NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
425983 | 2gx1 | 7186 | cing | 4-filtered-FRED | STAR | entry | full | 418 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2gx1 # This FRED archive file contains, for PDB entry <2gx1>: # # - 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_2gx1 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2gx1 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3292.02 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 $Neurotoxin_magi_5 A . 1 1 stop_ save_ save_Neurotoxin_magi_5 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Neurotoxin magi 5" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GCKLTFWKCKNKKECCGWNACALGICMPR _Entity.Number_of_monomers 29 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 CYS . 1 1 3 LYS . 1 1 4 LEU . 1 1 5 THR . 1 1 6 PHE . 1 1 7 TRP . 1 1 8 LYS . 1 1 9 CYS . 1 1 10 LYS . 1 1 11 ASN . 1 1 12 LYS . 1 1 13 LYS . 1 1 14 GLU . 1 1 15 CYS . 1 1 16 CYS . 1 1 17 GLY . 1 1 18 TRP . 1 1 19 ASN . 1 1 20 ALA . 1 1 21 CYS . 1 1 22 ALA . 1 1 23 LEU . 1 1 24 GLY . 1 1 25 ILE . 1 1 26 CYS . 1 1 27 MET . 1 1 28 PRO . 1 1 29 ARG . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 CYS 2 2 1 1 LYS 3 3 1 1 LEU 4 4 1 1 THR 5 5 1 1 PHE 6 6 1 1 TRP 7 7 1 1 LYS 8 8 1 1 CYS 9 9 1 1 LYS 10 10 1 1 ASN 11 11 1 1 LYS 12 12 1 1 LYS 13 13 1 1 GLU 14 14 1 1 CYS 15 15 1 1 CYS 16 16 1 1 GLY 17 17 1 1 TRP 18 18 1 1 ASN 19 19 1 1 ALA 20 20 1 1 CYS 21 21 1 1 ALA 22 22 1 1 LEU 23 23 1 1 GLY 24 24 1 1 ILE 25 25 1 1 CYS 26 26 1 1 MET 27 27 1 1 PRO 28 28 1 1 ARG 29 29 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 2 CYS SG . 2 . SG 1 1 1 1 2 1 1 16 CYS SG . 16 . SG 1 1 2 1 1 1 1 9 CYS SG . 9 . SG 1 1 2 1 2 1 1 21 CYS SG . 21 . SG 1 1 3 1 1 1 1 15 CYS SG . 15 . SG 1 1 3 1 2 1 1 26 CYS SG . 26 . SG 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.02 1.92 2.02 1 1 2 1 . . . . . 2.02 1.92 2.02 1 1 3 1 . . . . . 2.02 1.92 2.02 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_5_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _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 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 31 1 . . . 1 2 32 1 . . . 1 2 33 1 . . . 1 2 34 1 . . . 1 2 35 1 . . . 1 2 36 1 . . . 1 2 37 1 . . . 1 2 38 1 . . . 1 2 39 1 . . . 1 2 40 1 . . . 1 2 41 1 . . . 1 2 42 1 . . . 1 2 43 1 . . . 1 2 44 1 . . . 1 2 45 1 . . . 1 2 46 1 . . . 1 2 47 1 . . . 1 2 48 1 . . . 1 2 49 1 . . . 1 2 50 1 . . . 1 2 51 1 . . . 1 2 52 1 . . . 1 2 53 1 . . . 1 2 54 1 . . . 1 2 55 1 . . . 1 2 56 1 . . . 1 2 57 1 . . . 1 2 58 1 . . . 1 2 59 1 . . . 1 2 60 1 . . . 1 2 61 1 . . . 1 2 62 1 . . . 1 2 63 1 . . . 1 2 64 1 . . . 1 2 65 1 . . . 1 2 66 1 . . . 1 2 67 1 . . . 1 2 68 1 . . . 1 2 69 1 . . . 1 2 70 1 . . . 1 2 71 1 . . . 1 2 72 1 . . . 1 2 73 1 . . . 1 2 74 1 . . . 1 2 75 1 . . . 1 2 76 1 . . . 1 2 77 1 . . . 1 2 78 1 . . . 1 2 79 1 . . . 1 2 80 1 . . . 1 2 81 1 . . . 1 2 82 1 . . . 1 2 83 1 . . . 1 2 84 1 . . . 1 2 85 1 . . . 1 2 86 1 . . . 1 2 87 1 . . . 1 2 88 1 . . . 1 2 89 1 . . . 1 2 90 1 . . . 1 2 91 1 . . . 1 2 92 1 . . . 1 2 93 1 . . . 1 2 94 1 . . . 1 2 95 1 . . . 1 2 96 1 . . . 1 2 97 1 . . . 1 2 98 1 . . . 1 2 99 1 . . . 1 2 100 1 . . . 1 2 101 1 . . . 1 2 102 1 . . . 1 2 103 1 . . . 1 2 104 1 . . . 1 2 105 1 . . . 1 2 106 1 . . . 1 2 107 1 . . . 1 2 108 1 . . . 1 2 109 1 . . . 1 2 110 1 . . . 1 2 111 1 . . . 1 2 112 1 . . . 1 2 113 1 . . . 1 2 114 1 . . . 1 2 115 1 . . . 1 2 116 1 . . . 1 2 117 1 . . . 1 2 118 1 . . . 1 2 119 1 . . . 1 2 120 1 . . . 1 2 121 1 . . . 1 2 122 1 . . . 1 2 123 1 . . . 1 2 124 1 . . . 1 2 125 1 . . . 1 2 126 1 . . . 1 2 127 1 . . . 1 2 128 1 . . . 1 2 129 1 . . . 1 2 130 1 . . . 1 2 131 1 . . . 1 2 132 1 . . . 1 2 133 1 . . . 1 2 134 1 . . . 1 2 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 3 LYS H . 3 . HN 1 2 1 1 2 1 1 14 GLU HA . 14 . HA 1 2 2 1 1 1 1 3 LYS H . 3 . HN 1 2 2 1 2 1 1 14 GLU QG . 14 . HG* 1 2 3 1 1 1 1 3 LYS H . 3 . HN 1 2 3 1 2 1 1 15 CYS H . 15 . HN 1 2 4 1 1 1 1 3 LYS H . 3 . HN 1 2 4 1 2 1 1 16 CYS H . 16 . HN 1 2 5 1 1 1 1 3 LYS H . 3 . HN 1 2 5 1 2 1 1 16 CYS HA . 16 . HA 1 2 6 1 1 1 1 3 LYS QB . 3 . HB* 1 2 6 1 2 1 1 15 CYS H . 15 . HN 1 2 7 1 1 1 1 3 LYS HB2 . 3 . HB2 1 2 7 1 2 1 1 15 CYS HA . 15 . HA 1 2 8 1 1 1 1 3 LYS HB3 . 3 . HB1 1 2 8 1 2 1 1 15 CYS HA . 15 . HA 1 2 9 1 1 1 1 3 LYS QB . 3 . HB* 1 2 9 1 2 1 1 15 CYS QB . 15 . HB* 1 2 10 1 1 1 1 3 LYS QB . 3 . HB* 1 2 10 1 2 1 1 16 CYS H . 16 . HN 1 2 11 1 1 1 1 4 LEU HA . 4 . HA 1 2 11 1 2 1 1 16 CYS QB . 16 . HB* 1 2 12 1 1 1 1 4 LEU MD1 . 4 . HD1* 1 2 12 1 2 1 1 16 CYS HB2 . 16 . HB2 1 2 13 1 1 1 1 4 LEU MD1 . 4 . HD1* 1 2 13 1 2 1 1 16 CYS HB3 . 16 . HB1 1 2 14 1 1 1 1 5 THR H . 5 . HN 1 2 14 1 2 1 1 19 ASN HD22 . 19 . HD22 1 2 15 1 1 1 1 5 THR HA . 5 . HA 1 2 15 1 2 1 1 19 ASN HD22 . 19 . HD22 1 2 16 1 1 1 1 5 THR HA . 5 . HA 1 2 16 1 2 1 1 26 CYS H . 26 . HN 1 2 17 1 1 1 1 5 THR HA . 5 . HA 1 2 17 1 2 1 1 26 CYS HA . 26 . HA 1 2 18 1 1 1 1 5 THR HA . 5 . HA 1 2 18 1 2 1 1 26 CYS HB2 . 26 . HB2 1 2 19 1 1 1 1 5 THR HA . 5 . HA 1 2 19 1 2 1 1 26 CYS HB3 . 26 . HB1 1 2 20 1 1 1 1 5 THR HA . 5 . HA 1 2 20 1 2 1 1 27 MET H . 27 . HN 1 2 21 1 1 1 1 5 THR HA . 5 . HA 1 2 21 1 2 1 1 27 MET HA . 27 . HA 1 2 22 1 1 1 1 5 THR HB . 5 . HB 1 2 22 1 2 1 1 19 ASN HD22 . 19 . HD22 1 2 23 1 1 1 1 5 THR MG . 5 . HG2* 1 2 23 1 2 1 1 19 ASN HD22 . 19 . HD22 1 2 24 1 1 1 1 5 THR MG . 5 . HG2* 1 2 24 1 2 1 1 26 CYS H . 26 . HN 1 2 25 1 1 1 1 5 THR MG . 5 . HG2* 1 2 25 1 2 1 1 26 CYS HB2 . 26 . HB2 1 2 26 1 1 1 1 5 THR MG . 5 . HG2* 1 2 26 1 2 1 1 26 CYS HB3 . 26 . HB1 1 2 27 1 1 1 1 5 THR MG . 5 . HG2* 1 2 27 1 2 1 1 27 MET H . 27 . HN 1 2 28 1 1 1 1 5 THR MG . 5 . HG2* 1 2 28 1 2 1 1 27 MET HA . 27 . HA 1 2 29 1 1 1 1 5 THR MG . 5 . HG2* 1 2 29 1 2 1 1 28 PRO QD . 28 . HD* 1 2 30 1 1 1 1 5 THR MG . 5 . HG2* 1 2 30 1 2 1 1 29 ARG H . 29 . HN 1 2 31 1 1 1 1 6 PHE H . 6 . HN 1 2 31 1 2 1 1 25 ILE HB . 25 . HB 1 2 32 1 1 1 1 6 PHE H . 6 . HN 1 2 32 1 2 1 1 25 ILE MD . 25 . HD1* 1 2 33 1 1 1 1 6 PHE H . 6 . HN 1 2 33 1 2 1 1 25 ILE MG . 25 . HG2* 1 2 34 1 1 1 1 6 PHE H . 6 . HN 1 2 34 1 2 1 1 26 CYS H . 26 . HN 1 2 35 1 1 1 1 6 PHE H . 6 . HN 1 2 35 1 2 1 1 26 CYS QB . 26 . HB* 1 2 36 1 1 1 1 6 PHE H . 6 . HN 1 2 36 1 2 1 1 27 MET HA . 27 . HA 1 2 37 1 1 1 1 6 PHE HA . 6 . HA 1 2 37 1 2 1 1 25 ILE HB . 25 . HB 1 2 38 1 1 1 1 6 PHE HA . 6 . HA 1 2 38 1 2 1 1 25 ILE MD . 25 . HD1* 1 2 39 1 1 1 1 6 PHE HA . 6 . HA 1 2 39 1 2 1 1 25 ILE MG . 25 . HG2* 1 2 40 1 1 1 1 6 PHE HA . 6 . HA 1 2 40 1 2 1 1 26 CYS H . 26 . HN 1 2 41 1 1 1 1 6 PHE HB2 . 6 . HB2 1 2 41 1 2 1 1 25 ILE MD . 25 . HD1* 1 2 42 1 1 1 1 6 PHE HB2 . 6 . HB2 1 2 42 1 2 1 1 25 ILE MG . 25 . HG2* 1 2 43 1 1 1 1 6 PHE HB3 . 6 . HB1 1 2 43 1 2 1 1 25 ILE MD . 25 . HD1* 1 2 44 1 1 1 1 6 PHE HB3 . 6 . HB1 1 2 44 1 2 1 1 25 ILE MG . 25 . HG2* 1 2 45 1 1 1 1 6 PHE QD . 6 . HD* 1 2 45 1 2 1 1 25 ILE HB . 25 . HB 1 2 46 1 1 1 1 6 PHE QD . 6 . HD* 1 2 46 1 2 1 1 25 ILE HG12 . 25 . HG12 1 2 47 1 1 1 1 6 PHE QD . 6 . HD* 1 2 47 1 2 1 1 25 ILE HG13 . 25 . HG11 1 2 48 1 1 1 1 6 PHE QD . 6 . HD* 1 2 48 1 2 1 1 25 ILE MD . 25 . HD1* 1 2 49 1 1 1 1 6 PHE QD . 6 . HD* 1 2 49 1 2 1 1 27 MET HA . 27 . HA 1 2 50 1 1 1 1 6 PHE QE . 6 . HE* 1 2 50 1 2 1 1 25 ILE HB . 25 . HB 1 2 51 1 1 1 1 6 PHE QE . 6 . HE* 1 2 51 1 2 1 1 25 ILE HG13 . 25 . HG11 1 2 52 1 1 1 1 6 PHE QE . 6 . HE* 1 2 52 1 2 1 1 25 ILE MD . 25 . HD1* 1 2 53 1 1 1 1 6 PHE QE . 6 . HE* 1 2 53 1 2 1 1 25 ILE MG . 25 . HG2* 1 2 54 1 1 1 1 6 PHE QE . 6 . HE* 1 2 54 1 2 1 1 28 PRO QD . 28 . HD* 1 2 55 1 1 1 1 7 TRP H . 7 . HN 1 2 55 1 2 1 1 25 ILE HA . 25 . HA 1 2 56 1 1 1 1 7 TRP H . 7 . HN 1 2 56 1 2 1 1 25 ILE HB . 25 . HB 1 2 57 1 1 1 1 7 TRP H . 7 . HN 1 2 57 1 2 1 1 25 ILE MG . 25 . HG2* 1 2 58 1 1 1 1 7 TRP H . 7 . HN 1 2 58 1 2 1 1 26 CYS H . 26 . HN 1 2 59 1 1 1 1 7 TRP H . 7 . HN 1 2 59 1 2 1 1 26 CYS HA . 26 . HA 1 2 60 1 1 1 1 7 TRP H . 7 . HN 1 2 60 1 2 1 1 26 CYS HB2 . 26 . HB2 1 2 61 1 1 1 1 7 TRP H . 7 . HN 1 2 61 1 2 1 1 26 CYS HB3 . 26 . HB1 1 2 62 1 1 1 1 7 TRP HD1 . 7 . HD1 1 2 62 1 2 1 1 26 CYS H . 26 . HN 1 2 63 1 1 1 1 8 LYS H . 8 . HN 1 2 63 1 2 1 1 25 ILE HA . 25 . HA 1 2 64 1 1 1 1 8 LYS H . 8 . HN 1 2 64 1 2 1 1 25 ILE MG . 25 . HG2* 1 2 65 1 1 1 1 8 LYS HA . 8 . HA 1 2 65 1 2 1 1 25 ILE MD . 25 . HD1* 1 2 66 1 1 1 1 8 LYS HA . 8 . HA 1 2 66 1 2 1 1 25 ILE MG . 25 . HG2* 1 2 67 1 1 1 1 8 LYS HA . 8 . HA 1 2 67 1 2 1 1 26 CYS H . 26 . HN 1 2 68 1 1 1 1 8 LYS QB . 8 . HB* 1 2 68 1 2 1 1 25 ILE HA . 25 . HA 1 2 69 1 1 1 1 9 CYS H . 9 . HN 1 2 69 1 2 1 1 24 GLY QA . 24 . HA* 1 2 70 1 1 1 1 9 CYS H . 9 . HN 1 2 70 1 2 1 1 25 ILE H . 25 . HN 1 2 71 1 1 1 1 9 CYS H . 9 . HN 1 2 71 1 2 1 1 25 ILE HA . 25 . HA 1 2 72 1 1 1 1 9 CYS H . 9 . HN 1 2 72 1 2 1 1 25 ILE HB . 25 . HB 1 2 73 1 1 1 1 9 CYS H . 9 . HN 1 2 73 1 2 1 1 25 ILE MG . 25 . HG2* 1 2 74 1 1 1 1 9 CYS H . 9 . HN 1 2 74 1 2 1 1 26 CYS H . 26 . HN 1 2 75 1 1 1 1 9 CYS QB . 9 . HB* 1 2 75 1 2 1 1 25 ILE MG . 25 . HG2* 1 2 76 1 1 1 1 10 LYS H . 10 . HN 1 2 76 1 2 1 1 21 CYS QB . 21 . HB* 1 2 77 1 1 1 1 11 ASN H . 11 . HN 1 2 77 1 2 1 1 21 CYS QB . 21 . HB* 1 2 78 1 1 1 1 11 ASN HA . 11 . HA 1 2 78 1 2 1 1 21 CYS HB2 . 21 . HB2 1 2 79 1 1 1 1 11 ASN HA . 11 . HA 1 2 79 1 2 1 1 21 CYS HB3 . 21 . HB1 1 2 80 1 1 1 1 12 LYS H . 12 . HN 1 2 80 1 2 1 1 21 CYS H . 21 . HN 1 2 81 1 1 1 1 12 LYS H . 12 . HN 1 2 81 1 2 1 1 21 CYS HB2 . 21 . HB2 1 2 82 1 1 1 1 12 LYS H . 12 . HN 1 2 82 1 2 1 1 21 CYS HB3 . 21 . HB1 1 2 83 1 1 1 1 12 LYS HA . 12 . HA 1 2 83 1 2 1 1 21 CYS HA . 21 . HA 1 2 84 1 1 1 1 12 LYS HA . 12 . HA 1 2 84 1 2 1 1 21 CYS HB2 . 21 . HB2 1 2 85 1 1 1 1 12 LYS HA . 12 . HA 1 2 85 1 2 1 1 21 CYS HB3 . 21 . HB1 1 2 86 1 1 1 1 12 LYS HB2 . 12 . HB2 1 2 86 1 2 1 1 20 ALA HA . 20 . HA 1 2 87 1 1 1 1 12 LYS HB3 . 12 . HB1 1 2 87 1 2 1 1 20 ALA HA . 20 . HA 1 2 88 1 1 1 1 12 LYS QB . 12 . HB* 1 2 88 1 2 1 1 20 ALA MB . 20 . HB* 1 2 89 1 1 1 1 12 LYS HB2 . 12 . HB2 1 2 89 1 2 1 1 21 CYS H . 21 . HN 1 2 90 1 1 1 1 12 LYS HB3 . 12 . HB1 1 2 90 1 2 1 1 21 CYS H . 21 . HN 1 2 91 1 1 1 1 12 LYS QB . 12 . HB* 1 2 91 1 2 1 1 21 CYS HB2 . 21 . HB2 1 2 92 1 1 1 1 12 LYS QB . 12 . HB* 1 2 92 1 2 1 1 21 CYS HB3 . 21 . HB1 1 2 93 1 1 1 1 12 LYS QG . 12 . HG* 1 2 93 1 2 1 1 18 TRP HD1 . 18 . HD1 1 2 94 1 1 1 1 12 LYS QG . 12 . HG* 1 2 94 1 2 1 1 20 ALA HA . 20 . HA 1 2 95 1 1 1 1 12 LYS QG . 12 . HG* 1 2 95 1 2 1 1 21 CYS QB . 21 . HB* 1 2 96 1 1 1 1 13 LYS HA . 13 . HA 1 2 96 1 2 1 1 18 TRP HD1 . 18 . HD1 1 2 97 1 1 1 1 13 LYS HA . 13 . HA 1 2 97 1 2 1 1 18 TRP HE1 . 18 . HE1 1 2 98 1 1 1 1 13 LYS QB . 13 . HB* 1 2 98 1 2 1 1 18 TRP HD1 . 18 . HD1 1 2 99 1 1 1 1 13 LYS QB . 13 . HB* 1 2 99 1 2 1 1 18 TRP HE1 . 18 . HE1 1 2 100 1 1 1 1 15 CYS HA . 15 . HA 1 2 100 1 2 1 1 26 CYS QB . 26 . HB* 1 2 101 1 1 1 1 19 ASN HA . 19 . HA 1 2 101 1 2 1 1 27 MET H . 27 . HN 1 2 102 1 1 1 1 19 ASN HA . 19 . HA 1 2 102 1 2 1 1 29 ARG H . 29 . HN 1 2 103 1 1 1 1 19 ASN HA . 19 . HA 1 2 103 1 2 1 1 29 ARG QG . 29 . HG* 1 2 104 1 1 1 1 19 ASN QB . 19 . HB* 1 2 104 1 2 1 1 26 CYS QB . 26 . HB* 1 2 105 1 1 1 1 19 ASN QB . 19 . HB* 1 2 105 1 2 1 1 27 MET H . 27 . HN 1 2 106 1 1 1 1 19 ASN HD21 . 19 . HD21 1 2 106 1 2 1 1 26 CYS HA . 26 . HA 1 2 107 1 1 1 1 19 ASN HD21 . 19 . HD21 1 2 107 1 2 1 1 28 PRO HA . 28 . HA 1 2 108 1 1 1 1 19 ASN HD22 . 19 . HD22 1 2 108 1 2 1 1 26 CYS HB2 . 26 . HB2 1 2 109 1 1 1 1 19 ASN HD22 . 19 . HD22 1 2 109 1 2 1 1 26 CYS HB3 . 26 . HB1 1 2 110 1 1 1 1 19 ASN HD22 . 19 . HD22 1 2 110 1 2 1 1 28 PRO HA . 28 . HA 1 2 111 1 1 1 1 19 ASN HD22 . 19 . HD22 1 2 111 1 2 1 1 28 PRO QG . 28 . HG* 1 2 112 1 1 1 1 19 ASN HD22 . 19 . HD22 1 2 112 1 2 1 1 29 ARG H . 29 . HN 1 2 113 1 1 1 1 20 ALA H . 20 . HN 1 2 113 1 2 1 1 27 MET H . 27 . HN 1 2 114 1 1 1 1 20 ALA MB . 20 . HB* 1 2 114 1 2 1 1 26 CYS HA . 26 . HA 1 2 115 1 1 1 1 20 ALA MB . 20 . HB* 1 2 115 1 2 1 1 27 MET H . 27 . HN 1 2 116 1 1 1 1 20 ALA MB . 20 . HB* 1 2 116 1 2 1 1 27 MET HB2 . 27 . HB2 1 2 117 1 1 1 1 20 ALA MB . 20 . HB* 1 2 117 1 2 1 1 27 MET HB3 . 27 . HB1 1 2 118 1 1 1 1 20 ALA MB . 20 . HB* 1 2 118 1 2 1 1 27 MET QG . 27 . HG* 1 2 119 1 1 1 1 20 ALA MB . 20 . HB* 1 2 119 1 2 1 1 29 ARG H . 29 . HN 1 2 120 1 1 1 1 20 ALA MB . 20 . HB* 1 2 120 1 2 1 1 29 ARG HA . 29 . HA 1 2 121 1 1 1 1 20 ALA MB . 20 . HB* 1 2 121 1 2 1 1 29 ARG QD . 29 . HD* 1 2 122 1 1 1 1 21 CYS H . 21 . HN 1 2 122 1 2 1 1 27 MET H . 27 . HN 1 2 123 1 1 1 1 21 CYS HA . 21 . HA 1 2 123 1 2 1 1 27 MET H . 27 . HN 1 2 124 1 1 1 1 21 CYS QB . 21 . HB* 1 2 124 1 2 1 1 26 CYS HA . 26 . HA 1 2 125 1 1 1 1 22 ALA H . 22 . HN 1 2 125 1 2 1 1 27 MET H . 27 . HN 1 2 126 1 1 1 1 22 ALA H . 22 . HN 1 2 126 1 2 1 1 27 MET QG . 27 . HG* 1 2 127 1 1 1 1 22 ALA MB . 22 . HB* 1 2 127 1 2 1 1 27 MET H . 27 . HN 1 2 128 1 1 1 1 22 ALA MB . 22 . HB* 1 2 128 1 2 1 1 27 MET HA . 27 . HA 1 2 129 1 1 1 1 22 ALA MB . 22 . HB* 1 2 129 1 2 1 1 27 MET HB2 . 27 . HB2 1 2 130 1 1 1 1 22 ALA MB . 22 . HB* 1 2 130 1 2 1 1 27 MET HB3 . 27 . HB1 1 2 131 1 1 1 1 22 ALA MB . 22 . HB* 1 2 131 1 2 1 1 27 MET QG . 27 . HG* 1 2 132 1 1 1 1 22 ALA MB . 22 . HB* 1 2 132 1 2 1 1 28 PRO QB . 28 . HB* 1 2 133 1 1 1 1 23 LEU MD2 . 23 . HD2* 1 2 133 1 2 1 1 28 PRO QB . 28 . HB* 1 2 134 1 1 1 1 23 LEU MD1 . 23 . HD1* 1 2 134 1 2 1 1 28 PRO QB . 28 . HB* 1 2 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 . . . . . 5.6 1.8 5.6 1 2 2 1 . . . . . 5.51 1.8 5.51 1 2 3 1 . . . . . 5.18 1.8 5.18 1 2 4 1 . . . . . 4.57 1.8 4.57 1 2 5 1 . . . . . 5.06 1.8 5.06 1 2 6 1 . . . . . 5.83 1.8 5.83 1 2 7 1 . . . . . 4.93 1.8 4.93 1 2 8 1 . . . . . 4.93 1.8 4.93 1 2 9 1 . . . . . 4.13 1.8 4.13 1 2 10 1 . . . . . 5.26 1.8 5.26 1 2 11 1 . . . . . 4.63 1.8 4.63 1 2 12 1 . . . . . 4.51 1.8 4.51 1 2 13 1 . . . . . 4.51 1.8 4.51 1 2 14 1 . . . . . 6.1 1.8 6.1 1 2 15 1 . . . . . 4.29 1.8 4.29 1 2 16 1 . . . . . 3.99 1.8 3.99 1 2 17 1 . . . . . 5.09 1.8 5.09 1 2 18 1 . . . . . 3.84 1.8 3.84 1 2 19 1 . . . . . 3.84 1.8 3.84 1 2 20 1 . . . . . 5.79 1.8 5.79 1 2 21 1 . . . . . 4.97 1.8 4.97 1 2 22 1 . . . . . 4.86 1.8 4.86 1 2 23 1 . . . . . 4.08 1.8 4.08 1 2 24 1 . . . . . 5.38 1.8 5.38 1 2 25 1 . . . . . 4.87 1.8 4.87 1 2 26 1 . . . . . 4.87 1.8 4.87 1 2 27 1 . . . . . 5.37 1.8 5.37 1 2 28 1 . . . . . 3.76 1.8 3.76 1 2 29 1 . . . . . 4.66 1.8 4.66 1 2 30 1 . . . . . 6.23 1.8 6.23 1 2 31 1 . . . . . 5.12 1.8 5.12 1 2 32 1 . . . . . 4.99 1.8 4.99 1 2 33 1 . . . . . 4.14 1.8 4.14 1 2 34 1 . . . . . 4.86 1.8 4.86 1 2 35 1 . . . . . 4.5 1.8 4.5 1 2 36 1 . . . . . 6.09 1.8 6.09 1 2 37 1 . . . . . 3.91 1.8 3.91 1 2 38 1 . . . . . 3.75 1.8 3.75 1 2 39 1 . . . . . 3.33 1.8 3.33 1 2 40 1 . . . . . 4.44 1.8 4.44 1 2 41 1 . . . . . 4.86 1.8 4.86 1 2 42 1 . . . . . 4.79 1.8 4.79 1 2 43 1 . . . . . 4.86 1.8 4.86 1 2 44 1 . . . . . 4.79 1.8 4.79 1 2 45 1 . . . . . 4.31 1.8 4.31 1 2 46 1 . . . . . 5.53 1.8 5.53 1 2 47 1 . . . . . 5.53 1.8 5.53 1 2 48 1 . . . . . 3.3 1.8 3.3 1 2 49 1 . . . . . 5.8 1.8 5.8 1 2 50 1 . . . . . 5.37 1.8 5.37 1 2 51 1 . . . . . 5.41 1.8 5.41 1 2 52 1 . . . . . 4.71 1.8 4.71 1 2 53 1 . . . . . 4.93 1.8 4.93 1 2 54 1 . . . . . 5.16 1.8 5.16 1 2 55 1 . . . . . 5.35 1.8 5.35 1 2 56 1 . . . . . 4.94 1.8 4.94 1 2 57 1 . . . . . 4.5 1.8 4.5 1 2 58 1 . . . . . 4.04 1.8 4.04 1 2 59 1 . . . . . 5.67 1.8 5.67 1 2 60 1 . . . . . 5.01 1.8 5.01 1 2 61 1 . . . . . 5.01 1.8 5.01 1 2 62 1 . . . . . 5.19 1.8 5.19 1 2 63 1 . . . . . 4.97 1.8 4.97 1 2 64 1 . . . . . 4.54 1.8 4.54 1 2 65 1 . . . . . 4.57 1.8 4.57 1 2 66 1 . . . . . 4.22 1.8 4.22 1 2 67 1 . . . . . 4.91 1.8 4.91 1 2 68 1 . . . . . 5.25 1.8 5.25 1 2 69 1 . . . . . 4.74 1.8 4.74 1 2 70 1 . . . . . 5.01 1.8 5.01 1 2 71 1 . . . . . 3.48 1.8 3.48 1 2 72 1 . . . . . 4.7 1.8 4.7 1 2 73 1 . . . . . 4.15 1.8 4.15 1 2 74 1 . . . . . 4.03 1.8 4.03 1 2 75 1 . . . . . 4.82 1.8 4.82 1 2 76 1 . . . . . 5.83 1.1 5.83 1 2 77 1 . . . . . 4.81 1.8 4.81 1 2 78 1 . . . . . 4.14 1.8 4.14 1 2 79 1 . . . . . 4.14 1.8 4.14 1 2 80 1 . . . . . 4.38 1.8 4.38 1 2 81 1 . . . . . 3.98 1.8 3.98 1 2 82 1 . . . . . 3.98 1.8 3.98 1 2 83 1 . . . . . 5.41 1.8 5.41 1 2 84 1 . . . . . 3.5 1.8 3.5 1 2 85 1 . . . . . 3.5 1.8 3.5 1 2 86 1 . . . . . 4.69 1.8 4.69 1 2 87 1 . . . . . 4.69 1.8 4.69 1 2 88 1 . . . . . 4.38 1.8 4.38 1 2 89 1 . . . . . 4.51 1.8 4.51 1 2 90 1 . . . . . 4.51 1.8 4.51 1 2 91 1 . . . . . 4.39 1.8 4.39 1 2 92 1 . . . . . 4.39 1.8 4.39 1 2 93 1 . . . . . 6.05 1.8 6.05 1 2 94 1 . . . . . 4.33 1.8 4.33 1 2 95 1 . . . . . 5.13 1.8 5.13 1 2 96 1 . . . . . 4.03 1.8 4.03 1 2 97 1 . . . . . 4.6 1.8 4.6 1 2 98 1 . . . . . 4.8 1.8 4.8 1 2 99 1 . . . . . 4.6 1.8 4.6 1 2 100 1 . . . . . 5.31 1.8 5.31 1 2 101 1 . . . . . 5.49 1.8 5.49 1 2 102 1 . . . . . 4.32 1.8 4.32 1 2 103 1 . . . . . 5.09 1.8 5.09 1 2 104 1 . . . . . 3.97 1.8 3.97 1 2 105 1 . . . . . 5.07 1.8 5.07 1 2 106 1 . . . . . 5.98 1.8 5.98 1 2 107 1 . . . . . 5.98 1.8 5.98 1 2 108 1 . . . . . 5.16 1.8 5.16 1 2 109 1 . . . . . 5.16 1.8 5.16 1 2 110 1 . . . . . 5.57 1.8 5.57 1 2 111 1 . . . . . 6.54 1.8 6.54 1 2 112 1 . . . . . 5.43 1.8 5.43 1 2 113 1 . . . . . 4.43 1.8 4.43 1 2 114 1 . . . . . 5.43 1.8 5.43 1 2 115 1 . . . . . 4.19 1.8 4.19 1 2 116 1 . . . . . 5.48 1.8 5.48 1 2 117 1 . . . . . 5.48 1.8 5.48 1 2 118 1 . . . . . 5.75 1.8 5.75 1 2 119 1 . . . . . 5.31 1.8 5.31 1 2 120 1 . . . . . 4.27 1.8 4.27 1 2 121 1 . . . . . 4.66 1.8 4.66 1 2 122 1 . . . . . 5.31 1.8 5.31 1 2 123 1 . . . . . 4.0 1.8 4.0 1 2 124 1 . . . . . 4.82 1.8 4.82 1 2 125 1 . . . . . 4.35 1.8 4.35 1 2 126 1 . . . . . 5.43 1.8 5.43 1 2 127 1 . . . . . 4.87 1.8 4.87 1 2 128 1 . . . . . 5.26 1.8 5.26 1 2 129 1 . . . . . 4.08 1.8 4.08 1 2 130 1 . . . . . 4.08 1.8 4.08 1 2 131 1 . . . . . 4.87 1.8 4.87 1 2 132 1 . . . . . 3.83 1.8 3.83 1 2 133 1 . . . . . 4.07 1.8 4.07 1 2 134 1 . . . . . 4.46 1.8 4.46 1 2 stop_ save_ save_CNS/XPLOR_distance_constraints_7_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 3 _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 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 9 1 . . . 1 3 10 1 . . . 1 3 11 1 . . . 1 3 12 1 . . . 1 3 13 1 . . . 1 3 14 1 . . . 1 3 15 1 . . . 1 3 16 1 . . . 1 3 17 1 . . . 1 3 18 1 . . . 1 3 19 1 . . . 1 3 20 1 . . . 1 3 21 1 . . . 1 3 22 1 . . . 1 3 23 1 . . . 1 3 24 1 . . . 1 3 25 1 . . . 1 3 26 1 . . . 1 3 27 1 . . . 1 3 28 1 . . . 1 3 29 1 . . . 1 3 30 1 . . . 1 3 31 1 . . . 1 3 32 1 . . . 1 3 33 1 . . . 1 3 34 1 . . . 1 3 35 1 . . . 1 3 36 1 . . . 1 3 37 1 . . . 1 3 38 1 . . . 1 3 39 1 . . . 1 3 40 1 . . . 1 3 41 1 . . . 1 3 42 1 . . . 1 3 43 1 . . . 1 3 44 1 . . . 1 3 45 1 . . . 1 3 46 1 . . . 1 3 47 1 . . . 1 3 48 1 . . . 1 3 49 1 . . . 1 3 50 1 . . . 1 3 51 1 . . . 1 3 52 1 . . . 1 3 53 1 . . . 1 3 54 1 . . . 1 3 55 1 . . . 1 3 56 1 . . . 1 3 57 1 . . . 1 3 58 1 . . . 1 3 59 1 . . . 1 3 60 1 . . . 1 3 61 1 . . . 1 3 62 1 . . . 1 3 63 1 . . . 1 3 64 1 . . . 1 3 65 1 . . . 1 3 66 1 . . . 1 3 67 1 . . . 1 3 68 1 . . . 1 3 69 1 . . . 1 3 70 1 . . . 1 3 71 1 . . . 1 3 72 1 . . . 1 3 73 1 . . . 1 3 74 1 . . . 1 3 75 1 . . . 1 3 76 1 . . . 1 3 77 1 . . . 1 3 78 1 . . . 1 3 79 1 . . . 1 3 80 1 . . . 1 3 81 1 . . . 1 3 82 1 . . . 1 3 83 1 . . . 1 3 84 1 . . . 1 3 85 1 . . . 1 3 86 1 . . . 1 3 87 1 . . . 1 3 88 1 . . . 1 3 89 1 . . . 1 3 90 1 . . . 1 3 91 1 . . . 1 3 92 1 . . . 1 3 93 1 . . . 1 3 94 1 . . . 1 3 95 1 . . . 1 3 96 1 . . . 1 3 97 1 . . . 1 3 98 1 . . . 1 3 99 1 . . . 1 3 100 1 . . . 1 3 101 1 . . . 1 3 102 1 . . . 1 3 103 1 . . . 1 3 104 1 . . . 1 3 105 1 . . . 1 3 106 1 . . . 1 3 107 1 . . . 1 3 108 1 . . . 1 3 109 1 . . . 1 3 110 1 . . . 1 3 111 1 . . . 1 3 112 1 . . . 1 3 113 1 . . . 1 3 114 1 . . . 1 3 115 1 . . . 1 3 116 1 . . . 1 3 117 1 . . . 1 3 118 1 . . . 1 3 119 1 . . . 1 3 120 1 . . . 1 3 121 1 . . . 1 3 122 1 . . . 1 3 123 1 . . . 1 3 124 1 . . . 1 3 125 1 . . . 1 3 126 1 . . . 1 3 127 1 . . . 1 3 128 1 . . . 1 3 129 1 . . . 1 3 130 1 . . . 1 3 131 1 . . . 1 3 132 1 . . . 1 3 133 1 . . . 1 3 134 1 . . . 1 3 135 1 . . . 1 3 136 1 . . . 1 3 137 1 . . . 1 3 138 1 . . . 1 3 139 1 . . . 1 3 140 1 . . . 1 3 141 1 . . . 1 3 142 1 . . . 1 3 143 1 . . . 1 3 144 1 . . . 1 3 145 1 . . . 1 3 146 1 . . . 1 3 147 1 . . . 1 3 148 1 . . . 1 3 149 1 . . . 1 3 150 1 . . . 1 3 151 1 . . . 1 3 152 1 . . . 1 3 153 1 . . . 1 3 154 1 . . . 1 3 155 1 . . . 1 3 156 1 . . . 1 3 157 1 . . . 1 3 158 1 . . . 1 3 159 1 . . . 1 3 160 1 . . . 1 3 161 1 . . . 1 3 162 1 . . . 1 3 163 1 . . . 1 3 164 1 . . . 1 3 165 1 . . . 1 3 166 1 . . . 1 3 167 1 . . . 1 3 168 1 . . . 1 3 169 1 . . . 1 3 170 1 . . . 1 3 171 1 . . . 1 3 172 1 . . . 1 3 173 1 . . . 1 3 174 1 . . . 1 3 175 1 . . . 1 3 176 1 . . . 1 3 177 1 . . . 1 3 178 1 . . . 1 3 179 1 . . . 1 3 180 1 . . . 1 3 181 1 . . . 1 3 182 1 . . . 1 3 183 1 . . . 1 3 184 1 . . . 1 3 185 1 . . . 1 3 186 1 . . . 1 3 187 1 . . . 1 3 188 1 . . . 1 3 189 1 . . . 1 3 190 1 . . . 1 3 191 1 . . . 1 3 192 1 . . . 1 3 193 1 . . . 1 3 194 1 . . . 1 3 195 1 . . . 1 3 196 1 . . . 1 3 197 1 . . . 1 3 198 1 . . . 1 3 199 1 . . . 1 3 200 1 . . . 1 3 201 1 . . . 1 3 202 1 . . . 1 3 203 1 . . . 1 3 204 1 . . . 1 3 205 1 . . . 1 3 206 1 . . . 1 3 207 1 . . . 1 3 208 1 . . . 1 3 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 5 THR H . 5 . HN 1 3 1 1 2 1 1 7 TRP H . 7 . HN 1 3 2 1 1 1 1 11 ASN H . 11 . HN 1 3 2 1 2 1 1 13 LYS H . 13 . HN 1 3 3 1 1 1 1 12 LYS H . 12 . HN 1 3 3 1 2 1 1 14 GLU H . 14 . HN 1 3 4 1 1 1 1 13 LYS H . 13 . HN 1 3 4 1 2 1 1 15 CYS H . 15 . HN 1 3 5 1 1 1 1 23 LEU H . 23 . HN 1 3 5 1 2 1 1 25 ILE H . 25 . HN 1 3 6 1 1 1 1 4 LEU H . 4 . HN 1 3 6 1 2 1 1 7 TRP H . 7 . HN 1 3 7 1 1 1 1 22 ALA H . 22 . HN 1 3 7 1 2 1 1 25 ILE H . 25 . HN 1 3 8 1 1 1 1 22 ALA H . 22 . HN 1 3 8 1 2 1 1 26 CYS H . 26 . HN 1 3 9 1 1 1 1 3 LYS HA . 3 . HA 1 3 9 1 2 1 1 5 THR H . 5 . HN 1 3 10 1 1 1 1 7 TRP HA . 7 . HA 1 3 10 1 2 1 1 9 CYS H . 9 . HN 1 3 11 1 1 1 1 12 LYS HA . 12 . HA 1 3 11 1 2 1 1 14 GLU H . 14 . HN 1 3 12 1 1 1 1 16 CYS HA . 16 . HA 1 3 12 1 2 1 1 18 TRP H . 18 . HN 1 3 13 1 1 1 1 22 ALA HA . 22 . HA 1 3 13 1 2 1 1 24 GLY H . 24 . HN 1 3 14 1 1 1 1 23 LEU HA . 23 . HA 1 3 14 1 2 1 1 25 ILE H . 25 . HN 1 3 15 1 1 1 1 11 ASN HA . 11 . HA 1 3 15 1 2 1 1 14 GLU H . 14 . HN 1 3 16 1 1 1 1 12 LYS HA . 12 . HA 1 3 16 1 2 1 1 15 CYS H . 15 . HN 1 3 17 1 1 1 1 22 ALA HA . 22 . HA 1 3 17 1 2 1 1 25 ILE H . 25 . HN 1 3 18 1 1 1 1 3 LYS H . 3 . HN 1 3 18 1 2 1 1 7 TRP QB . 7 . HB* 1 3 19 1 1 1 1 3 LYS HA . 3 . HA 1 3 19 1 2 1 1 7 TRP HB2 . 7 . HB2 1 3 20 1 1 1 1 3 LYS HA . 3 . HA 1 3 20 1 2 1 1 7 TRP HB3 . 7 . HB1 1 3 21 1 1 1 1 3 LYS HA . 3 . HA 1 3 21 1 2 1 1 7 TRP HE3 . 7 . HE3 1 3 22 1 1 1 1 3 LYS HA . 3 . HA 1 3 22 1 2 1 1 7 TRP HH2 . 7 . HH2 1 3 23 1 1 1 1 3 LYS HB2 . 3 . HB2 1 3 23 1 2 1 1 7 TRP H . 7 . HN 1 3 24 1 1 1 1 3 LYS HB3 . 3 . HB1 1 3 24 1 2 1 1 7 TRP H . 7 . HN 1 3 25 1 1 1 1 3 LYS HB2 . 3 . HB2 1 3 25 1 2 1 1 7 TRP HB2 . 7 . HB2 1 3 26 1 1 1 1 3 LYS HB2 . 3 . HB2 1 3 26 1 2 1 1 7 TRP HB3 . 7 . HB1 1 3 27 1 1 1 1 3 LYS HB3 . 3 . HB1 1 3 27 1 2 1 1 7 TRP HB2 . 7 . HB2 1 3 28 1 1 1 1 3 LYS HB3 . 3 . HB1 1 3 28 1 2 1 1 7 TRP HB3 . 7 . HB1 1 3 29 1 1 1 1 3 LYS HB2 . 3 . HB2 1 3 29 1 2 1 1 7 TRP HE3 . 7 . HE3 1 3 30 1 1 1 1 3 LYS HB3 . 3 . HB1 1 3 30 1 2 1 1 7 TRP HE3 . 7 . HE3 1 3 31 1 1 1 1 3 LYS HG2 . 3 . HG2 1 3 31 1 2 1 1 7 TRP HB2 . 7 . HB2 1 3 32 1 1 1 1 3 LYS HG2 . 3 . HG2 1 3 32 1 2 1 1 7 TRP HB3 . 7 . HB1 1 3 33 1 1 1 1 3 LYS HG3 . 3 . HG1 1 3 33 1 2 1 1 7 TRP HB2 . 7 . HB2 1 3 34 1 1 1 1 3 LYS HG3 . 3 . HG1 1 3 34 1 2 1 1 7 TRP HB3 . 7 . HB1 1 3 35 1 1 1 1 3 LYS HG2 . 3 . HG2 1 3 35 1 2 1 1 7 TRP HE3 . 7 . HE3 1 3 36 1 1 1 1 3 LYS HG3 . 3 . HG1 1 3 36 1 2 1 1 7 TRP HE3 . 7 . HE3 1 3 37 1 1 1 1 3 LYS QG . 3 . HG* 1 3 37 1 2 1 1 7 TRP HZ3 . 7 . HZ3 1 3 38 1 1 1 1 4 LEU H . 4 . HN 1 3 38 1 2 1 1 7 TRP HB2 . 7 . HB2 1 3 39 1 1 1 1 4 LEU H . 4 . HN 1 3 39 1 2 1 1 7 TRP HB3 . 7 . HB1 1 3 40 1 1 1 1 4 LEU H . 4 . HN 1 3 40 1 2 1 1 7 TRP HD1 . 7 . HD1 1 3 41 1 1 1 1 4 LEU H . 4 . HN 1 3 41 1 2 1 1 7 TRP HE1 . 7 . HE1 1 3 42 1 1 1 1 4 LEU H . 4 . HN 1 3 42 1 2 1 1 7 TRP HE3 . 7 . HE3 1 3 43 1 1 1 1 4 LEU H . 4 . HN 1 3 43 1 2 1 1 7 TRP HZ2 . 7 . HZ2 1 3 44 1 1 1 1 4 LEU HA . 4 . HA 1 3 44 1 2 1 1 7 TRP HD1 . 7 . HD1 1 3 45 1 1 1 1 4 LEU HA . 4 . HA 1 3 45 1 2 1 1 7 TRP HE1 . 7 . HE1 1 3 46 1 1 1 1 4 LEU QB . 4 . HB* 1 3 46 1 2 1 1 7 TRP H . 7 . HN 1 3 47 1 1 1 1 4 LEU HB2 . 4 . HB2 1 3 47 1 2 1 1 7 TRP HD1 . 7 . HD1 1 3 48 1 1 1 1 4 LEU HB3 . 4 . HB1 1 3 48 1 2 1 1 7 TRP HD1 . 7 . HD1 1 3 49 1 1 1 1 4 LEU HB2 . 4 . HB2 1 3 49 1 2 1 1 7 TRP HE1 . 7 . HE1 1 3 50 1 1 1 1 4 LEU HB3 . 4 . HB1 1 3 50 1 2 1 1 7 TRP HE1 . 7 . HE1 1 3 51 1 1 1 1 4 LEU QB . 4 . HB* 1 3 51 1 2 1 1 7 TRP HE3 . 7 . HE3 1 3 52 1 1 1 1 4 LEU HB2 . 4 . HB2 1 3 52 1 2 1 1 7 TRP HZ2 . 7 . HZ2 1 3 53 1 1 1 1 4 LEU HB3 . 4 . HB1 1 3 53 1 2 1 1 7 TRP HZ2 . 7 . HZ2 1 3 54 1 1 1 1 4 LEU HG . 4 . HG 1 3 54 1 2 1 1 7 TRP HE1 . 7 . HE1 1 3 55 1 1 1 1 4 LEU HG . 4 . HG 1 3 55 1 2 1 1 7 TRP HZ2 . 7 . HZ2 1 3 56 1 1 1 1 4 LEU MD1 . 4 . HD1* 1 3 56 1 2 1 1 7 TRP HD1 . 7 . HD1 1 3 57 1 1 1 1 4 LEU MD2 . 4 . HD2* 1 3 57 1 2 1 1 7 TRP HD1 . 7 . HD1 1 3 58 1 1 1 1 4 LEU MD1 . 4 . HD1* 1 3 58 1 2 1 1 7 TRP HE1 . 7 . HE1 1 3 59 1 1 1 1 4 LEU MD2 . 4 . HD2* 1 3 59 1 2 1 1 7 TRP HE1 . 7 . HE1 1 3 60 1 1 1 1 4 LEU QD . 4 . HD* 1 3 60 1 2 1 1 7 TRP HE3 . 7 . HE3 1 3 61 1 1 1 1 4 LEU MD1 . 4 . HD1* 1 3 61 1 2 1 1 7 TRP HZ2 . 7 . HZ2 1 3 62 1 1 1 1 4 LEU MD2 . 4 . HD2* 1 3 62 1 2 1 1 7 TRP HZ2 . 7 . HZ2 1 3 63 1 1 1 1 4 LEU MD1 . 4 . HD1* 1 3 63 1 2 1 1 7 TRP HZ3 . 7 . HZ3 1 3 64 1 1 1 1 4 LEU MD2 . 4 . HD2* 1 3 64 1 2 1 1 7 TRP HZ3 . 7 . HZ3 1 3 65 1 1 1 1 4 LEU MD2 . 4 . HD2* 1 3 65 1 2 1 1 7 TRP HH2 . 7 . HH2 1 3 66 1 1 1 1 5 THR H . 5 . HN 1 3 66 1 2 1 1 7 TRP HE1 . 7 . HE1 1 3 67 1 1 1 1 5 THR MG . 5 . HG2* 1 3 67 1 2 1 1 7 TRP H . 7 . HN 1 3 68 1 1 1 1 10 LYS H . 10 . HN 1 3 68 1 2 1 1 14 GLU QB . 14 . HB* 1 3 69 1 1 1 1 10 LYS H . 10 . HN 1 3 69 1 2 1 1 14 GLU HG2 . 14 . HG2 1 3 70 1 1 1 1 10 LYS H . 10 . HN 1 3 70 1 2 1 1 14 GLU HG3 . 14 . HG1 1 3 71 1 1 1 1 11 ASN H . 11 . HN 1 3 71 1 2 1 1 14 GLU HA . 14 . HA 1 3 72 1 1 1 1 11 ASN H . 11 . HN 1 3 72 1 2 1 1 14 GLU QB . 14 . HB* 1 3 73 1 1 1 1 11 ASN H . 11 . HN 1 3 73 1 2 1 1 14 GLU HG2 . 14 . HG2 1 3 74 1 1 1 1 11 ASN H . 11 . HN 1 3 74 1 2 1 1 14 GLU HG3 . 14 . HG1 1 3 75 1 1 1 1 11 ASN QB . 11 . HB* 1 3 75 1 2 1 1 13 LYS H . 13 . HN 1 3 76 1 1 1 1 11 ASN QB . 11 . HB* 1 3 76 1 2 1 1 14 GLU H . 14 . HN 1 3 77 1 1 1 1 11 ASN HD21 . 11 . HD21 1 3 77 1 2 1 1 13 LYS H . 13 . HN 1 3 78 1 1 1 1 11 ASN HD22 . 11 . HD22 1 3 78 1 2 1 1 13 LYS H . 13 . HN 1 3 79 1 1 1 1 11 ASN HD21 . 11 . HD21 1 3 79 1 2 1 1 14 GLU QB . 14 . HB* 1 3 80 1 1 1 1 11 ASN HD22 . 11 . HD22 1 3 80 1 2 1 1 14 GLU QB . 14 . HB* 1 3 81 1 1 1 1 11 ASN HD21 . 11 . HD21 1 3 81 1 2 1 1 14 GLU QG . 14 . HG* 1 3 82 1 1 1 1 11 ASN HD22 . 11 . HD22 1 3 82 1 2 1 1 14 GLU QG . 14 . HG* 1 3 83 1 1 1 1 12 LYS QG . 12 . HG* 1 3 83 1 2 1 1 14 GLU H . 14 . HN 1 3 84 1 1 1 1 12 LYS QG . 12 . HG* 1 3 84 1 2 1 1 15 CYS H . 15 . HN 1 3 85 1 1 1 1 13 LYS QB . 13 . HB* 1 3 85 1 2 1 1 15 CYS H . 15 . HN 1 3 86 1 1 1 1 15 CYS H . 15 . HN 1 3 86 1 2 1 1 18 TRP HA . 18 . HA 1 3 87 1 1 1 1 15 CYS H . 15 . HN 1 3 87 1 2 1 1 18 TRP HD1 . 18 . HD1 1 3 88 1 1 1 1 20 ALA MB . 20 . HB* 1 3 88 1 2 1 1 22 ALA H . 22 . HN 1 3 89 1 1 1 1 22 ALA H . 22 . HN 1 3 89 1 2 1 1 25 ILE HB . 25 . HB 1 3 90 1 1 1 1 22 ALA H . 22 . HN 1 3 90 1 2 1 1 25 ILE QG . 25 . HG* 1 3 90 1 2 1 1 25 ILE MG . 25 . HG* 1 3 91 1 1 1 1 22 ALA H . 22 . HN 1 3 91 1 2 1 1 26 CYS HA . 26 . HA 1 3 92 1 1 1 1 22 ALA MB . 22 . HB* 1 3 92 1 2 1 1 25 ILE H . 25 . HN 1 3 93 1 1 1 1 22 ALA MB . 22 . HB* 1 3 93 1 2 1 1 26 CYS HA . 26 . HA 1 3 94 1 1 1 1 23 LEU QB . 23 . HB* 1 3 94 1 2 1 1 25 ILE H . 25 . HN 1 3 95 1 1 1 1 23 LEU MD1 . 23 . HD1* 1 3 95 1 2 1 1 27 MET H . 27 . HN 1 3 96 1 1 1 1 25 ILE H . 25 . HN 1 3 96 1 2 1 1 27 MET QG . 27 . HG* 1 3 97 1 1 1 1 25 ILE HB . 25 . HB 1 3 97 1 2 1 1 27 MET QG . 27 . HG* 1 3 98 1 1 1 1 25 ILE QG . 25 . HG* 1 3 98 1 1 1 1 25 ILE MG . 25 . HG* 1 3 98 1 2 1 1 27 MET HG2 . 27 . HG2 1 3 99 1 1 1 1 25 ILE QG . 25 . HG* 1 3 99 1 1 1 1 25 ILE MG . 25 . HG* 1 3 99 1 2 1 1 27 MET HG3 . 27 . HG1 1 3 100 1 1 1 1 25 ILE MG . 25 . HG2* 1 3 100 1 2 1 1 27 MET HG2 . 27 . HG2 1 3 101 1 1 1 1 25 ILE MG . 25 . HG2* 1 3 101 1 2 1 1 27 MET HG3 . 27 . HG1 1 3 102 1 1 1 1 25 ILE MD . 25 . HD1* 1 3 102 1 2 1 1 27 MET HG2 . 27 . HG2 1 3 103 1 1 1 1 25 ILE MD . 25 . HD1* 1 3 103 1 2 1 1 27 MET HG3 . 27 . HG1 1 3 104 1 1 1 1 2 CYS H . 2 . HN 1 3 104 1 2 1 1 3 LYS H . 3 . HN 1 3 105 1 1 1 1 3 LYS H . 3 . HN 1 3 105 1 2 1 1 4 LEU H . 4 . HN 1 3 106 1 1 1 1 4 LEU H . 4 . HN 1 3 106 1 2 1 1 5 THR H . 5 . HN 1 3 107 1 1 1 1 5 THR H . 5 . HN 1 3 107 1 2 1 1 6 PHE H . 6 . HN 1 3 108 1 1 1 1 6 PHE H . 6 . HN 1 3 108 1 2 1 1 7 TRP H . 7 . HN 1 3 109 1 1 1 1 8 LYS H . 8 . HN 1 3 109 1 2 1 1 9 CYS H . 9 . HN 1 3 110 1 1 1 1 9 CYS H . 9 . HN 1 3 110 1 2 1 1 10 LYS H . 10 . HN 1 3 111 1 1 1 1 10 LYS H . 10 . HN 1 3 111 1 2 1 1 11 ASN H . 11 . HN 1 3 112 1 1 1 1 11 ASN H . 11 . HN 1 3 112 1 2 1 1 12 LYS H . 12 . HN 1 3 113 1 1 1 1 12 LYS H . 12 . HN 1 3 113 1 2 1 1 13 LYS H . 13 . HN 1 3 114 1 1 1 1 13 LYS H . 13 . HN 1 3 114 1 2 1 1 14 GLU H . 14 . HN 1 3 115 1 1 1 1 14 GLU H . 14 . HN 1 3 115 1 2 1 1 15 CYS H . 15 . HN 1 3 116 1 1 1 1 15 CYS H . 15 . HN 1 3 116 1 2 1 1 16 CYS H . 16 . HN 1 3 117 1 1 1 1 16 CYS H . 16 . HN 1 3 117 1 2 1 1 17 GLY H . 17 . HN 1 3 118 1 1 1 1 17 GLY H . 17 . HN 1 3 118 1 2 1 1 18 TRP H . 18 . HN 1 3 119 1 1 1 1 18 TRP H . 18 . HN 1 3 119 1 2 1 1 19 ASN H . 19 . HN 1 3 120 1 1 1 1 21 CYS H . 21 . HN 1 3 120 1 2 1 1 22 ALA H . 22 . HN 1 3 121 1 1 1 1 22 ALA H . 22 . HN 1 3 121 1 2 1 1 23 LEU H . 23 . HN 1 3 122 1 1 1 1 23 LEU H . 23 . HN 1 3 122 1 2 1 1 24 GLY H . 24 . HN 1 3 123 1 1 1 1 24 GLY H . 24 . HN 1 3 123 1 2 1 1 25 ILE H . 25 . HN 1 3 124 1 1 1 1 25 ILE H . 25 . HN 1 3 124 1 2 1 1 26 CYS H . 26 . HN 1 3 125 1 1 1 1 26 CYS H . 26 . HN 1 3 125 1 2 1 1 27 MET H . 27 . HN 1 3 126 1 1 1 1 2 CYS HA . 2 . HA 1 3 126 1 2 1 1 3 LYS H . 3 . HN 1 3 127 1 1 1 1 3 LYS HA . 3 . HA 1 3 127 1 2 1 1 4 LEU H . 4 . HN 1 3 128 1 1 1 1 4 LEU HA . 4 . HA 1 3 128 1 2 1 1 5 THR H . 5 . HN 1 3 129 1 1 1 1 5 THR HA . 5 . HA 1 3 129 1 2 1 1 6 PHE H . 6 . HN 1 3 130 1 1 1 1 7 TRP HA . 7 . HA 1 3 130 1 2 1 1 8 LYS H . 8 . HN 1 3 131 1 1 1 1 8 LYS HA . 8 . HA 1 3 131 1 2 1 1 9 CYS H . 9 . HN 1 3 132 1 1 1 1 9 CYS HA . 9 . HA 1 3 132 1 2 1 1 10 LYS H . 10 . HN 1 3 133 1 1 1 1 10 LYS HA . 10 . HA 1 3 133 1 2 1 1 11 ASN H . 11 . HN 1 3 134 1 1 1 1 11 ASN HA . 11 . HA 1 3 134 1 2 1 1 12 LYS H . 12 . HN 1 3 135 1 1 1 1 13 LYS HA . 13 . HA 1 3 135 1 2 1 1 14 GLU H . 14 . HN 1 3 136 1 1 1 1 14 GLU HA . 14 . HA 1 3 136 1 2 1 1 15 CYS H . 15 . HN 1 3 137 1 1 1 1 15 CYS HA . 15 . HA 1 3 137 1 2 1 1 16 CYS H . 16 . HN 1 3 138 1 1 1 1 16 CYS HA . 16 . HA 1 3 138 1 2 1 1 17 GLY H . 17 . HN 1 3 139 1 1 1 1 18 TRP HA . 18 . HA 1 3 139 1 2 1 1 19 ASN H . 19 . HN 1 3 140 1 1 1 1 19 ASN HA . 19 . HA 1 3 140 1 2 1 1 20 ALA H . 20 . HN 1 3 141 1 1 1 1 20 ALA HA . 20 . HA 1 3 141 1 2 1 1 21 CYS H . 21 . HN 1 3 142 1 1 1 1 21 CYS HA . 21 . HA 1 3 142 1 2 1 1 22 ALA H . 22 . HN 1 3 143 1 1 1 1 22 ALA HA . 22 . HA 1 3 143 1 2 1 1 23 LEU H . 23 . HN 1 3 144 1 1 1 1 23 LEU HA . 23 . HA 1 3 144 1 2 1 1 24 GLY H . 24 . HN 1 3 145 1 1 1 1 25 ILE HA . 25 . HA 1 3 145 1 2 1 1 26 CYS H . 26 . HN 1 3 146 1 1 1 1 26 CYS HA . 26 . HA 1 3 146 1 2 1 1 27 MET H . 27 . HN 1 3 147 1 1 1 1 28 PRO HA . 28 . HA 1 3 147 1 2 1 1 29 ARG H . 29 . HN 1 3 148 1 1 1 1 2 CYS QB . 2 . HB* 1 3 148 1 2 1 1 3 LYS H . 3 . HN 1 3 149 1 1 1 1 3 LYS QB . 3 . HB* 1 3 149 1 2 1 1 4 LEU H . 4 . HN 1 3 150 1 1 1 1 4 LEU HB2 . 4 . HB2 1 3 150 1 2 1 1 5 THR H . 5 . HN 1 3 151 1 1 1 1 4 LEU HB3 . 4 . HB1 1 3 151 1 2 1 1 5 THR H . 5 . HN 1 3 152 1 1 1 1 5 THR HB . 5 . HB 1 3 152 1 2 1 1 6 PHE H . 6 . HN 1 3 153 1 1 1 1 6 PHE HB2 . 6 . HB2 1 3 153 1 2 1 1 7 TRP H . 7 . HN 1 3 154 1 1 1 1 6 PHE HB3 . 6 . HB1 1 3 154 1 2 1 1 7 TRP H . 7 . HN 1 3 155 1 1 1 1 7 TRP HB2 . 7 . HB2 1 3 155 1 2 1 1 8 LYS H . 8 . HN 1 3 156 1 1 1 1 7 TRP HB3 . 7 . HB1 1 3 156 1 2 1 1 8 LYS H . 8 . HN 1 3 157 1 1 1 1 8 LYS HB2 . 8 . HB2 1 3 157 1 2 1 1 9 CYS H . 9 . HN 1 3 158 1 1 1 1 8 LYS HB3 . 8 . HB1 1 3 158 1 2 1 1 9 CYS H . 9 . HN 1 3 159 1 1 1 1 10 LYS HB2 . 10 . HB2 1 3 159 1 2 1 1 11 ASN H . 11 . HN 1 3 160 1 1 1 1 10 LYS HB3 . 10 . HB1 1 3 160 1 2 1 1 11 ASN H . 11 . HN 1 3 161 1 1 1 1 11 ASN QB . 11 . HB* 1 3 161 1 2 1 1 12 LYS H . 12 . HN 1 3 162 1 1 1 1 12 LYS QB . 12 . HB* 1 3 162 1 2 1 1 13 LYS H . 13 . HN 1 3 163 1 1 1 1 13 LYS QB . 13 . HB* 1 3 163 1 2 1 1 14 GLU H . 14 . HN 1 3 164 1 1 1 1 14 GLU QB . 14 . HB* 1 3 164 1 2 1 1 15 CYS H . 15 . HN 1 3 165 1 1 1 1 16 CYS HB2 . 16 . HB2 1 3 165 1 2 1 1 17 GLY H . 17 . HN 1 3 166 1 1 1 1 16 CYS HB3 . 16 . HB1 1 3 166 1 2 1 1 17 GLY H . 17 . HN 1 3 167 1 1 1 1 19 ASN HB2 . 19 . HB2 1 3 167 1 2 1 1 20 ALA H . 20 . HN 1 3 168 1 1 1 1 19 ASN HB3 . 19 . HB1 1 3 168 1 2 1 1 20 ALA H . 20 . HN 1 3 169 1 1 1 1 20 ALA MB . 20 . HB* 1 3 169 1 2 1 1 21 CYS H . 21 . HN 1 3 170 1 1 1 1 21 CYS HB2 . 21 . HB2 1 3 170 1 2 1 1 22 ALA H . 22 . HN 1 3 171 1 1 1 1 21 CYS HB3 . 21 . HB1 1 3 171 1 2 1 1 22 ALA H . 22 . HN 1 3 172 1 1 1 1 22 ALA MB . 22 . HB* 1 3 172 1 2 1 1 23 LEU H . 23 . HN 1 3 173 1 1 1 1 23 LEU QB . 23 . HB* 1 3 173 1 2 1 1 24 GLY H . 24 . HN 1 3 174 1 1 1 1 25 ILE HB . 25 . HB 1 3 174 1 2 1 1 26 CYS H . 26 . HN 1 3 175 1 1 1 1 26 CYS HB2 . 26 . HB2 1 3 175 1 2 1 1 27 MET H . 27 . HN 1 3 176 1 1 1 1 26 CYS HB3 . 26 . HB1 1 3 176 1 2 1 1 27 MET H . 27 . HN 1 3 177 1 1 1 1 28 PRO QB . 28 . HB* 1 3 177 1 2 1 1 29 ARG H . 29 . HN 1 3 178 1 1 1 1 3 LYS HG2 . 3 . HG2 1 3 178 1 2 1 1 4 LEU H . 4 . HN 1 3 179 1 1 1 1 3 LYS HG3 . 