NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
369934 | 1bjc | cing | 4-filtered-FRED | STAR | entry | full | 169 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1bjc # This FRED archive file contains, for PDB entry <1bjc>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1bjc _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1bjc _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 3277.43 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 $AMYLOID_BETA_PEPTIDE A . 1 1 stop_ save_ save_AMYLOID_BETA_PEPTIDE _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "AMYLOID BETA PEPTIDE" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code DAEFRHDSGYEVHHQFLVFFAEDVGSNK _Entity.Number_of_monomers 28 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 ASP . 1 1 2 ALA . 1 1 3 GLU . 1 1 4 PHE . 1 1 5 ARG . 1 1 6 HIS . 1 1 7 ASP . 1 1 8 SER . 1 1 9 GLY . 1 1 10 TYR . 1 1 11 GLU . 1 1 12 VAL . 1 1 13 HIS . 1 1 14 HIS . 1 1 15 GLN . 1 1 16 PHE . 1 1 17 LEU . 1 1 18 VAL . 1 1 19 PHE . 1 1 20 PHE . 1 1 21 ALA . 1 1 22 GLU . 1 1 23 ASP . 1 1 24 VAL . 1 1 25 GLY . 1 1 26 SER . 1 1 27 ASN . 1 1 28 LYS . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID ASP 1 1 1 1 ALA 2 2 1 1 GLU 3 3 1 1 PHE 4 4 1 1 ARG 5 5 1 1 HIS 6 6 1 1 ASP 7 7 1 1 SER 8 8 1 1 GLY 9 9 1 1 TYR 10 10 1 1 GLU 11 11 1 1 VAL 12 12 1 1 HIS 13 13 1 1 HIS 14 14 1 1 GLN 15 15 1 1 PHE 16 16 1 1 LEU 17 17 1 1 VAL 18 18 1 1 PHE 19 19 1 1 PHE 20 20 1 1 ALA 21 21 1 1 GLU 22 22 1 1 ASP 23 23 1 1 VAL 24 24 1 1 GLY 25 25 1 1 SER 26 26 1 1 ASN 27 27 1 1 LYS 28 28 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 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 1 ASP HA . 1 . HA 1 1 1 1 2 1 1 2 ALA H . 2 . HN 1 1 2 1 1 1 1 1 ASP QB . 1 . HB* 1 1 2 1 2 1 1 2 ALA H . 2 . HN 1 1 3 1 1 1 1 2 ALA H . 2 . HN 1 1 3 1 2 1 1 3 GLU H . 3 . HN 1 1 4 1 1 1 1 2 ALA HA . 2 . HA 1 1 4 1 2 1 1 3 GLU H . 3 . HN 1 1 5 1 1 1 1 2 ALA MB . 2 . HB* 1 1 5 1 2 1 1 3 GLU H . 3 . HN 1 1 6 1 1 1 1 2 ALA MB . 2 . HB* 1 1 6 1 2 1 1 4 PHE H . 4 . HN 1 1 7 1 1 1 1 2 ALA MB . 2 . HB* 1 1 7 1 2 1 1 5 ARG H . 5 . HN 1 1 8 1 1 1 1 3 GLU HA . 3 . HA 1 1 8 1 2 1 1 4 PHE H . 4 . HN 1 1 9 1 1 1 1 4 PHE H . 4 . HN 1 1 9 1 2 1 1 4 PHE QB . 4 . HB* 1 1 10 1 1 1 1 4 PHE H . 4 . HN 1 1 10 1 2 1 1 5 ARG H . 5 . HN 1 1 11 1 1 1 1 4 PHE HA . 4 . HA 1 1 11 1 2 1 1 5 ARG H . 5 . HN 1 1 12 1 1 1 1 4 PHE HA . 4 . HA 1 1 12 1 2 1 1 6 HIS H . 6 . HN 1 1 13 1 1 1 1 4 PHE HA . 4 . HA 1 1 13 1 2 1 1 7 ASP H . 7 . HN 1 1 14 1 1 1 1 5 ARG H . 5 . HN 1 1 14 1 2 1 1 5 ARG HA . 5 . HA 1 1 15 1 1 1 1 5 ARG H . 5 . HN 1 1 15 1 2 1 1 5 ARG QB . 5 . HB* 1 1 16 1 1 1 1 5 ARG H . 5 . HN 1 1 16 1 2 1 1 5 ARG QG . 5 . HG* 1 1 17 1 1 1 1 5 ARG HA . 5 . HA 1 1 17 1 2 1 1 6 HIS H . 6 . HN 1 1 18 1 1 1 1 5 ARG HA . 5 . HA 1 1 18 1 2 1 1 7 ASP H . 7 . HN 1 1 19 1 1 1 1 5 ARG QB . 5 . HB* 1 1 19 1 2 1 1 6 HIS H . 6 . HN 1 1 20 1 1 1 1 5 ARG QG . 5 . HG* 1 1 20 1 2 1 1 6 HIS H . 6 . HN 1 1 21 1 1 1 1 6 HIS H . 6 . HN 1 1 21 1 2 1 1 6 HIS HA . 6 . HA 1 1 22 1 1 1 1 6 HIS QB . 6 . HB* 1 1 22 1 2 1 1 7 ASP H . 7 . HN 1 1 23 1 1 1 1 6 HIS QB . 6 . HB* 1 1 23 1 2 1 1 8 SER H . 8 . HN 1 1 24 1 1 1 1 7 ASP H . 7 . HN 1 1 24 1 2 1 1 7 ASP HA . 7 . HA 1 1 25 1 1 1 1 7 ASP HA . 7 . HA 1 1 25 1 2 1 1 8 SER H . 8 . HN 1 1 26 1 1 1 1 7 ASP QB . 7 . HB* 1 1 26 1 2 1 1 8 SER H . 8 . HN 1 1 27 1 1 1 1 8 SER H . 8 . HN 1 1 27 1 2 1 1 9 GLY H . 9 . HN 1 1 28 1 1 1 1 8 SER HA . 8 . HA 1 1 28 1 2 1 1 9 GLY H . 9 . HN 1 1 29 1 1 1 1 8 SER QB . 8 . HB* 1 1 29 1 2 1 1 9 GLY QA . 9 . HA* 1 1 30 1 1 1 1 9 GLY H . 9 . HN 1 1 30 1 2 1 1 9 GLY QA . 9 . HA* 1 1 31 1 1 1 1 9 GLY H . 9 . HN 1 1 31 1 2 1 1 10 TYR H . 10 . HN 1 1 32 1 1 1 1 9 GLY QA . 9 . HA* 1 1 32 1 2 1 1 10 TYR H . 10 . HN 1 1 33 1 1 1 1 9 GLY QA . 9 . HA* 1 1 33 1 2 1 1 10 TYR QB . 10 . HB* 1 1 34 1 1 1 1 10 TYR H . 10 . HN 1 1 34 1 2 1 1 10 TYR HA . 10 . HA 1 1 35 1 1 1 1 10 TYR H . 10 . HN 1 1 35 1 2 1 1 10 TYR QB . 10 . HB* 1 1 36 1 1 1 1 10 TYR H . 10 . HN 1 1 36 1 2 1 1 10 TYR QD . 10 . HD* 1 1 37 1 1 1 1 10 TYR H . 10 . HN 1 1 37 1 2 1 1 10 TYR QE . 10 . HE* 1 1 38 1 1 1 1 10 TYR HA . 10 . HA 1 1 38 1 2 1 1 10 TYR QE . 10 . HE* 1 1 39 1 1 1 1 10 TYR HA . 10 . HA 1 1 39 1 2 1 1 11 GLU H . 11 . HN 1 1 40 1 1 1 1 10 TYR QB . 10 . HB* 1 1 40 1 2 1 1 11 GLU H . 11 . HN 1 1 41 1 1 1 1 10 TYR QD . 10 . HD* 1 1 41 1 2 1 1 11 GLU H . 11 . HN 1 1 42 1 1 1 1 10 TYR QD . 10 . HD* 1 1 42 1 2 1 1 11 GLU HA . 11 . HA 1 1 43 1 1 1 1 10 TYR QD . 10 . HD* 1 1 43 1 2 1 1 12 VAL HA . 12 . HA 1 1 44 1 1 1 1 10 TYR QE . 10 . HE* 1 1 44 1 2 1 1 12 VAL HA . 12 . HA 1 1 45 1 1 1 1 11 GLU H . 11 . HN 1 1 45 1 2 1 1 12 VAL HA . 12 . HA 1 1 46 1 1 1 1 11 GLU H . 11 . HN 1 1 46 1 2 1 1 12 VAL QG . 12 . HG* 1 1 47 1 1 1 1 11 GLU HA . 11 . HA 1 1 47 1 2 1 1 11 GLU QG . 11 . HG* 1 1 48 1 1 1 1 11 GLU HA . 11 . HA 1 1 48 1 2 1 1 12 VAL H . 12 . HN 1 1 49 1 1 1 1 11 GLU HA . 11 . HA 1 1 49 1 2 1 1 12 VAL HB . 12 . HB 1 1 50 1 1 1 1 11 GLU HA . 11 . HA 1 1 50 1 2 1 1 12 VAL MG2 . 12 . HG2* 1 1 51 1 1 1 1 11 GLU QG . 11 . HG* 1 1 51 1 2 1 1 12 VAL HA . 12 . HA 1 1 52 1 1 1 1 12 VAL H . 12 . HN 1 1 52 1 2 1 1 12 VAL HA . 12 . HA 1 1 53 1 1 1 1 12 VAL H . 12 . HN 1 1 53 1 2 1 1 12 VAL HB . 12 . HB 1 1 54 1 1 1 1 12 VAL H . 12 . HN 1 1 54 1 2 1 1 12 VAL MG2 . 12 . HG2* 1 1 55 1 1 1 1 12 VAL H . 12 . HN 1 1 55 1 2 1 1 13 HIS H . 13 . HN 1 1 56 1 1 1 1 12 VAL HA . 12 . HA 1 1 56 1 2 1 1 12 VAL HB . 12 . HB 1 1 57 1 1 1 1 12 VAL HA . 12 . HA 1 1 57 1 2 1 1 13 HIS H . 13 . HN 1 1 58 1 1 1 1 12 VAL HB . 12 . HB 1 1 58 1 2 1 1 13 HIS H . 13 . HN 1 1 59 1 1 1 1 12 VAL QG . 12 . HG* 1 1 59 1 2 1 1 13 HIS HA . 13 . HA 1 1 60 1 1 1 1 12 VAL MG1 . 12 . HG1* 1 1 60 1 2 1 1 13 HIS H . 13 . HN 1 1 61 1 1 1 1 12 VAL MG1 . 12 . HG1* 1 1 61 1 2 1 1 14 HIS H . 14 . HN 1 1 62 1 1 1 1 12 VAL MG2 . 12 . HG2* 1 1 62 1 2 1 1 13 HIS H . 13 . HN 1 1 63 1 1 1 1 12 VAL MG2 . 12 . HG2* 1 1 63 1 2 1 1 14 HIS H . 14 . HN 1 1 64 1 1 1 1 13 HIS H . 13 . HN 1 1 64 1 2 1 1 13 HIS HA . 13 . HA 1 1 65 1 1 1 1 13 HIS H . 13 . HN 1 1 65 1 2 1 1 13 HIS QB . 13 . HB* 1 1 66 1 1 1 1 14 HIS H . 14 . HN 1 1 66 1 2 1 1 14 HIS HA . 14 . HA 1 1 67 1 1 1 1 14 HIS HA . 14 . HA 1 1 67 1 2 1 1 15 GLN QB . 15 . HB* 1 1 68 1 1 1 1 14 HIS HA . 14 . HA 1 1 68 1 2 1 1 15 GLN QG . 15 . HG* 1 1 69 1 1 1 1 14 HIS HA . 14 . HA 1 1 69 1 2 1 1 17 LEU QD . 17 . HD* 1 1 70 1 1 1 1 15 GLN H . 15 . HN 1 1 70 1 2 1 1 15 GLN QB . 15 . HB* 1 1 71 1 1 1 1 15 GLN H . 15 . HN 1 1 71 1 2 1 1 15 GLN QG . 15 . HG* 1 1 72 1 1 1 1 15 GLN H . 15 . HN 1 1 72 1 2 1 1 16 PHE H . 16 . HN 1 1 73 1 1 1 1 15 GLN HA . 15 . HA 1 1 73 1 2 1 1 15 GLN QB . 15 . HB* 1 1 74 1 1 1 1 15 GLN HA . 15 . HA 1 1 74 1 2 1 1 16 PHE H . 16 . HN 1 1 75 1 1 1 1 15 GLN HA . 15 . HA 1 1 75 1 2 1 1 18 VAL H . 18 . HN 1 1 76 1 1 1 1 15 GLN HA . 15 . HA 1 1 76 1 2 1 1 18 VAL MG1 . 18 . HG1* 1 1 77 1 1 1 1 15 GLN HA . 15 . HA 1 1 77 1 2 1 1 18 VAL MG2 . 18 . HG2* 1 1 78 1 1 1 1 15 GLN QB . 15 . HB* 1 1 78 1 2 1 1 16 PHE H . 16 . HN 1 1 79 1 1 1 1 15 GLN QG . 15 . HG* 1 1 79 1 2 1 1 16 PHE H . 16 . HN 1 1 80 1 1 1 1 16 PHE H . 16 . HN 1 1 80 1 2 1 1 18 VAL H . 18 . HN 1 1 81 1 1 1 1 16 PHE HA . 16 . HA 1 1 81 1 2 1 1 16 PHE QE . 16 . HE* 1 1 82 1 1 1 1 16 PHE HA . 16 . HA 1 1 82 1 2 1 1 17 LEU H . 17 . HN 1 1 83 1 1 1 1 16 PHE HA . 16 . HA 1 1 83 1 2 1 1 18 VAL H . 18 . HN 1 1 84 1 1 1 1 16 PHE HA . 16 . HA 1 1 84 1 2 1 1 19 PHE H . 19 . HN 1 1 85 1 1 1 1 16 PHE HA . 16 . HA 1 1 85 1 2 1 1 19 PHE QB . 19 . HB* 1 1 86 1 1 1 1 16 PHE QB . 16 . HB* 1 1 86 1 2 1 1 17 LEU H . 17 . HN 1 1 87 1 1 1 1 16 PHE QB . 16 . HB* 1 1 87 1 2 1 1 18 VAL H . 18 . HN 1 1 88 1 1 1 1 16 PHE QB . 16 . HB* 1 1 88 1 2 1 1 19 PHE H . 19 . HN 1 1 89 1 1 1 1 16 PHE QD . 16 . HD* 1 1 89 1 2 1 1 17 LEU QD . 17 . HD* 1 1 90 1 1 1 1 17 LEU H . 17 . HN 1 1 90 1 2 1 1 17 LEU HA . 17 . HA 1 1 91 1 1 1 1 17 LEU H . 17 . HN 1 1 91 1 2 1 1 17 LEU HG . 17 . HG* 1 1 92 1 1 1 1 17 LEU H . 17 . HN 1 1 92 1 2 1 1 18 VAL H . 18 . HN 1 1 93 1 1 1 1 17 LEU H . 17 . HN 1 1 93 1 2 1 1 18 VAL HA . 18 . HA 1 1 94 1 1 1 1 17 LEU HA . 17 . HA 1 1 94 1 2 1 1 17 LEU HG . 17 . HG 1 1 95 1 1 1 1 17 LEU HA . 17 . HA 1 1 95 1 2 1 1 18 VAL H . 18 . HN 1 1 96 1 1 1 1 17 LEU QB . 17 . HB* 1 1 96 1 2 1 1 18 VAL H . 18 . HN 1 1 97 1 1 1 1 17 LEU QB . 17 . HB* 1 1 97 1 2 1 1 18 VAL HA . 18 . HA 1 1 98 1 1 1 1 17 LEU QB . 17 . HB* 1 1 98 1 2 1 1 19 PHE H . 19 . HN 1 1 99 1 1 1 1 17 LEU HG . 17 . HG* 1 1 99 1 2 1 1 18 VAL H . 18 . HN 1 1 100 1 1 1 1 17 LEU HG . 17 . HG* 1 1 100 1 2 1 1 19 PHE H . 19 . HN 1 1 101 1 1 1 1 18 VAL H . 18 . HN 1 1 101 1 2 1 1 18 VAL HB . 18 . HB 1 1 102 1 1 1 1 18 VAL H . 18 . HN 1 1 102 1 2 1 1 18 VAL MG2 . 18 . HG2* 1 1 103 1 1 1 1 18 VAL H . 18 . HN 1 1 103 1 2 1 1 19 PHE H . 19 . HN 1 1 104 1 1 1 1 18 VAL HA . 18 . HA 1 1 104 1 2 1 1 19 PHE H . 19 . HN 1 1 105 1 1 1 1 18 VAL HA . 18 . HA 1 1 105 1 2 1 1 20 PHE H . 20 . HN 1 1 106 1 1 1 1 18 VAL HA . 18 . HA 1 1 106 1 2 1 1 21 ALA H . 21 . HN 1 1 107 1 1 1 1 18 VAL HA . 18 . HA 1 1 107 1 2 1 1 21 ALA MB . 21 . HB* 1 1 108 1 1 1 1 18 VAL HA . 18 . HA 1 1 108 1 2 1 1 22 GLU H . 22 . HN 1 1 109 1 1 1 1 18 VAL HB . 18 . HB 1 1 109 1 2 1 1 19 PHE H . 19 . HN 1 1 110 1 1 1 1 18 VAL MG1 . 18 . HG1* 1 1 110 1 2 1 1 19 PHE H . 19 . HN 1 1 111 1 1 1 1 18 VAL MG1 . 18 . HG1* 1 1 111 1 2 1 1 19 PHE HA . 19 . HA 1 1 112 1 1 1 1 18 VAL MG1 . 18 . HG1* 1 1 112 1 2 1 1 21 ALA H . 21 . HN 1 1 113 1 1 1 1 18 VAL MG2 . 18 . HG2* 1 1 113 1 2 1 1 19 PHE H . 19 . HN 1 1 114 1 1 1 1 18 VAL MG2 . 18 . HG2* 1 1 114 1 2 1 1 21 ALA H . 21 . HN 1 1 115 1 1 1 1 19 PHE H . 19 . HN 1 1 115 1 2 1 1 19 PHE QB . 19 . HB* 1 1 116 1 1 1 1 19 PHE H . 19 . HN 1 1 116 1 2 1 1 19 PHE QD . 19 . HD* 1 1 117 1 1 1 1 19 PHE H . 19 . HN 1 1 117 1 2 1 1 20 PHE H . 20 . HN 1 1 118 1 1 1 1 19 PHE HA . 19 . HA 1 1 118 1 2 1 1 19 PHE QE . 19 . HE* 1 1 119 1 1 1 1 19 PHE HA . 19 . HA 1 1 119 1 2 1 1 20 PHE H . 20 . HN 1 1 120 1 1 1 1 19 PHE HA . 19 . HA 1 1 120 1 2 1 1 22 GLU QB . 22 . HB* 1 1 121 1 1 1 1 19 PHE QE . 19 . HE* 1 1 121 1 2 1 1 23 ASP QB . 23 . HB* 1 1 122 1 1 1 1 20 PHE H . 20 . HN 1 1 122 1 2 1 1 20 PHE QB . 20 . HB* 1 1 123 1 1 1 1 20 PHE H . 20 . HN 1 1 123 1 2 1 1 21 ALA MB . 21 . HB* 1 1 124 1 1 1 1 20 PHE H . 20 . HN 1 1 124 1 2 1 1 24 VAL MG2 . 24 . HG2* 1 1 125 1 1 1 1 20 PHE HA . 20 . HA 1 1 125 1 2 1 1 20 PHE QE . 20 . HE* 1 1 126 1 1 1 1 20 PHE HA . 20 . HA 1 1 126 1 2 1 1 21 ALA H . 21 . HN 1 1 127 1 1 1 1 20 PHE HA . 20 . HA 1 1 127 1 2 1 1 23 ASP QB . 23 . HB* 1 1 128 1 1 1 1 20 PHE HA . 20 . HA 1 1 128 1 2 1 1 24 VAL MG2 . 24 . HG2* 1 1 129 1 1 1 1 20 PHE QB . 20 . HB* 1 1 129 1 2 1 1 21 ALA H . 21 . HN 1 1 130 1 1 1 1 20 PHE QD . 20 . HD* 1 1 130 1 2 1 1 24 VAL MG1 . 24 . HG1* 1 1 131 1 1 1 1 20 PHE QD . 20 . HD* 1 1 131 1 2 1 1 24 VAL MG2 . 24 . HG2* 1 1 132 1 1 1 1 21 ALA H . 21 . HN 1 1 132 1 2 1 1 21 ALA HA . 21 . HA 1 1 133 1 1 1 1 21 ALA H . 21 . HN 1 1 133 1 2 1 1 22 GLU H . 22 . HN 1 1 134 1 1 1 1 21 ALA HA . 21 . HA 1 1 134 1 2 1 1 22 GLU H . 22 . HN 1 1 135 1 1 1 1 21 ALA HA . 21 . HA 1 1 135 1 2 1 1 23 ASP H . 23 . HN 1 1 136 1 1 1 1 21 ALA HA . 21 . HA 1 1 136 1 2 1 1 24 VAL H . 24 . HN 1 1 137 1 1 1 1 21 ALA HA . 21 . HA 1 1 137 1 2 1 1 24 VAL HB . 24 . HB 1 1 138 1 1 1 1 21 ALA HA . 21 . HA 1 1 138 1 2 1 1 24 VAL MG1 . 24 . HG1* 1 1 139 1 1 1 1 21 ALA HA . 21 . HA 1 1 139 1 2 1 1 24 VAL MG2 . 24 . HG2* 1 1 140 1 1 1 1 21 ALA MB . 21 . HB* 1 1 140 1 2 1 1 22 GLU H . 22 . HN 1 1 141 1 1 1 1 21 ALA MB . 21 . HB* 1 1 141 1 2 1 1 24 VAL H . 24 . HN 1 1 142 1 1 1 1 22 GLU H . 22 . HN 1 1 142 1 2 1 1 22 GLU HA . 22 . HA 1 1 143 1 1 1 1 22 GLU H . 22 . HN 1 1 143 1 2 1 1 22 GLU QB . 22 . HB* 1 1 144 1 1 1 1 22 GLU H . 22 . HN 1 1 144 1 2 1 1 22 GLU QG . 22 . HG* 1 1 145 1 1 1 1 22 GLU H . 22 . HN 1 1 145 1 2 1 1 23 ASP QB . 23 . HB* 1 1 146 1 1 1 1 22 GLU HA . 22 . HA 1 1 146 1 2 1 1 23 ASP H . 23 . HN 1 1 147 1 1 1 1 22 GLU QB . 22 . HB* 1 1 147 1 2 1 1 23 ASP H . 23 . HN 1 1 148 1 1 1 1 22 GLU QG . 22 . HG* 1 1 148 1 2 1 1 23 ASP H . 23 . HN 1 1 149 1 1 1 1 23 ASP H . 23 . HN 1 1 149 1 2 1 1 23 ASP HA . 23 . HA 1 1 150 1 1 1 1 23 ASP H . 23 . HN 1 1 150 1 2 1 1 23 ASP QB . 23 . HB* 1 1 151 1 1 1 1 23 ASP H . 23 . HN 1 1 151 1 2 1 1 24 VAL H . 24 . HN 1 1 152 1 1 1 1 23 ASP HA . 23 . HA 1 1 152 1 2 1 1 24 VAL H . 24 . HN 1 1 153 1 1 1 1 23 ASP QB . 23 . HB* 1 1 153 1 2 1 1 24 VAL H . 24 . HN 1 1 154 1 1 1 1 24 VAL H . 24 . HN 1 1 154 1 2 1 1 24 VAL HB . 24 . HB 1 1 155 1 1 1 1 24 VAL H . 24 . HN 1 1 155 1 2 1 1 24 VAL MG2 . 24 . HG2* 1 1 156 1 1 1 1 24 VAL H . 24 . HN 1 1 156 1 2 1 1 25 GLY H . 25 . HN 1 1 157 1 1 1 1 24 VAL HA . 24 . HA 1 1 157 1 2 1 1 24 VAL HB . 24 . HB 1 1 158 1 1 1 1 24 VAL MG1 . 24 . HG1* 1 1 158 1 2 1 1 25 GLY H . 25 . HN 1 1 159 1 1 1 1 24 VAL MG2 . 24 . HG2* 1 1 159 1 2 1 1 25 GLY H . 25 . HN 1 1 160 1 1 1 1 26 SER H . 26 . HN 1 1 160 1 2 1 1 26 SER HA . 26 . HA 1 1 161 1 1 1 1 26 SER H . 26 . HN 1 1 161 1 2 1 1 26 SER QB . 26 . HB* 1 1 162 1 1 1 1 26 SER H . 26 . HN 1 1 162 1 2 1 1 27 ASN H . 27 . HN 1 1 163 1 1 1 1 26 SER HA . 26 . HA 1 1 163 1 2 1 1 27 ASN H . 27 . HN 1 1 164 1 1 1 1 26 SER HA . 26 . HA 1 1 164 1 2 1 1 28 LYS H . 28 . HN 1 1 165 1 1 1 1 27 ASN H . 27 . HN 1 1 165 1 2 1 1 28 LYS H . 28 . HN 1 1 166 1 1 1 1 27 ASN HA . 27 . HA 1 1 166 1 2 1 1 28 LYS H . 28 . HN 1 1 167 1 1 1 1 27 ASN QB . 27 . HB* 1 1 167 1 2 1 1 28 LYS H . 28 . HN 1 1 168 1 1 1 1 28 LYS H . 28 . HN 1 1 168 1 2 1 1 28 LYS QD . 28 . HD* 1 1 169 1 1 1 1 28 LYS H . 28 . HN 1 1 169 1 2 1 1 28 LYS QG . 28 . HG* 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 . . . . . 0.0 0.0 3.4 1 1 2 1 . . . . . 0.0 0.0 5.2 1 1 3 1 . . . . . 0.0 0.0 4.2 1 1 4 1 . . . . . 0.0 0.0 2.8 1 1 5 1 . . . . . 0.0 0.0 4.9 1 1 6 1 . . . . . 0.0 0.0 5.7 1 1 7 1 . . . . . 0.0 0.0 6.5 1 1 8 1 . . . . . 0.0 0.0 2.8 1 1 9 1 . . . . . 0.0 0.0 3.8 1 1 10 1 . . . . . 0.0 0.0 3.4 1 1 11 1 . . . . . 0.0 0.0 2.8 1 1 12 1 . . . . . 0.0 0.0 4.2 1 1 13 1 . . . . . 0.0 0.0 5.0 1 1 14 1 . . . . . 0.0 0.0 2.8 1 1 15 1 . . . . . 0.0 0.0 3.8 1 1 16 1 . . . . . 0.0 0.0 4.4 1 1 17 1 . . . . . 0.0 0.0 2.8 1 1 18 1 . . . . . 0.0 0.0 5.0 1 1 19 1 . . . . . 0.0 0.0 5.2 1 1 20 1 . . . . . 0.0 0.0 4.4 1 1 21 1 . . . . . 0.0 0.0 2.8 1 1 22 1 . . . . . 0.0 0.0 5.2 1 1 23 1 . . . . . 0.0 0.0 5.2 1 1 24 1 . . . . . 0.0 0.0 2.8 1 1 25 1 . . . . . 0.0 0.0 2.8 1 1 26 1 . . . . . 0.0 0.0 5.2 1 1 27 1 . . . . . 0.0 0.0 3.4 1 1 28 1 . . . . . 0.0 0.0 3.4 1 1 29 1 . . . . . 0.0 0.0 7.2 1 1 30 1 . . . . . 0.0 0.0 2.8 1 1 31 1 . . . . . 0.0 0.0 3.4 1 1 32 1 . . . . . 0.0 0.0 3.8 1 1 33 1 . . . . . 0.0 0.0 8.0 1 1 34 1 . . . . . 0.0 0.0 2.8 1 1 35 1 . . . . . 0.0 0.0 3.8 1 1 36 1 . . . . . 0.0 0.0 5.4 1 1 37 1 . . . . . 0.0 0.0 7.0 1 1 38 1 . . . . . 0.0 0.0 6.2 1 1 39 1 . . . . . 0.0 0.0 2.8 1 1 40 1 . . . . . 0.0 0.0 3.4 1 1 41 1 . . . . . 0.0 0.0 6.2 1 1 42 1 . . . . . 0.0 0.0 6.2 1 1 43 1 . . . . . 0.0 0.0 7.0 1 1 44 1 . . . . . 0.0 0.0 6.2 1 1 45 1 . . . . . 0.0 0.0 4.2 1 1 46 1 . . . . . 0.0 0.0 5.7 1 1 47 1 . . . . . 0.0 0.0 3.4 1 1 48 1 . . . . . 0.0 0.0 2.8 1 1 49 1 . . . . . 0.0 0.0 4.2 1 1 50 1 . . . . . 0.0 0.0 4.9 1 1 51 1 . . . . . 0.0 0.0 5.2 1 1 52 1 . . . . . 0.0 0.0 2.8 1 1 53 1 . . . . . 0.0 0.0 2.8 1 1 54 1 . . . . . 0.0 0.0 4.3 1 1 55 1 . . . . . 0.0 0.0 3.4 1 1 56 1 . . . . . 0.0 0.0 2.8 1 1 57 1 . . . . . 0.0 0.0 3.4 1 1 58 1 . . . . . 0.0 0.0 3.4 1 1 59 1 . . . . . 0.0 0.0 6.7 1 1 60 1 . . . . . 0.0 0.0 4.9 1 1 61 1 . . . . . 0.0 0.0 4.9 1 1 62 1 . . . . . 0.0 0.0 4.9 1 1 63 1 . . . . . 0.0 0.0 5.7 1 1 64 1 . . . . . 0.0 0.0 2.8 1 1 65 1 . . . . . 0.0 0.0 3.8 1 1 66 1 . . . . . 0.0 0.0 2.8 1 1 67 1 . . . . . 0.0 0.0 5.2 1 1 68 1 . . . . . 0.0 0.0 6.0 1 1 69 1 . . . . . 0.0 0.0 8.0 1 1 70 1 . . . . . 0.0 0.0 3.8 1 1 71 1 . . . . . 0.0 0.0 3.4 1 1 72 1 . . . . . 0.0 0.0 3.4 1 1 73 1 . . . . . 0.0 0.0 2.8 1 1 74 1 . . . . . 0.0 0.0 2.8 1 1 75 1 . . . . . 0.0 0.0 3.4 1 1 76 1 . . . . . 0.0 0.0 5.7 1 1 77 1 . . . . . 0.0 0.0 4.9 1 1 78 1 . . . . . 0.0 0.0 4.4 1 1 79 1 . . . . . 0.0 0.0 5.2 1 1 80 1 . . . . . 0.0 0.0 5.0 1 1 81 1 . . . . . 0.0 0.0 6.2 1 1 82 1 . . . . . 0.0 0.0 3.4 1 1 83 1 . . . . . 0.0 0.0 5.0 1 1 84 1 . . . . . 0.0 0.0 3.4 1 1 85 1 . . . . . 0.0 0.0 4.4 1 1 86 1 . . . . . 0.0 0.0 4.4 1 1 87 1 . . . . . 0.0 0.0 6.0 1 1 88 1 . . . . . 0.0 0.0 5.2 1 1 89 1 . . . . . 0.0 0.0 5.9 1 1 90 1 . . . . . 0.0 0.0 2.8 1 1 91 1 . . . . . 0.0 0.0 4.4 1 1 92 1 . . . . . 0.0 0.0 3.4 1 1 93 1 . . . . . 0.0 0.0 5.0 1 1 94 1 . . . . . 0.0 0.0 2.8 1 1 95 1 . . . . . 0.0 0.0 3.4 1 1 96 1 . . . . . 0.0 0.0 5.2 1 1 97 1 . . . . . 0.0 0.0 6.0 1 1 98 1 . . . . . 0.0 0.0 5.2 1 1 99 1 . . . . . 0.0 0.0 5.2 1 1 100 1 . . . . . 0.0 0.0 6.0 1 1 101 1 . . . . . 0.0 0.0 3.4 1 1 102 1 . . . . . 0.0 0.0 4.3 1 1 103 1 . . . . . 0.0 0.0 3.4 1 1 104 1 . . . . . 0.0 0.0 3.4 1 1 105 1 . . . . . 0.0 0.0 5.0 1 1 106 1 . . . . . 0.0 0.0 4.2 1 1 107 1 . . . . . 0.0 0.0 4.3 1 1 108 1 . . . . . 0.0 0.0 5.0 1 1 109 1 . . . . . 0.0 0.0 2.8 1 1 110 1 . . . . . 0.0 0.0 4.9 1 1 111 1 . . . . . 0.0 0.0 5.7 1 1 112 1 . . . . . 0.0 0.0 6.5 1 1 113 1 . . . . . 0.0 0.0 4.9 1 1 114 1 . . . . . 0.0 0.0 5.7 1 1 115 1 . . . . . 0.0 0.0 3.8 1 1 116 1 . . . . . 0.0 0.0 5.4 1 1 117 1 . . . . . 0.0 0.0 2.8 1 1 118 1 . . . . . 0.0 0.0 6.2 1 1 119 1 . . . . . 0.0 0.0 3.4 1 1 120 1 . . . . . 0.0 0.0 4.4 1 1 121 1 . . . . . 0.0 0.0 7.2 1 1 122 1 . . . . . 0.0 0.0 3.8 1 1 123 1 . . . . . 0.0 0.0 4.9 1 1 124 1 . . . . . 0.0 0.0 5.7 1 1 125 1 . . . . . 0.0 0.0 6.2 1 1 126 1 . . . . . 0.0 0.0 3.4 1 1 127 1 . . . . . 0.0 0.0 6.0 1 1 128 1 . . . . . 0.0 0.0 5.7 1 1 129 1 . . . . . 0.0 0.0 4.4 1 1 130 1 . . . . . 0.0 0.0 5.9 1 1 131 1 . . . . . 0.0 0.0 5.9 1 1 132 1 . . . . . 0.0 0.0 2.8 1 1 133 1 . . . . . 0.0 0.0 2.8 1 1 134 1 . . . . . 0.0 0.0 3.4 1 1 135 1 . . . . . 0.0 0.0 4.2 1 1 136 1 . . . . . 0.0 0.0 4.2 1 1 137 1 . . . . . 0.0 0.0 4.2 1 1 138 1 . . . . . 0.0 0.0 5.7 1 1 139 1 . . . . . 0.0 0.0 4.9 1 1 140 1 . . . . . 0.0 0.0 4.3 1 1 141 1 . . . . . 0.0 0.0 6.5 1 1 142 1 . . . . . 0.0 0.0 2.8 1 1 143 1 . . . . . 0.0 0.0 3.8 1 1 144 1 . . . . . 0.0 0.0 4.4 1 1 145 1 . . . . . 0.0 0.0 5.2 1 1 146 1 . . . . . 0.0 0.0 3.4 1 1 147 1 . . . . . 0.0 0.0 3.8 1 1 148 1 . . . . . 0.0 0.0 5.2 1 1 149 1 . . . . . 0.0 0.0 2.8 1 1 150 1 . . . . . 0.0 0.0 3.8 1 1 151 1 . . . . . 0.0 0.0 3.4 1 1 152 1 . . . . . 0.0 0.0 3.4 1 1 153 1 . . . . . 0.0 0.0 4.4 1 1 154 1 . . . . . 0.0 0.0 2.8 1 1 155 1 . . . . . 0.0 0.0 4.3 1 1 156 1 . . . . . 0.0 0.0 2.8 1 1 157 1 . . . . . 0.0 0.0 2.8 1 1 158 1 . . . . . 0.0 0.0 4.9 1 1 159 1 . . . . . 0.0 0.0 4.9 1 1 160 1 . . . . . 0.0 0.0 2.8 1 1 161 1 . . . . . 0.0 0.0 3.8 1 1 162 1 . . . . . 0.0 0.0 3.4 1 1 163 1 . . . . . 0.0 0.0 3.4 1 1 164 1 . . . . . 0.0 0.0 5.0 1 1 165 1 . . . . . 0.0 0.0 3.4 1 1 166 1 . . . . . 0.0 0.0 3.4 1 1 167 1 . . . . . 0.0 0.0 6.0 1 1 168 1 . . . . . 0.0 0.0 4.4 1 1 169 1 . . . . . 0.0 0.0 4.4 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 ASP C C -10.508 -20.810 2.683 1.00 . A A . 1 ASP C 1 1 1 2 1 1 1 ASP CA C -10.567 -20.944 4.210 1.00 . A A . 1 ASP CA 1 1 1 3 1 1 1 ASP CB C -11.370 -22.205 4.563 1.00 . A A . 1 ASP CB 1 1 1 4 1 1 1 ASP CG C -11.334 -22.420 6.085 1.00 . A A . 1 ASP CG 1 1 1 5 1 1 1 ASP H1 H -11.488 -19.081 4.036 1.00 . A A . 1 ASP H1 1 1 1 6 1 1 1 ASP H2 H -12.061 -20.017 5.331 1.00 . A A . 1 ASP H2 1 1 1 7 1 1 1 ASP H3 H -10.544 -19.259 5.435 1.00 . A A . 1 ASP H3 1 1 1 8 1 1 1 ASP HA H -9.562 -21.016 4.598 1.00 . A A . 1 ASP HA 1 1 1 9 1 1 1 ASP HB2 H -12.397 -22.097 4.244 1.00 . A A . 1 ASP HB2 1 1 1 10 1 1 1 ASP HB3 H -10.944 -23.069 4.072 1.00 . A A . 1 ASP HB3 1 1 1 11 1 1 1 ASP N N -11.214 -19.735 4.797 1.00 . A A . 1 ASP N 1 1 1 12 1 1 1 ASP O O -11.448 -20.344 2.068 1.00 . A A . 1 ASP O 1 1 1 13 1 1 1 ASP OD1 O -12.199 -21.854 6.735 1.00 . A A . 1 ASP OD1 1 1 1 14 1 1 1 ASP OD2 O -10.442 -23.135 6.514 1.00 . A A . 1 ASP OD2 1 1 1 15 1 1 2 ALA C C -9.248 -19.722 0.126 1.00 . A A . 2 ALA C 1 1 1 16 1 1 2 ALA CA C -9.168 -21.170 0.649 1.00 . A A . 2 ALA CA 1 1 1 17 1 1 2 ALA CB C -10.226 -22.066 -0.051 1.00 . A A . 2 ALA CB 1 1 1 18 1 1 2 ALA H H -8.688 -21.587 2.703 1.00 . A A . 2 ALA H 1 1 1 19 1 1 2 ALA HA H -8.181 -21.554 0.443 1.00 . A A . 2 ALA HA 1 1 1 20 1 1 2 ALA HB1 H -10.333 -22.998 0.485 1.00 . A A . 2 ALA HB1 1 1 1 21 1 1 2 ALA HB2 H -11.188 -21.575 -0.088 1.00 . A A . 2 ALA HB2 1 1 1 22 1 1 2 ALA HB3 H -9.911 -22.285 -1.060 1.00 . A A . 2 ALA HB3 1 1 1 23 1 1 2 ALA N N -9.395 -21.227 2.129 1.00 . A A . 2 ALA N 1 1 1 24 1 1 2 ALA O O -10.070 -19.383 -0.703 1.00 . A A . 2 ALA O 1 1 1 25 1 1 3 GLU C C -7.534 -17.272 -1.077 1.00 . A A . 3 GLU C 1 1 1 26 1 1 3 GLU CA C -8.299 -17.460 0.249 1.00 . A A . 3 GLU CA 1 1 1 27 1 1 3 GLU CB C -7.609 -16.687 1.408 1.00 . A A . 3 GLU CB 1 1 1 28 1 1 3 GLU CD C -9.368 -17.652 2.979 1.00 . A A . 3 GLU CD 1 1 1 29 1 1 3 GLU CG C -8.619 -16.378 2.542 1.00 . A A . 3 GLU CG 1 1 1 30 1 1 3 GLU H H -7.726 -19.250 1.305 1.00 . A A . 3 GLU H 1 1 1 31 1 1 3 GLU HA H -9.305 -17.092 0.108 1.00 . A A . 3 GLU HA 1 1 1 32 1 1 3 GLU HB2 H -6.789 -17.274 1.800 1.00 . A A . 3 GLU HB2 1 1 1 33 1 1 3 GLU HB3 H -7.213 -15.750 1.047 1.00 . A A . 3 GLU HB3 1 1 1 34 1 1 3 GLU HG2 H -8.091 -15.978 3.396 1.00 . A A . 3 GLU HG2 1 1 1 35 1 1 3 GLU HG3 H -9.331 -15.639 2.204 1.00 . A A . 3 GLU HG3 1 1 1 36 1 1 3 GLU N N -8.363 -18.907 0.643 1.00 . A A . 3 GLU N 1 1 1 37 1 1 3 GLU O O -6.824 -16.304 -1.274 1.00 . A A . 3 GLU O 1 1 1 38 1 1 3 GLU OE1 O -8.729 -18.476 3.611 1.00 . A A . 3 GLU OE1 1 1 1 39 1 1 3 GLU OE2 O -10.541 -17.727 2.650 1.00 . A A . 3 GLU OE2 1 1 1 40 1 1 4 PHE C C -7.880 -19.037 -4.283 1.00 . A A . 4 PHE C 1 1 1 41 1 1 4 PHE CA C -7.058 -18.213 -3.291 1.00 . A A . 4 PHE CA 1 1 1 42 1 1 4 PHE CB C -5.626 -18.795 -3.145 1.00 . A A . 4 PHE CB 1 1 1 43 1 1 4 PHE CD1 C -5.964 -21.284 -2.773 1.00 . A A . 4 PHE CD1 1 1 1 44 1 1 4 PHE CD2 C -5.439 -19.928 -0.882 1.00 . A A . 4 PHE CD2 1 1 1 45 1 1 4 PHE CE1 C -6.017 -22.396 -1.959 1.00 . A A . 4 PHE CE1 1 1 1 46 1 1 4 PHE CE2 C -5.490 -21.039 -0.069 1.00 . A A . 4 PHE CE2 1 1 1 47 1 1 4 PHE CG C -5.675 -20.041 -2.241 1.00 . A A . 4 PHE CG 1 1 1 48 1 1 4 PHE CZ C -5.780 -22.275 -0.607 1.00 . A A . 4 PHE CZ 1 1 1 49 1 1 4 PHE H H -8.303 -18.975 -1.724 1.00 . A A . 4 PHE H 1 1 1 50 1 1 4 PHE HA H -7.052 -17.205 -3.655 1.00 . A A . 4 PHE HA 1 1 1 51 1 1 4 PHE HB2 H -5.218 -19.070 -4.107 1.00 . A A . 4 PHE HB2 1 1 1 52 1 1 4 PHE HB3 H -4.974 -18.060 -2.694 1.00 . A A . 4 PHE HB3 1 1 1 53 1 1 4 PHE HD1 H -6.151 -21.388 -3.832 1.00 . A A . 4 PHE HD1 1 1 1 54 1 1 4 PHE HD2 H -5.212 -18.964 -0.452 1.00 . A A . 4 PHE HD2 1 1 1 55 1 1 4 PHE HE1 H -6.244 -23.363 -2.383 1.00 . A A . 4 PHE HE1 1 1 1 56 1 1 4 PHE HE2 H -5.305 -20.942 0.991 1.00 . A A . 4 PHE HE2 1 1 1 57 1 1 4 PHE HZ H -5.821 -23.146 0.029 1.00 . A A . 4 PHE HZ 1 1 1 58 1 1 4 PHE N N -7.717 -18.226 -1.951 1.00 . A A . 4 PHE N 1 1 1 59 1 1 4 PHE O O -7.426 -19.350 -5.365 1.00 . A A . 4 PHE O 1 1 1 60 1 1 5 ARG C C -10.555 -19.368 -5.890 1.00 . A A . 5 ARG C 1 1 1 61 1 1 5 ARG CA C -10.058 -20.139 -4.650 1.00 . A A . 5 ARG CA 1 1 1 62 1 1 5 ARG CB C -11.226 -20.499 -3.702 1.00 . A A . 5 ARG CB 1 1 1 63 1 1 5 ARG CD C -13.378 -21.796 -3.465 1.00 . A A . 5 ARG CD 1 1 1 64 1 1 5 ARG CG C -12.103 -21.614 -4.318 1.00 . A A . 5 ARG CG 1 1 1 65 1 1 5 ARG CZ C -14.948 -20.220 -4.517 1.00 . A A . 5 ARG CZ 1 1 1 66 1 1 5 ARG H H -9.334 -19.016 -2.969 1.00 . A A . 5 ARG H 1 1 1 67 1 1 5 ARG HA H -9.562 -21.041 -4.974 1.00 . A A . 5 ARG HA 1 1 1 68 1 1 5 ARG HB2 H -10.825 -20.847 -2.761 1.00 . A A . 5 ARG HB2 1 1 1 69 1 1 5 ARG HB3 H -11.815 -19.615 -3.506 1.00 . A A . 5 ARG HB3 1 1 1 70 1 1 5 ARG HD2 H -13.984 -22.609 -3.839 1.00 . A A . 5 ARG HD2 1 1 1 71 1 1 5 ARG HD3 H -13.115 -22.002 -2.438 1.00 . A A . 5 ARG HD3 1 1 1 72 1 1 5 ARG HE H -14.099 -19.896 -2.758 1.00 . A A . 5 ARG HE 1 1 1 73 1 1 5 ARG HG2 H -12.380 -21.364 -5.332 1.00 . A A . 5 ARG HG2 1 1 1 74 1 1 5 ARG HG3 H -11.550 -22.542 -4.331 1.00 . A A . 5 ARG HG3 1 1 1 75 1 1 5 ARG HH11 H -14.572 -21.893 -5.555 1.00 . A A . 5 ARG HH11 1 1 1 76 1 1 5 ARG HH12 H -15.668 -20.778 -6.298 1.00 . A A . 5 ARG HH12 1 1 1 77 1 1 5 ARG HH21 H -15.482 -18.483 -3.674 1.00 . A A . 5 ARG HH21 1 1 1 78 1 1 5 ARG HH22 H -16.196 -18.819 -5.215 1.00 . A A . 5 ARG HH22 1 1 1 79 1 1 5 ARG N N -9.079 -19.338 -3.855 1.00 . A A . 5 ARG N 1 1 1 80 1 1 5 ARG NE N -14.168 -20.524 -3.508 1.00 . A A . 5 ARG NE 1 1 1 81 1 1 5 ARG NH1 N -15.072 -21.027 -5.535 1.00 . A A . 5 ARG NH1 1 1 1 82 1 1 5 ARG NH2 N -15.592 -19.086 -4.465 1.00 . A A . 5 ARG NH2 1 1 1 83 1 1 5 ARG O O -11.684 -18.918 -5.958 1.00 . A A . 5 ARG O 1 1 1 84 1 1 6 HIS C C -8.694 -18.636 -9.036 1.00 . A A . 6 HIS C 1 1 1 85 1 1 6 HIS CA C -9.929 -18.538 -8.124 1.00 . A A . 6 HIS CA 1 1 1 86 1 1 6 HIS CB C -10.254 -17.032 -7.862 1.00 . A A . 6 HIS CB 1 1 1 87 1 1 6 HIS CD2 C -8.327 -16.038 -6.329 1.00 . A A . 6 HIS CD2 1 1 1 88 1 1 6 HIS CE1 C -9.372 -15.967 -4.540 1.00 . A A . 6 HIS CE1 1 1 1 89 1 1 6 HIS CG C -9.601 -16.516 -6.571 1.00 . A A . 6 HIS CG 1 1 1 90 1 1 6 HIS H H -8.777 -19.642 -6.699 1.00 . A A . 6 HIS H 1 1 1 91 1 1 6 HIS HA H -10.760 -19.021 -8.614 1.00 . A A . 6 HIS HA 1 1 1 92 1 1 6 HIS HB2 H -9.910 -16.422 -8.684 1.00 . A A . 6 HIS HB2 1 1 1 93 1 1 6 HIS HB3 H -11.324 -16.908 -7.774 1.00 . A A . 6 HIS HB3 1 1 1 94 1 1 6 HIS HD1 H -11.116 -16.714 -5.247 1.00 . A A . 6 HIS HD1 1 1 1 95 1 1 6 HIS HD2 H -7.549 -15.954 -7.069 1.00 . A A . 6 HIS HD2 1 1 1 96 1 1 6 HIS HE1 H -9.624 -15.808 -3.502 1.00 . A A . 6 HIS HE1 1 1 1 97 1 1 6 HIS N N -9.660 -19.249 -6.837 1.00 . A A . 6 HIS N 1 1 1 98 1 1 6 HIS ND1 N -10.190 -16.445 -5.422 1.00 . A A . 6 HIS ND1 1 1 1 99 1 1 6 HIS NE2 N -8.201 -15.700 -5.062 1.00 . A A . 6 HIS NE2 1 1 1 100 1 1 6 HIS O O -8.809 -18.473 -10.236 1.00 . A A . 6 HIS O 1 1 1 101 1 1 7 ASP C C -5.951 -17.719 -9.933 1.00 . A A . 7 ASP C 1 1 1 102 1 1 7 ASP CA C -6.262 -19.025 -9.185 1.00 . A A . 7 ASP CA 1 1 1 103 1 1 7 ASP CB C -6.381 -20.226 -10.171 1.00 . A A . 7 ASP CB 1 1 1 104 1 1 7 ASP CG C -4.973 -20.744 -10.517 1.00 . A A . 7 ASP CG 1 1 1 105 1 1 7 ASP H H -7.534 -19.009 -7.469 1.00 . A A . 7 ASP H 1 1 1 106 1 1 7 ASP HA H -5.474 -19.204 -8.468 1.00 . A A . 7 ASP HA 1 1 1 107 1 1 7 ASP HB2 H -6.943 -21.025 -9.710 1.00 . A A . 7 ASP HB2 1 1 1 108 1 1 7 ASP HB3 H -6.888 -19.933 -11.079 1.00 . A A . 7 ASP HB3 1 1 1 109 1 1 7 ASP N N -7.553 -18.896 -8.438 1.00 . A A . 7 ASP N 1 1 1 110 1 1 7 ASP O O -5.576 -17.712 -11.090 1.00 . A A . 7 ASP O 1 1 1 111 1 1 7 ASP OD1 O -4.473 -21.524 -9.723 1.00 . A A . 7 ASP OD1 1 1 1 112 1 1 7 ASP OD2 O -4.477 -20.331 -11.553 1.00 . A A . 7 ASP OD2 1 1 1 113 1 1 8 SER C C -4.371 -15.071 -10.042 1.00 . A A . 8 SER C 1 1 1 114 1 1 8 SER CA C -5.870 -15.287 -9.787 1.00 . A A . 8 SER CA 1 1 1 115 1 1 8 SER CB C -6.396 -14.224 -8.800 1.00 . A A . 8 SER CB 1 1 1 116 1 1 8 SER H H -6.429 -16.731 -8.287 1.00 . A A . 8 SER H 1 1 1 117 1 1 8 SER HA H -6.403 -15.226 -10.719 1.00 . A A . 8 SER HA 1 1 1 118 1 1 8 SER HB2 H -7.460 -14.321 -8.649 1.00 . A A . 8 SER HB2 1 1 1 119 1 1 8 SER HB3 H -5.879 -14.267 -7.853 1.00 . A A . 8 SER HB3 1 1 1 120 1 1 8 SER HG H -6.962 -12.524 -9.565 1.00 . A A . 8 SER HG 1 1 1 121 1 1 8 SER N N -6.126 -16.641 -9.213 1.00 . A A . 8 SER N 1 1 1 122 1 1 8 SER O O -3.990 -14.418 -10.995 1.00 . A A . 8 SER O 1 1 1 123 1 1 8 SER OG O -6.127 -12.978 -9.429 1.00 . A A . 8 SER OG 1 1 1 124 1 1 9 GLY C C -1.635 -14.244 -8.549 1.00 . A A . 9 GLY C 1 1 1 125 1 1 9 GLY CA C -2.091 -15.519 -9.267 1.00 . A A . 9 GLY CA 1 1 1 126 1 1 9 GLY H H -3.978 -16.142 -8.432 1.00 . A A . 9 GLY H 1 1 1 127 1 1 9 GLY HA2 H -1.640 -16.378 -8.794 1.00 . A A . 9 GLY HA2 1 1 1 128 1 1 9 GLY HA3 H -1.790 -15.478 -10.304 1.00 . A A . 9 GLY HA3 1 1 1 129 1 1 9 GLY N N -3.579 -15.634 -9.166 1.00 . A A . 9 GLY N 1 1 1 130 1 1 9 GLY O O -0.807 -14.290 -7.660 1.00 . A A . 9 GLY O 1 1 1 131 1 1 10 TYR C C -2.863 -10.759 -8.895 1.00 . A A . 10 TYR C 1 1 1 132 1 1 10 TYR CA C -1.872 -11.812 -8.375 1.00 . A A . 10 TYR CA 1 1 1 133 1 1 10 TYR CB C -0.423 -11.397 -8.773 1.00 . A A . 10 TYR CB 1 1 1 134 1 1 10 TYR CD1 C -0.106 -10.376 -6.420 1.00 . A A . 10 TYR CD1 1 1 1 135 1 1 10 TYR CD2 C 1.808 -11.093 -7.635 1.00 . A A . 10 TYR CD2 1 1 1 136 1 1 10 TYR CE1 C 0.704 -9.979 -5.379 1.00 . A A . 10 TYR CE1 1 1 1 137 1 1 10 TYR CE2 C 2.616 -10.694 -6.591 1.00 . A A . 10 TYR CE2 1 1 1 138 1 1 10 TYR CG C 0.436 -10.941 -7.568 1.00 . A A . 10 TYR CG 1 1 1 139 1 1 10 TYR CZ C 2.070 -10.134 -5.456 1.00 . A A . 10 TYR CZ 1 1 1 140 1 1 10 TYR H H -2.861 -13.182 -9.691 1.00 . A A . 10 TYR H 1 1 1 141 1 1 10 TYR HA H -1.992 -11.898 -7.307 1.00 . A A . 10 TYR HA 1 1 1 142 1 1 10 TYR HB2 H 0.075 -12.231 -9.245 1.00 . A A . 10 TYR HB2 1 1 1 143 1 1 10 TYR HB3 H -0.450 -10.584 -9.485 1.00 . A A . 10 TYR HB3 1 1 1 144 1 1 10 TYR HD1 H -1.170 -10.240 -6.323 1.00 . A A . 10 TYR HD1 1 1 1 145 1 1 10 TYR HD2 H 2.257 -11.529 -8.515 1.00 . A A . 10 TYR HD2 1 1 1 146 1 1 10 TYR HE1 H 0.259 -9.541 -4.497 1.00 . A A . 10 TYR HE1 1 1 1 147 1 1 10 TYR HE2 H 3.685 -10.822 -6.665 1.00 . A A . 10 TYR HE2 1 1 1 148 1 1 10 TYR HH H 3.137 -8.824 -4.571 1.00 . A A . 10 TYR HH 1 1 1 149 1 1 10 TYR N N -2.203 -13.141 -8.969 1.00 . A A . 10 TYR N 1 1 1 150 1 1 10 TYR O O -3.552 -10.973 -9.875 1.00 . A A . 10 TYR O 1 1 1 151 1 1 10 TYR OH O 2.880 -9.735 -4.413 1.00 . A A . 10 TYR OH 1 1 1 152 1 1 11 GLU C C -3.406 -7.334 -7.655 1.00 . A A . 11 GLU C 1 1 1 153 1 1 11 GLU CA C -3.787 -8.509 -8.555 1.00 . A A . 11 GLU CA 1 1 1 154 1 1 11 GLU CB C -5.272 -8.919 -8.323 1.00 . A A . 11 GLU CB 1 1 1 155 1 1 11 GLU CD C -6.143 -7.055 -9.825 1.00 . A A . 11 GLU CD 1 1 1 156 1 1 11 GLU CG C -6.213 -7.689 -8.423 1.00 . A A . 11 GLU CG 1 1 1 157 1 1 11 GLU H H -2.304 -9.557 -7.428 1.00 . A A . 11 GLU H 1 1 1 158 1 1 11 GLU HA H -3.617 -8.219 -9.582 1.00 . A A . 11 GLU HA 1 1 1 159 1 1 11 GLU HB2 H -5.567 -9.648 -9.064 1.00 . A A . 11 GLU HB2 1 1 1 160 1 1 11 GLU HB3 H -5.375 -9.367 -7.346 1.00 . A A . 11 GLU HB3 1 1 1 161 1 1 11 GLU HG2 H -7.227 -8.002 -8.228 1.00 . A A . 11 GLU HG2 1 1 1 162 1 1 11 GLU HG3 H -5.940 -6.947 -7.688 1.00 . A A . 11 GLU HG3 1 1 1 163 1 1 11 GLU N N -2.892 -9.649 -8.204 1.00 . A A . 11 GLU N 1 1 1 164 1 1 11 GLU O O -3.722 -7.304 -6.481 1.00 . A A . 11 GLU O 1 1 1 165 1 1 11 GLU OE1 O -5.266 -6.228 -10.010 1.00 . A A . 11 GLU OE1 1 1 1 166 1 1 11 GLU OE2 O -6.973 -7.431 -10.636 1.00 . A A . 11 GLU OE2 1 1 1 167 1 1 12 VAL C C -3.438 -4.192 -7.501 1.00 . A A . 12 VAL C 1 1 1 168 1 1 12 VAL CA C -2.270 -5.182 -7.547 1.00 . A A . 12 VAL CA 1 1 1 169 1 1 12 VAL CB C -1.075 -4.609 -8.313 1.00 . A A . 12 VAL CB 1 1 1 170 1 1 12 VAL CG1 C -0.674 -3.219 -7.756 1.00 . A A . 12 VAL CG1 1 1 1 171 1 1 12 VAL CG2 C 0.124 -5.576 -8.195 1.00 . A A . 12 VAL CG2 1 1 1 172 1 1 12 VAL H H -2.506 -6.502 -9.209 1.00 . A A . 12 VAL H 1 1 1 173 1 1 12 VAL HA H -1.972 -5.456 -6.560 1.00 . A A . 12 VAL HA 1 1 1 174 1 1 12 VAL HB H -1.384 -4.552 -9.340 1.00 . A A . 12 VAL HB 1 1 1 175 1 1 12 VAL HG11 H -0.440 -3.288 -6.704 1.00 . A A . 12 VAL HG11 1 1 1 176 1 1 12 VAL HG12 H 0.191 -2.838 -8.279 1.00 . A A . 12 VAL HG12 1 1 1 177 1 1 12 VAL HG13 H -1.481 -2.515 -7.884 1.00 . A A . 12 VAL HG13 1 1 1 178 1 1 12 VAL HG21 H -0.136 -6.544 -8.597 1.00 . A A . 12 VAL HG21 1 1 1 179 1 1 12 VAL HG22 H 0.967 -5.192 -8.749 1.00 . A A . 12 VAL HG22 1 1 1 180 1 1 12 VAL HG23 H 0.412 -5.695 -7.161 1.00 . A A . 12 VAL HG23 1 1 1 181 1 1 12 VAL N N -2.725 -6.402 -8.263 1.00 . A A . 12 VAL N 1 1 1 182 1 1 12 VAL O O -3.712 -3.583 -6.484 1.00 . A A . 12 VAL O 1 1 1 183 1 1 13 HIS C C -4.916 -1.723 -8.428 1.00 . A A . 13 HIS C 1 1 1 184 1 1 13 HIS CA C -5.257 -3.174 -8.819 1.00 . A A . 13 HIS CA 1 1 1 185 1 1 13 HIS CB C -6.431 -3.733 -7.954 1.00 . A A . 13 HIS CB 1 1 1 186 1 1 13 HIS CD2 C -8.973 -3.372 -8.616 1.00 . A A . 13 HIS CD2 1 1 1 187 1 1 13 HIS CE1 C -8.971 -4.414 -10.409 1.00 . A A . 13 HIS CE1 1 1 1 188 1 1 13 HIS CG C -7.694 -3.862 -8.814 1.00 . A A . 13 HIS CG 1 1 1 189 1 1 13 HIS H H -3.773 -4.623 -9.392 1.00 . A A . 13 HIS H 1 1 1 190 1 1 13 HIS HA H -5.519 -3.183 -9.866 1.00 . A A . 13 HIS HA 1 1 1 191 1 1 13 HIS HB2 H -6.185 -4.713 -7.573 1.00 . A A . 13 HIS HB2 1 1 1 192 1 1 13 HIS HB3 H -6.648 -3.089 -7.115 1.00 . A A . 13 HIS HB3 1 1 1 193 1 1 13 HIS HD1 H -7.025 -4.963 -10.373 1.00 . A A . 13 HIS HD1 1 1 1 194 1 1 13 HIS HD2 H -9.285 -2.785 -7.765 1.00 . A A . 13 HIS HD2 1 1 1 195 1 1 13 HIS HE1 H -9.289 -4.862 -11.338 1.00 . A A . 13 HIS HE1 1 1 1 196 1 1 13 HIS N N -4.082 -4.083 -8.636 1.00 . A A . 13 HIS N 1 1 1 197 1 1 13 HIS ND1 N -7.767 -4.494 -9.939 1.00 . A A . 13 HIS ND1 1 1 1 198 1 1 13 HIS NE2 N -9.755 -3.725 -9.617 1.00 . A A . 13 HIS NE2 1 1 1 199 1 1 13 HIS O O -5.762 -0.975 -7.976 1.00 . A A . 13 HIS O 1 1 1 200 1 1 14 HIS C C -1.927 0.321 -9.117 1.00 . A A . 14 HIS C 1 1 1 201 1 1 14 HIS CA C -3.182 -0.007 -8.295 1.00 . A A . 14 HIS CA 1 1 1 202 1 1 14 HIS CB C -2.869 0.060 -6.783 1.00 . A A . 14 HIS CB 1 1 1 203 1 1 14 HIS CD2 C -2.962 2.721 -6.978 1.00 . A A . 14 HIS CD2 1 1 1 204 1 1 14 HIS CE1 C -2.547 3.167 -4.997 1.00 . A A . 14 HIS CE1 1 1 1 205 1 1 14 HIS CG C -2.794 1.520 -6.305 1.00 . A A . 14 HIS CG 1 1 1 206 1 1 14 HIS H H -3.037 -2.023 -8.995 1.00 . A A . 14 HIS H 1 1 1 207 1 1 14 HIS HA H -3.962 0.690 -8.557 1.00 . A A . 14 HIS HA 1 1 1 208 1 1 14 HIS HB2 H -3.643 -0.440 -6.220 1.00 . A A . 14 HIS HB2 1 1 1 209 1 1 14 HIS HB3 H -1.926 -0.422 -6.574 1.00 . A A . 14 HIS HB3 1 1 1 210 1 1 14 HIS HD1 H -2.369 1.259 -4.346 1.00 . A A . 14 HIS HD1 1 1 1 211 1 1 14 HIS HD2 H -3.189 2.819 -8.030 1.00 . A A . 14 HIS HD2 1 1 1 212 1 1 14 HIS HE1 H -2.362 3.710 -4.082 1.00 . A A . 14 HIS HE1 1 1 1 213 1 1 14 HIS N N -3.666 -1.376 -8.624 1.00 . A A . 14 HIS N 1 1 1 214 1 1 14 HIS ND1 N -2.540 1.875 -5.089 1.00 . A A . 14 HIS ND1 1 1 1 215 1 1 14 HIS NE2 N -2.805 3.734 -6.149 1.00 . A A . 14 HIS NE2 1 1 1 216 1 1 14 HIS O O -0.864 -0.234 -8.907 1.00 . A A . 14 HIS O 1 1 1 217 1 1 15 GLN C C -0.127 2.747 -10.233 1.00 . A A . 15 GLN C 1 1 1 218 1 1 15 GLN CA C -0.983 1.673 -10.930 1.00 . A A . 15 GLN CA 1 1 1 219 1 1 15 GLN CB C -1.601 2.212 -12.238 1.00 . A A . 15 GLN CB 1 1 1 220 1 1 15 GLN CD C -2.980 1.606 -14.241 1.00 . A A . 15 GLN CD 1 1 1 221 1 1 15 GLN CG C -2.335 1.063 -12.961 1.00 . A A . 15 GLN CG 1 1 1 222 1 1 15 GLN H H -2.987 1.643 -10.148 1.00 . A A . 15 GLN H 1 1 1 223 1 1 15 GLN HA H -0.350 0.823 -11.146 1.00 . A A . 15 GLN HA 1 1 1 224 1 1 15 GLN HB2 H -2.296 3.010 -12.013 1.00 . A A . 15 GLN HB2 1 1 1 225 1 1 15 GLN HB3 H -0.823 2.602 -12.879 1.00 . A A . 15 GLN HB3 1 1 1 226 1 1 15 GLN HE21 H -4.502 2.437 -13.273 1.00 . A A . 15 GLN HE21 1 1 1 227 1 1 15 GLN HE22 H -4.517 2.637 -14.958 1.00 . A A . 15 GLN HE22 1 1 1 228 1 1 15 GLN HG2 H -1.639 0.278 -13.222 1.00 . A A . 15 GLN HG2 1 1 1 229 1 1 15 GLN HG3 H -3.109 0.649 -12.331 1.00 . A A . 15 GLN HG3 1 1 1 230 1 1 15 GLN N N -2.103 1.236 -10.039 1.00 . A A . 15 GLN N 1 1 1 231 1 1 15 GLN NE2 N -4.091 2.283 -14.150 1.00 . A A . 15 GLN NE2 1 1 1 232 1 1 15 GLN O O 0.139 3.810 -10.763 1.00 . A A . 15 GLN O 1 1 1 233 1 1 15 GLN OE1 O -2.480 1.421 -15.333 1.00 . A A . 15 GLN OE1 1 1 1 234 1 1 16 PHE C C 2.214 2.343 -7.659 1.00 . A A . 16 PHE C 1 1 1 235 1 1 16 PHE CA C 1.114 3.269 -8.169 1.00 . A A . 16 PHE CA 1 1 1 236 1 1 16 PHE CB C 0.257 3.806 -7.011 1.00 . A A . 16 PHE CB 1 1 1 237 1 1 16 PHE CD1 C 1.562 5.805 -6.151 1.00 . A A . 16 PHE CD1 1 1 1 238 1 1 16 PHE CD2 C 1.568 3.811 -4.842 1.00 . A A . 16 PHE CD2 1 1 1 239 1 1 16 PHE CE1 C 2.370 6.419 -5.217 1.00 . A A . 16 PHE CE1 1 1 1 240 1 1 16 PHE CE2 C 2.376 4.425 -3.908 1.00 . A A . 16 PHE CE2 1 1 1 241 1 1 16 PHE CG C 1.154 4.495 -5.970 1.00 . A A . 16 PHE CG 1 1 1 242 1 1 16 PHE CZ C 2.778 5.730 -4.095 1.00 . A A . 16 PHE CZ 1 1 1 243 1 1 16 PHE H H 0.007 1.526 -8.690 1.00 . A A . 16 PHE H 1 1 1 244 1 1 16 PHE HA H 1.554 4.062 -8.749 1.00 . A A . 16 PHE HA 1 1 1 245 1 1 16 PHE HB2 H -0.465 4.519 -7.381 1.00 . A A . 16 PHE HB2 1 1 1 246 1 1 16 PHE HB3 H -0.267 2.990 -6.535 1.00 . A A . 16 PHE HB3 1 1 1 247 1 1 16 PHE HD1 H 1.246 6.352 -7.027 1.00 . A A . 16 PHE HD1 1 1 1 248 1 1 16 PHE HD2 H 1.257 2.788 -4.687 1.00 . A A . 16 PHE HD2 1 1 1 249 1 1 16 PHE HE1 H 2.684 7.442 -5.365 1.00 . A A . 16 PHE HE1 1 1 1 250 1 1 16 PHE HE2 H 2.694 3.883 -3.030 1.00 . A A . 16 PHE HE2 1 1 1 251 1 1 16 PHE HZ H 3.411 6.211 -3.364 1.00 . A A . 16 PHE HZ 1 1 1 252 1 1 16 PHE N N 0.271 2.399 -9.038 1.00 . A A . 16 PHE N 1 1 1 253 1 1 16 PHE O O 3.389 2.641 -7.738 1.00 . A A . 16 PHE O 1 1 1 254 1 1 17 LEU C C 3.427 -0.354 -7.816 1.00 . A A . 17 LEU C 1 1 1 255 1 1 17 LEU CA C 2.699 0.201 -6.607 1.00 . A A . 17 LEU CA 1 1 1 256 1 1 17 LEU CB C 1.890 -0.899 -5.894 1.00 . A A . 17 LEU CB 1 1 1 257 1 1 17 LEU CD1 C -0.011 0.129 -4.564 1.00 . A A . 17 LEU CD1 1 1 1 258 1 1 17 LEU CD2 C 1.540 -1.511 -3.459 1.00 . A A . 17 LEU CD2 1 1 1 259 1 1 17 LEU CG C 1.444 -0.375 -4.500 1.00 . A A . 17 LEU CG 1 1 1 260 1 1 17 LEU H H 0.809 1.057 -7.133 1.00 . A A . 17 LEU H 1 1 1 261 1 1 17 LEU HA H 3.403 0.680 -5.952 1.00 . A A . 17 LEU HA 1 1 1 262 1 1 17 LEU HB2 H 1.032 -1.167 -6.494 1.00 . A A . 17 LEU HB2 1 1 1 263 1 1 17 LEU HB3 H 2.511 -1.777 -5.782 1.00 . A A . 17 LEU HB3 1 1 1 264 1 1 17 LEU HD11 H -0.129 0.828 -5.378 1.00 . A A . 17 LEU HD11 1 1 1 265 1 1 17 LEU HD12 H -0.691 -0.698 -4.713 1.00 . A A . 17 LEU HD12 1 1 1 266 1 1 17 LEU HD13 H -0.270 0.629 -3.642 1.00 . A A . 17 LEU HD13 1 1 1 267 1 1 17 LEU HD21 H 0.934 -2.353 -3.762 1.00 . A A . 17 LEU HD21 1 1 1 268 1 1 17 LEU HD22 H 2.565 -1.838 -3.361 1.00 . A A . 17 LEU HD22 1 1 1 269 1 1 17 LEU HD23 H 1.197 -1.164 -2.496 1.00 . A A . 17 LEU HD23 1 1 1 270 1 1 17 LEU HG H 2.083 0.442 -4.194 1.00 . A A . 17 LEU HG 1 1 1 271 1 1 17 LEU N N 1.769 1.224 -7.149 1.00 . A A . 17 LEU N 1 1 1 272 1 1 17 LEU O O 4.634 -0.489 -7.831 1.00 . A A . 17 LEU O 1 1 1 273 1 1 18 VAL C C 4.085 -0.112 -10.707 1.00 . A A . 18 VAL C 1 1 1 274 1 1 18 VAL CA C 3.229 -1.205 -10.070 1.00 . A A . 18 VAL CA 1 1 1 275 1 1 18 VAL CB C 2.049 -1.654 -10.974 1.00 . A A . 18 VAL CB 1 1 1 276 1 1 18 VAL CG1 C 2.377 -1.560 -12.484 1.00 . A A . 18 VAL CG1 1 1 1 277 1 1 18 VAL CG2 C 1.768 -3.122 -10.622 1.00 . A A . 18 VAL CG2 1 1 1 278 1 1 18 VAL H H 1.679 -0.518 -8.743 1.00 . A A . 18 VAL H 1 1 1 279 1 1 18 VAL HA H 3.866 -2.029 -9.802 1.00 . A A . 18 VAL HA 1 1 1 280 1 1 18 VAL HB H 1.181 -1.047 -10.759 1.00 . A A . 18 VAL HB 1 1 1 281 1 1 18 VAL HG11 H 3.369 -1.937 -12.684 1.00 . A A . 18 VAL HG11 1 1 1 282 1 1 18 VAL HG12 H 1.665 -2.135 -13.058 1.00 . A A . 18 VAL HG12 1 1 1 283 1 1 18 VAL HG13 H 2.316 -0.530 -12.803 1.00 . A A . 18 VAL HG13 1 1 1 284 1 1 18 VAL HG21 H 1.856 -3.265 -9.554 1.00 . A A . 18 VAL HG21 1 1 1 285 1 1 18 VAL HG22 H 0.775 -3.399 -10.936 1.00 . A A . 18 VAL HG22 1 1 1 286 1 1 18 VAL HG23 H 2.492 -3.762 -11.108 1.00 . A A . 18 VAL HG23 1 1 1 287 1 1 18 VAL N N 2.645 -0.655 -8.818 1.00 . A A . 18 VAL N 1 1 1 288 1 1 18 VAL O O 5.138 -0.388 -11.242 1.00 . A A . 18 VAL O 1 1 1 289 1 1 19 PHE C C 5.786 2.284 -10.619 1.00 . A A . 19 PHE C 1 1 1 290 1 1 19 PHE CA C 4.367 2.255 -11.204 1.00 . A A . 19 PHE CA 1 1 1 291 1 1 19 PHE CB C 3.630 3.563 -10.870 1.00 . A A . 19 PHE CB 1 1 1 292 1 1 19 PHE CD1 C 5.226 5.353 -11.705 1.00 . A A . 19 PHE CD1 1 1 1 293 1 1 19 PHE CD2 C 3.247 4.933 -12.969 1.00 . A A . 19 PHE CD2 1 1 1 294 1 1 19 PHE CE1 C 5.600 6.323 -12.610 1.00 . A A . 19 PHE CE1 1 1 1 295 1 1 19 PHE CE2 C 3.621 5.904 -13.875 1.00 . A A . 19 PHE CE2 1 1 1 296 1 1 19 PHE CG C 4.046 4.649 -11.877 1.00 . A A . 19 PHE CG 1 1 1 297 1 1 19 PHE CZ C 4.797 6.600 -13.696 1.00 . A A . 19 PHE CZ 1 1 1 298 1 1 19 PHE H H 2.754 1.237 -10.159 1.00 . A A . 19 PHE H 1 1 1 299 1 1 19 PHE HA H 4.435 2.119 -12.270 1.00 . A A . 19 PHE HA 1 1 1 300 1 1 19 PHE HB2 H 2.565 3.413 -10.936 1.00 . A A . 19 PHE HB2 1 1 1 301 1 1 19 PHE HB3 H 3.873 3.902 -9.872 1.00 . A A . 19 PHE HB3 1 1 1 302 1 1 19 PHE HD1 H 5.861 5.143 -10.857 1.00 . A A . 19 PHE HD1 1 1 1 303 1 1 19 PHE HD2 H 2.323 4.392 -13.118 1.00 . A A . 19 PHE HD2 1 1 1 304 1 1 19 PHE HE1 H 6.522 6.867 -12.469 1.00 . A A . 19 PHE HE1 1 1 1 305 1 1 19 PHE HE2 H 2.991 6.120 -14.726 1.00 . A A . 19 PHE HE2 1 1 1 306 1 1 19 PHE HZ H 5.090 7.360 -14.405 1.00 . A A . 19 PHE HZ 1 1 1 307 1 1 19 PHE N N 3.609 1.103 -10.618 1.00 . A A . 19 PHE N 1 1 1 308 1 1 19 PHE O O 6.757 2.538 -11.305 1.00 . A A . 19 PHE O 1 1 1 309 1 1 20 PHE C C 7.917 0.790 -9.082 1.00 . A A . 20 PHE C 1 1 1 310 1 1 20 PHE CA C 7.109 1.981 -8.589 1.00 . A A . 20 PHE CA 1 1 1 311 1 1 20 PHE CB C 6.758 1.863 -7.086 1.00 . A A . 20 PHE CB 1 1 1 312 1 1 20 PHE CD1 C 8.376 3.631 -6.245 1.00 . A A . 20 PHE CD1 1 1 1 313 1 1 20 PHE CD2 C 8.530 1.437 -5.324 1.00 . A A . 20 PHE CD2 1 1 1 314 1 1 20 PHE CE1 C 9.419 4.042 -5.440 1.00 . A A . 20 PHE CE1 1 1 1 315 1 1 20 PHE CE2 C 9.573 1.847 -4.519 1.00 . A A . 20 PHE CE2 1 1 1 316 1 1 20 PHE CG C 7.922 2.324 -6.194 1.00 . A A . 20 PHE CG 1 1 1 317 1 1 20 PHE CZ C 10.018 3.150 -4.577 1.00 . A A . 20 PHE CZ 1 1 1 318 1 1 20 PHE H H 5.021 1.797 -8.861 1.00 . A A . 20 PHE H 1 1 1 319 1 1 20 PHE HA H 7.655 2.884 -8.797 1.00 . A A . 20 PHE HA 1 1 1 320 1 1 20 PHE HB2 H 5.899 2.479 -6.863 1.00 . A A . 20 PHE HB2 1 1 1 321 1 1 20 PHE HB3 H 6.513 0.840 -6.837 1.00 . A A . 20 PHE HB3 1 1 1 322 1 1 20 PHE HD1 H 7.913 4.338 -6.919 1.00 . A A . 20 PHE HD1 1 1 1 323 1 1 20 PHE HD2 H 8.189 0.413 -5.271 1.00 . A A . 20 PHE HD2 1 1 1 324 1 1 20 PHE HE1 H 9.767 5.063 -5.487 1.00 . A A . 20 PHE HE1 1 1 1 325 1 1 20 PHE HE2 H 10.040 1.147 -3.843 1.00 . A A . 20 PHE HE2 1 1 1 326 1 1 20 PHE HZ H 10.834 3.471 -3.946 1.00 . A A . 20 PHE HZ 1 1 1 327 1 1 20 PHE N N 5.838 2.005 -9.345 1.00 . A A . 20 PHE N 1 1 1 328 1 1 20 PHE O O 9.059 0.934 -9.451 1.00 . A A . 20 PHE O 1 1 1 329 1 1 21 ALA C C 8.660 -1.484 -10.892 1.00 . A A . 21 ALA C 1 1 1 330 1 1 21 ALA CA C 7.957 -1.606 -9.540 1.00 . A A . 21 ALA CA 1 1 1 331 1 1 21 ALA CB C 6.885 -2.686 -9.585 1.00 . A A . 21 ALA CB 1 1 1 332 1 1 21 ALA H H 6.360 -0.385 -8.792 1.00 . A A . 21 ALA H 1 1 1 333 1 1 21 ALA HA H 8.710 -1.849 -8.812 1.00 . A A . 21 ALA HA 1 1 1 334 1 1 21 ALA HB1 H 6.310 -2.659 -8.671 1.00 . A A . 21 ALA HB1 1 1 1 335 1 1 21 ALA HB2 H 6.218 -2.506 -10.416 1.00 . A A . 21 ALA HB2 1 1 1 336 1 1 21 ALA HB3 H 7.338 -3.658 -9.694 1.00 . A A . 21 ALA HB3 1 1 1 337 1 1 21 ALA N N 7.291 -0.352 -9.088 1.00 . A A . 21 ALA N 1 1 1 338 1 1 21 ALA O O 9.813 -1.837 -11.031 1.00 . A A . 21 ALA O 1 1 1 339 1 1 22 GLU C C 9.636 0.161 -13.311 1.00 . A A . 22 GLU C 1 1 1 340 1 1 22 GLU CA C 8.431 -0.785 -13.230 1.00 . A A . 22 GLU CA 1 1 1 341 1 1 22 GLU CB C 7.289 -0.226 -14.088 1.00 . A A . 22 GLU CB 1 1 1 342 1 1 22 GLU CD C 4.858 -0.571 -14.685 1.00 . A A . 22 GLU CD 1 1 1 343 1 1 22 GLU CG C 6.125 -1.239 -14.126 1.00 . A A . 22 GLU CG 1 1 1 344 1 1 22 GLU H H 7.006 -0.731 -11.611 1.00 . A A . 22 GLU H 1 1 1 345 1 1 22 GLU HA H 8.727 -1.743 -13.621 1.00 . A A . 22 GLU HA 1 1 1 346 1 1 22 GLU HB2 H 6.954 0.712 -13.669 1.00 . A A . 22 GLU HB2 1 1 1 347 1 1 22 GLU HB3 H 7.640 -0.047 -15.095 1.00 . A A . 22 GLU HB3 1 1 1 348 1 1 22 GLU HG2 H 6.402 -2.058 -14.765 1.00 . A A . 22 GLU HG2 1 1 1 349 1 1 22 GLU HG3 H 5.908 -1.633 -13.145 1.00 . A A . 22 GLU HG3 1 1 1 350 1 1 22 GLU N N 7.922 -0.981 -11.838 1.00 . A A . 22 GLU N 1 1 1 351 1 1 22 GLU O O 10.526 -0.031 -14.117 1.00 . A A . 22 GLU O 1 1 1 352 1 1 22 GLU OE1 O 4.381 0.337 -14.023 1.00 . A A . 22 GLU OE1 1 1 1 353 1 1 22 GLU OE2 O 4.434 -1.009 -15.742 1.00 . A A . 22 GLU OE2 1 1 1 354 1 1 23 ASP C C 11.941 1.745 -11.603 1.00 . A A . 23 ASP C 1 1 1 355 1 1 23 ASP CA C 10.700 2.171 -12.402 1.00 . A A . 23 ASP CA 1 1 1 356 1 1 23 ASP CB C 10.077 3.458 -11.805 1.00 . A A . 23 ASP CB 1 1 1 357 1 1 23 ASP CG C 11.170 4.473 -11.415 1.00 . A A . 23 ASP CG 1 1 1 358 1 1 23 ASP H H 8.858 1.216 -11.842 1.00 . A A . 23 ASP H 1 1 1 359 1 1 23 ASP HA H 11.002 2.379 -13.412 1.00 . A A . 23 ASP HA 1 1 1 360 1 1 23 ASP HB2 H 9.420 3.914 -12.530 1.00 . A A . 23 ASP HB2 1 1 1 361 1 1 23 ASP HB3 H 9.495 3.212 -10.928 1.00 . A A . 23 ASP HB3 1 1 1 362 1 1 23 ASP N N 9.612 1.149 -12.458 1.00 . A A . 23 ASP N 1 1 1 363 1 1 23 ASP O O 13.057 1.787 -12.085 1.00 . A A . 23 ASP O 1 1 1 364 1 1 23 ASP OD1 O 11.624 5.157 -12.318 1.00 . A A . 23 ASP OD1 1 1 1 365 1 1 23 ASP OD2 O 11.487 4.502 -10.236 1.00 . A A . 23 ASP OD2 1 1 1 366 1 1 24 VAL C C 13.341 -0.433 -9.851 1.00 . A A . 24 VAL C 1 1 1 367 1 1 24 VAL CA C 12.706 0.896 -9.423 1.00 . A A . 24 VAL CA 1 1 1 368 1 1 24 VAL CB C 12.040 0.748 -8.032 1.00 . A A . 24 VAL CB 1 1 1 369 1 1 24 VAL CG1 C 13.121 0.675 -6.932 1.00 . A A . 24 VAL CG1 1 1 1 370 1 1 24 VAL CG2 C 11.040 1.909 -7.709 1.00 . A A . 24 VAL CG2 1 1 1 371 1 1 24 VAL H H 10.741 1.341 -10.115 1.00 . A A . 24 VAL H 1 1 1 372 1 1 24 VAL HA H 13.470 1.647 -9.351 1.00 . A A . 24 VAL HA 1 1 1 373 1 1 24 VAL HB H 11.500 -0.179 -8.044 1.00 . A A . 24 VAL HB 1 1 1 374 1 1 24 VAL HG11 H 13.733 1.565 -6.944 1.00 . A A . 24 VAL HG11 1 1 1 375 1 1 24 VAL HG12 H 12.654 0.586 -5.961 1.00 . A A . 24 VAL HG12 1 1 1 376 1 1 24 VAL HG13 H 13.754 -0.186 -7.089 1.00 . A A . 24 VAL HG13 1 1 1 377 1 1 24 VAL HG21 H 10.801 2.511 -8.572 1.00 . A A . 24 VAL HG21 1 1 1 378 1 1 24 VAL HG22 H 10.119 1.473 -7.353 1.00 . A A . 24 VAL HG22 1 1 1 379 1 1 24 VAL HG23 H 11.420 2.563 -6.940 1.00 . A A . 24 VAL HG23 1 1 1 380 1 1 24 VAL N N 11.671 1.349 -10.395 1.00 . A A . 24 VAL N 1 1 1 381 1 1 24 VAL O O 14.551 -0.558 -9.876 1.00 . A A . 24 VAL O 1 1 1 382 1 1 25 GLY C C 12.789 -2.925 -12.115 1.00 . A A . 25 GLY C 1 1 1 383 1 1 25 GLY CA C 12.962 -2.730 -10.607 1.00 . A A . 25 GLY CA 1 1 1 384 1 1 25 GLY H H 11.533 -1.200 -10.132 1.00 . A A . 25 GLY H 1 1 1 385 1 1 25 GLY HA2 H 14.002 -2.864 -10.345 1.00 . A A . 25 GLY HA2 1 1 1 386 1 1 25 GLY HA3 H 12.373 -3.477 -10.094 1.00 . A A . 25 GLY HA3 1 1 1 387 1 1 25 GLY N N 12.495 -1.378 -10.173 1.00 . A A . 25 GLY N 1 1 1 388 1 1 25 GLY O O 11.907 -2.353 -12.727 1.00 . A A . 25 GLY O 1 1 1 389 1 1 26 SER C C 12.685 -5.233 -14.403 1.00 . A A . 26 SER C 1 1 1 390 1 1 26 SER CA C 13.624 -4.045 -14.123 1.00 . A A . 26 SER CA 1 1 1 391 1 1 26 SER CB C 15.063 -4.367 -14.575 1.00 . A A . 26 SER CB 1 1 1 392 1 1 26 SER H H 14.338 -4.165 -12.111 1.00 . A A . 26 SER H 1 1 1 393 1 1 26 SER HA H 13.261 -3.178 -14.645 1.00 . A A . 26 SER HA 1 1 1 394 1 1 26 SER HB2 H 15.486 -5.185 -14.012 1.00 . A A . 26 SER HB2 1 1 1 395 1 1 26 SER HB3 H 15.112 -4.575 -15.634 1.00 . A A . 26 SER HB3 1 1 1 396 1 1 26 SER HG H 16.142 -2.842 -15.122 1.00 . A A . 26 SER HG 1 1 1 397 1 1 26 SER N N 13.653 -3.741 -12.662 1.00 . A A . 26 SER N 1 1 1 398 1 1 26 SER O O 12.911 -6.013 -15.309 1.00 . A A . 26 SER O 1 1 1 399 1 1 26 SER OG O 15.786 -3.176 -14.295 1.00 . A A . 26 SER OG 1 1 1 400 1 1 27 ASN C C 10.006 -6.403 -15.150 1.00 . A A . 27 ASN C 1 1 1 401 1 1 27 ASN CA C 10.640 -6.427 -13.752 1.00 . A A . 27 ASN CA 1 1 1 402 1 1 27 ASN CB C 9.549 -6.252 -12.664 1.00 . A A . 27 ASN CB 1 1 1 403 1 1 27 ASN CG C 8.868 -4.875 -12.769 1.00 . A A . 27 ASN CG 1 1 1 404 1 1 27 ASN H H 11.523 -4.662 -12.898 1.00 . A A . 27 ASN H 1 1 1 405 1 1 27 ASN HA H 11.143 -7.372 -13.618 1.00 . A A . 27 ASN HA 1 1 1 406 1 1 27 ASN HB2 H 8.798 -7.022 -12.769 1.00 . A A . 27 ASN HB2 1 1 1 407 1 1 27 ASN HB3 H 9.995 -6.337 -11.683 1.00 . A A . 27 ASN HB3 1 1 1 408 1 1 27 ASN HD21 H 7.034 -5.616 -12.594 1.00 . A A . 27 ASN HD21 1 1 1 409 1 1 27 ASN HD22 H 7.124 -3.930 -12.772 1.00 . A A . 27 ASN HD22 1 1 1 410 1 1 27 ASN N N 11.648 -5.327 -13.606 1.00 . A A . 27 ASN N 1 1 1 411 1 1 27 ASN ND2 N 7.566 -4.802 -12.706 1.00 . A A . 27 ASN ND2 1 1 1 412 1 1 27 ASN O O 9.714 -7.434 -15.725 1.00 . A A . 27 ASN O 1 1 1 413 1 1 27 ASN OD1 O 9.509 -3.853 -12.908 1.00 . A A . 27 ASN OD1 1 1 1 414 1 1 28 LYS C C 9.528 -3.543 -17.472 1.00 . A A . 28 LYS C 1 1 1 415 1 1 28 LYS CA C 9.219 -4.976 -16.983 1.00 . A A . 28 LYS CA 1 1 1 416 1 1 28 LYS CB C 7.687 -5.194 -16.891 1.00 . A A . 28 LYS CB 1 1 1 417 1 1 28 LYS CD C 5.736 -4.657 -15.344 1.00 . A A . 28 LYS CD 1 1 1 418 1 1 28 LYS CE C 4.542 -4.330 -16.273 1.00 . A A . 28 LYS CE 1 1 1 419 1 1 28 LYS CG C 7.057 -4.137 -15.954 1.00 . A A . 28 LYS CG 1 1 1 420 1 1 28 LYS H H 10.088 -4.434 -15.090 1.00 . A A . 28 LYS H 1 1 1 421 1 1 28 LYS HA H 9.650 -5.683 -17.678 1.00 . A A . 28 LYS HA 1 1 1 422 1 1 28 LYS HB2 H 7.252 -5.107 -17.876 1.00 . A A . 28 LYS HB2 1 1 1 423 1 1 28 LYS HB3 H 7.492 -6.190 -16.521 1.00 . A A . 28 LYS HB3 1 1 1 424 1 1 28 LYS HD2 H 5.795 -5.725 -15.185 1.00 . A A . 28 LYS HD2 1 1 1 425 1 1 28 LYS HD3 H 5.591 -4.185 -14.384 1.00 . A A . 28 LYS HD3 1 1 1 426 1 1 28 LYS HE2 H 4.812 -3.601 -17.025 1.00 . A A . 28 LYS HE2 1 1 1 427 1 1 28 LYS HE3 H 4.207 -5.228 -16.771 1.00 . A A . 28 LYS HE3 1 1 1 428 1 1 28 LYS HG2 H 7.738 -3.903 -15.150 1.00 . A A . 28 LYS HG2 1 1 1 429 1 1 28 LYS HG3 H 6.882 -3.230 -16.516 1.00 . A A . 28 LYS HG3 1 1 1 430 1 1 28 LYS HZ1 H 3.668 -3.732 -14.474 1.00 . A A . 28 LYS HZ1 1 1 1 431 1 1 28 LYS HZ2 H 3.177 -2.824 -15.820 1.00 . A A . 28 LYS HZ2 1 1 1 432 1 1 28 LYS HZ3 H 2.574 -4.394 -15.592 1.00 . A A . 28 LYS HZ3 1 1 1 433 1 1 28 LYS N N 9.823 -5.204 -15.634 1.00 . A A . 28 LYS N 1 1 1 434 1 1 28 LYS NZ N 3.406 -3.779 -15.480 1.00 . A A . 28 LYS NZ 1 1 1 435 1 1 28 LYS O O 9.517 -3.375 -18.680 1.00 . A A . 28 LYS O 1 1 1 436 1 1 28 LYS OXT O 9.756 -2.698 -16.619 1.00 . A A . 28 LYS OXT 1 1 2 437 1 1 1 ASP C C -21.971 -9.078 -20.849 1.00 . A A . 1 ASP C 1 1 2 438 1 1 1 ASP CA C -22.421 -8.691 -19.434 1.00 . A A . 1 ASP CA 1 1 2 439 1 1 1 ASP CB C -22.030 -7.223 -19.111 1.00 . A A . 1 ASP CB 1 1 2 440 1 1 1 ASP CG C -22.603 -6.273 -20.180 1.00 . A A . 1 ASP CG 1 1 2 441 1 1 1 ASP H1 H -21.156 -10.273 -18.955 1.00 . A A . 1 ASP H1 1 1 2 442 1 1 1 ASP H2 H -21.185 -9.037 -17.792 1.00 . A A . 1 ASP H2 1 1 2 443 1 1 1 ASP H3 H -22.491 -10.115 -17.919 1.00 . A A . 1 ASP H3 1 1 2 444 1 1 1 ASP HA H -23.487 -8.815 -19.363 1.00 . A A . 1 ASP HA 1 1 2 445 1 1 1 ASP HB2 H -22.427 -6.941 -18.146 1.00 . A A . 1 ASP HB2 1 1 2 446 1 1 1 ASP HB3 H -20.956 -7.121 -19.079 1.00 . A A . 1 ASP HB3 1 1 2 447 1 1 1 ASP N N -21.762 -9.596 -18.451 1.00 . A A . 1 ASP N 1 1 2 448 1 1 1 ASP O O -22.695 -9.739 -21.568 1.00 . A A . 1 ASP O 1 1 2 449 1 1 1 ASP OD1 O -23.782 -5.978 -20.071 1.00 . A A . 1 ASP OD1 1 1 2 450 1 1 1 ASP OD2 O -21.829 -5.896 -21.045 1.00 . A A . 1 ASP OD2 1 1 2 451 1 1 2 ALA C C -18.727 -8.578 -22.582 1.00 . A A . 2 ALA C 1 1 2 452 1 1 2 ALA CA C -20.213 -8.949 -22.548 1.00 . A A . 2 ALA CA 1 1 2 453 1 1 2 ALA CB C -20.971 -8.138 -23.616 1.00 . A A . 2 ALA CB 1 1 2 454 1 1 2 ALA H H -20.270 -8.123 -20.557 1.00 . A A . 2 ALA H 1 1 2 455 1 1 2 ALA HA H -20.313 -10.006 -22.744 1.00 . A A . 2 ALA HA 1 1 2 456 1 1 2 ALA HB1 H -21.312 -7.198 -23.210 1.00 . A A . 2 ALA HB1 1 1 2 457 1 1 2 ALA HB2 H -20.331 -7.935 -24.461 1.00 . A A . 2 ALA HB2 1 1 2 458 1 1 2 ALA HB3 H -21.830 -8.695 -23.957 1.00 . A A . 2 ALA HB3 1 1 2 459 1 1 2 ALA N N -20.786 -8.650 -21.199 1.00 . A A . 2 ALA N 1 1 2 460 1 1 2 ALA O O -18.317 -7.594 -21.997 1.00 . A A . 2 ALA O 1 1 2 461 1 1 3 GLU C C -16.199 -8.412 -24.718 1.00 . A A . 3 GLU C 1 1 2 462 1 1 3 GLU CA C -16.493 -9.153 -23.402 1.00 . A A . 3 GLU CA 1 1 2 463 1 1 3 GLU CB C -15.780 -10.532 -23.351 1.00 . A A . 3 GLU CB 1 1 2 464 1 1 3 GLU CD C -15.711 -12.874 -24.262 1.00 . A A . 3 GLU CD 1 1 2 465 1 1 3 GLU CG C -16.246 -11.454 -24.504 1.00 . A A . 3 GLU CG 1 1 2 466 1 1 3 GLU H H -18.374 -10.161 -23.719 1.00 . A A . 3 GLU H 1 1 2 467 1 1 3 GLU HA H -16.157 -8.536 -22.581 1.00 . A A . 3 GLU HA 1 1 2 468 1 1 3 GLU HB2 H -14.710 -10.389 -23.413 1.00 . A A . 3 GLU HB2 1 1 2 469 1 1 3 GLU HB3 H -16.001 -11.006 -22.405 1.00 . A A . 3 GLU HB3 1 1 2 470 1 1 3 GLU HG2 H -17.324 -11.490 -24.554 1.00 . A A . 3 GLU HG2 1 1 2 471 1 1 3 GLU HG3 H -15.866 -11.093 -25.449 1.00 . A A . 3 GLU HG3 1 1 2 472 1 1 3 GLU N N -17.967 -9.388 -23.275 1.00 . A A . 3 GLU N 1 1 2 473 1 1 3 GLU O O -15.169 -8.594 -25.339 1.00 . A A . 3 GLU O 1 1 2 474 1 1 3 GLU OE1 O -14.609 -13.127 -24.720 1.00 . A A . 3 GLU OE1 1 1 2 475 1 1 3 GLU OE2 O -16.436 -13.628 -23.631 1.00 . A A . 3 GLU OE2 1 1 2 476 1 1 4 PHE C C -17.861 -5.491 -26.133 1.00 . A A . 4 PHE C 1 1 2 477 1 1 4 PHE CA C -17.041 -6.772 -26.341 1.00 . A A . 4 PHE CA 1 1 2 478 1 1 4 PHE CB C -17.590 -7.614 -27.544 1.00 . A A . 4 PHE CB 1 1 2 479 1 1 4 PHE CD1 C -18.638 -9.709 -26.565 1.00 . A A . 4 PHE CD1 1 1 2 480 1 1 4 PHE CD2 C -20.102 -7.992 -27.330 1.00 . A A . 4 PHE CD2 1 1 2 481 1 1 4 PHE CE1 C -19.723 -10.475 -26.195 1.00 . A A . 4 PHE CE1 1 1 2 482 1 1 4 PHE CE2 C -21.190 -8.758 -26.960 1.00 . A A . 4 PHE CE2 1 1 2 483 1 1 4 PHE CG C -18.815 -8.461 -27.136 1.00 . A A . 4 PHE CG 1 1 2 484 1 1 4 PHE CZ C -21.001 -9.999 -26.392 1.00 . A A . 4 PHE CZ 1 1 2 485 1 1 4 PHE H H -17.939 -7.495 -24.527 1.00 . A A . 4 PHE H 1 1 2 486 1 1 4 PHE HA H -16.009 -6.494 -26.503 1.00 . A A . 4 PHE HA 1 1 2 487 1 1 4 PHE HB2 H -17.869 -6.966 -28.362 1.00 . A A . 4 PHE HB2 1 1 2 488 1 1 4 PHE HB3 H -16.815 -8.282 -27.893 1.00 . A A . 4 PHE HB3 1 1 2 489 1 1 4 PHE HD1 H -17.640 -10.088 -26.410 1.00 . A A . 4 PHE HD1 1 1 2 490 1 1 4 PHE HD2 H -20.264 -7.021 -27.776 1.00 . A A . 4 PHE HD2 1 1 2 491 1 1 4 PHE HE1 H -19.570 -11.447 -25.750 1.00 . A A . 4 PHE HE1 1 1 2 492 1 1 4 PHE HE2 H -22.191 -8.383 -27.117 1.00 . A A . 4 PHE HE2 1 1 2 493 1 1 4 PHE HZ H -21.852 -10.598 -26.102 1.00 . A A . 4 PHE HZ 1 1 2 494 1 1 4 PHE N N -17.142 -7.585 -25.090 1.00 . A A . 4 PHE N 1 1 2 495 1 1 4 PHE O O -18.839 -5.222 -26.805 1.00 . A A . 4 PHE O 1 1 2 496 1 1 5 ARG C C -17.060 -2.638 -23.934 1.00 . A A . 5 ARG C 1 1 2 497 1 1 5 ARG CA C -18.046 -3.443 -24.793 1.00 . A A . 5 ARG CA 1 1 2 498 1 1 5 ARG CB C -19.354 -3.742 -24.000 1.00 . A A . 5 ARG CB 1 1 2 499 1 1 5 ARG CD C -19.231 -4.141 -21.479 1.00 . A A . 5 ARG CD 1 1 2 500 1 1 5 ARG CG C -19.091 -4.783 -22.869 1.00 . A A . 5 ARG CG 1 1 2 501 1 1 5 ARG CZ C -18.934 -5.000 -19.198 1.00 . A A . 5 ARG CZ 1 1 2 502 1 1 5 ARG H H -16.608 -5.022 -24.677 1.00 . A A . 5 ARG H 1 1 2 503 1 1 5 ARG HA H -18.248 -2.887 -25.693 1.00 . A A . 5 ARG HA 1 1 2 504 1 1 5 ARG HB2 H -19.753 -2.825 -23.589 1.00 . A A . 5 ARG HB2 1 1 2 505 1 1 5 ARG HB3 H -20.088 -4.146 -24.681 1.00 . A A . 5 ARG HB3 1 1 2 506 1 1 5 ARG HD2 H -18.435 -3.432 -21.310 1.00 . A A . 5 ARG HD2 1 1 2 507 1 1 5 ARG HD3 H -20.186 -3.646 -21.372 1.00 . A A . 5 ARG HD3 1 1 2 508 1 1 5 ARG HE H -19.232 -6.169 -20.766 1.00 . A A . 5 ARG HE 1 1 2 509 1 1 5 ARG HG2 H -19.803 -5.587 -22.961 1.00 . A A . 5 ARG HG2 1 1 2 510 1 1 5 ARG HG3 H -18.100 -5.204 -22.949 1.00 . A A . 5 ARG HG3 1 1 2 511 1 1 5 ARG HH11 H -18.857 -3.013 -19.407 1.00 . A A . 5 ARG HH11 1 1 2 512 1 1 5 ARG HH12 H -18.651 -3.601 -17.792 1.00 . A A . 5 ARG HH12 1 1 2 513 1 1 5 ARG HH21 H -18.968 -6.947 -18.745 1.00 . A A . 5 ARG HH21 1 1 2 514 1 1 5 ARG HH22 H -18.712 -5.873 -17.410 1.00 . A A . 5 ARG HH22 1 1 2 515 1 1 5 ARG N N -17.402 -4.736 -25.170 1.00 . A A . 5 ARG N 1 1 2 516 1 1 5 ARG NE N -19.137 -5.240 -20.468 1.00 . A A . 5 ARG NE 1 1 2 517 1 1 5 ARG NH1 N -18.804 -3.776 -18.765 1.00 . A A . 5 ARG NH1 1 1 2 518 1 1 5 ARG NH2 N -18.866 -6.019 -18.387 1.00 . A A . 5 ARG NH2 1 1 2 519 1 1 5 ARG O O -17.449 -1.912 -23.038 1.00 . A A . 5 ARG O 1 1 2 520 1 1 6 HIS C C -14.829 -2.278 -21.969 1.00 . A A . 6 HIS C 1 1 2 521 1 1 6 HIS CA C -14.695 -2.096 -23.499 1.00 . A A . 6 HIS CA 1 1 2 522 1 1 6 HIS CB C -14.751 -0.589 -23.889 1.00 . A A . 6 HIS CB 1 1 2 523 1 1 6 HIS CD2 C -13.628 1.315 -22.428 1.00 . A A . 6 HIS CD2 1 1 2 524 1 1 6 HIS CE1 C -11.649 0.734 -22.637 1.00 . A A . 6 HIS CE1 1 1 2 525 1 1 6 HIS CG C -13.603 0.185 -23.228 1.00 . A A . 6 HIS CG 1 1 2 526 1 1 6 HIS H H -15.566 -3.411 -24.971 1.00 . A A . 6 HIS H 1 1 2 527 1 1 6 HIS HA H -13.751 -2.520 -23.811 1.00 . A A . 6 HIS HA 1 1 2 528 1 1 6 HIS HB2 H -14.662 -0.481 -24.961 1.00 . A A . 6 HIS HB2 1 1 2 529 1 1 6 HIS HB3 H -15.687 -0.151 -23.573 1.00 . A A . 6 HIS HB3 1 1 2 530 1 1 6 HIS HD1 H -11.987 -0.877 -23.816 1.00 . A A . 6 HIS HD1 1 1 2 531 1 1 6 HIS HD2 H -14.521 1.849 -22.139 1.00 . A A . 6 HIS HD2 1 1 2 532 1 1 6 HIS HE1 H -10.572 0.700 -22.553 1.00 . A A . 6 HIS HE1 1 1 2 533 1 1 6 HIS N N -15.794 -2.804 -24.238 1.00 . A A . 6 HIS N 1 1 2 534 1 1 6 HIS ND1 N -12.350 -0.117 -23.314 1.00 . A A . 6 HIS ND1 1 1 2 535 1 1 6 HIS NE2 N -12.402 1.643 -22.069 1.00 . A A . 6 HIS NE2 1 1 2 536 1 1 6 HIS O O -14.244 -1.547 -21.195 1.00 . A A . 6 HIS O 1 1 2 537 1 1 7 ASP C C -16.284 -2.292 -19.350 1.00 . A A . 7 ASP C 1 1 2 538 1 1 7 ASP CA C -15.827 -3.548 -20.116 1.00 . A A . 7 ASP CA 1 1 2 539 1 1 7 ASP CB C -14.508 -4.106 -19.517 1.00 . A A . 7 ASP CB 1 1 2 540 1 1 7 ASP CG C -13.977 -5.218 -20.440 1.00 . A A . 7 ASP CG 1 1 2 541 1 1 7 ASP H H -16.049 -3.822 -22.238 1.00 . A A . 7 ASP H 1 1 2 542 1 1 7 ASP HA H -16.606 -4.283 -20.042 1.00 . A A . 7 ASP HA 1 1 2 543 1 1 7 ASP HB2 H -13.766 -3.327 -19.426 1.00 . A A . 7 ASP HB2 1 1 2 544 1 1 7 ASP HB3 H -14.695 -4.522 -18.537 1.00 . A A . 7 ASP HB3 1 1 2 545 1 1 7 ASP N N -15.603 -3.259 -21.571 1.00 . A A . 7 ASP N 1 1 2 546 1 1 7 ASP O O -15.982 -2.117 -18.186 1.00 . A A . 7 ASP O 1 1 2 547 1 1 7 ASP OD1 O -14.465 -6.327 -20.294 1.00 . A A . 7 ASP OD1 1 1 2 548 1 1 7 ASP OD2 O -13.114 -4.892 -21.239 1.00 . A A . 7 ASP OD2 1 1 2 549 1 1 8 SER C C -16.454 0.734 -18.921 1.00 . A A . 8 SER C 1 1 2 550 1 1 8 SER CA C -17.552 -0.174 -19.509 1.00 . A A . 8 SER CA 1 1 2 551 1 1 8 SER CB C -18.609 -0.508 -18.419 1.00 . A A . 8 SER CB 1 1 2 552 1 1 8 SER H H -17.201 -1.678 -20.994 1.00 . A A . 8 SER H 1 1 2 553 1 1 8 SER HA H -18.026 0.361 -20.318 1.00 . A A . 8 SER HA 1 1 2 554 1 1 8 SER HB2 H -18.229 -1.188 -17.671 1.00 . A A . 8 SER HB2 1 1 2 555 1 1 8 SER HB3 H -18.984 0.386 -17.944 1.00 . A A . 8 SER HB3 1 1 2 556 1 1 8 SER HG H -19.425 -1.221 -20.052 1.00 . A A . 8 SER HG 1 1 2 557 1 1 8 SER N N -17.007 -1.458 -20.061 1.00 . A A . 8 SER N 1 1 2 558 1 1 8 SER O O -16.740 1.649 -18.172 1.00 . A A . 8 SER O 1 1 2 559 1 1 8 SER OG O -19.671 -1.134 -19.129 1.00 . A A . 8 SER OG 1 1 2 560 1 1 9 GLY C C -13.726 0.865 -17.349 1.00 . A A . 9 GLY C 1 1 2 561 1 1 9 GLY CA C -14.070 1.253 -18.788 1.00 . A A . 9 GLY CA 1 1 2 562 1 1 9 GLY H H -15.058 -0.300 -19.888 1.00 . A A . 9 GLY H 1 1 2 563 1 1 9 GLY HA2 H -13.216 1.062 -19.421 1.00 . A A . 9 GLY HA2 1 1 2 564 1 1 9 GLY HA3 H -14.314 2.306 -18.829 1.00 . A A . 9 GLY HA3 1 1 2 565 1 1 9 GLY N N -15.227 0.451 -19.283 1.00 . A A . 9 GLY N 1 1 2 566 1 1 9 GLY O O -14.232 1.453 -16.412 1.00 . A A . 9 GLY O 1 1 2 567 1 1 10 TYR C C -11.629 0.458 -15.123 1.00 . A A . 10 TYR C 1 1 2 568 1 1 10 TYR CA C -12.439 -0.614 -15.884 1.00 . A A . 10 TYR CA 1 1 2 569 1 1 10 TYR CB C -11.604 -1.911 -16.104 1.00 . A A . 10 TYR CB 1 1 2 570 1 1 10 TYR CD1 C -9.772 -0.786 -17.483 1.00 . A A . 10 TYR CD1 1 1 2 571 1 1 10 TYR CD2 C -9.122 -2.185 -15.669 1.00 . A A . 10 TYR CD2 1 1 2 572 1 1 10 TYR CE1 C -8.446 -0.533 -17.761 1.00 . A A . 10 TYR CE1 1 1 2 573 1 1 10 TYR CE2 C -7.796 -1.930 -15.951 1.00 . A A . 10 TYR CE2 1 1 2 574 1 1 10 TYR CG C -10.125 -1.615 -16.432 1.00 . A A . 10 TYR CG 1 1 2 575 1 1 10 TYR CZ C -7.450 -1.104 -16.998 1.00 . A A . 10 TYR CZ 1 1 2 576 1 1 10 TYR H H -12.519 -0.547 -18.032 1.00 . A A . 10 TYR H 1 1 2 577 1 1 10 TYR HA H -13.323 -0.852 -15.312 1.00 . A A . 10 TYR HA 1 1 2 578 1 1 10 TYR HB2 H -11.649 -2.516 -15.210 1.00 . A A . 10 TYR HB2 1 1 2 579 1 1 10 TYR HB3 H -12.024 -2.483 -16.919 1.00 . A A . 10 TYR HB3 1 1 2 580 1 1 10 TYR HD1 H -10.536 -0.329 -18.094 1.00 . A A . 10 TYR HD1 1 1 2 581 1 1 10 TYR HD2 H -9.374 -2.834 -14.844 1.00 . A A . 10 TYR HD2 1 1 2 582 1 1 10 TYR HE1 H -8.186 0.116 -18.584 1.00 . A A . 10 TYR HE1 1 1 2 583 1 1 10 TYR HE2 H -7.025 -2.385 -15.347 1.00 . A A . 10 TYR HE2 1 1 2 584 1 1 10 TYR HH H -5.804 -0.206 -16.641 1.00 . A A . 10 TYR HH 1 1 2 585 1 1 10 TYR N N -12.874 -0.123 -17.227 1.00 . A A . 10 TYR N 1 1 2 586 1 1 10 TYR O O -11.489 1.572 -15.590 1.00 . A A . 10 TYR O 1 1 2 587 1 1 10 TYR OH O -6.122 -0.850 -17.277 1.00 . A A . 10 TYR OH 1 1 2 588 1 1 11 GLU C C -9.763 0.239 -11.974 1.00 . A A . 11 GLU C 1 1 2 589 1 1 11 GLU CA C -10.317 1.036 -13.143 1.00 . A A . 11 GLU CA 1 1 2 590 1 1 11 GLU CB C -11.223 2.191 -12.619 1.00 . A A . 11 GLU CB 1 1 2 591 1 1 11 GLU CD C -11.303 4.248 -11.130 1.00 . A A . 11 GLU CD 1 1 2 592 1 1 11 GLU CG C -10.492 2.994 -11.505 1.00 . A A . 11 GLU CG 1 1 2 593 1 1 11 GLU H H -11.241 -0.825 -13.642 1.00 . A A . 11 GLU H 1 1 2 594 1 1 11 GLU HA H -9.485 1.416 -13.722 1.00 . A A . 11 GLU HA 1 1 2 595 1 1 11 GLU HB2 H -11.469 2.857 -13.432 1.00 . A A . 11 GLU HB2 1 1 2 596 1 1 11 GLU HB3 H -12.142 1.780 -12.225 1.00 . A A . 