1 28 ARG NE N 18.537 1.895 1.431 1.00 . A A . 34 ARG NE 1 1 3 1468 1 1 28 ARG NH1 N 20.404 0.852 2.295 1.00 . A A . 34 ARG NH1 1 1 3 1469 1 1 28 ARG NH2 N 19.809 0.508 0.107 1.00 . A A . 34 ARG NH2 1 1 3 1470 1 1 28 ARG O O 15.335 4.616 2.957 1.00 . A A . 34 ARG O 1 1 3 1471 1 1 29 GLY C C 16.071 7.430 5.141 1.00 . A A . 35 GLY C 1 1 3 1472 1 1 29 GLY CA C 16.874 6.368 4.416 1.00 . A A . 35 GLY CA 1 1 3 1473 1 1 29 GLY H H 16.840 4.674 5.685 1.00 . A A . 35 GLY H 1 1 3 1474 1 1 29 GLY HA2 H 17.923 6.529 4.616 1.00 . A A . 35 GLY HA2 1 1 3 1475 1 1 29 GLY HA3 H 16.702 6.465 3.354 1.00 . A A . 35 GLY HA3 1 1 3 1476 1 1 29 GLY N N 16.520 5.022 4.827 1.00 . A A . 35 GLY N 1 1 3 1477 1 1 29 GLY O O 16.576 8.517 5.421 1.00 . A A . 35 GLY O 1 1 3 1478 1 1 30 ARG C C 13.912 7.767 7.633 1.00 . A A . 36 ARG C 1 1 3 1479 1 1 30 ARG CA C 13.940 8.055 6.136 1.00 . A A . 36 ARG CA 1 1 3 1480 1 1 30 ARG CB C 12.524 7.980 5.563 1.00 . A A . 36 ARG CB 1 1 3 1481 1 1 30 ARG CD C 13.174 7.841 3.139 1.00 . A A . 36 ARG CD 1 1 3 1482 1 1 30 ARG CG C 12.391 8.614 4.188 1.00 . A A . 36 ARG CG 1 1 3 1483 1 1 30 ARG CZ C 14.312 9.698 1.986 1.00 . A A . 36 ARG CZ 1 1 3 1484 1 1 30 ARG H H 14.468 6.236 5.191 1.00 . A A . 36 ARG H 1 1 3 1485 1 1 30 ARG HA H 14.329 9.049 5.978 1.00 . A A . 36 ARG HA 1 1 3 1486 1 1 30 ARG HB2 H 12.233 6.943 5.487 1.00 . A A . 36 ARG HB2 1 1 3 1487 1 1 30 ARG HB3 H 11.848 8.486 6.236 1.00 . A A . 36 ARG HB3 1 1 3 1488 1 1 30 ARG HD2 H 13.483 6.896 3.560 1.00 . A A . 36 ARG HD2 1 1 3 1489 1 1 30 ARG HD3 H 12.532 7.662 2.291 1.00 . A A . 36 ARG HD3 1 1 3 1490 1 1 30 ARG HE H 15.234 8.201 2.929 1.00 . A A . 36 ARG HE 1 1 3 1491 1 1 30 ARG HG2 H 11.349 8.628 3.907 1.00 . A A . 36 ARG HG2 1 1 3 1492 1 1 30 ARG HG3 H 12.767 9.626 4.232 1.00 . A A . 36 ARG HG3 1 1 3 1493 1 1 30 ARG HH11 H 12.293 9.777 1.910 1.00 . A A . 36 ARG HH11 1 1 3 1494 1 1 30 ARG HH12 H 13.117 11.073 1.110 1.00 . A A . 36 ARG HH12 1 1 3 1495 1 1 30 ARG HH21 H 16.320 9.904 1.880 1.00 . A A . 36 ARG HH21 1 1 3 1496 1 1 30 ARG HH22 H 15.403 11.146 1.093 1.00 . A A . 36 ARG HH22 1 1 3 1497 1 1 30 ARG N N 14.815 7.117 5.442 1.00 . A A . 36 ARG N 1 1 3 1498 1 1 30 ARG NE N 14.358 8.570 2.691 1.00 . A A . 36 ARG NE 1 1 3 1499 1 1 30 ARG NH1 N 13.144 10.225 1.640 1.00 . A A . 36 ARG NH1 1 1 3 1500 1 1 30 ARG NH2 N 15.437 10.298 1.623 1.00 . A A . 36 ARG NH2 1 1 3 1501 1 1 30 ARG O O 14.051 6.620 8.058 1.00 . A A . 36 ARG O 1 1 3 1502 1 1 31 GLY C C 13.627 9.979 10.603 1.00 . A A . 37 GLY C 1 1 3 1503 1 1 31 GLY CA C 13.687 8.653 9.871 1.00 . A A . 37 GLY CA 1 1 3 1504 1 1 31 GLY H H 13.624 9.707 8.035 1.00 . A A . 37 GLY H 1 1 3 1505 1 1 31 GLY HA2 H 12.815 8.071 10.130 1.00 . A A . 37 GLY HA2 1 1 3 1506 1 1 31 GLY HA3 H 14.570 8.119 10.188 1.00 . A A . 37 GLY HA3 1 1 3 1507 1 1 31 GLY N N 13.730 8.816 8.429 1.00 . A A . 37 GLY N 1 1 3 1508 1 1 31 GLY O O 13.678 11.031 9.932 1.00 . A A . 37 GLY O 1 1 3 1509 1 1 31 GLY OXT O 13.527 9.965 11.848 1.00 . A A . 37 GLY OXT 1 1 3 1510 2 2 1 . C02 C 3.626 2.125 3.959 1.00 . B A . 1038 D6M C02 1 1 3 1511 2 2 1 . C04 C 2.060 0.264 3.818 1.00 . B A . 1038 D6M C04 1 1 3 1512 2 2 1 . C05 C 2.100 -1.032 3.006 1.00 . B A . 1038 D6M C05 1 1 3 1513 2 2 1 . C06 C 3.242 -1.959 3.391 1.00 . B A . 1038 D6M C06 1 1 3 1514 2 2 1 . C07 C 2.890 -3.424 3.219 1.00 . B A . 1038 D6M C07 1 1 3 1515 2 2 1 . C09 C 1.425 0.003 5.180 1.00 . B A . 1038 D6M C09 1 1 3 1516 2 2 1 . C12 C 5.027 2.686 4.100 1.00 . B A . 1038 D6M C12 1 1 3 1517 2 2 1 . C13 C 5.563 3.275 2.802 1.00 . B A . 1038 D6M C13 1 1 3 1518 2 2 1 . C14 C 4.859 4.576 2.443 1.00 . B A . 1038 D6M C14 1 1 3 1519 2 2 1 . C15 C 5.253 5.713 3.374 1.00 . B A . 1038 D6M C15 1 1 3 1520 2 2 1 . C16 C 4.120 6.072 4.322 1.00 . B A . 1038 D6M C16 1 1 3 1521 2 2 1 . C17 C 4.645 6.591 5.652 1.00 . B A . 1038 D6M C17 1 1 3 1522 2 2 1 . C18 C 5.269 5.479 6.481 1.00 . B A . 1038 D6M C18 1 1 3 1523 2 2 1 . C19 C 4.217 4.520 7.015 1.00 . B A . 1038 D6M C19 1 1 3 1524 2 2 1 . C20 C 4.848 3.247 7.556 1.00 . B A . 1038 D6M C20 1 1 3 1525 2 2 1 . C21 C 5.633 3.514 8.830 1.00 . B A . 1038 D6M C21 1 1 3 1526 2 2 1 . C22 C 6.469 2.309 9.232 1.00 . B A . 1038 D6M C22 1 1 3 1527 2 2 1 . C23 C 7.895 2.423 8.717 1.00 . B A . 1038 D6M C23 1 1 3 1528 2 2 1 . C24 C 8.902 1.953 9.755 1.00 . B A . 1038 D6M C24 1 1 3 1529 2 2 1 . C25 C 9.311 3.084 10.685 1.00 . B A . 1038 D6M C25 1 1 3 1530 2 2 1 . C26 C 9.866 2.560 11.992 1.00 . B A . 1038 D6M C26 1 1 3 1531 2 2 1 . H03 H 4.145 0.207 4.175 1.00 . B A . 1038 D6M H03 1 1 3 1532 2 2 1 . H04 H 1.462 0.991 3.289 1.00 . B A . 1038 D6M H04 1 1 3 1533 2 2 1 . HP21 H 5.684 1.891 4.417 1.00 . B A . 1038 D6M HP21 1 1 3 1534 2 2 1 . HP22 H 5.013 3.461 4.852 1.00 . B A . 1038 D6M HP22 1 1 3 1535 2 2 1 . HP31 H 5.419 2.563 2.010 1.00 . B A . 1038 D6M HP31 1 1 3 1536 2 2 1 . HP32 H 6.612 3.468 2.909 1.00 . B A . 1038 D6M HP32 1 1 3 1537 2 2 1 . HP41 H 3.791 4.424 2.506 1.00 . B A . 1038 D6M HP41 1 1 3 1538 2 2 1 . HP42 H 5.123 4.847 1.431 1.00 . B A . 1038 D6M HP42 1 1 3 1539 2 2 1 . HP51 H 5.502 6.580 2.780 1.00 . B A . 1038 D6M HP51 1 1 3 1540 2 2 1 . HP52 H 6.112 5.413 3.952 1.00 . B A . 1038 D6M HP52 1 1 3 1541 2 2 1 . HP61 H 3.520 5.192 4.500 1.00 . B A . 1038 D6M HP61 1 1 3 1542 2 2 1 . HP62 H 3.511 6.838 3.865 1.00 . B A . 1038 D6M HP62 1 1 3 1543 2 2 1 . HP71 H 3.825 7.024 6.206 1.00 . B A . 1038 D6M HP71 1 1 3 1544 2 2 1 . HP72 H 5.392 7.346 5.463 1.00 . B A . 1038 D6M HP72 1 1 3 1545 2 2 1 . HP81 H 5.798 5.919 7.314 1.00 . B A . 1038 D6M HP81 1 1 3 1546 2 2 1 . HP82 H 5.961 4.928 5.864 1.00 . B A . 1038 D6M HP82 1 1 3 1547 2 2 1 . HP91 H 3.538 4.264 6.216 1.00 . B A . 1038 D6M HP91 1 1 3 1548 2 2 1 . HP92 H 3.672 5.006 7.811 1.00 . B A . 1038 D6M HP92 1 1 3 1549 2 2 1 . HPA1 H 5.516 2.842 6.809 1.00 . B A . 1038 D6M HPA1 1 1 3 1550 2 2 1 . HPA2 H 4.068 2.532 7.769 1.00 . B A . 1038 D6M HPA2 1 1 3 1551 2 2 1 . HPB1 H 4.941 3.743 9.626 1.00 . B A . 1038 D6M HPB1 1 1 3 1552 2 2 1 . HPB2 H 6.289 4.355 8.667 1.00 . B A . 1038 D6M HPB2 1 1 3 1553 2 2 1 . HPC1 H 6.018 1.417 8.823 1.00 . B A . 1038 D6M HPC1 1 1 3 1554 2 2 1 . HPC2 H 6.490 2.242 10.310 1.00 . B A . 1038 D6M HPC2 1 1 3 1555 2 2 1 . HPD1 H 8.098 3.455 8.473 1.00 . B A . 1038 D6M HPD1 1 1 3 1556 2 2 1 . HPD2 H 7.997 1.814 7.831 1.00 . B A . 1038 D6M HPD2 1 1 3 1557 2 2 1 . HPE1 H 9.779 1.580 9.247 1.00 . B A . 1038 D6M HPE1 1 1 3 1558 2 2 1 . HPE2 H 8.458 1.162 10.341 1.00 . B A . 1038 D6M HPE2 1 1 3 1559 2 2 1 . HPF1 H 8.448 3.698 10.898 1.00 . B A . 1038 D6M HPF1 1 1 3 1560 2 2 1 . HPF2 H 10.073 3.679 10.205 1.00 . B A . 1038 D6M HPF2 1 1 3 1561 2 2 1 . HPG1 H 10.931 2.408 11.896 1.00 . B A . 1038 D6M HPG1 1 1 3 1562 2 2 1 . HPG2 H 9.388 1.623 12.236 1.00 . B A . 1038 D6M HPG2 1 1 3 1563 2 2 1 . HPG3 H 9.674 3.277 12.777 1.00 . B A . 1038 D6M HPG3 1 1 3 1564 2 2 1 . HQ21 H 4.097 -1.735 2.770 1.00 . B A . 1038 D6M HQ21 1 1 3 1565 2 2 1 . HQ22 H 3.496 -1.785 4.426 1.00 . B A . 1038 D6M HQ22 1 1 3 1566 2 2 1 . HQ31 H 1.171 -1.562 3.151 1.00 . B A . 1038 D6M HQ31 1 1 3 1567 2 2 1 . HQ32 H 2.204 -0.785 1.959 1.00 . B A . 1038 D6M HQ32 1 1 3 1568 2 2 1 . N03 N 3.404 0.813 3.967 1.00 . B A . 1038 D6M N03 1 1 3 1569 2 2 1 . O01 O 2.692 2.915 3.824 1.00 . B A . 1038 D6M O01 1 1 3 1570 2 2 1 . O08 O 2.486 -4.045 4.203 1.00 . B A . 1038 D6M O08 1 1 3 1571 2 2 1 . O10 O 0.231 -0.361 5.215 1.00 . B A . 1038 D6M O10 1 1 3 1572 2 2 1 . O11 O 2.127 0.166 6.200 1.00 . B A . 1038 D6M O11 1 1 4 1573 1 1 1 HIS C C -27.916 -1.570 2.080 1.00 . A A . 7 HIS C 1 1 4 1574 1 1 1 HIS CA C -28.701 -2.841 2.386 1.00 . A A . 7 HIS CA 1 1 4 1575 1 1 1 HIS CB C -27.802 -3.859 3.091 1.00 . A A . 7 HIS CB 1 1 4 1576 1 1 1 HIS CD2 C -29.450 -4.448 5.006 1.00 . A A . 7 HIS CD2 1 1 4 1577 1 1 1 HIS CE1 C -29.144 -6.619 5.036 1.00 . A A . 7 HIS CE1 1 1 4 1578 1 1 1 HIS CG C -28.538 -4.743 4.050 1.00 . A A . 7 HIS CG 1 1 4 1579 1 1 1 HIS H1 H -29.609 -2.696 0.546 1.00 . A A . 7 HIS H1 1 1 4 1580 1 1 1 HIS H2 H -28.443 -3.946 0.669 1.00 . A A . 7 HIS H2 1 1 4 1581 1 1 1 HIS H3 H -29.978 -4.129 1.415 1.00 . A A . 7 HIS H3 1 1 4 1582 1 1 1 HIS HA H -29.533 -2.596 3.029 1.00 . A A . 7 HIS HA 1 1 4 1583 1 1 1 HIS HB2 H -27.335 -4.491 2.350 1.00 . A A . 7 HIS HB2 1 1 4 1584 1 1 1 HIS HB3 H -27.037 -3.333 3.642 1.00 . A A . 7 HIS HB3 1 1 4 1585 1 1 1 HIS HD1 H -27.768 -6.633 3.522 1.00 . A A . 7 HIS HD1 1 1 4 1586 1 1 1 HIS HD2 H -29.825 -3.465 5.253 1.00 . A A . 7 HIS HD2 1 1 4 1587 1 1 1 HIS HE1 H -29.220 -7.664 5.297 1.00 . A A . 7 HIS HE1 1 1 4 1588 1 1 1 HIS HE2 H -30.390 -5.718 6.389 1.00 . A A . 7 HIS HE2 1 1 4 1589 1 1 1 HIS N N -29.230 -3.459 1.142 1.00 . A A . 7 HIS N 1 1 4 1590 1 1 1 HIS ND1 N -28.368 -6.111 4.095 1.00 . A A . 7 HIS ND1 1 1 4 1591 1 1 1 HIS NE2 N -29.810 -5.631 5.604 1.00 . A A . 7 HIS NE2 1 1 4 1592 1 1 1 HIS O O -27.132 -1.525 1.132 1.00 . A A . 7 HIS O 1 1 4 1593 1 1 2 ALA C C -26.364 0.933 3.757 1.00 . A A . 8 ALA C 1 1 4 1594 1 1 2 ALA CA C -27.448 0.736 2.703 1.00 . A A . 8 ALA CA 1 1 4 1595 1 1 2 ALA CB C -28.445 1.883 2.748 1.00 . A A . 8 ALA CB 1 1 4 1596 1 1 2 ALA H H -28.772 -0.634 3.625 1.00 . A A . 8 ALA H 1 1 4 1597 1 1 2 ALA HA H -26.988 0.728 1.725 1.00 . A A . 8 ALA HA 1 1 4 1598 1 1 2 ALA HB1 H -29.434 1.510 2.525 1.00 . A A . 8 ALA HB1 1 1 4 1599 1 1 2 ALA HB2 H -28.441 2.325 3.733 1.00 . A A . 8 ALA HB2 1 1 4 1600 1 1 2 ALA HB3 H -28.169 2.630 2.018 1.00 . A A . 8 ALA HB3 1 1 4 1601 1 1 2 ALA N N -28.134 -0.537 2.887 1.00 . A A . 8 ALA N 1 1 4 1602 1 1 2 ALA O O -26.655 1.261 4.907 1.00 . A A . 8 ALA O 1 1 4 1603 1 1 3 GLU C C -22.725 1.290 3.507 1.00 . A A . 9 GLU C 1 1 4 1604 1 1 3 GLU CA C -23.985 0.885 4.267 1.00 . A A . 9 GLU CA 1 1 4 1605 1 1 3 GLU CB C -23.736 -0.416 5.032 1.00 . A A . 9 GLU CB 1 1 4 1606 1 1 3 GLU CD C -23.152 -2.870 4.915 1.00 . A A . 9 GLU CD 1 1 4 1607 1 1 3 GLU CG C -23.347 -1.582 4.139 1.00 . A A . 9 GLU CG 1 1 4 1608 1 1 3 GLU H H -24.945 0.470 2.427 1.00 . A A . 9 GLU H 1 1 4 1609 1 1 3 GLU HA H -24.232 1.665 4.971 1.00 . A A . 9 GLU HA 1 1 4 1610 1 1 3 GLU HB2 H -22.941 -0.254 5.745 1.00 . A A . 9 GLU HB2 1 1 4 1611 1 1 3 GLU HB3 H -24.637 -0.683 5.566 1.00 . A A . 9 GLU HB3 1 1 4 1612 1 1 3 GLU HG2 H -24.127 -1.735 3.408 1.00 . A A . 9 GLU HG2 1 1 4 1613 1 1 3 GLU HG3 H -22.424 -1.340 3.634 1.00 . A A . 9 GLU HG3 1 1 4 1614 1 1 3 GLU N N -25.113 0.730 3.357 1.00 . A A . 9 GLU N 1 1 4 1615 1 1 3 GLU O O -22.550 0.935 2.342 1.00 . A A . 9 GLU O 1 1 4 1616 1 1 3 GLU OE1 O -24.030 -3.207 5.737 1.00 . A A . 9 GLU OE1 1 1 4 1617 1 1 3 GLU OE2 O -22.121 -3.542 4.701 1.00 . A A . 9 GLU OE2 1 1 4 1618 1 1 4 GLY C C -19.458 1.546 3.833 1.00 . A A . 10 GLY C 1 1 4 1619 1 1 4 GLY CA C -20.620 2.476 3.548 1.00 . A A . 10 GLY CA 1 1 4 1620 1 1 4 GLY H H -22.045 2.289 5.103 1.00 . A A . 10 GLY H 1 1 4 1621 1 1 4 GLY HA2 H -20.772 2.528 2.480 1.00 . A A . 10 GLY HA2 1 1 4 1622 1 1 4 GLY HA3 H -20.375 3.462 3.914 1.00 . A A . 10 GLY HA3 1 1 4 1623 1 1 4 GLY N N -21.852 2.036 4.176 1.00 . A A . 10 GLY N 1 1 4 1624 1 1 4 GLY O O -19.569 0.636 4.654 1.00 . A A . 10 GLY O 1 1 4 1625 1 1 5 THR C C -15.895 1.702 2.910 1.00 . A A . 11 THR C 1 1 4 1626 1 1 5 THR CA C -17.151 0.949 3.335 1.00 . A A . 11 THR CA 1 1 4 1627 1 1 5 THR CB C -17.277 -0.348 2.535 1.00 . A A . 11 THR CB 1 1 4 1628 1 1 5 THR CG2 C -17.360 -0.124 1.040 1.00 . A A . 11 THR CG2 1 1 4 1629 1 1 5 THR H H -18.313 2.514 2.511 1.00 . A A . 11 THR H 1 1 4 1630 1 1 5 THR HA H -17.074 0.708 4.385 1.00 . A A . 11 THR HA 1 1 4 1631 1 1 5 THR HB H -18.176 -0.863 2.842 1.00 . A A . 11 THR HB 1 1 4 1632 1 1 5 THR HG1 H -16.019 -1.262 3.727 1.00 . A A . 11 THR HG1 1 1 4 1633 1 1 5 THR HG21 H -18.026 0.702 0.837 1.00 . A A . 11 THR HG21 1 1 4 1634 1 1 5 THR HG22 H -16.377 0.103 0.655 1.00 . A A . 11 THR HG22 1 1 4 1635 1 1 5 THR HG23 H -17.737 -1.016 0.563 1.00 . A A . 11 THR HG23 1 1 4 1636 1 1 5 THR N N -18.339 1.774 3.152 1.00 . A A . 11 THR N 1 1 4 1637 1 1 5 THR O O -15.948 2.583 2.052 1.00 . A A . 11 THR O 1 1 4 1638 1 1 5 THR OG1 O -16.171 -1.198 2.781 1.00 . A A . 11 THR OG1 1 1 4 1639 1 1 6 PHE C C -12.380 0.965 3.050 1.00 . A A . 12 PHE C 1 1 4 1640 1 1 6 PHE CA C -13.496 1.995 3.202 1.00 . A A . 12 PHE CA 1 1 4 1641 1 1 6 PHE CB C -13.129 3.005 4.291 1.00 . A A . 12 PHE CB 1 1 4 1642 1 1 6 PHE CD1 C -13.893 1.777 6.343 1.00 . A A . 12 PHE CD1 1 1 4 1643 1 1 6 PHE CD2 C -11.594 2.389 6.179 1.00 . A A . 12 PHE CD2 1 1 4 1644 1 1 6 PHE CE1 C -13.654 1.199 7.575 1.00 . A A . 12 PHE CE1 1 1 4 1645 1 1 6 PHE CE2 C -11.349 1.813 7.411 1.00 . A A . 12 PHE CE2 1 1 4 1646 1 1 6 PHE CG C -12.867 2.378 5.631 1.00 . A A . 12 PHE CG 1 1 4 1647 1 1 6 PHE CZ C -12.381 1.218 8.110 1.00 . A A . 12 PHE CZ 1 1 4 1648 1 1 6 PHE H H -14.789 0.642 4.194 1.00 . A A . 12 PHE H 1 1 4 1649 1 1 6 PHE HA H -13.615 2.519 2.266 1.00 . A A . 12 PHE HA 1 1 4 1650 1 1 6 PHE HB2 H -12.237 3.536 3.994 1.00 . A A . 12 PHE HB2 1 1 4 1651 1 1 6 PHE HB3 H -13.940 3.710 4.406 1.00 . A A . 12 PHE HB3 1 1 4 1652 1 1 6 PHE HD1 H -14.889 1.762 5.925 1.00 . A A . 12 PHE HD1 1 1 4 1653 1 1 6 PHE HD2 H -10.787 2.855 5.633 1.00 . A A . 12 PHE HD2 1 1 4 1654 1 1 6 PHE HE1 H -14.463 0.735 8.120 1.00 . A A . 12 PHE HE1 1 1 4 1655 1 1 6 PHE HE2 H -10.352 1.829 7.826 1.00 . A A . 12 PHE HE2 1 1 4 1656 1 1 6 PHE HZ H -12.192 0.767 9.073 1.00 . A A . 12 PHE HZ 1 1 4 1657 1 1 6 PHE N N -14.766 1.351 3.518 1.00 . A A . 12 PHE N 1 1 4 1658 1 1 6 PHE O O -11.564 1.053 2.132 1.00 . A A . 12 PHE O 1 1 4 1659 1 1 7 THR C C -11.156 -1.627 2.523 1.00 . A A . 13 THR C 1 1 4 1660 1 1 7 THR CA C -11.332 -1.059 3.929 1.00 . A A . 13 THR CA 1 1 4 1661 1 1 7 THR CB C -11.706 -2.181 4.898 1.00 . A A . 13 THR CB 1 1 4 1662 1 1 7 THR CG2 C -13.003 -2.873 4.541 1.00 . A A . 13 THR CG2 1 1 4 1663 1 1 7 THR H H -13.027 -0.023 4.664 1.00 . A A . 13 THR H 1 1 4 1664 1 1 7 THR HA H -10.398 -0.621 4.245 1.00 . A A . 13 THR HA 1 1 4 1665 1 1 7 THR HB H -11.815 -1.765 5.890 1.00 . A A . 13 THR HB 1 1 4 1666 1 1 7 THR HG1 H -10.603 -3.574 4.074 1.00 . A A . 13 THR HG1 1 1 4 1667 1 1 7 THR HG21 H -13.753 -2.132 4.304 1.00 . A A . 13 THR HG21 1 1 4 1668 1 1 7 THR HG22 H -12.846 -3.513 3.685 1.00 . A A . 13 THR HG22 1 1 4 1669 1 1 7 THR HG23 H -13.337 -3.467 5.379 1.00 . A A . 13 THR HG23 1 1 4 1670 1 1 7 THR N N -12.350 -0.009 3.956 1.00 . A A . 13 THR N 1 1 4 1671 1 1 7 THR O O -10.073 -2.084 2.159 1.00 . A A . 13 THR O 1 1 4 1672 1 1 7 THR OG1 O -10.690 -3.167 4.939 1.00 . A A . 13 THR OG1 1 1 4 1673 1 1 8 SER C C -11.488 -1.123 -0.560 1.00 . A A . 14 SER C 1 1 4 1674 1 1 8 SER CA C -12.187 -2.108 0.373 1.00 . A A . 14 SER CA 1 1 4 1675 1 1 8 SER CB C -13.604 -2.390 -0.131 1.00 . A A . 14 SER CB 1 1 4 1676 1 1 8 SER H H -13.064 -1.220 2.082 1.00 . A A . 14 SER H 1 1 4 1677 1 1 8 SER HA H -11.628 -3.032 0.384 1.00 . A A . 14 SER HA 1 1 4 1678 1 1 8 SER HB2 H -14.298 -1.729 0.366 1.00 . A A . 14 SER HB2 1 1 4 1679 1 1 8 SER HB3 H -13.645 -2.220 -1.197 1.00 . A A . 14 SER HB3 1 1 4 1680 1 1 8 SER HG H -13.312 -4.326 -0.211 1.00 . A A . 14 SER HG 1 1 4 1681 1 1 8 SER N N -12.227 -1.596 1.737 1.00 . A A . 14 SER N 1 1 4 1682 1 1 8 SER O O -10.605 -1.502 -1.329 1.00 . A A . 14 SER O 1 1 4 1683 1 1 8 SER OG O -13.982 -3.730 0.133 1.00 . A A . 14 SER OG 1 1 4 1684 1 1 9 ASP C C -9.842 1.421 -0.954 1.00 . A A . 15 ASP C 1 1 4 1685 1 1 9 ASP CA C -11.302 1.180 -1.324 1.00 . A A . 15 ASP CA 1 1 4 1686 1 1 9 ASP CB C -12.095 2.482 -1.189 1.00 . A A . 15 ASP CB 1 1 4 1687 1 1 9 ASP CG C -13.588 2.267 -1.338 1.00 . A A . 15 ASP CG 1 1 4 1688 1 1 9 ASP H H -12.598 0.382 0.147 1.00 . A A . 15 ASP H 1 1 4 1689 1 1 9 ASP HA H -11.351 0.845 -2.349 1.00 . A A . 15 ASP HA 1 1 4 1690 1 1 9 ASP HB2 H -11.907 2.911 -0.217 1.00 . A A . 15 ASP HB2 1 1 4 1691 1 1 9 ASP HB3 H -11.770 3.174 -1.953 1.00 . A A . 15 ASP HB3 1 1 4 1692 1 1 9 ASP N N -11.890 0.141 -0.486 1.00 . A A . 15 ASP N 1 1 4 1693 1 1 9 ASP O O -9.031 1.798 -1.801 1.00 . A A . 15 ASP O 1 1 4 1694 1 1 9 ASP OD1 O -13.997 1.590 -2.305 1.00 . A A . 15 ASP OD1 1 1 4 1695 1 1 9 ASP OD2 O -14.349 2.777 -0.489 1.00 . A A . 15 ASP OD2 1 1 4 1696 1 1 10 VAL C C -7.161 0.517 0.034 1.00 . A A . 16 VAL C 1 1 4 1697 1 1 10 VAL CA C -8.150 1.396 0.795 1.00 . A A . 16 VAL CA 1 1 4 1698 1 1 10 VAL CB C -8.037 1.089 2.301 1.00 . A A . 16 VAL CB 1 1 4 1699 1 1 10 VAL CG1 C -6.653 1.452 2.818 1.00 . A A . 16 VAL CG1 1 1 4 1700 1 1 10 VAL CG2 C -9.118 1.826 3.079 1.00 . A A . 16 VAL CG2 1 1 4 1701 1 1 10 VAL H H -10.203 0.903 0.943 1.00 . A A . 16 VAL H 1 1 4 1702 1 1 10 VAL HA H -7.888 2.432 0.641 1.00 . A A . 16 VAL HA 1 1 4 1703 1 1 10 VAL HB H -8.182 0.028 2.442 1.00 . A A . 16 VAL HB 1 1 4 1704 1 1 10 VAL HG11 H -6.399 2.452 2.498 1.00 . A A . 16 VAL HG11 1 1 4 1705 1 1 10 VAL HG12 H -6.649 1.408 3.897 1.00 . A A . 16 VAL HG12 1 1 4 1706 1 1 10 VAL HG13 H -5.928 0.754 2.427 1.00 . A A . 16 VAL HG13 1 1 4 1707 1 1 10 VAL HG21 H -9.652 2.491 2.416 1.00 . A A . 16 VAL HG21 1 1 4 1708 1 1 10 VAL HG22 H -9.808 1.110 3.501 1.00 . A A . 16 VAL HG22 1 1 4 1709 1 1 10 VAL HG23 H -8.664 2.399 3.874 1.00 . A A . 16 VAL HG23 1 1 4 1710 1 1 10 VAL N N -9.513 1.202 0.314 1.00 . A A . 16 VAL N 1 1 4 1711 1 1 10 VAL O O -5.975 0.830 -0.049 1.00 . A A . 16 VAL O 1 1 4 1712 1 1 11 SER C C -6.768 -1.158 -2.748 1.00 . A A . 17 SER C 1 1 4 1713 1 1 11 SER CA C -6.809 -1.513 -1.261 1.00 . A A . 17 SER CA 1 1 4 1714 1 1 11 SER CB C -7.310 -2.947 -1.084 1.00 . A A . 17 SER CB 1 1 4 1715 1 1 11 SER H H -8.607 -0.790 -0.409 1.00 . A A . 17 SER H 1 1 4 1716 1 1 11 SER HA H -5.809 -1.442 -0.862 1.00 . A A . 17 SER HA 1 1 4 1717 1 1 11 SER HB2 H -8.191 -3.096 -1.690 1.00 . A A . 17 SER HB2 1 1 4 1718 1 1 11 SER HB3 H -6.539 -3.636 -1.395 1.00 . A A . 17 SER HB3 1 1 4 1719 1 1 11 SER HG H -6.907 -3.664 0.694 1.00 . A A . 17 SER HG 1 1 4 1720 1 1 11 SER N N -7.654 -0.588 -0.513 1.00 . A A . 17 SER N 1 1 4 1721 1 1 11 SER O O -5.869 -1.588 -3.471 1.00 . A A . 17 SER O 1 1 4 1722 1 1 11 SER OG O -7.638 -3.209 0.270 1.00 . A A . 17 SER OG 1 1 4 1723 1 1 12 SER C C -7.023 1.249 -4.915 1.00 . A A . 18 SER C 1 1 4 1724 1 1 12 SER CA C -7.837 -0.008 -4.610 1.00 . A A . 18 SER CA 1 1 4 1725 1 1 12 SER CB C -9.297 0.214 -5.009 1.00 . A A . 18 SER CB 1 1 4 1726 1 1 12 SER H H -8.455 -0.093 -2.586 1.00 . A A . 18 SER H 1 1 4 1727 1 1 12 SER HA H -7.441 -0.824 -5.195 1.00 . A A . 18 SER HA 1 1 4 1728 1 1 12 SER HB2 H -9.336 0.656 -5.994 1.00 . A A . 18 SER HB2 1 1 4 1729 1 1 12 SER HB3 H -9.814 -0.734 -5.019 1.00 . A A . 18 SER HB3 1 1 4 1730 1 1 12 SER HG H -10.891 1.088 -4.280 1.00 . A A . 18 SER HG 1 1 4 1731 1 1 12 SER N N -7.756 -0.393 -3.204 1.00 . A A . 18 SER N 1 1 4 1732 1 1 12 SER O O -6.580 1.443 -6.047 1.00 . A A . 18 SER O 1 1 4 1733 1 1 12 SER OG O -9.949 1.080 -4.096 1.00 . A A . 18 SER OG 1 1 4 1734 1 1 13 TYR C C -4.618 3.058 -4.438 1.00 . A A . 19 TYR C 1 1 4 1735 1 1 13 TYR CA C -6.086 3.345 -4.121 1.00 . A A . 19 TYR CA 1 1 4 1736 1 1 13 TYR CB C -6.208 4.265 -2.895 1.00 . A A . 19 TYR CB 1 1 4 1737 1 1 13 TYR CD1 C -3.855 4.561 -2.016 1.00 . A A . 19 TYR CD1 1 1 4 1738 1 1 13 TYR CD2 C -5.418 3.372 -0.668 1.00 . A A . 19 TYR CD2 1 1 4 1739 1 1 13 TYR CE1 C -2.880 4.380 -1.054 1.00 . A A . 19 TYR CE1 1 1 4 1740 1 1 13 TYR CE2 C -4.449 3.187 0.300 1.00 . A A . 19 TYR CE2 1 1 4 1741 1 1 13 TYR CG C -5.139 4.060 -1.840 1.00 . A A . 19 TYR CG 1 1 4 1742 1 1 13 TYR CZ C -3.182 3.692 0.102 1.00 . A A . 19 TYR CZ 1 1 4 1743 1 1 13 TYR H H -7.220 1.915 -3.037 1.00 . A A . 19 TYR H 1 1 4 1744 1 1 13 TYR HA H -6.522 3.848 -4.971 1.00 . A A . 19 TYR HA 1 1 4 1745 1 1 13 TYR HB2 H -6.150 5.291 -3.222 1.00 . A A . 19 TYR HB2 1 1 4 1746 1 1 13 TYR HB3 H -7.168 4.098 -2.429 1.00 . A A . 19 TYR HB3 1 1 4 1747 1 1 13 TYR HD1 H -6.411 2.976 -0.516 1.00 . A A . 19 TYR HD1 1 1 4 1748 1 1 13 TYR HD2 H -3.621 5.100 -2.922 1.00 . A A . 19 TYR HD2 1 1 4 1749 1 1 13 TYR HE1 H -4.686 2.648 1.205 1.00 . A A . 19 TYR HE1 1 1 4 1750 1 1 13 TYR HE2 H -1.887 4.776 -1.210 1.00 . A A . 19 TYR HE2 1 1 4 1751 1 1 13 TYR HH H -2.353 4.134 1.780 1.00 . A A . 19 TYR HH 1 1 4 1752 1 1 13 TYR N N -6.838 2.109 -3.918 1.00 . A A . 19 TYR N 1 1 4 1753 1 1 13 TYR O O -3.950 3.856 -5.095 1.00 . A A . 19 TYR O 1 1 4 1754 1 1 13 TYR OH O -2.214 3.510 1.063 1.00 . A A . 19 TYR OH 1 1 4 1755 1 1 14 LEU C C -2.568 0.883 -5.573 1.00 . A A . 20 LEU C 1 1 4 1756 1 1 14 LEU CA C -2.732 1.539 -4.205 1.00 . A A . 20 LEU CA 1 1 4 1757 1 1 14 LEU CB C -2.243 0.588 -3.111 1.00 . A A . 20 LEU CB 1 1 4 1758 1 1 14 LEU CD1 C -3.716 -0.138 -1.215 1.00 . A A . 20 LEU CD1 1 1 4 1759 1 1 14 LEU CD2 C -1.560 1.034 -0.737 1.00 . A A . 20 LEU CD2 1 1 4 1760 1 1 14 LEU CG C -2.734 0.917 -1.698 1.00 . A A . 20 LEU CG 1 1 4 1761 1 1 14 LEU H H -4.699 1.320 -3.449 1.00 . A A . 20 LEU H 1 1 4 1762 1 1 14 LEU HA H -2.136 2.439 -4.179 1.00 . A A . 20 LEU HA 1 1 4 1763 1 1 14 LEU HB2 H -2.568 -0.411 -3.362 1.00 . A A . 20 LEU HB2 1 1 4 1764 1 1 14 LEU HB3 H -1.163 0.605 -3.107 1.00 . A A . 20 LEU HB3 1 1 4 1765 1 1 14 LEU HD11 H -3.344 -1.120 -1.469 1.00 . A A . 20 LEU HD11 1 1 4 1766 1 1 14 LEU HD12 H -3.828 -0.062 -0.144 1.00 . A A . 20 LEU HD12 1 1 4 1767 1 1 14 LEU HD13 H -4.674 0.017 -1.690 1.00 . A A . 20 LEU HD13 1 1 4 1768 1 1 14 LEU HD21 H -0.852 0.243 -0.935 1.00 . A A . 20 LEU HD21 1 1 4 1769 1 1 14 LEU HD22 H -1.078 1.991 -0.872 1.00 . A A . 20 LEU HD22 1 1 4 1770 1 1 14 LEU HD23 H -1.917 0.951 0.279 1.00 . A A . 20 LEU HD23 1 1 4 1771 1 1 14 LEU HG H -3.248 1.867 -1.716 1.00 . A A . 20 LEU HG 1 1 4 1772 1 1 14 LEU N N -4.121 1.918 -3.968 1.00 . A A . 20 LEU N 1 1 4 1773 1 1 14 LEU O O -1.780 1.340 -6.400 1.00 . A A . 20 LEU O 1 1 4 1774 1 1 15 GLU C C -1.858 -1.506 -7.283 1.00 . A A . 21 GLU C 1 1 4 1775 1 1 15 GLU CA C -3.247 -0.914 -7.069 1.00 . A A . 21 GLU CA 1 1 4 1776 1 1 15 GLU CB C -3.601 0.015 -8.232 1.00 . A A . 21 GLU CB 1 1 4 1777 1 1 15 GLU CD C -5.582 0.994 -9.458 1.00 . A A . 21 GLU CD 1 1 4 1778 1 1 15 GLU CG C -4.980 0.644 -8.111 1.00 . A A . 21 GLU CG 1 1 4 1779 1 1 15 GLU H H -3.922 -0.512 -5.102 1.00 . A A . 21 GLU H 1 1 4 1780 1 1 15 GLU HA H -3.966 -1.719 -7.030 1.00 . A A . 21 GLU HA 1 1 4 1781 1 1 15 GLU HB2 H -2.870 0.809 -8.279 1.00 . A A . 21 GLU HB2 1 1 4 1782 1 1 15 GLU HB3 H -3.566 -0.549 -9.152 1.00 . A A . 21 GLU HB3 1 1 4 1783 1 1 15 GLU HG2 H -5.636 -0.052 -7.611 1.00 . A A . 21 GLU HG2 1 1 4 1784 1 1 15 GLU HG3 H -4.899 1.547 -7.523 1.00 . A A . 21 GLU HG3 1 1 4 1785 1 1 15 GLU N N -3.314 -0.193 -5.802 1.00 . A A . 21 GLU N 1 1 4 1786 1 1 15 GLU O O -1.401 -1.648 -8.417 1.00 . A A . 21 GLU O 1 1 4 1787 1 1 15 GLU OE1 O -5.496 0.158 -10.382 1.00 . A A . 21 GLU OE1 1 1 4 1788 1 1 15 GLU OE2 O -6.139 2.104 -9.588 1.00 . A A . 21 GLU OE2 1 1 4 1789 1 1 16 GLY C C 0.865 -2.407 -4.944 1.00 . A A . 22 GLY C 1 1 4 1790 1 1 16 GLY CA C 0.140 -2.419 -6.275 1.00 . A A . 22 GLY CA 1 1 4 1791 1 1 16 GLY H H -1.605 -1.711 -5.308 1.00 . A A . 22 GLY H 1 1 4 1792 1 1 16 GLY HA2 H 0.060 -3.439 -6.621 1.00 . A A . 22 GLY HA2 1 1 4 1793 1 1 16 GLY HA3 H 0.716 -1.852 -6.991 1.00 . A A . 22 GLY HA3 1 1 4 1794 1 1 16 GLY N N -1.191 -1.848 -6.186 1.00 . A A . 22 GLY N 1 1 4 1795 1 1 16 GLY O O 2.026 -2.007 -4.865 1.00 . A A . 22 GLY O 1 1 4 1796 1 1 17 GLN C C 2.004 -3.772 -2.529 1.00 . A A . 23 GLN C 1 1 4 1797 1 1 17 GLN CA C 0.761 -2.886 -2.560 1.00 . A A . 23 GLN CA 1 1 4 1798 1 1 17 GLN CB C -0.266 -3.396 -1.548 1.00 . A A . 23 GLN CB 1 1 4 1799 1 1 17 GLN CD C -0.179 -5.890 -1.154 1.00 . A A . 23 GLN CD 1 1 4 1800 1 1 17 GLN CG C -0.847 -4.755 -1.904 1.00 . A A . 23 GLN CG 1 1 4 1801 1 1 17 GLN H H -0.744 -3.153 -4.023 1.00 . A A . 23 GLN H 1 1 4 1802 1 1 17 GLN HA H 1.045 -1.879 -2.294 1.00 . A A . 23 GLN HA 1 1 4 1803 1 1 17 GLN HB2 H 0.206 -3.473 -0.580 1.00 . A A . 23 GLN HB2 1 1 4 1804 1 1 17 GLN HB3 H -1.077 -2.686 -1.489 1.00 . A A . 23 GLN HB3 1 1 4 1805 1 1 17 GLN HE21 H -1.041 -5.311 0.542 1.00 . A A . 23 GLN HE21 1 1 4 1806 1 1 17 GLN HE22 H -0.022 -6.701 0.655 1.00 . A A . 23 GLN HE22 1 1 4 1807 1 1 17 GLN HG2 H -1.899 -4.756 -1.665 1.00 . A A . 23 GLN HG2 1 1 4 1808 1 1 17 GLN HG3 H -0.720 -4.920 -2.964 1.00 . A A . 23 GLN HG3 1 1 4 1809 1 1 17 GLN N N 0.178 -2.848 -3.896 1.00 . A A . 23 GLN N 1 1 4 1810 1 1 17 GLN NE2 N -0.440 -5.976 0.146 1.00 . A A . 23 GLN NE2 1 1 4 1811 1 1 17 GLN O O 2.897 -3.575 -1.704 1.00 . A A . 23 GLN O 1 1 4 1812 1 1 17 GLN OE1 O 0.564 -6.682 -1.735 1.00 . A A . 23 GLN OE1 1 1 4 1813 1 1 18 ALA C C 4.512 -4.907 -3.564 1.00 . A A . 24 ALA C 1 1 4 1814 1 1 18 ALA CA C 3.189 -5.665 -3.504 1.00 . A A . 24 ALA CA 1 1 4 1815 1 1 18 ALA CB C 3.048 -6.581 -4.712 1.00 . A A . 24 ALA CB 1 1 4 1816 1 1 18 ALA H H 1.312 -4.857 -4.060 1.00 . A A . 24 ALA H 1 1 4 1817 1 1 18 ALA HA H 3.178 -6.279 -2.615 1.00 . A A . 24 ALA HA 1 1 4 1818 1 1 18 ALA HB1 H 2.497 -6.071 -5.488 1.00 . A A . 24 ALA HB1 1 1 4 1819 1 1 18 ALA HB2 H 4.029 -6.844 -5.080 1.00 . A A . 24 ALA HB2 1 1 4 1820 1 1 18 ALA HB3 H 2.519 -7.477 -4.424 1.00 . A A . 24 ALA HB3 1 1 4 1821 1 1 18 ALA N N 2.055 -4.749 -3.430 1.00 . A A . 24 ALA N 1 1 4 1822 1 1 18 ALA O O 5.529 -5.372 -3.052 1.00 . A A . 24 ALA O 1 1 4 1823 1 1 19 ALA C C 5.812 -1.948 -3.140 1.00 . A A . 25 ALA C 1 1 4 1824 1 1 19 ALA CA C 5.684 -2.911 -4.316 1.00 . A A . 25 ALA CA 1 1 4 1825 1 1 19 ALA CB C 5.662 -2.145 -5.630 1.00 . A A . 25 ALA CB 1 1 4 1826 1 1 19 ALA H H 3.646 -3.417 -4.578 1.00 . A A . 25 ALA H 1 1 4 1827 1 1 19 ALA HA H 6.543 -3.567 -4.323 1.00 . A A . 25 ALA HA 1 1 4 1828 1 1 19 ALA HB1 H 5.002 -2.642 -6.325 1.00 . A A . 25 ALA HB1 1 1 4 1829 1 1 19 ALA HB2 H 5.310 -1.139 -5.455 1.00 . A A . 25 ALA HB2 1 1 4 1830 1 1 19 ALA HB3 H 6.660 -2.110 -6.043 1.00 . A A . 25 ALA HB3 1 1 4 1831 1 1 19 ALA N N 4.488 -3.735 -4.192 1.00 . A A . 25 ALA N 1 1 4 1832 1 1 19 ALA O O 6.909 -1.684 -2.657 1.00 . A A . 25 ALA O 1 1 4 1833 1 1 20 LYS C C 5.326 -1.121 -0.319 1.00 . A A . 26 LYS C 1 1 4 1834 1 1 20 LYS CA C 4.680 -0.496 -1.556 1.00 . A A . 26 LYS CA 1 1 4 1835 1 1 20 LYS CB C 3.250 -0.048 -1.241 1.00 . A A . 26 LYS CB 1 1 4 1836 1 1 20 LYS CD C 3.282 1.472 -3.250 1.00 . A A . 26 LYS CD 1 1 4 1837 1 1 20 LYS CE C 4.571 2.259 -3.431 1.00 . A A . 26 LYS CE 1 1 4 1838 1 1 20 LYS CG C 2.912 1.335 -1.780 1.00 . A A . 26 LYS CG 1 1 4 1839 1 1 20 LYS HA H 5.258 0.368 -1.846 1.00 . A A . 26 LYS HA 1 1 4 1840 1 1 20 LYS HB2 H 2.560 -0.758 -1.672 1.00 . A A . 26 LYS HB2 1 1 4 1841 1 1 20 LYS HD2 H 3.411 0.487 -3.673 1.00 . A A . 26 LYS HD2 1 1 4 1842 1 1 20 LYS HE2 H 4.323 3.282 -3.670 1.00 . A A . 26 LYS HE2 1 1 4 1843 1 1 20 LYS HG2 H 1.851 1.503 -1.670 1.00 . A A . 26 LYS HG2 1 1 4 1844 1 1 20 LYS HZ1 H 5.388 0.741 -4.637 1.00 . A A . 26 LYS HZ1 1 1 4 1845 1 1 20 LYS N N 4.682 -1.426 -2.679 1.00 . A A . 26 LYS N 1 1 4 1846 1 1 20 LYS NZ N 5.402 1.712 -4.501 1.00 . A A . 26 LYS NZ 1 1 4 1847 1 1 20 LYS O O 5.746 -0.413 0.595 1.00 . A A . 26 LYS O 1 1 4 1848 1 1 21 GLU C C 7.433 -2.694 1.085 1.00 . A A . 27 GLU C 1 1 4 1849 1 1 21 GLU CA C 6.000 -3.160 0.831 1.00 . A A . 27 GLU CA 1 1 4 1850 1 1 21 GLU CB C 5.982 -4.668 0.574 1.00 . A A . 27 GLU CB 1 1 4 1851 1 1 21 GLU CD C 4.889 -6.767 1.458 1.00 . A A . 27 GLU CD 1 1 4 1852 1 1 21 GLU CG C 4.683 -5.340 0.987 1.00 . A A . 27 GLU CG 1 1 4 1853 1 1 21 GLU H H 5.051 -2.964 -1.050 1.00 . A A . 27 GLU H 1 1 4 1854 1 1 21 GLU HA H 5.405 -2.948 1.707 1.00 . A A . 27 GLU HA 1 1 4 1855 1 1 21 GLU HB2 H 6.133 -4.843 -0.481 1.00 . A A . 27 GLU HB2 1 1 4 1856 1 1 21 GLU HB3 H 6.790 -5.125 1.125 1.00 . A A . 27 GLU HB3 1 1 4 1857 1 1 21 GLU HG2 H 4.239 -4.773 1.792 1.00 . A A . 27 GLU HG2 1 1 4 1858 1 1 21 GLU HG3 H 4.012 -5.349 0.141 1.00 . A A . 27 GLU HG3 1 1 4 1859 1 1 21 GLU N N 5.403 -2.449 -0.295 1.00 . A A . 27 GLU N 1 1 4 1860 1 1 21 GLU O O 7.774 -2.291 2.197 1.00 . A A . 27 GLU O 1 1 4 1861 1 1 21 GLU OE1 O 5.331 -6.953 2.611 1.00 . A A . 27 GLU OE1 1 1 4 1862 1 1 21 GLU OE2 O 4.608 -7.697 0.674 1.00 . A A . 27 GLU OE2 1 1 4 1863 1 1 22 PHE C C 9.774 -0.871 0.557 1.00 . A A . 28 PHE C 1 1 4 1864 1 1 22 PHE CA C 9.666 -2.346 0.175 1.00 . A A . 28 PHE CA 1 1 4 1865 1 1 22 PHE CB C 10.426 -2.617 -1.134 1.00 . A A . 28 PHE CB 1 1 4 1866 1 1 22 PHE CD1 C 10.584 -0.337 -2.171 1.00 . A A . 28 PHE CD1 1 1 4 1867 1 1 22 PHE CD2 C 9.386 -2.032 -3.341 1.00 . A A . 28 PHE CD2 1 1 4 1868 1 1 22 PHE CE1 C 10.311 0.560 -3.178 1.00 . A A . 28 PHE CE1 1 1 4 1869 1 1 22 PHE CE2 C 9.107 -1.138 -4.352 1.00 . A A . 28 PHE CE2 1 1 4 1870 1 1 22 PHE CG C 10.125 -1.642 -2.237 1.00 . A A . 28 PHE CG 1 1 4 1871 1 1 22 PHE CZ C 9.570 0.157 -4.270 1.00 . A A . 28 PHE CZ 1 1 4 1872 1 1 22 PHE H H 7.943 -3.091 -0.810 1.00 . A A . 28 PHE H 1 1 4 1873 1 1 22 PHE HA H 10.112 -2.935 0.962 1.00 . A A . 28 PHE HA 1 1 4 1874 1 1 22 PHE HB2 H 11.488 -2.572 -0.940 1.00 . A A . 28 PHE HB2 1 1 4 1875 1 1 22 PHE HB3 H 10.173 -3.606 -1.488 1.00 . A A . 28 PHE HB3 1 1 4 1876 1 1 22 PHE HD1 H 9.021 -3.044 -3.406 1.00 . A A . 28 PHE HD1 1 1 4 1877 1 1 22 PHE HD2 H 11.160 -0.023 -1.320 1.00 . A A . 28 PHE HD2 1 1 4 1878 1 1 22 PHE HE1 H 8.530 -1.453 -5.208 1.00 . A A . 28 PHE HE1 1 1 4 1879 1 1 22 PHE HE2 H 10.680 1.576 -3.111 1.00 . A A . 28 PHE HE2 1 1 4 1880 1 1 22 PHE HZ H 9.353 0.852 -5.057 1.00 . A A . 28 PHE HZ 1 1 4 1881 1 1 22 PHE N N 8.270 -2.757 0.052 1.00 . A A . 28 PHE N 1 1 4 1882 1 1 22 PHE O O 10.682 -0.477 1.289 1.00 . A A . 28 PHE O 1 1 4 1883 1 1 23 ILE C C 8.857 1.636 1.845 1.00 . A A . 29 ILE C 1 1 4 1884 1 1 23 ILE CA C 8.854 1.373 0.339 1.00 . A A . 29 ILE CA 1 1 4 1885 1 1 23 ILE CB C 7.655 2.091 -0.332 1.00 . A A . 29 ILE CB 1 1 4 1886 1 1 23 ILE CD1 C 7.217 3.969 -1.993 1.00 . A A . 29 ILE CD1 1 1 4 1887 1 1 23 ILE CG1 C 8.097 3.450 -0.877 1.00 . A A . 29 ILE CG1 1 1 4 1888 1 1 23 ILE CG2 C 6.481 2.258 0.629 1.00 . A A . 29 ILE CG2 1 1 4 1889 1 1 23 ILE H H 8.153 -0.427 -0.531 1.00 . A A . 29 ILE H 1 1 4 1890 1 1 23 ILE HA H 9.761 1.784 -0.081 1.00 . A A . 29 ILE HA 1 1 4 1891 1 1 23 ILE HB H 7.321 1.479 -1.157 1.00 . A A . 29 ILE HB 1 1 4 1892 1 1 23 ILE HD11 H 6.913 3.146 -2.623 1.00 . A A . 29 ILE HD11 1 1 4 1893 1 1 23 ILE HD12 H 6.342 4.441 -1.571 1.00 . A A . 29 ILE HD12 1 1 4 1894 1 1 23 ILE HD13 H 7.767 4.688 -2.581 1.00 . A A . 29 ILE HD13 1 1 4 1895 1 1 23 ILE HG12 H 8.079 4.175 -0.077 1.00 . A A . 29 ILE HG12 1 1 4 1896 1 1 23 ILE HG13 H 9.105 3.367 -1.260 1.00 . A A . 29 ILE HG13 1 1 4 1897 1 1 23 ILE HG21 H 6.491 1.461 1.357 1.00 . A A . 29 ILE HG21 1 1 4 1898 1 1 23 ILE HG22 H 6.565 3.208 1.136 1.00 . A A . 29 ILE HG22 1 1 4 1899 1 1 23 ILE HG23 H 5.555 2.228 0.075 1.00 . A A . 29 ILE HG23 1 1 4 1900 1 1 23 ILE N N 8.850 -0.058 0.052 1.00 . A A . 29 ILE N 1 1 4 1901 1 1 23 ILE O O 9.353 2.664 2.304 1.00 . A A . 29 ILE O 1 1 4 1902 1 1 24 ALA C C 9.636 0.997 4.654 1.00 . A A . 30 ALA C 1 1 4 1903 1 1 24 ALA CA C 8.242 0.830 4.058 1.00 . A A . 30 ALA CA 1 1 4 1904 1 1 24 ALA CB C 7.546 -0.377 4.669 1.00 . A A . 30 ALA CB 1 1 4 1905 1 1 24 ALA H H 7.924 -0.100 2.184 1.00 . A A . 30 ALA H 1 1 4 1906 1 1 24 ALA HA H 7.656 1.708 4.288 1.00 . A A . 30 ALA HA 1 1 4 1907 1 1 24 ALA HB1 H 7.971 -1.282 4.262 1.00 . A A . 30 ALA HB1 1 1 4 1908 1 1 24 ALA HB2 H 7.681 -0.366 5.741 1.00 . A A . 30 ALA HB2 1 1 4 1909 1 1 24 ALA HB3 H 6.492 -0.339 4.439 1.00 . A A . 30 ALA HB3 1 1 4 1910 1 1 24 ALA N N 8.302 0.699 2.607 1.00 . A A . 30 ALA N 1 1 4 1911 1 1 24 ALA O O 9.859 1.859 5.504 1.00 . A A . 30 ALA O 1 1 4 1912 1 1 25 TRP C C 12.533 1.622 4.495 1.00 . A A . 31 TRP C 1 1 4 1913 1 1 25 TRP CA C 11.946 0.224 4.693 1.00 . A A . 31 TRP CA 1 1 4 1914 1 1 25 TRP CB C 12.799 -0.846 3.987 1.00 . A A . 31 TRP CB 1 1 4 1915 1 1 25 TRP CD1 C 15.129 0.217 4.164 1.00 . A A . 31 TRP CD1 1 1 4 1916 1 1 25 TRP CD2 C 14.541 -0.369 2.085 1.00 . A A . 31 TRP CD2 1 1 4 1917 1 1 25 TRP CE2 C 15.828 0.200 2.044 1.00 . A A . 31 TRP CE2 1 1 4 1918 1 1 25 TRP CE3 C 13.964 -0.814 0.891 1.00 . A A . 31 TRP CE3 1 1 4 1919 1 1 25 TRP CG C 14.111 -0.346 3.450 1.00 . A A . 31 TRP CG 1 1 4 1920 1 1 25 TRP CH2 C 15.957 -0.108 -0.293 1.00 . A A . 31 TRP CH2 1 1 4 1921 1 1 25 TRP CZ2 C 16.545 0.336 0.858 1.00 . A A . 31 TRP CZ2 1 1 4 1922 1 1 25 TRP CZ3 C 14.678 -0.679 -0.285 1.00 . A A . 31 TRP CZ3 1 1 4 1923 1 1 25 TRP H H 10.334 -0.499 3.525 1.00 . A A . 31 TRP H 1 1 4 1924 1 1 25 TRP HA H 11.923 0.008 5.751 1.00 . A A . 31 TRP HA 1 1 4 1925 1 1 25 TRP HB2 H 13.014 -1.639 4.686 1.00 . A A . 31 TRP HB2 1 1 4 1926 1 1 25 TRP HB3 H 12.235 -1.251 3.159 1.00 . A A . 31 TRP HB3 1 1 4 1927 1 1 25 TRP HD1 H 15.109 0.375 5.232 1.00 . A A . 31 TRP HD1 1 1 4 1928 1 1 25 TRP HE1 H 17.007 0.969 3.599 1.00 . A A . 31 TRP HE1 1 1 4 1929 1 1 25 TRP HE3 H 12.978 -1.257 0.876 1.00 . A A . 31 TRP HE3 1 1 4 1930 1 1 25 TRP HH2 H 16.479 -0.023 -1.234 1.00 . A A . 31 TRP HH2 1 1 4 1931 1 1 25 TRP HZ2 H 17.530 0.775 0.833 1.00 . A A . 31 TRP HZ2 1 1 4 1932 1 1 25 TRP HZ3 H 14.248 -1.015 -1.216 1.00 . A A . 31 TRP HZ3 1 1 4 1933 1 1 25 TRP N N 10.572 0.167 4.203 1.00 . A A . 31 TRP N 1 1 4 1934 1 1 25 TRP NE1 N 16.165 0.550 3.325 1.00 . A A . 31 TRP NE1 1 1 4 1935 1 1 25 TRP O O 12.970 2.263 5.452 1.00 . A A . 31 TRP O 1 1 4 1936 1 1 26 LEU C C 12.306 4.495 3.684 1.00 . A A . 32 LEU C 1 1 4 1937 1 1 26 LEU CA C 13.067 3.412 2.932 1.00 . A A . 32 LEU CA 1 1 4 1938 1 1 26 LEU CB C 12.982 3.676 1.426 1.00 . A A . 32 LEU CB 1 1 4 1939 1 1 26 LEU CD1 C 12.205 1.765 0.020 1.00 . A A . 32 LEU CD1 1 1 4 1940 1 1 26 LEU CD2 C 14.273 3.014 -0.616 1.00 . A A . 32 LEU CD2 1 1 4 1941 1 1 26 LEU CG C 13.419 2.513 0.539 1.00 . A A . 32 LEU CG 1 1 4 1942 1 1 26 LEU H H 12.174 1.534 2.532 1.00 . A A . 32 LEU H 1 1 4 1943 1 1 26 LEU HA H 14.102 3.437 3.236 1.00 . A A . 32 LEU HA 1 1 4 1944 1 1 26 LEU HB2 H 11.958 3.921 1.181 1.00 . A A . 32 LEU HB2 1 1 4 1945 1 1 26 LEU HB3 H 13.603 4.528 1.196 1.00 . A A . 32 LEU HB3 1 1 4 1946 1 1 26 LEU HD11 H 11.447 1.736 0.789 1.00 . A A . 32 LEU HD11 1 1 4 1947 1 1 26 LEU HD12 H 11.815 2.271 -0.850 1.00 . A A . 32 LEU HD12 1 1 4 1948 1 1 26 LEU HD13 H 12.489 0.759 -0.244 1.00 . A A . 32 LEU HD13 1 1 4 1949 1 1 26 LEU HD21 H 14.165 4.085 -0.706 1.00 . A A . 32 LEU HD21 1 1 4 1950 1 1 26 LEU HD22 H 15.308 2.770 -0.430 1.00 . A A . 32 LEU HD22 1 1 4 1951 1 1 26 LEU HD23 H 13.951 2.542 -1.532 1.00 . A A . 32 LEU HD23 1 1 4 1952 1 1 26 LEU HG H 14.012 1.826 1.122 1.00 . A A . 32 LEU HG 1 1 4 1953 1 1 26 LEU N N 12.537 2.089 3.251 1.00 . A A . 32 LEU N 1 1 4 1954 1 1 26 LEU O O 12.899 5.313 4.387 1.00 . A A . 32 LEU O 1 1 4 1955 1 1 27 VAL C C 10.387 5.496 5.697 1.00 . A A . 33 VAL C 1 1 4 1956 1 1 27 VAL CA C 10.141 5.481 4.190 1.00 . A A . 33 VAL CA 1 1 4 1957 1 1 27 VAL CB C 8.646 5.208 3.923 1.00 . A A . 33 VAL CB 1 1 4 1958 1 1 27 VAL CG1 C 7.773 6.227 4.642 1.00 . A A . 33 VAL CG1 1 1 4 1959 1 1 27 VAL CG2 C 8.362 5.217 2.430 1.00 . A A . 33 VAL CG2 1 1 4 1960 1 1 27 VAL H H 10.572 3.819 2.954 1.00 . A A . 33 VAL H 1 1 4 1961 1 1 27 VAL HA H 10.386 6.451 3.784 1.00 . A A . 33 VAL HA 1 1 4 1962 1 1 27 VAL HB H 8.407 4.227 4.307 1.00 . A A . 33 VAL HB 1 1 4 1963 1 1 27 VAL HG11 H 8.316 7.154 4.752 1.00 . A A . 33 VAL HG11 1 1 4 1964 1 1 27 VAL HG12 H 6.875 6.401 4.067 1.00 . A A . 33 VAL HG12 1 1 4 1965 1 1 27 VAL HG13 H 7.507 5.848 5.618 1.00 . A A . 33 VAL HG13 1 1 4 1966 1 1 27 VAL HG21 H 9.219 4.832 1.898 1.00 . A A . 33 VAL HG21 1 1 4 1967 1 1 27 VAL HG22 H 7.502 4.596 2.223 1.00 . A A . 33 VAL HG22 1 1 4 1968 1 1 27 VAL HG23 H 8.161 6.228 2.107 1.00 . A A . 33 VAL HG23 1 1 4 1969 1 1 27 VAL N N 10.986 4.496 3.529 1.00 . A A . 33 VAL N 1 1 4 1970 1 1 27 VAL O O 10.672 6.543 6.279 1.00 . A A . 33 VAL O 1 1 4 1971 1 1 28 ARG C C 11.893 4.650 8.143 1.00 . A A . 34 ARG C 1 1 4 1972 1 1 28 ARG CA C 10.484 4.210 7.761 1.00 . A A . 34 ARG CA 1 1 4 1973 1 1 28 ARG CB C 10.250 2.768 8.215 1.00 . A A . 34 ARG CB 1 1 4 1974 1 1 28 ARG CD C 8.418 2.604 9.927 1.00 . A A . 34 ARG CD 1 1 4 1975 1 1 28 ARG CG C 9.919 2.643 9.693 1.00 . A A . 34 ARG CG 1 1 4 1976 1 1 28 ARG CZ C 6.488 4.065 9.456 1.00 . A A . 34 ARG CZ 1 1 4 1977 1 1 28 ARG H H 10.044 3.529 5.805 1.00 . A A . 34 ARG H 1 1 4 1978 1 1 28 ARG HA H 9.772 4.854 8.254 1.00 . A A . 34 ARG HA 1 1 4 1979 1 1 28 ARG HB2 H 9.430 2.353 7.648 1.00 . A A . 34 ARG HB2 1 1 4 1980 1 1 28 ARG HB3 H 11.141 2.191 8.018 1.00 . A A . 34 ARG HB3 1 1 4 1981 1 1 28 ARG HD2 H 7.982 1.869 9.266 1.00 . A A . 34 ARG HD2 1 1 4 1982 1 1 28 ARG HD3 H 8.233 2.320 10.952 1.00 . A A . 34 ARG HD3 1 1 4 1983 1 1 28 ARG HE H 8.373 4.689 9.662 1.00 . A A . 34 ARG HE 1 1 4 1984 1 1 28 ARG HG2 H 10.356 1.732 10.074 1.00 . A A . 34 ARG HG2 1 1 4 1985 1 1 28 ARG HG3 H 10.335 3.491 10.218 1.00 . A A . 34 ARG HG3 1 1 4 1986 1 1 28 ARG HH11 H 6.026 2.104 9.638 1.00 . A A . 34 ARG HH11 1 1 4 1987 1 1 28 ARG HH12 H 4.690 3.154 9.304 1.00 . A A . 34 ARG HH12 1 1 4 1988 1 1 28 ARG HH21 H 6.617 6.068 9.222 1.00 . A A . 34 ARG HH21 1 1 4 1989 1 1 28 ARG HH22 H 5.025 5.403 9.067 1.00 . A A . 34 ARG HH22 1 1 4 1990 1 1 28 ARG N N 10.274 4.329 6.323 1.00 . A A . 34 ARG N 1 1 4 1991 1 1 28 ARG NE N 7.791 3.900 9.673 1.00 . A A . 34 ARG NE 1 1 4 1992 1 1 28 ARG NH1 N 5.668 3.022 9.467 1.00 . A A . 34 ARG NH1 1 1 4 1993 1 1 28 ARG NH2 N 6.004 5.278 9.230 1.00 . A A . 34 ARG NH2 1 1 4 1994 1 1 28 ARG O O 12.072 5.524 8.992 1.00 . A A . 34 ARG O 1 1 4 1995 1 1 29 GLY C C 15.219 3.936 6.704 1.00 . A A . 35 GLY C 1 1 4 1996 1 1 29 GLY CA C 14.270 4.381 7.800 1.00 . A A . 35 GLY CA 1 1 4 1997 1 1 29 GLY H H 12.686 3.350 6.846 1.00 . A A . 35 GLY H 1 1 4 1998 1 1 29 GLY HA2 H 14.347 5.452 7.916 1.00 . A A . 35 GLY HA2 1 1 4 1999 1 1 29 GLY HA3 H 14.560 3.907 8.726 1.00 . A A . 35 GLY HA3 1 1 4 2000 1 1 29 GLY N N 12.890 4.039 7.512 1.00 . A A . 35 GLY N 1 1 4 2001 1 1 29 GLY O O 15.757 2.831 6.751 1.00 . A A . 35 GLY O 1 1 4 2002 1 1 30 ARG C C 17.764 4.797 4.965 1.00 . A A . 36 ARG C 1 1 4 2003 1 1 30 ARG CA C 16.314 4.492 4.603 1.00 . A A . 36 ARG CA 1 1 4 2004 1 1 30 ARG CB C 15.909 5.288 3.361 1.00 . A A . 36 ARG CB 1 1 4 2005 1 1 30 ARG CD C 16.150 5.622 0.884 1.00 . A A . 36 ARG CD 1 1 4 2006 1 1 30 ARG CG C 16.466 4.721 2.066 1.00 . A A . 36 ARG CG 1 1 4 2007 1 1 30 ARG CZ C 18.424 6.055 0.040 1.00 . A A . 36 ARG CZ 1 1 4 2008 1 1 30 ARG H H 14.965 5.667 5.735 1.00 . A A . 36 ARG H 1 1 4 2009 1 1 30 ARG HA H 16.223 3.437 4.388 1.00 . A A . 36 ARG HA 1 1 4 2010 1 1 30 ARG HB2 H 14.832 5.298 3.289 1.00 . A A . 36 ARG HB2 1 1 4 2011 1 1 30 ARG HB3 H 16.264 6.302 3.467 1.00 . A A . 36 ARG HB3 1 1 4 2012 1 1 30 ARG HD2 H 15.914 5.004 0.030 1.00 . A A . 36 ARG HD2 1 1 4 2013 1 1 30 ARG HD3 H 15.294 6.233 1.132 1.00 . A A . 36 ARG HD3 1 1 4 2014 1 1 30 ARG HE H 17.162 7.454 0.699 1.00 . A A . 36 ARG HE 1 1 4 2015 1 1 30 ARG HG2 H 17.538 4.627 2.157 1.00 . A A . 36 ARG HG2 1 1 4 2016 1 1 30 ARG HG3 H 16.030 3.748 1.893 1.00 . A A . 36 ARG HG3 1 1 4 2017 1 1 30 ARG HH11 H 17.883 4.106 0.026 1.00 . A A . 36 ARG HH11 1 1 4 2018 1 1 30 ARG HH12 H 19.477 4.438 -0.563 1.00 . A A . 36 ARG HH12 1 1 4 2019 1 1 30 ARG HH21 H 19.258 7.892 -0.073 1.00 . A A . 36 ARG HH21 1 1 4 2020 1 1 30 ARG HH22 H 20.258 6.587 -0.619 1.00 . A A . 36 ARG HH22 1 1 4 2021 1 1 30 ARG N N 15.424 4.801 5.715 1.00 . A A . 36 ARG N 1 1 4 2022 1 1 30 ARG NE N 17.272 6.493 0.544 1.00 . A A . 36 ARG NE 1 1 4 2023 1 1 30 ARG NH1 N 18.609 4.760 -0.184 1.00 . A A . 36 ARG NH1 1 1 4 2024 1 1 30 ARG NH2 N 19.393 6.915 -0.240 1.00 . A A . 36 ARG NH2 1 1 4 2025 1 1 30 ARG O O 18.653 3.971 4.760 1.00 . A A . 36 ARG O 1 1 4 2026 1 1 31 GLY C C 19.548 7.883 5.812 1.00 . A A . 37 GLY C 1 1 4 2027 1 1 31 GLY CA C 19.339 6.383 5.886 1.00 . A A . 37 GLY CA 1 1 4 2028 1 1 31 GLY H H 17.248 6.608 5.644 1.00 . A A . 37 GLY H 1 1 4 2029 1 1 31 GLY HA2 H 19.525 6.054 6.898 1.00 . A A . 37 GLY HA2 1 1 4 2030 1 1 31 GLY HA3 H 20.045 5.900 5.227 1.00 . A A . 37 GLY HA3 1 1 4 2031 1 1 31 GLY N N 17.995 5.990 5.504 1.00 . A A . 37 GLY N 1 1 4 2032 1 1 31 GLY O O 19.121 8.493 4.810 1.00 . A A . 37 GLY O 1 1 4 2033 1 1 31 GLY OXT O 20.138 8.447 6.757 1.00 . A A . 37 GLY OXT 1 1 4 2034 2 2 1 . C02 C 11.309 2.364 -6.135 1.00 . B A . 1038 D6M C02 1 1 4 2035 2 2 1 . C04 C 9.346 1.664 -7.408 1.00 . B A . 1038 D6M C04 1 1 4 2036 2 2 1 . C05 C 8.401 2.442 -6.484 1.00 . B A . 1038 D6M C05 1 1 4 2037 2 2 1 . C06 C 7.010 1.833 -6.390 1.00 . B A . 1038 D6M C06 1 1 4 2038 2 2 1 . C07 C 6.169 2.456 -5.293 1.00 . B A . 1038 D6M C07 1 1 4 2039 2 2 1 . C09 C 9.556 2.434 -8.709 1.00 . B A . 1038 D6M C09 1 1 4 2040 2 2 1 . C12 C 12.622 2.078 -5.430 1.00 . B A . 1038 D6M C12 1 1 4 2041 2 2 1 . C13 C 12.789 0.614 -5.050 1.00 . B A . 1038 D6M C13 1 1 4 2042 2 2 1 . C14 C 13.376 0.462 -3.654 1.00 . B A . 1038 D6M C14 1 1 4 2043 2 2 1 . C15 C 14.855 0.111 -3.704 1.00 . B A . 1038 D6M C15 1 1 4 2044 2 2 1 . C16 C 15.655 1.145 -4.485 1.00 . B A . 1038 D6M C16 1 1 4 2045 2 2 1 . C17 C 15.955 2.378 -3.646 1.00 . B A . 1038 D6M C17 1 1 4 2046 2 2 1 . C18 C 15.485 3.650 -4.333 1.00 . B A . 1038 D6M C18 1 1 4 2047 2 2 1 . C19 C 14.955 4.665 -3.333 1.00 . B A . 1038 D6M C19 1 1 4 2048 2 2 1 . C20 C 13.435 4.658 -3.280 1.00 . B A . 1038 D6M C20 1 1 4 2049 2 2 1 . C21 C 12.900 5.823 -2.463 1.00 . B A . 1038 D6M C21 1 1 4 2050 2 2 1 . C22 C 11.789 5.381 -1.524 1.00 . B A . 1038 D6M C22 1 1 4 2051 2 2 1 . C23 C 11.448 6.468 -0.519 1.00 . B A . 1038 D6M C23 1 1 4 2052 2 2 1 . C24 C 10.071 6.252 0.088 1.00 . B A . 1038 D6M C24 1 1 4 2053 2 2 1 . C25 C 9.039 7.184 -0.525 1.00 . B A . 1038 D6M C25 1 1 4 2054 2 2 1 . C26 C 8.772 8.382 0.360 1.00 . B A . 1038 D6M C26 1 1 4 2055 2 2 1 . H03 H 11.000 0.499 -6.785 1.00 . B A . 1038 D6M H03 1 1 4 2056 2 2 1 . H04 H 8.898 0.708 -7.639 1.00 . B A . 1038 D6M H04 1 1 4 2057 2 2 1 . HP21 H 12.664 2.675 -4.531 1.00 . B A . 1038 D6M HP21 1 1 4 2058 2 2 1 . HP22 H 13.432 2.359 -6.085 1.00 . B A . 1038 D6M HP22 1 1 4 2059 2 2 1 . HP31 H 13.450 0.142 -5.762 1.00 . B A . 1038 D6M HP31 1 1 4 2060 2 2 1 . HP32 H 11.826 0.131 -5.078 1.00 . B A . 1038 D6M HP32 1 1 4 2061 2 2 1 . HP41 H 12.847 -0.325 -3.134 1.00 . B A . 1038 D6M HP41 1 1 4 2062 2 2 1 . HP42 H 13.254 1.392 -3.119 1.00 . B A . 1038 D6M HP42 1 1 4 2063 2 2 1 . HP51 H 14.969 -0.853 -4.178 1.00 . B A . 1038 D6M HP51 1 1 4 2064 2 2 1 . HP52 H 15.236 0.064 -2.696 1.00 . B A . 1038 D6M HP52 1 1 4 2065 2 2 1 . HP61 H 15.089 1.441 -5.356 1.00 . B A . 1038 D6M HP61 1 1 4 2066 2 2 1 . HP62 H 16.588 0.700 -4.797 1.00 . B A . 1038 D6M HP62 1 1 4 2067 2 2 1 . HP71 H 17.022 2.440 -3.485 1.00 . B A . 1038 D6M HP71 1 1 4 2068 2 2 1 . HP72 H 15.452 2.287 -2.695 1.00 . B A . 1038 D6M HP72 1 1 4 2069 2 2 1 . HP81 H 14.698 3.401 -5.030 1.00 . B A . 1038 D6M HP81 1 1 4 2070 2 2 1 . HP82 H 16.315 4.087 -4.867 1.00 . B A . 1038 D6M HP82 1 1 4 2071 2 2 1 . HP91 H 15.292 5.650 -3.623 1.00 . B A . 1038 D6M HP91 1 1 4 2072 2 2 1 . HP92 H 15.341 4.426 -2.353 1.00 . B A . 1038 D6M HP92 1 1 4 2073 2 2 1 . HPA1 H 13.103 3.732 -2.832 1.00 . B A . 1038 D6M HPA1 1 1 4 2074 2 2 1 . HPA2 H 13.049 4.731 -4.286 1.00 . B A . 1038 D6M HPA2 1 1 4 2075 2 2 1 . HPB1 H 12.513 6.574 -3.136 1.00 . B A . 1038 D6M HPB1 1 1 4 2076 2 2 1 . HPB2 H 13.706 6.241 -1.878 1.00 . B A . 1038 D6M HPB2 1 1 4 2077 2 2 1 . HPC1 H 12.111 4.497 -0.992 1.00 . B A . 1038 D6M HPC1 1 1 4 2078 2 2 1 . HPC2 H 10.908 5.152 -2.106 1.00 . B A . 1038 D6M HPC2 1 1 4 2079 2 2 1 . HPD1 H 11.466 7.425 -1.019 1.00 . B A . 1038 D6M HPD1 1 1 4 2080 2 2 1 . HPD2 H 12.184 6.458 0.271 1.00 . B A . 1038 D6M HPD2 1 1 4 2081 2 2 1 . HPE1 H 10.125 6.438 1.151 1.00 . B A . 1038 D6M HPE1 1 1 4 2082 2 2 1 . HPE2 H 9.767 5.230 -0.085 1.00 . B A . 1038 D6M HPE2 1 1 4 2083 2 2 1 . HPF1 H 8.113 6.644 -0.664 1.00 . B A . 1038 D6M HPF1 1 1 4 2084 2 2 1 . HPF2 H 9.402 7.538 -1.478 1.00 . B A . 1038 D6M HPF2 1 1 4 2085 2 2 1 . HPG1 H 9.297 9.242 -0.030 1.00 . B A . 1038 D6M HPG1 1 1 4 2086 2 2 1 . HPG2 H 9.116 8.174 1.362 1.00 . B A . 1038 D6M HPG2 1 1 4 2087 2 2 1 . HPG3 H 7.711 8.587 0.379 1.00 . B A . 1038 D6M HPG3 1 1 4 2088 2 2 1 . HQ21 H 6.505 1.974 -7.334 1.00 . B A . 1038 D6M HQ21 1 1 4 2089 2 2 1 . HQ22 H 7.108 0.777 -6.190 1.00 . B A . 1038 D6M HQ22 1 1 4 2090 2 2 1 . HQ31 H 8.828 2.468 -5.491 1.00 . B A . 1038 D6M HQ31 1 1 4 2091 2 2 1 . HQ32 H 8.304 3.454 -6.851 1.00 . B A . 1038 D6M HQ32 1 1 4 2092 2 2 1 . N03 N 10.623 1.402 -6.747 1.00 . B A . 1038 D6M N03 1 1 4 2093 2 2 1 . O01 O 10.878 3.517 -6.113 1.00 . B A . 1038 D6M O01 1 1 4 2094 2 2 1 . O08 O 6.209 3.678 -5.150 1.00 . B A . 1038 D6M O08 1 1 4 2095 2 2 1 . O10 O 9.629 3.679 -8.653 1.00 . B A . 1038 D6M O10 1 1 4 2096 2 2 1 . O11 O 9.644 1.784 -9.772 1.00 . B A . 1038 D6M O11 1 1 5 2097 1 1 1 HIS C C -13.693 -2.275 7.766 1.00 . A A . 7 HIS C 1 1 5 2098 1 1 1 HIS CA C -14.212 -1.969 9.167 1.00 . A A . 7 HIS CA 1 1 5 2099 1 1 1 HIS CB C -15.015 -0.667 9.160 1.00 . A A . 7 HIS CB 1 1 5 2100 1 1 1 HIS CD2 C -13.876 1.234 7.809 1.00 . A A . 7 HIS CD2 1 1 5 2101 1 1 1 HIS CE1 C -12.863 2.244 9.470 1.00 . A A . 7 HIS CE1 1 1 5 2102 1 1 1 HIS CG C -14.174 0.553 8.941 1.00 . A A . 7 HIS CG 1 1 5 2103 1 1 1 HIS H1 H -12.479 -1.062 9.804 1.00 . A A . 7 HIS H1 1 1 5 2104 1 1 1 HIS H2 H -13.506 -1.608 11.066 1.00 . A A . 7 HIS H2 1 1 5 2105 1 1 1 HIS H3 H -12.581 -2.735 10.161 1.00 . A A . 7 HIS H3 1 1 5 2106 1 1 1 HIS HA H -14.850 -2.778 9.492 1.00 . A A . 7 HIS HA 1 1 5 2107 1 1 1 HIS HB2 H -15.749 -0.709 8.369 1.00 . A A . 7 HIS HB2 1 1 5 2108 1 1 1 HIS HB3 H -15.520 -0.558 10.108 1.00 . A A . 7 HIS HB3 1 1 5 2109 1 1 1 HIS HD1 H -13.543 0.960 10.910 1.00 . A A . 7 HIS HD1 1 1 5 2110 1 1 1 HIS HD2 H -14.218 0.998 6.811 1.00 . A A . 7 HIS HD2 1 1 5 2111 1 1 1 HIS HE1 H -12.263 2.940 10.037 1.00 . A A . 7 HIS HE1 1 1 5 2112 1 1 1 HIS HE2 H -12.618 2.893 7.543 1.00 . A A . 7 HIS HE2 1 1 5 2113 1 1 1 HIS N N -13.094 -1.831 10.137 1.00 . A A . 7 HIS N 1 1 5 2114 1 1 1 HIS ND1 N -13.523 1.211 9.964 1.00 . A A . 7 HIS ND1 1 1 5 2115 1 1 1 HIS NE2 N -13.061 2.279 8.165 1.00 . A A . 7 HIS NE2 1 1 5 2116 1 1 1 HIS O O -13.361 -1.367 7.005 1.00 . A A . 7 HIS O 1 1 5 2117 1 1 2 ALA C C -14.286 -4.058 5.114 1.00 . A A . 8 ALA C 1 1 5 2118 1 1 2 ALA CA C -13.144 -3.986 6.123 1.00 . A A . 8 ALA CA 1 1 5 2119 1 1 2 ALA CB C -12.446 -5.333 6.230 1.00 . A A . 8 ALA CB 1 1 5 2120 1 1 2 ALA H H -13.903 -4.239 8.083 1.00 . A A . 8 ALA H 1 1 5 2121 1 1 2 ALA HA H -12.421 -3.259 5.781 1.00 . A A . 8 ALA HA 1 1 5 2122 1 1 2 ALA HB1 H -12.866 -5.891 7.054 1.00 . A A . 8 ALA HB1 1 1 5 2123 1 1 2 ALA HB2 H -12.587 -5.886 5.313 1.00 . A A . 8 ALA HB2 1 1 5 2124 1 1 2 ALA HB3 H -11.391 -5.179 6.400 1.00 . A A . 8 ALA HB3 1 1 5 2125 1 1 2 ALA N N -13.624 -3.560 7.433 1.00 . A A . 8 ALA N 1 1 5 2126 1 1 2 ALA O O -15.417 -4.396 5.464 1.00 . A A . 8 ALA O 1 1 5 2127 1 1 3 GLU C C -14.386 -4.301 1.503 1.00 . A A . 9 GLU C 1 1 5 2128 1 1 3 GLU CA C -14.983 -3.762 2.800 1.00 . A A . 9 GLU CA 1 1 5 2129 1 1 3 GLU CB C -15.549 -2.358 2.574 1.00 . A A . 9 GLU CB 1 1 5 2130 1 1 3 GLU CD C -17.365 -0.687 3.115 1.00 . A A . 9 GLU CD 1 1 5 2131 1 1 3 GLU CG C -16.844 -2.095 3.326 1.00 . A A . 9 GLU CG 1 1 5 2132 1 1 3 GLU H H -13.063 -3.474 3.644 1.00 . A A . 9 GLU H 1 1 5 2133 1 1 3 GLU HA H -15.782 -4.417 3.113 1.00 . A A . 9 GLU HA 1 1 5 2134 1 1 3 GLU HB2 H -14.818 -1.632 2.896 1.00 . A A . 9 GLU HB2 1 1 5 2135 1 1 3 GLU HB3 H -15.737 -2.222 1.519 1.00 . A A . 9 GLU HB3 1 1 5 2136 1 1 3 GLU HG2 H -17.593 -2.794 2.985 1.00 . A A . 9 GLU HG2 1 1 5 2137 1 1 3 GLU HG3 H -16.668 -2.243 4.382 1.00 . A A . 9 GLU HG3 1 1 5 2138 1 1 3 GLU N N -13.983 -3.736 3.861 1.00 . A A . 9 GLU N 1 1 5 2139 1 1 3 GLU O O -13.245 -4.762 1.479 1.00 . A A . 9 GLU O 1 1 5 2140 1 1 3 GLU OE1 O -16.548 0.258 3.133 1.00 . A A . 9 GLU OE1 1 1 5 2141 1 1 3 GLU OE2 O -18.590 -0.528 2.931 1.00 . A A . 9 GLU OE2 1 1 5 2142 1 1 4 GLY C C -13.608 -3.844 -1.447 1.00 . A A . 10 GLY C 1 1 5 2143 1 1 4 GLY CA C -14.692 -4.724 -0.858 1.00 . A A . 10 GLY CA 1 1 5 2144 1 1 4 GLY H H -16.064 -3.862 0.504 1.00 . A A . 10 GLY H 1 1 5 2145 1 1 4 GLY HA2 H -14.299 -5.721 -0.732 1.00 . A A . 10 GLY HA2 1 1 5 2146 1 1 4 GLY HA3 H -15.523 -4.760 -1.546 1.00 . A A . 10 GLY HA3 1 1 5 2147 1 1 4 GLY N N -15.163 -4.239 0.426 1.00 . A A . 10 GLY N 1 1 5 2148 1 1 4 GLY O O -13.652 -2.621 -1.317 1.00 . A A . 10 GLY O 1 1 5 2149 1 1 5 THR C C -10.779 -4.597 -3.707 1.00 . A A . 11 THR C 1 1 5 2150 1 1 5 THR CA C -11.524 -3.735 -2.696 1.00 . A A . 11 THR CA 1 1 5 2151 1 1 5 THR CB C -10.555 -3.254 -1.616 1.00 . A A . 11 THR CB 1 1 5 2152 1 1 5 THR CG2 C -9.784 -2.019 -2.018 1.00 . A A . 11 THR CG2 1 1 5 2153 1 1 5 THR H H -12.646 -5.447 -2.157 1.00 . A A . 11 THR H 1 1 5 2154 1 1 5 THR HA H -11.931 -2.879 -3.204 1.00 . A A . 11 THR HA 1 1 5 2155 1 1 5 THR HB H -9.841 -4.039 -1.412 1.00 . A A . 11 THR HB 1 1 5 2156 1 1 5 THR HG1 H -11.871 -2.247 -0.571 1.00 . A A . 11 THR HG1 1 1 5 2157 1 1 5 THR HG21 H -9.788 -1.928 -3.095 1.00 . A A . 11 THR HG21 1 1 5 2158 1 1 5 THR HG22 H -10.250 -1.147 -1.582 1.00 . A A . 11 THR HG22 1 1 5 2159 1 1 5 THR HG23 H -8.766 -2.099 -1.666 1.00 . A A . 11 THR HG23 1 1 5 2160 1 1 5 THR N N -12.628 -4.469 -2.091 1.00 . A A . 11 THR N 1 1 5 2161 1 1 5 THR O O -10.339 -5.701 -3.384 1.00 . A A . 11 THR O 1 1 5 2162 1 1 5 THR OG1 O -11.246 -2.958 -0.415 1.00 . A A . 11 THR OG1 1 1 5 2163 1 1 6 PHE C C -9.481 -3.937 -7.136 1.00 . A A . 12 PHE C 1 1 5 2164 1 1 6 PHE CA C -9.902 -4.829 -5.957 1.00 . A A . 12 PHE CA 1 1 5 2165 1 1 6 PHE CB C -10.774 -5.991 -6.458 1.00 . A A . 12 PHE CB 1 1 5 2166 1 1 6 PHE CD1 C -12.719 -4.379 -6.568 1.00 . A A . 12 PHE CD1 1 1 5 2167 1 1 6 PHE CD2 C -13.188 -6.715 -6.487 1.00 . A A . 12 PHE CD2 1 1 5 2168 1 1 6 PHE CE1 C -14.061 -4.101 -6.620 1.00 . A A . 12 PHE CE1 1 1 5 2169 1 1 6 PHE CE2 C -14.543 -6.441 -6.536 1.00 . A A . 12 PHE CE2 1 1 5 2170 1 1 6 PHE CG C -12.257 -5.688 -6.501 1.00 . A A . 12 PHE CG 1 1 5 2171 1 1 6 PHE CZ C -14.981 -5.131 -6.603 1.00 . A A . 12 PHE CZ 1 1 5 2172 1 1 6 PHE H H -10.975 -3.196 -5.129 1.00 . A A . 12 PHE H 1 1 5 2173 1 1 6 PHE HA H -9.022 -5.232 -5.498 1.00 . A A . 12 PHE HA 1 1 5 2174 1 1 6 PHE HB2 H -10.465 -6.256 -7.457 1.00 . A A . 12 PHE HB2 1 1 5 2175 1 1 6 PHE HB3 H -10.630 -6.842 -5.808 1.00 . A A . 12 PHE HB3 1 1 5 2176 1 1 6 PHE HD1 H -12.012 -3.567 -6.579 1.00 . A A . 12 PHE HD1 1 1 5 2177 1 1 6 PHE HD2 H -12.848 -7.739 -6.435 1.00 . A A . 12 PHE HD2 1 1 5 2178 1 1 6 PHE HE1 H -14.389 -3.075 -6.675 1.00 . A A . 12 PHE HE1 1 1 5 2179 1 1 6 PHE HE2 H -15.259 -7.249 -6.523 1.00 . A A . 12 PHE HE2 1 1 5 2180 1 1 6 PHE HZ H -16.038 -4.915 -6.644 1.00 . A A . 12 PHE HZ 1 1 5 2181 1 1 6 PHE N N -10.620 -4.086 -4.927 1.00 . A A . 12 PHE N 1 1 5 2182 1 1 6 PHE O O -8.354 -3.448 -7.166 1.00 . A A . 12 PHE O 1 1 5 2183 1 1 7 THR C C -10.590 -1.439 -9.010 1.00 . A A . 13 THR C 1 1 5 2184 1 1 7 THR CA C -10.100 -2.865 -9.245 1.00 . A A . 13 THR CA 1 1 5 2185 1 1 7 THR CB C -10.728 -3.442 -10.515 1.00 . A A . 13 THR CB 1 1 5 2186 1 1 7 THR CG2 C -9.736 -4.175 -11.392 1.00 . A A . 13 THR CG2 1 1 5 2187 1 1 7 THR H H -11.259 -4.133 -8.028 1.00 . A A . 13 THR H 1 1 5 2188 1 1 7 THR HA H -9.026 -2.830 -9.363 1.00 . A A . 13 THR HA 1 1 5 2189 1 1 7 THR HB H -11.149 -2.634 -11.097 1.00 . A A . 13 THR HB 1 1 5 2190 1 1 7 THR HG1 H -12.585 -3.863 -10.053 1.00 . A A . 13 THR HG1 1 1 5 2191 1 1 7 THR HG21 H -9.174 -4.875 -10.792 1.00 . A A . 13 THR HG21 1 1 5 2192 1 1 7 THR HG22 H -10.266 -4.709 -12.167 1.00 . A A . 13 THR HG22 1 1 5 2193 1 1 7 THR HG23 H -9.060 -3.463 -11.843 1.00 . A A . 13 THR HG23 1 1 5 2194 1 1 7 THR N N -10.382 -3.720 -8.096 1.00 . A A . 13 THR N 1 1 5 2195 1 1 7 THR O O -9.799 -0.513 -8.846 1.00 . A A . 13 THR O 1 1 5 2196 1 1 7 THR OG1 O -11.769 -4.348 -10.195 1.00 . A A . 13 THR OG1 1 1 5 2197 1 1 8 SER C C -12.684 0.355 -7.343 1.00 . A A . 14 SER C 1 1 5 2198 1 1 8 SER CA C -12.544 0.027 -8.826 1.00 . A A . 14 SER CA 1 1 5 2199 1 1 8 SER CB C -13.918 0.058 -9.497 1.00 . A A . 14 SER CB 1 1 5 2200 1 1 8 SER H H -12.486 -2.060 -9.171 1.00 . A A . 14 SER H 1 1 5 2201 1 1 8 SER HA H -11.912 0.770 -9.288 1.00 . A A . 14 SER HA 1 1 5 2202 1 1 8 SER HB2 H -14.580 -0.627 -8.990 1.00 . A A . 14 SER HB2 1 1 5 2203 1 1 8 SER HB3 H -14.322 1.058 -9.440 1.00 . A A . 14 SER HB3 1 1 5 2204 1 1 8 SER HG H -14.676 -0.180 -11.288 1.00 . A A . 14 SER HG 1 1 5 2205 1 1 8 SER N N -11.916 -1.278 -9.019 1.00 . A A . 14 SER N 1 1 5 2206 1 1 8 SER O O -12.336 1.453 -6.908 1.00 . A A . 14 SER O 1 1 5 2207 1 1 8 SER OG O -13.829 -0.320 -10.860 1.00 . A A . 14 SER OG 1 1 5 2208 1 1 9 ASP C C -12.095 0.203 -4.524 1.00 . A A . 15 ASP C 1 1 5 2209 1 1 9 ASP CA C -13.347 -0.430 -5.122 1.00 . A A . 15 ASP CA 1 1 5 2210 1 1 9 ASP CB C -13.609 -1.778 -4.446 1.00 . A A . 15 ASP CB 1 1 5 2211 1 1 9 ASP CG C -15.062 -2.202 -4.542 1.00 . A A . 15 ASP CG 1 1 5 2212 1 1 9 ASP H H -13.427 -1.467 -6.971 1.00 . A A . 15 ASP H 1 1 5 2213 1 1 9 ASP HA H -14.190 0.225 -4.956 1.00 . A A . 15 ASP HA 1 1 5 2214 1 1 9 ASP HB2 H -12.992 -2.539 -4.914 1.00 . A A . 15 ASP HB2 1 1 5 2215 1 1 9 ASP HB3 H -13.345 -1.703 -3.402 1.00 . A A . 15 ASP HB3 1 1 5 2216 1 1 9 ASP N N -13.180 -0.610 -6.566 1.00 . A A . 15 ASP N 1 1 5 2217 1 1 9 ASP O O -12.150 0.925 -3.528 1.00 . A A . 15 ASP O 1 1 5 2218 1 1 9 ASP OD1 O -15.912 -1.345 -4.863 1.00 . A A . 15 ASP OD1 1 1 5 2219 1 1 9 ASP OD2 O -15.350 -3.393 -4.296 1.00 . A A . 15 ASP OD2 1 1 5 2220 1 1 10 VAL C C -9.730 1.887 -4.329 1.00 . A A . 16 VAL C 1 1 5 2221 1 1 10 VAL CA C -9.667 0.422 -4.764 1.00 . A A . 16 VAL CA 1 1 5 2222 1 1 10 VAL CB C -8.671 0.267 -5.930 1.00 . A A . 16 VAL CB 1 1 5 2223 1 1 10 VAL CG1 C -8.705 -1.155 -6.455 1.00 . A A . 16 VAL CG1 1 1 5 2224 1 1 10 VAL CG2 C -8.982 1.260 -7.042 1.00 . A A . 16 VAL CG2 1 1 5 2225 1 1 10 VAL H H -11.022 -0.665 -5.948 1.00 . A A . 16 VAL H 1 1 5 2226 1 1 10 VAL HA H -9.315 -0.176 -3.937 1.00 . A A . 16 VAL HA 1 1 5 2227 1 1 10 VAL HB H -7.677 0.460 -5.570 1.00 . A A . 16 VAL HB 1 1 5 2228 1 1 10 VAL HG11 H -9.723 -1.429 -6.703 1.00 . A A . 16 VAL HG11 1 1 5 2229 1 1 10 VAL HG12 H -8.087 -1.229 -7.336 1.00 . A A . 16 VAL HG12 1 1 5 2230 1 1 10 VAL HG13 H -8.330 -1.824 -5.694 1.00 . A A . 16 VAL HG13 1 1 5 2231 1 1 10 VAL HG21 H -10.022 1.171 -7.322 1.00 . A A . 16 VAL HG21 1 1 5 2232 1 1 10 VAL HG22 H -8.787 2.263 -6.693 1.00 . A A . 16 VAL HG22 1 1 5 2233 1 1 10 VAL HG23 H -8.360 1.048 -7.898 1.00 . A A . 16 VAL HG23 1 1 5 2234 1 1 10 VAL N N -10.971 -0.085 -5.165 1.00 . A A . 16 VAL N 1 1 5 2235 1 1 10 VAL O O -9.138 2.272 -3.323 1.00 . A A . 16 VAL O 1 1 5 2236 1 1 11 SER C C -10.932 4.332 -3.305 1.00 . A A . 17 SER C 1 1 5 2237 1 1 11 SER CA C -10.599 4.119 -4.780 1.00 . A A . 17 SER CA 1 1 5 2238 1 1 11 SER CB C -11.686 4.747 -5.655 1.00 . A A . 17 SER CB 1 1 5 2239 1 1 11 SER H H -10.912 2.335 -5.880 1.00 . A A . 17 SER H 1 1 5 2240 1 1 11 SER HA H -9.656 4.600 -4.995 1.00 . A A . 17 SER HA 1 1 5 2241 1 1 11 SER HB2 H -11.805 4.160 -6.554 1.00 . A A . 17 SER HB2 1 1 5 2242 1 1 11 SER HB3 H -12.618 4.765 -5.110 1.00 . A A . 17 SER HB3 1 1 5 2243 1 1 11 SER HG H -11.378 6.162 -6.976 1.00 . A A . 17 SER HG 1 1 5 2244 1 1 11 SER N N -10.458 2.699 -5.091 1.00 . A A . 17 SER N 1 1 5 2245 1 1 11 SER O O -10.634 5.382 -2.736 1.00 . A A . 17 SER O 1 1 5 2246 1 1 11 SER OG O -11.344 6.074 -6.020 1.00 . A A . 17 SER OG 1 1 5 2247 1 1 12 SER C C -10.713 3.283 -0.374 1.00 . A A . 18 SER C 1 1 5 2248 1 1 12 SER CA C -11.931 3.406 -1.287 1.00 . A A . 18 SER CA 1 1 5 2249 1 1 12 SER CB C -12.944 2.311 -0.951 1.00 . A A . 18 SER CB 1 1 5 2250 1 1 12 SER H H -11.770 2.519 -3.198 1.00 . A A . 18 SER H 1 1 5 2251 1 1 12 SER HA H -12.391 4.369 -1.122 1.00 . A A . 18 SER HA 1 1 5 2252 1 1 12 SER HB2 H -12.614 1.375 -1.377 1.00 . A A . 18 SER HB2 1 1 5 2253 1 1 12 SER HB3 H -13.021 2.211 0.122 1.00 . A A . 18 SER HB3 1 1 5 2254 1 1 12 SER HG H -14.134 2.940 -2.375 1.00 . A A . 18 SER HG 1 1 5 2255 1 1 12 SER N N -11.555 3.329 -2.692 1.00 . A A . 18 SER N 1 1 5 2256 1 1 12 SER O O -10.637 3.947 0.659 1.00 . A A . 18 SER O 1 1 5 2257 1 1 12 SER OG O -14.224 2.623 -1.473 1.00 . A A . 18 SER OG 1 1 5 2258 1 1 13 TYR C C -7.747 3.518 0.147 1.00 . A A . 19 TYR C 1 1 5 2259 1 1 13 TYR CA C -8.565 2.229 0.060 1.00 . A A . 19 TYR CA 1 1 5 2260 1 1 13 TYR CB C -7.713 1.069 -0.491 1.00 . A A . 19 TYR CB 1 1 5 2261 1 1 13 TYR CD1 C -5.515 2.158 -1.119 1.00 . A A . 19 TYR CD1 1 1 5 2262 1 1 13 TYR CD2 C -6.793 1.128 -2.848 1.00 . A A . 19 TYR CD2 1 1 5 2263 1 1 13 TYR CE1 C -4.545 2.507 -2.038 1.00 . A A . 19 TYR CE1 1 1 5 2264 1 1 13 TYR CE2 C -5.827 1.476 -3.773 1.00 . A A . 19 TYR CE2 1 1 5 2265 1 1 13 TYR CG C -6.656 1.464 -1.507 1.00 . A A . 19 TYR CG 1 1 5 2266 1 1 13 TYR CZ C -4.705 2.165 -3.363 1.00 . A A . 19 TYR CZ 1 1 5 2267 1 1 13 TYR H H -9.876 1.916 -1.578 1.00 . A A . 19 TYR H 1 1 5 2268 1 1 13 TYR HA H -8.893 1.970 1.057 1.00 . A A . 19 TYR HA 1 1 5 2269 1 1 13 TYR HB2 H -7.207 0.588 0.332 1.00 . A A . 19 TYR HB2 1 1 5 2270 1 1 13 TYR HB3 H -8.370 0.351 -0.964 1.00 . A A . 19 TYR HB3 1 1 5 2271 1 1 13 TYR HD1 H -5.393 2.426 -0.080 1.00 . A A . 19 TYR HD1 1 1 5 2272 1 1 13 TYR HD2 H -7.671 0.589 -3.167 1.00 . A A . 19 TYR HD2 1 1 5 2273 1 1 13 TYR HE1 H -3.666 3.046 -1.715 1.00 . A A . 19 TYR HE1 1 1 5 2274 1 1 13 TYR HE2 H -5.953 1.208 -4.812 1.00 . A A . 19 TYR HE2 1 1 5 2275 1 1 13 TYR HH H -3.404 3.387 -4.077 1.00 . A A . 19 TYR HH 1 1 5 2276 1 1 13 TYR N N -9.764 2.426 -0.749 1.00 . A A . 19 TYR N 1 1 5 2277 1 1 13 TYR O O -6.924 3.679 1.047 1.00 . A A . 19 TYR O 1 1 5 2278 1 1 13 TYR OH O -3.741 2.511 -4.281 1.00 . A A . 19 TYR OH 1 1 5 2279 1 1 14 LEU C C -7.680 6.581 0.363 1.00 . A A . 20 LEU C 1 1 5 2280 1 1 14 LEU CA C -7.266 5.703 -0.815 1.00 . A A . 20 LEU CA 1 1 5 2281 1 1 14 LEU CB C -7.532 6.440 -2.131 1.00 . A A . 20 LEU CB 1 1 5 2282 1 1 14 LEU CD1 C -7.730 6.413 -4.629 1.00 . A A . 20 LEU CD1 1 1 5 2283 1 1 14 LEU CD2 C -6.103 4.896 -3.490 1.00 . A A . 20 LEU CD2 1 1 5 2284 1 1 14 LEU CG C -7.460 5.574 -3.389 1.00 . A A . 20 LEU CG 1 1 5 2285 1 1 14 LEU H H -8.649 4.248 -1.484 1.00 . A A . 20 LEU H 1 1 5 2286 1 1 14 LEU HA H -6.210 5.492 -0.738 1.00 . A A . 20 LEU HA 1 1 5 2287 1 1 14 LEU HB2 H -8.517 6.881 -2.079 1.00 . A A . 20 LEU HB2 1 1 5 2288 1 1 14 LEU HB3 H -6.806 7.234 -2.226 1.00 . A A . 20 LEU HB3 1 1 5 2289 1 1 14 LEU HD11 H -8.449 7.183 -4.392 1.00 . A A . 20 LEU HD11 1 1 5 2290 1 1 14 LEU HD12 H -6.810 6.869 -4.962 1.00 . A A . 20 LEU HD12 1 1 5 2291 1 1 14 LEU HD13 H -8.123 5.781 -5.412 1.00 . A A . 20 LEU HD13 1 1 5 2292 1 1 14 LEU HD21 H -5.765 4.619 -2.502 1.00 . A A . 20 LEU HD21 1 1 5 2293 1 1 14 LEU HD22 H -6.188 4.011 -4.103 1.00 . A A . 20 LEU HD22 1 1 5 2294 1 1 14 LEU HD23 H -5.393 5.577 -3.935 1.00 . A A . 20 LEU HD23 1 1 5 2295 1 1 14 LEU HG H -8.217 4.805 -3.334 1.00 . A A . 20 LEU HG 1 1 5 2296 1 1 14 LEU N N -7.981 4.432 -0.792 1.00 . A A . 20 LEU N 1 1 5 2297 1 1 14 LEU O O -8.348 7.600 0.186 1.00 . A A . 20 LEU O 1 1 5 2298 1 1 15 GLU C C -6.345 7.322 3.530 1.00 . A A . 21 GLU C 1 1 5 2299 1 1 15 GLU CA C -7.609 6.931 2.771 1.00 . A A . 21 GLU CA 1 1 5 2300 1 1 15 GLU CB C -8.527 6.108 3.675 1.00 . A A . 21 GLU CB 1 1 5 2301 1 1 15 GLU CD C -10.829 5.108 3.957 1.00 . A A . 21 GLU CD 1 1 5 2302 1 1 15 GLU CG C -9.992 6.170 3.273 1.00 . A A . 21 GLU CG 1 1 5 2303 1 1 15 GLU H H -6.749 5.359 1.643 1.00 . A A . 21 GLU H 1 1 5 2304 1 1 15 GLU HA H -8.126 7.830 2.471 1.00 . A A . 21 GLU HA 1 1 5 2305 1 1 15 GLU HB2 H -8.211 5.075 3.646 1.00 . A A . 21 GLU HB2 1 1 5 2306 1 1 15 GLU HB3 H -8.438 6.473 4.688 1.00 . A A . 21 GLU HB3 1 1 5 2307 1 1 15 GLU HG2 H -10.383 7.141 3.538 1.00 . A A . 21 GLU HG2 1 1 5 2308 1 1 15 GLU HG3 H -10.065 6.033 2.204 1.00 . A A . 21 GLU HG3 1 1 5 2309 1 1 15 GLU N N -7.279 6.180 1.565 1.00 . A A . 21 GLU N 1 1 5 2310 1 1 15 GLU O O -5.928 8.480 3.508 1.00 . A A . 21 GLU O 1 1 5 2311 1 1 15 GLU OE1 O -10.721 3.925 3.570 1.00 . A A . 21 GLU OE1 1 1 5 2312 1 1 15 GLU OE2 O -11.593 5.458 4.881 1.00 . A A . 21 GLU OE2 1 1 5 2313 1 1 16 GLY C C -3.274 6.347 4.144 1.00 . A A . 22 GLY C 1 1 5 2314 1 1 16 GLY CA C -4.528 6.608 4.955 1.00 . A A . 22 GLY CA 1 1 5 2315 1 1 16 GLY H H -6.116 5.443 4.181 1.00 . A A . 22 GLY H 1 1 5 2316 1 1 16 GLY HA2 H -4.530 7.641 5.273 1.00 . A A . 22 GLY HA2 1 1 5 2317 1 1 16 GLY HA3 H -4.517 5.973 5.829 1.00 . A A . 22 GLY HA3 1 1 5 2318 1 1 16 GLY N N -5.739 6.347 4.200 1.00 . A A . 22 GLY N 1 1 5 2319 1 1 16 GLY O O -2.893 5.196 3.932 1.00 . A A . 22 GLY O 1 1 5 2320 1 1 17 GLN C C -0.371 6.442 3.609 1.00 . A A . 23 GLN C 1 1 5 2321 1 1 17 GLN CA C -1.411 7.302 2.895 1.00 . A A . 23 GLN CA 1 1 5 2322 1 1 17 GLN CB C -0.835 8.691 2.600 1.00 . A A . 23 GLN CB 1 1 5 2323 1 1 17 GLN CD C -1.077 9.425 5.009 1.00 . A A . 23 GLN CD 1 1 5 2324 1 1 17 GLN CG C -0.167 9.352 3.799 1.00 . A A . 23 GLN CG 1 1 5 2325 1 1 17 GLN H H -2.986 8.310 3.890 1.00 . A A . 23 GLN H 1 1 5 2326 1 1 17 GLN HA H -1.671 6.826 1.960 1.00 . A A . 23 GLN HA 1 1 5 2327 1 1 17 GLN HB2 H -0.101 8.603 1.813 1.00 . A A . 23 GLN HB2 1 1 5 2328 1 1 17 GLN HB3 H -1.635 9.334 2.263 1.00 . A A . 23 GLN HB3 1 1 5 2329 1 1 17 GLN HE21 H 0.404 8.820 6.189 1.00 . A A . 23 GLN HE21 1 1 5 2330 1 1 17 GLN HE22 H -1.105 9.131 6.975 1.00 . A A . 23 GLN HE22 1 1 5 2331 1 1 17 GLN HG2 H 0.712 8.783 4.063 1.00 . A A . 23 GLN HG2 1 1 5 2332 1 1 17 GLN HG3 H 0.124 10.355 3.524 1.00 . A A . 23 GLN HG3 1 1 5 2333 1 1 17 GLN N N -2.631 7.419 3.688 1.00 . A A . 23 GLN N 1 1 5 2334 1 1 17 GLN NE2 N -0.539 9.092 6.175 1.00 . A A . 23 GLN NE2 1 1 5 2335 1 1 17 GLN O O 0.465 5.803 2.970 1.00 . A A . 23 GLN O 1 1 5 2336 1 1 17 GLN OE1 O -2.251 9.779 4.897 1.00 . A A . 23 GLN OE1 1 1 5 2337 1 1 18 ALA C C 0.570 4.202 5.259 1.00 . A A . 24 ALA C 1 1 5 2338 1 1 18 ALA CA C 0.505 5.649 5.741 1.00 . A A . 24 ALA CA 1 1 5 2339 1 1 18 ALA CB C 0.107 5.700 7.210 1.00 . A A . 24 ALA CB 1 1 5 2340 1 1 18 ALA H H -1.119 6.961 5.389 1.00 . A A . 24 ALA H 1 1 5 2341 1 1 18 ALA HA H 1.484 6.095 5.642 1.00 . A A . 24 ALA HA 1 1 5 2342 1 1 18 ALA HB1 H 0.028 6.730 7.526 1.00 . A A . 24 ALA HB1 1 1 5 2343 1 1 18 ALA HB2 H -0.846 5.209 7.342 1.00 . A A . 24 ALA HB2 1 1 5 2344 1 1 18 ALA HB3 H 0.856 5.197 7.805 1.00 . A A . 24 ALA HB3 1 1 5 2345 1 1 18 ALA N N -0.430 6.431 4.938 1.00 . A A . 24 ALA N 1 1 5 2346 1 1 18 ALA O O 1.593 3.533 5.407 1.00 . A A . 24 ALA O 1 1 5 2347 1 1 19 ALA C C 0.484 2.115 3.125 1.00 . A A . 25 ALA C 1 1 5 2348 1 1 19 ALA CA C -0.594 2.361 4.174 1.00 . A A . 25 ALA CA 1 1 5 2349 1 1 19 ALA CB C -1.975 2.079 3.599 1.00 . A A . 25 ALA CB 1 1 5 2350 1 1 19 ALA H H -1.311 4.308 4.588 1.00 . A A . 25 ALA H 1 1 5 2351 1 1 19 ALA HA H -0.430 1.691 5.006 1.00 . A A . 25 ALA HA 1 1 5 2352 1 1 19 ALA HB1 H -2.647 2.881 3.867 1.00 . A A . 25 ALA HB1 1 1 5 2353 1 1 19 ALA HB2 H -1.911 2.007 2.523 1.00 . A A . 25 ALA HB2 1 1 5 2354 1 1 19 ALA HB3 H -2.349 1.149 4.001 1.00 . A A . 25 ALA HB3 1 1 5 2355 1 1 19 ALA N N -0.528 3.727 4.680 1.00 . A A . 25 ALA N 1 1 5 2356 1 1 19 ALA O O 1.054 1.030 3.049 1.00 . A A . 25 ALA O 1 1 5 2357 1 1 20 LYS C C 3.147 3.448 1.812 1.00 . A A . 26 LYS C 1 1 5 2358 1 1 20 LYS CA C 1.780 3.023 1.281 1.00 . A A . 26 LYS CA 1 1 5 2359 1 1 20 LYS CB C 1.396 3.872 0.068 1.00 . A A . 26 LYS CB 1 1 5 2360 1 1 20 LYS CD C -0.176 2.517 -1.359 1.00 . A A . 26 LYS CD 1 1 5 2361 1 1 20 LYS CE C -1.215 1.507 -0.894 1.00 . A A . 26 LYS CE 1 1 5 2362 1 1 20 LYS CG C -0.044 3.674 -0.378 1.00 . A A . 26 LYS CG 1 1 5 2363 1 1 20 LYS HA H 1.833 1.988 0.981 1.00 . A A . 26 LYS HA 1 1 5 2364 1 1 20 LYS HB2 H 1.535 4.915 0.312 1.00 . A A . 26 LYS HB2 1 1 5 2365 1 1 20 LYS HD2 H -0.475 2.907 -2.321 1.00 . A A . 26 LYS HD2 1 1 5 2366 1 1 20 LYS HE2 H -2.154 2.019 -0.743 1.00 . A A . 26 LYS HE2 1 1 5 2367 1 1 20 LYS HG2 H -0.652 3.465 0.489 1.00 . A A . 26 LYS HG2 1 1 5 2368 1 1 20 LYS HZ1 H -0.063 1.234 0.844 1.00 . A A . 26 LYS HZ1 1 1 5 2369 1 1 20 LYS N N 0.763 3.132 2.320 1.00 . A A . 26 LYS N 1 1 5 2370 1 1 20 LYS NZ N -0.824 0.857 0.355 1.00 . A A . 26 LYS NZ 1 1 5 2371 1 1 20 LYS O O 4.179 3.105 1.239 1.00 . A A . 26 LYS O 1 1 5 2372 1 1 21 GLU C C 5.289 3.516 3.917 1.00 . A A . 27 GLU C 1 1 5 2373 1 1 21 GLU CA C 4.383 4.677 3.515 1.00 . A A . 27 GLU CA 1 1 5 2374 1 1 21 GLU CB C 4.076 5.544 4.738 1.00 . A A . 27 GLU CB 1 1 5 2375 1 1 21 GLU CD C 6.084 7.057 4.472 1.00 . A A . 27 GLU CD 1 1 5 2376 1 1 21 GLU CG C 5.315 6.132 5.395 1.00 . A A . 27 GLU CG 1 1 5 2377 1 1 21 GLU H H 2.290 4.446 3.319 1.00 . A A . 27 GLU H 1 1 5 2378 1 1 21 GLU HA H 4.898 5.278 2.781 1.00 . A A . 27 GLU HA 1 1 5 2379 1 1 21 GLU HB2 H 3.436 6.359 4.435 1.00 . A A . 27 GLU HB2 1 1 5 2380 1 1 21 GLU HB3 H 3.556 4.943 5.470 1.00 . A A . 27 GLU HB3 1 1 5 2381 1 1 21 GLU HG2 H 5.012 6.692 6.267 1.00 . A A . 27 GLU HG2 1 1 5 2382 1 1 21 GLU HG3 H 5.967 5.323 5.694 1.00 . A A . 27 GLU HG3 1 1 5 2383 1 1 21 GLU N N 3.145 4.201 2.909 1.00 . A A . 27 GLU N 1 1 5 2384 1 1 21 GLU O O 6.513 3.650 3.921 1.00 . A A . 27 GLU O 1 1 5 2385 1 1 21 GLU OE1 O 5.655 8.217 4.303 1.00 . A A . 27 GLU OE1 1 1 5 2386 1 1 21 GLU OE2 O 7.114 6.620 3.915 1.00 . A A . 27 GLU OE2 1 1 5 2387 1 1 22 PHE C C 6.013 0.464 3.449 1.00 . A A . 28 PHE C 1 1 5 2388 1 1 22 PHE CA C 5.460 1.206 4.666 1.00 . A A . 28 PHE CA 1 1 5 2389 1 1 22 PHE CB C 4.603 0.270 5.541 1.00 . A A . 28 PHE CB 1 1 5 2390 1 1 22 PHE CD1 C 4.309 -1.767 4.095 1.00 . A A . 28 PHE CD1 1 1 5 2391 1 1 22 PHE CD2 C 2.372 -0.540 4.742 1.00 . A A . 28 PHE CD2 1 1 5 2392 1 1 22 PHE CE1 C 3.517 -2.656 3.395 1.00 . A A . 28 PHE CE1 1 1 5 2393 1 1 22 PHE CE2 C 1.576 -1.425 4.044 1.00 . A A . 28 PHE CE2 1 1 5 2394 1 1 22 PHE CG C 3.744 -0.698 4.775 1.00 . A A . 28 PHE CG 1 1 5 2395 1 1 22 PHE CZ C 2.149 -2.484 3.369 1.00 . A A . 28 PHE CZ 1 1 5 2396 1 1 22 PHE H H 3.710 2.326 4.244 1.00 . A A . 28 PHE H 1 1 5 2397 1 1 22 PHE HA H 6.294 1.559 5.255 1.00 . A A . 28 PHE HA 1 1 5 2398 1 1 22 PHE HB2 H 5.252 -0.309 6.180 1.00 . A A . 28 PHE HB2 1 1 5 2399 1 1 22 PHE HB3 H 3.949 0.871 6.158 1.00 . A A . 28 PHE HB3 1 1 5 2400 1 1 22 PHE HD1 H 1.921 0.289 5.266 1.00 . A A . 28 PHE HD1 1 1 5 2401 1 1 22 PHE HD2 H 5.379 -1.901 4.116 1.00 . A A . 28 PHE HD2 1 1 5 2402 1 1 22 PHE HE1 H 0.506 -1.289 4.030 1.00 . A A . 28 PHE HE1 1 1 5 2403 1 1 22 PHE HE2 H 3.968 -3.484 2.868 1.00 . A A . 28 PHE HE2 1 1 5 2404 1 1 22 PHE HZ H 1.528 -3.177 2.821 1.00 . A A . 28 PHE HZ 1 1 5 2405 1 1 22 PHE N N 4.688 2.378 4.261 1.00 . A A . 28 PHE N 1 1 5 2406 1 1 22 PHE O O 7.169 0.040 3.444 1.00 . A A . 28 PHE O 1 1 5 2407 1 1 23 ILE C C 6.935 0.141 0.687 1.00 . A A . 29 ILE C 1 1 5 2408 1 1 23 ILE CA C 5.601 -0.393 1.205 1.00 . A A . 29 ILE CA 1 1 5 2409 1 1 23 ILE CB C 4.525 -0.294 0.094 1.00 . A A . 29 ILE CB 1 1 5 2410 1 1 23 ILE CD1 C 3.835 -2.606 -0.720 1.00 . A A . 29 ILE CD1 1 1 5 2411 1 1 23 ILE CG1 C 4.730 -1.405 -0.940 1.00 . A A . 29 ILE CG1 1 1 5 2412 1 1 23 ILE CG2 C 4.543 1.075 -0.578 1.00 . A A . 29 ILE CG2 1 1 5 2413 1 1 23 ILE H H 4.273 0.662 2.478 1.00 . A A . 29 ILE H 1 1 5 2414 1 1 23 ILE HA H 5.729 -1.439 1.457 1.00 . A A . 29 ILE HA 1 1 5 2415 1 1 23 ILE HB H 3.556 -0.421 0.554 1.00 . A A . 29 ILE HB 1 1 5 2416 1 1 23 ILE HD11 H 3.688 -2.756 0.339 1.00 . A A . 29 ILE HD11 1 1 5 2417 1 1 23 ILE HD12 H 2.881 -2.435 -1.196 1.00 . A A . 29 ILE HD12 1 1 5 2418 1 1 23 ILE HD13 H 4.298 -3.483 -1.147 1.00 . A A . 29 ILE HD13 1 1 5 2419 1 1 23 ILE HG12 H 4.523 -1.015 -1.925 1.00 . A A . 29 ILE HG12 1 1 5 2420 1 1 23 ILE HG13 H 5.755 -1.742 -0.898 1.00 . A A . 29 ILE HG13 1 1 5 2421 1 1 23 ILE HG21 H 5.229 1.725 -0.059 1.00 . A A . 29 ILE HG21 1 1 5 2422 1 1 23 ILE HG22 H 4.857 0.968 -1.607 1.00 . A A . 29 ILE HG22 1 1 5 2423 1 1 23 ILE HG23 H 3.552 1.503 -0.549 1.00 . A A . 29 ILE HG23 1 1 5 2424 1 1 23 ILE N N 5.184 0.305 2.419 1.00 . A A . 29 ILE N 1 1 5 2425 1 1 23 ILE O O 7.695 -0.580 0.040 1.00 . A A . 29 ILE O 1 1 5 2426 1 1 24 ALA C C 9.620 1.554 1.431 1.00 . A A . 30 ALA C 1 1 5 2427 1 1 24 ALA CA C 8.463 2.028 0.561 1.00 . A A . 30 ALA CA 1 1 5 2428 1 1 24 ALA CB C 8.343 3.544 0.614 1.00 . A A . 30 ALA CB 1 1 5 2429 1 1 24 ALA H H 6.576 1.927 1.511 1.00 . A A . 30 ALA H 1 1 5 2430 1 1 24 ALA HA H 8.650 1.738 -0.463 1.00 . A A . 30 ALA HA 1 1 5 2431 1 1 24 ALA HB1 H 7.423 3.849 0.136 1.00 . A A . 30 ALA HB1 1 1 5 2432 1 1 24 ALA HB2 H 8.339 3.869 1.644 1.00 . A A . 30 ALA HB2 1 1 5 2433 1 1 24 ALA HB3 H 9.181 3.989 0.099 1.00 . A A . 30 ALA HB3 1 1 5 2434 1 1 24 ALA N N 7.218 1.405 0.986 1.00 . A A . 30 ALA N 1 1 5 2435 1 1 24 ALA O O 10.756 1.447 0.970 1.00 . A A . 30 ALA O 1 1 5 2436 1 1 25 TRP C C 10.902 -0.544 3.186 1.00 . A A . 31 TRP C 1 1 5 2437 1 1 25 TRP CA C 10.324 0.797 3.637 1.00 . A A . 31 TRP CA 1 1 5 2438 1 1 25 TRP CB C 9.711 0.672 5.047 1.00 . A A . 31 TRP CB 1 1 5 2439 1 1 25 TRP CD1 C 11.045 -1.283 6.034 1.00 . A A . 31 TRP CD1 1 1 5 2440 1 1 25 TRP CD2 C 8.833 -1.632 5.968 1.00 . A A . 31 TRP CD2 1 1 5 2441 1 1 25 TRP CE2 C 9.454 -2.771 6.513 1.00 . A A . 31 TRP CE2 1 1 5 2442 1 1 25 TRP CE3 C 7.438 -1.629 5.834 1.00 . A A . 31 TRP CE3 1 1 5 2443 1 1 25 TRP CG C 9.872 -0.690 5.664 1.00 . A A . 31 TRP CG 1 1 5 2444 1 1 25 TRP CH2 C 7.376 -3.855 6.779 1.00 . A A . 31 TRP CH2 1 1 5 2445 1 1 25 TRP CZ2 C 8.732 -3.888 6.920 1.00 . A A . 31 TRP CZ2 1 1 5 2446 1 1 25 TRP CZ3 C 6.727 -2.740 6.243 1.00 . A A . 31 TRP CZ3 1 1 5 2447 1 1 25 TRP H H 8.392 1.370 2.997 1.00 . A A . 31 TRP H 1 1 5 2448 1 1 25 TRP HA H 11.119 1.527 3.663 1.00 . A A . 31 TRP HA 1 1 5 2449 1 1 25 TRP HB2 H 10.185 1.389 5.700 1.00 . A A . 31 TRP HB2 1 1 5 2450 1 1 25 TRP HB3 H 8.654 0.890 4.991 1.00 . A A . 31 TRP HB3 1 1 5 2451 1 1 25 TRP HD1 H 12.018 -0.824 5.930 1.00 . A A . 31 TRP HD1 1 1 5 2452 1 1 25 TRP HE1 H 11.484 -3.157 6.872 1.00 . A A . 31 TRP HE1 1 1 5 2453 1 1 25 TRP HE3 H 6.917 -0.782 5.422 1.00 . A A . 31 TRP HE3 1 1 5 2454 1 1 25 TRP HH2 H 6.783 -4.700 7.087 1.00 . A A . 31 TRP HH2 1 1 5 2455 1 1 25 TRP HZ2 H 9.213 -4.759 7.327 1.00 . A A . 31 TRP HZ2 1 1 5 2456 1 1 25 TRP HZ3 H 5.651 -2.754 6.148 1.00 . A A . 31 TRP HZ3 1 1 5 2457 1 1 25 TRP N N 9.317 1.267 2.694 1.00 . A A . 31 TRP N 1 1 5 2458 1 1 25 TRP NE1 N 10.803 -2.535 6.541 1.00 . A A . 31 TRP NE1 1 1 5 2459 1 1 25 TRP O O 12.105 -0.675 2.967 1.00 . A A . 31 TRP O 1 1 5 2460 1 1 26 LEU C C 11.072 -2.907 1.300 1.00 . A A . 32 LEU C 1 1 5 2461 1 1 26 LEU CA C 10.437 -2.882 2.685 1.00 . A A . 32 LEU CA 1 1 5 2462 1 1 26 LEU CB C 9.233 -3.820 2.711 1.00 . A A . 32 LEU CB 1 1 5 2463 1 1 26 LEU CD1 C 7.816 -3.799 0.641 1.00 . A A . 32 LEU CD1 1 1 5 2464 1 1 26 LEU CD2 C 6.749 -3.581 2.885 1.00 . A A . 32 LEU CD2 1 1 5 2465 1 1 26 LEU CG C 7.974 -3.258 2.052 1.00 . A A . 32 LEU CG 1 1 5 2466 1 1 26 LEU H H 9.090 -1.369 3.288 1.00 . A A . 32 LEU H 1 1 5 2467 1 1 26 LEU HA H 11.157 -3.226 3.402 1.00 . A A . 32 LEU HA 1 1 5 2468 1 1 26 LEU HB2 H 9.505 -4.736 2.205 1.00 . A A . 32 LEU HB2 1 1 5 2469 1 1 26 LEU HB3 H 9.004 -4.050 3.740 1.00 . A A . 32 LEU HB3 1 1 5 2470 1 1 26 LEU HD11 H 8.311 -4.757 0.565 1.00 . A A . 32 LEU HD11 1 1 5 2471 1 1 26 LEU HD12 H 6.768 -3.917 0.417 1.00 . A A . 32 LEU HD12 1 1 5 2472 1 1 26 LEU HD13 H 8.258 -3.109 -0.062 1.00 . A A . 32 LEU HD13 1 1 5 2473 1 1 26 LEU HD21 H 6.848 -3.124 3.857 1.00 . A A . 32 LEU HD21 1 1 5 2474 1 1 26 LEU HD22 H 5.868 -3.197 2.395 1.00 . A A . 32 LEU HD22 1 1 5 2475 1 1 26 LEU HD23 H 6.664 -4.650 2.998 1.00 . A A . 32 LEU HD23 1 1 5 2476 1 1 26 LEU HG H 8.060 -2.186 1.990 1.00 . A A . 32 LEU HG 1 1 5 2477 1 1 26 LEU N N 10.032 -1.539 3.078 1.00 . A A . 32 LEU N 1 1 5 2478 1 1 26 LEU O O 12.120 -3.519 1.097 1.00 . A A . 32 LEU O 1 1 5 2479 1 1 27 VAL C C 12.244 -1.494 -1.139 1.00 . A A . 33 VAL C 1 1 5 2480 1 1 27 VAL CA C 10.911 -2.234 -1.024 1.00 . A A . 33 VAL CA 1 1 5 2481 1 1 27 VAL CB C 9.877 -1.592 -1.970 1.00 . A A . 33 VAL CB 1 1 5 2482 1 1 27 VAL CG1 C 9.783 -0.092 -1.729 1.00 . A A . 33 VAL CG1 1 1 5 2483 1 1 27 VAL CG2 C 10.218 -1.894 -3.421 1.00 . A A . 33 VAL CG2 1 1 5 2484 1 1 27 VAL H H 9.581 -1.805 0.562 1.00 . A A . 33 VAL H 1 1 5 2485 1 1 27 VAL HA H 11.061 -3.257 -1.334 1.00 . A A . 33 VAL HA 1 1 5 2486 1 1 27 VAL HB H 8.911 -2.025 -1.755 1.00 . A A . 33 VAL HB 1 1 5 2487 1 1 27 VAL HG11 H 9.938 0.113 -0.679 1.00 . A A . 33 VAL HG11 1 1 5 2488 1 1 27 VAL HG12 H 10.540 0.414 -2.310 1.00 . A A . 33 VAL HG12 1 1 5 2489 1 1 27 VAL HG13 H 8.806 0.260 -2.025 1.00 . A A . 33 VAL HG13 1 1 5 2490 1 1 27 VAL HG21 H 11.260 -2.169 -3.496 1.00 . A A . 33 VAL HG21 1 1 5 2491 1 1 27 VAL HG22 H 9.603 -2.711 -3.772 1.00 . A A . 33 VAL HG22 1 1 5 2492 1 1 27 VAL HG23 H 10.032 -1.018 -4.025 1.00 . A A . 33 VAL HG23 1 1 5 2493 1 1 27 VAL N N 10.420 -2.261 0.345 1.00 . A A . 33 VAL N 1 1 5 2494 1 1 27 VAL O O 13.012 -1.729 -2.071 1.00 . A A . 33 VAL O 1 1 5 2495 1 1 28 ARG C C 14.679 -0.271 0.936 1.00 . A A . 34 ARG C 1 1 5 2496 1 1 28 ARG CA C 13.759 0.163 -0.202 1.00 . A A . 34 ARG CA 1 1 5 2497 1 1 28 ARG CB C 13.465 1.661 -0.097 1.00 . A A . 34 ARG CB 1 1 5 2498 1 1 28 ARG CD C 12.540 3.718 -1.212 1.00 . A A . 34 ARG CD 1 1 5 2499 1 1 28 ARG CG C 12.631 2.200 -1.249 1.00 . A A . 34 ARG CG 1 1 5 2500 1 1 28 ARG CZ C 12.805 5.567 -2.821 1.00 . A A . 34 ARG CZ 1 1 5 2501 1 1 28 ARG H H 11.868 -0.454 0.530 1.00 . A A . 34 ARG H 1 1 5 2502 1 1 28 ARG HA H 14.256 -0.031 -1.141 1.00 . A A . 34 ARG HA 1 1 5 2503 1 1 28 ARG HB2 H 12.934 1.850 0.823 1.00 . A A . 34 ARG HB2 1 1 5 2504 1 1 28 ARG HB3 H 14.402 2.199 -0.078 1.00 . A A . 34 ARG HB3 1 1 5 2505 1 1 28 ARG HD2 H 11.502 4.001 -1.117 1.00 . A A . 34 ARG HD2 1 1 5 2506 1 1 28 ARG HD3 H 13.089 4.080 -0.354 1.00 . A A . 34 ARG HD3 1 1 5 2507 1 1 28 ARG HE H 13.703 3.790 -2.961 1.00 . A A . 34 ARG HE 1 1 5 2508 1 1 28 ARG HG2 H 13.085 1.899 -2.182 1.00 . A A . 34 ARG HG2 1 1 5 2509 1 1 28 ARG HG3 H 11.635 1.787 -1.182 1.00 . A A . 34 ARG HG3 1 1 5 2510 1 1 28 ARG HH11 H 11.568 5.976 -1.274 1.00 . A A . 34 ARG HH11 1 1 5 2511 1 1 28 ARG HH12 H 11.772 7.257 -2.420 1.00 . A A . 34 ARG HH12 1 1 5 2512 1 1 28 ARG HH21 H 13.972 5.476 -4.467 1.00 . A A . 34 ARG HH21 1 1 5 2513 1 1 28 ARG HH22 H 13.135 6.974 -4.232 1.00 . A A . 34 ARG HH22 1 1 5 2514 1 1 28 ARG N N 12.515 -0.601 -0.191 1.00 . A A . 34 ARG N 1 1 5 2515 1 1 28 ARG NE N 13.089 4.330 -2.420 1.00 . A A . 34 ARG NE 1 1 5 2516 1 1 28 ARG NH1 N 11.981 6.329 -2.113 1.00 . A A . 34 ARG NH1 1 1 5 2517 1 1 28 ARG NH2 N 13.349 6.045 -3.931 1.00 . A A . 34 ARG NH2 1 1 5 2518 1 1 28 ARG O O 15.667 -0.971 0.715 1.00 . A A . 34 ARG O 1 1 5 2519 1 1 29 GLY C C 15.143 -1.696 3.587 1.00 . A A . 35 GLY C 1 1 5 2520 1 1 29 GLY CA C 15.153 -0.205 3.306 1.00 . A A . 35 GLY CA 1 1 5 2521 1 1 29 GLY H H 13.549 0.705 2.269 1.00 . A A . 35 GLY H 1 1 5 2522 1 1 29 GLY HA2 H 16.171 0.110 3.131 1.00 . A A . 35 GLY HA2 1 1 5 2523 1 1 29 GLY HA3 H 14.771 0.315 4.172 1.00 . A A . 35 GLY HA3 1 1 5 2524 1 1 29 GLY N N 14.347 0.149 2.153 1.00 . A A . 35 GLY N 1 1 5 2525 1 1 29 GLY O O 15.999 -2.432 3.096 1.00 . A A . 35 GLY O 1 1 5 2526 1 1 30 ARG C C 15.346 -4.060 5.380 1.00 . A A . 36 ARG C 1 1 5 2527 1 1 30 ARG CA C 14.059 -3.553 4.732 1.00 . A A . 36 ARG CA 1 1 5 2528 1 1 30 ARG CB C 13.730 -4.384 3.486 1.00 . A A . 36 ARG CB 1 1 5 2529 1 1 30 ARG CD C 12.258 -6.415 3.729 1.00 . A A . 36 ARG CD 1 1 5 2530 1 1 30 ARG CG C 13.684 -5.884 3.741 1.00 . A A . 36 ARG CG 1 1 5 2531 1 1 30 ARG CZ C 12.287 -8.294 5.324 1.00 . A A . 36 ARG CZ 1 1 5 2532 1 1 30 ARG H H 13.523 -1.505 4.745 1.00 . A A . 36 ARG H 1 1 5 2533 1 1 30 ARG HA H 13.251 -3.652 5.442 1.00 . A A . 36 ARG HA 1 1 5 2534 1 1 30 ARG HB2 H 12.766 -4.077 3.109 1.00 . A A . 36 ARG HB2 1 1 5 2535 1 1 30 ARG HB3 H 14.478 -4.191 2.731 1.00 . A A . 36 ARG HB3 1 1 5 2536 1 1 30 ARG HD2 H 11.581 -5.592 3.556 1.00 . A A . 36 ARG HD2 1 1 5 2537 1 1 30 ARG HD3 H 12.163 -7.133 2.927 1.00 . A A . 36 ARG HD3 1 1 5 2538 1 1 30 ARG HE H 11.355 -6.554 5.621 1.00 . A A . 36 ARG HE 1 1 5 2539 1 1 30 ARG HG2 H 14.250 -6.387 2.971 1.00 . A A . 36 ARG HG2 1 1 5 2540 1 1 30 ARG HG3 H 14.126 -6.089 4.705 1.00 . A A . 36 ARG HG3 1 1 5 2541 1 1 30 ARG HH11 H 13.314 -8.631 3.614 1.00 . A A . 36 ARG HH11 1 1 5 2542 1 1 30 ARG HH12 H 13.317 -9.936 4.752 1.00 . A A . 36 ARG HH12 1 1 5 2543 1 1 30 ARG HH21 H 11.360 -8.271 7.120 1.00 . A A . 36 ARG HH21 1 1 5 2544 1 1 30 ARG HH22 H 12.208 -9.733 6.741 1.00 . A A . 36 ARG HH22 1 1 5 2545 1 1 30 ARG N N 14.174 -2.141 4.383 1.00 . A A . 36 ARG N 1 1 5 2546 1 1 30 ARG NE N 11.905 -7.063 4.990 1.00 . A A . 36 ARG NE 1 1 5 2547 1 1 30 ARG NH1 N 13.034 -9.012 4.495 1.00 . A A . 36 ARG NH1 1 1 5 2548 1 1 30 ARG NH2 N 11.921 -8.808 6.490 1.00 . A A . 36 ARG NH2 1 1 5 2549 1 1 30 ARG O O 16.074 -4.862 4.795 1.00 . A A . 36 ARG O 1 1 5 2550 1 1 31 GLY C C 17.384 -2.900 8.173 1.00 . A A . 37 GLY C 1 1 5 2551 1 1 31 GLY CA C 16.815 -4.000 7.299 1.00 . A A . 37 GLY CA 1 1 5 2552 1 1 31 GLY H H 15.001 -2.948 7.008 1.00 . A A . 37 GLY H 1 1 5 2553 1 1 31 GLY HA2 H 16.575 -4.850 7.920 1.00 . A A . 37 GLY HA2 1 1 5 2554 1 1 31 GLY HA3 H 17.563 -4.295 6.577 1.00 . A A . 37 GLY HA3 1 1 5 2555 1 1 31 GLY N N 15.618 -3.585 6.591 1.00 . A A . 37 GLY N 1 1 5 2556 1 1 31 GLY O O 18.129 -3.221 9.122 1.00 . A A . 37 GLY O 1 1 5 2557 1 1 31 GLY OXT O 17.085 -1.716 7.907 1.00 . A A . 37 GLY OXT 1 1 5 2558 2 2 1 . C02 C -0.154 -4.316 4.155 1.00 . B A . 1038 D6M C02 1 1 5 2559 2 2 1 . C04 C -1.855 -2.620 3.761 1.00 . B A . 1038 D6M C04 1 1 5 2560 2 2 1 . C05 C -1.445 -2.271 2.327 1.00 . B A . 1038 D6M C05 1 1 5 2561 2 2 1 . C06 C -0.980 -0.833 2.160 1.00 . B A . 1038 D6M C06 1 1 5 2562 2 2 1 . C07 C -1.439 -0.208 0.858 1.00 . B A . 1038 D6M C07 1 1 5 2563 2 2 1 . C09 C -3.015 -3.612 3.744 1.00 . B A . 1038 D6M C09 1 1 5 2564 2 2 1 . C12 C 1.083 -4.844 4.860 1.00 . B A . 1038 D6M C12 1 1 5 2565 2 2 1 . C13 C 1.481 -4.033 6.089 1.00 . B A . 1038 D6M C13 1 1 5 2566 2 2 1 . C14 C 2.946 -4.246 6.461 1.00 . B A . 1038 D6M C14 1 1 5 2567 2 2 1 . C15 C 3.285 -5.728 6.599 1.00 . B A . 1038 D6M C15 1 1 5 2568 2 2 1 . C16 C 4.646 -6.064 6.003 1.00 . B A . 1038 D6M C16 1 1 5 2569 2 2 1 . C17 C 4.803 -5.517 4.591 1.00 . B A . 1038 D6M C17 1 1 5 2570 2 2 1 . C18 C 5.241 -6.598 3.612 1.00 . B A . 1038 D6M C18 1 1 5 2571 2 2 1 . C19 C 4.516 -6.474 2.279 1.00 . B A . 1038 D6M C19 1 1 5 2572 2 2 1 . C20 C 5.361 -5.744 1.245 1.00 . B A . 1038 D6M C20 1 1 5 2573 2 2 1 . C21 C 5.050 -6.214 -0.167 1.00 . B A . 1038 D6M C21 1 1 5 2574 2 2 1 . C22 C 6.265 -6.093 -1.077 1.00 . B A . 1038 D6M C22 1 1 5 2575 2 2 1 . C23 C 6.150 -4.897 -2.012 1.00 . B A . 1038 D6M C23 1 1 5 2576 2 2 1 . C24 C 7.219 -4.924 -3.096 1.00 . B A . 1038 D6M C24 1 1 5 2577 2 2 1 . C25 C 8.622 -4.998 -2.507 1.00 . B A . 1038 D6M C25 1 1 5 2578 2 2 1 . C26 C 9.318 -6.290 -2.880 1.00 . B A . 1038 D6M C26 1 1 5 2579 2 2 1 . H03 H -0.460 -2.746 5.344 1.00 . B A . 1038 D6M H03 1 1 5 2580 2 2 1 . H04 H -2.176 -1.720 4.263 1.00 . B A . 1038 D6M H04 1 1 5 2581 2 2 1 . HP21 H 1.903 -4.834 4.159 1.00 . B A . 1038 D6M HP21 1 1 5 2582 2 2 1 . HP22 H 0.889 -5.858 5.168 1.00 . B A . 1038 D6M HP22 1 1 5 2583 2 2 1 . HP31 H 0.861 -4.333 6.921 1.00 . B A . 1038 D6M HP31 1 1 5 2584 2 2 1 . HP32 H 1.326 -2.985 5.885 1.00 . B A . 1038 D6M HP32 1 1 5 2585 2 2 1 . HP41 H 3.141 -3.754 7.403 1.00 . B A . 1038 D6M HP41 1 1 5 2586 2 2 1 . HP42 H 3.570 -3.809 5.696 1.00 . B A . 1038 D6M HP42 1 1 5 2587 2 2 1 . HP51 H 2.529 -6.311 6.095 1.00 . B A . 1038 D6M HP51 1 1 5 2588 2 2 1 . HP52 H 3.294 -5.986 7.647 1.00 . B A . 1038 D6M HP52 1 1 5 2589 2 2 1 . HP61 H 4.759 -7.138 5.978 1.00 . B A . 1038 D6M HP61 1 1 5 2590 2 2 1 . HP62 H 5.413 -5.637 6.628 1.00 . B A . 1038 D6M HP62 1 1 5 2591 2 2 1 . HP71 H 5.544 -4.732 4.606 1.00 . B A . 1038 D6M HP71 1 1 5 2592 2 2 1 . HP72 H 3.857 -5.114 4.263 1.00 . B A . 1038 D6M HP72 1 1 5 2593 2 2 1 . HP81 H 5.024 -7.566 4.041 1.00 . B A . 1038 D6M HP81 1 1 5 2594 2 2 1 . HP82 H 6.303 -6.508 3.443 1.00 . B A . 1038 D6M HP82 1 1 5 2595 2 2 1 . HP91 H 3.597 -5.927 2.430 1.00 . B A . 1038 D6M HP91 1 1 5 2596 2 2 1 . HP92 H 4.291 -7.463 1.909 1.00 . B A . 1038 D6M HP92 1 1 5 2597 2 2 1 . HPA1 H 6.405 -5.927 1.454 1.00 . B A . 1038 D6M HPA1 1 1 5 2598 2 2 1 . HPA2 H 5.160 -4.685 1.313 1.00 . B A . 1038 D6M HPA2 1 1 5 2599 2 2 1 . HPB1 H 4.249 -5.610 -0.569 1.00 . B A . 1038 D6M HPB1 1 1 5 2600 2 2 1 . HPB2 H 4.741 -7.248 -0.133 1.00 . B A . 1038 D6M HPB2 1 1 5 2601 2 2 1 . HPC1 H 6.350 -6.993 -1.667 1.00 . B A . 1038 D6M HPC1 1 1 5 2602 2 2 1 . HPC2 H 7.148 -5.975 -0.468 1.00 . B A . 1038 D6M HPC2 1 1 5 2603 2 2 1 . HPD1 H 6.256 -3.990 -1.436 1.00 . B A . 1038 D6M HPD1 1 1 5 2604 2 2 1 . HPD2 H 5.178 -4.914 -2.482 1.00 . B A . 1038 D6M HPD2 1 1 5 2605 2 2 1 . HPE1 H 7.137 -4.024 -3.689 1.00 . B A . 