3 . HG1 1 3 179 1 2 1 1 4 LEU H . 4 . HN 1 3 180 1 1 1 1 4 LEU HG . 4 . HG 1 3 180 1 2 1 1 5 THR H . 5 . HN 1 3 181 1 1 1 1 5 THR MG . 5 . HG2* 1 3 181 1 2 1 1 6 PHE H . 6 . HN 1 3 182 1 1 1 1 8 LYS QG . 8 . HG* 1 3 182 1 2 1 1 9 CYS H . 9 . HN 1 3 183 1 1 1 1 10 LYS HG2 . 10 . HG2 1 3 183 1 2 1 1 11 ASN H . 11 . HN 1 3 184 1 1 1 1 10 LYS HG3 . 10 . HG1 1 3 184 1 2 1 1 11 ASN H . 11 . HN 1 3 185 1 1 1 1 12 LYS QG . 12 . HG* 1 3 185 1 2 1 1 13 LYS H . 13 . HN 1 3 186 1 1 1 1 13 LYS QG . 13 . HG* 1 3 186 1 2 1 1 14 GLU H . 14 . HN 1 3 187 1 1 1 1 14 GLU HG2 . 14 . HG2 1 3 187 1 2 1 1 15 CYS H . 15 . HN 1 3 188 1 1 1 1 14 GLU HG3 . 14 . HG1 1 3 188 1 2 1 1 15 CYS H . 15 . HN 1 3 189 1 1 1 1 25 ILE HG12 . 25 . HG12 1 3 189 1 2 1 1 26 CYS H . 26 . HN 1 3 190 1 1 1 1 25 ILE HG13 . 25 . HG11 1 3 190 1 2 1 1 26 CYS H . 26 . HN 1 3 191 1 1 1 1 28 PRO HG2 . 28 . HG2 1 3 191 1 2 1 1 29 ARG H . 29 . HN 1 3 192 1 1 1 1 28 PRO HG3 . 28 . HG1 1 3 192 1 2 1 1 29 ARG H . 29 . HN 1 3 193 1 1 1 1 4 LEU MD1 . 4 . HD1* 1 3 193 1 2 1 1 5 THR H . 5 . HN 1 3 194 1 1 1 1 4 LEU MD2 . 4 . HD2* 1 3 194 1 2 1 1 5 THR H . 5 . HN 1 3 195 1 1 1 1 7 TRP HD1 . 7 . HD1 1 3 195 1 2 1 1 8 LYS H . 8 . HN 1 3 196 1 1 1 1 8 LYS QD . 8 . HD* 1 3 196 1 2 1 1 9 CYS H . 9 . HN 1 3 197 1 1 1 1 11 ASN HD22 . 11 . HD22 1 3 197 1 2 1 1 12 LYS H . 12 . HN 1 3 198 1 1 1 1 11 ASN HD21 . 11 . HD21 1 3 198 1 2 1 1 12 LYS H . 12 . HN 1 3 199 1 1 1 1 25 ILE MD . 25 . HD1* 1 3 199 1 2 1 1 26 CYS H . 26 . HN 1 3 200 1 1 1 1 28 PRO HD2 . 28 . HD2 1 3 200 1 2 1 1 29 ARG H . 29 . HN 1 3 201 1 1 1 1 28 PRO HD3 . 28 . HD1 1 3 201 1 2 1 1 29 ARG H . 29 . HN 1 3 202 1 1 1 1 1 GLY QA . 1 . HA* 1 3 202 1 2 1 1 2 CYS HA . 2 . HA 1 3 203 1 1 1 1 4 LEU HA . 4 . HA 1 3 203 1 2 1 1 5 THR HA . 5 . HA 1 3 204 1 1 1 1 5 THR HA . 5 . HA 1 3 204 1 2 1 1 6 PHE HA . 6 . HA 1 3 205 1 1 1 1 11 ASN HA . 11 . HA 1 3 205 1 2 1 1 12 LYS HA . 12 . HA 1 3 206 1 1 1 1 16 CYS HA . 16 . HA 1 3 206 1 2 1 1 17 GLY HA3 . 17 . HA1 1 3 207 1 1 1 1 16 CYS HA . 16 . HA 1 3 207 1 2 1 1 17 GLY HA2 . 17 . HA2 1 3 208 1 1 1 1 22 ALA HA . 22 . HA 1 3 208 1 2 1 1 23 LEU HA . 23 . HA 1 3 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 . . . . . 5.28 1.8 5.28 1 3 2 1 . . . . . 5.52 1.8 5.52 1 3 3 1 . . . . . 4.79 1.8 4.79 1 3 4 1 . . . . . 4.81 1.8 4.81 1 3 5 1 . . . . . 4.63 1.8 4.63 1 3 6 1 . . . . . 5.45 1.8 5.45 1 3 7 1 . . . . . 3.67 1.8 3.67 1 3 8 1 . . . . . 5.25 1.8 5.25 1 3 9 1 . . . . . 6.44 1.8 6.44 1 3 10 1 . . . . . 5.91 1.8 5.91 1 3 11 1 . . . . . 4.4 1.8 4.4 1 3 12 1 . . . . . 4.99 1.8 4.99 1 3 13 1 . . . . . 4.11 1.8 4.11 1 3 14 1 . . . . . 4.65 1.8 4.65 1 3 15 1 . . . . . 5.25 1.8 5.25 1 3 16 1 . . . . . 4.22 1.8 4.22 1 3 17 1 . . . . . 4.88 1.8 4.88 1 3 18 1 . . . . . 5.76 1.8 5.76 1 3 19 1 . . . . . 4.95 1.8 4.95 1 3 20 1 . . . . . 4.95 1.8 4.95 1 3 21 1 . . . . . 3.7 1.8 3.7 1 3 22 1 . . . . . 5.52 1.8 5.52 1 3 23 1 . . . . . 4.51 1.8 4.51 1 3 24 1 . . . . . 5.03 1.8 5.03 1 3 25 1 . . . . . 3.88 1.8 3.88 1 3 26 1 . . . . . 3.88 1.8 3.88 1 3 27 1 . . . . . 4.24 1.8 4.24 1 3 28 1 . . . . . 4.24 1.8 4.24 1 3 29 1 . . . . . 3.96 1.8 3.96 1 3 30 1 . . . . . 4.07 1.8 4.07 1 3 31 1 . . . . . 5.72 1.8 5.72 1 3 32 1 . . . . . 5.72 1.8 5.72 1 3 33 1 . . . . . 4.74 1.8 4.74 1 3 34 1 . . . . . 4.74 1.8 4.74 1 3 35 1 . . . . . 3.94 1.8 3.94 1 3 36 1 . . . . . 3.94 1.8 3.94 1 3 37 1 . . . . . 4.98 1.8 4.98 1 3 38 1 . . . . . 4.95 1.8 4.95 1 3 39 1 . . . . . 4.95 1.8 4.95 1 3 40 1 . . . . . 4.35 1.8 4.35 1 3 41 1 . . . . . 4.95 1.8 4.95 1 3 42 1 . . . . . 4.22 1.8 4.22 1 3 43 1 . . . . . 5.23 1.8 5.23 1 3 44 1 . . . . . 5.11 1.8 5.11 1 3 45 1 . . . . . 5.51 1.8 5.51 1 3 46 1 . . . . . 5.56 1.8 5.56 1 3 47 1 . . . . . 3.76 1.8 3.76 1 3 48 1 . . . . . 3.76 1.8 3.76 1 3 49 1 . . . . . 5.04 1.8 5.04 1 3 50 1 . . . . . 5.04 1.8 5.04 1 3 51 1 . . . . . 5.62 1.8 5.62 1 3 52 1 . . . . . 5.53 1.8 5.53 1 3 53 1 . . . . . 5.53 1.8 5.53 1 3 54 1 . . . . . 4.8 1.8 4.8 1 3 55 1 . . . . . 5.41 1.8 5.41 1 3 56 1 . . . . . 5.29 1.8 5.29 1 3 57 1 . . . . . 5.09 1.8 5.09 1 3 58 1 . . . . . 4.86 1.8 4.86 1 3 59 1 . . . . . 6.0 1.8 6.0 1 3 60 1 . . . . . 4.86 1.8 4.86 1 3 61 1 . . . . . 4.94 1.8 4.94 1 3 62 1 . . . . . 4.94 1.8 4.94 1 3 63 1 . . . . . 6.19 1.8 6.19 1 3 64 1 . . . . . 5.69 1.8 5.69 1 3 65 1 . . . . . 4.51 1.8 4.51 1 3 66 1 . . . . . 5.34 1.8 5.34 1 3 67 1 . . . . . 4.91 1.8 4.91 1 3 68 1 . . . . . 4.68 1.8 4.68 1 3 69 1 . . . . . 4.83 1.8 4.83 1 3 70 1 . . . . . 4.83 1.8 4.83 1 3 71 1 . . . . . 5.79 1.8 5.79 1 3 72 1 . . . . . 4.1 1.8 4.1 1 3 73 1 . . . . . 4.59 1.8 4.59 1 3 74 1 . . . . . 4.59 1.8 4.59 1 3 75 1 . . . . . 4.41 1.8 4.41 1 3 76 1 . . . . . 4.55 1.8 4.55 1 3 77 1 . . . . . 5.78 1.8 5.78 1 3 78 1 . . . . . 5.56 1.8 5.56 1 3 79 1 . . . . . 5.67 1.8 5.67 1 3 80 1 . . . . . 5.42 1.8 5.42 1 3 81 1 . . . . . 5.36 1.8 5.36 1 3 82 1 . . . . . 5.25 1.8 5.25 1 3 83 1 . . . . . 5.14 1.8 5.14 1 3 84 1 . . . . . 5.53 1.8 5.53 1 3 85 1 . . . . . 4.99 1.8 4.99 1 3 86 1 . . . . . 5.81 1.8 5.81 1 3 87 1 . . . . . 5.58 1.8 5.58 1 3 88 1 . . . . . 4.48 1.8 4.48 1 3 89 1 . . . . . 5.25 1.8 5.25 1 3 90 1 . . . . . 5.28 1.8 5.28 1 3 91 1 . . . . . 4.28 1.8 4.28 1 3 92 1 . . . . . 4.57 1.8 4.57 1 3 93 1 . . . . . 5.47 1.8 5.47 1 3 94 1 . . . . . 4.91 1.8 4.91 1 3 95 1 . . . . . 5.9 1.8 5.9 1 3 96 1 . . . . . 5.56 1.8 5.56 1 3 97 1 . . . . . 4.93 1.8 4.93 1 3 98 1 . . . . . 4.93 1.8 4.93 1 3 99 1 . . . . . 6.27 1.8 6.27 1 3 100 1 . . . . . 4.77 1.8 4.77 1 3 101 1 . . . . . 4.77 1.8 4.77 1 3 102 1 . . . . . 4.92 1.8 4.92 1 3 103 1 . . . . . 4.92 1.8 4.92 1 3 104 1 . . . . . 5.62 1.8 5.62 1 3 105 1 . . . . . 5.21 1.8 5.21 1 3 106 1 . . . . . 4.33 1.8 4.33 1 3 107 1 . . . . . 4.09 1.8 4.09 1 3 108 1 . . . . . 3.7 1.8 3.7 1 3 109 1 . . . . . 4.27 1.8 4.27 1 3 110 1 . . . . . 4.69 1.8 4.69 1 3 111 1 . . . . . 2.95 1.8 2.95 1 3 112 1 . . . . . 4.48 1.8 4.48 1 3 113 1 . . . . . 3.84 1.8 3.84 1 3 114 1 . . . . . 4.43 1.8 4.43 1 3 115 1 . . . . . 3.22 1.8 3.22 1 3 116 1 . . . . . 5.45 1.8 5.45 1 3 117 1 . . . . . 5.47 1.8 5.47 1 3 118 1 . . . . . 4.42 1.8 4.42 1 3 119 1 . . . . . 4.13 1.8 4.13 1 3 120 1 . . . . . 4.28 1.8 4.28 1 3 121 1 . . . . . 4.54 1.8 4.54 1 3 122 1 . . . . . 3.61 1.8 3.61 1 3 123 1 . . . . . 3.61 1.8 3.61 1 3 124 1 . . . . . 4.57 1.8 4.57 1 3 125 1 . . . . . 4.58 1.8 4.58 1 3 126 1 . . . . . 3.63 1.8 3.63 1 3 127 1 . . . . . 3.07 1.8 3.07 1 3 128 1 . . . . . 3.4 1.8 3.4 1 3 129 1 . . . . . 3.62 1.8 3.62 1 3 130 1 . . . . . 3.15 1.8 3.15 1 3 131 1 . . . . . 3.31 1.8 3.31 1 3 132 1 . . . . . 4.05 1.8 4.05 1 3 133 1 . . . . . 3.82 1.8 3.82 1 3 134 1 . . . . . 2.92 1.8 2.92 1 3 135 1 . . . . . 4.42 1.8 4.42 1 3 136 1 . . . . . 4.02 1.8 4.02 1 3 137 1 . . . . . 3.88 1.8 3.88 1 3 138 1 . . . . . 3.58 1.8 3.58 1 3 139 1 . . . . . 4.81 1.8 4.81 1 3 140 1 . . . . . 3.59 1.8 3.59 1 3 141 1 . . . . . 3.45 1.8 3.45 1 3 142 1 . . . . . 3.03 1.8 3.03 1 3 143 1 . . . . . 3.58 1.8 3.58 1 3 144 1 . . . . . 3.65 1.8 3.65 1 3 145 1 . . . . . 2.98 1.8 2.98 1 3 146 1 . . . . . 2.98 1.8 2.98 1 3 147 1 . . . . . 3.49 1.8 3.49 1 3 148 1 . . . . . 3.91 1.8 3.91 1 3 149 1 . . . . . 4.86 1.8 4.86 1 3 150 1 . . . . . 3.52 1.8 3.52 1 3 151 1 . . . . . 3.52 1.8 3.52 1 3 152 1 . . . . . 4.09 1.8 4.09 1 3 153 1 . . . . . 4.8 1.8 4.8 1 3 154 1 . . . . . 4.8 1.8 4.8 1 3 155 1 . . . . . 4.52 1.8 4.52 1 3 156 1 . . . . . 4.52 1.8 4.52 1 3 157 1 . . . . . 4.73 1.8 4.73 1 3 158 1 . . . . . 4.73 1.8 4.73 1 3 159 1 . . . . . 4.06 1.8 4.06 1 3 160 1 . . . . . 4.06 1.8 4.06 1 3 161 1 . . . . . 3.52 1.8 3.52 1 3 162 1 . . . . . 4.96 1.8 4.96 1 3 163 1 . . . . . 3.84 1.8 3.84 1 3 164 1 . . . . . 4.26 1.8 4.26 1 3 165 1 . . . . . 4.47 1.8 4.47 1 3 166 1 . . . . . 4.47 1.8 4.47 1 3 167 1 . . . . . 4.71 1.8 4.71 1 3 168 1 . . . . . 4.71 1.8 4.71 1 3 169 1 . . . . . 3.66 1.8 3.66 1 3 170 1 . . . . . 4.75 1.8 4.75 1 3 171 1 . . . . . 4.75 1.8 4.75 1 3 172 1 . . . . . 3.65 1.8 3.65 1 3 173 1 . . . . . 5.18 1.8 5.18 1 3 174 1 . . . . . 3.58 1.8 3.58 1 3 175 1 . . . . . 4.73 1.8 4.73 1 3 176 1 . . . . . 4.73 1.8 4.73 1 3 177 1 . . . . . 4.1 1.8 4.1 1 3 178 1 . . . . . 5.47 1.8 5.47 1 3 179 1 . . . . . 5.47 1.8 5.47 1 3 180 1 . . . . . 4.17 1.8 4.17 1 3 181 1 . . . . . 3.65 1.8 3.65 1 3 182 1 . . . . . 4.88 1.8 4.88 1 3 183 1 . . . . . 4.94 1.8 4.94 1 3 184 1 . . . . . 4.94 1.8 4.94 1 3 185 1 . . . . . 4.44 1.8 4.44 1 3 186 1 . . . . . 5.34 1.8 5.34 1 3 187 1 . . . . . 4.57 1.8 4.57 1 3 188 1 . . . . . 4.57 1.8 4.57 1 3 189 1 . . . . . 4.87 1.8 4.87 1 3 190 1 . . . . . 4.87 1.8 4.87 1 3 191 1 . . . . . 5.67 1.8 5.67 1 3 192 1 . . . . . 5.67 1.8 5.67 1 3 193 1 . . . . . 4.17 1.8 4.17 1 3 194 1 . . . . . 4.17 1.8 4.17 1 3 195 1 . . . . . 5.27 1.8 5.27 1 3 196 1 . . . . . 4.8 1.8 4.8 1 3 197 1 . . . . . 5.41 1.8 5.41 1 3 198 1 . . . . . 4.82 1.8 4.82 1 3 199 1 . . . . . 4.36 1.8 4.36 1 3 200 1 . . . . . 5.38 1.8 5.38 1 3 201 1 . . . . . 5.38 1.8 5.38 1 3 202 1 . . . . . 6.05 1.8 6.05 1 3 203 1 . . . . . 5.9 1.8 5.9 1 3 204 1 . . . . . 4.91 1.8 4.91 1 3 205 1 . . . . . 5.96 1.8 5.96 1 3 206 1 . . . . . 5.68 1.8 5.68 1 3 207 1 . . . . . 5.96 1.8 5.96 1 3 208 1 . . . . . 5.32 1.8 5.32 1 3 stop_ save_ save_CNS/XPLOR_distance_constraints_9_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 4 _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 4 2 1 . . . 1 4 3 1 . . . 1 4 4 1 . . . 1 4 5 1 . . . 1 4 6 1 . . . 1 4 7 1 . . . 1 4 8 1 . . . 1 4 9 1 . . . 1 4 10 1 . . . 1 4 11 1 . . . 1 4 12 1 . . . 1 4 13 1 . . . 1 4 14 1 . . . 1 4 15 1 . . . 1 4 16 1 . . . 1 4 17 1 . . . 1 4 18 1 . . . 1 4 19 1 . . . 1 4 20 1 . . . 1 4 21 1 . . . 1 4 22 1 . . . 1 4 23 1 . . . 1 4 24 1 . . . 1 4 25 1 . . . 1 4 26 1 . . . 1 4 27 1 . . . 1 4 28 1 . . . 1 4 29 1 . . . 1 4 30 1 . . . 1 4 31 1 . . . 1 4 32 1 . . . 1 4 33 1 . . . 1 4 34 1 . . . 1 4 35 1 . . . 1 4 36 1 . . . 1 4 37 1 . . . 1 4 38 1 . . . 1 4 39 1 . . . 1 4 40 1 . . . 1 4 41 1 . . . 1 4 42 1 . . . 1 4 43 1 . . . 1 4 44 1 . . . 1 4 45 1 . . . 1 4 46 1 . . . 1 4 47 1 . . . 1 4 48 1 . . . 1 4 49 1 . . . 1 4 50 1 . . . 1 4 51 1 . . . 1 4 52 1 . . . 1 4 53 1 . . . 1 4 54 1 . . . 1 4 55 1 . . . 1 4 56 1 . . . 1 4 57 1 . . . 1 4 58 1 . . . 1 4 59 1 . . . 1 4 60 1 . . . 1 4 61 1 . . . 1 4 62 1 . . . 1 4 63 1 . . . 1 4 64 1 . . . 1 4 65 1 . . . 1 4 66 1 . . . 1 4 67 1 . . . 1 4 68 1 . . . 1 4 69 1 . . . 1 4 70 1 . . . 1 4 71 1 . . . 1 4 72 1 . . . 1 4 73 1 . . . 1 4 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 5 THR H . 5 . HN 1 4 1 1 2 1 1 5 THR HB . 5 . HB 1 4 2 1 1 1 1 7 TRP H . 7 . HN 1 4 2 1 2 1 1 7 TRP HB2 . 7 . HB2 1 4 3 1 1 1 1 7 TRP H . 7 . HN 1 4 3 1 2 1 1 7 TRP HB3 . 7 . HB1 1 4 4 1 1 1 1 8 LYS H . 8 . HN 1 4 4 1 2 1 1 8 LYS HB2 . 8 . HB2 1 4 5 1 1 1 1 8 LYS H . 8 . HN 1 4 5 1 2 1 1 8 LYS HB3 . 8 . HB1 1 4 6 1 1 1 1 10 LYS H . 10 . HN 1 4 6 1 2 1 1 10 LYS HB2 . 10 . HB2 1 4 7 1 1 1 1 10 LYS H . 10 . HN 1 4 7 1 2 1 1 10 LYS HB3 . 10 . HB1 1 4 8 1 1 1 1 11 ASN H . 11 . HN 1 4 8 1 2 1 1 11 ASN QB . 11 . HB* 1 4 9 1 1 1 1 12 LYS H . 12 . HN 1 4 9 1 2 1 1 12 LYS HB2 . 12 . HB2 1 4 10 1 1 1 1 12 LYS H . 12 . HN 1 4 10 1 2 1 1 12 LYS HB3 . 12 . HB1 1 4 11 1 1 1 1 13 LYS H . 13 . HN 1 4 11 1 2 1 1 13 LYS QB . 13 . HB* 1 4 12 1 1 1 1 14 GLU H . 14 . HN 1 4 12 1 2 1 1 14 GLU QB . 14 . HB* 1 4 13 1 1 1 1 15 CYS H . 15 . HN 1 4 13 1 2 1 1 15 CYS HB2 . 15 . HB2 1 4 14 1 1 1 1 15 CYS H . 15 . HN 1 4 14 1 2 1 1 15 CYS HB3 . 15 . HB1 1 4 15 1 1 1 1 18 TRP H . 18 . HN 1 4 15 1 2 1 1 18 TRP HB3 . 18 . HB1 1 4 16 1 1 1 1 21 CYS H . 21 . HN 1 4 16 1 2 1 1 21 CYS QB . 21 . HB* 1 4 17 1 1 1 1 22 ALA H . 22 . HN 1 4 17 1 2 1 1 22 ALA MB . 22 . HB* 1 4 18 1 1 1 1 25 ILE H . 25 . HN 1 4 18 1 2 1 1 25 ILE HB . 25 . HB 1 4 19 1 1 1 1 26 CYS H . 26 . HN 1 4 19 1 2 1 1 26 CYS HB2 . 26 . HB2 1 4 20 1 1 1 1 26 CYS H . 26 . HN 1 4 20 1 2 1 1 26 CYS HB3 . 26 . HB1 1 4 21 1 1 1 1 27 MET H . 27 . HN 1 4 21 1 2 1 1 27 MET QB . 27 . HB* 1 4 22 1 1 1 1 3 LYS H . 3 . HN 1 4 22 1 2 1 1 3 LYS HG2 . 3 . HG2 1 4 23 1 1 1 1 3 LYS H . 3 . HN 1 4 23 1 2 1 1 3 LYS HG3 . 3 . HG1 1 4 24 1 1 1 1 4 LEU H . 4 . HN 1 4 24 1 2 1 1 4 LEU HG . 4 . HG 1 4 25 1 1 1 1 5 THR H . 5 . HN 1 4 25 1 2 1 1 5 THR MG . 5 . HG2* 1 4 26 1 1 1 1 8 LYS H . 8 . HN 1 4 26 1 2 1 1 8 LYS QG . 8 . HG* 1 4 27 1 1 1 1 10 LYS H . 10 . HN 1 4 27 1 2 1 1 10 LYS HG2 . 10 . HG2 1 4 28 1 1 1 1 10 LYS H . 10 . HN 1 4 28 1 2 1 1 10 LYS HG3 . 10 . HG1 1 4 29 1 1 1 1 12 LYS H . 12 . HN 1 4 29 1 2 1 1 12 LYS QG . 12 . HG* 1 4 30 1 1 1 1 14 GLU H . 14 . HN 1 4 30 1 2 1 1 14 GLU HG2 . 14 . HG2 1 4 31 1 1 1 1 14 GLU H . 14 . HN 1 4 31 1 2 1 1 14 GLU HG3 . 14 . HG1 1 4 32 1 1 1 1 25 ILE H . 25 . HN 1 4 32 1 2 1 1 25 ILE HG12 . 25 . HG12 1 4 33 1 1 1 1 25 ILE H . 25 . HN 1 4 33 1 2 1 1 25 ILE HG13 . 25 . HG11 1 4 34 1 1 1 1 25 ILE H . 25 . HN 1 4 34 1 2 1 1 25 ILE MG . 25 . HG2* 1 4 35 1 1 1 1 27 MET H . 27 . HN 1 4 35 1 2 1 1 27 MET HG2 . 27 . HG2 1 4 36 1 1 1 1 27 MET H . 27 . HN 1 4 36 1 2 1 1 27 MET HG3 . 27 . HG1 1 4 37 1 1 1 1 29 ARG H . 29 . HN 1 4 37 1 2 1 1 29 ARG QG . 29 . HG* 1 4 38 1 1 1 1 4 LEU H . 4 . HN 1 4 38 1 2 1 1 4 LEU MD1 . 4 . HD1* 1 4 39 1 1 1 1 4 LEU H . 4 . HN 1 4 39 1 2 1 1 4 LEU MD2 . 4 . HD2* 1 4 40 1 1 1 1 6 PHE H . 6 . HN 1 4 40 1 2 1 1 6 PHE QD . 6 . HD* 1 4 41 1 1 1 1 7 TRP H . 7 . HN 1 4 41 1 2 1 1 7 TRP HD1 . 7 . HD1 1 4 42 1 1 1 1 7 TRP H . 7 . HN 1 4 42 1 2 1 1 7 TRP HE1 . 7 . HE1 1 4 43 1 1 1 1 8 LYS H . 8 . HN 1 4 43 1 2 1 1 8 LYS QD . 8 . HD* 1 4 44 1 1 1 1 11 ASN H . 11 . HN 1 4 44 1 2 1 1 11 ASN HD21 . 11 . HD21 1 4 45 1 1 1 1 12 LYS H . 12 . HN 1 4 45 1 2 1 1 12 LYS QD . 12 . HD* 1 4 46 1 1 1 1 18 TRP H . 18 . HN 1 4 46 1 2 1 1 18 TRP HD1 . 18 . HD1 1 4 47 1 1 1 1 18 TRP H . 18 . HN 1 4 47 1 2 1 1 18 TRP HE3 . 18 . HE3 1 4 48 1 1 1 1 23 LEU H . 23 . HN 1 4 48 1 2 1 1 23 LEU MD1 . 23 . HD1* 1 4 49 1 1 1 1 23 LEU H . 23 . HN 1 4 49 1 2 1 1 23 LEU MD2 . 23 . HD2* 1 4 50 1 1 1 1 25 ILE H . 25 . HN 1 4 50 1 2 1 1 25 ILE MD . 25 . HD1* 1 4 51 1 1 1 1 29 ARG H . 29 . HN 1 4 51 1 2 1 1 29 ARG QD . 29 . HD* 1 4 52 1 1 1 1 5 THR HA . 5 . HA 1 4 52 1 2 1 1 5 THR MG . 5 . HG2* 1 4 53 1 1 1 1 10 LYS HA . 10 . HA 1 4 53 1 2 1 1 10 LYS HG2 . 10 . HG2 1 4 54 1 1 1 1 10 LYS HA . 10 . HA 1 4 54 1 2 1 1 10 LYS HG3 . 10 . HG1 1 4 55 1 1 1 1 25 ILE HA . 25 . HA 1 4 55 1 2 1 1 25 ILE MG . 25 . HG2* 1 4 56 1 1 1 1 29 ARG HA . 29 . HA 1 4 56 1 2 1 1 29 ARG QG . 29 . HG* 1 4 57 1 1 1 1 4 LEU HA . 4 . HA 1 4 57 1 2 1 1 4 LEU MD1 . 4 . HD1* 1 4 58 1 1 1 1 4 LEU HA . 4 . HA 1 4 58 1 2 1 1 4 LEU MD2 . 4 . HD2* 1 4 59 1 1 1 1 6 PHE HA . 6 . HA 1 4 59 1 2 1 1 6 PHE QD . 6 . HD* 1 4 60 1 1 1 1 7 TRP HA . 7 . HA 1 4 60 1 2 1 1 7 TRP HD1 . 7 . HD1 1 4 61 1 1 1 1 11 ASN HA . 11 . HA 1 4 61 1 2 1 1 11 ASN HD21 . 11 . HD21 1 4 62 1 1 1 1 11 ASN HA . 11 . HA 1 4 62 1 2 1 1 11 ASN HD22 . 11 . HD22 1 4 63 1 1 1 1 18 TRP HA . 18 . HA 1 4 63 1 2 1 1 18 TRP HD1 . 18 . HD1 1 4 64 1 1 1 1 19 ASN HA . 19 . HA 1 4 64 1 2 1 1 19 ASN HD21 . 19 . HD21 1 4 65 1 1 1 1 19 ASN HA . 19 . HA 1 4 65 1 2 1 1 19 ASN HD22 . 19 . HD22 1 4 66 1 1 1 1 23 LEU HA . 23 . HA 1 4 66 1 2 1 1 23 LEU MD1 . 23 . HD1* 1 4 67 1 1 1 1 23 LEU HA . 23 . HA 1 4 67 1 2 1 1 23 LEU MD2 . 23 . HD2* 1 4 68 1 1 1 1 25 ILE HA . 25 . HA 1 4 68 1 2 1 1 25 ILE MD . 25 . HD1* 1 4 69 1 1 1 1 29 ARG HA . 29 . HA 1 4 69 1 2 1 1 29 ARG QD . 29 . HD* 1 4 70 1 1 1 1 11 ASN QB . 11 . HB* 1 4 70 1 2 1 1 11 ASN HD21 . 11 . HD21 1 4 71 1 1 1 1 11 ASN QB . 11 . HB* 1 4 71 1 2 1 1 11 ASN HD22 . 11 . HD22 1 4 72 1 1 1 1 19 ASN HB3 . 19 . HB1 1 4 72 1 2 1 1 19 ASN HD22 . 19 . HD22 1 4 73 1 1 1 1 19 ASN HB2 . 19 . HB2 1 4 73 1 2 1 1 19 ASN HD22 . 19 . HD22 1 4 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 . . . . . 3.01 1.8 3.01 1 4 2 1 . . . . . 3.51 1.8 3.51 1 4 3 1 . . . . . 3.51 1.8 3.51 1 4 4 1 . . . . . 3.72 1.8 3.72 1 4 5 1 . . . . . 3.72 1.8 3.72 1 4 6 1 . . . . . 3.71 1.8 3.71 1 4 7 1 . . . . . 3.71 1.8 3.71 1 4 8 1 . . . . . 3.72 1.8 3.72 1 4 9 1 . . . . . 3.43 1.8 3.43 1 4 10 1 . . . . . 3.43 1.8 3.43 1 4 11 1 . . . . . 3.26 1.8 3.26 1 4 12 1 . . . . . 3.41 1.8 3.41 1 4 13 1 . . . . . 3.69 1.8 3.69 1 4 14 1 . . . . . 3.69 1.8 3.69 1 4 15 1 . . . . . 4.03 1.8 4.03 1 4 16 1 . . . . . 3.81 1.8 3.81 1 4 17 1 . . . . . 3.36 1.8 3.36 1 4 18 1 . . . . . 3.6 1.8 3.6 1 4 19 1 . . . . . 3.72 1.8 3.72 1 4 20 1 . . . . . 3.72 1.8 3.72 1 4 21 1 . . . . . 3.88 1.8 3.88 1 4 22 1 . . . . . 4.13 1.8 4.13 1 4 23 1 . . . . . 4.13 1.8 4.13 1 4 24 1 . . . . . 4.21 1.8 4.21 1 4 25 1 . . . . . 3.69 1.8 3.69 1 4 26 1 . . . . . 3.85 1.8 3.85 1 4 27 1 . . . . . 4.58 1.8 4.58 1 4 28 1 . . . . . 4.58 1.8 4.58 1 4 29 1 . . . . . 3.95 1.8 3.95 1 4 30 1 . . . . . 4.33 1.8 4.33 1 4 31 1 . . . . . 4.33 1.8 4.33 1 4 32 1 . . . . . 3.74 1.8 3.74 1 4 33 1 . . . . . 3.74 1.8 3.74 1 4 34 1 . . . . . 4.01 1.8 4.01 1 4 35 1 . . . . . 4.64 1.8 4.64 1 4 36 1 . . . . . 4.64 1.8 4.64 1 4 37 1 . . . . . 4.36 1.8 4.36 1 4 38 1 . . . . . 3.85 1.8 3.85 1 4 39 1 . . . . . 3.85 1.8 3.85 1 4 40 1 . . . . . 3.75 1.8 3.75 1 4 41 1 . . . . . 3.01 1.8 3.01 1 4 42 1 . . . . . 4.91 1.8 4.91 1 4 43 1 . . . . . 3.79 1.8 3.79 1 4 44 1 . . . . . 4.84 1.8 4.84 1 4 45 1 . . . . . 4.61 1.8 4.61 1 4 46 1 . . . . . 4.71 1.8 4.71 1 4 47 1 . . . . . 4.87 1.8 4.87 1 4 48 1 . . . . . 4.21 1.8 4.21 1 4 49 1 . . . . . 4.21 1.8 4.21 1 4 50 1 . . . . . 4.04 1.8 4.04 1 4 51 1 . . . . . 5.05 1.8 5.05 1 4 52 1 . . . . . 3.32 1.8 3.32 1 4 53 1 . . . . . 4.24 1.8 4.24 1 4 54 1 . . . . . 4.24 1.8 4.24 1 4 55 1 . . . . . 3.32 1.8 3.32 1 4 56 1 . . . . . 3.81 1.8 3.81 1 4 57 1 . . . . . 3.99 1.8 3.99 1 4 58 1 . . . . . 3.99 1.8 3.99 1 4 59 1 . . . . . 2.97 1.8 2.97 1 4 60 1 . . . . . 3.14 1.8 3.14 1 4 61 1 . . . . . 4.54 1.8 4.54 1 4 62 1 . . . . . 5.2 1.8 5.2 1 4 63 1 . . . . . 3.34 1.8 3.34 1 4 64 1 . . . . . 4.84 1.8 4.84 1 4 65 1 . . . . . 4.79 1.8 4.79 1 4 66 1 . . . . . 4.12 1.8 4.12 1 4 67 1 . . . . . 4.12 1.8 4.12 1 4 68 1 . . . . . 3.94 1.8 3.94 1 4 69 1 . . . . . 4.31 1.8 4.31 1 4 70 1 . . . . . 3.1 1.8 3.1 1 4 71 1 . . . . . 3.42 1.8 3.42 1 4 72 1 . . . . . 4.27 1.8 4.27 1 4 73 1 . . . . . 4.27 1.8 4.27 1 4 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C -9.692 2.303 -4.033 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C -11.119 2.865 -4.072 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H -11.586 4.866 -4.415 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H -11.723 3.882 -5.789 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H -10.190 4.342 -5.220 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H -11.433 3.126 -3.070 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H -11.786 2.116 -4.472 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N -11.158 4.080 -4.939 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O -8.797 2.912 -3.482 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 CYS C C -7.092 1.451 -5.314 1.00 . A A . 2 CYS C 1 1 1 11 1 1 2 CYS CA C -8.108 0.529 -4.621 1.00 . A A . 2 CYS CA 1 1 1 12 1 1 2 CYS CB C -8.270 -0.776 -5.413 1.00 . A A . 2 CYS CB 1 1 1 13 1 1 2 CYS H H -10.225 0.685 -5.055 1.00 . A A . 2 CYS H 1 1 1 14 1 1 2 CYS HA H -7.792 0.312 -3.613 1.00 . A A . 2 CYS HA 1 1 1 15 1 1 2 CYS HB2 H -9.178 -1.273 -5.109 1.00 . A A . 2 CYS HB2 1 1 1 16 1 1 2 CYS HB3 H -8.321 -0.549 -6.468 1.00 . A A . 2 CYS HB3 1 1 1 17 1 1 2 CYS N N -9.479 1.149 -4.616 1.00 . A A . 2 CYS N 1 1 1 18 1 1 2 CYS O O -7.416 2.137 -6.271 1.00 . A A . 2 CYS O 1 1 1 19 1 1 2 CYS SG S -6.858 -1.861 -5.105 1.00 . A A . 2 CYS SG 1 1 1 20 1 1 3 LYS C C -3.511 1.577 -5.670 1.00 . A A . 3 LYS C 1 1 1 21 1 1 3 LYS CA C -4.824 2.345 -5.477 1.00 . A A . 3 LYS CA 1 1 1 22 1 1 3 LYS CB C -4.613 3.522 -4.512 1.00 . A A . 3 LYS CB 1 1 1 23 1 1 3 LYS CD C -5.796 5.530 -3.582 1.00 . A A . 3 LYS CD 1 1 1 24 1 1 3 LYS CE C -6.881 5.852 -2.547 1.00 . A A . 3 LYS CE 1 1 1 25 1 1 3 LYS CG C -5.968 4.089 -4.074 1.00 . A A . 3 LYS CG 1 1 1 26 1 1 3 LYS H H -5.627 0.910 -4.079 1.00 . A A . 3 LYS H 1 1 1 27 1 1 3 LYS HA H -5.175 2.715 -6.429 1.00 . A A . 3 LYS HA 1 1 1 28 1 1 3 LYS HB2 H -4.056 3.189 -3.647 1.00 . A A . 3 LYS HB2 1 1 1 29 1 1 3 LYS HB3 H -4.054 4.293 -5.019 1.00 . A A . 3 LYS HB3 1 1 1 30 1 1 3 LYS HD2 H -4.821 5.646 -3.131 1.00 . A A . 3 LYS HD2 1 1 1 31 1 1 3 LYS HD3 H -5.891 6.206 -4.418 1.00 . A A . 3 LYS HD3 1 1 1 32 1 1 3 LYS HE2 H -7.142 6.903 -2.594 1.00 . A A . 3 LYS HE2 1 1 1 33 1 1 3 LYS HE3 H -7.755 5.240 -2.715 1.00 . A A . 3 LYS HE3 1 1 1 34 1 1 3 LYS HG2 H -6.652 4.076 -4.908 1.00 . A A . 3 LYS HG2 1 1 1 35 1 1 3 LYS HG3 H -6.364 3.486 -3.275 1.00 . A A . 3 LYS HG3 1 1 1 36 1 1 3 LYS HZ1 H -5.767 4.607 -1.286 1.00 . A A . 3 LYS HZ1 1 1 1 37 1 1 3 LYS HZ2 H -7.017 5.455 -0.506 1.00 . A A . 3 LYS HZ2 1 1 1 38 1 1 3 LYS HZ3 H -5.594 6.273 -0.956 1.00 . A A . 3 LYS HZ3 1 1 1 39 1 1 3 LYS N N -5.865 1.470 -4.843 1.00 . A A . 3 LYS N 1 1 1 40 1 1 3 LYS NZ N -6.273 5.524 -1.228 1.00 . A A . 3 LYS NZ 1 1 1 41 1 1 3 LYS O O -3.405 0.408 -5.353 1.00 . A A . 3 LYS O 1 1 1 42 1 1 4 LEU C C -0.237 1.841 -5.268 1.00 . A A . 4 LEU C 1 1 1 43 1 1 4 LEU CA C -1.202 1.579 -6.447 1.00 . A A . 4 LEU CA 1 1 1 44 1 1 4 LEU CB C -0.685 2.208 -7.755 1.00 . A A . 4 LEU CB 1 1 1 45 1 1 4 LEU CD1 C -1.604 0.153 -8.876 1.00 . A A . 4 LEU CD1 1 1 1 46 1 1 4 LEU CD2 C -2.863 2.301 -8.997 1.00 . A A . 4 LEU CD2 1 1 1 47 1 1 4 LEU CG C -1.470 1.671 -8.963 1.00 . A A . 4 LEU CG 1 1 1 48 1 1 4 LEU H H -2.643 3.174 -6.453 1.00 . A A . 4 LEU H 1 1 1 49 1 1 4 LEU HA H -1.340 0.523 -6.580 1.00 . A A . 4 LEU HA 1 1 1 50 1 1 4 LEU HB2 H -0.801 3.279 -7.707 1.00 . A A . 4 LEU HB2 1 1 1 51 1 1 4 LEU HB3 H 0.356 1.972 -7.885 1.00 . A A . 4 LEU HB3 1 1 1 52 1 1 4 LEU HD11 H -1.805 -0.244 -9.860 1.00 . A A . 4 LEU HD11 1 1 1 53 1 1 4 LEU HD12 H -2.419 -0.096 -8.214 1.00 . A A . 4 LEU HD12 1 1 1 54 1 1 4 LEU HD13 H -0.686 -0.268 -8.497 1.00 . A A . 4 LEU HD13 1 1 1 55 1 1 4 LEU HD21 H -2.858 3.209 -8.415 1.00 . A A . 4 LEU HD21 1 1 1 56 1 1 4 LEU HD22 H -3.579 1.611 -8.581 1.00 . A A . 4 LEU HD22 1 1 1 57 1 1 4 LEU HD23 H -3.131 2.526 -10.018 1.00 . A A . 4 LEU HD23 1 1 1 58 1 1 4 LEU HG H -0.942 1.928 -9.869 1.00 . A A . 4 LEU HG 1 1 1 59 1 1 4 LEU N N -2.518 2.239 -6.202 1.00 . A A . 4 LEU N 1 1 1 60 1 1 4 LEU O O -0.614 1.711 -4.118 1.00 . A A . 4 LEU O 1 1 1 61 1 1 5 THR C C 1.916 3.870 -3.932 1.00 . A A . 5 THR C 1 1 1 62 1 1 5 THR CA C 1.998 2.422 -4.455 1.00 . A A . 5 THR CA 1 1 1 63 1 1 5 THR CB C 3.372 2.145 -5.102 1.00 . A A . 5 THR CB 1 1 1 64 1 1 5 THR CG2 C 4.306 1.499 -4.077 1.00 . A A . 5 THR CG2 1 1 1 65 1 1 5 THR H H 1.294 2.254 -6.467 1.00 . A A . 5 THR H 1 1 1 66 1 1 5 THR HA H 1.832 1.731 -3.647 1.00 . A A . 5 THR HA 1 1 1 67 1 1 5 THR HB H 3.809 3.075 -5.435 1.00 . A A . 5 THR HB 1 1 1 68 1 1 5 THR HG1 H 4.082 0.900 -6.445 1.00 . A A . 5 THR HG1 1 1 1 69 1 1 5 THR HG21 H 3.732 0.867 -3.417 1.00 . A A . 5 THR HG21 1 1 1 70 1 1 5 THR HG22 H 4.796 2.269 -3.501 1.00 . A A . 5 THR HG22 1 1 1 71 1 1 5 THR HG23 H 5.051 0.905 -4.587 1.00 . A A . 5 THR HG23 1 1 1 72 1 1 5 THR N N 1.002 2.180 -5.544 1.00 . A A . 5 THR N 1 1 1 73 1 1 5 THR O O 1.421 4.113 -2.852 1.00 . A A . 5 THR O 1 1 1 74 1 1 5 THR OG1 O 3.215 1.267 -6.220 1.00 . A A . 5 THR OG1 1 1 1 75 1 1 6 PHE C C 0.960 6.856 -4.266 1.00 . A A . 6 PHE C 1 1 1 76 1 1 6 PHE CA C 2.374 6.253 -4.204 1.00 . A A . 6 PHE CA 1 1 1 77 1 1 6 PHE CB C 3.334 7.008 -5.134 1.00 . A A . 6 PHE CB 1 1 1 78 1 1 6 PHE CD1 C 5.228 6.870 -3.473 1.00 . A A . 6 PHE CD1 1 1 1 79 1 1 6 PHE CD2 C 4.625 9.043 -4.384 1.00 . A A . 6 PHE CD2 1 1 1 80 1 1 6 PHE CE1 C 6.232 7.469 -2.709 1.00 . A A . 6 PHE CE1 1 1 1 81 1 1 6 PHE CE2 C 5.630 9.640 -3.620 1.00 . A A . 6 PHE CE2 1 1 1 82 1 1 6 PHE CG C 4.420 7.657 -4.311 1.00 . A A . 6 PHE CG 1 1 1 83 1 1 6 PHE CZ C 6.436 8.853 -2.783 1.00 . A A . 6 PHE CZ 1 1 1 84 1 1 6 PHE H H 2.807 4.616 -5.535 1.00 . A A . 6 PHE H 1 1 1 85 1 1 6 PHE HA H 2.744 6.301 -3.192 1.00 . A A . 6 PHE HA 1 1 1 86 1 1 6 PHE HB2 H 3.780 6.316 -5.833 1.00 . A A . 6 PHE HB2 1 1 1 87 1 1 6 PHE HB3 H 2.791 7.769 -5.674 1.00 . A A . 6 PHE HB3 1 1 1 88 1 1 6 PHE HD1 H 5.077 5.799 -3.414 1.00 . A A . 6 PHE HD1 1 1 1 89 1 1 6 PHE HD2 H 4.004 9.651 -5.025 1.00 . A A . 6 PHE HD2 1 1 1 90 1 1 6 PHE HE1 H 6.856 6.860 -2.063 1.00 . A A . 6 PHE HE1 1 1 1 91 1 1 6 PHE HE2 H 5.790 10.708 -3.677 1.00 . A A . 6 PHE HE2 1 1 1 92 1 1 6 PHE HZ H 7.216 9.315 -2.195 1.00 . A A . 6 PHE HZ 1 1 1 93 1 1 6 PHE N N 2.405 4.830 -4.678 1.00 . A A . 6 PHE N 1 1 1 94 1 1 6 PHE O O 0.784 8.013 -4.601 1.00 . A A . 6 PHE O 1 1 1 95 1 1 7 TRP C C -1.837 6.875 -2.456 1.00 . A A . 7 TRP C 1 1 1 96 1 1 7 TRP CA C -1.429 6.649 -3.907 1.00 . A A . 7 TRP CA 1 1 1 97 1 1 7 TRP CB C -2.294 5.569 -4.543 1.00 . A A . 7 TRP CB 1 1 1 98 1 1 7 TRP CD1 C -0.801 5.389 -6.571 1.00 . A A . 7 TRP CD1 1 1 1 99 1 1 7 TRP CD2 C -2.973 5.578 -7.114 1.00 . A A . 7 TRP CD2 1 1 1 100 1 1 7 TRP CE2 C -2.259 5.496 -8.329 1.00 . A A . 7 TRP CE2 1 1 1 101 1 1 7 TRP CE3 C -4.376 5.698 -7.173 1.00 . A A . 7 TRP CE3 1 1 1 102 1 1 7 TRP CG C -2.024 5.518 -6.011 1.00 . A A . 7 TRP CG 1 1 1 103 1 1 7 TRP CH2 C -4.300 5.647 -9.608 1.00 . A A . 7 TRP CH2 1 1 1 104 1 1 7 TRP CZ2 C -2.907 5.530 -9.564 1.00 . A A . 7 TRP CZ2 1 1 1 105 1 1 7 TRP CZ3 C -5.033 5.732 -8.415 1.00 . A A . 7 TRP CZ3 1 1 1 106 1 1 7 TRP H H 0.097 5.181 -3.615 1.00 . A A . 7 TRP H 1 1 1 107 1 1 7 TRP HA H -1.484 7.565 -4.475 1.00 . A A . 7 TRP HA 1 1 1 108 1 1 7 TRP HB2 H -2.063 4.613 -4.097 1.00 . A A . 7 TRP HB2 1 1 1 109 1 1 7 TRP HB3 H -3.332 5.802 -4.374 1.00 . A A . 7 TRP HB3 1 1 1 110 1 1 7 TRP HD1 H 0.129 5.311 -6.032 1.00 . A A . 7 TRP HD1 1 1 1 111 1 1 7 TRP HE1 H -0.201 5.312 -8.585 1.00 . A A . 7 TRP HE1 1 1 1 112 1 1 7 TRP HE3 H -4.949 5.760 -6.255 1.00 . A A . 7 TRP HE3 1 1 1 113 1 1 7 TRP HH2 H -4.808 5.674 -10.559 1.00 . A A . 7 TRP HH2 1 1 1 114 1 1 7 TRP HZ2 H -2.339 5.463 -10.478 1.00 . A A . 7 TRP HZ2 1 1 1 115 1 1 7 TRP HZ3 H -6.107 5.820 -8.450 1.00 . A A . 7 TRP HZ3 1 1 1 116 1 1 7 TRP N N -0.051 6.101 -3.910 1.00 . A A . 7 TRP N 1 1 1 117 1 1 7 TRP NE1 N -0.938 5.388 -7.945 1.00 . A A . 7 TRP NE1 1 1 1 118 1 1 7 TRP O O -1.871 5.938 -1.682 1.00 . A A . 7 TRP O 1 1 1 119 1 1 8 LYS C C -3.383 7.297 -0.097 1.00 . A A . 8 LYS C 1 1 1 120 1 1 8 LYS CA C -2.485 8.402 -0.662 1.00 . A A . 8 LYS CA 1 1 1 121 1 1 8 LYS CB C -3.233 9.739 -0.724 1.00 . A A . 8 LYS CB 1 1 1 122 1 1 8 LYS CD C -2.139 10.991 1.148 1.00 . A A . 8 LYS CD 1 1 1 123 1 1 8 LYS CE C -2.204 11.234 2.660 1.00 . A A . 8 LYS CE 1 1 1 124 1 1 8 LYS CG C -3.420 10.289 0.689 1.00 . A A . 8 LYS CG 1 1 1 125 1 1 8 LYS H H -2.045 8.834 -2.718 1.00 . A A . 8 LYS H 1 1 1 126 1 1 8 LYS HA H -1.598 8.506 -0.055 1.00 . A A . 8 LYS HA 1 1 1 127 1 1 8 LYS HB2 H -2.667 10.445 -1.313 1.00 . A A . 8 LYS HB2 1 1 1 128 1 1 8 LYS HB3 H -4.202 9.587 -1.177 1.00 . A A . 8 LYS HB3 1 1 1 129 1 1 8 LYS HD2 H -1.287 10.370 0.917 1.00 . A A . 8 LYS HD2 1 1 1 130 1 1 8 LYS HD3 H -2.042 11.939 0.637 1.00 . A A . 8 LYS HD3 1 1 1 131 1 1 8 LYS HE2 H -2.246 12.299 2.866 1.00 . A A . 8 LYS HE2 1 1 1 132 1 1 8 LYS HE3 H -3.061 10.736 3.087 1.00 . A A . 8 LYS HE3 1 1 1 133 1 1 8 LYS HG2 H -4.238 10.993 0.693 1.00 . A A . 8 LYS HG2 1 1 1 134 1 1 8 LYS HG3 H -3.641 9.476 1.359 1.00 . A A . 8 LYS HG3 1 1 1 135 1 1 8 LYS HZ1 H -1.018 10.575 4.238 1.00 . A A . 8 LYS HZ1 1 1 1 136 1 1 8 LYS HZ2 H -0.144 11.265 2.958 1.00 . A A . 8 LYS HZ2 1 1 1 137 1 1 8 LYS HZ3 H -0.794 9.698 2.798 1.00 . A A . 8 LYS HZ3 1 1 1 138 1 1 8 LYS N N -2.109 8.102 -2.076 1.00 . A A . 8 LYS N 1 1 1 139 1 1 8 LYS NZ N -0.947 10.648 3.204 1.00 . A A . 8 LYS NZ 1 1 1 140 1 1 8 LYS O O -4.568 7.225 -0.397 1.00 . A A . 8 LYS O 1 1 1 141 1 1 9 CYS C C -3.874 5.495 2.758 1.00 . A A . 9 CYS C 1 1 1 142 1 1 9 CYS CA C -3.642 5.307 1.261 1.00 . A A . 9 CYS CA 1 1 1 143 1 1 9 CYS CB C -2.842 4.017 1.007 1.00 . A A . 9 CYS CB 1 1 1 144 1 1 9 CYS H H -1.863 6.495 0.901 1.00 . A A . 9 CYS H 1 1 1 145 1 1 9 CYS HA H -4.585 5.249 0.750 1.00 . A A . 9 CYS HA 1 1 1 146 1 1 9 CYS HB2 H -3.257 3.222 1.608 1.00 . A A . 9 CYS HB2 1 1 1 147 1 1 9 CYS HB3 H -2.918 3.750 -0.037 1.00 . A A . 9 CYS HB3 1 1 1 148 1 1 9 CYS N N -2.824 6.425 0.694 1.00 . A A . 9 CYS N 1 1 1 149 1 1 9 CYS O O -3.147 6.201 3.428 1.00 . A A . 9 CYS O 1 1 1 150 1 1 9 CYS SG S -1.097 4.248 1.445 1.00 . A A . 9 CYS SG 1 1 1 151 1 1 10 LYS C C -4.497 3.783 5.458 1.00 . A A . 10 LYS C 1 1 1 152 1 1 10 LYS CA C -5.173 4.956 4.745 1.00 . A A . 10 LYS CA 1 1 1 153 1 1 10 LYS CB C -6.701 4.849 4.869 1.00 . A A . 10 LYS CB 1 1 1 154 1 1 10 LYS CD C -8.592 6.406 5.427 1.00 . A A . 10 LYS CD 1 1 1 155 1 1 10 LYS CE C -9.874 6.122 4.626 1.00 . A A . 10 LYS CE 1 1 1 156 1 1 10 LYS CG C -7.357 6.195 4.536 1.00 . A A . 10 LYS CG 1 1 1 157 1 1 10 LYS H H -5.445 4.278 2.710 1.00 . A A . 10 LYS H 1 1 1 158 1 1 10 LYS HA H -4.823 5.897 5.140 1.00 . A A . 10 LYS HA 1 1 1 159 1 1 10 LYS HB2 H -7.063 4.094 4.185 1.00 . A A . 10 LYS HB2 1 1 1 160 1 1 10 LYS HB3 H -6.956 4.565 5.880 1.00 . A A . 10 LYS HB3 1 1 1 161 1 1 10 LYS HD2 H -8.544 5.741 6.276 1.00 . A A . 10 LYS HD2 1 1 1 162 1 1 10 LYS HD3 H -8.614 7.430 5.775 1.00 . A A . 10 LYS HD3 1 1 1 163 1 1 10 LYS HE2 H -10.744 6.317 5.237 1.00 . A A . 10 LYS HE2 1 1 1 164 1 1 10 LYS HE3 H -9.901 6.726 3.731 1.00 . A A . 10 LYS HE3 1 1 1 165 1 1 10 LYS HG2 H -6.649 6.994 4.708 1.00 . A A . 10 LYS HG2 1 1 1 166 1 1 10 LYS HG3 H -7.659 6.202 3.498 1.00 . A A . 10 LYS HG3 1 1 1 167 1 1 10 LYS HZ1 H -9.237 4.157 4.954 1.00 . A A . 10 LYS HZ1 1 1 1 168 1 1 10 LYS HZ2 H -9.393 4.571 3.316 1.00 . A A . 10 LYS HZ2 1 1 1 169 1 1 10 LYS HZ3 H -10.772 4.276 4.254 1.00 . A A . 10 LYS HZ3 1 1 1 170 1 1 10 LYS N N -4.882 4.850 3.283 1.00 . A A . 10 LYS N 1 1 1 171 1 1 10 LYS NZ N -9.811 4.674 4.263 1.00 . A A . 10 LYS NZ 1 1 1 172 1 1 10 LYS O O -3.710 3.959 6.371 1.00 . A A . 10 LYS O 1 1 1 173 1 1 11 ASN C C -3.346 0.647 4.561 1.00 . A A . 11 ASN C 1 1 1 174 1 1 11 ASN CA C -4.174 1.376 5.625 1.00 . A A . 11 ASN CA 1 1 1 175 1 1 11 ASN CB C -5.350 0.517 6.109 1.00 . A A . 11 ASN CB 1 1 1 176 1 1 11 ASN CG C -6.280 0.169 4.943 1.00 . A A . 11 ASN CG 1 1 1 177 1 1 11 ASN H H -5.417 2.491 4.271 1.00 . A A . 11 ASN H 1 1 1 178 1 1 11 ASN HA H -3.553 1.650 6.459 1.00 . A A . 11 ASN HA 1 1 1 179 1 1 11 ASN HB2 H -4.967 -0.393 6.545 1.00 . A A . 11 ASN HB2 1 1 1 180 1 1 11 ASN HB3 H -5.904 1.066 6.857 1.00 . A A . 11 ASN HB3 1 1 1 181 1 1 11 ASN HD21 H -6.188 -1.784 5.258 1.00 . A A . 11 ASN HD21 1 1 1 182 1 1 11 ASN HD22 H -7.150 -1.298 3.949 1.00 . A A . 11 ASN HD22 1 1 1 183 1 1 11 ASN N N -4.791 2.591 5.021 1.00 . A A . 11 ASN N 1 1 1 184 1 1 11 ASN ND2 N -6.563 -1.073 4.698 1.00 . A A . 11 ASN ND2 1 1 1 185 1 1 11 ASN O O -3.302 1.058 3.417 1.00 . A A . 11 ASN O 1 1 1 186 1 1 11 ASN OD1 O -6.765 1.042 4.250 1.00 . A A . 11 ASN OD1 1 1 1 187 1 1 12 LYS C C -2.675 -2.119 3.071 1.00 . A A . 12 LYS C 1 1 1 188 1 1 12 LYS CA C -1.837 -1.141 3.919 1.00 . A A . 12 LYS CA 1 1 1 189 1 1 12 LYS CB C -0.786 -1.884 4.750 1.00 . A A . 12 LYS CB 1 1 1 190 1 1 12 LYS CD C -0.351 -3.804 6.296 1.00 . A A . 12 LYS CD 1 1 1 191 1 1 12 LYS CE C 0.323 -4.935 5.504 1.00 . A A . 12 LYS CE 1 1 1 192 1 1 12 LYS CG C -1.404 -3.114 5.423 1.00 . A A . 12 LYS CG 1 1 1 193 1 1 12 LYS H H -2.705 -0.722 5.850 1.00 . A A . 12 LYS H 1 1 1 194 1 1 12 LYS HA H -1.346 -0.434 3.272 1.00 . A A . 12 LYS HA 1 1 1 195 1 1 12 LYS HB2 H 0.013 -2.200 4.102 1.00 . A A . 12 LYS HB2 1 1 1 196 1 1 12 LYS HB3 H -0.394 -1.225 5.506 1.00 . A A . 12 LYS HB3 1 1 1 197 1 1 12 LYS HD2 H 0.392 -3.081 6.602 1.00 . A A . 12 LYS HD2 1 1 1 198 1 1 12 LYS HD3 H -0.833 -4.216 7.171 1.00 . A A . 12 LYS HD3 1 1 1 199 1 1 12 LYS HE2 H -0.416 -5.657 5.181 1.00 . A A . 12 LYS HE2 1 1 1 200 1 1 12 LYS HE3 H 0.850 -4.532 4.652 1.00 . A A . 12 LYS HE3 1 1 1 201 1 1 12 LYS HG2 H -2.237 -2.804 6.038 1.00 . A A . 12 LYS HG2 1 1 1 202 1 1 12 LYS HG3 H -1.751 -3.803 4.667 1.00 . A A . 12 LYS HG3 1 1 1 203 1 1 12 LYS HZ1 H 2.091 -4.924 6.609 1.00 . A A . 12 LYS HZ1 1 1 1 204 1 1 12 LYS HZ2 H 1.634 -6.457 6.043 1.00 . A A . 12 LYS HZ2 1 1 1 205 1 1 12 LYS HZ3 H 0.818 -5.760 7.357 1.00 . A A . 12 LYS HZ3 1 1 1 206 1 1 12 LYS N N -2.675 -0.413 4.922 1.00 . A A . 12 LYS N 1 1 1 207 1 1 12 LYS NZ N 1.287 -5.564 6.451 1.00 . A A . 12 LYS NZ 1 1 1 208 1 1 12 LYS O O -2.215 -2.603 2.057 1.00 . A A . 12 LYS O 1 1 1 209 1 1 13 LYS C C -5.598 -2.653 1.635 1.00 . A A . 13 LYS C 1 1 1 210 1 1 13 LYS CA C -4.710 -3.383 2.664 1.00 . A A . 13 LYS CA 1 1 1 211 1 1 13 LYS CB C -5.584 -4.121 3.686 1.00 . A A . 13 LYS CB 1 1 1 212 1 1 13 LYS CD C -5.557 -6.130 5.188 1.00 . A A . 13 LYS CD 1 1 1 213 1 1 13 LYS CE C -5.817 -5.851 6.676 1.00 . A A . 13 LYS CE 1 1 1 214 1 1 13 LYS CG C -4.710 -4.999 4.592 1.00 . A A . 13 LYS CG 1 1 1 215 1 1 13 LYS H H -4.244 -2.038 4.291 1.00 . A A . 13 LYS H 1 1 1 216 1 1 13 LYS HA H -4.069 -4.091 2.161 1.00 . A A . 13 LYS HA 1 1 1 217 1 1 13 LYS HB2 H -6.115 -3.398 4.286 1.00 . A A . 13 LYS HB2 1 1 1 218 1 1 13 LYS HB3 H -6.295 -4.742 3.161 1.00 . A A . 13 LYS HB3 1 1 1 219 1 1 13 LYS HD2 H -6.497 -6.192 4.661 1.00 . A A . 13 LYS HD2 1 1 1 220 1 1 13 LYS HD3 H -5.026 -7.068 5.090 1.00 . A A . 13 LYS HD3 1 1 1 221 1 1 13 LYS HE2 H -4.942 -6.102 7.265 1.00 . A A . 13 LYS HE2 1 1 1 222 1 1 13 LYS HE3 H -6.084 -4.814 6.827 1.00 . A A . 13 LYS HE3 1 1 1 223 1 1 13 LYS HG2 H -3.900 -5.421 4.012 1.00 . A A . 13 LYS HG2 1 1 1 224 1 1 13 LYS HG3 H -4.303 -4.397 5.390 1.00 . A A . 13 LYS HG3 1 1 1 225 1 1 13 LYS HZ1 H -7.809 -6.456 6.516 1.00 . A A . 13 LYS HZ1 1 1 1 226 1 1 13 LYS HZ2 H -7.150 -6.627 8.070 1.00 . A A . 13 LYS HZ2 1 1 1 227 1 1 13 LYS HZ3 H -6.726 -7.722 6.846 1.00 . A A . 13 LYS HZ3 1 1 1 228 1 1 13 LYS N N -3.885 -2.426 3.469 1.00 . A A . 13 LYS N 1 1 1 229 1 1 13 LYS NZ N -6.961 -6.730 7.051 1.00 . A A . 13 LYS NZ 1 1 1 230 1 1 13 LYS O O -6.437 -3.269 1.003 1.00 . A A . 13 LYS O 1 1 1 231 1 1 14 GLU C C -5.579 -0.543 -0.912 1.00 . A A . 