NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | in_recoord | in_dress | stage | program | type | subtype | item_count |
369189 | 1ba4 | cing | recoord | dress | 4-filtered-FRED | STAR | entry | full | 177 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1ba4 # This FRED archive file contains, for PDB entry <1ba4>: # # - 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_1ba4 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1ba4 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 4326.78 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 DAEFRHDSGYEVHHQKLVFFAEDVGSNKGAIIGLMVGGVV _Entity.Number_of_monomers 40 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 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 LYS . 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 29 GLY . 1 1 30 ALA . 1 1 31 ILE . 1 1 32 ILE . 1 1 33 GLY . 1 1 34 LEU . 1 1 35 MET . 1 1 36 VAL . 1 1 37 GLY . 1 1 38 GLY . 1 1 39 VAL . 1 1 40 VAL . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID 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 LYS 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 GLY 29 29 1 1 ALA 30 30 1 1 ILE 31 31 1 1 ILE 32 32 1 1 GLY 33 33 1 1 LEU 34 34 1 1 MET 35 35 1 1 VAL 36 36 1 1 GLY 37 37 1 1 GLY 38 38 1 1 VAL 39 39 1 1 VAL 40 40 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 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 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 QD . 4 . HD* 1 1 7 1 1 1 1 3 GLU H . 3 . HN 1 1 7 1 2 1 1 4 PHE H . 4 . HN 1 1 8 1 1 1 1 4 PHE H . 4 . HN 1 1 8 1 2 1 1 4 PHE QD . 4 . HD* 1 1 9 1 1 1 1 4 PHE H . 4 . HN 1 1 9 1 2 1 1 5 ARG H . 5 . HN 1 1 10 1 1 1 1 4 PHE HA . 4 . HA 1 1 10 1 2 1 1 5 ARG H . 5 . HN 1 1 11 1 1 1 1 4 PHE QB . 4 . HB* 1 1 11 1 2 1 1 5 ARG H . 5 . HN 1 1 12 1 1 1 1 5 ARG H . 5 . HN 1 1 12 1 2 1 1 6 HIS H . 6 . HN 1 1 13 1 1 1 1 5 ARG HA . 5 . HA 1 1 13 1 2 1 1 6 HIS H . 6 . HN 1 1 14 1 1 1 1 5 ARG QB . 5 . HB* 1 1 14 1 2 1 1 6 HIS H . 6 . HN 1 1 15 1 1 1 1 6 HIS H . 6 . HN 1 1 15 1 2 1 1 6 HIS HA . 6 . HA 1 1 16 1 1 1 1 6 HIS H . 6 . HN 1 1 16 1 2 1 1 7 ASP H . 7 . HN 1 1 17 1 1 1 1 6 HIS HA . 6 . HA 1 1 17 1 2 1 1 7 ASP H . 7 . HN 1 1 18 1 1 1 1 7 ASP H . 7 . HN 1 1 18 1 2 1 1 7 ASP HA . 7 . HA 1 1 19 1 1 1 1 7 ASP HA . 7 . HA 1 1 19 1 2 1 1 8 SER H . 8 . HN 1 1 20 1 1 1 1 7 ASP HB2 . 7 . HB2 1 1 20 1 2 1 1 8 SER H . 8 . HN 1 1 21 1 1 1 1 7 ASP HB3 . 7 . HB1 1 1 21 1 2 1 1 8 SER H . 8 . HN 1 1 22 1 1 1 1 8 SER H . 8 . HN 1 1 22 1 2 1 1 8 SER HA . 8 . HA 1 1 23 1 1 1 1 8 SER HA . 8 . HA 1 1 23 1 2 1 1 9 GLY H . 9 . HN 1 1 24 1 1 1 1 9 GLY H . 9 . HN 1 1 24 1 2 1 1 10 TYR H . 10 . HN 1 1 25 1 1 1 1 9 GLY QA . 9 . HA* 1 1 25 1 2 1 1 10 TYR H . 10 . HN 1 1 26 1 1 1 1 10 TYR H . 10 . HN 1 1 26 1 2 1 1 10 TYR QD . 10 . HD* 1 1 27 1 1 1 1 10 TYR H . 10 . HN 1 1 27 1 2 1 1 10 TYR QE . 10 . HE* 1 1 28 1 1 1 1 10 TYR QD . 10 . HD* 1 1 28 1 2 1 1 12 VAL HA . 12 . HA 1 1 29 1 1 1 1 10 TYR QD . 10 . HD* 1 1 29 1 2 1 1 12 VAL MG1 . 12 . HG1* 1 1 30 1 1 1 1 10 TYR QE . 10 . HE* 1 1 30 1 2 1 1 12 VAL HA . 12 . HA 1 1 31 1 1 1 1 10 TYR QE . 10 . HE* 1 1 31 1 2 1 1 12 VAL MG1 . 12 . HG1* 1 1 32 1 1 1 1 10 TYR QE . 10 . HE* 1 1 32 1 2 1 1 12 VAL MG2 . 12 . HG2* 1 1 33 1 1 1 1 12 VAL H . 12 . HN 1 1 33 1 2 1 1 13 HIS H . 13 . HN 1 1 34 1 1 1 1 12 VAL HA . 12 . HA 1 1 34 1 2 1 1 13 HIS H . 13 . HN 1 1 35 1 1 1 1 12 VAL HA . 12 . HA 1 1 35 1 2 1 1 13 HIS QB . 13 . HB* 1 1 36 1 1 1 1 12 VAL HB . 12 . HB 1 1 36 1 2 1 1 13 HIS H . 13 . HN 1 1 37 1 1 1 1 12 VAL MG1 . 12 . HG1* 1 1 37 1 2 1 1 13 HIS H . 13 . HN 1 1 38 1 1 1 1 12 VAL MG1 . 12 . HG1* 1 1 38 1 2 1 1 16 LYS H . 16 . HN 1 1 39 1 1 1 1 12 VAL MG2 . 12 . HG2* 1 1 39 1 2 1 1 13 HIS H . 13 . HN 1 1 40 1 1 1 1 12 VAL MG2 . 12 . HG2* 1 1 40 1 2 1 1 16 LYS H . 16 . HN 1 1 41 1 1 1 1 13 HIS H . 13 . HN 1 1 41 1 2 1 1 14 HIS H . 14 . HN 1 1 42 1 1 1 1 13 HIS HA . 13 . HA 1 1 42 1 2 1 1 13 HIS HD2 . 13 . HD2 1 1 43 1 1 1 1 13 HIS HA . 13 . HA 1 1 43 1 2 1 1 14 HIS H . 14 . HN 1 1 44 1 1 1 1 13 HIS QB . 13 . HB* 1 1 44 1 2 1 1 14 HIS H . 14 . HN 1 1 45 1 1 1 1 13 HIS QB . 13 . HB* 1 1 45 1 2 1 1 14 HIS HD2 . 14 . HD2 1 1 46 1 1 1 1 13 HIS QB . 13 . HB* 1 1 46 1 2 1 1 14 HIS HE1 . 14 . HE1 1 1 47 1 1 1 1 14 HIS H . 14 . HN 1 1 47 1 2 1 1 14 HIS HD2 . 14 . HD2 1 1 48 1 1 1 1 14 HIS H . 14 . HN 1 1 48 1 2 1 1 15 GLN H . 15 . HN 1 1 49 1 1 1 1 14 HIS HA . 14 . HA 1 1 49 1 2 1 1 15 GLN H . 15 . HN 1 1 50 1 1 1 1 14 HIS HB2 . 14 . HB2 1 1 50 1 2 1 1 17 LEU QB . 17 . HB* 1 1 51 1 1 1 1 14 HIS HB3 . 14 . HB1 1 1 51 1 2 1 1 17 LEU QB . 17 . HB* 1 1 52 1 1 1 1 15 GLN H . 15 . HN 1 1 52 1 2 1 1 16 LYS H . 16 . HN 1 1 53 1 1 1 1 15 GLN HA . 15 . HA 1 1 53 1 2 1 1 16 LYS H . 16 . HN 1 1 54 1 1 1 1 15 GLN HA . 15 . HA 1 1 54 1 2 1 1 18 VAL H . 18 . HN 1 1 55 1 1 1 1 15 GLN HA . 15 . HA 1 1 55 1 2 1 1 18 VAL MG2 . 18 . HG2* 1 1 56 1 1 1 1 15 GLN QB . 15 . HB* 1 1 56 1 2 1 1 19 PHE QD . 19 . HD* 1 1 57 1 1 1 1 15 GLN QB . 15 . HB* 1 1 57 1 2 1 1 19 PHE QE . 19 . HE* 1 1 58 1 1 1 1 15 GLN QG . 15 . HG* 1 1 58 1 2 1 1 19 PHE QD . 19 . HD* 1 1 59 1 1 1 1 15 GLN QG . 15 . HG* 1 1 59 1 2 1 1 19 PHE QE . 19 . HE* 1 1 60 1 1 1 1 16 LYS H . 16 . HN 1 1 60 1 2 1 1 17 LEU H . 17 . HN 1 1 61 1 1 1 1 16 LYS HA . 16 . HA 1 1 61 1 2 1 1 17 LEU H . 17 . HN 1 1 62 1 1 1 1 16 LYS HA . 16 . HA 1 1 62 1 2 1 1 19 PHE QB . 19 . HB* 1 1 63 1 1 1 1 16 LYS HA . 16 . HA 1 1 63 1 2 1 1 19 PHE QD . 19 . HD* 1 1 64 1 1 1 1 16 LYS QB . 16 . HB* 1 1 64 1 2 1 1 17 LEU H . 17 . HN 1 1 65 1 1 1 1 16 LYS QD . 16 . HD* 1 1 65 1 2 1 1 20 PHE QD . 20 . HD* 1 1 66 1 1 1 1 17 LEU H . 17 . HN 1 1 66 1 2 1 1 18 VAL H . 18 . HN 1 1 67 1 1 1 1 17 LEU HA . 17 . HA 1 1 67 1 2 1 1 18 VAL H . 18 . HN 1 1 68 1 1 1 1 17 LEU HA . 17 . HA 1 1 68 1 2 1 1 20 PHE H . 20 . HN 1 1 69 1 1 1 1 17 LEU HA . 17 . HA 1 1 69 1 2 1 1 20 PHE QB . 20 . HB* 1 1 70 1 1 1 1 17 LEU HA . 17 . HA 1 1 70 1 2 1 1 20 PHE QD . 20 . HD* 1 1 71 1 1 1 1 17 LEU HA . 17 . HA 1 1 71 1 2 1 1 21 ALA H . 21 . HN 1 1 72 1 1 1 1 17 LEU QB . 17 . HB* 1 1 72 1 2 1 1 18 VAL H . 18 . HN 1 1 73 1 1 1 1 17 LEU QD . 17 . HD* 1 1 73 1 2 1 1 20 PHE QD . 20 . HD* 1 1 74 1 1 1 1 18 VAL H . 18 . HN 1 1 74 1 2 1 1 19 PHE H . 19 . HN 1 1 75 1 1 1 1 18 VAL H . 18 . HN 1 1 75 1 2 1 1 20 PHE H . 20 . HN 1 1 76 1 1 1 1 18 VAL HA . 18 . HA 1 1 76 1 2 1 1 19 PHE H . 19 . HN 1 1 77 1 1 1 1 18 VAL HA . 18 . HA 1 1 77 1 2 1 1 21 ALA H . 21 . HN 1 1 78 1 1 1 1 18 VAL HA . 18 . HA 1 1 78 1 2 1 1 21 ALA MB . 21 . HB* 1 1 79 1 1 1 1 18 VAL HA . 18 . HA 1 1 79 1 2 1 1 22 GLU H . 22 . HN 1 1 80 1 1 1 1 18 VAL MG1 . 18 . HG1* 1 1 80 1 2 1 1 19 PHE QD . 19 . HD* 1 1 81 1 1 1 1 18 VAL MG1 . 18 . HG1* 1 1 81 1 2 1 1 19 PHE QE . 19 . HE* 1 1 82 1 1 1 1 19 PHE H . 19 . HN 1 1 82 1 2 1 1 19 PHE QD . 19 . HD* 1 1 83 1 1 1 1 19 PHE H . 19 . HN 1 1 83 1 2 1 1 20 PHE H . 20 . HN 1 1 84 1 1 1 1 19 PHE H . 19 . HN 1 1 84 1 2 1 1 21 ALA H . 21 . HN 1 1 85 1 1 1 1 19 PHE HA . 19 . HA 1 1 85 1 2 1 1 19 PHE QE . 19 . HE* 1 1 86 1 1 1 1 19 PHE HA . 19 . HA 1 1 86 1 2 1 1 20 PHE H . 20 . HN 1 1 87 1 1 1 1 19 PHE HA . 19 . HA 1 1 87 1 2 1 1 22 GLU QB . 22 . HB* 1 1 88 1 1 1 1 19 PHE HA . 19 . HA 1 1 88 1 2 1 1 22 GLU QG . 22 . HG* 1 1 89 1 1 1 1 19 PHE QB . 19 . HB* 1 1 89 1 2 1 1 20 PHE H . 20 . HN 1 1 90 1 1 1 1 20 PHE H . 20 . HN 1 1 90 1 2 1 1 20 PHE QD . 20 . HD* 1 1 91 1 1 1 1 20 PHE H . 20 . HN 1 1 91 1 2 1 1 20 PHE QE . 20 . HE* 1 1 92 1 1 1 1 20 PHE HA . 20 . HA 1 1 92 1 2 1 1 20 PHE QE . 20 . HE* 1 1 93 1 1 1 1 20 PHE HA . 20 . HA 1 1 93 1 2 1 1 21 ALA H . 21 . HN 1 1 94 1 1 1 1 20 PHE HA . 20 . HA 1 1 94 1 2 1 1 23 ASP HB2 . 23 . HB2 1 1 95 1 1 1 1 20 PHE HA . 20 . HA 1 1 95 1 2 1 1 23 ASP HB3 . 23 . HB1 1 1 96 1 1 1 1 20 PHE QB . 20 . HB* 1 1 96 1 2 1 1 21 ALA H . 21 . HN 1 1 97 1 1 1 1 20 PHE QD . 20 . HD* 1 1 97 1 2 1 1 21 ALA H . 21 . HN 1 1 98 1 1 1 1 20 PHE QD . 20 . HD* 1 1 98 1 2 1 1 21 ALA MB . 21 . HB* 1 1 99 1 1 1 1 20 PHE QD . 20 . HD* 1 1 99 1 2 1 1 23 ASP HB2 . 23 . HB2 1 1 100 1 1 1 1 20 PHE QD . 20 . HD* 1 1 100 1 2 1 1 23 ASP HB3 . 23 . HB1 1 1 101 1 1 1 1 20 PHE QD . 20 . HD* 1 1 101 1 2 1 1 24 VAL HB . 24 . HB 1 1 102 1 1 1 1 20 PHE QD . 20 . HD* 1 1 102 1 2 1 1 24 VAL MG1 . 24 . HG1* 1 1 103 1 1 1 1 20 PHE QD . 20 . HD* 1 1 103 1 2 1 1 24 VAL MG2 . 24 . HG2* 1 1 104 1 1 1 1 20 PHE QE . 20 . HE* 1 1 104 1 2 1 1 24 VAL MG1 . 24 . HG1* 1 1 105 1 1 1 1 20 PHE QE . 20 . HE* 1 1 105 1 2 1 1 24 VAL MG2 . 24 . HG2* 1 1 106 1 1 1 1 21 ALA H . 21 . HN 1 1 106 1 2 1 1 21 ALA HA . 21 . HA 1 1 107 1 1 1 1 21 ALA HA . 21 . HA 1 1 107 1 2 1 1 22 GLU H . 22 . HN 1 1 108 1 1 1 1 21 ALA HA . 21 . HA 1 1 108 1 2 1 1 24 VAL HB . 24 . HB 1 1 109 1 1 1 1 21 ALA HA . 21 . HA 1 1 109 1 2 1 1 24 VAL MG1 . 24 . HG1* 1 1 110 1 1 1 1 21 ALA HA . 21 . HA 1 1 110 1 2 1 1 24 VAL MG2 . 24 . HG2* 1 1 111 1 1 1 1 21 ALA MB . 21 . HB* 1 1 111 1 2 1 1 22 GLU H . 22 . HN 1 1 112 1 1 1 1 22 GLU H . 22 . HN 1 1 112 1 2 1 1 23 ASP H . 23 . HN 1 1 113 1 1 1 1 22 GLU H . 22 . HN 1 1 113 1 2 1 1 24 VAL H . 24 . HN 1 1 114 1 1 1 1 22 GLU HA . 22 . HA 1 1 114 1 2 1 1 25 GLY H . 25 . HN 1 1 115 1 1 1 1 22 GLU QB . 22 . HB* 1 1 115 1 2 1 1 23 ASP H . 23 . HN 1 1 116 1 1 1 1 22 GLU QG . 22 . HG* 1 1 116 1 2 1 1 23 ASP H . 23 . HN 1 1 117 1 1 1 1 23 ASP H . 23 . HN 1 1 117 1 2 1 1 23 ASP HA . 23 . HA 1 1 118 1 1 1 1 23 ASP H . 23 . HN 1 1 118 1 2 1 1 25 GLY H . 25 . HN 1 1 119 1 1 1 1 23 ASP HA . 23 . HA 1 1 119 1 2 1 1 24 VAL H . 24 . HN 1 1 120 1 1 1 1 23 ASP HA . 23 . HA 1 1 120 1 2 1 1 26 SER H . 26 . HN 1 1 121 1 1 1 1 23 ASP HA . 23 . HA 1 1 121 1 2 1 1 26 SER QB . 26 . HB* 1 1 122 1 1 1 1 23 ASP HB2 . 23 . HB2 1 1 122 1 2 1 1 24 VAL H . 24 . HN 1 1 123 1 1 1 1 23 ASP HB3 . 23 . HB1 1 1 123 1 2 1 1 24 VAL H . 24 . HN 1 1 124 1 1 1 1 24 VAL H . 24 . HN 1 1 124 1 2 1 1 25 GLY H . 25 . HN 1 1 125 1 1 1 1 24 VAL HA . 24 . HA 1 1 125 1 2 1 1 25 GLY H . 25 . HN 1 1 126 1 1 1 1 24 VAL HA . 24 . HA 1 1 126 1 2 1 1 27 ASN H . 27 . HN 1 1 127 1 1 1 1 24 VAL HA . 24 . HA 1 1 127 1 2 1 1 27 ASN HB2 . 27 . HB2 1 1 128 1 1 1 1 24 VAL HA . 24 . HA 1 1 128 1 2 1 1 27 ASN HB3 . 27 . HB1 1 1 129 1 1 1 1 24 VAL HB . 24 . HB 1 1 129 1 2 1 1 25 GLY H . 25 . HN 1 1 130 1 1 1 1 24 VAL MG1 . 24 . HG1* 1 1 130 1 2 1 1 25 GLY H . 25 . HN 1 1 131 1 1 1 1 24 VAL MG2 . 24 . HG2* 1 1 131 1 2 1 1 25 GLY H . 25 . HN 1 1 132 1 1 1 1 25 GLY H . 25 . HN 1 1 132 1 2 1 1 26 SER H . 26 . HN 1 1 133 1 1 1 1 25 GLY QA . 25 . HA* 1 1 133 1 2 1 1 26 SER H . 26 . HN 1 1 134 1 1 1 1 25 GLY QA . 25 . HA* 1 1 134 1 2 1 1 28 LYS QB . 28 . HB* 1 1 135 1 1 1 1 26 SER H . 26 . HN 1 1 135 1 2 1 1 26 SER HA . 26 . HA 1 1 136 1 1 1 1 26 SER HA . 26 . HA 1 1 136 1 2 1 1 27 ASN H . 27 . HN 1 1 137 1 1 1 1 26 SER QB . 26 . HB* 1 1 137 1 2 1 1 27 ASN QD . 27 . HD2* 1 1 138 1 1 1 1 27 ASN H . 27 . HN 1 1 138 1 2 1 1 27 ASN HA . 27 . HA 1 1 139 1 1 1 1 27 ASN H . 27 . HN 1 1 139 1 2 1 1 27 ASN QD . 27 . HD2* 1 1 140 1 1 1 1 27 ASN HA . 27 . HA 1 1 140 1 2 1 1 28 LYS H . 28 . HN 1 1 141 1 1 1 1 27 ASN HA . 27 . HA 1 1 141 1 2 1 1 30 ALA MB . 30 . HB* 1 1 142 1 1 1 1 28 LYS H . 28 . HN 1 1 142 1 2 1 1 28 LYS HA . 28 . HA 1 1 143 1 1 1 1 28 LYS H . 28 . HN 1 1 143 1 2 1 1 29 GLY H . 29 . HN 1 1 144 1 1 1 1 28 LYS HA . 28 . HA 1 1 144 1 2 1 1 31 ILE MD . 31 . HD* 1 1 145 1 1 1 1 28 LYS HA . 28 . HA 1 1 145 1 2 1 1 31 ILE HG13 . 31 . HG11 1 1 146 1 1 1 1 28 LYS HA . 28 . HA 1 1 146 1 2 1 1 31 ILE MG . 31 . HG2* 1 1 147 1 1 1 1 28 LYS QB . 28 . HB* 1 1 147 1 2 1 1 29 GLY H . 29 . HN 1 1 148 1 1 1 1 29 GLY H . 29 . HN 1 1 148 1 2 1 1 30 ALA H . 30 . HN 1 1 149 1 1 1 1 29 GLY QA . 29 . HA* 1 1 149 1 2 1 1 30 ALA H . 30 . HN 1 1 150 1 1 1 1 29 GLY QA . 29 . HA* 1 1 150 1 2 1 1 32 ILE HB . 32 . HB 1 1 151 1 1 1 1 31 ILE H . 31 . HN 1 1 151 1 2 1 1 31 ILE HA . 31 . HA 1 1 152 1 1 1 1 31 ILE HA . 31 . HA 1 1 152 1 2 1 1 34 LEU H . 34 . HN 1 1 153 1 1 1 1 31 ILE HA . 31 . HA 1 1 153 1 2 1 1 34 LEU QB . 34 . HB* 1 1 154 1 1 1 1 31 ILE HB . 31 . HB 1 1 154 1 2 1 1 32 ILE H . 32 . HN 1 1 155 1 1 1 1 32 ILE HA . 32 . HA 1 1 155 1 2 1 1 33 GLY H . 33 . HN 1 1 156 1 1 1 1 32 ILE HA . 32 . HA 1 1 156 1 2 1 1 35 MET H . 35 . HN 1 1 157 1 1 1 1 32 ILE HA . 32 . HA 1 1 157 1 2 1 1 35 MET QB . 35 . HB* 1 1 158 1 1 1 1 32 ILE HA . 32 . HA 1 1 158 1 2 1 1 35 MET QG . 35 . HG* 1 1 159 1 1 1 1 32 ILE HB . 32 . HB 1 1 159 1 2 1 1 33 GLY H . 33 . HN 1 1 160 1 1 1 1 32 ILE HG13 . 32 . HG11 1 1 160 1 2 1 1 33 GLY H . 33 . HN 1 1 161 1 1 1 1 33 GLY H . 33 . HN 1 1 161 1 2 1 1 34 LEU H . 34 . HN 1 1 162 1 1 1 1 33 GLY QA . 33 . HA* 1 1 162 1 2 1 1 34 LEU H . 34 . HN 1 1 163 1 1 1 1 33 GLY QA . 33 . HA* 1 1 163 1 2 1 1 36 VAL HB . 36 . HB 1 1 164 1 1 1 1 33 GLY QA . 33 . HA* 1 1 164 1 2 1 1 36 VAL MG2 . 36 . HG2* 1 1 165 1 1 1 1 34 LEU H . 34 . HN 1 1 165 1 2 1 1 34 LEU HA . 34 . HA 1 1 166 1 1 1 1 34 LEU H . 34 . HN 1 1 166 1 2 1 1 35 MET H . 35 . HN 1 1 167 1 1 1 1 34 LEU HA . 34 . HA 1 1 167 1 2 1 1 37 GLY H . 37 . HN 1 1 168 1 1 1 1 34 LEU QB . 34 . HB* 1 1 168 1 2 1 1 35 MET H . 35 . HN 1 1 169 1 1 1 1 35 MET H . 35 . HN 1 1 169 1 2 1 1 36 VAL H . 36 . HN 1 1 170 1 1 1 1 35 MET HA . 35 . HA 1 1 170 1 2 1 1 36 VAL H . 36 . HN 1 1 171 1 1 1 1 35 MET QG . 35 . HG* 1 1 171 1 2 1 1 36 VAL H . 36 . HN 1 1 172 1 1 1 1 36 VAL H . 36 . HN 1 1 172 1 2 1 1 37 GLY H . 37 . HN 1 1 173 1 1 1 1 38 GLY H . 38 . HN 1 1 173 1 2 1 1 39 VAL H . 39 . HN 1 1 174 1 1 1 1 38 GLY H . 38 . HN 1 1 174 1 2 1 1 40 VAL H . 40 . HN 1 1 175 1 1 1 1 39 VAL H . 39 . HN 1 1 175 1 2 1 1 39 VAL HA . 39 . HA 1 1 176 1 1 1 1 39 VAL H . 39 . HN 1 1 176 1 2 1 1 40 VAL H . 40 . HN 1 1 177 1 1 1 1 39 VAL HA . 39 . HA 1 1 177 1 2 1 1 40 VAL H . 40 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 0.0 0.0 2.8 1 1 2 1 . . . . . 0.0 0.0 4.4 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 4.2 1 1 6 1 . . . . . 0.0 0.0 7.2 1 1 7 1 . . . . . 0.0 0.0 3.4 1 1 8 1 . . . . . 0.0 0.0 5.4 1 1 9 1 . . . . . 0.0 0.0 3.4 1 1 10 1 . . . . . 0.0 0.0 2.8 1 1 11 1 . . . . . 0.0 0.0 4.4 1 1 12 1 . . . . . 0.0 0.0 3.4 1 1 13 1 . . . . . 0.0 0.0 2.8 1 1 14 1 . . . . . 0.0 0.0 5.2 1 1 15 1 . . . . . 0.0 0.0 2.8 1 1 16 1 . . . . . 0.0 0.0 3.4 1 1 17 1 . . . . . 0.0 0.0 2.8 1 1 18 1 . . . . . 0.0 0.0 2.8 1 1 19 1 . . . . . 0.0 0.0 2.8 1 1 20 1 . . . . . 0.0 0.0 4.2 1 1 21 1 . . . . . 0.0 0.0 5.0 1 1 22 1 . . . . . 0.0 0.0 2.8 1 1 23 1 . . . . . 0.0 0.0 2.8 1 1 24 1 . . . . . 0.0 0.0 2.8 1 1 25 1 . . . . . 0.0 0.0 4.4 1 1 26 1 . . . . . 0.0 0.0 4.8 1 1 27 1 . . . . . 0.0 0.0 7.0 1 1 28 1 . . . . . 0.0 0.0 6.2 1 1 29 1 . . . . . 0.0 0.0 7.2 1 1 30 1 . . . . . 0.0 0.0 5.4 1 1 31 1 . . . . . 0.0 0.0 7.2 1 1 32 1 . . . . . 0.0 0.0 8.0 1 1 33 1 . . . . . 0.0 0.0 4.2 1 1 34 1 . . . . . 0.0 0.0 2.8 1 1 35 1 . . . . . 0.0 0.0 5.2 1 1 36 1 . . . . . 0.0 0.0 3.4 1 1 37 1 . . . . . 0.0 0.0 4.2 1 1 38 1 . . . . . 0.0 0.0 5.8 1 1 39 1 . . . . . 0.0 0.0 4.2 1 1 40 1 . . . . . 0.0 0.0 5.8 1 1 41 1 . . . . . 0.0 0.0 3.4 1 1 42 1 . . . . . 0.0 0.0 3.4 1 1 43 1 . . . . . 0.0 0.0 3.4 1 1 44 1 . . . . . 0.0 0.0 5.2 1 1 45 1 . . . . . 0.0 0.0 6.2 1 1 46 1 . . . . . 0.0 0.0 6.0 1 1 47 1 . . . . . 0.0 0.0 4.2 1 1 48 1 . . . . . 0.0 0.0 4.2 1 1 49 1 . . . . . 0.0 0.0 2.8 1 1 50 1 . . . . . 0.0 0.0 5.2 1 1 51 1 . . . . . 0.0 0.0 6.0 1 1 52 1 . . . . . 0.0 0.0 3.4 1 1 53 1 . . . . . 0.0 0.0 3.4 1 1 54 1 . . . . . 0.0 0.0 4.2 1 1 55 1 . . . . . 0.0 0.0 5.3 1 1 56 1 . . . . . 0.0 0.0 8.0 1 1 57 1 . . . . . 0.0 0.0 7.2 1 1 58 1 . . . . . 0.0 0.0 7.2 1 1 59 1 . . . . . 0.0 0.0 7.2 1 1 60 1 . . . . . 0.0 0.0 3.4 1 1 61 1 . . . . . 0.0 0.0 3.4 1 1 62 1 . . . . . 0.0 0.0 4.4 1 1 63 1 . . . . . 0.0 0.0 5.4 1 1 64 1 . . . . . 0.0 0.0 5.2 1 1 65 1 . . . . . 0.0 0.0 7.2 1 1 66 1 . . . . . 0.0 0.0 3.4 1 1 67 1 . . . . . 0.0 0.0 4.2 1 1 68 1 . . . . . 0.0 0.0 3.4 1 1 69 1 . . . . . 0.0 0.0 3.8 1 1 70 1 . . . . . 0.0 0.0 5.4 1 1 71 1 . . . . . 0.0 0.0 4.2 1 1 72 1 . . . . . 0.0 0.0 5.2 1 1 73 1 . . . . . 0.0 0.0 6.4 1 1 74 1 . . . . . 0.0 0.0 3.4 1 1 75 1 . . . . . 0.0 0.0 4.2 1 1 76 1 . . . . . 0.0 0.0 4.2 1 1 77 1 . . . . . 0.0 0.0 4.2 1 1 78 1 . . . . . 0.0 0.0 3.6 1 1 79 1 . . . . . 0.0 0.0 5.0 1 1 80 1 . . . . . 0.0 0.0 6.4 1 1 81 1 . . . . . 0.0 0.0 7.2 1 1 82 1 . . . . . 0.0 0.0 5.4 1 1 83 1 . . . . . 0.0 0.0 3.4 1 1 84 1 . . . . . 0.0 0.0 4.2 1 1 85 1 . . . . . 0.0 0.0 6.2 1 1 86 1 . . . . . 0.0 0.0 3.4 1 1 87 1 . . . . . 0.0 0.0 4.4 1 1 88 1 . . . . . 0.0 0.0 5.2 1 1 89 1 . . . . . 0.0 0.0 4.4 1 1 90 1 . . . . . 0.0 0.0 5.4 1 1 91 1 . . . . . 0.0 0.0 6.2 1 1 92 1 . . . . . 0.0 0.0 6.2 1 1 93 1 . . . . . 0.0 0.0 4.2 1 1 94 1 . . . . . 0.0 0.0 3.4 1 1 95 1 . . . . . 0.0 0.0 3.4 1 1 96 1 . . . . . 0.0 0.0 3.8 1 1 97 1 . . . . . 0.0 0.0 5.4 1 1 98 1 . . . . . 0.0 0.0 6.4 1 1 99 1 . . . . . 0.0 0.0 6.2 1 1 100 1 . . . . . 0.0 0.0 6.2 1 1 101 1 . . . . . 0.0 0.0 6.2 1 1 102 1 . . . . . 0.0 0.0 6.4 1 1 103 1 . . . . . 0.0 0.0 5.8 1 1 104 1 . . . . . 0.0 0.0 8.0 1 1 105 1 . . . . . 0.0 0.0 6.4 1 1 106 1 . . . . . 0.0 0.0 2.8 1 1 107 1 . . . . . 0.0 0.0 3.4 1 1 108 1 . . . . . 0.0 0.0 2.8 1 1 109 1 . . . . . 0.0 0.0 4.2 1 1 110 1 . . . . . 0.0 0.0 3.6 1 1 111 1 . . . . . 0.0 0.0 3.6 1 1 112 1 . . . . . 0.0 0.0 2.8 1 1 113 1 . . . . . 0.0 0.0 4.2 1 1 114 1 . . . . . 0.0 0.0 3.4 1 1 115 1 . . . . . 0.0 0.0 4.4 1 1 116 1 . . . . . 0.0 0.0 5.2 1 1 117 1 . . . . . 0.0 0.0 2.8 1 1 118 1 . . . . . 0.0 0.0 4.2 1 1 119 1 . . . . . 0.0 0.0 3.4 1 1 120 1 . . . . . 0.0 0.0 4.2 1 1 121 1 . . . . . 0.0 0.0 5.2 1 1 122 1 . . . . . 0.0 0.0 4.2 1 1 123 1 . . . . . 0.0 0.0 3.4 1 1 124 1 . . . . . 0.0 0.0 2.8 1 1 125 1 . . . . . 0.0 0.0 3.4 1 1 126 1 . . . . . 0.0 0.0 4.2 1 1 127 1 . . . . . 0.0 0.0 4.2 1 1 128 1 . . . . . 0.0 0.0 4.2 1 1 129 1 . . . . . 0.0 0.0 2.8 1 1 130 1 . . . . . 0.0 0.0 4.2 1 1 131 1 . . . . . 0.0 0.0 4.2 1 1 132 1 . . . . . 0.0 0.0 2.8 1 1 133 1 . . . . . 0.0 0.0 4.4 1 1 134 1 . . . . . 0.0 0.0 7.0 1 1 135 1 . . . . . 0.0 0.0 2.8 1 1 136 1 . . . . . 0.0 0.0 3.4 1 1 137 1 . . . . . 0.0 0.0 7.2 1 1 138 1 . . . . . 0.0 0.0 2.8 1 1 139 1 . . . . . 0.0 0.0 5.2 1 1 140 1 . . . . . 0.0 0.0 3.4 1 1 141 1 . . . . . 0.0 0.0 4.2 1 1 142 1 . . . . . 0.0 0.0 2.8 1 1 143 1 . . . . . 0.0 0.0 3.4 1 1 144 1 . . . . . 0.0 0.0 4.2 1 1 145 1 . . . . . 0.0 0.0 4.2 1 1 146 1 . . . . . 0.0 0.0 3.6 1 1 147 1 . . . . . 0.0 0.0 4.4 1 1 148 1 . . . . . 0.0 0.0 2.8 1 1 149 1 . . . . . 0.0 0.0 3.8 1 1 150 1 . . . . . 0.0 0.0 4.4 1 1 151 1 . . . . . 0.0 0.0 2.8 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 3.4 1 1 156 1 . . . . . 0.0 0.0 3.4 1 1 157 1 . . . . . 0.0 0.0 4.4 1 1 158 1 . . . . . 0.0 0.0 5.2 1 1 159 1 . . . . . 0.0 0.0 2.8 1 1 160 1 . . . . . 0.0 0.0 4.2 1 1 161 1 . . . . . 0.0 0.0 2.8 1 1 162 1 . . . . . 0.0 0.0 3.8 1 1 163 1 . . . . . 0.0 0.0 3.4 1 1 164 1 . . . . . 0.0 0.0 5.4 1 1 165 1 . . . . . 0.0 0.0 2.8 1 1 166 1 . . . . . 0.0 0.0 2.8 1 1 167 1 . . . . . 0.0 0.0 3.4 1 1 168 1 . . . . . 0.0 0.0 4.4 1 1 169 1 . . . . . 0.0 0.0 2.8 1 1 170 1 . . . . . 0.0 0.0 3.4 1 1 171 1 . . . . . 0.0 0.0 5.2 1 1 172 1 . . . . . 0.0 0.0 2.8 1 1 173 1 . . . . . 0.0 0.0 2.8 1 1 174 1 . . . . . 0.0 0.0 4.2 1 1 175 1 . . . . . 0.0 0.0 2.8 1 1 176 1 . . . . . 0.0 0.0 2.8 1 1 177 1 . . . . . 0.0 0.0 2.8 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 1.242 -7.918 -10.889 1.00 . A A . 1 ASP C 1 1 1 2 1 1 1 ASP CA C 2.139 -6.771 -10.393 1.00 . A A . 1 ASP CA 1 1 1 3 1 1 1 ASP CB C 3.247 -7.330 -9.463 1.00 . A A . 1 ASP CB 1 1 1 4 1 1 1 ASP CG C 2.613 -8.161 -8.330 1.00 . A A . 1 ASP CG 1 1 1 5 1 1 1 ASP H1 H 0.330 -6.074 -9.623 1.00 . A A . 1 ASP H1 1 1 1 6 1 1 1 ASP H2 H 1.680 -5.696 -8.668 1.00 . A A . 1 ASP H2 1 1 1 7 1 1 1 ASP H3 H 1.396 -4.845 -10.111 1.00 . A A . 1 ASP H3 1 1 1 8 1 1 1 ASP HA H 2.584 -6.283 -11.248 1.00 . A A . 1 ASP HA 1 1 1 9 1 1 1 ASP HB2 H 3.930 -7.950 -10.025 1.00 . A A . 1 ASP HB2 1 1 1 10 1 1 1 ASP HB3 H 3.808 -6.514 -9.029 1.00 . A A . 1 ASP HB3 1 1 1 11 1 1 1 ASP N N 1.324 -5.770 -9.642 1.00 . A A . 1 ASP N 1 1 1 12 1 1 1 ASP O O 0.032 -7.850 -10.787 1.00 . A A . 1 ASP O 1 1 1 13 1 1 1 ASP OD1 O 2.229 -7.540 -7.352 1.00 . A A . 1 ASP OD1 1 1 1 14 1 1 1 ASP OD2 O 2.546 -9.367 -8.508 1.00 . A A . 1 ASP OD2 1 1 1 15 1 1 2 ALA C C 0.841 -11.023 -10.735 1.00 . A A . 2 ALA C 1 1 1 16 1 1 2 ALA CA C 1.108 -10.116 -11.931 1.00 . A A . 2 ALA CA 1 1 1 17 1 1 2 ALA CB C 1.938 -10.883 -12.978 1.00 . A A . 2 ALA CB 1 1 1 18 1 1 2 ALA H H 2.847 -8.934 -11.476 1.00 . A A . 2 ALA H 1 1 1 19 1 1 2 ALA HA H 0.171 -9.788 -12.359 1.00 . A A . 2 ALA HA 1 1 1 20 1 1 2 ALA HB1 H 2.989 -10.827 -12.742 1.00 . A A . 2 ALA HB1 1 1 1 21 1 1 2 ALA HB2 H 1.647 -11.925 -12.987 1.00 . A A . 2 ALA HB2 1 1 1 22 1 1 2 ALA HB3 H 1.771 -10.474 -13.962 1.00 . A A . 2 ALA HB3 1 1 1 23 1 1 2 ALA N N 1.870 -8.940 -11.418 1.00 . A A . 2 ALA N 1 1 1 24 1 1 2 ALA O O 1.727 -11.721 -10.278 1.00 . A A . 2 ALA O 1 1 1 25 1 1 3 GLU C C -0.620 -13.317 -9.489 1.00 . A A . 3 GLU C 1 1 1 26 1 1 3 GLU CA C -0.754 -11.835 -9.091 1.00 . A A . 3 GLU CA 1 1 1 27 1 1 3 GLU CB C -2.207 -11.485 -8.693 1.00 . A A . 3 GLU CB 1 1 1 28 1 1 3 GLU CD C -1.576 -9.042 -8.346 1.00 . A A . 3 GLU CD 1 1 1 29 1 1 3 GLU CG C -2.209 -10.293 -7.700 1.00 . A A . 3 GLU CG 1 1 1 30 1 1 3 GLU H H -1.041 -10.392 -10.670 1.00 . A A . 3 GLU H 1 1 1 31 1 1 3 GLU HA H -0.071 -11.636 -8.278 1.00 . A A . 3 GLU HA 1 1 1 32 1 1 3 GLU HB2 H -2.779 -11.224 -9.572 1.00 . A A . 3 GLU HB2 1 1 1 33 1 1 3 GLU HB3 H -2.677 -12.337 -8.224 1.00 . A A . 3 GLU HB3 1 1 1 34 1 1 3 GLU HG2 H -3.225 -10.065 -7.412 1.00 . A A . 3 GLU HG2 1 1 1 35 1 1 3 GLU HG3 H -1.654 -10.553 -6.809 1.00 . A A . 3 GLU HG3 1 1 1 36 1 1 3 GLU N N -0.376 -10.983 -10.259 1.00 . A A . 3 GLU N 1 1 1 37 1 1 3 GLU O O -0.517 -14.183 -8.642 1.00 . A A . 3 GLU O 1 1 1 38 1 1 3 GLU OE1 O -2.321 -8.326 -8.995 1.00 . A A . 3 GLU OE1 1 1 1 39 1 1 3 GLU OE2 O -0.383 -8.871 -8.156 1.00 . A A . 3 GLU OE2 1 1 1 40 1 1 4 PHE C C -0.640 -14.710 -12.912 1.00 . A A . 4 PHE C 1 1 1 41 1 1 4 PHE CA C -0.505 -14.890 -11.393 1.00 . A A . 4 PHE CA 1 1 1 42 1 1 4 PHE CB C -1.633 -15.823 -10.881 1.00 . A A . 4 PHE CB 1 1 1 43 1 1 4 PHE CD1 C -0.666 -18.128 -11.264 1.00 . A A . 4 PHE CD1 1 1 1 44 1 1 4 PHE CD2 C -2.371 -17.373 -12.749 1.00 . A A . 4 PHE CD2 1 1 1 45 1 1 4 PHE CE1 C -0.590 -19.319 -11.957 1.00 . A A . 4 PHE CE1 1 1 1 46 1 1 4 PHE CE2 C -2.297 -18.562 -13.443 1.00 . A A . 4 PHE CE2 1 1 1 47 1 1 4 PHE CG C -1.556 -17.148 -11.655 1.00 . A A . 4 PHE CG 1 1 1 48 1 1 4 PHE CZ C -1.405 -19.537 -13.047 1.00 . A A . 4 PHE CZ 1 1 1 49 1 1 4 PHE H H -0.714 -12.770 -11.387 1.00 . A A . 4 PHE H 1 1 1 50 1 1 4 PHE HA H 0.471 -15.296 -11.165 1.00 . A A . 4 PHE HA 1 1 1 51 1 1 4 PHE HB2 H -1.512 -16.033 -9.829 1.00 . A A . 4 PHE HB2 1 1 1 52 1 1 4 PHE HB3 H -2.603 -15.374 -11.040 1.00 . A A . 4 PHE HB3 1 1 1 53 1 1 4 PHE HD1 H -0.022 -17.958 -10.413 1.00 . A A . 4 PHE HD1 1 1 1 54 1 1 4 PHE HD2 H -3.069 -16.611 -13.065 1.00 . A A . 4 PHE HD2 1 1 1 55 1 1 4 PHE HE1 H 0.108 -20.081 -11.645 1.00 . A A . 4 PHE HE1 1 1 1 56 1 1 4 PHE HE2 H -2.935 -18.731 -14.297 1.00 . A A . 4 PHE HE2 1 1 1 57 1 1 4 PHE HZ H -1.346 -20.469 -13.589 1.00 . A A . 4 PHE HZ 1 1 1 58 1 1 4 PHE N N -0.625 -13.535 -10.782 1.00 . A A . 4 PHE N 1 1 1 59 1 1 4 PHE O O -1.733 -14.507 -13.401 1.00 . A A . 4 PHE O 1 1 1 60 1 1 5 ARG C C -0.493 -13.484 -15.567 1.00 . A A . 5 ARG C 1 1 1 61 1 1 5 ARG CA C 0.451 -14.621 -15.110 1.00 . A A . 5 ARG CA 1 1 1 62 1 1 5 ARG CB C 0.022 -15.986 -15.727 1.00 . A A . 5 ARG CB 1 1 1 63 1 1 5 ARG CD C -1.046 -16.281 -18.015 1.00 . A A . 5 ARG CD 1 1 1 64 1 1 5 ARG CG C 0.272 -16.001 -17.263 1.00 . A A . 5 ARG CG 1 1 1 65 1 1 5 ARG CZ C -1.785 -16.124 -20.345 1.00 . A A . 5 ARG CZ 1 1 1 66 1 1 5 ARG H H 1.309 -14.938 -13.152 1.00 . A A . 5 ARG H 1 1 1 67 1 1 5 ARG HA H 1.454 -14.380 -15.430 1.00 . A A . 5 ARG HA 1 1 1 68 1 1 5 ARG HB2 H 0.602 -16.776 -15.271 1.00 . A A . 5 ARG HB2 1 1 1 69 1 1 5 ARG HB3 H -1.020 -16.171 -15.504 1.00 . A A . 5 ARG HB3 1 1 1 70 1 1 5 ARG HD2 H -1.316 -17.324 -17.921 1.00 . A A . 5 ARG HD2 1 1 1 71 1 1 5 ARG HD3 H -1.854 -15.669 -17.642 1.00 . A A . 5 ARG HD3 1 1 1 72 1 1 5 ARG HE H 0.041 -15.630 -19.753 1.00 . A A . 5 ARG HE 1 1 1 73 1 1 5 ARG HG2 H 0.685 -15.060 -17.598 1.00 . A A . 5 ARG HG2 1 1 1 74 1 1 5 ARG HG3 H 0.978 -16.784 -17.496 1.00 . A A . 5 ARG HG3 1 1 1 75 1 1 5 ARG HH11 H -3.139 -16.791 -19.024 1.00 . A A . 5 ARG HH11 1 1 1 76 1 1 5 ARG HH12 H -3.679 -16.686 -20.666 1.00 . A A . 5 ARG HH12 1 1 1 77 1 1 5 ARG HH21 H -0.620 -15.484 -21.840 1.00 . A A . 5 ARG HH21 1 1 1 78 1 1 5 ARG HH22 H -2.230 -15.937 -22.288 1.00 . A A . 5 ARG HH22 1 1 1 79 1 1 5 ARG N N 0.462 -14.780 -13.616 1.00 . A A . 5 ARG N 1 1 1 80 1 1 5 ARG NE N -0.831 -15.965 -19.460 1.00 . A A . 5 ARG NE 1 1 1 81 1 1 5 ARG NH1 N -2.959 -16.568 -19.983 1.00 . A A . 5 ARG NH1 1 1 1 82 1 1 5 ARG NH2 N -1.524 -15.826 -21.587 1.00 . A A . 5 ARG NH2 1 1 1 83 1 1 5 ARG O O -1.450 -13.711 -16.283 1.00 . A A . 5 ARG O 1 1 1 84 1 1 6 HIS C C -2.496 -11.247 -15.475 1.00 . A A . 6 HIS C 1 1 1 85 1 1 6 HIS CA C -0.962 -11.051 -15.441 1.00 . A A . 6 HIS CA 1 1 1 86 1 1 6 HIS CB C -0.450 -10.505 -16.814 1.00 . A A . 6 HIS CB 1 1 1 87 1 1 6 HIS CD2 C 0.288 -12.352 -18.570 1.00 . A A . 6 HIS CD2 1 1 1 88 1 1 6 HIS CE1 C -1.579 -12.774 -19.367 1.00 . A A . 6 HIS CE1 1 1 1 89 1 1 6 HIS CG C -0.636 -11.547 -17.925 1.00 . A A . 6 HIS CG 1 1 1 90 1 1 6 HIS H H 0.611 -12.211 -14.541 1.00 . A A . 6 HIS H 1 1 1 91 1 1 6 HIS HA H -0.748 -10.324 -14.672 1.00 . A A . 6 HIS HA 1 1 1 92 1 1 6 HIS HB2 H -0.987 -9.609 -17.087 1.00 . A A . 6 HIS HB2 1 1 1 93 1 1 6 HIS HB3 H 0.599 -10.264 -16.740 1.00 . A A . 6 HIS HB3 1 1 1 94 1 1 6 HIS HD1 H -2.632 -11.469 -18.234 1.00 . A A . 6 HIS HD1 1 1 1 95 1 1 6 HIS HD2 H 1.349 -12.360 -18.370 1.00 . A A . 6 HIS HD2 1 1 1 96 1 1 6 HIS HE1 H -2.368 -13.205 -19.964 1.00 . A A . 6 HIS HE1 1 1 1 97 1 1 6 HIS N N -0.177 -12.293 -15.117 1.00 . A A . 6 HIS N 1 1 1 98 1 1 6 HIS ND1 N -1.766 -11.861 -18.468 1.00 . A A . 6 HIS ND1 1 1 1 99 1 1 6 HIS NE2 N -0.316 -13.109 -19.465 1.00 . A A . 6 HIS NE2 1 1 1 100 1 1 6 HIS O O -3.194 -10.637 -16.264 1.00 . A A . 6 HIS O 1 1 1 101 1 1 7 ASP C C -5.272 -11.163 -14.200 1.00 . A A . 7 ASP C 1 1 1 102 1 1 7 ASP CA C -4.428 -12.407 -14.505 1.00 . A A . 7 ASP CA 1 1 1 103 1 1 7 ASP CB C -4.636 -13.444 -13.393 1.00 . A A . 7 ASP CB 1 1 1 104 1 1 7 ASP CG C -4.264 -12.825 -12.025 1.00 . A A . 7 ASP CG 1 1 1 105 1 1 7 ASP H H -2.366 -12.566 -13.993 1.00 . A A . 7 ASP H 1 1 1 106 1 1 7 ASP HA H -4.752 -12.823 -15.448 1.00 . A A . 7 ASP HA 1 1 1 107 1 1 7 ASP HB2 H -5.669 -13.744 -13.380 1.00 . A A . 7 ASP HB2 1 1 1 108 1 1 7 ASP HB3 H -4.035 -14.321 -13.570 1.00 . A A . 7 ASP HB3 1 1 1 109 1 1 7 ASP N N -2.970 -12.101 -14.604 1.00 . A A . 7 ASP N 1 1 1 110 1 1 7 ASP O O -4.786 -10.203 -13.632 1.00 . A A . 7 ASP O 1 1 1 111 1 1 7 ASP OD1 O -3.076 -12.689 -11.783 1.00 . A A . 7 ASP OD1 1 1 1 112 1 1 7 ASP OD2 O -5.194 -12.520 -11.297 1.00 . A A . 7 ASP OD2 1 1 1 113 1 1 8 SER C C -7.833 -10.058 -12.873 1.00 . A A . 8 SER C 1 1 1 114 1 1 8 SER CA C -7.466 -10.107 -14.366 1.00 . A A . 8 SER CA 1 1 1 115 1 1 8 SER CB C -8.726 -10.333 -15.222 1.00 . A A . 8 SER CB 1 1 1 116 1 1 8 SER H H -6.837 -12.041 -15.048 1.00 . A A . 8 SER H 1 1 1 117 1 1 8 SER HA H -6.983 -9.185 -14.651 1.00 . A A . 8 SER HA 1 1 1 118 1 1 8 SER HB2 H -9.499 -9.613 -14.994 1.00 . A A . 8 SER HB2 1 1 1 119 1 1 8 SER HB3 H -8.495 -10.308 -16.277 1.00 . A A . 8 SER HB3 1 1 1 120 1 1 8 SER HG H -9.152 -12.184 -15.656 1.00 . A A . 8 SER HG 1 1 1 121 1 1 8 SER N N -6.517 -11.235 -14.595 1.00 . A A . 8 SER N 1 1 1 122 1 1 8 SER O O -7.717 -11.054 -12.182 1.00 . A A . 8 SER O 1 1 1 123 1 1 8 SER OG O -9.174 -11.635 -14.868 1.00 . A A . 8 SER OG 1 1 1 124 1 1 9 GLY C C -8.455 -7.313 -10.538 1.00 . A A . 9 GLY C 1 1 1 125 1 1 9 GLY CA C -8.644 -8.759 -10.986 1.00 . A A . 9 GLY CA 1 1 1 126 1 1 9 GLY H H -8.343 -8.136 -13.020 1.00 . A A . 9 GLY H 1 1 1 127 1 1 9 GLY HA2 H -9.679 -9.042 -10.863 1.00 . A A . 9 GLY HA2 1 1 1 128 1 1 9 GLY HA3 H -8.022 -9.398 -10.374 1.00 . A A . 9 GLY HA3 1 1 1 129 1 1 9 GLY N N -8.263 -8.908 -12.420 1.00 . A A . 9 GLY N 1 1 1 130 1 1 9 GLY O O -7.427 -6.967 -9.985 1.00 . A A . 9 GLY O 1 1 1 131 1 1 10 TYR C C -9.131 -4.901 -8.912 1.00 . A A . 10 TYR C 1 1 1 132 1 1 10 TYR CA C -9.436 -5.064 -10.419 1.00 . A A . 10 TYR CA 1 1 1 133 1 1 10 TYR CB C -10.822 -4.441 -10.778 1.00 . A A . 10 TYR CB 1 1 1 134 1 1 10 TYR CD1 C -12.308 -5.720 -9.156 1.00 . A A . 10 TYR CD1 1 1 1 135 1 1 10 TYR CD2 C -12.142 -3.359 -8.898 1.00 . A A . 10 TYR CD2 1 1 1 136 1 1 10 TYR CE1 C -13.162 -5.776 -8.074 1.00 . A A . 10 TYR CE1 1 1 1 137 1 1 10 TYR CE2 C -12.995 -3.416 -7.818 1.00 . A A . 10 TYR CE2 1 1 1 138 1 1 10 TYR CG C -11.790 -4.509 -9.577 1.00 . A A . 10 TYR CG 1 1 1 139 1 1 10 TYR CZ C -13.510 -4.625 -7.399 1.00 . A A . 10 TYR CZ 1 1 1 140 1 1 10 TYR H H -10.246 -6.883 -11.256 1.00 . A A . 10 TYR H 1 1 1 141 1 1 10 TYR HA H -8.656 -4.573 -10.985 1.00 . A A . 10 TYR HA 1 1 1 142 1 1 10 TYR HB2 H -10.691 -3.407 -11.063 1.00 . A A . 10 TYR HB2 1 1 1 143 1 1 10 TYR HB3 H -11.266 -4.971 -11.609 1.00 . A A . 10 TYR HB3 1 1 1 144 1 1 10 TYR HD1 H -12.045 -6.629 -9.676 1.00 . A A . 10 TYR HD1 1 1 1 145 1 1 10 TYR HD2 H -11.747 -2.405 -9.216 1.00 . A A . 10 TYR HD2 1 1 1 146 1 1 10 TYR HE1 H -13.560 -6.729 -7.755 1.00 . A A . 10 TYR HE1 1 1 1 147 1 1 10 TYR HE2 H -13.261 -2.508 -7.297 1.00 . A A . 10 TYR HE2 1 1 1 148 1 1 10 TYR HH H -13.822 -4.717 -5.519 1.00 . A A . 10 TYR HH 1 1 1 149 1 1 10 TYR N N -9.461 -6.516 -10.799 1.00 . A A . 10 TYR N 1 1 1 150 1 1 10 TYR O O -8.630 -3.881 -8.483 1.00 . A A . 10 TYR O 1 1 1 151 1 1 10 TYR OH O -14.359 -4.681 -6.313 1.00 . A A . 10 TYR OH 1 1 1 152 1 1 11 GLU C C -10.226 -5.079 -5.963 1.00 . A A . 11 GLU C 1 1 1 153 1 1 11 GLU CA C -9.272 -6.029 -6.709 1.00 . A A . 11 GLU CA 1 1 1 154 1 1 11 GLU CB C -7.778 -5.701 -6.388 1.00 . A A . 11 GLU CB 1 1 1 155 1 1 11 GLU CD C -6.286 -5.358 -4.394 1.00 . A A . 11 GLU CD 1 1 1 156 1 1 11 GLU CG C -7.402 -6.237 -4.988 1.00 . A A . 11 GLU CG 1 1 1 157 1 1 11 GLU H H -9.868 -6.713 -8.642 1.00 . A A . 11 GLU H 1 1 1 158 1 1 11 GLU HA H -9.492 -7.043 -6.407 1.00 . A A . 11 GLU HA 1 1 1 159 1 1 11 GLU HB2 H -7.147 -6.180 -7.122 1.00 . A A . 11 GLU HB2 1 1 1 160 1 1 11 GLU HB3 H -7.602 -4.638 -6.439 1.00 . A A . 11 GLU HB3 1 1 1 161 1 1 11 GLU HG2 H -8.253 -6.218 -4.322 1.00 . A A . 11 GLU HG2 1 1 1 162 1 1 11 GLU HG3 H -7.053 -7.256 -5.068 1.00 . A A . 11 GLU HG3 1 1 1 163 1 1 11 GLU N N -9.465 -5.944 -8.187 1.00 . A A . 11 GLU N 1 1 1 164 1 1 11 GLU O O -11.231 -5.525 -5.443 1.00 . A A . 11 GLU O 1 1 1 165 1 1 11 GLU OE1 O -6.613 -4.242 -4.024 1.00 . A A . 11 GLU OE1 1 1 1 166 1 1 11 GLU OE2 O -5.170 -5.849 -4.343 1.00 . A A . 11 GLU OE2 1 1 1 167 1 1 12 VAL C C -10.823 -1.493 -6.044 1.00 . A A . 12 VAL C 1 1 1 168 1 1 12 VAL CA C -10.749 -2.798 -5.231 1.00 . A A . 12 VAL CA 1 1 1 169 1 1 12 VAL CB C -10.135 -2.535 -3.832 1.00 . A A . 12 VAL CB 1 1 1 170 1 1 12 VAL CG1 C -10.045 -3.853 -3.038 1.00 . A A . 12 VAL CG1 1 1 1 171 1 1 12 VAL CG2 C -8.721 -1.939 -3.993 1.00 . A A . 12 VAL CG2 1 1 1 172 1 1 12 VAL H H -9.079 -3.508 -6.365 1.00 . A A . 12 VAL H 1 1 1 173 1 1 12 VAL HA H -11.754 -3.180 -5.124 1.00 . A A . 12 VAL HA 1 1 1 174 1 1 12 VAL HB H -10.757 -1.845 -3.281 1.00 . A A . 12 VAL HB 1 1 1 175 1 1 12 VAL HG11 H -10.988 -4.376 -3.076 1.00 . A A . 12 VAL HG11 1 1 1 176 1 1 12 VAL HG12 H -9.276 -4.488 -3.451 1.00 . A A . 12 VAL HG12 1 1 1 177 1 1 12 VAL HG13 H -9.804 -3.642 -2.007 1.00 . A A . 12 VAL HG13 1 1 1 178 1 1 12 VAL HG21 H -8.250 -2.291 -4.898 1.00 . A A . 12 VAL HG21 1 1 1 179 1 1 12 VAL HG22 H -8.790 -0.864 -4.042 1.00 . A A . 12 VAL HG22 1 1 1 180 1 1 12 VAL HG23 H -8.099 -2.216 -3.157 1.00 . A A . 12 VAL HG23 1 1 1 181 1 1 12 VAL N N -9.899 -3.811 -5.929 1.00 . A A . 12 VAL N 1 1 1 182 1 1 12 VAL O O -10.442 -1.449 -7.197 1.00 . A A . 12 VAL O 1 1 1 183 1 1 13 HIS C C -10.105 1.474 -6.401 1.00 . A A . 13 HIS C 1 1 1 184 1 1 13 HIS CA C -11.466 0.879 -6.014 1.00 . A A . 13 HIS CA 1 1 1 185 1 1 13 HIS CB C -12.205 1.800 -5.002 1.00 . A A . 13 HIS CB 1 1 1 186 1 1 13 HIS CD2 C -13.850 3.027 -6.683 1.00 . A A . 13 HIS CD2 1 1 1 187 1 1 13 HIS CE1 C -15.646 2.414 -5.845 1.00 . A A . 13 HIS CE1 1 1 1 188 1 1 13 HIS CG C -13.553 2.229 -5.590 1.00 . A A . 13 HIS CG 1 1 1 189 1 1 13 HIS H H -11.592 -0.606 -4.460 1.00 . A A . 13 HIS H 1 1 1 190 1 1 13 HIS HA H -12.048 0.769 -6.914 1.00 . A A . 13 HIS HA 1 1 1 191 1 1 13 HIS HB2 H -12.388 1.276 -4.075 1.00 . A A . 13 HIS HB2 1 1 1 192 1 1 13 HIS HB3 H -11.634 2.690 -4.783 1.00 . A A . 13 HIS HB3 1 1 1 193 1 1 13 HIS HD1 H -14.853 1.316 -4.339 1.00 . A A . 13 HIS HD1 1 1 1 194 1 1 13 HIS HD2 H -13.119 3.495 -7.325 1.00 . A A . 13 HIS HD2 1 1 1 195 1 1 13 HIS HE1 H -16.701 2.278 -5.662 1.00 . A A . 13 HIS HE1 1 1 1 196 1 1 13 HIS N N -11.316 -0.471 -5.388 1.00 . A A . 13 HIS N 1 1 1 197 1 1 13 HIS ND1 N -14.709 1.887 -5.122 1.00 . A A . 13 HIS ND1 1 1 1 198 1 1 13 HIS NE2 N -15.157 3.131 -6.827 1.00 . A A . 13 HIS NE2 1 1 1 199 1 1 13 HIS O O -9.765 1.500 -7.568 1.00 . A A . 13 HIS O 1 1 1 200 1 1 14 HIS C C -6.959 2.010 -4.721 1.00 . A A . 14 HIS C 1 1 1 201 1 1 14 HIS CA C -8.020 2.537 -5.680 1.00 . A A . 14 HIS CA 1 1 1 202 1 1 14 HIS CB C -8.079 4.093 -5.557 1.00 . A A . 14 HIS CB 1 1 1 203 1 1 14 HIS CD2 C -10.401 4.814 -6.616 1.00 . A A . 14 HIS CD2 1 1 1 204 1 1 14 HIS CE1 C -11.368 5.378 -4.871 1.00 . A A . 14 HIS CE1 1 1 1 205 1 1 14 HIS CG C -9.521 4.620 -5.566 1.00 . A A . 14 HIS CG 1 1 1 206 1 1 14 HIS H H -9.717 1.875 -4.504 1.00 . A A . 14 HIS H 1 1 1 207 1 1 14 HIS HA H -7.704 2.231 -6.657 1.00 . A A . 14 HIS HA 1 1 1 208 1 1 14 HIS HB2 H -7.589 4.427 -4.654 1.00 . A A . 14 HIS HB2 1 1 1 209 1 1 14 HIS HB3 H -7.563 4.533 -6.398 1.00 . A A . 14 HIS HB3 1 1 1 210 1 1 14 HIS HD1 H -9.842 4.974 -3.603 1.00 . A A . 14 HIS HD1 1 1 1 211 1 1 14 HIS HD2 H -10.182 4.608 -7.654 1.00 . A A . 14 HIS HD2 1 1 1 212 1 1 14 HIS HE1 H -12.117 5.735 -4.181 1.00 . A A . 14 HIS HE1 1 1 1 213 1 1 14 HIS N N -9.370 1.932 -5.417 1.00 . A A . 14 HIS N 1 1 1 214 1 1 14 HIS ND1 N -10.185 4.987 -4.521 1.00 . A A . 14 HIS ND1 1 1 1 215 1 1 14 HIS NE2 N -11.546 5.286 -6.166 1.00 . A A . 14 HIS NE2 1 1 1 216 1 1 14 HIS O O -5.790 2.325 -4.834 1.00 . A A . 14 HIS O 1 1 1 217 1 1 15 GLN C C -5.471 -0.263 -3.613 1.00 . A A . 15 GLN C 1 1 1 218 1 1 15 GLN CA C -6.429 0.626 -2.800 1.00 . A A . 15 GLN CA 1 1 1 219 1 1 15 GLN CB C -7.209 -0.206 -1.743 1.00 . A A . 15 GLN CB 1 1 1 220 1 1 15 GLN CD C -5.691 -0.080 0.271 1.00 . A A . 15 GLN CD 1 1 1 221 1 1 15 GLN CG C -7.011 0.411 -0.339 1.00 . A A . 15 GLN CG 1 1 1 222 1 1 15 GLN H H -8.348 1.002 -3.779 1.00 . A A . 15 GLN H 1 1 1 223 1 1 15 GLN HA H -5.858 1.425 -2.347 1.00 . A A . 15 GLN HA 1 1 1 224 1 1 15 GLN HB2 H -8.264 -0.200 -1.970 1.00 . A A . 15 GLN HB2 1 1 1 225 1 1 15 GLN HB3 H -6.865 -1.231 -1.735 1.00 . A A . 15 GLN HB3 1 1 1 226 1 1 15 GLN HE21 H -6.538 -0.636 1.977 1.00 . A A . 15 GLN HE21 1 1 1 227 1 1 15 GLN HE22 H -4.864 -0.899 1.877 1.00 . A A . 15 GLN HE22 1 1 1 228 1 1 15 GLN HG2 H -6.993 1.490 -0.389 1.00 . A A . 15 GLN HG2 1 1 1 229 1 1 15 GLN HG3 H -7.823 0.109 0.306 1.00 . A A . 15 GLN HG3 1 1 1 230 1 1 15 GLN N N -7.393 1.206 -3.792 1.00 . A A . 15 GLN N 1 1 1 231 1 1 15 GLN NE2 N -5.699 -0.580 1.476 1.00 . A A . 15 GLN NE2 1 1 1 232 1 1 15 GLN O O -4.356 -0.523 -3.211 1.00 . A A . 15 GLN O 1 1 1 233 1 1 15 GLN OE1 O -4.641 -0.013 -0.338 1.00 . A A . 15 GLN OE1 1 1 1 234 1 1 16 LYS C C -3.884 -0.768 -6.058 1.00 . A A . 16 LYS C 1 1 1 235 1 1 16 LYS CA C -5.134 -1.561 -5.655 1.00 . A A . 16 LYS CA 1 1 1 236 1 1 16 LYS CB C -6.001 -1.918 -6.890 1.00 . A A . 16 LYS CB 1 1 1 237 1 1 16 LYS CD C -4.572 -3.981 -7.214 1.00 . A A . 16 LYS CD 1 1 1 238 1 1 16 LYS CE C -4.535 -5.202 -8.151 1.00 . A A . 16 LYS CE 1 1 1 239 1 1 16 LYS CG C -5.210 -2.766 -7.919 1.00 . A A . 16 LYS CG 1 1 1 240 1 1 16 LYS H H -6.851 -0.469 -5.032 1.00 . A A . 16 LYS H 1 1 1 241 1 1 16 LYS HA H -4.832 -2.438 -5.111 1.00 . A A . 16 LYS HA 1 1 1 242 1 1 16 LYS HB2 H -6.870 -2.473 -6.570 1.00 . A A . 16 LYS HB2 1 1 1 243 1 1 16 LYS HB3 H -6.341 -1.011 -7.368 1.00 . A A . 16 LYS HB3 1 1 1 244 1 1 16 LYS HD2 H -3.573 -3.720 -6.900 1.00 . A A . 16 LYS HD2 1 1 1 245 1 1 16 LYS HD3 H -5.151 -4.221 -6.338 1.00 . A A . 16 LYS HD3 1 1 1 246 1 1 16 LYS HE2 H -5.483 -5.323 -8.657 1.00 . A A . 16 LYS HE2 1 1 1 247 1 1 16 LYS HE3 H -3.755 -5.084 -8.888 1.00 . A A . 16 LYS HE3 1 1 1 248 1 1 16 LYS HG2 H -5.888 -3.092 -8.695 1.00 . A A . 16 LYS HG2 1 1 1 249 1 1 16 LYS HG3 H -4.439 -2.160 -8.374 1.00 . A A . 16 LYS HG3 1 1 1 250 1 1 16 LYS HZ1 H -4.168 -6.197 -6.354 1.00 . A A . 16 LYS HZ1 1 1 1 251 1 1 16 LYS HZ2 H -5.054 -7.105 -7.480 1.00 . A A . 16 LYS HZ2 1 1 1 252 1 1 16 LYS HZ3 H -3.385 -6.879 -7.698 1.00 . A A . 16 LYS HZ3 1 1 1 253 1 1 16 LYS N N -5.944 -0.702 -4.755 1.00 . A A . 16 LYS N 1 1 1 254 1 1 16 LYS NZ N -4.265 -6.439 -7.361 1.00 . A A . 16 LYS NZ 1 1 1 255 1 1 16 LYS O O -2.789 -1.292 -6.067 1.00 . A A . 16 LYS O 1 1 1 256 1 1 17 LEU C C -2.043 1.543 -5.550 1.00 . A A . 17 LEU C 1 1 1 257 1 1 17 LEU CA C -2.947 1.357 -6.777 1.00 . A A . 17 LEU CA 1 1 1 258 1 1 17 LEU CB C -3.560 2.697 -7.328 1.00 . A A . 17 LEU CB 1 1 1 259 1 1 17 LEU CD1 C -2.019 4.414 -6.225 1.00 . A A . 17 LEU CD1 1 1 1 260 1 1 17 LEU CD2 C -4.392 5.015 -6.872 1.00 . A A . 17 LEU CD2 1 1 1 261 1 1 17 LEU CG C -3.485 3.886 -6.344 1.00 . A A . 17 LEU CG 1 1 1 262 1 1 17 LEU H H -4.986 0.872 -6.324 1.00 . A A . 17 LEU H 1 1 1 263 1 1 17 LEU HA H -2.393 0.860 -7.561 1.00 . A A . 17 LEU HA 1 1 1 264 1 1 17 LEU HB2 H -3.058 2.966 -8.245 1.00 . A A . 17 LEU HB2 1 1 1 265 1 1 17 LEU HB3 H -4.601 2.525 -7.568 1.00 . A A . 17 LEU HB3 1 1 1 266 1 1 17 LEU HD11 H -1.368 3.909 -6.923 1.00 . A A . 17 LEU HD11 1 1 1 267 1 1 17 LEU HD12 H -1.965 5.475 -6.422 1.00 . A A . 17 LEU HD12 1 1 1 268 1 1 17 LEU HD13 H -1.647 4.239 -5.227 1.00 . A A . 17 LEU HD13 1 1 1 269 1 1 17 LEU HD21 H -5.402 4.654 -6.984 1.00 . A A . 17 LEU HD21 1 1 1 270 1 1 17 LEU HD22 H -4.394 5.845 -6.180 1.00 . A A . 17 LEU HD22 1 1 1 271 1 1 17 LEU HD23 H -4.037 5.360 -7.832 1.00 . A A . 17 LEU HD23 1 1 1 272 1 1 17 LEU HG H -3.865 3.550 -5.393 1.00 . A A . 17 LEU HG 1 1 1 273 1 1 17 LEU N N -4.087 0.489 -6.368 1.00 . A A . 17 LEU N 1 1 1 274 1 1 17 LEU O O -0.839 1.464 -5.655 1.00 . A A . 17 LEU O 1 1 1 275 1 1 18 VAL C C -0.890 0.768 -2.992 1.00 . A A . 18 VAL C 1 1 1 276 1 1 18 VAL CA C -1.848 1.976 -3.155 1.00 . A A . 18 VAL CA 1 1 1 277 1 1 18 VAL CB C -2.889 2.107 -2.012 1.00 . A A . 18 VAL CB 1 1 1 278 1 1 18 VAL CG1 C -2.253 1.918 -0.637 1.00 . A A . 18 VAL CG1 1 1 1 279 1 1 18 VAL CG2 C -3.546 3.503 -2.086 1.00 . A A . 18 VAL CG2 1 1 1 280 1 1 18 VAL H H -3.615 1.846 -4.380 1.00 . A A . 18 VAL H 1 1 1 281 1 1 18 VAL HA H -1.261 2.878 -3.247 1.00 . A A . 18 VAL HA 1 1 1 282 1 1 18 VAL HB H -3.659 1.367 -2.136 1.00 . A A . 18 VAL HB 1 1 1 283 1 1 18 VAL HG11 H -1.273 2.371 -0.609 1.00 . A A . 18 VAL HG11 1 1 1 284 1 1 18 VAL HG12 H -2.877 2.363 0.124 1.00 . A A . 18 VAL HG12 1 1 1 285 1 1 18 VAL HG13 H -2.170 0.861 -0.438 1.00 . A A . 18 VAL HG13 1 1 1 286 1 1 18 VAL HG21 H -4.020 3.642 -3.047 1.00 . A A . 18 VAL HG21 1 1 1 287 1 1 18 VAL HG22 H -4.299 3.602 -1.317 1.00 . A A . 18 VAL HG22 1 1 1 288 1 1 18 VAL HG23 H -2.805 4.278 -1.949 1.00 . A A . 18 VAL HG23 1 1 1 289 1 1 18 VAL N N -2.639 1.785 -4.409 1.00 . A A . 18 VAL N 1 1 1 290 1 1 18 VAL O O 0.302 0.931 -2.817 1.00 . A A . 18 VAL O 1 1 1 291 1 1 19 PHE C C 0.466 -1.676 -4.003 1.00 . A A . 19 PHE C 1 1 1 292 1 1 19 PHE CA C -0.627 -1.663 -2.930 1.00 . A A . 19 PHE CA 1 1 1 293 1 1 19 PHE CB C -1.542 -2.895 -3.095 1.00 . A A . 19 PHE CB 1 1 1 294 1 1 19 PHE CD1 C -2.320 -2.673 -0.664 1.00 . A A . 19 PHE CD1 1 1 1 295 1 1 19 PHE CD2 C -3.914 -3.299 -2.318 1.00 . A A . 19 PHE CD2 1 1 1 296 1 1 19 PHE CE1 C -3.301 -2.739 0.303 1.00 . A A . 19 PHE CE1 1 1 1 297 1 1 19 PHE CE2 C -4.894 -3.365 -1.350 1.00 . A A . 19 PHE CE2 1 1 1 298 1 1 19 PHE CG C -2.616 -2.954 -1.989 1.00 . A A . 19 PHE CG 1 1 1 299 1 1 19 PHE CZ C -4.588 -3.084 -0.039 1.00 . A A . 19 PHE CZ 1 1 1 300 1 1 19 PHE H H -2.405 -0.480 -3.205 1.00 . A A . 19 PHE H 1 1 1 301 1 1 19 PHE HA H -0.149 -1.670 -1.968 1.00 . A A . 19 PHE HA 1 1 1 302 1 1 19 PHE HB2 H -2.032 -2.861 -4.058 1.00 . A A . 19 PHE HB2 1 1 1 303 1 1 19 PHE HB3 H -0.951 -3.798 -3.040 1.00 . A A . 19 PHE HB3 1 1 1 304 1 1 19 PHE HD1 H -1.316 -2.401 -0.375 1.00 . A A . 19 PHE HD1 1 1 1 305 1 1 19 PHE HD2 H -4.164 -3.521 -3.343 1.00 . A A . 19 PHE HD2 1 1 1 306 1 1 19 PHE HE1 H -3.059 -2.518 1.332 1.00 . A A . 19 PHE HE1 1 1 1 307 1 1 19 PHE HE2 H -5.903 -3.636 -1.618 1.00 . A A . 19 PHE HE2 1 1 1 308 1 1 19 PHE HZ H -5.355 -3.137 0.720 1.00 . A A . 19 PHE HZ 1 1 1 309 1 1 19 PHE N N -1.443 -0.416 -3.065 1.00 . A A . 19 PHE N 1 1 1 310 1 1 19 PHE O O 1.615 -1.950 -3.718 1.00 . A A . 19 PHE O 1 1 1 311 1 1 20 PHE C C 2.232 -0.445 -5.949 1.00 . A A . 20 PHE C 1 1 1 312 1 1 20 PHE CA C 1.043 -1.340 -6.355 1.00 . A A . 20 PHE CA 1 1 1 313 1 1 20 PHE CB C 0.259 -0.802 -7.600 1.00 . A A . 20 PHE CB 1 1 1 314 1 1 20 PHE CD1 C 2.092 -0.175 -9.221 1.00 . A A . 20 PHE CD1 1 1 1 315 1 1 20 PHE CD2 C 0.725 1.581 -8.375 1.00 . A A . 20 PHE CD2 1 1 1 316 1 1 20 PHE CE1 C 2.806 0.740 -9.963 1.00 . A A . 20 PHE CE1 1 1 1 317 1 1 20 PHE CE2 C 1.437 2.496 -9.115 1.00 . A A . 20 PHE CE2 1 1 1 318 1 1 20 PHE CG C 1.046 0.235 -8.420 1.00 . A A . 20 PHE CG 1 1 1 319 1 1 20 PHE CZ C 2.480 2.078 -9.912 1.00 . A A . 20 PHE CZ 1 1 1 320 1 1 20 PHE H H -0.862 -1.169 -5.385 1.00 . A A . 20 PHE H 1 1 1 321 1 1 20 PHE HA H 1.399 -2.343 -6.539 1.00 . A A . 20 PHE HA 1 1 1 322 1 1 20 PHE HB2 H 0.022 -1.634 -8.248 1.00 . A A . 20 PHE HB2 1 1 1 323 1 1 20 PHE HB3 H -0.673 -0.358 -7.288 1.00 . A A . 20 PHE HB3 1 1 1 324 1 1 20 PHE HD1 H 2.355 -1.221 -9.265 1.00 . A A . 20 PHE HD1 1 1 1 325 1 1 20 PHE HD2 H -0.089 1.931 -7.760 1.00 . A A . 20 PHE HD2 1 1 1 326 1 1 20 PHE HE1 H 3.621 0.401 -10.583 1.00 . A A . 20 PHE HE1 1 1 1 327 1 1 20 PHE HE2 H 1.172 3.542 -9.065 1.00 . A A . 20 PHE HE2 1 1 1 328 1 1 20 PHE HZ H 3.041 2.796 -10.493 1.00 . A A . 20 PHE HZ 1 1 1 329 1 1 20 PHE N N 0.078 -1.373 -5.215 1.00 . A A . 20 PHE N 1 1 1 330 1 1 20 PHE O O 3.369 -0.855 -6.042 1.00 . A A . 20 PHE O 1 1 1 331 1 1 21 ALA C C 3.939 1.042 -4.058 1.00 . A A . 21 ALA C 1 1 1 332 1 1 21 ALA CA C 3.000 1.708 -5.073 1.00 . A A . 21 ALA CA 1 1 1 333 1 1 21 ALA CB C 2.330 2.943 -4.449 1.00 . A A . 21 ALA CB 1 1 1 334 1 1 21 ALA H H 0.992 1.006 -5.453 1.00 . A A . 21 ALA H 1 1 1 335 1 1 21 ALA HA H 3.587 1.983 -5.937 1.00 . A A . 21 ALA HA 1 1 1 336 1 1 21 ALA HB1 H 1.489 3.251 -5.053 1.00 . A A . 21 ALA HB1 1 1 1 337 1 1 21 ALA HB2 H 1.980 2.726 -3.451 1.00 . A A . 21 ALA HB2 1 1 1 338 1 1 21 ALA HB3 H 3.037 3.758 -4.398 1.00 . A A . 21 ALA HB3 1 1 1 339 1 1 21 ALA N N 1.933 0.748 -5.501 1.00 . A A . 21 ALA N 1 1 1 340 1 1 21 ALA O O 5.140 1.140 -4.179 1.00 . A A . 21 ALA O 1 1 1 341 1 1 22 GLU C C 5.171 -1.306 -2.756 1.00 . A A . 22 GLU C 1 1 1 342 1 1 22 GLU CA C 4.235 -0.307 -2.051 1.00 . A A . 22 GLU CA 1 1 1 343 1 1 22 GLU CB C 3.338 -1.059 -1.051 1.00 . A A . 22 GLU CB 1 1 1 344 1 1 22 GLU CD C 1.159 -0.643 0.175 1.00 . A A . 22 GLU CD 1 1 1 345 1 1 22 GLU CG C 2.543 -0.058 -0.178 1.00 . A A . 22 GLU CG 1 1 1 346 1 1 22 GLU H H 2.404 0.355 -3.038 1.00 . A A . 22 GLU H 1 1 1 347 1 1 22 GLU HA H 4.843 0.437 -1.556 1.00 . A A . 22 GLU HA 1 1 1 348 1 1 22 GLU HB2 H 2.663 -1.711 -1.583 1.00 . A A . 22 GLU HB2 1 1 1 349 1 1 22 GLU HB3 H 3.955 -1.670 -0.407 1.00 . A A . 22 GLU HB3 1 1 1 350 1 1 22 GLU HG2 H 3.079 0.130 0.742 1.00 . A A . 22 GLU HG2 1 1 1 351 1 1 22 GLU HG3 H 2.412 0.881 -0.696 1.00 . A A . 22 GLU HG3 1 1 1 352 1 1 22 GLU N N 3.379 0.380 -3.080 1.00 . A A . 22 GLU N 1 1 1 353 1 1 22 GLU O O 6.365 -1.315 -2.525 1.00 . A A . 22 GLU O 1 1 1 354 1 1 22 GLU OE1 O 1.139 -1.738 0.714 1.00 . A A . 22 GLU OE1 1 1 1 355 1 1 22 GLU OE2 O 0.194 0.043 -0.113 1.00 . A A . 22 GLU OE2 1 1 1 356 1 1 23 ASP C C 6.542 -2.478 -5.041 1.00 . A A . 23 ASP C 1 1 1 357 1 1 23 ASP CA C 5.333 -3.148 -4.384 1.00 . A A . 23 ASP CA 1 1 1 358 1 1 23 ASP CB C 4.401 -3.733 -5.463 1.00 . A A . 23 ASP CB 1 1 1 359 1 1 23 ASP CG C 4.917 -5.103 -5.944 1.00 . A A . 23 ASP CG 1 1 1 360 1 1 23 ASP H H 3.615 -2.036 -3.727 1.00 . A A . 23 ASP H 1 1 1 361 1 1 23 ASP HA H 5.676 -3.915 -3.708 1.00 . A A . 23 ASP HA 1 1 1 362 1 1 23 ASP HB2 H 3.397 -3.832 -5.080 1.00 . A A . 23 ASP HB2 1 1 1 363 1 1 23 ASP HB3 H 4.358 -3.068 -6.311 1.00 . A A . 23 ASP HB3 1 1 1 364 1 1 23 ASP N N 4.581 -2.114 -3.603 1.00 . A A . 23 ASP N 1 1 1 365 1 1 23 ASP O O 7.668 -2.898 -4.899 1.00 . A A . 23 ASP O 1 1 1 366 1 1 23 ASP OD1 O 5.944 -5.094 -6.606 1.00 . A A . 23 ASP OD1 1 1 1 367 1 1 23 ASP OD2 O 4.259 -6.080 -5.626 1.00 . A A . 23 ASP OD2 1 1 1 368 1 1 24 VAL C C 8.337 -0.119 -5.550 1.00 . A A . 24 VAL C 1 1 1 369 1 1 24 VAL CA C 7.213 -0.597 -6.485 1.00 . A A . 24 VAL CA 1 1 1 370 1 1 24 VAL CB C 6.391 0.563 -7.090 1.00 . A A . 24 VAL CB 1 1 1 371 1 1 24 VAL CG1 C 7.247 1.562 -7.849 1.00 . A A . 24 VAL CG1 1 1 1 372 1 1 24 VAL CG2 C 5.309 -0.009 -8.026 1.00 . A A . 24 VAL CG2 1 1 1 373 1 1 24 VAL H H 5.282 -1.180 -5.788 1.00 . A A . 24 VAL H 1 1 1 374 1 1 24 VAL HA H 7.649 -1.197 -7.268 1.00 . A A . 24 VAL HA 1 1 1 375 1 1 24 VAL HB H 5.898 1.102 -6.301 1.00 . A A . 24 VAL HB 1 1 1 376 1 1 24 VAL HG11 H 7.836 1.057 -8.597 1.00 . A A . 24 VAL HG11 1 1 1 377 1 1 24 VAL HG12 H 6.596 2.281 -8.327 1.00 . A A . 24 VAL HG12 1 1 1 378 1 1 24 VAL HG13 H 7.890 2.081 -7.156 1.00 . A A . 24 VAL HG13 1 1 1 379 1 1 24 VAL HG21 H 5.118 -1.052 -7.816 1.00 . A A . 24 VAL HG21 1 1 1 380 1 1 24 VAL HG22 H 4.396 0.544 -7.863 1.00 . A A . 24 VAL HG22 1 1 1 381 1 1 24 VAL HG23 H 5.603 0.083 -9.059 1.00 . A A . 24 VAL HG23 1 1 1 382 1 1 24 VAL N N 6.225 -1.430 -5.744 1.00 . A A . 24 VAL N 1 1 1 383 1 1 24 VAL O O 9.509 -0.312 -5.808 1.00 . A A . 24 VAL O 1 1 1 384 1 1 25 GLY C C 9.887 -0.014 -3.023 1.00 . A A . 25 GLY C 1 1 1 385 1 1 25 GLY CA C 8.849 1.030 -3.443 1.00 . A A . 25 GLY CA 1 1 1 386 1 1 25 GLY H H 6.946 0.583 -4.357 1.00 . A A . 25 GLY H 1 1 1 387 1 1 25 GLY HA2 H 9.355 1.895 -3.847 1.00 . A A . 25 GLY HA2 1 1 1 388 1 1 25 GLY HA3 H 8.278 1.326 -2.576 1.00 . A A . 25 GLY HA3 1 1 1 389 1 1 25 GLY N N 7.911 0.488 -4.475 1.00 . A A . 25 GLY N 1 1 1 390 1 1 25 GLY O O 11.077 0.228 -3.086 1.00 . A A . 25 GLY O 1 1 1 391 1 1 26 SER C C 11.151 -2.767 -3.338 1.00 . A A . 26 SER C 1 1 1 392 1 1 26 SER CA C 10.294 -2.258 -2.169 1.00 . A A . 26 SER CA 1 1 1 393 1 1 26 SER CB C 9.441 -3.416 -1.590 1.00 . A A . 26 SER CB 1 1 1 394 1 1 26 SER H H 8.416 -1.258 -2.593 1.00 . A A . 26 SER H 1 1 1 395 1 1 26 SER HA H 10.947 -1.876 -1.404 1.00 . A A . 26 SER HA 1 1 1 396 1 1 26 SER HB2 H 10.016 -4.326 -1.496 1.00 . A A . 26 SER HB2 1 1 1 397 1 1 26 SER HB3 H 9.024 -3.147 -0.630 1.00 . A A . 26 SER HB3 1 1 1 398 1 1 26 SER HG H 8.467 -4.503 -2.877 1.00 . A A . 26 SER HG 1 1 1 399 1 1 26 SER N N 9.388 -1.150 -2.609 1.00 . A A . 26 SER N 1 1 1 400 1 1 26 SER O O 12.359 -2.853 -3.237 1.00 . A A . 26 SER O 1 1 1 401 1 1 26 SER OG O 8.384 -3.618 -2.515 1.00 . A A . 26 SER OG 1 1 1 402 1 1 27 ASN C C 12.415 -2.861 -6.022 1.00 . A A . 27 ASN C 1 1 1 403 1 1 27 ASN CA C 11.127 -3.593 -5.667 1.00 . A A . 27 ASN CA 1 1 1 404 1 1 27 ASN CB C 10.114 -3.453 -6.809 1.00 . A A . 27 ASN CB 1 1 1 405 1 1 27 ASN CG C 9.284 -4.737 -6.949 1.00 . A A . 27 ASN CG 1 1 1 406 1 1 27 ASN H H 9.517 -2.974 -4.425 1.00 . A A . 27 ASN H 1 1 1 407 1 1 27 ASN HA H 11.390 -4.626 -5.503 1.00 . A A . 27 ASN HA 1 1 1 408 1 1 27 ASN HB2 H 9.440 -2.634 -6.616 1.00 . A A . 27 ASN HB2 1 1 1 409 1 1 27 ASN HB3 H 10.633 -3.248 -7.729 1.00 . A A . 27 ASN HB3 1 1 1 410 1 1 27 ASN HD21 H 8.876 -4.838 -5.010 1.00 . A A . 27 ASN HD21 1 1 1 411 1 1 27 ASN HD22 H 8.211 -6.081 -5.958 1.00 . A A . 27 ASN HD22 1 1 1 412 1 1 27 ASN N N 10.484 -3.079 -4.419 1.00 . A A . 27 ASN N 1 1 1 413 1 1 27 ASN ND2 N 8.745 -5.262 -5.883 1.00 . A A . 27 ASN ND2 1 1 1 414 1 1 27 ASN O O 13.394 -3.487 -6.366 1.00 . A A . 27 ASN O 1 1 1 415 1 1 27 ASN OD1 O 9.119 -5.271 -8.028 1.00 . A A . 27 ASN OD1 1 1 1 416 1 1 28 LYS C C 14.876 -1.307 -5.790 1.00 . A A . 28 LYS C 1 1 1 417 1 1 28 LYS CA C 13.537 -0.687 -6.245 1.00 . A A . 28 LYS CA 1 1 1 418 1 1 28 LYS CB C 13.289 0.653 -5.548 1.00 . A A . 28 LYS CB 1 1 1 419 1 1 28 LYS CD C 14.193 3.006 -5.541 1.00 . A A . 28 LYS CD 1 1 1 420 1 1 28 LYS CE C 14.779 4.122 -6.425 1.00 . A A . 28 LYS CE 1 1 1 421 1 1 28 LYS CG C 13.852 1.783 -6.418 1.00 . A A . 28 LYS CG 1 1 1 422 1 1 28 LYS H H 11.521 -1.133 -5.683 1.00 . A A . 28 LYS H 1 1 1 423 1 1 28 LYS HA H 13.579 -0.547 -7.318 1.00 . A A . 28 LYS HA 1 1 1 424 1 1 28 LYS HB2 H 12.223 0.796 -5.433 1.00 . A A . 28 LYS HB2 1 1 1 425 1 1 28 LYS HB3 H 13.740 0.645 -4.568 1.00 . A A . 28 LYS HB3 1 1 1 426 1 1 28 LYS HD2 H 13.303 3.364 -5.046 1.00 . A A . 28 LYS HD2 1 1 1 427 1 1 28 LYS HD3 H 14.918 2.728 -4.790 1.00 . A A . 28 LYS HD3 1 1 1 428 1 1 28 LYS HE2 H 15.145 4.929 -5.807 1.00 . A A . 28 LYS HE2 1 1 1 429 1 1 28 LYS HE3 H 15.597 3.744 -7.022 1.00 . A A . 28 LYS HE3 1 1 1 430 1 1 28 LYS HG2 H 14.739 1.437 -6.929 1.00 . A A . 28 LYS HG2 1 1 1 431 1 1 28 LYS HG3 H 13.105 2.043 -7.154 1.00 . A A . 28 LYS HG3 1 1 1 432 1 1 28 LYS HZ1 H 12.833 4.164 -7.170 1.00 . A A . 28 LYS HZ1 1 1 1 433 1 1 28 LYS HZ2 H 13.601 5.678 -7.154 1.00 . A A . 28 LYS HZ2 1 1 1 434 1 1 28 LYS HZ3 H 14.025 4.522 -8.324 1.00 . A A . 28 LYS HZ3 1 1 1 435 1 1 28 LYS N N 12.362 -1.558 -5.939 1.00 . A A . 28 LYS N 1 1 1 436 1 1 28 LYS NZ N 13.731 4.662 -7.337 1.00 . A A . 28 LYS NZ 1 1 1 437 1 1 28 LYS O O 15.860 -1.212 -6.493 1.00 . A A . 28 LYS O 1 1 1 438 1 1 29 GLY C C 16.602 -3.647 -5.120 1.00 . A A . 29 GLY C 1 1 1 439 1 1 29 GLY CA C 16.143 -2.565 -4.130 1.00 . A A . 29 GLY CA 1 1 1 440 1 1 29 GLY H H 14.065 -2.005 -4.109 1.00 . A A . 29 GLY H 1 1 1 441 1 1 29 GLY HA2 H 16.909 -1.811 -4.031 1.00 . A A . 29 GLY HA2 1 1 1 442 1 1 29 GLY HA3 H 15.948 -3.018 -3.169 1.00 . A A . 29 GLY HA3 1 1 1 443 1 1 29 GLY N N 14.884 -1.937 -4.639 1.00 . A A . 29 GLY N 1 1 1 444 1 1 29 GLY O O 17.694 -3.592 -5.652 1.00 . A A . 29 GLY O 1 1 1 445 1 1 30 ALA C C 16.392 -5.149 -7.683 1.00 . A A . 30 ALA C 1 1 1 446 1 1 30 ALA CA C 16.066 -5.716 -6.296 1.00 . A A . 30 ALA CA 1 1 1 447 1 1 30 ALA CB C 14.863 -6.664 -6.386 1.00 . A A . 30 ALA CB 1 1 1 448 1 1 30 ALA H H 14.862 -4.580 -4.898 1.00 . A A . 30 ALA H 1 1 1 449 1 1 30 ALA HA H 16.939 -6.234 -5.927 1.00 . A A . 30 ALA HA 1 1 1 450 1 1 30 ALA HB1 H 14.636 -7.064 -5.409 1.00 . A A . 30 ALA HB1 1 1 1 451 1 1 30 ALA HB2 H 13.995 -6.136 -6.755 1.00 . A A . 30 ALA HB2 1 1 1 452 1 1 30 ALA HB3 H 15.084 -7.484 -7.054 1.00 . A A . 30 ALA HB3 1 1 1 453 1 1 30 ALA N N 15.733 -4.602 -5.349 1.00 . A A . 30 ALA N 1 1 1 454 1 1 30 ALA O O 17.307 -5.591 -8.343 1.00 . A A . 30 ALA O 1 1 1 455 1 1 31 ILE C C 17.240 -3.013 -9.527 1.00 . A A . 31 ILE C 1 1 1 456 1 1 31 ILE CA C 15.791 -3.497 -9.393 1.00 . A A . 31 ILE CA 1 1 1 457 1 1 31 ILE CB C 14.733 -2.355 -9.410 1.00 . A A . 31 ILE CB 1 1 1 458 1 1 31 ILE CD1 C 12.198 -1.989 -9.621 1.00 . A A . 31 ILE CD1 1 1 1 459 1 1 31 ILE CG1 C 13.349 -3.014 -9.677 1.00 . A A . 31 ILE CG1 1 1 1 460 1 1 31 ILE CG2 C 15.053 -1.276 -10.464 1.00 . A A . 31 ILE CG2 1 1 1 461 1 1 31 ILE H H 14.905 -3.873 -7.487 1.00 . A A . 31 ILE H 1 1 1 462 1 1 31 ILE HA H 15.608 -4.219 -10.175 1.00 . A A . 31 ILE HA 1 1 1 463 1 1 31 ILE HB H 14.712 -1.888 -8.441 1.00 . A A . 31 ILE HB 1 1 1 464 1 1 31 ILE HD11 H 12.341 -1.201 -10.344 1.00 . A A . 31 ILE HD11 1 1 1 465 1 1 31 ILE HD12 H 11.265 -2.487 -9.844 1.00 . A A . 31 ILE HD12 1 1 1 466 1 1 31 ILE HD13 H 12.127 -1.554 -8.636 1.00 . A A . 31 ILE HD13 1 1 1 467 1 1 31 ILE HG12 H 13.366 -3.502 -10.637 1.00 . A A . 31 ILE HG12 1 1 1 468 1 1 31 ILE HG13 H 13.165 -3.771 -8.927 1.00 . A A . 31 ILE HG13 1 1 1 469 1 1 31 ILE HG21 H 16.026 -0.850 -10.272 1.00 . A A . 31 ILE HG21 1 1 1 470 1 1 31 ILE HG22 H 15.031 -1.695 -11.457 1.00 . A A . 31 ILE HG22 1 1 1 471 1 1 31 ILE HG23 H 14.327 -0.477 -10.401 1.00 . A A . 31 ILE HG23 1 1 1 472 1 1 31 ILE N N 15.621 -4.172 -8.076 1.00 . A A . 31 ILE N 1 1 1 473 1 1 31 ILE O O 17.905 -3.341 -10.489 1.00 . A A . 31 ILE O 1 1 1 474 1 1 32 ILE C C 20.060 -2.937 -8.774 1.00 . A A . 32 ILE C 1 1 1 475 1 1 32 ILE CA C 19.109 -1.744 -8.621 1.00 . A A . 32 ILE CA 1 1 1 476 1 1 32 ILE CB C 19.398 -0.961 -7.316 1.00 . A A . 32 ILE CB 1 1 1 477 1 1 32 ILE CD1 C 18.278 0.755 -5.814 1.00 . A A . 32 ILE CD1 1 1 1 478 1 1 32 ILE CG1 C 18.450 0.271 -7.264 1.00 . A A . 32 ILE CG1 1 1 1 479 1 1 32 ILE CG2 C 20.870 -0.477 -7.308 1.00 . A A . 32 ILE CG2 1 1 1 480 1 1 32 ILE H H 17.123 -2.001 -7.819 1.00 . A A . 32 ILE H 1 1 1 481 1 1 32 ILE HA H 19.214 -1.117 -9.490 1.00 . A A . 32 ILE HA 1 1 1 482 1 1 32 ILE HB H 19.222 -1.604 -6.465 1.00 . A A . 32 ILE HB 1 1 1 483 1 1 32 ILE HD11 H 18.008 -0.068 -5.170 1.00 . A A . 32 ILE HD11 1 1 1 484 1 1 32 ILE HD12 H 19.196 1.194 -5.452 1.00 . A A . 32 ILE HD12 1 1 1 485 1 1 32 ILE HD13 H 17.498 1.500 -5.768 1.00 . A A . 32 ILE HD13 1 1 1 486 1 1 32 ILE HG12 H 18.851 1.065 -7.873 1.00 . A A . 32 ILE HG12 1 1 1 487 1 1 32 ILE HG13 H 17.481 0.014 -7.665 1.00 . A A . 32 ILE HG13 1 1 1 488 1 1 32 ILE HG21 H 21.101 0.045 -8.225 1.00 . A A . 32 ILE HG21 1 1 1 489 1 1 32 ILE HG22 H 21.040 0.191 -6.477 1.00 . A A . 32 ILE HG22 1 1 1 490 1 1 32 ILE HG23 H 21.538 -1.319 -7.209 1.00 . A A . 32 ILE HG23 1 1 1 491 1 1 32 ILE N N 17.701 -2.250 -8.568 1.00 . A A . 32 ILE N 1 1 1 492 1 1 32 ILE O O 20.941 -2.923 -9.610 1.00 . A A . 32 ILE O 1 1 1 493 1 1 33 GLY C C 20.753 -5.696 -9.467 1.00 . A A . 33 GLY C 1 1 1 494 1 1 33 GLY CA C 20.714 -5.161 -8.027 1.00 . A A . 33 GLY CA 1 1 1 495 1 1 33 GLY H H 19.115 -3.881 -7.313 1.00 . A A . 33 GLY H 1 1 1 496 1 1 33 GLY HA2 H 21.718 -4.899 -7.721 1.00 . A A . 33 GLY HA2 1 1 1 497 1 1 33 GLY HA3 H 20.319 -5.922 -7.373 1.00 . A A . 33 GLY HA3 1 1 1 498 1 1 33 GLY N N 19.847 -3.942 -7.961 1.00 . A A . 33 GLY N 1 1 1 499 1 1 33 GLY O O 21.809 -5.951 -10.007 1.00 . A A . 33 GLY O 1 1 1 500 1 1 34 LEU C C 20.284 -5.451 -12.417 1.00 . A A . 34 LEU C 1 1 1 501 1 1 34 LEU CA C 19.496 -6.357 -11.456 1.00 . A A . 34 LEU CA 1 1 1 502 1 1 34 LEU CB C 18.008 -6.405 -11.866 1.00 . A A . 34 LEU CB 1 1 1 503 1 1 34 LEU CD1 C 15.757 -7.170 -10.982 1.00 . A A . 34 LEU CD1 1 1 1 504 1 1 34 LEU CD2 C 17.451 -8.875 -11.729 1.00 . A A . 34 LEU CD2 1 1 1 505 1 1 34 LEU CG C 17.266 -7.502 -11.047 1.00 . A A . 34 LEU CG 1 1 1 506 1 1 34 LEU H H 18.778 -5.626 -9.559 1.00 . A A . 34 LEU H 1 1 1 507 1 1 34 LEU HA H 19.936 -7.343 -11.486 1.00 . A A . 34 LEU HA 1 1 1 508 1 1 34 LEU HB2 H 17.554 -5.442 -11.684 1.00 . A A . 34 LEU HB2 1 1 1 509 1 1 34 LEU HB3 H 17.930 -6.616 -12.923 1.00 . A A . 34 LEU HB3 1 1 1 510 1 1 34 LEU HD11 H 15.394 -6.859 -11.951 1.00 . A A . 34 LEU HD11 1 1 1 511 1 1 34 LEU HD12 H 15.196 -8.035 -10.663 1.00 . A A . 34 LEU HD12 1 1 1 512 1 1 34 LEU HD13 H 15.585 -6.374 -10.274 1.00 . A A . 34 LEU HD13 1 1 1 513 1 1 34 LEU HD21 H 18.501 -9.122 -11.793 1.00 . A A . 34 LEU HD21 1 1 1 514 1 1 34 LEU HD22 H 16.954 -9.642 -11.154 1.00 . A A . 34 LEU HD22 1 1 1 515 1 1 34 LEU HD23 H 17.035 -8.863 -12.726 1.00 . A A . 34 LEU HD23 1 1 1 516 1 1 34 LEU HG H 17.657 -7.552 -10.043 1.00 . A A . 34 LEU HG 1 1 1 517 1 1 34 LEU N N 19.592 -5.847 -10.052 1.00 . A A . 34 LEU N 1 1 1 518 1 1 34 LEU O O 21.059 -5.943 -13.214 1.00 . A A . 34 LEU O 1 1 1 519 1 1 35 MET C C 22.280 -3.414 -13.115 1.00 . A A . 35 MET C 1 1 1 520 1 1 35 MET CA C 20.767 -3.169 -13.182 1.00 . A A . 