11 GLU HB3 1 1 2 597 1 1 11 GLU HG2 H -10.381 2.388 -10.618 1.00 . A A . 11 GLU HG2 1 1 2 598 1 1 11 GLU HG3 H -9.509 3.288 -11.845 1.00 . A A . 11 GLU HG3 1 1 2 599 1 1 11 GLU N N -11.117 0.089 -13.974 1.00 . A A . 11 GLU N 1 1 2 600 1 1 11 GLU O O -10.488 -0.224 -11.113 1.00 . A A . 11 GLU O 1 1 2 601 1 1 11 GLU OE1 O -12.408 4.061 -10.647 1.00 . A A . 11 GLU OE1 1 1 2 602 1 1 11 GLU OE2 O -10.772 5.324 -11.345 1.00 . A A . 11 GLU OE2 1 1 2 603 1 1 12 VAL C C -7.784 0.210 -9.659 1.00 . A A . 12 VAL C 1 1 2 604 1 1 12 VAL CA C -7.741 -0.627 -10.948 1.00 . A A . 12 VAL CA 1 1 2 605 1 1 12 VAL CB C -6.325 -0.837 -11.454 1.00 . A A . 12 VAL CB 1 1 2 606 1 1 12 VAL CG1 C -5.496 -1.606 -10.410 1.00 . A A . 12 VAL CG1 1 1 2 607 1 1 12 VAL CG2 C -6.375 -1.635 -12.780 1.00 . A A . 12 VAL CG2 1 1 2 608 1 1 12 VAL H H -7.961 0.515 -12.738 1.00 . A A . 12 VAL H 1 1 2 609 1 1 12 VAL HA H -8.220 -1.572 -10.796 1.00 . A A . 12 VAL HA 1 1 2 610 1 1 12 VAL HB H -5.929 0.142 -11.646 1.00 . A A . 12 VAL HB 1 1 2 611 1 1 12 VAL HG11 H -6.013 -2.508 -10.117 1.00 . A A . 12 VAL HG11 1 1 2 612 1 1 12 VAL HG12 H -4.533 -1.871 -10.822 1.00 . A A . 12 VAL HG12 1 1 2 613 1 1 12 VAL HG13 H -5.344 -0.990 -9.537 1.00 . A A . 12 VAL HG13 1 1 2 614 1 1 12 VAL HG21 H -7.022 -2.495 -12.684 1.00 . A A . 12 VAL HG21 1 1 2 615 1 1 12 VAL HG22 H -6.761 -1.003 -13.566 1.00 . A A . 12 VAL HG22 1 1 2 616 1 1 12 VAL HG23 H -5.388 -1.969 -13.063 1.00 . A A . 12 VAL HG23 1 1 2 617 1 1 12 VAL N N -8.468 0.115 -12.004 1.00 . A A . 12 VAL N 1 1 2 618 1 1 12 VAL O O -7.848 -0.319 -8.566 1.00 . A A . 12 VAL O 1 1 2 619 1 1 13 HIS C C -6.524 2.542 -7.877 1.00 . A A . 13 HIS C 1 1 2 620 1 1 13 HIS CA C -7.780 2.523 -8.766 1.00 . A A . 13 HIS CA 1 1 2 621 1 1 13 HIS CB C -9.036 2.265 -7.882 1.00 . A A . 13 HIS CB 1 1 2 622 1 1 13 HIS CD2 C -9.366 4.593 -6.655 1.00 . A A . 13 HIS CD2 1 1 2 623 1 1 13 HIS CE1 C -11.088 5.200 -7.639 1.00 . A A . 13 HIS CE1 1 1 2 624 1 1 13 HIS CG C -9.706 3.602 -7.560 1.00 . A A . 13 HIS CG 1 1 2 625 1 1 13 HIS H H -7.695 1.819 -10.792 1.00 . A A . 13 HIS H 1 1 2 626 1 1 13 HIS HA H -7.863 3.492 -9.236 1.00 . A A . 13 HIS HA 1 1 2 627 1 1 13 HIS HB2 H -9.749 1.647 -8.406 1.00 . A A . 13 HIS HB2 1 1 2 628 1 1 13 HIS HB3 H -8.773 1.776 -6.956 1.00 . A A . 13 HIS HB3 1 1 2 629 1 1 13 HIS HD1 H -11.278 3.574 -8.828 1.00 . A A . 13 HIS HD1 1 1 2 630 1 1 13 HIS HD2 H -8.512 4.562 -5.995 1.00 . A A . 13 HIS HD2 1 1 2 631 1 1 13 HIS HE1 H -11.945 5.780 -7.951 1.00 . A A . 13 HIS HE1 1 1 2 632 1 1 13 HIS N N -7.747 1.504 -9.865 1.00 . A A . 13 HIS N 1 1 2 633 1 1 13 HIS ND1 N -10.778 4.044 -8.129 1.00 . A A . 13 HIS ND1 1 1 2 634 1 1 13 HIS NE2 N -10.236 5.582 -6.718 1.00 . A A . 13 HIS NE2 1 1 2 635 1 1 13 HIS O O -6.290 3.521 -7.195 1.00 . A A . 13 HIS O 1 1 2 636 1 1 14 HIS C C -3.473 0.552 -7.831 1.00 . A A . 14 HIS C 1 1 2 637 1 1 14 HIS CA C -4.514 1.392 -7.085 1.00 . A A . 14 HIS CA 1 1 2 638 1 1 14 HIS CB C -4.850 0.740 -5.720 1.00 . A A . 14 HIS CB 1 1 2 639 1 1 14 HIS CD2 C -5.718 2.701 -4.156 1.00 . A A . 14 HIS CD2 1 1 2 640 1 1 14 HIS CE1 C -7.749 2.306 -4.289 1.00 . A A . 14 HIS CE1 1 1 2 641 1 1 14 HIS CG C -5.879 1.599 -4.978 1.00 . A A . 14 HIS CG 1 1 2 642 1 1 14 HIS H H -5.985 0.723 -8.475 1.00 . A A . 14 HIS H 1 1 2 643 1 1 14 HIS HA H -4.119 2.383 -6.957 1.00 . A A . 14 HIS HA 1 1 2 644 1 1 14 HIS HB2 H -5.268 -0.246 -5.867 1.00 . A A . 14 HIS HB2 1 1 2 645 1 1 14 HIS HB3 H -3.962 0.657 -5.111 1.00 . A A . 14 HIS HB3 1 1 2 646 1 1 14 HIS HD1 H -7.608 0.703 -5.518 1.00 . A A . 14 HIS HD1 1 1 2 647 1 1 14 HIS HD2 H -4.770 3.147 -3.894 1.00 . A A . 14 HIS HD2 1 1 2 648 1 1 14 HIS HE1 H -8.819 2.367 -4.156 1.00 . A A . 14 HIS HE1 1 1 2 649 1 1 14 HIS N N -5.756 1.480 -7.906 1.00 . A A . 14 HIS N 1 1 2 650 1 1 14 HIS ND1 N -7.157 1.413 -5.016 1.00 . A A . 14 HIS ND1 1 1 2 651 1 1 14 HIS NE2 N -6.892 3.128 -3.736 1.00 . A A . 14 HIS NE2 1 1 2 652 1 1 14 HIS O O -3.448 -0.660 -7.732 1.00 . A A . 14 HIS O 1 1 2 653 1 1 15 GLN C C -0.250 1.353 -9.241 1.00 . A A . 15 GLN C 1 1 2 654 1 1 15 GLN CA C -1.561 0.583 -9.357 1.00 . A A . 15 GLN CA 1 1 2 655 1 1 15 GLN CB C -2.026 0.497 -10.836 1.00 . A A . 15 GLN CB 1 1 2 656 1 1 15 GLN CD C -0.961 2.571 -11.849 1.00 . A A . 15 GLN CD 1 1 2 657 1 1 15 GLN CG C -2.286 1.906 -11.444 1.00 . A A . 15 GLN CG 1 1 2 658 1 1 15 GLN H H -2.727 2.222 -8.595 1.00 . A A . 15 GLN H 1 1 2 659 1 1 15 GLN HA H -1.372 -0.389 -8.943 1.00 . A A . 15 GLN HA 1 1 2 660 1 1 15 GLN HB2 H -1.286 -0.031 -11.418 1.00 . A A . 15 GLN HB2 1 1 2 661 1 1 15 GLN HB3 H -2.946 -0.067 -10.872 1.00 . A A . 15 GLN HB3 1 1 2 662 1 1 15 GLN HE21 H -0.496 1.158 -13.165 1.00 . A A . 15 GLN HE21 1 1 2 663 1 1 15 GLN HE22 H 0.637 2.414 -13.018 1.00 . A A . 15 GLN HE22 1 1 2 664 1 1 15 GLN HG2 H -2.904 1.813 -12.325 1.00 . A A . 15 GLN HG2 1 1 2 665 1 1 15 GLN HG3 H -2.794 2.543 -10.734 1.00 . A A . 15 GLN HG3 1 1 2 666 1 1 15 GLN N N -2.641 1.246 -8.564 1.00 . A A . 15 GLN N 1 1 2 667 1 1 15 GLN NE2 N -0.211 2.000 -12.753 1.00 . A A . 15 GLN NE2 1 1 2 668 1 1 15 GLN O O 0.704 1.100 -9.946 1.00 . A A . 15 GLN O 1 1 2 669 1 1 15 GLN OE1 O -0.594 3.615 -11.347 1.00 . A A . 15 GLN OE1 1 1 2 670 1 1 16 PHE C C 2.142 2.247 -7.617 1.00 . A A . 16 PHE C 1 1 2 671 1 1 16 PHE CA C 0.975 3.119 -8.100 1.00 . A A . 16 PHE CA 1 1 2 672 1 1 16 PHE CB C 0.646 4.198 -7.054 1.00 . A A . 16 PHE CB 1 1 2 673 1 1 16 PHE CD1 C -1.187 3.214 -5.589 1.00 . A A . 16 PHE CD1 1 1 2 674 1 1 16 PHE CD2 C 1.016 3.360 -4.687 1.00 . A A . 16 PHE CD2 1 1 2 675 1 1 16 PHE CE1 C -1.633 2.657 -4.411 1.00 . A A . 16 PHE CE1 1 1 2 676 1 1 16 PHE CE2 C 0.568 2.802 -3.508 1.00 . A A . 16 PHE CE2 1 1 2 677 1 1 16 PHE CG C 0.143 3.573 -5.739 1.00 . A A . 16 PHE CG 1 1 2 678 1 1 16 PHE CZ C -0.755 2.450 -3.368 1.00 . A A . 16 PHE CZ 1 1 2 679 1 1 16 PHE H H -1.057 2.398 -7.802 1.00 . A A . 16 PHE H 1 1 2 680 1 1 16 PHE HA H 1.252 3.590 -9.032 1.00 . A A . 16 PHE HA 1 1 2 681 1 1 16 PHE HB2 H 1.533 4.782 -6.854 1.00 . A A . 16 PHE HB2 1 1 2 682 1 1 16 PHE HB3 H -0.117 4.851 -7.449 1.00 . A A . 16 PHE HB3 1 1 2 683 1 1 16 PHE HD1 H -1.884 3.374 -6.399 1.00 . A A . 16 PHE HD1 1 1 2 684 1 1 16 PHE HD2 H 2.056 3.634 -4.787 1.00 . A A . 16 PHE HD2 1 1 2 685 1 1 16 PHE HE1 H -2.671 2.380 -4.303 1.00 . A A . 16 PHE HE1 1 1 2 686 1 1 16 PHE HE2 H 1.258 2.641 -2.692 1.00 . A A . 16 PHE HE2 1 1 2 687 1 1 16 PHE HZ H -1.105 2.012 -2.445 1.00 . A A . 16 PHE HZ 1 1 2 688 1 1 16 PHE N N -0.242 2.280 -8.330 1.00 . A A . 16 PHE N 1 1 2 689 1 1 16 PHE O O 3.295 2.604 -7.756 1.00 . A A . 16 PHE O 1 1 2 690 1 1 17 LEU C C 3.538 -0.382 -7.755 1.00 . A A . 17 LEU C 1 1 2 691 1 1 17 LEU CA C 2.780 0.142 -6.543 1.00 . A A . 17 LEU CA 1 1 2 692 1 1 17 LEU CB C 2.049 -1.018 -5.831 1.00 . A A . 17 LEU CB 1 1 2 693 1 1 17 LEU CD1 C -0.410 -0.569 -5.314 1.00 . A A . 17 LEU CD1 1 1 2 694 1 1 17 LEU CD2 C 1.153 -1.279 -3.471 1.00 . A A . 17 LEU CD2 1 1 2 695 1 1 17 LEU CG C 1.041 -0.464 -4.776 1.00 . A A . 17 LEU CG 1 1 2 696 1 1 17 LEU H H 0.837 0.890 -6.998 1.00 . A A . 17 LEU H 1 1 2 697 1 1 17 LEU HA H 3.457 0.653 -5.881 1.00 . A A . 17 LEU HA 1 1 2 698 1 1 17 LEU HB2 H 1.529 -1.615 -6.567 1.00 . A A . 17 LEU HB2 1 1 2 699 1 1 17 LEU HB3 H 2.789 -1.645 -5.355 1.00 . A A . 17 LEU HB3 1 1 2 700 1 1 17 LEU HD11 H -0.625 -1.581 -5.623 1.00 . A A . 17 LEU HD11 1 1 2 701 1 1 17 LEU HD12 H -1.111 -0.289 -4.541 1.00 . A A . 17 LEU HD12 1 1 2 702 1 1 17 LEU HD13 H -0.554 0.089 -6.157 1.00 . A A . 17 LEU HD13 1 1 2 703 1 1 17 LEU HD21 H 0.939 -2.322 -3.657 1.00 . A A . 17 LEU HD21 1 1 2 704 1 1 17 LEU HD22 H 2.151 -1.195 -3.067 1.00 . A A . 17 LEU HD22 1 1 2 705 1 1 17 LEU HD23 H 0.452 -0.904 -2.738 1.00 . A A . 17 LEU HD23 1 1 2 706 1 1 17 LEU HG H 1.267 0.568 -4.559 1.00 . A A . 17 LEU HG 1 1 2 707 1 1 17 LEU N N 1.783 1.114 -7.067 1.00 . A A . 17 LEU N 1 1 2 708 1 1 17 LEU O O 4.746 -0.482 -7.769 1.00 . A A . 17 LEU O 1 1 2 709 1 1 18 VAL C C 4.088 -0.099 -10.727 1.00 . A A . 18 VAL C 1 1 2 710 1 1 18 VAL CA C 3.323 -1.221 -10.028 1.00 . A A . 18 VAL CA 1 1 2 711 1 1 18 VAL CB C 2.130 -1.745 -10.859 1.00 . A A . 18 VAL CB 1 1 2 712 1 1 18 VAL CG1 C 2.551 -2.139 -12.286 1.00 . A A . 18 VAL CG1 1 1 2 713 1 1 18 VAL CG2 C 1.605 -2.992 -10.133 1.00 . A A . 18 VAL CG2 1 1 2 714 1 1 18 VAL H H 1.795 -0.572 -8.659 1.00 . A A . 18 VAL H 1 1 2 715 1 1 18 VAL HA H 4.006 -2.011 -9.782 1.00 . A A . 18 VAL HA 1 1 2 716 1 1 18 VAL HB H 1.349 -1.002 -10.910 1.00 . A A . 18 VAL HB 1 1 2 717 1 1 18 VAL HG11 H 3.003 -1.300 -12.793 1.00 . A A . 18 VAL HG11 1 1 2 718 1 1 18 VAL HG12 H 3.251 -2.960 -12.256 1.00 . A A . 18 VAL HG12 1 1 2 719 1 1 18 VAL HG13 H 1.679 -2.447 -12.845 1.00 . A A . 18 VAL HG13 1 1 2 720 1 1 18 VAL HG21 H 2.404 -3.712 -10.019 1.00 . A A . 18 VAL HG21 1 1 2 721 1 1 18 VAL HG22 H 1.248 -2.718 -9.151 1.00 . A A . 18 VAL HG22 1 1 2 722 1 1 18 VAL HG23 H 0.799 -3.441 -10.691 1.00 . A A . 18 VAL HG23 1 1 2 723 1 1 18 VAL N N 2.762 -0.693 -8.756 1.00 . A A . 18 VAL N 1 1 2 724 1 1 18 VAL O O 5.202 -0.290 -11.172 1.00 . A A . 18 VAL O 1 1 2 725 1 1 19 PHE C C 5.470 2.487 -10.869 1.00 . A A . 19 PHE C 1 1 2 726 1 1 19 PHE CA C 4.061 2.244 -11.436 1.00 . A A . 19 PHE CA 1 1 2 727 1 1 19 PHE CB C 3.149 3.451 -11.159 1.00 . A A . 19 PHE CB 1 1 2 728 1 1 19 PHE CD1 C 4.366 5.514 -11.994 1.00 . A A . 19 PHE CD1 1 1 2 729 1 1 19 PHE CD2 C 2.674 4.568 -13.383 1.00 . A A . 19 PHE CD2 1 1 2 730 1 1 19 PHE CE1 C 4.594 6.493 -12.938 1.00 . A A . 19 PHE CE1 1 1 2 731 1 1 19 PHE CE2 C 2.903 5.547 -14.328 1.00 . A A . 19 PHE CE2 1 1 2 732 1 1 19 PHE CG C 3.404 4.543 -12.208 1.00 . A A . 19 PHE CG 1 1 2 733 1 1 19 PHE CZ C 3.863 6.510 -14.106 1.00 . A A . 19 PHE CZ 1 1 2 734 1 1 19 PHE H H 2.558 1.093 -10.403 1.00 . A A . 19 PHE H 1 1 2 735 1 1 19 PHE HA H 4.142 2.056 -12.495 1.00 . A A . 19 PHE HA 1 1 2 736 1 1 19 PHE HB2 H 2.111 3.153 -11.212 1.00 . A A . 19 PHE HB2 1 1 2 737 1 1 19 PHE HB3 H 3.341 3.856 -10.175 1.00 . A A . 19 PHE HB3 1 1 2 738 1 1 19 PHE HD1 H 4.944 5.507 -11.081 1.00 . A A . 19 PHE HD1 1 1 2 739 1 1 19 PHE HD2 H 1.919 3.818 -13.566 1.00 . A A . 19 PHE HD2 1 1 2 740 1 1 19 PHE HE1 H 5.348 7.246 -12.762 1.00 . A A . 19 PHE HE1 1 1 2 741 1 1 19 PHE HE2 H 2.328 5.560 -15.243 1.00 . A A . 19 PHE HE2 1 1 2 742 1 1 19 PHE HZ H 4.042 7.277 -14.846 1.00 . A A . 19 PHE HZ 1 1 2 743 1 1 19 PHE N N 3.454 1.040 -10.789 1.00 . A A . 19 PHE N 1 1 2 744 1 1 19 PHE O O 6.340 3.004 -11.544 1.00 . A A . 19 PHE O 1 1 2 745 1 1 20 PHE C C 7.804 1.052 -9.299 1.00 . A A . 20 PHE C 1 1 2 746 1 1 20 PHE CA C 6.928 2.241 -8.929 1.00 . A A . 20 PHE CA 1 1 2 747 1 1 20 PHE CB C 6.652 2.287 -7.409 1.00 . A A . 20 PHE CB 1 1 2 748 1 1 20 PHE CD1 C 8.764 3.600 -6.850 1.00 . A A . 20 PHE CD1 1 1 2 749 1 1 20 PHE CD2 C 8.293 1.640 -5.579 1.00 . A A . 20 PHE CD2 1 1 2 750 1 1 20 PHE CE1 C 9.910 3.806 -6.110 1.00 . A A . 20 PHE CE1 1 1 2 751 1 1 20 PHE CE2 C 9.440 1.846 -4.839 1.00 . A A . 20 PHE CE2 1 1 2 752 1 1 20 PHE CG C 7.943 2.516 -6.594 1.00 . A A . 20 PHE CG 1 1 2 753 1 1 20 PHE CZ C 10.248 2.929 -5.104 1.00 . A A . 20 PHE CZ 1 1 2 754 1 1 20 PHE H H 4.895 1.675 -9.150 1.00 . A A . 20 PHE H 1 1 2 755 1 1 20 PHE HA H 7.408 3.143 -9.262 1.00 . A A . 20 PHE HA 1 1 2 756 1 1 20 PHE HB2 H 5.969 3.095 -7.194 1.00 . A A . 20 PHE HB2 1 1 2 757 1 1 20 PHE HB3 H 6.196 1.363 -7.088 1.00 . A A . 20 PHE HB3 1 1 2 758 1 1 20 PHE HD1 H 8.513 4.295 -7.637 1.00 . A A . 20 PHE HD1 1 1 2 759 1 1 20 PHE HD2 H 7.672 0.783 -5.362 1.00 . A A . 20 PHE HD2 1 1 2 760 1 1 20 PHE HE1 H 10.541 4.655 -6.321 1.00 . A A . 20 PHE HE1 1 1 2 761 1 1 20 PHE HE2 H 9.703 1.156 -4.051 1.00 . A A . 20 PHE HE2 1 1 2 762 1 1 20 PHE HZ H 11.145 3.091 -4.525 1.00 . A A . 20 PHE HZ 1 1 2 763 1 1 20 PHE N N 5.635 2.088 -9.633 1.00 . A A . 20 PHE N 1 1 2 764 1 1 20 PHE O O 8.927 1.234 -9.708 1.00 . A A . 20 PHE O 1 1 2 765 1 1 21 ALA C C 8.753 -1.314 -10.814 1.00 . A A . 21 ALA C 1 1 2 766 1 1 21 ALA CA C 8.019 -1.384 -9.484 1.00 . A A . 21 ALA CA 1 1 2 767 1 1 21 ALA CB C 7.048 -2.559 -9.512 1.00 . A A . 21 ALA CB 1 1 2 768 1 1 21 ALA H H 6.343 -0.201 -8.844 1.00 . A A . 21 ALA H 1 1 2 769 1 1 21 ALA HA H 8.750 -1.542 -8.711 1.00 . A A . 21 ALA HA 1 1 2 770 1 1 21 ALA HB1 H 6.492 -2.596 -8.588 1.00 . A A . 21 ALA HB1 1 1 2 771 1 1 21 ALA HB2 H 6.361 -2.453 -10.338 1.00 . A A . 21 ALA HB2 1 1 2 772 1 1 21 ALA HB3 H 7.600 -3.480 -9.630 1.00 . A A . 21 ALA HB3 1 1 2 773 1 1 21 ALA N N 7.264 -0.132 -9.161 1.00 . A A . 21 ALA N 1 1 2 774 1 1 21 ALA O O 9.917 -1.640 -10.894 1.00 . A A . 21 ALA O 1 1 2 775 1 1 22 GLU C C 9.867 0.142 -13.192 1.00 . A A . 22 GLU C 1 1 2 776 1 1 22 GLU CA C 8.625 -0.757 -13.179 1.00 . A A . 22 GLU CA 1 1 2 777 1 1 22 GLU CB C 7.529 -0.198 -14.119 1.00 . A A . 22 GLU CB 1 1 2 778 1 1 22 GLU CD C 6.470 -2.515 -13.853 1.00 . A A . 22 GLU CD 1 1 2 779 1 1 22 GLU CG C 6.770 -1.355 -14.829 1.00 . A A . 22 GLU CG 1 1 2 780 1 1 22 GLU H H 7.109 -0.636 -11.629 1.00 . A A . 22 GLU H 1 1 2 781 1 1 22 GLU HA H 8.929 -1.740 -13.492 1.00 . A A . 22 GLU HA 1 1 2 782 1 1 22 GLU HB2 H 6.827 0.396 -13.553 1.00 . A A . 22 GLU HB2 1 1 2 783 1 1 22 GLU HB3 H 7.975 0.436 -14.872 1.00 . A A . 22 GLU HB3 1 1 2 784 1 1 22 GLU HG2 H 5.835 -0.985 -15.223 1.00 . A A . 22 GLU HG2 1 1 2 785 1 1 22 GLU HG3 H 7.363 -1.724 -15.654 1.00 . A A . 22 GLU HG3 1 1 2 786 1 1 22 GLU N N 8.039 -0.879 -11.810 1.00 . A A . 22 GLU N 1 1 2 787 1 1 22 GLU O O 10.821 -0.122 -13.897 1.00 . A A . 22 GLU O 1 1 2 788 1 1 22 GLU OE1 O 5.634 -2.300 -12.993 1.00 . A A . 22 GLU OE1 1 1 2 789 1 1 22 GLU OE2 O 7.094 -3.550 -14.020 1.00 . A A . 22 GLU OE2 1 1 2 790 1 1 23 ASP C C 12.076 1.543 -11.457 1.00 . A A . 23 ASP C 1 1 2 791 1 1 23 ASP CA C 10.930 2.147 -12.290 1.00 . A A . 23 ASP CA 1 1 2 792 1 1 23 ASP CB C 10.341 3.458 -11.662 1.00 . A A . 23 ASP CB 1 1 2 793 1 1 23 ASP CG C 11.080 3.906 -10.385 1.00 . A A . 23 ASP CG 1 1 2 794 1 1 23 ASP H H 8.999 1.304 -11.858 1.00 . A A . 23 ASP H 1 1 2 795 1 1 23 ASP HA H 11.288 2.351 -13.283 1.00 . A A . 23 ASP HA 1 1 2 796 1 1 23 ASP HB2 H 10.405 4.255 -12.389 1.00 . A A . 23 ASP HB2 1 1 2 797 1 1 23 ASP HB3 H 9.294 3.315 -11.426 1.00 . A A . 23 ASP HB3 1 1 2 798 1 1 23 ASP N N 9.805 1.175 -12.395 1.00 . A A . 23 ASP N 1 1 2 799 1 1 23 ASP O O 13.229 1.613 -11.833 1.00 . A A . 23 ASP O 1 1 2 800 1 1 23 ASP OD1 O 12.155 4.462 -10.540 1.00 . A A . 23 ASP OD1 1 1 2 801 1 1 23 ASP OD2 O 10.525 3.662 -9.327 1.00 . A A . 23 ASP OD2 1 1 2 802 1 1 24 VAL C C 13.479 -0.736 -10.140 1.00 . A A . 24 VAL C 1 1 2 803 1 1 24 VAL CA C 12.648 0.323 -9.394 1.00 . A A . 24 VAL CA 1 1 2 804 1 1 24 VAL CB C 11.857 -0.348 -8.238 1.00 . A A . 24 VAL CB 1 1 2 805 1 1 24 VAL CG1 C 12.819 -0.718 -7.092 1.00 . A A . 24 VAL CG1 1 1 2 806 1 1 24 VAL CG2 C 10.741 0.566 -7.660 1.00 . A A . 24 VAL CG2 1 1 2 807 1 1 24 VAL H H 10.740 0.983 -10.145 1.00 . A A . 24 VAL H 1 1 2 808 1 1 24 VAL HA H 13.300 1.068 -8.982 1.00 . A A . 24 VAL HA 1 1 2 809 1 1 24 VAL HB H 11.417 -1.244 -8.629 1.00 . A A . 24 VAL HB 1 1 2 810 1 1 24 VAL HG11 H 13.582 -1.395 -7.443 1.00 . A A . 24 VAL HG11 1 1 2 811 1 1 24 VAL HG12 H 13.288 0.174 -6.700 1.00 . A A . 24 VAL HG12 1 1 2 812 1 1 24 VAL HG13 H 12.269 -1.196 -6.294 1.00 . A A . 24 VAL HG13 1 1 2 813 1 1 24 VAL HG21 H 10.715 1.524 -8.149 1.00 . A A . 24 VAL HG21 1 1 2 814 1 1 24 VAL HG22 H 9.779 0.091 -7.779 1.00 . A A . 24 VAL HG22 1 1 2 815 1 1 24 VAL HG23 H 10.889 0.735 -6.607 1.00 . A A . 24 VAL HG23 1 1 2 816 1 1 24 VAL N N 11.692 0.972 -10.346 1.00 . A A . 24 VAL N 1 1 2 817 1 1 24 VAL O O 14.694 -0.727 -10.090 1.00 . A A . 24 VAL O 1 1 2 818 1 1 25 GLY C C 12.322 -3.601 -12.166 1.00 . A A . 25 GLY C 1 1 2 819 1 1 25 GLY CA C 13.418 -2.704 -11.590 1.00 . A A . 25 GLY CA 1 1 2 820 1 1 25 GLY H H 11.798 -1.557 -10.799 1.00 . A A . 25 GLY H 1 1 2 821 1 1 25 GLY HA2 H 13.994 -2.273 -12.395 1.00 . A A . 25 GLY HA2 1 1 2 822 1 1 25 GLY HA3 H 14.060 -3.282 -10.941 1.00 . A A . 25 GLY HA3 1 1 2 823 1 1 25 GLY N N 12.774 -1.612 -10.809 1.00 . A A . 25 GLY N 1 1 2 824 1 1 25 GLY O O 12.055 -4.660 -11.632 1.00 . A A . 25 GLY O 1 1 2 825 1 1 26 SER C C 10.950 -5.386 -14.114 1.00 . A A . 26 SER C 1 1 2 826 1 1 26 SER CA C 10.624 -3.895 -13.933 1.00 . A A . 26 SER CA 1 1 2 827 1 1 26 SER CB C 10.381 -3.250 -15.310 1.00 . A A . 26 SER CB 1 1 2 828 1 1 26 SER H H 11.998 -2.272 -13.601 1.00 . A A . 26 SER H 1 1 2 829 1 1 26 SER HA H 9.734 -3.818 -13.328 1.00 . A A . 26 SER HA 1 1 2 830 1 1 26 SER HB2 H 10.167 -2.195 -15.232 1.00 . A A . 26 SER HB2 1 1 2 831 1 1 26 SER HB3 H 11.220 -3.405 -15.974 1.00 . A A . 26 SER HB3 1 1 2 832 1 1 26 SER HG H 8.528 -3.289 -15.902 1.00 . A A . 26 SER HG 1 1 2 833 1 1 26 SER N N 11.722 -3.140 -13.239 1.00 . A A . 26 SER N 1 1 2 834 1 1 26 SER O O 10.077 -6.230 -14.055 1.00 . A A . 26 SER O 1 1 2 835 1 1 26 SER OG O 9.242 -3.924 -15.828 1.00 . A A . 26 SER OG 1 1 2 836 1 1 27 ASN C C 14.034 -7.202 -13.756 1.00 . A A . 27 ASN C 1 1 2 837 1 1 27 ASN CA C 12.721 -7.032 -14.529 1.00 . A A . 27 ASN CA 1 1 2 838 1 1 27 ASN CB C 12.954 -7.267 -16.030 1.00 . A A . 27 ASN CB 1 1 2 839 1 1 27 ASN CG C 11.645 -7.012 -16.788 1.00 . A A . 27 ASN CG 1 1 2 840 1 1 27 ASN H H 12.841 -4.888 -14.359 1.00 . A A . 27 ASN H 1 1 2 841 1 1 27 ASN HA H 12.002 -7.739 -14.141 1.00 . A A . 27 ASN HA 1 1 2 842 1 1 27 ASN HB2 H 13.711 -6.594 -16.405 1.00 . A A . 27 ASN HB2 1 1 2 843 1 1 27 ASN HB3 H 13.269 -8.286 -16.208 1.00 . A A . 27 ASN HB3 1 1 2 844 1 1 27 ASN HD21 H 10.932 -8.829 -16.427 1.00 . A A . 27 ASN HD21 1 1 2 845 1 1 27 ASN HD22 H 9.916 -7.817 -17.335 1.00 . A A . 27 ASN HD22 1 1 2 846 1 1 27 ASN N N 12.214 -5.639 -14.329 1.00 . A A . 27 ASN N 1 1 2 847 1 1 27 ASN ND2 N 10.757 -7.965 -16.856 1.00 . A A . 27 ASN ND2 1 1 2 848 1 1 27 ASN O O 14.391 -8.297 -13.364 1.00 . A A . 27 ASN O 1 1 2 849 1 1 27 ASN OD1 O 11.419 -5.944 -17.321 1.00 . A A . 27 ASN OD1 1 1 2 850 1 1 28 LYS C C 16.242 -4.665 -12.260 1.00 . A A . 28 LYS C 1 1 2 851 1 1 28 LYS CA C 16.010 -6.075 -12.834 1.00 . A A . 28 LYS CA 1 1 2 852 1 1 28 LYS CB C 17.197 -6.448 -13.798 1.00 . A A . 28 LYS CB 1 1 2 853 1 1 28 LYS CD C 16.527 -4.990 -15.792 1.00 . A A . 28 LYS CD 1 1 2 854 1 1 28 LYS CE C 16.530 -4.948 -17.331 1.00 . A A . 28 LYS CE 1 1 2 855 1 1 28 LYS CG C 16.823 -6.430 -15.310 1.00 . A A . 28 LYS CG 1 1 2 856 1 1 28 LYS H H 14.346 -5.256 -13.921 1.00 . A A . 28 LYS H 1 1 2 857 1 1 28 LYS HA H 15.961 -6.786 -12.021 1.00 . A A . 28 LYS HA 1 1 2 858 1 1 28 LYS HB2 H 18.031 -5.780 -13.634 1.00 . A A . 28 LYS HB2 1 1 2 859 1 1 28 LYS HB3 H 17.529 -7.446 -13.549 1.00 . A A . 28 LYS HB3 1 1 2 860 1 1 28 LYS HD2 H 15.556 -4.672 -15.441 1.00 . A A . 28 LYS HD2 1 1 2 861 1 1 28 LYS HD3 H 17.273 -4.307 -15.411 1.00 . A A . 28 LYS HD3 1 1 2 862 1 1 28 LYS HE2 H 15.936 -5.754 -17.735 1.00 . A A . 28 LYS HE2 1 1 2 863 1 1 28 LYS HE3 H 16.123 -4.008 -17.675 1.00 . A A . 28 LYS HE3 1 1 2 864 1 1 28 LYS HG2 H 17.659 -6.827 -15.867 1.00 . A A . 28 LYS HG2 1 1 2 865 1 1 28 LYS HG3 H 15.972 -7.068 -15.496 1.00 . A A . 28 LYS HG3 1 1 2 866 1 1 28 LYS HZ1 H 18.583 -5.167 -17.045 1.00 . A A . 28 LYS HZ1 1 1 2 867 1 1 28 LYS HZ2 H 17.993 -5.921 -18.447 1.00 . A A . 28 LYS HZ2 1 1 2 868 1 1 28 LYS HZ3 H 18.168 -4.233 -18.401 1.00 . A A . 28 LYS HZ3 1 1 2 869 1 1 28 LYS N N 14.707 -6.096 -13.569 1.00 . A A . 28 LYS N 1 1 2 870 1 1 28 LYS NZ N 17.923 -5.077 -17.844 1.00 . A A . 28 LYS NZ 1 1 2 871 1 1 28 LYS O O 16.057 -3.724 -13.015 1.00 . A A . 28 LYS O 1 1 2 872 1 1 28 LYS OXT O 16.592 -4.604 -11.093 1.00 . A A . 28 LYS OXT 1 1 3 873 1 1 1 ASP C C -17.245 0.043 -9.515 1.00 . A A . 1 ASP C 1 1 3 874 1 1 1 ASP CA C -17.123 -0.010 -7.987 1.00 . A A . 1 ASP CA 1 1 3 875 1 1 1 ASP CB C -15.790 -0.694 -7.617 1.00 . A A . 1 ASP CB 1 1 3 876 1 1 1 ASP CG C -15.653 -0.763 -6.085 1.00 . A A . 1 ASP CG 1 1 3 877 1 1 1 ASP H1 H -18.905 -1.084 -8.172 1.00 . A A . 1 ASP H1 1 1 3 878 1 1 1 ASP H2 H -17.921 -1.596 -6.887 1.00 . A A . 1 ASP H2 1 1 3 879 1 1 1 ASP H3 H -18.803 -0.152 -6.757 1.00 . A A . 1 ASP H3 1 1 3 880 1 1 1 ASP HA H -17.147 0.999 -7.601 1.00 . A A . 1 ASP HA 1 1 3 881 1 1 1 ASP HB2 H -15.753 -1.695 -8.024 1.00 . A A . 1 ASP HB2 1 1 3 882 1 1 1 ASP HB3 H -14.964 -0.127 -8.022 1.00 . A A . 1 ASP HB3 1 1 3 883 1 1 1 ASP N N -18.274 -0.767 -7.407 1.00 . A A . 1 ASP N 1 1 3 884 1 1 1 ASP O O -17.870 -0.813 -10.113 1.00 . A A . 1 ASP O 1 1 3 885 1 1 1 ASP OD1 O -15.122 0.193 -5.544 1.00 . A A . 1 ASP OD1 1 1 3 886 1 1 1 ASP OD2 O -16.086 -1.768 -5.544 1.00 . A A . 1 ASP OD2 1 1 3 887 1 1 2 ALA C C -15.472 1.959 -12.122 1.00 . A A . 2 ALA C 1 1 3 888 1 1 2 ALA CA C -16.689 1.206 -11.586 1.00 . A A . 2 ALA CA 1 1 3 889 1 1 2 ALA CB C -17.954 1.976 -11.993 1.00 . A A . 2 ALA CB 1 1 3 890 1 1 2 ALA H H -16.150 1.706 -9.569 1.00 . A A . 2 ALA H 1 1 3 891 1 1 2 ALA HA H -16.702 0.225 -12.037 1.00 . A A . 2 ALA HA 1 1 3 892 1 1 2 ALA HB1 H -18.020 2.905 -11.448 1.00 . A A . 2 ALA HB1 1 1 3 893 1 1 2 ALA HB2 H -17.926 2.199 -13.053 1.00 . A A . 2 ALA HB2 1 1 3 894 1 1 2 ALA HB3 H -18.832 1.382 -11.792 1.00 . A A . 2 ALA HB3 1 1 3 895 1 1 2 ALA N N -16.641 1.048 -10.101 1.00 . A A . 2 ALA N 1 1 3 896 1 1 2 ALA O O -14.923 2.842 -11.490 1.00 . A A . 2 ALA O 1 1 3 897 1 1 3 GLU C C -14.090 1.617 -15.515 1.00 . A A . 3 GLU C 1 1 3 898 1 1 3 GLU CA C -13.959 2.109 -14.060 1.00 . A A . 3 GLU CA 1 1 3 899 1 1 3 GLU CB C -12.618 1.612 -13.418 1.00 . A A . 3 GLU CB 1 1 3 900 1 1 3 GLU CD C -13.180 -0.789 -14.071 1.00 . A A . 3 GLU CD 1 1 3 901 1 1 3 GLU CG C -12.682 0.134 -12.940 1.00 . A A . 3 GLU CG 1 1 3 902 1 1 3 GLU H H -15.632 0.818 -13.707 1.00 . A A . 3 GLU H 1 1 3 903 1 1 3 GLU HA H -14.029 3.184 -14.056 1.00 . A A . 3 GLU HA 1 1 3 904 1 1 3 GLU HB2 H -11.822 1.709 -14.135 1.00 . A A . 3 GLU HB2 1 1 3 905 1 1 3 GLU HB3 H -12.375 2.241 -12.575 1.00 . A A . 3 GLU HB3 1 1 3 906 1 1 3 GLU HG2 H -11.697 -0.186 -12.635 1.00 . A A . 3 GLU HG2 1 1 3 907 1 1 3 GLU HG3 H -13.343 0.048 -12.089 1.00 . A A . 3 GLU HG3 1 1 3 908 1 1 3 GLU N N -15.114 1.543 -13.303 1.00 . A A . 3 GLU N 1 1 3 909 1 1 3 GLU O O -13.123 1.500 -16.246 1.00 . A A . 3 GLU O 1 1 3 910 1 1 3 GLU OE1 O -12.370 -1.104 -14.927 1.00 . A A . 3 GLU OE1 1 1 3 911 1 1 3 GLU OE2 O -14.350 -1.128 -14.020 1.00 . A A . 3 GLU OE2 1 1 3 912 1 1 4 PHE C C -15.782 1.990 -18.263 1.00 . A A . 4 PHE C 1 1 3 913 1 1 4 PHE CA C -15.678 0.854 -17.235 1.00 . A A . 4 PHE CA 1 1 3 914 1 1 4 PHE CB C -17.024 0.095 -17.150 1.00 . A A . 4 PHE CB 1 1 3 915 1 1 4 PHE CD1 C -16.410 -2.213 -16.291 1.00 . A A . 4 PHE CD1 1 1 3 916 1 1 4 PHE CD2 C -17.516 -0.714 -14.801 1.00 . A A . 4 PHE CD2 1 1 3 917 1 1 4 PHE CE1 C -16.378 -3.173 -15.300 1.00 . A A . 4 PHE CE1 1 1 3 918 1 1 4 PHE CE2 C -17.484 -1.673 -13.811 1.00 . A A . 4 PHE CE2 1 1 3 919 1 1 4 PHE CG C -16.980 -0.976 -16.048 1.00 . A A . 4 PHE CG 1 1 3 920 1 1 4 PHE CZ C -16.914 -2.903 -14.059 1.00 . A A . 4 PHE CZ 1 1 3 921 1 1 4 PHE H H -16.034 1.484 -15.210 1.00 . A A . 4 PHE H 1 1 3 922 1 1 4 PHE HA H -14.900 0.186 -17.574 1.00 . A A . 4 PHE HA 1 1 3 923 1 1 4 PHE HB2 H -17.829 0.785 -16.938 1.00 . A A . 4 PHE HB2 1 1 3 924 1 1 4 PHE HB3 H -17.229 -0.391 -18.094 1.00 . A A . 4 PHE HB3 1 1 3 925 1 1 4 PHE HD1 H -15.988 -2.431 -17.260 1.00 . A A . 4 PHE HD1 1 1 3 926 1 1 4 PHE HD2 H -17.964 0.247 -14.598 1.00 . A A . 4 PHE HD2 1 1 3 927 1 1 4 PHE HE1 H -15.931 -4.136 -15.497 1.00 . A A . 4 PHE HE1 1 1 3 928 1 1 4 PHE HE2 H -17.906 -1.461 -12.840 1.00 . A A . 4 PHE HE2 1 1 3 929 1 1 4 PHE HZ H -16.890 -3.654 -13.284 1.00 . A A . 4 PHE HZ 1 1 3 930 1 1 4 PHE N N -15.323 1.350 -15.870 1.00 . A A . 4 PHE N 1 1 3 931 1 1 4 PHE O O -16.596 1.944 -19.165 1.00 . A A . 4 PHE O 1 1 3 932 1 1 5 ARG C C -14.207 3.711 -20.299 1.00 . A A . 5 ARG C 1 1 3 933 1 1 5 ARG CA C -14.922 4.152 -19.008 1.00 . A A . 5 ARG CA 1 1 3 934 1 1 5 ARG CB C -14.166 5.306 -18.298 1.00 . A A . 5 ARG CB 1 1 3 935 1 1 5 ARG CD C -13.047 7.557 -18.698 1.00 . A A . 5 ARG CD 1 1 3 936 1 1 5 ARG CG C -14.135 6.574 -19.191 1.00 . A A . 5 ARG CG 1 1 3 937 1 1 5 ARG CZ C -11.410 9.013 -19.799 1.00 . A A . 5 ARG CZ 1 1 3 938 1 1 5 ARG H H -14.328 2.953 -17.330 1.00 . A A . 5 ARG H 1 1 3 939 1 1 5 ARG HA H -15.938 4.436 -19.228 1.00 . A A . 5 ARG HA 1 1 3 940 1 1 5 ARG HB2 H -14.671 5.535 -17.371 1.00 . A A . 5 ARG HB2 1 1 3 941 1 1 5 ARG HB3 H -13.161 4.983 -18.069 1.00 . A A . 5 ARG HB3 1 1 3 942 1 1 5 ARG HD2 H -13.510 8.422 -18.245 1.00 . A A . 5 ARG HD2 1 1 3 943 1 1 5 ARG HD3 H -12.390 7.095 -17.978 1.00 . A A . 5 ARG HD3 1 1 3 944 1 1 5 ARG HE H -12.321 7.520 -20.730 1.00 . A A . 5 ARG HE 1 1 3 945 1 1 5 ARG HG2 H -13.933 6.307 -20.218 1.00 . A A . 5 ARG HG2 1 1 3 946 1 1 5 ARG HG3 H -15.097 7.062 -19.152 1.00 . A A . 5 ARG HG3 1 1 3 947 1 1 5 ARG HH11 H -11.800 9.401 -17.865 1.00 . A A . 5 ARG HH11 1 1 3 948 1 1 5 ARG HH12 H -10.646 10.445 -18.617 1.00 . A A . 5 ARG HH12 1 1 3 949 1 1 5 ARG HH21 H -10.862 8.822 -21.720 1.00 . A A . 5 ARG HH21 1 1 3 950 1 1 5 ARG HH22 H -10.100 10.107 -20.848 1.00 . A A . 5 ARG HH22 1 1 3 951 1 1 5 ARG N N -14.946 2.981 -18.086 1.00 . A A . 5 ARG N 1 1 3 952 1 1 5 ARG NE N -12.236 7.998 -19.878 1.00 . A A . 5 ARG NE 1 1 3 953 1 1 5 ARG NH1 N -11.275 9.670 -18.673 1.00 . A A . 5 ARG NH1 1 1 3 954 1 1 5 ARG NH2 N -10.739 9.339 -20.872 1.00 . A A . 5 ARG NH2 1 1 3 955 1 1 5 ARG O O -13.059 4.039 -20.518 1.00 . A A . 5 ARG O 1 1 3 956 1 1 6 HIS C C -12.985 1.740 -22.265 1.00 . A A . 6 HIS C 1 1 3 957 1 1 6 HIS CA C -14.357 2.448 -22.417 1.00 . A A . 6 HIS CA 1 1 3 958 1 1 6 HIS CB C -14.235 3.650 -23.393 1.00 . A A . 6 HIS CB 1 1 3 959 1 1 6 HIS CD2 C -13.114 3.291 -25.774 1.00 . A A . 6 HIS CD2 1 1 3 960 1 1 6 HIS CE1 C -14.637 2.201 -26.663 1.00 . A A . 6 HIS CE1 1 1 3 961 1 1 6 HIS CG C -14.128 3.149 -24.841 1.00 . A A . 6 HIS CG 1 1 3 962 1 1 6 HIS H H -15.826 2.726 -20.863 1.00 . A A . 6 HIS H 1 1 3 963 1 1 6 HIS HA H -15.060 1.730 -22.815 1.00 . A A . 6 HIS HA 1 1 3 964 1 1 6 HIS HB2 H -15.107 4.283 -23.316 1.00 . A A . 6 HIS HB2 1 1 3 965 1 1 6 HIS HB3 H -13.357 4.236 -23.167 1.00 . A A . 6 HIS HB3 1 1 3 966 1 1 6 HIS HD1 H -15.894 2.192 -25.075 1.00 . A A . 6 HIS HD1 1 1 3 967 1 1 6 HIS HD2 H -12.185 3.814 -25.603 1.00 . A A . 6 HIS HD2 1 1 3 968 1 1 6 HIS HE1 H -15.215 1.641 -27.383 1.00 . A A . 6 HIS HE1 1 1 3 969 1 1 6 HIS N N -14.910 2.960 -21.115 1.00 . A A . 6 HIS N 1 1 3 970 1 1 6 HIS ND1 N -15.035 2.467 -25.459 1.00 . A A . 6 HIS ND1 1 1 3 971 1 1 6 HIS NE2 N -13.447 2.695 -26.901 1.00 . A A . 6 HIS NE2 1 1 3 972 1 1 6 HIS O O -12.316 1.469 -23.243 1.00 . A A . 6 HIS O 1 1 3 973 1 1 7 ASP C C -10.151 1.661 -21.176 1.00 . A A . 7 ASP C 1 1 3 974 1 1 7 ASP CA C -11.323 0.790 -20.704 1.00 . A A . 7 ASP CA 1 1 3 975 1 1 7 ASP CB C -11.290 -0.606 -21.391 1.00 . A A . 7 ASP CB 1 1 3 976 1 1 7 ASP CG C -10.416 -1.549 -20.548 1.00 . A A . 7 ASP CG 1 1 3 977 1 1 7 ASP H H -13.200 1.714 -20.297 1.00 . A A . 7 ASP H 1 1 3 978 1 1 7 ASP HA H -11.260 0.703 -19.631 1.00 . A A . 7 ASP HA 1 1 3 979 1 1 7 ASP HB2 H -12.289 -1.015 -21.450 1.00 . A A . 7 ASP HB2 1 1 3 980 1 1 7 ASP HB3 H -10.885 -0.541 -22.391 1.00 . A A . 7 ASP HB3 1 1 3 981 1 1 7 ASP N N -12.615 1.466 -21.036 1.00 . A A . 7 ASP N 1 1 3 982 1 1 7 ASP O O -9.085 1.178 -21.506 1.00 . A A . 7 ASP O 1 1 3 983 1 1 7 ASP OD1 O -10.961 -2.091 -19.599 1.00 . A A . 7 ASP OD1 1 1 3 984 1 1 7 ASP OD2 O -9.253 -1.674 -20.898 1.00 . A A . 7 ASP OD2 1 1 3 985 1 1 8 SER C C -8.286 4.038 -20.551 1.00 . A A . 8 SER C 1 1 3 986 1 1 8 SER CA C -9.394 3.945 -21.608 1.00 . A A . 8 SER CA 1 1 3 987 1 1 8 SER CB C -10.087 5.319 -21.787 1.00 . A A . 8 SER CB 1 1 3 988 1 1 8 SER H H -11.292 3.260 -20.899 1.00 . A A . 8 SER H 1 1 3 989 1 1 8 SER HA H -8.982 3.606 -22.543 1.00 . A A . 8 SER HA 1 1 3 990 1 1 8 SER HB2 H -9.369 6.098 -21.997 1.00 . A A . 8 SER HB2 1 1 3 991 1 1 8 SER HB3 H -10.825 5.279 -22.575 1.00 . A A . 8 SER HB3 1 1 3 992 1 1 8 SER HG H -10.607 4.861 -19.954 1.00 . A A . 8 SER HG 1 1 3 993 1 1 8 SER N N -10.411 2.945 -21.181 1.00 . A A . 8 SER N 1 1 3 994 1 1 8 SER O O -7.137 4.292 -20.860 1.00 . A A . 8 SER O 1 1 3 995 1 1 8 SER OG O -10.737 5.600 -20.552 1.00 . A A . 8 SER OG 1 1 3 996 1 1 9 GLY C C -8.553 3.601 -16.893 1.00 . A A . 9 GLY C 1 1 3 997 1 1 9 GLY CA C -7.762 3.868 -18.171 1.00 . A A . 9 GLY CA 1 1 3 998 1 1 9 GLY H H -9.644 3.624 -19.180 1.00 . A A . 9 GLY H 1 1 3 999 1 1 9 GLY HA2 H -7.001 3.110 -18.291 1.00 . A A . 9 GLY HA2 1 1 3 1000 1 1 9 GLY HA3 H -7.303 4.845 -18.114 1.00 . A A . 9 GLY HA3 1 1 3 1001 1 1 9 GLY N N -8.696 3.821 -19.330 1.00 . A A . 9 GLY N 1 1 3 1002 1 1 9 GLY O O -9.049 4.522 -16.273 1.00 . A A . 9 GLY O 1 1 3 1003 1 1 10 TYR C C -8.637 2.375 -14.036 1.00 . A A . 10 TYR C 1 1 3 1004 1 1 10 TYR CA C -9.395 1.947 -15.309 1.00 . A A . 10 TYR CA 1 1 3 1005 1 1 10 TYR CB C -9.604 0.406 -15.340 1.00 . A A . 10 TYR CB 1 1 3 1006 1 1 10 TYR CD1 C -7.419 -0.577 -16.171 1.00 . A A . 10 TYR CD1 1 1 3 1007 1 1 10 TYR CD2 C -7.931 -0.795 -13.856 1.00 . A A . 10 TYR CD2 1 1 3 1008 1 1 10 TYR CE1 C -6.232 -1.247 -15.965 1.00 . A A . 10 TYR CE1 1 1 3 1009 1 1 10 TYR CE2 C -6.744 -1.465 -13.656 1.00 . A A . 10 TYR CE2 1 1 3 1010 1 1 10 TYR CG C -8.280 -0.344 -15.117 1.00 . A A . 10 TYR CG 1 1 3 1011 1 1 10 TYR CZ C -5.886 -1.695 -14.707 1.00 . A A . 10 TYR CZ 1 1 3 1012 1 1 10 TYR H H -8.228 1.650 -17.086 1.00 . A A . 10 TYR H 1 1 3 1013 1 1 10 TYR HA H -10.349 2.446 -15.331 1.00 . A A . 10 TYR HA 1 1 3 1014 1 1 10 TYR HB2 H -10.287 0.123 -14.555 1.00 . A A . 10 TYR HB2 1 1 3 1015 1 1 10 TYR HB3 H -10.024 0.104 -16.287 1.00 . A A . 10 TYR HB3 1 1 3 1016 1 1 10 TYR HD1 H -7.674 -0.235 -17.163 1.00 . A A . 10 TYR HD1 1 1 3 1017 1 1 10 TYR HD2 H -8.592 -0.626 -13.020 1.00 . A A . 10 TYR HD2 1 1 3 1018 1 1 10 TYR HE1 H -5.567 -1.423 -16.795 1.00 . A A . 10 TYR HE1 1 1 3 1019 1 1 10 TYR HE2 H -6.483 -1.808 -12.668 1.00 . A A . 10 TYR HE2 1 1 3 1020 1 1 10 TYR HH H -4.502 -2.351 -13.566 1.00 . A A . 10 TYR HH 1 1 3 1021 1 1 10 TYR N N -8.648 2.343 -16.539 1.00 . A A . 10 TYR N 1 1 3 1022 1 1 10 TYR O O -7.725 3.176 -14.102 1.00 . A A . 10 TYR O 1 1 3 1023 1 1 10 TYR OH O -4.696 -2.366 -14.506 1.00 . A A . 10 TYR OH 1 1 3 1024 1 1 11 GLU C C -8.972 1.203 -10.601 1.00 . A A . 11 GLU C 1 1 3 1025 1 1 11 GLU CA C -8.381 2.158 -11.618 1.00 . A A . 11 GLU CA 1 1 3 1026 1 1 11 GLU CB C -8.689 3.607 -11.178 1.00 . A A . 11 GLU CB 1 1 3 1027 1 1 11 GLU CD C -8.582 4.881 -8.985 1.00 . A A . 11 GLU CD 1 1 3 1028 1 1 11 GLU CG C -7.829 3.920 -9.921 1.00 . A A . 11 GLU CG 1 1 3 1029 1 1 11 GLU H H -9.764 1.172 -12.900 1.00 . A A . 11 GLU H 1 1 3 1030 1 1 11 GLU HA H -7.317 1.983 -11.696 1.00 . A A . 11 GLU HA 1 1 3 1031 1 1 11 GLU HB2 H -8.432 4.298 -11.967 1.00 . A A . 11 GLU HB2 1 1 3 1032 1 1 11 GLU HB3 H -9.740 3.717 -10.957 1.00 . A A . 11 GLU HB3 1 1 3 1033 1 1 11 GLU HG2 H -7.598 3.014 -9.375 1.00 . A A . 11 GLU HG2 1 1 3 1034 1 1 11 GLU HG3 H -6.897 4.377 -10.222 1.00 . A A . 11 GLU HG3 1 1 3 1035 1 1 11 GLU N N -9.032 1.827 -12.914 1.00 . A A . 11 GLU N 1 1 3 1036 1 1 11 GLU O O -10.154 1.232 -10.314 1.00 . A A . 11 GLU O 1 1 3 1037 1 1 11 GLU OE1 O -8.599 6.058 -9.307 1.00 . A A . 11 GLU OE1 1 1 3 1038 1 1 11 GLU OE2 O -9.100 4.380 -7.998 1.00 . A A . 11 GLU OE2 1 1 3 1039 1 1 12 VAL C C -8.772 0.107 -7.759 1.00 . A A . 12 VAL C 1 1 3 1040 1 1 12 VAL CA C -8.520 -0.619 -9.086 1.00 . A A . 12 VAL CA 1 1 3 1041 1 1 12 VAL CB C -7.399 -1.646 -8.992 1.00 . A A . 12 VAL CB 1 1 3 1042 1 1 12 VAL CG1 C -7.626 -2.581 -7.790 1.00 . A A . 12 VAL CG1 1 1 3 1043 1 1 12 VAL CG2 C -7.365 -2.468 -10.303 1.00 . A A . 12 VAL CG2 1 1 3 1044 1 1 12 VAL H H -7.169 0.412 -10.377 1.00 . A A . 12 VAL H 1 1 3 1045 1 1 12 VAL HA H -9.408 -1.092 -9.439 1.00 . A A . 12 VAL HA 1 1 3 1046 1 1 12 VAL HB H -6.481 -1.099 -8.887 1.00 . A A . 12 VAL HB 1 1 3 1047 1 1 12 VAL HG11 H -8.648 -2.932 -7.784 1.00 . A A . 12 VAL HG11 1 1 3 1048 1 1 12 VAL HG12 H -6.962 -3.431 -7.851 1.00 . A A . 12 VAL HG12 1 1 3 1049 1 1 12 VAL HG13 H -7.431 -2.049 -6.871 1.00 . A A . 12 VAL HG13 1 1 3 1050 1 1 12 VAL HG21 H -7.882 -1.942 -11.093 1.00 . A A . 12 VAL HG21 1 1 3 1051 1 1 12 VAL HG22 H -6.341 -2.623 -10.608 1.00 . A A . 12 VAL HG22 1 1 3 1052 1 1 12 VAL HG23 H -7.842 -3.428 -10.174 1.00 . A A . 12 VAL HG23 1 1 3 1053 1 1 12 VAL N N -8.103 0.377 -10.094 1.00 . A A . 12 VAL N 1 1 3 1054 1 1 12 VAL O O -9.831 0.004 -7.172 1.00 . A A . 12 VAL O 1 1 3 1055 1 1 13 HIS C C -6.426 2.343 -5.992 1.00 . A A . 13 HIS C 1 1 3 1056 1 1 13 HIS CA C -7.770 1.613 -6.093 1.00 . A A . 13 HIS CA 1 1 3 1057 1 1 13 HIS CB C -7.949 0.666 -4.877 1.00 . A A . 13 HIS CB 1 1 3 1058 1 1 13 HIS CD2 C -7.184 1.116 -2.376 1.00 . A A . 13 HIS CD2 1 1 3 1059 1 1 13 HIS CE1 C -7.992 3.012 -2.149 1.00 . A A . 13 HIS CE1 1 1 3 1060 1 1 13 HIS CG C -7.808 1.453 -3.566 1.00 . A A . 13 HIS CG 1 1 3 1061 1 1 13 HIS H H -6.952 0.828 -7.917 1.00 . A A . 13 HIS H 1 1 3 1062 1 1 13 HIS HA H -8.568 2.338 -6.147 1.00 . A A . 13 HIS HA 1 1 3 1063 1 1 13 HIS HB2 H -8.928 0.212 -4.893 1.00 . A A . 13 HIS HB2 1 1 3 1064 1 1 13 HIS HB3 H -7.202 -0.114 -4.897 1.00 . A A . 13 HIS HB3 1 1 3 1065 1 1 13 HIS HD1 H -8.787 3.165 -4.004 1.00 . A A . 13 HIS HD1 1 1 3 1066 1 1 13 HIS HD2 H -6.671 0.184 -2.188 1.00 . A A . 13 HIS HD2 1 1 3 1067 1 1 13 HIS HE1 H -8.276 3.965 -1.726 1.00 . A A . 13 HIS HE1 1 1 3 1068 1 1 13 HIS N N -7.754 0.820 -7.358 1.00 . A A . 13 HIS N 1 1 3 1069 1 1 13 HIS ND1 N -8.283 2.636 -3.353 1.00 . A A . 13 HIS ND1 1 1 3 1070 1 1 13 HIS NE2 N -7.308 2.098 -1.505 1.00 . A A . 13 HIS NE2 1 1 3 1071 1 1 13 HIS O O -6.381 3.541 -5.794 1.00 . A A . 13 HIS O 1 1 3 1072 1 1 14 HIS C C -3.059 1.155 -6.848 1.00 . A A . 14 HIS C 1 1 3 1073 1 1 14 HIS CA C -3.986 2.095 -6.068 1.00 . A A . 14 HIS CA 1 1 3 1074 1 1 14 HIS CB C -3.536 2.165 -4.593 1.00 . A A . 14 HIS CB 1 1 3 1075 1 1 14 HIS CD2 C -3.487 4.747 -4.004 1.00 . A A . 14 HIS CD2 1 1 3 1076 1 1 14 HIS CE1 C -5.220 4.826 -2.866 1.00 . A A . 14 HIS CE1 1 1 3 1077 1 1 14 HIS CG C -4.023 3.473 -3.964 1.00 . A A . 14 HIS CG 1 1 3 1078 1 1 14 HIS H H -5.509 0.614 -6.300 1.00 . A A . 14 HIS H 1 1 3 1079 1 1 14 HIS HA H -3.967 3.067 -6.532 1.00 . A A . 14 HIS HA 1 1 3 1080 1 1 14 HIS HB2 H -3.948 1.337 -4.034 1.00 . A A . 14 HIS HB2 1 1 3 1081 1 1 14 HIS HB3 H -2.460 2.128 -4.524 1.00 . A A . 14 HIS HB3 1 1 3 1082 1 1 14 HIS HD1 H -5.706 2.868 -3.024 1.00 . A A . 14 HIS HD1 1 1 3 1083 1 1 14 HIS HD2 H -2.581 5.025 -4.523 1.00 . A A . 14 HIS HD2 1 1 3 1084 1 1 14 HIS HE1 H -6.032 5.190 -2.255 1.00 . A A . 14 HIS HE1 1 1 3 1085 1 1 14 HIS N N -5.379 1.569 -6.137 1.00 . A A . 14 HIS N 1 1 3 1086 1 1 14 HIS ND1 N -5.090 3.595 -3.245 1.00 . A A . 14 HIS ND1 1 1 3 1087 1 1 14 HIS NE2 N -4.245 5.578 -3.315 1.00 . A A . 14 HIS NE2 1 1 3 1088 1 1 14 HIS O O -2.882 0.012 -6.469 1.00 . A A . 14 HIS O 1 1 3 1089 1 1 15 GLN C C -0.212 1.565 -8.890 1.00 . A A . 15 GLN C 1 1 3 1090 1 1 15 GLN CA C -1.569 0.867 -8.774 1.00 . A A . 15 GLN CA 1 1 3 1091 1 1 15 GLN CB C -2.221 0.695 -10.166 1.00 . A A . 15 GLN CB 1 1 3 1092 1 1 15 GLN CD C -4.299 -0.074 -11.362 1.00 . A A . 15 GLN CD 1 1 3 1093 1 1 15 GLN CG C -3.556 -0.075 -10.022 1.00 . A A . 15 GLN CG 1 1 3 1094 1 1 15 GLN H H -2.694 2.598 -8.159 1.00 . A A . 15 GLN H 1 1 3 1095 1 1 15 GLN HA H -1.381 -0.082 -8.305 1.00 . A A . 15 GLN HA 1 1 3 1096 1 1 15 GLN HB2 H -2.403 1.666 -10.604 1.00 . A A . 15 GLN HB2 1 1 3 1097 1 1 15 GLN HB3 H -1.556 0.143 -10.814 1.00 . A A . 15 GLN HB3 1 1 3 1098 1 1 15 GLN HE21 H -2.849 -1.033 -12.321 1.00 . A A . 15 GLN HE21 1 1 3 1099 1 1 15 GLN HE22 H -4.202 -0.628 -13.265 1.00 . A A . 15 GLN HE22 1 1 3 1100 1 1 15 GLN HG2 H -3.369 -1.098 -9.729 1.00 . A A . 15 GLN HG2 1 1 3 1101 1 1 15 GLN HG3 H -4.188 0.392 -9.280 1.00 . A A . 15 GLN HG3 1 1 3 1102 1 1 15 GLN N N -2.500 1.670 -7.915 1.00 . A A . 15 GLN N 1 1 3 1103 1 1 15 GLN NE2 N -3.736 -0.625 -12.402 1.00 . A A . 15 GLN NE2 1 1 3 1104 1 1 15 GLN O O 0.605 1.252 -9.735 1.00 . A A . 15 GLN O 1 1 3 1105 1 1 15 GLN OE1 O -5.401 0.427 -11.478 1.00 . A A . 15 GLN OE1 1 1 3 1106 1 1 16 PHE C C 2.433 2.352 -7.570 1.00 . A A . 16 PHE C 1 1 3 1107 1 1 16 PHE CA C 1.281 3.268 -8.001 1.00 . A A . 16 PHE CA 1 1 3 1108 1 1 16 PHE CB C 1.149 4.461 -7.032 1.00 . A A . 16 PHE CB 1 1 3 1109 1 1 16 PHE CD1 C -0.010 3.613 -4.936 1.00 . A A . 16 PHE CD1 1 1 3 1110 1 1 16 PHE CD2 C 2.345 3.976 -4.849 1.00 . A A . 16 PHE CD2 1 1 3 1111 1 1 16 PHE CE1 C 0.006 3.204 -3.617 1.00 . A A . 16 PHE CE1 1 1 3 1112 1 1 16 PHE CE2 C 2.362 3.567 -3.533 1.00 . A A . 16 PHE CE2 1 1 3 1113 1 1 16 PHE CG C 1.159 4.002 -5.563 1.00 . A A . 16 PHE CG 1 1 3 1114 1 1 16 PHE CZ C 1.192 3.182 -2.915 1.00 . A A . 16 PHE CZ 1 1 3 1115 1 1 16 PHE H H -0.708 2.678 -7.351 1.00 . A A . 16 PHE H 1 1 3 1116 1 1 16 PHE HA H 1.473 3.630 -9.001 1.00 . A A . 16 PHE HA 1 1 3 1117 1 1 16 PHE HB2 H 1.974 5.140 -7.193 1.00 . A A . 16 PHE HB2 1 1 3 1118 1 1 16 PHE HB3 H 0.227 4.989 -7.230 1.00 . A A . 16 PHE HB3 1 1 3 1119 1 1 16 PHE HD1 H -0.943 3.627 -5.480 1.00 . A A . 16 PHE HD1 1 1 3 1120 1 1 16 PHE HD2 H 3.267 4.276 -5.326 1.00 . A A . 16 PHE HD2 1 1 3 1121 1 1 16 PHE HE1 H -0.909 2.902 -3.131 1.00 . A A . 16 PHE HE1 1 1 3 1122 1 1 16 PHE HE2 H 3.293 3.550 -2.986 1.00 . A A . 16 PHE HE2 1 1 3 1123 1 1 16 PHE HZ H 1.205 2.862 -1.884 1.00 . A A . 16 PHE HZ 1 1 3 1124 1 1 16 PHE N N -0.005 2.500 -8.007 1.00 . A A . 16 PHE N 1 1 3 1125 1 1 16 PHE O O 3.584 2.613 -7.858 1.00 . A A . 16 PHE O 1 1 3 1126 1 1 17 LEU C C 3.665 -0.346 -7.627 1.00 . A A . 17 LEU C 1 1 3 1127 1 1 17 LEU CA C 3.054 0.298 -6.392 1.00 . A A . 17 LEU CA 1 1 3 1128 1 1 17 LEU CB C 2.325 -0.759 -5.535 1.00 . A A . 17 LEU CB 1 1 3 1129 1 1 17 LEU CD1 C -0.039 -0.127 -4.814 1.00 . A A . 17 LEU CD1 1 1 3 1130 1 1 17 LEU CD2 C 1.666 -0.780 -3.081 1.00 . A A . 17 LEU CD2 1 1 3 1131 1 1 17 LEU CG C 1.461 -0.064 -4.433 1.00 . A A . 17 LEU CG 1 1 3 1132 1 1 17 LEU H H 1.123 1.145 -6.703 1.00 . A A . 17 LEU H 1 1 3 1133 1 1 17 LEU HA H 3.817 0.808 -5.831 1.00 . A A . 17 LEU HA 1 1 3 1134 1 1 17 LEU HB2 H 1.698 -1.365 -6.173 1.00 . A A . 17 LEU HB2 1 1 3 1135 1 1 17 LEU HB3 H 3.066 -1.404 -5.084 1.00 . A A . 17 LEU HB3 1 1 3 1136 1 1 17 LEU HD11 H -0.362 -1.154 -4.907 1.00 . A A . 17 LEU HD11 1 1 3 1137 1 1 17 LEU HD12 H -0.634 0.353 -4.051 1.00 . A A . 17 LEU HD12 1 1 3 1138 1 1 17 LEU HD13 H -0.216 0.377 -5.752 1.00 . A A . 17 LEU HD13 1 1 3 1139 1 1 17 LEU HD21 H 1.414 -1.827 -3.166 1.00 . A A . 17 LEU HD21 1 1 3 1140 1 1 17 LEU HD22 H 2.696 -0.693 -2.770 1.00 . A A . 17 LEU HD22 1 1 3 1141 1 1 17 LEU HD23 H 1.039 -0.332 -2.325 1.00 . A A . 17 LEU HD23 1 1 3 1142 1 1 17 LEU HG H 1.757 0.968 -4.325 1.00 . A A . 17 LEU HG 1 1 3 1143 1 1 17 LEU N N 2.068 1.295 -6.889 1.00 . A A . 17 LEU N 1 1 3 1144 1 1 17 LEU O O 4.859 -0.524 -7.742 1.00 . A A . 17 LEU O 1 1 3 1145 1 1 18 VAL C C 3.973 -0.281 -10.632 1.00 . A A . 18 VAL C 1 1 3 1146 1 1 18 VAL CA C 3.198 -1.309 -9.807 1.00 . A A . 18 VAL CA 1 1 3 1147 1 1 18 VAL CB C 1.904 -1.804 -10.496 1.00 . A A . 18 VAL CB 1 1 3 1148 1 1 18 VAL CG1 C 2.101 -2.044 -12.006 1.00 . A A . 18 VAL CG1 1 1 3 1149 1 1 18 VAL CG2 C 1.532 -3.128 -9.814 1.00 . A A . 18 VAL CG2 1 1 3 1150 1 1 18 VAL H H 1.836 -0.484 -8.360 1.00 . A A . 18 VAL H 1 1 3 1151 1 1 18 VAL HA H 3.853 -2.122 -9.562 1.00 . A A . 18 VAL HA 1 1 3 1152 1 1 18 VAL HB H 1.106 -1.091 -10.351 1.00 . A A . 18 VAL HB 1 1 3 1153 1 1 18 VAL HG11 H 3.080 -2.456 -12.204 1.00 . A A . 18 VAL HG11 1 1 3 1154 1 1 18 VAL HG12 H 1.352 -2.726 -12.379 1.00 . A A . 18 VAL HG12 1 1 3 1155 1 1 18 VAL HG13 H 1.998 -1.106 -12.532 1.00 . A A . 18 VAL HG13 1 1 3 1156 1 1 18 VAL HG21 H 1.420 -2.968 -8.752 1.00 . A A . 18 VAL HG21 1 1 3 1157 1 1 18 VAL HG22 H 0.607 -3.509 -10.215 1.00 . A A . 18 VAL HG22 1 1 3 1158 1 1 18 VAL HG23 H 2.317 -3.854 -9.972 1.00 . A A . 18 VAL HG23 1 1 3 1159 1 1 18 VAL N N 2.782 -0.669 -8.532 1.00 . A A . 18 VAL N 1 1 3 1160 1 1 18 VAL O O 5.026 -0.580 -11.163 1.00 . A A . 18 VAL O 1 1 3 1161 1 1 19 PHE C C 5.500 2.210 -10.978 1.00 . A A . 19 PHE C 1 1 3 1162 1 1 19 PHE CA C 4.058 2.013 -11.471 1.00 . A A . 19 PHE CA 1 1 3 1163 1 1 19 PHE CB C 3.250 3.303 -11.258 1.00 . A A . 19 PHE CB 1 1 3 1164 1 1 19 PHE CD1 C 3.308 4.450 -13.518 1.00 . A A . 19 PHE CD1 1 1 3 1165 1 1 19 PHE CD2 C 4.725 5.298 -11.796 1.00 . A A . 19 PHE CD2 1 1 3 1166 1 1 19 PHE CE1 C 3.781 5.415 -14.383 1.00 . A A . 19 PHE CE1 1 1 3 1167 1 1 19 PHE CE2 C 5.198 6.263 -12.660 1.00 . A A . 19 PHE CE2 1 1 3 1168 1 1 19 PHE CG C 3.776 4.383 -12.218 1.00 . A A . 19 PHE CG 1 1 3 1169 1 1 19 PHE CZ C 4.727 6.322 -13.954 1.00 . A A . 19 PHE CZ 1 1 3 1170 1 1 19 PHE H H 2.559 1.043 -10.253 1.00 . A A . 19 PHE H 1 1 3 1171 1 1 19 PHE HA H 4.081 1.752 -12.516 1.00 . A A . 19 PHE HA 1 1 3 1172 1 1 19 PHE HB2 H 2.204 3.128 -11.462 1.00 . A A . 19 PHE HB2 1 1 3 1173 1 1 19 PHE HB3 H 3.355 3.652 -10.242 1.00 . A A . 19 PHE HB3 1 1 3 1174 1 1 19 PHE HD1 H 2.566 3.743 -13.861 1.00 . A A . 19 PHE HD1 1 1 3 1175 1 1 19 PHE HD2 H 5.100 5.258 -10.783 1.00 . A A . 19 PHE HD2 1 1 3 1176 1 1 19 PHE HE1 H 3.409 5.460 -15.397 1.00 . A A . 19 PHE HE1 1 1 3 1177 1 1 19 PHE HE2 H 5.939 6.973 -12.323 1.00 . A A . 19 PHE HE2 1 1 3 1178 1 1 19 PHE HZ H 5.097 7.078 -14.631 1.00 . A A . 19 PHE HZ 1 1 3 1179 1 1 19 PHE N N 3.414 0.899 -10.705 1.00 . A A . 19 PHE N 1 1 3 1180 1 1 19 PHE O O 6.371 2.599 -11.731 1.00 . A A . 19 PHE O 1 1 3 1181 1 1 20 PHE C C 7.847 0.859 -9.498 1.00 . A A . 20 PHE C 1 1 3 1182 1 1 20 PHE CA C 7.019 2.058 -9.075 1.00 . A A . 20 PHE CA 1 1 3 1183 1 1 20 PHE CB C 6.849 2.091 -7.538 1.00 . A A . 20 PHE CB 1 1 3 1184 1 1 20 PHE CD1 C 6.066 4.511 -7.610 1.00 . A A . 20 PHE CD1 1 1 3 1185 1 1 20 PHE CD2 C 7.707 3.907 -5.988 1.00 . A A . 20 PHE CD2 1 1 3 1186 1 1 20 PHE CE1 C 6.091 5.812 -7.152 1.00 . A A . 20 PHE CE1 1 1 3 1187 1 1 20 PHE CE2 C 7.733 5.208 -5.531 1.00 . A A . 20 PHE CE2 1 1 3 1188 1 1 20 PHE CG C 6.874 3.545 -7.033 1.00 . A A . 20 PHE CG 1 1 3 1189 1 1 20 PHE CZ C 6.925 6.161 -6.112 1.00 . A A . 20 PHE CZ 1 1 3 1190 1 1 20 PHE H H 4.932 1.612 -9.177 1.00 . A A . 20 PHE H 1 1 3 1191 1 1 20 PHE HA H 7.496 2.951 -9.435 1.00 . A A . 20 PHE HA 1 1 3 1192 1 1 20 PHE HB2 H 5.907 1.649 -7.250 1.00 . A A . 20 PHE HB2 1 1 3 1193 1 1 20 PHE HB3 H 7.645 1.540 -7.059 1.00 . A A . 20 PHE HB3 1 1 3 1194 1 1 20 PHE HD1 H 5.412 4.248 -8.426 1.00 . A A . 20 PHE HD1 1 1 3 1195 1 1 20 PHE HD2 H 8.346 3.168 -5.524 1.00 . A A . 20 PHE HD2 1 1 3 1196 1 1 20 PHE HE1 H 5.457 6.556 -7.609 1.00 . A A . 20 PHE HE1 1 1 3 1197 1 1 20 PHE HE2 H 8.386 5.480 -4.715 1.00 . A A . 20 PHE HE2 1 1 3 1198 1 1 20 PHE HZ H 6.944 7.180 -5.753 1.00 . A A . 20 PHE HZ 1 1 3 1199 1 1 20 PHE N N 5.684 1.924 -9.715 1.00 . A A . 20 PHE N 1 1 3 1200 1 1 20 PHE O O 8.955 1.001 -9.957 1.00 . A A . 20 PHE O 1 1 3 1201 1 1 21 ALA C C 8.503 -1.578 -11.197 1.00 . A A . 21 ALA C 1 1 3 1202 1 1 21 ALA CA C 8.016 -1.555 -9.730 1.00 . A A . 21 ALA CA 1 1 3 1203 1 1 21 ALA CB C 7.071 -2.726 -9.466 1.00 . A A . 21 ALA CB 1 1 3 1204 1 1 21 ALA H H 6.386 -0.361 -8.983 1.00 . A A . 21 ALA H 1 1 3 1205 1 1 21 ALA HA H 8.885 -1.629 -9.092 1.00 . A A . 21 ALA HA 1 1 3 1206 1 1 21 ALA HB1 H 6.685 -2.662 -8.459 1.00 . A A . 21 ALA HB1 1 1 3 1207 1 1 21 ALA HB2 H 6.241 -2.689 -10.156 1.00 . A A . 21 ALA HB2 1 1 3 1208 1 1 21 ALA HB3 H 7.592 -3.663 -9.588 1.00 . A A . 21 ALA HB3 1 1 3 1209 1 1 21 ALA N N 7.290 -0.307 -9.349 1.00 . A A . 21 ALA N 1 1 3 1210 1 1 21 ALA O O 9.229 -2.474 -11.582 1.00 . A A . 21 ALA O 1 1 3 1211 1 1 22 GLU C C 9.735 0.376 -13.634 1.00 . A A . 22 GLU C 1 1 3 1212 1 1 22 GLU CA C 8.489 -0.499 -13.401 1.00 . A A . 22 GLU CA 1 1 3 1213 1 1 22 GLU CB C 7.290 0.069 -14.183 1.00 . A A . 22 GLU CB 1 1 3 1214 1 1 22 GLU CD C 4.881 -0.386 -14.734 1.00 . A A . 22 GLU CD 1 1 3 1215 1 1 22 GLU CG C 6.222 -1.032 -14.351 1.00 . A A . 22 GLU CG 1 1 3 1216 1 1 22 GLU H H 7.518 0.100 -11.596 1.00 . A A . 22 GLU H 1 1 3 1217 1 1 22 GLU HA H 8.703 -1.492 -13.755 1.00 . A A . 22 GLU HA 1 1 3 1218 1 1 22 GLU HB2 H 6.874 0.911 -13.648 1.00 . A A . 22 GLU HB2 1 1 3 1219 1 1 22 GLU HB3 H 7.607 0.407 -15.159 1.00 . A A . 22 GLU HB3 1 1 3 1220 1 1 22 GLU HG2 H 6.517 -1.717 -15.133 1.00 . A A . 22 GLU HG2 1 1 3 1221 1 1 22 GLU HG3 H 6.101 -1.590 -13.433 1.00 . A A . 22 GLU HG3 1 1 3 1222 1 1 22 GLU N N 8.095 -0.595 -11.964 1.00 . A A . 22 GLU N 1 1 3 1223 1 1 22 GLU O O 10.196 0.488 -14.754 1.00 . A A . 22 GLU O 1 1 3 1224 1 1 22 GLU OE1 O 4.770 0.001 -15.887 1.00 . A A . 22 GLU OE1 1 1 3 1225 1 1 22 GLU OE2 O 4.039 -0.317 -13.855 1.00 . A A . 22 GLU OE2 1 1 3 1226 1 1 23 ASP C C 12.349 1.642 -11.448 1.00 . A A . 23 ASP C 1 1 3 1227 1 1 23 ASP CA C 11.447 1.842 -12.675 1.00 . A A . 23 ASP CA 1 1 3 1228 1 1 23 ASP CB C 10.949 3.294 -12.785 1.00 . A A . 23 ASP CB 1 1 3 1229 1 1 23 ASP CG C 10.229 3.723 -11.493 1.00 . A A . 23 ASP CG 1 1 3 1230 1 1 23 ASP H H 9.839 0.849 -11.706 1.00 . A A . 23 ASP H 1 1 3 1231 1 1 23 ASP HA H 12.003 1.564 -13.551 1.00 . A A . 23 ASP HA 1 1 3 1232 1 1 23 ASP HB2 H 11.777 3.958 -12.973 1.00 . A A . 23 ASP HB2 1 1 3 1233 1 1 23 ASP HB3 H 10.249 3.364 -13.606 1.00 . A A . 23 ASP HB3 1 1 3 1234 1 1 23 ASP N N 10.244 0.967 -12.582 1.00 . A A . 23 ASP N 1 1 3 1235 1 1 23 ASP O O 13.560 1.702 -11.534 1.00 . A A . 23 ASP O 1 1 3 1236 1 1 23 ASP OD1 O 9.054 3.412 -11.400 1.00 . A A . 23 ASP OD1 1 1 3 1237 1 1 23 ASP OD2 O 10.896 4.335 -10.674 1.00 . A A . 23 ASP OD2 1 1 3 1238 1 1 24 VAL C C 12.904 -0.262 -9.059 1.00 . A A . 24 VAL C 1 1 3 1239 1 1 24 VAL CA C 12.368 1.174 -9.027 1.00 . A A . 24 VAL CA 1 1 3 1240 1 1 24 VAL CB C 11.343 1.318 -7.885 1.00 . A A . 24 VAL CB 1 1 3 1241 1 1 24 VAL CG1 C 12.033 1.211 -6.508 1.00 . A A . 24 VAL CG1 1 1 3 1242 1 1 24 VAL CG2 C 10.582 2.656 -7.963 1.00 . A A . 24 VAL CG2 1 1 3 1243 1 1 24 VAL H H 10.728 1.374 -10.366 1.00 . A A . 24 VAL H 1 1 3 1244 1 1 24 VAL HA H 13.172 1.870 -8.889 1.00 . A A . 24 VAL HA 1 1 3 1245 1 1 24 VAL HB H 10.647 0.510 -7.990 1.00 . A A . 24 VAL HB 1 1 3 1246 1 1 24 VAL HG11 H 12.806 1.959 -6.413 1.00 . A A . 24 VAL HG11 1 1 3 1247 1 1 24 VAL HG12 H 11.307 1.361 -5.722 1.00 . A A . 24 VAL HG12 1 1 3 1248 1 1 24 VAL HG13 H 12.472 0.232 -6.385 1.00 . A A . 24 VAL HG13 1 1 3 1249 1 1 24 VAL HG21 H 11.266 3.489 -7.913 1.00 . A A . 24 VAL HG21 1 1 3 1250 1 1 24 VAL HG22 H 10.020 2.726 -8.880 1.00 . A A . 24 VAL HG22 1 1 3 1251 1 1 24 VAL HG23 H 9.887 2.721 -7.141 1.00 . A A . 24 VAL HG23 1 1 3 1252 1 1 24 VAL N N 11.698 1.406 -10.341 1.00 . A A . 24 VAL N 1 1 3 1253 1 1 24 VAL O O 13.980 -0.552 -8.573 1.00 . A A . 24 VAL O 1 1 3 1254 1 1 25 GLY C C 11.719 -3.348 -8.686 1.00 . A A . 25 GLY C 1 1 3 1255 1 1 25 GLY CA C 12.429 -2.556 -9.785 1.00 . A A . 25 GLY CA 1 1 3 1256 1 1 25 GLY H H 11.247 -0.772 -10.006 1.00 . A A . 25 GLY H 1 1 3 1257 1 1 25 GLY HA2 H 12.096 -2.904 -10.751 1.00 . A A . 25 GLY HA2 1 1 3 1258 1 1 25 GLY HA3 H 13.496 -2.701 -9.699 1.00 . A A . 25 GLY HA3 1 1 3 1259 1 1 25 GLY N N 12.095 -1.108 -9.648 1.00 . A A . 25 GLY N 1 1 3 1260 1 1 25 GLY O O 11.264 -4.452 -8.918 1.00 . A A . 25 GLY O 1 1 3 1261 1 1 26 SER C C 11.598 -4.752 -5.977 1.00 . A A . 26 SER C 1 1 3 1262 1 1 26 SER CA C 10.991 -3.378 -6.329 1.00 . A A . 26 SER CA 1 1 3 1263 1 1 26 SER CB C 9.470 -3.521 -6.618 1.00 . A A . 26 SER CB 1 1 3 1264 1 1 26 SER H H 12.043 -1.855 -7.424 1.00 . A A . 26 SER H 1 1 3 1265 1 1 26 SER HA H 11.136 -2.725 -5.481 1.00 . A A . 26 SER HA 1 1 3 1266 1 1 26 SER HB2 H 9.268 -3.957 -7.585 1.00 . A A . 26 SER HB2 1 1 3 1267 1 1 26 SER HB3 H 8.967 -4.086 -5.848 1.00 . A A . 26 SER HB3 1 1 3 1268 1 1 26 SER HG H 8.341 -2.110 -5.897 1.00 . A A . 26 SER HG 1 1 3 1269 1 1 26 SER N N 11.650 -2.748 -7.520 1.00 . A A . 26 SER N 1 1 3 1270 1 1 26 SER O O 11.024 -5.505 -5.212 1.00 . A A . 26 SER O 1 1 3 1271 1 1 26 SER OG O 8.994 -2.183 -6.598 1.00 . A A . 26 SER OG 1 1 3 1272 1 1 27 ASN C C 13.919 -6.407 -4.830 1.00 . A A . 27 ASN C 1 1 3 1273 1 1 27 ASN CA C 13.440 -6.340 -6.288 1.00 . A A . 27 ASN CA 1 1 3 1274 1 1 27 ASN CB C 14.647 -6.462 -7.236 1.00 . A A . 27 ASN CB 1 1 3 1275 1 1 27 ASN CG C 14.153 -6.581 -8.683 1.00 . A A . 27 ASN CG 1 1 3 1276 1 1 27 ASN H H 13.156 -4.387 -7.154 1.00 . A A . 27 ASN H 1 1 3 1277 1 1 27 ASN HA H 12.746 -7.148 -6.466 1.00 . A A . 27 ASN HA 1 1 3 1278 1 1 27 ASN HB2 H 15.282 -5.591 -7.156 1.00 . A A . 27 ASN HB2 1 1 3 1279 1 1 27 ASN HB3 H 15.227 -7.341 -6.995 1.00 . A A . 27 ASN HB3 1 1 3 1280 1 1 27 ASN HD21 H 13.924 -4.622 -8.892 1.00 . A A . 27 ASN HD21 1 1 3 1281 1 1 27 ASN HD22 H 13.524 -5.549 -10.258 1.00 . A A . 27 ASN HD22 1 1 3 1282 1 1 27 ASN N N 12.745 -5.037 -6.547 1.00 . A A . 27 ASN N 1 1 3 1283 1 1 27 ASN ND2 N 13.841 -5.494 -9.333 1.00 . A A . 27 ASN ND2 1 1 3 1284 1 1 27 ASN O O 14.113 -7.478 -4.287 1.00 . A A . 27 ASN O 1 1 3 1285 1 1 27 ASN OD1 O 14.047 -7.660 -9.234 1.00 . A A . 27 ASN OD1 1 1 3 1286 1 1 28 LYS C C 13.835 -3.937 -2.140 1.00 . A A . 28 LYS C 1 1 3 1287 1 1 28 LYS CA C 14.553 -5.113 -2.837 1.00 . A A . 28 LYS CA 1 1 3 1288 1 1 28 LYS CB C 16.087 -4.890 -2.836 1.00 . A A . 28 LYS CB 1 1 3 1289 1 1 28 LYS CD C 17.925 -3.596 -4.009 1.00 . A A . 28 LYS CD 1 1 3 1290 1 1 28 LYS CE C 18.449 -2.160 -4.222 1.00 . A A . 28 LYS CE 1 1 3 1291 1 1 28 LYS CG C 16.453 -3.553 -3.535 1.00 . A A . 28 LYS CG 1 1 3 1292 1 1 28 LYS H H 13.913 -4.430 -4.770 1.00 . A A . 28 LYS H 1 1 3 1293 1 1 28 LYS HA H 14.317 -6.023 -2.303 1.00 . A A . 28 LYS HA 1 1 3 1294 1 1 28 LYS HB2 H 16.445 -4.872 -1.817 1.00 . A A . 28 LYS HB2 1 1 3 1295 1 1 28 LYS HB3 H 16.561 -5.716 -3.347 1.00 . A A . 28 LYS HB3 1 1 3 1296 1 1 28 LYS HD2 H 18.539 -4.094 -3.274 1.00 . A A . 28 LYS HD2 1 1 3 1297 1 1 28 LYS HD3 H 17.989 -4.143 -4.939 1.00 . A A . 28 LYS HD3 1 1 3 1298 1 1 28 LYS HE2 H 18.419 -1.608 -3.295 1.00 . A A . 28 LYS HE2 1 1 3 1299 1 1 28 LYS HE3 H 19.470 -2.186 -4.577 1.00 . A A . 28 LYS HE3 1 1 3 1300 1 1 28 LYS HG2 H 15.811 -3.387 -4.388 1.00 . A A . 28 LYS HG2 1 1 3 1301 1 1 28 LYS HG3 H 16.314 -2.738 -2.839 1.00 . A A . 28 LYS HG3 1 1 3 1302 1 1 28 LYS HZ1 H 16.859 -2.078 -5.568 1.00 . A A . 28 LYS HZ1 1 1 3 1303 1 1 28 LYS HZ2 H 17.190 -0.604 -4.794 1.00 . A A . 28 LYS HZ2 1 1 3 1304 1 1 28 LYS HZ3 H 18.209 -1.159 -6.034 1.00 . A A . 28 LYS HZ3 1 1 3 1305 1 1 28 LYS N N 14.091 -5.244 -4.255 1.00 . A A . 28 LYS N 1 1 3 1306 1 1 28 LYS NZ N 17.614 -1.447 -5.231 1.00 . A A . 28 LYS NZ 1 1 3 1307 1 1 28 LYS O O 13.311 -3.097 -2.857 1.00 . A A . 28 LYS O 1 1 3 1308 1 1 28 LYS OXT O 13.850 -3.944 -0.920 1.00 . A A . 28 LYS OXT 1 1 4 1309 1 1 1 ASP C C -17.845 12.496 -9.190 1.00 . A A . 1 ASP C 1 1 4 1310 1 1 1 ASP CA C -18.068 13.950 -8.747 1.00 . A A . 1 ASP CA 1 1 4 1311 1 1 1 ASP CB C -18.748 13.970 -7.352 1.00 . A A . 1 ASP CB 1 1 4 1312 1 1 1 ASP CG C -19.988 13.047 -7.357 1.00 . A A . 1 ASP CG 1 1 4 1313 1 1 1 ASP H1 H -19.190 14.005 -10.504 1.00 . A A . 1 ASP H1 1 1 4 1314 1 1 1 ASP H2 H -19.796 14.990 -9.263 1.00 . A A . 1 ASP H2 1 1 4 1315 1 1 1 ASP H3 H -18.415 15.470 -10.130 1.00 . A A . 1 ASP H3 1 1 4 1316 1 1 1 ASP HA H -17.111 14.450 -8.702 1.00 . A A . 1 ASP HA 1 1 4 1317 1 1 1 ASP HB2 H -18.055 13.634 -6.594 1.00 . A A . 1 ASP HB2 1 1 4 1318 1 1 1 ASP HB3 H -19.059 14.976 -7.109 1.00 . A A . 1 ASP HB3 1 1 4 1319 1 1 1 ASP N N -18.931 14.658 -9.736 1.00 . A A . 1 ASP N 1 1 4 1320 1 1 1 ASP O O -18.209 12.115 -10.287 1.00 . A A . 1 ASP O 1 1 4 1321 1 1 1 ASP OD1 O -21.010 13.521 -7.823 1.00 . A A . 1 ASP OD1 1 1 4 1322 1 1 1 ASP OD2 O -19.843 11.923 -6.899 1.00 . A A . 1 ASP OD2 1 1 4 1323 1 1 2 ALA C C -18.185 9.521 -8.129 1.00 . A A . 2 ALA C 1 1 4 1324 1 1 2 ALA CA C -16.974 10.298 -8.614 1.00 . A A . 2 ALA CA 1 1 4 1325 1 1 2 ALA CB C -15.748 9.788 -7.861 1.00 . A A . 2 ALA CB 1 1 4 1326 1 1 2 ALA H H -16.973 12.104 -7.448 1.00 . A A . 2 ALA H 1 1 4 1327 1 1 2 ALA HA H -16.850 10.158 -9.679 1.00 . A A . 2 ALA HA 1 1 4 1328 1 1 2 ALA HB1 H -15.842 10.007 -6.807 1.00 . A A . 2 ALA HB1 1 1 4 1329 1 1 2 ALA HB2 H -15.684 8.713 -7.980 1.00 . A A . 2 ALA HB2 1 1 4 1330 1 1 2 ALA HB3 H -14.851 10.239 -8.250 1.00 . A A . 2 ALA HB3 1 1 4 1331 1 1 2 ALA N N -17.244 11.732 -8.311 1.00 . A A . 2 ALA N 1 1 4 1332 1 1 2 ALA O O -18.363 9.332 -6.939 1.00 . A A . 2 ALA O 1 1 4 1333 1 1 3 GLU C C -19.665 7.054 -8.024 1.00 . A A . 3 GLU C 1 1 4 1334 1 1 3 GLU CA C -20.203 8.318 -8.696 1.00 . A A . 3 GLU CA 1 1 4 1335 1 1 3 GLU CB C -20.986 7.992 -9.977 1.00 . A A . 3 GLU CB 1 1 4 1336 1 1 3 GLU CD C -20.901 10.434 -10.648 1.00 . A A . 3 GLU CD 1 1 4 1337 1 1 3 GLU CG C -21.824 9.222 -10.406 1.00 . A A . 3 GLU CG 1 1 4 1338 1 1 3 GLU H H -18.796 9.292 -10.004 1.00 . A A . 3 GLU H 1 1 4 1339 1 1 3 GLU HA H -20.800 8.886 -7.995 1.00 . A A . 3 GLU HA 1 1 4 1340 1 1 3 GLU HB2 H -20.289 7.736 -10.760 1.00 . A A . 3 GLU HB2 1 1 4 1341 1 1 3 GLU HB3 H -21.642 7.152 -9.805 1.00 . A A . 3 GLU HB3 1 1 4 1342 1 1 3 GLU HG2 H -22.357 9.001 -11.318 1.00 . A A . 3 GLU HG2 1 1 4 1343 1 1 3 GLU HG3 H -22.544 9.466 -9.638 1.00 . A A . 3 GLU HG3 1 1 4 1344 1 1 3 GLU N N -18.989 9.097 -9.065 1.00 . A A . 3 GLU N 1 1 4 1345 1 1 3 GLU O O -18.921 6.303 -8.626 1.00 . A A . 3 GLU O 1 1 4 1346 1 1 3 GLU OE1 O -20.247 10.421 -11.679 1.00 . A A . 3 GLU OE1 1 1 4 1347 1 1 3 GLU OE2 O -20.898 11.301 -9.788 1.00 . A A . 3 GLU OE2 1 1 4 1348 1 1 4 PHE C C -20.467 4.466 -6.342 1.00 . A A . 4 PHE C 1 1 4 1349 1 1 4 PHE CA C -19.623 5.699 -5.983 1.00 . A A . 4 PHE CA 1 1 4 1350 1 1 4 PHE CB C -19.767 6.083 -4.487 1.00 . A A . 4 PHE CB 1 1 4 1351 1 1 4 PHE CD1 C -17.755 7.591 -4.108 1.00 . A A . 4 PHE CD1 1 1 4 1352 1 1 4 PHE CD2 C -19.908 8.609 -4.233 1.00 . A A . 4 PHE CD2 1 1 4 1353 1 1 4 PHE CE1 C -17.182 8.832 -3.920 1.00 . A A . 4 PHE CE1 1 1 4 1354 1 1 4 PHE CE2 C -19.334 9.850 -4.045 1.00 . A A . 4 PHE CE2 1 1 4 1355 1 1 4 PHE CG C -19.124 7.467 -4.267 1.00 . A A . 4 PHE CG 1 1 4 1356 1 1 4 PHE CZ C -17.970 9.961 -3.889 1.00 . A A . 4 PHE CZ 1 1 4 1357 1 1 4 PHE H H -20.650 7.547 -6.387 1.00 . A A . 4 PHE H 1 1 4 1358 1 1 4 PHE HA H -18.587 5.484 -6.203 1.00 . A A . 4 PHE HA 1 1 4 1359 1 1 4 PHE HB2 H -20.809 6.128 -4.205 1.00 . A A . 4 PHE HB2 1 1 4 1360 1 1 4 PHE HB3 H -19.265 5.358 -3.863 1.00 . A A . 4 PHE HB3 1 1 4 1361 1 1 4 PHE HD1 H -17.130 6.711 -4.130 1.00 . A A . 4 PHE HD1 1 1 4 1362 1 1 4 PHE HD2 H -20.978 8.530 -4.355 1.00 . A A . 4 PHE HD2 1 1 4 1363 1 1 4 PHE HE1 H -16.112 8.917 -3.796 1.00 . A A . 4 PHE HE1 1 1 4 1364 1 1 4 PHE HE2 H -19.955 10.733 -4.022 1.00 . A A . 4 PHE HE2 1 1 4 1365 1 1 4 PHE HZ H -17.520 10.932 -3.742 1.00 . A A . 4 PHE HZ 1 1 4 1366 1 1 4 PHE N N -20.058 6.881 -6.791 1.00 . A A . 4 PHE N 1 1 4 1367 1 1 4 PHE O O -21.068 3.824 -5.501 1.00 . A A . 4 PHE O 1 1 4 1368 1 1 5 ARG C C -20.220 1.894 -8.461 1.00 . A A . 5 ARG C 1 1 4 1369 1 1 5 ARG CA C -21.211 3.036 -8.196 1.00 . A A . 5 ARG CA 1 1 4 1370 1 1 5 ARG CB C -21.912 3.507 -9.512 1.00 . A A . 5 ARG CB 1 1 4 1371 1 1 5 ARG CD C -21.654 4.680 -11.746 1.00 . A A . 5 ARG CD 1 1 4 1372 1 1 5 ARG CG C -20.907 4.169 -10.496 1.00 . A A . 5 ARG CG 1 1 4 1373 1 1 5 ARG CZ C -21.506 6.765 -13.039 1.00 . A A . 5 ARG CZ 1 1 4 1374 1 1 5 ARG H H -19.948 4.756 -8.219 1.00 . A A . 5 ARG H 1 1 4 1375 1 1 5 ARG HA H -21.947 2.710 -7.484 1.00 . A A . 5 ARG HA 1 1 4 1376 1 1 5 ARG HB2 H -22.382 2.661 -9.992 1.00 . A A . 5 ARG HB2 1 1 4 1377 1 1 5 ARG HB3 H -22.683 4.219 -9.256 1.00 . A A . 5 ARG HB3 1 1 4 1378 1 1 5 ARG HD2 H -21.662 3.926 -12.520 1.00 . A A . 5 ARG HD2 1 1 4 1379 1 1 5 ARG HD3 H -22.672 4.951 -11.499 1.00 . A A . 5 ARG HD3 1 1 4 1380 1 1 5 ARG HE H -20.000 6.033 -11.983 1.00 . A A . 5 ARG HE 1 1 4 1381 1 1 5 ARG HG2 H -20.419 5.001 -10.015 1.00 . A A . 5 ARG HG2 1 1 4 1382 1 1 5 ARG HG3 H -20.151 3.459 -10.798 1.00 . A A . 5 ARG HG3 1 1 4 1383 1 1 5 ARG HH11 H -23.273 5.817 -13.117 1.00 . A A . 5 ARG HH11 1 1 4 1384 1 1 5 ARG HH12 H -23.169 7.287 -14.023 1.00 . A A . 5 ARG HH12 1 1 4 1385 1 1 5 ARG HH21 H -19.855 7.896 -13.122 1.00 . A A . 5 ARG HH21 1 1 4 1386 1 1 5 ARG HH22 H -21.211 8.479 -14.028 1.00 . A A . 5 ARG HH22 1 1 4 1387 1 1 5 ARG N N -20.463 4.188 -7.620 1.00 . A A . 5 ARG N 1 1 4 1388 1 1 5 ARG NE N -20.932 5.889 -12.251 1.00 . A A . 5 ARG NE 1 1 4 1389 1 1 5 ARG NH1 N -22.746 6.609 -13.421 1.00 . A A . 5 ARG NH1 1 1 4 1390 1 1 5 ARG NH2 N -20.802 7.793 -13.427 1.00 . A A . 5 ARG NH2 1 1 4 1391 1 1 5 ARG O O -20.182 1.317 -9.531 1.00 . A A . 5 ARG O 1 1 4 1392 1 1 6 HIS C C -17.372 0.821 -8.619 1.00 . A A . 6 HIS C 1 1 4 1393 1 1 6 HIS CA C -18.406 0.520 -7.515 1.00 . A A . 6 HIS CA 1 1 4 1394 1 1 6 HIS CB C -19.101 -0.849 -7.802 1.00 . A A . 6 HIS CB 1 1 4 1395 1 1 6 HIS CD2 C -21.738 -1.019 -7.594 1.00 . A A . 6 HIS CD2 1 1 4 1396 1 1 6 HIS CE1 C -21.885 -0.960 -5.526 1.00 . A A . 6 HIS CE1 1 1 4 1397 1 1 6 HIS CG C -20.455 -0.918 -7.083 1.00 . A A . 6 HIS CG 1 1 4 1398 1 1 6 HIS H H -19.536 2.121 -6.616 1.00 . A A . 6 HIS H 1 1 4 1399 1 1 6 HIS HA H -17.890 0.477 -6.566 1.00 . A A . 6 HIS HA 1 1 4 1400 1 1 6 HIS HB2 H -19.265 -0.983 -8.862 1.00 . A A . 6 HIS HB2 1 1 4 1401 1 1 6 HIS HB3 H -18.481 -1.657 -7.442 1.00 . A A . 6 HIS HB3 1 1 4 1402 1 1 6 HIS HD1 H -19.903 -0.817 -5.141 1.00 . A A . 6 HIS HD1 1 1 4 1403 1 1 6 HIS HD2 H -21.985 -1.069 -8.644 1.00 . A A . 6 HIS HD2 1 1 4 1404 1 1 6 HIS HE1 H -22.288 -0.953 -4.524 1.00 . A A . 6 HIS HE1 1 1 4 1405 1 1 6 HIS N N -19.440 1.608 -7.445 1.00 . A A . 6 HIS N 1 1 4 1406 1 1 6 HIS ND1 N -20.622 -0.887 -5.803 1.00 . A A . 6 HIS ND1 1 1 4 1407 1 1 6 HIS NE2 N -22.616 -1.044 -6.610 1.00 . A A . 6 HIS NE2 1 1 4 1408 1 1 6 HIS O O -16.657 -0.059 -9.059 1.00 . A A . 6 HIS O 1 1 4 1409 1 1 7 ASP C C -16.690 1.771 -11.370 1.00 . A A . 7 ASP C 1 1 4 1410 1 1 7 ASP CA C -16.407 2.557 -10.086 1.00 . A A . 7 ASP CA 1 1 4 1411 1 1 7 ASP CB C -14.923 2.358 -9.614 1.00 . A A . 7 ASP CB 1 1 4 1412 1 1 7 ASP CG C -13.902 3.064 -10.545 1.00 . A A . 7 ASP CG 1 1 4 1413 1 1 7 ASP H H -17.950 2.718 -8.622 1.00 . A A . 7 ASP H 1 1 4 1414 1 1 7 ASP HA H -16.615 3.603 -10.263 1.00 . A A . 7 ASP HA 1 1 4 1415 1 1 7 ASP HB2 H -14.811 2.761 -8.618 1.00 . A A . 7 ASP HB2 1 1 4 1416 1 1 7 ASP HB3 H -14.679 1.306 -9.581 1.00 . A A . 7 ASP HB3 1 1 4 1417 1 1 7 ASP N N -17.338 2.070 -9.024 1.00 . A A . 7 ASP N 1 1 4 1418 1 1 7 ASP O O -15.819 1.146 -11.943 1.00 . A A . 7 ASP O 1 1 4 1419 1 1 7 ASP OD1 O -14.316 3.685 -11.513 1.00 . A A . 7 ASP OD1 1 1 4 1420 1 1 7 ASP OD2 O -12.732 2.936 -10.227 1.00 . A A . 7 ASP OD2 1 1 4 1421 1 1 8 SER C C -18.050 1.969 -14.252 1.00 . A A . 8 SER C 1 1 4 1422 1 1 8 SER CA C -18.403 1.143 -13.000 1.00 . A A . 8 SER CA 1 1 4 1423 1 1 8 SER CB C -19.928 0.937 -12.879 1.00 . A A . 8 SER CB 1 1 4 1424 1 1 8 SER H H -18.569 2.375 -11.247 1.00 . A A . 8 SER H 1 1 4 1425 1 1 8 SER HA H -17.904 0.189 -13.052 1.00 . A A . 8 SER HA 1 1 4 1426 1 1 8 SER HB2 H -20.432 1.833 -12.549 1.00 . A A . 8 SER HB2 1 1 4 1427 1 1 8 SER HB3 H -20.361 0.583 -13.805 1.00 . A A . 8 SER HB3 1 1 4 1428 1 1 8 SER HG H -20.502 -0.824 -12.284 1.00 . A A . 8 SER HG 1 1 4 1429 1 1 8 SER N N -17.935 1.845 -11.769 1.00 . A A . 8 SER N 1 1 4 1430 1 1 8 SER O O -18.897 2.336 -15.045 1.00 . A A . 8 SER O 1 1 4 1431 1 1 8 SER OG O -20.057 -0.071 -11.888 1.00 . A A . 8 SER OG 1 1 4 1432 1 1 9 GLY C C -14.701 3.130 -15.416 1.00 . A A . 9 GLY C 1 1 4 1433 1 1 9 GLY CA C -16.226 3.017 -15.516 1.00 . A A . 9 GLY CA 1 1 4 1434 1 1 9 GLY H H -16.162 1.900 -13.688 1.00 . A A . 9 GLY H 1 1 4 1435 1 1 9 GLY HA2 H -16.478 2.526 -16.444 1.00 . A A . 9 GLY HA2 1 1 4 1436 1 1 9 GLY HA3 H -16.650 4.011 -15.504 1.00 . A A . 9 GLY HA3 1 1 4 1437 1 1 9 GLY N N -16.776 2.231 -14.372 1.00 . A A . 9 GLY N 1 1 4 1438 1 1 9 GLY O O -14.078 3.703 -16.289 1.00 . A A . 9 GLY O 1 1 4 1439 1 1 10 TYR C C -12.252 1.672 -13.039 1.00 . A A . 10 TYR C 1 1 4 1440 1 1 10 TYR CA C -12.665 2.636 -14.158 1.00 . A A . 10 TYR CA 1 1 4 1441 1 1 10 TYR CB C -12.252 4.089 -13.786 1.00 . A A . 10 TYR CB 1 1 4 1442 1 1 10 TYR CD1 C -10.940 4.814 -15.825 1.00 . A A . 10 TYR CD1 1 1 4 1443 1 1 10 TYR CD2 C -9.739 4.397 -13.812 1.00 . A A . 10 TYR CD2 1 1 4 1444 1 1 10 TYR CE1 C -9.762 5.130 -16.463 1.00 . A A . 10 TYR CE1 1 1 4 1445 1 1 10 TYR CE2 C -8.560 4.715 -14.452 1.00 . A A . 10 TYR CE2 1 1 4 1446 1 1 10 TYR CG C -10.939 4.444 -14.494 1.00 . A A . 10 TYR CG 1 1 4 1447 1 1 10 TYR CZ C -8.563 5.083 -15.782 1.00 . A A . 10 TYR CZ 1 1 4 1448 1 1 10 TYR H H -14.689 2.133 -13.688 1.00 . A A . 10 TYR H 1 1 4 1449 1 1 10 TYR HA H -12.192 2.312 -15.072 1.00 . A A . 10 TYR HA 1 1 4 1450 1 1 10 TYR HB2 H -13.011 4.794 -14.093 1.00 . A A . 10 TYR HB2 1 1 4 1451 1 1 10 TYR HB3 H -12.106 4.190 -12.721 1.00 . A A . 10 TYR HB3 1 1 4 1452 1 1 10 TYR HD1 H -11.869 4.857 -16.374 1.00 . A A . 10 TYR HD1 1 1 4 1453 1 1 10 TYR HD2 H -9.720 4.111 -12.771 1.00 . A A . 10 TYR HD2 1 1 4 1454 1 1 10 TYR HE1 H -9.784 5.417 -17.505 1.00 . A A . 10 TYR HE1 1 1 4 1455 1 1 10 TYR HE2 H -7.631 4.672 -13.905 1.00 . A A . 