14 GLU C 1 1 1 232 1 1 14 GLU CA C -6.289 -0.640 0.452 1.00 . A A . 14 GLU CA 1 1 1 233 1 1 14 GLU CB C -6.560 0.747 1.048 1.00 . A A . 14 GLU CB 1 1 1 234 1 1 14 GLU CD C -5.626 2.962 0.452 1.00 . A A . 14 GLU CD 1 1 1 235 1 1 14 GLU CG C -5.294 1.600 1.045 1.00 . A A . 14 GLU CG 1 1 1 236 1 1 14 GLU H H -4.760 -0.870 1.966 1.00 . A A . 14 GLU H 1 1 1 237 1 1 14 GLU HA H -7.223 -1.160 0.331 1.00 . A A . 14 GLU HA 1 1 1 238 1 1 14 GLU HB2 H -7.319 1.242 0.460 1.00 . A A . 14 GLU HB2 1 1 1 239 1 1 14 GLU HB3 H -6.913 0.639 2.062 1.00 . A A . 14 GLU HB3 1 1 1 240 1 1 14 GLU HG2 H -4.944 1.720 2.060 1.00 . A A . 14 GLU HG2 1 1 1 241 1 1 14 GLU HG3 H -4.530 1.124 0.450 1.00 . A A . 14 GLU HG3 1 1 1 242 1 1 14 GLU N N -5.434 -1.361 1.454 1.00 . A A . 14 GLU N 1 1 1 243 1 1 14 GLU O O -6.212 -0.322 -1.930 1.00 . A A . 14 GLU O 1 1 1 244 1 1 14 GLU OE1 O -6.282 3.738 1.129 1.00 . A A . 14 GLU OE1 1 1 1 245 1 1 14 GLU OE2 O -5.224 3.215 -0.669 1.00 . A A . 14 GLU OE2 1 1 1 246 1 1 15 CYS C C -3.763 -1.991 -3.013 1.00 . A A . 15 CYS C 1 1 1 247 1 1 15 CYS CA C -3.560 -0.663 -2.261 1.00 . A A . 15 CYS CA 1 1 1 248 1 1 15 CYS CB C -2.076 -0.449 -1.926 1.00 . A A . 15 CYS CB 1 1 1 249 1 1 15 CYS H H -3.784 -0.914 -0.127 1.00 . A A . 15 CYS H 1 1 1 250 1 1 15 CYS HA H -3.930 0.162 -2.850 1.00 . A A . 15 CYS HA 1 1 1 251 1 1 15 CYS HB2 H -1.717 -1.275 -1.327 1.00 . A A . 15 CYS HB2 1 1 1 252 1 1 15 CYS HB3 H -1.511 -0.398 -2.843 1.00 . A A . 15 CYS HB3 1 1 1 253 1 1 15 CYS N N -4.279 -0.723 -0.951 1.00 . A A . 15 CYS N 1 1 1 254 1 1 15 CYS O O -3.733 -3.052 -2.422 1.00 . A A . 15 CYS O 1 1 1 255 1 1 15 CYS SG S -1.858 1.100 -1.007 1.00 . A A . 15 CYS SG 1 1 1 256 1 1 16 CYS C C -2.983 -4.138 -4.902 1.00 . A A . 16 CYS C 1 1 1 257 1 1 16 CYS CA C -4.187 -3.215 -5.077 1.00 . A A . 16 CYS CA 1 1 1 258 1 1 16 CYS CB C -4.346 -2.802 -6.543 1.00 . A A . 16 CYS CB 1 1 1 259 1 1 16 CYS H H -4.002 -1.081 -4.771 1.00 . A A . 16 CYS H 1 1 1 260 1 1 16 CYS HA H -5.082 -3.709 -4.741 1.00 . A A . 16 CYS HA 1 1 1 261 1 1 16 CYS HB2 H -3.415 -2.398 -6.904 1.00 . A A . 16 CYS HB2 1 1 1 262 1 1 16 CYS HB3 H -4.612 -3.669 -7.131 1.00 . A A . 16 CYS HB3 1 1 1 263 1 1 16 CYS N N -3.976 -1.945 -4.307 1.00 . A A . 16 CYS N 1 1 1 264 1 1 16 CYS O O -3.124 -5.271 -4.494 1.00 . A A . 16 CYS O 1 1 1 265 1 1 16 CYS SG S -5.647 -1.546 -6.692 1.00 . A A . 16 CYS SG 1 1 1 266 1 1 17 GLY C C -0.255 -4.529 -3.514 1.00 . A A . 17 GLY C 1 1 1 267 1 1 17 GLY CA C -0.590 -4.512 -5.001 1.00 . A A . 17 GLY CA 1 1 1 268 1 1 17 GLY H H -1.702 -2.737 -5.491 1.00 . A A . 17 GLY H 1 1 1 269 1 1 17 GLY HA2 H -0.799 -5.516 -5.341 1.00 . A A . 17 GLY HA2 1 1 1 270 1 1 17 GLY HA3 H 0.242 -4.105 -5.556 1.00 . A A . 17 GLY HA3 1 1 1 271 1 1 17 GLY N N -1.798 -3.661 -5.182 1.00 . A A . 17 GLY N 1 1 1 272 1 1 17 GLY O O 0.250 -3.556 -2.995 1.00 . A A . 17 GLY O 1 1 1 273 1 1 18 TRP C C 1.003 -4.981 -0.967 1.00 . A A . 18 TRP C 1 1 1 274 1 1 18 TRP CA C -0.288 -5.714 -1.353 1.00 . A A . 18 TRP CA 1 1 1 275 1 1 18 TRP CB C -0.156 -7.213 -1.072 1.00 . A A . 18 TRP CB 1 1 1 276 1 1 18 TRP CD1 C -2.243 -7.117 0.372 1.00 . A A . 18 TRP CD1 1 1 1 277 1 1 18 TRP CD2 C -2.113 -9.009 -0.836 1.00 . A A . 18 TRP CD2 1 1 1 278 1 1 18 TRP CE2 C -3.310 -9.086 -0.087 1.00 . A A . 18 TRP CE2 1 1 1 279 1 1 18 TRP CE3 C -1.791 -10.086 -1.689 1.00 . A A . 18 TRP CE3 1 1 1 280 1 1 18 TRP CG C -1.451 -7.748 -0.528 1.00 . A A . 18 TRP CG 1 1 1 281 1 1 18 TRP CH2 C -3.820 -11.252 -1.025 1.00 . A A . 18 TRP CH2 1 1 1 282 1 1 18 TRP CZ2 C -4.156 -10.193 -0.176 1.00 . A A . 18 TRP CZ2 1 1 1 283 1 1 18 TRP CZ3 C -2.640 -11.201 -1.779 1.00 . A A . 18 TRP CZ3 1 1 1 284 1 1 18 TRP H H -0.997 -6.357 -3.289 1.00 . A A . 18 TRP H 1 1 1 285 1 1 18 TRP HA H -1.119 -5.311 -0.798 1.00 . A A . 18 TRP HA 1 1 1 286 1 1 18 TRP HB2 H 0.090 -7.728 -1.991 1.00 . A A . 18 TRP HB2 1 1 1 287 1 1 18 TRP HB3 H 0.631 -7.375 -0.352 1.00 . A A . 18 TRP HB3 1 1 1 288 1 1 18 TRP HD1 H -2.047 -6.150 0.813 1.00 . A A . 18 TRP HD1 1 1 1 289 1 1 18 TRP HE1 H -4.070 -7.688 1.244 1.00 . A A . 18 TRP HE1 1 1 1 290 1 1 18 TRP HE3 H -0.880 -10.058 -2.275 1.00 . A A . 18 TRP HE3 1 1 1 291 1 1 18 TRP HH2 H -4.472 -12.113 -1.100 1.00 . A A . 18 TRP HH2 1 1 1 292 1 1 18 TRP HZ2 H -5.068 -10.228 0.402 1.00 . A A . 18 TRP HZ2 1 1 1 293 1 1 18 TRP HZ3 H -2.382 -12.019 -2.432 1.00 . A A . 18 TRP HZ3 1 1 1 294 1 1 18 TRP N N -0.561 -5.610 -2.830 1.00 . A A . 18 TRP N 1 1 1 295 1 1 18 TRP NE1 N -3.345 -7.912 0.630 1.00 . A A . 18 TRP NE1 1 1 1 296 1 1 18 TRP O O 2.096 -5.518 -1.039 1.00 . A A . 18 TRP O 1 1 1 297 1 1 19 ASN C C 1.900 -2.403 1.236 1.00 . A A . 19 ASN C 1 1 1 298 1 1 19 ASN CA C 2.061 -2.934 -0.190 1.00 . A A . 19 ASN CA 1 1 1 299 1 1 19 ASN CB C 2.065 -1.781 -1.195 1.00 . A A . 19 ASN CB 1 1 1 300 1 1 19 ASN CG C 3.455 -1.625 -1.799 1.00 . A A . 19 ASN CG 1 1 1 301 1 1 19 ASN H H -0.023 -3.350 -0.542 1.00 . A A . 19 ASN H 1 1 1 302 1 1 19 ASN HA H 2.967 -3.511 -0.285 1.00 . A A . 19 ASN HA 1 1 1 303 1 1 19 ASN HB2 H 1.355 -1.987 -1.982 1.00 . A A . 19 ASN HB2 1 1 1 304 1 1 19 ASN HB3 H 1.789 -0.866 -0.694 1.00 . A A . 19 ASN HB3 1 1 1 305 1 1 19 ASN HD21 H 3.556 0.306 -1.403 1.00 . A A . 19 ASN HD21 1 1 1 306 1 1 19 ASN HD22 H 4.906 -0.338 -2.188 1.00 . A A . 19 ASN HD22 1 1 1 307 1 1 19 ASN N N 0.871 -3.749 -0.573 1.00 . A A . 19 ASN N 1 1 1 308 1 1 19 ASN ND2 N 4.019 -0.456 -1.793 1.00 . A A . 19 ASN ND2 1 1 1 309 1 1 19 ASN O O 1.042 -2.839 1.979 1.00 . A A . 19 ASN O 1 1 1 310 1 1 19 ASN OD1 O 4.035 -2.577 -2.280 1.00 . A A . 19 ASN OD1 1 1 1 311 1 1 20 ALA C C 2.358 0.607 2.969 1.00 . A A . 20 ALA C 1 1 1 312 1 1 20 ALA CA C 2.605 -0.904 3.005 1.00 . A A . 20 ALA CA 1 1 1 313 1 1 20 ALA CB C 3.958 -1.187 3.654 1.00 . A A . 20 ALA CB 1 1 1 314 1 1 20 ALA H H 3.401 -1.123 1.014 1.00 . A A . 20 ALA H 1 1 1 315 1 1 20 ALA HA H 1.827 -1.405 3.553 1.00 . A A . 20 ALA HA 1 1 1 316 1 1 20 ALA HB1 H 4.266 -2.197 3.434 1.00 . A A . 20 ALA HB1 1 1 1 317 1 1 20 ALA HB2 H 3.876 -1.061 4.727 1.00 . A A . 20 ALA HB2 1 1 1 318 1 1 20 ALA HB3 H 4.692 -0.494 3.268 1.00 . A A . 20 ALA HB3 1 1 1 319 1 1 20 ALA N N 2.716 -1.462 1.626 1.00 . A A . 20 ALA N 1 1 1 320 1 1 20 ALA O O 3.147 1.356 2.422 1.00 . A A . 20 ALA O 1 1 1 321 1 1 21 CYS C C 1.916 3.132 4.706 1.00 . A A . 21 CYS C 1 1 1 322 1 1 21 CYS CA C 1.028 2.533 3.611 1.00 . A A . 21 CYS CA 1 1 1 323 1 1 21 CYS CB C -0.464 2.663 3.957 1.00 . A A . 21 CYS CB 1 1 1 324 1 1 21 CYS H H 0.691 0.444 4.036 1.00 . A A . 21 CYS H 1 1 1 325 1 1 21 CYS HA H 1.236 2.982 2.653 1.00 . A A . 21 CYS HA 1 1 1 326 1 1 21 CYS HB2 H -1.024 1.908 3.428 1.00 . A A . 21 CYS HB2 1 1 1 327 1 1 21 CYS HB3 H -0.600 2.535 5.019 1.00 . A A . 21 CYS HB3 1 1 1 328 1 1 21 CYS N N 1.295 1.062 3.575 1.00 . A A . 21 CYS N 1 1 1 329 1 1 21 CYS O O 1.499 3.284 5.838 1.00 . A A . 21 CYS O 1 1 1 330 1 1 21 CYS SG S -1.067 4.301 3.468 1.00 . A A . 21 CYS SG 1 1 1 331 1 1 22 ALA C C 4.321 5.435 5.317 1.00 . A A . 22 ALA C 1 1 1 332 1 1 22 ALA CA C 4.106 3.926 5.421 1.00 . A A . 22 ALA CA 1 1 1 333 1 1 22 ALA CB C 5.411 3.176 5.138 1.00 . A A . 22 ALA CB 1 1 1 334 1 1 22 ALA H H 3.479 3.231 3.474 1.00 . A A . 22 ALA H 1 1 1 335 1 1 22 ALA HA H 3.753 3.675 6.407 1.00 . A A . 22 ALA HA 1 1 1 336 1 1 22 ALA HB1 H 6.232 3.670 5.641 1.00 . A A . 22 ALA HB1 1 1 1 337 1 1 22 ALA HB2 H 5.598 3.164 4.071 1.00 . A A . 22 ALA HB2 1 1 1 338 1 1 22 ALA HB3 H 5.325 2.163 5.498 1.00 . A A . 22 ALA HB3 1 1 1 339 1 1 22 ALA N N 3.158 3.408 4.388 1.00 . A A . 22 ALA N 1 1 1 340 1 1 22 ALA O O 3.898 6.187 6.175 1.00 . A A . 22 ALA O 1 1 1 341 1 1 23 LEU C C 4.004 8.086 3.694 1.00 . A A . 23 LEU C 1 1 1 342 1 1 23 LEU CA C 5.268 7.351 4.163 1.00 . A A . 23 LEU CA 1 1 1 343 1 1 23 LEU CB C 6.377 7.444 3.097 1.00 . A A . 23 LEU CB 1 1 1 344 1 1 23 LEU CD1 C 7.667 6.235 4.918 1.00 . A A . 23 LEU CD1 1 1 1 345 1 1 23 LEU CD2 C 8.652 6.485 2.652 1.00 . A A . 23 LEU CD2 1 1 1 346 1 1 23 LEU CG C 7.770 7.161 3.704 1.00 . A A . 23 LEU CG 1 1 1 347 1 1 23 LEU H H 5.346 5.259 3.632 1.00 . A A . 23 LEU H 1 1 1 348 1 1 23 LEU HA H 5.618 7.759 5.097 1.00 . A A . 23 LEU HA 1 1 1 349 1 1 23 LEU HB2 H 6.179 6.725 2.315 1.00 . A A . 23 LEU HB2 1 1 1 350 1 1 23 LEU HB3 H 6.373 8.437 2.670 1.00 . A A . 23 LEU HB3 1 1 1 351 1 1 23 LEU HD11 H 7.239 5.291 4.616 1.00 . A A . 23 LEU HD11 1 1 1 352 1 1 23 LEU HD12 H 7.039 6.691 5.668 1.00 . A A . 23 LEU HD12 1 1 1 353 1 1 23 LEU HD13 H 8.652 6.069 5.328 1.00 . A A . 23 LEU HD13 1 1 1 354 1 1 23 LEU HD21 H 8.263 6.689 1.666 1.00 . A A . 23 LEU HD21 1 1 1 355 1 1 23 LEU HD22 H 8.664 5.415 2.821 1.00 . A A . 23 LEU HD22 1 1 1 356 1 1 23 LEU HD23 H 9.660 6.869 2.726 1.00 . A A . 23 LEU HD23 1 1 1 357 1 1 23 LEU HG H 8.227 8.093 4.006 1.00 . A A . 23 LEU HG 1 1 1 358 1 1 23 LEU N N 4.997 5.884 4.298 1.00 . A A . 23 LEU N 1 1 1 359 1 1 23 LEU O O 4.025 8.807 2.721 1.00 . A A . 23 LEU O 1 1 1 360 1 1 24 GLY C C 1.099 7.939 2.656 1.00 . A A . 24 GLY C 1 1 1 361 1 1 24 GLY CA C 1.633 8.574 3.950 1.00 . A A . 24 GLY CA 1 1 1 362 1 1 24 GLY H H 2.895 7.308 5.156 1.00 . A A . 24 GLY H 1 1 1 363 1 1 24 GLY HA2 H 0.893 8.470 4.734 1.00 . A A . 24 GLY HA2 1 1 1 364 1 1 24 GLY HA3 H 1.828 9.622 3.777 1.00 . A A . 24 GLY HA3 1 1 1 365 1 1 24 GLY N N 2.898 7.900 4.372 1.00 . A A . 24 GLY N 1 1 1 366 1 1 24 GLY O O 0.085 8.368 2.127 1.00 . A A . 24 GLY O 1 1 1 367 1 1 25 ILE C C 1.803 4.788 0.897 1.00 . A A . 25 ILE C 1 1 1 368 1 1 25 ILE CA C 1.305 6.241 0.893 1.00 . A A . 25 ILE CA 1 1 1 369 1 1 25 ILE CB C 1.957 6.987 -0.285 1.00 . A A . 25 ILE CB 1 1 1 370 1 1 25 ILE CD1 C 3.171 9.023 -1.073 1.00 . A A . 25 ILE CD1 1 1 1 371 1 1 25 ILE CG1 C 2.591 8.312 0.150 1.00 . A A . 25 ILE CG1 1 1 1 372 1 1 25 ILE CG2 C 0.903 7.273 -1.345 1.00 . A A . 25 ILE CG2 1 1 1 373 1 1 25 ILE H H 2.567 6.589 2.598 1.00 . A A . 25 ILE H 1 1 1 374 1 1 25 ILE HA H 0.226 6.279 0.814 1.00 . A A . 25 ILE HA 1 1 1 375 1 1 25 ILE HB H 2.714 6.355 -0.713 1.00 . A A . 25 ILE HB 1 1 1 376 1 1 25 ILE HD11 H 3.787 9.851 -0.751 1.00 . A A . 25 ILE HD11 1 1 1 377 1 1 25 ILE HD12 H 2.364 9.391 -1.688 1.00 . A A . 25 ILE HD12 1 1 1 378 1 1 25 ILE HD13 H 3.767 8.326 -1.642 1.00 . A A . 25 ILE HD13 1 1 1 379 1 1 25 ILE HG12 H 1.842 8.935 0.607 1.00 . A A . 25 ILE HG12 1 1 1 380 1 1 25 ILE HG13 H 3.383 8.116 0.854 1.00 . A A . 25 ILE HG13 1 1 1 381 1 1 25 ILE HG21 H 0.558 6.341 -1.767 1.00 . A A . 25 ILE HG21 1 1 1 382 1 1 25 ILE HG22 H 1.337 7.884 -2.122 1.00 . A A . 25 ILE HG22 1 1 1 383 1 1 25 ILE HG23 H 0.072 7.795 -0.896 1.00 . A A . 25 ILE HG23 1 1 1 384 1 1 25 ILE N N 1.764 6.919 2.149 1.00 . A A . 25 ILE N 1 1 1 385 1 1 25 ILE O O 2.471 4.365 1.823 1.00 . A A . 25 ILE O 1 1 1 386 1 1 26 CYS C C 3.455 2.619 -0.720 1.00 . A A . 26 CYS C 1 1 1 387 1 1 26 CYS CA C 2.037 2.625 -0.156 1.00 . A A . 26 CYS CA 1 1 1 388 1 1 26 CYS CB C 1.086 1.851 -1.079 1.00 . A A . 26 CYS CB 1 1 1 389 1 1 26 CYS H H 1.021 4.390 -0.903 1.00 . A A . 26 CYS H 1 1 1 390 1 1 26 CYS HA H 2.022 2.201 0.832 1.00 . A A . 26 CYS HA 1 1 1 391 1 1 26 CYS HB2 H 0.540 2.542 -1.699 1.00 . A A . 26 CYS HB2 1 1 1 392 1 1 26 CYS HB3 H 1.658 1.182 -1.705 1.00 . A A . 26 CYS HB3 1 1 1 393 1 1 26 CYS N N 1.530 4.031 -0.132 1.00 . A A . 26 CYS N 1 1 1 394 1 1 26 CYS O O 3.676 3.079 -1.818 1.00 . A A . 26 CYS O 1 1 1 395 1 1 26 CYS SG S -0.075 0.883 -0.075 1.00 . A A . 26 CYS SG 1 1 1 396 1 1 27 MET C C 6.638 0.909 -0.003 1.00 . A A . 27 MET C 1 1 1 397 1 1 27 MET CA C 5.818 2.106 -0.533 1.00 . A A . 27 MET CA 1 1 1 398 1 1 27 MET CB C 6.418 3.446 -0.089 1.00 . A A . 27 MET CB 1 1 1 399 1 1 27 MET CE C 8.717 5.676 -0.879 1.00 . A A . 27 MET CE 1 1 1 400 1 1 27 MET CG C 6.300 4.466 -1.221 1.00 . A A . 27 MET CG 1 1 1 401 1 1 27 MET H H 4.230 1.746 0.901 1.00 . A A . 27 MET H 1 1 1 402 1 1 27 MET HA H 5.789 2.072 -1.607 1.00 . A A . 27 MET HA 1 1 1 403 1 1 27 MET HB2 H 5.887 3.810 0.780 1.00 . A A . 27 MET HB2 1 1 1 404 1 1 27 MET HB3 H 7.462 3.308 0.159 1.00 . A A . 27 MET HB3 1 1 1 405 1 1 27 MET HE1 H 9.233 5.073 -0.147 1.00 . A A . 27 MET HE1 1 1 1 406 1 1 27 MET HE2 H 7.984 6.292 -0.381 1.00 . A A . 27 MET HE2 1 1 1 407 1 1 27 MET HE3 H 9.424 6.308 -1.396 1.00 . A A . 27 MET HE3 1 1 1 408 1 1 27 MET HG2 H 5.537 4.147 -1.919 1.00 . A A . 27 MET HG2 1 1 1 409 1 1 27 MET HG3 H 6.030 5.426 -0.811 1.00 . A A . 27 MET HG3 1 1 1 410 1 1 27 MET N N 4.421 2.113 0.009 1.00 . A A . 27 MET N 1 1 1 411 1 1 27 MET O O 6.853 -0.037 -0.734 1.00 . A A . 27 MET O 1 1 1 412 1 1 27 MET SD S 7.893 4.596 -2.078 1.00 . A A . 27 MET SD 1 1 1 413 1 1 28 PRO C C 6.989 -1.312 2.190 1.00 . A A . 28 PRO C 1 1 1 414 1 1 28 PRO CA C 7.892 -0.121 1.825 1.00 . A A . 28 PRO CA 1 1 1 415 1 1 28 PRO CB C 8.489 0.500 3.082 1.00 . A A . 28 PRO CB 1 1 1 416 1 1 28 PRO CD C 6.866 2.070 2.207 1.00 . A A . 28 PRO CD 1 1 1 417 1 1 28 PRO CG C 7.541 1.588 3.466 1.00 . A A . 28 PRO CG 1 1 1 418 1 1 28 PRO HA H 8.677 -0.425 1.147 1.00 . A A . 28 PRO HA 1 1 1 419 1 1 28 PRO HB2 H 8.554 -0.239 3.867 1.00 . A A . 28 PRO HB2 1 1 1 420 1 1 28 PRO HB3 H 9.462 0.915 2.868 1.00 . A A . 28 PRO HB3 1 1 1 421 1 1 28 PRO HD2 H 5.809 2.221 2.379 1.00 . A A . 28 PRO HD2 1 1 1 422 1 1 28 PRO HD3 H 7.328 2.979 1.853 1.00 . A A . 28 PRO HD3 1 1 1 423 1 1 28 PRO HG2 H 6.802 1.199 4.151 1.00 . A A . 28 PRO HG2 1 1 1 424 1 1 28 PRO HG3 H 8.077 2.402 3.924 1.00 . A A . 28 PRO HG3 1 1 1 425 1 1 28 PRO N N 7.075 0.981 1.241 1.00 . A A . 28 PRO N 1 1 1 426 1 1 28 PRO O O 6.625 -1.507 3.335 1.00 . A A . 28 PRO O 1 1 1 427 1 1 29 ARG C C 6.347 -4.216 2.511 1.00 . A A . 29 ARG C 1 1 1 428 1 1 29 ARG CA C 5.720 -3.267 1.479 1.00 . A A . 29 ARG CA 1 1 1 429 1 1 29 ARG CB C 5.550 -3.967 0.122 1.00 . A A . 29 ARG CB 1 1 1 430 1 1 29 ARG CD C 6.917 -6.069 0.119 1.00 . A A . 29 ARG CD 1 1 1 431 1 1 29 ARG CG C 6.879 -4.598 -0.326 1.00 . A A . 29 ARG CG 1 1 1 432 1 1 29 ARG CZ C 9.311 -6.625 0.148 1.00 . A A . 29 ARG CZ 1 1 1 433 1 1 29 ARG H H 6.913 -1.900 0.308 1.00 . A A . 29 ARG H 1 1 1 434 1 1 29 ARG HA H 4.760 -2.926 1.831 1.00 . A A . 29 ARG HA 1 1 1 435 1 1 29 ARG HB2 H 4.799 -4.740 0.214 1.00 . A A . 29 ARG HB2 1 1 1 436 1 1 29 ARG HB3 H 5.232 -3.248 -0.614 1.00 . A A . 29 ARG HB3 1 1 1 437 1 1 29 ARG HD2 H 6.950 -6.139 1.199 1.00 . A A . 29 ARG HD2 1 1 1 438 1 1 29 ARG HD3 H 6.052 -6.586 -0.259 1.00 . A A . 29 ARG HD3 1 1 1 439 1 1 29 ARG HE H 8.097 -7.085 -1.368 1.00 . A A . 29 ARG HE 1 1 1 440 1 1 29 ARG HG2 H 6.958 -4.542 -1.405 1.00 . A A . 29 ARG HG2 1 1 1 441 1 1 29 ARG HG3 H 7.697 -4.059 0.125 1.00 . A A . 29 ARG HG3 1 1 1 442 1 1 29 ARG HH11 H 8.638 -5.568 1.724 1.00 . A A . 29 ARG HH11 1 1 1 443 1 1 29 ARG HH12 H 10.315 -6.015 1.776 1.00 . A A . 29 ARG HH12 1 1 1 444 1 1 29 ARG HH21 H 10.272 -7.673 -1.275 1.00 . A A . 29 ARG HH21 1 1 1 445 1 1 29 ARG HH22 H 11.236 -7.189 0.078 1.00 . A A . 29 ARG HH22 1 1 1 446 1 1 29 ARG N N 6.614 -2.093 1.217 1.00 . A A . 29 ARG N 1 1 1 447 1 1 29 ARG NE N 8.157 -6.649 -0.490 1.00 . A A . 29 ARG NE 1 1 1 448 1 1 29 ARG NH1 N 9.430 -6.025 1.304 1.00 . A A . 29 ARG NH1 1 1 1 449 1 1 29 ARG NH2 N 10.353 -7.209 -0.389 1.00 . A A . 29 ARG NH2 1 1 1 450 1 1 29 ARG O O 7.554 -4.412 2.481 1.00 . A A . 29 ARG O 1 1 1 451 1 1 29 ARG OXT O 5.604 -4.736 3.321 1.00 . A A . 29 ARG OXT 1 1 2 452 1 1 1 GLY C C -10.146 -0.267 -4.783 1.00 . A A . 1 GLY C 1 1 2 453 1 1 1 GLY CA C -11.315 -0.506 -5.739 1.00 . A A . 1 GLY CA 1 1 2 454 1 1 1 GLY H1 H -12.573 -0.499 -4.082 1.00 . A A . 1 GLY H1 1 1 2 455 1 1 1 GLY H2 H -12.320 -2.040 -4.749 1.00 . A A . 1 GLY H2 1 1 2 456 1 1 1 GLY H3 H -13.342 -0.932 -5.530 1.00 . A A . 1 GLY H3 1 1 2 457 1 1 1 GLY HA2 H -11.027 -1.223 -6.496 1.00 . A A . 1 GLY HA2 1 1 2 458 1 1 1 GLY HA3 H -11.590 0.424 -6.208 1.00 . A A . 1 GLY HA3 1 1 2 459 1 1 1 GLY N N -12.475 -1.035 -4.968 1.00 . A A . 1 GLY N 1 1 2 460 1 1 1 GLY O O -10.307 -0.295 -3.577 1.00 . A A . 1 GLY O 1 1 2 461 1 1 2 CYS C C -6.787 1.143 -5.122 1.00 . A A . 2 CYS C 1 1 2 462 1 1 2 CYS CA C -7.787 0.212 -4.423 1.00 . A A . 2 CYS CA 1 1 2 463 1 1 2 CYS CB C -7.166 -1.173 -4.195 1.00 . A A . 2 CYS CB 1 1 2 464 1 1 2 CYS H H -8.865 -0.011 -6.281 1.00 . A A . 2 CYS H 1 1 2 465 1 1 2 CYS HA H -8.098 0.635 -3.480 1.00 . A A . 2 CYS HA 1 1 2 466 1 1 2 CYS HB2 H -6.184 -1.058 -3.762 1.00 . A A . 2 CYS HB2 1 1 2 467 1 1 2 CYS HB3 H -7.792 -1.737 -3.519 1.00 . A A . 2 CYS HB3 1 1 2 468 1 1 2 CYS N N -8.973 -0.030 -5.306 1.00 . A A . 2 CYS N 1 1 2 469 1 1 2 CYS O O -6.920 1.432 -6.297 1.00 . A A . 2 CYS O 1 1 2 470 1 1 2 CYS SG S -7.028 -2.059 -5.771 1.00 . A A . 2 CYS SG 1 1 2 471 1 1 3 LYS C C -3.480 1.771 -5.345 1.00 . A A . 3 LYS C 1 1 2 472 1 1 3 LYS CA C -4.778 2.527 -5.051 1.00 . A A . 3 LYS CA 1 1 2 473 1 1 3 LYS CB C -4.516 3.659 -4.047 1.00 . A A . 3 LYS CB 1 1 2 474 1 1 3 LYS CD C -5.586 5.169 -2.353 1.00 . A A . 3 LYS CD 1 1 2 475 1 1 3 LYS CE C -6.876 5.919 -2.001 1.00 . A A . 3 LYS CE 1 1 2 476 1 1 3 LYS CG C -5.844 4.230 -3.536 1.00 . A A . 3 LYS CG 1 1 2 477 1 1 3 LYS H H -5.696 1.365 -3.467 1.00 . A A . 3 LYS H 1 1 2 478 1 1 3 LYS HA H -5.177 2.937 -5.965 1.00 . A A . 3 LYS HA 1 1 2 479 1 1 3 LYS HB2 H -3.930 3.284 -3.218 1.00 . A A . 3 LYS HB2 1 1 2 480 1 1 3 LYS HB3 H -3.965 4.441 -4.543 1.00 . A A . 3 LYS HB3 1 1 2 481 1 1 3 LYS HD2 H -5.262 4.592 -1.499 1.00 . A A . 3 LYS HD2 1 1 2 482 1 1 3 LYS HD3 H -4.819 5.882 -2.616 1.00 . A A . 3 LYS HD3 1 1 2 483 1 1 3 LYS HE2 H -7.116 6.638 -2.775 1.00 . A A . 3 LYS HE2 1 1 2 484 1 1 3 LYS HE3 H -7.690 5.224 -1.867 1.00 . A A . 3 LYS HE3 1 1 2 485 1 1 3 LYS HG2 H -6.329 4.775 -4.332 1.00 . A A . 3 LYS HG2 1 1 2 486 1 1 3 LYS HG3 H -6.481 3.421 -3.216 1.00 . A A . 3 LYS HG3 1 1 2 487 1 1 3 LYS HZ1 H -6.658 5.942 0.071 1.00 . A A . 3 LYS HZ1 1 1 2 488 1 1 3 LYS HZ2 H -7.276 7.382 -0.577 1.00 . A A . 3 LYS HZ2 1 1 2 489 1 1 3 LYS HZ3 H -5.623 7.023 -0.736 1.00 . A A . 3 LYS HZ3 1 1 2 490 1 1 3 LYS N N -5.787 1.615 -4.413 1.00 . A A . 3 LYS N 1 1 2 491 1 1 3 LYS NZ N -6.585 6.616 -0.715 1.00 . A A . 3 LYS NZ 1 1 2 492 1 1 3 LYS O O -3.328 0.615 -4.993 1.00 . A A . 3 LYS O 1 1 2 493 1 1 4 LEU C C -0.224 2.010 -5.192 1.00 . A A . 4 LEU C 1 1 2 494 1 1 4 LEU CA C -1.249 1.761 -6.320 1.00 . A A . 4 LEU CA 1 1 2 495 1 1 4 LEU CB C -0.807 2.404 -7.651 1.00 . A A . 4 LEU CB 1 1 2 496 1 1 4 LEU CD1 C -1.839 0.377 -8.721 1.00 . A A . 4 LEU CD1 1 1 2 497 1 1 4 LEU CD2 C -3.044 2.555 -8.779 1.00 . A A . 4 LEU CD2 1 1 2 498 1 1 4 LEU CG C -1.668 1.890 -8.816 1.00 . A A . 4 LEU CG 1 1 2 499 1 1 4 LEU H H -2.698 3.349 -6.257 1.00 . A A . 4 LEU H 1 1 2 500 1 1 4 LEU HA H -1.397 0.703 -6.456 1.00 . A A . 4 LEU HA 1 1 2 501 1 1 4 LEU HB2 H -0.909 3.474 -7.580 1.00 . A A . 4 LEU HB2 1 1 2 502 1 1 4 LEU HB3 H 0.225 2.161 -7.846 1.00 . A A . 4 LEU HB3 1 1 2 503 1 1 4 LEU HD11 H -2.575 0.147 -7.965 1.00 . A A . 4 LEU HD11 1 1 2 504 1 1 4 LEU HD12 H -0.895 -0.077 -8.459 1.00 . A A . 4 LEU HD12 1 1 2 505 1 1 4 LEU HD13 H -2.170 -0.004 -9.675 1.00 . A A . 4 LEU HD13 1 1 2 506 1 1 4 LEU HD21 H -3.334 2.835 -9.781 1.00 . A A . 4 LEU HD21 1 1 2 507 1 1 4 LEU HD22 H -3.000 3.434 -8.158 1.00 . A A . 4 LEU HD22 1 1 2 508 1 1 4 LEU HD23 H -3.768 1.864 -8.375 1.00 . A A . 4 LEU HD23 1 1 2 509 1 1 4 LEU HG H -1.180 2.131 -9.750 1.00 . A A . 4 LEU HG 1 1 2 510 1 1 4 LEU N N -2.545 2.421 -5.987 1.00 . A A . 4 LEU N 1 1 2 511 1 1 4 LEU O O -0.543 1.884 -4.023 1.00 . A A . 4 LEU O 1 1 2 512 1 1 5 THR C C 2.000 4.012 -3.959 1.00 . A A . 5 THR C 1 1 2 513 1 1 5 THR CA C 2.029 2.563 -4.477 1.00 . A A . 5 THR CA 1 1 2 514 1 1 5 THR CB C 3.375 2.256 -5.162 1.00 . A A . 5 THR CB 1 1 2 515 1 1 5 THR CG2 C 4.159 1.242 -4.328 1.00 . A A . 5 THR CG2 1 1 2 516 1 1 5 THR H H 1.249 2.421 -6.463 1.00 . A A . 5 THR H 1 1 2 517 1 1 5 THR HA H 1.880 1.879 -3.658 1.00 . A A . 5 THR HA 1 1 2 518 1 1 5 THR HB H 3.952 3.165 -5.236 1.00 . A A . 5 THR HB 1 1 2 519 1 1 5 THR HG1 H 4.006 1.609 -6.898 1.00 . A A . 5 THR HG1 1 1 2 520 1 1 5 THR HG21 H 4.700 1.762 -3.547 1.00 . A A . 5 THR HG21 1 1 2 521 1 1 5 THR HG22 H 4.858 0.718 -4.958 1.00 . A A . 5 THR HG22 1 1 2 522 1 1 5 THR HG23 H 3.473 0.536 -3.884 1.00 . A A . 5 THR HG23 1 1 2 523 1 1 5 THR N N 0.998 2.337 -5.525 1.00 . A A . 5 THR N 1 1 2 524 1 1 5 THR O O 1.578 4.269 -2.849 1.00 . A A . 5 THR O 1 1 2 525 1 1 5 THR OG1 O 3.151 1.727 -6.473 1.00 . A A . 5 THR OG1 1 1 2 526 1 1 6 PHE C C 1.070 7.014 -4.238 1.00 . A A . 6 PHE C 1 1 2 527 1 1 6 PHE CA C 2.472 6.385 -4.286 1.00 . A A . 6 PHE CA 1 1 2 528 1 1 6 PHE CB C 3.360 7.121 -5.298 1.00 . A A . 6 PHE CB 1 1 2 529 1 1 6 PHE CD1 C 5.421 6.556 -3.954 1.00 . A A . 6 PHE CD1 1 1 2 530 1 1 6 PHE CD2 C 5.096 8.846 -4.687 1.00 . A A . 6 PHE CD2 1 1 2 531 1 1 6 PHE CE1 C 6.619 6.924 -3.333 1.00 . A A . 6 PHE CE1 1 1 2 532 1 1 6 PHE CE2 C 6.294 9.212 -4.064 1.00 . A A . 6 PHE CE2 1 1 2 533 1 1 6 PHE CG C 4.657 7.516 -4.631 1.00 . A A . 6 PHE CG 1 1 2 534 1 1 6 PHE CZ C 7.058 8.252 -3.391 1.00 . A A . 6 PHE CZ 1 1 2 535 1 1 6 PHE H H 2.778 4.729 -5.628 1.00 . A A . 6 PHE H 1 1 2 536 1 1 6 PHE HA H 2.925 6.446 -3.309 1.00 . A A . 6 PHE HA 1 1 2 537 1 1 6 PHE HB2 H 3.568 6.478 -6.140 1.00 . A A . 6 PHE HB2 1 1 2 538 1 1 6 PHE HB3 H 2.851 8.010 -5.645 1.00 . A A . 6 PHE HB3 1 1 2 539 1 1 6 PHE HD1 H 5.085 5.530 -3.911 1.00 . A A . 6 PHE HD1 1 1 2 540 1 1 6 PHE HD2 H 4.509 9.592 -5.207 1.00 . A A . 6 PHE HD2 1 1 2 541 1 1 6 PHE HE1 H 7.208 6.181 -2.809 1.00 . A A . 6 PHE HE1 1 1 2 542 1 1 6 PHE HE2 H 6.634 10.239 -4.106 1.00 . A A . 6 PHE HE2 1 1 2 543 1 1 6 PHE HZ H 7.986 8.536 -2.912 1.00 . A A . 6 PHE HZ 1 1 2 544 1 1 6 PHE N N 2.446 4.957 -4.744 1.00 . A A . 6 PHE N 1 1 2 545 1 1 6 PHE O O 0.913 8.200 -4.471 1.00 . A A . 6 PHE O 1 1 2 546 1 1 7 TRP C C -1.617 7.077 -2.325 1.00 . A A . 7 TRP C 1 1 2 547 1 1 7 TRP CA C -1.306 6.846 -3.802 1.00 . A A . 7 TRP CA 1 1 2 548 1 1 7 TRP CB C -2.247 5.793 -4.391 1.00 . A A . 7 TRP CB 1 1 2 549 1 1 7 TRP CD1 C -0.918 5.614 -6.536 1.00 . A A . 7 TRP CD1 1 1 2 550 1 1 7 TRP CD2 C -3.129 5.795 -6.902 1.00 . A A . 7 TRP CD2 1 1 2 551 1 1 7 TRP CE2 C -2.513 5.712 -8.172 1.00 . A A . 7 TRP CE2 1 1 2 552 1 1 7 TRP CE3 C -4.528 5.913 -6.849 1.00 . A A . 7 TRP CE3 1 1 2 553 1 1 7 TRP CG C -2.092 5.740 -5.879 1.00 . A A . 7 TRP CG 1 1 2 554 1 1 7 TRP CH2 C -4.649 5.858 -9.280 1.00 . A A . 7 TRP CH2 1 1 2 555 1 1 7 TRP CZ2 C -3.260 5.743 -9.349 1.00 . A A . 7 TRP CZ2 1 1 2 556 1 1 7 TRP CZ3 C -5.283 5.943 -8.032 1.00 . A A . 7 TRP CZ3 1 1 2 557 1 1 7 TRP H H 0.191 5.312 -3.681 1.00 . A A . 7 TRP H 1 1 2 558 1 1 7 TRP HA H -1.368 7.767 -4.361 1.00 . A A . 7 TRP HA 1 1 2 559 1 1 7 TRP HB2 H -2.015 4.826 -3.970 1.00 . A A . 7 TRP HB2 1 1 2 560 1 1 7 TRP HB3 H -3.263 6.053 -4.147 1.00 . A A . 7 TRP HB3 1 1 2 561 1 1 7 TRP HD1 H 0.055 5.538 -6.075 1.00 . A A . 7 TRP HD1 1 1 2 562 1 1 7 TRP HE1 H -0.481 5.531 -8.590 1.00 . A A . 7 TRP HE1 1 1 2 563 1 1 7 TRP HE3 H -5.026 5.977 -5.890 1.00 . A A . 7 TRP HE3 1 1 2 564 1 1 7 TRP HH2 H -5.236 5.880 -10.186 1.00 . A A . 7 TRP HH2 1 1 2 565 1 1 7 TRP HZ2 H -2.767 5.674 -10.308 1.00 . A A . 7 TRP HZ2 1 1 2 566 1 1 7 TRP HZ3 H -6.358 6.029 -7.981 1.00 . A A . 7 TRP HZ3 1 1 2 567 1 1 7 TRP N N 0.056 6.257 -3.901 1.00 . A A . 7 TRP N 1 1 2 568 1 1 7 TRP NE1 N -1.166 5.606 -7.895 1.00 . A A . 7 TRP NE1 1 1 2 569 1 1 7 TRP O O -1.636 6.139 -1.552 1.00 . A A . 7 TRP O 1 1 2 570 1 1 8 LYS C C -3.122 7.597 0.073 1.00 . A A . 8 LYS C 1 1 2 571 1 1 8 LYS CA C -2.108 8.601 -0.482 1.00 . A A . 8 LYS CA 1 1 2 572 1 1 8 LYS CB C -2.668 10.027 -0.463 1.00 . A A . 8 LYS CB 1 1 2 573 1 1 8 LYS CD C -0.870 11.296 0.751 1.00 . A A . 8 LYS CD 1 1 2 574 1 1 8 LYS CE C -0.305 11.515 2.164 1.00 . A A . 8 LYS CE 1 1 2 575 1 1 8 LYS CG C -2.284 10.713 0.852 1.00 . A A . 8 LYS CG 1 1 2 576 1 1 8 LYS H H -1.777 9.044 -2.563 1.00 . A A . 8 LYS H 1 1 2 577 1 1 8 LYS HA H -1.194 8.561 0.091 1.00 . A A . 8 LYS HA 1 1 2 578 1 1 8 LYS HB2 H -2.259 10.585 -1.294 1.00 . A A . 8 LYS HB2 1 1 2 579 1 1 8 LYS HB3 H -3.744 9.992 -0.549 1.00 . A A . 8 LYS HB3 1 1 2 580 1 1 8 LYS HD2 H -0.236 10.607 0.209 1.00 . A A . 8 LYS HD2 1 1 2 581 1 1 8 LYS HD3 H -0.908 12.241 0.228 1.00 . A A . 8 LYS HD3 1 1 2 582 1 1 8 LYS HE2 H -0.954 12.173 2.730 1.00 . A A . 8 LYS HE2 1 1 2 583 1 1 8 LYS HE3 H -0.191 10.571 2.676 1.00 . A A . 8 LYS HE3 1 1 2 584 1 1 8 LYS HG2 H -2.986 11.506 1.059 1.00 . A A . 8 LYS HG2 1 1 2 585 1 1 8 LYS HG3 H -2.315 9.988 1.652 1.00 . A A . 8 LYS HG3 1 1 2 586 1 1 8 LYS HZ1 H 1.646 11.518 1.415 1.00 . A A . 8 LYS HZ1 1 1 2 587 1 1 8 LYS HZ2 H 1.470 12.331 2.893 1.00 . A A . 8 LYS HZ2 1 1 2 588 1 1 8 LYS HZ3 H 0.921 13.051 1.458 1.00 . A A . 8 LYS HZ3 1 1 2 589 1 1 8 LYS N N -1.824 8.310 -1.922 1.00 . A A . 8 LYS N 1 1 2 590 1 1 8 LYS NZ N 1.031 12.150 1.965 1.00 . A A . 8 LYS NZ 1 1 2 591 1 1 8 LYS O O -4.317 7.692 -0.171 1.00 . A A . 8 LYS O 1 1 2 592 1 1 9 CYS C C -3.827 5.786 2.842 1.00 . A A . 9 CYS C 1 1 2 593 1 1 9 CYS CA C -3.575 5.582 1.346 1.00 . A A . 9 CYS CA 1 1 2 594 1 1 9 CYS CB C -2.876 4.233 1.108 1.00 . A A . 9 CYS CB 1 1 2 595 1 1 9 CYS H H -1.681 6.557 0.954 1.00 . A A . 9 CYS H 1 1 2 596 1 1 9 CYS HA H -4.509 5.600 0.810 1.00 . A A . 9 CYS HA 1 1 2 597 1 1 9 CYS HB2 H -3.405 3.458 1.643 1.00 . A A . 9 CYS HB2 1 1 2 598 1 1 9 CYS HB3 H -2.886 4.005 0.050 1.00 . A A . 9 CYS HB3 1 1 2 599 1 1 9 CYS N N -2.650 6.619 0.794 1.00 . A A . 9 CYS N 1 1 2 600 1 1 9 CYS O O -3.145 6.542 3.509 1.00 . A A . 9 CYS O 1 1 2 601 1 1 9 CYS SG S -1.159 4.297 1.695 1.00 . A A . 9 CYS SG 1 1 2 602 1 1 10 LYS C C -4.694 3.865 5.489 1.00 . A A . 10 LYS C 1 1 2 603 1 1 10 LYS CA C -5.116 5.183 4.819 1.00 . A A . 10 LYS CA 1 1 2 604 1 1 10 LYS CB C -6.636 5.374 4.884 1.00 . A A . 10 LYS CB 1 1 2 605 1 1 10 LYS CD C -8.299 6.817 6.080 1.00 . A A . 10 LYS CD 1 1 2 606 1 1 10 LYS CE C -9.537 5.931 6.277 1.00 . A A . 10 LYS CE 1 1 2 607 1 1 10 LYS CG C -7.026 5.976 6.239 1.00 . A A . 10 LYS CG 1 1 2 608 1 1 10 LYS H H -5.321 4.482 2.799 1.00 . A A . 10 LYS H 1 1 2 609 1 1 10 LYS HA H -4.610 6.023 5.269 1.00 . A A . 10 LYS HA 1 1 2 610 1 1 10 LYS HB2 H -6.947 6.038 4.091 1.00 . A A . 10 LYS HB2 1 1 2 611 1 1 10 LYS HB3 H -7.122 4.418 4.765 1.00 . A A . 10 LYS HB3 1 1 2 612 1 1 10 LYS HD2 H -8.298 7.609 6.816 1.00 . A A . 10 LYS HD2 1 1 2 613 1 1 10 LYS HD3 H -8.318 7.246 5.090 1.00 . A A . 10 LYS HD3 1 1 2 614 1 1 10 LYS HE2 H -9.538 5.122 5.560 1.00 . A A . 10 LYS HE2 1 1 2 615 1 1 10 LYS HE3 H -9.564 5.539 7.284 1.00 . A A . 10 LYS HE3 1 1 2 616 1 1 10 LYS HG2 H -7.201 5.180 6.949 1.00 . A A . 10 LYS HG2 1 1 2 617 1 1 10 LYS HG3 H -6.225 6.607 6.599 1.00 . A A . 10 LYS HG3 1 1 2 618 1 1 10 LYS HZ1 H -10.558 7.398 5.194 1.00 . A A . 10 LYS HZ1 1 1 2 619 1 1 10 LYS HZ2 H -10.827 7.459 6.870 1.00 . A A . 10 LYS HZ2 1 1 2 620 1 1 10 LYS HZ3 H -11.567 6.253 5.932 1.00 . A A . 10 LYS HZ3 1 1 2 621 1 1 10 LYS N N -4.800 5.092 3.367 1.00 . A A . 10 LYS N 1 1 2 622 1 1 10 LYS NZ N -10.708 6.829 6.051 1.00 . A A . 10 LYS NZ 1 1 2 623 1 1 10 LYS O O -4.093 3.854 6.549 1.00 . A A . 10 LYS O 1 1 2 624 1 1 11 ASN C C -3.502 0.806 4.543 1.00 . A A . 11 ASN C 1 1 2 625 1 1 11 ASN CA C -4.597 1.430 5.423 1.00 . A A . 11 ASN CA 1 1 2 626 1 1 11 ASN CB C -5.882 0.601 5.371 1.00 . A A . 11 ASN CB 1 1 2 627 1 1 11 ASN CG C -5.693 -0.742 6.086 1.00 . A A . 11 ASN CG 1 1 2 628 1 1 11 ASN H H -5.463 2.780 3.999 1.00 . A A . 11 ASN H 1 1 2 629 1 1 11 ASN HA H -4.259 1.531 6.443 1.00 . A A . 11 ASN HA 1 1 2 630 1 1 11 ASN HB2 H -6.681 1.154 5.847 1.00 . A A . 11 ASN HB2 1 1 2 631 1 1 11 ASN HB3 H -6.143 0.420 4.339 1.00 . A A . 11 ASN HB3 1 1 2 632 1 1 11 ASN HD21 H -7.506 -1.384 5.628 1.00 . A A . 11 ASN HD21 1 1 2 633 1 1 11 ASN HD22 H -6.566 -2.457 6.539 1.00 . A A . 11 ASN HD22 1 1 2 634 1 1 11 ASN N N -4.989 2.750 4.859 1.00 . A A . 11 ASN N 1 1 2 635 1 1 11 ASN ND2 N -6.668 -1.600 6.084 1.00 . A A . 11 ASN ND2 1 1 2 636 1 1 11 ASN O O -3.218 1.274 3.459 1.00 . A A . 11 ASN O 1 1 2 637 1 1 11 ASN OD1 O -4.648 -1.019 6.647 1.00 . A A . 11 ASN OD1 1 1 2 638 1 1 12 LYS C C -2.392 -1.971 3.275 1.00 . A A . 12 LYS C 1 1 2 639 1 1 12 LYS CA C -1.806 -0.894 4.199 1.00 . A A . 12 LYS CA 1 1 2 640 1 1 12 LYS CB C -0.857 -1.510 5.242 1.00 . A A . 12 LYS CB 1 1 2 641 1 1 12 LYS CD C -1.150 -2.455 7.553 1.00 . A A . 12 LYS CD 1 1 2 642 1 1 12 LYS CE C -2.352 -2.103 8.443 1.00 . A A . 12 LYS CE 1 1 2 643 1 1 12 LYS CG C -1.597 -2.561 6.087 1.00 . A A . 12 LYS CG 1 1 2 644 1 1 12 LYS H H -3.116 -0.596 5.879 1.00 . A A . 12 LYS H 1 1 2 645 1 1 12 LYS HA H -1.281 -0.157 3.613 1.00 . A A . 12 LYS HA 1 1 2 646 1 1 12 LYS HB2 H -0.034 -1.980 4.734 1.00 . A A . 12 LYS HB2 1 1 2 647 1 1 12 LYS HB3 H -0.480 -0.732 5.890 1.00 . A A . 12 LYS HB3 1 1 2 648 1 1 12 LYS HD2 H -0.731 -3.400 7.870 1.00 . A A . 12 LYS HD2 1 1 2 649 1 1 12 LYS HD3 H -0.401 -1.682 7.645 1.00 . A A . 12 LYS HD3 1 1 2 650 1 1 12 LYS HE2 H -2.388 -1.037 8.623 1.00 . A A . 12 LYS HE2 1 1 2 651 1 1 12 LYS HE3 H -3.271 -2.437 7.984 1.00 . A A . 12 LYS HE3 1 1 2 652 1 1 12 LYS HG2 H -2.663 -2.396 6.018 1.00 . A A . 12 LYS HG2 1 1 2 653 1 1 12 LYS HG3 H -1.362 -3.547 5.713 1.00 . A A . 12 LYS HG3 1 1 2 654 1 1 12 LYS HZ1 H -2.911 -2.642 10.378 1.00 . A A . 12 LYS HZ1 1 1 2 655 1 1 12 LYS HZ2 H -1.232 -2.527 10.155 1.00 . A A . 12 LYS HZ2 1 1 2 656 1 1 12 LYS HZ3 H -2.083 -3.858 9.542 1.00 . A A . 12 LYS HZ3 1 1 2 657 1 1 12 LYS N N -2.881 -0.239 5.002 1.00 . A A . 12 LYS N 1 1 2 658 1 1 12 LYS NZ N -2.127 -2.839 9.722 1.00 . A A . 12 LYS NZ 1 1 2 659 1 1 12 LYS O O -1.846 -2.262 2.231 1.00 . A A . 12 LYS O 1 1 2 660 1 1 13 LYS C C -5.048 -3.005 1.722 1.00 . A A . 13 LYS C 1 1 2 661 1 1 13 LYS CA C -4.095 -3.619 2.769 1.00 . A A . 13 LYS CA 1 1 2 662 1 1 13 LYS CB C -4.857 -4.550 3.723 1.00 . A A . 13 LYS CB 1 1 2 663 1 1 13 LYS CD C -3.553 -6.695 3.861 1.00 . A A . 13 LYS CD 1 1 2 664 1 1 13 LYS CE C -3.001 -7.705 4.876 1.00 . A A . 13 LYS CE 1 1 2 665 1 1 13 LYS CG C -3.862 -5.363 4.564 1.00 . A A . 13 LYS CG 1 1 2 666 1 1 13 LYS H H -3.930 -2.319 4.486 1.00 . A A . 13 LYS H 1 1 2 667 1 1 13 LYS HA H -3.310 -4.177 2.274 1.00 . A A . 13 LYS HA 1 1 2 668 1 1 13 LYS HB2 H -5.481 -3.959 4.378 1.00 . A A . 13 LYS HB2 1 1 2 669 1 1 13 LYS HB3 H -5.475 -5.224 3.149 1.00 . A A . 13 LYS HB3 1 1 2 670 1 1 13 LYS HD2 H -4.459 -7.088 3.423 1.00 . A A . 13 LYS HD2 1 1 2 671 1 1 13 LYS HD3 H -2.820 -6.532 3.082 1.00 . A A . 13 LYS HD3 1 1 2 672 1 1 13 LYS HE2 H -3.460 -7.551 5.845 1.00 . A A . 13 LYS HE2 1 1 2 673 1 1 13 LYS HE3 H -3.177 -8.715 4.535 1.00 . A A . 13 LYS HE3 1 1 2 674 1 1 13 LYS HG2 H -2.951 -4.797 4.685 1.00 . A A . 13 LYS HG2 1 1 2 675 1 1 13 LYS HG3 H -4.293 -5.564 5.536 1.00 . A A . 13 LYS HG3 1 1 2 676 1 1 13 LYS HZ1 H -1.174 -7.741 5.877 1.00 . A A . 13 LYS HZ1 1 1 2 677 1 1 13 LYS HZ2 H -1.342 -6.430 4.816 1.00 . A A . 13 LYS HZ2 1 1 2 678 1 1 13 LYS HZ3 H -1.044 -7.987 4.211 1.00 . A A . 13 LYS HZ3 1 1 2 679 1 1 13 LYS N N -3.497 -2.565 3.643 1.00 . A A . 13 LYS N 1 1 2 680 1 1 13 LYS NZ N -1.533 -7.443 4.948 1.00 . A A . 13 LYS NZ 1 1 2 681 1 1 13 LYS O O -5.658 -3.718 0.948 1.00 . A A . 13 LYS O 1 1 2 682 1 1 14 GLU C C -5.368 -0.872 -0.675 1.00 . A A . 14 GLU C 1 1 2 683 1 1 14 GLU CA C -6.096 -1.084 0.667 1.00 . A A . 14 GLU CA 1 1 2 684 1 1 14 GLU CB C -6.563 0.251 1.265 1.00 . A A . 14 GLU CB 1 1 2 685 1 1 14 GLU CD C -5.775 2.615 1.328 1.00 . A A . 14 GLU CD 1 1 2 686 1 1 14 GLU CG C -5.367 1.161 1.555 1.00 . A A . 14 GLU CG 1 1 2 687 1 1 14 GLU H H -4.685 -1.129 2.299 1.00 . A A . 14 GLU H 1 1 2 688 1 1 14 GLU HA H -6.949 -1.726 0.521 1.00 . A A . 14 GLU HA 1 1 2 689 1 1 14 GLU HB2 H -7.221 0.742 0.563 1.00 . A A . 14 GLU HB2 1 1 2 690 1 1 14 GLU HB3 H -7.098 0.064 2.184 1.00 . A A . 14 GLU HB3 1 1 2 691 1 1 14 GLU HG2 H -5.061 1.029 2.582 1.00 . A A . 14 GLU HG2 1 1 2 692 1 1 14 GLU HG3 H -4.547 0.910 0.899 1.00 . A A . 14 GLU HG3 1 1 2 693 1 1 14 GLU N N -5.181 -1.698 1.679 1.00 . A A . 14 GLU N 1 1 2 694 1 1 14 GLU O O -5.995 -0.619 -1.690 1.00 . A A . 14 GLU O 1 1 2 695 1 1 14 GLU OE1 O -6.303 3.206 2.251 1.00 . A A . 14 GLU OE1 1 1 2 696 1 1 14 GLU OE2 O -5.546 3.120 0.245 1.00 . A A . 14 GLU OE2 1 1 2 697 1 1 15 CYS C C -3.625 -2.012 -2.913 1.00 . A A . 15 CYS C 1 1 2 698 1 1 15 CYS CA C -3.338 -0.800 -2.008 1.00 . A A . 15 CYS CA 1 1 2 699 1 1 15 CYS CB C -1.834 -0.723 -1.682 1.00 . A A . 15 CYS CB 1 1 2 700 1 1 15 CYS H H -3.559 -1.197 0.115 1.00 . A A . 15 CYS H 1 1 2 701 1 1 15 CYS HA H -3.660 0.111 -2.486 1.00 . A A . 15 CYS HA 1 1 2 702 1 1 15 CYS HB2 H -1.432 -1.722 -1.637 1.00 . A A . 15 CYS HB2 1 1 2 703 1 1 15 CYS HB3 H -1.331 -0.175 -2.466 1.00 . A A . 15 CYS HB3 1 1 2 704 1 1 15 CYS N N -4.058 -0.984 -0.705 1.00 . A A . 15 CYS N 1 1 2 705 1 1 15 CYS O O -3.689 -3.130 -2.445 1.00 . A A . 15 CYS O 1 1 2 706 1 1 15 CYS SG S -1.546 0.105 -0.088 1.00 . A A . 15 CYS SG 1 1 2 707 1 1 16 CYS C C -3.008 -4.027 -4.984 1.00 . A A . 16 CYS C 1 1 2 708 1 1 16 CYS CA C -4.096 -2.960 -5.115 1.00 . A A . 16 CYS CA 1 1 2 709 1 1 16 CYS CB C -4.119 -2.386 -6.538 1.00 . A A . 16 CYS CB 1 1 2 710 1 1 16 CYS H H -3.752 -0.886 -4.555 1.00 . A A . 16 CYS H 1 1 2 711 1 1 16 CYS HA H -5.054 -3.390 -4.876 1.00 . A A . 16 CYS HA 1 1 2 712 1 1 16 CYS HB2 H -3.178 -1.900 -6.747 1.00 . A A . 16 CYS HB2 1 1 2 713 1 1 16 CYS HB3 H -4.269 -3.190 -7.242 1.00 . A A . 16 CYS HB3 1 1 2 714 1 1 16 CYS N N -3.804 -1.802 -4.197 1.00 . A A . 16 CYS N 1 1 2 715 1 1 16 CYS O O -3.260 -5.126 -4.529 1.00 . A A . 16 CYS O 1 1 2 716 1 1 16 CYS SG S -5.464 -1.184 -6.699 1.00 . A A . 16 CYS SG 1 1 2 717 1 1 17 GLY C C -0.238 -4.686 -3.789 1.00 . A A . 17 GLY C 1 1 2 718 1 1 17 GLY CA C -0.699 -4.698 -5.236 1.00 . A A . 17 GLY CA 1 1 2 719 1 1 17 GLY H H -1.614 -2.814 -5.714 1.00 . A A . 17 GLY H 1 1 2 720 1 1 17 GLY HA2 H -1.057 -5.683 -5.503 1.00 . A A . 17 GLY HA2 1 1 2 721 1 1 17 GLY HA3 H 0.125 -4.420 -5.875 1.00 . A A . 17 GLY HA3 1 1 2 722 1 1 17 GLY N N -1.800 -3.708 -5.363 1.00 . A A . 