35 MET CA 1 1 1 521 1 1 35 MET CB C 20.444 -1.740 -12.694 1.00 . A A . 35 MET CB 1 1 1 522 1 1 35 MET CE C 19.313 1.068 -11.797 1.00 . A A . 35 MET CE 1 1 1 523 1 1 35 MET CG C 18.971 -1.386 -12.995 1.00 . A A . 35 MET CG 1 1 1 524 1 1 35 MET H H 19.413 -3.847 -11.642 1.00 . A A . 35 MET H 1 1 1 525 1 1 35 MET HA H 20.438 -3.308 -14.199 1.00 . A A . 35 MET HA 1 1 1 526 1 1 35 MET HB2 H 20.624 -1.661 -11.633 1.00 . A A . 35 MET HB2 1 1 1 527 1 1 35 MET HB3 H 21.086 -1.032 -13.199 1.00 . A A . 35 MET HB3 1 1 1 528 1 1 35 MET HE1 H 19.613 1.319 -12.804 1.00 . A A . 35 MET HE1 1 1 1 529 1 1 35 MET HE2 H 18.858 1.930 -11.332 1.00 . A A . 35 MET HE2 1 1 1 530 1 1 35 MET HE3 H 20.179 0.769 -11.225 1.00 . A A . 35 MET HE3 1 1 1 531 1 1 35 MET HG2 H 18.931 -0.918 -13.968 1.00 . A A . 35 MET HG2 1 1 1 532 1 1 35 MET HG3 H 18.391 -2.295 -13.054 1.00 . A A . 35 MET HG3 1 1 1 533 1 1 35 MET N N 20.059 -4.162 -12.307 1.00 . A A . 35 MET N 1 1 1 534 1 1 35 MET O O 22.946 -3.507 -14.128 1.00 . A A . 35 MET O 1 1 1 535 1 1 35 MET SD S 18.115 -0.291 -11.835 1.00 . A A . 35 MET SD 1 1 1 536 1 1 36 VAL C C 24.620 -5.072 -12.328 1.00 . A A . 36 VAL C 1 1 1 537 1 1 36 VAL CA C 24.207 -3.757 -11.636 1.00 . A A . 36 VAL CA 1 1 1 538 1 1 36 VAL CB C 24.406 -3.833 -10.089 1.00 . A A . 36 VAL CB 1 1 1 539 1 1 36 VAL CG1 C 25.815 -4.369 -9.742 1.00 . A A . 36 VAL CG1 1 1 1 540 1 1 36 VAL CG2 C 24.250 -2.416 -9.494 1.00 . A A . 36 VAL CG2 1 1 1 541 1 1 36 VAL H H 22.137 -3.409 -11.151 1.00 . A A . 36 VAL H 1 1 1 542 1 1 36 VAL HA H 24.782 -2.943 -12.056 1.00 . A A . 36 VAL HA 1 1 1 543 1 1 36 VAL HB H 23.658 -4.476 -9.645 1.00 . A A . 36 VAL HB 1 1 1 544 1 1 36 VAL HG11 H 26.568 -3.868 -10.333 1.00 . A A . 36 VAL HG11 1 1 1 545 1 1 36 VAL HG12 H 26.032 -4.209 -8.696 1.00 . A A . 36 VAL HG12 1 1 1 546 1 1 36 VAL HG13 H 25.863 -5.428 -9.941 1.00 . A A . 36 VAL HG13 1 1 1 547 1 1 36 VAL HG21 H 23.315 -1.976 -9.808 1.00 . A A . 36 VAL HG21 1 1 1 548 1 1 36 VAL HG22 H 24.260 -2.466 -8.415 1.00 . A A . 36 VAL HG22 1 1 1 549 1 1 36 VAL HG23 H 25.058 -1.778 -9.818 1.00 . A A . 36 VAL HG23 1 1 1 550 1 1 36 VAL N N 22.756 -3.511 -11.900 1.00 . A A . 36 VAL N 1 1 1 551 1 1 36 VAL O O 25.569 -5.102 -13.089 1.00 . A A . 36 VAL O 1 1 1 552 1 1 37 GLY C C 24.145 -8.500 -11.489 1.00 . A A . 37 GLY C 1 1 1 553 1 1 37 GLY CA C 24.135 -7.462 -12.614 1.00 . A A . 37 GLY CA 1 1 1 554 1 1 37 GLY H H 23.137 -6.007 -11.406 1.00 . A A . 37 GLY H 1 1 1 555 1 1 37 GLY HA2 H 23.345 -7.695 -13.312 1.00 . A A . 37 GLY HA2 1 1 1 556 1 1 37 GLY HA3 H 25.086 -7.481 -13.123 1.00 . A A . 37 GLY HA3 1 1 1 557 1 1 37 GLY N N 23.880 -6.111 -12.032 1.00 . A A . 37 GLY N 1 1 1 558 1 1 37 GLY O O 24.701 -8.258 -10.436 1.00 . A A . 37 GLY O 1 1 1 559 1 1 38 GLY C C 24.878 -11.186 -10.347 1.00 . A A . 38 GLY C 1 1 1 560 1 1 38 GLY CA C 23.466 -10.721 -10.728 1.00 . A A . 38 GLY CA 1 1 1 561 1 1 38 GLY H H 23.098 -9.752 -12.618 1.00 . A A . 38 GLY H 1 1 1 562 1 1 38 GLY HA2 H 22.957 -10.359 -9.846 1.00 . A A . 38 GLY HA2 1 1 1 563 1 1 38 GLY HA3 H 22.920 -11.557 -11.141 1.00 . A A . 38 GLY HA3 1 1 1 564 1 1 38 GLY N N 23.527 -9.626 -11.747 1.00 . A A . 38 GLY N 1 1 1 565 1 1 38 GLY O O 25.175 -11.389 -9.186 1.00 . A A . 38 GLY O 1 1 1 566 1 1 39 VAL C C 28.023 -10.534 -11.128 1.00 . A A . 39 VAL C 1 1 1 567 1 1 39 VAL CA C 27.112 -11.778 -11.161 1.00 . A A . 39 VAL CA 1 1 1 568 1 1 39 VAL CB C 27.508 -12.734 -12.338 1.00 . A A . 39 VAL CB 1 1 1 569 1 1 39 VAL CG1 C 28.711 -13.611 -11.913 1.00 . A A . 39 VAL CG1 1 1 1 570 1 1 39 VAL CG2 C 26.327 -13.672 -12.698 1.00 . A A . 39 VAL CG2 1 1 1 571 1 1 39 VAL H H 25.388 -11.148 -12.261 1.00 . A A . 39 VAL H 1 1 1 572 1 1 39 VAL HA H 27.186 -12.287 -10.216 1.00 . A A . 39 VAL HA 1 1 1 573 1 1 39 VAL HB H 27.776 -12.155 -13.210 1.00 . A A . 39 VAL HB 1 1 1 574 1 1 39 VAL HG11 H 29.549 -12.995 -11.624 1.00 . A A . 39 VAL HG11 1 1 1 575 1 1 39 VAL HG12 H 28.440 -14.240 -11.077 1.00 . A A . 39 VAL HG12 1 1 1 576 1 1 39 VAL HG13 H 29.017 -14.241 -12.735 1.00 . A A . 39 VAL HG13 1 1 1 577 1 1 39 VAL HG21 H 25.926 -14.132 -11.808 1.00 . A A . 39 VAL HG21 1 1 1 578 1 1 39 VAL HG22 H 25.541 -13.113 -13.184 1.00 . A A . 39 VAL HG22 1 1 1 579 1 1 39 VAL HG23 H 26.658 -14.450 -13.372 1.00 . A A . 39 VAL HG23 1 1 1 580 1 1 39 VAL N N 25.700 -11.332 -11.356 1.00 . A A . 39 VAL N 1 1 1 581 1 1 39 VAL O O 29.157 -10.564 -11.569 1.00 . A A . 39 VAL O 1 1 1 582 1 1 40 VAL C C 27.956 -7.566 -9.084 1.00 . A A . 40 VAL C 1 1 1 583 1 1 40 VAL CA C 28.215 -8.172 -10.478 1.00 . A A . 40 VAL CA 1 1 1 584 1 1 40 VAL CB C 27.718 -7.197 -11.586 1.00 . A A . 40 VAL CB 1 1 1 585 1 1 40 VAL CG1 C 28.569 -5.908 -11.572 1.00 . A A . 40 VAL CG1 1 1 1 586 1 1 40 VAL CG2 C 27.845 -7.861 -12.976 1.00 . A A . 40 VAL CG2 1 1 1 587 1 1 40 VAL H H 26.557 -9.524 -10.259 1.00 . A A . 40 VAL H 1 1 1 588 1 1 40 VAL HA H 29.275 -8.354 -10.590 1.00 . A A . 40 VAL HA 1 1 1 589 1 1 40 VAL HB H 26.684 -6.942 -11.407 1.00 . A A . 40 VAL HB 1 1 1 590 1 1 40 VAL HG11 H 29.614 -6.145 -11.716 1.00 . A A . 40 VAL HG11 1 1 1 591 1 1 40 VAL HG12 H 28.252 -5.244 -12.363 1.00 . A A . 40 VAL HG12 1 1 1 592 1 1 40 VAL HG13 H 28.457 -5.394 -10.629 1.00 . A A . 40 VAL HG13 1 1 1 593 1 1 40 VAL HG21 H 28.853 -8.217 -13.134 1.00 . A A . 40 VAL HG21 1 1 1 594 1 1 40 VAL HG22 H 27.164 -8.695 -13.056 1.00 . A A . 40 VAL HG22 1 1 1 595 1 1 40 VAL HG23 H 27.604 -7.148 -13.751 1.00 . A A . 40 VAL HG23 1 1 1 596 1 1 40 VAL N N 27.477 -9.471 -10.593 1.00 . A A . 40 VAL N 1 1 1 597 1 1 40 VAL O O 26.810 -7.613 -8.667 1.00 . A A . 40 VAL O 1 1 1 598 1 1 40 VAL OXT O 28.922 -7.088 -8.512 1.00 . A A . 40 VAL OXT 1 1 2 599 1 1 1 ASP C C 15.628 6.025 -15.600 1.00 . A A . 1 ASP C 1 1 2 600 1 1 1 ASP CA C 16.100 4.570 -15.733 1.00 . A A . 1 ASP CA 1 1 2 601 1 1 1 ASP CB C 15.283 3.668 -14.772 1.00 . A A . 1 ASP CB 1 1 2 602 1 1 1 ASP CG C 13.773 3.941 -14.930 1.00 . A A . 1 ASP CG 1 1 2 603 1 1 1 ASP H1 H 17.905 5.427 -15.147 1.00 . A A . 1 ASP H1 1 1 2 604 1 1 1 ASP H2 H 17.685 3.838 -14.594 1.00 . A A . 1 ASP H2 1 1 2 605 1 1 1 ASP H3 H 18.073 4.125 -16.221 1.00 . A A . 1 ASP H3 1 1 2 606 1 1 1 ASP HA H 15.964 4.242 -16.754 1.00 . A A . 1 ASP HA 1 1 2 607 1 1 1 ASP HB2 H 15.475 2.628 -15.000 1.00 . A A . 1 ASP HB2 1 1 2 608 1 1 1 ASP HB3 H 15.575 3.853 -13.747 1.00 . A A . 1 ASP HB3 1 1 2 609 1 1 1 ASP N N 17.549 4.484 -15.398 1.00 . A A . 1 ASP N 1 1 2 610 1 1 1 ASP O O 15.873 6.665 -14.596 1.00 . A A . 1 ASP O 1 1 2 611 1 1 1 ASP OD1 O 13.242 3.478 -15.926 1.00 . A A . 1 ASP OD1 1 1 2 612 1 1 1 ASP OD2 O 13.235 4.595 -14.050 1.00 . A A . 1 ASP OD2 1 1 2 613 1 1 2 ALA C C 12.973 7.840 -16.168 1.00 . A A . 2 ALA C 1 1 2 614 1 1 2 ALA CA C 14.433 7.887 -16.644 1.00 . A A . 2 ALA CA 1 1 2 615 1 1 2 ALA CB C 14.552 8.418 -18.080 1.00 . A A . 2 ALA CB 1 1 2 616 1 1 2 ALA H H 14.802 5.908 -17.399 1.00 . A A . 2 ALA H 1 1 2 617 1 1 2 ALA HA H 15.006 8.508 -15.971 1.00 . A A . 2 ALA HA 1 1 2 618 1 1 2 ALA HB1 H 14.259 7.654 -18.780 1.00 . A A . 2 ALA HB1 1 1 2 619 1 1 2 ALA HB2 H 13.924 9.287 -18.216 1.00 . A A . 2 ALA HB2 1 1 2 620 1 1 2 ALA HB3 H 15.578 8.694 -18.274 1.00 . A A . 2 ALA HB3 1 1 2 621 1 1 2 ALA N N 14.960 6.488 -16.626 1.00 . A A . 2 ALA N 1 1 2 622 1 1 2 ALA O O 12.047 8.207 -16.867 1.00 . A A . 2 ALA O 1 1 2 623 1 1 3 GLU C C 10.512 6.426 -15.113 1.00 . A A . 3 GLU C 1 1 2 624 1 1 3 GLU CA C 11.521 7.227 -14.272 1.00 . A A . 3 GLU CA 1 1 2 625 1 1 3 GLU CB C 10.980 8.655 -13.956 1.00 . A A . 3 GLU CB 1 1 2 626 1 1 3 GLU CD C 11.238 8.442 -11.454 1.00 . A A . 3 GLU CD 1 1 2 627 1 1 3 GLU CG C 11.705 9.209 -12.709 1.00 . A A . 3 GLU CG 1 1 2 628 1 1 3 GLU H H 13.657 7.101 -14.478 1.00 . A A . 3 GLU H 1 1 2 629 1 1 3 GLU HA H 11.686 6.678 -13.361 1.00 . A A . 3 GLU HA 1 1 2 630 1 1 3 GLU HB2 H 11.157 9.314 -14.793 1.00 . A A . 3 GLU HB2 1 1 2 631 1 1 3 GLU HB3 H 9.917 8.630 -13.765 1.00 . A A . 3 GLU HB3 1 1 2 632 1 1 3 GLU HG2 H 12.775 9.105 -12.816 1.00 . A A . 3 GLU HG2 1 1 2 633 1 1 3 GLU HG3 H 11.474 10.257 -12.587 1.00 . A A . 3 GLU HG3 1 1 2 634 1 1 3 GLU N N 12.845 7.370 -14.954 1.00 . A A . 3 GLU N 1 1 2 635 1 1 3 GLU O O 9.331 6.716 -15.146 1.00 . A A . 3 GLU O 1 1 2 636 1 1 3 GLU OE1 O 10.179 8.798 -10.963 1.00 . A A . 3 GLU OE1 1 1 2 637 1 1 3 GLU OE2 O 11.960 7.542 -11.056 1.00 . A A . 3 GLU OE2 1 1 2 638 1 1 4 PHE C C 10.149 3.122 -16.048 1.00 . A A . 4 PHE C 1 1 2 639 1 1 4 PHE CA C 10.207 4.535 -16.641 1.00 . A A . 4 PHE CA 1 1 2 640 1 1 4 PHE CB C 10.828 4.516 -18.058 1.00 . A A . 4 PHE CB 1 1 2 641 1 1 4 PHE CD1 C 9.631 6.707 -18.613 1.00 . A A . 4 PHE CD1 1 1 2 642 1 1 4 PHE CD2 C 11.870 6.407 -19.377 1.00 . A A . 4 PHE CD2 1 1 2 643 1 1 4 PHE CE1 C 9.598 7.956 -19.193 1.00 . A A . 4 PHE CE1 1 1 2 644 1 1 4 PHE CE2 C 11.837 7.658 -19.958 1.00 . A A . 4 PHE CE2 1 1 2 645 1 1 4 PHE CG C 10.768 5.917 -18.699 1.00 . A A . 4 PHE CG 1 1 2 646 1 1 4 PHE CZ C 10.702 8.434 -19.867 1.00 . A A . 4 PHE CZ 1 1 2 647 1 1 4 PHE H H 11.998 5.260 -15.699 1.00 . A A . 4 PHE H 1 1 2 648 1 1 4 PHE HA H 9.194 4.903 -16.667 1.00 . A A . 4 PHE HA 1 1 2 649 1 1 4 PHE HB2 H 11.859 4.203 -18.000 1.00 . A A . 4 PHE HB2 1 1 2 650 1 1 4 PHE HB3 H 10.294 3.826 -18.695 1.00 . A A . 4 PHE HB3 1 1 2 651 1 1 4 PHE HD1 H 8.755 6.349 -18.092 1.00 . A A . 4 PHE HD1 1 1 2 652 1 1 4 PHE HD2 H 12.765 5.807 -19.454 1.00 . A A . 4 PHE HD2 1 1 2 653 1 1 4 PHE HE1 H 8.705 8.561 -19.120 1.00 . A A . 4 PHE HE1 1 1 2 654 1 1 4 PHE HE2 H 12.703 8.031 -20.486 1.00 . A A . 4 PHE HE2 1 1 2 655 1 1 4 PHE HZ H 10.676 9.414 -20.321 1.00 . A A . 4 PHE HZ 1 1 2 656 1 1 4 PHE N N 11.037 5.427 -15.774 1.00 . A A . 4 PHE N 1 1 2 657 1 1 4 PHE O O 9.958 2.150 -16.754 1.00 . A A . 4 PHE O 1 1 2 658 1 1 5 ARG C C 9.076 1.828 -13.068 1.00 . A A . 5 ARG C 1 1 2 659 1 1 5 ARG CA C 10.290 1.769 -14.008 1.00 . A A . 5 ARG CA 1 1 2 660 1 1 5 ARG CB C 11.624 1.618 -13.219 1.00 . A A . 5 ARG CB 1 1 2 661 1 1 5 ARG CD C 11.270 -0.716 -12.269 1.00 . A A . 5 ARG CD 1 1 2 662 1 1 5 ARG CG C 12.113 0.149 -13.237 1.00 . A A . 5 ARG CG 1 1 2 663 1 1 5 ARG CZ C 12.792 -2.598 -11.832 1.00 . A A . 5 ARG CZ 1 1 2 664 1 1 5 ARG H H 10.469 3.903 -14.263 1.00 . A A . 5 ARG H 1 1 2 665 1 1 5 ARG HA H 10.150 0.950 -14.701 1.00 . A A . 5 ARG HA 1 1 2 666 1 1 5 ARG HB2 H 12.381 2.220 -13.690 1.00 . A A . 5 ARG HB2 1 1 2 667 1 1 5 ARG HB3 H 11.516 1.965 -12.205 1.00 . A A . 5 ARG HB3 1 1 2 668 1 1 5 ARG HD2 H 11.391 -0.394 -11.244 1.00 . A A . 5 ARG HD2 1 1 2 669 1 1 5 ARG HD3 H 10.226 -0.658 -12.535 1.00 . A A . 5 ARG HD3 1 1 2 670 1 1 5 ARG HE H 11.146 -2.761 -12.922 1.00 . A A . 5 ARG HE 1 1 2 671 1 1 5 ARG HG2 H 12.047 -0.251 -14.238 1.00 . A A . 5 ARG HG2 1 1 2 672 1 1 5 ARG HG3 H 13.149 0.125 -12.932 1.00 . A A . 5 ARG HG3 1 1 2 673 1 1 5 ARG HH11 H 13.312 -0.846 -11.004 1.00 . A A . 5 ARG HH11 1 1 2 674 1 1 5 ARG HH12 H 14.386 -2.171 -10.705 1.00 . A A . 5 ARG HH12 1 1 2 675 1 1 5 ARG HH21 H 12.497 -4.448 -12.539 1.00 . A A . 5 ARG HH21 1 1 2 676 1 1 5 ARG HH22 H 13.919 -4.231 -11.576 1.00 . A A . 5 ARG HH22 1 1 2 677 1 1 5 ARG N N 10.320 3.068 -14.752 1.00 . A A . 5 ARG N 1 1 2 678 1 1 5 ARG NE N 11.699 -2.145 -12.397 1.00 . A A . 5 ARG NE 1 1 2 679 1 1 5 ARG NH1 N 13.555 -1.808 -11.126 1.00 . A A . 5 ARG NH1 1 1 2 680 1 1 5 ARG NH2 N 13.093 -3.857 -11.994 1.00 . A A . 5 ARG NH2 1 1 2 681 1 1 5 ARG O O 9.166 1.494 -11.902 1.00 . A A . 5 ARG O 1 1 2 682 1 1 6 HIS C C 6.782 2.930 -11.487 1.00 . A A . 6 HIS C 1 1 2 683 1 1 6 HIS CA C 6.654 2.416 -12.935 1.00 . A A . 6 HIS CA 1 1 2 684 1 1 6 HIS CB C 5.924 1.036 -12.962 1.00 . A A . 6 HIS CB 1 1 2 685 1 1 6 HIS CD2 C 7.366 -1.185 -12.838 1.00 . A A . 6 HIS CD2 1 1 2 686 1 1 6 HIS CE1 C 7.823 -1.137 -10.817 1.00 . A A . 6 HIS CE1 1 1 2 687 1 1 6 HIS CG C 6.774 -0.054 -12.300 1.00 . A A . 6 HIS CG 1 1 2 688 1 1 6 HIS H H 8.020 2.505 -14.593 1.00 . A A . 6 HIS H 1 1 2 689 1 1 6 HIS HA H 6.069 3.134 -13.487 1.00 . A A . 6 HIS HA 1 1 2 690 1 1 6 HIS HB2 H 4.980 1.103 -12.442 1.00 . A A . 6 HIS HB2 1 1 2 691 1 1 6 HIS HB3 H 5.728 0.748 -13.985 1.00 . A A . 6 HIS HB3 1 1 2 692 1 1 6 HIS HD1 H 6.836 0.578 -10.382 1.00 . A A . 6 HIS HD1 1 1 2 693 1 1 6 HIS HD2 H 7.303 -1.481 -13.875 1.00 . A A . 6 HIS HD2 1 1 2 694 1 1 6 HIS HE1 H 8.223 -1.393 -9.847 1.00 . A A . 6 HIS HE1 1 1 2 695 1 1 6 HIS N N 7.976 2.264 -13.643 1.00 . A A . 6 HIS N 1 1 2 696 1 1 6 HIS ND1 N 7.099 -0.089 -11.051 1.00 . A A . 6 HIS ND1 1 1 2 697 1 1 6 HIS NE2 N 8.014 -1.847 -11.900 1.00 . A A . 6 HIS NE2 1 1 2 698 1 1 6 HIS O O 5.962 2.639 -10.636 1.00 . A A . 6 HIS O 1 1 2 699 1 1 7 ASP C C 6.938 4.904 -9.254 1.00 . A A . 7 ASP C 1 1 2 700 1 1 7 ASP CA C 8.168 4.308 -9.962 1.00 . A A . 7 ASP CA 1 1 2 701 1 1 7 ASP CB C 9.260 5.422 -10.174 1.00 . A A . 7 ASP CB 1 1 2 702 1 1 7 ASP CG C 9.663 5.558 -11.660 1.00 . A A . 7 ASP CG 1 1 2 703 1 1 7 ASP H H 8.412 3.858 -12.054 1.00 . A A . 7 ASP H 1 1 2 704 1 1 7 ASP HA H 8.578 3.531 -9.334 1.00 . A A . 7 ASP HA 1 1 2 705 1 1 7 ASP HB2 H 8.901 6.380 -9.822 1.00 . A A . 7 ASP HB2 1 1 2 706 1 1 7 ASP HB3 H 10.141 5.172 -9.599 1.00 . A A . 7 ASP HB3 1 1 2 707 1 1 7 ASP N N 7.828 3.692 -11.287 1.00 . A A . 7 ASP N 1 1 2 708 1 1 7 ASP O O 6.309 5.823 -9.739 1.00 . A A . 7 ASP O 1 1 2 709 1 1 7 ASP OD1 O 10.541 4.812 -12.069 1.00 . A A . 7 ASP OD1 1 1 2 710 1 1 7 ASP OD2 O 9.062 6.401 -12.305 1.00 . A A . 7 ASP OD2 1 1 2 711 1 1 8 SER C C 5.799 4.244 -5.802 1.00 . A A . 8 SER C 1 1 2 712 1 1 8 SER CA C 5.519 4.721 -7.238 1.00 . A A . 8 SER CA 1 1 2 713 1 1 8 SER CB C 4.222 4.063 -7.752 1.00 . A A . 8 SER CB 1 1 2 714 1 1 8 SER H H 7.237 3.598 -7.808 1.00 . A A . 8 SER H 1 1 2 715 1 1 8 SER HA H 5.441 5.796 -7.235 1.00 . A A . 8 SER HA 1 1 2 716 1 1 8 SER HB2 H 4.381 3.031 -8.026 1.00 . A A . 8 SER HB2 1 1 2 717 1 1 8 SER HB3 H 3.422 4.140 -7.031 1.00 . A A . 8 SER HB3 1 1 2 718 1 1 8 SER HG H 3.014 5.205 -8.758 1.00 . A A . 8 SER HG 1 1 2 719 1 1 8 SER N N 6.663 4.325 -8.111 1.00 . A A . 8 SER N 1 1 2 720 1 1 8 SER O O 6.689 3.448 -5.564 1.00 . A A . 8 SER O 1 1 2 721 1 1 8 SER OG O 3.875 4.810 -8.908 1.00 . A A . 8 SER OG 1 1 2 722 1 1 9 GLY C C 4.479 5.485 -2.612 1.00 . A A . 9 GLY C 1 1 2 723 1 1 9 GLY CA C 5.153 4.395 -3.444 1.00 . A A . 9 GLY CA 1 1 2 724 1 1 9 GLY H H 4.313 5.385 -5.159 1.00 . A A . 9 GLY H 1 1 2 725 1 1 9 GLY HA2 H 4.670 3.450 -3.254 1.00 . A A . 9 GLY HA2 1 1 2 726 1 1 9 GLY HA3 H 6.201 4.335 -3.180 1.00 . A A . 9 GLY HA3 1 1 2 727 1 1 9 GLY N N 5.012 4.754 -4.889 1.00 . A A . 9 GLY N 1 1 2 728 1 1 9 GLY O O 5.138 6.239 -1.924 1.00 . A A . 9 GLY O 1 1 2 729 1 1 10 TYR C C 0.899 6.123 -1.845 1.00 . A A . 10 TYR C 1 1 2 730 1 1 10 TYR CA C 2.374 6.545 -1.953 1.00 . A A . 10 TYR CA 1 1 2 731 1 1 10 TYR CB C 2.478 7.909 -2.684 1.00 . A A . 10 TYR CB 1 1 2 732 1 1 10 TYR CD1 C 2.879 7.392 -5.139 1.00 . A A . 10 TYR CD1 1 1 2 733 1 1 10 TYR CD2 C 0.669 7.961 -4.462 1.00 . A A . 10 TYR CD2 1 1 2 734 1 1 10 TYR CE1 C 2.444 7.244 -6.438 1.00 . A A . 10 TYR CE1 1 1 2 735 1 1 10 TYR CE2 C 0.235 7.812 -5.763 1.00 . A A . 10 TYR CE2 1 1 2 736 1 1 10 TYR CG C 1.996 7.751 -4.138 1.00 . A A . 10 TYR CG 1 1 2 737 1 1 10 TYR CZ C 1.119 7.453 -6.759 1.00 . A A . 10 TYR CZ 1 1 2 738 1 1 10 TYR H H 2.709 4.884 -3.284 1.00 . A A . 10 TYR H 1 1 2 739 1 1 10 TYR HA H 2.777 6.633 -0.954 1.00 . A A . 10 TYR HA 1 1 2 740 1 1 10 TYR HB2 H 1.868 8.650 -2.187 1.00 . A A . 10 TYR HB2 1 1 2 741 1 1 10 TYR HB3 H 3.502 8.255 -2.688 1.00 . A A . 10 TYR HB3 1 1 2 742 1 1 10 TYR HD1 H 3.920 7.228 -4.903 1.00 . A A . 10 TYR HD1 1 1 2 743 1 1 10 TYR HD2 H -0.036 8.243 -3.695 1.00 . A A . 10 TYR HD2 1 1 2 744 1 1 10 TYR HE1 H 3.145 6.963 -7.211 1.00 . A A . 10 TYR HE1 1 1 2 745 1 1 10 TYR HE2 H -0.805 7.981 -6.001 1.00 . A A . 10 TYR HE2 1 1 2 746 1 1 10 TYR HH H 0.176 6.489 -8.109 1.00 . A A . 10 TYR HH 1 1 2 747 1 1 10 TYR N N 3.173 5.528 -2.709 1.00 . A A . 10 TYR N 1 1 2 748 1 1 10 TYR O O 0.468 5.174 -2.472 1.00 . A A . 10 TYR O 1 1 2 749 1 1 10 TYR OH O 0.684 7.302 -8.059 1.00 . A A . 10 TYR OH 1 1 2 750 1 1 11 GLU C C -2.086 7.302 -1.915 1.00 . A A . 11 GLU C 1 1 2 751 1 1 11 GLU CA C -1.273 6.596 -0.822 1.00 . A A . 11 GLU CA 1 1 2 752 1 1 11 GLU CB C -1.666 7.127 0.575 1.00 . A A . 11 GLU CB 1 1 2 753 1 1 11 GLU CD C -3.948 8.246 0.482 1.00 . A A . 11 GLU CD 1 1 2 754 1 1 11 GLU CG C -3.191 6.947 0.832 1.00 . A A . 11 GLU CG 1 1 2 755 1 1 11 GLU H H 0.604 7.615 -0.574 1.00 . A A . 11 GLU H 1 1 2 756 1 1 11 GLU HA H -1.450 5.532 -0.868 1.00 . A A . 11 GLU HA 1 1 2 757 1 1 11 GLU HB2 H -1.116 6.575 1.324 1.00 . A A . 11 GLU HB2 1 1 2 758 1 1 11 GLU HB3 H -1.389 8.169 0.657 1.00 . A A . 11 GLU HB3 1 1 2 759 1 1 11 GLU HG2 H -3.585 6.132 0.242 1.00 . A A . 11 GLU HG2 1 1 2 760 1 1 11 GLU HG3 H -3.358 6.720 1.875 1.00 . A A . 11 GLU HG3 1 1 2 761 1 1 11 GLU N N 0.179 6.866 -1.042 1.00 . A A . 11 GLU N 1 1 2 762 1 1 11 GLU O O -2.029 8.510 -2.043 1.00 . A A . 11 GLU O 1 1 2 763 1 1 11 GLU OE1 O -3.833 9.171 1.271 1.00 . A A . 11 GLU OE1 1 1 2 764 1 1 11 GLU OE2 O -4.600 8.247 -0.551 1.00 . A A . 11 GLU OE2 1 1 2 765 1 1 12 VAL C C -5.110 6.783 -3.296 1.00 . A A . 12 VAL C 1 1 2 766 1 1 12 VAL CA C -3.665 7.030 -3.766 1.00 . A A . 12 VAL CA 1 1 2 767 1 1 12 VAL CB C -3.280 6.236 -5.080 1.00 . A A . 12 VAL CB 1 1 2 768 1 1 12 VAL CG1 C -2.596 4.894 -4.786 1.00 . A A . 12 VAL CG1 1 1 2 769 1 1 12 VAL CG2 C -4.477 5.900 -5.953 1.00 . A A . 12 VAL CG2 1 1 2 770 1 1 12 VAL H H -2.846 5.553 -2.549 1.00 . A A . 12 VAL H 1 1 2 771 1 1 12 VAL HA H -3.505 8.090 -3.900 1.00 . A A . 12 VAL HA 1 1 2 772 1 1 12 VAL HB H -2.604 6.845 -5.661 1.00 . A A . 12 VAL HB 1 1 2 773 1 1 12 VAL HG11 H -1.821 4.989 -4.046 1.00 . A A . 12 VAL HG11 1 1 2 774 1 1 12 VAL HG12 H -3.340 4.191 -4.444 1.00 . A A . 12 VAL HG12 1 1 2 775 1 1 12 VAL HG13 H -2.159 4.523 -5.696 1.00 . A A . 12 VAL HG13 1 1 2 776 1 1 12 VAL HG21 H -5.039 6.785 -6.187 1.00 . A A . 12 VAL HG21 1 1 2 777 1 1 12 VAL HG22 H -4.125 5.450 -6.864 1.00 . A A . 12 VAL HG22 1 1 2 778 1 1 12 VAL HG23 H -5.098 5.188 -5.433 1.00 . A A . 12 VAL HG23 1 1 2 779 1 1 12 VAL N N -2.817 6.520 -2.667 1.00 . A A . 12 VAL N 1 1 2 780 1 1 12 VAL O O -5.357 6.148 -2.287 1.00 . A A . 12 VAL O 1 1 2 781 1 1 13 HIS C C -8.039 5.832 -4.297 1.00 . A A . 13 HIS C 1 1 2 782 1 1 13 HIS CA C -7.479 7.171 -3.782 1.00 . A A . 13 HIS CA 1 1 2 783 1 1 13 HIS CB C -8.193 8.366 -4.447 1.00 . A A . 13 HIS CB 1 1 2 784 1 1 13 HIS CD2 C -6.548 10.211 -3.475 1.00 . A A . 13 HIS CD2 1 1 2 785 1 1 13 HIS CE1 C -7.968 11.445 -2.603 1.00 . A A . 13 HIS CE1 1 1 2 786 1 1 13 HIS CG C -7.794 9.649 -3.706 1.00 . A A . 13 HIS CG 1 1 2 787 1 1 13 HIS H H -5.690 7.773 -4.862 1.00 . A A . 13 HIS H 1 1 2 788 1 1 13 HIS HA H -7.626 7.218 -2.713 1.00 . A A . 13 HIS HA 1 1 2 789 1 1 13 HIS HB2 H -7.905 8.455 -5.486 1.00 . A A . 13 HIS HB2 1 1 2 790 1 1 13 HIS HB3 H -9.265 8.252 -4.384 1.00 . A A . 13 HIS HB3 1 1 2 791 1 1 13 HIS HD1 H -9.594 10.355 -3.122 1.00 . A A . 13 HIS HD1 1 1 2 792 1 1 13 HIS HD2 H -5.610 9.793 -3.807 1.00 . A A . 13 HIS HD2 1 1 2 793 1 1 13 HIS HE1 H -8.432 12.261 -2.068 1.00 . A A . 13 HIS HE1 1 1 2 794 1 1 13 HIS N N -6.015 7.300 -4.072 1.00 . A A . 13 HIS N 1 1 2 795 1 1 13 HIS ND1 N -8.621 10.464 -3.141 1.00 . A A . 13 HIS ND1 1 1 2 796 1 1 13 HIS NE2 N -6.676 11.328 -2.787 1.00 . A A . 13 HIS NE2 1 1 2 797 1 1 13 HIS O O -9.204 5.719 -4.628 1.00 . A A . 13 HIS O 1 1 2 798 1 1 14 HIS C C -6.593 2.505 -4.083 1.00 . A A . 14 HIS C 1 1 2 799 1 1 14 HIS CA C -7.518 3.480 -4.810 1.00 . A A . 14 HIS CA 1 1 2 800 1 1 14 HIS CB C -7.292 3.357 -6.328 1.00 . A A . 14 HIS CB 1 1 2 801 1 1 14 HIS CD2 C -7.862 5.521 -7.631 1.00 . A A . 14 HIS CD2 1 1 2 802 1 1 14 HIS CE1 C -9.896 5.258 -7.896 1.00 . A A . 14 HIS CE1 1 1 2 803 1 1 14 HIS CG C -8.201 4.335 -7.049 1.00 . A A . 14 HIS CG 1 1 2 804 1 1 14 HIS H H -6.250 5.026 -4.049 1.00 . A A . 14 HIS H 1 1 2 805 1 1 14 HIS HA H -8.547 3.269 -4.571 1.00 . A A . 14 HIS HA 1 1 2 806 1 1 14 HIS HB2 H -6.266 3.585 -6.579 1.00 . A A . 14 HIS HB2 1 1 2 807 1 1 14 HIS HB3 H -7.516 2.375 -6.694 1.00 . A A . 14 HIS HB3 1 1 2 808 1 1 14 HIS HD1 H -10.028 3.472 -6.944 1.00 . A A . 14 HIS HD1 1 1 2 809 1 1 14 HIS HD2 H -6.855 5.887 -7.629 1.00 . A A . 14 HIS HD2 1 1 2 810 1 1 14 HIS HE1 H -10.924 5.411 -8.187 1.00 . A A . 14 HIS HE1 1 1 2 811 1 1 14 HIS N N -7.169 4.854 -4.340 1.00 . A A . 14 HIS N 1 1 2 812 1 1 14 HIS ND1 N -9.472 4.222 -7.242 1.00 . A A . 14 HIS ND1 1 1 2 813 1 1 14 HIS NE2 N -8.923 6.097 -8.160 1.00 . A A . 14 HIS NE2 1 1 2 814 1 1 14 HIS O O -5.409 2.460 -4.359 1.00 . A A . 14 HIS O 1 1 2 815 1 1 15 GLN C C -5.580 -0.217 -3.368 1.00 . A A . 15 GLN C 1 1 2 816 1 1 15 GLN CA C -6.304 0.755 -2.412 1.00 . A A . 15 GLN CA 1 1 2 817 1 1 15 GLN CB C -7.220 -0.044 -1.440 1.00 . A A . 15 GLN CB 1 1 2 818 1 1 15 GLN CD C -5.544 -0.600 0.374 1.00 . A A . 15 GLN CD 1 1 2 819 1 1 15 GLN CG C -6.798 0.217 0.028 1.00 . A A . 15 GLN CG 1 1 2 820 1 1 15 GLN H H -8.100 1.814 -2.985 1.00 . A A . 15 GLN H 1 1 2 821 1 1 15 GLN HA H -5.562 1.309 -1.858 1.00 . A A . 15 GLN HA 1 1 2 822 1 1 15 GLN HB2 H -8.248 0.265 -1.567 1.00 . A A . 15 GLN HB2 1 1 2 823 1 1 15 GLN HB3 H -7.164 -1.103 -1.646 1.00 . A A . 15 GLN HB3 1 1 2 824 1 1 15 GLN HE21 H -6.422 -1.568 1.871 1.00 . A A . 15 GLN HE21 1 1 2 825 1 1 15 GLN HE22 H -4.801 -1.980 1.589 1.00 . A A . 15 GLN HE22 1 1 2 826 1 1 15 GLN HG2 H -6.585 1.265 0.186 1.00 . A A . 15 GLN HG2 1 1 2 827 1 1 15 GLN HG3 H -7.598 -0.075 0.693 1.00 . A A . 15 GLN HG3 1 1 2 828 1 1 15 GLN N N -7.141 1.742 -3.171 1.00 . A A . 15 GLN N 1 1 2 829 1 1 15 GLN NE2 N -5.594 -1.453 1.360 1.00 . A A . 15 GLN NE2 1 1 2 830 1 1 15 GLN O O -4.654 -0.903 -2.983 1.00 . A A . 15 GLN O 1 1 2 831 1 1 15 GLN OE1 O -4.506 -0.472 -0.244 1.00 . A A . 15 GLN OE1 1 1 2 832 1 1 16 LYS C C -4.085 -0.510 -6.032 1.00 . A A . 16 LYS C 1 1 2 833 1 1 16 LYS CA C -5.430 -1.108 -5.637 1.00 . A A . 16 LYS CA 1 1 2 834 1 1 16 LYS CB C -6.422 -1.159 -6.835 1.00 . A A . 16 LYS CB 1 1 2 835 1 1 16 LYS CD C -5.213 -3.177 -7.682 1.00 . A A . 16 LYS CD 1 1 2 836 1 1 16 LYS CE C -5.363 -4.378 -8.631 1.00 . A A . 16 LYS CE 1 1 2 837 1 1 16 LYS CG C -6.597 -2.607 -7.324 1.00 . A A . 16 LYS CG 1 1 2 838 1 1 16 LYS H H -6.743 0.370 -4.872 1.00 . A A . 16 LYS H 1 1 2 839 1 1 16 LYS HA H -5.271 -2.082 -5.208 1.00 . A A . 16 LYS HA 1 1 2 840 1 1 16 LYS HB2 H -7.386 -0.781 -6.527 1.00 . A A . 16 LYS HB2 1 1 2 841 1 1 16 LYS HB3 H -6.070 -0.545 -7.651 1.00 . A A . 16 LYS HB3 1 1 2 842 1 1 16 LYS HD2 H -4.621 -2.399 -8.145 1.00 . A A . 16 LYS HD2 1 1 2 843 1 1 16 LYS HD3 H -4.724 -3.483 -6.769 1.00 . A A . 16 LYS HD3 1 1 2 844 1 1 16 LYS HE2 H -4.410 -4.871 -8.756 1.00 . A A . 16 LYS HE2 1 1 2 845 1 1 16 LYS HE3 H -6.074 -5.088 -8.235 1.00 . A A . 16 LYS HE3 1 1 2 846 1 1 16 LYS HG2 H -7.053 -3.204 -6.547 1.00 . A A . 16 LYS HG2 1 1 2 847 1 1 16 LYS HG3 H -7.246 -2.613 -8.188 1.00 . A A . 16 LYS HG3 1 1 2 848 1 1 16 LYS HZ1 H -5.961 -2.887 -9.959 1.00 . A A . 16 LYS HZ1 1 1 2 849 1 1 16 LYS HZ2 H -5.138 -4.178 -10.693 1.00 . A A . 16 LYS HZ2 1 1 2 850 1 1 16 LYS HZ3 H -6.747 -4.374 -10.187 1.00 . A A . 16 LYS HZ3 1 1 2 851 1 1 16 LYS N N -6.019 -0.225 -4.602 1.00 . A A . 16 LYS N 1 1 2 852 1 1 16 LYS NZ N -5.838 -3.919 -9.969 1.00 . A A . 16 LYS NZ 1 1 2 853 1 1 16 LYS O O -3.047 -1.137 -5.937 1.00 . A A . 16 LYS O 1 1 2 854 1 1 17 LEU C C -1.985 1.493 -5.671 1.00 . A A . 17 LEU C 1 1 2 855 1 1 17 LEU CA C -2.928 1.444 -6.884 1.00 . A A . 17 LEU CA 1 1 2 856 1 1 17 LEU CB C -3.313 2.868 -7.344 1.00 . A A . 17 LEU CB 1 1 2 857 1 1 17 LEU CD1 C -3.773 4.065 -9.546 1.00 . A A . 17 LEU CD1 1 1 2 858 1 1 17 LEU CD2 C -4.253 1.606 -9.434 1.00 . A A . 17 LEU CD2 1 1 2 859 1 1 17 LEU CG C -4.239 2.917 -8.620 1.00 . A A . 17 LEU CG 1 1 2 860 1 1 17 LEU H H -5.034 1.160 -6.507 1.00 . A A . 17 LEU H 1 1 2 861 1 1 17 LEU HA H -2.442 0.889 -7.673 1.00 . A A . 17 LEU HA 1 1 2 862 1 1 17 LEU HB2 H -3.843 3.339 -6.532 1.00 . A A . 17 LEU HB2 1 1 2 863 1 1 17 LEU HB3 H -2.406 3.424 -7.530 1.00 . A A . 17 LEU HB3 1 1 2 864 1 1 17 LEU HD11 H -3.814 5.009 -9.024 1.00 . A A . 17 LEU HD11 1 1 2 865 1 1 17 LEU HD12 H -2.759 3.895 -9.877 1.00 . A A . 17 LEU HD12 1 1 2 866 1 1 17 LEU HD13 H -4.415 4.125 -10.413 1.00 . A A . 17 LEU HD13 1 1 2 867 1 1 17 LEU HD21 H -3.249 1.316 -9.706 1.00 . A A . 17 LEU HD21 1 1 2 868 1 1 17 LEU HD22 H -4.710 0.815 -8.861 1.00 . A A . 17 LEU HD22 1 1 2 869 1 1 17 LEU HD23 H -4.832 1.747 -10.335 1.00 . A A . 17 LEU HD23 1 1 2 870 1 1 17 LEU HG H -5.252 3.128 -8.314 1.00 . A A . 17 LEU HG 1 1 2 871 1 1 17 LEU N N -4.160 0.721 -6.464 1.00 . A A . 17 LEU N 1 1 2 872 1 1 17 LEU O O -0.791 1.371 -5.827 1.00 . A A . 17 LEU O 1 1 2 873 1 1 18 VAL C C -0.840 0.463 -3.163 1.00 . A A . 18 VAL C 1 1 2 874 1 1 18 VAL CA C -1.733 1.720 -3.239 1.00 . A A . 18 VAL CA 1 1 2 875 1 1 18 VAL CB C -2.722 1.788 -2.035 1.00 . A A . 18 VAL CB 1 1 2 876 1 1 18 VAL CG1 C -2.038 1.372 -0.727 1.00 . A A . 18 VAL CG1 1 1 2 877 1 1 18 VAL CG2 C -3.277 3.215 -1.866 1.00 . A A . 18 VAL CG2 1 1 2 878 1 1 18 VAL H H -3.510 1.766 -4.431 1.00 . A A . 18 VAL H 1 1 2 879 1 1 18 VAL HA H -1.104 2.600 -3.268 1.00 . A A . 18 VAL HA 1 1 2 880 1 1 18 VAL HB H -3.537 1.111 -2.220 1.00 . A A . 18 VAL HB 1 1 2 881 1 1 18 VAL HG11 H -1.035 1.771 -0.682 1.00 . A A . 18 VAL HG11 1 1 2 882 1 1 18 VAL HG12 H -2.601 1.727 0.122 1.00 . A A . 18 VAL HG12 1 1 2 883 1 1 18 VAL HG13 H -2.001 0.295 -0.686 1.00 . A A . 18 VAL HG13 1 1 2 884 1 1 18 VAL HG21 H -2.465 3.925 -1.893 1.00 . A A . 18 VAL HG21 1 1 2 885 1 1 18 VAL HG22 H -3.978 3.444 -2.652 1.00 . A A . 18 VAL HG22 1 1 2 886 1 1 18 VAL HG23 H -3.790 3.313 -0.922 1.00 . A A . 18 VAL HG23 1 1 2 887 1 1 18 VAL N N -2.542 1.664 -4.497 1.00 . A A . 18 VAL N 1 1 2 888 1 1 18 VAL O O 0.359 0.566 -3.004 1.00 . A A . 18 VAL O 1 1 2 889 1 1 19 PHE C C 0.444 -1.972 -4.251 1.00 . A A . 19 PHE C 1 1 2 890 1 1 19 PHE CA C -0.695 -1.978 -3.231 1.00 . A A . 19 PHE CA 1 1 2 891 1 1 19 PHE CB C -1.643 -3.159 -3.538 1.00 . A A . 19 PHE CB 1 1 2 892 1 1 19 PHE CD1 C -2.444 -3.200 -1.100 1.00 . A A . 19 PHE CD1 1 1 2 893 1 1 19 PHE CD2 C -4.010 -3.686 -2.831 1.00 . A A . 19 PHE CD2 1 1 2 894 1 1 19 PHE CE1 C -3.432 -3.385 -0.156 1.00 . A A . 19 PHE CE1 1 1 2 895 1 1 19 PHE CE2 C -4.998 -3.872 -1.886 1.00 . A A . 19 PHE CE2 1 1 2 896 1 1 19 PHE CG C -2.722 -3.349 -2.452 1.00 . A A . 19 PHE CG 1 1 2 897 1 1 19 PHE CZ C -4.709 -3.721 -0.548 1.00 . A A . 19 PHE CZ 1 1 2 898 1 1 19 PHE H H -2.421 -0.700 -3.421 1.00 . A A . 19 PHE H 1 1 2 899 1 1 19 PHE HA H -0.259 -2.085 -2.256 1.00 . A A . 19 PHE HA 1 1 2 900 1 1 19 PHE HB2 H -2.131 -2.994 -4.487 1.00 . A A . 19 PHE HB2 1 1 2 901 1 1 19 PHE HB3 H -1.070 -4.073 -3.605 1.00 . A A . 19 PHE HB3 1 1 2 902 1 1 19 PHE HD1 H -1.449 -2.939 -0.772 1.00 . A A . 19 PHE HD1 1 1 2 903 1 1 19 PHE HD2 H -4.248 -3.806 -3.878 1.00 . A A . 19 PHE HD2 1 1 2 904 1 1 19 PHE HE1 H -3.203 -3.267 0.893 1.00 . A A . 19 PHE HE1 1 1 2 905 1 1 19 PHE HE2 H -5.998 -4.135 -2.196 1.00 . A A . 19 PHE HE2 1 1 2 906 1 1 19 PHE HZ H -5.481 -3.867 0.192 1.00 . A A . 19 PHE HZ 1 1 2 907 1 1 19 PHE N N -1.455 -0.687 -3.288 1.00 . A A . 19 PHE N 1 1 2 908 1 1 19 PHE O O 1.579 -2.276 -3.931 1.00 . A A . 19 PHE O 1 1 2 909 1 1 20 PHE C C 2.277 -0.649 -6.113 1.00 . A A . 20 PHE C 1 1 2 910 1 1 20 PHE CA C 1.114 -1.565 -6.550 1.00 . A A . 20 PHE CA 1 1 2 911 1 1 20 PHE CB C 0.380 -1.052 -7.831 1.00 . A A . 20 PHE CB 1 1 2 912 1 1 20 PHE CD1 C 2.270 -0.535 -9.438 1.00 . A A . 20 PHE CD1 1 1 2 913 1 1 20 PHE CD2 C 0.991 1.288 -8.591 1.00 . A A . 20 PHE CD2 1 1 2 914 1 1 20 PHE CE1 C 3.041 0.346 -10.164 1.00 . A A . 20 PHE CE1 1 1 2 915 1 1 20 PHE CE2 C 1.759 2.169 -9.315 1.00 . A A . 20 PHE CE2 1 1 2 916 1 1 20 PHE CG C 1.238 -0.071 -8.646 1.00 . A A . 20 PHE CG 1 1 2 917 1 1 20 PHE CZ C 2.788 1.700 -10.104 1.00 . A A . 20 PHE CZ 1 1 2 918 1 1 20 PHE H H -0.835 -1.375 -5.641 1.00 . A A . 20 PHE H 1 1 2 919 1 1 20 PHE HA H 1.494 -2.563 -6.714 1.00 . A A . 20 PHE HA 1 1 2 920 1 1 20 PHE HB2 H 0.140 -1.895 -8.461 1.00 . A A . 20 PHE HB2 1 1 2 921 1 1 20 PHE HB3 H -0.545 -0.562 -7.563 1.00 . A A . 20 PHE HB3 1 1 2 922 1 1 20 PHE HD1 H 2.478 -1.595 -9.491 1.00 . A A . 20 PHE HD1 1 1 2 923 1 1 20 PHE HD2 H 0.188 1.666 -7.979 1.00 . A A . 20 PHE HD2 1 1 2 924 1 1 20 PHE HE1 H 3.843 -0.034 -10.777 1.00 . A A . 20 PHE HE1 1 1 2 925 1 1 20 PHE HE2 H 1.548 3.226 -9.257 1.00 . A A . 20 PHE HE2 1 1 2 926 1 1 20 PHE HZ H 3.391 2.392 -10.674 1.00 . A A . 20 PHE HZ 1 1 2 927 1 1 20 PHE N N 0.098 -1.613 -5.459 1.00 . A A . 20 PHE N 1 1 2 928 1 1 20 PHE O O 3.421 -1.053 -6.100 1.00 . A A . 20 PHE O 1 1 2 929 1 1 21 ALA C C 3.838 1.021 -4.208 1.00 . A A . 21 ALA C 1 1 2 930 1 1 21 ALA CA C 2.934 1.575 -5.305 1.00 . A A . 21 ALA CA 1 1 2 931 1 1 21 ALA CB C 2.169 2.811 -4.803 1.00 . A A . 21 ALA CB 1 1 2 932 1 1 21 ALA H H 0.984 0.802 -5.773 1.00 . A A . 21 ALA H 1 1 2 933 1 1 21 ALA HA H 3.567 1.825 -6.148 1.00 . A A . 21 ALA HA 1 1 2 934 1 1 21 ALA HB1 H 1.328 3.019 -5.450 1.00 . A A . 21 ALA HB1 1 1 2 935 1 1 21 ALA HB2 H 1.801 2.649 -3.799 1.00 . A A . 21 ALA HB2 1 1 2 936 1 1 21 ALA HB3 H 2.814 3.674 -4.798 1.00 . A A . 21 ALA HB3 1 1 2 937 1 1 21 ALA N N 1.930 0.559 -5.753 1.00 . A A . 21 ALA N 1 1 2 938 1 1 21 ALA O O 5.033 1.193 -4.263 1.00 . A A . 21 ALA O 1 1 2 939 1 1 22 GLU C C 5.122 -1.170 -2.687 1.00 . A A . 22 GLU C 1 1 2 940 1 1 22 GLU CA C 4.066 -0.214 -2.120 1.00 . A A . 22 GLU CA 1 1 2 941 1 1 22 GLU CB C 3.131 -0.971 -1.166 1.00 . A A . 22 GLU CB 1 1 2 942 1 1 22 GLU CD C 1.214 -0.705 0.411 1.00 . A A . 22 GLU CD 1 1 2 943 1 1 22 GLU CG C 2.366 0.035 -0.288 1.00 . A A . 22 GLU CG 1 1 2 944 1 1 22 GLU H H 2.289 0.276 -3.251 1.00 . A A . 22 GLU H 1 1 2 945 1 1 22 GLU HA H 4.580 0.591 -1.615 1.00 . A A . 22 GLU HA 1 1 2 946 1 1 22 GLU HB2 H 2.436 -1.570 -1.735 1.00 . A A . 22 GLU HB2 1 1 2 947 1 1 22 GLU HB3 H 3.709 -1.628 -0.532 1.00 . A A . 22 GLU HB3 1 1 2 948 1 1 22 GLU HG2 H 3.029 0.453 0.455 1.00 . A A . 22 GLU HG2 1 1 2 949 1 1 22 GLU HG3 H 1.961 0.841 -0.884 1.00 . A A . 22 GLU HG3 1 1 2 950 1 1 22 GLU N N 3.259 0.369 -3.238 1.00 . A A . 22 GLU N 1 1 2 951 1 1 22 GLU O O 6.289 -1.042 -2.379 1.00 . A A . 22 GLU O 1 1 2 952 1 1 22 GLU OE1 O 0.168 -0.784 -0.211 1.00 . A A . 22 GLU OE1 1 1 2 953 1 1 22 GLU OE2 O 1.443 -1.150 1.524 1.00 . A A . 22 GLU OE2 1 1 2 954 1 1 23 ASP C C 6.770 -2.363 -4.785 1.00 . A A . 23 ASP C 1 1 2 955 1 1 23 ASP CA C 5.594 -3.097 -4.131 1.00 . A A . 23 ASP CA 1 1 2 956 1 1 23 ASP CB C 4.825 -3.883 -5.202 1.00 . A A . 23 ASP CB 1 1 2 957 1 1 23 ASP CG C 5.608 -5.158 -5.555 1.00 . A A . 23 ASP CG 1 1 2 958 1 1 23 ASP H H 3.714 -2.131 -3.695 1.00 . A A . 23 ASP H 1 1 2 959 1 1 23 ASP HA H 5.971 -3.755 -3.364 1.00 . A A . 23 ASP HA 1 1 2 960 1 1 23 ASP HB2 H 3.835 -4.138 -4.858 1.00 . A A . 23 ASP HB2 1 1 2 961 1 1 23 ASP HB3 H 4.711 -3.285 -6.092 1.00 . A A . 23 ASP HB3 1 1 2 962 1 1 23 ASP N N 4.672 -2.096 -3.500 1.00 . A A . 23 ASP N 1 1 2 963 1 1 23 ASP O O 7.932 -2.638 -4.559 1.00 . A A . 23 ASP O 1 1 2 964 1 1 23 ASP OD1 O 6.513 -5.029 -6.366 1.00 . A A . 23 ASP OD1 1 1 2 965 1 1 23 ASP OD2 O 5.263 -6.186 -4.995 1.00 . A A . 23 ASP OD2 1 1 2 966 1 1 24 VAL C C 8.336 0.108 -5.403 1.00 . A A . 24 VAL C 1 1 2 967 1 1 24 VAL CA C 7.330 -0.565 -6.348 1.00 . A A . 24 VAL CA 1 1 2 968 1 1 24 VAL CB C 6.473 0.458 -7.102 1.00 . A A . 24 VAL CB 1 1 2 969 1 1 24 VAL CG1 C 7.343 1.340 -7.965 1.00 . A A . 24 VAL CG1 1 1 2 970 1 1 24 VAL CG2 C 5.431 -0.267 -7.982 1.00 . A A . 24 VAL CG2 1 1 2 971 1 1 24 VAL H H 5.419 -1.273 -5.705 1.00 . A A . 24 VAL H 1 1 2 972 1 1 24 VAL HA H 7.871 -1.187 -7.042 1.00 . A A . 24 VAL HA 1 1 2 973 1 1 24 VAL HB H 5.952 1.085 -6.399 1.00 . A A . 24 VAL HB 1 1 2 974 1 1 24 VAL HG11 H 7.973 0.743 -8.602 1.00 . A A . 24 VAL HG11 1 1 2 975 1 1 24 VAL HG12 H 6.695 1.952 -8.566 1.00 . A A . 24 VAL HG12 1 1 2 976 1 1 24 VAL HG13 H 7.950 1.970 -7.333 1.00 . A A . 24 VAL HG13 1 1 2 977 1 1 24 VAL HG21 H 5.308 -1.299 -7.681 1.00 . A A . 24 VAL HG21 1 1 2 978 1 1 24 VAL HG22 H 4.482 0.233 -7.871 1.00 . A A . 24 VAL HG22 1 1 2 979 1 1 24 VAL HG23 H 5.716 -0.254 -9.019 1.00 . A A . 24 VAL HG23 1 1 2 980 1 1 24 VAL N N 6.379 -1.421 -5.591 1.00 . A A . 24 VAL N 1 1 2 981 1 1 24 VAL O O 9.532 0.050 -5.605 1.00 . A A . 24 VAL O 1 1 2 982 1 1 25 GLY C C 9.652 0.511 -2.743 1.00 . A A . 25 GLY C 1 1 2 983 1 1 25 GLY CA C 8.607 1.439 -3.364 1.00 . A A . 25 GLY CA 1 1 2 984 1 1 25 GLY H H 6.822 0.712 -4.310 1.00 . A A . 25 GLY H 1 1 2 985 1 1 25 GLY HA2 H 9.104 2.277 -3.833 1.00 . A A . 25 GLY HA2 1 1 2 986 1 1 25 GLY HA3 H 7.950 1.803 -2.588 1.00 . A A . 25 GLY HA3 1 1 2 987 1 1 25 GLY N N 7.794 0.724 -4.390 1.00 . A A . 25 GLY N 1 1 2 988 1 1 25 GLY O O 10.830 0.800 -2.783 1.00 . A A . 25 GLY O 1 1 2 989 1 1 26 SER C C 11.240 -1.949 -2.550 1.00 . A A . 26 SER C 1 1 2 990 1 1 26 SER CA C 10.138 -1.564 -1.556 1.00 . A A . 26 SER CA 1 1 2 991 1 1 26 SER CB C 9.366 -2.840 -1.105 1.00 . A A . 26 SER CB 1 1 2 992 1 1 26 SER H H 8.230 -0.755 -2.212 1.00 . A A . 26 SER H 1 1 2 993 1 1 26 SER HA H 10.595 -1.090 -0.706 1.00 . A A . 26 SER HA 1 1 2 994 1 1 26 SER HB2 H 9.995 -3.717 -1.123 1.00 . A A . 26 SER HB2 1 1 2 995 1 1 26 SER HB3 H 8.957 -2.707 -0.115 1.00 . A A . 26 SER HB3 1 1 2 996 1 1 26 SER HG H 8.423 -3.848 -2.479 1.00 . A A . 26 SER HG 1 1 2 997 1 1 26 SER N N 9.193 -0.586 -2.194 1.00 . A A . 26 SER N 1 1 2 998 1 1 26 SER O O 12.410 -1.937 -2.220 1.00 . A A . 26 SER O 1 1 2 999 1 1 26 SER OG O 8.299 -3.011 -2.025 1.00 . A A . 26 SER OG 1 1 2 1000 1 1 27 ASN C C 12.870 -1.592 -4.991 1.00 . A A . 27 ASN C 1 1 2 1001 1 1 27 ASN CA C 11.797 -2.665 -4.818 1.00 . A A . 27 ASN CA 1 1 2 1002 1 1 27 ASN CB C 11.023 -2.847 -6.132 1.00 . A A . 27 ASN CB 1 1 2 1003 1 1 27 ASN CG C 10.625 -4.315 -6.321 1.00 . A A . 27 ASN CG 1 1 2 1004 1 1 27 ASN H H 9.876 -2.272 -3.951 1.00 . A A . 27 ASN H 1 1 2 1005 1 1 27 ASN HA H 12.300 -3.564 -4.499 1.00 . A A . 27 ASN HA 1 1 2 1006 1 1 27 ASN HB2 H 10.130 -2.241 -6.118 1.00 . A A . 27 ASN HB2 1 1 2 1007 1 1 27 ASN HB3 H 11.628 -2.528 -6.965 1.00 . A A . 27 ASN HB3 1 1 2 1008 1 1 27 ASN HD21 H 8.684 -3.957 -6.092 1.00 . A A . 27 ASN HD21 1 1 2 1009 1 1 27 ASN HD22 H 9.093 -5.577 -6.377 1.00 . A A . 27 ASN HD22 1 1 2 1010 1 1 27 ASN N N 10.831 -2.275 -3.748 1.00 . A A . 27 ASN N 1 1 2 1011 1 1 27 ASN ND2 N 9.364 -4.643 -6.258 1.00 . A A . 27 ASN ND2 1 1 2 1012 1 1 27 ASN O O 14.043 -1.854 -4.828 1.00 . A A . 27 ASN O 1 1 2 1013 1 1 27 ASN OD1 O 11.457 -5.176 -6.528 1.00 . A A . 27 ASN OD1 1 1 2 1014 1 1 28 LYS C C 14.284 0.873 -4.303 1.00 . A A . 28 LYS C 1 1 2 1015 1 1 28 LYS CA C 13.349 0.753 -5.520 1.00 . A A . 28 LYS CA 1 1 2 1016 1 1 28 LYS CB C 12.472 2.000 -5.692 1.00 . A A . 28 LYS CB 1 1 2 1017 1 1 28 LYS CD C 12.689 2.611 -8.149 1.00 . A A . 28 LYS CD 1 1 2 1018 1 1 28 LYS CE C 12.256 2.163 -9.560 1.00 . A A . 28 LYS CE 1 1 2 1019 1 1 28 LYS CG C 11.771 1.970 -7.077 1.00 . A A . 28 LYS CG 1 1 2 1020 1 1 28 LYS H H 11.466 -0.283 -5.427 1.00 . A A . 28 LYS H 1 1 2 1021 1 1 28 LYS HA H 13.961 0.579 -6.400 1.00 . A A . 28 LYS HA 1 1 2 1022 1 1 28 LYS HB2 H 11.713 1.996 -4.924 1.00 . A A . 28 LYS HB2 1 1 2 1023 1 1 28 LYS HB3 H 13.070 2.892 -5.587 1.00 . A A . 28 LYS HB3 1 1 2 1024 1 1 28 LYS HD2 H 12.627 3.688 -8.081 1.00 . A A . 28 LYS HD2 1 1 2 1025 1 1 28 LYS HD3 H 13.716 2.315 -7.987 1.00 . A A . 28 LYS HD3 1 1 2 1026 1 1 28 LYS HE2 H 12.878 2.644 -10.300 1.00 . A A . 28 LYS HE2 1 1 2 1027 1 1 28 LYS HE3 H 12.355 1.093 -9.664 1.00 . A A . 28 LYS HE3 1 1 2 1028 1 1 28 LYS HG2 H 11.530 0.953 -7.352 1.00 . A A . 28 LYS HG2 1 1 2 1029 1 1 28 LYS HG3 H 10.849 2.529 -7.016 1.00 . A A . 28 LYS HG3 1 1 2 1030 1 1 28 LYS HZ1 H 10.447 3.033 -8.990 1.00 . A A . 28 LYS HZ1 1 1 2 1031 1 1 28 LYS HZ2 H 10.793 3.173 -10.646 1.00 . A A . 28 LYS HZ2 1 1 2 1032 1 1 28 LYS HZ3 H 10.278 1.687 -10.010 1.00 . A A . 28 LYS HZ3 1 1 2 1033 1 1 28 LYS N N 12.428 -0.408 -5.316 1.00 . A A . 28 LYS N 1 1 2 1034 1 1 28 LYS NZ N 10.838 2.542 -9.820 1.00 . A A . 28 LYS NZ 1 1 2 1035 1 1 28 LYS O O 15.471 1.066 -4.457 1.00 . A A . 28 LYS O 1 1 2 1036 1 1 29 GLY C C 15.695 -0.183 -1.943 1.00 . A A . 29 GLY C 1 1 2 1037 1 1 29 GLY CA C 14.555 0.844 -1.878 1.00 . A A . 29 GLY CA 1 1 2 1038 1 1 29 GLY H H 12.769 0.606 -3.049 1.00 . A A . 29 GLY H 1 1 2 1039 1 1 29 GLY HA2 H 14.963 1.839 -1.787 1.00 . A A . 29 GLY HA2 1 1 2 1040 1 1 29 GLY HA3 H 13.929 0.630 -1.025 1.00 . A A . 29 GLY HA3 1 1 2 1041 1 1 29 GLY N N 13.731 0.752 -3.122 1.00 . A A . 29 GLY N 1 1 2 1042 1 1 29 GLY O O 16.853 0.164 -1.820 1.00 . A A . 29 GLY O 1 1 2 1043 1 1 30 ALA C C 17.392 -2.190 -3.326 1.00 . A A . 30 ALA C 1 1 2 1044 1 1 30 ALA CA C 16.365 -2.511 -2.232 1.00 . A A . 30 ALA CA 1 1 2 1045 1 1 30 ALA CB C 15.662 -3.842 -2.541 1.00 . A A . 30 ALA CB 1 1 2 1046 1 1 30 ALA H H 14.378 -1.642 -2.252 1.00 . A A . 30 ALA H 1 1 2 1047 1 1 30 ALA HA H 16.888 -2.556 -1.286 1.00 . A A . 30 ALA HA 1 1 2 1048 1 1 30 ALA HB1 H 14.905 -4.039 -1.798 1.00 . A A . 30 ALA HB1 1 1 2 1049 1 1 30 ALA HB2 H 15.193 -3.804 -3.513 1.00 . A A . 30 ALA HB2 1 1 2 1050 1 1 30 ALA HB3 H 16.379 -4.650 -2.531 1.00 . A A . 30 ALA HB3 1 1 2 1051 1 1 30 ALA N N 15.331 -1.426 -2.150 1.00 . A A . 30 ALA N 1 1 2 1052 1 1 30 ALA O O 18.580 -2.293 -3.119 1.00 . A A . 30 ALA O 1 1 2 1053 1 1 31 ILE C C 18.785 -0.419 -5.225 1.00 . A A . 31 ILE C 1 1 2 1054 1 1 31 ILE CA C 17.718 -1.442 -5.646 1.00 . A A . 31 ILE CA 1 1 2 1055 1 1 31 ILE CB C 16.689 -0.924 -6.698 1.00 . A A . 31 ILE CB 1 1 2 1056 1 1 31 ILE CD1 C 14.920 -1.744 -8.349 1.00 . A A . 31 ILE CD1 1 1 2 1057 1 1 31 ILE CG1 C 16.023 -2.160 -7.359 1.00 . A A . 31 ILE CG1 1 1 2 1058 1 1 31 ILE CG2 C 17.309 0.021 -7.742 1.00 . A A . 31 ILE CG2 1 1 2 1059 1 1 31 ILE H H 15.920 -1.752 -4.558 1.00 . A A . 31 ILE H 1 1 2 1060 1 1 31 ILE HA H 18.231 -2.333 -5.980 1.00 . A A . 31 ILE HA 1 1 2 1061 1 1 31 ILE HB H 15.917 -0.377 -6.186 1.00 . A A . 31 ILE HB 1 1 2 1062 1 1 31 ILE HD11 H 14.308 -0.957 -7.937 1.00 . A A . 31 ILE HD11 1 1 2 1063 1 1 31 ILE HD12 H 15.366 -1.396 -9.269 1.00 . A A . 31 ILE HD12 1 1 2 1064 1 1 31 ILE HD13 H 14.289 -2.594 -8.568 1.00 . A A . 31 ILE HD13 1 1 2 1065 1 1 31 ILE HG12 H 16.776 -2.748 -7.858 1.00 . A A . 31 ILE HG12 1 1 2 1066 1 1 31 ILE HG13 H 15.578 -2.778 -6.593 1.00 . A A . 31 ILE HG13 1 1 2 1067 1 1 31 ILE HG21 H 18.097 -0.475 -8.284 1.00 . A A . 31 ILE HG21 1 1 2 1068 1 1 31 ILE HG22 H 16.545 0.343 -8.436 1.00 . A A . 31 ILE HG22 1 1 2 1069 1 1 31 ILE HG23 H 17.702 0.899 -7.251 1.00 . A A . 31 ILE HG23 1 1 2 1070 1 1 31 ILE N N 16.888 -1.804 -4.464 1.00 . A A . 31 ILE N 1 1 2 1071 1 1 31 ILE O O 19.963 -0.625 -5.443 1.00 . A A . 31 ILE O 1 1 2 1072 1 1 32 ILE C C 20.337 1.085 -3.238 1.00 . A A . 32 ILE C 1 1 2 1073 1 1 32 ILE CA C 19.297 1.717 -4.172 1.00 . A A . 32 ILE CA 1 1 2 1074 1 1 32 ILE CB C 18.487 2.821 -3.440 1.00 . A A . 32 ILE CB 1 1 2 1075 1 1 32 ILE CD1 C 16.336 4.149 -3.690 1.00 . A A . 32 ILE CD1 1 1 2 1076 1 1 32 ILE CG1 C 17.486 3.455 -4.445 1.00 . A A . 32 ILE CG1 1 1 2 1077 1 1 32 ILE CG2 C 19.447 3.915 -2.910 1.00 . A A . 32 ILE CG2 1 1 2 1078 1 1 32 ILE H H 17.385 0.773 -4.491 1.00 . A A . 32 ILE H 1 1 2 1079 1 1 32 ILE HA H 19.814 2.107 -5.033 1.00 . A A . 32 ILE HA 1 1 2 1080 1 1 32 ILE HB H 17.953 2.382 -2.610 1.00 . A A . 32 ILE HB 1 1 2 1081 1 1 32 ILE HD11 H 15.937 3.499 -2.926 1.00 . A A . 32 ILE HD11 1 1 2 1082 1 1 32 ILE HD12 H 16.688 5.058 -3.227 1.00 . A A . 32 ILE HD12 1 1 2 1083 1 1 32 ILE HD13 H 15.543 4.396 -4.380 1.00 . A A . 32 ILE HD13 1 1 2 1084 1 1 32 ILE HG12 H 17.996 4.168 -5.070 1.00 . A A . 32 ILE HG12 1 1 2 1085 1 1 32 ILE HG13 H 17.070 2.698 -5.090 1.00 . A A . 32 ILE HG13 1 1 2 1086 1 1 32 ILE HG21 H 20.085 4.277 -3.703 1.00 . A A . 32 ILE HG21 1 1 2 1087 1 1 32 ILE HG22 H 18.885 4.746 -2.510 1.00 . A A . 32 ILE HG22 1 1 2 1088 1 1 32 ILE HG23 H 20.067 3.515 -2.121 1.00 . A A . 32 ILE HG23 1 1 2 1089 1 1 32 ILE N N 18.345 0.657 -4.630 1.00 . A A . 32 ILE N 1 1 2 1090 1 1 32 ILE O O 21.523 1.292 -3.401 1.00 . A A . 32 ILE O 1 1 2 1091 1 1 33 GLY C C 21.842 -1.149 -2.080 1.00 . A A . 33 GLY C 1 1 2 1092 1 1 33 GLY CA C 20.774 -0.352 -1.320 1.00 . A A . 33 GLY CA 1 1 2 1093 1 1 33 GLY H H 18.886 0.198 -2.217 1.00 . A A . 33 GLY H 1 1 2 1094 1 1 33 GLY HA2 H 21.255 0.397 -0.707 1.00 . A A . 33 GLY HA2 1 1 2 1095 1 1 33 GLY HA3 H 20.206 -1.023 -0.695 1.00 . A A . 33 GLY HA3 1 1 2 1096 1 1 33 GLY N N 19.855 0.322 -2.289 1.00 . A A . 33 GLY N 1 1 2 1097 1 1 33 GLY O O 23.017 -1.031 -1.801 1.00 . A A . 33 GLY O 1 1 2 1098 1 1 34 LEU C C 23.380 -1.864 -4.532 1.00 . A A . 34 LEU C 1 1 2 1099 1 1 34 LEU CA C 22.349 -2.758 -3.841 1.00 . A A . 34 LEU CA 1 1 2 1100 1 1 34 LEU CB C 21.551 -3.554 -4.898 1.00 . A A . 34 LEU CB 1 1 2 1101 1 1 34 LEU CD1 C 19.549 -5.079 -5.103 1.00 . A A . 34 LEU CD1 1 1 2 1102 1 1 34 LEU CD2 C 21.654 -5.922 -4.005 1.00 . A A . 34 LEU CD2 1 1 2 1103 1 1 34 LEU CG C 20.744 -4.689 -4.208 1.00 . A A . 34 LEU CG 1 1 2 1104 1 1 34 LEU H H 20.443 -1.985 -3.206 1.00 . A A . 34 LEU H 1 1 2 1105 1 1 34 LEU HA H 22.880 -3.417 -3.170 1.00 . A A . 34 LEU HA 1 1 2 1106 1 1 34 LEU HB2 H 20.878 -2.886 -5.413 1.00 . A A . 34 LEU HB2 1 1 2 1107 1 1 34 LEU HB3 H 22.229 -3.976 -5.626 1.00 . A A . 34 LEU HB3 1 1 2 1108 1 1 34 LEU HD11 H 19.873 -5.223 -6.125 1.00 . A A . 34 LEU HD11 1 1 2 1109 1 1 34 LEU HD12 H 19.097 -5.995 -4.749 1.00 . A A . 34 LEU HD12 1 1 2 1110 1 1 34 LEU HD13 H 18.802 -4.300 -5.081 1.00 . A A . 34 LEU HD13 1 1 2 1111 1 1 34 LEU HD21 H 22.056 -6.256 -4.949 1.00 . A A . 34 LEU HD21 1 1 2 1112 1 1 34 LEU HD22 H 22.474 -5.677 -3.345 1.00 . A A . 34 LEU HD22 1 1 2 1113 1 1 34 LEU HD23 H 21.089 -6.730 -3.564 1.00 . A A . 34 LEU HD23 1 1 2 1114 1 1 34 LEU HG H 20.372 -4.355 -3.250 1.00 . A A . 34 LEU HG 1 1 2 1115 1 1 34 LEU N N 21.402 -1.935 -3.030 1.00 . A A . 34 LEU N 1 1 2 1116 1 1 34 LEU O O 24.557 -2.153 -4.474 1.00 . A A . 34 LEU O 1 1 2 1117 1 1 35 MET C C 24.959 0.558 -4.889 1.00 . A A . 35 MET C 1 1 2 1118 1 1 35 MET CA C 23.856 0.122 -5.865 1.00 . A A . 35 MET CA 1 1 2 1119 1 1 35 MET CB C 23.069 1.355 -6.361 1.00 . A A . 35 MET CB 1 1 2 1120 1 1 35 MET CE C 23.653 2.262 -9.535 1.00 . A A . 35 MET CE 1 1 2 1121 1 1 35 MET CG C 22.219 0.974 -7.584 1.00 . A A . 35 MET CG 1 1 2 1122 1 1 35 MET H H 21.953 -0.644 -5.179 1.00 . A A . 35 MET H 1 1 2 1123 1 1 35 MET HA H 24.311 -0.398 -6.693 1.00 . A A . 35 MET HA 1 1 2 1124 1 1 35 MET HB2 H 22.424 1.726 -5.580 1.00 . A A . 35 MET HB2 1 1 2 1125 1 1 35 MET HB3 H 23.757 2.143 -6.634 1.00 . A A . 35 MET HB3 1 1 2 1126 1 1 35 MET HE1 H 22.833 2.957 -9.435 1.00 . A A . 35 MET HE1 1 1 2 1127 1 1 35 MET HE2 H 24.452 2.551 -8.868 1.00 . A A . 35 MET HE2 1 1 2 1128 1 1 35 MET HE3 H 24.015 2.278 -10.553 1.00 . A A . 35 MET HE3 1 1 2 1129 1 1 35 MET HG2 H 21.617 0.113 -7.332 1.00 . A A . 35 MET HG2 1 1 2 1130 1 1 35 MET HG3 H 21.541 1.790 -7.788 1.00 . A A . 35 MET HG3 1 1 2 1131 1 1 35 MET N N 22.918 -0.812 -5.164 1.00 . A A . 35 MET N 1 1 2 1132 1 1 35 MET O O 26.134 0.402 -5.163 1.00 . A A . 35 MET O 1 1 2 1133 1 1 35 MET SD S 23.094 0.589 -9.123 1.00 . A A . 35 MET SD 1 1 2 1134 1 1 36 VAL C C 26.419 0.466 -2.301 1.00 . A A . 36 VAL C 1 1 2 1135 1 1 36 VAL CA C 25.413 1.564 -2.692 1.00 . A A . 36 VAL CA 1 1 2 1136 1 1 36 VAL CB C 24.518 1.981 -1.481 1.00 . A A . 36 VAL CB 1 1 2 1137 1 1 36 VAL CG1 C 25.389 2.315 -0.246 1.00 . A A . 36 VAL CG1 1 1 2 1138 1 1 36 VAL CG2 C 23.695 3.234 -1.860 1.00 . A A . 36 VAL CG2 1 1 2 1139 1 1 36 VAL H H 23.539 1.135 -3.657 1.00 . A A . 36 VAL H 1 1 2 1140 1 1 36 VAL HA H 25.958 2.420 -3.063 1.00 . A A . 36 VAL HA 1 1 2 1141 1 1 36 VAL HB H 23.833 1.182 -1.230 1.00 . A A . 36 VAL HB 1 1 2 1142 1 1 36 VAL HG11 H 26.185 2.992 -0.517 1.00 . A A . 36 VAL HG11 1 1 2 1143 1 1 36 VAL HG12 H 24.785 2.778 0.521 1.00 . A A . 36 VAL HG12 1 1 2 1144 1 1 36 VAL HG13 H 25.821 1.412 0.159 1.00 . A A . 36 VAL HG13 1 1 2 1145 1 1 36 VAL HG21 H 23.217 3.100 -2.819 1.00 . A A . 36 VAL HG21 1 1 2 1146 1 1 36 VAL HG22 H 22.930 3.411 -1.118 1.00 . A A . 36 VAL HG22 1 1 2 1147 1 1 36 VAL HG23 H 24.333 4.104 -1.913 1.00 . A A . 36 VAL HG23 1 1 2 1148 1 1 36 VAL N N 24.507 1.075 -3.776 1.00 . A A . 36 VAL N 1 1 2 1149 1 1 36 VAL O O 27.614 0.696 -2.307 1.00 . A A . 36 VAL O 1 1 2 1150 1 1 37 GLY C C 26.722 -2.919 -2.672 1.00 . A A . 37 GLY C 1 1 2 1151 1 1 37 GLY CA C 26.747 -1.851 -1.576 1.00 . A A . 37 GLY CA 1 1 2 1152 1 1 37 GLY H H 24.922 -0.796 -1.999 1.00 . A A . 37 GLY H 1 1 2 1153 1 1 37 GLY HA2 H 27.767 -1.533 -1.414 1.00 . A A . 37 GLY HA2 1 1 2 1154 1 1 37 GLY HA3 H 26.355 -2.270 -0.661 1.00 . A A . 37 GLY HA3 1 1 2 1155 1 1 37 GLY N N 25.895 -0.690 -1.978 1.00 . A A . 37 GLY N 1 1 2 1156 1 1 37 GLY O O 26.278 -4.028 -2.444 1.00 . A A . 37 GLY O 1 1 2 1157 1 1 38 GLY C C 28.258 -3.034 -6.029 1.00 . A A . 38 GLY C 1 1 2 1158 1 1 38 GLY CA C 27.233 -3.491 -4.992 1.00 . A A . 38 GLY CA 1 1 2 1159 1 1 38 GLY H H 27.536 -1.631 -3.946 1.00 . A A . 38 GLY H 1 1 2 1160 1 1 38 GLY HA2 H 27.504 -4.477 -4.641 1.00 . A A . 38 GLY HA2 1 1 2 1161 1 1 38 GLY HA3 H 26.260 -3.532 -5.456 1.00 . A A . 38 GLY HA3 1 1 2 1162 1 1 38 GLY N N 27.199 -2.544 -3.833 1.00 . A A . 38 GLY N 1 1 2 1163 1 1 38 GLY O O 28.973 -3.847 -6.584 1.00 . A A . 38 GLY O 1 1 2 1164 1 1 39 VAL C C 30.628 -0.939 -6.564 1.00 . A A . 39 VAL C 1 1 2 1165 1 1 39 VAL CA C 29.263 -1.166 -7.249 1.00 . A A . 39 VAL CA 1 1 2 1166 1 1 39 VAL CB C 28.653 0.172 -7.790 1.00 . A A . 39 VAL CB 1 1 2 1167 1 1 39 VAL CG1 C 29.480 0.695 -8.993 1.00 . A A . 39 VAL CG1 1 1 2 1168 1 1 39 VAL CG2 C 27.200 -0.071 -8.276 1.00 . A A . 39 VAL CG2 1 1 2 1169 1 1 39 VAL H H 27.703 -1.138 -5.784 1.00 . A A . 39 VAL H 1 1 2 1170 1 1 39 VAL HA H 29.393 -1.875 -8.050 1.00 . A A . 39 VAL HA 1 1 2 1171 1 1 39 VAL HB H 28.646 0.913 -7.003 1.00 . A A . 39 VAL HB 1 1 2 1172 1 1 39 VAL HG11 H 29.844 -0.128 -9.592 1.00 . A A . 39 VAL HG11 1 1 2 1173 1 1 39 VAL HG12 H 28.875 1.334 -9.620 1.00 . A A . 39 VAL HG12 1 1 2 1174 1 1 39 VAL HG13 H 30.325 1.270 -8.644 1.00 . A A . 39 VAL HG13 1 1 2 1175 1 1 39 VAL HG21 H 26.594 -0.488 -7.485 1.00 . A A . 39 VAL HG21 1 1 2 1176 1 1 39 VAL HG22 H 26.757 0.861 -8.592 1.00 . A A . 39 VAL HG22 1 1 2 1177 1 1 39 VAL HG23 H 27.194 -0.760 -9.109 1.00 . A A . 39 VAL HG23 1 1 2 1178 1 1 39 VAL N N 28.302 -1.744 -6.259 1.00 . A A . 39 VAL N 1 1 2 1179 1 1 39 VAL O O 31.386 -0.053 -6.911 1.00 . A A . 39 VAL O 1 1 2 1180 1 1 40 VAL C C 33.356 -2.052 -5.734 1.00 . A A . 40 VAL C 1 1 2 1181 1 1 40 VAL CA C 32.164 -1.714 -4.814 1.00 . A A . 40 VAL CA 1 1 2 1182 1 1 40 VAL CB C 32.070 -2.730 -3.641 1.00 . A A . 40 VAL CB 1 1 2 1183 1 1 40 VAL CG1 C 33.350 -2.663 -2.775 1.00 . A A . 40 VAL CG1 1 1 2 1184 1 1 40 VAL CG2 C 30.844 -2.395 -2.760 1.00 . A A . 40 VAL CG2 1 1 2 1185 1 1 40 VAL H H 30.229 -2.463 -5.375 1.00 . A A . 40 VAL H 1 1 2 1186 1 1 40 VAL HA H 32.279 -0.711 -4.426 1.00 . A A . 40 VAL HA 1 1 2 1187 1 1 40 VAL HB H 31.959 -3.730 -4.035 1.00 . A A . 40 VAL HB 1 1 2 1188 1 1 40 VAL HG11 H 33.548 -1.646 -2.470 1.00 . A A . 40 VAL HG11 1 1 2 1189 1 1 40 VAL HG12 H 33.236 -3.275 -1.892 1.00 . A A . 40 VAL HG12 1 1 2 1190 1 1 40 VAL HG13 H 34.197 -3.029 -3.337 1.00 . A A . 40 VAL HG13 1 1 2 1191 1 1 40 VAL HG21 H 30.883 -1.364 -2.435 1.00 . A A . 40 VAL HG21 1 1 2 1192 1 1 40 VAL HG22 H 29.931 -2.549 -3.317 1.00 . A A . 40 VAL HG22 1 1 2 1193 1 1 40 VAL HG23 H 30.824 -3.032 -1.887 1.00 . A A . 40 VAL HG23 1 1 2 1194 1 1 40 VAL N N 30.890 -1.776 -5.594 1.00 . A A . 40 VAL N 1 1 2 1195 1 1 40 VAL O O 34.308 -1.291 -5.691 1.00 . A A . 40 VAL O 1 1 2 1196 1 1 40 VAL OXT O 33.246 -3.051 -6.428 1.00 . A A . 40 VAL OXT 1 1 3 1197 1 1 1 ASP C C -20.847 -19.344 13.990 1.00 . A A . 1 ASP C 1 1 3 1198 1 1 1 ASP CA C -20.275 -19.601 15.389 1.00 . A A . 1 ASP CA 1 1 3 1199 1 1 1 ASP CB C -19.537 -20.952 15.390 1.00 . A A . 1 ASP CB 1 1 3 1200 1 1 1 ASP CG C -18.887 -21.168 16.767 1.00 . A A . 1 ASP CG 1 1 3 1201 1 1 1 ASP H1 H -22.287 -19.450 15.913 1.00 . A A . 1 ASP H1 1 1 3 1202 1 1 1 ASP H2 H -21.404 -20.546 16.862 1.00 . A A . 1 ASP H2 1 1 3 1203 1 1 1 ASP H3 H -21.215 -18.876 17.100 1.00 . A A . 1 ASP H3 1 1 3 1204 1 1 1 ASP HA H -19.595 -18.801 15.642 1.00 . A A . 1 ASP HA 1 1 3 1205 1 1 1 ASP HB2 H -20.230 -21.758 15.192 1.00 . A A . 1 ASP HB2 1 1 3 1206 1 1 1 ASP HB3 H -18.769 -20.961 14.628 1.00 . A A . 1 ASP HB3 1 1 3 1207 1 1 1 ASP N N -21.379 -19.619 16.392 1.00 . A A . 1 ASP N 1 1 3 1208 1 1 1 ASP O O -21.934 -19.787 13.674 1.00 . A A . 1 ASP O 1 1 3 1209 1 1 1 ASP OD1 O -19.579 -21.710 17.614 1.00 . A A . 1 ASP OD1 1 1 3 1210 1 1 1 ASP OD2 O -17.738 -20.777 16.896 1.00 . A A . 1 ASP OD2 1 1 3 1211 1 1 2 ALA C C -19.291 -17.844 10.995 1.00 . A A . 2 ALA C 1 1 3 1212 1 1 2 ALA CA C -20.511 -18.298 11.802 1.00 . A A . 2 ALA CA 1 1 3 1213 1 1 2 ALA CB C -21.553 -17.168 11.844 1.00 . A A . 2 ALA CB 1 1 3 1214 1 1 2 ALA H H -19.221 -18.308 13.518 1.00 . A A . 2 ALA H 1 1 3 1215 1 1 2 ALA HA H -20.930 -19.181 11.340 1.00 . A A . 2 ALA HA 1 1 3 1216 1 1 2 ALA HB1 H -21.160 -16.317 12.380 1.00 . A A . 2 ALA HB1 1 1 3 1217 1 1 2 ALA HB2 H -21.808 -16.861 10.839 1.00 . A A . 2 ALA HB2 1 1 3 1218 1 1 2 ALA HB3 H -22.449 -17.509 12.339 1.00 . A A . 2 ALA HB3 1 1 3 1219 1 1 2 ALA N N -20.087 -18.631 13.196 1.00 . A A . 2 ALA N 1 1 3 1220 1 1 2 ALA O O -18.378 -17.245 11.533 1.00 . A A . 2 ALA O 1 1 3 1221 1 1 3 GLU C C -18.054 -16.240 8.760 1.00 . A A . 3 GLU C 1 1 3 1222 1 1 3 GLU CA C -18.197 -17.768 8.809 1.00 . A A . 3 GLU CA 1 1 3 1223 1 1 3 GLU CB C -18.485 -18.296 7.391 1.00 . A A . 3 GLU CB 1 1 3 1224 1 1 3 GLU CD C -18.969 -20.308 5.981 1.00 . A A . 3 GLU CD 1 1 3 1225 1 1 3 GLU CG C -18.697 -19.823 7.417 1.00 . A A . 3 GLU CG 1 1 3 1226 1 1 3 GLU H H -20.093 -18.633 9.367 1.00 . A A . 3 GLU H 1 1 3 1227 1 1 3 GLU HA H -17.279 -18.195 9.186 1.00 . A A . 3 GLU HA 1 1 3 1228 1 1 3 GLU HB2 H -19.368 -17.813 6.994 1.00 . A A . 3 GLU HB2 1 1 3 1229 1 1 3 GLU HB3 H -17.646 -18.060 6.752 1.00 . A A . 3 GLU HB3 1 1 3 1230 1 1 3 GLU HG2 H -17.817 -20.321 7.802 1.00 . A A . 3 GLU HG2 1 1 3 1231 1 1 3 GLU HG3 H -19.543 -20.079 8.041 1.00 . A A . 3 GLU HG3 1 1 3 1232 1 1 3 GLU N N -19.321 -18.149 9.723 1.00 . A A . 3 GLU N 1 1 3 1233 1 1 3 GLU O O -16.955 -15.718 8.754 1.00 . A A . 3 GLU O 1 1 3 1234 1 1 3 GLU OE1 O -17.994 -20.626 5.319 1.00 . A A . 3 GLU OE1 1 1 3 1235 1 1 3 GLU OE2 O -20.136 -20.331 5.628 1.00 . A A . 3 GLU OE2 1 1 3 1236 1 1 4 PHE C C -18.607 -13.547 7.418 1.00 . A A . 4 PHE C 1 1 3 1237 1 1 4 PHE CA C -19.285 -14.101 8.677 1.00 . A A . 4 PHE CA 1 1 3 1238 1 1 4 PHE CB C -18.620 -13.489 9.944 1.00 . A A . 4 PHE CB 1 1 3 1239 1 1 4 PHE CD1 C -18.324 -11.026 9.390 1.00 . A A . 4 PHE CD1 1 1 3 1240 1 1 4 PHE CD2 C -20.161 -11.655 10.775 1.00 . A A . 4 PHE CD2 1 1 3 1241 1 1 4 PHE CE1 C -18.712 -9.705 9.473 1.00 . A A . 4 PHE CE1 1 1 3 1242 1 1 4 PHE CE2 C -20.550 -10.334 10.858 1.00 . A A . 4 PHE CE2 1 1 3 1243 1 1 4 PHE CG C -19.045 -12.013 10.040 1.00 . A A . 4 PHE CG 1 1 3 1244 1 1 4 PHE CZ C -19.826 -9.358 10.207 1.00 . A A . 4 PHE CZ 1 1 3 1245 1 1 4 PHE H H -20.027 -16.106 8.736 1.00 . A A . 4 PHE H 1 1 3 1246 1 1 4 PHE HA H -20.332 -13.834 8.655 1.00 . A A . 4 PHE HA 1 1 3 1247 1 1 4 PHE HB2 H -18.953 -14.011 10.828 1.00 . A A . 4 PHE HB2 1 1 3 1248 1 1 4 PHE HB3 H -17.542 -13.543 9.892 1.00 . A A . 4 PHE HB3 1 1 3 1249 1 1 4 PHE HD1 H -17.448 -11.287 8.814 1.00 . A A . 4 PHE HD1 1 1 3 1250 1 1 4 PHE HD2 H -20.734 -12.414 11.289 1.00 . A A . 4 PHE HD2 1 1 3 1251 1 1 4 PHE HE1 H -18.144 -8.942 8.962 1.00 . A A . 4 PHE HE1 1 1 3 1252 1 1 4 PHE HE2 H -21.423 -10.065 11.434 1.00 . A A . 4 PHE HE2 1 1 3 1253 1 1 4 PHE HZ H -20.132 -8.324 10.271 1.00 . A A . 4 PHE HZ 1 1 3 1254 1 1 4 PHE N N -19.193 -15.591 8.727 1.00 . A A . 4 PHE N 1 1 3 1255 1 1 4 PHE O O -17.401 -13.401 7.356 1.00 . A A . 4 PHE O 1 1 3 1256 1 1 5 ARG C C -19.805 -11.538 4.690 1.00 . A A . 5 ARG C 1 1 3 1257 1 1 5 ARG CA C -18.932 -12.710 5.150 1.00 . A A . 5 ARG CA 1 1 3 1258 1 1 5 ARG CB C -18.941 -13.856 4.111 1.00 . A A . 5 ARG CB 1 1 3 1259 1 1 5 ARG CD C -17.437 -15.069 2.482 1.00 . A A . 5 ARG CD 1 1 3 1260 1 1 5 ARG CG C -17.713 -13.721 3.174 1.00 . A A . 5 ARG CG 1 1 3 1261 1 1 5 ARG CZ C -17.139 -17.371 3.288 1.00 . A A . 5 ARG CZ 1 1 3 1262 1 1 5 ARG H H -20.392 -13.415 6.572 1.00 . A A . 5 ARG H 1 1 3 1263 1 1 5 ARG HA H -17.936 -12.325 5.305 1.00 . A A . 5 ARG HA 1 1 3 1264 1 1 5 ARG HB2 H -18.908 -14.803 4.629 1.00 . A A . 5 ARG HB2 1 1 3 1265 1 1 5 ARG HB3 H -19.847 -13.826 3.524 1.00 . A A . 5 ARG HB3 1 1 3 1266 1 1 5 ARG HD2 H -18.306 -15.390 1.925 1.00 . A A . 5 ARG HD2 1 1 3 1267 1 1 5 ARG HD3 H -16.595 -14.979 1.811 1.00 . A A . 5 ARG HD3 1 1 3 1268 1 1 5 ARG HE H -16.870 -15.778 4.433 1.00 . A A . 5 ARG HE 1 1 3 1269 1 1 5 ARG HG2 H -17.912 -12.967 2.426 1.00 . A A . 5 ARG HG2 1 1 3 1270 1 1 5 ARG HG3 H -16.839 -13.422 3.734 1.00 . A A . 5 ARG HG3 1 1 3 1271 1 1 5 ARG HH11 H -17.680 -17.180 1.365 1.00 . A A . 5 ARG HH11 1 1 3 1272 1 1 5 ARG HH12 H -17.470 -18.803 1.929 1.00 . A A . 5 ARG HH12 1 1 3 1273 1 1 5 ARG HH21 H -16.602 -17.816 5.162 1.00 . A A . 5 ARG HH21 1 1 3 1274 1 1 5 ARG HH22 H -16.853 -19.171 4.114 1.00 . A A . 5 ARG HH22 1 1 3 1275 1 1 5 ARG N N -19.433 -13.262 6.446 1.00 . A A . 5 ARG N 1 1 3 1276 1 1 5 ARG NE N -17.111 -16.084 3.534 1.00 . A A . 5 ARG NE 1 1 3 1277 1 1 5 ARG NH1 N -17.455 -17.818 2.102 1.00 . A A . 5 ARG NH1 1 1 3 1278 1 1 5 ARG NH2 N -16.842 -18.182 4.263 1.00 . A A . 5 ARG NH2 1 1 3 1279 1 1 5 ARG O O -19.907 -11.250 3.512 1.00 . A A . 5 ARG O 1 1 3 1280 1 1 6 HIS C C -20.432 -8.451 5.369 1.00 . A A . 6 HIS C 1 1 3 1281 1 1 6 HIS CA C -21.293 -9.726 5.391 1.00 . A A . 6 HIS CA 1 1 3 1282 1 1 6 HIS CB C -22.365 -9.657 6.503 1.00 . A A . 6 HIS CB 1 1 3 1283 1 1 6 HIS CD2 C -23.737 -7.929 4.997 1.00 . A A . 6 HIS CD2 1 1 3 1284 1 1 6 HIS CE1 C -25.576 -8.135 5.931 1.00 . A A . 6 HIS CE1 1 1 3 1285 1 1 6 HIS CG C -23.587 -8.854 6.022 1.00 . A A . 6 HIS CG 1 1 3 1286 1 1 6 HIS H H -20.268 -11.190 6.581 1.00 . A A . 6 HIS H 1 1 3 1287 1 1 6 HIS HA H -21.755 -9.862 4.427 1.00 . A A . 6 HIS HA 1 1 3 1288 1 1 6 HIS HB2 H -22.694 -10.653 6.761 1.00 . A A . 6 HIS HB2 1 1 3 1289 1 1 6 HIS HB3 H -21.967 -9.187 7.391 1.00 . A A . 6 HIS HB3 1 1 3 1290 1 1 6 HIS HD1 H -25.003 -9.499 7.311 1.00 . A A . 6 HIS HD1 1 1 3 1291 1 1 6 HIS HD2 H -22.952 -7.610 4.327 1.00 . A A . 6 HIS HD2 1 1 3 1292 1 1 6 HIS HE1 H -26.619 -8.017 6.185 1.00 . A A . 6 HIS HE1 1 1 3 1293 1 1 6 HIS N N -20.407 -10.896 5.660 1.00 . A A . 6 HIS N 1 1 3 1294 1 1 6 HIS ND1 N -24.764 -8.928 6.552 1.00 . A A . 6 HIS ND1 1 1 3 1295 1 1 6 HIS NE2 N -24.981 -7.494 4.957 1.00 . A A . 6 HIS NE2 1 1 3 1296 1 1 6 HIS O O -20.793 -7.423 5.907 1.00 . A A . 6 HIS O 1 1 3 1297 1 1 7 ASP C C -18.842 -6.467 3.543 1.00 . A A . 7 ASP C 1 1 3 1298 1 1 7 ASP CA C -18.323 -7.467 4.590 1.00 . A A . 7 ASP CA 1 1 3 1299 1 1 7 ASP CB C -16.944 -8.068 4.171 1.00 . A A . 7 ASP CB 1 1 3 1300 1 1 7 ASP CG C -17.125 -9.352 3.332 1.00 . A A . 7 ASP CG 1 1 3 1301 1 1 7 ASP H H -19.078 -9.440 4.317 1.00 . A A . 7 ASP H 1 1 3 1302 1 1 7 ASP HA H -18.233 -6.971 5.543 1.00 . A A . 7 ASP HA 1 1 3 1303 1 1 7 ASP HB2 H -16.389 -7.350 3.589 1.00 . A A . 7 ASP HB2 1 1 3 1304 1 1 7 ASP HB3 H -16.371 -8.301 5.058 1.00 . A A . 7 ASP HB3 1 1 3 1305 1 1 7 ASP N N -19.300 -8.583 4.726 1.00 . A A . 7 ASP N 1 1 3 1306 1 1 7 ASP O O -18.433 -6.469 2.397 1.00 . A A . 7 ASP O 1 1 3 1307 1 1 7 ASP OD1 O -17.481 -9.203 2.175 1.00 . A A . 7 ASP OD1 1 1 3 1308 1 1 7 ASP OD2 O -16.903 -10.411 3.897 1.00 . A A . 7 ASP OD2 1 1 3 1309 1 1 8 SER C C -20.607 -3.323 3.946 1.00 . A A . 8 SER C 1 1 3 1310 1 1 8 SER CA C -20.369 -4.596 3.127 1.00 . A A . 