10 TYR HE2 1 1 4 1456 1 1 10 TYR HH H -7.075 4.615 -16.879 1.00 . A A . 10 TYR HH 1 1 4 1457 1 1 10 TYR N N -14.143 2.586 -14.360 1.00 . A A . 10 TYR N 1 1 4 1458 1 1 10 TYR O O -13.077 0.996 -12.454 1.00 . A A . 10 TYR O 1 1 4 1459 1 1 10 TYR OH O -7.383 5.401 -16.420 1.00 . A A . 10 TYR OH 1 1 4 1460 1 1 11 GLU C C -8.919 1.166 -11.572 1.00 . A A . 11 GLU C 1 1 4 1461 1 1 11 GLU CA C -10.385 0.774 -11.729 1.00 . A A . 11 GLU CA 1 1 4 1462 1 1 11 GLU CB C -10.485 -0.718 -12.142 1.00 . A A . 11 GLU CB 1 1 4 1463 1 1 11 GLU CD C -9.428 -2.942 -11.571 1.00 . A A . 11 GLU CD 1 1 4 1464 1 1 11 GLU CG C -9.911 -1.598 -11.000 1.00 . A A . 11 GLU CG 1 1 4 1465 1 1 11 GLU H H -10.369 2.223 -13.306 1.00 . A A . 11 GLU H 1 1 4 1466 1 1 11 GLU HA H -10.893 0.959 -10.792 1.00 . A A . 11 GLU HA 1 1 4 1467 1 1 11 GLU HB2 H -11.518 -0.986 -12.309 1.00 . A A . 11 GLU HB2 1 1 4 1468 1 1 11 GLU HB3 H -9.938 -0.881 -13.060 1.00 . A A . 11 GLU HB3 1 1 4 1469 1 1 11 GLU HG2 H -9.076 -1.113 -10.516 1.00 . A A . 11 GLU HG2 1 1 4 1470 1 1 11 GLU HG3 H -10.674 -1.775 -10.256 1.00 . A A . 11 GLU HG3 1 1 4 1471 1 1 11 GLU N N -10.969 1.648 -12.787 1.00 . A A . 11 GLU N 1 1 4 1472 1 1 11 GLU O O -8.065 0.775 -12.346 1.00 . A A . 11 GLU O 1 1 4 1473 1 1 11 GLU OE1 O -8.339 -2.936 -12.122 1.00 . A A . 11 GLU OE1 1 1 4 1474 1 1 11 GLU OE2 O -10.170 -3.899 -11.421 1.00 . A A . 11 GLU OE2 1 1 4 1475 1 1 12 VAL C C -6.473 1.260 -9.703 1.00 . A A . 12 VAL C 1 1 4 1476 1 1 12 VAL CA C -7.318 2.425 -10.241 1.00 . A A . 12 VAL CA 1 1 4 1477 1 1 12 VAL CB C -7.459 3.554 -9.217 1.00 . A A . 12 VAL CB 1 1 4 1478 1 1 12 VAL CG1 C -6.081 3.989 -8.661 1.00 . A A . 12 VAL CG1 1 1 4 1479 1 1 12 VAL CG2 C -8.149 4.767 -9.886 1.00 . A A . 12 VAL CG2 1 1 4 1480 1 1 12 VAL H H -9.432 2.220 -9.977 1.00 . A A . 12 VAL H 1 1 4 1481 1 1 12 VAL HA H -6.881 2.803 -11.139 1.00 . A A . 12 VAL HA 1 1 4 1482 1 1 12 VAL HB H -8.090 3.173 -8.437 1.00 . A A . 12 VAL HB 1 1 4 1483 1 1 12 VAL HG11 H -5.375 4.126 -9.467 1.00 . A A . 12 VAL HG11 1 1 4 1484 1 1 12 VAL HG12 H -6.173 4.917 -8.117 1.00 . A A . 12 VAL HG12 1 1 4 1485 1 1 12 VAL HG13 H -5.699 3.235 -7.989 1.00 . A A . 12 VAL HG13 1 1 4 1486 1 1 12 VAL HG21 H -7.572 5.113 -10.731 1.00 . A A . 12 VAL HG21 1 1 4 1487 1 1 12 VAL HG22 H -9.135 4.491 -10.231 1.00 . A A . 12 VAL HG22 1 1 4 1488 1 1 12 VAL HG23 H -8.248 5.577 -9.178 1.00 . A A . 12 VAL HG23 1 1 4 1489 1 1 12 VAL N N -8.690 1.944 -10.551 1.00 . A A . 12 VAL N 1 1 4 1490 1 1 12 VAL O O -5.267 1.236 -9.870 1.00 . A A . 12 VAL O 1 1 4 1491 1 1 13 HIS C C -5.204 -0.558 -7.711 1.00 . A A . 13 HIS C 1 1 4 1492 1 1 13 HIS CA C -6.505 -0.885 -8.472 1.00 . A A . 13 HIS CA 1 1 4 1493 1 1 13 HIS CB C -6.230 -1.883 -9.630 1.00 . A A . 13 HIS CB 1 1 4 1494 1 1 13 HIS CD2 C -6.030 -4.429 -8.925 1.00 . A A . 13 HIS CD2 1 1 4 1495 1 1 13 HIS CE1 C -8.054 -4.859 -8.783 1.00 . A A . 13 HIS CE1 1 1 4 1496 1 1 13 HIS CG C -6.727 -3.275 -9.238 1.00 . A A . 13 HIS CG 1 1 4 1497 1 1 13 HIS H H -8.121 0.446 -8.982 1.00 . A A . 13 HIS H 1 1 4 1498 1 1 13 HIS HA H -7.203 -1.312 -7.766 1.00 . A A . 13 HIS HA 1 1 4 1499 1 1 13 HIS HB2 H -6.752 -1.575 -10.523 1.00 . A A . 13 HIS HB2 1 1 4 1500 1 1 13 HIS HB3 H -5.176 -1.942 -9.859 1.00 . A A . 13 HIS HB3 1 1 4 1501 1 1 13 HIS HD1 H -8.732 -3.020 -9.286 1.00 . A A . 13 HIS HD1 1 1 4 1502 1 1 13 HIS HD2 H -4.954 -4.518 -8.913 1.00 . A A . 13 HIS HD2 1 1 4 1503 1 1 13 HIS HE1 H -8.986 -5.382 -8.627 1.00 . A A . 13 HIS HE1 1 1 4 1504 1 1 13 HIS N N -7.152 0.334 -9.068 1.00 . A A . 13 HIS N 1 1 4 1505 1 1 13 HIS ND1 N -7.969 -3.615 -9.129 1.00 . A A . 13 HIS ND1 1 1 4 1506 1 1 13 HIS NE2 N -6.871 -5.406 -8.645 1.00 . A A . 13 HIS NE2 1 1 4 1507 1 1 13 HIS O O -4.329 -1.394 -7.589 1.00 . A A . 13 HIS O 1 1 4 1508 1 1 14 HIS C C -2.632 0.702 -6.985 1.00 . A A . 14 HIS C 1 1 4 1509 1 1 14 HIS CA C -3.976 1.203 -6.458 1.00 . A A . 14 HIS CA 1 1 4 1510 1 1 14 HIS CB C -4.160 0.829 -4.952 1.00 . A A . 14 HIS CB 1 1 4 1511 1 1 14 HIS CD2 C -5.372 -1.499 -4.576 1.00 . A A . 14 HIS CD2 1 1 4 1512 1 1 14 HIS CE1 C -3.696 -2.720 -4.600 1.00 . A A . 14 HIS CE1 1 1 4 1513 1 1 14 HIS CG C -4.265 -0.690 -4.770 1.00 . A A . 14 HIS CG 1 1 4 1514 1 1 14 HIS H H -5.911 1.253 -7.376 1.00 . A A . 14 HIS H 1 1 4 1515 1 1 14 HIS HA H -3.971 2.265 -6.613 1.00 . A A . 14 HIS HA 1 1 4 1516 1 1 14 HIS HB2 H -3.323 1.189 -4.370 1.00 . A A . 14 HIS HB2 1 1 4 1517 1 1 14 HIS HB3 H -5.062 1.285 -4.571 1.00 . A A . 14 HIS HB3 1 1 4 1518 1 1 14 HIS HD1 H -2.328 -1.256 -4.893 1.00 . A A . 14 HIS HD1 1 1 4 1519 1 1 14 HIS HD2 H -6.392 -1.149 -4.517 1.00 . A A . 14 HIS HD2 1 1 4 1520 1 1 14 HIS HE1 H -3.056 -3.589 -4.565 1.00 . A A . 14 HIS HE1 1 1 4 1521 1 1 14 HIS N N -5.145 0.662 -7.226 1.00 . A A . 14 HIS N 1 1 4 1522 1 1 14 HIS ND1 N -3.267 -1.511 -4.774 1.00 . A A . 14 HIS ND1 1 1 4 1523 1 1 14 HIS NE2 N -4.998 -2.759 -4.472 1.00 . A A . 14 HIS NE2 1 1 4 1524 1 1 14 HIS O O -1.722 0.353 -6.259 1.00 . A A . 14 HIS O 1 1 4 1525 1 1 15 GLN C C -0.139 1.169 -8.894 1.00 . A A . 15 GLN C 1 1 4 1526 1 1 15 GLN CA C -1.355 0.250 -9.012 1.00 . A A . 15 GLN CA 1 1 4 1527 1 1 15 GLN CB C -1.784 0.064 -10.476 1.00 . A A . 15 GLN CB 1 1 4 1528 1 1 15 GLN CD C -0.857 2.150 -11.619 1.00 . A A . 15 GLN CD 1 1 4 1529 1 1 15 GLN CG C -2.132 1.421 -11.160 1.00 . A A . 15 GLN CG 1 1 4 1530 1 1 15 GLN H H -3.348 1.002 -8.805 1.00 . A A . 15 GLN H 1 1 4 1531 1 1 15 GLN HA H -1.063 -0.685 -8.575 1.00 . A A . 15 GLN HA 1 1 4 1532 1 1 15 GLN HB2 H -1.011 -0.454 -11.015 1.00 . A A . 15 GLN HB2 1 1 4 1533 1 1 15 GLN HB3 H -2.678 -0.544 -10.471 1.00 . A A . 15 GLN HB3 1 1 4 1534 1 1 15 GLN HE21 H -0.255 0.659 -12.785 1.00 . A A . 15 GLN HE21 1 1 4 1535 1 1 15 GLN HE22 H 0.768 2.015 -12.751 1.00 . A A . 15 GLN HE22 1 1 4 1536 1 1 15 GLN HG2 H -2.752 1.242 -12.026 1.00 . A A . 15 GLN HG2 1 1 4 1537 1 1 15 GLN HG3 H -2.672 2.063 -10.478 1.00 . A A . 15 GLN HG3 1 1 4 1538 1 1 15 GLN N N -2.571 0.702 -8.288 1.00 . A A . 15 GLN N 1 1 4 1539 1 1 15 GLN NE2 N -0.048 1.558 -12.455 1.00 . A A . 15 GLN NE2 1 1 4 1540 1 1 15 GLN O O 0.822 1.027 -9.617 1.00 . A A . 15 GLN O 1 1 4 1541 1 1 15 GLN OE1 O -0.585 3.263 -11.216 1.00 . A A . 15 GLN OE1 1 1 4 1542 1 1 16 PHE C C 2.246 2.308 -7.476 1.00 . A A . 16 PHE C 1 1 4 1543 1 1 16 PHE CA C 0.937 3.047 -7.773 1.00 . A A . 16 PHE CA 1 1 4 1544 1 1 16 PHE CB C 0.653 3.987 -6.587 1.00 . A A . 16 PHE CB 1 1 4 1545 1 1 16 PHE CD1 C -1.605 4.832 -7.373 1.00 . A A . 16 PHE CD1 1 1 4 1546 1 1 16 PHE CD2 C -1.467 3.863 -5.198 1.00 . A A . 16 PHE CD2 1 1 4 1547 1 1 16 PHE CE1 C -2.952 5.060 -7.188 1.00 . A A . 16 PHE CE1 1 1 4 1548 1 1 16 PHE CE2 C -2.815 4.091 -5.013 1.00 . A A . 16 PHE CE2 1 1 4 1549 1 1 16 PHE CG C -0.851 4.233 -6.382 1.00 . A A . 16 PHE CG 1 1 4 1550 1 1 16 PHE CZ C -3.558 4.690 -6.008 1.00 . A A . 16 PHE CZ 1 1 4 1551 1 1 16 PHE H H -1.005 2.122 -7.424 1.00 . A A . 16 PHE H 1 1 4 1552 1 1 16 PHE HA H 1.065 3.620 -8.677 1.00 . A A . 16 PHE HA 1 1 4 1553 1 1 16 PHE HB2 H 1.065 3.568 -5.681 1.00 . A A . 16 PHE HB2 1 1 4 1554 1 1 16 PHE HB3 H 1.135 4.935 -6.776 1.00 . A A . 16 PHE HB3 1 1 4 1555 1 1 16 PHE HD1 H -1.133 5.122 -8.301 1.00 . A A . 16 PHE HD1 1 1 4 1556 1 1 16 PHE HD2 H -0.892 3.391 -4.413 1.00 . A A . 16 PHE HD2 1 1 4 1557 1 1 16 PHE HE1 H -3.532 5.528 -7.970 1.00 . A A . 16 PHE HE1 1 1 4 1558 1 1 16 PHE HE2 H -3.288 3.801 -4.086 1.00 . A A . 16 PHE HE2 1 1 4 1559 1 1 16 PHE HZ H -4.613 4.868 -5.861 1.00 . A A . 16 PHE HZ 1 1 4 1560 1 1 16 PHE N N -0.200 2.086 -7.975 1.00 . A A . 16 PHE N 1 1 4 1561 1 1 16 PHE O O 3.318 2.711 -7.886 1.00 . A A . 16 PHE O 1 1 4 1562 1 1 17 LEU C C 3.841 -0.254 -7.614 1.00 . A A . 17 LEU C 1 1 4 1563 1 1 17 LEU CA C 3.246 0.376 -6.370 1.00 . A A . 17 LEU CA 1 1 4 1564 1 1 17 LEU CB C 2.734 -0.689 -5.391 1.00 . A A . 17 LEU CB 1 1 4 1565 1 1 17 LEU CD1 C 0.560 0.137 -4.306 1.00 . A A . 17 LEU CD1 1 1 4 1566 1 1 17 LEU CD2 C 2.440 -0.741 -2.869 1.00 . A A . 17 LEU CD2 1 1 4 1567 1 1 17 LEU CG C 2.101 0.033 -4.157 1.00 . A A . 17 LEU CG 1 1 4 1568 1 1 17 LEU H H 1.197 0.956 -6.494 1.00 . A A . 17 LEU H 1 1 4 1569 1 1 17 LEU HA H 3.988 1.001 -5.903 1.00 . A A . 17 LEU HA 1 1 4 1570 1 1 17 LEU HB2 H 2.006 -1.314 -5.889 1.00 . A A . 17 LEU HB2 1 1 4 1571 1 1 17 LEU HB3 H 3.565 -1.309 -5.086 1.00 . A A . 17 LEU HB3 1 1 4 1572 1 1 17 LEU HD11 H 0.161 -0.723 -4.823 1.00 . A A . 17 LEU HD11 1 1 4 1573 1 1 17 LEU HD12 H 0.088 0.205 -3.336 1.00 . A A . 17 LEU HD12 1 1 4 1574 1 1 17 LEU HD13 H 0.305 1.027 -4.862 1.00 . A A . 17 LEU HD13 1 1 4 1575 1 1 17 LEU HD21 H 3.512 -0.797 -2.744 1.00 . A A . 17 LEU HD21 1 1 4 1576 1 1 17 LEU HD22 H 2.019 -0.233 -2.013 1.00 . A A . 17 LEU HD22 1 1 4 1577 1 1 17 LEU HD23 H 2.038 -1.742 -2.916 1.00 . A A . 17 LEU HD23 1 1 4 1578 1 1 17 LEU HG H 2.506 1.034 -4.086 1.00 . A A . 17 LEU HG 1 1 4 1579 1 1 17 LEU N N 2.093 1.225 -6.765 1.00 . A A . 17 LEU N 1 1 4 1580 1 1 17 LEU O O 5.040 -0.390 -7.749 1.00 . A A . 17 LEU O 1 1 4 1581 1 1 18 VAL C C 4.099 -0.172 -10.608 1.00 . A A . 18 VAL C 1 1 4 1582 1 1 18 VAL CA C 3.416 -1.250 -9.772 1.00 . A A . 18 VAL CA 1 1 4 1583 1 1 18 VAL CB C 2.178 -1.839 -10.483 1.00 . A A . 18 VAL CB 1 1 4 1584 1 1 18 VAL CG1 C 2.591 -2.544 -11.794 1.00 . A A . 18 VAL CG1 1 1 4 1585 1 1 18 VAL CG2 C 1.571 -2.879 -9.529 1.00 . A A . 18 VAL CG2 1 1 4 1586 1 1 18 VAL H H 2.011 -0.474 -8.329 1.00 . A A . 18 VAL H 1 1 4 1587 1 1 18 VAL HA H 4.125 -2.013 -9.519 1.00 . A A . 18 VAL HA 1 1 4 1588 1 1 18 VAL HB H 1.456 -1.067 -10.697 1.00 . A A . 18 VAL HB 1 1 4 1589 1 1 18 VAL HG11 H 3.527 -3.069 -11.669 1.00 . A A . 18 VAL HG11 1 1 4 1590 1 1 18 VAL HG12 H 1.835 -3.254 -12.095 1.00 . A A . 18 VAL HG12 1 1 4 1591 1 1 18 VAL HG13 H 2.701 -1.814 -12.580 1.00 . A A . 18 VAL HG13 1 1 4 1592 1 1 18 VAL HG21 H 2.332 -3.586 -9.229 1.00 . A A . 18 VAL HG21 1 1 4 1593 1 1 18 VAL HG22 H 1.191 -2.386 -8.647 1.00 . A A . 18 VAL HG22 1 1 4 1594 1 1 18 VAL HG23 H 0.766 -3.408 -10.013 1.00 . A A . 18 VAL HG23 1 1 4 1595 1 1 18 VAL N N 2.963 -0.620 -8.504 1.00 . A A . 18 VAL N 1 1 4 1596 1 1 18 VAL O O 5.154 -0.391 -11.170 1.00 . A A . 18 VAL O 1 1 4 1597 1 1 19 PHE C C 5.469 2.359 -11.018 1.00 . A A . 19 PHE C 1 1 4 1598 1 1 19 PHE CA C 4.006 2.133 -11.420 1.00 . A A . 19 PHE CA 1 1 4 1599 1 1 19 PHE CB C 3.157 3.376 -11.100 1.00 . A A . 19 PHE CB 1 1 4 1600 1 1 19 PHE CD1 C 2.693 4.498 -13.323 1.00 . A A . 19 PHE CD1 1 1 4 1601 1 1 19 PHE CD2 C 4.431 5.392 -11.955 1.00 . A A . 19 PHE CD2 1 1 4 1602 1 1 19 PHE CE1 C 2.945 5.465 -14.274 1.00 . A A . 19 PHE CE1 1 1 4 1603 1 1 19 PHE CE2 C 4.683 6.359 -12.906 1.00 . A A . 19 PHE CE2 1 1 4 1604 1 1 19 PHE CG C 3.434 4.454 -12.156 1.00 . A A . 19 PHE CG 1 1 4 1605 1 1 19 PHE CZ C 3.940 6.396 -14.066 1.00 . A A . 19 PHE CZ 1 1 4 1606 1 1 19 PHE H H 2.629 1.054 -10.154 1.00 . A A . 19 PHE H 1 1 4 1607 1 1 19 PHE HA H 3.964 1.895 -12.472 1.00 . A A . 19 PHE HA 1 1 4 1608 1 1 19 PHE HB2 H 2.106 3.125 -11.119 1.00 . A A . 19 PHE HB2 1 1 4 1609 1 1 19 PHE HB3 H 3.403 3.768 -10.124 1.00 . A A . 19 PHE HB3 1 1 4 1610 1 1 19 PHE HD1 H 1.911 3.772 -13.494 1.00 . A A . 19 PHE HD1 1 1 4 1611 1 1 19 PHE HD2 H 5.017 5.370 -11.049 1.00 . A A . 19 PHE HD2 1 1 4 1612 1 1 19 PHE HE1 H 2.362 5.492 -15.183 1.00 . A A . 19 PHE HE1 1 1 4 1613 1 1 19 PHE HE2 H 5.464 7.086 -12.741 1.00 . A A . 19 PHE HE2 1 1 4 1614 1 1 19 PHE HZ H 4.138 7.152 -14.811 1.00 . A A . 19 PHE HZ 1 1 4 1615 1 1 19 PHE N N 3.469 0.971 -10.647 1.00 . A A . 19 PHE N 1 1 4 1616 1 1 19 PHE O O 6.296 2.744 -11.823 1.00 . A A . 19 PHE O 1 1 4 1617 1 1 20 PHE C C 7.909 1.067 -9.660 1.00 . A A . 20 PHE C 1 1 4 1618 1 1 20 PHE CA C 7.075 2.252 -9.187 1.00 . A A . 20 PHE CA 1 1 4 1619 1 1 20 PHE CB C 6.981 2.265 -7.643 1.00 . A A . 20 PHE CB 1 1 4 1620 1 1 20 PHE CD1 C 7.889 4.629 -7.393 1.00 . A A . 20 PHE CD1 1 1 4 1621 1 1 20 PHE CD2 C 5.798 4.105 -6.370 1.00 . A A . 20 PHE CD2 1 1 4 1622 1 1 20 PHE CE1 C 7.796 5.922 -6.920 1.00 . A A . 20 PHE CE1 1 1 4 1623 1 1 20 PHE CE2 C 5.705 5.398 -5.898 1.00 . A A . 20 PHE CE2 1 1 4 1624 1 1 20 PHE CG C 6.890 3.709 -7.121 1.00 . A A . 20 PHE CG 1 1 4 1625 1 1 20 PHE CZ C 6.703 6.308 -6.173 1.00 . A A . 20 PHE CZ 1 1 4 1626 1 1 20 PHE H H 4.992 1.797 -9.182 1.00 . A A . 20 PHE H 1 1 4 1627 1 1 20 PHE HA H 7.518 3.155 -9.570 1.00 . A A . 20 PHE HA 1 1 4 1628 1 1 20 PHE HB2 H 6.101 1.728 -7.322 1.00 . A A . 20 PHE HB2 1 1 4 1629 1 1 20 PHE HB3 H 7.843 1.792 -7.197 1.00 . A A . 20 PHE HB3 1 1 4 1630 1 1 20 PHE HD1 H 8.750 4.337 -7.976 1.00 . A A . 20 PHE HD1 1 1 4 1631 1 1 20 PHE HD2 H 5.014 3.398 -6.148 1.00 . A A . 20 PHE HD2 1 1 4 1632 1 1 20 PHE HE1 H 8.580 6.633 -7.137 1.00 . A A . 20 PHE HE1 1 1 4 1633 1 1 20 PHE HE2 H 4.848 5.697 -5.313 1.00 . A A . 20 PHE HE2 1 1 4 1634 1 1 20 PHE HZ H 6.630 7.320 -5.803 1.00 . A A . 20 PHE HZ 1 1 4 1635 1 1 20 PHE N N 5.717 2.098 -9.760 1.00 . A A . 20 PHE N 1 1 4 1636 1 1 20 PHE O O 8.982 1.252 -10.188 1.00 . A A . 20 PHE O 1 1 4 1637 1 1 21 ALA C C 8.747 -1.286 -11.245 1.00 . A A . 21 ALA C 1 1 4 1638 1 1 21 ALA CA C 8.076 -1.377 -9.870 1.00 . A A . 21 ALA CA 1 1 4 1639 1 1 21 ALA CB C 7.040 -2.509 -9.861 1.00 . A A . 21 ALA CB 1 1 4 1640 1 1 21 ALA H H 6.499 -0.175 -9.053 1.00 . A A . 21 ALA H 1 1 4 1641 1 1 21 ALA HA H 8.836 -1.589 -9.136 1.00 . A A . 21 ALA HA 1 1 4 1642 1 1 21 ALA HB1 H 6.413 -2.425 -8.985 1.00 . A A . 21 ALA HB1 1 1 4 1643 1 1 21 ALA HB2 H 6.414 -2.460 -10.740 1.00 . A A . 21 ALA HB2 1 1 4 1644 1 1 21 ALA HB3 H 7.540 -3.465 -9.842 1.00 . A A . 21 ALA HB3 1 1 4 1645 1 1 21 ALA N N 7.380 -0.114 -9.468 1.00 . A A . 21 ALA N 1 1 4 1646 1 1 21 ALA O O 9.901 -1.636 -11.386 1.00 . A A . 21 ALA O 1 1 4 1647 1 1 22 GLU C C 9.786 0.119 -13.752 1.00 . A A . 22 GLU C 1 1 4 1648 1 1 22 GLU CA C 8.450 -0.630 -13.606 1.00 . A A . 22 GLU CA 1 1 4 1649 1 1 22 GLU CB C 7.372 0.138 -14.402 1.00 . A A . 22 GLU CB 1 1 4 1650 1 1 22 GLU CD C 5.287 -1.178 -13.942 1.00 . A A . 22 GLU CD 1 1 4 1651 1 1 22 GLU CG C 6.345 -0.841 -15.001 1.00 . A A . 22 GLU CG 1 1 4 1652 1 1 22 GLU H H 7.077 -0.542 -11.919 1.00 . A A . 22 GLU H 1 1 4 1653 1 1 22 GLU HA H 8.582 -1.616 -14.026 1.00 . A A . 22 GLU HA 1 1 4 1654 1 1 22 GLU HB2 H 6.876 0.848 -13.755 1.00 . A A . 22 GLU HB2 1 1 4 1655 1 1 22 GLU HB3 H 7.829 0.689 -15.212 1.00 . A A . 22 GLU HB3 1 1 4 1656 1 1 22 GLU HG2 H 5.861 -0.380 -15.850 1.00 . A A . 22 GLU HG2 1 1 4 1657 1 1 22 GLU HG3 H 6.827 -1.750 -15.333 1.00 . A A . 22 GLU HG3 1 1 4 1658 1 1 22 GLU N N 7.983 -0.798 -12.186 1.00 . A A . 22 GLU N 1 1 4 1659 1 1 22 GLU O O 10.450 0.003 -14.765 1.00 . A A . 22 GLU O 1 1 4 1660 1 1 22 GLU OE1 O 4.346 -0.405 -13.853 1.00 . A A . 22 GLU OE1 1 1 4 1661 1 1 22 GLU OE2 O 5.482 -2.187 -13.283 1.00 . A A . 22 GLU OE2 1 1 4 1662 1 1 23 ASP C C 11.989 1.694 -11.297 1.00 . A A . 23 ASP C 1 1 4 1663 1 1 23 ASP CA C 11.389 1.650 -12.717 1.00 . A A . 23 ASP CA 1 1 4 1664 1 1 23 ASP CB C 11.023 3.048 -13.237 1.00 . A A . 23 ASP CB 1 1 4 1665 1 1 23 ASP CG C 12.281 3.780 -13.735 1.00 . A A . 23 ASP CG 1 1 4 1666 1 1 23 ASP H H 9.558 0.901 -11.955 1.00 . A A . 23 ASP H 1 1 4 1667 1 1 23 ASP HA H 12.100 1.169 -13.367 1.00 . A A . 23 ASP HA 1 1 4 1668 1 1 23 ASP HB2 H 10.319 2.953 -14.053 1.00 . A A . 23 ASP HB2 1 1 4 1669 1 1 23 ASP HB3 H 10.546 3.617 -12.450 1.00 . A A . 23 ASP HB3 1 1 4 1670 1 1 23 ASP N N 10.132 0.859 -12.734 1.00 . A A . 23 ASP N 1 1 4 1671 1 1 23 ASP O O 12.602 2.669 -10.907 1.00 . A A . 23 ASP O 1 1 4 1672 1 1 23 ASP OD1 O 12.711 3.436 -14.824 1.00 . A A . 23 ASP OD1 1 1 4 1673 1 1 23 ASP OD2 O 12.742 4.640 -13.002 1.00 . A A . 23 ASP OD2 1 1 4 1674 1 1 24 VAL C C 12.927 -0.874 -8.955 1.00 . A A . 24 VAL C 1 1 4 1675 1 1 24 VAL CA C 12.311 0.519 -9.164 1.00 . A A . 24 VAL CA 1 1 4 1676 1 1 24 VAL CB C 11.136 0.761 -8.182 1.00 . A A . 24 VAL CB 1 1 4 1677 1 1 24 VAL CG1 C 11.486 0.355 -6.733 1.00 . A A . 24 VAL CG1 1 1 4 1678 1 1 24 VAL CG2 C 10.745 2.261 -8.174 1.00 . A A . 24 VAL CG2 1 1 4 1679 1 1 24 VAL H H 11.287 -0.127 -10.943 1.00 . A A . 24 VAL H 1 1 4 1680 1 1 24 VAL HA H 13.062 1.265 -8.993 1.00 . A A . 24 VAL HA 1 1 4 1681 1 1 24 VAL HB H 10.315 0.165 -8.523 1.00 . A A . 24 VAL HB 1 1 4 1682 1 1 24 VAL HG11 H 12.396 0.843 -6.418 1.00 . A A . 24 VAL HG11 1 1 4 1683 1 1 24 VAL HG12 H 10.687 0.652 -6.067 1.00 . A A . 24 VAL HG12 1 1 4 1684 1 1 24 VAL HG13 H 11.610 -0.714 -6.660 1.00 . A A . 24 VAL HG13 1 1 4 1685 1 1 24 VAL HG21 H 10.595 2.634 -9.176 1.00 . A A . 24 VAL HG21 1 1 4 1686 1 1 24 VAL HG22 H 9.825 2.389 -7.624 1.00 . A A . 24 VAL HG22 1 1 4 1687 1 1 24 VAL HG23 H 11.513 2.852 -7.699 1.00 . A A . 24 VAL HG23 1 1 4 1688 1 1 24 VAL N N 11.789 0.624 -10.566 1.00 . A A . 24 VAL N 1 1 4 1689 1 1 24 VAL O O 13.881 -1.018 -8.216 1.00 . A A . 24 VAL O 1 1 4 1690 1 1 25 GLY C C 12.561 -3.809 -8.093 1.00 . A A . 25 GLY C 1 1 4 1691 1 1 25 GLY CA C 12.878 -3.256 -9.488 1.00 . A A . 25 GLY CA 1 1 4 1692 1 1 25 GLY H H 11.601 -1.686 -10.202 1.00 . A A . 25 GLY H 1 1 4 1693 1 1 25 GLY HA2 H 12.397 -3.875 -10.231 1.00 . A A . 25 GLY HA2 1 1 4 1694 1 1 25 GLY HA3 H 13.946 -3.263 -9.652 1.00 . A A . 25 GLY HA3 1 1 4 1695 1 1 25 GLY N N 12.365 -1.858 -9.615 1.00 . A A . 25 GLY N 1 1 4 1696 1 1 25 GLY O O 11.419 -3.815 -7.678 1.00 . A A . 25 GLY O 1 1 4 1697 1 1 26 SER C C 14.815 -4.958 -5.384 1.00 . A A . 26 SER C 1 1 4 1698 1 1 26 SER CA C 13.440 -4.821 -6.043 1.00 . A A . 26 SER CA 1 1 4 1699 1 1 26 SER CB C 12.758 -6.212 -6.126 1.00 . A A . 26 SER CB 1 1 4 1700 1 1 26 SER H H 14.483 -4.211 -7.815 1.00 . A A . 26 SER H 1 1 4 1701 1 1 26 SER HA H 12.849 -4.139 -5.459 1.00 . A A . 26 SER HA 1 1 4 1702 1 1 26 SER HB2 H 12.825 -6.741 -5.186 1.00 . A A . 26 SER HB2 1 1 4 1703 1 1 26 SER HB3 H 11.723 -6.125 -6.420 1.00 . A A . 26 SER HB3 1 1 4 1704 1 1 26 SER HG H 14.164 -6.380 -7.482 1.00 . A A . 26 SER HG 1 1 4 1705 1 1 26 SER N N 13.591 -4.253 -7.417 1.00 . A A . 26 SER N 1 1 4 1706 1 1 26 SER O O 14.986 -4.651 -4.220 1.00 . A A . 26 SER O 1 1 4 1707 1 1 26 SER OG O 13.470 -6.937 -7.122 1.00 . A A . 26 SER OG 1 1 4 1708 1 1 27 ASN C C 17.956 -4.322 -5.867 1.00 . A A . 27 ASN C 1 1 4 1709 1 1 27 ASN CA C 17.153 -5.618 -5.699 1.00 . A A . 27 ASN CA 1 1 4 1710 1 1 27 ASN CB C 17.792 -6.751 -6.521 1.00 . A A . 27 ASN CB 1 1 4 1711 1 1 27 ASN CG C 19.186 -7.070 -5.966 1.00 . A A . 27 ASN CG 1 1 4 1712 1 1 27 ASN H H 15.512 -5.638 -7.098 1.00 . A A . 27 ASN H 1 1 4 1713 1 1 27 ASN HA H 17.138 -5.884 -4.655 1.00 . A A . 27 ASN HA 1 1 4 1714 1 1 27 ASN HB2 H 17.182 -7.641 -6.462 1.00 . A A . 27 ASN HB2 1 1 4 1715 1 1 27 ASN HB3 H 17.885 -6.460 -7.557 1.00 . A A . 27 ASN HB3 1 1 4 1716 1 1 27 ASN HD21 H 20.074 -5.665 -7.051 1.00 . A A . 27 ASN HD21 1 1 4 1717 1 1 27 ASN HD22 H 21.105 -6.565 -6.046 1.00 . A A . 27 ASN HD22 1 1 4 1718 1 1 27 ASN N N 15.750 -5.420 -6.174 1.00 . A A . 27 ASN N 1 1 4 1719 1 1 27 ASN ND2 N 20.208 -6.376 -6.389 1.00 . A A . 27 ASN ND2 1 1 4 1720 1 1 27 ASN O O 18.768 -3.988 -5.027 1.00 . A A . 27 ASN O 1 1 4 1721 1 1 27 ASN OD1 O 19.358 -7.949 -5.146 1.00 . A A . 27 ASN OD1 1 1 4 1722 1 1 28 LYS C C 19.864 -2.488 -7.608 1.00 . A A . 28 LYS C 1 1 4 1723 1 1 28 LYS CA C 18.346 -2.356 -7.338 1.00 . A A . 28 LYS CA 1 1 4 1724 1 1 28 LYS CB C 18.118 -1.297 -6.203 1.00 . A A . 28 LYS CB 1 1 4 1725 1 1 28 LYS CD C 15.677 -1.855 -5.755 1.00 . A A . 28 LYS CD 1 1 4 1726 1 1 28 LYS CE C 14.390 -1.207 -5.209 1.00 . A A . 28 LYS CE 1 1 4 1727 1 1 28 LYS CG C 16.664 -0.765 -6.237 1.00 . A A . 28 LYS CG 1 1 4 1728 1 1 28 LYS H H 17.008 -4.027 -7.563 1.00 . A A . 28 LYS H 1 1 4 1729 1 1 28 LYS HA H 17.877 -2.005 -8.247 1.00 . A A . 28 LYS HA 1 1 4 1730 1 1 28 LYS HB2 H 18.336 -1.708 -5.230 1.00 . A A . 28 LYS HB2 1 1 4 1731 1 1 28 LYS HB3 H 18.781 -0.460 -6.362 1.00 . A A . 28 LYS HB3 1 1 4 1732 1 1 28 LYS HD2 H 15.425 -2.498 -6.586 1.00 . A A . 28 LYS HD2 1 1 4 1733 1 1 28 LYS HD3 H 16.133 -2.455 -4.981 1.00 . A A . 28 LYS HD3 1 1 4 1734 1 1 28 LYS HE2 H 14.225 -0.239 -5.657 1.00 . A A . 28 LYS HE2 1 1 4 1735 1 1 28 LYS HE3 H 13.540 -1.838 -5.424 1.00 . A A . 28 LYS HE3 1 1 4 1736 1 1 28 LYS HG2 H 16.598 0.100 -5.592 1.00 . A A . 28 LYS HG2 1 1 4 1737 1 1 28 LYS HG3 H 16.408 -0.459 -7.241 1.00 . A A . 28 LYS HG3 1 1 4 1738 1 1 28 LYS HZ1 H 15.408 -1.392 -3.400 1.00 . A A . 28 LYS HZ1 1 1 4 1739 1 1 28 LYS HZ2 H 14.403 -0.027 -3.495 1.00 . A A . 28 LYS HZ2 1 1 4 1740 1 1 28 LYS HZ3 H 13.725 -1.567 -3.270 1.00 . A A . 28 LYS HZ3 1 1 4 1741 1 1 28 LYS N N 17.684 -3.653 -6.962 1.00 . A A . 28 LYS N 1 1 4 1742 1 1 28 LYS NZ N 14.489 -1.035 -3.732 1.00 . A A . 28 LYS NZ 1 1 4 1743 1 1 28 LYS O O 20.436 -3.494 -7.217 1.00 . A A . 28 LYS O 1 1 4 1744 1 1 28 LYS OXT O 20.379 -1.557 -8.204 1.00 . A A . 28 LYS OXT 1 1 5 1745 1 1 1 ASP C C -9.796 0.822 -14.483 1.00 . A A . 1 ASP C 1 1 5 1746 1 1 1 ASP CA C -8.303 0.510 -14.309 1.00 . A A . 1 ASP CA 1 1 5 1747 1 1 1 ASP CB C -7.701 1.446 -13.241 1.00 . A A . 1 ASP CB 1 1 5 1748 1 1 1 ASP CG C -8.411 1.250 -11.885 1.00 . A A . 1 ASP CG 1 1 5 1749 1 1 1 ASP H1 H -8.254 0.999 -16.337 1.00 . A A . 1 ASP H1 1 1 5 1750 1 1 1 ASP H2 H -6.851 1.430 -15.484 1.00 . A A . 1 ASP H2 1 1 5 1751 1 1 1 ASP H3 H -7.137 -0.197 -15.882 1.00 . A A . 1 ASP H3 1 1 5 1752 1 1 1 ASP HA H -8.194 -0.522 -14.006 1.00 . A A . 1 ASP HA 1 1 5 1753 1 1 1 ASP HB2 H -6.647 1.238 -13.127 1.00 . A A . 1 ASP HB2 1 1 5 1754 1 1 1 ASP HB3 H -7.814 2.473 -13.557 1.00 . A A . 1 ASP HB3 1 1 5 1755 1 1 1 ASP N N -7.582 0.700 -15.600 1.00 . A A . 1 ASP N 1 1 5 1756 1 1 1 ASP O O -10.199 1.473 -15.428 1.00 . A A . 1 ASP O 1 1 5 1757 1 1 1 ASP OD1 O -7.966 0.387 -11.146 1.00 . A A . 1 ASP OD1 1 1 5 1758 1 1 1 ASP OD2 O -9.362 1.980 -11.665 1.00 . A A . 1 ASP OD2 1 1 5 1759 1 1 2 ALA C C -12.498 0.760 -12.099 1.00 . A A . 2 ALA C 1 1 5 1760 1 1 2 ALA CA C -12.038 0.535 -13.545 1.00 . A A . 2 ALA CA 1 1 5 1761 1 1 2 ALA CB C -12.689 -0.715 -14.139 1.00 . A A . 2 ALA CB 1 1 5 1762 1 1 2 ALA H H -10.159 -0.179 -12.811 1.00 . A A . 2 ALA H 1 1 5 1763 1 1 2 ALA HA H -12.283 1.409 -14.131 1.00 . A A . 2 ALA HA 1 1 5 1764 1 1 2 ALA HB1 H -12.175 -1.001 -15.045 1.00 . A A . 2 ALA HB1 1 1 5 1765 1 1 2 ALA HB2 H -12.645 -1.536 -13.438 1.00 . A A . 2 ALA HB2 1 1 5 1766 1 1 2 ALA HB3 H -13.720 -0.516 -14.381 1.00 . A A . 2 ALA HB3 1 1 5 1767 1 1 2 ALA N N -10.562 0.333 -13.542 1.00 . A A . 2 ALA N 1 1 5 1768 1 1 2 ALA O O -12.099 0.032 -11.209 1.00 . A A . 2 ALA O 1 1 5 1769 1 1 3 GLU C C -15.381 2.169 -10.540 1.00 . A A . 3 GLU C 1 1 5 1770 1 1 3 GLU CA C -13.852 2.097 -10.549 1.00 . A A . 3 GLU CA 1 1 5 1771 1 1 3 GLU CB C -13.248 3.450 -10.107 1.00 . A A . 3 GLU CB 1 1 5 1772 1 1 3 GLU CD C -10.959 4.484 -9.941 1.00 . A A . 3 GLU CD 1 1 5 1773 1 1 3 GLU CG C -11.800 3.231 -9.640 1.00 . A A . 3 GLU CG 1 1 5 1774 1 1 3 GLU H H -13.593 2.303 -12.686 1.00 . A A . 3 GLU H 1 1 5 1775 1 1 3 GLU HA H -13.581 1.303 -9.875 1.00 . A A . 3 GLU HA 1 1 5 1776 1 1 3 GLU HB2 H -13.275 4.143 -10.935 1.00 . A A . 3 GLU HB2 1 1 5 1777 1 1 3 GLU HB3 H -13.815 3.871 -9.289 1.00 . A A . 3 GLU HB3 1 1 5 1778 1 1 3 GLU HG2 H -11.775 3.028 -8.578 1.00 . A A . 3 GLU HG2 1 1 5 1779 1 1 3 GLU HG3 H -11.365 2.389 -10.158 1.00 . A A . 3 GLU HG3 1 1 5 1780 1 1 3 GLU N N -13.321 1.763 -11.915 1.00 . A A . 3 GLU N 1 1 5 1781 1 1 3 GLU O O -15.984 2.720 -9.639 1.00 . A A . 3 GLU O 1 1 5 1782 1 1 3 GLU OE1 O -10.433 4.533 -11.039 1.00 . A A . 3 GLU OE1 1 1 5 1783 1 1 3 GLU OE2 O -10.887 5.323 -9.059 1.00 . A A . 3 GLU OE2 1 1 5 1784 1 1 4 PHE C C -17.915 0.133 -11.425 1.00 . A A . 4 PHE C 1 1 5 1785 1 1 4 PHE CA C -17.435 1.560 -11.716 1.00 . A A . 4 PHE CA 1 1 5 1786 1 1 4 PHE CB C -17.816 2.005 -13.167 1.00 . A A . 4 PHE CB 1 1 5 1787 1 1 4 PHE CD1 C -15.649 2.200 -14.478 1.00 . A A . 4 PHE CD1 1 1 5 1788 1 1 4 PHE CD2 C -17.110 0.391 -15.001 1.00 . A A . 4 PHE CD2 1 1 5 1789 1 1 4 PHE CE1 C -14.770 1.772 -15.451 1.00 . A A . 4 PHE CE1 1 1 5 1790 1 1 4 PHE CE2 C -16.230 -0.038 -15.974 1.00 . A A . 4 PHE CE2 1 1 5 1791 1 1 4 PHE CG C -16.828 1.514 -14.244 1.00 . A A . 4 PHE CG 1 1 5 1792 1 1 4 PHE CZ C -15.060 0.653 -16.200 1.00 . A A . 4 PHE CZ 1 1 5 1793 1 1 4 PHE H H -15.367 1.173 -12.226 1.00 . A A . 4 PHE H 1 1 5 1794 1 1 4 PHE HA H -17.893 2.230 -11.002 1.00 . A A . 4 PHE HA 1 1 5 1795 1 1 4 PHE HB2 H -18.806 1.653 -13.421 1.00 . A A . 4 PHE HB2 1 1 5 1796 1 1 4 PHE HB3 H -17.837 3.085 -13.199 1.00 . A A . 4 PHE HB3 1 1 5 1797 1 1 4 PHE HD1 H -15.412 3.079 -13.895 1.00 . A A . 4 PHE HD1 1 1 5 1798 1 1 4 PHE HD2 H -18.024 -0.161 -14.833 1.00 . A A . 4 PHE HD2 1 1 5 1799 1 1 4 PHE HE1 H -13.852 2.315 -15.626 1.00 . A A . 4 PHE HE1 1 1 5 1800 1 1 4 PHE HE2 H -16.459 -0.915 -16.560 1.00 . A A . 4 PHE HE2 1 1 5 1801 1 1 4 PHE HZ H -14.372 0.317 -16.963 1.00 . A A . 4 PHE HZ 1 1 5 1802 1 1 4 PHE N N -15.949 1.592 -11.560 1.00 . A A . 4 PHE N 1 1 5 1803 1 1 4 PHE O O -18.471 -0.552 -12.263 1.00 . A A . 4 PHE O 1 1 5 1804 1 1 5 ARG C C -18.301 -1.522 -8.191 1.00 . A A . 5 ARG C 1 1 5 1805 1 1 5 ARG CA C -18.040 -1.606 -9.701 1.00 . A A . 5 ARG CA 1 1 5 1806 1 1 5 ARG CB C -16.888 -2.616 -10.027 1.00 . A A . 5 ARG CB 1 1 5 1807 1 1 5 ARG CD C -14.372 -2.681 -10.641 1.00 . A A . 5 ARG CD 1 1 5 1808 1 1 5 ARG CG C -15.474 -1.994 -9.781 1.00 . A A . 5 ARG CG 1 1 5 1809 1 1 5 ARG CZ C -15.306 -2.159 -12.861 1.00 . A A . 5 ARG CZ 1 1 5 1810 1 1 5 ARG H H -17.200 0.354 -9.595 1.00 . A A . 5 ARG H 1 1 5 1811 1 1 5 ARG HA H -18.959 -1.894 -10.179 1.00 . A A . 5 ARG HA 1 1 5 1812 1 1 5 ARG HB2 H -16.992 -3.501 -9.415 1.00 . A A . 5 ARG HB2 1 1 5 1813 1 1 5 ARG HB3 H -17.008 -2.918 -11.055 1.00 . A A . 5 ARG HB3 1 1 5 1814 1 1 5 ARG HD2 H -13.534 -2.011 -10.771 1.00 . A A . 5 ARG HD2 1 1 5 1815 1 1 5 ARG HD3 H -14.021 -3.576 -10.151 1.00 . A A . 5 ARG HD3 1 1 5 1816 1 1 5 ARG HE H -14.941 -4.002 -12.244 1.00 . A A . 5 ARG HE 1 1 5 1817 1 1 5 ARG HG2 H -15.463 -0.939 -10.000 1.00 . A A . 5 ARG HG2 1 1 5 1818 1 1 5 ARG HG3 H -15.222 -2.117 -8.739 1.00 . A A . 5 ARG HG3 1 1 5 1819 1 1 5 ARG HH11 H -14.916 -0.579 -11.689 1.00 . A A . 5 ARG HH11 1 1 5 1820 1 1 5 ARG HH12 H -15.583 -0.216 -13.241 1.00 . A A . 5 ARG HH12 1 1 5 1821 1 1 5 ARG HH21 H -15.772 -3.556 -14.216 1.00 . A A . 5 ARG HH21 1 1 5 1822 1 1 5 ARG HH22 H -16.070 -1.920 -14.694 1.00 . A A . 5 ARG HH22 1 1 5 1823 1 1 5 ARG N N -17.659 -0.256 -10.204 1.00 . A A . 5 ARG N 1 1 5 1824 1 1 5 ARG NE N -14.898 -3.055 -11.996 1.00 . A A . 5 ARG NE 1 1 5 1825 1 1 5 ARG NH1 N -15.265 -0.887 -12.573 1.00 . A A . 5 ARG NH1 1 1 5 1826 1 1 5 ARG NH2 N -15.750 -2.577 -14.013 1.00 . A A . 5 ARG NH2 1 1 5 1827 1 1 5 ARG O O -17.856 -2.338 -7.408 1.00 . A A . 5 ARG O 1 1 5 1828 1 1 6 HIS C C -18.209 -0.148 -5.497 1.00 . A A . 6 HIS C 1 1 5 1829 1 1 6 HIS CA C -19.429 -0.212 -6.428 1.00 . A A . 6 HIS CA 1 1 5 1830 1 1 6 HIS CB C -20.422 -1.317 -5.958 1.00 . A A . 6 HIS CB 1 1 5 1831 1 1 6 HIS CD2 C -22.742 -0.976 -7.204 1.00 . A A . 6 HIS CD2 1 1 5 1832 1 1 6 HIS CE1 C -22.414 -2.271 -8.791 1.00 . A A . 6 HIS CE1 1 1 5 1833 1 1 6 HIS CG C -21.483 -1.529 -7.043 1.00 . A A . 6 HIS CG 1 1 5 1834 1 1 6 HIS H H -19.353 0.112 -8.550 1.00 . A A . 6 HIS H 1 1 5 1835 1 1 6 HIS HA H -19.924 0.748 -6.399 1.00 . A A . 6 HIS HA 1 1 5 1836 1 1 6 HIS HB2 H -19.913 -2.254 -5.781 1.00 . A A . 6 HIS HB2 1 1 5 1837 1 1 6 HIS HB3 H -20.915 -1.009 -5.047 1.00 . A A . 6 HIS HB3 1 1 5 1838 1 1 6 HIS HD1 H -20.556 -2.867 -8.243 1.00 . A A . 6 HIS HD1 1 1 5 1839 1 1 6 HIS HD2 H -23.196 -0.261 -6.533 1.00 . A A . 6 HIS HD2 1 1 5 1840 1 1 6 HIS HE1 H -22.550 -2.839 -9.699 1.00 . A A . 6 HIS HE1 1 1 5 1841 1 1 6 HIS N N -19.041 -0.496 -7.848 1.00 . A A . 6 HIS N 1 1 5 1842 1 1 6 HIS ND1 N -21.347 -2.318 -8.058 1.00 . A A . 6 HIS ND1 1 1 5 1843 1 1 6 HIS NE2 N -23.307 -1.449 -8.298 1.00 . A A . 6 HIS NE2 1 1 5 1844 1 1 6 HIS O O -18.080 -0.903 -4.551 1.00 . A A . 6 HIS O 1 1 5 1845 1 1 7 ASP C C -16.451 1.818 -3.779 1.00 . A A . 7 ASP C 1 1 5 1846 1 1 7 ASP CA C -16.093 1.002 -5.040 1.00 . A A . 7 ASP CA 1 1 5 1847 1 1 7 ASP CB C -15.086 1.764 -5.945 1.00 . A A . 7 ASP CB 1 1 5 1848 1 1 7 ASP CG C -14.684 0.916 -7.175 1.00 . A A . 7 ASP CG 1 1 5 1849 1 1 7 ASP H H -17.511 1.338 -6.604 1.00 . A A . 7 ASP H 1 1 5 1850 1 1 7 ASP HA H -15.689 0.046 -4.752 1.00 . A A . 7 ASP HA 1 1 5 1851 1 1 7 ASP HB2 H -15.533 2.686 -6.294 1.00 . A A . 7 ASP HB2 1 1 5 1852 1 1 7 ASP HB3 H -14.202 2.006 -5.371 1.00 . A A . 7 ASP HB3 1 1 5 1853 1 1 7 ASP N N -17.343 0.777 -5.823 1.00 . A A . 7 ASP N 1 1 5 1854 1 1 7 ASP O O -16.116 2.982 -3.661 1.00 . A A . 7 ASP O 1 1 5 1855 1 1 7 ASP OD1 O -15.585 0.508 -7.893 1.00 . A A . 7 ASP OD1 1 1 5 1856 1 1 7 ASP OD2 O -13.488 0.723 -7.333 1.00 . A A . 7 ASP OD2 1 1 5 1857 1 1 8 SER C C -16.363 2.251 -0.742 1.00 . A A . 8 SER C 1 1 5 1858 1 1 8 SER CA C -17.560 1.803 -1.587 1.00 . A A . 8 SER CA 1 1 5 1859 1 1 8 SER CB C -18.418 0.793 -0.795 1.00 . A A . 8 SER CB 1 1 5 1860 1 1 8 SER H H -17.360 0.223 -3.032 1.00 . A A . 8 SER H 1 1 5 1861 1 1 8 SER HA H -18.151 2.672 -1.825 1.00 . A A . 8 SER HA 1 1 5 1862 1 1 8 SER HB2 H -18.649 1.154 0.197 1.00 . A A . 8 SER HB2 1 1 5 1863 1 1 8 SER HB3 H -19.331 0.551 -1.321 1.00 . A A . 8 SER HB3 1 1 5 1864 1 1 8 SER HG H -17.451 -0.544 0.232 1.00 . A A . 8 SER HG 1 1 5 1865 1 1 8 SER N N -17.129 1.161 -2.871 1.00 . A A . 8 SER N 1 1 5 1866 1 1 8 SER O O -16.399 3.291 -0.112 1.00 . A A . 8 SER O 1 1 5 1867 1 1 8 SER OG O -17.611 -0.373 -0.698 1.00 . A A . 8 SER OG 1 1 5 1868 1 1 9 GLY C C -13.284 2.774 -0.766 1.00 . A A . 9 GLY C 1 1 5 1869 1 1 9 GLY CA C -14.098 1.740 0.007 1.00 . A A . 9 GLY CA 1 1 5 1870 1 1 9 GLY H H -15.401 0.622 -1.302 1.00 . A A . 9 GLY H 1 1 5 1871 1 1 9 GLY HA2 H -14.354 2.140 0.978 1.00 . A A . 9 GLY HA2 1 1 5 1872 1 1 9 GLY HA3 H -13.519 0.836 0.125 1.00 . A A . 9 GLY HA3 1 1 5 1873 1 1 9 GLY N N -15.340 1.438 -0.765 1.00 . A A . 9 GLY N 1 1 5 1874 1 1 9 GLY O O -13.595 3.949 -0.733 1.00 . A A . 9 GLY O 1 1 5 1875 1 1 10 TYR C C -10.464 2.441 -3.169 1.00 . A A . 10 TYR C 1 1 5 1876 1 1 10 TYR CA C -11.396 3.218 -2.237 1.00 . A A . 10 TYR CA 1 1 5 1877 1 1 10 TYR CB C -10.541 4.096 -1.283 1.00 . A A . 10 TYR CB 1 1 5 1878 1 1 10 TYR CD1 C -9.547 5.944 -2.706 1.00 . A A . 10 TYR CD1 1 1 5 1879 1 1 10 TYR CD2 C -11.487 6.445 -1.423 1.00 . A A . 10 TYR CD2 1 1 5 1880 1 1 10 TYR CE1 C -9.535 7.235 -3.189 1.00 . A A . 10 TYR CE1 1 1 5 1881 1 1 10 TYR CE2 C -11.474 7.734 -1.906 1.00 . A A . 10 TYR CE2 1 1 5 1882 1 1 10 TYR CG C -10.523 5.537 -1.818 1.00 . A A . 10 TYR CG 1 1 5 1883 1 1 10 TYR CZ C -10.498 8.140 -2.794 1.00 . A A . 10 TYR CZ 1 1 5 1884 1 1 10 TYR H H -12.069 1.346 -1.428 1.00 . A A . 10 TYR H 1 1 5 1885 1 1 10 TYR HA H -12.044 3.827 -2.848 1.00 . A A . 10 TYR HA 1 1 5 1886 1 1 10 TYR HB2 H -10.957 4.101 -0.286 1.00 . A A . 10 TYR HB2 1 1 5 1887 1 1 10 TYR HB3 H -9.526 3.732 -1.230 1.00 . A A . 10 TYR HB3 1 1 5 1888 1 1 10 TYR HD1 H -8.784 5.249 -3.027 1.00 . A A . 10 TYR HD1 1 1 5 1889 1 1 10 TYR HD2 H -12.258 6.145 -0.728 1.00 . A A . 10 TYR HD2 1 1 5 1890 1 1 10 TYR HE1 H -8.765 7.536 -3.883 1.00 . A A . 10 TYR HE1 1 1 5 1891 1 1 10 TYR HE2 H -12.237 8.430 -1.585 1.00 . A A . 10 TYR HE2 1 1 5 1892 1 1 10 TYR HH H -10.362 10.026 -2.537 1.00 . A A . 10 TYR HH 1 1 5 1893 1 1 10 TYR N N -12.265 2.304 -1.441 1.00 . A A . 10 TYR N 1 1 5 1894 1 1 10 TYR O O -10.213 1.265 -2.989 1.00 . A A . 10 TYR O 1 1 5 1895 1 1 10 TYR OH O -10.485 9.430 -3.280 1.00 . A A . 10 TYR OH 1 1 5 1896 1 1 11 GLU C C -8.928 3.827 -6.164 1.00 . A A . 11 GLU C 1 1 5 1897 1 1 11 GLU CA C -9.059 2.664 -5.191 1.00 . A A . 11 GLU CA 1 1 5 1898 1 1 11 GLU CB C -9.648 1.438 -5.940 1.00 . A A . 11 GLU CB 1 1 5 1899 1 1 11 GLU CD C -9.297 1.372 -8.449 1.00 . A A . 11 GLU CD 1 1 5 1900 1 1 11 GLU CG C -8.678 1.028 -7.086 1.00 . A A . 11 GLU CG 1 1 5 1901 1 1 11 GLU H H -10.257 4.117 -4.188 1.00 . A A . 11 GLU H 1 1 5 1902 1 1 11 GLU HA H -8.096 2.450 -4.748 1.00 . A A . 11 GLU HA 1 1 5 1903 1 1 11 GLU HB2 H -9.746 0.606 -5.259 1.00 . A A . 11 GLU HB2 1 1 5 1904 1 1 11 GLU HB3 H -10.629 1.679 -6.327 1.00 . A A . 11 GLU HB3 1 1 5 1905 1 1 11 GLU HG2 H -7.733 1.547 -6.994 1.00 . A A . 11 GLU HG2 1 1 5 1906 1 1 11 GLU HG3 H -8.488 -0.032 -7.046 1.00 . A A . 11 GLU HG3 1 1 5 1907 1 1 11 GLU N N -9.990 3.173 -4.142 1.00 . A A . 11 GLU N 1 1 5 1908 1 1 11 GLU O O -9.911 4.297 -6.703 1.00 . A A . 11 GLU O 1 1 5 1909 1 1 11 GLU OE1 O -10.022 0.536 -8.966 1.00 . A A . 11 GLU OE1 1 1 5 1910 1 1 11 GLU OE2 O -9.006 2.465 -8.897 1.00 . A A . 11 GLU OE2 1 1 5 1911 1 1 12 VAL C C -7.342 4.872 -8.712 1.00 . A A . 12 VAL C 1 1 5 1912 1 1 12 VAL CA C -7.434 5.379 -7.274 1.00 . A A . 12 VAL CA 1 1 5 1913 1 1 12 VAL CB C -6.134 6.026 -6.786 1.00 . A A . 12 VAL CB 1 1 5 1914 1 1 12 VAL CG1 C -5.537 6.974 -7.848 1.00 . A A . 12 VAL CG1 1 1 5 1915 1 1 12 VAL CG2 C -6.418 6.803 -5.482 1.00 . A A . 12 VAL CG2 1 1 5 1916 1 1 12 VAL H H -6.966 3.824 -5.887 1.00 . A A . 12 VAL H 1 1 5 1917 1 1 12 VAL HA H -8.238 6.069 -7.195 1.00 . A A . 12 VAL HA 1 1 5 1918 1 1 12 VAL HB H -5.454 5.229 -6.564 1.00 . A A . 12 VAL HB 1 1 5 1919 1 1 12 VAL HG11 H -6.298 7.643 -8.223 1.00 . A A . 12 VAL HG11 1 1 5 1920 1 1 12 VAL HG12 H -4.734 7.556 -7.420 1.00 . A A . 12 VAL HG12 1 1 5 1921 1 1 12 VAL HG13 H -5.141 6.400 -8.673 1.00 . A A . 12 VAL HG13 1 1 5 1922 1 1 12 VAL HG21 H -6.827 6.136 -4.737 1.00 . A A . 12 VAL HG21 1 1 5 1923 1 1 12 VAL HG22 H -5.507 7.233 -5.095 1.00 . A A . 12 VAL HG22 1 1 5 1924 1 1 12 VAL HG23 H -7.130 7.595 -5.664 1.00 . A A . 12 VAL HG23 1 1 5 1925 1 1 12 VAL N N -7.710 4.250 -6.354 1.00 . A A . 12 VAL N 1 1 5 1926 1 1 12 VAL O O -8.010 5.375 -9.594 1.00 . A A . 12 VAL O 1 1 5 1927 1 1 13 HIS C C -5.467 1.968 -10.088 1.00 . A A . 13 HIS C 1 1 5 1928 1 1 13 HIS CA C -6.286 3.259 -10.217 1.00 . A A . 13 HIS CA 1 1 5 1929 1 1 13 HIS CB C -5.548 4.263 -11.145 1.00 . A A . 13 HIS CB 1 1 5 1930 1 1 13 HIS CD2 C -6.304 5.869 -13.110 1.00 . A A . 13 HIS CD2 1 1 5 1931 1 1 13 HIS CE1 C -8.312 5.356 -13.201 1.00 . A A . 13 HIS CE1 1 1 5 1932 1 1 13 HIS CG C -6.531 4.902 -12.145 1.00 . A A . 13 HIS CG 1 1 5 1933 1 1 13 HIS H H -6.016 3.556 -8.101 1.00 . A A . 13 HIS H 1 1 5 1934 1 1 13 HIS HA H -7.247 2.996 -10.612 1.00 . A A . 13 HIS HA 1 1 5 1935 1 1 13 HIS HB2 H -5.087 5.048 -10.564 1.00 . A A . 13 HIS HB2 1 1 5 1936 1 1 13 HIS HB3 H -4.780 3.763 -11.714 1.00 . A A . 13 HIS HB3 1 1 5 1937 1 1 13 HIS HD1 H -8.287 3.985 -11.718 1.00 . A A . 13 HIS HD1 1 1 5 1938 1 1 13 HIS HD2 H -5.349 6.335 -13.304 1.00 . A A . 13 HIS HD2 1 1 5 1939 1 1 13 HIS HE1 H -9.351 5.314 -13.490 1.00 . A A . 13 HIS HE1 1 1 5 1940 1 1 13 HIS N N -6.506 3.886 -8.880 1.00 . A A . 13 HIS N 1 1 5 1941 1 1 13 HIS ND1 N -7.792 4.634 -12.260 1.00 . A A . 13 HIS ND1 1 1 5 1942 1 1 13 HIS NE2 N -7.422 6.139 -13.757 1.00 . A A . 13 HIS NE2 1 1 5 1943 1 1 13 HIS O O -5.228 1.295 -11.072 1.00 . A A . 13 HIS O 1 1 5 1944 1 1 14 HIS C C -3.151 0.215 -9.605 1.00 . A A . 14 HIS C 1 1 5 1945 1 1 14 HIS CA C -4.261 0.442 -8.571 1.00 . A A . 14 HIS CA 1 1 5 1946 1 1 14 HIS CB C -5.236 -0.763 -8.515 1.00 . A A . 14 HIS CB 1 1 5 1947 1 1 14 HIS CD2 C -4.452 -3.291 -8.401 1.00 . A A . 14 HIS CD2 1 1 5 1948 1 1 14 HIS CE1 C -3.298 -3.174 -6.683 1.00 . A A . 14 HIS CE1 1 1 5 1949 1 1 14 HIS CG C -4.505 -1.984 -7.948 1.00 . A A . 14 HIS CG 1 1 5 1950 1 1 14 HIS H H -5.309 2.268 -8.142 1.00 . A A . 14 HIS H 1 1 5 1951 1 1 14 HIS HA H -3.780 0.585 -7.618 1.00 . A A . 14 HIS HA 1 1 5 1952 1 1 14 HIS HB2 H -6.074 -0.535 -7.874 1.00 . A A . 14 HIS HB2 1 1 5 1953 1 1 14 HIS HB3 H -5.607 -1.001 -9.502 1.00 . A A . 14 HIS HB3 1 1 5 1954 1 1 14 HIS HD1 H -3.597 -1.205 -6.317 1.00 . A A . 14 HIS HD1 1 1 5 1955 1 1 14 HIS HD2 H -4.957 -3.659 -9.282 1.00 . A A . 14 HIS HD2 1 1 5 1956 1 1 14 HIS HE1 H -2.653 -3.438 -5.856 1.00 . A A . 14 HIS HE1 1 1 5 1957 1 1 14 HIS N N -5.068 1.667 -8.875 1.00 . A A . 14 HIS N 1 1 5 1958 1 1 14 HIS ND1 N -3.770 -1.986 -6.885 1.00 . A A . 14 HIS ND1 1 1 5 1959 1 1 14 HIS NE2 N -3.696 -4.018 -7.602 1.00 . A A . 14 HIS NE2 1 1 5 1960 1 1 14 HIS O O -3.157 -0.743 -10.356 1.00 . A A . 14 HIS O 1 1 5 1961 1 1 15 GLN C C 0.120 1.906 -10.073 1.00 . A A . 15 GLN C 1 1 5 1962 1 1 15 GLN CA C -1.069 1.064 -10.540 1.00 . A A . 15 GLN CA 1 1 5 1963 1 1 15 GLN CB C -1.579 1.538 -11.917 1.00 . A A . 15 GLN CB 1 1 5 1964 1 1 15 GLN CD C -1.033 4.017 -11.871 1.00 . A A . 15 GLN CD 1 1 5 1965 1 1 15 GLN CG C -2.162 2.981 -11.830 1.00 . A A . 15 GLN CG 1 1 5 1966 1 1 15 GLN H H -2.284 1.877 -8.957 1.00 . A A . 15 GLN H 1 1 5 1967 1 1 15 GLN HA H -0.733 0.045 -10.563 1.00 . A A . 15 GLN HA 1 1 5 1968 1 1 15 GLN HB2 H -0.779 1.488 -12.638 1.00 . A A . 15 GLN HB2 1 1 5 1969 1 1 15 GLN HB3 H -2.368 0.869 -12.230 1.00 . A A . 15 GLN HB3 1 1 5 1970 1 1 15 GLN HE21 H -0.510 3.560 -13.729 1.00 . A A . 15 GLN HE21 1 1 5 1971 1 1 15 GLN HE22 H 0.406 4.789 -13.001 1.00 . A A . 15 GLN HE22 1 1 5 1972 1 1 15 GLN HG2 H -2.820 3.159 -12.668 1.00 . A A . 15 GLN HG2 1 1 5 1973 1 1 15 GLN HG3 H -2.725 3.119 -10.918 1.00 . A A . 15 GLN HG3 1 1 5 1974 1 1 15 GLN N N -2.222 1.134 -9.593 1.00 . A A . 15 GLN N 1 1 5 1975 1 1 15 GLN NE2 N -0.319 4.132 -12.957 1.00 . A A . 15 GLN NE2 1 1 5 1976 1 1 15 GLN O O 1.095 2.091 -10.774 1.00 . A A . 15 GLN O 1 1 5 1977 1 1 15 GLN OE1 O -0.789 4.730 -10.917 1.00 . A A . 15 GLN OE1 1 1 5 1978 1 1 16 PHE C C 2.165 2.324 -7.797 1.00 . A A . 16 PHE C 1 1 5 1979 1 1 16 PHE CA C 1.021 3.233 -8.229 1.00 . A A . 16 PHE CA 1 1 5 1980 1 1 16 PHE CB C 0.422 3.977 -6.987 1.00 . A A . 16 PHE CB 1 1 5 1981 1 1 16 PHE CD1 C -2.017 4.219 -7.650 1.00 . A A . 16 PHE CD1 1 1 5 1982 1 1 16 PHE CD2 C -1.500 2.809 -5.797 1.00 . A A . 16 PHE CD2 1 1 5 1983 1 1 16 PHE CE1 C -3.356 3.933 -7.494 1.00 . A A . 16 PHE CE1 1 1 5 1984 1 1 16 PHE CE2 C -2.841 2.524 -5.642 1.00 . A A . 16 PHE CE2 1 1 5 1985 1 1 16 PHE CG C -1.076 3.659 -6.803 1.00 . A A . 16 PHE CG 1 1 5 1986 1 1 16 PHE CZ C -3.769 3.086 -6.490 1.00 . A A . 16 PHE CZ 1 1 5 1987 1 1 16 PHE H H -0.850 2.148 -8.406 1.00 . A A . 16 PHE H 1 1 5 1988 1 1 16 PHE HA H 1.394 3.940 -8.952 1.00 . A A . 16 PHE HA 1 1 5 1989 1 1 16 PHE HB2 H 0.949 3.705 -6.084 1.00 . A A . 16 PHE HB2 1 1 5 1990 1 1 16 PHE HB3 H 0.527 5.043 -7.129 1.00 . A A . 16 PHE HB3 1 1 5 1991 1 1 16 PHE HD1 H -1.702 4.885 -8.440 1.00 . A A . 16 PHE HD1 1 1 5 1992 1 1 16 PHE HD2 H -0.778 2.364 -5.127 1.00 . A A . 16 PHE HD2 1 1 5 1993 1 1 16 PHE HE1 H -4.078 4.374 -8.164 1.00 . A A . 16 PHE HE1 1 1 5 1994 1 1 16 PHE HE2 H -3.163 1.859 -4.854 1.00 . A A . 16 PHE HE2 1 1 5 1995 1 1 16 PHE HZ H -4.818 2.862 -6.365 1.00 . A A . 16 PHE HZ 1 1 5 1996 1 1 16 PHE N N -0.024 2.380 -8.874 1.00 . A A . 16 PHE N 1 1 5 1997 1 1 16 PHE O O 3.322 2.593 -8.042 1.00 . A A . 16 PHE O 1 1 5 1998 1 1 17 LEU C C 3.487 -0.337 -7.883 1.00 . A A . 17 LEU C 1 1 5 1999 1 1 17 LEU CA C 2.770 0.248 -6.668 1.00 . A A . 17 LEU CA 1 1 5 2000 1 1 17 LEU CB C 2.023 -0.856 -5.906 1.00 . A A . 17 LEU CB 1 1 5 2001 1 1 17 LEU CD1 C 0.082 -1.136 -4.307 1.00 . A A . 17 LEU CD1 1 1 5 2002 1 1 17 LEU CD2 C 2.259 -0.201 -3.464 1.00 . A A . 17 LEU CD2 1 1 5 2003 1 1 17 LEU CG C 1.294 -0.253 -4.669 1.00 . A A . 17 LEU CG 1 1 5 2004 1 1 17 LEU H H 0.832 1.094 -7.019 1.00 . A A . 17 LEU H 1 1 5 2005 1 1 17 LEU HA H 3.485 0.748 -6.036 1.00 . A A . 17 LEU HA 1 1 5 2006 1 1 17 LEU HB2 H 1.305 -1.309 -6.575 1.00 . A A . 17 LEU HB2 1 1 5 2007 1 1 17 LEU HB3 H 2.726 -1.616 -5.598 1.00 . A A . 17 LEU HB3 1 1 5 2008 1 1 17 LEU HD11 H 0.402 -2.143 -4.082 1.00 . A A . 17 LEU HD11 1 1 5 2009 1 1 17 LEU HD12 H -0.427 -0.732 -3.445 1.00 . A A . 17 LEU HD12 1 1 5 2010 1 1 17 LEU HD13 H -0.615 -1.170 -5.133 1.00 . A A . 17 LEU HD13 1 1 5 2011 1 1 17 LEU HD21 H 2.625 -1.190 -3.230 1.00 . A A . 17 LEU HD21 1 1 5 2012 1 1 17 LEU HD22 H 3.100 0.439 -3.686 1.00 . A A . 17 LEU HD22 1 1 5 2013 1 1 17 LEU HD23 H 1.746 0.193 -2.597 1.00 . A A . 17 LEU HD23 1 1 5 2014 1 1 17 LEU HG H 0.944 0.747 -4.884 1.00 . A A . 17 LEU HG 1 1 5 2015 1 1 17 LEU N N 1.783 1.248 -7.163 1.00 . A A . 17 LEU N 1 1 5 2016 1 1 17 LEU O O 4.655 -0.675 -7.827 1.00 . A A . 17 LEU O 1 1 5 2017 1 1 18 VAL C C 4.253 0.015 -10.825 1.00 . A A . 18 VAL C 1 1 5 2018 1 1 18 VAL CA C 3.270 -0.973 -10.224 1.00 . A A . 18 VAL CA 1 1 5 2019 1 1 18 VAL CB C 2.092 -1.235 -11.179 1.00 . A A . 18 VAL CB 1 1 5 2020 1 1 18 VAL CG1 C 2.598 -1.674 -12.574 1.00 . A A . 18 VAL CG1 1 1 5 2021 1 1 18 VAL CG2 C 1.285 -2.378 -10.564 1.00 . A A . 18 VAL CG2 1 1 5 2022 1 1 18 VAL H H 1.802 -0.125 -8.904 1.00 . A A . 18 VAL H 1 1 5 2023 1 1 18 VAL HA H 3.789 -1.883 -9.987 1.00 . A A . 18 VAL HA 1 1 5 2024 1 1 18 VAL HB H 1.477 -0.353 -11.271 1.00 . A A . 18 VAL HB 1 1 5 2025 1 1 18 VAL HG11 H 3.346 -2.448 -12.479 1.00 . A A . 18 VAL HG11 1 1 5 2026 1 1 18 VAL HG12 H 1.777 -2.054 -13.165 1.00 . A A . 18 VAL HG12 1 1 5 2027 1 1 18 VAL HG13 H 3.033 -0.833 -13.095 1.00 . A A . 18 VAL HG13 1 1 5 2028 1 1 18 VAL HG21 H 1.927 -3.237 -10.425 1.00 . A A . 18 VAL HG21 1 1 5 2029 1 1 18 VAL HG22 H 0.901 -2.072 -9.603 1.00 . A A . 18 VAL HG22 1 1 5 2030 1 1 18 VAL HG23 H 0.465 -2.643 -11.212 1.00 . A A . 18 VAL HG23 1 1 5 2031 1 1 18 VAL N N 2.734 -0.426 -8.949 1.00 . A A . 18 VAL N 1 1 5 2032 1 1 18 VAL O O 5.253 -0.375 -11.386 1.00 . A A . 18 VAL O 1 1 5 2033 1 1 19 PHE C C 6.168 2.187 -10.444 1.00 . A A . 19 PHE C 1 1 5 2034 1 1 19 PHE CA C 4.870 2.310 -11.254 1.00 . A A . 19 PHE CA 1 1 5 2035 1 1 19 PHE CB C 4.225 3.699 -11.077 1.00 . A A . 19 PHE CB 1 1 5 2036 1 1 19 PHE CD1 C 4.745 4.686 -13.353 1.00 . A A . 19 PHE CD1 1 1 5 2037 1 1 19 PHE CD2 C 5.789 5.663 -11.443 1.00 . A A . 19 PHE CD2 1 1 5 2038 1 1 19 PHE CE1 C 5.387 5.593 -14.170 1.00 . A A . 19 PHE CE1 1 1 5 2039 1 1 19 PHE CE2 C 6.432 6.570 -12.261 1.00 . A A . 19 PHE CE2 1 1 5 2040 1 1 19 PHE CG C 4.940 4.712 -11.983 1.00 . A A . 19 PHE CG 1 1 5 2041 1 1 19 PHE CZ C 6.231 6.536 -13.625 1.00 . A A . 19 PHE CZ 1 1 5 2042 1 1 19 PHE H H 3.122 1.528 -10.239 1.00 . A A . 19 PHE H 1 1 5 2043 1 1 19 PHE HA H 5.074 2.079 -12.288 1.00 . A A . 19 PHE HA 1 1 5 2044 1 1 19 PHE HB2 H 3.182 3.662 -11.354 1.00 . A A . 19 PHE HB2 1 1 5 2045 1 1 19 PHE HB3 H 4.298 4.026 -10.049 1.00 . A A . 19 PHE HB3 1 1 5 2046 1 1 19 PHE HD1 H 4.084 3.950 -13.789 1.00 . A A . 19 PHE HD1 1 1 5 2047 1 1 19 PHE HD2 H 5.953 5.697 -10.376 1.00 . A A . 19 PHE HD2 1 1 5 2048 1 1 19 PHE HE1 H 5.229 5.563 -15.238 1.00 . A A . 19 PHE HE1 1 1 5 2049 1 1 19 PHE HE2 H 7.094 7.308 -11.832 1.00 . A A . 19 PHE HE2 1 1 5 2050 1 1 19 PHE HZ H 6.735 7.246 -14.264 1.00 . A A . 19 PHE HZ 1 1 5 2051 1 1 19 PHE N N 3.949 1.277 -10.697 1.00 . A A . 19 PHE N 1 1 5 2052 1 1 19 PHE O O 7.260 2.161 -10.971 1.00 . A A . 19 PHE O 1 1 5 2053 1 1 20 PHE C C 7.864 0.639 -8.486 1.00 . A A . 20 PHE C 1 1 5 2054 1 1 20 PHE CA C 7.137 1.961 -8.220 1.00 . A A . 20 PHE CA 1 1 5 2055 1 1 20 PHE CB C 6.597 2.005 -6.777 1.00 . A A . 20 PHE CB 1 1 5 2056 1 1 20 PHE CD1 C 8.258 3.504 -5.581 1.00 . A A . 20 PHE CD1 1 1 5 2057 1 1 20 PHE CD2 C 8.329 1.165 -5.124 1.00 . A A . 20 PHE CD2 1 1 5 2058 1 1 20 PHE CE1 C 9.304 3.707 -4.705 1.00 . A A . 20 PHE CE1 1 1 5 2059 1 1 20 PHE CE2 C 9.376 1.367 -4.248 1.00 . A A . 20 PHE CE2 1 1 5 2060 1 1 20 PHE CG C 7.762 2.231 -5.797 1.00 . A A . 20 PHE CG 1 1 5 2061 1 1 20 PHE CZ C 9.863 2.638 -4.038 1.00 . A A . 20 PHE CZ 1 1 5 2062 1 1 20 PHE H H 5.084 2.093 -8.805 1.00 . A A . 20 PHE H 1 1 5 2063 1 1 20 PHE HA H 7.821 2.780 -8.395 1.00 . A A . 20 PHE HA 1 1 5 2064 1 1 20 PHE HB2 H 5.890 2.816 -6.670 1.00 . A A . 20 PHE HB2 1 1 5 2065 1 1 20 PHE HB3 H 6.100 1.079 -6.529 1.00 . A A . 20 PHE HB3 1 1 5 2066 1 1 20 PHE HD1 H 7.825 4.347 -6.099 1.00 . A A . 20 PHE HD1 1 1 5 2067 1 1 20 PHE HD2 H 7.953 0.165 -5.282 1.00 . A A . 20 PHE HD2 1 1 5 2068 1 1 20 PHE HE1 H 9.685 4.704 -4.541 1.00 . A A . 20 PHE HE1 1 1 5 2069 1 1 20 PHE HE2 H 9.813 0.529 -3.727 1.00 . A A . 20 PHE HE2 1 1 5 2070 1 1 20 PHE HZ H 10.683 2.797 -3.352 1.00 . A A . 20 PHE HZ 1 1 5 2071 1 1 20 PHE N N 5.990 2.089 -9.156 1.00 . A A . 20 PHE N 1 1 5 2072 1 1 20 PHE O O 8.954 0.430 -7.999 1.00 . A A . 20 PHE O 1 1 5 2073 1 1 21 ALA C C 8.594 -1.578 -10.916 1.00 . A A . 21 ALA C 1 1 5 2074 1 1 21 ALA CA C 7.876 -1.531 -9.560 1.00 . A A . 21 ALA CA 1 1 5 2075 1 1 21 ALA CB C 6.762 -2.565 -9.483 1.00 . A A . 21 ALA CB 1 1 5 2076 1 1 21 ALA H H 6.354 -0.040 -9.617 1.00 . A A . 21 ALA H 1 1 5 2077 1 1 21 ALA HA H 8.619 -1.706 -8.810 1.00 . A A . 21 ALA HA 1 1 5 2078 1 1 21 ALA HB1 H 6.262 -2.473 -8.528 1.00 . A A . 21 ALA HB1 1 1 5 2079 1 1 21 ALA HB2 H 6.039 -2.381 -10.262 1.00 . A A . 21 ALA HB2 1 1 5 2080 1 1 21 ALA HB3 H 7.157 -3.561 -9.584 1.00 . A A . 21 ALA HB3 1 1 5 2081 1 1 21 ALA N N 7.244 -0.226 -9.249 1.00 . A A . 21 ALA N 1 1 5 2082 1 1 21 ALA O O 9.680 -2.111 -11.023 1.00 . A A . 21 ALA O 1 1 5 2083 1 1 22 GLU C C 9.648 0.041 -13.425 1.00 . A A . 22 GLU C 1 1 5 2084 1 1 22 GLU CA C 8.520 -0.982 -13.289 1.00 . A A . 22 GLU CA 1 1 5 2085 1 1 22 GLU CB C 7.365 -0.653 -14.275 1.00 . A A . 22 GLU CB 1 1 5 2086 1 1 22 GLU CD C 7.120 1.812 -14.984 1.00 . A A . 22 GLU CD 1 1 5 2087 1 1 22 GLU CG C 6.713 0.724 -13.966 1.00 . A A . 22 GLU CG 1 1 5 2088 1 1 22 GLU H H 7.094 -0.617 -11.736 1.00 . A A . 22 GLU H 1 1 5 2089 1 1 22 GLU HA H 8.912 -1.958 -13.514 1.00 . A A . 22 GLU HA 1 1 5 2090 1 1 22 GLU HB2 H 7.733 -0.670 -15.289 1.00 . A A . 22 GLU HB2 1 1 5 2091 1 1 22 GLU HB3 H 6.602 -1.411 -14.177 1.00 . A A . 22 GLU HB3 1 1 5 2092 1 1 22 GLU HG2 H 5.638 0.610 -13.985 1.00 . A A . 22 GLU HG2 1 1 5 2093 1 1 22 GLU HG3 H 6.994 1.061 -12.984 1.00 . A A . 22 GLU HG3 1 1 5 2094 1 1 22 GLU N N 7.960 -1.020 -11.908 1.00 . A A . 22 GLU N 1 1 5 2095 1 1 22 GLU O O 10.564 -0.142 -14.204 1.00 . A A . 22 GLU O 1 1 5 2096 1 1 22 GLU OE1 O 8.290 1.862 -15.333 1.00 . A A . 22 GLU OE1 1 1 5 2097 1 1 22 GLU OE2 O 6.225 2.552 -15.358 1.00 . A A . 22 GLU OE2 1 1 5 2098 1 1 23 ASP C C 11.746 1.818 -11.789 1.00 . A A . 23 ASP C 1 1 5 2099 1 1 23 ASP CA C 10.555 2.175 -12.675 1.00 . A A . 23 ASP CA 1 1 5 2100 1 1 23 ASP CB C 9.897 3.471 -12.182 1.00 . A A . 23 ASP CB 1 1 5 2101 1 1 23 ASP CG C 8.915 3.990 -13.247 1.00 . A A . 23 ASP CG 1 1 5 2102 1 1 23 ASP H H 8.775 1.172 -12.051 1.00 . A A . 23 ASP H 1 1 5 2103 1 1 23 ASP HA H 10.897 2.298 -13.685 1.00 . A A . 23 ASP HA 1 1 5 2104 1 1 23 ASP HB2 H 9.365 3.281 -11.260 1.00 . A A . 23 ASP HB2 1 1 5 2105 1 1 23 ASP HB3 H 10.646 4.225 -12.000 1.00 . A A . 23 ASP HB3 1 1 5 2106 1 1 23 ASP N N 9.537 1.090 -12.654 1.00 . A A . 23 ASP N 1 1 5 2107 1 1 23 ASP O O 12.873 1.767 -12.241 1.00 . A A . 23 ASP O 1 1 5 2108 1 1 23 ASP OD1 O 9.396 4.507 -14.242 1.00 . A A . 23 ASP OD1 1 1 5 2109 1 1 23 ASP OD2 O 7.730 3.841 -13.010 1.00 . A A . 23 ASP OD2 1 1 5 2110 1 1 24 VAL C C 13.048 -0.157 -9.919 1.00 . A A . 24 VAL C 1 1 5 2111 1 1 24 VAL CA C 12.479 1.215 -9.538 1.00 . A A . 24 VAL CA 1 1 5 2112 1 1 24 VAL CB C 11.844 1.163 -8.135 1.00 . A A . 24 VAL CB 1 1 5 2113 1 1 24 VAL CG1 C 12.943 1.100 -7.055 1.00 . A A . 24 VAL CG1 1 1 5 2114 1 1 24 VAL CG2 C 10.945 2.401 -7.880 1.00 . A A . 24 VAL CG2 1 1 5 2115 1 1 24 VAL H H 10.490 1.647 -10.291 1.00 . A A . 24 VAL H 1 1 5 2116 1 1 24 VAL HA H 13.261 1.950 -9.545 1.00 . A A . 24 VAL HA 1 1 5 2117 1 1 24 VAL HB H 11.264 0.265 -8.079 1.00 . A A . 24 VAL HB 1 1 5 2118 1 1 24 VAL HG11 H 13.587 1.963 -7.119 1.00 . A A . 24 VAL HG11 1 1 5 2119 1 1 24 VAL HG12 H 12.492 1.071 -6.074 1.00 . A A . 24 VAL HG12 1 1 5 2120 1 1 24 VAL HG13 H 13.537 0.208 -7.187 1.00 . A A . 24 VAL HG13 1 1 5 2121 1 1 24 VAL HG21 H 10.167 2.468 -8.627 1.00 . A A . 24 VAL HG21 1 1 5 2122 1 1 24 VAL HG22 H 10.472 2.308 -6.914 1.00 . A A . 24 VAL HG22 1 1 5 2123 1 1 24 VAL HG23 H 11.524 3.310 -7.903 1.00 . A A . 24 VAL HG23 1 1 5 2124 1 1 24 VAL N N 11.433 1.580 -10.544 1.00 . A A . 24 VAL N 1 1 5 2125 1 1 24 VAL O O 14.230 -0.293 -10.172 1.00 . A A . 24 VAL O 1 1 5 2126 1 1 25 GLY C C 12.745 -2.597 -11.827 1.00 . A A . 25 GLY C 1 1 5 2127 1 1 25 GLY CA C 12.585 -2.518 -10.305 1.00 . A A . 25 GLY CA 1 1 5 2128 1 1 25 GLY H H 11.238 -0.941 -9.729 1.00 . A A . 25 GLY H 1 1 5 2129 1 1 25 GLY HA2 H 13.522 -2.760 -9.823 1.00 . A A . 25 GLY HA2 1 1 5 2130 1 1 25 GLY HA3 H 11.821 -3.210 -9.987 1.00 . A A . 25 GLY HA3 1 1 5 2131 1 1 25 GLY N N 12.174 -1.129 -9.947 1.00 . A A . 25 GLY N 1 1 5 2132 1 1 25 GLY O O 12.035 -1.933 -12.557 1.00 . A A . 25 GLY O 1 1 5 2133 1 1 26 SER C C 14.762 -4.847 -13.952 1.00 . A A . 26 SER C 1 1 5 2134 1 1 26 SER CA C 13.937 -3.580 -13.719 1.00 . A A . 26 SER CA 1 1 5 2135 1 1 26 SER CB C 14.701 -2.345 -14.249 1.00 . A A . 26 SER CB 1 1 5 2136 1 1 26 SER H H 14.211 -3.918 -11.619 1.00 . A A . 26 SER H 1 1 5 2137 1 1 26 SER HA H 12.993 -3.691 -14.221 1.00 . A A . 26 SER HA 1 1 5 2138 1 1 26 SER HB2 H 15.111 -2.520 -15.234 1.00 . A A . 26 SER HB2 1 1 5 2139 1 1 26 SER HB3 H 14.070 -1.467 -14.265 1.00 . A A . 26 SER HB3 1 1 5 2140 1 1 26 SER HG H 15.644 -1.285 -12.919 1.00 . A A . 26 SER HG 1 1 5 2141 1 1 26 SER N N 13.674 -3.409 -12.258 1.00 . A A . 26 SER N 1 1 5 2142 1 1 26 SER O O 14.533 -5.578 -14.896 1.00 . A A . 26 SER O 1 1 5 2143 1 1 26 SER OG O 15.762 -2.147 -13.325 1.00 . A A . 26 SER OG 1 1 5 2144 1 1 27 ASN C C 15.960 -7.434 -12.397 1.00 . A A . 27 ASN C 1 1 5 2145 1 1 27 ASN CA C 16.602 -6.245 -13.139 1.00 . A A . 27 ASN CA 1 1 5 2146 1 1 27 ASN CB C 17.957 -5.847 -12.508 1.00 . A A . 27 ASN CB 1 1 5 2147 1 1 27 ASN CG C 19.052 -6.804 -13.000 1.00 . A A . 27 ASN CG 1 1 5 2148 1 1 27 ASN H H 15.807 -4.406 -12.338 1.00 . A A . 27 ASN H 1 1 5 2149 1 1 27 ASN HA H 16.743 -6.519 -14.175 1.00 . A A . 27 ASN HA 1 1 5 2150 1 1 27 ASN HB2 H 18.222 -4.842 -12.801 1.00 . A A . 27 ASN HB2 1 1 5 2151 1 1 27 ASN HB3 H 17.908 -5.893 -11.430 1.00 . A A . 27 ASN HB3 1 1 5 2152 1 1 27 ASN HD21 H 18.901 -7.997 -11.422 1.00 . A A . 27 ASN HD21 1 1 5 2153 1 1 27 ASN HD22 H 20.061 -8.458 -12.573 1.00 . A A . 27 ASN HD22 1 1 5 2154 1 1 27 ASN N N 15.701 -5.053 -13.065 1.00 . A A . 27 ASN N 1 1 5 2155 1 1 27 ASN ND2 N 19.364 -7.839 -12.271 1.00 . A A . 27 ASN ND2 1 1 5 2156 1 1 27 ASN O O 16.608 -8.148 -11.655 1.00 . A A . 27 ASN O 1 1 5 2157 1 1 27 ASN OD1 O 19.631 -6.617 -14.051 1.00 . A A . 27 ASN OD1 1 1 5 2158 1 1 28 LYS C C 14.404 -10.080 -12.529 1.00 . A A . 28 LYS C 1 1 5 2159 1 1 28 LYS CA C 13.921 -8.721 -11.986 1.00 . A A . 28 LYS CA 1 1 5 2160 1 1 28 LYS CB C 12.413 -8.532 -12.285 1.00 . A A . 28 LYS CB 1 1 5 2161 1 1 28 LYS CD C 11.984 -6.089 -11.640 1.00 . A A . 28 LYS CD 1 1 5 2162 1 1 28 LYS CE C 11.137 -5.719 -12.883 1.00 . A A . 28 LYS CE 1 1 5 2163 1 1 28 LYS CG C 11.764 -7.573 -11.249 1.00 . A A . 28 LYS CG 1 1 5 2164 1 1 28 LYS H H 14.217 -7.000 -13.243 1.00 . A A . 28 LYS H 1 1 5 2165 1 1 28 LYS HA H 14.098 -8.683 -10.920 1.00 . A A . 28 LYS HA 1 1 5 2166 1 1 28 LYS HB2 H 12.287 -8.147 -13.287 1.00 . A A . 28 LYS HB2 1 1 5 2167 1 1 28 LYS HB3 H 11.913 -9.487 -12.229 1.00 . A A . 28 LYS HB3 1 1 5 2168 1 1 28 LYS HD2 H 11.695 -5.468 -10.805 1.00 . A A . 28 LYS HD2 1 1 5 2169 1 1 28 LYS HD3 H 13.028 -5.911 -11.843 1.00 . A A . 28 LYS HD3 1 1 5 2170 1 1 28 LYS HE2 H 11.765 -5.688 -13.760 1.00 . A A . 28 LYS HE2 1 1 5 2171 1 1 28 LYS HE3 H 10.350 -6.440 -13.047 1.00 . A A . 28 LYS HE3 1 1 5 2172 1 1 28 LYS HG2 H 10.704 -7.778 -11.193 1.00 . A A . 28 LYS HG2 1 1 5 2173 1 1 28 LYS HG3 H 12.187 -7.749 -10.270 1.00 . A A . 28 LYS HG3 1 1 5 2174 1 1 28 LYS HZ1 H 10.777 -3.986 -11.776 1.00 . A A . 28 LYS HZ1 1 1 5 2175 1 1 28 LYS HZ2 H 10.839 -3.736 -13.452 1.00 . A A . 28 LYS HZ2 1 1 5 2176 1 1 28 LYS HZ3 H 9.476 -4.466 -12.751 1.00 . A A . 28 LYS HZ3 1 1 5 2177 1 1 28 LYS N N 14.683 -7.608 -12.633 1.00 . A A . 28 LYS N 1 1 5 2178 1 1 28 LYS NZ N 10.511 -4.377 -12.701 1.00 . A A . 28 LYS NZ 1 1 5 2179 1 1 28 LYS O O 14.538 -10.169 -13.740 1.00 . A A . 28 LYS O 1 1 5 2180 1 1 28 LYS OXT O 14.613 -10.952 -11.702 1.00 . A A . 28 LYS OXT 1 1 6 2181 1 1 1 ASP C C -23.078 6.652 -10.622 1.00 . A A . 1 ASP C 1 1 6 2182 1 1 1 ASP CA C -24.529 7.139 -10.701 1.00 . A A . 1 ASP CA 1 1 6 2183 1 1 1 ASP CB C -24.590 8.553 -11.336 1.00 . A A . 1 ASP CB 1 1 6 2184 1 1 1 ASP CG C -23.829 8.567 -12.677 1.00 . A A . 1 ASP CG 1 1 6 2185 1 1 1 ASP H1 H -24.395 6.883 -8.639 1.00 . A A . 1 ASP H1 1 1 6 2186 1 1 1 ASP H2 H -25.410 8.159 -9.113 1.00 . A A . 1 ASP H2 1 1 6 2187 1 1 1 ASP H3 H -25.932 6.553 -9.281 1.00 . A A . 1 ASP H3 1 1 6 2188 1 1 1 ASP HA H -25.095 6.441 -11.293 1.00 . A A . 1 ASP HA 1 1 6 2189 1 1 1 ASP HB2 H -25.619 8.828 -11.515 1.00 . A A . 1 ASP HB2 1 1 6 2190 1 1 1 ASP HB3 H -24.155 9.283 -10.669 1.00 . A A . 1 ASP HB3 1 1 6 2191 1 1 1 ASP N N -25.110 7.187 -9.330 1.00 . A A . 1 ASP N 1 1 6 2192 1 1 1 ASP O O -22.750 5.582 -11.097 1.00 . A A . 1 ASP O 1 1 6 2193 1 1 1 ASP OD1 O -24.437 8.159 -13.653 1.00 . A A . 1 ASP OD1 1 1 6 2194 1 1 1 ASP OD2 O -22.682 8.983 -12.646 1.00 . A A . 1 ASP OD2 1 1 6 2195 1 1 2 ALA C C -20.259 7.874 -8.619 1.00 . A A . 2 ALA C 1 1 6 2196 1 1 2 ALA CA C -20.808 7.151 -9.855 1.00 . A A . 2 ALA CA 1 1 6 2197 1 1 2 ALA CB C -20.056 7.603 -11.122 1.00 . A A . 2 ALA CB 1 1 6 2198 1 1 2 ALA H H -22.620 8.313 -9.669 1.00 . A A . 2 ALA H 1 1 6 2199 1 1 2 ALA HA H -20.691 6.087 -9.712 1.00 . A A . 2 ALA HA 1 1 6 2200 1 1 2 ALA HB1 H -20.188 8.665 -11.275 1.00 . A A . 2 ALA HB1 1 1 6 2201 1 1 2 ALA HB2 H -19.001 7.397 -11.017 1.00 . A A . 2 ALA HB2 1 1 6 2202 1 1 2 ALA HB3 H -20.430 7.074 -11.986 1.00 . A A . 2 ALA HB3 1 1 6 2203 1 1 2 ALA N N -22.260 7.472 -10.018 1.00 . A A . 2 ALA N 1 1 6 2204 1 1 2 ALA O O -19.482 8.805 -8.728 1.00 . A A . 2 ALA O 1 1 6 2205 1 1 3 GLU C C -18.777 7.601 -5.892 1.00 . A A . 3 GLU C 1 1 6 2206 1 1 3 GLU CA C -20.224 8.031 -6.188 1.00 . A A . 3 GLU CA 1 1 6 2207 1 1 3 GLU CB C -21.183 7.585 -5.047 1.00 . A A . 3 GLU CB 1 1 6 2208 1 1 3 GLU CD C -19.748 8.809 -3.337 1.00 . A A . 3 GLU CD 1 1 6 2209 1 1 3 GLU CG C -21.174 8.631 -3.900 1.00 . A A . 3 GLU CG 1 1 6 2210 1 1 3 GLU H H -21.311 6.660 -7.449 1.00 . A A . 3 GLU H 1 1 6 2211 1 1 3 GLU HA H -20.253 9.107 -6.292 1.00 . A A . 3 GLU HA 1 1 6 2212 1 1 3 GLU HB2 H -22.188 7.514 -5.438 1.00 . A A . 3 GLU HB2 1 1 6 2213 1 1 3 GLU HB3 H -20.906 6.612 -4.666 1.00 . A A . 3 GLU HB3 1 1 6 2214 1 1 3 GLU HG2 H -21.535 9.583 -4.264 1.00 . A A . 3 GLU HG2 1 1 6 2215 1 1 3 GLU HG3 H -21.827 8.301 -3.105 1.00 . A A . 3 GLU HG3 1 1 6 2216 1 1 3 GLU N N -20.686 7.414 -7.468 1.00 . A A . 3 GLU N 1 1 6 2217 1 1 3 GLU O O -18.515 6.710 -5.107 1.00 . A A . 3 GLU O 1 1 6 2218 1 1 3 GLU OE1 O -19.378 7.978 -2.523 1.00 . A A . 3 GLU OE1 1 1 6 2219 1 1 3 GLU OE2 O -19.105 9.763 -3.751 1.00 . A A . 3 GLU OE2 1 1 6 2220 1 1 4 PHE C C -15.696 9.353 -6.645 1.00 . A A . 4 PHE C 1 1 6 2221 1 1 4 PHE CA C -16.415 8.027 -6.422 1.00 . A A . 4 PHE CA 1 1 6 2222 1 1 4 PHE CB C -15.957 6.989 -7.481 1.00 . A A . 4 PHE CB 1 1 6 2223 1 1 4 PHE CD1 C -16.610 4.779 -6.421 1.00 . A A . 4 PHE CD1 1 1 6 2224 1 1 4 PHE CD2 C -17.855 5.532 -8.311 1.00 . A A . 4 PHE CD2 1 1 6 2225 1 1 4 PHE CE1 C -17.403 3.651 -6.352 1.00 . A A . 4 PHE CE1 1 1 6 2226 1 1 4 PHE CE2 C -18.647 4.406 -8.241 1.00 . A A . 4 PHE CE2 1 1 6 2227 1 1 4 PHE CG C -16.831 5.728 -7.402 1.00 . A A . 4 PHE CG 1 1 6 2228 1 1 4 PHE CZ C -18.421 3.464 -7.260 1.00 . A A . 4 PHE CZ 1 1 6 2229 1 1 4 PHE H H -18.182 8.979 -7.175 1.00 . A A . 4 PHE H 1 1 6 2230 1 1 4 PHE HA H -16.199 7.708 -5.421 1.00 . A A . 4 PHE HA 1 1 6 2231 1 1 4 PHE HB2 H -16.032 7.408 -8.474 1.00 . A A . 4 PHE HB2 1 1 6 2232 1 1 4 PHE HB3 H -14.929 6.708 -7.303 1.00 . A A . 4 PHE HB3 1 1 6 2233 1 1 4 PHE HD1 H -15.813 4.918 -5.705 1.00 . A A . 4 PHE HD1 1 1 6 2234 1 1 4 PHE HD2 H -18.037 6.267 -9.082 1.00 . A A . 4 PHE HD2 1 1 6 2235 1 1 4 PHE HE1 H -17.223 2.914 -5.583 1.00 . A A . 4 PHE HE1 1 1 6 2236 1 1 4 PHE HE2 H -19.445 4.262 -8.954 1.00 . A A . 4 PHE HE2 1 1 6 2237 1 1 4 PHE HZ H -19.041 2.582 -7.205 1.00 . A A . 4 PHE HZ 1 1 6 2238 1 1 4 PHE N N -17.882 8.279 -6.560 1.00 . A A . 4 PHE N 1 1 6 2239 1 1 4 PHE O O -14.569 9.377 -7.098 1.00 . A A . 4 PHE O 1 1 6 2240 1 1 5 ARG C C -15.126 12.036 -7.749 1.00 . A A . 5 ARG C 1 1 6 2241 1 1 5 ARG CA C -15.901 11.822 -6.436 1.00 . A A . 5 ARG CA 1 1 6 2242 1 1 5 ARG CB C -15.015 12.167 -5.185 1.00 . A A . 5 ARG CB 1 1 6 2243 1 1 5 ARG CD C -13.859 10.221 -4.036 1.00 . A A . 5 ARG CD 1 1 6 2244 1 1 5 ARG CG C -13.704 11.352 -5.088 1.00 . A A . 5 ARG CG 1 1 6 2245 1 1 5 ARG CZ C -11.793 8.912 -4.298 1.00 . A A . 5 ARG CZ 1 1 6 2246 1 1 5 ARG H H -17.296 10.262 -5.946 1.00 . A A . 5 ARG H 1 1 6 2247 1 1 5 ARG HA H -16.761 12.476 -6.447 1.00 . A A . 5 ARG HA 1 1 6 2248 1 1 5 ARG HB2 H -14.757 13.215 -5.235 1.00 . A A . 5 ARG HB2 1 1 6 2249 1 1 5 ARG HB3 H -15.611 12.024 -4.295 1.00 . A A . 5 ARG HB3 1 1 6 2250 1 1 5 ARG HD2 H -14.381 10.585 -3.162 1.00 . A A . 5 ARG HD2 1 1 6 2251 1 1 5 ARG HD3 H -14.404 9.377 -4.432 1.00 . A A . 5 ARG HD3 1 1 6 2252 1 1 5 ARG HE H -12.122 10.136 -2.773 1.00 . A A . 5 ARG HE 1 1 6 2253 1 1 5 ARG HG2 H -13.422 10.959 -6.051 1.00 . A A . 5 ARG HG2 1 1 6 2254 1 1 5 ARG HG3 H -12.922 12.021 -4.774 1.00 . A A . 5 ARG HG3 1 1 6 2255 1 1 5 ARG HH11 H -13.165 8.676 -5.741 1.00 . A A . 5 ARG HH11 1 1 6 2256 1 1 5 ARG HH12 H -11.714 7.752 -5.929 1.00 . A A . 5 ARG HH12 1 1 6 2257 1 1 5 ARG HH21 H -10.280 8.977 -2.990 1.00 . A A . 5 ARG HH21 1 1 6 2258 1 1 5 ARG HH22 H -10.049 7.927 -4.345 1.00 . A A . 5 ARG HH22 1 1 6 2259 1 1 5 ARG N N -16.396 10.411 -6.304 1.00 . A A . 5 ARG N 1 1 6 2260 1 1 5 ARG NE N -12.497 9.773 -3.603 1.00 . A A . 5 ARG NE 1 1 6 2261 1 1 5 ARG NH1 N -12.261 8.408 -5.409 1.00 . A A . 5 ARG NH1 1 1 6 2262 1 1 5 ARG NH2 N -10.616 8.579 -3.843 1.00 . A A . 5 ARG NH2 1 1 6 2263 1 1 5 ARG O O -14.157 12.769 -7.832 1.00 . A A . 5 ARG O 1 1 6 2264 1 1 6 HIS C C -13.793 10.549 -10.236 1.00 . A A . 6 HIS C 1 1 6 2265 1 1 6 HIS CA C -15.108 11.334 -10.134 1.00 . A A . 6 HIS CA 1 1 6 2266 1 1 6 HIS CB C -14.909 12.811 -10.602 1.00 . A A . 6 HIS CB 1 1 6 2267 1 1 6 HIS CD2 C -13.952 12.961 -13.069 1.00 . A A . 6 HIS CD2 1 1 6 2268 1 1 6 HIS CE1 C -15.752 12.858 -14.095 1.00 . A A . 6 HIS CE1 1 1 6 2269 1 1 6 HIS CG C -14.964 12.857 -12.131 1.00 . A A . 6 HIS CG 1 1 6 2270 1 1 6 HIS H H -16.405 10.771 -8.511 1.00 . A A . 6 HIS H 1 1 6 2271 1 1 6 HIS HA H -15.841 10.848 -10.763 1.00 . A A . 6 HIS HA 1 1 6 2272 1 1 6 HIS HB2 H -15.696 13.439 -10.212 1.00 . A A . 6 HIS HB2 1 1 6 2273 1 1 6 HIS HB3 H -13.956 13.204 -10.278 1.00 . A A . 6 HIS HB3 1 1 6 2274 1 1 6 HIS HD1 H -16.953 12.718 -12.471 1.00 . A A . 6 HIS HD1 1 1 6 2275 1 1 6 HIS HD2 H -12.900 13.033 -12.837 1.00 . A A . 6 HIS HD2 1 1 6 2276 1 1 6 HIS HE1 H -16.481 12.828 -14.890 1.00 . A A . 6 HIS HE1 1 1 6 2277 1 1 6 HIS N N -15.635 11.335 -8.731 1.00 . A A . 6 HIS N 1 1 6 2278 1 1 6 HIS ND1 N -16.047 12.798 -12.836 1.00 . A A . 6 HIS ND1 1 1 6 2279 1 1 6 HIS NE2 N -14.459 12.961 -14.285 1.00 . A A . 6 HIS NE2 1 1 6 2280 1 1 6 HIS O O -12.798 11.027 -10.748 1.00 . A A . 6 HIS O 1 1 6 2281 1 1 7 ASP C C -11.466 9.123 -9.112 1.00 . A A . 7 ASP C 1 1 6 2282 1 1 7 ASP CA C -12.681 8.416 -9.726 1.00 . A A . 7 ASP CA 1 1 6 2283 1 1 7 ASP CB C -12.395 7.975 -11.200 1.00 . A A . 7 ASP CB 1 1 6 2284 1 1 7 ASP CG C -11.549 6.681 -11.277 1.00 . A A . 7 ASP CG 1 1 6 2285 1 1 7 ASP H H -14.701 9.041 -9.334 1.00 . A A . 7 ASP H 1 1 6 2286 1 1 7 ASP HA H -12.925 7.566 -9.110 1.00 . A A . 7 ASP HA 1 1 6 2287 1 1 7 ASP HB2 H -13.338 7.798 -11.698 1.00 . A A . 7 ASP HB2 1 1 6 2288 1 1 7 ASP HB3 H -11.873 8.757 -11.732 1.00 . A A . 7 ASP HB3 1 1 6 2289 1 1 7 ASP N N -13.856 9.342 -9.727 1.00 . A A . 7 ASP N 1 1 6 2290 1 1 7 ASP O O -10.396 9.178 -9.684 1.00 . A A . 7 ASP O 1 1 6 2291 1 1 7 ASP OD1 O -10.880 6.354 -10.309 1.00 . A A . 7 ASP OD1 1 1 6 2292 1 1 7 ASP OD2 O -11.621 6.078 -12.335 1.00 . A A . 7 ASP OD2 1 1 6 2293 1 1 8 SER C C -10.208 11.621 -7.958 1.00 . A A . 8 SER C 1 1 6 2294 1 1 8 SER CA C -10.661 10.386 -7.164 1.00 . A A . 8 SER CA 1 1 6 2295 1 1 8 SER CB C -9.466 9.427 -6.900 1.00 . A A . 8 SER CB 1 1 6 2296 1 1 8 SER H H -12.609 9.551 -7.570 1.00 . A A . 8 SER H 1 1 6 2297 1 1 8 SER HA H -11.104 10.718 -6.237 1.00 . A A . 8 SER HA 1 1 6 2298 1 1 8 SER HB2 H -9.803 8.428 -6.665 1.00 . A A . 8 SER HB2 1 1 6 2299 1 1 8 SER HB3 H -8.771 9.396 -7.726 1.00 . A A . 8 SER HB3 1 1 6 2300 1 1 8 SER HG H -8.818 9.321 -5.068 1.00 . A A . 8 SER HG 1 1 6 2301 1 1 8 SER N N -11.709 9.649 -7.938 1.00 . A A . 8 SER N 1 1 6 2302 1 1 8 SER O O -9.079 12.062 -7.857 1.00 . A A . 8 SER O 1 1 6 2303 1 1 8 SER OG O -8.823 9.984 -5.763 1.00 . A A . 8 SER OG 1 1 6 2304 1 1 9 GLY C C -10.250 12.941 -10.921 1.00 . A A . 9 GLY C 1 1 6 2305 1 1 9 GLY CA C -10.861 13.343 -9.573 1.00 . A A . 9 GLY CA 1 1 6 2306 1 1 9 GLY H H -12.018 11.716 -8.749 1.00 . A A . 9 GLY H 1 1 6 2307 1 1 9 GLY HA2 H -11.793 13.861 -9.749 1.00 . A A . 9 GLY HA2 1 1 6 2308 1 1 9 GLY HA3 H -10.179 14.003 -9.057 1.00 . A A . 9 GLY HA3 1 1 6 2309 1 1 9 GLY N N -11.132 12.138 -8.730 1.00 . A A . 9 GLY N 1 1 6 2310 1 1 9 GLY O O -10.558 13.528 -11.940 1.00 . A A . 9 GLY O 1 1 6 2311 1 1 10 TYR C C -8.120 10.053 -11.825 1.00 . A A . 