1038 D6M HPE1 1 1 5 2606 2 2 1 . HPE2 H 7.058 -5.786 -3.725 1.00 . B A . 1038 D6M HPE2 1 1 5 2607 2 2 1 . HPF1 H 8.559 -4.939 -1.430 1.00 . B A . 1038 D6M HPF1 1 1 5 2608 2 2 1 . HPF2 H 9.208 -4.173 -2.884 1.00 . B A . 1038 D6M HPF2 1 1 5 2609 2 2 1 . HPG1 H 10.334 -6.271 -2.513 1.00 . B A . 1038 D6M HPG1 1 1 5 2610 2 2 1 . HPG2 H 9.326 -6.397 -3.955 1.00 . B A . 1038 D6M HPG2 1 1 5 2611 2 2 1 . HPG3 H 8.792 -7.124 -2.439 1.00 . B A . 1038 D6M HPG3 1 1 5 2612 2 2 1 . HQ21 H -1.367 -0.245 2.979 1.00 . B A . 1038 D6M HQ21 1 1 5 2613 2 2 1 . HQ22 H 0.098 -0.814 2.184 1.00 . B A . 1038 D6M HQ22 1 1 5 2614 2 2 1 . HQ31 H -0.637 -2.923 2.030 1.00 . B A . 1038 D6M HQ31 1 1 5 2615 2 2 1 . HQ32 H -2.288 -2.434 1.672 1.00 . B A . 1038 D6M HQ32 1 1 5 2616 2 2 1 . N03 N -0.717 -3.163 4.499 1.00 . B A . 1038 D6M N03 1 1 5 2617 2 2 1 . O01 O -0.589 -4.956 3.197 1.00 . B A . 1038 D6M O01 1 1 5 2618 2 2 1 . O08 O -2.398 -0.710 0.273 1.00 . B A . 1038 D6M O08 1 1 5 2619 2 2 1 . O10 O -3.088 -4.419 2.794 1.00 . B A . 1038 D6M O10 1 1 5 2620 2 2 1 . O11 O -3.839 -3.572 4.681 1.00 . B A . 1038 D6M O11 1 1 6 2621 1 1 1 HIS C C -30.185 -3.439 0.953 1.00 . A A . 7 HIS C 1 1 6 2622 1 1 1 HIS CA C -31.257 -4.293 0.283 1.00 . A A . 7 HIS CA 1 1 6 2623 1 1 1 HIS CB C -31.345 -3.958 -1.207 1.00 . A A . 7 HIS CB 1 1 6 2624 1 1 1 HIS CD2 C -31.445 -1.387 -1.542 1.00 . A A . 7 HIS CD2 1 1 6 2625 1 1 1 HIS CE1 C -33.591 -1.201 -1.950 1.00 . A A . 7 HIS CE1 1 1 6 2626 1 1 1 HIS CG C -31.979 -2.630 -1.485 1.00 . A A . 7 HIS CG 1 1 6 2627 1 1 1 HIS H1 H -32.778 -3.042 0.879 1.00 . A A . 7 HIS H1 1 1 6 2628 1 1 1 HIS H2 H -33.293 -4.584 0.336 1.00 . A A . 7 HIS H2 1 1 6 2629 1 1 1 HIS H3 H -32.554 -4.421 1.876 1.00 . A A . 7 HIS H3 1 1 6 2630 1 1 1 HIS HA H -30.999 -5.335 0.398 1.00 . A A . 7 HIS HA 1 1 6 2631 1 1 1 HIS HB2 H -30.349 -3.944 -1.625 1.00 . A A . 7 HIS HB2 1 1 6 2632 1 1 1 HIS HB3 H -31.929 -4.717 -1.705 1.00 . A A . 7 HIS HB3 1 1 6 2633 1 1 1 HIS HD1 H -33.986 -3.201 -1.775 1.00 . A A . 7 HIS HD1 1 1 6 2634 1 1 1 HIS HD2 H -30.407 -1.127 -1.388 1.00 . A A . 7 HIS HD2 1 1 6 2635 1 1 1 HIS HE1 H -34.562 -0.787 -2.174 1.00 . A A . 7 HIS HE1 1 1 6 2636 1 1 1 HIS HE2 H -32.396 0.459 -1.854 1.00 . A A . 7 HIS HE2 1 1 6 2637 1 1 1 HIS N N -32.591 -4.064 0.899 1.00 . A A . 7 HIS N 1 1 6 2638 1 1 1 HIS ND1 N -33.325 -2.479 -1.745 1.00 . A A . 7 HIS ND1 1 1 6 2639 1 1 1 HIS NE2 N -32.468 -0.518 -1.832 1.00 . A A . 7 HIS NE2 1 1 6 2640 1 1 1 HIS O O -30.491 -2.569 1.769 1.00 . A A . 7 HIS O 1 1 6 2641 1 1 2 ALA C C -27.677 -1.577 0.514 1.00 . A A . 8 ALA C 1 1 6 2642 1 1 2 ALA CA C -27.811 -2.948 1.169 1.00 . A A . 8 ALA CA 1 1 6 2643 1 1 2 ALA CB C -26.519 -3.737 1.019 1.00 . A A . 8 ALA CB 1 1 6 2644 1 1 2 ALA H H -28.748 -4.399 -0.053 1.00 . A A . 8 ALA H 1 1 6 2645 1 1 2 ALA HA H -28.002 -2.813 2.224 1.00 . A A . 8 ALA HA 1 1 6 2646 1 1 2 ALA HB1 H -26.747 -4.790 0.944 1.00 . A A . 8 ALA HB1 1 1 6 2647 1 1 2 ALA HB2 H -26.003 -3.416 0.126 1.00 . A A . 8 ALA HB2 1 1 6 2648 1 1 2 ALA HB3 H -25.890 -3.565 1.880 1.00 . A A . 8 ALA HB3 1 1 6 2649 1 1 2 ALA N N -28.929 -3.693 0.602 1.00 . A A . 8 ALA N 1 1 6 2650 1 1 2 ALA O O -28.266 -1.320 -0.537 1.00 . A A . 8 ALA O 1 1 6 2651 1 1 3 GLU C C -25.426 0.707 -0.232 1.00 . A A . 9 GLU C 1 1 6 2652 1 1 3 GLU CA C -26.690 0.645 0.619 1.00 . A A . 9 GLU CA 1 1 6 2653 1 1 3 GLU CB C -26.598 1.651 1.766 1.00 . A A . 9 GLU CB 1 1 6 2654 1 1 3 GLU CD C -26.319 4.161 1.865 1.00 . A A . 9 GLU CD 1 1 6 2655 1 1 3 GLU CG C -27.203 3.006 1.435 1.00 . A A . 9 GLU CG 1 1 6 2656 1 1 3 GLU H H -26.459 -0.964 1.975 1.00 . A A . 9 GLU H 1 1 6 2657 1 1 3 GLU HA H -27.539 0.895 0.000 1.00 . A A . 9 GLU HA 1 1 6 2658 1 1 3 GLU HB2 H -27.117 1.250 2.625 1.00 . A A . 9 GLU HB2 1 1 6 2659 1 1 3 GLU HB3 H -25.559 1.796 2.020 1.00 . A A . 9 GLU HB3 1 1 6 2660 1 1 3 GLU HG2 H -27.354 3.067 0.368 1.00 . A A . 9 GLU HG2 1 1 6 2661 1 1 3 GLU HG3 H -28.155 3.094 1.938 1.00 . A A . 9 GLU HG3 1 1 6 2662 1 1 3 GLU N N -26.900 -0.700 1.141 1.00 . A A . 9 GLU N 1 1 6 2663 1 1 3 GLU O O -24.619 -0.222 -0.232 1.00 . A A . 9 GLU O 1 1 6 2664 1 1 3 GLU OE1 O -26.426 4.587 3.034 1.00 . A A . 9 GLU OE1 1 1 6 2665 1 1 3 GLU OE2 O -25.520 4.638 1.033 1.00 . A A . 9 GLU OE2 1 1 6 2666 1 1 4 GLY C C -22.840 2.295 -1.013 1.00 . A A . 10 GLY C 1 1 6 2667 1 1 4 GLY CA C -24.092 1.970 -1.804 1.00 . A A . 10 GLY CA 1 1 6 2668 1 1 4 GLY H H -25.937 2.516 -0.919 1.00 . A A . 10 GLY H 1 1 6 2669 1 1 4 GLY HA2 H -23.931 1.054 -2.353 1.00 . A A . 10 GLY HA2 1 1 6 2670 1 1 4 GLY HA3 H -24.279 2.769 -2.505 1.00 . A A . 10 GLY HA3 1 1 6 2671 1 1 4 GLY N N -25.260 1.808 -0.957 1.00 . A A . 10 GLY N 1 1 6 2672 1 1 4 GLY O O -22.650 3.430 -0.577 1.00 . A A . 10 GLY O 1 1 6 2673 1 1 5 THR C C -19.641 0.571 -0.628 1.00 . A A . 11 THR C 1 1 6 2674 1 1 5 THR CA C -20.739 1.481 -0.087 1.00 . A A . 11 THR CA 1 1 6 2675 1 1 5 THR CB C -20.961 1.203 1.401 1.00 . A A . 11 THR CB 1 1 6 2676 1 1 5 THR CG2 C -21.702 -0.090 1.663 1.00 . A A . 11 THR CG2 1 1 6 2677 1 1 5 THR H H -22.188 0.414 -1.202 1.00 . A A . 11 THR H 1 1 6 2678 1 1 5 THR HA H -20.430 2.508 -0.209 1.00 . A A . 11 THR HA 1 1 6 2679 1 1 5 THR HB H -21.541 2.009 1.825 1.00 . A A . 11 THR HB 1 1 6 2680 1 1 5 THR HG1 H -19.781 1.644 2.901 1.00 . A A . 11 THR HG1 1 1 6 2681 1 1 5 THR HG21 H -22.143 -0.445 0.744 1.00 . A A . 11 THR HG21 1 1 6 2682 1 1 5 THR HG22 H -21.013 -0.831 2.041 1.00 . A A . 11 THR HG22 1 1 6 2683 1 1 5 THR HG23 H -22.480 0.083 2.392 1.00 . A A . 11 THR HG23 1 1 6 2684 1 1 5 THR N N -21.981 1.296 -0.829 1.00 . A A . 11 THR N 1 1 6 2685 1 1 5 THR O O -19.639 -0.634 -0.376 1.00 . A A . 11 THR O 1 1 6 2686 1 1 5 THR OG1 O -19.724 1.136 2.089 1.00 . A A . 11 THR OG1 1 1 6 2687 1 1 6 PHE C C -16.437 1.314 -2.300 1.00 . A A . 12 PHE C 1 1 6 2688 1 1 6 PHE CA C -17.605 0.397 -1.952 1.00 . A A . 12 PHE CA 1 1 6 2689 1 1 6 PHE CB C -18.076 -0.353 -3.200 1.00 . A A . 12 PHE CB 1 1 6 2690 1 1 6 PHE CD1 C -19.281 -2.440 -2.502 1.00 . A A . 12 PHE CD1 1 1 6 2691 1 1 6 PHE CD2 C -17.060 -2.642 -3.348 1.00 . A A . 12 PHE CD2 1 1 6 2692 1 1 6 PHE CE1 C -19.342 -3.810 -2.328 1.00 . A A . 12 PHE CE1 1 1 6 2693 1 1 6 PHE CE2 C -17.116 -4.012 -3.177 1.00 . A A . 12 PHE CE2 1 1 6 2694 1 1 6 PHE CG C -18.140 -1.842 -3.013 1.00 . A A . 12 PHE CG 1 1 6 2695 1 1 6 PHE CZ C -18.258 -4.597 -2.666 1.00 . A A . 12 PHE CZ 1 1 6 2696 1 1 6 PHE H H -18.765 2.119 -1.540 1.00 . A A . 12 PHE H 1 1 6 2697 1 1 6 PHE HA H -17.275 -0.321 -1.216 1.00 . A A . 12 PHE HA 1 1 6 2698 1 1 6 PHE HB2 H -19.064 -0.010 -3.467 1.00 . A A . 12 PHE HB2 1 1 6 2699 1 1 6 PHE HB3 H -17.396 -0.149 -4.015 1.00 . A A . 12 PHE HB3 1 1 6 2700 1 1 6 PHE HD1 H -20.129 -1.826 -2.238 1.00 . A A . 12 PHE HD1 1 1 6 2701 1 1 6 PHE HD2 H -16.167 -2.186 -3.748 1.00 . A A . 12 PHE HD2 1 1 6 2702 1 1 6 PHE HE1 H -20.237 -4.264 -1.928 1.00 . A A . 12 PHE HE1 1 1 6 2703 1 1 6 PHE HE2 H -16.267 -4.625 -3.441 1.00 . A A . 12 PHE HE2 1 1 6 2704 1 1 6 PHE HZ H -18.304 -5.667 -2.531 1.00 . A A . 12 PHE HZ 1 1 6 2705 1 1 6 PHE N N -18.709 1.155 -1.374 1.00 . A A . 12 PHE N 1 1 6 2706 1 1 6 PHE O O -15.328 1.140 -1.797 1.00 . A A . 12 PHE O 1 1 6 2707 1 1 7 THR C C -14.937 3.847 -2.396 1.00 . A A . 13 THR C 1 1 6 2708 1 1 7 THR CA C -15.671 3.239 -3.590 1.00 . A A . 13 THR CA 1 1 6 2709 1 1 7 THR CB C -16.301 4.352 -4.427 1.00 . A A . 13 THR CB 1 1 6 2710 1 1 7 THR CG2 C -17.012 3.843 -5.660 1.00 . A A . 13 THR CG2 1 1 6 2711 1 1 7 THR H H -17.602 2.373 -3.529 1.00 . A A . 13 THR H 1 1 6 2712 1 1 7 THR HA H -14.959 2.705 -4.200 1.00 . A A . 13 THR HA 1 1 6 2713 1 1 7 THR HB H -15.524 5.030 -4.749 1.00 . A A . 13 THR HB 1 1 6 2714 1 1 7 THR HG1 H -17.997 4.528 -3.464 1.00 . A A . 13 THR HG1 1 1 6 2715 1 1 7 THR HG21 H -17.457 2.882 -5.447 1.00 . A A . 13 THR HG21 1 1 6 2716 1 1 7 THR HG22 H -17.783 4.542 -5.946 1.00 . A A . 13 THR HG22 1 1 6 2717 1 1 7 THR HG23 H -16.302 3.740 -6.468 1.00 . A A . 13 THR HG23 1 1 6 2718 1 1 7 THR N N -16.697 2.289 -3.165 1.00 . A A . 13 THR N 1 1 6 2719 1 1 7 THR O O -13.793 4.283 -2.518 1.00 . A A . 13 THR O 1 1 6 2720 1 1 7 THR OG1 O -17.241 5.085 -3.661 1.00 . A A . 13 THR OG1 1 1 6 2721 1 1 8 SER C C -14.157 3.437 0.705 1.00 . A A . 14 SER C 1 1 6 2722 1 1 8 SER CA C -15.014 4.457 -0.044 1.00 . A A . 14 SER CA 1 1 6 2723 1 1 8 SER CB C -16.110 4.988 0.881 1.00 . A A . 14 SER CB 1 1 6 2724 1 1 8 SER H H -16.519 3.534 -1.212 1.00 . A A . 14 SER H 1 1 6 2725 1 1 8 SER HA H -14.386 5.280 -0.348 1.00 . A A . 14 SER HA 1 1 6 2726 1 1 8 SER HB2 H -16.326 4.251 1.640 1.00 . A A . 14 SER HB2 1 1 6 2727 1 1 8 SER HB3 H -15.770 5.900 1.351 1.00 . A A . 14 SER HB3 1 1 6 2728 1 1 8 SER HG H -17.096 5.818 -0.594 1.00 . A A . 14 SER HG 1 1 6 2729 1 1 8 SER N N -15.605 3.886 -1.248 1.00 . A A . 14 SER N 1 1 6 2730 1 1 8 SER O O -13.157 3.796 1.327 1.00 . A A . 14 SER O 1 1 6 2731 1 1 8 SER OG O -17.299 5.261 0.161 1.00 . A A . 14 SER OG 1 1 6 2732 1 1 9 ASP C C -12.741 0.503 0.456 1.00 . A A . 15 ASP C 1 1 6 2733 1 1 9 ASP CA C -13.821 1.114 1.346 1.00 . A A . 15 ASP CA 1 1 6 2734 1 1 9 ASP CB C -14.779 0.021 1.827 1.00 . A A . 15 ASP CB 1 1 6 2735 1 1 9 ASP CG C -15.745 -0.424 0.747 1.00 . A A . 15 ASP CG 1 1 6 2736 1 1 9 ASP H H -15.365 1.942 0.151 1.00 . A A . 15 ASP H 1 1 6 2737 1 1 9 ASP HA H -13.344 1.559 2.207 1.00 . A A . 15 ASP HA 1 1 6 2738 1 1 9 ASP HB2 H -14.206 -0.837 2.144 1.00 . A A . 15 ASP HB2 1 1 6 2739 1 1 9 ASP HB3 H -15.350 0.396 2.663 1.00 . A A . 15 ASP HB3 1 1 6 2740 1 1 9 ASP N N -14.556 2.170 0.655 1.00 . A A . 15 ASP N 1 1 6 2741 1 1 9 ASP O O -11.652 0.174 0.928 1.00 . A A . 15 ASP O 1 1 6 2742 1 1 9 ASP OD1 O -15.278 -0.862 -0.325 1.00 . A A . 15 ASP OD1 1 1 6 2743 1 1 9 ASP OD2 O -16.970 -0.336 0.975 1.00 . A A . 15 ASP OD2 1 1 6 2744 1 1 10 VAL C C -10.798 0.573 -1.829 1.00 . A A . 16 VAL C 1 1 6 2745 1 1 10 VAL CA C -12.092 -0.234 -1.768 1.00 . A A . 16 VAL CA 1 1 6 2746 1 1 10 VAL CB C -12.684 -0.351 -3.183 1.00 . A A . 16 VAL CB 1 1 6 2747 1 1 10 VAL CG1 C -13.689 -1.491 -3.236 1.00 . A A . 16 VAL CG1 1 1 6 2748 1 1 10 VAL CG2 C -13.321 0.963 -3.612 1.00 . A A . 16 VAL CG2 1 1 6 2749 1 1 10 VAL H H -13.928 0.620 -1.148 1.00 . A A . 16 VAL H 1 1 6 2750 1 1 10 VAL HA H -11.861 -1.230 -1.422 1.00 . A A . 16 VAL HA 1 1 6 2751 1 1 10 VAL HB H -11.882 -0.579 -3.868 1.00 . A A . 16 VAL HB 1 1 6 2752 1 1 10 VAL HG11 H -13.425 -2.235 -2.497 1.00 . A A . 16 VAL HG11 1 1 6 2753 1 1 10 VAL HG12 H -14.677 -1.110 -3.026 1.00 . A A . 16 VAL HG12 1 1 6 2754 1 1 10 VAL HG13 H -13.676 -1.937 -4.219 1.00 . A A . 16 VAL HG13 1 1 6 2755 1 1 10 VAL HG21 H -13.372 1.633 -2.766 1.00 . A A . 16 VAL HG21 1 1 6 2756 1 1 10 VAL HG22 H -12.724 1.413 -4.392 1.00 . A A . 16 VAL HG22 1 1 6 2757 1 1 10 VAL HG23 H -14.317 0.777 -3.984 1.00 . A A . 16 VAL HG23 1 1 6 2758 1 1 10 VAL N N -13.045 0.346 -0.828 1.00 . A A . 16 VAL N 1 1 6 2759 1 1 10 VAL O O -9.762 0.073 -2.266 1.00 . A A . 16 VAL O 1 1 6 2760 1 1 11 SER C C -8.703 2.268 -0.288 1.00 . A A . 17 SER C 1 1 6 2761 1 1 11 SER CA C -9.679 2.680 -1.390 1.00 . A A . 17 SER CA 1 1 6 2762 1 1 11 SER CB C -10.089 4.142 -1.203 1.00 . A A . 17 SER CB 1 1 6 2763 1 1 11 SER H H -11.705 2.174 -1.047 1.00 . A A . 17 SER H 1 1 6 2764 1 1 11 SER HA H -9.192 2.571 -2.347 1.00 . A A . 17 SER HA 1 1 6 2765 1 1 11 SER HB2 H -10.557 4.263 -0.237 1.00 . A A . 17 SER HB2 1 1 6 2766 1 1 11 SER HB3 H -9.211 4.770 -1.258 1.00 . A A . 17 SER HB3 1 1 6 2767 1 1 11 SER HG H -10.551 5.097 -2.850 1.00 . A A . 17 SER HG 1 1 6 2768 1 1 11 SER N N -10.856 1.822 -1.387 1.00 . A A . 17 SER N 1 1 6 2769 1 1 11 SER O O -7.522 2.614 -0.332 1.00 . A A . 17 SER O 1 1 6 2770 1 1 11 SER OG O -11.004 4.548 -2.206 1.00 . A A . 17 SER OG 1 1 6 2771 1 1 12 SER C C -7.743 -0.271 1.571 1.00 . A A . 18 SER C 1 1 6 2772 1 1 12 SER CA C -8.383 1.095 1.827 1.00 . A A . 18 SER CA 1 1 6 2773 1 1 12 SER CB C -9.221 1.040 3.105 1.00 . A A . 18 SER CB 1 1 6 2774 1 1 12 SER H H -10.158 1.303 0.694 1.00 . A A . 18 SER H 1 1 6 2775 1 1 12 SER HA H -7.597 1.822 1.962 1.00 . A A . 18 SER HA 1 1 6 2776 1 1 12 SER HB2 H -9.452 2.045 3.425 1.00 . A A . 18 SER HB2 1 1 6 2777 1 1 12 SER HB3 H -10.139 0.505 2.908 1.00 . A A . 18 SER HB3 1 1 6 2778 1 1 12 SER HG H -7.686 0.824 4.303 1.00 . A A . 18 SER HG 1 1 6 2779 1 1 12 SER N N -9.207 1.539 0.707 1.00 . A A . 18 SER N 1 1 6 2780 1 1 12 SER O O -6.519 -0.401 1.586 1.00 . A A . 18 SER O 1 1 6 2781 1 1 12 SER OG O -8.523 0.379 4.146 1.00 . A A . 18 SER OG 1 1 6 2782 1 1 13 TYR C C -6.922 -2.683 0.147 1.00 . A A . 19 TYR C 1 1 6 2783 1 1 13 TYR CA C -8.083 -2.657 1.143 1.00 . A A . 19 TYR CA 1 1 6 2784 1 1 13 TYR CB C -9.220 -3.574 0.663 1.00 . A A . 19 TYR CB 1 1 6 2785 1 1 13 TYR CD1 C -9.805 -2.540 -1.559 1.00 . A A . 19 TYR CD1 1 1 6 2786 1 1 13 TYR CD2 C -9.102 -4.813 -1.535 1.00 . A A . 19 TYR CD2 1 1 6 2787 1 1 13 TYR CE1 C -9.954 -2.594 -2.932 1.00 . A A . 19 TYR CE1 1 1 6 2788 1 1 13 TYR CE2 C -9.248 -4.879 -2.908 1.00 . A A . 19 TYR CE2 1 1 6 2789 1 1 13 TYR CG C -9.379 -3.643 -0.840 1.00 . A A . 19 TYR CG 1 1 6 2790 1 1 13 TYR CZ C -9.674 -3.766 -3.602 1.00 . A A . 19 TYR CZ 1 1 6 2791 1 1 13 TYR H H -9.541 -1.134 1.388 1.00 . A A . 19 TYR H 1 1 6 2792 1 1 13 TYR HA H -7.721 -3.026 2.091 1.00 . A A . 19 TYR HA 1 1 6 2793 1 1 13 TYR HB2 H -9.038 -4.576 1.019 1.00 . A A . 19 TYR HB2 1 1 6 2794 1 1 13 TYR HB3 H -10.154 -3.217 1.075 1.00 . A A . 19 TYR HB3 1 1 6 2795 1 1 13 TYR HD1 H -8.769 -5.683 -0.988 1.00 . A A . 19 TYR HD1 1 1 6 2796 1 1 13 TYR HD2 H -10.022 -1.626 -1.029 1.00 . A A . 19 TYR HD2 1 1 6 2797 1 1 13 TYR HE1 H -9.028 -5.798 -3.431 1.00 . A A . 19 TYR HE1 1 1 6 2798 1 1 13 TYR HE2 H -10.288 -1.722 -3.474 1.00 . A A . 19 TYR HE2 1 1 6 2799 1 1 13 TYR HH H -10.747 -3.711 -5.196 1.00 . A A . 19 TYR HH 1 1 6 2800 1 1 13 TYR N N -8.575 -1.294 1.367 1.00 . A A . 19 TYR N 1 1 6 2801 1 1 13 TYR O O -5.984 -3.466 0.296 1.00 . A A . 19 TYR O 1 1 6 2802 1 1 13 TYR OH O -9.821 -3.826 -4.968 1.00 . A A . 19 TYR OH 1 1 6 2803 1 1 14 LEU C C -4.571 -1.572 -1.248 1.00 . A A . 20 LEU C 1 1 6 2804 1 1 14 LEU CA C -5.945 -1.762 -1.885 1.00 . A A . 20 LEU CA 1 1 6 2805 1 1 14 LEU CB C -6.226 -0.624 -2.870 1.00 . A A . 20 LEU CB 1 1 6 2806 1 1 14 LEU CD1 C -5.307 1.294 -1.539 1.00 . A A . 20 LEU CD1 1 1 6 2807 1 1 14 LEU CD2 C -7.054 1.705 -3.280 1.00 . A A . 20 LEU CD2 1 1 6 2808 1 1 14 LEU CG C -6.538 0.731 -2.231 1.00 . A A . 20 LEU CG 1 1 6 2809 1 1 14 LEU H H -7.764 -1.229 -0.938 1.00 . A A . 20 LEU H 1 1 6 2810 1 1 14 LEU HA H -5.950 -2.698 -2.423 1.00 . A A . 20 LEU HA 1 1 6 2811 1 1 14 LEU HB2 H -5.361 -0.507 -3.507 1.00 . A A . 20 LEU HB2 1 1 6 2812 1 1 14 LEU HB3 H -7.067 -0.909 -3.484 1.00 . A A . 20 LEU HB3 1 1 6 2813 1 1 14 LEU HD11 H -4.418 0.885 -1.996 1.00 . A A . 20 LEU HD11 1 1 6 2814 1 1 14 LEU HD12 H -5.300 2.370 -1.636 1.00 . A A . 20 LEU HD12 1 1 6 2815 1 1 14 LEU HD13 H -5.329 1.027 -0.492 1.00 . A A . 20 LEU HD13 1 1 6 2816 1 1 14 LEU HD21 H -6.354 1.753 -4.101 1.00 . A A . 20 LEU HD21 1 1 6 2817 1 1 14 LEU HD22 H -8.013 1.367 -3.643 1.00 . A A . 20 LEU HD22 1 1 6 2818 1 1 14 LEU HD23 H -7.160 2.685 -2.839 1.00 . A A . 20 LEU HD23 1 1 6 2819 1 1 14 LEU HG H -7.309 0.601 -1.487 1.00 . A A . 20 LEU HG 1 1 6 2820 1 1 14 LEU N N -6.991 -1.827 -0.869 1.00 . A A . 20 LEU N 1 1 6 2821 1 1 14 LEU O O -4.453 -1.016 -0.156 1.00 . A A . 20 LEU O 1 1 6 2822 1 1 15 GLU C C -2.012 -2.643 -0.105 1.00 . A A . 21 GLU C 1 1 6 2823 1 1 15 GLU CA C -2.169 -1.921 -1.440 1.00 . A A . 21 GLU CA 1 1 6 2824 1 1 15 GLU CB C -1.785 -0.449 -1.285 1.00 . A A . 21 GLU CB 1 1 6 2825 1 1 15 GLU CD C 0.244 -0.342 -2.786 1.00 . A A . 21 GLU CD 1 1 6 2826 1 1 15 GLU CG C -1.167 0.153 -2.537 1.00 . A A . 21 GLU CG 1 1 6 2827 1 1 15 GLU H H -3.693 -2.473 -2.802 1.00 . A A . 21 GLU H 1 1 6 2828 1 1 15 GLU HA H -1.512 -2.381 -2.163 1.00 . A A . 21 GLU HA 1 1 6 2829 1 1 15 GLU HB2 H -2.670 0.118 -1.038 1.00 . A A . 21 GLU HB2 1 1 6 2830 1 1 15 GLU HB3 H -1.072 -0.357 -0.478 1.00 . A A . 21 GLU HB3 1 1 6 2831 1 1 15 GLU HG2 H -1.779 -0.109 -3.387 1.00 . A A . 21 GLU HG2 1 1 6 2832 1 1 15 GLU HG3 H -1.142 1.228 -2.429 1.00 . A A . 21 GLU HG3 1 1 6 2833 1 1 15 GLU N N -3.535 -2.039 -1.938 1.00 . A A . 21 GLU N 1 1 6 2834 1 1 15 GLU O O -2.996 -2.916 0.583 1.00 . A A . 21 GLU O 1 1 6 2835 1 1 15 GLU OE1 O 0.538 -1.503 -2.430 1.00 . A A . 21 GLU OE1 1 1 6 2836 1 1 15 GLU OE2 O 1.056 0.430 -3.337 1.00 . A A . 21 GLU OE2 1 1 6 2837 1 1 16 GLY C C 0.974 -3.781 1.791 1.00 . A A . 22 GLY C 1 1 6 2838 1 1 16 GLY CA C -0.508 -3.635 1.506 1.00 . A A . 22 GLY CA 1 1 6 2839 1 1 16 GLY H H -0.025 -2.706 -0.334 1.00 . A A . 22 GLY H 1 1 6 2840 1 1 16 GLY HA2 H -0.965 -3.079 2.311 1.00 . A A . 22 GLY HA2 1 1 6 2841 1 1 16 GLY HA3 H -0.954 -4.618 1.464 1.00 . A A . 22 GLY HA3 1 1 6 2842 1 1 16 GLY N N -0.770 -2.948 0.255 1.00 . A A . 22 GLY N 1 1 6 2843 1 1 16 GLY O O 1.708 -2.794 1.818 1.00 . A A . 22 GLY O 1 1 6 2844 1 1 17 GLN C C 3.713 -4.811 1.153 1.00 . A A . 23 GLN C 1 1 6 2845 1 1 17 GLN CA C 2.818 -5.292 2.290 1.00 . A A . 23 GLN CA 1 1 6 2846 1 1 17 GLN CB C 3.029 -6.789 2.521 1.00 . A A . 23 GLN CB 1 1 6 2847 1 1 17 GLN CD C 3.581 -7.686 0.225 1.00 . A A . 23 GLN CD 1 1 6 2848 1 1 17 GLN CG C 2.573 -7.654 1.357 1.00 . A A . 23 GLN CG 1 1 6 2849 1 1 17 GLN H H 0.779 -5.763 1.970 1.00 . A A . 23 GLN H 1 1 6 2850 1 1 17 GLN HA H 3.083 -4.758 3.191 1.00 . A A . 23 GLN HA 1 1 6 2851 1 1 17 GLN HB2 H 4.080 -6.971 2.687 1.00 . A A . 23 GLN HB2 1 1 6 2852 1 1 17 GLN HB3 H 2.477 -7.087 3.401 1.00 . A A . 23 GLN HB3 1 1 6 2853 1 1 17 GLN HE21 H 4.954 -8.461 1.437 1.00 . A A . 23 GLN HE21 1 1 6 2854 1 1 17 GLN HE22 H 5.457 -8.194 -0.193 1.00 . A A . 23 GLN HE22 1 1 6 2855 1 1 17 GLN HG2 H 2.422 -8.662 1.712 1.00 . A A . 23 GLN HG2 1 1 6 2856 1 1 17 GLN HG3 H 1.640 -7.263 0.978 1.00 . A A . 23 GLN HG3 1 1 6 2857 1 1 17 GLN N N 1.414 -5.017 2.004 1.00 . A A . 23 GLN N 1 1 6 2858 1 1 17 GLN NE2 N 4.786 -8.162 0.519 1.00 . A A . 23 GLN NE2 1 1 6 2859 1 1 17 GLN O O 4.862 -4.429 1.373 1.00 . A A . 23 GLN O 1 1 6 2860 1 1 17 GLN OE1 O 3.281 -7.289 -0.901 1.00 . A A . 23 GLN OE1 1 1 6 2861 1 1 18 ALA C C 4.432 -2.968 -1.078 1.00 . A A . 24 ALA C 1 1 6 2862 1 1 18 ALA CA C 3.931 -4.401 -1.238 1.00 . A A . 24 ALA CA 1 1 6 2863 1 1 18 ALA CB C 3.071 -4.524 -2.487 1.00 . A A . 24 ALA CB 1 1 6 2864 1 1 18 ALA H H 2.259 -5.149 -0.177 1.00 . A A . 24 ALA H 1 1 6 2865 1 1 18 ALA HA H 4.781 -5.058 -1.349 1.00 . A A . 24 ALA HA 1 1 6 2866 1 1 18 ALA HB1 H 2.272 -5.228 -2.305 1.00 . A A . 24 ALA HB1 1 1 6 2867 1 1 18 ALA HB2 H 2.653 -3.560 -2.733 1.00 . A A . 24 ALA HB2 1 1 6 2868 1 1 18 ALA HB3 H 3.679 -4.874 -3.308 1.00 . A A . 24 ALA HB3 1 1 6 2869 1 1 18 ALA N N 3.180 -4.833 -0.064 1.00 . A A . 24 ALA N 1 1 6 2870 1 1 18 ALA O O 5.442 -2.585 -1.668 1.00 . A A . 24 ALA O 1 1 6 2871 1 1 19 ALA C C 5.246 -0.692 0.952 1.00 . A A . 25 ALA C 1 1 6 2872 1 1 19 ALA CA C 4.095 -0.792 -0.043 1.00 . A A . 25 ALA CA 1 1 6 2873 1 1 19 ALA CB C 2.896 0.001 0.454 1.00 . A A . 25 ALA CB 1 1 6 2874 1 1 19 ALA H H 2.924 -2.542 0.165 1.00 . A A . 25 ALA H 1 1 6 2875 1 1 19 ALA HA H 4.410 -0.368 -0.986 1.00 . A A . 25 ALA HA 1 1 6 2876 1 1 19 ALA HB1 H 2.506 -0.459 1.350 1.00 . A A . 25 ALA HB1 1 1 6 2877 1 1 19 ALA HB2 H 3.199 1.014 0.672 1.00 . A A . 25 ALA HB2 1 1 6 2878 1 1 19 ALA HB3 H 2.130 0.011 -0.308 1.00 . A A . 25 ALA HB3 1 1 6 2879 1 1 19 ALA N N 3.720 -2.181 -0.277 1.00 . A A . 25 ALA N 1 1 6 2880 1 1 19 ALA O O 6.296 -0.130 0.646 1.00 . A A . 25 ALA O 1 1 6 2881 1 1 20 LYS C C 7.442 -1.552 2.650 1.00 . A A . 26 LYS C 1 1 6 2882 1 1 20 LYS CA C 6.056 -1.219 3.199 1.00 . A A . 26 LYS CA 1 1 6 2883 1 1 20 LYS CB C 5.687 -2.205 4.310 1.00 . A A . 26 LYS CB 1 1 6 2884 1 1 20 LYS CD C 3.446 -1.434 5.155 1.00 . A A . 26 LYS CD 1 1 6 2885 1 1 20 LYS CE C 2.944 -0.025 5.429 1.00 . A A . 26 LYS CE 1 1 6 2886 1 1 20 LYS CG C 4.930 -1.566 5.463 1.00 . A A . 26 LYS CG 1 1 6 2887 1 1 20 LYS HA H 6.079 -0.221 3.613 1.00 . A A . 26 LYS HA 1 1 6 2888 1 1 20 LYS HB2 H 5.070 -2.986 3.892 1.00 . A A . 26 LYS HB2 1 1 6 2889 1 1 20 LYS HD2 H 3.280 -1.667 4.114 1.00 . A A . 26 LYS HD2 1 1 6 2890 1 1 20 LYS HE2 H 1.864 -0.034 5.430 1.00 . A A . 26 LYS HE2 1 1 6 2891 1 1 20 LYS HG2 H 5.050 -2.179 6.343 1.00 . A A . 26 LYS HG2 1 1 6 2892 1 1 20 LYS HZ1 H 4.367 0.937 4.218 1.00 . A A . 26 LYS HZ1 1 1 6 2893 1 1 20 LYS N N 5.039 -1.243 2.147 1.00 . A A . 26 LYS N 1 1 6 2894 1 1 20 LYS NZ N 3.409 0.927 4.425 1.00 . A A . 26 LYS NZ 1 1 6 2895 1 1 20 LYS O O 8.454 -1.100 3.183 1.00 . A A . 26 LYS O 1 1 6 2896 1 1 21 GLU C C 9.582 -1.517 0.584 1.00 . A A . 27 GLU C 1 1 6 2897 1 1 21 GLU CA C 8.746 -2.738 0.971 1.00 . A A . 27 GLU CA 1 1 6 2898 1 1 21 GLU CB C 8.486 -3.602 -0.264 1.00 . A A . 27 GLU CB 1 1 6 2899 1 1 21 GLU CD C 7.851 -5.873 -1.172 1.00 . A A . 27 GLU CD 1 1 6 2900 1 1 21 GLU CG C 8.071 -5.027 0.067 1.00 . A A . 27 GLU CG 1 1 6 2901 1 1 21 GLU H H 6.643 -2.679 1.205 1.00 . A A . 27 GLU H 1 1 6 2902 1 1 21 GLU HA H 9.297 -3.320 1.693 1.00 . A A . 27 GLU HA 1 1 6 2903 1 1 21 GLU HB2 H 7.699 -3.148 -0.848 1.00 . A A . 27 GLU HB2 1 1 6 2904 1 1 21 GLU HB3 H 9.386 -3.641 -0.859 1.00 . A A . 27 GLU HB3 1 1 6 2905 1 1 21 GLU HG2 H 8.845 -5.484 0.664 1.00 . A A . 27 GLU HG2 1 1 6 2906 1 1 21 GLU HG3 H 7.151 -4.998 0.633 1.00 . A A . 27 GLU HG3 1 1 6 2907 1 1 21 GLU N N 7.482 -2.346 1.586 1.00 . A A . 27 GLU N 1 1 6 2908 1 1 21 GLU O O 10.799 -1.616 0.428 1.00 . A A . 27 GLU O 1 1 6 2909 1 1 21 GLU OE1 O 8.843 -6.176 -1.867 1.00 . A A . 27 GLU OE1 1 1 6 2910 1 1 21 GLU OE2 O 6.687 -6.233 -1.446 1.00 . A A . 27 GLU OE2 1 1 6 2911 1 1 22 PHE C C 10.442 1.409 1.218 1.00 . A A . 28 PHE C 1 1 6 2912 1 1 22 PHE CA C 9.623 0.859 0.051 1.00 . A A . 28 PHE CA 1 1 6 2913 1 1 22 PHE CB C 8.619 1.911 -0.456 1.00 . A A . 28 PHE CB 1 1 6 2914 1 1 22 PHE CD1 C 8.994 3.916 1.016 1.00 . A A . 28 PHE CD1 1 1 6 2915 1 1 22 PHE CD2 C 6.887 2.806 1.134 1.00 . A A . 28 PHE CD2 1 1 6 2916 1 1 22 PHE CE1 C 8.574 4.822 1.970 1.00 . A A . 28 PHE CE1 1 1 6 2917 1 1 22 PHE CE2 C 6.462 3.710 2.089 1.00 . A A . 28 PHE CE2 1 1 6 2918 1 1 22 PHE CG C 8.157 2.897 0.587 1.00 . A A . 28 PHE CG 1 1 6 2919 1 1 22 PHE CZ C 7.307 4.719 2.508 1.00 . A A . 28 PHE CZ 1 1 6 2920 1 1 22 PHE H H 7.957 -0.347 0.557 1.00 . A A . 28 PHE H 1 1 6 2921 1 1 22 PHE HA H 10.300 0.614 -0.754 1.00 . A A . 28 PHE HA 1 1 6 2922 1 1 22 PHE HB2 H 9.076 2.473 -1.256 1.00 . A A . 28 PHE HB2 1 1 6 2923 1 1 22 PHE HB3 H 7.746 1.402 -0.840 1.00 . A A . 28 PHE HB3 1 1 6 2924 1 1 22 PHE HD1 H 9.986 3.997 0.596 1.00 . A A . 28 PHE HD1 1 1 6 2925 1 1 22 PHE HD2 H 6.224 2.020 0.808 1.00 . A A . 28 PHE HD2 1 1 6 2926 1 1 22 PHE HE1 H 9.237 5.610 2.295 1.00 . A A . 28 PHE HE1 1 1 6 2927 1 1 22 PHE HE2 H 5.470 3.627 2.508 1.00 . A A . 28 PHE HE2 1 1 6 2928 1 1 22 PHE HZ H 6.977 5.426 3.255 1.00 . A A . 28 PHE HZ 1 1 6 2929 1 1 22 PHE N N 8.927 -0.369 0.425 1.00 . A A . 28 PHE N 1 1 6 2930 1 1 22 PHE O O 11.600 1.788 1.051 1.00 . A A . 28 PHE O 1 1 6 2931 1 1 23 ILE C C 11.866 1.324 3.791 1.00 . A A . 29 ILE C 1 1 6 2932 1 1 23 ILE CA C 10.500 1.977 3.587 1.00 . A A . 29 ILE CA 1 1 6 2933 1 1 23 ILE CB C 9.636 1.775 4.852 1.00 . A A . 29 ILE CB 1 1 6 2934 1 1 23 ILE CD1 C 9.134 3.069 6.986 1.00 . A A . 29 ILE CD1 1 1 6 2935 1 1 23 ILE CG1 C 10.194 2.602 6.012 1.00 . A A . 29 ILE CG1 1 1 6 2936 1 1 23 ILE CG2 C 9.559 0.301 5.231 1.00 . A A . 29 ILE CG2 1 1 6 2937 1 1 23 ILE H H 8.901 1.153 2.468 1.00 . A A . 29 ILE H 1 1 6 2938 1 1 23 ILE HA H 10.646 3.038 3.446 1.00 . A A . 29 ILE HA 1 1 6 2939 1 1 23 ILE HB H 8.634 2.113 4.631 1.00 . A A . 29 ILE HB 1 1 6 2940 1 1 23 ILE HD11 H 8.353 2.326 7.052 1.00 . A A . 29 ILE HD11 1 1 6 2941 1 1 23 ILE HD12 H 9.578 3.213 7.960 1.00 . A A . 29 ILE HD12 1 1 6 2942 1 1 23 ILE HD13 H 8.714 4.002 6.640 1.00 . A A . 29 ILE HD13 1 1 6 2943 1 1 23 ILE HG12 H 10.906 2.004 6.561 1.00 . A A . 29 ILE HG12 1 1 6 2944 1 1 23 ILE HG13 H 10.691 3.475 5.617 1.00 . A A . 29 ILE HG13 1 1 6 2945 1 1 23 ILE HG21 H 10.060 -0.291 4.480 1.00 . A A . 29 ILE HG21 1 1 6 2946 1 1 23 ILE HG22 H 10.037 0.147 6.187 1.00 . A A . 29 ILE HG22 1 1 6 2947 1 1 23 ILE HG23 H 8.523 0.000 5.294 1.00 . A A . 29 ILE HG23 1 1 6 2948 1 1 23 ILE N N 9.829 1.461 2.397 1.00 . A A . 29 ILE N 1 1 6 2949 1 1 23 ILE O O 12.764 1.917 4.388 1.00 . A A . 29 ILE O 1 1 6 2950 1 1 24 ALA C C 14.300 -0.125 2.384 1.00 . A A . 30 ALA C 1 1 6 2951 1 1 24 ALA CA C 13.281 -0.616 3.410 1.00 . A A . 30 ALA CA 1 1 6 2952 1 1 24 ALA CB C 13.049 -2.111 3.253 1.00 . A A . 30 ALA CB 1 1 6 2953 1 1 24 ALA H H 11.272 -0.317 2.816 1.00 . A A . 30 ALA H 1 1 6 2954 1 1 24 ALA HA H 13.670 -0.439 4.402 1.00 . A A . 30 ALA HA 1 1 6 2955 1 1 24 ALA HB1 H 12.608 -2.308 2.287 1.00 . A A . 30 ALA HB1 1 1 6 2956 1 1 24 ALA HB2 H 13.992 -2.632 3.331 1.00 . A A . 30 ALA HB2 1 1 6 2957 1 1 24 ALA HB3 H 12.383 -2.456 4.030 1.00 . A A . 30 ALA HB3 1 1 6 2958 1 1 24 ALA N N 12.021 0.106 3.286 1.00 . A A . 30 ALA N 1 1 6 2959 1 1 24 ALA O O 15.503 -0.333 2.542 1.00 . A A . 30 ALA O 1 1 6 2960 1 1 25 TRP C C 15.350 2.343 0.696 1.00 . A A . 31 TRP C 1 1 6 2961 1 1 25 TRP CA C 14.674 1.036 0.275 1.00 . A A . 31 TRP CA 1 1 6 2962 1 1 25 TRP CB C 13.862 1.233 -1.017 1.00 . A A . 31 TRP CB 1 1 6 2963 1 1 25 TRP CD1 C 15.098 3.162 -2.168 1.00 . A A . 31 TRP CD1 1 1 6 2964 1 1 25 TRP CD2 C 12.946 3.589 -1.720 1.00 . A A . 31 TRP CD2 1 1 6 2965 1 1 25 TRP CE2 C 13.508 4.719 -2.343 1.00 . A A . 31 TRP CE2 1 1 6 2966 1 1 25 TRP CE3 C 11.599 3.627 -1.348 1.00 . A A . 31 TRP CE3 1 1 6 2967 1 1 25 TRP CG C 13.981 2.604 -1.617 1.00 . A A . 31 TRP CG 1 1 6 2968 1 1 25 TRP CH2 C 11.456 5.881 -2.225 1.00 . A A . 31 TRP CH2 1 1 6 2969 1 1 25 TRP CZ2 C 12.771 5.872 -2.600 1.00 . A A . 31 TRP CZ2 1 1 6 2970 1 1 25 TRP CZ3 C 10.869 4.772 -1.604 1.00 . A A . 31 TRP CZ3 1 1 6 2971 1 1 25 TRP H H 12.842 0.653 1.257 1.00 . A A . 31 TRP H 1 1 6 2972 1 1 25 TRP HA H 15.441 0.298 0.092 1.00 . A A . 31 TRP HA 1 1 6 2973 1 1 25 TRP HB2 H 14.200 0.521 -1.755 1.00 . A A . 31 TRP HB2 1 1 6 2974 1 1 25 TRP HB3 H 12.819 1.051 -0.805 1.00 . A A . 31 TRP HB3 1 1 6 2975 1 1 25 TRP HD1 H 16.054 2.665 -2.240 1.00 . A A . 31 TRP HD1 1 1 6 2976 1 1 25 TRP HE1 H 15.462 5.039 -3.037 1.00 . A A . 31 TRP HE1 1 1 6 2977 1 1 25 TRP HE3 H 11.128 2.782 -0.869 1.00 . A A . 31 TRP HE3 1 1 6 2978 1 1 25 TRP HH2 H 10.848 6.754 -2.405 1.00 . A A . 31 TRP HH2 1 1 6 2979 1 1 25 TRP HZ2 H 13.210 6.735 -3.077 1.00 . A A . 31 TRP HZ2 1 1 6 2980 1 1 25 TRP HZ3 H 9.827 4.819 -1.323 1.00 . A A . 31 TRP HZ3 1 1 6 2981 1 1 25 TRP N N 13.810 0.522 1.330 1.00 . A A . 31 TRP N 1 1 6 2982 1 1 25 TRP NE1 N 14.823 4.434 -2.606 1.00 . A A . 31 TRP NE1 1 1 6 2983 1 1 25 TRP O O 16.522 2.567 0.395 1.00 . A A . 31 TRP O 1 1 6 2984 1 1 26 LEU C C 15.789 4.374 3.210 1.00 . A A . 32 LEU C 1 1 6 2985 1 1 26 LEU CA C 15.155 4.488 1.826 1.00 . A A . 32 LEU CA 1 1 6 2986 1 1 26 LEU CB C 14.092 5.603 1.825 1.00 . A A . 32 LEU CB 1 1 6 2987 1 1 26 LEU CD1 C 12.052 4.940 3.115 1.00 . A A . 32 LEU CD1 1 1 6 2988 1 1 26 LEU CD2 C 11.814 6.197 0.970 1.00 . A A . 32 LEU CD2 1 1 6 2989 1 1 26 LEU CG C 12.630 5.159 1.727 1.00 . A A . 32 LEU CG 1 1 6 2990 1 1 26 LEU H H 13.679 2.979 1.593 1.00 . A A . 32 LEU H 1 1 6 2991 1 1 26 LEU HA H 15.929 4.758 1.125 1.00 . A A . 32 LEU HA 1 1 6 2992 1 1 26 LEU HB2 H 14.202 6.171 2.736 1.00 . A A . 32 LEU HB2 1 1 6 2993 1 1 26 LEU HB3 H 14.297 6.258 0.991 1.00 . A A . 32 LEU HB3 1 1 6 2994 1 1 26 LEU HD11 H 12.401 5.718 3.777 1.00 . A A . 32 LEU HD11 1 1 6 2995 1 1 26 LEU HD12 H 10.973 4.967 3.064 1.00 . A A . 32 LEU HD12 1 1 6 2996 1 1 26 LEU HD13 H 12.370 3.978 3.489 1.00 . A A . 32 LEU HD13 1 1 6 2997 1 1 26 LEU HD21 H 12.316 6.445 0.047 1.00 . A A . 32 LEU HD21 1 1 6 2998 1 1 26 LEU HD22 H 10.835 5.797 0.752 1.00 . A A . 32 LEU HD22 1 1 6 2999 1 1 26 LEU HD23 H 11.713 7.087 1.574 1.00 . A A . 32 LEU HD23 1 1 6 3000 1 1 26 LEU HG H 12.570 4.229 1.186 1.00 . A A . 32 LEU HG 1 1 6 3001 1 1 26 LEU N N 14.607 3.207 1.384 1.00 . A A . 32 LEU N 1 1 6 3002 1 1 26 LEU O O 16.902 4.850 3.430 1.00 . A A . 32 LEU O 1 1 6 3003 1 1 27 VAL C C 16.901 2.807 5.507 1.00 . A A . 33 VAL C 1 1 6 3004 1 1 27 VAL CA C 15.585 3.581 5.498 1.00 . A A . 33 VAL CA 1 1 6 3005 1 1 27 VAL CB C 14.560 2.860 6.397 1.00 . A A . 33 VAL CB 1 1 6 3006 1 1 27 VAL CG1 C 15.119 2.651 7.798 1.00 . A A . 33 VAL CG1 1 1 6 3007 1 1 27 VAL CG2 C 13.259 3.645 6.451 1.00 . A A . 33 VAL CG2 1 1 6 3008 1 1 27 VAL H H 14.197 3.387 3.909 1.00 . A A . 33 VAL H 1 1 6 3009 1 1 27 VAL HA H 15.759 4.565 5.907 1.00 . A A . 33 VAL HA 1 1 6 3010 1 1 27 VAL HB H 14.352 1.890 5.968 1.00 . A A . 33 VAL HB 1 1 6 3011 1 1 27 VAL HG11 H 15.842 3.424 8.016 1.00 . A A . 33 VAL HG11 1 1 6 3012 1 1 27 VAL HG12 H 14.314 2.698 8.517 1.00 . A A . 33 VAL HG12 1 1 6 3013 1 1 27 VAL HG13 H 15.596 1.685 7.855 1.00 . A A . 33 VAL HG13 1 1 6 3014 1 1 27 VAL HG21 H 12.925 3.859 5.447 1.00 . A A . 33 VAL HG21 1 1 6 3015 1 1 27 VAL HG22 H 12.509 3.064 6.965 1.00 . A A . 33 VAL HG22 1 1 6 3016 1 1 27 VAL HG23 H 13.422 4.572 6.981 1.00 . A A . 33 VAL HG23 1 1 6 3017 1 1 27 VAL N N 15.079 3.746 4.140 1.00 . A A . 33 VAL N 1 1 6 3018 1 1 27 VAL O O 17.699 2.935 6.435 1.00 . A A . 33 VAL O 1 1 6 3019 1 1 28 ARG C C 19.219 1.715 3.217 1.00 . A A . 34 ARG C 1 1 6 3020 1 1 28 ARG CA C 18.347 1.217 4.366 1.00 . A A . 34 ARG CA 1 1 6 3021 1 1 28 ARG CB C 18.011 -0.262 4.167 1.00 . A A . 34 ARG CB 1 1 6 3022 1 1 28 ARG CD C 16.470 -2.166 4.727 1.00 . A A . 34 ARG CD 1 1 6 3023 1 1 28 ARG CG C 16.945 -0.777 5.120 1.00 . A A . 34 ARG CG 1 1 6 3024 1 1 28 ARG CZ C 17.678 -3.648 6.282 1.00 . A A . 34 ARG CZ 1 1 6 3025 1 1 28 ARG H H 16.453 1.943 3.758 1.00 . A A . 34 ARG H 1 1 6 3026 1 1 28 ARG HA H 18.893 1.331 5.291 1.00 . A A . 34 ARG HA 1 1 6 3027 1 1 28 ARG HB2 H 17.660 -0.406 3.156 1.00 . A A . 34 ARG HB2 1 1 6 3028 1 1 28 ARG HB3 H 18.907 -0.846 4.314 1.00 . A A . 34 ARG HB3 1 1 6 3029 1 1 28 ARG HD2 H 15.554 -2.382 5.255 1.00 . A A . 34 ARG HD2 1 1 6 3030 1 1 28 ARG HD3 H 16.284 -2.182 3.663 1.00 . A A . 34 ARG HD3 1 1 6 3031 1 1 28 ARG HE H 17.983 -3.566 4.311 1.00 . A A . 34 ARG HE 1 1 6 3032 1 1 28 ARG HG2 H 17.356 -0.816 6.117 1.00 . A A . 34 ARG HG2 1 1 6 3033 1 1 28 ARG HG3 H 16.103 -0.100 5.102 1.00 . A A . 34 ARG HG3 1 1 6 3034 1 1 28 ARG HH11 H 16.291 -2.465 7.158 1.00 . A A . 34 ARG HH11 1 1 6 3035 1 1 28 ARG HH12 H 17.154 -3.515 8.230 1.00 . A A . 34 ARG HH12 1 1 6 3036 1 1 28 ARG HH21 H 19.119 -4.949 5.720 1.00 . A A . 34 ARG HH21 1 1 6 3037 1 1 28 ARG HH22 H 18.760 -4.925 7.414 1.00 . A A . 34 ARG HH22 1 1 6 3038 1 1 28 ARG N N 17.124 2.005 4.470 1.00 . A A . 34 ARG N 1 1 6 3039 1 1 28 ARG NE N 17.457 -3.194 5.050 1.00 . A A . 34 ARG NE 1 1 6 3040 1 1 28 ARG NH1 N 16.984 -3.170 7.307 1.00 . A A . 34 ARG NH1 1 1 6 3041 1 1 28 ARG NH2 N 18.594 -4.584 6.489 1.00 . A A . 34 ARG NH2 1 1 6 3042 1 1 28 ARG O O 19.752 0.923 2.440 1.00 . A A . 34 ARG O 1 1 6 3043 1 1 29 GLY C C 19.962 5.109 1.924 1.00 . A A . 35 GLY C 1 1 6 3044 1 1 29 GLY CA C 20.168 3.613 2.059 1.00 . A A . 35 GLY CA 1 1 6 3045 1 1 29 GLY H H 18.911 3.616 3.763 1.00 . A A . 35 GLY H 1 1 6 3046 1 1 29 GLY HA2 H 21.209 3.422 2.271 1.00 . A A . 35 GLY HA2 1 1 6 3047 1 1 29 GLY HA3 H 19.910 3.140 1.122 1.00 . A A . 35 GLY HA3 1 1 6 3048 1 1 29 GLY N N 19.359 3.033 3.115 1.00 . A A . 35 GLY N 1 1 6 3049 1 1 29 GLY O O 20.915 5.884 2.010 1.00 . A A . 35 GLY O 1 1 6 3050 1 1 30 ARG C C 18.625 7.683 2.872 1.00 . A A . 36 ARG C 1 1 6 3051 1 1 30 ARG CA C 18.388 6.931 1.566 1.00 . A A . 36 ARG CA 1 1 6 3052 1 1 30 ARG CB C 16.932 7.098 1.126 1.00 . A A . 36 ARG CB 1 1 6 3053 1 1 30 ARG CD C 15.242 8.960 1.131 1.00 . A A . 36 ARG CD 1 1 6 3054 1 1 30 ARG CG C 16.603 8.499 0.634 1.00 . A A . 36 ARG CG 1 1 6 3055 1 1 30 ARG CZ C 14.708 10.951 -0.220 1.00 . A A . 36 ARG CZ 1 1 6 3056 1 1 30 ARG H H 17.997 4.853 1.654 1.00 . A A . 36 ARG H 1 1 6 3057 1 1 30 ARG HA H 19.034 7.343 0.806 1.00 . A A . 36 ARG HA 1 1 6 3058 1 1 30 ARG HB2 H 16.728 6.402 0.326 1.00 . A A . 36 ARG HB2 1 1 6 3059 1 1 30 ARG HB3 H 16.287 6.872 1.962 1.00 . A A . 36 ARG HB3 1 1 6 3060 1 1 30 ARG HD2 H 14.475 8.428 0.589 1.00 . A A . 36 ARG HD2 1 1 6 3061 1 1 30 ARG HD3 H 15.161 8.731 2.184 1.00 . A A . 36 ARG HD3 1 1 6 3062 1 1 30 ARG HE H 15.173 10.976 1.721 1.00 . A A . 36 ARG HE 1 1 6 3063 1 1 30 ARG HG2 H 17.356 9.183 0.994 1.00 . A A . 36 ARG HG2 1 1 6 3064 1 1 30 ARG HG3 H 16.601 8.499 -0.446 1.00 . A A . 36 ARG HG3 1 1 6 3065 1 1 30 ARG HH11 H 14.651 9.206 -1.242 1.00 . A A . 36 ARG HH11 1 1 6 3066 1 1 30 ARG HH12 H 14.276 10.621 -2.167 1.00 . A A . 36 ARG HH12 1 1 6 3067 1 1 30 ARG HH21 H 14.680 12.837 0.505 1.00 . A A . 36 ARG HH21 1 1 6 3068 1 1 30 ARG HH22 H 14.293 12.682 -1.176 1.00 . A A . 36 ARG HH22 1 1 6 3069 1 1 30 ARG N N 18.715 5.518 1.713 1.00 . A A . 36 ARG N 1 1 6 3070 1 1 30 ARG NE N 15.046 10.396 0.942 1.00 . A A . 36 ARG NE 1 1 6 3071 1 1 30 ARG NH1 N 14.530 10.197 -1.298 1.00 . A A . 36 ARG NH1 1 1 6 3072 1 1 30 ARG NH2 N 14.547 12.265 -0.304 1.00 . A A . 36 ARG NH2 1 1 6 3073 1 1 30 ARG O O 17.904 7.490 3.851 1.00 . A A . 36 ARG O 1 1 6 3074 1 1 31 GLY C C 20.408 8.434 5.222 1.00 . A A . 37 GLY C 1 1 6 3075 1 1 31 GLY CA C 19.953 9.309 4.070 1.00 . A A . 37 GLY CA 1 1 6 3076 1 1 31 GLY H H 20.180 8.654 2.070 1.00 . A A . 37 GLY H 1 1 6 3077 1 1 31 GLY HA2 H 20.738 10.012 3.835 1.00 . A A . 37 GLY HA2 1 1 6 3078 1 1 31 GLY HA3 H 19.073 9.856 4.374 1.00 . A A . 37 GLY HA3 1 1 6 3079 1 1 31 GLY N N 19.640 8.541 2.880 1.00 . A A . 37 GLY N 1 1 6 3080 1 1 31 GLY O O 20.879 8.988 6.238 1.00 . A A . 37 GLY O 1 1 6 3081 1 1 31 GLY OXT O 20.292 7.196 5.109 1.00 . A A . 37 GLY OXT 1 1 6 3082 2 2 1 . C02 C 4.187 5.418 -0.328 1.00 . B A . 1038 D6M C02 1 1 6 3083 2 2 1 . C04 C 2.425 4.575 1.127 1.00 . B A . 1038 D6M C04 1 1 6 3084 2 2 1 . C05 C 2.068 3.252 1.808 1.00 . B A . 1038 D6M C05 1 1 6 3085 2 2 1 . C06 C 3.147 2.741 2.750 1.00 . B A . 1038 D6M C06 1 1 6 3086 2 2 1 . C07 C 2.608 1.772 3.785 1.00 . B A . 1038 D6M C07 1 1 6 3087 2 2 1 . C09 C 2.368 5.713 2.141 1.00 . B A . 1038 D6M C09 1 1 6 3088 2 2 1 . C12 C 5.560 5.321 -0.963 1.00 . B A . 1038 D6M C12 1 1 6 3089 2 2 1 . C13 C 6.414 6.550 -0.699 1.00 . B A . 1038 D6M C13 1 1 6 3090 2 2 1 . C14 C 7.843 6.349 -1.179 1.00 . B A . 1038 D6M C14 1 1 6 3091 2 2 1 . C15 C 8.406 7.617 -1.802 1.00 . B A . 1038 D6M C15 1 1 6 3092 2 2 1 . C16 C 9.335 8.346 -0.843 1.00 . B A . 1038 D6M C16 1 1 6 3093 2 2 1 . C17 C 8.585 8.866 0.372 1.00 . B A . 1038 D6M C17 1 1 6 3094 2 2 1 . C18 C 8.736 7.932 1.562 1.00 . B A . 1038 D6M C18 1 1 6 3095 2 2 1 . C19 C 8.775 8.699 2.873 1.00 . B A . 1038 D6M C19 1 1 6 3096 2 2 1 . C20 C 9.076 7.781 4.047 1.00 . B A . 1038 D6M C20 1 1 6 3097 2 2 1 . C21 C 10.567 7.717 4.337 1.00 . B A . 1038 D6M C21 1 1 6 3098 2 2 1 . C22 C 10.873 6.742 5.462 1.00 . B A . 1038 D6M C22 1 1 6 3099 2 2 1 . C23 C 12.296 6.908 5.975 1.00 . B A . 1038 D6M C23 1 1 6 3100 2 2 1 . C24 C 12.332 7.035 7.490 1.00 . B A . 1038 D6M C24 1 1 6 3101 2 2 1 . C25 C 13.369 8.052 7.938 1.00 . B A . 1038 D6M C25 1 1 6 3102 2 2 1 . C26 C 12.744 9.400 8.221 1.00 . B A . 1038 D6M C26 1 1 6 3103 2 2 1 . H03 H 4.328 3.733 0.739 1.00 . B A . 1038 D6M H03 1 1 6 3104 2 2 1 . H04 H 1.708 4.770 0.344 1.00 . B A . 1038 D6M H04 1 1 6 3105 2 2 1 . HP21 H 5.439 5.203 -2.029 1.00 . B A . 1038 D6M HP21 1 1 6 3106 2 2 1 . HP22 H 6.065 4.455 -0.561 1.00 . B A . 1038 D6M HP22 1 1 6 3107 2 2 1 . HP31 H 6.425 6.747 0.363 1.00 . B A . 1038 D6M HP31 1 1 6 3108 2 2 1 . HP32 H 5.986 7.393 -1.220 1.00 . B A . 1038 D6M HP32 1 1 6 3109 2 2 1 . HP41 H 7.858 5.560 -1.916 1.00 . B A . 1038 D6M HP41 1 1 6 3110 2 2 1 . HP42 H 8.460 6.069 -0.337 1.00 . B A . 1038 D6M HP42 1 1 6 3111 2 2 1 . HP51 H 7.588 8.272 -2.063 1.00 . B A . 1038 D6M HP51 1 1 6 3112 2 2 1 . HP52 H 8.958 7.355 -2.692 1.00 . B A . 1038 D6M HP52 1 1 6 3113 2 2 1 . HP61 H 9.788 9.179 -1.360 1.00 . B A . 1038 D6M HP61 1 1 6 3114 2 2 1 . HP62 H 10.104 7.663 -0.514 1.00 . B A . 1038 D6M HP62 1 1 6 3115 2 2 1 . HP71 H 7.537 8.955 0.126 1.00 . B A . 1038 D6M HP71 1 1 6 3116 2 2 1 . HP72 H 8.978 9.836 0.638 1.00 . B A . 1038 D6M HP72 1 1 6 3117 2 2 1 . HP81 H 9.654 7.373 1.454 1.00 . B A . 1038 D6M HP81 1 1 6 3118 2 2 1 . HP82 H 7.899 7.251 1.581 1.00 . B A . 1038 D6M HP82 1 1 6 3119 2 2 1 . HP91 H 7.816 9.170 3.032 1.00 . B A . 1038 D6M HP91 1 1 6 3120 2 2 1 . HP92 H 9.544 9.455 2.814 1.00 . B A . 1038 D6M HP92 1 1 6 3121 2 2 1 . HPA1 H 8.720 6.788 3.815 1.00 . B A . 1038 D6M HPA1 1 1 6 3122 2 2 1 . HPA2 H 8.566 8.153 4.923 1.00 . B A . 1038 D6M HPA2 1 1 6 3123 2 2 1 . HPB1 H 10.912 8.701 4.620 1.00 . B A . 1038 D6M HPB1 1 1 6 3124 2 2 1 . HPB2 H 11.084 7.395 3.445 1.00 . B A . 1038 D6M HPB2 1 1 6 3125 2 2 1 . HPC1 H 10.748 5.733 5.095 1.00 . B A . 1038 D6M HPC1 1 1 6 3126 2 2 1 . HPC2 H 10.185 6.919 6.275 1.00 . B A . 1038 D6M HPC2 1 1 6 3127 2 2 1 . HPD1 H 12.725 7.798 5.537 1.00 . B A . 1038 D6M HPD1 1 1 6 3128 2 2 1 . HPD2 H 12.876 6.046 5.683 1.00 . B A . 1038 D6M HPD2 1 1 6 3129 2 2 1 . HPE1 H 12.575 6.074 7.916 1.00 . B A . 1038 D6M HPE1 1 1 6 3130 2 2 1 . HPE2 H 11.360 7.350 7.838 1.00 . B A . 1038 D6M HPE2 1 1 6 3131 2 2 1 . HPF1 H 14.109 8.171 7.159 1.00 . B A . 1038 D6M HPF1 1 1 6 3132 2 2 1 . HPF2 H 13.843 7.700 8.842 1.00 . B A . 1038 D6M HPF2 1 1 6 3133 2 2 1 . HPG1 H 11.894 9.273 8.874 1.00 . B A . 1038 D6M HPG1 1 1 6 3134 2 2 1 . HPG2 H 12.421 9.849 7.293 1.00 . B A . 1038 D6M HPG2 1 1 6 3135 2 2 1 . HPG3 H 13.471 10.041 8.697 1.00 . B A . 1038 D6M HPG3 1 1 6 3136 2 2 1 . HQ21 H 3.906 2.239 2.169 1.00 . B A . 1038 D6M HQ21 1 1 6 3137 2 2 1 . HQ22 H 3.586 3.584 3.263 1.00 . B A . 1038 D6M HQ22 1 1 6 3138 2 2 1 . HQ31 H 1.160 3.388 2.376 1.00 . B A . 1038 D6M HQ31 1 1 6 3139 2 2 1 . HQ32 H 1.900 2.502 1.049 1.00 . B A . 1038 D6M HQ32 1 1 6 3140 2 2 1 . N03 N 3.745 4.488 0.514 1.00 . B A . 1038 D6M N03 1 1 6 3141 2 2 1 . O01 O 3.481 6.386 -0.613 1.00 . B A . 1038 D6M O01 1 1 6 3142 2 2 1 . O08 O 1.401 1.785 4.022 1.00 . B A . 1038 D6M O08 1 1 6 3143 2 2 1 . O10 O 3.419 6.345 2.378 1.00 . B A . 1038 D6M O10 1 1 6 3144 2 2 1 . O11 O 1.275 5.961 2.691 1.00 . B A . 1038 D6M O11 1 1 7 3145 1 1 1 HIS C C -31.640 -2.174 -1.232 1.00 . A A . 7 HIS C 1 1 7 3146 1 1 1 HIS CA C -32.415 -2.105 -2.543 1.00 . A A . 7 HIS CA 1 1 7 3147 1 1 1 HIS CB C -32.440 -0.667 -3.066 1.00 . A A . 7 HIS CB 1 1 7 3148 1 1 1 HIS CD2 C -33.125 -1.047 -5.539 1.00 . A A . 7 HIS CD2 1 1 7 3149 1 1 1 HIS CE1 C -34.877 0.270 -5.592 1.00 . A A . 7 HIS CE1 1 1 7 3150 1 1 1 HIS CG C -33.258 -0.497 -4.309 1.00 . A A . 7 HIS CG 1 1 7 3151 1 1 1 HIS H1 H -33.786 -3.506 -1.918 1.00 . A A . 7 HIS H1 1 1 7 3152 1 1 1 HIS H2 H -34.303 -1.877 -1.758 1.00 . A A . 7 HIS H2 1 1 7 3153 1 1 1 HIS H3 H -34.256 -2.617 -3.306 1.00 . A A . 7 HIS H3 1 1 7 3154 1 1 1 HIS HA H -31.933 -2.740 -3.272 1.00 . A A . 7 HIS HA 1 1 7 3155 1 1 1 HIS HB2 H -32.854 -0.022 -2.306 1.00 . A A . 7 HIS HB2 1 1 7 3156 1 1 1 HIS HB3 H -31.430 -0.354 -3.286 1.00 . A A . 7 HIS HB3 1 1 7 3157 1 1 1 HIS HD1 H -34.721 0.864 -3.641 1.00 . A A . 7 HIS HD1 1 1 7 3158 1 1 1 HIS HD2 H -32.359 -1.744 -5.851 1.00 . A A . 7 HIS HD2 1 1 7 3159 1 1 1 HIS HE1 H -35.748 0.809 -5.936 1.00 . A A . 7 HIS HE1 1 1 7 3160 1 1 1 HIS HE2 H -34.250 -0.708 -7.279 1.00 . A A . 7 HIS HE2 1 1 7 3161 1 1 1 HIS N N -33.816 -2.568 -2.365 1.00 . A A . 7 HIS N 1 1 7 3162 1 1 1 HIS ND1 N -34.364 0.323 -4.376 1.00 . A A . 7 HIS ND1 1 1 7 3163 1 1 1 HIS NE2 N -34.143 -0.554 -6.317 1.00 . A A . 7 HIS NE2 1 1 7 3164 1 1 1 HIS O O -32.136 -1.762 -0.183 1.00 . A A . 7 HIS O 1 1 7 3165 1 1 2 ALA C C -28.348 -1.924 -0.222 1.00 . A A . 8 ALA C 1 1 7 3166 1 1 2 ALA CA C -29.576 -2.821 -0.116 1.00 . A A . 8 ALA CA 1 1 7 3167 1 1 2 ALA CB C -29.158 -4.270 0.084 1.00 . A A . 8 ALA CB 1 1 7 3168 1 1 2 ALA H H -30.080 -3.009 -2.163 1.00 . A A . 8 ALA H 1 1 7 3169 1 1 2 ALA HA H -30.158 -2.518 0.743 1.00 . A A . 8 ALA HA 1 1 7 3170 1 1 2 ALA HB1 H -29.123 -4.770 -0.873 1.00 . A A . 8 ALA HB1 1 1 7 3171 1 1 2 ALA HB2 H -28.180 -4.302 0.542 1.00 . A A . 8 ALA HB2 1 1 7 3172 1 1 2 ALA HB3 H -29.872 -4.766 0.724 1.00 . A A . 8 ALA HB3 1 1 7 3173 1 1 2 ALA N N -30.421 -2.698 -1.298 1.00 . A A . 8 ALA N 1 1 7 3174 1 1 2 ALA O O -28.135 -1.265 -1.240 1.00 . A A . 8 ALA O 1 1 7 3175 1 1 3 GLU C C -25.096 -1.943 0.614 1.00 . A A . 9 GLU C 1 1 7 3176 1 1 3 GLU CA C -26.335 -1.088 0.860 1.00 . A A . 9 GLU CA 1 1 7 3177 1 1 3 GLU CB C -26.211 -0.364 2.202 1.00 . A A . 9 GLU CB 1 1 7 3178 1 1 3 GLU CD C -26.014 2.071 2.850 1.00 . A A . 9 GLU CD 1 1 7 3179 1 1 3 GLU CG C -26.884 0.999 2.221 1.00 . A A . 9 GLU CG 1 1 7 3180 1 1 3 GLU H H -27.766 -2.452 1.616 1.00 . A A . 9 GLU H 1 1 7 3181 1 1 3 GLU HA H -26.414 -0.355 0.071 1.00 . A A . 9 GLU HA 1 1 7 3182 1 1 3 GLU HB2 H -26.661 -0.975 2.970 1.00 . A A . 9 GLU HB2 1 1 7 3183 1 1 3 GLU HB3 H -25.164 -0.228 2.429 1.00 . A A . 9 GLU HB3 1 1 7 3184 1 1 3 GLU HG2 H -27.108 1.290 1.206 1.00 . A A . 9 GLU HG2 1 1 7 3185 1 1 3 GLU HG3 H -27.802 0.925 2.785 1.00 . A A . 9 GLU HG3 1 1 7 3186 1 1 3 GLU N N -27.543 -1.904 0.835 1.00 . A A . 9 GLU N 1 1 7 3187 1 1 3 GLU O O -25.002 -3.072 1.096 1.00 . A A . 9 GLU O 1 1 7 3188 1 1 3 GLU OE1 O -24.974 2.418 2.251 1.00 . A A . 9 GLU OE1 1 1 7 3189 1 1 3 GLU OE2 O -26.373 2.562 3.940 1.00 . A A . 9 GLU OE2 1 1 7 3190 1 1 4 GLY C C -21.833 -1.861 0.583 1.00 . A A . 10 GLY C 1 1 7 3191 1 1 4 GLY CA C -22.926 -2.124 -0.435 1.00 . A A . 10 GLY CA 1 1 7 3192 1 1 4 GLY H H -24.276 -0.494 -0.497 1.00 . A A . 10 GLY H 1 1 7 3193 1 1 4 GLY HA2 H -23.144 -3.181 -0.449 1.00 . A A . 10 GLY HA2 1 1 7 3194 1 1 4 GLY HA3 H -22.571 -1.827 -1.412 1.00 . A A . 10 GLY HA3 1 1 7 3195 1 1 4 GLY N N -24.146 -1.397 -0.139 1.00 . A A . 10 GLY N 1 1 7 3196 1 1 4 GLY O O -22.077 -1.245 1.620 1.00 . A A . 10 GLY O 1 1 7 3197 1 1 5 THR C C -18.859 -0.770 0.986 1.00 . A A . 11 THR C 1 1 7 3198 1 1 5 THR CA C -19.491 -2.144 1.186 1.00 . A A . 11 THR CA 1 1 7 3199 1 1 5 THR CB C -18.447 -3.238 0.958 1.00 . A A . 11 THR CB 1 1 7 3200 1 1 5 THR CG2 C -17.770 -3.694 2.232 1.00 . A A . 11 THR CG2 1 1 7 3201 1 1 5 THR H H -20.493 -2.814 -0.555 1.00 . A A . 11 THR H 1 1 7 3202 1 1 5 THR HA H -19.857 -2.214 2.199 1.00 . A A . 11 THR HA 1 1 7 3203 1 1 5 THR HB H -17.683 -2.860 0.294 1.00 . A A . 11 THR HB 1 1 7 3204 1 1 5 THR HG1 H -19.861 -4.584 0.799 1.00 . A A . 11 THR HG1 1 1 7 3205 1 1 5 THR HG21 H -18.389 -3.438 3.080 1.00 . A A . 11 THR HG21 1 1 7 3206 1 1 5 THR HG22 H -17.627 -4.764 2.201 1.00 . A A . 11 THR HG22 1 1 7 3207 1 1 5 THR HG23 H -16.812 -3.205 2.325 1.00 . A A . 11 THR HG23 1 1 7 3208 1 1 5 THR N N -20.625 -2.331 0.287 1.00 . A A . 11 THR N 1 1 7 3209 1 1 5 THR O O -19.321 0.023 0.165 1.00 . A A . 11 THR O 1 1 7 3210 1 1 5 THR OG1 O -19.037 -4.376 0.354 1.00 . A A . 11 THR OG1 1 1 7 3211 1 1 6 PHE C C -15.798 0.756 2.430 1.00 . A A . 12 PHE C 1 1 7 3212 1 1 6 PHE CA C -17.105 0.784 1.645 1.00 . A A . 12 PHE CA 1 1 7 3213 1 1 6 PHE CB C -17.997 1.913 2.163 1.00 . A A . 12 PHE CB 1 1 7 3214 1 1 6 PHE CD1 C -16.429 3.835 2.545 1.00 . A A . 12 PHE CD1 1 1 7 3215 1 1 6 PHE CD2 C -18.053 4.025 0.809 1.00 . A A . 12 PHE CD2 1 1 7 3216 1 1 6 PHE CE1 C -15.954 5.097 2.243 1.00 . A A . 12 PHE CE1 1 1 7 3217 1 1 6 PHE CE2 C -17.582 5.287 0.502 1.00 . A A . 12 PHE CE2 1 1 7 3218 1 1 6 PHE CG C -17.482 3.285 1.832 1.00 . A A . 12 PHE CG 1 1 7 3219 1 1 6 PHE CZ C -16.532 5.824 1.220 1.00 . A A . 12 PHE CZ 1 1 7 3220 1 1 6 PHE H H -17.479 -1.168 2.377 1.00 . A A . 12 PHE H 1 1 7 3221 1 1 6 PHE HA H -16.882 0.963 0.604 1.00 . A A . 12 PHE HA 1 1 7 3222 1 1 6 PHE HB2 H -18.980 1.814 1.728 1.00 . A A . 12 PHE HB2 1 1 7 3223 1 1 6 PHE HB3 H -18.075 1.836 3.238 1.00 . A A . 12 PHE HB3 1 1 7 3224 1 1 6 PHE HD1 H -15.976 3.267 3.344 1.00 . A A . 12 PHE HD1 1 1 7 3225 1 1 6 PHE HD2 H -18.874 3.606 0.247 1.00 . A A . 12 PHE HD2 1 1 7 3226 1 1 6 PHE HE1 H -15.133 5.515 2.806 1.00 . A A . 12 PHE HE1 1 1 7 3227 1 1 6 PHE HE2 H -18.036 5.854 -0.297 1.00 . A A . 12 PHE HE2 1 1 7 3228 1 1 6 PHE HZ H -16.162 6.811 0.983 1.00 . A A . 12 PHE HZ 1 1 7 3229 1 1 6 PHE N N -17.800 -0.495 1.741 1.00 . A A . 12 PHE N 1 1 7 3230 1 1 6 PHE O O -14.776 1.265 1.971 1.00 . A A . 12 PHE O 1 1 7 3231 1 1 7 THR C C -13.507 -0.617 3.736 1.00 . A A . 13 THR C 1 1 7 3232 1 1 7 THR CA C -14.657 0.068 4.468 1.00 . A A . 13 THR CA 1 1 7 3233 1 1 7 THR CB C -14.986 -0.695 5.752 1.00 . A A . 13 THR CB 1 1 7 3234 1 1 7 THR CG2 C -15.616 0.174 6.819 1.00 . A A . 13 THR CG2 1 1 7 3235 1 1 7 THR H H -16.683 -0.226 3.930 1.00 . A A . 13 THR H 1 1 7 3236 1 1 7 THR HA H -14.355 1.072 4.725 1.00 . A A . 13 THR HA 1 1 7 3237 1 1 7 THR HB H -14.073 -1.107 6.158 1.00 . A A . 13 THR HB 1 1 7 3238 1 1 7 THR HG1 H -15.394 -2.492 5.088 1.00 . A A . 13 THR HG1 1 1 7 3239 1 1 7 THR HG21 H -15.633 1.200 6.484 1.00 . A A . 13 THR HG21 1 1 7 3240 1 1 7 THR HG22 H -16.626 -0.161 7.005 1.00 . A A . 13 THR HG22 1 1 7 3241 1 1 7 THR HG23 H -15.039 0.102 7.729 1.00 . A A . 13 THR HG23 1 1 7 3242 1 1 7 THR N N -15.838 0.160 3.618 1.00 . A A . 13 THR N 1 1 7 3243 1 1 7 THR O O -12.361 -0.174 3.807 1.00 . A A . 13 THR O 1 1 7 3244 1 1 7 THR OG1 O -15.877 -1.764 5.486 1.00 . A A . 13 THR OG1 1 1 7 3245 1 1 8 SER C C -12.670 -1.901 0.871 1.00 . A A . 14 SER C 1 1 7 3246 1 1 8 SER CA C -12.813 -2.445 2.288 1.00 . A A . 14 SER CA 1 1 7 3247 1 1 8 SER CB C -13.176 -3.931 2.242 1.00 . A A . 14 SER CB 1 1 7 3248 1 1 8 SER H H -14.752 -2.005 3.015 1.00 . A A . 14 SER H 1 1 7 3249 1 1 8 SER HA H -11.871 -2.330 2.801 1.00 . A A . 14 SER HA 1 1 7 3250 1 1 8 SER HB2 H -13.532 -4.243 3.212 1.00 . A A . 14 SER HB2 1 1 7 3251 1 1 8 SER HB3 H -13.953 -4.086 1.507 1.00 . A A . 14 SER HB3 1 1 7 3252 1 1 8 SER HG H -11.947 -4.723 0.939 1.00 . A A . 14 SER HG 1 1 7 3253 1 1 8 SER N N -13.821 -1.700 3.033 1.00 . A A . 14 SER N 1 1 7 3254 1 1 8 SER O O -11.590 -1.955 0.282 1.00 . A A . 14 SER O 1 1 7 3255 1 1 8 SER OG O -12.052 -4.720 1.893 1.00 . A A . 14 SER OG 1 1 7 3256 1 1 9 ASP C C -12.701 0.270 -1.159 1.00 . A A . 15 ASP C 1 1 7 3257 1 1 9 ASP CA C -13.758 -0.823 -1.022 1.00 . A A . 15 ASP CA 1 1 7 3258 1 1 9 ASP CB C -15.138 -0.263 -1.373 1.00 . A A . 15 ASP CB 1 1 7 3259 1 1 9 ASP CG C -15.519 -0.530 -2.816 1.00 . A A . 15 ASP CG 1 1 7 3260 1 1 9 ASP H H -14.596 -1.363 0.847 1.00 . A A . 15 ASP H 1 1 7 3261 1 1 9 ASP HA H -13.520 -1.624 -1.706 1.00 . A A . 15 ASP HA 1 1 7 3262 1 1 9 ASP HB2 H -15.879 -0.720 -0.734 1.00 . A A . 15 ASP HB2 1 1 7 3263 1 1 9 ASP HB3 H -15.138 0.805 -1.211 1.00 . A A . 15 ASP HB3 1 1 7 3264 1 1 9 ASP N N -13.764 -1.377 0.328 1.00 . A A . 15 ASP N 1 1 7 3265 1 1 9 ASP O O -12.193 0.522 -2.252 1.00 . A A . 15 ASP O 1 1 7 3266 1 1 9 ASP OD1 O -15.122 -1.588 -3.348 1.00 . A A . 15 ASP OD1 1 1 7 3267 1 1 9 ASP OD2 O -16.213 0.318 -3.414 1.00 . A A . 15 ASP OD2 1 1 7 3268 1 1 10 VAL C C -9.967 1.425 0.114 1.00 . A A . 16 VAL C 1 1 7 3269 1 1 10 VAL CA C -11.380 1.983 -0.040 1.00 . A A . 16 VAL CA 1 1 7 3270 1 1 10 VAL CB C -11.641 2.995 1.092 1.00 . A A . 16 VAL CB 1 1 7 3271 1 1 10 VAL CG1 C -10.781 4.236 0.906 1.00 . A A . 16 VAL CG1 1 1 7 3272 1 1 10 VAL CG2 C -13.118 3.363 1.154 1.00 . A A . 16 VAL CG2 1 1 7 3273 1 1 10 VAL H H -12.815 0.672 0.797 1.00 . A A . 16 VAL H 1 1 7 3274 1 1 10 VAL HA H -11.448 2.505 -0.983 1.00 . A A . 16 VAL HA 1 1 7 3275 1 1 10 VAL HB H -11.368 2.534 2.029 1.00 . A A . 16 VAL HB 1 1 7 3276 1 1 10 VAL HG11 H -10.551 4.361 -0.142 1.00 . A A . 16 VAL HG11 1 1 7 3277 1 1 10 VAL HG12 H -11.318 5.103 1.263 1.00 . A A . 16 VAL HG12 1 1 7 3278 1 1 10 VAL HG13 H -9.864 4.125 1.465 1.00 . A A . 16 VAL HG13 1 1 7 3279 1 1 10 VAL HG21 H -13.657 2.823 0.390 1.00 . A A . 16 VAL HG21 1 1 7 3280 1 1 10 VAL HG22 H -13.512 3.102 2.125 1.00 . A A . 16 VAL HG22 1 1 7 3281 1 1 10 VAL HG23 H -13.232 4.425 0.993 1.00 . A A . 16 VAL HG23 1 1 7 3282 1 1 10 VAL N N -12.375 0.917 -0.044 1.00 . A A . 16 VAL N 1 1 7 3283 1 1 10 VAL O O -8.988 2.091 -0.213 1.00 . A A . 16 VAL O 1 1 7 3284 1 1 11 SER C C -8.158 -1.232 -0.428 1.00 . A A . 17 SER C 1 1 7 3285 1 1 11 SER CA C -8.570 -0.438 0.810 1.00 . A A . 17 SER CA 1 1 7 3286 1 1 11 SER CB C -8.609 -1.359 2.031 1.00 . A A . 17 SER CB 1 1 7 3287 1 1 11 SER H H -10.679 -0.286 0.866 1.00 . A A . 17 SER H 1 1 7 3288 1 1 11 SER HA H -7.841 0.340 0.982 1.00 . A A . 17 SER HA 1 1 7 3289 1 1 11 SER HB2 H -9.180 -0.888 2.817 1.00 . A A . 17 SER HB2 1 1 7 3290 1 1 11 SER HB3 H -9.076 -2.294 1.758 1.00 . A A . 17 SER HB3 1 1 7 3291 1 1 11 SER HG H -6.948 -0.834 2.927 1.00 . A A . 17 SER HG 1 1 7 3292 1 1 11 SER N N -9.866 0.200 0.618 1.00 . A A . 17 SER N 1 1 7 3293 1 1 11 SER O O -6.980 -1.525 -0.624 1.00 . A A . 17 SER O 1 1 7 3294 1 1 11 SER OG O -7.303 -1.624 2.512 1.00 . A A . 17 SER OG 1 1 7 3295 1 1 12 SER C C -8.610 -1.470 -3.671 1.00 . A A . 18 SER C 1 1 7 3296 1 1 12 SER CA C -8.874 -2.366 -2.461 1.00 . A A . 18 SER CA 1 1 7 3297 1 1 12 SER CB C -10.051 -3.297 -2.755 1.00 . A A . 18 SER CB 1 1 7 3298 1 1 12 SER H H -10.060 -1.340 -1.039 1.00 . A A . 18 SER H 1 1 7 3299 1 1 12 SER HA H -7.996 -2.966 -2.279 1.00 . A A . 18 SER HA 1 1 7 3300 1 1 12 SER HB2 H -10.824 -2.746 -3.271 1.00 . A A . 18 SER HB2 1 1 7 3301 1 1 12 SER HB3 H -9.715 -4.113 -3.377 1.00 . A A . 18 SER HB3 1 1 7 3302 1 1 12 SER HG H -11.352 -4.378 -1.767 1.00 . A A . 18 SER HG 1 1 7 3303 1 1 12 SER N N -9.138 -1.592 -1.252 1.00 . A A . 18 SER N 1 1 7 3304 1 1 12 SER O O -7.917 -1.874 -4.605 1.00 . A A . 18 SER O 1 1 7 3305 1 1 12 SER OG O -10.593 -3.829 -1.558 1.00 . A A . 18 SER OG 1 1 7 3306 1 1 13 TYR C C -7.644 1.348 -4.747 1.00 . A A . 19 TYR C 1 1 7 3307 1 1 13 TYR CA C -9.006 0.653 -4.790 1.00 . A A . 19 TYR CA 1 1 7 3308 1 1 13 TYR CB C -10.142 1.690 -4.820 1.00 . A A . 19 TYR CB 1 1 7 3309 1 1 13 TYR CD1 C -9.268 2.922 -2.792 1.00 . A A . 19 TYR CD1 1 1 7 3310 1 1 13 TYR CD2 C -10.183 4.204 -4.579 1.00 . A A . 19 TYR CD2 1 1 7 3311 1 1 13 TYR CE1 C -9.007 4.084 -2.089 1.00 . A A . 19 TYR CE1 1 1 7 3312 1 1 13 TYR CE2 C -9.926 5.369 -3.883 1.00 . A A . 19 TYR CE2 1 1 7 3313 1 1 13 TYR CG C -9.859 2.962 -4.047 1.00 . A A . 19 TYR CG 1 1 7 3314 1 1 13 TYR CZ C -9.338 5.304 -2.639 1.00 . A A . 19 TYR CZ 1 1 7 3315 1 1 13 TYR H H -9.735 0.000 -2.906 1.00 . A A . 19 TYR H 1 1 7 3316 1 1 13 TYR HA H -9.055 0.065 -5.694 1.00 . A A . 19 TYR HA 1 1 7 3317 1 1 13 TYR HB2 H -10.335 1.967 -5.845 1.00 . A A . 19 TYR HB2 1 1 7 3318 1 1 13 TYR HB3 H -11.033 1.242 -4.403 1.00 . A A . 19 TYR HB3 1 1 7 3319 1 1 13 TYR HD1 H -9.011 1.965 -2.366 1.00 . A A . 19 TYR HD1 1 1 7 3320 1 1 13 TYR HD2 H -10.645 4.252 -5.555 1.00 . A A . 19 TYR HD2 1 1 7 3321 1 1 13 TYR HE1 H -8.545 4.033 -1.114 1.00 . A A . 19 TYR HE1 1 1 7 3322 1 1 13 TYR HE2 H -10.186 6.325 -4.314 1.00 . A A . 19 TYR HE2 1 1 7 3323 1 1 13 TYR HH H -9.342 6.350 -1.025 1.00 . A A . 19 TYR HH 1 1 7 3324 1 1 13 TYR N N -9.179 -0.267 -3.667 1.00 . A A . 19 TYR N 1 1 7 3325 1 1 13 TYR O O -7.173 1.863 -5.761 1.00 . A A . 19 TYR O 1 1 7 3326 1 1 13 TYR OH O -9.079 6.462 -1.942 1.00 . A A . 19 TYR OH 1 1 7 3327 1 1 14 LEU C C -4.584 1.094 -3.910 1.00 . A A . 20 LEU C 1 1 7 3328 1 1 14 LEU CA C -5.714 2.002 -3.422 1.00 . A A . 20 LEU CA 1 1 7 3329 1 1 14 LEU CB C -5.476 2.396 -1.960 1.00 . A A . 20 LEU CB 1 1 7 3330 1 1 14 LEU CD1 C -4.879 0.091 -1.167 1.00 . A A . 20 LEU CD1 1 1 7 3331 1 1 14 LEU CD2 C -5.564 1.841 0.481 1.00 . A A . 20 LEU CD2 1 1 7 3332 1 1 14 LEU CG C -5.765 1.303 -0.927 1.00 . A A . 20 LEU CG 1 1 7 3333 1 1 14 LEU H H -7.437 0.940 -2.801 1.00 . A A . 20 LEU H 1 1 7 3334 1 1 14 LEU HA H -5.717 2.898 -4.025 1.00 . A A . 20 LEU HA 1 1 7 3335 1 1 14 LEU HB2 H -4.444 2.696 -1.856 1.00 . A A . 20 LEU HB2 1 1 7 3336 1 1 14 LEU HB3 H -6.103 3.246 -1.734 1.00 . A A . 20 LEU HB3 1 1 7 3337 1 1 14 LEU HD11 H -3.876 0.418 -1.400 1.00 . A A . 20 LEU HD11 1 1 7 3338 1 1 14 LEU HD12 H -4.860 -0.522 -0.278 1.00 . A A . 20 LEU HD12 1 1 7 3339 1 1 14 LEU HD13 H -5.272 -0.483 -1.993 1.00 . A A . 20 LEU HD13 1 1 7 3340 1 1 14 LEU HD21 H -6.124 2.757 0.601 1.00 . A A . 20 LEU HD21 1 1 7 3341 1 1 14 LEU HD22 H -5.911 1.111 1.198 1.00 . A A . 20 LEU HD22 1 1 7 3342 1 1 14 LEU HD23 H -4.515 2.036 0.646 1.00 . A A . 20 LEU HD23 1 1 7 3343 1 1 14 LEU HG H -6.793 0.989 -1.021 1.00 . A A . 20 LEU HG 1 1 7 3344 1 1 14 LEU N N -7.017 1.364 -3.576 1.00 . A A . 20 LEU N 1 1 7 3345 1 1 14 LEU O O -3.420 1.493 -3.919 1.00 . A A . 20 LEU O 1 1 7 3346 1 1 15 GLU C C -3.039 -1.561 -3.671 1.00 . A A . 21 GLU C 1 1 7 3347 1 1 15 GLU CA C -3.943 -1.084 -4.804 1.00 . A A . 21 GLU CA 1 1 7 3348 1 1 15 GLU CB C -3.099 -0.463 -5.921 1.00 . A A . 21 GLU CB 1 1 7 3349 1 1 15 GLU CD C -3.078 -2.094 -7.850 1.00 . A A . 21 GLU CD 1 1 7 3350 1 1 15 GLU CG C -2.290 -1.481 -6.708 1.00 . A A . 21 GLU CG 1 1 7 3351 1 1 15 GLU H H -5.874 -0.391 -4.288 1.00 . A A . 21 GLU H 1 1 7 3352 1 1 15 GLU HA H -4.477 -1.935 -5.201 1.00 . A A . 21 GLU HA 1 1 7 3353 1 1 15 GLU HB2 H -3.754 0.052 -6.607 1.00 . A A . 21 GLU HB2 1 1 7 3354 1 1 15 GLU HB3 H -2.414 0.249 -5.486 1.00 . A A . 21 GLU HB3 1 1 7 3355 1 1 15 GLU HG2 H -1.418 -0.991 -7.115 1.00 . A A . 21 GLU HG2 1 1 7 3356 1 1 15 GLU HG3 H -1.979 -2.270 -6.040 1.00 . A A . 21 GLU HG3 1 1 7 3357 1 1 15 GLU N N -4.932 -0.126 -4.317 1.00 . A A . 21 GLU N 1 1 7 3358 1 1 15 GLU O O -3.087 -2.725 -3.274 1.00 . A A . 21 GLU O 1 1 7 3359 1 1 15 GLU OE1 O -3.616 -1.329 -8.678 1.00 . A A . 21 GLU OE1 1 1 7 3360 1 1 15 GLU OE2 O -3.157 -3.338 -7.915 1.00 . A A . 21 GLU OE2 1 1 7 3361 1 1 16 GLY C C -0.418 0.149 -1.668 1.00 . A A . 22 GLY C 1 1 7 3362 1 1 16 GLY CA C -1.314 -1.004 -2.073 1.00 . A A . 22 GLY CA 1 1 7 3363 1 1 16 GLY H H -2.220 0.259 -3.510 1.00 . A A . 22 GLY H 1 1 7 3364 1 1 16 GLY HA2 H -1.897 -1.310 -1.217 1.00 . A A . 22 GLY HA2 1 1 7 3365 1 1 16 GLY HA3 H -0.696 -1.832 -2.388 1.00 . A A . 22 GLY HA3 1 1 7 3366 1 1 16 GLY N N -2.215 -0.654 -3.155 1.00 . A A . 22 GLY N 1 1 7 3367 1 1 16 GLY O O 0.778 0.147 -1.958 1.00 . A A . 22 GLY O 1 1 7 3368 1 1 17 GLN C C 0.765 1.919 0.531 1.00 . A A . 23 GLN C 1 1 7 3369 1 1 17 GLN CA C -0.243 2.303 -0.548 1.00 . A A . 23 GLN CA 1 1 7 3370 1 1 17 GLN CB C -1.192 3.378 -0.017 1.00 . A A . 23 GLN CB 1 1 7 3371 1 1 17 GLN CD C 0.388 5.241 -0.661 1.00 . A A . 23 GLN CD 1 1 7 3372 1 1 17 GLN CG C -0.485 4.648 0.428 1.00 . A A . 23 GLN CG 1 1 7 3373 1 1 17 GLN H H -1.954 1.082 -0.793 1.00 . A A . 23 GLN H 1 1 7 3374 1 1 17 GLN HA H 0.293 2.697 -1.399 1.00 . A A . 23 GLN HA 1 1 7 3375 1 1 17 GLN HB2 H -1.895 3.637 -0.795 1.00 . A A . 23 GLN HB2 1 1 7 3376 1 1 17 GLN HB3 H -1.733 2.979 0.828 1.00 . A A . 23 GLN HB3 1 1 7 3377 1 1 17 GLN HE21 H 2.007 4.988 0.466 1.00 . A A . 23 GLN HE21 1 1 7 3378 1 1 17 GLN HE22 H 2.276 5.695 -1.088 1.00 . A A . 23 GLN HE22 1 1 7 3379 1 1 17 GLN HG2 H -1.228 5.379 0.709 1.00 . A A . 23 GLN HG2 1 1 7 3380 1 1 17 GLN HG3 H 0.135 4.419 1.282 1.00 . A A . 23 GLN HG3 1 1 7 3381 1 1 17 GLN N N -0.997 1.138 -0.995 1.00 . A A . 23 GLN N 1 1 7 3382 1 1 17 GLN NE2 N 1.689 5.316 -0.402 1.00 . A A . 23 GLN NE2 1 1 7 3383 1 1 17 GLN O O 1.819 2.541 0.660 1.00 . A A . 23 GLN O 1 1 7 3384 1 1 17 GLN OE1 O -0.100 5.627 -1.723 1.00 . A A . 23 GLN OE1 1 1 7 3385 1 1 18 ALA C C 2.677 0.022 1.833 1.00 . A A . 24 ALA C 1 1 7 3386 1 1 18 ALA CA C 1.307 0.422 2.374 1.00 . A A . 24 ALA CA 1 1 7 3387 1 1 18 ALA CB C 0.666 -0.747 3.105 1.00 . A A . 24 ALA CB 1 1 7 3388 1 1 18 ALA H H -0.422 0.434 1.154 1.00 . A A . 24 ALA H 1 1 7 3389 1 1 18 ALA HA H 1.433 1.231 3.079 1.00 . A A . 24 ALA HA 1 1 7 3390 1 1 18 ALA HB1 H -0.405 -0.712 2.970 1.00 . A A . 24 ALA HB1 1 1 7 3391 1 1 18 ALA HB2 H 1.049 -1.675 2.707 1.00 . A A . 24 ALA HB2 1 1 7 3392 1 1 18 ALA HB3 H 0.898 -0.684 4.158 1.00 . A A . 24 ALA HB3 1 1 7 3393 1 1 18 ALA N N 0.432 0.890 1.305 1.00 . A A . 24 ALA N 1 1 7 3394 1 1 18 ALA O O 3.669 0.033 2.561 1.00 . A A . 24 ALA O 1 1 7 3395 1 1 19 ALA C C 5.041 0.347 0.056 1.00 . A A . 25 ALA C 1 1 7 3396 1 1 19 ALA CA C 3.975 -0.735 -0.084 1.00 . A A . 25 ALA CA 1 1 7 3397 1 1 19 ALA CB C 3.739 -1.058 -1.552 1.00 . A A . 25 ALA CB 1 1 7 3398 1 1 19 ALA H H 1.902 -0.321 0.020 1.00 . A A . 25 ALA H 1 1 7 3399 1 1 19 ALA HA H 4.323 -1.633 0.405 1.00 . A A . 25 ALA HA 1 1 7 3400 1 1 19 ALA HB1 H 3.321 -0.194 -2.048 1.00 . A A . 25 ALA HB1 1 1 7 3401 1 1 19 ALA HB2 H 4.677 -1.322 -2.018 1.00 . A A . 25 ALA HB2 1 1 7 3402 1 1 19 ALA HB3 H 3.051 -1.887 -1.632 1.00 . A A . 25 ALA HB3 1 1 7 3403 1 1 19 ALA N N 2.726 -0.331 0.551 1.00 . A A . 25 ALA N 1 1 7 3404 1 1 19 ALA O O 6.142 0.086 0.539 1.00 . A A . 25 ALA O 1 1 7 3405 1 1 20 LYS C C 6.437 2.691 0.991 1.00 . A A . 26 LYS C 1 1 7 3406 1 1 20 LYS CA C 5.617 2.705 -0.298 1.00 . A A . 26 LYS CA 1 1 7 3407 1 1 20 LYS CB C 4.830 4.013 -0.402 1.00 . A A . 26 LYS CB 1 1 7 3408 1 1 20 LYS CD C 6.358 4.919 -2.194 1.00 . A A . 26 LYS CD 1 1 7 3409 1 1 20 LYS CE C 5.370 4.512 -3.278 1.00 . A A . 26 LYS CE 1 1 7 3410 1 1 20 LYS CG C 5.661 5.199 -0.870 1.00 . A A . 26 LYS CG 1 1 7 3411 1 1 20 LYS HA H 6.295 2.637 -1.136 1.00 . A A . 26 LYS HA 1 1 7 3412 1 1 20 LYS HB2 H 4.017 3.875 -1.099 1.00 . A A . 26 LYS HB2 1 1 7 3413 1 1 20 LYS HD2 H 6.874 5.812 -2.512 1.00 . A A . 26 LYS HD2 1 1 7 3414 1 1 20 LYS HE2 H 4.367 4.624 -2.895 1.00 . A A . 26 LYS HE2 1 1 7 3415 1 1 20 LYS HG2 H 5.011 6.053 -0.994 1.00 . A A . 26 LYS HG2 1 1 7 3416 1 1 20 LYS HZ1 H 6.233 2.596 -3.225 1.00 . A A . 26 LYS HZ1 1 1 7 3417 1 1 20 LYS N N 4.700 1.564 -0.369 1.00 . A A . 26 LYS N 1 1 7 3418 1 1 20 LYS NZ N 5.564 3.129 -3.704 1.00 . A A . 26 LYS NZ 1 1 7 3419 1 1 20 LYS O O 7.585 3.131 1.008 1.00 . A A . 26 LYS O 1 1 7 3420 1 1 21 GLU C C 7.961 1.613 3.211 1.00 . A A . 27 GLU C 1 1 7 3421 1 1 21 GLU CA C 6.521 2.105 3.360 1.00 . A A . 27 GLU CA 1 1 7 3422 1 1 21 GLU CB C 5.753 1.180 4.306 1.00 . A A . 27 GLU CB 1 1 7 3423 1 1 21 GLU CD C 3.512 0.660 5.352 1.00 . A A . 27 GLU CD 1 1 7 3424 1 1 21 GLU CG C 4.389 1.718 4.709 1.00 . A A . 27 GLU CG 1 1 7 3425 1 1 21 GLU H H 4.927 1.841 1.990 1.00 . A A . 27 GLU H 1 1 7 3426 1 1 21 GLU HA H 6.536 3.099 3.782 1.00 . A A . 27 GLU HA 1 1 7 3427 1 1 21 GLU HB2 H 5.610 0.226 3.821 1.00 . A A . 27 GLU HB2 1 1 7 3428 1 1 21 GLU HB3 H 6.338 1.034 5.202 1.00 . A A . 27 GLU HB3 1 1 7 3429 1 1 21 GLU HG2 H 4.528 2.524 5.414 1.00 . A A . 27 GLU HG2 1 1 7 3430 1 1 21 GLU HG3 H 3.889 2.092 3.828 1.00 . A A . 27 GLU HG3 1 1 7 3431 1 1 21 GLU N N 5.843 2.179 2.067 1.00 . A A . 27 GLU N 1 1 7 3432 1 1 21 GLU O O 8.833 1.972 4.002 1.00 . A A . 27 GLU O 1 1 7 3433 1 1 21 GLU OE1 O 4.060 -0.356 5.828 1.00 . A A . 27 GLU OE1 1 1 7 3434 1 1 21 GLU OE2 O 2.278 0.849 5.379 1.00 . A A . 27 GLU OE2 1 1 7 3435 1 1 22 PHE C C 10.540 1.382 1.690 1.00 . A A . 28 PHE C 1 1 7 3436 1 1 22 PHE CA C 9.539 0.256 1.946 1.00 . A A . 28 PHE CA 1 1 7 3437 1 1 22 PHE CB C 9.513 -0.723 0.760 1.00 . A A . 28 PHE CB 1 1 7 3438 1 1 22 PHE CD1 C 10.568 0.604 -1.099 1.00 . A A . 28 PHE CD1 1 1 7 3439 1 1 22 PHE CD2 C 8.310 -0.116 -1.362 1.00 . A A . 28 PHE CD2 1 1 7 3440 1 1 22 PHE CE1 C 10.523 1.208 -2.341 1.00 . A A . 28 PHE CE1 1 1 7 3441 1 1 22 PHE CE2 C 8.260 0.486 -2.604 1.00 . A A . 28 PHE CE2 1 1 7 3442 1 1 22 PHE CG C 9.463 -0.064 -0.594 1.00 . A A . 28 PHE CG 1 1 7 3443 1 1 22 PHE CZ C 9.368 1.149 -3.094 1.00 . A A . 28 PHE CZ 1 1 7 3444 1 1 22 PHE H H 7.470 0.539 1.595 1.00 . A A . 28 PHE H 1 1 7 3445 1 1 22 PHE HA H 9.845 -0.280 2.833 1.00 . A A . 28 PHE HA 1 1 7 3446 1 1 22 PHE HB2 H 10.399 -1.338 0.790 1.00 . A A . 28 PHE HB2 1 1 7 3447 1 1 22 PHE HB3 H 8.643 -1.358 0.850 1.00 . A A . 28 PHE HB3 1 1 7 3448 1 1 22 PHE HD1 H 11.472 0.651 -0.511 1.00 . A A . 28 PHE HD1 1 1 7 3449 1 1 22 PHE HD2 H 7.445 -0.636 -0.982 1.00 . A A . 28 PHE HD2 1 1 7 3450 1 1 22 PHE HE1 H 11.392 1.725 -2.722 1.00 . A A . 28 PHE HE1 1 1 7 3451 1 1 22 PHE HE2 H 7.355 0.438 -3.192 1.00 . A A . 28 PHE HE2 1 1 7 3452 1 1 22 PHE HZ H 9.331 1.620 -4.065 1.00 . A A . 28 PHE HZ 1 1 7 3453 1 1 22 PHE N N 8.204 0.791 2.193 1.00 . A A . 28 PHE N 1 1 7 3454 1 1 22 PHE O O 11.696 1.309 2.105 1.00 . A A . 28 PHE O 1 1 7 3455 1 1 23 ILE C C 11.676 4.089 1.897 1.00 . A A . 29 ILE C 1 1 7 3456 1 1 23 ILE CA C 10.937 3.562 0.669 1.00 . A A . 29 ILE CA 1 1 7 3457 1 1 23 ILE CB C 10.110 4.703 0.034 1.00 . A A . 29 ILE CB 1 1 7 3458 1 1 23 ILE CD1 C 11.566 6.778 0.427 1.00 . A A . 29 ILE CD1 1 1 7 3459 1 1 23 ILE CG1 C 11.038 5.766 -0.572 1.00 . A A . 29 ILE CG1 1 1 7 3460 1 1 23 ILE CG2 C 9.154 5.317 1.055 1.00 . A A . 29 ILE CG2 1 1 7 3461 1 1 23 ILE H H 9.156 2.417 0.689 1.00 . A A . 29 ILE H 1 1 7 3462 1 1 23 ILE HA H 11.669 3.229 -0.054 1.00 . A A . 29 ILE HA 1 1 7 3463 1 1 23 ILE HB H 9.509 4.274 -0.757 1.00 . A A . 29 ILE HB 1 1 7 3464 1 1 23 ILE HD11 H 11.305 6.469 1.428 1.00 . A A . 29 ILE HD11 1 1 7 3465 1 1 23 ILE HD12 H 12.638 6.843 0.340 1.00 . A A . 29 ILE HD12 1 1 7 3466 1 1 23 ILE HD13 H 11.130 7.744 0.225 1.00 . A A . 29 ILE HD13 1 1 7 3467 1 1 23 ILE HG12 H 11.888 5.275 -1.020 1.00 . A A . 29 ILE HG12 1 1 7 3468 1 1 23 ILE HG13 H 10.499 6.307 -1.337 1.00 . A A . 29 ILE HG13 1 1 7 3469 1 1 23 ILE HG21 H 9.253 4.800 1.998 1.00 . A A . 29 ILE HG21 1 1 7 3470 1 1 23 ILE HG22 H 9.387 6.361 1.192 1.00 . A A . 29 ILE HG22 1 1 7 3471 1 1 23 ILE HG23 H 8.140 5.222 0.699 1.00 . A A . 29 ILE HG23 1 1 7 3472 1 1 23 ILE N N 10.086 2.421 0.996 1.00 . A A . 29 ILE N 1 1 7 3473 1 1 23 ILE O O 12.755 4.670 1.780 1.00 . A A . 29 ILE O 1 1 7 3474 1 1 24 ALA C C 12.892 3.463 4.702 1.00 . A A . 30 ALA C 1 1 7 3475 1 1 24 ALA CA C 11.704 4.339 4.313 1.00 . A A . 30 ALA CA 1 1 7 3476 1 1 24 ALA CB C 10.674 4.359 5.432 1.00 . A A . 30 ALA CB 1 1 7 3477 1 1 24 ALA H H 10.235 3.414 3.104 1.00 . A A . 30 ALA H 1 1 7 3478 1 1 24 ALA HA H 12.052 5.351 4.161 1.00 . A A . 30 ALA HA 1 1 7 3479 1 1 24 ALA HB1 H 9.723 4.689 5.040 1.00 . A A . 30 ALA HB1 1 1 7 3480 1 1 24 ALA HB2 H 10.568 3.365 5.842 1.00 . A A . 30 ALA HB2 1 1 7 3481 1 1 24 ALA HB3 H 10.998 5.035 6.209 1.00 . A A . 30 ALA HB3 1 1 7 3482 1 1 24 ALA N N 11.094 3.884 3.071 1.00 . A A . 30 ALA N 1 1 7 3483 1 1 24 ALA O O 13.736 3.868 5.501 1.00 . A A . 30 ALA O 1 1 7 3484 1 1 25 TRP C C 15.283 1.605 3.625 1.00 . A A . 31 TRP C 1 1 7 3485 1 1 25 TRP CA C 14.023 1.321 4.452 1.00 . A A . 31 TRP CA 1 1 7 3486 1 1 25 TRP CB C 13.548 -0.128 4.227 1.00 . A A . 31 TRP CB 1 1 7 3487 1 1 25 TRP CD1 C 15.681 -1.328 3.458 1.00 . A A . 31 TRP CD1 1 1 7 3488 1 1 25 TRP CD2 C 14.033 -1.327 1.943 1.00 . A A . 31 TRP CD2 1 1 7 3489 1 1 25 TRP CE2 C 15.142 -1.999 1.399 1.00 . A A . 31 TRP CE2 1 1 7 3490 1 1 25 TRP CE3 C 12.875 -1.205 1.169 1.00 . A A . 31 TRP CE3 1 1 7 3491 1 1 25 TRP CG C 14.398 -0.904 3.261 1.00 . A A . 31 TRP CG 1 1 7 3492 1 1 25 TRP CH2 C 13.983 -2.408 -0.615 1.00 . A A . 31 TRP CH2 1 1 7 3493 1 1 25 TRP CZ2 C 15.128 -2.541 0.118 1.00 . A A . 31 TRP CZ2 1 1 7 3494 1 1 25 TRP CZ3 C 12.862 -1.748 -0.101 1.00 . A A . 31 TRP CZ3 1 1 7 3495 1 1 25 TRP H H 12.240 1.982 3.525 1.00 . A A . 31 TRP H 1 1 7 3496 1 1 25 TRP HA H 14.268 1.443 5.496 1.00 . A A . 31 TRP HA 1 1 7 3497 1 1 25 TRP HB2 H 13.558 -0.651 5.171 1.00 . A A . 31 TRP HB2 1 1 7 3498 1 1 25 TRP HB3 H 12.538 -0.110 3.843 1.00 . A A . 31 TRP HB3 1 1 7 3499 1 1 25 TRP HD1 H 16.245 -1.160 4.364 1.00 . A A . 31 TRP HD1 1 1 7 3500 1 1 25 TRP HE1 H 17.027 -2.381 2.238 1.00 . A A . 31 TRP HE1 1 1 7 3501 1 1 25 TRP HE3 H 12.003 -0.701 1.548 1.00 . A A . 31 TRP HE3 1 1 7 3502 1 1 25 TRP HH2 H 13.929 -2.819 -1.611 1.00 . A A . 31 TRP HH2 1 1 7 3503 1 1 25 TRP HZ2 H 15.983 -3.047 -0.295 1.00 . A A . 31 TRP HZ2 1 1 7 3504 1 1 25 TRP HZ3 H 11.976 -1.663 -0.713 1.00 . A A . 31 TRP HZ3 1 1 7 3505 1 1 25 TRP N N 12.946 2.256 4.146 1.00 . A A . 31 TRP N 1 1 7 3506 1 1 25 TRP NE1 N 16.137 -1.984 2.342 1.00 . A A . 31 TRP NE1 1 1 7 3507 1 1 25 TRP O O 16.350 1.868 4.180 1.00 . A A . 31 TRP O 1 1 7 3508 1 1 26 LEU C C 16.910 3.109 1.542 1.00 . A A . 32 LEU C 1 1 7 3509 1 1 26 LEU CA C 16.311 1.709 1.419 1.00 . A A . 32 LEU CA 1 1 7 3510 1 1 26 LEU CB C 15.957 1.382 -0.041 1.00 . A A . 32 LEU CB 1 1 7 3511 1 1 26 LEU CD1 C 13.949 2.872 0.017 1.00 . A A . 32 LEU CD1 1 1 7 3512 1 1 26 LEU CD2 C 16.023 3.627 -1.160 1.00 . A A . 32 LEU CD2 1 1 7 3513 1 1 26 LEU CG C 15.149 2.436 -0.797 1.00 . A A . 32 LEU CG 1 1 7 3514 1 1 26 LEU H H 14.299 1.263 1.913 1.00 . A A . 32 LEU H 1 1 7 3515 1 1 26 LEU HA H 17.058 1.009 1.736 1.00 . A A . 32 LEU HA 1 1 7 3516 1 1 26 LEU HB2 H 16.878 1.219 -0.579 1.00 . A A . 32 LEU HB2 1 1 7 3517 1 1 26 LEU HB3 H 15.393 0.461 -0.049 1.00 . A A . 32 LEU HB3 1 1 7 3518 1 1 26 LEU HD11 H 14.271 3.179 0.997 1.00 . A A . 32 LEU HD11 1 1 7 3519 1 1 26 LEU HD12 H 13.461 3.697 -0.479 1.00 . A A . 32 LEU HD12 1 1 7 3520 1 1 26 LEU HD13 H 13.261 2.044 0.107 1.00 . A A . 32 LEU HD13 1 1 7 3521 1 1 26 LEU HD21 H 17.047 3.300 -1.267 1.00 . A A . 32 LEU HD21 1 1 7 3522 1 1 26 LEU HD22 H 15.682 4.053 -2.092 1.00 . A A . 32 LEU HD22 1 1 7 3523 1 1 26 LEU HD23 H 15.961 4.370 -0.380 1.00 . A A . 32 LEU HD23 1 1 7 3524 1 1 26 LEU HG H 14.782 2.002 -1.716 1.00 . A A . 32 LEU HG 1 1 7 3525 1 1 26 LEU N N 15.165 1.507 2.301 1.00 . A A . 32 LEU N 1 1 7 3526 1 1 26 LEU O O 18.059 3.329 1.158 1.00 . A A . 32 LEU O 1 1 7 3527 1 1 27 VAL C C 17.313 5.607 3.592 1.00 . A A . 33 VAL C 1 1 7 3528 1 1 27 VAL CA C 16.634 5.419 2.235 1.00 . A A . 33 VAL CA 1 1 7 3529 1 1 27 VAL CB C 15.497 6.449 2.071 1.00 . A A . 33 VAL CB 1 1 7 3530 1 1 27 VAL CG1 C 15.952 7.842 2.489 1.00 . A A . 33 VAL CG1 1 1 7 3531 1 1 27 VAL CG2 C 15.004 6.459 0.633 1.00 . A A . 33 VAL CG2 1 1 7 3532 1 1 27 VAL H H 15.238 3.832 2.371 1.00 . A A . 33 VAL H 1 1 7 3533 1 1 27 VAL HA H 17.364 5.597 1.458 1.00 . A A . 33 VAL HA 1 1 7 3534 1 1 27 VAL HB H 14.676 6.156 2.708 1.00 . A A . 33 VAL HB 1 1 7 3535 1 1 27 VAL HG11 H 16.928 8.042 2.074 1.00 . A A . 33 VAL HG11 1 1 7 3536 1 1 27 VAL HG12 H 15.248 8.575 2.123 1.00 . A A . 33 VAL HG12 1 1 7 3537 1 1 27 VAL HG13 H 16.001 7.897 3.566 1.00 . A A . 33 VAL HG13 1 1 7 3538 1 1 27 VAL HG21 H 15.840 6.313 -0.035 1.00 . A A . 33 VAL HG21 1 1 7 3539 1 1 27 VAL HG22 H 14.287 5.663 0.492 1.00 . A A . 33 VAL HG22 1 1 7 3540 1 1 27 VAL HG23 H 14.534 7.408 0.418 1.00 . A A . 33 VAL HG23 1 1 7 3541 1 1 27 VAL N N 16.144 4.054 2.075 1.00 . A A . 33 VAL N 1 1 7 3542 1 1 27 VAL O O 18.138 6.504 3.761 1.00 . A A . 33 VAL O 1 1 7 3543 1 1 28 ARG C C 18.499 3.669 6.137 1.00 . A A . 34 ARG C 1 1 7 3544 1 1 28 ARG CA C 17.551 4.838 5.888 1.00 . A A . 34 ARG CA 1 1 7 3545 1 1 28 ARG CB C 16.452 4.857 6.953 1.00 . A A . 34 ARG CB 1 1 7 3546 1 1 28 ARG CD C 15.360 6.968 6.137 1.00 . A A . 34 ARG CD 1 1 7 3547 1 1 28 ARG CG C 15.987 6.255 7.324 1.00 . A A . 34 ARG CG 1 1 7 3548 1 1 28 ARG CZ C 16.097 9.288 6.521 1.00 . A A . 34 ARG CZ 1 1 7 3549 1 1 28 ARG H H 16.305 4.059 4.363 1.00 . A A . 34 ARG H 1 1 7 3550 1 1 28 ARG HA H 18.112 5.759 5.947 1.00 . A A . 34 ARG HA 1 1 7 3551 1 1 28 ARG HB2 H 15.602 4.303 6.585 1.00 . A A . 34 ARG HB2 1 1 7 3552 1 1 28 ARG HB3 H 16.824 4.376 7.845 1.00 . A A . 34 ARG HB3 1 1 7 3553 1 1 28 ARG HD2 H 16.023 6.881 5.289 1.00 . A A . 34 ARG HD2 1 1 7 3554 1 1 28 ARG HD3 H 14.417 6.495 5.906 1.00 . A A . 34 ARG HD3 1 1 7 3555 1 1 28 ARG HE H 14.197 8.677 6.515 1.00 . A A . 34 ARG HE 1 1 7 3556 1 1 28 ARG HG2 H 15.255 6.183 8.114 1.00 . A A . 34 ARG HG2 1 1 7 3557 1 1 28 ARG HG3 H 16.837 6.827 7.668 1.00 . A A . 34 ARG HG3 1 1 7 3558 1 1 28 ARG HH11 H 17.600 7.975 6.198 1.00 . A A . 34 ARG HH11 1 1 7 3559 1 1 28 ARG HH12 H 18.092 9.612 6.471 1.00 . A A . 34 ARG HH12 1 1 7 3560 1 1 28 ARG HH21 H 14.841 10.832 6.872 1.00 . A A . 34 ARG HH21 1 1 7 3561 1 1 28 ARG HH22 H 16.525 11.235 6.854 1.00 . A A . 34 ARG HH22 1 1 7 3562 1 1 28 ARG N N 16.966 4.757 4.554 1.00 . A A . 34 ARG N 1 1 7 3563 1 1 28 ARG NE N 15.126 8.384 6.409 1.00 . A A . 34 ARG NE 1 1 7 3564 1 1 28 ARG NH1 N 17.367 8.928 6.385 1.00 . A A . 34 ARG NH1 1 1 7 3565 1 1 28 ARG NH2 N 15.796 10.556 6.769 1.00 . A A . 34 ARG NH2 1 1 7 3566 1 1 28 ARG O O 18.201 2.770 6.924 1.00 . A A . 34 ARG O 1 1 7 3567 1 1 29 GLY C C 20.311 1.419 4.760 1.00 . A A . 35 GLY C 1 1 7 3568 1 1 29 GLY CA C 20.619 2.626 5.624 1.00 . A A . 35 GLY CA 1 1 7 3569 1 1 29 GLY H H 19.828 4.431 4.849 1.00 . A A . 35 GLY H 1 1 7 3570 1 1 29 GLY HA2 H 21.595 3.005 5.360 1.00 . A A . 35 GLY HA2 1 1 7 3571 1 1 29 GLY HA3 H 20.631 2.320 6.660 1.00 . A A . 35 GLY HA3 1 1 7 3572 1 1 29 GLY N N 19.644 3.689 5.462 1.00 . A A . 35 GLY N 1 1 7 3573 1 1 29 GLY O O 19.541 0.544 5.156 1.00 . A A . 35 GLY O 1 1 7 3574 1 1 30 ARG C C 22.033 -0.282 2.141 1.00 . A A . 36 ARG C 1 1 7 3575 1 1 30 ARG CA C 20.703 0.261 2.655 1.00 . A A . 36 ARG CA 1 1 7 3576 1 1 30 ARG CB C 19.833 0.707 1.478 1.00 . A A . 36 ARG CB 1 1 7 3577 1 1 30 ARG CD C 19.166 -0.184 -0.777 1.00 . A A . 36 ARG CD 1 1 7 3578 1 1 30 ARG CG C 19.197 -0.447 0.720 1.00 . A A . 36 ARG CG 1 1 7 3579 1 1 30 ARG CZ C 18.360 -1.356 -2.789 1.00 . A A . 36 ARG CZ 1 1 7 3580 1 1 30 ARG H H 21.519 2.098 3.319 1.00 . A A . 36 ARG H 1 1 7 3581 1 1 30 ARG HA H 20.191 -0.523 3.192 1.00 . A A . 36 ARG HA 1 1 7 3582 1 1 30 ARG HB2 H 19.044 1.344 1.850 1.00 . A A . 36 ARG HB2 1 1 7 3583 1 1 30 ARG HB3 H 20.443 1.271 0.787 1.00 . A A . 36 ARG HB3 1 1 7 3584 1 1 30 ARG HD2 H 18.807 0.821 -0.945 1.00 . A A . 36 ARG HD2 1 1 7 3585 1 1 30 ARG HD3 H 20.170 -0.276 -1.166 1.00 . A A . 36 ARG HD3 1 1 7 3586 1 1 30 ARG HE H 17.628 -1.605 -0.949 1.00 . A A . 36 ARG HE 1 1 7 3587 1 1 30 ARG HG2 H 19.767 -1.345 0.906 1.00 . A A . 36 ARG HG2 1 1 7 3588 1 1 30 ARG HG3 H 18.185 -0.582 1.074 1.00 . A A . 36 ARG HG3 1 1 7 3589 1 1 30 ARG HH11 H 19.880 -0.064 -3.125 1.00 . A A . 36 ARG HH11 1 1 7 3590 1 1 30 ARG HH12 H 19.294 -0.901 -4.523 1.00 . A A . 36 ARG HH12 1 1 7 3591 1 1 30 ARG HH21 H 16.857 -2.707 -2.786 1.00 . A A . 36 ARG HH21 1 1 7 3592 1 1 30 ARG HH22 H 17.577 -2.402 -4.331 1.00 . A A . 36 ARG HH22 1 1 7 3593 1 1 30 ARG N N 20.916 1.371 3.577 1.00 . A A . 36 ARG N 1 1 7 3594 1 1 30 ARG NE N 18.296 -1.123 -1.480 1.00 . A A . 36 ARG NE 1 1 7 3595 1 1 30 ARG NH1 N 19.251 -0.721 -3.541 1.00 . A A . 36 ARG NH1 1 1 7 3596 1 1 30 ARG NH2 N 17.530 -2.226 -3.348 1.00 . A A . 36 ARG NH2 1 1 7 3597 1 1 30 ARG O O 22.139 -0.709 0.992 1.00 . A A . 36 ARG O 1 1 7 3598 1 1 31 GLY C C 25.395 -0.549 3.702 1.00 . A A . 37 GLY C 1 1 7 3599 1 1 31 GLY CA C 24.356 -0.756 2.617 1.00 . A A . 37 GLY CA 1 1 7 3600 1 1 31 GLY H H 22.903 0.090 3.905 1.00 . A A . 37 GLY H 1 1 7 3601 1 1 31 GLY HA2 H 24.282 -1.811 2.401 1.00 . A A . 37 GLY HA2 1 1 7 3602 1 1 31 GLY HA3 H 24.675 -0.238 1.725 1.00 . A A . 37 GLY HA3 1 1 7 3603 1 1 31 GLY N N 23.046 -0.262 3.002 1.00 . A A . 37 GLY N 1 1 7 3604 1 1 31 GLY O O 25.404 0.539 4.316 1.00 . A A . 37 GLY O 1 1 7 3605 1 1 31 GLY OXT O 26.200 -1.475 3.937 1.00 . A A . 37 GLY OXT 1 1 7 3606 2 2 1 . C02 C 8.781 -1.733 -4.570 1.00 . B A . 1038 D6M C02 1 1 7 3607 2 2 1 . C04 C 6.965 -0.555 -5.688 1.00 . B A . 1038 D6M C04 1 1 7 3608 2 2 1 . C05 C 6.509 0.906 -5.703 1.00 . B A . 1038 D6M C05 1 1 7 3609 2 2 1 . C06 C 5.130 1.121 -5.100 1.00 . B A . 1038 D6M C06 1 1 7 3610 2 2 1 . C07 C 4.888 2.563 -4.698 1.00 . B A . 1038 D6M C07 1 1 7 3611 2 2 1 . C09 C 6.840 -1.156 -7.085 1.00 . B A . 1038 D6M C09 1 1 7 3612 2 2 1 . C12 C 10.199 -1.813 -4.039 1.00 . B A . 1038 D6M C12 1 1 7 3613 2 2 1 . C13 C 11.170 -0.957 -4.836 1.00 . B A . 1038 D6M C13 1 1 7 3614 2 2 1 . C14 C 12.584 -1.510 -4.770 1.00 . B A . 1038 D6M C14 1 1 7 3615 2 2 1 . C15 C 13.200 -1.303 -3.396 1.00 . B A . 1038 D6M C15 1 1 7 3616 2 2 1 . C16 C 13.619 0.142 -3.183 1.00 . B A . 1038 D6M C16 1 1 7 3617 2 2 1 . C17 C 14.984 0.423 -3.795 1.00 . B A . 1038 D6M C17 1 1 7 3618 2 2 1 . C18 C 14.894 1.448 -4.914 1.00 . B A . 1038 D6M C18 1 1 7 3619 2 2 1 . C19 C 15.246 2.843 -4.422 1.00 . B A . 1038 D6M C19 1 1 7 3620 2 2 1 . C20 C 14.008 3.609 -3.984 1.00 . B A . 1038 D6M C20 1 1 7 3621 2 2 1 . C21 C 14.080 5.069 -4.401 1.00 . B A . 1038 D6M C21 1 1 7 3622 2 2 1 . C22 C 12.983 5.890 -3.745 1.00 . B A . 1038 D6M C22 1 1 7 3623 2 2 1 . C23 C 13.449 7.306 -3.439 1.00 . B A . 1038 D6M C23 1 1 7 3624 2 2 1 . C24 C 13.152 7.691 -1.999 1.00 . B A . 1038 D6M C24 1 1 7 3625 2 2 1 . C25 C 13.651 9.092 -1.682 1.00 . B A . 1038 D6M C25 1 1 7 3626 2 2 1 . C26 C 12.574 10.132 -1.905 1.00 . B A . 1038 D6M C26 1 1 7 3627 2 2 1 . H03 H 8.943 0.109 -5.329 1.00 . B A . 1038 D6M H03 1 1 7 3628 2 2 1 . H04 H 6.335 -1.112 -5.012 1.00 . B A . 1038 D6M H04 1 1 7 3629 2 2 1 . HP21 H 10.526 -2.842 -4.083 1.00 . B A . 1038 D6M HP21 1 1 7 3630 2 2 1 . HP22 H 10.203 -1.478 -3.012 1.00 . B A . 1038 D6M HP22 1 1 7 3631 2 2 1 . HP31 H 11.165 0.045 -4.434 1.00 . B A . 1038 D6M HP31 1 1 7 3632 2 2 1 . HP32 H 10.851 -0.934 -5.868 1.00 . B A . 1038 D6M HP32 1 1 7 3633 2 2 1 . HP41 H 13.192 -1.006 -5.507 1.00 . B A . 1038 D6M HP41 1 1 7 3634 2 2 1 . HP42 H 12.557 -2.567 -4.985 1.00 . B A . 1038 D6M HP42 1 1 7 3635 2 2 1 . HP51 H 14.070 -1.937 -3.306 1.00 . B A . 1038 D6M HP51 1 1 7 3636 2 2 1 . HP52 H 12.475 -1.572 -2.642 1.00 . B A . 1038 D6M HP52 1 1 7 3637 2 2 1 . HP61 H 13.662 0.340 -2.121 1.00 . B A . 1038 D6M HP61 1 1 7 3638 2 2 1 . HP62 H 12.888 0.790 -3.642 1.00 . B A . 1038 D6M HP62 1 1 7 3639 2 2 1 . HP71 H 15.387 -0.497 -4.193 1.00 . B A . 1038 D6M HP71 1 1 7 3640 2 2 1 . HP72 H 15.641 0.802 -3.027 1.00 . B A . 1038 D6M HP72 1 1 7 3641 2 2 1 . HP81 H 13.885 1.456 -5.301 1.00 . B A . 1038 D6M HP81 1 1 7 3642 2 2 1 . HP82 H 15.580 1.171 -5.700 1.00 . B A . 1038 D6M HP82 1 1 7 3643 2 2 1 . HP91 H 15.730 3.384 -5.222 1.00 . B A . 1038 D6M HP91 1 1 7 3644 2 2 1 . HP92 H 15.921 2.758 -3.583 1.00 . B A . 1038 D6M HP92 1 1 7 3645 2 2 1 . HPA1 H 13.925 3.554 -2.908 1.00 . B A . 1038 D6M HPA1 1 1 7 3646 2 2 1 . HPA2 H 13.138 3.158 -4.437 1.00 . B A . 1038 D6M HPA2 1 1 7 3647 2 2 1 . HPB1 H 13.973 5.132 -5.474 1.00 . B A . 1038 D6M HPB1 1 1 7 3648 2 2 1 . HPB2 H 15.039 5.470 -4.109 1.00 . B A . 1038 D6M HPB2 1 1 7 3649 2 2 1 . HPC1 H 12.690 5.409 -2.823 1.00 . B A . 1038 D6M HPC1 1 1 7 3650 2 2 1 . HPC2 H 12.135 5.938 -4.412 1.00 . B A . 1038 D6M HPC2 1 1 7 3651 2 2 1 . HPD1 H 12.939 7.992 -4.099 1.00 . B A . 1038 D6M HPD1 1 1 7 3652 2 2 1 . HPD2 H 14.514 7.369 -3.605 1.00 . B A . 1038 D6M HPD2 1 1 7 3653 2 2 1 . HPE1 H 13.640 6.988 -1.341 1.00 . B A . 1038 D6M HPE1 1 1 7 3654 2 2 1 . HPE2 H 12.085 7.656 -1.840 1.00 . B A . 1038 D6M HPE2 1 1 7 3655 2 2 1 . HPF1 H 14.491 9.322 -2.321 1.00 . B A . 1038 D6M HPF1 1 1 7 3656 2 2 1 . HPF2 H 13.956 9.133 -0.647 1.00 . B A . 1038 D6M HPF2 1 1 7 3657 2 2 1 . HPG1 H 12.618 10.870 -1.118 1.00 . B A . 1038 D6M HPG1 1 1 7 3658 2 2 1 . HPG2 H 11.605 9.654 -1.898 1.00 . B A . 1038 D6M HPG2 1 1 7 3659 2 2 1 . HPG3 H 12.731 10.613 -2.859 1.00 . B A . 1038 D6M HPG3 1 1 7 3660 2 2 1 . HQ21 H 4.384 0.836 -5.827 1.00 . B A . 1038 D6M HQ21 1 1 7 3661 2 2 1 . HQ22 H 5.034 0.498 -4.223 1.00 . B A . 1038 D6M HQ22 1 1 7 3662 2 2 1 . HQ31 H 7.219 1.497 -5.143 1.00 . B A . 1038 D6M HQ31 1 1 7 3663 2 2 1 . HQ32 H 6.490 1.257 -6.725 1.00 . B A . 1038 D6M HQ32 1 1 7 3664 2 2 1 . N03 N 8.337 -0.650 -5.202 1.00 . B A . 1038 D6M N03 1 1 7 3665 2 2 1 . O01 O 8.033 -2.693 -4.380 1.00 . B A . 1038 D6M O01 1 1 7 3666 2 2 1 . O08 O 4.042 3.206 -5.320 1.00 . B A . 1038 D6M O08 1 1 7 3667 2 2 1 . O10 O 7.847 -1.150 -7.823 1.00 . B A . 1038 D6M O10 1 1 7 3668 2 2 1 . O11 O 5.736 -1.629 -7.428 1.00 . B A . 1038 D6M O11 1 1 8 3669 1 1 1 HIS C C -27.862 0.761 0.006 1.00 . A A . 7 HIS C 1 1 8 3670 1 1 1 HIS CA C -28.812 0.846 -1.184 1.00 . A A . 7 HIS CA 1 1 8 3671 1 1 1 HIS CB C -28.875 -0.500 -1.907 1.00 . A A . 7 HIS CB 1 1 8 3672 1 1 1 HIS CD2 C -30.515 -1.709 -3.513 1.00 . A A . 7 HIS CD2 1 1 8 3673 1 1 1 HIS CE1 C -31.995 -0.105 -3.726 1.00 . A A . 7 HIS CE1 1 1 8 3674 1 1 1 HIS CG C -30.093 -0.663 -2.762 1.00 . A A . 7 HIS CG 1 1 8 3675 1 1 1 HIS H1 H -27.447 1.589 -2.532 1.00 . A A . 7 HIS H1 1 1 8 3676 1 1 1 HIS H2 H -29.083 1.939 -2.905 1.00 . A A . 7 HIS H2 1 1 8 3677 1 1 1 HIS H3 H -28.293 2.784 -1.637 1.00 . A A . 7 HIS H3 1 1 8 3678 1 1 1 HIS HA H -29.798 1.106 -0.829 1.00 . A A . 7 HIS HA 1 1 8 3679 1 1 1 HIS HB2 H -28.008 -0.601 -2.542 1.00 . A A . 7 HIS HB2 1 1 8 3680 1 1 1 HIS HB3 H -28.873 -1.295 -1.175 1.00 . A A . 7 HIS HB3 1 1 8 3681 1 1 1 HIS HD1 H -31.020 1.210 -2.498 1.00 . A A . 7 HIS HD1 1 1 8 3682 1 1 1 HIS HD2 H -30.014 -2.659 -3.628 1.00 . A A . 7 HIS HD2 1 1 8 3683 1 1 1 HIS HE1 H -32.867 0.456 -4.028 1.00 . A A . 7 HIS HE1 1 1 8 3684 1 1 1 HIS HE2 H -32.192 -1.856 -4.769 1.00 . A A . 7 HIS HE2 1 1 8 3685 1 1 1 HIS N N -28.369 1.883 -2.152 1.00 . A A . 7 HIS N 1 1 8 3686 1 1 1 HIS ND1 N -31.042 0.325 -2.918 1.00 . A A . 7 HIS ND1 1 1 8 3687 1 1 1 HIS NE2 N -31.699 -1.335 -4.101 1.00 . A A . 7 HIS NE2 1 1 8 3688 1 1 1 HIS O O -26.717 1.205 -0.068 1.00 . A A . 7 HIS O 1 1 8 3689 1 1 2 ALA C C -26.625 -1.174 2.217 1.00 . A A . 8 ALA C 1 1 8 3690 1 1 2 ALA CA C -27.540 0.043 2.309 1.00 . A A . 8 ALA CA 1 1 8 3691 1 1 2 ALA CB C -28.437 -0.060 3.534 1.00 . A A . 8 ALA CB 1 1 8 3692 1 1 2 ALA H H -29.267 -0.148 1.101 1.00 . A A . 8 ALA H 1 1 8 3693 1 1 2 ALA HA H -26.932 0.931 2.411 1.00 . A A . 8 ALA HA 1 1 8 3694 1 1 2 ALA HB1 H -29.405 0.361 3.307 1.00 . A A . 8 ALA HB1 1 1 8 3695 1 1 2 ALA HB2 H -28.551 -1.098 3.810 1.00 . A A . 8 ALA HB2 1 1 8 3696 1 1 2 ALA HB3 H -27.991 0.484 4.353 1.00 . A A . 8 ALA HB3 1 1 8 3697 1 1 2 ALA N N -28.346 0.187 1.103 1.00 . A A . 8 ALA N 1 1 8 3698 1 1 2 ALA O O -27.038 -2.296 2.510 1.00 . A A . 8 ALA O 1 1 8 3699 1 1 3 GLU C C -23.231 -1.810 2.623 1.00 . A A . 9 GLU C 1 1 8 3700 1 1 3 GLU CA C -24.408 -2.022 1.676 1.00 . A A . 9 GLU CA 1 1 8 3701 1 1 3 GLU CB C -23.907 -2.112 0.234 1.00 . A A . 9 GLU CB 1 1 8 3702 1 1 3 GLU CD C -25.055 -3.590 -1.464 1.00 . A A . 9 GLU CD 1 1 8 3703 1 1 3 GLU CG C -25.024 -2.232 -0.791 1.00 . A A . 9 GLU CG 1 1 8 3704 1 1 3 GLU H H -25.113 -0.027 1.588 1.00 . A A . 9 GLU H 1 1 8 3705 1 1 3 GLU HA H -24.901 -2.947 1.935 1.00 . A A . 9 GLU HA 1 1 8 3706 1 1 3 GLU HB2 H -23.334 -1.225 0.008 1.00 . A A . 9 GLU HB2 1 1 8 3707 1 1 3 GLU HB3 H -23.267 -2.977 0.141 1.00 . A A . 9 GLU HB3 1 1 8 3708 1 1 3 GLU HG2 H -25.969 -2.072 -0.296 1.00 . A A . 9 GLU HG2 1 1 8 3709 1 1 3 GLU HG3 H -24.882 -1.474 -1.548 1.00 . A A . 9 GLU HG3 1 1 8 3710 1 1 3 GLU N N -25.382 -0.944 1.807 1.00 . A A . 9 GLU N 1 1 8 3711 1 1 3 GLU O O -23.094 -0.749 3.232 1.00 . A A . 9 GLU O 1 1 8 3712 1 1 3 GLU OE1 O -24.547 -4.561 -0.866 1.00 . A A . 9 GLU OE1 1 1 8 3713 1 1 3 GLU OE2 O -25.589 -3.683 -2.590 1.00 . A A . 9 GLU OE2 1 1 8 3714 1 1 4 GLY C C -19.937 -2.519 2.848 1.00 . A A . 10 GLY C 1 1 8 3715 1 1 4 GLY CA C -21.228 -2.731 3.614 1.00 . A A . 10 GLY CA 1 1 8 3716 1 1 4 GLY H H -22.543 -3.647 2.230 1.00 . A A . 10 GLY H 1 1 8 3717 1 1 4 GLY HA2 H -21.371 -1.903 4.293 1.00 . A A . 10 GLY HA2 1 1 8 3718 1 1 4 GLY HA3 H -21.148 -3.643 4.187 1.00 . A A . 10 GLY HA3 1 1 8 3719 1 1 4 GLY N N -22.383 -2.826 2.741 1.00 . A A . 10 GLY N 1 1 8 3720 1 1 4 GLY O O -19.396 -3.455 2.260 1.00 . A A . 10 GLY O 1 1 8 3721 1 1 5 THR C C -17.291 -0.113 3.040 1.00 . A A . 11 THR C 1 1 8 3722 1 1 5 THR CA C -18.208 -0.952 2.156 1.00 . A A . 11 THR CA 1 1 8 3723 1 1 5 THR CB C -18.517 -0.197 0.862 1.00 . A A . 11 THR CB 1 1 8 3724 1 1 5 THR CG2 C -19.241 1.112 1.092 1.00 . A A . 11 THR CG2 1 1 8 3725 1 1 5 THR H H -19.921 -0.582 3.343 1.00 . A A . 11 THR H 1 1 8 3726 1 1 5 THR HA H -17.706 -1.876 1.912 1.00 . A A . 11 THR HA 1 1 8 3727 1 1 5 THR HB H -19.145 -0.817 0.238 1.00 . A A . 11 THR HB 1 1 8 3728 1 1 5 THR HG1 H -16.740 0.609 0.705 1.00 . A A . 11 THR HG1 1 1 8 3729 1 1 5 THR HG21 H -19.294 1.312 2.152 1.00 . A A . 11 THR HG21 1 1 8 3730 1 1 5 THR HG22 H -18.704 1.910 0.601 1.00 . A A . 11 THR HG22 1 1 8 3731 1 1 5 THR HG23 H -20.240 1.047 0.687 1.00 . A A . 11 THR HG23 1 1 8 3732 1 1 5 THR N N -19.443 -1.285 2.855 1.00 . A A . 11 THR N 1 1 8 3733 1 1 5 THR O O -17.752 0.751 3.786 1.00 . A A . 11 THR O 1 1 8 3734 1 1 5 THR OG1 O -17.326 0.089 0.151 1.00 . A A . 11 THR OG1 1 1 8 3735 1 1 6 PHE C C -13.591 0.042 3.285 1.00 . A A . 12 PHE C 1 1 8 3736 1 1 6 PHE CA C -15.010 0.357 3.746 1.00 . A A . 12 PHE CA 1 1 8 3737 1 1 6 PHE CB C -15.164 0.014 5.229 1.00 . A A . 12 PHE CB 1 1 8 3738 1 1 6 PHE CD1 C -14.503 2.323 5.956 1.00 . A A . 12 PHE CD1 1 1 8 3739 1 1 6 PHE CD2 C -13.659 0.462 7.186 1.00 . A A . 12 PHE CD2 1 1 8 3740 1 1 6 PHE CE1 C -13.826 3.188 6.794 1.00 . A A . 12 PHE CE1 1 1 8 3741 1 1 6 PHE CE2 C -12.979 1.323 8.028 1.00 . A A . 12 PHE CE2 1 1 8 3742 1 1 6 PHE CG C -14.427 0.952 6.142 1.00 . A A . 12 PHE CG 1 1 8 3743 1 1 6 PHE CZ C -13.063 2.688 7.831 1.00 . A A . 