17 GLY N 1 1 2 723 1 1 17 GLY O O 0.434 -3.766 -3.376 1.00 . A A . 17 GLY O 1 1 2 724 1 1 18 TRP C C 0.940 -4.889 -1.224 1.00 . A A . 18 TRP C 1 1 2 725 1 1 18 TRP CA C -0.283 -5.752 -1.559 1.00 . A A . 18 TRP CA 1 1 2 726 1 1 18 TRP CB C 0.004 -7.233 -1.285 1.00 . A A . 18 TRP CB 1 1 2 727 1 1 18 TRP CD1 C -2.347 -7.390 -0.358 1.00 . A A . 18 TRP CD1 1 1 2 728 1 1 18 TRP CD2 C -1.607 -9.350 -1.180 1.00 . A A . 18 TRP CD2 1 1 2 729 1 1 18 TRP CE2 C -2.921 -9.577 -0.707 1.00 . A A . 18 TRP CE2 1 1 2 730 1 1 18 TRP CE3 C -0.911 -10.431 -1.747 1.00 . A A . 18 TRP CE3 1 1 2 731 1 1 18 TRP CG C -1.269 -7.950 -0.955 1.00 . A A . 18 TRP CG 1 1 2 732 1 1 18 TRP CH2 C -2.816 -11.896 -1.361 1.00 . A A . 18 TRP CH2 1 1 2 733 1 1 18 TRP CZ2 C -3.523 -10.832 -0.793 1.00 . A A . 18 TRP CZ2 1 1 2 734 1 1 18 TRP CZ3 C -1.512 -11.696 -1.835 1.00 . A A . 18 TRP CZ3 1 1 2 735 1 1 18 TRP H H -1.220 -6.367 -3.404 1.00 . A A . 18 TRP H 1 1 2 736 1 1 18 TRP HA H -1.122 -5.431 -0.966 1.00 . A A . 18 TRP HA 1 1 2 737 1 1 18 TRP HB2 H 0.449 -7.681 -2.160 1.00 . A A . 18 TRP HB2 1 1 2 738 1 1 18 TRP HB3 H 0.687 -7.318 -0.453 1.00 . A A . 18 TRP HB3 1 1 2 739 1 1 18 TRP HD1 H -2.430 -6.360 -0.048 1.00 . A A . 18 TRP HD1 1 1 2 740 1 1 18 TRP HE1 H -4.210 -8.204 0.184 1.00 . A A . 18 TRP HE1 1 1 2 741 1 1 18 TRP HE3 H 0.092 -10.288 -2.114 1.00 . A A . 18 TRP HE3 1 1 2 742 1 1 18 TRP HH2 H -3.273 -12.870 -1.430 1.00 . A A . 18 TRP HH2 1 1 2 743 1 1 18 TRP HZ2 H -4.529 -10.980 -0.428 1.00 . A A . 18 TRP HZ2 1 1 2 744 1 1 18 TRP HZ3 H -0.967 -12.521 -2.272 1.00 . A A . 18 TRP HZ3 1 1 2 745 1 1 18 TRP N N -0.642 -5.676 -3.021 1.00 . A A . 18 TRP N 1 1 2 746 1 1 18 TRP NE1 N -3.328 -8.353 -0.215 1.00 . A A . 18 TRP NE1 1 1 2 747 1 1 18 TRP O O 2.077 -5.313 -1.340 1.00 . A A . 18 TRP O 1 1 2 748 1 1 19 ASN C C 1.696 -2.350 1.014 1.00 . A A . 19 ASN C 1 1 2 749 1 1 19 ASN CA C 1.801 -2.738 -0.465 1.00 . A A . 19 ASN CA 1 1 2 750 1 1 19 ASN CB C 1.556 -1.512 -1.348 1.00 . A A . 19 ASN CB 1 1 2 751 1 1 19 ASN CG C 2.717 -1.294 -2.318 1.00 . A A . 19 ASN CG 1 1 2 752 1 1 19 ASN H H -0.235 -3.375 -0.742 1.00 . A A . 19 ASN H 1 1 2 753 1 1 19 ASN HA H 2.762 -3.178 -0.682 1.00 . A A . 19 ASN HA 1 1 2 754 1 1 19 ASN HB2 H 0.646 -1.657 -1.908 1.00 . A A . 19 ASN HB2 1 1 2 755 1 1 19 ASN HB3 H 1.455 -0.642 -0.719 1.00 . A A . 19 ASN HB3 1 1 2 756 1 1 19 ASN HD21 H 4.048 -0.895 -0.897 1.00 . A A . 19 ASN HD21 1 1 2 757 1 1 19 ASN HD22 H 4.639 -0.827 -2.487 1.00 . A A . 19 ASN HD22 1 1 2 758 1 1 19 ASN N N 0.692 -3.675 -0.814 1.00 . A A . 19 ASN N 1 1 2 759 1 1 19 ASN ND2 N 3.899 -0.986 -1.861 1.00 . A A . 19 ASN ND2 1 1 2 760 1 1 19 ASN O O 1.028 -3.008 1.789 1.00 . A A . 19 ASN O 1 1 2 761 1 1 19 ASN OD1 O 2.541 -1.388 -3.513 1.00 . A A . 19 ASN OD1 1 1 2 762 1 1 20 ALA C C 2.053 0.654 2.916 1.00 . A A . 20 ALA C 1 1 2 763 1 1 20 ALA CA C 2.250 -0.856 2.834 1.00 . A A . 20 ALA CA 1 1 2 764 1 1 20 ALA CB C 3.594 -1.247 3.436 1.00 . A A . 20 ALA CB 1 1 2 765 1 1 20 ALA H H 2.855 -0.751 0.775 1.00 . A A . 20 ALA H 1 1 2 766 1 1 20 ALA HA H 1.452 -1.375 3.341 1.00 . A A . 20 ALA HA 1 1 2 767 1 1 20 ALA HB1 H 3.576 -1.076 4.504 1.00 . A A . 20 ALA HB1 1 1 2 768 1 1 20 ALA HB2 H 4.373 -0.647 2.991 1.00 . A A . 20 ALA HB2 1 1 2 769 1 1 20 ALA HB3 H 3.789 -2.291 3.238 1.00 . A A . 20 ALA HB3 1 1 2 770 1 1 20 ALA N N 2.333 -1.281 1.412 1.00 . A A . 20 ALA N 1 1 2 771 1 1 20 ALA O O 2.816 1.416 2.348 1.00 . A A . 20 ALA O 1 1 2 772 1 1 21 CYS C C 1.784 3.095 4.815 1.00 . A A . 21 CYS C 1 1 2 773 1 1 21 CYS CA C 0.813 2.561 3.764 1.00 . A A . 21 CYS CA 1 1 2 774 1 1 21 CYS CB C -0.645 2.692 4.220 1.00 . A A . 21 CYS CB 1 1 2 775 1 1 21 CYS H H 0.463 0.460 4.083 1.00 . A A . 21 CYS H 1 1 2 776 1 1 21 CYS HA H 0.957 3.061 2.820 1.00 . A A . 21 CYS HA 1 1 2 777 1 1 21 CYS HB2 H -1.231 1.907 3.766 1.00 . A A . 21 CYS HB2 1 1 2 778 1 1 21 CYS HB3 H -0.699 2.602 5.295 1.00 . A A . 21 CYS HB3 1 1 2 779 1 1 21 CYS N N 1.049 1.095 3.626 1.00 . A A . 21 CYS N 1 1 2 780 1 1 21 CYS O O 1.478 3.130 5.991 1.00 . A A . 21 CYS O 1 1 2 781 1 1 21 CYS SG S -1.305 4.299 3.712 1.00 . A A . 21 CYS SG 1 1 2 782 1 1 22 ALA C C 4.237 5.447 5.263 1.00 . A A . 22 ALA C 1 1 2 783 1 1 22 ALA CA C 3.997 3.936 5.374 1.00 . A A . 22 ALA CA 1 1 2 784 1 1 22 ALA CB C 5.263 3.166 4.996 1.00 . A A . 22 ALA CB 1 1 2 785 1 1 22 ALA H H 3.195 3.378 3.445 1.00 . A A . 22 ALA H 1 1 2 786 1 1 22 ALA HA H 3.705 3.678 6.378 1.00 . A A . 22 ALA HA 1 1 2 787 1 1 22 ALA HB1 H 5.341 3.106 3.917 1.00 . A A . 22 ALA HB1 1 1 2 788 1 1 22 ALA HB2 H 5.215 2.170 5.411 1.00 . A A . 22 ALA HB2 1 1 2 789 1 1 22 ALA HB3 H 6.126 3.680 5.391 1.00 . A A . 22 ALA HB3 1 1 2 790 1 1 22 ALA N N 2.970 3.455 4.399 1.00 . A A . 22 ALA N 1 1 2 791 1 1 22 ALA O O 3.768 6.214 6.080 1.00 . A A . 22 ALA O 1 1 2 792 1 1 23 LEU C C 4.027 8.068 3.553 1.00 . A A . 23 LEU C 1 1 2 793 1 1 23 LEU CA C 5.256 7.347 4.119 1.00 . A A . 23 LEU CA 1 1 2 794 1 1 23 LEU CB C 6.443 7.474 3.136 1.00 . A A . 23 LEU CB 1 1 2 795 1 1 23 LEU CD1 C 8.656 6.559 2.386 1.00 . A A . 23 LEU CD1 1 1 2 796 1 1 23 LEU CD2 C 7.861 6.067 4.696 1.00 . A A . 23 LEU CD2 1 1 2 797 1 1 23 LEU CG C 7.418 6.281 3.241 1.00 . A A . 23 LEU CG 1 1 2 798 1 1 23 LEU H H 5.340 5.244 3.625 1.00 . A A . 23 LEU H 1 1 2 799 1 1 23 LEU HA H 5.526 7.775 5.073 1.00 . A A . 23 LEU HA 1 1 2 800 1 1 23 LEU HB2 H 6.058 7.528 2.129 1.00 . A A . 23 LEU HB2 1 1 2 801 1 1 23 LEU HB3 H 6.980 8.390 3.351 1.00 . A A . 23 LEU HB3 1 1 2 802 1 1 23 LEU HD11 H 9.199 7.395 2.802 1.00 . A A . 23 LEU HD11 1 1 2 803 1 1 23 LEU HD12 H 8.354 6.795 1.375 1.00 . A A . 23 LEU HD12 1 1 2 804 1 1 23 LEU HD13 H 9.293 5.687 2.376 1.00 . A A . 23 LEU HD13 1 1 2 805 1 1 23 LEU HD21 H 8.602 6.808 4.958 1.00 . A A . 23 LEU HD21 1 1 2 806 1 1 23 LEU HD22 H 8.290 5.078 4.800 1.00 . A A . 23 LEU HD22 1 1 2 807 1 1 23 LEU HD23 H 7.010 6.159 5.354 1.00 . A A . 23 LEU HD23 1 1 2 808 1 1 23 LEU HG H 6.934 5.388 2.873 1.00 . A A . 23 LEU HG 1 1 2 809 1 1 23 LEU N N 4.971 5.880 4.268 1.00 . A A . 23 LEU N 1 1 2 810 1 1 23 LEU O O 4.115 8.785 2.577 1.00 . A A . 23 LEU O 1 1 2 811 1 1 24 GLY C C 1.201 7.941 2.321 1.00 . A A . 24 GLY C 1 1 2 812 1 1 24 GLY CA C 1.651 8.566 3.650 1.00 . A A . 24 GLY CA 1 1 2 813 1 1 24 GLY H H 2.830 7.309 4.947 1.00 . A A . 24 GLY H 1 1 2 814 1 1 24 GLY HA2 H 0.863 8.461 4.379 1.00 . A A . 24 GLY HA2 1 1 2 815 1 1 24 GLY HA3 H 1.862 9.613 3.499 1.00 . A A . 24 GLY HA3 1 1 2 816 1 1 24 GLY N N 2.880 7.887 4.156 1.00 . A A . 24 GLY N 1 1 2 817 1 1 24 GLY O O 0.332 8.466 1.648 1.00 . A A . 24 GLY O 1 1 2 818 1 1 25 ILE C C 1.720 4.654 0.741 1.00 . A A . 25 ILE C 1 1 2 819 1 1 25 ILE CA C 1.400 6.150 0.663 1.00 . A A . 25 ILE CA 1 1 2 820 1 1 25 ILE CB C 2.244 6.781 -0.462 1.00 . A A . 25 ILE CB 1 1 2 821 1 1 25 ILE CD1 C 4.099 8.346 -1.062 1.00 . A A . 25 ILE CD1 1 1 2 822 1 1 25 ILE CG1 C 3.354 7.683 0.096 1.00 . A A . 25 ILE CG1 1 1 2 823 1 1 25 ILE CG2 C 1.345 7.607 -1.372 1.00 . A A . 25 ILE CG2 1 1 2 824 1 1 25 ILE H H 2.472 6.425 2.507 1.00 . A A . 25 ILE H 1 1 2 825 1 1 25 ILE HA H 0.354 6.301 0.460 1.00 . A A . 25 ILE HA 1 1 2 826 1 1 25 ILE HB H 2.685 5.988 -1.042 1.00 . A A . 25 ILE HB 1 1 2 827 1 1 25 ILE HD11 H 3.407 8.951 -1.628 1.00 . A A . 25 ILE HD11 1 1 2 828 1 1 25 ILE HD12 H 4.517 7.585 -1.703 1.00 . A A . 25 ILE HD12 1 1 2 829 1 1 25 ILE HD13 H 4.892 8.970 -0.676 1.00 . A A . 25 ILE HD13 1 1 2 830 1 1 25 ILE HG12 H 2.916 8.447 0.718 1.00 . A A . 25 ILE HG12 1 1 2 831 1 1 25 ILE HG13 H 4.048 7.096 0.678 1.00 . A A . 25 ILE HG13 1 1 2 832 1 1 25 ILE HG21 H 0.625 6.959 -1.845 1.00 . A A . 25 ILE HG21 1 1 2 833 1 1 25 ILE HG22 H 1.949 8.085 -2.131 1.00 . A A . 25 ILE HG22 1 1 2 834 1 1 25 ILE HG23 H 0.832 8.359 -0.792 1.00 . A A . 25 ILE HG23 1 1 2 835 1 1 25 ILE N N 1.784 6.827 1.943 1.00 . A A . 25 ILE N 1 1 2 836 1 1 25 ILE O O 2.299 4.181 1.702 1.00 . A A . 25 ILE O 1 1 2 837 1 1 26 CYS C C 3.112 2.268 -0.850 1.00 . A A . 26 CYS C 1 1 2 838 1 1 26 CYS CA C 1.694 2.460 -0.300 1.00 . A A . 26 CYS CA 1 1 2 839 1 1 26 CYS CB C 0.663 1.853 -1.263 1.00 . A A . 26 CYS CB 1 1 2 840 1 1 26 CYS H H 0.948 4.335 -1.065 1.00 . A A . 26 CYS H 1 1 2 841 1 1 26 CYS HA H 1.592 2.029 0.683 1.00 . A A . 26 CYS HA 1 1 2 842 1 1 26 CYS HB2 H 0.702 2.384 -2.201 1.00 . A A . 26 CYS HB2 1 1 2 843 1 1 26 CYS HB3 H 0.897 0.818 -1.435 1.00 . A A . 26 CYS HB3 1 1 2 844 1 1 26 CYS N N 1.382 3.918 -0.283 1.00 . A A . 26 CYS N 1 1 2 845 1 1 26 CYS O O 3.341 2.459 -2.023 1.00 . A A . 26 CYS O 1 1 2 846 1 1 26 CYS SG S -1.004 1.998 -0.563 1.00 . A A . 26 CYS SG 1 1 2 847 1 1 27 MET C C 6.250 0.614 0.054 1.00 . A A . 27 MET C 1 1 2 848 1 1 27 MET CA C 5.462 1.774 -0.594 1.00 . A A . 27 MET CA 1 1 2 849 1 1 27 MET CB C 6.136 3.129 -0.346 1.00 . A A . 27 MET CB 1 1 2 850 1 1 27 MET CE C 6.781 3.192 -4.132 1.00 . A A . 27 MET CE 1 1 2 851 1 1 27 MET CG C 6.079 3.974 -1.617 1.00 . A A . 27 MET CG 1 1 2 852 1 1 27 MET H H 3.905 1.789 0.920 1.00 . A A . 27 MET H 1 1 2 853 1 1 27 MET HA H 5.401 1.608 -1.654 1.00 . A A . 27 MET HA 1 1 2 854 1 1 27 MET HB2 H 5.621 3.645 0.451 1.00 . A A . 27 MET HB2 1 1 2 855 1 1 27 MET HB3 H 7.166 2.971 -0.067 1.00 . A A . 27 MET HB3 1 1 2 856 1 1 27 MET HE1 H 6.740 2.112 -4.185 1.00 . A A . 27 MET HE1 1 1 2 857 1 1 27 MET HE2 H 7.347 3.569 -4.969 1.00 . A A . 27 MET HE2 1 1 2 858 1 1 27 MET HE3 H 5.780 3.598 -4.166 1.00 . A A . 27 MET HE3 1 1 2 859 1 1 27 MET HG2 H 5.212 3.698 -2.197 1.00 . A A . 27 MET HG2 1 1 2 860 1 1 27 MET HG3 H 6.016 5.018 -1.350 1.00 . A A . 27 MET HG3 1 1 2 861 1 1 27 MET N N 4.080 1.925 -0.038 1.00 . A A . 27 MET N 1 1 2 862 1 1 27 MET O O 6.379 -0.434 -0.550 1.00 . A A . 27 MET O 1 1 2 863 1 1 27 MET SD S 7.582 3.690 -2.588 1.00 . A A . 27 MET SD 1 1 2 864 1 1 28 PRO C C 6.723 -1.411 2.358 1.00 . A A . 28 PRO C 1 1 2 865 1 1 28 PRO CA C 7.593 -0.223 1.923 1.00 . A A . 28 PRO CA 1 1 2 866 1 1 28 PRO CB C 8.179 0.502 3.131 1.00 . A A . 28 PRO CB 1 1 2 867 1 1 28 PRO CD C 6.673 2.044 2.064 1.00 . A A . 28 PRO CD 1 1 2 868 1 1 28 PRO CG C 7.233 1.624 3.392 1.00 . A A . 28 PRO CG 1 1 2 869 1 1 28 PRO HA H 8.391 -0.560 1.279 1.00 . A A . 28 PRO HA 1 1 2 870 1 1 28 PRO HB2 H 8.222 -0.163 3.982 1.00 . A A . 28 PRO HB2 1 1 2 871 1 1 28 PRO HB3 H 9.161 0.891 2.902 1.00 . A A . 28 PRO HB3 1 1 2 872 1 1 28 PRO HD2 H 5.639 2.347 2.166 1.00 . A A . 28 PRO HD2 1 1 2 873 1 1 28 PRO HD3 H 7.264 2.838 1.633 1.00 . A A . 28 PRO HD3 1 1 2 874 1 1 28 PRO HG2 H 6.435 1.286 4.037 1.00 . A A . 28 PRO HG2 1 1 2 875 1 1 28 PRO HG3 H 7.751 2.448 3.842 1.00 . A A . 28 PRO HG3 1 1 2 876 1 1 28 PRO N N 6.780 0.832 1.242 1.00 . A A . 28 PRO N 1 1 2 877 1 1 28 PRO O O 6.283 -1.485 3.489 1.00 . A A . 28 PRO O 1 1 2 878 1 1 29 ARG C C 6.139 -4.212 3.059 1.00 . A A . 29 ARG C 1 1 2 879 1 1 29 ARG CA C 5.636 -3.526 1.783 1.00 . A A . 29 ARG CA 1 1 2 880 1 1 29 ARG CB C 5.789 -4.481 0.591 1.00 . A A . 29 ARG CB 1 1 2 881 1 1 29 ARG CD C 6.397 -3.767 -1.735 1.00 . A A . 29 ARG CD 1 1 2 882 1 1 29 ARG CG C 5.271 -3.817 -0.694 1.00 . A A . 29 ARG CG 1 1 2 883 1 1 29 ARG CZ C 7.810 -5.499 -2.737 1.00 . A A . 29 ARG CZ 1 1 2 884 1 1 29 ARG H H 6.846 -2.222 0.560 1.00 . A A . 29 ARG H 1 1 2 885 1 1 29 ARG HA H 4.604 -3.238 1.895 1.00 . A A . 29 ARG HA 1 1 2 886 1 1 29 ARG HB2 H 6.832 -4.735 0.470 1.00 . A A . 29 ARG HB2 1 1 2 887 1 1 29 ARG HB3 H 5.223 -5.383 0.779 1.00 . A A . 29 ARG HB3 1 1 2 888 1 1 29 ARG HD2 H 6.042 -3.301 -2.644 1.00 . A A . 29 ARG HD2 1 1 2 889 1 1 29 ARG HD3 H 7.246 -3.225 -1.341 1.00 . A A . 29 ARG HD3 1 1 2 890 1 1 29 ARG HE H 6.240 -5.910 -1.586 1.00 . A A . 29 ARG HE 1 1 2 891 1 1 29 ARG HG2 H 4.442 -4.390 -1.085 1.00 . A A . 29 ARG HG2 1 1 2 892 1 1 29 ARG HG3 H 4.941 -2.812 -0.476 1.00 . A A . 29 ARG HG3 1 1 2 893 1 1 29 ARG HH11 H 8.273 -3.597 -3.181 1.00 . A A . 29 ARG HH11 1 1 2 894 1 1 29 ARG HH12 H 9.312 -4.787 -3.878 1.00 . A A . 29 ARG HH12 1 1 2 895 1 1 29 ARG HH21 H 7.597 -7.485 -2.495 1.00 . A A . 29 ARG HH21 1 1 2 896 1 1 29 ARG HH22 H 8.926 -6.985 -3.482 1.00 . A A . 29 ARG HH22 1 1 2 897 1 1 29 ARG N N 6.477 -2.328 1.457 1.00 . A A . 29 ARG N 1 1 2 898 1 1 29 ARG NE N 6.772 -5.195 -1.990 1.00 . A A . 29 ARG NE 1 1 2 899 1 1 29 ARG NH1 N 8.520 -4.554 -3.308 1.00 . A A . 29 ARG NH1 1 1 2 900 1 1 29 ARG NH2 N 8.135 -6.752 -2.920 1.00 . A A . 29 ARG NH2 1 1 2 901 1 1 29 ARG O O 5.314 -4.600 3.865 1.00 . A A . 29 ARG O 1 1 2 902 1 1 29 ARG OXT O 7.344 -4.340 3.206 1.00 . A A . 29 ARG OXT 1 1 3 903 1 1 1 GLY C C -10.194 0.756 -3.210 1.00 . A A . 1 GLY C 1 1 3 904 1 1 1 GLY CA C -11.477 1.582 -3.106 1.00 . A A . 1 GLY CA 1 1 3 905 1 1 1 GLY H1 H -12.478 -0.251 -3.012 1.00 . A A . 1 GLY H1 1 1 3 906 1 1 1 GLY H2 H -12.835 0.666 -4.396 1.00 . A A . 1 GLY H2 1 1 3 907 1 1 1 GLY H3 H -13.495 1.100 -2.897 1.00 . A A . 1 GLY H3 1 1 3 908 1 1 1 GLY HA2 H -11.448 2.374 -3.838 1.00 . A A . 1 GLY HA2 1 1 3 909 1 1 1 GLY HA3 H -11.548 2.006 -2.116 1.00 . A A . 1 GLY HA3 1 1 3 910 1 1 1 GLY N N -12.660 0.707 -3.372 1.00 . A A . 1 GLY N 1 1 3 911 1 1 1 GLY O O -10.058 -0.271 -2.571 1.00 . A A . 1 GLY O 1 1 3 912 1 1 2 CYS C C -6.974 1.255 -4.972 1.00 . A A . 2 CYS C 1 1 3 913 1 1 2 CYS CA C -7.982 0.421 -4.175 1.00 . A A . 2 CYS CA 1 1 3 914 1 1 2 CYS CB C -8.361 -0.851 -4.957 1.00 . A A . 2 CYS CB 1 1 3 915 1 1 2 CYS H H -9.391 2.015 -4.528 1.00 . A A . 2 CYS H 1 1 3 916 1 1 2 CYS HA H -7.583 0.155 -3.212 1.00 . A A . 2 CYS HA 1 1 3 917 1 1 2 CYS HB2 H -9.298 -1.243 -4.584 1.00 . A A . 2 CYS HB2 1 1 3 918 1 1 2 CYS HB3 H -8.468 -0.614 -6.006 1.00 . A A . 2 CYS HB3 1 1 3 919 1 1 2 CYS N N -9.257 1.188 -4.019 1.00 . A A . 2 CYS N 1 1 3 920 1 1 2 CYS O O -7.258 1.674 -6.082 1.00 . A A . 2 CYS O 1 1 3 921 1 1 2 CYS SG S -7.062 -2.096 -4.741 1.00 . A A . 2 CYS SG 1 1 3 922 1 1 3 LYS C C -3.492 1.562 -5.377 1.00 . A A . 3 LYS C 1 1 3 923 1 1 3 LYS CA C -4.795 2.339 -5.166 1.00 . A A . 3 LYS CA 1 1 3 924 1 1 3 LYS CB C -4.534 3.573 -4.289 1.00 . A A . 3 LYS CB 1 1 3 925 1 1 3 LYS CD C -5.689 4.965 -2.547 1.00 . A A . 3 LYS CD 1 1 3 926 1 1 3 LYS CE C -6.884 5.897 -2.294 1.00 . A A . 3 LYS CE 1 1 3 927 1 1 3 LYS CG C -5.861 4.241 -3.890 1.00 . A A . 3 LYS CG 1 1 3 928 1 1 3 LYS H H -5.603 1.176 -3.523 1.00 . A A . 3 LYS H 1 1 3 929 1 1 3 LYS HA H -5.190 2.651 -6.120 1.00 . A A . 3 LYS HA 1 1 3 930 1 1 3 LYS HB2 H -3.989 3.280 -3.401 1.00 . A A . 3 LYS HB2 1 1 3 931 1 1 3 LYS HB3 H -3.941 4.279 -4.847 1.00 . A A . 3 LYS HB3 1 1 3 932 1 1 3 LYS HD2 H -5.628 4.235 -1.753 1.00 . A A . 3 LYS HD2 1 1 3 933 1 1 3 LYS HD3 H -4.781 5.550 -2.567 1.00 . A A . 3 LYS HD3 1 1 3 934 1 1 3 LYS HE2 H -6.776 6.387 -1.336 1.00 . A A . 3 LYS HE2 1 1 3 935 1 1 3 LYS HE3 H -6.961 6.635 -3.081 1.00 . A A . 3 LYS HE3 1 1 3 936 1 1 3 LYS HG2 H -6.146 4.953 -4.650 1.00 . A A . 3 LYS HG2 1 1 3 937 1 1 3 LYS HG3 H -6.629 3.489 -3.793 1.00 . A A . 3 LYS HG3 1 1 3 938 1 1 3 LYS HZ1 H -7.818 4.018 -2.158 1.00 . A A . 3 LYS HZ1 1 1 3 939 1 1 3 LYS HZ2 H -8.594 5.111 -3.205 1.00 . A A . 3 LYS HZ2 1 1 3 940 1 1 3 LYS HZ3 H -8.735 5.302 -1.527 1.00 . A A . 3 LYS HZ3 1 1 3 941 1 1 3 LYS N N -5.809 1.514 -4.424 1.00 . A A . 3 LYS N 1 1 3 942 1 1 3 LYS NZ N -8.098 5.019 -2.298 1.00 . A A . 3 LYS NZ 1 1 3 943 1 1 3 LYS O O -3.390 0.390 -5.058 1.00 . A A . 3 LYS O 1 1 3 944 1 1 4 LEU C C -0.213 1.864 -5.023 1.00 . A A . 4 LEU C 1 1 3 945 1 1 4 LEU CA C -1.190 1.550 -6.174 1.00 . A A . 4 LEU CA 1 1 3 946 1 1 4 LEU CB C -0.698 2.146 -7.515 1.00 . A A . 4 LEU CB 1 1 3 947 1 1 4 LEU CD1 C -1.618 0.090 -8.620 1.00 . A A . 4 LEU CD1 1 1 3 948 1 1 4 LEU CD2 C -2.931 2.215 -8.653 1.00 . A A . 4 LEU CD2 1 1 3 949 1 1 4 LEU CG C -1.527 1.613 -8.693 1.00 . A A . 4 LEU CG 1 1 3 950 1 1 4 LEU H H -2.623 3.153 -6.165 1.00 . A A . 4 LEU H 1 1 3 951 1 1 4 LEU HA H -1.321 0.487 -6.271 1.00 . A A . 4 LEU HA 1 1 3 952 1 1 4 LEU HB2 H -0.792 3.218 -7.481 1.00 . A A . 4 LEU HB2 1 1 3 953 1 1 4 LEU HB3 H 0.334 1.886 -7.671 1.00 . A A . 4 LEU HB3 1 1 3 954 1 1 4 LEU HD11 H -0.663 -0.312 -8.313 1.00 . A A . 4 LEU HD11 1 1 3 955 1 1 4 LEU HD12 H -1.876 -0.301 -9.593 1.00 . A A . 4 LEU HD12 1 1 3 956 1 1 4 LEU HD13 H -2.375 -0.193 -7.904 1.00 . A A . 4 LEU HD13 1 1 3 957 1 1 4 LEU HD21 H -2.896 3.162 -8.143 1.00 . A A . 4 LEU HD21 1 1 3 958 1 1 4 LEU HD22 H -3.595 1.545 -8.131 1.00 . A A . 4 LEU HD22 1 1 3 959 1 1 4 LEU HD23 H -3.287 2.362 -9.663 1.00 . A A . 4 LEU HD23 1 1 3 960 1 1 4 LEU HG H -1.047 1.892 -9.622 1.00 . A A . 4 LEU HG 1 1 3 961 1 1 4 LEU N N -2.501 2.216 -5.920 1.00 . A A . 4 LEU N 1 1 3 962 1 1 4 LEU O O -0.595 1.905 -3.869 1.00 . A A . 4 LEU O 1 1 3 963 1 1 5 THR C C 1.983 3.838 -3.816 1.00 . A A . 5 THR C 1 1 3 964 1 1 5 THR CA C 2.052 2.362 -4.262 1.00 . A A . 5 THR CA 1 1 3 965 1 1 5 THR CB C 3.424 2.039 -4.892 1.00 . A A . 5 THR CB 1 1 3 966 1 1 5 THR CG2 C 4.303 1.339 -3.858 1.00 . A A . 5 THR CG2 1 1 3 967 1 1 5 THR H H 1.331 2.015 -6.250 1.00 . A A . 5 THR H 1 1 3 968 1 1 5 THR HA H 1.885 1.715 -3.414 1.00 . A A . 5 THR HA 1 1 3 969 1 1 5 THR HB H 3.904 2.950 -5.199 1.00 . A A . 5 THR HB 1 1 3 970 1 1 5 THR HG1 H 3.976 1.355 -6.641 1.00 . A A . 5 THR HG1 1 1 3 971 1 1 5 THR HG21 H 3.703 1.057 -3.003 1.00 . A A . 5 THR HG21 1 1 3 972 1 1 5 THR HG22 H 5.082 2.014 -3.534 1.00 . A A . 5 THR HG22 1 1 3 973 1 1 5 THR HG23 H 4.751 0.459 -4.295 1.00 . A A . 5 THR HG23 1 1 3 974 1 1 5 THR N N 1.044 2.071 -5.326 1.00 . A A . 5 THR N 1 1 3 975 1 1 5 THR O O 1.491 4.143 -2.748 1.00 . A A . 5 THR O 1 1 3 976 1 1 5 THR OG1 O 3.254 1.184 -6.019 1.00 . A A . 5 THR OG1 1 1 3 977 1 1 6 PHE C C 1.048 6.825 -4.307 1.00 . A A . 6 PHE C 1 1 3 978 1 1 6 PHE CA C 2.458 6.205 -4.226 1.00 . A A . 6 PHE CA 1 1 3 979 1 1 6 PHE CB C 3.411 6.900 -5.213 1.00 . A A . 6 PHE CB 1 1 3 980 1 1 6 PHE CD1 C 5.280 6.764 -3.521 1.00 . A A . 6 PHE CD1 1 1 3 981 1 1 6 PHE CD2 C 4.890 8.867 -4.663 1.00 . A A . 6 PHE CD2 1 1 3 982 1 1 6 PHE CE1 C 6.337 7.346 -2.810 1.00 . A A . 6 PHE CE1 1 1 3 983 1 1 6 PHE CE2 C 5.947 9.447 -3.953 1.00 . A A . 6 PHE CE2 1 1 3 984 1 1 6 PHE CG C 4.557 7.524 -4.450 1.00 . A A . 6 PHE CG 1 1 3 985 1 1 6 PHE CZ C 6.669 8.688 -3.025 1.00 . A A . 6 PHE CZ 1 1 3 986 1 1 6 PHE H H 2.866 4.493 -5.467 1.00 . A A . 6 PHE H 1 1 3 987 1 1 6 PHE HA H 2.842 6.315 -3.225 1.00 . A A . 6 PHE HA 1 1 3 988 1 1 6 PHE HB2 H 3.799 6.179 -5.916 1.00 . A A . 6 PHE HB2 1 1 3 989 1 1 6 PHE HB3 H 2.877 7.672 -5.748 1.00 . A A . 6 PHE HB3 1 1 3 990 1 1 6 PHE HD1 H 5.029 5.728 -3.355 1.00 . A A . 6 PHE HD1 1 1 3 991 1 1 6 PHE HD2 H 4.335 9.453 -5.378 1.00 . A A . 6 PHE HD2 1 1 3 992 1 1 6 PHE HE1 H 6.894 6.758 -2.094 1.00 . A A . 6 PHE HE1 1 1 3 993 1 1 6 PHE HE2 H 6.202 10.484 -4.121 1.00 . A A . 6 PHE HE2 1 1 3 994 1 1 6 PHE HZ H 7.484 9.140 -2.474 1.00 . A A . 6 PHE HZ 1 1 3 995 1 1 6 PHE N N 2.472 4.755 -4.618 1.00 . A A . 6 PHE N 1 1 3 996 1 1 6 PHE O O 0.890 7.969 -4.692 1.00 . A A . 6 PHE O 1 1 3 997 1 1 7 TRP C C -1.783 6.887 -2.485 1.00 . A A . 7 TRP C 1 1 3 998 1 1 7 TRP CA C -1.344 6.671 -3.934 1.00 . A A . 7 TRP CA 1 1 3 999 1 1 7 TRP CB C -2.219 5.609 -4.599 1.00 . A A . 7 TRP CB 1 1 3 1000 1 1 7 TRP CD1 C -0.661 5.364 -6.573 1.00 . A A . 7 TRP CD1 1 1 3 1001 1 1 7 TRP CD2 C -2.814 5.564 -7.185 1.00 . A A . 7 TRP CD2 1 1 3 1002 1 1 7 TRP CE2 C -2.060 5.444 -8.378 1.00 . A A . 7 TRP CE2 1 1 3 1003 1 1 7 TRP CE3 C -4.208 5.705 -7.287 1.00 . A A . 7 TRP CE3 1 1 3 1004 1 1 7 TRP CG C -1.901 5.517 -6.055 1.00 . A A . 7 TRP CG 1 1 3 1005 1 1 7 TRP CH2 C -4.065 5.598 -9.724 1.00 . A A . 7 TRP CH2 1 1 3 1006 1 1 7 TRP CZ2 C -2.673 5.460 -9.636 1.00 . A A . 7 TRP CZ2 1 1 3 1007 1 1 7 TRP CZ3 C -4.833 5.721 -8.550 1.00 . A A . 7 TRP CZ3 1 1 3 1008 1 1 7 TRP H H 0.166 5.195 -3.577 1.00 . A A . 7 TRP H 1 1 3 1009 1 1 7 TRP HA H -1.369 7.590 -4.491 1.00 . A A . 7 TRP HA 1 1 3 1010 1 1 7 TRP HB2 H -2.041 4.654 -4.130 1.00 . A A . 7 TRP HB2 1 1 3 1011 1 1 7 TRP HB3 H -3.251 5.881 -4.476 1.00 . A A . 7 TRP HB3 1 1 3 1012 1 1 7 TRP HD1 H 0.250 5.285 -6.001 1.00 . A A . 7 TRP HD1 1 1 3 1013 1 1 7 TRP HE1 H 0.003 5.228 -8.564 1.00 . A A . 7 TRP HE1 1 1 3 1014 1 1 7 TRP HE3 H -4.805 5.796 -6.387 1.00 . A A . 7 TRP HE3 1 1 3 1015 1 1 7 TRP HH2 H -4.549 5.612 -10.693 1.00 . A A . 7 TRP HH2 1 1 3 1016 1 1 7 TRP HZ2 H -2.074 5.356 -10.537 1.00 . A A . 7 TRP HZ2 1 1 3 1017 1 1 7 TRP HZ3 H -5.906 5.828 -8.617 1.00 . A A . 7 TRP HZ3 1 1 3 1018 1 1 7 TRP N N 0.029 6.102 -3.915 1.00 . A A . 7 TRP N 1 1 3 1019 1 1 7 TRP NE1 N -0.754 5.326 -7.950 1.00 . A A . 7 TRP NE1 1 1 3 1020 1 1 7 TRP O O -1.916 5.933 -1.742 1.00 . A A . 7 TRP O 1 1 3 1021 1 1 8 LYS C C -3.319 7.322 -0.119 1.00 . A A . 8 LYS C 1 1 3 1022 1 1 8 LYS CA C -2.386 8.416 -0.659 1.00 . A A . 8 LYS CA 1 1 3 1023 1 1 8 LYS CB C -3.123 9.760 -0.725 1.00 . A A . 8 LYS CB 1 1 3 1024 1 1 8 LYS CD C -1.705 11.606 0.207 1.00 . A A . 8 LYS CD 1 1 3 1025 1 1 8 LYS CE C -2.103 13.086 0.118 1.00 . A A . 8 LYS CE 1 1 3 1026 1 1 8 LYS CG C -2.134 10.880 -1.072 1.00 . A A . 8 LYS CG 1 1 3 1027 1 1 8 LYS H H -1.834 8.862 -2.699 1.00 . A A . 8 LYS H 1 1 3 1028 1 1 8 LYS HA H -1.513 8.507 -0.027 1.00 . A A . 8 LYS HA 1 1 3 1029 1 1 8 LYS HB2 H -3.888 9.711 -1.487 1.00 . A A . 8 LYS HB2 1 1 3 1030 1 1 8 LYS HB3 H -3.580 9.969 0.231 1.00 . A A . 8 LYS HB3 1 1 3 1031 1 1 8 LYS HD2 H -2.191 11.148 1.058 1.00 . A A . 8 LYS HD2 1 1 3 1032 1 1 8 LYS HD3 H -0.634 11.526 0.319 1.00 . A A . 8 LYS HD3 1 1 3 1033 1 1 8 LYS HE2 H -1.509 13.589 -0.634 1.00 . A A . 8 LYS HE2 1 1 3 1034 1 1 8 LYS HE3 H -3.154 13.179 -0.107 1.00 . A A . 8 LYS HE3 1 1 3 1035 1 1 8 LYS HG2 H -1.264 10.454 -1.553 1.00 . A A . 8 LYS HG2 1 1 3 1036 1 1 8 LYS HG3 H -2.608 11.580 -1.741 1.00 . A A . 8 LYS HG3 1 1 3 1037 1 1 8 LYS HZ1 H -2.232 14.602 1.541 1.00 . A A . 8 LYS HZ1 1 1 3 1038 1 1 8 LYS HZ2 H -0.790 13.705 1.619 1.00 . A A . 8 LYS HZ2 1 1 3 1039 1 1 8 LYS HZ3 H -2.242 13.042 2.197 1.00 . A A . 8 LYS HZ3 1 1 3 1040 1 1 8 LYS N N -1.977 8.121 -2.076 1.00 . A A . 8 LYS N 1 1 3 1041 1 1 8 LYS NZ N -1.819 13.650 1.468 1.00 . A A . 8 LYS NZ 1 1 3 1042 1 1 8 LYS O O -4.496 7.291 -0.422 1.00 . A A . 8 LYS O 1 1 3 1043 1 1 9 CYS C C -3.817 5.452 2.734 1.00 . A A . 9 CYS C 1 1 3 1044 1 1 9 CYS CA C -3.650 5.317 1.216 1.00 . A A . 9 CYS CA 1 1 3 1045 1 1 9 CYS CB C -2.934 4.000 0.873 1.00 . A A . 9 CYS CB 1 1 3 1046 1 1 9 CYS H H -1.831 6.458 0.885 1.00 . A A . 9 CYS H 1 1 3 1047 1 1 9 CYS HA H -4.616 5.335 0.739 1.00 . A A . 9 CYS HA 1 1 3 1048 1 1 9 CYS HB2 H -3.349 3.206 1.473 1.00 . A A . 9 CYS HB2 1 1 3 1049 1 1 9 CYS HB3 H -3.090 3.773 -0.174 1.00 . A A . 9 CYS HB3 1 1 3 1050 1 1 9 CYS N N -2.793 6.418 0.668 1.00 . A A . 9 CYS N 1 1 3 1051 1 1 9 CYS O O -3.017 6.077 3.406 1.00 . A A . 9 CYS O 1 1 3 1052 1 1 9 CYS SG S -1.151 4.124 1.197 1.00 . A A . 9 CYS SG 1 1 3 1053 1 1 10 LYS C C -4.533 3.658 5.408 1.00 . A A . 10 LYS C 1 1 3 1054 1 1 10 LYS CA C -5.068 4.935 4.752 1.00 . A A . 10 LYS CA 1 1 3 1055 1 1 10 LYS CB C -6.587 5.045 4.920 1.00 . A A . 10 LYS CB 1 1 3 1056 1 1 10 LYS CD C -6.490 6.584 6.902 1.00 . A A . 10 LYS CD 1 1 3 1057 1 1 10 LYS CE C -5.487 6.414 8.055 1.00 . A A . 10 LYS CE 1 1 3 1058 1 1 10 LYS CG C -6.941 5.205 6.401 1.00 . A A . 10 LYS CG 1 1 3 1059 1 1 10 LYS H H -5.479 4.359 2.719 1.00 . A A . 10 LYS H 1 1 3 1060 1 1 10 LYS HA H -4.584 5.808 5.164 1.00 . A A . 10 LYS HA 1 1 3 1061 1 1 10 LYS HB2 H -6.948 5.904 4.372 1.00 . A A . 10 LYS HB2 1 1 3 1062 1 1 10 LYS HB3 H -7.054 4.152 4.536 1.00 . A A . 10 LYS HB3 1 1 3 1063 1 1 10 LYS HD2 H -6.020 7.126 6.092 1.00 . A A . 10 LYS HD2 1 1 3 1064 1 1 10 LYS HD3 H -7.348 7.139 7.252 1.00 . A A . 10 LYS HD3 1 1 3 1065 1 1 10 LYS HE2 H -4.786 5.622 7.826 1.00 . A A . 10 LYS HE2 1 1 3 1066 1 1 10 LYS HE3 H -4.960 7.340 8.232 1.00 . A A . 10 LYS HE3 1 1 3 1067 1 1 10 LYS HG2 H -8.010 5.110 6.518 1.00 . A A . 10 LYS HG2 1 1 3 1068 1 1 10 LYS HG3 H -6.447 4.433 6.975 1.00 . A A . 10 LYS HG3 1 1 3 1069 1 1 10 LYS HZ1 H -7.121 5.474 8.959 1.00 . A A . 10 LYS HZ1 1 1 3 1070 1 1 10 LYS HZ2 H -6.655 6.924 9.705 1.00 . A A . 10 LYS HZ2 1 1 3 1071 1 1 10 LYS HZ3 H -5.729 5.517 9.922 1.00 . A A . 10 LYS HZ3 1 1 3 1072 1 1 10 LYS N N -4.850 4.860 3.278 1.00 . A A . 10 LYS N 1 1 3 1073 1 1 10 LYS NZ N -6.310 6.057 9.247 1.00 . A A . 10 LYS NZ 1 1 3 1074 1 1 10 LYS O O -3.893 3.698 6.442 1.00 . A A . 10 LYS O 1 1 3 1075 1 1 11 ASN C C -3.535 0.448 4.276 1.00 . A A . 11 ASN C 1 1 3 1076 1 1 11 ASN CA C -4.286 1.231 5.365 1.00 . A A . 11 ASN CA 1 1 3 1077 1 1 11 ASN CB C -5.534 0.471 5.830 1.00 . A A . 11 ASN CB 1 1 3 1078 1 1 11 ASN CG C -6.519 0.311 4.671 1.00 . A A . 11 ASN CG 1 1 3 1079 1 1 11 ASN H H -5.294 2.524 3.960 1.00 . A A . 11 ASN H 1 1 3 1080 1 1 11 ASN HA H -3.638 1.419 6.205 1.00 . A A . 11 ASN HA 1 1 3 1081 1 1 11 ASN HB2 H -5.250 -0.505 6.191 1.00 . A A . 11 ASN HB2 1 1 3 1082 1 1 11 ASN HB3 H -6.007 1.020 6.630 1.00 . A A . 11 ASN HB3 1 1 3 1083 1 1 11 ASN HD21 H -6.114 -1.606 4.386 1.00 . A A . 11 ASN HD21 1 1 3 1084 1 1 11 ASN HD22 H -7.270 -0.941 3.342 1.00 . A A . 11 ASN HD22 1 1 3 1085 1 1 11 ASN N N -4.783 2.524 4.801 1.00 . A A . 11 ASN N 1 1 3 1086 1 1 11 ASN ND2 N -6.641 -0.841 4.084 1.00 . A A . 11 ASN ND2 1 1 3 1087 1 1 11 ASN O O -3.733 0.666 3.097 1.00 . A A . 11 ASN O 1 1 3 1088 1 1 11 ASN OD1 O -7.194 1.248 4.299 1.00 . A A . 11 ASN OD1 1 1 3 1089 1 1 12 LYS C C -2.800 -2.076 2.744 1.00 . A A . 12 LYS C 1 1 3 1090 1 1 12 LYS CA C -1.880 -1.234 3.650 1.00 . A A . 12 LYS CA 1 1 3 1091 1 1 12 LYS CB C -0.935 -2.131 4.468 1.00 . A A . 12 LYS CB 1 1 3 1092 1 1 12 LYS CD C -0.779 -3.604 6.493 1.00 . A A . 12 LYS CD 1 1 3 1093 1 1 12 LYS CE C -1.460 -3.566 7.869 1.00 . A A . 12 LYS CE 1 1 3 1094 1 1 12 LYS CG C -1.726 -3.038 5.423 1.00 . A A . 12 LYS CG 1 1 3 1095 1 1 12 LYS H H -2.507 -0.602 5.617 1.00 . A A . 12 LYS H 1 1 3 1096 1 1 12 LYS HA H -1.296 -0.562 3.047 1.00 . A A . 12 LYS HA 1 1 3 1097 1 1 12 LYS HB2 H -0.360 -2.744 3.794 1.00 . A A . 12 LYS HB2 1 1 3 1098 1 1 12 LYS HB3 H -0.261 -1.510 5.043 1.00 . A A . 12 LYS HB3 1 1 3 1099 1 1 12 LYS HD2 H -0.524 -4.624 6.244 1.00 . A A . 12 LYS HD2 1 1 3 1100 1 1 12 LYS HD3 H 0.123 -3.009 6.527 1.00 . A A . 12 LYS HD3 1 1 3 1101 1 1 12 LYS HE2 H -0.980 -2.830 8.503 1.00 . A A . 12 LYS HE2 1 1 3 1102 1 1 12 LYS HE3 H -2.511 -3.343 7.766 1.00 . A A . 12 LYS HE3 1 1 3 1103 1 1 12 LYS HG2 H -2.512 -2.469 5.900 1.00 . A A . 12 LYS HG2 1 1 3 1104 1 1 12 LYS HG3 H -2.160 -3.854 4.866 1.00 . A A . 12 LYS HG3 1 1 3 1105 1 1 12 LYS HZ1 H -1.715 -5.635 7.803 1.00 . A A . 12 LYS HZ1 1 1 3 1106 1 1 12 LYS HZ2 H -1.737 -4.982 9.370 1.00 . A A . 12 LYS HZ2 1 1 3 1107 1 1 12 LYS HZ3 H -0.267 -5.142 8.537 1.00 . A A . 12 LYS HZ3 1 1 3 1108 1 1 12 LYS N N -2.662 -0.451 4.661 1.00 . A A . 12 LYS N 1 1 3 1109 1 1 12 LYS NZ N -1.282 -4.933 8.435 1.00 . A A . 12 LYS NZ 1 1 3 1110 1 1 12 LYS O O -2.527 -2.246 1.573 1.00 . A A . 12 LYS O 1 1 3 1111 1 1 13 LYS C C -5.600 -2.553 1.422 1.00 . A A . 13 LYS C 1 1 3 1112 1 1 13 LYS CA C -4.803 -3.430 2.413 1.00 . A A . 13 LYS CA 1 1 3 1113 1 1 13 LYS CB C -5.749 -4.136 3.399 1.00 . A A . 13 LYS CB 1 1 3 1114 1 1 13 LYS CD C -6.538 -6.510 3.593 1.00 . A A . 13 LYS CD 1 1 3 1115 1 1 13 LYS CE C -7.954 -7.107 3.602 1.00 . A A . 13 LYS CE 1 1 3 1116 1 1 13 LYS CG C -6.496 -5.274 2.688 1.00 . A A . 13 LYS CG 1 1 3 1117 1 1 13 LYS H H -4.090 -2.452 4.212 1.00 . A A . 13 LYS H 1 1 3 1118 1 1 13 LYS HA H -4.233 -4.166 1.871 1.00 . A A . 13 LYS HA 1 1 3 1119 1 1 13 LYS HB2 H -5.175 -4.542 4.219 1.00 . A A . 13 LYS HB2 1 1 3 1120 1 1 13 LYS HB3 H -6.467 -3.427 3.781 1.00 . A A . 13 LYS HB3 1 1 3 1121 1 1 13 LYS HD2 H -5.838 -7.247 3.227 1.00 . A A . 13 LYS HD2 1 1 3 1122 1 1 13 LYS HD3 H -6.266 -6.227 4.600 1.00 . A A . 13 LYS HD3 1 1 3 1123 1 1 13 LYS HE2 H -8.006 -7.934 4.298 1.00 . A A . 13 LYS HE2 1 1 3 1124 1 1 13 LYS HE3 H -8.680 -6.351 3.863 1.00 . A A . 13 LYS HE3 1 1 3 1125 1 1 13 LYS HG2 H -7.503 -4.957 2.467 1.00 . A A . 13 LYS HG2 1 1 3 1126 1 1 13 LYS HG3 H -5.984 -5.522 1.769 1.00 . A A . 13 LYS HG3 1 1 3 1127 1 1 13 LYS HZ1 H -8.444 -6.784 1.598 1.00 . A A . 13 LYS HZ1 1 1 3 1128 1 1 13 LYS HZ2 H -8.981 -8.271 2.212 1.00 . A A . 13 LYS HZ2 1 1 3 1129 1 1 13 LYS HZ3 H -7.342 -8.049 1.841 1.00 . A A . 13 LYS HZ3 1 1 3 1130 1 1 13 LYS N N -3.884 -2.600 3.266 1.00 . A A . 13 LYS N 1 1 3 1131 1 1 13 LYS NZ N -8.195 -7.588 2.209 1.00 . A A . 13 LYS NZ 1 1 3 1132 1 1 13 LYS O O -6.358 -3.063 0.618 1.00 . A A . 13 LYS O 1 1 3 1133 1 1 14 GLU C C -5.471 -0.344 -0.862 1.00 . A A . 14 GLU C 1 1 3 1134 1 1 14 GLU CA C -6.188 -0.373 0.501 1.00 . A A . 14 GLU CA 1 1 3 1135 1 1 14 GLU CB C -6.216 1.012 1.177 1.00 . A A . 14 GLU CB 1 1 3 1136 1 1 14 GLU CD C -7.479 2.392 -0.520 1.00 . A A . 14 GLU CD 1 1 3 1137 1 1 14 GLU CG C -6.119 2.150 0.149 1.00 . A A . 14 GLU CG 1 1 3 1138 1 1 14 GLU H H -4.821 -0.850 2.101 1.00 . A A . 14 GLU H 1 1 3 1139 1 1 14 GLU HA H -7.197 -0.737 0.377 1.00 . A A . 14 GLU HA 1 1 3 1140 1 1 14 GLU HB2 H -7.137 1.117 1.729 1.00 . A A . 14 GLU HB2 1 1 3 1141 1 1 14 GLU HB3 H -5.386 1.088 1.864 1.00 . A A . 14 GLU HB3 1 1 3 1142 1 1 14 GLU HG2 H -5.806 3.051 0.650 1.00 . A A . 14 GLU HG2 1 1 3 1143 1 1 14 GLU HG3 H -5.391 1.891 -0.604 1.00 . A A . 14 GLU HG3 1 1 3 1144 1 1 14 GLU N N -5.439 -1.250 1.456 1.00 . A A . 14 GLU N 1 1 3 1145 1 1 14 GLU O O -6.066 -0.031 -1.872 1.00 . A A . 14 GLU O 1 1 3 1146 1 1 14 GLU OE1 O -8.472 2.441 0.182 1.00 . A A . 14 GLU OE1 1 1 3 1147 1 1 14 GLU OE2 O -7.500 2.560 -1.727 1.00 . A A . 14 GLU OE2 1 1 3 1148 1 1 15 CYS C C -3.701 -2.016 -2.924 1.00 . A A . 15 CYS C 1 1 3 1149 1 1 15 CYS CA C -3.490 -0.672 -2.220 1.00 . A A . 15 CYS CA 1 1 3 1150 1 1 15 CYS CB C -2.015 -0.446 -1.882 1.00 . A A . 15 CYS CB 1 1 3 1151 1 1 15 CYS H H -3.731 -0.939 -0.088 1.00 . A A . 15 CYS H 1 1 3 1152 1 1 15 CYS HA H -3.853 0.134 -2.836 1.00 . A A . 15 CYS HA 1 1 3 1153 1 1 15 CYS HB2 H -1.662 -1.257 -1.262 1.00 . A A . 15 CYS HB2 1 1 3 1154 1 1 15 CYS HB3 H -1.441 -0.414 -2.795 1.00 . A A . 15 CYS HB3 1 1 3 1155 1 1 15 CYS N N -4.205 -0.676 -0.908 1.00 . A A . 15 CYS N 1 1 3 1156 1 1 15 CYS O O -3.503 -3.065 -2.340 1.00 . A A . 15 CYS O 1 1 3 1157 1 1 15 CYS SG S -1.835 1.126 -0.994 1.00 . A A . 15 CYS SG 1 1 3 1158 1 1 16 CYS C C -3.147 -4.195 -4.806 1.00 . A A . 16 CYS C 1 1 3 1159 1 1 16 CYS CA C -4.365 -3.276 -4.914 1.00 . A A . 16 CYS CA 1 1 3 1160 1 1 16 CYS CB C -4.607 -2.866 -6.373 1.00 . A A . 16 CYS CB 1 1 3 1161 1 1 16 CYS H H -4.284 -1.133 -4.610 1.00 . A A . 16 CYS H 1 1 3 1162 1 1 16 CYS HA H -5.239 -3.772 -4.526 1.00 . A A . 16 CYS HA 1 1 3 1163 1 1 16 CYS HB2 H -3.979 -2.024 -6.620 1.00 . A A . 16 CYS HB2 1 1 3 1164 1 1 16 CYS HB3 H -4.363 -3.694 -7.022 1.00 . A A . 16 CYS HB3 1 1 3 1165 1 1 16 CYS N N -4.121 -1.995 -4.166 1.00 . A A . 16 CYS N 1 1 3 1166 1 1 16 CYS O O -3.233 -5.286 -4.279 1.00 . A A . 16 CYS O 1 1 3 1167 1 1 16 CYS SG S -6.350 -2.406 -6.608 1.00 . A A . 16 CYS SG 1 1 3 1168 1 1 17 GLY C C -0.341 -4.588 -3.717 1.00 . A A . 17 GLY C 1 1 3 1169 1 1 17 GLY CA C -0.788 -4.599 -5.173 1.00 . A A . 17 GLY CA 1 1 3 1170 1 1 17 GLY H H -1.958 -2.864 -5.682 1.00 . A A . 17 GLY H 1 1 3 1171 1 1 17 GLY HA2 H -1.013 -5.610 -5.481 1.00 . A A . 17 GLY HA2 1 1 3 1172 1 1 17 GLY HA3 H -0.005 -4.192 -5.791 1.00 . A A . 17 GLY HA3 1 1 3 1173 1 1 17 GLY N N -2.010 -3.754 -5.279 1.00 . A A . 17 GLY N 1 1 3 1174 1 1 17 GLY O O 0.222 -3.616 -3.256 1.00 . A A . 17 GLY O 1 1 3 1175 1 1 18 TRP C C 1.018 -4.948 -1.232 1.00 . A A . 18 TRP C 1 1 3 1176 1 1 18 TRP CA C -0.264 -5.728 -1.536 1.00 . A A . 18 TRP CA 1 1 3 1177 1 1 18 TRP CB C -0.077 -7.218 -1.243 1.00 . A A . 18 TRP CB 1 1 3 1178 1 1 18 TRP CD1 C -2.199 -7.209 0.158 1.00 . A A . 18 TRP CD1 1 1 3 1179 1 1 18 TRP CD2 C -1.984 -9.073 -1.088 1.00 . A A . 18 TRP CD2 1 1 3 1180 1 1 18 TRP CE2 C -3.193 -9.203 -0.368 1.00 . A A . 18 TRP CE2 1 1 3 1181 1 1 18 TRP CE3 C -1.611 -10.118 -1.957 1.00 . A A . 18 TRP CE3 1 1 3 1182 1 1 18 TRP CG C -1.366 -7.800 -0.739 1.00 . A A . 18 TRP CG 1 1 3 1183 1 1 18 TRP CH2 C -3.623 -11.357 -1.363 1.00 . A A . 18 TRP CH2 1 1 3 1184 1 1 18 TRP CZ2 C -4.008 -10.329 -0.500 1.00 . A A . 18 TRP CZ2 1 1 3 1185 1 1 18 TRP CZ3 C -2.429 -11.252 -2.089 1.00 . A A . 18 TRP CZ3 1 1 3 1186 1 1 18 TRP H H -1.116 -6.386 -3.400 1.00 . A A . 18 TRP H 1 1 3 1187 1 1 18 TRP HA H -1.076 -5.345 -0.939 1.00 . A A . 18 TRP HA 1 1 3 1188 1 1 18 TRP HB2 H 0.219 -7.729 -2.148 1.00 . A A . 18 TRP HB2 1 1 3 1189 1 1 18 TRP HB3 H 0.691 -7.341 -0.493 1.00 . A A . 18 TRP HB3 1 1 3 1190 1 1 18 TRP HD1 H -2.043 -6.245 0.624 1.00 . A A . 18 TRP HD1 1 1 3 1191 1 1 18 TRP HE1 H -4.027 -7.854 0.979 1.00 . A A . 18 TRP HE1 1 1 3 1192 1 1 18 TRP HE3 H -0.693 -10.047 -2.522 1.00 . A A . 18 TRP HE3 1 1 3 1193 1 1 18 TRP HH2 H -4.247 -12.232 -1.467 1.00 . A A . 18 TRP HH2 1 1 3 1194 1 1 18 TRP HZ2 H -4.924 -10.408 0.063 1.00 . A A . 18 TRP HZ2 1 1 3 1195 1 1 18 TRP HZ3 H -2.136 -12.052 -2.754 1.00 . A A . 18 TRP HZ3 1 1 3 1196 1 1 18 TRP N N -0.629 -5.647 -2.990 1.00 . A A . 18 TRP N 1 1 3 1197 1 1 18 TRP NE1 N -3.281 -8.043 0.376 1.00 . A A . 18 TRP NE1 1 1 3 1198 1 1 18 TRP O O 2.122 -5.392 -1.503 1.00 . A A . 18 TRP O 1 1 3 1199 1 1 19 ASN C C 1.794 -2.277 1.040 1.00 . A A . 19 ASN C 1 1 3 1200 1 1 19 ASN CA C 2.018 -2.910 -0.343 1.00 . A A . 19 ASN CA 1 1 3 1201 1 1 19 ASN CB C 2.026 -1.855 -1.452 1.00 . A A . 19 ASN CB 1 1 3 1202 1 1 19 ASN CG C 3.166 -0.868 -1.224 1.00 . A A . 19 ASN CG 1 1 3 1203 1 1 19 ASN H H -0.055 -3.464 -0.494 1.00 . A A . 19 ASN H 1 1 3 1204 1 1 19 ASN HA H 2.939 -3.470 -0.360 1.00 . A A . 19 ASN HA 1 1 3 1205 1 1 19 ASN HB2 H 2.161 -2.341 -2.408 1.00 . A A . 19 ASN HB2 1 1 3 1206 1 1 19 ASN HB3 H 1.087 -1.323 -1.449 1.00 . A A . 19 ASN HB3 1 1 3 1207 1 1 19 ASN HD21 H 4.351 -1.661 -2.598 1.00 . A A . 19 ASN HD21 1 1 3 1208 1 1 19 ASN HD22 H 4.970 -0.303 -1.799 1.00 . A A . 19 ASN HD22 1 1 3 1209 1 1 19 ASN N N 0.855 -3.779 -0.683 1.00 . A A . 19 ASN N 1 1 3 1210 1 1 19 ASN ND2 N 4.253 -0.956 -1.928 1.00 . A A . 