10 TYR C 1 1 6 2312 1 1 10 TYR CA C -8.722 11.440 -12.110 1.00 . A A . 10 TYR CA 1 1 6 2313 1 1 10 TYR CB C -7.618 12.474 -12.528 1.00 . A A . 10 TYR CB 1 1 6 2314 1 1 10 TYR CD1 C -5.976 12.015 -10.641 1.00 . A A . 10 TYR CD1 1 1 6 2315 1 1 10 TYR CD2 C -5.192 11.829 -12.881 1.00 . A A . 10 TYR CD2 1 1 6 2316 1 1 10 TYR CE1 C -4.724 11.673 -10.176 1.00 . A A . 10 TYR CE1 1 1 6 2317 1 1 10 TYR CE2 C -3.941 11.487 -12.415 1.00 . A A . 10 TYR CE2 1 1 6 2318 1 1 10 TYR CG C -6.221 12.096 -11.999 1.00 . A A . 10 TYR CG 1 1 6 2319 1 1 10 TYR CZ C -3.698 11.406 -11.059 1.00 . A A . 10 TYR CZ 1 1 6 2320 1 1 10 TYR H H -9.198 11.515 -10.026 1.00 . A A . 10 TYR H 1 1 6 2321 1 1 10 TYR HA H -9.464 11.339 -12.884 1.00 . A A . 10 TYR HA 1 1 6 2322 1 1 10 TYR HB2 H -7.579 12.530 -13.607 1.00 . A A . 10 TYR HB2 1 1 6 2323 1 1 10 TYR HB3 H -7.866 13.456 -12.152 1.00 . A A . 10 TYR HB3 1 1 6 2324 1 1 10 TYR HD1 H -6.769 12.223 -9.936 1.00 . A A . 10 TYR HD1 1 1 6 2325 1 1 10 TYR HD2 H -5.365 11.887 -13.946 1.00 . A A . 10 TYR HD2 1 1 6 2326 1 1 10 TYR HE1 H -4.546 11.612 -9.113 1.00 . A A . 10 TYR HE1 1 1 6 2327 1 1 10 TYR HE2 H -3.147 11.281 -13.117 1.00 . A A . 10 TYR HE2 1 1 6 2328 1 1 10 TYR HH H -2.078 11.828 -10.146 1.00 . A A . 10 TYR HH 1 1 6 2329 1 1 10 TYR N N -9.399 11.945 -10.879 1.00 . A A . 10 TYR N 1 1 6 2330 1 1 10 TYR O O -7.990 9.654 -10.684 1.00 . A A . 10 TYR O 1 1 6 2331 1 1 10 TYR OH O -2.446 11.063 -10.594 1.00 . A A . 10 TYR OH 1 1 6 2332 1 1 11 GLU C C -6.671 7.636 -14.140 1.00 . A A . 11 GLU C 1 1 6 2333 1 1 11 GLU CA C -7.171 8.004 -12.753 1.00 . A A . 11 GLU CA 1 1 6 2334 1 1 11 GLU CB C -8.254 7.005 -12.279 1.00 . A A . 11 GLU CB 1 1 6 2335 1 1 11 GLU CD C -8.674 4.641 -11.548 1.00 . A A . 11 GLU CD 1 1 6 2336 1 1 11 GLU CG C -7.646 5.589 -12.181 1.00 . A A . 11 GLU CG 1 1 6 2337 1 1 11 GLU H H -7.874 9.743 -13.777 1.00 . A A . 11 GLU H 1 1 6 2338 1 1 11 GLU HA H -6.324 8.033 -12.080 1.00 . A A . 11 GLU HA 1 1 6 2339 1 1 11 GLU HB2 H -8.616 7.306 -11.307 1.00 . A A . 11 GLU HB2 1 1 6 2340 1 1 11 GLU HB3 H -9.085 7.004 -12.969 1.00 . A A . 11 GLU HB3 1 1 6 2341 1 1 11 GLU HG2 H -7.385 5.220 -13.163 1.00 . A A . 11 GLU HG2 1 1 6 2342 1 1 11 GLU HG3 H -6.753 5.605 -11.571 1.00 . A A . 11 GLU HG3 1 1 6 2343 1 1 11 GLU N N -7.764 9.366 -12.879 1.00 . A A . 11 GLU N 1 1 6 2344 1 1 11 GLU O O -7.427 7.310 -15.035 1.00 . A A . 11 GLU O 1 1 6 2345 1 1 11 GLU OE1 O -9.473 4.115 -12.307 1.00 . A A . 11 GLU OE1 1 1 6 2346 1 1 11 GLU OE2 O -8.608 4.495 -10.338 1.00 . A A . 11 GLU OE2 1 1 6 2347 1 1 12 VAL C C -4.985 5.971 -15.960 1.00 . A A . 12 VAL C 1 1 6 2348 1 1 12 VAL CA C -4.668 7.403 -15.509 1.00 . A A . 12 VAL CA 1 1 6 2349 1 1 12 VAL CB C -3.182 7.596 -15.239 1.00 . A A . 12 VAL CB 1 1 6 2350 1 1 12 VAL CG1 C -2.375 7.381 -16.533 1.00 . A A . 12 VAL CG1 1 1 6 2351 1 1 12 VAL CG2 C -2.936 9.021 -14.695 1.00 . A A . 12 VAL CG2 1 1 6 2352 1 1 12 VAL H H -4.855 7.990 -13.460 1.00 . A A . 12 VAL H 1 1 6 2353 1 1 12 VAL HA H -4.978 8.097 -16.260 1.00 . A A . 12 VAL HA 1 1 6 2354 1 1 12 VAL HB H -2.921 6.887 -14.478 1.00 . A A . 12 VAL HB 1 1 6 2355 1 1 12 VAL HG11 H -2.763 8.013 -17.320 1.00 . A A . 12 VAL HG11 1 1 6 2356 1 1 12 VAL HG12 H -1.336 7.622 -16.369 1.00 . A A . 12 VAL HG12 1 1 6 2357 1 1 12 VAL HG13 H -2.450 6.350 -16.846 1.00 . A A . 12 VAL HG13 1 1 6 2358 1 1 12 VAL HG21 H -3.515 9.746 -15.248 1.00 . A A . 12 VAL HG21 1 1 6 2359 1 1 12 VAL HG22 H -3.233 9.063 -13.656 1.00 . A A . 12 VAL HG22 1 1 6 2360 1 1 12 VAL HG23 H -1.890 9.281 -14.761 1.00 . A A . 12 VAL HG23 1 1 6 2361 1 1 12 VAL N N -5.377 7.716 -14.242 1.00 . A A . 12 VAL N 1 1 6 2362 1 1 12 VAL O O -5.452 5.744 -17.060 1.00 . A A . 12 VAL O 1 1 6 2363 1 1 13 HIS C C -4.511 2.876 -14.006 1.00 . A A . 13 HIS C 1 1 6 2364 1 1 13 HIS CA C -4.938 3.607 -15.287 1.00 . A A . 13 HIS CA 1 1 6 2365 1 1 13 HIS CB C -4.085 3.127 -16.499 1.00 . A A . 13 HIS CB 1 1 6 2366 1 1 13 HIS CD2 C -4.758 0.662 -17.221 1.00 . A A . 13 HIS CD2 1 1 6 2367 1 1 13 HIS CE1 C -3.352 -0.370 -16.098 1.00 . A A . 13 HIS CE1 1 1 6 2368 1 1 13 HIS CG C -4.006 1.595 -16.529 1.00 . A A . 13 HIS CG 1 1 6 2369 1 1 13 HIS H H -4.338 5.364 -14.208 1.00 . A A . 13 HIS H 1 1 6 2370 1 1 13 HIS HA H -5.991 3.441 -15.461 1.00 . A A . 13 HIS HA 1 1 6 2371 1 1 13 HIS HB2 H -4.528 3.463 -17.425 1.00 . A A . 13 HIS HB2 1 1 6 2372 1 1 13 HIS HB3 H -3.082 3.523 -16.432 1.00 . A A . 13 HIS HB3 1 1 6 2373 1 1 13 HIS HD1 H -2.475 1.251 -15.258 1.00 . A A . 13 HIS HD1 1 1 6 2374 1 1 13 HIS HD2 H -5.571 0.897 -17.894 1.00 . A A . 13 HIS HD2 1 1 6 2375 1 1 13 HIS HE1 H -2.772 -1.169 -15.657 1.00 . A A . 13 HIS HE1 1 1 6 2376 1 1 13 HIS N N -4.710 5.064 -15.062 1.00 . A A . 13 HIS N 1 1 6 2377 1 1 13 HIS ND1 N -3.159 0.888 -15.858 1.00 . A A . 13 HIS ND1 1 1 6 2378 1 1 13 HIS NE2 N -4.337 -0.556 -16.941 1.00 . A A . 13 HIS NE2 1 1 6 2379 1 1 13 HIS O O -5.302 2.196 -13.382 1.00 . A A . 13 HIS O 1 1 6 2380 1 1 14 HIS C C -1.269 3.034 -12.233 1.00 . A A . 14 HIS C 1 1 6 2381 1 1 14 HIS CA C -2.660 2.428 -12.456 1.00 . A A . 14 HIS CA 1 1 6 2382 1 1 14 HIS CB C -2.594 0.888 -12.684 1.00 . A A . 14 HIS CB 1 1 6 2383 1 1 14 HIS CD2 C -1.037 -0.534 -11.090 1.00 . A A . 14 HIS CD2 1 1 6 2384 1 1 14 HIS CE1 C -2.182 -0.422 -9.365 1.00 . A A . 14 HIS CE1 1 1 6 2385 1 1 14 HIS CG C -2.161 0.214 -11.380 1.00 . A A . 14 HIS CG 1 1 6 2386 1 1 14 HIS H H -2.694 3.629 -14.229 1.00 . A A . 14 HIS H 1 1 6 2387 1 1 14 HIS HA H -3.254 2.671 -11.593 1.00 . A A . 14 HIS HA 1 1 6 2388 1 1 14 HIS HB2 H -3.563 0.498 -12.958 1.00 . A A . 14 HIS HB2 1 1 6 2389 1 1 14 HIS HB3 H -1.890 0.638 -13.464 1.00 . A A . 14 HIS HB3 1 1 6 2390 1 1 14 HIS HD1 H -3.679 0.701 -10.138 1.00 . A A . 14 HIS HD1 1 1 6 2391 1 1 14 HIS HD2 H -0.253 -0.766 -11.795 1.00 . A A . 14 HIS HD2 1 1 6 2392 1 1 14 HIS HE1 H -2.525 -0.548 -8.350 1.00 . A A . 14 HIS HE1 1 1 6 2393 1 1 14 HIS N N -3.258 3.058 -13.670 1.00 . A A . 14 HIS N 1 1 6 2394 1 1 14 HIS ND1 N -2.822 0.244 -10.272 1.00 . A A . 14 HIS ND1 1 1 6 2395 1 1 14 HIS NE2 N -1.065 -0.923 -9.832 1.00 . A A . 14 HIS NE2 1 1 6 2396 1 1 14 HIS O O -1.190 4.201 -11.900 1.00 . A A . 14 HIS O 1 1 6 2397 1 1 15 GLN C C 1.280 3.481 -10.877 1.00 . A A . 15 GLN C 1 1 6 2398 1 1 15 GLN CA C 1.173 2.753 -12.219 1.00 . A A . 15 GLN CA 1 1 6 2399 1 1 15 GLN CB C 1.511 3.681 -13.411 1.00 . A A . 15 GLN CB 1 1 6 2400 1 1 15 GLN CD C 3.437 2.360 -14.349 1.00 . A A . 15 GLN CD 1 1 6 2401 1 1 15 GLN CG C 1.988 2.814 -14.591 1.00 . A A . 15 GLN CG 1 1 6 2402 1 1 15 GLN H H -0.355 1.326 -12.688 1.00 . A A . 15 GLN H 1 1 6 2403 1 1 15 GLN HA H 1.824 1.889 -12.161 1.00 . A A . 15 GLN HA 1 1 6 2404 1 1 15 GLN HB2 H 0.625 4.225 -13.706 1.00 . A A . 15 GLN HB2 1 1 6 2405 1 1 15 GLN HB3 H 2.272 4.395 -13.138 1.00 . A A . 15 GLN HB3 1 1 6 2406 1 1 15 GLN HE21 H 2.901 0.610 -13.581 1.00 . A A . 15 GLN HE21 1 1 6 2407 1 1 15 GLN HE22 H 4.574 0.885 -13.660 1.00 . A A . 15 GLN HE22 1 1 6 2408 1 1 15 GLN HG2 H 1.357 1.943 -14.694 1.00 . A A . 15 GLN HG2 1 1 6 2409 1 1 15 GLN HG3 H 1.945 3.384 -15.507 1.00 . A A . 15 GLN HG3 1 1 6 2410 1 1 15 GLN N N -0.225 2.257 -12.416 1.00 . A A . 15 GLN N 1 1 6 2411 1 1 15 GLN NE2 N 3.656 1.188 -13.819 1.00 . A A . 15 GLN NE2 1 1 6 2412 1 1 15 GLN O O 1.788 4.576 -10.732 1.00 . A A . 15 GLN O 1 1 6 2413 1 1 15 GLN OE1 O 4.381 3.069 -14.638 1.00 . A A . 15 GLN OE1 1 1 6 2414 1 1 16 PHE C C 0.945 1.820 -7.884 1.00 . A A . 16 PHE C 1 1 6 2415 1 1 16 PHE CA C 0.687 3.177 -8.513 1.00 . A A . 16 PHE CA 1 1 6 2416 1 1 16 PHE CB C -0.719 3.721 -8.218 1.00 . A A . 16 PHE CB 1 1 6 2417 1 1 16 PHE CD1 C -0.137 4.368 -5.827 1.00 . A A . 16 PHE CD1 1 1 6 2418 1 1 16 PHE CD2 C -2.126 3.107 -6.201 1.00 . A A . 16 PHE CD2 1 1 6 2419 1 1 16 PHE CE1 C -0.396 4.374 -4.473 1.00 . A A . 16 PHE CE1 1 1 6 2420 1 1 16 PHE CE2 C -2.385 3.113 -4.845 1.00 . A A . 16 PHE CE2 1 1 6 2421 1 1 16 PHE CG C -1.001 3.734 -6.704 1.00 . A A . 16 PHE CG 1 1 6 2422 1 1 16 PHE CZ C -1.519 3.747 -3.981 1.00 . A A . 16 PHE CZ 1 1 6 2423 1 1 16 PHE H H 0.360 1.898 -10.179 1.00 . A A . 16 PHE H 1 1 6 2424 1 1 16 PHE HA H 1.486 3.868 -8.282 1.00 . A A . 16 PHE HA 1 1 6 2425 1 1 16 PHE HB2 H -0.794 4.730 -8.597 1.00 . A A . 16 PHE HB2 1 1 6 2426 1 1 16 PHE HB3 H -1.455 3.107 -8.715 1.00 . A A . 16 PHE HB3 1 1 6 2427 1 1 16 PHE HD1 H 0.746 4.863 -6.204 1.00 . A A . 16 PHE HD1 1 1 6 2428 1 1 16 PHE HD2 H -2.811 2.607 -6.871 1.00 . A A . 16 PHE HD2 1 1 6 2429 1 1 16 PHE HE1 H 0.284 4.872 -3.795 1.00 . A A . 16 PHE HE1 1 1 6 2430 1 1 16 PHE HE2 H -3.266 2.620 -4.461 1.00 . A A . 16 PHE HE2 1 1 6 2431 1 1 16 PHE HZ H -1.722 3.752 -2.920 1.00 . A A . 16 PHE HZ 1 1 6 2432 1 1 16 PHE N N 0.747 2.765 -9.934 1.00 . A A . 16 PHE N 1 1 6 2433 1 1 16 PHE O O 0.158 0.916 -8.077 1.00 . A A . 16 PHE O 1 1 6 2434 1 1 17 LEU C C 3.271 -0.345 -7.512 1.00 . A A . 17 LEU C 1 1 6 2435 1 1 17 LEU CA C 2.479 0.470 -6.476 1.00 . A A . 17 LEU CA 1 1 6 2436 1 1 17 LEU CB C 1.285 -0.418 -5.987 1.00 . A A . 17 LEU CB 1 1 6 2437 1 1 17 LEU CD1 C -1.188 -0.035 -5.523 1.00 . A A . 17 LEU CD1 1 1 6 2438 1 1 17 LEU CD2 C 0.489 0.217 -3.662 1.00 . A A . 17 LEU CD2 1 1 6 2439 1 1 17 LEU CG C 0.252 0.419 -5.167 1.00 . A A . 17 LEU CG 1 1 6 2440 1 1 17 LEU H H 2.610 2.518 -7.088 1.00 . A A . 17 LEU H 1 1 6 2441 1 1 17 LEU HA H 3.121 0.737 -5.653 1.00 . A A . 17 LEU HA 1 1 6 2442 1 1 17 LEU HB2 H 0.813 -0.894 -6.834 1.00 . A A . 17 LEU HB2 1 1 6 2443 1 1 17 LEU HB3 H 1.691 -1.204 -5.367 1.00 . A A . 17 LEU HB3 1 1 6 2444 1 1 17 LEU HD11 H -1.231 -1.109 -5.643 1.00 . A A . 17 LEU HD11 1 1 6 2445 1 1 17 LEU HD12 H -1.882 0.252 -4.747 1.00 . A A . 17 LEU HD12 1 1 6 2446 1 1 17 LEU HD13 H -1.510 0.423 -6.446 1.00 . A A . 17 LEU HD13 1 1 6 2447 1 1 17 LEU HD21 H 1.511 0.464 -3.414 1.00 . A A . 17 LEU HD21 1 1 6 2448 1 1 17 LEU HD22 H -0.170 0.861 -3.099 1.00 . A A . 17 LEU HD22 1 1 6 2449 1 1 17 LEU HD23 H 0.298 -0.809 -3.386 1.00 . A A . 17 LEU HD23 1 1 6 2450 1 1 17 LEU HG H 0.368 1.470 -5.384 1.00 . A A . 17 LEU HG 1 1 6 2451 1 1 17 LEU N N 2.040 1.728 -7.171 1.00 . A A . 17 LEU N 1 1 6 2452 1 1 17 LEU O O 4.143 -1.117 -7.164 1.00 . A A . 17 LEU O 1 1 6 2453 1 1 18 VAL C C 4.563 0.123 -10.553 1.00 . A A . 18 VAL C 1 1 6 2454 1 1 18 VAL CA C 3.580 -0.827 -9.904 1.00 . A A . 18 VAL CA 1 1 6 2455 1 1 18 VAL CB C 2.492 -1.255 -10.896 1.00 . A A . 18 VAL CB 1 1 6 2456 1 1 18 VAL CG1 C 3.108 -1.883 -12.171 1.00 . A A . 18 VAL CG1 1 1 6 2457 1 1 18 VAL CG2 C 1.640 -2.314 -10.196 1.00 . A A . 18 VAL CG2 1 1 6 2458 1 1 18 VAL H H 2.216 0.509 -8.970 1.00 . A A . 18 VAL H 1 1 6 2459 1 1 18 VAL HA H 4.130 -1.672 -9.529 1.00 . A A . 18 VAL HA 1 1 6 2460 1 1 18 VAL HB H 1.891 -0.395 -11.155 1.00 . A A . 18 VAL HB 1 1 6 2461 1 1 18 VAL HG11 H 3.831 -2.641 -11.905 1.00 . A A . 18 VAL HG11 1 1 6 2462 1 1 18 VAL HG12 H 2.334 -2.338 -12.772 1.00 . A A . 18 VAL HG12 1 1 6 2463 1 1 18 VAL HG13 H 3.599 -1.127 -12.763 1.00 . A A . 18 VAL HG13 1 1 6 2464 1 1 18 VAL HG21 H 1.235 -1.910 -9.279 1.00 . A A . 18 VAL HG21 1 1 6 2465 1 1 18 VAL HG22 H 0.832 -2.621 -10.838 1.00 . A A . 18 VAL HG22 1 1 6 2466 1 1 18 VAL HG23 H 2.253 -3.171 -9.957 1.00 . A A . 18 VAL HG23 1 1 6 2467 1 1 18 VAL N N 2.926 -0.131 -8.762 1.00 . A A . 18 VAL N 1 1 6 2468 1 1 18 VAL O O 5.545 -0.319 -11.114 1.00 . A A . 18 VAL O 1 1 6 2469 1 1 19 PHE C C 6.537 2.234 -10.329 1.00 . A A . 19 PHE C 1 1 6 2470 1 1 19 PHE CA C 5.214 2.385 -11.083 1.00 . A A . 19 PHE CA 1 1 6 2471 1 1 19 PHE CB C 4.671 3.824 -10.911 1.00 . A A . 19 PHE CB 1 1 6 2472 1 1 19 PHE CD1 C 6.414 5.088 -12.261 1.00 . A A . 19 PHE CD1 1 1 6 2473 1 1 19 PHE CD2 C 6.298 5.507 -9.917 1.00 . A A . 19 PHE CD2 1 1 6 2474 1 1 19 PHE CE1 C 7.454 5.987 -12.371 1.00 . A A . 19 PHE CE1 1 1 6 2475 1 1 19 PHE CE2 C 7.338 6.406 -10.025 1.00 . A A . 19 PHE CE2 1 1 6 2476 1 1 19 PHE CG C 5.827 4.839 -11.033 1.00 . A A . 19 PHE CG 1 1 6 2477 1 1 19 PHE CZ C 7.917 6.647 -11.253 1.00 . A A . 19 PHE CZ 1 1 6 2478 1 1 19 PHE H H 3.455 1.682 -10.007 1.00 . A A . 19 PHE H 1 1 6 2479 1 1 19 PHE HA H 5.363 2.146 -12.120 1.00 . A A . 19 PHE HA 1 1 6 2480 1 1 19 PHE HB2 H 3.954 4.031 -11.690 1.00 . A A . 19 PHE HB2 1 1 6 2481 1 1 19 PHE HB3 H 4.194 3.938 -9.949 1.00 . A A . 19 PHE HB3 1 1 6 2482 1 1 19 PHE HD1 H 6.058 4.576 -13.142 1.00 . A A . 19 PHE HD1 1 1 6 2483 1 1 19 PHE HD2 H 5.850 5.324 -8.951 1.00 . A A . 19 PHE HD2 1 1 6 2484 1 1 19 PHE HE1 H 7.907 6.175 -13.332 1.00 . A A . 19 PHE HE1 1 1 6 2485 1 1 19 PHE HE2 H 7.699 6.923 -9.148 1.00 . A A . 19 PHE HE2 1 1 6 2486 1 1 19 PHE HZ H 8.732 7.351 -11.338 1.00 . A A . 19 PHE HZ 1 1 6 2487 1 1 19 PHE N N 4.276 1.397 -10.469 1.00 . A A . 19 PHE N 1 1 6 2488 1 1 19 PHE O O 7.593 2.135 -10.919 1.00 . A A . 19 PHE O 1 1 6 2489 1 1 20 PHE C C 8.239 0.690 -8.383 1.00 . A A . 20 PHE C 1 1 6 2490 1 1 20 PHE CA C 7.603 2.059 -8.148 1.00 . A A . 20 PHE CA 1 1 6 2491 1 1 20 PHE CB C 7.163 2.199 -6.680 1.00 . A A . 20 PHE CB 1 1 6 2492 1 1 20 PHE CD1 C 8.849 3.881 -5.814 1.00 . A A . 20 PHE CD1 1 1 6 2493 1 1 20 PHE CD2 C 9.060 1.617 -5.096 1.00 . A A . 20 PHE CD2 1 1 6 2494 1 1 20 PHE CE1 C 9.954 4.222 -5.063 1.00 . A A . 20 PHE CE1 1 1 6 2495 1 1 20 PHE CE2 C 10.167 1.958 -4.346 1.00 . A A . 20 PHE CE2 1 1 6 2496 1 1 20 PHE CG C 8.393 2.575 -5.837 1.00 . A A . 20 PHE CG 1 1 6 2497 1 1 20 PHE CZ C 10.615 3.261 -4.329 1.00 . A A . 20 PHE CZ 1 1 6 2498 1 1 20 PHE H H 5.517 2.244 -8.637 1.00 . A A . 20 PHE H 1 1 6 2499 1 1 20 PHE HA H 8.314 2.828 -8.408 1.00 . A A . 20 PHE HA 1 1 6 2500 1 1 20 PHE HB2 H 6.420 2.978 -6.583 1.00 . A A . 20 PHE HB2 1 1 6 2501 1 1 20 PHE HB3 H 6.745 1.273 -6.313 1.00 . A A . 20 PHE HB3 1 1 6 2502 1 1 20 PHE HD1 H 8.337 4.641 -6.386 1.00 . A A . 20 PHE HD1 1 1 6 2503 1 1 20 PHE HD2 H 8.717 0.592 -5.104 1.00 . A A . 20 PHE HD2 1 1 6 2504 1 1 20 PHE HE1 H 10.304 5.244 -5.052 1.00 . A A . 20 PHE HE1 1 1 6 2505 1 1 20 PHE HE2 H 10.683 1.203 -3.770 1.00 . A A . 20 PHE HE2 1 1 6 2506 1 1 20 PHE HZ H 11.480 3.528 -3.741 1.00 . A A . 20 PHE HZ 1 1 6 2507 1 1 20 PHE N N 6.410 2.197 -9.029 1.00 . A A . 20 PHE N 1 1 6 2508 1 1 20 PHE O O 9.346 0.439 -7.953 1.00 . A A . 20 PHE O 1 1 6 2509 1 1 21 ALA C C 8.010 -1.730 -10.888 1.00 . A A . 21 ALA C 1 1 6 2510 1 1 21 ALA CA C 7.994 -1.515 -9.370 1.00 . A A . 21 ALA CA 1 1 6 2511 1 1 21 ALA CB C 7.059 -2.473 -8.653 1.00 . A A . 21 ALA CB 1 1 6 2512 1 1 21 ALA H H 6.613 0.088 -9.376 1.00 . A A . 21 ALA H 1 1 6 2513 1 1 21 ALA HA H 9.010 -1.585 -9.028 1.00 . A A . 21 ALA HA 1 1 6 2514 1 1 21 ALA HB1 H 6.896 -2.117 -7.645 1.00 . A A . 21 ALA HB1 1 1 6 2515 1 1 21 ALA HB2 H 6.110 -2.501 -9.167 1.00 . A A . 21 ALA HB2 1 1 6 2516 1 1 21 ALA HB3 H 7.489 -3.460 -8.621 1.00 . A A . 21 ALA HB3 1 1 6 2517 1 1 21 ALA N N 7.507 -0.156 -9.062 1.00 . A A . 21 ALA N 1 1 6 2518 1 1 21 ALA O O 7.722 -2.800 -11.391 1.00 . A A . 21 ALA O 1 1 6 2519 1 1 22 GLU C C 9.652 0.201 -13.427 1.00 . A A . 22 GLU C 1 1 6 2520 1 1 22 GLU CA C 8.441 -0.656 -13.043 1.00 . A A . 22 GLU CA 1 1 6 2521 1 1 22 GLU CB C 7.121 -0.069 -13.585 1.00 . A A . 22 GLU CB 1 1 6 2522 1 1 22 GLU CD C 7.665 -0.928 -15.918 1.00 . A A . 22 GLU CD 1 1 6 2523 1 1 22 GLU CG C 7.224 0.289 -15.077 1.00 . A A . 22 GLU CG 1 1 6 2524 1 1 22 GLU H H 8.561 0.164 -11.100 1.00 . A A . 22 GLU H 1 1 6 2525 1 1 22 GLU HA H 8.602 -1.659 -13.384 1.00 . A A . 22 GLU HA 1 1 6 2526 1 1 22 GLU HB2 H 6.328 -0.788 -13.446 1.00 . A A . 22 GLU HB2 1 1 6 2527 1 1 22 GLU HB3 H 6.875 0.825 -13.034 1.00 . A A . 22 GLU HB3 1 1 6 2528 1 1 22 GLU HG2 H 6.258 0.622 -15.423 1.00 . A A . 22 GLU HG2 1 1 6 2529 1 1 22 GLU HG3 H 7.933 1.096 -15.199 1.00 . A A . 22 GLU HG3 1 1 6 2530 1 1 22 GLU N N 8.355 -0.668 -11.565 1.00 . A A . 22 GLU N 1 1 6 2531 1 1 22 GLU O O 10.422 -0.159 -14.297 1.00 . A A . 22 GLU O 1 1 6 2532 1 1 22 GLU OE1 O 7.022 -1.959 -15.789 1.00 . A A . 22 GLU OE1 1 1 6 2533 1 1 22 GLU OE2 O 8.627 -0.759 -16.647 1.00 . A A . 22 GLU OE2 1 1 6 2534 1 1 23 ASP C C 12.087 1.923 -12.103 1.00 . A A . 23 ASP C 1 1 6 2535 1 1 23 ASP CA C 10.890 2.263 -12.998 1.00 . A A . 23 ASP CA 1 1 6 2536 1 1 23 ASP CB C 10.372 3.717 -12.738 1.00 . A A . 23 ASP CB 1 1 6 2537 1 1 23 ASP CG C 10.470 4.140 -11.257 1.00 . A A . 23 ASP CG 1 1 6 2538 1 1 23 ASP H H 9.103 1.517 -12.066 1.00 . A A . 23 ASP H 1 1 6 2539 1 1 23 ASP HA H 11.186 2.167 -14.025 1.00 . A A . 23 ASP HA 1 1 6 2540 1 1 23 ASP HB2 H 10.949 4.410 -13.334 1.00 . A A . 23 ASP HB2 1 1 6 2541 1 1 23 ASP HB3 H 9.341 3.790 -13.054 1.00 . A A . 23 ASP HB3 1 1 6 2542 1 1 23 ASP N N 9.768 1.313 -12.748 1.00 . A A . 23 ASP N 1 1 6 2543 1 1 23 ASP O O 13.225 1.992 -12.527 1.00 . A A . 23 ASP O 1 1 6 2544 1 1 23 ASP OD1 O 11.543 4.588 -10.887 1.00 . A A . 23 ASP OD1 1 1 6 2545 1 1 23 ASP OD2 O 9.471 3.997 -10.573 1.00 . A A . 23 ASP OD2 1 1 6 2546 1 1 24 VAL C C 13.349 -0.206 -10.224 1.00 . A A . 24 VAL C 1 1 6 2547 1 1 24 VAL CA C 12.835 1.202 -9.892 1.00 . A A . 24 VAL CA 1 1 6 2548 1 1 24 VAL CB C 12.249 1.222 -8.469 1.00 . A A . 24 VAL CB 1 1 6 2549 1 1 24 VAL CG1 C 13.385 1.191 -7.426 1.00 . A A . 24 VAL CG1 1 1 6 2550 1 1 24 VAL CG2 C 11.390 2.484 -8.243 1.00 . A A . 24 VAL CG2 1 1 6 2551 1 1 24 VAL H H 10.828 1.544 -10.640 1.00 . A A . 24 VAL H 1 1 6 2552 1 1 24 VAL HA H 13.644 1.905 -9.949 1.00 . A A . 24 VAL HA 1 1 6 2553 1 1 24 VAL HB H 11.654 0.339 -8.354 1.00 . A A . 24 VAL HB 1 1 6 2554 1 1 24 VAL HG11 H 13.980 0.298 -7.549 1.00 . A A . 24 VAL HG11 1 1 6 2555 1 1 24 VAL HG12 H 14.025 2.055 -7.540 1.00 . A A . 24 VAL HG12 1 1 6 2556 1 1 24 VAL HG13 H 12.970 1.195 -6.429 1.00 . A A . 24 VAL HG13 1 1 6 2557 1 1 24 VAL HG21 H 11.946 3.374 -8.493 1.00 . A A . 24 VAL HG21 1 1 6 2558 1 1 24 VAL HG22 H 10.506 2.439 -8.858 1.00 . A A . 24 VAL HG22 1 1 6 2559 1 1 24 VAL HG23 H 11.082 2.541 -7.209 1.00 . A A . 24 VAL HG23 1 1 6 2560 1 1 24 VAL N N 11.775 1.565 -10.885 1.00 . A A . 24 VAL N 1 1 6 2561 1 1 24 VAL O O 14.535 -0.411 -10.404 1.00 . A A . 24 VAL O 1 1 6 2562 1 1 25 GLY C C 11.548 -3.205 -11.276 1.00 . A A . 25 GLY C 1 1 6 2563 1 1 25 GLY CA C 12.755 -2.551 -10.605 1.00 . A A . 25 GLY CA 1 1 6 2564 1 1 25 GLY H H 11.485 -0.881 -10.127 1.00 . A A . 25 GLY H 1 1 6 2565 1 1 25 GLY HA2 H 13.599 -2.591 -11.278 1.00 . A A . 25 GLY HA2 1 1 6 2566 1 1 25 GLY HA3 H 12.987 -3.075 -9.690 1.00 . A A . 25 GLY HA3 1 1 6 2567 1 1 25 GLY N N 12.421 -1.128 -10.290 1.00 . A A . 25 GLY N 1 1 6 2568 1 1 25 GLY O O 10.607 -2.522 -11.631 1.00 . A A . 25 GLY O 1 1 6 2569 1 1 26 SER C C 9.942 -4.604 -13.337 1.00 . A A . 26 SER C 1 1 6 2570 1 1 26 SER CA C 10.503 -5.289 -12.072 1.00 . A A . 26 SER CA 1 1 6 2571 1 1 26 SER CB C 9.392 -5.483 -11.014 1.00 . A A . 26 SER CB 1 1 6 2572 1 1 26 SER H H 12.411 -4.981 -11.118 1.00 . A A . 26 SER H 1 1 6 2573 1 1 26 SER HA H 10.892 -6.255 -12.360 1.00 . A A . 26 SER HA 1 1 6 2574 1 1 26 SER HB2 H 9.123 -4.555 -10.532 1.00 . A A . 26 SER HB2 1 1 6 2575 1 1 26 SER HB3 H 8.515 -5.961 -11.426 1.00 . A A . 26 SER HB3 1 1 6 2576 1 1 26 SER HG H 10.016 -5.882 -9.215 1.00 . A A . 26 SER HG 1 1 6 2577 1 1 26 SER N N 11.613 -4.506 -11.431 1.00 . A A . 26 SER N 1 1 6 2578 1 1 26 SER O O 8.758 -4.650 -13.613 1.00 . A A . 26 SER O 1 1 6 2579 1 1 26 SER OG O 9.989 -6.346 -10.055 1.00 . A A . 26 SER OG 1 1 6 2580 1 1 27 ASN C C 9.749 -4.219 -16.287 1.00 . A A . 27 ASN C 1 1 6 2581 1 1 27 ASN CA C 10.476 -3.269 -15.327 1.00 . A A . 27 ASN CA 1 1 6 2582 1 1 27 ASN CB C 11.771 -2.737 -15.968 1.00 . A A . 27 ASN CB 1 1 6 2583 1 1 27 ASN CG C 11.436 -1.700 -17.046 1.00 . A A . 27 ASN CG 1 1 6 2584 1 1 27 ASN H H 11.774 -3.993 -13.773 1.00 . A A . 27 ASN H 1 1 6 2585 1 1 27 ASN HA H 9.813 -2.459 -15.076 1.00 . A A . 27 ASN HA 1 1 6 2586 1 1 27 ASN HB2 H 12.388 -2.266 -15.215 1.00 . A A . 27 ASN HB2 1 1 6 2587 1 1 27 ASN HB3 H 12.330 -3.542 -16.421 1.00 . A A . 27 ASN HB3 1 1 6 2588 1 1 27 ASN HD21 H 10.743 -3.056 -18.319 1.00 . A A . 27 ASN HD21 1 1 6 2589 1 1 27 ASN HD22 H 10.694 -1.451 -18.870 1.00 . A A . 27 ASN HD22 1 1 6 2590 1 1 27 ASN N N 10.839 -3.986 -14.065 1.00 . A A . 27 ASN N 1 1 6 2591 1 1 27 ASN ND2 N 10.914 -2.103 -18.172 1.00 . A A . 27 ASN ND2 1 1 6 2592 1 1 27 ASN O O 8.835 -3.831 -16.988 1.00 . A A . 27 ASN O 1 1 6 2593 1 1 27 ASN OD1 O 11.642 -0.515 -16.875 1.00 . A A . 27 ASN OD1 1 1 6 2594 1 1 28 LYS C C 8.420 -7.173 -16.411 1.00 . A A . 28 LYS C 1 1 6 2595 1 1 28 LYS CA C 9.611 -6.512 -17.134 1.00 . A A . 28 LYS CA 1 1 6 2596 1 1 28 LYS CB C 10.694 -7.582 -17.454 1.00 . A A . 28 LYS CB 1 1 6 2597 1 1 28 LYS CD C 12.937 -7.226 -16.316 1.00 . A A . 28 LYS CD 1 1 6 2598 1 1 28 LYS CE C 13.534 -7.012 -14.913 1.00 . A A . 28 LYS CE 1 1 6 2599 1 1 28 LYS CG C 11.558 -7.923 -16.205 1.00 . A A . 28 LYS CG 1 1 6 2600 1 1 28 LYS H H 10.944 -5.661 -15.669 1.00 . A A . 28 LYS H 1 1 6 2601 1 1 28 LYS HA H 9.265 -6.066 -18.057 1.00 . A A . 28 LYS HA 1 1 6 2602 1 1 28 LYS HB2 H 10.208 -8.484 -17.800 1.00 . A A . 28 LYS HB2 1 1 6 2603 1 1 28 LYS HB3 H 11.318 -7.219 -18.257 1.00 . A A . 28 LYS HB3 1 1 6 2604 1 1 28 LYS HD2 H 13.606 -7.842 -16.899 1.00 . A A . 28 LYS HD2 1 1 6 2605 1 1 28 LYS HD3 H 12.838 -6.270 -16.810 1.00 . A A . 28 LYS HD3 1 1 6 2606 1 1 28 LYS HE2 H 13.324 -7.855 -14.271 1.00 . A A . 28 LYS HE2 1 1 6 2607 1 1 28 LYS HE3 H 14.605 -6.887 -14.983 1.00 . A A . 28 LYS HE3 1 1 6 2608 1 1 28 LYS HG2 H 11.056 -7.621 -15.296 1.00 . A A . 28 LYS HG2 1 1 6 2609 1 1 28 LYS HG3 H 11.708 -8.993 -16.162 1.00 . A A . 28 LYS HG3 1 1 6 2610 1 1 28 LYS HZ1 H 12.276 -5.353 -14.957 1.00 . A A . 28 LYS HZ1 1 1 6 2611 1 1 28 LYS HZ2 H 12.466 -6.037 -13.415 1.00 . A A . 28 LYS HZ2 1 1 6 2612 1 1 28 LYS HZ3 H 13.715 -5.108 -14.090 1.00 . A A . 28 LYS HZ3 1 1 6 2613 1 1 28 LYS N N 10.202 -5.445 -16.268 1.00 . A A . 28 LYS N 1 1 6 2614 1 1 28 LYS NZ N 12.955 -5.786 -14.297 1.00 . A A . 28 LYS NZ 1 1 6 2615 1 1 28 LYS O O 7.532 -7.611 -17.124 1.00 . A A . 28 LYS O 1 1 6 2616 1 1 28 LYS OXT O 8.461 -7.206 -15.191 1.00 . A A . 28 LYS OXT 1 1 7 2617 1 1 1 ASP C C -23.654 -9.955 -26.752 1.00 . A A . 1 ASP C 1 1 7 2618 1 1 1 ASP CA C -24.125 -10.330 -28.168 1.00 . A A . 1 ASP CA 1 1 7 2619 1 1 1 ASP CB C -24.753 -9.094 -28.867 1.00 . A A . 1 ASP CB 1 1 7 2620 1 1 1 ASP CG C -25.771 -8.387 -27.945 1.00 . A A . 1 ASP CG 1 1 7 2621 1 1 1 ASP H1 H -25.296 -11.696 -27.113 1.00 . A A . 1 ASP H1 1 1 7 2622 1 1 1 ASP H2 H -26.030 -11.095 -28.520 1.00 . A A . 1 ASP H2 1 1 7 2623 1 1 1 ASP H3 H -24.788 -12.249 -28.636 1.00 . A A . 1 ASP H3 1 1 7 2624 1 1 1 ASP HA H -23.274 -10.681 -28.734 1.00 . A A . 1 ASP HA 1 1 7 2625 1 1 1 ASP HB2 H -23.976 -8.398 -29.147 1.00 . A A . 1 ASP HB2 1 1 7 2626 1 1 1 ASP HB3 H -25.265 -9.407 -29.765 1.00 . A A . 1 ASP HB3 1 1 7 2627 1 1 1 ASP N N -25.135 -11.426 -28.104 1.00 . A A . 1 ASP N 1 1 7 2628 1 1 1 ASP O O -24.180 -10.449 -25.773 1.00 . A A . 1 ASP O 1 1 7 2629 1 1 1 ASP OD1 O -26.736 -9.046 -27.591 1.00 . A A . 1 ASP OD1 1 1 7 2630 1 1 1 ASP OD2 O -25.527 -7.230 -27.646 1.00 . A A . 1 ASP OD2 1 1 7 2631 1 1 2 ALA C C -23.063 -7.613 -24.742 1.00 . A A . 2 ALA C 1 1 7 2632 1 1 2 ALA CA C -22.124 -8.639 -25.381 1.00 . A A . 2 ALA CA 1 1 7 2633 1 1 2 ALA CB C -20.738 -8.007 -25.611 1.00 . A A . 2 ALA CB 1 1 7 2634 1 1 2 ALA H H -22.289 -8.715 -27.507 1.00 . A A . 2 ALA H 1 1 7 2635 1 1 2 ALA HA H -22.035 -9.490 -24.721 1.00 . A A . 2 ALA HA 1 1 7 2636 1 1 2 ALA HB1 H -20.149 -8.616 -26.279 1.00 . A A . 2 ALA HB1 1 1 7 2637 1 1 2 ALA HB2 H -20.845 -7.021 -26.041 1.00 . A A . 2 ALA HB2 1 1 7 2638 1 1 2 ALA HB3 H -20.215 -7.912 -24.670 1.00 . A A . 2 ALA HB3 1 1 7 2639 1 1 2 ALA N N -22.675 -9.088 -26.691 1.00 . A A . 2 ALA N 1 1 7 2640 1 1 2 ALA O O -24.194 -7.437 -25.150 1.00 . A A . 2 ALA O 1 1 7 2641 1 1 3 GLU C C -22.660 -4.594 -23.424 1.00 . A A . 3 GLU C 1 1 7 2642 1 1 3 GLU CA C -23.267 -5.928 -22.987 1.00 . A A . 3 GLU CA 1 1 7 2643 1 1 3 GLU CB C -23.063 -6.128 -21.484 1.00 . A A . 3 GLU CB 1 1 7 2644 1 1 3 GLU CD C -23.281 -7.586 -19.500 1.00 . A A . 3 GLU CD 1 1 7 2645 1 1 3 GLU CG C -23.581 -7.489 -21.008 1.00 . A A . 3 GLU CG 1 1 7 2646 1 1 3 GLU H H -21.604 -7.194 -23.501 1.00 . A A . 3 GLU H 1 1 7 2647 1 1 3 GLU HA H -24.317 -5.951 -23.240 1.00 . A A . 3 GLU HA 1 1 7 2648 1 1 3 GLU HB2 H -22.011 -6.053 -21.252 1.00 . A A . 3 GLU HB2 1 1 7 2649 1 1 3 GLU HB3 H -23.599 -5.353 -20.957 1.00 . A A . 3 GLU HB3 1 1 7 2650 1 1 3 GLU HG2 H -24.647 -7.571 -21.170 1.00 . A A . 3 GLU HG2 1 1 7 2651 1 1 3 GLU HG3 H -23.082 -8.298 -21.524 1.00 . A A . 3 GLU HG3 1 1 7 2652 1 1 3 GLU N N -22.524 -6.971 -23.744 1.00 . A A . 3 GLU N 1 1 7 2653 1 1 3 GLU O O -21.598 -4.205 -22.971 1.00 . A A . 3 GLU O 1 1 7 2654 1 1 3 GLU OE1 O -22.171 -7.985 -19.189 1.00 . A A . 3 GLU OE1 1 1 7 2655 1 1 3 GLU OE2 O -24.177 -7.248 -18.742 1.00 . A A . 3 GLU OE2 1 1 7 2656 1 1 4 PHE C C -23.369 -1.501 -23.880 1.00 . A A . 4 PHE C 1 1 7 2657 1 1 4 PHE CA C -22.890 -2.612 -24.824 1.00 . A A . 4 PHE CA 1 1 7 2658 1 1 4 PHE CB C -23.452 -2.457 -26.256 1.00 . A A . 4 PHE CB 1 1 7 2659 1 1 4 PHE CD1 C -23.245 -4.833 -27.149 1.00 . A A . 4 PHE CD1 1 1 7 2660 1 1 4 PHE CD2 C -21.689 -3.202 -27.925 1.00 . A A . 4 PHE CD2 1 1 7 2661 1 1 4 PHE CE1 C -22.630 -5.789 -27.931 1.00 . A A . 4 PHE CE1 1 1 7 2662 1 1 4 PHE CE2 C -21.075 -4.160 -28.707 1.00 . A A . 4 PHE CE2 1 1 7 2663 1 1 4 PHE CG C -22.779 -3.528 -27.138 1.00 . A A . 4 PHE CG 1 1 7 2664 1 1 4 PHE CZ C -21.546 -5.454 -28.710 1.00 . A A . 4 PHE CZ 1 1 7 2665 1 1 4 PHE H H -24.208 -4.302 -24.629 1.00 . A A . 4 PHE H 1 1 7 2666 1 1 4 PHE HA H -21.809 -2.599 -24.848 1.00 . A A . 4 PHE HA 1 1 7 2667 1 1 4 PHE HB2 H -24.523 -2.604 -26.270 1.00 . A A . 4 PHE HB2 1 1 7 2668 1 1 4 PHE HB3 H -23.224 -1.479 -26.653 1.00 . A A . 4 PHE HB3 1 1 7 2669 1 1 4 PHE HD1 H -24.095 -5.108 -26.544 1.00 . A A . 4 PHE HD1 1 1 7 2670 1 1 4 PHE HD2 H -21.313 -2.189 -27.931 1.00 . A A . 4 PHE HD2 1 1 7 2671 1 1 4 PHE HE1 H -22.998 -6.804 -27.933 1.00 . A A . 4 PHE HE1 1 1 7 2672 1 1 4 PHE HE2 H -20.225 -3.893 -29.317 1.00 . A A . 4 PHE HE2 1 1 7 2673 1 1 4 PHE HZ H -21.065 -6.204 -29.321 1.00 . A A . 4 PHE HZ 1 1 7 2674 1 1 4 PHE N N -23.362 -3.931 -24.305 1.00 . A A . 4 PHE N 1 1 7 2675 1 1 4 PHE O O -23.965 -0.522 -24.289 1.00 . A A . 4 PHE O 1 1 7 2676 1 1 5 ARG C C -22.227 -0.485 -20.646 1.00 . A A . 5 ARG C 1 1 7 2677 1 1 5 ARG CA C -23.444 -0.763 -21.544 1.00 . A A . 5 ARG CA 1 1 7 2678 1 1 5 ARG CB C -24.605 -1.384 -20.739 1.00 . A A . 5 ARG CB 1 1 7 2679 1 1 5 ARG CD C -26.436 -0.777 -19.122 1.00 . A A . 5 ARG CD 1 1 7 2680 1 1 5 ARG CG C -25.348 -0.232 -20.071 1.00 . A A . 5 ARG CG 1 1 7 2681 1 1 5 ARG CZ C -28.388 -0.667 -20.616 1.00 . A A . 5 ARG CZ 1 1 7 2682 1 1 5 ARG H H -22.591 -2.526 -22.373 1.00 . A A . 5 ARG H 1 1 7 2683 1 1 5 ARG HA H -23.739 0.163 -22.003 1.00 . A A . 5 ARG HA 1 1 7 2684 1 1 5 ARG HB2 H -25.270 -1.911 -21.409 1.00 . A A . 5 ARG HB2 1 1 7 2685 1 1 5 ARG HB3 H -24.242 -2.077 -19.994 1.00 . A A . 5 ARG HB3 1 1 7 2686 1 1 5 ARG HD2 H -26.024 -1.536 -18.473 1.00 . A A . 5 ARG HD2 1 1 7 2687 1 1 5 ARG HD3 H -26.842 0.019 -18.514 1.00 . A A . 5 ARG HD3 1 1 7 2688 1 1 5 ARG HE H -27.643 -2.368 -19.923 1.00 . A A . 5 ARG HE 1 1 7 2689 1 1 5 ARG HG2 H -24.634 0.358 -19.514 1.00 . A A . 5 ARG HG2 1 1 7 2690 1 1 5 ARG HG3 H -25.772 0.391 -20.844 1.00 . A A . 5 ARG HG3 1 1 7 2691 1 1 5 ARG HH11 H -27.558 1.088 -20.127 1.00 . A A . 5 ARG HH11 1 1 7 2692 1 1 5 ARG HH12 H -28.934 1.179 -21.173 1.00 . A A . 5 ARG HH12 1 1 7 2693 1 1 5 ARG HH21 H -29.390 -2.281 -21.248 1.00 . A A . 5 ARG HH21 1 1 7 2694 1 1 5 ARG HH22 H -29.986 -0.759 -21.815 1.00 . A A . 5 ARG HH22 1 1 7 2695 1 1 5 ARG N N -23.072 -1.715 -22.621 1.00 . A A . 5 ARG N 1 1 7 2696 1 1 5 ARG NE N -27.544 -1.392 -19.922 1.00 . A A . 5 ARG NE 1 1 7 2697 1 1 5 ARG NH1 N -28.287 0.635 -20.641 1.00 . A A . 5 ARG NH1 1 1 7 2698 1 1 5 ARG NH2 N -29.327 -1.284 -21.278 1.00 . A A . 5 ARG NH2 1 1 7 2699 1 1 5 ARG O O -22.279 -0.580 -19.434 1.00 . A A . 5 ARG O 1 1 7 2700 1 1 6 HIS C C -19.425 -0.916 -19.641 1.00 . A A . 6 HIS C 1 1 7 2701 1 1 6 HIS CA C -19.852 0.177 -20.644 1.00 . A A . 6 HIS CA 1 1 7 2702 1 1 6 HIS CB C -19.995 1.549 -19.923 1.00 . A A . 6 HIS CB 1 1 7 2703 1 1 6 HIS CD2 C -22.046 3.004 -20.764 1.00 . A A . 6 HIS CD2 1 1 7 2704 1 1 6 HIS CE1 C -21.149 3.865 -22.423 1.00 . A A . 6 HIS CE1 1 1 7 2705 1 1 6 HIS CG C -20.746 2.530 -20.833 1.00 . A A . 6 HIS CG 1 1 7 2706 1 1 6 HIS H H -21.231 -0.097 -22.288 1.00 . A A . 6 HIS H 1 1 7 2707 1 1 6 HIS HA H -19.094 0.248 -21.409 1.00 . A A . 6 HIS HA 1 1 7 2708 1 1 6 HIS HB2 H -20.549 1.439 -19.003 1.00 . A A . 6 HIS HB2 1 1 7 2709 1 1 6 HIS HB3 H -19.020 1.956 -19.698 1.00 . A A . 6 HIS HB3 1 1 7 2710 1 1 6 HIS HD1 H -19.340 2.980 -22.214 1.00 . A A . 6 HIS HD1 1 1 7 2711 1 1 6 HIS HD2 H -22.764 2.734 -20.004 1.00 . A A . 6 HIS HD2 1 1 7 2712 1 1 6 HIS HE1 H -20.984 4.454 -23.313 1.00 . A A . 6 HIS HE1 1 1 7 2713 1 1 6 HIS N N -21.157 -0.143 -21.314 1.00 . A A . 6 HIS N 1 1 7 2714 1 1 6 HIS ND1 N -20.253 3.103 -21.880 1.00 . A A . 6 HIS ND1 1 1 7 2715 1 1 6 HIS NE2 N -22.279 3.834 -21.761 1.00 . A A . 6 HIS NE2 1 1 7 2716 1 1 6 HIS O O -18.920 -0.628 -18.572 1.00 . A A . 6 HIS O 1 1 7 2717 1 1 7 ASP C C -17.791 -3.615 -19.276 1.00 . A A . 7 ASP C 1 1 7 2718 1 1 7 ASP CA C -19.290 -3.314 -19.171 1.00 . A A . 7 ASP CA 1 1 7 2719 1 1 7 ASP CB C -20.126 -4.529 -19.635 1.00 . A A . 7 ASP CB 1 1 7 2720 1 1 7 ASP CG C -21.624 -4.217 -19.476 1.00 . A A . 7 ASP CG 1 1 7 2721 1 1 7 ASP H H -20.049 -2.326 -20.897 1.00 . A A . 7 ASP H 1 1 7 2722 1 1 7 ASP HA H -19.534 -3.076 -18.150 1.00 . A A . 7 ASP HA 1 1 7 2723 1 1 7 ASP HB2 H -19.924 -4.748 -20.674 1.00 . A A . 7 ASP HB2 1 1 7 2724 1 1 7 ASP HB3 H -19.875 -5.398 -19.043 1.00 . A A . 7 ASP HB3 1 1 7 2725 1 1 7 ASP N N -19.644 -2.147 -20.029 1.00 . A A . 7 ASP N 1 1 7 2726 1 1 7 ASP O O -17.369 -4.504 -19.992 1.00 . A A . 7 ASP O 1 1 7 2727 1 1 7 ASP OD1 O -22.104 -3.436 -20.284 1.00 . A A . 7 ASP OD1 1 1 7 2728 1 1 7 ASP OD2 O -22.209 -4.774 -18.562 1.00 . A A . 7 ASP OD2 1 1 7 2729 1 1 8 SER C C -15.160 -4.381 -17.936 1.00 . A A . 8 SER C 1 1 7 2730 1 1 8 SER CA C -15.544 -3.019 -18.538 1.00 . A A . 8 SER CA 1 1 7 2731 1 1 8 SER CB C -14.920 -1.881 -17.711 1.00 . A A . 8 SER CB 1 1 7 2732 1 1 8 SER H H -17.436 -2.146 -17.990 1.00 . A A . 8 SER H 1 1 7 2733 1 1 8 SER HA H -15.205 -2.977 -19.561 1.00 . A A . 8 SER HA 1 1 7 2734 1 1 8 SER HB2 H -15.218 -0.912 -18.086 1.00 . A A . 8 SER HB2 1 1 7 2735 1 1 8 SER HB3 H -15.165 -1.965 -16.663 1.00 . A A . 8 SER HB3 1 1 7 2736 1 1 8 SER HG H -13.173 -1.239 -18.281 1.00 . A A . 8 SER HG 1 1 7 2737 1 1 8 SER N N -17.028 -2.846 -18.542 1.00 . A A . 8 SER N 1 1 7 2738 1 1 8 SER O O -14.145 -4.953 -18.287 1.00 . A A . 8 SER O 1 1 7 2739 1 1 8 SER OG O -13.518 -2.042 -17.885 1.00 . A A . 8 SER OG 1 1 7 2740 1 1 9 GLY C C -14.684 -6.065 -15.281 1.00 . A A . 9 GLY C 1 1 7 2741 1 1 9 GLY CA C -15.760 -6.161 -16.366 1.00 . A A . 9 GLY CA 1 1 7 2742 1 1 9 GLY H H -16.790 -4.322 -16.820 1.00 . A A . 9 GLY H 1 1 7 2743 1 1 9 GLY HA2 H -16.681 -6.487 -15.907 1.00 . A A . 9 GLY HA2 1 1 7 2744 1 1 9 GLY HA3 H -15.450 -6.894 -17.097 1.00 . A A . 9 GLY HA3 1 1 7 2745 1 1 9 GLY N N -15.996 -4.848 -17.043 1.00 . A A . 9 GLY N 1 1 7 2746 1 1 9 GLY O O -14.539 -6.975 -14.488 1.00 . A A . 9 GLY O 1 1 7 2747 1 1 10 TYR C C -12.411 -3.327 -14.190 1.00 . A A . 10 TYR C 1 1 7 2748 1 1 10 TYR CA C -12.886 -4.781 -14.259 1.00 . A A . 10 TYR CA 1 1 7 2749 1 1 10 TYR CB C -11.685 -5.696 -14.609 1.00 . A A . 10 TYR CB 1 1 7 2750 1 1 10 TYR CD1 C -11.614 -7.421 -12.763 1.00 . A A . 10 TYR CD1 1 1 7 2751 1 1 10 TYR CD2 C -10.058 -5.621 -12.666 1.00 . A A . 10 TYR CD2 1 1 7 2752 1 1 10 TYR CE1 C -11.096 -7.932 -11.592 1.00 . A A . 10 TYR CE1 1 1 7 2753 1 1 10 TYR CE2 C -9.542 -6.132 -11.496 1.00 . A A . 10 TYR CE2 1 1 7 2754 1 1 10 TYR CG C -11.100 -6.262 -13.309 1.00 . A A . 10 TYR CG 1 1 7 2755 1 1 10 TYR CZ C -10.056 -7.291 -10.951 1.00 . A A . 10 TYR CZ 1 1 7 2756 1 1 10 TYR H H -14.119 -4.267 -15.932 1.00 . A A . 10 TYR H 1 1 7 2757 1 1 10 TYR HA H -13.301 -5.041 -13.297 1.00 . A A . 10 TYR HA 1 1 7 2758 1 1 10 TYR HB2 H -11.999 -6.519 -15.235 1.00 . A A . 10 TYR HB2 1 1 7 2759 1 1 10 TYR HB3 H -10.917 -5.143 -15.130 1.00 . A A . 10 TYR HB3 1 1 7 2760 1 1 10 TYR HD1 H -12.428 -7.934 -13.253 1.00 . A A . 10 TYR HD1 1 1 7 2761 1 1 10 TYR HD2 H -9.643 -4.714 -13.080 1.00 . A A . 10 TYR HD2 1 1 7 2762 1 1 10 TYR HE1 H -11.512 -8.839 -11.180 1.00 . A A . 10 TYR HE1 1 1 7 2763 1 1 10 TYR HE2 H -8.729 -5.620 -11.005 1.00 . A A . 10 TYR HE2 1 1 7 2764 1 1 10 TYR HH H -9.592 -7.116 -9.109 1.00 . A A . 10 TYR HH 1 1 7 2765 1 1 10 TYR N N -13.959 -4.971 -15.273 1.00 . A A . 10 TYR N 1 1 7 2766 1 1 10 TYR O O -12.656 -2.529 -15.074 1.00 . A A . 10 TYR O 1 1 7 2767 1 1 10 TYR OH O -9.537 -7.802 -9.779 1.00 . A A . 10 TYR OH 1 1 7 2768 1 1 11 GLU C C -10.303 -1.887 -11.569 1.00 . A A . 11 GLU C 1 1 7 2769 1 1 11 GLU CA C -11.166 -1.713 -12.811 1.00 . A A . 11 GLU CA 1 1 7 2770 1 1 11 GLU CB C -12.294 -0.689 -12.525 1.00 . A A . 11 GLU CB 1 1 7 2771 1 1 11 GLU CD C -12.610 1.498 -11.293 1.00 . A A . 11 GLU CD 1 1 7 2772 1 1 11 GLU CG C -11.661 0.691 -12.196 1.00 . A A . 11 GLU CG 1 1 7 2773 1 1 11 GLU H H -11.593 -3.778 -12.453 1.00 . A A . 11 GLU H 1 1 7 2774 1 1 11 GLU HA H -10.524 -1.401 -13.626 1.00 . A A . 11 GLU HA 1 1 7 2775 1 1 11 GLU HB2 H -12.930 -0.591 -13.392 1.00 . A A . 11 GLU HB2 1 1 7 2776 1 1 11 GLU HB3 H -12.899 -1.035 -11.697 1.00 . A A . 11 GLU HB3 1 1 7 2777 1 1 11 GLU HG2 H -10.716 0.578 -11.683 1.00 . A A . 11 GLU HG2 1 1 7 2778 1 1 11 GLU HG3 H -11.483 1.237 -13.111 1.00 . A A . 11 GLU HG3 1 1 7 2779 1 1 11 GLU N N -11.735 -3.060 -13.104 1.00 . A A . 11 GLU N 1 1 7 2780 1 1 11 GLU O O -10.787 -1.989 -10.459 1.00 . A A . 11 GLU O 1 1 7 2781 1 1 11 GLU OE1 O -12.588 1.221 -10.104 1.00 . A A . 11 GLU OE1 1 1 7 2782 1 1 11 GLU OE2 O -13.303 2.342 -11.837 1.00 . A A . 11 GLU OE2 1 1 7 2783 1 1 12 VAL C C -8.066 -0.834 -9.838 1.00 . A A . 12 VAL C 1 1 7 2784 1 1 12 VAL CA C -8.024 -2.076 -10.746 1.00 . A A . 12 VAL CA 1 1 7 2785 1 1 12 VAL CB C -6.666 -2.254 -11.419 1.00 . A A . 12 VAL CB 1 1 7 2786 1 1 12 VAL CG1 C -5.565 -2.493 -10.363 1.00 . A A . 12 VAL CG1 1 1 7 2787 1 1 12 VAL CG2 C -6.702 -3.468 -12.381 1.00 . A A . 12 VAL CG2 1 1 7 2788 1 1 12 VAL H H -8.719 -1.830 -12.755 1.00 . A A . 12 VAL H 1 1 7 2789 1 1 12 VAL HA H -8.272 -2.945 -10.180 1.00 . A A . 12 VAL HA 1 1 7 2790 1 1 12 VAL HB H -6.505 -1.358 -11.988 1.00 . A A . 12 VAL HB 1 1 7 2791 1 1 12 VAL HG11 H -5.643 -1.774 -9.563 1.00 . A A . 12 VAL HG11 1 1 7 2792 1 1 12 VAL HG12 H -5.658 -3.484 -9.943 1.00 . A A . 12 VAL HG12 1 1 7 2793 1 1 12 VAL HG13 H -4.591 -2.400 -10.820 1.00 . A A . 12 VAL HG13 1 1 7 2794 1 1 12 VAL HG21 H -6.996 -4.362 -11.852 1.00 . A A . 12 VAL HG21 1 1 7 2795 1 1 12 VAL HG22 H -7.404 -3.295 -13.185 1.00 . A A . 12 VAL HG22 1 1 7 2796 1 1 12 VAL HG23 H -5.724 -3.627 -12.814 1.00 . A A . 12 VAL HG23 1 1 7 2797 1 1 12 VAL N N -9.025 -1.915 -11.829 1.00 . A A . 12 VAL N 1 1 7 2798 1 1 12 VAL O O -7.857 -0.926 -8.645 1.00 . A A . 12 VAL O 1 1 7 2799 1 1 13 HIS C C -7.136 2.075 -9.071 1.00 . A A . 13 HIS C 1 1 7 2800 1 1 13 HIS CA C -8.437 1.606 -9.754 1.00 . A A . 13 HIS CA 1 1 7 2801 1 1 13 HIS CB C -9.580 1.516 -8.700 1.00 . A A . 13 HIS CB 1 1 7 2802 1 1 13 HIS CD2 C -11.491 3.195 -7.955 1.00 . A A . 13 HIS CD2 1 1 7 2803 1 1 13 HIS CE1 C -10.640 4.959 -8.631 1.00 . A A . 13 HIS CE1 1 1 7 2804 1 1 13 HIS CG C -10.274 2.875 -8.532 1.00 . A A . 13 HIS CG 1 1 7 2805 1 1 13 HIS H H -8.496 0.252 -11.425 1.00 . A A . 13 HIS H 1 1 7 2806 1 1 13 HIS HA H -8.698 2.344 -10.500 1.00 . A A . 13 HIS HA 1 1 7 2807 1 1 13 HIS HB2 H -10.316 0.792 -9.016 1.00 . A A . 13 HIS HB2 1 1 7 2808 1 1 13 HIS HB3 H -9.191 1.209 -7.740 1.00 . A A . 13 HIS HB3 1 1 7 2809 1 1 13 HIS HD1 H -8.946 4.142 -9.382 1.00 . A A . 13 HIS HD1 1 1 7 2810 1 1 13 HIS HD2 H -12.171 2.481 -7.511 1.00 . A A . 13 HIS HD2 1 1 7 2811 1 1 13 HIS HE1 H -10.478 6.003 -8.857 1.00 . A A . 13 HIS HE1 1 1 7 2812 1 1 13 HIS N N -8.344 0.286 -10.458 1.00 . A A . 13 HIS N 1 1 7 2813 1 1 13 HIS ND1 N -9.806 4.015 -8.927 1.00 . A A . 13 HIS ND1 1 1 7 2814 1 1 13 HIS NE2 N -11.703 4.494 -8.026 1.00 . A A . 13 HIS NE2 1 1 7 2815 1 1 13 HIS O O -7.138 3.092 -8.404 1.00 . A A . 13 HIS O 1 1 7 2816 1 1 14 HIS C C -3.610 0.895 -9.206 1.00 . A A . 14 HIS C 1 1 7 2817 1 1 14 HIS CA C -4.760 1.722 -8.624 1.00 . A A . 14 HIS CA 1 1 7 2818 1 1 14 HIS CB C -4.823 1.499 -7.086 1.00 . A A . 14 HIS CB 1 1 7 2819 1 1 14 HIS CD2 C -6.641 -0.128 -6.048 1.00 . A A . 14 HIS CD2 1 1 7 2820 1 1 14 HIS CE1 C -5.811 -1.933 -6.642 1.00 . A A . 14 HIS CE1 1 1 7 2821 1 1 14 HIS CG C -5.479 0.154 -6.747 1.00 . A A . 14 HIS CG 1 1 7 2822 1 1 14 HIS H H -6.112 0.531 -9.797 1.00 . A A . 14 HIS H 1 1 7 2823 1 1 14 HIS HA H -4.579 2.762 -8.840 1.00 . A A . 14 HIS HA 1 1 7 2824 1 1 14 HIS HB2 H -3.828 1.510 -6.664 1.00 . A A . 14 HIS HB2 1 1 7 2825 1 1 14 HIS HB3 H -5.398 2.289 -6.623 1.00 . A A . 14 HIS HB3 1 1 7 2826 1 1 14 HIS HD1 H -4.201 -1.162 -7.595 1.00 . A A . 14 HIS HD1 1 1 7 2827 1 1 14 HIS HD2 H -7.295 0.612 -5.611 1.00 . A A . 14 HIS HD2 1 1 7 2828 1 1 14 HIS HE1 H -5.648 -2.990 -6.794 1.00 . A A . 14 HIS HE1 1 1 7 2829 1 1 14 HIS N N -6.066 1.339 -9.249 1.00 . A A . 14 HIS N 1 1 7 2830 1 1 14 HIS ND1 N -5.021 -1.006 -7.083 1.00 . A A . 14 HIS ND1 1 1 7 2831 1 1 14 HIS NE2 N -6.832 -1.432 -5.992 1.00 . A A . 14 HIS NE2 1 1 7 2832 1 1 14 HIS O O -3.769 -0.273 -9.501 1.00 . A A . 14 HIS O 1 1 7 2833 1 1 15 GLN C C -0.002 1.639 -9.606 1.00 . A A . 15 GLN C 1 1 7 2834 1 1 15 GLN CA C -1.273 0.841 -9.915 1.00 . A A . 15 GLN CA 1 1 7 2835 1 1 15 GLN CB C -1.458 0.678 -11.453 1.00 . A A . 15 GLN CB 1 1 7 2836 1 1 15 GLN CD C -0.441 2.390 -13.012 1.00 . A A . 15 GLN CD 1 1 7 2837 1 1 15 GLN CG C -1.661 2.057 -12.143 1.00 . A A . 15 GLN CG 1 1 7 2838 1 1 15 GLN H H -2.417 2.477 -9.100 1.00 . A A . 15 GLN H 1 1 7 2839 1 1 15 GLN HA H -1.179 -0.117 -9.432 1.00 . A A . 15 GLN HA 1 1 7 2840 1 1 15 GLN HB2 H -0.598 0.169 -11.865 1.00 . A A . 15 GLN HB2 1 1 7 2841 1 1 15 GLN HB3 H -2.326 0.064 -11.640 1.00 . A A . 15 GLN HB3 1 1 7 2842 1 1 15 GLN HE21 H 0.432 3.483 -11.603 1.00 . A A . 15 GLN HE21 1 1 7 2843 1 1 15 GLN HE22 H 1.289 3.362 -13.064 1.00 . A A . 15 GLN HE22 1 1 7 2844 1 1 15 GLN HG2 H -2.535 2.024 -12.777 1.00 . A A . 15 GLN HG2 1 1 7 2845 1 1 15 GLN HG3 H -1.794 2.849 -11.419 1.00 . A A . 15 GLN HG3 1 1 7 2846 1 1 15 GLN N N -2.478 1.533 -9.356 1.00 . A A . 15 GLN N 1 1 7 2847 1 1 15 GLN NE2 N 0.506 3.141 -12.519 1.00 . A A . 15 GLN NE2 1 1 7 2848 1 1 15 GLN O O 0.982 1.560 -10.312 1.00 . A A . 15 GLN O 1 1 7 2849 1 1 15 GLN OE1 O -0.337 1.971 -14.147 1.00 . A A . 15 GLN OE1 1 1 7 2850 1 1 16 PHE C C 2.279 2.326 -7.707 1.00 . A A . 16 PHE C 1 1 7 2851 1 1 16 PHE CA C 1.109 3.220 -8.119 1.00 . A A . 16 PHE CA 1 1 7 2852 1 1 16 PHE CB C 0.673 4.105 -6.944 1.00 . A A . 16 PHE CB 1 1 7 2853 1 1 16 PHE CD1 C 2.524 5.838 -6.804 1.00 . A A . 16 PHE CD1 1 1 7 2854 1 1 16 PHE CD2 C 2.393 4.199 -5.078 1.00 . A A . 16 PHE CD2 1 1 7 2855 1 1 16 PHE CE1 C 3.624 6.397 -6.189 1.00 . A A . 16 PHE CE1 1 1 7 2856 1 1 16 PHE CE2 C 3.492 4.758 -4.462 1.00 . A A . 16 PHE CE2 1 1 7 2857 1 1 16 PHE CG C 1.899 4.735 -6.254 1.00 . A A . 16 PHE CG 1 1 7 2858 1 1 16 PHE CZ C 4.109 5.858 -5.018 1.00 . A A . 16 PHE CZ 1 1 7 2859 1 1 16 PHE H H -0.889 2.389 -8.016 1.00 . A A . 16 PHE H 1 1 7 2860 1 1 16 PHE HA H 1.415 3.832 -8.951 1.00 . A A . 16 PHE HA 1 1 7 2861 1 1 16 PHE HB2 H 0.031 4.892 -7.310 1.00 . A A . 16 PHE HB2 1 1 7 2862 1 1 16 PHE HB3 H 0.131 3.508 -6.227 1.00 . A A . 16 PHE HB3 1 1 7 2863 1 1 16 PHE HD1 H 2.150 6.267 -7.723 1.00 . A A . 16 PHE HD1 1 1 7 2864 1 1 16 PHE HD2 H 1.915 3.337 -4.634 1.00 . A A . 16 PHE HD2 1 1 7 2865 1 1 16 PHE HE1 H 4.107 7.259 -6.627 1.00 . A A . 16 PHE HE1 1 1 7 2866 1 1 16 PHE HE2 H 3.871 4.333 -3.543 1.00 . A A . 16 PHE HE2 1 1 7 2867 1 1 16 PHE HZ H 4.971 6.295 -4.535 1.00 . A A . 16 PHE HZ 1 1 7 2868 1 1 16 PHE N N -0.062 2.386 -8.539 1.00 . A A . 16 PHE N 1 1 7 2869 1 1 16 PHE O O 3.411 2.542 -8.089 1.00 . A A . 16 PHE O 1 1 7 2870 1 1 17 LEU C C 3.598 -0.309 -7.640 1.00 . A A . 17 LEU C 1 1 7 2871 1 1 17 LEU CA C 2.959 0.362 -6.434 1.00 . A A . 17 LEU CA 1 1 7 2872 1 1 17 LEU CB C 2.260 -0.682 -5.545 1.00 . A A . 17 LEU CB 1 1 7 2873 1 1 17 LEU CD1 C -0.042 -0.001 -4.684 1.00 . A A . 17 LEU CD1 1 1 7 2874 1 1 17 LEU CD2 C 1.751 -0.679 -3.056 1.00 . A A . 17 LEU CD2 1 1 7 2875 1 1 17 LEU CG C 1.479 0.034 -4.395 1.00 . A A . 17 LEU CG 1 1 7 2876 1 1 17 LEU H H 1.012 1.215 -6.690 1.00 . A A . 17 LEU H 1 1 7 2877 1 1 17 LEU HA H 3.713 0.899 -5.883 1.00 . A A . 17 LEU HA 1 1 7 2878 1 1 17 LEU HB2 H 1.586 -1.271 -6.151 1.00 . A A . 17 LEU HB2 1 1 7 2879 1 1 17 LEU HB3 H 3.011 -1.345 -5.139 1.00 . A A . 17 LEU HB3 1 1 7 2880 1 1 17 LEU HD11 H -0.262 0.472 -5.629 1.00 . A A . 17 LEU HD11 1 1 7 2881 1 1 17 LEU HD12 H -0.396 -1.022 -4.718 1.00 . A A . 17 LEU HD12 1 1 7 2882 1 1 17 LEU HD13 H -0.576 0.525 -3.907 1.00 . A A . 17 LEU HD13 1 1 7 2883 1 1 17 LEU HD21 H 1.459 -1.717 -3.112 1.00 . A A . 17 LEU HD21 1 1 7 2884 1 1 17 LEU HD22 H 2.804 -0.625 -2.816 1.00 . A A . 17 LEU HD22 1 1 7 2885 1 1 17 LEU HD23 H 1.194 -0.202 -2.262 1.00 . A A . 17 LEU HD23 1 1 7 2886 1 1 17 LEU HG H 1.796 1.063 -4.306 1.00 . A A . 17 LEU HG 1 1 7 2887 1 1 17 LEU N N 1.946 1.330 -6.934 1.00 . A A . 17 LEU N 1 1 7 2888 1 1 17 LEU O O 4.783 -0.568 -7.673 1.00 . A A . 17 LEU O 1 1 7 2889 1 1 18 VAL C C 4.071 -0.257 -10.688 1.00 . A A . 18 VAL C 1 1 7 2890 1 1 18 VAL CA C 3.213 -1.208 -9.861 1.00 . A A . 18 VAL CA 1 1 7 2891 1 1 18 VAL CB C 1.952 -1.665 -10.619 1.00 . A A . 18 VAL CB 1 1 7 2892 1 1 18 VAL CG1 C 2.297 -2.161 -12.044 1.00 . A A . 18 VAL CG1 1 1 7 2893 1 1 18 VAL CG2 C 1.347 -2.810 -9.792 1.00 . A A . 18 VAL CG2 1 1 7 2894 1 1 18 VAL H H 1.817 -0.302 -8.501 1.00 . A A . 18 VAL H 1 1 7 2895 1 1 18 VAL HA H 3.815 -2.045 -9.572 1.00 . A A . 18 VAL HA 1 1 7 2896 1 1 18 VAL HB H 1.241 -0.856 -10.683 1.00 . A A . 18 VAL HB 1 1 7 2897 1 1 18 VAL HG11 H 3.288 -2.582 -12.066 1.00 . A A . 18 VAL HG11 1 1 7 2898 1 1 18 VAL HG12 H 1.593 -2.911 -12.374 1.00 . A A . 18 VAL HG12 1 1 7 2899 1 1 18 VAL HG13 H 2.263 -1.332 -12.736 1.00 . A A . 18 VAL HG13 1 1 7 2900 1 1 18 VAL HG21 H 2.125 -3.496 -9.486 1.00 . A A . 18 VAL HG21 1 1 7 2901 1 1 18 VAL HG22 H 0.887 -2.400 -8.905 1.00 . A A . 18 VAL HG22 1 1 7 2902 1 1 18 VAL HG23 H 0.607 -3.345 -10.364 1.00 . A A . 18 VAL HG23 1 1 7 2903 1 1 18 VAL N N 2.758 -0.555 -8.608 1.00 . A A . 18 VAL N 1 1 7 2904 1 1 18 VAL O O 5.036 -0.674 -11.300 1.00 . A A . 18 VAL O 1 1 7 2905 1 1 19 PHE C C 5.866 2.025 -10.860 1.00 . A A . 19 PHE C 1 1 7 2906 1 1 19 PHE CA C 4.455 2.016 -11.450 1.00 . A A . 19 PHE CA 1 1 7 2907 1 1 19 PHE CB C 3.745 3.395 -11.291 1.00 . A A . 19 PHE CB 1 1 7 2908 1 1 19 PHE CD1 C 5.554 4.791 -12.410 1.00 . A A . 19 PHE CD1 1 1 7 2909 1 1 19 PHE CD2 C 4.872 5.395 -10.207 1.00 . A A . 19 PHE CD2 1 1 7 2910 1 1 19 PHE CE1 C 6.459 5.833 -12.416 1.00 . A A . 19 PHE CE1 1 1 7 2911 1 1 19 PHE CE2 C 5.776 6.436 -10.212 1.00 . A A . 19 PHE CE2 1 1 7 2912 1 1 19 PHE CG C 4.753 4.562 -11.305 1.00 . A A . 19 PHE CG 1 1 7 2913 1 1 19 PHE CZ C 6.570 6.656 -11.317 1.00 . A A . 19 PHE CZ 1 1 7 2914 1 1 19 PHE H H 2.897 1.251 -10.163 1.00 . A A . 19 PHE H 1 1 7 2915 1 1 19 PHE HA H 4.503 1.717 -12.482 1.00 . A A . 19 PHE HA 1 1 7 2916 1 1 19 PHE HB2 H 3.057 3.536 -12.111 1.00 . A A . 19 PHE HB2 1 1 7 2917 1 1 19 PHE HB3 H 3.184 3.426 -10.371 1.00 . A A . 19 PHE HB3 1 1 7 2918 1 1 19 PHE HD1 H 5.475 4.150 -13.276 1.00 . A A . 19 PHE HD1 1 1 7 2919 1 1 19 PHE HD2 H 4.252 5.230 -9.337 1.00 . A A . 19 PHE HD2 1 1 7 2920 1 1 19 PHE HE1 H 7.081 6.003 -13.283 1.00 . A A . 19 PHE HE1 1 1 7 2921 1 1 19 PHE HE2 H 5.860 7.081 -9.351 1.00 . A A . 19 PHE HE2 1 1 7 2922 1 1 19 PHE HZ H 7.278 7.471 -11.321 1.00 . A A . 19 PHE HZ 1 1 7 2923 1 1 19 PHE N N 3.688 0.994 -10.678 1.00 . A A . 19 PHE N 1 1 7 2924 1 1 19 PHE O O 6.842 1.986 -11.578 1.00 . A A . 19 PHE O 1 1 7 2925 1 1 20 PHE C C 7.956 0.820 -9.220 1.00 . A A . 20 PHE C 1 1 7 2926 1 1 20 PHE CA C 7.205 2.076 -8.818 1.00 . A A . 20 PHE CA 1 1 7 2927 1 1 20 PHE CB C 6.926 2.084 -7.292 1.00 . A A . 20 PHE CB 1 1 7 2928 1 1 20 PHE CD1 C 6.651 4.597 -7.173 1.00 . A A . 20 PHE CD1 1 1 7 2929 1 1 20 PHE CD2 C 8.249 3.587 -5.721 1.00 . A A . 20 PHE CD2 1 1 7 2930 1 1 20 PHE CE1 C 6.967 5.838 -6.662 1.00 . A A . 20 PHE CE1 1 1 7 2931 1 1 20 PHE CE2 C 8.565 4.830 -5.209 1.00 . A A . 20 PHE CE2 1 1 7 2932 1 1 20 PHE CG C 7.287 3.461 -6.710 1.00 . A A . 20 PHE CG 1 1 7 2933 1 1 20 PHE CZ C 7.925 5.955 -5.680 1.00 . A A . 20 PHE CZ 1 1 7 2934 1 1 20 PHE H H 5.071 2.075 -9.060 1.00 . A A . 20 PHE H 1 1 7 2935 1 1 20 PHE HA H 7.773 2.936 -9.119 1.00 . A A . 20 PHE HA 1 1 7 2936 1 1 20 PHE HB2 H 5.881 1.892 -7.095 1.00 . A A . 20 PHE HB2 1 1 7 2937 1 1 20 PHE HB3 H 7.513 1.327 -6.791 1.00 . A A . 20 PHE HB3 1 1 7 2938 1 1 20 PHE HD1 H 5.901 4.509 -7.942 1.00 . A A . 20 PHE HD1 1 1 7 2939 1 1 20 PHE HD2 H 8.758 2.711 -5.345 1.00 . A A . 20 PHE HD2 1 1 7 2940 1 1 20 PHE HE1 H 6.463 6.718 -7.033 1.00 . A A . 20 PHE HE1 1 1 7 2941 1 1 20 PHE HE2 H 9.316 4.919 -4.438 1.00 . A A . 20 PHE HE2 1 1 7 2942 1 1 20 PHE HZ H 8.172 6.927 -5.278 1.00 . A A . 20 PHE HZ 1 1 7 2943 1 1 20 PHE N N 5.910 2.063 -9.554 1.00 . A A . 20 PHE N 1 1 7 2944 1 1 20 PHE O O 9.113 0.850 -9.573 1.00 . A A . 20 PHE O 1 1 7 2945 1 1 21 ALA C C 8.192 -1.730 -11.017 1.00 . A A . 21 ALA C 1 1 7 2946 1 1 21 ALA CA C 7.806 -1.589 -9.530 1.00 . A A . 21 ALA CA 1 1 7 2947 1 1 21 ALA CB C 6.757 -2.602 -9.126 1.00 . A A . 21 ALA CB 1 1 7 2948 1 1 21 ALA H H 6.303 -0.214 -8.906 1.00 . A A . 21 ALA H 1 1 7 2949 1 1 21 ALA HA H 8.702 -1.715 -8.936 1.00 . A A . 21 ALA HA 1 1 7 2950 1 1 21 ALA HB1 H 6.552 -2.506 -8.070 1.00 . A A . 21 ALA HB1 1 1 7 2951 1 1 21 ALA HB2 H 5.850 -2.397 -9.672 1.00 . A A . 21 ALA HB2 1 1 7 2952 1 1 21 ALA HB3 H 7.084 -3.602 -9.343 1.00 . A A . 21 ALA HB3 1 1 7 2953 1 1 21 ALA N N 7.240 -0.266 -9.176 1.00 . A A . 21 ALA N 1 1 7 2954 1 1 21 ALA O O 8.431 -2.828 -11.482 1.00 . A A . 21 ALA O 1 1 7 2955 1 1 22 GLU C C 9.677 0.461 -13.469 1.00 . A A . 22 GLU C 1 1 7 2956 1 1 22 GLU CA C 8.589 -0.587 -13.154 1.00 . A A . 22 GLU CA 1 1 7 2957 1 1 22 GLU CB C 7.311 -0.295 -13.968 1.00 . A A . 22 GLU CB 1 1 7 2958 1 1 22 GLU CD C 7.172 -2.664 -14.859 1.00 . A A . 22 GLU CD 1 1 7 2959 1 1 22 GLU CG C 6.446 -1.575 -14.041 1.00 . A A . 22 GLU CG 1 1 7 2960 1 1 22 GLU H H 7.999 0.219 -11.265 1.00 . A A . 22 GLU H 1 1 7 2961 1 1 22 GLU HA H 8.995 -1.545 -13.413 1.00 . A A . 22 GLU HA 1 1 7 2962 1 1 22 GLU HB2 H 6.746 0.496 -13.499 1.00 . A A . 22 GLU HB2 1 1 7 2963 1 1 22 GLU HB3 H 7.573 0.022 -14.968 1.00 . A A . 22 GLU HB3 1 1 7 2964 1 1 22 GLU HG2 H 6.251 -1.948 -13.047 1.00 . A A . 22 GLU HG2 1 1 7 2965 1 1 22 GLU HG3 H 5.502 -1.351 -14.516 1.00 . A A . 22 GLU HG3 1 1 7 2966 1 1 22 GLU N N 8.227 -0.617 -11.707 1.00 . A A . 22 GLU N 1 1 7 2967 1 1 22 GLU O O 10.062 0.614 -14.612 1.00 . A A . 22 GLU O 1 1 7 2968 1 1 22 GLU OE1 O 7.177 -2.521 -16.071 1.00 . A A . 22 GLU OE1 1 1 7 2969 1 1 22 GLU OE2 O 7.680 -3.578 -14.231 1.00 . A A . 22 GLU OE2 1 1 7 2970 1 1 23 ASP C C 12.260 1.919 -11.539 1.00 . A A . 23 ASP C 1 1 7 2971 1 1 23 ASP CA C 11.205 2.195 -12.613 1.00 . A A . 23 ASP CA 1 1 7 2972 1 1 23 ASP CB C 10.644 3.642 -12.407 1.00 . A A . 23 ASP CB 1 1 7 2973 1 1 23 ASP CG C 9.114 3.672 -12.267 1.00 . A A . 23 ASP CG 1 1 7 2974 1 1 23 ASP H H 9.792 0.987 -11.560 1.00 . A A . 23 ASP H 1 1 7 2975 1 1 23 ASP HA H 11.659 2.084 -13.579 1.00 . A A . 23 ASP HA 1 1 7 2976 1 1 23 ASP HB2 H 11.084 4.097 -11.531 1.00 . A A . 23 ASP HB2 1 1 7 2977 1 1 23 ASP HB3 H 10.916 4.246 -13.261 1.00 . A A . 23 ASP HB3 1 1 7 2978 1 1 23 ASP N N 10.142 1.150 -12.454 1.00 . A A . 23 ASP N 1 1 7 2979 1 1 23 ASP O O 13.447 2.074 -11.752 1.00 . A A . 23 ASP O 1 1 7 2980 1 1 23 ASP OD1 O 8.471 3.417 -13.272 1.00 . A A . 23 ASP OD1 1 1 7 2981 1 1 23 ASP OD2 O 8.681 3.951 -11.160 1.00 . A A . 23 ASP OD2 1 1 7 2982 1 1 24 VAL C C 12.991 -0.284 -9.463 1.00 . A A . 24 VAL C 1 1 7 2983 1 1 24 VAL CA C 12.577 1.173 -9.211 1.00 . A A . 24 VAL CA 1 1 7 2984 1 1 24 VAL CB C 11.716 1.278 -7.935 1.00 . A A . 24 VAL CB 1 1 7 2985 1 1 24 VAL CG1 C 12.608 1.313 -6.682 1.00 . A A . 24 VAL CG1 1 1 7 2986 1 1 24 VAL CG2 C 10.796 2.527 -7.938 1.00 . A A . 24 VAL CG2 1 1 7 2987 1 1 24 VAL H H 10.788 1.412 -10.323 1.00 . A A . 24 VAL H 1 1 7 2988 1 1 24 VAL HA H 13.441 1.805 -9.149 1.00 . A A . 24 VAL HA 1 1 7 2989 1 1 24 VAL HB H 11.106 0.396 -7.893 1.00 . A A . 24 VAL HB 1 1 7 2990 1 1 24 VAL HG11 H 13.200 0.413 -6.623 1.00 . A A . 24 VAL HG11 1 1 7 2991 1 1 24 VAL HG12 H 13.265 2.170 -6.713 1.00 . A A . 24 VAL HG12 1 1 7 2992 1 1 24 VAL HG13 H 11.990 1.381 -5.797 1.00 . A A . 24 VAL HG13 1 1 7 2993 1 1 24 VAL HG21 H 10.491 2.804 -8.935 1.00 . A A . 24 VAL HG21 1 1 7 2994 1 1 24 VAL HG22 H 9.908 2.296 -7.369 1.00 . A A . 24 VAL HG22 1 1 7 2995 1 1 24 VAL HG23 H 11.290 3.371 -7.481 1.00 . A A . 24 VAL HG23 1 1 7 2996 1 1 24 VAL N N 11.754 1.511 -10.406 1.00 . A A . 24 VAL N 1 1 7 2997 1 1 24 VAL O O 14.132 -0.665 -9.293 1.00 . A A . 24 VAL O 1 1 7 2998 1 1 25 GLY C C 11.587 -2.750 -11.587 1.00 . A A . 25 GLY C 1 1 7 2999 1 1 25 GLY CA C 12.146 -2.482 -10.183 1.00 . A A . 25 GLY CA 1 1 7 3000 1 1 25 GLY H H 11.114 -0.606 -9.962 1.00 . A A . 25 GLY H 1 1 7 3001 1 1 25 GLY HA2 H 13.189 -2.764 -10.157 1.00 . A A . 25 GLY HA2 1 1 7 3002 1 1 25 GLY HA3 H 11.591 -3.061 -9.459 1.00 . A A . 25 GLY HA3 1 1 7 3003 1 1 25 GLY N N 11.993 -1.031 -9.869 1.00 . A A . 25 GLY N 1 1 7 3004 1 1 25 GLY O O 11.399 -1.837 -12.368 1.00 . A A . 25 GLY O 1 1 7 3005 1 1 26 SER C C 10.058 -5.766 -12.958 1.00 . A A . 26 SER C 1 1 7 3006 1 1 26 SER CA C 10.795 -4.436 -13.178 1.00 . A A . 26 SER CA 1 1 7 3007 1 1 26 SER CB C 11.970 -4.596 -14.179 1.00 . A A . 26 SER CB 1 1 7 3008 1 1 26 SER H H 11.515 -4.687 -11.181 1.00 . A A . 26 SER H 1 1 7 3009 1 1 26 SER HA H 10.095 -3.694 -13.518 1.00 . A A . 26 SER HA 1 1 7 3010 1 1 26 SER HB2 H 11.656 -5.087 -15.089 1.00 . A A . 26 SER HB2 1 1 7 3011 1 1 26 SER HB3 H 12.417 -3.641 -14.412 1.00 . A A . 26 SER HB3 1 1 7 3012 1 1 26 SER HG H 13.029 -6.218 -14.010 1.00 . A A . 26 SER HG 1 1 7 3013 1 1 26 SER N N 11.340 -4.005 -11.858 1.00 . A A . 26 SER N 1 1 7 3014 1 1 26 SER O O 10.494 -6.823 -13.373 1.00 . A A . 26 SER O 1 1 7 3015 1 1 26 SER OG O 12.922 -5.408 -13.506 1.00 . A A . 26 SER OG 1 1 7 3016 1 1 27 ASN C C 6.581 -6.497 -12.071 1.00 . A A . 27 ASN C 1 1 7 3017 1 1 27 ASN CA C 8.077 -6.820 -11.964 1.00 . A A . 27 ASN CA 1 1 7 3018 1 1 27 ASN CB C 8.414 -7.283 -10.535 1.00 . A A . 27 ASN CB 1 1 7 3019 1 1 27 ASN CG C 8.214 -6.114 -9.556 1.00 . A A . 27 ASN CG 1 1 7 3020 1 1 27 ASN H H 8.679 -4.745 -12.001 1.00 . A A . 27 ASN H 1 1 7 3021 1 1 27 ASN HA H 8.293 -7.620 -12.658 1.00 . A A . 27 ASN HA 1 1 7 3022 1 1 27 ASN HB2 H 7.773 -8.102 -10.240 1.00 . A A . 27 ASN HB2 1 1 7 3023 1 1 27 ASN HB3 H 9.442 -7.610 -10.481 1.00 . A A . 27 ASN HB3 1 1 7 3024 1 1 27 ASN HD21 H 9.860 -5.172 -10.143 1.00 . A A . 27 ASN HD21 1 1 7 3025 1 1 27 ASN HD22 H 8.977 -4.394 -8.921 1.00 . A A . 27 ASN HD22 1 1 7 3026 1 1 27 ASN N N 8.942 -5.641 -12.290 1.00 . A A . 27 ASN N 1 1 7 3027 1 1 27 ASN ND2 N 9.090 -5.146 -9.538 1.00 . A A . 27 ASN ND2 1 1 7 3028 1 1 27 ASN O O 5.755 -7.369 -11.874 1.00 . A A . 27 ASN O 1 1 7 3029 1 1 27 ASN OD1 O 7.260 -6.073 -8.806 1.00 . A A . 27 ASN OD1 1 1 7 3030 1 1 28 LYS C C 4.105 -4.955 -11.169 1.00 . A A . 28 LYS C 1 1 7 3031 1 1 28 LYS CA C 4.863 -4.788 -12.514 1.00 . A A . 28 LYS CA 1 1 7 3032 1 1 28 LYS CB C 4.154 -5.609 -13.662 1.00 . A A . 28 LYS CB 1 1 7 3033 1 1 28 LYS CD C 5.802 -6.521 -15.403 1.00 . A A . 28 LYS CD 1 1 7 3034 1 1 28 LYS CE C 5.094 -7.553 -16.307 1.00 . A A . 28 LYS CE 1 1 7 3035 1 1 28 LYS CG C 4.829 -5.366 -15.036 1.00 . A A . 28 LYS CG 1 1 7 3036 1 1 28 LYS H H 7.007 -4.615 -12.504 1.00 . A A . 28 LYS H 1 1 7 3037 1 1 28 LYS HA H 4.881 -3.741 -12.773 1.00 . A A . 28 LYS HA 1 1 7 3038 1 1 28 LYS HB2 H 4.133 -6.659 -13.420 1.00 . A A . 28 LYS HB2 1 1 7 3039 1 1 28 LYS HB3 H 3.129 -5.274 -13.741 1.00 . A A . 28 LYS HB3 1 1 7 3040 1 1 28 LYS HD2 H 6.650 -6.112 -15.935 1.00 . A A . 28 LYS HD2 1 1 7 3041 1 1 28 LYS HD3 H 6.170 -7.018 -14.520 1.00 . A A . 28 LYS HD3 1 1 7 3042 1 1 28 LYS HE2 H 4.531 -7.062 -17.087 1.00 . A A . 28 LYS HE2 1 1 7 3043 1 1 28 LYS HE3 H 5.827 -8.200 -16.765 1.00 . A A . 28 LYS HE3 1 1 7 3044 1 1 28 LYS HG2 H 4.060 -5.279 -15.789 1.00 . A A . 28 LYS HG2 1 1 7 3045 1 1 28 LYS HG3 H 5.368 -4.433 -15.018 1.00 . A A . 28 LYS HG3 1 1 7 3046 1 1 28 LYS HZ1 H 4.202 -8.114 -14.506 1.00 . A A . 28 LYS HZ1 1 1 7 3047 1 1 28 LYS HZ2 H 3.193 -8.278 -15.859 1.00 . A A . 28 LYS HZ2 1 1 7 3048 1 1 28 LYS HZ3 H 4.440 -9.397 -15.588 1.00 . A A . 28 LYS HZ3 1 1 7 3049 1 1 28 LYS N N 6.281 -5.257 -12.373 1.00 . A A . 28 LYS N 1 1 7 3050 1 1 28 LYS NZ N 4.162 -8.398 -15.504 1.00 . A A . 28 LYS NZ 1 1 7 3051 1 1 28 LYS O O 4.763 -4.752 -10.162 1.00 . A A . 28 LYS O 1 1 7 3052 1 1 28 LYS OXT O 2.925 -5.269 -11.194 1.00 . A A . 28 LYS OXT 1 1 8 3053 1 1 1 ASP C C -19.179 -9.227 -3.697 1.00 . A A . 1 ASP C 1 1 8 3054 1 1 1 ASP CA C -19.109 -10.745 -3.500 1.00 . A A . 1 ASP CA 1 1 8 3055 1 1 1 ASP CB C -20.539 -11.315 -3.468 1.00 . A A . 1 ASP CB 1 1 8 3056 1 1 1 ASP CG C -20.464 -12.843 -3.311 1.00 . A A . 1 ASP CG 1 1 8 3057 1 1 1 ASP H1 H -18.131 -10.160 -1.756 1.00 . A A . 1 ASP H1 1 1 8 3058 1 1 1 ASP H2 H -19.035 -11.586 -1.595 1.00 . A A . 1 ASP H2 1 1 8 3059 1 1 1 ASP H3 H -17.552 -11.609 -2.424 1.00 . A A . 1 ASP H3 1 1 8 3060 1 1 1 ASP HA H -18.549 -11.183 -4.314 1.00 . A A . 1 ASP HA 1 1 8 3061 1 1 1 ASP HB2 H -21.091 -10.897 -2.637 1.00 . A A . 1 ASP HB2 1 1 8 3062 1 1 1 ASP HB3 H -21.059 -11.074 -4.384 1.00 . A A . 1 ASP HB3 1 1 8 3063 1 1 1 ASP N N -18.404 -11.048 -2.222 1.00 . A A . 1 ASP N 1 1 8 3064 1 1 1 ASP O O -19.588 -8.507 -2.807 1.00 . A A . 1 ASP O 1 1 8 3065 1 1 1 ASP OD1 O -20.445 -13.272 -2.168 1.00 . A A . 1 ASP OD1 1 1 8 3066 1 1 1 ASP OD2 O -20.431 -13.495 -4.342 1.00 . A A . 1 ASP OD2 1 1 8 3067 1 1 2 ALA C C -17.954 -6.526 -4.218 1.00 . A A . 2 ALA C 1 1 8 3068 1 1 2 ALA CA C -18.770 -7.345 -5.233 1.00 . A A . 2 ALA CA 1 1 8 3069 1 1 2 ALA CB C -20.238 -6.846 -5.292 1.00 . A A . 2 ALA CB 1 1 8 3070 1 1 2 ALA H H -18.457 -9.451 -5.527 1.00 . A A . 2 ALA H 1 1 8 3071 1 1 2 ALA HA H -18.314 -7.241 -6.206 1.00 . A A . 2 ALA HA 1 1 8 3072 1 1 2 ALA HB1 H -20.835 -7.531 -5.877 1.00 . A A . 2 ALA HB1 1 1 8 3073 1 1 2 ALA HB2 H -20.663 -6.773 -4.302 1.00 . A A . 2 ALA HB2 1 1 8 3074 1 1 2 ALA HB3 H -20.274 -5.872 -5.759 1.00 . A A . 2 ALA HB3 1 1 8 3075 1 1 2 ALA N N -18.772 -8.798 -4.868 1.00 . A A . 2 ALA N 1 1 8 3076 1 1 2 ALA O O -18.488 -5.787 -3.411 1.00 . A A . 2 ALA O 1 1 8 3077 1 1 3 GLU C C -15.381 -4.588 -3.964 1.00 . A A . 3 GLU C 1 1 8 3078 1 1 3 GLU CA C -15.707 -5.981 -3.395 1.00 . A A . 3 GLU CA 1 1 8 3079 1 1 3 GLU CB C -14.439 -6.873 -3.265 1.00 . A A . 3 GLU CB 1 1 8 3080 1 1 3 GLU CD C -16.019 -8.720 -2.460 1.00 . A A . 3 GLU CD 1 1 8 3081 1 1 3 GLU CG C -14.666 -8.013 -2.232 1.00 . A A . 3 GLU CG 1 1 8 3082 1 1 3 GLU H H -16.304 -7.308 -4.982 1.00 . A A . 3 GLU H 1 1 8 3083 1 1 3 GLU HA H -16.169 -5.853 -2.426 1.00 . A A . 3 GLU HA 1 1 8 3084 1 1 3 GLU HB2 H -14.193 -7.301 -4.227 1.00 . A A . 3 GLU HB2 1 1 8 3085 1 1 3 GLU HB3 H -13.599 -6.278 -2.935 1.00 . A A . 3 GLU HB3 1 1 8 3086 1 1 3 GLU HG2 H -13.874 -8.743 -2.317 1.00 . A A . 3 GLU HG2 1 1 8 3087 1 1 3 GLU HG3 H -14.641 -7.603 -1.231 1.00 . A A . 3 GLU HG3 1 1 8 3088 1 1 3 GLU N N -16.659 -6.696 -4.304 1.00 . A A . 3 GLU N 1 1 8 3089 1 1 3 GLU O O -14.244 -4.158 -4.009 1.00 . A A . 3 GLU O 1 1 8 3090 1 1 3 GLU OE1 O -16.076 -9.517 -3.382 1.00 . A A . 3 GLU OE1 1 1 8 3091 1 1 3 GLU OE2 O -16.922 -8.418 -1.697 1.00 . A A . 3 GLU OE2 1 1 8 3092 1 1 4 PHE C C -17.743 -1.939 -5.024 1.00 . A A . 4 PHE C 1 1 8 3093 1 1 4 PHE CA C -16.344 -2.558 -4.971 1.00 . A A . 4 PHE CA 1 1 8 3094 1 1 4 PHE CB C -15.735 -2.662 -6.400 1.00 . A A . 4 PHE CB 1 1 8 3095 1 1 4 PHE CD1 C -17.591 -3.719 -7.781 1.00 . A A . 4 PHE CD1 1 1 8 3096 1 1 4 PHE CD2 C -15.718 -5.074 -7.197 1.00 . A A . 4 PHE CD2 1 1 8 3097 1 1 4 PHE CE1 C -18.154 -4.788 -8.446 1.00 . A A . 4 PHE CE1 1 1 8 3098 1 1 4 PHE CE2 C -16.280 -6.142 -7.861 1.00 . A A . 4 PHE CE2 1 1 8 3099 1 1 4 PHE CG C -16.367 -3.852 -7.150 1.00 . A A . 4 PHE CG 1 1 8 3100 1 1 4 PHE CZ C -17.500 -6.000 -8.487 1.00 . A A . 4 PHE CZ 1 1 8 3101 1 1 4 PHE H H -17.312 -4.350 -4.308 1.00 . A A . 4 PHE H 1 1 8 3102 1 1 4 PHE HA H -15.759 -1.940 -4.314 1.00 . A A . 4 PHE HA 1 1 8 3103 1 1 4 PHE HB2 H -15.912 -1.757 -6.963 1.00 . A A . 4 PHE HB2 1 1 8 3104 1 1 4 PHE HB3 H -14.668 -2.818 -6.330 1.00 . A A . 4 PHE HB3 1 1 8 3105 1 1 4 PHE HD1 H -18.112 -2.773 -7.755 1.00 . A A . 4 PHE HD1 1 1 8 3106 1 1 4 PHE HD2 H -14.761 -5.194 -6.709 1.00 . A A . 4 PHE HD2 1 1 8 3107 1 1 4 PHE HE1 H -19.111 -4.674 -8.935 1.00 . A A . 4 PHE HE1 1 1 8 3108 1 1 4 PHE HE2 H -15.766 -7.090 -7.891 1.00 . A A . 4 PHE HE2 1 1 8 3109 1 1 4 PHE HZ H -17.943 -6.836 -9.008 1.00 . A A . 4 PHE HZ 1 1 8 3110 1 1 4 PHE N N -16.431 -3.931 -4.381 1.00 . A A . 4 PHE N 1 1 8 3111 1 1 4 PHE O O -17.993 -0.986 -5.738 1.00 . A A . 4 PHE O 1 1 8 3112 1 1 5 ARG C C -20.082 -0.865 -3.196 1.00 . A A . 5 ARG C 1 1 8 3113 1 1 5 ARG CA C -20.021 -2.063 -4.152 1.00 . A A . 5 ARG CA 1 1 8 3114 1 1 5 ARG CB C -20.881 -3.247 -3.644 1.00 . A A . 5 ARG CB 1 1 8 3115 1 1 5 ARG CD C -23.267 -4.039 -3.944 1.00 . A A . 5 ARG CD 1 1 8 3116 1 1 5 ARG CG C -22.374 -2.830 -3.608 1.00 . A A . 5 ARG CG 1 1 8 3117 1 1 5 ARG CZ C -25.104 -2.908 -5.124 1.00 . A A . 5 ARG CZ 1 1 8 3118 1 1 5 ARG H H -18.317 -3.280 -3.701 1.00 . A A . 5 ARG H 1 1 8 3119 1 1 5 ARG HA H -20.340 -1.758 -5.134 1.00 . A A . 5 ARG HA 1 1 8 3120 1 1 5 ARG HB2 H -20.742 -4.086 -4.309 1.00 . A A . 5 ARG HB2 1 1 8 3121 1 1 5 ARG HB3 H -20.558 -3.540 -2.656 1.00 . A A . 5 ARG HB3 1 1 8 3122 1 1 5 ARG HD2 H -22.963 -4.508 -4.869 1.00 . A A . 5 ARG HD2 1 1 8 3123 1 1 5 ARG HD3 H -23.219 -4.769 -3.149 1.00 . A A . 5 ARG HD3 1 1 8 3124 1 1 5 ARG HE H -25.315 -3.758 -3.346 1.00 . A A . 5 ARG HE 1 1 8 3125 1 1 5 ARG HG2 H -22.623 -2.467 -2.621 1.00 . A A . 5 ARG HG2 1 1 8 3126 1 1 5 ARG HG3 H -22.555 -2.037 -4.318 1.00 . A A . 5 ARG HG3 1 1 8 3127 1 1 5 ARG HH11 H -23.338 -2.927 -6.072 1.00 . A A . 5 ARG HH11 1 1 8 3128 1 1 5 ARG HH12 H -24.628 -2.131 -6.906 1.00 . A A . 5 ARG HH12 1 1 8 3129 1 1 5 ARG HH21 H -26.958 -2.757 -4.387 1.00 . A A . 5 ARG HH21 1 1 8 3130 1 1 5 ARG HH22 H -26.708 -2.032 -5.939 1.00 . A A . 5 ARG HH22 1 1 8 3131 1 1 5 ARG N N -18.611 -2.522 -4.239 1.00 . A A . 5 ARG N 1 1 8 3132 1 1 5 ARG NE N -24.683 -3.568 -4.071 1.00 . A A . 5 ARG NE 1 1 8 3133 1 1 5 ARG NH1 N -24.293 -2.635 -6.111 1.00 . A A . 5 ARG NH1 1 1 8 3134 1 1 5 ARG NH2 N -26.354 -2.536 -5.152 1.00 . A A . 5 ARG NH2 1 1 8 3135 1 1 5 ARG O O -20.455 -0.986 -2.044 1.00 . A A . 5 ARG O 1 1 8 3136 1 1 6 HIS C C -18.628 1.468 -1.862 1.00 . A A . 6 HIS C 1 1 8 3137 1 1 6 HIS CA C -19.677 1.557 -2.981 1.00 . A A . 6 HIS CA 1 1 8 3138 1 1 6 HIS CB C -21.094 1.845 -2.381 1.00 . A A . 6 HIS CB 1 1 8 3139 1 1 6 HIS CD2 C -22.609 2.286 -4.512 1.00 . A A . 6 HIS CD2 1 1 8 3140 1 1 6 HIS CE1 C -23.719 0.535 -4.457 1.00 . A A . 6 HIS CE1 1 1 8 3141 1 1 6 HIS CG C -22.176 1.548 -3.426 1.00 . A A . 6 HIS CG 1 1 8 3142 1 1 6 HIS H H -19.402 0.255 -4.672 1.00 . A A . 6 HIS H 1 1 8 3143 1 1 6 HIS HA H -19.397 2.348 -3.661 1.00 . A A . 6 HIS HA 1 1 8 3144 1 1 6 HIS HB2 H -21.287 1.241 -1.506 1.00 . A A . 6 HIS HB2 1 1 8 3145 1 1 6 HIS HB3 H -21.166 2.886 -2.101 1.00 . A A . 6 HIS HB3 1 1 8 3146 1 1 6 HIS HD1 H -22.847 -0.258 -2.811 1.00 . A A . 6 HIS HD1 1 1 8 3147 1 1 6 HIS HD2 H -22.217 3.250 -4.802 1.00 . A A . 6 HIS HD2 1 1 8 3148 1 1 6 HIS HE1 H -24.436 -0.235 -4.701 1.00 . A A . 6 HIS HE1 1 1 8 3149 1 1 6 HIS N N -19.695 0.263 -3.737 1.00 . A A . 6 HIS N 1 1 8 3150 1 1 6 HIS ND1 N -22.905 0.481 -3.453 1.00 . A A . 6 HIS ND1 1 1 8 3151 1 1 6 HIS NE2 N -23.570 1.642 -5.145 1.00 . A A . 6 HIS NE2 1 1 8 3152 1 1 6 HIS O O -18.939 1.306 -0.697 1.00 . A A . 6 HIS O 1 1 8 3153 1 1 7 ASP C C -15.972 2.890 -0.698 1.00 . A A . 7 ASP C 1 1 8 3154 1 1 7 ASP CA C -16.227 1.523 -1.358 1.00 . A A . 7 ASP CA 1 1 8 3155 1 1 7 ASP CB C -14.999 1.058 -2.183 1.00 . A A . 7 ASP CB 1 1 8 3156 1 1 7 ASP CG C -14.556 2.169 -3.159 1.00 . A A . 7 ASP CG 1 1 8 3157 1 1 7 ASP H H -17.230 1.708 -3.239 1.00 . A A . 7 ASP H 1 1 8 3158 1 1 7 ASP HA H -16.450 0.807 -0.588 1.00 . A A . 7 ASP HA 1 1 8 3159 1 1 7 ASP HB2 H -14.180 0.813 -1.519 1.00 . A A . 7 ASP HB2 1 1 8 3160 1 1 7 ASP HB3 H -15.251 0.174 -2.751 1.00 . A A . 7 ASP HB3 1 1 8 3161 1 1 7 ASP N N -17.396 1.581 -2.285 1.00 . A A . 