8 SER CA 1 1 3 1311 1 1 8 SER CB C -21.706 -5.119 2.583 1.00 . A A . 8 SER CB 1 1 3 1312 1 1 8 SER H H -20.027 -5.696 4.930 1.00 . A A . 8 SER H 1 1 3 1313 1 1 8 SER HA H -19.690 -4.368 2.321 1.00 . A A . 8 SER HA 1 1 3 1314 1 1 8 SER HB2 H -22.381 -5.400 3.378 1.00 . A A . 8 SER HB2 1 1 3 1315 1 1 8 SER HB3 H -22.179 -4.397 1.932 1.00 . A A . 8 SER HB3 1 1 3 1316 1 1 8 SER HG H -21.594 -6.118 0.918 1.00 . A A . 8 SER HG 1 1 3 1317 1 1 8 SER N N -19.747 -5.636 3.996 1.00 . A A . 8 SER N 1 1 3 1318 1 1 8 SER O O -21.149 -3.381 5.034 1.00 . A A . 8 SER O 1 1 3 1319 1 1 8 SER OG O -21.351 -6.272 1.833 1.00 . A A . 8 SER OG 1 1 3 1320 1 1 9 GLY C C -19.202 0.025 3.681 1.00 . A A . 9 GLY C 1 1 3 1321 1 1 9 GLY CA C -20.357 -0.895 4.075 1.00 . A A . 9 GLY CA 1 1 3 1322 1 1 9 GLY H H -19.761 -2.245 2.511 1.00 . A A . 9 GLY H 1 1 3 1323 1 1 9 GLY HA2 H -21.295 -0.451 3.771 1.00 . A A . 9 GLY HA2 1 1 3 1324 1 1 9 GLY HA3 H -20.350 -1.032 5.147 1.00 . A A . 9 GLY HA3 1 1 3 1325 1 1 9 GLY N N -20.191 -2.214 3.391 1.00 . A A . 9 GLY N 1 1 3 1326 1 1 9 GLY O O -19.412 1.105 3.163 1.00 . A A . 9 GLY O 1 1 3 1327 1 1 10 TYR C C -16.516 0.324 2.103 1.00 . A A . 10 TYR C 1 1 3 1328 1 1 10 TYR CA C -16.779 0.340 3.617 1.00 . A A . 10 TYR CA 1 1 3 1329 1 1 10 TYR CB C -15.580 -0.279 4.377 1.00 . A A . 10 TYR CB 1 1 3 1330 1 1 10 TYR CD1 C -13.986 1.702 4.324 1.00 . A A . 10 TYR CD1 1 1 3 1331 1 1 10 TYR CD2 C -13.331 -0.285 3.190 1.00 . A A . 10 TYR CD2 1 1 3 1332 1 1 10 TYR CE1 C -12.808 2.309 3.940 1.00 . A A . 10 TYR CE1 1 1 3 1333 1 1 10 TYR CE2 C -12.154 0.323 2.806 1.00 . A A . 10 TYR CE2 1 1 3 1334 1 1 10 TYR CG C -14.260 0.399 3.953 1.00 . A A . 10 TYR CG 1 1 3 1335 1 1 10 TYR CZ C -11.885 1.625 3.179 1.00 . A A . 10 TYR CZ 1 1 3 1336 1 1 10 TYR H H -17.917 -1.328 4.365 1.00 . A A . 10 TYR H 1 1 3 1337 1 1 10 TYR HA H -16.925 1.362 3.937 1.00 . A A . 10 TYR HA 1 1 3 1338 1 1 10 TYR HB2 H -15.710 -0.145 5.441 1.00 . A A . 10 TYR HB2 1 1 3 1339 1 1 10 TYR HB3 H -15.519 -1.336 4.166 1.00 . A A . 10 TYR HB3 1 1 3 1340 1 1 10 TYR HD1 H -14.699 2.252 4.920 1.00 . A A . 10 TYR HD1 1 1 3 1341 1 1 10 TYR HD2 H -13.526 -1.304 2.888 1.00 . A A . 10 TYR HD2 1 1 3 1342 1 1 10 TYR HE1 H -12.610 3.328 4.238 1.00 . A A . 10 TYR HE1 1 1 3 1343 1 1 10 TYR HE2 H -11.440 -0.225 2.211 1.00 . A A . 10 TYR HE2 1 1 3 1344 1 1 10 TYR HH H -10.703 2.301 1.839 1.00 . A A . 10 TYR HH 1 1 3 1345 1 1 10 TYR N N -18.007 -0.446 3.946 1.00 . A A . 10 TYR N 1 1 3 1346 1 1 10 TYR O O -16.953 -0.566 1.397 1.00 . A A . 10 TYR O 1 1 3 1347 1 1 10 TYR OH O -10.707 2.235 2.797 1.00 . A A . 10 TYR OH 1 1 3 1348 1 1 11 GLU C C -13.948 1.872 0.211 1.00 . A A . 11 GLU C 1 1 3 1349 1 1 11 GLU CA C -15.434 1.495 0.234 1.00 . A A . 11 GLU CA 1 1 3 1350 1 1 11 GLU CB C -16.313 2.613 -0.367 1.00 . A A . 11 GLU CB 1 1 3 1351 1 1 11 GLU CD C -15.089 2.931 -2.556 1.00 . A A . 11 GLU CD 1 1 3 1352 1 1 11 GLU CG C -16.405 2.469 -1.903 1.00 . A A . 11 GLU CG 1 1 3 1353 1 1 11 GLU H H -15.493 2.000 2.318 1.00 . A A . 11 GLU H 1 1 3 1354 1 1 11 GLU HA H -15.571 0.557 -0.286 1.00 . A A . 11 GLU HA 1 1 3 1355 1 1 11 GLU HB2 H -17.309 2.541 0.046 1.00 . A A . 11 GLU HB2 1 1 3 1356 1 1 11 GLU HB3 H -15.912 3.582 -0.106 1.00 . A A . 11 GLU HB3 1 1 3 1357 1 1 11 GLU HG2 H -16.606 1.442 -2.176 1.00 . A A . 11 GLU HG2 1 1 3 1358 1 1 11 GLU HG3 H -17.210 3.085 -2.275 1.00 . A A . 11 GLU HG3 1 1 3 1359 1 1 11 GLU N N -15.801 1.330 1.673 1.00 . A A . 11 GLU N 1 1 3 1360 1 1 11 GLU O O -13.545 2.795 0.894 1.00 . A A . 11 GLU O 1 1 3 1361 1 1 11 GLU OE1 O -14.865 4.130 -2.541 1.00 . A A . 11 GLU OE1 1 1 3 1362 1 1 11 GLU OE2 O -14.381 2.058 -3.033 1.00 . A A . 11 GLU OE2 1 1 3 1363 1 1 12 VAL C C -11.392 2.819 -1.198 1.00 . A A . 12 VAL C 1 1 3 1364 1 1 12 VAL CA C -11.719 1.425 -0.673 1.00 . A A . 12 VAL CA 1 1 3 1365 1 1 12 VAL CB C -11.056 0.370 -1.608 1.00 . A A . 12 VAL CB 1 1 3 1366 1 1 12 VAL CG1 C -11.233 -1.038 -1.011 1.00 . A A . 12 VAL CG1 1 1 3 1367 1 1 12 VAL CG2 C -11.669 0.404 -3.028 1.00 . A A . 12 VAL CG2 1 1 3 1368 1 1 12 VAL H H -13.549 0.430 -1.102 1.00 . A A . 12 VAL H 1 1 3 1369 1 1 12 VAL HA H -11.296 1.333 0.314 1.00 . A A . 12 VAL HA 1 1 3 1370 1 1 12 VAL HB H -9.999 0.582 -1.684 1.00 . A A . 12 VAL HB 1 1 3 1371 1 1 12 VAL HG11 H -10.979 -1.037 0.038 1.00 . A A . 12 VAL HG11 1 1 3 1372 1 1 12 VAL HG12 H -12.257 -1.366 -1.120 1.00 . A A . 12 VAL HG12 1 1 3 1373 1 1 12 VAL HG13 H -10.586 -1.734 -1.523 1.00 . A A . 12 VAL HG13 1 1 3 1374 1 1 12 VAL HG21 H -11.652 1.407 -3.426 1.00 . A A . 12 VAL HG21 1 1 3 1375 1 1 12 VAL HG22 H -11.099 -0.234 -3.686 1.00 . A A . 12 VAL HG22 1 1 3 1376 1 1 12 VAL HG23 H -12.691 0.053 -3.008 1.00 . A A . 12 VAL HG23 1 1 3 1377 1 1 12 VAL N N -13.179 1.155 -0.570 1.00 . A A . 12 VAL N 1 1 3 1378 1 1 12 VAL O O -12.204 3.503 -1.789 1.00 . A A . 12 VAL O 1 1 3 1379 1 1 13 HIS C C -8.488 4.191 -2.359 1.00 . A A . 13 HIS C 1 1 3 1380 1 1 13 HIS CA C -9.602 4.484 -1.350 1.00 . A A . 13 HIS CA 1 1 3 1381 1 1 13 HIS CB C -9.048 5.204 -0.104 1.00 . A A . 13 HIS CB 1 1 3 1382 1 1 13 HIS CD2 C -11.289 5.099 1.311 1.00 . A A . 13 HIS CD2 1 1 3 1383 1 1 13 HIS CE1 C -11.451 7.112 1.771 1.00 . A A . 13 HIS CE1 1 1 3 1384 1 1 13 HIS CG C -10.210 5.746 0.736 1.00 . A A . 13 HIS CG 1 1 3 1385 1 1 13 HIS H H -9.623 2.508 -0.452 1.00 . A A . 13 HIS H 1 1 3 1386 1 1 13 HIS HA H -10.365 5.080 -1.827 1.00 . A A . 13 HIS HA 1 1 3 1387 1 1 13 HIS HB2 H -8.465 4.525 0.498 1.00 . A A . 13 HIS HB2 1 1 3 1388 1 1 13 HIS HB3 H -8.426 6.035 -0.406 1.00 . A A . 13 HIS HB3 1 1 3 1389 1 1 13 HIS HD1 H -9.776 7.720 0.807 1.00 . A A . 13 HIS HD1 1 1 3 1390 1 1 13 HIS HD2 H -11.478 4.040 1.243 1.00 . A A . 13 HIS HD2 1 1 3 1391 1 1 13 HIS HE1 H -11.808 8.052 2.166 1.00 . A A . 13 HIS HE1 1 1 3 1392 1 1 13 HIS N N -10.166 3.163 -0.936 1.00 . A A . 13 HIS N 1 1 3 1393 1 1 13 HIS ND1 N -10.375 6.986 1.060 1.00 . A A . 13 HIS ND1 1 1 3 1394 1 1 13 HIS NE2 N -12.052 5.961 1.951 1.00 . A A . 13 HIS NE2 1 1 3 1395 1 1 13 HIS O O -7.321 4.439 -2.118 1.00 . A A . 13 HIS O 1 1 3 1396 1 1 14 HIS C C -6.867 2.377 -4.083 1.00 . A A . 14 HIS C 1 1 3 1397 1 1 14 HIS CA C -7.993 3.291 -4.598 1.00 . A A . 14 HIS CA 1 1 3 1398 1 1 14 HIS CB C -7.425 4.596 -5.191 1.00 . A A . 14 HIS CB 1 1 3 1399 1 1 14 HIS CD2 C -9.842 5.643 -5.562 1.00 . A A . 14 HIS CD2 1 1 3 1400 1 1 14 HIS CE1 C -9.396 7.600 -5.045 1.00 . A A . 14 HIS CE1 1 1 3 1401 1 1 14 HIS CG C -8.499 5.693 -5.227 1.00 . A A . 14 HIS CG 1 1 3 1402 1 1 14 HIS H H -9.868 3.495 -3.591 1.00 . A A . 14 HIS H 1 1 3 1403 1 1 14 HIS HA H -8.559 2.750 -5.342 1.00 . A A . 14 HIS HA 1 1 3 1404 1 1 14 HIS HB2 H -6.635 4.934 -4.545 1.00 . A A . 14 HIS HB2 1 1 3 1405 1 1 14 HIS HB3 H -7.044 4.437 -6.189 1.00 . A A . 14 HIS HB3 1 1 3 1406 1 1 14 HIS HD1 H -7.436 7.306 -4.634 1.00 . A A . 14 HIS HD1 1 1 3 1407 1 1 14 HIS HD2 H -10.368 4.754 -5.874 1.00 . A A . 14 HIS HD2 1 1 3 1408 1 1 14 HIS HE1 H -9.487 8.656 -4.843 1.00 . A A . 14 HIS HE1 1 1 3 1409 1 1 14 HIS N N -8.914 3.658 -3.478 1.00 . A A . 14 HIS N 1 1 3 1410 1 1 14 HIS ND1 N -8.296 6.931 -4.919 1.00 . A A . 14 HIS ND1 1 1 3 1411 1 1 14 HIS NE2 N -10.386 6.839 -5.444 1.00 . A A . 14 HIS NE2 1 1 3 1412 1 1 14 HIS O O -5.753 2.386 -4.571 1.00 . A A . 14 HIS O 1 1 3 1413 1 1 15 GLN C C -5.487 -0.183 -3.496 1.00 . A A . 15 GLN C 1 1 3 1414 1 1 15 GLN CA C -6.252 0.648 -2.459 1.00 . A A . 15 GLN CA 1 1 3 1415 1 1 15 GLN CB C -7.046 -0.261 -1.510 1.00 . A A . 15 GLN CB 1 1 3 1416 1 1 15 GLN CD C -8.359 -0.190 0.649 1.00 . A A . 15 GLN CD 1 1 3 1417 1 1 15 GLN CG C -7.271 0.498 -0.183 1.00 . A A . 15 GLN CG 1 1 3 1418 1 1 15 GLN H H -8.136 1.646 -2.754 1.00 . A A . 15 GLN H 1 1 3 1419 1 1 15 GLN HA H -5.533 1.225 -1.900 1.00 . A A . 15 GLN HA 1 1 3 1420 1 1 15 GLN HB2 H -7.994 -0.525 -1.959 1.00 . A A . 15 GLN HB2 1 1 3 1421 1 1 15 GLN HB3 H -6.494 -1.166 -1.316 1.00 . A A . 15 GLN HB3 1 1 3 1422 1 1 15 GLN HE21 H -7.699 -2.024 0.270 1.00 . A A . 15 GLN HE21 1 1 3 1423 1 1 15 GLN HE22 H -9.072 -1.937 1.263 1.00 . A A . 15 GLN HE22 1 1 3 1424 1 1 15 GLN HG2 H -6.357 0.513 0.394 1.00 . A A . 15 GLN HG2 1 1 3 1425 1 1 15 GLN HG3 H -7.578 1.516 -0.376 1.00 . A A . 15 GLN HG3 1 1 3 1426 1 1 15 GLN N N -7.217 1.600 -3.090 1.00 . A A . 15 GLN N 1 1 3 1427 1 1 15 GLN NE2 N -8.378 -1.492 0.734 1.00 . A A . 15 GLN NE2 1 1 3 1428 1 1 15 GLN O O -4.344 -0.533 -3.288 1.00 . A A . 15 GLN O 1 1 3 1429 1 1 15 GLN OE1 O -9.205 0.458 1.231 1.00 . A A . 15 GLN OE1 1 1 3 1430 1 1 16 LYS C C -4.145 -0.645 -6.082 1.00 . A A . 16 LYS C 1 1 3 1431 1 1 16 LYS CA C -5.490 -1.275 -5.673 1.00 . A A . 16 LYS CA 1 1 3 1432 1 1 16 LYS CB C -6.454 -1.347 -6.897 1.00 . A A . 16 LYS CB 1 1 3 1433 1 1 16 LYS CD C -6.424 0.576 -8.582 1.00 . A A . 16 LYS CD 1 1 3 1434 1 1 16 LYS CE C -7.177 0.005 -9.798 1.00 . A A . 16 LYS CE 1 1 3 1435 1 1 16 LYS CG C -7.057 0.046 -7.272 1.00 . A A . 16 LYS CG 1 1 3 1436 1 1 16 LYS H H -7.061 -0.156 -4.694 1.00 . A A . 16 LYS H 1 1 3 1437 1 1 16 LYS HA H -5.304 -2.266 -5.301 1.00 . A A . 16 LYS HA 1 1 3 1438 1 1 16 LYS HB2 H -5.926 -1.771 -7.739 1.00 . A A . 16 LYS HB2 1 1 3 1439 1 1 16 LYS HB3 H -7.265 -2.015 -6.648 1.00 . A A . 16 LYS HB3 1 1 3 1440 1 1 16 LYS HD2 H -6.487 1.654 -8.598 1.00 . A A . 16 LYS HD2 1 1 3 1441 1 1 16 LYS HD3 H -5.382 0.296 -8.639 1.00 . A A . 16 LYS HD3 1 1 3 1442 1 1 16 LYS HE2 H -7.251 -1.071 -9.730 1.00 . A A . 16 LYS HE2 1 1 3 1443 1 1 16 LYS HE3 H -8.173 0.422 -9.850 1.00 . A A . 16 LYS HE3 1 1 3 1444 1 1 16 LYS HG2 H -8.126 -0.057 -7.402 1.00 . A A . 16 LYS HG2 1 1 3 1445 1 1 16 LYS HG3 H -6.894 0.769 -6.489 1.00 . A A . 16 LYS HG3 1 1 3 1446 1 1 16 LYS HZ1 H -5.598 0.899 -10.822 1.00 . A A . 16 LYS HZ1 1 1 3 1447 1 1 16 LYS HZ2 H -6.178 -0.523 -11.546 1.00 . A A . 16 LYS HZ2 1 1 3 1448 1 1 16 LYS HZ3 H -7.071 0.917 -11.666 1.00 . A A . 16 LYS HZ3 1 1 3 1449 1 1 16 LYS N N -6.140 -0.472 -4.591 1.00 . A A . 16 LYS N 1 1 3 1450 1 1 16 LYS NZ N -6.451 0.351 -11.052 1.00 . A A . 16 LYS NZ 1 1 3 1451 1 1 16 LYS O O -3.113 -1.292 -6.079 1.00 . A A . 16 LYS O 1 1 3 1452 1 1 17 LEU C C -2.013 1.451 -5.609 1.00 . A A . 17 LEU C 1 1 3 1453 1 1 17 LEU CA C -2.946 1.326 -6.820 1.00 . A A . 17 LEU CA 1 1 3 1454 1 1 17 LEU CB C -3.345 2.719 -7.416 1.00 . A A . 17 LEU CB 1 1 3 1455 1 1 17 LEU CD1 C -1.927 4.392 -6.093 1.00 . A A . 17 LEU CD1 1 1 3 1456 1 1 17 LEU CD2 C -4.212 5.035 -6.955 1.00 . A A . 17 LEU CD2 1 1 3 1457 1 1 17 LEU CG C -3.372 3.877 -6.376 1.00 . A A . 17 LEU CG 1 1 3 1458 1 1 17 LEU H H -5.043 1.100 -6.373 1.00 . A A . 17 LEU H 1 1 3 1459 1 1 17 LEU HA H -2.453 0.740 -7.584 1.00 . A A . 17 LEU HA 1 1 3 1460 1 1 17 LEU HB2 H -2.648 2.966 -8.205 1.00 . A A . 17 LEU HB2 1 1 3 1461 1 1 17 LEU HB3 H -4.322 2.625 -7.867 1.00 . A A . 17 LEU HB3 1 1 3 1462 1 1 17 LEU HD11 H -1.210 3.919 -6.749 1.00 . A A . 17 LEU HD11 1 1 3 1463 1 1 17 LEU HD12 H -1.858 5.461 -6.233 1.00 . A A . 17 LEU HD12 1 1 3 1464 1 1 17 LEU HD13 H -1.653 4.168 -5.073 1.00 . A A . 17 LEU HD13 1 1 3 1465 1 1 17 LEU HD21 H -5.169 4.670 -7.298 1.00 . A A . 17 LEU HD21 1 1 3 1466 1 1 17 LEU HD22 H -4.379 5.786 -6.197 1.00 . A A . 17 LEU HD22 1 1 3 1467 1 1 17 LEU HD23 H -3.697 5.489 -7.790 1.00 . A A . 17 LEU HD23 1 1 3 1468 1 1 17 LEU HG H -3.833 3.536 -5.463 1.00 . A A . 17 LEU HG 1 1 3 1469 1 1 17 LEU N N -4.192 0.621 -6.408 1.00 . A A . 17 LEU N 1 1 3 1470 1 1 17 LEU O O -0.816 1.352 -5.759 1.00 . A A . 17 LEU O 1 1 3 1471 1 1 18 VAL C C -0.812 0.551 -3.123 1.00 . A A . 18 VAL C 1 1 3 1472 1 1 18 VAL CA C -1.722 1.794 -3.214 1.00 . A A . 18 VAL CA 1 1 3 1473 1 1 18 VAL CB C -2.673 1.913 -1.994 1.00 . A A . 18 VAL CB 1 1 3 1474 1 1 18 VAL CG1 C -1.865 1.996 -0.691 1.00 . A A . 18 VAL CG1 1 1 3 1475 1 1 18 VAL CG2 C -3.534 3.194 -2.134 1.00 . A A . 18 VAL CG2 1 1 3 1476 1 1 18 VAL H H -3.540 1.745 -4.364 1.00 . A A . 18 VAL H 1 1 3 1477 1 1 18 VAL HA H -1.106 2.677 -3.306 1.00 . A A . 18 VAL HA 1 1 3 1478 1 1 18 VAL HB H -3.317 1.050 -1.941 1.00 . A A . 18 VAL HB 1 1 3 1479 1 1 18 VAL HG11 H -0.814 2.136 -0.900 1.00 . A A . 18 VAL HG11 1 1 3 1480 1 1 18 VAL HG12 H -2.210 2.816 -0.079 1.00 . A A . 18 VAL HG12 1 1 3 1481 1 1 18 VAL HG13 H -1.998 1.077 -0.143 1.00 . A A . 18 VAL HG13 1 1 3 1482 1 1 18 VAL HG21 H -4.051 3.207 -3.080 1.00 . A A . 18 VAL HG21 1 1 3 1483 1 1 18 VAL HG22 H -4.268 3.234 -1.342 1.00 . A A . 18 VAL HG22 1 1 3 1484 1 1 18 VAL HG23 H -2.910 4.074 -2.073 1.00 . A A . 18 VAL HG23 1 1 3 1485 1 1 18 VAL N N -2.569 1.664 -4.441 1.00 . A A . 18 VAL N 1 1 3 1486 1 1 18 VAL O O 0.383 0.670 -2.948 1.00 . A A . 18 VAL O 1 1 3 1487 1 1 19 PHE C C 0.476 -1.858 -4.235 1.00 . A A . 19 PHE C 1 1 3 1488 1 1 19 PHE CA C -0.635 -1.893 -3.187 1.00 . A A . 19 PHE CA 1 1 3 1489 1 1 19 PHE CB C -1.579 -3.084 -3.469 1.00 . A A . 19 PHE CB 1 1 3 1490 1 1 19 PHE CD1 C -2.651 -2.769 -1.165 1.00 . A A . 19 PHE CD1 1 1 3 1491 1 1 19 PHE CD2 C -4.030 -3.465 -2.980 1.00 . A A . 19 PHE CD2 1 1 3 1492 1 1 19 PHE CE1 C -3.743 -2.798 -0.324 1.00 . A A . 19 PHE CE1 1 1 3 1493 1 1 19 PHE CE2 C -5.122 -3.495 -2.137 1.00 . A A . 19 PHE CE2 1 1 3 1494 1 1 19 PHE CG C -2.782 -3.103 -2.505 1.00 . A A . 19 PHE CG 1 1 3 1495 1 1 19 PHE CZ C -4.979 -3.161 -0.808 1.00 . A A . 19 PHE CZ 1 1 3 1496 1 1 19 PHE H H -2.370 -0.627 -3.389 1.00 . A A . 19 PHE H 1 1 3 1497 1 1 19 PHE HA H -0.181 -1.990 -2.218 1.00 . A A . 19 PHE HA 1 1 3 1498 1 1 19 PHE HB2 H -1.944 -3.029 -4.484 1.00 . A A . 19 PHE HB2 1 1 3 1499 1 1 19 PHE HB3 H -1.035 -4.010 -3.351 1.00 . A A . 19 PHE HB3 1 1 3 1500 1 1 19 PHE HD1 H -1.689 -2.484 -0.767 1.00 . A A . 19 PHE HD1 1 1 3 1501 1 1 19 PHE HD2 H -4.154 -3.731 -4.019 1.00 . A A . 19 PHE HD2 1 1 3 1502 1 1 19 PHE HE1 H -3.628 -2.535 0.718 1.00 . A A . 19 PHE HE1 1 1 3 1503 1 1 19 PHE HE2 H -6.092 -3.779 -2.521 1.00 . A A . 19 PHE HE2 1 1 3 1504 1 1 19 PHE HZ H -5.835 -3.183 -0.149 1.00 . A A . 19 PHE HZ 1 1 3 1505 1 1 19 PHE N N -1.406 -0.609 -3.252 1.00 . A A . 19 PHE N 1 1 3 1506 1 1 19 PHE O O 1.623 -2.134 -3.940 1.00 . A A . 19 PHE O 1 1 3 1507 1 1 20 PHE C C 2.272 -0.544 -6.109 1.00 . A A . 20 PHE C 1 1 3 1508 1 1 20 PHE CA C 1.088 -1.430 -6.555 1.00 . A A . 20 PHE CA 1 1 3 1509 1 1 20 PHE CB C 0.333 -0.857 -7.807 1.00 . A A . 20 PHE CB 1 1 3 1510 1 1 20 PHE CD1 C 2.248 -0.023 -9.249 1.00 . A A . 20 PHE CD1 1 1 3 1511 1 1 20 PHE CD2 C 0.658 1.577 -8.487 1.00 . A A . 20 PHE CD2 1 1 3 1512 1 1 20 PHE CE1 C 2.936 0.977 -9.902 1.00 . A A . 20 PHE CE1 1 1 3 1513 1 1 20 PHE CE2 C 1.345 2.576 -9.138 1.00 . A A . 20 PHE CE2 1 1 3 1514 1 1 20 PHE CG C 1.100 0.266 -8.534 1.00 . A A . 20 PHE CG 1 1 3 1515 1 1 20 PHE CZ C 2.487 2.278 -9.849 1.00 . A A . 20 PHE CZ 1 1 3 1516 1 1 20 PHE H H -0.845 -1.301 -5.601 1.00 . A A . 20 PHE H 1 1 3 1517 1 1 20 PHE HA H 1.454 -2.425 -6.764 1.00 . A A . 20 PHE HA 1 1 3 1518 1 1 20 PHE HB2 H 0.167 -1.659 -8.511 1.00 . A A . 20 PHE HB2 1 1 3 1519 1 1 20 PHE HB3 H -0.633 -0.478 -7.511 1.00 . A A . 20 PHE HB3 1 1 3 1520 1 1 20 PHE HD1 H 2.613 -1.038 -9.298 1.00 . A A . 20 PHE HD1 1 1 3 1521 1 1 20 PHE HD2 H -0.234 1.835 -7.940 1.00 . A A . 20 PHE HD2 1 1 3 1522 1 1 20 PHE HE1 H 3.829 0.733 -10.456 1.00 . A A . 20 PHE HE1 1 1 3 1523 1 1 20 PHE HE2 H 0.983 3.592 -9.088 1.00 . A A . 20 PHE HE2 1 1 3 1524 1 1 20 PHE HZ H 3.028 3.060 -10.361 1.00 . A A . 20 PHE HZ 1 1 3 1525 1 1 20 PHE N N 0.097 -1.509 -5.438 1.00 . A A . 20 PHE N 1 1 3 1526 1 1 20 PHE O O 3.409 -0.966 -6.129 1.00 . A A . 20 PHE O 1 1 3 1527 1 1 21 ALA C C 3.888 1.038 -4.153 1.00 . A A . 21 ALA C 1 1 3 1528 1 1 21 ALA CA C 2.991 1.636 -5.241 1.00 . A A . 21 ALA CA 1 1 3 1529 1 1 21 ALA CB C 2.272 2.885 -4.708 1.00 . A A . 21 ALA CB 1 1 3 1530 1 1 21 ALA H H 1.013 0.913 -5.700 1.00 . A A . 21 ALA H 1 1 3 1531 1 1 21 ALA HA H 3.617 1.895 -6.083 1.00 . A A . 21 ALA HA 1 1 3 1532 1 1 21 ALA HB1 H 1.448 3.142 -5.357 1.00 . A A . 21 ALA HB1 1 1 3 1533 1 1 21 ALA HB2 H 1.889 2.710 -3.713 1.00 . A A . 21 ALA HB2 1 1 3 1534 1 1 21 ALA HB3 H 2.958 3.719 -4.674 1.00 . A A . 21 ALA HB3 1 1 3 1535 1 1 21 ALA N N 1.955 0.658 -5.702 1.00 . A A . 21 ALA N 1 1 3 1536 1 1 21 ALA O O 5.092 1.157 -4.208 1.00 . A A . 21 ALA O 1 1 3 1537 1 1 22 GLU C C 5.084 -1.205 -2.672 1.00 . A A . 22 GLU C 1 1 3 1538 1 1 22 GLU CA C 4.073 -0.218 -2.077 1.00 . A A . 22 GLU CA 1 1 3 1539 1 1 22 GLU CB C 3.109 -0.950 -1.123 1.00 . A A . 22 GLU CB 1 1 3 1540 1 1 22 GLU CD C 1.085 -0.598 0.322 1.00 . A A . 22 GLU CD 1 1 3 1541 1 1 22 GLU CG C 2.311 0.089 -0.305 1.00 . A A . 22 GLU CG 1 1 3 1542 1 1 22 GLU H H 2.311 0.355 -3.196 1.00 . A A . 22 GLU H 1 1 3 1543 1 1 22 GLU HA H 4.626 0.561 -1.571 1.00 . A A . 22 GLU HA 1 1 3 1544 1 1 22 GLU HB2 H 2.433 -1.573 -1.688 1.00 . A A . 22 GLU HB2 1 1 3 1545 1 1 22 GLU HB3 H 3.670 -1.579 -0.446 1.00 . A A . 22 GLU HB3 1 1 3 1546 1 1 22 GLU HG2 H 2.929 0.494 0.483 1.00 . A A . 22 GLU HG2 1 1 3 1547 1 1 22 GLU HG3 H 1.979 0.901 -0.936 1.00 . A A . 22 GLU HG3 1 1 3 1548 1 1 22 GLU N N 3.284 0.406 -3.186 1.00 . A A . 22 GLU N 1 1 3 1549 1 1 22 GLU O O 6.251 -1.158 -2.343 1.00 . A A . 22 GLU O 1 1 3 1550 1 1 22 GLU OE1 O 1.273 -1.208 1.363 1.00 . A A . 22 GLU OE1 1 1 3 1551 1 1 22 GLU OE2 O 0.027 -0.475 -0.273 1.00 . A A . 22 GLU OE2 1 1 3 1552 1 1 23 ASP C C 6.690 -2.361 -4.826 1.00 . A A . 23 ASP C 1 1 3 1553 1 1 23 ASP CA C 5.494 -3.077 -4.190 1.00 . A A . 23 ASP CA 1 1 3 1554 1 1 23 ASP CB C 4.704 -3.814 -5.279 1.00 . A A . 23 ASP CB 1 1 3 1555 1 1 23 ASP CG C 5.398 -5.153 -5.585 1.00 . A A . 23 ASP CG 1 1 3 1556 1 1 23 ASP H H 3.654 -2.050 -3.752 1.00 . A A . 23 ASP H 1 1 3 1557 1 1 23 ASP HA H 5.852 -3.763 -3.439 1.00 . A A . 23 ASP HA 1 1 3 1558 1 1 23 ASP HB2 H 3.685 -3.981 -4.968 1.00 . A A . 23 ASP HB2 1 1 3 1559 1 1 23 ASP HB3 H 4.672 -3.220 -6.180 1.00 . A A . 23 ASP HB3 1 1 3 1560 1 1 23 ASP N N 4.606 -2.066 -3.536 1.00 . A A . 23 ASP N 1 1 3 1561 1 1 23 ASP O O 7.836 -2.676 -4.583 1.00 . A A . 23 ASP O 1 1 3 1562 1 1 23 ASP OD1 O 6.409 -5.098 -6.268 1.00 . A A . 23 ASP OD1 1 1 3 1563 1 1 23 ASP OD2 O 4.881 -6.153 -5.116 1.00 . A A . 23 ASP OD2 1 1 3 1564 1 1 24 VAL C C 8.387 -0.029 -5.404 1.00 . A A . 24 VAL C 1 1 3 1565 1 1 24 VAL CA C 7.318 -0.553 -6.373 1.00 . A A . 24 VAL CA 1 1 3 1566 1 1 24 VAL CB C 6.481 0.568 -7.030 1.00 . A A . 24 VAL CB 1 1 3 1567 1 1 24 VAL CG1 C 7.332 1.534 -7.835 1.00 . A A . 24 VAL CG1 1 1 3 1568 1 1 24 VAL CG2 C 5.419 -0.066 -7.951 1.00 . A A . 24 VAL CG2 1 1 3 1569 1 1 24 VAL H H 5.384 -1.223 -5.751 1.00 . A A . 24 VAL H 1 1 3 1570 1 1 24 VAL HA H 7.799 -1.162 -7.122 1.00 . A A . 24 VAL HA 1 1 3 1571 1 1 24 VAL HB H 5.978 1.141 -6.271 1.00 . A A . 24 VAL HB 1 1 3 1572 1 1 24 VAL HG11 H 8.033 0.991 -8.449 1.00 . A A . 24 VAL HG11 1 1 3 1573 1 1 24 VAL HG12 H 6.688 2.132 -8.462 1.00 . A A . 24 VAL HG12 1 1 3 1574 1 1 24 VAL HG13 H 7.859 2.186 -7.157 1.00 . A A . 24 VAL HG13 1 1 3 1575 1 1 24 VAL HG21 H 5.275 -1.113 -7.726 1.00 . A A . 24 VAL HG21 1 1 3 1576 1 1 24 VAL HG22 H 4.484 0.448 -7.793 1.00 . A A . 24 VAL HG22 1 1 3 1577 1 1 24 VAL HG23 H 5.700 0.021 -8.989 1.00 . A A . 24 VAL HG23 1 1 3 1578 1 1 24 VAL N N 6.339 -1.398 -5.631 1.00 . A A . 24 VAL N 1 1 3 1579 1 1 24 VAL O O 9.572 -0.172 -5.637 1.00 . A A . 24 VAL O 1 1 3 1580 1 1 25 GLY C C 9.745 0.045 -2.747 1.00 . A A . 25 GLY C 1 1 3 1581 1 1 25 GLY CA C 8.795 1.126 -3.280 1.00 . A A . 25 GLY CA 1 1 3 1582 1 1 25 GLY H H 6.931 0.617 -4.254 1.00 . A A . 25 GLY H 1 1 3 1583 1 1 25 GLY HA2 H 9.368 1.943 -3.693 1.00 . A A . 25 GLY HA2 1 1 3 1584 1 1 25 GLY HA3 H 8.183 1.492 -2.469 1.00 . A A . 25 GLY HA3 1 1 3 1585 1 1 25 GLY N N 7.904 0.556 -4.341 1.00 . A A . 25 GLY N 1 1 3 1586 1 1 25 GLY O O 10.947 0.212 -2.743 1.00 . A A . 25 GLY O 1 1 3 1587 1 1 26 SER C C 11.094 -2.570 -2.733 1.00 . A A . 26 SER C 1 1 3 1588 1 1 26 SER CA C 9.965 -2.187 -1.766 1.00 . A A . 26 SER CA 1 1 3 1589 1 1 26 SER CB C 9.031 -3.397 -1.551 1.00 . A A . 26 SER CB 1 1 3 1590 1 1 26 SER H H 8.191 -1.104 -2.350 1.00 . A A . 26 SER H 1 1 3 1591 1 1 26 SER HA H 10.401 -1.885 -0.829 1.00 . A A . 26 SER HA 1 1 3 1592 1 1 26 SER HB2 H 8.664 -3.798 -2.484 1.00 . A A . 26 SER HB2 1 1 3 1593 1 1 26 SER HB3 H 9.519 -4.174 -0.981 1.00 . A A . 26 SER HB3 1 1 3 1594 1 1 26 SER HG H 7.143 -2.995 -1.318 1.00 . A A . 26 SER HG 1 1 3 1595 1 1 26 SER N N 9.166 -1.044 -2.314 1.00 . A A . 26 SER N 1 1 3 1596 1 1 26 SER O O 12.248 -2.659 -2.364 1.00 . A A . 26 SER O 1 1 3 1597 1 1 26 SER OG O 7.942 -2.879 -0.800 1.00 . A A . 26 SER OG 1 1 3 1598 1 1 27 ASN C C 12.838 -2.191 -5.175 1.00 . A A . 27 ASN C 1 1 3 1599 1 1 27 ASN CA C 11.661 -3.158 -5.037 1.00 . A A . 27 ASN CA 1 1 3 1600 1 1 27 ASN CB C 10.865 -3.238 -6.352 1.00 . A A . 27 ASN CB 1 1 3 1601 1 1 27 ASN CG C 10.105 -4.571 -6.432 1.00 . A A . 27 ASN CG 1 1 3 1602 1 1 27 ASN H H 9.760 -2.688 -4.179 1.00 . A A . 27 ASN H 1 1 3 1603 1 1 27 ASN HA H 12.086 -4.110 -4.767 1.00 . A A . 27 ASN HA 1 1 3 1604 1 1 27 ASN HB2 H 10.146 -2.435 -6.403 1.00 . A A . 27 ASN HB2 1 1 3 1605 1 1 27 ASN HB3 H 11.526 -3.152 -7.196 1.00 . A A . 27 ASN HB3 1 1 3 1606 1 1 27 ASN HD21 H 9.164 -4.297 -4.705 1.00 . A A . 27 ASN HD21 1 1 3 1607 1 1 27 ASN HD22 H 8.789 -5.741 -5.514 1.00 . A A . 27 ASN HD22 1 1 3 1608 1 1 27 ASN N N 10.706 -2.778 -3.961 1.00 . A A . 27 ASN N 1 1 3 1609 1 1 27 ASN ND2 N 9.285 -4.896 -5.470 1.00 . A A . 27 ASN ND2 1 1 3 1610 1 1 27 ASN O O 13.969 -2.589 -4.976 1.00 . A A . 27 ASN O 1 1 3 1611 1 1 27 ASN OD1 O 10.250 -5.326 -7.372 1.00 . A A . 27 ASN OD1 1 1 3 1612 1 1 28 LYS C C 14.503 0.064 -4.360 1.00 . A A . 28 LYS C 1 1 3 1613 1 1 28 LYS CA C 13.680 0.034 -5.654 1.00 . A A . 28 LYS CA 1 1 3 1614 1 1 28 LYS CB C 13.090 1.438 -5.972 1.00 . A A . 28 LYS CB 1 1 3 1615 1 1 28 LYS CD C 11.545 3.321 -5.275 1.00 . A A . 28 LYS CD 1 1 3 1616 1 1 28 LYS CE C 10.379 3.148 -6.267 1.00 . A A . 28 LYS CE 1 1 3 1617 1 1 28 LYS CG C 12.116 1.938 -4.885 1.00 . A A . 28 LYS CG 1 1 3 1618 1 1 28 LYS H H 11.630 -0.695 -5.640 1.00 . A A . 28 LYS H 1 1 3 1619 1 1 28 LYS HA H 14.329 -0.284 -6.465 1.00 . A A . 28 LYS HA 1 1 3 1620 1 1 28 LYS HB2 H 13.901 2.143 -6.083 1.00 . A A . 28 LYS HB2 1 1 3 1621 1 1 28 LYS HB3 H 12.567 1.374 -6.916 1.00 . A A . 28 LYS HB3 1 1 3 1622 1 1 28 LYS HD2 H 11.183 3.819 -4.388 1.00 . A A . 28 LYS HD2 1 1 3 1623 1 1 28 LYS HD3 H 12.316 3.937 -5.719 1.00 . A A . 28 LYS HD3 1 1 3 1624 1 1 28 LYS HE2 H 10.735 2.769 -7.214 1.00 . A A . 28 LYS HE2 1 1 3 1625 1 1 28 LYS HE3 H 9.648 2.462 -5.868 1.00 . A A . 28 LYS HE3 1 1 3 1626 1 1 28 LYS HG2 H 11.309 1.233 -4.788 1.00 . A A . 28 LYS HG2 1 1 3 1627 1 1 28 LYS HG3 H 12.623 2.020 -3.935 1.00 . A A . 28 LYS HG3 1 1 3 1628 1 1 28 LYS HZ1 H 10.181 5.198 -5.945 1.00 . A A . 28 LYS HZ1 1 1 3 1629 1 1 28 LYS HZ2 H 9.765 4.698 -7.513 1.00 . A A . 28 LYS HZ2 1 1 3 1630 1 1 28 LYS HZ3 H 8.711 4.391 -6.217 1.00 . A A . 28 LYS HZ3 1 1 3 1631 1 1 28 LYS N N 12.563 -0.954 -5.504 1.00 . A A . 28 LYS N 1 1 3 1632 1 1 28 LYS NZ N 9.709 4.458 -6.503 1.00 . A A . 28 LYS NZ 1 1 3 1633 1 1 28 LYS O O 15.708 0.180 -4.418 1.00 . A A . 28 LYS O 1 1 3 1634 1 1 29 GLY C C 15.626 -1.164 -1.922 1.00 . A A . 29 GLY C 1 1 3 1635 1 1 29 GLY CA C 14.583 -0.036 -1.927 1.00 . A A . 29 GLY CA 1 1 3 1636 1 1 29 GLY H H 12.879 -0.133 -3.217 1.00 . A A . 29 GLY H 1 1 3 1637 1 1 29 GLY HA2 H 15.075 0.918 -1.796 1.00 . A A . 29 GLY HA2 1 1 3 1638 1 1 29 GLY HA3 H 13.879 -0.198 -1.124 1.00 . A A . 29 GLY HA3 1 1 3 1639 1 1 29 GLY N N 13.853 -0.048 -3.228 1.00 . A A . 29 GLY N 1 1 3 1640 1 1 29 GLY O O 16.801 -0.917 -1.738 1.00 . A A . 29 GLY O 1 1 3 1641 1 1 30 ALA C C 17.235 -3.335 -3.172 1.00 . A A . 30 ALA C 1 1 3 1642 1 1 30 ALA CA C 16.108 -3.550 -2.152 1.00 . A A . 30 ALA CA 1 1 3 1643 1 1 30 ALA CB C 15.310 -4.811 -2.509 1.00 . A A . 30 ALA CB 1 1 3 1644 1 1 30 ALA H H 14.210 -2.510 -2.291 1.00 . A A . 30 ALA H 1 1 3 1645 1 1 30 ALA HA H 16.554 -3.644 -1.172 1.00 . A A . 30 ALA HA 1 1 3 1646 1 1 30 ALA HB1 H 14.523 -4.965 -1.784 1.00 . A A . 30 ALA HB1 1 1 3 1647 1 1 30 ALA HB2 H 14.863 -4.708 -3.486 1.00 . A A . 30 ALA HB2 1 1 3 1648 1 1 30 ALA HB3 H 15.958 -5.675 -2.508 1.00 . A A . 30 ALA HB3 1 1 3 1649 1 1 30 ALA N N 15.170 -2.376 -2.137 1.00 . A A . 30 ALA N 1 1 3 1650 1 1 30 ALA O O 18.396 -3.561 -2.898 1.00 . A A . 30 ALA O 1 1 3 1651 1 1 31 ILE C C 18.884 -1.672 -4.962 1.00 . A A . 31 ILE C 1 1 3 1652 1 1 31 ILE CA C 17.782 -2.621 -5.451 1.00 . A A . 31 ILE CA 1 1 3 1653 1 1 31 ILE CB C 16.882 -2.049 -6.586 1.00 . A A . 31 ILE CB 1 1 3 1654 1 1 31 ILE CD1 C 15.127 -2.765 -8.304 1.00 . A A . 31 ILE CD1 1 1 3 1655 1 1 31 ILE CG1 C 16.149 -3.243 -7.254 1.00 . A A . 31 ILE CG1 1 1 3 1656 1 1 31 ILE CG2 C 17.661 -1.211 -7.614 1.00 . A A . 31 ILE CG2 1 1 3 1657 1 1 31 ILE H H 15.888 -2.739 -4.496 1.00 . A A . 31 ILE H 1 1 3 1658 1 1 31 ILE HA H 18.256 -3.554 -5.723 1.00 . A A . 31 ILE HA 1 1 3 1659 1 1 31 ILE HB H 16.138 -1.408 -6.142 1.00 . A A . 31 ILE HB 1 1 3 1660 1 1 31 ILE HD11 H 14.601 -1.889 -7.956 1.00 . A A . 31 ILE HD11 1 1 3 1661 1 1 31 ILE HD12 H 15.629 -2.528 -9.231 1.00 . A A . 31 ILE HD12 1 1 3 1662 1 1 31 ILE HD13 H 14.406 -3.546 -8.493 1.00 . A A . 31 ILE HD13 1 1 3 1663 1 1 31 ILE HG12 H 16.874 -3.901 -7.703 1.00 . A A . 31 ILE HG12 1 1 3 1664 1 1 31 ILE HG13 H 15.622 -3.804 -6.496 1.00 . A A . 31 ILE HG13 1 1 3 1665 1 1 31 ILE HG21 H 18.453 -1.792 -8.058 1.00 . A A . 31 ILE HG21 1 1 3 1666 1 1 31 ILE HG22 H 16.989 -0.874 -8.390 1.00 . A A . 31 ILE HG22 1 1 3 1667 1 1 31 ILE HG23 H 18.075 -0.340 -7.131 1.00 . A A . 31 ILE HG23 1 1 3 1668 1 1 31 ILE N N 16.838 -2.895 -4.335 1.00 . A A . 31 ILE N 1 1 3 1669 1 1 31 ILE O O 20.055 -1.985 -5.031 1.00 . A A . 31 ILE O 1 1 3 1670 1 1 32 ILE C C 20.357 -0.222 -2.899 1.00 . A A . 32 ILE C 1 1 3 1671 1 1 32 ILE CA C 19.489 0.456 -3.962 1.00 . A A . 32 ILE CA 1 1 3 1672 1 1 32 ILE CB C 18.725 1.667 -3.370 1.00 . A A . 32 ILE CB 1 1 3 1673 1 1 32 ILE CD1 C 16.733 3.146 -3.912 1.00 . A A . 32 ILE CD1 1 1 3 1674 1 1 32 ILE CG1 C 17.897 2.332 -4.506 1.00 . A A . 32 ILE CG1 1 1 3 1675 1 1 32 ILE CG2 C 19.733 2.695 -2.798 1.00 . A A . 32 ILE CG2 1 1 3 1676 1 1 32 ILE H H 17.538 -0.319 -4.432 1.00 . A A . 32 ILE H 1 1 3 1677 1 1 32 ILE HA H 20.129 0.743 -4.780 1.00 . A A . 32 ILE HA 1 1 3 1678 1 1 32 ILE HB H 18.069 1.327 -2.582 1.00 . A A . 32 ILE HB 1 1 3 1679 1 1 32 ILE HD11 H 16.169 2.545 -3.213 1.00 . A A . 32 ILE HD11 1 1 3 1680 1 1 32 ILE HD12 H 17.110 4.018 -3.398 1.00 . A A . 32 ILE HD12 1 1 3 1681 1 1 32 ILE HD13 H 16.073 3.470 -4.702 1.00 . A A . 32 ILE HD13 1 1 3 1682 1 1 32 ILE HG12 H 18.533 2.973 -5.095 1.00 . A A . 32 ILE HG12 1 1 3 1683 1 1 32 ILE HG13 H 17.494 1.579 -5.165 1.00 . A A . 32 ILE HG13 1 1 3 1684 1 1 32 ILE HG21 H 20.499 2.918 -3.526 1.00 . A A . 32 ILE HG21 1 1 3 1685 1 1 32 ILE HG22 H 19.227 3.613 -2.537 1.00 . A A . 32 ILE HG22 1 1 3 1686 1 1 32 ILE HG23 H 20.201 2.300 -1.910 1.00 . A A . 32 ILE HG23 1 1 3 1687 1 1 32 ILE N N 18.489 -0.530 -4.468 1.00 . A A . 32 ILE N 1 1 3 1688 1 1 32 ILE O O 21.553 -0.034 -2.872 1.00 . A A . 32 ILE O 1 1 3 1689 1 1 33 GLY C C 21.609 -2.559 -1.547 1.00 . A A . 33 GLY C 1 1 3 1690 1 1 33 GLY CA C 20.461 -1.718 -0.981 1.00 . A A . 33 GLY CA 1 1 3 1691 1 1 33 GLY H H 18.759 -1.109 -2.139 1.00 . A A . 33 GLY H 1 1 3 1692 1 1 33 GLY HA2 H 20.863 -0.991 -0.289 1.00 . A A . 33 GLY HA2 1 1 3 1693 1 1 33 GLY HA3 H 19.775 -2.367 -0.459 1.00 . A A . 33 GLY HA3 1 1 3 1694 1 1 33 GLY N N 19.726 -1.000 -2.060 1.00 . A A . 33 GLY N 1 1 3 1695 1 1 33 GLY O O 22.736 -2.411 -1.116 1.00 . A A . 33 GLY O 1 1 3 1696 1 1 34 LEU C C 23.500 -3.380 -3.731 1.00 . A A . 34 LEU C 1 1 3 1697 1 1 34 LEU CA C 22.413 -4.252 -3.076 1.00 . A A . 34 LEU CA 1 1 3 1698 1 1 34 LEU CB C 21.769 -5.266 -4.092 1.00 . A A . 34 LEU CB 1 1 3 1699 1 1 34 LEU CD1 C 22.801 -5.066 -6.418 1.00 . A A . 34 LEU CD1 1 1 3 1700 1 1 34 LEU CD2 C 20.312 -5.332 -6.158 1.00 . A A . 34 LEU CD2 1 1 3 1701 1 1 34 LEU CG C 21.580 -4.709 -5.533 1.00 . A A . 34 LEU CG 1 1 3 1702 1 1 34 LEU H H 20.391 -3.480 -2.821 1.00 . A A . 34 LEU H 1 1 3 1703 1 1 34 LEU HA H 22.867 -4.799 -2.263 1.00 . A A . 34 LEU HA 1 1 3 1704 1 1 34 LEU HB2 H 22.386 -6.153 -4.130 1.00 . A A . 34 LEU HB2 1 1 3 1705 1 1 34 LEU HB3 H 20.808 -5.561 -3.695 1.00 . A A . 34 LEU HB3 1 1 3 1706 1 1 34 LEU HD11 H 22.980 -6.132 -6.405 1.00 . A A . 34 LEU HD11 1 1 3 1707 1 1 34 LEU HD12 H 22.619 -4.759 -7.436 1.00 . A A . 34 LEU HD12 1 1 3 1708 1 1 34 LEU HD13 H 23.687 -4.562 -6.064 1.00 . A A . 34 LEU HD13 1 1 3 1709 1 1 34 LEU HD21 H 19.492 -5.300 -5.457 1.00 . A A . 34 LEU HD21 1 1 3 1710 1 1 34 LEU HD22 H 20.030 -4.783 -7.045 1.00 . A A . 34 LEU HD22 1 1 3 1711 1 1 34 LEU HD23 H 20.490 -6.362 -6.431 1.00 . A A . 34 LEU HD23 1 1 3 1712 1 1 34 LEU HG H 21.462 -3.643 -5.501 1.00 . A A . 34 LEU HG 1 1 3 1713 1 1 34 LEU N N 21.316 -3.410 -2.501 1.00 . A A . 34 LEU N 1 1 3 1714 1 1 34 LEU O O 24.674 -3.684 -3.627 1.00 . A A . 34 LEU O 1 1 3 1715 1 1 35 MET C C 25.025 -0.847 -3.972 1.00 . A A . 35 MET C 1 1 3 1716 1 1 35 MET CA C 24.080 -1.413 -5.047 1.00 . A A . 35 MET CA 1 1 3 1717 1 1 35 MET CB C 23.318 -0.271 -5.752 1.00 . A A . 35 MET CB 1 1 3 1718 1 1 35 MET CE C 21.418 1.665 -7.367 1.00 . A A . 35 MET CE 1 1 3 1719 1 1 35 MET CG C 22.532 -0.815 -6.967 1.00 . A A . 35 MET CG 1 1 3 1720 1 1 35 MET H H 22.130 -2.123 -4.454 1.00 . A A . 35 MET H 1 1 3 1721 1 1 35 MET HA H 24.658 -1.981 -5.757 1.00 . A A . 35 MET HA 1 1 3 1722 1 1 35 MET HB2 H 22.633 0.197 -5.062 1.00 . A A . 35 MET HB2 1 1 3 1723 1 1 35 MET HB3 H 24.022 0.477 -6.090 1.00 . A A . 35 MET HB3 1 1 3 1724 1 1 35 MET HE1 H 22.338 1.767 -7.924 1.00 . A A . 35 MET HE1 1 1 3 1725 1 1 35 MET HE2 H 20.645 2.247 -7.845 1.00 . A A . 35 MET HE2 1 1 3 1726 1 1 35 MET HE3 H 21.564 2.022 -6.359 1.00 . A A . 35 MET HE3 1 1 3 1727 1 1 35 MET HG2 H 23.148 -0.690 -7.846 1.00 . A A . 35 MET HG2 1 1 3 1728 1 1 35 MET HG3 H 22.369 -1.876 -6.841 1.00 . A A . 35 MET HG3 1 1 3 1729 1 1 35 MET N N 23.089 -2.320 -4.386 1.00 . A A . 35 MET N 1 1 3 1730 1 1 35 MET O O 26.231 -0.942 -4.082 1.00 . A A . 35 MET O 1 1 3 1731 1 1 35 MET SD S 20.919 -0.075 -7.326 1.00 . A A . 35 MET SD 1 1 3 1732 1 1 36 VAL C C 26.110 -0.686 -1.176 1.00 . A A . 36 VAL C 1 1 3 1733 1 1 36 VAL CA C 25.140 0.329 -1.805 1.00 . A A . 36 VAL CA 1 1 3 1734 1 1 36 VAL CB C 24.068 0.807 -0.776 1.00 . A A . 36 VAL CB 1 1 3 1735 1 1 36 VAL CG1 C 24.727 1.186 0.573 1.00 . A A . 36 VAL CG1 1 1 3 1736 1 1 36 VAL CG2 C 23.347 2.055 -1.340 1.00 . A A . 36 VAL CG2 1 1 3 1737 1 1 36 VAL H H 23.442 -0.261 -2.964 1.00 . A A . 36 VAL H 1 1 3 1738 1 1 36 VAL HA H 25.710 1.173 -2.167 1.00 . A A . 36 VAL HA 1 1 3 1739 1 1 36 VAL HB H 23.339 0.024 -0.610 1.00 . A A . 36 VAL HB 1 1 3 1740 1 1 36 VAL HG11 H 25.584 1.824 0.408 1.00 . A A . 36 VAL HG11 1 1 3 1741 1 1 36 VAL HG12 H 24.020 1.711 1.200 1.00 . A A . 36 VAL HG12 1 1 3 1742 1 1 36 VAL HG13 H 25.050 0.297 1.094 1.00 . A A . 36 VAL HG13 1 1 3 1743 1 1 36 VAL HG21 H 23.081 1.907 -2.376 1.00 . A A . 36 VAL HG21 1 1 3 1744 1 1 36 VAL HG22 H 22.446 2.244 -0.776 1.00 . A A . 36 VAL HG22 1 1 3 1745 1 1 36 VAL HG23 H 23.988 2.922 -1.271 1.00 . A A . 36 VAL HG23 1 1 3 1746 1 1 36 VAL N N 24.415 -0.283 -2.961 1.00 . A A . 36 VAL N 1 1 3 1747 1 1 36 VAL O O 27.253 -0.356 -0.922 1.00 . A A . 36 VAL O 1 1 3 1748 1 1 37 GLY C C 27.822 -3.129 -1.000 1.00 . A A . 37 GLY C 1 1 3 1749 1 1 37 GLY CA C 26.440 -2.978 -0.342 1.00 . A A . 37 GLY CA 1 1 3 1750 1 1 37 GLY H H 24.681 -2.061 -1.167 1.00 . A A . 37 GLY H 1 1 3 1751 1 1 37 GLY HA2 H 26.574 -2.770 0.711 1.00 . A A . 37 GLY HA2 1 1 3 1752 1 1 37 GLY HA3 H 25.902 -3.908 -0.448 1.00 . A A . 37 GLY HA3 1 1 3 1753 1 1 37 GLY N N 25.617 -1.881 -0.947 1.00 . A A . 37 GLY N 1 1 3 1754 1 1 37 GLY O O 28.757 -3.578 -0.367 1.00 . A A . 37 GLY O 1 1 3 1755 1 1 38 GLY C C 29.367 -4.249 -3.565 1.00 . A A . 38 GLY C 1 1 3 1756 1 1 38 GLY CA C 29.190 -2.843 -3.003 1.00 . A A . 38 GLY CA 1 1 3 1757 1 1 38 GLY H H 27.115 -2.403 -2.713 1.00 . A A . 38 GLY H 1 1 3 1758 1 1 38 GLY HA2 H 29.169 -2.137 -3.821 1.00 . A A . 38 GLY HA2 1 1 3 1759 1 1 38 GLY HA3 H 30.015 -2.608 -2.347 1.00 . A A . 38 GLY HA3 1 1 3 1760 1 1 38 GLY N N 27.905 -2.749 -2.252 1.00 . A A . 38 GLY N 1 1 3 1761 1 1 38 GLY O O 30.478 -4.732 -3.679 1.00 . A A . 38 GLY O 1 1 3 1762 1 1 39 VAL C C 28.548 -6.192 -5.986 1.00 . A A . 39 VAL C 1 1 3 1763 1 1 39 VAL CA C 28.290 -6.248 -4.466 1.00 . A A . 39 VAL CA 1 1 3 1764 1 1 39 VAL CB C 26.922 -6.946 -4.154 1.00 . A A . 39 VAL CB 1 1 3 1765 1 1 39 VAL CG1 C 27.114 -8.481 -4.161 1.00 . A A . 39 VAL CG1 1 1 3 1766 1 1 39 VAL CG2 C 26.407 -6.535 -2.749 1.00 . A A . 39 VAL CG2 1 1 3 1767 1 1 39 VAL H H 27.395 -4.426 -3.787 1.00 . A A . 39 VAL H 1 1 3 1768 1 1 39 VAL HA H 29.108 -6.775 -4.006 1.00 . A A . 39 VAL HA 1 1 3 1769 1 1 39 VAL HB H 26.188 -6.672 -4.898 1.00 . A A . 39 VAL HB 1 1 3 1770 1 1 39 VAL HG11 H 27.861 -8.770 -3.435 1.00 . A A . 39 VAL HG11 1 1 3 1771 1 1 39 VAL HG12 H 26.185 -8.972 -3.914 1.00 . A A . 39 VAL HG12 1 1 3 1772 1 1 39 VAL HG13 H 27.431 -8.822 -5.136 1.00 . A A . 39 VAL HG13 1 1 3 1773 1 1 39 VAL HG21 H 27.190 -6.650 -2.013 1.00 . A A . 39 VAL HG21 1 1 3 1774 1 1 39 VAL HG22 H 26.088 -5.503 -2.755 1.00 . A A . 39 VAL HG22 1 1 3 1775 1 1 39 VAL HG23 H 25.566 -7.148 -2.461 1.00 . A A . 39 VAL HG23 1 1 3 1776 1 1 39 VAL N N 28.260 -4.865 -3.902 1.00 . A A . 39 VAL N 1 1 3 1777 1 1 39 VAL O O 28.212 -7.096 -6.726 1.00 . A A . 39 VAL O 1 1 3 1778 1 1 40 VAL C C 30.583 -5.856 -8.277 1.00 . A A . 40 VAL C 1 1 3 1779 1 1 40 VAL CA C 29.486 -4.869 -7.828 1.00 . A A . 40 VAL CA 1 1 3 1780 1 1 40 VAL CB C 29.974 -3.402 -7.990 1.00 . A A . 40 VAL CB 1 1 3 1781 1 1 40 VAL CG1 C 30.223 -3.088 -9.484 1.00 . A A . 40 VAL CG1 1 1 3 1782 1 1 40 VAL CG2 C 28.902 -2.434 -7.442 1.00 . A A . 40 VAL CG2 1 1 3 1783 1 1 40 VAL H H 29.386 -4.425 -5.725 1.00 . A A . 40 VAL H 1 1 3 1784 1 1 40 VAL HA H 28.593 -5.029 -8.419 1.00 . A A . 40 VAL HA 1 1 3 1785 1 1 40 VAL HB H 30.892 -3.262 -7.438 1.00 . A A . 40 VAL HB 1 1 3 1786 1 1 40 VAL HG11 H 29.355 -3.342 -10.075 1.00 . A A . 40 VAL HG11 1 1 3 1787 1 1 40 VAL HG12 H 30.436 -2.036 -9.612 1.00 . A A . 40 VAL HG12 1 1 3 1788 1 1 40 VAL HG13 H 31.069 -3.654 -9.847 1.00 . A A . 40 VAL HG13 1 1 3 1789 1 1 40 VAL HG21 H 27.943 -2.638 -7.894 1.00 . A A . 40 VAL HG21 1 1 3 1790 1 1 40 VAL HG22 H 28.812 -2.546 -6.370 1.00 . A A . 40 VAL HG22 1 1 3 1791 1 1 40 VAL HG23 H 29.177 -1.412 -7.656 1.00 . A A . 40 VAL HG23 1 1 3 1792 1 1 40 VAL N N 29.151 -5.103 -6.390 1.00 . A A . 40 VAL N 1 1 3 1793 1 1 40 VAL O O 31.547 -5.976 -7.537 1.00 . A A . 40 VAL O 1 1 3 1794 1 1 40 VAL OXT O 30.394 -6.435 -9.334 1.00 . A A . 40 VAL OXT 1 1 4 1795 1 1 1 ASP C C -11.422 -8.248 -17.973 1.00 . A A . 1 ASP C 1 1 4 1796 1 1 1 ASP CA C -11.042 -6.769 -17.794 1.00 . A A . 1 ASP CA 1 1 4 1797 1 1 1 ASP CB C -12.285 -5.970 -17.329 1.00 . A A . 1 ASP CB 1 1 4 1798 1 1 1 ASP CG C -13.440 -6.155 -18.333 1.00 . A A . 1 ASP CG 1 1 4 1799 1 1 1 ASP H1 H -10.537 -6.930 -19.811 1.00 . A A . 1 ASP H1 1 1 4 1800 1 1 1 ASP H2 H -11.131 -5.404 -19.366 1.00 . A A . 1 ASP H2 1 1 4 1801 1 1 1 ASP H3 H -9.553 -5.860 -18.934 1.00 . A A . 1 ASP H3 1 1 4 1802 1 1 1 ASP HA H -10.262 -6.700 -17.051 1.00 . A A . 1 ASP HA 1 1 4 1803 1 1 1 ASP HB2 H -12.601 -6.309 -16.352 1.00 . A A . 1 ASP HB2 1 1 4 1804 1 1 1 ASP HB3 H -12.042 -4.919 -17.262 1.00 . A A . 1 ASP HB3 1 1 4 1805 1 1 1 ASP N N -10.526 -6.198 -19.073 1.00 . A A . 1 ASP N 1 1 4 1806 1 1 1 ASP O O -11.437 -8.759 -19.077 1.00 . A A . 1 ASP O 1 1 4 1807 1 1 1 ASP OD1 O -13.400 -5.466 -19.340 1.00 . A A . 1 ASP OD1 1 1 4 1808 1 1 1 ASP OD2 O -14.294 -6.974 -18.037 1.00 . A A . 1 ASP OD2 1 1 4 1809 1 1 2 ALA C C -13.468 -10.487 -16.156 1.00 . A A . 2 ALA C 1 1 4 1810 1 1 2 ALA CA C -12.111 -10.325 -16.860 1.00 . A A . 2 ALA CA 1 1 4 1811 1 1 2 ALA CB C -11.015 -11.115 -16.129 1.00 . A A . 2 ALA CB 1 1 4 1812 1 1 2 ALA H H -11.683 -8.392 -16.015 1.00 . A A . 2 ALA H 1 1 4 1813 1 1 2 ALA HA H -12.211 -10.681 -17.875 1.00 . A A . 2 ALA HA 1 1 4 1814 1 1 2 ALA HB1 H -10.059 -10.930 -16.594 1.00 . A A . 2 ALA HB1 1 1 4 1815 1 1 2 ALA HB2 H -10.965 -10.812 -15.093 1.00 . A A . 2 ALA HB2 1 1 4 1816 1 1 2 ALA HB3 H -11.228 -12.172 -16.175 1.00 . A A . 2 ALA HB3 1 1 4 1817 1 1 2 ALA N N -11.718 -8.879 -16.864 1.00 . A A . 2 ALA N 1 1 4 1818 1 1 2 ALA O O -13.726 -11.476 -15.495 1.00 . A A . 2 ALA O 1 1 4 1819 1 1 3 GLU C C -15.575 -9.634 -14.208 1.00 . A A . 3 GLU C 1 1 4 1820 1 1 3 GLU CA C -15.664 -9.450 -15.736 1.00 . A A . 3 GLU CA 1 1 4 1821 1 1 3 GLU CB C -16.523 -10.578 -16.397 1.00 . A A . 3 GLU CB 1 1 4 1822 1 1 3 GLU CD C -18.557 -10.048 -14.979 1.00 . A A . 3 GLU CD 1 1 4 1823 1 1 3 GLU CG C -18.017 -10.173 -16.418 1.00 . A A . 3 GLU CG 1 1 4 1824 1 1 3 GLU H H -13.992 -8.734 -16.890 1.00 . A A . 3 GLU H 1 1 4 1825 1 1 3 GLU HA H -16.094 -8.480 -15.941 1.00 . A A . 3 GLU HA 1 1 4 1826 1 1 3 GLU HB2 H -16.195 -10.724 -17.416 1.00 . A A . 3 GLU HB2 1 1 4 1827 1 1 3 GLU HB3 H -16.404 -11.515 -15.872 1.00 . A A . 3 GLU HB3 1 1 4 1828 1 1 3 GLU HG2 H -18.143 -9.230 -16.930 1.00 . A A . 3 GLU HG2 1 1 4 1829 1 1 3 GLU HG3 H -18.590 -10.925 -16.942 1.00 . A A . 3 GLU HG3 1 1 4 1830 1 1 3 GLU N N -14.293 -9.485 -16.338 1.00 . A A . 3 GLU N 1 1 4 1831 1 1 3 GLU O O -15.991 -10.632 -13.651 1.00 . A A . 3 GLU O 1 1 4 1832 1 1 3 GLU OE1 O -18.886 -11.087 -14.430 1.00 . A A . 3 GLU OE1 1 1 4 1833 1 1 3 GLU OE2 O -18.607 -8.923 -14.508 1.00 . A A . 3 GLU OE2 1 1 4 1834 1 1 4 PHE C C -14.577 -7.190 -11.653 1.00 . A A . 4 PHE C 1 1 4 1835 1 1 4 PHE CA C -14.844 -8.634 -12.101 1.00 . A A . 4 PHE CA 1 1 4 1836 1 1 4 PHE CB C -13.655 -9.561 -11.746 1.00 . A A . 4 PHE CB 1 1 4 1837 1 1 4 PHE CD1 C -14.338 -10.438 -9.464 1.00 . A A . 4 PHE CD1 1 1 4 1838 1 1 4 PHE CD2 C -12.488 -8.938 -9.581 1.00 . A A . 4 PHE CD2 1 1 4 1839 1 1 4 PHE CE1 C -14.187 -10.515 -8.094 1.00 . A A . 4 PHE CE1 1 1 4 1840 1 1 4 PHE CE2 C -12.337 -9.014 -8.213 1.00 . A A . 4 PHE CE2 1 1 4 1841 1 1 4 PHE CG C -13.489 -9.648 -10.219 1.00 . A A . 4 PHE CG 1 1 4 1842 1 1 4 PHE CZ C -13.188 -9.803 -7.469 1.00 . A A . 4 PHE CZ 1 1 4 1843 1 1 4 PHE H H -14.703 -7.858 -14.099 1.00 . A A . 4 PHE H 1 1 4 1844 1 1 4 PHE HA H -15.755 -8.987 -11.639 1.00 . A A . 4 PHE HA 1 1 4 1845 1 1 4 PHE HB2 H -13.832 -10.555 -12.129 1.00 . A A . 4 PHE HB2 1 1 4 1846 1 1 4 PHE HB3 H -12.742 -9.182 -12.182 1.00 . A A . 4 PHE HB3 1 1 4 1847 1 1 4 PHE HD1 H -15.125 -10.999 -9.946 1.00 . A A . 4 PHE HD1 1 1 4 1848 1 1 4 PHE HD2 H -11.817 -8.318 -10.157 1.00 . A A . 4 PHE HD2 1 1 4 1849 1 1 4 PHE HE1 H -14.854 -11.133 -7.512 1.00 . A A . 4 PHE HE1 1 1 4 1850 1 1 4 PHE HE2 H -11.553 -8.456 -7.724 1.00 . A A . 4 PHE HE2 1 1 4 1851 1 1 4 PHE HZ H -13.069 -9.864 -6.396 1.00 . A A . 4 PHE HZ 1 1 4 1852 1 1 4 PHE N N -15.016 -8.629 -13.584 1.00 . A A . 4 PHE N 1 1 4 1853 1 1 4 PHE O O -13.451 -6.731 -11.645 1.00 . A A . 4 PHE O 1 1 4 1854 1 1 5 ARG C C -16.746 -4.721 -9.964 1.00 . A A . 5 ARG C 1 1 4 1855 1 1 5 ARG CA C -15.538 -5.096 -10.839 1.00 . A A . 5 ARG CA 1 1 4 1856 1 1 5 ARG CB C -15.455 -4.188 -12.103 1.00 . A A . 5 ARG CB 1 1 4 1857 1 1 5 ARG CD C -14.188 -2.306 -13.196 1.00 . A A . 5 ARG CD 1 1 4 1858 1 1 5 ARG CG C -14.219 -3.270 -11.998 1.00 . A A . 5 ARG CG 1 1 4 1859 1 1 5 ARG CZ C -15.558 -0.416 -13.949 1.00 . A A . 5 ARG CZ 1 1 4 1860 1 1 5 ARG H H -16.518 -6.955 -11.336 1.00 . A A . 5 ARG H 1 1 4 1861 1 1 5 ARG HA H -14.656 -5.004 -10.225 1.00 . A A . 5 ARG HA 1 1 4 1862 1 1 5 ARG HB2 H -15.361 -4.800 -12.990 1.00 . A A . 5 ARG HB2 1 1 4 1863 1 1 5 ARG HB3 H -16.348 -3.589 -12.207 1.00 . A A . 5 ARG HB3 1 1 4 1864 1 1 5 ARG HD2 H -13.247 -1.778 -13.226 1.00 . A A . 5 ARG HD2 1 1 4 1865 1 1 5 ARG HD3 H -14.326 -2.844 -14.123 1.00 . A A . 5 ARG HD3 1 1 4 1866 1 1 5 ARG HE H -15.842 -1.338 -12.216 1.00 . A A . 5 ARG HE 1 1 4 1867 1 1 5 ARG HG2 H -14.258 -2.707 -11.077 1.00 . A A . 5 ARG HG2 1 1 4 1868 1 1 5 ARG HG3 H -13.321 -3.870 -11.997 1.00 . A A . 5 ARG HG3 1 1 4 1869 1 1 5 ARG HH11 H -14.100 -1.006 -15.194 1.00 . A A . 5 ARG HH11 1 1 4 1870 1 1 5 ARG HH12 H -15.056 0.329 -15.739 1.00 . A A . 5 ARG HH12 1 1 4 1871 1 1 5 ARG HH21 H -17.068 0.351 -12.885 1.00 . A A . 5 ARG HH21 1 1 4 1872 1 1 5 ARG HH22 H -16.765 1.112 -14.412 1.00 . A A . 5 ARG HH22 1 1 4 1873 1 1 5 ARG N N -15.642 -6.518 -11.299 1.00 . A A . 5 ARG N 1 1 4 1874 1 1 5 ARG NE N -15.298 -1.315 -13.031 1.00 . A A . 5 ARG NE 1 1 4 1875 1 1 5 ARG NH1 N -14.849 -0.361 -15.046 1.00 . A A . 5 ARG NH1 1 1 4 1876 1 1 5 ARG NH2 N -16.540 0.413 -13.731 1.00 . A A . 5 ARG NH2 1 1 4 1877 1 1 5 ARG O O -17.143 -3.573 -9.888 1.00 . A A . 5 ARG O 1 1 4 1878 1 1 6 HIS C C -18.561 -6.756 -7.489 1.00 . A A . 6 HIS C 1 1 4 1879 1 1 6 HIS CA C -18.469 -5.543 -8.429 1.00 . A A . 6 HIS CA 1 1 4 1880 1 1 6 HIS CB C -19.739 -5.415 -9.312 1.00 . A A . 6 HIS CB 1 1 4 1881 1 1 6 HIS CD2 C -21.604 -3.583 -8.875 1.00 . A A . 6 HIS CD2 1 1 4 1882 1 1 6 HIS CE1 C -22.182 -4.181 -6.976 1.00 . A A . 6 HIS CE1 1 1 4 1883 1 1 6 HIS CG C -20.837 -4.683 -8.530 1.00 . A A . 6 HIS CG 1 1 4 1884 1 1 6 HIS H H -16.904 -6.617 -9.434 1.00 . A A . 6 HIS H 1 1 4 1885 1 1 6 HIS HA H -18.311 -4.658 -7.831 1.00 . A A . 6 HIS HA 1 1 4 1886 1 1 6 HIS HB2 H -19.520 -4.848 -10.205 1.00 . A A . 6 HIS HB2 1 1 4 1887 1 1 6 HIS HB3 H -20.107 -6.388 -9.603 1.00 . A A . 6 HIS HB3 1 1 4 1888 1 1 6 HIS HD1 H -20.906 -5.742 -6.808 1.00 . A A . 6 HIS HD1 1 1 4 1889 1 1 6 HIS HD2 H -21.532 -3.048 -9.810 1.00 . A A . 6 HIS HD2 1 1 4 1890 1 1 6 HIS HE1 H -22.690 -4.232 -6.023 1.00 . A A . 6 HIS HE1 1 1 4 1891 1 1 6 HIS N N -17.287 -5.725 -9.324 1.00 . A A . 6 HIS N 1 1 4 1892 1 1 6 HIS ND1 N -21.249 -4.997 -7.345 1.00 . A A . 6 HIS ND1 1 1 4 1893 1 1 6 HIS NE2 N -22.436 -3.284 -7.896 1.00 . A A . 6 HIS NE2 1 1 4 1894 1 1 6 HIS O O -19.603 -7.360 -7.318 1.00 . A A . 6 HIS O 1 1 4 1895 1 1 7 ASP C C -18.181 -7.978 -4.698 1.00 . A A . 7 ASP C 1 1 4 1896 1 1 7 ASP CA C -17.338 -8.215 -5.959 1.00 . A A . 7 ASP CA 1 1 4 1897 1 1 7 ASP CB C -15.859 -8.396 -5.596 1.00 . A A . 7 ASP CB 1 1 4 1898 1 1 7 ASP CG C -15.318 -7.141 -4.882 1.00 . A A . 7 ASP CG 1 1 4 1899 1 1 7 ASP H H -16.626 -6.547 -7.077 1.00 . A A . 7 ASP H 1 1 4 1900 1 1 7 ASP HA H -17.696 -9.102 -6.462 1.00 . A A . 7 ASP HA 1 1 4 1901 1 1 7 ASP HB2 H -15.740 -9.252 -4.955 1.00 . A A . 7 ASP HB2 1 1 4 1902 1 1 7 ASP HB3 H -15.288 -8.558 -6.498 1.00 . A A . 7 ASP HB3 1 1 4 1903 1 1 7 ASP N N -17.434 -7.069 -6.902 1.00 . A A . 7 ASP N 1 1 4 1904 1 1 7 ASP O O -18.213 -6.880 -4.177 1.00 . A A . 7 ASP O 1 1 4 1905 1 1 7 ASP OD1 O -14.894 -6.253 -5.604 1.00 . A A . 7 ASP OD1 1 1 4 1906 1 1 7 ASP OD2 O -15.361 -7.139 -3.661 1.00 . A A . 7 ASP OD2 1 1 4 1907 1 1 8 SER C C -18.788 -8.773 -1.793 1.00 . A A . 8 SER C 1 1 4 1908 1 1 8 SER CA C -19.689 -8.938 -3.033 1.00 . A A . 8 SER CA 1 1 4 1909 1 1 8 SER CB C -20.531 -10.230 -2.952 1.00 . A A . 8 SER CB 1 1 4 1910 1 1 8 SER H H -18.759 -9.877 -4.726 1.00 . A A . 8 SER H 1 1 4 1911 1 1 8 SER HA H -20.335 -8.077 -3.125 1.00 . A A . 8 SER HA 1 1 4 1912 1 1 8 SER HB2 H -21.121 -10.373 -3.846 1.00 . A A . 8 SER HB2 1 1 4 1913 1 1 8 SER HB3 H -19.920 -11.101 -2.769 1.00 . A A . 8 SER HB3 1 1 4 1914 1 1 8 SER HG H -21.215 -10.686 -1.189 1.00 . A A . 8 SER HG 1 1 4 1915 1 1 8 SER N N -18.832 -9.024 -4.252 1.00 . A A . 8 SER N 1 1 4 1916 1 1 8 SER O O -18.485 -9.723 -1.095 1.00 . A A . 8 SER O 1 1 4 1917 1 1 8 SER OG O -21.398 -10.012 -1.848 1.00 . A A . 8 SER OG 1 1 4 1918 1 1 9 GLY C C -16.697 -5.937 -0.696 1.00 . A A . 9 GLY C 1 1 4 1919 1 1 9 GLY CA C -17.509 -7.208 -0.414 1.00 . A A . 9 GLY CA 1 1 4 1920 1 1 9 GLY H H -18.675 -6.834 -2.178 1.00 . A A . 9 GLY H 1 1 4 1921 1 1 9 GLY HA2 H -18.124 -7.047 0.458 1.00 . A A . 9 GLY HA2 1 1 4 1922 1 1 9 GLY HA3 H -16.825 -8.023 -0.229 1.00 . A A . 9 GLY HA3 1 1 4 1923 1 1 9 GLY N N -18.389 -7.547 -1.572 1.00 . A A . 9 GLY N 1 1 4 1924 1 1 9 GLY O O -15.975 -5.480 0.169 1.00 . A A . 9 GLY O 1 1 4 1925 1 1 10 TYR C C -16.377 -3.023 -1.276 1.00 . A A . 10 TYR C 1 1 4 1926 1 1 10 TYR CA C -16.082 -4.161 -2.263 1.00 . A A . 10 TYR CA 1 1 4 1927 1 1 10 TYR CB C -16.491 -3.723 -3.685 1.00 . A A . 10 TYR CB 1 1 4 1928 1 1 10 TYR CD1 C -15.955 -1.238 -3.795 1.00 . A A . 10 TYR CD1 1 1 4 1929 1 1 10 TYR CD2 C -14.460 -2.747 -4.867 1.00 . A A . 10 TYR CD2 1 1 4 1930 1 1 10 TYR CE1 C -15.168 -0.177 -4.189 1.00 . A A . 10 TYR CE1 1 1 4 1931 1 1 10 TYR CE2 C -13.674 -1.684 -5.260 1.00 . A A . 10 TYR CE2 1 1 4 1932 1 1 10 TYR CG C -15.609 -2.537 -4.130 1.00 . A A . 10 TYR CG 1 1 4 1933 1 1 10 TYR CZ C -14.022 -0.392 -4.924 1.00 . A A . 10 TYR CZ 1 1 4 1934 1 1 10 TYR H H -17.418 -5.817 -2.552 1.00 . A A . 10 TYR H 1 1 4 1935 1 1 10 TYR HA H -15.023 -4.383 -2.240 1.00 . A A . 10 TYR HA 1 1 4 1936 1 1 10 TYR HB2 H -16.366 -4.538 -4.380 1.00 . A A . 10 TYR HB2 1 1 4 1937 1 1 10 TYR HB3 H -17.527 -3.416 -3.698 1.00 . A A . 10 TYR HB3 1 1 4 1938 1 1 10 TYR HD1 H -16.848 -1.048 -3.219 1.00 . A A . 10 TYR HD1 1 1 4 1939 1 1 10 TYR HD2 H -14.168 -3.750 -5.139 1.00 . A A . 10 TYR HD2 1 1 4 1940 1 1 10 TYR HE1 H -15.452 0.830 -3.918 1.00 . A A . 10 TYR HE1 1 1 4 1941 1 1 10 TYR HE2 H -12.779 -1.864 -5.836 1.00 . A A . 10 TYR HE2 1 1 4 1942 1 1 10 TYR HH H -12.819 1.039 -4.532 1.00 . A A . 10 TYR HH 1 1 4 1943 1 1 10 TYR N N -16.829 -5.402 -1.889 1.00 . A A . 10 TYR N 1 1 4 1944 1 1 10 TYR O O -17.493 -2.860 -0.822 1.00 . A A . 10 TYR O 1 1 4 1945 1 1 10 TYR OH O -13.234 0.671 -5.316 1.00 . A A . 10 TYR OH 1 1 4 1946 1 1 11 GLU C C -14.201 -0.232 -0.149 1.00 . A A . 11 GLU C 1 1 4 1947 1 1 11 GLU CA C -15.447 -1.124 -0.045 1.00 . A A . 11 GLU CA 1 1 4 1948 1 1 11 GLU CB C -15.593 -1.662 1.403 1.00 . A A . 11 GLU CB 1 1 4 1949 1 1 11 GLU CD C -14.824 -3.445 3.000 1.00 . A A . 11 GLU CD 1 1 4 1950 1 1 11 GLU CG C -14.446 -2.646 1.742 1.00 . A A . 11 GLU CG 1 1 4 1951 1 1 11 GLU H H -14.480 -2.483 -1.403 1.00 . A A . 11 GLU H 1 1 4 1952 1 1 11 GLU HA H -16.313 -0.534 -0.310 1.00 . A A . 11 GLU HA 1 1 4 1953 1 1 11 GLU HB2 H -15.574 -0.837 2.101 1.00 . A A . 11 GLU HB2 1 1 4 1954 1 1 11 GLU HB3 H -16.545 -2.163 1.503 1.00 . A A . 11 GLU HB3 1 1 4 1955 1 1 11 GLU HG2 H -14.272 -3.336 0.929 1.00 . A A . 11 GLU HG2 1 1 4 1956 1 1 11 GLU HG3 H -13.532 -2.099 1.930 1.00 . A A . 11 GLU HG3 1 1 4 1957 1 1 11 GLU N N -15.343 -2.278 -0.989 1.00 . A A . 11 GLU N 1 1 4 1958 1 1 11 GLU O O -14.147 0.819 0.460 1.00 . A A . 11 GLU O 1 1 4 1959 1 1 11 GLU OE1 O -15.476 -4.463 2.822 1.00 . A A . 11 GLU OE1 1 1 4 1960 1 1 11 GLU OE2 O -14.443 -2.995 4.068 1.00 . A A . 11 GLU OE2 1 1 4 1961 1 1 12 VAL C C -12.180 1.318 -2.003 1.00 . A A . 12 VAL C 1 1 4 1962 1 1 12 VAL CA C -11.980 0.096 -1.101 1.00 . A A . 12 VAL CA 1 1 4 1963 1 1 12 VAL CB C -10.885 -0.838 -1.713 1.00 . A A . 12 VAL CB 1 1 4 1964 1 1 12 VAL CG1 C -10.509 -1.949 -0.717 1.00 . A A . 12 VAL CG1 1 1 4 1965 1 1 12 VAL CG2 C -11.365 -1.477 -3.032 1.00 . A A . 12 VAL CG2 1 1 4 1966 1 1 12 VAL H H -13.329 -1.524 -1.391 1.00 . A A . 12 VAL H 1 1 4 1967 1 1 12 VAL HA H -11.653 0.441 -0.133 1.00 . A A . 12 VAL HA 1 1 4 1968 1 1 12 VAL HB H -10.002 -0.256 -1.921 1.00 . A A . 12 VAL HB 1 1 4 1969 1 1 12 VAL HG11 H -10.157 -1.513 0.206 1.00 . A A . 12 VAL HG11 1 1 4 1970 1 1 12 VAL HG12 H -11.363 -2.575 -0.508 1.00 . A A . 12 VAL HG12 1 1 4 1971 1 1 12 VAL HG13 H -9.720 -2.561 -1.130 1.00 . A A . 12 VAL HG13 1 1 4 1972 1 1 12 VAL HG21 H -12.255 -2.070 -2.873 1.00 . A A . 12 VAL HG21 1 1 4 1973 1 1 12 VAL HG22 H -11.581 -0.706 -3.756 1.00 . A A . 12 VAL HG22 1 1 4 1974 1 1 12 VAL HG23 H -10.594 -2.116 -3.436 1.00 . A A . 12 VAL HG23 1 1 4 1975 1 1 12 VAL N N -13.238 -0.676 -0.919 1.00 . A A . 12 VAL N 1 1 4 1976 1 1 12 VAL O O -13.265 1.607 -2.471 1.00 . A A . 12 VAL O 1 1 4 1977 1 1 13 HIS C C -9.576 3.279 -3.570 1.00 . A A . 13 HIS C 1 1 4 1978 1 1 13 HIS CA C -11.010 3.214 -3.036 1.00 . A A . 13 HIS CA 1 1 4 1979 1 1 13 HIS CB C -11.340 4.440 -2.159 1.00 . A A . 13 HIS CB 1 1 4 1980 1 1 13 HIS CD2 C -12.212 6.258 -3.878 1.00 . A A . 13 HIS CD2 1 1 4 1981 1 1 13 HIS CE1 C -10.569 7.521 -3.835 1.00 . A A . 13 HIS CE1 1 1 4 1982 1 1 13 HIS CG C -11.287 5.716 -3.003 1.00 . A A . 13 HIS CG 1 1 4 1983 1 1 13 HIS H H -10.271 1.647 -1.761 1.00 . A A . 13 HIS H 1 1 4 1984 1 1 13 HIS HA H -11.700 3.127 -3.864 1.00 . A A . 13 HIS HA 1 1 4 1985 1 1 13 HIS HB2 H -12.335 4.343 -1.752 1.00 . A A . 13 HIS HB2 1 1 4 1986 1 1 13 HIS HB3 H -10.631 4.529 -1.350 1.00 . A A . 13 HIS HB3 1 1 4 1987 1 1 13 HIS HD1 H -9.469 6.453 -2.511 1.00 . A A . 13 HIS HD1 1 1 4 1988 1 1 13 HIS HD2 H -13.173 5.823 -4.109 1.00 . A A . 13 HIS HD2 1 1 4 1989 1 1 13 HIS HE1 H -9.902 8.348 -4.032 1.00 . A A . 13 HIS HE1 1 1 4 1990 1 1 13 HIS N N -11.078 1.986 -2.195 1.00 . A A . 13 HIS N 1 1 4 1991 1 1 13 HIS ND1 N -10.298 6.547 -3.027 1.00 . A A . 13 HIS ND1 1 1 4 1992 1 1 13 HIS NE2 N -11.750 7.382 -4.387 1.00 . A A . 13 HIS NE2 1 1 4 1993 1 1 13 HIS O O -8.690 3.846 -2.959 1.00 . A A . 13 HIS O 1 1 4 1994 1 1 14 HIS C C -7.011 1.948 -4.569 1.00 . A A . 14 HIS C 1 1 4 1995 1 1 14 HIS CA C -8.104 2.604 -5.427 1.00 . A A . 14 HIS CA 1 1 4 1996 1 1 14 HIS CB C -7.706 4.037 -5.826 1.00 . A A . 14 HIS CB 1 1 4 1997 1 1 14 HIS CD2 C -9.969 4.359 -7.184 1.00 . A A . 14 HIS CD2 1 1 4 1998 1 1 14 HIS CE1 C -10.255 6.375 -6.807 1.00 . A A . 14 HIS CE1 1 1 4 1999 1 1 14 HIS CG C -8.917 4.792 -6.393 1.00 . A A . 14 HIS CG 1 1 4 2000 1 1 14 HIS H H -10.187 2.244 -5.132 1.00 . A A . 14 HIS H 1 1 4 2001 1 1 14 HIS HA H -8.237 1.992 -6.305 1.00 . A A . 14 HIS HA 1 1 4 2002 1 1 14 HIS HB2 H -7.367 4.553 -4.946 1.00 . A A . 14 HIS HB2 1 1 4 2003 1 1 14 HIS HB3 H -6.922 4.023 -6.568 1.00 . A A . 14 HIS HB3 1 1 4 2004 1 1 14 HIS HD1 H -8.602 6.654 -5.674 1.00 . A A . 14 HIS HD1 1 1 4 2005 1 1 14 HIS HD2 H -10.096 3.349 -7.542 1.00 . A A . 14 HIS HD2 1 1 4 2006 1 1 14 HIS HE1 H -10.675 7.369 -6.795 1.00 . A A . 14 HIS HE1 1 1 4 2007 1 1 14 HIS N N -9.416 2.671 -4.717 1.00 . A A . 14 HIS N 1 1 4 2008 1 1 14 HIS ND1 N -9.161 6.046 -6.200 1.00 . A A . 14 HIS ND1 1 1 4 2009 1 1 14 HIS NE2 N -10.792 5.358 -7.432 1.00 . A A . 14 HIS NE2 1 1 4 2010 1 1 14 HIS O O -5.831 2.210 -4.718 1.00 . A A . 14 HIS O 1 1 4 2011 1 1 15 GLN C C -5.489 -0.360 -3.664 1.00 . A A . 15 GLN C 1 1 4 2012 1 1 15 GLN CA C -6.501 0.368 -2.772 1.00 . A A . 15 GLN CA 1 1 4 2013 1 1 15 GLN CB C -7.317 -0.621 -1.917 1.00 . A A . 15 GLN CB 1 1 4 2014 1 1 15 GLN CD C -6.294 -2.922 -1.880 1.00 . A A . 15 GLN CD 1 1 4 2015 1 1 15 GLN CG C -6.395 -1.581 -1.136 1.00 . A A . 15 GLN CG 1 1 4 2016 1 1 15 GLN H H -8.409 0.922 -3.609 1.00 . A A . 15 GLN H 1 1 4 2017 1 1 15 GLN HA H -5.977 1.084 -2.156 1.00 . A A . 15 GLN HA 1 1 4 2018 1 1 15 GLN HB2 H -7.907 -0.058 -1.208 1.00 . A A . 15 GLN HB2 1 1 4 2019 1 1 15 GLN HB3 H -7.992 -1.179 -2.552 1.00 . A A . 15 GLN HB3 1 1 4 2020 1 1 15 GLN HE21 H -4.521 -2.509 -2.671 1.00 . A A . 15 GLN HE21 1 1 4 2021 1 1 15 GLN HE22 H -5.164 -4.025 -3.083 1.00 . A A . 15 GLN HE22 1 1 4 2022 1 1 15 GLN HG2 H -5.407 -1.158 -1.027 1.00 . A A . 15 GLN HG2 1 1 4 2023 1 1 15 GLN HG3 H -6.809 -1.760 -0.155 1.00 . A A . 15 GLN HG3 1 1 4 2024 1 1 15 GLN N N -7.448 1.091 -3.679 1.00 . A A . 15 GLN N 1 1 4 2025 1 1 15 GLN NE2 N -5.239 -3.173 -2.605 1.00 . A A . 15 GLN NE2 1 1 4 2026 1 1 15 GLN O O -4.326 -0.475 -3.337 1.00 . A A . 15 GLN O 1 1 4 2027 1 1 15 GLN OE1 O -7.178 -3.753 -1.805 1.00 . A A . 15 GLN OE1 1 1 4 2028 1 1 16 LYS C C -3.868 -0.740 -6.107 1.00 . A A . 16 LYS C 1 1 4 2029 1 1 16 LYS CA C -5.119 -1.557 -5.750 1.00 . A A . 16 LYS CA 1 1 4 2030 1 1 16 LYS CB C -5.960 -1.847 -7.019 1.00 . A A . 16 LYS CB 1 1 4 2031 1 1 16 LYS CD C -4.493 -3.874 -7.459 1.00 . A A . 16 LYS CD 1 1 4 2032 1 1 16 LYS CE C -4.111 -4.875 -8.563 1.00 . A A . 16 LYS CE 1 1 4 2033 1 1 16 LYS CG C -5.133 -2.613 -8.084 1.00 . A A . 16 LYS CG 1 1 4 2034 1 1 16 LYS H H -6.930 -0.705 -4.975 1.00 . A A . 16 LYS H 1 1 4 2035 1 1 16 LYS HA H -4.803 -2.473 -5.286 1.00 . A A . 16 LYS HA 1 1 4 2036 1 1 16 LYS HB2 H -6.823 -2.435 -6.746 1.00 . A A . 16 LYS HB2 1 1 4 2037 1 1 16 LYS HB3 H -6.307 -0.914 -7.441 1.00 . A A . 16 LYS HB3 1 1 4 2038 1 1 16 LYS HD2 H -3.606 -3.587 -6.911 1.00 . A A . 16 LYS HD2 1 1 4 2039 1 1 16 LYS HD3 H -5.187 -4.332 -6.768 1.00 . A A . 16 LYS HD3 1 1 4 2040 1 1 16 LYS HE2 H -3.558 -4.382 -9.349 1.00 . A A . 16 LYS HE2 1 1 4 2041 1 1 16 LYS HE3 H -3.499 -5.664 -8.148 1.00 . A A . 16 LYS HE3 1 1 4 2042 1 1 16 LYS HG2 H -5.788 -2.893 -8.897 1.00 . A A . 16 LYS HG2 1 1 4 2043 1 1 16 LYS HG3 H -4.360 -1.970 -8.480 1.00 . A A . 16 LYS HG3 1 1 4 2044 1 1 16 LYS HZ1 H -6.180 -5.096 -8.682 1.00 . A A . 16 LYS HZ1 1 1 4 2045 1 1 16 LYS HZ2 H -5.378 -5.271 -10.168 1.00 . A A . 16 LYS HZ2 1 1 4 2046 1 1 16 LYS HZ3 H -5.312 -6.516 -9.016 1.00 . A A . 16 LYS HZ3 1 1 4 2047 1 1 16 LYS N N -5.979 -0.830 -4.779 1.00 . A A . 16 LYS N 1 1 4 2048 1 1 16 LYS NZ N -5.337 -5.486 -9.152 1.00 . A A . 16 LYS NZ 1 1 4 2049 1 1 16 LYS O O -2.767 -1.247 -6.037 1.00 . A A . 16 LYS O 1 1 4 2050 1 1 17 LEU C C -2.016 1.568 -5.574 1.00 . A A . 17 LEU C 1 1 4 2051 1 1 17 LEU CA C -2.880 1.347 -6.826 1.00 . A A . 17 LEU CA 1 1 4 2052 1 1 17 LEU CB C -3.420 2.684 -7.452 1.00 . A A . 17 LEU CB 1 1 4 2053 1 1 17 LEU CD1 C -2.065 4.431 -6.158 1.00 . A A . 17 LEU CD1 1 1 4 2054 1 1 17 LEU CD2 C -4.315 5.002 -7.144 1.00 . A A . 17 LEU CD2 1 1 4 2055 1 1 17 LEU CG C -3.495 3.880 -6.473 1.00 . A A . 17 LEU CG 1 1 4 2056 1 1 17 LEU H H -4.962 0.881 -6.486 1.00 . A A . 17 LEU H 1 1 4 2057 1 1 17 LEU HA H -2.300 0.823 -7.572 1.00 . A A . 17 LEU HA 1 1 4 2058 1 1 17 LEU HB2 H -2.788 2.953 -8.286 1.00 . A A . 17 LEU HB2 1 1 4 2059 1 1 17 LEU HB3 H -4.410 2.497 -7.844 1.00 . A A . 17 LEU HB3 1 1 4 2060 1 1 17 LEU HD11 H -1.321 3.958 -6.782 1.00 . A A . 17 LEU HD11 1 1 4 2061 1 1 17 LEU HD12 H -2.009 5.497 -6.322 1.00 . A A . 17 LEU HD12 1 1 4 2062 1 1 17 LEU HD13 H -1.817 4.238 -5.125 1.00 . A A . 17 LEU HD13 1 1 4 2063 1 1 17 LEU HD21 H -5.190 4.595 -7.630 1.00 . A A . 17 LEU HD21 1 1 4 2064 1 1 17 LEU HD22 H -4.631 5.719 -6.402 1.00 . A A . 17 LEU HD22 1 1 4 2065 1 1 17 LEU HD23 H -3.719 5.509 -7.890 1.00 . A A . 17 LEU HD23 1 1 4 2066 1 1 17 LEU HG H -3.998 3.552 -5.577 1.00 . A A . 17 LEU HG 1 1 4 2067 1 1 17 LEU N N -4.059 0.505 -6.464 1.00 . A A . 17 LEU N 1 1 4 2068 1 1 17 LEU O O -0.809 1.506 -5.647 1.00 . A A . 17 LEU O 1 1 4 2069 1 1 18 VAL C C -0.906 0.848 -2.985 1.00 . A A . 18 VAL C 1 1 4 2070 1 1 18 VAL CA C -1.876 2.041 -3.183 1.00 . A A . 18 VAL CA 1 1 4 2071 1 1 18 VAL CB C -2.943 2.174 -2.061 1.00 . A A . 18 VAL CB 1 1 4 2072 1 1 18 VAL CG1 C -2.327 2.046 -0.670 1.00 . A A . 18 VAL CG1 1 1 4 2073 1 1 18 VAL CG2 C -3.642 3.548 -2.191 1.00 . A A . 18 VAL CG2 1 1 4 2074 1 1 18 VAL H H -3.619 1.868 -4.438 1.00 . A A . 18 VAL H 1 1 4 2075 1 1 18 VAL HA H -1.293 2.949 -3.279 1.00 . A A . 18 VAL HA 1 1 4 2076 1 1 18 VAL HB H -3.689 1.405 -2.171 1.00 . A A . 18 VAL HB 1 1 4 2077 1 1 18 VAL HG11 H -1.356 2.515 -0.643 1.00 . A A . 18 VAL HG11 1 1 4 2078 1 1 18 VAL HG12 H -2.972 2.510 0.061 1.00 . A A . 18 VAL HG12 1 1 4 2079 1 1 18 VAL HG13 H -2.230 1.000 -0.427 1.00 . A A . 18 VAL HG13 1 1 4 2080 1 1 18 VAL HG21 H -4.084 3.651 -3.171 1.00 . A A . 18 VAL HG21 1 1 4 2081 1 1 18 VAL HG22 H -4.424 3.636 -1.451 1.00 . A A . 18 VAL HG22 1 1 4 2082 1 1 18 VAL HG23 H -2.931 4.348 -2.044 1.00 . A A . 18 VAL HG23 1 1 4 2083 1 1 18 VAL N N -2.642 1.818 -4.451 1.00 . A A . 18 VAL N 1 1 4 2084 1 1 18 VAL O O 0.281 1.015 -2.779 1.00 . A A . 18 VAL O 1 1 4 2085 1 1 19 PHE C C 0.451 -1.620 -3.951 1.00 . A A . 19 PHE C 1 1 4 2086 1 1 19 PHE CA C -0.671 -1.596 -2.908 1.00 . A A . 19 PHE CA 1 1 4 2087 1 1 19 PHE CB C -1.625 -2.794 -3.100 1.00 . A A . 19 PHE CB 1 1 4 2088 1 1 19 PHE CD1 C -2.758 -2.165 -0.885 1.00 . A A . 19 PHE CD1 1 1 4 2089 1 1 19 PHE CD2 C -2.620 -4.467 -1.485 1.00 . A A . 