19 ASN ND2 1 1 3 1211 1 1 19 ASN O O 0.709 -2.344 1.593 1.00 . A A . 19 ASN O 1 1 3 1212 1 1 19 ASN OD1 O 3.067 -0.011 -0.382 1.00 . A A . 19 ASN OD1 1 1 3 1213 1 1 20 ALA C C 2.419 0.428 2.888 1.00 . A A . 20 ALA C 1 1 3 1214 1 1 20 ALA CA C 2.654 -1.080 2.971 1.00 . A A . 20 ALA CA 1 1 3 1215 1 1 20 ALA CB C 3.983 -1.348 3.678 1.00 . A A . 20 ALA CB 1 1 3 1216 1 1 20 ALA H H 3.674 -1.651 1.160 1.00 . A A . 20 ALA H 1 1 3 1217 1 1 20 ALA HA H 1.849 -1.562 3.510 1.00 . A A . 20 ALA HA 1 1 3 1218 1 1 20 ALA HB1 H 4.753 -0.732 3.231 1.00 . A A . 20 ALA HB1 1 1 3 1219 1 1 20 ALA HB2 H 4.248 -2.389 3.573 1.00 . A A . 20 ALA HB2 1 1 3 1220 1 1 20 ALA HB3 H 3.890 -1.102 4.725 1.00 . A A . 20 ALA HB3 1 1 3 1221 1 1 20 ALA N N 2.808 -1.690 1.615 1.00 . A A . 20 ALA N 1 1 3 1222 1 1 20 ALA O O 3.247 1.169 2.389 1.00 . A A . 20 ALA O 1 1 3 1223 1 1 21 CYS C C 1.893 2.952 4.584 1.00 . A A . 21 CYS C 1 1 3 1224 1 1 21 CYS CA C 1.066 2.368 3.437 1.00 . A A . 21 CYS CA 1 1 3 1225 1 1 21 CYS CB C -0.441 2.524 3.691 1.00 . A A . 21 CYS CB 1 1 3 1226 1 1 21 CYS H H 0.693 0.283 3.861 1.00 . A A . 21 CYS H 1 1 3 1227 1 1 21 CYS HA H 1.343 2.814 2.496 1.00 . A A . 21 CYS HA 1 1 3 1228 1 1 21 CYS HB2 H -0.980 1.792 3.110 1.00 . A A . 21 CYS HB2 1 1 3 1229 1 1 21 CYS HB3 H -0.645 2.370 4.741 1.00 . A A . 21 CYS HB3 1 1 3 1230 1 1 21 CYS N N 1.322 0.896 3.425 1.00 . A A . 21 CYS N 1 1 3 1231 1 1 21 CYS O O 1.546 2.796 5.741 1.00 . A A . 21 CYS O 1 1 3 1232 1 1 21 CYS SG S -0.983 4.185 3.212 1.00 . A A . 21 CYS SG 1 1 3 1233 1 1 22 ALA C C 4.090 5.607 5.270 1.00 . A A . 22 ALA C 1 1 3 1234 1 1 22 ALA CA C 3.894 4.089 5.373 1.00 . A A . 22 ALA CA 1 1 3 1235 1 1 22 ALA CB C 5.227 3.361 5.166 1.00 . A A . 22 ALA CB 1 1 3 1236 1 1 22 ALA H H 3.293 3.630 3.344 1.00 . A A . 22 ALA H 1 1 3 1237 1 1 22 ALA HA H 3.490 3.833 6.340 1.00 . A A . 22 ALA HA 1 1 3 1238 1 1 22 ALA HB1 H 6.009 3.876 5.705 1.00 . A A . 22 ALA HB1 1 1 3 1239 1 1 22 ALA HB2 H 5.468 3.342 4.111 1.00 . A A . 22 ALA HB2 1 1 3 1240 1 1 22 ALA HB3 H 5.143 2.348 5.533 1.00 . A A . 22 ALA HB3 1 1 3 1241 1 1 22 ALA N N 3.014 3.560 4.284 1.00 . A A . 22 ALA N 1 1 3 1242 1 1 22 ALA O O 3.516 6.360 6.029 1.00 . A A . 22 ALA O 1 1 3 1243 1 1 23 LEU C C 3.961 8.250 3.632 1.00 . A A . 23 LEU C 1 1 3 1244 1 1 23 LEU CA C 5.184 7.526 4.220 1.00 . A A . 23 LEU CA 1 1 3 1245 1 1 23 LEU CB C 6.379 7.617 3.257 1.00 . A A . 23 LEU CB 1 1 3 1246 1 1 23 LEU CD1 C 7.515 6.463 5.218 1.00 . A A . 23 LEU CD1 1 1 3 1247 1 1 23 LEU CD2 C 8.673 6.635 3.026 1.00 . A A . 23 LEU CD2 1 1 3 1248 1 1 23 LEU CG C 7.717 7.348 3.983 1.00 . A A . 23 LEU CG 1 1 3 1249 1 1 23 LEU H H 5.380 5.426 3.773 1.00 . A A . 23 LEU H 1 1 3 1250 1 1 23 LEU HA H 5.447 7.953 5.176 1.00 . A A . 23 LEU HA 1 1 3 1251 1 1 23 LEU HB2 H 6.253 6.890 2.465 1.00 . A A . 23 LEU HB2 1 1 3 1252 1 1 23 LEU HB3 H 6.406 8.606 2.823 1.00 . A A . 23 LEU HB3 1 1 3 1253 1 1 23 LEU HD11 H 6.794 6.917 5.878 1.00 . A A . 23 LEU HD11 1 1 3 1254 1 1 23 LEU HD12 H 8.458 6.354 5.734 1.00 . A A . 23 LEU HD12 1 1 3 1255 1 1 23 LEU HD13 H 7.162 5.490 4.910 1.00 . A A . 23 LEU HD13 1 1 3 1256 1 1 23 LEU HD21 H 8.567 5.564 3.138 1.00 . A A . 23 LEU HD21 1 1 3 1257 1 1 23 LEU HD22 H 9.689 6.920 3.252 1.00 . A A . 23 LEU HD22 1 1 3 1258 1 1 23 LEU HD23 H 8.440 6.913 2.008 1.00 . A A . 23 LEU HD23 1 1 3 1259 1 1 23 LEU HG H 8.153 8.288 4.287 1.00 . A A . 23 LEU HG 1 1 3 1260 1 1 23 LEU N N 4.917 6.056 4.359 1.00 . A A . 23 LEU N 1 1 3 1261 1 1 23 LEU O O 4.053 8.916 2.623 1.00 . A A . 23 LEU O 1 1 3 1262 1 1 24 GLY C C 1.092 8.082 2.453 1.00 . A A . 24 GLY C 1 1 3 1263 1 1 24 GLY CA C 1.584 8.790 3.723 1.00 . A A . 24 GLY CA 1 1 3 1264 1 1 24 GLY H H 2.757 7.569 5.065 1.00 . A A . 24 GLY H 1 1 3 1265 1 1 24 GLY HA2 H 0.808 8.763 4.474 1.00 . A A . 24 GLY HA2 1 1 3 1266 1 1 24 GLY HA3 H 1.817 9.817 3.485 1.00 . A A . 24 GLY HA3 1 1 3 1267 1 1 24 GLY N N 2.814 8.116 4.252 1.00 . A A . 24 GLY N 1 1 3 1268 1 1 24 GLY O O 0.100 8.472 1.865 1.00 . A A . 24 GLY O 1 1 3 1269 1 1 25 ILE C C 1.834 4.853 0.890 1.00 . A A . 25 ILE C 1 1 3 1270 1 1 25 ILE CA C 1.346 6.303 0.801 1.00 . A A . 25 ILE CA 1 1 3 1271 1 1 25 ILE CB C 2.026 6.989 -0.398 1.00 . A A . 25 ILE CB 1 1 3 1272 1 1 25 ILE CD1 C 3.425 8.902 -1.206 1.00 . A A . 25 ILE CD1 1 1 3 1273 1 1 25 ILE CG1 C 2.810 8.238 0.027 1.00 . A A . 25 ILE CG1 1 1 3 1274 1 1 25 ILE CG2 C 0.972 7.389 -1.418 1.00 . A A . 25 ILE CG2 1 1 3 1275 1 1 25 ILE H H 2.557 6.740 2.517 1.00 . A A . 25 ILE H 1 1 3 1276 1 1 25 ILE HA H 0.275 6.338 0.691 1.00 . A A . 25 ILE HA 1 1 3 1277 1 1 25 ILE HB H 2.697 6.285 -0.857 1.00 . A A . 25 ILE HB 1 1 3 1278 1 1 25 ILE HD11 H 4.360 8.419 -1.445 1.00 . A A . 25 ILE HD11 1 1 3 1279 1 1 25 ILE HD12 H 3.600 9.947 -1.002 1.00 . A A . 25 ILE HD12 1 1 3 1280 1 1 25 ILE HD13 H 2.746 8.806 -2.040 1.00 . A A . 25 ILE HD13 1 1 3 1281 1 1 25 ILE HG12 H 2.144 8.935 0.515 1.00 . A A . 25 ILE HG12 1 1 3 1282 1 1 25 ILE HG13 H 3.597 7.955 0.709 1.00 . A A . 25 ILE HG13 1 1 3 1283 1 1 25 ILE HG21 H 0.497 6.503 -1.807 1.00 . A A . 25 ILE HG21 1 1 3 1284 1 1 25 ILE HG22 H 1.446 7.927 -2.226 1.00 . A A . 25 ILE HG22 1 1 3 1285 1 1 25 ILE HG23 H 0.234 8.020 -0.947 1.00 . A A . 25 ILE HG23 1 1 3 1286 1 1 25 ILE N N 1.768 7.041 2.028 1.00 . A A . 25 ILE N 1 1 3 1287 1 1 25 ILE O O 2.488 4.467 1.841 1.00 . A A . 25 ILE O 1 1 3 1288 1 1 26 CYS C C 3.480 2.628 -0.631 1.00 . A A . 26 CYS C 1 1 3 1289 1 1 26 CYS CA C 2.055 2.647 -0.082 1.00 . A A . 26 CYS CA 1 1 3 1290 1 1 26 CYS CB C 1.110 1.854 -0.992 1.00 . A A . 26 CYS CB 1 1 3 1291 1 1 26 CYS H H 1.066 4.396 -0.893 1.00 . A A . 26 CYS H 1 1 3 1292 1 1 26 CYS HA H 2.029 2.255 0.920 1.00 . A A . 26 CYS HA 1 1 3 1293 1 1 26 CYS HB2 H 0.592 2.529 -1.651 1.00 . A A . 26 CYS HB2 1 1 3 1294 1 1 26 CYS HB3 H 1.684 1.153 -1.579 1.00 . A A . 26 CYS HB3 1 1 3 1295 1 1 26 CYS N N 1.562 4.059 -0.109 1.00 . A A . 26 CYS N 1 1 3 1296 1 1 26 CYS O O 3.720 3.081 -1.733 1.00 . A A . 26 CYS O 1 1 3 1297 1 1 26 CYS SG S -0.093 0.948 0.018 1.00 . A A . 26 CYS SG 1 1 3 1298 1 1 27 MET C C 6.660 0.945 0.166 1.00 . A A . 27 MET C 1 1 3 1299 1 1 27 MET CA C 5.833 2.111 -0.407 1.00 . A A . 27 MET CA 1 1 3 1300 1 1 27 MET CB C 6.420 3.463 0.005 1.00 . A A . 27 MET CB 1 1 3 1301 1 1 27 MET CE C 8.781 5.472 -0.841 1.00 . A A . 27 MET CE 1 1 3 1302 1 1 27 MET CG C 6.276 4.451 -1.146 1.00 . A A . 27 MET CG 1 1 3 1303 1 1 27 MET H H 4.229 1.755 1.004 1.00 . A A . 27 MET H 1 1 3 1304 1 1 27 MET HA H 5.819 2.046 -1.479 1.00 . A A . 27 MET HA 1 1 3 1305 1 1 27 MET HB2 H 5.890 3.837 0.869 1.00 . A A . 27 MET HB2 1 1 3 1306 1 1 27 MET HB3 H 7.465 3.343 0.247 1.00 . A A . 27 MET HB3 1 1 3 1307 1 1 27 MET HE1 H 9.226 6.337 -1.313 1.00 . A A . 27 MET HE1 1 1 3 1308 1 1 27 MET HE2 H 9.562 4.848 -0.434 1.00 . A A . 27 MET HE2 1 1 3 1309 1 1 27 MET HE3 H 8.125 5.788 -0.043 1.00 . A A . 27 MET HE3 1 1 3 1310 1 1 27 MET HG2 H 5.486 4.124 -1.802 1.00 . A A . 27 MET HG2 1 1 3 1311 1 1 27 MET HG3 H 6.034 5.426 -0.752 1.00 . A A . 27 MET HG3 1 1 3 1312 1 1 27 MET N N 4.433 2.122 0.113 1.00 . A A . 27 MET N 1 1 3 1313 1 1 27 MET O O 6.931 -0.001 -0.544 1.00 . A A . 27 MET O 1 1 3 1314 1 1 27 MET SD S 7.833 4.534 -2.066 1.00 . A A . 27 MET SD 1 1 3 1315 1 1 28 PRO C C 7.065 -1.267 2.362 1.00 . A A . 28 PRO C 1 1 3 1316 1 1 28 PRO CA C 7.899 -0.023 2.030 1.00 . A A . 28 PRO CA 1 1 3 1317 1 1 28 PRO CB C 8.434 0.635 3.300 1.00 . A A . 28 PRO CB 1 1 3 1318 1 1 28 PRO CD C 6.792 2.144 2.361 1.00 . A A . 28 PRO CD 1 1 3 1319 1 1 28 PRO CG C 7.431 1.689 3.642 1.00 . A A . 28 PRO CG 1 1 3 1320 1 1 28 PRO HA H 8.718 -0.288 1.378 1.00 . A A . 28 PRO HA 1 1 3 1321 1 1 28 PRO HB2 H 8.510 -0.091 4.097 1.00 . A A . 28 PRO HB2 1 1 3 1322 1 1 28 PRO HB3 H 9.396 1.090 3.110 1.00 . A A . 28 PRO HB3 1 1 3 1323 1 1 28 PRO HD2 H 5.728 2.278 2.500 1.00 . A A . 28 PRO HD2 1 1 3 1324 1 1 28 PRO HD3 H 7.251 3.059 2.015 1.00 . A A . 28 PRO HD3 1 1 3 1325 1 1 28 PRO HG2 H 6.676 1.275 4.295 1.00 . A A . 28 PRO HG2 1 1 3 1326 1 1 28 PRO HG3 H 7.916 2.523 4.121 1.00 . A A . 28 PRO HG3 1 1 3 1327 1 1 28 PRO N N 7.065 1.051 1.415 1.00 . A A . 28 PRO N 1 1 3 1328 1 1 28 PRO O O 6.827 -1.572 3.520 1.00 . A A . 28 PRO O 1 1 3 1329 1 1 29 ARG C C 6.494 -4.132 2.602 1.00 . A A . 29 ARG C 1 1 3 1330 1 1 29 ARG CA C 5.811 -3.217 1.580 1.00 . A A . 29 ARG CA 1 1 3 1331 1 1 29 ARG CB C 5.731 -3.901 0.210 1.00 . A A . 29 ARG CB 1 1 3 1332 1 1 29 ARG CD C 5.875 -6.395 0.370 1.00 . A A . 29 ARG CD 1 1 3 1333 1 1 29 ARG CG C 4.920 -5.199 0.329 1.00 . A A . 29 ARG CG 1 1 3 1334 1 1 29 ARG CZ C 5.697 -7.684 2.461 1.00 . A A . 29 ARG CZ 1 1 3 1335 1 1 29 ARG H H 6.848 -1.709 0.438 1.00 . A A . 29 ARG H 1 1 3 1336 1 1 29 ARG HA H 4.823 -2.952 1.916 1.00 . A A . 29 ARG HA 1 1 3 1337 1 1 29 ARG HB2 H 5.249 -3.237 -0.498 1.00 . A A . 29 ARG HB2 1 1 3 1338 1 1 29 ARG HB3 H 6.728 -4.130 -0.135 1.00 . A A . 29 ARG HB3 1 1 3 1339 1 1 29 ARG HD2 H 5.999 -6.800 -0.626 1.00 . A A . 29 ARG HD2 1 1 3 1340 1 1 29 ARG HD3 H 6.827 -6.099 0.773 1.00 . A A . 29 ARG HD3 1 1 3 1341 1 1 29 ARG HE H 4.399 -7.850 0.950 1.00 . A A . 29 ARG HE 1 1 3 1342 1 1 29 ARG HG2 H 4.331 -5.173 1.235 1.00 . A A . 29 ARG HG2 1 1 3 1343 1 1 29 ARG HG3 H 4.265 -5.293 -0.523 1.00 . A A . 29 ARG HG3 1 1 3 1344 1 1 29 ARG HH11 H 7.210 -6.360 2.388 1.00 . A A . 29 ARG HH11 1 1 3 1345 1 1 29 ARG HH12 H 7.102 -7.290 3.835 1.00 . A A . 29 ARG HH12 1 1 3 1346 1 1 29 ARG HH21 H 4.291 -9.048 2.849 1.00 . A A . 29 ARG HH21 1 1 3 1347 1 1 29 ARG HH22 H 5.468 -8.809 4.096 1.00 . A A . 29 ARG HH22 1 1 3 1348 1 1 29 ARG N N 6.629 -1.985 1.354 1.00 . A A . 29 ARG N 1 1 3 1349 1 1 29 ARG NE N 5.210 -7.395 1.267 1.00 . A A . 29 ARG NE 1 1 3 1350 1 1 29 ARG NH1 N 6.751 -7.066 2.928 1.00 . A A . 29 ARG NH1 1 1 3 1351 1 1 29 ARG NH2 N 5.105 -8.584 3.192 1.00 . A A . 29 ARG NH2 1 1 3 1352 1 1 29 ARG O O 7.641 -4.492 2.390 1.00 . A A . 29 ARG O 1 1 3 1353 1 1 29 ARG OXT O 5.853 -4.466 3.579 1.00 . A A . 29 ARG OXT 1 1 4 1354 1 1 1 GLY C C -10.317 0.063 -4.106 1.00 . A A . 1 GLY C 1 1 4 1355 1 1 1 GLY CA C -11.701 0.338 -4.698 1.00 . A A . 1 GLY CA 1 1 4 1356 1 1 1 GLY H1 H -13.171 0.594 -3.250 1.00 . A A . 1 GLY H1 1 1 4 1357 1 1 1 GLY H2 H -12.339 -0.875 -3.126 1.00 . A A . 1 GLY H2 1 1 4 1358 1 1 1 GLY H3 H -13.500 -0.653 -4.345 1.00 . A A . 1 GLY H3 1 1 4 1359 1 1 1 GLY HA2 H -11.783 -0.142 -5.663 1.00 . A A . 1 GLY HA2 1 1 4 1360 1 1 1 GLY HA3 H -11.827 1.404 -4.817 1.00 . A A . 1 GLY HA3 1 1 4 1361 1 1 1 GLY N N -12.758 -0.189 -3.786 1.00 . A A . 1 GLY N 1 1 4 1362 1 1 1 GLY O O -10.186 -0.617 -3.107 1.00 . A A . 1 GLY O 1 1 4 1363 1 1 2 CYS C C -6.921 1.304 -4.909 1.00 . A A . 2 CYS C 1 1 4 1364 1 1 2 CYS CA C -7.897 0.370 -4.185 1.00 . A A . 2 CYS CA 1 1 4 1365 1 1 2 CYS CB C -7.569 -1.101 -4.481 1.00 . A A . 2 CYS CB 1 1 4 1366 1 1 2 CYS H H -9.415 1.136 -5.515 1.00 . A A . 2 CYS H 1 1 4 1367 1 1 2 CYS HA H -7.871 0.550 -3.120 1.00 . A A . 2 CYS HA 1 1 4 1368 1 1 2 CYS HB2 H -6.778 -1.427 -3.827 1.00 . A A . 2 CYS HB2 1 1 4 1369 1 1 2 CYS HB3 H -8.448 -1.706 -4.313 1.00 . A A . 2 CYS HB3 1 1 4 1370 1 1 2 CYS N N -9.283 0.587 -4.711 1.00 . A A . 2 CYS N 1 1 4 1371 1 1 2 CYS O O -7.252 1.875 -5.931 1.00 . A A . 2 CYS O 1 1 4 1372 1 1 2 CYS SG S -7.034 -1.280 -6.207 1.00 . A A . 2 CYS SG 1 1 4 1373 1 1 3 LYS C C -3.439 1.602 -5.360 1.00 . A A . 3 LYS C 1 1 4 1374 1 1 3 LYS CA C -4.740 2.359 -5.076 1.00 . A A . 3 LYS CA 1 1 4 1375 1 1 3 LYS CB C -4.482 3.526 -4.110 1.00 . A A . 3 LYS CB 1 1 4 1376 1 1 3 LYS CD C -5.627 5.591 -3.273 1.00 . A A . 3 LYS CD 1 1 4 1377 1 1 3 LYS CE C -6.715 6.030 -2.286 1.00 . A A . 3 LYS CE 1 1 4 1378 1 1 3 LYS CG C -5.813 4.110 -3.618 1.00 . A A . 3 LYS CG 1 1 4 1379 1 1 3 LYS H H -5.482 0.990 -3.573 1.00 . A A . 3 LYS H 1 1 4 1380 1 1 3 LYS HA H -5.152 2.736 -6.000 1.00 . A A . 3 LYS HA 1 1 4 1381 1 1 3 LYS HB2 H -3.899 3.183 -3.265 1.00 . A A . 3 LYS HB2 1 1 4 1382 1 1 3 LYS HB3 H -3.935 4.292 -4.630 1.00 . A A . 3 LYS HB3 1 1 4 1383 1 1 3 LYS HD2 H -4.655 5.740 -2.827 1.00 . A A . 3 LYS HD2 1 1 4 1384 1 1 3 LYS HD3 H -5.706 6.182 -4.173 1.00 . A A . 3 LYS HD3 1 1 4 1385 1 1 3 LYS HE2 H -6.901 7.092 -2.388 1.00 . A A . 3 LYS HE2 1 1 4 1386 1 1 3 LYS HE3 H -7.623 5.471 -2.455 1.00 . A A . 3 LYS HE3 1 1 4 1387 1 1 3 LYS HG2 H -6.560 4.010 -4.394 1.00 . A A . 3 LYS HG2 1 1 4 1388 1 1 3 LYS HG3 H -6.136 3.574 -2.740 1.00 . A A . 3 LYS HG3 1 1 4 1389 1 1 3 LYS HZ1 H -5.432 6.425 -0.688 1.00 . A A . 3 LYS HZ1 1 1 4 1390 1 1 3 LYS HZ2 H -5.750 4.757 -0.927 1.00 . A A . 3 LYS HZ2 1 1 4 1391 1 1 3 LYS HZ3 H -6.927 5.771 -0.232 1.00 . A A . 3 LYS HZ3 1 1 4 1392 1 1 3 LYS N N -5.729 1.462 -4.397 1.00 . A A . 3 LYS N 1 1 4 1393 1 1 3 LYS NZ N -6.168 5.724 -0.934 1.00 . A A . 3 LYS NZ 1 1 4 1394 1 1 3 LYS O O -3.326 0.419 -5.094 1.00 . A A . 3 LYS O 1 1 4 1395 1 1 4 LEU C C -0.156 1.920 -5.094 1.00 . A A . 4 LEU C 1 1 4 1396 1 1 4 LEU CA C -1.165 1.629 -6.221 1.00 . A A . 4 LEU CA 1 1 4 1397 1 1 4 LEU CB C -0.721 2.252 -7.559 1.00 . A A . 4 LEU CB 1 1 4 1398 1 1 4 LEU CD1 C -1.734 0.206 -8.612 1.00 . A A . 4 LEU CD1 1 1 4 1399 1 1 4 LEU CD2 C -2.958 2.371 -8.693 1.00 . A A . 4 LEU CD2 1 1 4 1400 1 1 4 LEU CG C -1.576 1.721 -8.722 1.00 . A A . 4 LEU CG 1 1 4 1401 1 1 4 LEU H H -2.598 3.227 -6.107 1.00 . A A . 4 LEU H 1 1 4 1402 1 1 4 LEU HA H -1.297 0.564 -6.334 1.00 . A A . 4 LEU HA 1 1 4 1403 1 1 4 LEU HB2 H -0.825 3.321 -7.504 1.00 . A A . 4 LEU HB2 1 1 4 1404 1 1 4 LEU HB3 H 0.311 2.006 -7.742 1.00 . A A . 4 LEU HB3 1 1 4 1405 1 1 4 LEU HD11 H -2.072 -0.187 -9.560 1.00 . A A . 4 LEU HD11 1 1 4 1406 1 1 4 LEU HD12 H -2.459 -0.024 -7.849 1.00 . A A . 4 LEU HD12 1 1 4 1407 1 1 4 LEU HD13 H -0.783 -0.236 -8.352 1.00 . A A . 4 LEU HD13 1 1 4 1408 1 1 4 LEU HD21 H -3.686 1.656 -8.343 1.00 . A A . 4 LEU HD21 1 1 4 1409 1 1 4 LEU HD22 H -3.222 2.697 -9.687 1.00 . A A . 4 LEU HD22 1 1 4 1410 1 1 4 LEU HD23 H -2.940 3.219 -8.030 1.00 . A A . 4 LEU HD23 1 1 4 1411 1 1 4 LEU HG H -1.088 1.959 -9.657 1.00 . A A . 4 LEU HG 1 1 4 1412 1 1 4 LEU N N -2.468 2.282 -5.903 1.00 . A A . 4 LEU N 1 1 4 1413 1 1 4 LEU O O -0.464 1.749 -3.927 1.00 . A A . 4 LEU O 1 1 4 1414 1 1 5 THR C C 1.967 4.080 -3.885 1.00 . A A . 5 THR C 1 1 4 1415 1 1 5 THR CA C 2.056 2.619 -4.357 1.00 . A A . 5 THR CA 1 1 4 1416 1 1 5 THR CB C 3.421 2.338 -5.016 1.00 . A A . 5 THR CB 1 1 4 1417 1 1 5 THR CG2 C 4.173 1.281 -4.204 1.00 . A A . 5 THR CG2 1 1 4 1418 1 1 5 THR H H 1.291 2.466 -6.353 1.00 . A A . 5 THR H 1 1 4 1419 1 1 5 THR HA H 1.914 1.951 -3.524 1.00 . A A . 5 THR HA 1 1 4 1420 1 1 5 THR HB H 3.999 3.246 -5.037 1.00 . A A . 5 THR HB 1 1 4 1421 1 1 5 THR HG1 H 4.075 1.922 -6.815 1.00 . A A . 5 THR HG1 1 1 4 1422 1 1 5 THR HG21 H 4.040 1.476 -3.151 1.00 . A A . 5 THR HG21 1 1 4 1423 1 1 5 THR HG22 H 5.226 1.318 -4.445 1.00 . A A . 5 THR HG22 1 1 4 1424 1 1 5 THR HG23 H 3.783 0.302 -4.441 1.00 . A A . 5 THR HG23 1 1 4 1425 1 1 5 THR N N 1.043 2.343 -5.416 1.00 . A A . 5 THR N 1 1 4 1426 1 1 5 THR O O 1.481 4.363 -2.807 1.00 . A A . 5 THR O 1 1 4 1427 1 1 5 THR OG1 O 3.234 1.864 -6.349 1.00 . A A . 5 THR OG1 1 1 4 1428 1 1 6 PHE C C 0.981 7.031 -4.265 1.00 . A A . 6 PHE C 1 1 4 1429 1 1 6 PHE CA C 2.408 6.447 -4.266 1.00 . A A . 6 PHE CA 1 1 4 1430 1 1 6 PHE CB C 3.295 7.180 -5.284 1.00 . A A . 6 PHE CB 1 1 4 1431 1 1 6 PHE CD1 C 5.209 6.881 -3.654 1.00 . A A . 6 PHE CD1 1 1 4 1432 1 1 6 PHE CD2 C 5.064 8.944 -4.918 1.00 . A A . 6 PHE CD2 1 1 4 1433 1 1 6 PHE CE1 C 6.370 7.347 -3.029 1.00 . A A . 6 PHE CE1 1 1 4 1434 1 1 6 PHE CE2 C 6.227 9.405 -4.290 1.00 . A A . 6 PHE CE2 1 1 4 1435 1 1 6 PHE CG C 4.553 7.678 -4.603 1.00 . A A . 6 PHE CG 1 1 4 1436 1 1 6 PHE CZ C 6.878 8.609 -3.346 1.00 . A A . 6 PHE CZ 1 1 4 1437 1 1 6 PHE H H 2.827 4.757 -5.530 1.00 . A A . 6 PHE H 1 1 4 1438 1 1 6 PHE HA H 2.839 6.551 -3.281 1.00 . A A . 6 PHE HA 1 1 4 1439 1 1 6 PHE HB2 H 3.565 6.507 -6.085 1.00 . A A . 6 PHE HB2 1 1 4 1440 1 1 6 PHE HB3 H 2.752 8.021 -5.692 1.00 . A A . 6 PHE HB3 1 1 4 1441 1 1 6 PHE HD1 H 4.821 5.905 -3.408 1.00 . A A . 6 PHE HD1 1 1 4 1442 1 1 6 PHE HD2 H 4.564 9.567 -5.648 1.00 . A A . 6 PHE HD2 1 1 4 1443 1 1 6 PHE HE1 H 6.872 6.732 -2.296 1.00 . A A . 6 PHE HE1 1 1 4 1444 1 1 6 PHE HE2 H 6.620 10.382 -4.534 1.00 . A A . 6 PHE HE2 1 1 4 1445 1 1 6 PHE HZ H 7.774 8.971 -2.861 1.00 . A A . 6 PHE HZ 1 1 4 1446 1 1 6 PHE N N 2.439 5.007 -4.676 1.00 . A A . 6 PHE N 1 1 4 1447 1 1 6 PHE O O 0.788 8.196 -4.553 1.00 . A A . 6 PHE O 1 1 4 1448 1 1 7 TRP C C -1.732 7.055 -2.374 1.00 . A A . 7 TRP C 1 1 4 1449 1 1 7 TRP CA C -1.392 6.793 -3.839 1.00 . A A . 7 TRP CA 1 1 4 1450 1 1 7 TRP CB C -2.279 5.685 -4.400 1.00 . A A . 7 TRP CB 1 1 4 1451 1 1 7 TRP CD1 C -0.938 5.487 -6.524 1.00 . A A . 7 TRP CD1 1 1 4 1452 1 1 7 TRP CD2 C -3.146 5.623 -6.905 1.00 . A A . 7 TRP CD2 1 1 4 1453 1 1 7 TRP CE2 C -2.522 5.528 -8.169 1.00 . A A . 7 TRP CE2 1 1 4 1454 1 1 7 TRP CE3 C -4.549 5.716 -6.861 1.00 . A A . 7 TRP CE3 1 1 4 1455 1 1 7 TRP CG C -2.116 5.609 -5.880 1.00 . A A . 7 TRP CG 1 1 4 1456 1 1 7 TRP CH2 C -4.655 5.615 -9.291 1.00 . A A . 7 TRP CH2 1 1 4 1457 1 1 7 TRP CZ2 C -3.262 5.524 -9.351 1.00 . A A . 7 TRP CZ2 1 1 4 1458 1 1 7 TRP CZ3 C -5.297 5.711 -8.048 1.00 . A A . 7 TRP CZ3 1 1 4 1459 1 1 7 TRP H H 0.158 5.331 -3.641 1.00 . A A . 7 TRP H 1 1 4 1460 1 1 7 TRP HA H -1.486 7.691 -4.428 1.00 . A A . 7 TRP HA 1 1 4 1461 1 1 7 TRP HB2 H -1.996 4.740 -3.958 1.00 . A A . 7 TRP HB2 1 1 4 1462 1 1 7 TRP HB3 H -3.307 5.898 -4.163 1.00 . A A . 7 TRP HB3 1 1 4 1463 1 1 7 TRP HD1 H 0.032 5.433 -6.050 1.00 . A A . 7 TRP HD1 1 1 4 1464 1 1 7 TRP HE1 H -0.483 5.373 -8.573 1.00 . A A . 7 TRP HE1 1 1 4 1465 1 1 7 TRP HE3 H -5.051 5.791 -5.907 1.00 . A A . 7 TRP HE3 1 1 4 1466 1 1 7 TRP HH2 H -5.235 5.612 -10.202 1.00 . A A . 7 TRP HH2 1 1 4 1467 1 1 7 TRP HZ2 H -2.761 5.446 -10.307 1.00 . A A . 7 TRP HZ2 1 1 4 1468 1 1 7 TRP HZ3 H -6.374 5.783 -8.006 1.00 . A A . 7 TRP HZ3 1 1 4 1469 1 1 7 TRP N N -0.009 6.256 -3.903 1.00 . A A . 7 TRP N 1 1 4 1470 1 1 7 TRP NE1 N -1.174 5.448 -7.882 1.00 . A A . 7 TRP NE1 1 1 4 1471 1 1 7 TRP O O -1.709 6.146 -1.567 1.00 . A A . 7 TRP O 1 1 4 1472 1 1 8 LYS C C -3.233 7.525 0.006 1.00 . A A . 8 LYS C 1 1 4 1473 1 1 8 LYS CA C -2.340 8.613 -0.597 1.00 . A A . 8 LYS CA 1 1 4 1474 1 1 8 LYS CB C -3.073 9.958 -0.659 1.00 . A A . 8 LYS CB 1 1 4 1475 1 1 8 LYS CD C -1.636 11.295 0.897 1.00 . A A . 8 LYS CD 1 1 4 1476 1 1 8 LYS CE C -1.316 11.405 2.396 1.00 . A A . 8 LYS CE 1 1 4 1477 1 1 8 LYS CG C -3.010 10.640 0.708 1.00 . A A . 8 LYS CG 1 1 4 1478 1 1 8 LYS H H -2.006 8.997 -2.687 1.00 . A A . 8 LYS H 1 1 4 1479 1 1 8 LYS HA H -1.432 8.714 -0.022 1.00 . A A . 8 LYS HA 1 1 4 1480 1 1 8 LYS HB2 H -2.606 10.590 -1.400 1.00 . A A . 8 LYS HB2 1 1 4 1481 1 1 8 LYS HB3 H -4.106 9.791 -0.928 1.00 . A A . 8 LYS HB3 1 1 4 1482 1 1 8 LYS HD2 H -0.877 10.695 0.411 1.00 . A A . 8 LYS HD2 1 1 4 1483 1 1 8 LYS HD3 H -1.643 12.282 0.459 1.00 . A A . 8 LYS HD3 1 1 4 1484 1 1 8 LYS HE2 H -1.441 10.444 2.877 1.00 . A A . 8 LYS HE2 1 1 4 1485 1 1 8 LYS HE3 H -0.308 11.768 2.538 1.00 . A A . 8 LYS HE3 1 1 4 1486 1 1 8 LYS HG2 H -3.781 11.394 0.763 1.00 . A A . 8 LYS HG2 1 1 4 1487 1 1 8 LYS HG3 H -3.165 9.903 1.479 1.00 . A A . 8 LYS HG3 1 1 4 1488 1 1 8 LYS HZ1 H -2.345 13.224 2.317 1.00 . A A . 8 LYS HZ1 1 1 4 1489 1 1 8 LYS HZ2 H -1.986 12.695 3.888 1.00 . A A . 8 LYS HZ2 1 1 4 1490 1 1 8 LYS HZ3 H -3.233 11.957 3.011 1.00 . A A . 8 LYS HZ3 1 1 4 1491 1 1 8 LYS N N -2.018 8.285 -2.020 1.00 . A A . 8 LYS N 1 1 4 1492 1 1 8 LYS NZ N -2.294 12.393 2.942 1.00 . A A . 8 LYS NZ 1 1 4 1493 1 1 8 LYS O O -4.421 7.453 -0.267 1.00 . A A . 8 LYS O 1 1 4 1494 1 1 9 CYS C C -3.652 5.744 2.900 1.00 . A A . 9 CYS C 1 1 4 1495 1 1 9 CYS CA C -3.475 5.555 1.394 1.00 . A A . 9 CYS CA 1 1 4 1496 1 1 9 CYS CB C -2.699 4.260 1.107 1.00 . A A . 9 CYS CB 1 1 4 1497 1 1 9 CYS H H -1.699 6.720 0.981 1.00 . A A . 9 CYS H 1 1 4 1498 1 1 9 CYS HA H -4.440 5.507 0.916 1.00 . A A . 9 CYS HA 1 1 4 1499 1 1 9 CYS HB2 H -3.199 3.431 1.584 1.00 . A A . 9 CYS HB2 1 1 4 1500 1 1 9 CYS HB3 H -2.668 4.091 0.041 1.00 . A A . 9 CYS HB3 1 1 4 1501 1 1 9 CYS N N -2.665 6.658 0.797 1.00 . A A . 9 CYS N 1 1 4 1502 1 1 9 CYS O O -2.864 6.395 3.559 1.00 . A A . 9 CYS O 1 1 4 1503 1 1 9 CYS SG S -1.005 4.384 1.751 1.00 . A A . 9 CYS SG 1 1 4 1504 1 1 10 LYS C C -4.615 3.885 5.545 1.00 . A A . 10 LYS C 1 1 4 1505 1 1 10 LYS CA C -4.940 5.242 4.905 1.00 . A A . 10 LYS CA 1 1 4 1506 1 1 10 LYS CB C -6.440 5.554 5.027 1.00 . A A . 10 LYS CB 1 1 4 1507 1 1 10 LYS CD C -8.213 6.579 6.475 1.00 . A A . 10 LYS CD 1 1 4 1508 1 1 10 LYS CE C -8.753 6.451 7.908 1.00 . A A . 10 LYS CE 1 1 4 1509 1 1 10 LYS CG C -6.749 6.116 6.420 1.00 . A A . 10 LYS CG 1 1 4 1510 1 1 10 LYS H H -5.290 4.627 2.872 1.00 . A A . 10 LYS H 1 1 4 1511 1 1 10 LYS HA H -4.355 6.028 5.352 1.00 . A A . 10 LYS HA 1 1 4 1512 1 1 10 LYS HB2 H -6.716 6.280 4.277 1.00 . A A . 10 LYS HB2 1 1 4 1513 1 1 10 LYS HB3 H -7.008 4.647 4.873 1.00 . A A . 10 LYS HB3 1 1 4 1514 1 1 10 LYS HD2 H -8.274 7.611 6.158 1.00 . A A . 10 LYS HD2 1 1 4 1515 1 1 10 LYS HD3 H -8.809 5.967 5.814 1.00 . A A . 10 LYS HD3 1 1 4 1516 1 1 10 LYS HE2 H -9.822 6.622 7.920 1.00 . A A . 10 LYS HE2 1 1 4 1517 1 1 10 LYS HE3 H -8.526 5.474 8.308 1.00 . A A . 10 LYS HE3 1 1 4 1518 1 1 10 LYS HG2 H -6.585 5.347 7.162 1.00 . A A . 10 LYS HG2 1 1 4 1519 1 1 10 LYS HG3 H -6.100 6.955 6.622 1.00 . A A . 10 LYS HG3 1 1 4 1520 1 1 10 LYS HZ1 H -8.198 8.433 8.256 1.00 . A A . 10 LYS HZ1 1 1 4 1521 1 1 10 LYS HZ2 H -7.030 7.292 8.725 1.00 . A A . 10 LYS HZ2 1 1 4 1522 1 1 10 LYS HZ3 H -8.424 7.523 9.664 1.00 . A A . 10 LYS HZ3 1 1 4 1523 1 1 10 LYS N N -4.682 5.155 3.440 1.00 . A A . 10 LYS N 1 1 4 1524 1 1 10 LYS NZ N -8.047 7.503 8.696 1.00 . A A . 10 LYS NZ 1 1 4 1525 1 1 10 LYS O O -4.164 3.808 6.675 1.00 . A A . 10 LYS O 1 1 4 1526 1 1 11 ASN C C -3.586 0.711 4.416 1.00 . A A . 11 ASN C 1 1 4 1527 1 1 11 ASN CA C -4.555 1.453 5.353 1.00 . A A . 11 ASN CA 1 1 4 1528 1 1 11 ASN CB C -5.928 0.765 5.386 1.00 . A A . 11 ASN CB 1 1 4 1529 1 1 11 ASN CG C -5.788 -0.682 5.868 1.00 . A A . 11 ASN CG 1 1 4 1530 1 1 11 ASN H H -5.201 2.907 3.911 1.00 . A A . 11 ASN H 1 1 4 1531 1 1 11 ASN HA H -4.146 1.512 6.349 1.00 . A A . 11 ASN HA 1 1 4 1532 1 1 11 ASN HB2 H -6.578 1.301 6.058 1.00 . A A . 11 ASN HB2 1 1 4 1533 1 1 11 ASN HB3 H -6.357 0.768 4.393 1.00 . A A . 11 ASN HB3 1 1 4 1534 1 1 11 ASN HD21 H -7.393 -1.314 4.889 1.00 . A A . 11 ASN HD21 1 1 4 1535 1 1 11 ASN HD22 H -6.580 -2.498 5.792 1.00 . A A . 11 ASN HD22 1 1 4 1536 1 1 11 ASN N N -4.841 2.816 4.819 1.00 . A A . 11 ASN N 1 1 4 1537 1 1 11 ASN ND2 N -6.658 -1.571 5.483 1.00 . A A . 11 ASN ND2 1 1 4 1538 1 1 11 ASN O O -3.318 1.139 3.312 1.00 . A A . 11 ASN O 1 1 4 1539 1 1 11 ASN OD1 O -4.876 -1.011 6.597 1.00 . A A . 11 ASN OD1 1 1 4 1540 1 1 12 LYS C C -2.887 -2.061 3.001 1.00 . A A . 12 LYS C 1 1 4 1541 1 1 12 LYS CA C -2.116 -1.188 4.004 1.00 . A A . 12 LYS CA 1 1 4 1542 1 1 12 LYS CB C -1.343 -2.064 5.000 1.00 . A A . 12 LYS CB 1 1 4 1543 1 1 12 LYS CD C 0.212 -3.999 4.644 1.00 . A A . 12 LYS CD 1 1 4 1544 1 1 12 LYS CE C 1.615 -4.393 4.156 1.00 . A A . 12 LYS CE 1 1 4 1545 1 1 12 LYS CG C -0.014 -2.506 4.386 1.00 . A A . 12 LYS CG 1 1 4 1546 1 1 12 LYS H H -3.290 -0.722 5.750 1.00 . A A . 12 LYS H 1 1 4 1547 1 1 12 LYS HA H -1.436 -0.533 3.483 1.00 . A A . 12 LYS HA 1 1 4 1548 1 1 12 LYS HB2 H -1.145 -1.497 5.898 1.00 . A A . 12 LYS HB2 1 1 4 1549 1 1 12 LYS HB3 H -1.930 -2.935 5.247 1.00 . A A . 12 LYS HB3 1 1 4 1550 1 1 12 LYS HD2 H 0.124 -4.200 5.702 1.00 . A A . 12 LYS HD2 1 1 4 1551 1 1 12 LYS HD3 H -0.527 -4.573 4.105 1.00 . A A . 12 LYS HD3 1 1 4 1552 1 1 12 LYS HE2 H 1.580 -5.346 3.645 1.00 . A A . 12 LYS HE2 1 1 4 1553 1 1 12 LYS HE3 H 2.012 -3.632 3.502 1.00 . A A . 12 LYS HE3 1 1 4 1554 1 1 12 LYS HG2 H -0.039 -2.323 3.322 1.00 . A A . 12 LYS HG2 1 1 4 1555 1 1 12 LYS HG3 H 0.789 -1.941 4.832 1.00 . A A . 12 LYS HG3 1 1 4 1556 1 1 12 LYS HZ1 H 3.436 -4.694 5.129 1.00 . A A . 12 LYS HZ1 1 1 4 1557 1 1 12 LYS HZ2 H 2.089 -5.258 5.995 1.00 . A A . 12 LYS HZ2 1 1 4 1558 1 1 12 LYS HZ3 H 2.412 -3.593 5.913 1.00 . A A . 12 LYS HZ3 1 1 4 1559 1 1 12 LYS N N -3.062 -0.399 4.854 1.00 . A A . 12 LYS N 1 1 4 1560 1 1 12 LYS NZ N 2.447 -4.491 5.389 1.00 . A A . 12 LYS NZ 1 1 4 1561 1 1 12 LYS O O -2.462 -2.241 1.873 1.00 . A A . 12 LYS O 1 1 4 1562 1 1 13 LYS C C -5.574 -2.685 1.420 1.00 . A A . 13 LYS C 1 1 4 1563 1 1 13 LYS CA C -4.785 -3.497 2.467 1.00 . A A . 13 LYS CA 1 1 4 1564 1 1 13 LYS CB C -5.739 -4.289 3.375 1.00 . A A . 13 LYS CB 1 1 4 1565 1 1 13 LYS CD C -6.612 -6.637 3.207 1.00 . A A . 13 LYS CD 1 1 4 1566 1 1 13 LYS CE C -8.036 -7.215 3.172 1.00 . A A . 13 LYS CE 1 1 4 1567 1 1 13 LYS CG C -6.586 -5.258 2.535 1.00 . A A . 13 LYS CG 1 1 4 1568 1 1 13 LYS H H -4.324 -2.468 4.314 1.00 . A A . 13 LYS H 1 1 4 1569 1 1 13 LYS HA H -4.118 -4.181 1.968 1.00 . A A . 13 LYS HA 1 1 4 1570 1 1 13 LYS HB2 H -5.162 -4.853 4.092 1.00 . A A . 13 LYS HB2 1 1 4 1571 1 1 13 LYS HB3 H -6.392 -3.606 3.896 1.00 . A A . 13 LYS HB3 1 1 4 1572 1 1 13 LYS HD2 H -5.941 -7.304 2.684 1.00 . A A . 13 LYS HD2 1 1 4 1573 1 1 13 LYS HD3 H -6.292 -6.543 4.235 1.00 . A A . 13 LYS HD3 1 1 4 1574 1 1 13 LYS HE2 H -8.062 -8.173 3.674 1.00 . A A . 13 LYS HE2 1 1 4 1575 1 1 13 LYS HE3 H -8.729 -6.530 3.639 1.00 . A A . 13 LYS HE3 1 1 4 1576 1 1 13 LYS HG2 H -7.595 -4.875 2.454 1.00 . A A . 13 LYS HG2 1 1 4 1577 1 1 13 LYS HG3 H -6.158 -5.350 1.548 1.00 . A A . 13 LYS HG3 1 1 4 1578 1 1 13 LYS HZ1 H -8.987 -8.206 1.600 1.00 . A A . 13 LYS HZ1 1 1 4 1579 1 1 13 LYS HZ2 H -7.505 -7.509 1.169 1.00 . A A . 13 LYS HZ2 1 1 4 1580 1 1 13 LYS HZ3 H -8.874 -6.531 1.385 1.00 . A A . 13 LYS HZ3 1 1 4 1581 1 1 13 LYS N N -4.006 -2.618 3.399 1.00 . A A . 13 LYS N 1 1 4 1582 1 1 13 LYS NZ N -8.373 -7.375 1.724 1.00 . A A . 13 LYS NZ 1 1 4 1583 1 1 13 LYS O O -6.159 -3.254 0.517 1.00 . A A . 13 LYS O 1 1 4 1584 1 1 14 GLU C C -5.577 -0.457 -0.830 1.00 . A A . 14 GLU C 1 1 4 1585 1 1 14 GLU CA C -6.375 -0.597 0.482 1.00 . A A . 14 GLU CA 1 1 4 1586 1 1 14 GLU CB C -6.663 0.774 1.113 1.00 . A A . 14 GLU CB 1 1 4 1587 1 1 14 GLU CD C -5.602 3.006 0.792 1.00 . A A . 14 GLU CD 1 1 4 1588 1 1 14 GLU CG C -5.371 1.577 1.282 1.00 . A A . 14 GLU CG 1 1 4 1589 1 1 14 GLU H H -5.133 -0.912 2.229 1.00 . A A . 14 GLU H 1 1 4 1590 1 1 14 GLU HA H -7.310 -1.096 0.283 1.00 . A A . 14 GLU HA 1 1 4 1591 1 1 14 GLU HB2 H -7.338 1.322 0.473 1.00 . A A . 14 GLU HB2 1 1 4 1592 1 1 14 GLU HB3 H -7.124 0.634 2.079 1.00 . A A . 14 GLU HB3 1 1 4 1593 1 1 14 GLU HG2 H -5.097 1.594 2.325 1.00 . A A . 14 GLU HG2 1 1 4 1594 1 1 14 GLU HG3 H -4.580 1.123 0.708 1.00 . A A . 14 GLU HG3 1 1 4 1595 1 1 14 GLU N N -5.605 -1.376 1.507 1.00 . A A . 14 GLU N 1 1 4 1596 1 1 14 GLU O O -6.122 -0.094 -1.857 1.00 . A A . 14 GLU O 1 1 4 1597 1 1 14 GLU OE1 O -6.072 3.811 1.574 1.00 . A A . 14 GLU OE1 1 1 4 1598 1 1 14 GLU OE2 O -5.304 3.277 -0.359 1.00 . A A . 14 GLU OE2 1 1 4 1599 1 1 15 CYS C C -3.540 -1.949 -2.852 1.00 . A A . 15 CYS C 1 1 4 1600 1 1 15 CYS CA C -3.501 -0.634 -2.077 1.00 . A A . 15 CYS CA 1 1 4 1601 1 1 15 CYS CB C -2.072 -0.324 -1.636 1.00 . A A . 15 CYS CB 1 1 4 1602 1 1 15 CYS H H -3.865 -1.057 0.012 1.00 . A A . 15 CYS H 1 1 4 1603 1 1 15 CYS HA H -3.880 0.174 -2.686 1.00 . A A . 15 CYS HA 1 1 4 1604 1 1 15 CYS HB2 H -1.810 -0.951 -0.796 1.00 . A A . 15 CYS HB2 1 1 4 1605 1 1 15 CYS HB3 H -1.393 -0.518 -2.453 1.00 . A A . 15 CYS HB3 1 1 4 1606 1 1 15 CYS N N -4.298 -0.751 -0.818 1.00 . A A . 15 CYS N 1 1 4 1607 1 1 15 CYS O O -3.377 -3.015 -2.288 1.00 . A A . 15 CYS O 1 1 4 1608 1 1 15 CYS SG S -1.955 1.416 -1.152 1.00 . A A . 15 CYS SG 1 1 4 1609 1 1 16 CYS C C -2.324 -3.651 -5.120 1.00 . A A . 16 CYS C 1 1 4 1610 1 1 16 CYS CA C -3.759 -3.141 -4.950 1.00 . A A . 16 CYS CA 1 1 4 1611 1 1 16 CYS CB C -4.371 -2.745 -6.296 1.00 . A A . 16 CYS CB 1 1 4 1612 1 1 16 CYS H H -3.846 -1.012 -4.580 1.00 . A A . 16 CYS H 1 1 4 1613 1 1 16 CYS HA H -4.369 -3.886 -4.466 1.00 . A A . 16 CYS HA 1 1 4 1614 1 1 16 CYS HB2 H -4.214 -1.691 -6.469 1.00 . A A . 16 CYS HB2 1 1 4 1615 1 1 16 CYS HB3 H -3.900 -3.312 -7.084 1.00 . A A . 16 CYS HB3 1 1 4 1616 1 1 16 CYS N N -3.735 -1.888 -4.140 1.00 . A A . 16 CYS N 1 1 4 1617 1 1 16 CYS O O -1.408 -2.876 -5.336 1.00 . A A . 16 CYS O 1 1 4 1618 1 1 16 CYS SG S -6.149 -3.099 -6.275 1.00 . A A . 16 CYS SG 1 1 4 1619 1 1 17 GLY C C -0.065 -5.373 -3.740 1.00 . A A . 17 GLY C 1 1 4 1620 1 1 17 GLY CA C -0.724 -5.476 -5.115 1.00 . A A . 17 GLY CA 1 1 4 1621 1 1 17 GLY H H -2.858 -5.539 -4.800 1.00 . A A . 17 GLY H 1 1 4 1622 1 1 17 GLY HA2 H -0.760 -6.511 -5.435 1.00 . A A . 17 GLY HA2 1 1 4 1623 1 1 17 GLY HA3 H -0.163 -4.893 -5.826 1.00 . A A . 17 GLY HA3 1 1 4 1624 1 1 17 GLY N N -2.111 -4.934 -4.996 1.00 . A A . 17 GLY N 1 1 4 1625 1 1 17 GLY O O 0.925 -4.693 -3.575 1.00 . A A . 17 GLY O 1 1 4 1626 1 1 18 TRP C C 1.081 -5.156 -1.120 1.00 . A A . 18 TRP C 1 1 4 1627 1 1 18 TRP CA C -0.170 -6.021 -1.337 1.00 . A A . 18 TRP CA 1 1 4 1628 1 1 18 TRP CB C 0.107 -7.487 -0.999 1.00 . A A . 18 TRP CB 1 1 4 1629 1 1 18 TRP CD1 C -2.175 -7.504 0.119 1.00 . A A . 18 TRP CD1 1 1 4 1630 1 1 18 TRP CD2 C -1.534 -9.546 -0.589 1.00 . A A . 18 TRP CD2 1 1 4 1631 1 1 18 TRP CE2 C -2.811 -9.698 0.001 1.00 . A A . 18 TRP CE2 1 1 4 1632 1 1 18 TRP CE3 C -0.905 -10.690 -1.117 1.00 . A A . 18 TRP CE3 1 1 4 1633 1 1 18 TRP CG C -1.151 -8.141 -0.508 1.00 . A A . 18 TRP CG 1 1 4 1634 1 1 18 TRP CH2 C -2.799 -12.064 -0.459 1.00 . A A . 18 TRP CH2 1 1 4 1635 1 1 18 TRP CZ2 C -3.441 -10.942 0.070 1.00 . A A . 18 TRP CZ2 1 1 4 1636 1 1 18 TRP CZ3 C -1.536 -11.938 -1.048 1.00 . A A . 18 TRP CZ3 1 1 4 1637 1 1 18 TRP H H -1.469 -6.543 -2.967 1.00 . A A . 18 TRP H 1 1 4 1638 1 1 18 TRP HA H -0.958 -5.662 -0.698 1.00 . A A . 18 TRP HA 1 1 4 1639 1 1 18 TRP HB2 H 0.458 -8.000 -1.882 1.00 . A A . 18 TRP HB2 1 1 4 1640 1 1 18 TRP HB3 H 0.860 -7.542 -0.228 1.00 . A A . 18 TRP HB3 1 1 4 1641 1 1 18 TRP HD1 H -2.217 -6.446 0.343 1.00 . A A . 18 TRP HD1 1 1 4 1642 1 1 18 TRP HE1 H -4.014 -8.219 0.866 1.00 . A A . 18 TRP HE1 1 1 4 1643 1 1 18 TRP HE3 H 0.068 -10.609 -1.573 1.00 . A A . 18 TRP HE3 1 1 4 1644 1 1 18 TRP HH2 H -3.274 -13.028 -0.410 1.00 . A A . 18 TRP HH2 1 1 4 1645 1 1 18 TRP HZ2 H -4.416 -11.036 0.531 1.00 . A A . 18 TRP HZ2 1 1 4 1646 1 1 18 TRP HZ3 H -1.044 -12.808 -1.453 1.00 . A A . 18 TRP HZ3 1 1 4 1647 1 1 18 TRP N N -0.659 -6.033 -2.761 1.00 . A A . 18 TRP N 1 1 4 1648 1 1 18 TRP NE1 N -3.162 -8.425 0.414 1.00 . A A . 18 TRP NE1 1 1 4 1649 1 1 18 TRP O O 2.203 -5.618 -1.202 1.00 . A A . 18 TRP O 1 1 4 1650 1 1 19 ASN C C 1.853 -2.446 0.892 1.00 . A A . 19 ASN C 1 1 4 1651 1 1 19 ASN CA C 2.000 -2.971 -0.547 1.00 . A A . 19 ASN CA 1 1 4 1652 1 1 19 ASN CB C 1.830 -1.856 -1.587 1.00 . A A . 19 ASN CB 1 1 4 1653 1 1 19 ASN CG C 3.026 -0.909 -1.531 1.00 . A A . 19 ASN CG 1 1 4 1654 1 1 19 ASN H H -0.049 -3.581 -0.735 1.00 . A A . 19 ASN H 1 1 4 1655 1 1 19 ASN HA H 2.951 -3.467 -0.678 1.00 . A A . 19 ASN HA 1 1 4 1656 1 1 19 ASN HB2 H 1.758 -2.292 -2.573 1.00 . A A . 19 ASN HB2 1 1 4 1657 1 1 19 ASN HB3 H 0.929 -1.304 -1.372 1.00 . A A . 19 ASN HB3 1 1 4 1658 1 1 19 ASN HD21 H 4.088 -1.881 -2.892 1.00 . A A . 19 ASN HD21 1 1 4 1659 1 1 19 ASN HD22 H 4.811 -0.482 -2.268 1.00 . A A . 19 ASN HD22 1 1 4 1660 1 1 19 ASN N N 0.871 -3.906 -0.814 1.00 . A A . 19 ASN N 1 1 4 1661 1 1 19 ASN ND2 N 4.060 -1.112 -2.290 1.00 . A A . 19 ASN ND2 1 1 4 1662 1 1 19 ASN O O 1.006 -2.914 1.625 1.00 . A A . 19 ASN O 1 1 4 1663 1 1 19 ASN OD1 O 3.027 0.022 -0.763 1.00 . A A . 19 ASN OD1 1 1 4 1664 1 1 20 ALA C C 2.256 0.501 2.775 1.00 . A A . 20 ALA C 1 1 4 1665 1 1 20 ALA CA C 2.522 -1.005 2.726 1.00 . A A . 20 ALA CA 1 1 4 1666 1 1 20 ALA CB C 3.861 -1.303 3.385 1.00 . A A . 20 ALA CB 1 1 4 1667 1 1 20 ALA H H 3.345 -1.132 0.741 1.00 . A A . 20 ALA H 1 1 4 1668 1 1 20 ALA HA H 1.743 -1.536 3.237 1.00 . A A . 20 ALA HA 1 1 4 1669 1 1 20 ALA HB1 H 4.158 -2.316 3.164 1.00 . A A . 20 ALA HB1 1 1 4 1670 1 1 20 ALA HB2 H 3.769 -1.173 4.453 1.00 . A A . 20 ALA HB2 1 1 4 1671 1 1 20 ALA HB3 H 4.608 -0.621 3.000 1.00 . A A . 20 ALA HB3 1 1 4 1672 1 1 20 ALA N N 2.656 -1.503 1.324 1.00 . A A . 20 ALA N 1 1 4 1673 1 1 20 ALA O O 3.009 1.287 2.239 1.00 . A A . 20 ALA O 1 1 4 1674 1 1 21 CYS C C 1.864 2.920 4.671 1.00 . A A . 21 CYS C 1 1 4 1675 1 1 21 CYS CA C 0.924 2.363 3.594 1.00 . A A . 21 CYS CA 1 1 4 1676 1 1 21 CYS CB C -0.544 2.445 4.036 1.00 . A A . 21 CYS CB 1 1 4 1677 1 1 21 CYS H H 0.644 0.248 3.920 1.00 . A A . 21 CYS H 1 1 4 1678 1 1 21 CYS HA H 1.073 2.875 2.653 1.00 . A A . 21 CYS HA 1 1 4 1679 1 1 21 CYS HB2 H -1.132 1.736 3.471 1.00 . A A . 21 CYS HB2 1 1 4 1680 1 1 21 CYS HB3 H -0.619 2.212 5.090 1.00 . A A . 21 CYS HB3 1 1 4 1681 1 1 21 CYS N N 1.215 0.905 3.459 1.00 . A A . 21 CYS N 1 1 4 1682 1 1 21 CYS O O 1.592 2.825 5.856 1.00 . A A . 21 CYS O 1 1 4 1683 1 1 21 CYS SG S -1.179 4.114 3.745 1.00 . A A . 21 CYS SG 1 1 4 1684 1 1 22 ALA C C 4.144 5.471 5.241 1.00 . A A . 22 ALA C 1 1 4 1685 1 1 22 ALA CA C 3.993 3.945 5.267 1.00 . A A . 22 ALA CA 1 1 4 1686 1 1 22 ALA CB C 5.309 3.264 4.867 1.00 . A A . 22 ALA CB 1 1 4 1687 1 1 22 ALA H H 3.207 3.469 3.310 1.00 . A A . 22 ALA H 1 1 4 1688 1 1 22 ALA HA H 3.712 3.623 6.255 1.00 . A A . 22 ALA HA 1 1 4 1689 1 1 22 ALA HB1 H 6.132 3.740 5.379 1.00 . A A . 22 ALA HB1 1 1 4 1690 1 1 22 ALA HB2 H 5.452 3.350 3.796 1.00 . A A . 22 ALA HB2 1 1 4 1691 1 1 22 ALA HB3 H 5.273 2.219 5.140 1.00 . A A . 22 ALA HB3 1 1 4 1692 1 1 22 ALA N N 2.997 3.444 4.269 1.00 . A A . 22 ALA N 1 1 4 1693 1 1 22 ALA O O 3.566 6.167 6.056 1.00 . A A . 22 ALA O 1 1 4 1694 1 1 23 LEU C C 3.897 8.211 3.787 1.00 . A A . 23 LEU C 1 1 4 1695 1 1 23 LEU CA C 5.155 7.485 4.291 1.00 . A A . 23 LEU CA 1 1 4 1696 1 1 23 LEU CB C 6.319 7.714 3.304 1.00 . A A . 