7 ASP N 1 1 8 3162 1 1 7 ASP O O -14.852 3.237 -0.376 1.00 . A A . 7 ASP O 1 1 8 3163 1 1 7 ASP OD1 O -15.276 2.377 -4.121 1.00 . A A . 7 ASP OD1 1 1 8 3164 1 1 7 ASP OD2 O -13.520 2.750 -2.883 1.00 . A A . 7 ASP OD2 1 1 8 3165 1 1 8 SER C C -16.209 5.983 -0.750 1.00 . A A . 8 SER C 1 1 8 3166 1 1 8 SER CA C -17.015 4.980 0.100 1.00 . A A . 8 SER CA 1 1 8 3167 1 1 8 SER CB C -16.393 4.894 1.526 1.00 . A A . 8 SER CB 1 1 8 3168 1 1 8 SER H H -17.907 3.253 -0.808 1.00 . A A . 8 SER H 1 1 8 3169 1 1 8 SER HA H -18.032 5.335 0.163 1.00 . A A . 8 SER HA 1 1 8 3170 1 1 8 SER HB2 H -15.328 4.718 1.498 1.00 . A A . 8 SER HB2 1 1 8 3171 1 1 8 SER HB3 H -16.599 5.790 2.092 1.00 . A A . 8 SER HB3 1 1 8 3172 1 1 8 SER HG H -17.672 3.407 1.548 1.00 . A A . 8 SER HG 1 1 8 3173 1 1 8 SER N N -17.046 3.617 -0.522 1.00 . A A . 8 SER N 1 1 8 3174 1 1 8 SER O O -15.951 7.090 -0.318 1.00 . A A . 8 SER O 1 1 8 3175 1 1 8 SER OG O -17.037 3.793 2.156 1.00 . A A . 8 SER OG 1 1 8 3176 1 1 9 GLY C C -14.882 5.748 -4.201 1.00 . A A . 9 GLY C 1 1 8 3177 1 1 9 GLY CA C -15.055 6.442 -2.852 1.00 . A A . 9 GLY CA 1 1 8 3178 1 1 9 GLY H H -16.075 4.660 -2.231 1.00 . A A . 9 GLY H 1 1 8 3179 1 1 9 GLY HA2 H -15.585 7.372 -3.001 1.00 . A A . 9 GLY HA2 1 1 8 3180 1 1 9 GLY HA3 H -14.085 6.638 -2.420 1.00 . A A . 9 GLY HA3 1 1 8 3181 1 1 9 GLY N N -15.839 5.563 -1.936 1.00 . A A . 9 GLY N 1 1 8 3182 1 1 9 GLY O O -15.789 5.729 -5.010 1.00 . A A . 9 GLY O 1 1 8 3183 1 1 10 TYR C C -12.183 3.574 -5.494 1.00 . A A . 10 TYR C 1 1 8 3184 1 1 10 TYR CA C -13.398 4.483 -5.665 1.00 . A A . 10 TYR CA 1 1 8 3185 1 1 10 TYR CB C -13.110 5.513 -6.781 1.00 . A A . 10 TYR CB 1 1 8 3186 1 1 10 TYR CD1 C -15.092 5.434 -8.351 1.00 . A A . 10 TYR CD1 1 1 8 3187 1 1 10 TYR CD2 C -13.133 4.226 -8.963 1.00 . A A . 10 TYR CD2 1 1 8 3188 1 1 10 TYR CE1 C -15.714 5.012 -9.506 1.00 . A A . 10 TYR CE1 1 1 8 3189 1 1 10 TYR CE2 C -13.757 3.804 -10.117 1.00 . A A . 10 TYR CE2 1 1 8 3190 1 1 10 TYR CG C -13.797 5.045 -8.071 1.00 . A A . 10 TYR CG 1 1 8 3191 1 1 10 TYR CZ C -15.050 4.193 -10.397 1.00 . A A . 10 TYR CZ 1 1 8 3192 1 1 10 TYR H H -13.032 5.243 -3.695 1.00 . A A . 10 TYR H 1 1 8 3193 1 1 10 TYR HA H -14.246 3.867 -5.916 1.00 . A A . 10 TYR HA 1 1 8 3194 1 1 10 TYR HB2 H -13.495 6.485 -6.514 1.00 . A A . 10 TYR HB2 1 1 8 3195 1 1 10 TYR HB3 H -12.048 5.597 -6.963 1.00 . A A . 10 TYR HB3 1 1 8 3196 1 1 10 TYR HD1 H -15.625 6.076 -7.664 1.00 . A A . 10 TYR HD1 1 1 8 3197 1 1 10 TYR HD2 H -12.121 3.912 -8.758 1.00 . A A . 10 TYR HD2 1 1 8 3198 1 1 10 TYR HE1 H -16.727 5.326 -9.711 1.00 . A A . 10 TYR HE1 1 1 8 3199 1 1 10 TYR HE2 H -13.226 3.163 -10.806 1.00 . A A . 10 TYR HE2 1 1 8 3200 1 1 10 TYR HH H -16.054 2.906 -11.381 1.00 . A A . 10 TYR HH 1 1 8 3201 1 1 10 TYR N N -13.712 5.195 -4.394 1.00 . A A . 10 TYR N 1 1 8 3202 1 1 10 TYR O O -11.400 3.725 -4.575 1.00 . A A . 10 TYR O 1 1 8 3203 1 1 10 TYR OH O -15.672 3.769 -11.554 1.00 . A A . 10 TYR OH 1 1 8 3204 1 1 11 GLU C C -10.904 1.033 -7.786 1.00 . A A . 11 GLU C 1 1 8 3205 1 1 11 GLU CA C -10.957 1.673 -6.407 1.00 . A A . 11 GLU CA 1 1 8 3206 1 1 11 GLU CB C -11.210 0.605 -5.313 1.00 . A A . 11 GLU CB 1 1 8 3207 1 1 11 GLU CD C -8.723 0.066 -5.369 1.00 . A A . 11 GLU CD 1 1 8 3208 1 1 11 GLU CG C -10.148 -0.522 -5.397 1.00 . A A . 11 GLU CG 1 1 8 3209 1 1 11 GLU H H -12.749 2.603 -7.124 1.00 . A A . 11 GLU H 1 1 8 3210 1 1 11 GLU HA H -10.026 2.194 -6.239 1.00 . A A . 11 GLU HA 1 1 8 3211 1 1 11 GLU HB2 H -11.163 1.068 -4.338 1.00 . A A . 11 GLU HB2 1 1 8 3212 1 1 11 GLU HB3 H -12.196 0.180 -5.439 1.00 . A A . 11 GLU HB3 1 1 8 3213 1 1 11 GLU HG2 H -10.265 -1.192 -4.560 1.00 . A A . 11 GLU HG2 1 1 8 3214 1 1 11 GLU HG3 H -10.284 -1.087 -6.310 1.00 . A A . 11 GLU HG3 1 1 8 3215 1 1 11 GLU N N -12.077 2.651 -6.412 1.00 . A A . 11 GLU N 1 1 8 3216 1 1 11 GLU O O -11.738 0.224 -8.148 1.00 . A A . 11 GLU O 1 1 8 3217 1 1 11 GLU OE1 O -8.328 0.494 -4.297 1.00 . A A . 11 GLU OE1 1 1 8 3218 1 1 11 GLU OE2 O -8.110 0.055 -6.423 1.00 . A A . 11 GLU OE2 1 1 8 3219 1 1 12 VAL C C -8.845 -0.351 -9.787 1.00 . A A . 12 VAL C 1 1 8 3220 1 1 12 VAL CA C -9.677 0.932 -9.882 1.00 . A A . 12 VAL CA 1 1 8 3221 1 1 12 VAL CB C -8.948 2.026 -10.667 1.00 . A A . 12 VAL CB 1 1 8 3222 1 1 12 VAL CG1 C -8.554 1.537 -12.083 1.00 . A A . 12 VAL CG1 1 1 8 3223 1 1 12 VAL CG2 C -9.846 3.276 -10.793 1.00 . A A . 12 VAL CG2 1 1 8 3224 1 1 12 VAL H H -9.274 2.097 -8.143 1.00 . A A . 12 VAL H 1 1 8 3225 1 1 12 VAL HA H -10.627 0.731 -10.321 1.00 . A A . 12 VAL HA 1 1 8 3226 1 1 12 VAL HB H -8.085 2.279 -10.082 1.00 . A A . 12 VAL HB 1 1 8 3227 1 1 12 VAL HG11 H -8.004 0.610 -12.033 1.00 . A A . 12 VAL HG11 1 1 8 3228 1 1 12 VAL HG12 H -9.438 1.378 -12.684 1.00 . A A . 12 VAL HG12 1 1 8 3229 1 1 12 VAL HG13 H -7.934 2.276 -12.568 1.00 . A A . 12 VAL HG13 1 1 8 3230 1 1 12 VAL HG21 H -10.799 3.015 -11.229 1.00 . A A . 12 VAL HG21 1 1 8 3231 1 1 12 VAL HG22 H -10.014 3.712 -9.819 1.00 . A A . 12 VAL HG22 1 1 8 3232 1 1 12 VAL HG23 H -9.367 4.014 -11.420 1.00 . A A . 12 VAL HG23 1 1 8 3233 1 1 12 VAL N N -9.899 1.441 -8.509 1.00 . A A . 12 VAL N 1 1 8 3234 1 1 12 VAL O O -9.236 -1.404 -10.250 1.00 . A A . 12 VAL O 1 1 8 3235 1 1 13 HIS C C -5.575 -0.744 -8.068 1.00 . A A . 13 HIS C 1 1 8 3236 1 1 13 HIS CA C -6.719 -1.271 -8.947 1.00 . A A . 13 HIS CA 1 1 8 3237 1 1 13 HIS CB C -6.145 -1.756 -10.308 1.00 . A A . 13 HIS CB 1 1 8 3238 1 1 13 HIS CD2 C -5.007 -0.612 -12.409 1.00 . A A . 13 HIS CD2 1 1 8 3239 1 1 13 HIS CE1 C -5.167 1.372 -11.829 1.00 . A A . 13 HIS CE1 1 1 8 3240 1 1 13 HIS CG C -5.630 -0.589 -11.172 1.00 . A A . 13 HIS CG 1 1 8 3241 1 1 13 HIS H H -7.505 0.720 -8.836 1.00 . A A . 13 HIS H 1 1 8 3242 1 1 13 HIS HA H -7.213 -2.079 -8.430 1.00 . A A . 13 HIS HA 1 1 8 3243 1 1 13 HIS HB2 H -5.326 -2.438 -10.135 1.00 . A A . 13 HIS HB2 1 1 8 3244 1 1 13 HIS HB3 H -6.910 -2.278 -10.863 1.00 . A A . 13 HIS HB3 1 1 8 3245 1 1 13 HIS HD1 H -6.085 1.039 -10.061 1.00 . A A . 13 HIS HD1 1 1 8 3246 1 1 13 HIS HD2 H -4.783 -1.506 -12.970 1.00 . A A . 13 HIS HD2 1 1 8 3247 1 1 13 HIS HE1 H -5.099 2.450 -11.820 1.00 . A A . 13 HIS HE1 1 1 8 3248 1 1 13 HIS N N -7.710 -0.175 -9.169 1.00 . A A . 13 HIS N 1 1 8 3249 1 1 13 HIS ND1 N -5.694 0.670 -10.879 1.00 . A A . 13 HIS ND1 1 1 8 3250 1 1 13 HIS NE2 N -4.727 0.615 -12.802 1.00 . A A . 13 HIS NE2 1 1 8 3251 1 1 13 HIS O O -4.883 -1.511 -7.427 1.00 . A A . 13 HIS O 1 1 8 3252 1 1 14 HIS C C -3.009 0.601 -7.464 1.00 . A A . 14 HIS C 1 1 8 3253 1 1 14 HIS CA C -4.372 1.272 -7.292 1.00 . A A . 14 HIS CA 1 1 8 3254 1 1 14 HIS CB C -4.820 1.293 -5.805 1.00 . A A . 14 HIS CB 1 1 8 3255 1 1 14 HIS CD2 C -6.471 2.941 -4.544 1.00 . A A . 14 HIS CD2 1 1 8 3256 1 1 14 HIS CE1 C -7.725 3.399 -6.132 1.00 . A A . 14 HIS CE1 1 1 8 3257 1 1 14 HIS CG C -6.013 2.248 -5.652 1.00 . A A . 14 HIS CG 1 1 8 3258 1 1 14 HIS H H -6.037 1.097 -8.623 1.00 . A A . 14 HIS H 1 1 8 3259 1 1 14 HIS HA H -4.281 2.270 -7.691 1.00 . A A . 14 HIS HA 1 1 8 3260 1 1 14 HIS HB2 H -5.121 0.307 -5.481 1.00 . A A . 14 HIS HB2 1 1 8 3261 1 1 14 HIS HB3 H -4.017 1.642 -5.173 1.00 . A A . 14 HIS HB3 1 1 8 3262 1 1 14 HIS HD1 H -6.793 2.258 -7.518 1.00 . A A . 14 HIS HD1 1 1 8 3263 1 1 14 HIS HD2 H -6.022 2.904 -3.563 1.00 . A A . 14 HIS HD2 1 1 8 3264 1 1 14 HIS HE1 H -8.523 3.824 -6.722 1.00 . A A . 14 HIS HE1 1 1 8 3265 1 1 14 HIS N N -5.427 0.560 -8.078 1.00 . A A . 14 HIS N 1 1 8 3266 1 1 14 HIS ND1 N -6.836 2.580 -6.594 1.00 . A A . 14 HIS ND1 1 1 8 3267 1 1 14 HIS NE2 N -7.536 3.651 -4.861 1.00 . A A . 14 HIS NE2 1 1 8 3268 1 1 14 HIS O O -2.358 0.175 -6.529 1.00 . A A . 14 HIS O 1 1 8 3269 1 1 15 GLN C C -0.159 0.900 -8.950 1.00 . A A . 15 GLN C 1 1 8 3270 1 1 15 GLN CA C -1.339 -0.067 -9.119 1.00 . A A . 15 GLN CA 1 1 8 3271 1 1 15 GLN CB C -1.515 -0.526 -10.584 1.00 . A A . 15 GLN CB 1 1 8 3272 1 1 15 GLN CD C -0.284 1.026 -12.174 1.00 . A A . 15 GLN CD 1 1 8 3273 1 1 15 GLN CG C -1.651 0.674 -11.565 1.00 . A A . 15 GLN CG 1 1 8 3274 1 1 15 GLN H H -3.223 0.919 -9.404 1.00 . A A . 15 GLN H 1 1 8 3275 1 1 15 GLN HA H -1.148 -0.918 -8.488 1.00 . A A . 15 GLN HA 1 1 8 3276 1 1 15 GLN HB2 H -0.692 -1.162 -10.861 1.00 . A A . 15 GLN HB2 1 1 8 3277 1 1 15 GLN HB3 H -2.425 -1.106 -10.635 1.00 . A A . 15 GLN HB3 1 1 8 3278 1 1 15 GLN HE21 H -0.283 2.869 -11.435 1.00 . A A . 15 GLN HE21 1 1 8 3279 1 1 15 GLN HE22 H 1.085 2.451 -12.351 1.00 . A A . 15 GLN HE22 1 1 8 3280 1 1 15 GLN HG2 H -2.315 0.405 -12.372 1.00 . A A . 15 GLN HG2 1 1 8 3281 1 1 15 GLN HG3 H -2.054 1.544 -11.066 1.00 . A A . 15 GLN HG3 1 1 8 3282 1 1 15 GLN N N -2.635 0.547 -8.714 1.00 . A A . 15 GLN N 1 1 8 3283 1 1 15 GLN NE2 N 0.213 2.215 -11.970 1.00 . A A . 15 GLN NE2 1 1 8 3284 1 1 15 GLN O O 0.841 0.805 -9.625 1.00 . A A . 15 GLN O 1 1 8 3285 1 1 15 GLN OE1 O 0.343 0.225 -12.838 1.00 . A A . 15 GLN OE1 1 1 8 3286 1 1 16 PHE C C 2.114 2.109 -7.455 1.00 . A A . 16 PHE C 1 1 8 3287 1 1 16 PHE CA C 0.789 2.817 -7.778 1.00 . A A . 16 PHE CA 1 1 8 3288 1 1 16 PHE CB C 0.323 3.701 -6.614 1.00 . A A . 16 PHE CB 1 1 8 3289 1 1 16 PHE CD1 C 2.116 5.480 -6.343 1.00 . A A . 16 PHE CD1 1 1 8 3290 1 1 16 PHE CD2 C 1.953 3.783 -4.675 1.00 . A A . 16 PHE CD2 1 1 8 3291 1 1 16 PHE CE1 C 3.170 6.049 -5.659 1.00 . A A . 16 PHE CE1 1 1 8 3292 1 1 16 PHE CE2 C 3.005 4.352 -3.991 1.00 . A A . 16 PHE CE2 1 1 8 3293 1 1 16 PHE CG C 1.500 4.342 -5.857 1.00 . A A . 16 PHE CG 1 1 8 3294 1 1 16 PHE CZ C 3.614 5.484 -4.483 1.00 . A A . 16 PHE CZ 1 1 8 3295 1 1 16 PHE H H -1.125 1.834 -7.514 1.00 . A A . 16 PHE H 1 1 8 3296 1 1 16 PHE HA H 0.920 3.414 -8.664 1.00 . A A . 16 PHE HA 1 1 8 3297 1 1 16 PHE HB2 H -0.306 4.482 -7.012 1.00 . A A . 16 PHE HB2 1 1 8 3298 1 1 16 PHE HB3 H -0.251 3.098 -5.927 1.00 . A A . 16 PHE HB3 1 1 8 3299 1 1 16 PHE HD1 H 1.773 5.927 -7.265 1.00 . A A . 16 PHE HD1 1 1 8 3300 1 1 16 PHE HD2 H 1.480 2.894 -4.283 1.00 . A A . 16 PHE HD2 1 1 8 3301 1 1 16 PHE HE1 H 3.647 6.938 -6.046 1.00 . A A . 16 PHE HE1 1 1 8 3302 1 1 16 PHE HE2 H 3.354 3.908 -3.070 1.00 . A A . 16 PHE HE2 1 1 8 3303 1 1 16 PHE HZ H 4.439 5.930 -3.945 1.00 . A A . 16 PHE HZ 1 1 8 3304 1 1 16 PHE N N -0.298 1.815 -8.034 1.00 . A A . 16 PHE N 1 1 8 3305 1 1 16 PHE O O 3.181 2.526 -7.861 1.00 . A A . 16 PHE O 1 1 8 3306 1 1 17 LEU C C 3.845 -0.252 -7.604 1.00 . A A . 17 LEU C 1 1 8 3307 1 1 17 LEU CA C 3.174 0.232 -6.329 1.00 . A A . 17 LEU CA 1 1 8 3308 1 1 17 LEU CB C 2.712 -0.960 -5.481 1.00 . A A . 17 LEU CB 1 1 8 3309 1 1 17 LEU CD1 C 0.404 -0.758 -4.427 1.00 . A A . 17 LEU CD1 1 1 8 3310 1 1 17 LEU CD2 C 2.419 -1.130 -2.963 1.00 . A A . 17 LEU CD2 1 1 8 3311 1 1 17 LEU CG C 1.907 -0.444 -4.246 1.00 . A A . 17 LEU CG 1 1 8 3312 1 1 17 LEU H H 1.099 0.742 -6.458 1.00 . A A . 17 LEU H 1 1 8 3313 1 1 17 LEU HA H 3.854 0.863 -5.783 1.00 . A A . 17 LEU HA 1 1 8 3314 1 1 17 LEU HB2 H 2.097 -1.608 -6.091 1.00 . A A . 17 LEU HB2 1 1 8 3315 1 1 17 LEU HB3 H 3.582 -1.517 -5.168 1.00 . A A . 17 LEU HB3 1 1 8 3316 1 1 17 LEU HD11 H 0.033 -0.312 -5.338 1.00 . A A . 17 LEU HD11 1 1 8 3317 1 1 17 LEU HD12 H 0.244 -1.825 -4.475 1.00 . A A . 17 LEU HD12 1 1 8 3318 1 1 17 LEU HD13 H -0.160 -0.359 -3.597 1.00 . A A . 17 LEU HD13 1 1 8 3319 1 1 17 LEU HD21 H 2.325 -2.204 -3.045 1.00 . A A . 17 LEU HD21 1 1 8 3320 1 1 17 LEU HD22 H 3.459 -0.884 -2.801 1.00 . A A . 17 LEU HD22 1 1 8 3321 1 1 17 LEU HD23 H 1.849 -0.795 -2.109 1.00 . A A . 17 LEU HD23 1 1 8 3322 1 1 17 LEU HG H 2.031 0.625 -4.140 1.00 . A A . 17 LEU HG 1 1 8 3323 1 1 17 LEU N N 1.988 1.032 -6.731 1.00 . A A . 17 LEU N 1 1 8 3324 1 1 17 LEU O O 5.051 -0.243 -7.738 1.00 . A A . 17 LEU O 1 1 8 3325 1 1 18 VAL C C 4.128 -0.026 -10.629 1.00 . A A . 18 VAL C 1 1 8 3326 1 1 18 VAL CA C 3.499 -1.159 -9.823 1.00 . A A . 18 VAL CA 1 1 8 3327 1 1 18 VAL CB C 2.310 -1.794 -10.579 1.00 . A A . 18 VAL CB 1 1 8 3328 1 1 18 VAL CG1 C 2.775 -2.410 -11.911 1.00 . A A . 18 VAL CG1 1 1 8 3329 1 1 18 VAL CG2 C 1.745 -2.909 -9.686 1.00 . A A . 18 VAL CG2 1 1 8 3330 1 1 18 VAL H H 2.044 -0.618 -8.332 1.00 . A A . 18 VAL H 1 1 8 3331 1 1 18 VAL HA H 4.246 -1.895 -9.606 1.00 . A A . 18 VAL HA 1 1 8 3332 1 1 18 VAL HB H 1.547 -1.060 -10.782 1.00 . A A . 18 VAL HB 1 1 8 3333 1 1 18 VAL HG11 H 3.536 -3.155 -11.733 1.00 . A A . 18 VAL HG11 1 1 8 3334 1 1 18 VAL HG12 H 1.938 -2.879 -12.409 1.00 . A A . 18 VAL HG12 1 1 8 3335 1 1 18 VAL HG13 H 3.172 -1.644 -12.559 1.00 . A A . 18 VAL HG13 1 1 8 3336 1 1 18 VAL HG21 H 2.548 -3.560 -9.368 1.00 . A A . 18 VAL HG21 1 1 8 3337 1 1 18 VAL HG22 H 1.284 -2.477 -8.811 1.00 . A A . 18 VAL HG22 1 1 8 3338 1 1 18 VAL HG23 H 1.012 -3.486 -10.225 1.00 . A A . 18 VAL HG23 1 1 8 3339 1 1 18 VAL N N 3.005 -0.655 -8.517 1.00 . A A . 18 VAL N 1 1 8 3340 1 1 18 VAL O O 5.172 -0.208 -11.221 1.00 . A A . 18 VAL O 1 1 8 3341 1 1 19 PHE C C 5.479 2.497 -11.028 1.00 . A A . 19 PHE C 1 1 8 3342 1 1 19 PHE CA C 3.995 2.302 -11.373 1.00 . A A . 19 PHE CA 1 1 8 3343 1 1 19 PHE CB C 3.131 3.549 -10.970 1.00 . A A . 19 PHE CB 1 1 8 3344 1 1 19 PHE CD1 C 4.614 5.480 -11.698 1.00 . A A . 19 PHE CD1 1 1 8 3345 1 1 19 PHE CD2 C 4.149 5.253 -9.371 1.00 . A A . 19 PHE CD2 1 1 8 3346 1 1 19 PHE CE1 C 5.386 6.593 -11.434 1.00 . A A . 19 PHE CE1 1 1 8 3347 1 1 19 PHE CE2 C 4.919 6.366 -9.108 1.00 . A A . 19 PHE CE2 1 1 8 3348 1 1 19 PHE CG C 3.988 4.799 -10.669 1.00 . A A . 19 PHE CG 1 1 8 3349 1 1 19 PHE CZ C 5.539 7.036 -10.139 1.00 . A A . 19 PHE CZ 1 1 8 3350 1 1 19 PHE H H 2.643 1.160 -10.108 1.00 . A A . 19 PHE H 1 1 8 3351 1 1 19 PHE HA H 3.913 2.103 -12.428 1.00 . A A . 19 PHE HA 1 1 8 3352 1 1 19 PHE HB2 H 2.462 3.791 -11.784 1.00 . A A . 19 PHE HB2 1 1 8 3353 1 1 19 PHE HB3 H 2.530 3.322 -10.105 1.00 . A A . 19 PHE HB3 1 1 8 3354 1 1 19 PHE HD1 H 4.500 5.140 -12.717 1.00 . A A . 19 PHE HD1 1 1 8 3355 1 1 19 PHE HD2 H 3.669 4.739 -8.554 1.00 . A A . 19 PHE HD2 1 1 8 3356 1 1 19 PHE HE1 H 5.870 7.118 -12.244 1.00 . A A . 19 PHE HE1 1 1 8 3357 1 1 19 PHE HE2 H 5.037 6.712 -8.092 1.00 . A A . 19 PHE HE2 1 1 8 3358 1 1 19 PHE HZ H 6.144 7.907 -9.932 1.00 . A A . 19 PHE HZ 1 1 8 3359 1 1 19 PHE N N 3.478 1.111 -10.620 1.00 . A A . 19 PHE N 1 1 8 3360 1 1 19 PHE O O 6.292 2.792 -11.882 1.00 . A A . 19 PHE O 1 1 8 3361 1 1 20 PHE C C 7.947 1.229 -9.666 1.00 . A A . 20 PHE C 1 1 8 3362 1 1 20 PHE CA C 7.143 2.457 -9.259 1.00 . A A . 20 PHE CA 1 1 8 3363 1 1 20 PHE CB C 7.099 2.597 -7.716 1.00 . A A . 20 PHE CB 1 1 8 3364 1 1 20 PHE CD1 C 8.473 4.747 -7.780 1.00 . A A . 20 PHE CD1 1 1 8 3365 1 1 20 PHE CD2 C 6.505 4.702 -6.435 1.00 . A A . 20 PHE CD2 1 1 8 3366 1 1 20 PHE CE1 C 8.705 6.052 -7.402 1.00 . A A . 20 PHE CE1 1 1 8 3367 1 1 20 PHE CE2 C 6.739 6.009 -6.057 1.00 . A A . 20 PHE CE2 1 1 8 3368 1 1 20 PHE CG C 7.370 4.057 -7.301 1.00 . A A . 20 PHE CG 1 1 8 3369 1 1 20 PHE CZ C 7.837 6.685 -6.539 1.00 . A A . 20 PHE CZ 1 1 8 3370 1 1 20 PHE H H 5.043 2.079 -9.146 1.00 . A A . 20 PHE H 1 1 8 3371 1 1 20 PHE HA H 7.586 3.317 -9.727 1.00 . A A . 20 PHE HA 1 1 8 3372 1 1 20 PHE HB2 H 6.126 2.305 -7.348 1.00 . A A . 20 PHE HB2 1 1 8 3373 1 1 20 PHE HB3 H 7.838 1.965 -7.246 1.00 . A A . 20 PHE HB3 1 1 8 3374 1 1 20 PHE HD1 H 9.163 4.264 -8.456 1.00 . A A . 20 PHE HD1 1 1 8 3375 1 1 20 PHE HD2 H 5.643 4.178 -6.051 1.00 . A A . 20 PHE HD2 1 1 8 3376 1 1 20 PHE HE1 H 9.568 6.580 -7.782 1.00 . A A . 20 PHE HE1 1 1 8 3377 1 1 20 PHE HE2 H 6.061 6.507 -5.380 1.00 . A A . 20 PHE HE2 1 1 8 3378 1 1 20 PHE HZ H 8.018 7.707 -6.243 1.00 . A A . 20 PHE HZ 1 1 8 3379 1 1 20 PHE N N 5.758 2.313 -9.765 1.00 . A A . 20 PHE N 1 1 8 3380 1 1 20 PHE O O 9.029 1.359 -10.194 1.00 . A A . 20 PHE O 1 1 8 3381 1 1 21 ALA C C 8.710 -1.218 -11.153 1.00 . A A . 21 ALA C 1 1 8 3382 1 1 21 ALA CA C 8.061 -1.222 -9.763 1.00 . A A . 21 ALA CA 1 1 8 3383 1 1 21 ALA CB C 7.009 -2.328 -9.668 1.00 . A A . 21 ALA CB 1 1 8 3384 1 1 21 ALA H H 6.504 0.044 -9.013 1.00 . A A . 21 ALA H 1 1 8 3385 1 1 21 ALA HA H 8.828 -1.405 -9.031 1.00 . A A . 21 ALA HA 1 1 8 3386 1 1 21 ALA HB1 H 6.501 -2.261 -8.716 1.00 . A A . 21 ALA HB1 1 1 8 3387 1 1 21 ALA HB2 H 6.280 -2.220 -10.453 1.00 . A A . 21 ALA HB2 1 1 8 3388 1 1 21 ALA HB3 H 7.476 -3.296 -9.749 1.00 . A A . 21 ALA HB3 1 1 8 3389 1 1 21 ALA N N 7.389 0.070 -9.424 1.00 . A A . 21 ALA N 1 1 8 3390 1 1 21 ALA O O 9.846 -1.624 -11.299 1.00 . A A . 21 ALA O 1 1 8 3391 1 1 22 GLU C C 9.748 0.073 -13.735 1.00 . A A . 22 GLU C 1 1 8 3392 1 1 22 GLU CA C 8.401 -0.648 -13.534 1.00 . A A . 22 GLU CA 1 1 8 3393 1 1 22 GLU CB C 7.313 0.094 -14.360 1.00 . A A . 22 GLU CB 1 1 8 3394 1 1 22 GLU CD C 5.998 -2.108 -14.066 1.00 . A A . 22 GLU CD 1 1 8 3395 1 1 22 GLU CG C 5.912 -0.591 -14.323 1.00 . A A . 22 GLU CG 1 1 8 3396 1 1 22 GLU H H 7.062 -0.434 -11.842 1.00 . A A . 22 GLU H 1 1 8 3397 1 1 22 GLU HA H 8.514 -1.654 -13.911 1.00 . A A . 22 GLU HA 1 1 8 3398 1 1 22 GLU HB2 H 7.211 1.099 -13.977 1.00 . A A . 22 GLU HB2 1 1 8 3399 1 1 22 GLU HB3 H 7.634 0.162 -15.389 1.00 . A A . 22 GLU HB3 1 1 8 3400 1 1 22 GLU HG2 H 5.301 -0.131 -13.562 1.00 . A A . 22 GLU HG2 1 1 8 3401 1 1 22 GLU HG3 H 5.421 -0.433 -15.274 1.00 . A A . 22 GLU HG3 1 1 8 3402 1 1 22 GLU N N 7.953 -0.738 -12.103 1.00 . A A . 22 GLU N 1 1 8 3403 1 1 22 GLU O O 10.342 -0.023 -14.791 1.00 . A A . 22 GLU O 1 1 8 3404 1 1 22 GLU OE1 O 6.249 -2.809 -15.032 1.00 . A A . 22 GLU OE1 1 1 8 3405 1 1 22 GLU OE2 O 5.810 -2.479 -12.919 1.00 . A A . 22 GLU OE2 1 1 8 3406 1 1 23 ASP C C 12.095 1.571 -11.355 1.00 . A A . 23 ASP C 1 1 8 3407 1 1 23 ASP CA C 11.466 1.524 -12.762 1.00 . A A . 23 ASP CA 1 1 8 3408 1 1 23 ASP CB C 11.137 2.932 -13.292 1.00 . A A . 23 ASP CB 1 1 8 3409 1 1 23 ASP CG C 12.404 3.588 -13.867 1.00 . A A . 23 ASP CG 1 1 8 3410 1 1 23 ASP H H 9.669 0.812 -11.898 1.00 . A A . 23 ASP H 1 1 8 3411 1 1 23 ASP HA H 12.142 1.005 -13.419 1.00 . A A . 23 ASP HA 1 1 8 3412 1 1 23 ASP HB2 H 10.391 2.858 -14.071 1.00 . A A . 23 ASP HB2 1 1 8 3413 1 1 23 ASP HB3 H 10.733 3.540 -12.494 1.00 . A A . 23 ASP HB3 1 1 8 3414 1 1 23 ASP N N 10.185 0.771 -12.719 1.00 . A A . 23 ASP N 1 1 8 3415 1 1 23 ASP O O 12.781 2.513 -11.004 1.00 . A A . 23 ASP O 1 1 8 3416 1 1 23 ASP OD1 O 12.747 3.220 -14.979 1.00 . A A . 23 ASP OD1 1 1 8 3417 1 1 23 ASP OD2 O 12.960 4.418 -13.164 1.00 . A A . 23 ASP OD2 1 1 8 3418 1 1 24 VAL C C 12.985 -0.974 -9.005 1.00 . A A . 24 VAL C 1 1 8 3419 1 1 24 VAL CA C 12.373 0.424 -9.197 1.00 . A A . 24 VAL CA 1 1 8 3420 1 1 24 VAL CB C 11.208 0.668 -8.206 1.00 . A A . 24 VAL CB 1 1 8 3421 1 1 24 VAL CG1 C 11.554 0.221 -6.767 1.00 . A A . 24 VAL CG1 1 1 8 3422 1 1 24 VAL CG2 C 10.848 2.171 -8.165 1.00 . A A . 24 VAL CG2 1 1 8 3423 1 1 24 VAL H H 11.280 -0.188 -10.944 1.00 . A A . 24 VAL H 1 1 8 3424 1 1 24 VAL HA H 13.130 1.166 -9.030 1.00 . A A . 24 VAL HA 1 1 8 3425 1 1 24 VAL HB H 10.371 0.103 -8.561 1.00 . A A . 24 VAL HB 1 1 8 3426 1 1 24 VAL HG11 H 12.514 0.618 -6.469 1.00 . A A . 24 VAL HG11 1 1 8 3427 1 1 24 VAL HG12 H 10.802 0.580 -6.080 1.00 . A A . 24 VAL HG12 1 1 8 3428 1 1 24 VAL HG13 H 11.583 -0.857 -6.707 1.00 . A A . 24 VAL HG13 1 1 8 3429 1 1 24 VAL HG21 H 10.772 2.584 -9.160 1.00 . A A . 24 VAL HG21 1 1 8 3430 1 1 24 VAL HG22 H 9.896 2.294 -7.672 1.00 . A A . 24 VAL HG22 1 1 8 3431 1 1 24 VAL HG23 H 11.592 2.730 -7.618 1.00 . A A . 24 VAL HG23 1 1 8 3432 1 1 24 VAL N N 11.838 0.536 -10.592 1.00 . A A . 24 VAL N 1 1 8 3433 1 1 24 VAL O O 13.929 -1.128 -8.254 1.00 . A A . 24 VAL O 1 1 8 3434 1 1 25 GLY C C 14.253 -3.510 -10.354 1.00 . A A . 25 GLY C 1 1 8 3435 1 1 25 GLY CA C 12.932 -3.353 -9.591 1.00 . A A . 25 GLY CA 1 1 8 3436 1 1 25 GLY H H 11.669 -1.759 -10.277 1.00 . A A . 25 GLY H 1 1 8 3437 1 1 25 GLY HA2 H 13.083 -3.609 -8.552 1.00 . A A . 25 GLY HA2 1 1 8 3438 1 1 25 GLY HA3 H 12.195 -4.017 -10.017 1.00 . A A . 25 GLY HA3 1 1 8 3439 1 1 25 GLY N N 12.429 -1.947 -9.689 1.00 . A A . 25 GLY N 1 1 8 3440 1 1 25 GLY O O 14.281 -4.030 -11.452 1.00 . A A . 25 GLY O 1 1 8 3441 1 1 26 SER C C 17.184 -4.567 -10.434 1.00 . A A . 26 SER C 1 1 8 3442 1 1 26 SER CA C 16.674 -3.123 -10.335 1.00 . A A . 26 SER CA 1 1 8 3443 1 1 26 SER CB C 17.636 -2.296 -9.472 1.00 . A A . 26 SER CB 1 1 8 3444 1 1 26 SER H H 15.207 -2.643 -8.848 1.00 . A A . 26 SER H 1 1 8 3445 1 1 26 SER HA H 16.626 -2.702 -11.327 1.00 . A A . 26 SER HA 1 1 8 3446 1 1 26 SER HB2 H 17.683 -2.667 -8.458 1.00 . A A . 26 SER HB2 1 1 8 3447 1 1 26 SER HB3 H 18.626 -2.257 -9.902 1.00 . A A . 26 SER HB3 1 1 8 3448 1 1 26 SER HG H 16.839 -0.768 -8.568 1.00 . A A . 26 SER HG 1 1 8 3449 1 1 26 SER N N 15.309 -3.049 -9.731 1.00 . A A . 26 SER N 1 1 8 3450 1 1 26 SER O O 18.102 -4.838 -11.182 1.00 . A A . 26 SER O 1 1 8 3451 1 1 26 SER OG O 17.067 -0.994 -9.473 1.00 . A A . 26 SER OG 1 1 8 3452 1 1 27 ASN C C 18.358 -7.125 -9.071 1.00 . A A . 27 ASN C 1 1 8 3453 1 1 27 ASN CA C 16.944 -6.897 -9.646 1.00 . A A . 27 ASN CA 1 1 8 3454 1 1 27 ASN CB C 16.857 -7.466 -11.093 1.00 . A A . 27 ASN CB 1 1 8 3455 1 1 27 ASN CG C 16.698 -8.990 -11.040 1.00 . A A . 27 ASN CG 1 1 8 3456 1 1 27 ASN H H 15.837 -5.134 -9.099 1.00 . A A . 27 ASN H 1 1 8 3457 1 1 27 ASN HA H 16.236 -7.409 -9.010 1.00 . A A . 27 ASN HA 1 1 8 3458 1 1 27 ASN HB2 H 16.002 -7.049 -11.606 1.00 . A A . 27 ASN HB2 1 1 8 3459 1 1 27 ASN HB3 H 17.748 -7.233 -11.655 1.00 . A A . 27 ASN HB3 1 1 8 3460 1 1 27 ASN HD21 H 14.779 -8.902 -10.537 1.00 . A A . 27 ASN HD21 1 1 8 3461 1 1 27 ASN HD22 H 15.419 -10.467 -10.693 1.00 . A A . 27 ASN HD22 1 1 8 3462 1 1 27 ASN N N 16.570 -5.443 -9.673 1.00 . A A . 27 ASN N 1 1 8 3463 1 1 27 ASN ND2 N 15.535 -9.494 -10.730 1.00 . A A . 27 ASN ND2 1 1 8 3464 1 1 27 ASN O O 18.836 -8.243 -9.027 1.00 . A A . 27 ASN O 1 1 8 3465 1 1 27 ASN OD1 O 17.629 -9.732 -11.277 1.00 . A A . 27 ASN OD1 1 1 8 3466 1 1 28 LYS C C 20.728 -4.756 -7.421 1.00 . A A . 28 LYS C 1 1 8 3467 1 1 28 LYS CA C 20.358 -6.109 -8.062 1.00 . A A . 28 LYS CA 1 1 8 3468 1 1 28 LYS CB C 21.393 -6.455 -9.174 1.00 . A A . 28 LYS CB 1 1 8 3469 1 1 28 LYS CD C 20.848 -6.354 -11.648 1.00 . A A . 28 LYS CD 1 1 8 3470 1 1 28 LYS CE C 20.582 -5.418 -12.847 1.00 . A A . 28 LYS CE 1 1 8 3471 1 1 28 LYS CG C 21.244 -5.522 -10.409 1.00 . A A . 28 LYS CG 1 1 8 3472 1 1 28 LYS H H 18.535 -5.183 -8.712 1.00 . A A . 28 LYS H 1 1 8 3473 1 1 28 LYS HA H 20.374 -6.874 -7.297 1.00 . A A . 28 LYS HA 1 1 8 3474 1 1 28 LYS HB2 H 22.390 -6.345 -8.771 1.00 . A A . 28 LYS HB2 1 1 8 3475 1 1 28 LYS HB3 H 21.269 -7.489 -9.460 1.00 . A A . 28 LYS HB3 1 1 8 3476 1 1 28 LYS HD2 H 21.651 -7.035 -11.896 1.00 . A A . 28 LYS HD2 1 1 8 3477 1 1 28 LYS HD3 H 19.967 -6.935 -11.425 1.00 . A A . 28 LYS HD3 1 1 8 3478 1 1 28 LYS HE2 H 20.437 -4.396 -12.525 1.00 . A A . 28 LYS HE2 1 1 8 3479 1 1 28 LYS HE3 H 21.418 -5.449 -13.531 1.00 . A A . 28 LYS HE3 1 1 8 3480 1 1 28 LYS HG2 H 20.498 -4.761 -10.232 1.00 . A A . 28 LYS HG2 1 1 8 3481 1 1 28 LYS HG3 H 22.188 -5.029 -10.596 1.00 . A A . 28 LYS HG3 1 1 8 3482 1 1 28 LYS HZ1 H 18.958 -6.697 -13.119 1.00 . A A . 28 LYS HZ1 1 1 8 3483 1 1 28 LYS HZ2 H 18.655 -5.089 -13.564 1.00 . A A . 28 LYS HZ2 1 1 8 3484 1 1 28 LYS HZ3 H 19.604 -6.083 -14.563 1.00 . A A . 28 LYS HZ3 1 1 8 3485 1 1 28 LYS N N 18.980 -6.053 -8.647 1.00 . A A . 28 LYS N 1 1 8 3486 1 1 28 LYS NZ N 19.359 -5.855 -13.579 1.00 . A A . 28 LYS NZ 1 1 8 3487 1 1 28 LYS O O 20.183 -3.758 -7.867 1.00 . A A . 28 LYS O 1 1 8 3488 1 1 28 LYS OXT O 21.543 -4.795 -6.513 1.00 . A A . 28 LYS OXT 1 1 9 3489 1 1 1 ASP C C -12.194 -13.578 -28.364 1.00 . A A . 1 ASP C 1 1 9 3490 1 1 1 ASP CA C -12.870 -14.892 -27.950 1.00 . A A . 1 ASP CA 1 1 9 3491 1 1 1 ASP CB C -11.785 -15.897 -27.522 1.00 . A A . 1 ASP CB 1 1 9 3492 1 1 1 ASP CG C -12.459 -17.191 -27.032 1.00 . A A . 1 ASP CG 1 1 9 3493 1 1 1 ASP H1 H -13.577 -14.810 -29.911 1.00 . A A . 1 ASP H1 1 1 9 3494 1 1 1 ASP H2 H -13.302 -16.385 -29.340 1.00 . A A . 1 ASP H2 1 1 9 3495 1 1 1 ASP H3 H -14.660 -15.516 -28.810 1.00 . A A . 1 ASP H3 1 1 9 3496 1 1 1 ASP HA H -13.545 -14.697 -27.129 1.00 . A A . 1 ASP HA 1 1 9 3497 1 1 1 ASP HB2 H -11.139 -16.130 -28.357 1.00 . A A . 1 ASP HB2 1 1 9 3498 1 1 1 ASP HB3 H -11.183 -15.483 -26.725 1.00 . A A . 1 ASP HB3 1 1 9 3499 1 1 1 ASP N N -13.662 -15.441 -29.090 1.00 . A A . 1 ASP N 1 1 9 3500 1 1 1 ASP O O -11.824 -13.405 -29.509 1.00 . A A . 1 ASP O 1 1 9 3501 1 1 1 ASP OD1 O -12.687 -18.039 -27.879 1.00 . A A . 1 ASP OD1 1 1 9 3502 1 1 1 ASP OD2 O -12.709 -17.255 -25.840 1.00 . A A . 1 ASP OD2 1 1 9 3503 1 1 2 ALA C C -10.845 -10.811 -26.351 1.00 . A A . 2 ALA C 1 1 9 3504 1 1 2 ALA CA C -11.414 -11.365 -27.661 1.00 . A A . 2 ALA CA 1 1 9 3505 1 1 2 ALA CB C -12.465 -10.395 -28.224 1.00 . A A . 2 ALA CB 1 1 9 3506 1 1 2 ALA H H -12.380 -12.903 -26.506 1.00 . A A . 2 ALA H 1 1 9 3507 1 1 2 ALA HA H -10.608 -11.491 -28.370 1.00 . A A . 2 ALA HA 1 1 9 3508 1 1 2 ALA HB1 H -13.297 -10.309 -27.540 1.00 . A A . 2 ALA HB1 1 1 9 3509 1 1 2 ALA HB2 H -12.031 -9.416 -28.370 1.00 . A A . 2 ALA HB2 1 1 9 3510 1 1 2 ALA HB3 H -12.831 -10.759 -29.172 1.00 . A A . 2 ALA HB3 1 1 9 3511 1 1 2 ALA N N -12.056 -12.693 -27.407 1.00 . A A . 2 ALA N 1 1 9 3512 1 1 2 ALA O O -11.538 -10.760 -25.352 1.00 . A A . 2 ALA O 1 1 9 3513 1 1 3 GLU C C -9.203 -8.347 -25.015 1.00 . A A . 3 GLU C 1 1 9 3514 1 1 3 GLU CA C -8.924 -9.848 -25.186 1.00 . A A . 3 GLU CA 1 1 9 3515 1 1 3 GLU CB C -7.402 -10.117 -25.317 1.00 . A A . 3 GLU CB 1 1 9 3516 1 1 3 GLU CD C -5.947 -8.165 -26.030 1.00 . A A . 3 GLU CD 1 1 9 3517 1 1 3 GLU CG C -6.791 -9.354 -26.530 1.00 . A A . 3 GLU CG 1 1 9 3518 1 1 3 GLU H H -9.099 -10.478 -27.240 1.00 . A A . 3 GLU H 1 1 9 3519 1 1 3 GLU HA H -9.320 -10.348 -24.320 1.00 . A A . 3 GLU HA 1 1 9 3520 1 1 3 GLU HB2 H -6.908 -9.831 -24.399 1.00 . A A . 3 GLU HB2 1 1 9 3521 1 1 3 GLU HB3 H -7.246 -11.177 -25.458 1.00 . A A . 3 GLU HB3 1 1 9 3522 1 1 3 GLU HG2 H -6.152 -10.019 -27.093 1.00 . A A . 3 GLU HG2 1 1 9 3523 1 1 3 GLU HG3 H -7.565 -8.988 -27.189 1.00 . A A . 3 GLU HG3 1 1 9 3524 1 1 3 GLU N N -9.598 -10.410 -26.400 1.00 . A A . 3 GLU N 1 1 9 3525 1 1 3 GLU O O -8.482 -7.641 -24.336 1.00 . A A . 3 GLU O 1 1 9 3526 1 1 3 GLU OE1 O -4.868 -8.434 -25.530 1.00 . A A . 3 GLU OE1 1 1 9 3527 1 1 3 GLU OE2 O -6.423 -7.052 -26.174 1.00 . A A . 3 GLU OE2 1 1 9 3528 1 1 4 PHE C C -9.584 -5.546 -26.029 1.00 . A A . 4 PHE C 1 1 9 3529 1 1 4 PHE CA C -10.720 -6.498 -25.612 1.00 . A A . 4 PHE CA 1 1 9 3530 1 1 4 PHE CB C -11.219 -6.181 -24.170 1.00 . A A . 4 PHE CB 1 1 9 3531 1 1 4 PHE CD1 C -13.426 -7.436 -24.133 1.00 . A A . 4 PHE CD1 1 1 9 3532 1 1 4 PHE CD2 C -11.638 -8.275 -22.796 1.00 . A A . 4 PHE CD2 1 1 9 3533 1 1 4 PHE CE1 C -14.232 -8.469 -23.702 1.00 . A A . 4 PHE CE1 1 1 9 3534 1 1 4 PHE CE2 C -12.444 -9.308 -22.366 1.00 . A A . 4 PHE CE2 1 1 9 3535 1 1 4 PHE CG C -12.122 -7.330 -23.684 1.00 . A A . 4 PHE CG 1 1 9 3536 1 1 4 PHE CZ C -13.742 -9.406 -22.818 1.00 . A A . 4 PHE CZ 1 1 9 3537 1 1 4 PHE H H -10.782 -8.582 -26.156 1.00 . A A . 4 PHE H 1 1 9 3538 1 1 4 PHE HA H -11.536 -6.382 -26.312 1.00 . A A . 4 PHE HA 1 1 9 3539 1 1 4 PHE HB2 H -10.385 -6.074 -23.491 1.00 . A A . 4 PHE HB2 1 1 9 3540 1 1 4 PHE HB3 H -11.787 -5.263 -24.168 1.00 . A A . 4 PHE HB3 1 1 9 3541 1 1 4 PHE HD1 H -13.820 -6.706 -24.825 1.00 . A A . 4 PHE HD1 1 1 9 3542 1 1 4 PHE HD2 H -10.622 -8.206 -22.435 1.00 . A A . 4 PHE HD2 1 1 9 3543 1 1 4 PHE HE1 H -15.250 -8.545 -24.058 1.00 . A A . 4 PHE HE1 1 1 9 3544 1 1 4 PHE HE2 H -12.057 -10.041 -21.674 1.00 . A A . 4 PHE HE2 1 1 9 3545 1 1 4 PHE HZ H -14.373 -10.216 -22.482 1.00 . A A . 4 PHE HZ 1 1 9 3546 1 1 4 PHE N N -10.268 -7.926 -25.647 1.00 . A A . 4 PHE N 1 1 9 3547 1 1 4 PHE O O -9.184 -4.667 -25.288 1.00 . A A . 4 PHE O 1 1 9 3548 1 1 5 ARG C C -8.533 -3.625 -28.382 1.00 . A A . 5 ARG C 1 1 9 3549 1 1 5 ARG CA C -8.001 -4.947 -27.797 1.00 . A A . 5 ARG CA 1 1 9 3550 1 1 5 ARG CB C -7.294 -5.807 -28.879 1.00 . A A . 5 ARG CB 1 1 9 3551 1 1 5 ARG CD C -4.971 -6.465 -29.629 1.00 . A A . 5 ARG CD 1 1 9 3552 1 1 5 ARG CG C -5.832 -5.331 -29.035 1.00 . A A . 5 ARG CG 1 1 9 3553 1 1 5 ARG CZ C -3.515 -8.219 -28.740 1.00 . A A . 5 ARG CZ 1 1 9 3554 1 1 5 ARG H H -9.475 -6.495 -27.765 1.00 . A A . 5 ARG H 1 1 9 3555 1 1 5 ARG HA H -7.315 -4.719 -27.000 1.00 . A A . 5 ARG HA 1 1 9 3556 1 1 5 ARG HB2 H -7.310 -6.845 -28.576 1.00 . A A . 5 ARG HB2 1 1 9 3557 1 1 5 ARG HB3 H -7.809 -5.729 -29.825 1.00 . A A . 5 ARG HB3 1 1 9 3558 1 1 5 ARG HD2 H -5.572 -7.151 -30.210 1.00 . A A . 5 ARG HD2 1 1 9 3559 1 1 5 ARG HD3 H -4.202 -6.048 -30.265 1.00 . A A . 5 ARG HD3 1 1 9 3560 1 1 5 ARG HE H -4.498 -6.941 -27.582 1.00 . A A . 5 ARG HE 1 1 9 3561 1 1 5 ARG HG2 H -5.805 -4.472 -29.689 1.00 . A A . 5 ARG HG2 1 1 9 3562 1 1 5 ARG HG3 H -5.429 -5.040 -28.075 1.00 . A A . 5 ARG HG3 1 1 9 3563 1 1 5 ARG HH11 H -3.692 -8.122 -30.735 1.00 . A A . 5 ARG HH11 1 1 9 3564 1 1 5 ARG HH12 H -2.652 -9.368 -30.134 1.00 . A A . 5 ARG HH12 1 1 9 3565 1 1 5 ARG HH21 H -3.168 -8.524 -26.792 1.00 . A A . 5 ARG HH21 1 1 9 3566 1 1 5 ARG HH22 H -2.357 -9.603 -27.874 1.00 . A A . 5 ARG HH22 1 1 9 3567 1 1 5 ARG N N -9.106 -5.770 -27.226 1.00 . A A . 5 ARG N 1 1 9 3568 1 1 5 ARG NE N -4.321 -7.212 -28.507 1.00 . A A . 5 ARG NE 1 1 9 3569 1 1 5 ARG NH1 N -3.267 -8.599 -29.966 1.00 . A A . 5 ARG NH1 1 1 9 3570 1 1 5 ARG NH2 N -2.972 -8.829 -27.722 1.00 . A A . 5 ARG NH2 1 1 9 3571 1 1 5 ARG O O -8.514 -3.395 -29.577 1.00 . A A . 5 ARG O 1 1 9 3572 1 1 6 HIS C C -9.639 -0.640 -26.549 1.00 . A A . 6 HIS C 1 1 9 3573 1 1 6 HIS CA C -9.555 -1.460 -27.839 1.00 . A A . 6 HIS CA 1 1 9 3574 1 1 6 HIS CB C -10.966 -1.635 -28.455 1.00 . A A . 6 HIS CB 1 1 9 3575 1 1 6 HIS CD2 C -11.200 -2.670 -30.883 1.00 . A A . 6 HIS CD2 1 1 9 3576 1 1 6 HIS CE1 C -10.449 -1.069 -31.966 1.00 . A A . 6 HIS CE1 1 1 9 3577 1 1 6 HIS CG C -10.861 -1.675 -29.982 1.00 . A A . 6 HIS CG 1 1 9 3578 1 1 6 HIS H H -8.969 -3.057 -26.542 1.00 . A A . 6 HIS H 1 1 9 3579 1 1 6 HIS HA H -8.872 -0.973 -28.517 1.00 . A A . 6 HIS HA 1 1 9 3580 1 1 6 HIS HB2 H -11.418 -2.555 -28.115 1.00 . A A . 6 HIS HB2 1 1 9 3581 1 1 6 HIS HB3 H -11.610 -0.811 -28.181 1.00 . A A . 6 HIS HB3 1 1 9 3582 1 1 6 HIS HD1 H -10.075 0.143 -30.388 1.00 . A A . 6 HIS HD1 1 1 9 3583 1 1 6 HIS HD2 H -11.618 -3.630 -30.615 1.00 . A A . 6 HIS HD2 1 1 9 3584 1 1 6 HIS HE1 H -10.125 -0.442 -32.784 1.00 . A A . 6 HIS HE1 1 1 9 3585 1 1 6 HIS N N -8.994 -2.795 -27.483 1.00 . A A . 6 HIS N 1 1 9 3586 1 1 6 HIS ND1 N -10.405 -0.718 -30.721 1.00 . A A . 6 HIS ND1 1 1 9 3587 1 1 6 HIS NE2 N -10.938 -2.276 -32.114 1.00 . A A . 6 HIS NE2 1 1 9 3588 1 1 6 HIS O O -8.969 0.367 -26.409 1.00 . A A . 6 HIS O 1 1 9 3589 1 1 7 ASP C C -11.054 1.026 -24.530 1.00 . A A . 7 ASP C 1 1 9 3590 1 1 7 ASP CA C -10.688 -0.451 -24.327 1.00 . A A . 7 ASP CA 1 1 9 3591 1 1 7 ASP CB C -9.382 -0.619 -23.488 1.00 . A A . 7 ASP CB 1 1 9 3592 1 1 7 ASP CG C -9.514 0.044 -22.101 1.00 . A A . 7 ASP CG 1 1 9 3593 1 1 7 ASP H H -10.972 -1.925 -25.855 1.00 . A A . 7 ASP H 1 1 9 3594 1 1 7 ASP HA H -11.512 -0.946 -23.835 1.00 . A A . 7 ASP HA 1 1 9 3595 1 1 7 ASP HB2 H -9.182 -1.671 -23.342 1.00 . A A . 7 ASP HB2 1 1 9 3596 1 1 7 ASP HB3 H -8.543 -0.183 -24.010 1.00 . A A . 7 ASP HB3 1 1 9 3597 1 1 7 ASP N N -10.470 -1.112 -25.651 1.00 . A A . 7 ASP N 1 1 9 3598 1 1 7 ASP O O -10.430 1.930 -24.007 1.00 . A A . 7 ASP O 1 1 9 3599 1 1 7 ASP OD1 O -10.555 -0.140 -21.490 1.00 . A A . 7 ASP OD1 1 1 9 3600 1 1 7 ASP OD2 O -8.556 0.702 -21.732 1.00 . A A . 7 ASP OD2 1 1 9 3601 1 1 8 SER C C -12.962 3.380 -24.361 1.00 . A A . 8 SER C 1 1 9 3602 1 1 8 SER CA C -12.588 2.580 -25.621 1.00 . A A . 8 SER CA 1 1 9 3603 1 1 8 SER CB C -13.816 2.458 -26.545 1.00 . A A . 8 SER CB 1 1 9 3604 1 1 8 SER H H -12.545 0.431 -25.692 1.00 . A A . 8 SER H 1 1 9 3605 1 1 8 SER HA H -11.795 3.094 -26.137 1.00 . A A . 8 SER HA 1 1 9 3606 1 1 8 SER HB2 H -14.292 3.414 -26.708 1.00 . A A . 8 SER HB2 1 1 9 3607 1 1 8 SER HB3 H -13.555 2.009 -27.493 1.00 . A A . 8 SER HB3 1 1 9 3608 1 1 8 SER HG H -14.863 0.824 -26.394 1.00 . A A . 8 SER HG 1 1 9 3609 1 1 8 SER N N -12.089 1.209 -25.308 1.00 . A A . 8 SER N 1 1 9 3610 1 1 8 SER O O -12.814 4.587 -24.325 1.00 . A A . 8 SER O 1 1 9 3611 1 1 8 SER OG O -14.709 1.599 -25.849 1.00 . A A . 8 SER OG 1 1 9 3612 1 1 9 GLY C C -12.699 3.362 -21.048 1.00 . A A . 9 GLY C 1 1 9 3613 1 1 9 GLY CA C -13.839 3.302 -22.075 1.00 . A A . 9 GLY CA 1 1 9 3614 1 1 9 GLY H H -13.511 1.698 -23.483 1.00 . A A . 9 GLY H 1 1 9 3615 1 1 9 GLY HA2 H -14.191 4.307 -22.262 1.00 . A A . 9 GLY HA2 1 1 9 3616 1 1 9 GLY HA3 H -14.650 2.726 -21.656 1.00 . A A . 9 GLY HA3 1 1 9 3617 1 1 9 GLY N N -13.430 2.667 -23.368 1.00 . A A . 9 GLY N 1 1 9 3618 1 1 9 GLY O O -12.957 3.553 -19.876 1.00 . A A . 9 GLY O 1 1 9 3619 1 1 10 TYR C C -10.247 2.116 -19.576 1.00 . A A . 10 TYR C 1 1 9 3620 1 1 10 TYR CA C -10.259 3.227 -20.641 1.00 . A A . 10 TYR CA 1 1 9 3621 1 1 10 TYR CB C -10.154 4.653 -19.964 1.00 . A A . 10 TYR CB 1 1 9 3622 1 1 10 TYR CD1 C -8.766 4.442 -17.849 1.00 . A A . 10 TYR CD1 1 1 9 3623 1 1 10 TYR CD2 C -11.117 4.717 -17.605 1.00 . A A . 10 TYR CD2 1 1 9 3624 1 1 10 TYR CE1 C -8.630 4.393 -16.478 1.00 . A A . 10 TYR CE1 1 1 9 3625 1 1 10 TYR CE2 C -10.979 4.665 -16.233 1.00 . A A . 10 TYR CE2 1 1 9 3626 1 1 10 TYR CG C -10.011 4.605 -18.427 1.00 . A A . 10 TYR CG 1 1 9 3627 1 1 10 TYR CZ C -9.735 4.503 -15.661 1.00 . A A . 10 TYR CZ 1 1 9 3628 1 1 10 TYR H H -11.358 3.046 -22.472 1.00 . A A . 10 TYR H 1 1 9 3629 1 1 10 TYR HA H -9.400 3.092 -21.281 1.00 . A A . 10 TYR HA 1 1 9 3630 1 1 10 TYR HB2 H -9.275 5.141 -20.362 1.00 . A A . 10 TYR HB2 1 1 9 3631 1 1 10 TYR HB3 H -11.014 5.254 -20.213 1.00 . A A . 10 TYR HB3 1 1 9 3632 1 1 10 TYR HD1 H -7.891 4.355 -18.475 1.00 . A A . 10 TYR HD1 1 1 9 3633 1 1 10 TYR HD2 H -12.099 4.847 -18.033 1.00 . A A . 10 TYR HD2 1 1 9 3634 1 1 10 TYR HE1 H -7.651 4.266 -16.040 1.00 . A A . 10 TYR HE1 1 1 9 3635 1 1 10 TYR HE2 H -11.853 4.754 -15.605 1.00 . A A . 10 TYR HE2 1 1 9 3636 1 1 10 TYR HH H -10.104 3.701 -13.969 1.00 . A A . 10 TYR HH 1 1 9 3637 1 1 10 TYR N N -11.482 3.197 -21.513 1.00 . A A . 10 TYR N 1 1 9 3638 1 1 10 TYR O O -11.265 1.571 -19.197 1.00 . A A . 10 TYR O 1 1 9 3639 1 1 10 TYR OH O -9.597 4.450 -14.289 1.00 . A A . 10 TYR OH 1 1 9 3640 1 1 11 GLU C C -7.304 0.854 -17.840 1.00 . A A . 11 GLU C 1 1 9 3641 1 1 11 GLU CA C -8.801 0.787 -18.101 1.00 . A A . 11 GLU CA 1 1 9 3642 1 1 11 GLU CB C -9.188 -0.616 -18.639 1.00 . A A . 11 GLU CB 1 1 9 3643 1 1 11 GLU CD C -9.397 -1.463 -16.254 1.00 . A A . 11 GLU CD 1 1 9 3644 1 1 11 GLU CG C -8.775 -1.719 -17.639 1.00 . A A . 11 GLU CG 1 1 9 3645 1 1 11 GLU H H -8.277 2.322 -19.487 1.00 . A A . 11 GLU H 1 1 9 3646 1 1 11 GLU HA H -9.333 1.043 -17.197 1.00 . A A . 11 GLU HA 1 1 9 3647 1 1 11 GLU HB2 H -10.252 -0.667 -18.806 1.00 . A A . 11 GLU HB2 1 1 9 3648 1 1 11 GLU HB3 H -8.684 -0.795 -19.577 1.00 . A A . 11 GLU HB3 1 1 9 3649 1 1 11 GLU HG2 H -9.113 -2.679 -18.003 1.00 . A A . 11 GLU HG2 1 1 9 3650 1 1 11 GLU HG3 H -7.698 -1.749 -17.550 1.00 . A A . 11 GLU HG3 1 1 9 3651 1 1 11 GLU N N -9.050 1.831 -19.134 1.00 . A A . 11 GLU N 1 1 9 3652 1 1 11 GLU O O -6.517 0.795 -18.766 1.00 . A A . 11 GLU O 1 1 9 3653 1 1 11 GLU OE1 O -10.582 -1.726 -16.135 1.00 . A A . 11 GLU OE1 1 1 9 3654 1 1 11 GLU OE2 O -8.654 -1.020 -15.392 1.00 . A A . 11 GLU OE2 1 1 9 3655 1 1 12 VAL C C -5.234 0.082 -15.041 1.00 . A A . 12 VAL C 1 1 9 3656 1 1 12 VAL CA C -5.537 1.057 -16.186 1.00 . A A . 12 VAL CA 1 1 9 3657 1 1 12 VAL CB C -5.247 2.511 -15.766 1.00 . A A . 12 VAL CB 1 1 9 3658 1 1 12 VAL CG1 C -3.926 2.639 -14.960 1.00 . A A . 12 VAL CG1 1 1 9 3659 1 1 12 VAL CG2 C -5.148 3.391 -17.025 1.00 . A A . 12 VAL CG2 1 1 9 3660 1 1 12 VAL H H -7.650 1.015 -15.892 1.00 . A A . 12 VAL H 1 1 9 3661 1 1 12 VAL HA H -4.953 0.817 -17.044 1.00 . A A . 12 VAL HA 1 1 9 3662 1 1 12 VAL HB H -6.079 2.835 -15.171 1.00 . A A . 12 VAL HB 1 1 9 3663 1 1 12 VAL HG11 H -3.129 2.097 -15.449 1.00 . A A . 12 VAL HG11 1 1 9 3664 1 1 12 VAL HG12 H -3.639 3.677 -14.879 1.00 . A A . 12 VAL HG12 1 1 9 3665 1 1 12 VAL HG13 H -4.057 2.242 -13.964 1.00 . A A . 12 VAL HG13 1 1 9 3666 1 1 12 VAL HG21 H -6.029 3.267 -17.638 1.00 . A A . 12 VAL HG21 1 1 9 3667 1 1 12 VAL HG22 H -5.067 4.429 -16.743 1.00 . A A . 12 VAL HG22 1 1 9 3668 1 1 12 VAL HG23 H -4.278 3.116 -17.603 1.00 . A A . 12 VAL HG23 1 1 9 3669 1 1 12 VAL N N -6.965 0.976 -16.585 1.00 . A A . 12 VAL N 1 1 9 3670 1 1 12 VAL O O -4.149 -0.461 -14.976 1.00 . A A . 12 VAL O 1 1 9 3671 1 1 13 HIS C C -5.408 -0.296 -11.850 1.00 . A A . 13 HIS C 1 1 9 3672 1 1 13 HIS CA C -6.188 -0.972 -12.987 1.00 . A A . 13 HIS CA 1 1 9 3673 1 1 13 HIS CB C -5.512 -2.334 -13.306 1.00 . A A . 13 HIS CB 1 1 9 3674 1 1 13 HIS CD2 C -5.810 -3.285 -15.760 1.00 . A A . 13 HIS CD2 1 1 9 3675 1 1 13 HIS CE1 C -7.733 -4.033 -15.561 1.00 . A A . 13 HIS CE1 1 1 9 3676 1 1 13 HIS CG C -6.229 -3.026 -14.468 1.00 . A A . 13 HIS CG 1 1 9 3677 1 1 13 HIS H H -7.048 0.412 -14.367 1.00 . A A . 13 HIS H 1 1 9 3678 1 1 13 HIS HA H -7.204 -1.139 -12.660 1.00 . A A . 13 HIS HA 1 1 9 3679 1 1 13 HIS HB2 H -4.468 -2.217 -13.550 1.00 . A A . 13 HIS HB2 1 1 9 3680 1 1 13 HIS HB3 H -5.591 -2.972 -12.439 1.00 . A A . 13 HIS HB3 1 1 9 3681 1 1 13 HIS HD1 H -8.008 -3.494 -13.629 1.00 . A A . 13 HIS HD1 1 1 9 3682 1 1 13 HIS HD2 H -4.845 -3.013 -16.164 1.00 . A A . 13 HIS HD2 1 1 9 3683 1 1 13 HIS HE1 H -8.680 -4.505 -15.776 1.00 . A A . 13 HIS HE1 1 1 9 3684 1 1 13 HIS N N -6.223 -0.082 -14.195 1.00 . A A . 13 HIS N 1 1 9 3685 1 1 13 HIS ND1 N -7.424 -3.514 -14.416 1.00 . A A . 13 HIS ND1 1 1 9 3686 1 1 13 HIS NE2 N -6.758 -3.913 -16.428 1.00 . A A . 13 HIS NE2 1 1 9 3687 1 1 13 HIS O O -5.919 -0.166 -10.755 1.00 . A A . 13 HIS O 1 1 9 3688 1 1 14 HIS C C -2.003 1.222 -11.804 1.00 . A A . 14 HIS C 1 1 9 3689 1 1 14 HIS CA C -3.319 0.792 -11.140 1.00 . A A . 14 HIS CA 1 1 9 3690 1 1 14 HIS CB C -2.994 -0.169 -9.963 1.00 . A A . 14 HIS CB 1 1 9 3691 1 1 14 HIS CD2 C -1.019 -1.909 -10.267 1.00 . A A . 14 HIS CD2 1 1 9 3692 1 1 14 HIS CE1 C -1.989 -3.245 -11.524 1.00 . A A . 14 HIS CE1 1 1 9 3693 1 1 14 HIS CG C -2.298 -1.430 -10.486 1.00 . A A . 14 HIS CG 1 1 9 3694 1 1 14 HIS H H -3.854 -0.020 -13.051 1.00 . A A . 14 HIS H 1 1 9 3695 1 1 14 HIS HA H -3.828 1.673 -10.779 1.00 . A A . 14 HIS HA 1 1 9 3696 1 1 14 HIS HB2 H -2.336 0.320 -9.260 1.00 . A A . 14 HIS HB2 1 1 9 3697 1 1 14 HIS HB3 H -3.893 -0.461 -9.442 1.00 . A A . 14 HIS HB3 1 1 9 3698 1 1 14 HIS HD1 H -3.754 -2.256 -11.615 1.00 . A A . 14 HIS HD1 1 1 9 3699 1 1 14 HIS HD2 H -0.274 -1.427 -9.652 1.00 . A A . 14 HIS HD2 1 1 9 3700 1 1 14 HIS HE1 H -2.198 -4.095 -12.156 1.00 . A A . 14 HIS HE1 1 1 9 3701 1 1 14 HIS N N -4.198 0.115 -12.146 1.00 . A A . 14 HIS N 1 1 9 3702 1 1 14 HIS ND1 N -2.839 -2.303 -11.269 1.00 . A A . 14 HIS ND1 1 1 9 3703 1 1 14 HIS NE2 N -0.843 -3.040 -10.921 1.00 . A A . 14 HIS NE2 1 1 9 3704 1 1 14 HIS O O -1.643 0.731 -12.857 1.00 . A A . 14 HIS O 1 1 9 3705 1 1 15 GLN C C 0.644 3.445 -10.511 1.00 . A A . 15 GLN C 1 1 9 3706 1 1 15 GLN CA C -0.030 2.667 -11.653 1.00 . A A . 15 GLN CA 1 1 9 3707 1 1 15 GLN CB C -0.301 3.591 -12.877 1.00 . A A . 15 GLN CB 1 1 9 3708 1 1 15 GLN CD C -1.094 5.956 -13.223 1.00 . A A . 15 GLN CD 1 1 9 3709 1 1 15 GLN CG C -1.423 4.615 -12.557 1.00 . A A . 15 GLN CG 1 1 9 3710 1 1 15 GLN H H -1.696 2.478 -10.305 1.00 . A A . 15 GLN H 1 1 9 3711 1 1 15 GLN HA H 0.608 1.835 -11.920 1.00 . A A . 15 GLN HA 1 1 9 3712 1 1 15 GLN HB2 H 0.615 4.100 -13.147 1.00 . A A . 15 GLN HB2 1 1 9 3713 1 1 15 GLN HB3 H -0.605 2.986 -13.718 1.00 . A A . 15 GLN HB3 1 1 9 3714 1 1 15 GLN HE21 H 0.337 6.387 -11.917 1.00 . A A . 15 GLN HE21 1 1 9 3715 1 1 15 GLN HE22 H 0.080 7.554 -13.121 1.00 . A A . 15 GLN HE22 1 1 9 3716 1 1 15 GLN HG2 H -2.371 4.259 -12.935 1.00 . A A . 15 GLN HG2 1 1 9 3717 1 1 15 GLN HG3 H -1.516 4.778 -11.493 1.00 . A A . 15 GLN HG3 1 1 9 3718 1 1 15 GLN N N -1.334 2.134 -11.148 1.00 . A A . 15 GLN N 1 1 9 3719 1 1 15 GLN NE2 N -0.147 6.694 -12.712 1.00 . A A . 15 GLN NE2 1 1 9 3720 1 1 15 GLN O O 1.055 4.582 -10.652 1.00 . A A . 15 GLN O 1 1 9 3721 1 1 15 GLN OE1 O -1.690 6.341 -14.209 1.00 . A A . 15 GLN OE1 1 1 9 3722 1 1 16 PHE C C 2.267 2.218 -7.646 1.00 . A A . 16 PHE C 1 1 9 3723 1 1 16 PHE CA C 1.343 3.318 -8.159 1.00 . A A . 16 PHE CA 1 1 9 3724 1 1 16 PHE CB C 0.210 3.645 -7.154 1.00 . A A . 16 PHE CB 1 1 9 3725 1 1 16 PHE CD1 C 1.650 4.858 -5.445 1.00 . A A . 16 PHE CD1 1 1 9 3726 1 1 16 PHE CD2 C 0.402 2.960 -4.719 1.00 . A A . 16 PHE CD2 1 1 9 3727 1 1 16 PHE CE1 C 2.151 5.016 -4.169 1.00 . A A . 16 PHE CE1 1 1 9 3728 1 1 16 PHE CE2 C 0.903 3.118 -3.443 1.00 . A A . 16 PHE CE2 1 1 9 3729 1 1 16 PHE CG C 0.770 3.828 -5.731 1.00 . A A . 16 PHE CG 1 1 9 3730 1 1 16 PHE CZ C 1.778 4.145 -3.168 1.00 . A A . 16 PHE CZ 1 1 9 3731 1 1 16 PHE H H 0.363 1.853 -9.381 1.00 . A A . 16 PHE H 1 1 9 3732 1 1 16 PHE HA H 1.931 4.187 -8.399 1.00 . A A . 16 PHE HA 1 1 9 3733 1 1 16 PHE HB2 H -0.286 4.559 -7.447 1.00 . A A . 16 PHE HB2 1 1 9 3734 1 1 16 PHE HB3 H -0.518 2.847 -7.147 1.00 . A A . 16 PHE HB3 1 1 9 3735 1 1 16 PHE HD1 H 1.947 5.545 -6.224 1.00 . A A . 16 PHE HD1 1 1 9 3736 1 1 16 PHE HD2 H -0.284 2.153 -4.925 1.00 . A A . 16 PHE HD2 1 1 9 3737 1 1 16 PHE HE1 H 2.837 5.822 -3.954 1.00 . A A . 16 PHE HE1 1 1 9 3738 1 1 16 PHE HE2 H 0.610 2.435 -2.660 1.00 . A A . 16 PHE HE2 1 1 9 3739 1 1 16 PHE HZ H 2.171 4.269 -2.169 1.00 . A A . 16 PHE HZ 1 1 9 3740 1 1 16 PHE N N 0.724 2.763 -9.399 1.00 . A A . 16 PHE N 1 1 9 3741 1 1 16 PHE O O 3.448 2.422 -7.440 1.00 . A A . 16 PHE O 1 1 9 3742 1 1 17 LEU C C 3.312 -0.558 -8.117 1.00 . A A . 17 LEU C 1 1 9 3743 1 1 17 LEU CA C 2.394 -0.130 -6.973 1.00 . A A . 17 LEU CA 1 1 9 3744 1 1 17 LEU CB C 1.385 -1.253 -6.649 1.00 . A A . 17 LEU CB 1 1 9 3745 1 1 17 LEU CD1 C -0.996 -0.409 -6.312 1.00 . A A . 17 LEU CD1 1 1 9 3746 1 1 17 LEU CD2 C 0.075 -1.873 -4.570 1.00 . A A . 17 LEU CD2 1 1 9 3747 1 1 17 LEU CG C 0.337 -0.758 -5.605 1.00 . A A . 17 LEU CG 1 1 9 3748 1 1 17 LEU H H 0.715 1.008 -7.663 1.00 . A A . 17 LEU H 1 1 9 3749 1 1 17 LEU HA H 2.980 0.142 -6.112 1.00 . A A . 17 LEU HA 1 1 9 3750 1 1 17 LEU HB2 H 0.890 -1.569 -7.557 1.00 . A A . 17 LEU HB2 1 1 9 3751 1 1 17 LEU HB3 H 1.930 -2.099 -6.257 1.00 . A A . 17 LEU HB3 1 1 9 3752 1 1 17 LEU HD11 H -1.338 -1.242 -6.909 1.00 . A A . 17 LEU HD11 1 1 9 3753 1 1 17 LEU HD12 H -1.754 -0.175 -5.579 1.00 . A A . 17 LEU HD12 1 1 9 3754 1 1 17 LEU HD13 H -0.871 0.450 -6.954 1.00 . A A . 17 LEU HD13 1 1 9 3755 1 1 17 LEU HD21 H 0.993 -2.129 -4.062 1.00 . A A . 17 LEU HD21 1 1 9 3756 1 1 17 LEU HD22 H -0.641 -1.537 -3.835 1.00 . A A . 17 LEU HD22 1 1 9 3757 1 1 17 LEU HD23 H -0.313 -2.757 -5.056 1.00 . A A . 17 LEU HD23 1 1 9 3758 1 1 17 LEU HG H 0.708 0.115 -5.088 1.00 . A A . 17 LEU HG 1 1 9 3759 1 1 17 LEU N N 1.666 1.073 -7.465 1.00 . A A . 17 LEU N 1 1 9 3760 1 1 17 LEU O O 4.444 -0.954 -7.915 1.00 . A A . 17 LEU O 1 1 9 3761 1 1 18 VAL C C 4.475 0.294 -10.852 1.00 . A A . 18 VAL C 1 1 9 3762 1 1 18 VAL CA C 3.490 -0.811 -10.535 1.00 . A A . 18 VAL CA 1 1 9 3763 1 1 18 VAL CB C 2.454 -1.006 -11.680 1.00 . A A . 18 VAL CB 1 1 9 3764 1 1 18 VAL CG1 C 2.998 -0.574 -13.073 1.00 . A A . 18 VAL CG1 1 1 9 3765 1 1 18 VAL CG2 C 2.147 -2.504 -11.728 1.00 . A A . 18 VAL CG2 1 1 9 3766 1 1 18 VAL H H 1.835 -0.112 -9.359 1.00 . A A . 18 VAL H 1 1 9 3767 1 1 18 VAL HA H 4.043 -1.712 -10.340 1.00 . A A . 18 VAL HA 1 1 9 3768 1 1 18 VAL HB H 1.557 -0.446 -11.459 1.00 . A A . 18 VAL HB 1 1 9 3769 1 1 18 VAL HG11 H 3.972 -1.006 -13.252 1.00 . A A . 18 VAL HG11 1 1 9 3770 1 1 18 VAL HG12 H 2.328 -0.899 -13.855 1.00 . A A . 18 VAL HG12 1 1 9 3771 1 1 18 VAL HG13 H 3.081 0.502 -13.123 1.00 . A A . 18 VAL HG13 1 1 9 3772 1 1 18 VAL HG21 H 1.841 -2.842 -10.749 1.00 . A A . 18 VAL HG21 1 1 9 3773 1 1 18 VAL HG22 H 1.361 -2.702 -12.439 1.00 . A A . 18 VAL HG22 1 1 9 3774 1 1 18 VAL HG23 H 3.036 -3.046 -12.019 1.00 . A A . 18 VAL HG23 1 1 9 3775 1 1 18 VAL N N 2.754 -0.445 -9.297 1.00 . A A . 18 VAL N 1 1 9 3776 1 1 18 VAL O O 5.593 0.022 -11.231 1.00 . A A . 18 VAL O 1 1 9 3777 1 1 19 PHE C C 6.190 2.602 -10.052 1.00 . A A . 19 PHE C 1 1 9 3778 1 1 19 PHE CA C 4.958 2.650 -10.979 1.00 . A A . 19 PHE CA 1 1 9 3779 1 1 19 PHE CB C 4.199 3.976 -10.782 1.00 . A A . 19 PHE CB 1 1 9 3780 1 1 19 PHE CD1 C 5.557 5.207 -12.541 1.00 . A A . 19 PHE CD1 1 1 9 3781 1 1 19 PHE CD2 C 5.465 6.139 -10.346 1.00 . A A . 19 PHE CD2 1 1 9 3782 1 1 19 PHE CE1 C 6.368 6.245 -12.950 1.00 . A A . 19 PHE CE1 1 1 9 3783 1 1 19 PHE CE2 C 6.278 7.178 -10.756 1.00 . A A . 19 PHE CE2 1 1 9 3784 1 1 19 PHE CG C 5.098 5.144 -11.236 1.00 . A A . 19 PHE CG 1 1 9 3785 1 1 19 PHE CZ C 6.730 7.231 -12.057 1.00 . A A . 19 PHE CZ 1 1 9 3786 1 1 19 PHE H H 3.122 1.656 -10.371 1.00 . A A . 19 PHE H 1 1 9 3787 1 1 19 PHE HA H 5.274 2.559 -12.003 1.00 . A A . 19 PHE HA 1 1 9 3788 1 1 19 PHE HB2 H 3.304 3.977 -11.386 1.00 . A A . 19 PHE HB2 1 1 9 3789 1 1 19 PHE HB3 H 3.930 4.107 -9.744 1.00 . A A . 19 PHE HB3 1 1 9 3790 1 1 19 PHE HD1 H 5.280 4.441 -13.251 1.00 . A A . 19 PHE HD1 1 1 9 3791 1 1 19 PHE HD2 H 5.116 6.107 -9.324 1.00 . A A . 19 PHE HD2 1 1 9 3792 1 1 19 PHE HE1 H 6.722 6.284 -13.970 1.00 . A A . 19 PHE HE1 1 1 9 3793 1 1 19 PHE HE2 H 6.561 7.951 -10.056 1.00 . A A . 19 PHE HE2 1 1 9 3794 1 1 19 PHE HZ H 7.365 8.043 -12.378 1.00 . A A . 19 PHE HZ 1 1 9 3795 1 1 19 PHE N N 4.039 1.512 -10.685 1.00 . A A . 19 PHE N 1 1 9 3796 1 1 19 PHE O O 7.223 3.165 -10.357 1.00 . A A . 19 PHE O 1 1 9 3797 1 1 20 PHE C C 7.982 0.518 -8.191 1.00 . A A . 20 PHE C 1 1 9 3798 1 1 20 PHE CA C 7.121 1.771 -7.943 1.00 . A A . 20 PHE CA 1 1 9 3799 1 1 20 PHE CB C 6.451 1.722 -6.557 1.00 . A A . 20 PHE CB 1 1 9 3800 1 1 20 PHE CD1 C 8.314 2.926 -5.307 1.00 . A A . 20 PHE CD1 1 1 9 3801 1 1 20 PHE CD2 C 7.583 0.813 -4.478 1.00 . A A . 20 PHE CD2 1 1 9 3802 1 1 20 PHE CE1 C 9.227 3.015 -4.277 1.00 . A A . 20 PHE CE1 1 1 9 3803 1 1 20 PHE CE2 C 8.496 0.901 -3.449 1.00 . A A . 20 PHE CE2 1 1 9 3804 1 1 20 PHE CG C 7.482 1.824 -5.417 1.00 . A A . 20 PHE CG 1 1 9 3805 1 1 20 PHE CZ C 9.319 2.003 -3.347 1.00 . A A . 20 PHE CZ 1 1 9 3806 1 1 20 PHE H H 5.172 1.474 -8.777 1.00 . A A . 20 PHE H 1 1 9 3807 1 1 20 PHE HA H 7.758 2.642 -7.994 1.00 . A A . 20 PHE HA 1 1 9 3808 1 1 20 PHE HB2 H 5.767 2.551 -6.460 1.00 . A A . 20 PHE HB2 1 1 9 3809 1 1 20 PHE HB3 H 5.891 0.804 -6.451 1.00 . A A . 20 PHE HB3 1 1 9 3810 1 1 20 PHE HD1 H 8.250 3.727 -6.030 1.00 . A A . 20 PHE HD1 1 1 9 3811 1 1 20 PHE HD2 H 6.943 -0.055 -4.551 1.00 . A A . 20 PHE HD2 1 1 9 3812 1 1 20 PHE HE1 H 9.872 3.878 -4.199 1.00 . A A . 20 PHE HE1 1 1 9 3813 1 1 20 PHE HE2 H 8.566 0.107 -2.722 1.00 . A A . 20 PHE HE2 1 1 9 3814 1 1 20 PHE HZ H 10.034 2.073 -2.541 1.00 . A A . 20 PHE HZ 1 1 9 3815 1 1 20 PHE N N 6.030 1.914 -8.950 1.00 . A A . 20 PHE N 1 1 9 3816 1 1 20 PHE O O 8.948 0.300 -7.483 1.00 . A A . 20 PHE O 1 1 9 3817 1 1 21 ALA C C 8.880 -1.722 -10.901 1.00 . A A . 21 ALA C 1 1 9 3818 1 1 21 ALA CA C 8.437 -1.508 -9.448 1.00 . A A . 21 ALA CA 1 1 9 3819 1 1 21 ALA CB C 7.608 -2.696 -8.975 1.00 . A A . 21 ALA CB 1 1 9 3820 1 1 21 ALA H H 6.855 -0.098 -9.736 1.00 . A A . 21 ALA H 1 1 9 3821 1 1 21 ALA HA H 9.332 -1.425 -8.867 1.00 . A A . 21 ALA HA 1 1 9 3822 1 1 21 ALA HB1 H 7.253 -2.521 -7.971 1.00 . A A . 21 ALA HB1 1 1 9 3823 1 1 21 ALA HB2 H 6.753 -2.830 -9.625 1.00 . A A . 21 ALA HB2 1 1 9 3824 1 1 21 ALA HB3 H 8.211 -3.588 -8.989 1.00 . A A . 21 ALA HB3 1 1 9 3825 1 1 21 ALA N N 7.633 -0.281 -9.175 1.00 . A A . 21 ALA N 1 1 9 3826 1 1 21 ALA O O 9.931 -2.283 -11.144 1.00 . A A . 21 ALA O 1 1 9 3827 1 1 22 GLU C C 9.492 -0.417 -13.616 1.00 . A A . 22 GLU C 1 1 9 3828 1 1 22 GLU CA C 8.389 -1.420 -13.274 1.00 . A A . 22 GLU CA 1 1 9 3829 1 1 22 GLU CB C 7.081 -1.143 -14.059 1.00 . A A . 22 GLU CB 1 1 9 3830 1 1 22 GLU CD C 7.468 0.685 -15.782 1.00 . A A . 22 GLU CD 1 1 9 3831 1 1 22 GLU CG C 7.352 -0.839 -15.553 1.00 . A A . 22 GLU CG 1 1 9 3832 1 1 22 GLU H H 7.250 -0.830 -11.577 1.00 . A A . 22 GLU H 1 1 9 3833 1 1 22 GLU HA H 8.739 -2.424 -13.454 1.00 . A A . 22 GLU HA 1 1 9 3834 1 1 22 GLU HB2 H 6.445 -2.014 -13.993 1.00 . A A . 22 GLU HB2 1 1 9 3835 1 1 22 GLU HB3 H 6.553 -0.315 -13.606 1.00 . A A . 22 GLU HB3 1 1 9 3836 1 1 22 GLU HG2 H 8.263 -1.323 -15.881 1.00 . A A . 22 GLU HG2 1 1 9 3837 1 1 22 GLU HG3 H 6.530 -1.215 -16.143 1.00 . A A . 22 GLU HG3 1 1 9 3838 1 1 22 GLU N N 8.076 -1.276 -11.825 1.00 . A A . 22 GLU N 1 1 9 3839 1 1 22 GLU O O 10.393 -0.688 -14.386 1.00 . A A . 22 GLU O 1 1 9 3840 1 1 22 GLU OE1 O 6.430 1.325 -15.725 1.00 . A A . 22 GLU OE1 1 1 9 3841 1 1 22 GLU OE2 O 8.585 1.125 -15.999 1.00 . A A . 22 GLU OE2 1 1 9 3842 1 1 23 ASP C C 11.460 1.768 -12.188 1.00 . A A . 23 ASP C 1 1 9 3843 1 1 23 ASP CA C 10.296 1.853 -13.175 1.00 . A A . 23 ASP CA 1 1 9 3844 1 1 23 ASP CB C 9.531 3.179 -12.964 1.00 . A A . 23 ASP CB 1 1 9 3845 1 1 23 ASP CG C 8.198 3.170 -13.733 1.00 . A A . 23 ASP CG 1 1 9 3846 1 1 23 ASP H H 8.589 0.827 -12.396 1.00 . A A . 23 ASP H 1 1 9 3847 1 1 23 ASP HA H 10.678 1.816 -14.177 1.00 . A A . 23 ASP HA 1 1 9 3848 1 1 23 ASP HB2 H 9.317 3.319 -11.913 1.00 . A A . 23 ASP HB2 1 1 9 3849 1 1 23 ASP HB3 H 10.133 4.007 -13.305 1.00 . A A . 23 ASP HB3 1 1 9 3850 1 1 23 ASP N N 9.350 0.722 -12.998 1.00 . A A . 23 ASP N 1 1 9 3851 1 1 23 ASP O O 12.615 1.701 -12.565 1.00 . A A . 23 ASP O 1 1 9 3852 1 1 23 ASP OD1 O 7.294 2.523 -13.229 1.00 . A A . 23 ASP OD1 1 1 9 3853 1 1 23 ASP OD2 O 8.150 3.801 -14.775 1.00 . A A . 23 ASP OD2 1 1 9 3854 1 1 24 VAL C C 12.588 0.301 -9.544 1.00 . A A . 24 VAL C 1 1 9 3855 1 1 24 VAL CA C 12.060 1.710 -9.812 1.00 . A A . 24 VAL CA 1 1 9 3856 1 1 24 VAL CB C 11.397 2.233 -8.518 1.00 . A A . 24 VAL CB 1 1 9 3857 1 1 24 VAL CG1 C 12.458 2.809 -7.565 1.00 . A A . 24 VAL CG1 1 1 9 3858 1 1 24 VAL CG2 C 10.315 3.290 -8.800 1.00 . A A . 24 VAL CG2 1 1 9 3859 1 1 24 VAL H H 10.124 1.829 -10.745 1.00 . A A . 24 VAL H 1 1 9 3860 1 1 24 VAL HA H 12.892 2.351 -10.041 1.00 . A A . 24 VAL HA 1 1 9 3861 1 1 24 VAL HB H 10.932 1.396 -8.039 1.00 . A A . 24 VAL HB 1 1 9 3862 1 1 24 VAL HG11 H 12.983 3.628 -8.034 1.00 . A A . 24 VAL HG11 1 1 9 3863 1 1 24 VAL HG12 H 11.985 3.165 -6.661 1.00 . A A . 24 VAL HG12 1 1 9 3864 1 1 24 VAL HG13 H 13.169 2.041 -7.300 1.00 . A A . 24 VAL HG13 1 1 9 3865 1 1 24 VAL HG21 H 10.702 4.075 -9.431 1.00 . A A . 24 VAL HG21 1 1 9 3866 1 1 24 VAL HG22 H 9.478 2.821 -9.296 1.00 . A A . 24 VAL HG22 1 1 9 3867 1 1 24 VAL HG23 H 9.965 3.718 -7.873 1.00 . A A . 24 VAL HG23 1 1 9 3868 1 1 24 VAL N N 11.082 1.777 -10.938 1.00 . A A . 24 VAL N 1 1 9 3869 1 1 24 VAL O O 13.783 0.076 -9.541 1.00 . A A . 24 VAL O 1 1 9 3870 1 1 25 GLY C C 12.605 -2.023 -7.610 1.00 . A A . 25 GLY C 1 1 9 3871 1 1 25 GLY CA C 12.052 -2.021 -9.038 1.00 . A A . 25 GLY CA 1 1 9 3872 1 1 25 GLY H H 10.725 -0.344 -9.351 1.00 . A A . 25 GLY H 1 1 9 3873 1 1 25 GLY HA2 H 11.182 -2.657 -9.087 1.00 . A A . 25 GLY HA2 1 1 9 3874 1 1 25 GLY HA3 H 12.806 -2.353 -9.736 1.00 . A A . 25 GLY HA3 1 1 9 3875 1 1 25 GLY N N 11.669 -0.605 -9.325 1.00 . A A . 25 GLY N 1 1 9 3876 1 1 25 GLY O O 13.586 -2.677 -7.318 1.00 . A A . 25 GLY O 1 1 9 3877 1 1 26 SER C C 12.451 -2.491 -4.630 1.00 . A A . 26 SER C 1 1 9 3878 1 1 26 SER CA C 12.319 -1.138 -5.331 1.00 . A A . 26 SER CA 1 1 9 3879 1 1 26 SER CB C 11.256 -0.292 -4.624 1.00 . A A . 26 SER CB 1 1 9 3880 1 1 26 SER H H 11.144 -0.781 -7.083 1.00 . A A . 26 SER H 1 1 9 3881 1 1 26 SER HA H 13.272 -0.635 -5.281 1.00 . A A . 26 SER HA 1 1 9 3882 1 1 26 SER HB2 H 10.312 -0.815 -4.571 1.00 . A A . 26 SER HB2 1 1 9 3883 1 1 26 SER HB3 H 11.575 0.009 -3.638 1.00 . A A . 26 SER HB3 1 1 9 3884 1 1 26 SER HG H 10.196 0.909 -5.732 1.00 . A A . 26 SER HG 1 1 9 3885 1 1 26 SER N N 11.932 -1.273 -6.771 1.00 . A A . 26 SER N 1 1 9 3886 1 1 26 SER O O 13.300 -2.672 -3.777 1.00 . A A . 26 SER O 1 1 9 3887 1 1 26 SER OG O 11.113 0.857 -5.449 1.00 . A A . 26 SER OG 1 1 9 3888 1 1 27 ASN C C 12.073 -5.791 -5.484 1.00 . A A . 27 ASN C 1 1 9 3889 1 1 27 ASN CA C 11.579 -4.771 -4.450 1.00 . A A . 27 ASN CA 1 1 9 3890 1 1 27 ASN CB C 10.138 -5.093 -4.015 1.00 . A A . 27 ASN CB 1 1 9 3891 1 1 27 ASN CG C 9.220 -5.199 -5.243 1.00 . A A . 27 ASN CG 1 1 9 3892 1 1 27 ASN H H 10.949 -3.147 -5.721 1.00 . A A . 27 ASN H 1 1 9 3893 1 1 27 ASN HA H 12.234 -4.812 -3.593 1.00 . A A . 27 ASN HA 1 1 9 3894 1 1 27 ASN HB2 H 10.115 -6.028 -3.474 1.00 . A A . 27 ASN HB2 1 1 9 3895 1 1 27 ASN HB3 H 9.765 -4.311 -3.369 1.00 . A A . 27 ASN HB3 1 1 9 3896 1 1 27 ASN HD21 H 8.900 -7.139 -4.980 1.00 . A A . 27 ASN HD21 1 1 9 3897 1 1 27 ASN HD22 H 8.112 -6.447 -6.315 1.00 . A A . 27 ASN HD22 1 1 9 3898 1 1 27 ASN N N 11.594 -3.392 -5.026 1.00 . A A . 27 ASN N 1 1 9 3899 1 1 27 ASN ND2 N 8.700 -6.358 -5.538 1.00 . A A . 27 ASN ND2 1 1 9 3900 1 1 27 ASN O O 12.536 -6.858 -5.133 1.00 . A A . 27 ASN O 1 1 9 3901 1 1 27 ASN OD1 O 8.971 -4.236 -5.940 1.00 . A A . 27 ASN OD1 1 1 9 3902 1 1 28 LYS C C 13.931 -6.374 -7.921 1.00 . A A . 28 LYS C 1 1 9 3903 1 1 28 LYS CA C 12.394 -6.308 -7.850 1.00 . A A . 28 LYS CA 1 1 9 3904 1 1 28 LYS CB C 11.831 -5.763 -9.186 1.00 . A A . 28 LYS CB 1 1 9 3905 1 1 28 LYS CD C 9.504 -6.723 -8.792 1.00 . A A . 28 LYS CD 1 1 9 3906 1 1 28 LYS CE C 7.999 -6.396 -8.760 1.00 . A A . 28 LYS CE 1 1 9 3907 1 1 28 LYS CG C 10.319 -5.436 -9.072 1.00 . A A . 28 LYS CG 1 1 9 3908 1 1 28 LYS H H 11.573 -4.537 -6.936 1.00 . A A . 28 LYS H 1 1 9 3909 1 1 28 LYS HA H 12.007 -7.302 -7.669 1.00 . A A . 28 LYS HA 1 1 9 3910 1 1 28 LYS HB2 H 12.365 -4.866 -9.462 1.00 . A A . 28 LYS HB2 1 1 9 3911 1 1 28 LYS HB3 H 11.984 -6.499 -9.962 1.00 . A A . 28 LYS HB3 1 1 9 3912 1 1 28 LYS HD2 H 9.699 -7.456 -9.561 1.00 . A A . 28 LYS HD2 1 1 9 3913 1 1 28 LYS HD3 H 9.792 -7.143 -7.838 1.00 . A A . 28 LYS HD3 1 1 9 3914 1 1 28 LYS HE2 H 7.443 -7.268 -8.451 1.00 . A A . 28 LYS HE2 1 1 9 3915 1 1 28 LYS HE3 H 7.798 -5.593 -8.067 1.00 . A A . 28 LYS HE3 1 1 9 3916 1 1 28 LYS HG2 H 10.154 -4.715 -8.285 1.00 . A A . 28 LYS HG2 1 1 9 3917 1 1 28 LYS HG3 H 9.991 -4.998 -10.003 1.00 . A A . 28 LYS HG3 1 1 9 3918 1 1 28 LYS HZ1 H 8.322 -6.015 -10.784 1.00 . A A . 28 LYS HZ1 1 1 9 3919 1 1 28 LYS HZ2 H 6.785 -6.644 -10.433 1.00 . A A . 28 LYS HZ2 1 1 9 3920 1 1 28 LYS HZ3 H 7.141 -5.024 -10.071 1.00 . A A . 28 LYS HZ3 1 1 9 3921 1 1 28 LYS N N 11.954 -5.416 -6.733 1.00 . A A . 28 LYS N 1 1 9 3922 1 1 28 LYS NZ N 7.527 -5.989 -10.114 1.00 . A A . 28 LYS NZ 1 1 9 3923 1 1 28 LYS O O 14.534 -5.327 -7.749 1.00 . A A . 28 LYS O 1 1 9 3924 1 1 28 LYS OXT O 14.416 -7.471 -8.141 1.00 . A A . 28 LYS OXT 1 1 10 3925 1 1 1 ASP C C -24.776 -5.891 -13.345 1.00 . A A . 1 ASP C 1 1 10 3926 1 1 1 ASP CA C -26.252 -5.628 -13.014 1.00 . A A . 1 ASP CA 1 1 10 3927 1 1 1 ASP CB C -26.346 -4.813 -11.692 1.00 . A A . 1 ASP CB 1 1 10 3928 1 1 1 ASP CG C -25.384 -3.603 -11.721 1.00 . A A . 1 ASP CG 1 1 10 3929 1 1 1 ASP H1 H -26.336 -7.710 -13.027 1.00 . A A . 1 ASP H1 1 1 10 3930 1 1 1 ASP H2 H -27.389 -6.982 -11.912 1.00 . A A . 1 ASP H2 1 1 10 3931 1 1 1 ASP H3 H -27.757 -6.955 -13.569 1.00 . A A . 1 ASP H3 1 1 10 3932 1 1 1 ASP HA H -26.699 -5.069 -13.824 1.00 . A A . 1 ASP HA 1 1 10 3933 1 1 1 ASP HB2 H -27.356 -4.453 -11.557 1.00 . A A . 1 ASP HB2 1 1 10 3934 1 1 1 ASP HB3 H -26.095 -5.445 -10.852 1.00 . A A . 1 ASP HB3 1 1 10 3935 1 1 1 ASP N N -26.988 -6.916 -12.870 1.00 . A A . 1 ASP N 1 1 10 3936 1 1 1 ASP O O -24.249 -6.959 -13.099 1.00 . A A . 1 ASP O 1 1 10 3937 1 1 1 ASP OD1 O -25.782 -2.601 -12.291 1.00 . A A . 1 ASP OD1 1 1 10 3938 1 1 1 ASP OD2 O -24.301 -3.752 -11.175 1.00 . A A . 1 ASP OD2 1 1 10 3939 1 1 2 ALA C C -22.190 -3.505 -14.113 1.00 . A A . 2 ALA C 1 1 10 3940 1 1 2 ALA CA C -22.740 -4.914 -14.298 1.00 . A A . 2 ALA CA 1 1 10 3941 1 1 2 ALA CB C -22.593 -5.320 -15.777 1.00 . A A . 2 ALA CB 1 1 10 3942 1 1 2 ALA H H -24.670 -4.049 -14.065 1.00 . A A . 2 ALA H 1 1 10 3943 1 1 2 ALA HA H -22.199 -5.588 -13.649 1.00 . A A . 2 ALA HA 1 1 10 3944 1 1 2 ALA HB1 H -23.446 -5.894 -16.104 1.00 . A A . 2 ALA HB1 1 1 10 3945 1 1 2 ALA HB2 H -22.503 -4.444 -16.406 1.00 . A A . 2 ALA HB2 1 1 10 3946 1 1 2 ALA HB3 H -21.699 -5.912 -15.901 1.00 . A A . 2 ALA HB3 1 1 10 3947 1 1 2 ALA N N -24.171 -4.874 -13.901 1.00 . A A . 2 ALA N 1 1 10 3948 1 1 2 ALA O O -22.893 -2.586 -13.735 1.00 . A A . 2 ALA O 1 1 10 3949 1 1 3 GLU C C -20.227 -1.475 -15.666 1.00 . A A . 3 GLU C 1 1 10 3950 1 1 3 GLU CA C -20.224 -2.098 -14.278 1.00 . A A . 3 GLU CA 1 1 10 3951 1 1 3 GLU CB C -18.796 -2.371 -13.747 1.00 . A A . 3 GLU CB 1 1 10 3952 1 1 3 GLU CD C -20.029 -3.109 -11.623 1.00 . A A . 3 GLU CD 1 1 10 3953 1 1 3 GLU CG C -18.812 -2.336 -12.190 1.00 . A A . 3 GLU CG 1 1 10 3954 1 1 3 GLU H H -20.438 -4.196 -14.693 1.00 . A A . 3 GLU H 1 1 10 3955 1 1 3 GLU HA H -20.762 -1.452 -13.607 1.00 . A A . 3 GLU HA 1 1 10 3956 1 1 3 GLU HB2 H -18.449 -3.336 -14.086 1.00 . A A . 3 GLU HB2 1 1 10 3957 1 1 3 GLU HB3 H -18.116 -1.614 -14.109 1.00 . A A . 3 GLU HB3 1 1 10 3958 1 1 3 GLU HG2 H -17.905 -2.782 -11.806 1.00 . A A . 3 GLU HG2 1 1 10 3959 1 1 3 GLU HG3 H -18.853 -1.309 -11.855 1.00 . A A . 3 GLU HG3 1 1 10 3960 1 1 3 GLU N N -20.923 -3.401 -14.398 1.00 . A A . 3 GLU N 1 1 10 3961 1 1 3 GLU O O -19.391 -1.767 -16.501 1.00 . A A . 3 GLU O 1 1 10 3962 1 1 3 GLU OE1 O -19.959 -4.327 -11.653 1.00 . A A . 3 GLU OE1 1 1 10 3963 1 1 3 GLU OE2 O -20.958 -2.441 -11.199 1.00 . A A . 3 GLU OE2 1 1 10 3964 1 1 4 PHE C C -20.506 1.350 -17.122 1.00 . A A . 4 PHE C 1 1 10 3965 1 1 4 PHE CA C -21.398 0.101 -17.140 1.00 . A A . 4 PHE CA 1 1 10 3966 1 1 4 PHE CB C -22.898 0.491 -17.284 1.00 . A A . 4 PHE CB 1 1 10 3967 1 1 4 PHE CD1 C -23.841 -1.872 -17.178 1.00 . A A . 4 PHE CD1 1 1 10 3968 1 1 4 PHE CD2 C -24.680 -0.255 -15.641 1.00 . A A . 4 PHE CD2 1 1 10 3969 1 1 4 PHE CE1 C -24.685 -2.820 -16.636 1.00 . A A . 4 PHE CE1 1 1 10 3970 1 1 4 PHE CE2 C -25.522 -1.203 -15.102 1.00 . A A . 4 PHE CE2 1 1 10 3971 1 1 4 PHE CG C -23.831 -0.579 -16.685 1.00 . A A . 4 PHE CG 1 1 10 3972 1 1 4 PHE CZ C -25.525 -2.486 -15.598 1.00 . A A . 4 PHE CZ 1 1 10 3973 1 1 4 PHE H H -21.836 -0.465 -15.116 1.00 . A A . 4 PHE H 1 1 10 3974 1 1 4 PHE HA H -21.089 -0.530 -17.957 1.00 . A A . 4 PHE HA 1 1 10 3975 1 1 4 PHE HB2 H -23.086 1.426 -16.778 1.00 . A A . 4 PHE HB2 1 1 10 3976 1 1 4 PHE HB3 H -23.141 0.613 -18.329 1.00 . A A . 4 PHE HB3 1 1 10 3977 1 1 4 PHE HD1 H -23.185 -2.144 -17.993 1.00 . A A . 4 PHE HD1 1 1 10 3978 1 1 4 PHE HD2 H -24.685 0.750 -15.242 1.00 . A A . 4 PHE HD2 1 1 10 3979 1 1 4 PHE HE1 H -24.687 -3.827 -17.028 1.00 . A A . 4 PHE HE1 1 1 10 3980 1 1 4 PHE HE2 H -26.181 -0.938 -14.289 1.00 . A A . 4 PHE HE2 1 1 10 3981 1 1 4 PHE HZ H -26.185 -3.227 -15.174 1.00 . A A . 4 PHE HZ 1 1 10 3982 1 1 4 PHE N N -21.207 -0.626 -15.848 1.00 . A A . 4 PHE N 1 1 10 3983 1 1 4 PHE O O -20.950 2.450 -17.381 1.00 . A A . 4 PHE O 1 1 10 3984 1 1 5 ARG C C -18.621 3.440 -15.967 1.00 . A A . 5 ARG C 1 1 10 3985 1 1 5 ARG CA C -18.195 2.162 -16.719 1.00 . A A . 5 ARG CA 1 1 10 3986 1 1 5 ARG CB C -17.718 2.507 -18.177 1.00 . A A . 5 ARG CB 1 1 10 3987 1 1 5 ARG CD C -18.095 3.953 -20.224 1.00 . A A . 5 ARG CD 1 1 10 3988 1 1 5 ARG CG C -18.771 3.288 -19.008 1.00 . A A . 5 ARG CG 1 1 10 3989 1 1 5 ARG CZ C -16.769 2.247 -21.414 1.00 . A A . 5 ARG CZ 1 1 10 3990 1 1 5 ARG H H -19.014 0.177 -16.620 1.00 . A A . 5 ARG H 1 1 10 3991 1 1 5 ARG HA H -17.377 1.734 -16.164 1.00 . A A . 5 ARG HA 1 1 10 3992 1 1 5 ARG HB2 H -16.809 3.086 -18.108 1.00 . A A . 5 ARG HB2 1 1 10 3993 1 1 5 ARG HB3 H -17.485 1.584 -18.687 1.00 . A A . 5 ARG HB3 1 1 10 3994 1 1 5 ARG HD2 H -18.746 4.719 -20.621 1.00 . A A . 5 ARG HD2 1 1 10 3995 1 1 5 ARG HD3 H -17.152 4.410 -19.961 1.00 . A A . 5 ARG HD3 1 1 10 3996 1 1 5 ARG HE H -18.620 2.734 -21.913 1.00 . A A . 5 ARG HE 1 1 10 3997 1 1 5 ARG HG2 H -19.531 2.608 -19.364 1.00 . A A . 5 ARG HG2 1 1 10 3998 1 1 5 ARG HG3 H -19.245 4.053 -18.410 1.00 . A A . 5 ARG HG3 1 1 10 3999 1 1 5 ARG HH11 H -15.830 3.126 -19.872 1.00 . A A . 5 ARG HH11 1 1 10 4000 1 1 5 ARG HH12 H -14.919 1.928 -20.724 1.00 . A A . 5 ARG HH12 1 1 10 4001 1 1 5 ARG HH21 H -17.474 1.224 -22.983 1.00 . A A . 5 ARG HH21 1 1 10 4002 1 1 5 ARG HH22 H -15.856 0.836 -22.501 1.00 . A A . 5 ARG HH22 1 1 10 4003 1 1 5 ARG N N -19.260 1.108 -16.807 1.00 . A A . 5 ARG N 1 1 10 4004 1 1 5 ARG NE N -17.889 2.917 -21.288 1.00 . A A . 5 ARG NE 1 1 10 4005 1 1 5 ARG NH1 N -15.763 2.451 -20.606 1.00 . A A . 5 ARG NH1 1 1 10 4006 1 1 5 ARG NH2 N -16.694 1.368 -22.374 1.00 . A A . 5 ARG NH2 1 1 10 4007 1 1 5 ARG O O -18.073 4.506 -16.169 1.00 . A A . 5 ARG O 1 1 10 4008 1 1 6 HIS C C -21.180 3.856 -13.258 1.00 . A A . 6 HIS C 1 1 10 4009 1 1 6 HIS CA C -20.151 4.376 -14.281 1.00 . A A . 6 HIS CA 1 1 10 4010 1 1 6 HIS CB C -20.830 5.447 -15.198 1.00 . A A . 6 HIS CB 1 1 10 4011 1 1 6 HIS CD2 C -23.078 4.118 -15.748 1.00 . A A . 6 HIS CD2 1 1 10 4012 1 1 6 HIS CE1 C -23.082 4.407 -17.801 1.00 . A A . 