19 PHE CD2 1 1 4 2090 1 1 19 PHE CE1 C -3.410 -2.508 0.281 1.00 . A A . 19 PHE CE1 1 1 4 2091 1 1 19 PHE CE2 C -3.273 -4.809 -0.319 1.00 . A A . 19 PHE CE2 1 1 4 2092 1 1 19 PHE CG C -2.354 -3.143 -1.783 1.00 . A A . 19 PHE CG 1 1 4 2093 1 1 19 PHE CZ C -3.668 -3.830 0.565 1.00 . A A . 19 PHE CZ 1 1 4 2094 1 1 19 PHE H H -2.416 -0.390 -3.238 1.00 . A A . 19 PHE H 1 1 4 2095 1 1 19 PHE HA H -0.226 -1.615 -1.929 1.00 . A A . 19 PHE HA 1 1 4 2096 1 1 19 PHE HB2 H -2.368 -2.563 -3.850 1.00 . A A . 19 PHE HB2 1 1 4 2097 1 1 19 PHE HB3 H -1.068 -3.660 -3.426 1.00 . A A . 19 PHE HB3 1 1 4 2098 1 1 19 PHE HD1 H -2.567 -1.123 -1.088 1.00 . A A . 19 PHE HD1 1 1 4 2099 1 1 19 PHE HD2 H -2.315 -5.245 -2.170 1.00 . A A . 19 PHE HD2 1 1 4 2100 1 1 19 PHE HE1 H -3.719 -1.738 0.972 1.00 . A A . 19 PHE HE1 1 1 4 2101 1 1 19 PHE HE2 H -3.474 -5.848 -0.099 1.00 . A A . 19 PHE HE2 1 1 4 2102 1 1 19 PHE HZ H -4.179 -4.099 1.478 1.00 . A A . 19 PHE HZ 1 1 4 2103 1 1 19 PHE N N -1.458 -0.335 -3.069 1.00 . A A . 19 PHE N 1 1 4 2104 1 1 19 PHE O O 1.595 -1.878 -3.636 1.00 . A A . 19 PHE O 1 1 4 2105 1 1 20 PHE C C 2.248 -0.433 -5.887 1.00 . A A . 20 PHE C 1 1 4 2106 1 1 20 PHE CA C 1.059 -1.320 -6.300 1.00 . A A . 20 PHE CA 1 1 4 2107 1 1 20 PHE CB C 0.292 -0.788 -7.553 1.00 . A A . 20 PHE CB 1 1 4 2108 1 1 20 PHE CD1 C 2.118 -0.246 -9.206 1.00 . A A . 20 PHE CD1 1 1 4 2109 1 1 20 PHE CD2 C 0.852 1.573 -8.334 1.00 . A A . 20 PHE CD2 1 1 4 2110 1 1 20 PHE CE1 C 2.861 0.632 -9.961 1.00 . A A . 20 PHE CE1 1 1 4 2111 1 1 20 PHE CE2 C 1.595 2.452 -9.088 1.00 . A A . 20 PHE CE2 1 1 4 2112 1 1 20 PHE CG C 1.110 0.213 -8.387 1.00 . A A . 20 PHE CG 1 1 4 2113 1 1 20 PHE CZ C 2.602 1.984 -9.904 1.00 . A A . 20 PHE CZ 1 1 4 2114 1 1 20 PHE H H -0.859 -1.154 -5.364 1.00 . A A . 20 PHE H 1 1 4 2115 1 1 20 PHE HA H 1.412 -2.326 -6.475 1.00 . A A . 20 PHE HA 1 1 4 2116 1 1 20 PHE HB2 H 0.037 -1.625 -8.187 1.00 . A A . 20 PHE HB2 1 1 4 2117 1 1 20 PHE HB3 H -0.626 -0.316 -7.250 1.00 . A A . 20 PHE HB3 1 1 4 2118 1 1 20 PHE HD1 H 2.327 -1.304 -9.255 1.00 . A A . 20 PHE HD1 1 1 4 2119 1 1 20 PHE HD2 H 0.067 1.963 -7.705 1.00 . A A . 20 PHE HD2 1 1 4 2120 1 1 20 PHE HE1 H 3.647 0.254 -10.596 1.00 . A A . 20 PHE HE1 1 1 4 2121 1 1 20 PHE HE2 H 1.382 3.509 -9.032 1.00 . A A . 20 PHE HE2 1 1 4 2122 1 1 20 PHE HZ H 3.185 2.674 -10.496 1.00 . A A . 20 PHE HZ 1 1 4 2123 1 1 20 PHE N N 0.079 -1.344 -5.175 1.00 . A A . 20 PHE N 1 1 4 2124 1 1 20 PHE O O 3.378 -0.857 -5.971 1.00 . A A . 20 PHE O 1 1 4 2125 1 1 21 ALA C C 3.993 1.031 -4.007 1.00 . A A . 21 ALA C 1 1 4 2126 1 1 21 ALA CA C 3.047 1.713 -5.010 1.00 . A A . 21 ALA CA 1 1 4 2127 1 1 21 ALA CB C 2.381 2.944 -4.370 1.00 . A A . 21 ALA CB 1 1 4 2128 1 1 21 ALA H H 1.029 1.039 -5.404 1.00 . A A . 21 ALA H 1 1 4 2129 1 1 21 ALA HA H 3.630 1.998 -5.875 1.00 . A A . 21 ALA HA 1 1 4 2130 1 1 21 ALA HB1 H 1.529 3.249 -4.960 1.00 . A A . 21 ALA HB1 1 1 4 2131 1 1 21 ALA HB2 H 2.043 2.719 -3.369 1.00 . A A . 21 ALA HB2 1 1 4 2132 1 1 21 ALA HB3 H 3.083 3.763 -4.324 1.00 . A A . 21 ALA HB3 1 1 4 2133 1 1 21 ALA N N 1.965 0.766 -5.444 1.00 . A A . 21 ALA N 1 1 4 2134 1 1 21 ALA O O 5.197 1.073 -4.153 1.00 . A A . 21 ALA O 1 1 4 2135 1 1 22 GLU C C 5.186 -1.305 -2.704 1.00 . A A . 22 GLU C 1 1 4 2136 1 1 22 GLU CA C 4.279 -0.291 -1.983 1.00 . A A . 22 GLU CA 1 1 4 2137 1 1 22 GLU CB C 3.373 -1.029 -0.975 1.00 . A A . 22 GLU CB 1 1 4 2138 1 1 22 GLU CD C 1.126 -0.587 0.144 1.00 . A A . 22 GLU CD 1 1 4 2139 1 1 22 GLU CG C 2.530 -0.016 -0.154 1.00 . A A . 22 GLU CG 1 1 4 2140 1 1 22 GLU H H 2.453 0.423 -2.944 1.00 . A A . 22 GLU H 1 1 4 2141 1 1 22 GLU HA H 4.912 0.440 -1.500 1.00 . A A . 22 GLU HA 1 1 4 2142 1 1 22 GLU HB2 H 2.731 -1.716 -1.503 1.00 . A A . 22 GLU HB2 1 1 4 2143 1 1 22 GLU HB3 H 3.990 -1.601 -0.296 1.00 . A A . 22 GLU HB3 1 1 4 2144 1 1 22 GLU HG2 H 3.022 0.185 0.787 1.00 . A A . 22 GLU HG2 1 1 4 2145 1 1 22 GLU HG3 H 2.427 0.916 -0.691 1.00 . A A . 22 GLU HG3 1 1 4 2146 1 1 22 GLU N N 3.428 0.409 -3.006 1.00 . A A . 22 GLU N 1 1 4 2147 1 1 22 GLU O O 6.380 -1.365 -2.476 1.00 . A A . 22 GLU O 1 1 4 2148 1 1 22 GLU OE1 O 1.062 -1.716 0.605 1.00 . A A . 22 GLU OE1 1 1 4 2149 1 1 22 GLU OE2 O 0.182 0.144 -0.107 1.00 . A A . 22 GLU OE2 1 1 4 2150 1 1 23 ASP C C 6.482 -2.460 -5.075 1.00 . A A . 23 ASP C 1 1 4 2151 1 1 23 ASP CA C 5.289 -3.107 -4.361 1.00 . A A . 23 ASP CA 1 1 4 2152 1 1 23 ASP CB C 4.305 -3.695 -5.379 1.00 . A A . 23 ASP CB 1 1 4 2153 1 1 23 ASP CG C 4.666 -5.161 -5.658 1.00 . A A . 23 ASP CG 1 1 4 2154 1 1 23 ASP H H 3.606 -1.966 -3.693 1.00 . A A . 23 ASP H 1 1 4 2155 1 1 23 ASP HA H 5.654 -3.865 -3.686 1.00 . A A . 23 ASP HA 1 1 4 2156 1 1 23 ASP HB2 H 3.295 -3.633 -5.005 1.00 . A A . 23 ASP HB2 1 1 4 2157 1 1 23 ASP HB3 H 4.342 -3.132 -6.297 1.00 . A A . 23 ASP HB3 1 1 4 2158 1 1 23 ASP N N 4.568 -2.071 -3.566 1.00 . A A . 23 ASP N 1 1 4 2159 1 1 23 ASP O O 7.600 -2.916 -4.984 1.00 . A A . 23 ASP O 1 1 4 2160 1 1 23 ASP OD1 O 5.518 -5.355 -6.510 1.00 . A A . 23 ASP OD1 1 1 4 2161 1 1 23 ASP OD2 O 4.072 -6.003 -5.005 1.00 . A A . 23 ASP OD2 1 1 4 2162 1 1 24 VAL C C 8.367 -0.251 -5.651 1.00 . A A . 24 VAL C 1 1 4 2163 1 1 24 VAL CA C 7.169 -0.594 -6.544 1.00 . A A . 24 VAL CA 1 1 4 2164 1 1 24 VAL CB C 6.405 0.657 -7.038 1.00 . A A . 24 VAL CB 1 1 4 2165 1 1 24 VAL CG1 C 7.286 1.593 -7.842 1.00 . A A . 24 VAL CG1 1 1 4 2166 1 1 24 VAL CG2 C 5.214 0.212 -7.906 1.00 . A A . 24 VAL CG2 1 1 4 2167 1 1 24 VAL H H 5.244 -1.119 -5.773 1.00 . A A . 24 VAL H 1 1 4 2168 1 1 24 VAL HA H 7.513 -1.184 -7.378 1.00 . A A . 24 VAL HA 1 1 4 2169 1 1 24 VAL HB H 6.035 1.219 -6.199 1.00 . A A . 24 VAL HB 1 1 4 2170 1 1 24 VAL HG11 H 7.720 1.067 -8.678 1.00 . A A . 24 VAL HG11 1 1 4 2171 1 1 24 VAL HG12 H 6.675 2.408 -8.206 1.00 . A A . 24 VAL HG12 1 1 4 2172 1 1 24 VAL HG13 H 8.061 1.994 -7.207 1.00 . A A . 24 VAL HG13 1 1 4 2173 1 1 24 VAL HG21 H 4.994 -0.836 -7.762 1.00 . A A . 24 VAL HG21 1 1 4 2174 1 1 24 VAL HG22 H 4.344 0.785 -7.622 1.00 . A A . 24 VAL HG22 1 1 4 2175 1 1 24 VAL HG23 H 5.420 0.373 -8.951 1.00 . A A . 24 VAL HG23 1 1 4 2176 1 1 24 VAL N N 6.178 -1.397 -5.766 1.00 . A A . 24 VAL N 1 1 4 2177 1 1 24 VAL O O 9.510 -0.437 -6.022 1.00 . A A . 24 VAL O 1 1 4 2178 1 1 25 GLY C C 10.027 -0.609 -3.259 1.00 . A A . 25 GLY C 1 1 4 2179 1 1 25 GLY CA C 9.122 0.615 -3.502 1.00 . A A . 25 GLY CA 1 1 4 2180 1 1 25 GLY H H 7.098 0.368 -4.279 1.00 . A A . 25 GLY H 1 1 4 2181 1 1 25 GLY HA2 H 9.710 1.430 -3.900 1.00 . A A . 25 GLY HA2 1 1 4 2182 1 1 25 GLY HA3 H 8.665 0.913 -2.571 1.00 . A A . 25 GLY HA3 1 1 4 2183 1 1 25 GLY N N 8.050 0.243 -4.483 1.00 . A A . 25 GLY N 1 1 4 2184 1 1 25 GLY O O 11.229 -0.561 -3.437 1.00 . A A . 25 GLY O 1 1 4 2185 1 1 26 SER C C 11.002 -3.366 -3.775 1.00 . A A . 26 SER C 1 1 4 2186 1 1 26 SER CA C 10.115 -2.969 -2.580 1.00 . A A . 26 SER CA 1 1 4 2187 1 1 26 SER CB C 9.082 -4.087 -2.311 1.00 . A A . 26 SER CB 1 1 4 2188 1 1 26 SER H H 8.419 -1.632 -2.746 1.00 . A A . 26 SER H 1 1 4 2189 1 1 26 SER HA H 10.743 -2.826 -1.716 1.00 . A A . 26 SER HA 1 1 4 2190 1 1 26 SER HB2 H 8.606 -4.428 -3.218 1.00 . A A . 26 SER HB2 1 1 4 2191 1 1 26 SER HB3 H 9.535 -4.922 -1.798 1.00 . A A . 26 SER HB3 1 1 4 2192 1 1 26 SER HG H 7.272 -3.480 -1.935 1.00 . A A . 26 SER HG 1 1 4 2193 1 1 26 SER N N 9.390 -1.684 -2.862 1.00 . A A . 26 SER N 1 1 4 2194 1 1 26 SER O O 12.162 -3.705 -3.632 1.00 . A A . 26 SER O 1 1 4 2195 1 1 26 SER OG O 8.109 -3.490 -1.464 1.00 . A A . 26 SER OG 1 1 4 2196 1 1 27 ASN C C 12.394 -2.889 -6.333 1.00 . A A . 27 ASN C 1 1 4 2197 1 1 27 ASN CA C 11.081 -3.643 -6.212 1.00 . A A . 27 ASN CA 1 1 4 2198 1 1 27 ASN CB C 10.146 -3.281 -7.379 1.00 . A A . 27 ASN CB 1 1 4 2199 1 1 27 ASN CG C 9.264 -4.480 -7.732 1.00 . A A . 27 ASN CG 1 1 4 2200 1 1 27 ASN H H 9.467 -3.033 -4.958 1.00 . A A . 27 ASN H 1 1 4 2201 1 1 27 ASN HA H 11.315 -4.694 -6.197 1.00 . A A . 27 ASN HA 1 1 4 2202 1 1 27 ASN HB2 H 9.504 -2.457 -7.114 1.00 . A A . 27 ASN HB2 1 1 4 2203 1 1 27 ASN HB3 H 10.721 -2.997 -8.244 1.00 . A A . 27 ASN HB3 1 1 4 2204 1 1 27 ASN HD21 H 7.606 -3.605 -7.079 1.00 . A A . 27 ASN HD21 1 1 4 2205 1 1 27 ASN HD22 H 7.405 -5.169 -7.703 1.00 . A A . 27 ASN HD22 1 1 4 2206 1 1 27 ASN N N 10.399 -3.304 -4.933 1.00 . A A . 27 ASN N 1 1 4 2207 1 1 27 ASN ND2 N 7.987 -4.412 -7.484 1.00 . A A . 27 ASN ND2 1 1 4 2208 1 1 27 ASN O O 13.417 -3.513 -6.478 1.00 . A A . 27 ASN O 1 1 4 2209 1 1 27 ASN OD1 O 9.727 -5.485 -8.235 1.00 . A A . 27 ASN OD1 1 1 4 2210 1 1 28 LYS C C 14.701 -1.345 -5.474 1.00 . A A . 28 LYS C 1 1 4 2211 1 1 28 LYS CA C 13.598 -0.758 -6.378 1.00 . A A . 28 LYS CA 1 1 4 2212 1 1 28 LYS CB C 13.244 0.684 -5.955 1.00 . A A . 28 LYS CB 1 1 4 2213 1 1 28 LYS CD C 15.309 1.829 -6.881 1.00 . A A . 28 LYS CD 1 1 4 2214 1 1 28 LYS CE C 15.991 1.276 -8.145 1.00 . A A . 28 LYS CE 1 1 4 2215 1 1 28 LYS CG C 13.767 1.682 -7.003 1.00 . A A . 28 LYS CG 1 1 4 2216 1 1 28 LYS H H 11.480 -1.151 -6.160 1.00 . A A . 28 LYS H 1 1 4 2217 1 1 28 LYS HA H 13.955 -0.803 -7.403 1.00 . A A . 28 LYS HA 1 1 4 2218 1 1 28 LYS HB2 H 12.170 0.788 -5.890 1.00 . A A . 28 LYS HB2 1 1 4 2219 1 1 28 LYS HB3 H 13.659 0.911 -4.983 1.00 . A A . 28 LYS HB3 1 1 4 2220 1 1 28 LYS HD2 H 15.558 2.872 -6.765 1.00 . A A . 28 LYS HD2 1 1 4 2221 1 1 28 LYS HD3 H 15.674 1.294 -6.016 1.00 . A A . 28 LYS HD3 1 1 4 2222 1 1 28 LYS HE2 H 15.701 0.250 -8.311 1.00 . A A . 28 LYS HE2 1 1 4 2223 1 1 28 LYS HE3 H 15.717 1.864 -9.007 1.00 . A A . 28 LYS HE3 1 1 4 2224 1 1 28 LYS HG2 H 13.481 1.346 -7.990 1.00 . A A . 28 LYS HG2 1 1 4 2225 1 1 28 LYS HG3 H 13.298 2.639 -6.826 1.00 . A A . 28 LYS HG3 1 1 4 2226 1 1 28 LYS HZ1 H 17.712 1.731 -7.060 1.00 . A A . 28 LYS HZ1 1 1 4 2227 1 1 28 LYS HZ2 H 17.859 0.364 -8.058 1.00 . A A . 28 LYS HZ2 1 1 4 2228 1 1 28 LYS HZ3 H 17.880 1.919 -8.740 1.00 . A A . 28 LYS HZ3 1 1 4 2229 1 1 28 LYS N N 12.348 -1.583 -6.272 1.00 . A A . 28 LYS N 1 1 4 2230 1 1 28 LYS NZ N 17.472 1.327 -7.988 1.00 . A A . 28 LYS NZ 1 1 4 2231 1 1 28 LYS O O 15.829 -1.506 -5.895 1.00 . A A . 28 LYS O 1 1 4 2232 1 1 29 GLY C C 15.953 -3.518 -3.909 1.00 . A A . 29 GLY C 1 1 4 2233 1 1 29 GLY CA C 15.338 -2.242 -3.302 1.00 . A A . 29 GLY CA 1 1 4 2234 1 1 29 GLY H H 13.417 -1.501 -3.974 1.00 . A A . 29 GLY H 1 1 4 2235 1 1 29 GLY HA2 H 16.117 -1.519 -3.107 1.00 . A A . 29 GLY HA2 1 1 4 2236 1 1 29 GLY HA3 H 14.837 -2.494 -2.379 1.00 . A A . 29 GLY HA3 1 1 4 2237 1 1 29 GLY N N 14.341 -1.658 -4.255 1.00 . A A . 29 GLY N 1 1 4 2238 1 1 29 GLY O O 17.156 -3.637 -4.059 1.00 . A A . 29 GLY O 1 1 4 2239 1 1 30 ALA C C 16.414 -5.482 -6.110 1.00 . A A . 30 ALA C 1 1 4 2240 1 1 30 ALA CA C 15.557 -5.733 -4.860 1.00 . A A . 30 ALA CA 1 1 4 2241 1 1 30 ALA CB C 14.328 -6.575 -5.227 1.00 . A A . 30 ALA CB 1 1 4 2242 1 1 30 ALA H H 14.132 -4.269 -4.116 1.00 . A A . 30 ALA H 1 1 4 2243 1 1 30 ALA HA H 16.169 -6.246 -4.133 1.00 . A A . 30 ALA HA 1 1 4 2244 1 1 30 ALA HB1 H 13.705 -6.717 -4.356 1.00 . A A . 30 ALA HB1 1 1 4 2245 1 1 30 ALA HB2 H 13.747 -6.081 -5.993 1.00 . A A . 30 ALA HB2 1 1 4 2246 1 1 30 ALA HB3 H 14.639 -7.542 -5.594 1.00 . A A . 30 ALA HB3 1 1 4 2247 1 1 30 ALA N N 15.089 -4.440 -4.256 1.00 . A A . 30 ALA N 1 1 4 2248 1 1 30 ALA O O 17.453 -6.080 -6.292 1.00 . A A . 30 ALA O 1 1 4 2249 1 1 31 ILE C C 18.058 -3.822 -7.893 1.00 . A A . 31 ILE C 1 1 4 2250 1 1 31 ILE CA C 16.606 -4.189 -8.202 1.00 . A A . 31 ILE CA 1 1 4 2251 1 1 31 ILE CB C 15.737 -3.018 -8.755 1.00 . A A . 31 ILE CB 1 1 4 2252 1 1 31 ILE CD1 C 13.540 -2.575 -9.995 1.00 . A A . 31 ILE CD1 1 1 4 2253 1 1 31 ILE CG1 C 14.517 -3.649 -9.477 1.00 . A A . 31 ILE CG1 1 1 4 2254 1 1 31 ILE CG2 C 16.522 -2.076 -9.684 1.00 . A A . 31 ILE CG2 1 1 4 2255 1 1 31 ILE H H 15.098 -4.162 -6.723 1.00 . A A . 31 ILE H 1 1 4 2256 1 1 31 ILE HA H 16.606 -5.036 -8.873 1.00 . A A . 31 ILE HA 1 1 4 2257 1 1 31 ILE HB H 15.366 -2.433 -7.933 1.00 . A A . 31 ILE HB 1 1 4 2258 1 1 31 ILE HD11 H 13.441 -1.771 -9.282 1.00 . A A . 31 ILE HD11 1 1 4 2259 1 1 31 ILE HD12 H 13.894 -2.171 -10.932 1.00 . A A . 31 ILE HD12 1 1 4 2260 1 1 31 ILE HD13 H 12.568 -3.016 -10.155 1.00 . A A . 31 ILE HD13 1 1 4 2261 1 1 31 ILE HG12 H 14.866 -4.266 -10.288 1.00 . A A . 31 ILE HG12 1 1 4 2262 1 1 31 ILE HG13 H 13.987 -4.289 -8.786 1.00 . A A . 31 ILE HG13 1 1 4 2263 1 1 31 ILE HG21 H 16.960 -2.624 -10.501 1.00 . A A . 31 ILE HG21 1 1 4 2264 1 1 31 ILE HG22 H 15.860 -1.317 -10.076 1.00 . A A . 31 ILE HG22 1 1 4 2265 1 1 31 ILE HG23 H 17.299 -1.579 -9.121 1.00 . A A . 31 ILE HG23 1 1 4 2266 1 1 31 ILE N N 15.939 -4.591 -6.936 1.00 . A A . 31 ILE N 1 1 4 2267 1 1 31 ILE O O 18.959 -4.349 -8.513 1.00 . A A . 31 ILE O 1 1 4 2268 1 1 32 ILE C C 20.470 -3.806 -6.279 1.00 . A A . 32 ILE C 1 1 4 2269 1 1 32 ILE CA C 19.662 -2.537 -6.592 1.00 . A A . 32 ILE CA 1 1 4 2270 1 1 32 ILE CB C 19.619 -1.596 -5.359 1.00 . A A . 32 ILE CB 1 1 4 2271 1 1 32 ILE CD1 C 18.382 0.433 -4.461 1.00 . A A . 32 ILE CD1 1 1 4 2272 1 1 32 ILE CG1 C 18.825 -0.314 -5.731 1.00 . A A . 32 ILE CG1 1 1 4 2273 1 1 32 ILE CG2 C 21.064 -1.205 -4.951 1.00 . A A . 32 ILE CG2 1 1 4 2274 1 1 32 ILE H H 17.494 -2.537 -6.492 1.00 . A A . 32 ILE H 1 1 4 2275 1 1 32 ILE HA H 20.109 -2.061 -7.449 1.00 . A A . 32 ILE HA 1 1 4 2276 1 1 32 ILE HB H 19.138 -2.102 -4.534 1.00 . A A . 32 ILE HB 1 1 4 2277 1 1 32 ILE HD11 H 17.939 -0.253 -3.754 1.00 . A A . 32 ILE HD11 1 1 4 2278 1 1 32 ILE HD12 H 19.229 0.915 -3.997 1.00 . A A . 32 ILE HD12 1 1 4 2279 1 1 32 ILE HD13 H 17.653 1.186 -4.715 1.00 . A A . 32 ILE HD13 1 1 4 2280 1 1 32 ILE HG12 H 19.438 0.332 -6.341 1.00 . A A . 32 ILE HG12 1 1 4 2281 1 1 32 ILE HG13 H 17.950 -0.573 -6.304 1.00 . A A . 32 ILE HG13 1 1 4 2282 1 1 32 ILE HG21 H 21.603 -0.814 -5.803 1.00 . A A . 32 ILE HG21 1 1 4 2283 1 1 32 ILE HG22 H 21.048 -0.453 -4.177 1.00 . A A . 32 ILE HG22 1 1 4 2284 1 1 32 ILE HG23 H 21.592 -2.069 -4.576 1.00 . A A . 32 ILE HG23 1 1 4 2285 1 1 32 ILE N N 18.261 -2.938 -6.950 1.00 . A A . 32 ILE N 1 1 4 2286 1 1 32 ILE O O 21.564 -3.986 -6.779 1.00 . A A . 32 ILE O 1 1 4 2287 1 1 33 GLY C C 20.987 -6.704 -6.363 1.00 . A A . 33 GLY C 1 1 4 2288 1 1 33 GLY CA C 20.600 -5.929 -5.093 1.00 . A A . 33 GLY CA 1 1 4 2289 1 1 33 GLY H H 19.015 -4.444 -5.099 1.00 . A A . 33 GLY H 1 1 4 2290 1 1 33 GLY HA2 H 21.496 -5.693 -4.533 1.00 . A A . 33 GLY HA2 1 1 4 2291 1 1 33 GLY HA3 H 19.944 -6.537 -4.490 1.00 . A A . 33 GLY HA3 1 1 4 2292 1 1 33 GLY N N 19.900 -4.656 -5.462 1.00 . A A . 33 GLY N 1 1 4 2293 1 1 33 GLY O O 22.122 -7.095 -6.536 1.00 . A A . 33 GLY O 1 1 4 2294 1 1 34 LEU C C 21.402 -6.984 -9.305 1.00 . A A . 34 LEU C 1 1 4 2295 1 1 34 LEU CA C 20.264 -7.638 -8.507 1.00 . A A . 34 LEU CA 1 1 4 2296 1 1 34 LEU CB C 18.962 -7.632 -9.336 1.00 . A A . 34 LEU CB 1 1 4 2297 1 1 34 LEU CD1 C 16.488 -8.063 -9.000 1.00 . A A . 34 LEU CD1 1 1 4 2298 1 1 34 LEU CD2 C 18.074 -10.006 -9.220 1.00 . A A . 34 LEU CD2 1 1 4 2299 1 1 34 LEU CG C 17.910 -8.569 -8.673 1.00 . A A . 34 LEU CG 1 1 4 2300 1 1 34 LEU H H 19.135 -6.556 -7.019 1.00 . A A . 34 LEU H 1 1 4 2301 1 1 34 LEU HA H 20.562 -8.648 -8.264 1.00 . A A . 34 LEU HA 1 1 4 2302 1 1 34 LEU HB2 H 18.576 -6.625 -9.388 1.00 . A A . 34 LEU HB2 1 1 4 2303 1 1 34 LEU HB3 H 19.168 -7.964 -10.344 1.00 . A A . 34 LEU HB3 1 1 4 2304 1 1 34 LEU HD11 H 16.401 -7.834 -10.053 1.00 . A A . 34 LEU HD11 1 1 4 2305 1 1 34 LEU HD12 H 15.755 -8.815 -8.747 1.00 . A A . 34 LEU HD12 1 1 4 2306 1 1 34 LEU HD13 H 16.274 -7.173 -8.431 1.00 . A A . 34 LEU HD13 1 1 4 2307 1 1 34 LEU HD21 H 19.080 -10.361 -9.045 1.00 . A A . 34 LEU HD21 1 1 4 2308 1 1 34 LEU HD22 H 17.384 -10.672 -8.723 1.00 . A A . 34 LEU HD22 1 1 4 2309 1 1 34 LEU HD23 H 17.877 -10.030 -10.282 1.00 . A A . 34 LEU HD23 1 1 4 2310 1 1 34 LEU HG H 18.039 -8.579 -7.600 1.00 . A A . 34 LEU HG 1 1 4 2311 1 1 34 LEU N N 20.024 -6.899 -7.226 1.00 . A A . 34 LEU N 1 1 4 2312 1 1 34 LEU O O 22.269 -7.666 -9.813 1.00 . A A . 34 LEU O 1 1 4 2313 1 1 35 MET C C 23.795 -5.316 -9.578 1.00 . A A . 35 MET C 1 1 4 2314 1 1 35 MET CA C 22.426 -4.936 -10.145 1.00 . A A . 35 MET CA 1 1 4 2315 1 1 35 MET CB C 22.189 -3.417 -10.003 1.00 . A A . 35 MET CB 1 1 4 2316 1 1 35 MET CE C 21.389 -0.582 -12.040 1.00 . A A . 35 MET CE 1 1 4 2317 1 1 35 MET CG C 20.963 -3.004 -10.839 1.00 . A A . 35 MET CG 1 1 4 2318 1 1 35 MET H H 20.632 -5.182 -8.975 1.00 . A A . 35 MET H 1 1 4 2319 1 1 35 MET HA H 22.381 -5.231 -11.174 1.00 . A A . 35 MET HA 1 1 4 2320 1 1 35 MET HB2 H 22.028 -3.155 -8.969 1.00 . A A . 35 MET HB2 1 1 4 2321 1 1 35 MET HB3 H 23.056 -2.880 -10.360 1.00 . A A . 35 MET HB3 1 1 4 2322 1 1 35 MET HE1 H 22.430 -0.830 -11.894 1.00 . A A . 35 MET HE1 1 1 4 2323 1 1 35 MET HE2 H 21.053 -0.982 -12.986 1.00 . A A . 35 MET HE2 1 1 4 2324 1 1 35 MET HE3 H 21.272 0.492 -12.043 1.00 . A A . 35 MET HE3 1 1 4 2325 1 1 35 MET HG2 H 21.182 -3.192 -11.880 1.00 . A A . 35 MET HG2 1 1 4 2326 1 1 35 MET HG3 H 20.130 -3.635 -10.569 1.00 . A A . 35 MET HG3 1 1 4 2327 1 1 35 MET N N 21.364 -5.676 -9.395 1.00 . A A . 35 MET N 1 1 4 2328 1 1 35 MET O O 24.678 -5.727 -10.306 1.00 . A A . 35 MET O 1 1 4 2329 1 1 35 MET SD S 20.401 -1.288 -10.697 1.00 . A A . 35 MET SD 1 1 4 2330 1 1 36 VAL C C 25.596 -6.939 -7.871 1.00 . A A . 36 VAL C 1 1 4 2331 1 1 36 VAL CA C 25.168 -5.491 -7.552 1.00 . A A . 36 VAL CA 1 1 4 2332 1 1 36 VAL CB C 24.899 -5.298 -6.028 1.00 . A A . 36 VAL CB 1 1 4 2333 1 1 36 VAL CG1 C 26.075 -5.854 -5.188 1.00 . A A . 36 VAL CG1 1 1 4 2334 1 1 36 VAL CG2 C 24.749 -3.790 -5.730 1.00 . A A . 36 VAL CG2 1 1 4 2335 1 1 36 VAL H H 23.133 -4.825 -7.790 1.00 . A A . 36 VAL H 1 1 4 2336 1 1 36 VAL HA H 25.944 -4.819 -7.889 1.00 . A A . 36 VAL HA 1 1 4 2337 1 1 36 VAL HB H 23.985 -5.800 -5.741 1.00 . A A . 36 VAL HB 1 1 4 2338 1 1 36 VAL HG11 H 27.018 -5.498 -5.578 1.00 . A A . 36 VAL HG11 1 1 4 2339 1 1 36 VAL HG12 H 25.982 -5.538 -4.159 1.00 . A A . 36 VAL HG12 1 1 4 2340 1 1 36 VAL HG13 H 26.071 -6.934 -5.215 1.00 . A A . 36 VAL HG13 1 1 4 2341 1 1 36 VAL HG21 H 24.006 -3.349 -6.379 1.00 . A A . 36 VAL HG21 1 1 4 2342 1 1 36 VAL HG22 H 24.439 -3.644 -4.706 1.00 . A A . 36 VAL HG22 1 1 4 2343 1 1 36 VAL HG23 H 25.688 -3.279 -5.885 1.00 . A A . 36 VAL HG23 1 1 4 2344 1 1 36 VAL N N 23.905 -5.166 -8.284 1.00 . A A . 36 VAL N 1 1 4 2345 1 1 36 VAL O O 26.736 -7.185 -8.213 1.00 . A A . 36 VAL O 1 1 4 2346 1 1 37 GLY C C 25.533 -9.536 -9.395 1.00 . A A . 37 GLY C 1 1 4 2347 1 1 37 GLY CA C 24.899 -9.290 -8.019 1.00 . A A . 37 GLY CA 1 1 4 2348 1 1 37 GLY H H 23.764 -7.558 -7.457 1.00 . A A . 37 GLY H 1 1 4 2349 1 1 37 GLY HA2 H 25.554 -9.681 -7.252 1.00 . A A . 37 GLY HA2 1 1 4 2350 1 1 37 GLY HA3 H 23.956 -9.814 -7.972 1.00 . A A . 37 GLY HA3 1 1 4 2351 1 1 37 GLY N N 24.654 -7.842 -7.745 1.00 . A A . 37 GLY N 1 1 4 2352 1 1 37 GLY O O 26.594 -10.124 -9.480 1.00 . A A . 37 GLY O 1 1 4 2353 1 1 38 GLY C C 24.691 -8.452 -12.877 1.00 . A A . 38 GLY C 1 1 4 2354 1 1 38 GLY CA C 25.415 -9.277 -11.809 1.00 . A A . 38 GLY CA 1 1 4 2355 1 1 38 GLY H H 24.020 -8.614 -10.291 1.00 . A A . 38 GLY H 1 1 4 2356 1 1 38 GLY HA2 H 26.459 -8.999 -11.816 1.00 . A A . 38 GLY HA2 1 1 4 2357 1 1 38 GLY HA3 H 25.331 -10.323 -12.068 1.00 . A A . 38 GLY HA3 1 1 4 2358 1 1 38 GLY N N 24.870 -9.080 -10.429 1.00 . A A . 38 GLY N 1 1 4 2359 1 1 38 GLY O O 25.148 -8.390 -14.003 1.00 . A A . 38 GLY O 1 1 4 2360 1 1 39 VAL C C 23.293 -5.547 -13.385 1.00 . A A . 39 VAL C 1 1 4 2361 1 1 39 VAL CA C 22.811 -7.009 -13.478 1.00 . A A . 39 VAL CA 1 1 4 2362 1 1 39 VAL CB C 21.286 -7.127 -13.124 1.00 . A A . 39 VAL CB 1 1 4 2363 1 1 39 VAL CG1 C 20.431 -6.669 -14.331 1.00 . A A . 39 VAL CG1 1 1 4 2364 1 1 39 VAL CG2 C 20.917 -8.598 -12.801 1.00 . A A . 39 VAL CG2 1 1 4 2365 1 1 39 VAL H H 23.271 -7.914 -11.593 1.00 . A A . 39 VAL H 1 1 4 2366 1 1 39 VAL HA H 22.995 -7.373 -14.474 1.00 . A A . 39 VAL HA 1 1 4 2367 1 1 39 VAL HB H 21.051 -6.513 -12.267 1.00 . A A . 39 VAL HB 1 1 4 2368 1 1 39 VAL HG11 H 20.699 -7.229 -15.216 1.00 . A A . 39 VAL HG11 1 1 4 2369 1 1 39 VAL HG12 H 19.383 -6.830 -14.125 1.00 . A A . 39 VAL HG12 1 1 4 2370 1 1 39 VAL HG13 H 20.580 -5.619 -14.530 1.00 . A A . 39 VAL HG13 1 1 4 2371 1 1 39 VAL HG21 H 21.254 -9.252 -13.592 1.00 . A A . 39 VAL HG21 1 1 4 2372 1 1 39 VAL HG22 H 21.377 -8.909 -11.874 1.00 . A A . 39 VAL HG22 1 1 4 2373 1 1 39 VAL HG23 H 19.846 -8.698 -12.699 1.00 . A A . 39 VAL HG23 1 1 4 2374 1 1 39 VAL N N 23.593 -7.839 -12.510 1.00 . A A . 39 VAL N 1 1 4 2375 1 1 39 VAL O O 22.529 -4.615 -13.550 1.00 . A A . 39 VAL O 1 1 4 2376 1 1 40 VAL C C 24.797 -3.114 -14.129 1.00 . A A . 40 VAL C 1 1 4 2377 1 1 40 VAL CA C 25.221 -4.065 -12.988 1.00 . A A . 40 VAL CA 1 1 4 2378 1 1 40 VAL CB C 26.771 -4.258 -12.997 1.00 . A A . 40 VAL CB 1 1 4 2379 1 1 40 VAL CG1 C 27.469 -2.896 -12.772 1.00 . A A . 40 VAL CG1 1 1 4 2380 1 1 40 VAL CG2 C 27.207 -5.226 -11.870 1.00 . A A . 40 VAL CG2 1 1 4 2381 1 1 40 VAL H H 25.109 -6.217 -13.001 1.00 . A A . 40 VAL H 1 1 4 2382 1 1 40 VAL HA H 24.917 -3.641 -12.042 1.00 . A A . 40 VAL HA 1 1 4 2383 1 1 40 VAL HB H 27.080 -4.664 -13.950 1.00 . A A . 40 VAL HB 1 1 4 2384 1 1 40 VAL HG11 H 27.073 -2.411 -11.891 1.00 . A A . 40 VAL HG11 1 1 4 2385 1 1 40 VAL HG12 H 28.531 -3.040 -12.643 1.00 . A A . 40 VAL HG12 1 1 4 2386 1 1 40 VAL HG13 H 27.310 -2.253 -13.625 1.00 . A A . 40 VAL HG13 1 1 4 2387 1 1 40 VAL HG21 H 26.735 -6.190 -11.991 1.00 . A A . 40 VAL HG21 1 1 4 2388 1 1 40 VAL HG22 H 28.277 -5.365 -11.903 1.00 . A A . 40 VAL HG22 1 1 4 2389 1 1 40 VAL HG23 H 26.942 -4.824 -10.903 1.00 . A A . 40 VAL HG23 1 1 4 2390 1 1 40 VAL N N 24.569 -5.410 -13.119 1.00 . A A . 40 VAL N 1 1 4 2391 1 1 40 VAL O O 24.322 -2.042 -13.787 1.00 . A A . 40 VAL O 1 1 4 2392 1 1 40 VAL OXT O 24.969 -3.511 -15.270 1.00 . A A . 40 VAL OXT 1 1 5 2393 1 1 1 ASP C C -16.814 -10.756 9.781 1.00 . A A . 1 ASP C 1 1 5 2394 1 1 1 ASP CA C -18.042 -11.008 8.886 1.00 . A A . 1 ASP CA 1 1 5 2395 1 1 1 ASP CB C -17.668 -10.906 7.378 1.00 . A A . 1 ASP CB 1 1 5 2396 1 1 1 ASP CG C -16.993 -9.557 7.074 1.00 . A A . 1 ASP CG 1 1 5 2397 1 1 1 ASP H1 H -18.771 -9.373 9.948 1.00 . A A . 1 ASP H1 1 1 5 2398 1 1 1 ASP H2 H -19.292 -9.436 8.335 1.00 . A A . 1 ASP H2 1 1 5 2399 1 1 1 ASP H3 H -19.964 -10.489 9.487 1.00 . A A . 1 ASP H3 1 1 5 2400 1 1 1 ASP HA H -18.427 -11.992 9.103 1.00 . A A . 1 ASP HA 1 1 5 2401 1 1 1 ASP HB2 H -17.000 -11.712 7.108 1.00 . A A . 1 ASP HB2 1 1 5 2402 1 1 1 ASP HB3 H -18.561 -10.992 6.775 1.00 . A A . 1 ASP HB3 1 1 5 2403 1 1 1 ASP N N -19.098 -10.001 9.186 1.00 . A A . 1 ASP N 1 1 5 2404 1 1 1 ASP O O -16.927 -10.162 10.836 1.00 . A A . 1 ASP O 1 1 5 2405 1 1 1 ASP OD1 O -17.729 -8.593 6.942 1.00 . A A . 1 ASP OD1 1 1 5 2406 1 1 1 ASP OD2 O -15.777 -9.566 6.995 1.00 . A A . 1 ASP OD2 1 1 5 2407 1 1 2 ALA C C -13.941 -9.581 9.976 1.00 . A A . 2 ALA C 1 1 5 2408 1 1 2 ALA CA C -14.414 -11.037 10.109 1.00 . A A . 2 ALA CA 1 1 5 2409 1 1 2 ALA CB C -13.358 -12.006 9.555 1.00 . A A . 2 ALA CB 1 1 5 2410 1 1 2 ALA H H -15.650 -11.694 8.477 1.00 . A A . 2 ALA H 1 1 5 2411 1 1 2 ALA HA H -14.599 -11.259 11.150 1.00 . A A . 2 ALA HA 1 1 5 2412 1 1 2 ALA HB1 H -13.298 -11.919 8.481 1.00 . A A . 2 ALA HB1 1 1 5 2413 1 1 2 ALA HB2 H -12.390 -11.785 9.983 1.00 . A A . 2 ALA HB2 1 1 5 2414 1 1 2 ALA HB3 H -13.622 -13.024 9.804 1.00 . A A . 2 ALA HB3 1 1 5 2415 1 1 2 ALA N N -15.675 -11.220 9.334 1.00 . A A . 2 ALA N 1 1 5 2416 1 1 2 ALA O O -13.312 -9.205 9.006 1.00 . A A . 2 ALA O 1 1 5 2417 1 1 3 GLU C C -12.508 -7.213 11.661 1.00 . A A . 3 GLU C 1 1 5 2418 1 1 3 GLU CA C -13.874 -7.357 10.976 1.00 . A A . 3 GLU CA 1 1 5 2419 1 1 3 GLU CB C -15.007 -6.578 11.706 1.00 . A A . 3 GLU CB 1 1 5 2420 1 1 3 GLU CD C -16.490 -7.019 9.662 1.00 . A A . 3 GLU CD 1 1 5 2421 1 1 3 GLU CG C -15.979 -5.957 10.663 1.00 . A A . 3 GLU CG 1 1 5 2422 1 1 3 GLU H H -14.780 -9.163 11.723 1.00 . A A . 3 GLU H 1 1 5 2423 1 1 3 GLU HA H -13.764 -7.006 9.961 1.00 . A A . 3 GLU HA 1 1 5 2424 1 1 3 GLU HB2 H -15.558 -7.242 12.356 1.00 . A A . 3 GLU HB2 1 1 5 2425 1 1 3 GLU HB3 H -14.599 -5.780 12.307 1.00 . A A . 3 GLU HB3 1 1 5 2426 1 1 3 GLU HG2 H -16.827 -5.521 11.173 1.00 . A A . 3 GLU HG2 1 1 5 2427 1 1 3 GLU HG3 H -15.473 -5.171 10.118 1.00 . A A . 3 GLU HG3 1 1 5 2428 1 1 3 GLU N N -14.269 -8.799 10.971 1.00 . A A . 3 GLU N 1 1 5 2429 1 1 3 GLU O O -12.335 -6.545 12.662 1.00 . A A . 3 GLU O 1 1 5 2430 1 1 3 GLU OE1 O -17.512 -7.613 9.967 1.00 . A A . 3 GLU OE1 1 1 5 2431 1 1 3 GLU OE2 O -15.831 -7.181 8.648 1.00 . A A . 3 GLU OE2 1 1 5 2432 1 1 4 PHE C C -9.327 -8.047 10.205 1.00 . A A . 4 PHE C 1 1 5 2433 1 1 4 PHE CA C -10.153 -7.921 11.494 1.00 . A A . 4 PHE CA 1 1 5 2434 1 1 4 PHE CB C -9.939 -9.146 12.416 1.00 . A A . 4 PHE CB 1 1 5 2435 1 1 4 PHE CD1 C -10.417 -8.288 14.758 1.00 . A A . 4 PHE CD1 1 1 5 2436 1 1 4 PHE CD2 C -12.063 -9.649 13.695 1.00 . A A . 4 PHE CD2 1 1 5 2437 1 1 4 PHE CE1 C -11.224 -8.181 15.872 1.00 . A A . 4 PHE CE1 1 1 5 2438 1 1 4 PHE CE2 C -12.870 -9.542 14.808 1.00 . A A . 4 PHE CE2 1 1 5 2439 1 1 4 PHE CG C -10.830 -9.024 13.661 1.00 . A A . 4 PHE CG 1 1 5 2440 1 1 4 PHE CZ C -12.452 -8.808 15.896 1.00 . A A . 4 PHE CZ 1 1 5 2441 1 1 4 PHE H H -11.819 -8.398 10.241 1.00 . A A . 4 PHE H 1 1 5 2442 1 1 4 PHE HA H -9.900 -6.997 11.994 1.00 . A A . 4 PHE HA 1 1 5 2443 1 1 4 PHE HB2 H -10.188 -10.059 11.893 1.00 . A A . 4 PHE HB2 1 1 5 2444 1 1 4 PHE HB3 H -8.907 -9.193 12.730 1.00 . A A . 4 PHE HB3 1 1 5 2445 1 1 4 PHE HD1 H -9.457 -7.793 14.746 1.00 . A A . 4 PHE HD1 1 1 5 2446 1 1 4 PHE HD2 H -12.399 -10.226 12.846 1.00 . A A . 4 PHE HD2 1 1 5 2447 1 1 4 PHE HE1 H -10.896 -7.606 16.724 1.00 . A A . 4 PHE HE1 1 1 5 2448 1 1 4 PHE HE2 H -13.832 -10.034 14.826 1.00 . A A . 4 PHE HE2 1 1 5 2449 1 1 4 PHE HZ H -13.084 -8.725 16.767 1.00 . A A . 4 PHE HZ 1 1 5 2450 1 1 4 PHE N N -11.574 -7.888 11.041 1.00 . A A . 4 PHE N 1 1 5 2451 1 1 4 PHE O O -8.578 -8.985 10.011 1.00 . A A . 4 PHE O 1 1 5 2452 1 1 5 ARG C C -9.125 -8.208 7.157 1.00 . A A . 5 ARG C 1 1 5 2453 1 1 5 ARG CA C -8.820 -6.978 8.037 1.00 . A A . 5 ARG CA 1 1 5 2454 1 1 5 ARG CB C -7.283 -6.864 8.270 1.00 . A A . 5 ARG CB 1 1 5 2455 1 1 5 ARG CD C -5.443 -5.584 9.391 1.00 . A A . 5 ARG CD 1 1 5 2456 1 1 5 ARG CG C -6.965 -5.641 9.156 1.00 . A A . 5 ARG CG 1 1 5 2457 1 1 5 ARG CZ C -4.994 -3.167 9.428 1.00 . A A . 5 ARG CZ 1 1 5 2458 1 1 5 ARG H H -10.146 -6.350 9.608 1.00 . A A . 5 ARG H 1 1 5 2459 1 1 5 ARG HA H -9.181 -6.100 7.521 1.00 . A A . 5 ARG HA 1 1 5 2460 1 1 5 ARG HB2 H -6.904 -7.764 8.731 1.00 . A A . 5 ARG HB2 1 1 5 2461 1 1 5 ARG HB3 H -6.792 -6.740 7.315 1.00 . A A . 5 ARG HB3 1 1 5 2462 1 1 5 ARG HD2 H -5.138 -6.400 10.030 1.00 . A A . 5 ARG HD2 1 1 5 2463 1 1 5 ARG HD3 H -4.897 -5.646 8.460 1.00 . A A . 5 ARG HD3 1 1 5 2464 1 1 5 ARG HE H -4.966 -4.302 11.052 1.00 . A A . 5 ARG HE 1 1 5 2465 1 1 5 ARG HG2 H -7.301 -4.738 8.667 1.00 . A A . 5 ARG HG2 1 1 5 2466 1 1 5 ARG HG3 H -7.470 -5.727 10.107 1.00 . A A . 5 ARG HG3 1 1 5 2467 1 1 5 ARG HH11 H -5.409 -3.952 7.628 1.00 . A A . 5 ARG HH11 1 1 5 2468 1 1 5 ARG HH12 H -5.082 -2.253 7.648 1.00 . A A . 5 ARG HH12 1 1 5 2469 1 1 5 ARG HH21 H -4.561 -2.149 11.097 1.00 . A A . 5 ARG HH21 1 1 5 2470 1 1 5 ARG HH22 H -4.600 -1.215 9.639 1.00 . A A . 5 ARG HH22 1 1 5 2471 1 1 5 ARG N N -9.519 -7.061 9.361 1.00 . A A . 5 ARG N 1 1 5 2472 1 1 5 ARG NE N -5.108 -4.297 10.081 1.00 . A A . 5 ARG NE 1 1 5 2473 1 1 5 ARG NH1 N -5.176 -3.121 8.135 1.00 . A A . 5 ARG NH1 1 1 5 2474 1 1 5 ARG NH2 N -4.695 -2.094 10.108 1.00 . A A . 5 ARG NH2 1 1 5 2475 1 1 5 ARG O O -8.266 -8.708 6.455 1.00 . A A . 5 ARG O 1 1 5 2476 1 1 6 HIS C C -12.267 -9.640 6.036 1.00 . A A . 6 HIS C 1 1 5 2477 1 1 6 HIS CA C -10.795 -9.838 6.431 1.00 . A A . 6 HIS CA 1 1 5 2478 1 1 6 HIS CB C -10.591 -11.108 7.308 1.00 . A A . 6 HIS CB 1 1 5 2479 1 1 6 HIS CD2 C -11.396 -13.633 7.141 1.00 . A A . 6 HIS CD2 1 1 5 2480 1 1 6 HIS CE1 C -12.063 -13.622 5.179 1.00 . A A . 6 HIS CE1 1 1 5 2481 1 1 6 HIS CG C -11.189 -12.360 6.637 1.00 . A A . 6 HIS CG 1 1 5 2482 1 1 6 HIS H H -11.009 -8.222 7.807 1.00 . A A . 6 HIS H 1 1 5 2483 1 1 6 HIS HA H -10.204 -9.895 5.533 1.00 . A A . 6 HIS HA 1 1 5 2484 1 1 6 HIS HB2 H -9.535 -11.275 7.459 1.00 . A A . 6 HIS HB2 1 1 5 2485 1 1 6 HIS HB3 H -11.059 -10.971 8.270 1.00 . A A . 6 HIS HB3 1 1 5 2486 1 1 6 HIS HD1 H -11.625 -11.689 4.779 1.00 . A A . 6 HIS HD1 1 1 5 2487 1 1 6 HIS HD2 H -11.149 -13.950 8.144 1.00 . A A . 6 HIS HD2 1 1 5 2488 1 1 6 HIS HE1 H -12.479 -13.934 4.231 1.00 . A A . 6 HIS HE1 1 1 5 2489 1 1 6 HIS N N -10.355 -8.657 7.227 1.00 . A A . 6 HIS N 1 1 5 2490 1 1 6 HIS ND1 N -11.625 -12.429 5.421 1.00 . A A . 6 HIS ND1 1 1 5 2491 1 1 6 HIS NE2 N -11.940 -14.405 6.221 1.00 . A A . 6 HIS NE2 1 1 5 2492 1 1 6 HIS O O -13.161 -10.247 6.593 1.00 . A A . 6 HIS O 1 1 5 2493 1 1 7 ASP C C -14.480 -9.676 3.863 1.00 . A A . 7 ASP C 1 1 5 2494 1 1 7 ASP CA C -13.821 -8.458 4.549 1.00 . A A . 7 ASP CA 1 1 5 2495 1 1 7 ASP CB C -13.656 -7.279 3.570 1.00 . A A . 7 ASP CB 1 1 5 2496 1 1 7 ASP CG C -12.769 -7.707 2.383 1.00 . A A . 7 ASP CG 1 1 5 2497 1 1 7 ASP H H -11.697 -8.325 4.662 1.00 . A A . 7 ASP H 1 1 5 2498 1 1 7 ASP HA H -14.440 -8.143 5.374 1.00 . A A . 7 ASP HA 1 1 5 2499 1 1 7 ASP HB2 H -14.618 -6.966 3.205 1.00 . A A . 7 ASP HB2 1 1 5 2500 1 1 7 ASP HB3 H -13.195 -6.442 4.074 1.00 . A A . 7 ASP HB3 1 1 5 2501 1 1 7 ASP N N -12.460 -8.781 5.069 1.00 . A A . 7 ASP N 1 1 5 2502 1 1 7 ASP O O -14.111 -10.809 4.110 1.00 . A A . 7 ASP O 1 1 5 2503 1 1 7 ASP OD1 O -13.338 -8.195 1.419 1.00 . A A . 7 ASP OD1 1 1 5 2504 1 1 7 ASP OD2 O -11.570 -7.521 2.510 1.00 . A A . 7 ASP OD2 1 1 5 2505 1 1 8 SER C C -16.585 -9.911 0.902 1.00 . A A . 8 SER C 1 1 5 2506 1 1 8 SER CA C -16.170 -10.464 2.279 1.00 . A A . 8 SER CA 1 1 5 2507 1 1 8 SER CB C -17.395 -10.877 3.128 1.00 . A A . 8 SER CB 1 1 5 2508 1 1 8 SER H H -15.691 -8.466 2.863 1.00 . A A . 8 SER H 1 1 5 2509 1 1 8 SER HA H -15.504 -11.299 2.127 1.00 . A A . 8 SER HA 1 1 5 2510 1 1 8 SER HB2 H -17.105 -11.137 4.136 1.00 . A A . 8 SER HB2 1 1 5 2511 1 1 8 SER HB3 H -18.158 -10.112 3.148 1.00 . A A . 8 SER HB3 1 1 5 2512 1 1 8 SER HG H -18.787 -11.842 2.170 1.00 . A A . 8 SER HG 1 1 5 2513 1 1 8 SER N N -15.441 -9.397 3.018 1.00 . A A . 8 SER N 1 1 5 2514 1 1 8 SER O O -17.752 -9.721 0.615 1.00 . A A . 8 SER O 1 1 5 2515 1 1 8 SER OG O -17.896 -12.035 2.474 1.00 . A A . 8 SER OG 1 1 5 2516 1 1 9 GLY C C -16.152 -7.629 -1.240 1.00 . A A . 9 GLY C 1 1 5 2517 1 1 9 GLY CA C -15.817 -9.126 -1.289 1.00 . A A . 9 GLY CA 1 1 5 2518 1 1 9 GLY H H -14.670 -9.844 0.387 1.00 . A A . 9 GLY H 1 1 5 2519 1 1 9 GLY HA2 H -14.918 -9.263 -1.872 1.00 . A A . 9 GLY HA2 1 1 5 2520 1 1 9 GLY HA3 H -16.630 -9.662 -1.757 1.00 . A A . 9 GLY HA3 1 1 5 2521 1 1 9 GLY N N -15.586 -9.668 0.089 1.00 . A A . 9 GLY N 1 1 5 2522 1 1 9 GLY O O -16.974 -7.150 -1.997 1.00 . A A . 9 GLY O 1 1 5 2523 1 1 10 TYR C C -15.061 -4.694 -1.332 1.00 . A A . 10 TYR C 1 1 5 2524 1 1 10 TYR CA C -15.712 -5.471 -0.175 1.00 . A A . 10 TYR CA 1 1 5 2525 1 1 10 TYR CB C -15.102 -5.055 1.186 1.00 . A A . 10 TYR CB 1 1 5 2526 1 1 10 TYR CD1 C -15.929 -2.663 1.430 1.00 . A A . 10 TYR CD1 1 1 5 2527 1 1 10 TYR CD2 C -13.590 -3.019 1.162 1.00 . A A . 10 TYR CD2 1 1 5 2528 1 1 10 TYR CE1 C -15.713 -1.302 1.498 1.00 . A A . 10 TYR CE1 1 1 5 2529 1 1 10 TYR CE2 C -13.375 -1.659 1.230 1.00 . A A . 10 TYR CE2 1 1 5 2530 1 1 10 TYR CG C -14.870 -3.533 1.262 1.00 . A A . 10 TYR CG 1 1 5 2531 1 1 10 TYR CZ C -14.435 -0.792 1.398 1.00 . A A . 10 TYR CZ 1 1 5 2532 1 1 10 TYR H H -14.847 -7.398 0.230 1.00 . A A . 10 TYR H 1 1 5 2533 1 1 10 TYR HA H -16.775 -5.275 -0.169 1.00 . A A . 10 TYR HA 1 1 5 2534 1 1 10 TYR HB2 H -15.770 -5.342 1.985 1.00 . A A . 10 TYR HB2 1 1 5 2535 1 1 10 TYR HB3 H -14.157 -5.555 1.331 1.00 . A A . 10 TYR HB3 1 1 5 2536 1 1 10 TYR HD1 H -16.936 -3.048 1.509 1.00 . A A . 10 TYR HD1 1 1 5 2537 1 1 10 TYR HD2 H -12.751 -3.686 1.030 1.00 . A A . 10 TYR HD2 1 1 5 2538 1 1 10 TYR HE1 H -16.549 -0.632 1.629 1.00 . A A . 10 TYR HE1 1 1 5 2539 1 1 10 TYR HE2 H -12.370 -1.272 1.150 1.00 . A A . 10 TYR HE2 1 1 5 2540 1 1 10 TYR HH H -14.029 0.789 2.379 1.00 . A A . 10 TYR HH 1 1 5 2541 1 1 10 TYR N N -15.494 -6.940 -0.344 1.00 . A A . 10 TYR N 1 1 5 2542 1 1 10 TYR O O -13.928 -4.952 -1.690 1.00 . A A . 10 TYR O 1 1 5 2543 1 1 10 TYR OH O -14.217 0.568 1.464 1.00 . A A . 10 TYR OH 1 1 5 2544 1 1 11 GLU C C -14.370 -1.857 -2.435 1.00 . A A . 11 GLU C 1 1 5 2545 1 1 11 GLU CA C -15.297 -2.934 -3.007 1.00 . A A . 11 GLU CA 1 1 5 2546 1 1 11 GLU CB C -16.498 -2.285 -3.741 1.00 . A A . 11 GLU CB 1 1 5 2547 1 1 11 GLU CD C -16.257 0.164 -4.381 1.00 . A A . 11 GLU CD 1 1 5 2548 1 1 11 GLU CG C -16.012 -1.290 -4.840 1.00 . A A . 11 GLU CG 1 1 5 2549 1 1 11 GLU H H -16.715 -3.613 -1.533 1.00 . A A . 11 GLU H 1 1 5 2550 1 1 11 GLU HA H -14.740 -3.565 -3.686 1.00 . A A . 11 GLU HA 1 1 5 2551 1 1 11 GLU HB2 H -17.078 -3.067 -4.212 1.00 . A A . 11 GLU HB2 1 1 5 2552 1 1 11 GLU HB3 H -17.131 -1.780 -3.026 1.00 . A A . 11 GLU HB3 1 1 5 2553 1 1 11 GLU HG2 H -14.961 -1.419 -5.052 1.00 . A A . 11 GLU HG2 1 1 5 2554 1 1 11 GLU HG3 H -16.561 -1.467 -5.755 1.00 . A A . 11 GLU HG3 1 1 5 2555 1 1 11 GLU N N -15.809 -3.766 -1.874 1.00 . A A . 11 GLU N 1 1 5 2556 1 1 11 GLU O O -14.711 -1.198 -1.472 1.00 . A A . 11 GLU O 1 1 5 2557 1 1 11 GLU OE1 O -15.436 0.651 -3.619 1.00 . A A . 11 GLU OE1 1 1 5 2558 1 1 11 GLU OE2 O -17.255 0.710 -4.820 1.00 . A A . 11 GLU OE2 1 1 5 2559 1 1 12 VAL C C -12.261 0.492 -3.564 1.00 . A A . 12 VAL C 1 1 5 2560 1 1 12 VAL CA C -12.221 -0.711 -2.624 1.00 . A A . 12 VAL CA 1 1 5 2561 1 1 12 VAL CB C -10.812 -1.348 -2.649 1.00 . A A . 12 VAL CB 1 1 5 2562 1 1 12 VAL CG1 C -10.697 -2.390 -1.518 1.00 . A A . 12 VAL CG1 1 1 5 2563 1 1 12 VAL CG2 C -10.523 -2.018 -4.010 1.00 . A A . 12 VAL CG2 1 1 5 2564 1 1 12 VAL H H -13.018 -2.274 -3.830 1.00 . A A . 12 VAL H 1 1 5 2565 1 1 12 VAL HA H -12.452 -0.375 -1.622 1.00 . A A . 12 VAL HA 1 1 5 2566 1 1 12 VAL HB H -10.083 -0.570 -2.492 1.00 . A A . 12 VAL HB 1 1 5 2567 1 1 12 VAL HG11 H -11.438 -3.166 -1.643 1.00 . A A . 12 VAL HG11 1 1 5 2568 1 1 12 VAL HG12 H -9.714 -2.838 -1.523 1.00 . A A . 12 VAL HG12 1 1 5 2569 1 1 12 VAL HG13 H -10.853 -1.911 -0.562 1.00 . A A . 12 VAL HG13 1 1 5 2570 1 1 12 VAL HG21 H -10.689 -1.316 -4.814 1.00 . A A . 12 VAL HG21 1 1 5 2571 1 1 12 VAL HG22 H -9.494 -2.343 -4.047 1.00 . A A . 12 VAL HG22 1 1 5 2572 1 1 12 VAL HG23 H -11.164 -2.874 -4.156 1.00 . A A . 12 VAL HG23 1 1 5 2573 1 1 12 VAL N N -13.229 -1.715 -3.058 1.00 . A A . 12 VAL N 1 1 5 2574 1 1 12 VAL O O -12.812 0.445 -4.646 1.00 . A A . 12 VAL O 1 1 5 2575 1 1 13 HIS C C -10.365 2.778 -4.781 1.00 . A A . 13 HIS C 1 1 5 2576 1 1 13 HIS CA C -11.575 2.817 -3.846 1.00 . A A . 13 HIS CA 1 1 5 2577 1 1 13 HIS CB C -11.468 3.987 -2.828 1.00 . A A . 13 HIS CB 1 1 5 2578 1 1 13 HIS CD2 C -14.012 4.451 -2.256 1.00 . A A . 13 HIS CD2 1 1 5 2579 1 1 13 HIS CE1 C -14.197 6.295 -3.185 1.00 . A A . 13 HIS CE1 1 1 5 2580 1 1 13 HIS CG C -12.786 4.763 -2.819 1.00 . A A . 13 HIS CG 1 1 5 2581 1 1 13 HIS H H -11.234 1.444 -2.204 1.00 . A A . 13 HIS H 1 1 5 2582 1 1 13 HIS HA H -12.465 2.923 -4.447 1.00 . A A . 13 HIS HA 1 1 5 2583 1 1 13 HIS HB2 H -11.285 3.612 -1.831 1.00 . A A . 13 HIS HB2 1 1 5 2584 1 1 13 HIS HB3 H -10.674 4.670 -3.089 1.00 . A A . 13 HIS HB3 1 1 5 2585 1 1 13 HIS HD1 H -12.294 6.423 -3.866 1.00 . A A . 13 HIS HD1 1 1 5 2586 1 1 13 HIS HD2 H -14.227 3.547 -1.705 1.00 . A A . 13 HIS HD2 1 1 5 2587 1 1 13 HIS HE1 H -14.607 7.225 -3.550 1.00 . A A . 13 HIS HE1 1 1 5 2588 1 1 13 HIS N N -11.650 1.536 -3.084 1.00 . A A . 13 HIS N 1 1 5 2589 1 1 13 HIS ND1 N -12.973 5.915 -3.375 1.00 . A A . 13 HIS ND1 1 1 5 2590 1 1 13 HIS NE2 N -14.879 5.415 -2.493 1.00 . A A . 13 HIS NE2 1 1 5 2591 1 1 13 HIS O O -10.510 2.538 -5.965 1.00 . A A . 13 HIS O 1 1 5 2592 1 1 14 HIS C C -6.867 2.204 -4.269 1.00 . A A . 14 HIS C 1 1 5 2593 1 1 14 HIS CA C -7.938 3.010 -5.010 1.00 . A A . 14 HIS CA 1 1 5 2594 1 1 14 HIS CB C -7.457 4.477 -5.225 1.00 . A A . 14 HIS CB 1 1 5 2595 1 1 14 HIS CD2 C -9.690 5.653 -6.045 1.00 . A A . 14 HIS CD2 1 1 5 2596 1 1 14 HIS CE1 C -9.937 6.972 -4.465 1.00 . A A . 14 HIS CE1 1 1 5 2597 1 1 14 HIS CG C -8.639 5.456 -5.165 1.00 . A A . 14 HIS CG 1 1 5 2598 1 1 14 HIS H H -9.185 3.199 -3.257 1.00 . A A . 14 HIS H 1 1 5 2599 1 1 14 HIS HA H -8.114 2.515 -5.951 1.00 . A A . 14 HIS HA 1 1 5 2600 1 1 14 HIS HB2 H -6.730 4.762 -4.476 1.00 . A A . 14 HIS HB2 1 1 5 2601 1 1 14 HIS HB3 H -6.998 4.565 -6.198 1.00 . A A . 14 HIS HB3 1 1 5 2602 1 1 14 HIS HD1 H -8.291 6.422 -3.424 1.00 . A A . 14 HIS HD1 1 1 5 2603 1 1 14 HIS HD2 H -9.832 5.109 -6.966 1.00 . A A . 14 HIS HD2 1 1 5 2604 1 1 14 HIS HE1 H -10.335 7.742 -3.821 1.00 . A A . 14 HIS HE1 1 1 5 2605 1 1 14 HIS N N -9.210 3.014 -4.217 1.00 . A A . 14 HIS N 1 1 5 2606 1 1 14 HIS ND1 N -8.857 6.304 -4.214 1.00 . A A . 14 HIS ND1 1 1 5 2607 1 1 14 HIS NE2 N -10.488 6.601 -5.594 1.00 . A A . 14 HIS NE2 1 1 5 2608 1 1 14 HIS O O -5.682 2.346 -4.500 1.00 . A A . 14 HIS O 1 1 5 2609 1 1 15 GLN C C -5.515 -0.298 -3.550 1.00 . A A . 15 GLN C 1 1 5 2610 1 1 15 GLN CA C -6.404 0.498 -2.584 1.00 . A A . 15 GLN CA 1 1 5 2611 1 1 15 GLN CB C -7.242 -0.451 -1.709 1.00 . A A . 15 GLN CB 1 1 5 2612 1 1 15 GLN CD C -8.928 1.185 -0.733 1.00 . A A . 15 GLN CD 1 1 5 2613 1 1 15 GLN CG C -7.726 0.276 -0.429 1.00 . A A . 15 GLN CG 1 1 5 2614 1 1 15 GLN H H -8.300 1.292 -3.265 1.00 . A A . 15 GLN H 1 1 5 2615 1 1 15 GLN HA H -5.775 1.134 -1.980 1.00 . A A . 15 GLN HA 1 1 5 2616 1 1 15 GLN HB2 H -8.078 -0.825 -2.276 1.00 . A A . 15 GLN HB2 1 1 5 2617 1 1 15 GLN HB3 H -6.638 -1.294 -1.415 1.00 . A A . 15 GLN HB3 1 1 5 2618 1 1 15 GLN HE21 H -7.808 2.667 -1.436 1.00 . A A . 15 GLN HE21 1 1 5 2619 1 1 15 GLN HE22 H -9.481 2.953 -1.444 1.00 . A A . 15 GLN HE22 1 1 5 2620 1 1 15 GLN HG2 H -8.026 -0.456 0.307 1.00 . A A . 15 GLN HG2 1 1 5 2621 1 1 15 GLN HG3 H -6.932 0.878 -0.009 1.00 . A A . 15 GLN HG3 1 1 5 2622 1 1 15 GLN N N -7.330 1.357 -3.388 1.00 . A A . 15 GLN N 1 1 5 2623 1 1 15 GLN NE2 N -8.722 2.366 -1.247 1.00 . A A . 15 GLN NE2 1 1 5 2624 1 1 15 GLN O O -4.373 -0.591 -3.262 1.00 . A A . 15 GLN O 1 1 5 2625 1 1 15 GLN OE1 O -10.066 0.827 -0.504 1.00 . A A . 15 GLN OE1 1 1 5 2626 1 1 16 LYS C C -4.034 -0.673 -6.103 1.00 . A A . 16 LYS C 1 1 5 2627 1 1 16 LYS CA C -5.346 -1.382 -5.731 1.00 . A A . 16 LYS CA 1 1 5 2628 1 1 16 LYS CB C -6.254 -1.533 -6.989 1.00 . A A . 16 LYS CB 1 1 5 2629 1 1 16 LYS CD C -6.372 0.390 -8.667 1.00 . A A . 16 LYS CD 1 1 5 2630 1 1 16 LYS CE C -6.839 1.851 -8.823 1.00 . A A . 16 LYS CE 1 1 5 2631 1 1 16 LYS CG C -6.971 -0.199 -7.369 1.00 . A A . 16 LYS CG 1 1 5 2632 1 1 16 LYS H H -7.009 -0.337 -4.844 1.00 . A A . 16 LYS H 1 1 5 2633 1 1 16 LYS HA H -5.107 -2.354 -5.335 1.00 . A A . 16 LYS HA 1 1 5 2634 1 1 16 LYS HB2 H -5.662 -1.895 -7.818 1.00 . A A . 16 LYS HB2 1 1 5 2635 1 1 16 LYS HB3 H -7.007 -2.278 -6.775 1.00 . A A . 16 LYS HB3 1 1 5 2636 1 1 16 LYS HD2 H -5.293 0.355 -8.637 1.00 . A A . 16 LYS HD2 1 1 5 2637 1 1 16 LYS HD3 H -6.708 -0.187 -9.517 1.00 . A A . 16 LYS HD3 1 1 5 2638 1 1 16 LYS HE2 H -7.881 1.882 -9.108 1.00 . A A . 16 LYS HE2 1 1 5 2639 1 1 16 LYS HE3 H -6.714 2.390 -7.895 1.00 . A A . 16 LYS HE3 1 1 5 2640 1 1 16 LYS HG2 H -8.020 -0.399 -7.530 1.00 . A A . 16 LYS HG2 1 1 5 2641 1 1 16 LYS HG3 H -6.889 0.529 -6.578 1.00 . A A . 16 LYS HG3 1 1 5 2642 1 1 16 LYS HZ1 H -5.341 1.873 -10.270 1.00 . A A . 16 LYS HZ1 1 1 5 2643 1 1 16 LYS HZ2 H -6.669 2.868 -10.631 1.00 . A A . 16 LYS HZ2 1 1 5 2644 1 1 16 LYS HZ3 H -5.542 3.350 -9.456 1.00 . A A . 16 LYS HZ3 1 1 5 2645 1 1 16 LYS N N -6.084 -0.613 -4.685 1.00 . A A . 16 LYS N 1 1 5 2646 1 1 16 LYS NZ N -6.037 2.536 -9.875 1.00 . A A . 16 LYS NZ 1 1 5 2647 1 1 16 LYS O O -2.971 -1.263 -6.048 1.00 . A A . 16 LYS O 1 1 5 2648 1 1 17 LEU C C -2.014 1.505 -5.606 1.00 . A A . 17 LEU C 1 1 5 2649 1 1 17 LEU CA C -2.910 1.341 -6.839 1.00 . A A . 17 LEU CA 1 1 5 2650 1 1 17 LEU CB C -3.356 2.715 -7.449 1.00 . A A . 17 LEU CB 1 1 5 2651 1 1 17 LEU CD1 C -1.993 4.431 -6.126 1.00 . A A . 17 LEU CD1 1 1 5 2652 1 1 17 LEU CD2 C -4.273 5.014 -7.045 1.00 . A A . 17 LEU CD2 1 1 5 2653 1 1 17 LEU CG C -3.423 3.883 -6.430 1.00 . A A . 17 LEU CG 1 1 5 2654 1 1 17 LEU H H -5.012 1.019 -6.469 1.00 . A A . 17 LEU H 1 1 5 2655 1 1 17 LEU HA H -2.378 0.778 -7.591 1.00 . A A . 17 LEU HA 1 1 5 2656 1 1 17 LEU HB2 H -2.675 2.977 -8.245 1.00 . A A . 17 LEU HB2 1 1 5 2657 1 1 17 LEU HB3 H -4.333 2.583 -7.890 1.00 . A A . 17 LEU HB3 1 1 5 2658 1 1 17 LEU HD11 H -1.255 3.974 -6.770 1.00 . A A . 17 LEU HD11 1 1 5 2659 1 1 17 LEU HD12 H -1.945 5.501 -6.263 1.00 . A A . 17 LEU HD12 1 1 5 2660 1 1 17 LEU HD13 H -1.729 4.211 -5.102 1.00 . A A . 17 LEU HD13 1 1 5 2661 1 1 17 LEU HD21 H -5.206 4.620 -7.418 1.00 . A A . 17 LEU HD21 1 1 5 2662 1 1 17 LEU HD22 H -4.485 5.764 -6.299 1.00 . A A . 17 LEU HD22 1 1 5 2663 1 1 17 LEU HD23 H -3.742 5.476 -7.865 1.00 . A A . 17 LEU HD23 1 1 5 2664 1 1 17 LEU HG H -3.900 3.538 -5.527 1.00 . A A . 17 LEU HG 1 1 5 2665 1 1 17 LEU N N -4.137 0.583 -6.459 1.00 . A A . 17 LEU N 1 1 5 2666 1 1 17 LEU O O -0.811 1.421 -5.715 1.00 . A A . 17 LEU O 1 1 5 2667 1 1 18 VAL C C -0.860 0.678 -3.083 1.00 . A A . 18 VAL C 1 1 5 2668 1 1 18 VAL CA C -1.802 1.897 -3.210 1.00 . A A . 18 VAL CA 1 1 5 2669 1 1 18 VAL CB C -2.803 2.000 -2.031 1.00 . A A . 18 VAL CB 1 1 5 2670 1 1 18 VAL CG1 C -2.078 1.863 -0.692 1.00 . A A . 18 VAL CG1 1 1 5 2671 1 1 18 VAL CG2 C -3.520 3.369 -2.087 1.00 . A A . 18 VAL CG2 1 1 5 2672 1 1 18 VAL H H -3.579 1.804 -4.413 1.00 . A A . 18 VAL H 1 1 5 2673 1 1 18 VAL HA H -1.205 2.796 -3.289 1.00 . A A . 18 VAL HA 1 1 5 2674 1 1 18 VAL HB H -3.539 1.218 -2.103 1.00 . A A . 18 VAL HB 1 1 5 2675 1 1 18 VAL HG11 H -1.205 2.498 -0.675 1.00 . A A . 18 VAL HG11 1 1 5 2676 1 1 18 VAL HG12 H -2.742 2.145 0.112 1.00 . A A . 18 VAL HG12 1 1 5 2677 1 1 18 VAL HG13 H -1.776 0.836 -0.552 1.00 . A A . 18 VAL HG13 1 1 5 2678 1 1 18 VAL HG21 H -3.946 3.533 -3.067 1.00 . A A . 18 VAL HG21 1 1 5 2679 1 1 18 VAL HG22 H -4.317 3.400 -1.358 1.00 . A A . 18 VAL HG22 1 1 5 2680 1 1 18 VAL HG23 H -2.825 4.169 -1.877 1.00 . A A . 18 VAL HG23 1 1 5 2681 1 1 18 VAL N N -2.606 1.733 -4.460 1.00 . A A . 18 VAL N 1 1 5 2682 1 1 18 VAL O O 0.336 0.825 -2.940 1.00 . A A . 18 VAL O 1 1 5 2683 1 1 19 PHE C C 0.484 -1.736 -4.088 1.00 . A A . 19 PHE C 1 1 5 2684 1 1 19 PHE CA C -0.637 -1.759 -3.048 1.00 . A A . 19 PHE CA 1 1 5 2685 1 1 19 PHE CB C -1.553 -2.976 -3.302 1.00 . A A . 19 PHE CB 1 1 5 2686 1 1 19 PHE CD1 C -2.709 -2.514 -1.059 1.00 . A A . 19 PHE CD1 1 1 5 2687 1 1 19 PHE CD2 C -3.967 -3.533 -2.809 1.00 . A A . 19 PHE CD2 1 1 5 2688 1 1 19 PHE CE1 C -3.816 -2.558 -0.239 1.00 . A A . 19 PHE CE1 1 1 5 2689 1 1 19 PHE CE2 C -5.074 -3.576 -1.988 1.00 . A A . 19 PHE CE2 1 1 5 2690 1 1 19 PHE CG C -2.771 -3.001 -2.356 1.00 . A A . 19 PHE CG 1 1 5 2691 1 1 19 PHE CZ C -4.999 -3.088 -0.702 1.00 . A A . 19 PHE CZ 1 1 5 2692 1 1 19 PHE H H -2.400 -0.542 -3.275 1.00 . A A . 19 PHE H 1 1 5 2693 1 1 19 PHE HA H -0.191 -1.811 -2.069 1.00 . A A . 19 PHE HA 1 1 5 2694 1 1 19 PHE HB2 H -1.908 -2.958 -4.322 1.00 . A A . 19 PHE HB2 1 1 5 2695 1 1 19 PHE HB3 H -0.991 -3.886 -3.151 1.00 . A A . 19 PHE HB3 1 1 5 2696 1 1 19 PHE HD1 H -1.790 -2.094 -0.678 1.00 . A A . 19 PHE HD1 1 1 5 2697 1 1 19 PHE HD2 H -4.036 -3.918 -3.815 1.00 . A A . 19 PHE HD2 1 1 5 2698 1 1 19 PHE HE1 H -3.756 -2.175 0.769 1.00 . A A . 19 PHE HE1 1 1 5 2699 1 1 19 PHE HE2 H -6.001 -3.993 -2.353 1.00 . A A . 19 PHE HE2 1 1 5 2700 1 1 19 PHE HZ H -5.865 -3.123 -0.058 1.00 . A A . 19 PHE HZ 1 1 5 2701 1 1 19 PHE N N -1.434 -0.496 -3.153 1.00 . A A . 19 PHE N 1 1 5 2702 1 1 19 PHE O O 1.632 -1.983 -3.774 1.00 . A A . 19 PHE O 1 1 5 2703 1 1 20 PHE C C 2.270 -0.468 -5.992 1.00 . A A . 20 PHE C 1 1 5 2704 1 1 20 PHE CA C 1.093 -1.365 -6.422 1.00 . A A . 20 PHE CA 1 1 5 2705 1 1 20 PHE CB C 0.323 -0.820 -7.674 1.00 . A A . 20 PHE CB 1 1 5 2706 1 1 20 PHE CD1 C 2.202 -0.103 -9.210 1.00 . A A . 20 PHE CD1 1 1 5 2707 1 1 20 PHE CD2 C 0.711 1.583 -8.434 1.00 . A A . 20 PHE CD2 1 1 5 2708 1 1 20 PHE CE1 C 2.904 0.846 -9.918 1.00 . A A . 20 PHE CE1 1 1 5 2709 1 1 20 PHE CE2 C 1.411 2.533 -9.141 1.00 . A A . 20 PHE CE2 1 1 5 2710 1 1 20 PHE CG C 1.099 0.253 -8.460 1.00 . A A . 20 PHE CG 1 1 5 2711 1 1 20 PHE CZ C 2.511 2.166 -9.886 1.00 . A A . 20 PHE CZ 1 1 5 2712 1 1 20 PHE H H -0.837 -1.246 -5.481 1.00 . A A . 20 PHE H 1 1 5 2713 1 1 20 PHE HA H 1.461 -2.362 -6.617 1.00 . A A . 20 PHE HA 1 1 5 2714 1 1 20 PHE HB2 H 0.122 -1.644 -8.343 1.00 . A A . 20 PHE HB2 1 1 5 2715 1 1 20 PHE HB3 H -0.626 -0.408 -7.372 1.00 . A A . 20 PHE HB3 1 1 5 2716 1 1 20 PHE HD1 H 2.519 -1.134 -9.240 1.00 . A A . 20 PHE HD1 1 1 5 2717 1 1 20 PHE HD2 H -0.148 1.893 -7.861 1.00 . A A . 20 PHE HD2 1 1 5 2718 1 1 20 PHE HE1 H 3.762 0.548 -10.499 1.00 . A A . 20 PHE HE1 1 1 5 2719 1 1 20 PHE HE2 H 1.092 3.563 -9.106 1.00 . A A . 20 PHE HE2 1 1 5 2720 1 1 20 PHE HZ H 3.062 2.910 -10.443 1.00 . A A . 20 PHE HZ 1 1 5 2721 1 1 20 PHE N N 0.107 -1.430 -5.303 1.00 . A A . 20 PHE N 1 1 5 2722 1 1 20 PHE O O 3.407 -0.887 -6.038 1.00 . A A . 20 PHE O 1 1 5 2723 1 1 21 ALA C C 3.947 1.049 -4.073 1.00 . A A . 21 ALA C 1 1 5 2724 1 1 21 ALA CA C 3.036 1.691 -5.128 1.00 . A A . 21 ALA CA 1 1 5 2725 1 1 21 ALA CB C 2.357 2.946 -4.556 1.00 . A A . 21 ALA CB 1 1 5 2726 1 1 21 ALA H H 1.027 0.997 -5.549 1.00 . A A . 21 ALA H 1 1 5 2727 1 1 21 ALA HA H 3.645 1.948 -5.983 1.00 . A A . 21 ALA HA 1 1 5 2728 1 1 21 ALA HB1 H 1.685 2.685 -3.754 1.00 . A A . 21 ALA HB1 1 1 5 2729 1 1 21 ALA HB2 H 3.100 3.633 -4.180 1.00 . A A . 21 ALA HB2 1 1 5 2730 1 1 21 ALA HB3 H 1.790 3.439 -5.332 1.00 . A A . 21 ALA HB3 1 1 5 2731 1 1 21 ALA N N 1.968 0.734 -5.571 1.00 . A A . 21 ALA N 1 1 5 2732 1 1 21 ALA O O 5.154 1.128 -4.169 1.00 . A A . 21 ALA O 1 1 5 2733 1 1 22 GLU C C 5.141 -1.240 -2.680 1.00 . A A . 22 GLU C 1 1 5 2734 1 1 22 GLU CA C 4.187 -0.231 -2.022 1.00 . A A . 22 GLU CA 1 1 5 2735 1 1 22 GLU CB C 3.273 -0.975 -1.007 1.00 . A A . 22 GLU CB 1 1 5 2736 1 1 22 GLU CD C 2.544 1.403 -0.341 1.00 . A A . 22 GLU CD 1 1 5 2737 1 1 22 GLU CG C 2.138 -0.082 -0.426 1.00 . A A . 22 GLU CG 1 1 5 2738 1 1 22 GLU H H 2.382 0.411 -3.065 1.00 . A A . 22 GLU H 1 1 5 2739 1 1 22 GLU HA H 4.789 0.526 -1.539 1.00 . A A . 22 GLU HA 1 1 5 2740 1 1 22 GLU HB2 H 2.827 -1.836 -1.485 1.00 . A A . 22 GLU HB2 1 1 5 2741 1 1 22 GLU HB3 H 3.883 -1.328 -0.188 1.00 . A A . 22 GLU HB3 1 1 5 2742 1 1 22 GLU HG2 H 1.251 -0.179 -1.033 1.00 . A A . 22 GLU HG2 1 1 5 2743 1 1 22 GLU HG3 H 1.892 -0.427 0.569 1.00 . A A . 22 GLU HG3 1 1 5 2744 1 1 22 GLU N N 3.358 0.426 -3.088 1.00 . A A . 22 GLU N 1 1 5 2745 1 1 22 GLU O O 6.322 -1.246 -2.398 1.00 . A A . 22 GLU O 1 1 5 2746 1 1 22 GLU OE1 O 3.337 1.694 0.539 1.00 . A A . 22 GLU OE1 1 1 5 2747 1 1 22 GLU OE2 O 2.043 2.162 -1.156 1.00 . A A . 22 GLU OE2 1 1 5 2748 1 1 23 ASP C C 6.591 -2.447 -4.951 1.00 . A A . 23 ASP C 1 1 5 2749 1 1 23 ASP CA C 5.380 -3.094 -4.274 1.00 . A A . 23 ASP CA 1 1 5 2750 1 1 23 ASP CB C 4.489 -3.744 -5.339 1.00 . A A . 23 ASP CB 1 1 5 2751 1 1 23 ASP CG C 5.088 -5.100 -5.744 1.00 . A A . 23 ASP CG 1 1 5 2752 1 1 23 ASP H H 3.629 -1.984 -3.708 1.00 . A A . 23 ASP H 1 1 5 2753 1 1 23 ASP HA H 5.726 -3.828 -3.562 1.00 . A A . 23 ASP HA 1 1 5 2754 1 1 23 ASP HB2 H 3.483 -3.877 -4.974 1.00 . A A . 23 ASP HB2 1 1 5 2755 1 1 23 ASP HB3 H 4.434 -3.112 -6.212 1.00 . A A . 23 ASP HB3 1 1 5 2756 1 1 23 ASP N N 4.587 -2.056 -3.542 1.00 . A A . 23 ASP N 1 1 5 2757 1 1 23 ASP O O 7.712 -2.883 -4.802 1.00 . A A . 23 ASP O 1 1 5 2758 1 1 23 ASP OD1 O 5.917 -5.080 -6.640 1.00 . A A . 23 ASP OD1 1 1 5 2759 1 1 23 ASP OD2 O 4.687 -6.078 -5.135 1.00 . A A . 23 ASP OD2 1 1 5 2760 1 1 24 VAL C C 8.391 -0.126 -5.537 1.00 . A A . 24 VAL C 1 1 5 2761 1 1 24 VAL CA C 7.251 -0.592 -6.446 1.00 . A A . 24 VAL CA 1 1 5 2762 1 1 24 VAL CB C 6.441 0.579 -7.042 1.00 . A A . 24 VAL CB 1 1 5 2763 1 1 24 VAL CG1 C 7.303 1.526 -7.860 1.00 . A A . 24 VAL CG1 1 1 5 2764 1 1 24 VAL CG2 C 5.322 0.013 -7.936 1.00 . A A . 24 VAL CG2 1 1 5 2765 1 1 24 VAL H H 5.328 -1.164 -5.721 1.00 . A A . 24 VAL H 1 1 5 2766 1 1 24 VAL HA H 7.665 -1.194 -7.236 1.00 . A A . 24 VAL HA 1 1 5 2767 1 1 24 VAL HB H 5.993 1.156 -6.252 1.00 . A A . 24 VAL HB 1 1 5 2768 1 1 24 VAL HG11 H 7.832 0.979 -8.624 1.00 . A A . 24 VAL HG11 1 1 5 2769 1 1 24 VAL HG12 H 6.662 2.264 -8.323 1.00 . A A . 24 VAL HG12 1 1 5 2770 1 1 24 VAL HG13 H 8.002 2.028 -7.210 1.00 . A A . 24 VAL HG13 1 1 5 2771 1 1 24 VAL HG21 H 5.146 -1.032 -7.729 1.00 . A A . 24 VAL HG21 1 1 5 2772 1 1 24 VAL HG22 H 4.416 0.561 -7.733 1.00 . A A . 24 VAL HG22 1 1 5 2773 1 1 24 VAL HG23 H 5.573 0.113 -8.980 1.00 . A A . 24 VAL HG23 1 1 5 2774 1 1 24 VAL N N 6.271 -1.411 -5.677 1.00 . A A . 24 VAL N 1 1 5 2775 1 1 24 VAL O O 9.555 -0.284 -5.849 1.00 . A A . 24 VAL O 1 1 5 2776 1 1 25 GLY C C 9.892 -0.195 -2.908 1.00 . A A . 25 GLY C 1 1 5 2777 1 1 25 GLY CA C 9.000 0.942 -3.437 1.00 . A A . 25 GLY CA 1 1 5 2778 1 1 25 GLY H H 7.036 0.525 -4.269 1.00 . A A . 25 GLY H 1 1 5 2779 1 1 25 GLY HA2 H 9.617 1.693 -3.908 1.00 . A A . 25 GLY HA2 1 1 5 2780 1 1 25 GLY HA3 H 8.471 1.387 -2.607 1.00 . A A . 25 GLY HA3 1 1 5 2781 1 1 25 GLY N N 8.000 0.438 -4.428 1.00 . A A . 25 GLY N 1 1 5 2782 1 1 25 GLY O O 11.105 -0.132 -2.980 1.00 . A A . 25 GLY O 1 1 5 2783 1 1 26 SER C C 10.522 -3.360 -2.894 1.00 . A A . 26 SER C 1 1 5 2784 1 1 26 SER CA C 9.957 -2.400 -1.831 1.00 . A A . 26 SER CA 1 1 5 2785 1 1 26 SER CB C 8.967 -3.148 -0.923 1.00 . A A . 26 SER CB 1 1 5 2786 1 1 26 SER H H 8.272 -1.194 -2.379 1.00 . A A . 26 SER H 1 1 5 2787 1 1 26 SER HA H 10.778 -2.036 -1.231 1.00 . A A . 26 SER HA 1 1 5 2788 1 1 26 SER HB2 H 8.399 -2.466 -0.306 1.00 . A A . 26 SER HB2 1 1 5 2789 1 1 26 SER HB3 H 8.297 -3.776 -1.493 1.00 . A A . 26 SER HB3 1 1 5 2790 1 1 26 SER HG H 9.564 -4.877 -0.252 1.00 . A A . 26 SER HG 1 1 5 2791 1 1 26 SER N N 9.247 -1.211 -2.394 1.00 . A A . 26 SER N 1 1 5 2792 1 1 26 SER O O 11.207 -4.308 -2.554 1.00 . A A . 26 SER O 1 1 5 2793 1 1 26 SER OG O 9.789 -3.958 -0.092 1.00 . A A . 26 SER OG 1 1 5 2794 1 1 27 ASN C C 12.273 -4.069 -5.167 1.00 . A A . 27 ASN C 1 1 5 2795 1 1 27 ASN CA C 10.756 -4.010 -5.223 1.00 . A A . 27 ASN CA 1 1 5 2796 1 1 27 ASN CB C 10.294 -3.484 -6.603 1.00 . A A . 27 ASN CB 1 1 5 2797 1 1 27 ASN CG C 9.035 -4.233 -7.076 1.00 . A A . 27 ASN CG 1 1 5 2798 1 1 27 ASN H H 9.688 -2.336 -4.394 1.00 . A A . 27 ASN H 1 1 5 2799 1 1 27 ASN HA H 10.389 -5.002 -5.025 1.00 . A A . 27 ASN HA 1 1 5 2800 1 1 27 ASN HB2 H 10.067 -2.433 -6.547 1.00 . A A . 27 ASN HB2 1 1 5 2801 1 1 27 ASN HB3 H 11.071 -3.623 -7.337 1.00 . A A . 27 ASN HB3 1 1 5 2802 1 1 27 ASN HD21 H 8.326 -2.664 -8.060 1.00 . A A . 27 ASN HD21 1 1 5 2803 1 1 27 ASN HD22 H 7.357 -4.057 -8.117 1.00 . A A . 27 ASN HD22 1 1 5 2804 1 1 27 ASN N N 10.237 -3.109 -4.150 1.00 . A A . 27 ASN N 1 1 5 2805 1 1 27 ASN ND2 N 8.167 -3.598 -7.813 1.00 . A A . 27 ASN ND2 1 1 5 2806 1 1 27 ASN O O 12.828 -5.143 -5.102 1.00 . A A . 27 ASN O 1 1 5 2807 1 1 27 ASN OD1 O 8.826 -5.395 -6.788 1.00 . A A . 27 ASN OD1 1 1 5 2808 1 1 28 LYS C C 14.891 -3.740 -3.950 1.00 . A A . 28 LYS C 1 1 5 2809 1 1 28 LYS CA C 14.400 -2.877 -5.127 1.00 . A A . 28 LYS CA 1 1 5 2810 1 1 28 LYS CB C 14.831 -1.406 -4.944 1.00 . A A . 28 LYS CB 1 1 5 2811 1 1 28 LYS CD C 17.263 -1.687 -5.538 1.00 . A A . 28 LYS CD 1 1 5 2812 1 1 28 LYS CE C 18.370 -1.293 -6.526 1.00 . A A . 28 LYS CE 1 1 5 2813 1 1 28 LYS CG C 15.922 -1.052 -5.969 1.00 . A A . 28 LYS CG 1 1 5 2814 1 1 28 LYS H H 12.386 -2.098 -5.242 1.00 . A A . 28 LYS H 1 1 5 2815 1 1 28 LYS HA H 14.801 -3.301 -6.042 1.00 . A A . 28 LYS HA 1 1 5 2816 1 1 28 LYS HB2 H 13.984 -0.756 -5.107 1.00 . A A . 28 LYS HB2 1 1 5 2817 1 1 28 LYS HB3 H 15.197 -1.234 -3.942 1.00 . A A . 28 LYS HB3 1 1 5 2818 1 1 28 LYS HD2 H 17.527 -1.344 -4.548 1.00 . A A . 28 LYS HD2 1 1 5 2819 1 1 28 LYS HD3 H 17.172 -2.762 -5.518 1.00 . A A . 28 LYS HD3 1 1 5 2820 1 1 28 LYS HE2 H 18.080 -1.539 -7.537 1.00 . A A . 28 LYS HE2 1 1 5 2821 1 1 28 LYS HE3 H 18.571 -0.234 -6.463 1.00 . A A . 28 LYS HE3 1 1 5 2822 1 1 28 LYS HG2 H 15.628 -1.413 -6.945 1.00 . A A . 28 LYS HG2 1 1 5 2823 1 1 28 LYS HG3 H 16.015 0.021 -6.016 1.00 . A A . 28 LYS HG3 1 1 5 2824 1 1 28 LYS HZ1 H 19.459 -2.653 -5.378 1.00 . A A . 28 LYS HZ1 1 1 5 2825 1 1 28 LYS HZ2 H 19.902 -2.614 -7.016 1.00 . A A . 28 LYS HZ2 1 1 5 2826 1 1 28 LYS HZ3 H 20.379 -1.358 -5.977 1.00 . A A . 28 LYS HZ3 1 1 5 2827 1 1 28 LYS N N 12.906 -2.925 -5.185 1.00 . A A . 28 LYS N 1 1 5 2828 1 1 28 LYS NZ N 19.622 -2.035 -6.199 1.00 . A A . 28 LYS NZ 1 1 5 2829 1 1 28 LYS O O 15.867 -4.451 -4.072 1.00 . A A . 28 LYS O 1 1 5 2830 1 1 29 GLY C C 14.592 -5.959 -1.998 1.00 . A A . 29 GLY C 1 1 5 2831 1 1 29 GLY CA C 14.585 -4.464 -1.643 1.00 . A A . 29 GLY CA 1 1 5 2832 1 1 29 GLY H H 13.408 -3.080 -2.804 1.00 . A A . 29 GLY H 1 1 5 2833 1 1 29 GLY HA2 H 15.570 -4.163 -1.315 1.00 . A A . 29 GLY HA2 1 1 5 2834 1 1 29 GLY HA3 H 13.869 -4.288 -0.852 1.00 . A A . 29 GLY HA3 1 1 5 2835 1 1 29 GLY N N 14.193 -3.665 -2.844 1.00 . A A . 29 GLY N 1 1 5 2836 1 1 29 GLY O O 15.601 -6.628 -1.884 1.00 . A A . 29 GLY O 1 1 5 2837 1 1 30 ALA C C 14.381 -8.266 -3.868 1.00 . A A . 30 ALA C 1 1 5 2838 1 1 30 ALA CA C 13.330 -7.885 -2.814 1.00 . A A . 30 ALA CA 1 1 5 2839 1 1 30 ALA CB C 11.920 -8.131 -3.366 1.00 . A A . 30 ALA CB 1 1 5 2840 1 1 30 ALA H H 12.683 -5.831 -2.510 1.00 . A A . 30 ALA H 1 1 5 2841 1 1 30 ALA HA H 13.509 -8.485 -1.932 1.00 . A A . 30 ALA HA 1 1 5 2842 1 1 30 ALA HB1 H 11.182 -7.838 -2.634 1.00 . A A . 30 ALA HB1 1 1 5 2843 1 1 30 ALA HB2 H 11.762 -7.552 -4.264 1.00 . A A . 30 ALA HB2 1 1 5 2844 1 1 30 ALA HB3 H 11.787 -9.178 -3.594 1.00 . A A . 30 ALA HB3 1 1 5 2845 1 1 30 ALA N N 13.452 -6.437 -2.434 1.00 . A A . 30 ALA N 1 1 5 2846 1 1 30 ALA O O 15.019 -9.294 -3.784 1.00 . A A . 30 ALA O 1 1 5 2847 1 1 31 ILE C C 16.877 -7.843 -5.369 1.00 . A A . 31 ILE C 1 1 5 2848 1 1 31 ILE CA C 15.487 -7.581 -5.952 1.00 . A A . 31 ILE CA 1 1 5 2849 1 1 31 ILE CB C 15.372 -6.275 -6.792 1.00 . A A . 31 ILE CB 1 1 5 2850 1 1 31 ILE CD1 C 13.833 -5.106 -8.471 1.00 . A A . 31 ILE CD1 1 1 5 2851 1 1 31 ILE CG1 C 14.102 -6.400 -7.677 1.00 . A A . 31 ILE CG1 1 1 5 2852 1 1 31 ILE CG2 C 16.626 -5.990 -7.640 1.00 . A A . 31 ILE CG2 1 1 5 2853 1 1 31 ILE H H 13.973 -6.601 -4.848 1.00 . A A . 31 ILE H 1 1 5 2854 1 1 31 ILE HA H 15.195 -8.455 -6.512 1.00 . A A . 31 ILE HA 1 1 5 2855 1 1 31 ILE HB H 15.233 -5.443 -6.123 1.00 . A A . 31 ILE HB 1 1 5 2856 1 1 31 ILE HD11 H 13.998 -4.237 -7.853 1.00 . A A . 31 ILE HD11 1 1 5 2857 1 1 31 ILE HD12 H 14.484 -5.054 -9.331 1.00 . A A . 31 ILE HD12 1 1 5 2858 1 1 31 ILE HD13 H 12.808 -5.096 -8.813 1.00 . A A . 31 ILE HD13 1 1 5 2859 1 1 31 ILE HG12 H 14.216 -7.236 -8.345 1.00 . A A . 31 ILE HG12 1 1 5 2860 1 1 31 ILE HG13 H 13.246 -6.600 -7.049 1.00 . A A . 31 ILE HG13 1 1 5 2861 1 1 31 ILE HG21 H 16.813 -6.800 -8.326 1.00 . A A . 31 ILE HG21 1 1 5 2862 1 1 31 ILE HG22 H 16.484 -5.077 -8.199 1.00 . A A . 31 ILE HG22 1 1 5 2863 1 1 31 ILE HG23 H 17.482 -5.856 -6.995 1.00 . A A . 31 ILE HG23 1 1 5 2864 1 1 31 ILE N N 14.523 -7.403 -4.836 1.00 . A A . 31 ILE N 1 1 5 2865 1 1 31 ILE O O 17.493 -8.841 -5.681 1.00 . A A . 31 ILE O 1 1 5 2866 1 1 32 ILE C C 18.736 -8.501 -3.218 1.00 . A A . 32 ILE C 1 1 5 2867 1 1 32 ILE CA C 18.689 -7.139 -3.922 1.00 . A A . 32 ILE CA 1 1 5 2868 1 1 32 ILE CB C 18.943 -5.987 -2.916 1.00 . A A . 32 ILE CB 1 1 5 2869 1 1 32 ILE CD1 C 18.690 -3.462 -2.743 1.00 . A A . 32 ILE CD1 1 1 5 2870 1 1 32 ILE CG1 C 18.958 -4.643 -3.697 1.00 . A A . 