23 LEU CB 1 1 4 1697 1 1 23 LEU CD1 C 7.546 6.268 5.031 1.00 . A A . 23 LEU CD1 1 1 4 1698 1 1 23 LEU CD2 C 7.573 5.639 2.615 1.00 . A A . 23 LEU CD2 1 1 4 1699 1 1 23 LEU CG C 7.551 6.815 3.597 1.00 . A A . 23 LEU CG 1 1 4 1700 1 1 23 LEU H H 5.407 5.419 3.706 1.00 . A A . 23 LEU H 1 1 4 1701 1 1 23 LEU HA H 5.428 7.853 5.267 1.00 . A A . 23 LEU HA 1 1 4 1702 1 1 23 LEU HB2 H 5.971 7.510 2.301 1.00 . A A . 23 LEU HB2 1 1 4 1703 1 1 23 LEU HB3 H 6.621 8.750 3.358 1.00 . A A . 23 LEU HB3 1 1 4 1704 1 1 23 LEU HD11 H 6.913 6.878 5.656 1.00 . A A . 23 LEU HD11 1 1 4 1705 1 1 23 LEU HD12 H 8.554 6.280 5.423 1.00 . A A . 23 LEU HD12 1 1 4 1706 1 1 23 LEU HD13 H 7.177 5.252 5.026 1.00 . A A . 23 LEU HD13 1 1 4 1707 1 1 23 LEU HD21 H 7.600 4.711 3.167 1.00 . A A . 23 LEU HD21 1 1 4 1708 1 1 23 LEU HD22 H 8.452 5.710 1.989 1.00 . A A . 23 LEU HD22 1 1 4 1709 1 1 23 LEU HD23 H 6.688 5.668 1.998 1.00 . A A . 23 LEU HD23 1 1 4 1710 1 1 23 LEU HG H 8.449 7.404 3.454 1.00 . A A . 23 LEU HG 1 1 4 1711 1 1 23 LEU N N 4.936 5.999 4.338 1.00 . A A . 23 LEU N 1 1 4 1712 1 1 23 LEU O O 3.948 8.967 2.837 1.00 . A A . 23 LEU O 1 1 4 1713 1 1 24 GLY C C 1.047 8.049 2.604 1.00 . A A . 24 GLY C 1 1 4 1714 1 1 24 GLY CA C 1.511 8.663 3.934 1.00 . A A . 24 GLY CA 1 1 4 1715 1 1 24 GLY H H 2.731 7.377 5.163 1.00 . A A . 24 GLY H 1 1 4 1716 1 1 24 GLY HA2 H 0.737 8.533 4.677 1.00 . A A . 24 GLY HA2 1 1 4 1717 1 1 24 GLY HA3 H 1.703 9.713 3.793 1.00 . A A . 24 GLY HA3 1 1 4 1718 1 1 24 GLY N N 2.764 7.989 4.401 1.00 . A A . 24 GLY N 1 1 4 1719 1 1 24 GLY O O 0.072 8.486 2.020 1.00 . A A . 24 GLY O 1 1 4 1720 1 1 25 ILE C C 1.818 4.928 0.868 1.00 . A A . 25 ILE C 1 1 4 1721 1 1 25 ILE CA C 1.346 6.382 0.841 1.00 . A A . 25 ILE CA 1 1 4 1722 1 1 25 ILE CB C 2.068 7.119 -0.303 1.00 . A A . 25 ILE CB 1 1 4 1723 1 1 25 ILE CD1 C 3.451 9.071 -1.000 1.00 . A A . 25 ILE CD1 1 1 4 1724 1 1 25 ILE CG1 C 2.781 8.382 0.189 1.00 . A A . 25 ILE CG1 1 1 4 1725 1 1 25 ILE CG2 C 1.055 7.511 -1.368 1.00 . A A . 25 ILE CG2 1 1 4 1726 1 1 25 ILE H H 2.513 6.701 2.613 1.00 . A A . 25 ILE H 1 1 4 1727 1 1 25 ILE HA H 0.278 6.435 0.699 1.00 . A A . 25 ILE HA 1 1 4 1728 1 1 25 ILE HB H 2.788 6.450 -0.741 1.00 . A A . 25 ILE HB 1 1 4 1729 1 1 25 ILE HD11 H 2.713 9.264 -1.766 1.00 . A A . 25 ILE HD11 1 1 4 1730 1 1 25 ILE HD12 H 4.221 8.429 -1.399 1.00 . A A . 25 ILE HD12 1 1 4 1731 1 1 25 ILE HD13 H 3.888 10.004 -0.678 1.00 . A A . 25 ILE HD13 1 1 4 1732 1 1 25 ILE HG12 H 2.062 9.051 0.640 1.00 . A A . 25 ILE HG12 1 1 4 1733 1 1 25 ILE HG13 H 3.531 8.114 0.917 1.00 . A A . 25 ILE HG13 1 1 4 1734 1 1 25 ILE HG21 H 0.276 8.111 -0.922 1.00 . A A . 25 ILE HG21 1 1 4 1735 1 1 25 ILE HG22 H 0.626 6.619 -1.797 1.00 . A A . 25 ILE HG22 1 1 4 1736 1 1 25 ILE HG23 H 1.552 8.079 -2.141 1.00 . A A . 25 ILE HG23 1 1 4 1737 1 1 25 ILE N N 1.737 7.039 2.122 1.00 . A A . 25 ILE N 1 1 4 1738 1 1 25 ILE O O 2.423 4.482 1.826 1.00 . A A . 25 ILE O 1 1 4 1739 1 1 26 CYS C C 3.445 2.716 -0.823 1.00 . A A . 26 CYS C 1 1 4 1740 1 1 26 CYS CA C 2.048 2.779 -0.198 1.00 . A A . 26 CYS CA 1 1 4 1741 1 1 26 CYS CB C 1.019 2.014 -1.033 1.00 . A A . 26 CYS CB 1 1 4 1742 1 1 26 CYS H H 1.110 4.571 -0.964 1.00 . A A . 26 CYS H 1 1 4 1743 1 1 26 CYS HA H 2.072 2.388 0.804 1.00 . A A . 26 CYS HA 1 1 4 1744 1 1 26 CYS HB2 H 0.633 2.656 -1.807 1.00 . A A . 26 CYS HB2 1 1 4 1745 1 1 26 CYS HB3 H 1.486 1.154 -1.485 1.00 . A A . 26 CYS HB3 1 1 4 1746 1 1 26 CYS N N 1.578 4.192 -0.179 1.00 . A A . 26 CYS N 1 1 4 1747 1 1 26 CYS O O 3.663 3.204 -1.915 1.00 . A A . 26 CYS O 1 1 4 1748 1 1 26 CYS SG S -0.332 1.471 0.048 1.00 . A A . 26 CYS SG 1 1 4 1749 1 1 27 MET C C 6.551 0.849 -0.177 1.00 . A A . 27 MET C 1 1 4 1750 1 1 27 MET CA C 5.775 2.067 -0.712 1.00 . A A . 27 MET CA 1 1 4 1751 1 1 27 MET CB C 6.440 3.390 -0.299 1.00 . A A . 27 MET CB 1 1 4 1752 1 1 27 MET CE C 7.553 3.091 -3.456 1.00 . A A . 27 MET CE 1 1 4 1753 1 1 27 MET CG C 6.310 4.414 -1.427 1.00 . A A . 27 MET CG 1 1 4 1754 1 1 27 MET H H 4.213 1.747 0.743 1.00 . A A . 27 MET H 1 1 4 1755 1 1 27 MET HA H 5.720 2.012 -1.784 1.00 . A A . 27 MET HA 1 1 4 1756 1 1 27 MET HB2 H 5.953 3.775 0.587 1.00 . A A . 27 MET HB2 1 1 4 1757 1 1 27 MET HB3 H 7.484 3.219 -0.085 1.00 . A A . 27 MET HB3 1 1 4 1758 1 1 27 MET HE1 H 6.515 3.093 -3.760 1.00 . A A . 27 MET HE1 1 1 4 1759 1 1 27 MET HE2 H 7.773 2.171 -2.940 1.00 . A A . 27 MET HE2 1 1 4 1760 1 1 27 MET HE3 H 8.189 3.174 -4.329 1.00 . A A . 27 MET HE3 1 1 4 1761 1 1 27 MET HG2 H 5.508 4.120 -2.088 1.00 . A A . 27 MET HG2 1 1 4 1762 1 1 27 MET HG3 H 6.091 5.382 -1.006 1.00 . A A . 27 MET HG3 1 1 4 1763 1 1 27 MET N N 4.401 2.134 -0.140 1.00 . A A . 27 MET N 1 1 4 1764 1 1 27 MET O O 6.792 -0.088 -0.917 1.00 . A A . 27 MET O 1 1 4 1765 1 1 27 MET SD S 7.864 4.495 -2.356 1.00 . A A . 27 MET SD 1 1 4 1766 1 1 28 PRO C C 6.817 -1.412 1.989 1.00 . A A . 28 PRO C 1 1 4 1767 1 1 28 PRO CA C 7.729 -0.215 1.681 1.00 . A A . 28 PRO CA 1 1 4 1768 1 1 28 PRO CB C 8.293 0.400 2.968 1.00 . A A . 28 PRO CB 1 1 4 1769 1 1 28 PRO CD C 6.705 1.979 2.046 1.00 . A A . 28 PRO CD 1 1 4 1770 1 1 28 PRO CG C 7.341 1.495 3.322 1.00 . A A . 28 PRO CG 1 1 4 1771 1 1 28 PRO HA H 8.533 -0.511 1.025 1.00 . A A . 28 PRO HA 1 1 4 1772 1 1 28 PRO HB2 H 8.324 -0.338 3.757 1.00 . A A . 28 PRO HB2 1 1 4 1773 1 1 28 PRO HB3 H 9.276 0.811 2.791 1.00 . A A . 28 PRO HB3 1 1 4 1774 1 1 28 PRO HD2 H 5.644 2.141 2.189 1.00 . A A . 28 PRO HD2 1 1 4 1775 1 1 28 PRO HD3 H 7.187 2.880 1.715 1.00 . A A . 28 PRO HD3 1 1 4 1776 1 1 28 PRO HG2 H 6.585 1.113 3.992 1.00 . A A . 28 PRO HG2 1 1 4 1777 1 1 28 PRO HG3 H 7.870 2.311 3.791 1.00 . A A . 28 PRO HG3 1 1 4 1778 1 1 28 PRO N N 6.944 0.900 1.080 1.00 . A A . 28 PRO N 1 1 4 1779 1 1 28 PRO O O 6.514 -1.689 3.134 1.00 . A A . 28 PRO O 1 1 4 1780 1 1 29 ARG C C 6.078 -4.290 2.170 1.00 . A A . 29 ARG C 1 1 4 1781 1 1 29 ARG CA C 5.476 -3.295 1.163 1.00 . A A . 29 ARG CA 1 1 4 1782 1 1 29 ARG CB C 5.341 -3.945 -0.225 1.00 . A A . 29 ARG CB 1 1 4 1783 1 1 29 ARG CD C 7.047 -5.767 -0.473 1.00 . A A . 29 ARG CD 1 1 4 1784 1 1 29 ARG CG C 6.727 -4.301 -0.788 1.00 . A A . 29 ARG CG 1 1 4 1785 1 1 29 ARG CZ C 6.336 -6.795 -2.583 1.00 . A A . 29 ARG CZ 1 1 4 1786 1 1 29 ARG H H 6.644 -1.839 0.062 1.00 . A A . 29 ARG H 1 1 4 1787 1 1 29 ARG HA H 4.504 -2.971 1.501 1.00 . A A . 29 ARG HA 1 1 4 1788 1 1 29 ARG HB2 H 4.744 -4.845 -0.143 1.00 . A A . 29 ARG HB2 1 1 4 1789 1 1 29 ARG HB3 H 4.851 -3.253 -0.890 1.00 . A A . 29 ARG HB3 1 1 4 1790 1 1 29 ARG HD2 H 8.074 -5.994 -0.732 1.00 . A A . 29 ARG HD2 1 1 4 1791 1 1 29 ARG HD3 H 6.876 -5.968 0.577 1.00 . A A . 29 ARG HD3 1 1 4 1792 1 1 29 ARG HE H 5.280 -6.943 -0.898 1.00 . A A . 29 ARG HE 1 1 4 1793 1 1 29 ARG HG2 H 6.731 -4.152 -1.860 1.00 . A A . 29 ARG HG2 1 1 4 1794 1 1 29 ARG HG3 H 7.472 -3.665 -0.334 1.00 . A A . 29 ARG HG3 1 1 4 1795 1 1 29 ARG HH11 H 8.055 -5.750 -2.630 1.00 . A A . 29 ARG HH11 1 1 4 1796 1 1 29 ARG HH12 H 7.586 -6.474 -4.127 1.00 . A A . 29 ARG HH12 1 1 4 1797 1 1 29 ARG HH21 H 4.678 -7.896 -2.841 1.00 . A A . 29 ARG HH21 1 1 4 1798 1 1 29 ARG HH22 H 5.669 -7.700 -4.246 1.00 . A A . 29 ARG HH22 1 1 4 1799 1 1 29 ARG N N 6.381 -2.107 0.967 1.00 . A A . 29 ARG N 1 1 4 1800 1 1 29 ARG NE N 6.095 -6.570 -1.312 1.00 . A A . 29 ARG NE 1 1 4 1801 1 1 29 ARG NH1 N 7.410 -6.304 -3.157 1.00 . A A . 29 ARG NH1 1 1 4 1802 1 1 29 ARG NH2 N 5.498 -7.518 -3.278 1.00 . A A . 29 ARG NH2 1 1 4 1803 1 1 29 ARG O O 7.295 -4.387 2.240 1.00 . A A . 29 ARG O 1 1 4 1804 1 1 29 ARG OXT O 5.307 -4.943 2.853 1.00 . A A . 29 ARG OXT 1 1 5 1805 1 1 1 GLY C C -9.948 0.147 -4.547 1.00 . A A . 1 GLY C 1 1 5 1806 1 1 1 GLY CA C -11.211 0.056 -5.412 1.00 . A A . 1 GLY CA 1 1 5 1807 1 1 1 GLY H1 H -13.028 0.917 -4.855 1.00 . A A . 1 GLY H1 1 1 5 1808 1 1 1 GLY H2 H -12.134 0.286 -3.554 1.00 . A A . 1 GLY H2 1 1 5 1809 1 1 1 GLY H3 H -12.952 -0.760 -4.615 1.00 . A A . 1 GLY H3 1 1 5 1810 1 1 1 GLY HA2 H -11.214 -0.885 -5.945 1.00 . A A . 1 GLY HA2 1 1 5 1811 1 1 1 GLY HA3 H -11.222 0.870 -6.121 1.00 . A A . 1 GLY HA3 1 1 5 1812 1 1 1 GLY N N -12.424 0.133 -4.543 1.00 . A A . 1 GLY N 1 1 5 1813 1 1 1 GLY O O -10.024 0.202 -3.334 1.00 . A A . 1 GLY O 1 1 5 1814 1 1 2 CYS C C -6.572 1.262 -5.033 1.00 . A A . 2 CYS C 1 1 5 1815 1 1 2 CYS CA C -7.516 0.256 -4.369 1.00 . A A . 2 CYS CA 1 1 5 1816 1 1 2 CYS CB C -6.911 -1.154 -4.394 1.00 . A A . 2 CYS CB 1 1 5 1817 1 1 2 CYS H H -8.750 0.124 -6.136 1.00 . A A . 2 CYS H 1 1 5 1818 1 1 2 CYS HA H -7.723 0.550 -3.352 1.00 . A A . 2 CYS HA 1 1 5 1819 1 1 2 CYS HB2 H -5.940 -1.132 -3.923 1.00 . A A . 2 CYS HB2 1 1 5 1820 1 1 2 CYS HB3 H -7.556 -1.829 -3.852 1.00 . A A . 2 CYS HB3 1 1 5 1821 1 1 2 CYS N N -8.788 0.164 -5.155 1.00 . A A . 2 CYS N 1 1 5 1822 1 1 2 CYS O O -6.843 1.754 -6.115 1.00 . A A . 2 CYS O 1 1 5 1823 1 1 2 CYS SG S -6.739 -1.732 -6.105 1.00 . A A . 2 CYS SG 1 1 5 1824 1 1 3 LYS C C -3.176 1.848 -5.311 1.00 . A A . 3 LYS C 1 1 5 1825 1 1 3 LYS CA C -4.512 2.542 -5.029 1.00 . A A . 3 LYS CA 1 1 5 1826 1 1 3 LYS CB C -4.323 3.675 -4.013 1.00 . A A . 3 LYS CB 1 1 5 1827 1 1 3 LYS CD C -5.500 4.857 -2.135 1.00 . A A . 3 LYS CD 1 1 5 1828 1 1 3 LYS CE C -6.649 5.848 -1.890 1.00 . A A . 3 LYS CE 1 1 5 1829 1 1 3 LYS CG C -5.681 4.175 -3.499 1.00 . A A . 3 LYS CG 1 1 5 1830 1 1 3 LYS H H -5.262 1.163 -3.540 1.00 . A A . 3 LYS H 1 1 5 1831 1 1 3 LYS HA H -4.924 2.936 -5.944 1.00 . A A . 3 LYS HA 1 1 5 1832 1 1 3 LYS HB2 H -3.723 3.325 -3.185 1.00 . A A . 3 LYS HB2 1 1 5 1833 1 1 3 LYS HB3 H -3.812 4.488 -4.497 1.00 . A A . 3 LYS HB3 1 1 5 1834 1 1 3 LYS HD2 H -5.496 4.110 -1.357 1.00 . A A . 3 LYS HD2 1 1 5 1835 1 1 3 LYS HD3 H -4.561 5.393 -2.124 1.00 . A A . 3 LYS HD3 1 1 5 1836 1 1 3 LYS HE2 H -6.280 6.729 -1.377 1.00 . A A . 3 LYS HE2 1 1 5 1837 1 1 3 LYS HE3 H -7.116 6.128 -2.824 1.00 . A A . 3 LYS HE3 1 1 5 1838 1 1 3 LYS HG2 H -6.092 4.884 -4.204 1.00 . A A . 3 LYS HG2 1 1 5 1839 1 1 3 LYS HG3 H -6.356 3.345 -3.397 1.00 . A A . 3 LYS HG3 1 1 5 1840 1 1 3 LYS HZ1 H -7.910 4.231 -1.499 1.00 . A A . 3 LYS HZ1 1 1 5 1841 1 1 3 LYS HZ2 H -8.459 5.709 -0.873 1.00 . A A . 3 LYS HZ2 1 1 5 1842 1 1 3 LYS HZ3 H -7.180 4.887 -0.108 1.00 . A A . 3 LYS HZ3 1 1 5 1843 1 1 3 LYS N N -5.467 1.571 -4.409 1.00 . A A . 3 LYS N 1 1 5 1844 1 1 3 LYS NZ N -7.623 5.114 -1.031 1.00 . A A . 3 LYS NZ 1 1 5 1845 1 1 3 LYS O O -2.939 0.740 -4.865 1.00 . A A . 3 LYS O 1 1 5 1846 1 1 4 LEU C C 0.007 2.148 -5.221 1.00 . A A . 4 LEU C 1 1 5 1847 1 1 4 LEU CA C -0.984 1.888 -6.371 1.00 . A A . 4 LEU CA 1 1 5 1848 1 1 4 LEU CB C -0.536 2.577 -7.673 1.00 . A A . 4 LEU CB 1 1 5 1849 1 1 4 LEU CD1 C -1.259 0.505 -8.881 1.00 . A A . 4 LEU CD1 1 1 5 1850 1 1 4 LEU CD2 C -2.780 2.474 -8.786 1.00 . A A . 4 LEU CD2 1 1 5 1851 1 1 4 LEU CG C -1.321 2.030 -8.871 1.00 . A A . 4 LEU CG 1 1 5 1852 1 1 4 LEU H H -2.532 3.381 -6.392 1.00 . A A . 4 LEU H 1 1 5 1853 1 1 4 LEU HA H -1.091 0.826 -6.537 1.00 . A A . 4 LEU HA 1 1 5 1854 1 1 4 LEU HB2 H -0.704 3.638 -7.595 1.00 . A A . 4 LEU HB2 1 1 5 1855 1 1 4 LEU HB3 H 0.512 2.396 -7.837 1.00 . A A . 4 LEU HB3 1 1 5 1856 1 1 4 LEU HD11 H -1.443 0.146 -9.884 1.00 . A A . 4 LEU HD11 1 1 5 1857 1 1 4 LEU HD12 H -2.013 0.112 -8.216 1.00 . A A . 4 LEU HD12 1 1 5 1858 1 1 4 LEU HD13 H -0.283 0.180 -8.556 1.00 . A A . 4 LEU HD13 1 1 5 1859 1 1 4 LEU HD21 H -3.201 2.513 -9.779 1.00 . A A . 4 LEU HD21 1 1 5 1860 1 1 4 LEU HD22 H -2.830 3.452 -8.334 1.00 . A A . 4 LEU HD22 1 1 5 1861 1 1 4 LEU HD23 H -3.332 1.769 -8.187 1.00 . A A . 4 LEU HD23 1 1 5 1862 1 1 4 LEU HG H -0.883 2.408 -9.782 1.00 . A A . 4 LEU HG 1 1 5 1863 1 1 4 LEU N N -2.309 2.494 -6.047 1.00 . A A . 4 LEU N 1 1 5 1864 1 1 4 LEU O O -0.341 2.005 -4.061 1.00 . A A . 4 LEU O 1 1 5 1865 1 1 5 THR C C 2.148 4.206 -3.927 1.00 . A A . 5 THR C 1 1 5 1866 1 1 5 THR CA C 2.229 2.753 -4.438 1.00 . A A . 5 THR CA 1 1 5 1867 1 1 5 THR CB C 3.600 2.465 -5.089 1.00 . A A . 5 THR CB 1 1 5 1868 1 1 5 THR CG2 C 4.360 1.422 -4.267 1.00 . A A . 5 THR CG2 1 1 5 1869 1 1 5 THR H H 1.505 2.612 -6.454 1.00 . A A . 5 THR H 1 1 5 1870 1 1 5 THR HA H 2.064 2.068 -3.623 1.00 . A A . 5 THR HA 1 1 5 1871 1 1 5 THR HB H 4.175 3.370 -5.121 1.00 . A A . 5 THR HB 1 1 5 1872 1 1 5 THR HG1 H 4.231 1.514 -6.677 1.00 . A A . 5 THR HG1 1 1 5 1873 1 1 5 THR HG21 H 4.611 1.829 -3.298 1.00 . A A . 5 THR HG21 1 1 5 1874 1 1 5 THR HG22 H 5.265 1.141 -4.789 1.00 . A A . 5 THR HG22 1 1 5 1875 1 1 5 THR HG23 H 3.738 0.555 -4.137 1.00 . A A . 5 THR HG23 1 1 5 1876 1 1 5 THR N N 1.230 2.512 -5.518 1.00 . A A . 5 THR N 1 1 5 1877 1 1 5 THR O O 1.675 4.465 -2.835 1.00 . A A . 5 THR O 1 1 5 1878 1 1 5 THR OG1 O 3.424 1.977 -6.418 1.00 . A A . 5 THR OG1 1 1 5 1879 1 1 6 PHE C C 1.149 7.166 -4.242 1.00 . A A . 6 PHE C 1 1 5 1880 1 1 6 PHE CA C 2.572 6.588 -4.246 1.00 . A A . 6 PHE CA 1 1 5 1881 1 1 6 PHE CB C 3.461 7.344 -5.240 1.00 . A A . 6 PHE CB 1 1 5 1882 1 1 6 PHE CD1 C 5.442 6.870 -3.738 1.00 . A A . 6 PHE CD1 1 1 5 1883 1 1 6 PHE CD2 C 5.222 9.077 -4.716 1.00 . A A . 6 PHE CD2 1 1 5 1884 1 1 6 PHE CE1 C 6.627 7.269 -3.104 1.00 . A A . 6 PHE CE1 1 1 5 1885 1 1 6 PHE CE2 C 6.408 9.474 -4.082 1.00 . A A . 6 PHE CE2 1 1 5 1886 1 1 6 PHE CG C 4.739 7.775 -4.551 1.00 . A A . 6 PHE CG 1 1 5 1887 1 1 6 PHE CZ C 7.108 8.571 -3.272 1.00 . A A . 6 PHE CZ 1 1 5 1888 1 1 6 PHE H H 2.978 4.936 -5.568 1.00 . A A . 6 PHE H 1 1 5 1889 1 1 6 PHE HA H 2.998 6.668 -3.261 1.00 . A A . 6 PHE HA 1 1 5 1890 1 1 6 PHE HB2 H 3.700 6.703 -6.074 1.00 . A A . 6 PHE HB2 1 1 5 1891 1 1 6 PHE HB3 H 2.934 8.219 -5.596 1.00 . A A . 6 PHE HB3 1 1 5 1892 1 1 6 PHE HD1 H 5.076 5.861 -3.605 1.00 . A A . 6 PHE HD1 1 1 5 1893 1 1 6 PHE HD2 H 4.686 9.775 -5.339 1.00 . A A . 6 PHE HD2 1 1 5 1894 1 1 6 PHE HE1 H 7.168 6.570 -2.478 1.00 . A A . 6 PHE HE1 1 1 5 1895 1 1 6 PHE HE2 H 6.782 10.481 -4.212 1.00 . A A . 6 PHE HE2 1 1 5 1896 1 1 6 PHE HZ H 8.022 8.879 -2.784 1.00 . A A . 6 PHE HZ 1 1 5 1897 1 1 6 PHE N N 2.606 5.158 -4.699 1.00 . A A . 6 PHE N 1 1 5 1898 1 1 6 PHE O O 0.953 8.339 -4.492 1.00 . A A . 6 PHE O 1 1 5 1899 1 1 7 TRP C C -1.609 7.141 -2.410 1.00 . A A . 7 TRP C 1 1 5 1900 1 1 7 TRP CA C -1.229 6.923 -3.870 1.00 . A A . 7 TRP CA 1 1 5 1901 1 1 7 TRP CB C -2.117 5.851 -4.498 1.00 . A A . 7 TRP CB 1 1 5 1902 1 1 7 TRP CD1 C -0.695 5.768 -6.594 1.00 . A A . 7 TRP CD1 1 1 5 1903 1 1 7 TRP CD2 C -2.898 5.805 -7.038 1.00 . A A . 7 TRP CD2 1 1 5 1904 1 1 7 TRP CE2 C -2.232 5.768 -8.285 1.00 . A A . 7 TRP CE2 1 1 5 1905 1 1 7 TRP CE3 C -4.301 5.823 -7.034 1.00 . A A . 7 TRP CE3 1 1 5 1906 1 1 7 TRP CG C -1.900 5.809 -5.978 1.00 . A A . 7 TRP CG 1 1 5 1907 1 1 7 TRP CH2 C -4.333 5.776 -9.470 1.00 . A A . 7 TRP CH2 1 1 5 1908 1 1 7 TRP CZ2 C -2.938 5.755 -9.489 1.00 . A A . 7 TRP CZ2 1 1 5 1909 1 1 7 TRP CZ3 C -5.013 5.810 -8.245 1.00 . A A . 7 TRP CZ3 1 1 5 1910 1 1 7 TRP H H 0.310 5.440 -3.686 1.00 . A A . 7 TRP H 1 1 5 1911 1 1 7 TRP HA H -1.299 7.844 -4.430 1.00 . A A . 7 TRP HA 1 1 5 1912 1 1 7 TRP HB2 H -1.888 4.886 -4.068 1.00 . A A . 7 TRP HB2 1 1 5 1913 1 1 7 TRP HB3 H -3.149 6.095 -4.295 1.00 . A A . 7 TRP HB3 1 1 5 1914 1 1 7 TRP HD1 H 0.266 5.754 -6.100 1.00 . A A . 7 TRP HD1 1 1 5 1915 1 1 7 TRP HE1 H -0.182 5.738 -8.631 1.00 . A A . 7 TRP HE1 1 1 5 1916 1 1 7 TRP HE3 H -4.835 5.850 -6.093 1.00 . A A . 7 TRP HE3 1 1 5 1917 1 1 7 TRP HH2 H -4.889 5.761 -10.398 1.00 . A A . 7 TRP HH2 1 1 5 1918 1 1 7 TRP HZ2 H -2.407 5.724 -10.430 1.00 . A A . 7 TRP HZ2 1 1 5 1919 1 1 7 TRP HZ3 H -6.091 5.825 -8.233 1.00 . A A . 7 TRP HZ3 1 1 5 1920 1 1 7 TRP N N 0.153 6.378 -3.921 1.00 . A A . 7 TRP N 1 1 5 1921 1 1 7 TRP NE1 N -0.892 5.757 -7.959 1.00 . A A . 7 TRP NE1 1 1 5 1922 1 1 7 TRP O O -1.558 6.216 -1.621 1.00 . A A . 7 TRP O 1 1 5 1923 1 1 8 LYS C C -3.271 7.530 -0.078 1.00 . A A . 8 LYS C 1 1 5 1924 1 1 8 LYS CA C -2.332 8.626 -0.605 1.00 . A A . 8 LYS CA 1 1 5 1925 1 1 8 LYS CB C -3.039 9.986 -0.617 1.00 . A A . 8 LYS CB 1 1 5 1926 1 1 8 LYS CD C -1.247 11.664 -1.135 1.00 . A A . 8 LYS CD 1 1 5 1927 1 1 8 LYS CE C -0.578 12.948 -0.620 1.00 . A A . 8 LYS CE 1 1 5 1928 1 1 8 LYS CG C -2.113 11.056 -0.026 1.00 . A A . 8 LYS CG 1 1 5 1929 1 1 8 LYS H H -1.976 9.073 -2.689 1.00 . A A . 8 LYS H 1 1 5 1930 1 1 8 LYS HA H -1.440 8.679 0.003 1.00 . A A . 8 LYS HA 1 1 5 1931 1 1 8 LYS HB2 H -3.299 10.249 -1.633 1.00 . A A . 8 LYS HB2 1 1 5 1932 1 1 8 LYS HB3 H -3.936 9.923 -0.021 1.00 . A A . 8 LYS HB3 1 1 5 1933 1 1 8 LYS HD2 H -0.486 10.951 -1.423 1.00 . A A . 8 LYS HD2 1 1 5 1934 1 1 8 LYS HD3 H -1.865 11.896 -1.987 1.00 . A A . 8 LYS HD3 1 1 5 1935 1 1 8 LYS HE2 H -1.000 13.234 0.334 1.00 . A A . 8 LYS HE2 1 1 5 1936 1 1 8 LYS HE3 H 0.489 12.802 -0.528 1.00 . A A . 8 LYS HE3 1 1 5 1937 1 1 8 LYS HG2 H -2.711 11.830 0.432 1.00 . A A . 8 LYS HG2 1 1 5 1938 1 1 8 LYS HG3 H -1.474 10.605 0.722 1.00 . A A . 8 LYS HG3 1 1 5 1939 1 1 8 LYS HZ1 H -1.889 14.071 -1.791 1.00 . A A . 8 LYS HZ1 1 1 5 1940 1 1 8 LYS HZ2 H -0.409 13.731 -2.551 1.00 . A A . 8 LYS HZ2 1 1 5 1941 1 1 8 LYS HZ3 H -0.492 14.908 -1.327 1.00 . A A . 8 LYS HZ3 1 1 5 1942 1 1 8 LYS N N -1.963 8.348 -2.034 1.00 . A A . 8 LYS N 1 1 5 1943 1 1 8 LYS NZ N -0.864 13.990 -1.650 1.00 . A A . 8 LYS NZ 1 1 5 1944 1 1 8 LYS O O -4.454 7.517 -0.371 1.00 . A A . 8 LYS O 1 1 5 1945 1 1 9 CYS C C -3.861 5.615 2.697 1.00 . A A . 9 CYS C 1 1 5 1946 1 1 9 CYS CA C -3.606 5.484 1.189 1.00 . A A . 9 CYS CA 1 1 5 1947 1 1 9 CYS CB C -2.828 4.198 0.890 1.00 . A A . 9 CYS CB 1 1 5 1948 1 1 9 CYS H H -1.783 6.618 0.872 1.00 . A A . 9 CYS H 1 1 5 1949 1 1 9 CYS HA H -4.546 5.470 0.659 1.00 . A A . 9 CYS HA 1 1 5 1950 1 1 9 CYS HB2 H -3.337 3.360 1.338 1.00 . A A . 9 CYS HB2 1 1 5 1951 1 1 9 CYS HB3 H -2.775 4.054 -0.180 1.00 . A A . 9 CYS HB3 1 1 5 1952 1 1 9 CYS N N -2.747 6.598 0.673 1.00 . A A . 9 CYS N 1 1 5 1953 1 1 9 CYS O O -3.369 6.515 3.352 1.00 . A A . 9 CYS O 1 1 5 1954 1 1 9 CYS SG S -1.147 4.316 1.567 1.00 . A A . 9 CYS SG 1 1 5 1955 1 1 10 LYS C C -4.303 3.532 5.391 1.00 . A A . 10 LYS C 1 1 5 1956 1 1 10 LYS CA C -4.946 4.746 4.702 1.00 . A A . 10 LYS CA 1 1 5 1957 1 1 10 LYS CB C -6.480 4.679 4.749 1.00 . A A . 10 LYS CB 1 1 5 1958 1 1 10 LYS CD C -8.490 4.529 6.229 1.00 . A A . 10 LYS CD 1 1 5 1959 1 1 10 LYS CE C -9.126 3.132 6.160 1.00 . A A . 10 LYS CE 1 1 5 1960 1 1 10 LYS CG C -6.964 4.406 6.176 1.00 . A A . 10 LYS CG 1 1 5 1961 1 1 10 LYS H H -5.018 4.004 2.686 1.00 . A A . 10 LYS H 1 1 5 1962 1 1 10 LYS HA H -4.598 5.665 5.144 1.00 . A A . 10 LYS HA 1 1 5 1963 1 1 10 LYS HB2 H -6.886 5.620 4.407 1.00 . A A . 10 LYS HB2 1 1 5 1964 1 1 10 LYS HB3 H -6.819 3.888 4.100 1.00 . A A . 10 LYS HB3 1 1 5 1965 1 1 10 LYS HD2 H -8.776 5.007 7.158 1.00 . A A . 10 LYS HD2 1 1 5 1966 1 1 10 LYS HD3 H -8.837 5.125 5.399 1.00 . A A . 10 LYS HD3 1 1 5 1967 1 1 10 LYS HE2 H -8.637 2.468 6.863 1.00 . A A . 10 LYS HE2 1 1 5 1968 1 1 10 LYS HE3 H -10.183 3.192 6.374 1.00 . A A . 10 LYS HE3 1 1 5 1969 1 1 10 LYS HG2 H -6.671 3.410 6.474 1.00 . A A . 10 LYS HG2 1 1 5 1970 1 1 10 LYS HG3 H -6.524 5.128 6.848 1.00 . A A . 10 LYS HG3 1 1 5 1971 1 1 10 LYS HZ1 H -9.737 2.087 4.457 1.00 . A A . 10 LYS HZ1 1 1 5 1972 1 1 10 LYS HZ2 H -8.057 2.050 4.720 1.00 . A A . 10 LYS HZ2 1 1 5 1973 1 1 10 LYS HZ3 H -8.796 3.455 4.111 1.00 . A A . 10 LYS HZ3 1 1 5 1974 1 1 10 LYS N N -4.635 4.713 3.243 1.00 . A A . 10 LYS N 1 1 5 1975 1 1 10 LYS NZ N -8.915 2.649 4.760 1.00 . A A . 10 LYS NZ 1 1 5 1976 1 1 10 LYS O O -3.536 3.670 6.324 1.00 . A A . 10 LYS O 1 1 5 1977 1 1 11 ASN C C -3.175 0.357 4.487 1.00 . A A . 11 ASN C 1 1 5 1978 1 1 11 ASN CA C -3.988 1.120 5.542 1.00 . A A . 11 ASN CA 1 1 5 1979 1 1 11 ASN CB C -5.162 0.284 6.074 1.00 . A A . 11 ASN CB 1 1 5 1980 1 1 11 ASN CG C -6.204 0.051 4.982 1.00 . A A . 11 ASN CG 1 1 5 1981 1 1 11 ASN H H -5.208 2.251 4.163 1.00 . A A . 11 ASN H 1 1 5 1982 1 1 11 ASN HA H -3.345 1.409 6.363 1.00 . A A . 11 ASN HA 1 1 5 1983 1 1 11 ASN HB2 H -4.790 -0.669 6.419 1.00 . A A . 11 ASN HB2 1 1 5 1984 1 1 11 ASN HB3 H -5.624 0.807 6.897 1.00 . A A . 11 ASN HB3 1 1 5 1985 1 1 11 ASN HD21 H -5.644 -1.818 4.645 1.00 . A A . 11 ASN HD21 1 1 5 1986 1 1 11 ASN HD22 H -6.929 -1.261 3.689 1.00 . A A . 11 ASN HD22 1 1 5 1987 1 1 11 ASN N N -4.596 2.342 4.925 1.00 . A A . 11 ASN N 1 1 5 1988 1 1 11 ASN ND2 N -6.264 -1.104 4.390 1.00 . A A . 11 ASN ND2 1 1 5 1989 1 1 11 ASN O O -3.205 0.683 3.315 1.00 . A A . 11 ASN O 1 1 5 1990 1 1 11 ASN OD1 O -6.986 0.930 4.676 1.00 . A A . 11 ASN OD1 1 1 5 1991 1 1 12 LYS C C -2.437 -2.233 2.933 1.00 . A A . 12 LYS C 1 1 5 1992 1 1 12 LYS CA C -1.579 -1.389 3.901 1.00 . A A . 12 LYS CA 1 1 5 1993 1 1 12 LYS CB C -0.647 -2.279 4.750 1.00 . A A . 12 LYS CB 1 1 5 1994 1 1 12 LYS CD C -0.459 -4.363 6.139 1.00 . A A . 12 LYS CD 1 1 5 1995 1 1 12 LYS CE C -0.124 -5.538 5.209 1.00 . A A . 12 LYS CE 1 1 5 1996 1 1 12 LYS CG C -1.435 -3.410 5.433 1.00 . A A . 12 LYS CG 1 1 5 1997 1 1 12 LYS H H -2.388 -0.875 5.838 1.00 . A A . 12 LYS H 1 1 5 1998 1 1 12 LYS HA H -0.981 -0.686 3.338 1.00 . A A . 12 LYS HA 1 1 5 1999 1 1 12 LYS HB2 H 0.107 -2.706 4.111 1.00 . A A . 12 LYS HB2 1 1 5 2000 1 1 12 LYS HB3 H -0.168 -1.674 5.505 1.00 . A A . 12 LYS HB3 1 1 5 2001 1 1 12 LYS HD2 H 0.446 -3.826 6.389 1.00 . A A . 12 LYS HD2 1 1 5 2002 1 1 12 LYS HD3 H -0.916 -4.740 7.042 1.00 . A A . 12 LYS HD3 1 1 5 2003 1 1 12 LYS HE2 H -0.950 -6.236 5.179 1.00 . A A . 12 LYS HE2 1 1 5 2004 1 1 12 LYS HE3 H 0.100 -5.177 4.215 1.00 . A A . 12 LYS HE3 1 1 5 2005 1 1 12 LYS HG2 H -2.110 -2.984 6.162 1.00 . A A . 12 LYS HG2 1 1 5 2006 1 1 12 LYS HG3 H -2.002 -3.960 4.695 1.00 . A A . 12 LYS HG3 1 1 5 2007 1 1 12 LYS HZ1 H 1.525 -6.812 5.103 1.00 . A A . 12 LYS HZ1 1 1 5 2008 1 1 12 LYS HZ2 H 0.800 -6.739 6.638 1.00 . A A . 12 LYS HZ2 1 1 5 2009 1 1 12 LYS HZ3 H 1.770 -5.455 6.090 1.00 . A A . 12 LYS HZ3 1 1 5 2010 1 1 12 LYS N N -2.420 -0.636 4.888 1.00 . A A . 12 LYS N 1 1 5 2011 1 1 12 LYS NZ N 1.082 -6.182 5.805 1.00 . A A . 12 LYS NZ 1 1 5 2012 1 1 12 LYS O O -2.108 -2.369 1.773 1.00 . A A . 12 LYS O 1 1 5 2013 1 1 13 LYS C C -5.195 -2.703 1.521 1.00 . A A . 13 LYS C 1 1 5 2014 1 1 13 LYS CA C -4.401 -3.610 2.483 1.00 . A A . 13 LYS CA 1 1 5 2015 1 1 13 LYS CB C -5.350 -4.380 3.408 1.00 . A A . 13 LYS CB 1 1 5 2016 1 1 13 LYS CD C -7.057 -6.233 3.518 1.00 . A A . 13 LYS CD 1 1 5 2017 1 1 13 LYS CE C -8.365 -6.371 2.721 1.00 . A A . 13 LYS CE 1 1 5 2018 1 1 13 LYS CG C -5.983 -5.560 2.646 1.00 . A A . 13 LYS CG 1 1 5 2019 1 1 13 LYS H H -3.784 -2.660 4.330 1.00 . A A . 13 LYS H 1 1 5 2020 1 1 13 LYS HA H -3.797 -4.307 1.918 1.00 . A A . 13 LYS HA 1 1 5 2021 1 1 13 LYS HB2 H -4.797 -4.755 4.256 1.00 . A A . 13 LYS HB2 1 1 5 2022 1 1 13 LYS HB3 H -6.130 -3.719 3.753 1.00 . A A . 13 LYS HB3 1 1 5 2023 1 1 13 LYS HD2 H -6.711 -7.214 3.817 1.00 . A A . 13 LYS HD2 1 1 5 2024 1 1 13 LYS HD3 H -7.235 -5.633 4.396 1.00 . A A . 13 LYS HD3 1 1 5 2025 1 1 13 LYS HE2 H -9.175 -5.879 3.243 1.00 . A A . 13 LYS HE2 1 1 5 2026 1 1 13 LYS HE3 H -8.250 -5.958 1.731 1.00 . A A . 13 LYS HE3 1 1 5 2027 1 1 13 LYS HG2 H -6.436 -5.198 1.737 1.00 . A A . 13 LYS HG2 1 1 5 2028 1 1 13 LYS HG3 H -5.218 -6.283 2.400 1.00 . A A . 13 LYS HG3 1 1 5 2029 1 1 13 LYS HZ1 H -8.840 -8.215 3.579 1.00 . A A . 13 LYS HZ1 1 1 5 2030 1 1 13 LYS HZ2 H -7.778 -8.318 2.254 1.00 . A A . 13 LYS HZ2 1 1 5 2031 1 1 13 LYS HZ3 H -9.426 -8.014 2.001 1.00 . A A . 13 LYS HZ3 1 1 5 2032 1 1 13 LYS N N -3.531 -2.788 3.394 1.00 . A A . 13 LYS N 1 1 5 2033 1 1 13 LYS NZ N -8.620 -7.840 2.633 1.00 . A A . 13 LYS NZ 1 1 5 2034 1 1 13 LYS O O -5.916 -3.184 0.672 1.00 . A A . 13 LYS O 1 1 5 2035 1 1 14 GLU C C -5.131 -0.391 -0.640 1.00 . A A . 14 GLU C 1 1 5 2036 1 1 14 GLU CA C -5.818 -0.483 0.740 1.00 . A A . 14 GLU CA 1 1 5 2037 1 1 14 GLU CB C -5.776 0.874 1.452 1.00 . A A . 14 GLU CB 1 1 5 2038 1 1 14 GLU CD C -6.949 3.079 1.454 1.00 . A A . 14 GLU CD 1 1 5 2039 1 1 14 GLU CG C -6.495 1.908 0.593 1.00 . A A . 14 GLU CG 1 1 5 2040 1 1 14 GLU H H -4.492 -1.031 2.334 1.00 . A A . 14 GLU H 1 1 5 2041 1 1 14 GLU HA H -6.841 -0.808 0.630 1.00 . A A . 14 GLU HA 1 1 5 2042 1 1 14 GLU HB2 H -6.269 0.796 2.408 1.00 . A A . 14 GLU HB2 1 1 5 2043 1 1 14 GLU HB3 H -4.749 1.176 1.593 1.00 . A A . 14 GLU HB3 1 1 5 2044 1 1 14 GLU HG2 H -5.824 2.260 -0.176 1.00 . A A . 14 GLU HG2 1 1 5 2045 1 1 14 GLU HG3 H -7.352 1.448 0.136 1.00 . A A . 14 GLU HG3 1 1 5 2046 1 1 14 GLU N N -5.073 -1.404 1.646 1.00 . A A . 14 GLU N 1 1 5 2047 1 1 14 GLU O O -5.747 -0.038 -1.632 1.00 . A A . 14 GLU O 1 1 5 2048 1 1 14 GLU OE1 O -7.710 2.858 2.378 1.00 . A A . 14 GLU OE1 1 1 5 2049 1 1 14 GLU OE2 O -6.522 4.183 1.172 1.00 . A A . 14 GLU OE2 1 1 5 2050 1 1 15 CYS C C -3.561 -1.815 -2.900 1.00 . A A . 15 CYS C 1 1 5 2051 1 1 15 CYS CA C -3.159 -0.620 -2.032 1.00 . A A . 15 CYS CA 1 1 5 2052 1 1 15 CYS CB C -1.657 -0.665 -1.722 1.00 . A A . 15 CYS CB 1 1 5 2053 1 1 15 CYS H H -3.383 -0.991 0.085 1.00 . A A . 15 CYS H 1 1 5 2054 1 1 15 CYS HA H -3.403 0.303 -2.531 1.00 . A A . 15 CYS HA 1 1 5 2055 1 1 15 CYS HB2 H -1.340 -1.696 -1.656 1.00 . A A . 15 CYS HB2 1 1 5 2056 1 1 15 CYS HB3 H -1.113 -0.175 -2.518 1.00 . A A . 15 CYS HB3 1 1 5 2057 1 1 15 CYS N N -3.866 -0.702 -0.716 1.00 . A A . 15 CYS N 1 1 5 2058 1 1 15 CYS O O -3.952 -2.850 -2.394 1.00 . A A . 15 CYS O 1 1 5 2059 1 1 15 CYS SG S -1.308 0.174 -0.148 1.00 . A A . 15 CYS SG 1 1 5 2060 1 1 16 CYS C C -2.932 -3.985 -4.909 1.00 . A A . 16 CYS C 1 1 5 2061 1 1 16 CYS CA C -3.880 -2.806 -5.100 1.00 . A A . 16 CYS CA 1 1 5 2062 1 1 16 CYS CB C -3.779 -2.251 -6.523 1.00 . A A . 16 CYS CB 1 1 5 2063 1 1 16 CYS H H -3.174 -0.824 -4.583 1.00 . A A . 16 CYS H 1 1 5 2064 1 1 16 CYS HA H -4.887 -3.109 -4.895 1.00 . A A . 16 CYS HA 1 1 5 2065 1 1 16 CYS HB2 H -2.785 -1.856 -6.686 1.00 . A A . 16 CYS HB2 1 1 5 2066 1 1 16 CYS HB3 H -3.976 -3.041 -7.233 1.00 . A A . 16 CYS HB3 1 1 5 2067 1 1 16 CYS N N -3.486 -1.677 -4.199 1.00 . A A . 16 CYS N 1 1 5 2068 1 1 16 CYS O O -1.740 -3.808 -4.740 1.00 . A A . 16 CYS O 1 1 5 2069 1 1 16 CYS SG S -4.999 -0.930 -6.745 1.00 . A A . 16 CYS SG 1 1 5 2070 1 1 17 GLY C C -2.076 -6.348 -3.279 1.00 . A A . 17 GLY C 1 1 5 2071 1 1 17 GLY CA C -2.592 -6.379 -4.713 1.00 . A A . 17 GLY CA 1 1 5 2072 1 1 17 GLY H H -4.420 -5.296 -5.041 1.00 . A A . 17 GLY H 1 1 5 2073 1 1 17 GLY HA2 H -3.174 -7.277 -4.875 1.00 . A A . 17 GLY HA2 1 1 5 2074 1 1 17 GLY HA3 H -1.759 -6.360 -5.400 1.00 . A A . 17 GLY HA3 1 1 5 2075 1 1 17 GLY N N -3.455 -5.182 -4.918 1.00 . A A . 17 GLY N 1 1 5 2076 1 1 17 GLY O O -2.729 -6.819 -2.369 1.00 . A A . 17 GLY O 1 1 5 2077 1 1 18 TRP C C 0.725 -4.591 -1.643 1.00 . A A . 18 TRP C 1 1 5 2078 1 1 18 TRP CA C -0.358 -5.673 -1.694 1.00 . A A . 18 TRP CA 1 1 5 2079 1 1 18 TRP CB C 0.235 -7.048 -1.392 1.00 . A A . 18 TRP CB 1 1 5 2080 1 1 18 TRP CD1 C -1.556 -7.361 0.369 1.00 . A A . 18 TRP CD1 1 1 5 2081 1 1 18 TRP CD2 C -1.061 -9.260 -0.733 1.00 . A A . 18 TRP CD2 1 1 5 2082 1 1 18 TRP CE2 C -2.059 -9.589 0.214 1.00 . A A . 18 TRP CE2 1 1 5 2083 1 1 18 TRP CE3 C -0.569 -10.279 -1.565 1.00 . A A . 18 TRP CE3 1 1 5 2084 1 1 18 TRP CG C -0.750 -7.849 -0.606 1.00 . A A . 18 TRP CG 1 1 5 2085 1 1 18 TRP CH2 C -2.055 -11.893 -0.506 1.00 . A A . 18 TRP CH2 1 1 5 2086 1 1 18 TRP CZ2 C -2.556 -10.889 0.329 1.00 . A A . 18 TRP CZ2 1 1 5 2087 1 1 18 TRP CZ3 C -1.064 -11.588 -1.454 1.00 . A A . 18 TRP CZ3 1 1 5 2088 1 1 18 TRP H H -0.440 -5.377 -3.821 1.00 . A A . 18 TRP H 1 1 5 2089 1 1 18 TRP HA H -1.142 -5.446 -0.992 1.00 . A A . 18 TRP HA 1 1 5 2090 1 1 18 TRP HB2 H 0.452 -7.557 -2.324 1.00 . A A . 18 TRP HB2 1 1 5 2091 1 1 18 TRP HB3 H 1.144 -6.933 -0.823 1.00 . A A . 18 TRP HB3 1 1 5 2092 1 1 18 TRP HD1 H -1.589 -6.332 0.705 1.00 . A A . 18 TRP HD1 1 1 5 2093 1 1 18 TRP HE1 H -2.990 -8.319 1.583 1.00 . A A . 18 TRP HE1 1 1 5 2094 1 1 18 TRP HE3 H 0.188 -10.049 -2.299 1.00 . A A . 18 TRP HE3 1 1 5 2095 1 1 18 TRP HH2 H -2.429 -12.904 -0.422 1.00 . A A . 18 TRP HH2 1 1 5 2096 1 1 18 TRP HZ2 H -3.320 -11.119 1.064 1.00 . A A . 18 TRP HZ2 1 1 5 2097 1 1 18 TRP HZ3 H -0.676 -12.368 -2.098 1.00 . A A . 18 TRP HZ3 1 1 5 2098 1 1 18 TRP N N -0.925 -5.769 -3.070 1.00 . A A . 18 TRP N 1 1 5 2099 1 1 18 TRP NE1 N -2.328 -8.398 0.862 1.00 . A A . 18 TRP NE1 1 1 5 2100 1 1 18 TRP O O 1.539 -4.463 -2.536 1.00 . A A . 18 TRP O 1 1 5 2101 1 1 19 ASN C C 1.722 -2.290 1.035 1.00 . A A . 19 ASN C 1 1 5 2102 1 1 19 ASN CA C 1.741 -2.736 -0.431 1.00 . A A . 19 ASN CA 1 1 5 2103 1 1 19 ASN CB C 1.246 -1.610 -1.343 1.00 . A A . 19 ASN CB 1 1 5 2104 1 1 19 ASN CG C 2.402 -0.886 -2.048 1.00 . A A . 19 ASN CG 1 1 5 2105 1 1 19 ASN H H 0.056 -3.965 0.104 1.00 . A A . 19 ASN H 1 1 5 2106 1 1 19 ASN HA H 2.720 -3.075 -0.729 1.00 . A A . 19 ASN HA 1 1 5 2107 1 1 19 ASN HB2 H 0.588 -2.030 -2.094 1.00 . A A . 19 ASN HB2 1 1 5 2108 1 1 19 ASN HB3 H 0.695 -0.897 -0.753 1.00 . A A . 19 ASN HB3 1 1 5 2109 1 1 19 ASN HD21 H 3.870 -1.711 -0.983 1.00 . A A . 19 ASN HD21 1 1 5 2110 1 1 19 ASN HD22 H 4.362 -0.609 -2.179 1.00 . A A . 19 ASN HD22 1 1 5 2111 1 1 19 ASN N N 0.732 -3.826 -0.592 1.00 . A A . 19 ASN N 1 1 5 2112 1 1 19 ASN ND2 N 3.646 -1.084 -1.702 1.00 . A A . 19 ASN ND2 1 1 5 2113 1 1 19 ASN O O 1.042 -2.886 1.854 1.00 . A A . 19 ASN O 1 1 5 2114 1 1 19 ASN OD1 O 2.157 -0.107 -2.936 1.00 . A A . 19 ASN OD1 1 1 5 2115 1 1 20 ALA C C 2.157 0.714 2.858 1.00 . A A . 20 ALA C 1 1 5 2116 1 1 20 ALA CA C 2.419 -0.790 2.790 1.00 . A A . 20 ALA CA 1 1 5 2117 1 1 20 ALA CB C 3.804 -1.110 3.339 1.00 . A A . 20 ALA CB 1 1 5 2118 1 1 20 ALA H H 2.965 -0.776 0.709 1.00 . A A . 20 ALA H 1 1 5 2119 1 1 20 ALA HA H 1.673 -1.328 3.353 1.00 . A A . 20 ALA HA 1 1 5 2120 1 1 20 ALA HB1 H 3.948 -0.597 4.277 1.00 . A A . 20 ALA HB1 1 1 5 2121 1 1 20 ALA HB2 H 4.556 -0.784 2.634 1.00 . A A . 20 ALA HB2 1 1 5 2122 1 1 20 ALA HB3 H 3.897 -2.175 3.494 1.00 . A A . 20 ALA HB3 1 1 5 2123 1 1 20 ALA N N 2.433 -1.254 1.375 1.00 . A A . 20 ALA N 1 1 5 2124 1 1 20 ALA O O 2.922 1.511 2.344 1.00 . A A . 20 ALA O 1 1 5 2125 1 1 21 CYS C C 1.690 3.104 4.757 1.00 . A A . 21 CYS C 1 1 5 2126 1 1 21 CYS CA C 0.794 2.555 3.645 1.00 . A A . 21 CYS CA 1 1 5 2127 1 1 21 CYS CB C -0.690 2.616 4.026 1.00 . A A . 21 CYS CB 1 1 5 2128 1 1 21 CYS H H 0.516 0.441 3.931 1.00 . A A . 21 CYS H 1 1 5 2129 1 1 21 CYS HA H 0.969 3.075 2.716 1.00 . A A . 21 CYS HA 1 1 5 2130 1 1 21 CYS HB2 H -1.220 1.844 3.491 1.00 . A A . 21 CYS HB2 1 1 5 2131 1 1 21 CYS HB3 H -0.802 2.456 5.087 1.00 . A A . 21 CYS HB3 1 1 5 2132 1 1 21 CYS N N 1.098 1.104 3.509 1.00 . A A . 21 CYS N 1 1 5 2133 1 1 21 CYS O O 1.345 3.059 5.921 1.00 . A A . 21 CYS O 1 1 5 2134 1 1 21 CYS SG S -1.375 4.227 3.573 1.00 . A A . 21 CYS SG 1 1 5 2135 1 1 22 ALA C C 4.063 5.536 5.408 1.00 . A A . 22 ALA C 1 1 5 2136 1 1 22 ALA CA C 3.834 4.024 5.456 1.00 . A A . 22 ALA CA 1 1 5 2137 1 1 22 ALA CB C 5.131 3.282 5.117 1.00 . A A . 22 ALA CB 1 1 5 2138 1 1 22 ALA H H 3.145 3.522 3.468 1.00 . A A . 22 ALA H 1 1 5 2139 1 1 22 ALA HA H 3.498 3.730 6.436 1.00 . A A . 22 ALA HA 1 1 5 2140 1 1 22 ALA HB1 H 5.275 3.291 4.041 1.00 . A A . 22 ALA HB1 1 1 5 2141 1 1 22 ALA HB2 H 5.066 2.262 5.462 1.00 . A A . 22 ALA HB2 1 1 5 2142 1 1 22 ALA HB3 H 5.967 3.773 5.595 1.00 . A A . 22 ALA HB3 1 1 5 2143 1 1 22 ALA N N 2.872 3.547 4.411 1.00 . A A . 22 ALA N 1 1 5 2144 1 1 22 ALA O O 3.666 6.257 6.302 1.00 . A A . 22 ALA O 1 1 5 2145 1 1 23 LEU C C 3.808 8.233 3.715 1.00 . A A . 23 LEU C 1 1 5 2146 1 1 23 LEU CA C 5.018 7.490 4.302 1.00 . A A . 23 LEU CA 1 1 5 2147 1 1 23 LEU CB C 6.255 7.647 3.385 1.00 . A A . 23 LEU CB 1 1 5 2148 1 1 23 LEU CD1 C 6.875 5.632 2.022 1.00 . A A . 23 LEU CD1 1 1 5 2149 1 1 23 LEU CD2 C 8.588 6.690 3.474 1.00 . A A . 23 LEU CD2 1 1 5 2150 1 1 23 LEU CG C 7.101 6.356 3.350 1.00 . A A . 23 LEU CG 1 1 5 2151 1 1 23 LEU H H 5.043 5.414 3.690 1.00 . A A . 23 LEU H 1 1 5 2152 1 1 23 LEU HA H 5.245 7.875 5.285 1.00 . A A . 23 LEU HA 1 1 5 2153 1 1 23 LEU HB2 H 5.927 7.882 2.381 1.00 . A A . 23 LEU HB2 1 1 5 2154 1 1 23 LEU HB3 H 6.865 8.458 3.753 1.00 . A A . 23 LEU HB3 1 1 5 2155 1 1 23 LEU HD11 H 6.524 6.336 1.281 1.00 . A A . 23 LEU HD11 1 1 5 2156 1 1 23 LEU HD12 H 6.140 4.854 2.155 1.00 . A A . 23 LEU HD12 1 1 5 2157 1 1 23 LEU HD13 H 7.805 5.193 1.686 1.00 . A A . 23 LEU HD13 1 1 5 2158 1 1 23 LEU HD21 H 9.165 5.774 3.419 1.00 . A A . 23 LEU HD21 1 1 5 2159 1 1 23 LEU HD22 H 8.772 7.175 4.422 1.00 . A A . 23 LEU HD22 1 1 5 2160 1 1 23 LEU HD23 H 8.880 7.347 2.668 1.00 . A A . 23 LEU HD23 1 1 5 2161 1 1 23 LEU HG H 6.814 5.709 4.166 1.00 . A A . 23 LEU HG 1 1 5 2162 1 1 23 LEU N N 4.725 6.019 4.388 1.00 . A A . 23 LEU N 1 1 5 2163 1 1 23 LEU O O 3.924 8.987 2.771 1.00 . A A . 23 LEU O 1 1 5 2164 1 1 24 GLY C C 1.019 8.052 2.388 1.00 . A A . 24 GLY C 1 1 5 2165 1 1 24 GLY CA C 1.416 8.684 3.733 1.00 . A A . 24 GLY CA 1 1 5 2166 1 1 24 GLY H H 2.563 7.396 5.023 1.00 . A A . 24 GLY H 1 1 5 2167 1 1 24 GLY HA2 H 0.606 8.567 4.438 1.00 . A A . 24 GLY HA2 1 1 5 2168 1 1 24 GLY HA3 H 1.619 9.733 3.590 1.00 . A A . 24 GLY HA3 1 1 5 2169 1 1 24 GLY N N 2.639 8.011 4.264 1.00 . A A . 24 GLY N 1 1 5 2170 1 1 24 GLY O O 0.153 8.550 1.691 1.00 . A A . 24 GLY O 1 1 5 2171 1 1 25 ILE C C 1.706 4.824 0.774 1.00 . A A . 25 ILE C 1 1 5 2172 1 1 25 ILE CA C 1.319 6.299 0.711 1.00 . A A . 25 ILE CA 1 1 5 2173 1 1 25 ILE CB C 2.156 6.989 -0.389 1.00 . A A . 25 ILE CB 1 1 5 2174 1 1 25 ILE CD1 C 3.898 8.690 -0.934 1.00 . A A . 25 ILE CD1 1 1 5 2175 1 1 25 ILE CG1 C 3.145 8.003 0.199 1.00 . A A . 25 ILE CG1 1 1 5 2176 1 1 25 ILE CG2 C 1.229 7.706 -1.354 1.00 . A A . 25 ILE CG2 1 1 5 2177 1 1 25 ILE H H 2.344 6.571 2.579 1.00 . A A . 25 ILE H 1 1 5 2178 1 1 25 ILE HA H 0.273 6.402 0.491 1.00 . A A . 25 ILE HA 1 1 5 2179 1 1 25 ILE HB H 2.698 6.233 -0.933 1.00 . A A . 25 ILE HB 1 1 5 2180 1 1 25 ILE HD11 H 4.607 7.999 -1.367 1.00 . A A . 25 ILE HD11 1 1 5 2181 1 1 25 ILE HD12 H 4.419 9.552 -0.550 1.00 . A A . 