6 HIS CE1 1 1 10 4013 1 1 6 HIS CG C -21.953 4.865 -16.069 1.00 . A A . 6 HIS CG 1 1 10 4014 1 1 6 HIS H H -19.966 2.359 -15.027 1.00 . A A . 6 HIS H 1 1 10 4015 1 1 6 HIS HA H -19.335 4.824 -13.737 1.00 . A A . 6 HIS HA 1 1 10 4016 1 1 6 HIS HB2 H -21.251 6.232 -14.587 1.00 . A A . 6 HIS HB2 1 1 10 4017 1 1 6 HIS HB3 H -20.094 5.896 -15.848 1.00 . A A . 6 HIS HB3 1 1 10 4018 1 1 6 HIS HD1 H -21.374 5.487 -17.902 1.00 . A A . 6 HIS HD1 1 1 10 4019 1 1 6 HIS HD2 H -23.354 3.803 -14.753 1.00 . A A . 6 HIS HD2 1 1 10 4020 1 1 6 HIS HE1 H -23.366 4.379 -18.843 1.00 . A A . 6 HIS HE1 1 1 10 4021 1 1 6 HIS N N -19.597 3.261 -15.114 1.00 . A A . 6 HIS N 1 1 10 4022 1 1 6 HIS ND1 N -22.025 5.004 -17.352 1.00 . A A . 6 HIS ND1 1 1 10 4023 1 1 6 HIS NE2 N -23.766 3.844 -16.838 1.00 . A A . 6 HIS NE2 1 1 10 4024 1 1 6 HIS O O -21.853 4.634 -12.610 1.00 . A A . 6 HIS O 1 1 10 4025 1 1 7 ASP C C -21.695 1.883 -10.744 1.00 . A A . 7 ASP C 1 1 10 4026 1 1 7 ASP CA C -22.222 1.908 -12.188 1.00 . A A . 7 ASP CA 1 1 10 4027 1 1 7 ASP CB C -22.485 0.483 -12.701 1.00 . A A . 7 ASP CB 1 1 10 4028 1 1 7 ASP CG C -23.731 -0.133 -12.043 1.00 . A A . 7 ASP CG 1 1 10 4029 1 1 7 ASP H H -20.697 1.980 -13.691 1.00 . A A . 7 ASP H 1 1 10 4030 1 1 7 ASP HA H -23.119 2.492 -12.189 1.00 . A A . 7 ASP HA 1 1 10 4031 1 1 7 ASP HB2 H -22.626 0.493 -13.772 1.00 . A A . 7 ASP HB2 1 1 10 4032 1 1 7 ASP HB3 H -21.625 -0.124 -12.466 1.00 . A A . 7 ASP HB3 1 1 10 4033 1 1 7 ASP N N -21.266 2.552 -13.142 1.00 . A A . 7 ASP N 1 1 10 4034 1 1 7 ASP O O -22.130 1.087 -9.933 1.00 . A A . 7 ASP O 1 1 10 4035 1 1 7 ASP OD1 O -24.813 0.293 -12.408 1.00 . A A . 7 ASP OD1 1 1 10 4036 1 1 7 ASP OD2 O -23.528 -1.000 -11.209 1.00 . A A . 7 ASP OD2 1 1 10 4037 1 1 8 SER C C -19.700 1.591 -8.483 1.00 . A A . 8 SER C 1 1 10 4038 1 1 8 SER CA C -20.118 2.926 -9.142 1.00 . A A . 8 SER CA 1 1 10 4039 1 1 8 SER CB C -21.095 3.709 -8.214 1.00 . A A . 8 SER CB 1 1 10 4040 1 1 8 SER H H -20.505 3.369 -11.213 1.00 . A A . 8 SER H 1 1 10 4041 1 1 8 SER HA H -19.225 3.519 -9.276 1.00 . A A . 8 SER HA 1 1 10 4042 1 1 8 SER HB2 H -20.602 4.025 -7.305 1.00 . A A . 8 SER HB2 1 1 10 4043 1 1 8 SER HB3 H -21.510 4.568 -8.720 1.00 . A A . 8 SER HB3 1 1 10 4044 1 1 8 SER HG H -22.134 2.666 -6.941 1.00 . A A . 8 SER HG 1 1 10 4045 1 1 8 SER N N -20.772 2.774 -10.484 1.00 . A A . 8 SER N 1 1 10 4046 1 1 8 SER O O -19.502 1.529 -7.284 1.00 . A A . 8 SER O 1 1 10 4047 1 1 8 SER OG O -22.144 2.806 -7.890 1.00 . A A . 8 SER OG 1 1 10 4048 1 1 9 GLY C C -17.782 -0.741 -8.159 1.00 . A A . 9 GLY C 1 1 10 4049 1 1 9 GLY CA C -19.179 -0.780 -8.775 1.00 . A A . 9 GLY CA 1 1 10 4050 1 1 9 GLY H H -19.758 0.687 -10.249 1.00 . A A . 9 GLY H 1 1 10 4051 1 1 9 GLY HA2 H -19.888 -1.103 -8.027 1.00 . A A . 9 GLY HA2 1 1 10 4052 1 1 9 GLY HA3 H -19.172 -1.487 -9.588 1.00 . A A . 9 GLY HA3 1 1 10 4053 1 1 9 GLY N N -19.578 0.565 -9.291 1.00 . A A . 9 GLY N 1 1 10 4054 1 1 9 GLY O O -17.630 -0.937 -6.968 1.00 . A A . 9 GLY O 1 1 10 4055 1 1 10 TYR C C -14.485 0.326 -9.485 1.00 . A A . 10 TYR C 1 1 10 4056 1 1 10 TYR CA C -15.397 -0.420 -8.507 1.00 . A A . 10 TYR CA 1 1 10 4057 1 1 10 TYR CB C -14.868 -1.860 -8.296 1.00 . A A . 10 TYR CB 1 1 10 4058 1 1 10 TYR CD1 C -14.566 -1.980 -5.788 1.00 . A A . 10 TYR CD1 1 1 10 4059 1 1 10 TYR CD2 C -12.617 -1.759 -7.137 1.00 . A A . 10 TYR CD2 1 1 10 4060 1 1 10 TYR CE1 C -13.783 -1.979 -4.654 1.00 . A A . 10 TYR CE1 1 1 10 4061 1 1 10 TYR CE2 C -11.834 -1.758 -6.002 1.00 . A A . 10 TYR CE2 1 1 10 4062 1 1 10 TYR CG C -13.989 -1.869 -7.039 1.00 . A A . 10 TYR CG 1 1 10 4063 1 1 10 TYR CZ C -12.411 -1.868 -4.754 1.00 . A A . 10 TYR CZ 1 1 10 4064 1 1 10 TYR H H -16.994 -0.333 -9.939 1.00 . A A . 10 TYR H 1 1 10 4065 1 1 10 TYR HA H -15.402 0.130 -7.580 1.00 . A A . 10 TYR HA 1 1 10 4066 1 1 10 TYR HB2 H -15.684 -2.554 -8.154 1.00 . A A . 10 TYR HB2 1 1 10 4067 1 1 10 TYR HB3 H -14.280 -2.188 -9.143 1.00 . A A . 10 TYR HB3 1 1 10 4068 1 1 10 TYR HD1 H -15.638 -2.068 -5.694 1.00 . A A . 10 TYR HD1 1 1 10 4069 1 1 10 TYR HD2 H -12.150 -1.672 -8.107 1.00 . A A . 10 TYR HD2 1 1 10 4070 1 1 10 TYR HE1 H -14.253 -2.066 -3.686 1.00 . A A . 10 TYR HE1 1 1 10 4071 1 1 10 TYR HE2 H -10.763 -1.670 -6.096 1.00 . A A . 10 TYR HE2 1 1 10 4072 1 1 10 TYR HH H -11.439 -2.780 -3.388 1.00 . A A . 10 TYR HH 1 1 10 4073 1 1 10 TYR N N -16.805 -0.485 -8.992 1.00 . A A . 10 TYR N 1 1 10 4074 1 1 10 TYR O O -14.839 0.567 -10.624 1.00 . A A . 10 TYR O 1 1 10 4075 1 1 10 TYR OH O -11.626 -1.867 -3.619 1.00 . A A . 10 TYR OH 1 1 10 4076 1 1 11 GLU C C -11.078 1.469 -8.833 1.00 . A A . 11 GLU C 1 1 10 4077 1 1 11 GLU CA C -12.286 1.396 -9.753 1.00 . A A . 11 GLU CA 1 1 10 4078 1 1 11 GLU CB C -12.778 2.825 -10.099 1.00 . A A . 11 GLU CB 1 1 10 4079 1 1 11 GLU CD C -11.108 4.721 -9.857 1.00 . A A . 11 GLU CD 1 1 10 4080 1 1 11 GLU CG C -11.648 3.630 -10.803 1.00 . A A . 11 GLU CG 1 1 10 4081 1 1 11 GLU H H -13.118 0.422 -8.050 1.00 . A A . 11 GLU H 1 1 10 4082 1 1 11 GLU HA H -12.013 0.833 -10.637 1.00 . A A . 11 GLU HA 1 1 10 4083 1 1 11 GLU HB2 H -13.626 2.763 -10.764 1.00 . A A . 11 GLU HB2 1 1 10 4084 1 1 11 GLU HB3 H -13.096 3.327 -9.195 1.00 . A A . 11 GLU HB3 1 1 10 4085 1 1 11 GLU HG2 H -10.830 2.986 -11.094 1.00 . A A . 11 GLU HG2 1 1 10 4086 1 1 11 GLU HG3 H -12.041 4.096 -11.695 1.00 . A A . 11 GLU HG3 1 1 10 4087 1 1 11 GLU N N -13.326 0.662 -8.978 1.00 . A A . 11 GLU N 1 1 10 4088 1 1 11 GLU O O -11.176 1.906 -7.701 1.00 . A A . 11 GLU O 1 1 10 4089 1 1 11 GLU OE1 O -10.335 4.362 -8.984 1.00 . A A . 11 GLU OE1 1 1 10 4090 1 1 11 GLU OE2 O -11.500 5.859 -10.060 1.00 . A A . 11 GLU OE2 1 1 10 4091 1 1 12 VAL C C -7.933 2.289 -9.007 1.00 . A A . 12 VAL C 1 1 10 4092 1 1 12 VAL CA C -8.706 1.030 -8.609 1.00 . A A . 12 VAL CA 1 1 10 4093 1 1 12 VAL CB C -7.966 -0.268 -8.969 1.00 . A A . 12 VAL CB 1 1 10 4094 1 1 12 VAL CG1 C -6.520 -0.263 -8.423 1.00 . A A . 12 VAL CG1 1 1 10 4095 1 1 12 VAL CG2 C -8.736 -1.469 -8.370 1.00 . A A . 12 VAL CG2 1 1 10 4096 1 1 12 VAL H H -9.976 0.690 -10.281 1.00 . A A . 12 VAL H 1 1 10 4097 1 1 12 VAL HA H -8.927 1.042 -7.568 1.00 . A A . 12 VAL HA 1 1 10 4098 1 1 12 VAL HB H -7.971 -0.344 -10.039 1.00 . A A . 12 VAL HB 1 1 10 4099 1 1 12 VAL HG11 H -6.501 0.112 -7.411 1.00 . A A . 12 VAL HG11 1 1 10 4100 1 1 12 VAL HG12 H -6.116 -1.264 -8.428 1.00 . A A . 12 VAL HG12 1 1 10 4101 1 1 12 VAL HG13 H -5.893 0.360 -9.042 1.00 . A A . 12 VAL HG13 1 1 10 4102 1 1 12 VAL HG21 H -9.755 -1.478 -8.730 1.00 . A A . 12 VAL HG21 1 1 10 4103 1 1 12 VAL HG22 H -8.263 -2.395 -8.659 1.00 . A A . 12 VAL HG22 1 1 10 4104 1 1 12 VAL HG23 H -8.751 -1.407 -7.292 1.00 . A A . 12 VAL HG23 1 1 10 4105 1 1 12 VAL N N -9.975 1.029 -9.367 1.00 . A A . 12 VAL N 1 1 10 4106 1 1 12 VAL O O -7.708 3.166 -8.198 1.00 . A A . 12 VAL O 1 1 10 4107 1 1 13 HIS C C -5.489 3.798 -10.103 1.00 . A A . 13 HIS C 1 1 10 4108 1 1 13 HIS CA C -6.795 3.462 -10.860 1.00 . A A . 13 HIS CA 1 1 10 4109 1 1 13 HIS CB C -7.732 4.699 -10.892 1.00 . A A . 13 HIS CB 1 1 10 4110 1 1 13 HIS CD2 C -8.288 5.944 -13.157 1.00 . A A . 13 HIS CD2 1 1 10 4111 1 1 13 HIS CE1 C -6.433 6.801 -13.510 1.00 . A A . 13 HIS CE1 1 1 10 4112 1 1 13 HIS CG C -7.450 5.573 -12.120 1.00 . A A . 13 HIS CG 1 1 10 4113 1 1 13 HIS H H -7.812 1.553 -10.823 1.00 . A A . 13 HIS H 1 1 10 4114 1 1 13 HIS HA H -6.530 3.185 -11.871 1.00 . A A . 13 HIS HA 1 1 10 4115 1 1 13 HIS HB2 H -8.754 4.366 -10.959 1.00 . A A . 13 HIS HB2 1 1 10 4116 1 1 13 HIS HB3 H -7.619 5.301 -10.001 1.00 . A A . 13 HIS HB3 1 1 10 4117 1 1 13 HIS HD1 H -5.507 6.075 -11.867 1.00 . A A . 13 HIS HD1 1 1 10 4118 1 1 13 HIS HD2 H -9.323 5.653 -13.251 1.00 . A A . 13 HIS HD2 1 1 10 4119 1 1 13 HIS HE1 H -5.629 7.362 -13.963 1.00 . A A . 13 HIS HE1 1 1 10 4120 1 1 13 HIS N N -7.564 2.317 -10.263 1.00 . A A . 13 HIS N 1 1 10 4121 1 1 13 HIS ND1 N -6.322 6.138 -12.405 1.00 . A A . 13 HIS ND1 1 1 10 4122 1 1 13 HIS NE2 N -7.639 6.709 -14.014 1.00 . A A . 13 HIS NE2 1 1 10 4123 1 1 13 HIS O O -4.831 4.772 -10.414 1.00 . A A . 13 HIS O 1 1 10 4124 1 1 14 HIS C C -2.685 2.753 -9.136 1.00 . A A . 14 HIS C 1 1 10 4125 1 1 14 HIS CA C -3.908 3.211 -8.337 1.00 . A A . 14 HIS CA 1 1 10 4126 1 1 14 HIS CB C -4.037 2.427 -7.004 1.00 . A A . 14 HIS CB 1 1 10 4127 1 1 14 HIS CD2 C -5.795 4.139 -5.989 1.00 . A A . 14 HIS CD2 1 1 10 4128 1 1 14 HIS CE1 C -7.135 2.763 -5.208 1.00 . A A . 14 HIS CE1 1 1 10 4129 1 1 14 HIS CG C -5.307 2.873 -6.268 1.00 . A A . 14 HIS CG 1 1 10 4130 1 1 14 HIS H H -5.705 2.215 -8.920 1.00 . A A . 14 HIS H 1 1 10 4131 1 1 14 HIS HA H -3.815 4.263 -8.136 1.00 . A A . 14 HIS HA 1 1 10 4132 1 1 14 HIS HB2 H -4.108 1.364 -7.186 1.00 . A A . 14 HIS HB2 1 1 10 4133 1 1 14 HIS HB3 H -3.184 2.620 -6.370 1.00 . A A . 14 HIS HB3 1 1 10 4134 1 1 14 HIS HD1 H -6.138 1.097 -5.778 1.00 . A A . 14 HIS HD1 1 1 10 4135 1 1 14 HIS HD2 H -5.315 5.064 -6.271 1.00 . A A . 14 HIS HD2 1 1 10 4136 1 1 14 HIS HE1 H -7.990 2.327 -4.712 1.00 . A A . 14 HIS HE1 1 1 10 4137 1 1 14 HIS N N -5.146 2.984 -9.134 1.00 . A A . 14 HIS N 1 1 10 4138 1 1 14 HIS ND1 N -6.185 2.075 -5.756 1.00 . A A . 14 HIS ND1 1 1 10 4139 1 1 14 HIS NE2 N -6.934 4.052 -5.330 1.00 . A A . 14 HIS NE2 1 1 10 4140 1 1 14 HIS O O -2.043 3.568 -9.772 1.00 . A A . 14 HIS O 1 1 10 4141 1 1 15 GLN C C 0.078 1.637 -9.566 1.00 . A A . 15 GLN C 1 1 10 4142 1 1 15 GLN CA C -1.234 0.883 -9.820 1.00 . A A . 15 GLN CA 1 1 10 4143 1 1 15 GLN CB C -1.581 0.877 -11.332 1.00 . A A . 15 GLN CB 1 1 10 4144 1 1 15 GLN CD C -1.543 -1.587 -11.794 1.00 . A A . 15 GLN CD 1 1 10 4145 1 1 15 GLN CG C -2.446 -0.356 -11.647 1.00 . A A . 15 GLN CG 1 1 10 4146 1 1 15 GLN H H -2.970 0.879 -8.555 1.00 . A A . 15 GLN H 1 1 10 4147 1 1 15 GLN HA H -1.092 -0.116 -9.445 1.00 . A A . 15 GLN HA 1 1 10 4148 1 1 15 GLN HB2 H -2.137 1.769 -11.582 1.00 . A A . 15 GLN HB2 1 1 10 4149 1 1 15 GLN HB3 H -0.685 0.861 -11.934 1.00 . A A . 15 GLN HB3 1 1 10 4150 1 1 15 GLN HE21 H -0.871 -1.037 -13.580 1.00 . A A . 15 GLN HE21 1 1 10 4151 1 1 15 GLN HE22 H -0.244 -2.500 -12.987 1.00 . A A . 15 GLN HE22 1 1 10 4152 1 1 15 GLN HG2 H -3.158 -0.533 -10.853 1.00 . A A . 15 GLN HG2 1 1 10 4153 1 1 15 GLN HG3 H -2.983 -0.203 -12.570 1.00 . A A . 15 GLN HG3 1 1 10 4154 1 1 15 GLN N N -2.402 1.472 -9.086 1.00 . A A . 15 GLN N 1 1 10 4155 1 1 15 GLN NE2 N -0.826 -1.719 -12.877 1.00 . A A . 15 GLN NE2 1 1 10 4156 1 1 15 GLN O O 1.018 1.569 -10.332 1.00 . A A . 15 GLN O 1 1 10 4157 1 1 15 GLN OE1 O -1.481 -2.436 -10.927 1.00 . A A . 15 GLN OE1 1 1 10 4158 1 1 16 PHE C C 2.486 2.182 -7.786 1.00 . A A . 16 PHE C 1 1 10 4159 1 1 16 PHE CA C 1.320 3.125 -8.092 1.00 . A A . 16 PHE CA 1 1 10 4160 1 1 16 PHE CB C 0.987 3.982 -6.856 1.00 . A A . 16 PHE CB 1 1 10 4161 1 1 16 PHE CD1 C 3.131 5.317 -6.599 1.00 . A A . 16 PHE CD1 1 1 10 4162 1 1 16 PHE CD2 C 2.597 3.729 -4.902 1.00 . A A . 16 PHE CD2 1 1 10 4163 1 1 16 PHE CE1 C 4.290 5.647 -5.928 1.00 . A A . 16 PHE CE1 1 1 10 4164 1 1 16 PHE CE2 C 3.757 4.059 -4.230 1.00 . A A . 16 PHE CE2 1 1 10 4165 1 1 16 PHE CG C 2.276 4.357 -6.093 1.00 . A A . 16 PHE CG 1 1 10 4166 1 1 16 PHE CZ C 4.604 5.018 -4.743 1.00 . A A . 16 PHE CZ 1 1 10 4167 1 1 16 PHE H H -0.690 2.328 -7.896 1.00 . A A . 16 PHE H 1 1 10 4168 1 1 16 PHE HA H 1.589 3.761 -8.920 1.00 . A A . 16 PHE HA 1 1 10 4169 1 1 16 PHE HB2 H 0.490 4.885 -7.174 1.00 . A A . 16 PHE HB2 1 1 10 4170 1 1 16 PHE HB3 H 0.335 3.426 -6.199 1.00 . A A . 16 PHE HB3 1 1 10 4171 1 1 16 PHE HD1 H 2.890 5.812 -7.528 1.00 . A A . 16 PHE HD1 1 1 10 4172 1 1 16 PHE HD2 H 1.938 2.975 -4.492 1.00 . A A . 16 PHE HD2 1 1 10 4173 1 1 16 PHE HE1 H 4.953 6.399 -6.332 1.00 . A A . 16 PHE HE1 1 1 10 4174 1 1 16 PHE HE2 H 4.001 3.565 -3.301 1.00 . A A . 16 PHE HE2 1 1 10 4175 1 1 16 PHE HZ H 5.512 5.276 -4.217 1.00 . A A . 16 PHE HZ 1 1 10 4176 1 1 16 PHE N N 0.105 2.337 -8.468 1.00 . A A . 16 PHE N 1 1 10 4177 1 1 16 PHE O O 3.627 2.485 -8.068 1.00 . A A . 16 PHE O 1 1 10 4178 1 1 17 LEU C C 3.813 -0.450 -8.103 1.00 . A A . 17 LEU C 1 1 10 4179 1 1 17 LEU CA C 3.120 0.021 -6.839 1.00 . A A . 17 LEU CA 1 1 10 4180 1 1 17 LEU CB C 2.368 -1.126 -6.153 1.00 . A A . 17 LEU CB 1 1 10 4181 1 1 17 LEU CD1 C 0.090 -0.473 -5.192 1.00 . A A . 17 LEU CD1 1 1 10 4182 1 1 17 LEU CD2 C 1.840 -1.494 -3.696 1.00 . A A . 17 LEU CD2 1 1 10 4183 1 1 17 LEU CG C 1.609 -0.566 -4.902 1.00 . A A . 17 LEU CG 1 1 10 4184 1 1 17 LEU H H 1.187 0.898 -7.046 1.00 . A A . 17 LEU H 1 1 10 4185 1 1 17 LEU HA H 3.848 0.460 -6.178 1.00 . A A . 17 LEU HA 1 1 10 4186 1 1 17 LEU HB2 H 1.672 -1.564 -6.855 1.00 . A A . 17 LEU HB2 1 1 10 4187 1 1 17 LEU HB3 H 3.080 -1.884 -5.863 1.00 . A A . 17 LEU HB3 1 1 10 4188 1 1 17 LEU HD11 H -0.302 -1.440 -5.471 1.00 . A A . 17 LEU HD11 1 1 10 4189 1 1 17 LEU HD12 H -0.433 -0.127 -4.313 1.00 . A A . 17 LEU HD12 1 1 10 4190 1 1 17 LEU HD13 H -0.105 0.223 -5.995 1.00 . A A . 17 LEU HD13 1 1 10 4191 1 1 17 LEU HD21 H 1.482 -2.490 -3.914 1.00 . A A . 17 LEU HD21 1 1 10 4192 1 1 17 LEU HD22 H 2.893 -1.543 -3.466 1.00 . A A . 17 LEU HD22 1 1 10 4193 1 1 17 LEU HD23 H 1.315 -1.114 -2.831 1.00 . A A . 17 LEU HD23 1 1 10 4194 1 1 17 LEU HG H 1.975 0.419 -4.649 1.00 . A A . 17 LEU HG 1 1 10 4195 1 1 17 LEU N N 2.131 1.063 -7.219 1.00 . A A . 17 LEU N 1 1 10 4196 1 1 17 LEU O O 4.999 -0.716 -8.111 1.00 . A A . 17 LEU O 1 1 10 4197 1 1 18 VAL C C 4.390 0.183 -10.992 1.00 . A A . 18 VAL C 1 1 10 4198 1 1 18 VAL CA C 3.557 -0.970 -10.451 1.00 . A A . 18 VAL CA 1 1 10 4199 1 1 18 VAL CB C 2.369 -1.321 -11.378 1.00 . A A . 18 VAL CB 1 1 10 4200 1 1 18 VAL CG1 C 2.853 -1.536 -12.830 1.00 . A A . 18 VAL CG1 1 1 10 4201 1 1 18 VAL CG2 C 1.778 -2.638 -10.849 1.00 . A A . 18 VAL CG2 1 1 10 4202 1 1 18 VAL H H 2.074 -0.292 -9.047 1.00 . A A . 18 VAL H 1 1 10 4203 1 1 18 VAL HA H 4.192 -1.814 -10.271 1.00 . A A . 18 VAL HA 1 1 10 4204 1 1 18 VAL HB H 1.619 -0.545 -11.352 1.00 . A A . 18 VAL HB 1 1 10 4205 1 1 18 VAL HG11 H 3.696 -2.213 -12.852 1.00 . A A . 18 VAL HG11 1 1 10 4206 1 1 18 VAL HG12 H 2.057 -1.953 -13.430 1.00 . A A . 18 VAL HG12 1 1 10 4207 1 1 18 VAL HG13 H 3.153 -0.595 -13.266 1.00 . A A . 18 VAL HG13 1 1 10 4208 1 1 18 VAL HG21 H 2.566 -3.366 -10.711 1.00 . A A . 18 VAL HG21 1 1 10 4209 1 1 18 VAL HG22 H 1.299 -2.463 -9.897 1.00 . A A . 18 VAL HG22 1 1 10 4210 1 1 18 VAL HG23 H 1.055 -3.034 -11.544 1.00 . A A . 18 VAL HG23 1 1 10 4211 1 1 18 VAL N N 3.020 -0.528 -9.142 1.00 . A A . 18 VAL N 1 1 10 4212 1 1 18 VAL O O 5.483 -0.029 -11.473 1.00 . A A . 18 VAL O 1 1 10 4213 1 1 19 PHE C C 5.841 2.793 -10.526 1.00 . A A . 19 PHE C 1 1 10 4214 1 1 19 PHE CA C 4.565 2.583 -11.372 1.00 . A A . 19 PHE CA 1 1 10 4215 1 1 19 PHE CB C 3.621 3.795 -11.242 1.00 . A A . 19 PHE CB 1 1 10 4216 1 1 19 PHE CD1 C 4.576 5.172 -13.151 1.00 . A A . 19 PHE CD1 1 1 10 4217 1 1 19 PHE CD2 C 4.672 6.085 -10.948 1.00 . A A . 19 PHE CD2 1 1 10 4218 1 1 19 PHE CE1 C 5.195 6.300 -13.646 1.00 . A A . 19 PHE CE1 1 1 10 4219 1 1 19 PHE CE2 C 5.292 7.213 -11.445 1.00 . A A . 19 PHE CE2 1 1 10 4220 1 1 19 PHE CG C 4.308 5.054 -11.797 1.00 . A A . 19 PHE CG 1 1 10 4221 1 1 19 PHE CZ C 5.554 7.322 -12.793 1.00 . A A . 19 PHE CZ 1 1 10 4222 1 1 19 PHE H H 2.957 1.446 -10.485 1.00 . A A . 19 PHE H 1 1 10 4223 1 1 19 PHE HA H 4.843 2.433 -12.404 1.00 . A A . 19 PHE HA 1 1 10 4224 1 1 19 PHE HB2 H 2.711 3.619 -11.798 1.00 . A A . 19 PHE HB2 1 1 10 4225 1 1 19 PHE HB3 H 3.368 3.959 -10.205 1.00 . A A . 19 PHE HB3 1 1 10 4226 1 1 19 PHE HD1 H 4.297 4.376 -13.827 1.00 . A A . 19 PHE HD1 1 1 10 4227 1 1 19 PHE HD2 H 4.471 6.008 -9.890 1.00 . A A . 19 PHE HD2 1 1 10 4228 1 1 19 PHE HE1 H 5.400 6.383 -14.703 1.00 . A A . 19 PHE HE1 1 1 10 4229 1 1 19 PHE HE2 H 5.573 8.013 -10.775 1.00 . A A . 19 PHE HE2 1 1 10 4230 1 1 19 PHE HZ H 6.040 8.205 -13.180 1.00 . A A . 19 PHE HZ 1 1 10 4231 1 1 19 PHE N N 3.846 1.367 -10.886 1.00 . A A . 19 PHE N 1 1 10 4232 1 1 19 PHE O O 6.671 3.622 -10.848 1.00 . A A . 19 PHE O 1 1 10 4233 1 1 20 PHE C C 7.926 0.793 -8.565 1.00 . A A . 20 PHE C 1 1 10 4234 1 1 20 PHE CA C 7.118 2.103 -8.549 1.00 . A A . 20 PHE CA 1 1 10 4235 1 1 20 PHE CB C 6.601 2.401 -7.122 1.00 . A A . 20 PHE CB 1 1 10 4236 1 1 20 PHE CD1 C 7.928 4.464 -6.501 1.00 . A A . 20 PHE CD1 1 1 10 4237 1 1 20 PHE CD2 C 8.489 2.411 -5.424 1.00 . A A . 20 PHE CD2 1 1 10 4238 1 1 20 PHE CE1 C 8.920 5.109 -5.791 1.00 . A A . 20 PHE CE1 1 1 10 4239 1 1 20 PHE CE2 C 9.481 3.055 -4.714 1.00 . A A . 20 PHE CE2 1 1 10 4240 1 1 20 PHE CG C 7.704 3.111 -6.323 1.00 . A A . 20 PHE CG 1 1 10 4241 1 1 20 PHE CZ C 9.697 4.404 -4.897 1.00 . A A . 20 PHE CZ 1 1 10 4242 1 1 20 PHE H H 5.236 1.383 -9.267 1.00 . A A . 20 PHE H 1 1 10 4243 1 1 20 PHE HA H 7.769 2.903 -8.872 1.00 . A A . 20 PHE HA 1 1 10 4244 1 1 20 PHE HB2 H 5.744 3.056 -7.163 1.00 . A A . 20 PHE HB2 1 1 10 4245 1 1 20 PHE HB3 H 6.318 1.490 -6.615 1.00 . A A . 20 PHE HB3 1 1 10 4246 1 1 20 PHE HD1 H 7.322 5.023 -7.200 1.00 . A A . 20 PHE HD1 1 1 10 4247 1 1 20 PHE HD2 H 8.326 1.354 -5.275 1.00 . A A . 20 PHE HD2 1 1 10 4248 1 1 20 PHE HE1 H 9.087 6.166 -5.935 1.00 . A A . 20 PHE HE1 1 1 10 4249 1 1 20 PHE HE2 H 10.089 2.501 -4.014 1.00 . A A . 20 PHE HE2 1 1 10 4250 1 1 20 PHE HZ H 10.474 4.908 -4.341 1.00 . A A . 20 PHE HZ 1 1 10 4251 1 1 20 PHE N N 5.947 2.027 -9.466 1.00 . A A . 20 PHE N 1 1 10 4252 1 1 20 PHE O O 8.940 0.717 -7.904 1.00 . A A . 20 PHE O 1 1 10 4253 1 1 21 ALA C C 8.791 -1.751 -10.756 1.00 . A A . 21 ALA C 1 1 10 4254 1 1 21 ALA CA C 8.229 -1.499 -9.352 1.00 . A A . 21 ALA CA 1 1 10 4255 1 1 21 ALA CB C 7.279 -2.636 -8.960 1.00 . A A . 21 ALA CB 1 1 10 4256 1 1 21 ALA H H 6.656 -0.121 -9.811 1.00 . A A . 21 ALA H 1 1 10 4257 1 1 21 ALA HA H 9.055 -1.434 -8.669 1.00 . A A . 21 ALA HA 1 1 10 4258 1 1 21 ALA HB1 H 6.408 -2.632 -9.599 1.00 . A A . 21 ALA HB1 1 1 10 4259 1 1 21 ALA HB2 H 7.778 -3.589 -9.055 1.00 . A A . 21 ALA HB2 1 1 10 4260 1 1 21 ALA HB3 H 6.960 -2.513 -7.935 1.00 . A A . 21 ALA HB3 1 1 10 4261 1 1 21 ALA N N 7.482 -0.203 -9.296 1.00 . A A . 21 ALA N 1 1 10 4262 1 1 21 ALA O O 9.858 -2.311 -10.920 1.00 . A A . 21 ALA O 1 1 10 4263 1 1 22 GLU C C 9.237 -0.248 -13.603 1.00 . A A . 22 GLU C 1 1 10 4264 1 1 22 GLU CA C 8.436 -1.485 -13.168 1.00 . A A . 22 GLU CA 1 1 10 4265 1 1 22 GLU CB C 7.148 -1.630 -14.006 1.00 . A A . 22 GLU CB 1 1 10 4266 1 1 22 GLU CD C 7.789 -2.665 -16.224 1.00 . A A . 22 GLU CD 1 1 10 4267 1 1 22 GLU CG C 7.205 -2.934 -14.824 1.00 . A A . 22 GLU CG 1 1 10 4268 1 1 22 GLU H H 7.199 -0.890 -11.546 1.00 . A A . 22 GLU H 1 1 10 4269 1 1 22 GLU HA H 9.062 -2.355 -13.250 1.00 . A A . 22 GLU HA 1 1 10 4270 1 1 22 GLU HB2 H 6.294 -1.672 -13.347 1.00 . A A . 22 GLU HB2 1 1 10 4271 1 1 22 GLU HB3 H 7.021 -0.778 -14.659 1.00 . A A . 22 GLU HB3 1 1 10 4272 1 1 22 GLU HG2 H 7.817 -3.672 -14.326 1.00 . A A . 22 GLU HG2 1 1 10 4273 1 1 22 GLU HG3 H 6.205 -3.329 -14.921 1.00 . A A . 22 GLU HG3 1 1 10 4274 1 1 22 GLU N N 8.043 -1.326 -11.739 1.00 . A A . 22 GLU N 1 1 10 4275 1 1 22 GLU O O 9.481 -0.017 -14.771 1.00 . A A . 22 GLU O 1 1 10 4276 1 1 22 GLU OE1 O 8.952 -2.300 -16.271 1.00 . A A . 22 GLU OE1 1 1 10 4277 1 1 22 GLU OE2 O 7.046 -2.844 -17.175 1.00 . A A . 22 GLU OE2 1 1 10 4278 1 1 23 ASP C C 11.518 1.843 -11.756 1.00 . A A . 23 ASP C 1 1 10 4279 1 1 23 ASP CA C 10.397 1.757 -12.798 1.00 . A A . 23 ASP CA 1 1 10 4280 1 1 23 ASP CB C 9.442 2.964 -12.656 1.00 . A A . 23 ASP CB 1 1 10 4281 1 1 23 ASP CG C 8.188 2.757 -13.534 1.00 . A A . 23 ASP CG 1 1 10 4282 1 1 23 ASP H H 9.371 0.241 -11.706 1.00 . A A . 23 ASP H 1 1 10 4283 1 1 23 ASP HA H 10.842 1.734 -13.774 1.00 . A A . 23 ASP HA 1 1 10 4284 1 1 23 ASP HB2 H 9.133 3.073 -11.626 1.00 . A A . 23 ASP HB2 1 1 10 4285 1 1 23 ASP HB3 H 9.946 3.870 -12.961 1.00 . A A . 23 ASP HB3 1 1 10 4286 1 1 23 ASP N N 9.615 0.509 -12.608 1.00 . A A . 23 ASP N 1 1 10 4287 1 1 23 ASP O O 12.510 2.509 -11.978 1.00 . A A . 23 ASP O 1 1 10 4288 1 1 23 ASP OD1 O 7.314 2.029 -13.087 1.00 . A A . 23 ASP OD1 1 1 10 4289 1 1 23 ASP OD2 O 8.172 3.337 -14.606 1.00 . A A . 23 ASP OD2 1 1 10 4290 1 1 24 VAL C C 12.767 -0.278 -9.217 1.00 . A A . 24 VAL C 1 1 10 4291 1 1 24 VAL CA C 12.334 1.156 -9.548 1.00 . A A . 24 VAL CA 1 1 10 4292 1 1 24 VAL CB C 11.726 1.803 -8.292 1.00 . A A . 24 VAL CB 1 1 10 4293 1 1 24 VAL CG1 C 12.835 2.271 -7.340 1.00 . A A . 24 VAL CG1 1 1 10 4294 1 1 24 VAL CG2 C 10.810 2.998 -8.647 1.00 . A A . 24 VAL CG2 1 1 10 4295 1 1 24 VAL H H 10.497 0.647 -10.543 1.00 . A A . 24 VAL H 1 1 10 4296 1 1 24 VAL HA H 13.201 1.721 -9.838 1.00 . A A . 24 VAL HA 1 1 10 4297 1 1 24 VAL HB H 11.162 1.043 -7.795 1.00 . A A . 24 VAL HB 1 1 10 4298 1 1 24 VAL HG11 H 13.464 1.435 -7.069 1.00 . A A . 24 VAL HG11 1 1 10 4299 1 1 24 VAL HG12 H 13.440 3.031 -7.811 1.00 . A A . 24 VAL HG12 1 1 10 4300 1 1 24 VAL HG13 H 12.394 2.676 -6.440 1.00 . A A . 24 VAL HG13 1 1 10 4301 1 1 24 VAL HG21 H 11.365 3.749 -9.187 1.00 . A A . 24 VAL HG21 1 1 10 4302 1 1 24 VAL HG22 H 9.986 2.666 -9.260 1.00 . A A . 24 VAL HG22 1 1 10 4303 1 1 24 VAL HG23 H 10.410 3.434 -7.744 1.00 . A A . 24 VAL HG23 1 1 10 4304 1 1 24 VAL N N 11.322 1.163 -10.653 1.00 . A A . 24 VAL N 1 1 10 4305 1 1 24 VAL O O 13.945 -0.575 -9.174 1.00 . A A . 24 VAL O 1 1 10 4306 1 1 25 GLY C C 12.606 -3.380 -9.816 1.00 . A A . 25 GLY C 1 1 10 4307 1 1 25 GLY CA C 12.042 -2.549 -8.656 1.00 . A A . 25 GLY CA 1 1 10 4308 1 1 25 GLY H H 10.863 -0.792 -9.053 1.00 . A A . 25 GLY H 1 1 10 4309 1 1 25 GLY HA2 H 12.741 -2.589 -7.834 1.00 . A A . 25 GLY HA2 1 1 10 4310 1 1 25 GLY HA3 H 11.110 -2.988 -8.331 1.00 . A A . 25 GLY HA3 1 1 10 4311 1 1 25 GLY N N 11.786 -1.116 -8.996 1.00 . A A . 25 GLY N 1 1 10 4312 1 1 25 GLY O O 13.691 -3.126 -10.302 1.00 . A A . 25 GLY O 1 1 10 4313 1 1 26 SER C C 12.461 -4.573 -12.674 1.00 . A A . 26 SER C 1 1 10 4314 1 1 26 SER CA C 12.219 -5.276 -11.332 1.00 . A A . 26 SER CA 1 1 10 4315 1 1 26 SER CB C 11.108 -6.320 -11.497 1.00 . A A . 26 SER CB 1 1 10 4316 1 1 26 SER H H 10.970 -4.490 -9.772 1.00 . A A . 26 SER H 1 1 10 4317 1 1 26 SER HA H 13.133 -5.771 -11.048 1.00 . A A . 26 SER HA 1 1 10 4318 1 1 26 SER HB2 H 10.147 -5.856 -11.671 1.00 . A A . 26 SER HB2 1 1 10 4319 1 1 26 SER HB3 H 11.329 -7.022 -12.285 1.00 . A A . 26 SER HB3 1 1 10 4320 1 1 26 SER HG H 10.222 -6.873 -9.855 1.00 . A A . 26 SER HG 1 1 10 4321 1 1 26 SER N N 11.832 -4.356 -10.216 1.00 . A A . 26 SER N 1 1 10 4322 1 1 26 SER O O 13.296 -4.997 -13.448 1.00 . A A . 26 SER O 1 1 10 4323 1 1 26 SER OG O 11.087 -7.004 -10.252 1.00 . A A . 26 SER OG 1 1 10 4324 1 1 27 ASN C C 11.551 -3.518 -15.448 1.00 . A A . 27 ASN C 1 1 10 4325 1 1 27 ASN CA C 11.812 -2.713 -14.159 1.00 . A A . 27 ASN CA 1 1 10 4326 1 1 27 ASN CB C 13.220 -2.054 -14.224 1.00 . A A . 27 ASN CB 1 1 10 4327 1 1 27 ASN CG C 13.187 -0.768 -13.393 1.00 . A A . 27 ASN CG 1 1 10 4328 1 1 27 ASN H H 11.080 -3.248 -12.209 1.00 . A A . 27 ASN H 1 1 10 4329 1 1 27 ASN HA H 11.065 -1.939 -14.109 1.00 . A A . 27 ASN HA 1 1 10 4330 1 1 27 ASN HB2 H 13.984 -2.702 -13.821 1.00 . A A . 27 ASN HB2 1 1 10 4331 1 1 27 ASN HB3 H 13.484 -1.800 -15.240 1.00 . A A . 27 ASN HB3 1 1 10 4332 1 1 27 ASN HD21 H 12.890 -1.733 -11.685 1.00 . A A . 27 ASN HD21 1 1 10 4333 1 1 27 ASN HD22 H 12.987 -0.043 -11.560 1.00 . A A . 27 ASN HD22 1 1 10 4334 1 1 27 ASN N N 11.717 -3.521 -12.897 1.00 . A A . 27 ASN N 1 1 10 4335 1 1 27 ASN ND2 N 13.006 -0.856 -12.105 1.00 . A A . 27 ASN ND2 1 1 10 4336 1 1 27 ASN O O 11.713 -2.993 -16.533 1.00 . A A . 27 ASN O 1 1 10 4337 1 1 27 ASN OD1 O 13.324 0.327 -13.904 1.00 . A A . 27 ASN OD1 1 1 10 4338 1 1 28 LYS C C 9.503 -5.216 -17.096 1.00 . A A . 28 LYS C 1 1 10 4339 1 1 28 LYS CA C 10.875 -5.608 -16.508 1.00 . A A . 28 LYS CA 1 1 10 4340 1 1 28 LYS CB C 10.884 -7.096 -16.078 1.00 . A A . 28 LYS CB 1 1 10 4341 1 1 28 LYS CD C 12.314 -8.900 -15.054 1.00 . A A . 28 LYS CD 1 1 10 4342 1 1 28 LYS CE C 11.446 -9.382 -13.874 1.00 . A A . 28 LYS CE 1 1 10 4343 1 1 28 LYS CG C 12.156 -7.388 -15.257 1.00 . A A . 28 LYS CG 1 1 10 4344 1 1 28 LYS H H 11.039 -5.156 -14.421 1.00 . A A . 28 LYS H 1 1 10 4345 1 1 28 LYS HA H 11.649 -5.443 -17.246 1.00 . A A . 28 LYS HA 1 1 10 4346 1 1 28 LYS HB2 H 10.014 -7.315 -15.476 1.00 . A A . 28 LYS HB2 1 1 10 4347 1 1 28 LYS HB3 H 10.858 -7.718 -16.961 1.00 . A A . 28 LYS HB3 1 1 10 4348 1 1 28 LYS HD2 H 12.029 -9.416 -15.958 1.00 . A A . 28 LYS HD2 1 1 10 4349 1 1 28 LYS HD3 H 13.351 -9.106 -14.844 1.00 . A A . 28 LYS HD3 1 1 10 4350 1 1 28 LYS HE2 H 11.902 -9.097 -12.936 1.00 . A A . 28 LYS HE2 1 1 10 4351 1 1 28 LYS HE3 H 10.454 -8.957 -13.924 1.00 . A A . 28 LYS HE3 1 1 10 4352 1 1 28 LYS HG2 H 13.023 -7.004 -15.775 1.00 . A A . 28 LYS HG2 1 1 10 4353 1 1 28 LYS HG3 H 12.090 -6.903 -14.297 1.00 . A A . 28 LYS HG3 1 1 10 4354 1 1 28 LYS HZ1 H 11.855 -11.245 -14.715 1.00 . A A . 28 LYS HZ1 1 1 10 4355 1 1 28 LYS HZ2 H 11.712 -11.263 -13.023 1.00 . A A . 28 LYS HZ2 1 1 10 4356 1 1 28 LYS HZ3 H 10.324 -11.131 -13.991 1.00 . A A . 28 LYS HZ3 1 1 10 4357 1 1 28 LYS N N 11.155 -4.761 -15.310 1.00 . A A . 28 LYS N 1 1 10 4358 1 1 28 LYS NZ N 11.326 -10.867 -13.903 1.00 . A A . 28 LYS NZ 1 1 10 4359 1 1 28 LYS O O 9.521 -4.622 -18.161 1.00 . A A . 28 LYS O 1 1 10 4360 1 1 28 LYS OXT O 8.511 -5.521 -16.451 1.00 . A A . 28 LYS OXT 1 1 11 4361 1 1 1 ASP C C -9.317 9.407 -4.870 1.00 . A A . 1 ASP C 1 1 11 4362 1 1 1 ASP CA C -7.945 8.815 -5.224 1.00 . A A . 1 ASP CA 1 1 11 4363 1 1 1 ASP CB C -6.869 9.930 -5.168 1.00 . A A . 1 ASP CB 1 1 11 4364 1 1 1 ASP CG C -7.305 11.141 -6.019 1.00 . A A . 1 ASP CG 1 1 11 4365 1 1 1 ASP H1 H -8.928 8.326 -6.998 1.00 . A A . 1 ASP H1 1 1 11 4366 1 1 1 ASP H2 H -7.283 8.692 -7.198 1.00 . A A . 1 ASP H2 1 1 11 4367 1 1 1 ASP H3 H -7.744 7.201 -6.526 1.00 . A A . 1 ASP H3 1 1 11 4368 1 1 1 ASP HA H -7.713 8.035 -4.516 1.00 . A A . 1 ASP HA 1 1 11 4369 1 1 1 ASP HB2 H -6.721 10.245 -4.145 1.00 . A A . 1 ASP HB2 1 1 11 4370 1 1 1 ASP HB3 H -5.930 9.556 -5.549 1.00 . A A . 1 ASP HB3 1 1 11 4371 1 1 1 ASP N N -7.978 8.212 -6.590 1.00 . A A . 1 ASP N 1 1 11 4372 1 1 1 ASP O O -9.756 9.334 -3.739 1.00 . A A . 1 ASP O 1 1 11 4373 1 1 1 ASP OD1 O -7.238 11.010 -7.231 1.00 . A A . 1 ASP OD1 1 1 11 4374 1 1 1 ASP OD2 O -7.682 12.128 -5.408 1.00 . A A . 1 ASP OD2 1 1 11 4375 1 1 2 ALA C C -12.192 10.163 -6.866 1.00 . A A . 2 ALA C 1 1 11 4376 1 1 2 ALA CA C -11.281 10.607 -5.716 1.00 . A A . 2 ALA CA 1 1 11 4377 1 1 2 ALA CB C -11.113 12.132 -5.731 1.00 . A A . 2 ALA CB 1 1 11 4378 1 1 2 ALA H H -9.499 9.981 -6.748 1.00 . A A . 2 ALA H 1 1 11 4379 1 1 2 ALA HA H -11.724 10.296 -4.781 1.00 . A A . 2 ALA HA 1 1 11 4380 1 1 2 ALA HB1 H -10.340 12.407 -6.429 1.00 . A A . 2 ALA HB1 1 1 11 4381 1 1 2 ALA HB2 H -12.031 12.615 -6.031 1.00 . A A . 2 ALA HB2 1 1 11 4382 1 1 2 ALA HB3 H -10.836 12.483 -4.749 1.00 . A A . 2 ALA HB3 1 1 11 4383 1 1 2 ALA N N -9.937 9.975 -5.872 1.00 . A A . 2 ALA N 1 1 11 4384 1 1 2 ALA O O -11.881 10.380 -8.023 1.00 . A A . 2 ALA O 1 1 11 4385 1 1 3 GLU C C -15.148 10.218 -8.093 1.00 . A A . 3 GLU C 1 1 11 4386 1 1 3 GLU CA C -14.277 9.075 -7.540 1.00 . A A . 3 GLU CA 1 1 11 4387 1 1 3 GLU CB C -15.157 7.969 -6.888 1.00 . A A . 3 GLU CB 1 1 11 4388 1 1 3 GLU CD C -17.287 9.048 -6.007 1.00 . A A . 3 GLU CD 1 1 11 4389 1 1 3 GLU CG C -15.904 8.487 -5.622 1.00 . A A . 3 GLU CG 1 1 11 4390 1 1 3 GLU H H -13.489 9.421 -5.561 1.00 . A A . 3 GLU H 1 1 11 4391 1 1 3 GLU HA H -13.719 8.668 -8.367 1.00 . A A . 3 GLU HA 1 1 11 4392 1 1 3 GLU HB2 H -15.865 7.595 -7.613 1.00 . A A . 3 GLU HB2 1 1 11 4393 1 1 3 GLU HB3 H -14.517 7.149 -6.598 1.00 . A A . 3 GLU HB3 1 1 11 4394 1 1 3 GLU HG2 H -16.047 7.668 -4.933 1.00 . A A . 3 GLU HG2 1 1 11 4395 1 1 3 GLU HG3 H -15.334 9.253 -5.118 1.00 . A A . 3 GLU HG3 1 1 11 4396 1 1 3 GLU N N -13.299 9.558 -6.511 1.00 . A A . 3 GLU N 1 1 11 4397 1 1 3 GLU O O -16.232 10.007 -8.602 1.00 . A A . 3 GLU O 1 1 11 4398 1 1 3 GLU OE1 O -18.133 8.230 -6.331 1.00 . A A . 3 GLU OE1 1 1 11 4399 1 1 3 GLU OE2 O -17.425 10.259 -5.956 1.00 . A A . 3 GLU OE2 1 1 11 4400 1 1 4 PHE C C -14.239 13.613 -8.999 1.00 . A A . 4 PHE C 1 1 11 4401 1 1 4 PHE CA C -15.285 12.648 -8.434 1.00 . A A . 4 PHE CA 1 1 11 4402 1 1 4 PHE CB C -16.037 13.281 -7.235 1.00 . A A . 4 PHE CB 1 1 11 4403 1 1 4 PHE CD1 C -14.852 12.441 -5.146 1.00 . A A . 4 PHE CD1 1 1 11 4404 1 1 4 PHE CD2 C -14.430 14.679 -5.844 1.00 . A A . 4 PHE CD2 1 1 11 4405 1 1 4 PHE CE1 C -13.996 12.609 -4.079 1.00 . A A . 4 PHE CE1 1 1 11 4406 1 1 4 PHE CE2 C -13.574 14.849 -4.776 1.00 . A A . 4 PHE CE2 1 1 11 4407 1 1 4 PHE CG C -15.078 13.472 -6.040 1.00 . A A . 4 PHE CG 1 1 11 4408 1 1 4 PHE CZ C -13.356 13.814 -3.892 1.00 . A A . 4 PHE CZ 1 1 11 4409 1 1 4 PHE H H -13.732 11.469 -7.548 1.00 . A A . 4 PHE H 1 1 11 4410 1 1 4 PHE HA H -15.949 12.401 -9.244 1.00 . A A . 4 PHE HA 1 1 11 4411 1 1 4 PHE HB2 H -16.448 14.240 -7.513 1.00 . A A . 4 PHE HB2 1 1 11 4412 1 1 4 PHE HB3 H -16.849 12.637 -6.930 1.00 . A A . 4 PHE HB3 1 1 11 4413 1 1 4 PHE HD1 H -15.348 11.493 -5.281 1.00 . A A . 4 PHE HD1 1 1 11 4414 1 1 4 PHE HD2 H -14.594 15.497 -6.530 1.00 . A A . 4 PHE HD2 1 1 11 4415 1 1 4 PHE HE1 H -13.828 11.795 -3.388 1.00 . A A . 4 PHE HE1 1 1 11 4416 1 1 4 PHE HE2 H -13.071 15.794 -4.632 1.00 . A A . 4 PHE HE2 1 1 11 4417 1 1 4 PHE HZ H -12.685 13.948 -3.056 1.00 . A A . 4 PHE HZ 1 1 11 4418 1 1 4 PHE N N -14.612 11.401 -7.965 1.00 . A A . 4 PHE N 1 1 11 4419 1 1 4 PHE O O -14.461 14.805 -9.094 1.00 . A A . 4 PHE O 1 1 11 4420 1 1 5 ARG C C -12.294 14.062 -11.418 1.00 . A A . 5 ARG C 1 1 11 4421 1 1 5 ARG CA C -11.990 13.822 -9.930 1.00 . A A . 5 ARG CA 1 1 11 4422 1 1 5 ARG CB C -10.691 13.006 -9.730 1.00 . A A . 5 ARG CB 1 1 11 4423 1 1 5 ARG CD C -8.230 13.498 -9.266 1.00 . A A . 5 ARG CD 1 1 11 4424 1 1 5 ARG CG C -9.467 13.880 -10.114 1.00 . A A . 5 ARG CG 1 1 11 4425 1 1 5 ARG CZ C -8.730 14.729 -7.192 1.00 . A A . 5 ARG CZ 1 1 11 4426 1 1 5 ARG H H -13.025 12.078 -9.245 1.00 . A A . 5 ARG H 1 1 11 4427 1 1 5 ARG HA H -11.930 14.764 -9.411 1.00 . A A . 5 ARG HA 1 1 11 4428 1 1 5 ARG HB2 H -10.632 12.694 -8.699 1.00 . A A . 5 ARG HB2 1 1 11 4429 1 1 5 ARG HB3 H -10.712 12.120 -10.347 1.00 . A A . 5 ARG HB3 1 1 11 4430 1 1 5 ARG HD2 H -7.926 12.487 -9.490 1.00 . A A . 5 ARG HD2 1 1 11 4431 1 1 5 ARG HD3 H -7.407 14.166 -9.476 1.00 . A A . 5 ARG HD3 1 1 11 4432 1 1 5 ARG HE H -8.685 12.754 -7.303 1.00 . A A . 5 ARG HE 1 1 11 4433 1 1 5 ARG HG2 H -9.238 13.724 -11.158 1.00 . A A . 5 ARG HG2 1 1 11 4434 1 1 5 ARG HG3 H -9.691 14.926 -9.971 1.00 . A A . 5 ARG HG3 1 1 11 4435 1 1 5 ARG HH11 H -8.354 15.856 -8.806 1.00 . A A . 5 ARG HH11 1 1 11 4436 1 1 5 ARG HH12 H -8.711 16.726 -7.353 1.00 . A A . 5 ARG HH12 1 1 11 4437 1 1 5 ARG HH21 H -9.137 13.825 -5.454 1.00 . A A . 5 ARG HH21 1 1 11 4438 1 1 5 ARG HH22 H -9.161 15.556 -5.421 1.00 . A A . 5 ARG HH22 1 1 11 4439 1 1 5 ARG N N -13.119 13.041 -9.357 1.00 . A A . 5 ARG N 1 1 11 4440 1 1 5 ARG NE N -8.573 13.585 -7.810 1.00 . A A . 5 ARG NE 1 1 11 4441 1 1 5 ARG NH1 N -8.587 15.859 -7.834 1.00 . A A . 5 ARG NH1 1 1 11 4442 1 1 5 ARG NH2 N -9.033 14.702 -5.924 1.00 . A A . 5 ARG NH2 1 1 11 4443 1 1 5 ARG O O -11.762 13.399 -12.289 1.00 . A A . 5 ARG O 1 1 11 4444 1 1 6 HIS C C -14.215 14.188 -13.741 1.00 . A A . 6 HIS C 1 1 11 4445 1 1 6 HIS CA C -13.589 15.401 -13.029 1.00 . A A . 6 HIS CA 1 1 11 4446 1 1 6 HIS CB C -12.348 15.913 -13.807 1.00 . A A . 6 HIS CB 1 1 11 4447 1 1 6 HIS CD2 C -12.848 16.636 -16.309 1.00 . A A . 6 HIS CD2 1 1 11 4448 1 1 6 HIS CE1 C -13.545 18.554 -15.936 1.00 . A A . 6 HIS CE1 1 1 11 4449 1 1 6 HIS CG C -12.802 16.841 -14.940 1.00 . A A . 6 HIS CG 1 1 11 4450 1 1 6 HIS H H -13.545 15.497 -10.877 1.00 . A A . 6 HIS H 1 1 11 4451 1 1 6 HIS HA H -14.337 16.177 -12.951 1.00 . A A . 6 HIS HA 1 1 11 4452 1 1 6 HIS HB2 H -11.696 16.464 -13.147 1.00 . A A . 6 HIS HB2 1 1 11 4453 1 1 6 HIS HB3 H -11.797 15.086 -14.233 1.00 . A A . 6 HIS HB3 1 1 11 4454 1 1 6 HIS HD1 H -13.342 18.502 -13.923 1.00 . A A . 6 HIS HD1 1 1 11 4455 1 1 6 HIS HD2 H -12.548 15.727 -16.810 1.00 . A A . 6 HIS HD2 1 1 11 4456 1 1 6 HIS HE1 H -13.936 19.551 -16.076 1.00 . A A . 6 HIS HE1 1 1 11 4457 1 1 6 HIS N N -13.162 15.020 -11.642 1.00 . A A . 6 HIS N 1 1 11 4458 1 1 6 HIS ND1 N -13.247 18.045 -14.784 1.00 . A A . 6 HIS ND1 1 1 11 4459 1 1 6 HIS NE2 N -13.313 17.712 -16.914 1.00 . A A . 6 HIS NE2 1 1 11 4460 1 1 6 HIS O O -14.181 14.081 -14.952 1.00 . A A . 6 HIS O 1 1 11 4461 1 1 7 ASP C C -14.404 11.251 -14.242 1.00 . A A . 7 ASP C 1 1 11 4462 1 1 7 ASP CA C -15.427 12.066 -13.436 1.00 . A A . 7 ASP CA 1 1 11 4463 1 1 7 ASP CB C -16.653 12.456 -14.313 1.00 . A A . 7 ASP CB 1 1 11 4464 1 1 7 ASP CG C -17.535 11.209 -14.518 1.00 . A A . 7 ASP CG 1 1 11 4465 1 1 7 ASP H H -14.752 13.480 -11.972 1.00 . A A . 7 ASP H 1 1 11 4466 1 1 7 ASP HA H -15.742 11.482 -12.584 1.00 . A A . 7 ASP HA 1 1 11 4467 1 1 7 ASP HB2 H -17.233 13.221 -13.817 1.00 . A A . 7 ASP HB2 1 1 11 4468 1 1 7 ASP HB3 H -16.342 12.834 -15.276 1.00 . A A . 7 ASP HB3 1 1 11 4469 1 1 7 ASP N N -14.769 13.312 -12.936 1.00 . A A . 7 ASP N 1 1 11 4470 1 1 7 ASP O O -14.511 11.093 -15.444 1.00 . A A . 7 ASP O 1 1 11 4471 1 1 7 ASP OD1 O -18.372 10.993 -13.657 1.00 . A A . 7 ASP OD1 1 1 11 4472 1 1 7 ASP OD2 O -17.322 10.545 -15.519 1.00 . A A . 7 ASP OD2 1 1 11 4473 1 1 8 SER C C -12.889 8.790 -14.989 1.00 . A A . 8 SER C 1 1 11 4474 1 1 8 SER CA C -12.332 9.941 -14.135 1.00 . A A . 8 SER CA 1 1 11 4475 1 1 8 SER CB C -11.455 9.372 -13.010 1.00 . A A . 8 SER CB 1 1 11 4476 1 1 8 SER H H -13.404 10.942 -12.559 1.00 . A A . 8 SER H 1 1 11 4477 1 1 8 SER HA H -11.747 10.585 -14.771 1.00 . A A . 8 SER HA 1 1 11 4478 1 1 8 SER HB2 H -12.023 8.747 -12.336 1.00 . A A . 8 SER HB2 1 1 11 4479 1 1 8 SER HB3 H -10.609 8.827 -13.402 1.00 . A A . 8 SER HB3 1 1 11 4480 1 1 8 SER HG H -11.316 10.474 -11.412 1.00 . A A . 8 SER HG 1 1 11 4481 1 1 8 SER N N -13.425 10.763 -13.522 1.00 . A A . 8 SER N 1 1 11 4482 1 1 8 SER O O -12.298 8.409 -15.979 1.00 . A A . 8 SER O 1 1 11 4483 1 1 8 SER OG O -10.996 10.524 -12.315 1.00 . A A . 8 SER OG 1 1 11 4484 1 1 9 GLY C C -13.786 5.941 -15.473 1.00 . A A . 9 GLY C 1 1 11 4485 1 1 9 GLY CA C -14.698 7.154 -15.273 1.00 . A A . 9 GLY CA 1 1 11 4486 1 1 9 GLY H H -14.420 8.655 -13.748 1.00 . A A . 9 GLY H 1 1 11 4487 1 1 9 GLY HA2 H -15.556 6.845 -14.696 1.00 . A A . 9 GLY HA2 1 1 11 4488 1 1 9 GLY HA3 H -15.030 7.503 -16.241 1.00 . A A . 9 GLY HA3 1 1 11 4489 1 1 9 GLY N N -14.017 8.281 -14.560 1.00 . A A . 9 GLY N 1 1 11 4490 1 1 9 GLY O O -13.927 5.225 -16.445 1.00 . A A . 9 GLY O 1 1 11 4491 1 1 10 TYR C C -11.259 4.297 -13.301 1.00 . A A . 10 TYR C 1 1 11 4492 1 1 10 TYR CA C -11.937 4.596 -14.642 1.00 . A A . 10 TYR CA 1 1 11 4493 1 1 10 TYR CB C -10.860 4.911 -15.710 1.00 . A A . 10 TYR CB 1 1 11 4494 1 1 10 TYR CD1 C -11.370 3.351 -17.636 1.00 . A A . 10 TYR CD1 1 1 11 4495 1 1 10 TYR CD2 C -9.583 2.771 -16.173 1.00 . A A . 10 TYR CD2 1 1 11 4496 1 1 10 TYR CE1 C -11.139 2.211 -18.372 1.00 . A A . 10 TYR CE1 1 1 11 4497 1 1 10 TYR CE2 C -9.353 1.629 -16.911 1.00 . A A . 10 TYR CE2 1 1 11 4498 1 1 10 TYR CG C -10.594 3.641 -16.530 1.00 . A A . 10 TYR CG 1 1 11 4499 1 1 10 TYR CZ C -10.129 1.341 -18.015 1.00 . A A . 10 TYR CZ 1 1 11 4500 1 1 10 TYR H H -12.816 6.357 -13.786 1.00 . A A . 10 TYR H 1 1 11 4501 1 1 10 TYR HA H -12.515 3.728 -14.918 1.00 . A A . 10 TYR HA 1 1 11 4502 1 1 10 TYR HB2 H -11.197 5.691 -16.378 1.00 . A A . 10 TYR HB2 1 1 11 4503 1 1 10 TYR HB3 H -9.937 5.231 -15.249 1.00 . A A . 10 TYR HB3 1 1 11 4504 1 1 10 TYR HD1 H -12.163 4.023 -17.929 1.00 . A A . 10 TYR HD1 1 1 11 4505 1 1 10 TYR HD2 H -8.967 2.983 -15.312 1.00 . A A . 10 TYR HD2 1 1 11 4506 1 1 10 TYR HE1 H -11.756 2.000 -19.234 1.00 . A A . 10 TYR HE1 1 1 11 4507 1 1 10 TYR HE2 H -8.560 0.957 -16.618 1.00 . A A . 10 TYR HE2 1 1 11 4508 1 1 10 TYR HH H -9.117 0.345 -19.291 1.00 . A A . 10 TYR HH 1 1 11 4509 1 1 10 TYR N N -12.879 5.747 -14.547 1.00 . A A . 10 TYR N 1 1 11 4510 1 1 10 TYR O O -11.286 5.096 -12.384 1.00 . A A . 10 TYR O 1 1 11 4511 1 1 10 TYR OH O -9.898 0.197 -18.751 1.00 . A A . 10 TYR OH 1 1 11 4512 1 1 11 GLU C C -9.089 1.467 -12.489 1.00 . A A . 11 GLU C 1 1 11 4513 1 1 11 GLU CA C -9.950 2.647 -12.042 1.00 . A A . 11 GLU CA 1 1 11 4514 1 1 11 GLU CB C -10.975 2.201 -10.972 1.00 . A A . 11 GLU CB 1 1 11 4515 1 1 11 GLU CD C -11.246 1.630 -8.540 1.00 . A A . 11 GLU CD 1 1 11 4516 1 1 11 GLU CG C -10.226 1.829 -9.674 1.00 . A A . 11 GLU CG 1 1 11 4517 1 1 11 GLU H H -10.695 2.551 -14.045 1.00 . A A . 11 GLU H 1 1 11 4518 1 1 11 GLU HA H -9.300 3.432 -11.674 1.00 . A A . 11 GLU HA 1 1 11 4519 1 1 11 GLU HB2 H -11.663 3.010 -10.771 1.00 . A A . 11 GLU HB2 1 1 11 4520 1 1 11 GLU HB3 H -11.539 1.351 -11.327 1.00 . A A . 11 GLU HB3 1 1 11 4521 1 1 11 GLU HG2 H -9.667 0.915 -9.811 1.00 . A A . 11 GLU HG2 1 1 11 4522 1 1 11 GLU HG3 H -9.537 2.616 -9.398 1.00 . A A . 11 GLU HG3 1 1 11 4523 1 1 11 GLU N N -10.668 3.130 -13.255 1.00 . A A . 11 GLU N 1 1 11 4524 1 1 11 GLU O O -9.568 0.370 -12.704 1.00 . A A . 11 GLU O 1 1 11 4525 1 1 11 GLU OE1 O -11.775 0.533 -8.468 1.00 . A A . 11 GLU OE1 1 1 11 4526 1 1 11 GLU OE2 O -11.441 2.588 -7.810 1.00 . A A . 11 GLU OE2 1 1 11 4527 1 1 12 VAL C C -6.464 -0.202 -11.888 1.00 . A A . 12 VAL C 1 1 11 4528 1 1 12 VAL CA C -6.826 0.742 -13.043 1.00 . A A . 12 VAL CA 1 1 11 4529 1 1 12 VAL CB C -5.600 1.508 -13.552 1.00 . A A . 12 VAL CB 1 1 11 4530 1 1 12 VAL CG1 C -4.399 0.564 -13.805 1.00 . A A . 12 VAL CG1 1 1 11 4531 1 1 12 VAL CG2 C -5.961 2.244 -14.862 1.00 . A A . 12 VAL CG2 1 1 11 4532 1 1 12 VAL H H -7.519 2.666 -12.429 1.00 . A A . 12 VAL H 1 1 11 4533 1 1 12 VAL HA H -7.238 0.177 -13.853 1.00 . A A . 12 VAL HA 1 1 11 4534 1 1 12 VAL HB H -5.362 2.232 -12.796 1.00 . A A . 12 VAL HB 1 1 11 4535 1 1 12 VAL HG11 H -4.711 -0.296 -14.381 1.00 . A A . 12 VAL HG11 1 1 11 4536 1 1 12 VAL HG12 H -3.624 1.084 -14.346 1.00 . A A . 12 VAL HG12 1 1 11 4537 1 1 12 VAL HG13 H -3.990 0.224 -12.864 1.00 . A A . 12 VAL HG13 1 1 11 4538 1 1 12 VAL HG21 H -6.330 1.545 -15.599 1.00 . A A . 12 VAL HG21 1 1 11 4539 1 1 12 VAL HG22 H -6.725 2.983 -14.672 1.00 . A A . 12 VAL HG22 1 1 11 4540 1 1 12 VAL HG23 H -5.092 2.745 -15.262 1.00 . A A . 12 VAL HG23 1 1 11 4541 1 1 12 VAL N N -7.825 1.757 -12.616 1.00 . A A . 12 VAL N 1 1 11 4542 1 1 12 VAL O O -6.140 -1.349 -12.125 1.00 . A A . 12 VAL O 1 1 11 4543 1 1 13 HIS C C -4.710 -0.447 -9.214 1.00 . A A . 13 HIS C 1 1 11 4544 1 1 13 HIS CA C -6.234 -0.374 -9.405 1.00 . A A . 13 HIS CA 1 1 11 4545 1 1 13 HIS CB C -6.805 -1.820 -9.402 1.00 . A A . 13 HIS CB 1 1 11 4546 1 1 13 HIS CD2 C -9.406 -1.733 -8.898 1.00 . A A . 13 HIS CD2 1 1 11 4547 1 1 13 HIS CE1 C -10.098 -1.850 -10.849 1.00 . A A . 13 HIS CE1 1 1 11 4548 1 1 13 HIS CG C -8.303 -1.810 -9.731 1.00 . A A . 13 HIS CG 1 1 11 4549 1 1 13 HIS H H -6.824 1.269 -10.635 1.00 . A A . 13 HIS H 1 1 11 4550 1 1 13 HIS HA H -6.661 0.192 -8.590 1.00 . A A . 13 HIS HA 1 1 11 4551 1 1 13 HIS HB2 H -6.292 -2.451 -10.110 1.00 . A A . 13 HIS HB2 1 1 11 4552 1 1 13 HIS HB3 H -6.680 -2.241 -8.416 1.00 . A A . 13 HIS HB3 1 1 11 4553 1 1 13 HIS HD1 H -8.286 -1.945 -11.749 1.00 . A A . 13 HIS HD1 1 1 11 4554 1 1 13 HIS HD2 H -9.365 -1.661 -7.822 1.00 . A A . 13 HIS HD2 1 1 11 4555 1 1 13 HIS HE1 H -10.752 -1.895 -11.706 1.00 . A A . 13 HIS HE1 1 1 11 4556 1 1 13 HIS N N -6.542 0.336 -10.692 1.00 . A A . 13 HIS N 1 1 11 4557 1 1 13 HIS ND1 N -8.805 -1.880 -10.919 1.00 . A A . 13 HIS ND1 1 1 11 4558 1 1 13 HIS NE2 N -10.515 -1.759 -9.611 1.00 . A A . 13 HIS NE2 1 1 11 4559 1 1 13 HIS O O -4.198 -0.079 -8.175 1.00 . A A . 13 HIS O 1 1 11 4560 1 1 14 HIS C C -1.931 0.301 -10.577 1.00 . A A . 14 HIS C 1 1 11 4561 1 1 14 HIS CA C -2.553 -1.052 -10.216 1.00 . A A . 14 HIS CA 1 1 11 4562 1 1 14 HIS CB C -2.153 -2.146 -11.236 1.00 . A A . 14 HIS CB 1 1 11 4563 1 1 14 HIS CD2 C -2.757 -4.556 -10.308 1.00 . A A . 14 HIS CD2 1 1 11 4564 1 1 14 HIS CE1 C -4.669 -4.708 -11.098 1.00 . A A . 14 HIS CE1 1 1 11 4565 1 1 14 HIS CG C -3.016 -3.391 -11.007 1.00 . A A . 14 HIS CG 1 1 11 4566 1 1 14 HIS H H -4.510 -1.198 -11.037 1.00 . A A . 14 HIS H 1 1 11 4567 1 1 14 HIS HA H -2.231 -1.317 -9.225 1.00 . A A . 14 HIS HA 1 1 11 4568 1 1 14 HIS HB2 H -2.309 -1.797 -12.247 1.00 . A A . 14 HIS HB2 1 1 11 4569 1 1 14 HIS HB3 H -1.115 -2.416 -11.112 1.00 . A A . 14 HIS HB3 1 1 11 4570 1 1 14 HIS HD1 H -4.700 -2.903 -12.013 1.00 . A A . 14 HIS HD1 1 1 11 4571 1 1 14 HIS HD2 H -1.837 -4.772 -9.784 1.00 . A A . 14 HIS HD2 1 1 11 4572 1 1 14 HIS HE1 H -5.649 -5.083 -11.354 1.00 . A A . 14 HIS HE1 1 1 11 4573 1 1 14 HIS N N -4.038 -0.919 -10.234 1.00 . A A . 14 HIS N 1 1 11 4574 1 1 14 HIS ND1 N -4.213 -3.555 -11.468 1.00 . A A . 14 HIS ND1 1 1 11 4575 1 1 14 HIS NE2 N -3.796 -5.365 -10.374 1.00 . A A . 14 HIS NE2 1 1 11 4576 1 1 14 HIS O O -2.539 1.330 -10.351 1.00 . A A . 14 HIS O 1 1 11 4577 1 1 15 GLN C C 0.059 2.489 -10.335 1.00 . A A . 15 GLN C 1 1 11 4578 1 1 15 GLN CA C -0.015 1.517 -11.523 1.00 . A A . 15 GLN CA 1 1 11 4579 1 1 15 GLN CB C -0.768 2.147 -12.726 1.00 . A A . 15 GLN CB 1 1 11 4580 1 1 15 GLN CD C -0.861 2.304 -15.221 1.00 . A A . 15 GLN CD 1 1 11 4581 1 1 15 GLN CG C -0.188 1.594 -14.039 1.00 . A A . 15 GLN CG 1 1 11 4582 1 1 15 GLN H H -0.309 -0.603 -11.279 1.00 . A A . 15 GLN H 1 1 11 4583 1 1 15 GLN HA H 1.004 1.235 -11.754 1.00 . A A . 15 GLN HA 1 1 11 4584 1 1 15 GLN HB2 H -1.819 1.902 -12.670 1.00 . A A . 15 GLN HB2 1 1 11 4585 1 1 15 GLN HB3 H -0.669 3.221 -12.708 1.00 . A A . 15 GLN HB3 1 1 11 4586 1 1 15 GLN HE21 H 0.060 4.027 -14.869 1.00 . A A . 15 GLN HE21 1 1 11 4587 1 1 15 GLN HE22 H -0.996 4.026 -16.199 1.00 . A A . 15 GLN HE22 1 1 11 4588 1 1 15 GLN HG2 H 0.877 1.771 -14.090 1.00 . A A . 15 GLN HG2 1 1 11 4589 1 1 15 GLN HG3 H -0.373 0.532 -14.116 1.00 . A A . 15 GLN HG3 1 1 11 4590 1 1 15 GLN N N -0.739 0.264 -11.126 1.00 . A A . 15 GLN N 1 1 11 4591 1 1 15 GLN NE2 N -0.575 3.557 -15.449 1.00 . A A . 15 GLN NE2 1 1 11 4592 1 1 15 GLN O O 0.058 3.699 -10.452 1.00 . A A . 15 GLN O 1 1 11 4593 1 1 15 GLN OE1 O -1.649 1.728 -15.944 1.00 . A A . 15 GLN OE1 1 1 11 4594 1 1 16 PHE C C 1.003 1.381 -7.211 1.00 . A A . 16 PHE C 1 1 11 4595 1 1 16 PHE CA C 0.207 2.483 -7.878 1.00 . A A . 16 PHE CA 1 1 11 4596 1 1 16 PHE CB C -1.205 2.636 -7.269 1.00 . A A . 16 PHE CB 1 1 11 4597 1 1 16 PHE CD1 C -0.545 3.547 -4.988 1.00 . A A . 16 PHE CD1 1 1 11 4598 1 1 16 PHE CD2 C -1.634 1.427 -5.072 1.00 . A A . 16 PHE CD2 1 1 11 4599 1 1 16 PHE CE1 C -0.469 3.454 -3.614 1.00 . A A . 16 PHE CE1 1 1 11 4600 1 1 16 PHE CE2 C -1.559 1.335 -3.698 1.00 . A A . 16 PHE CE2 1 1 11 4601 1 1 16 PHE CG C -1.128 2.535 -5.730 1.00 . A A . 16 PHE CG 1 1 11 4602 1 1 16 PHE CZ C -0.977 2.348 -2.968 1.00 . A A . 16 PHE CZ 1 1 11 4603 1 1 16 PHE H H 0.108 0.864 -9.247 1.00 . A A . 16 PHE H 1 1 11 4604 1 1 16 PHE HA H 0.788 3.391 -7.940 1.00 . A A . 16 PHE HA 1 1 11 4605 1 1 16 PHE HB2 H -1.613 3.598 -7.540 1.00 . A A . 16 PHE HB2 1 1 11 4606 1 1 16 PHE HB3 H -1.855 1.860 -7.646 1.00 . A A . 16 PHE HB3 1 1 11 4607 1 1 16 PHE HD1 H -0.143 4.418 -5.485 1.00 . A A . 16 PHE HD1 1 1 11 4608 1 1 16 PHE HD2 H -2.091 0.626 -5.634 1.00 . A A . 16 PHE HD2 1 1 11 4609 1 1 16 PHE HE1 H -0.013 4.250 -3.045 1.00 . A A . 16 PHE HE1 1 1 11 4610 1 1 16 PHE HE2 H -1.957 0.466 -3.195 1.00 . A A . 16 PHE HE2 1 1 11 4611 1 1 16 PHE HZ H -0.918 2.275 -1.893 1.00 . A A . 16 PHE HZ 1 1 11 4612 1 1 16 PHE N N 0.120 1.843 -9.210 1.00 . A A . 16 PHE N 1 1 11 4613 1 1 16 PHE O O 0.484 0.299 -7.013 1.00 . A A . 16 PHE O 1 1 11 4614 1 1 17 LEU C C 3.833 -0.030 -7.406 1.00 . A A . 17 LEU C 1 1 11 4615 1 1 17 LEU CA C 3.186 0.756 -6.257 1.00 . A A . 17 LEU CA 1 1 11 4616 1 1 17 LEU CB C 2.447 -0.224 -5.297 1.00 . A A . 17 LEU CB 1 1 11 4617 1 1 17 LEU CD1 C 3.226 0.309 -2.976 1.00 . A A . 17 LEU CD1 1 1 11 4618 1 1 17 LEU CD2 C 3.085 -2.088 -3.754 1.00 . A A . 17 LEU CD2 1 1 11 4619 1 1 17 LEU CG C 3.409 -0.641 -4.181 1.00 . A A . 17 LEU CG 1 1 11 4620 1 1 17 LEU H H 2.561 2.597 -7.115 1.00 . A A . 17 LEU H 1 1 11 4621 1 1 17 LEU HA H 3.947 1.330 -5.753 1.00 . A A . 17 LEU HA 1 1 11 4622 1 1 17 LEU HB2 H 1.581 0.261 -4.866 1.00 . A A . 17 LEU HB2 1 1 11 4623 1 1 17 LEU HB3 H 2.113 -1.094 -5.844 1.00 . A A . 17 LEU HB3 1 1 11 4624 1 1 17 LEU HD11 H 3.396 1.332 -3.282 1.00 . A A . 17 LEU HD11 1 1 11 4625 1 1 17 LEU HD12 H 2.223 0.230 -2.584 1.00 . A A . 17 LEU HD12 1 1 11 4626 1 1 17 LEU HD13 H 3.927 0.060 -2.194 1.00 . A A . 17 LEU HD13 1 1 11 4627 1 1 17 LEU HD21 H 2.047 -2.166 -3.457 1.00 . A A . 17 LEU HD21 1 1 11 4628 1 1 17 LEU HD22 H 3.257 -2.763 -4.581 1.00 . A A . 17 LEU HD22 1 1 11 4629 1 1 17 LEU HD23 H 3.709 -2.385 -2.926 1.00 . A A . 17 LEU HD23 1 1 11 4630 1 1 17 LEU HG H 4.418 -0.574 -4.561 1.00 . A A . 17 LEU HG 1 1 11 4631 1 1 17 LEU N N 2.235 1.701 -6.908 1.00 . A A . 17 LEU N 1 1 11 4632 1 1 17 LEU O O 4.956 -0.483 -7.295 1.00 . A A . 17 LEU O 1 1 11 4633 1 1 18 VAL C C 4.188 0.186 -10.570 1.00 . A A . 18 VAL C 1 1 11 4634 1 1 18 VAL CA C 3.572 -0.886 -9.681 1.00 . A A . 18 VAL CA 1 1 11 4635 1 1 18 VAL CB C 2.369 -1.573 -10.368 1.00 . A A . 18 VAL CB 1 1 11 4636 1 1 18 VAL CG1 C 2.861 -2.405 -11.574 1.00 . A A . 18 VAL CG1 1 1 11 4637 1 1 18 VAL CG2 C 1.680 -2.511 -9.353 1.00 . A A . 18 VAL CG2 1 1 11 4638 1 1 18 VAL H H 2.195 0.235 -8.527 1.00 . A A . 18 VAL H 1 1 11 4639 1 1 18 VAL HA H 4.329 -1.589 -9.387 1.00 . A A . 18 VAL HA 1 1 11 4640 1 1 18 VAL HB H 1.664 -0.828 -10.707 1.00 . A A . 18 VAL HB 1 1 11 4641 1 1 18 VAL HG11 H 3.776 -2.927 -11.332 1.00 . A A . 18 VAL HG11 1 1 11 4642 1 1 18 VAL HG12 H 2.117 -3.132 -11.864 1.00 . A A . 18 VAL HG12 1 1 11 4643 1 1 18 VAL HG13 H 3.044 -1.754 -12.415 1.00 . A A . 18 VAL HG13 1 1 11 4644 1 1 18 VAL HG21 H 2.404 -3.177 -8.906 1.00 . A A . 18 VAL HG21 1 1 11 4645 1 1 18 VAL HG22 H 1.213 -1.929 -8.571 1.00 . A A . 18 VAL HG22 1 1 11 4646 1 1 18 VAL HG23 H 0.921 -3.102 -9.843 1.00 . A A . 18 VAL HG23 1 1 11 4647 1 1 18 VAL N N 3.091 -0.157 -8.483 1.00 . A A . 18 VAL N 1 1 11 4648 1 1 18 VAL O O 5.216 -0.026 -11.181 1.00 . A A . 18 VAL O 1 1 11 4649 1 1 19 PHE C C 5.485 2.769 -11.024 1.00 . A A . 19 PHE C 1 1 11 4650 1 1 19 PHE CA C 4.030 2.465 -11.430 1.00 . A A . 19 PHE CA 1 1 11 4651 1 1 19 PHE CB C 3.107 3.675 -11.176 1.00 . A A . 19 PHE CB 1 1 11 4652 1 1 19 PHE CD1 C 3.628 5.243 -13.100 1.00 . A A . 19 PHE CD1 1 1 11 4653 1 1 19 PHE CD2 C 4.350 5.870 -10.915 1.00 . A A . 19 PHE CD2 1 1 11 4654 1 1 19 PHE CE1 C 4.173 6.402 -13.613 1.00 . A A . 19 PHE CE1 1 1 11 4655 1 1 19 PHE CE2 C 4.895 7.029 -11.428 1.00 . A A . 19 PHE CE2 1 1 11 4656 1 1 19 PHE CG C 3.712 4.968 -11.747 1.00 . A A . 19 PHE CG 1 1 11 4657 1 1 19 PHE CZ C 4.806 7.296 -12.777 1.00 . A A . 19 PHE CZ 1 1 11 4658 1 1 19 PHE H H 2.717 1.414 -10.056 1.00 . A A . 19 PHE H 1 1 11 4659 1 1 19 PHE HA H 4.006 2.177 -12.470 1.00 . A A . 19 PHE HA 1 1 11 4660 1 1 19 PHE HB2 H 2.162 3.503 -11.668 1.00 . A A . 19 PHE HB2 1 1 11 4661 1 1 19 PHE HB3 H 2.930 3.802 -10.117 1.00 . A A . 19 PHE HB3 1 1 11 4662 1 1 19 PHE HD1 H 3.133 4.547 -13.762 1.00 . A A . 19 PHE HD1 1 1 11 4663 1 1 19 PHE HD2 H 4.423 5.669 -9.857 1.00 . A A . 19 PHE HD2 1 1 11 4664 1 1 19 PHE HE1 H 4.102 6.609 -14.671 1.00 . A A . 19 PHE HE1 1 1 11 4665 1 1 19 PHE HE2 H 5.391 7.729 -10.771 1.00 . A A . 19 PHE HE2 1 1 11 4666 1 1 19 PHE HZ H 5.233 8.204 -13.178 1.00 . A A . 19 PHE HZ 1 1 11 4667 1 1 19 PHE N N 3.534 1.323 -10.597 1.00 . A A . 19 PHE N 1 1 11 4668 1 1 19 PHE O O 6.276 3.255 -11.811 1.00 . A A . 19 PHE O 1 1 11 4669 1 1 20 PHE C C 7.947 1.418 -9.515 1.00 . A A . 20 PHE C 1 1 11 4670 1 1 20 PHE CA C 7.118 2.663 -9.202 1.00 . A A . 20 PHE CA 1 1 11 4671 1 1 20 PHE CB C 6.942 2.869 -7.682 1.00 . A A . 20 PHE CB 1 1 11 4672 1 1 20 PHE CD1 C 9.248 3.934 -7.415 1.00 . A A . 20 PHE CD1 1 1 11 4673 1 1 20 PHE CD2 C 8.536 2.352 -5.781 1.00 . A A . 20 PHE CD2 1 1 11 4674 1 1 20 PHE CE1 C 10.437 4.101 -6.735 1.00 . A A . 20 PHE CE1 1 1 11 4675 1 1 20 PHE CE2 C 9.726 2.520 -5.101 1.00 . A A . 20 PHE CE2 1 1 11 4676 1 1 20 PHE CG C 8.283 3.058 -6.945 1.00 . A A . 20 PHE CG 1 1 11 4677 1 1 20 PHE CZ C 10.677 3.395 -5.578 1.00 . A A . 20 PHE CZ 1 1 11 4678 1 1 20 PHE H H 5.079 2.062 -9.217 1.00 . A A . 20 PHE H 1 1 11 4679 1 1 20 PHE HA H 7.577 3.520 -9.664 1.00 . A A . 20 PHE HA 1 1 11 4680 1 1 20 PHE HB2 H 6.338 3.749 -7.514 1.00 . A A . 20 PHE HB2 1 1 11 4681 1 1 20 PHE HB3 H 6.425 2.019 -7.260 1.00 . A A . 20 PHE HB3 1 1 11 4682 1 1 20 PHE HD1 H 9.076 4.493 -8.321 1.00 . A A . 20 PHE HD1 1 1 11 4683 1 1 20 PHE HD2 H 7.802 1.660 -5.396 1.00 . A A . 20 PHE HD2 1 1 11 4684 1 1 20 PHE HE1 H 11.181 4.788 -7.112 1.00 . A A . 20 PHE HE1 1 1 11 4685 1 1 20 PHE HE2 H 9.911 1.963 -4.194 1.00 . A A . 20 PHE HE2 1 1 11 4686 1 1 20 PHE HZ H 11.608 3.526 -5.045 1.00 . A A . 20 PHE HZ 1 1 11 4687 1 1 20 PHE N N 5.770 2.454 -9.786 1.00 . A A . 20 PHE N 1 1 11 4688 1 1 20 PHE O O 9.095 1.522 -9.890 1.00 . A A . 20 PHE O 1 1 11 4689 1 1 21 ALA C C 8.746 -1.052 -10.974 1.00 . A A . 21 ALA C 1 1 11 4690 1 1 21 ALA CA C 8.020 -1.031 -9.629 1.00 . A A . 21 ALA CA 1 1 11 4691 1 1 21 ALA CB C 6.990 -2.165 -9.600 1.00 . A A . 21 ALA CB 1 1 11 4692 1 1 21 ALA H H 6.396 0.277 -9.073 1.00 . A A . 21 ALA H 1 1 11 4693 1 1 21 ALA HA H 8.743 -1.197 -8.850 1.00 . A A . 21 ALA HA 1 1 11 4694 1 1 21 ALA HB1 H 6.395 -2.099 -8.702 1.00 . A A . 21 ALA HB1 1 1 11 4695 1 1 21 ALA HB2 H 6.341 -2.116 -10.460 1.00 . A A . 21 ALA HB2 1 1 11 4696 1 1 21 ALA HB3 H 7.499 -3.117 -9.606 1.00 . A A . 21 ALA HB3 1 1 11 4697 1 1 21 ALA N N 7.330 0.272 -9.363 1.00 . A A . 21 ALA N 1 1 11 4698 1 1 21 ALA O O 9.886 -1.461 -11.046 1.00 . A A . 21 ALA O 1 1 11 4699 1 1 22 GLU C C 10.004 0.092 -13.395 1.00 . A A . 22 GLU C 1 1 11 4700 1 1 22 GLU CA C 8.609 -0.549 -13.374 1.00 . A A . 22 GLU CA 1 1 11 4701 1 1 22 GLU CB C 7.650 0.268 -14.275 1.00 . A A . 22 GLU CB 1 1 11 4702 1 1 22 GLU CD C 5.496 -0.978 -13.892 1.00 . A A . 22 GLU CD 1 1 11 4703 1 1 22 GLU CG C 6.597 -0.659 -14.919 1.00 . A A . 22 GLU CG 1 1 11 4704 1 1 22 GLU H H 7.139 -0.293 -11.794 1.00 . A A . 22 GLU H 1 1 11 4705 1 1 22 GLU HA H 8.700 -1.561 -13.736 1.00 . A A . 22 GLU HA 1 1 11 4706 1 1 22 GLU HB2 H 7.162 1.036 -13.690 1.00 . A A . 22 GLU HB2 1 1 11 4707 1 1 22 GLU HB3 H 8.209 0.752 -15.062 1.00 . A A . 22 GLU HB3 1 1 11 4708 1 1 22 GLU HG2 H 6.151 -0.166 -15.772 1.00 . A A . 22 GLU HG2 1 1 11 4709 1 1 22 GLU HG3 H 7.050 -1.580 -15.254 1.00 . A A . 22 GLU HG3 1 1 11 4710 1 1 22 GLU N N 8.049 -0.600 -11.982 1.00 . A A . 22 GLU N 1 1 11 4711 1 1 22 GLU O O 10.894 -0.351 -14.095 1.00 . A A . 22 GLU O 1 1 11 4712 1 1 22 GLU OE1 O 5.691 -1.941 -13.168 1.00 . A A . 22 GLU OE1 1 1 11 4713 1 1 22 GLU OE2 O 4.524 -0.238 -13.890 1.00 . A A . 22 GLU OE2 1 1 11 4714 1 1 23 ASP C C 12.384 1.167 -11.555 1.00 . A A . 23 ASP C 1 1 11 4715 1 1 23 ASP CA C 11.390 1.891 -12.480 1.00 . A A . 23 ASP CA 1 1 11 4716 1 1 23 ASP CB C 11.014 3.309 -11.941 1.00 . A A . 23 ASP CB 1 1 11 4717 1 1 23 ASP CG C 11.916 3.753 -10.768 1.00 . A A . 23 ASP CG 1 1 11 4718 1 1 23 ASP H H 9.346 1.400 -12.083 1.00 . A A . 23 ASP H 1 1 11 4719 1 1 23 ASP HA H 11.825 1.980 -13.457 1.00 . A A . 23 ASP HA 1 1 11 4720 1 1 23 ASP HB2 H 11.097 4.031 -12.739 1.00 . A A . 23 ASP HB2 1 1 11 4721 1 1 23 ASP HB3 H 9.985 3.306 -11.606 1.00 . A A . 23 ASP HB3 1 1 11 4722 1 1 23 ASP N N 10.121 1.125 -12.606 1.00 . A A . 23 ASP N 1 1 11 4723 1 1 23 ASP O O 13.539 0.989 -11.886 1.00 . A A . 23 ASP O 1 1 11 4724 1 1 23 ASP OD1 O 13.032 4.153 -11.055 1.00 . A A . 23 ASP OD1 1 1 11 4725 1 1 23 ASP OD2 O 11.434 3.661 -9.652 1.00 . A A . 23 ASP OD2 1 1 11 4726 1 1 24 VAL C C 13.431 -1.105 -9.948 1.00 . A A . 24 VAL C 1 1 11 4727 1 1 24 VAL CA C 12.639 0.069 -9.364 1.00 . A A . 24 VAL CA 1 1 11 4728 1 1 24 VAL CB C 11.658 -0.437 -8.279 1.00 . A A . 24 VAL CB 1 1 11 4729 1 1 24 VAL CG1 C 12.434 -1.048 -7.091 1.00 . A A . 24 VAL CG1 1 1 11 4730 1 1 24 VAL CG2 C 10.774 0.712 -7.728 1.00 . A A . 24 VAL CG2 1 1 11 4731 1 1 24 VAL H H 10.920 0.978 -10.268 1.00 . A A . 24 VAL H 1 1 11 4732 1 1 24 VAL HA H 13.305 0.760 -8.893 1.00 . A A . 24 VAL HA 1 1 11 4733 1 1 24 VAL HB H 11.038 -1.188 -8.730 1.00 . A A . 24 VAL HB 1 1 11 4734 1 1 24 VAL HG11 H 13.086 -0.307 -6.654 1.00 . A A . 24 VAL HG11 1 1 11 4735 1 1 24 VAL HG12 H 11.736 -1.384 -6.336 1.00 . A A . 24 VAL HG12 1 1 11 4736 1 1 24 VAL HG13 H 13.025 -1.890 -7.414 1.00 . A A . 24 VAL HG13 1 1 11 4737 1 1 24 VAL HG21 H 10.853 1.599 -8.335 1.00 . A A . 24 VAL HG21 1 1 11 4738 1 1 24 VAL HG22 H 9.739 0.405 -7.703 1.00 . A A . 24 VAL HG22 1 1 11 4739 1 1 24 VAL HG23 H 11.067 0.974 -6.724 1.00 . A A . 24 VAL HG23 1 1 11 4740 1 1 24 VAL N N 11.861 0.784 -10.420 1.00 . A A . 24 VAL N 1 1 11 4741 1 1 24 VAL O O 14.620 -1.220 -9.736 1.00 . A A . 24 VAL O 1 1 11 4742 1 1 25 GLY C C 14.227 -3.957 -10.324 1.00 . A A . 25 GLY C 1 1 11 4743 1 1 25 GLY CA C 13.359 -3.148 -11.309 1.00 . A A . 25 GLY CA 1 1 11 4744 1 1 25 GLY H H 11.778 -1.766 -10.790 1.00 . A A . 25 GLY H 1 1 11 4745 1 1 25 GLY HA2 H 12.573 -3.786 -11.682 1.00 . A A . 25 GLY HA2 1 1 11 4746 1 1 25 GLY HA3 H 13.973 -2.826 -12.137 1.00 . A A . 25 GLY HA3 1 1 11 4747 1 1 25 GLY N N 12.733 -1.943 -10.669 1.00 . A A . 25 GLY N 1 1 11 4748 1 1 25 GLY O O 15.099 -4.698 -10.734 1.00 . A A . 25 GLY O 1 1 11 4749 1 1 26 SER C C 16.214 -4.242 -8.009 1.00 . A A . 26 SER C 1 1 11 4750 1 1 26 SER CA C 14.689 -4.484 -7.955 1.00 . A A . 26 SER CA 1 1 11 4751 1 1 26 SER CB C 14.390 -6.002 -8.052 1.00 . A A . 26 SER CB 1 1 11 4752 1 1 26 SER H H 13.223 -3.167 -8.816 1.00 . A A . 26 SER H 1 1 11 4753 1 1 26 SER HA H 14.322 -4.099 -7.015 1.00 . A A . 26 SER HA 1 1 11 4754 1 1 26 SER HB2 H 13.359 -6.192 -8.312 1.00 . A A . 26 SER HB2 1 1 11 4755 1 1 26 SER HB3 H 15.046 -6.502 -8.749 1.00 . A A . 26 SER HB3 1 1 11 4756 1 1 26 SER HG H 15.394 -7.075 -6.777 1.00 . A A . 26 SER HG 1 1 11 4757 1 1 26 SER N N 13.948 -3.782 -9.053 1.00 . A A . 26 SER N 1 1 11 4758 1 1 26 SER O O 16.976 -5.026 -7.475 1.00 . A A . 26 SER O 1 1 11 4759 1 1 26 SER OG O 14.638 -6.484 -6.738 1.00 . A A . 26 SER OG 1 1 11 4760 1 1 27 ASN C C 18.326 -1.336 -8.566 1.00 . A A . 27 ASN C 1 1 11 4761 1 1 27 ASN CA C 18.074 -2.834 -8.763 1.00 . A A . 27 ASN CA 1 1 11 4762 1 1 27 ASN CB C 18.590 -3.243 -10.159 1.00 . A A . 27 ASN CB 1 1 11 4763 1 1 27 ASN CG C 18.283 -4.716 -10.464 1.00 . A A . 27 ASN CG 1 1 11 4764 1 1 27 ASN H H 15.963 -2.562 -9.050 1.00 . A A . 27 ASN H 1 1 11 4765 1 1 27 ASN HA H 18.621 -3.362 -7.998 1.00 . A A . 27 ASN HA 1 1 11 4766 1 1 27 ASN HB2 H 18.124 -2.631 -10.917 1.00 . A A . 27 ASN HB2 1 1 11 4767 1 1 27 ASN HB3 H 19.659 -3.102 -10.207 1.00 . A A . 27 ASN HB3 1 1 11 4768 1 1 27 ASN HD21 H 19.035 -5.382 -8.751 1.00 . A A . 27 ASN HD21 1 1 11 4769 1 1 27 ASN HD22 H 18.412 -6.577 -9.786 1.00 . A A . 27 ASN HD22 1 1 11 4770 1 1 27 ASN N N 16.617 -3.167 -8.645 1.00 . A A . 27 ASN N 1 1 11 4771 1 1 27 ASN ND2 N 18.603 -5.635 -9.594 1.00 . A A . 27 ASN ND2 1 1 11 4772 1 1 27 ASN O O 19.358 -0.949 -8.055 1.00 . A A . 27 ASN O 1 1 11 4773 1 1 27 ASN OD1 O 17.747 -5.046 -11.504 1.00 . A A . 27 ASN OD1 1 1 11 4774 1 1 28 LYS C C 15.999 1.471 -8.754 1.00 . A A . 28 LYS C 1 1 11 4775 1 1 28 LYS CA C 17.449 0.941 -8.870 1.00 . A A . 28 LYS CA 1 1 11 4776 1 1 28 LYS CB C 18.156 1.511 -10.145 1.00 . A A . 28 LYS CB 1 1 11 4777 1 1 28 LYS CD C 20.131 0.144 -10.967 1.00 . A A . 28 LYS CD 1 1 11 4778 1 1 28 LYS CE C 21.495 -0.404 -10.502 1.00 . A A . 28 LYS CE 1 1 11 4779 1 1 28 LYS CG C 19.695 1.329 -10.069 1.00 . A A . 28 LYS CG 1 1 11 4780 1 1 28 LYS H H 16.561 -0.936 -9.369 1.00 . A A . 28 LYS H 1 1 11 4781 1 1 28 LYS HA H 17.998 1.207 -7.977 1.00 . A A . 28 LYS HA 1 1 11 4782 1 1 28 LYS HB2 H 17.761 1.022 -11.023 1.00 . A A . 28 LYS HB2 1 1 11 4783 1 1 28 LYS HB3 H 17.939 2.566 -10.223 1.00 . A A . 28 LYS HB3 1 1 11 4784 1 1 28 LYS HD2 H 19.397 -0.646 -10.932 1.00 . A A . 28 LYS HD2 1 1 11 4785 1 1 28 LYS HD3 H 20.214 0.482 -11.990 1.00 . A A . 28 LYS HD3 1 1 11 4786 1 1 28 LYS HE2 H 22.288 0.269 -10.795 1.00 . A A . 28 LYS HE2 1 1 11 4787 1 1 28 LYS HE3 H 21.520 -0.527 -9.430 1.00 . A A . 28 LYS HE3 1 1 11 4788 1 1 28 LYS HG2 H 20.168 2.231 -10.430 1.00 . A A . 28 LYS HG2 1 1 11 4789 1 1 28 LYS HG3 H 20.008 1.176 -9.046 1.00 . A A . 28 LYS HG3 1 1 11 4790 1 1 28 LYS HZ1 H 20.947 -1.989 -11.743 1.00 . A A . 28 LYS HZ1 1 1 11 4791 1 1 28 LYS HZ2 H 22.616 -1.683 -11.698 1.00 . A A . 28 LYS HZ2 1 1 11 4792 1 1 28 LYS HZ3 H 21.858 -2.447 -10.385 1.00 . A A . 28 LYS HZ3 1 1 11 4793 1 1 28 LYS N N 17.368 -0.547 -8.980 1.00 . A A . 28 LYS N 1 1 11 4794 1 1 28 LYS NZ N 21.747 -1.730 -11.131 1.00 . A A . 28 LYS NZ 1 1 11 4795 1 1 28 LYS O O 15.394 1.734 -9.784 1.00 . A A . 28 LYS O 1 1 11 4796 1 1 28 LYS OXT O 15.568 1.580 -7.619 1.00 . A A . 28 LYS OXT 1 1 12 4797 1 1 1 ASP C C -10.440 -8.910 -23.302 1.00 . A A . 1 ASP C 1 1 12 4798 1 1 1 ASP CA C -11.418 -9.405 -24.370 1.00 . A A . 1 ASP CA 1 1 12 4799 1 1 1 ASP CB C -12.881 -9.218 -23.891 1.00 . A A . 1 ASP CB 1 1 12 4800 1 1 1 ASP CG C -13.081 -7.809 -23.298 1.00 . A A . 1 ASP CG 1 1 12 4801 1 1 1 ASP H1 H -10.377 -11.173 -24.026 1.00 . A A . 1 ASP H1 1 1 12 4802 1 1 1 ASP H2 H -12.013 -11.403 -24.415 1.00 . A A . 1 ASP H2 1 1 12 4803 1 1 1 ASP H3 H -10.900 -10.982 -25.627 1.00 . A A . 1 ASP H3 1 1 12 4804 1 1 1 ASP HA H -11.245 -8.855 -25.280 1.00 . A A . 1 ASP HA 1 1 12 4805 1 1 1 ASP HB2 H -13.558 -9.344 -24.725 1.00 . A A . 1 ASP HB2 1 1 12 4806 1 1 1 ASP HB3 H -13.124 -9.959 -23.142 1.00 . A A . 1 ASP HB3 1 1 12 4807 1 1 1 ASP N N -11.159 -10.849 -24.630 1.00 . A A . 1 ASP N 1 1 12 4808 1 1 1 ASP O O -9.653 -8.016 -23.540 1.00 . A A . 1 ASP O 1 1 12 4809 1 1 1 ASP OD1 O -13.263 -6.902 -24.094 1.00 . A A . 1 ASP OD1 1 1 12 4810 1 1 1 ASP OD2 O -13.035 -7.721 -22.080 1.00 . A A . 1 ASP OD2 1 1 12 4811 1 1 2 ALA C C -8.620 -10.288 -20.804 1.00 . A A . 2 ALA C 1 1 12 4812 1 1 2 ALA CA C -9.670 -9.180 -20.990 1.00 . A A . 2 ALA CA 1 1 12 4813 1 1 2 ALA CB C -10.576 -9.045 -19.757 1.00 . A A . 2 ALA CB 1 1 12 4814 1 1 2 ALA H H -11.212 -10.234 -22.071 1.00 . A A . 2 ALA H 1 1 12 4815 1 1 2 ALA HA H -9.164 -8.244 -21.175 1.00 . A A . 2 ALA HA 1 1 12 4816 1 1 2 ALA HB1 H -11.176 -9.935 -19.638 1.00 . A A . 2 ALA HB1 1 1 12 4817 1 1 2 ALA HB2 H -9.981 -8.896 -18.868 1.00 . A A . 2 ALA HB2 1 1 12 4818 1 1 2 ALA HB3 H -11.236 -8.199 -19.878 1.00 . A A . 2 ALA HB3 1 1 12 4819 1 1 2 ALA N N -10.541 -9.526 -22.155 1.00 . A A . 2 ALA N 1 1 12 4820 1 1 2 ALA O O -8.504 -10.897 -19.758 1.00 . A A . 2 ALA O 1 1 12 4821 1 1 3 GLU C C -5.471 -10.980 -21.343 1.00 . A A . 3 GLU C 1 1 12 4822 1 1 3 GLU CA C -6.801 -11.556 -21.847 1.00 . A A . 3 GLU CA 1 1 12 4823 1 1 3 GLU CB C -6.626 -12.112 -23.287 1.00 . A A . 3 GLU CB 1 1 12 4824 1 1 3 GLU CD C -8.270 -11.264 -25.059 1.00 . A A . 3 GLU CD 1 1 12 4825 1 1 3 GLU CG C -8.005 -12.337 -23.975 1.00 . A A . 3 GLU CG 1 1 12 4826 1 1 3 GLU H H -8.017 -9.974 -22.665 1.00 . A A . 3 GLU H 1 1 12 4827 1 1 3 GLU HA H -7.093 -12.348 -21.175 1.00 . A A . 3 GLU HA 1 1 12 4828 1 1 3 GLU HB2 H -6.022 -11.433 -23.872 1.00 . A A . 3 GLU HB2 1 1 12 4829 1 1 3 GLU HB3 H -6.103 -13.055 -23.231 1.00 . A A . 3 GLU HB3 1 1 12 4830 1 1 3 GLU HG2 H -8.007 -13.313 -24.439 1.00 . A A . 3 GLU HG2 1 1 12 4831 1 1 3 GLU HG3 H -8.811 -12.309 -23.256 1.00 . A A . 3 GLU HG3 1 1 12 4832 1 1 3 GLU N N -7.872 -10.507 -21.857 1.00 . A A . 3 GLU N 1 1 12 4833 1 1 3 GLU O O -4.406 -11.443 -21.710 1.00 . A A . 3 GLU O 1 1 12 4834 1 1 3 GLU OE1 O -8.057 -10.097 -24.770 1.00 . A A . 3 GLU OE1 1 1 12 4835 1 1 3 GLU OE2 O -8.683 -11.677 -26.130 1.00 . A A . 3 GLU OE2 1 1 12 4836 1 1 4 PHE C C -4.356 -9.511 -18.402 1.00 . A A . 4 PHE C 1 1 12 4837 1 1 4 PHE CA C -4.388 -9.300 -19.919 1.00 . A A . 4 PHE CA 1 1 12 4838 1 1 4 PHE CB C -4.459 -7.780 -20.267 1.00 . A A . 4 PHE CB 1 1 12 4839 1 1 4 PHE CD1 C -4.801 -8.099 -22.771 1.00 . A A . 4 PHE CD1 1 1 12 4840 1 1 4 PHE CD2 C -6.419 -6.820 -21.573 1.00 . A A . 4 PHE CD2 1 1 12 4841 1 1 4 PHE CE1 C -5.513 -7.909 -23.937 1.00 . A A . 4 PHE CE1 1 1 12 4842 1 1 4 PHE CE2 C -7.130 -6.628 -22.741 1.00 . A A . 4 PHE CE2 1 1 12 4843 1 1 4 PHE CG C -5.248 -7.557 -21.577 1.00 . A A . 4 PHE CG 1 1 12 4844 1 1 4 PHE CZ C -6.678 -7.173 -23.923 1.00 . A A . 4 PHE CZ 1 1 12 4845 1 1 4 PHE H H -6.485 -9.681 -20.261 1.00 . A A . 4 PHE H 1 1 12 4846 1 1 4 PHE HA H -3.496 -9.748 -20.323 1.00 . A A . 4 PHE HA 1 1 12 4847 1 1 4 PHE HB2 H -4.946 -7.233 -19.472 1.00 . A A . 4 PHE HB2 1 1 12 4848 1 1 4 PHE HB3 H -3.461 -7.383 -20.392 1.00 . A A . 4 PHE HB3 1 1 12 4849 1 1 4 PHE HD1 H -3.889 -8.676 -22.794 1.00 . A A . 4 PHE HD1 1 1 12 4850 1 1 4 PHE HD2 H -6.783 -6.389 -20.652 1.00 . A A . 4 PHE HD2 1 1 12 4851 1 1 4 PHE HE1 H -5.157 -8.335 -24.863 1.00 . A A . 4 PHE HE1 1 1 12 4852 1 1 4 PHE HE2 H -8.043 -6.052 -22.728 1.00 . A A . 