32 ILE CG1 1 1 5 2871 1 1 32 ILE CG2 C 20.314 -6.195 -2.220 1.00 . A A . 32 ILE CG2 1 1 5 2872 1 1 32 ILE H H 16.812 -6.157 -4.320 1.00 . A A . 32 ILE H 1 1 5 2873 1 1 32 ILE HA H 19.418 -7.149 -4.712 1.00 . A A . 32 ILE HA 1 1 5 2874 1 1 32 ILE HB H 18.158 -5.975 -2.173 1.00 . A A . 32 ILE HB 1 1 5 2875 1 1 32 ILE HD11 H 19.247 -3.573 -1.824 1.00 . A A . 32 ILE HD11 1 1 5 2876 1 1 32 ILE HD12 H 18.989 -2.537 -3.214 1.00 . A A . 32 ILE HD12 1 1 5 2877 1 1 32 ILE HD13 H 17.638 -3.404 -2.505 1.00 . A A . 32 ILE HD13 1 1 5 2878 1 1 32 ILE HG12 H 19.908 -4.515 -4.187 1.00 . A A . 32 ILE HG12 1 1 5 2879 1 1 32 ILE HG13 H 18.198 -4.653 -4.461 1.00 . A A . 32 ILE HG13 1 1 5 2880 1 1 32 ILE HG21 H 21.080 -6.407 -2.952 1.00 . A A . 32 ILE HG21 1 1 5 2881 1 1 32 ILE HG22 H 20.600 -5.313 -1.666 1.00 . A A . 32 ILE HG22 1 1 5 2882 1 1 32 ILE HG23 H 20.256 -7.024 -1.530 1.00 . A A . 32 ILE HG23 1 1 5 2883 1 1 32 ILE N N 17.341 -6.950 -4.536 1.00 . A A . 32 ILE N 1 1 5 2884 1 1 32 ILE O O 19.673 -9.254 -3.385 1.00 . A A . 32 ILE O 1 1 5 2885 1 1 33 GLY C C 17.841 -11.279 -2.671 1.00 . A A . 33 GLY C 1 1 5 2886 1 1 33 GLY CA C 17.659 -10.083 -1.727 1.00 . A A . 33 GLY CA 1 1 5 2887 1 1 33 GLY H H 16.983 -8.136 -2.372 1.00 . A A . 33 GLY H 1 1 5 2888 1 1 33 GLY HA2 H 18.450 -10.099 -0.989 1.00 . A A . 33 GLY HA2 1 1 5 2889 1 1 33 GLY HA3 H 16.707 -10.171 -1.230 1.00 . A A . 33 GLY HA3 1 1 5 2890 1 1 33 GLY N N 17.713 -8.783 -2.458 1.00 . A A . 33 GLY N 1 1 5 2891 1 1 33 GLY O O 18.649 -12.147 -2.405 1.00 . A A . 33 GLY O 1 1 5 2892 1 1 34 LEU C C 18.570 -12.471 -5.465 1.00 . A A . 34 LEU C 1 1 5 2893 1 1 34 LEU CA C 17.241 -12.444 -4.699 1.00 . A A . 34 LEU CA 1 1 5 2894 1 1 34 LEU CB C 16.009 -12.414 -5.673 1.00 . A A . 34 LEU CB 1 1 5 2895 1 1 34 LEU CD1 C 16.732 -12.419 -8.113 1.00 . A A . 34 LEU CD1 1 1 5 2896 1 1 34 LEU CD2 C 14.830 -10.965 -7.367 1.00 . A A . 34 LEU CD2 1 1 5 2897 1 1 34 LEU CG C 16.199 -11.549 -6.950 1.00 . A A . 34 LEU CG 1 1 5 2898 1 1 34 LEU H H 16.473 -10.571 -3.933 1.00 . A A . 34 LEU H 1 1 5 2899 1 1 34 LEU HA H 17.196 -13.343 -4.108 1.00 . A A . 34 LEU HA 1 1 5 2900 1 1 34 LEU HB2 H 15.775 -13.430 -5.958 1.00 . A A . 34 LEU HB2 1 1 5 2901 1 1 34 LEU HB3 H 15.165 -12.033 -5.120 1.00 . A A . 34 LEU HB3 1 1 5 2902 1 1 34 LEU HD11 H 16.035 -13.214 -8.338 1.00 . A A . 34 LEU HD11 1 1 5 2903 1 1 34 LEU HD12 H 16.860 -11.811 -8.996 1.00 . A A . 34 LEU HD12 1 1 5 2904 1 1 34 LEU HD13 H 17.685 -12.858 -7.860 1.00 . A A . 34 LEU HD13 1 1 5 2905 1 1 34 LEU HD21 H 14.361 -10.470 -6.529 1.00 . A A . 34 LEU HD21 1 1 5 2906 1 1 34 LEU HD22 H 14.961 -10.246 -8.162 1.00 . A A . 34 LEU HD22 1 1 5 2907 1 1 34 LEU HD23 H 14.173 -11.750 -7.713 1.00 . A A . 34 LEU HD23 1 1 5 2908 1 1 34 LEU HG H 16.881 -10.741 -6.757 1.00 . A A . 34 LEU HG 1 1 5 2909 1 1 34 LEU N N 17.103 -11.298 -3.754 1.00 . A A . 34 LEU N 1 1 5 2910 1 1 34 LEU O O 19.102 -13.549 -5.646 1.00 . A A . 34 LEU O 1 1 5 2911 1 1 35 MET C C 21.492 -11.904 -5.667 1.00 . A A . 35 MET C 1 1 5 2912 1 1 35 MET CA C 20.399 -11.428 -6.640 1.00 . A A . 35 MET CA 1 1 5 2913 1 1 35 MET CB C 20.761 -10.031 -7.232 1.00 . A A . 35 MET CB 1 1 5 2914 1 1 35 MET CE C 22.801 -7.064 -5.717 1.00 . A A . 35 MET CE 1 1 5 2915 1 1 35 MET CG C 20.854 -8.945 -6.164 1.00 . A A . 35 MET CG 1 1 5 2916 1 1 35 MET H H 18.645 -10.488 -5.751 1.00 . A A . 35 MET H 1 1 5 2917 1 1 35 MET HA H 20.305 -12.149 -7.436 1.00 . A A . 35 MET HA 1 1 5 2918 1 1 35 MET HB2 H 21.707 -10.098 -7.751 1.00 . A A . 35 MET HB2 1 1 5 2919 1 1 35 MET HB3 H 20.005 -9.748 -7.949 1.00 . A A . 35 MET HB3 1 1 5 2920 1 1 35 MET HE1 H 22.556 -7.175 -4.672 1.00 . A A . 35 MET HE1 1 1 5 2921 1 1 35 MET HE2 H 23.534 -7.807 -5.997 1.00 . A A . 35 MET HE2 1 1 5 2922 1 1 35 MET HE3 H 23.208 -6.079 -5.888 1.00 . A A . 35 MET HE3 1 1 5 2923 1 1 35 MET HG2 H 19.884 -8.876 -5.708 1.00 . A A . 35 MET HG2 1 1 5 2924 1 1 35 MET HG3 H 21.558 -9.250 -5.406 1.00 . A A . 35 MET HG3 1 1 5 2925 1 1 35 MET N N 19.095 -11.348 -5.901 1.00 . A A . 35 MET N 1 1 5 2926 1 1 35 MET O O 22.406 -12.606 -6.053 1.00 . A A . 35 MET O 1 1 5 2927 1 1 35 MET SD S 21.307 -7.281 -6.718 1.00 . A A . 35 MET SD 1 1 5 2928 1 1 36 VAL C C 22.232 -13.397 -3.128 1.00 . A A . 36 VAL C 1 1 5 2929 1 1 36 VAL CA C 22.316 -11.873 -3.355 1.00 . A A . 36 VAL CA 1 1 5 2930 1 1 36 VAL CB C 21.937 -11.070 -2.065 1.00 . A A . 36 VAL CB 1 1 5 2931 1 1 36 VAL CG1 C 22.593 -11.691 -0.807 1.00 . A A . 36 VAL CG1 1 1 5 2932 1 1 36 VAL CG2 C 22.443 -9.615 -2.214 1.00 . A A . 36 VAL CG2 1 1 5 2933 1 1 36 VAL H H 20.595 -10.920 -4.199 1.00 . A A . 36 VAL H 1 1 5 2934 1 1 36 VAL HA H 23.315 -11.621 -3.680 1.00 . A A . 36 VAL HA 1 1 5 2935 1 1 36 VAL HB H 20.862 -11.057 -1.935 1.00 . A A . 36 VAL HB 1 1 5 2936 1 1 36 VAL HG11 H 23.638 -11.899 -0.988 1.00 . A A . 36 VAL HG11 1 1 5 2937 1 1 36 VAL HG12 H 22.517 -11.008 0.029 1.00 . A A . 36 VAL HG12 1 1 5 2938 1 1 36 VAL HG13 H 22.093 -12.611 -0.542 1.00 . A A . 36 VAL HG13 1 1 5 2939 1 1 36 VAL HG21 H 22.189 -9.223 -3.188 1.00 . A A . 36 VAL HG21 1 1 5 2940 1 1 36 VAL HG22 H 21.988 -8.989 -1.460 1.00 . A A . 36 VAL HG22 1 1 5 2941 1 1 36 VAL HG23 H 23.516 -9.574 -2.097 1.00 . A A . 36 VAL HG23 1 1 5 2942 1 1 36 VAL N N 21.349 -11.496 -4.430 1.00 . A A . 36 VAL N 1 1 5 2943 1 1 36 VAL O O 23.216 -14.094 -3.281 1.00 . A A . 36 VAL O 1 1 5 2944 1 1 37 GLY C C 20.612 -16.056 -3.848 1.00 . A A . 37 GLY C 1 1 5 2945 1 1 37 GLY CA C 20.847 -15.321 -2.525 1.00 . A A . 37 GLY CA 1 1 5 2946 1 1 37 GLY H H 20.301 -13.252 -2.668 1.00 . A A . 37 GLY H 1 1 5 2947 1 1 37 GLY HA2 H 21.713 -15.735 -2.029 1.00 . A A . 37 GLY HA2 1 1 5 2948 1 1 37 GLY HA3 H 19.981 -15.445 -1.891 1.00 . A A . 37 GLY HA3 1 1 5 2949 1 1 37 GLY N N 21.057 -13.862 -2.774 1.00 . A A . 37 GLY N 1 1 5 2950 1 1 37 GLY O O 21.491 -16.728 -4.353 1.00 . A A . 37 GLY O 1 1 5 2951 1 1 38 GLY C C 17.600 -16.168 -6.008 1.00 . A A . 38 GLY C 1 1 5 2952 1 1 38 GLY CA C 19.039 -16.552 -5.655 1.00 . A A . 38 GLY CA 1 1 5 2953 1 1 38 GLY H H 18.768 -15.335 -3.898 1.00 . A A . 38 GLY H 1 1 5 2954 1 1 38 GLY HA2 H 19.704 -16.219 -6.439 1.00 . A A . 38 GLY HA2 1 1 5 2955 1 1 38 GLY HA3 H 19.108 -17.625 -5.548 1.00 . A A . 38 GLY HA3 1 1 5 2956 1 1 38 GLY N N 19.420 -15.897 -4.366 1.00 . A A . 38 GLY N 1 1 5 2957 1 1 38 GLY O O 17.360 -15.447 -6.959 1.00 . A A . 38 GLY O 1 1 5 2958 1 1 39 VAL C C 14.703 -16.024 -4.006 1.00 . A A . 39 VAL C 1 1 5 2959 1 1 39 VAL CA C 15.233 -16.409 -5.397 1.00 . A A . 39 VAL CA 1 1 5 2960 1 1 39 VAL CB C 14.552 -17.705 -5.945 1.00 . A A . 39 VAL CB 1 1 5 2961 1 1 39 VAL CG1 C 13.103 -17.381 -6.386 1.00 . A A . 39 VAL CG1 1 1 5 2962 1 1 39 VAL CG2 C 15.330 -18.231 -7.175 1.00 . A A . 39 VAL CG2 1 1 5 2963 1 1 39 VAL H H 16.966 -17.241 -4.471 1.00 . A A . 39 VAL H 1 1 5 2964 1 1 39 VAL HA H 15.102 -15.577 -6.067 1.00 . A A . 39 VAL HA 1 1 5 2965 1 1 39 VAL HB H 14.539 -18.466 -5.179 1.00 . A A . 39 VAL HB 1 1 5 2966 1 1 39 VAL HG11 H 13.100 -16.589 -7.119 1.00 . A A . 39 VAL HG11 1 1 5 2967 1 1 39 VAL HG12 H 12.645 -18.258 -6.823 1.00 . A A . 39 VAL HG12 1 1 5 2968 1 1 39 VAL HG13 H 12.509 -17.072 -5.540 1.00 . A A . 39 VAL HG13 1 1 5 2969 1 1 39 VAL HG21 H 15.493 -17.436 -7.888 1.00 . A A . 39 VAL HG21 1 1 5 2970 1 1 39 VAL HG22 H 16.288 -18.624 -6.868 1.00 . A A . 39 VAL HG22 1 1 5 2971 1 1 39 VAL HG23 H 14.775 -19.021 -7.659 1.00 . A A . 39 VAL HG23 1 1 5 2972 1 1 39 VAL N N 16.690 -16.672 -5.214 1.00 . A A . 39 VAL N 1 1 5 2973 1 1 39 VAL O O 13.802 -16.634 -3.462 1.00 . A A . 39 VAL O 1 1 5 2974 1 1 40 VAL C C 15.277 -15.425 -1.039 1.00 . A A . 40 VAL C 1 1 5 2975 1 1 40 VAL CA C 15.039 -14.388 -2.162 1.00 . A A . 40 VAL CA 1 1 5 2976 1 1 40 VAL CB C 13.559 -13.867 -2.167 1.00 . A A . 40 VAL CB 1 1 5 2977 1 1 40 VAL CG1 C 13.198 -13.266 -0.786 1.00 . A A . 40 VAL CG1 1 1 5 2978 1 1 40 VAL CG2 C 13.407 -12.767 -3.239 1.00 . A A . 40 VAL CG2 1 1 5 2979 1 1 40 VAL H H 16.034 -14.592 -4.042 1.00 . A A . 40 VAL H 1 1 5 2980 1 1 40 VAL HA H 15.710 -13.553 -2.018 1.00 . A A . 40 VAL HA 1 1 5 2981 1 1 40 VAL HB H 12.893 -14.679 -2.405 1.00 . A A . 40 VAL HB 1 1 5 2982 1 1 40 VAL HG11 H 13.973 -12.588 -0.458 1.00 . A A . 40 VAL HG11 1 1 5 2983 1 1 40 VAL HG12 H 12.265 -12.724 -0.844 1.00 . A A . 40 VAL HG12 1 1 5 2984 1 1 40 VAL HG13 H 13.091 -14.050 -0.052 1.00 . A A . 40 VAL HG13 1 1 5 2985 1 1 40 VAL HG21 H 14.169 -12.011 -3.112 1.00 . A A . 40 VAL HG21 1 1 5 2986 1 1 40 VAL HG22 H 13.500 -13.200 -4.224 1.00 . A A . 40 VAL HG22 1 1 5 2987 1 1 40 VAL HG23 H 12.437 -12.299 -3.162 1.00 . A A . 40 VAL HG23 1 1 5 2988 1 1 40 VAL N N 15.329 -14.991 -3.500 1.00 . A A . 40 VAL N 1 1 5 2989 1 1 40 VAL O O 14.400 -16.242 -0.802 1.00 . A A . 40 VAL O 1 1 5 2990 1 1 40 VAL OXT O 16.352 -15.337 -0.470 1.00 . A A . 40 VAL OXT 1 1 6 2991 1 1 1 ASP C C -6.849 -13.761 -0.530 1.00 . A A . 1 ASP C 1 1 6 2992 1 1 1 ASP CA C -6.803 -14.149 0.960 1.00 . A A . 1 ASP CA 1 1 6 2993 1 1 1 ASP CB C -8.159 -13.817 1.638 1.00 . A A . 1 ASP CB 1 1 6 2994 1 1 1 ASP CG C -8.479 -12.319 1.471 1.00 . A A . 1 ASP CG 1 1 6 2995 1 1 1 ASP H1 H -5.226 -12.788 0.973 1.00 . A A . 1 ASP H1 1 1 6 2996 1 1 1 ASP H2 H -6.109 -12.833 2.422 1.00 . A A . 1 ASP H2 1 1 6 2997 1 1 1 ASP H3 H -5.027 -14.089 2.044 1.00 . A A . 1 ASP H3 1 1 6 2998 1 1 1 ASP HA H -6.604 -15.208 1.036 1.00 . A A . 1 ASP HA 1 1 6 2999 1 1 1 ASP HB2 H -8.954 -14.403 1.197 1.00 . A A . 1 ASP HB2 1 1 6 3000 1 1 1 ASP HB3 H -8.111 -14.053 2.692 1.00 . A A . 1 ASP HB3 1 1 6 3001 1 1 1 ASP N N -5.709 -13.409 1.653 1.00 . A A . 1 ASP N 1 1 6 3002 1 1 1 ASP O O -5.980 -13.068 -1.022 1.00 . A A . 1 ASP O 1 1 6 3003 1 1 1 ASP OD1 O -7.970 -11.563 2.282 1.00 . A A . 1 ASP OD1 1 1 6 3004 1 1 1 ASP OD2 O -9.210 -12.017 0.540 1.00 . A A . 1 ASP OD2 1 1 6 3005 1 1 2 ALA C C -6.892 -14.264 -3.545 1.00 . A A . 2 ALA C 1 1 6 3006 1 1 2 ALA CA C -8.106 -13.969 -2.648 1.00 . A A . 2 ALA CA 1 1 6 3007 1 1 2 ALA CB C -8.539 -12.493 -2.804 1.00 . A A . 2 ALA CB 1 1 6 3008 1 1 2 ALA H H -8.526 -14.786 -0.708 1.00 . A A . 2 ALA H 1 1 6 3009 1 1 2 ALA HA H -8.906 -14.615 -2.966 1.00 . A A . 2 ALA HA 1 1 6 3010 1 1 2 ALA HB1 H -9.401 -12.296 -2.185 1.00 . A A . 2 ALA HB1 1 1 6 3011 1 1 2 ALA HB2 H -7.737 -11.832 -2.510 1.00 . A A . 2 ALA HB2 1 1 6 3012 1 1 2 ALA HB3 H -8.801 -12.289 -3.832 1.00 . A A . 2 ALA HB3 1 1 6 3013 1 1 2 ALA N N -7.878 -14.234 -1.190 1.00 . A A . 2 ALA N 1 1 6 3014 1 1 2 ALA O O -6.739 -13.691 -4.607 1.00 . A A . 2 ALA O 1 1 6 3015 1 1 3 GLU C C -5.114 -16.931 -4.490 1.00 . A A . 3 GLU C 1 1 6 3016 1 1 3 GLU CA C -4.837 -15.571 -3.829 1.00 . A A . 3 GLU CA 1 1 6 3017 1 1 3 GLU CB C -3.654 -15.650 -2.825 1.00 . A A . 3 GLU CB 1 1 6 3018 1 1 3 GLU CD C -3.389 -16.082 -0.354 1.00 . A A . 3 GLU CD 1 1 6 3019 1 1 3 GLU CG C -3.951 -16.644 -1.671 1.00 . A A . 3 GLU CG 1 1 6 3020 1 1 3 GLU H H -6.276 -15.576 -2.213 1.00 . A A . 3 GLU H 1 1 6 3021 1 1 3 GLU HA H -4.619 -14.847 -4.600 1.00 . A A . 3 GLU HA 1 1 6 3022 1 1 3 GLU HB2 H -2.760 -15.963 -3.345 1.00 . A A . 3 GLU HB2 1 1 6 3023 1 1 3 GLU HB3 H -3.482 -14.658 -2.430 1.00 . A A . 3 GLU HB3 1 1 6 3024 1 1 3 GLU HG2 H -5.012 -16.807 -1.552 1.00 . A A . 3 GLU HG2 1 1 6 3025 1 1 3 GLU HG3 H -3.485 -17.595 -1.880 1.00 . A A . 3 GLU HG3 1 1 6 3026 1 1 3 GLU N N -6.069 -15.164 -3.078 1.00 . A A . 3 GLU N 1 1 6 3027 1 1 3 GLU O O -4.338 -17.864 -4.413 1.00 . A A . 3 GLU O 1 1 6 3028 1 1 3 GLU OE1 O -4.034 -15.190 0.170 1.00 . A A . 3 GLU OE1 1 1 6 3029 1 1 3 GLU OE2 O -2.349 -16.574 0.053 1.00 . A A . 3 GLU OE2 1 1 6 3030 1 1 4 PHE C C -6.985 -17.795 -7.311 1.00 . A A . 4 PHE C 1 1 6 3031 1 1 4 PHE CA C -6.740 -18.184 -5.845 1.00 . A A . 4 PHE CA 1 1 6 3032 1 1 4 PHE CB C -8.052 -18.680 -5.147 1.00 . A A . 4 PHE CB 1 1 6 3033 1 1 4 PHE CD1 C -7.085 -18.903 -2.806 1.00 . A A . 4 PHE CD1 1 1 6 3034 1 1 4 PHE CD2 C -8.944 -17.442 -3.111 1.00 . A A . 4 PHE CD2 1 1 6 3035 1 1 4 PHE CE1 C -7.056 -18.588 -1.464 1.00 . A A . 4 PHE CE1 1 1 6 3036 1 1 4 PHE CE2 C -8.915 -17.127 -1.768 1.00 . A A . 4 PHE CE2 1 1 6 3037 1 1 4 PHE CG C -8.028 -18.333 -3.643 1.00 . A A . 4 PHE CG 1 1 6 3038 1 1 4 PHE CZ C -7.972 -17.700 -0.943 1.00 . A A . 4 PHE CZ 1 1 6 3039 1 1 4 PHE H H -6.806 -16.160 -5.136 1.00 . A A . 4 PHE H 1 1 6 3040 1 1 4 PHE HA H -5.987 -18.958 -5.809 1.00 . A A . 4 PHE HA 1 1 6 3041 1 1 4 PHE HB2 H -8.929 -18.231 -5.592 1.00 . A A . 4 PHE HB2 1 1 6 3042 1 1 4 PHE HB3 H -8.131 -19.753 -5.249 1.00 . A A . 4 PHE HB3 1 1 6 3043 1 1 4 PHE HD1 H -6.363 -19.603 -3.205 1.00 . A A . 4 PHE HD1 1 1 6 3044 1 1 4 PHE HD2 H -9.688 -16.988 -3.746 1.00 . A A . 4 PHE HD2 1 1 6 3045 1 1 4 PHE HE1 H -6.316 -19.039 -0.820 1.00 . A A . 4 PHE HE1 1 1 6 3046 1 1 4 PHE HE2 H -9.634 -16.430 -1.362 1.00 . A A . 4 PHE HE2 1 1 6 3047 1 1 4 PHE HZ H -7.949 -17.452 0.108 1.00 . A A . 4 PHE HZ 1 1 6 3048 1 1 4 PHE N N -6.255 -16.966 -5.128 1.00 . A A . 4 PHE N 1 1 6 3049 1 1 4 PHE O O -8.105 -17.627 -7.755 1.00 . A A . 4 PHE O 1 1 6 3050 1 1 5 ARG C C -6.709 -16.009 -9.719 1.00 . A A . 5 ARG C 1 1 6 3051 1 1 5 ARG CA C -5.894 -17.287 -9.463 1.00 . A A . 5 ARG CA 1 1 6 3052 1 1 5 ARG CB C -6.476 -18.479 -10.292 1.00 . A A . 5 ARG CB 1 1 6 3053 1 1 5 ARG CD C -4.126 -19.226 -11.031 1.00 . A A . 5 ARG CD 1 1 6 3054 1 1 5 ARG CG C -5.459 -19.651 -10.364 1.00 . A A . 5 ARG CG 1 1 6 3055 1 1 5 ARG CZ C -3.537 -17.526 -12.707 1.00 . A A . 5 ARG CZ 1 1 6 3056 1 1 5 ARG H H -5.028 -17.814 -7.567 1.00 . A A . 5 ARG H 1 1 6 3057 1 1 5 ARG HA H -4.876 -17.087 -9.762 1.00 . A A . 5 ARG HA 1 1 6 3058 1 1 5 ARG HB2 H -7.385 -18.836 -9.833 1.00 . A A . 5 ARG HB2 1 1 6 3059 1 1 5 ARG HB3 H -6.717 -18.149 -11.291 1.00 . A A . 5 ARG HB3 1 1 6 3060 1 1 5 ARG HD2 H -3.521 -18.676 -10.324 1.00 . A A . 5 ARG HD2 1 1 6 3061 1 1 5 ARG HD3 H -3.580 -20.098 -11.357 1.00 . A A . 5 ARG HD3 1 1 6 3062 1 1 5 ARG HE H -5.295 -18.437 -12.659 1.00 . A A . 5 ARG HE 1 1 6 3063 1 1 5 ARG HG2 H -5.260 -20.013 -9.367 1.00 . A A . 5 ARG HG2 1 1 6 3064 1 1 5 ARG HG3 H -5.896 -20.459 -10.934 1.00 . A A . 5 ARG HG3 1 1 6 3065 1 1 5 ARG HH11 H -2.111 -17.955 -11.361 1.00 . A A . 5 ARG HH11 1 1 6 3066 1 1 5 ARG HH12 H -1.696 -16.757 -12.538 1.00 . A A . 5 ARG HH12 1 1 6 3067 1 1 5 ARG HH21 H -4.782 -16.926 -14.154 1.00 . A A . 5 ARG HH21 1 1 6 3068 1 1 5 ARG HH22 H -3.227 -16.165 -14.141 1.00 . A A . 5 ARG HH22 1 1 6 3069 1 1 5 ARG N N -5.887 -17.662 -8.013 1.00 . A A . 5 ARG N 1 1 6 3070 1 1 5 ARG NE N -4.420 -18.368 -12.225 1.00 . A A . 5 ARG NE 1 1 6 3071 1 1 5 ARG NH1 N -2.357 -17.405 -12.159 1.00 . A A . 5 ARG NH1 1 1 6 3072 1 1 5 ARG NH2 N -3.875 -16.818 -13.748 1.00 . A A . 5 ARG NH2 1 1 6 3073 1 1 5 ARG O O -7.798 -16.046 -10.262 1.00 . A A . 5 ARG O 1 1 6 3074 1 1 6 HIS C C -8.249 -13.471 -9.311 1.00 . A A . 6 HIS C 1 1 6 3075 1 1 6 HIS CA C -6.710 -13.540 -9.437 1.00 . A A . 6 HIS CA 1 1 6 3076 1 1 6 HIS CB C -6.243 -12.966 -10.811 1.00 . A A . 6 HIS CB 1 1 6 3077 1 1 6 HIS CD2 C -7.877 -13.698 -12.770 1.00 . A A . 6 HIS CD2 1 1 6 3078 1 1 6 HIS CE1 C -6.867 -15.402 -13.386 1.00 . A A . 6 HIS CE1 1 1 6 3079 1 1 6 HIS CG C -6.755 -13.835 -11.969 1.00 . A A . 6 HIS CG 1 1 6 3080 1 1 6 HIS H H -5.241 -15.000 -8.873 1.00 . A A . 6 HIS H 1 1 6 3081 1 1 6 HIS HA H -6.293 -12.927 -8.651 1.00 . A A . 6 HIS HA 1 1 6 3082 1 1 6 HIS HB2 H -6.611 -11.959 -10.942 1.00 . A A . 6 HIS HB2 1 1 6 3083 1 1 6 HIS HB3 H -5.163 -12.945 -10.850 1.00 . A A . 6 HIS HB3 1 1 6 3084 1 1 6 HIS HD1 H -5.350 -15.288 -12.051 1.00 . A A . 6 HIS HD1 1 1 6 3085 1 1 6 HIS HD2 H -8.603 -12.902 -12.688 1.00 . A A . 6 HIS HD2 1 1 6 3086 1 1 6 HIS HE1 H -6.600 -16.298 -13.925 1.00 . A A . 6 HIS HE1 1 1 6 3087 1 1 6 HIS N N -6.119 -14.914 -9.300 1.00 . A A . 6 HIS N 1 1 6 3088 1 1 6 HIS ND1 N -6.180 -14.907 -12.407 1.00 . A A . 6 HIS ND1 1 1 6 3089 1 1 6 HIS NE2 N -7.931 -14.681 -13.645 1.00 . A A . 6 HIS NE2 1 1 6 3090 1 1 6 HIS O O -8.908 -12.733 -10.021 1.00 . A A . 6 HIS O 1 1 6 3091 1 1 7 ASP C C -10.770 -12.930 -7.664 1.00 . A A . 7 ASP C 1 1 6 3092 1 1 7 ASP CA C -10.249 -14.284 -8.165 1.00 . A A . 7 ASP CA 1 1 6 3093 1 1 7 ASP CB C -10.542 -15.377 -7.134 1.00 . A A . 7 ASP CB 1 1 6 3094 1 1 7 ASP CG C -9.806 -15.056 -5.822 1.00 . A A . 7 ASP CG 1 1 6 3095 1 1 7 ASP H H -8.208 -14.824 -7.849 1.00 . A A . 7 ASP H 1 1 6 3096 1 1 7 ASP HA H -10.737 -14.524 -9.099 1.00 . A A . 7 ASP HA 1 1 6 3097 1 1 7 ASP HB2 H -11.600 -15.424 -6.944 1.00 . A A . 7 ASP HB2 1 1 6 3098 1 1 7 ASP HB3 H -10.218 -16.338 -7.505 1.00 . A A . 7 ASP HB3 1 1 6 3099 1 1 7 ASP N N -8.776 -14.248 -8.399 1.00 . A A . 7 ASP N 1 1 6 3100 1 1 7 ASP O O -9.996 -12.098 -7.232 1.00 . A A . 7 ASP O 1 1 6 3101 1 1 7 ASP OD1 O -10.402 -14.370 -5.009 1.00 . A A . 7 ASP OD1 1 1 6 3102 1 1 7 ASP OD2 O -8.683 -15.516 -5.714 1.00 . A A . 7 ASP OD2 1 1 6 3103 1 1 8 SER C C -12.111 -10.231 -7.830 1.00 . A A . 8 SER C 1 1 6 3104 1 1 8 SER CA C -12.773 -11.523 -7.302 1.00 . A A . 8 SER CA 1 1 6 3105 1 1 8 SER CB C -12.829 -11.543 -5.738 1.00 . A A . 8 SER CB 1 1 6 3106 1 1 8 SER H H -12.605 -13.510 -8.107 1.00 . A A . 8 SER H 1 1 6 3107 1 1 8 SER HA H -13.783 -11.557 -7.685 1.00 . A A . 8 SER HA 1 1 6 3108 1 1 8 SER HB2 H -13.509 -10.795 -5.361 1.00 . A A . 8 SER HB2 1 1 6 3109 1 1 8 SER HB3 H -13.122 -12.516 -5.373 1.00 . A A . 8 SER HB3 1 1 6 3110 1 1 8 SER HG H -11.174 -12.033 -4.839 1.00 . A A . 8 SER HG 1 1 6 3111 1 1 8 SER N N -12.071 -12.774 -7.742 1.00 . A A . 8 SER N 1 1 6 3112 1 1 8 SER O O -11.371 -10.265 -8.795 1.00 . A A . 8 SER O 1 1 6 3113 1 1 8 SER OG O -11.515 -11.251 -5.281 1.00 . A A . 8 SER OG 1 1 6 3114 1 1 9 GLY C C -12.386 -6.687 -6.749 1.00 . A A . 9 GLY C 1 1 6 3115 1 1 9 GLY CA C -11.818 -7.820 -7.605 1.00 . A A . 9 GLY CA 1 1 6 3116 1 1 9 GLY H H -13.009 -9.164 -6.415 1.00 . A A . 9 GLY H 1 1 6 3117 1 1 9 GLY HA2 H -10.744 -7.855 -7.489 1.00 . A A . 9 GLY HA2 1 1 6 3118 1 1 9 GLY HA3 H -12.064 -7.639 -8.643 1.00 . A A . 9 GLY HA3 1 1 6 3119 1 1 9 GLY N N -12.402 -9.129 -7.183 1.00 . A A . 9 GLY N 1 1 6 3120 1 1 9 GLY O O -11.661 -6.056 -6.005 1.00 . A A . 9 GLY O 1 1 6 3121 1 1 10 TYR C C -13.955 -3.991 -6.476 1.00 . A A . 10 TYR C 1 1 6 3122 1 1 10 TYR CA C -14.439 -5.421 -6.158 1.00 . A A . 10 TYR CA 1 1 6 3123 1 1 10 TYR CB C -14.329 -5.689 -4.622 1.00 . A A . 10 TYR CB 1 1 6 3124 1 1 10 TYR CD1 C -16.291 -4.215 -3.949 1.00 . A A . 10 TYR CD1 1 1 6 3125 1 1 10 TYR CD2 C -14.162 -3.756 -2.988 1.00 . A A . 10 TYR CD2 1 1 6 3126 1 1 10 TYR CE1 C -16.836 -3.165 -3.241 1.00 . A A . 10 TYR CE1 1 1 6 3127 1 1 10 TYR CE2 C -14.707 -2.706 -2.281 1.00 . A A . 10 TYR CE2 1 1 6 3128 1 1 10 TYR CG C -14.947 -4.520 -3.829 1.00 . A A . 10 TYR CG 1 1 6 3129 1 1 10 TYR CZ C -16.047 -2.403 -2.403 1.00 . A A . 10 TYR CZ 1 1 6 3130 1 1 10 TYR H H -14.163 -7.052 -7.525 1.00 . A A . 10 TYR H 1 1 6 3131 1 1 10 TYR HA H -15.474 -5.503 -6.454 1.00 . A A . 10 TYR HA 1 1 6 3132 1 1 10 TYR HB2 H -14.867 -6.593 -4.373 1.00 . A A . 10 TYR HB2 1 1 6 3133 1 1 10 TYR HB3 H -13.300 -5.808 -4.317 1.00 . A A . 10 TYR HB3 1 1 6 3134 1 1 10 TYR HD1 H -16.921 -4.802 -4.601 1.00 . A A . 10 TYR HD1 1 1 6 3135 1 1 10 TYR HD2 H -13.112 -3.981 -2.882 1.00 . A A . 10 TYR HD2 1 1 6 3136 1 1 10 TYR HE1 H -17.886 -2.938 -3.346 1.00 . A A . 10 TYR HE1 1 1 6 3137 1 1 10 TYR HE2 H -14.079 -2.118 -1.628 1.00 . A A . 10 TYR HE2 1 1 6 3138 1 1 10 TYR HH H -16.289 -1.417 -0.788 1.00 . A A . 10 TYR HH 1 1 6 3139 1 1 10 TYR N N -13.674 -6.481 -6.898 1.00 . A A . 10 TYR N 1 1 6 3140 1 1 10 TYR O O -12.775 -3.728 -6.603 1.00 . A A . 10 TYR O 1 1 6 3141 1 1 10 TYR OH O -16.593 -1.352 -1.696 1.00 . A A . 10 TYR OH 1 1 6 3142 1 1 11 GLU C C -14.116 -0.970 -5.629 1.00 . A A . 11 GLU C 1 1 6 3143 1 1 11 GLU CA C -14.611 -1.675 -6.898 1.00 . A A . 11 GLU CA 1 1 6 3144 1 1 11 GLU CB C -15.890 -0.996 -7.418 1.00 . A A . 11 GLU CB 1 1 6 3145 1 1 11 GLU CD C -17.539 -0.903 -9.303 1.00 . A A . 11 GLU CD 1 1 6 3146 1 1 11 GLU CG C -16.298 -1.632 -8.761 1.00 . A A . 11 GLU CG 1 1 6 3147 1 1 11 GLU H H -15.844 -3.386 -6.475 1.00 . A A . 11 GLU H 1 1 6 3148 1 1 11 GLU HA H -13.837 -1.630 -7.653 1.00 . A A . 11 GLU HA 1 1 6 3149 1 1 11 GLU HB2 H -16.688 -1.117 -6.700 1.00 . A A . 11 GLU HB2 1 1 6 3150 1 1 11 GLU HB3 H -15.710 0.060 -7.557 1.00 . A A . 11 GLU HB3 1 1 6 3151 1 1 11 GLU HG2 H -15.493 -1.547 -9.478 1.00 . A A . 11 GLU HG2 1 1 6 3152 1 1 11 GLU HG3 H -16.532 -2.678 -8.626 1.00 . A A . 11 GLU HG3 1 1 6 3153 1 1 11 GLU N N -14.913 -3.106 -6.592 1.00 . A A . 11 GLU N 1 1 6 3154 1 1 11 GLU O O -14.862 -0.805 -4.682 1.00 . A A . 11 GLU O 1 1 6 3155 1 1 11 GLU OE1 O -18.623 -1.320 -8.926 1.00 . A A . 11 GLU OE1 1 1 6 3156 1 1 11 GLU OE2 O -17.335 0.029 -10.064 1.00 . A A . 11 GLU OE2 1 1 6 3157 1 1 12 VAL C C -11.968 1.580 -4.888 1.00 . A A . 12 VAL C 1 1 6 3158 1 1 12 VAL CA C -12.233 0.122 -4.506 1.00 . A A . 12 VAL CA 1 1 6 3159 1 1 12 VAL CB C -10.894 -0.583 -4.143 1.00 . A A . 12 VAL CB 1 1 6 3160 1 1 12 VAL CG1 C -11.186 -1.984 -3.577 1.00 . A A . 12 VAL CG1 1 1 6 3161 1 1 12 VAL CG2 C -9.968 -0.711 -5.379 1.00 . A A . 12 VAL CG2 1 1 6 3162 1 1 12 VAL H H -12.320 -0.740 -6.451 1.00 . A A . 12 VAL H 1 1 6 3163 1 1 12 VAL HA H -12.899 0.107 -3.655 1.00 . A A . 12 VAL HA 1 1 6 3164 1 1 12 VAL HB H -10.385 -0.006 -3.388 1.00 . A A . 12 VAL HB 1 1 6 3165 1 1 12 VAL HG11 H -11.807 -1.901 -2.697 1.00 . A A . 12 VAL HG11 1 1 6 3166 1 1 12 VAL HG12 H -11.697 -2.589 -4.312 1.00 . A A . 12 VAL HG12 1 1 6 3167 1 1 12 VAL HG13 H -10.263 -2.472 -3.304 1.00 . A A . 12 VAL HG13 1 1 6 3168 1 1 12 VAL HG21 H -9.769 0.262 -5.803 1.00 . A A . 12 VAL HG21 1 1 6 3169 1 1 12 VAL HG22 H -9.027 -1.156 -5.088 1.00 . A A . 12 VAL HG22 1 1 6 3170 1 1 12 VAL HG23 H -10.423 -1.336 -6.134 1.00 . A A . 12 VAL HG23 1 1 6 3171 1 1 12 VAL N N -12.867 -0.579 -5.659 1.00 . A A . 12 VAL N 1 1 6 3172 1 1 12 VAL O O -12.170 1.988 -6.016 1.00 . A A . 12 VAL O 1 1 6 3173 1 1 13 HIS C C -9.886 3.834 -4.885 1.00 . A A . 13 HIS C 1 1 6 3174 1 1 13 HIS CA C -11.203 3.759 -4.107 1.00 . A A . 13 HIS CA 1 1 6 3175 1 1 13 HIS CB C -11.082 4.436 -2.713 1.00 . A A . 13 HIS CB 1 1 6 3176 1 1 13 HIS CD2 C -13.547 5.278 -2.232 1.00 . A A . 13 HIS CD2 1 1 6 3177 1 1 13 HIS CE1 C -13.228 7.311 -2.492 1.00 . A A . 13 HIS CE1 1 1 6 3178 1 1 13 HIS CG C -12.211 5.457 -2.551 1.00 . A A . 13 HIS CG 1 1 6 3179 1 1 13 HIS H H -11.389 1.886 -3.039 1.00 . A A . 13 HIS H 1 1 6 3180 1 1 13 HIS HA H -11.980 4.215 -4.699 1.00 . A A . 13 HIS HA 1 1 6 3181 1 1 13 HIS HB2 H -11.170 3.703 -1.924 1.00 . A A . 13 HIS HB2 1 1 6 3182 1 1 13 HIS HB3 H -10.139 4.948 -2.601 1.00 . A A . 13 HIS HB3 1 1 6 3183 1 1 13 HIS HD1 H -11.256 7.200 -2.926 1.00 . A A . 13 HIS HD1 1 1 6 3184 1 1 13 HIS HD2 H -14.013 4.323 -2.039 1.00 . A A . 13 HIS HD2 1 1 6 3185 1 1 13 HIS HE1 H -13.389 8.377 -2.554 1.00 . A A . 13 HIS HE1 1 1 6 3186 1 1 13 HIS N N -11.517 2.314 -3.908 1.00 . A A . 13 HIS N 1 1 6 3187 1 1 13 HIS ND1 N -12.088 6.736 -2.696 1.00 . A A . 13 HIS ND1 1 1 6 3188 1 1 13 HIS NE2 N -14.165 6.442 -2.200 1.00 . A A . 13 HIS NE2 1 1 6 3189 1 1 13 HIS O O -9.874 4.150 -6.059 1.00 . A A . 13 HIS O 1 1 6 3190 1 1 14 HIS C C -6.580 2.493 -4.125 1.00 . A A . 14 HIS C 1 1 6 3191 1 1 14 HIS CA C -7.452 3.554 -4.805 1.00 . A A . 14 HIS CA 1 1 6 3192 1 1 14 HIS CB C -6.791 4.960 -4.625 1.00 . A A . 14 HIS CB 1 1 6 3193 1 1 14 HIS CD2 C -8.729 6.771 -4.663 1.00 . A A . 14 HIS CD2 1 1 6 3194 1 1 14 HIS CE1 C -8.751 7.233 -2.643 1.00 . A A . 14 HIS CE1 1 1 6 3195 1 1 14 HIS CG C -7.762 5.998 -4.047 1.00 . A A . 14 HIS CG 1 1 6 3196 1 1 14 HIS H H -8.923 3.296 -3.252 1.00 . A A . 14 HIS H 1 1 6 3197 1 1 14 HIS HA H -7.538 3.278 -5.842 1.00 . A A . 14 HIS HA 1 1 6 3198 1 1 14 HIS HB2 H -5.938 4.897 -3.966 1.00 . A A . 14 HIS HB2 1 1 6 3199 1 1 14 HIS HB3 H -6.454 5.320 -5.586 1.00 . A A . 14 HIS HB3 1 1 6 3200 1 1 14 HIS HD1 H -7.272 5.967 -2.086 1.00 . A A . 14 HIS HD1 1 1 6 3201 1 1 14 HIS HD2 H -8.954 6.748 -5.719 1.00 . A A . 14 HIS HD2 1 1 6 3202 1 1 14 HIS HE1 H -9.004 7.679 -1.693 1.00 . A A . 14 HIS HE1 1 1 6 3203 1 1 14 HIS N N -8.819 3.535 -4.194 1.00 . A A . 14 HIS N 1 1 6 3204 1 1 14 HIS ND1 N -7.831 6.335 -2.801 1.00 . A A . 14 HIS ND1 1 1 6 3205 1 1 14 HIS NE2 N -9.335 7.534 -3.777 1.00 . A A . 14 HIS NE2 1 1 6 3206 1 1 14 HIS O O -5.375 2.477 -4.259 1.00 . A A . 14 HIS O 1 1 6 3207 1 1 15 GLN C C -5.602 -0.246 -3.641 1.00 . A A . 15 GLN C 1 1 6 3208 1 1 15 GLN CA C -6.519 0.520 -2.681 1.00 . A A . 15 GLN CA 1 1 6 3209 1 1 15 GLN CB C -7.580 -0.415 -2.069 1.00 . A A . 15 GLN CB 1 1 6 3210 1 1 15 GLN CD C -9.071 1.411 -1.122 1.00 . A A . 15 GLN CD 1 1 6 3211 1 1 15 GLN CG C -8.168 0.213 -0.781 1.00 . A A . 15 GLN CG 1 1 6 3212 1 1 15 GLN H H -8.206 1.691 -3.367 1.00 . A A . 15 GLN H 1 1 6 3213 1 1 15 GLN HA H -5.905 0.964 -1.912 1.00 . A A . 15 GLN HA 1 1 6 3214 1 1 15 GLN HB2 H -8.365 -0.595 -2.787 1.00 . A A . 15 GLN HB2 1 1 6 3215 1 1 15 GLN HB3 H -7.132 -1.364 -1.823 1.00 . A A . 15 GLN HB3 1 1 6 3216 1 1 15 GLN HE21 H -7.585 2.727 -1.036 1.00 . A A . 15 GLN HE21 1 1 6 3217 1 1 15 GLN HE22 H -9.109 3.374 -1.412 1.00 . A A . 15 GLN HE22 1 1 6 3218 1 1 15 GLN HG2 H -8.759 -0.524 -0.257 1.00 . A A . 15 GLN HG2 1 1 6 3219 1 1 15 GLN HG3 H -7.376 0.545 -0.125 1.00 . A A . 15 GLN HG3 1 1 6 3220 1 1 15 GLN N N -7.231 1.617 -3.411 1.00 . A A . 15 GLN N 1 1 6 3221 1 1 15 GLN NE2 N -8.545 2.604 -1.196 1.00 . A A . 15 GLN NE2 1 1 6 3222 1 1 15 GLN O O -4.465 -0.542 -3.331 1.00 . A A . 15 GLN O 1 1 6 3223 1 1 15 GLN OE1 O -10.261 1.275 -1.323 1.00 . A A . 15 GLN OE1 1 1 6 3224 1 1 16 LYS C C -4.025 -0.593 -6.131 1.00 . A A . 16 LYS C 1 1 6 3225 1 1 16 LYS CA C -5.368 -1.271 -5.835 1.00 . A A . 16 LYS CA 1 1 6 3226 1 1 16 LYS CB C -6.230 -1.346 -7.127 1.00 . A A . 16 LYS CB 1 1 6 3227 1 1 16 LYS CD C -5.501 -3.726 -7.529 1.00 . A A . 16 LYS CD 1 1 6 3228 1 1 16 LYS CE C -5.879 -4.943 -8.393 1.00 . A A . 16 LYS CE 1 1 6 3229 1 1 16 LYS CG C -6.721 -2.789 -7.364 1.00 . A A . 16 LYS CG 1 1 6 3230 1 1 16 LYS H H -7.055 -0.262 -4.987 1.00 . A A . 16 LYS H 1 1 6 3231 1 1 16 LYS HA H -5.161 -2.250 -5.444 1.00 . A A . 16 LYS HA 1 1 6 3232 1 1 16 LYS HB2 H -7.090 -0.696 -7.035 1.00 . A A . 16 LYS HB2 1 1 6 3233 1 1 16 LYS HB3 H -5.660 -1.020 -7.986 1.00 . A A . 16 LYS HB3 1 1 6 3234 1 1 16 LYS HD2 H -4.683 -3.185 -7.984 1.00 . A A . 16 LYS HD2 1 1 6 3235 1 1 16 LYS HD3 H -5.185 -4.062 -6.551 1.00 . A A . 16 LYS HD3 1 1 6 3236 1 1 16 LYS HE2 H -5.104 -5.694 -8.331 1.00 . A A . 16 LYS HE2 1 1 6 3237 1 1 16 LYS HE3 H -6.809 -5.375 -8.054 1.00 . A A . 16 LYS HE3 1 1 6 3238 1 1 16 LYS HG2 H -7.319 -3.115 -6.525 1.00 . A A . 16 LYS HG2 1 1 6 3239 1 1 16 LYS HG3 H -7.336 -2.812 -8.252 1.00 . A A . 16 LYS HG3 1 1 6 3240 1 1 16 LYS HZ1 H -7.000 -4.742 -10.135 1.00 . A A . 16 LYS HZ1 1 1 6 3241 1 1 16 LYS HZ2 H -5.847 -3.516 -9.911 1.00 . A A . 16 LYS HZ2 1 1 6 3242 1 1 16 LYS HZ3 H -5.354 -5.064 -10.405 1.00 . A A . 16 LYS HZ3 1 1 6 3243 1 1 16 LYS N N -6.137 -0.533 -4.798 1.00 . A A . 16 LYS N 1 1 6 3244 1 1 16 LYS NZ N -6.031 -4.535 -9.818 1.00 . A A . 16 LYS NZ 1 1 6 3245 1 1 16 LYS O O -2.981 -1.207 -6.017 1.00 . A A . 16 LYS O 1 1 6 3246 1 1 17 LEU C C -1.953 1.500 -5.540 1.00 . A A . 17 LEU C 1 1 6 3247 1 1 17 LEU CA C -2.823 1.392 -6.801 1.00 . A A . 17 LEU CA 1 1 6 3248 1 1 17 LEU CB C -3.212 2.792 -7.395 1.00 . A A . 17 LEU CB 1 1 6 3249 1 1 17 LEU CD1 C -1.777 4.415 -6.036 1.00 . A A . 17 LEU CD1 1 1 6 3250 1 1 17 LEU CD2 C -4.015 5.124 -6.972 1.00 . A A . 17 LEU CD2 1 1 6 3251 1 1 17 LEU CG C -3.230 3.944 -6.363 1.00 . A A . 17 LEU CG 1 1 6 3252 1 1 17 LEU H H -4.949 1.121 -6.547 1.00 . A A . 17 LEU H 1 1 6 3253 1 1 17 LEU HA H -2.285 0.834 -7.552 1.00 . A A . 17 LEU HA 1 1 6 3254 1 1 17 LEU HB2 H -2.517 3.035 -8.186 1.00 . A A . 17 LEU HB2 1 1 6 3255 1 1 17 LEU HB3 H -4.192 2.709 -7.842 1.00 . A A . 17 LEU HB3 1 1 6 3256 1 1 17 LEU HD11 H -1.058 3.931 -6.680 1.00 . A A . 17 LEU HD11 1 1 6 3257 1 1 17 LEU HD12 H -1.676 5.484 -6.159 1.00 . A A . 17 LEU HD12 1 1 6 3258 1 1 17 LEU HD13 H -1.536 4.169 -5.012 1.00 . A A . 17 LEU HD13 1 1 6 3259 1 1 17 LEU HD21 H -5.001 4.798 -7.271 1.00 . A A . 17 LEU HD21 1 1 6 3260 1 1 17 LEU HD22 H -4.115 5.915 -6.245 1.00 . A A . 17 LEU HD22 1 1 6 3261 1 1 17 LEU HD23 H -3.498 5.507 -7.839 1.00 . A A . 17 LEU HD23 1 1 6 3262 1 1 17 LEU HG H -3.737 3.603 -5.476 1.00 . A A . 17 LEU HG 1 1 6 3263 1 1 17 LEU N N -4.085 0.664 -6.490 1.00 . A A . 17 LEU N 1 1 6 3264 1 1 17 LEU O O -0.754 1.387 -5.635 1.00 . A A . 17 LEU O 1 1 6 3265 1 1 18 VAL C C -0.844 0.587 -2.988 1.00 . A A . 18 VAL C 1 1 6 3266 1 1 18 VAL CA C -1.767 1.821 -3.125 1.00 . A A . 18 VAL CA 1 1 6 3267 1 1 18 VAL CB C -2.803 1.927 -1.968 1.00 . A A . 18 VAL CB 1 1 6 3268 1 1 18 VAL CG1 C -2.167 1.603 -0.611 1.00 . A A . 18 VAL CG1 1 1 6 3269 1 1 18 VAL CG2 C -3.387 3.357 -1.928 1.00 . A A . 18 VAL CG2 1 1 6 3270 1 1 18 VAL H H -3.518 1.810 -4.353 1.00 . A A . 18 VAL H 1 1 6 3271 1 1 18 VAL HA H -1.154 2.712 -3.169 1.00 . A A . 18 VAL HA 1 1 6 3272 1 1 18 VAL HB H -3.612 1.235 -2.136 1.00 . A A . 18 VAL HB 1 1 6 3273 1 1 18 VAL HG11 H -1.244 2.149 -0.493 1.00 . A A . 18 VAL HG11 1 1 6 3274 1 1 18 VAL HG12 H -2.847 1.874 0.184 1.00 . A A . 18 VAL HG12 1 1 6 3275 1 1 18 VAL HG13 H -1.968 0.544 -0.549 1.00 . A A . 18 VAL HG13 1 1 6 3276 1 1 18 VAL HG21 H -3.596 3.709 -2.927 1.00 . A A . 18 VAL HG21 1 1 6 3277 1 1 18 VAL HG22 H -4.307 3.361 -1.362 1.00 . A A . 18 VAL HG22 1 1 6 3278 1 1 18 VAL HG23 H -2.689 4.037 -1.462 1.00 . A A . 18 VAL HG23 1 1 6 3279 1 1 18 VAL N N -2.549 1.711 -4.395 1.00 . A A . 18 VAL N 1 1 6 3280 1 1 18 VAL O O 0.351 0.716 -2.798 1.00 . A A . 18 VAL O 1 1 6 3281 1 1 19 PHE C C 0.468 -1.856 -4.038 1.00 . A A . 19 PHE C 1 1 6 3282 1 1 19 PHE CA C -0.646 -1.850 -2.989 1.00 . A A . 19 PHE CA 1 1 6 3283 1 1 19 PHE CB C -1.581 -3.061 -3.221 1.00 . A A . 19 PHE CB 1 1 6 3284 1 1 19 PHE CD1 C -2.833 -2.467 -1.071 1.00 . A A . 19 PHE CD1 1 1 6 3285 1 1 19 PHE CD2 C -4.061 -3.420 -2.878 1.00 . A A . 19 PHE CD2 1 1 6 3286 1 1 19 PHE CE1 C -3.986 -2.403 -0.319 1.00 . A A . 19 PHE CE1 1 1 6 3287 1 1 19 PHE CE2 C -5.216 -3.357 -2.126 1.00 . A A . 19 PHE CE2 1 1 6 3288 1 1 19 PHE CG C -2.857 -2.977 -2.360 1.00 . A A . 19 PHE CG 1 1 6 3289 1 1 19 PHE CZ C -5.178 -2.847 -0.846 1.00 . A A . 19 PHE CZ 1 1 6 3290 1 1 19 PHE H H -2.394 -0.604 -3.259 1.00 . A A . 19 PHE H 1 1 6 3291 1 1 19 PHE HA H -0.196 -1.898 -2.013 1.00 . A A . 19 PHE HA 1 1 6 3292 1 1 19 PHE HB2 H -1.867 -3.109 -4.262 1.00 . A A . 19 PHE HB2 1 1 6 3293 1 1 19 PHE HB3 H -1.059 -3.972 -2.966 1.00 . A A . 19 PHE HB3 1 1 6 3294 1 1 19 PHE HD1 H -1.906 -2.115 -0.642 1.00 . A A . 19 PHE HD1 1 1 6 3295 1 1 19 PHE HD2 H -4.101 -3.821 -3.880 1.00 . A A . 19 PHE HD2 1 1 6 3296 1 1 19 PHE HE1 H -3.956 -2.004 0.683 1.00 . A A . 19 PHE HE1 1 1 6 3297 1 1 19 PHE HE2 H -6.150 -3.706 -2.540 1.00 . A A . 19 PHE HE2 1 1 6 3298 1 1 19 PHE HZ H -6.082 -2.798 -0.256 1.00 . A A . 19 PHE HZ 1 1 6 3299 1 1 19 PHE N N -1.432 -0.577 -3.101 1.00 . A A . 19 PHE N 1 1 6 3300 1 1 19 PHE O O 1.616 -2.127 -3.743 1.00 . A A . 19 PHE O 1 1 6 3301 1 1 20 PHE C C 2.240 -0.607 -5.988 1.00 . A A . 20 PHE C 1 1 6 3302 1 1 20 PHE CA C 1.046 -1.505 -6.379 1.00 . A A . 20 PHE CA 1 1 6 3303 1 1 20 PHE CB C 0.245 -0.982 -7.620 1.00 . A A . 20 PHE CB 1 1 6 3304 1 1 20 PHE CD1 C 2.059 -0.384 -9.268 1.00 . A A . 20 PHE CD1 1 1 6 3305 1 1 20 PHE CD2 C 0.710 1.388 -8.427 1.00 . A A . 20 PHE CD2 1 1 6 3306 1 1 20 PHE CE1 C 2.770 0.517 -10.029 1.00 . A A . 20 PHE CE1 1 1 6 3307 1 1 20 PHE CE2 C 1.419 2.291 -9.186 1.00 . A A . 20 PHE CE2 1 1 6 3308 1 1 20 PHE CG C 1.024 0.041 -8.461 1.00 . A A . 20 PHE CG 1 1 6 3309 1 1 20 PHE CZ C 2.452 1.857 -9.989 1.00 . A A . 20 PHE CZ 1 1 6 3310 1 1 20 PHE H H -0.864 -1.341 -5.412 1.00 . A A . 20 PHE H 1 1 6 3311 1 1 20 PHE HA H 1.405 -2.508 -6.565 1.00 . A A . 20 PHE HA 1 1 6 3312 1 1 20 PHE HB2 H -0.002 -1.821 -8.255 1.00 . A A . 20 PHE HB2 1 1 6 3313 1 1 20 PHE HB3 H -0.680 -0.531 -7.300 1.00 . A A . 20 PHE HB3 1 1 6 3314 1 1 20 PHE HD1 H 2.312 -1.432 -9.302 1.00 . A A . 20 PHE HD1 1 1 6 3315 1 1 20 PHE HD2 H -0.098 1.748 -7.808 1.00 . A A . 20 PHE HD2 1 1 6 3316 1 1 20 PHE HE1 H 3.576 0.166 -10.653 1.00 . A A . 20 PHE HE1 1 1 6 3317 1 1 20 PHE HE2 H 1.161 3.338 -9.145 1.00 . A A . 20 PHE HE2 1 1 6 3318 1 1 20 PHE HZ H 3.010 2.564 -10.584 1.00 . A A . 20 PHE HZ 1 1 6 3319 1 1 20 PHE N N 0.078 -1.547 -5.247 1.00 . A A . 20 PHE N 1 1 6 3320 1 1 20 PHE O O 3.372 -1.036 -6.026 1.00 . A A . 20 PHE O 1 1 6 3321 1 1 21 ALA C C 3.926 1.011 -4.135 1.00 . A A . 21 ALA C 1 1 6 3322 1 1 21 ALA CA C 2.997 1.595 -5.201 1.00 . A A . 21 ALA CA 1 1 6 3323 1 1 21 ALA CB C 2.301 2.855 -4.665 1.00 . A A . 21 ALA CB 1 1 6 3324 1 1 21 ALA H H 1.008 0.873 -5.589 1.00 . A A . 21 ALA H 1 1 6 3325 1 1 21 ALA HA H 3.594 1.838 -6.067 1.00 . A A . 21 ALA HA 1 1 6 3326 1 1 21 ALA HB1 H 1.618 3.240 -5.408 1.00 . A A . 21 ALA HB1 1 1 6 3327 1 1 21 ALA HB2 H 1.745 2.627 -3.768 1.00 . A A . 21 ALA HB2 1 1 6 3328 1 1 21 ALA HB3 H 3.034 3.615 -4.439 1.00 . A A . 21 ALA HB3 1 1 6 3329 1 1 21 ALA N N 1.945 0.609 -5.608 1.00 . A A . 21 ALA N 1 1 6 3330 1 1 21 ALA O O 5.128 1.116 -4.243 1.00 . A A . 21 ALA O 1 1 6 3331 1 1 22 GLU C C 5.178 -1.193 -2.670 1.00 . A A . 22 GLU C 1 1 6 3332 1 1 22 GLU CA C 4.181 -0.200 -2.039 1.00 . A A . 22 GLU CA 1 1 6 3333 1 1 22 GLU CB C 3.179 -0.869 -1.051 1.00 . A A . 22 GLU CB 1 1 6 3334 1 1 22 GLU CD C 3.803 -3.354 -1.066 1.00 . A A . 22 GLU CD 1 1 6 3335 1 1 22 GLU CG C 3.803 -2.040 -0.250 1.00 . A A . 22 GLU CG 1 1 6 3336 1 1 22 GLU H H 2.382 0.367 -3.093 1.00 . A A . 22 GLU H 1 1 6 3337 1 1 22 GLU HA H 4.748 0.588 -1.562 1.00 . A A . 22 GLU HA 1 1 6 3338 1 1 22 GLU HB2 H 2.850 -0.119 -0.347 1.00 . A A . 22 GLU HB2 1 1 6 3339 1 1 22 GLU HB3 H 2.307 -1.211 -1.586 1.00 . A A . 22 GLU HB3 1 1 6 3340 1 1 22 GLU HG2 H 4.815 -1.788 0.030 1.00 . A A . 22 GLU HG2 1 1 6 3341 1 1 22 GLU HG3 H 3.227 -2.199 0.649 1.00 . A A . 22 GLU HG3 1 1 6 3342 1 1 22 GLU N N 3.356 0.409 -3.128 1.00 . A A . 22 GLU N 1 1 6 3343 1 1 22 GLU O O 6.364 -1.143 -2.401 1.00 . A A . 22 GLU O 1 1 6 3344 1 1 22 GLU OE1 O 2.754 -3.693 -1.593 1.00 . A A . 22 GLU OE1 1 1 6 3345 1 1 22 GLU OE2 O 4.864 -3.954 -1.117 1.00 . A A . 22 GLU OE2 1 1 6 3346 1 1 23 ASP C C 6.665 -2.382 -4.903 1.00 . A A . 23 ASP C 1 1 6 3347 1 1 23 ASP CA C 5.509 -3.086 -4.186 1.00 . A A . 23 ASP CA 1 1 6 3348 1 1 23 ASP CB C 4.647 -3.837 -5.205 1.00 . A A . 23 ASP CB 1 1 6 3349 1 1 23 ASP CG C 5.300 -5.195 -5.510 1.00 . A A . 23 ASP CG 1 1 6 3350 1 1 23 ASP H H 3.695 -2.052 -3.662 1.00 . A A . 23 ASP H 1 1 6 3351 1 1 23 ASP HA H 5.914 -3.759 -3.449 1.00 . A A . 23 ASP HA 1 1 6 3352 1 1 23 ASP HB2 H 3.649 -3.984 -4.826 1.00 . A A . 23 ASP HB2 1 1 6 3353 1 1 23 ASP HB3 H 4.566 -3.268 -6.118 1.00 . A A . 23 ASP HB3 1 1 6 3354 1 1 23 ASP N N 4.658 -2.065 -3.497 1.00 . A A . 23 ASP N 1 1 6 3355 1 1 23 ASP O O 7.824 -2.702 -4.738 1.00 . A A . 23 ASP O 1 1 6 3356 1 1 23 ASP OD1 O 6.113 -5.211 -6.421 1.00 . A A . 23 ASP OD1 1 1 6 3357 1 1 23 ASP OD2 O 4.950 -6.135 -4.817 1.00 . A A . 23 ASP OD2 1 1 6 3358 1 1 24 VAL C C 8.299 0.009 -5.636 1.00 . A A . 24 VAL C 1 1 6 3359 1 1 24 VAL CA C 7.180 -0.577 -6.496 1.00 . A A . 24 VAL CA 1 1 6 3360 1 1 24 VAL CB C 6.319 0.527 -7.143 1.00 . A A . 24 VAL CB 1 1 6 3361 1 1 24 VAL CG1 C 7.160 1.447 -8.023 1.00 . A A . 24 VAL CG1 1 1 6 3362 1 1 24 VAL CG2 C 5.210 -0.125 -7.990 1.00 . A A . 24 VAL CG2 1 1 6 3363 1 1 24 VAL H H 5.303 -1.242 -5.742 1.00 . A A . 24 VAL H 1 1 6 3364 1 1 24 VAL HA H 7.620 -1.196 -7.261 1.00 . A A . 24 VAL HA 1 1 6 3365 1 1 24 VAL HB H 5.863 1.133 -6.381 1.00 . A A . 24 VAL HB 1 1 6 3366 1 1 24 VAL HG11 H 7.727 0.865 -8.732 1.00 . A A . 24 VAL HG11 1 1 6 3367 1 1 24 VAL HG12 H 6.505 2.122 -8.554 1.00 . A A . 24 VAL HG12 1 1 6 3368 1 1 24 VAL HG13 H 7.829 2.023 -7.403 1.00 . A A . 24 VAL HG13 1 1 6 3369 1 1 24 VAL HG21 H 5.089 -1.169 -7.739 1.00 . A A . 24 VAL HG21 1 1 6 3370 1 1 24 VAL HG22 H 4.282 0.386 -7.788 1.00 . A A . 24 VAL HG22 1 1 6 3371 1 1 24 VAL HG23 H 5.433 -0.056 -9.042 1.00 . A A . 24 VAL HG23 1 1 6 3372 1 1 24 VAL N N 6.261 -1.419 -5.684 1.00 . A A . 24 VAL N 1 1 6 3373 1 1 24 VAL O O 9.452 -0.087 -5.995 1.00 . A A . 24 VAL O 1 1 6 3374 1 1 25 GLY C C 10.107 0.352 -3.336 1.00 . A A . 25 GLY C 1 1 6 3375 1 1 25 GLY CA C 8.861 1.217 -3.564 1.00 . A A . 25 GLY CA 1 1 6 3376 1 1 25 GLY H H 6.944 0.598 -4.355 1.00 . A A . 25 GLY H 1 1 6 3377 1 1 25 GLY HA2 H 9.159 2.181 -3.947 1.00 . A A . 25 GLY HA2 1 1 6 3378 1 1 25 GLY HA3 H 8.355 1.354 -2.620 1.00 . A A . 25 GLY HA3 1 1 6 3379 1 1 25 GLY N N 7.904 0.587 -4.533 1.00 . A A . 25 GLY N 1 1 6 3380 1 1 25 GLY O O 11.221 0.837 -3.341 1.00 . A A . 25 GLY O 1 1 6 3381 1 1 26 SER C C 11.604 -2.364 -4.224 1.00 . A A . 26 SER C 1 1 6 3382 1 1 26 SER CA C 10.961 -1.896 -2.906 1.00 . A A . 26 SER CA 1 1 6 3383 1 1 26 SER CB C 10.381 -3.100 -2.140 1.00 . A A . 26 SER CB 1 1 6 3384 1 1 26 SER H H 8.922 -1.206 -3.149 1.00 . A A . 26 SER H 1 1 6 3385 1 1 26 SER HA H 11.712 -1.417 -2.304 1.00 . A A . 26 SER HA 1 1 6 3386 1 1 26 SER HB2 H 9.870 -2.786 -1.242 1.00 . A A . 26 SER HB2 1 1 6 3387 1 1 26 SER HB3 H 9.711 -3.681 -2.759 1.00 . A A . 26 SER HB3 1 1 6 3388 1 1 26 SER HG H 12.302 -3.482 -2.119 1.00 . A A . 26 SER HG 1 1 6 3389 1 1 26 SER N N 9.856 -0.915 -3.142 1.00 . A A . 26 SER N 1 1 6 3390 1 1 26 SER O O 12.808 -2.340 -4.396 1.00 . A A . 26 SER O 1 1 6 3391 1 1 26 SER OG O 11.505 -3.896 -1.783 1.00 . A A . 26 SER OG 1 1 6 3392 1 1 27 ASN C C 12.107 -2.374 -7.242 1.00 . A A . 27 ASN C 1 1 6 3393 1 1 27 ASN CA C 11.156 -3.280 -6.465 1.00 . A A . 27 ASN CA 1 1 6 3394 1 1 27 ASN CB C 9.876 -3.499 -7.273 1.00 . A A . 27 ASN CB 1 1 6 3395 1 1 27 ASN CG C 9.210 -4.822 -6.876 1.00 . A A . 27 ASN CG 1 1 6 3396 1 1 27 ASN H H 9.798 -2.759 -4.906 1.00 . A A . 27 ASN H 1 1 6 3397 1 1 27 ASN HA H 11.687 -4.209 -6.316 1.00 . A A . 27 ASN HA 1 1 6 3398 1 1 27 ASN HB2 H 9.181 -2.698 -7.074 1.00 . A A . 27 ASN HB2 1 1 6 3399 1 1 27 ASN HB3 H 10.098 -3.495 -8.326 1.00 . A A . 27 ASN HB3 1 1 6 3400 1 1 27 ASN HD21 H 9.025 -5.449 -8.750 1.00 . A A . 27 ASN HD21 1 1 6 3401 1 1 27 ASN HD22 H 8.431 -6.511 -7.566 1.00 . A A . 27 ASN HD22 1 1 6 3402 1 1 27 ASN N N 10.750 -2.778 -5.119 1.00 . A A . 27 ASN N 1 1 6 3403 1 1 27 ASN ND2 N 8.860 -5.664 -7.809 1.00 . A A . 27 ASN ND2 1 1 6 3404 1 1 27 ASN O O 13.110 -2.822 -7.756 1.00 . A A . 27 ASN O 1 1 6 3405 1 1 27 ASN OD1 O 8.999 -5.104 -5.712 1.00 . A A . 27 ASN OD1 1 1 6 3406 1 1 28 LYS C C 14.056 -0.204 -7.607 1.00 . A A . 28 LYS C 1 1 6 3407 1 1 28 LYS CA C 12.586 -0.115 -8.035 1.00 . A A . 28 LYS CA 1 1 6 3408 1 1 28 LYS CB C 11.984 1.273 -7.746 1.00 . A A . 28 LYS CB 1 1 6 3409 1 1 28 LYS CD C 11.182 2.787 -5.871 1.00 . A A . 28 LYS CD 1 1 6 3410 1 1 28 LYS CE C 11.503 4.109 -6.595 1.00 . A A . 28 LYS CE 1 1 6 3411 1 1 28 LYS CG C 12.199 1.694 -6.269 1.00 . A A . 28 LYS CG 1 1 6 3412 1 1 28 LYS H H 10.943 -0.830 -6.861 1.00 . A A . 28 LYS H 1 1 6 3413 1 1 28 LYS HA H 12.521 -0.313 -9.098 1.00 . A A . 28 LYS HA 1 1 6 3414 1 1 28 LYS HB2 H 12.436 1.994 -8.410 1.00 . A A . 28 LYS HB2 1 1 6 3415 1 1 28 LYS HB3 H 10.926 1.226 -7.964 1.00 . A A . 28 LYS HB3 1 1 6 3416 1 1 28 LYS HD2 H 10.178 2.472 -6.117 1.00 . A A . 28 LYS HD2 1 1 6 3417 1 1 28 LYS HD3 H 11.237 2.948 -4.804 1.00 . A A . 28 LYS HD3 1 1 6 3418 1 1 28 LYS HE2 H 12.556 4.340 -6.513 1.00 . A A . 28 LYS HE2 1 1 6 3419 1 1 28 LYS HE3 H 11.237 4.039 -7.639 1.00 . A A . 28 LYS HE3 1 1 6 3420 1 1 28 LYS HG2 H 12.065 0.836 -5.627 1.00 . A A . 28 LYS HG2 1 1 6 3421 1 1 28 LYS HG3 H 13.205 2.064 -6.136 1.00 . A A . 28 LYS HG3 1 1 6 3422 1 1 28 LYS HZ1 H 10.144 4.857 -5.203 1.00 . A A . 28 LYS HZ1 1 1 6 3423 1 1 28 LYS HZ2 H 11.384 5.942 -5.615 1.00 . A A . 28 LYS HZ2 1 1 6 3424 1 1 28 LYS HZ3 H 10.112 5.653 -6.703 1.00 . A A . 28 LYS HZ3 1 1 6 3425 1 1 28 LYS N N 11.760 -1.118 -7.305 1.00 . A A . 28 LYS N 1 1 6 3426 1 1 28 LYS NZ N 10.727 5.224 -5.983 1.00 . A A . 28 LYS NZ 1 1 6 3427 1 1 28 LYS O O 14.932 -0.031 -8.424 1.00 . A A . 28 LYS O 1 1 6 3428 1 1 29 GLY C C 16.442 -1.659 -6.680 1.00 . A A . 29 GLY C 1 1 6 3429 1 1 29 GLY CA C 15.706 -0.588 -5.861 1.00 . A A . 29 GLY CA 1 1 6 3430 1 1 29 GLY H H 13.553 -0.624 -5.730 1.00 . A A . 29 GLY H 1 1 6 3431 1 1 29 GLY HA2 H 16.201 0.365 -5.978 1.00 . A A . 29 GLY HA2 1 1 6 3432 1 1 29 GLY HA3 H 15.701 -0.872 -4.820 1.00 . A A . 29 GLY HA3 1 1 6 3433 1 1 29 GLY N N 14.297 -0.483 -6.349 1.00 . A A . 29 GLY N 1 1 6 3434 1 1 29 GLY O O 17.452 -1.394 -7.307 1.00 . A A . 29 GLY O 1 1 6 3435 1 1 30 ALA C C 16.588 -3.658 -8.919 1.00 . A A . 30 ALA C 1 1 6 3436 1 1 30 ALA CA C 16.529 -3.977 -7.420 1.00 . A A . 30 ALA CA 1 1 6 3437 1 1 30 ALA CB C 15.706 -5.251 -7.188 1.00 . A A . 30 ALA CB 1 1 6 3438 1 1 30 ALA H H 15.067 -2.991 -6.146 1.00 . A A . 30 ALA H 1 1 6 3439 1 1 30 ALA HA H 17.542 -4.102 -7.065 1.00 . A A . 30 ALA HA 1 1 6 3440 1 1 30 ALA HB1 H 14.683 -5.098 -7.501 1.00 . A A . 30 ALA HB1 1 1 6 3441 1 1 30 ALA HB2 H 16.125 -6.072 -7.751 1.00 . A A . 30 ALA HB2 1 1 6 3442 1 1 30 ALA HB3 H 15.714 -5.509 -6.139 1.00 . A A . 30 ALA HB3 1 1 6 3443 1 1 30 ALA N N 15.895 -2.850 -6.659 1.00 . A A . 30 ALA N 1 1 6 3444 1 1 30 ALA O O 17.589 -3.878 -9.569 1.00 . A A . 30 ALA O 1 1 6 3445 1 1 31 ILE C C 16.510 -1.832 -11.266 1.00 . A A . 31 ILE C 1 1 6 3446 1 1 31 ILE CA C 15.369 -2.766 -10.852 1.00 . A A . 31 ILE CA 1 1 6 3447 1 1 31 ILE CB C 13.963 -2.126 -10.983 1.00 . A A . 31 ILE CB 1 1 6 3448 1 1 31 ILE CD1 C 11.478 -2.723 -10.856 1.00 . A A . 31 ILE CD1 1 1 6 3449 1 1 31 ILE CG1 C 12.916 -3.274 -10.922 1.00 . A A . 31 ILE CG1 1 1 6 3450 1 1 31 ILE CG2 C 13.808 -1.300 -12.274 1.00 . A A . 31 ILE CG2 1 1 6 3451 1 1 31 ILE H H 14.729 -2.994 -8.833 1.00 . A A . 31 ILE H 1 1 6 3452 1 1 31 ILE HA H 15.466 -3.668 -11.437 1.00 . A A . 31 ILE HA 1 1 6 3453 1 1 31 ILE HB H 13.815 -1.470 -10.142 1.00 . A A . 31 ILE HB 1 1 6 3454 1 1 31 ILE HD11 H 11.406 -1.932 -10.125 1.00 . A A . 31 ILE HD11 1 1 6 3455 1 1 31 ILE HD12 H 11.176 -2.340 -11.820 1.00 . A A . 31 ILE HD12 1 1 6 3456 1 1 31 ILE HD13 H 10.802 -3.516 -10.575 1.00 . A A . 31 ILE HD13 1 1 6 3457 1 1 31 ILE HG12 H 13.033 -3.909 -11.786 1.00 . A A . 31 ILE HG12 1 1 6 3458 1 1 31 ILE HG13 H 13.092 -3.879 -10.046 1.00 . A A . 31 ILE HG13 1 1 6 3459 1 1 31 ILE HG21 H 13.979 -1.915 -13.143 1.00 . A A . 31 ILE HG21 1 1 6 3460 1 1 31 ILE HG22 H 12.812 -0.885 -12.323 1.00 . A A . 31 ILE HG22 1 1 6 3461 1 1 31 ILE HG23 H 14.510 -0.479 -12.271 1.00 . A A . 31 ILE HG23 1 1 6 3462 1 1 31 ILE N N 15.498 -3.141 -9.416 1.00 . A A . 31 ILE N 1 1 6 3463 1 1 31 ILE O O 17.156 -2.063 -12.265 1.00 . A A . 31 ILE O 1 1 6 3464 1 1 32 ILE C C 19.158 -0.653 -10.901 1.00 . A A . 32 ILE C 1 1 6 3465 1 1 32 ILE CA C 17.849 0.138 -10.857 1.00 . A A . 32 ILE CA 1 1 6 3466 1 1 32 ILE CB C 17.903 1.256 -9.788 1.00 . A A . 32 ILE CB 1 1 6 3467 1 1 32 ILE CD1 C 16.312 2.776 -8.521 1.00 . A A . 32 ILE CD1 1 1 6 3468 1 1 32 ILE CG1 C 16.574 2.053 -9.855 1.00 . A A . 32 ILE CG1 1 1 6 3469 1 1 32 ILE CG2 C 19.090 2.211 -10.081 1.00 . A A . 32 ILE CG2 1 1 6 3470 1 1 32 ILE H H 16.198 -0.627 -9.715 1.00 . A A . 32 ILE H 1 1 6 3471 1 1 32 ILE HA H 17.664 0.526 -11.845 1.00 . A A . 32 ILE HA 1 1 6 3472 1 1 32 ILE HB H 18.027 0.813 -8.809 1.00 . A A . 32 ILE HB 1 1 6 3473 1 1 32 ILE HD11 H 16.427 2.093 -7.692 1.00 . A A . 32 ILE HD11 1 1 6 3474 1 1 32 ILE HD12 H 17.002 3.596 -8.397 1.00 . A A . 32 ILE HD12 1 1 6 3475 1 1 32 ILE HD13 H 15.304 3.166 -8.509 1.00 . A A . 32 ILE HD13 1 1 6 3476 1 1 32 ILE HG12 H 16.618 2.766 -10.660 1.00 . A A . 32 ILE HG12 1 1 6 3477 1 1 32 ILE HG13 H 15.752 1.387 -10.064 1.00 . A A . 32 ILE HG13 1 1 6 3478 1 1 32 ILE HG21 H 19.066 2.536 -11.111 1.00 . A A . 32 ILE HG21 1 1 6 3479 1 1 32 ILE HG22 H 19.038 3.080 -9.442 1.00 . A A . 32 ILE HG22 1 1 6 3480 1 1 32 ILE HG23 H 20.027 1.707 -9.897 1.00 . A A . 32 ILE HG23 1 1 6 3481 1 1 32 ILE N N 16.744 -0.798 -10.505 1.00 . A A . 32 ILE N 1 1 6 3482 1 1 32 ILE O O 19.924 -0.512 -11.830 1.00 . A A . 32 ILE O 1 1 6 3483 1 1 33 GLY C C 20.812 -3.111 -11.146 1.00 . A A . 33 GLY C 1 1 6 3484 1 1 33 GLY CA C 20.628 -2.286 -9.864 1.00 . A A . 33 GLY CA 1 1 6 3485 1 1 33 GLY H H 18.710 -1.547 -9.189 1.00 . A A . 33 GLY H 1 1 6 3486 1 1 33 GLY HA2 H 21.472 -1.617 -9.757 1.00 . A A . 33 GLY HA2 1 1 6 3487 1 1 33 GLY HA3 H 20.591 -2.954 -9.020 1.00 . A A . 33 GLY HA3 1 1 6 3488 1 1 33 GLY N N 19.374 -1.472 -9.905 1.00 . A A . 33 GLY N 1 1 6 3489 1 1 33 GLY O O 21.840 -3.023 -11.789 1.00 . A A . 33 GLY O 1 1 6 3490 1 1 34 LEU C C 20.040 -3.843 -14.005 1.00 . A A . 34 LEU C 1 1 6 3491 1 1 34 LEU CA C 19.949 -4.712 -12.741 1.00 . A A . 34 LEU CA 1 1 6 3492 1 1 34 LEU CB C 18.739 -5.711 -12.863 1.00 . A A . 34 LEU CB 1 1 6 3493 1 1 34 LEU CD1 C 16.659 -4.681 -13.899 1.00 . A A . 34 LEU CD1 1 1 6 3494 1 1 34 LEU CD2 C 16.469 -6.138 -11.856 1.00 . A A . 34 LEU CD2 1 1 6 3495 1 1 34 LEU CG C 17.352 -5.092 -12.578 1.00 . A A . 34 LEU CG 1 1 6 3496 1 1 34 LEU H H 19.006 -3.907 -10.943 1.00 . A A . 34 LEU H 1 1 6 3497 1 1 34 LEU HA H 20.859 -5.282 -12.660 1.00 . A A . 34 LEU HA 1 1 6 3498 1 1 34 LEU HB2 H 18.734 -6.148 -13.850 1.00 . A A . 34 LEU HB2 1 1 6 3499 1 1 34 LEU HB3 H 18.908 -6.506 -12.153 1.00 . A A . 34 LEU HB3 1 1 6 3500 1 1 34 LEU HD11 H 17.285 -4.015 -14.471 1.00 . A A . 34 LEU HD11 1 1 6 3501 1 1 34 LEU HD12 H 16.447 -5.554 -14.500 1.00 . A A . 34 LEU HD12 1 1 6 3502 1 1 34 LEU HD13 H 15.728 -4.175 -13.686 1.00 . A A . 34 LEU HD13 1 1 6 3503 1 1 34 LEU HD21 H 16.512 -7.087 -12.370 1.00 . A A . 34 LEU HD21 1 1 6 3504 1 1 34 LEU HD22 H 16.816 -6.275 -10.842 1.00 . A A . 34 LEU HD22 1 1 6 3505 1 1 34 LEU HD23 H 15.440 -5.811 -11.825 1.00 . A A . 34 LEU HD23 1 1 6 3506 1 1 34 LEU HG H 17.468 -4.243 -11.933 1.00 . A A . 34 LEU HG 1 1 6 3507 1 1 34 LEU N N 19.814 -3.885 -11.497 1.00 . A A . 34 LEU N 1 1 6 3508 1 1 34 LEU O O 20.773 -4.186 -14.915 1.00 . A A . 34 LEU O 1 1 6 3509 1 1 35 MET C C 20.767 -1.310 -15.414 1.00 . A A . 35 MET C 1 1 6 3510 1 1 35 MET CA C 19.338 -1.841 -15.223 1.00 . A A . 35 MET CA 1 1 6 3511 1 1 35 MET CB C 18.349 -0.690 -14.963 1.00 . A A . 35 MET CB 1 1 6 3512 1 1 35 MET CE C 17.449 0.733 -18.810 1.00 . A A . 35 MET CE 1 1 6 3513 1 1 35 MET CG C 18.160 0.145 -16.238 1.00 . A A . 35 MET CG 1 1 6 3514 1 1 35 MET H H 18.728 -2.515 -13.291 1.00 . A A . 35 MET H 1 1 6 3515 1 1 35 MET HA H 19.054 -2.404 -16.098 1.00 . A A . 35 MET HA 1 1 6 3516 1 1 35 MET HB2 H 17.394 -1.098 -14.667 1.00 . A A . 35 MET HB2 1 1 6 3517 1 1 35 MET HB3 H 18.713 -0.060 -14.165 1.00 . A A . 35 MET HB3 1 1 6 3518 1 1 35 MET HE1 H 18.408 1.225 -18.876 1.00 . A A . 35 MET HE1 1 1 6 3519 1 1 35 MET HE2 H 17.142 0.412 -19.795 1.00 . A A . 35 MET HE2 1 1 6 3520 1 1 35 MET HE3 H 16.717 1.418 -18.410 1.00 . A A . 35 MET HE3 1 1 6 3521 1 1 35 MET HG2 H 17.449 0.926 -16.013 1.00 . A A . 35 MET HG2 1 1 6 3522 1 1 35 MET HG3 H 19.101 0.621 -16.474 1.00 . A A . 35 MET HG3 1 1 6 3523 1 1 35 MET N N 19.311 -2.752 -14.038 1.00 . A A . 35 MET N 1 1 6 3524 1 1 35 MET O O 21.290 -1.292 -16.511 1.00 . A A . 35 MET O 1 1 6 3525 1 1 35 MET SD S 17.583 -0.711 -17.725 1.00 . A A . 35 MET SD 1 1 6 3526 1 1 36 VAL C C 23.679 -1.397 -14.857 1.00 . A A . 36 VAL C 1 1 6 3527 1 1 36 VAL CA C 22.722 -0.345 -14.275 1.00 . A A . 36 VAL CA 1 1 6 3528 1 1 36 VAL CB C 23.054 -0.004 -12.784 1.00 . A A . 36 VAL CB 1 1 6 3529 1 1 36 VAL CG1 C 24.579 0.159 -12.572 1.00 . A A . 36 VAL CG1 1 1 6 3530 1 1 36 VAL CG2 C 22.360 1.328 -12.413 1.00 . A A . 36 VAL CG2 1 1 6 3531 1 1 36 VAL H H 20.830 -0.937 -13.478 1.00 . A A . 36 VAL H 1 1 6 3532 1 1 36 VAL HA H 22.760 0.544 -14.889 1.00 . A A . 36 VAL HA 1 1 6 3533 1 1 36 VAL HB H 22.680 -0.779 -12.127 1.00 . A A . 36 VAL HB 1 1 6 3534 1 1 36 VAL HG11 H 25.004 0.791 -13.339 1.00 . A A . 36 VAL HG11 1 1 6 3535 1 1 36 VAL HG12 H 24.775 0.605 -11.607 1.00 . A A . 36 VAL HG12 1 1 6 3536 1 1 36 VAL HG13 H 25.064 -0.806 -12.606 1.00 . A A . 36 VAL HG13 1 1 6 3537 1 1 36 VAL HG21 H 21.339 1.336 -12.768 1.00 . A A . 36 VAL HG21 1 1 6 3538 1 1 36 VAL HG22 H 22.353 1.450 -11.340 1.00 . A A . 36 VAL HG22 1 1 6 3539 1 1 36 VAL HG23 H 22.883 2.163 -12.856 1.00 . A A . 36 VAL HG23 1 1 6 3540 1 1 36 VAL N N 21.335 -0.894 -14.311 1.00 . A A . 36 VAL N 1 1 6 3541 1 1 36 VAL O O 24.420 -1.105 -15.776 1.00 . A A . 36 VAL O 1 1 6 3542 1 1 37 GLY C C 24.266 -5.018 -14.128 1.00 . A A . 37 GLY C 1 1 6 3543 1 1 37 GLY CA C 24.524 -3.672 -14.809 1.00 . A A . 37 GLY CA 1 1 6 3544 1 1 37 GLY H H 23.015 -2.753 -13.561 1.00 . A A . 37 GLY H 1 1 6 3545 1 1 37 GLY HA2 H 24.370 -3.786 -15.873 1.00 . A A . 37 GLY HA2 1 1 6 3546 1 1 37 GLY HA3 H 25.551 -3.388 -14.632 1.00 . A A . 37 GLY HA3 1 1 6 3547 1 1 37 GLY N N 23.631 -2.583 -14.304 1.00 . A A . 37 GLY N 1 1 6 3548 1 1 37 GLY O O 24.649 -6.047 -14.651 1.00 . A A . 37 GLY O 1 1 6 3549 1 1 38 GLY C C 24.582 -6.890 -11.632 1.00 . A A . 38 GLY C 1 1 6 3550 1 1 38 GLY CA C 23.323 -6.238 -12.230 1.00 . A A . 38 GLY CA 1 1 6 3551 1 1 38 GLY H H 23.331 -4.125 -12.616 1.00 . A A . 38 GLY H 1 1 6 3552 1 1 38 GLY HA2 H 22.648 -5.995 -11.423 1.00 . A A . 38 GLY HA2 1 1 6 3553 1 1 38 GLY HA3 H 22.840 -6.943 -12.891 1.00 . A A . 38 GLY HA3 1 1 6 3554 1 1 38 GLY N N 23.627 -4.981 -12.986 1.00 . A A . 38 GLY N 1 1 6 3555 1 1 38 GLY O O 24.480 -7.894 -10.954 1.00 . A A . 38 GLY O 1 1 6 3556 1 1 39 VAL C C 27.327 -6.172 -10.020 1.00 . A A . 39 VAL C 1 1 6 3557 1 1 39 VAL CA C 27.021 -6.838 -11.374 1.00 . A A . 39 VAL CA 1 1 6 3558 1 1 39 VAL CB C 28.159 -6.534 -12.413 1.00 . A A . 39 VAL CB 1 1 6 3559 1 1 39 VAL CG1 C 29.317 -7.540 -12.213 1.00 . A A . 39 VAL CG1 1 1 6 3560 1 1 39 VAL CG2 C 27.639 -6.672 -13.866 1.00 . A A . 39 VAL CG2 1 1 6 3561 1 1 39 VAL H H 25.741 -5.497 -12.443 1.00 . A A . 39 VAL H 1 1 6 3562 1 1 39 VAL HA H 26.916 -7.899 -11.222 1.00 . A A . 39 VAL HA 1 1 6 3563 1 1 39 VAL HB H 28.528 -5.530 -12.270 1.00 . A A . 39 VAL HB 1 1 6 3564 1 1 39 VAL HG11 H 29.716 -7.466 -11.212 1.00 . A A . 39 VAL HG11 1 1 6 3565 1 1 39 VAL HG12 H 28.970 -8.551 -12.374 1.00 . A A . 39 VAL HG12 1 1 6 3566 1 1 39 VAL HG13 H 30.112 -7.333 -12.914 1.00 . A A . 39 VAL HG13 1 1 6 3567 1 1 39 VAL HG21 H 27.002 -7.540 -13.962 1.00 . A A . 39 VAL HG21 1 1 6 3568 1 1 39 VAL HG22 H 27.076 -5.792 -14.138 1.00 . A A . 39 VAL HG22 1 1 6 3569 1 1 39 VAL HG23 H 28.465 -6.771 -14.555 1.00 . A A . 39 VAL HG23 1 1 6 3570 1 1 39 VAL N N 25.725 -6.303 -11.896 1.00 . A A . 39 VAL N 1 1 6 3571 1 1 39 VAL O O 28.468 -5.961 -9.653 1.00 . A A . 39 VAL O 1 1 6 3572 1 1 40 VAL C C 26.982 -6.201 -6.960 1.00 . A A . 40 VAL C 1 1 6 3573 1 1 40 VAL CA C 26.381 -5.211 -7.979 1.00 . A A . 40 VAL CA 1 1 6 3574 1 1 40 VAL CB C 24.961 -4.753 -7.535 1.00 . A A . 40 VAL CB 1 1 6 3575 1 1 40 VAL CG1 C 25.053 -3.991 -6.195 1.00 . A A . 40 VAL CG1 1 1 6 3576 1 1 40 VAL CG2 C 24.355 -3.815 -8.610 1.00 . A A . 40 VAL CG2 1 1 6 3577 1 1 40 VAL H H 25.382 -6.068 -9.680 1.00 . A A . 40 VAL H 1 1 6 3578 1 1 40 VAL HA H 27.033 -4.352 -8.072 1.00 . A A . 40 VAL HA 1 1 6 3579 1 1 40 VAL HB H 24.320 -5.614 -7.413 1.00 . A A . 40 VAL HB 1 1 6 3580 1 1 40 VAL HG11 H 25.789 -3.202 -6.257 1.00 . A A . 40 VAL HG11 1 1 6 3581 1 1 40 VAL HG12 H 24.096 -3.555 -5.949 1.00 . A A . 40 VAL HG12 1 1 6 3582 1 1 40 VAL HG13 H 25.335 -4.668 -5.402 1.00 . A A . 40 VAL HG13 1 1 6 3583 1 1 40 VAL HG21 H 25.018 -2.984 -8.802 1.00 . A A . 40 VAL HG21 1 1 6 3584 1 1 40 VAL HG22 H 24.197 -4.354 -9.533 1.00 . A A . 40 VAL HG22 1 1 6 3585 1 1 40 VAL HG23 H 23.403 -3.430 -8.274 1.00 . A A . 40 VAL HG23 1 1 6 3586 1 1 40 VAL N N 26.267 -5.864 -9.318 1.00 . A A . 40 VAL N 1 1 6 3587 1 1 40 VAL O O 27.902 -5.783 -6.276 1.00 . A A . 40 VAL O 1 1 6 3588 1 1 40 VAL OXT O 26.489 -7.317 -6.925 1.00 . A A . 40 VAL OXT 1 1 7 3589 1 1 1 ASP C C -29.365 0.538 -20.511 1.00 . A A . 1 ASP C 1 1 7 3590 1 1 1 ASP CA C -30.019 0.383 -21.891 1.00 . A A . 1 ASP CA 1 1 7 3591 1 1 1 ASP CB C -30.141 -1.115 -22.223 1.00 . A A . 1 ASP CB 1 1 7 3592 1 1 1 ASP CG C -30.890 -1.274 -23.558 1.00 . A A . 1 ASP CG 1 1 7 3593 1 1 1 ASP H1 H -28.370 1.511 -22.489 1.00 . A A . 1 ASP H1 1 1 7 3594 1 1 1 ASP H2 H -28.890 0.380 -23.644 1.00 . A A . 1 ASP H2 1 1 7 3595 1 1 1 ASP H3 H -29.776 1.805 -23.392 1.00 . A A . 1 ASP H3 1 1 7 3596 1 1 1 ASP HA H -30.997 0.840 -21.864 1.00 . A A . 1 ASP HA 1 1 7 3597 1 1 1 ASP HB2 H -29.160 -1.563 -22.308 1.00 . A A . 1 ASP HB2 1 1 7 3598 1 1 1 ASP HB3 H -30.690 -1.626 -21.444 1.00 . A A . 1 ASP HB3 1 1 7 3599 1 1 1 ASP N N -29.201 1.072 -22.932 1.00 . A A . 1 ASP N 1 1 7 3600 1 1 1 ASP O O -28.186 0.821 -20.406 1.00 . A A . 1 ASP O 1 1 7 3601 1 1 1 ASP OD1 O -30.204 -1.275 -24.568 1.00 . A A . 1 ASP OD1 1 1 7 3602 1 1 1 ASP OD2 O -32.104 -1.385 -23.492 1.00 . A A . 1 ASP OD2 1 1 7 3603 1 1 2 ALA C C -30.623 -0.331 -17.166 1.00 . A A . 2 ALA C 1 1 7 3604 1 1 2 ALA CA C -29.682 0.457 -18.083 1.00 . A A . 2 ALA CA 1 1 7 3605 1 1 2 ALA CB C -29.666 1.941 -17.673 1.00 . A A . 2 ALA CB 1 1 7 3606 1 1 2 ALA H H -31.104 0.116 -19.660 1.00 . A A . 2 ALA H 1 1 7 3607 1 1 2 ALA HA H -28.687 0.035 -18.013 1.00 . A A . 2 ALA HA 1 1 7 3608 1 1 2 ALA HB1 H -29.258 2.541 -18.472 1.00 . A A . 2 ALA HB1 1 1 7 3609 1 1 2 ALA HB2 H -30.668 2.283 -17.461 1.00 . A A . 2 ALA HB2 1 1 7 3610 1 1 2 ALA HB3 H -29.056 2.081 -16.793 1.00 . A A . 2 ALA HB3 1 1 7 3611 1 1 2 ALA N N -30.166 0.343 -19.494 1.00 . A A . 2 ALA N 1 1 7 3612 1 1 2 ALA O O -31.828 -0.237 -17.292 1.00 . A A . 2 ALA O 1 1 7 3613 1 1 3 GLU C C -31.516 -1.006 -14.260 1.00 . A A . 3 GLU C 1 1 7 3614 1 1 3 GLU CA C -30.853 -1.905 -15.311 1.00 . A A . 3 GLU CA 1 1 7 3615 1 1 3 GLU CB C -29.945 -2.925 -14.596 1.00 . A A . 3 GLU CB 1 1 7 3616 1 1 3 GLU CD C -27.670 -3.141 -15.672 1.00 . A A . 3 GLU CD 1 1 7 3617 1 1 3 GLU CG C -29.098 -3.717 -15.621 1.00 . A A . 3 GLU CG 1 1 7 3618 1 1 3 GLU H H -29.065 -1.113 -16.219 1.00 . A A . 3 GLU H 1 1 7 3619 1 1 3 GLU HA H -31.625 -2.423 -15.863 1.00 . A A . 3 GLU HA 1 1 7 3620 1 1 3 GLU HB2 H -29.306 -2.412 -13.891 1.00 . A A . 3 GLU HB2 1 1 7 3621 1 1 3 GLU HB3 H -30.561 -3.617 -14.041 1.00 . A A . 3 GLU HB3 1 1 7 3622 1 1 3 GLU HG2 H -29.043 -4.754 -15.322 1.00 . A A . 3 GLU HG2 1 1 7 3623 1 1 3 GLU HG3 H -29.537 -3.673 -16.609 1.00 . A A . 3 GLU HG3 1 1 7 3624 1 1 3 GLU N N -30.042 -1.085 -16.268 1.00 . A A . 3 GLU N 1 1 7 3625 1 1 3 GLU O O -32.459 -1.409 -13.607 1.00 . A A . 3 GLU O 1 1 7 3626 1 1 3 GLU OE1 O -26.919 -3.491 -14.776 1.00 . A A . 3 GLU OE1 1 1 7 3627 1 1 3 GLU OE2 O -27.411 -2.388 -16.598 1.00 . A A . 3 GLU OE2 1 1 7 3628 1 1 4 PHE C C -31.455 0.645 -11.725 1.00 . A A . 4 PHE C 1 1 7 3629 1 1 4 PHE CA C -31.503 1.198 -13.161 1.00 . A A . 4 PHE CA 1 1 7 3630 1 1 4 PHE CB C -32.960 1.574 -13.561 1.00 . A A . 4 PHE CB 1 1 7 3631 1 1 4 PHE CD1 C -32.796 3.955 -14.409 1.00 . A A . 4 PHE CD1 1 1 7 3632 1 1 4 PHE CD2 C -33.664 3.605 -12.215 1.00 . A A . 4 PHE CD2 1 1 7 3633 1 1 4 PHE CE1 C -32.960 5.316 -14.258 1.00 . A A . 4 PHE CE1 1 1 7 3634 1 1 4 PHE CE2 C -33.828 4.967 -12.063 1.00 . A A . 4 PHE CE2 1 1 7 3635 1 1 4 PHE CG C -33.147 3.089 -13.389 1.00 . A A . 4 PHE CG 1 1 7 3636 1 1 4 PHE CZ C -33.477 5.822 -13.084 1.00 . A A . 4 PHE CZ 1 1 7 3637 1 1 4 PHE H H -30.231 0.429 -14.709 1.00 . A A . 4 PHE H 1 1 7 3638 1 1 4 PHE HA H -30.851 2.054 -13.210 1.00 . A A . 4 PHE HA 1 1 7 3639 1 1 4 PHE HB2 H -33.144 1.319 -14.594 1.00 . A A . 4 PHE HB2 1 1 7 3640 1 1 4 PHE HB3 H -33.683 1.054 -12.948 1.00 . A A . 4 PHE HB3 1 1 7 3641 1 1 4 PHE HD1 H -32.391 3.565 -15.333 1.00 . A A . 4 PHE HD1 1 1 7 3642 1 1 4 PHE HD2 H -33.943 2.943 -11.409 1.00 . A A . 4 PHE HD2 1 1 7 3643 1 1 4 PHE HE1 H -32.683 5.984 -15.060 1.00 . A A . 4 PHE HE1 1 1 7 3644 1 1 4 PHE HE2 H -34.232 5.362 -11.143 1.00 . A A . 4 PHE HE2 1 1 7 3645 1 1 4 PHE HZ H -33.604 6.889 -12.966 1.00 . A A . 