12 PHE CZ 1 1 8 3744 1 1 6 PHE H H -15.684 -1.076 2.341 1.00 . A A . 12 PHE H 1 1 8 3745 1 1 6 PHE HA H -15.194 1.412 3.610 1.00 . A A . 12 PHE HA 1 1 8 3746 1 1 6 PHE HB2 H -16.211 0.049 5.493 1.00 . A A . 12 PHE HB2 1 1 8 3747 1 1 6 PHE HB3 H -14.788 -0.984 5.401 1.00 . A A . 12 PHE HB3 1 1 8 3748 1 1 6 PHE HD1 H -15.100 2.715 5.146 1.00 . A A . 12 PHE HD1 1 1 8 3749 1 1 6 PHE HD2 H -13.592 -0.604 7.340 1.00 . A A . 12 PHE HD2 1 1 8 3750 1 1 6 PHE HE1 H -13.893 4.255 6.638 1.00 . A A . 12 PHE HE1 1 1 8 3751 1 1 6 PHE HE2 H -12.384 0.929 8.838 1.00 . A A . 12 PHE HE2 1 1 8 3752 1 1 6 PHE HZ H -12.533 3.362 8.487 1.00 . A A . 12 PHE HZ 1 1 8 3753 1 1 6 PHE N N -15.991 -0.375 2.953 1.00 . A A . 12 PHE N 1 1 8 3754 1 1 6 PHE O O -12.749 0.934 3.180 1.00 . A A . 12 PHE O 1 1 8 3755 1 1 7 THR C C -11.843 -1.437 1.066 1.00 . A A . 13 THR C 1 1 8 3756 1 1 7 THR CA C -12.013 -1.667 2.564 1.00 . A A . 13 THR CA 1 1 8 3757 1 1 7 THR CB C -11.802 -3.145 2.892 1.00 . A A . 13 THR CB 1 1 8 3758 1 1 7 THR CG2 C -11.299 -3.381 4.299 1.00 . A A . 13 THR CG2 1 1 8 3759 1 1 7 THR H H -14.044 -1.899 3.117 1.00 . A A . 13 THR H 1 1 8 3760 1 1 7 THR HA H -11.275 -1.081 3.092 1.00 . A A . 13 THR HA 1 1 8 3761 1 1 7 THR HB H -11.072 -3.554 2.207 1.00 . A A . 13 THR HB 1 1 8 3762 1 1 7 THR HG1 H -13.304 -3.815 1.828 1.00 . A A . 13 THR HG1 1 1 8 3763 1 1 7 THR HG21 H -11.091 -2.431 4.771 1.00 . A A . 13 THR HG21 1 1 8 3764 1 1 7 THR HG22 H -12.051 -3.908 4.867 1.00 . A A . 13 THR HG22 1 1 8 3765 1 1 7 THR HG23 H -10.395 -3.970 4.265 1.00 . A A . 13 THR HG23 1 1 8 3766 1 1 7 THR N N -13.332 -1.233 3.013 1.00 . A A . 13 THR N 1 1 8 3767 1 1 7 THR O O -10.785 -1.003 0.611 1.00 . A A . 13 THR O 1 1 8 3768 1 1 7 THR OG1 O -13.009 -3.870 2.740 1.00 . A A . 13 THR OG1 1 1 8 3769 1 1 8 SER C C -12.591 -0.101 -1.512 1.00 . A A . 14 SER C 1 1 8 3770 1 1 8 SER CA C -12.855 -1.557 -1.144 1.00 . A A . 14 SER CA 1 1 8 3771 1 1 8 SER CB C -14.173 -2.021 -1.767 1.00 . A A . 14 SER CB 1 1 8 3772 1 1 8 SER H H -13.707 -2.074 0.724 1.00 . A A . 14 SER H 1 1 8 3773 1 1 8 SER HA H -12.051 -2.165 -1.531 1.00 . A A . 14 SER HA 1 1 8 3774 1 1 8 SER HB2 H -14.991 -1.760 -1.112 1.00 . A A . 14 SER HB2 1 1 8 3775 1 1 8 SER HB3 H -14.308 -1.534 -2.722 1.00 . A A . 14 SER HB3 1 1 8 3776 1 1 8 SER HG H -15.084 -3.732 -2.052 1.00 . A A . 14 SER HG 1 1 8 3777 1 1 8 SER N N -12.891 -1.731 0.303 1.00 . A A . 14 SER N 1 1 8 3778 1 1 8 SER O O -11.725 0.194 -2.337 1.00 . A A . 14 SER O 1 1 8 3779 1 1 8 SER OG O -14.179 -3.424 -1.965 1.00 . A A . 14 SER OG 1 1 8 3780 1 1 9 ASP C C -11.785 2.707 -0.801 1.00 . A A . 15 ASP C 1 1 8 3781 1 1 9 ASP CA C -13.190 2.232 -1.159 1.00 . A A . 15 ASP CA 1 1 8 3782 1 1 9 ASP CB C -14.227 3.033 -0.369 1.00 . A A . 15 ASP CB 1 1 8 3783 1 1 9 ASP CG C -14.320 2.593 1.079 1.00 . A A . 15 ASP CG 1 1 8 3784 1 1 9 ASP H H -14.016 0.508 -0.249 1.00 . A A . 15 ASP H 1 1 8 3785 1 1 9 ASP HA H -13.352 2.393 -2.214 1.00 . A A . 15 ASP HA 1 1 8 3786 1 1 9 ASP HB2 H -13.958 4.078 -0.391 1.00 . A A . 15 ASP HB2 1 1 8 3787 1 1 9 ASP HB3 H -15.196 2.905 -0.828 1.00 . A A . 15 ASP HB3 1 1 8 3788 1 1 9 ASP N N -13.342 0.806 -0.896 1.00 . A A . 15 ASP N 1 1 8 3789 1 1 9 ASP O O -11.112 3.349 -1.608 1.00 . A A . 15 ASP O 1 1 8 3790 1 1 9 ASP OD1 O -13.508 3.072 1.898 1.00 . A A . 15 ASP OD1 1 1 8 3791 1 1 9 ASP OD2 O -15.205 1.770 1.394 1.00 . A A . 15 ASP OD2 1 1 8 3792 1 1 10 VAL C C -8.925 2.021 0.147 1.00 . A A . 16 VAL C 1 1 8 3793 1 1 10 VAL CA C -10.026 2.787 0.879 1.00 . A A . 16 VAL CA 1 1 8 3794 1 1 10 VAL CB C -9.875 2.564 2.397 1.00 . A A . 16 VAL CB 1 1 8 3795 1 1 10 VAL CG1 C -10.035 1.092 2.743 1.00 . A A . 16 VAL CG1 1 1 8 3796 1 1 10 VAL CG2 C -8.534 3.093 2.885 1.00 . A A . 16 VAL CG2 1 1 8 3797 1 1 10 VAL H H -11.933 1.878 1.012 1.00 . A A . 16 VAL H 1 1 8 3798 1 1 10 VAL HA H -9.907 3.842 0.680 1.00 . A A . 16 VAL HA 1 1 8 3799 1 1 10 VAL HB H -10.658 3.114 2.899 1.00 . A A . 16 VAL HB 1 1 8 3800 1 1 10 VAL HG11 H -10.798 0.655 2.115 1.00 . A A . 16 VAL HG11 1 1 8 3801 1 1 10 VAL HG12 H -9.098 0.580 2.579 1.00 . A A . 16 VAL HG12 1 1 8 3802 1 1 10 VAL HG13 H -10.322 0.994 3.779 1.00 . A A . 16 VAL HG13 1 1 8 3803 1 1 10 VAL HG21 H -8.223 3.917 2.259 1.00 . A A . 16 VAL HG21 1 1 8 3804 1 1 10 VAL HG22 H -8.631 3.433 3.906 1.00 . A A . 16 VAL HG22 1 1 8 3805 1 1 10 VAL HG23 H -7.797 2.306 2.836 1.00 . A A . 16 VAL HG23 1 1 8 3806 1 1 10 VAL N N -11.350 2.390 0.414 1.00 . A A . 16 VAL N 1 1 8 3807 1 1 10 VAL O O -7.773 2.450 0.123 1.00 . A A . 16 VAL O 1 1 8 3808 1 1 11 SER C C -8.087 0.613 -2.584 1.00 . A A . 17 SER C 1 1 8 3809 1 1 11 SER CA C -8.320 0.069 -1.175 1.00 . A A . 17 SER CA 1 1 8 3810 1 1 11 SER CB C -8.807 -1.379 -1.252 1.00 . A A . 17 SER CB 1 1 8 3811 1 1 11 SER H H -10.216 0.592 -0.393 1.00 . A A . 17 SER H 1 1 8 3812 1 1 11 SER HA H -7.388 0.096 -0.634 1.00 . A A . 17 SER HA 1 1 8 3813 1 1 11 SER HB2 H -8.868 -1.790 -0.255 1.00 . A A . 17 SER HB2 1 1 8 3814 1 1 11 SER HB3 H -9.783 -1.405 -1.712 1.00 . A A . 17 SER HB3 1 1 8 3815 1 1 11 SER HG H -7.904 -1.857 -2.924 1.00 . A A . 17 SER HG 1 1 8 3816 1 1 11 SER N N -9.284 0.887 -0.446 1.00 . A A . 17 SER N 1 1 8 3817 1 1 11 SER O O -7.082 0.297 -3.221 1.00 . A A . 17 SER O 1 1 8 3818 1 1 11 SER OG O -7.920 -2.176 -2.018 1.00 . A A . 17 SER OG 1 1 8 3819 1 1 12 SER C C -7.637 2.798 -4.585 1.00 . A A . 18 SER C 1 1 8 3820 1 1 12 SER CA C -8.926 1.999 -4.404 1.00 . A A . 18 SER CA 1 1 8 3821 1 1 12 SER CB C -10.134 2.896 -4.679 1.00 . A A . 18 SER CB 1 1 8 3822 1 1 12 SER H H -9.806 1.630 -2.516 1.00 . A A . 18 SER H 1 1 8 3823 1 1 12 SER HA H -8.931 1.185 -5.113 1.00 . A A . 18 SER HA 1 1 8 3824 1 1 12 SER HB2 H -10.453 3.360 -3.758 1.00 . A A . 18 SER HB2 1 1 8 3825 1 1 12 SER HB3 H -9.857 3.661 -5.390 1.00 . A A . 18 SER HB3 1 1 8 3826 1 1 12 SER HG H -11.803 2.735 -5.693 1.00 . A A . 18 SER HG 1 1 8 3827 1 1 12 SER N N -9.024 1.422 -3.067 1.00 . A A . 18 SER N 1 1 8 3828 1 1 12 SER O O -6.975 2.691 -5.618 1.00 . A A . 18 SER O 1 1 8 3829 1 1 12 SER OG O -11.215 2.149 -5.210 1.00 . A A . 18 SER OG 1 1 8 3830 1 1 13 TYR C C -4.829 3.571 -3.807 1.00 . A A . 19 TYR C 1 1 8 3831 1 1 13 TYR CA C -6.085 4.432 -3.670 1.00 . A A . 19 TYR CA 1 1 8 3832 1 1 13 TYR CB C -5.985 5.369 -2.453 1.00 . A A . 19 TYR CB 1 1 8 3833 1 1 13 TYR CD1 C -3.856 4.660 -1.281 1.00 . A A . 19 TYR CD1 1 1 8 3834 1 1 13 TYR CD2 C -5.920 4.414 -0.115 1.00 . A A . 19 TYR CD2 1 1 8 3835 1 1 13 TYR CE1 C -3.175 4.151 -0.192 1.00 . A A . 19 TYR CE1 1 1 8 3836 1 1 13 TYR CE2 C -5.246 3.903 0.978 1.00 . A A . 19 TYR CE2 1 1 8 3837 1 1 13 TYR CG C -5.239 4.800 -1.262 1.00 . A A . 19 TYR CG 1 1 8 3838 1 1 13 TYR CZ C -3.874 3.773 0.934 1.00 . A A . 19 TYR CZ 1 1 8 3839 1 1 13 TYR H H -7.858 3.667 -2.794 1.00 . A A . 19 TYR H 1 1 8 3840 1 1 13 TYR HA H -6.173 5.038 -4.559 1.00 . A A . 19 TYR HA 1 1 8 3841 1 1 13 TYR HB2 H -5.477 6.273 -2.751 1.00 . A A . 19 TYR HB2 1 1 8 3842 1 1 13 TYR HB3 H -6.984 5.621 -2.127 1.00 . A A . 19 TYR HB3 1 1 8 3843 1 1 13 TYR HD1 H -3.311 4.956 -2.165 1.00 . A A . 19 TYR HD1 1 1 8 3844 1 1 13 TYR HD2 H -6.995 4.516 -0.083 1.00 . A A . 19 TYR HD2 1 1 8 3845 1 1 13 TYR HE1 H -2.100 4.050 -0.227 1.00 . A A . 19 TYR HE1 1 1 8 3846 1 1 13 TYR HE2 H -5.794 3.607 1.861 1.00 . A A . 19 TYR HE2 1 1 8 3847 1 1 13 TYR HH H -2.379 3.750 2.144 1.00 . A A . 19 TYR HH 1 1 8 3848 1 1 13 TYR N N -7.289 3.610 -3.590 1.00 . A A . 19 TYR N 1 1 8 3849 1 1 13 TYR O O -3.944 3.877 -4.605 1.00 . A A . 19 TYR O 1 1 8 3850 1 1 13 TYR OH O -3.199 3.265 2.021 1.00 . A A . 19 TYR OH 1 1 8 3851 1 1 14 LEU C C -3.801 0.512 -4.123 1.00 . A A . 20 LEU C 1 1 8 3852 1 1 14 LEU CA C -3.603 1.603 -3.076 1.00 . A A . 20 LEU CA 1 1 8 3853 1 1 14 LEU CB C -3.355 0.971 -1.704 1.00 . A A . 20 LEU CB 1 1 8 3854 1 1 14 LEU CD1 C -4.130 -1.158 -0.623 1.00 . A A . 20 LEU CD1 1 1 8 3855 1 1 14 LEU CD2 C -5.171 1.022 0.024 1.00 . A A . 20 LEU CD2 1 1 8 3856 1 1 14 LEU CG C -4.550 0.221 -1.111 1.00 . A A . 20 LEU CG 1 1 8 3857 1 1 14 LEU H H -5.490 2.300 -2.410 1.00 . A A . 20 LEU H 1 1 8 3858 1 1 14 LEU HA H -2.740 2.193 -3.349 1.00 . A A . 20 LEU HA 1 1 8 3859 1 1 14 LEU HB2 H -2.530 0.280 -1.796 1.00 . A A . 20 LEU HB2 1 1 8 3860 1 1 14 LEU HB3 H -3.072 1.754 -1.017 1.00 . A A . 20 LEU HB3 1 1 8 3861 1 1 14 LEU HD11 H -3.322 -1.526 -1.238 1.00 . A A . 20 LEU HD11 1 1 8 3862 1 1 14 LEU HD12 H -3.801 -1.092 0.403 1.00 . A A . 20 LEU HD12 1 1 8 3863 1 1 14 LEU HD13 H -4.970 -1.834 -0.689 1.00 . A A . 20 LEU HD13 1 1 8 3864 1 1 14 LEU HD21 H -4.393 1.360 0.692 1.00 . A A . 20 LEU HD21 1 1 8 3865 1 1 14 LEU HD22 H -5.692 1.876 -0.383 1.00 . A A . 20 LEU HD22 1 1 8 3866 1 1 14 LEU HD23 H -5.866 0.400 0.567 1.00 . A A . 20 LEU HD23 1 1 8 3867 1 1 14 LEU HG H -5.301 0.089 -1.877 1.00 . A A . 20 LEU HG 1 1 8 3868 1 1 14 LEU N N -4.756 2.497 -3.028 1.00 . A A . 20 LEU N 1 1 8 3869 1 1 14 LEU O O -4.929 0.133 -4.434 1.00 . A A . 20 LEU O 1 1 8 3870 1 1 15 GLU C C -1.707 -2.116 -5.396 1.00 . A A . 21 GLU C 1 1 8 3871 1 1 15 GLU CA C -2.746 -1.035 -5.678 1.00 . A A . 21 GLU CA 1 1 8 3872 1 1 15 GLU CB C -2.514 -0.440 -7.068 1.00 . A A . 21 GLU CB 1 1 8 3873 1 1 15 GLU CD C -1.251 1.300 -8.395 1.00 . A A . 21 GLU CD 1 1 8 3874 1 1 15 GLU CG C -1.262 0.417 -7.162 1.00 . A A . 21 GLU CG 1 1 8 3875 1 1 15 GLU H H -1.824 0.356 -4.377 1.00 . A A . 21 GLU H 1 1 8 3876 1 1 15 GLU HA H -3.729 -1.480 -5.646 1.00 . A A . 21 GLU HA 1 1 8 3877 1 1 15 GLU HB2 H -2.428 -1.245 -7.783 1.00 . A A . 21 GLU HB2 1 1 8 3878 1 1 15 GLU HB3 H -3.364 0.173 -7.331 1.00 . A A . 21 GLU HB3 1 1 8 3879 1 1 15 GLU HG2 H -1.206 1.047 -6.287 1.00 . A A . 21 GLU HG2 1 1 8 3880 1 1 15 GLU HG3 H -0.399 -0.232 -7.194 1.00 . A A . 21 GLU HG3 1 1 8 3881 1 1 15 GLU N N -2.695 0.012 -4.665 1.00 . A A . 21 GLU N 1 1 8 3882 1 1 15 GLU O O -1.179 -2.739 -6.317 1.00 . A A . 21 GLU O 1 1 8 3883 1 1 15 GLU OE1 O -2.337 1.540 -8.963 1.00 . A A . 21 GLU OE1 1 1 8 3884 1 1 15 GLU OE2 O -0.157 1.753 -8.791 1.00 . A A . 21 GLU OE2 1 1 8 3885 1 1 16 GLY C C 0.268 -2.995 -2.443 1.00 . A A . 22 GLY C 1 1 8 3886 1 1 16 GLY CA C -0.445 -3.338 -3.737 1.00 . A A . 22 GLY CA 1 1 8 3887 1 1 16 GLY H H -1.871 -1.805 -3.426 1.00 . A A . 22 GLY H 1 1 8 3888 1 1 16 GLY HA2 H -0.949 -4.285 -3.617 1.00 . A A . 22 GLY HA2 1 1 8 3889 1 1 16 GLY HA3 H 0.288 -3.430 -4.525 1.00 . A A . 22 GLY HA3 1 1 8 3890 1 1 16 GLY N N -1.419 -2.332 -4.117 1.00 . A A . 22 GLY N 1 1 8 3891 1 1 16 GLY O O 1.365 -2.437 -2.460 1.00 . A A . 22 GLY O 1 1 8 3892 1 1 17 GLN C C 1.513 -3.844 0.190 1.00 . A A . 23 GLN C 1 1 8 3893 1 1 17 GLN CA C 0.224 -3.053 -0.011 1.00 . A A . 23 GLN CA 1 1 8 3894 1 1 17 GLN CB C -0.775 -3.394 1.097 1.00 . A A . 23 GLN CB 1 1 8 3895 1 1 17 GLN CD C -1.136 -3.118 3.582 1.00 . A A . 23 GLN CD 1 1 8 3896 1 1 17 GLN CG C -0.707 -2.453 2.288 1.00 . A A . 23 GLN CG 1 1 8 3897 1 1 17 GLN H H -1.230 -3.773 -1.371 1.00 . A A . 23 GLN H 1 1 8 3898 1 1 17 GLN HA H 0.452 -1.999 0.035 1.00 . A A . 23 GLN HA 1 1 8 3899 1 1 17 GLN HB2 H -1.774 -3.353 0.690 1.00 . A A . 23 GLN HB2 1 1 8 3900 1 1 17 GLN HB3 H -0.579 -4.397 1.446 1.00 . A A . 23 GLN HB3 1 1 8 3901 1 1 17 GLN HE21 H 0.760 -3.274 4.160 1.00 . A A . 23 GLN HE21 1 1 8 3902 1 1 17 GLN HE22 H -0.415 -3.896 5.263 1.00 . A A . 23 GLN HE22 1 1 8 3903 1 1 17 GLN HG2 H 0.310 -2.107 2.400 1.00 . A A . 23 GLN HG2 1 1 8 3904 1 1 17 GLN HG3 H -1.355 -1.609 2.102 1.00 . A A . 23 GLN HG3 1 1 8 3905 1 1 17 GLN N N -0.357 -3.330 -1.319 1.00 . A A . 23 GLN N 1 1 8 3906 1 1 17 GLN NE2 N -0.166 -3.465 4.419 1.00 . A A . 23 GLN NE2 1 1 8 3907 1 1 17 GLN O O 2.440 -3.379 0.853 1.00 . A A . 23 GLN O 1 1 8 3908 1 1 17 GLN OE1 O -2.326 -3.318 3.825 1.00 . A A . 23 GLN OE1 1 1 8 3909 1 1 18 ALA C C 3.980 -5.195 -0.817 1.00 . A A . 24 ALA C 1 1 8 3910 1 1 18 ALA CA C 2.740 -5.894 -0.272 1.00 . A A . 24 ALA CA 1 1 8 3911 1 1 18 ALA CB C 2.510 -7.209 -1.001 1.00 . A A . 24 ALA CB 1 1 8 3912 1 1 18 ALA H H 0.793 -5.355 -0.903 1.00 . A A . 24 ALA H 1 1 8 3913 1 1 18 ALA HA H 2.893 -6.112 0.775 1.00 . A A . 24 ALA HA 1 1 8 3914 1 1 18 ALA HB1 H 1.821 -7.053 -1.818 1.00 . A A . 24 ALA HB1 1 1 8 3915 1 1 18 ALA HB2 H 3.449 -7.576 -1.388 1.00 . A A . 24 ALA HB2 1 1 8 3916 1 1 18 ALA HB3 H 2.096 -7.934 -0.315 1.00 . A A . 24 ALA HB3 1 1 8 3917 1 1 18 ALA N N 1.564 -5.040 -0.387 1.00 . A A . 24 ALA N 1 1 8 3918 1 1 18 ALA O O 5.093 -5.420 -0.340 1.00 . A A . 24 ALA O 1 1 8 3919 1 1 19 ALA C C 5.197 -2.343 -1.642 1.00 . A A . 25 ALA C 1 1 8 3920 1 1 19 ALA CA C 4.881 -3.610 -2.429 1.00 . A A . 25 ALA CA 1 1 8 3921 1 1 19 ALA CB C 4.551 -3.269 -3.874 1.00 . A A . 25 ALA CB 1 1 8 3922 1 1 19 ALA H H 2.870 -4.207 -2.155 1.00 . A A . 25 ALA H 1 1 8 3923 1 1 19 ALA HA H 5.752 -4.249 -2.425 1.00 . A A . 25 ALA HA 1 1 8 3924 1 1 19 ALA HB1 H 3.977 -4.072 -4.311 1.00 . A A . 25 ALA HB1 1 1 8 3925 1 1 19 ALA HB2 H 3.975 -2.356 -3.906 1.00 . A A . 25 ALA HB2 1 1 8 3926 1 1 19 ALA HB3 H 5.467 -3.136 -4.431 1.00 . A A . 25 ALA HB3 1 1 8 3927 1 1 19 ALA N N 3.780 -4.345 -1.819 1.00 . A A . 25 ALA N 1 1 8 3928 1 1 19 ALA O O 6.352 -2.078 -1.314 1.00 . A A . 25 ALA O 1 1 8 3929 1 1 20 LYS C C 5.284 -0.477 0.584 1.00 . A A . 26 LYS C 1 1 8 3930 1 1 20 LYS CA C 4.309 -0.320 -0.583 1.00 . A A . 26 LYS CA 1 1 8 3931 1 1 20 LYS CB C 2.948 0.154 -0.069 1.00 . A A . 26 LYS CB 1 1 8 3932 1 1 20 LYS CD C 2.133 0.748 -2.376 1.00 . A A . 26 LYS CD 1 1 8 3933 1 1 20 LYS CE C 3.076 1.471 -3.326 1.00 . A A . 26 LYS CE 1 1 8 3934 1 1 20 LYS CG C 2.309 1.224 -0.940 1.00 . A A . 26 LYS CG 1 1 8 3935 1 1 20 LYS HA H 4.703 0.426 -1.258 1.00 . A A . 26 LYS HA 1 1 8 3936 1 1 20 LYS HB2 H 2.279 -0.692 -0.025 1.00 . A A . 26 LYS HB2 1 1 8 3937 1 1 20 LYS HD2 H 2.335 -0.311 -2.422 1.00 . A A . 26 LYS HD2 1 1 8 3938 1 1 20 LYS HE2 H 2.514 2.212 -3.875 1.00 . A A . 26 LYS HE2 1 1 8 3939 1 1 20 LYS HG2 H 1.340 1.472 -0.534 1.00 . A A . 26 LYS HG2 1 1 8 3940 1 1 20 LYS HZ1 H 3.789 -0.384 -4.011 1.00 . A A . 26 LYS HZ1 1 1 8 3941 1 1 20 LYS N N 4.158 -1.567 -1.336 1.00 . A A . 26 LYS N 1 1 8 3942 1 1 20 LYS NZ N 3.707 0.556 -4.274 1.00 . A A . 26 LYS NZ 1 1 8 3943 1 1 20 LYS O O 5.916 0.491 1.005 1.00 . A A . 26 LYS O 1 1 8 3944 1 1 21 GLU C C 7.670 -1.314 1.994 1.00 . A A . 27 GLU C 1 1 8 3945 1 1 21 GLU CA C 6.310 -1.975 2.215 1.00 . A A . 27 GLU CA 1 1 8 3946 1 1 21 GLU CB C 6.486 -3.485 2.394 1.00 . A A . 27 GLU CB 1 1 8 3947 1 1 21 GLU CD C 5.762 -3.500 4.813 1.00 . A A . 27 GLU CD 1 1 8 3948 1 1 21 GLU CG C 5.552 -4.086 3.431 1.00 . A A . 27 GLU CG 1 1 8 3949 1 1 21 GLU H H 4.877 -2.433 0.724 1.00 . A A . 27 GLU H 1 1 8 3950 1 1 21 GLU HA H 5.866 -1.566 3.110 1.00 . A A . 27 GLU HA 1 1 8 3951 1 1 21 GLU HB2 H 6.300 -3.972 1.448 1.00 . A A . 27 GLU HB2 1 1 8 3952 1 1 21 GLU HB3 H 7.503 -3.685 2.697 1.00 . A A . 27 GLU HB3 1 1 8 3953 1 1 21 GLU HG2 H 4.532 -3.901 3.130 1.00 . A A . 27 GLU HG2 1 1 8 3954 1 1 21 GLU HG3 H 5.725 -5.152 3.477 1.00 . A A . 27 GLU HG3 1 1 8 3955 1 1 21 GLU N N 5.405 -1.699 1.101 1.00 . A A . 27 GLU N 1 1 8 3956 1 1 21 GLU O O 8.350 -0.938 2.949 1.00 . A A . 27 GLU O 1 1 8 3957 1 1 21 GLU OE1 O 6.689 -3.955 5.517 1.00 . A A . 27 GLU OE1 1 1 8 3958 1 1 21 GLU OE2 O 5.000 -2.586 5.193 1.00 . A A . 27 GLU OE2 1 1 8 3959 1 1 22 PHE C C 9.404 0.869 0.962 1.00 . A A . 28 PHE C 1 1 8 3960 1 1 22 PHE CA C 9.328 -0.541 0.383 1.00 . A A . 28 PHE CA 1 1 8 3961 1 1 22 PHE CB C 9.506 -0.501 -1.143 1.00 . A A . 28 PHE CB 1 1 8 3962 1 1 22 PHE CD1 C 9.110 1.907 -1.752 1.00 . A A . 28 PHE CD1 1 1 8 3963 1 1 22 PHE CD2 C 7.563 0.272 -2.537 1.00 . A A . 28 PHE CD2 1 1 8 3964 1 1 22 PHE CE1 C 8.379 2.901 -2.372 1.00 . A A . 28 PHE CE1 1 1 8 3965 1 1 22 PHE CE2 C 6.829 1.262 -3.160 1.00 . A A . 28 PHE CE2 1 1 8 3966 1 1 22 PHE CG C 8.711 0.581 -1.826 1.00 . A A . 28 PHE CG 1 1 8 3967 1 1 22 PHE CZ C 7.236 2.578 -3.076 1.00 . A A . 28 PHE CZ 1 1 8 3968 1 1 22 PHE H H 7.468 -1.481 0.010 1.00 . A A . 28 PHE H 1 1 8 3969 1 1 22 PHE HA H 10.118 -1.138 0.814 1.00 . A A . 28 PHE HA 1 1 8 3970 1 1 22 PHE HB2 H 10.548 -0.338 -1.373 1.00 . A A . 28 PHE HB2 1 1 8 3971 1 1 22 PHE HB3 H 9.198 -1.450 -1.557 1.00 . A A . 28 PHE HB3 1 1 8 3972 1 1 22 PHE HD1 H 10.004 2.160 -1.201 1.00 . A A . 28 PHE HD1 1 1 8 3973 1 1 22 PHE HD2 H 7.245 -0.755 -2.607 1.00 . A A . 28 PHE HD2 1 1 8 3974 1 1 22 PHE HE1 H 8.700 3.930 -2.307 1.00 . A A . 28 PHE HE1 1 1 8 3975 1 1 22 PHE HE2 H 5.935 1.007 -3.708 1.00 . A A . 28 PHE HE2 1 1 8 3976 1 1 22 PHE HZ H 6.663 3.354 -3.562 1.00 . A A . 28 PHE HZ 1 1 8 3977 1 1 22 PHE N N 8.055 -1.167 0.728 1.00 . A A . 28 PHE N 1 1 8 3978 1 1 22 PHE O O 10.461 1.318 1.406 1.00 . A A . 28 PHE O 1 1 8 3979 1 1 23 ILE C C 8.709 3.013 2.896 1.00 . A A . 29 ILE C 1 1 8 3980 1 1 23 ILE CA C 8.184 2.922 1.463 1.00 . A A . 29 ILE CA 1 1 8 3981 1 1 23 ILE CB C 6.732 3.446 1.412 1.00 . A A . 29 ILE CB 1 1 8 3982 1 1 23 ILE CD1 C 5.611 5.641 0.777 1.00 . A A . 29 ILE CD1 1 1 8 3983 1 1 23 ILE CG1 C 6.710 4.967 1.569 1.00 . A A . 29 ILE CG1 1 1 8 3984 1 1 23 ILE CG2 C 5.878 2.783 2.485 1.00 . A A . 29 ILE CG2 1 1 8 3985 1 1 23 ILE H H 7.462 1.143 0.578 1.00 . A A . 29 ILE H 1 1 8 3986 1 1 23 ILE HA H 8.793 3.554 0.830 1.00 . A A . 29 ILE HA 1 1 8 3987 1 1 23 ILE HB H 6.315 3.186 0.449 1.00 . A A . 29 ILE HB 1 1 8 3988 1 1 23 ILE HD11 H 5.515 5.162 -0.186 1.00 . A A . 29 ILE HD11 1 1 8 3989 1 1 23 ILE HD12 H 4.678 5.559 1.315 1.00 . A A . 29 ILE HD12 1 1 8 3990 1 1 23 ILE HD13 H 5.855 6.684 0.638 1.00 . A A . 29 ILE HD13 1 1 8 3991 1 1 23 ILE HG12 H 6.566 5.213 2.611 1.00 . A A . 29 ILE HG12 1 1 8 3992 1 1 23 ILE HG13 H 7.655 5.371 1.236 1.00 . A A . 29 ILE HG13 1 1 8 3993 1 1 23 ILE HG21 H 6.334 1.852 2.785 1.00 . A A . 29 ILE HG21 1 1 8 3994 1 1 23 ILE HG22 H 5.802 3.439 3.340 1.00 . A A . 29 ILE HG22 1 1 8 3995 1 1 23 ILE HG23 H 4.891 2.590 2.091 1.00 . A A . 29 ILE HG23 1 1 8 3996 1 1 23 ILE N N 8.268 1.561 0.948 1.00 . A A . 29 ILE N 1 1 8 3997 1 1 23 ILE O O 9.130 4.079 3.344 1.00 . A A . 29 ILE O 1 1 8 3998 1 1 24 ALA C C 10.676 1.715 5.041 1.00 . A A . 30 ALA C 1 1 8 3999 1 1 24 ALA CA C 9.156 1.849 4.986 1.00 . A A . 30 ALA CA 1 1 8 4000 1 1 24 ALA CB C 8.496 0.703 5.737 1.00 . A A . 30 ALA CB 1 1 8 4001 1 1 24 ALA H H 8.334 1.071 3.198 1.00 . A A . 30 ALA H 1 1 8 4002 1 1 24 ALA HA H 8.870 2.774 5.465 1.00 . A A . 30 ALA HA 1 1 8 4003 1 1 24 ALA HB1 H 8.237 -0.081 5.041 1.00 . A A . 30 ALA HB1 1 1 8 4004 1 1 24 ALA HB2 H 9.181 0.316 6.477 1.00 . A A . 30 ALA HB2 1 1 8 4005 1 1 24 ALA HB3 H 7.602 1.060 6.226 1.00 . A A . 30 ALA HB3 1 1 8 4006 1 1 24 ALA N N 8.682 1.891 3.608 1.00 . A A . 30 ALA N 1 1 8 4007 1 1 24 ALA O O 11.305 2.090 6.029 1.00 . A A . 30 ALA O 1 1 8 4008 1 1 25 TRP C C 13.405 2.307 3.555 1.00 . A A . 31 TRP C 1 1 8 4009 1 1 25 TRP CA C 12.703 0.992 3.900 1.00 . A A . 31 TRP CA 1 1 8 4010 1 1 25 TRP CB C 13.034 -0.097 2.865 1.00 . A A . 31 TRP CB 1 1 8 4011 1 1 25 TRP CD1 C 15.402 0.515 2.090 1.00 . A A . 31 TRP CD1 1 1 8 4012 1 1 25 TRP CD2 C 13.869 0.531 0.459 1.00 . A A . 31 TRP CD2 1 1 8 4013 1 1 25 TRP CE2 C 15.114 0.883 -0.094 1.00 . A A . 31 TRP CE2 1 1 8 4014 1 1 25 TRP CE3 C 12.753 0.473 -0.381 1.00 . A A . 31 TRP CE3 1 1 8 4015 1 1 25 TRP CG C 14.075 0.299 1.857 1.00 . A A . 31 TRP CG 1 1 8 4016 1 1 25 TRP CH2 C 14.164 1.110 -2.243 1.00 . A A . 31 TRP CH2 1 1 8 4017 1 1 25 TRP CZ2 C 15.272 1.176 -1.446 1.00 . A A . 31 TRP CZ2 1 1 8 4018 1 1 25 TRP CZ3 C 12.912 0.763 -1.722 1.00 . A A . 31 TRP CZ3 1 1 8 4019 1 1 25 TRP H H 10.703 0.897 3.217 1.00 . A A . 31 TRP H 1 1 8 4020 1 1 25 TRP HA H 13.041 0.664 4.871 1.00 . A A . 31 TRP HA 1 1 8 4021 1 1 25 TRP HB2 H 13.395 -0.973 3.382 1.00 . A A . 31 TRP HB2 1 1 8 4022 1 1 25 TRP HB3 H 12.132 -0.353 2.327 1.00 . A A . 31 TRP HB3 1 1 8 4023 1 1 25 TRP HD1 H 15.873 0.421 3.057 1.00 . A A . 31 TRP HD1 1 1 8 4024 1 1 25 TRP HE1 H 16.989 1.072 0.831 1.00 . A A . 31 TRP HE1 1 1 8 4025 1 1 25 TRP HE3 H 11.779 0.209 0.001 1.00 . A A . 31 TRP HE3 1 1 8 4026 1 1 25 TRP HH2 H 14.242 1.329 -3.297 1.00 . A A . 31 TRP HH2 1 1 8 4027 1 1 25 TRP HZ2 H 16.229 1.447 -1.864 1.00 . A A . 31 TRP HZ2 1 1 8 4028 1 1 25 TRP HZ3 H 12.061 0.723 -2.385 1.00 . A A . 31 TRP HZ3 1 1 8 4029 1 1 25 TRP N N 11.258 1.177 3.974 1.00 . A A . 31 TRP N 1 1 8 4030 1 1 25 TRP NE1 N 16.035 0.867 0.922 1.00 . A A . 31 TRP NE1 1 1 8 4031 1 1 25 TRP O O 14.236 2.799 4.318 1.00 . A A . 31 TRP O 1 1 8 4032 1 1 26 LEU C C 13.548 5.222 2.967 1.00 . A A . 32 LEU C 1 1 8 4033 1 1 26 LEU CA C 13.672 4.107 1.929 1.00 . A A . 32 LEU CA 1 1 8 4034 1 1 26 LEU CB C 13.030 4.550 0.610 1.00 . A A . 32 LEU CB 1 1 8 4035 1 1 26 LEU CD1 C 10.789 5.404 1.342 1.00 . A A . 32 LEU CD1 1 1 8 4036 1 1 26 LEU CD2 C 11.064 4.402 -0.929 1.00 . A A . 32 LEU CD2 1 1 8 4037 1 1 26 LEU CG C 11.517 4.353 0.520 1.00 . A A . 32 LEU CG 1 1 8 4038 1 1 26 LEU H H 12.411 2.409 1.828 1.00 . A A . 32 LEU H 1 1 8 4039 1 1 26 LEU HA H 14.720 3.917 1.755 1.00 . A A . 32 LEU HA 1 1 8 4040 1 1 26 LEU HB2 H 13.244 5.599 0.466 1.00 . A A . 32 LEU HB2 1 1 8 4041 1 1 26 LEU HB3 H 13.489 3.994 -0.193 1.00 . A A . 32 LEU HB3 1 1 8 4042 1 1 26 LEU HD11 H 11.268 6.362 1.207 1.00 . A A . 32 LEU HD11 1 1 8 4043 1 1 26 LEU HD12 H 9.761 5.466 1.017 1.00 . A A . 32 LEU HD12 1 1 8 4044 1 1 26 LEU HD13 H 10.821 5.130 2.385 1.00 . A A . 32 LEU HD13 1 1 8 4045 1 1 26 LEU HD21 H 11.570 3.631 -1.491 1.00 . A A . 32 LEU HD21 1 1 8 4046 1 1 26 LEU HD22 H 9.998 4.241 -0.976 1.00 . A A . 32 LEU HD22 1 1 8 4047 1 1 26 LEU HD23 H 11.301 5.369 -1.349 1.00 . A A . 32 LEU HD23 1 1 8 4048 1 1 26 LEU HG H 11.260 3.383 0.916 1.00 . A A . 32 LEU HG 1 1 8 4049 1 1 26 LEU N N 13.071 2.859 2.393 1.00 . A A . 32 LEU N 1 1 8 4050 1 1 26 LEU O O 14.316 6.183 2.946 1.00 . A A . 32 LEU O 1 1 8 4051 1 1 27 VAL C C 13.181 5.804 6.158 1.00 . A A . 33 VAL C 1 1 8 4052 1 1 27 VAL CA C 12.370 6.109 4.901 1.00 . A A . 33 VAL CA 1 1 8 4053 1 1 27 VAL CB C 10.879 6.236 5.274 1.00 . A A . 33 VAL CB 1 1 8 4054 1 1 27 VAL CG1 C 10.359 4.937 5.870 1.00 . A A . 33 VAL CG1 1 1 8 4055 1 1 27 VAL CG2 C 10.663 7.396 6.235 1.00 . A A . 33 VAL CG2 1 1 8 4056 1 1 27 VAL H H 11.990 4.315 3.840 1.00 . A A . 33 VAL H 1 1 8 4057 1 1 27 VAL HA H 12.697 7.058 4.501 1.00 . A A . 33 VAL HA 1 1 8 4058 1 1 27 VAL HB H 10.320 6.438 4.372 1.00 . A A . 33 VAL HB 1 1 8 4059 1 1 27 VAL HG11 H 10.937 4.685 6.746 1.00 . A A . 33 VAL HG11 1 1 8 4060 1 1 27 VAL HG12 H 9.321 5.057 6.146 1.00 . A A . 33 VAL HG12 1 1 8 4061 1 1 27 VAL HG13 H 10.448 4.147 5.140 1.00 . A A . 33 VAL HG13 1 1 8 4062 1 1 27 VAL HG21 H 11.596 7.639 6.722 1.00 . A A . 33 VAL HG21 1 1 8 4063 1 1 27 VAL HG22 H 10.310 8.257 5.687 1.00 . A A . 33 VAL HG22 1 1 8 4064 1 1 27 VAL HG23 H 9.931 7.118 6.979 1.00 . A A . 33 VAL HG23 1 1 8 4065 1 1 27 VAL N N 12.579 5.098 3.870 1.00 . A A . 33 VAL N 1 1 8 4066 1 1 27 VAL O O 13.732 6.708 6.785 1.00 . A A . 33 VAL O 1 1 8 4067 1 1 28 ARG C C 15.486 4.015 7.411 1.00 . A A . 34 ARG C 1 1 8 4068 1 1 28 ARG CA C 13.993 4.115 7.710 1.00 . A A . 34 ARG CA 1 1 8 4069 1 1 28 ARG CB C 13.470 2.773 8.228 1.00 . A A . 34 ARG CB 1 1 8 4070 1 1 28 ARG CD C 12.819 0.431 7.589 1.00 . A A . 34 ARG CD 1 1 8 4071 1 1 28 ARG CG C 13.730 1.610 7.285 1.00 . A A . 34 ARG CG 1 1 8 4072 1 1 28 ARG CZ C 12.495 -1.162 9.441 1.00 . A A . 34 ARG CZ 1 1 8 4073 1 1 28 ARG H H 12.788 3.849 5.987 1.00 . A A . 34 ARG H 1 1 8 4074 1 1 28 ARG HA H 13.841 4.866 8.470 1.00 . A A . 34 ARG HA 1 1 8 4075 1 1 28 ARG HB2 H 13.946 2.555 9.172 1.00 . A A . 34 ARG HB2 1 1 8 4076 1 1 28 ARG HB3 H 12.404 2.851 8.383 1.00 . A A . 34 ARG HB3 1 1 8 4077 1 1 28 ARG HD2 H 11.822 0.802 7.777 1.00 . A A . 34 ARG HD2 1 1 8 4078 1 1 28 ARG HD3 H 12.801 -0.225 6.731 1.00 . A A . 34 ARG HD3 1 1 8 4079 1 1 28 ARG HE H 14.199 -0.202 9.042 1.00 . A A . 34 ARG HE 1 1 8 4080 1 1 28 ARG HG2 H 13.554 1.936 6.271 1.00 . A A . 34 ARG HG2 1 1 8 4081 1 1 28 ARG HG3 H 14.758 1.296 7.391 1.00 . A A . 34 ARG HG3 1 1 8 4082 1 1 28 ARG HH11 H 10.857 -0.869 8.292 1.00 . A A . 34 ARG HH11 1 1 8 4083 1 1 28 ARG HH12 H 10.655 -1.985 9.600 1.00 . A A . 34 ARG HH12 1 1 8 4084 1 1 28 ARG HH21 H 13.936 -1.670 10.764 1.00 . A A . 34 ARG HH21 1 1 8 4085 1 1 28 ARG HH22 H 12.403 -2.439 11.004 1.00 . A A . 34 ARG HH22 1 1 8 4086 1 1 28 ARG N N 13.249 4.528 6.524 1.00 . A A . 34 ARG N 1 1 8 4087 1 1 28 ARG NE N 13.270 -0.325 8.755 1.00 . A A . 34 ARG NE 1 1 8 4088 1 1 28 ARG NH1 N 11.232 -1.354 9.081 1.00 . A A . 34 ARG NH1 1 1 8 4089 1 1 28 ARG NH2 N 12.985 -1.810 10.489 1.00 . A A . 34 ARG NH2 1 1 8 4090 1 1 28 ARG O O 16.316 4.490 8.186 1.00 . A A . 34 ARG O 1 1 8 4091 1 1 29 GLY C C 17.394 3.087 4.409 1.00 . A A . 35 GLY C 1 1 8 4092 1 1 29 GLY CA C 17.213 3.245 5.906 1.00 . A A . 35 GLY CA 1 1 8 4093 1 1 29 GLY H H 15.116 3.036 5.706 1.00 . A A . 35 GLY H 1 1 8 4094 1 1 29 GLY HA2 H 17.759 4.118 6.233 1.00 . A A . 35 GLY HA2 1 1 8 4095 1 1 29 GLY HA3 H 17.617 2.374 6.401 1.00 . A A . 35 GLY HA3 1 1 8 4096 1 1 29 GLY N N 15.820 3.395 6.285 1.00 . A A . 35 GLY N 1 1 8 4097 1 1 29 GLY O O 17.261 1.986 3.874 1.00 . A A . 35 GLY O 1 1 8 4098 1 1 30 ARG C C 19.382 4.110 1.942 1.00 . A A . 36 ARG C 1 1 8 4099 1 1 30 ARG CA C 17.897 4.167 2.287 1.00 . A A . 36 ARG CA 1 1 8 4100 1 1 30 ARG CB C 17.261 5.401 1.645 1.00 . A A . 36 ARG CB 1 1 8 4101 1 1 30 ARG CD C 16.365 6.492 -0.436 1.00 . A A . 36 ARG CD 1 1 8 4102 1 1 30 ARG CG C 16.917 5.214 0.176 1.00 . A A . 36 ARG CG 1 1 8 4103 1 1 30 ARG CZ C 17.509 8.414 0.606 1.00 . A A . 36 ARG CZ 1 1 8 4104 1 1 30 ARG H H 17.791 5.037 4.214 1.00 . A A . 36 ARG H 1 1 8 4105 1 1 30 ARG HA H 17.416 3.282 1.899 1.00 . A A . 36 ARG HA 1 1 8 4106 1 1 30 ARG HB2 H 16.352 5.641 2.177 1.00 . A A . 36 ARG HB2 1 1 8 4107 1 1 30 ARG HB3 H 17.947 6.231 1.729 1.00 . A A . 36 ARG HB3 1 1 8 4108 1 1 30 ARG HD2 H 16.085 6.293 -1.460 1.00 . A A . 36 ARG HD2 1 1 8 4109 1 1 30 ARG HD3 H 15.491 6.796 0.121 1.00 . A A . 36 ARG HD3 1 1 8 4110 1 1 30 ARG HE H 17.908 7.690 -1.211 1.00 . A A . 36 ARG HE 1 1 8 4111 1 1 30 ARG HG2 H 17.810 4.928 -0.359 1.00 . A A . 36 ARG HG2 1 1 8 4112 1 1 30 ARG HG3 H 16.176 4.433 0.087 1.00 . A A . 36 ARG HG3 1 1 8 4113 1 1 30 ARG HH11 H 16.076 7.578 1.763 1.00 . A A . 36 ARG HH11 1 1 8 4114 1 1 30 ARG HH12 H 16.899 8.930 2.463 1.00 . A A . 36 ARG HH12 1 1 8 4115 1 1 30 ARG HH21 H 18.987 9.466 -0.286 1.00 . A A . 36 ARG HH21 1 1 8 4116 1 1 30 ARG HH22 H 18.549 10.001 1.302 1.00 . A A . 36 ARG HH22 1 1 8 4117 1 1 30 ARG N N 17.698 4.189 3.731 1.00 . A A . 36 ARG N 1 1 8 4118 1 1 30 ARG NE N 17.344 7.577 -0.417 1.00 . A A . 36 ARG NE 1 1 8 4119 1 1 30 ARG NH1 N 16.766 8.297 1.700 1.00 . A A . 36 ARG NH1 1 1 8 4120 1 1 30 ARG NH2 N 18.423 9.372 0.535 1.00 . A A . 36 ARG NH2 1 1 8 4121 1 1 30 ARG O O 19.820 4.678 0.942 1.00 . A A . 36 ARG O 1 1 8 4122 1 1 31 GLY C C 22.371 4.411 3.205 1.00 . A A . 37 GLY C 1 1 8 4123 1 1 31 GLY CA C 21.579 3.301 2.542 1.00 . A A . 37 GLY CA 1 1 8 4124 1 1 31 GLY H H 19.749 2.987 3.558 1.00 . A A . 37 GLY H 1 1 8 4125 1 1 31 GLY HA2 H 21.919 2.351 2.929 1.00 . A A . 37 GLY HA2 1 1 8 4126 1 1 31 GLY HA3 H 21.762 3.330 1.478 1.00 . A A . 37 GLY HA3 1 1 8 4127 1 1 31 GLY N N 20.152 3.420 2.777 1.00 . A A . 37 GLY N 1 1 8 4128 1 1 31 GLY O O 23.588 4.511 2.941 1.00 . A A . 37 GLY O 1 1 8 4129 1 1 31 GLY OXT O 21.775 5.180 3.988 1.00 . A A . 37 GLY OXT 1 1 8 4130 2 2 1 . C02 C 9.519 1.385 -5.870 1.00 . B A . 1038 D6M C02 1 1 8 4131 2 2 1 . C04 C 7.302 0.610 -6.530 1.00 . B A . 1038 D6M C04 1 1 8 4132 2 2 1 . C05 C 6.254 -0.393 -6.019 1.00 . B A . 1038 D6M C05 1 1 8 4133 2 2 1 . C06 C 4.819 -0.063 -6.409 1.00 . B A . 1038 D6M C06 1 1 8 4134 2 2 1 . C07 C 4.171 0.930 -5.463 1.00 . B A . 1038 D6M C07 1 1 8 4135 2 2 1 . C09 C 6.710 2.016 -6.621 1.00 . B A . 1038 D6M C09 1 1 8 4136 2 2 1 . C12 C 10.713 1.386 -4.933 1.00 . B A . 1038 D6M C12 1 1 8 4137 2 2 1 . C13 C 11.835 2.297 -5.408 1.00 . B A . 1038 D6M C13 1 1 8 4138 2 2 1 . C14 C 12.546 2.967 -4.240 1.00 . B A . 1038 D6M C14 1 1 8 4139 2 2 1 . C15 C 12.266 4.461 -4.197 1.00 . B A . 1038 D6M C15 1 1 8 4140 2 2 1 . C16 C 10.780 4.745 -4.051 1.00 . B A . 1038 D6M C16 1 1 8 4141 2 2 1 . C17 C 10.526 6.185 -3.633 1.00 . B A . 1038 D6M C17 1 1 8 4142 2 2 1 . C18 C 9.206 6.326 -2.891 1.00 . B A . 1038 D6M C18 1 1 8 4143 2 2 1 . C19 C 8.872 7.784 -2.618 1.00 . B A . 1038 D6M C19 1 1 8 4144 2 2 1 . C20 C 9.159 8.162 -1.174 1.00 . B A . 1038 D6M C20 1 1 8 4145 2 2 1 . C21 C 7.886 8.202 -0.344 1.00 . B A . 1038 D6M C21 1 1 8 4146 2 2 1 . C22 C 8.180 8.043 1.139 1.00 . B A . 1038 D6M C22 1 1 8 4147 2 2 1 . C23 C 9.088 9.152 1.649 1.00 . B A . 1038 D6M C23 1 1 8 4148 2 2 1 . C24 C 9.350 9.016 3.140 1.00 . B A . 1038 D6M C24 1 1 8 4149 2 2 1 . C25 C 10.783 9.386 3.492 1.00 . B A . 1038 D6M C25 1 1 8 4150 2 2 1 . C26 C 10.842 10.555 4.452 1.00 . B A . 1038 D6M C26 1 1 8 4151 2 2 1 . H03 H 8.478 -0.007 -4.881 1.00 . B A . 1038 D6M H03 1 1 8 4152 2 2 1 . H04 H 7.626 0.306 -7.514 1.00 . B A . 1038 D6M H04 1 1 8 4153 2 2 1 . HP21 H 11.094 0.377 -4.859 1.00 . B A . 1038 D6M HP21 1 1 8 4154 2 2 1 . HP22 H 10.387 1.718 -3.958 1.00 . B A . 1038 D6M HP22 1 1 8 4155 2 2 1 . HP31 H 11.418 3.060 -6.050 1.00 . B A . 1038 D6M HP31 1 1 8 4156 2 2 1 . HP32 H 12.552 1.710 -5.962 1.00 . B A . 1038 D6M HP32 1 1 8 4157 2 2 1 . HP41 H 13.610 2.813 -4.345 1.00 . B A . 1038 D6M HP41 1 1 8 4158 2 2 1 . HP42 H 12.205 2.521 -3.318 1.00 . B A . 1038 D6M HP42 1 1 8 4159 2 2 1 . HP51 H 12.621 4.910 -5.113 1.00 . B A . 1038 D6M HP51 1 1 8 4160 2 2 1 . HP52 H 12.789 4.891 -3.357 1.00 . B A . 1038 D6M HP52 1 1 8 4161 2 2 1 . HP61 H 10.371 4.084 -3.302 1.00 . B A . 1038 D6M HP61 1 1 8 4162 2 2 1 . HP62 H 10.294 4.565 -4.998 1.00 . B A . 1038 D6M HP62 1 1 8 4163 2 2 1 . HP71 H 10.501 6.806 -4.516 1.00 . B A . 1038 D6M HP71 1 1 8 4164 2 2 1 . HP72 H 11.328 6.508 -2.985 1.00 . B A . 1038 D6M HP72 1 1 8 4165 2 2 1 . HP81 H 9.275 5.800 -1.950 1.00 . B A . 1038 D6M HP81 1 1 8 4166 2 2 1 . HP82 H 8.420 5.893 -3.490 1.00 . B A . 1038 D6M HP82 1 1 8 4167 2 2 1 . HP91 H 7.824 7.947 -2.823 1.00 . B A . 1038 D6M HP91 1 1 8 4168 2 2 1 . HP92 H 9.469 8.408 -3.267 1.00 . B A . 1038 D6M HP92 1 1 8 4169 2 2 1 . HPA1 H 9.623 9.137 -1.152 1.00 . B A . 1038 D6M HPA1 1 1 8 4170 2 2 1 . HPA2 H 9.831 7.432 -0.747 1.00 . B A . 1038 D6M HPA2 1 1 8 4171 2 2 1 . HPB1 H 7.236 7.399 -0.661 1.00 . B A . 1038 D6M HPB1 1 1 8 4172 2 2 1 . HPB2 H 7.394 9.150 -0.503 1.00 . B A . 1038 D6M HPB2 1 1 8 4173 2 2 1 . HPC1 H 8.664 7.091 1.300 1.00 . B A . 1038 D6M HPC1 1 1 8 4174 2 2 1 . HPC2 H 7.250 8.074 1.686 1.00 . B A . 1038 D6M HPC2 1 1 8 4175 2 2 1 . HPD1 H 8.616 10.105 1.460 1.00 . B A . 1038 D6M HPD1 1 1 8 4176 2 2 1 . HPD2 H 10.029 9.104 1.122 1.00 . B A . 1038 D6M HPD2 1 1 8 4177 2 2 1 . HPE1 H 9.169 7.992 3.435 1.00 . B A . 1038 D6M HPE1 1 1 8 4178 2 2 1 . HPE2 H 8.677 9.670 3.675 1.00 . B A . 1038 D6M HPE2 1 1 8 4179 2 2 1 . HPF1 H 11.313 9.655 2.589 1.00 . B A . 1038 D6M HPF1 1 1 8 4180 2 2 1 . HPF2 H 11.264 8.539 3.958 1.00 . B A . 1038 D6M HPF2 1 1 8 4181 2 2 1 . HPG1 H 11.784 11.070 4.335 1.00 . B A . 1038 D6M HPG1 1 1 8 4182 2 2 1 . HPG2 H 10.753 10.193 5.466 1.00 . B A . 1038 D6M HPG2 1 1 8 4183 2 2 1 . HPG3 H 10.030 11.236 4.240 1.00 . B A . 1038 D6M HPG3 1 1 8 4184 2 2 1 . HQ21 H 4.815 0.354 -7.405 1.00 . B A . 1038 D6M HQ21 1 1 8 4185 2 2 1 . HQ22 H 4.239 -0.975 -6.400 1.00 . B A . 1038 D6M HQ22 1 1 8 4186 2 2 1 . HQ31 H 6.492 -1.369 -6.414 1.00 . B A . 1038 D6M HQ31 1 1 8 4187 2 2 1 . HQ32 H 6.309 -0.431 -4.942 1.00 . B A . 1038 D6M HQ32 1 1 8 4188 2 2 1 . N03 N 8.469 0.597 -5.653 1.00 . B A . 1038 D6M N03 1 1 8 4189 2 2 1 . O01 O 9.530 2.155 -6.831 1.00 . B A . 1038 D6M O01 1 1 8 4190 2 2 1 . O08 O 4.083 2.105 -5.823 1.00 . B A . 1038 D6M O08 1 1 8 4191 2 2 1 . O10 O 5.908 2.261 -7.547 1.00 . B A . 1038 D6M O10 1 1 8 4192 2 2 1 . O11 O 7.057 2.860 -5.770 1.00 . B A . 1038 D6M O11 1 1 9 4193 1 1 1 HIS C C -27.058 -3.043 0.502 1.00 . A A . 7 HIS C 1 1 9 4194 1 1 1 HIS CA C -27.796 -3.620 -0.701 1.00 . A A . 7 HIS CA 1 1 9 4195 1 1 1 HIS CB C -27.726 -2.647 -1.880 1.00 . A A . 7 HIS CB 1 1 9 4196 1 1 1 HIS CD2 C -27.154 -3.448 -4.280 1.00 . A A . 7 HIS CD2 1 1 9 4197 1 1 1 HIS CE1 C -29.082 -4.366 -4.779 1.00 . A A . 7 HIS CE1 1 1 9 4198 1 1 1 HIS CG C -27.967 -3.295 -3.208 1.00 . A A . 7 HIS CG 1 1 9 4199 1 1 1 HIS H1 H -29.269 -4.298 0.565 1.00 . A A . 7 HIS H1 1 1 9 4200 1 1 1 HIS H2 H -29.723 -2.962 -0.407 1.00 . A A . 7 HIS H2 1 1 9 4201 1 1 1 HIS H3 H -29.599 -4.526 -1.104 1.00 . A A . 7 HIS H3 1 1 9 4202 1 1 1 HIS HA H -27.335 -4.555 -0.983 1.00 . A A . 7 HIS HA 1 1 9 4203 1 1 1 HIS HB2 H -28.470 -1.876 -1.747 1.00 . A A . 7 HIS HB2 1 1 9 4204 1 1 1 HIS HB3 H -26.745 -2.193 -1.904 1.00 . A A . 7 HIS HB3 1 1 9 4205 1 1 1 HIS HD1 H -29.964 -3.934 -2.984 1.00 . A A . 7 HIS HD1 1 1 9 4206 1 1 1 HIS HD2 H -26.132 -3.108 -4.362 1.00 . A A . 7 HIS HD2 1 1 9 4207 1 1 1 HIS HE1 H -29.868 -4.879 -5.312 1.00 . A A . 7 HIS HE1 1 1 9 4208 1 1 1 HIS HE2 H -27.570 -4.288 -6.159 1.00 . A A . 7 HIS HE2 1 1 9 4209 1 1 1 HIS N N -29.226 -3.874 -0.383 1.00 . A A . 7 HIS N 1 1 9 4210 1 1 1 HIS ND1 N -29.168 -3.881 -3.553 1.00 . A A . 7 HIS ND1 1 1 9 4211 1 1 1 HIS NE2 N -27.871 -4.116 -5.242 1.00 . A A . 7 HIS NE2 1 1 9 4212 1 1 1 HIS O O -27.261 -1.887 0.872 1.00 . A A . 7 HIS O 1 1 9 4213 1 1 2 ALA C C -24.147 -2.722 1.849 1.00 . A A . 8 ALA C 1 1 9 4214 1 1 2 ALA CA C -25.431 -3.427 2.271 1.00 . A A . 8 ALA CA 1 1 9 4215 1 1 2 ALA CB C -25.112 -4.618 3.163 1.00 . A A . 8 ALA CB 1 1 9 4216 1 1 2 ALA H H -26.081 -4.768 0.768 1.00 . A A . 8 ALA H 1 1 9 4217 1 1 2 ALA HA H -26.040 -2.737 2.837 1.00 . A A . 8 ALA HA 1 1 9 4218 1 1 2 ALA HB1 H -24.677 -5.407 2.568 1.00 . A A . 8 ALA HB1 1 1 9 4219 1 1 2 ALA HB2 H -24.413 -4.317 3.929 1.00 . A A . 8 ALA HB2 1 1 9 4220 1 1 2 ALA HB3 H -26.021 -4.975 3.625 1.00 . A A . 8 ALA HB3 1 1 9 4221 1 1 2 ALA N N -26.200 -3.857 1.110 1.00 . A A . 8 ALA N 1 1 9 4222 1 1 2 ALA O O -23.777 -2.736 0.676 1.00 . A A . 8 ALA O 1 1 9 4223 1 1 3 GLU C C -21.261 -1.513 3.711 1.00 . A A . 9 GLU C 1 1 9 4224 1 1 3 GLU CA C -22.230 -1.392 2.539 1.00 . A A . 9 GLU CA 1 1 9 4225 1 1 3 GLU CB C -22.519 0.083 2.244 1.00 . A A . 9 GLU CB 1 1 9 4226 1 1 3 GLU CD C -20.801 1.309 0.852 1.00 . A A . 9 GLU CD 1 1 9 4227 1 1 3 GLU CG C -22.095 0.518 0.850 1.00 . A A . 9 GLU CG 1 1 9 4228 1 1 3 GLU H H -23.819 -2.127 3.730 1.00 . A A . 9 GLU H 1 1 9 4229 1 1 3 GLU HA H -21.779 -1.841 1.667 1.00 . A A . 9 GLU HA 1 1 9 4230 1 1 3 GLU HB2 H -23.581 0.255 2.343 1.00 . A A . 9 GLU HB2 1 1 9 4231 1 1 3 GLU HB3 H -21.995 0.694 2.964 1.00 . A A . 9 GLU HB3 1 1 9 4232 1 1 3 GLU HG2 H -21.960 -0.360 0.238 1.00 . A A . 9 GLU HG2 1 1 9 4233 1 1 3 GLU HG3 H -22.876 1.134 0.427 1.00 . A A . 9 GLU HG3 1 1 9 4234 1 1 3 GLU N N -23.473 -2.104 2.813 1.00 . A A . 9 GLU N 1 1 9 4235 1 1 3 GLU O O -21.663 -1.809 4.836 1.00 . A A . 9 GLU O 1 1 9 4236 1 1 3 GLU OE1 O -19.986 1.113 1.778 1.00 . A A . 9 GLU OE1 1 1 9 4237 1 1 3 GLU OE2 O -20.603 2.125 -0.073 1.00 . A A . 9 GLU OE2 1 1 9 4238 1 1 4 GLY C C -17.765 -0.499 4.180 1.00 . A A . 10 GLY C 1 1 9 4239 1 1 4 GLY CA C -18.971 -1.369 4.473 1.00 . A A . 10 GLY CA 1 1 9 4240 1 1 4 GLY H H -19.721 -1.051 2.520 1.00 . A A . 10 GLY H 1 1 9 4241 1 1 4 GLY HA2 H -19.406 -1.059 5.412 1.00 . A A . 10 GLY HA2 1 1 9 4242 1 1 4 GLY HA3 H -18.647 -2.396 4.560 1.00 . A A . 10 GLY HA3 1 1 9 4243 1 1 4 GLY N N -19.982 -1.282 3.436 1.00 . A A . 10 GLY N 1 1 9 4244 1 1 4 GLY O O -17.790 0.317 3.258 1.00 . A A . 10 GLY O 1 1 9 4245 1 1 5 THR C C -14.772 -0.304 3.499 1.00 . A A . 11 THR C 1 1 9 4246 1 1 5 THR CA C -15.486 0.105 4.783 1.00 . A A . 11 THR CA 1 1 9 4247 1 1 5 THR CB C -14.553 -0.082 5.981 1.00 . A A . 11 THR CB 1 1 9 4248 1 1 5 THR CG2 C -14.163 -1.525 6.218 1.00 . A A . 11 THR CG2 1 1 9 4249 1 1 5 THR H H -16.747 -1.338 5.683 1.00 . A A . 11 THR H 1 1 9 4250 1 1 5 THR HA H -15.763 1.146 4.712 1.00 . A A . 11 THR HA 1 1 9 4251 1 1 5 THR HB H -15.051 0.276 6.871 1.00 . A A . 11 THR HB 1 1 9 4252 1 1 5 THR HG1 H -13.185 1.174 6.602 1.00 . A A . 11 THR HG1 1 1 9 4253 1 1 5 THR HG21 H -14.743 -2.166 5.570 1.00 . A A . 11 THR HG21 1 1 9 4254 1 1 5 THR HG22 H -13.112 -1.653 6.004 1.00 . A A . 11 THR HG22 1 1 9 4255 1 1 5 THR HG23 H -14.355 -1.786 7.248 1.00 . A A . 11 THR HG23 1 1 9 4256 1 1 5 THR N N -16.707 -0.672 4.965 1.00 . A A . 11 THR N 1 1 9 4257 1 1 5 THR O O -13.951 -1.221 3.499 1.00 . A A . 11 THR O 1 1 9 4258 1 1 5 THR OG1 O -13.361 0.663 5.809 1.00 . A A . 11 THR OG1 1 1 9 4259 1 1 6 PHE C C -14.527 1.300 0.188 1.00 . A A . 12 PHE C 1 1 9 4260 1 1 6 PHE CA C -14.486 0.085 1.113 1.00 . A A . 12 PHE CA 1 1 9 4261 1 1 6 PHE CB C -15.197 -1.098 0.453 1.00 . A A . 12 PHE CB 1 1 9 4262 1 1 6 PHE CD1 C -13.151 -1.736 -0.854 1.00 . A A . 12 PHE CD1 1 1 9 4263 1 1 6 PHE CD2 C -14.474 -3.475 0.100 1.00 . A A . 12 PHE CD2 1 1 9 4264 1 1 6 PHE CE1 C -12.284 -2.677 -1.375 1.00 . A A . 12 PHE CE1 1 1 9 4265 1 1 6 PHE CE2 C -13.610 -4.421 -0.418 1.00 . A A . 12 PHE CE2 1 1 9 4266 1 1 6 PHE CG C -14.255 -2.124 -0.112 1.00 . A A . 12 PHE CG 1 1 9 4267 1 1 6 PHE CZ C -12.513 -4.021 -1.156 1.00 . A A . 12 PHE CZ 1 1 9 4268 1 1 6 PHE H H -15.758 1.097 2.473 1.00 . A A . 12 PHE H 1 1 9 4269 1 1 6 PHE HA H -13.455 -0.181 1.288 1.00 . A A . 12 PHE HA 1 1 9 4270 1 1 6 PHE HB2 H -15.821 -1.588 1.184 1.00 . A A . 12 PHE HB2 1 1 9 4271 1 1 6 PHE HB3 H -15.816 -0.734 -0.355 1.00 . A A . 12 PHE HB3 1 1 9 4272 1 1 6 PHE HD1 H -12.971 -0.685 -1.025 1.00 . A A . 12 PHE HD1 1 1 9 4273 1 1 6 PHE HD2 H -15.332 -3.789 0.678 1.00 . A A . 12 PHE HD2 1 1 9 4274 1 1 6 PHE HE1 H -11.427 -2.362 -1.952 1.00 . A A . 12 PHE HE1 1 1 9 4275 1 1 6 PHE HE2 H -13.792 -5.472 -0.245 1.00 . A A . 12 PHE HE2 1 1 9 4276 1 1 6 PHE HZ H -11.836 -4.759 -1.562 1.00 . A A . 12 PHE HZ 1 1 9 4277 1 1 6 PHE N N -15.095 0.380 2.407 1.00 . A A . 12 PHE N 1 1 9 4278 1 1 6 PHE O O -13.610 1.517 -0.602 1.00 . A A . 12 PHE O 1 1 9 4279 1 1 7 THR C C -14.471 4.101 -0.599 1.00 . A A . 13 THR C 1 1 9 4280 1 1 7 THR CA C -15.758 3.278 -0.548 1.00 . A A . 13 THR CA 1 1 9 4281 1 1 7 THR CB C -16.903 4.142 -0.020 1.00 . A A . 13 THR CB 1 1 9 4282 1 1 7 THR CG2 C -18.172 3.361 0.245 1.00 . A A . 13 THR CG2 1 1 9 4283 1 1 7 THR H H -16.300 1.861 0.928 1.00 . A A . 13 THR H 1 1 9 4284 1 1 7 THR HA H -16.000 2.951 -1.548 1.00 . A A . 13 THR HA 1 1 9 4285 1 1 7 THR HB H -17.132 4.905 -0.750 1.00 . A A . 13 THR HB 1 1 9 4286 1 1 7 THR HG1 H -16.153 4.134 1.789 1.00 . A A . 13 THR HG1 1 1 9 4287 1 1 7 THR HG21 H -18.249 2.548 -0.462 1.00 . A A . 13 THR HG21 1 1 9 4288 1 1 7 THR HG22 H -18.147 2.963 1.249 1.00 . A A . 13 THR HG22 1 1 9 4289 1 1 7 THR HG23 H -19.026 4.013 0.139 1.00 . A A . 13 THR HG23 1 1 9 4290 1 1 7 THR N N -15.598 2.087 0.285 1.00 . A A . 13 THR N 1 1 9 4291 1 1 7 THR O O -14.061 4.564 -1.664 1.00 . A A . 13 THR O 1 1 9 4292 1 1 7 THR OG1 O -16.532 4.780 1.189 1.00 . A A . 13 THR OG1 1 1 9 4293 1 1 8 SER C C -11.386 4.144 0.444 1.00 . A A . 14 SER C 1 1 9 4294 1 1 8 SER CA C -12.602 5.045 0.641 1.00 . A A . 14 SER CA 1 1 9 4295 1 1 8 SER CB C -12.509 5.756 1.993 1.00 . A A . 14 SER CB 1 1 9 4296 1 1 8 SER H H -14.215 3.885 1.372 1.00 . A A . 14 SER H 1 1 9 4297 1 1 8 SER HA H -12.617 5.786 -0.144 1.00 . A A . 14 SER HA 1 1 9 4298 1 1 8 SER HB2 H -13.488 6.109 2.280 1.00 . A A . 14 SER HB2 1 1 9 4299 1 1 8 SER HB3 H -12.144 5.063 2.737 1.00 . A A . 14 SER HB3 1 1 9 4300 1 1 8 SER HG H -11.903 7.454 1.225 1.00 . A A . 14 SER HG 1 1 9 4301 1 1 8 SER N N -13.840 4.278 0.557 1.00 . A A . 14 SER N 1 1 9 4302 1 1 8 SER O O -10.390 4.551 -0.154 1.00 . A A . 14 SER O 1 1 9 4303 1 1 8 SER OG O -11.627 6.863 1.929 1.00 . A A . 14 SER OG 1 1 9 4304 1 1 9 ASP C C -10.152 1.556 -0.620 1.00 . A A . 15 ASP C 1 1 9 4305 1 1 9 ASP CA C -10.380 1.960 0.834 1.00 . A A . 15 ASP CA 1 1 9 4306 1 1 9 ASP CB C -10.671 0.717 1.677 1.00 . A A . 15 ASP CB 1 1 9 4307 1 1 9 ASP CG C -9.420 0.148 2.317 1.00 . A A . 15 ASP CG 1 1 9 4308 1 1 9 ASP H H -12.294 2.653 1.419 1.00 . A A . 15 ASP H 1 1 9 4309 1 1 9 ASP HA H -9.485 2.433 1.208 1.00 . A A . 15 ASP HA 1 1 9 4310 1 1 9 ASP HB2 H -11.368 0.975 2.461 1.00 . A A . 15 ASP HB2 1 1 9 4311 1 1 9 ASP HB3 H -11.109 -0.043 1.047 1.00 . A A . 15 ASP HB3 1 1 9 4312 1 1 9 ASP N N -11.474 2.919 0.952 1.00 . A A . 15 ASP N 1 1 9 4313 1 1 9 ASP O O -9.049 1.161 -0.997 1.00 . A A . 15 ASP O 1 1 9 4314 1 1 9 ASP OD1 O -8.317 0.392 1.784 1.00 . A A . 15 ASP OD1 1 1 9 4315 1 1 9 ASP OD2 O -9.543 -0.541 3.352 1.00 . A A . 15 ASP OD2 1 1 9 4316 1 1 10 VAL C C -9.992 2.053 -3.547 1.00 . A A . 16 VAL C 1 1 9 4317 1 1 10 VAL CA C -11.114 1.293 -2.842 1.00 . A A . 16 VAL CA 1 1 9 4318 1 1 10 VAL CB C -12.445 1.561 -3.573 1.00 . A A . 16 VAL CB 1 1 9 4319 1 1 10 VAL CG1 C -12.765 3.049 -3.585 1.00 . A A . 16 VAL CG1 1 1 9 4320 1 1 10 VAL CG2 C -12.395 1.006 -4.988 1.00 . A A . 16 VAL CG2 1 1 9 4321 1 1 10 VAL H H -12.056 1.971 -1.072 1.00 . A A . 16 VAL H 1 1 9 4322 1 1 10 VAL HA H -10.908 0.235 -2.899 1.00 . A A . 16 VAL HA 1 1 9 4323 1 1 10 VAL HB H -13.233 1.052 -3.039 1.00 . A A . 16 VAL HB 1 1 9 4324 1 1 10 VAL HG11 H -12.202 3.545 -2.809 1.00 . A A . 16 VAL HG11 1 1 9 4325 1 1 10 VAL HG12 H -12.501 3.466 -4.545 1.00 . A A . 16 VAL HG12 1 1 9 4326 1 1 10 VAL HG13 H -13.822 3.190 -3.410 1.00 . A A . 16 VAL HG13 1 1 9 4327 1 1 10 VAL HG21 H -11.818 0.093 -4.996 1.00 . A A . 16 VAL HG21 1 1 9 4328 1 1 10 VAL HG22 H -13.399 0.800 -5.330 1.00 . A A . 16 VAL HG22 1 1 9 4329 1 1 10 VAL HG23 H -11.933 1.730 -5.643 1.00 . A A . 16 VAL HG23 1 1 9 4330 1 1 10 VAL N N -11.201 1.653 -1.431 1.00 . A A . 16 VAL N 1 1 9 4331 1 1 10 VAL O O -9.489 1.618 -4.581 1.00 . A A . 16 VAL O 1 1 9 4332 1 1 11 SER C C -7.177 3.616 -3.006 1.00 . A A . 17 SER C 1 1 9 4333 1 1 11 SER CA C -8.545 4.008 -3.563 1.00 . A A . 17 SER CA 1 1 9 4334 1 1 11 SER CB C -8.811 5.490 -3.292 1.00 . A A . 17 SER CB 1 1 9 4335 1 1 11 SER H H -10.045 3.494 -2.162 1.00 . A A . 17 SER H 1 1 9 4336 1 1 11 SER HA H -8.546 3.842 -4.629 1.00 . A A . 17 SER HA 1 1 9 4337 1 1 11 SER HB2 H -9.858 5.700 -3.452 1.00 . A A . 17 SER HB2 1 1 9 4338 1 1 11 SER HB3 H -8.549 5.720 -2.270 1.00 . A A . 17 SER HB3 1 1 9 4339 1 1 11 SER HG H -8.044 7.212 -3.824 1.00 . A A . 17 SER HG 1 1 9 4340 1 1 11 SER N N -9.606 3.193 -2.984 1.00 . A A . 17 SER N 1 1 9 4341 1 1 11 SER O O -6.145 3.927 -3.600 1.00 . A A . 17 SER O 1 1 9 4342 1 1 11 SER OG O -8.045 6.312 -4.156 1.00 . A A . 17 SER OG 1 1 9 4343 1 1 12 SER C C -5.431 1.189 -1.748 1.00 . A A . 18 SER C 1 1 9 4344 1 1 12 SER CA C -5.929 2.532 -1.216 1.00 . A A . 18 SER CA 1 1 9 4345 1 1 12 SER CB C -6.118 2.452 0.299 1.00 . A A . 18 SER CB 1 1 9 4346 1 1 12 SER H H -8.026 2.737 -1.421 1.00 . A A . 18 SER H 1 1 9 4347 1 1 12 SER HA H -5.185 3.284 -1.432 1.00 . A A . 18 SER HA 1 1 9 4348 1 1 12 SER HB2 H -6.976 3.043 0.585 1.00 . A A . 18 SER HB2 1 1 9 4349 1 1 12 SER HB3 H -6.279 1.423 0.586 1.00 . A A . 18 SER HB3 1 1 9 4350 1 1 12 SER HG H -5.187 3.788 1.387 1.00 . A A . 18 SER HG 1 1 9 4351 1 1 12 SER N N -7.174 2.946 -1.856 1.00 . A A . 18 SER N 1 1 9 4352 1 1 12 SER O O -4.225 0.974 -1.867 1.00 . A A . 18 SER O 1 1 9 4353 1 1 12 SER OG O -4.978 2.943 0.983 1.00 . A A . 18 SER OG 1 1 9 4354 1 1 13 TYR C C -5.075 -0.924 -3.785 1.00 . A A . 19 TYR C 1 1 9 4355 1 1 13 TYR CA C -5.980 -1.040 -2.559 1.00 . A A . 19 TYR CA 1 1 9 4356 1 1 13 TYR CB C -7.229 -1.875 -2.885 1.00 . A A . 19 TYR CB 1 1 9 4357 1 1 13 TYR CD1 C -7.083 -2.372 -5.361 1.00 . A A . 19 TYR CD1 1 1 9 4358 1 1 13 TYR CD2 C -8.856 -0.976 -4.597 1.00 . A A . 19 TYR CD2 1 1 9 4359 1 1 13 TYR CE1 C -7.540 -2.251 -6.659 1.00 . A A . 19 TYR CE1 1 1 9 4360 1 1 13 TYR CE2 C -9.320 -0.851 -5.893 1.00 . A A . 19 TYR CE2 1 1 9 4361 1 1 13 TYR CG C -7.732 -1.736 -4.309 1.00 . A A . 19 TYR CG 1 1 9 4362 1 1 13 TYR CZ C -8.659 -1.489 -6.920 1.00 . A A . 19 TYR CZ 1 1 9 4363 1 1 13 TYR H H -7.303 0.498 -1.934 1.00 . A A . 19 TYR H 1 1 9 4364 1 1 13 TYR HA H -5.427 -1.538 -1.775 1.00 . A A . 19 TYR HA 1 1 9 4365 1 1 13 TYR HB2 H -7.006 -2.918 -2.719 1.00 . A A . 19 TYR HB2 1 1 9 4366 1 1 13 TYR HB3 H -8.030 -1.578 -2.222 1.00 . A A . 19 TYR HB3 1 1 9 4367 1 1 13 TYR HD1 H -9.370 -0.475 -3.792 1.00 . A A . 19 TYR HD1 1 1 9 4368 1 1 13 TYR HD2 H -6.207 -2.968 -5.153 1.00 . A A . 19 TYR HD2 1 1 9 4369 1 1 13 TYR HE1 H -10.197 -0.254 -6.097 1.00 . A A . 19 TYR HE1 1 1 9 4370 1 1 13 TYR HE2 H -7.021 -2.752 -7.463 1.00 . A A . 19 TYR HE2 1 1 9 4371 1 1 13 TYR HH H -9.560 -2.178 -8.472 1.00 . A A . 19 TYR HH 1 1 9 4372 1 1 13 TYR N N -6.355 0.281 -2.055 1.00 . A A . 19 TYR N 1 1 9 4373 1 1 13 TYR O O -4.297 -1.831 -4.082 1.00 . A A . 19 TYR O 1 1 9 4374 1 1 13 TYR OH O -9.118 -1.367 -8.211 1.00 . A A . 19 TYR OH 1 1 9 4375 1 1 14 LEU C C -2.894 0.221 -5.400 1.00 . A A . 20 LEU C 1 1 9 4376 1 1 14 LEU CA C -4.378 0.429 -5.689 1.00 . A A . 20 LEU CA 1 1 9 4377 1 1 14 LEU CB C -4.614 1.845 -6.219 1.00 . A A . 20 LEU CB 1 1 9 4378 1 1 14 LEU CD1 C -6.203 3.617 -7.009 1.00 . A A . 20 LEU CD1 1 1 9 4379 1 1 14 LEU CD2 C -6.884 1.213 -7.084 1.00 . A A . 20 LEU CD2 1 1 9 4380 1 1 14 LEU CG C -6.082 2.263 -6.328 1.00 . A A . 20 LEU CG 1 1 9 4381 1 1 14 LEU H H -5.822 0.882 -4.209 1.00 . A A . 20 LEU H 1 1 9 4382 1 1 14 LEU HA H -4.688 -0.282 -6.440 1.00 . A A . 20 LEU HA 1 1 9 4383 1 1 14 LEU HB2 H -4.111 2.541 -5.563 1.00 . A A . 20 LEU HB2 1 1 9 4384 1 1 14 LEU HB3 H -4.169 1.918 -7.200 1.00 . A A . 20 LEU HB3 1 1 9 4385 1 1 14 LEU HD11 H -5.652 3.603 -7.938 1.00 . A A . 20 LEU HD11 1 1 9 4386 1 1 14 LEU HD12 H -7.243 3.828 -7.210 1.00 . A A . 20 LEU HD12 1 1 9 4387 1 1 14 LEU HD13 H -5.798 4.382 -6.363 1.00 . A A . 20 LEU HD13 1 1 9 4388 1 1 14 LEU HD21 H -6.362 0.946 -7.991 1.00 . A A . 20 LEU HD21 1 1 9 4389 1 1 14 LEU HD22 H -7.002 0.336 -6.465 1.00 . A A . 20 LEU HD22 1 1 9 4390 1 1 14 LEU HD23 H -7.856 1.613 -7.332 1.00 . A A . 20 LEU HD23 1 1 9 4391 1 1 14 LEU HG H -6.499 2.352 -5.335 1.00 . A A . 20 LEU HG 1 1 9 4392 1 1 14 LEU N N -5.184 0.196 -4.494 1.00 . A A . 20 LEU N 1 1 9 4393 1 1 14 LEU O O -2.400 0.590 -4.335 1.00 . A A . 20 LEU O 1 1 9 4394 1 1 15 GLU C C -0.492 -1.620 -5.074 1.00 . A A . 21 GLU C 1 1 9 4395 1 1 15 GLU CA C -0.762 -0.638 -6.213 1.00 . A A . 21 GLU CA 1 1 9 4396 1 1 15 GLU CB C -0.004 0.669 -5.966 1.00 . A A . 21 GLU CB 1 1 9 4397 1 1 15 GLU CD C 0.987 2.730 -7.037 1.00 . A A . 21 GLU CD 1 1 9 4398 1 1 15 GLU CG C 0.573 1.285 -7.230 1.00 . A A . 21 GLU CG 1 1 9 4399 1 1 15 GLU H H -2.643 -0.647 -7.184 1.00 . A A . 21 GLU H 1 1 9 4400 1 1 15 GLU HA H -0.412 -1.074 -7.136 1.00 . A A . 21 GLU HA 1 1 9 4401 1 1 15 GLU HB2 H -0.679 1.385 -5.520 1.00 . A A . 21 GLU HB2 1 1 9 4402 1 1 15 GLU HB3 H 0.808 0.479 -5.281 1.00 . A A . 21 GLU HB3 1 1 9 4403 1 1 15 GLU HG2 H 1.440 0.715 -7.529 1.00 . A A . 21 GLU HG2 1 1 9 4404 1 1 15 GLU HG3 H -0.173 1.240 -8.010 1.00 . A A . 21 GLU HG3 1 1 9 4405 1 1 15 GLU N N -2.190 -0.375 -6.358 1.00 . A A . 21 GLU N 1 1 9 4406 1 1 15 GLU O O 0.639 -1.736 -4.601 1.00 . A A . 21 GLU O 1 1 9 4407 1 1 15 GLU OE1 O 2.049 2.967 -6.423 1.00 . A A . 21 GLU OE1 1 1 9 4408 1 1 15 GLU OE2 O 0.251 3.626 -7.501 1.00 . A A . 21 GLU OE2 1 1 9 4409 1 1 16 GLY C C -0.637 -2.723 -2.365 1.00 . A A . 22 GLY C 1 1 9 4410 1 1 16 GLY CA C -1.379 -3.292 -3.560 1.00 . A A . 22 GLY CA 1 1 9 4411 1 1 16 GLY H H -2.411 -2.199 -5.052 1.00 . A A . 22 GLY H 1 1 9 4412 1 1 16 GLY HA2 H -2.359 -3.615 -3.240 1.00 . A A . 22 GLY HA2 1 1 9 4413 1 1 16 GLY HA3 H -0.835 -4.147 -3.933 1.00 . A A . 22 GLY HA3 1 1 9 4414 1 1 16 GLY N N -1.533 -2.328 -4.638 1.00 . A A . 22 GLY N 1 1 9 4415 1 1 16 GLY O O 0.593 -2.731 -2.329 1.00 . A A . 22 GLY O 1 1 9 4416 1 1 17 GLN C C 0.067 -2.687 0.545 1.00 . A A . 23 GLN C 1 1 9 4417 1 1 17 GLN CA C -0.787 -1.654 -0.184 1.00 . A A . 23 GLN CA 1 1 9 4418 1 1 17 GLN CB C -1.874 -1.116 0.750 1.00 . A A . 23 GLN CB 1 1 9 4419 1 1 17 GLN CD C -2.545 -2.288 2.889 1.00 . A A . 23 GLN CD 1 1 9 4420 1 1 17 GLN CG C -2.730 -2.201 1.386 1.00 . A A . 23 GLN CG 1 1 9 4421 1 1 17 GLN H H -2.362 -2.249 -1.469 1.00 . A A . 23 GLN H 1 1 9 4422 1 1 17 GLN HA H -0.153 -0.835 -0.492 1.00 . A A . 23 GLN HA 1 1 9 4423 1 1 17 GLN HB2 H -1.404 -0.549 1.541 1.00 . A A . 23 GLN HB2 1 1 9 4424 1 1 17 GLN HB3 H -2.523 -0.460 0.188 1.00 . A A . 23 GLN HB3 1 1 9 4425 1 1 17 GLN HE21 H -0.961 -3.468 2.654 1.00 . A A . 23 GLN HE21 1 1 9 4426 1 1 17 GLN HE22 H -1.385 -3.098 4.287 1.00 . A A . 23 GLN HE22 1 1 9 4427 1 1 17 GLN HG2 H -3.769 -1.990 1.179 1.00 . A A . 23 GLN HG2 1 1 9 4428 1 1 17 GLN HG3 H -2.465 -3.153 0.950 1.00 . A A . 23 GLN HG3 1 1 9 4429 1 1 17 GLN N N -1.386 -2.228 -1.384 1.00 . A A . 23 GLN N 1 1 9 4430 1 1 17 GLN NE2 N -1.528 -3.026 3.320 1.00 . A A . 23 GLN NE2 1 1 9 4431 1 1 17 GLN O O 1.059 -2.344 1.189 1.00 . A A . 23 GLN O 1 1 9 4432 1 1 17 GLN OE1 O -3.307 -1.698 3.655 1.00 . A A . 23 GLN OE1 1 1 9 4433 1 1 18 ALA C C 1.843 -5.102 0.592 1.00 . A A . 24 ALA C 1 1 9 4434 1 1 18 ALA CA C 0.403 -5.037 1.087 1.00 . A A . 24 ALA CA 1 1 9 4435 1 1 18 ALA CB C -0.300 -6.364 0.844 1.00 . A A . 24 ALA CB 1 1 9 4436 1 1 18 ALA H H -1.123 -4.163 -0.089 1.00 . A A . 24 ALA H 1 1 9 4437 1 1 18 ALA HA H 0.406 -4.847 2.150 1.00 . A A . 24 ALA HA 1 1 9 4438 1 1 18 ALA HB1 H -1.345 -6.185 0.639 1.00 . A A . 24 ALA HB1 1 1 9 4439 1 1 18 ALA HB2 H 0.152 -6.861 -0.001 1.00 . A A . 24 ALA HB2 1 1 9 4440 1 1 18 ALA HB3 H -0.206 -6.987 1.721 1.00 . A A . 24 ALA HB3 1 1 9 4441 1 1 18 ALA N N -0.325 -3.953 0.438 1.00 . A A . 24 ALA N 1 1 9 4442 1 1 18 ALA O O 2.751 -5.466 1.339 1.00 . A A . 24 ALA O 1 1 9 4443 1 1 19 ALA C C 4.073 -3.421 -1.088 1.00 . A A . 25 ALA C 1 1 9 4444 1 1 19 ALA CA C 3.374 -4.763 -1.269 1.00 . A A . 25 ALA CA 1 1 9 4445 1 1 19 ALA CB C 3.287 -5.118 -2.746 1.00 . A A . 25 ALA CB 1 1 9 4446 1 1 19 ALA H H 1.280 -4.466 -1.218 1.00 . A A . 25 ALA H 1 1 9 4447 1 1 19 ALA HA H 3.952 -5.529 -0.773 1.00 . A A . 25 ALA HA 1 1 9 4448 1 1 19 ALA HB1 H 2.583 -5.926 -2.881 1.00 . A A . 25 ALA HB1 1 1 9 4449 1 1 19 ALA HB2 H 2.955 -4.255 -3.304 1.00 . A A . 25 ALA HB2 1 1 9 4450 1 1 19 ALA HB3 H 4.260 -5.425 -3.100 1.00 . A A . 25 ALA HB3 1 1 9 4451 1 1 19 ALA N N 2.044 -4.747 -0.673 1.00 . A A . 25 ALA N 1 1 9 4452 1 1 19 ALA O O 5.143 -3.343 -0.486 1.00 . A A . 25 ALA O 1 1 9 4453 1 1 20 LYS C C 4.533 -0.704 -0.123 1.00 . A A . 26 LYS C 1 1 9 4454 1 1 20 LYS CA C 4.015 -1.015 -1.527 1.00 . A A . 26 LYS CA 1 1 9 4455 1 1 20 LYS CB C 2.958 0.016 -1.932 1.00 . A A . 26 LYS CB 1 1 9 4456 1 1 20 LYS CD C 4.552 1.265 -3.439 1.00 . A A . 26 LYS CD 1 1 9 4457 1 1 20 LYS CE C 3.918 0.759 -4.726 1.00 . A A . 26 LYS CE 1 1 9 4458 1 1 20 LYS CG C 3.534 1.373 -2.313 1.00 . A A . 26 LYS CG 1 1 9 4459 1 1 20 LYS HA H 4.840 -0.956 -2.218 1.00 . A A . 26 LYS HA 1 1 9 4460 1 1 20 LYS HB2 H 2.404 -0.367 -2.775 1.00 . A A . 26 LYS HB2 1 1 9 4461 1 1 20 LYS HD2 H 4.975 2.241 -3.622 1.00 . A A . 26 LYS HD2 1 1 9 4462 1 1 20 LYS HE2 H 2.989 0.265 -4.486 1.00 . A A . 26 LYS HE2 1 1 9 4463 1 1 20 LYS HG2 H 2.728 2.016 -2.633 1.00 . A A . 26 LYS HG2 1 1 9 4464 1 1 20 LYS HZ1 H 4.394 -1.034 -5.716 1.00 . A A . 26 LYS HZ1 1 1 9 4465 1 1 20 LYS N N 3.459 -2.365 -1.617 1.00 . A A . 26 LYS N 1 1 9 4466 1 1 20 LYS NZ N 4.785 -0.181 -5.433 1.00 . A A . 26 LYS NZ 1 1 9 4467 1 1 20 LYS O O 5.431 0.121 0.043 1.00 . A A . 26 LYS O 1 1 9 4468 1 1 21 GLU C C 5.891 -1.073 2.406 1.00 . A A . 27 GLU C 1 1 9 4469 1 1 21 GLU CA C 4.373 -1.158 2.275 1.00 . A A . 27 GLU CA 1 1 9 4470 1 1 21 GLU CB C 3.853 -2.296 3.154 1.00 . A A . 27 GLU CB 1 1 9 4471 1 1 21 GLU CD C 3.944 -4.760 3.714 1.00 . A A . 27 GLU CD 1 1 9 4472 1 1 21 GLU CG C 4.462 -3.647 2.823 1.00 . A A . 27 GLU CG 1 1 9 4473 1 1 21 GLU H H 3.252 -2.010 0.690 1.00 . A A . 27 GLU H 1 1 9 4474 1 1 21 GLU HA H 3.940 -0.229 2.612 1.00 . A A . 27 GLU HA 1 1 9 4475 1 1 21 GLU HB2 H 4.080 -2.069 4.184 1.00 . A A . 27 GLU HB2 1 1 9 4476 1 1 21 GLU HB3 H 2.783 -2.368 3.036 1.00 . A A . 27 GLU HB3 1 1 9 4477 1 1 21 GLU HG2 H 4.229 -3.890 1.797 1.00 . A A . 27 GLU HG2 1 1 9 4478 1 1 21 GLU HG3 H 5.534 -3.581 2.941 1.00 . A A . 27 GLU HG3 1 1 9 4479 1 1 21 GLU N N 3.965 -1.367 0.884 1.00 . A A . 27 GLU N 1 1 9 4480 1 1 21 GLU O O 6.415 -0.265 3.172 1.00 . A A . 27 GLU O 1 1 9 4481 1 1 21 GLU OE1 O 3.256 -4.452 4.710 1.00 . A A . 27 GLU OE1 1 1 9 4482 1 1 21 GLU OE2 O 4.227 -5.939 3.416 1.00 . A A . 27 GLU OE2 1 1 9 4483 1 1 22 PHE C C 8.633 -0.550 1.493 1.00 . A A . 28 PHE C 1 1 9 4484 1 1 22 PHE CA C 8.046 -1.949 1.683 1.00 . A A . 28 PHE CA 1 1 9 4485 1 1 22 PHE CB C 8.568 -2.910 0.603 1.00 . A A . 28 PHE CB 1 1 9 4486 1 1 22 PHE CD1 C 9.633 -1.374 -1.067 1.00 . A A . 28 PHE CD1 1 1 9 4487 1 1 22 PHE CD2 C 7.754 -2.659 -1.766 1.00 . A A . 28 PHE CD2 1 1 9 4488 1 1 22 PHE CE1 C 9.720 -0.806 -2.321 1.00 . A A . 28 PHE CE1 1 1 9 4489 1 1 22 PHE CE2 C 7.835 -2.094 -3.025 1.00 . A A . 28 PHE CE2 1 1 9 4490 1 1 22 PHE CG C 8.653 -2.304 -0.773 1.00 . A A . 28 PHE CG 1 1 9 4491 1 1 22 PHE CZ C 8.819 -1.165 -3.303 1.00 . A A . 28 PHE CZ 1 1 9 4492 1 1 22 PHE H H 6.110 -2.539 1.068 1.00 . A A . 28 PHE H 1 1 9 4493 1 1 22 PHE HA H 8.346 -2.320 2.652 1.00 . A A . 28 PHE HA 1 1 9 4494 1 1 22 PHE HB2 H 9.558 -3.242 0.876 1.00 . A A . 28 PHE HB2 1 1 9 4495 1 1 22 PHE HB3 H 7.909 -3.764 0.550 1.00 . A A . 28 PHE HB3 1 1 9 4496 1 1 22 PHE HD1 H 6.986 -3.384 -1.551 1.00 . A A . 28 PHE HD1 1 1 9 4497 1 1 22 PHE HD2 H 10.338 -1.096 -0.302 1.00 . A A . 28 PHE HD2 1 1 9 4498 1 1 22 PHE HE1 H 7.129 -2.378 -3.791 1.00 . A A . 28 PHE HE1 1 1 9 4499 1 1 22 PHE HE2 H 10.490 -0.079 -2.530 1.00 . A A . 28 PHE HE2 1 1 9 4500 1 1 22 PHE HZ H 8.884 -0.722 -4.286 1.00 . A A . 28 PHE HZ 1 1 9 4501 1 1 22 PHE N N 6.588 -1.917 1.655 1.00 . A A . 28 PHE N 1 1 9 4502 1 1 22 PHE O O 9.616 -0.184 2.138 1.00 . A A . 28 PHE O 1 1 9 4503 1 1 23 ILE C C 8.779 2.372 1.577 1.00 . A A . 29 ILE C 1 1 9 4504 1 1 23 ILE CA C 8.484 1.581 0.303 1.00 . A A . 29 ILE CA 1 1 9 4505 1 1 23 ILE CB C 7.448 2.351 -0.545 1.00 . A A . 29 ILE CB 1 1 9 4506 1 1 23 ILE CD1 C 7.414 4.068 -2.425 1.00 . A A . 29 ILE CD1 1 1 9 4507 1 1 23 ILE CG1 C 8.084 3.604 -1.150 1.00 . A A . 29 ILE CG1 1 1 9 4508 1 1 23 ILE CG2 C 6.229 2.719 0.291 1.00 . A A . 29 ILE CG2 1 1 9 4509 1 1 23 ILE H H 7.249 -0.130 0.112 1.00 . A A . 29 ILE H 1 1 9 4510 1 1 23 ILE HA H 9.393 1.503 -0.273 1.00 . A A . 29 ILE HA 1 1 9 4511 1 1 23 ILE HB H 7.120 1.703 -1.345 1.00 . A A . 29 ILE HB 1 1 9 4512 1 1 23 ILE HD11 H 7.251 3.221 -3.074 1.00 . A A . 29 ILE HD11 1 1 9 4513 1 1 23 ILE HD12 H 6.466 4.527 -2.187 1.00 . A A . 29 ILE HD12 1 1 9 4514 1 1 23 ILE HD13 H 8.047 4.787 -2.923 1.00 . A A . 29 ILE HD13 1 1 9 4515 1 1 23 ILE HG12 H 8.026 4.410 -0.434 1.00 . A A . 29 ILE HG12 1 1 9 4516 1 1 23 ILE HG13 H 9.121 3.401 -1.374 1.00 . A A . 29 ILE HG13 1 1 9 4517 1 1 23 ILE HG21 H 6.100 1.992 1.079 1.00 . A A . 29 ILE HG21 1 1 9 4518 1 1 23 ILE HG22 H 6.373 3.698 0.724 1.00 . A A . 29 ILE HG22 1 1 9 4519 1 1 23 ILE HG23 H 5.352 2.729 -0.337 1.00 . A A . 29 ILE HG23 1 1 9 4520 1 1 23 ILE N N 8.025 0.224 0.596 1.00 . A A . 29 ILE N 1 1 9 4521 1 1 23 ILE O O 9.593 3.295 1.570 1.00 . A A . 29 ILE O 1 1 9 4522 1 1 24 ALA C C 9.616 2.321 4.595 1.00 . A A . 30 ALA C 1 1 9 4523 1 1 24 ALA CA C 8.289 2.692 3.936 1.00 . A A . 30 ALA CA 1 1 9 4524 1 1 24 ALA CB C 7.132 2.370 4.870 1.00 . A A . 30 ALA CB 1 1 9 4525 1 1 24 ALA H H 7.464 1.273 2.605 1.00 . A A . 30 ALA H 1 1 9 4526 1 1 24 ALA HA H 8.280 3.756 3.748 1.00 . A A . 30 ALA HA 1 1 9 4527 1 1 24 ALA HB1 H 6.752 1.384 4.644 1.00 . A A . 30 ALA HB1 1 1 9 4528 1 1 24 ALA HB2 H 7.476 2.397 5.893 1.00 . A A . 30 ALA HB2 1 1 9 4529 1 1 24 ALA HB3 H 6.347 3.099 4.734 1.00 . A A . 30 ALA HB3 1 1 9 4530 1 1 24 ALA N N 8.106 2.011 2.662 1.00 . A A . 30 ALA N 1 1 9 4531 1 1 24 ALA O O 10.245 3.153 5.246 1.00 . A A . 30 ALA O 1 1 9 4532 1 1 25 TRP C C 12.499 1.302 4.458 1.00 . A A . 31 TRP C 1 1 9 4533 1 1 25 TRP CA C 11.272 0.592 5.043 1.00 . A A . 31 TRP CA 1 1 9 4534 1 1 25 TRP CB C 11.384 -0.935 4.899 1.00 . A A . 31 TRP CB 1 1 9 4535 1 1 25 TRP CD1 C 13.908 -1.394 4.826 1.00 . A A . 31 TRP CD1 1 1 9 4536 1 1 25 TRP CD2 C 12.809 -1.958 2.964 1.00 . A A . 31 TRP CD2 1 1 9 4537 1 1 25 TRP CE2 C 14.173 -2.256 2.785 1.00 . A A . 31 TRP CE2 1 1 9 4538 1 1 25 TRP CE3 C 11.921 -2.227 1.924 1.00 . A A . 31 TRP CE3 1 1 9 4539 1 1 25 TRP CG C 12.661 -1.407 4.272 1.00 . A A . 31 TRP CG 1 1 9 4540 1 1 25 TRP CH2 C 13.769 -3.059 0.605 1.00 . A A . 31 TRP CH2 1 1 9 4541 1 1 25 TRP CZ2 C 14.662 -2.810 1.603 1.00 . A A . 31 TRP CZ2 1 1 9 4542 1 1 25 TRP CZ3 C 12.409 -2.771 0.759 1.00 . A A . 31 TRP CZ3 1 1 9 4543 1 1 25 TRP H H 9.480 0.442 3.921 1.00 . A A . 31 TRP H 1 1 9 4544 1 1 25 TRP HA H 11.222 0.829 6.096 1.00 . A A . 31 TRP HA 1 1 9 4545 1 1 25 TRP HB2 H 11.314 -1.385 5.878 1.00 . A A . 31 TRP HB2 1 1 9 4546 1 1 25 TRP HB3 H 10.564 -1.289 4.291 1.00 . A A . 31 TRP HB3 1 1 9 4547 1 1 25 TRP HD1 H 14.130 -1.030 5.819 1.00 . A A . 31 TRP HD1 1 1 9 4548 1 1 25 TRP HE1 H 15.785 -1.984 4.092 1.00 . A A . 31 TRP HE1 1 1 9 4549 1 1 25 TRP HE3 H 10.868 -2.013 2.018 1.00 . A A . 31 TRP HE3 1 1 9 4550 1 1 25 TRP HH2 H 14.105 -3.486 -0.328 1.00 . A A . 31 TRP HH2 1 1 9 4551 1 1 25 TRP HZ2 H 15.704 -3.027 1.459 1.00 . A A . 31 TRP HZ2 1 1 9 4552 1 1 25 TRP HZ3 H 11.741 -2.961 -0.059 1.00 . A A . 31 TRP HZ3 1 1 9 4553 1 1 25 TRP N N 10.029 1.066 4.440 1.00 . A A . 31 TRP N 1 1 9 4554 1 1 25 TRP NE1 N 14.825 -1.897 3.933 1.00 . A A . 31 TRP NE1 1 1 9 4555 1 1 25 TRP O O 13.337 1.804 5.207 1.00 . A A . 31 TRP O 1 1 9 4556 1 1 26 LEU C C 13.987 3.382 3.097 1.00 . A A . 32 LEU C 1 1 9 4557 1 1 26 LEU CA C 13.761 2.004 2.490 1.00 . A A . 32 LEU CA 1 1 9 4558 1 1 26 LEU CB C 13.590 2.197 0.972 1.00 . A A . 32 LEU CB 1 1 9 4559 1 1 26 LEU CD1 C 13.909 -0.194 0.436 1.00 . A A . 32 LEU CD1 1 1 9 4560 1 1 26 LEU CD2 C 11.607 0.795 0.402 1.00 . A A . 32 LEU CD2 1 1 9 4561 1 1 26 LEU CG C 13.085 1.031 0.153 1.00 . A A . 32 LEU CG 1 1 9 4562 1 1 26 LEU H H 11.924 0.929 2.576 1.00 . A A . 32 LEU H 1 1 9 4563 1 1 26 LEU HA H 14.634 1.396 2.672 1.00 . A A . 32 LEU HA 1 1 9 4564 1 1 26 LEU HB2 H 12.915 3.012 0.811 1.00 . A A . 32 LEU HB2 1 1 9 4565 1 1 26 LEU HB3 H 14.553 2.466 0.577 1.00 . A A . 32 LEU HB3 1 1 9 4566 1 1 26 LEU HD11 H 14.957 0.061 0.398 1.00 . A A . 32 LEU HD11 1 1 9 4567 1 1 26 LEU HD12 H 13.665 -0.561 1.411 1.00 . A A . 32 LEU HD12 1 1 9 4568 1 1 26 LEU HD13 H 13.694 -0.945 -0.304 1.00 . A A . 32 LEU HD13 1 1 9 4569 1 1 26 LEU HD21 H 11.192 1.638 0.939 1.00 . A A . 32 LEU HD21 1 1 9 4570 1 1 26 LEU HD22 H 11.098 0.687 -0.544 1.00 . A A . 32 LEU HD22 1 1 9 4571 1 1 26 LEU HD23 H 11.479 -0.102 0.983 1.00 . A A . 32 LEU HD23 1 1 9 4572 1 1 26 LEU HG H 13.211 1.269 -0.891 1.00 . A A . 32 LEU HG 1 1 9 4573 1 1 26 LEU N N 12.613 1.344 3.127 1.00 . A A . 32 LEU N 1 1 9 4574 1 1 26 LEU O O 14.994 3.636 3.757 1.00 . A A . 32 LEU O 1 1 9 4575 1 1 27 VAL C C 13.391 5.716 4.818 1.00 . A A . 33 VAL C 1 1 9 4576 1 1 27 VAL CA C 13.095 5.641 3.320 1.00 . A A . 33 VAL CA 1 1 9 4577 1 1 27 VAL CB C 11.777 6.377 3.013 1.00 . A A . 33 VAL CB 1 1 9 4578 1 1 27 VAL CG1 C 10.623 5.769 3.793 1.00 . A A . 33 VAL CG1 1 1 9 4579 1 1 27 VAL CG2 C 11.912 7.864 3.292 1.00 . A A . 33 VAL CG2 1 1 9 4580 1 1 27 VAL H H 12.268 3.997 2.296 1.00 . A A . 33 VAL H 1 1 9 4581 1 1 27 VAL HA H 13.887 6.139 2.784 1.00 . A A . 33 VAL HA 1 1 9 4582 1 1 27 VAL HB H 11.564 6.253 1.964 1.00 . A A . 33 VAL HB 1 1 9 4583 1 1 27 VAL HG11 H 10.792 5.902 4.851 1.00 . A A . 33 VAL HG11 1 1 9 4584 1 1 27 VAL HG12 H 9.702 6.258 3.511 1.00 . A A . 33 VAL HG12 1 1 9 4585 1 1 27 VAL HG13 H 10.554 4.714 3.567 1.00 . A A . 33 VAL HG13 1 1 9 4586 1 1 27 VAL HG21 H 12.736 8.031 3.969 1.00 . A A . 33 VAL HG21 1 1 9 4587 1 1 27 VAL HG22 H 12.098 8.384 2.362 1.00 . A A . 33 VAL HG22 1 1 9 4588 1 1 27 VAL HG23 H 10.999 8.233 3.734 1.00 . A A . 33 VAL HG23 1 1 9 4589 1 1 27 VAL N N 13.035 4.271 2.840 1.00 . A A . 33 VAL N 1 1 9 4590 1 1 27 VAL O O 14.199 6.535 5.256 1.00 . A A . 33 VAL O 1 1 9 4591 1 1 28 ARG C C 14.331 4.302 7.387 1.00 . A A . 34 ARG C 1 1 9 4592 1 1 28 ARG CA C 12.947 4.845 7.043 1.00 . A A . 34 ARG CA 1 1 9 4593 1 1 28 ARG CB C 11.869 4.005 7.732 1.00 . A A . 34 ARG CB 1 1 9 4594 1 1 28 ARG CD C 9.443 4.600 7.425 1.00 . A A . 34 ARG CD 1 1 9 4595 1 1 28 ARG CG C 10.699 4.826 8.251 1.00 . A A . 34 ARG CG 1 1 9 4596 1 1 28 ARG CZ C 7.102 5.369 7.478 1.00 . A A . 34 ARG CZ 1 1 9 4597 1 1 28 ARG H H 12.107 4.229 5.197 1.00 . A A . 34 ARG H 1 1 9 4598 1 1 28 ARG HA H 12.877 5.862 7.397 1.00 . A A . 34 ARG HA 1 1 9 4599 1 1 28 ARG HB2 H 11.491 3.278 7.029 1.00 . A A . 34 ARG HB2 1 1 9 4600 1 1 28 ARG HB3 H 12.314 3.484 8.568 1.00 . A A . 34 ARG HB3 1 1 9 4601 1 1 28 ARG HD2 H 9.551 5.114 6.482 1.00 . A A . 34 ARG HD2 1 1 9 4602 1 1 28 ARG HD3 H 9.332 3.541 7.246 1.00 . A A . 34 ARG HD3 1 1 9 4603 1 1 28 ARG HE H 8.298 5.231 9.070 1.00 . A A . 34 ARG HE 1 1 9 4604 1 1 28 ARG HG2 H 10.500 4.544 9.274 1.00 . A A . 34 ARG HG2 1 1 9 4605 1 1 28 ARG HG3 H 10.962 5.873 8.210 1.00 . A A . 34 ARG HG3 1 1 9 4606 1 1 28 ARG HH11 H 7.774 4.863 5.638 1.00 . A A . 34 ARG HH11 1 1 9 4607 1 1 28 ARG HH12 H 6.132 5.407 5.705 1.00 . A A . 34 ARG HH12 1 1 9 4608 1 1 28 ARG HH21 H 6.138 5.945 9.157 1.00 . A A . 34 ARG HH21 1 1 9 4609 1 1 28 ARG HH22 H 5.203 6.021 7.702 1.00 . A A . 34 ARG HH22 1 1 9 4610 1 1 28 ARG N N 12.739 4.861 5.599 1.00 . A A . 34 ARG N 1 1 9 4611 1 1 28 ARG NE N 8.247 5.095 8.101 1.00 . A A . 34 ARG NE 1 1 9 4612 1 1 28 ARG NH1 N 6.995 5.199 6.166 1.00 . A A . 34 ARG NH1 1 1 9 4613 1 1 28 ARG NH2 N 6.063 5.815 8.169 1.00 . A A . 34 ARG NH2 1 1 9 4614 1 1 28 ARG O O 14.914 4.665 8.409 1.00 . A A . 34 ARG O 1 1 9 4615 1 1 29 GLY C C 16.898 2.542 5.470 1.00 . A A . 35 GLY C 1 1 9 4616 1 1 29 GLY CA C 16.164 2.856 6.759 1.00 . A A . 35 GLY CA 1 1 9 4617 1 1 29 GLY H H 14.343 3.180 5.729 1.00 . A A . 35 GLY H 1 1 9 4618 1 1 29 GLY HA2 H 16.753 3.553 7.336 1.00 . A A . 35 GLY HA2 1 1 9 4619 1 1 29 GLY HA3 H 16.048 1.944 7.326 1.00 . A A . 35 GLY HA3 1 1 9 4620 1 1 29 GLY N N 14.852 3.432 6.527 1.00 . A A . 35 GLY N 1 1 9 4621 1 1 29 GLY O O 16.843 1.417 4.974 1.00 . A A . 35 GLY O 1 1 9 4622 1 1 30 ARG C C 19.186 4.599 3.388 1.00 . A A . 36 ARG C 1 1 9 4623 1 1 30 ARG CA C 18.337 3.367 3.687 1.00 . A A . 36 ARG CA 1 1 9 4624 1 1 30 ARG CB C 17.383 3.096 2.523 1.00 . A A . 36 ARG CB 1 1 9 4625 1 1 30 ARG CD C 17.309 1.867 0.334 1.00 . A A . 36 ARG CD 1 1 9 4626 1 1 30 ARG CG C 18.091 2.838 1.203 1.00 . A A . 36 ARG CG 1 1 9 4627 1 1 30 ARG CZ C 19.078 0.365 -0.498 1.00 . A A . 36 ARG CZ 1 1 9 4628 1 1 30 ARG H H 17.592 4.414 5.369 1.00 . A A . 36 ARG H 1 1 9 4629 1 1 30 ARG HA H 18.990 2.516 3.811 1.00 . A A . 36 ARG HA 1 1 9 4630 1 1 30 ARG HB2 H 16.781 2.232 2.760 1.00 . A A . 36 ARG HB2 1 1 9 4631 1 1 30 ARG HB3 H 16.735 3.952 2.398 1.00 . A A . 36 ARG HB3 1 1 9 4632 1 1 30 ARG HD2 H 16.925 1.073 0.958 1.00 . A A . 36 ARG HD2 1 1 9 4633 1 1 30 ARG HD3 H 16.485 2.395 -0.122 1.00 . A A . 36 ARG HD3 1 1 9 4634 1 1 30 ARG HE H 17.988 1.591 -1.636 1.00 . A A . 36 ARG HE 1 1 9 4635 1 1 30 ARG HG2 H 18.198 3.773 0.674 1.00 . A A . 36 ARG HG2 1 1 9 4636 1 1 30 ARG HG3 H 19.067 2.422 1.405 1.00 . A A . 36 ARG HG3 1 1 9 4637 1 1 30 ARG HH11 H 18.779 0.281 1.501 1.00 . A A . 36 ARG HH11 1 1 9 4638 1 1 30 ARG HH12 H 20.016 -0.765 0.891 1.00 . A A . 36 ARG HH12 1 1 9 4639 1 1 30 ARG HH21 H 19.615 0.215 -2.440 1.00 . A A . 36 ARG HH21 1 1 9 4640 1 1 30 ARG HH22 H 20.492 -0.803 -1.346 1.00 . A A . 36 ARG HH22 1 1 9 4641 1 1 30 ARG N N 17.587 3.540 4.926 1.00 . A A . 36 ARG N 1 1 9 4642 1 1 30 ARG NE N 18.139 1.283 -0.718 1.00 . A A . 36 ARG NE 1 1 9 4643 1 1 30 ARG NH1 N 19.310 -0.075 0.733 1.00 . A A . 36 ARG NH1 1 1 9 4644 1 1 30 ARG NH2 N 19.786 -0.114 -1.511 1.00 . A A . 36 ARG NH2 1 1 9 4645 1 1 30 ARG O O 18.820 5.718 3.745 1.00 . A A . 36 ARG O 1 1 9 4646 1 1 31 GLY C C 21.905 5.281 1.065 1.00 . A A . 37 GLY C 1 1 9 4647 1 1 31 GLY CA C 21.202 5.486 2.392 1.00 . A A . 37 GLY CA 1 1 9 4648 1 1 31 GLY H H 20.560 3.470 2.469 1.00 . A A . 37 GLY H 1 1 9 4649 1 1 31 GLY HA2 H 20.622 6.395 2.343 1.00 . A A . 37 GLY HA2 1 1 9 4650 1 1 31 GLY HA3 H 21.946 5.588 3.169 1.00 . A A . 37 GLY HA3 1 1 9 4651 1 1 31 GLY N N 20.320 4.384 2.729 1.00 . A A . 37 GLY N 1 1 9 4652 1 1 31 GLY O O 22.334 6.285 0.459 1.00 . A A . 37 GLY O 1 1 9 4653 1 1 31 GLY OXT O 22.028 4.116 0.631 1.00 . A A . 37 GLY OXT 1 1 9 4654 2 2 1 . C02 C 9.410 -3.790 -5.299 1.00 . B A . 1038 D6M C02 1 1 9 4655 2 2 1 . C04 C 7.416 -3.455 -6.661 1.00 . B A . 1038 D6M C04 1 1 9 4656 2 2 1 . C05 C 6.381 -2.368 -6.346 1.00 . B A . 1038 D6M C05 1 1 9 4657 2 2 1 . C06 C 6.922 -0.949 -6.447 1.00 . B A . 1038 D6M C06 1 1 9 4658 2 2 1 . C07 C 6.063 0.061 -5.709 1.00 . B A . 1038 D6M C07 1 1 9 4659 2 2 1 . C09 C 7.434 -3.733 -8.160 1.00 . B A . 1038 D6M C09 1 1 9 4660 2 2 1 . C12 C 10.795 -3.385 -4.827 1.00 . B A . 1038 D6M C12 1 1 9 4661 2 2 1 . C13 C 11.327 -4.282 -3.717 1.00 . B A . 1038 D6M C13 1 1 9 4662 2 2 1 . C14 C 12.849 -4.227 -3.625 1.00 . B A . 1038 D6M C14 1 1 9 4663 2 2 1 . C15 C 13.369 -2.795 -3.599 1.00 . B A . 1038 D6M C15 1 1 9 4664 2 2 1 . C16 C 12.744 -1.995 -2.465 1.00 . B A . 1038 D6M C16 1 1 9 4665 2 2 1 . C17 C 12.936 -0.492 -2.638 1.00 . B A . 1038 D6M C17 1 1 9 4666 2 2 1 . C18 C 12.585 -0.018 -4.047 1.00 . B A . 1038 D6M C18 1 1 9 4667 2 2 1 . C19 C 11.870 1.335 -4.050 1.00 . B A . 1038 D6M C19 1 1 9 4668 2 2 1 . C20 C 12.364 2.255 -2.941 1.00 . B A . 1038 D6M C20 1 1 9 4669 2 2 1 . C21 C 12.154 3.722 -3.288 1.00 . B A . 1038 D6M C21 1 1 9 4670 2 2 1 . C22 C 12.697 4.636 -2.198 1.00 . B A . 1038 D6M C22 1 1 9 4671 2 2 1 . C23 C 11.719 5.753 -1.862 1.00 . B A . 1038 D6M C23 1 1 9 4672 2 2 1 . C24 C 11.769 6.115 -0.385 1.00 . B A . 1038 D6M C24 1 1 9 4673 2 2 1 . C25 C 12.656 7.324 -0.132 1.00 . B A . 1038 D6M C25 1 1 9 4674 2 2 1 . C26 C 12.121 8.566 -0.813 1.00 . B A . 1038 D6M C26 1 1 9 4675 2 2 1 . H03 H 9.194 -2.308 -6.622 1.00 . B A . 1038 D6M H03 1 1 9 4676 2 2 1 . H04 H 7.138 -4.362 -6.144 1.00 . B A . 1038 D6M H04 1 1 9 4677 2 2 1 . HP21 H 10.750 -2.370 -4.461 1.00 . B A . 1038 D6M HP21 1 1 9 4678 2 2 1 . HP22 H 11.472 -3.434 -5.666 1.00 . B A . 1038 D6M HP22 1 1 9 4679 2 2 1 . HP31 H 11.025 -5.300 -3.916 1.00 . B A . 1038 D6M HP31 1 1 9 4680 2 2 1 . HP32 H 10.909 -3.960 -2.774 1.00 . B A . 1038 D6M HP32 1 1 9 4681 2 2 1 . HP41 H 13.268 -4.736 -4.480 1.00 . B A . 1038 D6M HP41 1 1 9 4682 2 2 1 . HP42 H 13.162 -4.725 -2.720 1.00 . B A . 1038 D6M HP42 1 1 9 4683 2 2 1 . HP51 H 13.133 -2.321 -4.539 1.00 . B A . 1038 D6M HP51 1 1 9 4684 2 2 1 . HP52 H 14.440 -2.815 -3.462 1.00 . B A . 1038 D6M HP52 1 1 9 4685 2 2 1 . HP61 H 13.204 -2.299 -1.537 1.00 . B A . 1038 D6M HP61 1 1 9 4686 2 2 1 . HP62 H 11.688 -2.208 -2.426 1.00 . B A . 1038 D6M HP62 1 1 9 4687 2 2 1 . HP71 H 13.969 -0.248 -2.433 1.00 . B A . 1038 D6M HP71 1 1 9 4688 2 2 1 . HP72 H 12.301 0.017 -1.934 1.00 . B A . 1038 D6M HP72 1 1 9 4689 2 2 1 . HP81 H 11.941 -0.752 -4.509 1.00 . B A . 1038 D6M HP81 1 1 9 4690 2 2 1 . HP82 H 13.494 0.072 -4.620 1.00 . B A . 1038 D6M HP82 1 1 9 4691 2 2 1 . HP91 H 10.810 1.170 -3.923 1.00 . B A . 1038 D6M HP91 1 1 9 4692 2 2 1 . HP92 H 12.045 1.817 -5.000 1.00 . B A . 1038 D6M HP92 1 1 9 4693 2 2 1 . HPA1 H 13.417 2.078 -2.782 1.00 . B A . 1038 D6M HPA1 1 1 9 4694 2 2 1 . HPA2 H 11.820 2.032 -2.035 1.00 . B A . 1038 D6M HPA2 1 1 9 4695 2 2 1 . HPB1 H 11.097 3.906 -3.408 1.00 . B A . 1038 D6M HPB1 1 1 9 4696 2 2 1 . HPB2 H 12.667 3.939 -4.213 1.00 . B A . 1038 D6M HPB2 1 1 9 4697 2 2 1 . HPC1 H 13.625 5.073 -2.537 1.00 . B A . 1038 D6M HPC1 1 1 9 4698 2 2 1 . HPC2 H 12.877 4.052 -1.308 1.00 . B A . 1038 D6M HPC2 1 1 9 4699 2 2 1 . HPD1 H 10.719 5.428 -2.111 1.00 . B A . 1038 D6M HPD1 1 1 9 4700 2 2 1 . HPD2 H 11.971 6.626 -2.445 1.00 . B A . 1038 D6M HPD2 1 1 9 4701 2 2 1 . HPE1 H 12.158 5.274 0.170 1.00 . B A . 1038 D6M HPE1 1 1 9 4702 2 2 1 . HPE2 H 10.769 6.340 -0.043 1.00 . B A . 1038 D6M HPE2 1 1 9 4703 2 2 1 . HPF1 H 13.647 7.123 -0.511 1.00 . B A . 1038 D6M HPF1 1 1 9 4704 2 2 1 . HPF2 H 12.703 7.514 0.931 1.00 . B A . 1038 D6M HPF2 1 1 9 4705 2 2 1 . HPG1 H 11.689 9.224 -0.073 1.00 . B A . 1038 D6M HPG1 1 1 9 4706 2 2 1 . HPG2 H 11.364 8.286 -1.530 1.00 . B A . 1038 D6M HPG2 1 1 9 4707 2 2 1 . HPG3 H 12.927 9.074 -1.320 1.00 . B A . 1038 D6M HPG3 1 1 9 4708 2 2 1 . HQ21 H 7.916 -0.924 -6.026 1.00 . B A . 1038 D6M HQ21 1 1 9 4709 2 2 1 . HQ22 H 6.966 -0.668 -7.488 1.00 . B A . 1038 D6M HQ22 1 1 9 4710 2 2 1 . HQ31 H 5.558 -2.464 -7.038 1.00 . B A . 1038 D6M HQ31 1 1 9 4711 2 2 1 . HQ32 H 6.012 -2.518 -5.342 1.00 . B A . 1038 D6M HQ32 1 1 9 4712 2 2 1 . N03 N 8.741 -3.061 -6.188 1.00 . B A . 1038 D6M N03 1 1 9 4713 2 2 1 . O01 O 8.919 -4.826 -4.848 1.00 . B A . 1038 D6M O01 1 1 9 4714 2 2 1 . O08 O 6.580 1.124 -5.367 1.00 . B A . 1038 D6M O08 1 1 9 4715 2 2 1 . O10 O 8.420 -3.344 -8.821 1.00 . B A . 1038 D6M O10 1 1 9 4716 2 2 1 . O11 O 6.462 -4.335 -8.661 1.00 . B A . 1038 D6M O11 1 1 10 4717 1 1 1 HIS C C -29.373 -2.106 -0.571 1.00 . A A . 7 HIS C 1 1 10 4718 1 1 1 HIS CA C -29.797 -3.530 -0.229 1.00 . A A . 7 HIS CA 1 1 10 4719 1 1 1 HIS CB C -28.611 -4.311 0.342 1.00 . A A . 7 HIS CB 1 1 10 4720 1 1 1 HIS CD2 C -28.504 -6.699 1.351 1.00 . A A . 7 HIS CD2 1 1 10 4721 1 1 1 HIS CE1 C -30.178 -6.528 2.756 1.00 . A A . 7 HIS CE1 1 1 10 4722 1 1 1 HIS CG C -29.014 -5.450 1.226 1.00 . A A . 7 HIS CG 1 1 10 4723 1 1 1 HIS H1 H -29.558 -4.208 -2.157 1.00 . A A . 7 HIS H1 1 1 10 4724 1 1 1 HIS H2 H -30.505 -5.226 -1.154 1.00 . A A . 7 HIS H2 1 1 10 4725 1 1 1 HIS H3 H -31.164 -3.757 -1.750 1.00 . A A . 7 HIS H3 1 1 10 4726 1 1 1 HIS HA H -30.586 -3.495 0.507 1.00 . A A . 7 HIS HA 1 1 10 4727 1 1 1 HIS HB2 H -28.029 -4.714 -0.473 1.00 . A A . 7 HIS HB2 1 1 10 4728 1 1 1 HIS HB3 H -27.994 -3.641 0.922 1.00 . A A . 7 HIS HB3 1 1 10 4729 1 1 1 HIS HD1 H -30.636 -4.595 2.266 1.00 . A A . 7 HIS HD1 1 1 10 4730 1 1 1 HIS HD2 H -27.669 -7.108 0.799 1.00 . A A . 7 HIS HD2 1 1 10 4731 1 1 1 HIS HE1 H -30.912 -6.761 3.514 1.00 . A A . 7 HIS HE1 1 1 10 4732 1 1 1 HIS HE2 H -29.160 -8.293 2.548 1.00 . A A . 7 HIS HE2 1 1 10 4733 1 1 1 HIS N N -30.301 -4.245 -1.431 1.00 . A A . 7 HIS N 1 1 10 4734 1 1 1 HIS ND1 N -30.062 -5.376 2.119 1.00 . A A . 7 HIS ND1 1 1 10 4735 1 1 1 HIS NE2 N -29.245 -7.347 2.307 1.00 . A A . 7 HIS NE2 1 1 10 4736 1 1 1 HIS O O -28.771 -1.861 -1.617 1.00 . A A . 7 HIS O 1 1 10 4737 1 1 2 ALA C C -28.087 0.604 0.895 1.00 . A A . 8 ALA C 1 1 10 4738 1 1 2 ALA CA C -29.339 0.229 0.110 1.00 . A A . 8 ALA CA 1 1 10 4739 1 1 2 ALA CB C -30.501 1.128 0.505 1.00 . A A . 8 ALA CB 1 1 10 4740 1 1 2 ALA H H -30.168 -1.428 1.134 1.00 . A A . 8 ALA H 1 1 10 4741 1 1 2 ALA HA H -29.147 0.371 -0.944 1.00 . A A . 8 ALA HA 1 1 10 4742 1 1 2 ALA HB1 H -30.913 0.791 1.445 1.00 . A A . 8 ALA HB1 1 1 10 4743 1 1 2 ALA HB2 H -30.150 2.145 0.610 1.00 . A A . 8 ALA HB2 1 1 10 4744 1 1 2 ALA HB3 H -31.265 1.088 -0.258 1.00 . A A . 8 ALA HB3 1 1 10 4745 1 1 2 ALA N N -29.689 -1.170 0.318 1.00 . A A . 8 ALA N 1 1 10 4746 1 1 2 ALA O O -28.169 1.035 2.045 1.00 . A A . 8 ALA O 1 1 10 4747 1 1 3 GLU C C -24.559 0.950 -0.140 1.00 . A A . 9 GLU C 1 1 10 4748 1 1 3 GLU CA C -25.658 0.761 0.902 1.00 . A A . 9 GLU CA 1 1 10 4749 1 1 3 GLU CB C -25.264 -0.344 1.885 1.00 . A A . 9 GLU CB 1 1 10 4750 1 1 3 GLU CD C -24.608 1.101 3.850 1.00 . A A . 9 GLU CD 1 1 10 4751 1 1 3 GLU CG C -25.529 0.011 3.339 1.00 . A A . 9 GLU CG 1 1 10 4752 1 1 3 GLU H H -26.930 0.094 -0.653 1.00 . A A . 9 GLU H 1 1 10 4753 1 1 3 GLU HA H -25.785 1.686 1.445 1.00 . A A . 9 GLU HA 1 1 10 4754 1 1 3 GLU HB2 H -25.823 -1.237 1.648 1.00 . A A . 9 GLU HB2 1 1 10 4755 1 1 3 GLU HB3 H -24.210 -0.551 1.775 1.00 . A A . 9 GLU HB3 1 1 10 4756 1 1 3 GLU HG2 H -26.550 0.350 3.433 1.00 . A A . 9 GLU HG2 1 1 10 4757 1 1 3 GLU HG3 H -25.388 -0.873 3.943 1.00 . A A . 9 GLU HG3 1 1 10 4758 1 1 3 GLU N N -26.929 0.440 0.264 1.00 . A A . 9 GLU N 1 1 10 4759 1 1 3 GLU O O -24.817 0.903 -1.343 1.00 . A A . 9 GLU O 1 1 10 4760 1 1 3 GLU OE1 O -24.674 2.231 3.322 1.00 . A A . 9 GLU OE1 1 1 10 4761 1 1 3 GLU OE2 O -23.819 0.824 4.778 1.00 . A A . 9 GLU OE2 1 1 10 4762 1 1 4 GLY C C -20.977 0.600 -0.134 1.00 . A A . 10 GLY C 1 1 10 4763 1 1 4 GLY CA C -22.215 1.355 -0.573 1.00 . A A . 10 GLY CA 1 1 10 4764 1 1 4 GLY H H -23.189 1.189 1.300 1.00 . A A . 10 GLY H 1 1 10 4765 1 1 4 GLY HA2 H -22.500 1.016 -1.558 1.00 . A A . 10 GLY HA2 1 1 10 4766 1 1 4 GLY HA3 H -21.983 2.409 -0.621 1.00 . A A . 10 GLY HA3 1 1 10 4767 1 1 4 GLY N N -23.334 1.163 0.331 1.00 . A A . 10 GLY N 1 1 10 4768 1 1 4 GLY O O -20.962 -0.014 0.933 1.00 . A A . 10 GLY O 1 1 10 4769 1 1 5 THR C C -17.875 0.745 0.376 1.00 . A A . 11 THR C 1 1 10 4770 1 1 5 THR CA C -18.686 -0.040 -0.649 1.00 . A A . 11 THR CA 1 1 10 4771 1 1 5 THR CB C -17.863 -0.241 -1.922 1.00 . A A . 11 THR CB 1 1 10 4772 1 1 5 THR CG2 C -17.088 -1.541 -1.933 1.00 . A A . 11 THR CG2 1 1 10 4773 1 1 5 THR H H -20.008 1.152 -1.794 1.00 . A A . 11 THR H 1 1 10 4774 1 1 5 THR HA H -18.932 -1.005 -0.234 1.00 . A A . 11 THR HA 1 1 10 4775 1 1 5 THR HB H -17.153 0.568 -2.012 1.00 . A A . 11 THR HB 1 1 10 4776 1 1 5 THR HG1 H -18.159 -0.276 -3.858 1.00 . A A . 11 THR HG1 1 1 10 4777 1 1 5 THR HG21 H -17.751 -2.357 -1.686 1.00 . A A . 11 THR HG21 1 1 10 4778 1 1 5 THR HG22 H -16.669 -1.702 -2.915 1.00 . A A . 11 THR HG22 1 1 10 4779 1 1 5 THR HG23 H -16.292 -1.491 -1.206 1.00 . A A . 11 THR HG23 1 1 10 4780 1 1 5 THR N N -19.935 0.645 -0.958 1.00 . A A . 11 THR N 1 1 10 4781 1 1 5 THR O O -18.147 1.919 0.631 1.00 . A A . 11 THR O 1 1 10 4782 1 1 5 THR OG1 O -18.699 -0.228 -3.066 1.00 . A A . 11 THR OG1 1 1 10 4783 1 1 6 PHE C C -14.822 -0.145 2.291 1.00 . A A . 12 PHE C 1 1 10 4784 1 1 6 PHE CA C -16.027 0.729 1.960 1.00 . A A . 12 PHE CA 1 1 10 4785 1 1 6 PHE CB C -16.826 1.019 3.232 1.00 . A A . 12 PHE CB 1 1 10 4786 1 1 6 PHE CD1 C -15.354 2.927 3.931 1.00 . A A . 12 PHE CD1 1 1 10 4787 1 1 6 PHE CD2 C -16.011 1.338 5.584 1.00 . A A . 12 PHE CD2 1 1 10 4788 1 1 6 PHE CE1 C -14.638 3.626 4.884 1.00 . A A . 12 PHE CE1 1 1 10 4789 1 1 6 PHE CE2 C -15.296 2.033 6.541 1.00 . A A . 12 PHE CE2 1 1 10 4790 1 1 6 PHE CG C -16.047 1.776 4.270 1.00 . A A . 12 PHE CG 1 1 10 4791 1 1 6 PHE CZ C -14.609 3.179 6.191 1.00 . A A . 12 PHE CZ 1 1 10 4792 1 1 6 PHE H H -16.709 -0.843 0.718 1.00 . A A . 12 PHE H 1 1 10 4793 1 1 6 PHE HA H -15.676 1.663 1.547 1.00 . A A . 12 PHE HA 1 1 10 4794 1 1 6 PHE HB2 H -17.696 1.604 2.977 1.00 . A A . 12 PHE HB2 1 1 10 4795 1 1 6 PHE HB3 H -17.143 0.083 3.670 1.00 . A A . 12 PHE HB3 1 1 10 4796 1 1 6 PHE HD1 H -15.376 3.278 2.910 1.00 . A A . 12 PHE HD1 1 1 10 4797 1 1 6 PHE HD2 H -16.547 0.442 5.858 1.00 . A A . 12 PHE HD2 1 1 10 4798 1 1 6 PHE HE1 H -14.101 4.522 4.607 1.00 . A A . 12 PHE HE1 1 1 10 4799 1 1 6 PHE HE2 H -15.275 1.681 7.562 1.00 . A A . 12 PHE HE2 1 1 10 4800 1 1 6 PHE HZ H -14.050 3.724 6.937 1.00 . A A . 12 PHE HZ 1 1 10 4801 1 1 6 PHE N N -16.877 0.091 0.962 1.00 . A A . 12 PHE N 1 1 10 4802 1 1 6 PHE O O -13.702 0.348 2.423 1.00 . A A . 12 PHE O 1 1 10 4803 1 1 7 THR C C -12.878 -2.327 1.703 1.00 . A A . 13 THR C 1 1 10 4804 1 1 7 THR CA C -13.992 -2.390 2.743 1.00 . A A . 13 THR CA 1 1 10 4805 1 1 7 THR CB C -14.549 -3.813 2.824 1.00 . A A . 13 THR CB 1 1 10 4806 1 1 7 THR CG2 C -15.603 -3.983 3.897 1.00 . A A . 13 THR CG2 1 1 10 4807 1 1 7 THR H H -15.973 -1.780 2.310 1.00 . A A . 13 THR H 1 1 10 4808 1 1 7 THR HA H -13.585 -2.118 3.705 1.00 . A A . 13 THR HA 1 1 10 4809 1 1 7 THR HB H -13.740 -4.493 3.044 1.00 . A A . 13 THR HB 1 1 10 4810 1 1 7 THR HG1 H -14.622 -4.915 1.207 1.00 . A A . 13 THR HG1 1 1 10 4811 1 1 7 THR HG21 H -15.334 -3.395 4.762 1.00 . A A . 13 THR HG21 1 1 10 4812 1 1 7 THR HG22 H -16.559 -3.651 3.519 1.00 . A A . 13 THR HG22 1 1 10 4813 1 1 7 THR HG23 H -15.668 -5.024 4.176 1.00 . A A . 13 THR HG23 1 1 10 4814 1 1 7 THR N N -15.059 -1.447 2.426 1.00 . A A . 13 THR N 1 1 10 4815 1 1 7 THR O O -11.772 -1.869 1.990 1.00 . A A . 13 THR O 1 1 10 4816 1 1 7 THR OG1 O -15.129 -4.195 1.589 1.00 . A A . 13 THR OG1 1 1 10 4817 1 1 8 SER C C -12.155 -1.429 -1.285 1.00 . A A . 14 SER C 1 1 10 4818 1 1 8 SER CA C -12.200 -2.788 -0.590 1.00 . A A . 14 SER CA 1 1 10 4819 1 1 8 SER CB C -12.533 -3.881 -1.606 1.00 . A A . 14 SER CB 1 1 10 4820 1 1 8 SER H H -14.076 -3.144 0.326 1.00 . A A . 14 SER H 1 1 10 4821 1 1 8 SER HA H -11.231 -2.991 -0.161 1.00 . A A . 14 SER HA 1 1 10 4822 1 1 8 SER HB2 H -13.538 -3.735 -1.974 1.00 . A A . 14 SER HB2 1 1 10 4823 1 1 8 SER HB3 H -11.837 -3.828 -2.430 1.00 . A A . 14 SER HB3 1 1 10 4824 1 1 8 SER HG H -13.091 -5.240 -0.309 1.00 . A A . 14 SER HG 1 1 10 4825 1 1 8 SER N N -13.177 -2.791 0.494 1.00 . A A . 14 SER N 1 1 10 4826 1 1 8 SER O O -11.154 -1.076 -1.909 1.00 . A A . 14 SER O 1 1 10 4827 1 1 8 SER OG O -12.448 -5.168 -1.018 1.00 . A A . 14 SER OG 1 1 10 4828 1 1 9 ASP C C -12.165 1.536 -1.355 1.00 . A A . 15 ASP C 1 1 10 4829 1 1 9 ASP CA C -13.325 0.646 -1.797 1.00 . A A . 15 ASP CA 1 1 10 4830 1 1 9 ASP CB C -14.656 1.314 -1.449 1.00 . A A . 15 ASP CB 1 1 10 4831 1 1 9 ASP CG C -15.250 2.068 -2.623 1.00 . A A . 15 ASP CG 1 1 10 4832 1 1 9 ASP H H -14.011 -1.007 -0.668 1.00 . A A . 15 ASP H 1 1 10 4833 1 1 9 ASP HA H -13.270 0.511 -2.867 1.00 . A A . 15 ASP HA 1 1 10 4834 1 1 9 ASP HB2 H -15.361 0.558 -1.138 1.00 . A A . 15 ASP HB2 1 1 10 4835 1 1 9 ASP HB3 H -14.501 2.011 -0.638 1.00 . A A . 15 ASP HB3 1 1 10 4836 1 1 9 ASP N N -13.243 -0.672 -1.176 1.00 . A A . 15 ASP N 1 1 10 4837 1 1 9 ASP O O -11.724 2.411 -2.100 1.00 . A A . 15 ASP O 1 1 10 4838 1 1 9 ASP OD1 O -15.736 1.409 -3.566 1.00 . A A . 15 ASP OD1 1 1 10 4839 1 1 9 ASP OD2 O -15.229 3.316 -2.600 1.00 . A A . 15 ASP OD2 1 1 10 4840 1 1 10 VAL C C -9.232 1.585 -0.133 1.00 . A A . 16 VAL C 1 1 10 4841 1 1 10 VAL CA C -10.571 2.089 0.397 1.00 . A A . 16 VAL CA 1 1 10 4842 1 1 10 VAL CB C -10.549 2.052 1.937 1.00 . A A . 16 VAL CB 1 1 10 4843 1 1 10 VAL CG1 C -9.473 2.980 2.480 1.00 . A A . 16 VAL CG1 1 1 10 4844 1 1 10 VAL CG2 C -11.913 2.420 2.500 1.00 . A A . 16 VAL CG2 1 1 10 4845 1 1 10 VAL H H -12.071 0.596 0.408 1.00 . A A . 16 VAL H 1 1 10 4846 1 1 10 VAL HA H -10.706 3.115 0.085 1.00 . A A . 16 VAL HA 1 1 10 4847 1 1 10 VAL HB H -10.314 1.045 2.249 1.00 . A A . 16 VAL HB 1 1 10 4848 1 1 10 VAL HG11 H -8.766 3.209 1.695 1.00 . A A . 16 VAL HG11 1 1 10 4849 1 1 10 VAL HG12 H -9.929 3.894 2.830 1.00 . A A . 16 VAL HG12 1 1 10 4850 1 1 10 VAL HG13 H -8.959 2.497 3.298 1.00 . A A . 16 VAL HG13 1 1 10 4851 1 1 10 VAL HG21 H -12.666 2.288 1.737 1.00 . A A . 16 VAL HG21 1 1 10 4852 1 1 10 VAL HG22 H -12.139 1.783 3.342 1.00 . A A . 16 VAL HG22 1 1 10 4853 1 1 10 VAL HG23 H -11.903 3.451 2.821 1.00 . A A . 16 VAL HG23 1 1 10 4854 1 1 10 VAL N N -11.677 1.307 -0.140 1.00 . A A . 16 VAL N 1 1 10 4855 1 1 10 VAL O O -8.546 2.281 -0.880 1.00 . A A . 16 VAL O 1 1 10 4856 1 1 11 SER C C -7.438 -0.119 -1.693 1.00 . A A . 17 SER C 1 1 10 4857 1 1 11 SER CA C -7.607 -0.231 -0.179 1.00 . A A . 17 SER CA 1 1 10 4858 1 1 11 SER CB C -7.544 -1.700 0.244 1.00 . A A . 17 SER CB 1 1 10 4859 1 1 11 SER H H -9.454 -0.141 0.853 1.00 . A A . 17 SER H 1 1 10 4860 1 1 11 SER HA H -6.802 0.306 0.300 1.00 . A A . 17 SER HA 1 1 10 4861 1 1 11 SER HB2 H -7.829 -2.325 -0.589 1.00 . A A . 17 SER HB2 1 1 10 4862 1 1 11 SER HB3 H -6.536 -1.942 0.548 1.00 . A A . 17 SER HB3 1 1 10 4863 1 1 11 SER HG H -8.044 -1.603 2.136 1.00 . A A . 17 SER HG 1 1 10 4864 1 1 11 SER N N -8.865 0.368 0.258 1.00 . A A . 17 SER N 1 1 10 4865 1 1 11 SER O O -6.318 -0.102 -2.203 1.00 . A A . 17 SER O 1 1 10 4866 1 1 11 SER OG O -8.421 -1.957 1.327 1.00 . A A . 17 SER OG 1 1 10 4867 1 1 12 SER C C -7.876 1.364 -4.307 1.00 . A A . 18 SER C 1 1 10 4868 1 1 12 SER CA C -8.535 0.062 -3.858 1.00 . A A . 18 SER CA 1 1 10 4869 1 1 12 SER CB C -9.956 -0.021 -4.418 1.00 . A A . 18 SER CB 1 1 10 4870 1 1 12 SER H H -9.422 -0.068 -1.943 1.00 . A A . 18 SER H 1 1 10 4871 1 1 12 SER HA H -7.959 -0.768 -4.242 1.00 . A A . 18 SER HA 1 1 10 4872 1 1 12 SER HB2 H -10.653 0.346 -3.680 1.00 . A A . 18 SER HB2 1 1 10 4873 1 1 12 SER HB3 H -10.024 0.583 -5.311 1.00 . A A . 18 SER HB3 1 1 10 4874 1 1 12 SER HG H -10.744 -1.375 -5.594 1.00 . A A . 18 SER HG 1 1 10 4875 1 1 12 SER N N -8.558 -0.046 -2.405 1.00 . A A . 18 SER N 1 1 10 4876 1 1 12 SER O O -7.292 1.431 -5.388 1.00 . A A . 18 SER O 1 1 10 4877 1 1 12 SER OG O -10.299 -1.357 -4.744 1.00 . A A . 18 SER OG 1 1 10 4878 1 1 13 TYR C C -5.949 3.787 -3.308 1.00 . A A . 19 TYR C 1 1 10 4879 1 1 13 TYR CA C -7.389 3.693 -3.808 1.00 . A A . 