4 PHE HE2 1 1 12 4853 1 1 4 PHE HZ H -7.234 -7.025 -24.838 1.00 . A A . 4 PHE HZ 1 1 12 4854 1 1 4 PHE N N -5.587 -9.983 -20.506 1.00 . A A . 4 PHE N 1 1 12 4855 1 1 4 PHE O O -3.746 -8.764 -17.661 1.00 . A A . 4 PHE O 1 1 12 4856 1 1 5 ARG C C -5.698 -12.366 -16.428 1.00 . A A . 5 ARG C 1 1 12 4857 1 1 5 ARG CA C -5.137 -10.948 -16.571 1.00 . A A . 5 ARG CA 1 1 12 4858 1 1 5 ARG CB C -6.055 -9.924 -15.837 1.00 . A A . 5 ARG CB 1 1 12 4859 1 1 5 ARG CD C -8.433 -10.832 -15.559 1.00 . A A . 5 ARG CD 1 1 12 4860 1 1 5 ARG CG C -7.498 -9.948 -16.428 1.00 . A A . 5 ARG CG 1 1 12 4861 1 1 5 ARG CZ C -9.516 -12.307 -17.202 1.00 . A A . 5 ARG CZ 1 1 12 4862 1 1 5 ARG H H -5.484 -11.093 -18.688 1.00 . A A . 5 ARG H 1 1 12 4863 1 1 5 ARG HA H -4.139 -10.972 -16.185 1.00 . A A . 5 ARG HA 1 1 12 4864 1 1 5 ARG HB2 H -6.073 -10.139 -14.779 1.00 . A A . 5 ARG HB2 1 1 12 4865 1 1 5 ARG HB3 H -5.645 -8.932 -15.960 1.00 . A A . 5 ARG HB3 1 1 12 4866 1 1 5 ARG HD2 H -8.002 -11.019 -14.587 1.00 . A A . 5 ARG HD2 1 1 12 4867 1 1 5 ARG HD3 H -9.388 -10.348 -15.415 1.00 . A A . 5 ARG HD3 1 1 12 4868 1 1 5 ARG HE H -8.093 -12.917 -15.967 1.00 . A A . 5 ARG HE 1 1 12 4869 1 1 5 ARG HG2 H -7.886 -8.941 -16.451 1.00 . A A . 5 ARG HG2 1 1 12 4870 1 1 5 ARG HG3 H -7.481 -10.318 -17.443 1.00 . A A . 5 ARG HG3 1 1 12 4871 1 1 5 ARG HH11 H -10.156 -10.406 -17.167 1.00 . A A . 5 ARG HH11 1 1 12 4872 1 1 5 ARG HH12 H -10.925 -11.435 -18.328 1.00 . A A . 5 ARG HH12 1 1 12 4873 1 1 5 ARG HH21 H -9.050 -14.241 -17.431 1.00 . A A . 5 ARG HH21 1 1 12 4874 1 1 5 ARG HH22 H -10.287 -13.641 -18.481 1.00 . A A . 5 ARG HH22 1 1 12 4875 1 1 5 ARG N N -5.034 -10.555 -18.008 1.00 . A A . 5 ARG N 1 1 12 4876 1 1 5 ARG NE N -8.636 -12.150 -16.243 1.00 . A A . 5 ARG NE 1 1 12 4877 1 1 5 ARG NH1 N -10.256 -11.305 -17.596 1.00 . A A . 5 ARG NH1 1 1 12 4878 1 1 5 ARG NH2 N -9.627 -13.488 -17.747 1.00 . A A . 5 ARG NH2 1 1 12 4879 1 1 5 ARG O O -5.966 -12.842 -15.342 1.00 . A A . 5 ARG O 1 1 12 4880 1 1 6 HIS C C -5.246 -15.354 -17.351 1.00 . A A . 6 HIS C 1 1 12 4881 1 1 6 HIS CA C -6.378 -14.370 -17.657 1.00 . A A . 6 HIS CA 1 1 12 4882 1 1 6 HIS CB C -6.932 -14.577 -19.081 1.00 . A A . 6 HIS CB 1 1 12 4883 1 1 6 HIS CD2 C -8.304 -16.700 -18.265 1.00 . A A . 6 HIS CD2 1 1 12 4884 1 1 6 HIS CE1 C -8.235 -17.791 -20.025 1.00 . A A . 6 HIS CE1 1 1 12 4885 1 1 6 HIS CG C -7.596 -15.955 -19.193 1.00 . A A . 6 HIS CG 1 1 12 4886 1 1 6 HIS H H -5.588 -12.507 -18.372 1.00 . A A . 6 HIS H 1 1 12 4887 1 1 6 HIS HA H -7.158 -14.480 -16.924 1.00 . A A . 6 HIS HA 1 1 12 4888 1 1 6 HIS HB2 H -7.669 -13.820 -19.307 1.00 . A A . 6 HIS HB2 1 1 12 4889 1 1 6 HIS HB3 H -6.138 -14.513 -19.812 1.00 . A A . 6 HIS HB3 1 1 12 4890 1 1 6 HIS HD1 H -7.168 -16.453 -21.105 1.00 . A A . 6 HIS HD1 1 1 12 4891 1 1 6 HIS HD2 H -8.509 -16.394 -17.249 1.00 . A A . 6 HIS HD2 1 1 12 4892 1 1 6 HIS HE1 H -8.376 -18.574 -20.755 1.00 . A A . 6 HIS HE1 1 1 12 4893 1 1 6 HIS N N -5.846 -12.984 -17.565 1.00 . A A . 6 HIS N 1 1 12 4894 1 1 6 HIS ND1 N -7.594 -16.691 -20.255 1.00 . A A . 6 HIS ND1 1 1 12 4895 1 1 6 HIS NE2 N -8.695 -17.839 -18.800 1.00 . A A . 6 HIS NE2 1 1 12 4896 1 1 6 HIS O O -5.357 -16.198 -16.484 1.00 . A A . 6 HIS O 1 1 12 4897 1 1 7 ASP C C -1.774 -15.238 -18.497 1.00 . A A . 7 ASP C 1 1 12 4898 1 1 7 ASP CA C -2.970 -16.043 -17.962 1.00 . A A . 7 ASP CA 1 1 12 4899 1 1 7 ASP CB C -3.143 -17.378 -18.782 1.00 . A A . 7 ASP CB 1 1 12 4900 1 1 7 ASP CG C -4.550 -17.504 -19.399 1.00 . A A . 7 ASP CG 1 1 12 4901 1 1 7 ASP H H -4.186 -14.483 -18.775 1.00 . A A . 7 ASP H 1 1 12 4902 1 1 7 ASP HA H -2.808 -16.225 -16.915 1.00 . A A . 7 ASP HA 1 1 12 4903 1 1 7 ASP HB2 H -2.420 -17.439 -19.582 1.00 . A A . 7 ASP HB2 1 1 12 4904 1 1 7 ASP HB3 H -2.974 -18.219 -18.123 1.00 . A A . 7 ASP HB3 1 1 12 4905 1 1 7 ASP N N -4.188 -15.189 -18.100 1.00 . A A . 7 ASP N 1 1 12 4906 1 1 7 ASP O O -0.763 -15.780 -18.903 1.00 . A A . 7 ASP O 1 1 12 4907 1 1 7 ASP OD1 O -4.738 -16.903 -20.445 1.00 . A A . 7 ASP OD1 1 1 12 4908 1 1 7 ASP OD2 O -5.356 -18.188 -18.791 1.00 . A A . 7 ASP OD2 1 1 12 4909 1 1 8 SER C C -0.060 -12.532 -17.754 1.00 . A A . 8 SER C 1 1 12 4910 1 1 8 SER CA C -0.918 -12.980 -18.940 1.00 . A A . 8 SER CA 1 1 12 4911 1 1 8 SER CB C -1.630 -11.777 -19.582 1.00 . A A . 8 SER CB 1 1 12 4912 1 1 8 SER H H -2.803 -13.602 -18.113 1.00 . A A . 8 SER H 1 1 12 4913 1 1 8 SER HA H -0.286 -13.466 -19.664 1.00 . A A . 8 SER HA 1 1 12 4914 1 1 8 SER HB2 H -2.292 -12.099 -20.372 1.00 . A A . 8 SER HB2 1 1 12 4915 1 1 8 SER HB3 H -2.179 -11.203 -18.850 1.00 . A A . 8 SER HB3 1 1 12 4916 1 1 8 SER HG H 0.252 -11.397 -19.976 1.00 . A A . 8 SER HG 1 1 12 4917 1 1 8 SER N N -1.955 -13.942 -18.466 1.00 . A A . 8 SER N 1 1 12 4918 1 1 8 SER O O 1.151 -12.478 -17.838 1.00 . A A . 8 SER O 1 1 12 4919 1 1 8 SER OG O -0.596 -10.974 -20.136 1.00 . A A . 8 SER OG 1 1 12 4920 1 1 9 GLY C C -1.042 -10.970 -14.565 1.00 . A A . 9 GLY C 1 1 12 4921 1 1 9 GLY CA C -0.068 -11.768 -15.433 1.00 . A A . 9 GLY CA 1 1 12 4922 1 1 9 GLY H H -1.720 -12.300 -16.714 1.00 . A A . 9 GLY H 1 1 12 4923 1 1 9 GLY HA2 H 0.275 -12.629 -14.879 1.00 . A A . 9 GLY HA2 1 1 12 4924 1 1 9 GLY HA3 H 0.774 -11.141 -15.685 1.00 . A A . 9 GLY HA3 1 1 12 4925 1 1 9 GLY N N -0.744 -12.225 -16.683 1.00 . A A . 9 GLY N 1 1 12 4926 1 1 9 GLY O O -0.697 -9.902 -14.094 1.00 . A A . 9 GLY O 1 1 12 4927 1 1 10 TYR C C -3.410 -9.359 -13.734 1.00 . A A . 10 TYR C 1 1 12 4928 1 1 10 TYR CA C -3.310 -10.891 -13.563 1.00 . A A . 10 TYR CA 1 1 12 4929 1 1 10 TYR CB C -3.060 -11.303 -12.058 1.00 . A A . 10 TYR CB 1 1 12 4930 1 1 10 TYR CD1 C -1.277 -9.760 -11.087 1.00 . A A . 10 TYR CD1 1 1 12 4931 1 1 10 TYR CD2 C -0.656 -11.988 -11.650 1.00 . A A . 10 TYR CD2 1 1 12 4932 1 1 10 TYR CE1 C 0.013 -9.513 -10.669 1.00 . A A . 10 TYR CE1 1 1 12 4933 1 1 10 TYR CE2 C 0.631 -11.735 -11.231 1.00 . A A . 10 TYR CE2 1 1 12 4934 1 1 10 TYR CG C -1.626 -11.003 -11.583 1.00 . A A . 10 TYR CG 1 1 12 4935 1 1 10 TYR CZ C 0.975 -10.496 -10.738 1.00 . A A . 10 TYR CZ 1 1 12 4936 1 1 10 TYR H H -2.399 -12.389 -14.809 1.00 . A A . 10 TYR H 1 1 12 4937 1 1 10 TYR HA H -4.260 -11.305 -13.854 1.00 . A A . 10 TYR HA 1 1 12 4938 1 1 10 TYR HB2 H -3.758 -10.815 -11.394 1.00 . A A . 10 TYR HB2 1 1 12 4939 1 1 10 TYR HB3 H -3.226 -12.367 -11.968 1.00 . A A . 10 TYR HB3 1 1 12 4940 1 1 10 TYR HD1 H -2.016 -8.975 -11.024 1.00 . A A . 10 TYR HD1 1 1 12 4941 1 1 10 TYR HD2 H -0.908 -12.965 -12.035 1.00 . A A . 10 TYR HD2 1 1 12 4942 1 1 10 TYR HE1 H 0.276 -8.541 -10.284 1.00 . A A . 10 TYR HE1 1 1 12 4943 1 1 10 TYR HE2 H 1.375 -12.513 -11.290 1.00 . A A . 10 TYR HE2 1 1 12 4944 1 1 10 TYR HH H 2.318 -10.443 -9.382 1.00 . A A . 10 TYR HH 1 1 12 4945 1 1 10 TYR N N -2.221 -11.523 -14.386 1.00 . A A . 10 TYR N 1 1 12 4946 1 1 10 TYR O O -3.116 -8.837 -14.793 1.00 . A A . 10 TYR O 1 1 12 4947 1 1 10 TYR OH O 2.266 -10.243 -10.320 1.00 . A A . 10 TYR OH 1 1 12 4948 1 1 11 GLU C C -4.028 -6.822 -11.241 1.00 . A A . 11 GLU C 1 1 12 4949 1 1 11 GLU CA C -3.975 -7.208 -12.707 1.00 . A A . 11 GLU CA 1 1 12 4950 1 1 11 GLU CB C -5.283 -6.805 -13.421 1.00 . A A . 11 GLU CB 1 1 12 4951 1 1 11 GLU CD C -6.661 -4.921 -12.428 1.00 . A A . 11 GLU CD 1 1 12 4952 1 1 11 GLU CG C -5.466 -5.262 -13.336 1.00 . A A . 11 GLU CG 1 1 12 4953 1 1 11 GLU H H -4.048 -9.164 -11.870 1.00 . A A . 11 GLU H 1 1 12 4954 1 1 11 GLU HA H -3.101 -6.753 -13.156 1.00 . A A . 11 GLU HA 1 1 12 4955 1 1 11 GLU HB2 H -5.223 -7.096 -14.460 1.00 . A A . 11 GLU HB2 1 1 12 4956 1 1 11 GLU HB3 H -6.122 -7.321 -12.975 1.00 . A A . 11 GLU HB3 1 1 12 4957 1 1 11 GLU HG2 H -4.582 -4.784 -12.935 1.00 . A A . 11 GLU HG2 1 1 12 4958 1 1 11 GLU HG3 H -5.645 -4.862 -14.323 1.00 . A A . 11 GLU HG3 1 1 12 4959 1 1 11 GLU N N -3.827 -8.689 -12.695 1.00 . A A . 11 GLU N 1 1 12 4960 1 1 11 GLU O O -4.828 -7.328 -10.478 1.00 . A A . 11 GLU O 1 1 12 4961 1 1 11 GLU OE1 O -6.473 -5.017 -11.226 1.00 . A A . 11 GLU OE1 1 1 12 4962 1 1 11 GLU OE2 O -7.694 -4.585 -12.983 1.00 . A A . 11 GLU OE2 1 1 12 4963 1 1 12 VAL C C -3.947 -4.206 -9.262 1.00 . A A . 12 VAL C 1 1 12 4964 1 1 12 VAL CA C -3.047 -5.419 -9.525 1.00 . A A . 12 VAL CA 1 1 12 4965 1 1 12 VAL CB C -1.581 -5.085 -9.299 1.00 . A A . 12 VAL CB 1 1 12 4966 1 1 12 VAL CG1 C -1.353 -4.532 -7.878 1.00 . A A . 12 VAL CG1 1 1 12 4967 1 1 12 VAL CG2 C -0.727 -6.351 -9.511 1.00 . A A . 12 VAL CG2 1 1 12 4968 1 1 12 VAL H H -2.547 -5.561 -11.591 1.00 . A A . 12 VAL H 1 1 12 4969 1 1 12 VAL HA H -3.316 -6.226 -8.879 1.00 . A A . 12 VAL HA 1 1 12 4970 1 1 12 VAL HB H -1.328 -4.363 -10.051 1.00 . A A . 12 VAL HB 1 1 12 4971 1 1 12 VAL HG11 H -1.872 -5.142 -7.152 1.00 . A A . 12 VAL HG11 1 1 12 4972 1 1 12 VAL HG12 H -0.300 -4.524 -7.641 1.00 . A A . 12 VAL HG12 1 1 12 4973 1 1 12 VAL HG13 H -1.729 -3.523 -7.821 1.00 . A A . 12 VAL HG13 1 1 12 4974 1 1 12 VAL HG21 H -1.115 -7.174 -8.928 1.00 . A A . 12 VAL HG21 1 1 12 4975 1 1 12 VAL HG22 H -0.750 -6.629 -10.556 1.00 . A A . 12 VAL HG22 1 1 12 4976 1 1 12 VAL HG23 H 0.299 -6.173 -9.228 1.00 . A A . 12 VAL HG23 1 1 12 4977 1 1 12 VAL N N -3.152 -5.919 -10.913 1.00 . A A . 12 VAL N 1 1 12 4978 1 1 12 VAL O O -4.411 -4.015 -8.155 1.00 . A A . 12 VAL O 1 1 12 4979 1 1 13 HIS C C -4.233 -1.014 -9.647 1.00 . A A . 13 HIS C 1 1 12 4980 1 1 13 HIS CA C -4.996 -2.192 -10.273 1.00 . A A . 13 HIS CA 1 1 12 4981 1 1 13 HIS CB C -6.311 -2.421 -9.453 1.00 . A A . 13 HIS CB 1 1 12 4982 1 1 13 HIS CD2 C -7.932 -0.595 -10.478 1.00 . A A . 13 HIS CD2 1 1 12 4983 1 1 13 HIS CE1 C -9.198 -1.869 -11.515 1.00 . A A . 13 HIS CE1 1 1 12 4984 1 1 13 HIS CG C -7.491 -1.889 -10.267 1.00 . A A . 13 HIS CG 1 1 12 4985 1 1 13 HIS H H -3.728 -3.691 -11.148 1.00 . A A . 13 HIS H 1 1 12 4986 1 1 13 HIS HA H -5.232 -1.935 -11.296 1.00 . A A . 13 HIS HA 1 1 12 4987 1 1 13 HIS HB2 H -6.484 -3.468 -9.257 1.00 . A A . 13 HIS HB2 1 1 12 4988 1 1 13 HIS HB3 H -6.280 -1.898 -8.509 1.00 . A A . 13 HIS HB3 1 1 12 4989 1 1 13 HIS HD1 H -8.283 -3.599 -10.996 1.00 . A A . 13 HIS HD1 1 1 12 4990 1 1 13 HIS HD2 H -7.473 0.291 -10.065 1.00 . A A . 13 HIS HD2 1 1 12 4991 1 1 13 HIS HE1 H -10.000 -2.243 -12.135 1.00 . A A . 13 HIS HE1 1 1 12 4992 1 1 13 HIS N N -4.153 -3.435 -10.303 1.00 . A A . 13 HIS N 1 1 12 4993 1 1 13 HIS ND1 N -8.318 -2.622 -10.936 1.00 . A A . 13 HIS ND1 1 1 12 4994 1 1 13 HIS NE2 N -8.996 -0.600 -11.257 1.00 . A A . 13 HIS NE2 1 1 12 4995 1 1 13 HIS O O -4.431 0.116 -10.046 1.00 . A A . 13 HIS O 1 1 12 4996 1 1 14 HIS C C -1.420 0.166 -8.912 1.00 . A A . 14 HIS C 1 1 12 4997 1 1 14 HIS CA C -2.586 -0.252 -8.002 1.00 . A A . 14 HIS CA 1 1 12 4998 1 1 14 HIS CB C -2.057 -0.814 -6.663 1.00 . A A . 14 HIS CB 1 1 12 4999 1 1 14 HIS CD2 C -4.146 -0.845 -5.032 1.00 . A A . 14 HIS CD2 1 1 12 5000 1 1 14 HIS CE1 C -4.546 -2.878 -5.097 1.00 . A A . 14 HIS CE1 1 1 12 5001 1 1 14 HIS CG C -3.214 -1.430 -5.871 1.00 . A A . 14 HIS CG 1 1 12 5002 1 1 14 HIS H H -3.274 -2.236 -8.404 1.00 . A A . 14 HIS H 1 1 12 5003 1 1 14 HIS HA H -3.223 0.597 -7.817 1.00 . A A . 14 HIS HA 1 1 12 5004 1 1 14 HIS HB2 H -1.305 -1.571 -6.828 1.00 . A A . 14 HIS HB2 1 1 12 5005 1 1 14 HIS HB3 H -1.629 -0.015 -6.080 1.00 . A A . 14 HIS HB3 1 1 12 5006 1 1 14 HIS HD1 H -3.052 -3.385 -6.364 1.00 . A A . 14 HIS HD1 1 1 12 5007 1 1 14 HIS HD2 H -4.193 0.208 -4.798 1.00 . A A . 14 HIS HD2 1 1 12 5008 1 1 14 HIS HE1 H -4.998 -3.844 -4.923 1.00 . A A . 14 HIS HE1 1 1 12 5009 1 1 14 HIS N N -3.388 -1.309 -8.687 1.00 . A A . 14 HIS N 1 1 12 5010 1 1 14 HIS ND1 N -3.521 -2.685 -5.864 1.00 . A A . 14 HIS ND1 1 1 12 5011 1 1 14 HIS NE2 N -4.969 -1.761 -4.559 1.00 . A A . 14 HIS NE2 1 1 12 5012 1 1 14 HIS O O -0.288 -0.244 -8.736 1.00 . A A . 14 HIS O 1 1 12 5013 1 1 15 GLN C C 0.158 2.612 -10.283 1.00 . A A . 15 GLN C 1 1 12 5014 1 1 15 GLN CA C -0.750 1.505 -10.855 1.00 . A A . 15 GLN CA 1 1 12 5015 1 1 15 GLN CB C -1.538 2.011 -12.085 1.00 . A A . 15 GLN CB 1 1 12 5016 1 1 15 GLN CD C -3.484 1.309 -13.515 1.00 . A A . 15 GLN CD 1 1 12 5017 1 1 15 GLN CG C -2.238 0.813 -12.773 1.00 . A A . 15 GLN CG 1 1 12 5018 1 1 15 GLN H H -2.686 1.286 -9.943 1.00 . A A . 15 GLN H 1 1 12 5019 1 1 15 GLN HA H -0.113 0.682 -11.146 1.00 . A A . 15 GLN HA 1 1 12 5020 1 1 15 GLN HB2 H -2.268 2.742 -11.767 1.00 . A A . 15 GLN HB2 1 1 12 5021 1 1 15 GLN HB3 H -0.866 2.479 -12.790 1.00 . A A . 15 GLN HB3 1 1 12 5022 1 1 15 GLN HE21 H -4.727 0.753 -12.071 1.00 . A A . 15 GLN HE21 1 1 12 5023 1 1 15 GLN HE22 H -5.458 1.484 -13.416 1.00 . A A . 15 GLN HE22 1 1 12 5024 1 1 15 GLN HG2 H -1.570 0.352 -13.486 1.00 . A A . 15 GLN HG2 1 1 12 5025 1 1 15 GLN HG3 H -2.541 0.066 -12.053 1.00 . A A . 15 GLN HG3 1 1 12 5026 1 1 15 GLN N N -1.754 0.994 -9.869 1.00 . A A . 15 GLN N 1 1 12 5027 1 1 15 GLN NE2 N -4.654 1.171 -12.954 1.00 . A A . 15 GLN NE2 1 1 12 5028 1 1 15 GLN O O 0.566 3.522 -10.978 1.00 . A A . 15 GLN O 1 1 12 5029 1 1 15 GLN OE1 O -3.403 1.827 -14.611 1.00 . A A . 15 GLN OE1 1 1 12 5030 1 1 16 PHE C C 2.429 2.560 -7.717 1.00 . A A . 16 PHE C 1 1 12 5031 1 1 16 PHE CA C 1.306 3.436 -8.270 1.00 . A A . 16 PHE CA 1 1 12 5032 1 1 16 PHE CB C 0.486 4.093 -7.132 1.00 . A A . 16 PHE CB 1 1 12 5033 1 1 16 PHE CD1 C 2.327 5.655 -6.333 1.00 . A A . 16 PHE CD1 1 1 12 5034 1 1 16 PHE CD2 C 1.381 4.139 -4.756 1.00 . A A . 16 PHE CD2 1 1 12 5035 1 1 16 PHE CE1 C 3.170 6.145 -5.356 1.00 . A A . 16 PHE CE1 1 1 12 5036 1 1 16 PHE CE2 C 2.223 4.627 -3.778 1.00 . A A . 16 PHE CE2 1 1 12 5037 1 1 16 PHE CG C 1.425 4.647 -6.041 1.00 . A A . 16 PHE CG 1 1 12 5038 1 1 16 PHE CZ C 3.119 5.631 -4.078 1.00 . A A . 16 PHE CZ 1 1 12 5039 1 1 16 PHE H H 0.066 1.721 -8.524 1.00 . A A . 16 PHE H 1 1 12 5040 1 1 16 PHE HA H 1.725 4.161 -8.946 1.00 . A A . 16 PHE HA 1 1 12 5041 1 1 16 PHE HB2 H -0.101 4.908 -7.529 1.00 . A A . 16 PHE HB2 1 1 12 5042 1 1 16 PHE HB3 H -0.182 3.368 -6.691 1.00 . A A . 16 PHE HB3 1 1 12 5043 1 1 16 PHE HD1 H 2.375 6.064 -7.331 1.00 . A A . 16 PHE HD1 1 1 12 5044 1 1 16 PHE HD2 H 0.682 3.353 -4.510 1.00 . A A . 16 PHE HD2 1 1 12 5045 1 1 16 PHE HE1 H 3.871 6.931 -5.593 1.00 . A A . 16 PHE HE1 1 1 12 5046 1 1 16 PHE HE2 H 2.180 4.223 -2.778 1.00 . A A . 16 PHE HE2 1 1 12 5047 1 1 16 PHE HZ H 3.778 6.013 -3.313 1.00 . A A . 16 PHE HZ 1 1 12 5048 1 1 16 PHE N N 0.438 2.479 -9.014 1.00 . A A . 16 PHE N 1 1 12 5049 1 1 16 PHE O O 3.598 2.864 -7.849 1.00 . A A . 16 PHE O 1 1 12 5050 1 1 17 LEU C C 3.602 -0.210 -7.689 1.00 . A A . 17 LEU C 1 1 12 5051 1 1 17 LEU CA C 2.956 0.509 -6.516 1.00 . A A . 17 LEU CA 1 1 12 5052 1 1 17 LEU CB C 2.181 -0.479 -5.622 1.00 . A A . 17 LEU CB 1 1 12 5053 1 1 17 LEU CD1 C 0.317 0.615 -4.286 1.00 . A A . 17 LEU CD1 1 1 12 5054 1 1 17 LEU CD2 C 2.075 -0.730 -3.100 1.00 . A A . 17 LEU CD2 1 1 12 5055 1 1 17 LEU CG C 1.808 0.226 -4.282 1.00 . A A . 17 LEU CG 1 1 12 5056 1 1 17 LEU H H 1.048 1.310 -7.057 1.00 . A A . 17 LEU H 1 1 12 5057 1 1 17 LEU HA H 3.706 1.046 -5.969 1.00 . A A . 17 LEU HA 1 1 12 5058 1 1 17 LEU HB2 H 1.292 -0.815 -6.138 1.00 . A A . 17 LEU HB2 1 1 12 5059 1 1 17 LEU HB3 H 2.804 -1.341 -5.432 1.00 . A A . 17 LEU HB3 1 1 12 5060 1 1 17 LEU HD11 H 0.082 1.184 -5.174 1.00 . A A . 17 LEU HD11 1 1 12 5061 1 1 17 LEU HD12 H -0.304 -0.269 -4.262 1.00 . A A . 17 LEU HD12 1 1 12 5062 1 1 17 LEU HD13 H 0.091 1.219 -3.419 1.00 . A A . 17 LEU HD13 1 1 12 5063 1 1 17 LEU HD21 H 1.515 -1.647 -3.220 1.00 . A A . 17 LEU HD21 1 1 12 5064 1 1 17 LEU HD22 H 3.127 -0.970 -3.048 1.00 . A A . 17 LEU HD22 1 1 12 5065 1 1 17 LEU HD23 H 1.781 -0.264 -2.171 1.00 . A A . 17 LEU HD23 1 1 12 5066 1 1 17 LEU HG H 2.402 1.119 -4.149 1.00 . A A . 17 LEU HG 1 1 12 5067 1 1 17 LEU N N 2.006 1.481 -7.112 1.00 . A A . 17 LEU N 1 1 12 5068 1 1 17 LEU O O 4.801 -0.389 -7.745 1.00 . A A . 17 LEU O 1 1 12 5069 1 1 18 VAL C C 4.095 -0.319 -10.636 1.00 . A A . 18 VAL C 1 1 12 5070 1 1 18 VAL CA C 3.272 -1.309 -9.821 1.00 . A A . 18 VAL CA 1 1 12 5071 1 1 18 VAL CB C 2.053 -1.842 -10.603 1.00 . A A . 18 VAL CB 1 1 12 5072 1 1 18 VAL CG1 C 2.478 -2.448 -11.967 1.00 . A A . 18 VAL CG1 1 1 12 5073 1 1 18 VAL CG2 C 1.434 -2.945 -9.733 1.00 . A A . 18 VAL CG2 1 1 12 5074 1 1 18 VAL H H 1.808 -0.425 -8.526 1.00 . A A . 18 VAL H 1 1 12 5075 1 1 18 VAL HA H 3.911 -2.109 -9.494 1.00 . A A . 18 VAL HA 1 1 12 5076 1 1 18 VAL HB H 1.336 -1.050 -10.758 1.00 . A A . 18 VAL HB 1 1 12 5077 1 1 18 VAL HG11 H 3.527 -2.704 -11.972 1.00 . A A . 18 VAL HG11 1 1 12 5078 1 1 18 VAL HG12 H 1.909 -3.340 -12.185 1.00 . A A . 18 VAL HG12 1 1 12 5079 1 1 18 VAL HG13 H 2.290 -1.732 -12.752 1.00 . A A . 18 VAL HG13 1 1 12 5080 1 1 18 VAL HG21 H 2.170 -3.712 -9.535 1.00 . A A . 18 VAL HG21 1 1 12 5081 1 1 18 VAL HG22 H 1.106 -2.531 -8.790 1.00 . A A . 18 VAL HG22 1 1 12 5082 1 1 18 VAL HG23 H 0.592 -3.386 -10.240 1.00 . A A . 18 VAL HG23 1 1 12 5083 1 1 18 VAL N N 2.766 -0.598 -8.616 1.00 . A A . 18 VAL N 1 1 12 5084 1 1 18 VAL O O 5.098 -0.679 -11.218 1.00 . A A . 18 VAL O 1 1 12 5085 1 1 19 PHE C C 5.826 2.006 -10.824 1.00 . A A . 19 PHE C 1 1 12 5086 1 1 19 PHE CA C 4.418 1.944 -11.422 1.00 . A A . 19 PHE CA 1 1 12 5087 1 1 19 PHE CB C 3.728 3.315 -11.297 1.00 . A A . 19 PHE CB 1 1 12 5088 1 1 19 PHE CD1 C 4.800 4.579 -13.220 1.00 . A A . 19 PHE CD1 1 1 12 5089 1 1 19 PHE CD2 C 5.403 5.199 -10.998 1.00 . A A . 19 PHE CD2 1 1 12 5090 1 1 19 PHE CE1 C 5.649 5.543 -13.720 1.00 . A A . 19 PHE CE1 1 1 12 5091 1 1 19 PHE CE2 C 6.255 6.162 -11.498 1.00 . A A . 19 PHE CE2 1 1 12 5092 1 1 19 PHE CG C 4.669 4.399 -11.855 1.00 . A A . 19 PHE CG 1 1 12 5093 1 1 19 PHE CZ C 6.378 6.334 -12.859 1.00 . A A . 19 PHE CZ 1 1 12 5094 1 1 19 PHE H H 2.844 1.147 -10.153 1.00 . A A . 19 PHE H 1 1 12 5095 1 1 19 PHE HA H 4.487 1.641 -12.452 1.00 . A A . 19 PHE HA 1 1 12 5096 1 1 19 PHE HB2 H 2.816 3.318 -11.874 1.00 . A A . 19 PHE HB2 1 1 12 5097 1 1 19 PHE HB3 H 3.496 3.538 -10.267 1.00 . A A . 19 PHE HB3 1 1 12 5098 1 1 19 PHE HD1 H 4.233 3.961 -13.902 1.00 . A A . 19 PHE HD1 1 1 12 5099 1 1 19 PHE HD2 H 5.313 5.069 -9.929 1.00 . A A . 19 PHE HD2 1 1 12 5100 1 1 19 PHE HE1 H 5.746 5.676 -14.788 1.00 . A A . 19 PHE HE1 1 1 12 5101 1 1 19 PHE HE2 H 6.824 6.782 -10.822 1.00 . A A . 19 PHE HE2 1 1 12 5102 1 1 19 PHE HZ H 7.045 7.089 -13.251 1.00 . A A . 19 PHE HZ 1 1 12 5103 1 1 19 PHE N N 3.657 0.916 -10.650 1.00 . A A . 19 PHE N 1 1 12 5104 1 1 19 PHE O O 6.798 2.153 -11.533 1.00 . A A . 19 PHE O 1 1 12 5105 1 1 20 PHE C C 7.976 0.720 -9.294 1.00 . A A . 20 PHE C 1 1 12 5106 1 1 20 PHE CA C 7.178 1.914 -8.802 1.00 . A A . 20 PHE CA 1 1 12 5107 1 1 20 PHE CB C 6.914 1.820 -7.274 1.00 . A A . 20 PHE CB 1 1 12 5108 1 1 20 PHE CD1 C 7.564 4.227 -6.809 1.00 . A A . 20 PHE CD1 1 1 12 5109 1 1 20 PHE CD2 C 8.646 2.517 -5.545 1.00 . A A . 20 PHE CD2 1 1 12 5110 1 1 20 PHE CE1 C 8.293 5.186 -6.136 1.00 . A A . 20 PHE CE1 1 1 12 5111 1 1 20 PHE CE2 C 9.373 3.476 -4.873 1.00 . A A . 20 PHE CE2 1 1 12 5112 1 1 20 PHE CG C 7.732 2.884 -6.520 1.00 . A A . 20 PHE CG 1 1 12 5113 1 1 20 PHE CZ C 9.198 4.811 -5.168 1.00 . A A . 20 PHE CZ 1 1 12 5114 1 1 20 PHE H H 5.063 1.739 -9.016 1.00 . A A . 20 PHE H 1 1 12 5115 1 1 20 PHE HA H 7.700 2.815 -9.073 1.00 . A A . 20 PHE HA 1 1 12 5116 1 1 20 PHE HB2 H 5.868 1.988 -7.062 1.00 . A A . 20 PHE HB2 1 1 12 5117 1 1 20 PHE HB3 H 7.181 0.842 -6.898 1.00 . A A . 20 PHE HB3 1 1 12 5118 1 1 20 PHE HD1 H 6.857 4.528 -7.566 1.00 . A A . 20 PHE HD1 1 1 12 5119 1 1 20 PHE HD2 H 8.793 1.473 -5.306 1.00 . A A . 20 PHE HD2 1 1 12 5120 1 1 20 PHE HE1 H 8.152 6.231 -6.369 1.00 . A A . 20 PHE HE1 1 1 12 5121 1 1 20 PHE HE2 H 10.083 3.181 -4.114 1.00 . A A . 20 PHE HE2 1 1 12 5122 1 1 20 PHE HZ H 9.769 5.562 -4.641 1.00 . A A . 20 PHE HZ 1 1 12 5123 1 1 20 PHE N N 5.882 1.874 -9.524 1.00 . A A . 20 PHE N 1 1 12 5124 1 1 20 PHE O O 9.107 0.858 -9.703 1.00 . A A . 20 PHE O 1 1 12 5125 1 1 21 ALA C C 8.685 -1.506 -11.045 1.00 . A A . 21 ALA C 1 1 12 5126 1 1 21 ALA CA C 7.994 -1.681 -9.694 1.00 . A A . 21 ALA CA 1 1 12 5127 1 1 21 ALA CB C 6.910 -2.754 -9.764 1.00 . A A . 21 ALA CB 1 1 12 5128 1 1 21 ALA H H 6.423 -0.441 -8.913 1.00 . A A . 21 ALA H 1 1 12 5129 1 1 21 ALA HA H 8.747 -1.937 -8.972 1.00 . A A . 21 ALA HA 1 1 12 5130 1 1 21 ALA HB1 H 6.212 -2.609 -8.953 1.00 . A A . 21 ALA HB1 1 1 12 5131 1 1 21 ALA HB2 H 6.372 -2.685 -10.697 1.00 . A A . 21 ALA HB2 1 1 12 5132 1 1 21 ALA HB3 H 7.355 -3.732 -9.678 1.00 . A A . 21 ALA HB3 1 1 12 5133 1 1 21 ALA N N 7.343 -0.420 -9.248 1.00 . A A . 21 ALA N 1 1 12 5134 1 1 21 ALA O O 9.845 -1.825 -11.193 1.00 . A A . 21 ALA O 1 1 12 5135 1 1 22 GLU C C 9.607 0.267 -13.333 1.00 . A A . 22 GLU C 1 1 12 5136 1 1 22 GLU CA C 8.455 -0.746 -13.354 1.00 . A A . 22 GLU CA 1 1 12 5137 1 1 22 GLU CB C 7.310 -0.208 -14.227 1.00 . A A . 22 GLU CB 1 1 12 5138 1 1 22 GLU CD C 4.891 -0.591 -14.774 1.00 . A A . 22 GLU CD 1 1 12 5139 1 1 22 GLU CG C 6.207 -1.278 -14.371 1.00 . A A . 22 GLU CG 1 1 12 5140 1 1 22 GLU H H 7.019 -0.751 -11.737 1.00 . A A . 22 GLU H 1 1 12 5141 1 1 22 GLU HA H 8.813 -1.680 -13.751 1.00 . A A . 22 GLU HA 1 1 12 5142 1 1 22 GLU HB2 H 6.903 0.684 -13.773 1.00 . A A . 22 GLU HB2 1 1 12 5143 1 1 22 GLU HB3 H 7.689 0.049 -15.206 1.00 . A A . 22 GLU HB3 1 1 12 5144 1 1 22 GLU HG2 H 6.481 -1.991 -15.136 1.00 . A A . 22 GLU HG2 1 1 12 5145 1 1 22 GLU HG3 H 6.058 -1.810 -13.442 1.00 . A A . 22 GLU HG3 1 1 12 5146 1 1 22 GLU N N 7.937 -0.985 -11.973 1.00 . A A . 22 GLU N 1 1 12 5147 1 1 22 GLU O O 10.568 0.157 -14.069 1.00 . A A . 22 GLU O 1 1 12 5148 1 1 22 GLU OE1 O 4.745 -0.348 -15.961 1.00 . A A . 22 GLU OE1 1 1 12 5149 1 1 22 GLU OE2 O 4.105 -0.345 -13.874 1.00 . A A . 22 GLU OE2 1 1 12 5150 1 1 23 ASP C C 11.439 2.075 -11.129 1.00 . A A . 23 ASP C 1 1 12 5151 1 1 23 ASP CA C 10.414 2.326 -12.256 1.00 . A A . 23 ASP CA 1 1 12 5152 1 1 23 ASP CB C 9.585 3.589 -11.969 1.00 . A A . 23 ASP CB 1 1 12 5153 1 1 23 ASP CG C 8.869 4.069 -13.250 1.00 . A A . 23 ASP CG 1 1 12 5154 1 1 23 ASP H H 8.630 1.213 -11.914 1.00 . A A . 23 ASP H 1 1 12 5155 1 1 23 ASP HA H 10.953 2.465 -13.176 1.00 . A A . 23 ASP HA 1 1 12 5156 1 1 23 ASP HB2 H 8.839 3.360 -11.221 1.00 . A A . 23 ASP HB2 1 1 12 5157 1 1 23 ASP HB3 H 10.214 4.378 -11.591 1.00 . A A . 23 ASP HB3 1 1 12 5158 1 1 23 ASP N N 9.438 1.221 -12.459 1.00 . A A . 23 ASP N 1 1 12 5159 1 1 23 ASP O O 12.126 2.995 -10.728 1.00 . A A . 23 ASP O 1 1 12 5160 1 1 23 ASP OD1 O 7.981 3.357 -13.692 1.00 . A A . 23 ASP OD1 1 1 12 5161 1 1 23 ASP OD2 O 9.252 5.128 -13.721 1.00 . A A . 23 ASP OD2 1 1 12 5162 1 1 24 VAL C C 13.299 -0.740 -9.881 1.00 . A A . 24 VAL C 1 1 12 5163 1 1 24 VAL CA C 12.489 0.525 -9.549 1.00 . A A . 24 VAL CA 1 1 12 5164 1 1 24 VAL CB C 11.686 0.326 -8.235 1.00 . A A . 24 VAL CB 1 1 12 5165 1 1 24 VAL CG1 C 12.610 -0.104 -7.075 1.00 . A A . 24 VAL CG1 1 1 12 5166 1 1 24 VAL CG2 C 10.935 1.622 -7.809 1.00 . A A . 24 VAL CG2 1 1 12 5167 1 1 24 VAL H H 10.949 0.152 -11.015 1.00 . A A . 24 VAL H 1 1 12 5168 1 1 24 VAL HA H 13.169 1.341 -9.395 1.00 . A A . 24 VAL HA 1 1 12 5169 1 1 24 VAL HB H 10.974 -0.453 -8.426 1.00 . A A . 24 VAL HB 1 1 12 5170 1 1 24 VAL HG11 H 13.440 0.583 -6.984 1.00 . A A . 24 VAL HG11 1 1 12 5171 1 1 24 VAL HG12 H 12.056 -0.103 -6.146 1.00 . A A . 24 VAL HG12 1 1 12 5172 1 1 24 VAL HG13 H 12.991 -1.098 -7.245 1.00 . A A . 24 VAL HG13 1 1 12 5173 1 1 24 VAL HG21 H 10.757 2.283 -8.643 1.00 . A A . 24 VAL HG21 1 1 12 5174 1 1 24 VAL HG22 H 9.976 1.342 -7.400 1.00 . A A . 24 VAL HG22 1 1 12 5175 1 1 24 VAL HG23 H 11.479 2.169 -7.054 1.00 . A A . 24 VAL HG23 1 1 12 5176 1 1 24 VAL N N 11.524 0.857 -10.650 1.00 . A A . 24 VAL N 1 1 12 5177 1 1 24 VAL O O 14.498 -0.774 -9.686 1.00 . A A . 24 VAL O 1 1 12 5178 1 1 25 GLY C C 12.289 -3.851 -11.572 1.00 . A A . 25 GLY C 1 1 12 5179 1 1 25 GLY CA C 13.273 -3.028 -10.741 1.00 . A A . 25 GLY CA 1 1 12 5180 1 1 25 GLY H H 11.653 -1.656 -10.520 1.00 . A A . 25 GLY H 1 1 12 5181 1 1 25 GLY HA2 H 14.165 -2.833 -11.312 1.00 . A A . 25 GLY HA2 1 1 12 5182 1 1 25 GLY HA3 H 13.524 -3.569 -9.841 1.00 . A A . 25 GLY HA3 1 1 12 5183 1 1 25 GLY N N 12.616 -1.740 -10.376 1.00 . A A . 25 GLY N 1 1 12 5184 1 1 25 GLY O O 11.283 -4.302 -11.058 1.00 . A A . 25 GLY O 1 1 12 5185 1 1 26 SER C C 12.522 -5.342 -14.941 1.00 . A A . 26 SER C 1 1 12 5186 1 1 26 SER CA C 11.727 -4.806 -13.746 1.00 . A A . 26 SER CA 1 1 12 5187 1 1 26 SER CB C 10.587 -3.890 -14.227 1.00 . A A . 26 SER CB 1 1 12 5188 1 1 26 SER H H 13.432 -3.635 -13.183 1.00 . A A . 26 SER H 1 1 12 5189 1 1 26 SER HA H 11.341 -5.646 -13.196 1.00 . A A . 26 SER HA 1 1 12 5190 1 1 26 SER HB2 H 10.084 -3.422 -13.394 1.00 . A A . 26 SER HB2 1 1 12 5191 1 1 26 SER HB3 H 10.936 -3.139 -14.920 1.00 . A A . 26 SER HB3 1 1 12 5192 1 1 26 SER HG H 8.840 -4.722 -14.429 1.00 . A A . 26 SER HG 1 1 12 5193 1 1 26 SER N N 12.607 -4.022 -12.830 1.00 . A A . 26 SER N 1 1 12 5194 1 1 26 SER O O 12.243 -6.415 -15.442 1.00 . A A . 26 SER O 1 1 12 5195 1 1 26 SER OG O 9.683 -4.764 -14.887 1.00 . A A . 26 SER OG 1 1 12 5196 1 1 27 ASN C C 15.803 -4.526 -16.201 1.00 . A A . 27 ASN C 1 1 12 5197 1 1 27 ASN CA C 14.359 -4.946 -16.512 1.00 . A A . 27 ASN CA 1 1 12 5198 1 1 27 ASN CB C 13.820 -4.230 -17.771 1.00 . A A . 27 ASN CB 1 1 12 5199 1 1 27 ASN CG C 14.372 -4.924 -19.023 1.00 . A A . 27 ASN CG 1 1 12 5200 1 1 27 ASN H H 13.641 -3.718 -14.891 1.00 . A A . 27 ASN H 1 1 12 5201 1 1 27 ASN HA H 14.338 -6.019 -16.641 1.00 . A A . 27 ASN HA 1 1 12 5202 1 1 27 ASN HB2 H 12.741 -4.281 -17.796 1.00 . A A . 27 ASN HB2 1 1 12 5203 1 1 27 ASN HB3 H 14.120 -3.193 -17.780 1.00 . A A . 27 ASN HB3 1 1 12 5204 1 1 27 ASN HD21 H 13.172 -6.495 -18.833 1.00 . A A . 27 ASN HD21 1 1 12 5205 1 1 27 ASN HD22 H 14.222 -6.540 -20.168 1.00 . A A . 27 ASN HD22 1 1 12 5206 1 1 27 ASN N N 13.489 -4.566 -15.355 1.00 . A A . 27 ASN N 1 1 12 5207 1 1 27 ASN ND2 N 13.881 -6.083 -19.371 1.00 . A A . 27 ASN ND2 1 1 12 5208 1 1 27 ASN O O 16.521 -4.023 -17.045 1.00 . A A . 27 ASN O 1 1 12 5209 1 1 27 ASN OD1 O 15.250 -4.421 -19.694 1.00 . A A . 27 ASN OD1 1 1 12 5210 1 1 28 LYS C C 18.595 -5.365 -15.115 1.00 . A A . 28 LYS C 1 1 12 5211 1 1 28 LYS CA C 17.556 -4.406 -14.503 1.00 . A A . 28 LYS CA 1 1 12 5212 1 1 28 LYS CB C 17.604 -4.494 -12.957 1.00 . A A . 28 LYS CB 1 1 12 5213 1 1 28 LYS CD C 16.586 -2.163 -12.615 1.00 . A A . 28 LYS CD 1 1 12 5214 1 1 28 LYS CE C 15.523 -1.704 -13.647 1.00 . A A . 28 LYS CE 1 1 12 5215 1 1 28 LYS CG C 16.448 -3.684 -12.312 1.00 . A A . 28 LYS CG 1 1 12 5216 1 1 28 LYS H H 15.549 -5.169 -14.342 1.00 . A A . 28 LYS H 1 1 12 5217 1 1 28 LYS HA H 17.778 -3.395 -14.817 1.00 . A A . 28 LYS HA 1 1 12 5218 1 1 28 LYS HB2 H 17.518 -5.528 -12.654 1.00 . A A . 28 LYS HB2 1 1 12 5219 1 1 28 LYS HB3 H 18.554 -4.117 -12.605 1.00 . A A . 28 LYS HB3 1 1 12 5220 1 1 28 LYS HD2 H 16.459 -1.610 -11.696 1.00 . A A . 28 LYS HD2 1 1 12 5221 1 1 28 LYS HD3 H 17.573 -1.943 -12.998 1.00 . A A . 28 LYS HD3 1 1 12 5222 1 1 28 LYS HE2 H 15.973 -1.028 -14.358 1.00 . A A . 28 LYS HE2 1 1 12 5223 1 1 28 LYS HE3 H 15.109 -2.542 -14.188 1.00 . A A . 28 LYS HE3 1 1 12 5224 1 1 28 LYS HG2 H 15.498 -4.065 -12.657 1.00 . A A . 28 LYS HG2 1 1 12 5225 1 1 28 LYS HG3 H 16.489 -3.827 -11.242 1.00 . A A . 28 LYS HG3 1 1 12 5226 1 1 28 LYS HZ1 H 14.591 -0.952 -11.938 1.00 . A A . 28 LYS HZ1 1 1 12 5227 1 1 28 LYS HZ2 H 14.337 -0.021 -13.334 1.00 . A A . 28 LYS HZ2 1 1 12 5228 1 1 28 LYS HZ3 H 13.514 -1.494 -13.132 1.00 . A A . 28 LYS HZ3 1 1 12 5229 1 1 28 LYS N N 16.180 -4.758 -14.969 1.00 . A A . 28 LYS N 1 1 12 5230 1 1 28 LYS NZ N 14.407 -0.989 -12.962 1.00 . A A . 28 LYS NZ 1 1 12 5231 1 1 28 LYS O O 19.637 -4.859 -15.500 1.00 . A A . 28 LYS O 1 1 12 5232 1 1 28 LYS OXT O 18.290 -6.546 -15.166 1.00 . A A . 28 LYS OXT 1 1 13 5233 1 1 1 ASP C C -12.798 -13.190 11.873 1.00 . A A . 1 ASP C 1 1 13 5234 1 1 1 ASP CA C -12.807 -13.361 13.397 1.00 . A A . 1 ASP CA 1 1 13 5235 1 1 1 ASP CB C -12.251 -12.086 14.053 1.00 . A A . 1 ASP CB 1 1 13 5236 1 1 1 ASP CG C -12.777 -12.000 15.496 1.00 . A A . 1 ASP CG 1 1 13 5237 1 1 1 ASP H1 H -11.574 -14.978 12.940 1.00 . A A . 1 ASP H1 1 1 13 5238 1 1 1 ASP H2 H -11.209 -14.221 14.416 1.00 . A A . 1 ASP H2 1 1 13 5239 1 1 1 ASP H3 H -12.571 -15.224 14.292 1.00 . A A . 1 ASP H3 1 1 13 5240 1 1 1 ASP HA H -13.822 -13.542 13.720 1.00 . A A . 1 ASP HA 1 1 13 5241 1 1 1 ASP HB2 H -11.171 -12.108 14.065 1.00 . A A . 1 ASP HB2 1 1 13 5242 1 1 1 ASP HB3 H -12.567 -11.211 13.505 1.00 . A A . 1 ASP HB3 1 1 13 5243 1 1 1 ASP N N -11.977 -14.535 13.789 1.00 . A A . 1 ASP N 1 1 13 5244 1 1 1 ASP O O -11.751 -13.177 11.255 1.00 . A A . 1 ASP O 1 1 13 5245 1 1 1 ASP OD1 O -13.881 -11.503 15.649 1.00 . A A . 1 ASP OD1 1 1 13 5246 1 1 1 ASP OD2 O -12.042 -12.440 16.364 1.00 . A A . 1 ASP OD2 1 1 13 5247 1 1 2 ALA C C -15.526 -12.280 9.574 1.00 . A A . 2 ALA C 1 1 13 5248 1 1 2 ALA CA C -14.139 -12.884 9.845 1.00 . A A . 2 ALA CA 1 1 13 5249 1 1 2 ALA CB C -13.991 -14.264 9.167 1.00 . A A . 2 ALA CB 1 1 13 5250 1 1 2 ALA H H -14.778 -13.080 11.889 1.00 . A A . 2 ALA H 1 1 13 5251 1 1 2 ALA HA H -13.384 -12.200 9.484 1.00 . A A . 2 ALA HA 1 1 13 5252 1 1 2 ALA HB1 H -14.720 -14.954 9.566 1.00 . A A . 2 ALA HB1 1 1 13 5253 1 1 2 ALA HB2 H -14.142 -14.173 8.102 1.00 . A A . 2 ALA HB2 1 1 13 5254 1 1 2 ALA HB3 H -13.002 -14.660 9.342 1.00 . A A . 2 ALA HB3 1 1 13 5255 1 1 2 ALA N N -13.978 -13.060 11.321 1.00 . A A . 2 ALA N 1 1 13 5256 1 1 2 ALA O O -16.304 -12.792 8.789 1.00 . A A . 2 ALA O 1 1 13 5257 1 1 3 GLU C C -17.025 -9.459 8.945 1.00 . A A . 3 GLU C 1 1 13 5258 1 1 3 GLU CA C -17.097 -10.478 10.097 1.00 . A A . 3 GLU CA 1 1 13 5259 1 1 3 GLU CB C -17.427 -9.780 11.443 1.00 . A A . 3 GLU CB 1 1 13 5260 1 1 3 GLU CD C -16.139 -10.608 13.463 1.00 . A A . 3 GLU CD 1 1 13 5261 1 1 3 GLU CG C -17.404 -10.809 12.608 1.00 . A A . 3 GLU CG 1 1 13 5262 1 1 3 GLU H H -15.114 -10.828 10.860 1.00 . A A . 3 GLU H 1 1 13 5263 1 1 3 GLU HA H -17.868 -11.200 9.865 1.00 . A A . 3 GLU HA 1 1 13 5264 1 1 3 GLU HB2 H -16.722 -8.986 11.634 1.00 . A A . 3 GLU HB2 1 1 13 5265 1 1 3 GLU HB3 H -18.414 -9.347 11.381 1.00 . A A . 3 GLU HB3 1 1 13 5266 1 1 3 GLU HG2 H -18.279 -10.670 13.227 1.00 . A A . 3 GLU HG2 1 1 13 5267 1 1 3 GLU HG3 H -17.416 -11.824 12.234 1.00 . A A . 3 GLU HG3 1 1 13 5268 1 1 3 GLU N N -15.788 -11.188 10.247 1.00 . A A . 3 GLU N 1 1 13 5269 1 1 3 GLU O O -17.624 -8.401 8.994 1.00 . A A . 3 GLU O 1 1 13 5270 1 1 3 GLU OE1 O -15.091 -11.021 12.995 1.00 . A A . 3 GLU OE1 1 1 13 5271 1 1 3 GLU OE2 O -16.284 -10.051 14.538 1.00 . A A . 3 GLU OE2 1 1 13 5272 1 1 4 PHE C C -15.555 -7.584 7.020 1.00 . A A . 4 PHE C 1 1 13 5273 1 1 4 PHE CA C -16.068 -8.995 6.709 1.00 . A A . 4 PHE CA 1 1 13 5274 1 1 4 PHE CB C -17.409 -8.917 5.925 1.00 . A A . 4 PHE CB 1 1 13 5275 1 1 4 PHE CD1 C -17.530 -11.245 4.926 1.00 . A A . 4 PHE CD1 1 1 13 5276 1 1 4 PHE CD2 C -19.084 -10.679 6.643 1.00 . A A . 4 PHE CD2 1 1 13 5277 1 1 4 PHE CE1 C -18.082 -12.508 4.842 1.00 . A A . 4 PHE CE1 1 1 13 5278 1 1 4 PHE CE2 C -19.636 -11.941 6.561 1.00 . A A . 4 PHE CE2 1 1 13 5279 1 1 4 PHE CG C -18.028 -10.321 5.827 1.00 . A A . 4 PHE CG 1 1 13 5280 1 1 4 PHE CZ C -19.135 -12.856 5.660 1.00 . A A . 4 PHE CZ 1 1 13 5281 1 1 4 PHE H H -15.833 -10.707 7.983 1.00 . A A . 4 PHE H 1 1 13 5282 1 1 4 PHE HA H -15.315 -9.481 6.111 1.00 . A A . 4 PHE HA 1 1 13 5283 1 1 4 PHE HB2 H -18.107 -8.257 6.421 1.00 . A A . 4 PHE HB2 1 1 13 5284 1 1 4 PHE HB3 H -17.234 -8.545 4.926 1.00 . A A . 4 PHE HB3 1 1 13 5285 1 1 4 PHE HD1 H -16.705 -10.979 4.282 1.00 . A A . 4 PHE HD1 1 1 13 5286 1 1 4 PHE HD2 H -19.484 -9.969 7.352 1.00 . A A . 4 PHE HD2 1 1 13 5287 1 1 4 PHE HE1 H -17.686 -13.223 4.135 1.00 . A A . 4 PHE HE1 1 1 13 5288 1 1 4 PHE HE2 H -20.461 -12.210 7.203 1.00 . A A . 4 PHE HE2 1 1 13 5289 1 1 4 PHE HZ H -19.567 -13.844 5.596 1.00 . A A . 4 PHE HZ 1 1 13 5290 1 1 4 PHE N N -16.277 -9.835 7.936 1.00 . A A . 4 PHE N 1 1 13 5291 1 1 4 PHE O O -15.724 -6.660 6.248 1.00 . A A . 4 PHE O 1 1 13 5292 1 1 5 ARG C C -13.104 -5.739 7.831 1.00 . A A . 5 ARG C 1 1 13 5293 1 1 5 ARG CA C -14.359 -6.152 8.608 1.00 . A A . 5 ARG CA 1 1 13 5294 1 1 5 ARG CB C -14.023 -6.232 10.117 1.00 . A A . 5 ARG CB 1 1 13 5295 1 1 5 ARG CD C -15.204 -6.556 12.347 1.00 . A A . 5 ARG CD 1 1 13 5296 1 1 5 ARG CG C -15.122 -7.014 10.872 1.00 . A A . 5 ARG CG 1 1 13 5297 1 1 5 ARG CZ C -13.595 -8.059 13.440 1.00 . A A . 5 ARG CZ 1 1 13 5298 1 1 5 ARG H H -14.812 -8.265 8.711 1.00 . A A . 5 ARG H 1 1 13 5299 1 1 5 ARG HA H -15.109 -5.414 8.412 1.00 . A A . 5 ARG HA 1 1 13 5300 1 1 5 ARG HB2 H -13.073 -6.728 10.251 1.00 . A A . 5 ARG HB2 1 1 13 5301 1 1 5 ARG HB3 H -13.942 -5.228 10.507 1.00 . A A . 5 ARG HB3 1 1 13 5302 1 1 5 ARG HD2 H -14.548 -5.721 12.555 1.00 . A A . 5 ARG HD2 1 1 13 5303 1 1 5 ARG HD3 H -16.215 -6.257 12.579 1.00 . A A . 5 ARG HD3 1 1 13 5304 1 1 5 ARG HE H -15.553 -8.194 13.696 1.00 . A A . 5 ARG HE 1 1 13 5305 1 1 5 ARG HG2 H -16.078 -6.848 10.397 1.00 . A A . 5 ARG HG2 1 1 13 5306 1 1 5 ARG HG3 H -14.895 -8.069 10.812 1.00 . A A . 5 ARG HG3 1 1 13 5307 1 1 5 ARG HH11 H -12.801 -6.659 12.243 1.00 . A A . 5 ARG HH11 1 1 13 5308 1 1 5 ARG HH12 H -11.670 -7.716 13.017 1.00 . A A . 5 ARG HH12 1 1 13 5309 1 1 5 ARG HH21 H -14.137 -9.532 14.681 1.00 . A A . 5 ARG HH21 1 1 13 5310 1 1 5 ARG HH22 H -12.436 -9.364 14.419 1.00 . A A . 5 ARG HH22 1 1 13 5311 1 1 5 ARG N N -14.919 -7.469 8.156 1.00 . A A . 5 ARG N 1 1 13 5312 1 1 5 ARG NE N -14.840 -7.700 13.241 1.00 . A A . 5 ARG NE 1 1 13 5313 1 1 5 ARG NH1 N -12.613 -7.427 12.854 1.00 . A A . 5 ARG NH1 1 1 13 5314 1 1 5 ARG NH2 N -13.372 -9.062 14.242 1.00 . A A . 5 ARG NH2 1 1 13 5315 1 1 5 ARG O O -12.419 -4.794 8.170 1.00 . A A . 5 ARG O 1 1 13 5316 1 1 6 HIS C C -12.011 -5.175 4.872 1.00 . A A . 6 HIS C 1 1 13 5317 1 1 6 HIS CA C -11.708 -6.284 5.890 1.00 . A A . 6 HIS CA 1 1 13 5318 1 1 6 HIS CB C -11.417 -7.608 5.164 1.00 . A A . 6 HIS CB 1 1 13 5319 1 1 6 HIS CD2 C -12.136 -9.489 6.889 1.00 . A A . 6 HIS CD2 1 1 13 5320 1 1 6 HIS CE1 C -10.247 -10.084 7.496 1.00 . A A . 6 HIS CE1 1 1 13 5321 1 1 6 HIS CG C -11.212 -8.720 6.201 1.00 . A A . 6 HIS CG 1 1 13 5322 1 1 6 HIS H H -13.492 -7.217 6.624 1.00 . A A . 6 HIS H 1 1 13 5323 1 1 6 HIS HA H -10.859 -5.999 6.486 1.00 . A A . 6 HIS HA 1 1 13 5324 1 1 6 HIS HB2 H -12.249 -7.877 4.530 1.00 . A A . 6 HIS HB2 1 1 13 5325 1 1 6 HIS HB3 H -10.525 -7.522 4.561 1.00 . A A . 6 HIS HB3 1 1 13 5326 1 1 6 HIS HD1 H -9.197 -8.802 6.334 1.00 . A A . 6 HIS HD1 1 1 13 5327 1 1 6 HIS HD2 H -13.207 -9.409 6.784 1.00 . A A . 6 HIS HD2 1 1 13 5328 1 1 6 HIS HE1 H -9.445 -10.603 8.002 1.00 . A A . 6 HIS HE1 1 1 13 5329 1 1 6 HIS N N -12.868 -6.491 6.796 1.00 . A A . 6 HIS N 1 1 13 5330 1 1 6 HIS ND1 N -10.068 -9.143 6.626 1.00 . A A . 6 HIS ND1 1 1 13 5331 1 1 6 HIS NE2 N -11.518 -10.332 7.691 1.00 . A A . 6 HIS NE2 1 1 13 5332 1 1 6 HIS O O -11.102 -4.606 4.299 1.00 . A A . 6 HIS O 1 1 13 5333 1 1 7 ASP C C -13.243 -4.186 2.315 1.00 . A A . 7 ASP C 1 1 13 5334 1 1 7 ASP CA C -13.752 -3.856 3.726 1.00 . A A . 7 ASP CA 1 1 13 5335 1 1 7 ASP CB C -13.220 -2.473 4.202 1.00 . A A . 7 ASP CB 1 1 13 5336 1 1 7 ASP CG C -14.013 -1.348 3.512 1.00 . A A . 7 ASP CG 1 1 13 5337 1 1 7 ASP H H -13.959 -5.416 5.179 1.00 . A A . 7 ASP H 1 1 13 5338 1 1 7 ASP HA H -14.831 -3.871 3.710 1.00 . A A . 7 ASP HA 1 1 13 5339 1 1 7 ASP HB2 H -13.345 -2.379 5.272 1.00 . A A . 7 ASP HB2 1 1 13 5340 1 1 7 ASP HB3 H -12.170 -2.366 3.969 1.00 . A A . 7 ASP HB3 1 1 13 5341 1 1 7 ASP N N -13.286 -4.909 4.684 1.00 . A A . 7 ASP N 1 1 13 5342 1 1 7 ASP O O -13.015 -3.322 1.493 1.00 . A A . 7 ASP O 1 1 13 5343 1 1 7 ASP OD1 O -15.147 -1.155 3.918 1.00 . A A . 7 ASP OD1 1 1 13 5344 1 1 7 ASP OD2 O -13.442 -0.746 2.616 1.00 . A A . 7 ASP OD2 1 1 13 5345 1 1 8 SER C C -13.315 -5.415 -0.445 1.00 . A A . 8 SER C 1 1 13 5346 1 1 8 SER CA C -12.607 -6.010 0.786 1.00 . A A . 8 SER CA 1 1 13 5347 1 1 8 SER CB C -12.791 -7.539 0.801 1.00 . A A . 8 SER CB 1 1 13 5348 1 1 8 SER H H -13.317 -6.092 2.815 1.00 . A A . 8 SER H 1 1 13 5349 1 1 8 SER HA H -11.555 -5.779 0.722 1.00 . A A . 8 SER HA 1 1 13 5350 1 1 8 SER HB2 H -13.830 -7.813 0.902 1.00 . A A . 8 SER HB2 1 1 13 5351 1 1 8 SER HB3 H -12.370 -7.998 -0.081 1.00 . A A . 8 SER HB3 1 1 13 5352 1 1 8 SER HG H -11.691 -7.226 2.395 1.00 . A A . 8 SER HG 1 1 13 5353 1 1 8 SER N N -13.096 -5.468 2.093 1.00 . A A . 8 SER N 1 1 13 5354 1 1 8 SER O O -12.784 -5.460 -1.537 1.00 . A A . 8 SER O 1 1 13 5355 1 1 8 SER OG O -12.074 -7.984 1.947 1.00 . A A . 8 SER OG 1 1 13 5356 1 1 9 GLY C C -14.528 -3.143 -2.052 1.00 . A A . 9 GLY C 1 1 13 5357 1 1 9 GLY CA C -15.292 -4.261 -1.325 1.00 . A A . 9 GLY CA 1 1 13 5358 1 1 9 GLY H H -14.849 -4.882 0.688 1.00 . A A . 9 GLY H 1 1 13 5359 1 1 9 GLY HA2 H -15.558 -5.029 -2.037 1.00 . A A . 9 GLY HA2 1 1 13 5360 1 1 9 GLY HA3 H -16.194 -3.844 -0.901 1.00 . A A . 9 GLY HA3 1 1 13 5361 1 1 9 GLY N N -14.489 -4.878 -0.223 1.00 . A A . 9 GLY N 1 1 13 5362 1 1 9 GLY O O -14.781 -2.888 -3.214 1.00 . A A . 9 GLY O 1 1 13 5363 1 1 10 TYR C C -11.786 -1.961 -2.958 1.00 . A A . 10 TYR C 1 1 13 5364 1 1 10 TYR CA C -12.811 -1.409 -1.947 1.00 . A A . 10 TYR CA 1 1 13 5365 1 1 10 TYR CB C -12.114 -0.651 -0.776 1.00 . A A . 10 TYR CB 1 1 13 5366 1 1 10 TYR CD1 C -10.539 -2.590 -0.241 1.00 . A A . 10 TYR CD1 1 1 13 5367 1 1 10 TYR CD2 C -9.637 -0.390 -0.308 1.00 . A A . 10 TYR CD2 1 1 13 5368 1 1 10 TYR CE1 C -9.292 -3.091 0.061 1.00 . A A . 10 TYR CE1 1 1 13 5369 1 1 10 TYR CE2 C -8.391 -0.893 -0.005 1.00 . A A . 10 TYR CE2 1 1 13 5370 1 1 10 TYR CG C -10.726 -1.232 -0.431 1.00 . A A . 10 TYR CG 1 1 13 5371 1 1 10 TYR CZ C -8.209 -2.246 0.182 1.00 . A A . 10 TYR CZ 1 1 13 5372 1 1 10 TYR H H -13.455 -2.758 -0.419 1.00 . A A . 10 TYR H 1 1 13 5373 1 1 10 TYR HA H -13.482 -0.740 -2.459 1.00 . A A . 10 TYR HA 1 1 13 5374 1 1 10 TYR HB2 H -11.997 0.388 -1.050 1.00 . A A . 10 TYR HB2 1 1 13 5375 1 1 10 TYR HB3 H -12.731 -0.697 0.109 1.00 . A A . 10 TYR HB3 1 1 13 5376 1 1 10 TYR HD1 H -11.373 -3.270 -0.331 1.00 . A A . 10 TYR HD1 1 1 13 5377 1 1 10 TYR HD2 H -9.760 0.674 -0.451 1.00 . A A . 10 TYR HD2 1 1 13 5378 1 1 10 TYR HE1 H -9.165 -4.154 0.204 1.00 . A A . 10 TYR HE1 1 1 13 5379 1 1 10 TYR HE2 H -7.552 -0.218 0.086 1.00 . A A . 10 TYR HE2 1 1 13 5380 1 1 10 TYR HH H -6.565 -3.063 -0.332 1.00 . A A . 10 TYR HH 1 1 13 5381 1 1 10 TYR N N -13.618 -2.512 -1.350 1.00 . A A . 10 TYR N 1 1 13 5382 1 1 10 TYR O O -11.714 -3.156 -3.179 1.00 . A A . 10 TYR O 1 1 13 5383 1 1 10 TYR OH O -6.961 -2.749 0.484 1.00 . A A . 10 TYR OH 1 1 13 5384 1 1 11 GLU C C -9.208 -0.184 -4.882 1.00 . A A . 11 GLU C 1 1 13 5385 1 1 11 GLU CA C -9.985 -1.449 -4.534 1.00 . A A . 11 GLU CA 1 1 13 5386 1 1 11 GLU CB C -10.657 -2.035 -5.811 1.00 . A A . 11 GLU CB 1 1 13 5387 1 1 11 GLU CD C -8.516 -3.234 -6.524 1.00 . A A . 11 GLU CD 1 1 13 5388 1 1 11 GLU CG C -9.617 -2.238 -6.947 1.00 . A A . 11 GLU CG 1 1 13 5389 1 1 11 GLU H H -11.125 -0.117 -3.306 1.00 . A A . 11 GLU H 1 1 13 5390 1 1 11 GLU HA H -9.307 -2.164 -4.091 1.00 . A A . 11 GLU HA 1 1 13 5391 1 1 11 GLU HB2 H -11.110 -2.988 -5.580 1.00 . A A . 11 GLU HB2 1 1 13 5392 1 1 11 GLU HB3 H -11.432 -1.365 -6.151 1.00 . A A . 11 GLU HB3 1 1 13 5393 1 1 11 GLU HG2 H -10.122 -2.624 -7.820 1.00 . A A . 11 GLU HG2 1 1 13 5394 1 1 11 GLU HG3 H -9.166 -1.294 -7.213 1.00 . A A . 11 GLU HG3 1 1 13 5395 1 1 11 GLU N N -11.024 -1.065 -3.534 1.00 . A A . 11 GLU N 1 1 13 5396 1 1 11 GLU O O -9.727 0.737 -5.483 1.00 . A A . 11 GLU O 1 1 13 5397 1 1 11 GLU OE1 O -7.549 -2.775 -5.935 1.00 . A A . 11 GLU OE1 1 1 13 5398 1 1 11 GLU OE2 O -8.701 -4.404 -6.813 1.00 . A A . 11 GLU OE2 1 1 13 5399 1 1 12 VAL C C -6.508 0.891 -6.167 1.00 . A A . 12 VAL C 1 1 13 5400 1 1 12 VAL CA C -7.053 0.944 -4.724 1.00 . A A . 12 VAL CA 1 1 13 5401 1 1 12 VAL CB C -5.942 0.839 -3.675 1.00 . A A . 12 VAL CB 1 1 13 5402 1 1 12 VAL CG1 C -4.823 1.882 -3.903 1.00 . A A . 12 VAL CG1 1 1 13 5403 1 1 12 VAL CG2 C -6.564 1.055 -2.281 1.00 . A A . 12 VAL CG2 1 1 13 5404 1 1 12 VAL H H -7.629 -0.982 -3.998 1.00 . A A . 12 VAL H 1 1 13 5405 1 1 12 VAL HA H -7.601 1.847 -4.567 1.00 . A A . 12 VAL HA 1 1 13 5406 1 1 12 VAL HB H -5.558 -0.161 -3.739 1.00 . A A . 12 VAL HB 1 1 13 5407 1 1 12 VAL HG11 H -5.246 2.831 -4.200 1.00 . A A . 12 VAL HG11 1 1 13 5408 1 1 12 VAL HG12 H -4.251 2.025 -2.998 1.00 . A A . 12 VAL HG12 1 1 13 5409 1 1 12 VAL HG13 H -4.153 1.539 -4.679 1.00 . A A . 12 VAL HG13 1 1 13 5410 1 1 12 VAL HG21 H -7.401 0.387 -2.145 1.00 . A A . 12 VAL HG21 1 1 13 5411 1 1 12 VAL HG22 H -5.832 0.856 -1.513 1.00 . A A . 12 VAL HG22 1 1 13 5412 1 1 12 VAL HG23 H -6.915 2.072 -2.181 1.00 . A A . 12 VAL HG23 1 1 13 5413 1 1 12 VAL N N -7.969 -0.200 -4.477 1.00 . A A . 12 VAL N 1 1 13 5414 1 1 12 VAL O O -5.753 1.746 -6.590 1.00 . A A . 12 VAL O 1 1 13 5415 1 1 13 HIS C C -5.038 -0.780 -8.396 1.00 . A A . 13 HIS C 1 1 13 5416 1 1 13 HIS CA C -6.521 -0.383 -8.291 1.00 . A A . 13 HIS CA 1 1 13 5417 1 1 13 HIS CB C -6.793 0.897 -9.130 1.00 . A A . 13 HIS CB 1 1 13 5418 1 1 13 HIS CD2 C -8.025 0.291 -11.398 1.00 . A A . 13 HIS CD2 1 1 13 5419 1 1 13 HIS CE1 C -6.348 0.066 -12.598 1.00 . A A . 13 HIS CE1 1 1 13 5420 1 1 13 HIS CG C -6.911 0.528 -10.612 1.00 . A A . 13 HIS CG 1 1 13 5421 1 1 13 HIS H H -7.534 -0.766 -6.441 1.00 . A A . 13 HIS H 1 1 13 5422 1 1 13 HIS HA H -7.117 -1.203 -8.666 1.00 . A A . 13 HIS HA 1 1 13 5423 1 1 13 HIS HB2 H -7.717 1.360 -8.817 1.00 . A A . 13 HIS HB2 1 1 13 5424 1 1 13 HIS HB3 H -5.990 1.609 -9.016 1.00 . A A . 13 HIS HB3 1 1 13 5425 1 1 13 HIS HD1 H -4.971 0.471 -11.172 1.00 . A A . 13 HIS HD1 1 1 13 5426 1 1 13 HIS HD2 H -9.047 0.334 -11.052 1.00 . A A . 13 HIS HD2 1 1 13 5427 1 1 13 HIS HE1 H -5.711 -0.116 -13.450 1.00 . A A . 13 HIS HE1 1 1 13 5428 1 1 13 HIS N N -6.926 -0.133 -6.870 1.00 . A A . 13 HIS N 1 1 13 5429 1 1 13 HIS ND1 N -5.913 0.373 -11.419 1.00 . A A . 13 HIS ND1 1 1 13 5430 1 1 13 HIS NE2 N -7.656 0.005 -12.631 1.00 . A A . 13 HIS NE2 1 1 13 5431 1 1 13 HIS O O -4.571 -1.061 -9.483 1.00 . A A . 13 HIS O 1 1 13 5432 1 1 14 HIS C C -2.128 -0.890 -8.454 1.00 . A A . 14 HIS C 1 1 13 5433 1 1 14 HIS CA C -2.903 -1.152 -7.159 1.00 . A A . 14 HIS CA 1 1 13 5434 1 1 14 HIS CB C -2.796 -2.660 -6.742 1.00 . A A . 14 HIS CB 1 1 13 5435 1 1 14 HIS CD2 C -4.967 -4.181 -6.778 1.00 . A A . 14 HIS CD2 1 1 13 5436 1 1 14 HIS CE1 C -5.140 -4.418 -8.830 1.00 . A A . 14 HIS CE1 1 1 13 5437 1 1 14 HIS CG C -3.925 -3.488 -7.369 1.00 . A A . 14 HIS CG 1 1 13 5438 1 1 14 HIS H H -4.832 -0.555 -6.441 1.00 . A A . 14 HIS H 1 1 13 5439 1 1 14 HIS HA H -2.465 -0.524 -6.401 1.00 . A A . 14 HIS HA 1 1 13 5440 1 1 14 HIS HB2 H -1.848 -3.080 -7.042 1.00 . A A . 14 HIS HB2 1 1 13 5441 1 1 14 HIS HB3 H -2.876 -2.736 -5.667 1.00 . A A . 14 HIS HB3 1 1 13 5442 1 1 14 HIS HD1 H -3.517 -3.318 -9.340 1.00 . A A . 14 HIS HD1 1 1 13 5443 1 1 14 HIS HD2 H -5.145 -4.242 -5.714 1.00 . A A . 14 HIS HD2 1 1 13 5444 1 1 14 HIS HE1 H -5.495 -4.721 -9.803 1.00 . A A . 14 HIS HE1 1 1 13 5445 1 1 14 HIS N N -4.362 -0.792 -7.265 1.00 . A A . 14 HIS N 1 1 13 5446 1 1 14 HIS ND1 N -4.094 -3.679 -8.635 1.00 . A A . 14 HIS ND1 1 1 13 5447 1 1 14 HIS NE2 N -5.714 -4.753 -7.702 1.00 . A A . 14 HIS NE2 1 1 13 5448 1 1 14 HIS O O -1.699 -1.787 -9.154 1.00 . A A . 14 HIS O 1 1 13 5449 1 1 15 GLN C C -0.319 2.021 -9.584 1.00 . A A . 15 GLN C 1 1 13 5450 1 1 15 GLN CA C -1.274 0.869 -9.918 1.00 . A A . 15 GLN CA 1 1 13 5451 1 1 15 GLN CB C -2.357 1.286 -10.928 1.00 . A A . 15 GLN CB 1 1 13 5452 1 1 15 GLN CD C -4.303 2.860 -11.359 1.00 . A A . 15 GLN CD 1 1 13 5453 1 1 15 GLN CG C -3.283 2.377 -10.317 1.00 . A A . 15 GLN CG 1 1 13 5454 1 1 15 GLN H H -2.372 1.039 -8.083 1.00 . A A . 15 GLN H 1 1 13 5455 1 1 15 GLN HA H -0.674 0.063 -10.316 1.00 . A A . 15 GLN HA 1 1 13 5456 1 1 15 GLN HB2 H -1.886 1.647 -11.828 1.00 . A A . 15 GLN HB2 1 1 13 5457 1 1 15 GLN HB3 H -2.947 0.414 -11.167 1.00 . A A . 15 GLN HB3 1 1 13 5458 1 1 15 GLN HE21 H -5.644 3.366 -9.985 1.00 . A A . 15 GLN HE21 1 1 13 5459 1 1 15 GLN HE22 H -6.113 3.640 -11.593 1.00 . A A . 15 GLN HE22 1 1 13 5460 1 1 15 GLN HG2 H -3.820 1.973 -9.471 1.00 . A A . 15 GLN HG2 1 1 13 5461 1 1 15 GLN HG3 H -2.706 3.227 -9.982 1.00 . A A . 15 GLN HG3 1 1 13 5462 1 1 15 GLN N N -1.992 0.385 -8.706 1.00 . A A . 15 GLN N 1 1 13 5463 1 1 15 GLN NE2 N -5.448 3.327 -10.944 1.00 . A A . 15 GLN NE2 1 1 13 5464 1 1 15 GLN O O -0.058 2.886 -10.398 1.00 . A A . 15 GLN O 1 1 13 5465 1 1 15 GLN OE1 O -4.079 2.821 -12.552 1.00 . A A . 15 GLN OE1 1 1 13 5466 1 1 16 PHE C C 2.388 2.245 -7.490 1.00 . A A . 16 PHE C 1 1 13 5467 1 1 16 PHE CA C 1.120 3.005 -7.858 1.00 . A A . 16 PHE CA 1 1 13 5468 1 1 16 PHE CB C 0.519 3.688 -6.616 1.00 . A A . 16 PHE CB 1 1 13 5469 1 1 16 PHE CD1 C 1.749 5.903 -6.472 1.00 . A A . 16 PHE CD1 1 1 13 5470 1 1 16 PHE CD2 C 2.369 4.180 -4.946 1.00 . A A . 16 PHE CD2 1 1 13 5471 1 1 16 PHE CE1 C 2.699 6.736 -5.918 1.00 . A A . 16 PHE CE1 1 1 13 5472 1 1 16 PHE CE2 C 3.319 5.012 -4.391 1.00 . A A . 16 PHE CE2 1 1 13 5473 1 1 16 PHE CG C 1.575 4.618 -5.992 1.00 . A A . 16 PHE CG 1 1 13 5474 1 1 16 PHE CZ C 3.485 6.291 -4.877 1.00 . A A . 16 PHE CZ 1 1 13 5475 1 1 16 PHE H H -0.102 1.237 -7.789 1.00 . A A . 16 PHE H 1 1 13 5476 1 1 16 PHE HA H 1.348 3.724 -8.627 1.00 . A A . 16 PHE HA 1 1 13 5477 1 1 16 PHE HB2 H -0.344 4.273 -6.899 1.00 . A A . 16 PHE HB2 1 1 13 5478 1 1 16 PHE HB3 H 0.218 2.949 -5.888 1.00 . A A . 16 PHE HB3 1 1 13 5479 1 1 16 PHE HD1 H 1.136 6.258 -7.288 1.00 . A A . 16 PHE HD1 1 1 13 5480 1 1 16 PHE HD2 H 2.246 3.180 -4.558 1.00 . A A . 16 PHE HD2 1 1 13 5481 1 1 16 PHE HE1 H 2.827 7.738 -6.301 1.00 . A A . 16 PHE HE1 1 1 13 5482 1 1 16 PHE HE2 H 3.934 4.661 -3.576 1.00 . A A . 16 PHE HE2 1 1 13 5483 1 1 16 PHE HZ H 4.228 6.943 -4.444 1.00 . A A . 16 PHE HZ 1 1 13 5484 1 1 16 PHE N N 0.168 1.975 -8.374 1.00 . A A . 16 PHE N 1 1 13 5485 1 1 16 PHE O O 3.487 2.603 -7.864 1.00 . A A . 16 PHE O 1 1 13 5486 1 1 17 LEU C C 3.876 -0.298 -7.548 1.00 . A A . 17 LEU C 1 1 13 5487 1 1 17 LEU CA C 3.274 0.312 -6.291 1.00 . A A . 17 LEU CA 1 1 13 5488 1 1 17 LEU CB C 2.704 -0.782 -5.379 1.00 . A A . 17 LEU CB 1 1 13 5489 1 1 17 LEU CD1 C 0.408 -0.306 -4.383 1.00 . A A . 17 LEU CD1 1 1 13 5490 1 1 17 LEU CD2 C 2.352 -0.810 -2.865 1.00 . A A . 17 LEU CD2 1 1 13 5491 1 1 17 LEU CG C 1.933 -0.133 -4.186 1.00 . A A . 17 LEU CG 1 1 13 5492 1 1 17 LEU H H 1.249 0.971 -6.508 1.00 . A A . 17 LEU H 1 1 13 5493 1 1 17 LEU HA H 4.012 0.913 -5.787 1.00 . A A . 17 LEU HA 1 1 13 5494 1 1 17 LEU HB2 H 2.043 -1.412 -5.959 1.00 . A A . 17 LEU HB2 1 1 13 5495 1 1 17 LEU HB3 H 3.522 -1.391 -5.024 1.00 . A A . 17 LEU HB3 1 1 13 5496 1 1 17 LEU HD11 H 0.092 0.148 -5.311 1.00 . A A . 17 LEU HD11 1 1 13 5497 1 1 17 LEU HD12 H 0.146 -1.354 -4.406 1.00 . A A . 17 LEU HD12 1 1 13 5498 1 1 17 LEU HD13 H -0.126 0.168 -3.572 1.00 . A A . 17 LEU HD13 1 1 13 5499 1 1 17 LEU HD21 H 2.143 -1.869 -2.900 1.00 . A A . 17 LEU HD21 1 1 13 5500 1 1 17 LEU HD22 H 3.410 -0.668 -2.697 1.00 . A A . 17 LEU HD22 1 1 13 5501 1 1 17 LEU HD23 H 1.811 -0.376 -2.037 1.00 . A A . 17 LEU HD23 1 1 13 5502 1 1 17 LEU HG H 2.160 0.922 -4.120 1.00 . A A . 17 LEU HG 1 1 13 5503 1 1 17 LEU N N 2.166 1.190 -6.754 1.00 . A A . 17 LEU N 1 1 13 5504 1 1 17 LEU O O 5.073 -0.448 -7.683 1.00 . A A . 17 LEU O 1 1 13 5505 1 1 18 VAL C C 4.056 -0.145 -10.582 1.00 . A A . 18 VAL C 1 1 13 5506 1 1 18 VAL CA C 3.400 -1.231 -9.738 1.00 . A A . 18 VAL CA 1 1 13 5507 1 1 18 VAL CB C 2.140 -1.810 -10.412 1.00 . A A . 18 VAL CB 1 1 13 5508 1 1 18 VAL CG1 C 2.498 -2.453 -11.771 1.00 . A A . 18 VAL CG1 1 1 13 5509 1 1 18 VAL CG2 C 1.584 -2.895 -9.475 1.00 . A A . 18 VAL CG2 1 1 13 5510 1 1 18 VAL H H 2.038 -0.463 -8.266 1.00 . A A . 18 VAL H 1 1 13 5511 1 1 18 VAL HA H 4.120 -1.999 -9.526 1.00 . A A . 18 VAL HA 1 1 13 5512 1 1 18 VAL HB H 1.404 -1.033 -10.554 1.00 . A A . 18 VAL HB 1 1 13 5513 1 1 18 VAL HG11 H 3.437 -2.982 -11.708 1.00 . A A . 18 VAL HG11 1 1 13 5514 1 1 18 VAL HG12 H 1.728 -3.148 -12.074 1.00 . A A . 18 VAL HG12 1 1 13 5515 1 1 18 VAL HG13 H 2.575 -1.686 -12.526 1.00 . A A . 18 VAL HG13 1 1 13 5516 1 1 18 VAL HG21 H 2.358 -3.614 -9.247 1.00 . A A . 18 VAL HG21 1 1 13 5517 1 1 18 VAL HG22 H 1.250 -2.444 -8.552 1.00 . A A . 18 VAL HG22 1 1 13 5518 1 1 18 VAL HG23 H 0.753 -3.402 -9.940 1.00 . A A . 18 VAL HG23 1 1 13 5519 1 1 18 VAL N N 2.987 -0.624 -8.447 1.00 . A A . 18 VAL N 1 1 13 5520 1 1 18 VAL O O 5.109 -0.354 -11.153 1.00 . A A . 18 VAL O 1 1 13 5521 1 1 19 PHE C C 5.418 2.387 -11.020 1.00 . A A . 19 PHE C 1 1 13 5522 1 1 19 PHE CA C 3.953 2.147 -11.418 1.00 . A A . 19 PHE CA 1 1 13 5523 1 1 19 PHE CB C 3.099 3.396 -11.124 1.00 . A A . 19 PHE CB 1 1 13 5524 1 1 19 PHE CD1 C 3.530 4.731 -13.237 1.00 . A A . 19 PHE CD1 1 1 13 5525 1 1 19 PHE CD2 C 4.344 5.607 -11.173 1.00 . A A . 19 PHE CD2 1 1 13 5526 1 1 19 PHE CE1 C 4.048 5.822 -13.904 1.00 . A A . 19 PHE CE1 1 1 13 5527 1 1 19 PHE CE2 C 4.861 6.697 -11.839 1.00 . A A . 19 PHE CE2 1 1 13 5528 1 1 19 PHE CG C 3.674 4.615 -11.866 1.00 . A A . 19 PHE CG 1 1 13 5529 1 1 19 PHE CZ C 4.714 6.807 -13.205 1.00 . A A . 19 PHE CZ 1 1 13 5530 1 1 19 PHE H H 2.576 1.076 -10.117 1.00 . A A . 19 PHE H 1 1 13 5531 1 1 19 PHE HA H 3.911 1.895 -12.465 1.00 . A A . 19 PHE HA 1 1 13 5532 1 1 19 PHE HB2 H 2.089 3.233 -11.466 1.00 . A A . 19 PHE HB2 1 1 13 5533 1 1 19 PHE HB3 H 3.081 3.605 -10.065 1.00 . A A . 19 PHE HB3 1 1 13 5534 1 1 19 PHE HD1 H 3.009 3.964 -13.792 1.00 . A A . 19 PHE HD1 1 1 13 5535 1 1 19 PHE HD2 H 4.464 5.531 -10.102 1.00 . A A . 19 PHE HD2 1 1 13 5536 1 1 19 PHE HE1 H 3.932 5.905 -14.975 1.00 . A A . 19 PHE HE1 1 1 13 5537 1 1 19 PHE HE2 H 5.383 7.467 -11.290 1.00 . A A . 19 PHE HE2 1 1 13 5538 1 1 19 PHE HZ H 5.120 7.660 -13.727 1.00 . A A . 19 PHE HZ 1 1 13 5539 1 1 19 PHE N N 3.413 0.994 -10.622 1.00 . A A . 19 PHE N 1 1 13 5540 1 1 19 PHE O O 6.236 2.786 -11.826 1.00 . A A . 19 PHE O 1 1 13 5541 1 1 20 PHE C C 7.875 1.101 -9.657 1.00 . A A . 20 PHE C 1 1 13 5542 1 1 20 PHE CA C 7.034 2.284 -9.192 1.00 . A A . 20 PHE CA 1 1 13 5543 1 1 20 PHE CB C 6.916 2.314 -7.650 1.00 . A A . 20 PHE CB 1 1 13 5544 1 1 20 PHE CD1 C 5.916 4.648 -7.624 1.00 . A A . 20 PHE CD1 1 1 13 5545 1 1 20 PHE CD2 C 7.800 4.222 -6.227 1.00 . A A . 20 PHE CD2 1 1 13 5546 1 1 20 PHE CE1 C 5.877 5.952 -7.180 1.00 . A A . 20 PHE CE1 1 1 13 5547 1 1 20 PHE CE2 C 7.762 5.527 -5.781 1.00 . A A . 20 PHE CE2 1 1 13 5548 1 1 20 PHE CG C 6.876 3.770 -7.153 1.00 . A A . 20 PHE CG 1 1 13 5549 1 1 20 PHE CZ C 6.801 6.392 -6.258 1.00 . A A . 20 PHE CZ 1 1 13 5550 1 1 20 PHE H H 4.961 1.808 -9.183 1.00 . A A . 20 PHE H 1 1 13 5551 1 1 20 PHE HA H 7.473 3.189 -9.572 1.00 . A A . 20 PHE HA 1 1 13 5552 1 1 20 PHE HB2 H 6.008 1.825 -7.332 1.00 . A A . 20 PHE HB2 1 1 13 5553 1 1 20 PHE HB3 H 7.752 1.806 -7.192 1.00 . A A . 20 PHE HB3 1 1 13 5554 1 1 20 PHE HD1 H 5.189 4.311 -8.348 1.00 . A A . 20 PHE HD1 1 1 13 5555 1 1 20 PHE HD2 H 8.557 3.550 -5.848 1.00 . A A . 20 PHE HD2 1 1 13 5556 1 1 20 PHE HE1 H 5.123 6.627 -7.555 1.00 . A A . 20 PHE HE1 1 1 13 5557 1 1 20 PHE HE2 H 8.487 5.871 -5.058 1.00 . A A . 20 PHE HE2 1 1 13 5558 1 1 20 PHE HZ H 6.771 7.414 -5.908 1.00 . A A . 20 PHE HZ 1 1 13 5559 1 1 20 PHE N N 5.677 2.122 -9.766 1.00 . A A . 20 PHE N 1 1 13 5560 1 1 20 PHE O O 8.948 1.288 -10.184 1.00 . A A . 20 PHE O 1 1 13 5561 1 1 21 ALA C C 8.713 -1.257 -11.241 1.00 . A A . 21 ALA C 1 1 13 5562 1 1 21 ALA CA C 8.058 -1.341 -9.856 1.00 . A A . 21 ALA CA 1 1 13 5563 1 1 21 ALA CB C 7.038 -2.486 -9.826 1.00 . A A . 21 ALA CB 1 1 13 5564 1 1 21 ALA H H 6.472 -0.146 -9.045 1.00 . A A . 21 ALA H 1 1 13 5565 1 1 21 ALA HA H 8.829 -1.534 -9.129 1.00 . A A . 21 ALA HA 1 1 13 5566 1 1 21 ALA HB1 H 6.445 -2.422 -8.926 1.00 . A A . 21 ALA HB1 1 1 13 5567 1 1 21 ALA HB2 H 6.379 -2.430 -10.679 1.00 . A A . 21 ALA HB2 1 1 13 5568 1 1 21 ALA HB3 H 7.548 -3.437 -9.840 1.00 . A A . 21 ALA HB3 1 1 13 5569 1 1 21 ALA N N 7.353 -0.083 -9.460 1.00 . A A . 21 ALA N 1 1 13 5570 1 1 21 ALA O O 9.857 -1.626 -11.401 1.00 . A A . 21 ALA O 1 1 13 5571 1 1 22 GLU C C 9.750 0.147 -13.751 1.00 . A A . 22 GLU C 1 1 13 5572 1 1 22 GLU CA C 8.407 -0.590 -13.593 1.00 . A A . 22 GLU CA 1 1 13 5573 1 1 22 GLU CB C 7.327 0.184 -14.381 1.00 . A A . 22 GLU CB 1 1 13 5574 1 1 22 GLU CD C 5.252 -1.149 -13.925 1.00 . A A . 22 GLU CD 1 1 13 5575 1 1 22 GLU CG C 6.303 -0.791 -14.986 1.00 . A A . 22 GLU CG 1 1 13 5576 1 1 22 GLU H H 7.048 -0.482 -11.900 1.00 . A A . 22 GLU H 1 1 13 5577 1 1 22 GLU HA H 8.528 -1.578 -14.013 1.00 . A A . 22 GLU HA 1 1 13 5578 1 1 22 GLU HB2 H 6.832 0.888 -13.727 1.00 . A A . 22 GLU HB2 1 1 13 5579 1 1 22 GLU HB3 H 7.783 0.743 -15.187 1.00 . A A . 22 GLU HB3 1 1 13 5580 1 1 22 GLU HG2 H 5.813 -0.322 -15.826 1.00 . A A . 22 GLU HG2 1 1 13 5581 1 1 22 GLU HG3 H 6.788 -1.692 -15.331 1.00 . A A . 22 GLU HG3 1 1 13 5582 1 1 22 GLU N N 7.948 -0.753 -12.172 1.00 . A A . 22 GLU N 1 1 13 5583 1 1 22 GLU O O 10.397 0.034 -14.774 1.00 . A A . 22 GLU O 1 1 13 5584 1 1 22 GLU OE1 O 4.297 -0.394 -13.837 1.00 . A A . 22 GLU OE1 1 1 13 5585 1 1 22 GLU OE2 O 5.466 -2.153 -13.264 1.00 . A A . 22 GLU OE2 1 1 13 5586 1 1 23 ASP C C 12.009 1.683 -11.313 1.00 . A A . 23 ASP C 1 1 13 5587 1 1 23 ASP CA C 11.387 1.650 -12.725 1.00 . A A . 23 ASP CA 1 1 13 5588 1 1 23 ASP CB C 11.032 3.055 -13.231 1.00 . A A . 23 ASP CB 1 1 13 5589 1 1 23 ASP CG C 12.293 3.769 -13.751 1.00 . A A . 23 ASP CG 1 1 13 5590 1 1 23 ASP H H 9.556 0.914 -11.942 1.00 . A A . 23 ASP H 1 1 13 5591 1 1 23 ASP HA H 12.082 1.163 -13.386 1.00 . A A . 23 ASP HA 1 1 13 5592 1 1 23 ASP HB2 H 10.313 2.975 -14.035 1.00 . A A . 23 ASP HB2 1 1 13 5593 1 1 23 ASP HB3 H 10.581 3.628 -12.432 1.00 . A A . 23 ASP HB3 1 1 13 5594 1 1 23 ASP N N 10.120 0.872 -12.730 1.00 . A A . 23 ASP N 1 1 13 5595 1 1 23 ASP O O 12.712 2.610 -10.963 1.00 . A A . 23 ASP O 1 1 13 5596 1 1 23 ASP OD1 O 12.699 3.421 -14.849 1.00 . A A . 23 ASP OD1 1 1 13 5597 1 1 23 ASP OD2 O 12.780 4.621 -13.025 1.00 . A A . 23 ASP OD2 1 1 13 5598 1 1 24 VAL C C 12.810 -0.873 -8.929 1.00 . A A . 24 VAL C 1 1 13 5599 1 1 24 VAL CA C 12.257 0.546 -9.148 1.00 . A A . 24 VAL CA 1 1 13 5600 1 1 24 VAL CB C 11.107 0.849 -8.154 1.00 . A A . 24 VAL CB 1 1 13 5601 1 1 24 VAL CG1 C 11.504 0.514 -6.696 1.00 . A A . 24 VAL CG1 1 1 13 5602 1 1 24 VAL CG2 C 10.710 2.348 -8.218 1.00 . A A . 24 VAL CG2 1 1 13 5603 1 1 24 VAL H H 11.154 -0.056 -10.895 1.00 . A A . 24 VAL H 1 1 13 5604 1 1 24 VAL HA H 13.043 1.260 -8.991 1.00 . A A . 24 VAL HA 1 1 13 5605 1 1 24 VAL HB H 10.277 0.235 -8.441 1.00 . A A . 24 VAL HB 1 1 13 5606 1 1 24 VAL HG11 H 12.474 0.930 -6.464 1.00 . A A . 24 VAL HG11 1 1 13 5607 1 1 24 VAL HG12 H 10.777 0.925 -6.010 1.00 . A A . 24 VAL HG12 1 1 13 5608 1 1 24 VAL HG13 H 11.537 -0.556 -6.555 1.00 . A A . 24 VAL HG13 1 1 13 5609 1 1 24 VAL HG21 H 10.636 2.691 -9.238 1.00 . A A . 24 VAL HG21 1 1 13 5610 1 1 24 VAL HG22 H 9.749 2.489 -7.746 1.00 . A A . 24 VAL HG22 1 1 13 5611 1 1 24 VAL HG23 H 11.436 2.958 -7.703 1.00 . A A . 24 VAL HG23 1 1 13 5612 1 1 24 VAL N N 11.727 0.658 -10.546 1.00 . A A . 24 VAL N 1 1 13 5613 1 1 24 VAL O O 13.708 -1.067 -8.132 1.00 . A A . 24 VAL O 1 1 13 5614 1 1 25 GLY C C 11.522 -4.089 -9.008 1.00 . A A . 25 GLY C 1 1 13 5615 1 1 25 GLY CA C 12.680 -3.245 -9.551 1.00 . A A . 25 GLY CA 1 1 13 5616 1 1 25 GLY H H 11.535 -1.591 -10.275 1.00 . A A . 25 GLY H 1 1 13 5617 1 1 25 GLY HA2 H 12.945 -3.601 -10.535 1.00 . A A . 25 GLY HA2 1 1 13 5618 1 1 25 GLY HA3 H 13.532 -3.340 -8.892 1.00 . A A . 25 GLY HA3 1 1 13 5619 1 1 25 GLY N N 12.254 -1.816 -9.651 1.00 . A A . 25 GLY N 1 1 13 5620 1 1 25 GLY O O 10.392 -3.639 -8.964 1.00 . A A . 25 GLY O 1 1 13 5621 1 1 26 SER C C 11.549 -7.375 -7.329 1.00 . A A . 26 SER C 1 1 13 5622 1 1 26 SER CA C 10.827 -6.232 -8.061 1.00 . A A . 26 SER CA 1 1 13 5623 1 1 26 SER CB C 9.964 -6.776 -9.230 1.00 . A A . 26 SER CB 1 1 13 5624 1 1 26 SER H H 12.776 -5.590 -8.676 1.00 . A A . 26 SER H 1 1 13 5625 1 1 26 SER HA H 10.222 -5.695 -7.349 1.00 . A A . 26 SER HA 1 1 13 5626 1 1 26 SER HB2 H 9.521 -5.976 -9.805 1.00 . A A . 26 SER HB2 1 1 13 5627 1 1 26 SER HB3 H 10.529 -7.428 -9.880 1.00 . A A . 26 SER HB3 1 1 13 5628 1 1 26 SER HG H 8.093 -7.126 -8.825 1.00 . A A . 26 SER HG 1 1 13 5629 1 1 26 SER N N 11.847 -5.294 -8.613 1.00 . A A . 26 SER N 1 1 13 5630 1 1 26 SER O O 11.550 -8.511 -7.767 1.00 . A A . 26 SER O 1 1 13 5631 1 1 26 SER OG O 8.938 -7.517 -8.587 1.00 . A A . 26 SER OG 1 1 13 5632 1 1 27 ASN C C 11.950 -9.142 -4.944 1.00 . A A . 27 ASN C 1 1 13 5633 1 1 27 ASN CA C 12.896 -8.022 -5.391 1.00 . A A . 27 ASN CA 1 1 13 5634 1 1 27 ASN CB C 13.488 -7.312 -4.157 1.00 . A A . 27 ASN CB 1 1 13 5635 1 1 27 ASN CG C 14.329 -6.101 -4.592 1.00 . A A . 27 ASN CG 1 1 13 5636 1 1 27 ASN H H 12.108 -6.087 -5.929 1.00 . A A . 27 ASN H 1 1 13 5637 1 1 27 ASN HA H 13.682 -8.451 -5.992 1.00 . A A . 27 ASN HA 1 1 13 5638 1 1 27 ASN HB2 H 12.695 -6.973 -3.506 1.00 . A A . 27 ASN HB2 1 1 13 5639 1 1 27 ASN HB3 H 14.123 -7.992 -3.608 1.00 . A A . 27 ASN HB3 1 1 13 5640 1 1 27 ASN HD21 H 13.619 -4.934 -3.148 1.00 . A A . 27 ASN HD21 1 1 13 5641 1 1 27 ASN HD22 H 14.751 -4.207 -4.181 1.00 . A A . 27 ASN HD22 1 1 13 5642 1 1 27 ASN N N 12.149 -7.021 -6.220 1.00 . A A . 27 ASN N 1 1 13 5643 1 1 27 ASN ND2 N 14.224 -4.988 -3.917 1.00 . A A . 27 ASN ND2 1 1 13 5644 1 1 27 ASN O O 12.348 -10.283 -4.805 1.00 . A A . 27 ASN O 1 1 13 5645 1 1 27 ASN OD1 O 15.084 -6.151 -5.542 1.00 . A A . 27 ASN OD1 1 1 13 5646 1 1 28 LYS C C 9.096 -10.455 -5.527 1.00 . A A . 28 LYS C 1 1 13 5647 1 1 28 LYS CA C 9.661 -9.716 -4.298 1.00 . A A . 28 LYS CA 1 1 13 5648 1 1 28 LYS CB C 8.540 -8.935 -3.589 1.00 . A A . 28 LYS CB 1 1 13 5649 1 1 28 LYS CD C 8.844 -6.717 -2.371 1.00 . A A . 28 LYS CD 1 1 13 5650 1 1 28 LYS CE C 7.367 -6.415 -2.050 1.00 . A A . 28 LYS CE 1 1 13 5651 1 1 28 LYS CG C 9.095 -8.242 -2.311 1.00 . A A . 28 LYS CG 1 1 13 5652 1 1 28 LYS H H 10.489 -7.814 -4.873 1.00 . A A . 28 LYS H 1 1 13 5653 1 1 28 LYS HA H 10.097 -10.435 -3.617 1.00 . A A . 28 LYS HA 1 1 13 5654 1 1 28 LYS HB2 H 8.125 -8.208 -4.274 1.00 . A A . 28 LYS HB2 1 1 13 5655 1 1 28 LYS HB3 H 7.753 -9.620 -3.307 1.00 . A A . 28 LYS HB3 1 1 13 5656 1 1 28 LYS HD2 H 9.475 -6.224 -1.644 1.00 . A A . 28 LYS HD2 1 1 13 5657 1 1 28 LYS HD3 H 9.093 -6.335 -3.351 1.00 . A A . 28 LYS HD3 1 1 13 5658 1 1 28 LYS HE2 H 6.721 -6.856 -2.794 1.00 . A A . 28 LYS HE2 1 1 13 5659 1 1 28 LYS HE3 H 7.104 -6.809 -1.079 1.00 . A A . 28 LYS HE3 1 1 13 5660 1 1 28 LYS HG2 H 8.611 -8.658 -1.439 1.00 . A A . 28 LYS HG2 1 1 13 5661 1 1 28 LYS HG3 H 10.157 -8.415 -2.213 1.00 . A A . 28 LYS HG3 1 1 13 5662 1 1 28 LYS HZ1 H 8.028 -4.447 -2.251 1.00 . A A . 28 LYS HZ1 1 1 13 5663 1 1 28 LYS HZ2 H 6.427 -4.696 -2.758 1.00 . A A . 28 LYS HZ2 1 1 13 5664 1 1 28 LYS HZ3 H 6.796 -4.652 -1.101 1.00 . A A . 28 LYS HZ3 1 1 13 5665 1 1 28 LYS N N 10.719 -8.756 -4.735 1.00 . A A . 28 LYS N 1 1 13 5666 1 1 28 LYS NZ N 7.139 -4.941 -2.040 1.00 . A A . 28 LYS NZ 1 1 13 5667 1 1 28 LYS O O 8.996 -9.808 -6.559 1.00 . A A . 28 LYS O 1 1 13 5668 1 1 28 LYS OXT O 8.796 -11.626 -5.365 1.00 . A A . 28 LYS OXT 1 1 14 5669 1 1 1 ASP C C -0.272 -20.504 5.607 1.00 . A A . 1 ASP C 1 1 14 5670 1 1 1 ASP CA C -1.392 -21.284 6.301 1.00 . A A . 1 ASP CA 1 1 14 5671 1 1 1 ASP CB C -0.888 -22.706 6.632 1.00 . A A . 1 ASP CB 1 1 14 5672 1 1 1 ASP CG C 0.362 -22.615 7.532 1.00 . A A . 1 ASP CG 1 1 14 5673 1 1 1 ASP H1 H -2.364 -20.854 4.510 1.00 . A A . 1 ASP H1 1 1 14 5674 1 1 1 ASP H2 H -2.804 -22.345 5.193 1.00 . A A . 1 ASP H2 1 1 14 5675 1 1 1 ASP H3 H -3.389 -20.896 5.861 1.00 . A A . 1 ASP H3 1 1 14 5676 1 1 1 ASP HA H -1.680 -20.766 7.205 1.00 . A A . 1 ASP HA 1 1 14 5677 1 1 1 ASP HB2 H -1.658 -23.262 7.151 1.00 . A A . 1 ASP HB2 1 1 14 5678 1 1 1 ASP HB3 H -0.636 -23.236 5.723 1.00 . A A . 1 ASP HB3 1 1 14 5679 1 1 1 ASP N N -2.577 -21.352 5.399 1.00 . A A . 1 ASP N 1 1 14 5680 1 1 1 ASP O O -0.013 -20.711 4.438 1.00 . A A . 1 ASP O 1 1 14 5681 1 1 1 ASP OD1 O 0.161 -22.520 8.732 1.00 . A A . 1 ASP OD1 1 1 14 5682 1 1 1 ASP OD2 O 1.444 -22.643 6.968 1.00 . A A . 1 ASP OD2 1 1 14 5683 1 1 2 ALA C C 1.050 -18.083 4.545 1.00 . A A . 2 ALA C 1 1 14 5684 1 1 2 ALA CA C 1.474 -18.786 5.846 1.00 . A A . 2 ALA CA 1 1 14 5685 1 1 2 ALA CB C 2.707 -19.694 5.611 1.00 . A A . 2 ALA CB 1 1 14 5686 1 1 2 ALA H H 0.077 -19.538 7.300 1.00 . A A . 2 ALA H 1 1 14 5687 1 1 2 ALA HA H 1.705 -18.038 6.588 1.00 . A A . 2 ALA HA 1 1 14 5688 1 1 2 ALA HB1 H 2.998 -20.166 6.538 1.00 . A A . 2 ALA HB1 1 1 14 5689 1 1 2 ALA HB2 H 2.485 -20.465 4.888 1.00 . A A . 2 ALA HB2 1 1 14 5690 1 1 2 ALA HB3 H 3.536 -19.104 5.249 1.00 . A A . 2 ALA HB3 1 1 14 5691 1 1 2 ALA N N 0.353 -19.634 6.365 1.00 . A A . 2 ALA N 1 1 14 5692 1 1 2 ALA O O 1.469 -18.440 3.459 1.00 . A A . 2 ALA O 1 1 14 5693 1 1 3 GLU C C 0.657 -15.179 3.119 1.00 . A A . 