4 PHE HZ 1 1 7 3646 1 1 4 PHE N N -30.989 0.189 -14.138 1.00 . A A . 4 PHE N 1 1 7 3647 1 1 4 PHE O O -32.136 1.115 -10.835 1.00 . A A . 4 PHE O 1 1 7 3648 1 1 5 ARG C C -28.934 -1.467 -10.186 1.00 . A A . 5 ARG C 1 1 7 3649 1 1 5 ARG CA C -30.411 -1.041 -10.264 1.00 . A A . 5 ARG CA 1 1 7 3650 1 1 5 ARG CB C -31.345 -2.280 -10.195 1.00 . A A . 5 ARG CB 1 1 7 3651 1 1 5 ARG CD C -33.728 -3.083 -9.993 1.00 . A A . 5 ARG CD 1 1 7 3652 1 1 5 ARG CG C -32.826 -1.842 -10.140 1.00 . A A . 5 ARG CG 1 1 7 3653 1 1 5 ARG CZ C -36.102 -3.554 -10.384 1.00 . A A . 5 ARG CZ 1 1 7 3654 1 1 5 ARG H H -30.111 -0.646 -12.357 1.00 . A A . 5 ARG H 1 1 7 3655 1 1 5 ARG HA H -30.617 -0.354 -9.455 1.00 . A A . 5 ARG HA 1 1 7 3656 1 1 5 ARG HB2 H -31.182 -2.904 -11.061 1.00 . A A . 5 ARG HB2 1 1 7 3657 1 1 5 ARG HB3 H -31.115 -2.857 -9.309 1.00 . A A . 5 ARG HB3 1 1 7 3658 1 1 5 ARG HD2 H -33.422 -3.863 -10.677 1.00 . A A . 5 ARG HD2 1 1 7 3659 1 1 5 ARG HD3 H -33.698 -3.459 -8.980 1.00 . A A . 5 ARG HD3 1 1 7 3660 1 1 5 ARG HE H -35.330 -1.731 -10.487 1.00 . A A . 5 ARG HE 1 1 7 3661 1 1 5 ARG HG2 H -32.985 -1.178 -9.303 1.00 . A A . 5 ARG HG2 1 1 7 3662 1 1 5 ARG HG3 H -33.091 -1.321 -11.050 1.00 . A A . 5 ARG HG3 1 1 7 3663 1 1 5 ARG HH11 H -34.949 -5.135 -9.944 1.00 . A A . 5 ARG HH11 1 1 7 3664 1 1 5 ARG HH12 H -36.622 -5.481 -10.217 1.00 . A A . 5 ARG HH12 1 1 7 3665 1 1 5 ARG HH21 H -37.446 -2.143 -10.838 1.00 . A A . 5 ARG HH21 1 1 7 3666 1 1 5 ARG HH22 H -38.065 -3.758 -10.733 1.00 . A A . 5 ARG HH22 1 1 7 3667 1 1 5 ARG N N -30.619 -0.350 -11.574 1.00 . A A . 5 ARG N 1 1 7 3668 1 1 5 ARG NE N -35.132 -2.676 -10.318 1.00 . A A . 5 ARG NE 1 1 7 3669 1 1 5 ARG NH1 N -35.872 -4.821 -10.164 1.00 . A A . 5 ARG NH1 1 1 7 3670 1 1 5 ARG NH2 N -37.299 -3.119 -10.674 1.00 . A A . 5 ARG NH2 1 1 7 3671 1 1 5 ARG O O -28.600 -2.526 -9.687 1.00 . A A . 5 ARG O 1 1 7 3672 1 1 6 HIS C C -25.869 0.493 -10.752 1.00 . A A . 6 HIS C 1 1 7 3673 1 1 6 HIS CA C -26.616 -0.850 -10.710 1.00 . A A . 6 HIS CA 1 1 7 3674 1 1 6 HIS CB C -26.280 -1.705 -11.953 1.00 . A A . 6 HIS CB 1 1 7 3675 1 1 6 HIS CD2 C -25.786 -0.583 -14.305 1.00 . A A . 6 HIS CD2 1 1 7 3676 1 1 6 HIS CE1 C -27.661 0.221 -14.666 1.00 . A A . 6 HIS CE1 1 1 7 3677 1 1 6 HIS CG C -26.595 -0.909 -13.230 1.00 . A A . 6 HIS CG 1 1 7 3678 1 1 6 HIS H H -28.431 0.227 -11.081 1.00 . A A . 6 HIS H 1 1 7 3679 1 1 6 HIS HA H -26.350 -1.348 -9.796 1.00 . A A . 6 HIS HA 1 1 7 3680 1 1 6 HIS HB2 H -25.232 -1.968 -11.955 1.00 . A A . 6 HIS HB2 1 1 7 3681 1 1 6 HIS HB3 H -26.867 -2.612 -11.956 1.00 . A A . 6 HIS HB3 1 1 7 3682 1 1 6 HIS HD1 H -28.543 -0.426 -12.962 1.00 . A A . 6 HIS HD1 1 1 7 3683 1 1 6 HIS HD2 H -24.747 -0.864 -14.405 1.00 . A A . 6 HIS HD2 1 1 7 3684 1 1 6 HIS HE1 H -28.479 0.744 -15.135 1.00 . A A . 6 HIS HE1 1 1 7 3685 1 1 6 HIS N N -28.092 -0.605 -10.696 1.00 . A A . 6 HIS N 1 1 7 3686 1 1 6 HIS ND1 N -27.740 -0.380 -13.522 1.00 . A A . 6 HIS ND1 1 1 7 3687 1 1 6 HIS NE2 N -26.465 0.120 -15.190 1.00 . A A . 6 HIS NE2 1 1 7 3688 1 1 6 HIS O O -24.703 0.572 -11.085 1.00 . A A . 6 HIS O 1 1 7 3689 1 1 7 ASP C C -25.709 3.266 -8.923 1.00 . A A . 7 ASP C 1 1 7 3690 1 1 7 ASP CA C -26.122 2.909 -10.352 1.00 . A A . 7 ASP CA 1 1 7 3691 1 1 7 ASP CB C -27.259 3.849 -10.841 1.00 . A A . 7 ASP CB 1 1 7 3692 1 1 7 ASP CG C -28.648 3.220 -10.590 1.00 . A A . 7 ASP CG 1 1 7 3693 1 1 7 ASP H H -27.534 1.328 -10.134 1.00 . A A . 7 ASP H 1 1 7 3694 1 1 7 ASP HA H -25.270 2.997 -11.006 1.00 . A A . 7 ASP HA 1 1 7 3695 1 1 7 ASP HB2 H -27.204 4.791 -10.319 1.00 . A A . 7 ASP HB2 1 1 7 3696 1 1 7 ASP HB3 H -27.144 4.039 -11.899 1.00 . A A . 7 ASP HB3 1 1 7 3697 1 1 7 ASP N N -26.610 1.504 -10.392 1.00 . A A . 7 ASP N 1 1 7 3698 1 1 7 ASP O O -26.490 3.119 -8.003 1.00 . A A . 7 ASP O 1 1 7 3699 1 1 7 ASP OD1 O -29.047 2.438 -11.437 1.00 . A A . 7 ASP OD1 1 1 7 3700 1 1 7 ASP OD2 O -29.225 3.554 -9.568 1.00 . A A . 7 ASP OD2 1 1 7 3701 1 1 8 SER C C -23.983 2.926 -6.484 1.00 . A A . 8 SER C 1 1 7 3702 1 1 8 SER CA C -23.931 4.121 -7.458 1.00 . A A . 8 SER CA 1 1 7 3703 1 1 8 SER CB C -24.761 5.319 -6.917 1.00 . A A . 8 SER CB 1 1 7 3704 1 1 8 SER H H -23.922 3.814 -9.587 1.00 . A A . 8 SER H 1 1 7 3705 1 1 8 SER HA H -22.900 4.412 -7.592 1.00 . A A . 8 SER HA 1 1 7 3706 1 1 8 SER HB2 H -24.932 6.060 -7.684 1.00 . A A . 8 SER HB2 1 1 7 3707 1 1 8 SER HB3 H -25.704 5.008 -6.489 1.00 . A A . 8 SER HB3 1 1 7 3708 1 1 8 SER HG H -24.397 5.771 -5.062 1.00 . A A . 8 SER HG 1 1 7 3709 1 1 8 SER N N -24.487 3.727 -8.791 1.00 . A A . 8 SER N 1 1 7 3710 1 1 8 SER O O -24.327 3.065 -5.326 1.00 . A A . 8 SER O 1 1 7 3711 1 1 8 SER OG O -23.941 5.876 -5.899 1.00 . A A . 8 SER OG 1 1 7 3712 1 1 9 GLY C C -22.493 0.579 -5.169 1.00 . A A . 9 GLY C 1 1 7 3713 1 1 9 GLY CA C -23.626 0.526 -6.192 1.00 . A A . 9 GLY CA 1 1 7 3714 1 1 9 GLY H H -23.357 1.737 -7.948 1.00 . A A . 9 GLY H 1 1 7 3715 1 1 9 GLY HA2 H -24.573 0.426 -5.682 1.00 . A A . 9 GLY HA2 1 1 7 3716 1 1 9 GLY HA3 H -23.478 -0.320 -6.846 1.00 . A A . 9 GLY HA3 1 1 7 3717 1 1 9 GLY N N -23.628 1.777 -7.008 1.00 . A A . 9 GLY N 1 1 7 3718 1 1 9 GLY O O -22.731 0.694 -3.982 1.00 . A A . 9 GLY O 1 1 7 3719 1 1 10 TYR C C -18.803 0.706 -5.637 1.00 . A A . 10 TYR C 1 1 7 3720 1 1 10 TYR CA C -20.077 0.535 -4.801 1.00 . A A . 10 TYR CA 1 1 7 3721 1 1 10 TYR CB C -19.974 -0.783 -3.977 1.00 . A A . 10 TYR CB 1 1 7 3722 1 1 10 TYR CD1 C -18.501 -0.019 -2.050 1.00 . A A . 10 TYR CD1 1 1 7 3723 1 1 10 TYR CD2 C -17.568 -1.534 -3.634 1.00 . A A . 10 TYR CD2 1 1 7 3724 1 1 10 TYR CE1 C -17.306 -0.006 -1.362 1.00 . A A . 10 TYR CE1 1 1 7 3725 1 1 10 TYR CE2 C -16.375 -1.520 -2.944 1.00 . A A . 10 TYR CE2 1 1 7 3726 1 1 10 TYR CG C -18.644 -0.782 -3.195 1.00 . A A . 10 TYR CG 1 1 7 3727 1 1 10 TYR CZ C -16.235 -0.756 -1.804 1.00 . A A . 10 TYR CZ 1 1 7 3728 1 1 10 TYR H H -21.185 0.409 -6.648 1.00 . A A . 10 TYR H 1 1 7 3729 1 1 10 TYR HA H -20.166 1.380 -4.132 1.00 . A A . 10 TYR HA 1 1 7 3730 1 1 10 TYR HB2 H -20.791 -0.856 -3.275 1.00 . A A . 10 TYR HB2 1 1 7 3731 1 1 10 TYR HB3 H -20.000 -1.640 -4.634 1.00 . A A . 10 TYR HB3 1 1 7 3732 1 1 10 TYR HD1 H -19.330 0.574 -1.692 1.00 . A A . 10 TYR HD1 1 1 7 3733 1 1 10 TYR HD2 H -17.662 -2.137 -4.526 1.00 . A A . 10 TYR HD2 1 1 7 3734 1 1 10 TYR HE1 H -17.208 0.596 -0.469 1.00 . A A . 10 TYR HE1 1 1 7 3735 1 1 10 TYR HE2 H -15.544 -2.112 -3.299 1.00 . A A . 10 TYR HE2 1 1 7 3736 1 1 10 TYR HH H -14.476 -0.074 -1.516 1.00 . A A . 10 TYR HH 1 1 7 3737 1 1 10 TYR N N -21.289 0.496 -5.677 1.00 . A A . 10 TYR N 1 1 7 3738 1 1 10 TYR O O -18.749 0.343 -6.796 1.00 . A A . 10 TYR O 1 1 7 3739 1 1 10 TYR OH O -15.040 -0.740 -1.116 1.00 . A A . 10 TYR OH 1 1 7 3740 1 1 11 GLU C C -15.488 1.823 -4.491 1.00 . A A . 11 GLU C 1 1 7 3741 1 1 11 GLU CA C -16.487 1.517 -5.614 1.00 . A A . 11 GLU CA 1 1 7 3742 1 1 11 GLU CB C -16.600 2.723 -6.578 1.00 . A A . 11 GLU CB 1 1 7 3743 1 1 11 GLU CD C -14.208 3.426 -7.092 1.00 . A A . 11 GLU CD 1 1 7 3744 1 1 11 GLU CG C -15.453 2.688 -7.623 1.00 . A A . 11 GLU CG 1 1 7 3745 1 1 11 GLU H H -17.953 1.523 -4.050 1.00 . A A . 11 GLU H 1 1 7 3746 1 1 11 GLU HA H -16.174 0.622 -6.134 1.00 . A A . 11 GLU HA 1 1 7 3747 1 1 11 GLU HB2 H -17.544 2.681 -7.101 1.00 . A A . 11 GLU HB2 1 1 7 3748 1 1 11 GLU HB3 H -16.575 3.648 -6.016 1.00 . A A . 11 GLU HB3 1 1 7 3749 1 1 11 GLU HG2 H -15.191 1.667 -7.861 1.00 . A A . 11 GLU HG2 1 1 7 3750 1 1 11 GLU HG3 H -15.776 3.174 -8.531 1.00 . A A . 11 GLU HG3 1 1 7 3751 1 1 11 GLU N N -17.816 1.264 -4.985 1.00 . A A . 11 GLU N 1 1 7 3752 1 1 11 GLU O O -15.839 2.445 -3.506 1.00 . A A . 11 GLU O 1 1 7 3753 1 1 11 GLU OE1 O -14.330 4.621 -6.870 1.00 . A A . 11 GLU OE1 1 1 7 3754 1 1 11 GLU OE2 O -13.200 2.757 -6.936 1.00 . A A . 11 GLU OE2 1 1 7 3755 1 1 12 VAL C C -12.695 3.056 -3.804 1.00 . A A . 12 VAL C 1 1 7 3756 1 1 12 VAL CA C -13.205 1.611 -3.647 1.00 . A A . 12 VAL CA 1 1 7 3757 1 1 12 VAL CB C -12.052 0.565 -3.875 1.00 . A A . 12 VAL CB 1 1 7 3758 1 1 12 VAL CG1 C -12.591 -0.866 -3.672 1.00 . A A . 12 VAL CG1 1 1 7 3759 1 1 12 VAL CG2 C -11.451 0.682 -5.297 1.00 . A A . 12 VAL CG2 1 1 7 3760 1 1 12 VAL H H -14.051 0.880 -5.486 1.00 . A A . 12 VAL H 1 1 7 3761 1 1 12 VAL HA H -13.613 1.501 -2.654 1.00 . A A . 12 VAL HA 1 1 7 3762 1 1 12 VAL HB H -11.269 0.727 -3.148 1.00 . A A . 12 VAL HB 1 1 7 3763 1 1 12 VAL HG11 H -13.410 -1.066 -4.348 1.00 . A A . 12 VAL HG11 1 1 7 3764 1 1 12 VAL HG12 H -11.805 -1.584 -3.860 1.00 . A A . 12 VAL HG12 1 1 7 3765 1 1 12 VAL HG13 H -12.935 -0.993 -2.657 1.00 . A A . 12 VAL HG13 1 1 7 3766 1 1 12 VAL HG21 H -11.115 1.690 -5.485 1.00 . A A . 12 VAL HG21 1 1 7 3767 1 1 12 VAL HG22 H -10.604 0.017 -5.393 1.00 . A A . 12 VAL HG22 1 1 7 3768 1 1 12 VAL HG23 H -12.184 0.414 -6.045 1.00 . A A . 12 VAL HG23 1 1 7 3769 1 1 12 VAL N N -14.271 1.375 -4.670 1.00 . A A . 12 VAL N 1 1 7 3770 1 1 12 VAL O O -13.419 3.927 -4.246 1.00 . A A . 12 VAL O 1 1 7 3771 1 1 13 HIS C C -9.611 4.458 -4.436 1.00 . A A . 13 HIS C 1 1 7 3772 1 1 13 HIS CA C -10.829 4.611 -3.525 1.00 . A A . 13 HIS CA 1 1 7 3773 1 1 13 HIS CB C -10.443 5.055 -2.105 1.00 . A A . 13 HIS CB 1 1 7 3774 1 1 13 HIS CD2 C -12.200 6.795 -1.172 1.00 . A A . 13 HIS CD2 1 1 7 3775 1 1 13 HIS CE1 C -13.576 5.452 -0.397 1.00 . A A . 13 HIS CE1 1 1 7 3776 1 1 13 HIS CG C -11.723 5.520 -1.409 1.00 . A A . 13 HIS CG 1 1 7 3777 1 1 13 HIS H H -10.948 2.511 -3.075 1.00 . A A . 13 HIS H 1 1 7 3778 1 1 13 HIS HA H -11.507 5.324 -3.967 1.00 . A A . 13 HIS HA 1 1 7 3779 1 1 13 HIS HB2 H -10.017 4.235 -1.544 1.00 . A A . 13 HIS HB2 1 1 7 3780 1 1 13 HIS HB3 H -9.740 5.874 -2.132 1.00 . A A . 13 HIS HB3 1 1 7 3781 1 1 13 HIS HD1 H -12.583 3.761 -0.909 1.00 . A A . 13 HIS HD1 1 1 7 3782 1 1 13 HIS HD2 H -11.698 7.705 -1.466 1.00 . A A . 13 HIS HD2 1 1 7 3783 1 1 13 HIS HE1 H -14.448 5.036 0.087 1.00 . A A . 13 HIS HE1 1 1 7 3784 1 1 13 HIS N N -11.463 3.263 -3.429 1.00 . A A . 13 HIS N 1 1 7 3785 1 1 13 HIS ND1 N -12.620 4.740 -0.905 1.00 . A A . 13 HIS ND1 1 1 7 3786 1 1 13 HIS NE2 N -13.356 6.735 -0.540 1.00 . A A . 13 HIS NE2 1 1 7 3787 1 1 13 HIS O O -9.686 4.741 -5.616 1.00 . A A . 13 HIS O 1 1 7 3788 1 1 14 HIS C C -6.463 2.652 -4.034 1.00 . A A . 14 HIS C 1 1 7 3789 1 1 14 HIS CA C -7.262 3.812 -4.635 1.00 . A A . 14 HIS CA 1 1 7 3790 1 1 14 HIS CB C -6.395 5.117 -4.601 1.00 . A A . 14 HIS CB 1 1 7 3791 1 1 14 HIS CD2 C -8.049 7.191 -4.454 1.00 . A A . 14 HIS CD2 1 1 7 3792 1 1 14 HIS CE1 C -7.726 7.686 -2.466 1.00 . A A . 14 HIS CE1 1 1 7 3793 1 1 14 HIS CG C -7.124 6.297 -3.942 1.00 . A A . 14 HIS CG 1 1 7 3794 1 1 14 HIS H H -8.542 3.810 -2.903 1.00 . A A . 14 HIS H 1 1 7 3795 1 1 14 HIS HA H -7.520 3.531 -5.641 1.00 . A A . 14 HIS HA 1 1 7 3796 1 1 14 HIS HB2 H -5.481 4.950 -4.052 1.00 . A A . 14 HIS HB2 1 1 7 3797 1 1 14 HIS HB3 H -6.140 5.404 -5.610 1.00 . A A . 14 HIS HB3 1 1 7 3798 1 1 14 HIS HD1 H -6.379 6.230 -2.066 1.00 . A A . 14 HIS HD1 1 1 7 3799 1 1 14 HIS HD2 H -8.419 7.183 -5.468 1.00 . A A . 14 HIS HD2 1 1 7 3800 1 1 14 HIS HE1 H -7.781 8.181 -1.507 1.00 . A A . 14 HIS HE1 1 1 7 3801 1 1 14 HIS N N -8.525 4.013 -3.860 1.00 . A A . 14 HIS N 1 1 7 3802 1 1 14 HIS ND1 N -6.973 6.662 -2.713 1.00 . A A . 14 HIS ND1 1 1 7 3803 1 1 14 HIS NE2 N -8.414 8.049 -3.521 1.00 . A A . 14 HIS NE2 1 1 7 3804 1 1 14 HIS O O -5.287 2.503 -4.294 1.00 . A A . 14 HIS O 1 1 7 3805 1 1 15 GLN C C -5.621 -0.128 -3.591 1.00 . A A . 15 GLN C 1 1 7 3806 1 1 15 GLN CA C -6.464 0.675 -2.588 1.00 . A A . 15 GLN CA 1 1 7 3807 1 1 15 GLN CB C -7.555 -0.225 -1.972 1.00 . A A . 15 GLN CB 1 1 7 3808 1 1 15 GLN CD C -7.972 -2.186 -0.456 1.00 . A A . 15 GLN CD 1 1 7 3809 1 1 15 GLN CG C -6.905 -1.225 -0.991 1.00 . A A . 15 GLN CG 1 1 7 3810 1 1 15 GLN H H -8.080 2.031 -3.100 1.00 . A A . 15 GLN H 1 1 7 3811 1 1 15 GLN HA H -5.807 1.052 -1.820 1.00 . A A . 15 GLN HA 1 1 7 3812 1 1 15 GLN HB2 H -8.267 0.391 -1.442 1.00 . A A . 15 GLN HB2 1 1 7 3813 1 1 15 GLN HB3 H -8.078 -0.757 -2.753 1.00 . A A . 15 GLN HB3 1 1 7 3814 1 1 15 GLN HE21 H -8.972 -0.753 0.487 1.00 . A A . 15 GLN HE21 1 1 7 3815 1 1 15 GLN HE22 H -9.629 -2.311 0.632 1.00 . A A . 15 GLN HE22 1 1 7 3816 1 1 15 GLN HG2 H -6.139 -1.801 -1.490 1.00 . A A . 15 GLN HG2 1 1 7 3817 1 1 15 GLN HG3 H -6.461 -0.700 -0.158 1.00 . A A . 15 GLN HG3 1 1 7 3818 1 1 15 GLN N N -7.129 1.849 -3.246 1.00 . A A . 15 GLN N 1 1 7 3819 1 1 15 GLN NE2 N -8.938 -1.710 0.283 1.00 . A A . 15 GLN NE2 1 1 7 3820 1 1 15 GLN O O -4.492 -0.487 -3.322 1.00 . A A . 15 GLN O 1 1 7 3821 1 1 15 GLN OE1 O -7.936 -3.374 -0.705 1.00 . A A . 15 GLN OE1 1 1 7 3822 1 1 16 LYS C C -4.137 -0.556 -6.137 1.00 . A A . 16 LYS C 1 1 7 3823 1 1 16 LYS CA C -5.523 -1.140 -5.808 1.00 . A A . 16 LYS CA 1 1 7 3824 1 1 16 LYS CB C -6.422 -1.137 -7.083 1.00 . A A . 16 LYS CB 1 1 7 3825 1 1 16 LYS CD C -6.425 0.865 -8.667 1.00 . A A . 16 LYS CD 1 1 7 3826 1 1 16 LYS CE C -6.737 2.373 -8.729 1.00 . A A . 16 LYS CE 1 1 7 3827 1 1 16 LYS CG C -7.034 0.271 -7.376 1.00 . A A . 16 LYS CG 1 1 7 3828 1 1 16 LYS H H -7.128 -0.043 -4.863 1.00 . A A . 16 LYS H 1 1 7 3829 1 1 16 LYS HA H -5.389 -2.152 -5.471 1.00 . A A . 16 LYS HA 1 1 7 3830 1 1 16 LYS HB2 H -5.844 -1.484 -7.929 1.00 . A A . 16 LYS HB2 1 1 7 3831 1 1 16 LYS HB3 H -7.229 -1.840 -6.930 1.00 . A A . 16 LYS HB3 1 1 7 3832 1 1 16 LYS HD2 H -5.355 0.716 -8.684 1.00 . A A . 16 LYS HD2 1 1 7 3833 1 1 16 LYS HD3 H -6.847 0.371 -9.530 1.00 . A A . 16 LYS HD3 1 1 7 3834 1 1 16 LYS HE2 H -7.787 2.532 -8.928 1.00 . A A . 16 LYS HE2 1 1 7 3835 1 1 16 LYS HE3 H -6.481 2.853 -7.796 1.00 . A A . 16 LYS HE3 1 1 7 3836 1 1 16 LYS HG2 H -8.102 0.169 -7.507 1.00 . A A . 16 LYS HG2 1 1 7 3837 1 1 16 LYS HG3 H -6.865 0.951 -6.555 1.00 . A A . 16 LYS HG3 1 1 7 3838 1 1 16 LYS HZ1 H -5.356 2.297 -10.289 1.00 . A A . 16 LYS HZ1 1 1 7 3839 1 1 16 LYS HZ2 H -6.593 3.439 -10.513 1.00 . A A . 16 LYS HZ2 1 1 7 3840 1 1 16 LYS HZ3 H -5.336 3.752 -9.413 1.00 . A A . 16 LYS HZ3 1 1 7 3841 1 1 16 LYS N N -6.214 -0.372 -4.728 1.00 . A A . 16 LYS N 1 1 7 3842 1 1 16 LYS NZ N -5.946 3.014 -9.818 1.00 . A A . 16 LYS NZ 1 1 7 3843 1 1 16 LYS O O -3.126 -1.218 -5.987 1.00 . A A . 16 LYS O 1 1 7 3844 1 1 17 LEU C C -1.941 1.444 -5.670 1.00 . A A . 17 LEU C 1 1 7 3845 1 1 17 LEU CA C -2.824 1.320 -6.914 1.00 . A A . 17 LEU CA 1 1 7 3846 1 1 17 LEU CB C -3.125 2.710 -7.571 1.00 . A A . 17 LEU CB 1 1 7 3847 1 1 17 LEU CD1 C -1.731 4.366 -6.213 1.00 . A A . 17 LEU CD1 1 1 7 3848 1 1 17 LEU CD2 C -3.927 5.058 -7.254 1.00 . A A . 17 LEU CD2 1 1 7 3849 1 1 17 LEU CG C -3.175 3.896 -6.577 1.00 . A A . 17 LEU CG 1 1 7 3850 1 1 17 LEU H H -4.962 1.176 -6.651 1.00 . A A . 17 LEU H 1 1 7 3851 1 1 17 LEU HA H -2.320 0.694 -7.636 1.00 . A A . 17 LEU HA 1 1 7 3852 1 1 17 LEU HB2 H -2.371 2.906 -8.321 1.00 . A A . 17 LEU HB2 1 1 7 3853 1 1 17 LEU HB3 H -4.072 2.639 -8.082 1.00 . A A . 17 LEU HB3 1 1 7 3854 1 1 17 LEU HD11 H -0.989 3.840 -6.798 1.00 . A A . 17 LEU HD11 1 1 7 3855 1 1 17 LEU HD12 H -1.608 5.424 -6.388 1.00 . A A . 17 LEU HD12 1 1 7 3856 1 1 17 LEU HD13 H -1.538 4.171 -5.169 1.00 . A A . 17 LEU HD13 1 1 7 3857 1 1 17 LEU HD21 H -3.422 5.351 -8.163 1.00 . A A . 17 LEU HD21 1 1 7 3858 1 1 17 LEU HD22 H -4.934 4.757 -7.499 1.00 . A A . 17 LEU HD22 1 1 7 3859 1 1 17 LEU HD23 H -3.970 5.908 -6.588 1.00 . A A . 17 LEU HD23 1 1 7 3860 1 1 17 LEU HG H -3.712 3.596 -5.690 1.00 . A A . 17 LEU HG 1 1 7 3861 1 1 17 LEU N N -4.123 0.680 -6.567 1.00 . A A . 17 LEU N 1 1 7 3862 1 1 17 LEU O O -0.748 1.294 -5.774 1.00 . A A . 17 LEU O 1 1 7 3863 1 1 18 VAL C C -0.838 0.566 -3.117 1.00 . A A . 18 VAL C 1 1 7 3864 1 1 18 VAL CA C -1.702 1.835 -3.274 1.00 . A A . 18 VAL CA 1 1 7 3865 1 1 18 VAL CB C -2.705 2.021 -2.102 1.00 . A A . 18 VAL CB 1 1 7 3866 1 1 18 VAL CG1 C -2.024 1.792 -0.748 1.00 . A A . 18 VAL CG1 1 1 7 3867 1 1 18 VAL CG2 C -3.291 3.452 -2.143 1.00 . A A . 18 VAL CG2 1 1 7 3868 1 1 18 VAL H H -3.476 1.837 -4.465 1.00 . A A . 18 VAL H 1 1 7 3869 1 1 18 VAL HA H -1.053 2.694 -3.361 1.00 . A A . 18 VAL HA 1 1 7 3870 1 1 18 VAL HB H -3.513 1.316 -2.201 1.00 . A A . 18 VAL HB 1 1 7 3871 1 1 18 VAL HG11 H -1.048 2.251 -0.737 1.00 . A A . 18 VAL HG11 1 1 7 3872 1 1 18 VAL HG12 H -2.625 2.214 0.043 1.00 . A A . 18 VAL HG12 1 1 7 3873 1 1 18 VAL HG13 H -1.923 0.730 -0.578 1.00 . A A . 18 VAL HG13 1 1 7 3874 1 1 18 VAL HG21 H -3.453 3.769 -3.162 1.00 . A A . 18 VAL HG21 1 1 7 3875 1 1 18 VAL HG22 H -4.238 3.472 -1.623 1.00 . A A . 18 VAL HG22 1 1 7 3876 1 1 18 VAL HG23 H -2.620 4.153 -1.668 1.00 . A A . 18 VAL HG23 1 1 7 3877 1 1 18 VAL N N -2.512 1.708 -4.523 1.00 . A A . 18 VAL N 1 1 7 3878 1 1 18 VAL O O 0.369 0.644 -3.022 1.00 . A A . 18 VAL O 1 1 7 3879 1 1 19 PHE C C 0.381 -1.943 -3.987 1.00 . A A . 19 PHE C 1 1 7 3880 1 1 19 PHE CA C -0.764 -1.880 -2.963 1.00 . A A . 19 PHE CA 1 1 7 3881 1 1 19 PHE CB C -1.781 -3.020 -3.196 1.00 . A A . 19 PHE CB 1 1 7 3882 1 1 19 PHE CD1 C -3.141 -2.319 -1.137 1.00 . A A . 19 PHE CD1 1 1 7 3883 1 1 19 PHE CD2 C -2.756 -4.641 -1.511 1.00 . A A . 19 PHE CD2 1 1 7 3884 1 1 19 PHE CE1 C -3.854 -2.620 0.004 1.00 . A A . 19 PHE CE1 1 1 7 3885 1 1 19 PHE CE2 C -3.471 -4.942 -0.369 1.00 . A A . 19 PHE CE2 1 1 7 3886 1 1 19 PHE CG C -2.582 -3.327 -1.911 1.00 . A A . 19 PHE CG 1 1 7 3887 1 1 19 PHE CZ C -4.020 -3.932 0.389 1.00 . A A . 19 PHE CZ 1 1 7 3888 1 1 19 PHE H H -2.456 -0.562 -3.199 1.00 . A A . 19 PHE H 1 1 7 3889 1 1 19 PHE HA H -0.343 -1.939 -1.973 1.00 . A A . 19 PHE HA 1 1 7 3890 1 1 19 PHE HB2 H -2.478 -2.743 -3.973 1.00 . A A . 19 PHE HB2 1 1 7 3891 1 1 19 PHE HB3 H -1.263 -3.917 -3.506 1.00 . A A . 19 PHE HB3 1 1 7 3892 1 1 19 PHE HD1 H -3.023 -1.284 -1.419 1.00 . A A . 19 PHE HD1 1 1 7 3893 1 1 19 PHE HD2 H -2.330 -5.443 -2.096 1.00 . A A . 19 PHE HD2 1 1 7 3894 1 1 19 PHE HE1 H -4.283 -1.826 0.596 1.00 . A A . 19 PHE HE1 1 1 7 3895 1 1 19 PHE HE2 H -3.600 -5.971 -0.069 1.00 . A A . 19 PHE HE2 1 1 7 3896 1 1 19 PHE HZ H -4.580 -4.167 1.283 1.00 . A A . 19 PHE HZ 1 1 7 3897 1 1 19 PHE N N -1.484 -0.572 -3.107 1.00 . A A . 19 PHE N 1 1 7 3898 1 1 19 PHE O O 1.517 -2.242 -3.666 1.00 . A A . 19 PHE O 1 1 7 3899 1 1 20 PHE C C 2.210 -0.746 -5.931 1.00 . A A . 20 PHE C 1 1 7 3900 1 1 20 PHE CA C 1.018 -1.650 -6.326 1.00 . A A . 20 PHE CA 1 1 7 3901 1 1 20 PHE CB C 0.240 -1.162 -7.597 1.00 . A A . 20 PHE CB 1 1 7 3902 1 1 20 PHE CD1 C 2.101 -0.604 -9.207 1.00 . A A . 20 PHE CD1 1 1 7 3903 1 1 20 PHE CD2 C 0.658 1.169 -8.540 1.00 . A A . 20 PHE CD2 1 1 7 3904 1 1 20 PHE CE1 C 2.810 0.271 -10.000 1.00 . A A . 20 PHE CE1 1 1 7 3905 1 1 20 PHE CE2 C 1.365 2.046 -9.331 1.00 . A A . 20 PHE CE2 1 1 7 3906 1 1 20 PHE CG C 1.021 -0.166 -8.471 1.00 . A A . 20 PHE CG 1 1 7 3907 1 1 20 PHE CZ C 2.444 1.599 -10.063 1.00 . A A . 20 PHE CZ 1 1 7 3908 1 1 20 PHE H H -0.909 -1.412 -5.395 1.00 . A A . 20 PHE H 1 1 7 3909 1 1 20 PHE HA H 1.373 -2.661 -6.471 1.00 . A A . 20 PHE HA 1 1 7 3910 1 1 20 PHE HB2 H 0.004 -2.023 -8.205 1.00 . A A . 20 PHE HB2 1 1 7 3911 1 1 20 PHE HB3 H -0.693 -0.705 -7.305 1.00 . A A . 20 PHE HB3 1 1 7 3912 1 1 20 PHE HD1 H 2.393 -1.641 -9.160 1.00 . A A . 20 PHE HD1 1 1 7 3913 1 1 20 PHE HD2 H -0.186 1.540 -7.979 1.00 . A A . 20 PHE HD2 1 1 7 3914 1 1 20 PHE HE1 H 3.651 -0.090 -10.570 1.00 . A A . 20 PHE HE1 1 1 7 3915 1 1 20 PHE HE2 H 1.069 3.083 -9.371 1.00 . A A . 20 PHE HE2 1 1 7 3916 1 1 20 PHE HZ H 2.999 2.284 -10.685 1.00 . A A . 20 PHE HZ 1 1 7 3917 1 1 20 PHE N N 0.024 -1.642 -5.210 1.00 . A A . 20 PHE N 1 1 7 3918 1 1 20 PHE O O 3.351 -1.157 -5.975 1.00 . A A . 20 PHE O 1 1 7 3919 1 1 21 ALA C C 3.872 0.894 -4.072 1.00 . A A . 21 ALA C 1 1 7 3920 1 1 21 ALA CA C 2.926 1.466 -5.126 1.00 . A A . 21 ALA CA 1 1 7 3921 1 1 21 ALA CB C 2.207 2.709 -4.571 1.00 . A A . 21 ALA CB 1 1 7 3922 1 1 21 ALA H H 0.960 0.717 -5.530 1.00 . A A . 21 ALA H 1 1 7 3923 1 1 21 ALA HA H 3.516 1.734 -5.991 1.00 . A A . 21 ALA HA 1 1 7 3924 1 1 21 ALA HB1 H 1.349 2.946 -5.182 1.00 . A A . 21 ALA HB1 1 1 7 3925 1 1 21 ALA HB2 H 1.877 2.541 -3.557 1.00 . A A . 21 ALA HB2 1 1 7 3926 1 1 21 ALA HB3 H 2.881 3.553 -4.579 1.00 . A A . 21 ALA HB3 1 1 7 3927 1 1 21 ALA N N 1.898 0.463 -5.544 1.00 . A A . 21 ALA N 1 1 7 3928 1 1 21 ALA O O 5.062 1.068 -4.181 1.00 . A A . 21 ALA O 1 1 7 3929 1 1 22 GLU C C 5.278 -1.264 -2.686 1.00 . A A . 22 GLU C 1 1 7 3930 1 1 22 GLU CA C 4.230 -0.359 -2.016 1.00 . A A . 22 GLU CA 1 1 7 3931 1 1 22 GLU CB C 3.379 -1.193 -1.026 1.00 . A A . 22 GLU CB 1 1 7 3932 1 1 22 GLU CD C 1.611 0.480 -0.395 1.00 . A A . 22 GLU CD 1 1 7 3933 1 1 22 GLU CG C 2.841 -0.292 0.106 1.00 . A A . 22 GLU CG 1 1 7 3934 1 1 22 GLU H H 2.371 0.147 -3.049 1.00 . A A . 22 GLU H 1 1 7 3935 1 1 22 GLU HA H 4.752 0.446 -1.518 1.00 . A A . 22 GLU HA 1 1 7 3936 1 1 22 GLU HB2 H 2.557 -1.663 -1.544 1.00 . A A . 22 GLU HB2 1 1 7 3937 1 1 22 GLU HB3 H 3.988 -1.970 -0.586 1.00 . A A . 22 GLU HB3 1 1 7 3938 1 1 22 GLU HG2 H 2.553 -0.901 0.951 1.00 . A A . 22 GLU HG2 1 1 7 3939 1 1 22 GLU HG3 H 3.597 0.408 0.434 1.00 . A A . 22 GLU HG3 1 1 7 3940 1 1 22 GLU N N 3.343 0.232 -3.077 1.00 . A A . 22 GLU N 1 1 7 3941 1 1 22 GLU O O 6.465 -1.139 -2.442 1.00 . A A . 22 GLU O 1 1 7 3942 1 1 22 GLU OE1 O 0.537 -0.094 -0.299 1.00 . A A . 22 GLU OE1 1 1 7 3943 1 1 22 GLU OE2 O 1.811 1.596 -0.848 1.00 . A A . 22 GLU OE2 1 1 7 3944 1 1 23 ASP C C 6.819 -2.296 -4.948 1.00 . A A . 23 ASP C 1 1 7 3945 1 1 23 ASP CA C 5.701 -3.094 -4.254 1.00 . A A . 23 ASP CA 1 1 7 3946 1 1 23 ASP CB C 4.875 -3.855 -5.300 1.00 . A A . 23 ASP CB 1 1 7 3947 1 1 23 ASP CG C 5.625 -5.131 -5.714 1.00 . A A . 23 ASP CG 1 1 7 3948 1 1 23 ASP H H 3.826 -2.188 -3.666 1.00 . A A . 23 ASP H 1 1 7 3949 1 1 23 ASP HA H 6.141 -3.773 -3.541 1.00 . A A . 23 ASP HA 1 1 7 3950 1 1 23 ASP HB2 H 3.905 -4.109 -4.902 1.00 . A A . 23 ASP HB2 1 1 7 3951 1 1 23 ASP HB3 H 4.717 -3.239 -6.173 1.00 . A A . 23 ASP HB3 1 1 7 3952 1 1 23 ASP N N 4.794 -2.149 -3.524 1.00 . A A . 23 ASP N 1 1 7 3953 1 1 23 ASP O O 7.999 -2.553 -4.812 1.00 . A A . 23 ASP O 1 1 7 3954 1 1 23 ASP OD1 O 6.509 -4.992 -6.544 1.00 . A A . 23 ASP OD1 1 1 7 3955 1 1 23 ASP OD2 O 5.274 -6.170 -5.178 1.00 . A A . 23 ASP OD2 1 1 7 3956 1 1 24 VAL C C 8.277 0.240 -5.551 1.00 . A A . 24 VAL C 1 1 7 3957 1 1 24 VAL CA C 7.224 -0.400 -6.460 1.00 . A A . 24 VAL CA 1 1 7 3958 1 1 24 VAL CB C 6.293 0.655 -7.099 1.00 . A A . 24 VAL CB 1 1 7 3959 1 1 24 VAL CG1 C 7.063 1.588 -8.026 1.00 . A A . 24 VAL CG1 1 1 7 3960 1 1 24 VAL CG2 C 5.185 -0.053 -7.907 1.00 . A A . 24 VAL CG2 1 1 7 3961 1 1 24 VAL H H 5.383 -1.204 -5.726 1.00 . A A . 24 VAL H 1 1 7 3962 1 1 24 VAL HA H 7.733 -0.967 -7.224 1.00 . A A . 24 VAL HA 1 1 7 3963 1 1 24 VAL HB H 5.838 1.257 -6.330 1.00 . A A . 24 VAL HB 1 1 7 3964 1 1 24 VAL HG11 H 7.832 2.100 -7.471 1.00 . A A . 24 VAL HG11 1 1 7 3965 1 1 24 VAL HG12 H 7.509 1.025 -8.830 1.00 . A A . 24 VAL HG12 1 1 7 3966 1 1 24 VAL HG13 H 6.379 2.319 -8.433 1.00 . A A . 24 VAL HG13 1 1 7 3967 1 1 24 VAL HG21 H 5.134 -1.107 -7.674 1.00 . A A . 24 VAL HG21 1 1 7 3968 1 1 24 VAL HG22 H 4.237 0.397 -7.661 1.00 . A A . 24 VAL HG22 1 1 7 3969 1 1 24 VAL HG23 H 5.359 0.047 -8.967 1.00 . A A . 24 VAL HG23 1 1 7 3970 1 1 24 VAL N N 6.352 -1.324 -5.683 1.00 . A A . 24 VAL N 1 1 7 3971 1 1 24 VAL O O 9.443 0.249 -5.876 1.00 . A A . 24 VAL O 1 1 7 3972 1 1 25 GLY C C 9.947 0.562 -3.136 1.00 . A A . 25 GLY C 1 1 7 3973 1 1 25 GLY CA C 8.711 1.418 -3.429 1.00 . A A . 25 GLY CA 1 1 7 3974 1 1 25 GLY H H 6.867 0.693 -4.281 1.00 . A A . 25 GLY H 1 1 7 3975 1 1 25 GLY HA2 H 9.019 2.381 -3.807 1.00 . A A . 25 GLY HA2 1 1 7 3976 1 1 25 GLY HA3 H 8.154 1.556 -2.514 1.00 . A A . 25 GLY HA3 1 1 7 3977 1 1 25 GLY N N 7.825 0.752 -4.438 1.00 . A A . 25 GLY N 1 1 7 3978 1 1 25 GLY O O 11.066 1.035 -3.182 1.00 . A A . 25 GLY O 1 1 7 3979 1 1 26 SER C C 11.908 -1.543 -3.582 1.00 . A A . 26 SER C 1 1 7 3980 1 1 26 SER CA C 10.783 -1.666 -2.532 1.00 . A A . 26 SER CA 1 1 7 3981 1 1 26 SER CB C 10.207 -3.101 -2.550 1.00 . A A . 26 SER CB 1 1 7 3982 1 1 26 SER H H 8.744 -0.964 -2.826 1.00 . A A . 26 SER H 1 1 7 3983 1 1 26 SER HA H 11.186 -1.440 -1.558 1.00 . A A . 26 SER HA 1 1 7 3984 1 1 26 SER HB2 H 10.072 -3.473 -3.555 1.00 . A A . 26 SER HB2 1 1 7 3985 1 1 26 SER HB3 H 10.832 -3.779 -1.988 1.00 . A A . 26 SER HB3 1 1 7 3986 1 1 26 SER HG H 8.263 -3.199 -2.566 1.00 . A A . 26 SER HG 1 1 7 3987 1 1 26 SER N N 9.685 -0.687 -2.842 1.00 . A A . 26 SER N 1 1 7 3988 1 1 26 SER O O 13.062 -1.315 -3.272 1.00 . A A . 26 SER O 1 1 7 3989 1 1 26 SER OG O 8.939 -2.998 -1.914 1.00 . A A . 26 SER OG 1 1 7 3990 1 1 27 ASN C C 13.068 -0.226 -6.088 1.00 . A A . 27 ASN C 1 1 7 3991 1 1 27 ASN CA C 12.434 -1.612 -5.978 1.00 . A A . 27 ASN CA 1 1 7 3992 1 1 27 ASN CB C 11.634 -1.930 -7.248 1.00 . A A . 27 ASN CB 1 1 7 3993 1 1 27 ASN CG C 11.910 -3.374 -7.676 1.00 . A A . 27 ASN CG 1 1 7 3994 1 1 27 ASN H H 10.549 -1.877 -4.957 1.00 . A A . 27 ASN H 1 1 7 3995 1 1 27 ASN HA H 13.239 -2.309 -5.810 1.00 . A A . 27 ASN HA 1 1 7 3996 1 1 27 ASN HB2 H 10.577 -1.819 -7.052 1.00 . A A . 27 ASN HB2 1 1 7 3997 1 1 27 ASN HB3 H 11.894 -1.258 -8.051 1.00 . A A . 27 ASN HB3 1 1 7 3998 1 1 27 ASN HD21 H 13.445 -2.872 -8.831 1.00 . A A . 27 ASN HD21 1 1 7 3999 1 1 27 ASN HD22 H 13.085 -4.529 -8.782 1.00 . A A . 27 ASN HD22 1 1 7 4000 1 1 27 ASN N N 11.499 -1.697 -4.812 1.00 . A A . 27 ASN N 1 1 7 4001 1 1 27 ASN ND2 N 12.895 -3.612 -8.498 1.00 . A A . 27 ASN ND2 1 1 7 4002 1 1 27 ASN O O 14.265 -0.089 -6.233 1.00 . A A . 27 ASN O 1 1 7 4003 1 1 27 ASN OD1 O 11.235 -4.297 -7.267 1.00 . A A . 27 ASN OD1 1 1 7 4004 1 1 28 LYS C C 13.849 2.449 -5.225 1.00 . A A . 28 LYS C 1 1 7 4005 1 1 28 LYS CA C 12.615 2.198 -6.099 1.00 . A A . 28 LYS CA 1 1 7 4006 1 1 28 LYS CB C 11.418 3.037 -5.622 1.00 . A A . 28 LYS CB 1 1 7 4007 1 1 28 LYS CD C 9.392 4.299 -6.438 1.00 . A A . 28 LYS CD 1 1 7 4008 1 1 28 LYS CE C 9.390 5.428 -5.391 1.00 . A A . 28 LYS CE 1 1 7 4009 1 1 28 LYS CG C 10.843 3.886 -6.778 1.00 . A A . 28 LYS CG 1 1 7 4010 1 1 28 LYS H H 11.278 0.539 -5.913 1.00 . A A . 28 LYS H 1 1 7 4011 1 1 28 LYS HA H 12.870 2.435 -7.126 1.00 . A A . 28 LYS HA 1 1 7 4012 1 1 28 LYS HB2 H 10.652 2.366 -5.267 1.00 . A A . 28 LYS HB2 1 1 7 4013 1 1 28 LYS HB3 H 11.714 3.677 -4.806 1.00 . A A . 28 LYS HB3 1 1 7 4014 1 1 28 LYS HD2 H 8.898 4.642 -7.336 1.00 . A A . 28 LYS HD2 1 1 7 4015 1 1 28 LYS HD3 H 8.845 3.451 -6.053 1.00 . A A . 28 LYS HD3 1 1 7 4016 1 1 28 LYS HE2 H 9.989 5.157 -4.532 1.00 . A A . 28 LYS HE2 1 1 7 4017 1 1 28 LYS HE3 H 9.783 6.339 -5.820 1.00 . A A . 28 LYS HE3 1 1 7 4018 1 1 28 LYS HG2 H 11.456 4.762 -6.931 1.00 . A A . 28 LYS HG2 1 1 7 4019 1 1 28 LYS HG3 H 10.837 3.307 -7.692 1.00 . A A . 28 LYS HG3 1 1 7 4020 1 1 28 LYS HZ1 H 7.341 5.042 -5.417 1.00 . A A . 28 LYS HZ1 1 1 7 4021 1 1 28 LYS HZ2 H 7.938 5.522 -3.902 1.00 . A A . 28 LYS HZ2 1 1 7 4022 1 1 28 LYS HZ3 H 7.737 6.669 -5.137 1.00 . A A . 28 LYS HZ3 1 1 7 4023 1 1 28 LYS N N 12.218 0.760 -6.018 1.00 . A A . 28 LYS N 1 1 7 4024 1 1 28 LYS NZ N 7.997 5.684 -4.927 1.00 . A A . 28 LYS NZ 1 1 7 4025 1 1 28 LYS O O 14.785 3.069 -5.673 1.00 . A A . 28 LYS O 1 1 7 4026 1 1 29 GLY C C 16.295 1.761 -3.799 1.00 . A A . 29 GLY C 1 1 7 4027 1 1 29 GLY CA C 14.990 2.152 -3.088 1.00 . A A . 29 GLY CA 1 1 7 4028 1 1 29 GLY H H 13.035 1.473 -3.709 1.00 . A A . 29 GLY H 1 1 7 4029 1 1 29 GLY HA2 H 15.039 3.187 -2.784 1.00 . A A . 29 GLY HA2 1 1 7 4030 1 1 29 GLY HA3 H 14.858 1.525 -2.218 1.00 . A A . 29 GLY HA3 1 1 7 4031 1 1 29 GLY N N 13.826 1.961 -4.010 1.00 . A A . 29 GLY N 1 1 7 4032 1 1 29 GLY O O 17.222 2.545 -3.895 1.00 . A A . 29 GLY O 1 1 7 4033 1 1 30 ALA C C 17.830 0.912 -6.265 1.00 . A A . 30 ALA C 1 1 7 4034 1 1 30 ALA CA C 17.550 0.067 -5.012 1.00 . A A . 30 ALA CA 1 1 7 4035 1 1 30 ALA CB C 17.345 -1.402 -5.406 1.00 . A A . 30 ALA CB 1 1 7 4036 1 1 30 ALA H H 15.526 -0.025 -4.200 1.00 . A A . 30 ALA H 1 1 7 4037 1 1 30 ALA HA H 18.395 0.167 -4.345 1.00 . A A . 30 ALA HA 1 1 7 4038 1 1 30 ALA HB1 H 17.124 -1.991 -4.528 1.00 . A A . 30 ALA HB1 1 1 7 4039 1 1 30 ALA HB2 H 16.524 -1.496 -6.102 1.00 . A A . 30 ALA HB2 1 1 7 4040 1 1 30 ALA HB3 H 18.241 -1.792 -5.867 1.00 . A A . 30 ALA HB3 1 1 7 4041 1 1 30 ALA N N 16.319 0.550 -4.298 1.00 . A A . 30 ALA N 1 1 7 4042 1 1 30 ALA O O 18.937 1.349 -6.502 1.00 . A A . 30 ALA O 1 1 7 4043 1 1 31 ILE C C 17.559 3.251 -8.036 1.00 . A A . 31 ILE C 1 1 7 4044 1 1 31 ILE CA C 16.854 1.910 -8.294 1.00 . A A . 31 ILE CA 1 1 7 4045 1 1 31 ILE CB C 15.378 2.049 -8.756 1.00 . A A . 31 ILE CB 1 1 7 4046 1 1 31 ILE CD1 C 13.440 0.671 -9.701 1.00 . A A . 31 ILE CD1 1 1 7 4047 1 1 31 ILE CG1 C 14.945 0.685 -9.367 1.00 . A A . 31 ILE CG1 1 1 7 4048 1 1 31 ILE CG2 C 15.177 3.199 -9.758 1.00 . A A . 31 ILE CG2 1 1 7 4049 1 1 31 ILE H H 15.937 0.728 -6.769 1.00 . A A . 31 ILE H 1 1 7 4050 1 1 31 ILE HA H 17.443 1.361 -9.014 1.00 . A A . 31 ILE HA 1 1 7 4051 1 1 31 ILE HB H 14.766 2.249 -7.895 1.00 . A A . 31 ILE HB 1 1 7 4052 1 1 31 ILE HD11 H 12.863 1.063 -8.877 1.00 . A A . 31 ILE HD11 1 1 7 4053 1 1 31 ILE HD12 H 13.244 1.264 -10.582 1.00 . A A . 31 ILE HD12 1 1 7 4054 1 1 31 ILE HD13 H 13.122 -0.343 -9.893 1.00 . A A . 31 ILE HD13 1 1 7 4055 1 1 31 ILE HG12 H 15.526 0.487 -10.253 1.00 . A A . 31 ILE HG12 1 1 7 4056 1 1 31 ILE HG13 H 15.144 -0.106 -8.659 1.00 . A A . 31 ILE HG13 1 1 7 4057 1 1 31 ILE HG21 H 15.781 3.047 -10.639 1.00 . A A . 31 ILE HG21 1 1 7 4058 1 1 31 ILE HG22 H 14.136 3.254 -10.045 1.00 . A A . 31 ILE HG22 1 1 7 4059 1 1 31 ILE HG23 H 15.444 4.139 -9.296 1.00 . A A . 31 ILE HG23 1 1 7 4060 1 1 31 ILE N N 16.793 1.114 -7.032 1.00 . A A . 31 ILE N 1 1 7 4061 1 1 31 ILE O O 18.465 3.629 -8.751 1.00 . A A . 31 ILE O 1 1 7 4062 1 1 32 ILE C C 19.208 5.026 -6.391 1.00 . A A . 32 ILE C 1 1 7 4063 1 1 32 ILE CA C 17.717 5.246 -6.643 1.00 . A A . 32 ILE CA 1 1 7 4064 1 1 32 ILE CB C 16.989 5.768 -5.381 1.00 . A A . 32 ILE CB 1 1 7 4065 1 1 32 ILE CD1 C 14.623 6.051 -4.497 1.00 . A A . 32 ILE CD1 1 1 7 4066 1 1 32 ILE CG1 C 15.505 6.037 -5.759 1.00 . A A . 32 ILE CG1 1 1 7 4067 1 1 32 ILE CG2 C 17.645 7.086 -4.902 1.00 . A A . 32 ILE CG2 1 1 7 4068 1 1 32 ILE H H 16.380 3.582 -6.485 1.00 . A A . 32 ILE H 1 1 7 4069 1 1 32 ILE HA H 17.602 5.921 -7.474 1.00 . A A . 32 ILE HA 1 1 7 4070 1 1 32 ILE HB H 17.047 5.028 -4.596 1.00 . A A . 32 ILE HB 1 1 7 4071 1 1 32 ILE HD11 H 14.854 5.207 -3.865 1.00 . A A . 32 ILE HD11 1 1 7 4072 1 1 32 ILE HD12 H 14.782 6.961 -3.940 1.00 . A A . 32 ILE HD12 1 1 7 4073 1 1 32 ILE HD13 H 13.582 5.994 -4.780 1.00 . A A . 32 ILE HD13 1 1 7 4074 1 1 32 ILE HG12 H 15.426 6.979 -6.276 1.00 . A A . 32 ILE HG12 1 1 7 4075 1 1 32 ILE HG13 H 15.146 5.272 -6.428 1.00 . A A . 32 ILE HG13 1 1 7 4076 1 1 32 ILE HG21 H 17.731 7.785 -5.721 1.00 . A A . 32 ILE HG21 1 1 7 4077 1 1 32 ILE HG22 H 17.054 7.539 -4.119 1.00 . A A . 32 ILE HG22 1 1 7 4078 1 1 32 ILE HG23 H 18.633 6.888 -4.511 1.00 . A A . 32 ILE HG23 1 1 7 4079 1 1 32 ILE N N 17.119 3.933 -7.012 1.00 . A A . 32 ILE N 1 1 7 4080 1 1 32 ILE O O 20.031 5.713 -6.958 1.00 . A A . 32 ILE O 1 1 7 4081 1 1 33 GLY C C 21.767 3.624 -6.542 1.00 . A A . 33 GLY C 1 1 7 4082 1 1 33 GLY CA C 20.949 3.770 -5.245 1.00 . A A . 33 GLY CA 1 1 7 4083 1 1 33 GLY H H 18.796 3.552 -5.137 1.00 . A A . 33 GLY H 1 1 7 4084 1 1 33 GLY HA2 H 21.358 4.580 -4.657 1.00 . A A . 33 GLY HA2 1 1 7 4085 1 1 33 GLY HA3 H 21.007 2.849 -4.685 1.00 . A A . 33 GLY HA3 1 1 7 4086 1 1 33 GLY N N 19.515 4.068 -5.556 1.00 . A A . 33 GLY N 1 1 7 4087 1 1 33 GLY O O 22.880 4.105 -6.627 1.00 . A A . 33 GLY O 1 1 7 4088 1 1 34 LEU C C 22.048 4.045 -9.623 1.00 . A A . 34 LEU C 1 1 7 4089 1 1 34 LEU CA C 21.854 2.751 -8.822 1.00 . A A . 34 LEU CA 1 1 7 4090 1 1 34 LEU CB C 21.016 1.741 -9.645 1.00 . A A . 34 LEU CB 1 1 7 4091 1 1 34 LEU CD1 C 19.882 -0.500 -9.289 1.00 . A A . 34 LEU CD1 1 1 7 4092 1 1 34 LEU CD2 C 22.359 -0.406 -9.729 1.00 . A A . 34 LEU CD2 1 1 7 4093 1 1 34 LEU CG C 21.172 0.313 -9.047 1.00 . A A . 34 LEU CG 1 1 7 4094 1 1 34 LEU H H 20.283 2.599 -7.360 1.00 . A A . 34 LEU H 1 1 7 4095 1 1 34 LEU HA H 22.836 2.353 -8.626 1.00 . A A . 34 LEU HA 1 1 7 4096 1 1 34 LEU HB2 H 19.978 2.033 -9.624 1.00 . A A . 34 LEU HB2 1 1 7 4097 1 1 34 LEU HB3 H 21.342 1.748 -10.676 1.00 . A A . 34 LEU HB3 1 1 7 4098 1 1 34 LEU HD11 H 19.594 -0.455 -10.329 1.00 . A A . 34 LEU HD11 1 1 7 4099 1 1 34 LEU HD12 H 20.037 -1.534 -9.016 1.00 . A A . 34 LEU HD12 1 1 7 4100 1 1 34 LEU HD13 H 19.079 -0.104 -8.686 1.00 . A A . 34 LEU HD13 1 1 7 4101 1 1 34 LEU HD21 H 23.212 0.252 -9.791 1.00 . A A . 34 LEU HD21 1 1 7 4102 1 1 34 LEU HD22 H 22.638 -1.278 -9.157 1.00 . A A . 34 LEU HD22 1 1 7 4103 1 1 34 LEU HD23 H 22.090 -0.717 -10.728 1.00 . A A . 34 LEU HD23 1 1 7 4104 1 1 34 LEU HG H 21.346 0.369 -7.983 1.00 . A A . 34 LEU HG 1 1 7 4105 1 1 34 LEU N N 21.179 2.965 -7.508 1.00 . A A . 34 LEU N 1 1 7 4106 1 1 34 LEU O O 23.161 4.333 -10.021 1.00 . A A . 34 LEU O 1 1 7 4107 1 1 35 MET C C 22.100 7.030 -9.918 1.00 . A A . 35 MET C 1 1 7 4108 1 1 35 MET CA C 21.137 6.066 -10.626 1.00 . A A . 35 MET CA 1 1 7 4109 1 1 35 MET CB C 19.741 6.742 -10.812 1.00 . A A . 35 MET CB 1 1 7 4110 1 1 35 MET CE C 17.749 9.232 -8.607 1.00 . A A . 35 MET CE 1 1 7 4111 1 1 35 MET CG C 19.006 6.953 -9.489 1.00 . A A . 35 MET CG 1 1 7 4112 1 1 35 MET H H 20.119 4.502 -9.491 1.00 . A A . 35 MET H 1 1 7 4113 1 1 35 MET HA H 21.550 5.823 -11.592 1.00 . A A . 35 MET HA 1 1 7 4114 1 1 35 MET HB2 H 19.865 7.699 -11.297 1.00 . A A . 35 MET HB2 1 1 7 4115 1 1 35 MET HB3 H 19.131 6.118 -11.448 1.00 . A A . 35 MET HB3 1 1 7 4116 1 1 35 MET HE1 H 18.549 9.777 -9.087 1.00 . A A . 35 MET HE1 1 1 7 4117 1 1 35 MET HE2 H 16.868 9.855 -8.556 1.00 . A A . 35 MET HE2 1 1 7 4118 1 1 35 MET HE3 H 18.051 8.957 -7.607 1.00 . A A . 35 MET HE3 1 1 7 4119 1 1 35 MET HG2 H 18.868 5.981 -9.054 1.00 . A A . 35 MET HG2 1 1 7 4120 1 1 35 MET HG3 H 19.630 7.530 -8.825 1.00 . A A . 35 MET HG3 1 1 7 4121 1 1 35 MET N N 20.988 4.789 -9.843 1.00 . A A . 35 MET N 1 1 7 4122 1 1 35 MET O O 22.846 7.743 -10.559 1.00 . A A . 35 MET O 1 1 7 4123 1 1 35 MET SD S 17.376 7.739 -9.563 1.00 . A A . 35 MET SD 1 1 7 4124 1 1 36 VAL C C 24.382 7.472 -8.019 1.00 . A A . 36 VAL C 1 1 7 4125 1 1 36 VAL CA C 22.919 7.883 -7.773 1.00 . A A . 36 VAL CA 1 1 7 4126 1 1 36 VAL CB C 22.512 7.685 -6.280 1.00 . A A . 36 VAL CB 1 1 7 4127 1 1 36 VAL CG1 C 23.592 8.253 -5.327 1.00 . A A . 36 VAL CG1 1 1 7 4128 1 1 36 VAL CG2 C 21.180 8.424 -6.015 1.00 . A A . 36 VAL CG2 1 1 7 4129 1 1 36 VAL H H 21.408 6.422 -8.164 1.00 . A A . 36 VAL H 1 1 7 4130 1 1 36 VAL HA H 22.784 8.912 -8.074 1.00 . A A . 36 VAL HA 1 1 7 4131 1 1 36 VAL HB H 22.379 6.631 -6.073 1.00 . A A . 36 VAL HB 1 1 7 4132 1 1 36 VAL HG11 H 23.886 9.246 -5.637 1.00 . A A . 36 VAL HG11 1 1 7 4133 1 1 36 VAL HG12 H 23.210 8.303 -4.318 1.00 . A A . 36 VAL HG12 1 1 7 4134 1 1 36 VAL HG13 H 24.464 7.616 -5.330 1.00 . A A . 36 VAL HG13 1 1 7 4135 1 1 36 VAL HG21 H 20.457 8.192 -6.781 1.00 . A A . 36 VAL HG21 1 1 7 4136 1 1 36 VAL HG22 H 20.777 8.123 -5.059 1.00 . A A . 36 VAL HG22 1 1 7 4137 1 1 36 VAL HG23 H 21.338 9.493 -6.004 1.00 . A A . 36 VAL HG23 1 1 7 4138 1 1 36 VAL N N 22.044 7.012 -8.610 1.00 . A A . 36 VAL N 1 1 7 4139 1 1 36 VAL O O 25.215 8.314 -8.296 1.00 . A A . 36 VAL O 1 1 7 4140 1 1 37 GLY C C 26.645 5.301 -6.777 1.00 . A A . 37 GLY C 1 1 7 4141 1 1 37 GLY CA C 26.016 5.654 -8.126 1.00 . A A . 37 GLY CA 1 1 7 4142 1 1 37 GLY H H 23.925 5.560 -7.678 1.00 . A A . 37 GLY H 1 1 7 4143 1 1 37 GLY HA2 H 25.954 4.760 -8.730 1.00 . A A . 37 GLY HA2 1 1 7 4144 1 1 37 GLY HA3 H 26.629 6.385 -8.632 1.00 . A A . 37 GLY HA3 1 1 7 4145 1 1 37 GLY N N 24.638 6.191 -7.911 1.00 . A A . 37 GLY N 1 1 7 4146 1 1 37 GLY O O 27.812 5.553 -6.552 1.00 . A A . 37 GLY O 1 1 7 4147 1 1 38 GLY C C 25.852 2.872 -4.292 1.00 . A A . 38 GLY C 1 1 7 4148 1 1 38 GLY CA C 26.287 4.315 -4.560 1.00 . A A . 38 GLY CA 1 1 7 4149 1 1 38 GLY H H 24.904 4.558 -6.186 1.00 . A A . 38 GLY H 1 1 7 4150 1 1 38 GLY HA2 H 27.362 4.381 -4.486 1.00 . A A . 38 GLY HA2 1 1 7 4151 1 1 38 GLY HA3 H 25.832 4.965 -3.827 1.00 . A A . 38 GLY HA3 1 1 7 4152 1 1 38 GLY N N 25.832 4.726 -5.926 1.00 . A A . 38 GLY N 1 1 7 4153 1 1 38 GLY O O 26.538 2.138 -3.608 1.00 . A A . 38 GLY O 1 1 7 4154 1 1 39 VAL C C 24.203 0.631 -3.289 1.00 . A A . 39 VAL C 1 1 7 4155 1 1 39 VAL CA C 24.097 1.172 -4.733 1.00 . A A . 39 VAL CA 1 1 7 4156 1 1 39 VAL CB C 24.830 0.310 -5.795 1.00 . A A . 39 VAL CB 1 1 7 4157 1 1 39 VAL CG1 C 24.440 -1.192 -5.730 1.00 . A A . 39 VAL CG1 1 1 7 4158 1 1 39 VAL CG2 C 24.480 0.846 -7.199 1.00 . A A . 39 VAL CG2 1 1 7 4159 1 1 39 VAL H H 24.250 3.187 -5.397 1.00 . A A . 39 VAL H 1 1 7 4160 1 1 39 VAL HA H 23.050 1.257 -4.985 1.00 . A A . 39 VAL HA 1 1 7 4161 1 1 39 VAL HB H 25.882 0.471 -5.642 1.00 . A A . 39 VAL HB 1 1 7 4162 1 1 39 VAL HG11 H 23.438 -1.307 -5.343 1.00 . A A . 39 VAL HG11 1 1 7 4163 1 1 39 VAL HG12 H 24.484 -1.644 -6.710 1.00 . A A . 39 VAL HG12 1 1 7 4164 1 1 39 VAL HG13 H 25.126 -1.722 -5.085 1.00 . A A . 39 VAL HG13 1 1 7 4165 1 1 39 VAL HG21 H 24.757 1.887 -7.290 1.00 . A A . 39 VAL HG21 1 1 7 4166 1 1 39 VAL HG22 H 25.005 0.285 -7.957 1.00 . A A . 39 VAL HG22 1 1 7 4167 1 1 39 VAL HG23 H 23.419 0.750 -7.364 1.00 . A A . 39 VAL HG23 1 1 7 4168 1 1 39 VAL N N 24.718 2.529 -4.857 1.00 . A A . 39 VAL N 1 1 7 4169 1 1 39 VAL O O 24.388 -0.546 -3.044 1.00 . A A . 39 VAL O 1 1 7 4170 1 1 40 VAL C C 22.881 0.417 -0.501 1.00 . A A . 40 VAL C 1 1 7 4171 1 1 40 VAL CA C 24.150 1.188 -0.916 1.00 . A A . 40 VAL CA 1 1 7 4172 1 1 40 VAL CB C 24.291 2.493 -0.082 1.00 . A A . 40 VAL CB 1 1 7 4173 1 1 40 VAL CG1 C 24.564 2.133 1.397 1.00 . A A . 40 VAL CG1 1 1 7 4174 1 1 40 VAL CG2 C 25.473 3.334 -0.621 1.00 . A A . 40 VAL CG2 1 1 7 4175 1 1 40 VAL H H 23.925 2.478 -2.635 1.00 . A A . 40 VAL H 1 1 7 4176 1 1 40 VAL HA H 25.019 0.561 -0.764 1.00 . A A . 40 VAL HA 1 1 7 4177 1 1 40 VAL HB H 23.381 3.073 -0.150 1.00 . A A . 40 VAL HB 1 1 7 4178 1 1 40 VAL HG11 H 25.421 1.478 1.475 1.00 . A A . 40 VAL HG11 1 1 7 4179 1 1 40 VAL HG12 H 24.759 3.028 1.969 1.00 . A A . 40 VAL HG12 1 1 7 4180 1 1 40 VAL HG13 H 23.706 1.634 1.825 1.00 . A A . 40 VAL HG13 1 1 7 4181 1 1 40 VAL HG21 H 26.351 2.716 -0.748 1.00 . A A . 40 VAL HG21 1 1 7 4182 1 1 40 VAL HG22 H 25.213 3.766 -1.576 1.00 . A A . 40 VAL HG22 1 1 7 4183 1 1 40 VAL HG23 H 25.708 4.134 0.064 1.00 . A A . 40 VAL HG23 1 1 7 4184 1 1 40 VAL N N 24.073 1.547 -2.365 1.00 . A A . 40 VAL N 1 1 7 4185 1 1 40 VAL O O 23.055 -0.609 0.136 1.00 . A A . 40 VAL O 1 1 7 4186 1 1 40 VAL OXT O 21.811 0.894 -0.845 1.00 . A A . 40 VAL OXT 1 1 8 4187 1 1 1 ASP C C -12.847 -11.804 -24.274 1.00 . A A . 1 ASP C 1 1 8 4188 1 1 1 ASP CA C -13.834 -12.519 -25.207 1.00 . A A . 1 ASP CA 1 1 8 4189 1 1 1 ASP CB C -14.813 -13.354 -24.351 1.00 . A A . 1 ASP CB 1 1 8 4190 1 1 1 ASP CG C -14.094 -14.590 -23.774 1.00 . A A . 1 ASP CG 1 1 8 4191 1 1 1 ASP H1 H -12.082 -13.341 -25.992 1.00 . A A . 1 ASP H1 1 1 8 4192 1 1 1 ASP H2 H -13.419 -14.383 -26.048 1.00 . A A . 1 ASP H2 1 1 8 4193 1 1 1 ASP H3 H -13.304 -13.090 -27.142 1.00 . A A . 1 ASP H3 1 1 8 4194 1 1 1 ASP HA H -14.382 -11.777 -25.770 1.00 . A A . 1 ASP HA 1 1 8 4195 1 1 1 ASP HB2 H -15.200 -12.760 -23.536 1.00 . A A . 1 ASP HB2 1 1 8 4196 1 1 1 ASP HB3 H -15.644 -13.677 -24.963 1.00 . A A . 1 ASP HB3 1 1 8 4197 1 1 1 ASP N N -13.105 -13.399 -26.170 1.00 . A A . 1 ASP N 1 1 8 4198 1 1 1 ASP O O -11.733 -12.254 -24.086 1.00 . A A . 1 ASP O 1 1 8 4199 1 1 1 ASP OD1 O -13.341 -14.397 -22.835 1.00 . A A . 1 ASP OD1 1 1 8 4200 1 1 1 ASP OD2 O -14.339 -15.659 -24.308 1.00 . A A . 1 ASP OD2 1 1 8 4201 1 1 2 ALA C C -12.655 -10.371 -21.334 1.00 . A A . 2 ALA C 1 1 8 4202 1 1 2 ALA CA C -12.438 -9.911 -22.784 1.00 . A A . 2 ALA CA 1 1 8 4203 1 1 2 ALA CB C -12.802 -8.433 -22.948 1.00 . A A . 2 ALA CB 1 1 8 4204 1 1 2 ALA H H -14.207 -10.403 -23.909 1.00 . A A . 2 ALA H 1 1 8 4205 1 1 2 ALA HA H -11.400 -10.059 -23.044 1.00 . A A . 2 ALA HA 1 1 8 4206 1 1 2 ALA HB1 H -13.863 -8.295 -22.804 1.00 . A A . 2 ALA HB1 1 1 8 4207 1 1 2 ALA HB2 H -12.267 -7.839 -22.221 1.00 . A A . 2 ALA HB2 1 1 8 4208 1 1 2 ALA HB3 H -12.531 -8.099 -23.938 1.00 . A A . 2 ALA HB3 1 1 8 4209 1 1 2 ALA N N -13.295 -10.708 -23.714 1.00 . A A . 2 ALA N 1 1 8 4210 1 1 2 ALA O O -13.279 -9.696 -20.536 1.00 . A A . 2 ALA O 1 1 8 4211 1 1 3 GLU C C -10.834 -12.565 -19.196 1.00 . A A . 3 GLU C 1 1 8 4212 1 1 3 GLU CA C -12.228 -12.134 -19.683 1.00 . A A . 3 GLU CA 1 1 8 4213 1 1 3 GLU CB C -13.183 -13.350 -19.755 1.00 . A A . 3 GLU CB 1 1 8 4214 1 1 3 GLU CD C -15.536 -14.096 -20.304 1.00 . A A . 3 GLU CD 1 1 8 4215 1 1 3 GLU CG C -14.585 -12.887 -20.212 1.00 . A A . 3 GLU CG 1 1 8 4216 1 1 3 GLU H H -11.631 -12.004 -21.757 1.00 . A A . 3 GLU H 1 1 8 4217 1 1 3 GLU HA H -12.614 -11.402 -18.988 1.00 . A A . 3 GLU HA 1 1 8 4218 1 1 3 GLU HB2 H -12.788 -14.087 -20.435 1.00 . A A . 3 GLU HB2 1 1 8 4219 1 1 3 GLU HB3 H -13.260 -13.799 -18.776 1.00 . A A . 3 GLU HB3 1 1 8 4220 1 1 3 GLU HG2 H -14.991 -12.183 -19.500 1.00 . A A . 3 GLU HG2 1 1 8 4221 1 1 3 GLU HG3 H -14.528 -12.404 -21.177 1.00 . A A . 3 GLU HG3 1 1 8 4222 1 1 3 GLU N N -12.116 -11.529 -21.051 1.00 . A A . 3 GLU N 1 1 8 4223 1 1 3 GLU O O -10.637 -13.665 -18.712 1.00 . A A . 3 GLU O 1 1 8 4224 1 1 3 GLU OE1 O -15.798 -14.668 -19.256 1.00 . A A . 3 GLU OE1 1 1 8 4225 1 1 3 GLU OE2 O -15.951 -14.385 -21.414 1.00 . A A . 3 GLU OE2 1 1 8 4226 1 1 4 PHE C C -8.316 -11.333 -17.511 1.00 . A A . 4 PHE C 1 1 8 4227 1 1 4 PHE CA C -8.490 -11.905 -18.924 1.00 . A A . 4 PHE CA 1 1 8 4228 1 1 4 PHE CB C -7.519 -11.215 -19.947 1.00 . A A . 4 PHE CB 1 1 8 4229 1 1 4 PHE CD1 C -8.532 -8.874 -20.027 1.00 . A A . 4 PHE CD1 1 1 8 4230 1 1 4 PHE CD2 C -8.431 -10.125 -22.053 1.00 . A A . 4 PHE CD2 1 1 8 4231 1 1 4 PHE CE1 C -9.122 -7.828 -20.703 1.00 . A A . 4 PHE CE1 1 1 8 4232 1 1 4 PHE CE2 C -9.022 -9.078 -22.728 1.00 . A A . 4 PHE CE2 1 1 8 4233 1 1 4 PHE CG C -8.181 -10.035 -20.694 1.00 . A A . 4 PHE CG 1 1 8 4234 1 1 4 PHE CZ C -9.368 -7.928 -22.054 1.00 . A A . 4 PHE CZ 1 1 8 4235 1 1 4 PHE H H -10.142 -10.794 -19.735 1.00 . A A . 4 PHE H 1 1 8 4236 1 1 4 PHE HA H -8.298 -12.968 -18.899 1.00 . A A . 4 PHE HA 1 1 8 4237 1 1 4 PHE HB2 H -6.628 -10.855 -19.454 1.00 . A A . 4 PHE HB2 1 1 8 4238 1 1 4 PHE HB3 H -7.212 -11.952 -20.675 1.00 . A A . 4 PHE HB3 1 1 8 4239 1 1 4 PHE HD1 H -8.345 -8.778 -18.969 1.00 . A A . 4 PHE HD1 1 1 8 4240 1 1 4 PHE HD2 H -8.165 -11.022 -22.593 1.00 . A A . 4 PHE HD2 1 1 8 4241 1 1 4 PHE HE1 H -9.393 -6.926 -20.173 1.00 . A A . 4 PHE HE1 1 1 8 4242 1 1 4 PHE HE2 H -9.213 -9.159 -23.788 1.00 . A A . 4 PHE HE2 1 1 8 4243 1 1 4 PHE HZ H -9.830 -7.108 -22.584 1.00 . A A . 4 PHE HZ 1 1 8 4244 1 1 4 PHE N N -9.904 -11.657 -19.344 1.00 . A A . 4 PHE N 1 1 8 4245 1 1 4 PHE O O -7.628 -10.355 -17.290 1.00 . A A . 4 PHE O 1 1 8 4246 1 1 5 ARG C C -9.606 -10.240 -14.949 1.00 . A A . 5 ARG C 1 1 8 4247 1 1 5 ARG CA C -8.960 -11.624 -15.143 1.00 . A A . 5 ARG CA 1 1 8 4248 1 1 5 ARG CB C -7.479 -11.625 -14.632 1.00 . A A . 5 ARG CB 1 1 8 4249 1 1 5 ARG CD C -6.049 -10.932 -12.653 1.00 . A A . 5 ARG CD 1 1 8 4250 1 1 5 ARG CG C -7.443 -11.438 -13.092 1.00 . A A . 5 ARG CG 1 1 8 4251 1 1 5 ARG CZ C -5.296 -9.227 -11.060 1.00 . A A . 5 ARG CZ 1 1 8 4252 1 1 5 ARG H H -9.508 -12.768 -16.886 1.00 . A A . 5 ARG H 1 1 8 4253 1 1 5 ARG HA H -9.535 -12.357 -14.595 1.00 . A A . 5 ARG HA 1 1 8 4254 1 1 5 ARG HB2 H -7.018 -12.570 -14.885 1.00 . A A . 5 ARG HB2 1 1 8 4255 1 1 5 ARG HB3 H -6.916 -10.836 -15.108 1.00 . A A . 5 ARG HB3 1 1 8 4256 1 1 5 ARG HD2 H -5.403 -11.764 -12.413 1.00 . A A . 5 ARG HD2 1 1 8 4257 1 1 5 ARG HD3 H -5.593 -10.340 -13.433 1.00 . A A . 5 ARG HD3 1 1 8 4258 1 1 5 ARG HE H -7.033 -10.162 -10.902 1.00 . A A . 5 ARG HE 1 1 8 4259 1 1 5 ARG HG2 H -8.196 -10.727 -12.788 1.00 . A A . 5 ARG HG2 1 1 8 4260 1 1 5 ARG HG3 H -7.653 -12.381 -12.610 1.00 . A A . 5 ARG HG3 1 1 8 4261 1 1 5 ARG HH11 H -4.036 -9.650 -12.560 1.00 . A A . 5 ARG HH11 1 1 8 4262 1 1 5 ARG HH12 H -3.497 -8.434 -11.457 1.00 . A A . 5 ARG HH12 1 1 8 4263 1 1 5 ARG HH21 H -6.381 -8.645 -9.486 1.00 . A A . 5 ARG HH21 1 1 8 4264 1 1 5 ARG HH22 H -4.849 -7.856 -9.670 1.00 . A A . 5 ARG HH22 1 1 8 4265 1 1 5 ARG N N -8.978 -11.996 -16.595 1.00 . A A . 5 ARG N 1 1 8 4266 1 1 5 ARG NE N -6.215 -10.082 -11.434 1.00 . A A . 5 ARG NE 1 1 8 4267 1 1 5 ARG NH1 N -4.190 -9.093 -11.745 1.00 . A A . 5 ARG NH1 1 1 8 4268 1 1 5 ARG NH2 N -5.525 -8.520 -9.989 1.00 . A A . 5 ARG NH2 1 1 8 4269 1 1 5 ARG O O -8.931 -9.231 -14.856 1.00 . A A . 5 ARG O 1 1 8 4270 1 1 6 HIS C C -11.898 -8.730 -13.210 1.00 . A A . 6 HIS C 1 1 8 4271 1 1 6 HIS CA C -11.705 -9.002 -14.714 1.00 . A A . 6 HIS CA 1 1 8 4272 1 1 6 HIS CB C -13.064 -9.181 -15.435 1.00 . A A . 6 HIS CB 1 1 8 4273 1 1 6 HIS CD2 C -14.769 -7.202 -14.958 1.00 . A A . 6 HIS CD2 1 1 8 4274 1 1 6 HIS CE1 C -14.108 -5.881 -16.412 1.00 . A A . 6 HIS CE1 1 1 8 4275 1 1 6 HIS CG C -13.718 -7.805 -15.628 1.00 . A A . 6 HIS CG 1 1 8 4276 1 1 6 HIS H H -11.391 -11.104 -14.985 1.00 . A A . 6 HIS H 1 1 8 4277 1 1 6 HIS HA H -11.157 -8.184 -15.154 1.00 . A A . 6 HIS HA 1 1 8 4278 1 1 6 HIS HB2 H -12.918 -9.632 -16.407 1.00 . A A . 6 HIS HB2 1 1 8 4279 1 1 6 HIS HB3 H -13.728 -9.808 -14.857 1.00 . A A . 6 HIS HB3 1 1 8 4280 1 1 6 HIS HD1 H -12.633 -7.049 -17.157 1.00 . A A . 6 HIS HD1 1 1 8 4281 1 1 6 HIS HD2 H -15.322 -7.647 -14.144 1.00 . A A . 6 HIS HD2 1 1 8 4282 1 1 6 HIS HE1 H -14.009 -5.005 -17.038 1.00 . A A . 6 HIS HE1 1 1 8 4283 1 1 6 HIS N N -10.915 -10.256 -14.900 1.00 . A A . 6 HIS N 1 1 8 4284 1 1 6 HIS ND1 N -13.359 -6.933 -16.512 1.00 . A A . 6 HIS ND1 1 1 8 4285 1 1 6 HIS NE2 N -14.998 -6.004 -15.459 1.00 . A A . 6 HIS NE2 1 1 8 4286 1 1 6 HIS O O -12.990 -8.469 -12.740 1.00 . A A . 6 HIS O 1 1 8 4287 1 1 7 ASP C C -11.199 -7.130 -10.672 1.00 . A A . 7 ASP C 1 1 8 4288 1 1 7 ASP CA C -10.795 -8.571 -11.027 1.00 . A A . 7 ASP CA 1 1 8 4289 1 1 7 ASP CB C -9.380 -8.887 -10.521 1.00 . A A . 7 ASP CB 1 1 8 4290 1 1 7 ASP CG C -8.373 -7.867 -11.090 1.00 . A A . 7 ASP CG 1 1 8 4291 1 1 7 ASP H H -9.951 -9.019 -12.931 1.00 . A A . 7 ASP H 1 1 8 4292 1 1 7 ASP HA H -11.501 -9.251 -10.572 1.00 . A A . 7 ASP HA 1 1 8 4293 1 1 7 ASP HB2 H -9.362 -8.853 -9.445 1.00 . A A . 7 ASP HB2 1 1 8 4294 1 1 7 ASP HB3 H -9.090 -9.879 -10.836 1.00 . A A . 7 ASP HB3 1 1 8 4295 1 1 7 ASP N N -10.801 -8.804 -12.499 1.00 . A A . 7 ASP N 1 1 8 4296 1 1 7 ASP O O -11.372 -6.302 -11.546 1.00 . A A . 7 ASP O 1 1 8 4297 1 1 7 ASP OD1 O -8.027 -8.027 -12.251 1.00 . A A . 7 ASP OD1 1 1 8 4298 1 1 7 ASP OD2 O -8.009 -6.983 -10.331 1.00 . A A . 7 ASP OD2 1 1 8 4299 1 1 8 SER C C -13.069 -5.073 -9.478 1.00 . A A . 8 SER C 1 1 8 4300 1 1 8 SER CA C -11.723 -5.530 -8.881 1.00 . A A . 8 SER CA 1 1 8 4301 1 1 8 SER CB C -10.591 -4.529 -9.240 1.00 . A A . 8 SER CB 1 1 8 4302 1 1 8 SER H H -11.174 -7.609 -8.750 1.00 . A A . 8 SER H 1 1 8 4303 1 1 8 SER HA H -11.831 -5.595 -7.808 1.00 . A A . 8 SER HA 1 1 8 4304 1 1 8 SER HB2 H -9.617 -4.943 -9.023 1.00 . A A . 8 SER HB2 1 1 8 4305 1 1 8 SER HB3 H -10.640 -4.215 -10.271 1.00 . A A . 8 SER HB3 1 1 8 4306 1 1 8 SER HG H -11.014 -2.654 -8.953 1.00 . A A . 8 SER HG 1 1 8 4307 1 1 8 SER N N -11.333 -6.885 -9.391 1.00 . A A . 8 SER N 1 1 8 4308 1 1 8 SER O O -13.260 -3.910 -9.780 1.00 . A A . 8 SER O 1 1 8 4309 1 1 8 SER OG O -10.827 -3.412 -8.394 1.00 . A A . 8 SER OG 1 1 8 4310 1 1 9 GLY C C -16.023 -4.674 -9.336 1.00 . A A . 9 GLY C 1 1 8 4311 1 1 9 GLY CA C -15.319 -5.731 -10.192 1.00 . A A . 9 GLY CA 1 1 8 4312 1 1 9 GLY H H -13.738 -6.939 -9.364 1.00 . A A . 9 GLY H 1 1 8 4313 1 1 9 GLY HA2 H -15.212 -5.366 -11.204 1.00 . A A . 9 GLY HA2 1 1 8 4314 1 1 9 GLY HA3 H -15.905 -6.639 -10.194 1.00 . A A . 9 GLY HA3 1 1 8 4315 1 1 9 GLY N N -13.962 -6.022 -9.628 1.00 . A A . 9 GLY N 1 1 8 4316 1 1 9 GLY O O -16.667 -3.777 -9.847 1.00 . A A . 9 GLY O 1 1 8 4317 1 1 10 TYR C C -15.815 -2.506 -7.222 1.00 . A A . 10 TYR C 1 1 8 4318 1 1 10 TYR CA C -16.477 -3.885 -7.061 1.00 . A A . 10 TYR CA 1 1 8 4319 1 1 10 TYR CB C -16.249 -4.464 -5.639 1.00 . A A . 10 TYR CB 1 1 8 4320 1 1 10 TYR CD1 C -17.490 -2.952 -4.015 1.00 . A A . 10 TYR CD1 1 1 8 4321 1 1 10 TYR CD2 C -15.118 -2.766 -4.126 1.00 . A A . 10 TYR CD2 1 1 8 4322 1 1 10 TYR CE1 C -17.519 -1.964 -3.052 1.00 . A A . 10 TYR CE1 1 1 8 4323 1 1 10 TYR CE2 C -15.151 -1.779 -3.164 1.00 . A A . 10 TYR CE2 1 1 8 4324 1 1 10 TYR CG C -16.288 -3.362 -4.562 1.00 . A A . 10 TYR CG 1 1 8 4325 1 1 10 TYR CZ C -16.351 -1.372 -2.621 1.00 . A A . 10 TYR CZ 1 1 8 4326 1 1 10 TYR H H -15.325 -5.578 -7.718 1.00 . A A . 10 TYR H 1 1 8 4327 1 1 10 TYR HA H -17.535 -3.799 -7.269 1.00 . A A . 10 TYR HA 1 1 8 4328 1 1 10 TYR HB2 H -17.017 -5.193 -5.419 1.00 . A A . 10 TYR HB2 1 1 8 4329 1 1 10 TYR HB3 H -15.288 -4.957 -5.595 1.00 . A A . 10 TYR HB3 1 1 8 4330 1 1 10 TYR HD1 H -18.413 -3.406 -4.343 1.00 . A A . 10 TYR HD1 1 1 8 4331 1 1 10 TYR HD2 H -14.169 -3.073 -4.542 1.00 . A A . 10 TYR HD2 1 1 8 4332 1 1 10 TYR HE1 H -18.465 -1.654 -2.634 1.00 . A A . 10 TYR HE1 1 1 8 4333 1 1 10 TYR HE2 H -14.231 -1.323 -2.832 1.00 . A A . 10 TYR HE2 1 1 8 4334 1 1 10 TYR HH H -16.664 -0.785 -0.833 1.00 . A A . 10 TYR HH 1 1 8 4335 1 1 10 TYR N N -15.863 -4.828 -8.045 1.00 . A A . 10 TYR N 1 1 8 4336 1 1 10 TYR O O -16.454 -1.488 -7.040 1.00 . A A . 10 TYR O 1 1 8 4337 1 1 10 TYR OH O -16.382 -0.384 -1.658 1.00 . A A . 10 TYR OH 1 1 8 4338 1 1 11 GLU C C -13.593 -0.509 -6.470 1.00 . A A . 11 GLU C 1 1 8 4339 1 1 11 GLU CA C -13.716 -1.323 -7.767 1.00 . A A . 11 GLU CA 1 1 8 4340 1 1 11 GLU CB C -14.353 -0.451 -8.884 1.00 . A A . 11 GLU CB 1 1 8 4341 1 1 11 GLU CD C -13.965 1.834 -9.861 1.00 . A A . 11 GLU CD 1 1 8 4342 1 1 11 GLU CG C -13.287 0.519 -9.444 1.00 . A A . 11 GLU CG 1 1 8 4343 1 1 11 GLU H H -14.127 -3.424 -7.684 1.00 . A A . 11 GLU H 1 1 8 4344 1 1 11 GLU HA H -12.730 -1.641 -8.073 1.00 . A A . 11 GLU HA 1 1 8 4345 1 1 11 GLU HB2 H -14.702 -1.090 -9.682 1.00 . A A . 11 GLU HB2 1 1 8 4346 1 1 11 GLU HB3 H -15.197 0.101 -8.497 1.00 . A A . 11 GLU HB3 1 1 8 4347 1 1 11 GLU HG2 H -12.529 0.736 -8.703 1.00 . A A . 11 GLU HG2 1 1 8 4348 1 1 11 GLU HG3 H -12.806 0.077 -10.306 1.00 . A A . 11 GLU HG3 1 1 8 4349 1 1 11 GLU N N -14.548 -2.549 -7.560 1.00 . A A . 11 GLU N 1 1 8 4350 1 1 11 GLU O O -14.526 0.133 -6.028 1.00 . A A . 11 GLU O 1 1 8 4351 1 1 11 GLU OE1 O -14.052 2.695 -8.999 1.00 . A A . 11 GLU OE1 1 1 8 4352 1 1 11 GLU OE2 O -14.358 1.903 -11.014 1.00 . A A . 11 GLU OE2 1 1 8 4353 1 1 12 VAL C C -11.874 1.639 -4.937 1.00 . A A . 12 VAL C 1 1 8 4354 1 1 12 VAL CA C -12.122 0.156 -4.636 1.00 . A A . 12 VAL CA 1 1 8 4355 1 1 12 VAL CB C -10.867 -0.489 -3.974 1.00 . A A . 12 VAL CB 1 1 8 4356 1 1 12 VAL CG1 C -11.147 -1.973 -3.660 1.00 . A A . 12 VAL CG1 1 1 8 4357 1 1 12 VAL CG2 C -9.633 -0.385 -4.914 1.00 . A A . 12 VAL CG2 1 1 8 4358 1 1 12 VAL H H -11.705 -1.104 -6.303 1.00 . A A . 12 VAL H 1 1 8 4359 1 1 12 VAL HA H -12.972 0.077 -3.975 1.00 . A A . 12 VAL HA 1 1 8 4360 1 1 12 VAL HB H -10.653 0.021 -3.046 1.00 . A A . 12 VAL HB 1 1 8 4361 1 1 12 VAL HG11 H -12.035 -2.064 -3.052 1.00 . A A . 12 VAL HG11 1 1 8 4362 1 1 12 VAL HG12 H -11.289 -2.534 -4.572 1.00 . A A . 12 VAL HG12 1 1 8 4363 1 1 12 VAL HG13 H -10.315 -2.398 -3.117 1.00 . A A . 12 VAL HG13 1 1 8 4364 1 1 12 VAL HG21 H -9.899 -0.610 -5.936 1.00 . A A . 12 VAL HG21 1 1 8 4365 1 1 12 VAL HG22 H -9.226 0.615 -4.875 1.00 . A A . 12 VAL HG22 1 1 8 4366 1 1 12 VAL HG23 H -8.866 -1.079 -4.602 1.00 . A A . 12 VAL HG23 1 1 8 4367 1 1 12 VAL N N -12.418 -0.572 -5.900 1.00 . A A . 12 VAL N 1 1 8 4368 1 1 12 VAL O O -12.067 2.103 -6.044 1.00 . A A . 12 VAL O 1 1 8 4369 1 1 13 HIS C C -9.836 3.906 -4.802 1.00 . A A . 13 HIS C 1 1 8 4370 1 1 13 HIS CA C -11.152 3.787 -4.030 1.00 . A A . 13 HIS CA 1 1 8 4371 1 1 13 HIS CB C -11.031 4.386 -2.602 1.00 . A A . 13 HIS CB 1 1 8 4372 1 1 13 HIS CD2 C -12.484 6.574 -2.943 1.00 . A A . 13 HIS CD2 1 1 8 4373 1 1 13 HIS CE1 C -13.961 6.173 -1.544 1.00 . A A . 13 HIS CE1 1 1 8 4374 1 1 13 HIS CG C -12.189 5.355 -2.357 1.00 . A A . 13 HIS CG 1 1 8 4375 1 1 13 HIS H H -11.324 1.857 -3.065 1.00 . A A . 13 HIS H 1 1 8 4376 1 1 13 HIS HA H -11.936 4.265 -4.596 1.00 . A A . 13 HIS HA 1 1 8 4377 1 1 13 HIS HB2 H -11.074 3.603 -1.857 1.00 . A A . 13 HIS HB2 1 1 8 4378 1 1 13 HIS HB3 H -10.106 4.926 -2.477 1.00 . A A . 13 HIS HB3 1 1 8 4379 1 1 13 HIS HD1 H -13.232 4.392 -0.917 1.00 . A A . 13 HIS HD1 1 1 8 4380 1 1 13 HIS HD2 H -11.895 7.050 -3.713 1.00 . A A . 13 HIS HD2 1 1 8 4381 1 1 13 HIS HE1 H -14.843 6.261 -0.926 1.00 . A A . 13 HIS HE1 1 1 8 4382 1 1 13 HIS N N -11.448 2.327 -3.913 1.00 . A A . 13 HIS N 1 1 8 4383 1 1 13 HIS ND1 N -13.142 5.171 -1.505 1.00 . A A . 13 HIS ND1 1 1 8 4384 1 1 13 HIS NE2 N -13.590 7.070 -2.425 1.00 . A A . 13 HIS NE2 1 1 8 4385 1 1 13 HIS O O -9.821 4.277 -5.960 1.00 . A A . 13 HIS O 1 1 8 4386 1 1 14 HIS C C -6.538 2.538 -4.060 1.00 . A A . 14 HIS C 1 1 8 4387 1 1 14 HIS CA C -7.402 3.630 -4.705 1.00 . A A . 14 HIS CA 1 1 8 4388 1 1 14 HIS CB C -6.746 5.032 -4.455 1.00 . A A . 14 HIS CB 1 1 8 4389 1 1 14 HIS CD2 C -8.692 6.837 -4.386 1.00 . A A . 14 HIS CD2 1 1 8 4390 1 1 14 HIS CE1 C -8.702 7.194 -2.344 1.00 . A A . 14 HIS CE1 1 1 8 4391 1 1 14 HIS CG C -7.718 6.036 -3.817 1.00 . A A . 14 HIS CG 1 1 8 4392 1 1 14 HIS H H -8.884 3.300 -3.186 1.00 . A A . 14 HIS H 1 1 8 4393 1 1 14 HIS HA H -7.474 3.396 -5.753 1.00 . A A . 14 HIS HA 1 1 8 4394 1 1 14 HIS HB2 H -5.887 4.934 -3.809 1.00 . A A . 14 HIS HB2 1 1 8 4395 1 1 14 HIS HB3 H -6.415 5.440 -5.397 1.00 . A A . 14 HIS HB3 1 1 8 4396 1 1 14 HIS HD1 H -7.214 5.907 -1.862 1.00 . A A . 14 HIS HD1 1 1 8 4397 1 1 14 HIS HD2 H -8.926 6.871 -5.440 1.00 . A A . 14 HIS HD2 1 1 8 4398 1 1 14 HIS HE1 H -8.950 7.590 -1.371 1.00 . A A . 14 HIS HE1 1 1 8 4399 1 1 14 HIS N N -8.774 3.580 -4.115 1.00 . A A . 14 HIS N 1 1 8 4400 1 1 14 HIS ND1 N -7.780 6.309 -2.554 1.00 . A A . 14 HIS ND1 1 1 8 4401 1 1 14 HIS NE2 N -9.294 7.552 -3.456 1.00 . A A . 14 HIS NE2 1 1 8 4402 1 1 14 HIS O O -5.336 2.498 -4.222 1.00 . A A . 14 HIS O 1 1 8 4403 1 1 15 GLN C C -5.589 -0.217 -3.635 1.00 . A A . 15 GLN C 1 1 8 4404 1 1 15 GLN CA C -6.487 0.536 -2.645 1.00 . A A . 15 GLN CA 1 1 8 4405 1 1 15 GLN CB C -7.558 -0.400 -2.053 1.00 . A A . 15 GLN CB 1 1 8 4406 1 1 15 GLN CD C -9.067 -0.698 -0.083 1.00 . A A . 15 GLN CD 1 1 8 4407 1 1 15 GLN CG C -7.717 -0.134 -0.545 1.00 . A A . 15 GLN CG 1 1 8 4408 1 1 15 GLN H H -8.160 1.760 -3.274 1.00 . A A . 15 GLN H 1 1 8 4409 1 1 15 GLN HA H -5.857 0.952 -1.873 1.00 . A A . 15 GLN HA 1 1 8 4410 1 1 15 GLN HB2 H -8.500 -0.209 -2.541 1.00 . A A . 15 GLN HB2 1 1 8 4411 1 1 15 GLN HB3 H -7.300 -1.434 -2.219 1.00 . A A . 15 GLN HB3 1 1 8 4412 1 1 15 GLN HE21 H -8.546 -2.582 -0.438 1.00 . A A . 15 GLN HE21 1 1 8 4413 1 1 15 GLN HE22 H -10.115 -2.364 0.176 1.00 . A A . 15 GLN HE22 1 1 8 4414 1 1 15 GLN HG2 H -6.928 -0.620 0.009 1.00 . A A . 15 GLN HG2 1 1 8 4415 1 1 15 GLN HG3 H -7.693 0.925 -0.336 1.00 . A A . 15 GLN HG3 1 1 8 4416 1 1 15 GLN N N -7.189 1.664 -3.342 1.00 . A A . 15 GLN N 1 1 8 4417 1 1 15 GLN NE2 N -9.258 -1.989 -0.118 1.00 . A A . 15 GLN NE2 1 1 8 4418 1 1 15 GLN O O -4.444 -0.516 -3.354 1.00 . A A . 15 GLN O 1 1 8 4419 1 1 15 GLN OE1 O -9.957 0.028 0.313 1.00 . A A . 15 GLN OE1 1 1 8 4420 1 1 16 LYS C C -4.064 -0.567 -6.137 1.00 . A A . 16 LYS C 1 1 8 4421 1 1 16 LYS CA C -5.426 -1.211 -5.857 1.00 . A A . 16 LYS CA 1 1 8 4422 1 1 16 LYS CB C -6.314 -1.188 -7.125 1.00 . A A . 16 LYS CB 1 1 8 4423 1 1 16 LYS CD C -5.916 -3.568 -7.781 1.00 . A A . 16 LYS CD 1 1 8 4424 1 1 16 LYS CE C -6.615 -4.837 -8.312 1.00 . A A . 