25 ILE HD12 1 1 5 2182 1 1 25 ILE HD13 H 3.193 9.001 -1.692 1.00 . A A . 25 ILE HD13 1 1 5 2183 1 1 25 ILE HG12 H 2.603 8.743 0.768 1.00 . A A . 25 ILE HG12 1 1 5 2184 1 1 25 ILE HG13 H 3.848 7.495 0.842 1.00 . A A . 25 ILE HG13 1 1 5 2185 1 1 25 ILE HG21 H 0.628 6.978 -1.870 1.00 . A A . 25 ILE HG21 1 1 5 2186 1 1 25 ILE HG22 H 1.819 8.258 -2.074 1.00 . A A . 25 ILE HG22 1 1 5 2187 1 1 25 ILE HG23 H 0.592 8.385 -0.808 1.00 . A A . 25 ILE HG23 1 1 5 2188 1 1 25 ILE N N 1.650 6.961 2.009 1.00 . A A . 25 ILE N 1 1 5 2189 1 1 25 ILE O O 2.272 4.366 1.752 1.00 . A A . 25 ILE O 1 1 5 2190 1 1 26 CYS C C 3.256 2.546 -0.816 1.00 . A A . 26 CYS C 1 1 5 2191 1 1 26 CYS CA C 1.819 2.654 -0.301 1.00 . A A . 26 CYS CA 1 1 5 2192 1 1 26 CYS CB C 0.844 2.001 -1.294 1.00 . A A . 26 CYS CB 1 1 5 2193 1 1 26 CYS H H 1.012 4.511 -1.059 1.00 . A A . 26 CYS H 1 1 5 2194 1 1 26 CYS HA H 1.720 2.208 0.678 1.00 . A A . 26 CYS HA 1 1 5 2195 1 1 26 CYS HB2 H 0.892 2.527 -2.236 1.00 . A A . 26 CYS HB2 1 1 5 2196 1 1 26 CYS HB3 H 1.125 0.976 -1.447 1.00 . A A . 26 CYS HB3 1 1 5 2197 1 1 26 CYS N N 1.442 4.096 -0.272 1.00 . A A . 26 CYS N 1 1 5 2198 1 1 26 CYS O O 3.520 2.863 -1.952 1.00 . A A . 26 CYS O 1 1 5 2199 1 1 26 CYS SG S -0.853 2.078 -0.654 1.00 . A A . 26 CYS SG 1 1 5 2200 1 1 27 MET C C 6.413 0.896 0.103 1.00 . A A . 27 MET C 1 1 5 2201 1 1 27 MET CA C 5.603 2.050 -0.531 1.00 . A A . 27 MET CA 1 1 5 2202 1 1 27 MET CB C 6.219 3.418 -0.212 1.00 . A A . 27 MET CB 1 1 5 2203 1 1 27 MET CE C 7.001 3.709 -4.008 1.00 . A A . 27 MET CE 1 1 5 2204 1 1 27 MET CG C 6.219 4.295 -1.466 1.00 . A A . 27 MET CG 1 1 5 2205 1 1 27 MET H H 3.997 1.887 0.917 1.00 . A A . 27 MET H 1 1 5 2206 1 1 27 MET HA H 5.580 1.919 -1.595 1.00 . A A . 27 MET HA 1 1 5 2207 1 1 27 MET HB2 H 5.641 3.901 0.562 1.00 . A A . 27 MET HB2 1 1 5 2208 1 1 27 MET HB3 H 7.236 3.286 0.129 1.00 . A A . 27 MET HB3 1 1 5 2209 1 1 27 MET HE1 H 6.775 2.657 -4.105 1.00 . A A . 27 MET HE1 1 1 5 2210 1 1 27 MET HE2 H 7.690 4.000 -4.784 1.00 . A A . 27 MET HE2 1 1 5 2211 1 1 27 MET HE3 H 6.094 4.290 -4.102 1.00 . A A . 27 MET HE3 1 1 5 2212 1 1 27 MET HG2 H 5.368 4.048 -2.086 1.00 . A A . 27 MET HG2 1 1 5 2213 1 1 27 MET HG3 H 6.159 5.334 -1.175 1.00 . A A . 27 MET HG3 1 1 5 2214 1 1 27 MET N N 4.200 2.129 -0.011 1.00 . A A . 27 MET N 1 1 5 2215 1 1 27 MET O O 6.621 -0.111 -0.541 1.00 . A A . 27 MET O 1 1 5 2216 1 1 27 MET SD S 7.753 4.017 -2.388 1.00 . A A . 27 MET SD 1 1 5 2217 1 1 28 PRO C C 6.846 -1.194 2.356 1.00 . A A . 28 PRO C 1 1 5 2218 1 1 28 PRO CA C 7.698 0.031 1.998 1.00 . A A . 28 PRO CA 1 1 5 2219 1 1 28 PRO CB C 8.213 0.741 3.257 1.00 . A A . 28 PRO CB 1 1 5 2220 1 1 28 PRO CD C 6.661 2.238 2.196 1.00 . A A . 28 PRO CD 1 1 5 2221 1 1 28 PRO CG C 7.208 1.807 3.529 1.00 . A A . 28 PRO CG 1 1 5 2222 1 1 28 PRO HA H 8.533 -0.251 1.369 1.00 . A A . 28 PRO HA 1 1 5 2223 1 1 28 PRO HB2 H 8.271 0.051 4.090 1.00 . A A . 28 PRO HB2 1 1 5 2224 1 1 28 PRO HB3 H 9.177 1.188 3.067 1.00 . A A . 28 PRO HB3 1 1 5 2225 1 1 28 PRO HD2 H 5.607 2.472 2.271 1.00 . A A . 28 PRO HD2 1 1 5 2226 1 1 28 PRO HD3 H 7.212 3.084 1.817 1.00 . A A . 28 PRO HD3 1 1 5 2227 1 1 28 PRO HG2 H 6.414 1.411 4.149 1.00 . A A . 28 PRO HG2 1 1 5 2228 1 1 28 PRO HG3 H 7.679 2.642 4.017 1.00 . A A . 28 PRO HG3 1 1 5 2229 1 1 28 PRO N N 6.871 1.077 1.328 1.00 . A A . 28 PRO N 1 1 5 2230 1 1 28 PRO O O 6.536 -1.425 3.511 1.00 . A A . 28 PRO O 1 1 5 2231 1 1 29 ARG C C 6.280 -4.096 2.660 1.00 . A A . 29 ARG C 1 1 5 2232 1 1 29 ARG CA C 5.622 -3.184 1.613 1.00 . A A . 29 ARG CA 1 1 5 2233 1 1 29 ARG CB C 5.550 -3.902 0.257 1.00 . A A . 29 ARG CB 1 1 5 2234 1 1 29 ARG CD C 4.757 -6.200 0.845 1.00 . A A . 29 ARG CD 1 1 5 2235 1 1 29 ARG CG C 4.349 -4.851 0.237 1.00 . A A . 29 ARG CG 1 1 5 2236 1 1 29 ARG CZ C 5.254 -8.387 -0.127 1.00 . A A . 29 ARG CZ 1 1 5 2237 1 1 29 ARG H H 6.723 -1.732 0.456 1.00 . A A . 29 ARG H 1 1 5 2238 1 1 29 ARG HA H 4.633 -2.896 1.929 1.00 . A A . 29 ARG HA 1 1 5 2239 1 1 29 ARG HB2 H 5.449 -3.174 -0.532 1.00 . A A . 29 ARG HB2 1 1 5 2240 1 1 29 ARG HB3 H 6.458 -4.471 0.107 1.00 . A A . 29 ARG HB3 1 1 5 2241 1 1 29 ARG HD2 H 5.675 -6.092 1.413 1.00 . A A . 29 ARG HD2 1 1 5 2242 1 1 29 ARG HD3 H 3.969 -6.576 1.478 1.00 . A A . 29 ARG HD3 1 1 5 2243 1 1 29 ARG HE H 4.887 -6.768 -1.232 1.00 . A A . 29 ARG HE 1 1 5 2244 1 1 29 ARG HG2 H 3.545 -4.424 0.819 1.00 . A A . 29 ARG HG2 1 1 5 2245 1 1 29 ARG HG3 H 4.020 -4.997 -0.780 1.00 . A A . 29 ARG HG3 1 1 5 2246 1 1 29 ARG HH11 H 5.252 -8.261 1.871 1.00 . A A . 29 ARG HH11 1 1 5 2247 1 1 29 ARG HH12 H 5.597 -9.825 1.230 1.00 . A A . 29 ARG HH12 1 1 5 2248 1 1 29 ARG HH21 H 5.328 -8.817 -2.085 1.00 . A A . 29 ARG HH21 1 1 5 2249 1 1 29 ARG HH22 H 5.640 -10.143 -1.016 1.00 . A A . 29 ARG HH22 1 1 5 2250 1 1 29 ARG N N 6.464 -1.964 1.368 1.00 . A A . 29 ARG N 1 1 5 2251 1 1 29 ARG NE N 4.967 -7.118 -0.319 1.00 . A A . 29 ARG NE 1 1 5 2252 1 1 29 ARG NH1 N 5.375 -8.861 1.086 1.00 . A A . 29 ARG NH1 1 1 5 2253 1 1 29 ARG NH2 N 5.418 -9.176 -1.154 1.00 . A A . 29 ARG NH2 1 1 5 2254 1 1 29 ARG O O 5.574 -4.555 3.540 1.00 . A A . 29 ARG O 1 1 5 2255 1 1 29 ARG OXT O 7.475 -4.322 2.565 1.00 . A A . 29 ARG OXT 1 1 6 2256 1 1 1 GLY C C -10.048 1.582 -5.624 1.00 . A A . 1 GLY C 1 1 6 2257 1 1 1 GLY CA C -11.360 1.642 -6.405 1.00 . A A . 1 GLY CA 1 1 6 2258 1 1 1 GLY H1 H -10.497 3.359 -7.204 1.00 . A A . 1 GLY H1 1 1 6 2259 1 1 1 GLY H2 H -12.057 3.590 -6.581 1.00 . A A . 1 GLY H2 1 1 6 2260 1 1 1 GLY H3 H -11.845 2.797 -8.067 1.00 . A A . 1 GLY H3 1 1 6 2261 1 1 1 GLY HA2 H -12.190 1.552 -5.723 1.00 . A A . 1 GLY HA2 1 1 6 2262 1 1 1 GLY HA3 H -11.392 0.834 -7.122 1.00 . A A . 1 GLY HA3 1 1 6 2263 1 1 1 GLY N N -11.447 2.944 -7.119 1.00 . A A . 1 GLY N 1 1 6 2264 1 1 1 GLY O O -9.611 2.568 -5.062 1.00 . A A . 1 GLY O 1 1 6 2265 1 1 2 CYS C C -7.060 1.207 -5.496 1.00 . A A . 2 CYS C 1 1 6 2266 1 1 2 CYS CA C -8.120 0.317 -4.838 1.00 . A A . 2 CYS CA 1 1 6 2267 1 1 2 CYS CB C -7.727 -1.157 -4.945 1.00 . A A . 2 CYS CB 1 1 6 2268 1 1 2 CYS H H -9.782 -0.342 -6.052 1.00 . A A . 2 CYS H 1 1 6 2269 1 1 2 CYS HA H -8.258 0.593 -3.802 1.00 . A A . 2 CYS HA 1 1 6 2270 1 1 2 CYS HB2 H -6.838 -1.334 -4.362 1.00 . A A . 2 CYS HB2 1 1 6 2271 1 1 2 CYS HB3 H -8.533 -1.774 -4.572 1.00 . A A . 2 CYS HB3 1 1 6 2272 1 1 2 CYS N N -9.414 0.437 -5.585 1.00 . A A . 2 CYS N 1 1 6 2273 1 1 2 CYS O O -7.197 1.599 -6.640 1.00 . A A . 2 CYS O 1 1 6 2274 1 1 2 CYS SG S -7.410 -1.565 -6.682 1.00 . A A . 2 CYS SG 1 1 6 2275 1 1 3 LYS C C -3.640 1.672 -5.553 1.00 . A A . 3 LYS C 1 1 6 2276 1 1 3 LYS CA C -4.963 2.418 -5.403 1.00 . A A . 3 LYS CA 1 1 6 2277 1 1 3 LYS CB C -4.812 3.612 -4.458 1.00 . A A . 3 LYS CB 1 1 6 2278 1 1 3 LYS CD C -6.115 5.567 -3.574 1.00 . A A . 3 LYS CD 1 1 6 2279 1 1 3 LYS CE C -7.531 6.150 -3.495 1.00 . A A . 3 LYS CE 1 1 6 2280 1 1 3 LYS CG C -6.200 4.112 -4.044 1.00 . A A . 3 LYS CG 1 1 6 2281 1 1 3 LYS H H -5.914 1.227 -3.869 1.00 . A A . 3 LYS H 1 1 6 2282 1 1 3 LYS HA H -5.288 2.766 -6.370 1.00 . A A . 3 LYS HA 1 1 6 2283 1 1 3 LYS HB2 H -4.246 3.319 -3.584 1.00 . A A . 3 LYS HB2 1 1 6 2284 1 1 3 LYS HB3 H -4.291 4.403 -4.971 1.00 . A A . 3 LYS HB3 1 1 6 2285 1 1 3 LYS HD2 H -5.649 5.609 -2.601 1.00 . A A . 3 LYS HD2 1 1 6 2286 1 1 3 LYS HD3 H -5.532 6.144 -4.279 1.00 . A A . 3 LYS HD3 1 1 6 2287 1 1 3 LYS HE2 H -7.489 7.230 -3.515 1.00 . A A . 3 LYS HE2 1 1 6 2288 1 1 3 LYS HE3 H -8.135 5.784 -4.312 1.00 . A A . 3 LYS HE3 1 1 6 2289 1 1 3 LYS HG2 H -6.866 4.045 -4.893 1.00 . A A . 3 LYS HG2 1 1 6 2290 1 1 3 LYS HG3 H -6.577 3.496 -3.245 1.00 . A A . 3 LYS HG3 1 1 6 2291 1 1 3 LYS HZ1 H -7.761 6.308 -1.432 1.00 . A A . 3 LYS HZ1 1 1 6 2292 1 1 3 LYS HZ2 H -7.753 4.697 -1.988 1.00 . A A . 3 LYS HZ2 1 1 6 2293 1 1 3 LYS HZ3 H -9.121 5.690 -2.232 1.00 . A A . 3 LYS HZ3 1 1 6 2294 1 1 3 LYS N N -6.010 1.541 -4.791 1.00 . A A . 3 LYS N 1 1 6 2295 1 1 3 LYS NZ N -8.084 5.676 -2.193 1.00 . A A . 3 LYS NZ 1 1 6 2296 1 1 3 LYS O O -3.497 0.544 -5.124 1.00 . A A . 3 LYS O 1 1 6 2297 1 1 4 LEU C C -0.409 1.950 -5.234 1.00 . A A . 4 LEU C 1 1 6 2298 1 1 4 LEU CA C -1.363 1.643 -6.405 1.00 . A A . 4 LEU CA 1 1 6 2299 1 1 4 LEU CB C -0.857 2.265 -7.722 1.00 . A A . 4 LEU CB 1 1 6 2300 1 1 4 LEU CD1 C -2.773 0.886 -8.633 1.00 . A A . 4 LEU CD1 1 1 6 2301 1 1 4 LEU CD2 C -1.558 2.479 -10.102 1.00 . A A . 4 LEU CD2 1 1 6 2302 1 1 4 LEU CG C -1.405 1.500 -8.942 1.00 . A A . 4 LEU CG 1 1 6 2303 1 1 4 LEU H H -2.846 3.192 -6.534 1.00 . A A . 4 LEU H 1 1 6 2304 1 1 4 LEU HA H -1.480 0.574 -6.527 1.00 . A A . 4 LEU HA 1 1 6 2305 1 1 4 LEU HB2 H -1.182 3.296 -7.776 1.00 . A A . 4 LEU HB2 1 1 6 2306 1 1 4 LEU HB3 H 0.220 2.237 -7.743 1.00 . A A . 4 LEU HB3 1 1 6 2307 1 1 4 LEU HD11 H -3.450 1.665 -8.318 1.00 . A A . 4 LEU HD11 1 1 6 2308 1 1 4 LEU HD12 H -2.675 0.153 -7.845 1.00 . A A . 4 LEU HD12 1 1 6 2309 1 1 4 LEU HD13 H -3.161 0.410 -9.520 1.00 . A A . 4 LEU HD13 1 1 6 2310 1 1 4 LEU HD21 H -1.940 1.953 -10.962 1.00 . A A . 4 LEU HD21 1 1 6 2311 1 1 4 LEU HD22 H -0.597 2.914 -10.342 1.00 . A A . 4 LEU HD22 1 1 6 2312 1 1 4 LEU HD23 H -2.248 3.261 -9.819 1.00 . A A . 4 LEU HD23 1 1 6 2313 1 1 4 LEU HG H -0.717 0.719 -9.222 1.00 . A A . 4 LEU HG 1 1 6 2314 1 1 4 LEU N N -2.685 2.294 -6.185 1.00 . A A . 4 LEU N 1 1 6 2315 1 1 4 LEU O O -0.829 2.231 -4.128 1.00 . A A . 4 LEU O 1 1 6 2316 1 1 5 THR C C 1.858 3.574 -3.902 1.00 . A A . 5 THR C 1 1 6 2317 1 1 5 THR CA C 1.880 2.110 -4.394 1.00 . A A . 5 THR CA 1 1 6 2318 1 1 5 THR CB C 3.226 1.753 -5.048 1.00 . A A . 5 THR CB 1 1 6 2319 1 1 5 THR CG2 C 4.399 2.149 -4.144 1.00 . A A . 5 THR CG2 1 1 6 2320 1 1 5 THR H H 1.171 1.604 -6.366 1.00 . A A . 5 THR H 1 1 6 2321 1 1 5 THR HA H 1.697 1.448 -3.566 1.00 . A A . 5 THR HA 1 1 6 2322 1 1 5 THR HB H 3.316 2.272 -5.994 1.00 . A A . 5 THR HB 1 1 6 2323 1 1 5 THR HG1 H 3.877 0.196 -6.007 1.00 . A A . 5 THR HG1 1 1 6 2324 1 1 5 THR HG21 H 4.434 1.488 -3.290 1.00 . A A . 5 THR HG21 1 1 6 2325 1 1 5 THR HG22 H 4.278 3.167 -3.802 1.00 . A A . 5 THR HG22 1 1 6 2326 1 1 5 THR HG23 H 5.322 2.065 -4.699 1.00 . A A . 5 THR HG23 1 1 6 2327 1 1 5 THR N N 0.871 1.862 -5.474 1.00 . A A . 5 THR N 1 1 6 2328 1 1 5 THR O O 1.455 3.851 -2.787 1.00 . A A . 5 THR O 1 1 6 2329 1 1 5 THR OG1 O 3.267 0.353 -5.280 1.00 . A A . 5 THR OG1 1 1 6 2330 1 1 6 PHE C C 0.971 6.599 -4.278 1.00 . A A . 6 PHE C 1 1 6 2331 1 1 6 PHE CA C 2.356 5.936 -4.256 1.00 . A A . 6 PHE CA 1 1 6 2332 1 1 6 PHE CB C 3.303 6.637 -5.237 1.00 . A A . 6 PHE CB 1 1 6 2333 1 1 6 PHE CD1 C 5.165 6.486 -3.532 1.00 . A A . 6 PHE CD1 1 1 6 2334 1 1 6 PHE CD2 C 4.828 8.574 -4.712 1.00 . A A . 6 PHE CD2 1 1 6 2335 1 1 6 PHE CE1 C 6.227 7.059 -2.822 1.00 . A A . 6 PHE CE1 1 1 6 2336 1 1 6 PHE CE2 C 5.893 9.146 -4.003 1.00 . A A . 6 PHE CE2 1 1 6 2337 1 1 6 PHE CG C 4.460 7.247 -4.480 1.00 . A A . 6 PHE CG 1 1 6 2338 1 1 6 PHE CZ C 6.591 8.389 -3.060 1.00 . A A . 6 PHE CZ 1 1 6 2339 1 1 6 PHE H H 2.655 4.267 -5.578 1.00 . A A . 6 PHE H 1 1 6 2340 1 1 6 PHE HA H 2.767 5.998 -3.264 1.00 . A A . 6 PHE HA 1 1 6 2341 1 1 6 PHE HB2 H 3.686 5.916 -5.942 1.00 . A A . 6 PHE HB2 1 1 6 2342 1 1 6 PHE HB3 H 2.770 7.416 -5.768 1.00 . A A . 6 PHE HB3 1 1 6 2343 1 1 6 PHE HD1 H 4.894 5.462 -3.348 1.00 . A A . 6 PHE HD1 1 1 6 2344 1 1 6 PHE HD2 H 4.295 9.161 -5.438 1.00 . A A . 6 PHE HD2 1 1 6 2345 1 1 6 PHE HE1 H 6.769 6.469 -2.089 1.00 . A A . 6 PHE HE1 1 1 6 2346 1 1 6 PHE HE2 H 6.171 10.175 -4.184 1.00 . A A . 6 PHE HE2 1 1 6 2347 1 1 6 PHE HZ H 7.414 8.831 -2.512 1.00 . A A . 6 PHE HZ 1 1 6 2348 1 1 6 PHE N N 2.317 4.507 -4.701 1.00 . A A . 6 PHE N 1 1 6 2349 1 1 6 PHE O O 0.850 7.760 -4.624 1.00 . A A . 6 PHE O 1 1 6 2350 1 1 7 TRP C C -1.779 6.795 -2.400 1.00 . A A . 7 TRP C 1 1 6 2351 1 1 7 TRP CA C -1.413 6.530 -3.858 1.00 . A A . 7 TRP CA 1 1 6 2352 1 1 7 TRP CB C -2.357 5.514 -4.501 1.00 . A A . 7 TRP CB 1 1 6 2353 1 1 7 TRP CD1 C -0.905 5.445 -6.561 1.00 . A A . 7 TRP CD1 1 1 6 2354 1 1 7 TRP CD2 C -3.093 5.602 -7.059 1.00 . A A . 7 TRP CD2 1 1 6 2355 1 1 7 TRP CE2 C -2.392 5.580 -8.290 1.00 . A A . 7 TRP CE2 1 1 6 2356 1 1 7 TRP CE3 C -4.490 5.693 -7.092 1.00 . A A . 7 TRP CE3 1 1 6 2357 1 1 7 TRP CG C -2.122 5.520 -5.978 1.00 . A A . 7 TRP CG 1 1 6 2358 1 1 7 TRP CH2 C -4.452 5.739 -9.526 1.00 . A A . 7 TRP CH2 1 1 6 2359 1 1 7 TRP CZ2 C -3.057 5.647 -9.506 1.00 . A A . 7 TRP CZ2 1 1 6 2360 1 1 7 TRP CZ3 C -5.170 5.763 -8.327 1.00 . A A . 7 TRP CZ3 1 1 6 2361 1 1 7 TRP H H 0.040 4.972 -3.589 1.00 . A A . 7 TRP H 1 1 6 2362 1 1 7 TRP HA H -1.414 7.450 -4.419 1.00 . A A . 7 TRP HA 1 1 6 2363 1 1 7 TRP HB2 H -2.153 4.533 -4.103 1.00 . A A . 7 TRP HB2 1 1 6 2364 1 1 7 TRP HB3 H -3.380 5.789 -4.294 1.00 . A A . 7 TRP HB3 1 1 6 2365 1 1 7 TRP HD1 H 0.036 5.374 -6.032 1.00 . A A . 7 TRP HD1 1 1 6 2366 1 1 7 TRP HE1 H -0.327 5.450 -8.580 1.00 . A A . 7 TRP HE1 1 1 6 2367 1 1 7 TRP HE3 H -5.043 5.705 -6.167 1.00 . A A . 7 TRP HE3 1 1 6 2368 1 1 7 TRP HH2 H -4.980 5.799 -10.461 1.00 . A A . 7 TRP HH2 1 1 6 2369 1 1 7 TRP HZ2 H -2.491 5.626 -10.431 1.00 . A A . 7 TRP HZ2 1 1 6 2370 1 1 7 TRP HZ3 H -6.249 5.841 -8.356 1.00 . A A . 7 TRP HZ3 1 1 6 2371 1 1 7 TRP N N -0.065 5.902 -3.887 1.00 . A A . 7 TRP N 1 1 6 2372 1 1 7 TRP NE1 N -1.060 5.488 -7.924 1.00 . A A . 7 TRP NE1 1 1 6 2373 1 1 7 TRP O O -1.865 5.879 -1.604 1.00 . A A . 7 TRP O 1 1 6 2374 1 1 8 LYS C C -3.249 7.399 0.013 1.00 . A A . 8 LYS C 1 1 6 2375 1 1 8 LYS CA C -2.275 8.405 -0.618 1.00 . A A . 8 LYS CA 1 1 6 2376 1 1 8 LYS CB C -2.910 9.803 -0.684 1.00 . A A . 8 LYS CB 1 1 6 2377 1 1 8 LYS CD C -0.925 11.286 -0.294 1.00 . A A . 8 LYS CD 1 1 6 2378 1 1 8 LYS CE C -0.506 12.570 0.439 1.00 . A A . 8 LYS CE 1 1 6 2379 1 1 8 LYS CG C -2.219 10.732 0.320 1.00 . A A . 8 LYS CG 1 1 6 2380 1 1 8 LYS H H -1.838 8.755 -2.709 1.00 . A A . 8 LYS H 1 1 6 2381 1 1 8 LYS HA H -1.371 8.445 -0.039 1.00 . A A . 8 LYS HA 1 1 6 2382 1 1 8 LYS HB2 H -2.803 10.199 -1.683 1.00 . A A . 8 LYS HB2 1 1 6 2383 1 1 8 LYS HB3 H -3.961 9.727 -0.441 1.00 . A A . 8 LYS HB3 1 1 6 2384 1 1 8 LYS HD2 H -0.140 10.547 -0.206 1.00 . A A . 8 LYS HD2 1 1 6 2385 1 1 8 LYS HD3 H -1.088 11.510 -1.339 1.00 . A A . 8 LYS HD3 1 1 6 2386 1 1 8 LYS HE2 H -0.712 12.481 1.499 1.00 . A A . 8 LYS HE2 1 1 6 2387 1 1 8 LYS HE3 H 0.543 12.770 0.277 1.00 . A A . 8 LYS HE3 1 1 6 2388 1 1 8 LYS HG2 H -2.883 11.548 0.561 1.00 . A A . 8 LYS HG2 1 1 6 2389 1 1 8 LYS HG3 H -1.981 10.183 1.222 1.00 . A A . 8 LYS HG3 1 1 6 2390 1 1 8 LYS HZ1 H -2.323 13.339 -0.231 1.00 . A A . 8 LYS HZ1 1 1 6 2391 1 1 8 LYS HZ2 H -0.981 13.865 -1.125 1.00 . A A . 8 LYS HZ2 1 1 6 2392 1 1 8 LYS HZ3 H -1.278 14.503 0.422 1.00 . A A . 8 LYS HZ3 1 1 6 2393 1 1 8 LYS N N -1.951 8.044 -2.043 1.00 . A A . 8 LYS N 1 1 6 2394 1 1 8 LYS NZ N -1.335 13.649 -0.170 1.00 . A A . 8 LYS NZ 1 1 6 2395 1 1 8 LYS O O -4.449 7.445 -0.206 1.00 . A A . 8 LYS O 1 1 6 2396 1 1 9 CYS C C -3.586 5.626 2.967 1.00 . A A . 9 CYS C 1 1 6 2397 1 1 9 CYS CA C -3.612 5.475 1.445 1.00 . A A . 9 CYS CA 1 1 6 2398 1 1 9 CYS CB C -3.037 4.109 1.032 1.00 . A A . 9 CYS CB 1 1 6 2399 1 1 9 CYS H H -1.761 6.481 0.944 1.00 . A A . 9 CYS H 1 1 6 2400 1 1 9 CYS HA H -4.621 5.571 1.075 1.00 . A A . 9 CYS HA 1 1 6 2401 1 1 9 CYS HB2 H -3.556 3.329 1.565 1.00 . A A . 9 CYS HB2 1 1 6 2402 1 1 9 CYS HB3 H -3.177 3.967 -0.031 1.00 . A A . 9 CYS HB3 1 1 6 2403 1 1 9 CYS N N -2.733 6.493 0.793 1.00 . A A . 9 CYS N 1 1 6 2404 1 1 9 CYS O O -2.866 6.443 3.511 1.00 . A A . 9 CYS O 1 1 6 2405 1 1 9 CYS SG S -1.258 4.016 1.419 1.00 . A A . 9 CYS SG 1 1 6 2406 1 1 10 LYS C C -3.923 3.516 5.714 1.00 . A A . 10 LYS C 1 1 6 2407 1 1 10 LYS CA C -4.353 4.881 5.156 1.00 . A A . 10 LYS CA 1 1 6 2408 1 1 10 LYS CB C -5.786 5.240 5.568 1.00 . A A . 10 LYS CB 1 1 6 2409 1 1 10 LYS CD C -8.215 4.639 5.395 1.00 . A A . 10 LYS CD 1 1 6 2410 1 1 10 LYS CE C -8.453 4.484 6.901 1.00 . A A . 10 LYS CE 1 1 6 2411 1 1 10 LYS CG C -6.788 4.195 5.051 1.00 . A A . 10 LYS CG 1 1 6 2412 1 1 10 LYS H H -4.912 4.167 3.195 1.00 . A A . 10 LYS H 1 1 6 2413 1 1 10 LYS HA H -3.674 5.650 5.492 1.00 . A A . 10 LYS HA 1 1 6 2414 1 1 10 LYS HB2 H -5.839 5.287 6.645 1.00 . A A . 10 LYS HB2 1 1 6 2415 1 1 10 LYS HB3 H -6.039 6.207 5.158 1.00 . A A . 10 LYS HB3 1 1 6 2416 1 1 10 LYS HD2 H -8.344 5.675 5.116 1.00 . A A . 10 LYS HD2 1 1 6 2417 1 1 10 LYS HD3 H -8.923 4.029 4.853 1.00 . A A . 10 LYS HD3 1 1 6 2418 1 1 10 LYS HE2 H -7.831 3.694 7.297 1.00 . A A . 10 LYS HE2 1 1 6 2419 1 1 10 LYS HE3 H -8.247 5.415 7.406 1.00 . A A . 10 LYS HE3 1 1 6 2420 1 1 10 LYS HG2 H -6.695 4.102 3.980 1.00 . A A . 10 LYS HG2 1 1 6 2421 1 1 10 LYS HG3 H -6.591 3.239 5.516 1.00 . A A . 10 LYS HG3 1 1 6 2422 1 1 10 LYS HZ1 H -10.132 4.027 8.049 1.00 . A A . 10 LYS HZ1 1 1 6 2423 1 1 10 LYS HZ2 H -10.099 3.243 6.545 1.00 . A A . 10 LYS HZ2 1 1 6 2424 1 1 10 LYS HZ3 H -10.484 4.895 6.638 1.00 . A A . 10 LYS HZ3 1 1 6 2425 1 1 10 LYS N N -4.351 4.823 3.661 1.00 . A A . 10 LYS N 1 1 6 2426 1 1 10 LYS NZ N -9.900 4.135 7.042 1.00 . A A . 10 LYS NZ 1 1 6 2427 1 1 10 LYS O O -3.201 3.432 6.686 1.00 . A A . 10 LYS O 1 1 6 2428 1 1 11 ASN C C -3.170 0.383 4.414 1.00 . A A . 11 ASN C 1 1 6 2429 1 1 11 ASN CA C -3.930 1.083 5.545 1.00 . A A . 11 ASN CA 1 1 6 2430 1 1 11 ASN CB C -5.236 0.346 5.883 1.00 . A A . 11 ASN CB 1 1 6 2431 1 1 11 ASN CG C -6.166 0.335 4.670 1.00 . A A . 11 ASN CG 1 1 6 2432 1 1 11 ASN H H -4.899 2.531 4.282 1.00 . A A . 11 ASN H 1 1 6 2433 1 1 11 ASN HA H -3.310 1.155 6.423 1.00 . A A . 11 ASN HA 1 1 6 2434 1 1 11 ASN HB2 H -5.008 -0.669 6.170 1.00 . A A . 11 ASN HB2 1 1 6 2435 1 1 11 ASN HB3 H -5.723 0.847 6.706 1.00 . A A . 11 ASN HB3 1 1 6 2436 1 1 11 ASN HD21 H -6.033 -1.622 4.405 1.00 . A A . 11 ASN HD21 1 1 6 2437 1 1 11 ASN HD22 H -7.022 -0.798 3.296 1.00 . A A . 11 ASN HD22 1 1 6 2438 1 1 11 ASN N N -4.336 2.444 5.081 1.00 . A A . 11 ASN N 1 1 6 2439 1 1 11 ASN ND2 N -6.432 -0.789 4.077 1.00 . A A . 11 ASN ND2 1 1 6 2440 1 1 11 ASN O O -3.358 0.693 3.254 1.00 . A A . 11 ASN O 1 1 6 2441 1 1 11 ASN OD1 O -6.666 1.363 4.267 1.00 . A A . 11 ASN OD1 1 1 6 2442 1 1 12 LYS C C -2.425 -2.050 2.747 1.00 . A A . 12 LYS C 1 1 6 2443 1 1 12 LYS CA C -1.513 -1.226 3.669 1.00 . A A . 12 LYS CA 1 1 6 2444 1 1 12 LYS CB C -0.510 -2.120 4.414 1.00 . A A . 12 LYS CB 1 1 6 2445 1 1 12 LYS CD C -0.206 -4.349 5.522 1.00 . A A . 12 LYS CD 1 1 6 2446 1 1 12 LYS CE C 0.859 -3.757 6.460 1.00 . A A . 12 LYS CE 1 1 6 2447 1 1 12 LYS CG C -1.228 -3.268 5.131 1.00 . A A . 12 LYS CG 1 1 6 2448 1 1 12 LYS H H -2.152 -0.757 5.681 1.00 . A A . 12 LYS H 1 1 6 2449 1 1 12 LYS HA H -0.979 -0.495 3.086 1.00 . A A . 12 LYS HA 1 1 6 2450 1 1 12 LYS HB2 H 0.189 -2.528 3.706 1.00 . A A . 12 LYS HB2 1 1 6 2451 1 1 12 LYS HB3 H 0.030 -1.528 5.140 1.00 . A A . 12 LYS HB3 1 1 6 2452 1 1 12 LYS HD2 H -0.715 -5.161 6.024 1.00 . A A . 12 LYS HD2 1 1 6 2453 1 1 12 LYS HD3 H 0.274 -4.726 4.630 1.00 . A A . 12 LYS HD3 1 1 6 2454 1 1 12 LYS HE2 H 1.261 -2.844 6.039 1.00 . A A . 12 LYS HE2 1 1 6 2455 1 1 12 LYS HE3 H 0.435 -3.566 7.434 1.00 . A A . 12 LYS HE3 1 1 6 2456 1 1 12 LYS HG2 H -1.716 -2.892 6.020 1.00 . A A . 12 LYS HG2 1 1 6 2457 1 1 12 LYS HG3 H -1.966 -3.697 4.470 1.00 . A A . 12 LYS HG3 1 1 6 2458 1 1 12 LYS HZ1 H 2.755 -4.402 7.050 1.00 . A A . 12 LYS HZ1 1 1 6 2459 1 1 12 LYS HZ2 H 2.209 -5.106 5.609 1.00 . A A . 12 LYS HZ2 1 1 6 2460 1 1 12 LYS HZ3 H 1.570 -5.614 7.098 1.00 . A A . 12 LYS HZ3 1 1 6 2461 1 1 12 LYS N N -2.301 -0.535 4.737 1.00 . A A . 12 LYS N 1 1 6 2462 1 1 12 LYS NZ N 1.925 -4.799 6.561 1.00 . A A . 12 LYS NZ 1 1 6 2463 1 1 12 LYS O O -2.096 -2.287 1.606 1.00 . A A . 12 LYS O 1 1 6 2464 1 1 13 LYS C C -5.421 -2.358 1.540 1.00 . A A . 13 LYS C 1 1 6 2465 1 1 13 LYS CA C -4.478 -3.281 2.339 1.00 . A A . 13 LYS CA 1 1 6 2466 1 1 13 LYS CB C -5.279 -4.174 3.289 1.00 . A A . 13 LYS CB 1 1 6 2467 1 1 13 LYS CD C -4.774 -6.621 3.112 1.00 . A A . 13 LYS CD 1 1 6 2468 1 1 13 LYS CE C -3.627 -7.633 3.250 1.00 . A A . 13 LYS CE 1 1 6 2469 1 1 13 LYS CG C -4.394 -5.312 3.810 1.00 . A A . 13 LYS CG 1 1 6 2470 1 1 13 LYS H H -3.831 -2.287 4.144 1.00 . A A . 13 LYS H 1 1 6 2471 1 1 13 LYS HA H -3.903 -3.894 1.662 1.00 . A A . 13 LYS HA 1 1 6 2472 1 1 13 LYS HB2 H -5.636 -3.586 4.118 1.00 . A A . 13 LYS HB2 1 1 6 2473 1 1 13 LYS HB3 H -6.124 -4.592 2.757 1.00 . A A . 13 LYS HB3 1 1 6 2474 1 1 13 LYS HD2 H -5.673 -7.023 3.560 1.00 . A A . 13 LYS HD2 1 1 6 2475 1 1 13 LYS HD3 H -4.955 -6.431 2.063 1.00 . A A . 13 LYS HD3 1 1 6 2476 1 1 13 LYS HE2 H -3.684 -8.373 2.462 1.00 . A A . 13 LYS HE2 1 1 6 2477 1 1 13 LYS HE3 H -2.675 -7.125 3.218 1.00 . A A . 13 LYS HE3 1 1 6 2478 1 1 13 LYS HG2 H -3.356 -5.084 3.608 1.00 . A A . 13 LYS HG2 1 1 6 2479 1 1 13 LYS HG3 H -4.540 -5.420 4.874 1.00 . A A . 13 LYS HG3 1 1 6 2480 1 1 13 LYS HZ1 H -4.646 -8.903 4.559 1.00 . A A . 13 LYS HZ1 1 1 6 2481 1 1 13 LYS HZ2 H -3.946 -7.554 5.315 1.00 . A A . 13 LYS HZ2 1 1 6 2482 1 1 13 LYS HZ3 H -2.976 -8.852 4.814 1.00 . A A . 13 LYS HZ3 1 1 6 2483 1 1 13 LYS N N -3.569 -2.486 3.220 1.00 . A A . 13 LYS N 1 1 6 2484 1 1 13 LYS NZ N -3.815 -8.281 4.584 1.00 . A A . 13 LYS NZ 1 1 6 2485 1 1 13 LYS O O -6.400 -2.807 0.976 1.00 . A A . 13 LYS O 1 1 6 2486 1 1 14 GLU C C -5.509 -0.071 -0.760 1.00 . A A . 14 GLU C 1 1 6 2487 1 1 14 GLU CA C -6.010 -0.146 0.693 1.00 . A A . 14 GLU CA 1 1 6 2488 1 1 14 GLU CB C -5.913 1.208 1.434 1.00 . A A . 14 GLU CB 1 1 6 2489 1 1 14 GLU CD C -7.088 2.919 -0.030 1.00 . A A . 14 GLU CD 1 1 6 2490 1 1 14 GLU CG C -5.731 2.395 0.464 1.00 . A A . 14 GLU CG 1 1 6 2491 1 1 14 GLU H H -4.338 -0.730 1.927 1.00 . A A . 14 GLU H 1 1 6 2492 1 1 14 GLU HA H -7.030 -0.500 0.710 1.00 . A A . 14 GLU HA 1 1 6 2493 1 1 14 GLU HB2 H -6.816 1.360 2.008 1.00 . A A . 14 GLU HB2 1 1 6 2494 1 1 14 GLU HB3 H -5.074 1.174 2.108 1.00 . A A . 14 GLU HB3 1 1 6 2495 1 1 14 GLU HG2 H -5.222 3.192 0.980 1.00 . A A . 14 GLU HG2 1 1 6 2496 1 1 14 GLU HG3 H -5.137 2.085 -0.377 1.00 . A A . 14 GLU HG3 1 1 6 2497 1 1 14 GLU N N -5.133 -1.077 1.474 1.00 . A A . 14 GLU N 1 1 6 2498 1 1 14 GLU O O -6.272 0.180 -1.678 1.00 . A A . 14 GLU O 1 1 6 2499 1 1 14 GLU OE1 O -8.050 2.843 0.715 1.00 . A A . 14 GLU OE1 1 1 6 2500 1 1 14 GLU OE2 O -7.138 3.416 -1.142 1.00 . A A . 14 GLU OE2 1 1 6 2501 1 1 15 CYS C C -3.815 -1.704 -3.003 1.00 . A A . 15 CYS C 1 1 6 2502 1 1 15 CYS CA C -3.727 -0.291 -2.402 1.00 . A A . 15 CYS CA 1 1 6 2503 1 1 15 CYS CB C -2.264 0.210 -2.364 1.00 . A A . 15 CYS CB 1 1 6 2504 1 1 15 CYS H H -3.641 -0.556 -0.246 1.00 . A A . 15 CYS H 1 1 6 2505 1 1 15 CYS HA H -4.324 0.390 -2.988 1.00 . A A . 15 CYS HA 1 1 6 2506 1 1 15 CYS HB2 H -1.754 -0.134 -3.252 1.00 . A A . 15 CYS HB2 1 1 6 2507 1 1 15 CYS HB3 H -2.262 1.289 -2.354 1.00 . A A . 15 CYS HB3 1 1 6 2508 1 1 15 CYS N N -4.239 -0.322 -0.991 1.00 . A A . 15 CYS N 1 1 6 2509 1 1 15 CYS O O -3.528 -2.680 -2.343 1.00 . A A . 15 CYS O 1 1 6 2510 1 1 15 CYS SG S -1.381 -0.407 -0.905 1.00 . A A . 15 CYS SG 1 1 6 2511 1 1 16 CYS C C -3.044 -3.937 -4.758 1.00 . A A . 16 CYS C 1 1 6 2512 1 1 16 CYS CA C -4.359 -3.174 -4.882 1.00 . A A . 16 CYS CA 1 1 6 2513 1 1 16 CYS CB C -4.712 -2.921 -6.350 1.00 . A A . 16 CYS CB 1 1 6 2514 1 1 16 CYS H H -4.468 -1.016 -4.758 1.00 . A A . 16 CYS H 1 1 6 2515 1 1 16 CYS HA H -5.147 -3.731 -4.409 1.00 . A A . 16 CYS HA 1 1 6 2516 1 1 16 CYS HB2 H -4.547 -1.882 -6.590 1.00 . A A . 16 CYS HB2 1 1 6 2517 1 1 16 CYS HB3 H -4.091 -3.540 -6.983 1.00 . A A . 16 CYS HB3 1 1 6 2518 1 1 16 CYS N N -4.232 -1.819 -4.247 1.00 . A A . 16 CYS N 1 1 6 2519 1 1 16 CYS O O -3.011 -5.038 -4.242 1.00 . A A . 16 CYS O 1 1 6 2520 1 1 16 CYS SG S -6.452 -3.341 -6.611 1.00 . A A . 16 CYS SG 1 1 6 2521 1 1 17 GLY C C -0.360 -4.164 -3.564 1.00 . A A . 17 GLY C 1 1 6 2522 1 1 17 GLY CA C -0.650 -4.046 -5.054 1.00 . A A . 17 GLY CA 1 1 6 2523 1 1 17 GLY H H -2.001 -2.457 -5.579 1.00 . A A . 17 GLY H 1 1 6 2524 1 1 17 GLY HA2 H -0.703 -5.028 -5.504 1.00 . A A . 17 GLY HA2 1 1 6 2525 1 1 17 GLY HA3 H 0.125 -3.464 -5.528 1.00 . A A . 17 GLY HA3 1 1 6 2526 1 1 17 GLY N N -1.957 -3.356 -5.192 1.00 . A A . 17 GLY N 1 1 6 2527 1 1 17 GLY O O -0.041 -3.183 -2.925 1.00 . A A . 17 GLY O 1 1 6 2528 1 1 18 TRP C C 1.049 -4.909 -1.092 1.00 . A A . 18 TRP C 1 1 6 2529 1 1 18 TRP CA C -0.287 -5.525 -1.532 1.00 . A A . 18 TRP CA 1 1 6 2530 1 1 18 TRP CB C -0.300 -7.040 -1.299 1.00 . A A . 18 TRP CB 1 1 6 2531 1 1 18 TRP CD1 C -2.783 -6.789 -0.800 1.00 . A A . 18 TRP CD1 1 1 6 2532 1 1 18 TRP CD2 C -2.238 -8.857 -1.502 1.00 . A A . 18 TRP CD2 1 1 6 2533 1 1 18 TRP CE2 C -3.633 -8.862 -1.267 1.00 . A A . 18 TRP CE2 1 1 6 2534 1 1 18 TRP CE3 C -1.635 -10.051 -1.957 1.00 . A A . 18 TRP CE3 1 1 6 2535 1 1 18 TRP CG C -1.720 -7.529 -1.200 1.00 . A A . 18 TRP CG 1 1 6 2536 1 1 18 TRP CH2 C -3.790 -11.181 -1.920 1.00 . A A . 18 TRP CH2 1 1 6 2537 1 1 18 TRP CZ2 C -4.403 -10.006 -1.471 1.00 . A A . 18 TRP CZ2 1 1 6 2538 1 1 18 TRP CZ3 C -2.412 -11.205 -2.164 1.00 . A A . 18 TRP CZ3 1 1 6 2539 1 1 18 TRP H H -0.816 -6.100 -3.548 1.00 . A A . 18 TRP H 1 1 6 2540 1 1 18 TRP HA H -1.097 -5.072 -0.979 1.00 . A A . 18 TRP HA 1 1 6 2541 1 1 18 TRP HB2 H 0.195 -7.535 -2.124 1.00 . A A . 18 TRP HB2 1 1 6 2542 1 1 18 TRP HB3 H 0.222 -7.266 -0.382 1.00 . A A . 18 TRP HB3 1 1 6 2543 1 1 18 TRP HD1 H -2.751 -5.749 -0.500 1.00 . A A . 18 TRP HD1 1 1 6 2544 1 1 18 TRP HE1 H -4.824 -7.280 -0.603 1.00 . A A . 18 TRP HE1 1 1 6 2545 1 1 18 TRP HE3 H -0.572 -10.079 -2.151 1.00 . A A . 18 TRP HE3 1 1 6 2546 1 1 18 TRP HH2 H -4.381 -12.072 -2.079 1.00 . A A . 18 TRP HH2 1 1 6 2547 1 1 18 TRP HZ2 H -5.464 -9.985 -1.283 1.00 . A A . 18 TRP HZ2 1 1 6 2548 1 1 18 TRP HZ3 H -1.942 -12.115 -2.510 1.00 . A A . 18 TRP HZ3 1 1 6 2549 1 1 18 TRP N N -0.517 -5.341 -3.003 1.00 . A A . 18 TRP N 1 1 6 2550 1 1 18 TRP NE1 N -3.919 -7.578 -0.842 1.00 . A A . 18 TRP NE1 1 1 6 2551 1 1 18 TRP O O 2.086 -5.550 -1.103 1.00 . A A . 18 TRP O 1 1 6 2552 1 1 19 ASN C C 2.024 -2.464 1.174 1.00 . A A . 19 ASN C 1 1 6 2553 1 1 19 ASN CA C 2.231 -2.942 -0.261 1.00 . A A . 19 ASN CA 1 1 6 2554 1 1 19 ASN CB C 2.339 -1.750 -1.219 1.00 . A A . 19 ASN CB 1 1 6 2555 1 1 19 ASN CG C 3.746 -1.668 -1.809 1.00 . A A . 19 ASN CG 1 1 6 2556 1 1 19 ASN H H 0.150 -3.191 -0.724 1.00 . A A . 19 ASN H 1 1 6 2557 1 1 19 ASN HA H 3.104 -3.571 -0.337 1.00 . A A . 19 ASN HA 1 1 6 2558 1 1 19 ASN HB2 H 1.624 -1.868 -2.016 1.00 . A A . 19 ASN HB2 1 1 6 2559 1 1 19 ASN HB3 H 2.127 -0.839 -0.679 1.00 . A A . 19 ASN HB3 1 1 6 2560 1 1 19 ASN HD21 H 3.777 0.308 -1.795 1.00 . A A . 19 ASN HD21 1 1 6 2561 1 1 19 ASN HD22 H 5.170 -0.430 -2.402 1.00 . A A . 19 ASN HD22 1 1 6 2562 1 1 19 ASN N N 1.007 -3.662 -0.712 1.00 . A A . 19 ASN N 1 1 6 2563 1 1 19 ASN ND2 N 4.276 -0.500 -2.018 1.00 . A A . 19 ASN ND2 1 1 6 2564 1 1 19 ASN O O 1.168 -2.965 1.879 1.00 . A A . 19 ASN O 1 1 6 2565 1 1 19 ASN OD1 O 4.364 -2.670 -2.091 1.00 . A A . 19 ASN OD1 1 1 6 2566 1 1 20 ALA C C 2.329 0.508 3.016 1.00 . A A . 20 ALA C 1 1 6 2567 1 1 20 ALA CA C 2.575 -1.000 3.013 1.00 . A A . 20 ALA CA 1 1 6 2568 1 1 20 ALA CB C 3.875 -1.310 3.742 1.00 . A A . 20 ALA CB 1 1 6 2569 1 1 20 ALA H H 3.454 -1.090 1.050 1.00 . A A . 20 ALA H 1 1 6 2570 1 1 20 ALA HA H 1.759 -1.520 3.483 1.00 . A A . 20 ALA HA 1 1 6 2571 1 1 20 ALA HB1 H 4.656 -0.664 3.372 1.00 . A A . 20 ALA HB1 1 1 6 2572 1 1 20 ALA HB2 H 4.147 -2.341 3.574 1.00 . A A . 20 ALA HB2 1 1 6 2573 1 1 20 ALA HB3 H 3.742 -1.140 4.801 1.00 . A A . 20 ALA HB3 1 1 6 2574 1 1 20 ALA N N 2.773 -1.494 1.623 1.00 . A A . 20 ALA N 1 1 6 2575 1 1 20 ALA O O 3.129 1.273 2.507 1.00 . A A . 20 ALA O 1 1 6 2576 1 1 21 CYS C C 1.841 2.986 4.783 1.00 . A A . 21 CYS C 1 1 6 2577 1 1 21 CYS CA C 0.978 2.410 3.661 1.00 . A A . 21 CYS CA 1 1 6 2578 1 1 21 CYS CB C -0.515 2.533 3.975 1.00 . A A . 21 CYS CB 1 1 6 2579 1 1 21 CYS H H 0.635 0.313 4.025 1.00 . A A . 21 CYS H 1 1 6 2580 1 1 21 CYS HA H 1.206 2.879 2.718 1.00 . A A . 21 CYS HA 1 1 6 2581 1 1 21 CYS HB2 H -1.051 1.756 3.455 1.00 . A A . 21 CYS HB2 1 1 6 2582 1 1 21 CYS HB3 H -0.668 2.427 5.040 1.00 . A A . 21 CYS HB3 1 1 6 2583 1 1 21 CYS N N 1.248 0.945 3.599 1.00 . A A . 21 CYS N 1 1 6 2584 1 1 21 CYS O O 1.573 2.778 5.951 1.00 . A A . 21 CYS O 1 1 6 2585 1 1 21 CYS SG S -1.128 4.150 3.434 1.00 . A A . 21 CYS SG 1 1 6 2586 1 1 22 ALA C C 4.066 5.689 5.359 1.00 . A A . 22 ALA C 1 1 6 2587 1 1 22 ALA CA C 3.830 4.182 5.495 1.00 . A A . 22 ALA CA 1 1 6 2588 1 1 22 ALA CB C 5.141 3.417 5.264 1.00 . A A . 22 ALA CB 1 1 6 2589 1 1 22 ALA H H 3.132 3.770 3.488 1.00 . A A . 22 ALA H 1 1 6 2590 1 1 22 ALA HA H 3.446 3.952 6.477 1.00 . A A . 22 ALA HA 1 1 6 2591 1 1 22 ALA HB1 H 5.962 3.957 5.719 1.00 . A A . 22 ALA HB1 1 1 6 2592 1 1 22 ALA HB2 H 5.319 3.325 4.201 1.00 . A A . 22 ALA HB2 1 1 6 2593 1 1 22 ALA HB3 H 5.070 2.435 5.705 1.00 . A A . 22 ALA HB3 1 1 6 2594 1 1 22 ALA N N 2.911 3.652 4.439 1.00 . A A . 22 ALA N 1 1 6 2595 1 1 22 ALA O O 3.718 6.459 6.233 1.00 . A A . 22 ALA O 1 1 6 2596 1 1 23 LEU C C 3.718 8.259 3.502 1.00 . A A . 23 LEU C 1 1 6 2597 1 1 23 LEU CA C 4.947 7.576 4.109 1.00 . A A . 23 LEU CA 1 1 6 2598 1 1 23 LEU CB C 6.155 7.690 3.146 1.00 . A A . 23 LEU CB 1 1 6 2599 1 1 23 LEU CD1 C 8.306 6.692 2.345 1.00 . A A . 23 LEU CD1 1 1 6 2600 1 1 23 LEU CD2 C 7.590 6.307 4.690 1.00 . A A . 23 LEU CD2 1 1 6 2601 1 1 23 LEU CG C 7.098 6.477 3.255 1.00 . A A . 23 LEU CG 1 1 6 2602 1 1 23 LEU H H 4.944 5.474 3.597 1.00 . A A . 23 LEU H 1 1 6 2603 1 1 23 LEU HA H 5.188 8.023 5.059 1.00 . A A . 23 LEU HA 1 1 6 2604 1 1 23 LEU HB2 H 5.792 7.760 2.132 1.00 . A A . 23 LEU HB2 1 1 6 2605 1 1 23 LEU HB3 H 6.705 8.590 3.383 1.00 . A A . 23 LEU HB3 1 1 6 2606 1 1 23 LEU HD11 H 7.989 7.171 1.432 1.00 . A A . 23 LEU HD11 1 1 6 2607 1 1 23 LEU HD12 H 8.755 5.736 2.115 1.00 . A A . 23 LEU HD12 1 1 6 2608 1 1 23 LEU HD13 H 9.029 7.317 2.848 1.00 . A A . 23 LEU HD13 1 1 6 2609 1 1 23 LEU HD21 H 6.763 6.418 5.372 1.00 . A A . 23 LEU HD21 1 1 6 2610 1 1 23 LEU HD22 H 8.339 7.057 4.904 1.00 . A A . 23 LEU HD22 1 1 6 2611 1 1 23 LEU HD23 H 8.021 5.322 4.805 1.00 . A A . 23 LEU HD23 1 1 6 2612 1 1 23 LEU HG H 6.576 5.587 2.944 1.00 . A A . 23 LEU HG 1 1 6 2613 1 1 23 LEU N N 4.670 6.114 4.283 1.00 . A A . 23 LEU N 1 1 6 2614 1 1 23 LEU O O 3.808 8.935 2.499 1.00 . A A . 23 LEU O 1 1 6 2615 1 1 24 GLY C C 0.929 7.959 2.234 1.00 . A A . 24 GLY C 1 1 6 2616 1 1 24 GLY CA C 1.324 8.685 3.532 1.00 . A A . 24 GLY CA 1 1 6 2617 1 1 24 GLY H H 2.509 7.511 4.898 1.00 . A A . 24 GLY H 1 1 6 2618 1 1 24 GLY HA2 H 0.524 8.599 4.254 1.00 . A A . 24 GLY HA2 1 1 6 2619 1 1 24 GLY HA3 H 1.506 9.726 3.317 1.00 . A A . 24 GLY HA3 1 1 6 2620 1 1 24 GLY N N 2.565 8.070 4.094 1.00 . A A . 24 GLY N 1 1 6 2621 1 1 24 GLY O O 0.037 8.384 1.528 1.00 . A A . 24 GLY O 1 1 6 2622 1 1 25 ILE C C 1.709 4.662 0.824 1.00 . A A . 25 ILE C 1 1 6 2623 1 1 25 ILE CA C 1.268 6.111 0.663 1.00 . A A . 25 ILE CA 1 1 6 2624 1 1 25 ILE CB C 2.071 6.752 -0.479 1.00 . A A . 25 ILE CB 1 1 6 2625 1 1 25 ILE CD1 C 3.677 8.530 -1.165 1.00 . A A . 25 ILE CD1 1 1 6 2626 1 1 25 ILE CG1 C 3.008 7.854 0.028 1.00 . A A . 25 ILE CG1 1 1 6 2627 1 1 25 ILE CG2 C 1.112 7.342 -1.502 1.00 . A A . 25 ILE CG2 1 1 6 2628 1 1 25 ILE H H 2.302 6.543 2.495 1.00 . A A . 25 ILE H 1 1 6 2629 1 1 25 ILE HA H 0.214 6.166 0.445 1.00 . A A . 25 ILE HA 1 1 6 2630 1 1 25 ILE HB H 2.654 5.982 -0.957 1.00 . A A . 25 ILE HB 1 1 6 2631 1 1 25 ILE HD11 H 3.214 9.488 -1.336 1.00 . A A . 25 ILE HD11 1 1 6 2632 1 1 25 ILE HD12 H 3.559 7.909 -2.041 1.00 . A A . 25 ILE HD12 1 1 6 2633 1 1 25 ILE HD13 H 4.728 8.672 -0.960 1.00 . A A . 25 ILE HD13 1 1 6 2634 1 1 25 ILE HG12 H 2.438 8.584 0.579 1.00 . A A . 25 ILE HG12 1 1 6 2635 1 1 25 ILE HG13 H 3.765 7.426 0.667 1.00 . A A . 25 ILE HG13 1 1 6 2636 1 1 25 ILE HG21 H 1.678 7.742 -2.331 1.00 . A A . 25 ILE HG21 1 1 6 2637 1 1 25 ILE HG22 H 0.534 8.130 -1.044 1.00 . A A . 25 ILE HG22 1 1 6 2638 1 1 25 ILE HG23 H 0.455 6.567 -1.859 1.00 . A A . 25 ILE HG23 1 1 6 2639 1 1 25 ILE N N 1.589 6.869 1.913 1.00 . A A . 25 ILE N 1 1 6 2640 1 1 25 ILE O O 2.349 4.307 1.801 1.00 . A A . 25 ILE O 1 1 6 2641 1 1 26 CYS C C 3.299 2.306 -0.560 1.00 . A A . 26 CYS C 1 1 6 2642 1 1 26 CYS CA C 1.862 2.400 -0.045 1.00 . A A . 26 CYS CA 1 1 6 2643 1 1 26 CYS CB C 0.906 1.608 -0.947 1.00 . A A . 26 CYS CB 1 1 6 2644 1 1 26 CYS H H 0.938 4.152 -0.944 1.00 . A A . 26 CYS H 1 1 6 2645 1 1 26 CYS HA H 1.796 2.051 0.972 1.00 . A A . 26 CYS HA 1 1 6 2646 1 1 26 CYS HB2 H 0.681 2.184 -1.828 1.00 . A A . 26 CYS HB2 1 1 6 2647 1 1 26 CYS HB3 H 1.372 0.682 -1.239 1.00 . A A . 26 CYS HB3 1 1 6 2648 1 1 26 CYS N N 1.420 3.828 -0.140 1.00 . A A . 26 CYS N 1 1 6 2649 1 1 26 CYS O O 3.554 2.631 -1.695 1.00 . A A . 26 CYS O 1 1 6 2650 1 1 26 CYS SG S -0.625 1.257 -0.039 1.00 . A A . 26 CYS SG 1 1 6 2651 1 1 27 MET C C 6.496 0.699 0.373 1.00 . A A . 27 MET C 1 1 6 2652 1 1 27 MET CA C 5.658 1.832 -0.269 1.00 . A A . 27 MET CA 1 1 6 2653 1 1 27 MET CB C 6.249 3.208 0.054 1.00 . A A . 27 MET CB 1 1 6 2654 1 1 27 MET CE C 7.696 2.553 -2.761 1.00 . A A . 27 MET CE 1 1 6 2655 1 1 27 MET CG C 6.151 4.129 -1.168 1.00 . A A . 27 MET CG 1 1 6 2656 1 1 27 MET H H 4.044 1.646 1.177 1.00 . A A . 27 MET H 1 1 6 2657 1 1 27 MET HA H 5.643 1.700 -1.334 1.00 . A A . 27 MET HA 1 1 6 2658 1 1 27 MET HB2 H 5.703 3.649 0.876 1.00 . A A . 27 MET HB2 1 1 6 2659 1 1 27 MET HB3 H 7.284 3.094 0.333 1.00 . A A . 27 MET HB3 1 1 6 2660 1 1 27 MET HE1 H 6.750 2.419 -3.268 1.00 . A A . 27 MET HE1 1 1 6 2661 1 1 27 MET HE2 H 7.796 1.803 -1.992 1.00 . A A . 27 MET HE2 1 1 6 2662 1 1 27 MET HE3 H 8.509 2.450 -3.468 1.00 . A A . 27 MET HE3 1 1 6 2663 1 1 27 MET HG2 H 5.400 3.756 -1.847 1.00 . A A . 27 MET HG2 1 1 6 2664 1 1 27 MET HG3 H 5.875 5.123 -0.844 1.00 . A A . 27 MET HG3 1 1 6 2665 1 1 27 MET N N 4.248 1.892 0.247 1.00 . A A . 27 MET N 1 1 6 2666 1 1 27 MET O O 6.822 -0.259 -0.298 1.00 . A A . 