19 TYR CA 1 1 10 4880 1 1 13 TYR CB C -8.246 4.838 -3.237 1.00 . A A . 19 TYR CB 1 1 10 4881 1 1 13 TYR CD1 C -6.715 6.023 -1.606 1.00 . A A . 19 TYR CD1 1 1 10 4882 1 1 13 TYR CD2 C -8.681 4.982 -0.750 1.00 . A A . 19 TYR CD2 1 1 10 4883 1 1 13 TYR CE1 C -6.375 6.439 -0.333 1.00 . A A . 19 TYR CE1 1 1 10 4884 1 1 13 TYR CE2 C -8.349 5.397 0.526 1.00 . A A . 19 TYR CE2 1 1 10 4885 1 1 13 TYR CG C -7.871 5.286 -1.837 1.00 . A A . 19 TYR CG 1 1 10 4886 1 1 13 TYR CZ C -7.196 6.124 0.729 1.00 . A A . 19 TYR CZ 1 1 10 4887 1 1 13 TYR H H -8.456 2.292 -2.629 1.00 . A A . 19 TYR H 1 1 10 4888 1 1 13 TYR HA H -7.379 3.775 -4.885 1.00 . A A . 19 TYR HA 1 1 10 4889 1 1 13 TYR HB2 H -8.159 5.695 -3.887 1.00 . A A . 19 TYR HB2 1 1 10 4890 1 1 13 TYR HB3 H -9.279 4.519 -3.214 1.00 . A A . 19 TYR HB3 1 1 10 4891 1 1 13 TYR HD1 H -9.582 4.410 -0.912 1.00 . A A . 19 TYR HD1 1 1 10 4892 1 1 13 TYR HD2 H -6.075 6.270 -2.440 1.00 . A A . 19 TYR HD2 1 1 10 4893 1 1 13 TYR HE1 H -8.992 5.150 1.357 1.00 . A A . 19 TYR HE1 1 1 10 4894 1 1 13 TYR HE2 H -5.472 7.010 -0.175 1.00 . A A . 19 TYR HE2 1 1 10 4895 1 1 13 TYR HH H -5.987 6.212 2.222 1.00 . A A . 19 TYR HH 1 1 10 4896 1 1 13 TYR N N -7.976 2.399 -3.477 1.00 . A A . 19 TYR N 1 1 10 4897 1 1 13 TYR O O -5.126 4.493 -3.890 1.00 . A A . 19 TYR O 1 1 10 4898 1 1 13 TYR OH O -6.862 6.538 1.998 1.00 . A A . 19 TYR OH 1 1 10 4899 1 1 14 LEU C C -3.353 2.234 -2.491 1.00 . A A . 20 LEU C 1 1 10 4900 1 1 14 LEU CA C -4.308 3.084 -1.655 1.00 . A A . 20 LEU CA 1 1 10 4901 1 1 14 LEU CB C -4.339 2.578 -0.210 1.00 . A A . 20 LEU CB 1 1 10 4902 1 1 14 LEU CD1 C -6.335 3.269 1.141 1.00 . A A . 20 LEU CD1 1 1 10 4903 1 1 14 LEU CD2 C -4.035 3.556 2.080 1.00 . A A . 20 LEU CD2 1 1 10 4904 1 1 14 LEU CG C -4.882 3.576 0.816 1.00 . A A . 20 LEU CG 1 1 10 4905 1 1 14 LEU H H -6.348 2.530 -1.803 1.00 . A A . 20 LEU H 1 1 10 4906 1 1 14 LEU HA H -3.957 4.105 -1.660 1.00 . A A . 20 LEU HA 1 1 10 4907 1 1 14 LEU HB2 H -4.951 1.688 -0.176 1.00 . A A . 20 LEU HB2 1 1 10 4908 1 1 14 LEU HB3 H -3.332 2.312 0.077 1.00 . A A . 20 LEU HB3 1 1 10 4909 1 1 14 LEU HD11 H -6.413 2.263 1.525 1.00 . A A . 20 LEU HD11 1 1 10 4910 1 1 14 LEU HD12 H -6.693 3.967 1.884 1.00 . A A . 20 LEU HD12 1 1 10 4911 1 1 14 LEU HD13 H -6.931 3.360 0.245 1.00 . A A . 20 LEU HD13 1 1 10 4912 1 1 14 LEU HD21 H -3.043 3.201 1.844 1.00 . A A . 20 LEU HD21 1 1 10 4913 1 1 14 LEU HD22 H -3.974 4.554 2.488 1.00 . A A . 20 LEU HD22 1 1 10 4914 1 1 14 LEU HD23 H -4.489 2.897 2.807 1.00 . A A . 20 LEU HD23 1 1 10 4915 1 1 14 LEU HG H -4.836 4.571 0.398 1.00 . A A . 20 LEU HG 1 1 10 4916 1 1 14 LEU N N -5.650 3.074 -2.226 1.00 . A A . 20 LEU N 1 1 10 4917 1 1 14 LEU O O -2.643 2.752 -3.353 1.00 . A A . 20 LEU O 1 1 10 4918 1 1 15 GLU C C -2.466 -1.369 -2.302 1.00 . A A . 21 GLU C 1 1 10 4919 1 1 15 GLU CA C -2.470 0.006 -2.963 1.00 . A A . 21 GLU CA 1 1 10 4920 1 1 15 GLU CB C -1.040 0.554 -3.033 1.00 . A A . 21 GLU CB 1 1 10 4921 1 1 15 GLU CD C -0.709 -0.209 -5.417 1.00 . A A . 21 GLU CD 1 1 10 4922 1 1 15 GLU CG C -0.605 0.942 -4.436 1.00 . A A . 21 GLU CG 1 1 10 4923 1 1 15 GLU H H -3.928 0.572 -1.536 1.00 . A A . 21 GLU H 1 1 10 4924 1 1 15 GLU HA H -2.858 -0.092 -3.966 1.00 . A A . 21 GLU HA 1 1 10 4925 1 1 15 GLU HB2 H -0.972 1.429 -2.403 1.00 . A A . 21 GLU HB2 1 1 10 4926 1 1 15 GLU HB3 H -0.358 -0.197 -2.663 1.00 . A A . 21 GLU HB3 1 1 10 4927 1 1 15 GLU HG2 H -1.233 1.749 -4.784 1.00 . A A . 21 GLU HG2 1 1 10 4928 1 1 15 GLU HG3 H 0.422 1.276 -4.402 1.00 . A A . 21 GLU HG3 1 1 10 4929 1 1 15 GLU N N -3.339 0.927 -2.234 1.00 . A A . 21 GLU N 1 1 10 4930 1 1 15 GLU O O -2.896 -2.358 -2.896 1.00 . A A . 21 GLU O 1 1 10 4931 1 1 15 GLU OE1 O 0.013 -1.211 -5.235 1.00 . A A . 21 GLU OE1 1 1 10 4932 1 1 15 GLU OE2 O -1.513 -0.108 -6.369 1.00 . A A . 21 GLU OE2 1 1 10 4933 1 1 16 GLY C C -1.111 -2.569 0.935 1.00 . A A . 22 GLY C 1 1 10 4934 1 1 16 GLY CA C -1.920 -2.677 -0.342 1.00 . A A . 22 GLY CA 1 1 10 4935 1 1 16 GLY H H -1.645 -0.600 -0.647 1.00 . A A . 22 GLY H 1 1 10 4936 1 1 16 GLY HA2 H -2.926 -2.981 -0.094 1.00 . A A . 22 GLY HA2 1 1 10 4937 1 1 16 GLY HA3 H -1.473 -3.428 -0.976 1.00 . A A . 22 GLY HA3 1 1 10 4938 1 1 16 GLY N N -1.974 -1.422 -1.068 1.00 . A A . 22 GLY N 1 1 10 4939 1 1 16 GLY O O -0.839 -1.468 1.414 1.00 . A A . 22 GLY O 1 1 10 4940 1 1 17 GLN C C 1.553 -3.711 2.416 1.00 . A A . 23 GLN C 1 1 10 4941 1 1 17 GLN CA C 0.058 -3.739 2.719 1.00 . A A . 23 GLN CA 1 1 10 4942 1 1 17 GLN CB C -0.285 -4.983 3.541 1.00 . A A . 23 GLN CB 1 1 10 4943 1 1 17 GLN CD C -0.460 -6.001 5.846 1.00 . A A . 23 GLN CD 1 1 10 4944 1 1 17 GLN CG C -0.351 -4.724 5.037 1.00 . A A . 23 GLN CG 1 1 10 4945 1 1 17 GLN H H -0.971 -4.560 1.061 1.00 . A A . 23 GLN H 1 1 10 4946 1 1 17 GLN HA H -0.197 -2.860 3.291 1.00 . A A . 23 GLN HA 1 1 10 4947 1 1 17 GLN HB2 H -1.246 -5.358 3.220 1.00 . A A . 23 GLN HB2 1 1 10 4948 1 1 17 GLN HB3 H 0.465 -5.739 3.361 1.00 . A A . 23 GLN HB3 1 1 10 4949 1 1 17 GLN HE21 H 1.467 -6.386 5.546 1.00 . A A . 23 GLN HE21 1 1 10 4950 1 1 17 GLN HE22 H 0.609 -7.548 6.493 1.00 . A A . 23 GLN HE22 1 1 10 4951 1 1 17 GLN HG2 H 0.545 -4.201 5.339 1.00 . A A . 23 GLN HG2 1 1 10 4952 1 1 17 GLN HG3 H -1.213 -4.108 5.245 1.00 . A A . 23 GLN HG3 1 1 10 4953 1 1 17 GLN N N -0.724 -3.713 1.489 1.00 . A A . 23 GLN N 1 1 10 4954 1 1 17 GLN NE2 N 0.651 -6.717 5.975 1.00 . A A . 23 GLN NE2 1 1 10 4955 1 1 17 GLN O O 2.319 -3.016 3.084 1.00 . A A . 23 GLN O 1 1 10 4956 1 1 17 GLN OE1 O -1.531 -6.340 6.351 1.00 . A A . 23 GLN OE1 1 1 10 4957 1 1 18 ALA C C 3.863 -3.180 0.519 1.00 . A A . 24 ALA C 1 1 10 4958 1 1 18 ALA CA C 3.365 -4.534 1.016 1.00 . A A . 24 ALA CA 1 1 10 4959 1 1 18 ALA CB C 3.568 -5.597 -0.053 1.00 . A A . 24 ALA CB 1 1 10 4960 1 1 18 ALA H H 1.304 -5.004 0.912 1.00 . A A . 24 ALA H 1 1 10 4961 1 1 18 ALA HA H 3.939 -4.820 1.886 1.00 . A A . 24 ALA HA 1 1 10 4962 1 1 18 ALA HB1 H 3.039 -6.496 0.227 1.00 . A A . 24 ALA HB1 1 1 10 4963 1 1 18 ALA HB2 H 3.188 -5.235 -0.997 1.00 . A A . 24 ALA HB2 1 1 10 4964 1 1 18 ALA HB3 H 4.622 -5.814 -0.150 1.00 . A A . 24 ALA HB3 1 1 10 4965 1 1 18 ALA N N 1.962 -4.472 1.406 1.00 . A A . 24 ALA N 1 1 10 4966 1 1 18 ALA O O 5.056 -2.884 0.590 1.00 . A A . 24 ALA O 1 1 10 4967 1 1 19 ALA C C 4.043 -0.223 0.556 1.00 . A A . 25 ALA C 1 1 10 4968 1 1 19 ALA CA C 3.291 -1.038 -0.492 1.00 . A A . 25 ALA CA 1 1 10 4969 1 1 19 ALA CB C 2.035 -0.301 -0.937 1.00 . A A . 25 ALA CB 1 1 10 4970 1 1 19 ALA H H 2.009 -2.653 -0.013 1.00 . A A . 25 ALA H 1 1 10 4971 1 1 19 ALA HA H 3.927 -1.170 -1.355 1.00 . A A . 25 ALA HA 1 1 10 4972 1 1 19 ALA HB1 H 1.168 -0.776 -0.504 1.00 . A A . 25 ALA HB1 1 1 10 4973 1 1 19 ALA HB2 H 2.084 0.727 -0.610 1.00 . A A . 25 ALA HB2 1 1 10 4974 1 1 19 ALA HB3 H 1.962 -0.333 -2.015 1.00 . A A . 25 ALA HB3 1 1 10 4975 1 1 19 ALA N N 2.943 -2.361 0.017 1.00 . A A . 25 ALA N 1 1 10 4976 1 1 19 ALA O O 5.008 0.473 0.245 1.00 . A A . 25 ALA O 1 1 10 4977 1 1 20 LYS C C 5.332 -0.415 3.542 1.00 . A A . 26 LYS C 1 1 10 4978 1 1 20 LYS CA C 4.227 0.417 2.893 1.00 . A A . 26 LYS CA 1 1 10 4979 1 1 20 LYS CB C 3.178 0.817 3.937 1.00 . A A . 26 LYS CB 1 1 10 4980 1 1 20 LYS CD C 3.496 3.246 3.243 1.00 . A A . 26 LYS CD 1 1 10 4981 1 1 20 LYS CE C 2.536 3.013 2.083 1.00 . A A . 26 LYS CE 1 1 10 4982 1 1 20 LYS CG C 3.265 2.271 4.396 1.00 . A A . 26 LYS CG 1 1 10 4983 1 1 20 LYS HA H 4.668 1.308 2.478 1.00 . A A . 26 LYS HA 1 1 10 4984 1 1 20 LYS HB2 H 2.196 0.655 3.520 1.00 . A A . 26 LYS HB2 1 1 10 4985 1 1 20 LYS HD2 H 3.357 4.252 3.608 1.00 . A A . 26 LYS HD2 1 1 10 4986 1 1 20 LYS HE2 H 1.961 2.121 2.277 1.00 . A A . 26 LYS HE2 1 1 10 4987 1 1 20 LYS HG2 H 2.342 2.534 4.888 1.00 . A A . 26 LYS HG2 1 1 10 4988 1 1 20 LYS HZ1 H 4.019 2.256 0.798 1.00 . A A . 26 LYS HZ1 1 1 10 4989 1 1 20 LYS N N 3.595 -0.312 1.800 1.00 . A A . 26 LYS N 1 1 10 4990 1 1 20 LYS NZ N 3.243 2.855 0.814 1.00 . A A . 26 LYS NZ 1 1 10 4991 1 1 20 LYS O O 6.202 0.120 4.228 1.00 . A A . 26 LYS O 1 1 10 4992 1 1 21 GLU C C 7.652 -2.449 3.253 1.00 . A A . 27 GLU C 1 1 10 4993 1 1 21 GLU CA C 6.280 -2.627 3.905 1.00 . A A . 27 GLU CA 1 1 10 4994 1 1 21 GLU CB C 5.821 -4.079 3.757 1.00 . A A . 27 GLU CB 1 1 10 4995 1 1 21 GLU CD C 5.064 -5.934 5.296 1.00 . A A . 27 GLU CD 1 1 10 4996 1 1 21 GLU CG C 6.168 -4.953 4.952 1.00 . A A . 27 GLU CG 1 1 10 4997 1 1 21 GLU H H 4.566 -2.099 2.784 1.00 . A A . 27 GLU H 1 1 10 4998 1 1 21 GLU HA H 6.365 -2.396 4.956 1.00 . A A . 27 GLU HA 1 1 10 4999 1 1 21 GLU HB2 H 4.749 -4.094 3.627 1.00 . A A . 27 GLU HB2 1 1 10 5000 1 1 21 GLU HB3 H 6.287 -4.504 2.880 1.00 . A A . 27 GLU HB3 1 1 10 5001 1 1 21 GLU HG2 H 7.065 -5.510 4.726 1.00 . A A . 27 GLU HG2 1 1 10 5002 1 1 21 GLU HG3 H 6.345 -4.317 5.807 1.00 . A A . 27 GLU HG3 1 1 10 5003 1 1 21 GLU N N 5.287 -1.726 3.332 1.00 . A A . 27 GLU N 1 1 10 5004 1 1 21 GLU O O 8.672 -2.813 3.838 1.00 . A A . 27 GLU O 1 1 10 5005 1 1 21 GLU OE1 O 3.879 -5.573 5.138 1.00 . A A . 27 GLU OE1 1 1 10 5006 1 1 21 GLU OE2 O 5.385 -7.062 5.724 1.00 . A A . 27 GLU OE2 1 1 10 5007 1 1 22 PHE C C 9.552 -0.331 1.647 1.00 . A A . 28 PHE C 1 1 10 5008 1 1 22 PHE CA C 8.941 -1.697 1.331 1.00 . A A . 28 PHE CA 1 1 10 5009 1 1 22 PHE CB C 8.745 -1.864 -0.187 1.00 . A A . 28 PHE CB 1 1 10 5010 1 1 22 PHE CD1 C 8.788 0.523 -0.976 1.00 . A A . 28 PHE CD1 1 1 10 5011 1 1 22 PHE CD2 C 6.845 -0.781 -1.426 1.00 . A A . 28 PHE CD2 1 1 10 5012 1 1 22 PHE CE1 C 8.214 1.607 -1.605 1.00 . A A . 28 PHE CE1 1 1 10 5013 1 1 22 PHE CE2 C 6.266 0.302 -2.060 1.00 . A A . 28 PHE CE2 1 1 10 5014 1 1 22 PHE CG C 8.112 -0.682 -0.875 1.00 . A A . 28 PHE CG 1 1 10 5015 1 1 22 PHE CZ C 6.951 1.498 -2.148 1.00 . A A . 28 PHE CZ 1 1 10 5016 1 1 22 PHE H H 6.839 -1.632 1.612 1.00 . A A . 28 PHE H 1 1 10 5017 1 1 22 PHE HA H 9.626 -2.459 1.673 1.00 . A A . 28 PHE HA 1 1 10 5018 1 1 22 PHE HB2 H 9.707 -2.031 -0.647 1.00 . A A . 28 PHE HB2 1 1 10 5019 1 1 22 PHE HB3 H 8.118 -2.725 -0.365 1.00 . A A . 28 PHE HB3 1 1 10 5020 1 1 22 PHE HD1 H 6.306 -1.714 -1.354 1.00 . A A . 28 PHE HD1 1 1 10 5021 1 1 22 PHE HD2 H 9.777 0.611 -0.555 1.00 . A A . 28 PHE HD2 1 1 10 5022 1 1 22 PHE HE1 H 5.278 0.212 -2.487 1.00 . A A . 28 PHE HE1 1 1 10 5023 1 1 22 PHE HE2 H 8.754 2.541 -1.670 1.00 . A A . 28 PHE HE2 1 1 10 5024 1 1 22 PHE HZ H 6.500 2.344 -2.643 1.00 . A A . 28 PHE HZ 1 1 10 5025 1 1 22 PHE N N 7.679 -1.899 2.040 1.00 . A A . 28 PHE N 1 1 10 5026 1 1 22 PHE O O 10.768 -0.202 1.770 1.00 . A A . 28 PHE O 1 1 10 5027 1 1 23 ILE C C 10.200 2.077 3.165 1.00 . A A . 29 ILE C 1 1 10 5028 1 1 23 ILE CA C 9.164 2.049 2.042 1.00 . A A . 29 ILE CA 1 1 10 5029 1 1 23 ILE CB C 7.986 2.973 2.416 1.00 . A A . 29 ILE CB 1 1 10 5030 1 1 23 ILE CD1 C 7.462 5.428 2.002 1.00 . A A . 29 ILE CD1 1 1 10 5031 1 1 23 ILE CG1 C 8.461 4.422 2.530 1.00 . A A . 29 ILE CG1 1 1 10 5032 1 1 23 ILE CG2 C 7.334 2.519 3.715 1.00 . A A . 29 ILE CG2 1 1 10 5033 1 1 23 ILE H H 7.744 0.526 1.640 1.00 . A A . 29 ILE H 1 1 10 5034 1 1 23 ILE HA H 9.622 2.438 1.140 1.00 . A A . 29 ILE HA 1 1 10 5035 1 1 23 ILE HB H 7.247 2.907 1.632 1.00 . A A . 29 ILE HB 1 1 10 5036 1 1 23 ILE HD11 H 6.527 5.320 2.532 1.00 . A A . 29 ILE HD11 1 1 10 5037 1 1 23 ILE HD12 H 7.845 6.428 2.147 1.00 . A A . 29 ILE HD12 1 1 10 5038 1 1 23 ILE HD13 H 7.300 5.255 0.948 1.00 . A A . 29 ILE HD13 1 1 10 5039 1 1 23 ILE HG12 H 8.645 4.653 3.569 1.00 . A A . 29 ILE HG12 1 1 10 5040 1 1 23 ILE HG13 H 9.379 4.539 1.972 1.00 . A A . 29 ILE HG13 1 1 10 5041 1 1 23 ILE HG21 H 7.840 1.640 4.085 1.00 . A A . 29 ILE HG21 1 1 10 5042 1 1 23 ILE HG22 H 7.403 3.309 4.449 1.00 . A A . 29 ILE HG22 1 1 10 5043 1 1 23 ILE HG23 H 6.295 2.287 3.534 1.00 . A A . 29 ILE HG23 1 1 10 5044 1 1 23 ILE N N 8.703 0.688 1.760 1.00 . A A . 29 ILE N 1 1 10 5045 1 1 23 ILE O O 11.055 2.960 3.208 1.00 . A A . 29 ILE O 1 1 10 5046 1 1 24 ALA C C 12.459 0.683 4.719 1.00 . A A . 30 ALA C 1 1 10 5047 1 1 24 ALA CA C 11.050 1.034 5.189 1.00 . A A . 30 ALA CA 1 1 10 5048 1 1 24 ALA CB C 10.564 0.020 6.214 1.00 . A A . 30 ALA CB 1 1 10 5049 1 1 24 ALA H H 9.415 0.432 3.988 1.00 . A A . 30 ALA H 1 1 10 5050 1 1 24 ALA HA H 11.074 2.005 5.663 1.00 . A A . 30 ALA HA 1 1 10 5051 1 1 24 ALA HB1 H 9.502 -0.138 6.089 1.00 . A A . 30 ALA HB1 1 1 10 5052 1 1 24 ALA HB2 H 11.086 -0.914 6.071 1.00 . A A . 30 ALA HB2 1 1 10 5053 1 1 24 ALA HB3 H 10.757 0.392 7.209 1.00 . A A . 30 ALA HB3 1 1 10 5054 1 1 24 ALA N N 10.118 1.109 4.071 1.00 . A A . 30 ALA N 1 1 10 5055 1 1 24 ALA O O 13.443 1.027 5.374 1.00 . A A . 30 ALA O 1 1 10 5056 1 1 25 TRP C C 14.610 0.825 2.517 1.00 . A A . 31 TRP C 1 1 10 5057 1 1 25 TRP CA C 13.841 -0.396 3.033 1.00 . A A . 31 TRP CA 1 1 10 5058 1 1 25 TRP CB C 13.648 -1.427 1.900 1.00 . A A . 31 TRP CB 1 1 10 5059 1 1 25 TRP CD1 C 15.540 -0.841 0.273 1.00 . A A . 31 TRP CD1 1 1 10 5060 1 1 25 TRP CD2 C 13.487 -0.600 -0.590 1.00 . A A . 31 TRP CD2 1 1 10 5061 1 1 25 TRP CE2 C 14.432 -0.229 -1.564 1.00 . A A . 31 TRP CE2 1 1 10 5062 1 1 25 TRP CE3 C 12.128 -0.532 -0.913 1.00 . A A . 31 TRP CE3 1 1 10 5063 1 1 25 TRP CG C 14.218 -0.985 0.582 1.00 . A A . 31 TRP CG 1 1 10 5064 1 1 25 TRP CH2 C 12.728 0.264 -3.120 1.00 . A A . 31 TRP CH2 1 1 10 5065 1 1 25 TRP CZ2 C 14.063 0.207 -2.831 1.00 . A A . 31 TRP CZ2 1 1 10 5066 1 1 25 TRP CZ3 C 11.764 -0.102 -2.175 1.00 . A A . 31 TRP CZ3 1 1 10 5067 1 1 25 TRP H H 11.731 -0.248 3.106 1.00 . A A . 31 TRP H 1 1 10 5068 1 1 25 TRP HA H 14.412 -0.852 3.827 1.00 . A A . 31 TRP HA 1 1 10 5069 1 1 25 TRP HB2 H 14.133 -2.351 2.178 1.00 . A A . 31 TRP HB2 1 1 10 5070 1 1 25 TRP HB3 H 12.592 -1.608 1.765 1.00 . A A . 31 TRP HB3 1 1 10 5071 1 1 25 TRP HD1 H 16.350 -1.054 0.954 1.00 . A A . 31 TRP HD1 1 1 10 5072 1 1 25 TRP HE1 H 16.527 -0.198 -1.464 1.00 . A A . 31 TRP HE1 1 1 10 5073 1 1 25 TRP HE3 H 11.368 -0.811 -0.200 1.00 . A A . 31 TRP HE3 1 1 10 5074 1 1 25 TRP HH2 H 12.399 0.596 -4.093 1.00 . A A . 31 TRP HH2 1 1 10 5075 1 1 25 TRP HZ2 H 14.794 0.499 -3.566 1.00 . A A . 31 TRP HZ2 1 1 10 5076 1 1 25 TRP HZ3 H 10.719 -0.041 -2.442 1.00 . A A . 31 TRP HZ3 1 1 10 5077 1 1 25 TRP N N 12.550 -0.002 3.584 1.00 . A A . 31 TRP N 1 1 10 5078 1 1 25 TRP NE1 N 15.677 -0.382 -1.013 1.00 . A A . 31 TRP NE1 1 1 10 5079 1 1 25 TRP O O 15.717 1.115 2.973 1.00 . A A . 31 TRP O 1 1 10 5080 1 1 26 LEU C C 14.835 3.816 1.938 1.00 . A A . 32 LEU C 1 1 10 5081 1 1 26 LEU CA C 14.646 2.683 0.934 1.00 . A A . 32 LEU CA 1 1 10 5082 1 1 26 LEU CB C 13.804 3.168 -0.246 1.00 . A A . 32 LEU CB 1 1 10 5083 1 1 26 LEU CD1 C 12.012 4.918 -0.164 1.00 . A A . 32 LEU CD1 1 1 10 5084 1 1 26 LEU CD2 C 11.418 2.550 -0.695 1.00 . A A . 32 LEU CD2 1 1 10 5085 1 1 26 LEU CG C 12.345 3.459 0.093 1.00 . A A . 32 LEU CG 1 1 10 5086 1 1 26 LEU H H 13.148 1.218 1.213 1.00 . A A . 32 LEU H 1 1 10 5087 1 1 26 LEU HA H 15.614 2.382 0.568 1.00 . A A . 32 LEU HA 1 1 10 5088 1 1 26 LEU HB2 H 14.253 4.070 -0.636 1.00 . A A . 32 LEU HB2 1 1 10 5089 1 1 26 LEU HB3 H 13.828 2.410 -1.015 1.00 . A A . 32 LEU HB3 1 1 10 5090 1 1 26 LEU HD11 H 12.893 5.522 -0.006 1.00 . A A . 32 LEU HD11 1 1 10 5091 1 1 26 LEU HD12 H 11.672 5.036 -1.182 1.00 . A A . 32 LEU HD12 1 1 10 5092 1 1 26 LEU HD13 H 11.234 5.233 0.515 1.00 . A A . 32 LEU HD13 1 1 10 5093 1 1 26 LEU HD21 H 11.853 2.341 -1.661 1.00 . A A . 32 LEU HD21 1 1 10 5094 1 1 26 LEU HD22 H 11.281 1.627 -0.153 1.00 . A A . 32 LEU HD22 1 1 10 5095 1 1 26 LEU HD23 H 10.463 3.035 -0.825 1.00 . A A . 32 LEU HD23 1 1 10 5096 1 1 26 LEU HG H 12.187 3.261 1.140 1.00 . A A . 32 LEU HG 1 1 10 5097 1 1 26 LEU N N 14.021 1.515 1.544 1.00 . A A . 32 LEU N 1 1 10 5098 1 1 26 LEU O O 15.832 4.535 1.892 1.00 . A A . 32 LEU O 1 1 10 5099 1 1 27 VAL C C 15.067 4.751 4.849 1.00 . A A . 33 VAL C 1 1 10 5100 1 1 27 VAL CA C 13.954 5.033 3.843 1.00 . A A . 33 VAL CA 1 1 10 5101 1 1 27 VAL CB C 12.614 5.208 4.587 1.00 . A A . 33 VAL CB 1 1 10 5102 1 1 27 VAL CG1 C 12.741 6.236 5.704 1.00 . A A . 33 VAL CG1 1 1 10 5103 1 1 27 VAL CG2 C 11.515 5.609 3.615 1.00 . A A . 33 VAL CG2 1 1 10 5104 1 1 27 VAL H H 13.100 3.379 2.834 1.00 . A A . 33 VAL H 1 1 10 5105 1 1 27 VAL HA H 14.180 5.955 3.327 1.00 . A A . 33 VAL HA 1 1 10 5106 1 1 27 VAL HB H 12.344 4.261 5.030 1.00 . A A . 33 VAL HB 1 1 10 5107 1 1 27 VAL HG11 H 13.109 7.166 5.296 1.00 . A A . 33 VAL HG11 1 1 10 5108 1 1 27 VAL HG12 H 11.773 6.398 6.155 1.00 . A A . 33 VAL HG12 1 1 10 5109 1 1 27 VAL HG13 H 13.430 5.872 6.451 1.00 . A A . 33 VAL HG13 1 1 10 5110 1 1 27 VAL HG21 H 11.637 5.066 2.689 1.00 . A A . 33 VAL HG21 1 1 10 5111 1 1 27 VAL HG22 H 10.552 5.377 4.044 1.00 . A A . 33 VAL HG22 1 1 10 5112 1 1 27 VAL HG23 H 11.576 6.670 3.420 1.00 . A A . 33 VAL HG23 1 1 10 5113 1 1 27 VAL N N 13.876 3.977 2.842 1.00 . A A . 33 VAL N 1 1 10 5114 1 1 27 VAL O O 15.622 5.673 5.447 1.00 . A A . 33 VAL O 1 1 10 5115 1 1 28 ARG C C 17.816 3.209 5.295 1.00 . A A . 34 ARG C 1 1 10 5116 1 1 28 ARG CA C 16.446 3.081 5.955 1.00 . A A . 34 ARG CA 1 1 10 5117 1 1 28 ARG CB C 16.224 1.644 6.432 1.00 . A A . 34 ARG CB 1 1 10 5118 1 1 28 ARG CD C 15.525 0.184 8.355 1.00 . A A . 34 ARG CD 1 1 10 5119 1 1 28 ARG CG C 15.383 1.546 7.695 1.00 . A A . 34 ARG CG 1 1 10 5120 1 1 28 ARG CZ C 13.169 -0.483 8.636 1.00 . A A . 34 ARG CZ 1 1 10 5121 1 1 28 ARG H H 14.920 2.784 4.519 1.00 . A A . 34 ARG H 1 1 10 5122 1 1 28 ARG HA H 16.405 3.746 6.805 1.00 . A A . 34 ARG HA 1 1 10 5123 1 1 28 ARG HB2 H 15.726 1.090 5.650 1.00 . A A . 34 ARG HB2 1 1 10 5124 1 1 28 ARG HB3 H 17.184 1.190 6.629 1.00 . A A . 34 ARG HB3 1 1 10 5125 1 1 28 ARG HD2 H 16.412 -0.298 7.972 1.00 . A A . 34 ARG HD2 1 1 10 5126 1 1 28 ARG HD3 H 15.625 0.324 9.421 1.00 . A A . 34 ARG HD3 1 1 10 5127 1 1 28 ARG HE H 14.497 -1.429 7.485 1.00 . A A . 34 ARG HE 1 1 10 5128 1 1 28 ARG HG2 H 15.705 2.307 8.390 1.00 . A A . 34 ARG HG2 1 1 10 5129 1 1 28 ARG HG3 H 14.346 1.706 7.438 1.00 . A A . 34 ARG HG3 1 1 10 5130 1 1 28 ARG HH11 H 13.706 1.159 9.688 1.00 . A A . 34 ARG HH11 1 1 10 5131 1 1 28 ARG HH12 H 12.055 0.669 9.869 1.00 . A A . 34 ARG HH12 1 1 10 5132 1 1 28 ARG HH21 H 12.326 -2.075 7.720 1.00 . A A . 34 ARG HH21 1 1 10 5133 1 1 28 ARG HH22 H 11.271 -1.167 8.752 1.00 . A A . 34 ARG HH22 1 1 10 5134 1 1 28 ARG N N 15.393 3.475 5.027 1.00 . A A . 34 ARG N 1 1 10 5135 1 1 28 ARG NE N 14.370 -0.673 8.095 1.00 . A A . 34 ARG NE 1 1 10 5136 1 1 28 ARG NH1 N 12.960 0.532 9.466 1.00 . A A . 34 ARG NH1 1 1 10 5137 1 1 28 ARG NH2 N 12.174 -1.309 8.346 1.00 . A A . 34 ARG NH2 1 1 10 5138 1 1 28 ARG O O 18.561 2.235 5.188 1.00 . A A . 34 ARG O 1 1 10 5139 1 1 29 GLY C C 19.263 4.850 2.702 1.00 . A A . 35 GLY C 1 1 10 5140 1 1 29 GLY CA C 19.411 4.657 4.198 1.00 . A A . 35 GLY CA 1 1 10 5141 1 1 29 GLY H H 17.502 5.157 4.959 1.00 . A A . 35 GLY H 1 1 10 5142 1 1 29 GLY HA2 H 19.860 5.543 4.622 1.00 . A A . 35 GLY HA2 1 1 10 5143 1 1 29 GLY HA3 H 20.060 3.814 4.380 1.00 . A A . 35 GLY HA3 1 1 10 5144 1 1 29 GLY N N 18.137 4.419 4.849 1.00 . A A . 35 GLY N 1 1 10 5145 1 1 29 GLY O O 18.781 5.888 2.247 1.00 . A A . 35 GLY O 1 1 10 5146 1 1 30 ARG C C 20.130 5.225 -0.061 1.00 . A A . 36 ARG C 1 1 10 5147 1 1 30 ARG CA C 19.584 3.903 0.476 1.00 . A A . 36 ARG CA 1 1 10 5148 1 1 30 ARG CB C 18.131 3.714 0.029 1.00 . A A . 36 ARG CB 1 1 10 5149 1 1 30 ARG CD C 16.685 2.745 -1.785 1.00 . A A . 36 ARG CD 1 1 10 5150 1 1 30 ARG CG C 17.942 2.565 -0.948 1.00 . A A . 36 ARG CG 1 1 10 5151 1 1 30 ARG CZ C 17.628 2.185 -3.994 1.00 . A A . 36 ARG CZ 1 1 10 5152 1 1 30 ARG H H 20.047 3.044 2.356 1.00 . A A . 36 ARG H 1 1 10 5153 1 1 30 ARG HA H 20.180 3.096 0.077 1.00 . A A . 36 ARG HA 1 1 10 5154 1 1 30 ARG HB2 H 17.521 3.521 0.899 1.00 . A A . 36 ARG HB2 1 1 10 5155 1 1 30 ARG HB3 H 17.787 4.621 -0.446 1.00 . A A . 36 ARG HB3 1 1 10 5156 1 1 30 ARG HD2 H 16.103 1.837 -1.736 1.00 . A A . 36 ARG HD2 1 1 10 5157 1 1 30 ARG HD3 H 16.109 3.564 -1.378 1.00 . A A . 36 ARG HD3 1 1 10 5158 1 1 30 ARG HE H 16.720 3.903 -3.539 1.00 . A A . 36 ARG HE 1 1 10 5159 1 1 30 ARG HG2 H 18.796 2.520 -1.606 1.00 . A A . 36 ARG HG2 1 1 10 5160 1 1 30 ARG HG3 H 17.864 1.642 -0.392 1.00 . A A . 36 ARG HG3 1 1 10 5161 1 1 30 ARG HH11 H 17.837 0.730 -2.605 1.00 . A A . 36 ARG HH11 1 1 10 5162 1 1 30 ARG HH12 H 18.491 0.364 -4.165 1.00 . A A . 36 ARG HH12 1 1 10 5163 1 1 30 ARG HH21 H 17.580 3.422 -5.591 1.00 . A A . 36 ARG HH21 1 1 10 5164 1 1 30 ARG HH22 H 18.347 1.892 -5.860 1.00 . A A . 36 ARG HH22 1 1 10 5165 1 1 30 ARG N N 19.675 3.846 1.933 1.00 . A A . 36 ARG N 1 1 10 5166 1 1 30 ARG NE N 16.996 3.032 -3.184 1.00 . A A . 36 ARG NE 1 1 10 5167 1 1 30 ARG NH1 N 18.017 0.995 -3.551 1.00 . A A . 36 ARG NH1 1 1 10 5168 1 1 30 ARG NH2 N 17.872 2.527 -5.251 1.00 . A A . 36 ARG NH2 1 1 10 5169 1 1 30 ARG O O 19.705 5.701 -1.114 1.00 . A A . 36 ARG O 1 1 10 5170 1 1 31 GLY C C 21.314 8.213 1.187 1.00 . A A . 37 GLY C 1 1 10 5171 1 1 31 GLY CA C 21.660 7.072 0.251 1.00 . A A . 37 GLY CA 1 1 10 5172 1 1 31 GLY H H 21.373 5.387 1.500 1.00 . A A . 37 GLY H 1 1 10 5173 1 1 31 GLY HA2 H 22.734 6.962 0.216 1.00 . A A . 37 GLY HA2 1 1 10 5174 1 1 31 GLY HA3 H 21.301 7.313 -0.739 1.00 . A A . 37 GLY HA3 1 1 10 5175 1 1 31 GLY N N 21.073 5.813 0.670 1.00 . A A . 37 GLY N 1 1 10 5176 1 1 31 GLY O O 20.122 8.358 1.532 1.00 . A A . 37 GLY O 1 1 10 5177 1 1 31 GLY OXT O 22.235 8.961 1.577 1.00 . A A . 37 GLY OXT 1 1 10 5178 2 2 1 . C02 C 5.431 1.207 -4.794 1.00 . B A . 1038 D6M C02 1 1 10 5179 2 2 1 . C04 C 3.391 2.203 -3.906 1.00 . B A . 1038 D6M C04 1 1 10 5180 2 2 1 . C05 C 3.170 2.079 -2.395 1.00 . B A . 1038 D6M C05 1 1 10 5181 2 2 1 . C06 C 3.663 3.278 -1.600 1.00 . B A . 1038 D6M C06 1 1 10 5182 2 2 1 . C07 C 2.893 3.478 -0.308 1.00 . B A . 1038 D6M C07 1 1 10 5183 2 2 1 . C09 C 2.692 3.452 -4.433 1.00 . B A . 1038 D6M C09 1 1 10 5184 2 2 1 . C12 C 6.898 1.271 -5.179 1.00 . B A . 1038 D6M C12 1 1 10 5185 2 2 1 . C13 C 7.588 -0.082 -5.088 1.00 . B A . 1038 D6M C13 1 1 10 5186 2 2 1 . C14 C 9.005 0.044 -4.549 1.00 . B A . 1038 D6M C14 1 1 10 5187 2 2 1 . C15 C 9.941 0.671 -5.573 1.00 . B A . 1038 D6M C15 1 1 10 5188 2 2 1 . C16 C 9.934 2.192 -5.490 1.00 . B A . 1038 D6M C16 1 1 10 5189 2 2 1 . C17 C 10.300 2.682 -4.097 1.00 . B A . 1038 D6M C17 1 1 10 5190 2 2 1 . C18 C 10.827 4.108 -4.124 1.00 . B A . 1038 D6M C18 1 1 10 5191 2 2 1 . C19 C 9.716 5.119 -3.887 1.00 . B A . 1038 D6M C19 1 1 10 5192 2 2 1 . C20 C 9.102 4.963 -2.505 1.00 . B A . 1038 D6M C20 1 1 10 5193 2 2 1 . C21 C 8.565 6.285 -1.981 1.00 . B A . 1038 D6M C21 1 1 10 5194 2 2 1 . C22 C 9.632 7.061 -1.225 1.00 . B A . 1038 D6M C22 1 1 10 5195 2 2 1 . C23 C 9.445 6.942 0.279 1.00 . B A . 1038 D6M C23 1 1 10 5196 2 2 1 . C24 C 10.595 7.585 1.039 1.00 . B A . 1038 D6M C24 1 1 10 5197 2 2 1 . C25 C 10.586 9.099 0.892 1.00 . B A . 1038 D6M C25 1 1 10 5198 2 2 1 . C26 C 11.660 9.751 1.738 1.00 . B A . 1038 D6M C26 1 1 10 5199 2 2 1 . H03 H 5.317 3.067 -4.069 1.00 . B A . 1038 D6M H03 1 1 10 5200 2 2 1 . H04 H 2.968 1.338 -4.394 1.00 . B A . 1038 D6M H04 1 1 10 5201 2 2 1 . HP21 H 7.399 1.963 -4.519 1.00 . B A . 1038 D6M HP21 1 1 10 5202 2 2 1 . HP22 H 6.972 1.629 -6.196 1.00 . B A . 1038 D6M HP22 1 1 10 5203 2 2 1 . HP31 H 7.625 -0.522 -6.073 1.00 . B A . 1038 D6M HP31 1 1 10 5204 2 2 1 . HP32 H 7.020 -0.720 -4.427 1.00 . B A . 1038 D6M HP32 1 1 10 5205 2 2 1 . HP41 H 9.371 -0.940 -4.295 1.00 . B A . 1038 D6M HP41 1 1 10 5206 2 2 1 . HP42 H 8.990 0.661 -3.666 1.00 . B A . 1038 D6M HP42 1 1 10 5207 2 2 1 . HP51 H 9.626 0.373 -6.562 1.00 . B A . 1038 D6M HP51 1 1 10 5208 2 2 1 . HP52 H 10.944 0.317 -5.392 1.00 . B A . 1038 D6M HP52 1 1 10 5209 2 2 1 . HP61 H 8.946 2.551 -5.740 1.00 . B A . 1038 D6M HP61 1 1 10 5210 2 2 1 . HP62 H 10.650 2.583 -6.196 1.00 . B A . 1038 D6M HP62 1 1 10 5211 2 2 1 . HP71 H 11.060 2.034 -3.686 1.00 . B A . 1038 D6M HP71 1 1 10 5212 2 2 1 . HP72 H 9.421 2.648 -3.474 1.00 . B A . 1038 D6M HP72 1 1 10 5213 2 2 1 . HP81 H 11.275 4.298 -5.089 1.00 . B A . 1038 D6M HP81 1 1 10 5214 2 2 1 . HP82 H 11.572 4.221 -3.351 1.00 . B A . 1038 D6M HP82 1 1 10 5215 2 2 1 . HP91 H 8.946 4.975 -4.632 1.00 . B A . 1038 D6M HP91 1 1 10 5216 2 2 1 . HP92 H 10.123 6.115 -3.977 1.00 . B A . 1038 D6M HP92 1 1 10 5217 2 2 1 . HPA1 H 9.856 4.596 -1.825 1.00 . B A . 1038 D6M HPA1 1 1 10 5218 2 2 1 . HPA2 H 8.290 4.253 -2.560 1.00 . B A . 1038 D6M HPA2 1 1 10 5219 2 2 1 . HPB1 H 7.737 6.087 -1.316 1.00 . B A . 1038 D6M HPB1 1 1 10 5220 2 2 1 . HPB2 H 8.224 6.881 -2.815 1.00 . B A . 1038 D6M HPB2 1 1 10 5221 2 2 1 . HPC1 H 9.574 8.102 -1.506 1.00 . B A . 1038 D6M HPC1 1 1 10 5222 2 2 1 . HPC2 H 10.603 6.669 -1.488 1.00 . B A . 1038 D6M HPC2 1 1 10 5223 2 2 1 . HPD1 H 9.391 5.896 0.542 1.00 . B A . 1038 D6M HPD1 1 1 10 5224 2 2 1 . HPD2 H 8.524 7.433 0.557 1.00 . B A . 1038 D6M HPD2 1 1 10 5225 2 2 1 . HPE1 H 11.528 7.200 0.655 1.00 . B A . 1038 D6M HPE1 1 1 10 5226 2 2 1 . HPE2 H 10.505 7.336 2.086 1.00 . B A . 1038 D6M HPE2 1 1 10 5227 2 2 1 . HPF1 H 9.623 9.479 1.203 1.00 . B A . 1038 D6M HPF1 1 1 10 5228 2 2 1 . HPF2 H 10.764 9.355 -0.141 1.00 . B A . 1038 D6M HPF2 1 1 10 5229 2 2 1 . HPG1 H 12.245 10.419 1.123 1.00 . B A . 1038 D6M HPG1 1 1 10 5230 2 2 1 . HPG2 H 12.303 8.990 2.155 1.00 . B A . 1038 D6M HPG2 1 1 10 5231 2 2 1 . HPG3 H 11.198 10.310 2.538 1.00 . B A . 1038 D6M HPG3 1 1 10 5232 2 2 1 . HQ21 H 4.706 3.132 -1.360 1.00 . B A . 1038 D6M HQ21 1 1 10 5233 2 2 1 . HQ22 H 3.555 4.166 -2.206 1.00 . B A . 1038 D6M HQ22 1 1 10 5234 2 2 1 . HQ31 H 2.113 1.963 -2.209 1.00 . B A . 1038 D6M HQ31 1 1 10 5235 2 2 1 . HQ32 H 3.688 1.202 -2.038 1.00 . B A . 1038 D6M HQ32 1 1 10 5236 2 2 1 . N03 N 4.818 2.237 -4.216 1.00 . B A . 1038 D6M N03 1 1 10 5237 2 2 1 . O01 O 4.800 0.189 -5.081 1.00 . B A . 1038 D6M O01 1 1 10 5238 2 2 1 . O08 O 1.924 4.237 -0.320 1.00 . B A . 1038 D6M O08 1 1 10 5239 2 2 1 . O10 O 1.527 3.338 -4.868 1.00 . B A . 1038 D6M O10 1 1 10 5240 2 2 1 . O11 O 3.316 4.534 -4.407 1.00 . B A . 1038 D6M O11 1 1 11 5241 1 1 1 HIS C C -27.026 4.506 0.434 1.00 . A A . 7 HIS C 1 1 11 5242 1 1 1 HIS CA C -28.109 4.912 -0.559 1.00 . A A . 7 HIS CA 1 1 11 5243 1 1 1 HIS CB C -27.505 5.753 -1.685 1.00 . A A . 7 HIS CB 1 1 11 5244 1 1 1 HIS CD2 C -29.182 7.549 -2.515 1.00 . A A . 7 HIS CD2 1 1 11 5245 1 1 1 HIS CE1 C -29.880 6.525 -4.323 1.00 . A A . 7 HIS CE1 1 1 11 5246 1 1 1 HIS CG C -28.528 6.366 -2.590 1.00 . A A . 7 HIS CG 1 1 11 5247 1 1 1 HIS H1 H -29.426 5.224 0.991 1.00 . A A . 7 HIS H1 1 1 11 5248 1 1 1 HIS H2 H -28.796 6.656 0.289 1.00 . A A . 7 HIS H2 1 1 11 5249 1 1 1 HIS H3 H -29.990 5.747 -0.544 1.00 . A A . 7 HIS H3 1 1 11 5250 1 1 1 HIS HA H -28.554 4.022 -0.979 1.00 . A A . 7 HIS HA 1 1 11 5251 1 1 1 HIS HB2 H -26.921 6.553 -1.255 1.00 . A A . 7 HIS HB2 1 1 11 5252 1 1 1 HIS HB3 H -26.861 5.127 -2.286 1.00 . A A . 7 HIS HB3 1 1 11 5253 1 1 1 HIS HD1 H -28.704 4.871 -4.065 1.00 . A A . 7 HIS HD1 1 1 11 5254 1 1 1 HIS HD2 H -29.069 8.296 -1.742 1.00 . A A . 7 HIS HD2 1 1 11 5255 1 1 1 HIS HE1 H -30.409 6.299 -5.237 1.00 . A A . 7 HIS HE1 1 1 11 5256 1 1 1 HIS HE2 H -30.678 8.327 -3.767 1.00 . A A . 7 HIS HE2 1 1 11 5257 1 1 1 HIS N N -29.176 5.706 0.104 1.00 . A A . 7 HIS N 1 1 11 5258 1 1 1 HIS ND1 N -28.989 5.748 -3.734 1.00 . A A . 7 HIS ND1 1 1 11 5259 1 1 1 HIS NE2 N -30.016 7.623 -3.603 1.00 . A A . 7 HIS NE2 1 1 11 5260 1 1 1 HIS O O -26.736 5.234 1.384 1.00 . A A . 7 HIS O 1 1 11 5261 1 1 2 ALA C C -24.645 1.664 0.444 1.00 . A A . 8 ALA C 1 1 11 5262 1 1 2 ALA CA C -25.379 2.837 1.085 1.00 . A A . 8 ALA CA 1 1 11 5263 1 1 2 ALA CB C -25.962 2.427 2.428 1.00 . A A . 8 ALA CB 1 1 11 5264 1 1 2 ALA H H -26.705 2.804 -0.565 1.00 . A A . 8 ALA H 1 1 11 5265 1 1 2 ALA HA H -24.675 3.639 1.254 1.00 . A A . 8 ALA HA 1 1 11 5266 1 1 2 ALA HB1 H -26.795 3.070 2.670 1.00 . A A . 8 ALA HB1 1 1 11 5267 1 1 2 ALA HB2 H -26.302 1.403 2.376 1.00 . A A . 8 ALA HB2 1 1 11 5268 1 1 2 ALA HB3 H -25.204 2.516 3.192 1.00 . A A . 8 ALA HB3 1 1 11 5269 1 1 2 ALA N N -26.430 3.340 0.209 1.00 . A A . 8 ALA N 1 1 11 5270 1 1 2 ALA O O -25.198 0.573 0.307 1.00 . A A . 8 ALA O 1 1 11 5271 1 1 3 GLU C C -21.972 -0.061 0.479 1.00 . A A . 9 GLU C 1 1 11 5272 1 1 3 GLU CA C -22.585 0.857 -0.572 1.00 . A A . 9 GLU CA 1 1 11 5273 1 1 3 GLU CB C -21.481 1.487 -1.424 1.00 . A A . 9 GLU CB 1 1 11 5274 1 1 3 GLU CD C -21.267 0.038 -3.482 1.00 . A A . 9 GLU CD 1 1 11 5275 1 1 3 GLU CG C -20.636 0.469 -2.172 1.00 . A A . 9 GLU CG 1 1 11 5276 1 1 3 GLU H H -23.010 2.786 0.190 1.00 . A A . 9 GLU H 1 1 11 5277 1 1 3 GLU HA H -23.231 0.273 -1.211 1.00 . A A . 9 GLU HA 1 1 11 5278 1 1 3 GLU HB2 H -21.934 2.149 -2.147 1.00 . A A . 9 GLU HB2 1 1 11 5279 1 1 3 GLU HB3 H -20.830 2.060 -0.781 1.00 . A A . 9 GLU HB3 1 1 11 5280 1 1 3 GLU HG2 H -19.672 0.907 -2.383 1.00 . A A . 9 GLU HG2 1 1 11 5281 1 1 3 GLU HG3 H -20.506 -0.402 -1.547 1.00 . A A . 9 GLU HG3 1 1 11 5282 1 1 3 GLU N N -23.396 1.896 0.054 1.00 . A A . 9 GLU N 1 1 11 5283 1 1 3 GLU O O -21.156 0.369 1.295 1.00 . A A . 9 GLU O 1 1 11 5284 1 1 3 GLU OE1 O -22.278 -0.695 -3.440 1.00 . A A . 9 GLU OE1 1 1 11 5285 1 1 3 GLU OE2 O -20.752 0.433 -4.548 1.00 . A A . 9 GLU OE2 1 1 11 5286 1 1 4 GLY C C -20.461 -2.779 1.044 1.00 . A A . 10 GLY C 1 1 11 5287 1 1 4 GLY CA C -21.848 -2.289 1.411 1.00 . A A . 10 GLY CA 1 1 11 5288 1 1 4 GLY H H -23.021 -1.616 -0.218 1.00 . A A . 10 GLY H 1 1 11 5289 1 1 4 GLY HA2 H -21.807 -1.824 2.384 1.00 . A A . 10 GLY HA2 1 1 11 5290 1 1 4 GLY HA3 H -22.517 -3.135 1.455 1.00 . A A . 10 GLY HA3 1 1 11 5291 1 1 4 GLY N N -22.369 -1.329 0.455 1.00 . A A . 10 GLY N 1 1 11 5292 1 1 4 GLY O O -20.308 -3.623 0.160 1.00 . A A . 10 GLY O 1 1 11 5293 1 1 5 THR C C -17.163 -2.232 2.624 1.00 . A A . 11 THR C 1 1 11 5294 1 1 5 THR CA C -18.068 -2.639 1.465 1.00 . A A . 11 THR CA 1 1 11 5295 1 1 5 THR CB C -17.571 -2.006 0.163 1.00 . A A . 11 THR CB 1 1 11 5296 1 1 5 THR CG2 C -17.523 -2.979 -0.995 1.00 . A A . 11 THR CG2 1 1 11 5297 1 1 5 THR H H -19.636 -1.583 2.416 1.00 . A A . 11 THR H 1 1 11 5298 1 1 5 THR HA H -18.040 -3.714 1.365 1.00 . A A . 11 THR HA 1 1 11 5299 1 1 5 THR HB H -16.570 -1.627 0.317 1.00 . A A . 11 THR HB 1 1 11 5300 1 1 5 THR HG1 H -18.582 -0.372 0.546 1.00 . A A . 11 THR HG1 1 1 11 5301 1 1 5 THR HG21 H -18.335 -3.686 -0.904 1.00 . A A . 11 THR HG21 1 1 11 5302 1 1 5 THR HG22 H -17.620 -2.437 -1.924 1.00 . A A . 11 THR HG22 1 1 11 5303 1 1 5 THR HG23 H -16.582 -3.507 -0.982 1.00 . A A . 11 THR HG23 1 1 11 5304 1 1 5 THR N N -19.449 -2.250 1.724 1.00 . A A . 11 THR N 1 1 11 5305 1 1 5 THR O O -17.573 -1.486 3.513 1.00 . A A . 11 THR O 1 1 11 5306 1 1 5 THR OG1 O -18.402 -0.924 -0.219 1.00 . A A . 11 THR OG1 1 1 11 5307 1 1 6 PHE C C -13.552 -2.796 3.229 1.00 . A A . 12 PHE C 1 1 11 5308 1 1 6 PHE CA C -14.966 -2.414 3.656 1.00 . A A . 12 PHE CA 1 1 11 5309 1 1 6 PHE CB C -15.335 -3.142 4.949 1.00 . A A . 12 PHE CB 1 1 11 5310 1 1 6 PHE CD1 C -14.049 -1.519 6.367 1.00 . A A . 12 PHE CD1 1 1 11 5311 1 1 6 PHE CD2 C -13.932 -3.838 6.910 1.00 . A A . 12 PHE CD2 1 1 11 5312 1 1 6 PHE CE1 C -13.208 -1.226 7.423 1.00 . A A . 12 PHE CE1 1 1 11 5313 1 1 6 PHE CE2 C -13.090 -3.551 7.968 1.00 . A A . 12 PHE CE2 1 1 11 5314 1 1 6 PHE CG C -14.420 -2.826 6.098 1.00 . A A . 12 PHE CG 1 1 11 5315 1 1 6 PHE CZ C -12.728 -2.243 8.225 1.00 . A A . 12 PHE CZ 1 1 11 5316 1 1 6 PHE H H -15.660 -3.316 1.871 1.00 . A A . 12 PHE H 1 1 11 5317 1 1 6 PHE HA H -15.000 -1.349 3.830 1.00 . A A . 12 PHE HA 1 1 11 5318 1 1 6 PHE HB2 H -16.338 -2.863 5.237 1.00 . A A . 12 PHE HB2 1 1 11 5319 1 1 6 PHE HB3 H -15.299 -4.208 4.777 1.00 . A A . 12 PHE HB3 1 1 11 5320 1 1 6 PHE HD1 H -14.424 -0.722 5.741 1.00 . A A . 12 PHE HD1 1 1 11 5321 1 1 6 PHE HD2 H -14.215 -4.861 6.710 1.00 . A A . 12 PHE HD2 1 1 11 5322 1 1 6 PHE HE1 H -12.925 -0.202 7.622 1.00 . A A . 12 PHE HE1 1 1 11 5323 1 1 6 PHE HE2 H -12.717 -4.349 8.593 1.00 . A A . 12 PHE HE2 1 1 11 5324 1 1 6 PHE HZ H -12.070 -2.017 9.051 1.00 . A A . 12 PHE HZ 1 1 11 5325 1 1 6 PHE N N -15.929 -2.726 2.607 1.00 . A A . 12 PHE N 1 1 11 5326 1 1 6 PHE O O -12.627 -1.990 3.318 1.00 . A A . 12 PHE O 1 1 11 5327 1 1 7 THR C C -11.759 -4.003 0.930 1.00 . A A . 13 THR C 1 1 11 5328 1 1 7 THR CA C -12.093 -4.522 2.325 1.00 . A A . 13 THR CA 1 1 11 5329 1 1 7 THR CB C -12.072 -6.051 2.331 1.00 . A A . 13 THR CB 1 1 11 5330 1 1 7 THR CG2 C -13.177 -6.668 1.501 1.00 . A A . 13 THR CG2 1 1 11 5331 1 1 7 THR H H -14.170 -4.628 2.718 1.00 . A A . 13 THR H 1 1 11 5332 1 1 7 THR HA H -11.350 -4.158 3.018 1.00 . A A . 13 THR HA 1 1 11 5333 1 1 7 THR HB H -12.188 -6.398 3.348 1.00 . A A . 13 THR HB 1 1 11 5334 1 1 7 THR HG1 H -10.340 -6.939 2.549 1.00 . A A . 13 THR HG1 1 1 11 5335 1 1 7 THR HG21 H -13.406 -6.021 0.668 1.00 . A A . 13 THR HG21 1 1 11 5336 1 1 7 THR HG22 H -12.855 -7.631 1.132 1.00 . A A . 13 THR HG22 1 1 11 5337 1 1 7 THR HG23 H -14.059 -6.794 2.112 1.00 . A A . 13 THR HG23 1 1 11 5338 1 1 7 THR N N -13.394 -4.032 2.765 1.00 . A A . 13 THR N 1 1 11 5339 1 1 7 THR O O -10.595 -3.770 0.605 1.00 . A A . 13 THR O 1 1 11 5340 1 1 7 THR OG1 O -10.838 -6.537 1.833 1.00 . A A . 13 THR OG1 1 1 11 5341 1 1 8 SER C C -12.615 -1.807 -1.286 1.00 . A A . 14 SER C 1 1 11 5342 1 1 8 SER CA C -12.605 -3.332 -1.252 1.00 . A A . 14 SER CA 1 1 11 5343 1 1 8 SER CB C -13.700 -3.882 -2.168 1.00 . A A . 14 SER CB 1 1 11 5344 1 1 8 SER H H -13.694 -4.027 0.425 1.00 . A A . 14 SER H 1 1 11 5345 1 1 8 SER HA H -11.645 -3.681 -1.603 1.00 . A A . 14 SER HA 1 1 11 5346 1 1 8 SER HB2 H -14.632 -3.383 -1.950 1.00 . A A . 14 SER HB2 1 1 11 5347 1 1 8 SER HB3 H -13.428 -3.702 -3.198 1.00 . A A . 14 SER HB3 1 1 11 5348 1 1 8 SER HG H -14.716 -5.546 -2.347 1.00 . A A . 14 SER HG 1 1 11 5349 1 1 8 SER N N -12.789 -3.824 0.108 1.00 . A A . 14 SER N 1 1 11 5350 1 1 8 SER O O -11.957 -1.191 -2.124 1.00 . A A . 14 SER O 1 1 11 5351 1 1 8 SER OG O -13.873 -5.275 -1.978 1.00 . A A . 14 SER OG 1 1 11 5352 1 1 9 ASP C C -12.198 0.849 0.306 1.00 . A A . 15 ASP C 1 1 11 5353 1 1 9 ASP CA C -13.464 0.248 -0.296 1.00 . A A . 15 ASP CA 1 1 11 5354 1 1 9 ASP CB C -14.681 0.657 0.535 1.00 . A A . 15 ASP CB 1 1 11 5355 1 1 9 ASP CG C -14.990 2.137 0.420 1.00 . A A . 15 ASP CG 1 1 11 5356 1 1 9 ASP H H -13.869 -1.751 0.270 1.00 . A A . 15 ASP H 1 1 11 5357 1 1 9 ASP HA H -13.583 0.624 -1.301 1.00 . A A . 15 ASP HA 1 1 11 5358 1 1 9 ASP HB2 H -15.543 0.102 0.197 1.00 . A A . 15 ASP HB2 1 1 11 5359 1 1 9 ASP HB3 H -14.494 0.426 1.574 1.00 . A A . 15 ASP HB3 1 1 11 5360 1 1 9 ASP N N -13.367 -1.205 -0.370 1.00 . A A . 15 ASP N 1 1 11 5361 1 1 9 ASP O O -11.763 1.930 -0.092 1.00 . A A . 15 ASP O 1 1 11 5362 1 1 9 ASP OD1 O -15.655 2.530 -0.561 1.00 . A A . 15 ASP OD1 1 1 11 5363 1 1 9 ASP OD2 O -14.566 2.902 1.312 1.00 . A A . 15 ASP OD2 1 1 11 5364 1 1 10 VAL C C -9.190 0.494 0.996 1.00 . A A . 16 VAL C 1 1 11 5365 1 1 10 VAL CA C -10.396 0.609 1.924 1.00 . A A . 16 VAL CA 1 1 11 5366 1 1 10 VAL CB C -10.119 -0.179 3.220 1.00 . A A . 16 VAL CB 1 1 11 5367 1 1 10 VAL CG1 C -9.903 -1.655 2.920 1.00 . A A . 16 VAL CG1 1 1 11 5368 1 1 10 VAL CG2 C -8.921 0.403 3.955 1.00 . A A . 16 VAL CG2 1 1 11 5369 1 1 10 VAL H H -12.006 -0.711 1.542 1.00 . A A . 16 VAL H 1 1 11 5370 1 1 10 VAL HA H -10.538 1.648 2.184 1.00 . A A . 16 VAL HA 1 1 11 5371 1 1 10 VAL HB H -10.984 -0.090 3.861 1.00 . A A . 16 VAL HB 1 1 11 5372 1 1 10 VAL HG11 H -10.600 -1.973 2.159 1.00 . A A . 16 VAL HG11 1 1 11 5373 1 1 10 VAL HG12 H -8.893 -1.807 2.569 1.00 . A A . 16 VAL HG12 1 1 11 5374 1 1 10 VAL HG13 H -10.063 -2.232 3.818 1.00 . A A . 16 VAL HG13 1 1 11 5375 1 1 10 VAL HG21 H -8.114 0.567 3.256 1.00 . A A . 16 VAL HG21 1 1 11 5376 1 1 10 VAL HG22 H -9.199 1.342 4.410 1.00 . A A . 16 VAL HG22 1 1 11 5377 1 1 10 VAL HG23 H -8.599 -0.286 4.722 1.00 . A A . 16 VAL HG23 1 1 11 5378 1 1 10 VAL N N -11.611 0.143 1.267 1.00 . A A . 16 VAL N 1 1 11 5379 1 1 10 VAL O O -8.395 1.425 0.879 1.00 . A A . 16 VAL O 1 1 11 5380 1 1 11 SER C C -7.923 0.163 -1.695 1.00 . A A . 17 SER C 1 1 11 5381 1 1 11 SER CA C -7.952 -0.885 -0.583 1.00 . A A . 17 SER CA 1 1 11 5382 1 1 11 SER CB C -8.057 -2.285 -1.193 1.00 . A A . 17 SER CB 1 1 11 5383 1 1 11 SER H H -9.729 -1.357 0.467 1.00 . A A . 17 SER H 1 1 11 5384 1 1 11 SER HA H -7.035 -0.818 -0.018 1.00 . A A . 17 SER HA 1 1 11 5385 1 1 11 SER HB2 H -7.089 -2.590 -1.560 1.00 . A A . 17 SER HB2 1 1 11 5386 1 1 11 SER HB3 H -8.391 -2.980 -0.436 1.00 . A A . 17 SER HB3 1 1 11 5387 1 1 11 SER HG H -8.784 -3.049 -2.844 1.00 . A A . 17 SER HG 1 1 11 5388 1 1 11 SER N N -9.062 -0.652 0.336 1.00 . A A . 17 SER N 1 1 11 5389 1 1 11 SER O O -6.897 0.361 -2.345 1.00 . A A . 17 SER O 1 1 11 5390 1 1 11 SER OG O -8.979 -2.306 -2.269 1.00 . A A . 17 SER OG 1 1 11 5391 1 1 12 SER C C -8.224 3.018 -2.695 1.00 . A A . 18 SER C 1 1 11 5392 1 1 12 SER CA C -9.162 1.840 -2.955 1.00 . A A . 18 SER CA 1 1 11 5393 1 1 12 SER CB C -10.604 2.341 -3.056 1.00 . A A . 18 SER CB 1 1 11 5394 1 1 12 SER H H -9.844 0.616 -1.371 1.00 . A A . 18 SER H 1 1 11 5395 1 1 12 SER HA H -8.888 1.381 -3.892 1.00 . A A . 18 SER HA 1 1 11 5396 1 1 12 SER HB2 H -10.895 2.787 -2.117 1.00 . A A . 18 SER HB2 1 1 11 5397 1 1 12 SER HB3 H -10.672 3.078 -3.842 1.00 . A A . 18 SER HB3 1 1 11 5398 1 1 12 SER HG H -11.673 1.260 -4.293 1.00 . A A . 18 SER HG 1 1 11 5399 1 1 12 SER N N -9.056 0.823 -1.915 1.00 . A A . 18 SER N 1 1 11 5400 1 1 12 SER O O -7.776 3.677 -3.634 1.00 . A A . 18 SER O 1 1 11 5401 1 1 12 SER OG O -11.494 1.277 -3.350 1.00 . A A . 18 SER OG 1 1 11 5402 1 1 13 TYR C C -5.583 3.997 -1.152 1.00 . A A . 19 TYR C 1 1 11 5403 1 1 13 TYR CA C -7.055 4.403 -1.075 1.00 . A A . 19 TYR CA 1 1 11 5404 1 1 13 TYR CB C -7.408 4.955 0.318 1.00 . A A . 19 TYR CB 1 1 11 5405 1 1 13 TYR CD1 C -5.323 4.569 1.701 1.00 . A A . 19 TYR CD1 1 1 11 5406 1 1 13 TYR CD2 C -7.324 3.444 2.343 1.00 . A A . 19 TYR CD2 1 1 11 5407 1 1 13 TYR CE1 C -4.651 3.986 2.758 1.00 . A A . 19 TYR CE1 1 1 11 5408 1 1 13 TYR CE2 C -6.659 2.859 3.404 1.00 . A A . 19 TYR CE2 1 1 11 5409 1 1 13 TYR CG C -6.669 4.307 1.474 1.00 . A A . 19 TYR CG 1 1 11 5410 1 1 13 TYR CZ C -5.323 3.132 3.606 1.00 . A A . 19 TYR CZ 1 1 11 5411 1 1 13 TYR H H -8.322 2.740 -0.713 1.00 . A A . 19 TYR H 1 1 11 5412 1 1 13 TYR HA H -7.225 5.183 -1.804 1.00 . A A . 19 TYR HA 1 1 11 5413 1 1 13 TYR HB2 H -7.183 6.011 0.340 1.00 . A A . 19 TYR HB2 1 1 11 5414 1 1 13 TYR HB3 H -8.467 4.820 0.486 1.00 . A A . 19 TYR HB3 1 1 11 5415 1 1 13 TYR HD1 H -8.370 3.230 2.181 1.00 . A A . 19 TYR HD1 1 1 11 5416 1 1 13 TYR HD2 H -4.799 5.239 1.036 1.00 . A A . 19 TYR HD2 1 1 11 5417 1 1 13 TYR HE1 H -7.186 2.190 4.068 1.00 . A A . 19 TYR HE1 1 1 11 5418 1 1 13 TYR HE2 H -3.605 4.201 2.917 1.00 . A A . 19 TYR HE2 1 1 11 5419 1 1 13 TYR HH H -4.359 1.675 4.408 1.00 . A A . 19 TYR HH 1 1 11 5420 1 1 13 TYR N N -7.934 3.291 -1.425 1.00 . A A . 19 TYR N 1 1 11 5421 1 1 13 TYR O O -4.766 4.708 -1.736 1.00 . A A . 19 TYR O 1 1 11 5422 1 1 13 TYR OH O -4.658 2.551 4.661 1.00 . A A . 19 TYR OH 1 1 11 5423 1 1 14 LEU C C -3.477 1.883 -1.963 1.00 . A A . 20 LEU C 1 1 11 5424 1 1 14 LEU CA C -3.872 2.369 -0.572 1.00 . A A . 20 LEU CA 1 1 11 5425 1 1 14 LEU CB C -3.690 1.239 0.445 1.00 . A A . 20 LEU CB 1 1 11 5426 1 1 14 LEU CD1 C -4.229 -1.213 0.407 1.00 . A A . 20 LEU CD1 1 1 11 5427 1 1 14 LEU CD2 C -5.677 0.363 1.699 1.00 . A A . 20 LEU CD2 1 1 11 5428 1 1 14 LEU CG C -4.808 0.193 0.462 1.00 . A A . 20 LEU CG 1 1 11 5429 1 1 14 LEU H H -5.941 2.327 -0.110 1.00 . A A . 20 LEU H 1 1 11 5430 1 1 14 LEU HA H -3.231 3.193 -0.298 1.00 . A A . 20 LEU HA 1 1 11 5431 1 1 14 LEU HB2 H -2.757 0.738 0.229 1.00 . A A . 20 LEU HB2 1 1 11 5432 1 1 14 LEU HB3 H -3.623 1.678 1.429 1.00 . A A . 20 LEU HB3 1 1 11 5433 1 1 14 LEU HD11 H -3.428 -1.301 1.127 1.00 . A A . 20 LEU HD11 1 1 11 5434 1 1 14 LEU HD12 H -5.002 -1.930 0.640 1.00 . A A . 20 LEU HD12 1 1 11 5435 1 1 14 LEU HD13 H -3.845 -1.406 -0.584 1.00 . A A . 20 LEU HD13 1 1 11 5436 1 1 14 LEU HD21 H -5.048 0.488 2.568 1.00 . A A . 20 LEU HD21 1 1 11 5437 1 1 14 LEU HD22 H -6.303 1.234 1.580 1.00 . A A . 20 LEU HD22 1 1 11 5438 1 1 14 LEU HD23 H -6.298 -0.511 1.827 1.00 . A A . 20 LEU HD23 1 1 11 5439 1 1 14 LEU HG H -5.433 0.330 -0.408 1.00 . A A . 20 LEU HG 1 1 11 5440 1 1 14 LEU N N -5.249 2.854 -0.561 1.00 . A A . 20 LEU N 1 1 11 5441 1 1 14 LEU O O -4.327 1.465 -2.750 1.00 . A A . 20 LEU O 1 1 11 5442 1 1 15 GLU C C -1.980 0.034 -3.796 1.00 . A A . 21 GLU C 1 1 11 5443 1 1 15 GLU CA C -1.675 1.510 -3.557 1.00 . A A . 21 GLU CA 1 1 11 5444 1 1 15 GLU CB C -0.167 1.753 -3.645 1.00 . A A . 21 GLU CB 1 1 11 5445 1 1 15 GLU CD C 0.688 3.195 -5.535 1.00 . A A . 21 GLU CD 1 1 11 5446 1 1 15 GLU CG C 0.199 3.156 -4.100 1.00 . A A . 21 GLU CG 1 1 11 5447 1 1 15 GLU H H -1.555 2.286 -1.591 1.00 . A A . 21 GLU H 1 1 11 5448 1 1 15 GLU HA H -2.170 2.095 -4.317 1.00 . A A . 21 GLU HA 1 1 11 5449 1 1 15 GLU HB2 H 0.270 1.589 -2.670 1.00 . A A . 21 GLU HB2 1 1 11 5450 1 1 15 GLU HB3 H 0.259 1.048 -4.343 1.00 . A A . 21 GLU HB3 1 1 11 5451 1 1 15 GLU HG2 H -0.674 3.787 -4.017 1.00 . A A . 21 GLU HG2 1 1 11 5452 1 1 15 GLU HG3 H 0.980 3.537 -3.458 1.00 . A A . 21 GLU HG3 1 1 11 5453 1 1 15 GLU N N -2.183 1.943 -2.260 1.00 . A A . 21 GLU N 1 1 11 5454 1 1 15 GLU O O -2.919 -0.307 -4.516 1.00 . A A . 21 GLU O 1 1 11 5455 1 1 15 GLU OE1 O 1.468 2.299 -5.920 1.00 . A A . 21 GLU OE1 1 1 11 5456 1 1 15 GLU OE2 O 0.291 4.121 -6.273 1.00 . A A . 21 GLU OE2 1 1 11 5457 1 1 16 GLY C C -0.320 -3.085 -2.643 1.00 . A A . 22 GLY C 1 1 11 5458 1 1 16 GLY CA C -1.383 -2.266 -3.350 1.00 . A A . 22 GLY CA 1 1 11 5459 1 1 16 GLY H H -0.449 -0.509 -2.627 1.00 . A A . 22 GLY H 1 1 11 5460 1 1 16 GLY HA2 H -2.350 -2.529 -2.948 1.00 . A A . 22 GLY HA2 1 1 11 5461 1 1 16 GLY HA3 H -1.364 -2.504 -4.403 1.00 . A A . 22 GLY HA3 1 1 11 5462 1 1 16 GLY N N -1.181 -0.838 -3.189 1.00 . A A . 22 GLY N 1 1 11 5463 1 1 16 GLY O O 0.145 -2.714 -1.566 1.00 . A A . 22 GLY O 1 1 11 5464 1 1 17 GLN C C 2.415 -4.353 -2.543 1.00 . A A . 23 GLN C 1 1 11 5465 1 1 17 GLN CA C 1.078 -5.078 -2.674 1.00 . A A . 23 GLN CA 1 1 11 5466 1 1 17 GLN CB C 1.244 -6.334 -3.532 1.00 . A A . 23 GLN CB 1 1 11 5467 1 1 17 GLN CD C 1.293 -8.431 -2.123 1.00 . A A . 23 GLN CD 1 1 11 5468 1 1 17 GLN CG C 0.461 -7.530 -3.015 1.00 . A A . 23 GLN CG 1 1 11 5469 1 1 17 GLN H H -0.344 -4.445 -4.109 1.00 . A A . 23 GLN H 1 1 11 5470 1 1 17 GLN HA H 0.742 -5.368 -1.690 1.00 . A A . 23 GLN HA 1 1 11 5471 1 1 17 GLN HB2 H 0.909 -6.118 -4.535 1.00 . A A . 23 GLN HB2 1 1 11 5472 1 1 17 GLN HB3 H 2.290 -6.602 -3.561 1.00 . A A . 23 GLN HB3 1 1 11 5473 1 1 17 GLN HE21 H 2.118 -6.846 -1.249 1.00 . A A . 23 GLN HE21 1 1 11 5474 1 1 17 GLN HE22 H 2.653 -8.385 -0.673 1.00 . A A . 23 GLN HE22 1 1 11 5475 1 1 17 GLN HG2 H -0.386 -7.172 -2.449 1.00 . A A . 23 GLN HG2 1 1 11 5476 1 1 17 GLN HG3 H 0.111 -8.107 -3.859 1.00 . A A . 23 GLN HG3 1 1 11 5477 1 1 17 GLN N N 0.064 -4.203 -3.252 1.00 . A A . 23 GLN N 1 1 11 5478 1 1 17 GLN NE2 N 2.103 -7.826 -1.262 1.00 . A A . 23 GLN NE2 1 1 11 5479 1 1 17 GLN O O 3.117 -4.503 -1.543 1.00 . A A . 23 GLN O 1 1 11 5480 1 1 17 GLN OE1 O 1.209 -9.656 -2.207 1.00 . A A . 23 GLN OE1 1 1 11 5481 1 1 18 ALA C C 4.096 -1.881 -2.354 1.00 . A A . 24 ALA C 1 1 11 5482 1 1 18 ALA CA C 4.011 -2.819 -3.556 1.00 . A A . 24 ALA CA 1 1 11 5483 1 1 18 ALA CB C 4.157 -2.034 -4.851 1.00 . A A . 24 ALA CB 1 1 11 5484 1 1 18 ALA H H 2.157 -3.489 -4.327 1.00 . A A . 24 ALA H 1 1 11 5485 1 1 18 ALA HA H 4.823 -3.529 -3.502 1.00 . A A . 24 ALA HA 1 1 11 5486 1 1 18 ALA HB1 H 3.585 -2.516 -5.630 1.00 . A A . 24 ALA HB1 1 1 11 5487 1 1 18 ALA HB2 H 3.791 -1.028 -4.705 1.00 . A A . 24 ALA HB2 1 1 11 5488 1 1 18 ALA HB3 H 5.198 -2.000 -5.136 1.00 . A A . 24 ALA HB3 1 1 11 5489 1 1 18 ALA N N 2.759 -3.568 -3.558 1.00 . A A . 24 ALA N 1 1 11 5490 1 1 18 ALA O O 5.183 -1.453 -1.965 1.00 . A A . 24 ALA O 1 1 11 5491 1 1 19 ALA C C 3.745 -1.202 0.539 1.00 . A A . 25 ALA C 1 1 11 5492 1 1 19 ALA CA C 2.888 -0.678 -0.612 1.00 . A A . 25 ALA CA 1 1 11 5493 1 1 19 ALA CB C 1.446 -0.498 -0.162 1.00 . A A . 25 ALA CB 1 1 11 5494 1 1 19 ALA H H 2.109 -1.935 -2.123 1.00 . A A . 25 ALA H 1 1 11 5495 1 1 19 ALA HA H 3.266 0.289 -0.914 1.00 . A A . 25 ALA HA 1 1 11 5496 1 1 19 ALA HB1 H 0.786 -0.638 -1.005 1.00 . A A . 25 ALA HB1 1 1 11 5497 1 1 19 ALA HB2 H 1.214 -1.225 0.602 1.00 . A A . 25 ALA HB2 1 1 11 5498 1 1 19 ALA HB3 H 1.315 0.497 0.236 1.00 . A A . 25 ALA HB3 1 1 11 5499 1 1 19 ALA N N 2.944 -1.564 -1.769 1.00 . A A . 25 ALA N 1 1 11 5500 1 1 19 ALA O O 4.120 -0.446 1.435 1.00 . A A . 25 ALA O 1 1 11 5501 1 1 20 LYS C C 6.355 -2.884 1.282 1.00 . A A . 26 LYS C 1 1 11 5502 1 1 20 LYS CA C 4.872 -3.100 1.563 1.00 . A A . 26 LYS CA 1 1 11 5503 1 1 20 LYS CB C 4.551 -4.592 1.700 1.00 . A A . 26 LYS CB 1 1 11 5504 1 1 20 LYS CD C 3.511 -4.014 3.960 1.00 . A A . 26 LYS CD 1 1 11 5505 1 1 20 LYS CE C 2.293 -3.468 3.225 1.00 . A A . 26 LYS CE 1 1 11 5506 1 1 20 LYS CG C 4.270 -5.053 3.132 1.00 . A A . 26 LYS CG 1 1 11 5507 1 1 20 LYS HA H 4.632 -2.602 2.486 1.00 . A A . 26 LYS HA 1 1 11 5508 1 1 20 LYS HB2 H 3.680 -4.814 1.101 1.00 . A A . 26 LYS HB2 1 1 11 5509 1 1 20 LYS HD2 H 3.181 -4.476 4.878 1.00 . A A . 26 LYS HD2 1 1 11 5510 1 1 20 LYS HE2 H 2.241 -3.923 2.248 1.00 . A A . 26 LYS HE2 1 1 11 5511 1 1 20 LYS HG2 H 3.682 -5.957 3.094 1.00 . A A . 26 LYS HG2 1 1 11 5512 1 1 20 LYS HZ1 H 3.227 -1.603 2.944 1.00 . A A . 26 LYS HZ1 1 1 11 5513 1 1 20 LYS N N 4.056 -2.497 0.515 1.00 . A A . 26 LYS N 1 1 11 5514 1 1 20 LYS NZ N 2.347 -2.013 3.068 1.00 . A A . 26 LYS NZ 1 1 11 5515 1 1 20 LYS O O 7.081 -2.367 2.132 1.00 . A A . 26 LYS O 1 1 11 5516 1 1 21 GLU C C 8.585 -1.589 -0.025 1.00 . A A . 27 GLU C 1 1 11 5517 1 1 21 GLU CA C 8.203 -3.042 -0.292 1.00 . A A . 27 GLU CA 1 1 11 5518 1 1 21 GLU CB C 8.424 -3.387 -1.766 1.00 . A A . 27 GLU CB 1 1 11 5519 1 1 21 GLU CD C 9.270 -5.434 -2.981 1.00 . A A . 27 GLU CD 1 1 11 5520 1 1 21 GLU CG C 8.190 -4.854 -2.089 1.00 . A A . 27 GLU CG 1 1 11 5521 1 1 21 GLU H H 6.181 -3.631 -0.572 1.00 . A A . 27 GLU H 1 1 11 5522 1 1 21 GLU HA H 8.812 -3.687 0.324 1.00 . A A . 27 GLU HA 1 1 11 5523 1 1 21 GLU HB2 H 7.748 -2.796 -2.367 1.00 . A A . 27 GLU HB2 1 1 11 5524 1 1 21 GLU HB3 H 9.440 -3.138 -2.033 1.00 . A A . 27 GLU HB3 1 1 11 5525 1 1 21 GLU HG2 H 8.168 -5.414 -1.166 1.00 . A A . 27 GLU HG2 1 1 11 5526 1 1 21 GLU HG3 H 7.238 -4.951 -2.590 1.00 . A A . 27 GLU HG3 1 1 11 5527 1 1 21 GLU N N 6.803 -3.246 0.080 1.00 . A A . 27 GLU N 1 1 11 5528 1 1 21 GLU O O 9.730 -1.272 0.298 1.00 . A A . 27 GLU O 1 1 11 5529 1 1 21 GLU OE1 O 9.820 -4.683 -3.813 1.00 . A A . 27 GLU OE1 1 1 11 5530 1 1 21 GLU OE2 O 9.565 -6.641 -2.848 1.00 . A A . 27 GLU OE2 1 1 11 5531 1 1 22 PHE C C 8.333 0.944 1.481 1.00 . A A . 28 PHE C 1 1 11 5532 1 1 22 PHE CA C 7.733 0.707 0.109 1.00 . A A . 28 PHE CA 1 1 11 5533 1 1 22 PHE CB C 6.351 1.345 0.059 1.00 . A A . 28 PHE CB 1 1 11 5534 1 1 22 PHE CD1 C 7.207 3.709 -0.264 1.00 . A A . 28 PHE CD1 1 1 11 5535 1 1 22 PHE CD2 C 5.246 3.318 1.018 1.00 . A A . 28 PHE CD2 1 1 11 5536 1 1 22 PHE CE1 C 7.072 5.068 -0.049 1.00 . A A . 28 PHE CE1 1 1 11 5537 1 1 22 PHE CE2 C 5.101 4.659 1.235 1.00 . A A . 28 PHE CE2 1 1 11 5538 1 1 22 PHE CG C 6.284 2.822 0.271 1.00 . A A . 28 PHE CG 1 1 11 5539 1 1 22 PHE CZ C 6.013 5.546 0.701 1.00 . A A . 28 PHE CZ 1 1 11 5540 1 1 22 PHE H H 6.697 -1.060 -0.379 1.00 . A A . 28 PHE H 1 1 11 5541 1 1 22 PHE HA H 8.364 1.137 -0.653 1.00 . A A . 28 PHE HA 1 1 11 5542 1 1 22 PHE HB2 H 5.896 1.133 -0.890 1.00 . A A . 28 PHE HB2 1 1 11 5543 1 1 22 PHE HB3 H 5.754 0.899 0.844 1.00 . A A . 28 PHE HB3 1 1 11 5544 1 1 22 PHE HD1 H 4.531 2.631 1.441 1.00 . A A . 28 PHE HD1 1 1 11 5545 1 1 22 PHE HD2 H 8.045 3.339 -0.829 1.00 . A A . 28 PHE HD2 1 1 11 5546 1 1 22 PHE HE1 H 4.286 5.007 1.848 1.00 . A A . 28 PHE HE1 1 1 11 5547 1 1 22 PHE HE2 H 7.789 5.755 -0.468 1.00 . A A . 28 PHE HE2 1 1 11 5548 1 1 22 PHE HZ H 5.902 6.607 0.870 1.00 . A A . 28 PHE HZ 1 1 11 5549 1 1 22 PHE N N 7.584 -0.721 -0.138 1.00 . A A . 28 PHE N 1 1 11 5550 1 1 22 PHE O O 9.483 1.346 1.612 1.00 . A A . 28 PHE O 1 1 11 5551 1 1 23 ILE C C 9.328 0.294 4.167 1.00 . A A . 29 ILE C 1 1 11 5552 1 1 23 ILE CA C 7.933 0.872 3.882 1.00 . A A . 29 ILE CA 1 1 11 5553 1 1 23 ILE CB C 6.872 0.298 4.844 1.00 . A A . 29 ILE CB 1 1 11 5554 1 1 23 ILE CD1 C 5.835 0.678 7.149 1.00 . A A . 29 ILE CD1 1 1 11 5555 1 1 23 ILE CG1 C 6.676 1.253 6.027 1.00 . A A . 29 ILE CG1 1 1 11 5556 1 1 23 ILE CG2 C 7.242 -1.104 5.318 1.00 . A A . 29 ILE CG2 1 1 11 5557 1 1 23 ILE H H 6.620 0.368 2.321 1.00 . A A . 29 ILE H 1 1 11 5558 1 1 23 ILE HA H 7.975 1.933 4.049 1.00 . A A . 29 ILE HA 1 1 11 5559 1 1 23 ILE HB H 5.939 0.233 4.297 1.00 . A A . 29 ILE HB 1 1 11 5560 1 1 23 ILE HD11 H 4.987 0.155 6.732 1.00 . A A . 29 ILE HD11 1 1 11 5561 1 1 23 ILE HD12 H 6.432 -0.009 7.730 1.00 . A A . 29 ILE HD12 1 1 11 5562 1 1 23 ILE HD13 H 5.487 1.479 7.784 1.00 . A A . 29 ILE HD13 1 1 11 5563 1 1 23 ILE HG12 H 7.640 1.513 6.434 1.00 . A A . 29 ILE HG12 1 1 11 5564 1 1 23 ILE HG13 H 6.187 2.152 5.672 1.00 . A A . 29 ILE HG13 1 1 11 5565 1 1 23 ILE HG21 H 7.757 -1.626 4.526 1.00 . A A . 29 ILE HG21 1 1 11 5566 1 1 23 ILE HG22 H 7.885 -1.033 6.182 1.00 . A A . 29 ILE HG22 1 1 11 5567 1 1 23 ILE HG23 H 6.344 -1.643 5.580 1.00 . A A . 29 ILE HG23 1 1 11 5568 1 1 23 ILE N N 7.526 0.687 2.502 1.00 . A A . 29 ILE N 1 1 11 5569 1 1 23 ILE O O 9.971 0.668 5.145 1.00 . A A . 29 ILE O 1 1 11 5570 1 1 24 ALA C C 12.211 -0.266 2.928 1.00 . A A . 30 ALA C 1 1 11 5571 1 1 24 ALA CA C 11.123 -1.196 3.480 1.00 . A A . 30 ALA CA 1 1 11 5572 1 1 24 ALA CB C 11.189 -2.554 2.796 1.00 . A A . 30 ALA CB 1 1 11 5573 1 1 24 ALA H H 9.255 -0.872 2.540 1.00 . A A . 30 ALA H 1 1 11 5574 1 1 24 ALA HA H 11.290 -1.342 4.537 1.00 . A A . 30 ALA HA 1 1 11 5575 1 1 24 ALA HB1 H 10.188 -2.932 2.652 1.00 . A A . 30 ALA HB1 1 1 11 5576 1 1 24 ALA HB2 H 11.676 -2.451 1.838 1.00 . A A . 30 ALA HB2 1 1 11 5577 1 1 24 ALA HB3 H 11.748 -3.241 3.413 1.00 . A A . 30 ALA HB3 1 1 11 5578 1 1 24 ALA N N 9.799 -0.606 3.308 1.00 . A A . 30 ALA N 1 1 11 5579 1 1 24 ALA O O 13.382 -0.381 3.288 1.00 . A A . 30 ALA O 1 1 11 5580 1 1 25 TRP C C 13.138 2.702 2.418 1.00 . A A . 31 TRP C 1 1 11 5581 1 1 25 TRP CA C 12.729 1.610 1.433 1.00 . A A . 31 TRP CA 1 1 11 5582 1 1 25 TRP CB C 12.069 2.250 0.191 1.00 . A A . 31 TRP CB 1 1 11 5583 1 1 25 TRP CD1 C 12.754 4.706 -0.180 1.00 . A A . 31 TRP CD1 1 1 11 5584 1 1 25 TRP CD2 C 10.782 4.463 0.854 1.00 . A A . 31 TRP CD2 1 1 11 5585 1 1 25 TRP CE2 C 11.047 5.839 0.716 1.00 . A A . 31 TRP CE2 1 1 11 5586 1 1 25 TRP CE3 C 9.593 4.075 1.477 1.00 . A A . 31 TRP CE3 1 1 11 5587 1 1 25 TRP CG C 11.889 3.750 0.275 1.00 . A A . 31 TRP CG 1 1 11 5588 1 1 25 TRP CH2 C 9.013 6.402 1.783 1.00 . A A . 31 TRP CH2 1 1 11 5589 1 1 25 TRP CZ2 C 10.163 6.819 1.180 1.00 . A A . 31 TRP CZ2 1 1 11 5590 1 1 25 TRP CZ3 C 8.725 5.045 1.935 1.00 . A A . 31 TRP CZ3 1 1 11 5591 1 1 25 TRP H H 10.862 0.689 1.803 1.00 . A A . 31 TRP H 1 1 11 5592 1 1 25 TRP HA H 13.611 1.071 1.123 1.00 . A A . 31 TRP HA 1 1 11 5593 1 1 25 TRP HB2 H 12.678 2.041 -0.675 1.00 . A A . 31 TRP HB2 1 1 11 5594 1 1 25 TRP HB3 H 11.093 1.807 0.048 1.00 . A A . 31 TRP HB3 1 1 11 5595 1 1 25 TRP HD1 H 13.692 4.492 -0.670 1.00 . A A . 31 TRP HD1 1 1 11 5596 1 1 25 TRP HE1 H 12.695 6.809 -0.143 1.00 . A A . 31 TRP HE1 1 1 11 5597 1 1 25 TRP HE3 H 9.350 3.041 1.606 1.00 . A A . 31 TRP HE3 1 1 11 5598 1 1 25 TRP HH2 H 8.307 7.126 2.155 1.00 . A A . 31 TRP HH2 1 1 11 5599 1 1 25 TRP HZ2 H 10.365 7.872 1.076 1.00 . A A . 31 TRP HZ2 1 1 11 5600 1 1 25 TRP HZ3 H 7.803 4.756 2.419 1.00 . A A . 31 TRP HZ3 1 1 11 5601 1 1 25 TRP N N 11.808 0.653 2.049 1.00 . A A . 31 TRP N 1 1 11 5602 1 1 25 TRP NE1 N 12.256 5.963 0.084 1.00 . A A . 31 TRP NE1 1 1 11 5603 1 1 25 TRP O O 14.320 3.007 2.579 1.00 . A A . 31 TRP O 1 1 11 5604 1 1 26 LEU C C 12.854 3.925 5.333 1.00 . A A . 32 LEU C 1 1 11 5605 1 1 26 LEU CA C 12.353 4.403 3.971 1.00 . A A . 32 LEU CA 1 1 11 5606 1 1 26 LEU CB C 11.072 5.241 4.097 1.00 . A A . 32 LEU CB 1 1 11 5607 1 1 26 LEU CD1 C 9.674 3.228 4.643 1.00 . A A . 32 LEU CD1 1 1 11 5608 1 1 26 LEU CD2 C 10.305 4.829 6.457 1.00 . A A . 32 LEU CD2 1 1 11 5609 1 1 26 LEU CG C 9.958 4.676 4.984 1.00 . A A . 32 LEU CG 1 1 11 5610 1 1 26 LEU H H 11.224 3.032 2.833 1.00 . A A . 32 LEU H 1 1 11 5611 1 1 26 LEU HA H 13.117 5.029 3.542 1.00 . A A . 32 LEU HA 1 1 11 5612 1 1 26 LEU HB2 H 11.341 6.211 4.478 1.00 . A A . 32 LEU HB2 1 1 11 5613 1 1 26 LEU HB3 H 10.669 5.368 3.105 1.00 . A A . 32 LEU HB3 1 1 11 5614 1 1 26 LEU HD11 H 10.597 2.679 4.604 1.00 . A A . 32 LEU HD11 1 1 11 5615 1 1 26 LEU HD12 H 9.032 2.801 5.400 1.00 . A A . 32 LEU HD12 1 1 11 5616 1 1 26 LEU HD13 H 9.180 3.173 3.681 1.00 . A A . 32 LEU HD13 1 1 11 5617 1 1 26 LEU HD21 H 10.919 5.707 6.593 1.00 . A A . 32 LEU HD21 1 1 11 5618 1 1 26 LEU HD22 H 9.397 4.932 7.031 1.00 . A A . 32 LEU HD22 1 1 11 5619 1 1 26 LEU HD23 H 10.846 3.957 6.792 1.00 . A A . 32 LEU HD23 1 1 11 5620 1 1 26 LEU HG H 9.053 5.232 4.796 1.00 . A A . 32 LEU HG 1 1 11 5621 1 1 26 LEU N N 12.138 3.310 3.036 1.00 . A A . 32 LEU N 1 1 11 5622 1 1 26 LEU O O 13.414 4.708 6.099 1.00 . A A . 32 LEU O 1 1 11 5623 1 1 27 VAL C C 14.587 1.687 6.837 1.00 . A A . 33 VAL C 1 1 11 5624 1 1 27 VAL CA C 13.117 2.101 6.910 1.00 . A A . 33 VAL CA 1 1 11 5625 1 1 27 VAL CB C 12.261 0.893 7.348 1.00 . A A . 33 VAL CB 1 1 11 5626 1 1 27 VAL CG1 C 12.850 0.225 8.584 1.00 . A A . 33 VAL CG1 1 1 11 5627 1 1 27 VAL CG2 C 10.827 1.326 7.609 1.00 . A A . 33 VAL CG2 1 1 11 5628 1 1 27 VAL H H 12.221 2.057 4.992 1.00 . A A . 33 VAL H 1 1 11 5629 1 1 27 VAL HA H 13.013 2.878 7.654 1.00 . A A . 33 VAL HA 1 1 11 5630 1 1 27 VAL HB H 12.255 0.171 6.545 1.00 . A A . 33 VAL HB 1 1 11 5631 1 1 27 VAL HG11 H 12.918 0.946 9.385 1.00 . A A . 33 VAL HG11 1 1 11 5632 1 1 27 VAL HG12 H 12.215 -0.594 8.888 1.00 . A A . 33 VAL HG12 1 1 11 5633 1 1 27 VAL HG13 H 13.836 -0.151 8.354 1.00 . A A . 33 VAL HG13 1 1 11 5634 1 1 27 VAL HG21 H 10.512 2.014 6.839 1.00 . A A . 33 VAL HG21 1 1 11 5635 1 1 27 VAL HG22 H 10.182 0.460 7.603 1.00 . A A . 33 VAL HG22 1 1 11 5636 1 1 27 VAL HG23 H 10.767 1.812 8.572 1.00 . A A . 33 VAL HG23 1 1 11 5637 1 1 27 VAL N N 12.664 2.646 5.636 1.00 . A A . 33 VAL N 1 1 11 5638 1 1 27 VAL O O 15.262 1.583 7.861 1.00 . A A . 33 VAL O 1 1 11 5639 1 1 28 ARG C C 17.368 2.280 5.293 1.00 . A A . 34 ARG C 1 1 11 5640 1 1 28 ARG CA C 16.466 1.057 5.425 1.00 . A A . 34 ARG CA 1 1 11 5641 1 1 28 ARG CB C 16.596 0.178 4.179 1.00 . A A . 34 ARG CB 1 1 11 5642 1 1 28 ARG CD C 18.653 -0.077 2.753 1.00 . A A . 34 ARG CD 1 1 11 5643 1 1 28 ARG CG C 17.957 -0.485 4.042 1.00 . A A . 34 ARG CG 1 1 11 5644 1 1 28 ARG CZ C 21.061 -0.313 3.223 1.00 . A A . 34 ARG CZ 1 1 11 5645 1 1 28 ARG H H 14.494 1.555 4.842 1.00 . A A . 34 ARG H 1 1 11 5646 1 1 28 ARG HA H 16.774 0.488 6.289 1.00 . A A . 34 ARG HA 1 1 11 5647 1 1 28 ARG HB2 H 15.844 -0.596 4.220 1.00 . A A . 34 ARG HB2 1 1 11 5648 1 1 28 ARG HB3 H 16.424 0.788 3.304 1.00 . A A . 34 ARG HB3 1 1 11 5649 1 1 28 ARG HD2 H 18.028 -0.355 1.917 1.00 . A A . 34 ARG HD2 1 1 11 5650 1 1 28 ARG HD3 H 18.791 0.994 2.757 1.00 . A A . 34 ARG HD3 1 1 11 5651 1 1 28 ARG HE H 20.010 -1.503 2.014 1.00 . A A . 34 ARG HE 1 1 11 5652 1 1 28 ARG HG2 H 18.574 -0.195 4.878 1.00 . A A . 34 ARG HG2 1 1 11 5653 1 1 28 ARG HG3 H 17.825 -1.558 4.045 1.00 . A A . 34 ARG HG3 1 1 11 5654 1 1 28 ARG HH11 H 20.168 1.229 4.180 1.00 . A A . 34 ARG HH11 1 1 11 5655 1 1 28 ARG HH12 H 21.861 1.042 4.493 1.00 . A A . 34 ARG HH12 1 1 11 5656 1 1 28 ARG HH21 H 22.236 -1.751 2.425 1.00 . A A . 34 ARG HH21 1 1 11 5657 1 1 28 ARG HH22 H 23.035 -0.650 3.497 1.00 . A A . 34 ARG HH22 1 1 11 5658 1 1 28 ARG N N 15.078 1.455 5.622 1.00 . A A . 34 ARG N 1 1 11 5659 1 1 28 ARG NE N 19.956 -0.723 2.605 1.00 . A A . 34 ARG NE 1 1 11 5660 1 1 28 ARG NH1 N 21.027 0.739 4.032 1.00 . A A . 34 ARG NH1 1 1 11 5661 1 1 28 ARG NH2 N 22.204 -0.957 3.033 1.00 . A A . 34 ARG NH2 1 1 11 5662 1 1 28 ARG O O 18.378 2.397 5.987 1.00 . A A . 34 ARG O 1 1 11 5663 1 1 29 GLY C C 16.921 5.621 3.974 1.00 . A A . 35 GLY C 1 1 11 5664 1 1 29 GLY CA C 17.782 4.391 4.190 1.00 . A A . 35 GLY CA 1 1 11 5665 1 1 29 GLY H H 16.182 3.042 3.873 1.00 . A A . 35 GLY H 1 1 11 5666 1 1 29 GLY HA2 H 18.408 4.552 5.056 1.00 . A A . 35 GLY HA2 1 1 11 5667 1 1 29 GLY HA3 H 18.413 4.251 3.325 1.00 . A A . 35 GLY HA3 1 1 11 5668 1 1 29 GLY N N 16.996 3.189 4.398 1.00 . A A . 35 GLY N 1 1 11 5669 1 1 29 GLY O O 17.203 6.687 4.521 1.00 . A A . 35 GLY O 1 1 11 5670 1 1 30 ARG C C 15.662 7.668 2.078 1.00 . A A . 36 ARG C 1 1 11 5671 1 1 30 ARG CA C 14.959 6.575 2.879 1.00 . A A . 36 ARG CA 1 1 11 5672 1 1 30 ARG CB C 14.387 7.159 4.173 1.00 . A A . 36 ARG CB 1 1 11 5673 1 1 30 ARG CD C 12.395 8.377 5.097 1.00 . A A . 36 ARG CD 1 1 11 5674 1 1 30 ARG CG C 13.378 8.272 3.943 1.00 . A A . 36 ARG CG 1 1 11 5675 1 1 30 ARG CZ C 10.638 9.932 4.342 1.00 . A A . 36 ARG CZ 1 1 11 5676 1 1 30 ARG H H 15.701 4.595 2.767 1.00 . A A . 36 ARG H 1 1 11 5677 1 1 30 ARG HA H 14.147 6.181 2.286 1.00 . A A . 36 ARG HA 1 1 11 5678 1 1 30 ARG HB2 H 13.901 6.370 4.728 1.00 . A A . 36 ARG HB2 1 1 11 5679 1 1 30 ARG HB3 H 15.197 7.555 4.766 1.00 . A A . 36 ARG HB3 1 1 11 5680 1 1 30 ARG HD2 H 12.371 7.432 5.618 1.00 . A A . 36 ARG HD2 1 1 11 5681 1 1 30 ARG HD3 H 12.733 9.150 5.771 1.00 . A A . 36 ARG HD3 1 1 11 5682 1 1 30 ARG HE H 10.405 7.962 4.563 1.00 . A A . 36 ARG HE 1 1 11 5683 1 1 30 ARG HG2 H 13.905 9.209 3.846 1.00 . A A . 36 ARG HG2 1 1 11 5684 1 1 30 ARG HG3 H 12.832 8.068 3.034 1.00 . A A . 36 ARG HG3 1 1 11 5685 1 1 30 ARG HH11 H 12.421 10.807 4.725 1.00 . A A . 36 ARG HH11 1 1 11 5686 1 1 30 ARG HH12 H 11.165 11.879 4.203 1.00 . A A . 36 ARG HH12 1 1 11 5687 1 1 30 ARG HH21 H 8.753 9.370 3.878 1.00 . A A . 36 ARG HH21 1 1 11 5688 1 1 30 ARG HH22 H 9.082 11.063 3.723 1.00 . A A . 36 ARG HH22 1 1 11 5689 1 1 30 ARG N N 15.869 5.471 3.172 1.00 . A A . 36 ARG N 1 1 11 5690 1 1 30 ARG NE N 11.045 8.701 4.643 1.00 . A A . 36 ARG NE 1 1 11 5691 1 1 30 ARG NH1 N 11.477 10.956 4.431 1.00 . A A . 36 ARG NH1 1 1 11 5692 1 1 30 ARG NH2 N 9.389 10.139 3.948 1.00 . A A . 36 ARG NH2 1 1 11 5693 1 1 30 ARG O O 15.422 7.824 0.881 1.00 . A A . 36 ARG O 1 1 11 5694 1 1 31 GLY C C 17.524 10.666 2.994 1.00 . A A . 37 GLY C 1 1 11 5695 1 1 31 GLY CA C 17.249 9.490 2.078 1.00 . A A . 37 GLY CA 1 1 11 5696 1 1 31 GLY H H 16.680 8.253 3.698 1.00 . A A . 37 GLY H 1 1 11 5697 1 1 31 GLY HA2 H 18.189 9.102 1.715 1.00 . A A . 37 GLY HA2 1 1 11 5698 1 1 31 GLY HA3 H 16.664 9.832 1.237 1.00 . A A . 37 GLY HA3 1 1 11 5699 1 1 31 GLY N N 16.528 8.422 2.745 1.00 . A A . 37 GLY N 1 1 11 5700 1 1 31 GLY O O 18.268 11.579 2.581 1.00 . A A . 37 GLY O 1 1 11 5701 1 1 31 GLY OXT O 16.994 10.673 4.125 1.00 . A A . 37 GLY OXT 1 1 11 5702 2 2 1 . C02 C 4.211 3.124 4.471 1.00 . B A . 1038 D6M C02 1 1 11 5703 2 2 1 . C04 C 1.885 2.500 4.054 1.00 . B A . 1038 D6M C04 1 1 11 5704 2 2 1 . C05 C 1.982 0.974 4.122 1.00 . B A . 1038 D6M C05 1 1 11 5705 2 2 1 . C06 C 1.392 0.276 2.906 1.00 . B A . 1038 D6M C06 1 1 11 5706 2 2 1 . C07 C 1.275 -1.228 3.081 1.00 . B A . 1038 D6M C07 1 1 11 5707 2 2 1 . C09 C 1.435 3.060 5.401 1.00 . B A . 1038 D6M C09 1 1 11 5708 2 2 1 . C12 C 5.574 3.581 3.985 1.00 . B A . 1038 D6M C12 1 1 11 5709 2 2 1 . C13 C 6.145 4.731 4.804 1.00 . B A . 1038 D6M C13 1 1 11 5710 2 2 1 . C14 C 5.769 6.083 4.207 1.00 . B A . 1038 D6M C14 1 1 11 5711 2 2 1 . C15 C 6.938 7.058 4.213 1.00 . B A . 1038 D6M C15 1 1 11 5712 2 2 1 . C16 C 6.852 8.029 5.380 1.00 . B A . 1038 D6M C16 1 1 11 5713 2 2 1 . C17 C 7.883 7.710 6.450 1.00 . B A . 1038 D6M C17 1 1 11 5714 2 2 1 . C18 C 7.353 8.018 7.841 1.00 . B A . 1038 D6M C18 1 1 11 5715 2 2 1 . C19 C 6.292 7.015 8.268 1.00 . B A . 1038 D6M C19 1 1 11 5716 2 2 1 . C20 C 6.896 5.646 8.537 1.00 . B A . 1038 D6M C20 1 1 11 5717 2 2 1 . C21 C 6.992 5.361 10.027 1.00 . B A . 1038 D6M C21 1 1 11 5718 2 2 1 . C22 C 7.106 3.871 10.303 1.00 . B A . 1038 D6M C22 1 1 11 5719 2 2 1 . C23 C 8.409 3.302 9.765 1.00 . B A . 1038 D6M C23 1 1 11 5720 2 2 1 . C24 C 8.722 1.949 10.381 1.00 . B A . 1038 D6M C24 1 1 11 5721 2 2 1 . C25 C 8.002 0.825 9.653 1.00 . B A . 1038 D6M C25 1 1 11 5722 2 2 1 . C26 C 7.747 -0.357 10.563 1.00 . B A . 1038 D6M C26 1 1 11 5723 2 2 1 . H03 H 3.263 3.421 2.736 1.00 . B A . 1038 D6M H03 1 1 11 5724 2 2 1 . H04 H 1.154 2.770 3.306 1.00 . B A . 1038 D6M H04 1 1 11 5725 2 2 1 . HP21 H 5.480 3.898 2.972 1.00 . B A . 1038 D6M HP21 1 1 11 5726 2 2 1 . HP22 H 6.254 2.745 4.025 1.00 . B A . 1038 D6M HP22 1 1 11 5727 2 2 1 . HP31 H 7.220 4.644 4.827 1.00 . B A . 1038 D6M HP31 1 1 11 5728 2 2 1 . HP32 H 5.756 4.673 5.809 1.00 . B A . 1038 D6M HP32 1 1 11 5729 2 2 1 . HP41 H 4.959 6.506 4.782 1.00 . B A . 1038 D6M HP41 1 1 11 5730 2 2 1 . HP42 H 5.450 5.939 3.189 1.00 . B A . 1038 D6M HP42 1 1 11 5731 2 2 1 . HP51 H 6.927 7.620 3.290 1.00 . B A . 1038 D6M HP51 1 1 11 5732 2 2 1 . HP52 H 7.859 6.504 4.284 1.00 . B A . 1038 D6M HP52 1 1 11 5733 2 2 1 . HP61 H 5.865 7.970 5.814 1.00 . B A . 1038 D6M HP61 1 1 11 5734 2 2 1 . HP62 H 7.027 9.030 5.015 1.00 . B A . 1038 D6M HP62 1 1 11 5735 2 2 1 . HP71 H 8.768 8.303 6.271 1.00 . B A . 1038 D6M HP71 1 1 11 5736 2 2 1 . HP72 H 8.132 6.661 6.395 1.00 . B A . 1038 D6M HP72 1 1 11 5737 2 2 1 . HP81 H 6.920 9.008 7.839 1.00 . B A . 1038 D6M HP81 1 1 11 5738 2 2 1 . HP82 H 8.171 7.982 8.544 1.00 . B A . 1038 D6M HP82 1 1 11 5739 2 2 1 . HP91 H 5.557 6.927 7.481 1.00 . B A . 1038 D6M HP91 1 1 11 5740 2 2 1 . HP92 H 5.816 7.372 9.169 1.00 . B A . 1038 D6M HP92 1 1 11 5741 2 2 1 . HPA1 H 7.886 5.609 8.108 1.00 . B A . 1038 D6M HPA1 1 1 11 5742 2 2 1 . HPA2 H 6.274 4.892 8.077 1.00 . B A . 1038 D6M HPA2 1 1 11 5743 2 2 1 . HPB1 H 6.106 5.742 10.514 1.00 . B A . 1038 D6M HPB1 1 1 11 5744 2 2 1 . HPB2 H 7.865 5.858 10.423 1.00 . B A . 1038 D6M HPB2 1 1 11 5745 2 2 1 . HPC1 H 6.279 3.363 9.829 1.00 . B A . 1038 D6M HPC1 1 1 11 5746 2 2 1 . HPC2 H 7.067 3.708 11.369 1.00 . B A . 1038 D6M HPC2 1 1 11 5747 2 2 1 . HPD1 H 9.212 3.988 9.995 1.00 . B A . 1038 D6M HPD1 1 1 11 5748 2 2 1 . HPD2 H 8.326 3.189 8.694 1.00 . B A . 1038 D6M HPD2 1 1 11 5749 2 2 1 . HPE1 H 8.411 1.954 11.415 1.00 . B A . 1038 D6M HPE1 1 1 11 5750 2 2 1 . HPE2 H 9.787 1.776 10.325 1.00 . B A . 1038 D6M HPE2 1 1 11 5751 2 2 1 . HPF1 H 8.608 0.496 8.822 1.00 . B A . 1038 D6M HPF1 1 1 11 5752 2 2 1 . HPF2 H 7.052 1.188 9.292 1.00 . B A . 1038 D6M HPF2 1 1 11 5753 2 2 1 . HPG1 H 7.042 -1.027 10.094 1.00 . B A . 1038 D6M HPG1 1 1 11 5754 2 2 1 . HPG2 H 7.343 -0.009 11.502 1.00 . B A . 1038 D6M HPG2 1 1 11 5755 2 2 1 . HPG3 H 8.675 -0.880 10.743 1.00 . B A . 1038 D6M HPG3 1 1 11 5756 2 2 1 . HQ21 H 0.407 0.678 2.719 1.00 . B A . 1038 D6M HQ21 1 1 11 5757 2 2 1 . HQ22 H 2.026 0.474 2.055 1.00 . B A . 1038 D6M HQ22 1 1 11 5758 2 2 1 . HQ31 H 3.023 0.697 4.198 1.00 . B A . 1038 D6M HQ31 1 1 11 5759 2 2 1 . HQ32 H 1.459 0.627 5.000 1.00 . B A . 1038 D6M HQ32 1 1 11 5760 2 2 1 . N03 N 3.169 3.068 3.645 1.00 . B A . 1038 D6M N03 1 1 11 5761 2 2 1 . O01 O 4.115 2.697 5.622 1.00 . B A . 1038 D6M O01 1 1 11 5762 2 2 1 . O08 O 0.152 -1.711 3.230 1.00 . B A . 1038 D6M O08 1 1 11 5763 2 2 1 . O10 O 0.541 2.451 6.025 1.00 . B A . 1038 D6M O10 1 1 11 5764 2 2 1 . O11 O 1.979 4.103 5.819 1.00 . B A . 1038 D6M O11 1 1 12 5765 1 1 1 HIS C C -19.835 1.213 12.240 1.00 . A A . 7 HIS C 1 1 12 5766 1 1 1 HIS CA C -19.953 2.245 13.356 1.00 . A A . 7 HIS CA 1 1 12 5767 1 1 1 HIS CB C -18.808 3.255 13.265 1.00 . A A . 7 HIS CB 1 1 12 5768 1 1 1 HIS CD2 C -16.435 2.549 12.491 1.00 . A A . 7 HIS CD2 1 1 12 5769 1 1 1 HIS CE1 C -15.780 1.555 14.332 1.00 . A A . 7 HIS CE1 1 1 12 5770 1 1 1 HIS CG C -17.451 2.634 13.382 1.00 . A A . 7 HIS CG 1 1 12 5771 1 1 1 HIS H1 H -19.137 0.901 14.683 1.00 . A A . 7 HIS H1 1 1 12 5772 1 1 1 HIS H2 H -19.734 2.342 15.399 1.00 . A A . 7 HIS H2 1 1 12 5773 1 1 1 HIS H3 H -20.827 1.137 14.853 1.00 . A A . 7 HIS H3 1 1 12 5774 1 1 1 HIS HA H -20.895 2.765 13.257 1.00 . A A . 7 HIS HA 1 1 12 5775 1 1 1 HIS HB2 H -18.859 3.762 12.313 1.00 . A A . 7 HIS HB2 1 1 12 5776 1 1 1 HIS HB3 H -18.913 3.980 14.059 1.00 . A A . 7 HIS HB3 1 1 12 5777 1 1 1 HIS HD1 H -17.520 1.894 15.354 1.00 . A A . 7 HIS HD1 1 1 12 5778 1 1 1 HIS HD2 H -16.432 2.940 11.483 1.00 . A A . 7 HIS HD2 1 1 12 5779 1 1 1 HIS HE1 H -15.181 1.020 15.054 1.00 . A A . 7 HIS HE1 1 1 12 5780 1 1 1 HIS HE2 H -14.513 1.739 12.734 1.00 . A A . 7 HIS HE2 1 1 12 5781 1 1 1 HIS N N -19.909 1.598 14.693 1.00 . A A . 7 HIS N 1 1 12 5782 1 1 1 HIS ND1 N -17.009 2.000 14.525 1.00 . A A . 7 HIS ND1 1 1 12 5783 1 1 1 HIS NE2 N -15.409 1.875 13.106 1.00 . A A . 7 HIS NE2 1 1 12 5784 1 1 1 HIS O O -19.199 0.173 12.407 1.00 . A A . 7 HIS O 1 1 12 5785 1 1 2 ALA C C -19.075 0.680 9.239 1.00 . A A . 8 ALA C 1 1 12 5786 1 1 2 ALA CA C -20.418 0.605 9.957 1.00 . A A . 8 ALA CA 1 1 12 5787 1 1 2 ALA CB C -21.550 0.928 8.994 1.00 . A A . 8 ALA CB 1 1 12 5788 1 1 2 ALA H H -20.945 2.352 11.028 1.00 . A A . 8 ALA H 1 1 12 5789 1 1 2 ALA HA H -20.564 -0.401 10.322 1.00 . A A . 8 ALA HA 1 1 12 5790 1 1 2 ALA HB1 H -21.805 1.975 9.076 1.00 . A A . 8 ALA HB1 1 1 12 5791 1 1 2 ALA HB2 H -21.237 0.712 7.984 1.00 . A A . 8 ALA HB2 1 1 12 5792 1 1 2 ALA HB3 H -22.414 0.328 9.240 1.00 . A A . 8 ALA HB3 1 1 12 5793 1 1 2 ALA N N -20.453 1.508 11.101 1.00 . A A . 8 ALA N 1 1 12 5794 1 1 2 ALA O O -18.415 1.719 9.241 1.00 . A A . 8 ALA O 1 1 12 5795 1 1 3 GLU C C -17.648 -0.493 6.393 1.00 . A A . 9 GLU C 1 1 12 5796 1 1 3 GLU CA C -17.413 -0.490 7.900 1.00 . A A . 9 GLU CA 1 1 12 5797 1 1 3 GLU CB C -16.627 -1.737 8.309 1.00 . A A . 9 GLU CB 1 1 12 5798 1 1 3 GLU CD C -16.667 -4.241 7.989 1.00 . A A . 9 GLU CD 1 1 12 5799 1 1 3 GLU CG C -17.467 -3.003 8.340 1.00 . A A . 9 GLU CG 1 1 12 5800 1 1 3 GLU H H -19.247 -1.225 8.657 1.00 . A A . 9 GLU H 1 1 12 5801 1 1 3 GLU HA H -16.839 0.387 8.161 1.00 . A A . 9 GLU HA 1 1 12 5802 1 1 3 GLU HB2 H -15.818 -1.884 7.609 1.00 . A A . 9 GLU HB2 1 1 12 5803 1 1 3 GLU HB3 H -16.213 -1.581 9.295 1.00 . A A . 9 GLU HB3 1 1 12 5804 1 1 3 GLU HG2 H -17.874 -3.125 9.333 1.00 . A A . 9 GLU HG2 1 1 12 5805 1 1 3 GLU HG3 H -18.275 -2.900 7.631 1.00 . A A . 9 GLU HG3 1 1 12 5806 1 1 3 GLU N N -18.677 -0.429 8.624 1.00 . A A . 9 GLU N 1 1 12 5807 1 1 3 GLU O O -18.219 -1.436 5.846 1.00 . A A . 9 GLU O 1 1 12 5808 1 1 3 GLU OE1 O -15.424 -4.197 8.103 1.00 . A A . 9 GLU OE1 1 1 12 5809 1 1 3 GLU OE2 O -17.284 -5.256 7.600 1.00 . A A . 9 GLU OE2 1 1 12 5810 1 1 4 GLY C C -16.499 -0.317 3.535 1.00 . A A . 10 GLY C 1 1 12 5811 1 1 4 GLY CA C -17.371 0.667 4.290 1.00 . A A . 10 GLY CA 1 1 12 5812 1 1 4 GLY H H -16.753 1.288 6.217 1.00 . A A . 10 GLY H 1 1 12 5813 1 1 4 GLY HA2 H -18.406 0.475 4.046 1.00 . A A . 10 GLY HA2 1 1 12 5814 1 1 4 GLY HA3 H -17.119 1.669 3.977 1.00 . A A . 10 GLY HA3 1 1 12 5815 1 1 4 GLY N N -17.202 0.567 5.728 1.00 . A A . 10 GLY N 1 1 12 5816 1 1 4 GLY O O -15.896 -1.208 4.134 1.00 . A A . 10 GLY O 1 1 12 5817 1 1 5 THR C C -14.138 -0.806 1.624 1.00 . A A . 11 THR C 1 1 12 5818 1 1 5 THR CA C -15.626 -1.042 1.382 1.00 . A A . 11 THR CA 1 1 12 5819 1 1 5 THR CB C -15.960 -0.828 -0.095 1.00 . A A . 11 THR CB 1 1 12 5820 1 1 5 THR CG2 C -15.757 0.599 -0.555 1.00 . A A . 11 THR CG2 1 1 12 5821 1 1 5 THR H H -16.935 0.570 1.796 1.00 . A A . 11 THR H 1 1 12 5822 1 1 5 THR HA H -15.864 -2.060 1.652 1.00 . A A . 11 THR HA 1 1 12 5823 1 1 5 THR HB H -16.997 -1.082 -0.259 1.00 . A A . 11 THR HB 1 1 12 5824 1 1 5 THR HG1 H -15.367 -2.582 -0.732 1.00 . A A . 11 THR HG1 1 1 12 5825 1 1 5 THR HG21 H -15.014 1.076 0.068 1.00 . A A . 11 THR HG21 1 1 12 5826 1 1 5 THR HG22 H -15.420 0.602 -1.581 1.00 . A A . 11 THR HG22 1 1 12 5827 1 1 5 THR HG23 H -16.690 1.138 -0.481 1.00 . A A . 11 THR HG23 1 1 12 5828 1 1 5 THR N N -16.432 -0.158 2.217 1.00 . A A . 11 THR N 1 1 12 5829 1 1 5 THR O O -13.758 -0.023 2.495 1.00 . A A . 11 THR O 1 1 12 5830 1 1 5 THR OG1 O -15.164 -1.662 -0.917 1.00 . A A . 11 THR OG1 1 1 12 5831 1 1 6 PHE C C -11.123 -2.044 -0.159 1.00 . A A . 12 PHE C 1 1 12 5832 1 1 6 PHE CA C -11.852 -1.352 0.990 1.00 . A A . 12 PHE CA 1 1 12 5833 1 1 6 PHE CB C -11.394 -1.938 2.327 1.00 . A A . 12 PHE CB 1 1 12 5834 1 1 6 PHE CD1 C -8.990 -2.627 2.114 1.00 . A A . 12 PHE CD1 1 1 12 5835 1 1 6 PHE CD2 C -9.499 -0.661 3.364 1.00 . A A . 12 PHE CD2 1 1 12 5836 1 1 6 PHE CE1 C -7.644 -2.447 2.372 1.00 . A A . 12 PHE CE1 1 1 12 5837 1 1 6 PHE CE2 C -8.154 -0.475 3.625 1.00 . A A . 12 PHE CE2 1 1 12 5838 1 1 6 PHE CG C -9.931 -1.737 2.606 1.00 . A A . 12 PHE CG 1 1 12 5839 1 1 6 PHE CZ C -7.226 -1.369 3.128 1.00 . A A . 12 PHE CZ 1 1 12 5840 1 1 6 PHE H H -13.660 -2.100 0.176 1.00 . A A . 12 PHE H 1 1 12 5841 1 1 6 PHE HA H -11.616 -0.299 0.969 1.00 . A A . 12 PHE HA 1 1 12 5842 1 1 6 PHE HB2 H -11.950 -1.471 3.125 1.00 . A A . 12 PHE HB2 1 1 12 5843 1 1 6 PHE HB3 H -11.591 -3.001 2.332 1.00 . A A . 12 PHE HB3 1 1 12 5844 1 1 6 PHE HD1 H -9.316 -3.470 1.521 1.00 . A A . 12 PHE HD1 1 1 12 5845 1 1 6 PHE HD2 H -10.224 0.039 3.752 1.00 . A A . 12 PHE HD2 1 1 12 5846 1 1 6 PHE HE1 H -6.920 -3.147 1.983 1.00 . A A . 12 PHE HE1 1 1 12 5847 1 1 6 PHE HE2 H -7.830 0.368 4.216 1.00 . A A . 12 PHE HE2 1 1 12 5848 1 1 6 PHE HZ H -6.175 -1.226 3.331 1.00 . A A . 12 PHE HZ 1 1 12 5849 1 1 6 PHE N N -13.299 -1.489 0.851 1.00 . A A . 12 PHE N 1 1 12 5850 1 1 6 PHE O O -10.124 -1.536 -0.667 1.00 . A A . 12 PHE O 1 1 12 5851 1 1 7 THR C C -10.738 -3.095 -2.861 1.00 . A A . 13 THR C 1 1 12 5852 1 1 7 THR CA C -11.022 -3.975 -1.646 1.00 . A A . 13 THR CA 1 1 12 5853 1 1 7 THR CB C -11.936 -5.134 -2.047 1.00 . A A . 13 THR CB 1 1 12 5854 1 1 7 THR CG2 C -11.780 -6.353 -1.164 1.00 . A A . 13 THR CG2 1 1 12 5855 1 1 7 THR H H -12.422 -3.563 -0.112 1.00 . A A . 13 THR H 1 1 12 5856 1 1 7 THR HA H -10.087 -4.377 -1.284 1.00 . A A . 13 THR HA 1 1 12 5857 1 1 7 THR HB H -11.704 -5.427 -3.060 1.00 . A A . 13 THR HB 1 1 12 5858 1 1 7 THR HG1 H -13.791 -5.213 -2.670 1.00 . A A . 13 THR HG1 1 1 12 5859 1 1 7 THR HG21 H -11.565 -6.040 -0.152 1.00 . A A . 13 THR HG21 1 1 12 5860 1 1 7 THR HG22 H -12.695 -6.926 -1.177 1.00 . A A . 13 THR HG22 1 1 12 5861 1 1 7 THR HG23 H -10.968 -6.962 -1.532 1.00 . A A . 13 THR HG23 1 1 12 5862 1 1 7 THR N N -11.626 -3.208 -0.560 1.00 . A A . 13 THR N 1 1 12 5863 1 1 7 THR O O -9.595 -2.981 -3.303 1.00 . A A . 13 THR O 1 1 12 5864 1 1 7 THR OG1 O -13.296 -4.739 -1.998 1.00 . A A . 13 THR OG1 1 1 12 5865 1 1 8 SER C C -11.378 -0.173 -4.167 1.00 . A A . 14 SER C 1 1 12 5866 1 1 8 SER CA C -11.644 -1.619 -4.572 1.00 . A A . 14 SER CA 1 1 12 5867 1 1 8 SER CB C -12.898 -1.695 -5.444 1.00 . A A . 14 SER CB 1 1 12 5868 1 1 8 SER H H -12.674 -2.614 -3.011 1.00 . A A . 14 SER H 1 1 12 5869 1 1 8 SER HA H -10.799 -1.977 -5.141 1.00 . A A . 14 SER HA 1 1 12 5870 1 1 8 SER HB2 H -13.642 -1.014 -5.061 1.00 . A A . 14 SER HB2 1 1 12 5871 1 1 8 SER HB3 H -12.646 -1.420 -6.458 1.00 . A A . 14 SER HB3 1 1 12 5872 1 1 8 SER HG H -14.349 -2.975 -5.750 1.00 . A A . 14 SER HG 1 1 12 5873 1 1 8 SER N N -11.786 -2.481 -3.403 1.00 . A A . 14 SER N 1 1 12 5874 1 1 8 SER O O -10.568 0.514 -4.790 1.00 . A A . 14 SER O 1 1 12 5875 1 1 8 SER OG O -13.439 -3.005 -5.448 1.00 . A A . 14 SER OG 1 1 12 5876 1 1 9 ASP C C -10.410 1.999 -2.495 1.00 . A A . 15 ASP C 1 1 12 5877 1 1 9 ASP CA C -11.891 1.654 -2.639 1.00 . A A . 15 ASP CA 1 1 12 5878 1 1 9 ASP CB C -12.603 1.837 -1.297 1.00 . A A . 15 ASP CB 1 1 12 5879 1 1 9 ASP CG C -12.511 3.260 -0.781 1.00 . A A . 15 ASP CG 1 1 12 5880 1 1 9 ASP H H -12.692 -0.308 -2.664 1.00 . A A . 15 ASP H 1 1 12 5881 1 1 9 ASP HA H -12.333 2.319 -3.365 1.00 . A A . 15 ASP HA 1 1 12 5882 1 1 9 ASP HB2 H -13.646 1.584 -1.414 1.00 . A A . 15 ASP HB2 1 1 12 5883 1 1 9 ASP HB3 H -12.157 1.178 -0.567 1.00 . A A . 15 ASP HB3 1 1 12 5884 1 1 9 ASP N N -12.061 0.286 -3.122 1.00 . A A . 15 ASP N 1 1 12 5885 1 1 9 ASP O O -10.015 3.158 -2.619 1.00 . A A . 15 ASP O 1 1 12 5886 1 1 9 ASP OD1 O -12.259 4.172 -1.596 1.00 . A A . 15 ASP OD1 1 1 12 5887 1 1 9 ASP OD2 O -12.690 3.462 0.438 1.00 . A A . 15 ASP OD2 1 1 12 5888 1 1 10 VAL C C -7.471 1.226 -3.440 1.00 . A A . 16 VAL C 1 1 12 5889 1 1 10 VAL CA C -8.163 1.157 -2.080 1.00 . A A . 16 VAL CA 1 1 12 5890 1 1 10 VAL CB C -7.555 0.005 -1.249 1.00 . A A . 16 VAL CB 1 1 12 5891 1 1 10 VAL CG1 C -6.048 -0.093 -1.449 1.00 . A A . 16 VAL CG1 1 1 12 5892 1 1 10 VAL CG2 C -7.892 0.182 0.223 1.00 . A A . 16 VAL CG2 1 1 12 5893 1 1 10 VAL H H -9.977 0.079 -2.152 1.00 . A A . 16 VAL H 1 1 12 5894 1 1 10 VAL HA H -7.995 2.084 -1.551 1.00 . A A . 16 VAL HA 1 1 12 5895 1 1 10 VAL HB H -7.997 -0.922 -1.584 1.00 . A A . 16 VAL HB 1 1 12 5896 1 1 10 VAL HG11 H -5.666 0.860 -1.783 1.00 . A A . 16 VAL HG11 1 1 12 5897 1 1 10 VAL HG12 H -5.576 -0.363 -0.516 1.00 . A A . 16 VAL HG12 1 1 12 5898 1 1 10 VAL HG13 H -5.834 -0.846 -2.193 1.00 . A A . 16 VAL HG13 1 1 12 5899 1 1 10 VAL HG21 H -7.606 1.173 0.541 1.00 . A A . 16 VAL HG21 1 1 12 5900 1 1 10 VAL HG22 H -8.953 0.049 0.368 1.00 . A A . 16 VAL HG22 1 1 12 5901 1 1 10 VAL HG23 H -7.354 -0.551 0.804 1.00 . A A . 16 VAL HG23 1 1 12 5902 1 1 10 VAL N N -9.599 0.978 -2.237 1.00 . A A . 16 VAL N 1 1 12 5903 1 1 10 VAL O O -6.701 2.147 -3.710 1.00 . A A . 16 VAL O 1 1 12 5904 1 1 11 SER C C -7.297 1.497 -6.373 1.00 . A A . 17 SER C 1 1 12 5905 1 1 11 SER CA C -7.158 0.174 -5.621 1.00 . A A . 17 SER CA 1 1 12 5906 1 1 11 SER CB C -7.808 -0.950 -6.430 1.00 . A A . 17 SER CB 1 1 12 5907 1 1 11 SER H H -8.372 -0.464 -4.008 1.00 . A A . 17 SER H 1 1 12 5908 1 1 11 SER HA H -6.110 -0.048 -5.501 1.00 . A A . 17 SER HA 1 1 12 5909 1 1 11 SER HB2 H -8.771 -0.621 -6.790 1.00 . A A . 17 SER HB2 1 1 12 5910 1 1 11 SER HB3 H -7.175 -1.198 -7.270 1.00 . A A . 17 SER HB3 1 1 12 5911 1 1 11 SER HG H -7.273 -2.728 -5.804 1.00 . A A . 17 SER HG 1 1 12 5912 1 1 11 SER N N -7.752 0.241 -4.288 1.00 . A A . 17 SER N 1 1 12 5913 1 1 11 SER O O -6.533 1.777 -7.297 1.00 . A A . 17 SER O 1 1 12 5914 1 1 11 SER OG O -7.989 -2.111 -5.638 1.00 . A A . 17 SER OG 1 1 12 5915 1 1 12 SER C C -7.439 4.610 -6.305 1.00 . A A . 18 SER C 1 1 12 5916 1 1 12 SER CA C -8.523 3.583 -6.635 1.00 . A A . 18 SER CA 1 1 12 5917 1 1 12 SER CB C -9.892 4.130 -6.227 1.00 . A A . 18 SER CB 1 1 12 5918 1 1 12 SER H H -8.866 2.022 -5.250 1.00 . A A . 18 SER H 1 1 12 5919 1 1 12 SER HA H -8.523 3.414 -7.701 1.00 . A A . 18 SER HA 1 1 12 5920 1 1 12 SER HB2 H -10.667 3.542 -6.696 1.00 . A A . 18 SER HB2 1 1 12 5921 1 1 12 SER HB3 H -9.995 4.069 -5.153 1.00 . A A . 18 SER HB3 1 1 12 5922 1 1 12 SER HG H -10.970 5.669 -6.781 1.00 . A A . 18 SER HG 1 1 12 5923 1 1 12 SER N N -8.281 2.301 -5.984 1.00 . A A . 18 SER N 1 1 12 5924 1 1 12 SER O O -7.116 5.461 -7.133 1.00 . A A . 18 SER O 1 1 12 5925 1 1 12 SER OG O -10.041 5.482 -6.624 1.00 . A A . 18 SER OG 1 1 12 5926 1 1 13 TYR C C -4.456 5.000 -5.018 1.00 . A A . 19 TYR C 1 1 12 5927 1 1 13 TYR CA C -5.863 5.496 -4.682 1.00 . A A . 19 TYR CA 1 1 12 5928 1 1 13 TYR CB C -5.991 5.813 -3.183 1.00 . A A . 19 TYR CB 1 1 12 5929 1 1 13 TYR CD1 C -3.865 4.970 -2.101 1.00 . A A . 19 TYR CD1 1 1 12 5930 1 1 13 TYR CD2 C -5.915 3.883 -1.555 1.00 . A A . 19 TYR CD2 1 1 12 5931 1 1 13 TYR CE1 C -3.181 4.114 -1.259 1.00 . A A . 19 TYR CE1 1 1 12 5932 1 1 13 TYR CE2 C -5.238 3.025 -0.709 1.00 . A A . 19 TYR CE2 1 1 12 5933 1 1 13 TYR CG C -5.242 4.868 -2.265 1.00 . A A . 19 TYR CG 1 1 12 5934 1 1 13 TYR CZ C -3.872 3.144 -0.564 1.00 . A A . 19 TYR CZ 1 1 12 5935 1 1 13 TYR H H -7.193 3.856 -4.465 1.00 . A A . 19 TYR H 1 1 12 5936 1 1 13 TYR HA H -6.034 6.405 -5.237 1.00 . A A . 19 TYR HA 1 1 12 5937 1 1 13 TYR HB2 H -5.613 6.808 -3.004 1.00 . A A . 19 TYR HB2 1 1 12 5938 1 1 13 TYR HB3 H -7.035 5.779 -2.909 1.00 . A A . 19 TYR HB3 1 1 12 5939 1 1 13 TYR HD1 H -6.985 3.790 -1.670 1.00 . A A . 19 TYR HD1 1 1 12 5940 1 1 13 TYR HD2 H -3.327 5.732 -2.646 1.00 . A A . 19 TYR HD2 1 1 12 5941 1 1 13 TYR HE1 H -5.780 2.265 -0.165 1.00 . A A . 19 TYR HE1 1 1 12 5942 1 1 13 TYR HE2 H -2.112 4.209 -1.146 1.00 . A A . 19 TYR HE2 1 1 12 5943 1 1 13 TYR HH H -3.739 2.098 1.044 1.00 . A A . 19 TYR HH 1 1 12 5944 1 1 13 TYR N N -6.892 4.544 -5.094 1.00 . A A . 19 TYR N 1 1 12 5945 1 1 13 TYR O O -3.661 5.730 -5.610 1.00 . A A . 19 TYR O 1 1 12 5946 1 1 13 TYR OH O -3.195 2.291 0.277 1.00 . A A . 19 TYR OH 1 1 12 5947 1 1 14 LEU C C -2.489 3.258 -6.385 1.00 . A A . 20 LEU C 1 1 12 5948 1 1 14 LEU CA C -2.831 3.194 -4.898 1.00 . A A . 20 LEU CA 1 1 12 5949 1 1 14 LEU CB C -2.773 1.744 -4.410 1.00 . A A . 20 LEU CB 1 1 12 5950 1 1 14 LEU CD1 C -3.929 0.717 -6.385 1.00 . A A . 20 LEU CD1 1 1 12 5951 1 1 14 LEU CD2 C -3.851 -0.510 -4.207 1.00 . A A . 20 LEU CD2 1 1 12 5952 1 1 14 LEU CG C -3.930 0.856 -4.870 1.00 . A A . 20 LEU CG 1 1 12 5953 1 1 14 LEU H H -4.819 3.230 -4.162 1.00 . A A . 20 LEU H 1 1 12 5954 1 1 14 LEU HA H -2.105 3.776 -4.350 1.00 . A A . 20 LEU HA 1 1 12 5955 1 1 14 LEU HB2 H -1.849 1.306 -4.760 1.00 . A A . 20 LEU HB2 1 1 12 5956 1 1 14 LEU HB3 H -2.762 1.750 -3.330 1.00 . A A . 20 LEU HB3 1 1 12 5957 1 1 14 LEU HD11 H -2.916 0.583 -6.733 1.00 . A A . 20 LEU HD11 1 1 12 5958 1 1 14 LEU HD12 H -4.524 -0.138 -6.669 1.00 . A A . 20 LEU HD12 1 1 12 5959 1 1 14 LEU HD13 H -4.347 1.610 -6.827 1.00 . A A . 20 LEU HD13 1 1 12 5960 1 1 14 LEU HD21 H -3.982 -0.400 -3.141 1.00 . A A . 20 LEU HD21 1 1 12 5961 1 1 14 LEU HD22 H -4.629 -1.147 -4.601 1.00 . A A . 20 LEU HD22 1 1 12 5962 1 1 14 LEU HD23 H -2.887 -0.953 -4.408 1.00 . A A . 20 LEU HD23 1 1 12 5963 1 1 14 LEU HG H -4.863 1.315 -4.580 1.00 . A A . 20 LEU HG 1 1 12 5964 1 1 14 LEU N N -4.149 3.766 -4.635 1.00 . A A . 20 LEU N 1 1 12 5965 1 1 14 LEU O O -3.263 3.774 -7.190 1.00 . A A . 20 LEU O 1 1 12 5966 1 1 15 GLU C C -0.304 1.345 -8.492 1.00 . A A . 21 GLU C 1 1 12 5967 1 1 15 GLU CA C -0.876 2.711 -8.127 1.00 . A A . 21 GLU CA 1 1 12 5968 1 1 15 GLU CB C 0.178 3.797 -8.356 1.00 . A A . 21 GLU CB 1 1 12 5969 1 1 15 GLU CD C 0.743 6.256 -8.216 1.00 . A A . 21 GLU CD 1 1 12 5970 1 1 15 GLU CG C -0.354 5.209 -8.169 1.00 . A A . 21 GLU CG 1 1 12 5971 1 1 15 GLU H H -0.753 2.324 -6.051 1.00 . A A . 21 GLU H 1 1 12 5972 1 1 15 GLU HA H -1.731 2.911 -8.755 1.00 . A A . 21 GLU HA 1 1 12 5973 1 1 15 GLU HB2 H 0.990 3.647 -7.662 1.00 . A A . 21 GLU HB2 1 1 12 5974 1 1 15 GLU HB3 H 0.556 3.709 -9.364 1.00 . A A . 21 GLU HB3 1 1 12 5975 1 1 15 GLU HG2 H -1.064 5.420 -8.954 1.00 . A A . 21 GLU HG2 1 1 12 5976 1 1 15 GLU HG3 H -0.848 5.270 -7.211 1.00 . A A . 21 GLU HG3 1 1 12 5977 1 1 15 GLU N N -1.324 2.724 -6.739 1.00 . A A . 21 GLU N 1 1 12 5978 1 1 15 GLU O O -0.922 0.577 -9.228 1.00 . A A . 21 GLU O 1 1 12 5979 1 1 15 GLU OE1 O 1.876 5.948 -7.790 1.00 . A A . 21 GLU OE1 1 1 12 5980 1 1 15 GLU OE2 O 0.468 7.383 -8.678 1.00 . A A . 21 GLU OE2 1 1 12 5981 1 1 16 GLY C C 1.863 -0.967 -6.953 1.00 . A A . 22 GLY C 1 1 12 5982 1 1 16 GLY CA C 1.517 -0.227 -8.230 1.00 . A A . 22 GLY CA 1 1 12 5983 1 1 16 GLY H H 1.319 1.699 -7.377 1.00 . A A . 22 GLY H 1 1 12 5984 1 1 16 GLY HA2 H 0.848 -0.838 -8.819 1.00 . A A . 22 GLY HA2 1 1 12 5985 1 1 16 GLY HA3 H 2.423 -0.055 -8.792 1.00 . A A . 22 GLY HA3 1 1 12 5986 1 1 16 GLY N N 0.878 1.048 -7.962 1.00 . A A . 22 GLY N 1 1 12 5987 1 1 16 GLY O O 3.022 -1.308 -6.719 1.00 . A A . 22 GLY O 1 1 12 5988 1 1 17 GLN C C 1.981 -3.086 -4.974 1.00 . A A . 23 GLN C 1 1 12 5989 1 1 17 GLN CA C 1.032 -1.896 -4.847 1.00 . A A . 23 GLN CA 1 1 12 5990 1 1 17 GLN CB C -0.320 -2.366 -4.307 1.00 . A A . 23 GLN CB 1 1 12 5991 1 1 17 GLN CD C -0.639 -4.525 -3.032 1.00 . A A . 23 GLN CD 1 1 12 5992 1 1 17 GLN CG C -0.227 -3.067 -2.961 1.00 . A A . 23 GLN CG 1 1 12 5993 1 1 17 GLN H H -0.047 -0.897 -6.371 1.00 . A A . 23 GLN H 1 1 12 5994 1 1 17 GLN HA H 1.457 -1.189 -4.150 1.00 . A A . 23 GLN HA 1 1 12 5995 1 1 17 GLN HB2 H -0.968 -1.509 -4.198 1.00 . A A . 23 GLN HB2 1 1 12 5996 1 1 17 GLN HB3 H -0.760 -3.051 -5.017 1.00 . A A . 23 GLN HB3 1 1 12 5997 1 1 17 GLN HE21 H 1.185 -5.035 -3.638 1.00 . A A . 23 GLN HE21 1 1 12 5998 1 1 17 GLN HE22 H 0.056 -6.334 -3.477 1.00 . A A . 23 GLN HE22 1 1 12 5999 1 1 17 GLN HG2 H 0.793 -3.015 -2.611 1.00 . A A . 23 GLN HG2 1 1 12 6000 1 1 17 GLN HG3 H -0.873 -2.559 -2.260 1.00 . A A . 23 GLN HG3 1 1 12 6001 1 1 17 GLN N N 0.850 -1.204 -6.123 1.00 . A A . 23 GLN N 1 1 12 6002 1 1 17 GLN NE2 N 0.295 -5.385 -3.421 1.00 . A A . 23 GLN NE2 1 1 12 6003 1 1 17 GLN O O 2.689 -3.424 -4.026 1.00 . A A . 