16 LYS CE 1 1 8 4425 1 1 16 LYS CG C -6.984 -2.557 -7.324 1.00 . A A . 16 LYS CG 1 1 8 4426 1 1 16 LYS H H -7.077 -0.219 -4.940 1.00 . A A . 16 LYS H 1 1 8 4427 1 1 16 LYS HA H -5.253 -2.218 -5.518 1.00 . A A . 16 LYS HA 1 1 8 4428 1 1 16 LYS HB2 H -7.082 -0.434 -7.020 1.00 . A A . 16 LYS HB2 1 1 8 4429 1 1 16 LYS HB3 H -5.725 -0.938 -7.996 1.00 . A A . 16 LYS HB3 1 1 8 4430 1 1 16 LYS HD2 H -5.306 -3.115 -8.549 1.00 . A A . 16 LYS HD2 1 1 8 4431 1 1 16 LYS HD3 H -5.281 -3.809 -6.941 1.00 . A A . 16 LYS HD3 1 1 8 4432 1 1 16 LYS HE2 H -7.041 -5.400 -7.494 1.00 . A A . 16 LYS HE2 1 1 8 4433 1 1 16 LYS HE3 H -7.400 -4.571 -9.003 1.00 . A A . 16 LYS HE3 1 1 8 4434 1 1 16 LYS HG2 H -7.436 -2.888 -6.400 1.00 . A A . 16 LYS HG2 1 1 8 4435 1 1 16 LYS HG3 H -7.758 -2.467 -8.073 1.00 . A A . 16 LYS HG3 1 1 8 4436 1 1 16 LYS HZ1 H -4.698 -5.264 -9.014 1.00 . A A . 16 LYS HZ1 1 1 8 4437 1 1 16 LYS HZ2 H -5.595 -6.634 -8.559 1.00 . A A . 16 LYS HZ2 1 1 8 4438 1 1 16 LYS HZ3 H -5.950 -5.834 -10.013 1.00 . A A . 16 LYS HZ3 1 1 8 4439 1 1 16 LYS N N -6.153 -0.490 -4.779 1.00 . A A . 16 LYS N 1 1 8 4440 1 1 16 LYS NZ N -5.639 -5.708 -9.028 1.00 . A A . 16 LYS NZ 1 1 8 4441 1 1 16 LYS O O -3.032 -1.204 -6.036 1.00 . A A . 16 LYS O 1 1 8 4442 1 1 17 LEU C C -1.959 1.493 -5.514 1.00 . A A . 17 LEU C 1 1 8 4443 1 1 17 LEU CA C -2.840 1.420 -6.767 1.00 . A A . 17 LEU CA 1 1 8 4444 1 1 17 LEU CB C -3.226 2.834 -7.329 1.00 . A A . 17 LEU CB 1 1 8 4445 1 1 17 LEU CD1 C -1.732 4.408 -5.985 1.00 . A A . 17 LEU CD1 1 1 8 4446 1 1 17 LEU CD2 C -3.991 5.165 -6.835 1.00 . A A . 17 LEU CD2 1 1 8 4447 1 1 17 LEU CG C -3.200 3.967 -6.277 1.00 . A A . 17 LEU CG 1 1 8 4448 1 1 17 LEU H H -4.963 1.169 -6.510 1.00 . A A . 17 LEU H 1 1 8 4449 1 1 17 LEU HA H -2.314 0.869 -7.532 1.00 . A A . 17 LEU HA 1 1 8 4450 1 1 17 LEU HB2 H -2.553 3.085 -8.134 1.00 . A A . 17 LEU HB2 1 1 8 4451 1 1 17 LEU HB3 H -4.222 2.773 -7.746 1.00 . A A . 17 LEU HB3 1 1 8 4452 1 1 17 LEU HD11 H -1.036 3.905 -6.641 1.00 . A A . 17 LEU HD11 1 1 8 4453 1 1 17 LEU HD12 H -1.610 5.473 -6.118 1.00 . A A . 17 LEU HD12 1 1 8 4454 1 1 17 LEU HD13 H -1.474 4.162 -4.966 1.00 . A A . 17 LEU HD13 1 1 8 4455 1 1 17 LEU HD21 H -4.995 4.860 -7.089 1.00 . A A . 17 LEU HD21 1 1 8 4456 1 1 17 LEU HD22 H -4.041 5.952 -6.097 1.00 . A A . 17 LEU HD22 1 1 8 4457 1 1 17 LEU HD23 H -3.509 5.547 -7.724 1.00 . A A . 17 LEU HD23 1 1 8 4458 1 1 17 LEU HG H -3.682 3.610 -5.382 1.00 . A A . 17 LEU HG 1 1 8 4459 1 1 17 LEU N N -4.106 0.698 -6.467 1.00 . A A . 17 LEU N 1 1 8 4460 1 1 17 LEU O O -0.764 1.369 -5.628 1.00 . A A . 17 LEU O 1 1 8 4461 1 1 18 VAL C C -0.833 0.518 -2.985 1.00 . A A . 18 VAL C 1 1 8 4462 1 1 18 VAL CA C -1.737 1.766 -3.095 1.00 . A A . 18 VAL CA 1 1 8 4463 1 1 18 VAL CB C -2.755 1.874 -1.922 1.00 . A A . 18 VAL CB 1 1 8 4464 1 1 18 VAL CG1 C -2.105 1.523 -0.580 1.00 . A A . 18 VAL CG1 1 1 8 4465 1 1 18 VAL CG2 C -3.311 3.314 -1.858 1.00 . A A . 18 VAL CG2 1 1 8 4466 1 1 18 VAL H H -3.503 1.794 -4.304 1.00 . A A . 18 VAL H 1 1 8 4467 1 1 18 VAL HA H -1.110 2.647 -3.134 1.00 . A A . 18 VAL HA 1 1 8 4468 1 1 18 VAL HB H -3.578 1.199 -2.084 1.00 . A A . 18 VAL HB 1 1 8 4469 1 1 18 VAL HG11 H -1.171 2.054 -0.470 1.00 . A A . 18 VAL HG11 1 1 8 4470 1 1 18 VAL HG12 H -2.767 1.792 0.230 1.00 . A A . 18 VAL HG12 1 1 8 4471 1 1 18 VAL HG13 H -1.919 0.460 -0.537 1.00 . A A . 18 VAL HG13 1 1 8 4472 1 1 18 VAL HG21 H -3.581 3.660 -2.845 1.00 . A A . 18 VAL HG21 1 1 8 4473 1 1 18 VAL HG22 H -4.191 3.341 -1.233 1.00 . A A . 18 VAL HG22 1 1 8 4474 1 1 18 VAL HG23 H -2.572 3.986 -1.447 1.00 . A A . 18 VAL HG23 1 1 8 4475 1 1 18 VAL N N -2.536 1.688 -4.356 1.00 . A A . 18 VAL N 1 1 8 4476 1 1 18 VAL O O 0.363 0.627 -2.800 1.00 . A A . 18 VAL O 1 1 8 4477 1 1 19 PHE C C 0.457 -1.914 -4.057 1.00 . A A . 19 PHE C 1 1 8 4478 1 1 19 PHE CA C -0.680 -1.924 -3.032 1.00 . A A . 19 PHE CA 1 1 8 4479 1 1 19 PHE CB C -1.619 -3.119 -3.332 1.00 . A A . 19 PHE CB 1 1 8 4480 1 1 19 PHE CD1 C -3.040 -2.496 -1.295 1.00 . A A . 19 PHE CD1 1 1 8 4481 1 1 19 PHE CD2 C -4.107 -3.524 -3.162 1.00 . A A . 19 PHE CD2 1 1 8 4482 1 1 19 PHE CE1 C -4.249 -2.442 -0.634 1.00 . A A . 19 PHE CE1 1 1 8 4483 1 1 19 PHE CE2 C -5.316 -3.470 -2.501 1.00 . A A . 19 PHE CE2 1 1 8 4484 1 1 19 PHE CG C -2.956 -3.038 -2.567 1.00 . A A . 19 PHE CG 1 1 8 4485 1 1 19 PHE CZ C -5.388 -2.929 -1.237 1.00 . A A . 19 PHE CZ 1 1 8 4486 1 1 19 PHE H H -2.404 -0.639 -3.269 1.00 . A A . 19 PHE H 1 1 8 4487 1 1 19 PHE HA H -0.254 -2.014 -2.046 1.00 . A A . 19 PHE HA 1 1 8 4488 1 1 19 PHE HB2 H -1.833 -3.158 -4.392 1.00 . A A . 19 PHE HB2 1 1 8 4489 1 1 19 PHE HB3 H -1.125 -4.039 -3.053 1.00 . A A . 19 PHE HB3 1 1 8 4490 1 1 19 PHE HD1 H -2.156 -2.110 -0.808 1.00 . A A . 19 PHE HD1 1 1 8 4491 1 1 19 PHE HD2 H -4.062 -3.951 -4.154 1.00 . A A . 19 PHE HD2 1 1 8 4492 1 1 19 PHE HE1 H -4.304 -2.016 0.358 1.00 . A A . 19 PHE HE1 1 1 8 4493 1 1 19 PHE HE2 H -6.207 -3.853 -2.977 1.00 . A A . 19 PHE HE2 1 1 8 4494 1 1 19 PHE HZ H -6.334 -2.889 -0.719 1.00 . A A . 19 PHE HZ 1 1 8 4495 1 1 19 PHE N N -1.441 -0.633 -3.116 1.00 . A A . 19 PHE N 1 1 8 4496 1 1 19 PHE O O 1.603 -2.177 -3.746 1.00 . A A . 19 PHE O 1 1 8 4497 1 1 20 PHE C C 2.234 -0.614 -6.017 1.00 . A A . 20 PHE C 1 1 8 4498 1 1 20 PHE CA C 1.050 -1.534 -6.394 1.00 . A A . 20 PHE CA 1 1 8 4499 1 1 20 PHE CB C 0.232 -1.041 -7.635 1.00 . A A . 20 PHE CB 1 1 8 4500 1 1 20 PHE CD1 C 2.042 -0.360 -9.251 1.00 . A A . 20 PHE CD1 1 1 8 4501 1 1 20 PHE CD2 C 0.569 1.338 -8.465 1.00 . A A . 20 PHE CD2 1 1 8 4502 1 1 20 PHE CE1 C 2.713 0.573 -10.010 1.00 . A A . 20 PHE CE1 1 1 8 4503 1 1 20 PHE CE2 C 1.239 2.273 -9.222 1.00 . A A . 20 PHE CE2 1 1 8 4504 1 1 20 PHE CG C 0.967 0.014 -8.474 1.00 . A A . 20 PHE CG 1 1 8 4505 1 1 20 PHE CZ C 2.313 1.892 -9.997 1.00 . A A . 20 PHE CZ 1 1 8 4506 1 1 20 PHE H H -0.867 -1.393 -5.433 1.00 . A A . 20 PHE H 1 1 8 4507 1 1 20 PHE HA H 1.428 -2.530 -6.576 1.00 . A A . 20 PHE HA 1 1 8 4508 1 1 20 PHE HB2 H 0.019 -1.888 -8.271 1.00 . A A . 20 PHE HB2 1 1 8 4509 1 1 20 PHE HB3 H -0.713 -0.626 -7.318 1.00 . A A . 20 PHE HB3 1 1 8 4510 1 1 20 PHE HD1 H 2.356 -1.394 -9.261 1.00 . A A . 20 PHE HD1 1 1 8 4511 1 1 20 PHE HD2 H -0.271 1.651 -7.867 1.00 . A A . 20 PHE HD2 1 1 8 4512 1 1 20 PHE HE1 H 3.554 0.266 -10.614 1.00 . A A . 20 PHE HE1 1 1 8 4513 1 1 20 PHE HE2 H 0.916 3.302 -9.203 1.00 . A A . 20 PHE HE2 1 1 8 4514 1 1 20 PHE HZ H 2.839 2.625 -10.591 1.00 . A A . 20 PHE HZ 1 1 8 4515 1 1 20 PHE N N 0.078 -1.596 -5.266 1.00 . A A . 20 PHE N 1 1 8 4516 1 1 20 PHE O O 3.378 -1.016 -6.060 1.00 . A A . 20 PHE O 1 1 8 4517 1 1 21 ALA C C 3.879 1.065 -4.190 1.00 . A A . 21 ALA C 1 1 8 4518 1 1 21 ALA CA C 2.931 1.616 -5.249 1.00 . A A . 21 ALA CA 1 1 8 4519 1 1 21 ALA CB C 2.199 2.855 -4.714 1.00 . A A . 21 ALA CB 1 1 8 4520 1 1 21 ALA H H 0.970 0.838 -5.621 1.00 . A A . 21 ALA H 1 1 8 4521 1 1 21 ALA HA H 3.518 1.870 -6.121 1.00 . A A . 21 ALA HA 1 1 8 4522 1 1 21 ALA HB1 H 1.474 3.198 -5.439 1.00 . A A . 21 ALA HB1 1 1 8 4523 1 1 21 ALA HB2 H 1.682 2.620 -3.795 1.00 . A A . 21 ALA HB2 1 1 8 4524 1 1 21 ALA HB3 H 2.903 3.651 -4.523 1.00 . A A . 21 ALA HB3 1 1 8 4525 1 1 21 ALA N N 1.912 0.597 -5.645 1.00 . A A . 21 ALA N 1 1 8 4526 1 1 21 ALA O O 5.072 1.223 -4.304 1.00 . A A . 21 ALA O 1 1 8 4527 1 1 22 GLU C C 5.202 -1.134 -2.732 1.00 . A A . 22 GLU C 1 1 8 4528 1 1 22 GLU CA C 4.200 -0.146 -2.106 1.00 . A A . 22 GLU CA 1 1 8 4529 1 1 22 GLU CB C 3.261 -0.839 -1.087 1.00 . A A . 22 GLU CB 1 1 8 4530 1 1 22 GLU CD C 4.402 -3.102 -0.740 1.00 . A A . 22 GLU CD 1 1 8 4531 1 1 22 GLU CG C 4.041 -1.741 -0.097 1.00 . A A . 22 GLU CG 1 1 8 4532 1 1 22 GLU H H 2.371 0.346 -3.141 1.00 . A A . 22 GLU H 1 1 8 4533 1 1 22 GLU HA H 4.756 0.658 -1.646 1.00 . A A . 22 GLU HA 1 1 8 4534 1 1 22 GLU HB2 H 2.746 -0.076 -0.523 1.00 . A A . 22 GLU HB2 1 1 8 4535 1 1 22 GLU HB3 H 2.516 -1.422 -1.609 1.00 . A A . 22 GLU HB3 1 1 8 4536 1 1 22 GLU HG2 H 4.943 -1.236 0.217 1.00 . A A . 22 GLU HG2 1 1 8 4537 1 1 22 GLU HG3 H 3.427 -1.923 0.771 1.00 . A A . 22 GLU HG3 1 1 8 4538 1 1 22 GLU N N 3.340 0.431 -3.185 1.00 . A A . 22 GLU N 1 1 8 4539 1 1 22 GLU O O 6.396 -1.028 -2.523 1.00 . A A . 22 GLU O 1 1 8 4540 1 1 22 GLU OE1 O 3.485 -3.758 -1.210 1.00 . A A . 22 GLU OE1 1 1 8 4541 1 1 22 GLU OE2 O 5.583 -3.411 -0.726 1.00 . A A . 22 GLU OE2 1 1 8 4542 1 1 23 ASP C C 6.698 -2.420 -4.860 1.00 . A A . 23 ASP C 1 1 8 4543 1 1 23 ASP CA C 5.517 -3.099 -4.166 1.00 . A A . 23 ASP CA 1 1 8 4544 1 1 23 ASP CB C 4.676 -3.842 -5.213 1.00 . A A . 23 ASP CB 1 1 8 4545 1 1 23 ASP CG C 5.431 -5.110 -5.644 1.00 . A A . 23 ASP CG 1 1 8 4546 1 1 23 ASP H H 3.702 -2.082 -3.607 1.00 . A A . 23 ASP H 1 1 8 4547 1 1 23 ASP HA H 5.892 -3.785 -3.420 1.00 . A A . 23 ASP HA 1 1 8 4548 1 1 23 ASP HB2 H 3.704 -4.100 -4.824 1.00 . A A . 23 ASP HB2 1 1 8 4549 1 1 23 ASP HB3 H 4.522 -3.213 -6.078 1.00 . A A . 23 ASP HB3 1 1 8 4550 1 1 23 ASP N N 4.672 -2.066 -3.487 1.00 . A A . 23 ASP N 1 1 8 4551 1 1 23 ASP O O 7.846 -2.759 -4.662 1.00 . A A . 23 ASP O 1 1 8 4552 1 1 23 ASP OD1 O 5.231 -6.119 -4.988 1.00 . A A . 23 ASP OD1 1 1 8 4553 1 1 23 ASP OD2 O 6.172 -4.992 -6.607 1.00 . A A . 23 ASP OD2 1 1 8 4554 1 1 24 VAL C C 8.305 0.035 -5.570 1.00 . A A . 24 VAL C 1 1 8 4555 1 1 24 VAL CA C 7.250 -0.626 -6.465 1.00 . A A . 24 VAL CA 1 1 8 4556 1 1 24 VAL CB C 6.346 0.395 -7.193 1.00 . A A . 24 VAL CB 1 1 8 4557 1 1 24 VAL CG1 C 7.126 1.384 -8.047 1.00 . A A . 24 VAL CG1 1 1 8 4558 1 1 24 VAL CG2 C 5.329 -0.358 -8.074 1.00 . A A . 24 VAL CG2 1 1 8 4559 1 1 24 VAL H H 5.360 -1.283 -5.730 1.00 . A A . 24 VAL H 1 1 8 4560 1 1 24 VAL HA H 7.754 -1.266 -7.174 1.00 . A A . 24 VAL HA 1 1 8 4561 1 1 24 VAL HB H 5.797 0.965 -6.463 1.00 . A A . 24 VAL HB 1 1 8 4562 1 1 24 VAL HG11 H 7.883 1.872 -7.452 1.00 . A A . 24 VAL HG11 1 1 8 4563 1 1 24 VAL HG12 H 7.583 0.870 -8.876 1.00 . A A . 24 VAL HG12 1 1 8 4564 1 1 24 VAL HG13 H 6.442 2.131 -8.424 1.00 . A A . 24 VAL HG13 1 1 8 4565 1 1 24 VAL HG21 H 5.195 -1.376 -7.734 1.00 . A A . 24 VAL HG21 1 1 8 4566 1 1 24 VAL HG22 H 4.380 0.147 -8.004 1.00 . A A . 24 VAL HG22 1 1 8 4567 1 1 24 VAL HG23 H 5.648 -0.383 -9.102 1.00 . A A . 24 VAL HG23 1 1 8 4568 1 1 24 VAL N N 6.319 -1.463 -5.657 1.00 . A A . 24 VAL N 1 1 8 4569 1 1 24 VAL O O 9.492 -0.077 -5.801 1.00 . A A . 24 VAL O 1 1 8 4570 1 1 25 GLY C C 9.856 0.524 -3.167 1.00 . A A . 25 GLY C 1 1 8 4571 1 1 25 GLY CA C 8.691 1.423 -3.577 1.00 . A A . 25 GLY CA 1 1 8 4572 1 1 25 GLY H H 6.846 0.733 -4.462 1.00 . A A . 25 GLY H 1 1 8 4573 1 1 25 GLY HA2 H 9.071 2.327 -4.031 1.00 . A A . 25 GLY HA2 1 1 8 4574 1 1 25 GLY HA3 H 8.107 1.673 -2.703 1.00 . A A . 25 GLY HA3 1 1 8 4575 1 1 25 GLY N N 7.816 0.708 -4.562 1.00 . A A . 25 GLY N 1 1 8 4576 1 1 25 GLY O O 11.001 0.929 -3.179 1.00 . A A . 25 GLY O 1 1 8 4577 1 1 26 SER C C 11.363 -2.144 -3.596 1.00 . A A . 26 SER C 1 1 8 4578 1 1 26 SER CA C 10.512 -1.688 -2.394 1.00 . A A . 26 SER CA 1 1 8 4579 1 1 26 SER CB C 9.760 -2.881 -1.767 1.00 . A A . 26 SER CB 1 1 8 4580 1 1 26 SER H H 8.546 -0.909 -2.827 1.00 . A A . 26 SER H 1 1 8 4581 1 1 26 SER HA H 11.155 -1.237 -1.660 1.00 . A A . 26 SER HA 1 1 8 4582 1 1 26 SER HB2 H 9.131 -2.560 -0.949 1.00 . A A . 26 SER HB2 1 1 8 4583 1 1 26 SER HB3 H 9.173 -3.424 -2.493 1.00 . A A . 26 SER HB3 1 1 8 4584 1 1 26 SER HG H 10.660 -3.818 -0.320 1.00 . A A . 26 SER HG 1 1 8 4585 1 1 26 SER N N 9.498 -0.681 -2.815 1.00 . A A . 26 SER N 1 1 8 4586 1 1 26 SER O O 12.550 -1.892 -3.671 1.00 . A A . 26 SER O 1 1 8 4587 1 1 26 SER OG O 10.787 -3.725 -1.266 1.00 . A A . 26 SER OG 1 1 8 4588 1 1 27 ASN C C 11.965 -2.239 -6.626 1.00 . A A . 27 ASN C 1 1 8 4589 1 1 27 ASN CA C 11.352 -3.323 -5.748 1.00 . A A . 27 ASN CA 1 1 8 4590 1 1 27 ASN CB C 10.277 -4.113 -6.518 1.00 . A A . 27 ASN CB 1 1 8 4591 1 1 27 ASN CG C 9.906 -5.380 -5.736 1.00 . A A . 27 ASN CG 1 1 8 4592 1 1 27 ASN H H 9.748 -2.932 -4.404 1.00 . A A . 27 ASN H 1 1 8 4593 1 1 27 ASN HA H 12.166 -3.954 -5.436 1.00 . A A . 27 ASN HA 1 1 8 4594 1 1 27 ASN HB2 H 9.388 -3.509 -6.641 1.00 . A A . 27 ASN HB2 1 1 8 4595 1 1 27 ASN HB3 H 10.638 -4.391 -7.493 1.00 . A A . 27 ASN HB3 1 1 8 4596 1 1 27 ASN HD21 H 8.061 -4.759 -5.335 1.00 . A A . 27 ASN HD21 1 1 8 4597 1 1 27 ASN HD22 H 8.463 -6.287 -4.716 1.00 . A A . 27 ASN HD22 1 1 8 4598 1 1 27 ASN N N 10.704 -2.794 -4.516 1.00 . A A . 27 ASN N 1 1 8 4599 1 1 27 ASN ND2 N 8.711 -5.484 -5.220 1.00 . A A . 27 ASN ND2 1 1 8 4600 1 1 27 ASN O O 13.173 -2.108 -6.666 1.00 . A A . 27 ASN O 1 1 8 4601 1 1 27 ASN OD1 O 10.700 -6.287 -5.587 1.00 . A A . 27 ASN OD1 1 1 8 4602 1 1 28 LYS C C 12.651 0.445 -7.428 1.00 . A A . 28 LYS C 1 1 8 4603 1 1 28 LYS CA C 11.632 -0.400 -8.197 1.00 . A A . 28 LYS CA 1 1 8 4604 1 1 28 LYS CB C 10.441 0.473 -8.641 1.00 . A A . 28 LYS CB 1 1 8 4605 1 1 28 LYS CD C 9.789 1.989 -10.571 1.00 . A A . 28 LYS CD 1 1 8 4606 1 1 28 LYS CE C 9.034 1.794 -11.900 1.00 . A A . 28 LYS CE 1 1 8 4607 1 1 28 LYS CG C 10.505 0.673 -10.169 1.00 . A A . 28 LYS CG 1 1 8 4608 1 1 28 LYS H H 10.172 -1.663 -7.230 1.00 . A A . 28 LYS H 1 1 8 4609 1 1 28 LYS HA H 12.132 -0.846 -9.049 1.00 . A A . 28 LYS HA 1 1 8 4610 1 1 28 LYS HB2 H 9.517 -0.027 -8.395 1.00 . A A . 28 LYS HB2 1 1 8 4611 1 1 28 LYS HB3 H 10.458 1.427 -8.131 1.00 . A A . 28 LYS HB3 1 1 8 4612 1 1 28 LYS HD2 H 9.090 2.296 -9.806 1.00 . A A . 28 LYS HD2 1 1 8 4613 1 1 28 LYS HD3 H 10.523 2.773 -10.692 1.00 . A A . 28 LYS HD3 1 1 8 4614 1 1 28 LYS HE2 H 8.623 2.736 -12.230 1.00 . A A . 28 LYS HE2 1 1 8 4615 1 1 28 LYS HE3 H 9.702 1.419 -12.663 1.00 . A A . 28 LYS HE3 1 1 8 4616 1 1 28 LYS HG2 H 11.535 0.719 -10.490 1.00 . A A . 28 LYS HG2 1 1 8 4617 1 1 28 LYS HG3 H 10.039 -0.180 -10.640 1.00 . A A . 28 LYS HG3 1 1 8 4618 1 1 28 LYS HZ1 H 7.893 0.491 -10.739 1.00 . A A . 28 LYS HZ1 1 1 8 4619 1 1 28 LYS HZ2 H 7.013 1.290 -11.949 1.00 . A A . 28 LYS HZ2 1 1 8 4620 1 1 28 LYS HZ3 H 8.054 0.014 -12.359 1.00 . A A . 28 LYS HZ3 1 1 8 4621 1 1 28 LYS N N 11.132 -1.495 -7.307 1.00 . A A . 28 LYS N 1 1 8 4622 1 1 28 LYS NZ N 7.915 0.825 -11.723 1.00 . A A . 28 LYS NZ 1 1 8 4623 1 1 28 LYS O O 13.617 0.897 -7.998 1.00 . A A . 28 LYS O 1 1 8 4624 1 1 29 GLY C C 14.764 0.829 -5.408 1.00 . A A . 29 GLY C 1 1 8 4625 1 1 29 GLY CA C 13.355 1.432 -5.317 1.00 . A A . 29 GLY CA 1 1 8 4626 1 1 29 GLY H H 11.612 0.231 -5.763 1.00 . A A . 29 GLY H 1 1 8 4627 1 1 29 GLY HA2 H 13.371 2.452 -5.673 1.00 . A A . 29 GLY HA2 1 1 8 4628 1 1 29 GLY HA3 H 13.033 1.412 -4.289 1.00 . A A . 29 GLY HA3 1 1 8 4629 1 1 29 GLY N N 12.416 0.627 -6.153 1.00 . A A . 29 GLY N 1 1 8 4630 1 1 29 GLY O O 15.693 1.486 -5.838 1.00 . A A . 29 GLY O 1 1 8 4631 1 1 30 ALA C C 16.790 -1.087 -6.491 1.00 . A A . 30 ALA C 1 1 8 4632 1 1 30 ALA CA C 16.226 -1.086 -5.064 1.00 . A A . 30 ALA CA 1 1 8 4633 1 1 30 ALA CB C 16.074 -2.527 -4.558 1.00 . A A . 30 ALA CB 1 1 8 4634 1 1 30 ALA H H 14.095 -0.912 -4.688 1.00 . A A . 30 ALA H 1 1 8 4635 1 1 30 ALA HA H 16.908 -0.527 -4.439 1.00 . A A . 30 ALA HA 1 1 8 4636 1 1 30 ALA HB1 H 15.704 -2.522 -3.543 1.00 . A A . 30 ALA HB1 1 1 8 4637 1 1 30 ALA HB2 H 15.380 -3.073 -5.180 1.00 . A A . 30 ALA HB2 1 1 8 4638 1 1 30 ALA HB3 H 17.031 -3.029 -4.575 1.00 . A A . 30 ALA HB3 1 1 8 4639 1 1 30 ALA N N 14.883 -0.417 -5.013 1.00 . A A . 30 ALA N 1 1 8 4640 1 1 30 ALA O O 17.958 -0.833 -6.714 1.00 . A A . 30 ALA O 1 1 8 4641 1 1 31 ILE C C 16.939 -0.094 -9.271 1.00 . A A . 31 ILE C 1 1 8 4642 1 1 31 ILE CA C 16.286 -1.421 -8.862 1.00 . A A . 31 ILE CA 1 1 8 4643 1 1 31 ILE CB C 14.957 -1.730 -9.605 1.00 . A A . 31 ILE CB 1 1 8 4644 1 1 31 ILE CD1 C 13.238 -3.602 -9.941 1.00 . A A . 31 ILE CD1 1 1 8 4645 1 1 31 ILE CG1 C 14.623 -3.231 -9.372 1.00 . A A . 31 ILE CG1 1 1 8 4646 1 1 31 ILE CG2 C 15.024 -1.399 -11.106 1.00 . A A . 31 ILE CG2 1 1 8 4647 1 1 31 ILE H H 14.999 -1.567 -7.168 1.00 . A A . 31 ILE H 1 1 8 4648 1 1 31 ILE HA H 17.023 -2.198 -8.993 1.00 . A A . 31 ILE HA 1 1 8 4649 1 1 31 ILE HB H 14.176 -1.132 -9.167 1.00 . A A . 31 ILE HB 1 1 8 4650 1 1 31 ILE HD11 H 12.509 -2.841 -9.708 1.00 . A A . 31 ILE HD11 1 1 8 4651 1 1 31 ILE HD12 H 13.293 -3.719 -11.013 1.00 . A A . 31 ILE HD12 1 1 8 4652 1 1 31 ILE HD13 H 12.908 -4.536 -9.509 1.00 . A A . 31 ILE HD13 1 1 8 4653 1 1 31 ILE HG12 H 15.386 -3.842 -9.825 1.00 . A A . 31 ILE HG12 1 1 8 4654 1 1 31 ILE HG13 H 14.621 -3.438 -8.312 1.00 . A A . 31 ILE HG13 1 1 8 4655 1 1 31 ILE HG21 H 15.821 -1.949 -11.581 1.00 . A A . 31 ILE HG21 1 1 8 4656 1 1 31 ILE HG22 H 14.086 -1.654 -11.576 1.00 . A A . 31 ILE HG22 1 1 8 4657 1 1 31 ILE HG23 H 15.185 -0.339 -11.240 1.00 . A A . 31 ILE HG23 1 1 8 4658 1 1 31 ILE N N 15.921 -1.373 -7.420 1.00 . A A . 31 ILE N 1 1 8 4659 1 1 31 ILE O O 18.047 -0.077 -9.763 1.00 . A A . 31 ILE O 1 1 8 4660 1 1 32 ILE C C 18.157 2.505 -8.732 1.00 . A A . 32 ILE C 1 1 8 4661 1 1 32 ILE CA C 16.801 2.325 -9.416 1.00 . A A . 32 ILE CA 1 1 8 4662 1 1 32 ILE CB C 15.796 3.413 -8.956 1.00 . A A . 32 ILE CB 1 1 8 4663 1 1 32 ILE CD1 C 13.296 3.861 -8.956 1.00 . A A . 32 ILE CD1 1 1 8 4664 1 1 32 ILE CG1 C 14.464 3.218 -9.729 1.00 . A A . 32 ILE CG1 1 1 8 4665 1 1 32 ILE CG2 C 16.363 4.824 -9.258 1.00 . A A . 32 ILE CG2 1 1 8 4666 1 1 32 ILE H H 15.361 0.929 -8.657 1.00 . A A . 32 ILE H 1 1 8 4667 1 1 32 ILE HA H 16.961 2.351 -10.480 1.00 . A A . 32 ILE HA 1 1 8 4668 1 1 32 ILE HB H 15.627 3.314 -7.894 1.00 . A A . 32 ILE HB 1 1 8 4669 1 1 32 ILE HD11 H 13.314 3.563 -7.918 1.00 . A A . 32 ILE HD11 1 1 8 4670 1 1 32 ILE HD12 H 13.364 4.938 -9.011 1.00 . A A . 32 ILE HD12 1 1 8 4671 1 1 32 ILE HD13 H 12.356 3.552 -9.389 1.00 . A A . 32 ILE HD13 1 1 8 4672 1 1 32 ILE HG12 H 14.543 3.658 -10.709 1.00 . A A . 32 ILE HG12 1 1 8 4673 1 1 32 ILE HG13 H 14.262 2.166 -9.864 1.00 . A A . 32 ILE HG13 1 1 8 4674 1 1 32 ILE HG21 H 16.661 4.899 -10.293 1.00 . A A . 32 ILE HG21 1 1 8 4675 1 1 32 ILE HG22 H 15.618 5.580 -9.056 1.00 . A A . 32 ILE HG22 1 1 8 4676 1 1 32 ILE HG23 H 17.223 5.020 -8.633 1.00 . A A . 32 ILE HG23 1 1 8 4677 1 1 32 ILE N N 16.248 0.989 -9.055 1.00 . A A . 32 ILE N 1 1 8 4678 1 1 32 ILE O O 19.104 2.930 -9.359 1.00 . A A . 32 ILE O 1 1 8 4679 1 1 33 GLY C C 20.650 1.589 -7.418 1.00 . A A . 33 GLY C 1 1 8 4680 1 1 33 GLY CA C 19.492 2.303 -6.713 1.00 . A A . 33 GLY CA 1 1 8 4681 1 1 33 GLY H H 17.415 1.818 -7.027 1.00 . A A . 33 GLY H 1 1 8 4682 1 1 33 GLY HA2 H 19.733 3.355 -6.628 1.00 . A A . 33 GLY HA2 1 1 8 4683 1 1 33 GLY HA3 H 19.367 1.884 -5.727 1.00 . A A . 33 GLY HA3 1 1 8 4684 1 1 33 GLY N N 18.214 2.165 -7.472 1.00 . A A . 33 GLY N 1 1 8 4685 1 1 33 GLY O O 21.684 2.187 -7.647 1.00 . A A . 33 GLY O 1 1 8 4686 1 1 34 LEU C C 21.862 0.218 -9.827 1.00 . A A . 34 LEU C 1 1 8 4687 1 1 34 LEU CA C 21.567 -0.393 -8.448 1.00 . A A . 34 LEU CA 1 1 8 4688 1 1 34 LEU CB C 21.164 -1.913 -8.531 1.00 . A A . 34 LEU CB 1 1 8 4689 1 1 34 LEU CD1 C 21.297 -2.746 -10.936 1.00 . A A . 34 LEU CD1 1 1 8 4690 1 1 34 LEU CD2 C 19.405 -3.478 -9.453 1.00 . A A . 34 LEU CD2 1 1 8 4691 1 1 34 LEU CG C 20.348 -2.303 -9.796 1.00 . A A . 34 LEU CG 1 1 8 4692 1 1 34 LEU H H 19.601 -0.104 -7.568 1.00 . A A . 34 LEU H 1 1 8 4693 1 1 34 LEU HA H 22.449 -0.295 -7.839 1.00 . A A . 34 LEU HA 1 1 8 4694 1 1 34 LEU HB2 H 22.068 -2.505 -8.493 1.00 . A A . 34 LEU HB2 1 1 8 4695 1 1 34 LEU HB3 H 20.589 -2.152 -7.648 1.00 . A A . 34 LEU HB3 1 1 8 4696 1 1 34 LEU HD11 H 22.035 -3.443 -10.565 1.00 . A A . 34 LEU HD11 1 1 8 4697 1 1 34 LEU HD12 H 20.735 -3.228 -11.722 1.00 . A A . 34 LEU HD12 1 1 8 4698 1 1 34 LEU HD13 H 21.809 -1.894 -11.357 1.00 . A A . 34 LEU HD13 1 1 8 4699 1 1 34 LEU HD21 H 18.866 -3.274 -8.539 1.00 . A A . 34 LEU HD21 1 1 8 4700 1 1 34 LEU HD22 H 18.689 -3.620 -10.250 1.00 . A A . 34 LEU HD22 1 1 8 4701 1 1 34 LEU HD23 H 19.969 -4.390 -9.325 1.00 . A A . 34 LEU HD23 1 1 8 4702 1 1 34 LEU HG H 19.755 -1.469 -10.119 1.00 . A A . 34 LEU HG 1 1 8 4703 1 1 34 LEU N N 20.457 0.337 -7.761 1.00 . A A . 34 LEU N 1 1 8 4704 1 1 34 LEU O O 23.017 0.316 -10.196 1.00 . A A . 34 LEU O 1 1 8 4705 1 1 35 MET C C 21.908 2.467 -11.775 1.00 . A A . 35 MET C 1 1 8 4706 1 1 35 MET CA C 21.010 1.224 -11.893 1.00 . A A . 35 MET CA 1 1 8 4707 1 1 35 MET CB C 19.614 1.616 -12.453 1.00 . A A . 35 MET CB 1 1 8 4708 1 1 35 MET CE C 18.799 -1.438 -13.067 1.00 . A A . 35 MET CE 1 1 8 4709 1 1 35 MET CG C 19.426 1.104 -13.900 1.00 . A A . 35 MET CG 1 1 8 4710 1 1 35 MET H H 19.923 0.494 -10.188 1.00 . A A . 35 MET H 1 1 8 4711 1 1 35 MET HA H 21.504 0.504 -12.525 1.00 . A A . 35 MET HA 1 1 8 4712 1 1 35 MET HB2 H 18.840 1.192 -11.831 1.00 . A A . 35 MET HB2 1 1 8 4713 1 1 35 MET HB3 H 19.495 2.690 -12.441 1.00 . A A . 35 MET HB3 1 1 8 4714 1 1 35 MET HE1 H 19.877 -1.387 -13.033 1.00 . A A . 35 MET HE1 1 1 8 4715 1 1 35 MET HE2 H 18.398 -1.284 -12.076 1.00 . A A . 35 MET HE2 1 1 8 4716 1 1 35 MET HE3 H 18.496 -2.410 -13.428 1.00 . A A . 35 MET HE3 1 1 8 4717 1 1 35 MET HG2 H 19.160 1.952 -14.512 1.00 . A A . 35 MET HG2 1 1 8 4718 1 1 35 MET HG3 H 20.359 0.717 -14.285 1.00 . A A . 35 MET HG3 1 1 8 4719 1 1 35 MET N N 20.831 0.609 -10.539 1.00 . A A . 35 MET N 1 1 8 4720 1 1 35 MET O O 22.845 2.645 -12.528 1.00 . A A . 35 MET O 1 1 8 4721 1 1 35 MET SD S 18.159 -0.159 -14.179 1.00 . A A . 35 MET SD 1 1 8 4722 1 1 36 VAL C C 23.758 4.227 -10.186 1.00 . A A . 36 VAL C 1 1 8 4723 1 1 36 VAL CA C 22.291 4.544 -10.512 1.00 . A A . 36 VAL CA 1 1 8 4724 1 1 36 VAL CB C 21.563 5.231 -9.314 1.00 . A A . 36 VAL CB 1 1 8 4725 1 1 36 VAL CG1 C 22.409 6.397 -8.748 1.00 . A A . 36 VAL CG1 1 1 8 4726 1 1 36 VAL CG2 C 20.210 5.795 -9.810 1.00 . A A . 36 VAL CG2 1 1 8 4727 1 1 36 VAL H H 20.787 3.049 -10.267 1.00 . A A . 36 VAL H 1 1 8 4728 1 1 36 VAL HA H 22.256 5.178 -11.387 1.00 . A A . 36 VAL HA 1 1 8 4729 1 1 36 VAL HB H 21.371 4.509 -8.528 1.00 . A A . 36 VAL HB 1 1 8 4730 1 1 36 VAL HG11 H 22.747 7.042 -9.546 1.00 . A A . 36 VAL HG11 1 1 8 4731 1 1 36 VAL HG12 H 21.821 6.981 -8.055 1.00 . A A . 36 VAL HG12 1 1 8 4732 1 1 36 VAL HG13 H 23.271 6.012 -8.223 1.00 . A A . 36 VAL HG13 1 1 8 4733 1 1 36 VAL HG21 H 19.719 5.089 -10.463 1.00 . A A . 36 VAL HG21 1 1 8 4734 1 1 36 VAL HG22 H 19.562 5.992 -8.970 1.00 . A A . 36 VAL HG22 1 1 8 4735 1 1 36 VAL HG23 H 20.361 6.716 -10.355 1.00 . A A . 36 VAL HG23 1 1 8 4736 1 1 36 VAL N N 21.562 3.279 -10.811 1.00 . A A . 36 VAL N 1 1 8 4737 1 1 36 VAL O O 24.651 4.764 -10.813 1.00 . A A . 36 VAL O 1 1 8 4738 1 1 37 GLY C C 25.402 2.262 -7.496 1.00 . A A . 37 GLY C 1 1 8 4739 1 1 37 GLY CA C 25.354 2.996 -8.835 1.00 . A A . 37 GLY CA 1 1 8 4740 1 1 37 GLY H H 23.201 2.966 -8.747 1.00 . A A . 37 GLY H 1 1 8 4741 1 1 37 GLY HA2 H 25.767 2.354 -9.598 1.00 . A A . 37 GLY HA2 1 1 8 4742 1 1 37 GLY HA3 H 25.953 3.894 -8.762 1.00 . A A . 37 GLY HA3 1 1 8 4743 1 1 37 GLY N N 23.961 3.366 -9.219 1.00 . A A . 37 GLY N 1 1 8 4744 1 1 37 GLY O O 26.180 2.618 -6.631 1.00 . A A . 37 GLY O 1 1 8 4745 1 1 38 GLY C C 25.910 -0.150 -5.829 1.00 . A A . 38 GLY C 1 1 8 4746 1 1 38 GLY CA C 24.527 0.457 -6.095 1.00 . A A . 38 GLY CA 1 1 8 4747 1 1 38 GLY H H 23.975 1.027 -8.105 1.00 . A A . 38 GLY H 1 1 8 4748 1 1 38 GLY HA2 H 24.248 1.100 -5.274 1.00 . A A . 38 GLY HA2 1 1 8 4749 1 1 38 GLY HA3 H 23.805 -0.339 -6.194 1.00 . A A . 38 GLY HA3 1 1 8 4750 1 1 38 GLY N N 24.570 1.257 -7.364 1.00 . A A . 38 GLY N 1 1 8 4751 1 1 38 GLY O O 26.343 -0.262 -4.698 1.00 . A A . 38 GLY O 1 1 8 4752 1 1 39 VAL C C 28.769 -0.246 -7.802 1.00 . A A . 39 VAL C 1 1 8 4753 1 1 39 VAL CA C 27.906 -1.125 -6.878 1.00 . A A . 39 VAL CA 1 1 8 4754 1 1 39 VAL CB C 27.822 -2.599 -7.395 1.00 . A A . 39 VAL CB 1 1 8 4755 1 1 39 VAL CG1 C 29.123 -3.356 -7.030 1.00 . A A . 39 VAL CG1 1 1 8 4756 1 1 39 VAL CG2 C 26.630 -3.329 -6.733 1.00 . A A . 39 VAL CG2 1 1 8 4757 1 1 39 VAL H H 26.117 -0.393 -7.778 1.00 . A A . 39 VAL H 1 1 8 4758 1 1 39 VAL HA H 28.297 -1.073 -5.877 1.00 . A A . 39 VAL HA 1 1 8 4759 1 1 39 VAL HB H 27.691 -2.607 -8.467 1.00 . A A . 39 VAL HB 1 1 8 4760 1 1 39 VAL HG11 H 29.982 -2.870 -7.469 1.00 . A A . 39 VAL HG11 1 1 8 4761 1 1 39 VAL HG12 H 29.256 -3.384 -5.958 1.00 . A A . 39 VAL HG12 1 1 8 4762 1 1 39 VAL HG13 H 29.078 -4.369 -7.402 1.00 . A A . 39 VAL HG13 1 1 8 4763 1 1 39 VAL HG21 H 26.648 -3.186 -5.662 1.00 . A A . 39 VAL HG21 1 1 8 4764 1 1 39 VAL HG22 H 25.697 -2.942 -7.119 1.00 . A A . 39 VAL HG22 1 1 8 4765 1 1 39 VAL HG23 H 26.674 -4.389 -6.941 1.00 . A A . 39 VAL HG23 1 1 8 4766 1 1 39 VAL N N 26.546 -0.519 -6.911 1.00 . A A . 39 VAL N 1 1 8 4767 1 1 39 VAL O O 29.485 -0.732 -8.655 1.00 . A A . 39 VAL O 1 1 8 4768 1 1 40 VAL C C 28.903 2.192 -9.790 1.00 . A A . 40 VAL C 1 1 8 4769 1 1 40 VAL CA C 29.354 2.123 -8.311 1.00 . A A . 40 VAL CA 1 1 8 4770 1 1 40 VAL CB C 30.895 1.867 -8.207 1.00 . A A . 40 VAL CB 1 1 8 4771 1 1 40 VAL CG1 C 31.671 2.949 -8.996 1.00 . A A . 40 VAL CG1 1 1 8 4772 1 1 40 VAL CG2 C 31.332 1.927 -6.725 1.00 . A A . 40 VAL CG2 1 1 8 4773 1 1 40 VAL H H 28.028 1.311 -6.852 1.00 . A A . 40 VAL H 1 1 8 4774 1 1 40 VAL HA H 29.118 3.062 -7.830 1.00 . A A . 40 VAL HA 1 1 8 4775 1 1 40 VAL HB H 31.126 0.892 -8.597 1.00 . A A . 40 VAL HB 1 1 8 4776 1 1 40 VAL HG11 H 31.362 3.935 -8.683 1.00 . A A . 40 VAL HG11 1 1 8 4777 1 1 40 VAL HG12 H 32.733 2.846 -8.825 1.00 . A A . 40 VAL HG12 1 1 8 4778 1 1 40 VAL HG13 H 31.484 2.845 -10.055 1.00 . A A . 40 VAL HG13 1 1 8 4779 1 1 40 VAL HG21 H 31.085 2.887 -6.296 1.00 . A A . 40 VAL HG21 1 1 8 4780 1 1 40 VAL HG22 H 30.838 1.153 -6.157 1.00 . A A . 40 VAL HG22 1 1 8 4781 1 1 40 VAL HG23 H 32.400 1.777 -6.648 1.00 . A A . 40 VAL HG23 1 1 8 4782 1 1 40 VAL N N 28.637 1.039 -7.566 1.00 . A A . 40 VAL N 1 1 8 4783 1 1 40 VAL O O 29.176 1.251 -10.520 1.00 . A A . 40 VAL O 1 1 8 4784 1 1 40 VAL OXT O 28.301 3.202 -10.113 1.00 . A A . 40 VAL OXT 1 1 9 4785 1 1 1 ASP C C -2.078 20.933 -9.533 1.00 . A A . 1 ASP C 1 1 9 4786 1 1 1 ASP CA C -1.358 21.297 -8.228 1.00 . A A . 1 ASP CA 1 1 9 4787 1 1 1 ASP CB C -1.916 20.439 -7.068 1.00 . A A . 1 ASP CB 1 1 9 4788 1 1 1 ASP CG C -1.120 20.750 -5.788 1.00 . A A . 1 ASP CG 1 1 9 4789 1 1 1 ASP H1 H -2.160 23.165 -8.690 1.00 . A A . 1 ASP H1 1 1 9 4790 1 1 1 ASP H2 H -2.055 22.852 -7.025 1.00 . A A . 1 ASP H2 1 1 9 4791 1 1 1 ASP H3 H -0.655 23.229 -7.908 1.00 . A A . 1 ASP H3 1 1 9 4792 1 1 1 ASP HA H -0.298 21.120 -8.345 1.00 . A A . 1 ASP HA 1 1 9 4793 1 1 1 ASP HB2 H -2.960 20.666 -6.898 1.00 . A A . 1 ASP HB2 1 1 9 4794 1 1 1 ASP HB3 H -1.824 19.387 -7.299 1.00 . A A . 1 ASP HB3 1 1 9 4795 1 1 1 ASP N N -1.575 22.745 -7.941 1.00 . A A . 1 ASP N 1 1 9 4796 1 1 1 ASP O O -3.282 20.762 -9.554 1.00 . A A . 1 ASP O 1 1 9 4797 1 1 1 ASP OD1 O -1.501 21.704 -5.131 1.00 . A A . 1 ASP OD1 1 1 9 4798 1 1 1 ASP OD2 O -0.176 20.017 -5.543 1.00 . A A . 1 ASP OD2 1 1 9 4799 1 1 2 ALA C C -0.775 19.879 -12.814 1.00 . A A . 2 ALA C 1 1 9 4800 1 1 2 ALA CA C -1.874 20.479 -11.924 1.00 . A A . 2 ALA CA 1 1 9 4801 1 1 2 ALA CB C -2.449 21.756 -12.556 1.00 . A A . 2 ALA CB 1 1 9 4802 1 1 2 ALA H H -0.344 20.982 -10.498 1.00 . A A . 2 ALA H 1 1 9 4803 1 1 2 ALA HA H -2.656 19.743 -11.799 1.00 . A A . 2 ALA HA 1 1 9 4804 1 1 2 ALA HB1 H -3.145 22.222 -11.876 1.00 . A A . 2 ALA HB1 1 1 9 4805 1 1 2 ALA HB2 H -1.656 22.454 -12.777 1.00 . A A . 2 ALA HB2 1 1 9 4806 1 1 2 ALA HB3 H -2.968 21.509 -13.467 1.00 . A A . 2 ALA HB3 1 1 9 4807 1 1 2 ALA N N -1.307 20.828 -10.586 1.00 . A A . 2 ALA N 1 1 9 4808 1 1 2 ALA O O -0.261 20.515 -13.714 1.00 . A A . 2 ALA O 1 1 9 4809 1 1 3 GLU C C 0.045 17.418 -14.634 1.00 . A A . 3 GLU C 1 1 9 4810 1 1 3 GLU CA C 0.603 17.918 -13.293 1.00 . A A . 3 GLU CA 1 1 9 4811 1 1 3 GLU CB C 1.106 16.718 -12.463 1.00 . A A . 3 GLU CB 1 1 9 4812 1 1 3 GLU CD C 3.017 14.963 -12.690 1.00 . A A . 3 GLU CD 1 1 9 4813 1 1 3 GLU CG C 2.612 16.453 -12.790 1.00 . A A . 3 GLU CG 1 1 9 4814 1 1 3 GLU H H -0.912 18.205 -11.777 1.00 . A A . 3 GLU H 1 1 9 4815 1 1 3 GLU HA H 1.415 18.604 -13.491 1.00 . A A . 3 GLU HA 1 1 9 4816 1 1 3 GLU HB2 H 1.005 16.935 -11.410 1.00 . A A . 3 GLU HB2 1 1 9 4817 1 1 3 GLU HB3 H 0.500 15.852 -12.690 1.00 . A A . 3 GLU HB3 1 1 9 4818 1 1 3 GLU HG2 H 2.839 16.797 -13.789 1.00 . A A . 3 GLU HG2 1 1 9 4819 1 1 3 GLU HG3 H 3.222 17.014 -12.097 1.00 . A A . 3 GLU HG3 1 1 9 4820 1 1 3 GLU N N -0.451 18.648 -12.518 1.00 . A A . 3 GLU N 1 1 9 4821 1 1 3 GLU O O 0.798 17.112 -15.536 1.00 . A A . 3 GLU O 1 1 9 4822 1 1 3 GLU OE1 O 2.213 14.148 -12.263 1.00 . A A . 3 GLU OE1 1 1 9 4823 1 1 3 GLU OE2 O 4.154 14.716 -13.060 1.00 . A A . 3 GLU OE2 1 1 9 4824 1 1 4 PHE C C -1.811 15.393 -16.205 1.00 . A A . 4 PHE C 1 1 9 4825 1 1 4 PHE CA C -1.997 16.894 -15.934 1.00 . A A . 4 PHE CA 1 1 9 4826 1 1 4 PHE CB C -1.518 17.724 -17.171 1.00 . A A . 4 PHE CB 1 1 9 4827 1 1 4 PHE CD1 C -2.696 19.844 -16.429 1.00 . A A . 4 PHE CD1 1 1 9 4828 1 1 4 PHE CD2 C -0.364 19.973 -16.905 1.00 . A A . 4 PHE CD2 1 1 9 4829 1 1 4 PHE CE1 C -2.709 21.187 -16.117 1.00 . A A . 4 PHE CE1 1 1 9 4830 1 1 4 PHE CE2 C -0.377 21.317 -16.592 1.00 . A A . 4 PHE CE2 1 1 9 4831 1 1 4 PHE CG C -1.524 19.224 -16.825 1.00 . A A . 4 PHE CG 1 1 9 4832 1 1 4 PHE CZ C -1.549 21.924 -16.198 1.00 . A A . 4 PHE CZ 1 1 9 4833 1 1 4 PHE H H -1.787 17.626 -13.926 1.00 . A A . 4 PHE H 1 1 9 4834 1 1 4 PHE HA H -3.046 17.069 -15.772 1.00 . A A . 4 PHE HA 1 1 9 4835 1 1 4 PHE HB2 H -0.525 17.430 -17.482 1.00 . A A . 4 PHE HB2 1 1 9 4836 1 1 4 PHE HB3 H -2.194 17.563 -17.998 1.00 . A A . 4 PHE HB3 1 1 9 4837 1 1 4 PHE HD1 H -3.611 19.275 -16.363 1.00 . A A . 4 PHE HD1 1 1 9 4838 1 1 4 PHE HD2 H 0.561 19.508 -17.213 1.00 . A A . 4 PHE HD2 1 1 9 4839 1 1 4 PHE HE1 H -3.630 21.659 -15.808 1.00 . A A . 4 PHE HE1 1 1 9 4840 1 1 4 PHE HE2 H 0.533 21.893 -16.657 1.00 . A A . 4 PHE HE2 1 1 9 4841 1 1 4 PHE HZ H -1.557 22.976 -15.952 1.00 . A A . 4 PHE HZ 1 1 9 4842 1 1 4 PHE N N -1.262 17.356 -14.709 1.00 . A A . 4 PHE N 1 1 9 4843 1 1 4 PHE O O -1.834 14.947 -17.337 1.00 . A A . 4 PHE O 1 1 9 4844 1 1 5 ARG C C -2.809 12.541 -14.928 1.00 . A A . 5 ARG C 1 1 9 4845 1 1 5 ARG CA C -1.445 13.178 -15.225 1.00 . A A . 5 ARG CA 1 1 9 4846 1 1 5 ARG CB C -0.361 12.755 -14.183 1.00 . A A . 5 ARG CB 1 1 9 4847 1 1 5 ARG CD C 1.452 13.849 -15.580 1.00 . A A . 5 ARG CD 1 1 9 4848 1 1 5 ARG CG C 1.000 12.545 -14.893 1.00 . A A . 5 ARG CG 1 1 9 4849 1 1 5 ARG CZ C 3.601 14.900 -16.099 1.00 . A A . 5 ARG CZ 1 1 9 4850 1 1 5 ARG H H -1.632 15.097 -14.258 1.00 . A A . 5 ARG H 1 1 9 4851 1 1 5 ARG HA H -1.148 12.905 -16.228 1.00 . A A . 5 ARG HA 1 1 9 4852 1 1 5 ARG HB2 H -0.259 13.512 -13.419 1.00 . A A . 5 ARG HB2 1 1 9 4853 1 1 5 ARG HB3 H -0.632 11.826 -13.702 1.00 . A A . 5 ARG HB3 1 1 9 4854 1 1 5 ARG HD2 H 1.120 13.867 -16.608 1.00 . A A . 5 ARG HD2 1 1 9 4855 1 1 5 ARG HD3 H 1.059 14.710 -15.062 1.00 . A A . 5 ARG HD3 1 1 9 4856 1 1 5 ARG HE H 3.444 13.201 -15.090 1.00 . A A . 5 ARG HE 1 1 9 4857 1 1 5 ARG HG2 H 1.738 12.239 -14.165 1.00 . A A . 5 ARG HG2 1 1 9 4858 1 1 5 ARG HG3 H 0.909 11.761 -15.631 1.00 . A A . 5 ARG HG3 1 1 9 4859 1 1 5 ARG HH11 H 1.963 15.845 -16.763 1.00 . A A . 5 ARG HH11 1 1 9 4860 1 1 5 ARG HH12 H 3.470 16.614 -17.130 1.00 . A A . 5 ARG HH12 1 1 9 4861 1 1 5 ARG HH21 H 5.371 14.150 -15.544 1.00 . A A . 5 ARG HH21 1 1 9 4862 1 1 5 ARG HH22 H 5.432 15.635 -16.432 1.00 . A A . 5 ARG HH22 1 1 9 4863 1 1 5 ARG N N -1.636 14.660 -15.134 1.00 . A A . 5 ARG N 1 1 9 4864 1 1 5 ARG NE N 2.945 13.912 -15.543 1.00 . A A . 5 ARG NE 1 1 9 4865 1 1 5 ARG NH1 N 2.962 15.861 -16.712 1.00 . A A . 5 ARG NH1 1 1 9 4866 1 1 5 ARG NH2 N 4.903 14.894 -16.018 1.00 . A A . 5 ARG NH2 1 1 9 4867 1 1 5 ARG O O -2.997 11.832 -13.957 1.00 . A A . 5 ARG O 1 1 9 4868 1 1 6 HIS C C -5.235 10.882 -16.244 1.00 . A A . 6 HIS C 1 1 9 4869 1 1 6 HIS CA C -5.126 12.324 -15.709 1.00 . A A . 6 HIS CA 1 1 9 4870 1 1 6 HIS CB C -6.022 13.291 -16.507 1.00 . A A . 6 HIS CB 1 1 9 4871 1 1 6 HIS CD2 C -5.959 15.938 -16.708 1.00 . A A . 6 HIS CD2 1 1 9 4872 1 1 6 HIS CE1 C -5.264 16.376 -14.805 1.00 . A A . 6 HIS CE1 1 1 9 4873 1 1 6 HIS CG C -5.784 14.738 -16.041 1.00 . A A . 6 HIS CG 1 1 9 4874 1 1 6 HIS H H -3.515 13.417 -16.564 1.00 . A A . 6 HIS H 1 1 9 4875 1 1 6 HIS HA H -5.416 12.326 -14.672 1.00 . A A . 6 HIS HA 1 1 9 4876 1 1 6 HIS HB2 H -5.809 13.224 -17.563 1.00 . A A . 6 HIS HB2 1 1 9 4877 1 1 6 HIS HB3 H -7.055 13.044 -16.341 1.00 . A A . 6 HIS HB3 1 1 9 4878 1 1 6 HIS HD1 H -5.128 14.464 -14.151 1.00 . A A . 6 HIS HD1 1 1 9 4879 1 1 6 HIS HD2 H -6.314 16.036 -17.723 1.00 . A A . 6 HIS HD2 1 1 9 4880 1 1 6 HIS HE1 H -4.927 16.916 -13.933 1.00 . A A . 6 HIS HE1 1 1 9 4881 1 1 6 HIS N N -3.731 12.837 -15.810 1.00 . A A . 6 HIS N 1 1 9 4882 1 1 6 HIS ND1 N -5.353 15.086 -14.874 1.00 . A A . 6 HIS ND1 1 1 9 4883 1 1 6 HIS NE2 N -5.631 16.946 -15.925 1.00 . A A . 6 HIS NE2 1 1 9 4884 1 1 6 HIS O O -6.238 10.483 -16.805 1.00 . A A . 6 HIS O 1 1 9 4885 1 1 7 ASP C C -4.911 7.852 -15.531 1.00 . A A . 7 ASP C 1 1 9 4886 1 1 7 ASP CA C -4.080 8.728 -16.479 1.00 . A A . 7 ASP CA 1 1 9 4887 1 1 7 ASP CB C -2.593 8.290 -16.455 1.00 . A A . 7 ASP CB 1 1 9 4888 1 1 7 ASP CG C -1.818 9.024 -15.340 1.00 . A A . 7 ASP CG 1 1 9 4889 1 1 7 ASP H H -3.403 10.536 -15.582 1.00 . A A . 7 ASP H 1 1 9 4890 1 1 7 ASP HA H -4.472 8.652 -17.481 1.00 . A A . 7 ASP HA 1 1 9 4891 1 1 7 ASP HB2 H -2.522 7.229 -16.279 1.00 . A A . 7 ASP HB2 1 1 9 4892 1 1 7 ASP HB3 H -2.134 8.507 -17.410 1.00 . A A . 7 ASP HB3 1 1 9 4893 1 1 7 ASP N N -4.172 10.148 -16.038 1.00 . A A . 7 ASP N 1 1 9 4894 1 1 7 ASP O O -4.834 8.006 -14.327 1.00 . A A . 7 ASP O 1 1 9 4895 1 1 7 ASP OD1 O -1.985 8.621 -14.201 1.00 . A A . 7 ASP OD1 1 1 9 4896 1 1 7 ASP OD2 O -1.107 9.952 -15.692 1.00 . A A . 7 ASP OD2 1 1 9 4897 1 1 8 SER C C -5.683 5.067 -14.478 1.00 . A A . 8 SER C 1 1 9 4898 1 1 8 SER CA C -6.538 6.049 -15.291 1.00 . A A . 8 SER CA 1 1 9 4899 1 1 8 SER CB C -7.468 5.268 -16.231 1.00 . A A . 8 SER CB 1 1 9 4900 1 1 8 SER H H -5.696 6.892 -17.083 1.00 . A A . 8 SER H 1 1 9 4901 1 1 8 SER HA H -7.126 6.649 -14.612 1.00 . A A . 8 SER HA 1 1 9 4902 1 1 8 SER HB2 H -6.911 4.715 -16.974 1.00 . A A . 8 SER HB2 1 1 9 4903 1 1 8 SER HB3 H -8.125 4.608 -15.684 1.00 . A A . 8 SER HB3 1 1 9 4904 1 1 8 SER HG H -8.087 6.213 -17.815 1.00 . A A . 8 SER HG 1 1 9 4905 1 1 8 SER N N -5.680 6.962 -16.106 1.00 . A A . 8 SER N 1 1 9 4906 1 1 8 SER O O -4.653 4.614 -14.942 1.00 . A A . 8 SER O 1 1 9 4907 1 1 8 SER OG O -8.238 6.276 -16.869 1.00 . A A . 8 SER OG 1 1 9 4908 1 1 9 GLY C C -5.671 2.390 -12.839 1.00 . A A . 9 GLY C 1 1 9 4909 1 1 9 GLY CA C -5.408 3.830 -12.390 1.00 . A A . 9 GLY CA 1 1 9 4910 1 1 9 GLY H H -6.979 5.173 -12.977 1.00 . A A . 9 GLY H 1 1 9 4911 1 1 9 GLY HA2 H -4.348 4.037 -12.430 1.00 . A A . 9 GLY HA2 1 1 9 4912 1 1 9 GLY HA3 H -5.761 3.958 -11.377 1.00 . A A . 9 GLY HA3 1 1 9 4913 1 1 9 GLY N N -6.142 4.772 -13.287 1.00 . A A . 9 GLY N 1 1 9 4914 1 1 9 GLY O O -4.801 1.748 -13.396 1.00 . A A . 9 GLY O 1 1 9 4915 1 1 10 TYR C C -8.802 0.462 -13.062 1.00 . A A . 10 TYR C 1 1 9 4916 1 1 10 TYR CA C -7.267 0.544 -12.961 1.00 . A A . 10 TYR CA 1 1 9 4917 1 1 10 TYR CB C -6.663 -0.431 -11.875 1.00 . A A . 10 TYR CB 1 1 9 4918 1 1 10 TYR CD1 C -8.236 -2.427 -12.106 1.00 . A A . 10 TYR CD1 1 1 9 4919 1 1 10 TYR CD2 C -8.017 -1.397 -9.977 1.00 . A A . 10 TYR CD2 1 1 9 4920 1 1 10 TYR CE1 C -9.134 -3.330 -11.573 1.00 . A A . 10 TYR CE1 1 1 9 4921 1 1 10 TYR CE2 C -8.911 -2.299 -9.448 1.00 . A A . 10 TYR CE2 1 1 9 4922 1 1 10 TYR CG C -7.669 -1.451 -11.308 1.00 . A A . 10 TYR CG 1 1 9 4923 1 1 10 TYR CZ C -9.477 -3.270 -10.240 1.00 . A A . 10 TYR CZ 1 1 9 4924 1 1 10 TYR H H -7.518 2.514 -12.124 1.00 . A A . 10 TYR H 1 1 9 4925 1 1 10 TYR HA H -6.846 0.314 -13.929 1.00 . A A . 10 TYR HA 1 1 9 4926 1 1 10 TYR HB2 H -5.847 -0.982 -12.321 1.00 . A A . 10 TYR HB2 1 1 9 4927 1 1 10 TYR HB3 H -6.260 0.144 -11.054 1.00 . A A . 10 TYR HB3 1 1 9 4928 1 1 10 TYR HD1 H -7.978 -2.486 -13.154 1.00 . A A . 10 TYR HD1 1 1 9 4929 1 1 10 TYR HD2 H -7.585 -0.639 -9.343 1.00 . A A . 10 TYR HD2 1 1 9 4930 1 1 10 TYR HE1 H -9.577 -4.085 -12.202 1.00 . A A . 10 TYR HE1 1 1 9 4931 1 1 10 TYR HE2 H -9.167 -2.244 -8.402 1.00 . A A . 10 TYR HE2 1 1 9 4932 1 1 10 TYR HH H -11.199 -3.711 -9.551 1.00 . A A . 10 TYR HH 1 1 9 4933 1 1 10 TYR N N -6.871 1.934 -12.577 1.00 . A A . 10 TYR N 1 1 9 4934 1 1 10 TYR O O -9.321 0.287 -14.148 1.00 . A A . 10 TYR O 1 1 9 4935 1 1 10 TYR OH O -10.372 -4.172 -9.704 1.00 . A A . 10 TYR OH 1 1 9 4936 1 1 11 GLU C C -11.581 0.967 -10.620 1.00 . A A . 11 GLU C 1 1 9 4937 1 1 11 GLU CA C -10.982 0.520 -11.959 1.00 . A A . 11 GLU CA 1 1 9 4938 1 1 11 GLU CB C -11.434 -0.939 -12.260 1.00 . A A . 11 GLU CB 1 1 9 4939 1 1 11 GLU CD C -12.118 -0.593 -14.661 1.00 . A A . 11 GLU CD 1 1 9 4940 1 1 11 GLU CG C -12.623 -0.932 -13.245 1.00 . A A . 11 GLU CG 1 1 9 4941 1 1 11 GLU H H -9.013 0.731 -11.101 1.00 . A A . 11 GLU H 1 1 9 4942 1 1 11 GLU HA H -11.339 1.196 -12.722 1.00 . A A . 11 GLU HA 1 1 9 4943 1 1 11 GLU HB2 H -10.623 -1.494 -12.702 1.00 . A A . 11 GLU HB2 1 1 9 4944 1 1 11 GLU HB3 H -11.728 -1.442 -11.351 1.00 . A A . 11 GLU HB3 1 1 9 4945 1 1 11 GLU HG2 H -13.087 -1.907 -13.263 1.00 . A A . 11 GLU HG2 1 1 9 4946 1 1 11 GLU HG3 H -13.364 -0.206 -12.940 1.00 . A A . 11 GLU HG3 1 1 9 4947 1 1 11 GLU N N -9.485 0.589 -11.948 1.00 . A A . 11 GLU N 1 1 9 4948 1 1 11 GLU O O -12.489 1.777 -10.605 1.00 . A A . 11 GLU O 1 1 9 4949 1 1 11 GLU OE1 O -11.538 -1.485 -15.259 1.00 . A A . 11 GLU OE1 1 1 9 4950 1 1 11 GLU OE2 O -12.336 0.539 -15.064 1.00 . A A . 11 GLU OE2 1 1 9 4951 1 1 12 VAL C C -11.111 2.214 -7.806 1.00 . A A . 12 VAL C 1 1 9 4952 1 1 12 VAL CA C -11.591 0.812 -8.190 1.00 . A A . 12 VAL CA 1 1 9 4953 1 1 12 VAL CB C -11.109 -0.235 -7.128 1.00 . A A . 12 VAL CB 1 1 9 4954 1 1 12 VAL CG1 C -11.549 -1.657 -7.552 1.00 . A A . 12 VAL CG1 1 1 9 4955 1 1 12 VAL CG2 C -9.574 -0.155 -6.916 1.00 . A A . 12 VAL CG2 1 1 9 4956 1 1 12 VAL H H -10.336 -0.210 -9.595 1.00 . A A . 12 VAL H 1 1 9 4957 1 1 12 VAL HA H -12.666 0.809 -8.212 1.00 . A A . 12 VAL HA 1 1 9 4958 1 1 12 VAL HB H -11.591 -0.020 -6.185 1.00 . A A . 12 VAL HB 1 1 9 4959 1 1 12 VAL HG11 H -11.370 -1.825 -8.603 1.00 . A A . 12 VAL HG11 1 1 9 4960 1 1 12 VAL HG12 H -11.017 -2.405 -6.982 1.00 . A A . 12 VAL HG12 1 1 9 4961 1 1 12 VAL HG13 H -12.607 -1.776 -7.366 1.00 . A A . 12 VAL HG13 1 1 9 4962 1 1 12 VAL HG21 H -9.069 -0.009 -7.857 1.00 . A A . 12 VAL HG21 1 1 9 4963 1 1 12 VAL HG22 H -9.336 0.678 -6.270 1.00 . A A . 12 VAL HG22 1 1 9 4964 1 1 12 VAL HG23 H -9.208 -1.058 -6.455 1.00 . A A . 12 VAL HG23 1 1 9 4965 1 1 12 VAL N N -11.067 0.435 -9.538 1.00 . A A . 12 VAL N 1 1 9 4966 1 1 12 VAL O O -10.610 2.958 -8.627 1.00 . A A . 12 VAL O 1 1 9 4967 1 1 13 HIS C C -9.375 3.999 -6.134 1.00 . A A . 13 HIS C 1 1 9 4968 1 1 13 HIS CA C -10.891 3.824 -5.976 1.00 . A A . 13 HIS CA 1 1 9 4969 1 1 13 HIS CB C -11.318 3.827 -4.501 1.00 . A A . 13 HIS CB 1 1 9 4970 1 1 13 HIS CD2 C -13.429 5.389 -4.164 1.00 . A A . 13 HIS CD2 1 1 9 4971 1 1 13 HIS CE1 C -14.905 3.958 -4.434 1.00 . A A . 13 HIS CE1 1 1 9 4972 1 1 13 HIS CG C -12.803 4.180 -4.413 1.00 . A A . 13 HIS CG 1 1 9 4973 1 1 13 HIS H H -11.704 1.831 -5.975 1.00 . A A . 13 HIS H 1 1 9 4974 1 1 13 HIS HA H -11.388 4.614 -6.515 1.00 . A A . 13 HIS HA 1 1 9 4975 1 1 13 HIS HB2 H -11.174 2.844 -4.076 1.00 . A A . 13 HIS HB2 1 1 9 4976 1 1 13 HIS HB3 H -10.751 4.550 -3.939 1.00 . A A . 13 HIS HB3 1 1 9 4977 1 1 13 HIS HD1 H -13.668 2.388 -4.763 1.00 . A A . 13 HIS HD1 1 1 9 4978 1 1 13 HIS HD2 H -12.917 6.323 -3.983 1.00 . A A . 13 HIS HD2 1 1 9 4979 1 1 13 HIS HE1 H -15.870 3.479 -4.521 1.00 . A A . 13 HIS HE1 1 1 9 4980 1 1 13 HIS N N -11.292 2.509 -6.548 1.00 . A A . 13 HIS N 1 1 9 4981 1 1 13 HIS ND1 N -13.774 3.343 -4.571 1.00 . A A . 13 HIS ND1 1 1 9 4982 1 1 13 HIS NE2 N -14.738 5.233 -4.181 1.00 . A A . 13 HIS NE2 1 1 9 4983 1 1 13 HIS O O -8.922 4.526 -7.132 1.00 . A A . 13 HIS O 1 1 9 4984 1 1 14 HIS C C -6.474 2.600 -4.358 1.00 . A A . 14 HIS C 1 1 9 4985 1 1 14 HIS CA C -7.147 3.674 -5.208 1.00 . A A . 14 HIS CA 1 1 9 4986 1 1 14 HIS CB C -6.706 5.083 -4.705 1.00 . A A . 14 HIS CB 1 1 9 4987 1 1 14 HIS CD2 C -8.719 6.815 -4.779 1.00 . A A . 14 HIS CD2 1 1 9 4988 1 1 14 HIS CE1 C -9.319 6.664 -2.801 1.00 . A A . 14 HIS CE1 1 1 9 4989 1 1 14 HIS CG C -7.886 5.902 -4.156 1.00 . A A . 14 HIS CG 1 1 9 4990 1 1 14 HIS H H -9.048 3.151 -4.368 1.00 . A A . 14 HIS H 1 1 9 4991 1 1 14 HIS HA H -6.841 3.492 -6.220 1.00 . A A . 14 HIS HA 1 1 9 4992 1 1 14 HIS HB2 H -5.981 4.972 -3.918 1.00 . A A . 14 HIS HB2 1 1 9 4993 1 1 14 HIS HB3 H -6.256 5.637 -5.514 1.00 . A A . 14 HIS HB3 1 1 9 4994 1 1 14 HIS HD1 H -7.935 5.303 -2.227 1.00 . A A . 14 HIS HD1 1 1 9 4995 1 1 14 HIS HD2 H -8.653 7.102 -5.818 1.00 . A A . 14 HIS HD2 1 1 9 4996 1 1 14 HIS HE1 H -9.856 6.812 -1.875 1.00 . A A . 14 HIS HE1 1 1 9 4997 1 1 14 HIS N N -8.633 3.557 -5.152 1.00 . A A . 14 HIS N 1 1 9 4998 1 1 14 HIS ND1 N -8.313 5.861 -2.938 1.00 . A A . 14 HIS ND1 1 1 9 4999 1 1 14 HIS NE2 N -9.606 7.279 -3.922 1.00 . A A . 14 HIS NE2 1 1 9 5000 1 1 14 HIS O O -5.268 2.563 -4.247 1.00 . A A . 14 HIS O 1 1 9 5001 1 1 15 GLN C C -5.703 -0.182 -3.757 1.00 . A A . 15 GLN C 1 1 9 5002 1 1 15 GLN CA C -6.693 0.647 -2.923 1.00 . A A . 15 GLN CA 1 1 9 5003 1 1 15 GLN CB C -7.863 -0.221 -2.419 1.00 . A A . 15 GLN CB 1 1 9 5004 1 1 15 GLN CD C -8.459 -1.716 -0.491 1.00 . A A . 15 GLN CD 1 1 9 5005 1 1 15 GLN CG C -7.338 -1.291 -1.447 1.00 . A A . 15 GLN CG 1 1 9 5006 1 1 15 GLN H H -8.222 1.826 -3.931 1.00 . A A . 15 GLN H 1 1 9 5007 1 1 15 GLN HA H -6.151 1.099 -2.104 1.00 . A A . 15 GLN HA 1 1 9 5008 1 1 15 GLN HB2 H -8.581 0.412 -1.920 1.00 . A A . 15 GLN HB2 1 1 9 5009 1 1 15 GLN HB3 H -8.353 -0.699 -3.255 1.00 . A A . 15 GLN HB3 1 1 9 5010 1 1 15 GLN HE21 H -7.905 -0.445 0.930 1.00 . A A . 15 GLN HE21 1 1 9 5011 1 1 15 GLN HE22 H -9.261 -1.399 1.297 1.00 . A A . 15 GLN HE22 1 1 9 5012 1 1 15 GLN HG2 H -7.010 -2.156 -2.005 1.00 . A A . 15 GLN HG2 1 1 9 5013 1 1 15 GLN HG3 H -6.510 -0.910 -0.865 1.00 . A A . 15 GLN HG3 1 1 9 5014 1 1 15 GLN N N -7.262 1.739 -3.781 1.00 . A A . 15 GLN N 1 1 9 5015 1 1 15 GLN NE2 N -8.549 -1.139 0.675 1.00 . A A . 15 GLN NE2 1 1 9 5016 1 1 15 GLN O O -4.623 -0.526 -3.315 1.00 . A A . 15 GLN O 1 1 9 5017 1 1 15 GLN OE1 O -9.262 -2.574 -0.797 1.00 . A A . 15 GLN OE1 1 1 9 5018 1 1 16 LYS C C -3.930 -0.580 -6.112 1.00 . A A . 16 LYS C 1 1 9 5019 1 1 16 LYS CA C -5.283 -1.261 -5.899 1.00 . A A . 16 LYS CA 1 1 9 5020 1 1 16 LYS CB C -6.029 -1.380 -7.243 1.00 . A A . 16 LYS CB 1 1 9 5021 1 1 16 LYS CD C -5.187 -3.717 -7.694 1.00 . A A . 16 LYS CD 1 1 9 5022 1 1 16 LYS CE C -5.465 -4.720 -8.834 1.00 . A A . 16 LYS CE 1 1 9 5023 1 1 16 LYS CG C -5.234 -2.269 -8.231 1.00 . A A . 16 LYS CG 1 1 9 5024 1 1 16 LYS H H -7.001 -0.160 -5.251 1.00 . A A . 16 LYS H 1 1 9 5025 1 1 16 LYS HA H -5.116 -2.231 -5.468 1.00 . A A . 16 LYS HA 1 1 9 5026 1 1 16 LYS HB2 H -7.010 -1.804 -7.077 1.00 . A A . 16 LYS HB2 1 1 9 5027 1 1 16 LYS HB3 H -6.152 -0.395 -7.670 1.00 . A A . 16 LYS HB3 1 1 9 5028 1 1 16 LYS HD2 H -4.208 -3.892 -7.271 1.00 . A A . 16 LYS HD2 1 1 9 5029 1 1 16 LYS HD3 H -5.920 -3.846 -6.910 1.00 . A A . 16 LYS HD3 1 1 9 5030 1 1 16 LYS HE2 H -4.767 -4.579 -9.646 1.00 . A A . 16 LYS HE2 1 1 9 5031 1 1 16 LYS HE3 H -5.374 -5.731 -8.464 1.00 . A A . 16 LYS HE3 1 1 9 5032 1 1 16 LYS HG2 H -5.703 -2.237 -9.202 1.00 . A A . 16 LYS HG2 1 1 9 5033 1 1 16 LYS HG3 H -4.226 -1.894 -8.341 1.00 . A A . 16 LYS HG3 1 1 9 5034 1 1 16 LYS HZ1 H -7.313 -3.767 -8.828 1.00 . A A . 16 LYS HZ1 1 1 9 5035 1 1 16 LYS HZ2 H -6.812 -4.283 -10.365 1.00 . A A . 16 LYS HZ2 1 1 9 5036 1 1 16 LYS HZ3 H -7.392 -5.412 -9.237 1.00 . A A . 16 LYS HZ3 1 1 9 5037 1 1 16 LYS N N -6.121 -0.468 -4.961 1.00 . A A . 16 LYS N 1 1 9 5038 1 1 16 LYS NZ N -6.849 -4.533 -9.356 1.00 . A A . 16 LYS NZ 1 1 9 5039 1 1 16 LYS O O -2.891 -1.184 -5.927 1.00 . A A . 16 LYS O 1 1 9 5040 1 1 17 LEU C C -1.907 1.521 -5.432 1.00 . A A . 17 LEU C 1 1 9 5041 1 1 17 LEU CA C -2.730 1.427 -6.723 1.00 . A A . 17 LEU CA 1 1 9 5042 1 1 17 LEU CB C -3.136 2.824 -7.310 1.00 . A A . 17 LEU CB 1 1 9 5043 1 1 17 LEU CD1 C -1.645 4.413 -5.981 1.00 . A A . 17 LEU CD1 1 1 9 5044 1 1 17 LEU CD2 C -3.881 5.171 -6.884 1.00 . A A . 17 LEU CD2 1 1 9 5045 1 1 17 LEU CG C -3.113 3.977 -6.287 1.00 . A A . 17 LEU CG 1 1 9 5046 1 1 17 LEU H H -4.850 1.123 -6.588 1.00 . A A . 17 LEU H 1 1 9 5047 1 1 17 LEU HA H -2.160 0.888 -7.463 1.00 . A A . 17 LEU HA 1 1 9 5048 1 1 17 LEU HB2 H -2.474 3.064 -8.129 1.00 . A A . 17 LEU HB2 1 1 9 5049 1 1 17 LEU HB3 H -4.137 2.747 -7.713 1.00 . A A . 17 LEU HB3 1 1 9 5050 1 1 17 LEU HD11 H -0.947 3.913 -6.639 1.00 . A A . 17 LEU HD11 1 1 9 5051 1 1 17 LEU HD12 H -1.518 5.478 -6.104 1.00 . A A . 17 LEU HD12 1 1 9 5052 1 1 17 LEU HD13 H -1.391 4.158 -4.962 1.00 . A A . 17 LEU HD13 1 1 9 5053 1 1 17 LEU HD21 H -4.884 4.870 -7.145 1.00 . A A . 17 LEU HD21 1 1 9 5054 1 1 17 LEU HD22 H -3.931 5.977 -6.168 1.00 . A A . 17 LEU HD22 1 1 9 5055 1 1 17 LEU HD23 H -3.382 5.525 -7.776 1.00 . A A . 17 LEU HD23 1 1 9 5056 1 1 17 LEU HG H -3.618 3.638 -5.399 1.00 . A A . 17 LEU HG 1 1 9 5057 1 1 17 LEU N N -3.988 0.675 -6.480 1.00 . A A . 17 LEU N 1 1 9 5058 1 1 17 LEU O O -0.709 1.402 -5.490 1.00 . A A . 17 LEU O 1 1 9 5059 1 1 18 VAL C C -0.878 0.606 -2.843 1.00 . A A . 18 VAL C 1 1 9 5060 1 1 18 VAL CA C -1.815 1.824 -3.004 1.00 . A A . 18 VAL CA 1 1 9 5061 1 1 18 VAL CB C -2.918 1.900 -1.901 1.00 . A A . 18 VAL CB 1 1 9 5062 1 1 18 VAL CG1 C -2.419 1.418 -0.534 1.00 . A A . 18 VAL CG1 1 1 9 5063 1 1 18 VAL CG2 C -3.437 3.347 -1.780 1.00 . A A . 18 VAL CG2 1 1 9 5064 1 1 18 VAL H H -3.508 1.826 -4.306 1.00 . A A . 18 VAL H 1 1 9 5065 1 1 18 VAL HA H -1.211 2.722 -3.011 1.00 . A A . 18 VAL HA 1 1 9 5066 1 1 18 VAL HB H -3.750 1.280 -2.186 1.00 . A A . 18 VAL HB 1 1 9 5067 1 1 18 VAL HG11 H -1.463 1.863 -0.303 1.00 . A A . 18 VAL HG11 1 1 9 5068 1 1 18 VAL HG12 H -3.134 1.688 0.229 1.00 . A A . 18 VAL HG12 1 1 9 5069 1 1 18 VAL HG13 H -2.321 0.342 -0.546 1.00 . A A . 18 VAL HG13 1 1 9 5070 1 1 18 VAL HG21 H -3.601 3.772 -2.760 1.00 . A A . 18 VAL HG21 1 1 9 5071 1 1 18 VAL HG22 H -4.375 3.352 -1.244 1.00 . A A . 18 VAL HG22 1 1 9 5072 1 1 18 VAL HG23 H -2.727 3.963 -1.248 1.00 . A A . 18 VAL HG23 1 1 9 5073 1 1 18 VAL N N -2.539 1.725 -4.308 1.00 . A A . 18 VAL N 1 1 9 5074 1 1 18 VAL O O 0.314 0.752 -2.651 1.00 . A A . 18 VAL O 1 1 9 5075 1 1 19 PHE C C 0.440 -1.887 -3.887 1.00 . A A . 19 PHE C 1 1 9 5076 1 1 19 PHE CA C -0.639 -1.820 -2.800 1.00 . A A . 19 PHE CA 1 1 9 5077 1 1 19 PHE CB C -1.584 -3.036 -2.908 1.00 . A A . 19 PHE CB 1 1 9 5078 1 1 19 PHE CD1 C -1.839 -3.282 -0.388 1.00 . A A . 19 PHE CD1 1 1 9 5079 1 1 19 PHE CD2 C -3.821 -3.140 -1.704 1.00 . A A . 19 PHE CD2 1 1 9 5080 1 1 19 PHE CE1 C -2.604 -3.389 0.755 1.00 . A A . 19 PHE CE1 1 1 9 5081 1 1 19 PHE CE2 C -4.584 -3.247 -0.559 1.00 . A A . 19 PHE CE2 1 1 9 5082 1 1 19 PHE CG C -2.440 -3.156 -1.630 1.00 . A A . 19 PHE CG 1 1 9 5083 1 1 19 PHE CZ C -3.978 -3.373 0.670 1.00 . A A . 19 PHE CZ 1 1 9 5084 1 1 19 PHE H H -2.410 -0.612 -3.104 1.00 . A A . 19 PHE H 1 1 9 5085 1 1 19 PHE HA H -0.145 -1.803 -1.843 1.00 . A A . 19 PHE HA 1 1 9 5086 1 1 19 PHE HB2 H -2.235 -2.925 -3.763 1.00 . A A . 19 PHE HB2 1 1 9 5087 1 1 19 PHE HB3 H -1.013 -3.946 -3.025 1.00 . A A . 19 PHE HB3 1 1 9 5088 1 1 19 PHE HD1 H -0.762 -3.299 -0.309 1.00 . A A . 19 PHE HD1 1 1 9 5089 1 1 19 PHE HD2 H -4.309 -3.043 -2.663 1.00 . A A . 19 PHE HD2 1 1 9 5090 1 1 19 PHE HE1 H -2.123 -3.487 1.718 1.00 . A A . 19 PHE HE1 1 1 9 5091 1 1 19 PHE HE2 H -5.661 -3.237 -0.625 1.00 . A A . 19 PHE HE2 1 1 9 5092 1 1 19 PHE HZ H -4.578 -3.456 1.564 1.00 . A A . 19 PHE HZ 1 1 9 5093 1 1 19 PHE N N -1.449 -0.567 -2.939 1.00 . A A . 19 PHE N 1 1 9 5094 1 1 19 PHE O O 1.592 -2.166 -3.613 1.00 . A A . 19 PHE O 1 1 9 5095 1 1 20 PHE C C 2.187 -0.751 -5.943 1.00 . A A . 20 PHE C 1 1 9 5096 1 1 20 PHE CA C 0.967 -1.645 -6.261 1.00 . A A . 20 PHE CA 1 1 9 5097 1 1 20 PHE CB C 0.144 -1.157 -7.501 1.00 . A A . 20 PHE CB 1 1 9 5098 1 1 20 PHE CD1 C 1.914 -0.621 -9.214 1.00 . A A . 20 PHE CD1 1 1 9 5099 1 1 20 PHE CD2 C 0.619 1.189 -8.368 1.00 . A A . 20 PHE CD2 1 1 9 5100 1 1 20 PHE CE1 C 2.617 0.254 -10.013 1.00 . A A . 20 PHE CE1 1 1 9 5101 1 1 20 PHE CE2 C 1.319 2.067 -9.165 1.00 . A A . 20 PHE CE2 1 1 9 5102 1 1 20 PHE CG C 0.913 -0.162 -8.387 1.00 . A A . 20 PHE CG 1 1 9 5103 1 1 20 PHE CZ C 2.320 1.601 -9.990 1.00 . A A . 20 PHE CZ 1 1 9 5104 1 1 20 PHE H H -0.912 -1.403 -5.257 1.00 . A A . 20 PHE H 1 1 9 5105 1 1 20 PHE HA H 1.306 -2.661 -6.413 1.00 . A A . 20 PHE HA 1 1 9 5106 1 1 20 PHE HB2 H -0.125 -2.011 -8.106 1.00 . A A . 20 PHE HB2 1 1 9 5107 1 1 20 PHE HB3 H -0.768 -0.686 -7.170 1.00 . A A . 20 PHE HB3 1 1 9 5108 1 1 20 PHE HD1 H 2.145 -1.675 -9.233 1.00 . A A . 20 PHE HD1 1 1 9 5109 1 1 20 PHE HD2 H -0.162 1.573 -7.731 1.00 . A A . 20 PHE HD2 1 1 9 5110 1 1 20 PHE HE1 H 3.399 -0.119 -10.656 1.00 . A A . 20 PHE HE1 1 1 9 5111 1 1 20 PHE HE2 H 1.077 3.119 -9.137 1.00 . A A . 20 PHE HE2 1 1 9 5112 1 1 20 PHE HZ H 2.870 2.288 -10.616 1.00 . A A . 20 PHE HZ 1 1 9 5113 1 1 20 PHE N N 0.028 -1.621 -5.100 1.00 . A A . 20 PHE N 1 1 9 5114 1 1 20 PHE O O 3.319 -1.182 -6.013 1.00 . A A . 20 PHE O 1 1 9 5115 1 1 21 ALA C C 3.885 0.937 -4.188 1.00 . A A . 21 ALA C 1 1 9 5116 1 1 21 ALA CA C 2.936 1.489 -5.244 1.00 . A A . 21 ALA CA 1 1 9 5117 1 1 21 ALA CB C 2.229 2.749 -4.723 1.00 . A A . 21 ALA CB 1 1 9 5118 1 1 21 ALA H H 0.963 0.733 -5.543 1.00 . A A . 21 ALA H 1 1 9 5119 1 1 21 ALA HA H 3.512 1.715 -6.131 1.00 . A A . 21 ALA HA 1 1 9 5120 1 1 21 ALA HB1 H 1.542 3.124 -5.469 1.00 . A A . 21 ALA HB1 1 1 9 5121 1 1 21 ALA HB2 H 1.671 2.522 -3.826 1.00 . A A . 21 ALA HB2 1 1 9 5122 1 1 21 ALA HB3 H 2.952 3.518 -4.498 1.00 . A A . 21 ALA HB3 1 1 9 5123 1 1 21 ALA N N 1.898 0.473 -5.589 1.00 . A A . 21 ALA N 1 1 9 5124 1 1 21 ALA O O 5.078 1.097 -4.300 1.00 . A A . 21 ALA O 1 1 9 5125 1 1 22 GLU C C 5.238 -1.216 -2.736 1.00 . A A . 22 GLU C 1 1 9 5126 1 1 22 GLU CA C 4.189 -0.282 -2.100 1.00 . A A . 22 GLU CA 1 1 9 5127 1 1 22 GLU CB C 3.266 -1.054 -1.135 1.00 . A A . 22 GLU CB 1 1 9 5128 1 1 22 GLU CD C 3.067 -2.149 1.099 1.00 . A A . 22 GLU CD 1 1 9 5129 1 1 22 GLU CG C 3.951 -1.240 0.229 1.00 . A A . 22 GLU CG 1 1 9 5130 1 1 22 GLU H H 2.367 0.229 -3.153 1.00 . A A . 22 GLU H 1 1 9 5131 1 1 22 GLU HA H 4.713 0.525 -1.607 1.00 . A A . 22 GLU HA 1 1 9 5132 1 1 22 GLU HB2 H 2.349 -0.500 -0.997 1.00 . A A . 22 GLU HB2 1 1 9 5133 1 1 22 GLU HB3 H 3.021 -2.021 -1.552 1.00 . A A . 22 GLU HB3 1 1 9 5134 1 1 22 GLU HG2 H 4.922 -1.697 0.105 1.00 . A A . 22 GLU HG2 1 1 9 5135 1 1 22 GLU HG3 H 4.073 -0.285 0.720 1.00 . A A . 22 GLU HG3 1 1 9 5136 1 1 22 GLU N N 3.339 0.304 -3.185 1.00 . A A . 22 GLU N 1 1 9 5137 1 1 22 GLU O O 6.425 -1.087 -2.497 1.00 . A A . 22 GLU O 1 1 9 5138 1 1 22 GLU OE1 O 2.204 -1.596 1.763 1.00 . A A . 22 GLU OE1 1 1 9 5139 1 1 22 GLU OE2 O 3.302 -3.346 1.050 1.00 . A A . 22 GLU OE2 1 1 9 5140 1 1 23 ASP C C 6.761 -2.349 -4.975 1.00 . A A . 23 ASP C 1 1 9 5141 1 1 23 ASP CA C 5.646 -3.105 -4.238 1.00 . A A . 23 ASP CA 1 1 9 5142 1 1 23 ASP CB C 4.826 -3.910 -5.256 1.00 . A A . 23 ASP CB 1 1 9 5143 1 1 23 ASP CG C 5.613 -5.170 -5.663 1.00 . A A . 23 ASP CG 1 1 9 5144 1 1 23 ASP H H 3.781 -2.161 -3.675 1.00 . A A . 23 ASP H 1 1 9 5145 1 1 23 ASP HA H 6.087 -3.756 -3.500 1.00 . A A . 23 ASP HA 1 1 9 5146 1 1 23 ASP HB2 H 3.867 -4.184 -4.844 1.00 . A A . 23 ASP HB2 1 1 9 5147 1 1 23 ASP HB3 H 4.640 -3.317 -6.138 1.00 . A A . 23 ASP HB3 1 1 9 5148 1 1 23 ASP N N 4.751 -2.127 -3.539 1.00 . A A . 23 ASP N 1 1 9 5149 1 1 23 ASP O O 7.936 -2.615 -4.831 1.00 . A A . 23 ASP O 1 1 9 5150 1 1 23 ASP OD1 O 6.520 -5.012 -6.467 1.00 . A A . 23 ASP OD1 1 1 9 5151 1 1 23 ASP OD2 O 5.264 -6.220 -5.148 1.00 . A A . 23 ASP OD2 1 1 9 5152 1 1 24 VAL C C 8.251 0.138 -5.717 1.00 . A A . 24 VAL C 1 1 9 5153 1 1 24 VAL CA C 7.177 -0.532 -6.582 1.00 . A A . 24 VAL CA 1 1 9 5154 1 1 24 VAL CB C 6.246 0.495 -7.261 1.00 . A A . 24 VAL CB 1 1 9 5155 1 1 24 VAL CG1 C 7.013 1.370 -8.237 1.00 . A A . 24 VAL CG1 1 1 9 5156 1 1 24 VAL CG2 C 5.125 -0.242 -8.025 1.00 . A A . 24 VAL CG2 1 1 9 5157 1 1 24 VAL H H 5.334 -1.282 -5.799 1.00 . A A . 24 VAL H 1 1 9 5158 1 1 24 VAL HA H 7.666 -1.141 -7.326 1.00 . A A . 24 VAL HA 1 1 9 5159 1 1 24 VAL HB H 5.803 1.135 -6.514 1.00 . A A . 24 VAL HB 1 1 9 5160 1 1 24 VAL HG11 H 7.862 1.801 -7.737 1.00 . A A . 24 VAL HG11 1 1 9 5161 1 1 24 VAL HG12 H 7.350 0.784 -9.079 1.00 . A A . 24 VAL HG12 1 1 9 5162 1 1 24 VAL HG13 H 6.365 2.161 -8.586 1.00 . A A . 24 VAL HG13 1 1 9 5163 1 1 24 VAL HG21 H 5.081 -1.288 -7.755 1.00 . A A . 24 VAL HG21 1 1 9 5164 1 1 24 VAL HG22 H 4.182 0.217 -7.774 1.00 . A A . 24 VAL HG22 1 1 9 5165 1 1 24 VAL HG23 H 5.273 -0.180 -9.090 1.00 . A A . 24 VAL HG23 1 1 9 5166 1 1 24 VAL N N 6.303 -1.411 -5.755 1.00 . A A . 24 VAL N 1 1 9 5167 1 1 24 VAL O O 9.416 0.123 -6.053 1.00 . A A . 24 VAL O 1 1 9 5168 1 1 25 GLY C C 9.979 0.549 -3.438 1.00 . A A . 25 GLY C 1 1 9 5169 1 1 25 GLY CA C 8.734 1.403 -3.666 1.00 . A A . 25 GLY CA 1 1 9 5170 1 1 25 GLY H H 6.858 0.663 -4.445 1.00 . A A . 25 GLY H 1 1 9 5171 1 1 25 GLY HA2 H 9.022 2.361 -4.071 1.00 . A A . 25 GLY HA2 1 1 9 5172 1 1 25 GLY HA3 H 8.223 1.544 -2.725 1.00 . A A . 25 GLY HA3 1 1 9 5173 1 1 25 GLY N N 7.816 0.705 -4.625 1.00 . A A . 25 GLY N 1 1 9 5174 1 1 25 GLY O O 11.096 1.014 -3.561 1.00 . A A . 25 GLY O 1 1 9 5175 1 1 26 SER C C 11.590 -1.959 -4.156 1.00 . A A . 26 SER C 1 1 9 5176 1 1 26 SER CA C 10.816 -1.665 -2.860 1.00 . A A . 26 SER CA 1 1 9 5177 1 1 26 SER CB C 10.190 -2.958 -2.294 1.00 . A A . 26 SER CB 1 1 9 5178 1 1 26 SER H H 8.780 -0.959 -3.035 1.00 . A A . 26 SER H 1 1 9 5179 1 1 26 SER HA H 11.491 -1.238 -2.141 1.00 . A A . 26 SER HA 1 1 9 5180 1 1 26 SER HB2 H 9.605 -2.753 -1.410 1.00 . A A . 26 SER HB2 1 1 9 5181 1 1 26 SER HB3 H 9.583 -3.466 -3.028 1.00 . A A . 26 SER HB3 1 1 9 5182 1 1 26 SER HG H 12.110 -3.326 -2.151 1.00 . A A . 26 SER HG 1 1 9 5183 1 1 26 SER N N 9.718 -0.688 -3.113 1.00 . A A . 26 SER N 1 1 9 5184 1 1 26 SER O O 12.781 -1.739 -4.244 1.00 . A A . 26 SER O 1 1 9 5185 1 1 26 SER OG O 11.293 -3.786 -1.944 1.00 . A A . 26 SER OG 1 1 9 5186 1 1 27 ASN C C 12.173 -1.599 -7.113 1.00 . A A . 27 ASN C 1 1 9 5187 1 1 27 ASN CA C 11.470 -2.788 -6.460 1.00 . A A . 27 ASN CA 1 1 9 5188 1 1 27 ASN CB C 10.331 -3.316 -7.356 1.00 . A A . 27 ASN CB 1 1 9 5189 1 1 27 ASN CG C 9.761 -4.634 -6.804 1.00 . A A . 27 ASN CG 1 1 9 5190 1 1 27 ASN H H 9.917 -2.577 -4.998 1.00 . A A . 27 ASN H 1 1 9 5191 1 1 27 ASN HA H 12.226 -3.534 -6.289 1.00 . A A . 27 ASN HA 1 1 9 5192 1 1 27 ASN HB2 H 9.530 -2.592 -7.405 1.00 . A A . 27 ASN HB2 1 1 9 5193 1 1 27 ASN HB3 H 10.703 -3.486 -8.350 1.00 . A A . 27 ASN HB3 1 1 9 5194 1 1 27 ASN HD21 H 9.906 -5.573 -8.548 1.00 . A A . 27 ASN HD21 1 1 9 5195 1 1 27 ASN HD22 H 9.272 -6.501 -7.276 1.00 . A A . 27 ASN HD22 1 1 9 5196 1 1 27 ASN N N 10.873 -2.442 -5.136 1.00 . A A . 27 ASN N 1 1 9 5197 1 1 27 ASN ND2 N 9.637 -5.654 -7.609 1.00 . A A . 27 ASN ND2 1 1 9 5198 1 1 27 ASN O O 13.386 -1.573 -7.182 1.00 . A A . 27 ASN O 1 1 9 5199 1 1 27 ASN OD1 O 9.424 -4.754 -5.643 1.00 . A A . 27 ASN OD1 1 1 9 5200 1 1 28 LYS C C 13.070 1.141 -7.308 1.00 . A A . 28 LYS C 1 1 9 5201 1 1 28 LYS CA C 11.986 0.569 -8.233 1.00 . A A . 28 LYS CA 1 1 9 5202 1 1 28 LYS CB C 10.840 1.613 -8.487 1.00 . A A . 28 LYS CB 1 1 9 5203 1 1 28 LYS CD C 9.667 3.767 -7.777 1.00 . A A . 28 LYS CD 1 1 9 5204 1 1 28 LYS CE C 8.724 4.023 -6.582 1.00 . A A . 28 LYS CE 1 1 9 5205 1 1 28 LYS CG C 10.750 2.723 -7.392 1.00 . A A . 28 LYS CG 1 1 9 5206 1 1 28 LYS H H 10.436 -0.747 -7.493 1.00 . A A . 