3 GLU C 1 1 14 5694 1 1 3 GLU CA C -0.292 -16.306 3.542 1.00 . A A . 3 GLU CA 1 1 14 5695 1 1 3 GLU CB C -1.696 -15.759 3.930 1.00 . A A . 3 GLU CB 1 1 14 5696 1 1 3 GLU CD C -2.412 -18.197 4.178 1.00 . A A . 3 GLU CD 1 1 14 5697 1 1 3 GLU CG C -2.790 -16.814 3.605 1.00 . A A . 3 GLU CG 1 1 14 5698 1 1 3 GLU H H -0.082 -16.853 5.616 1.00 . A A . 3 GLU H 1 1 14 5699 1 1 3 GLU HA H -0.373 -16.973 2.702 1.00 . A A . 3 GLU HA 1 1 14 5700 1 1 3 GLU HB2 H -1.722 -15.528 4.986 1.00 . A A . 3 GLU HB2 1 1 14 5701 1 1 3 GLU HB3 H -1.920 -14.856 3.382 1.00 . A A . 3 GLU HB3 1 1 14 5702 1 1 3 GLU HG2 H -3.731 -16.504 4.037 1.00 . A A . 3 GLU HG2 1 1 14 5703 1 1 3 GLU HG3 H -2.917 -16.893 2.535 1.00 . A A . 3 GLU HG3 1 1 14 5704 1 1 3 GLU N N 0.215 -17.089 4.712 1.00 . A A . 3 GLU N 1 1 14 5705 1 1 3 GLU O O 0.243 -14.191 2.540 1.00 . A A . 3 GLU O 1 1 14 5706 1 1 3 GLU OE1 O -2.472 -18.327 5.391 1.00 . A A . 3 GLU OE1 1 1 14 5707 1 1 3 GLU OE2 O -2.079 -19.048 3.370 1.00 . A A . 3 GLU OE2 1 1 14 5708 1 1 4 PHE C C 3.440 -14.607 1.614 1.00 . A A . 4 PHE C 1 1 14 5709 1 1 4 PHE CA C 2.985 -14.390 3.072 1.00 . A A . 4 PHE CA 1 1 14 5710 1 1 4 PHE CB C 4.166 -14.584 4.049 1.00 . A A . 4 PHE CB 1 1 14 5711 1 1 4 PHE CD1 C 3.138 -13.492 6.097 1.00 . A A . 4 PHE CD1 1 1 14 5712 1 1 4 PHE CD2 C 3.635 -15.823 6.199 1.00 . A A . 4 PHE CD2 1 1 14 5713 1 1 4 PHE CE1 C 2.656 -13.539 7.389 1.00 . A A . 4 PHE CE1 1 1 14 5714 1 1 4 PHE CE2 C 3.152 -15.869 7.490 1.00 . A A . 4 PHE CE2 1 1 14 5715 1 1 4 PHE CG C 3.632 -14.634 5.491 1.00 . A A . 4 PHE CG 1 1 14 5716 1 1 4 PHE CZ C 2.663 -14.728 8.086 1.00 . A A . 4 PHE CZ 1 1 14 5717 1 1 4 PHE H H 2.157 -16.218 3.871 1.00 . A A . 4 PHE H 1 1 14 5718 1 1 4 PHE HA H 2.578 -13.394 3.157 1.00 . A A . 4 PHE HA 1 1 14 5719 1 1 4 PHE HB2 H 4.687 -15.504 3.831 1.00 . A A . 4 PHE HB2 1 1 14 5720 1 1 4 PHE HB3 H 4.859 -13.759 3.962 1.00 . A A . 4 PHE HB3 1 1 14 5721 1 1 4 PHE HD1 H 3.129 -12.556 5.558 1.00 . A A . 4 PHE HD1 1 1 14 5722 1 1 4 PHE HD2 H 4.016 -16.722 5.739 1.00 . A A . 4 PHE HD2 1 1 14 5723 1 1 4 PHE HE1 H 2.272 -12.642 7.854 1.00 . A A . 4 PHE HE1 1 1 14 5724 1 1 4 PHE HE2 H 3.159 -16.801 8.035 1.00 . A A . 4 PHE HE2 1 1 14 5725 1 1 4 PHE HZ H 2.284 -14.764 9.097 1.00 . A A . 4 PHE HZ 1 1 14 5726 1 1 4 PHE N N 1.915 -15.386 3.415 1.00 . A A . 4 PHE N 1 1 14 5727 1 1 4 PHE O O 4.551 -14.306 1.225 1.00 . A A . 4 PHE O 1 1 14 5728 1 1 5 ARG C C 1.217 -15.501 -1.142 1.00 . A A . 5 ARG C 1 1 14 5729 1 1 5 ARG CA C 2.648 -15.463 -0.574 1.00 . A A . 5 ARG CA 1 1 14 5730 1 1 5 ARG CB C 3.351 -16.844 -0.715 1.00 . A A . 5 ARG CB 1 1 14 5731 1 1 5 ARG CD C 1.836 -18.893 -0.680 1.00 . A A . 5 ARG CD 1 1 14 5732 1 1 5 ARG CG C 2.673 -17.926 0.184 1.00 . A A . 5 ARG CG 1 1 14 5733 1 1 5 ARG CZ C 0.209 -19.750 0.949 1.00 . A A . 5 ARG CZ 1 1 14 5734 1 1 5 ARG H H 1.649 -15.338 1.282 1.00 . A A . 5 ARG H 1 1 14 5735 1 1 5 ARG HA H 3.187 -14.667 -1.055 1.00 . A A . 5 ARG HA 1 1 14 5736 1 1 5 ARG HB2 H 3.340 -17.149 -1.752 1.00 . A A . 5 ARG HB2 1 1 14 5737 1 1 5 ARG HB3 H 4.382 -16.738 -0.414 1.00 . A A . 5 ARG HB3 1 1 14 5738 1 1 5 ARG HD2 H 1.027 -18.380 -1.177 1.00 . A A . 5 ARG HD2 1 1 14 5739 1 1 5 ARG HD3 H 2.459 -19.367 -1.425 1.00 . A A . 5 ARG HD3 1 1 14 5740 1 1 5 ARG HE H 1.703 -20.836 0.230 1.00 . A A . 5 ARG HE 1 1 14 5741 1 1 5 ARG HG2 H 3.440 -18.488 0.697 1.00 . A A . 5 ARG HG2 1 1 14 5742 1 1 5 ARG HG3 H 2.036 -17.475 0.929 1.00 . A A . 5 ARG HG3 1 1 14 5743 1 1 5 ARG HH11 H -0.048 -17.848 0.369 1.00 . A A . 5 ARG HH11 1 1 14 5744 1 1 5 ARG HH12 H -1.201 -18.444 1.511 1.00 . A A . 5 ARG HH12 1 1 14 5745 1 1 5 ARG HH21 H 0.258 -21.613 1.679 1.00 . A A . 5 ARG HH21 1 1 14 5746 1 1 5 ARG HH22 H -1.027 -20.613 2.267 1.00 . A A . 5 ARG HH22 1 1 14 5747 1 1 5 ARG N N 2.508 -15.138 0.870 1.00 . A A . 5 ARG N 1 1 14 5748 1 1 5 ARG NE N 1.270 -19.958 0.207 1.00 . A A . 5 ARG NE 1 1 14 5749 1 1 5 ARG NH1 N -0.392 -18.591 0.942 1.00 . A A . 5 ARG NH1 1 1 14 5750 1 1 5 ARG NH2 N -0.219 -20.734 1.689 1.00 . A A . 5 ARG NH2 1 1 14 5751 1 1 5 ARG O O 0.932 -16.148 -2.131 1.00 . A A . 5 ARG O 1 1 14 5752 1 1 6 HIS C C -1.470 -13.183 -0.752 1.00 . A A . 6 HIS C 1 1 14 5753 1 1 6 HIS CA C -1.070 -14.658 -0.811 1.00 . A A . 6 HIS CA 1 1 14 5754 1 1 6 HIS CB C -1.903 -15.477 0.198 1.00 . A A . 6 HIS CB 1 1 14 5755 1 1 6 HIS CD2 C -3.873 -17.051 -0.599 1.00 . A A . 6 HIS CD2 1 1 14 5756 1 1 6 HIS CE1 C -2.742 -18.463 -1.613 1.00 . A A . 6 HIS CE1 1 1 14 5757 1 1 6 HIS CG C -2.545 -16.677 -0.500 1.00 . A A . 6 HIS CG 1 1 14 5758 1 1 6 HIS H H 0.688 -14.283 0.317 1.00 . A A . 6 HIS H 1 1 14 5759 1 1 6 HIS HA H -1.203 -15.009 -1.819 1.00 . A A . 6 HIS HA 1 1 14 5760 1 1 6 HIS HB2 H -1.272 -15.847 0.990 1.00 . A A . 6 HIS HB2 1 1 14 5761 1 1 6 HIS HB3 H -2.687 -14.877 0.636 1.00 . A A . 6 HIS HB3 1 1 14 5762 1 1 6 HIS HD1 H -0.931 -17.623 -1.268 1.00 . A A . 6 HIS HD1 1 1 14 5763 1 1 6 HIS HD2 H -4.703 -16.508 -0.169 1.00 . A A . 6 HIS HD2 1 1 14 5764 1 1 6 HIS HE1 H -2.457 -19.329 -2.192 1.00 . A A . 6 HIS HE1 1 1 14 5765 1 1 6 HIS N N 0.367 -14.776 -0.460 1.00 . A A . 6 HIS N 1 1 14 5766 1 1 6 HIS ND1 N -1.903 -17.592 -1.148 1.00 . A A . 6 HIS ND1 1 1 14 5767 1 1 6 HIS NE2 N -3.978 -18.164 -1.296 1.00 . A A . 6 HIS NE2 1 1 14 5768 1 1 6 HIS O O -2.057 -12.678 -1.688 1.00 . A A . 6 HIS O 1 1 14 5769 1 1 7 ASP C C -3.002 -10.964 0.383 1.00 . A A . 7 ASP C 1 1 14 5770 1 1 7 ASP CA C -1.472 -11.091 0.536 1.00 . A A . 7 ASP CA 1 1 14 5771 1 1 7 ASP CB C -0.643 -10.276 -0.541 1.00 . A A . 7 ASP CB 1 1 14 5772 1 1 7 ASP CG C -1.256 -8.902 -0.876 1.00 . A A . 7 ASP CG 1 1 14 5773 1 1 7 ASP H H -0.665 -13.021 1.056 1.00 . A A . 7 ASP H 1 1 14 5774 1 1 7 ASP HA H -1.196 -10.800 1.538 1.00 . A A . 7 ASP HA 1 1 14 5775 1 1 7 ASP HB2 H 0.349 -10.107 -0.149 1.00 . A A . 7 ASP HB2 1 1 14 5776 1 1 7 ASP HB3 H -0.538 -10.844 -1.453 1.00 . A A . 7 ASP HB3 1 1 14 5777 1 1 7 ASP N N -1.138 -12.541 0.346 1.00 . A A . 7 ASP N 1 1 14 5778 1 1 7 ASP O O -3.525 -10.276 -0.474 1.00 . A A . 7 ASP O 1 1 14 5779 1 1 7 ASP OD1 O -1.411 -8.123 0.051 1.00 . A A . 7 ASP OD1 1 1 14 5780 1 1 7 ASP OD2 O -1.536 -8.714 -2.049 1.00 . A A . 7 ASP OD2 1 1 14 5781 1 1 8 SER C C -5.679 -12.126 -0.098 1.00 . A A . 8 SER C 1 1 14 5782 1 1 8 SER CA C -5.169 -11.706 1.294 1.00 . A A . 8 SER CA 1 1 14 5783 1 1 8 SER CB C -5.687 -10.290 1.681 1.00 . A A . 8 SER CB 1 1 14 5784 1 1 8 SER H H -3.166 -12.203 1.915 1.00 . A A . 8 SER H 1 1 14 5785 1 1 8 SER HA H -5.484 -12.441 2.021 1.00 . A A . 8 SER HA 1 1 14 5786 1 1 8 SER HB2 H -5.175 -9.912 2.554 1.00 . A A . 8 SER HB2 1 1 14 5787 1 1 8 SER HB3 H -5.590 -9.588 0.867 1.00 . A A . 8 SER HB3 1 1 14 5788 1 1 8 SER HG H -7.306 -11.383 1.831 1.00 . A A . 8 SER HG 1 1 14 5789 1 1 8 SER N N -3.671 -11.676 1.262 1.00 . A A . 8 SER N 1 1 14 5790 1 1 8 SER O O -6.708 -11.676 -0.564 1.00 . A A . 8 SER O 1 1 14 5791 1 1 8 SER OG O -7.064 -10.467 1.987 1.00 . A A . 8 SER OG 1 1 14 5792 1 1 9 GLY C C -4.487 -12.620 -3.063 1.00 . A A . 9 GLY C 1 1 14 5793 1 1 9 GLY CA C -5.237 -13.510 -2.073 1.00 . A A . 9 GLY CA 1 1 14 5794 1 1 9 GLY H H -4.094 -13.305 -0.262 1.00 . A A . 9 GLY H 1 1 14 5795 1 1 9 GLY HA2 H -4.887 -14.528 -2.165 1.00 . A A . 9 GLY HA2 1 1 14 5796 1 1 9 GLY HA3 H -6.298 -13.456 -2.261 1.00 . A A . 9 GLY HA3 1 1 14 5797 1 1 9 GLY N N -4.908 -12.992 -0.711 1.00 . A A . 9 GLY N 1 1 14 5798 1 1 9 GLY O O -3.792 -13.100 -3.938 1.00 . A A . 9 GLY O 1 1 14 5799 1 1 10 TYR C C -4.461 -8.904 -3.227 1.00 . A A . 10 TYR C 1 1 14 5800 1 1 10 TYR CA C -4.024 -10.292 -3.717 1.00 . A A . 10 TYR CA 1 1 14 5801 1 1 10 TYR CB C -4.445 -10.460 -5.204 1.00 . A A . 10 TYR CB 1 1 14 5802 1 1 10 TYR CD1 C -2.767 -9.048 -6.466 1.00 . A A . 10 TYR CD1 1 1 14 5803 1 1 10 TYR CD2 C -2.452 -11.404 -6.455 1.00 . A A . 10 TYR CD2 1 1 14 5804 1 1 10 TYR CE1 C -1.634 -8.897 -7.235 1.00 . A A . 10 TYR CE1 1 1 14 5805 1 1 10 TYR CE2 C -1.318 -11.255 -7.224 1.00 . A A . 10 TYR CE2 1 1 14 5806 1 1 10 TYR CG C -3.186 -10.302 -6.069 1.00 . A A . 10 TYR CG 1 1 14 5807 1 1 10 TYR CZ C -0.900 -10.000 -7.619 1.00 . A A . 10 TYR CZ 1 1 14 5808 1 1 10 TYR H H -5.248 -11.050 -2.132 1.00 . A A . 10 TYR H 1 1 14 5809 1 1 10 TYR HA H -2.954 -10.376 -3.597 1.00 . A A . 10 TYR HA 1 1 14 5810 1 1 10 TYR HB2 H -4.879 -11.430 -5.390 1.00 . A A . 10 TYR HB2 1 1 14 5811 1 1 10 TYR HB3 H -5.163 -9.706 -5.494 1.00 . A A . 10 TYR HB3 1 1 14 5812 1 1 10 TYR HD1 H -3.332 -8.178 -6.173 1.00 . A A . 10 TYR HD1 1 1 14 5813 1 1 10 TYR HD2 H -2.763 -12.394 -6.155 1.00 . A A . 10 TYR HD2 1 1 14 5814 1 1 10 TYR HE1 H -1.322 -7.908 -7.533 1.00 . A A . 10 TYR HE1 1 1 14 5815 1 1 10 TYR HE2 H -0.755 -12.128 -7.516 1.00 . A A . 10 TYR HE2 1 1 14 5816 1 1 10 TYR HH H 0.968 -9.657 -7.799 1.00 . A A . 10 TYR HH 1 1 14 5817 1 1 10 TYR N N -4.668 -11.338 -2.867 1.00 . A A . 10 TYR N 1 1 14 5818 1 1 10 TYR O O -5.399 -8.776 -2.463 1.00 . A A . 10 TYR O 1 1 14 5819 1 1 10 TYR OH O 0.235 -9.851 -8.388 1.00 . A A . 10 TYR OH 1 1 14 5820 1 1 11 GLU C C -3.254 -5.655 -4.308 1.00 . A A . 11 GLU C 1 1 14 5821 1 1 11 GLU CA C -4.045 -6.495 -3.322 1.00 . A A . 11 GLU CA 1 1 14 5822 1 1 11 GLU CB C -3.572 -6.211 -1.875 1.00 . A A . 11 GLU CB 1 1 14 5823 1 1 11 GLU CD C -2.743 -3.798 -2.064 1.00 . A A . 11 GLU CD 1 1 14 5824 1 1 11 GLU CG C -3.841 -4.727 -1.497 1.00 . A A . 11 GLU CG 1 1 14 5825 1 1 11 GLU H H -3.007 -8.068 -4.307 1.00 . A A . 11 GLU H 1 1 14 5826 1 1 11 GLU HA H -5.099 -6.296 -3.463 1.00 . A A . 11 GLU HA 1 1 14 5827 1 1 11 GLU HB2 H -4.103 -6.855 -1.190 1.00 . A A . 11 GLU HB2 1 1 14 5828 1 1 11 GLU HB3 H -2.517 -6.422 -1.788 1.00 . A A . 11 GLU HB3 1 1 14 5829 1 1 11 GLU HG2 H -4.803 -4.419 -1.883 1.00 . A A . 11 GLU HG2 1 1 14 5830 1 1 11 GLU HG3 H -3.851 -4.622 -0.423 1.00 . A A . 11 GLU HG3 1 1 14 5831 1 1 11 GLU N N -3.755 -7.905 -3.694 1.00 . A A . 11 GLU N 1 1 14 5832 1 1 11 GLU O O -2.046 -5.777 -4.395 1.00 . A A . 11 GLU O 1 1 14 5833 1 1 11 GLU OE1 O -1.590 -4.041 -1.749 1.00 . A A . 11 GLU OE1 1 1 14 5834 1 1 11 GLU OE2 O -3.122 -2.890 -2.785 1.00 . A A . 11 GLU OE2 1 1 14 5835 1 1 12 VAL C C -3.669 -2.492 -5.680 1.00 . A A . 12 VAL C 1 1 14 5836 1 1 12 VAL CA C -3.344 -3.945 -6.023 1.00 . A A . 12 VAL CA 1 1 14 5837 1 1 12 VAL CB C -3.888 -4.317 -7.412 1.00 . A A . 12 VAL CB 1 1 14 5838 1 1 12 VAL CG1 C -3.559 -3.224 -8.467 1.00 . A A . 12 VAL CG1 1 1 14 5839 1 1 12 VAL CG2 C -3.276 -5.651 -7.859 1.00 . A A . 12 VAL CG2 1 1 14 5840 1 1 12 VAL H H -4.940 -4.789 -4.893 1.00 . A A . 12 VAL H 1 1 14 5841 1 1 12 VAL HA H -2.295 -4.116 -5.986 1.00 . A A . 12 VAL HA 1 1 14 5842 1 1 12 VAL HB H -4.949 -4.438 -7.300 1.00 . A A . 12 VAL HB 1 1 14 5843 1 1 12 VAL HG11 H -2.525 -2.921 -8.386 1.00 . A A . 12 VAL HG11 1 1 14 5844 1 1 12 VAL HG12 H -3.731 -3.599 -9.465 1.00 . A A . 12 VAL HG12 1 1 14 5845 1 1 12 VAL HG13 H -4.187 -2.358 -8.316 1.00 . A A . 12 VAL HG13 1 1 14 5846 1 1 12 VAL HG21 H -2.203 -5.640 -7.724 1.00 . A A . 12 VAL HG21 1 1 14 5847 1 1 12 VAL HG22 H -3.698 -6.448 -7.268 1.00 . A A . 12 VAL HG22 1 1 14 5848 1 1 12 VAL HG23 H -3.497 -5.836 -8.899 1.00 . A A . 12 VAL HG23 1 1 14 5849 1 1 12 VAL N N -3.973 -4.830 -5.019 1.00 . A A . 12 VAL N 1 1 14 5850 1 1 12 VAL O O -2.777 -1.693 -5.481 1.00 . A A . 12 VAL O 1 1 14 5851 1 1 13 HIS C C -5.439 0.047 -6.520 1.00 . A A . 13 HIS C 1 1 14 5852 1 1 13 HIS CA C -5.563 -0.905 -5.319 1.00 . A A . 13 HIS CA 1 1 14 5853 1 1 13 HIS CB C -4.863 -0.268 -4.083 1.00 . A A . 13 HIS CB 1 1 14 5854 1 1 13 HIS CD2 C -6.430 1.201 -2.527 1.00 . A A . 13 HIS CD2 1 1 14 5855 1 1 13 HIS CE1 C -6.444 2.931 -3.672 1.00 . A A . 13 HIS CE1 1 1 14 5856 1 1 13 HIS CG C -5.647 0.972 -3.646 1.00 . A A . 13 HIS CG 1 1 14 5857 1 1 13 HIS H H -5.558 -2.995 -5.811 1.00 . A A . 13 HIS H 1 1 14 5858 1 1 13 HIS HA H -6.611 -1.056 -5.105 1.00 . A A . 13 HIS HA 1 1 14 5859 1 1 13 HIS HB2 H -4.839 -0.970 -3.263 1.00 . A A . 13 HIS HB2 1 1 14 5860 1 1 13 HIS HB3 H -3.856 0.040 -4.315 1.00 . A A . 13 HIS HB3 1 1 14 5861 1 1 13 HIS HD1 H -5.248 2.251 -5.159 1.00 . A A . 13 HIS HD1 1 1 14 5862 1 1 13 HIS HD2 H -6.614 0.482 -1.742 1.00 . A A . 13 HIS HD2 1 1 14 5863 1 1 13 HIS HE1 H -6.649 3.933 -4.017 1.00 . A A . 13 HIS HE1 1 1 14 5864 1 1 13 HIS N N -4.957 -2.244 -5.630 1.00 . A A . 13 HIS N 1 1 14 5865 1 1 13 HIS ND1 N -5.701 2.081 -4.306 1.00 . A A . 13 HIS ND1 1 1 14 5866 1 1 13 HIS NE2 N -6.918 2.425 -2.560 1.00 . A A . 13 HIS NE2 1 1 14 5867 1 1 13 HIS O O -6.411 0.653 -6.925 1.00 . A A . 13 HIS O 1 1 14 5868 1 1 14 HIS C C -2.585 0.594 -8.786 1.00 . A A . 14 HIS C 1 1 14 5869 1 1 14 HIS CA C -3.945 1.014 -8.215 1.00 . A A . 14 HIS CA 1 1 14 5870 1 1 14 HIS CB C -3.889 2.494 -7.761 1.00 . A A . 14 HIS CB 1 1 14 5871 1 1 14 HIS CD2 C -6.045 3.385 -9.020 1.00 . A A . 14 HIS CD2 1 1 14 5872 1 1 14 HIS CE1 C -7.112 4.031 -7.363 1.00 . A A . 14 HIS CE1 1 1 14 5873 1 1 14 HIS CG C -5.276 3.129 -7.898 1.00 . A A . 14 HIS CG 1 1 14 5874 1 1 14 HIS H H -3.514 -0.383 -6.670 1.00 . A A . 14 HIS H 1 1 14 5875 1 1 14 HIS HA H -4.698 0.851 -8.969 1.00 . A A . 14 HIS HA 1 1 14 5876 1 1 14 HIS HB2 H -3.583 2.560 -6.727 1.00 . A A . 14 HIS HB2 1 1 14 5877 1 1 14 HIS HB3 H -3.195 3.058 -8.366 1.00 . A A . 14 HIS HB3 1 1 14 5878 1 1 14 HIS HD1 H -5.739 3.518 -5.970 1.00 . A A . 14 HIS HD1 1 1 14 5879 1 1 14 HIS HD2 H -5.753 3.158 -10.035 1.00 . A A . 14 HIS HD2 1 1 14 5880 1 1 14 HIS HE1 H -7.889 4.447 -6.739 1.00 . A A . 14 HIS HE1 1 1 14 5881 1 1 14 HIS N N -4.245 0.139 -7.047 1.00 . A A . 14 HIS N 1 1 14 5882 1 1 14 HIS ND1 N -5.997 3.552 -6.913 1.00 . A A . 14 HIS ND1 1 1 14 5883 1 1 14 HIS NE2 N -7.185 3.947 -8.669 1.00 . A A . 14 HIS NE2 1 1 14 5884 1 1 14 HIS O O -1.829 -0.118 -8.150 1.00 . A A . 14 HIS O 1 1 14 5885 1 1 15 GLN C C 0.188 1.485 -10.067 1.00 . A A . 15 GLN C 1 1 14 5886 1 1 15 GLN CA C -1.000 0.706 -10.636 1.00 . A A . 15 GLN CA 1 1 14 5887 1 1 15 GLN CB C -1.148 0.973 -12.154 1.00 . A A . 15 GLN CB 1 1 14 5888 1 1 15 GLN CD C -0.569 -1.284 -13.076 1.00 . A A . 15 GLN CD 1 1 14 5889 1 1 15 GLN CG C -1.711 -0.287 -12.829 1.00 . A A . 15 GLN CG 1 1 14 5890 1 1 15 GLN H H -2.944 1.629 -10.443 1.00 . A A . 15 GLN H 1 1 14 5891 1 1 15 GLN HA H -0.802 -0.332 -10.433 1.00 . A A . 15 GLN HA 1 1 14 5892 1 1 15 GLN HB2 H -1.826 1.799 -12.315 1.00 . A A . 15 GLN HB2 1 1 14 5893 1 1 15 GLN HB3 H -0.196 1.227 -12.599 1.00 . A A . 15 GLN HB3 1 1 14 5894 1 1 15 GLN HE21 H -0.840 -2.218 -11.343 1.00 . A A . 15 GLN HE21 1 1 14 5895 1 1 15 GLN HE22 H 0.416 -2.827 -12.310 1.00 . A A . 15 GLN HE22 1 1 14 5896 1 1 15 GLN HG2 H -2.458 -0.752 -12.202 1.00 . A A . 15 GLN HG2 1 1 14 5897 1 1 15 GLN HG3 H -2.160 -0.025 -13.775 1.00 . A A . 15 GLN HG3 1 1 14 5898 1 1 15 GLN N N -2.301 1.054 -9.979 1.00 . A A . 15 GLN N 1 1 14 5899 1 1 15 GLN NE2 N -0.309 -2.185 -12.166 1.00 . A A . 15 GLN NE2 1 1 14 5900 1 1 15 GLN O O 1.238 1.575 -10.670 1.00 . A A . 15 GLN O 1 1 14 5901 1 1 15 GLN OE1 O 0.095 -1.252 -14.092 1.00 . A A . 15 GLN OE1 1 1 14 5902 1 1 16 PHE C C 2.248 1.874 -7.884 1.00 . A A . 16 PHE C 1 1 14 5903 1 1 16 PHE CA C 1.082 2.809 -8.239 1.00 . A A . 16 PHE CA 1 1 14 5904 1 1 16 PHE CB C 0.512 3.484 -6.971 1.00 . A A . 16 PHE CB 1 1 14 5905 1 1 16 PHE CD1 C -0.759 1.739 -5.627 1.00 . A A . 16 PHE CD1 1 1 14 5906 1 1 16 PHE CD2 C 1.415 2.367 -4.878 1.00 . A A . 16 PHE CD2 1 1 14 5907 1 1 16 PHE CE1 C -0.869 0.864 -4.567 1.00 . A A . 16 PHE CE1 1 1 14 5908 1 1 16 PHE CE2 C 1.305 1.491 -3.819 1.00 . A A . 16 PHE CE2 1 1 14 5909 1 1 16 PHE CG C 0.384 2.500 -5.792 1.00 . A A . 16 PHE CG 1 1 14 5910 1 1 16 PHE CZ C 0.162 0.738 -3.663 1.00 . A A . 16 PHE CZ 1 1 14 5911 1 1 16 PHE H H -0.877 1.898 -8.470 1.00 . A A . 16 PHE H 1 1 14 5912 1 1 16 PHE HA H 1.435 3.560 -8.930 1.00 . A A . 16 PHE HA 1 1 14 5913 1 1 16 PHE HB2 H 1.169 4.292 -6.682 1.00 . A A . 16 PHE HB2 1 1 14 5914 1 1 16 PHE HB3 H -0.461 3.897 -7.192 1.00 . A A . 16 PHE HB3 1 1 14 5915 1 1 16 PHE HD1 H -1.571 1.829 -6.332 1.00 . A A . 16 PHE HD1 1 1 14 5916 1 1 16 PHE HD2 H 2.315 2.953 -4.993 1.00 . A A . 16 PHE HD2 1 1 14 5917 1 1 16 PHE HE1 H -1.762 0.275 -4.443 1.00 . A A . 16 PHE HE1 1 1 14 5918 1 1 16 PHE HE2 H 2.115 1.395 -3.111 1.00 . A A . 16 PHE HE2 1 1 14 5919 1 1 16 PHE HZ H 0.074 0.052 -2.833 1.00 . A A . 16 PHE HZ 1 1 14 5920 1 1 16 PHE N N -0.007 2.025 -8.897 1.00 . A A . 16 PHE N 1 1 14 5921 1 1 16 PHE O O 3.380 2.304 -7.772 1.00 . A A . 16 PHE O 1 1 14 5922 1 1 17 LEU C C 3.861 -0.520 -8.577 1.00 . A A . 17 LEU C 1 1 14 5923 1 1 17 LEU CA C 2.922 -0.424 -7.382 1.00 . A A . 17 LEU CA 1 1 14 5924 1 1 17 LEU CB C 2.209 -1.771 -7.145 1.00 . A A . 17 LEU CB 1 1 14 5925 1 1 17 LEU CD1 C 0.188 -2.757 -5.986 1.00 . A A . 17 LEU CD1 1 1 14 5926 1 1 17 LEU CD2 C 2.110 -1.887 -4.614 1.00 . A A . 17 LEU CD2 1 1 14 5927 1 1 17 LEU CG C 1.284 -1.675 -5.902 1.00 . A A . 17 LEU CG 1 1 14 5928 1 1 17 LEU H H 0.984 0.344 -7.837 1.00 . A A . 17 LEU H 1 1 14 5929 1 1 17 LEU HA H 3.472 -0.103 -6.515 1.00 . A A . 17 LEU HA 1 1 14 5930 1 1 17 LEU HB2 H 1.621 -2.014 -8.019 1.00 . A A . 17 LEU HB2 1 1 14 5931 1 1 17 LEU HB3 H 2.944 -2.551 -7.004 1.00 . A A . 17 LEU HB3 1 1 14 5932 1 1 17 LEU HD11 H 0.630 -3.734 -6.119 1.00 . A A . 17 LEU HD11 1 1 14 5933 1 1 17 LEU HD12 H -0.400 -2.763 -5.080 1.00 . A A . 17 LEU HD12 1 1 14 5934 1 1 17 LEU HD13 H -0.467 -2.555 -6.821 1.00 . A A . 17 LEU HD13 1 1 14 5935 1 1 17 LEU HD21 H 2.630 -2.834 -4.649 1.00 . A A . 17 LEU HD21 1 1 14 5936 1 1 17 LEU HD22 H 2.836 -1.096 -4.501 1.00 . A A . 17 LEU HD22 1 1 14 5937 1 1 17 LEU HD23 H 1.461 -1.881 -3.750 1.00 . A A . 17 LEU HD23 1 1 14 5938 1 1 17 LEU HG H 0.812 -0.705 -5.873 1.00 . A A . 17 LEU HG 1 1 14 5939 1 1 17 LEU N N 1.913 0.616 -7.725 1.00 . A A . 17 LEU N 1 1 14 5940 1 1 17 LEU O O 5.064 -0.591 -8.433 1.00 . A A . 17 LEU O 1 1 14 5941 1 1 18 VAL C C 4.811 0.695 -11.134 1.00 . A A . 18 VAL C 1 1 14 5942 1 1 18 VAL CA C 4.009 -0.597 -11.003 1.00 . A A . 18 VAL CA 1 1 14 5943 1 1 18 VAL CB C 2.980 -0.803 -12.165 1.00 . A A . 18 VAL CB 1 1 14 5944 1 1 18 VAL CG1 C 3.346 -0.014 -13.452 1.00 . A A . 18 VAL CG1 1 1 14 5945 1 1 18 VAL CG2 C 2.962 -2.305 -12.484 1.00 . A A . 18 VAL CG2 1 1 14 5946 1 1 18 VAL H H 2.267 -0.449 -9.744 1.00 . A A . 18 VAL H 1 1 14 5947 1 1 18 VAL HA H 4.691 -1.420 -10.912 1.00 . A A . 18 VAL HA 1 1 14 5948 1 1 18 VAL HB H 1.993 -0.504 -11.843 1.00 . A A . 18 VAL HB 1 1 14 5949 1 1 18 VAL HG11 H 4.399 -0.094 -13.666 1.00 . A A . 18 VAL HG11 1 1 14 5950 1 1 18 VAL HG12 H 2.792 -0.397 -14.297 1.00 . A A . 18 VAL HG12 1 1 14 5951 1 1 18 VAL HG13 H 3.095 1.028 -13.326 1.00 . A A . 18 VAL HG13 1 1 14 5952 1 1 18 VAL HG21 H 3.963 -2.649 -12.702 1.00 . A A . 18 VAL HG21 1 1 14 5953 1 1 18 VAL HG22 H 2.591 -2.850 -11.628 1.00 . A A . 18 VAL HG22 1 1 14 5954 1 1 18 VAL HG23 H 2.329 -2.506 -13.333 1.00 . A A . 18 VAL HG23 1 1 14 5955 1 1 18 VAL N N 3.244 -0.513 -9.731 1.00 . A A . 18 VAL N 1 1 14 5956 1 1 18 VAL O O 5.989 0.672 -11.426 1.00 . A A . 18 VAL O 1 1 14 5957 1 1 19 PHE C C 5.882 3.269 -9.895 1.00 . A A . 19 PHE C 1 1 14 5958 1 1 19 PHE CA C 4.798 3.120 -10.988 1.00 . A A . 19 PHE CA 1 1 14 5959 1 1 19 PHE CB C 3.713 4.205 -10.831 1.00 . A A . 19 PHE CB 1 1 14 5960 1 1 19 PHE CD1 C 4.259 5.700 -12.806 1.00 . A A . 19 PHE CD1 1 1 14 5961 1 1 19 PHE CD2 C 4.630 6.563 -10.615 1.00 . A A . 19 PHE CD2 1 1 14 5962 1 1 19 PHE CE1 C 4.710 6.884 -13.350 1.00 . A A . 19 PHE CE1 1 1 14 5963 1 1 19 PHE CE2 C 5.081 7.748 -11.158 1.00 . A A . 19 PHE CE2 1 1 14 5964 1 1 19 PHE CG C 4.215 5.528 -11.433 1.00 . A A . 19 PHE CG 1 1 14 5965 1 1 19 PHE CZ C 5.121 7.909 -12.526 1.00 . A A . 19 PHE CZ 1 1 14 5966 1 1 19 PHE H H 3.188 1.720 -10.678 1.00 . A A . 19 PHE H 1 1 14 5967 1 1 19 PHE HA H 5.279 3.181 -11.955 1.00 . A A . 19 PHE HA 1 1 14 5968 1 1 19 PHE HB2 H 2.811 3.909 -11.347 1.00 . A A . 19 PHE HB2 1 1 14 5969 1 1 19 PHE HB3 H 3.480 4.356 -9.786 1.00 . A A . 19 PHE HB3 1 1 14 5970 1 1 19 PHE HD1 H 3.939 4.900 -13.459 1.00 . A A . 19 PHE HD1 1 1 14 5971 1 1 19 PHE HD2 H 4.601 6.445 -9.541 1.00 . A A . 19 PHE HD2 1 1 14 5972 1 1 19 PHE HE1 H 4.741 7.008 -14.422 1.00 . A A . 19 PHE HE1 1 1 14 5973 1 1 19 PHE HE2 H 5.402 8.551 -10.510 1.00 . A A . 19 PHE HE2 1 1 14 5974 1 1 19 PHE HZ H 5.474 8.837 -12.951 1.00 . A A . 19 PHE HZ 1 1 14 5975 1 1 19 PHE N N 4.137 1.787 -10.902 1.00 . A A . 19 PHE N 1 1 14 5976 1 1 19 PHE O O 6.497 4.312 -9.776 1.00 . A A . 19 PHE O 1 1 14 5977 1 1 20 PHE C C 7.859 0.870 -7.980 1.00 . A A . 20 PHE C 1 1 14 5978 1 1 20 PHE CA C 7.100 2.217 -8.039 1.00 . A A . 20 PHE CA 1 1 14 5979 1 1 20 PHE CB C 6.372 2.492 -6.703 1.00 . A A . 20 PHE CB 1 1 14 5980 1 1 20 PHE CD1 C 7.900 4.312 -5.819 1.00 . A A . 20 PHE CD1 1 1 14 5981 1 1 20 PHE CD2 C 7.786 2.262 -4.604 1.00 . A A . 20 PHE CD2 1 1 14 5982 1 1 20 PHE CE1 C 8.807 4.804 -4.904 1.00 . A A . 20 PHE CE1 1 1 14 5983 1 1 20 PHE CE2 C 8.694 2.755 -3.689 1.00 . A A . 20 PHE CE2 1 1 14 5984 1 1 20 PHE CG C 7.381 3.036 -5.678 1.00 . A A . 20 PHE CG 1 1 14 5985 1 1 20 PHE CZ C 9.205 4.026 -3.839 1.00 . A A . 20 PHE CZ 1 1 14 5986 1 1 20 PHE H H 5.553 1.409 -9.269 1.00 . A A . 20 PHE H 1 1 14 5987 1 1 20 PHE HA H 7.823 2.997 -8.235 1.00 . A A . 20 PHE HA 1 1 14 5988 1 1 20 PHE HB2 H 5.598 3.231 -6.846 1.00 . A A . 20 PHE HB2 1 1 14 5989 1 1 20 PHE HB3 H 5.922 1.587 -6.321 1.00 . A A . 20 PHE HB3 1 1 14 5990 1 1 20 PHE HD1 H 7.594 4.928 -6.652 1.00 . A A . 20 PHE HD1 1 1 14 5991 1 1 20 PHE HD2 H 7.391 1.265 -4.480 1.00 . A A . 20 PHE HD2 1 1 14 5992 1 1 20 PHE HE1 H 9.207 5.800 -5.023 1.00 . A A . 20 PHE HE1 1 1 14 5993 1 1 20 PHE HE2 H 9.004 2.143 -2.856 1.00 . A A . 20 PHE HE2 1 1 14 5994 1 1 20 PHE HZ H 9.916 4.411 -3.123 1.00 . A A . 20 PHE HZ 1 1 14 5995 1 1 20 PHE N N 6.082 2.219 -9.130 1.00 . A A . 20 PHE N 1 1 14 5996 1 1 20 PHE O O 8.567 0.621 -7.023 1.00 . A A . 20 PHE O 1 1 14 5997 1 1 21 ALA C C 8.775 -1.717 -10.415 1.00 . A A . 21 ALA C 1 1 14 5998 1 1 21 ALA CA C 8.411 -1.288 -8.996 1.00 . A A . 21 ALA CA 1 1 14 5999 1 1 21 ALA CB C 7.504 -2.349 -8.353 1.00 . A A . 21 ALA CB 1 1 14 6000 1 1 21 ALA H H 7.129 0.259 -9.744 1.00 . A A . 21 ALA H 1 1 14 6001 1 1 21 ALA HA H 9.328 -1.174 -8.454 1.00 . A A . 21 ALA HA 1 1 14 6002 1 1 21 ALA HB1 H 7.149 -2.001 -7.394 1.00 . A A . 21 ALA HB1 1 1 14 6003 1 1 21 ALA HB2 H 6.654 -2.553 -8.988 1.00 . A A . 21 ALA HB2 1 1 14 6004 1 1 21 ALA HB3 H 8.057 -3.267 -8.207 1.00 . A A . 21 ALA HB3 1 1 14 6005 1 1 21 ALA N N 7.705 0.034 -8.986 1.00 . A A . 21 ALA N 1 1 14 6006 1 1 21 ALA O O 9.783 -2.355 -10.642 1.00 . A A . 21 ALA O 1 1 14 6007 1 1 22 GLU C C 9.271 -0.773 -13.245 1.00 . A A . 22 GLU C 1 1 14 6008 1 1 22 GLU CA C 8.126 -1.676 -12.769 1.00 . A A . 22 GLU CA 1 1 14 6009 1 1 22 GLU CB C 6.825 -1.363 -13.523 1.00 . A A . 22 GLU CB 1 1 14 6010 1 1 22 GLU CD C 5.431 -1.841 -15.541 1.00 . A A . 22 GLU CD 1 1 14 6011 1 1 22 GLU CG C 6.744 -2.188 -14.818 1.00 . A A . 22 GLU CG 1 1 14 6012 1 1 22 GLU H H 7.136 -0.843 -11.067 1.00 . A A . 22 GLU H 1 1 14 6013 1 1 22 GLU HA H 8.408 -2.712 -12.856 1.00 . A A . 22 GLU HA 1 1 14 6014 1 1 22 GLU HB2 H 5.980 -1.597 -12.892 1.00 . A A . 22 GLU HB2 1 1 14 6015 1 1 22 GLU HB3 H 6.780 -0.307 -13.758 1.00 . A A . 22 GLU HB3 1 1 14 6016 1 1 22 GLU HG2 H 7.578 -1.956 -15.466 1.00 . A A . 22 GLU HG2 1 1 14 6017 1 1 22 GLU HG3 H 6.761 -3.246 -14.593 1.00 . A A . 22 GLU HG3 1 1 14 6018 1 1 22 GLU N N 7.925 -1.349 -11.330 1.00 . A A . 22 GLU N 1 1 14 6019 1 1 22 GLU O O 10.173 -1.178 -13.951 1.00 . A A . 22 GLU O 1 1 14 6020 1 1 22 GLU OE1 O 5.446 -0.847 -16.251 1.00 . A A . 22 GLU OE1 1 1 14 6021 1 1 22 GLU OE2 O 4.483 -2.585 -15.342 1.00 . A A . 22 GLU OE2 1 1 14 6022 1 1 23 ASP C C 11.333 1.493 -12.173 1.00 . A A . 23 ASP C 1 1 14 6023 1 1 23 ASP CA C 10.112 1.538 -13.101 1.00 . A A . 23 ASP CA 1 1 14 6024 1 1 23 ASP CB C 9.366 2.889 -12.960 1.00 . A A . 23 ASP CB 1 1 14 6025 1 1 23 ASP CG C 8.938 3.150 -11.496 1.00 . A A . 23 ASP CG 1 1 14 6026 1 1 23 ASP H H 8.366 0.635 -12.238 1.00 . A A . 23 ASP H 1 1 14 6027 1 1 23 ASP HA H 10.440 1.414 -14.115 1.00 . A A . 23 ASP HA 1 1 14 6028 1 1 23 ASP HB2 H 10.007 3.692 -13.295 1.00 . A A . 23 ASP HB2 1 1 14 6029 1 1 23 ASP HB3 H 8.479 2.880 -13.577 1.00 . A A . 23 ASP HB3 1 1 14 6030 1 1 23 ASP N N 9.144 0.448 -12.797 1.00 . A A . 23 ASP N 1 1 14 6031 1 1 23 ASP O O 12.458 1.633 -12.616 1.00 . A A . 23 ASP O 1 1 14 6032 1 1 23 ASP OD1 O 8.322 2.263 -10.931 1.00 . A A . 23 ASP OD1 1 1 14 6033 1 1 23 ASP OD2 O 9.252 4.227 -11.019 1.00 . A A . 23 ASP OD2 1 1 14 6034 1 1 24 VAL C C 12.911 -0.077 -10.106 1.00 . A A . 24 VAL C 1 1 14 6035 1 1 24 VAL CA C 12.141 1.227 -9.879 1.00 . A A . 24 VAL CA 1 1 14 6036 1 1 24 VAL CB C 11.490 1.263 -8.483 1.00 . A A . 24 VAL CB 1 1 14 6037 1 1 24 VAL CG1 C 12.550 1.065 -7.374 1.00 . A A . 24 VAL CG1 1 1 14 6038 1 1 24 VAL CG2 C 10.786 2.620 -8.267 1.00 . A A . 24 VAL CG2 1 1 14 6039 1 1 24 VAL H H 10.123 1.189 -10.652 1.00 . A A . 24 VAL H 1 1 14 6040 1 1 24 VAL HA H 12.799 2.067 -9.986 1.00 . A A . 24 VAL HA 1 1 14 6041 1 1 24 VAL HB H 10.770 0.472 -8.448 1.00 . A A . 24 VAL HB 1 1 14 6042 1 1 24 VAL HG11 H 13.360 1.769 -7.497 1.00 . A A . 24 VAL HG11 1 1 14 6043 1 1 24 VAL HG12 H 12.103 1.215 -6.403 1.00 . A A . 24 VAL HG12 1 1 14 6044 1 1 24 VAL HG13 H 12.951 0.063 -7.415 1.00 . A A . 24 VAL HG13 1 1 14 6045 1 1 24 VAL HG21 H 11.474 3.436 -8.432 1.00 . A A . 24 VAL HG21 1 1 14 6046 1 1 24 VAL HG22 H 9.959 2.719 -8.952 1.00 . A A . 24 VAL HG22 1 1 14 6047 1 1 24 VAL HG23 H 10.403 2.687 -7.259 1.00 . A A . 24 VAL HG23 1 1 14 6048 1 1 24 VAL N N 11.060 1.296 -10.911 1.00 . A A . 24 VAL N 1 1 14 6049 1 1 24 VAL O O 14.104 -0.067 -10.342 1.00 . A A . 24 VAL O 1 1 14 6050 1 1 25 GLY C C 12.867 -2.790 -11.730 1.00 . A A . 25 GLY C 1 1 14 6051 1 1 25 GLY CA C 12.784 -2.512 -10.224 1.00 . A A . 25 GLY CA 1 1 14 6052 1 1 25 GLY H H 11.227 -1.080 -9.827 1.00 . A A . 25 GLY H 1 1 14 6053 1 1 25 GLY HA2 H 13.774 -2.545 -9.794 1.00 . A A . 25 GLY HA2 1 1 14 6054 1 1 25 GLY HA3 H 12.155 -3.254 -9.755 1.00 . A A . 25 GLY HA3 1 1 14 6055 1 1 25 GLY N N 12.183 -1.161 -10.024 1.00 . A A . 25 GLY N 1 1 14 6056 1 1 25 GLY O O 12.794 -1.875 -12.530 1.00 . A A . 25 GLY O 1 1 14 6057 1 1 26 SER C C 14.302 -3.801 -14.232 1.00 . A A . 26 SER C 1 1 14 6058 1 1 26 SER CA C 13.115 -4.470 -13.510 1.00 . A A . 26 SER CA 1 1 14 6059 1 1 26 SER CB C 11.794 -4.109 -14.251 1.00 . A A . 26 SER CB 1 1 14 6060 1 1 26 SER H H 13.068 -4.728 -11.369 1.00 . A A . 26 SER H 1 1 14 6061 1 1 26 SER HA H 13.261 -5.538 -13.542 1.00 . A A . 26 SER HA 1 1 14 6062 1 1 26 SER HB2 H 11.744 -3.059 -14.498 1.00 . A A . 26 SER HB2 1 1 14 6063 1 1 26 SER HB3 H 11.677 -4.701 -15.146 1.00 . A A . 26 SER HB3 1 1 14 6064 1 1 26 SER HG H 10.181 -5.079 -13.756 1.00 . A A . 26 SER HG 1 1 14 6065 1 1 26 SER N N 13.017 -4.047 -12.071 1.00 . A A . 26 SER N 1 1 14 6066 1 1 26 SER O O 14.380 -3.818 -15.446 1.00 . A A . 26 SER O 1 1 14 6067 1 1 26 SER OG O 10.751 -4.430 -13.338 1.00 . A A . 26 SER OG 1 1 14 6068 1 1 27 ASN C C 17.240 -3.500 -14.866 1.00 . A A . 27 ASN C 1 1 14 6069 1 1 27 ASN CA C 16.399 -2.540 -14.013 1.00 . A A . 27 ASN CA 1 1 14 6070 1 1 27 ASN CB C 17.230 -1.999 -12.838 1.00 . A A . 27 ASN CB 1 1 14 6071 1 1 27 ASN CG C 18.296 -1.030 -13.366 1.00 . A A . 27 ASN CG 1 1 14 6072 1 1 27 ASN H H 15.066 -3.256 -12.483 1.00 . A A . 27 ASN H 1 1 14 6073 1 1 27 ASN HA H 16.063 -1.727 -14.638 1.00 . A A . 27 ASN HA 1 1 14 6074 1 1 27 ASN HB2 H 16.594 -1.471 -12.143 1.00 . A A . 27 ASN HB2 1 1 14 6075 1 1 27 ASN HB3 H 17.720 -2.808 -12.316 1.00 . A A . 27 ASN HB3 1 1 14 6076 1 1 27 ASN HD21 H 17.122 0.561 -13.182 1.00 . A A . 27 ASN HD21 1 1 14 6077 1 1 27 ASN HD22 H 18.678 0.872 -13.787 1.00 . A A . 27 ASN HD22 1 1 14 6078 1 1 27 ASN N N 15.192 -3.231 -13.454 1.00 . A A . 27 ASN N 1 1 14 6079 1 1 27 ASN ND2 N 18.008 0.240 -13.452 1.00 . A A . 27 ASN ND2 1 1 14 6080 1 1 27 ASN O O 17.900 -3.091 -15.802 1.00 . A A . 27 ASN O 1 1 14 6081 1 1 27 ASN OD1 O 19.396 -1.418 -13.704 1.00 . A A . 27 ASN OD1 1 1 14 6082 1 1 28 LYS C C 17.418 -5.996 -16.670 1.00 . A A . 28 LYS C 1 1 14 6083 1 1 28 LYS CA C 17.937 -5.818 -15.227 1.00 . A A . 28 LYS CA 1 1 14 6084 1 1 28 LYS CB C 17.799 -7.142 -14.438 1.00 . A A . 28 LYS CB 1 1 14 6085 1 1 28 LYS CD C 16.142 -8.554 -13.154 1.00 . A A . 28 LYS CD 1 1 14 6086 1 1 28 LYS CE C 14.654 -8.907 -12.983 1.00 . A A . 28 LYS CE 1 1 14 6087 1 1 28 LYS CG C 16.309 -7.567 -14.327 1.00 . A A . 28 LYS CG 1 1 14 6088 1 1 28 LYS H H 16.621 -4.994 -13.733 1.00 . A A . 28 LYS H 1 1 14 6089 1 1 28 LYS HA H 18.979 -5.529 -15.260 1.00 . A A . 28 LYS HA 1 1 14 6090 1 1 28 LYS HB2 H 18.359 -7.918 -14.939 1.00 . A A . 28 LYS HB2 1 1 14 6091 1 1 28 LYS HB3 H 18.218 -7.004 -13.451 1.00 . A A . 28 LYS HB3 1 1 14 6092 1 1 28 LYS HD2 H 16.704 -9.455 -13.353 1.00 . A A . 28 LYS HD2 1 1 14 6093 1 1 28 LYS HD3 H 16.513 -8.110 -12.241 1.00 . A A . 28 LYS HD3 1 1 14 6094 1 1 28 LYS HE2 H 14.222 -9.200 -13.930 1.00 . A A . 28 LYS HE2 1 1 14 6095 1 1 28 LYS HE3 H 14.547 -9.723 -12.285 1.00 . A A . 28 LYS HE3 1 1 14 6096 1 1 28 LYS HG2 H 15.680 -6.703 -14.168 1.00 . A A . 28 LYS HG2 1 1 14 6097 1 1 28 LYS HG3 H 16.004 -8.046 -15.247 1.00 . A A . 28 LYS HG3 1 1 14 6098 1 1 28 LYS HZ1 H 14.551 -6.930 -12.327 1.00 . A A . 28 LYS HZ1 1 1 14 6099 1 1 28 LYS HZ2 H 13.158 -7.467 -13.135 1.00 . A A . 28 LYS HZ2 1 1 14 6100 1 1 28 LYS HZ3 H 13.466 -7.978 -11.546 1.00 . A A . 28 LYS HZ3 1 1 14 6101 1 1 28 LYS N N 17.179 -4.753 -14.500 1.00 . A A . 28 LYS N 1 1 14 6102 1 1 28 LYS NZ N 13.901 -7.732 -12.458 1.00 . A A . 28 LYS NZ 1 1 14 6103 1 1 28 LYS O O 18.229 -6.392 -17.490 1.00 . A A . 28 LYS O 1 1 14 6104 1 1 28 LYS OXT O 16.243 -5.729 -16.874 1.00 . A A . 28 LYS OXT 1 1 15 6105 1 1 1 ASP C C 6.058 17.448 -5.161 1.00 . A A . 1 ASP C 1 1 15 6106 1 1 1 ASP CA C 5.728 18.396 -6.333 1.00 . A A . 1 ASP CA 1 1 15 6107 1 1 1 ASP CB C 6.313 19.824 -6.097 1.00 . A A . 1 ASP CB 1 1 15 6108 1 1 1 ASP CG C 5.887 20.383 -4.722 1.00 . A A . 1 ASP CG 1 1 15 6109 1 1 1 ASP H1 H 3.785 17.924 -5.747 1.00 . A A . 1 ASP H1 1 1 15 6110 1 1 1 ASP H2 H 3.960 19.499 -6.353 1.00 . A A . 1 ASP H2 1 1 15 6111 1 1 1 ASP H3 H 3.963 18.174 -7.417 1.00 . A A . 1 ASP H3 1 1 15 6112 1 1 1 ASP HA H 6.130 17.974 -7.243 1.00 . A A . 1 ASP HA 1 1 15 6113 1 1 1 ASP HB2 H 7.392 19.795 -6.157 1.00 . A A . 1 ASP HB2 1 1 15 6114 1 1 1 ASP HB3 H 5.954 20.492 -6.867 1.00 . A A . 1 ASP HB3 1 1 15 6115 1 1 1 ASP N N 4.248 18.507 -6.474 1.00 . A A . 1 ASP N 1 1 15 6116 1 1 1 ASP O O 5.323 16.511 -4.915 1.00 . A A . 1 ASP O 1 1 15 6117 1 1 1 ASP OD1 O 4.719 20.714 -4.604 1.00 . A A . 1 ASP OD1 1 1 15 6118 1 1 1 ASP OD2 O 6.754 20.448 -3.863 1.00 . A A . 1 ASP OD2 1 1 15 6119 1 1 2 ALA C C 8.685 17.614 -2.555 1.00 . A A . 2 ALA C 1 1 15 6120 1 1 2 ALA CA C 7.578 16.878 -3.325 1.00 . A A . 2 ALA CA 1 1 15 6121 1 1 2 ALA CB C 8.089 15.518 -3.854 1.00 . A A . 2 ALA CB 1 1 15 6122 1 1 2 ALA H H 7.697 18.486 -4.739 1.00 . A A . 2 ALA H 1 1 15 6123 1 1 2 ALA HA H 6.736 16.742 -2.666 1.00 . A A . 2 ALA HA 1 1 15 6124 1 1 2 ALA HB1 H 8.881 15.676 -4.573 1.00 . A A . 2 ALA HB1 1 1 15 6125 1 1 2 ALA HB2 H 8.469 14.922 -3.038 1.00 . A A . 2 ALA HB2 1 1 15 6126 1 1 2 ALA HB3 H 7.287 14.978 -4.332 1.00 . A A . 2 ALA HB3 1 1 15 6127 1 1 2 ALA N N 7.149 17.716 -4.482 1.00 . A A . 2 ALA N 1 1 15 6128 1 1 2 ALA O O 9.836 17.215 -2.554 1.00 . A A . 2 ALA O 1 1 15 6129 1 1 3 GLU C C 9.459 18.920 0.288 1.00 . A A . 3 GLU C 1 1 15 6130 1 1 3 GLU CA C 9.241 19.516 -1.117 1.00 . A A . 3 GLU CA 1 1 15 6131 1 1 3 GLU CB C 8.657 20.944 -1.035 1.00 . A A . 3 GLU CB 1 1 15 6132 1 1 3 GLU CD C 9.114 23.313 -0.376 1.00 . A A . 3 GLU CD 1 1 15 6133 1 1 3 GLU CG C 9.768 21.978 -0.771 1.00 . A A . 3 GLU CG 1 1 15 6134 1 1 3 GLU H H 7.345 18.952 -1.961 1.00 . A A . 3 GLU H 1 1 15 6135 1 1 3 GLU HA H 10.194 19.525 -1.623 1.00 . A A . 3 GLU HA 1 1 15 6136 1 1 3 GLU HB2 H 8.172 21.196 -1.965 1.00 . A A . 3 GLU HB2 1 1 15 6137 1 1 3 GLU HB3 H 7.921 20.989 -0.249 1.00 . A A . 3 GLU HB3 1 1 15 6138 1 1 3 GLU HG2 H 10.419 21.655 0.029 1.00 . A A . 3 GLU HG2 1 1 15 6139 1 1 3 GLU HG3 H 10.362 22.121 -1.663 1.00 . A A . 3 GLU HG3 1 1 15 6140 1 1 3 GLU N N 8.286 18.685 -1.915 1.00 . A A . 3 GLU N 1 1 15 6141 1 1 3 GLU O O 9.694 19.635 1.244 1.00 . A A . 3 GLU O 1 1 15 6142 1 1 3 GLU OE1 O 8.833 23.455 0.804 1.00 . A A . 3 GLU OE1 1 1 15 6143 1 1 3 GLU OE2 O 8.927 24.117 -1.275 1.00 . A A . 3 GLU OE2 1 1 15 6144 1 1 4 PHE C C 8.765 17.469 2.810 1.00 . A A . 4 PHE C 1 1 15 6145 1 1 4 PHE CA C 9.560 16.862 1.643 1.00 . A A . 4 PHE CA 1 1 15 6146 1 1 4 PHE CB C 11.079 16.837 1.948 1.00 . A A . 4 PHE CB 1 1 15 6147 1 1 4 PHE CD1 C 11.794 14.882 0.496 1.00 . A A . 4 PHE CD1 1 1 15 6148 1 1 4 PHE CD2 C 12.422 17.079 -0.194 1.00 . A A . 4 PHE CD2 1 1 15 6149 1 1 4 PHE CE1 C 12.421 14.355 -0.615 1.00 . A A . 4 PHE CE1 1 1 15 6150 1 1 4 PHE CE2 C 13.048 16.550 -1.304 1.00 . A A . 4 PHE CE2 1 1 15 6151 1 1 4 PHE CG C 11.789 16.250 0.715 1.00 . A A . 4 PHE CG 1 1 15 6152 1 1 4 PHE CZ C 13.048 15.189 -1.515 1.00 . A A . 4 PHE CZ 1 1 15 6153 1 1 4 PHE H H 9.184 17.112 -0.460 1.00 . A A . 4 PHE H 1 1 15 6154 1 1 4 PHE HA H 9.225 15.850 1.499 1.00 . A A . 4 PHE HA 1 1 15 6155 1 1 4 PHE HB2 H 11.453 17.832 2.140 1.00 . A A . 4 PHE HB2 1 1 15 6156 1 1 4 PHE HB3 H 11.282 16.209 2.803 1.00 . A A . 4 PHE HB3 1 1 15 6157 1 1 4 PHE HD1 H 11.305 14.223 1.198 1.00 . A A . 4 PHE HD1 1 1 15 6158 1 1 4 PHE HD2 H 12.427 18.148 -0.038 1.00 . A A . 4 PHE HD2 1 1 15 6159 1 1 4 PHE HE1 H 12.420 13.287 -0.778 1.00 . A A . 4 PHE HE1 1 1 15 6160 1 1 4 PHE HE2 H 13.539 17.205 -2.009 1.00 . A A . 4 PHE HE2 1 1 15 6161 1 1 4 PHE HZ H 13.539 14.776 -2.385 1.00 . A A . 4 PHE HZ 1 1 15 6162 1 1 4 PHE N N 9.374 17.614 0.359 1.00 . A A . 4 PHE N 1 1 15 6163 1 1 4 PHE O O 9.224 17.523 3.935 1.00 . A A . 4 PHE O 1 1 15 6164 1 1 5 ARG C C 5.198 18.342 3.055 1.00 . A A . 5 ARG C 1 1 15 6165 1 1 5 ARG CA C 6.660 18.527 3.480 1.00 . A A . 5 ARG CA 1 1 15 6166 1 1 5 ARG CB C 7.014 20.037 3.609 1.00 . A A . 5 ARG CB 1 1 15 6167 1 1 5 ARG CD C 5.610 21.555 2.095 1.00 . A A . 5 ARG CD 1 1 15 6168 1 1 5 ARG CG C 6.933 20.763 2.235 1.00 . A A . 5 ARG CG 1 1 15 6169 1 1 5 ARG CZ C 5.869 22.867 0.022 1.00 . A A . 5 ARG CZ 1 1 15 6170 1 1 5 ARG H H 7.276 17.828 1.555 1.00 . A A . 5 ARG H 1 1 15 6171 1 1 5 ARG HA H 6.793 18.008 4.410 1.00 . A A . 5 ARG HA 1 1 15 6172 1 1 5 ARG HB2 H 6.359 20.499 4.333 1.00 . A A . 5 ARG HB2 1 1 15 6173 1 1 5 ARG HB3 H 8.024 20.120 3.981 1.00 . A A . 5 ARG HB3 1 1 15 6174 1 1 5 ARG HD2 H 4.865 20.972 1.575 1.00 . A A . 5 ARG HD2 1 1 15 6175 1 1 5 ARG HD3 H 5.219 21.827 3.064 1.00 . A A . 5 ARG HD3 1 1 15 6176 1 1 5 ARG HE H 6.088 23.635 1.832 1.00 . A A . 5 ARG HE 1 1 15 6177 1 1 5 ARG HG2 H 7.770 21.440 2.153 1.00 . A A . 5 ARG HG2 1 1 15 6178 1 1 5 ARG HG3 H 6.999 20.049 1.430 1.00 . A A . 5 ARG HG3 1 1 15 6179 1 1 5 ARG HH11 H 5.414 20.933 -0.233 1.00 . A A . 5 ARG HH11 1 1 15 6180 1 1 5 ARG HH12 H 5.596 21.855 -1.685 1.00 . A A . 5 ARG HH12 1 1 15 6181 1 1 5 ARG HH21 H 6.323 24.814 0.012 1.00 . A A . 5 ARG HH21 1 1 15 6182 1 1 5 ARG HH22 H 6.119 24.084 -1.545 1.00 . A A . 5 ARG HH22 1 1 15 6183 1 1 5 ARG N N 7.578 17.908 2.479 1.00 . A A . 5 ARG N 1 1 15 6184 1 1 5 ARG NE N 5.886 22.816 1.334 1.00 . A A . 5 ARG NE 1 1 15 6185 1 1 5 ARG NH1 N 5.605 21.802 -0.687 1.00 . A A . 5 ARG NH1 1 1 15 6186 1 1 5 ARG NH2 N 6.123 24.010 -0.548 1.00 . A A . 5 ARG NH2 1 1 15 6187 1 1 5 ARG O O 4.316 19.068 3.470 1.00 . A A . 5 ARG O 1 1 15 6188 1 1 6 HIS C C 3.896 15.734 0.792 1.00 . A A . 6 HIS C 1 1 15 6189 1 1 6 HIS CA C 3.681 16.969 1.678 1.00 . A A . 6 HIS CA 1 1 15 6190 1 1 6 HIS CB C 3.082 18.149 0.838 1.00 . A A . 6 HIS CB 1 1 15 6191 1 1 6 HIS CD2 C 5.101 18.746 -0.788 1.00 . A A . 6 HIS CD2 1 1 15 6192 1 1 6 HIS CE1 C 4.138 18.392 -2.587 1.00 . A A . 6 HIS CE1 1 1 15 6193 1 1 6 HIS CG C 3.808 18.345 -0.500 1.00 . A A . 6 HIS CG 1 1 15 6194 1 1 6 HIS H H 5.801 16.823 1.964 1.00 . A A . 6 HIS H 1 1 15 6195 1 1 6 HIS HA H 3.028 16.709 2.498 1.00 . A A . 6 HIS HA 1 1 15 6196 1 1 6 HIS HB2 H 2.044 17.935 0.630 1.00 . A A . 6 HIS HB2 1 1 15 6197 1 1 6 HIS HB3 H 3.126 19.078 1.387 1.00 . A A . 6 HIS HB3 1 1 15 6198 1 1 6 HIS HD1 H 2.351 17.849 -1.810 1.00 . A A . 6 HIS HD1 1 1 15 6199 1 1 6 HIS HD2 H 5.847 18.998 -0.052 1.00 . A A . 6 HIS HD2 1 1 15 6200 1 1 6 HIS HE1 H 3.933 18.298 -3.643 1.00 . A A . 6 HIS HE1 1 1 15 6201 1 1 6 HIS N N 5.017 17.346 2.229 1.00 . A A . 6 HIS N 1 1 15 6202 1 1 6 HIS ND1 N 3.273 18.144 -1.658 1.00 . A A . 6 HIS ND1 1 1 15 6203 1 1 6 HIS NE2 N 5.288 18.769 -2.092 1.00 . A A . 6 HIS NE2 1 1 15 6204 1 1 6 HIS O O 3.171 14.762 0.893 1.00 . A A . 6 HIS O 1 1 15 6205 1 1 7 ASP C C 4.064 14.266 -1.762 1.00 . A A . 7 ASP C 1 1 15 6206 1 1 7 ASP CA C 5.289 14.749 -0.996 1.00 . A A . 7 ASP CA 1 1 15 6207 1 1 7 ASP CB C 5.954 13.625 -0.165 1.00 . A A . 7 ASP CB 1 1 15 6208 1 1 7 ASP CG C 7.158 14.252 0.566 1.00 . A A . 7 ASP CG 1 1 15 6209 1 1 7 ASP H H 5.423 16.659 -0.052 1.00 . A A . 7 ASP H 1 1 15 6210 1 1 7 ASP HA H 6.000 15.141 -1.703 1.00 . A A . 7 ASP HA 1 1 15 6211 1 1 7 ASP HB2 H 5.268 13.211 0.560 1.00 . A A . 7 ASP HB2 1 1 15 6212 1 1 7 ASP HB3 H 6.300 12.833 -0.814 1.00 . A A . 7 ASP HB3 1 1 15 6213 1 1 7 ASP N N 4.901 15.833 -0.046 1.00 . A A . 7 ASP N 1 1 15 6214 1 1 7 ASP O O 3.638 13.131 -1.655 1.00 . A A . 7 ASP O 1 1 15 6215 1 1 7 ASP OD1 O 6.931 14.784 1.643 1.00 . A A . 7 ASP OD1 1 1 15 6216 1 1 7 ASP OD2 O 8.237 14.168 0.000 1.00 . A A . 7 ASP OD2 1 1 15 6217 1 1 8 SER C C 2.610 13.763 -4.311 1.00 . A A . 8 SER C 1 1 15 6218 1 1 8 SER CA C 2.335 14.920 -3.349 1.00 . A A . 8 SER CA 1 1 15 6219 1 1 8 SER CB C 1.967 16.192 -4.141 1.00 . A A . 8 SER CB 1 1 15 6220 1 1 8 SER H H 3.952 16.084 -2.548 1.00 . A A . 8 SER H 1 1 15 6221 1 1 8 SER HA H 1.540 14.648 -2.680 1.00 . A A . 8 SER HA 1 1 15 6222 1 1 8 SER HB2 H 1.763 17.023 -3.484 1.00 . A A . 8 SER HB2 1 1 15 6223 1 1 8 SER HB3 H 2.733 16.461 -4.854 1.00 . A A . 8 SER HB3 1 1 15 6224 1 1 8 SER HG H 0.961 15.854 -5.774 1.00 . A A . 8 SER HG 1 1 15 6225 1 1 8 SER N N 3.541 15.196 -2.523 1.00 . A A . 8 SER N 1 1 15 6226 1 1 8 SER O O 1.899 12.778 -4.317 1.00 . A A . 8 SER O 1 1 15 6227 1 1 8 SER OG O 0.777 15.844 -4.833 1.00 . A A . 8 SER OG 1 1 15 6228 1 1 9 GLY C C 2.872 12.423 -6.906 1.00 . A A . 9 GLY C 1 1 15 6229 1 1 9 GLY CA C 4.072 12.918 -6.092 1.00 . A A . 9 GLY CA 1 1 15 6230 1 1 9 GLY H H 4.155 14.775 -4.995 1.00 . A A . 9 GLY H 1 1 15 6231 1 1 9 GLY HA2 H 4.792 13.364 -6.761 1.00 . A A . 9 GLY HA2 1 1 15 6232 1 1 9 GLY HA3 H 4.526 12.085 -5.577 1.00 . A A . 9 GLY HA3 1 1 15 6233 1 1 9 GLY N N 3.649 13.943 -5.086 1.00 . A A . 9 GLY N 1 1 15 6234 1 1 9 GLY O O 2.677 11.231 -7.046 1.00 . A A . 9 GLY O 1 1 15 6235 1 1 10 TYR C C -0.069 12.101 -7.616 1.00 . A A . 10 TYR C 1 1 15 6236 1 1 10 TYR CA C 0.890 13.142 -8.229 1.00 . A A . 10 TYR CA 1 1 15 6237 1 1 10 TYR CB C 1.333 12.701 -9.679 1.00 . A A . 10 TYR CB 1 1 15 6238 1 1 10 TYR CD1 C 1.192 10.158 -9.657 1.00 . A A . 10 TYR CD1 1 1 15 6239 1 1 10 TYR CD2 C 3.336 11.148 -9.881 1.00 . A A . 10 TYR CD2 1 1 15 6240 1 1 10 TYR CE1 C 1.755 8.904 -9.711 1.00 . A A . 10 TYR CE1 1 1 15 6241 1 1 10 TYR CE2 C 3.903 9.891 -9.934 1.00 . A A . 10 TYR CE2 1 1 15 6242 1 1 10 TYR CG C 1.969 11.296 -9.740 1.00 . A A . 10 TYR CG 1 1 15 6243 1 1 10 TYR CZ C 3.116 8.761 -9.850 1.00 . A A . 10 TYR CZ 1 1 15 6244 1 1 10 TYR H H 2.383 14.307 -7.213 1.00 . A A . 10 TYR H 1 1 15 6245 1 1 10 TYR HA H 0.356 14.078 -8.300 1.00 . A A . 10 TYR HA 1 1 15 6246 1 1 10 TYR HB2 H 0.474 12.711 -10.334 1.00 . A A . 10 TYR HB2 1 1 15 6247 1 1 10 TYR HB3 H 2.046 13.416 -10.062 1.00 . A A . 10 TYR HB3 1 1 15 6248 1 1 10 TYR HD1 H 0.124 10.239 -9.552 1.00 . A A . 10 TYR HD1 1 1 15 6249 1 1 10 TYR HD2 H 3.969 12.023 -9.947 1.00 . A A . 10 TYR HD2 1 1 15 6250 1 1 10 TYR HE1 H 1.119 8.033 -9.643 1.00 . A A . 10 TYR HE1 1 1 15 6251 1 1 10 TYR HE2 H 4.971 9.793 -10.046 1.00 . A A . 10 TYR HE2 1 1 15 6252 1 1 10 TYR HH H 4.174 7.436 -10.723 1.00 . A A . 10 TYR HH 1 1 15 6253 1 1 10 TYR N N 2.121 13.382 -7.400 1.00 . A A . 10 TYR N 1 1 15 6254 1 1 10 TYR O O 0.123 11.654 -6.501 1.00 . A A . 10 TYR O 1 1 15 6255 1 1 10 TYR OH O 3.680 7.504 -9.904 1.00 . A A . 10 TYR OH 1 1 15 6256 1 1 11 GLU C C -2.827 10.100 -9.031 1.00 . A A . 11 GLU C 1 1 15 6257 1 1 11 GLU CA C -2.076 10.743 -7.871 1.00 . A A . 11 GLU CA 1 1 15 6258 1 1 11 GLU CB C -3.069 11.437 -6.901 1.00 . A A . 11 GLU CB 1 1 15 6259 1 1 11 GLU CD C -4.627 13.388 -6.654 1.00 . A A . 11 GLU CD 1 1 15 6260 1 1 11 GLU CG C -3.487 12.786 -7.491 1.00 . A A . 11 GLU CG 1 1 15 6261 1 1 11 GLU H H -1.199 12.146 -9.252 1.00 . A A . 11 GLU H 1 1 15 6262 1 1 11 GLU HA H -1.535 9.956 -7.383 1.00 . A A . 11 GLU HA 1 1 15 6263 1 1 11 GLU HB2 H -3.937 10.812 -6.748 1.00 . A A . 11 GLU HB2 1 1 15 6264 1 1 11 GLU HB3 H -2.588 11.594 -5.946 1.00 . A A . 11 GLU HB3 1 1 15 6265 1 1 11 GLU HG2 H -2.635 13.448 -7.485 1.00 . A A . 11 GLU HG2 1 1 15 6266 1 1 11 GLU HG3 H -3.816 12.650 -8.511 1.00 . A A . 11 GLU HG3 1 1 15 6267 1 1 11 GLU N N -1.085 11.749 -8.364 1.00 . A A . 11 GLU N 1 1 15 6268 1 1 11 GLU O O -3.922 10.480 -9.402 1.00 . A A . 11 GLU O 1 1 15 6269 1 1 11 GLU OE1 O -5.761 13.065 -6.971 1.00 . A A . 11 GLU OE1 1 1 15 6270 1 1 11 GLU OE2 O -4.301 14.135 -5.746 1.00 . A A . 11 GLU OE2 1 1 15 6271 1 1 12 VAL C C -3.925 7.500 -10.238 1.00 . A A . 12 VAL C 1 1 15 6272 1 1 12 VAL CA C -2.736 8.352 -10.715 1.00 . A A . 12 VAL CA 1 1 15 6273 1 1 12 VAL CB C -1.610 7.487 -11.281 1.00 . A A . 12 VAL CB 1 1 15 6274 1 1 12 VAL CG1 C -2.130 6.480 -12.341 1.00 . A A . 12 VAL CG1 1 1 15 6275 1 1 12 VAL CG2 C -0.556 8.408 -11.931 1.00 . A A . 12 VAL CG2 1 1 15 6276 1 1 12 VAL H H -1.293 8.862 -9.218 1.00 . A A . 12 VAL H 1 1 15 6277 1 1 12 VAL HA H -3.043 9.062 -11.452 1.00 . A A . 12 VAL HA 1 1 15 6278 1 1 12 VAL HB H -1.172 6.981 -10.440 1.00 . A A . 12 VAL HB 1 1 15 6279 1 1 12 VAL HG11 H -2.642 7.002 -13.135 1.00 . A A . 12 VAL HG11 1 1 15 6280 1 1 12 VAL HG12 H -1.302 5.930 -12.766 1.00 . A A . 12 VAL HG12 1 1 15 6281 1 1 12 VAL HG13 H -2.816 5.775 -11.897 1.00 . A A . 12 VAL HG13 1 1 15 6282 1 1 12 VAL HG21 H -0.519 9.362 -11.425 1.00 . A A . 12 VAL HG21 1 1 15 6283 1 1 12 VAL HG22 H 0.417 7.945 -11.868 1.00 . A A . 12 VAL HG22 1 1 15 6284 1 1 12 VAL HG23 H -0.795 8.588 -12.967 1.00 . A A . 12 VAL HG23 1 1 15 6285 1 1 12 VAL N N -2.171 9.111 -9.570 1.00 . A A . 12 VAL N 1 1 15 6286 1 1 12 VAL O O -4.788 7.144 -11.017 1.00 . A A . 12 VAL O 1 1 15 6287 1 1 13 HIS C C -5.022 4.959 -8.894 1.00 . A A . 13 HIS C 1 1 15 6288 1 1 13 HIS CA C -4.992 6.386 -8.313 1.00 . A A . 13 HIS CA 1 1 15 6289 1 1 13 HIS CB C -6.361 7.091 -8.532 1.00 . A A . 13 HIS CB 1 1 15 6290 1 1 13 HIS CD2 C -7.625 7.479 -6.235 1.00 . A A . 13 HIS CD2 1 1 15 6291 1 1 13 HIS CE1 C -8.668 5.689 -6.159 1.00 . A A . 13 HIS CE1 1 1 15 6292 1 1 13 HIS CG C -7.299 6.754 -7.369 1.00 . A A . 13 HIS CG 1 1 15 6293 1 1 13 HIS H H -3.180 7.538 -8.404 1.00 . A A . 13 HIS H 1 1 15 6294 1 1 13 HIS HA H -4.772 6.318 -7.257 1.00 . A A . 13 HIS HA 1 1 15 6295 1 1 13 HIS HB2 H -6.230 8.163 -8.568 1.00 . A A . 13 HIS HB2 1 1 15 6296 1 1 13 HIS HB3 H -6.822 6.766 -9.454 1.00 . A A . 13 HIS HB3 1 1 15 6297 1 1 13 HIS HD1 H -7.973 4.924 -7.900 1.00 . A A . 13 HIS HD1 1 1 15 6298 1 1 13 HIS HD2 H -7.237 8.458 -5.994 1.00 . A A . 13 HIS HD2 1 1 15 6299 1 1 13 HIS HE1 H -9.321 4.892 -5.834 1.00 . A A . 13 HIS HE1 1 1 15 6300 1 1 13 HIS N N -3.917 7.207 -8.958 1.00 . A A . 13 HIS N 1 1 15 6301 1 1 13 HIS ND1 N -7.979 5.661 -7.254 1.00 . A A . 13 HIS ND1 1 1 15 6302 1 1 13 HIS NE2 N -8.479 6.801 -5.494 1.00 . A A . 13 HIS NE2 1 1 15 6303 1 1 13 HIS O O -5.985 4.235 -8.725 1.00 . A A . 13 HIS O 1 1 15 6304 1 1 14 HIS C C -2.409 2.949 -10.601 1.00 . A A . 14 HIS C 1 1 15 6305 1 1 14 HIS CA C -3.847 3.247 -10.181 1.00 . A A . 14 HIS CA 1 1 15 6306 1 1 14 HIS CB C -4.776 3.173 -11.418 1.00 . A A . 14 HIS CB 1 1 15 6307 1 1 14 HIS CD2 C -5.637 0.728 -11.971 1.00 . A A . 14 HIS CD2 1 1 15 6308 1 1 14 HIS CE1 C -7.197 0.646 -10.608 1.00 . A A . 14 HIS CE1 1 1 15 6309 1 1 14 HIS CG C -5.665 1.934 -11.291 1.00 . A A . 14 HIS CG 1 1 15 6310 1 1 14 HIS H H -3.209 5.225 -9.662 1.00 . A A . 14 HIS H 1 1 15 6311 1 1 14 HIS HA H -4.122 2.519 -9.437 1.00 . A A . 14 HIS HA 1 1 15 6312 1 1 14 HIS HB2 H -5.411 4.046 -11.476 1.00 . A A . 14 HIS HB2 1 1 15 6313 1 1 14 HIS HB3 H -4.210 3.100 -12.334 1.00 . A A . 14 HIS HB3 1 1 15 6314 1 1 14 HIS HD1 H -6.944 2.500 -9.831 1.00 . A A . 14 HIS HD1 1 1 15 6315 1 1 14 HIS HD2 H -4.931 0.472 -12.747 1.00 . A A . 14 HIS HD2 1 1 15 6316 1 1 14 HIS HE1 H -8.042 0.299 -10.032 1.00 . A A . 14 HIS HE1 1 1 15 6317 1 1 14 HIS N N -3.954 4.600 -9.563 1.00 . A A . 14 HIS N 1 1 15 6318 1 1 14 HIS ND1 N -6.652 1.813 -10.467 1.00 . A A . 14 HIS ND1 1 1 15 6319 1 1 14 HIS NE2 N -6.596 -0.062 -11.532 1.00 . A A . 14 HIS NE2 1 1 15 6320 1 1 14 HIS O O -1.646 3.837 -10.928 1.00 . A A . 14 HIS O 1 1 15 6321 1 1 15 GLN C C 0.420 1.891 -10.276 1.00 . A A . 15 GLN C 1 1 15 6322 1 1 15 GLN CA C -0.750 1.163 -10.949 1.00 . A A . 15 GLN CA 1 1 15 6323 1 1 15 GLN CB C -0.617 1.256 -12.488 1.00 . A A . 15 GLN CB 1 1 15 6324 1 1 15 GLN CD C -1.331 0.100 -14.597 1.00 . A A . 15 GLN CD 1 1 15 6325 1 1 15 GLN CG C -1.749 0.460 -13.166 1.00 . A A . 15 GLN CG 1 1 15 6326 1 1 15 GLN H H -2.789 1.036 -10.291 1.00 . A A . 15 GLN H 1 1 15 6327 1 1 15 GLN HA H -0.701 0.137 -10.624 1.00 . A A . 15 GLN HA 1 1 15 6328 1 1 15 GLN HB2 H -0.678 2.292 -12.791 1.00 . A A . 15 GLN HB2 1 1 15 6329 1 1 15 GLN HB3 H 0.341 0.863 -12.789 1.00 . A A . 15 GLN HB3 1 1 15 6330 1 1 15 GLN HE21 H 0.080 -1.164 -14.000 1.00 . A A . 15 GLN HE21 1 1 15 6331 1 1 15 GLN HE22 H -0.086 -1.003 -15.681 1.00 . A A . 15 GLN HE22 1 1 15 6332 1 1 15 GLN HG2 H -1.957 -0.452 -12.626 1.00 . A A . 15 GLN HG2 1 1 15 6333 1 1 15 GLN HG3 H -2.649 1.060 -13.207 1.00 . A A . 15 GLN HG3 1 1 15 6334 1 1 15 GLN N N -2.103 1.677 -10.571 1.00 . A A . 15 GLN N 1 1 15 6335 1 1 15 GLN NE2 N -0.364 -0.761 -14.775 1.00 . A A . 15 GLN NE2 1 1 15 6336 1 1 15 GLN O O 1.530 1.900 -10.766 1.00 . A A . 15 GLN O 1 1 15 6337 1 1 15 GLN OE1 O -1.874 0.596 -15.563 1.00 . A A . 15 GLN OE1 1 1 15 6338 1 1 16 PHE C C 2.293 2.223 -7.932 1.00 . A A . 16 PHE C 1 1 15 6339 1 1 16 PHE CA C 1.231 3.223 -8.416 1.00 . A A . 16 PHE CA 1 1 15 6340 1 1 16 PHE CB C 0.631 3.985 -7.205 1.00 . A A . 16 PHE CB 1 1 15 6341 1 1 16 PHE CD1 C -1.874 3.569 -7.135 1.00 . A A . 16 PHE CD1 1 1 15 6342 1 1 16 PHE CD2 C -0.489 2.342 -5.631 1.00 . A A . 16 PHE CD2 1 1 15 6343 1 1 16 PHE CE1 C -2.988 2.932 -6.630 1.00 . A A . 16 PHE CE1 1 1 15 6344 1 1 16 PHE CE2 C -1.602 1.704 -5.125 1.00 . A A . 16 PHE CE2 1 1 15 6345 1 1 16 PHE CG C -0.615 3.278 -6.639 1.00 . A A . 16 PHE CG 1 1 15 6346 1 1 16 PHE CZ C -2.853 1.999 -5.624 1.00 . A A . 16 PHE CZ 1 1 15 6347 1 1 16 PHE H H -0.765 2.433 -8.800 1.00 . A A . 16 PHE H 1 1 15 6348 1 1 16 PHE HA H 1.697 3.921 -9.095 1.00 . A A . 16 PHE HA 1 1 15 6349 1 1 16 PHE HB2 H 1.372 4.073 -6.424 1.00 . A A . 16 PHE HB2 1 1 15 6350 1 1 16 PHE HB3 H 0.352 4.978 -7.524 1.00 . A A . 16 PHE HB3 1 1 15 6351 1 1 16 PHE HD1 H -1.985 4.301 -7.921 1.00 . A A . 16 PHE HD1 1 1 15 6352 1 1 16 PHE HD2 H 0.488 2.109 -5.235 1.00 . A A . 16 PHE HD2 1 1 15 6353 1 1 16 PHE HE1 H -3.968 3.163 -7.020 1.00 . A A . 16 PHE HE1 1 1 15 6354 1 1 16 PHE HE2 H -1.495 0.972 -4.338 1.00 . A A . 16 PHE HE2 1 1 15 6355 1 1 16 PHE HZ H -3.725 1.500 -5.229 1.00 . A A . 16 PHE HZ 1 1 15 6356 1 1 16 PHE N N 0.148 2.486 -9.147 1.00 . A A . 16 PHE N 1 1 15 6357 1 1 16 PHE O O 3.446 2.568 -7.759 1.00 . A A . 16 PHE O 1 1 15 6358 1 1 17 LEU C C 3.677 -0.456 -8.429 1.00 . A A . 17 LEU C 1 1 15 6359 1 1 17 LEU CA C 2.748 -0.090 -7.272 1.00 . A A . 17 LEU CA 1 1 15 6360 1 1 17 LEU CB C 1.898 -1.307 -6.878 1.00 . A A . 17 LEU CB 1 1 15 6361 1 1 17 LEU CD1 C -0.223 -1.735 -5.567 1.00 . A A . 17 LEU CD1 1 1 15 6362 1 1 17 LEU CD2 C 1.972 -1.507 -4.352 1.00 . A A . 17 LEU CD2 1 1 15 6363 1 1 17 LEU CG C 1.140 -1.013 -5.555 1.00 . A A . 17 LEU CG 1 1 15 6364 1 1 17 LEU H H 0.912 0.803 -7.902 1.00 . A A . 17 LEU H 1 1 15 6365 1 1 17 LEU HA H 3.332 0.268 -6.441 1.00 . A A . 17 LEU HA 1 1 15 6366 1 1 17 LEU HB2 H 1.196 -1.508 -7.675 1.00 . A A . 17 LEU HB2 1 1 15 6367 1 1 17 LEU HB3 H 2.536 -2.172 -6.765 1.00 . A A . 17 LEU HB3 1 1 15 6368 1 1 17 LEU HD11 H -0.087 -2.799 -5.700 1.00 . A A . 17 LEU HD11 1 1 15 6369 1 1 17 LEU HD12 H -0.743 -1.564 -4.635 1.00 . A A . 17 LEU HD12 1 1 15 6370 1 1 17 LEU HD13 H -0.834 -1.358 -6.375 1.00 . A A . 17 LEU HD13 1 1 15 6371 1 1 17 LEU HD21 H 2.943 -1.034 -4.351 1.00 . A A . 17 LEU HD21 1 1 15 6372 1 1 17 LEU HD22 H 1.468 -1.260 -3.428 1.00 . A A . 17 LEU HD22 1 1 15 6373 1 1 17 LEU HD23 H 2.106 -2.577 -4.399 1.00 . A A . 17 LEU HD23 1 1 15 6374 1 1 17 LEU HG H 0.972 0.048 -5.454 1.00 . A A . 17 LEU HG 1 1 15 6375 1 1 17 LEU N N 1.853 1.006 -7.737 1.00 . A A . 17 LEU N 1 1 15 6376 1 1 17 LEU O O 4.824 -0.805 -8.235 1.00 . A A . 17 LEU O 1 1 15 6377 1 1 18 VAL C C 4.896 0.447 -11.057 1.00 . A A . 18 VAL C 1 1 15 6378 1 1 18 VAL CA C 3.871 -0.665 -10.861 1.00 . A A . 18 VAL CA 1 1 15 6379 1 1 18 VAL CB C 2.855 -0.729 -12.030 1.00 . A A . 18 VAL CB 1 1 15 6380 1 1 18 VAL CG1 C 3.533 -1.175 -13.339 1.00 . A A . 18 VAL CG1 1 1 15 6381 1 1 18 VAL CG2 C 1.772 -1.757 -11.660 1.00 . A A . 18 VAL CG2 1 1 15 6382 1 1 18 VAL H H 2.186 -0.063 -9.666 1.00 . A A . 18 VAL H 1 1 15 6383 1 1 18 VAL HA H 4.380 -1.601 -10.726 1.00 . A A . 18 VAL HA 1 1 15 6384 1 1 18 VAL HB H 2.403 0.238 -12.187 1.00 . A A . 18 VAL HB 1 1 15 6385 1 1 18 VAL HG11 H 4.332 -0.497 -13.595 1.00 . A A . 18 VAL HG11 1 1 15 6386 1 1 18 VAL HG12 H 3.931 -2.174 -13.235 1.00 . A A . 18 VAL HG12 1 1 15 6387 1 1 18 VAL HG13 H 2.815 -1.174 -14.145 1.00 . A A . 18 VAL HG13 1 1 15 6388 1 1 18 VAL HG21 H 2.238 -2.679 -11.341 1.00 . A A . 18 VAL HG21 1 1 15 6389 1 1 18 VAL HG22 H 1.169 -1.375 -10.849 1.00 . A A . 18 VAL HG22 1 1 15 6390 1 1 18 VAL HG23 H 1.138 -1.957 -12.508 1.00 . A A . 18 VAL HG23 1 1 15 6391 1 1 18 VAL N N 3.120 -0.353 -9.610 1.00 . A A . 18 VAL N 1 1 15 6392 1 1 18 VAL O O 6.047 0.211 -11.360 1.00 . A A . 18 VAL O 1 1 15 6393 1 1 19 PHE C C 6.451 2.731 -9.963 1.00 . A A . 19 PHE C 1 1 15 6394 1 1 19 PHE CA C 5.340 2.825 -11.027 1.00 . A A . 19 PHE CA 1 1 15 6395 1 1 19 PHE CB C 4.530 4.119 -10.840 1.00 . A A . 19 PHE CB 1 1 15 6396 1 1 19 PHE CD1 C 5.335 5.642 -12.700 1.00 . A A . 19 PHE CD1 1 1 15 6397 1 1 19 PHE CD2 C 6.165 6.029 -10.499 1.00 . A A . 19 PHE CD2 1 1 15 6398 1 1 19 PHE CE1 C 6.089 6.698 -13.171 1.00 . A A . 19 PHE CE1 1 1 15 6399 1 1 19 PHE CE2 C 6.919 7.085 -10.968 1.00 . A A . 19 PHE CE2 1 1 15 6400 1 1 19 PHE CG C 5.367 5.299 -11.361 1.00 . A A . 19 PHE CG 1 1 15 6401 1 1 19 PHE CZ C 6.881 7.419 -12.304 1.00 . A A . 19 PHE CZ 1 1 15 6402 1 1 19 PHE H H 3.490 1.771 -10.637 1.00 . A A . 19 PHE H 1 1 15 6403 1 1 19 PHE HA H 5.786 2.774 -12.010 1.00 . A A . 19 PHE HA 1 1 15 6404 1 1 19 PHE HB2 H 3.607 4.068 -11.400 1.00 . A A . 19 PHE HB2 1 1 15 6405 1 1 19 PHE HB3 H 4.297 4.281 -9.797 1.00 . A A . 19 PHE HB3 1 1 15 6406 1 1 19 PHE HD1 H 4.717 5.081 -13.386 1.00 . A A . 19 PHE HD1 1 1 15 6407 1 1 19 PHE HD2 H 6.201 5.774 -9.450 1.00 . A A . 19 PHE HD2 1 1 15 6408 1 1 19 PHE HE1 H 6.057 6.958 -14.218 1.00 . A A . 19 PHE HE1 1 1 15 6409 1 1 19 PHE HE2 H 7.539 7.649 -10.287 1.00 . A A . 19 PHE HE2 1 1 15 6410 1 1 19 PHE HZ H 7.471 8.246 -12.672 1.00 . A A . 19 PHE HZ 1 1 15 6411 1 1 19 PHE N N 4.432 1.653 -10.871 1.00 . A A . 19 PHE N 1 1 15 6412 1 1 19 PHE O O 7.506 3.317 -10.109 1.00 . A A . 19 PHE O 1 1 15 6413 1 1 20 PHE C C 7.960 0.521 -8.036 1.00 . A A . 20 PHE C 1 1 15 6414 1 1 20 PHE CA C 7.145 1.802 -7.813 1.00 . A A . 20 PHE CA 1 1 15 6415 1 1 20 PHE CB C 6.389 1.713 -6.478 1.00 . A A . 20 PHE CB 1 1 15 6416 1 1 20 PHE CD1 C 8.163 2.773 -4.997 1.00 . A A . 20 PHE CD1 1 1 15 6417 1 1 20 PHE CD2 C 7.596 0.490 -4.609 1.00 . A A . 20 PHE CD2 1 1 15 6418 1 1 20 PHE CE1 C 9.080 2.720 -3.968 1.00 . A A . 20 PHE CE1 1 1 15 6419 1 1 20 PHE CE2 C 8.514 0.436 -3.581 1.00 . A A . 20 PHE CE2 1 1 15 6420 1 1 20 PHE CG C 7.412 1.657 -5.327 1.00 . A A . 20 PHE CG 1 1 15 6421 1 1 20 PHE CZ C 9.257 1.551 -3.260 1.00 . A A . 20 PHE CZ 1 1 15 6422 1 1 20 PHE H H 5.292 1.548 -8.868 1.00 . A A . 20 PHE H 1 1 15 6423 1 1 20 PHE HA H 7.824 2.641 -7.795 1.00 . A A . 20 PHE HA 1 1 15 6424 1 1 20 PHE HB2 H 5.760 2.581 -6.350 1.00 . A A . 20 PHE HB2 1 1 15 6425 1 1 20 PHE HB3 H 5.772 0.826 -6.454 1.00 . A A . 20 PHE HB3 1 1 15 6426 1 1 20 PHE HD1 H 8.033 3.693 -5.547 1.00 . A A . 20 PHE HD1 1 1 15 6427 1 1 20 PHE HD2 H 7.020 -0.391 -4.854 1.00 . A A . 20 PHE HD2 1 1 15 6428 1 1 20 PHE HE1 H 9.662 3.595 -3.718 1.00 . A A . 20 PHE HE1 1 1 15 6429 1 1 20 PHE HE2 H 8.651 -0.480 -3.027 1.00 . A A . 20 PHE HE2 1 1 15 6430 1 1 20 PHE HZ H 9.976 1.510 -2.455 1.00 . A A . 20 PHE HZ 1 1 15 6431 1 1 20 PHE N N 6.165 1.989 -8.920 1.00 . A A . 20 PHE N 1 1 15 6432 1 1 20 PHE O O 9.022 0.374 -7.463 1.00 . A A . 20 PHE O 1 1 15 6433 1 1 21 ALA C C 8.667 -1.665 -10.565 1.00 . A A . 21 ALA C 1 1 15 6434 1 1 21 ALA CA C 8.151 -1.644 -9.137 1.00 . A A . 21 ALA CA 1 1 15 6435 1 1 21 ALA CB C 7.189 -2.808 -8.907 1.00 . A A . 21 ALA CB 1 1 15 6436 1 1 21 ALA H H 6.577 -0.202 -9.278 1.00 . A A . 21 ALA H 1 1 15 6437 1 1 21 ALA HA H 8.990 -1.720 -8.486 1.00 . A A . 21 ALA HA 1 1 15 6438 1 1 21 ALA HB1 H 6.298 -2.677 -9.502 1.00 . A A . 21 ALA HB1 1 1 15 6439 1 1 21 ALA HB2 H 7.671 -3.733 -9.186 1.00 . A A . 21 ALA HB2 1 1 15 6440 1 1 21 ALA HB3 H 6.919 -2.850 -7.864 1.00 . A A . 21 ALA HB3 1 1 15 6441 1 1 21 ALA N N 7.441 -0.367 -8.850 1.00 . A A . 21 ALA N 1 1 15 6442 1 1 21 ALA O O 9.854 -1.606 -10.782 1.00 . A A . 21 ALA O 1 1 15 6443 1 1 22 GLU C C 9.074 -0.632 -13.334 1.00 . A A . 22 GLU C 1 1 15 6444 1 1 22 GLU CA C 8.117 -1.774 -12.947 1.00 . A A . 22 GLU CA 1 1 15 6445 1 1 22 GLU CB C 6.822 -1.659 -13.748 1.00 . A A . 22 GLU CB 1 1 15 6446 1 1 22 GLU CD C 5.664 -2.059 -15.918 1.00 . A A . 22 GLU CD 1 1 15 6447 1 1 22 GLU CG C 6.992 -2.239 -15.162 1.00 . A A . 22 GLU CG 1 1 15 6448 1 1 22 GLU H H 6.822 -1.782 -11.214 1.00 . A A . 22 GLU H 1 1 15 6449 1 1 22 GLU HA H 8.604 -2.715 -13.154 1.00 . A A . 22 GLU HA 1 1 15 6450 1 1 22 GLU HB2 H 6.045 -2.195 -13.226 1.00 . A A . 22 GLU HB2 1 1 15 6451 1 1 22 GLU HB3 H 6.532 -0.618 -13.813 1.00 . A A . 22 GLU HB3 1 1 15 6452 1 1 22 GLU HG2 H 7.777 -1.720 -15.693 1.00 . A A . 22 GLU HG2 1 1 15 6453 1 1 22 GLU HG3 H 7.238 -3.290 -15.112 1.00 . A A . 22 GLU HG3 1 1 15 6454 1 1 22 GLU N N 7.760 -1.744 -11.494 1.00 . A A . 22 GLU N 1 1 15 6455 1 1 22 GLU O O 9.958 -0.802 -14.152 1.00 . A A . 22 GLU O 1 1 15 6456 1 1 22 GLU OE1 O 5.504 -0.994 -16.492 1.00 . A A . 22 GLU OE1 1 1 15 6457 1 1 22 GLU OE2 O 4.881 -2.995 -15.876 1.00 . A A . 22 GLU OE2 1 1 15 6458 1 1 23 ASP C C 10.805 1.960 -11.949 1.00 . A A . 23 ASP C 1 1 15 6459 1 1 23 ASP CA C 9.662 1.718 -12.956 1.00 . A A . 23 ASP CA 1 1 15 6460 1 1 23 ASP CB C 8.692 2.927 -12.963 1.00 . A A . 23 ASP CB 1 1 15 6461 1 1 23 ASP CG C 9.001 3.848 -14.154 1.00 . A A . 23 ASP CG 1 1 15 6462 1 1 23 ASP H H 8.108 0.508 -12.071 1.00 . A A . 23 ASP H 1 1 15 6463 1 1 23 ASP HA H 10.102 1.616 -13.932 1.00 . A A . 23 ASP HA 1 1 15 6464 1 1 23 ASP HB2 H 7.670 2.586 -13.042 1.00 . A A . 23 ASP HB2 1 1 15 6465 1 1 23 ASP HB3 H 8.790 3.502 -12.056 1.00 . A A . 23 ASP HB3 1 1 15 6466 1 1 23 ASP N N 8.844 0.492 -12.710 1.00 . A A . 23 ASP N 1 1 15 6467 1 1 23 ASP O O 11.323 3.059 -11.884 1.00 . A A . 23 ASP O 1 1 15 6468 1 1 23 ASP OD1 O 9.860 4.695 -13.976 1.00 . A A . 23 ASP OD1 1 1 15 6469 1 1 23 ASP OD2 O 8.358 3.652 -15.174 1.00 . A A . 23 ASP OD2 1 1 15 6470 1 1 24 VAL C C 13.203 -0.121 -10.145 1.00 . A A . 24 VAL C 1 1 15 6471 1 1 24 VAL CA C 12.278 1.108 -10.188 1.00 . A A . 24 VAL CA 1 1 15 6472 1 1 24 VAL CB C 11.650 1.335 -8.801 1.00 . A A . 24 VAL CB 1 1 15 6473 1 1 24 VAL CG1 C 12.739 1.690 -7.764 1.00 . A A . 24 VAL CG1 1 1 15 6474 1 1 24 VAL CG2 C 10.618 2.489 -8.846 1.00 . A A . 24 VAL CG2 1 1 15 6475 1 1 24 VAL H H 10.733 0.084 -11.284 1.00 . A A . 24 VAL H 1 1 15 6476 1 1 24 VAL HA H 12.870 1.969 -10.429 1.00 . A A . 24 VAL HA 1 1 15 6477 1 1 24 VAL HB H 11.169 0.417 -8.528 1.00 . A A . 24 VAL HB 1 1 15 6478 1 1 24 VAL HG11 H 13.394 2.456 -8.151 1.00 . A A . 24 VAL HG11 1 1 15 6479 1 1 24 VAL HG12 H 12.273 2.060 -6.865 1.00 . A A . 24 VAL HG12 1 1 15 6480 1 1 24 VAL HG13 H 13.323 0.816 -7.518 1.00 . A A . 24 VAL HG13 1 1 15 6481 1 1 24 VAL HG21 H 11.061 3.378 -9.271 1.00 . A A . 24 VAL HG21 1 1 15 6482 1 1 24 VAL HG22 H 9.766 2.204 -9.445 1.00 . A A . 24 VAL HG22 1 1 15 6483 1 1 24 VAL HG23 H 10.271 2.717 -7.849 1.00 . A A . 24 VAL HG23 1 1 15 6484 1 1 24 VAL N N 11.174 0.951 -11.196 1.00 . A A . 24 VAL N 1 1 15 6485 1 1 24 VAL O O 14.384 0.016 -9.893 1.00 . A A . 24 VAL O 1 1 15 6486 1 1 25 GLY C C 13.918 -2.890 -8.949 1.00 . A A . 25 GLY C 1 1 15 6487 1 1 25 GLY CA C 13.444 -2.549 -10.366 1.00 . A A . 25 GLY CA 1 1 15 6488 1 1 25 GLY H H 11.687 -1.340 -10.559 1.00 . A A . 25 GLY H 1 1 15 6489 1 1 25 GLY HA2 H 12.825 -3.354 -10.734 1.00 . A A . 25 GLY HA2 1 1 15 6490 1 1 25 GLY HA3 H 14.302 -2.438 -11.014 1.00 . A A . 25 GLY HA3 1 1 15 6491 1 1 25 GLY N N 12.646 -1.284 -10.378 1.00 . A A . 25 GLY N 1 1 15 6492 1 1 25 GLY O O 13.286 -3.657 -8.249 1.00 . A A . 25 GLY O 1 1 15 6493 1 1 26 SER C C 16.418 -1.272 -6.783 1.00 . A A . 26 SER C 1 1 15 6494 1 1 26 SER CA C 15.629 -2.513 -7.239 1.00 . A A . 26 SER CA 1 1 15 6495 1 1 26 SER CB C 16.559 -3.745 -7.310 1.00 . A A . 26 SER CB 1 1 15 6496 1 1 26 SER H H 15.474 -1.690 -9.203 1.00 . A A . 26 SER H 1 1 15 6497 1 1 26 SER HA H 14.833 -2.681 -6.535 1.00 . A A . 26 SER HA 1 1 15 6498 1 1 26 SER HB2 H 17.084 -3.907 -6.380 1.00 . A A . 26 SER HB2 1 1 15 6499 1 1 26 SER HB3 H 16.011 -4.635 -7.585 1.00 . A A . 26 SER HB3 1 1 15 6500 1 1 26 SER HG H 18.369 -3.423 -7.946 1.00 . A A . 26 SER HG 1 1 15 6501 1 1 26 SER N N 15.026 -2.296 -8.583 1.00 . A A . 26 SER N 1 1 15 6502 1 1 26 SER O O 17.092 -1.317 -5.772 1.00 . A A . 26 SER O 1 1 15 6503 1 1 26 SER OG O 17.492 -3.434 -8.336 1.00 . A A . 26 SER OG 1 1 15 6504 1 1 27 ASN C C 16.607 1.535 -5.790 1.00 . A A . 27 ASN C 1 1 15 6505 1 1 27 ASN CA C 17.030 1.065 -7.190 1.00 . A A . 27 ASN CA 1 1 15 6506 1 1 27 ASN CB C 16.681 2.131 -8.243 1.00 . A A . 27 ASN CB 1 1 15 6507 1 1 27 ASN CG C 17.676 3.294 -8.146 1.00 . A A . 27 ASN CG 1 1 15 6508 1 1 27 ASN H H 15.751 -0.220 -8.341 1.00 . A A . 27 ASN H 1 1 15 6509 1 1 27 ASN HA H 18.091 0.866 -7.185 1.00 . A A . 27 ASN HA 1 1 15 6510 1 1 27 ASN HB2 H 16.737 1.707 -9.236 1.00 . A A . 27 ASN HB2 1 1 15 6511 1 1 27 ASN HB3 H 15.683 2.512 -8.086 1.00 . A A . 27 ASN HB3 1 1 15 6512 1 1 27 ASN HD21 H 16.824 4.054 -6.522 1.00 . A A . 27 ASN HD21 1 1 15 6513 1 1 27 ASN HD22 H 18.175 4.905 -7.099 1.00 . A A . 27 ASN HD22 1 1 15 6514 1 1 27 ASN N N 16.310 -0.202 -7.538 1.00 . A A . 27 ASN N 1 1 15 6515 1 1 27 ASN ND2 N 17.548 4.156 -7.174 1.00 . A A . 27 ASN ND2 1 1 15 6516 1 1 27 ASN O O 17.389 2.104 -5.052 1.00 . A A . 27 ASN O 1 1 15 6517 1 1 27 ASN OD1 O 18.577 3.428 -8.949 1.00 . A A . 27 ASN OD1 1 1 15 6518 1 1 28 LYS C C 15.486 0.902 -3.016 1.00 . A A . 28 LYS C 1 1 15 6519 1 1 28 LYS CA C 14.772 1.645 -4.166 1.00 . A A . 28 LYS CA 1 1 15 6520 1 1 28 LYS CB C 13.261 1.290 -4.163 1.00 . A A . 28 LYS CB 1 1 15 6521 1 1 28 LYS CD C 11.569 -0.376 -5.099 1.00 . A A . 28 LYS CD 1 1 15 6522 1 1 28 LYS CE C 11.524 -1.448 -6.207 1.00 . A A . 28 LYS CE 1 1 15 6523 1 1 28 LYS CG C 13.027 -0.185 -4.606 1.00 . A A . 28 LYS CG 1 1 15 6524 1 1 28 LYS H H 14.812 0.809 -6.153 1.00 . A A . 28 LYS H 1 1 15 6525 1 1 28 LYS HA H 14.894 2.710 -4.031 1.00 . A A . 28 LYS HA 1 1 15 6526 1 1 28 LYS HB2 H 12.865 1.427 -3.167 1.00 . A A . 28 LYS HB2 1 1 15 6527 1 1 28 LYS HB3 H 12.743 1.971 -4.820 1.00 . A A . 28 LYS HB3 1 1 15 6528 1 1 28 LYS HD2 H 10.953 -0.696 -4.270 1.00 . A A . 28 LYS HD2 1 1 15 6529 1 1 28 LYS HD3 H 11.166 0.549 -5.484 1.00 . A A . 28 LYS HD3 1 1 15 6530 1 1 28 LYS HE2 H 10.508 -1.592 -6.539 1.00 . A A . 28 LYS HE2 1 1 15 6531 1 1 28 LYS HE3 H 12.128 -1.148 -7.052 1.00 . A A . 28 LYS HE3 1 1 15 6532 1 1 28 LYS HG2 H 13.716 -0.465 -5.389 1.00 . A A . 28 LYS HG2 1 1 15 6533 1 1 28 LYS HG3 H 13.199 -0.837 -3.762 1.00 . A A . 28 LYS HG3 1 1 15 6534 1 1 28 LYS HZ1 H 12.314 -2.641 -4.692 1.00 . A A . 28 LYS HZ1 1 1 15 6535 1 1 28 LYS HZ2 H 11.299 -3.471 -5.771 1.00 . A A . 28 LYS HZ2 1 1 15 6536 1 1 28 LYS HZ3 H 12.870 -3.036 -6.247 1.00 . A A . 28 LYS HZ3 1 1 15 6537 1 1 28 LYS N N 15.363 1.267 -5.488 1.00 . A A . 28 LYS N 1 1 15 6538 1 1 28 LYS NZ N 12.041 -2.747 -5.690 1.00 . A A . 28 LYS NZ 1 1 15 6539 1 1 28 LYS O O 15.875 -0.232 -3.248 1.00 . A A . 28 LYS O 1 1 15 6540 1 1 28 LYS OXT O 15.600 1.515 -1.967 1.00 . A A . 28 LYS OXT 1 1 stop_ save_
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