23 GLN O 1 1 12 6004 1 1 17 GLN OE1 O -1.782 -4.874 -2.739 1.00 . A A . 23 GLN OE1 1 1 12 6005 1 1 18 ALA C C 4.278 -4.613 -5.878 1.00 . A A . 24 ALA C 1 1 12 6006 1 1 18 ALA CA C 2.861 -4.870 -6.384 1.00 . A A . 24 ALA CA 1 1 12 6007 1 1 18 ALA CB C 2.883 -5.214 -7.864 1.00 . A A . 24 ALA CB 1 1 12 6008 1 1 18 ALA H H 1.408 -3.404 -6.864 1.00 . A A . 24 ALA H 1 1 12 6009 1 1 18 ALA HA H 2.448 -5.713 -5.849 1.00 . A A . 24 ALA HA 1 1 12 6010 1 1 18 ALA HB1 H 2.006 -4.803 -8.341 1.00 . A A . 24 ALA HB1 1 1 12 6011 1 1 18 ALA HB2 H 3.769 -4.796 -8.317 1.00 . A A . 24 ALA HB2 1 1 12 6012 1 1 18 ALA HB3 H 2.889 -6.287 -7.983 1.00 . A A . 24 ALA HB3 1 1 12 6013 1 1 18 ALA N N 1.994 -3.718 -6.144 1.00 . A A . 24 ALA N 1 1 12 6014 1 1 18 ALA O O 4.778 -5.329 -5.011 1.00 . A A . 24 ALA O 1 1 12 6015 1 1 19 ALA C C 6.241 -2.286 -4.816 1.00 . A A . 25 ALA C 1 1 12 6016 1 1 19 ALA CA C 6.268 -3.221 -6.016 1.00 . A A . 25 ALA CA 1 1 12 6017 1 1 19 ALA CB C 7.011 -2.578 -7.176 1.00 . A A . 25 ALA CB 1 1 12 6018 1 1 19 ALA H H 4.461 -3.043 -7.101 1.00 . A A . 25 ALA H 1 1 12 6019 1 1 19 ALA HA H 6.790 -4.127 -5.740 1.00 . A A . 25 ALA HA 1 1 12 6020 1 1 19 ALA HB1 H 6.366 -1.861 -7.663 1.00 . A A . 25 ALA HB1 1 1 12 6021 1 1 19 ALA HB2 H 7.892 -2.075 -6.805 1.00 . A A . 25 ALA HB2 1 1 12 6022 1 1 19 ALA HB3 H 7.302 -3.339 -7.884 1.00 . A A . 25 ALA HB3 1 1 12 6023 1 1 19 ALA N N 4.915 -3.580 -6.419 1.00 . A A . 25 ALA N 1 1 12 6024 1 1 19 ALA O O 6.977 -2.479 -3.850 1.00 . A A . 25 ALA O 1 1 12 6025 1 1 20 LYS C C 5.083 -1.017 -2.446 1.00 . A A . 26 LYS C 1 1 12 6026 1 1 20 LYS CA C 5.251 -0.311 -3.790 1.00 . A A . 26 LYS CA 1 1 12 6027 1 1 20 LYS CB C 4.067 0.629 -4.041 1.00 . A A . 26 LYS CB 1 1 12 6028 1 1 20 LYS CD C 5.531 1.650 -5.833 1.00 . A A . 26 LYS CD 1 1 12 6029 1 1 20 LYS CE C 6.259 2.522 -4.823 1.00 . A A . 26 LYS CE 1 1 12 6030 1 1 20 LYS CG C 4.108 1.342 -5.388 1.00 . A A . 26 LYS CG 1 1 12 6031 1 1 20 LYS HA H 6.159 0.272 -3.761 1.00 . A A . 26 LYS HA 1 1 12 6032 1 1 20 LYS HB2 H 3.154 0.055 -3.992 1.00 . A A . 26 LYS HB2 1 1 12 6033 1 1 20 LYS HD2 H 6.071 0.722 -5.946 1.00 . A A . 26 LYS HD2 1 1 12 6034 1 1 20 LYS HE2 H 5.998 3.554 -5.004 1.00 . A A . 26 LYS HE2 1 1 12 6035 1 1 20 LYS HG2 H 3.642 0.713 -6.130 1.00 . A A . 26 LYS HG2 1 1 12 6036 1 1 20 LYS HZ1 H 8.203 2.196 -4.090 1.00 . A A . 26 LYS HZ1 1 1 12 6037 1 1 20 LYS N N 5.379 -1.275 -4.879 1.00 . A A . 26 LYS N 1 1 12 6038 1 1 20 LYS NZ N 7.710 2.376 -4.918 1.00 . A A . 26 LYS NZ 1 1 12 6039 1 1 20 LYS O O 5.400 -0.455 -1.401 1.00 . A A . 26 LYS O 1 1 12 6040 1 1 21 GLU C C 5.566 -2.906 -0.313 1.00 . A A . 27 GLU C 1 1 12 6041 1 1 21 GLU CA C 4.382 -3.041 -1.267 1.00 . A A . 27 GLU CA 1 1 12 6042 1 1 21 GLU CB C 4.180 -4.516 -1.623 1.00 . A A . 27 GLU CB 1 1 12 6043 1 1 21 GLU CD C 5.176 -6.619 -2.605 1.00 . A A . 27 GLU CD 1 1 12 6044 1 1 21 GLU CG C 5.412 -5.171 -2.224 1.00 . A A . 27 GLU CG 1 1 12 6045 1 1 21 GLU H H 4.355 -2.650 -3.348 1.00 . A A . 27 GLU H 1 1 12 6046 1 1 21 GLU HA H 3.494 -2.673 -0.778 1.00 . A A . 27 GLU HA 1 1 12 6047 1 1 21 GLU HB2 H 3.914 -5.056 -0.727 1.00 . A A . 27 GLU HB2 1 1 12 6048 1 1 21 GLU HB3 H 3.373 -4.597 -2.335 1.00 . A A . 27 GLU HB3 1 1 12 6049 1 1 21 GLU HG2 H 5.699 -4.624 -3.109 1.00 . A A . 27 GLU HG2 1 1 12 6050 1 1 21 GLU HG3 H 6.214 -5.130 -1.501 1.00 . A A . 27 GLU HG3 1 1 12 6051 1 1 21 GLU N N 4.587 -2.254 -2.483 1.00 . A A . 27 GLU N 1 1 12 6052 1 1 21 GLU O O 5.407 -2.974 0.906 1.00 . A A . 27 GLU O 1 1 12 6053 1 1 21 GLU OE1 O 4.004 -6.991 -2.826 1.00 . A A . 27 GLU OE1 1 1 12 6054 1 1 21 GLU OE2 O 6.162 -7.381 -2.683 1.00 . A A . 27 GLU OE2 1 1 12 6055 1 1 22 PHE C C 7.925 -1.311 0.765 1.00 . A A . 28 PHE C 1 1 12 6056 1 1 22 PHE CA C 7.965 -2.581 -0.085 1.00 . A A . 28 PHE CA 1 1 12 6057 1 1 22 PHE CB C 9.200 -2.594 -1.002 1.00 . A A . 28 PHE CB 1 1 12 6058 1 1 22 PHE CD1 C 10.078 -0.243 -0.813 1.00 . A A . 28 PHE CD1 1 1 12 6059 1 1 22 PHE CD2 C 9.367 -1.020 -2.952 1.00 . A A . 28 PHE CD2 1 1 12 6060 1 1 22 PHE CE1 C 10.405 0.982 -1.363 1.00 . A A . 28 PHE CE1 1 1 12 6061 1 1 22 PHE CE2 C 9.692 0.203 -3.507 1.00 . A A . 28 PHE CE2 1 1 12 6062 1 1 22 PHE CG C 9.555 -1.257 -1.600 1.00 . A A . 28 PHE CG 1 1 12 6063 1 1 22 PHE CZ C 10.211 1.205 -2.711 1.00 . A A . 28 PHE CZ 1 1 12 6064 1 1 22 PHE H H 6.815 -2.679 -1.857 1.00 . A A . 28 PHE H 1 1 12 6065 1 1 22 PHE HA H 8.018 -3.432 0.577 1.00 . A A . 28 PHE HA 1 1 12 6066 1 1 22 PHE HB2 H 10.052 -2.937 -0.437 1.00 . A A . 28 PHE HB2 1 1 12 6067 1 1 22 PHE HB3 H 9.017 -3.283 -1.817 1.00 . A A . 28 PHE HB3 1 1 12 6068 1 1 22 PHE HD1 H 10.230 -0.416 0.242 1.00 . A A . 28 PHE HD1 1 1 12 6069 1 1 22 PHE HD2 H 8.966 -1.802 -3.576 1.00 . A A . 28 PHE HD2 1 1 12 6070 1 1 22 PHE HE1 H 10.811 1.763 -0.739 1.00 . A A . 28 PHE HE1 1 1 12 6071 1 1 22 PHE HE2 H 9.539 0.375 -4.563 1.00 . A A . 28 PHE HE2 1 1 12 6072 1 1 22 PHE HZ H 10.465 2.162 -3.142 1.00 . A A . 28 PHE HZ 1 1 12 6073 1 1 22 PHE N N 6.753 -2.719 -0.880 1.00 . A A . 28 PHE N 1 1 12 6074 1 1 22 PHE O O 8.343 -1.316 1.922 1.00 . A A . 28 PHE O 1 1 12 6075 1 1 23 ILE C C 6.697 0.876 2.272 1.00 . A A . 29 ILE C 1 1 12 6076 1 1 23 ILE CA C 7.330 1.051 0.892 1.00 . A A . 29 ILE CA 1 1 12 6077 1 1 23 ILE CB C 6.521 2.091 0.083 1.00 . A A . 29 ILE CB 1 1 12 6078 1 1 23 ILE CD1 C 6.499 4.596 -0.368 1.00 . A A . 29 ILE CD1 1 1 12 6079 1 1 23 ILE CG1 C 6.757 3.496 0.639 1.00 . A A . 29 ILE CG1 1 1 12 6080 1 1 23 ILE CG2 C 5.035 1.756 0.092 1.00 . A A . 29 ILE CG2 1 1 12 6081 1 1 23 ILE H H 7.103 -0.281 -0.741 1.00 . A A . 29 ILE H 1 1 12 6082 1 1 23 ILE HA H 8.334 1.430 1.017 1.00 . A A . 29 ILE HA 1 1 12 6083 1 1 23 ILE HB H 6.863 2.058 -0.940 1.00 . A A . 29 ILE HB 1 1 12 6084 1 1 23 ILE HD11 H 5.690 4.303 -1.021 1.00 . A A . 29 ILE HD11 1 1 12 6085 1 1 23 ILE HD12 H 6.233 5.505 0.151 1.00 . A A . 29 ILE HD12 1 1 12 6086 1 1 23 ILE HD13 H 7.391 4.763 -0.954 1.00 . A A . 29 ILE HD13 1 1 12 6087 1 1 23 ILE HG12 H 6.100 3.658 1.481 1.00 . A A . 29 ILE HG12 1 1 12 6088 1 1 23 ILE HG13 H 7.783 3.579 0.968 1.00 . A A . 29 ILE HG13 1 1 12 6089 1 1 23 ILE HG21 H 4.898 0.734 0.412 1.00 . A A . 29 ILE HG21 1 1 12 6090 1 1 23 ILE HG22 H 4.519 2.418 0.772 1.00 . A A . 29 ILE HG22 1 1 12 6091 1 1 23 ILE HG23 H 4.632 1.878 -0.903 1.00 . A A . 29 ILE HG23 1 1 12 6092 1 1 23 ILE N N 7.420 -0.224 0.184 1.00 . A A . 29 ILE N 1 1 12 6093 1 1 23 ILE O O 7.005 1.616 3.205 1.00 . A A . 29 ILE O 1 1 12 6094 1 1 24 ALA C C 6.138 -0.673 4.768 1.00 . A A . 30 ALA C 1 1 12 6095 1 1 24 ALA CA C 5.138 -0.383 3.653 1.00 . A A . 30 ALA CA 1 1 12 6096 1 1 24 ALA CB C 4.177 -1.552 3.490 1.00 . A A . 30 ALA CB 1 1 12 6097 1 1 24 ALA H H 5.612 -0.666 1.610 1.00 . A A . 30 ALA H 1 1 12 6098 1 1 24 ALA HA H 4.561 0.490 3.918 1.00 . A A . 30 ALA HA 1 1 12 6099 1 1 24 ALA HB1 H 4.657 -2.337 2.924 1.00 . A A . 30 ALA HB1 1 1 12 6100 1 1 24 ALA HB2 H 3.900 -1.928 4.463 1.00 . A A . 30 ALA HB2 1 1 12 6101 1 1 24 ALA HB3 H 3.292 -1.220 2.966 1.00 . A A . 30 ALA HB3 1 1 12 6102 1 1 24 ALA N N 5.814 -0.109 2.391 1.00 . A A . 30 ALA N 1 1 12 6103 1 1 24 ALA O O 5.835 -0.494 5.947 1.00 . A A . 30 ALA O 1 1 12 6104 1 1 25 TRP C C 8.976 -0.168 5.952 1.00 . A A . 31 TRP C 1 1 12 6105 1 1 25 TRP CA C 8.369 -1.444 5.363 1.00 . A A . 31 TRP CA 1 1 12 6106 1 1 25 TRP CB C 9.447 -2.333 4.711 1.00 . A A . 31 TRP CB 1 1 12 6107 1 1 25 TRP CD1 C 11.595 -1.550 5.878 1.00 . A A . 31 TRP CD1 1 1 12 6108 1 1 25 TRP CD2 C 11.642 -1.366 3.647 1.00 . A A . 31 TRP CD2 1 1 12 6109 1 1 25 TRP CE2 C 12.868 -0.903 4.161 1.00 . A A . 31 TRP CE2 1 1 12 6110 1 1 25 TRP CE3 C 11.443 -1.347 2.263 1.00 . A A . 31 TRP CE3 1 1 12 6111 1 1 25 TRP CG C 10.840 -1.773 4.762 1.00 . A A . 31 TRP CG 1 1 12 6112 1 1 25 TRP CH2 C 13.664 -0.421 1.990 1.00 . A A . 31 TRP CH2 1 1 12 6113 1 1 25 TRP CZ2 C 13.887 -0.427 3.340 1.00 . A A . 31 TRP CZ2 1 1 12 6114 1 1 25 TRP CZ3 C 12.456 -0.875 1.450 1.00 . A A . 31 TRP CZ3 1 1 12 6115 1 1 25 TRP H H 7.514 -1.253 3.436 1.00 . A A . 31 TRP H 1 1 12 6116 1 1 25 TRP HA H 7.902 -1.998 6.163 1.00 . A A . 31 TRP HA 1 1 12 6117 1 1 25 TRP HB2 H 9.460 -3.288 5.213 1.00 . A A . 31 TRP HB2 1 1 12 6118 1 1 25 TRP HB3 H 9.189 -2.487 3.673 1.00 . A A . 31 TRP HB3 1 1 12 6119 1 1 25 TRP HD1 H 11.267 -1.757 6.886 1.00 . A A . 31 TRP HD1 1 1 12 6120 1 1 25 TRP HE1 H 13.530 -0.778 6.148 1.00 . A A . 31 TRP HE1 1 1 12 6121 1 1 25 TRP HE3 H 10.518 -1.694 1.827 1.00 . A A . 31 TRP HE3 1 1 12 6122 1 1 25 TRP HH2 H 14.428 -0.061 1.317 1.00 . A A . 31 TRP HH2 1 1 12 6123 1 1 25 TRP HZ2 H 14.824 -0.073 3.739 1.00 . A A . 31 TRP HZ2 1 1 12 6124 1 1 25 TRP HZ3 H 12.319 -0.854 0.379 1.00 . A A . 31 TRP HZ3 1 1 12 6125 1 1 25 TRP N N 7.330 -1.126 4.390 1.00 . A A . 31 TRP N 1 1 12 6126 1 1 25 TRP NE1 N 12.815 -1.024 5.525 1.00 . A A . 31 TRP NE1 1 1 12 6127 1 1 25 TRP O O 8.909 0.059 7.160 1.00 . A A . 31 TRP O 1 1 12 6128 1 1 26 LEU C C 9.191 2.808 6.236 1.00 . A A . 32 LEU C 1 1 12 6129 1 1 26 LEU CA C 10.201 1.897 5.543 1.00 . A A . 32 LEU CA 1 1 12 6130 1 1 26 LEU CB C 10.849 2.632 4.366 1.00 . A A . 32 LEU CB 1 1 12 6131 1 1 26 LEU CD1 C 9.628 3.957 2.618 1.00 . A A . 32 LEU CD1 1 1 12 6132 1 1 26 LEU CD2 C 10.930 1.925 1.960 1.00 . A A . 32 LEU CD2 1 1 12 6133 1 1 26 LEU CG C 10.077 2.568 3.045 1.00 . A A . 32 LEU CG 1 1 12 6134 1 1 26 LEU H H 9.606 0.416 4.147 1.00 . A A . 32 LEU H 1 1 12 6135 1 1 26 LEU HA H 10.970 1.636 6.254 1.00 . A A . 32 LEU HA 1 1 12 6136 1 1 26 LEU HB2 H 10.965 3.671 4.642 1.00 . A A . 32 LEU HB2 1 1 12 6137 1 1 26 LEU HB3 H 11.830 2.211 4.206 1.00 . A A . 32 LEU HB3 1 1 12 6138 1 1 26 LEU HD11 H 10.296 4.695 3.036 1.00 . A A . 32 LEU HD11 1 1 12 6139 1 1 26 LEU HD12 H 9.645 4.025 1.541 1.00 . A A . 32 LEU HD12 1 1 12 6140 1 1 26 LEU HD13 H 8.624 4.136 2.974 1.00 . A A . 32 LEU HD13 1 1 12 6141 1 1 26 LEU HD21 H 11.671 1.286 2.417 1.00 . A A . 32 LEU HD21 1 1 12 6142 1 1 26 LEU HD22 H 10.300 1.336 1.309 1.00 . A A . 32 LEU HD22 1 1 12 6143 1 1 26 LEU HD23 H 11.423 2.695 1.386 1.00 . A A . 32 LEU HD23 1 1 12 6144 1 1 26 LEU HG H 9.195 1.961 3.180 1.00 . A A . 32 LEU HG 1 1 12 6145 1 1 26 LEU N N 9.576 0.654 5.096 1.00 . A A . 32 LEU N 1 1 12 6146 1 1 26 LEU O O 9.537 3.530 7.171 1.00 . A A . 32 LEU O 1 1 12 6147 1 1 27 VAL C C 6.715 3.278 7.850 1.00 . A A . 33 VAL C 1 1 12 6148 1 1 27 VAL CA C 6.894 3.597 6.367 1.00 . A A . 33 VAL CA 1 1 12 6149 1 1 27 VAL CB C 5.547 3.408 5.639 1.00 . A A . 33 VAL CB 1 1 12 6150 1 1 27 VAL CG1 C 4.456 4.247 6.290 1.00 . A A . 33 VAL CG1 1 1 12 6151 1 1 27 VAL CG2 C 5.683 3.760 4.165 1.00 . A A . 33 VAL CG2 1 1 12 6152 1 1 27 VAL H H 7.723 2.176 5.032 1.00 . A A . 33 VAL H 1 1 12 6153 1 1 27 VAL HA H 7.191 4.632 6.267 1.00 . A A . 33 VAL HA 1 1 12 6154 1 1 27 VAL HB H 5.263 2.368 5.713 1.00 . A A . 33 VAL HB 1 1 12 6155 1 1 27 VAL HG11 H 4.709 5.294 6.207 1.00 . A A . 33 VAL HG11 1 1 12 6156 1 1 27 VAL HG12 H 3.515 4.063 5.793 1.00 . A A . 33 VAL HG12 1 1 12 6157 1 1 27 VAL HG13 H 4.371 3.979 7.333 1.00 . A A . 33 VAL HG13 1 1 12 6158 1 1 27 VAL HG21 H 6.727 3.765 3.890 1.00 . A A . 33 VAL HG21 1 1 12 6159 1 1 27 VAL HG22 H 5.158 3.026 3.570 1.00 . A A . 33 VAL HG22 1 1 12 6160 1 1 27 VAL HG23 H 5.259 4.737 3.987 1.00 . A A . 33 VAL HG23 1 1 12 6161 1 1 27 VAL N N 7.943 2.771 5.779 1.00 . A A . 33 VAL N 1 1 12 6162 1 1 27 VAL O O 6.266 4.122 8.626 1.00 . A A . 33 VAL O 1 1 12 6163 1 1 28 ARG C C 8.290 1.744 10.347 1.00 . A A . 34 ARG C 1 1 12 6164 1 1 28 ARG CA C 6.950 1.630 9.626 1.00 . A A . 34 ARG CA 1 1 12 6165 1 1 28 ARG CB C 6.436 0.189 9.694 1.00 . A A . 34 ARG CB 1 1 12 6166 1 1 28 ARG CD C 4.664 -1.399 10.501 1.00 . A A . 34 ARG CD 1 1 12 6167 1 1 28 ARG CG C 5.096 0.055 10.397 1.00 . A A . 34 ARG CG 1 1 12 6168 1 1 28 ARG CZ C 3.157 -1.667 8.569 1.00 . A A . 34 ARG CZ 1 1 12 6169 1 1 28 ARG H H 7.423 1.428 7.573 1.00 . A A . 34 ARG H 1 1 12 6170 1 1 28 ARG HA H 6.238 2.280 10.111 1.00 . A A . 34 ARG HA 1 1 12 6171 1 1 28 ARG HB2 H 6.330 -0.191 8.689 1.00 . A A . 34 ARG HB2 1 1 12 6172 1 1 28 ARG HB3 H 7.158 -0.416 10.224 1.00 . A A . 34 ARG HB3 1 1 12 6173 1 1 28 ARG HD2 H 5.481 -1.976 10.908 1.00 . A A . 34 ARG HD2 1 1 12 6174 1 1 28 ARG HD3 H 3.814 -1.462 11.164 1.00 . A A . 34 ARG HD3 1 1 12 6175 1 1 28 ARG HE H 4.924 -2.572 8.777 1.00 . A A . 34 ARG HE 1 1 12 6176 1 1 28 ARG HG2 H 5.179 0.467 11.392 1.00 . A A . 34 ARG HG2 1 1 12 6177 1 1 28 ARG HG3 H 4.351 0.604 9.839 1.00 . A A . 34 ARG HG3 1 1 12 6178 1 1 28 ARG HH11 H 2.467 -0.417 10.002 1.00 . A A . 34 ARG HH11 1 1 12 6179 1 1 28 ARG HH12 H 1.428 -0.622 8.633 1.00 . A A . 34 ARG HH12 1 1 12 6180 1 1 28 ARG HH21 H 3.557 -2.843 6.975 1.00 . A A . 34 ARG HH21 1 1 12 6181 1 1 28 ARG HH22 H 2.045 -1.999 6.914 1.00 . A A . 34 ARG HH22 1 1 12 6182 1 1 28 ARG N N 7.071 2.057 8.237 1.00 . A A . 34 ARG N 1 1 12 6183 1 1 28 ARG NE N 4.293 -1.953 9.201 1.00 . A A . 34 ARG NE 1 1 12 6184 1 1 28 ARG NH1 N 2.279 -0.834 9.113 1.00 . A A . 34 ARG NH1 1 1 12 6185 1 1 28 ARG NH2 N 2.899 -2.215 7.389 1.00 . A A . 34 ARG NH2 1 1 12 6186 1 1 28 ARG O O 8.587 0.967 11.253 1.00 . A A . 34 ARG O 1 1 12 6187 1 1 29 GLY C C 11.531 2.809 9.555 1.00 . A A . 35 GLY C 1 1 12 6188 1 1 29 GLY CA C 10.395 2.918 10.553 1.00 . A A . 35 GLY CA 1 1 12 6189 1 1 29 GLY H H 8.806 3.308 9.209 1.00 . A A . 35 GLY H 1 1 12 6190 1 1 29 GLY HA2 H 10.420 3.899 11.005 1.00 . A A . 35 GLY HA2 1 1 12 6191 1 1 29 GLY HA3 H 10.534 2.174 11.323 1.00 . A A . 35 GLY HA3 1 1 12 6192 1 1 29 GLY N N 9.096 2.719 9.936 1.00 . A A . 35 GLY N 1 1 12 6193 1 1 29 GLY O O 11.959 1.708 9.209 1.00 . A A . 35 GLY O 1 1 12 6194 1 1 30 ARG C C 14.208 4.947 8.571 1.00 . A A . 36 ARG C 1 1 12 6195 1 1 30 ARG CA C 13.114 3.983 8.126 1.00 . A A . 36 ARG CA 1 1 12 6196 1 1 30 ARG CB C 12.591 4.389 6.746 1.00 . A A . 36 ARG CB 1 1 12 6197 1 1 30 ARG CD C 13.136 4.997 4.371 1.00 . A A . 36 ARG CD 1 1 12 6198 1 1 30 ARG CG C 13.667 4.420 5.673 1.00 . A A . 36 ARG CG 1 1 12 6199 1 1 30 ARG CZ C 13.951 6.522 2.615 1.00 . A A . 36 ARG CZ 1 1 12 6200 1 1 30 ARG H H 11.637 4.800 9.404 1.00 . A A . 36 ARG H 1 1 12 6201 1 1 30 ARG HA H 13.529 2.989 8.065 1.00 . A A . 36 ARG HA 1 1 12 6202 1 1 30 ARG HB2 H 11.830 3.686 6.442 1.00 . A A . 36 ARG HB2 1 1 12 6203 1 1 30 ARG HB3 H 12.153 5.373 6.815 1.00 . A A . 36 ARG HB3 1 1 12 6204 1 1 30 ARG HD2 H 12.711 4.197 3.784 1.00 . A A . 36 ARG HD2 1 1 12 6205 1 1 30 ARG HD3 H 12.368 5.722 4.600 1.00 . A A . 36 ARG HD3 1 1 12 6206 1 1 30 ARG HE H 15.115 5.424 3.807 1.00 . A A . 36 ARG HE 1 1 12 6207 1 1 30 ARG HG2 H 14.488 5.031 6.017 1.00 . A A . 36 ARG HG2 1 1 12 6208 1 1 30 ARG HG3 H 14.014 3.413 5.495 1.00 . A A . 36 ARG HG3 1 1 12 6209 1 1 30 ARG HH11 H 11.937 6.443 2.787 1.00 . A A . 36 ARG HH11 1 1 12 6210 1 1 30 ARG HH12 H 12.536 7.508 1.560 1.00 . A A . 36 ARG HH12 1 1 12 6211 1 1 30 ARG HH21 H 15.904 6.825 2.194 1.00 . A A . 36 ARG HH21 1 1 12 6212 1 1 30 ARG HH22 H 14.787 7.724 1.223 1.00 . A A . 36 ARG HH22 1 1 12 6213 1 1 30 ARG N N 12.021 3.954 9.091 1.00 . A A . 36 ARG N 1 1 12 6214 1 1 30 ARG NE N 14.186 5.649 3.592 1.00 . A A . 36 ARG NE 1 1 12 6215 1 1 30 ARG NH1 N 12.706 6.851 2.295 1.00 . A A . 36 ARG NH1 1 1 12 6216 1 1 30 ARG NH2 N 14.964 7.069 1.957 1.00 . A A . 36 ARG NH2 1 1 12 6217 1 1 30 ARG O O 15.300 4.528 8.956 1.00 . A A . 36 ARG O 1 1 12 6218 1 1 31 GLY C C 14.537 7.882 10.246 1.00 . A A . 37 GLY C 1 1 12 6219 1 1 31 GLY CA C 14.878 7.245 8.913 1.00 . A A . 37 GLY CA 1 1 12 6220 1 1 31 GLY H H 13.023 6.516 8.198 1.00 . A A . 37 GLY H 1 1 12 6221 1 1 31 GLY HA2 H 15.851 6.781 8.986 1.00 . A A . 37 GLY HA2 1 1 12 6222 1 1 31 GLY HA3 H 14.914 8.015 8.157 1.00 . A A . 37 GLY HA3 1 1 12 6223 1 1 31 GLY N N 13.909 6.241 8.514 1.00 . A A . 37 GLY N 1 1 12 6224 1 1 31 GLY O O 15.472 8.309 10.956 1.00 . A A . 37 GLY O 1 1 12 6225 1 1 31 GLY OXT O 13.336 7.954 10.580 1.00 . A A . 37 GLY OXT 1 1 12 6226 2 2 1 . C02 C 12.862 -0.775 -5.206 1.00 . B A . 1038 D6M C02 1 1 12 6227 2 2 1 . C04 C 11.819 0.770 -6.774 1.00 . B A . 1038 D6M C04 1 1 12 6228 2 2 1 . C05 C 10.333 1.108 -6.921 1.00 . B A . 1038 D6M C05 1 1 12 6229 2 2 1 . C06 C 9.895 2.312 -6.100 1.00 . B A . 1038 D6M C06 1 1 12 6230 2 2 1 . C07 C 8.387 2.473 -6.058 1.00 . B A . 1038 D6M C07 1 1 12 6231 2 2 1 . C09 C 12.669 1.991 -7.110 1.00 . B A . 1038 D6M C09 1 1 12 6232 2 2 1 . C12 C 13.127 -1.287 -3.803 1.00 . B A . 1038 D6M C12 1 1 12 6233 2 2 1 . C13 C 14.075 -0.391 -3.022 1.00 . B A . 1038 D6M C13 1 1 12 6234 2 2 1 . C14 C 13.317 0.552 -2.101 1.00 . B A . 1038 D6M C14 1 1 12 6235 2 2 1 . C15 C 14.263 1.413 -1.280 1.00 . B A . 1038 D6M C15 1 1 12 6236 2 2 1 . C16 C 13.563 2.013 -0.070 1.00 . B A . 1038 D6M C16 1 1 12 6237 2 2 1 . C17 C 13.342 3.509 -0.235 1.00 . B A . 1038 D6M C17 1 1 12 6238 2 2 1 . C18 C 12.345 3.812 -1.344 1.00 . B A . 1038 D6M C18 1 1 12 6239 2 2 1 . C19 C 11.044 4.377 -0.793 1.00 . B A . 1038 D6M C19 1 1 12 6240 2 2 1 . C20 C 11.282 5.646 0.013 1.00 . B A . 1038 D6M C20 1 1 12 6241 2 2 1 . C21 C 10.234 6.705 -0.289 1.00 . B A . 1038 D6M C21 1 1 12 6242 2 2 1 . C22 C 8.904 6.375 0.369 1.00 . B A . 1038 D6M C22 1 1 12 6243 2 2 1 . C23 C 8.860 6.854 1.811 1.00 . B A . 1038 D6M C23 1 1 12 6244 2 2 1 . C24 C 7.593 6.391 2.513 1.00 . B A . 1038 D6M C24 1 1 12 6245 2 2 1 . C25 C 6.469 7.401 2.355 1.00 . B A . 1038 D6M C25 1 1 12 6246 2 2 1 . C26 C 5.349 7.151 3.342 1.00 . B A . 1038 D6M C26 1 1 12 6247 2 2 1 . H03 H 11.809 0.834 -4.659 1.00 . B A . 1038 D6M H03 1 1 12 6248 2 2 1 . H04 H 12.067 -0.025 -7.461 1.00 . B A . 1038 D6M H04 1 1 12 6249 2 2 1 . HP21 H 13.561 -2.273 -3.873 1.00 . B A . 1038 D6M HP21 1 1 12 6250 2 2 1 . HP22 H 12.188 -1.344 -3.273 1.00 . B A . 1038 D6M HP22 1 1 12 6251 2 2 1 . HP31 H 14.660 0.193 -3.718 1.00 . B A . 1038 D6M HP31 1 1 12 6252 2 2 1 . HP32 H 14.731 -1.009 -2.427 1.00 . B A . 1038 D6M HP32 1 1 12 6253 2 2 1 . HP41 H 12.703 -0.032 -1.431 1.00 . B A . 1038 D6M HP41 1 1 12 6254 2 2 1 . HP42 H 12.690 1.195 -2.699 1.00 . B A . 1038 D6M HP42 1 1 12 6255 2 2 1 . HP51 H 14.639 2.212 -1.902 1.00 . B A . 1038 D6M HP51 1 1 12 6256 2 2 1 . HP52 H 15.086 0.802 -0.940 1.00 . B A . 1038 D6M HP52 1 1 12 6257 2 2 1 . HP61 H 14.171 1.843 0.806 1.00 . B A . 1038 D6M HP61 1 1 12 6258 2 2 1 . HP62 H 12.605 1.531 0.057 1.00 . B A . 1038 D6M HP62 1 1 12 6259 2 2 1 . HP71 H 14.286 3.977 -0.474 1.00 . B A . 1038 D6M HP71 1 1 12 6260 2 2 1 . HP72 H 12.965 3.911 0.694 1.00 . B A . 1038 D6M HP72 1 1 12 6261 2 2 1 . HP81 H 12.131 2.900 -1.882 1.00 . B A . 1038 D6M HP81 1 1 12 6262 2 2 1 . HP82 H 12.781 4.534 -2.019 1.00 . B A . 1038 D6M HP82 1 1 12 6263 2 2 1 . HP91 H 10.583 3.637 -0.155 1.00 . B A . 1038 D6M HP91 1 1 12 6264 2 2 1 . HP92 H 10.385 4.605 -1.617 1.00 . B A . 1038 D6M HP92 1 1 12 6265 2 2 1 . HPA1 H 12.258 6.038 -0.232 1.00 . B A . 1038 D6M HPA1 1 1 12 6266 2 2 1 . HPA2 H 11.242 5.405 1.065 1.00 . B A . 1038 D6M HPA2 1 1 12 6267 2 2 1 . HPB1 H 10.092 6.762 -1.359 1.00 . B A . 1038 D6M HPB1 1 1 12 6268 2 2 1 . HPB2 H 10.580 7.657 0.082 1.00 . B A . 1038 D6M HPB2 1 1 12 6269 2 2 1 . HPC1 H 8.761 5.305 0.350 1.00 . B A . 1038 D6M HPC1 1 1 12 6270 2 2 1 . HPC2 H 8.110 6.855 -0.183 1.00 . B A . 1038 D6M HPC2 1 1 12 6271 2 2 1 . HPD1 H 8.894 7.933 1.823 1.00 . B A . 1038 D6M HPD1 1 1 12 6272 2 2 1 . HPD2 H 9.716 6.459 2.337 1.00 . B A . 1038 D6M HPD2 1 1 12 6273 2 2 1 . HPE1 H 7.804 6.261 3.565 1.00 . B A . 1038 D6M HPE1 1 1 12 6274 2 2 1 . HPE2 H 7.281 5.450 2.087 1.00 . B A . 1038 D6M HPE2 1 1 12 6275 2 2 1 . HPF1 H 6.068 7.331 1.354 1.00 . B A . 1038 D6M HPF1 1 1 12 6276 2 2 1 . HPF2 H 6.856 8.394 2.525 1.00 . B A . 1038 D6M HPF2 1 1 12 6277 2 2 1 . HPG1 H 4.904 8.092 3.629 1.00 . B A . 1038 D6M HPG1 1 1 12 6278 2 2 1 . HPG2 H 5.745 6.658 4.218 1.00 . B A . 1038 D6M HPG2 1 1 12 6279 2 2 1 . HPG3 H 4.599 6.523 2.884 1.00 . B A . 1038 D6M HPG3 1 1 12 6280 2 2 1 . HQ21 H 10.257 2.195 -5.090 1.00 . B A . 1038 D6M HQ21 1 1 12 6281 2 2 1 . HQ22 H 10.324 3.203 -6.535 1.00 . B A . 1038 D6M HQ22 1 1 12 6282 2 2 1 . HQ31 H 10.126 1.314 -7.960 1.00 . B A . 1038 D6M HQ31 1 1 12 6283 2 2 1 . HQ32 H 9.748 0.256 -6.608 1.00 . B A . 1038 D6M HQ32 1 1 12 6284 2 2 1 . N03 N 12.101 0.295 -5.423 1.00 . B A . 1038 D6M N03 1 1 12 6285 2 2 1 . O01 O 13.351 -1.392 -6.153 1.00 . B A . 1038 D6M O01 1 1 12 6286 2 2 1 . O08 O 7.796 2.697 -7.114 1.00 . B A . 1038 D6M O08 1 1 12 6287 2 2 1 . O10 O 13.144 2.658 -6.167 1.00 . B A . 1038 D6M O10 1 1 12 6288 2 2 1 . O11 O 12.852 2.270 -8.314 1.00 . B A . 1038 D6M O11 1 1 13 6289 1 1 1 HIS C C -31.906 -4.313 0.490 1.00 . A A . 7 HIS C 1 1 13 6290 1 1 1 HIS CA C -32.464 -5.514 -0.268 1.00 . A A . 7 HIS CA 1 1 13 6291 1 1 1 HIS CB C -31.699 -5.714 -1.578 1.00 . A A . 7 HIS CB 1 1 13 6292 1 1 1 HIS CD2 C -30.276 -7.640 -0.581 1.00 . A A . 7 HIS CD2 1 1 13 6293 1 1 1 HIS CE1 C -28.553 -7.497 -1.930 1.00 . A A . 7 HIS CE1 1 1 13 6294 1 1 1 HIS CG C -30.523 -6.631 -1.450 1.00 . A A . 7 HIS CG 1 1 13 6295 1 1 1 HIS H1 H -33.989 -4.486 -1.190 1.00 . A A . 7 HIS H1 1 1 13 6296 1 1 1 HIS H2 H -34.233 -6.182 -1.079 1.00 . A A . 7 HIS H2 1 1 13 6297 1 1 1 HIS H3 H -34.411 -5.194 0.313 1.00 . A A . 7 HIS H3 1 1 13 6298 1 1 1 HIS HA H -32.358 -6.397 0.344 1.00 . A A . 7 HIS HA 1 1 13 6299 1 1 1 HIS HB2 H -32.367 -6.131 -2.316 1.00 . A A . 7 HIS HB2 1 1 13 6300 1 1 1 HIS HB3 H -31.339 -4.756 -1.926 1.00 . A A . 7 HIS HB3 1 1 13 6301 1 1 1 HIS HD1 H -29.302 -5.935 -3.021 1.00 . A A . 7 HIS HD1 1 1 13 6302 1 1 1 HIS HD2 H -30.926 -7.972 0.216 1.00 . A A . 7 HIS HD2 1 1 13 6303 1 1 1 HIS HE1 H -27.600 -7.681 -2.403 1.00 . A A . 7 HIS HE1 1 1 13 6304 1 1 1 HIS HE2 H -28.567 -8.844 -0.388 1.00 . A A . 7 HIS HE2 1 1 13 6305 1 1 1 HIS N N -33.904 -5.327 -0.584 1.00 . A A . 7 HIS N 1 1 13 6306 1 1 1 HIS ND1 N -29.424 -6.567 -2.282 1.00 . A A . 7 HIS ND1 1 1 13 6307 1 1 1 HIS NE2 N -29.046 -8.160 -0.900 1.00 . A A . 7 HIS NE2 1 1 13 6308 1 1 1 HIS O O -32.579 -3.293 0.638 1.00 . A A . 7 HIS O 1 1 13 6309 1 1 2 ALA C C -28.899 -2.739 0.896 1.00 . A A . 8 ALA C 1 1 13 6310 1 1 2 ALA CA C -30.025 -3.367 1.710 1.00 . A A . 8 ALA CA 1 1 13 6311 1 1 2 ALA CB C -29.492 -3.889 3.036 1.00 . A A . 8 ALA CB 1 1 13 6312 1 1 2 ALA H H -30.186 -5.280 0.817 1.00 . A A . 8 ALA H 1 1 13 6313 1 1 2 ALA HA H -30.768 -2.612 1.919 1.00 . A A . 8 ALA HA 1 1 13 6314 1 1 2 ALA HB1 H -30.173 -4.628 3.431 1.00 . A A . 8 ALA HB1 1 1 13 6315 1 1 2 ALA HB2 H -28.522 -4.338 2.882 1.00 . A A . 8 ALA HB2 1 1 13 6316 1 1 2 ALA HB3 H -29.403 -3.070 3.735 1.00 . A A . 8 ALA HB3 1 1 13 6317 1 1 2 ALA N N -30.672 -4.442 0.967 1.00 . A A . 8 ALA N 1 1 13 6318 1 1 2 ALA O O -28.455 -3.301 -0.105 1.00 . A A . 8 ALA O 1 1 13 6319 1 1 3 GLU C C -26.128 -0.762 1.528 1.00 . A A . 9 GLU C 1 1 13 6320 1 1 3 GLU CA C -27.367 -0.864 0.644 1.00 . A A . 9 GLU CA 1 1 13 6321 1 1 3 GLU CB C -27.829 0.535 0.231 1.00 . A A . 9 GLU CB 1 1 13 6322 1 1 3 GLU CD C -26.702 2.768 -0.126 1.00 . A A . 9 GLU CD 1 1 13 6323 1 1 3 GLU CG C -26.784 1.314 -0.550 1.00 . A A . 9 GLU CG 1 1 13 6324 1 1 3 GLU H H -28.836 -1.172 2.136 1.00 . A A . 9 GLU H 1 1 13 6325 1 1 3 GLU HA H -27.116 -1.426 -0.243 1.00 . A A . 9 GLU HA 1 1 13 6326 1 1 3 GLU HB2 H -28.712 0.443 -0.383 1.00 . A A . 9 GLU HB2 1 1 13 6327 1 1 3 GLU HB3 H -28.076 1.097 1.120 1.00 . A A . 9 GLU HB3 1 1 13 6328 1 1 3 GLU HG2 H -25.819 0.855 -0.393 1.00 . A A . 9 GLU HG2 1 1 13 6329 1 1 3 GLU HG3 H -27.034 1.274 -1.600 1.00 . A A . 9 GLU HG3 1 1 13 6330 1 1 3 GLU N N -28.442 -1.569 1.332 1.00 . A A . 9 GLU N 1 1 13 6331 1 1 3 GLU O O -26.230 -0.518 2.730 1.00 . A A . 9 GLU O 1 1 13 6332 1 1 3 GLU OE1 O -26.586 3.026 1.090 1.00 . A A . 9 GLU OE1 1 1 13 6333 1 1 3 GLU OE2 O -26.754 3.648 -1.011 1.00 . A A . 9 GLU OE2 1 1 13 6334 1 1 4 GLY C C -22.530 -0.542 0.790 1.00 . A A . 10 GLY C 1 1 13 6335 1 1 4 GLY CA C -23.718 -0.875 1.671 1.00 . A A . 10 GLY CA 1 1 13 6336 1 1 4 GLY H H -24.940 -1.141 -0.037 1.00 . A A . 10 GLY H 1 1 13 6337 1 1 4 GLY HA2 H -23.813 -0.113 2.430 1.00 . A A . 10 GLY HA2 1 1 13 6338 1 1 4 GLY HA3 H -23.541 -1.826 2.150 1.00 . A A . 10 GLY HA3 1 1 13 6339 1 1 4 GLY N N -24.959 -0.950 0.924 1.00 . A A . 10 GLY N 1 1 13 6340 1 1 4 GLY O O -22.131 -1.343 -0.056 1.00 . A A . 10 GLY O 1 1 13 6341 1 1 5 THR C C -19.529 0.979 1.021 1.00 . A A . 11 THR C 1 1 13 6342 1 1 5 THR CA C -20.814 1.083 0.206 1.00 . A A . 11 THR CA 1 1 13 6343 1 1 5 THR CB C -21.016 2.523 -0.270 1.00 . A A . 11 THR CB 1 1 13 6344 1 1 5 THR CG2 C -21.506 3.452 0.820 1.00 . A A . 11 THR CG2 1 1 13 6345 1 1 5 THR H H -22.328 1.238 1.677 1.00 . A A . 11 THR H 1 1 13 6346 1 1 5 THR HA H -20.734 0.437 -0.656 1.00 . A A . 11 THR HA 1 1 13 6347 1 1 5 THR HB H -21.748 2.530 -1.064 1.00 . A A . 11 THR HB 1 1 13 6348 1 1 5 THR HG1 H -20.003 3.757 -1.405 1.00 . A A . 11 THR HG1 1 1 13 6349 1 1 5 THR HG21 H -21.239 3.047 1.785 1.00 . A A . 11 THR HG21 1 1 13 6350 1 1 5 THR HG22 H -21.049 4.423 0.698 1.00 . A A . 11 THR HG22 1 1 13 6351 1 1 5 THR HG23 H -22.580 3.548 0.754 1.00 . A A . 11 THR HG23 1 1 13 6352 1 1 5 THR N N -21.964 0.644 0.988 1.00 . A A . 11 THR N 1 1 13 6353 1 1 5 THR O O -19.141 1.922 1.710 1.00 . A A . 11 THR O 1 1 13 6354 1 1 5 THR OG1 O -19.806 3.058 -0.777 1.00 . A A . 11 THR OG1 1 1 13 6355 1 1 6 PHE C C -16.603 -1.109 0.789 1.00 . A A . 12 PHE C 1 1 13 6356 1 1 6 PHE CA C -17.631 -0.403 1.668 1.00 . A A . 12 PHE CA 1 1 13 6357 1 1 6 PHE CB C -17.900 -1.231 2.926 1.00 . A A . 12 PHE CB 1 1 13 6358 1 1 6 PHE CD1 C -15.813 -1.160 4.318 1.00 . A A . 12 PHE CD1 1 1 13 6359 1 1 6 PHE CD2 C -17.718 0.064 5.068 1.00 . A A . 12 PHE CD2 1 1 13 6360 1 1 6 PHE CE1 C -15.101 -0.734 5.423 1.00 . A A . 12 PHE CE1 1 1 13 6361 1 1 6 PHE CE2 C -17.011 0.493 6.175 1.00 . A A . 12 PHE CE2 1 1 13 6362 1 1 6 PHE CG C -17.128 -0.766 4.128 1.00 . A A . 12 PHE CG 1 1 13 6363 1 1 6 PHE CZ C -15.700 0.093 6.353 1.00 . A A . 12 PHE CZ 1 1 13 6364 1 1 6 PHE H H -19.234 -0.889 0.372 1.00 . A A . 12 PHE H 1 1 13 6365 1 1 6 PHE HA H -17.237 0.559 1.959 1.00 . A A . 12 PHE HA 1 1 13 6366 1 1 6 PHE HB2 H -18.951 -1.176 3.167 1.00 . A A . 12 PHE HB2 1 1 13 6367 1 1 6 PHE HB3 H -17.633 -2.260 2.736 1.00 . A A . 12 PHE HB3 1 1 13 6368 1 1 6 PHE HD1 H -15.343 -1.806 3.592 1.00 . A A . 12 PHE HD1 1 1 13 6369 1 1 6 PHE HD2 H -18.743 0.376 4.930 1.00 . A A . 12 PHE HD2 1 1 13 6370 1 1 6 PHE HE1 H -14.076 -1.048 5.560 1.00 . A A . 12 PHE HE1 1 1 13 6371 1 1 6 PHE HE2 H -17.482 1.139 6.900 1.00 . A A . 12 PHE HE2 1 1 13 6372 1 1 6 PHE HZ H -15.146 0.427 7.217 1.00 . A A . 12 PHE HZ 1 1 13 6373 1 1 6 PHE N N -18.873 -0.175 0.937 1.00 . A A . 12 PHE N 1 1 13 6374 1 1 6 PHE O O -15.435 -0.725 0.754 1.00 . A A . 12 PHE O 1 1 13 6375 1 1 7 THR C C -15.363 -1.986 -1.713 1.00 . A A . 13 THR C 1 1 13 6376 1 1 7 THR CA C -16.165 -2.909 -0.798 1.00 . A A . 13 THR CA 1 1 13 6377 1 1 7 THR CB C -16.978 -3.895 -1.638 1.00 . A A . 13 THR CB 1 1 13 6378 1 1 7 THR CG2 C -17.969 -4.699 -0.823 1.00 . A A . 13 THR CG2 1 1 13 6379 1 1 7 THR H H -17.989 -2.404 0.153 1.00 . A A . 13 THR H 1 1 13 6380 1 1 7 THR HA H -15.477 -3.462 -0.177 1.00 . A A . 13 THR HA 1 1 13 6381 1 1 7 THR HB H -16.301 -4.590 -2.115 1.00 . A A . 13 THR HB 1 1 13 6382 1 1 7 THR HG1 H -18.161 -2.465 -2.263 1.00 . A A . 13 THR HG1 1 1 13 6383 1 1 7 THR HG21 H -17.502 -5.020 0.097 1.00 . A A . 13 THR HG21 1 1 13 6384 1 1 7 THR HG22 H -18.829 -4.088 -0.596 1.00 . A A . 13 THR HG22 1 1 13 6385 1 1 7 THR HG23 H -18.281 -5.565 -1.389 1.00 . A A . 13 THR HG23 1 1 13 6386 1 1 7 THR N N -17.046 -2.145 0.081 1.00 . A A . 13 THR N 1 1 13 6387 1 1 7 THR O O -14.250 -2.316 -2.123 1.00 . A A . 13 THR O 1 1 13 6388 1 1 7 THR OG1 O -17.703 -3.216 -2.647 1.00 . A A . 13 THR OG1 1 1 13 6389 1 1 8 SER C C -14.310 1.013 -2.091 1.00 . A A . 14 SER C 1 1 13 6390 1 1 8 SER CA C -15.272 0.142 -2.892 1.00 . A A . 14 SER CA 1 1 13 6391 1 1 8 SER CB C -16.306 1.023 -3.596 1.00 . A A . 14 SER CB 1 1 13 6392 1 1 8 SER H H -16.823 -0.620 -1.670 1.00 . A A . 14 SER H 1 1 13 6393 1 1 8 SER HA H -14.711 -0.404 -3.635 1.00 . A A . 14 SER HA 1 1 13 6394 1 1 8 SER HB2 H -16.522 1.882 -2.980 1.00 . A A . 14 SER HB2 1 1 13 6395 1 1 8 SER HB3 H -15.909 1.351 -4.545 1.00 . A A . 14 SER HB3 1 1 13 6396 1 1 8 SER HG H -18.047 0.790 -4.463 1.00 . A A . 14 SER HG 1 1 13 6397 1 1 8 SER N N -15.935 -0.828 -2.028 1.00 . A A . 14 SER N 1 1 13 6398 1 1 8 SER O O -13.192 1.286 -2.529 1.00 . A A . 14 SER O 1 1 13 6399 1 1 8 SER OG O -17.510 0.312 -3.826 1.00 . A A . 14 SER OG 1 1 13 6400 1 1 9 ASP C C -12.689 1.540 0.414 1.00 . A A . 15 ASP C 1 1 13 6401 1 1 9 ASP CA C -13.932 2.289 -0.053 1.00 . A A . 15 ASP CA 1 1 13 6402 1 1 9 ASP CB C -14.743 2.759 1.156 1.00 . A A . 15 ASP CB 1 1 13 6403 1 1 9 ASP CG C -14.351 4.152 1.610 1.00 . A A . 15 ASP CG 1 1 13 6404 1 1 9 ASP H H -15.653 1.197 -0.622 1.00 . A A . 15 ASP H 1 1 13 6405 1 1 9 ASP HA H -13.624 3.151 -0.625 1.00 . A A . 15 ASP HA 1 1 13 6406 1 1 9 ASP HB2 H -15.791 2.767 0.898 1.00 . A A . 15 ASP HB2 1 1 13 6407 1 1 9 ASP HB3 H -14.584 2.074 1.977 1.00 . A A . 15 ASP HB3 1 1 13 6408 1 1 9 ASP N N -14.753 1.448 -0.916 1.00 . A A . 15 ASP N 1 1 13 6409 1 1 9 ASP O O -11.635 2.138 0.629 1.00 . A A . 15 ASP O 1 1 13 6410 1 1 9 ASP OD1 O -13.227 4.588 1.284 1.00 . A A . 15 ASP OD1 1 1 13 6411 1 1 9 ASP OD2 O -15.167 4.806 2.292 1.00 . A A . 15 ASP OD2 1 1 13 6412 1 1 10 VAL C C -10.555 -0.550 0.012 1.00 . A A . 16 VAL C 1 1 13 6413 1 1 10 VAL CA C -11.707 -0.605 1.009 1.00 . A A . 16 VAL CA 1 1 13 6414 1 1 10 VAL CB C -12.140 -2.070 1.196 1.00 . A A . 16 VAL CB 1 1 13 6415 1 1 10 VAL CG1 C -11.015 -2.883 1.819 1.00 . A A . 16 VAL CG1 1 1 13 6416 1 1 10 VAL CG2 C -13.403 -2.152 2.044 1.00 . A A . 16 VAL CG2 1 1 13 6417 1 1 10 VAL H H -13.686 -0.193 0.381 1.00 . A A . 16 VAL H 1 1 13 6418 1 1 10 VAL HA H -11.365 -0.227 1.962 1.00 . A A . 16 VAL HA 1 1 13 6419 1 1 10 VAL HB H -12.359 -2.487 0.224 1.00 . A A . 16 VAL HB 1 1 13 6420 1 1 10 VAL HG11 H -10.065 -2.444 1.552 1.00 . A A . 16 VAL HG11 1 1 13 6421 1 1 10 VAL HG12 H -11.123 -2.882 2.893 1.00 . A A . 16 VAL HG12 1 1 13 6422 1 1 10 VAL HG13 H -11.059 -3.898 1.453 1.00 . A A . 16 VAL HG13 1 1 13 6423 1 1 10 VAL HG21 H -13.625 -1.178 2.454 1.00 . A A . 16 VAL HG21 1 1 13 6424 1 1 10 VAL HG22 H -14.228 -2.480 1.429 1.00 . A A . 16 VAL HG22 1 1 13 6425 1 1 10 VAL HG23 H -13.252 -2.855 2.849 1.00 . A A . 16 VAL HG23 1 1 13 6426 1 1 10 VAL N N -12.820 0.227 0.569 1.00 . A A . 16 VAL N 1 1 13 6427 1 1 10 VAL O O -9.460 -0.094 0.339 1.00 . A A . 16 VAL O 1 1 13 6428 1 1 11 SER C C -9.125 0.355 -2.371 1.00 . A A . 17 SER C 1 1 13 6429 1 1 11 SER CA C -9.792 -1.013 -2.256 1.00 . A A . 17 SER CA 1 1 13 6430 1 1 11 SER CB C -10.414 -1.403 -3.598 1.00 . A A . 17 SER CB 1 1 13 6431 1 1 11 SER H H -11.703 -1.361 -1.410 1.00 . A A . 17 SER H 1 1 13 6432 1 1 11 SER HA H -9.043 -1.745 -1.990 1.00 . A A . 17 SER HA 1 1 13 6433 1 1 11 SER HB2 H -11.438 -1.062 -3.631 1.00 . A A . 17 SER HB2 1 1 13 6434 1 1 11 SER HB3 H -9.855 -0.940 -4.399 1.00 . A A . 17 SER HB3 1 1 13 6435 1 1 11 SER HG H -10.824 -3.234 -3.037 1.00 . A A . 17 SER HG 1 1 13 6436 1 1 11 SER N N -10.810 -1.013 -1.208 1.00 . A A . 17 SER N 1 1 13 6437 1 1 11 SER O O -7.976 0.463 -2.799 1.00 . A A . 17 SER O 1 1 13 6438 1 1 11 SER OG O -10.395 -2.808 -3.782 1.00 . A A . 17 SER OG 1 1 13 6439 1 1 12 SER C C -8.070 2.907 -1.215 1.00 . A A . 18 SER C 1 1 13 6440 1 1 12 SER CA C -9.340 2.759 -2.049 1.00 . A A . 18 SER CA 1 1 13 6441 1 1 12 SER CB C -10.400 3.750 -1.564 1.00 . A A . 18 SER CB 1 1 13 6442 1 1 12 SER H H -10.766 1.248 -1.658 1.00 . A A . 18 SER H 1 1 13 6443 1 1 12 SER HA H -9.104 2.977 -3.080 1.00 . A A . 18 SER HA 1 1 13 6444 1 1 12 SER HB2 H -11.382 3.336 -1.738 1.00 . A A . 18 SER HB2 1 1 13 6445 1 1 12 SER HB3 H -10.267 3.928 -0.507 1.00 . A A . 18 SER HB3 1 1 13 6446 1 1 12 SER HG H -10.361 5.707 -1.624 1.00 . A A . 18 SER HG 1 1 13 6447 1 1 12 SER N N -9.856 1.398 -1.988 1.00 . A A . 18 SER N 1 1 13 6448 1 1 12 SER O O -7.145 3.622 -1.602 1.00 . A A . 18 SER O 1 1 13 6449 1 1 12 SER OG O -10.297 4.984 -2.252 1.00 . A A . 18 SER OG 1 1 13 6450 1 1 13 TYR C C -5.744 1.390 0.309 1.00 . A A . 19 TYR C 1 1 13 6451 1 1 13 TYR CA C -6.864 2.304 0.808 1.00 . A A . 19 TYR CA 1 1 13 6452 1 1 13 TYR CB C -7.254 1.960 2.257 1.00 . A A . 19 TYR CB 1 1 13 6453 1 1 13 TYR CD1 C -5.912 -0.112 2.817 1.00 . A A . 19 TYR CD1 1 1 13 6454 1 1 13 TYR CD2 C -8.290 -0.285 2.782 1.00 . A A . 19 TYR CD2 1 1 13 6455 1 1 13 TYR CE1 C -5.816 -1.449 3.158 1.00 . A A . 19 TYR CE1 1 1 13 6456 1 1 13 TYR CE2 C -8.201 -1.621 3.125 1.00 . A A . 19 TYR CE2 1 1 13 6457 1 1 13 TYR CG C -7.149 0.492 2.621 1.00 . A A . 19 TYR CG 1 1 13 6458 1 1 13 TYR CZ C -6.963 -2.198 3.311 1.00 . A A . 19 TYR CZ 1 1 13 6459 1 1 13 TYR H H -8.794 1.680 0.193 1.00 . A A . 19 TYR H 1 1 13 6460 1 1 13 TYR HA H -6.504 3.322 0.782 1.00 . A A . 19 TYR HA 1 1 13 6461 1 1 13 TYR HB2 H -6.613 2.508 2.930 1.00 . A A . 19 TYR HB2 1 1 13 6462 1 1 13 TYR HB3 H -8.277 2.267 2.423 1.00 . A A . 19 TYR HB3 1 1 13 6463 1 1 13 TYR HD1 H -9.258 0.169 2.634 1.00 . A A . 19 TYR HD1 1 1 13 6464 1 1 13 TYR HD2 H -5.015 0.477 2.698 1.00 . A A . 19 TYR HD2 1 1 13 6465 1 1 13 TYR HE1 H -9.100 -2.207 3.246 1.00 . A A . 19 TYR HE1 1 1 13 6466 1 1 13 TYR HE2 H -4.846 -1.900 3.303 1.00 . A A . 19 TYR HE2 1 1 13 6467 1 1 13 TYR HH H -6.697 -4.049 2.865 1.00 . A A . 19 TYR HH 1 1 13 6468 1 1 13 TYR N N -8.028 2.233 -0.068 1.00 . A A . 19 TYR N 1 1 13 6469 1 1 13 TYR O O -4.573 1.601 0.623 1.00 . A A . 19 TYR O 1 1 13 6470 1 1 13 TYR OH O -6.872 -3.528 3.652 1.00 . A A . 19 TYR OH 1 1 13 6471 1 1 14 LEU C C -4.535 -0.025 -2.318 1.00 . A A . 20 LEU C 1 1 13 6472 1 1 14 LEU CA C -5.134 -0.559 -1.019 1.00 . A A . 20 LEU CA 1 1 13 6473 1 1 14 LEU CB C -5.784 -1.922 -1.269 1.00 . A A . 20 LEU CB 1 1 13 6474 1 1 14 LEU CD1 C -7.579 -2.608 0.341 1.00 . A A . 20 LEU CD1 1 1 13 6475 1 1 14 LEU CD2 C -5.724 -4.193 -0.205 1.00 . A A . 20 LEU CD2 1 1 13 6476 1 1 14 LEU CG C -6.105 -2.732 -0.011 1.00 . A A . 20 LEU CG 1 1 13 6477 1 1 14 LEU H H -7.058 0.261 -0.695 1.00 . A A . 20 LEU H 1 1 13 6478 1 1 14 LEU HA H -4.344 -0.674 -0.292 1.00 . A A . 20 LEU HA 1 1 13 6479 1 1 14 LEU HB2 H -6.704 -1.762 -1.814 1.00 . A A . 20 LEU HB2 1 1 13 6480 1 1 14 LEU HB3 H -5.118 -2.506 -1.887 1.00 . A A . 20 LEU HB3 1 1 13 6481 1 1 14 LEU HD11 H -8.178 -2.862 -0.521 1.00 . A A . 20 LEU HD11 1 1 13 6482 1 1 14 LEU HD12 H -7.814 -3.281 1.153 1.00 . A A . 20 LEU HD12 1 1 13 6483 1 1 14 LEU HD13 H -7.794 -1.593 0.641 1.00 . A A . 20 LEU HD13 1 1 13 6484 1 1 14 LEU HD21 H -4.876 -4.259 -0.872 1.00 . A A . 20 LEU HD21 1 1 13 6485 1 1 14 LEU HD22 H -5.466 -4.628 0.749 1.00 . A A . 20 LEU HD22 1 1 13 6486 1 1 14 LEU HD23 H -6.559 -4.730 -0.631 1.00 . A A . 20 LEU HD23 1 1 13 6487 1 1 14 LEU HG H -5.530 -2.343 0.817 1.00 . A A . 20 LEU HG 1 1 13 6488 1 1 14 LEU N N -6.111 0.378 -0.475 1.00 . A A . 20 LEU N 1 1 13 6489 1 1 14 LEU O O -4.600 -0.680 -3.359 1.00 . A A . 20 LEU O 1 1 13 6490 1 1 15 GLU C C -1.844 1.521 -3.467 1.00 . A A . 21 GLU C 1 1 13 6491 1 1 15 GLU CA C -3.346 1.786 -3.426 1.00 . A A . 21 GLU CA 1 1 13 6492 1 1 15 GLU CB C -3.614 3.293 -3.430 1.00 . A A . 21 GLU CB 1 1 13 6493 1 1 15 GLU CD C -4.740 4.114 -5.537 1.00 . A A . 21 GLU CD 1 1 13 6494 1 1 15 GLU CG C -4.925 3.676 -4.097 1.00 . A A . 21 GLU CG 1 1 13 6495 1 1 15 GLU H H -3.932 1.644 -1.396 1.00 . A A . 21 GLU H 1 1 13 6496 1 1 15 GLU HA H -3.800 1.348 -4.302 1.00 . A A . 21 GLU HA 1 1 13 6497 1 1 15 GLU HB2 H -3.638 3.646 -2.410 1.00 . A A . 21 GLU HB2 1 1 13 6498 1 1 15 GLU HB3 H -2.810 3.789 -3.954 1.00 . A A . 21 GLU HB3 1 1 13 6499 1 1 15 GLU HG2 H -5.586 2.822 -4.080 1.00 . A A . 21 GLU HG2 1 1 13 6500 1 1 15 GLU HG3 H -5.373 4.487 -3.543 1.00 . A A . 21 GLU HG3 1 1 13 6501 1 1 15 GLU N N -3.953 1.168 -2.252 1.00 . A A . 21 GLU N 1 1 13 6502 1 1 15 GLU O O -1.049 2.428 -3.717 1.00 . A A . 21 GLU O 1 1 13 6503 1 1 15 GLU OE1 O -4.371 3.264 -6.374 1.00 . A A . 21 GLU OE1 1 1 13 6504 1 1 15 GLU OE2 O -4.964 5.308 -5.827 1.00 . A A . 21 GLU OE2 1 1 13 6505 1 1 16 GLY C C 0.736 0.612 -2.149 1.00 . A A . 22 GLY C 1 1 13 6506 1 1 16 GLY CA C -0.056 -0.089 -3.236 1.00 . A A . 22 GLY CA 1 1 13 6507 1 1 16 GLY H H -2.139 -0.409 -3.029 1.00 . A A . 22 GLY H 1 1 13 6508 1 1 16 GLY HA2 H 0.031 -1.157 -3.097 1.00 . A A . 22 GLY HA2 1 1 13 6509 1 1 16 GLY HA3 H 0.362 0.173 -4.197 1.00 . A A . 22 GLY HA3 1 1 13 6510 1 1 16 GLY N N -1.462 0.272 -3.222 1.00 . A A . 22 GLY N 1 1 13 6511 1 1 16 GLY O O 1.948 0.790 -2.272 1.00 . A A . 22 GLY O 1 1 13 6512 1 1 17 GLN C C 1.739 0.799 0.688 1.00 . A A . 23 GLN C 1 1 13 6513 1 1 17 GLN CA C 0.697 1.696 0.029 1.00 . A A . 23 GLN CA 1 1 13 6514 1 1 17 GLN CB C -0.345 2.132 1.061 1.00 . A A . 23 GLN CB 1 1 13 6515 1 1 17 GLN CD C 0.872 2.958 3.114 1.00 . A A . 23 GLN CD 1 1 13 6516 1 1 17 GLN CG C 0.078 3.340 1.880 1.00 . A A . 23 GLN CG 1 1 13 6517 1 1 17 GLN H H -0.914 0.840 -1.043 1.00 . A A . 23 GLN H 1 1 13 6518 1 1 17 GLN HA H 1.190 2.573 -0.363 1.00 . A A . 23 GLN HA 1 1 13 6519 1 1 17 GLN HB2 H -1.263 2.376 0.547 1.00 . A A . 23 GLN HB2 1 1 13 6520 1 1 17 GLN HB3 H -0.529 1.311 1.738 1.00 . A A . 23 GLN HB3 1 1 13 6521 1 1 17 GLN HE21 H 2.525 2.776 2.025 1.00 . A A . 23 GLN HE21 1 1 13 6522 1 1 17 GLN HE22 H 2.699 2.454 3.714 1.00 . A A . 23 GLN HE22 1 1 13 6523 1 1 17 GLN HG2 H 0.689 3.982 1.263 1.00 . A A . 23 GLN HG2 1 1 13 6524 1 1 17 GLN HG3 H -0.807 3.876 2.191 1.00 . A A . 23 GLN HG3 1 1 13 6525 1 1 17 GLN N N 0.050 1.011 -1.083 1.00 . A A . 23 GLN N 1 1 13 6526 1 1 17 GLN NE2 N 2.162 2.704 2.933 1.00 . A A . 23 GLN NE2 1 1 13 6527 1 1 17 GLN O O 2.870 1.219 0.932 1.00 . A A . 23 GLN O 1 1 13 6528 1 1 17 GLN OE1 O 0.331 2.892 4.218 1.00 . A A . 23 GLN OE1 1 1 13 6529 1 1 18 ALA C C 3.468 -1.677 0.722 1.00 . A A . 24 ALA C 1 1 13 6530 1 1 18 ALA CA C 2.252 -1.399 1.602 1.00 . A A . 24 ALA CA 1 1 13 6531 1 1 18 ALA CB C 1.514 -2.694 1.907 1.00 . A A . 24 ALA CB 1 1 13 6532 1 1 18 ALA H H 0.437 -0.716 0.753 1.00 . A A . 24 ALA H 1 1 13 6533 1 1 18 ALA HA H 2.587 -0.975 2.537 1.00 . A A . 24 ALA HA 1 1 13 6534 1 1 18 ALA HB1 H 0.456 -2.496 1.984 1.00 . A A . 24 ALA HB1 1 1 13 6535 1 1 18 ALA HB2 H 1.692 -3.405 1.114 1.00 . A A . 24 ALA HB2 1 1 13 6536 1 1 18 ALA HB3 H 1.873 -3.100 2.842 1.00 . A A . 24 ALA HB3 1 1 13 6537 1 1 18 ALA N N 1.351 -0.440 0.973 1.00 . A A . 24 ALA N 1 1 13 6538 1 1 18 ALA O O 4.494 -2.157 1.202 1.00 . A A . 24 ALA O 1 1 13 6539 1 1 19 ALA C C 5.451 -0.466 -1.479 1.00 . A A . 25 ALA C 1 1 13 6540 1 1 19 ALA CA C 4.436 -1.600 -1.511 1.00 . A A . 25 ALA CA 1 1 13 6541 1 1 19 ALA CB C 3.897 -1.770 -2.920 1.00 . A A . 25 ALA CB 1 1 13 6542 1 1 19 ALA H H 2.503 -1.001 -0.895 1.00 . A A . 25 ALA H 1 1 13 6543 1 1 19 ALA HA H 4.935 -2.517 -1.232 1.00 . A A . 25 ALA HA 1 1 13 6544 1 1 19 ALA HB1 H 3.016 -1.158 -3.045 1.00 . A A . 25 ALA HB1 1 1 13 6545 1 1 19 ALA HB2 H 4.653 -1.463 -3.629 1.00 . A A . 25 ALA HB2 1 1 13 6546 1 1 19 ALA HB3 H 3.644 -2.806 -3.087 1.00 . A A . 25 ALA HB3 1 1 13 6547 1 1 19 ALA N N 3.346 -1.378 -0.568 1.00 . A A . 25 ALA N 1 1 13 6548 1 1 19 ALA O O 6.575 -0.632 -1.939 1.00 . A A . 25 ALA O 1 1 13 6549 1 1 20 LYS C C 6.724 1.869 0.420 1.00 . A A . 26 LYS C 1 1 13 6550 1 1 20 LYS CA C 5.936 1.845 -0.889 1.00 . A A . 26 LYS CA 1 1 13 6551 1 1 20 LYS CB C 5.130 3.139 -1.039 1.00 . A A . 26 LYS CB 1 1 13 6552 1 1 20 LYS CD C 6.801 3.962 -2.756 1.00 . A A . 26 LYS CD 1 1 13 6553 1 1 20 LYS CE C 5.976 3.372 -3.891 1.00 . A A . 26 LYS CE 1 1 13 6554 1 1 20 LYS CG C 5.941 4.324 -1.551 1.00 . A A . 26 LYS CG 1 1 13 6555 1 1 20 LYS HA H 6.633 1.770 -1.709 1.00 . A A . 26 LYS HA 1 1 13 6556 1 1 20 LYS HB2 H 4.316 2.964 -1.727 1.00 . A A . 26 LYS HB2 1 1 13 6557 1 1 20 LYS HD2 H 7.293 4.855 -3.113 1.00 . A A . 26 LYS HD2 1 1 13 6558 1 1 20 LYS HE2 H 5.093 2.909 -3.479 1.00 . A A . 26 LYS HE2 1 1 13 6559 1 1 20 LYS HG2 H 5.261 5.113 -1.836 1.00 . A A . 26 LYS HG2 1 1 13 6560 1 1 20 LYS HZ1 H 7.520 2.674 -5.135 1.00 . A A . 26 LYS HZ1 1 1 13 6561 1 1 20 LYS N N 5.047 0.688 -0.958 1.00 . A A . 26 LYS N 1 1 13 6562 1 1 20 LYS NZ N 6.726 2.372 -4.647 1.00 . A A . 26 LYS NZ 1 1 13 6563 1 1 20 LYS O O 7.759 2.528 0.516 1.00 . A A . 26 LYS O 1 1 13 6564 1 1 21 GLU C C 8.387 0.813 2.582 1.00 . A A . 27 GLU C 1 1 13 6565 1 1 21 GLU CA C 6.893 1.094 2.728 1.00 . A A . 27 GLU CA 1 1 13 6566 1 1 21 GLU CB C 6.251 0.013 3.600 1.00 . A A . 27 GLU CB 1 1 13 6567 1 1 21 GLU CD C 5.554 -2.412 3.715 1.00 . A A . 27 GLU CD 1 1 13 6568 1 1 21 GLU CG C 6.508 -1.402 3.109 1.00 . A A . 27 GLU CG 1 1 13 6569 1 1 21 GLU H H 5.402 0.646 1.292 1.00 . A A . 27 GLU H 1 1 13 6570 1 1 21 GLU HA H 6.765 2.053 3.207 1.00 . A A . 27 GLU HA 1 1 13 6571 1 1 21 GLU HB2 H 6.642 0.098 4.602 1.00 . A A . 27 GLU HB2 1 1 13 6572 1 1 21 GLU HB3 H 5.184 0.174 3.624 1.00 . A A . 27 GLU HB3 1 1 13 6573 1 1 21 GLU HG2 H 6.396 -1.423 2.035 1.00 . A A . 27 GLU HG2 1 1 13 6574 1 1 21 GLU HG3 H 7.519 -1.681 3.369 1.00 . A A . 27 GLU HG3 1 1 13 6575 1 1 21 GLU N N 6.231 1.150 1.426 1.00 . A A . 27 GLU N 1 1 13 6576 1 1 21 GLU O O 9.216 1.432 3.248 1.00 . A A . 27 GLU O 1 1 13 6577 1 1 21 GLU OE1 O 4.959 -2.107 4.771 1.00 . A A . 27 GLU OE1 1 1 13 6578 1 1 21 GLU OE2 O 5.401 -3.507 3.135 1.00 . A A . 27 GLU OE2 1 1 13 6579 1 1 22 PHE C C 11.002 0.709 1.296 1.00 . A A . 28 PHE C 1 1 13 6580 1 1 22 PHE CA C 10.103 -0.515 1.464 1.00 . A A . 28 PHE CA 1 1 13 6581 1 1 22 PHE CB C 10.179 -1.404 0.218 1.00 . A A . 28 PHE CB 1 1 13 6582 1 1 22 PHE CD1 C 9.213 -0.112 -1.704 1.00 . A A . 28 PHE CD1 1 1 13 6583 1 1 22 PHE CD2 C 11.571 -0.445 -1.646 1.00 . A A . 28 PHE CD2 1 1 13 6584 1 1 22 PHE CE1 C 9.338 0.593 -2.885 1.00 . A A . 28 PHE CE1 1 1 13 6585 1 1 22 PHE CE2 C 11.703 0.259 -2.828 1.00 . A A . 28 PHE CE2 1 1 13 6586 1 1 22 PHE CG C 10.324 -0.638 -1.071 1.00 . A A . 28 PHE CG 1 1 13 6587 1 1 22 PHE CZ C 10.585 0.778 -3.449 1.00 . A A . 28 PHE CZ 1 1 13 6588 1 1 22 PHE H H 8.004 -0.589 1.213 1.00 . A A . 28 PHE H 1 1 13 6589 1 1 22 PHE HA H 10.443 -1.081 2.317 1.00 . A A . 28 PHE HA 1 1 13 6590 1 1 22 PHE HB2 H 11.026 -2.066 0.308 1.00 . A A . 28 PHE HB2 1 1 13 6591 1 1 22 PHE HB3 H 9.273 -1.992 0.155 1.00 . A A . 28 PHE HB3 1 1 13 6592 1 1 22 PHE HD1 H 12.446 -0.850 -1.162 1.00 . A A . 28 PHE HD1 1 1 13 6593 1 1 22 PHE HD2 H 8.239 -0.255 -1.265 1.00 . A A . 28 PHE HD2 1 1 13 6594 1 1 22 PHE HE1 H 12.680 0.402 -3.265 1.00 . A A . 28 PHE HE1 1 1 13 6595 1 1 22 PHE HE2 H 8.461 0.998 -3.367 1.00 . A A . 28 PHE HE2 1 1 13 6596 1 1 22 PHE HZ H 10.685 1.329 -4.373 1.00 . A A . 28 PHE HZ 1 1 13 6597 1 1 22 PHE N N 8.716 -0.131 1.707 1.00 . A A . 28 PHE N 1 1 13 6598 1 1 22 PHE O O 12.118 0.749 1.813 1.00 . A A . 28 PHE O 1 1 13 6599 1 1 23 ILE C C 11.838 3.515 1.591 1.00 . A A . 29 ILE C 1 1 13 6600 1 1 23 ILE CA C 11.261 2.922 0.305 1.00 . A A . 29 ILE CA 1 1 13 6601 1 1 23 ILE CB C 10.384 3.978 -0.405 1.00 . A A . 29 ILE CB 1 1 13 6602 1 1 23 ILE CD1 C 10.490 5.986 -1.963 1.00 . A A . 29 ILE CD1 1 1 13 6603 1 1 23 ILE CG1 C 11.268 4.994 -1.128 1.00 . A A . 29 ILE CG1 1 1 13 6604 1 1 23 ILE CG2 C 9.458 4.675 0.583 1.00 . A A . 29 ILE CG2 1 1 13 6605 1 1 23 ILE H H 9.614 1.601 0.169 1.00 . A A . 29 ILE H 1 1 13 6606 1 1 23 ILE HA H 12.078 2.671 -0.354 1.00 . A A . 29 ILE HA 1 1 13 6607 1 1 23 ILE HB H 9.770 3.468 -1.133 1.00 . A A . 29 ILE HB 1 1 13 6608 1 1 23 ILE HD11 H 9.743 5.462 -2.542 1.00 . A A . 29 ILE HD11 1 1 13 6609 1 1 23 ILE HD12 H 10.006 6.701 -1.315 1.00 . A A . 29 ILE HD12 1 1 13 6610 1 1 23 ILE HD13 H 11.164 6.503 -2.630 1.00 . A A . 29 ILE HD13 1 1 13 6611 1 1 23 ILE HG12 H 11.837 5.550 -0.398 1.00 . A A . 29 ILE HG12 1 1 13 6612 1 1 23 ILE HG13 H 11.947 4.467 -1.783 1.00 . A A . 29 ILE HG13 1 1 13 6613 1 1 23 ILE HG21 H 9.306 4.041 1.444 1.00 . A A . 29 ILE HG21 1 1 13 6614 1 1 23 ILE HG22 H 9.903 5.608 0.897 1.00 . A A . 29 ILE HG22 1 1 13 6615 1 1 23 ILE HG23 H 8.508 4.872 0.108 1.00 . A A . 29 ILE HG23 1 1 13 6616 1 1 23 ILE N N 10.508 1.699 0.560 1.00 . A A . 29 ILE N 1 1 13 6617 1 1 23 ILE O O 12.847 4.220 1.560 1.00 . A A . 29 ILE O 1 1 13 6618 1 1 24 ALA C C 12.799 2.912 4.566 1.00 . A A . 30 ALA C 1 1 13 6619 1 1 24 ALA CA C 11.645 3.741 4.005 1.00 . A A . 30 ALA CA 1 1 13 6620 1 1 24 ALA CB C 10.488 3.772 4.992 1.00 . A A . 30 ALA CB 1 1 13 6621 1 1 24 ALA H H 10.392 2.666 2.680 1.00 . A A . 30 ALA H 1 1 13 6622 1 1 24 ALA HA H 11.985 4.756 3.858 1.00 . A A . 30 ALA HA 1 1 13 6623 1 1 24 ALA HB1 H 9.828 2.939 4.799 1.00 . A A . 30 ALA HB1 1 1 13 6624 1 1 24 ALA HB2 H 10.871 3.701 6.000 1.00 . A A . 30 ALA HB2 1 1 13 6625 1 1 24 ALA HB3 H 9.942 4.697 4.879 1.00 . A A . 30 ALA HB3 1 1 13 6626 1 1 24 ALA N N 11.193 3.230 2.716 1.00 . A A . 30 ALA N 1 1 13 6627 1 1 24 ALA O O 13.541 3.375 5.432 1.00 . A A . 30 ALA O 1 1 13 6628 1 1 25 TRP C C 15.340 1.138 3.871 1.00 . A A . 31 TRP C 1 1 13 6629 1 1 25 TRP CA C 14.006 0.796 4.538 1.00 . A A . 31 TRP CA 1 1 13 6630 1 1 25 TRP CB C 13.619 -0.670 4.275 1.00 . A A . 31 TRP CB 1 1 13 6631 1 1 25 TRP CD1 C 15.901 -1.797 3.931 1.00 . A A . 31 TRP CD1 1 1 13 6632 1 1 25 TRP CD2 C 14.501 -2.009 2.197 1.00 . A A . 31 TRP CD2 1 1 13 6633 1 1 25 TRP CE2 C 15.706 -2.666 1.883 1.00 . A A . 31 TRP CE2 1 1 13 6634 1 1 25 TRP CE3 C 13.468 -2.011 1.256 1.00 . A A . 31 TRP CE3 1 1 13 6635 1 1 25 TRP CG C 14.646 -1.459 3.512 1.00 . A A . 31 TRP CG 1 1 13 6636 1 1 25 TRP CH2 C 14.876 -3.301 -0.235 1.00 . A A . 31 TRP CH2 1 1 13 6637 1 1 25 TRP CZ2 C 15.904 -3.316 0.667 1.00 . A A . 31 TRP CZ2 1 1 13 6638 1 1 25 TRP CZ3 C 13.667 -2.656 0.050 1.00 . A A . 31 TRP CZ3 1 1 13 6639 1 1 25 TRP H H 12.321 1.365 3.389 1.00 . A A . 31 TRP H 1 1 13 6640 1 1 25 TRP HA H 14.110 0.941 5.603 1.00 . A A . 31 TRP HA 1 1 13 6641 1 1 25 TRP HB2 H 13.463 -1.164 5.221 1.00 . A A . 31 TRP HB2 1 1 13 6642 1 1 25 TRP HB3 H 12.698 -0.691 3.711 1.00 . A A . 31 TRP HB3 1 1 13 6643 1 1 25 TRP HD1 H 16.315 -1.525 4.891 1.00 . A A . 31 TRP HD1 1 1 13 6644 1 1 25 TRP HE1 H 17.456 -2.878 3.021 1.00 . A A . 31 TRP HE1 1 1 13 6645 1 1 25 TRP HE3 H 12.528 -1.518 1.458 1.00 . A A . 31 TRP HE3 1 1 13 6646 1 1 25 TRP HH2 H 14.987 -3.793 -1.190 1.00 . A A . 31 TRP HH2 1 1 13 6647 1 1 25 TRP HZ2 H 16.831 -3.818 0.431 1.00 . A A . 31 TRP HZ2 1 1 13 6648 1 1 25 TRP HZ3 H 12.881 -2.668 -0.689 1.00 . A A . 31 TRP HZ3 1 1 13 6649 1 1 25 TRP N N 12.944 1.684 4.075 1.00 . A A . 31 TRP N 1 1 13 6650 1 1 25 TRP NE1 N 16.545 -2.522 2.957 1.00 . A A . 31 TRP NE1 1 1 13 6651 1 1 25 TRP O O 16.351 1.325 4.547 1.00 . A A . 31 TRP O 1 1 13 6652 1 1 26 LEU C C 17.151 2.847 2.242 1.00 . A A . 32 LEU C 1 1 13 6653 1 1 26 LEU CA C 16.547 1.521 1.791 1.00 . A A . 32 LEU CA 1 1 13 6654 1 1 26 LEU CB C 16.250 1.571 0.291 1.00 . A A . 32 LEU CB 1 1 13 6655 1 1 26 LEU CD1 C 13.977 1.129 -0.681 1.00 . A A . 32 LEU CD1 1 1 13 6656 1 1 26 LEU CD2 C 15.918 -0.306 -1.342 1.00 . A A . 32 LEU CD2 1 1 13 6657 1 1 26 LEU CG C 15.282 0.499 -0.217 1.00 . A A . 32 LEU CG 1 1 13 6658 1 1 26 LEU H H 14.499 1.047 2.059 1.00 . A A . 32 LEU H 1 1 13 6659 1 1 26 LEU HA H 17.261 0.734 1.979 1.00 . A A . 32 LEU HA 1 1 13 6660 1 1 26 LEU HB2 H 15.836 2.542 0.061 1.00 . A A . 32 LEU HB2 1 1 13 6661 1 1 26 LEU HB3 H 17.183 1.463 -0.241 1.00 . A A . 32 LEU HB3 1 1 13 6662 1 1 26 LEU HD11 H 14.003 2.193 -0.498 1.00 . A A . 32 LEU HD11 1 1 13 6663 1 1 26 LEU HD12 H 13.845 0.950 -1.738 1.00 . A A . 32 LEU HD12 1 1 13 6664 1 1 26 LEU HD13 H 13.154 0.691 -0.137 1.00 . A A . 32 LEU HD13 1 1 13 6665 1 1 26 LEU HD21 H 16.650 0.303 -1.850 1.00 . A A . 32 LEU HD21 1 1 13 6666 1 1 26 LEU HD22 H 16.400 -1.181 -0.931 1.00 . A A . 32 LEU HD22 1 1 13 6667 1 1 26 LEU HD23 H 15.154 -0.610 -2.041 1.00 . A A . 32 LEU HD23 1 1 13 6668 1 1 26 LEU HG H 15.054 -0.180 0.592 1.00 . A A . 32 LEU HG 1 1 13 6669 1 1 26 LEU N N 15.335 1.211 2.544 1.00 . A A . 32 LEU N 1 1 13 6670 1 1 26 LEU O O 18.279 2.891 2.734 1.00 . A A . 32 LEU O 1 1 13 6671 1 1 27 VAL C C 17.283 5.286 3.924 1.00 . A A . 33 VAL C 1 1 13 6672 1 1 27 VAL CA C 16.856 5.254 2.458 1.00 . A A . 33 VAL CA 1 1 13 6673 1 1 27 VAL CB C 15.765 6.317 2.224 1.00 . A A . 33 VAL CB 1 1 13 6674 1 1 27 VAL CG1 C 16.297 7.711 2.525 1.00 . A A . 33 VAL CG1 1 1 13 6675 1 1 27 VAL CG2 C 15.242 6.237 0.797 1.00 . A A . 33 VAL CG2 1 1 13 6676 1 1 27 VAL H H 15.505 3.827 1.671 1.00 . A A . 33 VAL H 1 1 13 6677 1 1 27 VAL HA H 17.708 5.502 1.841 1.00 . A A . 33 VAL HA 1 1 13 6678 1 1 27 VAL HB H 14.944 6.116 2.897 1.00 . A A . 33 VAL HB 1 1 13 6679 1 1 27 VAL HG11 H 16.712 7.730 3.522 1.00 . A A . 33 VAL HG11 1 1 13 6680 1 1 27 VAL HG12 H 17.066 7.965 1.811 1.00 . A A . 33 VAL HG12 1 1 13 6681 1 1 27 VAL HG13 H 15.491 8.426 2.457 1.00 . A A . 33 VAL HG13 1 1 13 6682 1 1 27 VAL HG21 H 16.058 6.009 0.127 1.00 . A A . 33 VAL HG21 1 1 13 6683 1 1 27 VAL HG22 H 14.494 5.462 0.731 1.00 . A A . 33 VAL HG22 1 1 13 6684 1 1 27 VAL HG23 H 14.804 7.185 0.521 1.00 . A A . 33 VAL HG23 1 1 13 6685 1 1 27 VAL N N 16.394 3.926 2.070 1.00 . A A . 33 VAL N 1 1 13 6686 1 1 27 VAL O O 18.113 6.105 4.319 1.00 . A A . 33 VAL O 1 1 13 6687 1 1 28 ARG C C 18.488 3.875 6.345 1.00 . A A . 34 ARG C 1 1 13 6688 1 1 28 ARG CA C 17.042 4.318 6.144 1.00 . A A . 34 ARG CA 1 1 13 6689 1 1 28 ARG CB C 16.093 3.354 6.863 1.00 . A A . 34 ARG CB 1 1 13 6690 1 1 28 ARG CD C 15.432 4.024 9.194 1.00 . A A . 34 ARG CD 1 1 13 6691 1 1 28 ARG CG C 15.052 4.053 7.722 1.00 . A A . 34 ARG CG 1 1 13 6692 1 1 28 ARG CZ C 15.511 6.393 9.875 1.00 . A A . 34 ARG CZ 1 1 13 6693 1 1 28 ARG H H 16.061 3.761 4.353 1.00 . A A . 34 ARG H 1 1 13 6694 1 1 28 ARG HA H 16.920 5.306 6.562 1.00 . A A . 34 ARG HA 1 1 13 6695 1 1 28 ARG HB2 H 15.578 2.758 6.124 1.00 . A A . 34 ARG HB2 1 1 13 6696 1 1 28 ARG HB3 H 16.673 2.701 7.498 1.00 . A A . 34 ARG HB3 1 1 13 6697 1 1 28 ARG HD2 H 15.015 3.134 9.642 1.00 . A A . 34 ARG HD2 1 1 13 6698 1 1 28 ARG HD3 H 16.509 3.996 9.274 1.00 . A A . 34 ARG HD3 1 1 13 6699 1 1 28 ARG HE H 14.123 5.081 10.454 1.00 . A A . 34 ARG HE 1 1 13 6700 1 1 28 ARG HG2 H 14.967 5.081 7.403 1.00 . A A . 34 ARG HG2 1 1 13 6701 1 1 28 ARG HG3 H 14.102 3.556 7.595 1.00 . A A . 34 ARG HG3 1 1 13 6702 1 1 28 ARG HH11 H 17.011 5.826 8.641 1.00 . A A . 34 ARG HH11 1 1 13 6703 1 1 28 ARG HH12 H 17.041 7.487 9.132 1.00 . A A . 34 ARG HH12 1 1 13 6704 1 1 28 ARG HH21 H 14.162 7.264 11.101 1.00 . A A . 34 ARG HH21 1 1 13 6705 1 1 28 ARG HH22 H 15.424 8.303 10.528 1.00 . A A . 34 ARG HH22 1 1 13 6706 1 1 28 ARG N N 16.714 4.389 4.725 1.00 . A A . 34 ARG N 1 1 13 6707 1 1 28 ARG NE N 14.933 5.194 9.914 1.00 . A A . 34 ARG NE 1 1 13 6708 1 1 28 ARG NH1 N 16.611 6.584 9.157 1.00 . A A . 34 ARG NH1 1 1 13 6709 1 1 28 ARG NH2 N 14.990 7.403 10.557 1.00 . A A . 34 ARG NH2 1 1 13 6710 1 1 28 ARG O O 19.288 4.587 6.952 1.00 . A A . 34 ARG O 1 1 13 6711 1 1 29 GLY C C 20.850 1.992 4.622 1.00 . A A . 35 GLY C 1 1 13 6712 1 1 29 GLY CA C 20.167 2.177 5.963 1.00 . A A . 35 GLY CA 1 1 13 6713 1 1 29 GLY H H 18.138 2.170 5.356 1.00 . A A . 35 GLY H 1 1 13 6714 1 1 29 GLY HA2 H 20.748 2.865 6.558 1.00 . A A . 35 GLY HA2 1 1 13 6715 1 1 29 GLY HA3 H 20.127 1.224 6.469 1.00 . A A . 35 GLY HA3 1 1 13 6716 1 1 29 GLY N N 18.817 2.694 5.830 1.00 . A A . 35 GLY N 1 1 13 6717 1 1 29 GLY O O 21.120 2.963 3.916 1.00 . A A . 35 GLY O 1 1 13 6718 1 1 30 ARG C C 23.165 1.082 2.935 1.00 . A A . 36 ARG C 1 1 13 6719 1 1 30 ARG CA C 21.787 0.432 3.006 1.00 . A A . 36 ARG CA 1 1 13 6720 1 1 30 ARG CB C 20.927 0.905 1.832 1.00 . A A . 36 ARG CB 1 1 13 6721 1 1 30 ARG CD C 20.444 0.208 -0.533 1.00 . A A . 36 ARG CD 1 1 13 6722 1 1 30 ARG CG C 21.522 0.579 0.472 1.00 . A A . 36 ARG CG 1 1 13 6723 1 1 30 ARG CZ C 20.233 -1.305 -2.467 1.00 . A A . 36 ARG CZ 1 1 13 6724 1 1 30 ARG H H 20.890 0.009 4.876 1.00 . A A . 36 ARG H 1 1 13 6725 1 1 30 ARG HA H 21.903 -0.640 2.946 1.00 . A A . 36 ARG HA 1 1 13 6726 1 1 30 ARG HB2 H 19.957 0.435 1.899 1.00 . A A . 36 ARG HB2 1 1 13 6727 1 1 30 ARG HB3 H 20.804 1.976 1.900 1.00 . A A . 36 ARG HB3 1 1 13 6728 1 1 30 ARG HD2 H 19.689 -0.379 -0.032 1.00 . A A . 36 ARG HD2 1 1 13 6729 1 1 30 ARG HD3 H 19.999 1.115 -0.915 1.00 . A A . 36 ARG HD3 1 1 13 6730 1 1 30 ARG HE H 21.948 -0.531 -1.802 1.00 . A A . 36 ARG HE 1 1 13 6731 1 1 30 ARG HG2 H 22.058 1.443 0.108 1.00 . A A . 36 ARG HG2 1 1 13 6732 1 1 30 ARG HG3 H 22.204 -0.252 0.579 1.00 . A A . 36 ARG HG3 1 1 13 6733 1 1 30 ARG HH11 H 18.484 -0.871 -1.548 1.00 . A A . 36 ARG HH11 1 1 13 6734 1 1 30 ARG HH12 H 18.363 -1.933 -2.910 1.00 . A A . 36 ARG HH12 1 1 13 6735 1 1 30 ARG HH21 H 21.791 -1.926 -3.594 1.00 . A A . 36 ARG HH21 1 1 13 6736 1 1 30 ARG HH22 H 20.240 -2.532 -4.072 1.00 . A A . 36 ARG HH22 1 1 13 6737 1 1 30 ARG N N 21.130 0.741 4.271 1.00 . A A . 36 ARG N 1 1 13 6738 1 1 30 ARG NE N 20.980 -0.565 -1.651 1.00 . A A . 36 ARG NE 1 1 13 6739 1 1 30 ARG NH1 N 18.919 -1.375 -2.294 1.00 . A A . 36 ARG NH1 1 1 13 6740 1 1 30 ARG NH2 N 20.801 -1.976 -3.459 1.00 . A A . 36 ARG NH2 1 1 13 6741 1 1 30 ARG O O 23.283 2.306 2.881 1.00 . A A . 36 ARG O 1 1 13 6742 1 1 31 GLY C C 26.412 0.304 4.038 1.00 . A A . 37 GLY C 1 1 13 6743 1 1 31 GLY CA C 25.561 0.767 2.872 1.00 . A A . 37 GLY CA 1 1 13 6744 1 1 31 GLY H H 24.050 -0.713 2.981 1.00 . A A . 37 GLY H 1 1 13 6745 1 1 31 GLY HA2 H 26.017 0.432 1.952 1.00 . A A . 37 GLY HA2 1 1 13 6746 1 1 31 GLY HA3 H 25.527 1.846 2.872 1.00 . A A . 37 GLY HA3 1 1 13 6747 1 1 31 GLY N N 24.205 0.254 2.936 1.00 . A A . 37 GLY N 1 1 13 6748 1 1 31 GLY O O 25.943 0.402 5.191 1.00 . A A . 37 GLY O 1 1 13 6749 1 1 31 GLY OXT O 27.548 -0.157 3.797 1.00 . A A . 37 GLY OXT 1 1 13 6750 2 2 1 . C02 C 9.268 -3.143 -4.338 1.00 . B A . 1038 D6M C02 1 1 13 6751 2 2 1 . C04 C 7.058 -2.426 -5.071 1.00 . B A . 1038 D6M C04 1 1 13 6752 2 2 1 . C05 C 6.464 -1.205 -5.781 1.00 . B A . 1038 D6M C05 1 1 13 6753 2 2 1 . C06 C 7.211 0.092 -5.505 1.00 . B A . 1038 D6M C06 1 1 13 6754 2 2 1 . C07 C 6.391 1.086 -4.704 1.00 . B A . 1038 D6M C07 1 1 13 6755 2 2 1 . C09 C 6.494 -3.705 -5.682 1.00 . B A . 1038 D6M C09 1 1 13 6756 2 2 1 . C12 C 10.783 -3.103 -4.406 1.00 . B A . 1038 D6M C12 1 1 13 6757 2 2 1 . C13 C 11.437 -3.585 -3.121 1.00 . B A . 1038 D6M C13 1 1 13 6758 2 2 1 . C14 C 12.904 -3.927 -3.332 1.00 . B A . 1038 D6M C14 1 1 13 6759 2 2 1 . C15 C 13.758 -2.675 -3.452 1.00 . B A . 1038 D6M C15 1 1 13 6760 2 2 1 . C16 C 14.825 -2.831 -4.524 1.00 . B A . 1038 D6M C16 1 1 13 6761 2 2 1 . C17 C 15.731 -1.612 -4.593 1.00 . B A . 1038 D6M C17 1 1 13 6762 2 2 1 . C18 C 14.999 -0.405 -5.156 1.00 . B A . 1038 D6M C18 1 1 13 6763 2 2 1 . C19 C 15.603 0.897 -4.656 1.00 . B A . 1038 D6M C19 1 1 13 6764 2 2 1 . C20 C 14.628 2.054 -4.801 1.00 . B A . 1038 D6M C20 1 1 13 6765 2 2 1 . C21 C 15.139 3.303 -4.102 1.00 . B A . 1038 D6M C21 1 1 13 6766 2 2 1 . C22 C 14.972 3.204 -2.594 1.00 . B A . 1038 D6M C22 1 1 13 6767 2 2 1 . C23 C 15.472 4.457 -1.893 1.00 . B A . 1038 D6M C23 1 1 13 6768 2 2 1 . C24 C 16.947 4.701 -2.167 1.00 . B A . 1038 D6M C24 1 1 13 6769 2 2 1 . C25 C 17.803 3.546 -1.676 1.00 . B A . 1038 D6M C25 1 1 13 6770 2 2 1 . C26 C 19.275 3.791 -1.933 1.00 . B A . 1038 D6M C26 1 1 13 6771 2 2 1 . H03 H 8.949 -1.857 -5.838 1.00 . B A . 1038 D6M H03 1 1 13 6772 2 2 1 . H04 H 6.785 -2.390 -4.027 1.00 . B A . 1038 D6M H04 1 1 13 6773 2 2 1 . HP21 H 11.094 -2.086 -4.594 1.00 . B A . 1038 D6M HP21 1 1 13 6774 2 2 1 . HP22 H 11.109 -3.735 -5.219 1.00 . B A . 1038 D6M HP22 1 1 13 6775 2 2 1 . HP31 H 10.918 -4.467 -2.773 1.00 . B A . 1038 D6M HP31 1 1 13 6776 2 2 1 . HP32 H 11.364 -2.807 -2.377 1.00 . B A . 1038 D6M HP32 1 1 13 6777 2 2 1 . HP41 H 13.001 -4.508 -4.238 1.00 . B A . 1038 D6M HP41 1 1 13 6778 2 2 1 . HP42 H 13.252 -4.508 -2.491 1.00 . B A . 1038 D6M HP42 1 1 13 6779 2 2 1 . HP51 H 14.239 -2.487 -2.503 1.00 . B A . 1038 D6M HP51 1 1 13 6780 2 2 1 . HP52 H 13.124 -1.841 -3.709 1.00 . B A . 1038 D6M HP52 1 1 13 6781 2 2 1 . HP61 H 14.342 -2.964 -5.482 1.00 . B A . 1038 D6M HP61 1 1 13 6782 2 2 1 . HP62 H 15.425 -3.700 -4.298 1.00 . B A . 1038 D6M HP62 1 1 13 6783 2 2 1 . HP71 H 16.575 -1.839 -5.227 1.00 . B A . 1038 D6M HP71 1 1 13 6784 2 2 1 . HP72 H 16.079 -1.378 -3.598 1.00 . B A . 1038 D6M HP72 1 1 13 6785 2 2 1 . HP81 H 13.963 -0.451 -4.854 1.00 . B A . 1038 D6M HP81 1 1 13 6786 2 2 1 . HP82 H 15.062 -0.429 -6.234 1.00 . B A . 1038 D6M HP82 1 1 13 6787 2 2 1 . HP91 H 16.493 1.113 -5.229 1.00 . B A . 1038 D6M HP91 1 1 13 6788 2 2 1 . HP92 H 15.861 0.786 -3.614 1.00 . B A . 1038 D6M HP92 1 1 13 6789 2 2 1 . HPA1 H 13.681 1.771 -4.366 1.00 . B A . 1038 D6M HPA1 1 1 13 6790 2 2 1 . HPA2 H 14.494 2.271 -5.850 1.00 . B A . 1038 D6M HPA2 1 1 13 6791 2 2 1 . HPB1 H 14.585 4.158 -4.462 1.00 . B A . 1038 D6M HPB1 1 1 13 6792 2 2 1 . HPB2 H 16.187 3.429 -4.331 1.00 . B A . 1038 D6M HPB2 1 1 13 6793 2 2 1 . HPC1 H 15.533 2.354 -2.236 1.00 . B A . 1038 D6M HPC1 1 1 13 6794 2 2 1 . HPC2 H 13.926 3.070 -2.366 1.00 . B A . 1038 D6M HPC2 1 1 13 6795 2 2 1 . HPD1 H 15.327 4.344 -0.828 1.00 . B A . 1038 D6M HPD1 1 1 13 6796 2 2 1 . HPD2 H 14.905 5.306 -2.246 1.00 . B A . 1038 D6M HPD2 1 1 13 6797 2 2 1 . HPE1 H 17.252 5.605 -1.661 1.00 . B A . 1038 D6M HPE1 1 1 13 6798 2 2 1 . HPE2 H 17.091 4.816 -3.231 1.00 . B A . 1038 D6M HPE2 1 1 13 6799 2 2 1 . HPF1 H 17.509 2.643 -2.192 1.00 . B A . 1038 D6M HPF1 1 1 13 6800 2 2 1 . HPF2 H 17.659 3.423 -0.614 1.00 . B A . 1038 D6M HPF2 1 1 13 6801 2 2 1 . HPG1 H 19.387 4.449 -2.781 1.00 . B A . 1038 D6M HPG1 1 1 13 6802 2 2 1 . HPG2 H 19.765 2.851 -2.139 1.00 . B A . 1038 D6M HPG2 1 1 13 6803 2 2 1 . HPG3 H 19.721 4.247 -1.061 1.00 . B A . 1038 D6M HPG3 1 1 13 6804 2 2 1 . HQ21 H 8.110 -0.136 -4.953 1.00 . B A . 1038 D6M HQ21 1 1 13 6805 2 2 1 . HQ22 H 7.475 0.546 -6.449 1.00 . B A . 1038 D6M HQ22 1 1 13 6806 2 2 1 . HQ31 H 6.479 -1.383 -6.846 1.00 . B A . 1038 D6M HQ31 1 1 13 6807 2 2 1 . HQ32 H 5.440 -1.081 -5.461 1.00 . B A . 1038 D6M HQ32 1 1 13 6808 2 2 1 . N03 N 8.515 -2.408 -5.153 1.00 . B A . 1038 D6M N03 1 1 13 6809 2 2 1 . O01 O 8.743 -3.863 -3.488 1.00 . B A . 1038 D6M O01 1 1 13 6810 2 2 1 . O08 O 5.400 0.674 -4.100 1.00 . B A . 1038 D6M O08 1 1 13 6811 2 2 1 . O10 O 5.261 -3.780 -5.863 1.00 . B A . 1038 D6M O10 1 1 13 6812 2 2 1 . O11 O 7.291 -4.622 -5.972 1.00 . B A . 1038 D6M O11 1 1 14 6813 1 1 1 HIS C C -22.661 -3.901 3.557 1.00 . A A . 7 HIS C 1 1 14 6814 1 1 1 HIS CA C -23.866 -3.572 2.682 1.00 . A A . 7 HIS CA 1 1 14 6815 1 1 1 HIS CB C -24.998 -2.999 3.537 1.00 . A A . 7 HIS CB 1 1 14 6816 1 1 1 HIS CD2 C -25.864 -1.634 1.508 1.00 . A A . 7 HIS CD2 1 1 14 6817 1 1 1 HIS CE1 C -27.437 -0.501 2.533 1.00 . A A . 7 HIS CE1 1 1 14 6818 1 1 1 HIS CG C -25.857 -2.013 2.809 1.00 . A A . 7 HIS CG 1 1 14 6819 1 1 1 HIS H1 H -23.548 -5.286 1.590 1.00 . A A . 7 HIS H1 1 1 14 6820 1 1 1 HIS H2 H -24.866 -5.370 2.682 1.00 . A A . 7 HIS H2 1 1 14 6821 1 1 1 HIS H3 H -25.013 -4.469 1.229 1.00 . A A . 7 HIS H3 1 1 14 6822 1 1 1 HIS HA H -23.576 -2.843 1.941 1.00 . A A . 7 HIS HA 1 1 14 6823 1 1 1 HIS HB2 H -25.632 -3.807 3.871 1.00 . A A . 7 HIS HB2 1 1 14 6824 1 1 1 HIS HB3 H -24.574 -2.502 4.397 1.00 . A A . 7 HIS HB3 1 1 14 6825 1 1 1 HIS HD1 H -27.098 -1.334 4.371 1.00 . A A . 7 HIS HD1 1 1 14 6826 1 1 1 HIS HD2 H -25.212 -2.003 0.730 1.00 . A A . 7 HIS HD2 1 1 14 6827 1 1 1 HIS HE1 H -28.251 0.182 2.729 1.00 . A A . 7 HIS HE1 1 1 14 6828 1 1 1 HIS HE2 H -27.150 -0.304 0.515 1.00 . A A . 7 HIS HE2 1 1 14 6829 1 1 1 HIS N N -24.369 -4.784 1.982 1.00 . A A . 7 HIS N 1 1 14 6830 1 1 1 HIS ND1 N -26.854 -1.284 3.423 1.00 . A A . 7 HIS ND1 1 1 14 6831 1 1 1 HIS NE2 N -26.855 -0.694 1.364 1.00 . A A . 7 HIS NE2 1 1 14 6832 1 1 1 HIS O O -22.660 -4.896 4.281 1.00 . A A . 7 HIS O 1 1 14 6833 1 1 2 ALA C C -20.005 -1.973 4.972 1.00 . A A . 8 ALA C 1 1 14 6834 1 1 2 ALA CA C -20.424 -3.259 4.269 1.00 . A A . 8 ALA CA 1 1 14 6835 1 1 2 ALA CB C -19.299 -3.767 3.380 1.00 . A A . 8 ALA CB 1 1 14 6836 1 1 2 ALA H H -21.696 -2.282 2.888 1.00 . A A . 8 ALA H 1 1 14 6837 1 1 2 ALA HA H -20.631 -4.014 5.013 1.00 . A A . 8 ALA HA 1 1 14 6838 1 1 2 ALA HB1 H -19.655 -4.593 2.784 1.00 . A A . 8 ALA HB1 1 1 14 6839 1 1 2 ALA HB2 H -18.967 -2.971 2.730 1.00 . A A . 8 ALA HB2 1 1 14 6840 1 1 2 ALA HB3 H -18.474 -4.096 3.995 1.00 . A A . 8 ALA HB3 1 1 14 6841 1 1 2 ALA N N -21.636 -3.058 3.484 1.00 . A A . 8 ALA N 1 1 14 6842 1 1 2 ALA O O -20.751 -0.994 4.993 1.00 . A A . 8 ALA O 1 1 14 6843 1 1 3 GLU C C -17.953 0.307 5.276 1.00 . A A . 9 GLU C 1 1 14 6844 1 1 3 GLU CA C -18.287 -0.816 6.253 1.00 . A A . 9 GLU CA 1 1 14 6845 1 1 3 GLU CB C -17.042 -1.193 7.058 1.00 . A A . 9 GLU CB 1 1 14 6846 1 1 3 GLU CD C -16.501 -3.103 8.622 1.00 . A A . 9 GLU CD 1 1 14 6847 1 1 3 GLU CG C -17.358 -1.876 8.379 1.00 . A A . 9 GLU CG 1 1 14 6848 1 1 3 GLU H H -18.258 -2.793 5.497 1.00 . A A . 9 GLU H 1 1 14 6849 1 1 3 GLU HA H -19.053 -0.470 6.931 1.00 . A A . 9 GLU HA 1 1 14 6850 1 1 3 GLU HB2 H -16.434 -1.862 6.467 1.00 . A A . 9 GLU HB2 1 1 14 6851 1 1 3 GLU HB3 H -16.477 -0.297 7.267 1.00 . A A . 9 GLU HB3 1 1 14 6852 1 1 3 GLU HG2 H -17.190 -1.174 9.182 1.00 . A A . 9 GLU HG2 1 1 14 6853 1 1 3 GLU HG3 H -18.396 -2.175 8.375 1.00 . A A . 9 GLU HG3 1 1 14 6854 1 1 3 GLU N N -18.806 -1.982 5.548 1.00 . A A . 9 GLU N 1 1 14 6855 1 1 3 GLU O O -18.166 0.177 4.070 1.00 . A A . 9 GLU O 1 1 14 6856 1 1 3 GLU OE1 O -16.125 -3.770 7.635 1.00 . A A . 9 GLU OE1 1 1 14 6857 1 1 3 GLU OE2 O -16.205 -3.396 9.800 1.00 . A A . 9 GLU OE2 1 1 14 6858 1 1 4 GLY C C -15.668 3.040 5.223 1.00 . A A . 10 GLY C 1 1 14 6859 1 1 4 GLY CA C -17.075 2.538 4.963 1.00 . A A . 10 GLY CA 1 1 14 6860 1 1 4 GLY H H -17.282 1.457 6.771 1.00 . A A . 10 GLY H 1 1 14 6861 1 1 4 GLY HA2 H -17.153 2.240 3.927 1.00 . A A . 10 GLY HA2 1 1 14 6862 1 1 4 GLY HA3 H -17.772 3.342 5.147 1.00 . A A . 10 GLY HA3 1 1 14 6863 1 1 4 GLY N N -17.429 1.409 5.804 1.00 . A A . 10 GLY N 1 1 14 6864 1 1 4 GLY O O -15.410 3.685 6.239 1.00 . A A . 10 GLY O 1 1 14 6865 1 1 5 THR C C -12.796 3.574 3.080 1.00 . A A . 11 THR C 1 1 14 6866 1 1 5 THR CA C -13.369 3.169 4.434 1.00 . A A . 11 THR CA 1 1 14 6867 1 1 5 THR CB C -12.525 2.049 5.045 1.00 . A A . 11 THR CB 1 1 14 6868 1 1 5 THR CG2 C -12.450 0.812 4.176 1.00 . A A . 11 THR CG2 1 1 14 6869 1 1 5 THR H H -15.025 2.227 3.514 1.00 . A A . 11 THR H 1 1 14 6870 1 1 5 THR HA H -13.346 4.025 5.092 1.00 . A A . 11 THR HA 1 1 14 6871 1 1 5 THR HB H -12.959 1.762 5.992 1.00 . A A . 11 THR HB 1 1 14 6872 1 1 5 THR HG1 H -11.218 3.313 5.773 1.00 . A A . 11 THR HG1 1 1 14 6873 1 1 5 THR HG21 H -13.329 0.756 3.552 1.00 . A A . 11 THR HG21 1 1 14 6874 1 1 5 THR HG22 H -11.569 0.862 3.554 1.00 . A A . 11 THR HG22 1 1 14 6875 1 1 5 THR HG23 H -12.398 -0.066 4.804 1.00 . A A . 11 THR HG23 1 1 14 6876 1 1 5 THR N N -14.757 2.744 4.302 1.00 . A A . 11 THR N 1 1 14 6877 1 1 5 THR O O -13.299 3.161 2.035 1.00 . A A . 11 THR O 1 1 14 6878 1 1 5 THR OG1 O -11.199 2.490 5.279 1.00 . A A . 11 THR OG1 1 1 14 6879 1 1 6 PHE C C -9.592 4.691 1.942 1.00 . A A . 12 PHE C 1 1 14 6880 1 1 6 PHE CA C -11.109 4.844 1.871 1.00 . A A . 12 PHE CA 1 1 14 6881 1 1 6 PHE CB C -11.482 6.303 1.592 1.00 . A A . 12 PHE CB 1 1 14 6882 1 1 6 PHE CD1 C -11.089 7.409 3.811 1.00 . A A . 12 PHE CD1 1 1 14 6883 1 1 6 PHE CD2 C -9.778 8.110 1.947 1.00 . A A . 12 PHE CD2 1 1 14 6884 1 1 6 PHE CE1 C -10.435 8.320 4.618 1.00 . A A . 12 PHE CE1 1 1 14 6885 1 1 6 PHE CE2 C -9.121 9.024 2.748 1.00 . A A . 12 PHE CE2 1 1 14 6886 1 1 6 PHE CG C -10.768 7.294 2.468 1.00 . A A . 12 PHE CG 1 1 14 6887 1 1 6 PHE CZ C -9.450 9.129 4.085 1.00 . A A . 12 PHE CZ 1 1 14 6888 1 1 6 PHE H H -11.388 4.684 3.965 1.00 . A A . 12 PHE H 1 1 14 6889 1 1 6 PHE HA H -11.480 4.230 1.064 1.00 . A A . 12 PHE HA 1 1 14 6890 1 1 6 PHE HB2 H -11.242 6.538 0.566 1.00 . A A . 12 PHE HB2 1 1 14 6891 1 1 6 PHE HB3 H -12.544 6.430 1.745 1.00 . A A . 12 PHE HB3 1 1 14 6892 1 1 6 PHE HD1 H -9.521 8.028 0.901 1.00 . A A . 12 PHE HD1 1 1 14 6893 1 1 6 PHE HD2 H -11.859 6.776 4.228 1.00 . A A . 12 PHE HD2 1 1 14 6894 1 1 6 PHE HE1 H -8.351 9.654 2.329 1.00 . A A . 12 PHE HE1 1 1 14 6895 1 1 6 PHE HE2 H -10.694 8.400 5.663 1.00 . A A . 12 PHE HE2 1 1 14 6896 1 1 6 PHE HZ H -8.938 9.843 4.713 1.00 . A A . 12 PHE HZ 1 1 14 6897 1 1 6 PHE N N -11.744 4.386 3.103 1.00 . A A . 12 PHE N 1 1 14 6898 1 1 6 PHE O O -8.958 4.267 0.977 1.00 . A A . 12 PHE O 1 1 14 6899 1 1 7 THR C C -7.005 3.652 2.721 1.00 . A A . 13 THR C 1 1 14 6900 1 1 7 THR CA C -7.570 4.950 3.295 1.00 . A A . 13 THR CA 1 1 14 6901 1 1 7 THR CB C -7.241 5.043 4.786 1.00 . A A . 13 THR CB 1 1 14 6902 1 1 7 THR CG2 C -7.477 6.421 5.366 1.00 . A A . 13 THR CG2 1 1 14 6903 1 1 7 THR H H -9.577 5.375 3.822 1.00 . A A . 13 THR H 1 1 14 6904 1 1 7 THR HA H -7.112 5.783 2.784 1.00 . A A . 13 THR HA 1 1 14 6905 1 1 7 THR HB H -6.198 4.798 4.930 1.00 . A A . 13 THR HB 1 1 14 6906 1 1 7 THR HG1 H -8.940 4.399 5.517 1.00 . A A . 13 THR HG1 1 1 14 6907 1 1 7 THR HG21 H -8.529 6.660 5.309 1.00 . A A . 13 THR HG21 1 1 14 6908 1 1 7 THR HG22 H -7.159 6.436 6.398 1.00 . A A . 13 THR HG22 1 1 14 6909 1 1 7 THR HG23 H -6.911 7.150 4.805 1.00 . A A . 13 THR HG23 1 1 14 6910 1 1 7 THR N N -9.016 5.042 3.091 1.00 . A A . 13 THR N 1 1 14 6911 1 1 7 THR O O -6.086 3.673 1.901 1.00 . A A . 13 THR O 1 1 14 6912 1 1 7 THR OG1 O -8.020 4.124 5.530 1.00 . A A . 13 THR OG1 1 1 14 6913 1 1 8 SER C C -7.898 0.791 1.441 1.00 . A A . 14 SER C 1 1 14 6914 1 1 8 SER CA C -7.116 1.221 2.679 1.00 . A A . 14 SER CA 1 1 14 6915 1 1 8 SER CB C -7.271 0.174 3.784 1.00 . A A . 14 SER CB 1 1 14 6916 1 1 8 SER H H -8.292 2.574 3.805 1.00 . A A . 14 SER H 1 1 14 6917 1 1 8 SER HA H -6.071 1.304 2.419 1.00 . A A . 14 SER HA 1 1 14 6918 1 1 8 SER HB2 H -7.530 -0.777 3.342 1.00 . A A . 14 SER HB2 1 1 14 6919 1 1 8 SER HB3 H -6.338 0.079 4.320 1.00 . A A . 14 SER HB3 1 1 14 6920 1 1 8 SER HG H -7.897 1.009 5.442 1.00 . A A . 14 SER HG 1 1 14 6921 1 1 8 SER N N -7.562 2.526 3.153 1.00 . A A . 14 SER N 1 1 14 6922 1 1 8 SER O O -7.434 -0.041 0.661 1.00 . A A . 14 SER O 1 1 14 6923 1 1 8 SER OG O -8.288 0.544 4.699 1.00 . A A . 14 SER OG 1 1 14 6924 1 1 9 ASP C C -9.328 1.546 -1.177 1.00 . A A . 15 ASP C 1 1 14 6925 1 1 9 ASP CA C -9.934 1.028 0.125 1.00 . A A . 15 ASP CA 1 1 14 6926 1 1 9 ASP CB C -11.338 1.607 0.319 1.00 . A A . 15 ASP CB 1 1 14 6927 1 1 9 ASP CG C -12.387 0.529 0.511 1.00 . A A . 15 ASP CG 1 1 14 6928 1 1 9 ASP H H -9.408 2.012 1.923 1.00 . A A . 15 ASP H 1 1 14 6929 1 1 9 ASP HA H -10.005 -0.048 0.069 1.00 . A A . 15 ASP HA 1 1 14 6930 1 1 9 ASP HB2 H -11.341 2.244 1.192 1.00 . A A . 15 ASP HB2 1 1 14 6931 1 1 9 ASP HB3 H -11.605 2.193 -0.549 1.00 . A A . 15 ASP HB3 1 1 14 6932 1 1 9 ASP N N -9.089 1.358 1.267 1.00 . A A . 15 ASP N 1 1 14 6933 1 1 9 ASP O O -9.447 0.908 -2.223 1.00 . A A . 15 ASP O 1 1 14 6934 1 1 9 ASP OD1 O -12.194 -0.587 -0.015 1.00 . A A . 15 ASP OD1 1 1 14 6935 1 1 9 ASP OD2 O -13.401 0.800 1.188 1.00 . A A . 15 ASP OD2 1 1 14 6936 1 1 10 VAL C C -7.078 2.332 -2.941 1.00 . A A . 16 VAL C 1 1 14 6937 1 1 10 VAL CA C -8.059 3.302 -2.287 1.00 . A A . 16 VAL CA 1 1 14 6938 1 1 10 VAL CB C -7.320 4.611 -1.938 1.00 . A A . 16 VAL CB 1 1 14 6939 1 1 10 VAL CG1 C -6.681 5.219 -3.180 1.00 . A A . 16 VAL CG1 1 1 14 6940 1 1 10 VAL CG2 C -8.271 5.601 -1.279 1.00 . A A . 16 VAL CG2 1 1 14 6941 1 1 10 VAL H H -8.617 3.170 -0.248 1.00 . A A . 16 VAL H 1 1 14 6942 1 1 10 VAL HA H -8.843 3.534 -2.993 1.00 . A A . 16 VAL HA 1 1 14 6943 1 1 10 VAL HB H -6.534 4.378 -1.234 1.00 . A A . 16 VAL HB 1 1 14 6944 1 1 10 VAL HG11 H -6.748 4.519 -4.000 1.00 . A A . 16 VAL HG11 1 1 14 6945 1 1 10 VAL HG12 H -7.198 6.130 -3.443 1.00 . A A . 16 VAL HG12 1 1 14 6946 1 1 10 VAL HG13 H -5.643 5.440 -2.979 1.00 . A A . 16 VAL HG13 1 1 14 6947 1 1 10 VAL HG21 H -9.215 5.117 -1.079 1.00 . A A . 16 VAL HG21 1 1 14 6948 1 1 10 VAL HG22 H -7.841 5.950 -0.352 1.00 . A A . 16 VAL HG22 1 1 14 6949 1 1 10 VAL HG23 H -8.431 6.441 -1.940 1.00 . A A . 16 VAL HG23 1 1 14 6950 1 1 10 VAL N N -8.679 2.705 -1.109 1.00 . A A . 16 VAL N 1 1 14 6951 1 1 10 VAL O O -7.229 1.976 -4.110 1.00 . A A . 16 VAL O 1 1 14 6952 1 1 11 SER C C -5.722 -0.266 -3.283 1.00 . A A . 17 SER C 1 1 14 6953 1 1 11 SER CA C -5.069 0.978 -2.684 1.00 . A A . 17 SER CA 1 1 14 6954 1 1 11 SER CB C -4.111 0.574 -1.562 1.00 . A A . 17 SER CB 1 1 14 6955 1 1 11 SER H H -6.008 2.228 -1.256 1.00 . A A . 17 SER H 1 1 14 6956 1 1 11 SER HA H -4.509 1.483 -3.457 1.00 . A A . 17 SER HA 1 1 14 6957 1 1 11 SER HB2 H -4.673 0.399 -0.657 1.00 . A A . 17 SER HB2 1 1 14 6958 1 1 11 SER HB3 H -3.591 -0.331 -1.843 1.00 . A A . 17 SER HB3 1 1 14 6959 1 1 11 SER HG H -3.532 2.247 -0.723 1.00 . A A . 17 SER HG 1 1 14 6960 1 1 11 SER N N -6.074 1.908 -2.180 1.00 . A A . 17 SER N 1 1 14 6961 1 1 11 SER O O -5.133 -0.944 -4.124 1.00 . A A . 17 SER O 1 1 14 6962 1 1 11 SER OG O -3.156 1.591 -1.315 1.00 . A A . 17 SER OG 1 1 14 6963 1 1 12 SER C C -8.051 -1.565 -4.798 1.00 . A A . 18 SER C 1 1 14 6964 1 1 12 SER CA C -7.672 -1.723 -3.328 1.00 . A A . 18 SER CA 1 1 14 6965 1 1 12 SER CB C -8.931 -1.948 -2.488 1.00 . A A . 18 SER CB 1 1 14 6966 1 1 12 SER H H -7.358 0.015 -2.166 1.00 . A A . 18 SER H 1 1 14 6967 1 1 12 SER HA H -7.028 -2.583 -3.227 1.00 . A A . 18 SER HA 1 1 14 6968 1 1 12 SER HB2 H -9.763 -1.433 -2.943 1.00 . A A . 18 SER HB2 1 1 14 6969 1 1 12 SER HB3 H -9.145 -3.006 -2.441 1.00 . A A . 18 SER HB3 1 1 14 6970 1 1 12 SER HG H -8.618 -2.195 -0.569 1.00 . A A . 18 SER HG 1 1 14 6971 1 1 12 SER N N -6.941 -0.560 -2.840 1.00 . A A . 18 SER N 1 1 14 6972 1 1 12 SER O O -8.027 -2.533 -5.558 1.00 . A A . 18 SER O 1 1 14 6973 1 1 12 SER OG O -8.759 -1.459 -1.169 1.00 . A A . 18 SER OG 1 1 14 6974 1 1 13 TYR C C -7.569 0.087 -7.474 1.00 . A A . 19 TYR C 1 1 14 6975 1 1 13 TYR CA C -8.797 -0.087 -6.580 1.00 . A A . 19 TYR CA 1 1 14 6976 1 1 13 TYR CB C -9.719 1.141 -6.662 1.00 . A A . 19 TYR CB 1 1 14 6977 1 1 13 TYR CD1 C -8.496 2.817 -8.108 1.00 . A A . 19 TYR CD1 1 1 14 6978 1 1 13 TYR CD2 C -8.871 3.368 -5.820 1.00 . A A . 19 TYR CD2 1 1 14 6979 1 1 13 TYR CE1 C -7.861 4.029 -8.301 1.00 . A A . 19 TYR CE1 1 1 14 6980 1 1 13 TYR CE2 C -8.236 4.582 -6.004 1.00 . A A . 19 TYR CE2 1 1 14 6981 1 1 13 TYR CG C -9.011 2.466 -6.865 1.00 . A A . 19 TYR CG 1 1 14 6982 1 1 13 TYR CZ C -7.734 4.907 -7.246 1.00 . A A . 19 TYR CZ 1 1 14 6983 1 1 13 TYR H H -8.416 0.389 -4.549 1.00 . A A . 19 TYR H 1 1 14 6984 1 1 13 TYR HA H -9.345 -0.951 -6.925 1.00 . A A . 19 TYR HA 1 1 14 6985 1 1 13 TYR HB2 H -10.404 1.010 -7.485 1.00 . A A . 19 TYR HB2 1 1 14 6986 1 1 13 TYR HB3 H -10.285 1.211 -5.743 1.00 . A A . 19 TYR HB3 1 1 14 6987 1 1 13 TYR HD1 H -8.597 2.127 -8.932 1.00 . A A . 19 TYR HD1 1 1 14 6988 1 1 13 TYR HD2 H -9.265 3.110 -4.848 1.00 . A A . 19 TYR HD2 1 1 14 6989 1 1 13 TYR HE1 H -7.469 4.284 -9.274 1.00 . A A . 19 TYR HE1 1 1 14 6990 1 1 13 TYR HE2 H -8.138 5.270 -5.179 1.00 . A A . 19 TYR HE2 1 1 14 6991 1 1 13 TYR HH H -6.566 6.320 -6.665 1.00 . A A . 19 TYR HH 1 1 14 6992 1 1 13 TYR N N -8.409 -0.346 -5.197 1.00 . A A . 19 TYR N 1 1 14 6993 1 1 13 TYR O O -7.656 -0.054 -8.694 1.00 . A A . 19 TYR O 1 1 14 6994 1 1 13 TYR OH O -7.103 6.116 -7.434 1.00 . A A . 19 TYR OH 1 1 14 6995 1 1 14 LEU C C -4.711 -0.737 -8.230 1.00 . A A . 20 LEU C 1 1 14 6996 1 1 14 LEU CA C -5.187 0.576 -7.609 1.00 . A A . 20 LEU CA 1 1 14 6997 1 1 14 LEU CB C -4.097 1.143 -6.697 1.00 . A A . 20 LEU CB 1 1 14 6998 1 1 14 LEU CD1 C -3.316 2.915 -5.107 1.00 . A A . 20 LEU CD1 1 1 14 6999 1 1 14 LEU CD2 C -5.081 3.446 -6.797 1.00 . A A . 20 LEU CD2 1 1 14 7000 1 1 14 LEU CG C -4.505 2.374 -5.885 1.00 . A A . 20 LEU CG 1 1 14 7001 1 1 14 LEU H H -6.416 0.487 -5.888 1.00 . A A . 20 LEU H 1 1 14 7002 1 1 14 LEU HA H -5.382 1.283 -8.402 1.00 . A A . 20 LEU HA 1 1 14 7003 1 1 14 LEU HB2 H -3.795 0.367 -6.009 1.00 . A A . 20 LEU HB2 1 1 14 7004 1 1 14 LEU HB3 H -3.248 1.409 -7.309 1.00 . A A . 20 LEU HB3 1 1 14 7005 1 1 14 LEU HD11 H -2.884 2.124 -4.513 1.00 . A A . 20 LEU HD11 1 1 14 7006 1 1 14 LEU HD12 H -2.576 3.293 -5.797 1.00 . A A . 20 LEU HD12 1 1 14 7007 1 1 14 LEU HD13 H -3.645 3.714 -4.458 1.00 . A A . 20 LEU HD13 1 1 14 7008 1 1 14 LEU HD21 H -5.782 2.995 -7.483 1.00 . A A . 20 LEU HD21 1 1 14 7009 1 1 14 LEU HD22 H -5.589 4.190 -6.201 1.00 . A A . 20 LEU HD22 1 1 14 7010 1 1 14 LEU HD23 H -4.282 3.914 -7.352 1.00 . A A . 20 LEU HD23 1 1 14 7011 1 1 14 LEU HG H -5.268 2.091 -5.175 1.00 . A A . 20 LEU HG 1 1 14 7012 1 1 14 LEU N N -6.427 0.390 -6.863 1.00 . A A . 20 LEU N 1 1 14 7013 1 1 14 LEU O O -3.825 -0.739 -9.085 1.00 . A A . 20 LEU O 1 1 14 7014 1 1 15 GLU C C -3.422 -3.335 -8.407 1.00 . A A . 21 GLU C 1 1 14 7015 1 1 15 GLU CA C -4.937 -3.175 -8.304 1.00 . A A . 21 GLU CA 1 1 14 7016 1 1 15 GLU CB C -5.588 -3.428 -9.668 1.00 . A A . 21 GLU CB 1 1 14 7017 1 1 15 GLU CD C -5.926 -2.641 -12.044 1.00 . A A . 21 GLU CD 1 1 14 7018 1 1 15 GLU CG C -5.378 -2.305 -10.672 1.00 . A A . 21 GLU CG 1 1 14 7019 1 1 15 GLU H H -5.997 -1.786 -7.109 1.00 . A A . 21 GLU H 1 1 14 7020 1 1 15 GLU HA H -5.310 -3.907 -7.602 1.00 . A A . 21 GLU HA 1 1 14 7021 1 1 15 GLU HB2 H -5.176 -4.334 -10.086 1.00 . A A . 21 GLU HB2 1 1 14 7022 1 1 15 GLU HB3 H -6.650 -3.559 -9.526 1.00 . A A . 21 GLU HB3 1 1 14 7023 1 1 15 GLU HG2 H -5.876 -1.418 -10.310 1.00 . A A . 21 GLU HG2 1 1 14 7024 1 1 15 GLU HG3 H -4.319 -2.111 -10.761 1.00 . A A . 21 GLU HG3 1 1 14 7025 1 1 15 GLU N N -5.301 -1.852 -7.794 1.00 . A A . 21 GLU N 1 1 14 7026 1 1 15 GLU O O -2.837 -3.146 -9.473 1.00 . A A . 21 GLU O 1 1 14 7027 1 1 15 GLU OE1 O -7.156 -2.536 -12.234 1.00 . A A . 21 GLU OE1 1 1 14 7028 1 1 15 GLU OE2 O -5.126 -3.009 -12.930 1.00 . A A . 21 GLU OE2 1 1 14 7029 1 1 16 GLY C C -0.705 -3.220 -6.060 1.00 . A A . 22 GLY C 1 1 14 7030 1 1 16 GLY CA C -1.354 -3.862 -7.270 1.00 . A A . 22 GLY CA 1 1 14 7031 1 1 16 GLY H H -3.313 -3.819 -6.469 1.00 . A A . 22 GLY H 1 1 14 7032 1 1 16 GLY HA2 H -1.134 -4.919 -7.265 1.00 . A A . 22 GLY HA2 1 1 14 7033 1 1 16 GLY HA3 H -0.937 -3.423 -8.164 1.00 . A A . 22 GLY HA3 1 1 14 7034 1 1 16 GLY N N -2.794 -3.683 -7.289 1.00 . A A . 22 GLY N 1 1 14 7035 1 1 16 GLY O O 0.344 -2.585 -6.173 1.00 . A A . 22 GLY O 1 1 14 7036 1 1 17 GLN C C 0.187 -3.768 -2.998 1.00 . A A . 23 GLN C 1 1 14 7037 1 1 17 GLN CA C -0.805 -2.815 -3.661 1.00 . A A . 23 GLN CA 1 1 14 7038 1 1 17 GLN CB C -1.952 -2.480 -2.698 1.00 . A A . 23 GLN CB 1 1 14 7039 1 1 17 GLN CD C -3.189 -4.688 -2.777 1.00 . A A . 23 GLN CD 1 1 14 7040 1 1 17 GLN CG C -2.476 -3.671 -1.906 1.00 . A A . 23 GLN CG 1 1 14 7041 1 1 17 GLN H H -2.161 -3.901 -4.871 1.00 . A A . 23 GLN H 1 1 14 7042 1 1 17 GLN HA H -0.287 -1.903 -3.916 1.00 . A A . 23 GLN HA 1 1 14 7043 1 1 17 GLN HB2 H -1.608 -1.736 -1.995 1.00 . A A . 23 GLN HB2 1 1 14 7044 1 1 17 GLN HB3 H -2.772 -2.067 -3.268 1.00 . A A . 23 GLN HB3 1 1 14 7045 1 1 17 GLN HE21 H -4.882 -4.386 -1.781 1.00 . A A . 23 GLN HE21 1 1 14 7046 1 1 17 GLN HE22 H -4.960 -5.546 -3.059 1.00 . A A . 23 GLN HE22 1 1 14 7047 1 1 17 GLN HG2 H -1.646 -4.159 -1.419 1.00 . A A . 23 GLN HG2 1 1 14 7048 1 1 17 GLN HG3 H -3.169 -3.312 -1.159 1.00 . A A . 23 GLN HG3 1 1 14 7049 1 1 17 GLN N N -1.329 -3.385 -4.898 1.00 . A A . 23 GLN N 1 1 14 7050 1 1 17 GLN NE2 N -4.473 -4.894 -2.512 1.00 . A A . 23 GLN NE2 1 1 14 7051 1 1 17 GLN O O 1.097 -3.337 -2.290 1.00 . A A . 23 GLN O 1 1 14 7052 1 1 17 GLN OE1 O -2.592 -5.281 -3.676 1.00 . A A . 23 GLN OE1 1 1 14 7053 1 1 18 ALA C C 2.351 -5.727 -2.872 1.00 . A A . 24 ALA C 1 1 14 7054 1 1 18 ALA CA C 0.882 -6.080 -2.656 1.00 . A A . 24 ALA CA 1 1 14 7055 1 1 18 ALA CB C 0.573 -7.444 -3.254 1.00 . A A . 24 ALA CB 1 1 14 7056 1 1 18 ALA H H -0.740 -5.348 -3.803 1.00 . A A . 24 ALA H 1 1 14 7057 1 1 18 ALA HA H 0.687 -6.126 -1.595 1.00 . A A . 24 ALA HA 1 1 14 7058 1 1 18 ALA HB1 H -0.426 -7.439 -3.665 1.00 . A A . 24 ALA HB1 1 1 14 7059 1 1 18 ALA HB2 H 1.284 -7.665 -4.036 1.00 . A A . 24 ALA HB2 1 1 14 7060 1 1 18 ALA HB3 H 0.640 -8.199 -2.484 1.00 . A A . 24 ALA HB3 1 1 14 7061 1 1 18 ALA N N 0.004 -5.065 -3.231 1.00 . A A . 24 ALA N 1 1 14 7062 1 1 18 ALA O O 3.214 -6.101 -2.078 1.00 . A A . 24 ALA O 1 1 14 7063 1 1 19 ALA C C 4.345 -3.289 -3.561 1.00 . A A . 25 ALA C 1 1 14 7064 1 1 19 ALA CA C 3.989 -4.591 -4.269 1.00 . A A . 25 ALA CA 1 1 14 7065 1 1 19 ALA CB C 4.158 -4.444 -5.774 1.00 . A A . 25 ALA CB 1 1 14 7066 1 1 19 ALA H H 1.896 -4.729 -4.545 1.00 . A A . 25 ALA H 1 1 14 7067 1 1 19 ALA HA H 4.657 -5.369 -3.929 1.00 . A A . 25 ALA HA 1 1 14 7068 1 1 19 ALA HB1 H 3.301 -4.869 -6.276 1.00 . A A . 25 ALA HB1 1 1 14 7069 1 1 19 ALA HB2 H 4.242 -3.398 -6.028 1.00 . A A . 25 ALA HB2 1 1 14 7070 1 1 19 ALA HB3 H 5.051 -4.964 -6.088 1.00 . A A . 25 ALA HB3 1 1 14 7071 1 1 19 ALA N N 2.627 -5.000 -3.951 1.00 . A A . 25 ALA N 1 1 14 7072 1 1 19 ALA O O 5.107 -3.285 -2.595 1.00 . A A . 25 ALA O 1 1 14 7073 1 1 20 LYS C C 3.941 -0.904 -1.936 1.00 . A A . 26 LYS C 1 1 14 7074 1 1 20 LYS CA C 4.036 -0.867 -3.461 1.00 . A A . 26 LYS CA 1 1 14 7075 1 1 20 LYS CB C 3.042 0.155 -4.018 1.00 . A A . 26 LYS CB 1 1 14 7076 1 1 20 LYS CD C 4.896 1.548 -5.026 1.00 . A A . 26 LYS CD 1 1 14 7077 1 1 20 LYS CE C 4.686 0.891 -6.382 1.00 . A A . 26 LYS CE 1 1 14 7078 1 1 20 LYS CG C 3.621 1.553 -4.193 1.00 . A A . 26 LYS CG 1 1 14 7079 1 1 20 LYS HA H 5.036 -0.570 -3.736 1.00 . A A . 26 LYS HA 1 1 14 7080 1 1 20 LYS HB2 H 2.692 -0.188 -4.980 1.00 . A A . 26 LYS HB2 1 1 14 7081 1 1 20 LYS HD2 H 5.214 2.568 -5.181 1.00 . A A . 26 LYS HD2 1 1 14 7082 1 1 20 LYS HE2 H 4.121 -0.018 -6.246 1.00 . A A . 26 LYS HE2 1 1 14 7083 1 1 20 LYS HG2 H 2.888 2.175 -4.684 1.00 . A A . 26 LYS HG2 1 1 14 7084 1 1 20 LYS HZ1 H 6.409 1.282 -7.521 1.00 . A A . 26 LYS HZ1 1 1 14 7085 1 1 20 LYS N N 3.783 -2.183 -4.045 1.00 . A A . 26 LYS N 1 1 14 7086 1 1 20 LYS NZ N 5.952 0.566 -7.032 1.00 . A A . 26 LYS NZ 1 1 14 7087 1 1 20 LYS O O 4.571 -0.103 -1.248 1.00 . A A . 26 LYS O 1 1 14 7088 1 1 21 GLU C C 4.319 -1.947 0.760 1.00 . A A . 27 GLU C 1 1 14 7089 1 1 21 GLU CA C 2.976 -1.982 0.029 1.00 . A A . 27 GLU CA 1 1 14 7090 1 1 21 GLU CB C 2.241 -3.286 0.347 1.00 . A A . 27 GLU CB 1 1 14 7091 1 1 21 GLU CD C 0.215 -3.179 1.854 1.00 . A A . 27 GLU CD 1 1 14 7092 1 1 21 GLU CG C 0.731 -3.129 0.429 1.00 . A A . 27 GLU CG 1 1 14 7093 1 1 21 GLU H H 2.674 -2.451 -2.013 1.00 . A A . 27 GLU H 1 1 14 7094 1 1 21 GLU HA H 2.376 -1.152 0.369 1.00 . A A . 27 GLU HA 1 1 14 7095 1 1 21 GLU HB2 H 2.465 -4.009 -0.424 1.00 . A A . 27 GLU HB2 1 1 14 7096 1 1 21 GLU HB3 H 2.595 -3.663 1.295 1.00 . A A . 27 GLU HB3 1 1 14 7097 1 1 21 GLU HG2 H 0.457 -2.178 -0.003 1.00 . A A . 27 GLU HG2 1 1 14 7098 1 1 21 GLU HG3 H 0.267 -3.925 -0.135 1.00 . A A . 27 GLU HG3 1 1 14 7099 1 1 21 GLU N N 3.152 -1.841 -1.415 1.00 . A A . 27 GLU N 1 1 14 7100 1 1 21 GLU O O 4.391 -1.542 1.920 1.00 . A A . 27 GLU O 1 1 14 7101 1 1 21 GLU OE1 O 0.649 -2.342 2.673 1.00 . A A . 27 GLU OE1 1 1 14 7102 1 1 21 GLU OE2 O -0.624 -4.056 2.151 1.00 . A A . 27 GLU OE2 1 1 14 7103 1 1 22 PHE C C 7.153 -0.970 1.046 1.00 . A A . 28 PHE C 1 1 14 7104 1 1 22 PHE CA C 6.712 -2.385 0.670 1.00 . A A . 28 PHE CA 1 1 14 7105 1 1 22 PHE CB C 7.726 -3.028 -0.294 1.00 . A A . 28 PHE CB 1 1 14 7106 1 1 22 PHE CD1 C 9.071 -1.057 -1.075 1.00 . A A . 28 PHE CD1 1 1 14 7107 1 1 22 PHE CD2 C 7.852 -2.300 -2.701 1.00 . A A . 28 PHE CD2 1 1 14 7108 1 1 22 PHE CE1 C 9.534 -0.209 -2.061 1.00 . A A . 28 PHE CE1 1 1 14 7109 1 1 22 PHE CE2 C 8.312 -1.456 -3.694 1.00 . A A . 28 PHE CE2 1 1 14 7110 1 1 22 PHE CG C 8.225 -2.109 -1.380 1.00 . A A . 28 PHE CG 1 1 14 7111 1 1 22 PHE CZ C 9.154 -0.408 -3.374 1.00 . A A . 28 PHE CZ 1 1 14 7112 1 1 22 PHE H H 5.262 -2.684 -0.845 1.00 . A A . 28 PHE H 1 1 14 7113 1 1 22 PHE HA H 6.663 -2.980 1.571 1.00 . A A . 28 PHE HA 1 1 14 7114 1 1 22 PHE HB2 H 8.584 -3.361 0.270 1.00 . A A . 28 PHE HB2 1 1 14 7115 1 1 22 PHE HB3 H 7.264 -3.882 -0.769 1.00 . A A . 28 PHE HB3 1 1 14 7116 1 1 22 PHE HD1 H 9.368 -0.901 -0.051 1.00 . A A . 28 PHE HD1 1 1 14 7117 1 1 22 PHE HD2 H 7.197 -3.119 -2.953 1.00 . A A . 28 PHE HD2 1 1 14 7118 1 1 22 PHE HE1 H 10.193 0.608 -1.805 1.00 . A A . 28 PHE HE1 1 1 14 7119 1 1 22 PHE HE2 H 8.013 -1.615 -4.720 1.00 . A A . 28 PHE HE2 1 1 14 7120 1 1 22 PHE HZ H 9.514 0.253 -4.148 1.00 . A A . 28 PHE HZ 1 1 14 7121 1 1 22 PHE N N 5.379 -2.373 0.077 1.00 . A A . 28 PHE N 1 1 14 7122 1 1 22 PHE O O 7.824 -0.764 2.057 1.00 . A A . 28 PHE O 1 1 14 7123 1 1 23 ILE C C 6.684 1.886 1.818 1.00 . A A . 29 ILE C 1 1 14 7124 1 1 23 ILE CA C 7.131 1.396 0.439 1.00 . A A . 29 ILE CA 1 1 14 7125 1 1 23 ILE CB C 6.522 2.308 -0.649 1.00 . A A . 