28 LYS H 1 1 9 5207 1 1 28 LYS HA H 12.443 0.284 -9.174 1.00 . A A . 28 LYS HA 1 1 9 5208 1 1 28 LYS HB2 H 11.019 2.087 -9.442 1.00 . A A . 28 LYS HB2 1 1 9 5209 1 1 28 LYS HB3 H 9.895 1.095 -8.546 1.00 . A A . 28 LYS HB3 1 1 9 5210 1 1 28 LYS HD2 H 10.150 4.696 -8.045 1.00 . A A . 28 LYS HD2 1 1 9 5211 1 1 28 LYS HD3 H 9.094 3.430 -8.629 1.00 . A A . 28 LYS HD3 1 1 9 5212 1 1 28 LYS HE2 H 8.548 3.112 -6.032 1.00 . A A . 28 LYS HE2 1 1 9 5213 1 1 28 LYS HE3 H 9.156 4.756 -5.916 1.00 . A A . 28 LYS HE3 1 1 9 5214 1 1 28 LYS HG2 H 10.535 2.276 -6.432 1.00 . A A . 28 LYS HG2 1 1 9 5215 1 1 28 LYS HG3 H 11.694 3.239 -7.317 1.00 . A A . 28 LYS HG3 1 1 9 5216 1 1 28 LYS HZ1 H 7.420 4.602 -8.103 1.00 . A A . 28 LYS HZ1 1 1 9 5217 1 1 28 LYS HZ2 H 6.658 3.874 -6.772 1.00 . A A . 28 LYS HZ2 1 1 9 5218 1 1 28 LYS HZ3 H 7.228 5.470 -6.656 1.00 . A A . 28 LYS HZ3 1 1 9 5219 1 1 28 LYS N N 11.404 -0.648 -7.579 1.00 . A A . 28 LYS N 1 1 9 5220 1 1 28 LYS NZ N 7.409 4.531 -7.066 1.00 . A A . 28 LYS NZ 1 1 9 5221 1 1 28 LYS O O 14.063 1.647 -7.777 1.00 . A A . 28 LYS O 1 1 9 5222 1 1 29 GLY C C 15.205 0.907 -5.302 1.00 . A A . 29 GLY C 1 1 9 5223 1 1 29 GLY CA C 13.843 1.555 -5.035 1.00 . A A . 29 GLY CA 1 1 9 5224 1 1 29 GLY H H 12.024 0.605 -5.716 1.00 . A A . 29 GLY H 1 1 9 5225 1 1 29 GLY HA2 H 13.922 2.628 -5.135 1.00 . A A . 29 GLY HA2 1 1 9 5226 1 1 29 GLY HA3 H 13.521 1.305 -4.035 1.00 . A A . 29 GLY HA3 1 1 9 5227 1 1 29 GLY N N 12.849 1.033 -6.021 1.00 . A A . 29 GLY N 1 1 9 5228 1 1 29 GLY O O 16.171 1.584 -5.596 1.00 . A A . 29 GLY O 1 1 9 5229 1 1 30 ALA C C 17.068 -0.848 -6.844 1.00 . A A . 30 ALA C 1 1 9 5230 1 1 30 ALA CA C 16.519 -1.137 -5.443 1.00 . A A . 30 ALA CA 1 1 9 5231 1 1 30 ALA CB C 16.254 -2.639 -5.279 1.00 . A A . 30 ALA CB 1 1 9 5232 1 1 30 ALA H H 14.417 -0.892 -4.979 1.00 . A A . 30 ALA H 1 1 9 5233 1 1 30 ALA HA H 17.247 -0.791 -4.723 1.00 . A A . 30 ALA HA 1 1 9 5234 1 1 30 ALA HB1 H 15.496 -2.963 -5.977 1.00 . A A . 30 ALA HB1 1 1 9 5235 1 1 30 ALA HB2 H 17.159 -3.201 -5.456 1.00 . A A . 30 ALA HB2 1 1 9 5236 1 1 30 ALA HB3 H 15.911 -2.843 -4.274 1.00 . A A . 30 ALA HB3 1 1 9 5237 1 1 30 ALA N N 15.237 -0.399 -5.205 1.00 . A A . 30 ALA N 1 1 9 5238 1 1 30 ALA O O 18.244 -0.609 -7.020 1.00 . A A . 30 ALA O 1 1 9 5239 1 1 31 ILE C C 17.296 0.722 -9.349 1.00 . A A . 31 ILE C 1 1 9 5240 1 1 31 ILE CA C 16.545 -0.613 -9.225 1.00 . A A . 31 ILE CA 1 1 9 5241 1 1 31 ILE CB C 15.192 -0.653 -9.989 1.00 . A A . 31 ILE CB 1 1 9 5242 1 1 31 ILE CD1 C 13.360 -2.278 -10.736 1.00 . A A . 31 ILE CD1 1 1 9 5243 1 1 31 ILE CG1 C 14.769 -2.142 -10.125 1.00 . A A . 31 ILE CG1 1 1 9 5244 1 1 31 ILE CG2 C 15.258 0.040 -11.363 1.00 . A A . 31 ILE CG2 1 1 9 5245 1 1 31 ILE H H 15.254 -1.071 -7.590 1.00 . A A . 31 ILE H 1 1 9 5246 1 1 31 ILE HA H 17.222 -1.391 -9.543 1.00 . A A . 31 ILE HA 1 1 9 5247 1 1 31 ILE HB H 14.454 -0.141 -9.394 1.00 . A A . 31 ILE HB 1 1 9 5248 1 1 31 ILE HD11 H 12.665 -1.617 -10.240 1.00 . A A . 31 ILE HD11 1 1 9 5249 1 1 31 ILE HD12 H 13.382 -2.043 -11.789 1.00 . A A . 31 ILE HD12 1 1 9 5250 1 1 31 ILE HD13 H 13.010 -3.294 -10.620 1.00 . A A . 31 ILE HD13 1 1 9 5251 1 1 31 ILE HG12 H 15.490 -2.665 -10.731 1.00 . A A . 31 ILE HG12 1 1 9 5252 1 1 31 ILE HG13 H 14.762 -2.604 -9.148 1.00 . A A . 31 ILE HG13 1 1 9 5253 1 1 31 ILE HG21 H 15.536 1.076 -11.242 1.00 . A A . 31 ILE HG21 1 1 9 5254 1 1 31 ILE HG22 H 15.973 -0.452 -12.004 1.00 . A A . 31 ILE HG22 1 1 9 5255 1 1 31 ILE HG23 H 14.284 0.012 -11.829 1.00 . A A . 31 ILE HG23 1 1 9 5256 1 1 31 ILE N N 16.186 -0.873 -7.803 1.00 . A A . 31 ILE N 1 1 9 5257 1 1 31 ILE O O 18.397 0.768 -9.861 1.00 . A A . 31 ILE O 1 1 9 5258 1 1 32 ILE C C 18.666 3.062 -8.225 1.00 . A A . 32 ILE C 1 1 9 5259 1 1 32 ILE CA C 17.313 3.122 -8.934 1.00 . A A . 32 ILE CA 1 1 9 5260 1 1 32 ILE CB C 16.368 4.145 -8.247 1.00 . A A . 32 ILE CB 1 1 9 5261 1 1 32 ILE CD1 C 13.912 4.800 -8.174 1.00 . A A . 32 ILE CD1 1 1 9 5262 1 1 32 ILE CG1 C 15.036 4.206 -9.048 1.00 . A A . 32 ILE CG1 1 1 9 5263 1 1 32 ILE CG2 C 17.027 5.548 -8.244 1.00 . A A . 32 ILE CG2 1 1 9 5264 1 1 32 ILE H H 15.797 1.678 -8.475 1.00 . A A . 32 ILE H 1 1 9 5265 1 1 32 ILE HA H 17.485 3.374 -9.967 1.00 . A A . 32 ILE HA 1 1 9 5266 1 1 32 ILE HB H 16.175 3.832 -7.230 1.00 . A A . 32 ILE HB 1 1 9 5267 1 1 32 ILE HD11 H 13.862 4.292 -7.222 1.00 . A A . 32 ILE HD11 1 1 9 5268 1 1 32 ILE HD12 H 14.088 5.851 -7.999 1.00 . A A . 32 ILE HD12 1 1 9 5269 1 1 32 ILE HD13 H 12.962 4.689 -8.676 1.00 . A A . 32 ILE HD13 1 1 9 5270 1 1 32 ILE HG12 H 15.168 4.806 -9.932 1.00 . A A . 32 ILE HG12 1 1 9 5271 1 1 32 ILE HG13 H 14.747 3.217 -9.368 1.00 . A A . 32 ILE HG13 1 1 9 5272 1 1 32 ILE HG21 H 17.361 5.811 -9.237 1.00 . A A . 32 ILE HG21 1 1 9 5273 1 1 32 ILE HG22 H 16.321 6.295 -7.909 1.00 . A A . 32 ILE HG22 1 1 9 5274 1 1 32 ILE HG23 H 17.877 5.560 -7.577 1.00 . A A . 32 ILE HG23 1 1 9 5275 1 1 32 ILE N N 16.682 1.772 -8.874 1.00 . A A . 32 ILE N 1 1 9 5276 1 1 32 ILE O O 19.648 3.545 -8.748 1.00 . A A . 32 ILE O 1 1 9 5277 1 1 33 GLY C C 21.048 1.736 -7.169 1.00 . A A . 33 GLY C 1 1 9 5278 1 1 33 GLY CA C 19.956 2.351 -6.288 1.00 . A A . 33 GLY CA 1 1 9 5279 1 1 33 GLY H H 17.852 2.093 -6.694 1.00 . A A . 33 GLY H 1 1 9 5280 1 1 33 GLY HA2 H 20.267 3.339 -5.976 1.00 . A A . 33 GLY HA2 1 1 9 5281 1 1 33 GLY HA3 H 19.797 1.728 -5.422 1.00 . A A . 33 GLY HA3 1 1 9 5282 1 1 33 GLY N N 18.680 2.465 -7.061 1.00 . A A . 33 GLY N 1 1 9 5283 1 1 33 GLY O O 22.131 2.273 -7.271 1.00 . A A . 33 GLY O 1 1 9 5284 1 1 34 LEU C C 22.169 0.877 -9.817 1.00 . A A . 34 LEU C 1 1 9 5285 1 1 34 LEU CA C 21.724 -0.053 -8.679 1.00 . A A . 34 LEU CA 1 1 9 5286 1 1 34 LEU CB C 21.079 -1.332 -9.259 1.00 . A A . 34 LEU CB 1 1 9 5287 1 1 34 LEU CD1 C 19.728 -3.350 -8.563 1.00 . A A . 34 LEU CD1 1 1 9 5288 1 1 34 LEU CD2 C 22.134 -3.162 -7.847 1.00 . A A . 34 LEU CD2 1 1 9 5289 1 1 34 LEU CG C 20.834 -2.368 -8.125 1.00 . A A . 34 LEU CG 1 1 9 5290 1 1 34 LEU H H 19.839 0.243 -7.672 1.00 . A A . 34 LEU H 1 1 9 5291 1 1 34 LEU HA H 22.595 -0.291 -8.086 1.00 . A A . 34 LEU HA 1 1 9 5292 1 1 34 LEU HB2 H 20.140 -1.074 -9.727 1.00 . A A . 34 LEU HB2 1 1 9 5293 1 1 34 LEU HB3 H 21.727 -1.756 -10.013 1.00 . A A . 34 LEU HB3 1 1 9 5294 1 1 34 LEU HD11 H 18.819 -2.813 -8.792 1.00 . A A . 34 LEU HD11 1 1 9 5295 1 1 34 LEU HD12 H 20.037 -3.898 -9.441 1.00 . A A . 34 LEU HD12 1 1 9 5296 1 1 34 LEU HD13 H 19.520 -4.054 -7.770 1.00 . A A . 34 LEU HD13 1 1 9 5297 1 1 34 LEU HD21 H 22.931 -2.490 -7.566 1.00 . A A . 34 LEU HD21 1 1 9 5298 1 1 34 LEU HD22 H 21.974 -3.861 -7.040 1.00 . A A . 34 LEU HD22 1 1 9 5299 1 1 34 LEU HD23 H 22.438 -3.711 -8.726 1.00 . A A . 34 LEU HD23 1 1 9 5300 1 1 34 LEU HG H 20.522 -1.870 -7.218 1.00 . A A . 34 LEU HG 1 1 9 5301 1 1 34 LEU N N 20.732 0.629 -7.792 1.00 . A A . 34 LEU N 1 1 9 5302 1 1 34 LEU O O 23.352 1.016 -10.060 1.00 . A A . 34 LEU O 1 1 9 5303 1 1 35 MET C C 22.515 3.489 -11.148 1.00 . A A . 35 MET C 1 1 9 5304 1 1 35 MET CA C 21.510 2.420 -11.604 1.00 . A A . 35 MET CA 1 1 9 5305 1 1 35 MET CB C 20.177 3.057 -12.050 1.00 . A A . 35 MET CB 1 1 9 5306 1 1 35 MET CE C 21.021 4.303 -15.972 1.00 . A A . 35 MET CE 1 1 9 5307 1 1 35 MET CG C 20.375 3.836 -13.357 1.00 . A A . 35 MET CG 1 1 9 5308 1 1 35 MET H H 20.276 1.319 -10.229 1.00 . A A . 35 MET H 1 1 9 5309 1 1 35 MET HA H 21.946 1.853 -12.409 1.00 . A A . 35 MET HA 1 1 9 5310 1 1 35 MET HB2 H 19.444 2.279 -12.204 1.00 . A A . 35 MET HB2 1 1 9 5311 1 1 35 MET HB3 H 19.809 3.724 -11.284 1.00 . A A . 35 MET HB3 1 1 9 5312 1 1 35 MET HE1 H 21.517 5.161 -15.542 1.00 . A A . 35 MET HE1 1 1 9 5313 1 1 35 MET HE2 H 21.544 4.001 -16.868 1.00 . A A . 35 MET HE2 1 1 9 5314 1 1 35 MET HE3 H 20.003 4.563 -16.223 1.00 . A A . 35 MET HE3 1 1 9 5315 1 1 35 MET HG2 H 19.416 4.247 -13.638 1.00 . A A . 35 MET HG2 1 1 9 5316 1 1 35 MET HG3 H 21.040 4.663 -13.156 1.00 . A A . 35 MET HG3 1 1 9 5317 1 1 35 MET N N 21.209 1.483 -10.475 1.00 . A A . 35 MET N 1 1 9 5318 1 1 35 MET O O 23.508 3.741 -11.803 1.00 . A A . 35 MET O 1 1 9 5319 1 1 35 MET SD S 21.025 2.935 -14.786 1.00 . A A . 35 MET SD 1 1 9 5320 1 1 36 VAL C C 24.462 4.581 -9.133 1.00 . A A . 36 VAL C 1 1 9 5321 1 1 36 VAL CA C 23.054 5.141 -9.411 1.00 . A A . 36 VAL CA 1 1 9 5322 1 1 36 VAL CB C 22.356 5.611 -8.093 1.00 . A A . 36 VAL CB 1 1 9 5323 1 1 36 VAL CG1 C 23.313 6.491 -7.252 1.00 . A A . 36 VAL CG1 1 1 9 5324 1 1 36 VAL CG2 C 21.105 6.447 -8.452 1.00 . A A . 36 VAL CG2 1 1 9 5325 1 1 36 VAL H H 21.378 3.812 -9.577 1.00 . A A . 36 VAL H 1 1 9 5326 1 1 36 VAL HA H 23.135 5.964 -10.107 1.00 . A A . 36 VAL HA 1 1 9 5327 1 1 36 VAL HB H 22.046 4.755 -7.507 1.00 . A A . 36 VAL HB 1 1 9 5328 1 1 36 VAL HG11 H 23.798 7.225 -7.877 1.00 . A A . 36 VAL HG11 1 1 9 5329 1 1 36 VAL HG12 H 22.766 7.004 -6.474 1.00 . A A . 36 VAL HG12 1 1 9 5330 1 1 36 VAL HG13 H 24.070 5.876 -6.787 1.00 . A A . 36 VAL HG13 1 1 9 5331 1 1 36 VAL HG21 H 20.465 5.900 -9.128 1.00 . A A . 36 VAL HG21 1 1 9 5332 1 1 36 VAL HG22 H 20.545 6.674 -7.556 1.00 . A A . 36 VAL HG22 1 1 9 5333 1 1 36 VAL HG23 H 21.392 7.375 -8.924 1.00 . A A . 36 VAL HG23 1 1 9 5334 1 1 36 VAL N N 22.202 4.077 -10.024 1.00 . A A . 36 VAL N 1 1 9 5335 1 1 36 VAL O O 25.450 5.153 -9.551 1.00 . A A . 36 VAL O 1 1 9 5336 1 1 37 GLY C C 25.702 2.411 -6.598 1.00 . A A . 37 GLY C 1 1 9 5337 1 1 37 GLY CA C 25.776 2.799 -8.074 1.00 . A A . 37 GLY CA 1 1 9 5338 1 1 37 GLY H H 23.660 3.068 -8.127 1.00 . A A . 37 GLY H 1 1 9 5339 1 1 37 GLY HA2 H 25.893 1.909 -8.675 1.00 . A A . 37 GLY HA2 1 1 9 5340 1 1 37 GLY HA3 H 26.611 3.466 -8.235 1.00 . A A . 37 GLY HA3 1 1 9 5341 1 1 37 GLY N N 24.494 3.473 -8.433 1.00 . A A . 37 GLY N 1 1 9 5342 1 1 37 GLY O O 24.905 1.574 -6.220 1.00 . A A . 37 GLY O 1 1 9 5343 1 1 38 GLY C C 27.545 1.606 -4.034 1.00 . A A . 38 GLY C 1 1 9 5344 1 1 38 GLY CA C 26.582 2.758 -4.339 1.00 . A A . 38 GLY CA 1 1 9 5345 1 1 38 GLY H H 27.156 3.693 -6.190 1.00 . A A . 38 GLY H 1 1 9 5346 1 1 38 GLY HA2 H 26.920 3.647 -3.825 1.00 . A A . 38 GLY HA2 1 1 9 5347 1 1 38 GLY HA3 H 25.594 2.498 -3.984 1.00 . A A . 38 GLY HA3 1 1 9 5348 1 1 38 GLY N N 26.541 3.035 -5.808 1.00 . A A . 38 GLY N 1 1 9 5349 1 1 38 GLY O O 28.131 1.554 -2.970 1.00 . A A . 38 GLY O 1 1 9 5350 1 1 39 VAL C C 29.628 -0.394 -5.978 1.00 . A A . 39 VAL C 1 1 9 5351 1 1 39 VAL CA C 28.566 -0.466 -4.864 1.00 . A A . 39 VAL CA 1 1 9 5352 1 1 39 VAL CB C 27.693 -1.760 -4.985 1.00 . A A . 39 VAL CB 1 1 9 5353 1 1 39 VAL CG1 C 28.499 -2.989 -4.497 1.00 . A A . 39 VAL CG1 1 1 9 5354 1 1 39 VAL CG2 C 26.424 -1.630 -4.106 1.00 . A A . 39 VAL CG2 1 1 9 5355 1 1 39 VAL H H 27.163 0.839 -5.816 1.00 . A A . 39 VAL H 1 1 9 5356 1 1 39 VAL HA H 29.065 -0.427 -3.911 1.00 . A A . 39 VAL HA 1 1 9 5357 1 1 39 VAL HB H 27.398 -1.907 -6.014 1.00 . A A . 39 VAL HB 1 1 9 5358 1 1 39 VAL HG11 H 28.974 -2.781 -3.550 1.00 . A A . 39 VAL HG11 1 1 9 5359 1 1 39 VAL HG12 H 27.844 -3.839 -4.375 1.00 . A A . 39 VAL HG12 1 1 9 5360 1 1 39 VAL HG13 H 29.260 -3.254 -5.216 1.00 . A A . 39 VAL HG13 1 1 9 5361 1 1 39 VAL HG21 H 26.680 -1.261 -3.123 1.00 . A A . 39 VAL HG21 1 1 9 5362 1 1 39 VAL HG22 H 25.725 -0.945 -4.563 1.00 . A A . 39 VAL HG22 1 1 9 5363 1 1 39 VAL HG23 H 25.940 -2.590 -3.999 1.00 . A A . 39 VAL HG23 1 1 9 5364 1 1 39 VAL N N 27.670 0.721 -4.991 1.00 . A A . 39 VAL N 1 1 9 5365 1 1 39 VAL O O 30.041 -1.394 -6.533 1.00 . A A . 39 VAL O 1 1 9 5366 1 1 40 VAL C C 32.467 0.651 -6.791 1.00 . A A . 40 VAL C 1 1 9 5367 1 1 40 VAL CA C 31.074 1.039 -7.331 1.00 . A A . 40 VAL CA 1 1 9 5368 1 1 40 VAL CB C 31.069 2.538 -7.750 1.00 . A A . 40 VAL CB 1 1 9 5369 1 1 40 VAL CG1 C 31.904 2.712 -9.041 1.00 . A A . 40 VAL CG1 1 1 9 5370 1 1 40 VAL CG2 C 29.622 3.011 -8.023 1.00 . A A . 40 VAL CG2 1 1 9 5371 1 1 40 VAL H H 29.673 1.581 -5.782 1.00 . A A . 40 VAL H 1 1 9 5372 1 1 40 VAL HA H 30.833 0.418 -8.185 1.00 . A A . 40 VAL HA 1 1 9 5373 1 1 40 VAL HB H 31.497 3.139 -6.960 1.00 . A A . 40 VAL HB 1 1 9 5374 1 1 40 VAL HG11 H 31.514 2.083 -9.828 1.00 . A A . 40 VAL HG11 1 1 9 5375 1 1 40 VAL HG12 H 31.870 3.739 -9.372 1.00 . A A . 40 VAL HG12 1 1 9 5376 1 1 40 VAL HG13 H 32.934 2.445 -8.862 1.00 . A A . 40 VAL HG13 1 1 9 5377 1 1 40 VAL HG21 H 29.118 2.319 -8.682 1.00 . A A . 40 VAL HG21 1 1 9 5378 1 1 40 VAL HG22 H 29.073 3.076 -7.095 1.00 . A A . 40 VAL HG22 1 1 9 5379 1 1 40 VAL HG23 H 29.633 3.989 -8.483 1.00 . A A . 40 VAL HG23 1 1 9 5380 1 1 40 VAL N N 30.043 0.815 -6.268 1.00 . A A . 40 VAL N 1 1 9 5381 1 1 40 VAL O O 32.728 0.999 -5.649 1.00 . A A . 40 VAL O 1 1 9 5382 1 1 40 VAL OXT O 33.189 0.028 -7.551 1.00 . A A . 40 VAL OXT 1 1 10 5383 1 1 1 ASP C C 1.913 22.624 -7.379 1.00 . A A . 1 ASP C 1 1 10 5384 1 1 1 ASP CA C 2.601 23.797 -8.105 1.00 . A A . 1 ASP CA 1 1 10 5385 1 1 1 ASP CB C 1.543 24.827 -8.602 1.00 . A A . 1 ASP CB 1 1 10 5386 1 1 1 ASP CG C 0.392 24.110 -9.340 1.00 . A A . 1 ASP CG 1 1 10 5387 1 1 1 ASP H1 H 3.263 22.254 -9.342 1.00 . A A . 1 ASP H1 1 1 10 5388 1 1 1 ASP H2 H 3.008 23.725 -10.148 1.00 . A A . 1 ASP H2 1 1 10 5389 1 1 1 ASP H3 H 4.376 23.522 -9.160 1.00 . A A . 1 ASP H3 1 1 10 5390 1 1 1 ASP HA H 3.288 24.273 -7.421 1.00 . A A . 1 ASP HA 1 1 10 5391 1 1 1 ASP HB2 H 1.144 25.380 -7.763 1.00 . A A . 1 ASP HB2 1 1 10 5392 1 1 1 ASP HB3 H 2.006 25.530 -9.280 1.00 . A A . 1 ASP HB3 1 1 10 5393 1 1 1 ASP N N 3.371 23.286 -9.277 1.00 . A A . 1 ASP N 1 1 10 5394 1 1 1 ASP O O 2.302 21.483 -7.539 1.00 . A A . 1 ASP O 1 1 10 5395 1 1 1 ASP OD1 O 0.643 23.698 -10.461 1.00 . A A . 1 ASP OD1 1 1 10 5396 1 1 1 ASP OD2 O -0.667 24.012 -8.740 1.00 . A A . 1 ASP OD2 1 1 10 5397 1 1 2 ALA C C -1.343 22.272 -5.903 1.00 . A A . 2 ALA C 1 1 10 5398 1 1 2 ALA CA C 0.143 21.930 -5.837 1.00 . A A . 2 ALA CA 1 1 10 5399 1 1 2 ALA CB C 0.595 21.930 -4.373 1.00 . A A . 2 ALA CB 1 1 10 5400 1 1 2 ALA H H 0.651 23.893 -6.524 1.00 . A A . 2 ALA H 1 1 10 5401 1 1 2 ALA HA H 0.301 20.957 -6.280 1.00 . A A . 2 ALA HA 1 1 10 5402 1 1 2 ALA HB1 H 0.563 22.936 -3.978 1.00 . A A . 2 ALA HB1 1 1 10 5403 1 1 2 ALA HB2 H -0.064 21.307 -3.783 1.00 . A A . 2 ALA HB2 1 1 10 5404 1 1 2 ALA HB3 H 1.602 21.550 -4.292 1.00 . A A . 2 ALA HB3 1 1 10 5405 1 1 2 ALA N N 0.910 22.952 -6.604 1.00 . A A . 2 ALA N 1 1 10 5406 1 1 2 ALA O O -1.727 23.407 -5.699 1.00 . A A . 2 ALA O 1 1 10 5407 1 1 3 GLU C C -4.155 21.431 -4.845 1.00 . A A . 3 GLU C 1 1 10 5408 1 1 3 GLU CA C -3.603 21.456 -6.282 1.00 . A A . 3 GLU CA 1 1 10 5409 1 1 3 GLU CB C -4.154 20.313 -7.164 1.00 . A A . 3 GLU CB 1 1 10 5410 1 1 3 GLU CD C -6.154 19.481 -8.420 1.00 . A A . 3 GLU CD 1 1 10 5411 1 1 3 GLU CG C -5.596 20.645 -7.588 1.00 . A A . 3 GLU CG 1 1 10 5412 1 1 3 GLU H H -1.755 20.383 -6.347 1.00 . A A . 3 GLU H 1 1 10 5413 1 1 3 GLU HA H -3.817 22.417 -6.729 1.00 . A A . 3 GLU HA 1 1 10 5414 1 1 3 GLU HB2 H -3.539 20.241 -8.050 1.00 . A A . 3 GLU HB2 1 1 10 5415 1 1 3 GLU HB3 H -4.114 19.363 -6.652 1.00 . A A . 3 GLU HB3 1 1 10 5416 1 1 3 GLU HG2 H -6.223 20.796 -6.720 1.00 . A A . 3 GLU HG2 1 1 10 5417 1 1 3 GLU HG3 H -5.612 21.547 -8.186 1.00 . A A . 3 GLU HG3 1 1 10 5418 1 1 3 GLU N N -2.132 21.269 -6.189 1.00 . A A . 3 GLU N 1 1 10 5419 1 1 3 GLU O O -3.959 22.396 -4.133 1.00 . A A . 3 GLU O 1 1 10 5420 1 1 3 GLU OE1 O -5.904 19.490 -9.615 1.00 . A A . 3 GLU OE1 1 1 10 5421 1 1 3 GLU OE2 O -6.800 18.643 -7.814 1.00 . A A . 3 GLU OE2 1 1 10 5422 1 1 4 PHE C C -5.564 18.823 -2.606 1.00 . A A . 4 PHE C 1 1 10 5423 1 1 4 PHE CA C -5.368 20.280 -3.059 1.00 . A A . 4 PHE CA 1 1 10 5424 1 1 4 PHE CB C -6.729 21.026 -3.023 1.00 . A A . 4 PHE CB 1 1 10 5425 1 1 4 PHE CD1 C -6.005 23.135 -1.817 1.00 . A A . 4 PHE CD1 1 1 10 5426 1 1 4 PHE CD2 C -6.782 23.339 -4.063 1.00 . A A . 4 PHE CD2 1 1 10 5427 1 1 4 PHE CE1 C -5.799 24.497 -1.765 1.00 . A A . 4 PHE CE1 1 1 10 5428 1 1 4 PHE CE2 C -6.576 24.701 -4.010 1.00 . A A . 4 PHE CE2 1 1 10 5429 1 1 4 PHE CG C -6.500 22.545 -2.966 1.00 . A A . 4 PHE CG 1 1 10 5430 1 1 4 PHE CZ C -6.083 25.282 -2.861 1.00 . A A . 4 PHE CZ 1 1 10 5431 1 1 4 PHE H H -4.921 19.607 -5.059 1.00 . A A . 4 PHE H 1 1 10 5432 1 1 4 PHE HA H -4.674 20.750 -2.375 1.00 . A A . 4 PHE HA 1 1 10 5433 1 1 4 PHE HB2 H -7.305 20.787 -3.905 1.00 . A A . 4 PHE HB2 1 1 10 5434 1 1 4 PHE HB3 H -7.296 20.735 -2.151 1.00 . A A . 4 PHE HB3 1 1 10 5435 1 1 4 PHE HD1 H -5.776 22.529 -0.953 1.00 . A A . 4 PHE HD1 1 1 10 5436 1 1 4 PHE HD2 H -7.165 22.892 -4.968 1.00 . A A . 4 PHE HD2 1 1 10 5437 1 1 4 PHE HE1 H -5.413 24.951 -0.862 1.00 . A A . 4 PHE HE1 1 1 10 5438 1 1 4 PHE HE2 H -6.799 25.314 -4.871 1.00 . A A . 4 PHE HE2 1 1 10 5439 1 1 4 PHE HZ H -5.922 26.348 -2.820 1.00 . A A . 4 PHE HZ 1 1 10 5440 1 1 4 PHE N N -4.805 20.361 -4.446 1.00 . A A . 4 PHE N 1 1 10 5441 1 1 4 PHE O O -6.617 18.241 -2.792 1.00 . A A . 4 PHE O 1 1 10 5442 1 1 5 ARG C C -5.039 15.839 -2.514 1.00 . A A . 5 ARG C 1 1 10 5443 1 1 5 ARG CA C -4.513 16.875 -1.505 1.00 . A A . 5 ARG CA 1 1 10 5444 1 1 5 ARG CB C -5.360 16.839 -0.197 1.00 . A A . 5 ARG CB 1 1 10 5445 1 1 5 ARG CD C -3.483 16.634 1.479 1.00 . A A . 5 ARG CD 1 1 10 5446 1 1 5 ARG CG C -4.692 15.916 0.847 1.00 . A A . 5 ARG CG 1 1 10 5447 1 1 5 ARG CZ C -1.947 16.155 3.324 1.00 . A A . 5 ARG CZ 1 1 10 5448 1 1 5 ARG H H -3.713 18.831 -1.922 1.00 . A A . 5 ARG H 1 1 10 5449 1 1 5 ARG HA H -3.486 16.622 -1.298 1.00 . A A . 5 ARG HA 1 1 10 5450 1 1 5 ARG HB2 H -5.449 17.837 0.210 1.00 . A A . 5 ARG HB2 1 1 10 5451 1 1 5 ARG HB3 H -6.357 16.481 -0.407 1.00 . A A . 5 ARG HB3 1 1 10 5452 1 1 5 ARG HD2 H -2.666 16.688 0.775 1.00 . A A . 5 ARG HD2 1 1 10 5453 1 1 5 ARG HD3 H -3.751 17.631 1.798 1.00 . A A . 5 ARG HD3 1 1 10 5454 1 1 5 ARG HE H -3.587 15.094 2.980 1.00 . A A . 5 ARG HE 1 1 10 5455 1 1 5 ARG HG2 H -5.410 15.673 1.617 1.00 . A A . 5 ARG HG2 1 1 10 5456 1 1 5 ARG HG3 H -4.367 14.997 0.380 1.00 . A A . 5 ARG HG3 1 1 10 5457 1 1 5 ARG HH11 H -1.470 17.703 2.140 1.00 . A A . 5 ARG HH11 1 1 10 5458 1 1 5 ARG HH12 H -0.368 17.384 3.436 1.00 . A A . 5 ARG HH12 1 1 10 5459 1 1 5 ARG HH21 H -2.207 14.667 4.635 1.00 . A A . 5 ARG HH21 1 1 10 5460 1 1 5 ARG HH22 H -0.792 15.637 4.873 1.00 . A A . 5 ARG HH22 1 1 10 5461 1 1 5 ARG N N -4.520 18.286 -2.022 1.00 . A A . 5 ARG N 1 1 10 5462 1 1 5 ARG NE N -3.043 15.850 2.675 1.00 . A A . 5 ARG NE 1 1 10 5463 1 1 5 ARG NH1 N -1.204 17.159 2.936 1.00 . A A . 5 ARG NH1 1 1 10 5464 1 1 5 ARG NH2 N -1.623 15.430 4.358 1.00 . A A . 5 ARG NH2 1 1 10 5465 1 1 5 ARG O O -5.513 14.778 -2.154 1.00 . A A . 5 ARG O 1 1 10 5466 1 1 6 HIS C C -4.070 15.000 -5.618 1.00 . A A . 6 HIS C 1 1 10 5467 1 1 6 HIS CA C -5.362 15.375 -4.901 1.00 . A A . 6 HIS CA 1 1 10 5468 1 1 6 HIS CB C -6.332 16.246 -5.743 1.00 . A A . 6 HIS CB 1 1 10 5469 1 1 6 HIS CD2 C -6.635 14.183 -7.409 1.00 . A A . 6 HIS CD2 1 1 10 5470 1 1 6 HIS CE1 C -7.996 15.054 -8.705 1.00 . A A . 6 HIS CE1 1 1 10 5471 1 1 6 HIS CG C -6.881 15.469 -6.953 1.00 . A A . 6 HIS CG 1 1 10 5472 1 1 6 HIS H H -4.526 17.083 -3.948 1.00 . A A . 6 HIS H 1 1 10 5473 1 1 6 HIS HA H -5.842 14.483 -4.574 1.00 . A A . 6 HIS HA 1 1 10 5474 1 1 6 HIS HB2 H -7.166 16.555 -5.130 1.00 . A A . 6 HIS HB2 1 1 10 5475 1 1 6 HIS HB3 H -5.820 17.128 -6.094 1.00 . A A . 6 HIS HB3 1 1 10 5476 1 1 6 HIS HD1 H -8.115 16.845 -7.769 1.00 . A A . 6 HIS HD1 1 1 10 5477 1 1 6 HIS HD2 H -5.966 13.478 -6.941 1.00 . A A . 6 HIS HD2 1 1 10 5478 1 1 6 HIS HE1 H -8.678 15.208 -9.527 1.00 . A A . 6 HIS HE1 1 1 10 5479 1 1 6 HIS N N -4.922 16.212 -3.758 1.00 . A A . 6 HIS N 1 1 10 5480 1 1 6 HIS ND1 N -7.732 15.944 -7.803 1.00 . A A . 6 HIS ND1 1 1 10 5481 1 1 6 HIS NE2 N -7.336 13.943 -8.498 1.00 . A A . 6 HIS NE2 1 1 10 5482 1 1 6 HIS O O -3.248 14.296 -5.071 1.00 . A A . 6 HIS O 1 1 10 5483 1 1 7 ASP C C -1.528 16.076 -7.170 1.00 . A A . 7 ASP C 1 1 10 5484 1 1 7 ASP CA C -2.729 15.229 -7.654 1.00 . A A . 7 ASP CA 1 1 10 5485 1 1 7 ASP CB C -3.099 15.569 -9.113 1.00 . A A . 7 ASP CB 1 1 10 5486 1 1 7 ASP CG C -4.007 16.813 -9.167 1.00 . A A . 7 ASP CG 1 1 10 5487 1 1 7 ASP H H -4.657 16.036 -7.157 1.00 . A A . 7 ASP H 1 1 10 5488 1 1 7 ASP HA H -2.474 14.185 -7.569 1.00 . A A . 7 ASP HA 1 1 10 5489 1 1 7 ASP HB2 H -2.199 15.774 -9.664 1.00 . A A . 7 ASP HB2 1 1 10 5490 1 1 7 ASP HB3 H -3.605 14.733 -9.575 1.00 . A A . 7 ASP HB3 1 1 10 5491 1 1 7 ASP N N -3.932 15.487 -6.813 1.00 . A A . 7 ASP N 1 1 10 5492 1 1 7 ASP O O -0.697 16.508 -7.945 1.00 . A A . 7 ASP O 1 1 10 5493 1 1 7 ASP OD1 O -3.454 17.892 -9.037 1.00 . A A . 7 ASP OD1 1 1 10 5494 1 1 7 ASP OD2 O -5.200 16.610 -9.331 1.00 . A A . 7 ASP OD2 1 1 10 5495 1 1 8 SER C C -0.382 16.790 -3.700 1.00 . A A . 8 SER C 1 1 10 5496 1 1 8 SER CA C -0.417 17.073 -5.215 1.00 . A A . 8 SER CA 1 1 10 5497 1 1 8 SER CB C -0.684 18.564 -5.478 1.00 . A A . 8 SER CB 1 1 10 5498 1 1 8 SER H H -2.194 15.908 -5.326 1.00 . A A . 8 SER H 1 1 10 5499 1 1 8 SER HA H 0.526 16.760 -5.627 1.00 . A A . 8 SER HA 1 1 10 5500 1 1 8 SER HB2 H 0.003 19.192 -4.934 1.00 . A A . 8 SER HB2 1 1 10 5501 1 1 8 SER HB3 H -0.642 18.793 -6.533 1.00 . A A . 8 SER HB3 1 1 10 5502 1 1 8 SER HG H -1.975 19.464 -4.330 1.00 . A A . 8 SER HG 1 1 10 5503 1 1 8 SER N N -1.491 16.283 -5.879 1.00 . A A . 8 SER N 1 1 10 5504 1 1 8 SER O O 0.050 17.619 -2.921 1.00 . A A . 8 SER O 1 1 10 5505 1 1 8 SER OG O -2.007 18.777 -5.000 1.00 . A A . 8 SER OG 1 1 10 5506 1 1 9 GLY C C -1.397 13.828 -1.631 1.00 . A A . 9 GLY C 1 1 10 5507 1 1 9 GLY CA C -0.853 15.241 -1.878 1.00 . A A . 9 GLY CA 1 1 10 5508 1 1 9 GLY H H -1.178 15.001 -4.006 1.00 . A A . 9 GLY H 1 1 10 5509 1 1 9 GLY HA2 H 0.157 15.291 -1.499 1.00 . A A . 9 GLY HA2 1 1 10 5510 1 1 9 GLY HA3 H -1.462 15.947 -1.334 1.00 . A A . 9 GLY HA3 1 1 10 5511 1 1 9 GLY N N -0.841 15.622 -3.327 1.00 . A A . 9 GLY N 1 1 10 5512 1 1 9 GLY O O -1.142 13.250 -0.593 1.00 . A A . 9 GLY O 1 1 10 5513 1 1 10 TYR C C -1.654 10.905 -2.901 1.00 . A A . 10 TYR C 1 1 10 5514 1 1 10 TYR CA C -2.720 11.943 -2.475 1.00 . A A . 10 TYR CA 1 1 10 5515 1 1 10 TYR CB C -3.977 11.923 -3.396 1.00 . A A . 10 TYR CB 1 1 10 5516 1 1 10 TYR CD1 C -4.758 9.733 -2.264 1.00 . A A . 10 TYR CD1 1 1 10 5517 1 1 10 TYR CD2 C -6.329 11.037 -3.486 1.00 . A A . 10 TYR CD2 1 1 10 5518 1 1 10 TYR CE1 C -5.745 8.814 -1.979 1.00 . A A . 10 TYR CE1 1 1 10 5519 1 1 10 TYR CE2 C -7.316 10.116 -3.199 1.00 . A A . 10 TYR CE2 1 1 10 5520 1 1 10 TYR CG C -5.037 10.860 -3.024 1.00 . A A . 10 TYR CG 1 1 10 5521 1 1 10 TYR CZ C -7.030 8.998 -2.443 1.00 . A A . 10 TYR CZ 1 1 10 5522 1 1 10 TYR H H -2.307 13.818 -3.403 1.00 . A A . 10 TYR H 1 1 10 5523 1 1 10 TYR HA H -3.002 11.759 -1.449 1.00 . A A . 10 TYR HA 1 1 10 5524 1 1 10 TYR HB2 H -4.454 12.890 -3.345 1.00 . A A . 10 TYR HB2 1 1 10 5525 1 1 10 TYR HB3 H -3.677 11.755 -4.420 1.00 . A A . 10 TYR HB3 1 1 10 5526 1 1 10 TYR HD1 H -3.764 9.561 -1.882 1.00 . A A . 10 TYR HD1 1 1 10 5527 1 1 10 TYR HD2 H -6.574 11.906 -4.079 1.00 . A A . 10 TYR HD2 1 1 10 5528 1 1 10 TYR HE1 H -5.504 7.941 -1.389 1.00 . A A . 10 TYR HE1 1 1 10 5529 1 1 10 TYR HE2 H -8.317 10.271 -3.573 1.00 . A A . 10 TYR HE2 1 1 10 5530 1 1 10 TYR HH H -8.731 8.534 -1.716 1.00 . A A . 10 TYR HH 1 1 10 5531 1 1 10 TYR N N -2.129 13.312 -2.587 1.00 . A A . 10 TYR N 1 1 10 5532 1 1 10 TYR O O -0.486 11.065 -2.602 1.00 . A A . 10 TYR O 1 1 10 5533 1 1 10 TYR OH O -8.015 8.075 -2.160 1.00 . A A . 10 TYR OH 1 1 10 5534 1 1 11 GLU C C -2.017 7.944 -5.048 1.00 . A A . 11 GLU C 1 1 10 5535 1 1 11 GLU CA C -1.193 8.786 -4.069 1.00 . A A . 11 GLU CA 1 1 10 5536 1 1 11 GLU CB C -0.730 7.912 -2.869 1.00 . A A . 11 GLU CB 1 1 10 5537 1 1 11 GLU CD C 0.239 5.724 -3.718 1.00 . A A . 11 GLU CD 1 1 10 5538 1 1 11 GLU CG C 0.573 7.145 -3.219 1.00 . A A . 11 GLU CG 1 1 10 5539 1 1 11 GLU H H -3.046 9.817 -3.790 1.00 . A A . 11 GLU H 1 1 10 5540 1 1 11 GLU HA H -0.355 9.224 -4.593 1.00 . A A . 11 GLU HA 1 1 10 5541 1 1 11 GLU HB2 H -0.537 8.544 -2.015 1.00 . A A . 11 GLU HB2 1 1 10 5542 1 1 11 GLU HB3 H -1.512 7.219 -2.595 1.00 . A A . 11 GLU HB3 1 1 10 5543 1 1 11 GLU HG2 H 1.137 7.665 -3.981 1.00 . A A . 11 GLU HG2 1 1 10 5544 1 1 11 GLU HG3 H 1.192 7.065 -2.337 1.00 . A A . 11 GLU HG3 1 1 10 5545 1 1 11 GLU N N -2.091 9.878 -3.584 1.00 . A A . 11 GLU N 1 1 10 5546 1 1 11 GLU O O -1.535 7.549 -6.092 1.00 . A A . 11 GLU O 1 1 10 5547 1 1 11 GLU OE1 O 0.025 4.879 -2.862 1.00 . A A . 11 GLU OE1 1 1 10 5548 1 1 11 GLU OE2 O 0.216 5.560 -4.928 1.00 . A A . 11 GLU OE2 1 1 10 5549 1 1 12 VAL C C -5.603 7.501 -5.475 1.00 . A A . 12 VAL C 1 1 10 5550 1 1 12 VAL CA C -4.193 6.899 -5.486 1.00 . A A . 12 VAL CA 1 1 10 5551 1 1 12 VAL CB C -4.269 5.439 -4.931 1.00 . A A . 12 VAL CB 1 1 10 5552 1 1 12 VAL CG1 C -2.892 4.826 -4.801 1.00 . A A . 12 VAL CG1 1 1 10 5553 1 1 12 VAL CG2 C -4.964 5.396 -3.541 1.00 . A A . 12 VAL CG2 1 1 10 5554 1 1 12 VAL H H -3.553 8.058 -3.798 1.00 . A A . 12 VAL H 1 1 10 5555 1 1 12 VAL HA H -3.854 6.891 -6.508 1.00 . A A . 12 VAL HA 1 1 10 5556 1 1 12 VAL HB H -4.831 4.823 -5.615 1.00 . A A . 12 VAL HB 1 1 10 5557 1 1 12 VAL HG11 H -2.358 4.879 -5.737 1.00 . A A . 12 VAL HG11 1 1 10 5558 1 1 12 VAL HG12 H -2.335 5.315 -4.021 1.00 . A A . 12 VAL HG12 1 1 10 5559 1 1 12 VAL HG13 H -3.026 3.793 -4.536 1.00 . A A . 12 VAL HG13 1 1 10 5560 1 1 12 VAL HG21 H -5.963 5.804 -3.593 1.00 . A A . 12 VAL HG21 1 1 10 5561 1 1 12 VAL HG22 H -5.042 4.373 -3.202 1.00 . A A . 12 VAL HG22 1 1 10 5562 1 1 12 VAL HG23 H -4.395 5.960 -2.817 1.00 . A A . 12 VAL HG23 1 1 10 5563 1 1 12 VAL N N -3.246 7.704 -4.657 1.00 . A A . 12 VAL N 1 1 10 5564 1 1 12 VAL O O -5.829 8.627 -5.088 1.00 . A A . 12 VAL O 1 1 10 5565 1 1 13 HIS C C -8.559 5.453 -5.980 1.00 . A A . 13 HIS C 1 1 10 5566 1 1 13 HIS CA C -7.941 6.876 -6.066 1.00 . A A . 13 HIS CA 1 1 10 5567 1 1 13 HIS CB C -8.234 7.537 -7.425 1.00 . A A . 13 HIS CB 1 1 10 5568 1 1 13 HIS CD2 C -8.199 10.121 -6.819 1.00 . A A . 13 HIS CD2 1 1 10 5569 1 1 13 HIS CE1 C -6.390 10.613 -7.704 1.00 . A A . 13 HIS CE1 1 1 10 5570 1 1 13 HIS CG C -7.683 8.969 -7.388 1.00 . A A . 13 HIS CG 1 1 10 5571 1 1 13 HIS H H -6.136 5.787 -6.236 1.00 . A A . 13 HIS H 1 1 10 5572 1 1 13 HIS HA H -8.296 7.472 -5.235 1.00 . A A . 13 HIS HA 1 1 10 5573 1 1 13 HIS HB2 H -7.754 6.994 -8.227 1.00 . A A . 13 HIS HB2 1 1 10 5574 1 1 13 HIS HB3 H -9.297 7.578 -7.611 1.00 . A A . 13 HIS HB3 1 1 10 5575 1 1 13 HIS HD1 H -5.946 8.765 -8.403 1.00 . A A . 13 HIS HD1 1 1 10 5576 1 1 13 HIS HD2 H -9.135 10.182 -6.283 1.00 . A A . 13 HIS HD2 1 1 10 5577 1 1 13 HIS HE1 H -5.531 11.171 -8.045 1.00 . A A . 13 HIS HE1 1 1 10 5578 1 1 13 HIS N N -6.478 6.653 -5.937 1.00 . A A . 13 HIS N 1 1 10 5579 1 1 13 HIS ND1 N -6.566 9.348 -7.917 1.00 . A A . 13 HIS ND1 1 1 10 5580 1 1 13 HIS NE2 N -7.381 11.134 -7.025 1.00 . A A . 13 HIS NE2 1 1 10 5581 1 1 13 HIS O O -9.749 5.274 -6.152 1.00 . A A . 13 HIS O 1 1 10 5582 1 1 14 HIS C C -6.970 2.366 -4.706 1.00 . A A . 14 HIS C 1 1 10 5583 1 1 14 HIS CA C -8.045 3.049 -5.578 1.00 . A A . 14 HIS CA 1 1 10 5584 1 1 14 HIS CB C -8.068 2.411 -6.974 1.00 . A A . 14 HIS CB 1 1 10 5585 1 1 14 HIS CD2 C -9.552 3.591 -8.751 1.00 . A A . 14 HIS CD2 1 1 10 5586 1 1 14 HIS CE1 C -11.416 2.932 -8.144 1.00 . A A . 14 HIS CE1 1 1 10 5587 1 1 14 HIS CG C -9.370 2.785 -7.660 1.00 . A A . 14 HIS CG 1 1 10 5588 1 1 14 HIS H H -6.755 4.728 -5.581 1.00 . A A . 14 HIS H 1 1 10 5589 1 1 14 HIS HA H -9.012 2.959 -5.105 1.00 . A A . 14 HIS HA 1 1 10 5590 1 1 14 HIS HB2 H -7.250 2.792 -7.568 1.00 . A A . 14 HIS HB2 1 1 10 5591 1 1 14 HIS HB3 H -7.997 1.339 -6.951 1.00 . A A . 14 HIS HB3 1 1 10 5592 1 1 14 HIS HD1 H -10.777 1.815 -6.578 1.00 . A A . 14 HIS HD1 1 1 10 5593 1 1 14 HIS HD2 H -8.734 4.066 -9.261 1.00 . A A . 14 HIS HD2 1 1 10 5594 1 1 14 HIS HE1 H -12.483 2.773 -8.085 1.00 . A A . 14 HIS HE1 1 1 10 5595 1 1 14 HIS N N -7.695 4.494 -5.709 1.00 . A A . 14 HIS N 1 1 10 5596 1 1 14 HIS ND1 N -10.559 2.406 -7.328 1.00 . A A . 14 HIS ND1 1 1 10 5597 1 1 14 HIS NE2 N -10.832 3.679 -9.049 1.00 . A A . 14 HIS NE2 1 1 10 5598 1 1 14 HIS O O -5.783 2.487 -4.958 1.00 . A A . 14 HIS O 1 1 10 5599 1 1 15 GLN C C -5.583 -0.068 -3.561 1.00 . A A . 15 GLN C 1 1 10 5600 1 1 15 GLN CA C -6.449 0.949 -2.783 1.00 . A A . 15 GLN CA 1 1 10 5601 1 1 15 GLN CB C -7.256 0.223 -1.688 1.00 . A A . 15 GLN CB 1 1 10 5602 1 1 15 GLN CD C -7.024 -1.073 0.444 1.00 . A A . 15 GLN CD 1 1 10 5603 1 1 15 GLN CG C -6.370 -0.008 -0.444 1.00 . A A . 15 GLN CG 1 1 10 5604 1 1 15 GLN H H -8.373 1.587 -3.533 1.00 . A A . 15 GLN H 1 1 10 5605 1 1 15 GLN HA H -5.803 1.691 -2.336 1.00 . A A . 15 GLN HA 1 1 10 5606 1 1 15 GLN HB2 H -8.110 0.825 -1.409 1.00 . A A . 15 GLN HB2 1 1 10 5607 1 1 15 GLN HB3 H -7.616 -0.723 -2.067 1.00 . A A . 15 GLN HB3 1 1 10 5608 1 1 15 GLN HE21 H -8.150 0.242 1.416 1.00 . A A . 15 GLN HE21 1 1 10 5609 1 1 15 GLN HE22 H -8.337 -1.374 1.901 1.00 . A A . 15 GLN HE22 1 1 10 5610 1 1 15 GLN HG2 H -5.384 -0.350 -0.721 1.00 . A A . 15 GLN HG2 1 1 10 5611 1 1 15 GLN HG3 H -6.275 0.908 0.124 1.00 . A A . 15 GLN HG3 1 1 10 5612 1 1 15 GLN N N -7.409 1.657 -3.696 1.00 . A A . 15 GLN N 1 1 10 5613 1 1 15 GLN NE2 N -7.911 -0.704 1.327 1.00 . A A . 15 GLN NE2 1 1 10 5614 1 1 15 GLN O O -4.591 -0.570 -3.069 1.00 . A A . 15 GLN O 1 1 10 5615 1 1 15 GLN OE1 O -6.735 -2.249 0.341 1.00 . A A . 15 GLN OE1 1 1 10 5616 1 1 16 LYS C C -3.935 -0.636 -5.995 1.00 . A A . 16 LYS C 1 1 10 5617 1 1 16 LYS CA C -5.261 -1.292 -5.651 1.00 . A A . 16 LYS CA 1 1 10 5618 1 1 16 LYS CB C -6.118 -1.544 -6.918 1.00 . A A . 16 LYS CB 1 1 10 5619 1 1 16 LYS CD C -4.797 -3.666 -7.282 1.00 . A A . 16 LYS CD 1 1 10 5620 1 1 16 LYS CE C -4.404 -4.707 -8.346 1.00 . A A . 16 LYS CE 1 1 10 5621 1 1 16 LYS CG C -5.351 -2.396 -7.959 1.00 . A A . 16 LYS CG 1 1 10 5622 1 1 16 LYS H H -6.770 0.125 -5.131 1.00 . A A . 16 LYS H 1 1 10 5623 1 1 16 LYS HA H -5.084 -2.202 -5.100 1.00 . A A . 16 LYS HA 1 1 10 5624 1 1 16 LYS HB2 H -7.028 -2.056 -6.637 1.00 . A A . 16 LYS HB2 1 1 10 5625 1 1 16 LYS HB3 H -6.390 -0.599 -7.366 1.00 . A A . 16 LYS HB3 1 1 10 5626 1 1 16 LYS HD2 H -3.928 -3.397 -6.700 1.00 . A A . 16 LYS HD2 1 1 10 5627 1 1 16 LYS HD3 H -5.544 -4.069 -6.613 1.00 . A A . 16 LYS HD3 1 1 10 5628 1 1 16 LYS HE2 H -3.785 -4.256 -9.108 1.00 . A A . 16 LYS HE2 1 1 10 5629 1 1 16 LYS HE3 H -3.856 -5.516 -7.886 1.00 . A A . 16 LYS HE3 1 1 10 5630 1 1 16 LYS HG2 H -6.026 -2.665 -8.759 1.00 . A A . 16 LYS HG2 1 1 10 5631 1 1 16 LYS HG3 H -4.538 -1.821 -8.379 1.00 . A A . 16 LYS HG3 1 1 10 5632 1 1 16 LYS HZ1 H -6.473 -4.839 -8.577 1.00 . A A . 16 LYS HZ1 1 1 10 5633 1 1 16 LYS HZ2 H -5.597 -5.073 -10.015 1.00 . A A . 16 LYS HZ2 1 1 10 5634 1 1 16 LYS HZ3 H -5.651 -6.301 -8.843 1.00 . A A . 16 LYS HZ3 1 1 10 5635 1 1 16 LYS N N -5.985 -0.331 -4.777 1.00 . A A . 16 LYS N 1 1 10 5636 1 1 16 LYS NZ N -5.624 -5.272 -8.994 1.00 . A A . 16 LYS NZ 1 1 10 5637 1 1 16 LYS O O -2.869 -1.198 -5.841 1.00 . A A . 16 LYS O 1 1 10 5638 1 1 17 LEU C C -1.995 1.510 -5.598 1.00 . A A . 17 LEU C 1 1 10 5639 1 1 17 LEU CA C -2.885 1.377 -6.839 1.00 . A A . 17 LEU CA 1 1 10 5640 1 1 17 LEU CB C -3.365 2.747 -7.340 1.00 . A A . 17 LEU CB 1 1 10 5641 1 1 17 LEU CD1 C -4.839 3.999 -8.935 1.00 . A A . 17 LEU CD1 1 1 10 5642 1 1 17 LEU CD2 C -4.009 1.718 -9.594 1.00 . A A . 17 LEU CD2 1 1 10 5643 1 1 17 LEU CG C -4.474 2.599 -8.416 1.00 . A A . 17 LEU CG 1 1 10 5644 1 1 17 LEU H H -4.972 0.956 -6.537 1.00 . A A . 17 LEU H 1 1 10 5645 1 1 17 LEU HA H -2.337 0.848 -7.605 1.00 . A A . 17 LEU HA 1 1 10 5646 1 1 17 LEU HB2 H -3.793 3.277 -6.510 1.00 . A A . 17 LEU HB2 1 1 10 5647 1 1 17 LEU HB3 H -2.530 3.314 -7.727 1.00 . A A . 17 LEU HB3 1 1 10 5648 1 1 17 LEU HD11 H -5.157 4.626 -8.115 1.00 . A A . 17 LEU HD11 1 1 10 5649 1 1 17 LEU HD12 H -3.982 4.455 -9.411 1.00 . A A . 17 LEU HD12 1 1 10 5650 1 1 17 LEU HD13 H -5.643 3.929 -9.653 1.00 . A A . 17 LEU HD13 1 1 10 5651 1 1 17 LEU HD21 H -3.026 2.017 -9.926 1.00 . A A . 17 LEU HD21 1 1 10 5652 1 1 17 LEU HD22 H -3.979 0.682 -9.289 1.00 . A A . 17 LEU HD22 1 1 10 5653 1 1 17 LEU HD23 H -4.701 1.809 -10.418 1.00 . A A . 17 LEU HD23 1 1 10 5654 1 1 17 LEU HG H -5.347 2.147 -7.973 1.00 . A A . 17 LEU HG 1 1 10 5655 1 1 17 LEU N N -4.073 0.577 -6.452 1.00 . A A . 17 LEU N 1 1 10 5656 1 1 17 LEU O O -0.791 1.519 -5.725 1.00 . A A . 17 LEU O 1 1 10 5657 1 1 18 VAL C C -0.858 0.482 -3.096 1.00 . A A . 18 VAL C 1 1 10 5658 1 1 18 VAL CA C -1.761 1.731 -3.183 1.00 . A A . 18 VAL CA 1 1 10 5659 1 1 18 VAL CB C -2.746 1.851 -1.956 1.00 . A A . 18 VAL CB 1 1 10 5660 1 1 18 VAL CG1 C -2.271 1.082 -0.705 1.00 . A A . 18 VAL CG1 1 1 10 5661 1 1 18 VAL CG2 C -2.881 3.329 -1.551 1.00 . A A . 18 VAL CG2 1 1 10 5662 1 1 18 VAL H H -3.568 1.613 -4.379 1.00 . A A . 18 VAL H 1 1 10 5663 1 1 18 VAL HA H -1.135 2.607 -3.266 1.00 . A A . 18 VAL HA 1 1 10 5664 1 1 18 VAL HB H -3.719 1.487 -2.236 1.00 . A A . 18 VAL HB 1 1 10 5665 1 1 18 VAL HG11 H -1.307 1.452 -0.391 1.00 . A A . 18 VAL HG11 1 1 10 5666 1 1 18 VAL HG12 H -2.976 1.229 0.100 1.00 . A A . 18 VAL HG12 1 1 10 5667 1 1 18 VAL HG13 H -2.200 0.025 -0.902 1.00 . A A . 18 VAL HG13 1 1 10 5668 1 1 18 VAL HG21 H -3.047 3.943 -2.417 1.00 . A A . 18 VAL HG21 1 1 10 5669 1 1 18 VAL HG22 H -3.717 3.451 -0.879 1.00 . A A . 18 VAL HG22 1 1 10 5670 1 1 18 VAL HG23 H -1.982 3.668 -1.057 1.00 . A A . 18 VAL HG23 1 1 10 5671 1 1 18 VAL N N -2.588 1.608 -4.430 1.00 . A A . 18 VAL N 1 1 10 5672 1 1 18 VAL O O 0.350 0.596 -3.045 1.00 . A A . 18 VAL O 1 1 10 5673 1 1 19 PHE C C 0.438 -1.956 -4.039 1.00 . A A . 19 PHE C 1 1 10 5674 1 1 19 PHE CA C -0.703 -1.966 -3.015 1.00 . A A . 19 PHE CA 1 1 10 5675 1 1 19 PHE CB C -1.677 -3.134 -3.296 1.00 . A A . 19 PHE CB 1 1 10 5676 1 1 19 PHE CD1 C -3.050 -2.843 -1.178 1.00 . A A . 19 PHE CD1 1 1 10 5677 1 1 19 PHE CD2 C -1.985 -4.944 -1.543 1.00 . A A . 19 PHE CD2 1 1 10 5678 1 1 19 PHE CE1 C -3.567 -3.309 0.012 1.00 . A A . 19 PHE CE1 1 1 10 5679 1 1 19 PHE CE2 C -2.502 -5.411 -0.352 1.00 . A A . 19 PHE CE2 1 1 10 5680 1 1 19 PHE CG C -2.255 -3.655 -1.968 1.00 . A A . 19 PHE CG 1 1 10 5681 1 1 19 PHE CZ C -3.293 -4.594 0.426 1.00 . A A . 19 PHE CZ 1 1 10 5682 1 1 19 PHE H H -2.444 -0.693 -3.146 1.00 . A A . 19 PHE H 1 1 10 5683 1 1 19 PHE HA H -0.275 -2.052 -2.030 1.00 . A A . 19 PHE HA 1 1 10 5684 1 1 19 PHE HB2 H -2.494 -2.806 -3.921 1.00 . A A . 19 PHE HB2 1 1 10 5685 1 1 19 PHE HB3 H -1.164 -3.943 -3.796 1.00 . A A . 19 PHE HB3 1 1 10 5686 1 1 19 PHE HD1 H -3.271 -1.835 -1.492 1.00 . A A . 19 PHE HD1 1 1 10 5687 1 1 19 PHE HD2 H -1.366 -5.592 -2.146 1.00 . A A . 19 PHE HD2 1 1 10 5688 1 1 19 PHE HE1 H -4.186 -2.666 0.620 1.00 . A A . 19 PHE HE1 1 1 10 5689 1 1 19 PHE HE2 H -2.286 -6.419 -0.029 1.00 . A A . 19 PHE HE2 1 1 10 5690 1 1 19 PHE HZ H -3.698 -4.960 1.358 1.00 . A A . 19 PHE HZ 1 1 10 5691 1 1 19 PHE N N -1.469 -0.677 -3.095 1.00 . A A . 19 PHE N 1 1 10 5692 1 1 19 PHE O O 1.579 -2.238 -3.728 1.00 . A A . 19 PHE O 1 1 10 5693 1 1 20 PHE C C 2.207 -0.613 -5.951 1.00 . A A . 20 PHE C 1 1 10 5694 1 1 20 PHE CA C 1.046 -1.544 -6.366 1.00 . A A . 20 PHE CA 1 1 10 5695 1 1 20 PHE CB C 0.246 -1.033 -7.599 1.00 . A A . 20 PHE CB 1 1 10 5696 1 1 20 PHE CD1 C 2.002 -0.798 -9.395 1.00 . A A . 20 PHE CD1 1 1 10 5697 1 1 20 PHE CD2 C 1.022 1.189 -8.515 1.00 . A A . 20 PHE CD2 1 1 10 5698 1 1 20 PHE CE1 C 2.788 -0.038 -10.232 1.00 . A A . 20 PHE CE1 1 1 10 5699 1 1 20 PHE CE2 C 1.806 1.951 -9.350 1.00 . A A . 20 PHE CE2 1 1 10 5700 1 1 20 PHE CG C 1.115 -0.188 -8.533 1.00 . A A . 20 PHE CG 1 1 10 5701 1 1 20 PHE CZ C 2.692 1.338 -10.212 1.00 . A A . 20 PHE CZ 1 1 10 5702 1 1 20 PHE H H -0.865 -1.399 -5.425 1.00 . A A . 20 PHE H 1 1 10 5703 1 1 20 PHE HA H 1.433 -2.536 -6.555 1.00 . A A . 20 PHE HA 1 1 10 5704 1 1 20 PHE HB2 H -0.142 -1.873 -8.157 1.00 . A A . 20 PHE HB2 1 1 10 5705 1 1 20 PHE HB3 H -0.593 -0.434 -7.276 1.00 . A A . 20 PHE HB3 1 1 10 5706 1 1 20 PHE HD1 H 2.079 -1.875 -9.416 1.00 . A A . 20 PHE HD1 1 1 10 5707 1 1 20 PHE HD2 H 0.330 1.678 -7.847 1.00 . A A . 20 PHE HD2 1 1 10 5708 1 1 20 PHE HE1 H 3.477 -0.529 -10.901 1.00 . A A . 20 PHE HE1 1 1 10 5709 1 1 20 PHE HE2 H 1.719 3.026 -9.321 1.00 . A A . 20 PHE HE2 1 1 10 5710 1 1 20 PHE HZ H 3.310 1.933 -10.869 1.00 . A A . 20 PHE HZ 1 1 10 5711 1 1 20 PHE N N 0.071 -1.614 -5.246 1.00 . A A . 20 PHE N 1 1 10 5712 1 1 20 PHE O O 3.358 -0.992 -6.004 1.00 . A A . 20 PHE O 1 1 10 5713 1 1 21 ALA C C 3.851 1.006 -4.073 1.00 . A A . 21 ALA C 1 1 10 5714 1 1 21 ALA CA C 2.882 1.591 -5.101 1.00 . A A . 21 ALA CA 1 1 10 5715 1 1 21 ALA CB C 2.148 2.803 -4.504 1.00 . A A . 21 ALA CB 1 1 10 5716 1 1 21 ALA H H 0.918 0.819 -5.508 1.00 . A A . 21 ALA H 1 1 10 5717 1 1 21 ALA HA H 3.460 1.886 -5.967 1.00 . A A . 21 ALA HA 1 1 10 5718 1 1 21 ALA HB1 H 1.306 3.068 -5.125 1.00 . A A . 21 ALA HB1 1 1 10 5719 1 1 21 ALA HB2 H 1.791 2.585 -3.509 1.00 . A A . 21 ALA HB2 1 1 10 5720 1 1 21 ALA HB3 H 2.818 3.649 -4.453 1.00 . A A . 21 ALA HB3 1 1 10 5721 1 1 21 ALA N N 1.864 0.581 -5.535 1.00 . A A . 21 ALA N 1 1 10 5722 1 1 21 ALA O O 5.041 1.191 -4.196 1.00 . A A . 21 ALA O 1 1 10 5723 1 1 22 GLU C C 5.247 -1.228 -2.736 1.00 . A A . 22 GLU C 1 1 10 5724 1 1 22 GLU CA C 4.242 -0.288 -2.051 1.00 . A A . 22 GLU CA 1 1 10 5725 1 1 22 GLU CB C 3.407 -1.090 -1.028 1.00 . A A . 22 GLU CB 1 1 10 5726 1 1 22 GLU CD C 1.541 0.469 -0.401 1.00 . A A . 22 GLU CD 1 1 10 5727 1 1 22 GLU CG C 2.865 -0.151 0.070 1.00 . A A . 22 GLU CG 1 1 10 5728 1 1 22 GLU H H 2.369 0.223 -3.056 1.00 . A A . 22 GLU H 1 1 10 5729 1 1 22 GLU HA H 4.800 0.508 -1.578 1.00 . A A . 22 GLU HA 1 1 10 5730 1 1 22 GLU HB2 H 2.592 -1.592 -1.528 1.00 . A A . 22 GLU HB2 1 1 10 5731 1 1 22 GLU HB3 H 4.029 -1.842 -0.560 1.00 . A A . 22 GLU HB3 1 1 10 5732 1 1 22 GLU HG2 H 2.682 -0.714 0.975 1.00 . A A . 22 GLU HG2 1 1 10 5733 1 1 22 GLU HG3 H 3.574 0.634 0.296 1.00 . A A . 22 GLU HG3 1 1 10 5734 1 1 22 GLU N N 3.340 0.317 -3.090 1.00 . A A . 22 GLU N 1 1 10 5735 1 1 22 GLU O O 6.440 -1.115 -2.533 1.00 . A A . 22 GLU O 1 1 10 5736 1 1 22 GLU OE1 O 0.558 -0.251 -0.331 1.00 . A A . 22 GLU OE1 1 1 10 5737 1 1 22 GLU OE2 O 1.588 1.620 -0.806 1.00 . A A . 22 GLU OE2 1 1 10 5738 1 1 23 ASP C C 6.729 -2.370 -4.956 1.00 . A A . 23 ASP C 1 1 10 5739 1 1 23 ASP CA C 5.575 -3.109 -4.278 1.00 . A A . 23 ASP CA 1 1 10 5740 1 1 23 ASP CB C 4.742 -3.817 -5.359 1.00 . A A . 23 ASP CB 1 1 10 5741 1 1 23 ASP CG C 5.587 -4.934 -5.998 1.00 . A A . 23 ASP CG 1 1 10 5742 1 1 23 ASP H H 3.748 -2.143 -3.642 1.00 . A A . 23 ASP H 1 1 10 5743 1 1 23 ASP HA H 5.975 -3.823 -3.573 1.00 . A A . 23 ASP HA 1 1 10 5744 1 1 23 ASP HB2 H 3.834 -4.226 -4.953 1.00 . A A . 23 ASP HB2 1 1 10 5745 1 1 23 ASP HB3 H 4.463 -3.112 -6.129 1.00 . A A . 23 ASP HB3 1 1 10 5746 1 1 23 ASP N N 4.719 -2.124 -3.535 1.00 . A A . 23 ASP N 1 1 10 5747 1 1 23 ASP O O 7.891 -2.677 -4.788 1.00 . A A . 23 ASP O 1 1 10 5748 1 1 23 ASP OD1 O 5.721 -5.961 -5.354 1.00 . A A . 23 ASP OD1 1 1 10 5749 1 1 23 ASP OD2 O 6.056 -4.691 -7.099 1.00 . A A . 23 ASP OD2 1 1 10 5750 1 1 24 VAL C C 8.274 0.116 -5.585 1.00 . A A . 24 VAL C 1 1 10 5751 1 1 24 VAL CA C 7.210 -0.508 -6.491 1.00 . A A . 24 VAL CA 1 1 10 5752 1 1 24 VAL CB C 6.288 0.541 -7.146 1.00 . A A . 24 VAL CB 1 1 10 5753 1 1 24 VAL CG1 C 7.074 1.552 -7.974 1.00 . A A . 24 VAL CG1 1 1 10 5754 1 1 24 VAL CG2 C 5.247 -0.179 -8.034 1.00 . A A . 24 VAL CG2 1 1 10 5755 1 1 24 VAL H H 5.346 -1.237 -5.762 1.00 . A A . 24 VAL H 1 1 10 5756 1 1 24 VAL HA H 7.706 -1.103 -7.242 1.00 . A A . 24 VAL HA 1 1 10 5757 1 1 24 VAL HB H 5.761 1.085 -6.380 1.00 . A A . 24 VAL HB 1 1 10 5758 1 1 24 VAL HG11 H 7.685 1.040 -8.700 1.00 . A A . 24 VAL HG11 1 1 10 5759 1 1 24 VAL HG12 H 6.380 2.206 -8.482 1.00 . A A . 24 VAL HG12 1 1 10 5760 1 1 24 VAL HG13 H 7.697 2.144 -7.322 1.00 . A A . 24 VAL HG13 1 1 10 5761 1 1 24 VAL HG21 H 5.128 -1.212 -7.738 1.00 . A A . 24 VAL HG21 1 1 10 5762 1 1 24 VAL HG22 H 4.293 0.313 -7.921 1.00 . A A . 24 VAL HG22 1 1 10 5763 1 1 24 VAL HG23 H 5.541 -0.158 -9.070 1.00 . A A . 24 VAL HG23 1 1 10 5764 1 1 24 VAL N N 6.309 -1.395 -5.709 1.00 . A A . 24 VAL N 1 1 10 5765 1 1 24 VAL O O 9.455 0.015 -5.843 1.00 . A A . 24 VAL O 1 1 10 5766 1 1 25 GLY C C 9.835 0.468 -3.146 1.00 . A A . 25 GLY C 1 1 10 5767 1 1 25 GLY CA C 8.700 1.410 -3.547 1.00 . A A . 25 GLY CA 1 1 10 5768 1 1 25 GLY H H 6.834 0.759 -4.421 1.00 . A A . 25 GLY H 1 1 10 5769 1 1 25 GLY HA2 H 9.112 2.305 -3.990 1.00 . A A . 25 GLY HA2 1 1 10 5770 1 1 25 GLY HA3 H 8.125 1.670 -2.670 1.00 . A A . 25 GLY HA3 1 1 10 5771 1 1 25 GLY N N 7.803 0.740 -4.541 1.00 . A A . 25 GLY N 1 1 10 5772 1 1 25 GLY O O 10.995 0.827 -3.189 1.00 . A A . 25 GLY O 1 1 10 5773 1 1 26 SER C C 11.366 -2.147 -3.495 1.00 . A A . 26 SER C 1 1 10 5774 1 1 26 SER CA C 10.420 -1.762 -2.345 1.00 . A A . 26 SER CA 1 1 10 5775 1 1 26 SER CB C 9.643 -3.006 -1.867 1.00 . A A . 26 SER CB 1 1 10 5776 1 1 26 SER H H 8.479 -0.911 -2.760 1.00 . A A . 26 SER H 1 1 10 5777 1 1 26 SER HA H 11.007 -1.368 -1.534 1.00 . A A . 26 SER HA 1 1 10 5778 1 1 26 SER HB2 H 9.097 -3.479 -2.670 1.00 . A A . 26 SER HB2 1 1 10 5779 1 1 26 SER HB3 H 10.299 -3.721 -1.391 1.00 . A A . 26 SER HB3 1 1 10 5780 1 1 26 SER HG H 8.905 -2.927 -0.068 1.00 . A A . 26 SER HG 1 1 10 5781 1 1 26 SER N N 9.439 -0.718 -2.767 1.00 . A A . 26 SER N 1 1 10 5782 1 1 26 SER O O 12.565 -1.981 -3.408 1.00 . A A . 26 SER O 1 1 10 5783 1 1 26 SER OG O 8.722 -2.502 -0.909 1.00 . A A . 26 SER OG 1 1 10 5784 1 1 27 ASN C C 12.378 -1.953 -6.371 1.00 . A A . 27 ASN C 1 1 10 5785 1 1 27 ASN CA C 11.546 -3.075 -5.756 1.00 . A A . 27 ASN CA 1 1 10 5786 1 1 27 ASN CB C 10.522 -3.622 -6.768 1.00 . A A . 27 ASN CB 1 1 10 5787 1 1 27 ASN CG C 9.984 -4.976 -6.278 1.00 . A A . 27 ASN CG 1 1 10 5788 1 1 27 ASN H H 9.812 -2.728 -4.560 1.00 . A A . 27 ASN H 1 1 10 5789 1 1 27 ASN HA H 12.244 -3.831 -5.439 1.00 . A A . 27 ASN HA 1 1 10 5790 1 1 27 ASN HB2 H 9.695 -2.935 -6.869 1.00 . A A . 27 ASN HB2 1 1 10 5791 1 1 27 ASN HB3 H 10.978 -3.752 -7.733 1.00 . A A . 27 ASN HB3 1 1 10 5792 1 1 27 ASN HD21 H 8.111 -4.331 -6.137 1.00 . A A . 27 ASN HD21 1 1 10 5793 1 1 27 ASN HD22 H 8.352 -5.952 -5.704 1.00 . A A . 27 ASN HD22 1 1 10 5794 1 1 27 ASN N N 10.782 -2.642 -4.552 1.00 . A A . 27 ASN N 1 1 10 5795 1 1 27 ASN ND2 N 8.711 -5.096 -6.018 1.00 . A A . 27 ASN ND2 1 1 10 5796 1 1 27 ASN O O 13.589 -1.977 -6.285 1.00 . A A . 27 ASN O 1 1 10 5797 1 1 27 ASN OD1 O 10.717 -5.933 -6.129 1.00 . A A . 27 ASN OD1 1 1 10 5798 1 1 28 LYS C C 13.406 0.744 -6.591 1.00 . A A . 28 LYS C 1 1 10 5799 1 1 28 LYS CA C 12.421 0.154 -7.610 1.00 . A A . 28 LYS CA 1 1 10 5800 1 1 28 LYS CB C 11.373 1.210 -8.031 1.00 . A A . 28 LYS CB 1 1 10 5801 1 1 28 LYS CD C 10.482 2.552 -9.989 1.00 . A A . 28 LYS CD 1 1 10 5802 1 1 28 LYS CE C 10.850 3.970 -9.497 1.00 . A A . 28 LYS CE 1 1 10 5803 1 1 28 LYS CG C 11.541 1.521 -9.528 1.00 . A A . 28 LYS CG 1 1 10 5804 1 1 28 LYS H H 10.740 -1.049 -7.005 1.00 . A A . 28 LYS H 1 1 10 5805 1 1 28 LYS HA H 12.988 -0.205 -8.462 1.00 . A A . 28 LYS HA 1 1 10 5806 1 1 28 LYS HB2 H 10.375 0.830 -7.870 1.00 . A A . 28 LYS HB2 1 1 10 5807 1 1 28 LYS HB3 H 11.496 2.109 -7.446 1.00 . A A . 28 LYS HB3 1 1 10 5808 1 1 28 LYS HD2 H 10.441 2.555 -11.069 1.00 . A A . 28 LYS HD2 1 1 10 5809 1 1 28 LYS HD3 H 9.506 2.275 -9.617 1.00 . A A . 28 LYS HD3 1 1 10 5810 1 1 28 LYS HE2 H 11.922 4.109 -9.480 1.00 . A A . 28 LYS HE2 1 1 10 5811 1 1 28 LYS HE3 H 10.415 4.708 -10.154 1.00 . A A . 28 LYS HE3 1 1 10 5812 1 1 28 LYS HG2 H 12.539 1.893 -9.711 1.00 . A A . 28 LYS HG2 1 1 10 5813 1 1 28 LYS HG3 H 11.407 0.606 -10.087 1.00 . A A . 28 LYS HG3 1 1 10 5814 1 1 28 LYS HZ1 H 9.816 3.343 -7.799 1.00 . A A . 28 LYS HZ1 1 1 10 5815 1 1 28 LYS HZ2 H 11.106 4.396 -7.475 1.00 . A A . 28 LYS HZ2 1 1 10 5816 1 1 28 LYS HZ3 H 9.662 5.002 -8.131 1.00 . A A . 28 LYS HZ3 1 1 10 5817 1 1 28 LYS N N 11.715 -1.001 -6.974 1.00 . A A . 28 LYS N 1 1 10 5818 1 1 28 LYS NZ N 10.318 4.194 -8.122 1.00 . A A . 28 LYS NZ 1 1 10 5819 1 1 28 LYS O O 14.478 1.172 -6.955 1.00 . A A . 28 LYS O 1 1 10 5820 1 1 29 GLY C C 15.241 0.539 -4.284 1.00 . A A . 29 GLY C 1 1 10 5821 1 1 29 GLY CA C 13.901 1.284 -4.267 1.00 . A A . 29 GLY CA 1 1 10 5822 1 1 29 GLY H H 12.140 0.369 -5.115 1.00 . A A . 29 GLY H 1 1 10 5823 1 1 29 GLY HA2 H 14.068 2.338 -4.439 1.00 . A A . 29 GLY HA2 1 1 10 5824 1 1 29 GLY HA3 H 13.432 1.143 -3.306 1.00 . A A . 29 GLY HA3 1 1 10 5825 1 1 29 GLY N N 13.017 0.738 -5.340 1.00 . A A . 29 GLY N 1 1 10 5826 1 1 29 GLY O O 16.285 1.135 -4.470 1.00 . A A . 29 GLY O 1 1 10 5827 1 1 30 ALA C C 17.194 -1.400 -5.409 1.00 . A A . 30 ALA C 1 1 10 5828 1 1 30 ALA CA C 16.424 -1.583 -4.097 1.00 . A A . 30 ALA CA 1 1 10 5829 1 1 30 ALA CB C 16.041 -3.057 -3.912 1.00 . A A . 30 ALA CB 1 1 10 5830 1 1 30 ALA H H 14.299 -1.191 -3.967 1.00 . A A . 30 ALA H 1 1 10 5831 1 1 30 ALA HA H 17.054 -1.241 -3.288 1.00 . A A . 30 ALA HA 1 1 10 5832 1 1 30 ALA HB1 H 15.509 -3.185 -2.981 1.00 . A A . 30 ALA HB1 1 1 10 5833 1 1 30 ALA HB2 H 15.407 -3.385 -4.723 1.00 . A A . 30 ALA HB2 1 1 10 5834 1 1 30 ALA HB3 H 16.930 -3.671 -3.892 1.00 . A A . 30 ALA HB3 1 1 10 5835 1 1 30 ALA N N 15.172 -0.758 -4.100 1.00 . A A . 30 ALA N 1 1 10 5836 1 1 30 ALA O O 18.393 -1.218 -5.414 1.00 . A A . 30 ALA O 1 1 10 5837 1 1 31 ILE C C 17.891 -0.014 -7.910 1.00 . A A . 31 ILE C 1 1 10 5838 1 1 31 ILE CA C 17.041 -1.289 -7.853 1.00 . A A . 31 ILE CA 1 1 10 5839 1 1 31 ILE CB C 15.812 -1.284 -8.805 1.00 . A A . 31 ILE CB 1 1 10 5840 1 1 31 ILE CD1 C 14.040 -2.845 -9.803 1.00 . A A . 31 ILE CD1 1 1 10 5841 1 1 31 ILE CG1 C 15.327 -2.754 -8.958 1.00 . A A . 31 ILE CG1 1 1 10 5842 1 1 31 ILE CG2 C 16.121 -0.651 -10.172 1.00 . A A . 31 ILE CG2 1 1 10 5843 1 1 31 ILE H H 15.504 -1.596 -6.410 1.00 . A A . 31 ILE H 1 1 10 5844 1 1 31 ILE HA H 17.701 -2.124 -8.039 1.00 . A A . 31 ILE HA 1 1 10 5845 1 1 31 ILE HB H 15.025 -0.713 -8.343 1.00 . A A . 31 ILE HB 1 1 10 5846 1 1 31 ILE HD11 H 13.332 -2.084 -9.509 1.00 . A A . 31 ILE HD11 1 1 10 5847 1 1 31 ILE HD12 H 14.271 -2.723 -10.851 1.00 . A A . 31 ILE HD12 1 1 10 5848 1 1 31 ILE HD13 H 13.581 -3.813 -9.663 1.00 . A A . 31 ILE HD13 1 1 10 5849 1 1 31 ILE HG12 H 16.109 -3.342 -9.411 1.00 . A A . 31 ILE HG12 1 1 10 5850 1 1 31 ILE HG13 H 15.126 -3.169 -7.982 1.00 . A A . 31 ILE HG13 1 1 10 5851 1 1 31 ILE HG21 H 16.913 -1.189 -10.666 1.00 . A A . 31 ILE HG21 1 1 10 5852 1 1 31 ILE HG22 H 15.235 -0.670 -10.790 1.00 . A A . 31 ILE HG22 1 1 10 5853 1 1 31 ILE HG23 H 16.410 0.381 -10.040 1.00 . A A . 31 ILE HG23 1 1 10 5854 1 1 31 ILE N N 16.465 -1.448 -6.489 1.00 . A A . 31 ILE N 1 1 10 5855 1 1 31 ILE O O 19.056 -0.062 -8.255 1.00 . A A . 31 ILE O 1 1 10 5856 1 1 32 ILE C C 19.271 2.273 -6.703 1.00 . A A . 32 ILE C 1 1 10 5857 1 1 32 ILE CA C 18.024 2.394 -7.580 1.00 . A A . 32 ILE CA 1 1 10 5858 1 1 32 ILE CB C 17.073 3.500 -7.052 1.00 . A A . 32 ILE CB 1 1 10 5859 1 1 32 ILE CD1 C 14.670 4.276 -7.330 1.00 . A A . 32 ILE CD1 1 1 10 5860 1 1 32 ILE CG1 C 15.877 3.626 -8.034 1.00 . A A . 32 ILE CG1 1 1 10 5861 1 1 32 ILE CG2 C 17.823 4.855 -6.981 1.00 . A A . 32 ILE CG2 1 1 10 5862 1 1 32 ILE H H 16.351 1.077 -7.301 1.00 . A A . 32 ILE H 1 1 10 5863 1 1 32 ILE HA H 18.344 2.593 -8.589 1.00 . A A . 32 ILE HA 1 1 10 5864 1 1 32 ILE HB H 16.721 3.230 -6.067 1.00 . A A . 32 ILE HB 1 1 10 5865 1 1 32 ILE HD11 H 14.497 3.814 -6.369 1.00 . A A . 32 ILE HD11 1 1 10 5866 1 1 32 ILE HD12 H 14.845 5.332 -7.183 1.00 . A A . 32 ILE HD12 1 1 10 5867 1 1 32 ILE HD13 H 13.784 4.154 -7.935 1.00 . A A . 32 ILE HD13 1 1 10 5868 1 1 32 ILE HG12 H 16.166 4.215 -8.888 1.00 . A A . 32 ILE HG12 1 1 10 5869 1 1 32 ILE HG13 H 15.591 2.651 -8.395 1.00 . A A . 32 ILE HG13 1 1 10 5870 1 1 32 ILE HG21 H 18.322 5.059 -7.918 1.00 . A A . 32 ILE HG21 1 1 10 5871 1 1 32 ILE HG22 H 17.129 5.659 -6.778 1.00 . A A . 32 ILE HG22 1 1 10 5872 1 1 32 ILE HG23 H 18.560 4.834 -6.192 1.00 . A A . 32 ILE HG23 1 1 10 5873 1 1 32 ILE N N 17.291 1.095 -7.566 1.00 . A A . 32 ILE N 1 1 10 5874 1 1 32 ILE O O 20.344 2.655 -7.118 1.00 . A A . 32 ILE O 1 1 10 5875 1 1 33 GLY C C 21.410 0.843 -5.299 1.00 . A A . 33 GLY C 1 1 10 5876 1 1 33 GLY CA C 20.260 1.574 -4.592 1.00 . A A . 33 GLY CA 1 1 10 5877 1 1 33 GLY H H 18.202 1.451 -5.254 1.00 . A A . 33 GLY H 1 1 10 5878 1 1 33 GLY HA2 H 20.599 2.551 -4.275 1.00 . A A . 33 GLY HA2 1 1 10 5879 1 1 33 GLY HA3 H 19.948 1.002 -3.731 1.00 . A A . 33 GLY HA3 1 1 10 5880 1 1 33 GLY N N 19.098 1.739 -5.522 1.00 . A A . 33 GLY N 1 1 10 5881 1 1 33 GLY O O 22.540 1.289 -5.286 1.00 . A A . 33 GLY O 1 1 10 5882 1 1 34 LEU C C 22.785 -0.220 -7.735 1.00 . A A . 34 LEU C 1 1 10 5883 1 1 34 LEU CA C 22.122 -1.064 -6.636 1.00 . A A . 34 LEU CA 1 1 10 5884 1 1 34 LEU CB C 21.444 -2.314 -7.248 1.00 . A A . 34 LEU CB 1 1 10 5885 1 1 34 LEU CD1 C 19.716 -4.088 -6.696 1.00 . A A . 34 LEU CD1 1 1 10 5886 1 1 34 LEU CD2 C 21.937 -4.122 -5.530 1.00 . A A . 34 LEU CD2 1 1 10 5887 1 1 34 LEU CG C 20.846 -3.209 -6.119 1.00 . A A . 34 LEU CG 1 1 10 5888 1 1 34 LEU H H 20.155 -0.575 -5.891 1.00 . A A . 34 LEU H 1 1 10 5889 1 1 34 LEU HA H 22.885 -1.340 -5.924 1.00 . A A . 34 LEU HA 1 1 10 5890 1 1 34 LEU HB2 H 20.655 -1.997 -7.915 1.00 . A A . 34 LEU HB2 1 1 10 5891 1 1 34 LEU HB3 H 22.165 -2.875 -7.823 1.00 . A A . 34 LEU HB3 1 1 10 5892 1 1 34 LEU HD11 H 20.031 -4.549 -7.623 1.00 . A A . 34 LEU HD11 1 1 10 5893 1 1 34 LEU HD12 H 19.447 -4.865 -5.995 1.00 . A A . 34 LEU HD12 1 1 10 5894 1 1 34 LEU HD13 H 18.841 -3.486 -6.887 1.00 . A A . 34 LEU HD13 1 1 10 5895 1 1 34 LEU HD21 H 22.357 -4.751 -6.301 1.00 . A A . 34 LEU HD21 1 1 10 5896 1 1 34 LEU HD22 H 22.721 -3.523 -5.097 1.00 . A A . 34 LEU HD22 1 1 10 5897 1 1 34 LEU HD23 H 21.520 -4.751 -4.757 1.00 . A A . 34 LEU HD23 1 1 10 5898 1 1 34 LEU HG H 20.442 -2.599 -5.325 1.00 . A A . 34 LEU HG 1 1 10 5899 1 1 34 LEU N N 21.085 -0.267 -5.912 1.00 . A A . 34 LEU N 1 1 10 5900 1 1 34 LEU O O 23.997 -0.173 -7.823 1.00 . A A . 34 LEU O 1 1 10 5901 1 1 35 MET C C 23.485 2.319 -9.100 1.00 . A A . 35 MET C 1 1 10 5902 1 1 35 MET CA C 22.487 1.286 -9.647 1.00 . A A . 35 MET CA 1 1 10 5903 1 1 35 MET CB C 21.297 2.005 -10.316 1.00 . A A . 35 MET CB 1 1 10 5904 1 1 35 MET CE C 18.341 0.316 -12.733 1.00 . A A . 35 MET CE 1 1 10 5905 1 1 35 MET CG C 20.414 0.992 -11.070 1.00 . A A . 35 MET CG 1 1 10 5906 1 1 35 MET H H 21.002 0.335 -8.405 1.00 . A A . 35 MET H 1 1 10 5907 1 1 35 MET HA H 22.996 0.658 -10.360 1.00 . A A . 35 MET HA 1 1 10 5908 1 1 35 MET HB2 H 20.703 2.509 -9.568 1.00 . A A . 35 MET HB2 1 1 10 5909 1 1 35 MET HB3 H 21.664 2.743 -11.013 1.00 . A A . 35 MET HB3 1 1 10 5910 1 1 35 MET HE1 H 18.604 -0.683 -12.417 1.00 . A A . 35 MET HE1 1 1 10 5911 1 1 35 MET HE2 H 17.286 0.352 -12.963 1.00 . A A . 35 MET HE2 1 1 10 5912 1 1 35 MET HE3 H 18.908 0.576 -13.615 1.00 . A A . 35 MET HE3 1 1 10 5913 1 1 35 MET HG2 H 20.889 0.777 -12.017 1.00 . A A . 35 MET HG2 1 1 10 5914 1 1 35 MET HG3 H 20.372 0.068 -10.511 1.00 . A A . 35 MET HG3 1 1 10 5915 1 1 35 MET N N 21.968 0.423 -8.534 1.00 . A A . 35 MET N 1 1 10 5916 1 1 35 MET O O 24.578 2.469 -9.613 1.00 . A A . 35 MET O 1 1 10 5917 1 1 35 MET SD S 18.707 1.494 -11.408 1.00 . A A . 35 MET SD 1 1 10 5918 1 1 36 VAL C C 25.215 3.438 -6.957 1.00 . A A . 36 VAL C 1 1 10 5919 1 1 36 VAL CA C 23.866 4.039 -7.382 1.00 . A A . 36 VAL CA 1 1 10 5920 1 1 36 VAL CB C 23.054 4.555 -6.155 1.00 . A A . 36 VAL CB 1 1 10 5921 1 1 36 VAL CG1 C 23.941 5.426 -5.232 1.00 . A A . 36 VAL CG1 1 1 10 5922 1 1 36 VAL CG2 C 21.869 5.413 -6.658 1.00 . A A . 36 VAL CG2 1 1 10 5923 1 1 36 VAL H H 22.156 2.798 -7.731 1.00 . A A . 36 VAL H 1 1 10 5924 1 1 36 VAL HA H 24.048 4.845 -8.079 1.00 . A A . 36 VAL HA 1 1 10 5925 1 1 36 VAL HB H 22.662 3.719 -5.591 1.00 . A A . 36 VAL HB 1 1 10 5926 1 1 36 VAL HG11 H 24.492 6.152 -5.813 1.00 . A A . 36 VAL HG11 1 1 10 5927 1 1 36 VAL HG12 H 23.330 5.949 -4.511 1.00 . A A . 36 VAL HG12 1 1 10 5928 1 1 36 VAL HG13 H 24.643 4.803 -4.697 1.00 . A A . 36 VAL HG13 1 1 10 5929 1 1 36 VAL HG21 H 21.358 4.918 -7.471 1.00 . A A . 36 VAL HG21 1 1 10 5930 1 1 36 VAL HG22 H 21.164 5.574 -5.855 1.00 . A A . 36 VAL HG22 1 1 10 5931 1 1 36 VAL HG23 H 22.222 6.372 -7.009 1.00 . A A . 36 VAL HG23 1 1 10 5932 1 1 36 VAL N N 23.050 2.990 -8.065 1.00 . A A . 36 VAL N 1 1 10 5933 1 1 36 VAL O O 26.249 4.013 -7.236 1.00 . A A . 36 VAL O 1 1 10 5934 1 1 37 GLY C C 27.361 1.405 -7.018 1.00 . A A . 37 GLY C 1 1 10 5935 1 1 37 GLY CA C 26.408 1.628 -5.835 1.00 . A A . 37 GLY CA 1 1 10 5936 1 1 37 GLY H H 24.288 1.902 -6.091 1.00 . A A . 37 GLY H 1 1 10 5937 1 1 37 GLY HA2 H 26.894 2.243 -5.090 1.00 . A A . 37 GLY HA2 1 1 10 5938 1 1 37 GLY HA3 H 26.151 0.675 -5.399 1.00 . A A . 37 GLY HA3 1 1 10 5939 1 1 37 GLY N N 25.157 2.307 -6.294 1.00 . A A . 37 GLY N 1 1 10 5940 1 1 37 GLY O O 28.502 1.823 -6.983 1.00 . A A . 37 GLY O 1 1 10 5941 1 1 38 GLY C C 28.415 -0.863 -9.084 1.00 . A A . 38 GLY C 1 1 10 5942 1 1 38 GLY CA C 27.653 0.454 -9.259 1.00 . A A . 38 GLY CA 1 1 10 5943 1 1 38 GLY H H 25.926 0.439 -7.974 1.00 . A A . 38 GLY H 1 1 10 5944 1 1 38 GLY HA2 H 26.982 0.368 -10.101 1.00 . A A . 38 GLY HA2 1 1 10 5945 1 1 38 GLY HA3 H 28.356 1.254 -9.441 1.00 . A A . 38 GLY HA3 1 1 10 5946 1 1 38 GLY N N 26.850 0.748 -8.029 1.00 . A A . 38 GLY N 1 1 10 5947 1 1 38 GLY O O 28.618 -1.601 -10.028 1.00 . A A . 38 GLY O 1 1 10 5948 1 1 39 VAL C C 28.758 -3.000 -6.347 1.00 . A A . 39 VAL C 1 1 10 5949 1 1 39 VAL CA C 29.562 -2.320 -7.470 1.00 . A A . 39 VAL CA 1 1 10 5950 1 1 39 VAL CB C 30.988 -1.903 -6.978 1.00 . A A . 39 VAL CB 1 1 10 5951 1 1 39 VAL CG1 C 31.931 -3.129 -6.999 1.00 . A A . 39 VAL CG1 1 1 10 5952 1 1 39 VAL CG2 C 31.582 -0.811 -7.902 1.00 . A A . 39 VAL CG2 1 1 10 5953 1 1 39 VAL H H 28.596 -0.442 -7.165 1.00 . A A . 39 VAL H 1 1 10 5954 1 1 39 VAL HA H 29.603 -2.987 -8.312 1.00 . A A . 39 VAL HA 1 1 10 5955 1 1 39 VAL HB H 30.923 -1.513 -5.972 1.00 . A A . 39 VAL HB 1 1 10 5956 1 1 39 VAL HG11 H 31.968 -3.559 -7.991 1.00 . A A . 39 VAL HG11 1 1 10 5957 1 1 39 VAL HG12 H 32.931 -2.835 -6.714 1.00 . A A . 39 VAL HG12 1 1 10 5958 1 1 39 VAL HG13 H 31.591 -3.885 -6.308 1.00 . A A . 39 VAL HG13 1 1 10 5959 1 1 39 VAL HG21 H 31.503 -1.107 -8.938 1.00 . A A . 39 VAL HG21 1 1 10 5960 1 1 39 VAL HG22 H 31.052 0.121 -7.764 1.00 . A A . 39 VAL HG22 1 1 10 5961 1 1 39 VAL HG23 H 32.625 -0.647 -7.666 1.00 . A A . 39 VAL HG23 1 1 10 5962 1 1 39 VAL N N 28.807 -1.095 -7.858 1.00 . A A . 39 VAL N 1 1 10 5963 1 1 39 VAL O O 29.294 -3.697 -5.506 1.00 . A A . 39 VAL O 1 1 10 5964 1 1 40 VAL C C 25.285 -3.837 -6.157 1.00 . A A . 40 VAL C 1 1 10 5965 1 1 40 VAL CA C 26.517 -3.320 -5.390 1.00 . A A . 40 VAL CA 1 1 10 5966 1 1 40 VAL CB C 26.105 -2.201 -4.385 1.00 . A A . 40 VAL CB 1 1 10 5967 1 1 40 VAL CG1 C 25.281 -2.813 -3.231 1.00 . A A . 40 VAL CG1 1 1 10 5968 1 1 40 VAL CG2 C 27.362 -1.522 -3.792 1.00 . A A . 40 VAL CG2 1 1 10 5969 1 1 40 VAL H H 27.122 -2.185 -7.103 1.00 . A A . 40 VAL H 1 1 10 5970 1 1 40 VAL HA H 26.986 -4.143 -4.868 1.00 . A A . 40 VAL HA 1 1 10 5971 1 1 40 VAL HB H 25.506 -1.457 -4.891 1.00 . A A . 40 VAL HB 1 1 10 5972 1 1 40 VAL HG11 H 25.837 -3.604 -2.747 1.00 . A A . 40 VAL HG11 1 1 10 5973 1 1 40 VAL HG12 H 25.048 -2.054 -2.499 1.00 . A A . 40 VAL HG12 1 1 10 5974 1 1 40 VAL HG13 H 24.355 -3.222 -3.607 1.00 . A A . 40 VAL HG13 1 1 10 5975 1 1 40 VAL HG21 H 28.036 -2.263 -3.386 1.00 . A A . 40 VAL HG21 1 1 10 5976 1 1 40 VAL HG22 H 27.880 -0.960 -4.557 1.00 . A A . 40 VAL HG22 1 1 10 5977 1 1 40 VAL HG23 H 27.079 -0.841 -3.003 1.00 . A A . 40 VAL HG23 1 1 10 5978 1 1 40 VAL N N 27.472 -2.757 -6.390 1.00 . A A . 40 VAL N 1 1 10 5979 1 1 40 VAL O O 24.953 -4.988 -5.929 1.00 . A A . 40 VAL O 1 1 10 5980 1 1 40 VAL OXT O 24.748 -3.054 -6.926 1.00 . A A . 40 VAL OXT 1 1 stop_ save_
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