29 ILE CB 1 1 14 7126 1 1 23 ILE CD1 C 6.642 4.643 -1.660 1.00 . A A . 29 ILE CD1 1 1 14 7127 1 1 23 ILE CG1 C 7.204 3.677 -0.639 1.00 . A A . 29 ILE CG1 1 1 14 7128 1 1 23 ILE CG2 C 5.018 2.455 -0.450 1.00 . A A . 29 ILE CG2 1 1 14 7129 1 1 23 ILE H H 6.246 -0.237 -0.577 1.00 . A A . 29 ILE H 1 1 14 7130 1 1 23 ILE HA H 8.210 1.473 0.378 1.00 . A A . 29 ILE HA 1 1 14 7131 1 1 23 ILE HB H 6.685 1.840 -1.609 1.00 . A A . 29 ILE HB 1 1 14 7132 1 1 23 ILE HD11 H 5.686 4.281 -2.009 1.00 . A A . 29 ILE HD11 1 1 14 7133 1 1 23 ILE HD12 H 6.514 5.614 -1.205 1.00 . A A . 29 ILE HD12 1 1 14 7134 1 1 23 ILE HD13 H 7.323 4.722 -2.494 1.00 . A A . 29 ILE HD13 1 1 14 7135 1 1 23 ILE HG12 H 7.087 4.123 0.337 1.00 . A A . 29 ILE HG12 1 1 14 7136 1 1 23 ILE HG13 H 8.256 3.550 -0.847 1.00 . A A . 29 ILE HG13 1 1 14 7137 1 1 23 ILE HG21 H 4.655 1.643 0.163 1.00 . A A . 29 ILE HG21 1 1 14 7138 1 1 23 ILE HG22 H 4.811 3.396 0.039 1.00 . A A . 29 ILE HG22 1 1 14 7139 1 1 23 ILE HG23 H 4.524 2.431 -1.409 1.00 . A A . 29 ILE HG23 1 1 14 7140 1 1 23 ILE N N 6.775 -0.003 0.215 1.00 . A A . 29 ILE N 1 1 14 7141 1 1 23 ILE O O 7.184 2.891 2.321 1.00 . A A . 29 ILE O 1 1 14 7142 1 1 24 ALA C C 6.288 1.371 4.819 1.00 . A A . 30 ALA C 1 1 14 7143 1 1 24 ALA CA C 5.228 1.561 3.734 1.00 . A A . 30 ALA CA 1 1 14 7144 1 1 24 ALA CB C 3.980 0.758 4.068 1.00 . A A . 30 ALA CB 1 1 14 7145 1 1 24 ALA H H 5.361 0.396 1.975 1.00 . A A . 30 ALA H 1 1 14 7146 1 1 24 ALA HA H 4.954 2.605 3.695 1.00 . A A . 30 ALA HA 1 1 14 7147 1 1 24 ALA HB1 H 3.470 0.490 3.155 1.00 . A A . 30 ALA HB1 1 1 14 7148 1 1 24 ALA HB2 H 4.260 -0.139 4.600 1.00 . A A . 30 ALA HB2 1 1 14 7149 1 1 24 ALA HB3 H 3.324 1.353 4.686 1.00 . A A . 30 ALA HB3 1 1 14 7150 1 1 24 ALA N N 5.734 1.183 2.421 1.00 . A A . 30 ALA N 1 1 14 7151 1 1 24 ALA O O 6.184 1.942 5.904 1.00 . A A . 30 ALA O 1 1 14 7152 1 1 25 TRP C C 9.486 1.321 5.410 1.00 . A A . 31 TRP C 1 1 14 7153 1 1 25 TRP CA C 8.360 0.282 5.493 1.00 . A A . 31 TRP CA 1 1 14 7154 1 1 25 TRP CB C 8.898 -1.149 5.289 1.00 . A A . 31 TRP CB 1 1 14 7155 1 1 25 TRP CD1 C 11.332 -0.852 6.056 1.00 . A A . 31 TRP CD1 1 1 14 7156 1 1 25 TRP CD2 C 11.111 -1.784 4.033 1.00 . A A . 31 TRP CD2 1 1 14 7157 1 1 25 TRP CE2 C 12.483 -1.674 4.328 1.00 . A A . 31 TRP CE2 1 1 14 7158 1 1 25 TRP CE3 C 10.729 -2.346 2.811 1.00 . A A . 31 TRP CE3 1 1 14 7159 1 1 25 TRP CG C 10.391 -1.249 5.149 1.00 . A A . 31 TRP CG 1 1 14 7160 1 1 25 TRP CH2 C 13.068 -2.648 2.259 1.00 . A A . 31 TRP CH2 1 1 14 7161 1 1 25 TRP CZ2 C 13.471 -2.102 3.447 1.00 . A A . 31 TRP CZ2 1 1 14 7162 1 1 25 TRP CZ3 C 11.711 -2.773 1.938 1.00 . A A . 31 TRP CZ3 1 1 14 7163 1 1 25 TRP H H 7.325 0.116 3.653 1.00 . A A . 31 TRP H 1 1 14 7164 1 1 25 TRP HA H 7.920 0.343 6.477 1.00 . A A . 31 TRP HA 1 1 14 7165 1 1 25 TRP HB2 H 8.610 -1.752 6.135 1.00 . A A . 31 TRP HB2 1 1 14 7166 1 1 25 TRP HB3 H 8.453 -1.563 4.396 1.00 . A A . 31 TRP HB3 1 1 14 7167 1 1 25 TRP HD1 H 11.104 -0.403 7.011 1.00 . A A . 31 TRP HD1 1 1 14 7168 1 1 25 TRP HE1 H 13.431 -0.900 6.032 1.00 . A A . 31 TRP HE1 1 1 14 7169 1 1 25 TRP HE3 H 9.687 -2.450 2.544 1.00 . A A . 31 TRP HE3 1 1 14 7170 1 1 25 TRP HH2 H 13.802 -2.994 1.546 1.00 . A A . 31 TRP HH2 1 1 14 7171 1 1 25 TRP HZ2 H 14.521 -2.012 3.678 1.00 . A A . 31 TRP HZ2 1 1 14 7172 1 1 25 TRP HZ3 H 11.435 -3.209 0.989 1.00 . A A . 31 TRP HZ3 1 1 14 7173 1 1 25 TRP N N 7.299 0.554 4.528 1.00 . A A . 31 TRP N 1 1 14 7174 1 1 25 TRP NE1 N 12.592 -1.100 5.568 1.00 . A A . 31 TRP NE1 1 1 14 7175 1 1 25 TRP O O 9.736 2.046 6.373 1.00 . A A . 31 TRP O 1 1 14 7176 1 1 26 LEU C C 10.840 3.766 4.310 1.00 . A A . 32 LEU C 1 1 14 7177 1 1 26 LEU CA C 11.286 2.317 4.107 1.00 . A A . 32 LEU CA 1 1 14 7178 1 1 26 LEU CB C 11.981 2.150 2.742 1.00 . A A . 32 LEU CB 1 1 14 7179 1 1 26 LEU CD1 C 10.713 0.516 1.324 1.00 . A A . 32 LEU CD1 1 1 14 7180 1 1 26 LEU CD2 C 9.834 2.837 1.635 1.00 . A A . 32 LEU CD2 1 1 14 7181 1 1 26 LEU CG C 11.079 1.978 1.519 1.00 . A A . 32 LEU CG 1 1 14 7182 1 1 26 LEU H H 9.950 0.767 3.543 1.00 . A A . 32 LEU H 1 1 14 7183 1 1 26 LEU HA H 12.006 2.086 4.879 1.00 . A A . 32 LEU HA 1 1 14 7184 1 1 26 LEU HB2 H 12.598 3.017 2.573 1.00 . A A . 32 LEU HB2 1 1 14 7185 1 1 26 LEU HB3 H 12.623 1.285 2.800 1.00 . A A . 32 LEU HB3 1 1 14 7186 1 1 26 LEU HD11 H 11.278 -0.091 2.016 1.00 . A A . 32 LEU HD11 1 1 14 7187 1 1 26 LEU HD12 H 9.657 0.381 1.505 1.00 . A A . 32 LEU HD12 1 1 14 7188 1 1 26 LEU HD13 H 10.946 0.219 0.313 1.00 . A A . 32 LEU HD13 1 1 14 7189 1 1 26 LEU HD21 H 10.108 3.824 1.975 1.00 . A A . 32 LEU HD21 1 1 14 7190 1 1 26 LEU HD22 H 9.355 2.910 0.671 1.00 . A A . 32 LEU HD22 1 1 14 7191 1 1 26 LEU HD23 H 9.157 2.386 2.342 1.00 . A A . 32 LEU HD23 1 1 14 7192 1 1 26 LEU HG H 11.622 2.298 0.642 1.00 . A A . 32 LEU HG 1 1 14 7193 1 1 26 LEU N N 10.178 1.377 4.273 1.00 . A A . 32 LEU N 1 1 14 7194 1 1 26 LEU O O 11.665 4.642 4.570 1.00 . A A . 32 LEU O 1 1 14 7195 1 1 27 VAL C C 8.827 5.677 5.868 1.00 . A A . 33 VAL C 1 1 14 7196 1 1 27 VAL CA C 9.009 5.367 4.383 1.00 . A A . 33 VAL CA 1 1 14 7197 1 1 27 VAL CB C 7.663 5.556 3.644 1.00 . A A . 33 VAL CB 1 1 14 7198 1 1 27 VAL CG1 C 6.931 6.798 4.139 1.00 . A A . 33 VAL CG1 1 1 14 7199 1 1 27 VAL CG2 C 7.888 5.640 2.142 1.00 . A A . 33 VAL CG2 1 1 14 7200 1 1 27 VAL H H 8.920 3.287 3.997 1.00 . A A . 33 VAL H 1 1 14 7201 1 1 27 VAL HA H 9.725 6.063 3.968 1.00 . A A . 33 VAL HA 1 1 14 7202 1 1 27 VAL HB H 7.041 4.696 3.844 1.00 . A A . 33 VAL HB 1 1 14 7203 1 1 27 VAL HG11 H 7.643 7.591 4.312 1.00 . A A . 33 VAL HG11 1 1 14 7204 1 1 27 VAL HG12 H 6.214 7.113 3.395 1.00 . A A . 33 VAL HG12 1 1 14 7205 1 1 27 VAL HG13 H 6.416 6.569 5.061 1.00 . A A . 33 VAL HG13 1 1 14 7206 1 1 27 VAL HG21 H 8.332 4.722 1.793 1.00 . A A . 33 VAL HG21 1 1 14 7207 1 1 27 VAL HG22 H 6.943 5.794 1.644 1.00 . A A . 33 VAL HG22 1 1 14 7208 1 1 27 VAL HG23 H 8.550 6.465 1.923 1.00 . A A . 33 VAL HG23 1 1 14 7209 1 1 27 VAL N N 9.537 4.019 4.199 1.00 . A A . 33 VAL N 1 1 14 7210 1 1 27 VAL O O 8.941 6.827 6.290 1.00 . A A . 33 VAL O 1 1 14 7211 1 1 28 ARG C C 9.689 4.927 8.811 1.00 . A A . 34 ARG C 1 1 14 7212 1 1 28 ARG CA C 8.351 4.805 8.090 1.00 . A A . 34 ARG CA 1 1 14 7213 1 1 28 ARG CB C 7.557 3.626 8.654 1.00 . A A . 34 ARG CB 1 1 14 7214 1 1 28 ARG CD C 5.424 3.258 9.932 1.00 . A A . 34 ARG CD 1 1 14 7215 1 1 28 ARG CG C 6.056 3.865 8.690 1.00 . A A . 34 ARG CG 1 1 14 7216 1 1 28 ARG CZ C 4.880 0.959 9.230 1.00 . A A . 34 ARG CZ 1 1 14 7217 1 1 28 ARG H H 8.469 3.749 6.259 1.00 . A A . 34 ARG H 1 1 14 7218 1 1 28 ARG HA H 7.788 5.713 8.246 1.00 . A A . 34 ARG HA 1 1 14 7219 1 1 28 ARG HB2 H 7.747 2.754 8.045 1.00 . A A . 34 ARG HB2 1 1 14 7220 1 1 28 ARG HB3 H 7.893 3.429 9.662 1.00 . A A . 34 ARG HB3 1 1 14 7221 1 1 28 ARG HD2 H 5.891 3.689 10.805 1.00 . A A . 34 ARG HD2 1 1 14 7222 1 1 28 ARG HD3 H 4.370 3.494 9.935 1.00 . A A . 34 ARG HD3 1 1 14 7223 1 1 28 ARG HE H 6.255 1.444 10.593 1.00 . A A . 34 ARG HE 1 1 14 7224 1 1 28 ARG HG2 H 5.871 4.928 8.687 1.00 . A A . 34 ARG HG2 1 1 14 7225 1 1 28 ARG HG3 H 5.610 3.417 7.814 1.00 . A A . 34 ARG HG3 1 1 14 7226 1 1 28 ARG HH11 H 3.801 2.397 8.302 1.00 . A A . 34 ARG HH11 1 1 14 7227 1 1 28 ARG HH12 H 3.438 0.772 7.826 1.00 . A A . 34 ARG HH12 1 1 14 7228 1 1 28 ARG HH21 H 5.778 -0.694 9.968 1.00 . A A . 34 ARG HH21 1 1 14 7229 1 1 28 ARG HH22 H 4.560 -0.983 8.772 1.00 . A A . 34 ARG HH22 1 1 14 7230 1 1 28 ARG N N 8.546 4.642 6.654 1.00 . A A . 34 ARG N 1 1 14 7231 1 1 28 ARG NE N 5.585 1.807 9.976 1.00 . A A . 34 ARG NE 1 1 14 7232 1 1 28 ARG NH1 N 3.965 1.414 8.383 1.00 . A A . 34 ARG NH1 1 1 14 7233 1 1 28 ARG NH2 N 5.090 -0.346 9.332 1.00 . A A . 34 ARG NH2 1 1 14 7234 1 1 28 ARG O O 9.792 5.593 9.841 1.00 . A A . 34 ARG O 1 1 14 7235 1 1 29 GLY C C 13.072 3.592 8.051 1.00 . A A . 35 GLY C 1 1 14 7236 1 1 29 GLY CA C 12.030 4.328 8.869 1.00 . A A . 35 GLY CA 1 1 14 7237 1 1 29 GLY H H 10.572 3.763 7.443 1.00 . A A . 35 GLY H 1 1 14 7238 1 1 29 GLY HA2 H 12.330 5.361 8.968 1.00 . A A . 35 GLY HA2 1 1 14 7239 1 1 29 GLY HA3 H 11.980 3.883 9.852 1.00 . A A . 35 GLY HA3 1 1 14 7240 1 1 29 GLY N N 10.713 4.279 8.264 1.00 . A A . 35 GLY N 1 1 14 7241 1 1 29 GLY O O 13.098 2.361 8.028 1.00 . A A . 35 GLY O 1 1 14 7242 1 1 30 ARG C C 16.295 4.515 6.718 1.00 . A A . 36 ARG C 1 1 14 7243 1 1 30 ARG CA C 14.981 3.758 6.551 1.00 . A A . 36 ARG CA 1 1 14 7244 1 1 30 ARG CB C 14.562 3.760 5.080 1.00 . A A . 36 ARG CB 1 1 14 7245 1 1 30 ARG CD C 15.208 3.242 2.706 1.00 . A A . 36 ARG CD 1 1 14 7246 1 1 30 ARG CG C 15.509 2.990 4.175 1.00 . A A . 36 ARG CG 1 1 14 7247 1 1 30 ARG CZ C 17.481 3.136 1.760 1.00 . A A . 36 ARG CZ 1 1 14 7248 1 1 30 ARG H H 13.861 5.322 7.434 1.00 . A A . 36 ARG H 1 1 14 7249 1 1 30 ARG HA H 15.124 2.738 6.874 1.00 . A A . 36 ARG HA 1 1 14 7250 1 1 30 ARG HB2 H 13.580 3.318 4.998 1.00 . A A . 36 ARG HB2 1 1 14 7251 1 1 30 ARG HB3 H 14.517 4.782 4.732 1.00 . A A . 36 ARG HB3 1 1 14 7252 1 1 30 ARG HD2 H 14.939 2.305 2.241 1.00 . A A . 36 ARG HD2 1 1 14 7253 1 1 30 ARG HD3 H 14.379 3.930 2.633 1.00 . A A . 36 ARG HD3 1 1 14 7254 1 1 30 ARG HE H 16.287 4.733 1.691 1.00 . A A . 36 ARG HE 1 1 14 7255 1 1 30 ARG HG2 H 16.522 3.300 4.383 1.00 . A A . 36 ARG HG2 1 1 14 7256 1 1 30 ARG HG3 H 15.406 1.934 4.379 1.00 . A A . 36 ARG HG3 1 1 14 7257 1 1 30 ARG HH11 H 16.863 1.428 2.651 1.00 . A A . 36 ARG HH11 1 1 14 7258 1 1 30 ARG HH12 H 18.458 1.380 1.979 1.00 . A A . 36 ARG HH12 1 1 14 7259 1 1 30 ARG HH21 H 18.384 4.671 0.806 1.00 . A A . 36 ARG HH21 1 1 14 7260 1 1 30 ARG HH22 H 19.323 3.221 0.933 1.00 . A A . 36 ARG HH22 1 1 14 7261 1 1 30 ARG N N 13.933 4.346 7.376 1.00 . A A . 36 ARG N 1 1 14 7262 1 1 30 ARG NE N 16.357 3.806 2.001 1.00 . A A . 36 ARG NE 1 1 14 7263 1 1 30 ARG NH1 N 17.611 1.878 2.163 1.00 . A A . 36 ARG NH1 1 1 14 7264 1 1 30 ARG NH2 N 18.478 3.724 1.113 1.00 . A A . 36 ARG NH2 1 1 14 7265 1 1 30 ARG O O 17.291 3.956 7.176 1.00 . A A . 36 ARG O 1 1 14 7266 1 1 31 GLY C C 18.231 6.728 5.144 1.00 . A A . 37 GLY C 1 1 14 7267 1 1 31 GLY CA C 17.486 6.603 6.458 1.00 . A A . 37 GLY CA 1 1 14 7268 1 1 31 GLY H H 15.465 6.182 5.985 1.00 . A A . 37 GLY H 1 1 14 7269 1 1 31 GLY HA2 H 17.206 7.590 6.796 1.00 . A A . 37 GLY HA2 1 1 14 7270 1 1 31 GLY HA3 H 18.142 6.156 7.190 1.00 . A A . 37 GLY HA3 1 1 14 7271 1 1 31 GLY N N 16.289 5.790 6.343 1.00 . A A . 37 GLY N 1 1 14 7272 1 1 31 GLY O O 19.339 7.304 5.142 1.00 . A A . 37 GLY O 1 1 14 7273 1 1 31 GLY OXT O 17.706 6.250 4.116 1.00 . A A . 37 GLY OXT 1 1 14 7274 2 2 1 . C02 C 10.783 -2.592 -4.949 1.00 . B A . 1038 D6M C02 1 1 14 7275 2 2 1 . C04 C 10.235 -1.288 -6.932 1.00 . B A . 1038 D6M C04 1 1 14 7276 2 2 1 . C05 C 9.017 -0.362 -6.931 1.00 . B A . 1038 D6M C05 1 1 14 7277 2 2 1 . C06 C 7.825 -0.926 -7.687 1.00 . B A . 1038 D6M C06 1 1 14 7278 2 2 1 . C07 C 6.508 -0.640 -6.994 1.00 . B A . 1038 D6M C07 1 1 14 7279 2 2 1 . C09 C 11.296 -0.755 -7.889 1.00 . B A . 1038 D6M C09 1 1 14 7280 2 2 1 . C12 C 11.370 -2.732 -3.558 1.00 . B A . 1038 D6M C12 1 1 14 7281 2 2 1 . C13 C 12.708 -2.025 -3.416 1.00 . B A . 1038 D6M C13 1 1 14 7282 2 2 1 . C14 C 13.280 -2.189 -2.016 1.00 . B A . 1038 D6M C14 1 1 14 7283 2 2 1 . C15 C 12.692 -1.171 -1.050 1.00 . B A . 1038 D6M C15 1 1 14 7284 2 2 1 . C16 C 13.744 -0.184 -0.567 1.00 . B A . 1038 D6M C16 1 1 14 7285 2 2 1 . C17 C 13.899 0.986 -1.529 1.00 . B A . 1038 D6M C17 1 1 14 7286 2 2 1 . C18 C 12.587 1.734 -1.719 1.00 . B A . 1038 D6M C18 1 1 14 7287 2 2 1 . C19 C 12.731 3.214 -1.402 1.00 . B A . 1038 D6M C19 1 1 14 7288 2 2 1 . C20 C 11.375 3.888 -1.262 1.00 . B A . 1038 D6M C20 1 1 14 7289 2 2 1 . C21 C 11.330 4.805 -0.050 1.00 . B A . 1038 D6M C21 1 1 14 7290 2 2 1 . C22 C 12.030 6.126 -0.325 1.00 . B A . 1038 D6M C22 1 1 14 7291 2 2 1 . C23 C 12.189 6.945 0.945 1.00 . B A . 1038 D6M C23 1 1 14 7292 2 2 1 . C24 C 10.840 7.290 1.556 1.00 . B A . 1038 D6M C24 1 1 14 7293 2 2 1 . C25 C 10.921 8.538 2.419 1.00 . B A . 1038 D6M C25 1 1 14 7294 2 2 1 . C26 C 11.175 9.777 1.587 1.00 . B A . 1038 D6M C26 1 1 14 7295 2 2 1 . H03 H 11.132 -0.631 -5.130 1.00 . B A . 1038 D6M H03 1 1 14 7296 2 2 1 . H04 H 9.928 -2.269 -7.265 1.00 . B A . 1038 D6M H04 1 1 14 7297 2 2 1 . HP21 H 11.507 -3.782 -3.346 1.00 . B A . 1038 D6M HP21 1 1 14 7298 2 2 1 . HP22 H 10.676 -2.310 -2.846 1.00 . B A . 1038 D6M HP22 1 1 14 7299 2 2 1 . HP31 H 12.572 -0.973 -3.618 1.00 . B A . 1038 D6M HP31 1 1 14 7300 2 2 1 . HP32 H 13.403 -2.443 -4.128 1.00 . B A . 1038 D6M HP32 1 1 14 7301 2 2 1 . HP41 H 14.351 -2.058 -2.058 1.00 . B A . 1038 D6M HP41 1 1 14 7302 2 2 1 . HP42 H 13.051 -3.182 -1.659 1.00 . B A . 1038 D6M HP42 1 1 14 7303 2 2 1 . HP51 H 12.284 -1.694 -0.198 1.00 . B A . 1038 D6M HP51 1 1 14 7304 2 2 1 . HP52 H 11.906 -0.627 -1.550 1.00 . B A . 1038 D6M HP52 1 1 14 7305 2 2 1 . HP61 H 14.691 -0.696 -0.481 1.00 . B A . 1038 D6M HP61 1 1 14 7306 2 2 1 . HP62 H 13.450 0.196 0.400 1.00 . B A . 1038 D6M HP62 1 1 14 7307 2 2 1 . HP71 H 14.231 0.610 -2.485 1.00 . B A . 1038 D6M HP71 1 1 14 7308 2 2 1 . HP72 H 14.637 1.668 -1.133 1.00 . B A . 1038 D6M HP72 1 1 14 7309 2 2 1 . HP81 H 11.843 1.307 -1.064 1.00 . B A . 1038 D6M HP81 1 1 14 7310 2 2 1 . HP82 H 12.269 1.626 -2.745 1.00 . B A . 1038 D6M HP82 1 1 14 7311 2 2 1 . HP91 H 13.280 3.691 -2.202 1.00 . B A . 1038 D6M HP91 1 1 14 7312 2 2 1 . HP92 H 13.275 3.322 -0.476 1.00 . B A . 1038 D6M HP92 1 1 14 7313 2 2 1 . HPA1 H 10.615 3.127 -1.153 1.00 . B A . 1038 D6M HPA1 1 1 14 7314 2 2 1 . HPA2 H 11.179 4.471 -2.149 1.00 . B A . 1038 D6M HPA2 1 1 14 7315 2 2 1 . HPB1 H 11.818 4.315 0.779 1.00 . B A . 1038 D6M HPB1 1 1 14 7316 2 2 1 . HPB2 H 10.299 5.002 0.202 1.00 . B A . 1038 D6M HPB2 1 1 14 7317 2 2 1 . HPC1 H 11.446 6.691 -1.037 1.00 . B A . 1038 D6M HPC1 1 1 14 7318 2 2 1 . HPC2 H 13.008 5.926 -0.737 1.00 . B A . 1038 D6M HPC2 1 1 14 7319 2 2 1 . HPD1 H 12.712 7.860 0.709 1.00 . B A . 1038 D6M HPD1 1 1 14 7320 2 2 1 . HPD2 H 12.761 6.374 1.661 1.00 . B A . 1038 D6M HPD2 1 1 14 7321 2 2 1 . HPE1 H 10.510 6.462 2.166 1.00 . B A . 1038 D6M HPE1 1 1 14 7322 2 2 1 . HPE2 H 10.129 7.459 0.762 1.00 . B A . 1038 D6M HPE2 1 1 14 7323 2 2 1 . HPF1 H 11.728 8.427 3.128 1.00 . B A . 1038 D6M HPF1 1 1 14 7324 2 2 1 . HPF2 H 9.987 8.667 2.945 1.00 . B A . 1038 D6M HPF2 1 1 14 7325 2 2 1 . HPG1 H 11.551 9.489 0.617 1.00 . B A . 1038 D6M HPG1 1 1 14 7326 2 2 1 . HPG2 H 11.902 10.402 2.085 1.00 . B A . 1038 D6M HPG2 1 1 14 7327 2 2 1 . HPG3 H 10.252 10.326 1.467 1.00 . B A . 1038 D6M HPG3 1 1 14 7328 2 2 1 . HQ21 H 7.799 -0.486 -8.673 1.00 . B A . 1038 D6M HQ21 1 1 14 7329 2 2 1 . HQ22 H 7.944 -1.996 -7.773 1.00 . B A . 1038 D6M HQ22 1 1 14 7330 2 2 1 . HQ31 H 8.717 -0.184 -5.909 1.00 . B A . 1038 D6M HQ31 1 1 14 7331 2 2 1 . HQ32 H 9.291 0.579 -7.385 1.00 . B A . 1038 D6M HQ32 1 1 14 7332 2 2 1 . N03 N 10.771 -1.422 -5.582 1.00 . B A . 1038 D6M N03 1 1 14 7333 2 2 1 . O01 O 10.336 -3.600 -5.496 1.00 . B A . 1038 D6M O01 1 1 14 7334 2 2 1 . O08 O 5.957 -1.559 -6.388 1.00 . B A . 1038 D6M O08 1 1 14 7335 2 2 1 . O10 O 10.931 -0.365 -9.018 1.00 . B A . 1038 D6M O10 1 1 14 7336 2 2 1 . O11 O 12.483 -0.732 -7.501 1.00 . B A . 1038 D6M O11 1 1 15 7337 1 1 1 HIS C C -30.256 -3.706 0.098 1.00 . A A . 7 HIS C 1 1 15 7338 1 1 1 HIS CA C -30.771 -5.039 -0.436 1.00 . A A . 7 HIS CA 1 1 15 7339 1 1 1 HIS CB C -30.333 -5.231 -1.889 1.00 . A A . 7 HIS CB 1 1 15 7340 1 1 1 HIS CD2 C -31.552 -3.090 -2.704 1.00 . A A . 7 HIS CD2 1 1 15 7341 1 1 1 HIS CE1 C -31.971 -3.724 -4.760 1.00 . A A . 7 HIS CE1 1 1 15 7342 1 1 1 HIS CG C -31.053 -4.340 -2.854 1.00 . A A . 7 HIS CG 1 1 15 7343 1 1 1 HIS H1 H -32.625 -4.201 -0.734 1.00 . A A . 7 HIS H1 1 1 15 7344 1 1 1 HIS H2 H -32.561 -5.899 -0.972 1.00 . A A . 7 HIS H2 1 1 15 7345 1 1 1 HIS H3 H -32.526 -5.251 0.616 1.00 . A A . 7 HIS H3 1 1 15 7346 1 1 1 HIS HA H -30.367 -5.839 0.166 1.00 . A A . 7 HIS HA 1 1 15 7347 1 1 1 HIS HB2 H -29.277 -5.022 -1.970 1.00 . A A . 7 HIS HB2 1 1 15 7348 1 1 1 HIS HB3 H -30.516 -6.255 -2.180 1.00 . A A . 7 HIS HB3 1 1 15 7349 1 1 1 HIS HD1 H -31.098 -5.564 -4.569 1.00 . A A . 7 HIS HD1 1 1 15 7350 1 1 1 HIS HD2 H -31.512 -2.487 -1.807 1.00 . A A . 7 HIS HD2 1 1 15 7351 1 1 1 HIS HE1 H -32.317 -3.730 -5.784 1.00 . A A . 7 HIS HE1 1 1 15 7352 1 1 1 HIS HE2 H -32.634 -1.914 -4.066 1.00 . A A . 7 HIS HE2 1 1 15 7353 1 1 1 HIS N N -32.254 -5.103 -0.376 1.00 . A A . 7 HIS N 1 1 15 7354 1 1 1 HIS ND1 N -31.333 -4.708 -4.153 1.00 . A A . 7 HIS ND1 1 1 15 7355 1 1 1 HIS NE2 N -32.117 -2.731 -3.903 1.00 . A A . 7 HIS NE2 1 1 15 7356 1 1 1 HIS O O -31.034 -2.791 0.367 1.00 . A A . 7 HIS O 1 1 15 7357 1 1 2 ALA C C -27.570 -1.653 -0.360 1.00 . A A . 8 ALA C 1 1 15 7358 1 1 2 ALA CA C -28.321 -2.383 0.749 1.00 . A A . 8 ALA CA 1 1 15 7359 1 1 2 ALA CB C -27.382 -2.703 1.902 1.00 . A A . 8 ALA CB 1 1 15 7360 1 1 2 ALA H H -28.371 -4.368 0.016 1.00 . A A . 8 ALA H 1 1 15 7361 1 1 2 ALA HA H -29.105 -1.741 1.122 1.00 . A A . 8 ALA HA 1 1 15 7362 1 1 2 ALA HB1 H -27.009 -3.711 1.793 1.00 . A A . 8 ALA HB1 1 1 15 7363 1 1 2 ALA HB2 H -26.554 -2.010 1.895 1.00 . A A . 8 ALA HB2 1 1 15 7364 1 1 2 ALA HB3 H -27.916 -2.616 2.836 1.00 . A A . 8 ALA HB3 1 1 15 7365 1 1 2 ALA N N -28.939 -3.604 0.248 1.00 . A A . 8 ALA N 1 1 15 7366 1 1 2 ALA O O -27.605 -2.062 -1.521 1.00 . A A . 8 ALA O 1 1 15 7367 1 1 3 GLU C C -24.898 -0.546 -1.433 1.00 . A A . 9 GLU C 1 1 15 7368 1 1 3 GLU CA C -26.132 0.217 -0.960 1.00 . A A . 9 GLU CA 1 1 15 7369 1 1 3 GLU CB C -25.715 1.553 -0.342 1.00 . A A . 9 GLU CB 1 1 15 7370 1 1 3 GLU CD C -27.055 3.453 0.647 1.00 . A A . 9 GLU CD 1 1 15 7371 1 1 3 GLU CG C -26.701 2.679 -0.607 1.00 . A A . 9 GLU CG 1 1 15 7372 1 1 3 GLU H H -26.902 -0.294 0.945 1.00 . A A . 9 GLU H 1 1 15 7373 1 1 3 GLU HA H -26.771 0.407 -1.809 1.00 . A A . 9 GLU HA 1 1 15 7374 1 1 3 GLU HB2 H -25.621 1.429 0.727 1.00 . A A . 9 GLU HB2 1 1 15 7375 1 1 3 GLU HB3 H -24.756 1.840 -0.747 1.00 . A A . 9 GLU HB3 1 1 15 7376 1 1 3 GLU HG2 H -26.265 3.362 -1.321 1.00 . A A . 9 GLU HG2 1 1 15 7377 1 1 3 GLU HG3 H -27.606 2.258 -1.021 1.00 . A A . 9 GLU HG3 1 1 15 7378 1 1 3 GLU N N -26.891 -0.570 0.005 1.00 . A A . 9 GLU N 1 1 15 7379 1 1 3 GLU O O -24.602 -1.634 -0.938 1.00 . A A . 9 GLU O 1 1 15 7380 1 1 3 GLU OE1 O -26.127 3.843 1.387 1.00 . A A . 9 GLU OE1 1 1 15 7381 1 1 3 GLU OE2 O -28.261 3.671 0.890 1.00 . A A . 9 GLU OE2 1 1 15 7382 1 1 4 GLY C C -21.900 0.384 -3.263 1.00 . A A . 10 GLY C 1 1 15 7383 1 1 4 GLY CA C -22.991 -0.610 -2.916 1.00 . A A . 10 GLY CA 1 1 15 7384 1 1 4 GLY H H -24.468 0.898 -2.750 1.00 . A A . 10 GLY H 1 1 15 7385 1 1 4 GLY HA2 H -22.612 -1.299 -2.176 1.00 . A A . 10 GLY HA2 1 1 15 7386 1 1 4 GLY HA3 H -23.254 -1.164 -3.806 1.00 . A A . 10 GLY HA3 1 1 15 7387 1 1 4 GLY N N -24.183 0.031 -2.393 1.00 . A A . 10 GLY N 1 1 15 7388 1 1 4 GLY O O -22.006 1.112 -4.250 1.00 . A A . 10 GLY O 1 1 15 7389 1 1 5 THR C C -18.420 0.698 -2.219 1.00 . A A . 11 THR C 1 1 15 7390 1 1 5 THR CA C -19.733 1.325 -2.675 1.00 . A A . 11 THR CA 1 1 15 7391 1 1 5 THR CB C -19.966 2.643 -1.935 1.00 . A A . 11 THR CB 1 1 15 7392 1 1 5 THR CG2 C -20.294 2.455 -0.469 1.00 . A A . 11 THR CG2 1 1 15 7393 1 1 5 THR H H -20.824 -0.192 -1.680 1.00 . A A . 11 THR H 1 1 15 7394 1 1 5 THR HA H -19.676 1.523 -3.735 1.00 . A A . 11 THR HA 1 1 15 7395 1 1 5 THR HB H -20.795 3.161 -2.395 1.00 . A A . 11 THR HB 1 1 15 7396 1 1 5 THR HG1 H -18.916 4.078 -2.755 1.00 . A A . 11 THR HG1 1 1 15 7397 1 1 5 THR HG21 H -19.963 1.479 -0.148 1.00 . A A . 11 THR HG21 1 1 15 7398 1 1 5 THR HG22 H -19.793 3.214 0.112 1.00 . A A . 11 THR HG22 1 1 15 7399 1 1 5 THR HG23 H -21.362 2.539 -0.326 1.00 . A A . 11 THR HG23 1 1 15 7400 1 1 5 THR N N -20.850 0.414 -2.450 1.00 . A A . 11 THR N 1 1 15 7401 1 1 5 THR O O -18.017 0.847 -1.066 1.00 . A A . 11 THR O 1 1 15 7402 1 1 5 THR OG1 O -18.821 3.473 -2.016 1.00 . A A . 11 THR OG1 1 1 15 7403 1 1 6 PHE C C -15.338 -0.006 -3.579 1.00 . A A . 12 PHE C 1 1 15 7404 1 1 6 PHE CA C -16.491 -0.658 -2.824 1.00 . A A . 12 PHE CA 1 1 15 7405 1 1 6 PHE CB C -16.564 -2.147 -3.164 1.00 . A A . 12 PHE CB 1 1 15 7406 1 1 6 PHE CD1 C -18.029 -2.300 -5.196 1.00 . A A . 12 PHE CD1 1 1 15 7407 1 1 6 PHE CD2 C -15.709 -2.800 -5.431 1.00 . A A . 12 PHE CD2 1 1 15 7408 1 1 6 PHE CE1 C -18.223 -2.551 -6.540 1.00 . A A . 12 PHE CE1 1 1 15 7409 1 1 6 PHE CE2 C -15.897 -3.053 -6.777 1.00 . A A . 12 PHE CE2 1 1 15 7410 1 1 6 PHE CG C -16.771 -2.421 -4.627 1.00 . A A . 12 PHE CG 1 1 15 7411 1 1 6 PHE CZ C -17.155 -2.928 -7.332 1.00 . A A . 12 PHE CZ 1 1 15 7412 1 1 6 PHE H H -18.133 -0.090 -4.034 1.00 . A A . 12 PHE H 1 1 15 7413 1 1 6 PHE HA H -16.313 -0.550 -1.764 1.00 . A A . 12 PHE HA 1 1 15 7414 1 1 6 PHE HB2 H -15.642 -2.623 -2.866 1.00 . A A . 12 PHE HB2 1 1 15 7415 1 1 6 PHE HB3 H -17.385 -2.593 -2.622 1.00 . A A . 12 PHE HB3 1 1 15 7416 1 1 6 PHE HD1 H -18.864 -2.005 -4.578 1.00 . A A . 12 PHE HD1 1 1 15 7417 1 1 6 PHE HD2 H -14.724 -2.897 -4.998 1.00 . A A . 12 PHE HD2 1 1 15 7418 1 1 6 PHE HE1 H -19.208 -2.454 -6.972 1.00 . A A . 12 PHE HE1 1 1 15 7419 1 1 6 PHE HE2 H -15.060 -3.347 -7.394 1.00 . A A . 12 PHE HE2 1 1 15 7420 1 1 6 PHE HZ H -17.305 -3.126 -8.383 1.00 . A A . 12 PHE HZ 1 1 15 7421 1 1 6 PHE N N -17.759 -0.006 -3.132 1.00 . A A . 12 PHE N 1 1 15 7422 1 1 6 PHE O O -14.192 -0.054 -3.135 1.00 . A A . 12 PHE O 1 1 15 7423 1 1 7 THR C C -13.700 2.121 -4.681 1.00 . A A . 13 THR C 1 1 15 7424 1 1 7 THR CA C -14.630 1.267 -5.540 1.00 . A A . 13 THR CA 1 1 15 7425 1 1 7 THR CB C -15.295 2.136 -6.608 1.00 . A A . 13 THR CB 1 1 15 7426 1 1 7 THR CG2 C -16.262 3.152 -6.037 1.00 . A A . 13 THR CG2 1 1 15 7427 1 1 7 THR H H -16.577 0.610 -5.025 1.00 . A A . 13 THR H 1 1 15 7428 1 1 7 THR HA H -14.046 0.501 -6.026 1.00 . A A . 13 THR HA 1 1 15 7429 1 1 7 THR HB H -15.847 1.499 -7.284 1.00 . A A . 13 THR HB 1 1 15 7430 1 1 7 THR HG1 H -14.673 3.044 -8.228 1.00 . A A . 13 THR HG1 1 1 15 7431 1 1 7 THR HG21 H -16.935 2.661 -5.350 1.00 . A A . 13 THR HG21 1 1 15 7432 1 1 7 THR HG22 H -15.710 3.919 -5.515 1.00 . A A . 13 THR HG22 1 1 15 7433 1 1 7 THR HG23 H -16.829 3.599 -6.840 1.00 . A A . 13 THR HG23 1 1 15 7434 1 1 7 THR N N -15.645 0.605 -4.723 1.00 . A A . 13 THR N 1 1 15 7435 1 1 7 THR O O -12.478 2.055 -4.816 1.00 . A A . 13 THR O 1 1 15 7436 1 1 7 THR OG1 O -14.323 2.843 -7.357 1.00 . A A . 13 THR OG1 1 1 15 7437 1 1 8 SER C C -13.179 3.055 -1.608 1.00 . A A . 14 SER C 1 1 15 7438 1 1 8 SER CA C -13.515 3.779 -2.909 1.00 . A A . 14 SER CA 1 1 15 7439 1 1 8 SER CB C -14.289 5.064 -2.607 1.00 . A A . 14 SER CB 1 1 15 7440 1 1 8 SER H H -15.266 2.923 -3.732 1.00 . A A . 14 SER H 1 1 15 7441 1 1 8 SER HA H -12.595 4.033 -3.414 1.00 . A A . 14 SER HA 1 1 15 7442 1 1 8 SER HB2 H -14.812 5.384 -3.496 1.00 . A A . 14 SER HB2 1 1 15 7443 1 1 8 SER HB3 H -15.002 4.875 -1.818 1.00 . A A . 14 SER HB3 1 1 15 7444 1 1 8 SER HG H -13.077 6.560 -2.966 1.00 . A A . 14 SER HG 1 1 15 7445 1 1 8 SER N N -14.288 2.918 -3.795 1.00 . A A . 14 SER N 1 1 15 7446 1 1 8 SER O O -12.177 3.357 -0.959 1.00 . A A . 14 SER O 1 1 15 7447 1 1 8 SER OG O -13.416 6.101 -2.195 1.00 . A A . 14 SER OG 1 1 15 7448 1 1 9 ASP C C -12.647 0.364 -0.151 1.00 . A A . 15 ASP C 1 1 15 7449 1 1 9 ASP CA C -13.820 1.332 -0.010 1.00 . A A . 15 ASP CA 1 1 15 7450 1 1 9 ASP CB C -15.091 0.560 0.348 1.00 . A A . 15 ASP CB 1 1 15 7451 1 1 9 ASP CG C -15.212 0.304 1.837 1.00 . A A . 15 ASP CG 1 1 15 7452 1 1 9 ASP H H -14.805 1.905 -1.792 1.00 . A A . 15 ASP H 1 1 15 7453 1 1 9 ASP HA H -13.599 2.029 0.784 1.00 . A A . 15 ASP HA 1 1 15 7454 1 1 9 ASP HB2 H -15.951 1.127 0.028 1.00 . A A . 15 ASP HB2 1 1 15 7455 1 1 9 ASP HB3 H -15.082 -0.392 -0.163 1.00 . A A . 15 ASP HB3 1 1 15 7456 1 1 9 ASP N N -14.024 2.099 -1.233 1.00 . A A . 15 ASP N 1 1 15 7457 1 1 9 ASP O O -12.090 -0.096 0.845 1.00 . A A . 15 ASP O 1 1 15 7458 1 1 9 ASP OD1 O -14.550 1.019 2.618 1.00 . A A . 15 ASP OD1 1 1 15 7459 1 1 9 ASP OD2 O -15.970 -0.611 2.223 1.00 . A A . 15 ASP OD2 1 1 15 7460 1 1 10 VAL C C -9.932 -0.483 -0.838 1.00 . A A . 16 VAL C 1 1 15 7461 1 1 10 VAL CA C -11.168 -0.861 -1.654 1.00 . A A . 16 VAL CA 1 1 15 7462 1 1 10 VAL CB C -10.804 -0.882 -3.155 1.00 . A A . 16 VAL CB 1 1 15 7463 1 1 10 VAL CG1 C -9.571 -1.742 -3.407 1.00 . A A . 16 VAL CG1 1 1 15 7464 1 1 10 VAL CG2 C -11.983 -1.374 -3.983 1.00 . A A . 16 VAL CG2 1 1 15 7465 1 1 10 VAL H H -12.756 0.450 -2.148 1.00 . A A . 16 VAL H 1 1 15 7466 1 1 10 VAL HA H -11.484 -1.854 -1.369 1.00 . A A . 16 VAL HA 1 1 15 7467 1 1 10 VAL HB H -10.577 0.129 -3.462 1.00 . A A . 16 VAL HB 1 1 15 7468 1 1 10 VAL HG11 H -9.283 -2.236 -2.491 1.00 . A A . 16 VAL HG11 1 1 15 7469 1 1 10 VAL HG12 H -9.795 -2.484 -4.160 1.00 . A A . 16 VAL HG12 1 1 15 7470 1 1 10 VAL HG13 H -8.760 -1.117 -3.750 1.00 . A A . 16 VAL HG13 1 1 15 7471 1 1 10 VAL HG21 H -12.693 -1.871 -3.339 1.00 . A A . 16 VAL HG21 1 1 15 7472 1 1 10 VAL HG22 H -12.460 -0.534 -4.465 1.00 . A A . 16 VAL HG22 1 1 15 7473 1 1 10 VAL HG23 H -11.632 -2.067 -4.734 1.00 . A A . 16 VAL HG23 1 1 15 7474 1 1 10 VAL N N -12.275 0.055 -1.392 1.00 . A A . 16 VAL N 1 1 15 7475 1 1 10 VAL O O -9.411 -1.292 -0.073 1.00 . A A . 16 VAL O 1 1 15 7476 1 1 11 SER C C -8.451 1.054 1.225 1.00 . A A . 17 SER C 1 1 15 7477 1 1 11 SER CA C -8.293 1.233 -0.284 1.00 . A A . 17 SER CA 1 1 15 7478 1 1 11 SER CB C -8.044 2.708 -0.607 1.00 . A A . 17 SER CB 1 1 15 7479 1 1 11 SER H H -9.926 1.353 -1.629 1.00 . A A . 17 SER H 1 1 15 7480 1 1 11 SER HA H -7.444 0.656 -0.615 1.00 . A A . 17 SER HA 1 1 15 7481 1 1 11 SER HB2 H -8.074 2.850 -1.677 1.00 . A A . 17 SER HB2 1 1 15 7482 1 1 11 SER HB3 H -8.811 3.310 -0.142 1.00 . A A . 17 SER HB3 1 1 15 7483 1 1 11 SER HG H -6.087 2.636 -0.573 1.00 . A A . 17 SER HG 1 1 15 7484 1 1 11 SER N N -9.468 0.751 -1.006 1.00 . A A . 17 SER N 1 1 15 7485 1 1 11 SER O O -7.464 1.028 1.961 1.00 . A A . 17 SER O 1 1 15 7486 1 1 11 SER OG O -6.779 3.128 -0.126 1.00 . A A . 17 SER OG 1 1 15 7487 1 1 12 SER C C -9.373 -0.522 3.649 1.00 . A A . 18 SER C 1 1 15 7488 1 1 12 SER CA C -9.972 0.774 3.105 1.00 . A A . 18 SER CA 1 1 15 7489 1 1 12 SER CB C -11.482 0.792 3.355 1.00 . A A . 18 SER CB 1 1 15 7490 1 1 12 SER H H -10.442 0.976 1.053 1.00 . A A . 18 SER H 1 1 15 7491 1 1 12 SER HA H -9.525 1.606 3.626 1.00 . A A . 18 SER HA 1 1 15 7492 1 1 12 SER HB2 H -11.948 1.494 2.680 1.00 . A A . 18 SER HB2 1 1 15 7493 1 1 12 SER HB3 H -11.885 -0.195 3.181 1.00 . A A . 18 SER HB3 1 1 15 7494 1 1 12 SER HG H -12.709 1.379 4.764 1.00 . A A . 18 SER HG 1 1 15 7495 1 1 12 SER N N -9.694 0.940 1.683 1.00 . A A . 18 SER N 1 1 15 7496 1 1 12 SER O O -8.810 -0.539 4.743 1.00 . A A . 18 SER O 1 1 15 7497 1 1 12 SER OG O -11.774 1.176 4.687 1.00 . A A . 18 SER OG 1 1 15 7498 1 1 13 TYR C C -7.453 -2.862 3.441 1.00 . A A . 19 TYR C 1 1 15 7499 1 1 13 TYR CA C -8.976 -2.899 3.325 1.00 . A A . 19 TYR CA 1 1 15 7500 1 1 13 TYR CB C -9.433 -4.022 2.376 1.00 . A A . 19 TYR CB 1 1 15 7501 1 1 13 TYR CD1 C -7.276 -4.923 1.404 1.00 . A A . 19 TYR CD1 1 1 15 7502 1 1 13 TYR CD2 C -8.859 -3.947 -0.086 1.00 . A A . 19 TYR CD2 1 1 15 7503 1 1 13 TYR CE1 C -6.431 -5.184 0.342 1.00 . A A . 19 TYR CE1 1 1 15 7504 1 1 13 TYR CE2 C -8.020 -4.207 -1.154 1.00 . A A . 19 TYR CE2 1 1 15 7505 1 1 13 TYR CG C -8.503 -4.299 1.209 1.00 . A A . 19 TYR CG 1 1 15 7506 1 1 13 TYR CZ C -6.807 -4.824 -0.934 1.00 . A A . 19 TYR CZ 1 1 15 7507 1 1 13 TYR H H -9.967 -1.543 2.030 1.00 . A A . 19 TYR H 1 1 15 7508 1 1 13 TYR HA H -9.382 -3.094 4.306 1.00 . A A . 19 TYR HA 1 1 15 7509 1 1 13 TYR HB2 H -9.526 -4.937 2.941 1.00 . A A . 19 TYR HB2 1 1 15 7510 1 1 13 TYR HB3 H -10.401 -3.762 1.972 1.00 . A A . 19 TYR HB3 1 1 15 7511 1 1 13 TYR HD1 H -9.809 -3.462 -0.256 1.00 . A A . 19 TYR HD1 1 1 15 7512 1 1 13 TYR HD2 H -6.984 -5.205 2.405 1.00 . A A . 19 TYR HD2 1 1 15 7513 1 1 13 TYR HE1 H -8.315 -3.925 -2.153 1.00 . A A . 19 TYR HE1 1 1 15 7514 1 1 13 TYR HE2 H -5.481 -5.668 0.515 1.00 . A A . 19 TYR HE2 1 1 15 7515 1 1 13 TYR HH H -6.487 -5.368 -2.750 1.00 . A A . 19 TYR HH 1 1 15 7516 1 1 13 TYR N N -9.503 -1.608 2.891 1.00 . A A . 19 TYR N 1 1 15 7517 1 1 13 TYR O O -6.888 -3.321 4.434 1.00 . A A . 19 TYR O 1 1 15 7518 1 1 13 TYR OH O -5.969 -5.083 -1.993 1.00 . A A . 19 TYR OH 1 1 15 7519 1 1 14 LEU C C -4.866 -1.073 3.307 1.00 . A A . 20 LEU C 1 1 15 7520 1 1 14 LEU CA C -5.338 -2.224 2.425 1.00 . A A . 20 LEU CA 1 1 15 7521 1 1 14 LEU CB C -4.811 -2.040 1.000 1.00 . A A . 20 LEU CB 1 1 15 7522 1 1 14 LEU CD1 C -4.511 -0.022 -0.464 1.00 . A A . 20 LEU CD1 1 1 15 7523 1 1 14 LEU CD2 C -6.410 -1.595 -0.880 1.00 . A A . 20 LEU CD2 1 1 15 7524 1 1 14 LEU CG C -5.521 -0.960 0.179 1.00 . A A . 20 LEU CG 1 1 15 7525 1 1 14 LEU H H -7.296 -1.965 1.660 1.00 . A A . 20 LEU H 1 1 15 7526 1 1 14 LEU HA H -4.950 -3.149 2.825 1.00 . A A . 20 LEU HA 1 1 15 7527 1 1 14 LEU HB2 H -3.761 -1.788 1.059 1.00 . A A . 20 LEU HB2 1 1 15 7528 1 1 14 LEU HB3 H -4.908 -2.980 0.479 1.00 . A A . 20 LEU HB3 1 1 15 7529 1 1 14 LEU HD11 H -3.846 0.366 0.293 1.00 . A A . 20 LEU HD11 1 1 15 7530 1 1 14 LEU HD12 H -3.937 -0.563 -1.203 1.00 . A A . 20 LEU HD12 1 1 15 7531 1 1 14 LEU HD13 H -5.031 0.795 -0.941 1.00 . A A . 20 LEU HD13 1 1 15 7532 1 1 14 LEU HD21 H -5.893 -2.428 -1.331 1.00 . A A . 20 LEU HD21 1 1 15 7533 1 1 14 LEU HD22 H -7.323 -1.944 -0.420 1.00 . A A . 20 LEU HD22 1 1 15 7534 1 1 14 LEU HD23 H -6.646 -0.863 -1.638 1.00 . A A . 20 LEU HD23 1 1 15 7535 1 1 14 LEU HG H -6.148 -0.374 0.835 1.00 . A A . 20 LEU HG 1 1 15 7536 1 1 14 LEU N N -6.794 -2.315 2.425 1.00 . A A . 20 LEU N 1 1 15 7537 1 1 14 LEU O O -4.907 0.090 2.904 1.00 . A A . 20 LEU O 1 1 15 7538 1 1 15 GLU C C -2.779 0.398 4.858 1.00 . A A . 21 GLU C 1 1 15 7539 1 1 15 GLU CA C -3.934 -0.400 5.455 1.00 . A A . 21 GLU CA 1 1 15 7540 1 1 15 GLU CB C -3.489 -1.064 6.759 1.00 . A A . 21 GLU CB 1 1 15 7541 1 1 15 GLU CD C -5.442 -2.642 7.037 1.00 . A A . 21 GLU CD 1 1 15 7542 1 1 15 GLU CG C -4.644 -1.505 7.643 1.00 . A A . 21 GLU CG 1 1 15 7543 1 1 15 GLU H H -4.407 -2.349 4.777 1.00 . A A . 21 GLU H 1 1 15 7544 1 1 15 GLU HA H -4.750 0.275 5.666 1.00 . A A . 21 GLU HA 1 1 15 7545 1 1 15 GLU HB2 H -2.895 -1.934 6.521 1.00 . A A . 21 GLU HB2 1 1 15 7546 1 1 15 GLU HB3 H -2.883 -0.366 7.316 1.00 . A A . 21 GLU HB3 1 1 15 7547 1 1 15 GLU HG2 H -4.249 -1.830 8.594 1.00 . A A . 21 GLU HG2 1 1 15 7548 1 1 15 GLU HG3 H -5.304 -0.663 7.797 1.00 . A A . 21 GLU HG3 1 1 15 7549 1 1 15 GLU N N -4.416 -1.405 4.514 1.00 . A A . 21 GLU N 1 1 15 7550 1 1 15 GLU O O -2.576 1.564 5.196 1.00 . A A . 21 GLU O 1 1 15 7551 1 1 15 GLU OE1 O -4.821 -3.623 6.575 1.00 . A A . 21 GLU OE1 1 1 15 7552 1 1 15 GLU OE2 O -6.688 -2.554 7.025 1.00 . A A . 21 GLU OE2 1 1 15 7553 1 1 16 GLY C C 0.409 -0.311 3.564 1.00 . A A . 22 GLY C 1 1 15 7554 1 1 16 GLY CA C -0.897 0.426 3.339 1.00 . A A . 22 GLY CA 1 1 15 7555 1 1 16 GLY H H -2.231 -1.168 3.738 1.00 . A A . 22 GLY H 1 1 15 7556 1 1 16 GLY HA2 H -1.080 0.494 2.277 1.00 . A A . 22 GLY HA2 1 1 15 7557 1 1 16 GLY HA3 H -0.809 1.423 3.744 1.00 . A A . 22 GLY HA3 1 1 15 7558 1 1 16 GLY N N -2.023 -0.239 3.968 1.00 . A A . 22 GLY N 1 1 15 7559 1 1 16 GLY O O 1.440 0.306 3.829 1.00 . A A . 22 GLY O 1 1 15 7560 1 1 17 GLN C C 2.489 -2.354 2.457 1.00 . A A . 23 GLN C 1 1 15 7561 1 1 17 GLN CA C 1.551 -2.458 3.656 1.00 . A A . 23 GLN CA 1 1 15 7562 1 1 17 GLN CB C 1.153 -3.918 3.888 1.00 . A A . 23 GLN CB 1 1 15 7563 1 1 17 GLN CD C 2.459 -5.787 4.979 1.00 . A A . 23 GLN CD 1 1 15 7564 1 1 17 GLN CG C 1.692 -4.496 5.187 1.00 . A A . 23 GLN CG 1 1 15 7565 1 1 17 GLN H H -0.489 -2.069 3.248 1.00 . A A . 23 GLN H 1 1 15 7566 1 1 17 GLN HA H 2.066 -2.091 4.532 1.00 . A A . 23 GLN HA 1 1 15 7567 1 1 17 GLN HB2 H 0.075 -3.985 3.910 1.00 . A A . 23 GLN HB2 1 1 15 7568 1 1 17 GLN HB3 H 1.525 -4.517 3.070 1.00 . A A . 23 GLN HB3 1 1 15 7569 1 1 17 GLN HE21 H 3.896 -4.807 4.016 1.00 . A A . 23 GLN HE21 1 1 15 7570 1 1 17 GLN HE22 H 4.127 -6.512 4.176 1.00 . A A . 23 GLN HE22 1 1 15 7571 1 1 17 GLN HG2 H 2.353 -3.772 5.641 1.00 . A A . 23 GLN HG2 1 1 15 7572 1 1 17 GLN HG3 H 0.862 -4.690 5.851 1.00 . A A . 23 GLN HG3 1 1 15 7573 1 1 17 GLN N N 0.363 -1.635 3.460 1.00 . A A . 23 GLN N 1 1 15 7574 1 1 17 GLN NE2 N 3.610 -5.692 4.324 1.00 . A A . 23 GLN NE2 1 1 15 7575 1 1 17 GLN O O 3.650 -1.971 2.597 1.00 . A A . 23 GLN O 1 1 15 7576 1 1 17 GLN OE1 O 2.022 -6.857 5.402 1.00 . A A . 23 GLN OE1 1 1 15 7577 1 1 18 ALA C C 3.370 -1.252 -0.146 1.00 . A A . 24 ALA C 1 1 15 7578 1 1 18 ALA CA C 2.771 -2.640 0.055 1.00 . A A . 24 ALA CA 1 1 15 7579 1 1 18 ALA CB C 1.921 -3.028 -1.145 1.00 . A A . 24 ALA CB 1 1 15 7580 1 1 18 ALA H H 1.045 -2.993 1.229 1.00 . A A . 24 ALA H 1 1 15 7581 1 1 18 ALA HA H 3.574 -3.357 0.145 1.00 . A A . 24 ALA HA 1 1 15 7582 1 1 18 ALA HB1 H 0.885 -2.802 -0.941 1.00 . A A . 24 ALA HB1 1 1 15 7583 1 1 18 ALA HB2 H 2.246 -2.471 -2.012 1.00 . A A . 24 ALA HB2 1 1 15 7584 1 1 18 ALA HB3 H 2.028 -4.085 -1.335 1.00 . A A . 24 ALA HB3 1 1 15 7585 1 1 18 ALA N N 1.978 -2.696 1.278 1.00 . A A . 24 ALA N 1 1 15 7586 1 1 18 ALA O O 4.467 -1.110 -0.687 1.00 . A A . 24 ALA O 1 1 15 7587 1 1 19 ALA C C 4.277 1.416 1.107 1.00 . A A . 25 ALA C 1 1 15 7588 1 1 19 ALA CA C 3.104 1.146 0.170 1.00 . A A . 25 ALA CA 1 1 15 7589 1 1 19 ALA CB C 1.961 2.111 0.452 1.00 . A A . 25 ALA CB 1 1 15 7590 1 1 19 ALA H H 1.779 -0.409 0.722 1.00 . A A . 25 ALA H 1 1 15 7591 1 1 19 ALA HA H 3.428 1.296 -0.850 1.00 . A A . 25 ALA HA 1 1 15 7592 1 1 19 ALA HB1 H 1.108 1.560 0.820 1.00 . A A . 25 ALA HB1 1 1 15 7593 1 1 19 ALA HB2 H 2.271 2.831 1.195 1.00 . A A . 25 ALA HB2 1 1 15 7594 1 1 19 ALA HB3 H 1.692 2.626 -0.458 1.00 . A A . 25 ALA HB3 1 1 15 7595 1 1 19 ALA N N 2.644 -0.231 0.297 1.00 . A A . 25 ALA N 1 1 15 7596 1 1 19 ALA O O 5.429 1.461 0.677 1.00 . A A . 25 ALA O 1 1 15 7597 1 1 20 LYS C C 6.201 0.930 3.230 1.00 . A A . 26 LYS C 1 1 15 7598 1 1 20 LYS CA C 4.996 1.854 3.403 1.00 . A A . 26 LYS CA 1 1 15 7599 1 1 20 LYS CB C 4.402 1.681 4.805 1.00 . A A . 26 LYS CB 1 1 15 7600 1 1 20 LYS CD C 4.548 4.198 5.144 1.00 . A A . 26 LYS CD 1 1 15 7601 1 1 20 LYS CE C 3.226 4.334 4.400 1.00 . A A . 26 LYS CE 1 1 15 7602 1 1 20 LYS CG C 4.723 2.817 5.773 1.00 . A A . 26 LYS CG 1 1 15 7603 1 1 20 LYS HA H 5.324 2.874 3.282 1.00 . A A . 26 LYS HA 1 1 15 7604 1 1 20 LYS HB2 H 3.328 1.607 4.719 1.00 . A A . 26 LYS HB2 1 1 15 7605 1 1 20 LYS HD2 H 4.581 4.941 5.927 1.00 . A A . 26 LYS HD2 1 1 15 7606 1 1 20 LYS HE2 H 2.713 3.386 4.417 1.00 . A A . 26 LYS HE2 1 1 15 7607 1 1 20 LYS HG2 H 4.065 2.742 6.625 1.00 . A A . 26 LYS HG2 1 1 15 7608 1 1 20 LYS HZ1 H 3.852 4.102 2.407 1.00 . A A . 26 LYS HZ1 1 1 15 7609 1 1 20 LYS N N 3.973 1.590 2.391 1.00 . A A . 26 LYS N 1 1 15 7610 1 1 20 LYS NZ N 3.424 4.743 3.012 1.00 . A A . 26 LYS NZ 1 1 15 7611 1 1 20 LYS O O 7.325 1.289 3.578 1.00 . A A . 26 LYS O 1 1 15 7612 1 1 21 GLU C C 8.232 -0.599 1.786 1.00 . A A . 27 GLU C 1 1 15 7613 1 1 21 GLU CA C 7.020 -1.236 2.466 1.00 . A A . 27 GLU CA 1 1 15 7614 1 1 21 GLU CB C 6.497 -2.396 1.615 1.00 . A A . 27 GLU CB 1 1 15 7615 1 1 21 GLU CD C 7.266 -4.741 2.158 1.00 . A A . 27 GLU CD 1 1 15 7616 1 1 21 GLU CG C 7.531 -3.480 1.359 1.00 . A A . 27 GLU CG 1 1 15 7617 1 1 21 GLU H H 5.041 -0.488 2.430 1.00 . A A . 27 GLU H 1 1 15 7618 1 1 21 GLU HA H 7.323 -1.619 3.428 1.00 . A A . 27 GLU HA 1 1 15 7619 1 1 21 GLU HB2 H 5.654 -2.845 2.120 1.00 . A A . 27 GLU HB2 1 1 15 7620 1 1 21 GLU HB3 H 6.169 -2.009 0.662 1.00 . A A . 27 GLU HB3 1 1 15 7621 1 1 21 GLU HG2 H 7.518 -3.730 0.308 1.00 . A A . 27 GLU HG2 1 1 15 7622 1 1 21 GLU HG3 H 8.506 -3.100 1.625 1.00 . A A . 27 GLU HG3 1 1 15 7623 1 1 21 GLU N N 5.958 -0.259 2.688 1.00 . A A . 27 GLU N 1 1 15 7624 1 1 21 GLU O O 9.360 -1.064 1.949 1.00 . A A . 27 GLU O 1 1 15 7625 1 1 21 GLU OE1 O 6.083 -5.031 2.436 1.00 . A A . 27 GLU OE1 1 1 15 7626 1 1 21 GLU OE2 O 8.241 -5.439 2.508 1.00 . A A . 27 GLU OE2 1 1 15 7627 1 1 22 PHE C C 10.038 1.808 1.307 1.00 . A A . 28 PHE C 1 1 15 7628 1 1 22 PHE CA C 9.072 1.152 0.321 1.00 . A A . 28 PHE CA 1 1 15 7629 1 1 22 PHE CB C 8.501 2.195 -0.657 1.00 . A A . 28 PHE CB 1 1 15 7630 1 1 22 PHE CD1 C 9.356 4.406 0.193 1.00 . A A . 28 PHE CD1 1 1 15 7631 1 1 22 PHE CD2 C 7.004 4.012 0.233 1.00 . A A . 28 PHE CD2 1 1 15 7632 1 1 22 PHE CE1 C 9.158 5.662 0.733 1.00 . A A . 28 PHE CE1 1 1 15 7633 1 1 22 PHE CE2 C 6.801 5.268 0.773 1.00 . A A . 28 PHE CE2 1 1 15 7634 1 1 22 PHE CG C 8.283 3.565 -0.063 1.00 . A A . 28 PHE CG 1 1 15 7635 1 1 22 PHE CZ C 7.879 6.093 1.024 1.00 . A A . 28 PHE CZ 1 1 15 7636 1 1 22 PHE H H 7.075 0.790 0.925 1.00 . A A . 28 PHE H 1 1 15 7637 1 1 22 PHE HA H 9.616 0.410 -0.244 1.00 . A A . 28 PHE HA 1 1 15 7638 1 1 22 PHE HB2 H 9.182 2.304 -1.487 1.00 . A A . 28 PHE HB2 1 1 15 7639 1 1 22 PHE HB3 H 7.551 1.840 -1.028 1.00 . A A . 28 PHE HB3 1 1 15 7640 1 1 22 PHE HD1 H 6.161 3.369 0.037 1.00 . A A . 28 PHE HD1 1 1 15 7641 1 1 22 PHE HD2 H 10.357 4.070 -0.033 1.00 . A A . 28 PHE HD2 1 1 15 7642 1 1 22 PHE HE1 H 5.799 5.603 0.998 1.00 . A A . 28 PHE HE1 1 1 15 7643 1 1 22 PHE HE2 H 10.003 6.306 0.928 1.00 . A A . 28 PHE HE2 1 1 15 7644 1 1 22 PHE HZ H 7.722 7.075 1.446 1.00 . A A . 28 PHE HZ 1 1 15 7645 1 1 22 PHE N N 7.994 0.464 1.022 1.00 . A A . 28 PHE N 1 1 15 7646 1 1 22 PHE O O 11.254 1.692 1.169 1.00 . A A . 28 PHE O 1 1 15 7647 1 1 23 ILE C C 11.406 2.276 3.842 1.00 . A A . 29 ILE C 1 1 15 7648 1 1 23 ILE CA C 10.308 3.186 3.294 1.00 . A A . 29 ILE CA 1 1 15 7649 1 1 23 ILE CB C 9.448 3.718 4.462 1.00 . A A . 29 ILE CB 1 1 15 7650 1 1 23 ILE CD1 C 9.395 5.528 6.251 1.00 . A A . 29 ILE CD1 1 1 15 7651 1 1 23 ILE CG1 C 10.245 4.727 5.289 1.00 . A A . 29 ILE CG1 1 1 15 7652 1 1 23 ILE CG2 C 8.953 2.576 5.340 1.00 . A A . 29 ILE CG2 1 1 15 7653 1 1 23 ILE H H 8.514 2.568 2.353 1.00 . A A . 29 ILE H 1 1 15 7654 1 1 23 ILE HA H 10.776 4.032 2.810 1.00 . A A . 29 ILE HA 1 1 15 7655 1 1 23 ILE HB H 8.584 4.213 4.043 1.00 . A A . 29 ILE HB 1 1 15 7656 1 1 23 ILE HD11 H 8.392 5.128 6.263 1.00 . A A . 29 ILE HD11 1 1 15 7657 1 1 23 ILE HD12 H 9.819 5.468 7.243 1.00 . A A . 29 ILE HD12 1 1 15 7658 1 1 23 ILE HD13 H 9.367 6.560 5.934 1.00 . A A . 29 ILE HD13 1 1 15 7659 1 1 23 ILE HG12 H 10.991 4.201 5.866 1.00 . A A . 29 ILE HG12 1 1 15 7660 1 1 23 ILE HG13 H 10.736 5.421 4.622 1.00 . A A . 29 ILE HG13 1 1 15 7661 1 1 23 ILE HG21 H 9.135 1.634 4.844 1.00 . A A . 29 ILE HG21 1 1 15 7662 1 1 23 ILE HG22 H 9.478 2.593 6.284 1.00 . A A . 29 ILE HG22 1 1 15 7663 1 1 23 ILE HG23 H 7.893 2.690 5.515 1.00 . A A . 29 ILE HG23 1 1 15 7664 1 1 23 ILE N N 9.490 2.504 2.296 1.00 . A A . 29 ILE N 1 1 15 7665 1 1 23 ILE O O 12.469 2.748 4.235 1.00 . A A . 29 ILE O 1 1 15 7666 1 1 24 ALA C C 13.269 -0.193 3.391 1.00 . A A . 30 ALA C 1 1 15 7667 1 1 24 ALA CA C 12.114 0.009 4.370 1.00 . A A . 30 ALA CA 1 1 15 7668 1 1 24 ALA CB C 11.431 -1.319 4.660 1.00 . A A . 30 ALA CB 1 1 15 7669 1 1 24 ALA H H 10.276 0.655 3.539 1.00 . A A . 30 ALA H 1 1 15 7670 1 1 24 ALA HA H 12.509 0.391 5.300 1.00 . A A . 30 ALA HA 1 1 15 7671 1 1 24 ALA HB1 H 10.467 -1.137 5.111 1.00 . A A . 30 ALA HB1 1 1 15 7672 1 1 24 ALA HB2 H 11.299 -1.865 3.738 1.00 . A A . 30 ALA HB2 1 1 15 7673 1 1 24 ALA HB3 H 12.042 -1.898 5.337 1.00 . A A . 30 ALA HB3 1 1 15 7674 1 1 24 ALA N N 11.143 0.975 3.866 1.00 . A A . 30 ALA N 1 1 15 7675 1 1 24 ALA O O 14.337 -0.672 3.771 1.00 . A A . 30 ALA O 1 1 15 7676 1 1 25 TRP C C 15.043 1.193 1.095 1.00 . A A . 31 TRP C 1 1 15 7677 1 1 25 TRP CA C 14.071 0.011 1.101 1.00 . A A . 31 TRP CA 1 1 15 7678 1 1 25 TRP CB C 13.414 -0.137 -0.286 1.00 . A A . 31 TRP CB 1 1 15 7679 1 1 25 TRP CD1 C 15.110 0.923 -1.894 1.00 . A A . 31 TRP CD1 1 1 15 7680 1 1 25 TRP CD2 C 13.154 2.008 -1.784 1.00 . A A . 31 TRP CD2 1 1 15 7681 1 1 25 TRP CE2 C 13.996 2.691 -2.682 1.00 . A A . 31 TRP CE2 1 1 15 7682 1 1 25 TRP CE3 C 11.869 2.508 -1.558 1.00 . A A . 31 TRP CE3 1 1 15 7683 1 1 25 TRP CG C 13.886 0.878 -1.290 1.00 . A A . 31 TRP CG 1 1 15 7684 1 1 25 TRP CH2 C 12.333 4.312 -3.105 1.00 . A A . 31 TRP CH2 1 1 15 7685 1 1 25 TRP CZ2 C 13.595 3.847 -3.347 1.00 . A A . 31 TRP CZ2 1 1 15 7686 1 1 25 TRP CZ3 C 11.472 3.654 -2.220 1.00 . A A . 31 TRP CZ3 1 1 15 7687 1 1 25 TRP H H 12.175 0.534 1.883 1.00 . A A . 31 TRP H 1 1 15 7688 1 1 25 TRP HA H 14.624 -0.889 1.321 1.00 . A A . 31 TRP HA 1 1 15 7689 1 1 25 TRP HB2 H 13.636 -1.119 -0.678 1.00 . A A . 31 TRP HB2 1 1 15 7690 1 1 25 TRP HB3 H 12.344 -0.032 -0.182 1.00 . A A . 31 TRP HB3 1 1 15 7691 1 1 25 TRP HD1 H 15.897 0.203 -1.727 1.00 . A A . 31 TRP HD1 1 1 15 7692 1 1 25 TRP HE1 H 15.961 2.258 -3.275 1.00 . A A . 31 TRP HE1 1 1 15 7693 1 1 25 TRP HE3 H 11.190 2.015 -0.882 1.00 . A A . 31 TRP HE3 1 1 15 7694 1 1 25 TRP HH2 H 11.982 5.205 -3.600 1.00 . A A . 31 TRP HH2 1 1 15 7695 1 1 25 TRP HZ2 H 14.247 4.369 -4.029 1.00 . A A . 31 TRP HZ2 1 1 15 7696 1 1 25 TRP HZ3 H 10.483 4.055 -2.055 1.00 . A A . 31 TRP HZ3 1 1 15 7697 1 1 25 TRP N N 13.048 0.165 2.130 1.00 . A A . 31 TRP N 1 1 15 7698 1 1 25 TRP NE1 N 15.184 2.010 -2.731 1.00 . A A . 31 TRP NE1 1 1 15 7699 1 1 25 TRP O O 16.254 1.015 1.229 1.00 . A A . 31 TRP O 1 1 15 7700 1 1 26 LEU C C 15.872 4.020 2.187 1.00 . A A . 32 LEU C 1 1 15 7701 1 1 26 LEU CA C 15.320 3.597 0.823 1.00 . A A . 32 LEU CA 1 1 15 7702 1 1 26 LEU CB C 14.517 4.733 0.173 1.00 . A A . 32 LEU CB 1 1 15 7703 1 1 26 LEU CD1 C 13.088 6.786 0.357 1.00 . A A . 32 LEU CD1 1 1 15 7704 1 1 26 LEU CD2 C 12.965 5.016 2.127 1.00 . A A . 32 LEU CD2 1 1 15 7705 1 1 26 LEU CG C 13.868 5.733 1.132 1.00 . A A . 32 LEU CG 1 1 15 7706 1 1 26 LEU H H 13.536 2.463 0.767 1.00 . A A . 32 LEU H 1 1 15 7707 1 1 26 LEU HA H 16.157 3.370 0.183 1.00 . A A . 32 LEU HA 1 1 15 7708 1 1 26 LEU HB2 H 15.179 5.279 -0.483 1.00 . A A . 32 LEU HB2 1 1 15 7709 1 1 26 LEU HB3 H 13.736 4.290 -0.427 1.00 . A A . 32 LEU HB3 1 1 15 7710 1 1 26 LEU HD11 H 13.139 6.568 -0.700 1.00 . A A . 32 LEU HD11 1 1 15 7711 1 1 26 LEU HD12 H 12.057 6.779 0.676 1.00 . A A . 32 LEU HD12 1 1 15 7712 1 1 26 LEU HD13 H 13.516 7.760 0.544 1.00 . A A . 32 LEU HD13 1 1 15 7713 1 1 26 LEU HD21 H 13.036 3.949 1.977 1.00 . A A . 32 LEU HD21 1 1 15 7714 1 1 26 LEU HD22 H 13.274 5.260 3.133 1.00 . A A . 32 LEU HD22 1 1 15 7715 1 1 26 LEU HD23 H 11.943 5.333 1.979 1.00 . A A . 32 LEU HD23 1 1 15 7716 1 1 26 LEU HG H 14.643 6.237 1.685 1.00 . A A . 32 LEU HG 1 1 15 7717 1 1 26 LEU N N 14.505 2.392 0.897 1.00 . A A . 32 LEU N 1 1 15 7718 1 1 26 LEU O O 16.845 4.769 2.259 1.00 . A A . 32 LEU O 1 1 15 7719 1 1 27 VAL C C 17.013 3.148 4.950 1.00 . A A . 33 VAL C 1 1 15 7720 1 1 27 VAL CA C 15.732 3.901 4.601 1.00 . A A . 33 VAL CA 1 1 15 7721 1 1 27 VAL CB C 14.669 3.625 5.684 1.00 . A A . 33 VAL CB 1 1 15 7722 1 1 27 VAL CG1 C 14.470 2.128 5.884 1.00 . A A . 33 VAL CG1 1 1 15 7723 1 1 27 VAL CG2 C 15.058 4.296 6.992 1.00 . A A . 33 VAL CG2 1 1 15 7724 1 1 27 VAL H H 14.490 2.950 3.166 1.00 . A A . 33 VAL H 1 1 15 7725 1 1 27 VAL HA H 15.945 4.961 4.598 1.00 . A A . 33 VAL HA 1 1 15 7726 1 1 27 VAL HB H 13.732 4.049 5.355 1.00 . A A . 33 VAL HB 1 1 15 7727 1 1 27 VAL HG11 H 14.405 1.641 4.922 1.00 . A A . 33 VAL HG11 1 1 15 7728 1 1 27 VAL HG12 H 15.306 1.725 6.436 1.00 . A A . 33 VAL HG12 1 1 15 7729 1 1 27 VAL HG13 H 13.558 1.957 6.436 1.00 . A A . 33 VAL HG13 1 1 15 7730 1 1 27 VAL HG21 H 16.111 4.145 7.175 1.00 . A A . 33 VAL HG21 1 1 15 7731 1 1 27 VAL HG22 H 14.851 5.354 6.928 1.00 . A A . 33 VAL HG22 1 1 15 7732 1 1 27 VAL HG23 H 14.487 3.866 7.801 1.00 . A A . 33 VAL HG23 1 1 15 7733 1 1 27 VAL N N 15.262 3.545 3.266 1.00 . A A . 33 VAL N 1 1 15 7734 1 1 27 VAL O O 17.844 3.638 5.715 1.00 . A A . 33 VAL O 1 1 15 7735 1 1 28 ARG C C 19.475 1.499 3.675 1.00 . A A . 34 ARG C 1 1 15 7736 1 1 28 ARG CA C 18.345 1.135 4.634 1.00 . A A . 34 ARG CA 1 1 15 7737 1 1 28 ARG CB C 17.996 -0.349 4.497 1.00 . A A . 34 ARG CB 1 1 15 7738 1 1 28 ARG CD C 17.333 -2.225 2.962 1.00 . A A . 34 ARG CD 1 1 15 7739 1 1 28 ARG CG C 17.426 -0.718 3.136 1.00 . A A . 34 ARG CG 1 1 15 7740 1 1 28 ARG CZ C 16.997 -3.857 1.147 1.00 . A A . 34 ARG CZ 1 1 15 7741 1 1 28 ARG H H 16.469 1.619 3.782 1.00 . A A . 34 ARG H 1 1 15 7742 1 1 28 ARG HA H 18.672 1.326 5.645 1.00 . A A . 34 ARG HA 1 1 15 7743 1 1 28 ARG HB2 H 18.889 -0.934 4.660 1.00 . A A . 34 ARG HB2 1 1 15 7744 1 1 28 ARG HB3 H 17.265 -0.606 5.250 1.00 . A A . 34 ARG HB3 1 1 15 7745 1 1 28 ARG HD2 H 18.277 -2.666 3.245 1.00 . A A . 34 ARG HD2 1 1 15 7746 1 1 28 ARG HD3 H 16.553 -2.601 3.608 1.00 . A A . 34 ARG HD3 1 1 15 7747 1 1 28 ARG HE H 16.839 -1.877 0.949 1.00 . A A . 34 ARG HE 1 1 15 7748 1 1 28 ARG HG2 H 16.438 -0.293 3.043 1.00 . A A . 34 ARG HG2 1 1 15 7749 1 1 28 ARG HG3 H 18.068 -0.314 2.367 1.00 . A A . 34 ARG HG3 1 1 15 7750 1 1 28 ARG HH11 H 17.464 -4.677 2.936 1.00 . A A . 34 ARG HH11 1 1 15 7751 1 1 28 ARG HH12 H 17.223 -5.804 1.643 1.00 . A A . 34 ARG HH12 1 1 15 7752 1 1 28 ARG HH21 H 16.520 -3.357 -0.752 1.00 . A A . 34 ARG HH21 1 1 15 7753 1 1 28 ARG HH22 H 16.687 -5.055 -0.451 1.00 . A A . 34 ARG HH22 1 1 15 7754 1 1 28 ARG N N 17.166 1.955 4.383 1.00 . A A . 34 ARG N 1 1 15 7755 1 1 28 ARG NE N 17.029 -2.600 1.583 1.00 . A A . 34 ARG NE 1 1 15 7756 1 1 28 ARG NH1 N 17.249 -4.861 1.977 1.00 . A A . 34 ARG NH1 1 1 15 7757 1 1 28 ARG NH2 N 16.711 -4.111 -0.123 1.00 . A A . 34 ARG NH2 1 1 15 7758 1 1 28 ARG O O 20.002 0.642 2.964 1.00 . A A . 34 ARG O 1 1 15 7759 1 1 29 GLY C C 20.484 3.275 1.332 1.00 . A A . 35 GLY C 1 1 15 7760 1 1 29 GLY CA C 20.908 3.231 2.786 1.00 . A A . 35 GLY CA 1 1 15 7761 1 1 29 GLY H H 19.389 3.414 4.249 1.00 . A A . 35 GLY H 1 1 15 7762 1 1 29 GLY HA2 H 21.211 4.221 3.092 1.00 . A A . 35 GLY HA2 1 1 15 7763 1 1 29 GLY HA3 H 21.750 2.562 2.884 1.00 . A A . 35 GLY HA3 1 1 15 7764 1 1 29 GLY N N 19.843 2.776 3.661 1.00 . A A . 35 GLY N 1 1 15 7765 1 1 29 GLY O O 20.770 2.354 0.567 1.00 . A A . 35 GLY O 1 1 15 7766 1 1 30 ARG C C 20.421 5.130 -1.297 1.00 . A A . 36 ARG C 1 1 15 7767 1 1 30 ARG CA C 19.335 4.509 -0.424 1.00 . A A . 36 ARG CA 1 1 15 7768 1 1 30 ARG CB C 18.073 5.374 -0.460 1.00 . A A . 36 ARG CB 1 1 15 7769 1 1 30 ARG CD C 17.003 7.582 0.078 1.00 . A A . 36 ARG CD 1 1 15 7770 1 1 30 ARG CG C 18.311 6.819 -0.050 1.00 . A A . 36 ARG CG 1 1 15 7771 1 1 30 ARG CZ C 17.095 9.301 -1.685 1.00 . A A . 36 ARG CZ 1 1 15 7772 1 1 30 ARG H H 19.602 5.049 1.605 1.00 . A A . 36 ARG H 1 1 15 7773 1 1 30 ARG HA H 19.099 3.528 -0.809 1.00 . A A . 36 ARG HA 1 1 15 7774 1 1 30 ARG HB2 H 17.676 5.369 -1.464 1.00 . A A . 36 ARG HB2 1 1 15 7775 1 1 30 ARG HB3 H 17.340 4.949 0.209 1.00 . A A . 36 ARG HB3 1 1 15 7776 1 1 30 ARG HD2 H 16.246 7.074 -0.502 1.00 . A A . 36 ARG HD2 1 1 15 7777 1 1 30 ARG HD3 H 16.710 7.596 1.118 1.00 . A A . 36 ARG HD3 1 1 15 7778 1 1 30 ARG HE H 17.229 9.662 0.273 1.00 . A A . 36 ARG HE 1 1 15 7779 1 1 30 ARG HG2 H 18.820 6.834 0.902 1.00 . A A . 36 ARG HG2 1 1 15 7780 1 1 30 ARG HG3 H 18.926 7.298 -0.798 1.00 . A A . 36 ARG HG3 1 1 15 7781 1 1 30 ARG HH11 H 16.864 7.411 -2.369 1.00 . A A . 36 ARG HH11 1 1 15 7782 1 1 30 ARG HH12 H 16.932 8.638 -3.589 1.00 . A A . 36 ARG HH12 1 1 15 7783 1 1 30 ARG HH21 H 17.320 11.278 -1.330 1.00 . A A . 36 ARG HH21 1 1 15 7784 1 1 30 ARG HH22 H 17.191 10.834 -2.999 1.00 . A A . 36 ARG HH22 1 1 15 7785 1 1 30 ARG N N 19.800 4.348 0.949 1.00 . A A . 36 ARG N 1 1 15 7786 1 1 30 ARG NE N 17.122 8.957 -0.400 1.00 . A A . 36 ARG NE 1 1 15 7787 1 1 30 ARG NH1 N 16.952 8.374 -2.625 1.00 . A A . 36 ARG NH1 1 1 15 7788 1 1 30 ARG NH2 N 17.212 10.575 -2.033 1.00 . A A . 36 ARG NH2 1 1 15 7789 1 1 30 ARG O O 20.890 6.236 -1.029 1.00 . A A . 36 ARG O 1 1 15 7790 1 1 31 GLY C C 23.236 4.491 -2.814 1.00 . A A . 37 GLY C 1 1 15 7791 1 1 31 GLY CA C 21.843 4.909 -3.239 1.00 . A A . 37 GLY CA 1 1 15 7792 1 1 31 GLY H H 20.406 3.537 -2.507 1.00 . A A . 37 GLY H 1 1 15 7793 1 1 31 GLY HA2 H 21.652 4.530 -4.232 1.00 . A A . 37 GLY HA2 1 1 15 7794 1 1 31 GLY HA3 H 21.794 5.988 -3.262 1.00 . A A . 37 GLY HA3 1 1 15 7795 1 1 31 GLY N N 20.815 4.412 -2.343 1.00 . A A . 37 GLY N 1 1 15 7796 1 1 31 GLY O O 23.352 3.536 -2.017 1.00 . A A . 37 GLY O 1 1 15 7797 1 1 31 GLY OXT O 24.212 5.117 -3.278 1.00 . A A . 37 GLY OXT 1 1 15 7798 2 2 1 . C02 C 5.912 5.774 -2.284 1.00 . B A . 1038 D6M C02 1 1 15 7799 2 2 1 . C04 C 3.711 5.466 -1.287 1.00 . B A . 1038 D6M C04 1 1 15 7800 2 2 1 . C05 C 3.420 5.102 0.170 1.00 . B A . 1038 D6M C05 1 1 15 7801 2 2 1 . C06 C 3.288 6.310 1.084 1.00 . B A . 1038 D6M C06 1 1 15 7802 2 2 1 . C07 C 3.058 5.930 2.535 1.00 . B A . 1038 D6M C07 1 1 15 7803 2 2 1 . C09 C 2.590 6.342 -1.838 1.00 . B A . 1038 D6M C09 1 1 15 7804 2 2 1 . C12 C 7.251 6.478 -2.380 1.00 . B A . 1038 D6M C12 1 1 15 7805 2 2 1 . C13 C 8.316 5.623 -3.048 1.00 . B A . 1038 D6M C13 1 1 15 7806 2 2 1 . C14 C 9.539 6.447 -3.417 1.00 . B A . 1038 D6M C14 1 1 15 7807 2 2 1 . C15 C 10.324 6.861 -2.182 1.00 . B A . 1038 D6M C15 1 1 15 7808 2 2 1 . C16 C 11.043 8.186 -2.395 1.00 . B A . 1038 D6M C16 1 1 15 7809 2 2 1 . C17 C 10.531 9.264 -1.448 1.00 . B A . 1038 D6M C17 1 1 15 7810 2 2 1 . C18 C 11.653 9.840 -0.598 1.00 . B A . 1038 D6M C18 1 1 15 7811 2 2 1 . C19 C 11.137 10.335 0.744 1.00 . B A . 1038 D6M C19 1 1 15 7812 2 2 1 . C20 C 10.990 9.197 1.741 1.00 . B A . 1038 D6M C20 1 1 15 7813 2 2 1 . C21 C 12.199 9.098 2.659 1.00 . B A . 1038 D6M C21 1 1 15 7814 2 2 1 . C22 C 11.788 8.878 4.107 1.00 . B A . 1038 D6M C22 1 1 15 7815 2 2 1 . C23 C 12.123 7.471 4.578 1.00 . B A . 1038 D6M C23 1 1 15 7816 2 2 1 . C24 C 13.508 7.406 5.202 1.00 . B A . 1038 D6M C24 1 1 15 7817 2 2 1 . C25 C 13.584 8.227 6.480 1.00 . B A . 1038 D6M C25 1 1 15 7818 2 2 1 . C26 C 13.614 7.347 7.711 1.00 . B A . 1038 D6M C26 1 1 15 7819 2 2 1 . H03 H 5.205 6.874 -0.771 1.00 . B A . 1038 D6M H03 1 1 15 7820 2 2 1 . H04 H 3.764 4.561 -1.872 1.00 . B A . 1038 D6M H04 1 1 15 7821 2 2 1 . HP21 H 7.582 6.728 -1.383 1.00 . B A . 1038 D6M HP21 1 1 15 7822 2 2 1 . HP22 H 7.124 7.384 -2.953 1.00 . B A . 1038 D6M HP22 1 1 15 7823 2 2 1 . HP31 H 7.903 5.186 -3.946 1.00 . B A . 1038 D6M HP31 1 1 15 7824 2 2 1 . HP32 H 8.614 4.839 -2.368 1.00 . B A . 1038 D6M HP32 1 1 15 7825 2 2 1 . HP41 H 9.219 7.334 -3.943 1.00 . B A . 1038 D6M HP41 1 1 15 7826 2 2 1 . HP42 H 10.179 5.857 -4.057 1.00 . B A . 1038 D6M HP42 1 1 15 7827 2 2 1 . HP51 H 11.055 6.098 -1.960 1.00 . B A . 1038 D6M HP51 1 1 15 7828 2 2 1 . HP52 H 9.642 6.961 -1.351 1.00 . B A . 1038 D6M HP52 1 1 15 7829 2 2 1 . HP61 H 10.886 8.511 -3.413 1.00 . B A . 1038 D6M HP61 1 1 15 7830 2 2 1 . HP62 H 12.099 8.041 -2.222 1.00 . B A . 1038 D6M HP62 1 1 15 7831 2 2 1 . HP71 H 9.783 8.834 -0.798 1.00 . B A . 1038 D6M HP71 1 1 15 7832 2 2 1 . HP72 H 10.091 10.059 -2.030 1.00 . B A . 1038 D6M HP72 1 1 15 7833 2 2 1 . HP81 H 12.104 10.666 -1.128 1.00 . B A . 1038 D6M HP81 1 1 15 7834 2 2 1 . HP82 H 12.392 9.072 -0.427 1.00 . B A . 1038 D6M HP82 1 1 15 7835 2 2 1 . HP91 H 10.174 10.801 0.598 1.00 . B A . 1038 D6M HP91 1 1 15 7836 2 2 1 . HP92 H 11.833 11.059 1.140 1.00 . B A . 1038 D6M HP92 1 1 15 7837 2 2 1 . HPA1 H 10.883 8.269 1.199 1.00 . B A . 1038 D6M HPA1 1 1 15 7838 2 2 1 . HPA2 H 10.109 9.369 2.340 1.00 . B A . 1038 D6M HPA2 1 1 15 7839 2 2 1 . HPB1 H 12.766 10.015 2.590 1.00 . B A . 1038 D6M HPB1 1 1 15 7840 2 2 1 . HPB2 H 12.814 8.269 2.340 1.00 . B A . 1038 D6M HPB2 1 1 15 7841 2 2 1 . HPC1 H 10.723 9.034 4.197 1.00 . B A . 1038 D6M HPC1 1 1 15 7842 2 2 1 . HPC2 H 12.310 9.588 4.730 1.00 . B A . 1038 D6M HPC2 1 1 15 7843 2 2 1 . HPD1 H 12.087 6.801 3.731 1.00 . B A . 1038 D6M HPD1 1 1 15 7844 2 2 1 . HPD2 H 11.394 7.165 5.313 1.00 . B A . 1038 D6M HPD2 1 1 15 7845 2 2 1 . HPE1 H 14.229 7.789 4.495 1.00 . B A . 1038 D6M HPE1 1 1 15 7846 2 2 1 . HPE2 H 13.740 6.377 5.433 1.00 . B A . 1038 D6M HPE2 1 1 15 7847 2 2 1 . HPF1 H 12.720 8.873 6.539 1.00 . B A . 1038 D6M HPF1 1 1 15 7848 2 2 1 . HPF2 H 14.484 8.822 6.466 1.00 . B A . 1038 D6M HPF2 1 1 15 7849 2 2 1 . HPG1 H 13.242 6.364 7.460 1.00 . B A . 1038 D6M HPG1 1 1 15 7850 2 2 1 . HPG2 H 12.992 7.781 8.480 1.00 . B A . 1038 D6M HPG2 1 1 15 7851 2 2 1 . HPG3 H 14.629 7.265 8.071 1.00 . B A . 1038 D6M HPG3 1 1 15 7852 2 2 1 . HQ21 H 4.194 6.894 1.021 1.00 . B A . 1038 D6M HQ21 1 1 15 7853 2 2 1 . HQ22 H 2.453 6.907 0.749 1.00 . B A . 1038 D6M HQ22 1 1 15 7854 2 2 1 . HQ31 H 2.497 4.543 0.210 1.00 . B A . 1038 D6M HQ31 1 1 15 7855 2 2 1 . HQ32 H 4.224 4.482 0.541 1.00 . B A . 1038 D6M HQ32 1 1 15 7856 2 2 1 . N03 N 4.999 6.143 -1.390 1.00 . B A . 1038 D6M N03 1 1 15 7857 2 2 1 . O01 O 5.688 4.840 -3.054 1.00 . B A . 1038 D6M O01 1 1 15 7858 2 2 1 . O08 O 2.520 6.755 3.273 1.00 . B A . 1038 D6M O08 1 1 15 7859 2 2 1 . O10 O 2.774 7.577 -1.885 1.00 . B A . 1038 D6M O10 1 1 15 7860 2 2 1 . O11 O 1.538 5.787 -2.217 1.00 . B A . 1038 D6M O11 1 1 16 7861 1 1 1 HIS C C -26.867 -4.248 3.768 1.00 . A A . 7 HIS C 1 1 16 7862 1 1 1 HIS CA C -28.036 -5.178 4.081 1.00 . A A . 7 HIS CA 1 1 16 7863 1 1 1 HIS CB C -28.072 -6.343 3.087 1.00 . A A . 7 HIS CB 1 1 16 7864 1 1 1 HIS CD2 C -27.991 -6.640 0.510 1.00 . A A . 7 HIS CD2 1 1 16 7865 1 1 1 HIS CE1 C -28.231 -4.539 -0.066 1.00 . A A . 7 HIS CE1 1 1 16 7866 1 1 1 HIS CG C -28.098 -5.916 1.650 1.00 . A A . 7 HIS CG 1 1 16 7867 1 1 1 HIS H1 H -29.154 -3.455 4.249 1.00 . A A . 7 HIS H1 1 1 16 7868 1 1 1 HIS H2 H -29.713 -4.554 3.055 1.00 . A A . 7 HIS H2 1 1 16 7869 1 1 1 HIS H3 H -29.974 -4.888 4.715 1.00 . A A . 7 HIS H3 1 1 16 7870 1 1 1 HIS HA H -27.913 -5.570 5.080 1.00 . A A . 7 HIS HA 1 1 16 7871 1 1 1 HIS HB2 H -27.195 -6.957 3.233 1.00 . A A . 7 HIS HB2 1 1 16 7872 1 1 1 HIS HB3 H -28.954 -6.938 3.273 1.00 . A A . 7 HIS HB3 1 1 16 7873 1 1 1 HIS HD1 H -28.349 -3.832 1.849 1.00 . A A . 7 HIS HD1 1 1 16 7874 1 1 1 HIS HD2 H -27.863 -7.711 0.441 1.00 . A A . 7 HIS HD2 1 1 16 7875 1 1 1 HIS HE1 H -28.327 -3.639 -0.656 1.00 . A A . 7 HIS HE1 1 1 16 7876 1 1 1 HIS HE2 H -28.119 -6.008 -1.488 1.00 . A A . 7 HIS HE2 1 1 16 7877 1 1 1 HIS N N -29.336 -4.454 4.019 1.00 . A A . 7 HIS N 1 1 16 7878 1 1 1 HIS ND1 N -28.246 -4.603 1.253 1.00 . A A . 7 HIS ND1 1 1 16 7879 1 1 1 HIS NE2 N -28.077 -5.761 -0.540 1.00 . A A . 7 HIS NE2 1 1 16 7880 1 1 1 HIS O O -27.061 -3.125 3.304 1.00 . A A . 7 HIS O 1 1 16 7881 1 1 2 ALA C C -24.132 -3.890 2.281 1.00 . A A . 8 ALA C 1 1 16 7882 1 1 2 ALA CA C -24.453 -3.936 3.770 1.00 . A A . 8 ALA CA 1 1 16 7883 1 1 2 ALA CB C -23.275 -4.500 4.549 1.00 . A A . 8 ALA CB 1 1 16 7884 1 1 2 ALA H H -25.561 -5.628 4.395 1.00 . A A . 8 ALA H 1 1 16 7885 1 1 2 ALA HA H -24.636 -2.930 4.119 1.00 . A A . 8 ALA HA 1 1 16 7886 1 1 2 ALA HB1 H -23.317 -5.579 4.535 1.00 . A A . 8 ALA HB1 1 1 16 7887 1 1 2 ALA HB2 H -22.352 -4.170 4.096 1.00 . A A . 8 ALA HB2 1 1 16 7888 1 1 2 ALA HB3 H -23.319 -4.152 5.571 1.00 . A A . 8 ALA HB3 1 1 16 7889 1 1 2 ALA N N -25.653 -4.725 4.025 1.00 . A A . 8 ALA N 1 1 16 7890 1 1 2 ALA O O -23.554 -4.828 1.731 1.00 . A A . 8 ALA O 1 1 16 7891 1 1 3 GLU C C -22.802 -2.259 -0.052 1.00 . A A . 9 GLU C 1 1 16 7892 1 1 3 GLU CA C -24.260 -2.625 0.206 1.00 . A A . 9 GLU CA 1 1 16 7893 1 1 3 GLU CB C -25.180 -1.548 -0.372 1.00 . A A . 9 GLU CB 1 1 16 7894 1 1 3 GLU CD C -25.769 0.908 -0.403 1.00 . A A . 9 GLU CD 1 1 16 7895 1 1 3 GLU CG C -25.091 -0.216 0.356 1.00 . A A . 9 GLU CG 1 1 16 7896 1 1 3 GLU H H -24.965 -2.080 2.125 1.00 . A A . 9 GLU H 1 1 16 7897 1 1 3 GLU HA H -24.473 -3.566 -0.280 1.00 . A A . 9 GLU HA 1 1 16 7898 1 1 3 GLU HB2 H -24.921 -1.386 -1.407 1.00 . A A . 9 GLU HB2 1 1 16 7899 1 1 3 GLU HB3 H -26.201 -1.896 -0.316 1.00 . A A . 9 GLU HB3 1 1 16 7900 1 1 3 GLU HG2 H -25.564 -0.315 1.321 1.00 . A A . 9 GLU HG2 1 1 16 7901 1 1 3 GLU HG3 H -24.049 0.037 0.490 1.00 . A A . 9 GLU HG3 1 1 16 7902 1 1 3 GLU N N -24.509 -2.793 1.632 1.00 . A A . 9 GLU N 1 1 16 7903 1 1 3 GLU O O -22.003 -2.161 0.880 1.00 . A A . 9 GLU O 1 1 16 7904 1 1 3 GLU OE1 O -26.615 0.612 -1.272 1.00 . A A . 9 GLU OE1 1 1 16 7905 1 1 3 GLU OE2 O -25.455 2.085 -0.126 1.00 . A A . 9 GLU OE2 1 1 16 7906 1 1 4 GLY C C -20.777 -0.257 -1.388 1.00 . A A . 10 GLY C 1 1 16 7907 1 1 4 GLY CA C -21.098 -1.710 -1.676 1.00 . A A . 10 GLY CA 1 1 16 7908 1 1 4 GLY H H -23.139 -2.154 -2.022 1.00 . A A . 10 GLY H 1 1 16 7909 1 1 4 GLY HA2 H -20.420 -2.335 -1.114 1.00 . A A . 10 GLY HA2 1 1 16 7910 1 1 4 GLY HA3 H -20.953 -1.898 -2.730 1.00 . A A . 10 GLY HA3 1 1 16 7911 1 1 4 GLY N N -22.461 -2.061 -1.321 1.00 . A A . 10 GLY N 1 1 16 7912 1 1 4 GLY O O -21.230 0.639 -2.100 1.00 . A A . 10 GLY O 1 1 16 7913 1 1 5 THR C C -18.438 1.820 -0.814 1.00 . A A . 11 THR C 1 1 16 7914 1 1 5 THR CA C -19.606 1.332 0.036 1.00 . A A . 11 THR CA 1 1 16 7915 1 1 5 THR CB C -19.236 1.386 1.521 1.00 . A A . 11 THR CB 1 1 16 7916 1 1 5 THR CG2 C -20.294 2.049 2.377 1.00 . A A . 11 THR CG2 1 1 16 7917 1 1 5 THR H H -19.659 -0.779 0.185 1.00 . A A . 11 THR H 1 1 16 7918 1 1 5 THR HA H -20.455 1.977 -0.137 1.00 . A A . 11 THR HA 1 1 16 7919 1 1 5 THR HB H -18.320 1.950 1.635 1.00 . A A . 11 THR HB 1 1 16 7920 1 1 5 THR HG1 H -19.863 -0.373 2.114 1.00 . A A . 11 THR HG1 1 1 16 7921 1 1 5 THR HG21 H -20.936 2.652 1.753 1.00 . A A . 11 THR HG21 1 1 16 7922 1 1 5 THR HG22 H -20.883 1.290 2.872 1.00 . A A . 11 THR HG22 1 1 16 7923 1 1 5 THR HG23 H -19.819 2.675 3.117 1.00 . A A . 11 THR HG23 1 1 16 7924 1 1 5 THR N N -19.990 -0.023 -0.343 1.00 . A A . 11 THR N 1 1 16 7925 1 1 5 THR O O -17.764 1.028 -1.474 1.00 . A A . 11 THR O 1 1 16 7926 1 1 5 THR OG1 O -19.021 0.083 2.035 1.00 . A A . 11 THR OG1 1 1 16 7927 1 1 6 PHE C C -16.065 4.346 -0.666 1.00 . A A . 12 PHE C 1 1 16 7928 1 1 6 PHE CA C -17.121 3.720 -1.575 1.00 . A A . 12 PHE CA 1 1 16 7929 1 1 6 PHE CB C -17.674 4.777 -2.533 1.00 . A A . 12 PHE CB 1 1 16 7930 1 1 6 PHE CD1 C -15.678 5.911 -3.545 1.00 . A A . 12 PHE CD1 1 1 16 7931 1 1 6 PHE CD2 C -17.001 4.493 -4.933 1.00 . A A . 12 PHE CD2 1 1 16 7932 1 1 6 PHE CE1 C -14.841 6.179 -4.612 1.00 . A A . 12 PHE CE1 1 1 16 7933 1 1 6 PHE CE2 C -16.168 4.757 -6.003 1.00 . A A . 12 PHE CE2 1 1 16 7934 1 1 6 PHE CG C -16.766 5.066 -3.694 1.00 . A A . 12 PHE CG 1 1 16 7935 1 1 6 PHE CZ C -15.086 5.601 -5.842 1.00 . A A . 12 PHE CZ 1 1 16 7936 1 1 6 PHE H H -18.780 3.709 -0.258 1.00 . A A . 12 PHE H 1 1 16 7937 1 1 6 PHE HA H -16.660 2.933 -2.152 1.00 . A A . 12 PHE HA 1 1 16 7938 1 1 6 PHE HB2 H -18.619 4.436 -2.927 1.00 . A A . 12 PHE HB2 1 1 16 7939 1 1 6 PHE HB3 H -17.826 5.699 -1.991 1.00 . A A . 12 PHE HB3 1 1 16 7940 1 1 6 PHE HD1 H -15.485 6.363 -2.583 1.00 . A A . 12 PHE HD1 1 1 16 7941 1 1 6 PHE HD2 H -17.847 3.834 -5.060 1.00 . A A . 12 PHE HD2 1 1 16 7942 1 1 6 PHE HE1 H -13.996 6.839 -4.483 1.00 . A A . 12 PHE HE1 1 1 16 7943 1 1 6 PHE HE2 H -16.362 4.305 -6.964 1.00 . A A . 12 PHE HE2 1 1 16 7944 1 1 6 PHE HZ H -14.433 5.809 -6.677 1.00 . A A . 12 PHE HZ 1 1 16 7945 1 1 6 PHE N N -18.206 3.128 -0.799 1.00 . A A . 12 PHE N 1 1 16 7946 1 1 6 PHE O O -14.907 4.490 -1.057 1.00 . A A . 12 PHE O 1 1 16 7947 1 1 7 THR C C -14.303 4.487 1.707 1.00 . A A . 13 THR C 1 1 16 7948 1 1 7 THR CA C -15.553 5.343 1.499 1.00 . A A . 13 THR CA 1 1 16 7949 1 1 7 THR CB C -16.255 5.599 2.843 1.00 . A A . 13 THR CB 1 1 16 7950 1 1 7 THR CG2 C -17.325 4.579 3.182 1.00 . A A . 13 THR CG2 1 1 16 7951 1 1 7 THR H H -17.407 4.591 0.796 1.00 . A A . 13 THR H 1 1 16 7952 1 1 7 THR HA H -15.248 6.292 1.083 1.00 . A A . 13 THR HA 1 1 16 7953 1 1 7 THR HB H -16.728 6.570 2.806 1.00 . A A . 13 THR HB 1 1 16 7954 1 1 7 THR HG1 H -14.648 6.268 3.740 1.00 . A A . 13 THR HG1 1 1 16 7955 1 1 7 THR HG21 H -17.179 3.692 2.584 1.00 . A A . 13 THR HG21 1 1 16 7956 1 1 7 THR HG22 H -17.258 4.323 4.229 1.00 . A A . 13 THR HG22 1 1 16 7957 1 1 7 THR HG23 H -18.299 4.997 2.974 1.00 . A A . 13 THR HG23 1 1 16 7958 1 1 7 THR N N -16.471 4.724 0.543 1.00 . A A . 13 THR N 1 1 16 7959 1 1 7 THR O O -13.252 4.764 1.132 1.00 . A A . 13 THR O 1 1 16 7960 1 1 7 THR OG1 O -15.320 5.604 3.908 1.00 . A A . 13 THR OG1 1 1 16 7961 1 1 8 SER C C -13.252 1.400 1.832 1.00 . A A . 14 SER C 1 1 16 7962 1 1 8 SER CA C -13.293 2.568 2.813 1.00 . A A . 14 SER CA 1 1 16 7963 1 1 8 SER CB C -13.373 2.040 4.246 1.00 . A A . 14 SER CB 1 1 16 7964 1 1 8 SER H H -15.280 3.280 2.968 1.00 . A A . 14 SER H 1 1 16 7965 1 1 8 SER HA H -12.386 3.144 2.704 1.00 . A A . 14 SER HA 1 1 16 7966 1 1 8 SER HB2 H -12.889 1.076 4.300 1.00 . A A . 14 SER HB2 1 1 16 7967 1 1 8 SER HB3 H -12.875 2.730 4.910 1.00 . A A . 14 SER HB3 1 1 16 7968 1 1 8 SER HG H -14.757 1.868 5.622 1.00 . A A . 14 SER HG 1 1 16 7969 1 1 8 SER N N -14.420 3.452 2.534 1.00 . A A . 14 SER N 1 1 16 7970 1 1 8 SER O O -12.180 0.904 1.486 1.00 . A A . 14 SER O 1 1 16 7971 1 1 8 SER OG O -14.720 1.896 4.663 1.00 . A A . 14 SER OG 1 1 16 7972 1 1 9 ASP C C -13.685 0.081 -0.791 1.00 . A A . 15 ASP C 1 1 16 7973 1 1 9 ASP CA C -14.530 -0.155 0.460 1.00 . A A . 15 ASP CA 1 1 16 7974 1 1 9 ASP CB C -15.992 -0.382 0.066 1.00 . A A . 15 ASP CB 1 1 16 7975 1 1 9 ASP CG C -16.555 -1.665 0.646 1.00 . A A . 15 ASP CG 1 1 16 7976 1 1 9 ASP H H -15.247 1.394 1.712 1.00 . A A . 15 ASP H 1 1 16 7977 1 1 9 ASP HA H -14.164 -1.038 0.962 1.00 . A A . 15 ASP HA 1 1 16 7978 1 1 9 ASP HB2 H -16.587 0.444 0.426 1.00 . A A . 15 ASP HB2 1 1 16 7979 1 1 9 ASP HB3 H -16.067 -0.432 -1.010 1.00 . A A . 15 ASP HB3 1 1 16 7980 1 1 9 ASP N N -14.427 0.961 1.394 1.00 . A A . 15 ASP N 1 1 16 7981 1 1 9 ASP O O -13.247 -0.868 -1.440 1.00 . A A . 15 ASP O 1 1 16 7982 1 1 9 ASP OD1 O -15.766 -2.602 0.890 1.00 . A A . 15 ASP OD1 1 1 16 7983 1 1 9 ASP OD2 O -17.784 -1.733 0.855 1.00 . A A . 15 ASP OD2 1 1 16 7984 1 1 10 VAL C C -11.188 1.456 -2.073 1.00 . A A . 16 VAL C 1 1 16 7985 1 1 10 VAL CA C -12.678 1.693 -2.307 1.00 . A A . 16 VAL CA 1 1 16 7986 1 1 10 VAL CB C -12.905 3.160 -2.731 1.00 . A A . 16 VAL CB 1 1 16 7987 1 1 10 VAL CG1 C -12.290 4.123 -1.725 1.00 . A A . 16 VAL CG1 1 1 16 7988 1 1 10 VAL CG2 C -12.345 3.404 -4.124 1.00 . A A . 16 VAL CG2 1 1 16 7989 1 1 10 VAL H H -13.843 2.064 -0.578 1.00 . A A . 16 VAL H 1 1 16 7990 1 1 10 VAL HA H -13.005 1.056 -3.117 1.00 . A A . 16 VAL HA 1 1 16 7991 1 1 10 VAL HB H -13.970 3.343 -2.760 1.00 . A A . 16 VAL HB 1 1 16 7992 1 1 10 VAL HG11 H -12.554 3.815 -0.725 1.00 . A A . 16 VAL HG11 1 1 16 7993 1 1 10 VAL HG12 H -11.215 4.117 -1.832 1.00 . A A . 16 VAL HG12 1 1 16 7994 1 1 10 VAL HG13 H -12.664 5.120 -1.905 1.00 . A A . 16 VAL HG13 1 1 16 7995 1 1 10 VAL HG21 H -12.692 2.629 -4.792 1.00 . A A . 16 VAL HG21 1 1 16 7996 1 1 10 VAL HG22 H -12.679 4.366 -4.483 1.00 . A A . 16 VAL HG22 1 1 16 7997 1 1 10 VAL HG23 H -11.266 3.389 -4.085 1.00 . A A . 16 VAL HG23 1 1 16 7998 1 1 10 VAL N N -13.465 1.348 -1.129 1.00 . A A . 16 VAL N 1 1 16 7999 1 1 10 VAL O O -10.507 0.867 -2.908 1.00 . A A . 16 VAL O 1 1 16 8000 1 1 11 SER C C -8.886 0.280 -0.532 1.00 . A A . 17 SER C 1 1 16 8001 1 1 11 SER CA C -9.276 1.756 -0.597 1.00 . A A . 17 SER CA 1 1 16 8002 1 1 11 SER CB C -8.970 2.434 0.740 1.00 . A A . 17 SER CB 1 1 16 8003 1 1 11 SER H H -11.277 2.381 -0.303 1.00 . A A . 17 SER H 1 1 16 8004 1 1 11 SER HA H -8.695 2.234 -1.371 1.00 . A A . 17 SER HA 1 1 16 8005 1 1 11 SER HB2 H -8.124 1.948 1.203 1.00 . A A . 17 SER HB2 1 1 16 8006 1 1 11 SER HB3 H -8.737 3.475 0.568 1.00 . A A . 17 SER HB3 1 1 16 8007 1 1 11 SER HG H -10.182 3.188 2.082 1.00 . A A . 17 SER HG 1 1 16 8008 1 1 11 SER N N -10.686 1.919 -0.933 1.00 . A A . 17 SER N 1 1 16 8009 1 1 11 SER O O -7.707 -0.063 -0.619 1.00 . A A . 17 SER O 1 1 16 8010 1 1 11 SER OG O -10.079 2.354 1.619 1.00 . A A . 17 SER OG 1 1 16 8011 1 1 12 SER C C -9.080 -2.584 -1.590 1.00 . A A . 18 SER C 1 1 16 8012 1 1 12 SER CA C -9.637 -2.023 -0.282 1.00 . A A . 18 SER CA 1 1 16 8013 1 1 12 SER CB C -10.927 -2.757 0.087 1.00 . A A . 18 SER CB 1 1 16 8014 1 1 12 SER H H -10.799 -0.256 -0.300 1.00 . A A . 18 SER H 1 1 16 8015 1 1 12 SER HA H -8.910 -2.185 0.499 1.00 . A A . 18 SER HA 1 1 16 8016 1 1 12 SER HB2 H -11.775 -2.200 -0.283 1.00 . A A . 18 SER HB2 1 1 16 8017 1 1 12 SER HB3 H -10.920 -3.741 -0.359 1.00 . A A . 18 SER HB3 1 1 16 8018 1 1 12 SER HG H -10.816 -2.066 1.917 1.00 . A A . 18 SER HG 1 1 16 8019 1 1 12 SER N N -9.881 -0.588 -0.370 1.00 . A A . 18 SER N 1 1 16 8020 1 1 12 SER O O -8.084 -3.307 -1.587 1.00 . A A . 18 SER O 1 1 16 8021 1 1 12 SER OG O -11.052 -2.894 1.492 1.00 . A A . 18 SER OG 1 1 16 8022 1 1 13 TYR C C -7.868 -2.331 -4.324 1.00 . A A . 19 TYR C 1 1 16 8023 1 1 13 TYR CA C -9.301 -2.762 -4.006 1.00 . A A . 19 TYR CA 1 1 16 8024 1 1 13 TYR CB C -10.270 -2.304 -5.110 1.00 . A A . 19 TYR CB 1 1 16 8025 1 1 13 TYR CD1 C -8.864 -0.868 -6.649 1.00 . A A . 19 TYR CD1 1 1 16 8026 1 1 13 TYR CD2 C -10.667 0.165 -5.481 1.00 . A A . 19 TYR CD2 1 1 16 8027 1 1 13 TYR CE1 C -8.553 0.339 -7.245 1.00 . A A . 19 TYR CE1 1 1 16 8028 1 1 13 TYR CE2 C -10.361 1.376 -6.072 1.00 . A A . 19 TYR CE2 1 1 16 8029 1 1 13 TYR CG C -9.925 -0.976 -5.757 1.00 . A A . 19 TYR CG 1 1 16 8030 1 1 13 TYR CZ C -9.303 1.458 -6.953 1.00 . A A . 19 TYR CZ 1 1 16 8031 1 1 13 TYR H H -10.530 -1.696 -2.647 1.00 . A A . 19 TYR H 1 1 16 8032 1 1 13 TYR HA H -9.323 -3.840 -3.959 1.00 . A A . 19 TYR HA 1 1 16 8033 1 1 13 TYR HB2 H -10.286 -3.050 -5.890 1.00 . A A . 19 TYR HB2 1 1 16 8034 1 1 13 TYR HB3 H -11.261 -2.218 -4.688 1.00 . A A . 19 TYR HB3 1 1 16 8035 1 1 13 TYR HD1 H -8.277 -1.746 -6.874 1.00 . A A . 19 TYR HD1 1 1 16 8036 1 1 13 TYR HD2 H -11.494 0.099 -4.790 1.00 . A A . 19 TYR HD2 1 1 16 8037 1 1 13 TYR HE1 H -7.725 0.403 -7.935 1.00 . A A . 19 TYR HE1 1 1 16 8038 1 1 13 TYR HE2 H -10.949 2.253 -5.843 1.00 . A A . 19 TYR HE2 1 1 16 8039 1 1 13 TYR HH H -9.097 3.369 -6.903 1.00 . A A . 19 TYR HH 1 1 16 8040 1 1 13 TYR N N -9.734 -2.265 -2.703 1.00 . A A . 19 TYR N 1 1 16 8041 1 1 13 TYR O O -7.194 -2.956 -5.142 1.00 . A A . 19 TYR O 1 1 16 8042 1 1 13 TYR OH O -8.997 2.662 -7.545 1.00 . A A . 19 TYR OH 1 1 16 8043 1 1 14 LEU C C -5.033 -1.593 -3.128 1.00 . A A . 20 LEU C 1 1 16 8044 1 1 14 LEU CA C -6.055 -0.768 -3.903 1.00 . A A . 20 LEU CA 1 1 16 8045 1 1 14 LEU CB C -5.952 0.703 -3.496 1.00 . A A . 20 LEU CB 1 1 16 8046 1 1 14 LEU CD1 C -7.989 2.140 -3.760 1.00 . A A . 20 LEU CD1 1 1 16 8047 1 1 14 LEU CD2 C -5.812 2.875 -4.747 1.00 . A A . 20 LEU CD2 1 1 16 8048 1 1 14 LEU CG C -6.694 1.681 -4.411 1.00 . A A . 20 LEU CG 1 1 16 8049 1 1 14 LEU H H -7.987 -0.805 -3.035 1.00 . A A . 20 LEU H 1 1 16 8050 1 1 14 LEU HA H -5.843 -0.855 -4.958 1.00 . A A . 20 LEU HA 1 1 16 8051 1 1 14 LEU HB2 H -6.345 0.806 -2.495 1.00 . A A . 20 LEU HB2 1 1 16 8052 1 1 14 LEU HB3 H -4.908 0.978 -3.484 1.00 . A A . 20 LEU HB3 1 1 16 8053 1 1 14 LEU HD11 H -8.382 1.344 -3.144 1.00 . A A . 20 LEU HD11 1 1 16 8054 1 1 14 LEU HD12 H -7.795 3.008 -3.146 1.00 . A A . 20 LEU HD12 1 1 16 8055 1 1 14 LEU HD13 H -8.708 2.392 -4.525 1.00 . A A . 20 LEU HD13 1 1 16 8056 1 1 14 LEU HD21 H -5.343 3.241 -3.846 1.00 . A A . 20 LEU HD21 1 1 16 8057 1 1 14 LEU HD22 H -5.052 2.573 -5.452 1.00 . A A . 20 LEU HD22 1 1 16 8058 1 1 14 LEU HD23 H -6.416 3.657 -5.182 1.00 . A A . 20 LEU HD23 1 1 16 8059 1 1 14 LEU HG H -6.946 1.179 -5.334 1.00 . A A . 20 LEU HG 1 1 16 8060 1 1 14 LEU N N -7.407 -1.266 -3.677 1.00 . A A . 20 LEU N 1 1 16 8061 1 1 14 LEU O O -5.155 -1.773 -1.917 1.00 . A A . 20 LEU O 1 1 16 8062 1 1 15 GLU C C -1.747 -2.970 -4.115 1.00 . A A . 21 GLU C 1 1 16 8063 1 1 15 GLU CA C -2.979 -2.896 -3.217 1.00 . A A . 21 GLU CA 1 1 16 8064 1 1 15 GLU CB C -3.499 -4.304 -2.921 1.00 . A A . 21 GLU CB 1 1 16 8065 1 1 15 GLU CD C -3.619 -6.450 -4.249 1.00 . A A . 21 GLU CD 1 1 16 8066 1 1 15 GLU CG C -4.073 -5.008 -4.140 1.00 . A A . 21 GLU CG 1 1 16 8067 1 1 15 GLU H H -3.982 -1.911 -4.799 1.00 . A A . 21 GLU H 1 1 16 8068 1 1 15 GLU HA H -2.703 -2.421 -2.287 1.00 . A A . 21 GLU HA 1 1 16 8069 1 1 15 GLU HB2 H -2.686 -4.902 -2.536 1.00 . A A . 21 GLU HB2 1 1 16 8070 1 1 15 GLU HB3 H -4.273 -4.239 -2.171 1.00 . A A . 21 GLU HB3 1 1 16 8071 1 1 15 GLU HG2 H -5.151 -4.990 -4.075 1.00 . A A . 21 GLU HG2 1 1 16 8072 1 1 15 GLU HG3 H -3.758 -4.478 -5.027 1.00 . A A . 21 GLU HG3 1 1 16 8073 1 1 15 GLU N N -4.024 -2.090 -3.836 1.00 . A A . 21 GLU N 1 1 16 8074 1 1 15 GLU O O -1.280 -4.056 -4.459 1.00 . A A . 21 GLU O 1 1 16 8075 1 1 15 GLU OE1 O -3.719 -7.182 -3.242 1.00 . A A . 21 GLU OE1 1 1 16 8076 1 1 15 GLU OE2 O -3.163 -6.848 -5.342 1.00 . A A . 21 GLU OE2 1 1 16 8077 1 1 16 GLY C C 1.003 -0.806 -4.827 1.00 . A A . 22 GLY C 1 1 16 8078 1 1 16 GLY CA C -0.054 -1.761 -5.346 1.00 . A A . 22 GLY CA 1 1 16 8079 1 1 16 GLY H H -1.641 -0.973 -4.187 1.00 . A A . 22 GLY H 1 1 16 8080 1 1 16 GLY HA2 H 0.372 -2.751 -5.410 1.00 . A A . 22 GLY HA2 1 1 16 8081 1 1 16 GLY HA3 H -0.354 -1.445 -6.334 1.00 . A A . 22 GLY HA3 1 1 16 8082 1 1 16 GLY N N -1.226 -1.807 -4.491 1.00 . A A . 22 GLY N 1 1 16 8083 1 1 16 GLY O O 2.170 -1.174 -4.693 1.00 . A A . 22 GLY O 1 1 16 8084 1 1 17 GLN C C 1.810 1.209 -2.546 1.00 . A A . 23 GLN C 1 1 16 8085 1 1 17 GLN CA C 1.513 1.436 -4.026 1.00 . A A . 23 GLN CA 1 1 16 8086 1 1 17 GLN CB C 0.930 2.835 -4.234 1.00 . A A . 23 GLN CB 1 1 16 8087 1 1 17 GLN CD C 2.498 4.650 -3.440 1.00 . A A . 23 GLN CD 1 1 16 8088 1 1 17 GLN CG C 1.969 3.872 -4.629 1.00 . A A . 23 GLN CG 1 1 16 8089 1 1 17 GLN H H -0.350 0.657 -4.662 1.00 . A A . 23 GLN H 1 1 16 8090 1 1 17 GLN HA H 2.434 1.354 -4.582 1.00 . A A . 23 GLN HA 1 1 16 8091 1 1 17 GLN HB2 H 0.184 2.790 -5.012 1.00 . A A . 23 GLN HB2 1 1 16 8092 1 1 17 GLN HB3 H 0.461 3.158 -3.316 1.00 . A A . 23 GLN HB3 1 1 16 8093 1 1 17 GLN HE21 H 4.256 3.734 -3.591 1.00 . A A . 23 GLN HE21 1 1 16 8094 1 1 17 GLN HE22 H 4.118 4.887 -2.312 1.00 . A A . 23 GLN HE22 1 1 16 8095 1 1 17 GLN HG2 H 2.796 3.370 -5.107 1.00 . A A . 23 GLN HG2 1 1 16 8096 1 1 17 GLN HG3 H 1.519 4.566 -5.324 1.00 . A A . 23 GLN HG3 1 1 16 8097 1 1 17 GLN N N 0.593 0.424 -4.534 1.00 . A A . 23 GLN N 1 1 16 8098 1 1 17 GLN NE2 N 3.750 4.398 -3.078 1.00 . A A . 23 GLN NE2 1 1 16 8099 1 1 17 GLN O O 2.871 1.591 -2.052 1.00 . A A . 23 GLN O 1 1 16 8100 1 1 17 GLN OE1 O 1.789 5.468 -2.853 1.00 . A A . 23 GLN OE1 1 1 16 8101 1 1 18 ALA C C 2.299 -0.498 -0.158 1.00 . A A . 24 ALA C 1 1 16 8102 1 1 18 ALA CA C 1.031 0.308 -0.422 1.00 . A A . 24 ALA CA 1 1 16 8103 1 1 18 ALA CB C -0.186 -0.431 0.113 1.00 . A A . 24 ALA CB 1 1 16 8104 1 1 18 ALA H H 0.044 0.305 -2.294 1.00 . A A . 24 ALA H 1 1 16 8105 1 1 18 ALA HA H 1.104 1.254 0.096 1.00 . A A . 24 ALA HA 1 1 16 8106 1 1 18 ALA HB1 H -1.083 0.100 -0.171 1.00 . A A . 24 ALA HB1 1 1 16 8107 1 1 18 ALA HB2 H -0.212 -1.428 -0.301 1.00 . A A . 24 ALA HB2 1 1 16 8108 1 1 18 ALA HB3 H -0.128 -0.489 1.190 1.00 . A A . 24 ALA HB3 1 1 16 8109 1 1 18 ALA N N 0.868 0.586 -1.844 1.00 . A A . 24 ALA N 1 1 16 8110 1 1 18 ALA O O 2.881 -0.422 0.924 1.00 . A A . 24 ALA O 1 1 16 8111 1 1 19 ALA C C 5.172 -1.222 -0.928 1.00 . A A . 25 ALA C 1 1 16 8112 1 1 19 ALA CA C 3.922 -2.089 -1.028 1.00 . A A . 25 ALA CA 1 1 16 8113 1 1 19 ALA CB C 4.034 -3.045 -2.206 1.00 . A A . 25 ALA CB 1 1 16 8114 1 1 19 ALA H H 2.218 -1.289 -1.993 1.00 . A A . 25 ALA H 1 1 16 8115 1 1 19 ALA HA H 3.832 -2.676 -0.126 1.00 . A A . 25 ALA HA 1 1 16 8116 1 1 19 ALA HB1 H 3.046 -3.363 -2.506 1.00 . A A . 25 ALA HB1 1 1 16 8117 1 1 19 ALA HB2 H 4.517 -2.544 -3.032 1.00 . A A . 25 ALA HB2 1 1 16 8118 1 1 19 ALA HB3 H 4.616 -3.907 -1.916 1.00 . A A . 25 ALA HB3 1 1 16 8119 1 1 19 ALA N N 2.723 -1.270 -1.154 1.00 . A A . 25 ALA N 1 1 16 8120 1 1 19 ALA O O 5.991 -1.398 -0.028 1.00 . A A . 25 ALA O 1 1 16 8121 1 1 20 LYS C C 6.787 1.164 -0.498 1.00 . A A . 26 LYS C 1 1 16 8122 1 1 20 LYS CA C 6.464 0.619 -1.888 1.00 . A A . 26 LYS CA 1 1 16 8123 1 1 20 LYS CB C 6.203 1.780 -2.849 1.00 . A A . 26 LYS CB 1 1 16 8124 1 1 20 LYS CD C 7.512 1.409 -4.963 1.00 . A A . 26 LYS CD 1 1 16 8125 1 1 20 LYS CE C 7.803 0.139 -5.746 1.00 . A A . 26 LYS CE 1 1 16 8126 1 1 20 LYS CG C 6.140 1.359 -4.308 1.00 . A A . 26 LYS CG 1 1 16 8127 1 1 20 LYS HA H 7.314 0.057 -2.245 1.00 . A A . 26 LYS HA 1 1 16 8128 1 1 20 LYS HB2 H 5.263 2.243 -2.590 1.00 . A A . 26 LYS HB2 1 1 16 8129 1 1 20 LYS HD2 H 7.548 2.252 -5.638 1.00 . A A . 26 LYS HD2 1 1 16 8130 1 1 20 LYS HE2 H 7.171 0.118 -6.621 1.00 . A A . 26 LYS HE2 1 1 16 8131 1 1 20 LYS HG2 H 5.762 0.349 -4.365 1.00 . A A . 26 LYS HG2 1 1 16 8132 1 1 20 LYS HZ1 H 7.555 -0.967 -3.976 1.00 . A A . 26 LYS HZ1 1 1 16 8133 1 1 20 LYS N N 5.312 -0.282 -1.861 1.00 . A A . 26 LYS N 1 1 16 8134 1 1 20 LYS NZ N 7.553 -1.060 -4.951 1.00 . A A . 26 LYS NZ 1 1 16 8135 1 1 20 LYS O O 7.934 1.498 -0.207 1.00 . A A . 26 LYS O 1 1 16 8136 1 1 21 GLU C C 7.193 1.180 2.382 1.00 . A A . 27 GLU C 1 1 16 8137 1 1 21 GLU CA C 5.946 1.763 1.715 1.00 . A A . 27 GLU CA 1 1 16 8138 1 1 21 GLU CB C 4.712 1.445 2.561 1.00 . A A . 27 GLU CB 1 1 16 8139 1 1 21 GLU CD C 2.835 2.780 3.600 1.00 . A A . 27 GLU CD 1 1 16 8140 1 1 21 GLU CG C 3.547 2.392 2.319 1.00 . A A . 27 GLU CG 1 1 16 8141 1 1 21 GLU H H 4.877 0.975 0.065 1.00 . A A . 27 GLU H 1 1 16 8142 1 1 21 GLU HA H 6.057 2.834 1.652 1.00 . A A . 27 GLU HA 1 1 16 8143 1 1 21 GLU HB2 H 4.384 0.441 2.337 1.00 . A A . 27 GLU HB2 1 1 16 8144 1 1 21 GLU HB3 H 4.982 1.502 3.605 1.00 . A A . 27 GLU HB3 1 1 16 8145 1 1 21 GLU HG2 H 3.921 3.288 1.847 1.00 . A A . 27 GLU HG2 1 1 16 8146 1 1 21 GLU HG3 H 2.839 1.909 1.662 1.00 . A A . 27 GLU HG3 1 1 16 8147 1 1 21 GLU N N 5.770 1.253 0.356 1.00 . A A . 27 GLU N 1 1 16 8148 1 1 21 GLU O O 7.801 1.820 3.241 1.00 . A A . 27 GLU O 1 1 16 8149 1 1 21 GLU OE1 O 3.460 3.455 4.445 1.00 . A A . 27 GLU OE1 1 1 16 8150 1 1 21 GLU OE2 O 1.653 2.409 3.758 1.00 . A A . 27 GLU OE2 1 1 16 8151 1 1 22 PHE C C 10.018 0.080 2.228 1.00 . A A . 28 PHE C 1 1 16 8152 1 1 22 PHE CA C 8.741 -0.689 2.562 1.00 . A A . 28 PHE CA 1 1 16 8153 1 1 22 PHE CB C 8.841 -2.144 2.075 1.00 . A A . 28 PHE CB 1 1 16 8154 1 1 22 PHE CD1 C 10.850 -2.169 0.560 1.00 . A A . 28 PHE CD1 1 1 16 8155 1 1 22 PHE CD2 C 8.708 -2.612 -0.391 1.00 . A A . 28 PHE CD2 1 1 16 8156 1 1 22 PHE CE1 C 11.437 -2.325 -0.682 1.00 . A A . 28 PHE CE1 1 1 16 8157 1 1 22 PHE CE2 C 9.290 -2.769 -1.635 1.00 . A A . 28 PHE CE2 1 1 16 8158 1 1 22 PHE CG C 9.479 -2.310 0.720 1.00 . A A . 28 PHE CG 1 1 16 8159 1 1 22 PHE CZ C 10.656 -2.624 -1.781 1.00 . A A . 28 PHE CZ 1 1 16 8160 1 1 22 PHE H H 7.046 -0.501 1.304 1.00 . A A . 28 PHE H 1 1 16 8161 1 1 22 PHE HA H 8.617 -0.692 3.635 1.00 . A A . 28 PHE HA 1 1 16 8162 1 1 22 PHE HB2 H 9.427 -2.709 2.783 1.00 . A A . 28 PHE HB2 1 1 16 8163 1 1 22 PHE HB3 H 7.847 -2.565 2.027 1.00 . A A . 28 PHE HB3 1 1 16 8164 1 1 22 PHE HD1 H 11.462 -1.935 1.418 1.00 . A A . 28 PHE HD1 1 1 16 8165 1 1 22 PHE HD2 H 7.642 -2.728 -0.280 1.00 . A A . 28 PHE HD2 1 1 16 8166 1 1 22 PHE HE1 H 12.506 -2.212 -0.792 1.00 . A A . 28 PHE HE1 1 1 16 8167 1 1 22 PHE HE2 H 8.676 -3.003 -2.493 1.00 . A A . 28 PHE HE2 1 1 16 8168 1 1 22 PHE HZ H 11.112 -2.746 -2.753 1.00 . A A . 28 PHE HZ 1 1 16 8169 1 1 22 PHE N N 7.569 -0.035 1.989 1.00 . A A . 28 PHE N 1 1 16 8170 1 1 22 PHE O O 10.894 0.244 3.076 1.00 . A A . 28 PHE O 1 1 16 8171 1 1 23 ILE C C 11.660 2.396 1.532 1.00 . A A . 29 ILE C 1 1 16 8172 1 1 23 ILE CA C 11.293 1.292 0.542 1.00 . A A . 29 ILE CA 1 1 16 8173 1 1 23 ILE CB C 11.072 1.911 -0.856 1.00 . A A . 29 ILE CB 1 1 16 8174 1 1 23 ILE CD1 C 12.281 2.934 -2.848 1.00 . A A . 29 ILE CD1 1 1 16 8175 1 1 23 ILE CG1 C 12.399 2.405 -1.435 1.00 . A A . 29 ILE CG1 1 1 16 8176 1 1 23 ILE CG2 C 10.059 3.048 -0.792 1.00 . A A . 29 ILE CG2 1 1 16 8177 1 1 23 ILE H H 9.390 0.381 0.353 1.00 . A A . 29 ILE H 1 1 16 8178 1 1 23 ILE HA H 12.119 0.598 0.475 1.00 . A A . 29 ILE HA 1 1 16 8179 1 1 23 ILE HB H 10.671 1.145 -1.502 1.00 . A A . 29 ILE HB 1 1 16 8180 1 1 23 ILE HD11 H 11.251 3.184 -3.053 1.00 . A A . 29 ILE HD11 1 1 16 8181 1 1 23 ILE HD12 H 12.894 3.817 -2.954 1.00 . A A . 29 ILE HD12 1 1 16 8182 1 1 23 ILE HD13 H 12.614 2.179 -3.544 1.00 . A A . 29 ILE HD13 1 1 16 8183 1 1 23 ILE HG12 H 12.781 3.202 -0.814 1.00 . A A . 29 ILE HG12 1 1 16 8184 1 1 23 ILE HG13 H 13.107 1.589 -1.443 1.00 . A A . 29 ILE HG13 1 1 16 8185 1 1 23 ILE HG21 H 9.547 3.021 0.158 1.00 . A A . 29 ILE HG21 1 1 16 8186 1 1 23 ILE HG22 H 10.571 3.993 -0.898 1.00 . A A . 29 ILE HG22 1 1 16 8187 1 1 23 ILE HG23 H 9.342 2.935 -1.591 1.00 . A A . 29 ILE HG23 1 1 16 8188 1 1 23 ILE N N 10.120 0.546 0.986 1.00 . A A . 29 ILE N 1 1 16 8189 1 1 23 ILE O O 12.828 2.757 1.669 1.00 . A A . 29 ILE O 1 1 16 8190 1 1 24 ALA C C 11.626 3.467 4.420 1.00 . A A . 30 ALA C 1 1 16 8191 1 1 24 ALA CA C 10.870 3.983 3.199 1.00 . A A . 30 ALA CA 1 1 16 8192 1 1 24 ALA CB C 9.540 4.590 3.619 1.00 . A A . 30 ALA CB 1 1 16 8193 1 1 24 ALA H H 9.745 2.592 2.070 1.00 . A A . 30 ALA H 1 1 16 8194 1 1 24 ALA HA H 11.458 4.757 2.726 1.00 . A A . 30 ALA HA 1 1 16 8195 1 1 24 ALA HB1 H 8.797 4.387 2.862 1.00 . A A . 30 ALA HB1 1 1 16 8196 1 1 24 ALA HB2 H 9.227 4.157 4.557 1.00 . A A . 30 ALA HB2 1 1 16 8197 1 1 24 ALA HB3 H 9.653 5.658 3.735 1.00 . A A . 30 ALA HB3 1 1 16 8198 1 1 24 ALA N N 10.655 2.923 2.222 1.00 . A A . 30 ALA N 1 1 16 8199 1 1 24 ALA O O 12.312 4.227 5.103 1.00 . A A . 30 ALA O 1 1 16 8200 1 1 25 TRP C C 13.675 1.472 5.596 1.00 . A A . 31 TRP C 1 1 16 8201 1 1 25 TRP CA C 12.166 1.562 5.834 1.00 . A A . 31 TRP CA 1 1 16 8202 1 1 25 TRP CB C 11.563 0.174 6.125 1.00 . A A . 31 TRP CB 1 1 16 8203 1 1 25 TRP CD1 C 13.611 -1.151 6.927 1.00 . A A . 31 TRP CD1 1 1 16 8204 1 1 25 TRP CD2 C 12.568 -2.051 5.162 1.00 . A A . 31 TRP CD2 1 1 16 8205 1 1 25 TRP CE2 C 13.668 -2.862 5.496 1.00 . A A . 31 TRP CE2 1 1 16 8206 1 1 25 TRP CE3 C 11.761 -2.423 4.082 1.00 . A A . 31 TRP CE3 1 1 16 8207 1 1 25 TRP CG C 12.550 -0.959 6.088 1.00 . A A . 31 TRP CG 1 1 16 8208 1 1 25 TRP CH2 C 13.176 -4.359 3.738 1.00 . A A . 31 TRP CH2 1 1 16 8209 1 1 25 TRP CZ2 C 13.982 -4.019 4.789 1.00 . A A . 31 TRP CZ2 1 1 16 8210 1 1 25 TRP CZ3 C 12.073 -3.573 3.382 1.00 . A A . 31 TRP CZ3 1 1 16 8211 1 1 25 TRP H H 10.934 1.614 4.114 1.00 . A A . 31 TRP H 1 1 16 8212 1 1 25 TRP HA H 11.995 2.200 6.689 1.00 . A A . 31 TRP HA 1 1 16 8213 1 1 25 TRP HB2 H 11.116 0.186 7.108 1.00 . A A . 31 TRP HB2 1 1 16 8214 1 1 25 TRP HB3 H 10.794 -0.032 5.394 1.00 . A A . 31 TRP HB3 1 1 16 8215 1 1 25 TRP HD1 H 13.869 -0.490 7.742 1.00 . A A . 31 TRP HD1 1 1 16 8216 1 1 25 TRP HE1 H 15.088 -2.640 7.024 1.00 . A A . 31 TRP HE1 1 1 16 8217 1 1 25 TRP HE3 H 10.906 -1.830 3.794 1.00 . A A . 31 TRP HE3 1 1 16 8218 1 1 25 TRP HH2 H 13.383 -5.249 3.163 1.00 . A A . 31 TRP HH2 1 1 16 8219 1 1 25 TRP HZ2 H 14.829 -4.635 5.049 1.00 . A A . 31 TRP HZ2 1 1 16 8220 1 1 25 TRP HZ3 H 11.461 -3.875 2.545 1.00 . A A . 31 TRP HZ3 1 1 16 8221 1 1 25 TRP N N 11.495 2.172 4.692 1.00 . A A . 31 TRP N 1 1 16 8222 1 1 25 TRP NE1 N 14.290 -2.291 6.575 1.00 . A A . 31 TRP NE1 1 1 16 8223 1 1 25 TRP O O 14.466 2.029 6.357 1.00 . A A . 31 TRP O 1 1 16 8224 1 1 26 LEU C C 16.154 1.946 3.981 1.00 . A A . 32 LEU C 1 1 16 8225 1 1 26 LEU CA C 15.479 0.597 4.217 1.00 . A A . 32 LEU CA 1 1 16 8226 1 1 26 LEU CB C 15.648 -0.304 2.989 1.00 . A A . 32 LEU CB 1 1 16 8227 1 1 26 LEU CD1 C 15.439 0.859 0.779 1.00 . A A . 32 LEU CD1 1 1 16 8228 1 1 26 LEU CD2 C 14.209 -1.280 1.184 1.00 . A A . 32 LEU CD2 1 1 16 8229 1 1 26 LEU CG C 14.720 0.007 1.813 1.00 . A A . 32 LEU CG 1 1 16 8230 1 1 26 LEU H H 13.391 0.335 3.976 1.00 . A A . 32 LEU H 1 1 16 8231 1 1 26 LEU HA H 15.953 0.121 5.063 1.00 . A A . 32 LEU HA 1 1 16 8232 1 1 26 LEU HB2 H 16.669 -0.219 2.647 1.00 . A A . 32 LEU HB2 1 1 16 8233 1 1 26 LEU HB3 H 15.474 -1.325 3.294 1.00 . A A . 32 LEU HB3 1 1 16 8234 1 1 26 LEU HD11 H 16.027 1.613 1.280 1.00 . A A . 32 LEU HD11 1 1 16 8235 1 1 26 LEU HD12 H 16.087 0.233 0.185 1.00 . A A . 32 LEU HD12 1 1 16 8236 1 1 26 LEU HD13 H 14.712 1.336 0.138 1.00 . A A . 32 LEU HD13 1 1 16 8237 1 1 26 LEU HD21 H 15.025 -1.980 1.082 1.00 . A A . 32 LEU HD21 1 1 16 8238 1 1 26 LEU HD22 H 13.442 -1.709 1.812 1.00 . A A . 32 LEU HD22 1 1 16 8239 1 1 26 LEU HD23 H 13.796 -1.065 0.209 1.00 . A A . 32 LEU HD23 1 1 16 8240 1 1 26 LEU HG H 13.869 0.565 2.172 1.00 . A A . 32 LEU HG 1 1 16 8241 1 1 26 LEU N N 14.066 0.763 4.542 1.00 . A A . 32 LEU N 1 1 16 8242 1 1 26 LEU O O 17.282 2.168 4.420 1.00 . A A . 32 LEU O 1 1 16 8243 1 1 27 VAL C C 16.275 4.933 4.308 1.00 . A A . 33 VAL C 1 1 16 8244 1 1 27 VAL CA C 16.005 4.172 3.012 1.00 . A A . 33 VAL CA 1 1 16 8245 1 1 27 VAL CB C 15.051 5.001 2.125 1.00 . A A . 33 VAL CB 1 1 16 8246 1 1 27 VAL CG1 C 15.582 6.414 1.928 1.00 . A A . 33 VAL CG1 1 1 16 8247 1 1 27 VAL CG2 C 14.842 4.316 0.783 1.00 . A A . 33 VAL CG2 1 1 16 8248 1 1 27 VAL H H 14.564 2.618 2.969 1.00 . A A . 33 VAL H 1 1 16 8249 1 1 27 VAL HA H 16.937 4.043 2.481 1.00 . A A . 33 VAL HA 1 1 16 8250 1 1 27 VAL HB H 14.095 5.066 2.623 1.00 . A A . 33 VAL HB 1 1 16 8251 1 1 27 VAL HG11 H 16.602 6.370 1.575 1.00 . A A . 33 VAL HG11 1 1 16 8252 1 1 27 VAL HG12 H 14.972 6.930 1.202 1.00 . A A . 33 VAL HG12 1 1 16 8253 1 1 27 VAL HG13 H 15.549 6.945 2.868 1.00 . A A . 33 VAL HG13 1 1 16 8254 1 1 27 VAL HG21 H 14.900 3.247 0.913 1.00 . A A . 33 VAL HG21 1 1 16 8255 1 1 27 VAL HG22 H 13.871 4.580 0.392 1.00 . A A . 33 VAL HG22 1 1 16 8256 1 1 27 VAL HG23 H 15.607 4.637 0.092 1.00 . A A . 33 VAL HG23 1 1 16 8257 1 1 27 VAL N N 15.460 2.847 3.292 1.00 . A A . 33 VAL N 1 1 16 8258 1 1 27 VAL O O 17.162 5.785 4.366 1.00 . A A . 33 VAL O 1 1 16 8259 1 1 28 ARG C C 17.068 5.060 7.194 1.00 . A A . 34 ARG C 1 1 16 8260 1 1 28 ARG CA C 15.663 5.274 6.639 1.00 . A A . 34 ARG CA 1 1 16 8261 1 1 28 ARG CB C 14.625 4.746 7.631 1.00 . A A . 34 ARG CB 1 1 16 8262 1 1 28 ARG CD C 12.823 6.435 8.093 1.00 . A A . 34 ARG CD 1 1 16 8263 1 1 28 ARG CG C 14.110 5.802 8.595 1.00 . A A . 34 ARG CG 1 1 16 8264 1 1 28 ARG CZ C 10.409 5.963 8.245 1.00 . A A . 34 ARG CZ 1 1 16 8265 1 1 28 ARG H H 14.815 3.933 5.239 1.00 . A A . 34 ARG H 1 1 16 8266 1 1 28 ARG HA H 15.503 6.333 6.496 1.00 . A A . 34 ARG HA 1 1 16 8267 1 1 28 ARG HB2 H 13.783 4.354 7.078 1.00 . A A . 34 ARG HB2 1 1 16 8268 1 1 28 ARG HB3 H 15.069 3.948 8.207 1.00 . A A . 34 ARG HB3 1 1 16 8269 1 1 28 ARG HD2 H 12.648 7.348 8.642 1.00 . A A . 34 ARG HD2 1 1 16 8270 1 1 28 ARG HD3 H 12.934 6.663 7.043 1.00 . A A . 34 ARG HD3 1 1 16 8271 1 1 28 ARG HE H 11.854 4.597 8.409 1.00 . A A . 34 ARG HE 1 1 16 8272 1 1 28 ARG HG2 H 13.923 5.340 9.553 1.00 . A A . 34 ARG HG2 1 1 16 8273 1 1 28 ARG HG3 H 14.861 6.571 8.705 1.00 . A A . 34 ARG HG3 1 1 16 8274 1 1 28 ARG HH11 H 10.863 7.909 7.932 1.00 . A A . 34 ARG HH11 1 1 16 8275 1 1 28 ARG HH12 H 9.173 7.550 8.042 1.00 . A A . 34 ARG HH12 1 1 16 8276 1 1 28 ARG HH21 H 9.631 4.123 8.552 1.00 . A A . 34 ARG HH21 1 1 16 8277 1 1 28 ARG HH22 H 8.473 5.402 8.395 1.00 . A A . 34 ARG HH22 1 1 16 8278 1 1 28 ARG N N 15.506 4.620 5.346 1.00 . A A . 34 ARG N 1 1 16 8279 1 1 28 ARG NE N 11.674 5.549 8.268 1.00 . A A . 34 ARG NE 1 1 16 8280 1 1 28 ARG NH1 N 10.125 7.246 8.058 1.00 . A A . 34 ARG NH1 1 1 16 8281 1 1 28 ARG NH2 N 9.423 5.091 8.411 1.00 . A A . 34 ARG NH2 1 1 16 8282 1 1 28 ARG O O 17.727 6.007 7.623 1.00 . A A . 34 ARG O 1 1 16 8283 1 1 29 GLY C C 19.610 2.552 6.786 1.00 . A A . 35 GLY C 1 1 16 8284 1 1 29 GLY CA C 18.845 3.498 7.691 1.00 . A A . 35 GLY CA 1 1 16 8285 1 1 29 GLY H H 16.952 3.094 6.831 1.00 . A A . 35 GLY H 1 1 16 8286 1 1 29 GLY HA2 H 19.406 4.415 7.789 1.00 . A A . 35 GLY HA2 1 1 16 8287 1 1 29 GLY HA3 H 18.747 3.044 8.666 1.00 . A A . 35 GLY HA3 1 1 16 8288 1 1 29 GLY N N 17.521 3.810 7.184 1.00 . A A . 35 GLY N 1 1 16 8289 1 1 29 GLY O O 20.798 2.752 6.530 1.00 . A A . 35 GLY O 1 1 16 8290 1 1 30 ARG C C 20.151 1.210 4.187 1.00 . A A . 36 ARG C 1 1 16 8291 1 1 30 ARG CA C 19.553 0.536 5.419 1.00 . A A . 36 ARG CA 1 1 16 8292 1 1 30 ARG CB C 18.529 -0.516 4.991 1.00 . A A . 36 ARG CB 1 1 16 8293 1 1 30 ARG CD C 18.616 -2.046 2.997 1.00 . A A . 36 ARG CD 1 1 16 8294 1 1 30 ARG CG C 19.154 -1.765 4.391 1.00 . A A . 36 ARG CG 1 1 16 8295 1 1 30 ARG CZ C 19.438 -3.107 0.930 1.00 . A A . 36 ARG CZ 1 1 16 8296 1 1 30 ARG H H 17.986 1.412 6.542 1.00 . A A . 36 ARG H 1 1 16 8297 1 1 30 ARG HA H 20.345 0.051 5.970 1.00 . A A . 36 ARG HA 1 1 16 8298 1 1 30 ARG HB2 H 17.949 -0.809 5.854 1.00 . A A . 36 ARG HB2 1 1 16 8299 1 1 30 ARG HB3 H 17.869 -0.080 4.256 1.00 . A A . 36 ARG HB3 1 1 16 8300 1 1 30 ARG HD2 H 17.632 -2.482 3.085 1.00 . A A . 36 ARG HD2 1 1 16 8301 1 1 30 ARG HD3 H 18.548 -1.113 2.457 1.00 . A A . 36 ARG HD3 1 1 16 8302 1 1 30 ARG HE H 20.114 -3.501 2.766 1.00 . A A . 36 ARG HE 1 1 16 8303 1 1 30 ARG HG2 H 20.223 -1.628 4.332 1.00 . A A . 36 ARG HG2 1 1 16 8304 1 1 30 ARG HG3 H 18.932 -2.608 5.029 1.00 . A A . 36 ARG HG3 1 1 16 8305 1 1 30 ARG HH11 H 17.972 -1.743 0.645 1.00 . A A . 36 ARG HH11 1 1 16 8306 1 1 30 ARG HH12 H 18.565 -2.506 -0.791 1.00 . A A . 36 ARG HH12 1 1 16 8307 1 1 30 ARG HH21 H 20.896 -4.505 0.878 1.00 . A A . 36 ARG HH21 1 1 16 8308 1 1 30 ARG HH22 H 20.225 -4.074 -0.660 1.00 . A A . 36 ARG HH22 1 1 16 8309 1 1 30 ARG N N 18.930 1.518 6.301 1.00 . A A . 36 ARG N 1 1 16 8310 1 1 30 ARG NE N 19.476 -2.963 2.253 1.00 . A A . 36 ARG NE 1 1 16 8311 1 1 30 ARG NH1 N 18.588 -2.393 0.202 1.00 . A A . 36 ARG NH1 1 1 16 8312 1 1 30 ARG NH2 N 20.253 -3.965 0.334 1.00 . A A . 36 ARG NH2 1 1 16 8313 1 1 30 ARG O O 19.427 1.647 3.294 1.00 . A A . 36 ARG O 1 1 16 8314 1 1 31 GLY C C 22.698 3.283 3.361 1.00 . A A . 37 GLY C 1 1 16 8315 1 1 31 GLY CA C 22.149 1.911 3.023 1.00 . A A . 37 GLY CA 1 1 16 8316 1 1 31 GLY H H 22.003 0.924 4.890 1.00 . A A . 37 GLY H 1 1 16 8317 1 1 31 GLY HA2 H 22.965 1.277 2.710 1.00 . A A . 37 GLY HA2 1 1 16 8318 1 1 31 GLY HA3 H 21.449 2.008 2.206 1.00 . A A . 37 GLY HA3 1 1 16 8319 1 1 31 GLY N N 21.477 1.290 4.148 1.00 . A A . 37 GLY N 1 1 16 8320 1 1 31 GLY O O 22.469 4.226 2.574 1.00 . A A . 37 GLY O 1 1 16 8321 1 1 31 GLY OXT O 23.357 3.416 4.414 1.00 . A A . 37 GLY OXT 1 1 16 8322 2 2 1 . C02 C 7.898 -6.191 -1.510 1.00 . B A . 1038 D6M C02 1 1 16 8323 2 2 1 . C04 C 7.900 -5.783 -3.911 1.00 . B A . 1038 D6M C04 1 1 16 8324 2 2 1 . C05 C 8.174 -4.512 -4.716 1.00 . B A . 1038 D6M C05 1 1 16 8325 2 2 1 . C06 C 7.072 -3.471 -4.605 1.00 . B A . 1038 D6M C06 1 1 16 8326 2 2 1 . C07 C 7.326 -2.258 -5.479 1.00 . B A . 1038 D6M C07 1 1 16 8327 2 2 1 . C09 C 8.440 -6.999 -4.657 1.00 . B A . 1038 D6M C09 1 1 16 8328 2 2 1 . C12 C 8.521 -6.083 -0.131 1.00 . B A . 1038 D6M C12 1 1 16 8329 2 2 1 . C13 C 9.944 -6.616 -0.088 1.00 . B A . 1038 D6M C13 1 1 16 8330 2 2 1 . C14 C 10.712 -6.057 1.100 1.00 . B A . 1038 D6M C14 1 1 16 8331 2 2 1 . C15 C 12.186 -6.424 1.034 1.00 . B A . 1038 D6M C15 1 1 16 8332 2 2 1 . C16 C 13.023 -5.285 0.471 1.00 . B A . 1038 D6M C16 1 1 16 8333 2 2 1 . C17 C 13.802 -5.720 -0.760 1.00 . B A . 1038 D6M C17 1 1 16 8334 2 2 1 . C18 C 13.816 -4.635 -1.825 1.00 . B A . 1038 D6M C18 1 1 16 8335 2 2 1 . C19 C 14.845 -3.562 -1.511 1.00 . B A . 1038 D6M C19 1 1 16 8336 2 2 1 . C20 C 14.654 -2.333 -2.386 1.00 . B A . 1038 D6M C20 1 1 16 8337 2 2 1 . C21 C 15.324 -1.108 -1.782 1.00 . B A . 1038 D6M C21 1 1 16 8338 2 2 1 . C22 C 16.262 -0.437 -2.773 1.00 . B A . 1038 D6M C22 1 1 16 8339 2 2 1 . C23 C 15.562 0.674 -3.537 1.00 . B A . 1038 D6M C23 1 1 16 8340 2 2 1 . C24 C 15.533 1.968 -2.739 1.00 . B A . 1038 D6M C24 1 1 16 8341 2 2 1 . C25 C 16.914 2.596 -2.644 1.00 . B A . 1038 D6M C25 1 1 16 8342 2 2 1 . C26 C 17.137 3.258 -1.302 1.00 . B A . 1038 D6M C26 1 1 16 8343 2 2 1 . H03 H 9.330 -5.178 -2.472 1.00 . B A . 1038 D6M H03 1 1 16 8344 2 2 1 . H04 H 6.833 -5.897 -3.787 1.00 . B A . 1038 D6M H04 1 1 16 8345 2 2 1 . HP21 H 7.918 -6.648 0.564 1.00 . B A . 1038 D6M HP21 1 1 16 8346 2 2 1 . HP22 H 8.530 -5.044 0.163 1.00 . B A . 1038 D6M HP22 1 1 16 8347 2 2 1 . HP31 H 10.452 -6.333 -0.999 1.00 . B A . 1038 D6M HP31 1 1 16 8348 2 2 1 . HP32 H 9.914 -7.692 -0.010 1.00 . B A . 1038 D6M HP32 1 1 16 8349 2 2 1 . HP41 H 10.289 -6.460 2.009 1.00 . B A . 1038 D6M HP41 1 1 16 8350 2 2 1 . HP42 H 10.619 -4.982 1.103 1.00 . B A . 1038 D6M HP42 1 1 16 8351 2 2 1 . HP51 H 12.302 -7.293 0.402 1.00 . B A . 1038 D6M HP51 1 1 16 8352 2 2 1 . HP52 H 12.534 -6.653 2.031 1.00 . B A . 1038 D6M HP52 1 1 16 8353 2 2 1 . HP61 H 13.719 -4.954 1.228 1.00 . B A . 1038 D6M HP61 1 1 16 8354 2 2 1 . HP62 H 12.369 -4.469 0.200 1.00 . B A . 1038 D6M HP62 1 1 16 8355 2 2 1 . HP71 H 13.343 -6.608 -1.169 1.00 . B A . 1038 D6M HP71 1 1 16 8356 2 2 1 . HP72 H 14.819 -5.939 -0.471 1.00 . B A . 1038 D6M HP72 1 1 16 8357 2 2 1 . HP81 H 12.838 -4.180 -1.874 1.00 . B A . 1038 D6M HP81 1 1 16 8358 2 2 1 . HP82 H 14.057 -5.082 -2.778 1.00 . B A . 1038 D6M HP82 1 1 16 8359 2 2 1 . HP91 H 15.834 -3.964 -1.681 1.00 . B A . 1038 D6M HP91 1 1 16 8360 2 2 1 . HP92 H 14.745 -3.272 -0.476 1.00 . B A . 1038 D6M HP92 1 1 16 8361 2 2 1 . HPA1 H 13.597 -2.140 -2.492 1.00 . B A . 1038 D6M HPA1 1 1 16 8362 2 2 1 . HPA2 H 15.085 -2.525 -3.358 1.00 . B A . 1038 D6M HPA2 1 1 16 8363 2 2 1 . HPB1 H 15.890 -1.410 -0.912 1.00 . B A . 1038 D6M HPB1 1 1 16 8364 2 2 1 . HPB2 H 14.562 -0.401 -1.490 1.00 . B A . 1038 D6M HPB2 1 1 16 8365 2 2 1 . HPC1 H 16.617 -1.177 -3.475 1.00 . B A . 1038 D6M HPC1 1 1 16 8366 2 2 1 . HPC2 H 17.099 -0.018 -2.235 1.00 . B A . 1038 D6M HPC2 1 1 16 8367 2 2 1 . HPD1 H 14.547 0.369 -3.748 1.00 . B A . 1038 D6M HPD1 1 1 16 8368 2 2 1 . HPD2 H 16.087 0.847 -4.464 1.00 . B A . 1038 D6M HPD2 1 1 16 8369 2 2 1 . HPE1 H 15.174 1.756 -1.742 1.00 . B A . 1038 D6M HPE1 1 1 16 8370 2 2 1 . HPE2 H 14.865 2.663 -3.224 1.00 . B A . 1038 D6M HPE2 1 1 16 8371 2 2 1 . HPF1 H 17.017 3.342 -3.419 1.00 . B A . 1038 D6M HPF1 1 1 16 8372 2 2 1 . HPF2 H 17.662 1.829 -2.774 1.00 . B A . 1038 D6M HPF2 1 1 16 8373 2 2 1 . HPG1 H 16.403 2.898 -0.595 1.00 . B A . 1038 D6M HPG1 1 1 16 8374 2 2 1 . HPG2 H 17.038 4.329 -1.408 1.00 . B A . 1038 D6M HPG2 1 1 16 8375 2 2 1 . HPG3 H 18.128 3.022 -0.944 1.00 . B A . 1038 D6M HPG3 1 1 16 8376 2 2 1 . HQ21 H 6.137 -3.921 -4.904 1.00 . B A . 1038 D6M HQ21 1 1 16 8377 2 2 1 . HQ22 H 7.002 -3.147 -3.577 1.00 . B A . 1038 D6M HQ22 1 1 16 8378 2 2 1 . HQ31 H 9.094 -4.070 -4.364 1.00 . B A . 1038 D6M HQ31 1 1 16 8379 2 2 1 . HQ32 H 8.286 -4.775 -5.758 1.00 . B A . 1038 D6M HQ32 1 1 16 8380 2 2 1 . N03 N 8.495 -5.680 -2.583 1.00 . B A . 1038 D6M N03 1 1 16 8381 2 2 1 . O01 O 6.816 -6.768 -1.615 1.00 . B A . 1038 D6M O01 1 1 16 8382 2 2 1 . O08 O 7.317 -2.408 -6.700 1.00 . B A . 1038 D6M O08 1 1 16 8383 2 2 1 . O10 O 7.665 -7.954 -4.870 1.00 . B A . 1038 D6M O10 1 1 16 8384 2 2 1 . O11 O 9.635 -6.985 -5.021 1.00 . B A . 1038 D6M O11 1 1 17 8385 1 1 1 HIS C C -32.262 -3.570 -2.163 1.00 . A A . 7 HIS C 1 1 17 8386 1 1 1 HIS CA C -33.513 -4.260 -1.628 1.00 . A A . 7 HIS CA 1 1 17 8387 1 1 1 HIS CB C -33.147 -5.198 -0.476 1.00 . A A . 7 HIS CB 1 1 17 8388 1 1 1 HIS CD2 C -31.479 -6.473 -2.000 1.00 . A A . 7 HIS CD2 1 1 17 8389 1 1 1 HIS CE1 C -31.046 -8.156 -0.663 1.00 . A A . 7 HIS CE1 1 1 17 8390 1 1 1 HIS CG C -32.201 -6.290 -0.869 1.00 . A A . 7 HIS CG 1 1 17 8391 1 1 1 HIS H1 H -33.450 -5.561 -3.221 1.00 . A A . 7 HIS H1 1 1 17 8392 1 1 1 HIS H2 H -34.838 -5.716 -2.227 1.00 . A A . 7 HIS H2 1 1 17 8393 1 1 1 HIS H3 H -34.699 -4.387 -3.304 1.00 . A A . 7 HIS H3 1 1 17 8394 1 1 1 HIS HA H -34.203 -3.510 -1.270 1.00 . A A . 7 HIS HA 1 1 17 8395 1 1 1 HIS HB2 H -32.683 -4.625 0.312 1.00 . A A . 7 HIS HB2 1 1 17 8396 1 1 1 HIS HB3 H -34.048 -5.658 -0.097 1.00 . A A . 7 HIS HB3 1 1 17 8397 1 1 1 HIS HD1 H -32.275 -7.516 0.843 1.00 . A A . 7 HIS HD1 1 1 17 8398 1 1 1 HIS HD2 H -31.463 -5.823 -2.864 1.00 . A A . 7 HIS HD2 1 1 17 8399 1 1 1 HIS HE1 H -30.638 -9.072 -0.263 1.00 . A A . 7 HIS HE1 1 1 17 8400 1 1 1 HIS HE2 H -30.229 -8.072 -2.539 1.00 . A A . 7 HIS HE2 1 1 17 8401 1 1 1 HIS N N -34.186 -5.052 -2.691 1.00 . A A . 7 HIS N 1 1 17 8402 1 1 1 HIS ND1 N -31.907 -7.361 -0.052 1.00 . A A . 7 HIS ND1 1 1 17 8403 1 1 1 HIS NE2 N -30.771 -7.640 -1.846 1.00 . A A . 7 HIS NE2 1 1 17 8404 1 1 1 HIS O O -31.949 -3.664 -3.349 1.00 . A A . 7 HIS O 1 1 17 8405 1 1 2 ALA C C -29.345 -2.116 -0.504 1.00 . A A . 8 ALA C 1 1 17 8406 1 1 2 ALA CA C -30.335 -2.171 -1.662 1.00 . A A . 8 ALA CA 1 1 17 8407 1 1 2 ALA CB C -30.669 -0.766 -2.141 1.00 . A A . 8 ALA CB 1 1 17 8408 1 1 2 ALA H H -31.853 -2.839 -0.347 1.00 . A A . 8 ALA H 1 1 17 8409 1 1 2 ALA HA H -29.883 -2.708 -2.484 1.00 . A A . 8 ALA HA 1 1 17 8410 1 1 2 ALA HB1 H -31.565 -0.794 -2.743 1.00 . A A . 8 ALA HB1 1 1 17 8411 1 1 2 ALA HB2 H -30.829 -0.124 -1.287 1.00 . A A . 8 ALA HB2 1 1 17 8412 1 1 2 ALA HB3 H -29.850 -0.383 -2.731 1.00 . A A . 8 ALA HB3 1 1 17 8413 1 1 2 ALA N N -31.552 -2.877 -1.279 1.00 . A A . 8 ALA N 1 1 17 8414 1 1 2 ALA O O -29.693 -1.710 0.605 1.00 . A A . 8 ALA O 1 1 17 8415 1 1 3 GLU C C -25.707 -2.209 -0.360 1.00 . A A . 9 GLU C 1 1 17 8416 1 1 3 GLU CA C -27.068 -2.526 0.252 1.00 . A A . 9 GLU CA 1 1 17 8417 1 1 3 GLU CB C -27.018 -3.880 0.962 1.00 . A A . 9 GLU CB 1 1 17 8418 1 1 3 GLU CD C -26.502 -4.673 3.305 1.00 . A A . 9 GLU CD 1 1 17 8419 1 1 3 GLU CG C -25.988 -3.944 2.079 1.00 . A A . 9 GLU CG 1 1 17 8420 1 1 3 GLU H H -27.893 -2.841 -1.672 1.00 . A A . 9 GLU H 1 1 17 8421 1 1 3 GLU HA H -27.312 -1.760 0.973 1.00 . A A . 9 GLU HA 1 1 17 8422 1 1 3 GLU HB2 H -27.989 -4.088 1.385 1.00 . A A . 9 GLU HB2 1 1 17 8423 1 1 3 GLU HB3 H -26.779 -4.645 0.238 1.00 . A A . 9 GLU HB3 1 1 17 8424 1 1 3 GLU HG2 H -25.112 -4.458 1.714 1.00 . A A . 9 GLU HG2 1 1 17 8425 1 1 3 GLU HG3 H -25.721 -2.936 2.363 1.00 . A A . 9 GLU HG3 1 1 17 8426 1 1 3 GLU N N -28.109 -2.528 -0.769 1.00 . A A . 9 GLU N 1 1 17 8427 1 1 3 GLU O O -25.443 -2.541 -1.516 1.00 . A A . 9 GLU O 1 1 17 8428 1 1 3 GLU OE1 O -27.673 -4.453 3.679 1.00 . A A . 9 GLU OE1 1 1 17 8429 1 1 3 GLU OE2 O -25.733 -5.464 3.890 1.00 . A A . 9 GLU OE2 1 1 17 8430 1 1 4 GLY C C -22.465 -1.326 1.019 1.00 . A A . 10 GLY C 1 1 17 8431 1 1 4 GLY CA C -23.524 -1.216 -0.060 1.00 . A A . 10 GLY CA 1 1 17 8432 1 1 4 GLY H H -25.113 -1.327 1.335 1.00 . A A . 10 GLY H 1 1 17 8433 1 1 4 GLY HA2 H -23.263 -1.876 -0.874 1.00 . A A . 10 GLY HA2 1 1 17 8434 1 1 4 GLY HA3 H -23.544 -0.200 -0.427 1.00 . A A . 10 GLY HA3 1 1 17 8435 1 1 4 GLY N N -24.847 -1.566 0.422 1.00 . A A . 10 GLY N 1 1 17 8436 1 1 4 GLY O O -22.765 -1.207 2.207 1.00 . A A . 10 GLY O 1 1 17 8437 1 1 5 THR C C -19.275 -0.407 1.570 1.00 . A A . 11 THR C 1 1 17 8438 1 1 5 THR CA C -20.115 -1.681 1.544 1.00 . A A . 11 THR CA 1 1 17 8439 1 1 5 THR CB C -19.238 -2.878 1.173 1.00 . A A . 11 THR CB 1 1 17 8440 1 1 5 THR CG2 C -19.551 -4.121 1.978 1.00 . A A . 11 THR CG2 1 1 17 8441 1 1 5 THR H H -21.047 -1.639 -0.356 1.00 . A A . 11 THR H 1 1 17 8442 1 1 5 THR HA H -20.532 -1.843 2.527 1.00 . A A . 11 THR HA 1 1 17 8443 1 1 5 THR HB H -18.203 -2.623 1.347 1.00 . A A . 11 THR HB 1 1 17 8444 1 1 5 THR HG1 H -20.279 -3.535 -0.351 1.00 . A A . 11 THR HG1 1 1 17 8445 1 1 5 THR HG21 H -20.533 -4.027 2.418 1.00 . A A . 11 THR HG21 1 1 17 8446 1 1 5 THR HG22 H -19.526 -4.985 1.332 1.00 . A A . 11 THR HG22 1 1 17 8447 1 1 5 THR HG23 H -18.816 -4.236 2.761 1.00 . A A . 11 THR HG23 1 1 17 8448 1 1 5 THR N N -21.223 -1.554 0.605 1.00 . A A . 11 THR N 1 1 17 8449 1 1 5 THR O O -19.621 0.589 0.935 1.00 . A A . 11 THR O 1 1 17 8450 1 1 5 THR OG1 O -19.391 -3.206 -0.197 1.00 . A A . 11 THR OG1 1 1 17 8451 1 1 6 PHE C C -15.839 0.258 2.628 1.00 . A A . 12 PHE C 1 1 17 8452 1 1 6 PHE CA C -17.283 0.704 2.420 1.00 . A A . 12 PHE CA 1 1 17 8453 1 1 6 PHE CB C -17.725 1.607 3.574 1.00 . A A . 12 PHE CB 1 1 17 8454 1 1 6 PHE CD1 C -18.779 3.433 2.213 1.00 . A A . 12 PHE CD1 1 1 17 8455 1 1 6 PHE CD2 C -17.093 4.025 3.793 1.00 . A A . 12 PHE CD2 1 1 17 8456 1 1 6 PHE CE1 C -18.913 4.761 1.853 1.00 . A A . 12 PHE CE1 1 1 17 8457 1 1 6 PHE CE2 C -17.223 5.355 3.437 1.00 . A A . 12 PHE CE2 1 1 17 8458 1 1 6 PHE CG C -17.869 3.051 3.186 1.00 . A A . 12 PHE CG 1 1 17 8459 1 1 6 PHE CZ C -18.134 5.723 2.466 1.00 . A A . 12 PHE CZ 1 1 17 8460 1 1 6 PHE H H -17.950 -1.270 2.794 1.00 . A A . 12 PHE H 1 1 17 8461 1 1 6 PHE HA H -17.344 1.260 1.497 1.00 . A A . 12 PHE HA 1 1 17 8462 1 1 6 PHE HB2 H -18.682 1.266 3.942 1.00 . A A . 12 PHE HB2 1 1 17 8463 1 1 6 PHE HB3 H -16.998 1.546 4.371 1.00 . A A . 12 PHE HB3 1 1 17 8464 1 1 6 PHE HD1 H -16.380 3.739 4.552 1.00 . A A . 12 PHE HD1 1 1 17 8465 1 1 6 PHE HD2 H -19.388 2.682 1.733 1.00 . A A . 12 PHE HD2 1 1 17 8466 1 1 6 PHE HE1 H -16.613 6.105 3.919 1.00 . A A . 12 PHE HE1 1 1 17 8467 1 1 6 PHE HE2 H -19.626 5.046 1.094 1.00 . A A . 12 PHE HE2 1 1 17 8468 1 1 6 PHE HZ H -18.237 6.761 2.187 1.00 . A A . 12 PHE HZ 1 1 17 8469 1 1 6 PHE N N -18.172 -0.447 2.310 1.00 . A A . 12 PHE N 1 1 17 8470 1 1 6 PHE O O -14.962 0.570 1.825 1.00 . A A . 12 PHE O 1 1 17 8471 1 1 7 THR C C -13.709 -1.814 2.889 1.00 . A A . 13 THR C 1 1 17 8472 1 1 7 THR CA C -14.263 -0.962 4.027 1.00 . A A . 13 THR CA 1 1 17 8473 1 1 7 THR CB C -14.287 -1.776 5.322 1.00 . A A . 13 THR CB 1 1 17 8474 1 1 7 THR CG2 C -14.260 -0.918 6.568 1.00 . A A . 13 THR CG2 1 1 17 8475 1 1 7 THR H H -16.343 -0.690 4.315 1.00 . A A . 13 THR H 1 1 17 8476 1 1 7 THR HA H -13.621 -0.105 4.164 1.00 . A A . 13 THR HA 1 1 17 8477 1 1 7 THR HB H -13.420 -2.421 5.346 1.00 . A A . 13 THR HB 1 1 17 8478 1 1 7 THR HG1 H -15.190 -3.506 5.486 1.00 . A A . 13 THR HG1 1 1 17 8479 1 1 7 THR HG21 H -14.707 0.042 6.354 1.00 . A A . 13 THR HG21 1 1 17 8480 1 1 7 THR HG22 H -14.816 -1.407 7.354 1.00 . A A . 13 THR HG22 1 1 17 8481 1 1 7 THR HG23 H -13.237 -0.776 6.885 1.00 . A A . 13 THR HG23 1 1 17 8482 1 1 7 THR N N -15.601 -0.474 3.712 1.00 . A A . 13 THR N 1 1 17 8483 1 1 7 THR O O -12.498 -1.868 2.675 1.00 . A A . 13 THR O 1 1 17 8484 1 1 7 THR OG1 O -15.447 -2.587 5.383 1.00 . A A . 13 THR OG1 1 1 17 8485 1 1 8 SER C C -14.129 -2.532 -0.250 1.00 . A A . 14 SER C 1 1 17 8486 1 1 8 SER CA C -14.199 -3.329 1.049 1.00 . A A . 14 SER CA 1 1 17 8487 1 1 8 SER CB C -15.176 -4.496 0.892 1.00 . A A . 14 SER CB 1 1 17 8488 1 1 8 SER H H -15.553 -2.398 2.383 1.00 . A A . 14 SER H 1 1 17 8489 1 1 8 SER HA H -13.218 -3.721 1.269 1.00 . A A . 14 SER HA 1 1 17 8490 1 1 8 SER HB2 H -14.965 -5.018 -0.030 1.00 . A A . 14 SER HB2 1 1 17 8491 1 1 8 SER HB3 H -15.060 -5.174 1.724 1.00 . A A . 14 SER HB3 1 1 17 8492 1 1 8 SER HG H -16.893 -4.084 1.740 1.00 . A A . 14 SER HG 1 1 17 8493 1 1 8 SER N N -14.602 -2.480 2.163 1.00 . A A . 14 SER N 1 1 17 8494 1 1 8 SER O O -13.333 -2.840 -1.137 1.00 . A A . 14 SER O 1 1 17 8495 1 1 8 SER OG O -16.517 -4.038 0.858 1.00 . A A . 14 SER OG 1 1 17 8496 1 1 9 ASP C C -13.861 0.346 -1.533 1.00 . A A . 15 ASP C 1 1 17 8497 1 1 9 ASP CA C -15.001 -0.666 -1.547 1.00 . A A . 15 ASP CA 1 1 17 8498 1 1 9 ASP CB C -16.343 0.062 -1.647 1.00 . A A . 15 ASP CB 1 1 17 8499 1 1 9 ASP CG C -17.441 -0.823 -2.205 1.00 . A A . 15 ASP CG 1 1 17 8500 1 1 9 ASP H H -15.580 -1.311 0.384 1.00 . A A . 15 ASP H 1 1 17 8501 1 1 9 ASP HA H -14.886 -1.308 -2.408 1.00 . A A . 15 ASP HA 1 1 17 8502 1 1 9 ASP HB2 H -16.640 0.393 -0.663 1.00 . A A . 15 ASP HB2 1 1 17 8503 1 1 9 ASP HB3 H -16.233 0.920 -2.293 1.00 . A A . 15 ASP HB3 1 1 17 8504 1 1 9 ASP N N -14.968 -1.507 -0.356 1.00 . A A . 15 ASP N 1 1 17 8505 1 1 9 ASP O O -13.282 0.659 -2.574 1.00 . A A . 15 ASP O 1 1 17 8506 1 1 9 ASP OD1 O -17.506 -0.979 -3.442 1.00 . A A . 15 ASP OD1 1 1 17 8507 1 1 9 ASP OD2 O -18.235 -1.359 -1.404 1.00 . A A . 15 ASP OD2 1 1 17 8508 1 1 10 VAL C C -11.108 1.199 -0.430 1.00 . A A . 16 VAL C 1 1 17 8509 1 1 10 VAL CA C -12.474 1.836 -0.200 1.00 . A A . 16 VAL CA 1 1 17 8510 1 1 10 VAL CB C -12.496 2.489 1.195 1.00 . A A . 16 VAL CB 1 1 17 8511 1 1 10 VAL CG1 C -13.743 3.343 1.363 1.00 . A A . 16 VAL CG1 1 1 17 8512 1 1 10 VAL CG2 C -12.411 1.429 2.284 1.00 . A A . 16 VAL CG2 1 1 17 8513 1 1 10 VAL H H -14.042 0.570 0.445 1.00 . A A . 16 VAL H 1 1 17 8514 1 1 10 VAL HA H -12.627 2.610 -0.938 1.00 . A A . 16 VAL HA 1 1 17 8515 1 1 10 VAL HB H -11.634 3.133 1.281 1.00 . A A . 16 VAL HB 1 1 17 8516 1 1 10 VAL HG11 H -14.092 3.665 0.393 1.00 . A A . 16 VAL HG11 1 1 17 8517 1 1 10 VAL HG12 H -14.514 2.763 1.849 1.00 . A A . 16 VAL HG12 1 1 17 8518 1 1 10 VAL HG13 H -13.508 4.207 1.967 1.00 . A A . 16 VAL HG13 1 1 17 8519 1 1 10 VAL HG21 H -12.663 0.465 1.869 1.00 . A A . 16 VAL HG21 1 1 17 8520 1 1 10 VAL HG22 H -11.406 1.400 2.678 1.00 . A A . 16 VAL HG22 1 1 17 8521 1 1 10 VAL HG23 H -13.102 1.671 3.078 1.00 . A A . 16 VAL HG23 1 1 17 8522 1 1 10 VAL N N -13.544 0.857 -0.348 1.00 . A A . 16 VAL N 1 1 17 8523 1 1 10 VAL O O -10.199 1.830 -0.966 1.00 . A A . 16 VAL O 1 1 17 8524 1 1 11 SER C C -9.270 -0.787 -1.657 1.00 . A A . 17 SER C 1 1 17 8525 1 1 11 SER CA C -9.710 -0.778 -0.193 1.00 . A A . 17 SER CA 1 1 17 8526 1 1 11 SER CB C -9.848 -2.213 0.317 1.00 . A A . 17 SER CB 1 1 17 8527 1 1 11 SER H H -11.728 -0.514 0.393 1.00 . A A . 17 SER H 1 1 17 8528 1 1 11 SER HA H -8.959 -0.270 0.392 1.00 . A A . 17 SER HA 1 1 17 8529 1 1 11 SER HB2 H -8.896 -2.715 0.237 1.00 . A A . 17 SER HB2 1 1 17 8530 1 1 11 SER HB3 H -10.160 -2.197 1.351 1.00 . A A . 17 SER HB3 1 1 17 8531 1 1 11 SER HG H -11.637 -2.451 -0.445 1.00 . A A . 17 SER HG 1 1 17 8532 1 1 11 SER N N -10.968 -0.058 -0.025 1.00 . A A . 17 SER N 1 1 17 8533 1 1 11 SER O O -8.097 -1.006 -1.959 1.00 . A A . 17 SER O 1 1 17 8534 1 1 11 SER OG O -10.808 -2.934 -0.437 1.00 . A A . 17 SER OG 1 1 17 8535 1 1 12 SER C C -9.243 0.753 -4.417 1.00 . A A . 18 SER C 1 1 17 8536 1 1 12 SER CA C -9.925 -0.546 -3.991 1.00 . A A . 18 SER CA 1 1 17 8537 1 1 12 SER CB C -11.211 -0.744 -4.795 1.00 . A A . 18 SER CB 1 1 17 8538 1 1 12 SER H H -11.136 -0.395 -2.265 1.00 . A A . 18 SER H 1 1 17 8539 1 1 12 SER HA H -9.257 -1.369 -4.195 1.00 . A A . 18 SER HA 1 1 17 8540 1 1 12 SER HB2 H -10.962 -0.925 -5.830 1.00 . A A . 18 SER HB2 1 1 17 8541 1 1 12 SER HB3 H -11.752 -1.592 -4.401 1.00 . A A . 18 SER HB3 1 1 17 8542 1 1 12 SER HG H -12.774 0.228 -4.125 1.00 . A A . 18 SER HG 1 1 17 8543 1 1 12 SER N N -10.218 -0.556 -2.563 1.00 . A A . 18 SER N 1 1 17 8544 1 1 12 SER O O -8.279 0.731 -5.182 1.00 . A A . 18 SER O 1 1 17 8545 1 1 12 SER OG O -12.041 0.402 -4.720 1.00 . A A . 18 SER OG 1 1 17 8546 1 1 13 TYR C C -7.707 3.261 -3.892 1.00 . A A . 19 TYR C 1 1 17 8547 1 1 13 TYR CA C -9.181 3.182 -4.288 1.00 . A A . 19 TYR CA 1 1 17 8548 1 1 13 TYR CB C -9.986 4.328 -3.647 1.00 . A A . 19 TYR CB 1 1 17 8549 1 1 13 TYR CD1 C -8.316 5.462 -2.118 1.00 . A A . 19 TYR CD1 1 1 17 8550 1 1 13 TYR CD2 C -10.256 4.488 -1.136 1.00 . A A . 19 TYR CD2 1 1 17 8551 1 1 13 TYR CE1 C -7.883 5.869 -0.871 1.00 . A A . 19 TYR CE1 1 1 17 8552 1 1 13 TYR CE2 C -9.829 4.890 0.115 1.00 . A A . 19 TYR CE2 1 1 17 8553 1 1 13 TYR CG C -9.508 4.764 -2.274 1.00 . A A . 19 TYR CG 1 1 17 8554 1 1 13 TYR CZ C -8.642 5.580 0.242 1.00 . A A . 19 TYR CZ 1 1 17 8555 1 1 13 TYR H H -10.525 1.848 -3.333 1.00 . A A . 19 TYR H 1 1 17 8556 1 1 13 TYR HA H -9.246 3.276 -5.362 1.00 . A A . 19 TYR HA 1 1 17 8557 1 1 13 TYR HB2 H -9.940 5.190 -4.295 1.00 . A A . 19 TYR HB2 1 1 17 8558 1 1 13 TYR HB3 H -11.017 4.017 -3.553 1.00 . A A . 19 TYR HB3 1 1 17 8559 1 1 13 TYR HD1 H -7.722 5.686 -2.992 1.00 . A A . 19 TYR HD1 1 1 17 8560 1 1 13 TYR HD2 H -11.185 3.947 -1.238 1.00 . A A . 19 TYR HD2 1 1 17 8561 1 1 13 TYR HE1 H -6.954 6.410 -0.772 1.00 . A A . 19 TYR HE1 1 1 17 8562 1 1 13 TYR HE2 H -10.424 4.664 0.987 1.00 . A A . 19 TYR HE2 1 1 17 8563 1 1 13 TYR HH H -8.224 6.942 1.533 1.00 . A A . 19 TYR HH 1 1 17 8564 1 1 13 TYR N N -9.751 1.885 -3.932 1.00 . A A . 19 TYR N 1 1 17 8565 1 1 13 TYR O O -6.929 3.989 -4.508 1.00 . A A . 19 TYR O 1 1 17 8566 1 1 13 TYR OH O -8.215 5.983 1.487 1.00 . A A . 19 TYR OH 1 1 17 8567 1 1 14 LEU C C -5.061 1.694 -3.339 1.00 . A A . 20 LEU C 1 1 17 8568 1 1 14 LEU CA C -5.950 2.494 -2.394 1.00 . A A . 20 LEU CA 1 1 17 8569 1 1 14 LEU CB C -5.874 1.908 -0.983 1.00 . A A . 20 LEU CB 1 1 17 8570 1 1 14 LEU CD1 C -7.693 2.630 0.584 1.00 . A A . 20 LEU CD1 1 1 17 8571 1 1 14 LEU CD2 C -5.304 2.732 1.317 1.00 . A A . 20 LEU CD2 1 1 17 8572 1 1 14 LEU CG C -6.260 2.873 0.140 1.00 . A A . 20 LEU CG 1 1 17 8573 1 1 14 LEU H H -7.995 1.945 -2.413 1.00 . A A . 20 LEU H 1 1 17 8574 1 1 14 LEU HA H -5.600 3.516 -2.369 1.00 . A A . 20 LEU HA 1 1 17 8575 1 1 14 LEU HB2 H -6.530 1.051 -0.937 1.00 . A A . 20 LEU HB2 1 1 17 8576 1 1 14 LEU HB3 H -4.862 1.574 -0.810 1.00 . A A . 20 LEU HB3 1 1 17 8577 1 1 14 LEU HD11 H -7.817 1.590 0.848 1.00 . A A . 20 LEU HD11 1 1 17 8578 1 1 14 LEU HD12 H -7.914 3.247 1.442 1.00 . A A . 20 LEU HD12 1 1 17 8579 1 1 14 LEU HD13 H -8.367 2.879 -0.222 1.00 . A A . 20 LEU HD13 1 1 17 8580 1 1 14 LEU HD21 H -4.287 2.826 0.967 1.00 . A A . 20 LEU HD21 1 1 17 8581 1 1 14 LEU HD22 H -5.509 3.507 2.041 1.00 . A A . 20 LEU HD22 1 1 17 8582 1 1 14 LEU HD23 H -5.439 1.765 1.777 1.00 . A A . 20 LEU HD23 1 1 17 8583 1 1 14 LEU HG H -6.193 3.887 -0.227 1.00 . A A . 20 LEU HG 1 1 17 8584 1 1 14 LEU N N -7.330 2.506 -2.865 1.00 . A A . 20 LEU N 1 1 17 8585 1 1 14 LEU O O -5.551 0.926 -4.168 1.00 . A A . 20 LEU O 1 1 17 8586 1 1 15 GLU C C -1.566 0.754 -3.252 1.00 . A A . 21 GLU C 1 1 17 8587 1 1 15 GLU CA C -2.794 1.173 -4.054 1.00 . A A . 21 GLU CA 1 1 17 8588 1 1 15 GLU CB C -2.373 2.055 -5.230 1.00 . A A . 21 GLU CB 1 1 17 8589 1 1 15 GLU CD C -0.716 2.010 -7.136 1.00 . A A . 21 GLU CD 1 1 17 8590 1 1 15 GLU CG C -1.826 1.272 -6.413 1.00 . A A . 21 GLU CG 1 1 17 8591 1 1 15 GLU H H -3.421 2.504 -2.532 1.00 . A A . 21 GLU H 1 1 17 8592 1 1 15 GLU HA H -3.278 0.287 -4.436 1.00 . A A . 21 GLU HA 1 1 17 8593 1 1 15 GLU HB2 H -3.230 2.621 -5.566 1.00 . A A . 21 GLU HB2 1 1 17 8594 1 1 15 GLU HB3 H -1.609 2.741 -4.896 1.00 . A A . 21 GLU HB3 1 1 17 8595 1 1 15 GLU HG2 H -1.437 0.330 -6.056 1.00 . A A . 21 GLU HG2 1 1 17 8596 1 1 15 GLU HG3 H -2.630 1.088 -7.110 1.00 . A A . 21 GLU HG3 1 1 17 8597 1 1 15 GLU N N -3.751 1.878 -3.210 1.00 . A A . 21 GLU N 1 1 17 8598 1 1 15 GLU O O -0.443 0.783 -3.756 1.00 . A A . 21 GLU O 1 1 17 8599 1 1 15 GLU OE1 O 0.387 2.134 -6.563 1.00 . A A . 21 GLU OE1 1 1 17 8600 1 1 15 GLU OE2 O -0.949 2.462 -8.277 1.00 . A A . 21 GLU OE2 1 1 17 8601 1 1 16 GLY C C 0.326 1.049 -0.925 1.00 . A A . 22 GLY C 1 1 17 8602 1 1 16 GLY CA C -0.689 -0.054 -1.150 1.00 . A A . 22 GLY CA 1 1 17 8603 1 1 16 GLY H H -2.703 0.362 -1.652 1.00 . A A . 22 GLY H 1 1 17 8604 1 1 16 GLY HA2 H -1.086 -0.363 -0.194 1.00 . A A . 22 GLY HA2 1 1 17 8605 1 1 16 GLY HA3 H -0.193 -0.896 -1.610 1.00 . A A . 22 GLY HA3 1 1 17 8606 1 1 16 GLY N N -1.787 0.365 -2.000 1.00 . A A . 22 GLY N 1 1 17 8607 1 1 16 GLY O O 1.327 1.136 -1.637 1.00 . A A . 22 GLY O 1 1 17 8608 1 1 17 GLN C C 2.018 2.566 1.406 1.00 . A A . 23 GLN C 1 1 17 8609 1 1 17 GLN CA C 0.969 2.997 0.386 1.00 . A A . 23 GLN CA 1 1 17 8610 1 1 17 GLN CB C 0.176 4.188 0.926 1.00 . A A . 23 GLN CB 1 1 17 8611 1 1 17 GLN CD C 1.628 6.062 1.798 1.00 . A A . 23 GLN CD 1 1 17 8612 1 1 17 GLN CG C 0.820 5.532 0.629 1.00 . A A . 23 GLN CG 1 1 17 8613 1 1 17 GLN H H -0.744 1.771 0.601 1.00 . A A . 23 GLN H 1 1 17 8614 1 1 17 GLN HA H 1.468 3.290 -0.525 1.00 . A A . 23 GLN HA 1 1 17 8615 1 1 17 GLN HB2 H -0.810 4.180 0.484 1.00 . A A . 23 GLN HB2 1 1 17 8616 1 1 17 GLN HB3 H 0.081 4.088 1.997 1.00 . A A . 23 GLN HB3 1 1 17 8617 1 1 17 GLN HE21 H 3.152 4.881 1.311 1.00 . A A . 23 GLN HE21 1 1 17 8618 1 1 17 GLN HE22 H 3.391 5.882 2.699 1.00 . A A . 23 GLN HE22 1 1 17 8619 1 1 17 GLN HG2 H 1.476 5.423 -0.222 1.00 . A A . 23 GLN HG2 1 1 17 8620 1 1 17 GLN HG3 H 0.043 6.245 0.395 1.00 . A A . 23 GLN HG3 1 1 17 8621 1 1 17 GLN N N 0.069 1.893 0.069 1.00 . A A . 23 GLN N 1 1 17 8622 1 1 17 GLN NE2 N 2.847 5.558 1.951 1.00 . A A . 23 GLN NE2 1 1 17 8623 1 1 17 GLN O O 3.185 2.946 1.309 1.00 . A A . 23 GLN O 1 1 17 8624 1 1 17 GLN OE1 O 1.163 6.915 2.553 1.00 . A A . 23 GLN OE1 1 1 17 8625 1 1 18 ALA C C 3.634 0.458 2.828 1.00 . A A . 24 ALA C 1 1 17 8626 1 1 18 ALA CA C 2.496 1.285 3.420 1.00 . A A . 24 ALA CA 1 1 17 8627 1 1 18 ALA CB C 1.726 0.464 4.444 1.00 . A A . 24 ALA CB 1 1 17 8628 1 1 18 ALA H H 0.652 1.501 2.404 1.00 . A A . 24 ALA H 1 1 17 8629 1 1 18 ALA HA H 2.913 2.144 3.925 1.00 . A A . 24 ALA HA 1 1 17 8630 1 1 18 ALA HB1 H 1.174 -0.315 3.939 1.00 . A A . 24 ALA HB1 1 1 17 8631 1 1 18 ALA HB2 H 2.418 0.019 5.143 1.00 . A A . 24 ALA HB2 1 1 17 8632 1 1 18 ALA HB3 H 1.038 1.105 4.976 1.00 . A A . 24 ALA HB3 1 1 17 8633 1 1 18 ALA N N 1.594 1.769 2.382 1.00 . A A . 24 ALA N 1 1 17 8634 1 1 18 ALA O O 4.671 0.269 3.463 1.00 . A A . 24 ALA O 1 1 17 8635 1 1 19 ALA C C 5.588 0.017 0.406 1.00 . A A . 25 ALA C 1 1 17 8636 1 1 19 ALA CA C 4.444 -0.845 0.937 1.00 . A A . 25 ALA CA 1 1 17 8637 1 1 19 ALA CB C 3.808 -1.637 -0.195 1.00 . A A . 25 ALA CB 1 1 17 8638 1 1 19 ALA H H 2.586 0.144 1.153 1.00 . A A . 25 ALA H 1 1 17 8639 1 1 19 ALA HA H 4.840 -1.547 1.656 1.00 . A A . 25 ALA HA 1 1 17 8640 1 1 19 ALA HB1 H 2.751 -1.753 -0.004 1.00 . A A . 25 ALA HB1 1 1 17 8641 1 1 19 ALA HB2 H 3.950 -1.111 -1.127 1.00 . A A . 25 ALA HB2 1 1 17 8642 1 1 19 ALA HB3 H 4.270 -2.611 -0.257 1.00 . A A . 25 ALA HB3 1 1 17 8643 1 1 19 ALA N N 3.434 -0.036 1.610 1.00 . A A . 25 ALA N 1 1 17 8644 1 1 19 ALA O O 6.678 -0.484 0.134 1.00 . A A . 25 ALA O 1 1 17 8645 1 1 20 LYS C C 7.171 2.842 0.884 1.00 . A A . 26 LYS C 1 1 17 8646 1 1 20 LYS CA C 6.346 2.235 -0.252 1.00 . A A . 26 LYS CA 1 1 17 8647 1 1 20 LYS CB C 5.684 3.348 -1.069 1.00 . A A . 26 LYS CB 1 1 17 8648 1 1 20 LYS CD C 4.574 2.051 -2.918 1.00 . A A . 26 LYS CD 1 1 17 8649 1 1 20 LYS CE C 5.133 0.916 -3.762 1.00 . A A . 26 LYS CE 1 1 17 8650 1 1 20 LYS CG C 5.650 3.066 -2.563 1.00 . A A . 26 LYS CG 1 1 17 8651 1 1 20 LYS HA H 7.007 1.677 -0.898 1.00 . A A . 26 LYS HA 1 1 17 8652 1 1 20 LYS HB2 H 4.668 3.475 -0.726 1.00 . A A . 26 LYS HB2 1 1 17 8653 1 1 20 LYS HD2 H 4.164 1.640 -2.008 1.00 . A A . 26 LYS HD2 1 1 17 8654 1 1 20 LYS HE2 H 4.315 0.415 -4.257 1.00 . A A . 26 LYS HE2 1 1 17 8655 1 1 20 LYS HG2 H 5.448 3.988 -3.088 1.00 . A A . 26 LYS HG2 1 1 17 8656 1 1 20 LYS HZ1 H 6.578 0.282 -2.375 1.00 . A A . 26 LYS HZ1 1 1 17 8657 1 1 20 LYS N N 5.334 1.312 0.252 1.00 . A A . 26 LYS N 1 1 17 8658 1 1 20 LYS NZ N 5.863 -0.056 -2.954 1.00 . A A . 26 LYS NZ 1 1 17 8659 1 1 20 LYS O O 8.263 3.361 0.656 1.00 . A A . 26 LYS O 1 1 17 8660 1 1 21 GLU C C 8.551 2.537 3.662 1.00 . A A . 27 GLU C 1 1 17 8661 1 1 21 GLU CA C 7.327 3.361 3.259 1.00 . A A . 27 GLU CA 1 1 17 8662 1 1 21 GLU CB C 6.363 3.473 4.445 1.00 . A A . 27 GLU CB 1 1 17 8663 1 1 21 GLU CD C 4.679 2.037 5.668 1.00 . A A . 27 GLU CD 1 1 17 8664 1 1 21 GLU CG C 6.103 2.156 5.162 1.00 . A A . 27 GLU CG 1 1 17 8665 1 1 21 GLU H H 5.758 2.383 2.224 1.00 . A A . 27 GLU H 1 1 17 8666 1 1 21 GLU HA H 7.656 4.352 2.989 1.00 . A A . 27 GLU HA 1 1 17 8667 1 1 21 GLU HB2 H 6.774 4.169 5.161 1.00 . A A . 27 GLU HB2 1 1 17 8668 1 1 21 GLU HB3 H 5.418 3.855 4.089 1.00 . A A . 27 GLU HB3 1 1 17 8669 1 1 21 GLU HG2 H 6.295 1.345 4.478 1.00 . A A . 27 GLU HG2 1 1 17 8670 1 1 21 GLU HG3 H 6.776 2.082 6.004 1.00 . A A . 27 GLU HG3 1 1 17 8671 1 1 21 GLU N N 6.639 2.794 2.101 1.00 . A A . 27 GLU N 1 1 17 8672 1 1 21 GLU O O 9.550 3.087 4.126 1.00 . A A . 27 GLU O 1 1 17 8673 1 1 21 GLU OE1 O 3.970 3.065 5.696 1.00 . A A . 27 GLU OE1 1 1 17 8674 1 1 21 GLU OE2 O 4.272 0.915 6.037 1.00 . A A . 27 GLU OE2 1 1 17 8675 1 1 22 PHE C C 10.813 0.600 3.031 1.00 . A A . 28 PHE C 1 1 17 8676 1 1 22 PHE CA C 9.564 0.337 3.876 1.00 . A A . 28 PHE CA 1 1 17 8677 1 1 22 PHE CB C 9.123 -1.131 3.773 1.00 . A A . 28 PHE CB 1 1 17 8678 1 1 22 PHE CD1 C 10.724 -2.181 2.147 1.00 . A A . 28 PHE CD1 1 1 17 8679 1 1 22 PHE CD2 C 8.430 -2.022 1.531 1.00 . A A . 28 PHE CD2 1 1 17 8680 1 1 22 PHE CE1 C 11.011 -2.789 0.940 1.00 . A A . 28 PHE CE1 1 1 17 8681 1 1 22 PHE CE2 C 8.711 -2.629 0.324 1.00 . A A . 28 PHE CE2 1 1 17 8682 1 1 22 PHE CG C 9.432 -1.791 2.456 1.00 . A A . 28 PHE CG 1 1 17 8683 1 1 22 PHE CZ C 10.003 -3.012 0.027 1.00 . A A . 28 PHE CZ 1 1 17 8684 1 1 22 PHE H H 7.639 0.834 3.142 1.00 . A A . 28 PHE H 1 1 17 8685 1 1 22 PHE HA H 9.807 0.548 4.907 1.00 . A A . 28 PHE HA 1 1 17 8686 1 1 22 PHE HB2 H 9.615 -1.699 4.547 1.00 . A A . 28 PHE HB2 1 1 17 8687 1 1 22 PHE HB3 H 8.054 -1.181 3.925 1.00 . A A . 28 PHE HB3 1 1 17 8688 1 1 22 PHE HD1 H 7.419 -1.723 1.760 1.00 . A A . 28 PHE HD1 1 1 17 8689 1 1 22 PHE HD2 H 11.512 -2.006 2.862 1.00 . A A . 28 PHE HD2 1 1 17 8690 1 1 22 PHE HE1 H 7.921 -2.804 -0.386 1.00 . A A . 28 PHE HE1 1 1 17 8691 1 1 22 PHE HE2 H 12.022 -3.088 0.711 1.00 . A A . 28 PHE HE2 1 1 17 8692 1 1 22 PHE HZ H 10.223 -3.487 -0.918 1.00 . A A . 28 PHE HZ 1 1 17 8693 1 1 22 PHE N N 8.464 1.221 3.503 1.00 . A A . 28 PHE N 1 1 17 8694 1 1 22 PHE O O 11.935 0.525 3.532 1.00 . A A . 28 PHE O 1 1 17 8695 1 1 23 ILE C C 12.611 2.320 1.386 1.00 . A A . 29 ILE C 1 1 17 8696 1 1 23 ILE CA C 11.735 1.187 0.852 1.00 . A A . 29 ILE CA 1 1 17 8697 1 1 23 ILE CB C 11.251 1.532 -0.573 1.00 . A A . 29 ILE CB 1 1 17 8698 1 1 23 ILE CD1 C 12.006 1.663 -3.001 1.00 . A A . 29 ILE CD1 1 1 17 8699 1 1 23 ILE CG1 C 12.418 1.456 -1.559 1.00 . A A . 29 ILE CG1 1 1 17 8700 1 1 23 ILE CG2 C 10.604 2.911 -0.611 1.00 . A A . 29 ILE CG2 1 1 17 8701 1 1 23 ILE H H 9.700 0.960 1.407 1.00 . A A . 29 ILE H 1 1 17 8702 1 1 23 ILE HA H 12.339 0.287 0.795 1.00 . A A . 29 ILE HA 1 1 17 8703 1 1 23 ILE HB H 10.503 0.807 -0.859 1.00 . A A . 29 ILE HB 1 1 17 8704 1 1 23 ILE HD11 H 11.032 2.128 -3.034 1.00 . A A . 29 ILE HD11 1 1 17 8705 1 1 23 ILE HD12 H 12.727 2.300 -3.493 1.00 . A A . 29 ILE HD12 1 1 17 8706 1 1 23 ILE HD13 H 11.967 0.708 -3.504 1.00 . A A . 29 ILE HD13 1 1 17 8707 1 1 23 ILE HG12 H 13.142 2.217 -1.309 1.00 . A A . 29 ILE HG12 1 1 17 8708 1 1 23 ILE HG13 H 12.882 0.484 -1.482 1.00 . A A . 29 ILE HG13 1 1 17 8709 1 1 23 ILE HG21 H 10.483 3.280 0.397 1.00 . A A . 29 ILE HG21 1 1 17 8710 1 1 23 ILE HG22 H 11.232 3.589 -1.170 1.00 . A A . 29 ILE HG22 1 1 17 8711 1 1 23 ILE HG23 H 9.636 2.842 -1.087 1.00 . A A . 29 ILE HG23 1 1 17 8712 1 1 23 ILE N N 10.616 0.912 1.752 1.00 . A A . 29 ILE N 1 1 17 8713 1 1 23 ILE O O 13.764 2.468 0.986 1.00 . A A . 29 ILE O 1 1 17 8714 1 1 24 ALA C C 13.839 3.701 3.881 1.00 . A A . 30 ALA C 1 1 17 8715 1 1 24 ALA CA C 12.810 4.221 2.877 1.00 . A A . 30 ALA CA 1 1 17 8716 1 1 24 ALA CB C 11.864 5.206 3.548 1.00 . A A . 30 ALA CB 1 1 17 8717 1 1 24 ALA H H 11.140 2.962 2.578 1.00 . A A . 30 ALA H 1 1 17 8718 1 1 24 ALA HA H 13.326 4.737 2.080 1.00 . A A . 30 ALA HA 1 1 17 8719 1 1 24 ALA HB1 H 10.871 5.085 3.141 1.00 . A A . 30 ALA HB1 1 1 17 8720 1 1 24 ALA HB2 H 11.843 5.017 4.611 1.00 . A A . 30 ALA HB2 1 1 17 8721 1 1 24 ALA HB3 H 12.207 6.214 3.368 1.00 . A A . 30 ALA HB3 1 1 17 8722 1 1 24 ALA N N 12.063 3.119 2.291 1.00 . A A . 30 ALA N 1 1 17 8723 1 1 24 ALA O O 14.790 4.400 4.229 1.00 . A A . 30 ALA O 1 1 17 8724 1 1 25 TRP C C 15.776 1.267 4.663 1.00 . A A . 31 TRP C 1 1 17 8725 1 1 25 TRP CA C 14.526 1.857 5.328 1.00 . A A . 31 TRP CA 1 1 17 8726 1 1 25 TRP CB C 13.758 0.792 6.139 1.00 . A A . 31 TRP CB 1 1 17 8727 1 1 25 TRP CD1 C 15.610 -0.939 6.566 1.00 . A A . 31 TRP CD1 1 1 17 8728 1 1 25 TRP CD2 C 13.741 -1.793 5.675 1.00 . A A . 31 TRP CD2 1 1 17 8729 1 1 25 TRP CE2 C 14.669 -2.836 5.857 1.00 . A A . 31 TRP CE2 1 1 17 8730 1 1 25 TRP CE3 C 12.489 -2.095 5.128 1.00 . A A . 31 TRP CE3 1 1 17 8731 1 1 25 TRP CG C 14.364 -0.585 6.131 1.00 . A A . 31 TRP CG 1 1 17 8732 1 1 25 TRP CH2 C 13.151 -4.421 4.981 1.00 . A A . 31 TRP CH2 1 1 17 8733 1 1 25 TRP CZ2 C 14.383 -4.156 5.512 1.00 . A A . 31 TRP CZ2 1 1 17 8734 1 1 25 TRP CZ3 C 12.209 -3.405 4.787 1.00 . A A . 31 TRP CZ3 1 1 17 8735 1 1 25 TRP H H 12.849 1.968 4.046 1.00 . A A . 31 TRP H 1 1 17 8736 1 1 25 TRP HA H 14.844 2.637 6.005 1.00 . A A . 31 TRP HA 1 1 17 8737 1 1 25 TRP HB2 H 13.700 1.115 7.167 1.00 . A A . 31 TRP HB2 1 1 17 8738 1 1 25 TRP HB3 H 12.755 0.714 5.743 1.00 . A A . 31 TRP HB3 1 1 17 8739 1 1 25 TRP HD1 H 16.331 -0.245 6.973 1.00 . A A . 31 TRP HD1 1 1 17 8740 1 1 25 TRP HE1 H 16.616 -2.781 6.636 1.00 . A A . 31 TRP HE1 1 1 17 8741 1 1 25 TRP HE3 H 11.747 -1.328 4.969 1.00 . A A . 31 TRP HE3 1 1 17 8742 1 1 25 TRP HH2 H 12.889 -5.430 4.700 1.00 . A A . 31 TRP HH2 1 1 17 8743 1 1 25 TRP HZ2 H 15.098 -4.952 5.655 1.00 . A A . 31 TRP HZ2 1 1 17 8744 1 1 25 TRP HZ3 H 11.247 -3.656 4.364 1.00 . A A . 31 TRP HZ3 1 1 17 8745 1 1 25 TRP N N 13.631 2.471 4.353 1.00 . A A . 31 TRP N 1 1 17 8746 1 1 25 TRP NE1 N 15.802 -2.289 6.401 1.00 . A A . 31 TRP NE1 1 1 17 8747 1 1 25 TRP O O 16.896 1.670 4.976 1.00 . A A . 31 TRP O 1 1 17 8748 1 1 26 LEU C C 17.518 0.681 2.255 1.00 . A A . 32 LEU C 1 1 17 8749 1 1 26 LEU CA C 16.724 -0.327 3.087 1.00 . A A . 32 LEU CA 1 1 17 8750 1 1 26 LEU CB C 16.288 -1.520 2.215 1.00 . A A . 32 LEU CB 1 1 17 8751 1 1 26 LEU CD1 C 13.798 -1.770 2.151 1.00 . A A . 32 LEU CD1 1 1 17 8752 1 1 26 LEU CD2 C 14.890 0.086 0.879 1.00 . A A . 32 LEU CD2 1 1 17 8753 1 1 26 LEU CG C 15.027 -1.343 1.367 1.00 . A A . 32 LEU CG 1 1 17 8754 1 1 26 LEU H H 14.679 0.011 3.552 1.00 . A A . 32 LEU H 1 1 17 8755 1 1 26 LEU HA H 17.378 -0.699 3.863 1.00 . A A . 32 LEU HA 1 1 17 8756 1 1 26 LEU HB2 H 17.099 -1.757 1.547 1.00 . A A . 32 LEU HB2 1 1 17 8757 1 1 26 LEU HB3 H 16.128 -2.364 2.867 1.00 . A A . 32 LEU HB3 1 1 17 8758 1 1 26 LEU HD11 H 14.021 -1.755 3.206 1.00 . A A . 32 LEU HD11 1 1 17 8759 1 1 26 LEU HD12 H 12.985 -1.092 1.945 1.00 . A A . 32 LEU HD12 1 1 17 8760 1 1 26 LEU HD13 H 13.517 -2.770 1.859 1.00 . A A . 32 LEU HD13 1 1 17 8761 1 1 26 LEU HD21 H 15.831 0.416 0.464 1.00 . A A . 32 LEU HD21 1 1 17 8762 1 1 26 LEU HD22 H 14.126 0.136 0.119 1.00 . A A . 32 LEU HD22 1 1 17 8763 1 1 26 LEU HD23 H 14.617 0.721 1.707 1.00 . A A . 32 LEU HD23 1 1 17 8764 1 1 26 LEU HG H 15.100 -1.983 0.500 1.00 . A A . 32 LEU HG 1 1 17 8765 1 1 26 LEU N N 15.589 0.305 3.759 1.00 . A A . 32 LEU N 1 1 17 8766 1 1 26 LEU O O 18.678 0.441 1.924 1.00 . A A . 32 LEU O 1 1 17 8767 1 1 27 VAL C C 18.360 3.784 2.051 1.00 . A A . 33 VAL C 1 1 17 8768 1 1 27 VAL CA C 17.568 2.842 1.144 1.00 . A A . 33 VAL CA 1 1 17 8769 1 1 27 VAL CB C 16.561 3.657 0.299 1.00 . A A . 33 VAL CB 1 1 17 8770 1 1 27 VAL CG1 C 17.190 4.946 -0.216 1.00 . A A . 33 VAL CG1 1 1 17 8771 1 1 27 VAL CG2 C 16.042 2.820 -0.860 1.00 . A A . 33 VAL CG2 1 1 17 8772 1 1 27 VAL H H 15.976 1.956 2.221 1.00 . A A . 33 VAL H 1 1 17 8773 1 1 27 VAL HA H 18.256 2.350 0.470 1.00 . A A . 33 VAL HA 1 1 17 8774 1 1 27 VAL HB H 15.723 3.918 0.928 1.00 . A A . 33 VAL HB 1 1 17 8775 1 1 27 VAL HG11 H 18.146 4.724 -0.666 1.00 . A A . 33 VAL HG11 1 1 17 8776 1 1 27 VAL HG12 H 16.540 5.394 -0.954 1.00 . A A . 33 VAL HG12 1 1 17 8777 1 1 27 VAL HG13 H 17.328 5.632 0.606 1.00 . A A . 33 VAL HG13 1 1 17 8778 1 1 27 VAL HG21 H 16.869 2.320 -1.341 1.00 . A A . 33 VAL HG21 1 1 17 8779 1 1 27 VAL HG22 H 15.344 2.085 -0.490 1.00 . A A . 33 VAL HG22 1 1 17 8780 1 1 27 VAL HG23 H 15.545 3.461 -1.573 1.00 . A A . 33 VAL HG23 1 1 17 8781 1 1 27 VAL N N 16.898 1.810 1.926 1.00 . A A . 33 VAL N 1 1 17 8782 1 1 27 VAL O O 19.283 4.462 1.601 1.00 . A A . 33 VAL O 1 1 17 8783 1 1 28 ARG C C 19.547 3.854 5.236 1.00 . A A . 34 ARG C 1 1 17 8784 1 1 28 ARG CA C 18.674 4.677 4.294 1.00 . A A . 34 ARG CA 1 1 17 8785 1 1 28 ARG CB C 17.652 5.484 5.098 1.00 . A A . 34 ARG CB 1 1 17 8786 1 1 28 ARG CD C 17.285 7.557 6.478 1.00 . A A . 34 ARG CD 1 1 17 8787 1 1 28 ARG CG C 18.067 6.926 5.335 1.00 . A A . 34 ARG CG 1 1 17 8788 1 1 28 ARG CZ C 15.310 6.200 7.077 1.00 . A A . 34 ARG CZ 1 1 17 8789 1 1 28 ARG H H 17.252 3.257 3.633 1.00 . A A . 34 ARG H 1 1 17 8790 1 1 28 ARG HA H 19.304 5.360 3.744 1.00 . A A . 34 ARG HA 1 1 17 8791 1 1 28 ARG HB2 H 16.712 5.485 4.566 1.00 . A A . 34 ARG HB2 1 1 17 8792 1 1 28 ARG HB3 H 17.510 5.010 6.058 1.00 . A A . 34 ARG HB3 1 1 17 8793 1 1 28 ARG HD2 H 17.695 7.208 7.414 1.00 . A A . 34 ARG HD2 1 1 17 8794 1 1 28 ARG HD3 H 17.394 8.630 6.419 1.00 . A A . 34 ARG HD3 1 1 17 8795 1 1 28 ARG HE H 15.287 7.791 5.873 1.00 . A A . 34 ARG HE 1 1 17 8796 1 1 28 ARG HG2 H 19.119 6.952 5.576 1.00 . A A . 34 ARG HG2 1 1 17 8797 1 1 28 ARG HG3 H 17.888 7.493 4.433 1.00 . A A . 34 ARG HG3 1 1 17 8798 1 1 28 ARG HH11 H 17.036 5.556 7.914 1.00 . A A . 34 ARG HH11 1 1 17 8799 1 1 28 ARG HH12 H 15.628 4.635 8.318 1.00 . A A . 34 ARG HH12 1 1 17 8800 1 1 28 ARG HH21 H 13.442 6.575 6.406 1.00 . A A . 34 ARG HH21 1 1 17 8801 1 1 28 ARG HH22 H 13.591 5.210 7.462 1.00 . A A . 34 ARG HH22 1 1 17 8802 1 1 28 ARG N N 17.995 3.820 3.330 1.00 . A A . 34 ARG N 1 1 17 8803 1 1 28 ARG NE N 15.863 7.222 6.424 1.00 . A A . 34 ARG NE 1 1 17 8804 1 1 28 ARG NH1 N 16.054 5.398 7.831 1.00 . A A . 34 ARG NH1 1 1 17 8805 1 1 28 ARG NH2 N 14.007 5.977 6.973 1.00 . A A . 34 ARG NH2 1 1 17 8806 1 1 28 ARG O O 19.129 3.505 6.340 1.00 . A A . 34 ARG O 1 1 17 8807 1 1 29 GLY C C 22.091 1.472 4.947 1.00 . A A . 35 GLY C 1 1 17 8808 1 1 29 GLY CA C 21.675 2.770 5.611 1.00 . A A . 35 GLY CA 1 1 17 8809 1 1 29 GLY H H 21.043 3.854 3.906 1.00 . A A . 35 GLY H 1 1 17 8810 1 1 29 GLY HA2 H 22.559 3.360 5.805 1.00 . A A . 35 GLY HA2 1 1 17 8811 1 1 29 GLY HA3 H 21.195 2.542 6.552 1.00 . A A . 35 GLY HA3 1 1 17 8812 1 1 29 GLY N N 20.763 3.548 4.794 1.00 . A A . 35 GLY N 1 1 17 8813 1 1 29 GLY O O 23.263 1.280 4.622 1.00 . A A . 35 GLY O 1 1 17 8814 1 1 30 ARG C C 22.023 -0.527 2.736 1.00 . A A . 36 ARG C 1 1 17 8815 1 1 30 ARG CA C 21.401 -0.712 4.117 1.00 . A A . 36 ARG CA 1 1 17 8816 1 1 30 ARG CB C 20.114 -1.530 4.001 1.00 . A A . 36 ARG CB 1 1 17 8817 1 1 30 ARG CD C 19.418 -3.635 2.808 1.00 . A A . 36 ARG CD 1 1 17 8818 1 1 30 ARG CG C 20.356 -3.023 3.837 1.00 . A A . 36 ARG CG 1 1 17 8819 1 1 30 ARG CZ C 17.881 -5.558 2.691 1.00 . A A . 36 ARG CZ 1 1 17 8820 1 1 30 ARG H H 20.214 0.787 5.027 1.00 . A A . 36 ARG H 1 1 17 8821 1 1 30 ARG HA H 22.100 -1.244 4.744 1.00 . A A . 36 ARG HA 1 1 17 8822 1 1 30 ARG HB2 H 19.524 -1.379 4.893 1.00 . A A . 36 ARG HB2 1 1 17 8823 1 1 30 ARG HB3 H 19.555 -1.181 3.146 1.00 . A A . 36 ARG HB3 1 1 17 8824 1 1 30 ARG HD2 H 18.812 -2.851 2.378 1.00 . A A . 36 ARG HD2 1 1 17 8825 1 1 30 ARG HD3 H 20.009 -4.097 2.031 1.00 . A A . 36 ARG HD3 1 1 17 8826 1 1 30 ARG HE H 18.436 -4.637 4.372 1.00 . A A . 36 ARG HE 1 1 17 8827 1 1 30 ARG HG2 H 21.375 -3.179 3.517 1.00 . A A . 36 ARG HG2 1 1 17 8828 1 1 30 ARG HG3 H 20.198 -3.510 4.789 1.00 . A A . 36 ARG HG3 1 1 17 8829 1 1 30 ARG HH11 H 18.579 -4.933 0.898 1.00 . A A . 36 ARG HH11 1 1 17 8830 1 1 30 ARG HH12 H 17.499 -6.286 0.844 1.00 . A A . 36 ARG HH12 1 1 17 8831 1 1 30 ARG HH21 H 17.015 -6.415 4.304 1.00 . A A . 36 ARG HH21 1 1 17 8832 1 1 30 ARG HH22 H 16.610 -7.127 2.777 1.00 . A A . 36 ARG HH22 1 1 17 8833 1 1 30 ARG N N 21.129 0.577 4.745 1.00 . A A . 36 ARG N 1 1 17 8834 1 1 30 ARG NE N 18.540 -4.642 3.398 1.00 . A A . 36 ARG NE 1 1 17 8835 1 1 30 ARG NH1 N 17.996 -5.595 1.369 1.00 . A A . 36 ARG NH1 1 1 17 8836 1 1 30 ARG NH2 N 17.105 -6.439 3.308 1.00 . A A . 36 ARG NH2 1 1 17 8837 1 1 30 ARG O O 23.171 -0.907 2.505 1.00 . A A . 36 ARG O 1 1 17 8838 1 1 31 GLY C C 20.788 1.098 -0.366 1.00 . A A . 37 GLY C 1 1 17 8839 1 1 31 GLY CA C 21.749 0.282 0.475 1.00 . A A . 37 GLY CA 1 1 17 8840 1 1 31 GLY H H 20.350 0.340 2.063 1.00 . A A . 37 GLY H 1 1 17 8841 1 1 31 GLY HA2 H 22.693 0.804 0.531 1.00 . A A . 37 GLY HA2 1 1 17 8842 1 1 31 GLY HA3 H 21.906 -0.674 -0.003 1.00 . A A . 37 GLY HA3 1 1 17 8843 1 1 31 GLY N N 21.257 0.058 1.821 1.00 . A A . 37 GLY N 1 1 17 8844 1 1 31 GLY O O 19.586 0.759 -0.391 1.00 . A A . 37 GLY O 1 1 17 8845 1 1 31 GLY OXT O 21.236 2.077 -0.999 1.00 . A A . 37 GLY OXT 1 1 17 8846 2 2 1 . C02 C 6.317 -5.123 0.860 1.00 . B A . 1038 D6M C02 1 1 17 8847 2 2 1 . C04 C 5.794 -4.723 -1.485 1.00 . B A . 1038 D6M C04 1 1 17 8848 2 2 1 . C05 C 6.315 -3.765 -2.560 1.00 . B A . 1038 D6M C05 1 1 17 8849 2 2 1 . C06 C 6.409 -2.319 -2.097 1.00 . B A . 1038 D6M C06 1 1 17 8850 2 2 1 . C07 C 5.613 -1.361 -2.962 1.00 . B A . 1038 D6M C07 1 1 17 8851 2 2 1 . C09 C 5.574 -6.107 -2.087 1.00 . B A . 1038 D6M C09 1 1 17 8852 2 2 1 . C12 C 7.260 -5.103 2.050 1.00 . B A . 1038 D6M C12 1 1 17 8853 2 2 1 . C13 C 8.641 -5.649 1.721 1.00 . B A . 1038 D6M C13 1 1 17 8854 2 2 1 . C14 C 9.608 -5.457 2.882 1.00 . B A . 1038 D6M C14 1 1 17 8855 2 2 1 . C15 C 10.700 -6.515 2.879 1.00 . B A . 1038 D6M C15 1 1 17 8856 2 2 1 . C16 C 12.011 -5.961 2.343 1.00 . B A . 1038 D6M C16 1 1 17 8857 2 2 1 . C17 C 12.216 -6.331 0.883 1.00 . B A . 1038 D6M C17 1 1 17 8858 2 2 1 . C18 C 13.580 -5.883 0.379 1.00 . B A . 1038 D6M C18 1 1 17 8859 2 2 1 . C19 C 13.477 -5.173 -0.963 1.00 . B A . 1038 D6M C19 1 1 17 8860 2 2 1 . C20 C 14.234 -3.855 -0.956 1.00 . B A . 1038 D6M C20 1 1 17 8861 2 2 1 . C21 C 14.304 -3.245 -2.347 1.00 . B A . 1038 D6M C21 1 1 17 8862 2 2 1 . C22 C 14.110 -1.738 -2.304 1.00 . B A . 1038 D6M C22 1 1 17 8863 2 2 1 . C23 C 15.018 -1.031 -3.297 1.00 . B A . 1038 D6M C23 1 1 17 8864 2 2 1 . C24 C 15.334 0.388 -2.852 1.00 . B A . 1038 D6M C24 1 1 17 8865 2 2 1 . C25 C 16.460 0.992 -3.674 1.00 . B A . 1038 D6M C25 1 1 17 8866 2 2 1 . C26 C 16.090 1.095 -5.138 1.00 . B A . 1038 D6M C26 1 1 17 8867 2 2 1 . H03 H 7.688 -4.737 -0.541 1.00 . B A . 1038 D6M H03 1 1 17 8868 2 2 1 . H04 H 4.851 -4.353 -1.111 1.00 . B A . 1038 D6M H04 1 1 17 8869 2 2 1 . HP21 H 6.830 -5.702 2.839 1.00 . B A . 1038 D6M HP21 1 1 17 8870 2 2 1 . HP22 H 7.363 -4.084 2.391 1.00 . B A . 1038 D6M HP22 1 1 17 8871 2 2 1 . HP31 H 9.026 -5.131 0.855 1.00 . B A . 1038 D6M HP31 1 1 17 8872 2 2 1 . HP32 H 8.559 -6.703 1.506 1.00 . B A . 1038 D6M HP32 1 1 17 8873 2 2 1 . HP41 H 9.059 -5.523 3.810 1.00 . B A . 1038 D6M HP41 1 1 17 8874 2 2 1 . HP42 H 10.066 -4.482 2.801 1.00 . B A . 1038 D6M HP42 1 1 17 8875 2 2 1 . HP51 H 10.387 -7.340 2.256 1.00 . B A . 1038 D6M HP51 1 1 17 8876 2 2 1 . HP52 H 10.855 -6.861 3.889 1.00 . B A . 1038 D6M HP52 1 1 17 8877 2 2 1 . HP61 H 12.826 -6.363 2.926 1.00 . B A . 1038 D6M HP61 1 1 17 8878 2 2 1 . HP62 H 11.999 -4.884 2.433 1.00 . B A . 1038 D6M HP62 1 1 17 8879 2 2 1 . HP71 H 11.448 -5.857 0.290 1.00 . B A . 1038 D6M HP71 1 1 17 8880 2 2 1 . HP72 H 12.141 -7.404 0.780 1.00 . B A . 1038 D6M HP72 1 1 17 8881 2 2 1 . HP81 H 14.214 -6.751 0.269 1.00 . B A . 1038 D6M HP81 1 1 17 8882 2 2 1 . HP82 H 14.015 -5.207 1.100 1.00 . B A . 1038 D6M HP82 1 1 17 8883 2 2 1 . HP91 H 12.436 -4.978 -1.179 1.00 . B A . 1038 D6M HP91 1 1 17 8884 2 2 1 . HP92 H 13.892 -5.810 -1.729 1.00 . B A . 1038 D6M HP92 1 1 17 8885 2 2 1 . HPA1 H 15.238 -4.030 -0.598 1.00 . B A . 1038 D6M HPA1 1 1 17 8886 2 2 1 . HPA2 H 13.730 -3.165 -0.297 1.00 . B A . 1038 D6M HPA2 1 1 17 8887 2 2 1 . HPB1 H 13.530 -3.681 -2.961 1.00 . B A . 1038 D6M HPB1 1 1 17 8888 2 2 1 . HPB2 H 15.271 -3.461 -2.776 1.00 . B A . 1038 D6M HPB2 1 1 17 8889 2 2 1 . HPC1 H 14.335 -1.383 -1.308 1.00 . B A . 1038 D6M HPC1 1 1 17 8890 2 2 1 . HPC2 H 13.083 -1.509 -2.546 1.00 . B A . 1038 D6M HPC2 1 1 17 8891 2 2 1 . HPD1 H 14.526 -0.997 -4.258 1.00 . B A . 1038 D6M HPD1 1 1 17 8892 2 2 1 . HPD2 H 15.942 -1.584 -3.383 1.00 . B A . 1038 D6M HPD2 1 1 17 8893 2 2 1 . HPE1 H 15.627 0.371 -1.812 1.00 . B A . 1038 D6M HPE1 1 1 17 8894 2 2 1 . HPE2 H 14.450 0.996 -2.969 1.00 . B A . 1038 D6M HPE2 1 1 17 8895 2 2 1 . HPF1 H 17.338 0.368 -3.584 1.00 . B A . 1038 D6M HPF1 1 1 17 8896 2 2 1 . HPF2 H 16.676 1.983 -3.307 1.00 . B A . 1038 D6M HPF2 1 1 17 8897 2 2 1 . HPG1 H 15.017 1.036 -5.243 1.00 . B A . 1038 D6M HPG1 1 1 17 8898 2 2 1 . HPG2 H 16.550 0.285 -5.684 1.00 . B A . 1038 D6M HPG2 1 1 17 8899 2 2 1 . HPG3 H 16.439 2.038 -5.532 1.00 . B A . 1038 D6M HPG3 1 1 17 8900 2 2 1 . HQ21 H 6.040 -2.254 -1.084 1.00 . B A . 1038 D6M HQ21 1 1 17 8901 2 2 1 . HQ22 H 7.445 -2.017 -2.118 1.00 . B A . 1038 D6M HQ22 1 1 17 8902 2 2 1 . HQ31 H 7.300 -4.086 -2.862 1.00 . B A . 1038 D6M HQ31 1 1 17 8903 2 2 1 . HQ32 H 5.654 -3.806 -3.413 1.00 . B A . 1038 D6M HQ32 1 1 17 8904 2 2 1 . N03 N 6.726 -4.787 -0.361 1.00 . B A . 1038 D6M N03 1 1 17 8905 2 2 1 . O01 O 5.133 -5.392 1.065 1.00 . B A . 1038 D6M O01 1 1 17 8906 2 2 1 . O08 O 4.721 -1.820 -3.676 1.00 . B A . 1038 D6M O08 1 1 17 8907 2 2 1 . O10 O 4.462 -6.360 -2.596 1.00 . B A . 1038 D6M O10 1 1 17 8908 2 2 1 . O11 O 6.516 -6.927 -2.044 1.00 . B A . 1038 D6M O11 1 1 18 8909 1 1 1 HIS C C -26.498 -2.212 -2.329 1.00 . A A . 7 HIS C 1 1 18 8910 1 1 1 HIS CA C -26.825 -1.174 -3.398 1.00 . A A . 7 HIS CA 1 1 18 8911 1 1 1 HIS CB C -26.406 0.219 -2.925 1.00 . A A . 7 HIS CB 1 1 18 8912 1 1 1 HIS CD2 C -28.350 1.496 -1.776 1.00 . A A . 7 HIS CD2 1 1 18 8913 1 1 1 HIS CE1 C -27.827 1.065 0.309 1.00 . A A . 7 HIS CE1 1 1 18 8914 1 1 1 HIS CG C -27.229 0.736 -1.786 1.00 . A A . 7 HIS CG 1 1 18 8915 1 1 1 HIS H1 H -28.792 -1.119 -2.795 1.00 . A A . 7 HIS H1 1 1 18 8916 1 1 1 HIS H2 H -28.474 -0.307 -4.271 1.00 . A A . 7 HIS H2 1 1 18 8917 1 1 1 HIS H3 H -28.506 -2.022 -4.226 1.00 . A A . 7 HIS H3 1 1 18 8918 1 1 1 HIS HA H -26.289 -1.419 -4.303 1.00 . A A . 7 HIS HA 1 1 18 8919 1 1 1 HIS HB2 H -25.376 0.188 -2.603 1.00 . A A . 7 HIS HB2 1 1 18 8920 1 1 1 HIS HB3 H -26.501 0.914 -3.747 1.00 . A A . 7 HIS HB3 1 1 18 8921 1 1 1 HIS HD1 H -26.166 -0.043 -0.141 1.00 . A A . 7 HIS HD1 1 1 18 8922 1 1 1 HIS HD2 H -28.872 1.881 -2.641 1.00 . A A . 7 HIS HD2 1 1 18 8923 1 1 1 HIS HE1 H -27.844 1.038 1.389 1.00 . A A . 7 HIS HE1 1 1 18 8924 1 1 1 HIS HE2 H -29.419 2.271 -0.143 1.00 . A A . 7 HIS HE2 1 1 18 8925 1 1 1 HIS N N -28.280 -1.154 -3.700 1.00 . A A . 7 HIS N 1 1 18 8926 1 1 1 HIS ND1 N -26.927 0.484 -0.464 1.00 . A A . 7 HIS ND1 1 1 18 8927 1 1 1 HIS NE2 N -28.700 1.686 -0.462 1.00 . A A . 7 HIS NE2 1 1 18 8928 1 1 1 HIS O O -27.267 -2.414 -1.390 1.00 . A A . 7 HIS O 1 1 18 8929 1 1 2 ALA C C -24.017 -3.288 -0.456 1.00 . A A . 8 ALA C 1 1 18 8930 1 1 2 ALA CA C -24.923 -3.885 -1.528 1.00 . A A . 8 ALA CA 1 1 18 8931 1 1 2 ALA CB C -24.210 -5.017 -2.252 1.00 . A A . 8 ALA CB 1 1 18 8932 1 1 2 ALA H H -24.781 -2.662 -3.249 1.00 . A A . 8 ALA H 1 1 18 8933 1 1 2 ALA HA H -25.804 -4.291 -1.054 1.00 . A A . 8 ALA HA 1 1 18 8934 1 1 2 ALA HB1 H -24.839 -5.387 -3.048 1.00 . A A . 8 ALA HB1 1 1 18 8935 1 1 2 ALA HB2 H -23.282 -4.652 -2.666 1.00 . A A . 8 ALA HB2 1 1 18 8936 1 1 2 ALA HB3 H -24.004 -5.817 -1.555 1.00 . A A . 8 ALA HB3 1 1 18 8937 1 1 2 ALA N N -25.352 -2.868 -2.479 1.00 . A A . 8 ALA N 1 1 18 8938 1 1 2 ALA O O -23.570 -2.146 -0.573 1.00 . A A . 8 ALA O 1 1 18 8939 1 1 3 GLU C C -21.504 -4.230 1.572 1.00 . A A . 9 GLU C 1 1 18 8940 1 1 3 GLU CA C -22.895 -3.614 1.679 1.00 . A A . 9 GLU CA 1 1 18 8941 1 1 3 GLU CB C -23.522 -3.972 3.027 1.00 . A A . 9 GLU CB 1 1 18 8942 1 1 3 GLU CD C -26.000 -4.458 3.011 1.00 . A A . 9 GLU CD 1 1 18 8943 1 1 3 GLU CG C -24.923 -3.412 3.216 1.00 . A A . 9 GLU CG 1 1 18 8944 1 1 3 GLU H H -24.134 -4.967 0.623 1.00 . A A . 9 GLU H 1 1 18 8945 1 1 3 GLU HA H -22.807 -2.540 1.607 1.00 . A A . 9 GLU HA 1 1 18 8946 1 1 3 GLU HB2 H -23.573 -5.047 3.113 1.00 . A A . 9 GLU HB2 1 1 18 8947 1 1 3 GLU HB3 H -22.894 -3.586 3.817 1.00 . A A . 9 GLU HB3 1 1 18 8948 1 1 3 GLU HG2 H -25.008 -3.020 4.218 1.00 . A A . 9 GLU HG2 1 1 18 8949 1 1 3 GLU HG3 H -25.076 -2.614 2.504 1.00 . A A . 9 GLU HG3 1 1 18 8950 1 1 3 GLU N N -23.749 -4.066 0.587 1.00 . A A . 9 GLU N 1 1 18 8951 1 1 3 GLU O O -21.362 -5.440 1.396 1.00 . A A . 9 GLU O 1 1 18 8952 1 1 3 GLU OE1 O -25.884 -5.251 2.054 1.00 . A A . 9 GLU OE1 1 1 18 8953 1 1 3 GLU OE2 O -26.961 -4.484 3.809 1.00 . A A . 9 GLU OE2 1 1 18 8954 1 1 4 GLY C C -18.116 -2.873 2.151 1.00 . A A . 10 GLY C 1 1 18 8955 1 1 4 GLY CA C -19.115 -3.868 1.595 1.00 . A A . 10 GLY CA 1 1 18 8956 1 1 4 GLY H H -20.656 -2.435 1.821 1.00 . A A . 10 GLY H 1 1 18 8957 1 1 4 GLY HA2 H -19.033 -4.792 2.149 1.00 . A A . 10 GLY HA2 1 1 18 8958 1 1 4 GLY HA3 H -18.876 -4.060 0.559 1.00 . A A . 10 GLY HA3 1 1 18 8959 1 1 4 GLY N N -20.481 -3.389 1.681 1.00 . A A . 10 GLY N 1 1 18 8960 1 1 4 GLY O O -18.494 -1.792 2.605 1.00 . A A . 10 GLY O 1 1 18 8961 1 1 5 THR C C -15.598 -1.153 1.716 1.00 . A A . 11 THR C 1 1 18 8962 1 1 5 THR CA C -15.783 -2.365 2.622 1.00 . A A . 11 THR CA 1 1 18 8963 1 1 5 THR CB C -14.467 -3.137 2.741 1.00 . A A . 11 THR CB 1 1 18 8964 1 1 5 THR CG2 C -14.152 -3.566 4.158 1.00 . A A . 11 THR CG2 1 1 18 8965 1 1 5 THR H H -16.599 -4.110 1.743 1.00 . A A . 11 THR H 1 1 18 8966 1 1 5 THR HA H -16.078 -2.024 3.603 1.00 . A A . 11 THR HA 1 1 18 8967 1 1 5 THR HB H -13.658 -2.507 2.399 1.00 . A A . 11 THR HB 1 1 18 8968 1 1 5 THR HG1 H -13.605 -4.504 1.633 1.00 . A A . 11 THR HG1 1 1 18 8969 1 1 5 THR HG21 H -14.949 -4.192 4.530 1.00 . A A . 11 THR HG21 1 1 18 8970 1 1 5 THR HG22 H -13.224 -4.119 4.169 1.00 . A A . 11 THR HG22 1 1 18 8971 1 1 5 THR HG23 H -14.058 -2.692 4.785 1.00 . A A . 11 THR HG23 1 1 18 8972 1 1 5 THR N N -16.838 -3.236 2.117 1.00 . A A . 11 THR N 1 1 18 8973 1 1 5 THR O O -15.929 -1.195 0.531 1.00 . A A . 11 THR O 1 1 18 8974 1 1 5 THR OG1 O -14.494 -4.303 1.936 1.00 . A A . 11 THR OG1 1 1 18 8975 1 1 6 PHE C C -13.442 1.704 1.787 1.00 . A A . 12 PHE C 1 1 18 8976 1 1 6 PHE CA C -14.840 1.152 1.524 1.00 . A A . 12 PHE CA 1 1 18 8977 1 1 6 PHE CB C -15.891 2.203 1.886 1.00 . A A . 12 PHE CB 1 1 18 8978 1 1 6 PHE CD1 C -17.134 2.533 -0.269 1.00 . A A . 12 PHE CD1 1 1 18 8979 1 1 6 PHE CD2 C -15.904 4.371 0.623 1.00 . A A . 12 PHE CD2 1 1 18 8980 1 1 6 PHE CE1 C -17.529 3.312 -1.340 1.00 . A A . 12 PHE CE1 1 1 18 8981 1 1 6 PHE CE2 C -16.296 5.156 -0.445 1.00 . A A . 12 PHE CE2 1 1 18 8982 1 1 6 PHE CG C -16.318 3.053 0.723 1.00 . A A . 12 PHE CG 1 1 18 8983 1 1 6 PHE CZ C -17.109 4.626 -1.428 1.00 . A A . 12 PHE CZ 1 1 18 8984 1 1 6 PHE H H -14.826 -0.101 3.230 1.00 . A A . 12 PHE H 1 1 18 8985 1 1 6 PHE HA H -14.928 0.914 0.475 1.00 . A A . 12 PHE HA 1 1 18 8986 1 1 6 PHE HB2 H -16.768 1.706 2.273 1.00 . A A . 12 PHE HB2 1 1 18 8987 1 1 6 PHE HB3 H -15.490 2.856 2.647 1.00 . A A . 12 PHE HB3 1 1 18 8988 1 1 6 PHE HD1 H -17.463 1.506 -0.201 1.00 . A A . 12 PHE HD1 1 1 18 8989 1 1 6 PHE HD2 H -15.268 4.787 1.391 1.00 . A A . 12 PHE HD2 1 1 18 8990 1 1 6 PHE HE1 H -18.164 2.895 -2.107 1.00 . A A . 12 PHE HE1 1 1 18 8991 1 1 6 PHE HE2 H -15.966 6.182 -0.512 1.00 . A A . 12 PHE HE2 1 1 18 8992 1 1 6 PHE HZ H -17.416 5.237 -2.264 1.00 . A A . 12 PHE HZ 1 1 18 8993 1 1 6 PHE N N -15.068 -0.073 2.281 1.00 . A A . 12 PHE N 1 1 18 8994 1 1 6 PHE O O -12.729 2.081 0.858 1.00 . A A . 12 PHE O 1 1 18 8995 1 1 7 THR C C -10.631 1.452 2.777 1.00 . A A . 13 THR C 1 1 18 8996 1 1 7 THR CA C -11.744 2.255 3.444 1.00 . A A . 13 THR CA 1 1 18 8997 1 1 7 THR CB C -11.579 2.208 4.964 1.00 . A A . 13 THR CB 1 1 18 8998 1 1 7 THR CG2 C -11.789 0.827 5.547 1.00 . A A . 13 THR CG2 1 1 18 8999 1 1 7 THR H H -13.670 1.434 3.756 1.00 . A A . 13 THR H 1 1 18 9000 1 1 7 THR HA H -11.676 3.281 3.116 1.00 . A A . 13 THR HA 1 1 18 9001 1 1 7 THR HB H -12.304 2.871 5.415 1.00 . A A . 13 THR HB 1 1 18 9002 1 1 7 THR HG1 H -10.356 3.421 5.896 1.00 . A A . 13 THR HG1 1 1 18 9003 1 1 7 THR HG21 H -11.033 0.156 5.165 1.00 . A A . 13 THR HG21 1 1 18 9004 1 1 7 THR HG22 H -11.717 0.876 6.623 1.00 . A A . 13 THR HG22 1 1 18 9005 1 1 7 THR HG23 H -12.767 0.463 5.268 1.00 . A A . 13 THR HG23 1 1 18 9006 1 1 7 THR N N -13.057 1.748 3.059 1.00 . A A . 13 THR N 1 1 18 9007 1 1 7 THR O O -9.654 2.016 2.285 1.00 . A A . 13 THR O 1 1 18 9008 1 1 7 THR OG1 O -10.285 2.640 5.341 1.00 . A A . 13 THR OG1 1 1 18 9009 1 1 8 SER C C -10.084 -0.961 0.678 1.00 . A A . 14 SER C 1 1 18 9010 1 1 8 SER CA C -9.792 -0.748 2.160 1.00 . A A . 14 SER CA 1 1 18 9011 1 1 8 SER CB C -9.764 -2.095 2.885 1.00 . A A . 14 SER CB 1 1 18 9012 1 1 8 SER H H -11.585 -0.260 3.175 1.00 . A A . 14 SER H 1 1 18 9013 1 1 8 SER HA H -8.827 -0.275 2.260 1.00 . A A . 14 SER HA 1 1 18 9014 1 1 8 SER HB2 H -9.992 -1.944 3.930 1.00 . A A . 14 SER HB2 1 1 18 9015 1 1 8 SER HB3 H -10.500 -2.752 2.447 1.00 . A A . 14 SER HB3 1 1 18 9016 1 1 8 SER HG H -8.305 -2.909 1.862 1.00 . A A . 14 SER HG 1 1 18 9017 1 1 8 SER N N -10.785 0.132 2.766 1.00 . A A . 14 SER N 1 1 18 9018 1 1 8 SER O O -9.170 -1.173 -0.119 1.00 . A A . 14 SER O 1 1 18 9019 1 1 8 SER OG O -8.488 -2.703 2.781 1.00 . A A . 14 SER OG 1 1 18 9020 1 1 9 ASP C C -11.349 0.095 -1.931 1.00 . A A . 15 ASP C 1 1 18 9021 1 1 9 ASP CA C -11.770 -1.092 -1.071 1.00 . A A . 15 ASP CA 1 1 18 9022 1 1 9 ASP CB C -13.286 -1.285 -1.157 1.00 . A A . 15 ASP CB 1 1 18 9023 1 1 9 ASP CG C -13.733 -1.747 -2.530 1.00 . A A . 15 ASP CG 1 1 18 9024 1 1 9 ASP H H -12.045 -0.733 0.997 1.00 . A A . 15 ASP H 1 1 18 9025 1 1 9 ASP HA H -11.283 -1.981 -1.443 1.00 . A A . 15 ASP HA 1 1 18 9026 1 1 9 ASP HB2 H -13.590 -2.026 -0.432 1.00 . A A . 15 ASP HB2 1 1 18 9027 1 1 9 ASP HB3 H -13.775 -0.348 -0.935 1.00 . A A . 15 ASP HB3 1 1 18 9028 1 1 9 ASP N N -11.361 -0.905 0.316 1.00 . A A . 15 ASP N 1 1 18 9029 1 1 9 ASP O O -11.093 -0.052 -3.127 1.00 . A A . 15 ASP O 1 1 18 9030 1 1 9 ASP OD1 O -13.326 -2.852 -2.947 1.00 . A A . 15 ASP OD1 1 1 18 9031 1 1 9 ASP OD2 O -14.489 -1.003 -3.189 1.00 . A A . 15 ASP OD2 1 1 18 9032 1 1 10 VAL C C -9.377 2.577 -2.179 1.00 . A A . 16 VAL C 1 1 18 9033 1 1 10 VAL CA C -10.893 2.483 -2.031 1.00 . A A . 16 VAL CA 1 1 18 9034 1 1 10 VAL CB C -11.413 3.748 -1.318 1.00 . A A . 16 VAL CB 1 1 18 9035 1 1 10 VAL CG1 C -10.771 3.898 0.054 1.00 . A A . 16 VAL CG1 1 1 18 9036 1 1 10 VAL CG2 C -11.160 4.982 -2.171 1.00 . A A . 16 VAL CG2 1 1 18 9037 1 1 10 VAL H H -11.499 1.328 -0.364 1.00 . A A . 16 VAL H 1 1 18 9038 1 1 10 VAL HA H -11.337 2.444 -3.015 1.00 . A A . 16 VAL HA 1 1 18 9039 1 1 10 VAL HB H -12.479 3.646 -1.181 1.00 . A A . 16 VAL HB 1 1 18 9040 1 1 10 VAL HG11 H -10.695 2.929 0.524 1.00 . A A . 16 VAL HG11 1 1 18 9041 1 1 10 VAL HG12 H -9.785 4.324 -0.055 1.00 . A A . 16 VAL HG12 1 1 18 9042 1 1 10 VAL HG13 H -11.378 4.549 0.666 1.00 . A A . 16 VAL HG13 1 1 18 9043 1 1 10 VAL HG21 H -11.341 4.744 -3.209 1.00 . A A . 16 VAL HG21 1 1 18 9044 1 1 10 VAL HG22 H -11.824 5.775 -1.863 1.00 . A A . 16 VAL HG22 1 1 18 9045 1 1 10 VAL HG23 H -10.136 5.301 -2.048 1.00 . A A . 16 VAL HG23 1 1 18 9046 1 1 10 VAL N N -11.281 1.272 -1.318 1.00 . A A . 16 VAL N 1 1 18 9047 1 1 10 VAL O O -8.868 2.913 -3.248 1.00 . A A . 16 VAL O 1 1 18 9048 1 1 11 SER C C -6.625 1.414 -2.190 1.00 . A A . 17 SER C 1 1 18 9049 1 1 11 SER CA C -7.203 2.328 -1.111 1.00 . A A . 17 SER CA 1 1 18 9050 1 1 11 SER CB C -6.648 1.931 0.258 1.00 . A A . 17 SER CB 1 1 18 9051 1 1 11 SER H H -9.124 2.015 -0.277 1.00 . A A . 17 SER H 1 1 18 9052 1 1 11 SER HA H -6.910 3.345 -1.325 1.00 . A A . 17 SER HA 1 1 18 9053 1 1 11 SER HB2 H -5.619 1.620 0.151 1.00 . A A . 17 SER HB2 1 1 18 9054 1 1 11 SER HB3 H -6.699 2.779 0.925 1.00 . A A . 17 SER HB3 1 1 18 9055 1 1 11 SER HG H -6.805 0.122 0.992 1.00 . A A . 17 SER HG 1 1 18 9056 1 1 11 SER N N -8.661 2.277 -1.100 1.00 . A A . 17 SER N 1 1 18 9057 1 1 11 SER O O -5.484 1.589 -2.618 1.00 . A A . 17 SER O 1 1 18 9058 1 1 11 SER OG O -7.390 0.863 0.819 1.00 . A A . 17 SER OG 1 1 18 9059 1 1 12 SER C C -6.488 0.221 -4.899 1.00 . A A . 18 SER C 1 1 18 9060 1 1 12 SER CA C -6.983 -0.505 -3.650 1.00 . A A . 18 SER CA 1 1 18 9061 1 1 12 SER CB C -8.127 -1.452 -4.019 1.00 . A A . 18 SER CB 1 1 18 9062 1 1 12 SER H H -8.316 0.344 -2.244 1.00 . A A . 18 SER H 1 1 18 9063 1 1 12 SER HA H -6.169 -1.085 -3.241 1.00 . A A . 18 SER HA 1 1 18 9064 1 1 12 SER HB2 H -8.676 -1.041 -4.852 1.00 . A A . 18 SER HB2 1 1 18 9065 1 1 12 SER HB3 H -7.721 -2.414 -4.295 1.00 . A A . 18 SER HB3 1 1 18 9066 1 1 12 SER HG H -9.605 -2.363 -3.111 1.00 . A A . 18 SER HG 1 1 18 9067 1 1 12 SER N N -7.418 0.437 -2.624 1.00 . A A . 18 SER N 1 1 18 9068 1 1 12 SER O O -5.507 -0.191 -5.517 1.00 . A A . 18 SER O 1 1 18 9069 1 1 12 SER OG O -9.016 -1.626 -2.929 1.00 . A A . 18 SER OG 1 1 18 9070 1 1 13 TYR C C -5.647 3.024 -6.137 1.00 . A A . 19 TYR C 1 1 18 9071 1 1 13 TYR CA C -6.797 2.069 -6.450 1.00 . A A . 19 TYR CA 1 1 18 9072 1 1 13 TYR CB C -8.010 2.839 -6.999 1.00 . A A . 19 TYR CB 1 1 18 9073 1 1 13 TYR CD1 C -7.389 5.286 -6.849 1.00 . A A . 19 TYR CD1 1 1 18 9074 1 1 13 TYR CD2 C -9.159 4.489 -5.465 1.00 . A A . 19 TYR CD2 1 1 18 9075 1 1 13 TYR CE1 C -7.550 6.557 -6.331 1.00 . A A . 19 TYR CE1 1 1 18 9076 1 1 13 TYR CE2 C -9.327 5.758 -4.944 1.00 . A A . 19 TYR CE2 1 1 18 9077 1 1 13 TYR CG C -8.189 4.231 -6.425 1.00 . A A . 19 TYR CG 1 1 18 9078 1 1 13 TYR CZ C -8.520 6.788 -5.380 1.00 . A A . 19 TYR CZ 1 1 18 9079 1 1 13 TYR H H -7.950 1.579 -4.741 1.00 . A A . 19 TYR H 1 1 18 9080 1 1 13 TYR HA H -6.463 1.369 -7.201 1.00 . A A . 19 TYR HA 1 1 18 9081 1 1 13 TYR HB2 H -7.906 2.938 -8.069 1.00 . A A . 19 TYR HB2 1 1 18 9082 1 1 13 TYR HB3 H -8.907 2.275 -6.784 1.00 . A A . 19 TYR HB3 1 1 18 9083 1 1 13 TYR HD1 H -9.790 3.681 -5.126 1.00 . A A . 19 TYR HD1 1 1 18 9084 1 1 13 TYR HD2 H -6.630 5.102 -7.595 1.00 . A A . 19 TYR HD2 1 1 18 9085 1 1 13 TYR HE1 H -10.087 5.939 -4.199 1.00 . A A . 19 TYR HE1 1 1 18 9086 1 1 13 TYR HE2 H -6.918 7.363 -6.673 1.00 . A A . 19 TYR HE2 1 1 18 9087 1 1 13 TYR HH H -8.993 8.643 -5.554 1.00 . A A . 19 TYR HH 1 1 18 9088 1 1 13 TYR N N -7.174 1.299 -5.270 1.00 . A A . 19 TYR N 1 1 18 9089 1 1 13 TYR O O -4.826 3.326 -7.003 1.00 . A A . 19 TYR O 1 1 18 9090 1 1 13 TYR OH O -8.685 8.052 -4.863 1.00 . A A . 19 TYR OH 1 1 18 9091 1 1 14 LEU C C -3.194 3.721 -4.422 1.00 . A A . 20 LEU C 1 1 18 9092 1 1 14 LEU CA C -4.549 4.419 -4.474 1.00 . A A . 20 LEU CA 1 1 18 9093 1 1 14 LEU CB C -4.884 5.013 -3.105 1.00 . A A . 20 LEU CB 1 1 18 9094 1 1 14 LEU CD1 C -7.300 5.568 -2.721 1.00 . A A . 20 LEU CD1 1 1 18 9095 1 1 14 LEU CD2 C -5.535 7.262 -2.202 1.00 . A A . 20 LEU CD2 1 1 18 9096 1 1 14 LEU CG C -5.941 6.120 -3.123 1.00 . A A . 20 LEU CG 1 1 18 9097 1 1 14 LEU H H -6.280 3.222 -4.251 1.00 . A A . 20 LEU H 1 1 18 9098 1 1 14 LEU HA H -4.500 5.218 -5.199 1.00 . A A . 20 LEU HA 1 1 18 9099 1 1 14 LEU HB2 H -5.237 4.215 -2.467 1.00 . A A . 20 LEU HB2 1 1 18 9100 1 1 14 LEU HB3 H -3.978 5.417 -2.680 1.00 . A A . 20 LEU HB3 1 1 18 9101 1 1 14 LEU HD11 H -7.534 4.708 -3.332 1.00 . A A . 20 LEU HD11 1 1 18 9102 1 1 14 LEU HD12 H -7.278 5.277 -1.682 1.00 . A A . 20 LEU HD12 1 1 18 9103 1 1 14 LEU HD13 H -8.054 6.328 -2.866 1.00 . A A . 20 LEU HD13 1 1 18 9104 1 1 14 LEU HD21 H -4.458 7.308 -2.140 1.00 . A A . 20 LEU HD21 1 1 18 9105 1 1 14 LEU HD22 H -5.912 8.194 -2.597 1.00 . A A . 20 LEU HD22 1 1 18 9106 1 1 14 LEU HD23 H -5.946 7.095 -1.218 1.00 . A A . 20 LEU HD23 1 1 18 9107 1 1 14 LEU HG H -6.024 6.512 -4.126 1.00 . A A . 20 LEU HG 1 1 18 9108 1 1 14 LEU N N -5.596 3.497 -4.897 1.00 . A A . 20 LEU N 1 1 18 9109 1 1 14 LEU O O -2.342 3.934 -5.284 1.00 . A A . 20 LEU O 1 1 18 9110 1 1 15 GLU C C -1.854 1.133 -2.119 1.00 . A A . 21 GLU C 1 1 18 9111 1 1 15 GLU CA C -1.749 2.158 -3.244 1.00 . A A . 21 GLU CA 1 1 18 9112 1 1 15 GLU CB C -0.604 3.132 -2.956 1.00 . A A . 21 GLU CB 1 1 18 9113 1 1 15 GLU CD C -0.062 5.389 -1.960 1.00 . A A . 21 GLU CD 1 1 18 9114 1 1 15 GLU CG C -0.925 4.146 -1.871 1.00 . A A . 21 GLU CG 1 1 18 9115 1 1 15 GLU H H -3.718 2.757 -2.750 1.00 . A A . 21 GLU H 1 1 18 9116 1 1 15 GLU HA H -1.544 1.640 -4.169 1.00 . A A . 21 GLU HA 1 1 18 9117 1 1 15 GLU HB2 H 0.264 2.568 -2.646 1.00 . A A . 21 GLU HB2 1 1 18 9118 1 1 15 GLU HB3 H -0.368 3.669 -3.863 1.00 . A A . 21 GLU HB3 1 1 18 9119 1 1 15 GLU HG2 H -1.961 4.438 -1.965 1.00 . A A . 21 GLU HG2 1 1 18 9120 1 1 15 GLU HG3 H -0.768 3.684 -0.907 1.00 . A A . 21 GLU HG3 1 1 18 9121 1 1 15 GLU N N -3.002 2.886 -3.406 1.00 . A A . 21 GLU N 1 1 18 9122 1 1 15 GLU O O -1.505 -0.034 -2.294 1.00 . A A . 21 GLU O 1 1 18 9123 1 1 15 GLU OE1 O 1.129 5.312 -1.593 1.00 . A A . 21 GLU OE1 1 1 18 9124 1 1 15 GLU OE2 O -0.577 6.439 -2.398 1.00 . A A . 21 GLU OE2 1 1 18 9125 1 1 16 GLY C C -1.387 0.893 1.205 1.00 . A A . 22 GLY C 1 1 18 9126 1 1 16 GLY CA C -2.478 0.688 0.173 1.00 . A A . 22 GLY CA 1 1 18 9127 1 1 16 GLY H H -2.598 2.519 -0.882 1.00 . A A . 22 GLY H 1 1 18 9128 1 1 16 GLY HA2 H -3.437 0.864 0.638 1.00 . A A . 22 GLY HA2 1 1 18 9129 1 1 16 GLY HA3 H -2.441 -0.334 -0.176 1.00 . A A . 22 GLY HA3 1 1 18 9130 1 1 16 GLY N N -2.337 1.578 -0.964 1.00 . A A . 22 GLY N 1 1 18 9131 1 1 16 GLY O O -0.458 0.092 1.305 1.00 . A A . 22 GLY O 1 1 18 9132 1 1 17 GLN C C -0.308 1.115 3.958 1.00 . A A . 23 GLN C 1 1 18 9133 1 1 17 GLN CA C -0.515 2.289 3.004 1.00 . A A . 23 GLN CA 1 1 18 9134 1 1 17 GLN CB C -0.954 3.526 3.790 1.00 . A A . 23 GLN CB 1 1 18 9135 1 1 17 GLN CD C -0.132 3.742 6.168 1.00 . A A . 23 GLN CD 1 1 18 9136 1 1 17 GLN CG C 0.122 4.076 4.711 1.00 . A A . 23 GLN CG 1 1 18 9137 1 1 17 GLN H H -2.263 2.572 1.843 1.00 . A A . 23 GLN H 1 1 18 9138 1 1 17 GLN HA H 0.421 2.504 2.510 1.00 . A A . 23 GLN HA 1 1 18 9139 1 1 17 GLN HB2 H -1.231 4.302 3.091 1.00 . A A . 23 GLN HB2 1 1 18 9140 1 1 17 GLN HB3 H -1.816 3.270 4.389 1.00 . A A . 23 GLN HB3 1 1 18 9141 1 1 17 GLN HE21 H 1.188 2.258 6.084 1.00 . A A . 23 GLN HE21 1 1 18 9142 1 1 17 GLN HE22 H 0.416 2.490 7.612 1.00 . A A . 23 GLN HE22 1 1 18 9143 1 1 17 GLN HG2 H 1.074 3.656 4.423 1.00 . A A . 23 GLN HG2 1 1 18 9144 1 1 17 GLN HG3 H 0.156 5.150 4.603 1.00 . A A . 23 GLN HG3 1 1 18 9145 1 1 17 GLN N N -1.500 1.972 1.974 1.00 . A A . 23 GLN N 1 1 18 9146 1 1 17 GLN NE2 N 0.561 2.728 6.673 1.00 . A A . 23 GLN NE2 1 1 18 9147 1 1 17 GLN O O 0.740 0.999 4.591 1.00 . A A . 23 GLN O 1 1 18 9148 1 1 17 GLN OE1 O -0.941 4.389 6.833 1.00 . A A . 23 GLN OE1 1 1 18 9149 1 1 18 ALA C C -0.016 -1.772 4.625 1.00 . A A . 24 ALA C 1 1 18 9150 1 1 18 ALA CA C -1.234 -0.910 4.944 1.00 . A A . 24 ALA CA 1 1 18 9151 1 1 18 ALA CB C -2.507 -1.735 4.843 1.00 . A A . 24 ALA CB 1 1 18 9152 1 1 18 ALA H H -2.126 0.394 3.535 1.00 . A A . 24 ALA H 1 1 18 9153 1 1 18 ALA HA H -1.148 -0.549 5.959 1.00 . A A . 24 ALA HA 1 1 18 9154 1 1 18 ALA HB1 H -2.597 -2.138 3.845 1.00 . A A . 24 ALA HB1 1 1 18 9155 1 1 18 ALA HB2 H -2.468 -2.546 5.556 1.00 . A A . 24 ALA HB2 1 1 18 9156 1 1 18 ALA HB3 H -3.360 -1.108 5.057 1.00 . A A . 24 ALA HB3 1 1 18 9157 1 1 18 ALA N N -1.312 0.249 4.062 1.00 . A A . 24 ALA N 1 1 18 9158 1 1 18 ALA O O 0.826 -2.017 5.489 1.00 . A A . 24 ALA O 1 1 18 9159 1 1 19 ALA C C 2.367 -2.216 2.499 1.00 . A A . 25 ALA C 1 1 18 9160 1 1 19 ALA CA C 1.188 -3.065 2.951 1.00 . A A . 25 ALA CA 1 1 18 9161 1 1 19 ALA CB C 0.749 -3.999 1.833 1.00 . A A . 25 ALA CB 1 1 18 9162 1 1 19 ALA H H -0.630 -2.002 2.737 1.00 . A A . 25 ALA H 1 1 18 9163 1 1 19 ALA HA H 1.498 -3.670 3.792 1.00 . A A . 25 ALA HA 1 1 18 9164 1 1 19 ALA HB1 H 0.265 -3.427 1.055 1.00 . A A . 25 ALA HB1 1 1 18 9165 1 1 19 ALA HB2 H 1.613 -4.502 1.425 1.00 . A A . 25 ALA HB2 1 1 18 9166 1 1 19 ALA HB3 H 0.058 -4.730 2.225 1.00 . A A . 25 ALA HB3 1 1 18 9167 1 1 19 ALA N N 0.072 -2.230 3.381 1.00 . A A . 25 ALA N 1 1 18 9168 1 1 19 ALA O O 3.501 -2.442 2.918 1.00 . A A . 25 ALA O 1 1 18 9169 1 1 20 LYS C C 4.003 0.203 2.274 1.00 . A A . 26 LYS C 1 1 18 9170 1 1 20 LYS CA C 3.141 -0.351 1.138 1.00 . A A . 26 LYS CA 1 1 18 9171 1 1 20 LYS CB C 2.528 0.795 0.329 1.00 . A A . 26 LYS CB 1 1 18 9172 1 1 20 LYS CD C 1.976 0.253 -2.070 1.00 . A A . 26 LYS CD 1 1 18 9173 1 1 20 LYS CE C 1.593 -1.171 -1.691 1.00 . A A . 26 LYS CE 1 1 18 9174 1 1 20 LYS CG C 3.008 0.836 -1.115 1.00 . A A . 26 LYS CG 1 1 18 9175 1 1 20 LYS HA H 3.771 -0.936 0.485 1.00 . A A . 26 LYS HA 1 1 18 9176 1 1 20 LYS HB2 H 1.454 0.685 0.326 1.00 . A A . 26 LYS HB2 1 1 18 9177 1 1 20 LYS HD2 H 1.090 0.869 -2.046 1.00 . A A . 26 LYS HD2 1 1 18 9178 1 1 20 LYS HE2 H 1.502 -1.232 -0.617 1.00 . A A . 26 LYS HE2 1 1 18 9179 1 1 20 LYS HG2 H 3.198 1.862 -1.391 1.00 . A A . 26 LYS HG2 1 1 18 9180 1 1 20 LYS HZ1 H 3.387 -1.811 -2.583 1.00 . A A . 26 LYS HZ1 1 1 18 9181 1 1 20 LYS N N 2.095 -1.234 1.645 1.00 . A A . 26 LYS N 1 1 18 9182 1 1 20 LYS NZ N 2.583 -2.148 -2.137 1.00 . A A . 26 LYS NZ 1 1 18 9183 1 1 20 LYS O O 5.144 0.603 2.052 1.00 . A A . 26 LYS O 1 1 18 9184 1 1 21 GLU C C 5.618 0.199 4.671 1.00 . A A . 27 GLU C 1 1 18 9185 1 1 21 GLU CA C 4.181 0.714 4.658 1.00 . A A . 27 GLU CA 1 1 18 9186 1 1 21 GLU CB C 3.473 0.284 5.945 1.00 . A A . 27 GLU CB 1 1 18 9187 1 1 21 GLU CD C 2.725 -1.623 7.422 1.00 . A A . 27 GLU CD 1 1 18 9188 1 1 21 GLU CG C 3.484 -1.219 6.174 1.00 . A A . 27 GLU CG 1 1 18 9189 1 1 21 GLU H H 2.541 -0.116 3.607 1.00 . A A . 27 GLU H 1 1 18 9190 1 1 21 GLU HA H 4.196 1.792 4.608 1.00 . A A . 27 GLU HA 1 1 18 9191 1 1 21 GLU HB2 H 3.961 0.756 6.784 1.00 . A A . 27 GLU HB2 1 1 18 9192 1 1 21 GLU HB3 H 2.446 0.613 5.905 1.00 . A A . 27 GLU HB3 1 1 18 9193 1 1 21 GLU HG2 H 3.030 -1.703 5.322 1.00 . A A . 27 GLU HG2 1 1 18 9194 1 1 21 GLU HG3 H 4.508 -1.547 6.270 1.00 . A A . 27 GLU HG3 1 1 18 9195 1 1 21 GLU N N 3.454 0.217 3.490 1.00 . A A . 27 GLU N 1 1 18 9196 1 1 21 GLU O O 6.530 0.876 5.145 1.00 . A A . 27 GLU O 1 1 18 9197 1 1 21 GLU OE1 O 1.905 -0.816 7.907 1.00 . A A . 27 GLU OE1 1 1 18 9198 1 1 21 GLU OE2 O 2.951 -2.748 7.916 1.00 . A A . 27 GLU OE2 1 1 18 9199 1 1 22 PHE C C 8.060 -0.818 3.187 1.00 . A A . 28 PHE C 1 1 18 9200 1 1 22 PHE CA C 7.125 -1.621 4.091 1.00 . A A . 28 PHE CA 1 1 18 9201 1 1 22 PHE CB C 7.006 -3.075 3.606 1.00 . A A . 28 PHE CB 1 1 18 9202 1 1 22 PHE CD1 C 8.133 -3.038 1.356 1.00 . A A . 28 PHE CD1 1 1 18 9203 1 1 22 PHE CD2 C 5.812 -3.574 1.451 1.00 . A A . 28 PHE CD2 1 1 18 9204 1 1 22 PHE CE1 C 8.114 -3.179 -0.018 1.00 . A A . 28 PHE CE1 1 1 18 9205 1 1 22 PHE CE2 C 5.786 -3.716 0.077 1.00 . A A . 28 PHE CE2 1 1 18 9206 1 1 22 PHE CG C 6.984 -3.233 2.107 1.00 . A A . 28 PHE CG 1 1 18 9207 1 1 22 PHE CZ C 6.938 -3.517 -0.659 1.00 . A A . 28 PHE CZ 1 1 18 9208 1 1 22 PHE H H 5.037 -1.495 3.784 1.00 . A A . 28 PHE H 1 1 18 9209 1 1 22 PHE HA H 7.529 -1.619 5.093 1.00 . A A . 28 PHE HA 1 1 18 9210 1 1 22 PHE HB2 H 7.842 -3.641 3.985 1.00 . A A . 28 PHE HB2 1 1 18 9211 1 1 22 PHE HB3 H 6.088 -3.496 3.997 1.00 . A A . 28 PHE HB3 1 1 18 9212 1 1 22 PHE HD1 H 4.912 -3.733 2.022 1.00 . A A . 28 PHE HD1 1 1 18 9213 1 1 22 PHE HD2 H 9.052 -2.773 1.857 1.00 . A A . 28 PHE HD2 1 1 18 9214 1 1 22 PHE HE1 H 4.866 -3.982 -0.419 1.00 . A A . 28 PHE HE1 1 1 18 9215 1 1 22 PHE HE2 H 9.016 -3.023 -0.590 1.00 . A A . 28 PHE HE2 1 1 18 9216 1 1 22 PHE HZ H 6.920 -3.628 -1.733 1.00 . A A . 28 PHE HZ 1 1 18 9217 1 1 22 PHE N N 5.806 -1.006 4.145 1.00 . A A . 28 PHE N 1 1 18 9218 1 1 22 PHE O O 9.229 -0.609 3.512 1.00 . A A . 28 PHE O 1 1 18 9219 1 1 23 ILE C C 8.979 1.602 1.759 1.00 . A A . 29 ILE C 1 1 18 9220 1 1 23 ILE CA C 8.311 0.402 1.088 1.00 . A A . 29 ILE CA 1 1 18 9221 1 1 23 ILE CB C 7.423 0.883 -0.084 1.00 . A A . 29 ILE CB 1 1 18 9222 1 1 23 ILE CD1 C 7.607 0.664 -2.611 1.00 . A A . 29 ILE CD1 1 1 18 9223 1 1 23 ILE CG1 C 8.272 1.126 -1.333 1.00 . A A . 29 ILE CG1 1 1 18 9224 1 1 23 ILE CG2 C 6.647 2.141 0.290 1.00 . A A . 29 ILE CG2 1 1 18 9225 1 1 23 ILE H H 6.596 -0.578 1.848 1.00 . A A . 29 ILE H 1 1 18 9226 1 1 23 ILE HA H 9.080 -0.244 0.685 1.00 . A A . 29 ILE HA 1 1 18 9227 1 1 23 ILE HB H 6.706 0.105 -0.298 1.00 . A A . 29 ILE HB 1 1 18 9228 1 1 23 ILE HD11 H 6.659 0.203 -2.377 1.00 . A A . 29 ILE HD11 1 1 18 9229 1 1 23 ILE HD12 H 7.443 1.512 -3.259 1.00 . A A . 29 ILE HD12 1 1 18 9230 1 1 23 ILE HD13 H 8.242 -0.052 -3.110 1.00 . A A . 29 ILE HD13 1 1 18 9231 1 1 23 ILE HG12 H 8.470 2.183 -1.426 1.00 . A A . 29 ILE HG12 1 1 18 9232 1 1 23 ILE HG13 H 9.208 0.595 -1.234 1.00 . A A . 29 ILE HG13 1 1 18 9233 1 1 23 ILE HG21 H 6.514 2.178 1.360 1.00 . A A . 29 ILE HG21 1 1 18 9234 1 1 23 ILE HG22 H 7.196 3.012 -0.034 1.00 . A A . 29 ILE HG22 1 1 18 9235 1 1 23 ILE HG23 H 5.681 2.124 -0.193 1.00 . A A . 29 ILE HG23 1 1 18 9236 1 1 23 ILE N N 7.533 -0.375 2.049 1.00 . A A . 29 ILE N 1 1 18 9237 1 1 23 ILE O O 10.052 2.040 1.346 1.00 . A A . 29 ILE O 1 1 18 9238 1 1 24 ALA C C 10.150 2.921 4.261 1.00 . A A . 30 ALA C 1 1 18 9239 1 1 24 ALA CA C 8.862 3.274 3.523 1.00 . A A . 30 ALA CA 1 1 18 9240 1 1 24 ALA CB C 7.821 3.801 4.499 1.00 . A A . 30 ALA CB 1 1 18 9241 1 1 24 ALA H H 7.483 1.733 3.077 1.00 . A A . 30 ALA H 1 1 18 9242 1 1 24 ALA HA H 9.074 4.053 2.805 1.00 . A A . 30 ALA HA 1 1 18 9243 1 1 24 ALA HB1 H 7.145 3.004 4.769 1.00 . A A . 30 ALA HB1 1 1 18 9244 1 1 24 ALA HB2 H 8.314 4.171 5.385 1.00 . A A . 30 ALA HB2 1 1 18 9245 1 1 24 ALA HB3 H 7.266 4.603 4.034 1.00 . A A . 30 ALA HB3 1 1 18 9246 1 1 24 ALA N N 8.335 2.126 2.795 1.00 . A A . 30 ALA N 1 1 18 9247 1 1 24 ALA O O 10.993 3.784 4.501 1.00 . A A . 30 ALA O 1 1 18 9248 1 1 25 TRP C C 12.684 1.105 4.400 1.00 . A A . 31 TRP C 1 1 18 9249 1 1 25 TRP CA C 11.478 1.188 5.339 1.00 . A A . 31 TRP CA 1 1 18 9250 1 1 25 TRP CB C 11.190 -0.173 6.002 1.00 . A A . 31 TRP CB 1 1 18 9251 1 1 25 TRP CD1 C 13.522 -1.245 6.046 1.00 . A A . 31 TRP CD1 1 1 18 9252 1 1 25 TRP CD2 C 11.968 -2.469 4.996 1.00 . A A . 31 TRP CD2 1 1 18 9253 1 1 25 TRP CE2 C 13.192 -3.162 4.948 1.00 . A A . 31 TRP CE2 1 1 18 9254 1 1 25 TRP CE3 C 10.843 -3.046 4.400 1.00 . A A . 31 TRP CE3 1 1 18 9255 1 1 25 TRP CG C 12.201 -1.244 5.703 1.00 . A A . 31 TRP CG 1 1 18 9256 1 1 25 TRP CH2 C 12.204 -4.944 3.752 1.00 . A A . 31 TRP CH2 1 1 18 9257 1 1 25 TRP CZ2 C 13.321 -4.403 4.326 1.00 . A A . 31 TRP CZ2 1 1 18 9258 1 1 25 TRP CZ3 C 10.973 -4.277 3.785 1.00 . A A . 31 TRP CZ3 1 1 18 9259 1 1 25 TRP H H 9.586 1.007 4.407 1.00 . A A . 31 TRP H 1 1 18 9260 1 1 25 TRP HA H 11.694 1.911 6.111 1.00 . A A . 31 TRP HA 1 1 18 9261 1 1 25 TRP HB2 H 11.162 -0.040 7.072 1.00 . A A . 31 TRP HB2 1 1 18 9262 1 1 25 TRP HB3 H 10.225 -0.525 5.667 1.00 . A A . 31 TRP HB3 1 1 18 9263 1 1 25 TRP HD1 H 14.010 -0.451 6.591 1.00 . A A . 31 TRP HD1 1 1 18 9264 1 1 25 TRP HE1 H 15.070 -2.628 5.717 1.00 . A A . 31 TRP HE1 1 1 18 9265 1 1 25 TRP HE3 H 9.885 -2.548 4.415 1.00 . A A . 31 TRP HE3 1 1 18 9266 1 1 25 TRP HH2 H 12.259 -5.903 3.260 1.00 . A A . 31 TRP HH2 1 1 18 9267 1 1 25 TRP HZ2 H 14.263 -4.930 4.292 1.00 . A A . 31 TRP HZ2 1 1 18 9268 1 1 25 TRP HZ3 H 10.114 -4.738 3.319 1.00 . A A . 31 TRP HZ3 1 1 18 9269 1 1 25 TRP N N 10.294 1.650 4.623 1.00 . A A . 31 TRP N 1 1 18 9270 1 1 25 TRP NE1 N 14.126 -2.395 5.595 1.00 . A A . 31 TRP NE1 1 1 18 9271 1 1 25 TRP O O 13.674 1.814 4.582 1.00 . A A . 31 TRP O 1 1 18 9272 1 1 26 LEU C C 14.004 1.350 1.717 1.00 . A A . 32 LEU C 1 1 18 9273 1 1 26 LEU CA C 13.680 0.048 2.446 1.00 . A A . 32 LEU CA 1 1 18 9274 1 1 26 LEU CB C 13.336 -1.050 1.433 1.00 . A A . 32 LEU CB 1 1 18 9275 1 1 26 LEU CD1 C 11.673 -0.247 -0.265 1.00 . A A . 32 LEU CD1 1 1 18 9276 1 1 26 LEU CD2 C 11.463 -2.542 0.709 1.00 . A A . 32 LEU CD2 1 1 18 9277 1 1 26 LEU CG C 11.876 -1.103 0.976 1.00 . A A . 32 LEU CG 1 1 18 9278 1 1 26 LEU H H 11.784 -0.311 3.320 1.00 . A A . 32 LEU H 1 1 18 9279 1 1 26 LEU HA H 14.554 -0.257 3.002 1.00 . A A . 32 LEU HA 1 1 18 9280 1 1 26 LEU HB2 H 13.955 -0.909 0.560 1.00 . A A . 32 LEU HB2 1 1 18 9281 1 1 26 LEU HB3 H 13.582 -2.004 1.875 1.00 . A A . 32 LEU HB3 1 1 18 9282 1 1 26 LEU HD11 H 12.629 0.111 -0.619 1.00 . A A . 32 LEU HD11 1 1 18 9283 1 1 26 LEU HD12 H 11.201 -0.836 -1.037 1.00 . A A . 32 LEU HD12 1 1 18 9284 1 1 26 LEU HD13 H 11.042 0.595 -0.021 1.00 . A A . 32 LEU HD13 1 1 18 9285 1 1 26 LEU HD21 H 12.337 -3.128 0.467 1.00 . A A . 32 LEU HD21 1 1 18 9286 1 1 26 LEU HD22 H 10.988 -2.950 1.588 1.00 . A A . 32 LEU HD22 1 1 18 9287 1 1 26 LEU HD23 H 10.772 -2.570 -0.119 1.00 . A A . 32 LEU HD23 1 1 18 9288 1 1 26 LEU HG H 11.241 -0.712 1.755 1.00 . A A . 32 LEU HG 1 1 18 9289 1 1 26 LEU N N 12.595 0.230 3.405 1.00 . A A . 32 LEU N 1 1 18 9290 1 1 26 LEU O O 15.172 1.675 1.504 1.00 . A A . 32 LEU O 1 1 18 9291 1 1 27 VAL C C 13.869 4.378 1.522 1.00 . A A . 33 VAL C 1 1 18 9292 1 1 27 VAL CA C 13.163 3.357 0.632 1.00 . A A . 33 VAL CA 1 1 18 9293 1 1 27 VAL CB C 11.819 3.940 0.141 1.00 . A A . 33 VAL CB 1 1 18 9294 1 1 27 VAL CG1 C 11.994 5.365 -0.370 1.00 . A A . 33 VAL CG1 1 1 18 9295 1 1 27 VAL CG2 C 11.222 3.054 -0.943 1.00 . A A . 33 VAL CG2 1 1 18 9296 1 1 27 VAL H H 12.061 1.787 1.532 1.00 . A A . 33 VAL H 1 1 18 9297 1 1 27 VAL HA H 13.783 3.162 -0.231 1.00 . A A . 33 VAL HA 1 1 18 9298 1 1 27 VAL HB H 11.133 3.962 0.974 1.00 . A A . 33 VAL HB 1 1 18 9299 1 1 27 VAL HG11 H 12.998 5.491 -0.748 1.00 . A A . 33 VAL HG11 1 1 18 9300 1 1 27 VAL HG12 H 11.284 5.553 -1.162 1.00 . A A . 33 VAL HG12 1 1 18 9301 1 1 27 VAL HG13 H 11.823 6.060 0.439 1.00 . A A . 33 VAL HG13 1 1 18 9302 1 1 27 VAL HG21 H 11.780 2.131 -1.003 1.00 . A A . 33 VAL HG21 1 1 18 9303 1 1 27 VAL HG22 H 10.192 2.836 -0.704 1.00 . A A . 33 VAL HG22 1 1 18 9304 1 1 27 VAL HG23 H 11.270 3.564 -1.894 1.00 . A A . 33 VAL HG23 1 1 18 9305 1 1 27 VAL N N 12.971 2.093 1.336 1.00 . A A . 33 VAL N 1 1 18 9306 1 1 27 VAL O O 14.568 5.264 1.030 1.00 . A A . 33 VAL O 1 1 18 9307 1 1 28 ARG C C 15.827 5.140 3.646 1.00 . A A . 34 ARG C 1 1 18 9308 1 1 28 ARG CA C 14.308 5.166 3.783 1.00 . A A . 34 ARG CA 1 1 18 9309 1 1 28 ARG CB C 13.907 4.804 5.215 1.00 . A A . 34 ARG CB 1 1 18 9310 1 1 28 ARG CD C 12.391 5.725 6.996 1.00 . A A . 34 ARG CD 1 1 18 9311 1 1 28 ARG CG C 13.564 6.011 6.073 1.00 . A A . 34 ARG CG 1 1 18 9312 1 1 28 ARG CZ C 9.957 6.110 6.976 1.00 . A A . 34 ARG CZ 1 1 18 9313 1 1 28 ARG H H 13.118 3.525 3.169 1.00 . A A . 34 ARG H 1 1 18 9314 1 1 28 ARG HA H 13.956 6.162 3.561 1.00 . A A . 34 ARG HA 1 1 18 9315 1 1 28 ARG HB2 H 13.046 4.155 5.182 1.00 . A A . 34 ARG HB2 1 1 18 9316 1 1 28 ARG HB3 H 14.725 4.277 5.684 1.00 . A A . 34 ARG HB3 1 1 18 9317 1 1 28 ARG HD2 H 12.452 4.699 7.329 1.00 . A A . 34 ARG HD2 1 1 18 9318 1 1 28 ARG HD3 H 12.453 6.384 7.850 1.00 . A A . 34 ARG HD3 1 1 18 9319 1 1 28 ARG HE H 11.100 5.934 5.351 1.00 . A A . 34 ARG HE 1 1 18 9320 1 1 28 ARG HG2 H 14.424 6.272 6.671 1.00 . A A . 34 ARG HG2 1 1 18 9321 1 1 28 ARG HG3 H 13.308 6.838 5.426 1.00 . A A . 34 ARG HG3 1 1 18 9322 1 1 28 ARG HH11 H 10.768 5.980 8.825 1.00 . A A . 34 ARG HH11 1 1 18 9323 1 1 28 ARG HH12 H 9.058 6.249 8.782 1.00 . A A . 34 ARG HH12 1 1 18 9324 1 1 28 ARG HH21 H 8.853 6.289 5.293 1.00 . A A . 34 ARG HH21 1 1 18 9325 1 1 28 ARG HH22 H 7.970 6.424 6.777 1.00 . A A . 34 ARG HH22 1 1 18 9326 1 1 28 ARG N N 13.685 4.250 2.833 1.00 . A A . 34 ARG N 1 1 18 9327 1 1 28 ARG NE N 11.107 5.930 6.331 1.00 . A A . 34 ARG NE 1 1 18 9328 1 1 28 ARG NH1 N 9.925 6.113 8.304 1.00 . A A . 34 ARG NH1 1 1 18 9329 1 1 28 ARG NH2 N 8.835 6.289 6.293 1.00 . A A . 34 ARG NH2 1 1 18 9330 1 1 28 ARG O O 16.485 6.178 3.728 1.00 . A A . 34 ARG O 1 1 18 9331 1 1 29 GLY C C 18.238 2.384 3.006 1.00 . A A . 35 GLY C 1 1 18 9332 1 1 29 GLY CA C 17.815 3.812 3.292 1.00 . A A . 35 GLY CA 1 1 18 9333 1 1 29 GLY H H 15.804 3.157 3.380 1.00 . A A . 35 GLY H 1 1 18 9334 1 1 29 GLY HA2 H 18.146 4.443 2.480 1.00 . A A . 35 GLY HA2 1 1 18 9335 1 1 29 GLY HA3 H 18.291 4.141 4.205 1.00 . A A . 35 GLY HA3 1 1 18 9336 1 1 29 GLY N N 16.378 3.949 3.437 1.00 . A A . 35 GLY N 1 1 18 9337 1 1 29 GLY O O 18.821 1.720 3.862 1.00 . A A . 35 GLY O 1 1 18 9338 1 1 30 ARG C C 19.035 0.552 0.068 1.00 . A A . 36 ARG C 1 1 18 9339 1 1 30 ARG CA C 18.296 0.554 1.402 1.00 . A A . 36 ARG CA 1 1 18 9340 1 1 30 ARG CB C 17.041 -0.315 1.304 1.00 . A A . 36 ARG CB 1 1 18 9341 1 1 30 ARG CD C 16.535 -2.420 0.023 1.00 . A A . 36 ARG CD 1 1 18 9342 1 1 30 ARG CG C 17.338 -1.799 1.155 1.00 . A A . 36 ARG CG 1 1 18 9343 1 1 30 ARG CZ C 16.906 -2.968 -2.351 1.00 . A A . 36 ARG CZ 1 1 18 9344 1 1 30 ARG H H 17.477 2.491 1.160 1.00 . A A . 36 ARG H 1 1 18 9345 1 1 30 ARG HA H 18.947 0.145 2.161 1.00 . A A . 36 ARG HA 1 1 18 9346 1 1 30 ARG HB2 H 16.450 -0.176 2.197 1.00 . A A . 36 ARG HB2 1 1 18 9347 1 1 30 ARG HB3 H 16.464 0.003 0.448 1.00 . A A . 36 ARG HB3 1 1 18 9348 1 1 30 ARG HD2 H 16.429 -3.478 0.213 1.00 . A A . 36 ARG HD2 1 1 18 9349 1 1 30 ARG HD3 H 15.558 -1.961 -0.002 1.00 . A A . 36 ARG HD3 1 1 18 9350 1 1 30 ARG HE H 17.856 -1.528 -1.346 1.00 . A A . 36 ARG HE 1 1 18 9351 1 1 30 ARG HG2 H 18.390 -1.927 0.948 1.00 . A A . 36 ARG HG2 1 1 18 9352 1 1 30 ARG HG3 H 17.088 -2.300 2.079 1.00 . A A . 36 ARG HG3 1 1 18 9353 1 1 30 ARG HH11 H 15.514 -4.114 -1.435 1.00 . A A . 36 ARG HH11 1 1 18 9354 1 1 30 ARG HH12 H 15.795 -4.479 -3.104 1.00 . A A . 36 ARG HH12 1 1 18 9355 1 1 30 ARG HH21 H 18.227 -2.008 -3.542 1.00 . A A . 36 ARG HH21 1 1 18 9356 1 1 30 ARG HH22 H 17.335 -3.285 -4.300 1.00 . A A . 36 ARG HH22 1 1 18 9357 1 1 30 ARG N N 17.943 1.912 1.799 1.00 . A A . 36 ARG N 1 1 18 9358 1 1 30 ARG NE N 17.181 -2.235 -1.274 1.00 . A A . 36 ARG NE 1 1 18 9359 1 1 30 ARG NH1 N 15.997 -3.933 -2.291 1.00 . A A . 36 ARG NH1 1 1 18 9360 1 1 30 ARG NH2 N 17.541 -2.734 -3.491 1.00 . A A . 36 ARG NH2 1 1 18 9361 1 1 30 ARG O O 18.936 -0.400 -0.706 1.00 . A A . 36 ARG O 1 1 18 9362 1 1 31 GLY C C 20.594 3.147 -1.954 1.00 . A A . 37 GLY C 1 1 18 9363 1 1 31 GLY CA C 20.520 1.725 -1.435 1.00 . A A . 37 GLY CA 1 1 18 9364 1 1 31 GLY H H 19.817 2.352 0.460 1.00 . A A . 37 GLY H 1 1 18 9365 1 1 31 GLY HA2 H 21.524 1.361 -1.271 1.00 . A A . 37 GLY HA2 1 1 18 9366 1 1 31 GLY HA3 H 20.042 1.106 -2.180 1.00 . A A . 37 GLY HA3 1 1 18 9367 1 1 31 GLY N N 19.776 1.624 -0.194 1.00 . A A . 37 GLY N 1 1 18 9368 1 1 31 GLY O O 20.253 4.076 -1.190 1.00 . A A . 37 GLY O 1 1 18 9369 1 1 31 GLY OXT O 20.992 3.334 -3.123 1.00 . A A . 37 GLY OXT 1 1 18 9370 2 2 1 . C02 C 5.956 -6.893 0.062 1.00 . B A . 1038 D6M C02 1 1 18 9371 2 2 1 . C04 C 4.633 -6.696 -1.968 1.00 . B A . 1038 D6M C04 1 1 18 9372 2 2 1 . C05 C 3.439 -5.767 -1.705 1.00 . B A . 1038 D6M C05 1 1 18 9373 2 2 1 . C06 C 3.498 -4.440 -2.450 1.00 . B A . 1038 D6M C06 1 1 18 9374 2 2 1 . C07 C 2.445 -3.460 -1.969 1.00 . B A . 1038 D6M C07 1 1 18 9375 2 2 1 . C09 C 5.018 -6.664 -3.446 1.00 . B A . 1038 D6M C09 1 1 18 9376 2 2 1 . C12 C 7.130 -6.512 0.945 1.00 . B A . 1038 D6M C12 1 1 18 9377 2 2 1 . C13 C 8.360 -7.365 0.687 1.00 . B A . 1038 D6M C13 1 1 18 9378 2 2 1 . C14 C 9.481 -7.030 1.658 1.00 . B A . 1038 D6M C14 1 1 18 9379 2 2 1 . C15 C 10.845 -7.129 0.993 1.00 . B A . 1038 D6M C15 1 1 18 9380 2 2 1 . C16 C 11.370 -5.760 0.587 1.00 . B A . 1038 D6M C16 1 1 18 9381 2 2 1 . C17 C 11.157 -5.497 -0.896 1.00 . B A . 1038 D6M C17 1 1 18 9382 2 2 1 . C18 C 12.440 -5.045 -1.575 1.00 . B A . 1038 D6M C18 1 1 18 9383 2 2 1 . C19 C 12.151 -4.217 -2.817 1.00 . B A . 1038 D6M C19 1 1 18 9384 2 2 1 . C20 C 11.601 -2.847 -2.455 1.00 . B A . 1038 D6M C20 1 1 18 9385 2 2 1 . C21 C 11.545 -1.929 -3.665 1.00 . B A . 1038 D6M C21 1 1 18 9386 2 2 1 . C22 C 10.585 -0.771 -3.442 1.00 . B A . 1038 D6M C22 1 1 18 9387 2 2 1 . C23 C 11.327 0.517 -3.124 1.00 . B A . 1038 D6M C23 1 1 18 9388 2 2 1 . C24 C 11.365 1.453 -4.320 1.00 . B A . 1038 D6M C24 1 1 18 9389 2 2 1 . C25 C 10.154 2.371 -4.346 1.00 . B A . 1038 D6M C25 1 1 18 9390 2 2 1 . C26 C 9.076 1.850 -5.272 1.00 . B A . 1038 D6M C26 1 1 18 9391 2 2 1 . H03 H 6.484 -5.784 -1.513 1.00 . B A . 1038 D6M H03 1 1 18 9392 2 2 1 . H04 H 4.352 -7.704 -1.707 1.00 . B A . 1038 D6M H04 1 1 18 9393 2 2 1 . HP21 H 6.836 -6.630 1.977 1.00 . B A . 1038 D6M HP21 1 1 18 9394 2 2 1 . HP22 H 7.380 -5.479 0.759 1.00 . B A . 1038 D6M HP22 1 1 18 9395 2 2 1 . HP31 H 8.705 -7.188 -0.322 1.00 . B A . 1038 D6M HP31 1 1 18 9396 2 2 1 . HP32 H 8.096 -8.406 0.802 1.00 . B A . 1038 D6M HP32 1 1 18 9397 2 2 1 . HP41 H 9.444 -7.722 2.487 1.00 . B A . 1038 D6M HP41 1 1 18 9398 2 2 1 . HP42 H 9.341 -6.023 2.020 1.00 . B A . 1038 D6M HP42 1 1 18 9399 2 2 1 . HP51 H 10.761 -7.748 0.112 1.00 . B A . 1038 D6M HP51 1 1 18 9400 2 2 1 . HP52 H 11.541 -7.578 1.685 1.00 . B A . 1038 D6M HP52 1 1 18 9401 2 2 1 . HP61 H 12.427 -5.712 0.806 1.00 . B A . 1038 D6M HP61 1 1 18 9402 2 2 1 . HP62 H 10.849 -5.003 1.155 1.00 . B A . 1038 D6M HP62 1 1 18 9403 2 2 1 . HP71 H 10.409 -4.726 -1.011 1.00 . B A . 1038 D6M HP71 1 1 18 9404 2 2 1 . HP72 H 10.814 -6.406 -1.369 1.00 . B A . 1038 D6M HP72 1 1 18 9405 2 2 1 . HP81 H 13.013 -5.916 -1.858 1.00 . B A . 1038 D6M HP81 1 1 18 9406 2 2 1 . HP82 H 13.011 -4.446 -0.881 1.00 . B A . 1038 D6M HP82 1 1 18 9407 2 2 1 . HP91 H 11.426 -4.739 -3.424 1.00 . B A . 1038 D6M HP91 1 1 18 9408 2 2 1 . HP92 H 13.067 -4.091 -3.375 1.00 . B A . 1038 D6M HP92 1 1 18 9409 2 2 1 . HPA1 H 12.238 -2.401 -1.705 1.00 . B A . 1038 D6M HPA1 1 1 18 9410 2 2 1 . HPA2 H 10.603 -2.964 -2.059 1.00 . B A . 1038 D6M HPA2 1 1 18 9411 2 2 1 . HPB1 H 11.216 -2.498 -4.522 1.00 . B A . 1038 D6M HPB1 1 1 18 9412 2 2 1 . HPB2 H 12.532 -1.534 -3.851 1.00 . B A . 1038 D6M HPB2 1 1 18 9413 2 2 1 . HPC1 H 9.931 -1.012 -2.616 1.00 . B A . 1038 D6M HPC1 1 1 18 9414 2 2 1 . HPC2 H 9.998 -0.625 -4.337 1.00 . B A . 1038 D6M HPC2 1 1 18 9415 2 2 1 . HPD1 H 12.339 0.276 -2.834 1.00 . B A . 1038 D6M HPD1 1 1 18 9416 2 2 1 . HPD2 H 10.827 1.015 -2.307 1.00 . B A . 1038 D6M HPD2 1 1 18 9417 2 2 1 . HPE1 H 11.380 0.865 -5.226 1.00 . B A . 1038 D6M HPE1 1 1 18 9418 2 2 1 . HPE2 H 12.259 2.057 -4.265 1.00 . B A . 1038 D6M HPE2 1 1 18 9419 2 2 1 . HPF1 H 10.458 3.350 -4.686 1.00 . B A . 1038 D6M HPF1 1 1 18 9420 2 2 1 . HPF2 H 9.742 2.441 -3.350 1.00 . B A . 1038 D6M HPF2 1 1 18 9421 2 2 1 . HPG1 H 8.292 2.588 -5.362 1.00 . B A . 1038 D6M HPG1 1 1 18 9422 2 2 1 . HPG2 H 8.666 0.936 -4.870 1.00 . B A . 1038 D6M HPG2 1 1 18 9423 2 2 1 . HPG3 H 9.501 1.657 -6.246 1.00 . B A . 1038 D6M HPG3 1 1 18 9424 2 2 1 . HQ21 H 4.473 -4.000 -2.303 1.00 . B A . 1038 D6M HQ21 1 1 18 9425 2 2 1 . HQ22 H 3.342 -4.625 -3.502 1.00 . B A . 1038 D6M HQ22 1 1 18 9426 2 2 1 . HQ31 H 2.534 -6.277 -2.000 1.00 . B A . 1038 D6M HQ31 1 1 18 9427 2 2 1 . HQ32 H 3.392 -5.556 -0.647 1.00 . B A . 1038 D6M HQ32 1 1 18 9428 2 2 1 . N03 N 5.764 -6.323 -1.126 1.00 . B A . 1038 D6M N03 1 1 18 9429 2 2 1 . O01 O 5.176 -7.752 0.473 1.00 . B A . 1038 D6M O01 1 1 18 9430 2 2 1 . O08 O 1.444 -3.911 -1.412 1.00 . B A . 1038 D6M O08 1 1 18 9431 2 2 1 . O10 O 5.956 -5.919 -3.796 1.00 . B A . 1038 D6M O10 1 1 18 9432 2 2 1 . O11 O 4.376 -7.386 -4.238 1.00 . B A . 1038 D6M O11 1 1 19 9433 1 1 1 HIS C C -28.742 -2.028 4.953 1.00 . A A . 7 HIS C 1 1 19 9434 1 1 1 HIS CA C -29.100 -1.035 6.054 1.00 . A A . 7 HIS CA 1 1 19 9435 1 1 1 HIS CB C -28.071 -1.105 7.185 1.00 . A A . 7 HIS CB 1 1 19 9436 1 1 1 HIS CD2 C -26.962 1.092 6.364 1.00 . A A . 7 HIS CD2 1 1 19 9437 1 1 1 HIS CE1 C -25.132 0.996 7.568 1.00 . A A . 7 HIS CE1 1 1 19 9438 1 1 1 HIS CG C -27.022 -0.040 7.105 1.00 . A A . 7 HIS CG 1 1 19 9439 1 1 1 HIS H1 H -31.086 -1.524 5.827 1.00 . A A . 7 HIS H1 1 1 19 9440 1 1 1 HIS H2 H -30.355 -2.147 7.247 1.00 . A A . 7 HIS H2 1 1 19 9441 1 1 1 HIS H3 H -30.752 -0.480 7.148 1.00 . A A . 7 HIS H3 1 1 19 9442 1 1 1 HIS HA H -29.107 -0.038 5.641 1.00 . A A . 7 HIS HA 1 1 19 9443 1 1 1 HIS HB2 H -28.579 -0.999 8.131 1.00 . A A . 7 HIS HB2 1 1 19 9444 1 1 1 HIS HB3 H -27.576 -2.064 7.153 1.00 . A A . 7 HIS HB3 1 1 19 9445 1 1 1 HIS HD1 H -25.607 -0.770 8.486 1.00 . A A . 7 HIS HD1 1 1 19 9446 1 1 1 HIS HD2 H -27.708 1.439 5.662 1.00 . A A . 7 HIS HD2 1 1 19 9447 1 1 1 HIS HE1 H -24.172 1.237 7.999 1.00 . A A . 7 HIS HE1 1 1 19 9448 1 1 1 HIS HE2 H -25.424 2.514 6.225 1.00 . A A . 7 HIS HE2 1 1 19 9449 1 1 1 HIS N N -30.444 -1.322 6.620 1.00 . A A . 7 HIS N 1 1 19 9450 1 1 1 HIS ND1 N -25.860 -0.071 7.848 1.00 . A A . 7 HIS ND1 1 1 19 9451 1 1 1 HIS NE2 N -25.778 1.717 6.670 1.00 . A A . 7 HIS NE2 1 1 19 9452 1 1 1 HIS O O -29.556 -2.870 4.573 1.00 . A A . 7 HIS O 1 1 19 9453 1 1 2 ALA C C -25.599 -3.214 3.607 1.00 . A A . 8 ALA C 1 1 19 9454 1 1 2 ALA CA C -27.053 -2.812 3.386 1.00 . A A . 8 ALA CA 1 1 19 9455 1 1 2 ALA CB C -27.218 -2.146 2.028 1.00 . A A . 8 ALA CB 1 1 19 9456 1 1 2 ALA H H -26.915 -1.232 4.788 1.00 . A A . 8 ALA H 1 1 19 9457 1 1 2 ALA HA H -27.668 -3.700 3.402 1.00 . A A . 8 ALA HA 1 1 19 9458 1 1 2 ALA HB1 H -27.898 -1.311 2.117 1.00 . A A . 8 ALA HB1 1 1 19 9459 1 1 2 ALA HB2 H -26.259 -1.793 1.680 1.00 . A A . 8 ALA HB2 1 1 19 9460 1 1 2 ALA HB3 H -27.616 -2.860 1.323 1.00 . A A . 8 ALA HB3 1 1 19 9461 1 1 2 ALA N N -27.519 -1.923 4.444 1.00 . A A . 8 ALA N 1 1 19 9462 1 1 2 ALA O O -25.018 -2.929 4.655 1.00 . A A . 8 ALA O 1 1 19 9463 1 1 3 GLU C C -22.776 -3.648 1.628 1.00 . A A . 9 GLU C 1 1 19 9464 1 1 3 GLU CA C -23.628 -4.319 2.700 1.00 . A A . 9 GLU CA 1 1 19 9465 1 1 3 GLU CB C -23.546 -5.840 2.556 1.00 . A A . 9 GLU CB 1 1 19 9466 1 1 3 GLU CD C -24.386 -7.840 1.262 1.00 . A A . 9 GLU CD 1 1 19 9467 1 1 3 GLU CG C -24.081 -6.355 1.230 1.00 . A A . 9 GLU CG 1 1 19 9468 1 1 3 GLU H H -25.531 -4.075 1.804 1.00 . A A . 9 GLU H 1 1 19 9469 1 1 3 GLU HA H -23.250 -4.038 3.672 1.00 . A A . 9 GLU HA 1 1 19 9470 1 1 3 GLU HB2 H -22.513 -6.143 2.645 1.00 . A A . 9 GLU HB2 1 1 19 9471 1 1 3 GLU HB3 H -24.116 -6.297 3.352 1.00 . A A . 9 GLU HB3 1 1 19 9472 1 1 3 GLU HG2 H -24.989 -5.822 0.991 1.00 . A A . 9 GLU HG2 1 1 19 9473 1 1 3 GLU HG3 H -23.344 -6.170 0.463 1.00 . A A . 9 GLU HG3 1 1 19 9474 1 1 3 GLU N N -25.016 -3.877 2.614 1.00 . A A . 9 GLU N 1 1 19 9475 1 1 3 GLU O O -23.144 -3.626 0.453 1.00 . A A . 9 GLU O 1 1 19 9476 1 1 3 GLU OE1 O -23.457 -8.642 1.029 1.00 . A A . 9 GLU OE1 1 1 19 9477 1 1 3 GLU OE2 O -25.554 -8.201 1.520 1.00 . A A . 9 GLU OE2 1 1 19 9478 1 1 4 GLY C C -19.299 -2.829 1.301 1.00 . A A . 10 GLY C 1 1 19 9479 1 1 4 GLY CA C -20.750 -2.439 1.102 1.00 . A A . 10 GLY CA 1 1 19 9480 1 1 4 GLY H H -21.396 -3.152 2.989 1.00 . A A . 10 GLY H 1 1 19 9481 1 1 4 GLY HA2 H -21.047 -2.699 0.097 1.00 . A A . 10 GLY HA2 1 1 19 9482 1 1 4 GLY HA3 H -20.845 -1.371 1.229 1.00 . A A . 10 GLY HA3 1 1 19 9483 1 1 4 GLY N N -21.637 -3.103 2.040 1.00 . A A . 10 GLY N 1 1 19 9484 1 1 4 GLY O O -18.903 -3.240 2.391 1.00 . A A . 10 GLY O 1 1 19 9485 1 1 5 THR C C -16.305 -1.981 1.074 1.00 . A A . 11 THR C 1 1 19 9486 1 1 5 THR CA C -17.087 -3.041 0.306 1.00 . A A . 11 THR CA 1 1 19 9487 1 1 5 THR CB C -16.515 -3.191 -1.105 1.00 . A A . 11 THR CB 1 1 19 9488 1 1 5 THR CG2 C -16.598 -1.920 -1.923 1.00 . A A . 11 THR CG2 1 1 19 9489 1 1 5 THR H H -18.878 -2.365 -0.598 1.00 . A A . 11 THR H 1 1 19 9490 1 1 5 THR HA H -16.997 -3.984 0.824 1.00 . A A . 11 THR HA 1 1 19 9491 1 1 5 THR HB H -17.070 -3.957 -1.627 1.00 . A A . 11 THR HB 1 1 19 9492 1 1 5 THR HG1 H -15.050 -4.297 -0.423 1.00 . A A . 11 THR HG1 1 1 19 9493 1 1 5 THR HG21 H -16.322 -1.077 -1.307 1.00 . A A . 11 THR HG21 1 1 19 9494 1 1 5 THR HG22 H -15.923 -1.989 -2.763 1.00 . A A . 11 THR HG22 1 1 19 9495 1 1 5 THR HG23 H -17.608 -1.789 -2.282 1.00 . A A . 11 THR HG23 1 1 19 9496 1 1 5 THR N N -18.504 -2.699 0.244 1.00 . A A . 11 THR N 1 1 19 9497 1 1 5 THR O O -16.548 -0.783 0.921 1.00 . A A . 11 THR O 1 1 19 9498 1 1 5 THR OG1 O -15.155 -3.582 -1.055 1.00 . A A . 11 THR OG1 1 1 19 9499 1 1 6 PHE C C -13.159 -2.105 2.933 1.00 . A A . 12 PHE C 1 1 19 9500 1 1 6 PHE CA C -14.547 -1.518 2.692 1.00 . A A . 12 PHE CA 1 1 19 9501 1 1 6 PHE CB C -15.227 -1.220 4.030 1.00 . A A . 12 PHE CB 1 1 19 9502 1 1 6 PHE CD1 C -14.028 0.961 4.344 1.00 . A A . 12 PHE CD1 1 1 19 9503 1 1 6 PHE CD2 C -14.215 -0.509 6.213 1.00 . A A . 12 PHE CD2 1 1 19 9504 1 1 6 PHE CE1 C -13.335 1.869 5.124 1.00 . A A . 12 PHE CE1 1 1 19 9505 1 1 6 PHE CE2 C -13.523 0.395 6.997 1.00 . A A . 12 PHE CE2 1 1 19 9506 1 1 6 PHE CG C -14.475 -0.236 4.879 1.00 . A A . 12 PHE CG 1 1 19 9507 1 1 6 PHE CZ C -13.083 1.585 6.452 1.00 . A A . 12 PHE CZ 1 1 19 9508 1 1 6 PHE H H -15.219 -3.394 1.978 1.00 . A A . 12 PHE H 1 1 19 9509 1 1 6 PHE HA H -14.444 -0.598 2.138 1.00 . A A . 12 PHE HA 1 1 19 9510 1 1 6 PHE HB2 H -16.210 -0.814 3.843 1.00 . A A . 12 PHE HB2 1 1 19 9511 1 1 6 PHE HB3 H -15.322 -2.139 4.589 1.00 . A A . 12 PHE HB3 1 1 19 9512 1 1 6 PHE HD1 H -14.225 1.184 3.306 1.00 . A A . 12 PHE HD1 1 1 19 9513 1 1 6 PHE HD2 H -14.559 -1.439 6.640 1.00 . A A . 12 PHE HD2 1 1 19 9514 1 1 6 PHE HE1 H -12.992 2.799 4.695 1.00 . A A . 12 PHE HE1 1 1 19 9515 1 1 6 PHE HE2 H -13.327 0.171 8.035 1.00 . A A . 12 PHE HE2 1 1 19 9516 1 1 6 PHE HZ H -12.542 2.293 7.063 1.00 . A A . 12 PHE HZ 1 1 19 9517 1 1 6 PHE N N -15.365 -2.429 1.900 1.00 . A A . 12 PHE N 1 1 19 9518 1 1 6 PHE O O -12.147 -1.441 2.709 1.00 . A A . 12 PHE O 1 1 19 9519 1 1 7 THR C C -11.015 -4.136 2.394 1.00 . A A . 13 THR C 1 1 19 9520 1 1 7 THR CA C -11.857 -4.028 3.661 1.00 . A A . 13 THR CA 1 1 19 9521 1 1 7 THR CB C -12.113 -5.421 4.237 1.00 . A A . 13 THR CB 1 1 19 9522 1 1 7 THR CG2 C -13.073 -5.418 5.407 1.00 . A A . 13 THR CG2 1 1 19 9523 1 1 7 THR H H -13.962 -3.830 3.549 1.00 . A A . 13 THR H 1 1 19 9524 1 1 7 THR HA H -11.317 -3.441 4.389 1.00 . A A . 13 THR HA 1 1 19 9525 1 1 7 THR HB H -11.176 -5.836 4.580 1.00 . A A . 13 THR HB 1 1 19 9526 1 1 7 THR HG1 H -13.417 -5.875 2.848 1.00 . A A . 13 THR HG1 1 1 19 9527 1 1 7 THR HG21 H -13.638 -4.497 5.407 1.00 . A A . 13 THR HG21 1 1 19 9528 1 1 7 THR HG22 H -13.750 -6.255 5.320 1.00 . A A . 13 THR HG22 1 1 19 9529 1 1 7 THR HG23 H -12.517 -5.499 6.329 1.00 . A A . 13 THR HG23 1 1 19 9530 1 1 7 THR N N -13.121 -3.352 3.390 1.00 . A A . 13 THR N 1 1 19 9531 1 1 7 THR O O -9.824 -3.825 2.400 1.00 . A A . 13 THR O 1 1 19 9532 1 1 7 THR OG1 O -12.645 -6.284 3.247 1.00 . A A . 13 THR OG1 1 1 19 9533 1 1 8 SER C C -10.995 -3.426 -0.763 1.00 . A A . 14 SER C 1 1 19 9534 1 1 8 SER CA C -10.950 -4.725 0.034 1.00 . A A . 14 SER CA 1 1 19 9535 1 1 8 SER CB C -11.576 -5.859 -0.781 1.00 . A A . 14 SER CB 1 1 19 9536 1 1 8 SER H H -12.592 -4.809 1.367 1.00 . A A . 14 SER H 1 1 19 9537 1 1 8 SER HA H -9.920 -4.971 0.243 1.00 . A A . 14 SER HA 1 1 19 9538 1 1 8 SER HB2 H -11.503 -5.626 -1.833 1.00 . A A . 14 SER HB2 1 1 19 9539 1 1 8 SER HB3 H -11.049 -6.779 -0.578 1.00 . A A . 14 SER HB3 1 1 19 9540 1 1 8 SER HG H -13.033 -6.775 0.155 1.00 . A A . 14 SER HG 1 1 19 9541 1 1 8 SER N N -11.642 -4.577 1.309 1.00 . A A . 14 SER N 1 1 19 9542 1 1 8 SER O O -10.080 -3.124 -1.530 1.00 . A A . 14 SER O 1 1 19 9543 1 1 8 SER OG O -12.943 -6.033 -0.447 1.00 . A A . 14 SER OG 1 1 19 9544 1 1 9 ASP C C -11.078 -0.441 -0.966 1.00 . A A . 15 ASP C 1 1 19 9545 1 1 9 ASP CA C -12.230 -1.391 -1.279 1.00 . A A . 15 ASP CA 1 1 19 9546 1 1 9 ASP CB C -13.561 -0.741 -0.896 1.00 . A A . 15 ASP CB 1 1 19 9547 1 1 9 ASP CG C -13.931 0.405 -1.818 1.00 . A A . 15 ASP CG 1 1 19 9548 1 1 9 ASP H H -12.761 -2.953 0.047 1.00 . A A . 15 ASP H 1 1 19 9549 1 1 9 ASP HA H -12.232 -1.597 -2.339 1.00 . A A . 15 ASP HA 1 1 19 9550 1 1 9 ASP HB2 H -14.343 -1.483 -0.944 1.00 . A A . 15 ASP HB2 1 1 19 9551 1 1 9 ASP HB3 H -13.492 -0.361 0.112 1.00 . A A . 15 ASP HB3 1 1 19 9552 1 1 9 ASP N N -12.065 -2.659 -0.577 1.00 . A A . 15 ASP N 1 1 19 9553 1 1 9 ASP O O -10.589 0.268 -1.846 1.00 . A A . 15 ASP O 1 1 19 9554 1 1 9 ASP OD1 O -13.443 0.423 -2.967 1.00 . A A . 15 ASP OD1 1 1 19 9555 1 1 9 ASP OD2 O -14.708 1.283 -1.389 1.00 . A A . 15 ASP OD2 1 1 19 9556 1 1 10 VAL C C -8.226 -0.014 0.107 1.00 . A A . 16 VAL C 1 1 19 9557 1 1 10 VAL CA C -9.555 0.432 0.717 1.00 . A A . 16 VAL CA 1 1 19 9558 1 1 10 VAL CB C -9.424 0.465 2.252 1.00 . A A . 16 VAL CB 1 1 19 9559 1 1 10 VAL CG1 C -9.036 -0.903 2.793 1.00 . A A . 16 VAL CG1 1 1 19 9560 1 1 10 VAL CG2 C -8.416 1.523 2.674 1.00 . A A . 16 VAL CG2 1 1 19 9561 1 1 10 VAL H H -11.078 -1.019 0.948 1.00 . A A . 16 VAL H 1 1 19 9562 1 1 10 VAL HA H -9.774 1.433 0.376 1.00 . A A . 16 VAL HA 1 1 19 9563 1 1 10 VAL HB H -10.385 0.731 2.668 1.00 . A A . 16 VAL HB 1 1 19 9564 1 1 10 VAL HG11 H -9.258 -1.658 2.054 1.00 . A A . 16 VAL HG11 1 1 19 9565 1 1 10 VAL HG12 H -7.979 -0.916 3.015 1.00 . A A . 16 VAL HG12 1 1 19 9566 1 1 10 VAL HG13 H -9.596 -1.105 3.694 1.00 . A A . 16 VAL HG13 1 1 19 9567 1 1 10 VAL HG21 H -8.623 2.445 2.151 1.00 . A A . 16 VAL HG21 1 1 19 9568 1 1 10 VAL HG22 H -8.492 1.689 3.739 1.00 . A A . 16 VAL HG22 1 1 19 9569 1 1 10 VAL HG23 H -7.419 1.187 2.431 1.00 . A A . 16 VAL HG23 1 1 19 9570 1 1 10 VAL N N -10.649 -0.431 0.291 1.00 . A A . 16 VAL N 1 1 19 9571 1 1 10 VAL O O -7.272 0.760 0.044 1.00 . A A . 16 VAL O 1 1 19 9572 1 1 11 SER C C -6.921 -1.525 -2.445 1.00 . A A . 17 SER C 1 1 19 9573 1 1 11 SER CA C -6.955 -1.801 -0.943 1.00 . A A . 17 SER CA 1 1 19 9574 1 1 11 SER CB C -6.857 -3.307 -0.688 1.00 . A A . 17 SER CB 1 1 19 9575 1 1 11 SER H H -8.958 -1.838 -0.262 1.00 . A A . 17 SER H 1 1 19 9576 1 1 11 SER HA H -6.111 -1.312 -0.480 1.00 . A A . 17 SER HA 1 1 19 9577 1 1 11 SER HB2 H -7.111 -3.512 0.341 1.00 . A A . 17 SER HB2 1 1 19 9578 1 1 11 SER HB3 H -7.546 -3.825 -1.339 1.00 . A A . 17 SER HB3 1 1 19 9579 1 1 11 SER HG H -5.592 -4.608 -1.426 1.00 . A A . 17 SER HG 1 1 19 9580 1 1 11 SER N N -8.169 -1.264 -0.339 1.00 . A A . 17 SER N 1 1 19 9581 1 1 11 SER O O -5.860 -1.570 -3.069 1.00 . A A . 17 SER O 1 1 19 9582 1 1 11 SER OG O -5.546 -3.783 -0.937 1.00 . A A . 17 SER OG 1 1 19 9583 1 1 12 SER C C -7.683 0.425 -4.795 1.00 . A A . 18 SER C 1 1 19 9584 1 1 12 SER CA C -8.190 -0.975 -4.451 1.00 . A A . 18 SER CA 1 1 19 9585 1 1 12 SER CB C -9.639 -1.131 -4.915 1.00 . A A . 18 SER CB 1 1 19 9586 1 1 12 SER H H -8.900 -1.234 -2.476 1.00 . A A . 18 SER H 1 1 19 9587 1 1 12 SER HA H -7.580 -1.700 -4.969 1.00 . A A . 18 SER HA 1 1 19 9588 1 1 12 SER HB2 H -9.686 -1.020 -5.988 1.00 . A A . 18 SER HB2 1 1 19 9589 1 1 12 SER HB3 H -10.000 -2.111 -4.639 1.00 . A A . 18 SER HB3 1 1 19 9590 1 1 12 SER HG H -11.394 -0.392 -4.454 1.00 . A A . 18 SER HG 1 1 19 9591 1 1 12 SER N N -8.087 -1.248 -3.022 1.00 . A A . 18 SER N 1 1 19 9592 1 1 12 SER O O -6.984 0.609 -5.792 1.00 . A A . 18 SER O 1 1 19 9593 1 1 12 SER OG O -10.474 -0.153 -4.319 1.00 . A A . 18 SER OG 1 1 19 9594 1 1 13 TYR C C -6.102 2.893 -4.311 1.00 . A A . 19 TYR C 1 1 19 9595 1 1 13 TYR CA C -7.625 2.791 -4.222 1.00 . A A . 19 TYR CA 1 1 19 9596 1 1 13 TYR CB C -8.171 3.728 -3.129 1.00 . A A . 19 TYR CB 1 1 19 9597 1 1 13 TYR CD1 C -6.127 4.721 -2.020 1.00 . A A . 19 TYR CD1 1 1 19 9598 1 1 13 TYR CD2 C -7.523 3.287 -0.726 1.00 . A A . 19 TYR CD2 1 1 19 9599 1 1 13 TYR CE1 C -5.291 4.895 -0.934 1.00 . A A . 19 TYR CE1 1 1 19 9600 1 1 13 TYR CE2 C -6.692 3.457 0.365 1.00 . A A . 19 TYR CE2 1 1 19 9601 1 1 13 TYR CG C -7.255 3.913 -1.935 1.00 . A A . 19 TYR CG 1 1 19 9602 1 1 13 TYR CZ C -5.578 4.261 0.256 1.00 . A A . 19 TYR CZ 1 1 19 9603 1 1 13 TYR H H -8.610 1.211 -3.203 1.00 . A A . 19 TYR H 1 1 19 9604 1 1 13 TYR HA H -8.041 3.091 -5.173 1.00 . A A . 19 TYR HA 1 1 19 9605 1 1 13 TYR HB2 H -8.346 4.702 -3.560 1.00 . A A . 19 TYR HB2 1 1 19 9606 1 1 13 TYR HB3 H -9.109 3.331 -2.766 1.00 . A A . 19 TYR HB3 1 1 19 9607 1 1 13 TYR HD1 H -5.904 5.215 -2.953 1.00 . A A . 19 TYR HD1 1 1 19 9608 1 1 13 TYR HD2 H -8.396 2.657 -0.643 1.00 . A A . 19 TYR HD2 1 1 19 9609 1 1 13 TYR HE1 H -4.419 5.526 -1.019 1.00 . A A . 19 TYR HE1 1 1 19 9610 1 1 13 TYR HE2 H -6.916 2.960 1.297 1.00 . A A . 19 TYR HE2 1 1 19 9611 1 1 13 TYR HH H -4.419 3.577 1.629 1.00 . A A . 19 TYR HH 1 1 19 9612 1 1 13 TYR N N -8.045 1.412 -3.978 1.00 . A A . 19 TYR N 1 1 19 9613 1 1 13 TYR O O -5.568 3.824 -4.913 1.00 . A A . 19 TYR O 1 1 19 9614 1 1 13 TYR OH O -4.748 4.431 1.340 1.00 . A A . 19 TYR OH 1 1 19 9615 1 1 14 LEU C C -3.420 1.871 -5.151 1.00 . A A . 20 LEU C 1 1 19 9616 1 1 14 LEU CA C -3.951 1.913 -3.718 1.00 . A A . 20 LEU CA 1 1 19 9617 1 1 14 LEU CB C -3.431 0.709 -2.926 1.00 . A A . 20 LEU CB 1 1 19 9618 1 1 14 LEU CD1 C -3.430 -0.656 -0.824 1.00 . A A . 20 LEU CD1 1 1 19 9619 1 1 14 LEU CD2 C -4.160 1.735 -0.755 1.00 . A A . 20 LEU CD2 1 1 19 9620 1 1 14 LEU CG C -4.127 0.460 -1.586 1.00 . A A . 20 LEU CG 1 1 19 9621 1 1 14 LEU H H -5.891 1.215 -3.242 1.00 . A A . 20 LEU H 1 1 19 9622 1 1 14 LEU HA H -3.605 2.820 -3.246 1.00 . A A . 20 LEU HA 1 1 19 9623 1 1 14 LEU HB2 H -3.547 -0.174 -3.538 1.00 . A A . 20 LEU HB2 1 1 19 9624 1 1 14 LEU HB3 H -2.378 0.859 -2.736 1.00 . A A . 20 LEU HB3 1 1 19 9625 1 1 14 LEU HD11 H -2.387 -0.686 -1.104 1.00 . A A . 20 LEU HD11 1 1 19 9626 1 1 14 LEU HD12 H -3.512 -0.473 0.237 1.00 . A A . 20 LEU HD12 1 1 19 9627 1 1 14 LEU HD13 H -3.895 -1.600 -1.064 1.00 . A A . 20 LEU HD13 1 1 19 9628 1 1 14 LEU HD21 H -4.718 2.494 -1.283 1.00 . A A . 20 LEU HD21 1 1 19 9629 1 1 14 LEU HD22 H -4.634 1.534 0.194 1.00 . A A . 20 LEU HD22 1 1 19 9630 1 1 14 LEU HD23 H -3.151 2.081 -0.587 1.00 . A A . 20 LEU HD23 1 1 19 9631 1 1 14 LEU HG H -5.146 0.152 -1.768 1.00 . A A . 20 LEU HG 1 1 19 9632 1 1 14 LEU N N -5.410 1.930 -3.707 1.00 . A A . 20 LEU N 1 1 19 9633 1 1 14 LEU O O -4.143 2.178 -6.098 1.00 . A A . 20 LEU O 1 1 19 9634 1 1 15 GLU C C -1.250 2.808 -7.173 1.00 . A A . 21 GLU C 1 1 19 9635 1 1 15 GLU CA C -1.524 1.414 -6.619 1.00 . A A . 21 GLU CA 1 1 19 9636 1 1 15 GLU CB C -2.407 0.628 -7.595 1.00 . A A . 21 GLU CB 1 1 19 9637 1 1 15 GLU CD C -4.266 -1.080 -7.683 1.00 . A A . 21 GLU CD 1 1 19 9638 1 1 15 GLU CG C -2.978 -0.652 -7.006 1.00 . A A . 21 GLU CG 1 1 19 9639 1 1 15 GLU H H -1.624 1.262 -4.510 1.00 . A A . 21 GLU H 1 1 19 9640 1 1 15 GLU HA H -0.583 0.896 -6.505 1.00 . A A . 21 GLU HA 1 1 19 9641 1 1 15 GLU HB2 H -3.230 1.256 -7.902 1.00 . A A . 21 GLU HB2 1 1 19 9642 1 1 15 GLU HB3 H -1.821 0.368 -8.464 1.00 . A A . 21 GLU HB3 1 1 19 9643 1 1 15 GLU HG2 H -2.251 -1.442 -7.120 1.00 . A A . 21 GLU HG2 1 1 19 9644 1 1 15 GLU HG3 H -3.176 -0.494 -5.956 1.00 . A A . 21 GLU HG3 1 1 19 9645 1 1 15 GLU N N -2.151 1.492 -5.303 1.00 . A A . 21 GLU N 1 1 19 9646 1 1 15 GLU O O -2.000 3.314 -8.008 1.00 . A A . 21 GLU O 1 1 19 9647 1 1 15 GLU OE1 O -5.063 -0.194 -8.055 1.00 . A A . 21 GLU OE1 1 1 19 9648 1 1 15 GLU OE2 O -4.477 -2.301 -7.840 1.00 . A A . 21 GLU OE2 1 1 19 9649 1 1 16 GLY C C 1.382 5.324 -6.424 1.00 . A A . 22 GLY C 1 1 19 9650 1 1 16 GLY CA C 0.183 4.757 -7.158 1.00 . A A . 22 GLY CA 1 1 19 9651 1 1 16 GLY H H 0.389 2.973 -6.035 1.00 . A A . 22 GLY H 1 1 19 9652 1 1 16 GLY HA2 H 0.407 4.715 -8.213 1.00 . A A . 22 GLY HA2 1 1 19 9653 1 1 16 GLY HA3 H -0.661 5.413 -7.005 1.00 . A A . 22 GLY HA3 1 1 19 9654 1 1 16 GLY N N -0.171 3.425 -6.700 1.00 . A A . 22 GLY N 1 1 19 9655 1 1 16 GLY O O 2.420 4.670 -6.318 1.00 . A A . 22 GLY O 1 1 19 9656 1 1 17 GLN C C 2.252 6.881 -3.699 1.00 . A A . 23 GLN C 1 1 19 9657 1 1 17 GLN CA C 2.320 7.201 -5.190 1.00 . A A . 23 GLN CA 1 1 19 9658 1 1 17 GLN CB C 2.256 8.714 -5.401 1.00 . A A . 23 GLN CB 1 1 19 9659 1 1 17 GLN CD C 3.662 10.611 -4.502 1.00 . A A . 23 GLN CD 1 1 19 9660 1 1 17 GLN CG C 3.619 9.388 -5.396 1.00 . A A . 23 GLN CG 1 1 19 9661 1 1 17 GLN H H 0.388 7.014 -6.035 1.00 . A A . 23 GLN H 1 1 19 9662 1 1 17 GLN HA H 3.255 6.832 -5.582 1.00 . A A . 23 GLN HA 1 1 19 9663 1 1 17 GLN HB2 H 1.783 8.914 -6.352 1.00 . A A . 23 GLN HB2 1 1 19 9664 1 1 17 GLN HB3 H 1.659 9.151 -4.614 1.00 . A A . 23 GLN HB3 1 1 19 9665 1 1 17 GLN HE21 H 3.193 9.501 -2.920 1.00 . A A . 23 GLN HE21 1 1 19 9666 1 1 17 GLN HE22 H 3.417 11.186 -2.614 1.00 . A A . 23 GLN HE22 1 1 19 9667 1 1 17 GLN HG2 H 4.355 8.680 -5.047 1.00 . A A . 23 GLN HG2 1 1 19 9668 1 1 17 GLN HG3 H 3.861 9.689 -6.405 1.00 . A A . 23 GLN HG3 1 1 19 9669 1 1 17 GLN N N 1.240 6.544 -5.917 1.00 . A A . 23 GLN N 1 1 19 9670 1 1 17 GLN NE2 N 3.398 10.413 -3.215 1.00 . A A . 23 GLN NE2 1 1 19 9671 1 1 17 GLN O O 3.253 6.974 -2.990 1.00 . A A . 23 GLN O 1 1 19 9672 1 1 17 GLN OE1 O 3.929 11.721 -4.961 1.00 . A A . 23 GLN OE1 1 1 19 9673 1 1 18 ALA C C 1.826 5.073 -1.375 1.00 . A A . 24 ALA C 1 1 19 9674 1 1 18 ALA CA C 0.873 6.176 -1.821 1.00 . A A . 24 ALA CA 1 1 19 9675 1 1 18 ALA CB C -0.569 5.762 -1.568 1.00 . A A . 24 ALA CB 1 1 19 9676 1 1 18 ALA H H 0.302 6.452 -3.840 1.00 . A A . 24 ALA H 1 1 19 9677 1 1 18 ALA HA H 1.072 7.066 -1.242 1.00 . A A . 24 ALA HA 1 1 19 9678 1 1 18 ALA HB1 H -1.236 6.471 -2.036 1.00 . A A . 24 ALA HB1 1 1 19 9679 1 1 18 ALA HB2 H -0.739 4.779 -1.984 1.00 . A A . 24 ALA HB2 1 1 19 9680 1 1 18 ALA HB3 H -0.756 5.740 -0.505 1.00 . A A . 24 ALA HB3 1 1 19 9681 1 1 18 ALA N N 1.066 6.506 -3.228 1.00 . A A . 24 ALA N 1 1 19 9682 1 1 18 ALA O O 2.475 5.184 -0.336 1.00 . A A . 24 ALA O 1 1 19 9683 1 1 19 ALA C C 4.220 3.334 -1.645 1.00 . A A . 25 ALA C 1 1 19 9684 1 1 19 ALA CA C 2.776 2.882 -1.846 1.00 . A A . 25 ALA CA 1 1 19 9685 1 1 19 ALA CB C 2.700 1.832 -2.944 1.00 . A A . 25 ALA CB 1 1 19 9686 1 1 19 ALA H H 1.360 3.975 -2.979 1.00 . A A . 25 ALA H 1 1 19 9687 1 1 19 ALA HA H 2.421 2.434 -0.928 1.00 . A A . 25 ALA HA 1 1 19 9688 1 1 19 ALA HB1 H 2.662 2.321 -3.907 1.00 . A A . 25 ALA HB1 1 1 19 9689 1 1 19 ALA HB2 H 3.572 1.197 -2.896 1.00 . A A . 25 ALA HB2 1 1 19 9690 1 1 19 ALA HB3 H 1.811 1.234 -2.809 1.00 . A A . 25 ALA HB3 1 1 19 9691 1 1 19 ALA N N 1.904 4.007 -2.164 1.00 . A A . 25 ALA N 1 1 19 9692 1 1 19 ALA O O 4.996 2.673 -0.957 1.00 . A A . 25 ALA O 1 1 19 9693 1 1 20 LYS C C 6.224 5.422 -0.687 1.00 . A A . 26 LYS C 1 1 19 9694 1 1 20 LYS CA C 5.930 4.991 -2.123 1.00 . A A . 26 LYS CA 1 1 19 9695 1 1 20 LYS CB C 6.136 6.167 -3.081 1.00 . A A . 26 LYS CB 1 1 19 9696 1 1 20 LYS CD C 7.317 5.954 -5.306 1.00 . A A . 26 LYS CD 1 1 19 9697 1 1 20 LYS CE C 6.450 4.750 -5.651 1.00 . A A . 26 LYS CE 1 1 19 9698 1 1 20 LYS CG C 7.478 6.133 -3.801 1.00 . A A . 26 LYS CG 1 1 19 9699 1 1 20 LYS HA H 6.614 4.200 -2.390 1.00 . A A . 26 LYS HA 1 1 19 9700 1 1 20 LYS HB2 H 5.351 6.156 -3.822 1.00 . A A . 26 LYS HB2 1 1 19 9701 1 1 20 LYS HD2 H 6.859 6.840 -5.716 1.00 . A A . 26 LYS HD2 1 1 19 9702 1 1 20 LYS HE2 H 5.426 4.975 -5.393 1.00 . A A . 26 LYS HE2 1 1 19 9703 1 1 20 LYS HG2 H 7.995 7.063 -3.617 1.00 . A A . 26 LYS HG2 1 1 19 9704 1 1 20 LYS HZ1 H 7.341 3.659 -4.090 1.00 . A A . 26 LYS HZ1 1 1 19 9705 1 1 20 LYS N N 4.577 4.463 -2.246 1.00 . A A . 26 LYS N 1 1 19 9706 1 1 20 LYS NZ N 6.862 3.545 -4.935 1.00 . A A . 26 LYS NZ 1 1 19 9707 1 1 20 LYS O O 7.383 5.551 -0.295 1.00 . A A . 26 LYS O 1 1 19 9708 1 1 21 GLU C C 6.063 5.000 2.298 1.00 . A A . 27 GLU C 1 1 19 9709 1 1 21 GLU CA C 5.331 6.063 1.484 1.00 . A A . 27 GLU CA 1 1 19 9710 1 1 21 GLU CB C 3.969 6.358 2.115 1.00 . A A . 27 GLU CB 1 1 19 9711 1 1 21 GLU CD C 2.677 8.094 0.812 1.00 . A A . 27 GLU CD 1 1 19 9712 1 1 21 GLU CG C 3.558 7.818 2.015 1.00 . A A . 27 GLU CG 1 1 19 9713 1 1 21 GLU H H 4.269 5.530 -0.268 1.00 . A A . 27 GLU H 1 1 19 9714 1 1 21 GLU HA H 5.920 6.968 1.490 1.00 . A A . 27 GLU HA 1 1 19 9715 1 1 21 GLU HB2 H 3.219 5.759 1.622 1.00 . A A . 27 GLU HB2 1 1 19 9716 1 1 21 GLU HB3 H 4.002 6.086 3.160 1.00 . A A . 27 GLU HB3 1 1 19 9717 1 1 21 GLU HG2 H 3.016 8.089 2.909 1.00 . A A . 27 GLU HG2 1 1 19 9718 1 1 21 GLU HG3 H 4.449 8.424 1.938 1.00 . A A . 27 GLU HG3 1 1 19 9719 1 1 21 GLU N N 5.171 5.646 0.096 1.00 . A A . 27 GLU N 1 1 19 9720 1 1 21 GLU O O 6.823 5.323 3.211 1.00 . A A . 27 GLU O 1 1 19 9721 1 1 21 GLU OE1 O 3.052 7.680 -0.305 1.00 . A A . 27 GLU OE1 1 1 19 9722 1 1 21 GLU OE2 O 1.613 8.724 0.986 1.00 . A A . 27 GLU OE2 1 1 19 9723 1 1 22 PHE C C 7.834 2.304 2.058 1.00 . A A . 28 PHE C 1 1 19 9724 1 1 22 PHE CA C 6.483 2.638 2.681 1.00 . A A . 28 PHE CA 1 1 19 9725 1 1 22 PHE CB C 5.590 1.387 2.707 1.00 . A A . 28 PHE CB 1 1 19 9726 1 1 22 PHE CD1 C 6.449 0.070 0.768 1.00 . A A . 28 PHE CD1 1 1 19 9727 1 1 22 PHE CD2 C 4.171 0.759 0.734 1.00 . A A . 28 PHE CD2 1 1 19 9728 1 1 22 PHE CE1 C 6.290 -0.544 -0.447 1.00 . A A . 28 PHE CE1 1 1 19 9729 1 1 22 PHE CE2 C 4.001 0.140 -0.489 1.00 . A A . 28 PHE CE2 1 1 19 9730 1 1 22 PHE CG C 5.399 0.730 1.374 1.00 . A A . 28 PHE CG 1 1 19 9731 1 1 22 PHE CZ C 5.064 -0.513 -1.082 1.00 . A A . 28 PHE CZ 1 1 19 9732 1 1 22 PHE H H 5.219 3.529 1.232 1.00 . A A . 28 PHE H 1 1 19 9733 1 1 22 PHE HA H 6.647 2.966 3.697 1.00 . A A . 28 PHE HA 1 1 19 9734 1 1 22 PHE HB2 H 6.038 0.652 3.359 1.00 . A A . 28 PHE HB2 1 1 19 9735 1 1 22 PHE HB3 H 4.616 1.655 3.089 1.00 . A A . 28 PHE HB3 1 1 19 9736 1 1 22 PHE HD1 H 3.342 1.273 1.196 1.00 . A A . 28 PHE HD1 1 1 19 9737 1 1 22 PHE HD2 H 7.409 0.041 1.258 1.00 . A A . 28 PHE HD2 1 1 19 9738 1 1 22 PHE HE1 H 3.040 0.167 -0.981 1.00 . A A . 28 PHE HE1 1 1 19 9739 1 1 22 PHE HE2 H 7.127 -1.048 -0.898 1.00 . A A . 28 PHE HE2 1 1 19 9740 1 1 22 PHE HZ H 4.936 -0.999 -2.037 1.00 . A A . 28 PHE HZ 1 1 19 9741 1 1 22 PHE N N 5.833 3.731 1.968 1.00 . A A . 28 PHE N 1 1 19 9742 1 1 22 PHE O O 8.794 1.994 2.763 1.00 . A A . 28 PHE O 1 1 19 9743 1 1 23 ILE C C 10.319 2.868 0.587 1.00 . A A . 29 ILE C 1 1 19 9744 1 1 23 ILE CA C 9.150 2.047 0.035 1.00 . A A . 29 ILE CA 1 1 19 9745 1 1 23 ILE CB C 9.019 2.244 -1.495 1.00 . A A . 29 ILE CB 1 1 19 9746 1 1 23 ILE CD1 C 11.326 1.453 -2.274 1.00 . A A . 29 ILE CD1 1 1 19 9747 1 1 23 ILE CG1 C 9.837 1.174 -2.234 1.00 . A A . 29 ILE CG1 1 1 19 9748 1 1 23 ILE CG2 C 9.444 3.647 -1.919 1.00 . A A . 29 ILE CG2 1 1 19 9749 1 1 23 ILE H H 7.115 2.608 0.213 1.00 . A A . 29 ILE H 1 1 19 9750 1 1 23 ILE HA H 9.353 1.004 0.215 1.00 . A A . 29 ILE HA 1 1 19 9751 1 1 23 ILE HB H 7.979 2.124 -1.756 1.00 . A A . 29 ILE HB 1 1 19 9752 1 1 23 ILE HD11 H 11.536 2.368 -1.743 1.00 . A A . 29 ILE HD11 1 1 19 9753 1 1 23 ILE HD12 H 11.857 0.636 -1.809 1.00 . A A . 29 ILE HD12 1 1 19 9754 1 1 23 ILE HD13 H 11.646 1.551 -3.301 1.00 . A A . 29 ILE HD13 1 1 19 9755 1 1 23 ILE HG12 H 9.696 0.218 -1.745 1.00 . A A . 29 ILE HG12 1 1 19 9756 1 1 23 ILE HG13 H 9.486 1.103 -3.253 1.00 . A A . 29 ILE HG13 1 1 19 9757 1 1 23 ILE HG21 H 8.904 4.378 -1.338 1.00 . A A . 29 ILE HG21 1 1 19 9758 1 1 23 ILE HG22 H 10.504 3.768 -1.754 1.00 . A A . 29 ILE HG22 1 1 19 9759 1 1 23 ILE HG23 H 9.225 3.787 -2.968 1.00 . A A . 29 ILE HG23 1 1 19 9760 1 1 23 ILE N N 7.909 2.361 0.731 1.00 . A A . 29 ILE N 1 1 19 9761 1 1 23 ILE O O 11.480 2.489 0.439 1.00 . A A . 29 ILE O 1 1 19 9762 1 1 24 ALA C C 11.563 4.262 3.121 1.00 . A A . 30 ALA C 1 1 19 9763 1 1 24 ALA CA C 11.025 4.846 1.814 1.00 . A A . 30 ALA CA 1 1 19 9764 1 1 24 ALA CB C 10.468 6.245 2.044 1.00 . A A . 30 ALA CB 1 1 19 9765 1 1 24 ALA H H 9.061 4.237 1.326 1.00 . A A . 30 ALA H 1 1 19 9766 1 1 24 ALA HA H 11.837 4.922 1.105 1.00 . A A . 30 ALA HA 1 1 19 9767 1 1 24 ALA HB1 H 9.533 6.352 1.513 1.00 . A A . 30 ALA HB1 1 1 19 9768 1 1 24 ALA HB2 H 10.301 6.397 3.100 1.00 . A A . 30 ALA HB2 1 1 19 9769 1 1 24 ALA HB3 H 11.173 6.978 1.682 1.00 . A A . 30 ALA HB3 1 1 19 9770 1 1 24 ALA N N 10.003 3.986 1.233 1.00 . A A . 30 ALA N 1 1 19 9771 1 1 24 ALA O O 12.649 4.628 3.571 1.00 . A A . 30 ALA O 1 1 19 9772 1 1 25 TRP C C 12.019 1.457 4.750 1.00 . A A . 31 TRP C 1 1 19 9773 1 1 25 TRP CA C 11.205 2.734 4.989 1.00 . A A . 31 TRP CA 1 1 19 9774 1 1 25 TRP CB C 9.972 2.393 5.852 1.00 . A A . 31 TRP CB 1 1 19 9775 1 1 25 TRP CD1 C 10.667 0.272 7.116 1.00 . A A . 31 TRP CD1 1 1 19 9776 1 1 25 TRP CD2 C 9.052 -0.055 5.601 1.00 . A A . 31 TRP CD2 1 1 19 9777 1 1 25 TRP CE2 C 9.365 -1.290 6.196 1.00 . A A . 31 TRP CE2 1 1 19 9778 1 1 25 TRP CE3 C 8.058 -0.016 4.619 1.00 . A A . 31 TRP CE3 1 1 19 9779 1 1 25 TRP CG C 9.899 0.933 6.201 1.00 . A A . 31 TRP CG 1 1 19 9780 1 1 25 TRP CH2 C 7.760 -2.405 4.871 1.00 . A A . 31 TRP CH2 1 1 19 9781 1 1 25 TRP CZ2 C 8.727 -2.472 5.835 1.00 . A A . 31 TRP CZ2 1 1 19 9782 1 1 25 TRP CZ3 C 7.421 -1.191 4.267 1.00 . A A . 31 TRP CZ3 1 1 19 9783 1 1 25 TRP H H 9.940 3.105 3.330 1.00 . A A . 31 TRP H 1 1 19 9784 1 1 25 TRP HA H 11.819 3.442 5.524 1.00 . A A . 31 TRP HA 1 1 19 9785 1 1 25 TRP HB2 H 10.014 2.957 6.772 1.00 . A A . 31 TRP HB2 1 1 19 9786 1 1 25 TRP HB3 H 9.075 2.655 5.311 1.00 . A A . 31 TRP HB3 1 1 19 9787 1 1 25 TRP HD1 H 11.413 0.744 7.738 1.00 . A A . 31 TRP HD1 1 1 19 9788 1 1 25 TRP HE1 H 10.773 -1.747 7.682 1.00 . A A . 31 TRP HE1 1 1 19 9789 1 1 25 TRP HE3 H 7.779 0.911 4.145 1.00 . A A . 31 TRP HE3 1 1 19 9790 1 1 25 TRP HH2 H 7.238 -3.299 4.565 1.00 . A A . 31 TRP HH2 1 1 19 9791 1 1 25 TRP HZ2 H 8.984 -3.416 6.282 1.00 . A A . 31 TRP HZ2 1 1 19 9792 1 1 25 TRP HZ3 H 6.652 -1.180 3.509 1.00 . A A . 31 TRP HZ3 1 1 19 9793 1 1 25 TRP N N 10.798 3.356 3.731 1.00 . A A . 31 TRP N 1 1 19 9794 1 1 25 TRP NE1 N 10.356 -1.066 7.115 1.00 . A A . 31 TRP NE1 1 1 19 9795 1 1 25 TRP O O 13.153 1.334 5.211 1.00 . A A . 31 TRP O 1 1 19 9796 1 1 26 LEU C C 13.416 -0.665 3.186 1.00 . A A . 32 LEU C 1 1 19 9797 1 1 26 LEU CA C 12.027 -0.803 3.814 1.00 . A A . 32 LEU CA 1 1 19 9798 1 1 26 LEU CB C 11.093 -1.688 2.960 1.00 . A A . 32 LEU CB 1 1 19 9799 1 1 26 LEU CD1 C 11.232 -0.143 1.000 1.00 . A A . 32 LEU CD1 1 1 19 9800 1 1 26 LEU CD2 C 12.520 -2.291 0.989 1.00 . A A . 32 LEU CD2 1 1 19 9801 1 1 26 LEU CG C 11.251 -1.589 1.443 1.00 . A A . 32 LEU CG 1 1 19 9802 1 1 26 LEU H H 10.483 0.642 3.762 1.00 . A A . 32 LEU H 1 1 19 9803 1 1 26 LEU HA H 12.150 -1.281 4.775 1.00 . A A . 32 LEU HA 1 1 19 9804 1 1 26 LEU HB2 H 11.253 -2.716 3.244 1.00 . A A . 32 LEU HB2 1 1 19 9805 1 1 26 LEU HB3 H 10.071 -1.425 3.201 1.00 . A A . 32 LEU HB3 1 1 19 9806 1 1 26 LEU HD11 H 10.595 0.426 1.666 1.00 . A A . 32 LEU HD11 1 1 19 9807 1 1 26 LEU HD12 H 12.230 0.256 1.024 1.00 . A A . 32 LEU HD12 1 1 19 9808 1 1 26 LEU HD13 H 10.845 -0.082 -0.005 1.00 . A A . 32 LEU HD13 1 1 19 9809 1 1 26 LEU HD21 H 12.754 -3.087 1.681 1.00 . A A . 32 LEU HD21 1 1 19 9810 1 1 26 LEU HD22 H 12.369 -2.701 0.003 1.00 . A A . 32 LEU HD22 1 1 19 9811 1 1 26 LEU HD23 H 13.334 -1.585 0.963 1.00 . A A . 32 LEU HD23 1 1 19 9812 1 1 26 LEU HG H 10.414 -2.083 0.973 1.00 . A A . 32 LEU HG 1 1 19 9813 1 1 26 LEU N N 11.400 0.491 4.069 1.00 . A A . 32 LEU N 1 1 19 9814 1 1 26 LEU O O 14.224 -1.591 3.259 1.00 . A A . 32 LEU O 1 1 19 9815 1 1 27 VAL C C 15.977 1.327 2.959 1.00 . A A . 33 VAL C 1 1 19 9816 1 1 27 VAL CA C 15.002 0.708 1.960 1.00 . A A . 33 VAL CA 1 1 19 9817 1 1 27 VAL CB C 14.895 1.614 0.711 1.00 . A A . 33 VAL CB 1 1 19 9818 1 1 27 VAL CG1 C 16.276 2.027 0.215 1.00 . A A . 33 VAL CG1 1 1 19 9819 1 1 27 VAL CG2 C 14.122 0.907 -0.395 1.00 . A A . 33 VAL CG2 1 1 19 9820 1 1 27 VAL H H 13.026 1.194 2.551 1.00 . A A . 33 VAL H 1 1 19 9821 1 1 27 VAL HA H 15.389 -0.252 1.649 1.00 . A A . 33 VAL HA 1 1 19 9822 1 1 27 VAL HB H 14.354 2.507 0.984 1.00 . A A . 33 VAL HB 1 1 19 9823 1 1 27 VAL HG11 H 16.861 1.145 0.000 1.00 . A A . 33 VAL HG11 1 1 19 9824 1 1 27 VAL HG12 H 16.174 2.619 -0.683 1.00 . A A . 33 VAL HG12 1 1 19 9825 1 1 27 VAL HG13 H 16.772 2.612 0.976 1.00 . A A . 33 VAL HG13 1 1 19 9826 1 1 27 VAL HG21 H 14.052 -0.147 -0.170 1.00 . A A . 33 VAL HG21 1 1 19 9827 1 1 27 VAL HG22 H 13.130 1.326 -0.463 1.00 . A A . 33 VAL HG22 1 1 19 9828 1 1 27 VAL HG23 H 14.634 1.041 -1.336 1.00 . A A . 33 VAL HG23 1 1 19 9829 1 1 27 VAL N N 13.700 0.484 2.579 1.00 . A A . 33 VAL N 1 1 19 9830 1 1 27 VAL O O 17.130 0.907 3.057 1.00 . A A . 33 VAL O 1 1 19 9831 1 1 28 ARG C C 16.653 2.067 5.852 1.00 . A A . 34 ARG C 1 1 19 9832 1 1 28 ARG CA C 16.335 3.000 4.689 1.00 . A A . 34 ARG CA 1 1 19 9833 1 1 28 ARG CB C 15.632 4.258 5.203 1.00 . A A . 34 ARG CB 1 1 19 9834 1 1 28 ARG CD C 16.489 6.007 6.795 1.00 . A A . 34 ARG CD 1 1 19 9835 1 1 28 ARG CG C 16.566 5.445 5.385 1.00 . A A . 34 ARG CG 1 1 19 9836 1 1 28 ARG CZ C 18.081 6.653 8.561 1.00 . A A . 34 ARG CZ 1 1 19 9837 1 1 28 ARG H H 14.577 2.616 3.574 1.00 . A A . 34 ARG H 1 1 19 9838 1 1 28 ARG HA H 17.259 3.285 4.209 1.00 . A A . 34 ARG HA 1 1 19 9839 1 1 28 ARG HB2 H 14.862 4.539 4.500 1.00 . A A . 34 ARG HB2 1 1 19 9840 1 1 28 ARG HB3 H 15.173 4.037 6.156 1.00 . A A . 34 ARG HB3 1 1 19 9841 1 1 28 ARG HD2 H 15.806 6.844 6.799 1.00 . A A . 34 ARG HD2 1 1 19 9842 1 1 28 ARG HD3 H 16.117 5.238 7.456 1.00 . A A . 34 ARG HD3 1 1 19 9843 1 1 28 ARG HE H 18.489 6.623 6.608 1.00 . A A . 34 ARG HE 1 1 19 9844 1 1 28 ARG HG2 H 17.579 5.125 5.192 1.00 . A A . 34 ARG HG2 1 1 19 9845 1 1 28 ARG HG3 H 16.290 6.218 4.683 1.00 . A A . 34 ARG HG3 1 1 19 9846 1 1 28 ARG HH11 H 16.247 6.132 9.237 1.00 . A A . 34 ARG HH11 1 1 19 9847 1 1 28 ARG HH12 H 17.385 6.588 10.459 1.00 . A A . 34 ARG HH12 1 1 19 9848 1 1 28 ARG HH21 H 19.988 7.223 8.213 1.00 . A A . 34 ARG HH21 1 1 19 9849 1 1 28 ARG HH22 H 19.510 7.208 9.878 1.00 . A A . 34 ARG HH22 1 1 19 9850 1 1 28 ARG N N 15.505 2.326 3.697 1.00 . A A . 34 ARG N 1 1 19 9851 1 1 28 ARG NE N 17.792 6.458 7.277 1.00 . A A . 34 ARG NE 1 1 19 9852 1 1 28 ARG NH1 N 17.162 6.440 9.495 1.00 . A A . 34 ARG NH1 1 1 19 9853 1 1 28 ARG NH2 N 19.293 7.061 8.913 1.00 . A A . 34 ARG NH2 1 1 19 9854 1 1 28 ARG O O 17.818 1.826 6.167 1.00 . A A . 34 ARG O 1 1 19 9855 1 1 29 GLY C C 15.763 -0.816 7.183 1.00 . A A . 35 GLY C 1 1 19 9856 1 1 29 GLY CA C 15.798 0.640 7.605 1.00 . A A . 35 GLY CA 1 1 19 9857 1 1 29 GLY H H 14.703 1.770 6.189 1.00 . A A . 35 GLY H 1 1 19 9858 1 1 29 GLY HA2 H 16.753 0.847 8.064 1.00 . A A . 35 GLY HA2 1 1 19 9859 1 1 29 GLY HA3 H 15.016 0.812 8.329 1.00 . A A . 35 GLY HA3 1 1 19 9860 1 1 29 GLY N N 15.609 1.543 6.486 1.00 . A A . 35 GLY N 1 1 19 9861 1 1 29 GLY O O 16.406 -1.202 6.206 1.00 . A A . 35 GLY O 1 1 19 9862 1 1 30 ARG C C 16.252 -3.733 7.697 1.00 . A A . 36 ARG C 1 1 19 9863 1 1 30 ARG CA C 14.893 -3.047 7.616 1.00 . A A . 36 ARG CA 1 1 19 9864 1 1 30 ARG CB C 14.289 -3.246 6.224 1.00 . A A . 36 ARG CB 1 1 19 9865 1 1 30 ARG CD C 13.215 -4.848 4.612 1.00 . A A . 36 ARG CD 1 1 19 9866 1 1 30 ARG CG C 13.550 -4.565 6.067 1.00 . A A . 36 ARG CG 1 1 19 9867 1 1 30 ARG CZ C 14.285 -7.021 4.160 1.00 . A A . 36 ARG CZ 1 1 19 9868 1 1 30 ARG H H 14.521 -1.258 8.685 1.00 . A A . 36 ARG H 1 1 19 9869 1 1 30 ARG HA H 14.236 -3.489 8.350 1.00 . A A . 36 ARG HA 1 1 19 9870 1 1 30 ARG HB2 H 13.595 -2.443 6.026 1.00 . A A . 36 ARG HB2 1 1 19 9871 1 1 30 ARG HB3 H 15.082 -3.213 5.491 1.00 . A A . 36 ARG HB3 1 1 19 9872 1 1 30 ARG HD2 H 12.243 -4.431 4.392 1.00 . A A . 36 ARG HD2 1 1 19 9873 1 1 30 ARG HD3 H 13.958 -4.376 3.986 1.00 . A A . 36 ARG HD3 1 1 19 9874 1 1 30 ARG HE H 12.315 -6.712 4.250 1.00 . A A . 36 ARG HE 1 1 19 9875 1 1 30 ARG HG2 H 14.172 -5.363 6.443 1.00 . A A . 36 ARG HG2 1 1 19 9876 1 1 30 ARG HG3 H 12.633 -4.522 6.637 1.00 . A A . 36 ARG HG3 1 1 19 9877 1 1 30 ARG HH11 H 15.579 -5.493 4.447 1.00 . A A . 36 ARG HH11 1 1 19 9878 1 1 30 ARG HH12 H 16.306 -7.032 4.129 1.00 . A A . 36 ARG HH12 1 1 19 9879 1 1 30 ARG HH21 H 13.269 -8.737 3.833 1.00 . A A . 36 ARG HH21 1 1 19 9880 1 1 30 ARG HH22 H 14.995 -8.874 3.780 1.00 . A A . 36 ARG HH22 1 1 19 9881 1 1 30 ARG N N 15.010 -1.625 7.919 1.00 . A A . 36 ARG N 1 1 19 9882 1 1 30 ARG NE N 13.191 -6.280 4.324 1.00 . A A . 36 ARG NE 1 1 19 9883 1 1 30 ARG NH1 N 15.489 -6.470 4.253 1.00 . A A . 36 ARG NH1 1 1 19 9884 1 1 30 ARG NH2 N 14.174 -8.317 3.903 1.00 . A A . 36 ARG NH2 1 1 19 9885 1 1 30 ARG O O 17.293 -3.092 7.556 1.00 . A A . 36 ARG O 1 1 19 9886 1 1 31 GLY C C 18.004 -5.855 9.441 1.00 . A A . 37 GLY C 1 1 19 9887 1 1 31 GLY CA C 17.472 -5.793 8.023 1.00 . A A . 37 GLY CA 1 1 19 9888 1 1 31 GLY H H 15.375 -5.501 8.031 1.00 . A A . 37 GLY H 1 1 19 9889 1 1 31 GLY HA2 H 17.297 -6.800 7.671 1.00 . A A . 37 GLY HA2 1 1 19 9890 1 1 31 GLY HA3 H 18.214 -5.327 7.392 1.00 . A A . 37 GLY HA3 1 1 19 9891 1 1 31 GLY N N 16.235 -5.042 7.926 1.00 . A A . 37 GLY N 1 1 19 9892 1 1 31 GLY O O 18.321 -6.969 9.908 1.00 . A A . 37 GLY O 1 1 19 9893 1 1 31 GLY OXT O 18.104 -4.789 10.084 1.00 . A A . 37 GLY OXT 1 1 19 9894 2 2 1 . C02 C 7.216 -2.842 -2.591 1.00 . B A . 1038 D6M C02 1 1 19 9895 2 2 1 . C04 C 6.181 -1.274 -4.136 1.00 . B A . 1038 D6M C04 1 1 19 9896 2 2 1 . C05 C 5.885 0.229 -4.157 1.00 . B A . 1038 D6M C05 1 1 19 9897 2 2 1 . C06 C 7.061 1.093 -4.585 1.00 . B A . 1038 D6M C06 1 1 19 9898 2 2 1 . C07 C 6.617 2.313 -5.369 1.00 . B A . 1038 D6M C07 1 1 19 9899 2 2 1 . C09 C 6.718 -1.725 -5.491 1.00 . B A . 1038 D6M C09 1 1 19 9900 2 2 1 . C12 C 8.013 -3.144 -1.335 1.00 . B A . 1038 D6M C12 1 1 19 9901 2 2 1 . C13 C 7.118 -3.390 -0.127 1.00 . B A . 1038 D6M C13 1 1 19 9902 2 2 1 . C14 C 7.640 -2.680 1.118 1.00 . B A . 1038 D6M C14 1 1 19 9903 2 2 1 . C15 C 8.644 -3.535 1.878 1.00 . B A . 1038 D6M C15 1 1 19 9904 2 2 1 . C16 C 8.048 -4.867 2.312 1.00 . B A . 1038 D6M C16 1 1 19 9905 2 2 1 . C17 C 8.959 -6.033 1.950 1.00 . B A . 1038 D6M C17 1 1 19 9906 2 2 1 . C18 C 9.320 -6.033 0.469 1.00 . B A . 1038 D6M C18 1 1 19 9907 2 2 1 . C19 C 10.813 -5.831 0.254 1.00 . B A . 1038 D6M C19 1 1 19 9908 2 2 1 . C20 C 11.097 -4.718 -0.747 1.00 . B A . 1038 D6M C20 1 1 19 9909 2 2 1 . C21 C 10.864 -5.176 -2.177 1.00 . B A . 1038 D6M C21 1 1 19 9910 2 2 1 . C22 C 11.299 -4.115 -3.175 1.00 . B A . 1038 D6M C22 1 1 19 9911 2 2 1 . C23 C 12.809 -3.919 -3.163 1.00 . B A . 1038 D6M C23 1 1 19 9912 2 2 1 . C24 C 13.182 -2.468 -2.896 1.00 . B A . 1038 D6M C24 1 1 19 9913 2 2 1 . C25 C 14.685 -2.249 -2.987 1.00 . B A . 1038 D6M C25 1 1 19 9914 2 2 1 . C26 C 15.272 -1.832 -1.655 1.00 . B A . 1038 D6M C26 1 1 19 9915 2 2 1 . H03 H 7.760 -0.924 -2.772 1.00 . B A . 1038 D6M H03 1 1 19 9916 2 2 1 . H04 H 5.262 -1.804 -3.933 1.00 . B A . 1038 D6M H04 1 1 19 9917 2 2 1 . HP21 H 8.658 -2.304 -1.125 1.00 . B A . 1038 D6M HP21 1 1 19 9918 2 2 1 . HP22 H 8.613 -4.024 -1.511 1.00 . B A . 1038 D6M HP22 1 1 19 9919 2 2 1 . HP31 H 7.072 -4.450 0.064 1.00 . B A . 1038 D6M HP31 1 1 19 9920 2 2 1 . HP32 H 6.128 -3.021 -0.347 1.00 . B A . 1038 D6M HP32 1 1 19 9921 2 2 1 . HP41 H 6.806 -2.452 1.770 1.00 . B A . 1038 D6M HP41 1 1 19 9922 2 2 1 . HP42 H 8.122 -1.762 0.820 1.00 . B A . 1038 D6M HP42 1 1 19 9923 2 2 1 . HP51 H 8.968 -2.994 2.755 1.00 . B A . 1038 D6M HP51 1 1 19 9924 2 2 1 . HP52 H 9.493 -3.725 1.240 1.00 . B A . 1038 D6M HP52 1 1 19 9925 2 2 1 . HP61 H 7.094 -5.001 1.826 1.00 . B A . 1038 D6M HP61 1 1 19 9926 2 2 1 . HP62 H 7.908 -4.853 3.383 1.00 . B A . 1038 D6M HP62 1 1 19 9927 2 2 1 . HP71 H 8.453 -6.957 2.188 1.00 . B A . 1038 D6M HP71 1 1 19 9928 2 2 1 . HP72 H 9.866 -5.959 2.531 1.00 . B A . 1038 D6M HP72 1 1 19 9929 2 2 1 . HP81 H 8.785 -5.235 -0.021 1.00 . B A . 1038 D6M HP81 1 1 19 9930 2 2 1 . HP82 H 9.030 -6.979 0.038 1.00 . B A . 1038 D6M HP82 1 1 19 9931 2 2 1 . HP91 H 11.239 -6.752 -0.117 1.00 . B A . 1038 D6M HP91 1 1 19 9932 2 2 1 . HP92 H 11.273 -5.576 1.197 1.00 . B A . 1038 D6M HP92 1 1 19 9933 2 2 1 . HPA1 H 12.127 -4.412 -0.643 1.00 . B A . 1038 D6M HPA1 1 1 19 9934 2 2 1 . HPA2 H 10.447 -3.878 -0.538 1.00 . B A . 1038 D6M HPA2 1 1 19 9935 2 2 1 . HPB1 H 9.812 -5.378 -2.314 1.00 . B A . 1038 D6M HPB1 1 1 19 9936 2 2 1 . HPB2 H 11.432 -6.077 -2.353 1.00 . B A . 1038 D6M HPB2 1 1 19 9937 2 2 1 . HPC1 H 10.821 -3.180 -2.921 1.00 . B A . 1038 D6M HPC1 1 1 19 9938 2 2 1 . HPC2 H 10.995 -4.419 -4.165 1.00 . B A . 1038 D6M HPC2 1 1 19 9939 2 2 1 . HPD1 H 13.208 -4.214 -4.123 1.00 . B A . 1038 D6M HPD1 1 1 19 9940 2 2 1 . HPD2 H 13.238 -4.538 -2.388 1.00 . B A . 1038 D6M HPD2 1 1 19 9941 2 2 1 . HPE1 H 12.846 -2.196 -1.906 1.00 . B A . 1038 D6M HPE1 1 1 19 9942 2 2 1 . HPE2 H 12.693 -1.842 -3.628 1.00 . B A . 1038 D6M HPE2 1 1 19 9943 2 2 1 . HPF1 H 14.886 -1.472 -3.710 1.00 . B A . 1038 D6M HPF1 1 1 19 9944 2 2 1 . HPF2 H 15.161 -3.167 -3.297 1.00 . B A . 1038 D6M HPF2 1 1 19 9945 2 2 1 . HPG1 H 14.559 -2.030 -0.869 1.00 . B A . 1038 D6M HPG1 1 1 19 9946 2 2 1 . HPG2 H 15.500 -0.776 -1.677 1.00 . B A . 1038 D6M HPG2 1 1 19 9947 2 2 1 . HPG3 H 16.177 -2.391 -1.470 1.00 . B A . 1038 D6M HPG3 1 1 19 9948 2 2 1 . HQ21 H 7.589 1.423 -3.703 1.00 . B A . 1038 D6M HQ21 1 1 19 9949 2 2 1 . HQ22 H 7.722 0.505 -5.203 1.00 . B A . 1038 D6M HQ22 1 1 19 9950 2 2 1 . HQ31 H 5.070 0.411 -4.841 1.00 . B A . 1038 D6M HQ31 1 1 19 9951 2 2 1 . HQ32 H 5.586 0.539 -3.169 1.00 . B A . 1038 D6M HQ32 1 1 19 9952 2 2 1 . N03 N 7.116 -1.602 -3.066 1.00 . B A . 1038 D6M N03 1 1 19 9953 2 2 1 . O01 O 6.518 -3.741 -3.060 1.00 . B A . 1038 D6M O01 1 1 19 9954 2 2 1 . O08 O 6.013 2.136 -6.427 1.00 . B A . 1038 D6M O08 1 1 19 9955 2 2 1 . O10 O 5.900 -2.105 -6.355 1.00 . B A . 1038 D6M O10 1 1 19 9956 2 2 1 . O11 O 7.953 -1.694 -5.677 1.00 . B A . 1038 D6M O11 1 1 20 9957 1 1 1 HIS C C -27.276 -4.392 3.365 1.00 . A A . 7 HIS C 1 1 20 9958 1 1 1 HIS CA C -28.204 -4.616 4.554 1.00 . A A . 7 HIS CA 1 1 20 9959 1 1 1 HIS CB C -27.884 -5.951 5.229 1.00 . A A . 7 HIS CB 1 1 20 9960 1 1 1 HIS CD2 C -25.872 -6.712 6.679 1.00 . A A . 7 HIS CD2 1 1 20 9961 1 1 1 HIS CE1 C -25.716 -4.942 7.964 1.00 . A A . 7 HIS CE1 1 1 20 9962 1 1 1 HIS CG C -26.842 -5.846 6.299 1.00 . A A . 7 HIS CG 1 1 20 9963 1 1 1 HIS H1 H -29.764 -5.449 3.504 1.00 . A A . 7 HIS H1 1 1 20 9964 1 1 1 HIS H2 H -30.213 -4.710 4.986 1.00 . A A . 7 HIS H2 1 1 20 9965 1 1 1 HIS H3 H -29.818 -3.739 3.630 1.00 . A A . 7 HIS H3 1 1 20 9966 1 1 1 HIS HA H -28.064 -3.816 5.265 1.00 . A A . 7 HIS HA 1 1 20 9967 1 1 1 HIS HB2 H -28.783 -6.343 5.680 1.00 . A A . 7 HIS HB2 1 1 20 9968 1 1 1 HIS HB3 H -27.528 -6.647 4.483 1.00 . A A . 7 HIS HB3 1 1 20 9969 1 1 1 HIS HD1 H -27.277 -3.945 7.095 1.00 . A A . 7 HIS HD1 1 1 20 9970 1 1 1 HIS HD2 H -25.675 -7.684 6.248 1.00 . A A . 7 HIS HD2 1 1 20 9971 1 1 1 HIS HE1 H -25.387 -4.251 8.725 1.00 . A A . 7 HIS HE1 1 1 20 9972 1 1 1 HIS HE2 H -24.377 -6.483 8.136 1.00 . A A . 7 HIS HE2 1 1 20 9973 1 1 1 HIS N N -29.628 -4.630 4.130 1.00 . A A . 7 HIS N 1 1 20 9974 1 1 1 HIS ND1 N -26.717 -4.748 7.123 1.00 . A A . 7 HIS ND1 1 1 20 9975 1 1 1 HIS NE2 N -25.188 -6.127 7.715 1.00 . A A . 7 HIS NE2 1 1 20 9976 1 1 1 HIS O O -27.665 -4.596 2.215 1.00 . A A . 7 HIS O 1 1 20 9977 1 1 2 ALA C C -23.716 -4.338 2.962 1.00 . A A . 8 ALA C 1 1 20 9978 1 1 2 ALA CA C -25.065 -3.722 2.605 1.00 . A A . 8 ALA CA 1 1 20 9979 1 1 2 ALA CB C -24.918 -2.227 2.366 1.00 . A A . 8 ALA CB 1 1 20 9980 1 1 2 ALA H H -25.798 -3.829 4.587 1.00 . A A . 8 ALA H 1 1 20 9981 1 1 2 ALA HA H -25.425 -4.175 1.692 1.00 . A A . 8 ALA HA 1 1 20 9982 1 1 2 ALA HB1 H -24.586 -1.748 3.275 1.00 . A A . 8 ALA HB1 1 1 20 9983 1 1 2 ALA HB2 H -24.194 -2.056 1.584 1.00 . A A . 8 ALA HB2 1 1 20 9984 1 1 2 ALA HB3 H -25.872 -1.814 2.070 1.00 . A A . 8 ALA HB3 1 1 20 9985 1 1 2 ALA N N -26.048 -3.973 3.650 1.00 . A A . 8 ALA N 1 1 20 9986 1 1 2 ALA O O -23.270 -4.256 4.106 1.00 . A A . 8 ALA O 1 1 20 9987 1 1 3 GLU C C -20.648 -4.562 2.027 1.00 . A A . 9 GLU C 1 1 20 9988 1 1 3 GLU CA C -21.772 -5.579 2.188 1.00 . A A . 9 GLU CA 1 1 20 9989 1 1 3 GLU CB C -21.576 -6.738 1.209 1.00 . A A . 9 GLU CB 1 1 20 9990 1 1 3 GLU CD C -22.467 -8.982 0.460 1.00 . A A . 9 GLU CD 1 1 20 9991 1 1 3 GLU CG C -22.792 -7.642 1.091 1.00 . A A . 9 GLU CG 1 1 20 9992 1 1 3 GLU H H -23.478 -4.983 1.085 1.00 . A A . 9 GLU H 1 1 20 9993 1 1 3 GLU HA H -21.751 -5.965 3.197 1.00 . A A . 9 GLU HA 1 1 20 9994 1 1 3 GLU HB2 H -21.358 -6.335 0.231 1.00 . A A . 9 GLU HB2 1 1 20 9995 1 1 3 GLU HB3 H -20.739 -7.336 1.538 1.00 . A A . 9 GLU HB3 1 1 20 9996 1 1 3 GLU HG2 H -23.192 -7.816 2.079 1.00 . A A . 9 GLU HG2 1 1 20 9997 1 1 3 GLU HG3 H -23.536 -7.146 0.485 1.00 . A A . 9 GLU HG3 1 1 20 9998 1 1 3 GLU N N -23.071 -4.952 1.976 1.00 . A A . 9 GLU N 1 1 20 9999 1 1 3 GLU O O -20.894 -3.394 1.723 1.00 . A A . 9 GLU O 1 1 20 10000 1 1 3 GLU OE1 O -21.496 -9.628 0.906 1.00 . A A . 9 GLU OE1 1 1 20 10001 1 1 3 GLU OE2 O -23.184 -9.385 -0.480 1.00 . A A . 9 GLU OE2 1 1 20 10002 1 1 4 GLY C C -18.011 -3.717 0.669 1.00 . A A . 10 GLY C 1 1 20 10003 1 1 4 GLY CA C -18.273 -4.122 2.106 1.00 . A A . 10 GLY CA 1 1 20 10004 1 1 4 GLY H H -19.277 -5.950 2.474 1.00 . A A . 10 GLY H 1 1 20 10005 1 1 4 GLY HA2 H -18.455 -3.233 2.692 1.00 . A A . 10 GLY HA2 1 1 20 10006 1 1 4 GLY HA3 H -17.397 -4.622 2.493 1.00 . A A . 10 GLY HA3 1 1 20 10007 1 1 4 GLY N N -19.414 -5.010 2.233 1.00 . A A . 10 GLY N 1 1 20 10008 1 1 4 GLY O O -17.699 -4.558 -0.173 1.00 . A A . 10 GLY O 1 1 20 10009 1 1 5 THR C C -16.441 -1.590 -1.179 1.00 . A A . 11 THR C 1 1 20 10010 1 1 5 THR CA C -17.916 -1.909 -0.956 1.00 . A A . 11 THR CA 1 1 20 10011 1 1 5 THR CB C -18.766 -0.659 -1.193 1.00 . A A . 11 THR CB 1 1 20 10012 1 1 5 THR CG2 C -19.509 -0.683 -2.511 1.00 . A A . 11 THR CG2 1 1 20 10013 1 1 5 THR H H -18.391 -1.803 1.104 1.00 . A A . 11 THR H 1 1 20 10014 1 1 5 THR HA H -18.215 -2.675 -1.656 1.00 . A A . 11 THR HA 1 1 20 10015 1 1 5 THR HB H -18.121 0.208 -1.193 1.00 . A A . 11 THR HB 1 1 20 10016 1 1 5 THR HG1 H -20.258 -1.296 -0.095 1.00 . A A . 11 THR HG1 1 1 20 10017 1 1 5 THR HG21 H -19.850 -1.688 -2.713 1.00 . A A . 11 THR HG21 1 1 20 10018 1 1 5 THR HG22 H -20.358 -0.019 -2.457 1.00 . A A . 11 THR HG22 1 1 20 10019 1 1 5 THR HG23 H -18.848 -0.361 -3.302 1.00 . A A . 11 THR HG23 1 1 20 10020 1 1 5 THR N N -18.139 -2.425 0.389 1.00 . A A . 11 THR N 1 1 20 10021 1 1 5 THR O O -15.591 -1.925 -0.354 1.00 . A A . 11 THR O 1 1 20 10022 1 1 5 THR OG1 O -19.726 -0.500 -0.163 1.00 . A A . 11 THR OG1 1 1 20 10023 1 1 6 PHE C C -14.719 0.366 -3.829 1.00 . A A . 12 PHE C 1 1 20 10024 1 1 6 PHE CA C -14.772 -0.575 -2.629 1.00 . A A . 12 PHE CA 1 1 20 10025 1 1 6 PHE CB C -13.943 -1.829 -2.912 1.00 . A A . 12 PHE CB 1 1 20 10026 1 1 6 PHE CD1 C -15.492 -3.565 -3.850 1.00 . A A . 12 PHE CD1 1 1 20 10027 1 1 6 PHE CD2 C -13.938 -2.517 -5.324 1.00 . A A . 12 PHE CD2 1 1 20 10028 1 1 6 PHE CE1 C -15.977 -4.326 -4.897 1.00 . A A . 12 PHE CE1 1 1 20 10029 1 1 6 PHE CE2 C -14.419 -3.275 -6.375 1.00 . A A . 12 PHE CE2 1 1 20 10030 1 1 6 PHE CG C -14.469 -2.653 -4.052 1.00 . A A . 12 PHE CG 1 1 20 10031 1 1 6 PHE CZ C -15.439 -4.181 -6.161 1.00 . A A . 12 PHE CZ 1 1 20 10032 1 1 6 PHE H H -16.866 -0.699 -2.916 1.00 . A A . 12 PHE H 1 1 20 10033 1 1 6 PHE HA H -14.351 -0.066 -1.775 1.00 . A A . 12 PHE HA 1 1 20 10034 1 1 6 PHE HB2 H -12.932 -1.537 -3.154 1.00 . A A . 12 PHE HB2 1 1 20 10035 1 1 6 PHE HB3 H -13.932 -2.451 -2.029 1.00 . A A . 12 PHE HB3 1 1 20 10036 1 1 6 PHE HD1 H -15.914 -3.679 -2.862 1.00 . A A . 12 PHE HD1 1 1 20 10037 1 1 6 PHE HD2 H -13.140 -1.809 -5.493 1.00 . A A . 12 PHE HD2 1 1 20 10038 1 1 6 PHE HE1 H -16.775 -5.034 -4.727 1.00 . A A . 12 PHE HE1 1 1 20 10039 1 1 6 PHE HE2 H -13.997 -3.160 -7.362 1.00 . A A . 12 PHE HE2 1 1 20 10040 1 1 6 PHE HZ H -15.816 -4.775 -6.980 1.00 . A A . 12 PHE HZ 1 1 20 10041 1 1 6 PHE N N -16.145 -0.939 -2.299 1.00 . A A . 12 PHE N 1 1 20 10042 1 1 6 PHE O O -13.882 1.265 -3.879 1.00 . A A . 12 PHE O 1 1 20 10043 1 1 7 THR C C -15.338 2.439 -5.717 1.00 . A A . 13 THR C 1 1 20 10044 1 1 7 THR CA C -15.669 0.974 -6.007 1.00 . A A . 13 THR CA 1 1 20 10045 1 1 7 THR CB C -17.056 0.875 -6.645 1.00 . A A . 13 THR CB 1 1 20 10046 1 1 7 THR CG2 C -18.179 1.214 -5.690 1.00 . A A . 13 THR CG2 1 1 20 10047 1 1 7 THR H H -16.248 -0.588 -4.697 1.00 . A A . 13 THR H 1 1 20 10048 1 1 7 THR HA H -14.940 0.586 -6.702 1.00 . A A . 13 THR HA 1 1 20 10049 1 1 7 THR HB H -17.210 -0.137 -6.992 1.00 . A A . 13 THR HB 1 1 20 10050 1 1 7 THR HG1 H -16.831 1.305 -8.543 1.00 . A A . 13 THR HG1 1 1 20 10051 1 1 7 THR HG21 H -17.792 1.262 -4.682 1.00 . A A . 13 THR HG21 1 1 20 10052 1 1 7 THR HG22 H -18.605 2.169 -5.958 1.00 . A A . 13 THR HG22 1 1 20 10053 1 1 7 THR HG23 H -18.942 0.451 -5.746 1.00 . A A . 13 THR HG23 1 1 20 10054 1 1 7 THR N N -15.612 0.150 -4.796 1.00 . A A . 13 THR N 1 1 20 10055 1 1 7 THR O O -14.706 3.113 -6.531 1.00 . A A . 13 THR O 1 1 20 10056 1 1 7 THR OG1 O -17.160 1.747 -7.757 1.00 . A A . 13 THR OG1 1 1 20 10057 1 1 8 SER C C -14.193 4.417 -3.394 1.00 . A A . 14 SER C 1 1 20 10058 1 1 8 SER CA C -15.508 4.303 -4.161 1.00 . A A . 14 SER CA 1 1 20 10059 1 1 8 SER CB C -16.659 4.833 -3.303 1.00 . A A . 14 SER CB 1 1 20 10060 1 1 8 SER H H -16.261 2.335 -3.947 1.00 . A A . 14 SER H 1 1 20 10061 1 1 8 SER HA H -15.438 4.897 -5.060 1.00 . A A . 14 SER HA 1 1 20 10062 1 1 8 SER HB2 H -16.525 4.506 -2.283 1.00 . A A . 14 SER HB2 1 1 20 10063 1 1 8 SER HB3 H -16.664 5.912 -3.338 1.00 . A A . 14 SER HB3 1 1 20 10064 1 1 8 SER HG H -17.968 4.499 -4.721 1.00 . A A . 14 SER HG 1 1 20 10065 1 1 8 SER N N -15.764 2.922 -4.555 1.00 . A A . 14 SER N 1 1 20 10066 1 1 8 SER O O -13.399 5.327 -3.632 1.00 . A A . 14 SER O 1 1 20 10067 1 1 8 SER OG O -17.907 4.355 -3.774 1.00 . A A . 14 SER OG 1 1 20 10068 1 1 9 ASP C C -11.523 3.180 -2.511 1.00 . A A . 15 ASP C 1 1 20 10069 1 1 9 ASP CA C -12.758 3.475 -1.661 1.00 . A A . 15 ASP CA 1 1 20 10070 1 1 9 ASP CB C -12.879 2.438 -0.543 1.00 . A A . 15 ASP CB 1 1 20 10071 1 1 9 ASP CG C -14.030 2.733 0.398 1.00 . A A . 15 ASP CG 1 1 20 10072 1 1 9 ASP H H -14.647 2.789 -2.328 1.00 . A A . 15 ASP H 1 1 20 10073 1 1 9 ASP HA H -12.649 4.453 -1.219 1.00 . A A . 15 ASP HA 1 1 20 10074 1 1 9 ASP HB2 H -13.037 1.463 -0.980 1.00 . A A . 15 ASP HB2 1 1 20 10075 1 1 9 ASP HB3 H -11.963 2.427 0.029 1.00 . A A . 15 ASP HB3 1 1 20 10076 1 1 9 ASP N N -13.973 3.486 -2.471 1.00 . A A . 15 ASP N 1 1 20 10077 1 1 9 ASP O O -10.399 3.468 -2.104 1.00 . A A . 15 ASP O 1 1 20 10078 1 1 9 ASP OD1 O -15.022 3.346 -0.050 1.00 . A A . 15 ASP OD1 1 1 20 10079 1 1 9 ASP OD2 O -13.941 2.350 1.584 1.00 . A A . 15 ASP OD2 1 1 20 10080 1 1 10 VAL C C -9.627 3.393 -4.725 1.00 . A A . 16 VAL C 1 1 20 10081 1 1 10 VAL CA C -10.640 2.255 -4.594 1.00 . A A . 16 VAL CA 1 1 20 10082 1 1 10 VAL CB C -11.168 1.883 -5.994 1.00 . A A . 16 VAL CB 1 1 20 10083 1 1 10 VAL CG1 C -10.020 1.543 -6.934 1.00 . A A . 16 VAL CG1 1 1 20 10084 1 1 10 VAL CG2 C -12.148 0.723 -5.899 1.00 . A A . 16 VAL CG2 1 1 20 10085 1 1 10 VAL H H -12.654 2.387 -3.957 1.00 . A A . 16 VAL H 1 1 20 10086 1 1 10 VAL HA H -10.137 1.392 -4.188 1.00 . A A . 16 VAL HA 1 1 20 10087 1 1 10 VAL HB H -11.694 2.736 -6.396 1.00 . A A . 16 VAL HB 1 1 20 10088 1 1 10 VAL HG11 H -9.256 1.008 -6.389 1.00 . A A . 16 VAL HG11 1 1 20 10089 1 1 10 VAL HG12 H -10.385 0.926 -7.741 1.00 . A A . 16 VAL HG12 1 1 20 10090 1 1 10 VAL HG13 H -9.603 2.454 -7.337 1.00 . A A . 16 VAL HG13 1 1 20 10091 1 1 10 VAL HG21 H -12.031 0.230 -4.944 1.00 . A A . 16 VAL HG21 1 1 20 10092 1 1 10 VAL HG22 H -13.157 1.096 -5.989 1.00 . A A . 16 VAL HG22 1 1 20 10093 1 1 10 VAL HG23 H -11.953 0.018 -6.694 1.00 . A A . 16 VAL HG23 1 1 20 10094 1 1 10 VAL N N -11.736 2.598 -3.690 1.00 . A A . 16 VAL N 1 1 20 10095 1 1 10 VAL O O -8.457 3.160 -5.028 1.00 . A A . 16 VAL O 1 1 20 10096 1 1 11 SER C C -8.521 6.069 -3.257 1.00 . A A . 17 SER C 1 1 20 10097 1 1 11 SER CA C -9.196 5.779 -4.596 1.00 . A A . 17 SER CA 1 1 20 10098 1 1 11 SER CB C -9.984 7.005 -5.058 1.00 . A A . 17 SER CB 1 1 20 10099 1 1 11 SER H H -11.018 4.754 -4.264 1.00 . A A . 17 SER H 1 1 20 10100 1 1 11 SER HA H -8.435 5.555 -5.328 1.00 . A A . 17 SER HA 1 1 20 10101 1 1 11 SER HB2 H -9.312 7.844 -5.166 1.00 . A A . 17 SER HB2 1 1 20 10102 1 1 11 SER HB3 H -10.450 6.793 -6.010 1.00 . A A . 17 SER HB3 1 1 20 10103 1 1 11 SER HG H -11.301 8.239 -4.295 1.00 . A A . 17 SER HG 1 1 20 10104 1 1 11 SER N N -10.076 4.621 -4.498 1.00 . A A . 17 SER N 1 1 20 10105 1 1 11 SER O O -7.398 6.567 -3.212 1.00 . A A . 17 SER O 1 1 20 10106 1 1 11 SER OG O -10.992 7.347 -4.122 1.00 . A A . 17 SER OG 1 1 20 10107 1 1 12 SER C C -7.937 4.803 -0.273 1.00 . A A . 18 SER C 1 1 20 10108 1 1 12 SER CA C -8.696 6.010 -0.829 1.00 . A A . 18 SER CA 1 1 20 10109 1 1 12 SER CB C -9.835 6.384 0.120 1.00 . A A . 18 SER CB 1 1 20 10110 1 1 12 SER H H -10.117 5.385 -2.269 1.00 . A A . 18 SER H 1 1 20 10111 1 1 12 SER HA H -8.013 6.844 -0.892 1.00 . A A . 18 SER HA 1 1 20 10112 1 1 12 SER HB2 H -9.461 6.413 1.133 1.00 . A A . 18 SER HB2 1 1 20 10113 1 1 12 SER HB3 H -10.221 7.357 -0.149 1.00 . A A . 18 SER HB3 1 1 20 10114 1 1 12 SER HG H -10.698 4.703 0.635 1.00 . A A . 18 SER HG 1 1 20 10115 1 1 12 SER N N -9.221 5.770 -2.169 1.00 . A A . 18 SER N 1 1 20 10116 1 1 12 SER O O -7.160 4.939 0.671 1.00 . A A . 18 SER O 1 1 20 10117 1 1 12 SER OG O -10.889 5.440 0.050 1.00 . A A . 18 SER OG 1 1 20 10118 1 1 13 TYR C C -6.150 2.197 -0.966 1.00 . A A . 19 TYR C 1 1 20 10119 1 1 13 TYR CA C -7.530 2.405 -0.341 1.00 . A A . 19 TYR CA 1 1 20 10120 1 1 13 TYR CB C -8.420 1.176 -0.591 1.00 . A A . 19 TYR CB 1 1 20 10121 1 1 13 TYR CD1 C -8.005 1.196 -3.087 1.00 . A A . 19 TYR CD1 1 1 20 10122 1 1 13 TYR CD2 C -8.120 -0.911 -1.981 1.00 . A A . 19 TYR CD2 1 1 20 10123 1 1 13 TYR CE1 C -7.780 0.554 -4.292 1.00 . A A . 19 TYR CE1 1 1 20 10124 1 1 13 TYR CE2 C -7.895 -1.559 -3.180 1.00 . A A . 19 TYR CE2 1 1 20 10125 1 1 13 TYR CG C -8.179 0.476 -1.914 1.00 . A A . 19 TYR CG 1 1 20 10126 1 1 13 TYR CZ C -7.725 -0.822 -4.332 1.00 . A A . 19 TYR CZ 1 1 20 10127 1 1 13 TYR H H -8.827 3.555 -1.567 1.00 . A A . 19 TYR H 1 1 20 10128 1 1 13 TYR HA H -7.401 2.522 0.723 1.00 . A A . 19 TYR HA 1 1 20 10129 1 1 13 TYR HB2 H -8.251 0.456 0.194 1.00 . A A . 19 TYR HB2 1 1 20 10130 1 1 13 TYR HB3 H -9.456 1.485 -0.567 1.00 . A A . 19 TYR HB3 1 1 20 10131 1 1 13 TYR HD1 H -8.254 -1.486 -1.077 1.00 . A A . 19 TYR HD1 1 1 20 10132 1 1 13 TYR HD2 H -8.049 2.273 -3.053 1.00 . A A . 19 TYR HD2 1 1 20 10133 1 1 13 TYR HE1 H -7.853 -2.638 -3.211 1.00 . A A . 19 TYR HE1 1 1 20 10134 1 1 13 TYR HE2 H -7.647 1.131 -5.195 1.00 . A A . 19 TYR HE2 1 1 20 10135 1 1 13 TYR HH H -8.216 -1.267 -6.137 1.00 . A A . 19 TYR HH 1 1 20 10136 1 1 13 TYR N N -8.183 3.618 -0.832 1.00 . A A . 19 TYR N 1 1 20 10137 1 1 13 TYR O O -5.316 1.481 -0.412 1.00 . A A . 19 TYR O 1 1 20 10138 1 1 13 TYR OH O -7.500 -1.464 -5.528 1.00 . A A . 19 TYR OH 1 1 20 10139 1 1 14 LEU C C -3.463 2.930 -1.849 1.00 . A A . 20 LEU C 1 1 20 10140 1 1 14 LEU CA C -4.626 2.673 -2.803 1.00 . A A . 20 LEU CA 1 1 20 10141 1 1 14 LEU CB C -4.543 3.624 -3.999 1.00 . A A . 20 LEU CB 1 1 20 10142 1 1 14 LEU CD1 C -4.018 5.937 -3.190 1.00 . A A . 20 LEU CD1 1 1 20 10143 1 1 14 LEU CD2 C -5.661 5.600 -5.048 1.00 . A A . 20 LEU CD2 1 1 20 10144 1 1 14 LEU CG C -5.096 5.028 -3.757 1.00 . A A . 20 LEU CG 1 1 20 10145 1 1 14 LEU H H -6.610 3.367 -2.522 1.00 . A A . 20 LEU H 1 1 20 10146 1 1 14 LEU HA H -4.557 1.657 -3.162 1.00 . A A . 20 LEU HA 1 1 20 10147 1 1 14 LEU HB2 H -3.505 3.714 -4.286 1.00 . A A . 20 LEU HB2 1 1 20 10148 1 1 14 LEU HB3 H -5.088 3.184 -4.820 1.00 . A A . 20 LEU HB3 1 1 20 10149 1 1 14 LEU HD11 H -3.057 5.644 -3.584 1.00 . A A . 20 LEU HD11 1 1 20 10150 1 1 14 LEU HD12 H -4.226 6.960 -3.470 1.00 . A A . 20 LEU HD12 1 1 20 10151 1 1 14 LEU HD13 H -4.008 5.853 -2.113 1.00 . A A . 20 LEU HD13 1 1 20 10152 1 1 14 LEU HD21 H -4.917 5.535 -5.827 1.00 . A A . 20 LEU HD21 1 1 20 10153 1 1 14 LEU HD22 H -6.536 5.036 -5.338 1.00 . A A . 20 LEU HD22 1 1 20 10154 1 1 14 LEU HD23 H -5.934 6.634 -4.895 1.00 . A A . 20 LEU HD23 1 1 20 10155 1 1 14 LEU HG H -5.897 4.975 -3.036 1.00 . A A . 20 LEU HG 1 1 20 10156 1 1 14 LEU N N -5.910 2.814 -2.120 1.00 . A A . 20 LEU N 1 1 20 10157 1 1 14 LEU O O -3.639 3.522 -0.784 1.00 . A A . 20 LEU O 1 1 20 10158 1 1 15 GLU C C -1.227 1.900 -0.092 1.00 . A A . 21 GLU C 1 1 20 10159 1 1 15 GLU CA C -1.083 2.647 -1.415 1.00 . A A . 21 GLU CA 1 1 20 10160 1 1 15 GLU CB C -0.821 4.134 -1.157 1.00 . A A . 21 GLU CB 1 1 20 10161 1 1 15 GLU CD C 1.530 4.320 -2.061 1.00 . A A . 21 GLU CD 1 1 20 10162 1 1 15 GLU CG C 0.091 4.778 -2.188 1.00 . A A . 21 GLU CG 1 1 20 10163 1 1 15 GLU H H -2.201 2.006 -3.094 1.00 . A A . 21 GLU H 1 1 20 10164 1 1 15 GLU HA H -0.246 2.232 -1.958 1.00 . A A . 21 GLU HA 1 1 20 10165 1 1 15 GLU HB2 H -1.764 4.660 -1.163 1.00 . A A . 21 GLU HB2 1 1 20 10166 1 1 15 GLU HB3 H -0.363 4.244 -0.185 1.00 . A A . 21 GLU HB3 1 1 20 10167 1 1 15 GLU HG2 H -0.266 4.524 -3.175 1.00 . A A . 21 GLU HG2 1 1 20 10168 1 1 15 GLU HG3 H 0.057 5.850 -2.059 1.00 . A A . 21 GLU HG3 1 1 20 10169 1 1 15 GLU N N -2.276 2.474 -2.237 1.00 . A A . 21 GLU N 1 1 20 10170 1 1 15 GLU O O -1.051 2.475 0.983 1.00 . A A . 21 GLU O 1 1 20 10171 1 1 15 GLU OE1 O 1.752 3.176 -1.609 1.00 . A A . 21 GLU OE1 1 1 20 10172 1 1 15 GLU OE2 O 2.436 5.103 -2.414 1.00 . A A . 21 GLU OE2 1 1 20 10173 1 1 16 GLY C C -0.473 -0.208 1.886 1.00 . A A . 22 GLY C 1 1 20 10174 1 1 16 GLY CA C -1.714 -0.196 1.015 1.00 . A A . 22 GLY CA 1 1 20 10175 1 1 16 GLY H H -1.677 0.209 -1.063 1.00 . A A . 22 GLY H 1 1 20 10176 1 1 16 GLY HA2 H -2.540 0.195 1.590 1.00 . A A . 22 GLY HA2 1 1 20 10177 1 1 16 GLY HA3 H -1.943 -1.210 0.720 1.00 . A A . 22 GLY HA3 1 1 20 10178 1 1 16 GLY N N -1.549 0.613 -0.180 1.00 . A A . 22 GLY N 1 1 20 10179 1 1 16 GLY O O 0.491 -0.915 1.595 1.00 . A A . 22 GLY O 1 1 20 10180 1 1 17 GLN C C 0.949 -0.703 4.481 1.00 . A A . 23 GLN C 1 1 20 10181 1 1 17 GLN CA C 0.633 0.660 3.873 1.00 . A A . 23 GLN CA 1 1 20 10182 1 1 17 GLN CB C 0.345 1.671 4.983 1.00 . A A . 23 GLN CB 1 1 20 10183 1 1 17 GLN CD C -1.196 2.396 6.848 1.00 . A A . 23 GLN CD 1 1 20 10184 1 1 17 GLN CG C -0.951 1.402 5.730 1.00 . A A . 23 GLN CG 1 1 20 10185 1 1 17 GLN H H -1.296 1.120 3.133 1.00 . A A . 23 GLN H 1 1 20 10186 1 1 17 GLN HA H 1.491 0.996 3.309 1.00 . A A . 23 GLN HA 1 1 20 10187 1 1 17 GLN HB2 H 1.156 1.647 5.695 1.00 . A A . 23 GLN HB2 1 1 20 10188 1 1 17 GLN HB3 H 0.286 2.658 4.549 1.00 . A A . 23 GLN HB3 1 1 20 10189 1 1 17 GLN HE21 H 0.388 1.711 7.836 1.00 . A A . 23 GLN HE21 1 1 20 10190 1 1 17 GLN HE22 H -0.475 2.997 8.601 1.00 . A A . 23 GLN HE22 1 1 20 10191 1 1 17 GLN HG2 H -1.773 1.460 5.032 1.00 . A A . 23 GLN HG2 1 1 20 10192 1 1 17 GLN HG3 H -0.909 0.409 6.153 1.00 . A A . 23 GLN HG3 1 1 20 10193 1 1 17 GLN N N -0.498 0.579 2.956 1.00 . A A . 23 GLN N 1 1 20 10194 1 1 17 GLN NE2 N -0.341 2.364 7.865 1.00 . A A . 23 GLN NE2 1 1 20 10195 1 1 17 GLN O O 2.087 -0.970 4.868 1.00 . A A . 23 GLN O 1 1 20 10196 1 1 17 GLN OE1 O -2.141 3.182 6.800 1.00 . A A . 23 GLN OE1 1 1 20 10197 1 1 18 ALA C C 1.358 -3.579 4.576 1.00 . A A . 24 ALA C 1 1 20 10198 1 1 18 ALA CA C 0.106 -2.901 5.126 1.00 . A A . 24 ALA CA 1 1 20 10199 1 1 18 ALA CB C -1.124 -3.750 4.843 1.00 . A A . 24 ALA CB 1 1 20 10200 1 1 18 ALA H H -0.948 -1.291 4.239 1.00 . A A . 24 ALA H 1 1 20 10201 1 1 18 ALA HA H 0.205 -2.801 6.197 1.00 . A A . 24 ALA HA 1 1 20 10202 1 1 18 ALA HB1 H -1.499 -3.524 3.856 1.00 . A A . 24 ALA HB1 1 1 20 10203 1 1 18 ALA HB2 H -0.860 -4.796 4.897 1.00 . A A . 24 ALA HB2 1 1 20 10204 1 1 18 ALA HB3 H -1.888 -3.534 5.576 1.00 . A A . 24 ALA HB3 1 1 20 10205 1 1 18 ALA N N -0.064 -1.563 4.563 1.00 . A A . 24 ALA N 1 1 20 10206 1 1 18 ALA O O 2.264 -3.938 5.329 1.00 . A A . 24 ALA O 1 1 20 10207 1 1 19 ALA C C 3.589 -3.323 2.222 1.00 . A A . 25 ALA C 1 1 20 10208 1 1 19 ALA CA C 2.549 -4.367 2.607 1.00 . A A . 25 ALA CA 1 1 20 10209 1 1 19 ALA CB C 2.100 -5.148 1.382 1.00 . A A . 25 ALA CB 1 1 20 10210 1 1 19 ALA H H 0.655 -3.430 2.712 1.00 . A A . 25 ALA H 1 1 20 10211 1 1 19 ALA HA H 2.996 -5.061 3.304 1.00 . A A . 25 ALA HA 1 1 20 10212 1 1 19 ALA HB1 H 1.285 -5.803 1.653 1.00 . A A . 25 ALA HB1 1 1 20 10213 1 1 19 ALA HB2 H 1.770 -4.461 0.616 1.00 . A A . 25 ALA HB2 1 1 20 10214 1 1 19 ALA HB3 H 2.925 -5.736 1.007 1.00 . A A . 25 ALA HB3 1 1 20 10215 1 1 19 ALA N N 1.405 -3.743 3.259 1.00 . A A . 25 ALA N 1 1 20 10216 1 1 19 ALA O O 4.781 -3.500 2.467 1.00 . A A . 25 ALA O 1 1 20 10217 1 1 20 LYS C C 4.954 -0.733 2.330 1.00 . A A . 26 LYS C 1 1 20 10218 1 1 20 LYS CA C 4.016 -1.150 1.200 1.00 . A A . 26 LYS CA 1 1 20 10219 1 1 20 LYS CB C 3.203 0.057 0.724 1.00 . A A . 26 LYS CB 1 1 20 10220 1 1 20 LYS CD C 3.286 -0.830 -1.633 1.00 . A A . 26 LYS CD 1 1 20 10221 1 1 20 LYS CE C 3.116 -2.340 -1.663 1.00 . A A . 26 LYS CE 1 1 20 10222 1 1 20 LYS CG C 2.418 -0.198 -0.556 1.00 . A A . 26 LYS CG 1 1 20 10223 1 1 20 LYS HA H 4.610 -1.516 0.377 1.00 . A A . 26 LYS HA 1 1 20 10224 1 1 20 LYS HB2 H 2.503 0.332 1.499 1.00 . A A . 26 LYS HB2 1 1 20 10225 1 1 20 LYS HD2 H 3.002 -0.426 -2.594 1.00 . A A . 26 LYS HD2 1 1 20 10226 1 1 20 LYS HE2 H 3.073 -2.703 -0.648 1.00 . A A . 26 LYS HE2 1 1 20 10227 1 1 20 LYS HG2 H 1.597 -0.863 -0.336 1.00 . A A . 26 LYS HG2 1 1 20 10228 1 1 20 LYS HZ1 H 5.072 -2.533 -2.408 1.00 . A A . 26 LYS HZ1 1 1 20 10229 1 1 20 LYS N N 3.127 -2.229 1.621 1.00 . A A . 26 LYS N 1 1 20 10230 1 1 20 LYS NZ N 4.215 -3.005 -2.356 1.00 . A A . 26 LYS NZ 1 1 20 10231 1 1 20 LYS O O 6.032 -0.196 2.084 1.00 . A A . 26 LYS O 1 1 20 10232 1 1 21 GLU C C 6.806 -1.040 4.547 1.00 . A A . 27 GLU C 1 1 20 10233 1 1 21 GLU CA C 5.344 -0.637 4.738 1.00 . A A . 27 GLU CA 1 1 20 10234 1 1 21 GLU CB C 4.776 -1.309 5.991 1.00 . A A . 27 GLU CB 1 1 20 10235 1 1 21 GLU CD C 4.532 -0.411 8.342 1.00 . A A . 27 GLU CD 1 1 20 10236 1 1 21 GLU CG C 4.035 -0.351 6.911 1.00 . A A . 27 GLU CG 1 1 20 10237 1 1 21 GLU H H 3.669 -1.415 3.705 1.00 . A A . 27 GLU H 1 1 20 10238 1 1 21 GLU HA H 5.295 0.434 4.865 1.00 . A A . 27 GLU HA 1 1 20 10239 1 1 21 GLU HB2 H 4.090 -2.086 5.688 1.00 . A A . 27 GLU HB2 1 1 20 10240 1 1 21 GLU HB3 H 5.587 -1.754 6.548 1.00 . A A . 27 GLU HB3 1 1 20 10241 1 1 21 GLU HG2 H 4.166 0.655 6.543 1.00 . A A . 27 GLU HG2 1 1 20 10242 1 1 21 GLU HG3 H 2.984 -0.603 6.899 1.00 . A A . 27 GLU HG3 1 1 20 10243 1 1 21 GLU N N 4.539 -0.985 3.570 1.00 . A A . 27 GLU N 1 1 20 10244 1 1 21 GLU O O 7.708 -0.416 5.106 1.00 . A A . 27 GLU O 1 1 20 10245 1 1 21 GLU OE1 O 5.750 -0.237 8.556 1.00 . A A . 27 GLU OE1 1 1 20 10246 1 1 21 GLU OE2 O 3.702 -0.630 9.250 1.00 . A A . 27 GLU OE2 1 1 20 10247 1 1 22 PHE C C 9.197 -1.505 2.742 1.00 . A A . 28 PHE C 1 1 20 10248 1 1 22 PHE CA C 8.390 -2.559 3.499 1.00 . A A . 28 PHE CA 1 1 20 10249 1 1 22 PHE CB C 8.355 -3.884 2.717 1.00 . A A . 28 PHE CB 1 1 20 10250 1 1 22 PHE CD1 C 9.188 -3.217 0.440 1.00 . A A . 28 PHE CD1 1 1 20 10251 1 1 22 PHE CD2 C 6.982 -4.098 0.623 1.00 . A A . 28 PHE CD2 1 1 20 10252 1 1 22 PHE CE1 C 9.023 -3.075 -0.923 1.00 . A A . 28 PHE CE1 1 1 20 10253 1 1 22 PHE CE2 C 6.810 -3.959 -0.741 1.00 . A A . 28 PHE CE2 1 1 20 10254 1 1 22 PHE CG C 8.170 -3.729 1.229 1.00 . A A . 28 PHE CG 1 1 20 10255 1 1 22 PHE CZ C 7.832 -3.445 -1.515 1.00 . A A . 28 PHE CZ 1 1 20 10256 1 1 22 PHE H H 6.279 -2.545 3.337 1.00 . A A . 28 PHE H 1 1 20 10257 1 1 22 PHE HA H 8.862 -2.732 4.455 1.00 . A A . 28 PHE HA 1 1 20 10258 1 1 22 PHE HB2 H 9.283 -4.411 2.878 1.00 . A A . 28 PHE HB2 1 1 20 10259 1 1 22 PHE HB3 H 7.538 -4.488 3.090 1.00 . A A . 28 PHE HB3 1 1 20 10260 1 1 22 PHE HD1 H 10.119 -2.926 0.902 1.00 . A A . 28 PHE HD1 1 1 20 10261 1 1 22 PHE HD2 H 6.183 -4.502 1.225 1.00 . A A . 28 PHE HD2 1 1 20 10262 1 1 22 PHE HE1 H 9.826 -2.675 -1.526 1.00 . A A . 28 PHE HE1 1 1 20 10263 1 1 22 PHE HE2 H 5.878 -4.249 -1.199 1.00 . A A . 28 PHE HE2 1 1 20 10264 1 1 22 PHE HZ H 7.701 -3.334 -2.581 1.00 . A A . 28 PHE HZ 1 1 20 10265 1 1 22 PHE N N 7.035 -2.085 3.756 1.00 . A A . 28 PHE N 1 1 20 10266 1 1 22 PHE O O 10.381 -1.302 3.010 1.00 . A A . 28 PHE O 1 1 20 10267 1 1 23 ILE C C 9.822 1.269 1.866 1.00 . A A . 29 ILE C 1 1 20 10268 1 1 23 ILE CA C 9.190 0.190 0.987 1.00 . A A . 29 ILE CA 1 1 20 10269 1 1 23 ILE CB C 8.186 0.838 0.004 1.00 . A A . 29 ILE CB 1 1 20 10270 1 1 23 ILE CD1 C 8.021 2.142 -2.172 1.00 . A A . 29 ILE CD1 1 1 20 10271 1 1 23 ILE CG1 C 8.934 1.542 -1.126 1.00 . A A . 29 ILE CG1 1 1 20 10272 1 1 23 ILE CG2 C 7.255 1.809 0.720 1.00 . A A . 29 ILE CG2 1 1 20 10273 1 1 23 ILE H H 7.601 -1.052 1.626 1.00 . A A . 29 ILE H 1 1 20 10274 1 1 23 ILE HA H 9.971 -0.281 0.402 1.00 . A A . 29 ILE HA 1 1 20 10275 1 1 23 ILE HB H 7.580 0.051 -0.418 1.00 . A A . 29 ILE HB 1 1 20 10276 1 1 23 ILE HD11 H 7.099 2.458 -1.707 1.00 . A A . 29 ILE HD11 1 1 20 10277 1 1 23 ILE HD12 H 8.505 2.994 -2.627 1.00 . A A . 29 ILE HD12 1 1 20 10278 1 1 23 ILE HD13 H 7.807 1.402 -2.930 1.00 . A A . 29 ILE HD13 1 1 20 10279 1 1 23 ILE HG12 H 9.534 2.339 -0.712 1.00 . A A . 29 ILE HG12 1 1 20 10280 1 1 23 ILE HG13 H 9.581 0.829 -1.617 1.00 . A A . 29 ILE HG13 1 1 20 10281 1 1 23 ILE HG21 H 7.261 1.601 1.779 1.00 . A A . 29 ILE HG21 1 1 20 10282 1 1 23 ILE HG22 H 7.591 2.821 0.550 1.00 . A A . 29 ILE HG22 1 1 20 10283 1 1 23 ILE HG23 H 6.252 1.693 0.336 1.00 . A A . 29 ILE HG23 1 1 20 10284 1 1 23 ILE N N 8.544 -0.841 1.792 1.00 . A A . 29 ILE N 1 1 20 10285 1 1 23 ILE O O 10.836 1.860 1.504 1.00 . A A . 29 ILE O 1 1 20 10286 1 1 24 ALA C C 11.138 2.202 4.410 1.00 . A A . 30 ALA C 1 1 20 10287 1 1 24 ALA CA C 9.721 2.528 3.945 1.00 . A A . 30 ALA CA 1 1 20 10288 1 1 24 ALA CB C 8.791 2.659 5.142 1.00 . A A . 30 ALA CB 1 1 20 10289 1 1 24 ALA H H 8.410 1.015 3.258 1.00 . A A . 30 ALA H 1 1 20 10290 1 1 24 ALA HA H 9.734 3.475 3.426 1.00 . A A . 30 ALA HA 1 1 20 10291 1 1 24 ALA HB1 H 8.337 1.703 5.352 1.00 . A A . 30 ALA HB1 1 1 20 10292 1 1 24 ALA HB2 H 9.356 2.986 6.003 1.00 . A A . 30 ALA HB2 1 1 20 10293 1 1 24 ALA HB3 H 8.020 3.383 4.921 1.00 . A A . 30 ALA HB3 1 1 20 10294 1 1 24 ALA N N 9.216 1.519 3.021 1.00 . A A . 30 ALA N 1 1 20 10295 1 1 24 ALA O O 11.940 3.101 4.660 1.00 . A A . 30 ALA O 1 1 20 10296 1 1 25 TRP C C 13.804 0.685 3.877 1.00 . A A . 31 TRP C 1 1 20 10297 1 1 25 TRP CA C 12.757 0.476 4.974 1.00 . A A . 31 TRP CA 1 1 20 10298 1 1 25 TRP CB C 12.697 -1.000 5.408 1.00 . A A . 31 TRP CB 1 1 20 10299 1 1 25 TRP CD1 C 15.144 -1.771 5.318 1.00 . A A . 31 TRP CD1 1 1 20 10300 1 1 25 TRP CD2 C 13.780 -2.875 3.927 1.00 . A A . 31 TRP CD2 1 1 20 10301 1 1 25 TRP CE2 C 15.083 -3.388 3.780 1.00 . A A . 31 TRP CE2 1 1 20 10302 1 1 25 TRP CE3 C 12.752 -3.419 3.152 1.00 . A A . 31 TRP CE3 1 1 20 10303 1 1 25 TRP CG C 13.841 -1.841 4.917 1.00 . A A . 31 TRP CG 1 1 20 10304 1 1 25 TRP CH2 C 14.357 -4.928 2.144 1.00 . A A . 31 TRP CH2 1 1 20 10305 1 1 25 TRP CZ2 C 15.382 -4.416 2.889 1.00 . A A . 31 TRP CZ2 1 1 20 10306 1 1 25 TRP CZ3 C 13.051 -4.439 2.268 1.00 . A A . 31 TRP CZ3 1 1 20 10307 1 1 25 TRP H H 10.757 0.242 4.322 1.00 . A A . 31 TRP H 1 1 20 10308 1 1 25 TRP HA H 13.031 1.079 5.827 1.00 . A A . 31 TRP HA 1 1 20 10309 1 1 25 TRP HB2 H 12.695 -1.047 6.487 1.00 . A A . 31 TRP HB2 1 1 20 10310 1 1 25 TRP HB3 H 11.781 -1.436 5.036 1.00 . A A . 31 TRP HB3 1 1 20 10311 1 1 25 TRP HD1 H 15.515 -1.080 6.061 1.00 . A A . 31 TRP HD1 1 1 20 10312 1 1 25 TRP HE1 H 16.860 -2.841 4.751 1.00 . A A . 31 TRP HE1 1 1 20 10313 1 1 25 TRP HE3 H 11.739 -3.055 3.233 1.00 . A A . 31 TRP HE3 1 1 20 10314 1 1 25 TRP HH2 H 14.545 -5.726 1.441 1.00 . A A . 31 TRP HH2 1 1 20 10315 1 1 25 TRP HZ2 H 16.383 -4.804 2.780 1.00 . A A . 31 TRP HZ2 1 1 20 10316 1 1 25 TRP HZ3 H 12.270 -4.870 1.661 1.00 . A A . 31 TRP HZ3 1 1 20 10317 1 1 25 TRP N N 11.439 0.914 4.530 1.00 . A A . 31 TRP N 1 1 20 10318 1 1 25 TRP NE1 N 15.897 -2.697 4.639 1.00 . A A . 31 TRP NE1 1 1 20 10319 1 1 25 TRP O O 14.715 1.500 4.022 1.00 . A A . 31 TRP O 1 1 20 10320 1 1 26 LEU C C 14.721 1.442 1.134 1.00 . A A . 32 LEU C 1 1 20 10321 1 1 26 LEU CA C 14.616 0.020 1.680 1.00 . A A . 32 LEU CA 1 1 20 10322 1 1 26 LEU CB C 14.217 -0.942 0.556 1.00 . A A . 32 LEU CB 1 1 20 10323 1 1 26 LEU CD1 C 12.275 0.054 -0.674 1.00 . A A . 32 LEU CD1 1 1 20 10324 1 1 26 LEU CD2 C 12.387 -2.416 -0.303 1.00 . A A . 32 LEU CD2 1 1 20 10325 1 1 26 LEU CG C 12.717 -1.048 0.274 1.00 . A A . 32 LEU CG 1 1 20 10326 1 1 26 LEU H H 12.937 -0.708 2.744 1.00 . A A . 32 LEU H 1 1 20 10327 1 1 26 LEU HA H 15.585 -0.272 2.054 1.00 . A A . 32 LEU HA 1 1 20 10328 1 1 26 LEU HB2 H 14.705 -0.619 -0.351 1.00 . A A . 32 LEU HB2 1 1 20 10329 1 1 26 LEU HB3 H 14.581 -1.927 0.808 1.00 . A A . 32 LEU HB3 1 1 20 10330 1 1 26 LEU HD11 H 13.131 0.644 -0.965 1.00 . A A . 32 LEU HD11 1 1 20 10331 1 1 26 LEU HD12 H 11.825 -0.384 -1.553 1.00 . A A . 32 LEU HD12 1 1 20 10332 1 1 26 LEU HD13 H 11.555 0.688 -0.180 1.00 . A A . 32 LEU HD13 1 1 20 10333 1 1 26 LEU HD21 H 13.275 -2.844 -0.742 1.00 . A A . 32 LEU HD21 1 1 20 10334 1 1 26 LEU HD22 H 12.026 -3.061 0.483 1.00 . A A . 32 LEU HD22 1 1 20 10335 1 1 26 LEU HD23 H 11.626 -2.312 -1.062 1.00 . A A . 32 LEU HD23 1 1 20 10336 1 1 26 LEU HG H 12.169 -0.932 1.196 1.00 . A A . 32 LEU HG 1 1 20 10337 1 1 26 LEU N N 13.675 -0.068 2.792 1.00 . A A . 32 LEU N 1 1 20 10338 1 1 26 LEU O O 15.820 1.931 0.871 1.00 . A A . 32 LEU O 1 1 20 10339 1 1 27 VAL C C 14.420 4.400 1.281 1.00 . A A . 33 VAL C 1 1 20 10340 1 1 27 VAL CA C 13.566 3.462 0.429 1.00 . A A . 33 VAL CA 1 1 20 10341 1 1 27 VAL CB C 12.129 4.018 0.333 1.00 . A A . 33 VAL CB 1 1 20 10342 1 1 27 VAL CG1 C 11.599 4.407 1.706 1.00 . A A . 33 VAL CG1 1 1 20 10343 1 1 27 VAL CG2 C 12.081 5.202 -0.620 1.00 . A A . 33 VAL CG2 1 1 20 10344 1 1 27 VAL H H 12.733 1.661 1.175 1.00 . A A . 33 VAL H 1 1 20 10345 1 1 27 VAL HA H 13.980 3.431 -0.569 1.00 . A A . 33 VAL HA 1 1 20 10346 1 1 27 VAL HB H 11.492 3.242 -0.065 1.00 . A A . 33 VAL HB 1 1 20 10347 1 1 27 VAL HG11 H 11.901 3.665 2.430 1.00 . A A . 33 VAL HG11 1 1 20 10348 1 1 27 VAL HG12 H 12.001 5.369 1.986 1.00 . A A . 33 VAL HG12 1 1 20 10349 1 1 27 VAL HG13 H 10.521 4.462 1.673 1.00 . A A . 33 VAL HG13 1 1 20 10350 1 1 27 VAL HG21 H 12.877 5.891 -0.380 1.00 . A A . 33 VAL HG21 1 1 20 10351 1 1 27 VAL HG22 H 12.202 4.851 -1.636 1.00 . A A . 33 VAL HG22 1 1 20 10352 1 1 27 VAL HG23 H 11.129 5.703 -0.524 1.00 . A A . 33 VAL HG23 1 1 20 10353 1 1 27 VAL N N 13.581 2.101 0.955 1.00 . A A . 33 VAL N 1 1 20 10354 1 1 27 VAL O O 15.096 5.286 0.757 1.00 . A A . 33 VAL O 1 1 20 10355 1 1 28 ARG C C 16.438 4.315 3.948 1.00 . A A . 34 ARG C 1 1 20 10356 1 1 28 ARG CA C 15.160 5.028 3.515 1.00 . A A . 34 ARG CA 1 1 20 10357 1 1 28 ARG CB C 14.322 5.387 4.745 1.00 . A A . 34 ARG CB 1 1 20 10358 1 1 28 ARG CD C 11.905 5.902 5.189 1.00 . A A . 34 ARG CD 1 1 20 10359 1 1 28 ARG CG C 13.162 6.320 4.443 1.00 . A A . 34 ARG CG 1 1 20 10360 1 1 28 ARG CZ C 9.798 6.962 5.901 1.00 . A A . 34 ARG CZ 1 1 20 10361 1 1 28 ARG H H 13.830 3.477 2.954 1.00 . A A . 34 ARG H 1 1 20 10362 1 1 28 ARG HA H 15.428 5.936 2.996 1.00 . A A . 34 ARG HA 1 1 20 10363 1 1 28 ARG HB2 H 13.924 4.478 5.172 1.00 . A A . 34 ARG HB2 1 1 20 10364 1 1 28 ARG HB3 H 14.961 5.866 5.473 1.00 . A A . 34 ARG HB3 1 1 20 10365 1 1 28 ARG HD2 H 11.324 5.251 4.553 1.00 . A A . 34 ARG HD2 1 1 20 10366 1 1 28 ARG HD3 H 12.194 5.368 6.082 1.00 . A A . 34 ARG HD3 1 1 20 10367 1 1 28 ARG HE H 11.512 7.930 5.577 1.00 . A A . 34 ARG HE 1 1 20 10368 1 1 28 ARG HG2 H 13.430 7.322 4.742 1.00 . A A . 34 ARG HG2 1 1 20 10369 1 1 28 ARG HG3 H 12.964 6.300 3.382 1.00 . A A . 34 ARG HG3 1 1 20 10370 1 1 28 ARG HH11 H 9.686 4.958 5.654 1.00 . A A . 34 ARG HH11 1 1 20 10371 1 1 28 ARG HH12 H 8.217 5.728 6.153 1.00 . A A . 34 ARG HH12 1 1 20 10372 1 1 28 ARG HH21 H 9.583 8.943 6.235 1.00 . A A . 34 ARG HH21 1 1 20 10373 1 1 28 ARG HH22 H 8.158 7.989 6.482 1.00 . A A . 34 ARG HH22 1 1 20 10374 1 1 28 ARG N N 14.387 4.199 2.595 1.00 . A A . 34 ARG N 1 1 20 10375 1 1 28 ARG NE N 11.084 7.049 5.569 1.00 . A A . 34 ARG NE 1 1 20 10376 1 1 28 ARG NH1 N 9.184 5.786 5.902 1.00 . A A . 34 ARG NH1 1 1 20 10377 1 1 28 ARG NH2 N 9.124 8.054 6.233 1.00 . A A . 34 ARG NH2 1 1 20 10378 1 1 28 ARG O O 17.527 4.623 3.464 1.00 . A A . 34 ARG O 1 1 20 10379 1 1 29 GLY C C 18.024 1.695 4.293 1.00 . A A . 35 GLY C 1 1 20 10380 1 1 29 GLY CA C 17.445 2.618 5.346 1.00 . A A . 35 GLY CA 1 1 20 10381 1 1 29 GLY H H 15.404 3.158 5.212 1.00 . A A . 35 GLY H 1 1 20 10382 1 1 29 GLY HA2 H 18.208 3.317 5.655 1.00 . A A . 35 GLY HA2 1 1 20 10383 1 1 29 GLY HA3 H 17.145 2.028 6.199 1.00 . A A . 35 GLY HA3 1 1 20 10384 1 1 29 GLY N N 16.296 3.360 4.863 1.00 . A A . 35 GLY N 1 1 20 10385 1 1 29 GLY O O 17.815 0.483 4.337 1.00 . A A . 35 GLY O 1 1 20 10386 1 1 30 ARG C C 20.205 2.382 1.367 1.00 . A A . 36 ARG C 1 1 20 10387 1 1 30 ARG CA C 19.362 1.490 2.272 1.00 . A A . 36 ARG CA 1 1 20 10388 1 1 30 ARG CB C 18.284 0.781 1.451 1.00 . A A . 36 ARG CB 1 1 20 10389 1 1 30 ARG CD C 18.138 -0.848 -0.459 1.00 . A A . 36 ARG CD 1 1 20 10390 1 1 30 ARG CG C 18.715 -0.578 0.922 1.00 . A A . 36 ARG CG 1 1 20 10391 1 1 30 ARG CZ C 19.856 -2.322 -1.430 1.00 . A A . 36 ARG CZ 1 1 20 10392 1 1 30 ARG H H 18.882 3.241 3.360 1.00 . A A . 36 ARG H 1 1 20 10393 1 1 30 ARG HA H 20.003 0.749 2.726 1.00 . A A . 36 ARG HA 1 1 20 10394 1 1 30 ARG HB2 H 17.410 0.643 2.069 1.00 . A A . 36 ARG HB2 1 1 20 10395 1 1 30 ARG HB3 H 18.023 1.405 0.608 1.00 . A A . 36 ARG HB3 1 1 20 10396 1 1 30 ARG HD2 H 17.061 -0.877 -0.386 1.00 . A A . 36 ARG HD2 1 1 20 10397 1 1 30 ARG HD3 H 18.433 -0.046 -1.119 1.00 . A A . 36 ARG HD3 1 1 20 10398 1 1 30 ARG HE H 17.964 -2.849 -1.075 1.00 . A A . 36 ARG HE 1 1 20 10399 1 1 30 ARG HG2 H 19.792 -0.606 0.861 1.00 . A A . 36 ARG HG2 1 1 20 10400 1 1 30 ARG HG3 H 18.371 -1.344 1.602 1.00 . A A . 36 ARG HG3 1 1 20 10401 1 1 30 ARG HH11 H 20.506 -0.458 -0.988 1.00 . A A . 36 ARG HH11 1 1 20 10402 1 1 30 ARG HH12 H 21.694 -1.515 -1.674 1.00 . A A . 36 ARG HH12 1 1 20 10403 1 1 30 ARG HH21 H 19.524 -4.238 -1.976 1.00 . A A . 36 ARG HH21 1 1 20 10404 1 1 30 ARG HH22 H 21.136 -3.661 -2.236 1.00 . A A . 36 ARG HH22 1 1 20 10405 1 1 30 ARG N N 18.752 2.269 3.342 1.00 . A A . 36 ARG N 1 1 20 10406 1 1 30 ARG NE N 18.610 -2.115 -1.011 1.00 . A A . 36 ARG NE 1 1 20 10407 1 1 30 ARG NH1 N 20.759 -1.352 -1.358 1.00 . A A . 36 ARG NH1 1 1 20 10408 1 1 30 ARG NH2 N 20.201 -3.504 -1.920 1.00 . A A . 36 ARG NH2 1 1 20 10409 1 1 30 ARG O O 19.982 3.590 1.288 1.00 . A A . 36 ARG O 1 1 20 10410 1 1 31 GLY C C 23.463 2.620 0.302 1.00 . A A . 37 GLY C 1 1 20 10411 1 1 31 GLY CA C 22.035 2.535 -0.203 1.00 . A A . 37 GLY CA 1 1 20 10412 1 1 31 GLY H H 21.305 0.813 0.790 1.00 . A A . 37 GLY H 1 1 20 10413 1 1 31 GLY HA2 H 22.036 2.061 -1.174 1.00 . A A . 37 GLY HA2 1 1 20 10414 1 1 31 GLY HA3 H 21.641 3.535 -0.304 1.00 . A A . 37 GLY HA3 1 1 20 10415 1 1 31 GLY N N 21.174 1.779 0.687 1.00 . A A . 37 GLY N 1 1 20 10416 1 1 31 GLY O O 23.805 3.633 0.947 1.00 . A A . 37 GLY O 1 1 20 10417 1 1 31 GLY OXT O 24.240 1.674 0.051 1.00 . A A . 37 GLY OXT 1 1 20 10418 2 2 1 . C02 C 8.729 -6.298 -1.697 1.00 . B A . 1038 D6M C02 1 1 20 10419 2 2 1 . C04 C 6.379 -6.692 -2.222 1.00 . B A . 1038 D6M C04 1 1 20 10420 2 2 1 . C05 C 5.389 -6.346 -3.336 1.00 . B A . 1038 D6M C05 1 1 20 10421 2 2 1 . C06 C 5.285 -4.856 -3.621 1.00 . B A . 1038 D6M C06 1 1 20 10422 2 2 1 . C07 C 4.111 -4.207 -2.914 1.00 . B A . 1038 D6M C07 1 1 20 10423 2 2 1 . C09 C 6.466 -8.206 -2.060 1.00 . B A . 1038 D6M C09 1 1 20 10424 2 2 1 . C12 C 10.096 -5.726 -2.021 1.00 . B A . 1038 D6M C12 1 1 20 10425 2 2 1 . C13 C 10.971 -5.553 -0.788 1.00 . B A . 1038 D6M C13 1 1 20 10426 2 2 1 . C14 C 12.382 -6.067 -1.027 1.00 . B A . 1038 D6M C14 1 1 20 10427 2 2 1 . C15 C 13.074 -5.296 -2.141 1.00 . B A . 1038 D6M C15 1 1 20 10428 2 2 1 . C16 C 14.586 -5.466 -2.088 1.00 . B A . 1038 D6M C16 1 1 20 10429 2 2 1 . C17 C 15.305 -4.125 -2.034 1.00 . B A . 1038 D6M C17 1 1 20 10430 2 2 1 . C18 C 14.943 -3.241 -3.220 1.00 . B A . 1038 D6M C18 1 1 20 10431 2 2 1 . C19 C 15.286 -1.785 -2.953 1.00 . B A . 1038 D6M C19 1 1 20 10432 2 2 1 . C20 C 14.226 -0.845 -3.510 1.00 . B A . 1038 D6M C20 1 1 20 10433 2 2 1 . C21 C 14.853 0.377 -4.167 1.00 . B A . 1038 D6M C21 1 1 20 10434 2 2 1 . C22 C 14.482 1.662 -3.439 1.00 . B A . 1038 D6M C22 1 1 20 10435 2 2 1 . C23 C 13.532 2.521 -4.262 1.00 . B A . 1038 D6M C23 1 1 20 10436 2 2 1 . C24 C 12.282 2.884 -3.475 1.00 . B A . 1038 D6M C24 1 1 20 10437 2 2 1 . C25 C 11.518 1.644 -3.043 1.00 . B A . 1038 D6M C25 1 1 20 10438 2 2 1 . C26 C 10.328 1.377 -3.938 1.00 . B A . 1038 D6M C26 1 1 20 10439 2 2 1 . H03 H 7.817 -5.611 -3.340 1.00 . B A . 1038 D6M H03 1 1 20 10440 2 2 1 . H04 H 6.029 -6.262 -1.296 1.00 . B A . 1038 D6M H04 1 1 20 10441 2 2 1 . HP21 H 9.963 -4.761 -2.490 1.00 . B A . 1038 D6M HP21 1 1 20 10442 2 2 1 . HP22 H 10.594 -6.393 -2.709 1.00 . B A . 1038 D6M HP22 1 1 20 10443 2 2 1 . HP31 H 10.532 -6.100 0.034 1.00 . B A . 1038 D6M HP31 1 1 20 10444 2 2 1 . HP32 H 11.022 -4.504 -0.539 1.00 . B A . 1038 D6M HP32 1 1 20 10445 2 2 1 . HP41 H 12.334 -7.111 -1.300 1.00 . B A . 1038 D6M HP41 1 1 20 10446 2 2 1 . HP42 H 12.955 -5.957 -0.118 1.00 . B A . 1038 D6M HP42 1 1 20 10447 2 2 1 . HP51 H 12.833 -4.248 -2.040 1.00 . B A . 1038 D6M HP51 1 1 20 10448 2 2 1 . HP52 H 12.715 -5.659 -3.092 1.00 . B A . 1038 D6M HP52 1 1 20 10449 2 2 1 . HP61 H 14.908 -6.001 -2.970 1.00 . B A . 1038 D6M HP61 1 1 20 10450 2 2 1 . HP62 H 14.845 -6.034 -1.207 1.00 . B A . 1038 D6M HP62 1 1 20 10451 2 2 1 . HP71 H 16.371 -4.301 -2.042 1.00 . B A . 1038 D6M HP71 1 1 20 10452 2 2 1 . HP72 H 15.031 -3.617 -1.122 1.00 . B A . 1038 D6M HP72 1 1 20 10453 2 2 1 . HP81 H 13.883 -3.323 -3.409 1.00 . B A . 1038 D6M HP81 1 1 20 10454 2 2 1 . HP82 H 15.491 -3.577 -4.087 1.00 . B A . 1038 D6M HP82 1 1 20 10455 2 2 1 . HP91 H 16.235 -1.559 -3.418 1.00 . B A . 1038 D6M HP91 1 1 20 10456 2 2 1 . HP92 H 15.362 -1.633 -1.887 1.00 . B A . 1038 D6M HP92 1 1 20 10457 2 2 1 . HPA1 H 13.585 -0.522 -2.703 1.00 . B A . 1038 D6M HPA1 1 1 20 10458 2 2 1 . HPA2 H 13.640 -1.376 -4.246 1.00 . B A . 1038 D6M HPA2 1 1 20 10459 2 2 1 . HPB1 H 14.509 0.440 -5.189 1.00 . B A . 1038 D6M HPB1 1 1 20 10460 2 2 1 . HPB2 H 15.928 0.269 -4.155 1.00 . B A . 1038 D6M HPB2 1 1 20 10461 2 2 1 . HPC1 H 15.383 2.225 -3.245 1.00 . B A . 1038 D6M HPC1 1 1 20 10462 2 2 1 . HPC2 H 14.006 1.410 -2.505 1.00 . B A . 1038 D6M HPC2 1 1 20 10463 2 2 1 . HPD1 H 13.242 1.975 -5.148 1.00 . B A . 1038 D6M HPD1 1 1 20 10464 2 2 1 . HPD2 H 14.040 3.429 -4.547 1.00 . B A . 1038 D6M HPD2 1 1 20 10465 2 2 1 . HPE1 H 11.641 3.492 -4.096 1.00 . B A . 1038 D6M HPE1 1 1 20 10466 2 2 1 . HPE2 H 12.569 3.441 -2.596 1.00 . B A . 1038 D6M HPE2 1 1 20 10467 2 2 1 . HPF1 H 11.166 1.780 -2.031 1.00 . B A . 1038 D6M HPF1 1 1 20 10468 2 2 1 . HPF2 H 12.175 0.790 -3.088 1.00 . B A . 1038 D6M HPF2 1 1 20 10469 2 2 1 . HPG1 H 9.742 0.569 -3.525 1.00 . B A . 1038 D6M HPG1 1 1 20 10470 2 2 1 . HPG2 H 10.675 1.103 -4.924 1.00 . B A . 1038 D6M HPG2 1 1 20 10471 2 2 1 . HPG3 H 9.720 2.266 -4.005 1.00 . B A . 1038 D6M HPG3 1 1 20 10472 2 2 1 . HQ21 H 6.194 -4.375 -3.293 1.00 . B A . 1038 D6M HQ21 1 1 20 10473 2 2 1 . HQ22 H 5.167 -4.713 -4.685 1.00 . B A . 1038 D6M HQ22 1 1 20 10474 2 2 1 . HQ31 H 5.699 -6.843 -4.243 1.00 . B A . 1038 D6M HQ31 1 1 20 10475 2 2 1 . HQ32 H 4.409 -6.705 -3.056 1.00 . B A . 1038 D6M HQ32 1 1 20 10476 2 2 1 . N03 N 7.692 -6.122 -2.513 1.00 . B A . 1038 D6M N03 1 1 20 10477 2 2 1 . O01 O 8.602 -6.955 -0.664 1.00 . B A . 1038 D6M O01 1 1 20 10478 2 2 1 . O08 O 3.048 -4.825 -2.863 1.00 . B A . 1038 D6M O08 1 1 20 10479 2 2 1 . O10 O 6.025 -8.714 -1.007 1.00 . B A . 1038 D6M O10 1 1 20 10480 2 2 1 . O11 O 6.974 -8.872 -2.987 1.00 . B A . 1038 D6M O11 1 1 stop_ save_
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