27 MET O 1 1 6 2667 1 1 27 MET SD S 7.754 4.197 -2.011 1.00 . A A . 27 MET SD 1 1 6 2668 1 1 28 PRO C C 6.926 -1.453 2.630 1.00 . A A . 28 PRO C 1 1 6 2669 1 1 28 PRO CA C 7.701 -0.158 2.328 1.00 . A A . 28 PRO CA 1 1 6 2670 1 1 28 PRO CB C 8.114 0.553 3.619 1.00 . A A . 28 PRO CB 1 1 6 2671 1 1 28 PRO CD C 6.516 1.979 2.507 1.00 . A A . 28 PRO CD 1 1 6 2672 1 1 28 PRO CG C 7.045 1.568 3.852 1.00 . A A . 28 PRO CG 1 1 6 2673 1 1 28 PRO HA H 8.576 -0.377 1.741 1.00 . A A . 28 PRO HA 1 1 6 2674 1 1 28 PRO HB2 H 8.154 -0.153 4.439 1.00 . A A . 28 PRO HB2 1 1 6 2675 1 1 28 PRO HB3 H 9.071 1.043 3.495 1.00 . A A . 28 PRO HB3 1 1 6 2676 1 1 28 PRO HD2 H 5.444 2.118 2.548 1.00 . A A . 28 PRO HD2 1 1 6 2677 1 1 28 PRO HD3 H 7.002 2.878 2.161 1.00 . A A . 28 PRO HD3 1 1 6 2678 1 1 28 PRO HG2 H 6.253 1.134 4.441 1.00 . A A . 28 PRO HG2 1 1 6 2679 1 1 28 PRO HG3 H 7.455 2.427 4.356 1.00 . A A . 28 PRO HG3 1 1 6 2680 1 1 28 PRO N N 6.853 0.859 1.630 1.00 . A A . 28 PRO N 1 1 6 2681 1 1 28 PRO O O 6.573 -1.729 3.762 1.00 . A A . 28 PRO O 1 1 6 2682 1 1 29 ARG C C 6.768 -4.561 2.606 1.00 . A A . 29 ARG C 1 1 6 2683 1 1 29 ARG CA C 5.932 -3.538 1.813 1.00 . A A . 29 ARG CA 1 1 6 2684 1 1 29 ARG CB C 5.662 -4.056 0.392 1.00 . A A . 29 ARG CB 1 1 6 2685 1 1 29 ARG CD C 7.094 -3.509 -1.593 1.00 . A A . 29 ARG CD 1 1 6 2686 1 1 29 ARG CG C 6.985 -4.353 -0.317 1.00 . A A . 29 ARG CG 1 1 6 2687 1 1 29 ARG CZ C 9.027 -2.777 -2.901 1.00 . A A . 29 ARG CZ 1 1 6 2688 1 1 29 ARG H H 6.982 -1.985 0.726 1.00 . A A . 29 ARG H 1 1 6 2689 1 1 29 ARG HA H 4.996 -3.358 2.316 1.00 . A A . 29 ARG HA 1 1 6 2690 1 1 29 ARG HB2 H 5.076 -4.961 0.447 1.00 . A A . 29 ARG HB2 1 1 6 2691 1 1 29 ARG HB3 H 5.113 -3.311 -0.166 1.00 . A A . 29 ARG HB3 1 1 6 2692 1 1 29 ARG HD2 H 6.688 -4.058 -2.430 1.00 . A A . 29 ARG HD2 1 1 6 2693 1 1 29 ARG HD3 H 6.580 -2.565 -1.476 1.00 . A A . 29 ARG HD3 1 1 6 2694 1 1 29 ARG HE H 9.181 -3.501 -1.056 1.00 . A A . 29 ARG HE 1 1 6 2695 1 1 29 ARG HG2 H 7.806 -4.121 0.346 1.00 . A A . 29 ARG HG2 1 1 6 2696 1 1 29 ARG HG3 H 7.018 -5.397 -0.577 1.00 . A A . 29 ARG HG3 1 1 6 2697 1 1 29 ARG HH11 H 7.230 -2.623 -3.782 1.00 . A A . 29 ARG HH11 1 1 6 2698 1 1 29 ARG HH12 H 8.574 -2.094 -4.729 1.00 . A A . 29 ARG HH12 1 1 6 2699 1 1 29 ARG HH21 H 10.936 -2.816 -2.295 1.00 . A A . 29 ARG HH21 1 1 6 2700 1 1 29 ARG HH22 H 10.678 -2.200 -3.891 1.00 . A A . 29 ARG HH22 1 1 6 2701 1 1 29 ARG N N 6.676 -2.243 1.620 1.00 . A A . 29 ARG N 1 1 6 2702 1 1 29 ARG NE N 8.559 -3.275 -1.782 1.00 . A A . 29 ARG NE 1 1 6 2703 1 1 29 ARG NH1 N 8.212 -2.473 -3.882 1.00 . A A . 29 ARG NH1 1 1 6 2704 1 1 29 ARG NH2 N 10.314 -2.582 -3.040 1.00 . A A . 29 ARG NH2 1 1 6 2705 1 1 29 ARG O O 7.984 -4.464 2.584 1.00 . A A . 29 ARG O 1 1 6 2706 1 1 29 ARG OXT O 6.175 -5.434 3.221 1.00 . A A . 29 ARG OXT 1 1 7 2707 1 1 1 GLY C C -10.235 0.952 -4.270 1.00 . A A . 1 GLY C 1 1 7 2708 1 1 1 GLY CA C -11.607 1.065 -4.945 1.00 . A A . 1 GLY CA 1 1 7 2709 1 1 1 GLY H1 H -13.319 1.335 -3.790 1.00 . A A . 1 GLY H1 1 1 7 2710 1 1 1 GLY H2 H -12.850 2.708 -4.668 1.00 . A A . 1 GLY H2 1 1 7 2711 1 1 1 GLY H3 H -11.991 2.254 -3.276 1.00 . A A . 1 GLY H3 1 1 7 2712 1 1 1 GLY HA2 H -12.036 0.079 -5.061 1.00 . A A . 1 GLY HA2 1 1 7 2713 1 1 1 GLY HA3 H -11.491 1.524 -5.915 1.00 . A A . 1 GLY HA3 1 1 7 2714 1 1 1 GLY N N -12.510 1.901 -4.106 1.00 . A A . 1 GLY N 1 1 7 2715 1 1 1 GLY O O -10.049 1.409 -3.157 1.00 . A A . 1 GLY O 1 1 7 2716 1 1 2 CYS C C -6.906 1.107 -5.069 1.00 . A A . 2 CYS C 1 1 7 2717 1 1 2 CYS CA C -7.909 0.217 -4.320 1.00 . A A . 2 CYS CA 1 1 7 2718 1 1 2 CYS CB C -7.543 -1.265 -4.481 1.00 . A A . 2 CYS CB 1 1 7 2719 1 1 2 CYS H H -9.439 0.001 -5.829 1.00 . A A . 2 CYS H 1 1 7 2720 1 1 2 CYS HA H -7.937 0.479 -3.273 1.00 . A A . 2 CYS HA 1 1 7 2721 1 1 2 CYS HB2 H -6.577 -1.448 -4.036 1.00 . A A . 2 CYS HB2 1 1 7 2722 1 1 2 CYS HB3 H -8.285 -1.875 -3.988 1.00 . A A . 2 CYS HB3 1 1 7 2723 1 1 2 CYS N N -9.272 0.355 -4.930 1.00 . A A . 2 CYS N 1 1 7 2724 1 1 2 CYS O O -7.164 1.538 -6.175 1.00 . A A . 2 CYS O 1 1 7 2725 1 1 2 CYS SG S -7.486 -1.692 -6.245 1.00 . A A . 2 CYS SG 1 1 7 2726 1 1 3 LYS C C -3.473 1.475 -5.471 1.00 . A A . 3 LYS C 1 1 7 2727 1 1 3 LYS CA C -4.764 2.252 -5.172 1.00 . A A . 3 LYS CA 1 1 7 2728 1 1 3 LYS CB C -4.455 3.406 -4.216 1.00 . A A . 3 LYS CB 1 1 7 2729 1 1 3 LYS CD C -5.424 4.787 -2.378 1.00 . A A . 3 LYS CD 1 1 7 2730 1 1 3 LYS CE C -6.145 6.143 -2.382 1.00 . A A . 3 LYS CE 1 1 7 2731 1 1 3 LYS CG C -5.745 4.019 -3.665 1.00 . A A . 3 LYS CG 1 1 7 2732 1 1 3 LYS H H -5.581 1.034 -3.580 1.00 . A A . 3 LYS H 1 1 7 2733 1 1 3 LYS HA H -5.179 2.642 -6.089 1.00 . A A . 3 LYS HA 1 1 7 2734 1 1 3 LYS HB2 H -3.847 3.047 -3.400 1.00 . A A . 3 LYS HB2 1 1 7 2735 1 1 3 LYS HB3 H -3.912 4.160 -4.756 1.00 . A A . 3 LYS HB3 1 1 7 2736 1 1 3 LYS HD2 H -5.750 4.209 -1.526 1.00 . A A . 3 LYS HD2 1 1 7 2737 1 1 3 LYS HD3 H -4.356 4.951 -2.309 1.00 . A A . 3 LYS HD3 1 1 7 2738 1 1 3 LYS HE2 H -5.582 6.866 -1.806 1.00 . A A . 3 LYS HE2 1 1 7 2739 1 1 3 LYS HE3 H -6.286 6.496 -3.392 1.00 . A A . 3 LYS HE3 1 1 7 2740 1 1 3 LYS HG2 H -6.163 4.694 -4.400 1.00 . A A . 3 LYS HG2 1 1 7 2741 1 1 3 LYS HG3 H -6.455 3.237 -3.451 1.00 . A A . 3 LYS HG3 1 1 7 2742 1 1 3 LYS HZ1 H -8.011 5.216 -2.323 1.00 . A A . 3 LYS HZ1 1 1 7 2743 1 1 3 LYS HZ2 H -7.986 6.769 -1.641 1.00 . A A . 3 LYS HZ2 1 1 7 2744 1 1 3 LYS HZ3 H -7.307 5.454 -0.788 1.00 . A A . 3 LYS HZ3 1 1 7 2745 1 1 3 LYS N N -5.769 1.386 -4.477 1.00 . A A . 3 LYS N 1 1 7 2746 1 1 3 LYS NZ N -7.462 5.877 -1.741 1.00 . A A . 3 LYS NZ 1 1 7 2747 1 1 3 LYS O O -3.398 0.273 -5.279 1.00 . A A . 3 LYS O 1 1 7 2748 1 1 4 LEU C C -0.125 1.787 -5.164 1.00 . A A . 4 LEU C 1 1 7 2749 1 1 4 LEU CA C -1.158 1.520 -6.279 1.00 . A A . 4 LEU CA 1 1 7 2750 1 1 4 LEU CB C -0.731 2.172 -7.614 1.00 . A A . 4 LEU CB 1 1 7 2751 1 1 4 LEU CD1 C -1.593 0.110 -8.752 1.00 . A A . 4 LEU CD1 1 1 7 2752 1 1 4 LEU CD2 C -3.006 2.158 -8.681 1.00 . A A . 4 LEU CD2 1 1 7 2753 1 1 4 LEU CG C -1.572 1.634 -8.781 1.00 . A A . 4 LEU CG 1 1 7 2754 1 1 4 LEU H H -2.570 3.130 -6.082 1.00 . A A . 4 LEU H 1 1 7 2755 1 1 4 LEU HA H -1.294 0.459 -6.415 1.00 . A A . 4 LEU HA 1 1 7 2756 1 1 4 LEU HB2 H -0.860 3.239 -7.544 1.00 . A A . 4 LEU HB2 1 1 7 2757 1 1 4 LEU HB3 H 0.307 1.954 -7.803 1.00 . A A . 4 LEU HB3 1 1 7 2758 1 1 4 LEU HD11 H -1.833 -0.264 -9.737 1.00 . A A . 4 LEU HD11 1 1 7 2759 1 1 4 LEU HD12 H -2.340 -0.226 -8.048 1.00 . A A . 4 LEU HD12 1 1 7 2760 1 1 4 LEU HD13 H -0.624 -0.258 -8.452 1.00 . A A . 4 LEU HD13 1 1 7 2761 1 1 4 LEU HD21 H -3.404 2.309 -9.671 1.00 . A A . 4 LEU HD21 1 1 7 2762 1 1 4 LEU HD22 H -3.010 3.095 -8.143 1.00 . A A . 4 LEU HD22 1 1 7 2763 1 1 4 LEU HD23 H -3.614 1.439 -8.155 1.00 . A A . 4 LEU HD23 1 1 7 2764 1 1 4 LEU HG H -1.136 1.965 -9.715 1.00 . A A . 4 LEU HG 1 1 7 2765 1 1 4 LEU N N -2.464 2.170 -5.943 1.00 . A A . 4 LEU N 1 1 7 2766 1 1 4 LEU O O -0.387 1.540 -4.000 1.00 . A A . 4 LEU O 1 1 7 2767 1 1 5 THR C C 1.982 3.968 -3.912 1.00 . A A . 5 THR C 1 1 7 2768 1 1 5 THR CA C 2.093 2.534 -4.462 1.00 . A A . 5 THR CA 1 1 7 2769 1 1 5 THR CB C 3.445 2.333 -5.178 1.00 . A A . 5 THR CB 1 1 7 2770 1 1 5 THR CG2 C 4.341 1.401 -4.355 1.00 . A A . 5 THR CG2 1 1 7 2771 1 1 5 THR H H 1.258 2.456 -6.435 1.00 . A A . 5 THR H 1 1 7 2772 1 1 5 THR HA H 2.000 1.823 -3.657 1.00 . A A . 5 THR HA 1 1 7 2773 1 1 5 THR HB H 3.939 3.288 -5.277 1.00 . A A . 5 THR HB 1 1 7 2774 1 1 5 THR HG1 H 4.056 1.869 -6.975 1.00 . A A . 5 THR HG1 1 1 7 2775 1 1 5 THR HG21 H 5.193 1.098 -4.948 1.00 . A A . 5 THR HG21 1 1 7 2776 1 1 5 THR HG22 H 3.783 0.527 -4.060 1.00 . A A . 5 THR HG22 1 1 7 2777 1 1 5 THR HG23 H 4.684 1.921 -3.468 1.00 . A A . 5 THR HG23 1 1 7 2778 1 1 5 THR N N 1.050 2.274 -5.500 1.00 . A A . 5 THR N 1 1 7 2779 1 1 5 THR O O 1.484 4.182 -2.823 1.00 . A A . 5 THR O 1 1 7 2780 1 1 5 THR OG1 O 3.238 1.772 -6.473 1.00 . A A . 5 THR OG1 1 1 7 2781 1 1 6 PHE C C 0.957 6.930 -4.221 1.00 . A A . 6 PHE C 1 1 7 2782 1 1 6 PHE CA C 2.384 6.366 -4.168 1.00 . A A . 6 PHE CA 1 1 7 2783 1 1 6 PHE CB C 3.305 7.141 -5.117 1.00 . A A . 6 PHE CB 1 1 7 2784 1 1 6 PHE CD1 C 5.338 6.965 -3.622 1.00 . A A . 6 PHE CD1 1 1 7 2785 1 1 6 PHE CD2 C 4.581 9.165 -4.307 1.00 . A A . 6 PHE CD2 1 1 7 2786 1 1 6 PHE CE1 C 6.373 7.554 -2.894 1.00 . A A . 6 PHE CE1 1 1 7 2787 1 1 6 PHE CE2 C 5.619 9.742 -3.577 1.00 . A A . 6 PHE CE2 1 1 7 2788 1 1 6 PHE CG C 4.434 7.771 -4.331 1.00 . A A . 6 PHE CG 1 1 7 2789 1 1 6 PHE CZ C 6.510 8.937 -2.872 1.00 . A A . 6 PHE CZ 1 1 7 2790 1 1 6 PHE H H 2.828 4.755 -5.516 1.00 . A A . 6 PHE H 1 1 7 2791 1 1 6 PHE HA H 2.767 6.431 -3.161 1.00 . A A . 6 PHE HA 1 1 7 2792 1 1 6 PHE HB2 H 3.715 6.463 -5.851 1.00 . A A . 6 PHE HB2 1 1 7 2793 1 1 6 PHE HB3 H 2.741 7.913 -5.617 1.00 . A A . 6 PHE HB3 1 1 7 2794 1 1 6 PHE HD1 H 5.241 5.892 -3.638 1.00 . A A . 6 PHE HD1 1 1 7 2795 1 1 6 PHE HD2 H 3.894 9.795 -4.846 1.00 . A A . 6 PHE HD2 1 1 7 2796 1 1 6 PHE HE1 H 7.065 6.941 -2.345 1.00 . A A . 6 PHE HE1 1 1 7 2797 1 1 6 PHE HE2 H 5.738 10.810 -3.557 1.00 . A A . 6 PHE HE2 1 1 7 2798 1 1 6 PHE HZ H 7.308 9.387 -2.310 1.00 . A A . 6 PHE HZ 1 1 7 2799 1 1 6 PHE N N 2.439 4.948 -4.650 1.00 . A A . 6 PHE N 1 1 7 2800 1 1 6 PHE O O 0.748 8.075 -4.581 1.00 . A A . 6 PHE O 1 1 7 2801 1 1 7 TRP C C -1.850 6.883 -2.395 1.00 . A A . 7 TRP C 1 1 7 2802 1 1 7 TRP CA C -1.411 6.657 -3.841 1.00 . A A . 7 TRP CA 1 1 7 2803 1 1 7 TRP CB C -2.247 5.549 -4.477 1.00 . A A . 7 TRP CB 1 1 7 2804 1 1 7 TRP CD1 C -0.770 5.375 -6.518 1.00 . A A . 7 TRP CD1 1 1 7 2805 1 1 7 TRP CD2 C -2.949 5.528 -7.044 1.00 . A A . 7 TRP CD2 1 1 7 2806 1 1 7 TRP CE2 C -2.243 5.446 -8.266 1.00 . A A . 7 TRP CE2 1 1 7 2807 1 1 7 TRP CE3 C -4.347 5.629 -7.090 1.00 . A A . 7 TRP CE3 1 1 7 2808 1 1 7 TRP CG C -1.988 5.491 -5.950 1.00 . A A . 7 TRP CG 1 1 7 2809 1 1 7 TRP CH2 C -4.292 5.562 -9.524 1.00 . A A . 7 TRP CH2 1 1 7 2810 1 1 7 TRP CZ2 C -2.900 5.465 -9.493 1.00 . A A . 7 TRP CZ2 1 1 7 2811 1 1 7 TRP CZ3 C -5.015 5.645 -8.325 1.00 . A A . 7 TRP CZ3 1 1 7 2812 1 1 7 TRP H H 0.167 5.240 -3.536 1.00 . A A . 7 TRP H 1 1 7 2813 1 1 7 TRP HA H -1.491 7.561 -4.419 1.00 . A A . 7 TRP HA 1 1 7 2814 1 1 7 TRP HB2 H -1.991 4.600 -4.025 1.00 . A A . 7 TRP HB2 1 1 7 2815 1 1 7 TRP HB3 H -3.290 5.756 -4.305 1.00 . A A . 7 TRP HB3 1 1 7 2816 1 1 7 TRP HD1 H 0.167 5.317 -5.986 1.00 . A A . 7 TRP HD1 1 1 7 2817 1 1 7 TRP HE1 H -0.180 5.294 -8.533 1.00 . A A . 7 TRP HE1 1 1 7 2818 1 1 7 TRP HE3 H -4.911 5.688 -6.169 1.00 . A A . 7 TRP HE3 1 1 7 2819 1 1 7 TRP HH2 H -4.813 5.577 -10.470 1.00 . A A . 7 TRP HH2 1 1 7 2820 1 1 7 TRP HZ2 H -2.338 5.398 -10.412 1.00 . A A . 7 TRP HZ2 1 1 7 2821 1 1 7 TRP HZ3 H -6.089 5.720 -8.349 1.00 . A A . 7 TRP HZ3 1 1 7 2822 1 1 7 TRP N N -0.018 6.152 -3.842 1.00 . A A . 7 TRP N 1 1 7 2823 1 1 7 TRP NE1 N -0.916 5.362 -7.889 1.00 . A A . 7 TRP NE1 1 1 7 2824 1 1 7 TRP O O -2.261 5.952 -1.733 1.00 . A A . 7 TRP O 1 1 7 2825 1 1 8 LYS C C -3.146 7.418 0.075 1.00 . A A . 8 LYS C 1 1 7 2826 1 1 8 LYS CA C -2.122 8.425 -0.479 1.00 . A A . 8 LYS CA 1 1 7 2827 1 1 8 LYS CB C -2.721 9.848 -0.505 1.00 . A A . 8 LYS CB 1 1 7 2828 1 1 8 LYS CD C -4.971 10.065 -1.616 1.00 . A A . 8 LYS CD 1 1 7 2829 1 1 8 LYS CE C -5.690 10.932 -2.661 1.00 . A A . 8 LYS CE 1 1 7 2830 1 1 8 LYS CG C -3.455 10.132 -1.833 1.00 . A A . 8 LYS CG 1 1 7 2831 1 1 8 LYS H H -1.371 8.810 -2.476 1.00 . A A . 8 LYS H 1 1 7 2832 1 1 8 LYS HA H -1.242 8.422 0.144 1.00 . A A . 8 LYS HA 1 1 7 2833 1 1 8 LYS HB2 H -3.420 9.950 0.313 1.00 . A A . 8 LYS HB2 1 1 7 2834 1 1 8 LYS HB3 H -1.927 10.568 -0.379 1.00 . A A . 8 LYS HB3 1 1 7 2835 1 1 8 LYS HD2 H -5.297 9.040 -1.717 1.00 . A A . 8 LYS HD2 1 1 7 2836 1 1 8 LYS HD3 H -5.210 10.422 -0.627 1.00 . A A . 8 LYS HD3 1 1 7 2837 1 1 8 LYS HE2 H -5.365 10.665 -3.658 1.00 . A A . 8 LYS HE2 1 1 7 2838 1 1 8 LYS HE3 H -6.759 10.811 -2.572 1.00 . A A . 8 LYS HE3 1 1 7 2839 1 1 8 LYS HG2 H -3.184 11.117 -2.184 1.00 . A A . 8 LYS HG2 1 1 7 2840 1 1 8 LYS HG3 H -3.171 9.402 -2.574 1.00 . A A . 8 LYS HG3 1 1 7 2841 1 1 8 LYS HZ1 H -6.074 12.979 -2.628 1.00 . A A . 8 LYS HZ1 1 1 7 2842 1 1 8 LYS HZ2 H -4.439 12.589 -2.860 1.00 . A A . 8 LYS HZ2 1 1 7 2843 1 1 8 LYS HZ3 H -5.144 12.439 -1.321 1.00 . A A . 8 LYS HZ3 1 1 7 2844 1 1 8 LYS N N -1.735 8.102 -1.905 1.00 . A A . 8 LYS N 1 1 7 2845 1 1 8 LYS NZ N -5.307 12.340 -2.343 1.00 . A A . 8 LYS NZ 1 1 7 2846 1 1 8 LYS O O -4.329 7.498 -0.209 1.00 . A A . 8 LYS O 1 1 7 2847 1 1 9 CYS C C -3.835 5.599 2.909 1.00 . A A . 9 CYS C 1 1 7 2848 1 1 9 CYS CA C -3.643 5.436 1.396 1.00 . A A . 9 CYS CA 1 1 7 2849 1 1 9 CYS CB C -3.014 4.066 1.087 1.00 . A A . 9 CYS CB 1 1 7 2850 1 1 9 CYS H H -1.731 6.401 1.046 1.00 . A A . 9 CYS H 1 1 7 2851 1 1 9 CYS HA H -4.597 5.513 0.897 1.00 . A A . 9 CYS HA 1 1 7 2852 1 1 9 CYS HB2 H -3.515 3.305 1.666 1.00 . A A . 9 CYS HB2 1 1 7 2853 1 1 9 CYS HB3 H -3.138 3.847 0.034 1.00 . A A . 9 CYS HB3 1 1 7 2854 1 1 9 CYS N N -2.694 6.459 0.845 1.00 . A A . 9 CYS N 1 1 7 2855 1 1 9 CYS O O -3.085 6.286 3.577 1.00 . A A . 9 CYS O 1 1 7 2856 1 1 9 CYS SG S -1.240 4.050 1.503 1.00 . A A . 9 CYS SG 1 1 7 2857 1 1 10 LYS C C -4.647 3.694 5.547 1.00 . A A . 10 LYS C 1 1 7 2858 1 1 10 LYS CA C -5.116 5.004 4.909 1.00 . A A . 10 LYS CA 1 1 7 2859 1 1 10 LYS CB C -6.640 5.137 5.038 1.00 . A A . 10 LYS CB 1 1 7 2860 1 1 10 LYS CD C -8.369 6.064 3.494 1.00 . A A . 10 LYS CD 1 1 7 2861 1 1 10 LYS CE C -9.343 7.247 3.523 1.00 . A A . 10 LYS CE 1 1 7 2862 1 1 10 LYS CG C -7.126 6.400 4.324 1.00 . A A . 10 LYS CG 1 1 7 2863 1 1 10 LYS H H -5.415 4.395 2.870 1.00 . A A . 10 LYS H 1 1 7 2864 1 1 10 LYS HA H -4.621 5.849 5.363 1.00 . A A . 10 LYS HA 1 1 7 2865 1 1 10 LYS HB2 H -7.113 4.270 4.595 1.00 . A A . 10 LYS HB2 1 1 7 2866 1 1 10 LYS HB3 H -6.911 5.193 6.084 1.00 . A A . 10 LYS HB3 1 1 7 2867 1 1 10 LYS HD2 H -8.074 5.863 2.474 1.00 . A A . 10 LYS HD2 1 1 7 2868 1 1 10 LYS HD3 H -8.851 5.190 3.907 1.00 . A A . 10 LYS HD3 1 1 7 2869 1 1 10 LYS HE2 H -8.843 8.128 3.905 1.00 . A A . 10 LYS HE2 1 1 7 2870 1 1 10 LYS HE3 H -9.732 7.437 2.535 1.00 . A A . 10 LYS HE3 1 1 7 2871 1 1 10 LYS HG2 H -7.373 7.148 5.060 1.00 . A A . 10 LYS HG2 1 1 7 2872 1 1 10 LYS HG3 H -6.350 6.774 3.673 1.00 . A A . 10 LYS HG3 1 1 7 2873 1 1 10 LYS HZ1 H -10.977 6.050 4.016 1.00 . A A . 10 LYS HZ1 1 1 7 2874 1 1 10 LYS HZ2 H -11.086 7.644 4.585 1.00 . A A . 10 LYS HZ2 1 1 7 2875 1 1 10 LYS HZ3 H -10.053 6.538 5.354 1.00 . A A . 10 LYS HZ3 1 1 7 2876 1 1 10 LYS N N -4.838 4.946 3.442 1.00 . A A . 10 LYS N 1 1 7 2877 1 1 10 LYS NZ N -10.447 6.837 4.438 1.00 . A A . 10 LYS NZ 1 1 7 2878 1 1 10 LYS O O -4.001 3.690 6.578 1.00 . A A . 10 LYS O 1 1 7 2879 1 1 11 ASN C C -3.728 0.467 4.438 1.00 . A A . 11 ASN C 1 1 7 2880 1 1 11 ASN CA C -4.534 1.256 5.485 1.00 . A A . 11 ASN CA 1 1 7 2881 1 1 11 ASN CB C -5.823 0.512 5.881 1.00 . A A . 11 ASN CB 1 1 7 2882 1 1 11 ASN CG C -6.839 0.535 4.731 1.00 . A A . 11 ASN CG 1 1 7 2883 1 1 11 ASN H H -5.489 2.610 4.090 1.00 . A A . 11 ASN H 1 1 7 2884 1 1 11 ASN HA H -3.926 1.414 6.364 1.00 . A A . 11 ASN HA 1 1 7 2885 1 1 11 ASN HB2 H -5.583 -0.512 6.130 1.00 . A A . 11 ASN HB2 1 1 7 2886 1 1 11 ASN HB3 H -6.258 0.994 6.746 1.00 . A A . 11 ASN HB3 1 1 7 2887 1 1 11 ASN HD21 H -6.331 -1.247 4.045 1.00 . A A . 11 ASN HD21 1 1 7 2888 1 1 11 ASN HD22 H -7.558 -0.457 3.183 1.00 . A A . 11 ASN HD22 1 1 7 2889 1 1 11 ASN N N -4.967 2.575 4.930 1.00 . A A . 11 ASN N 1 1 7 2890 1 1 11 ASN ND2 N -6.914 -0.473 3.920 1.00 . A A . 11 ASN ND2 1 1 7 2891 1 1 11 ASN O O -3.797 0.724 3.251 1.00 . A A . 11 ASN O 1 1 7 2892 1 1 11 ASN OD1 O -7.581 1.481 4.575 1.00 . A A . 11 ASN OD1 1 1 7 2893 1 1 12 LYS C C -2.952 -2.019 2.897 1.00 . A A . 12 LYS C 1 1 7 2894 1 1 12 LYS CA C -2.097 -1.290 3.947 1.00 . A A . 12 LYS CA 1 1 7 2895 1 1 12 LYS CB C -1.361 -2.293 4.851 1.00 . A A . 12 LYS CB 1 1 7 2896 1 1 12 LYS CD C 0.031 -4.377 4.827 1.00 . A A . 12 LYS CD 1 1 7 2897 1 1 12 LYS CE C 1.558 -4.568 4.800 1.00 . A A . 12 LYS CE 1 1 7 2898 1 1 12 LYS CG C -0.355 -3.115 4.036 1.00 . A A . 12 LYS CG 1 1 7 2899 1 1 12 LYS H H -2.898 -0.649 5.850 1.00 . A A . 12 LYS H 1 1 7 2900 1 1 12 LYS HA H -1.379 -0.651 3.453 1.00 . A A . 12 LYS HA 1 1 7 2901 1 1 12 LYS HB2 H -0.833 -1.757 5.630 1.00 . A A . 12 LYS HB2 1 1 7 2902 1 1 12 LYS HB3 H -2.082 -2.958 5.301 1.00 . A A . 12 LYS HB3 1 1 7 2903 1 1 12 LYS HD2 H -0.297 -4.267 5.854 1.00 . A A . 12 LYS HD2 1 1 7 2904 1 1 12 LYS HD3 H -0.449 -5.238 4.390 1.00 . A A . 12 LYS HD3 1 1 7 2905 1 1 12 LYS HE2 H 2.053 -3.617 4.948 1.00 . A A . 12 LYS HE2 1 1 7 2906 1 1 12 LYS HE3 H 1.860 -5.269 5.564 1.00 . A A . 12 LYS HE3 1 1 7 2907 1 1 12 LYS HG2 H -0.800 -3.399 3.094 1.00 . A A . 12 LYS HG2 1 1 7 2908 1 1 12 LYS HG3 H 0.529 -2.523 3.855 1.00 . A A . 12 LYS HG3 1 1 7 2909 1 1 12 LYS HZ1 H 1.677 -4.396 2.715 1.00 . A A . 12 LYS HZ1 1 1 7 2910 1 1 12 LYS HZ2 H 1.295 -5.964 3.263 1.00 . A A . 12 LYS HZ2 1 1 7 2911 1 1 12 LYS HZ3 H 2.884 -5.378 3.404 1.00 . A A . 12 LYS HZ3 1 1 7 2912 1 1 12 LYS N N -2.943 -0.479 4.886 1.00 . A A . 12 LYS N 1 1 7 2913 1 1 12 LYS NZ N 1.875 -5.120 3.444 1.00 . A A . 12 LYS NZ 1 1 7 2914 1 1 12 LYS O O -2.570 -2.107 1.747 1.00 . A A . 12 LYS O 1 1 7 2915 1 1 13 LYS C C -5.634 -2.301 1.283 1.00 . A A . 13 LYS C 1 1 7 2916 1 1 13 LYS CA C -4.949 -3.274 2.265 1.00 . A A . 13 LYS CA 1 1 7 2917 1 1 13 LYS CB C -6.016 -4.012 3.076 1.00 . A A . 13 LYS CB 1 1 7 2918 1 1 13 LYS CD C -6.591 -6.151 4.229 1.00 . A A . 13 LYS CD 1 1 7 2919 1 1 13 LYS CE C -6.186 -7.630 4.309 1.00 . A A . 13 LYS CE 1 1 7 2920 1 1 13 LYS CG C -5.448 -5.323 3.626 1.00 . A A . 13 LYS CG 1 1 7 2921 1 1 13 LYS H H -4.385 -2.476 4.203 1.00 . A A . 13 LYS H 1 1 7 2922 1 1 13 LYS HA H -4.353 -3.988 1.719 1.00 . A A . 13 LYS HA 1 1 7 2923 1 1 13 LYS HB2 H -6.345 -3.389 3.893 1.00 . A A . 13 LYS HB2 1 1 7 2924 1 1 13 LYS HB3 H -6.854 -4.233 2.431 1.00 . A A . 13 LYS HB3 1 1 7 2925 1 1 13 LYS HD2 H -6.808 -5.784 5.222 1.00 . A A . 13 LYS HD2 1 1 7 2926 1 1 13 LYS HD3 H -7.470 -6.053 3.609 1.00 . A A . 13 LYS HD3 1 1 7 2927 1 1 13 LYS HE2 H -5.530 -7.883 3.489 1.00 . A A . 13 LYS HE2 1 1 7 2928 1 1 13 LYS HE3 H -5.709 -7.839 5.254 1.00 . A A . 13 LYS HE3 1 1 7 2929 1 1 13 LYS HG2 H -4.977 -5.878 2.825 1.00 . A A . 13 LYS HG2 1 1 7 2930 1 1 13 LYS HG3 H -4.719 -5.106 4.393 1.00 . A A . 13 LYS HG3 1 1 7 2931 1 1 13 LYS HZ1 H -8.205 -7.932 4.775 1.00 . A A . 13 LYS HZ1 1 1 7 2932 1 1 13 LYS HZ2 H -7.320 -9.361 4.559 1.00 . A A . 13 LYS HZ2 1 1 7 2933 1 1 13 LYS HZ3 H -7.770 -8.434 3.213 1.00 . A A . 13 LYS HZ3 1 1 7 2934 1 1 13 LYS N N -4.095 -2.548 3.270 1.00 . A A . 13 LYS N 1 1 7 2935 1 1 13 LYS NZ N -7.466 -8.394 4.206 1.00 . A A . 13 LYS NZ 1 1 7 2936 1 1 13 LYS O O -6.335 -2.724 0.381 1.00 . A A . 13 LYS O 1 1 7 2937 1 1 14 GLU C C -5.491 -0.150 -0.898 1.00 . A A . 14 GLU C 1 1 7 2938 1 1 14 GLU CA C -6.100 -0.038 0.510 1.00 . A A . 14 GLU CA 1 1 7 2939 1 1 14 GLU CB C -5.813 1.333 1.121 1.00 . A A . 14 GLU CB 1 1 7 2940 1 1 14 GLU CD C -6.741 3.673 1.084 1.00 . A A . 14 GLU CD 1 1 7 2941 1 1 14 GLU CG C -6.467 2.414 0.261 1.00 . A A . 14 GLU CG 1 1 7 2942 1 1 14 GLU H H -4.894 -0.676 2.170 1.00 . A A . 14 GLU H 1 1 7 2943 1 1 14 GLU HA H -7.165 -0.207 0.471 1.00 . A A . 14 GLU HA 1 1 7 2944 1 1 14 GLU HB2 H -6.220 1.374 2.121 1.00 . A A . 14 GLU HB2 1 1 7 2945 1 1 14 GLU HB3 H -4.747 1.502 1.158 1.00 . A A . 14 GLU HB3 1 1 7 2946 1 1 14 GLU HG2 H -5.808 2.656 -0.552 1.00 . A A . 14 GLU HG2 1 1 7 2947 1 1 14 GLU HG3 H -7.397 2.038 -0.130 1.00 . A A . 14 GLU HG3 1 1 7 2948 1 1 14 GLU N N -5.450 -1.010 1.441 1.00 . A A . 14 GLU N 1 1 7 2949 1 1 14 GLU O O -6.174 0.034 -1.892 1.00 . A A . 14 GLU O 1 1 7 2950 1 1 14 GLU OE1 O -6.793 3.578 2.295 1.00 . A A . 14 GLU OE1 1 1 7 2951 1 1 14 GLU OE2 O -6.907 4.721 0.481 1.00 . A A . 14 GLU OE2 1 1 7 2952 1 1 15 CYS C C -3.813 -1.977 -2.897 1.00 . A A . 15 CYS C 1 1 7 2953 1 1 15 CYS CA C -3.602 -0.563 -2.354 1.00 . A A . 15 CYS CA 1 1 7 2954 1 1 15 CYS CB C -2.113 -0.279 -2.147 1.00 . A A . 15 CYS CB 1 1 7 2955 1 1 15 CYS H H -3.681 -0.599 -0.190 1.00 . A A . 15 CYS H 1 1 7 2956 1 1 15 CYS HA H -4.026 0.168 -3.019 1.00 . A A . 15 CYS HA 1 1 7 2957 1 1 15 CYS HB2 H -1.681 -1.055 -1.532 1.00 . A A . 15 CYS HB2 1 1 7 2958 1 1 15 CYS HB3 H -1.615 -0.258 -3.106 1.00 . A A . 15 CYS HB3 1 1 7 2959 1 1 15 CYS N N -4.222 -0.446 -1.000 1.00 . A A . 15 CYS N 1 1 7 2960 1 1 15 CYS O O -3.584 -2.948 -2.206 1.00 . A A . 15 CYS O 1 1 7 2961 1 1 15 CYS SG S -1.920 1.324 -1.329 1.00 . A A . 15 CYS SG 1 1 7 2962 1 1 16 CYS C C -3.150 -4.256 -4.636 1.00 . A A . 16 CYS C 1 1 7 2963 1 1 16 CYS CA C -4.455 -3.476 -4.708 1.00 . A A . 16 CYS CA 1 1 7 2964 1 1 16 CYS CB C -4.892 -3.260 -6.160 1.00 . A A . 16 CYS CB 1 1 7 2965 1 1 16 CYS H H -4.414 -1.304 -4.671 1.00 . A A . 16 CYS H 1 1 7 2966 1 1 16 CYS HA H -5.226 -3.998 -4.165 1.00 . A A . 16 CYS HA 1 1 7 2967 1 1 16 CYS HB2 H -4.662 -2.250 -6.462 1.00 . A A . 16 CYS HB2 1 1 7 2968 1 1 16 CYS HB3 H -4.367 -3.954 -6.804 1.00 . A A . 16 CYS HB3 1 1 7 2969 1 1 16 CYS N N -4.244 -2.104 -4.129 1.00 . A A . 16 CYS N 1 1 7 2970 1 1 16 CYS O O -3.109 -5.350 -4.103 1.00 . A A . 16 CYS O 1 1 7 2971 1 1 16 CYS SG S -6.676 -3.545 -6.295 1.00 . A A . 16 CYS SG 1 1 7 2972 1 1 17 GLY C C -0.389 -4.390 -3.540 1.00 . A A . 17 GLY C 1 1 7 2973 1 1 17 GLY CA C -0.764 -4.381 -5.018 1.00 . A A . 17 GLY CA 1 1 7 2974 1 1 17 GLY H H -2.122 -2.791 -5.508 1.00 . A A . 17 GLY H 1 1 7 2975 1 1 17 GLY HA2 H -0.849 -5.393 -5.389 1.00 . A A . 17 GLY HA2 1 1 7 2976 1 1 17 GLY HA3 H -0.018 -3.837 -5.573 1.00 . A A . 17 GLY HA3 1 1 7 2977 1 1 17 GLY N N -2.075 -3.688 -5.118 1.00 . A A . 17 GLY N 1 1 7 2978 1 1 17 GLY O O -0.042 -3.363 -2.984 1.00 . A A . 17 GLY O 1 1 7 2979 1 1 18 TRP C C 1.134 -4.973 -1.081 1.00 . A A . 18 TRP C 1 1 7 2980 1 1 18 TRP CA C -0.223 -5.603 -1.419 1.00 . A A . 18 TRP CA 1 1 7 2981 1 1 18 TRP CB C -0.248 -7.098 -1.084 1.00 . A A . 18 TRP CB 1 1 7 2982 1 1 18 TRP CD1 C -2.704 -6.984 -0.479 1.00 . A A . 18 TRP CD1 1 1 7 2983 1 1 18 TRP CD2 C -2.212 -8.754 -1.774 1.00 . A A . 18 TRP CD2 1 1 7 2984 1 1 18 TRP CE2 C -3.603 -8.809 -1.518 1.00 . A A . 18 TRP CE2 1 1 7 2985 1 1 18 TRP CE3 C -1.646 -9.760 -2.566 1.00 . A A . 18 TRP CE3 1 1 7 2986 1 1 18 TRP CG C -1.662 -7.585 -1.107 1.00 . A A . 18 TRP CG 1 1 7 2987 1 1 18 TRP CH2 C -3.815 -10.821 -2.826 1.00 . A A . 18 TRP CH2 1 1 7 2988 1 1 18 TRP CZ2 C -4.399 -9.829 -2.036 1.00 . A A . 18 TRP CZ2 1 1 7 2989 1 1 18 TRP CZ3 C -2.444 -10.784 -3.092 1.00 . A A . 18 TRP CZ3 1 1 7 2990 1 1 18 TRP H H -0.848 -6.313 -3.357 1.00 . A A . 18 TRP H 1 1 7 2991 1 1 18 TRP HA H -1.000 -5.101 -0.867 1.00 . A A . 18 TRP HA 1 1 7 2992 1 1 18 TRP HB2 H 0.332 -7.643 -1.814 1.00 . A A . 18 TRP HB2 1 1 7 2993 1 1 18 TRP HB3 H 0.172 -7.255 -0.100 1.00 . A A . 18 TRP HB3 1 1 7 2994 1 1 18 TRP HD1 H -2.645 -6.083 0.116 1.00 . A A . 18 TRP HD1 1 1 7 2995 1 1 18 TRP HE1 H -4.749 -7.487 -0.386 1.00 . A A . 18 TRP HE1 1 1 7 2996 1 1 18 TRP HE3 H -0.592 -9.738 -2.781 1.00 . A A . 18 TRP HE3 1 1 7 2997 1 1 18 TRP HH2 H -4.420 -11.616 -3.232 1.00 . A A . 18 TRP HH2 1 1 7 2998 1 1 18 TRP HZ2 H -5.459 -9.853 -1.829 1.00 . A A . 18 TRP HZ2 1 1 7 2999 1 1 18 TRP HZ3 H -1.997 -11.554 -3.703 1.00 . A A . 18 TRP HZ3 1 1 7 3000 1 1 18 TRP N N -0.515 -5.521 -2.888 1.00 . A A . 18 TRP N 1 1 7 3001 1 1 18 TRP NE1 N -3.853 -7.712 -0.724 1.00 . A A . 18 TRP NE1 1 1 7 3002 1 1 18 TRP O O 2.173 -5.612 -1.107 1.00 . A A . 18 TRP O 1 1 7 3003 1 1 19 ASN C C 2.215 -2.509 1.060 1.00 . A A . 19 ASN C 1 1 7 3004 1 1 19 ASN CA C 2.340 -2.962 -0.392 1.00 . A A . 19 ASN CA 1 1 7 3005 1 1 19 ASN CB C 2.354 -1.766 -1.359 1.00 . A A . 19 ASN CB 1 1 7 3006 1 1 19 ASN CG C 3.732 -1.637 -1.999 1.00 . A A . 19 ASN CG 1 1 7 3007 1 1 19 ASN H H 0.243 -3.243 -0.744 1.00 . A A . 19 ASN H 1 1 7 3008 1 1 19 ASN HA H 3.225 -3.564 -0.527 1.00 . A A . 19 ASN HA 1 1 7 3009 1 1 19 ASN HB2 H 1.619 -1.923 -2.131 1.00 . A A . 19 ASN HB2 1 1 7 3010 1 1 19 ASN HB3 H 2.118 -0.865 -0.814 1.00 . A A . 19 ASN HB3 1 1 7 3011 1 1 19 ASN HD21 H 3.765 0.335 -1.889 1.00 . A A . 19 ASN HD21 1 1 7 3012 1 1 19 ASN HD22 H 5.133 -0.374 -2.586 1.00 . A A . 19 ASN HD22 1 1 7 3013 1 1 19 ASN N N 1.105 -3.708 -0.754 1.00 . A A . 19 ASN N 1 1 7 3014 1 1 19 ASN ND2 N 4.249 -0.462 -2.171 1.00 . A A . 19 ASN ND2 1 1 7 3015 1 1 19 ASN O O 1.586 -3.172 1.869 1.00 . A A . 19 ASN O 1 1 7 3016 1 1 19 ASN OD1 O 4.347 -2.622 -2.353 1.00 . A A . 19 ASN OD1 1 1 7 3017 1 1 20 ALA C C 2.395 0.575 2.871 1.00 . A A . 20 ALA C 1 1 7 3018 1 1 20 ALA CA C 2.682 -0.925 2.821 1.00 . A A . 20 ALA CA 1 1 7 3019 1 1 20 ALA CB C 4.042 -1.216 3.453 1.00 . A A . 20 ALA CB 1 1 7 3020 1 1 20 ALA H H 3.297 -0.869 0.758 1.00 . A A . 20 ALA H 1 1 7 3021 1 1 20 ALA HA H 1.914 -1.473 3.340 1.00 . A A . 20 ALA HA 1 1 7 3022 1 1 20 ALA HB1 H 4.199 -2.284 3.506 1.00 . A A . 20 ALA HB1 1 1 7 3023 1 1 20 ALA HB2 H 4.073 -0.799 4.449 1.00 . A A . 20 ALA HB2 1 1 7 3024 1 1 20 ALA HB3 H 4.823 -0.768 2.852 1.00 . A A . 20 ALA HB3 1 1 7 3025 1 1 20 ALA N N 2.794 -1.397 1.415 1.00 . A A . 20 ALA N 1 1 7 3026 1 1 20 ALA O O 3.160 1.374 2.356 1.00 . A A . 20 ALA O 1 1 7 3027 1 1 21 CYS C C 1.928 2.979 4.732 1.00 . A A . 21 CYS C 1 1 7 3028 1 1 21 CYS CA C 1.016 2.423 3.631 1.00 . A A . 21 CYS CA 1 1 7 3029 1 1 21 CYS CB C -0.465 2.500 4.022 1.00 . A A . 21 CYS CB 1 1 7 3030 1 1 21 CYS H H 0.741 0.303 3.940 1.00 . A A . 21 CYS H 1 1 7 3031 1 1 21 CYS HA H 1.189 2.928 2.698 1.00 . A A . 21 CYS HA 1 1 7 3032 1 1 21 CYS HB2 H -1.007 1.708 3.530 1.00 . A A . 21 CYS HB2 1 1 7 3033 1 1 21 CYS HB3 H -0.558 2.385 5.093 1.00 . A A . 21 CYS HB3 1 1 7 3034 1 1 21 CYS N N 1.324 0.966 3.511 1.00 . A A . 21 CYS N 1 1 7 3035 1 1 21 CYS O O 1.631 2.883 5.910 1.00 . A A . 21 CYS O 1 1 7 3036 1 1 21 CYS SG S -1.157 4.102 3.524 1.00 . A A . 21 CYS SG 1 1 7 3037 1 1 22 ALA C C 4.242 5.500 5.313 1.00 . A A . 22 ALA C 1 1 7 3038 1 1 22 ALA CA C 4.059 3.979 5.367 1.00 . A A . 22 ALA CA 1 1 7 3039 1 1 22 ALA CB C 5.366 3.276 4.980 1.00 . A A . 22 ALA CB 1 1 7 3040 1 1 22 ALA H H 3.306 3.502 3.396 1.00 . A A . 22 ALA H 1 1 7 3041 1 1 22 ALA HA H 3.764 3.675 6.354 1.00 . A A . 22 ALA HA 1 1 7 3042 1 1 22 ALA HB1 H 6.196 3.761 5.470 1.00 . A A . 22 ALA HB1 1 1 7 3043 1 1 22 ALA HB2 H 5.501 3.327 3.900 1.00 . A A . 22 ALA HB2 1 1 7 3044 1 1 22 ALA HB3 H 5.325 2.244 5.287 1.00 . A A . 22 ALA HB3 1 1 7 3045 1 1 22 ALA N N 3.073 3.487 4.352 1.00 . A A . 22 ALA N 1 1 7 3046 1 1 22 ALA O O 3.810 6.219 6.192 1.00 . A A . 22 ALA O 1 1 7 3047 1 1 23 LEU C C 3.888 8.152 3.619 1.00 . A A . 23 LEU C 1 1 7 3048 1 1 23 LEU CA C 5.137 7.466 4.186 1.00 . A A . 23 LEU CA 1 1 7 3049 1 1 23 LEU CB C 6.348 7.650 3.236 1.00 . A A . 23 LEU CB 1 1 7 3050 1 1 23 LEU CD1 C 7.047 5.666 1.870 1.00 . A A . 23 LEU CD1 1 1 7 3051 1 1 23 LEU CD2 C 8.710 6.770 3.339 1.00 . A A . 23 LEU CD2 1 1 7 3052 1 1 23 LEU CG C 7.239 6.388 3.202 1.00 . A A . 23 LEU CG 1 1 7 3053 1 1 23 LEU H H 5.229 5.384 3.604 1.00 . A A . 23 LEU H 1 1 7 3054 1 1 23 LEU HA H 5.372 7.870 5.159 1.00 . A A . 23 LEU HA 1 1 7 3055 1 1 23 LEU HB2 H 5.987 7.857 2.239 1.00 . A A . 23 LEU HB2 1 1 7 3056 1 1 23 LEU HB3 H 6.937 8.490 3.577 1.00 . A A . 23 LEU HB3 1 1 7 3057 1 1 23 LEU HD11 H 6.199 5.003 1.935 1.00 . A A . 23 LEU HD11 1 1 7 3058 1 1 23 LEU HD12 H 7.935 5.095 1.641 1.00 . A A . 23 LEU HD12 1 1 7 3059 1 1 23 LEU HD13 H 6.878 6.393 1.087 1.00 . A A . 23 LEU HD13 1 1 7 3060 1 1 23 LEU HD21 H 8.921 7.032 4.364 1.00 . A A . 23 LEU HD21 1 1 7 3061 1 1 23 LEU HD22 H 8.928 7.609 2.695 1.00 . A A . 23 LEU HD22 1 1 7 3062 1 1 23 LEU HD23 H 9.324 5.923 3.051 1.00 . A A . 23 LEU HD23 1 1 7 3063 1 1 23 LEU HG H 6.966 5.729 4.013 1.00 . A A . 23 LEU HG 1 1 7 3064 1 1 23 LEU N N 4.893 5.990 4.294 1.00 . A A . 23 LEU N 1 1 7 3065 1 1 23 LEU O O 3.953 8.873 2.644 1.00 . A A . 23 LEU O 1 1 7 3066 1 1 24 GLY C C 1.043 7.856 2.402 1.00 . A A . 24 GLY C 1 1 7 3067 1 1 24 GLY CA C 1.480 8.541 3.712 1.00 . A A . 24 GLY CA 1 1 7 3068 1 1 24 GLY H H 2.716 7.327 5.004 1.00 . A A . 24 GLY H 1 1 7 3069 1 1 24 GLY HA2 H 0.701 8.432 4.455 1.00 . A A . 24 GLY HA2 1 1 7 3070 1 1 24 GLY HA3 H 1.652 9.587 3.524 1.00 . A A . 24 GLY HA3 1 1 7 3071 1 1 24 GLY N N 2.746 7.919 4.220 1.00 . A A . 24 GLY N 1 1 7 3072 1 1 24 GLY O O 0.104 8.283 1.756 1.00 . A A . 24 GLY O 1 1 7 3073 1 1 25 ILE C C 1.854 4.632 0.815 1.00 . A A . 25 ILE C 1 1 7 3074 1 1 25 ILE CA C 1.374 6.083 0.736 1.00 . A A . 25 ILE CA 1 1 7 3075 1 1 25 ILE CB C 2.127 6.789 -0.408 1.00 . A A . 25 ILE CB 1 1 7 3076 1 1 25 ILE CD1 C 3.717 8.616 -1.035 1.00 . A A . 25 ILE CD1 1 1 7 3077 1 1 25 ILE CG1 C 3.127 7.820 0.125 1.00 . A A . 25 ILE CG1 1 1 7 3078 1 1 25 ILE CG2 C 1.129 7.501 -1.302 1.00 . A A . 25 ILE CG2 1 1 7 3079 1 1 25 ILE H H 2.478 6.480 2.536 1.00 . A A . 25 ILE H 1 1 7 3080 1 1 25 ILE HA H 0.316 6.126 0.557 1.00 . A A . 25 ILE HA 1 1 7 3081 1 1 25 ILE HB H 2.650 6.047 -0.988 1.00 . A A . 25 ILE HB 1 1 7 3082 1 1 25 ILE HD11 H 4.774 8.760 -0.874 1.00 . A A . 25 ILE HD11 1 1 7 3083 1 1 25 ILE HD12 H 3.226 9.575 -1.095 1.00 . A A . 25 ILE HD12 1 1 7 3084 1 1 25 ILE HD13 H 3.562 8.075 -1.957 1.00 . A A . 25 ILE HD13 1 1 7 3085 1 1 25 ILE HG12 H 2.617 8.494 0.794 1.00 . A A . 25 ILE HG12 1 1 7 3086 1 1 25 ILE HG13 H 3.920 7.315 0.655 1.00 . A A . 25 ILE HG13 1 1 7 3087 1 1 25 ILE HG21 H 0.385 6.800 -1.639 1.00 . A A . 25 ILE HG21 1 1 7 3088 1 1 25 ILE HG22 H 1.649 7.916 -2.153 1.00 . A A . 25 ILE HG22 1 1 7 3089 1 1 25 ILE HG23 H 0.657 8.298 -0.745 1.00 . A A . 25 ILE HG23 1 1 7 3090 1 1 25 ILE N N 1.726 6.802 2.002 1.00 . A A . 25 ILE N 1 1 7 3091 1 1 25 ILE O O 2.521 4.234 1.752 1.00 . A A . 25 ILE O 1 1 7 3092 1 1 26 CYS C C 3.436 2.419 -0.798 1.00 . A A . 26 CYS C 1 1 7 3093 1 1 26 CYS CA C 2.038 2.441 -0.201 1.00 . A A . 26 CYS CA 1 1 7 3094 1 1 26 CYS CB C 1.068 1.687 -1.106 1.00 . A A . 26 CYS CB 1 1 7 3095 1 1 26 CYS H H 1.056 4.208 -0.957 1.00 . A A . 26 CYS H 1 1 7 3096 1 1 26 CYS HA H 2.035 2.028 0.790 1.00 . A A . 26 CYS HA 1 1 7 3097 1 1 26 CYS HB2 H 0.706 2.349 -1.878 1.00 . A A . 26 CYS HB2 1 1 7 3098 1 1 26 CYS HB3 H 1.582 0.853 -1.562 1.00 . A A . 26 CYS HB3 1 1 7 3099 1 1 26 CYS N N 1.560 3.853 -0.188 1.00 . A A . 26 CYS N 1 1 7 3100 1 1 26 CYS O O 3.617 2.792 -1.934 1.00 . A A . 26 CYS O 1 1 7 3101 1 1 26 CYS SG S -0.321 1.073 -0.125 1.00 . A A . 26 CYS SG 1 1 7 3102 1 1 27 MET C C 6.690 0.896 -0.015 1.00 . A A . 27 MET C 1 1 7 3103 1 1 27 MET CA C 5.813 2.011 -0.627 1.00 . A A . 27 MET CA 1 1 7 3104 1 1 27 MET CB C 6.358 3.414 -0.314 1.00 . A A . 27 MET CB 1 1 7 3105 1 1 27 MET CE C 8.638 4.922 -2.334 1.00 . A A . 27 MET CE 1 1 7 3106 1 1 27 MET CG C 6.107 4.340 -1.511 1.00 . A A . 27 MET CG 1 1 7 3107 1 1 27 MET H H 4.268 1.720 0.868 1.00 . A A . 27 MET H 1 1 7 3108 1 1 27 MET HA H 5.768 1.884 -1.693 1.00 . A A . 27 MET HA 1 1 7 3109 1 1 27 MET HB2 H 5.853 3.811 0.556 1.00 . A A . 27 MET HB2 1 1 7 3110 1 1 27 MET HB3 H 7.418 3.356 -0.116 1.00 . A A . 27 MET HB3 1 1 7 3111 1 1 27 MET HE1 H 8.680 5.818 -2.940 1.00 . A A . 27 MET HE1 1 1 7 3112 1 1 27 MET HE2 H 9.553 4.366 -2.456 1.00 . A A . 27 MET HE2 1 1 7 3113 1 1 27 MET HE3 H 8.519 5.191 -1.294 1.00 . A A . 27 MET HE3 1 1 7 3114 1 1 27 MET HG2 H 5.091 4.220 -1.846 1.00 . A A . 27 MET HG2 1 1 7 3115 1 1 27 MET HG3 H 6.268 5.368 -1.221 1.00 . A A . 27 MET HG3 1 1 7 3116 1 1 27 MET N N 4.429 2.012 -0.056 1.00 . A A . 27 MET N 1 1 7 3117 1 1 27 MET O O 6.941 -0.092 -0.669 1.00 . A A . 27 MET O 1 1 7 3118 1 1 27 MET SD S 7.237 3.905 -2.860 1.00 . A A . 27 MET SD 1 1 7 3119 1 1 28 PRO C C 7.182 -1.153 2.271 1.00 . A A . 28 PRO C 1 1 7 3120 1 1 28 PRO CA C 8.005 0.081 1.875 1.00 . A A . 28 PRO CA 1 1 7 3121 1 1 28 PRO CB C 8.532 0.822 3.106 1.00 . A A . 28 PRO CB 1 1 7 3122 1 1 28 PRO CD C 6.881 2.245 2.075 1.00 . A A . 28 PRO CD 1 1 7 3123 1 1 28 PRO CG C 7.504 1.864 3.394 1.00 . A A . 28 PRO CG 1 1 7 3124 1 1 28 PRO HA H 8.828 -0.196 1.232 1.00 . A A . 28 PRO HA 1 1 7 3125 1 1 28 PRO HB2 H 8.630 0.145 3.944 1.00 . A A . 28 PRO HB2 1 1 7 3126 1 1 28 PRO HB3 H 9.477 1.296 2.888 1.00 . A A . 28 PRO HB3 1 1 7 3127 1 1 28 PRO HD2 H 5.819 2.407 2.189 1.00 . A A . 28 PRO HD2 1 1 7 3128 1 1 28 PRO HD3 H 7.359 3.125 1.670 1.00 . A A . 28 PRO HD3 1 1 7 3129 1 1 28 PRO HG2 H 6.751 1.459 4.059 1.00 . A A . 28 PRO HG2 1 1 7 3130 1 1 28 PRO HG3 H 7.967 2.726 3.843 1.00 . A A . 28 PRO HG3 1 1 7 3131 1 1 28 PRO N N 7.140 1.092 1.206 1.00 . A A . 28 PRO N 1 1 7 3132 1 1 28 PRO O O 6.847 -1.342 3.426 1.00 . A A . 28 PRO O 1 1 7 3133 1 1 29 ARG C C 6.723 -4.128 2.587 1.00 . A A . 29 ARG C 1 1 7 3134 1 1 29 ARG CA C 6.028 -3.201 1.579 1.00 . A A . 29 ARG CA 1 1 7 3135 1 1 29 ARG CB C 5.875 -3.909 0.227 1.00 . A A . 29 ARG CB 1 1 7 3136 1 1 29 ARG CD C 7.714 -5.629 0.147 1.00 . A A . 29 ARG CD 1 1 7 3137 1 1 29 ARG CG C 7.255 -4.256 -0.362 1.00 . A A . 29 ARG CG 1 1 7 3138 1 1 29 ARG CZ C 7.336 -6.970 -1.851 1.00 . A A . 29 ARG CZ 1 1 7 3139 1 1 29 ARG H H 7.124 -1.772 0.391 1.00 . A A . 29 ARG H 1 1 7 3140 1 1 29 ARG HA H 5.053 -2.917 1.947 1.00 . A A . 29 ARG HA 1 1 7 3141 1 1 29 ARG HB2 H 5.306 -4.816 0.363 1.00 . A A . 29 ARG HB2 1 1 7 3142 1 1 29 ARG HB3 H 5.348 -3.258 -0.456 1.00 . A A . 29 ARG HB3 1 1 7 3143 1 1 29 ARG HD2 H 8.537 -5.509 0.841 1.00 . A A . 29 ARG HD2 1 1 7 3144 1 1 29 ARG HD3 H 6.900 -6.158 0.615 1.00 . A A . 29 ARG HD3 1 1 7 3145 1 1 29 ARG HE H 9.141 -6.389 -1.264 1.00 . A A . 29 ARG HE 1 1 7 3146 1 1 29 ARG HG2 H 7.192 -4.271 -1.446 1.00 . A A . 29 ARG HG2 1 1 7 3147 1 1 29 ARG HG3 H 7.978 -3.506 -0.065 1.00 . A A . 29 ARG HG3 1 1 7 3148 1 1 29 ARG HH11 H 5.704 -6.433 -0.808 1.00 . A A . 29 ARG HH11 1 1 7 3149 1 1 29 ARG HH12 H 5.401 -7.390 -2.214 1.00 . A A . 29 ARG HH12 1 1 7 3150 1 1 29 ARG HH21 H 8.781 -7.691 -3.041 1.00 . A A . 29 ARG HH21 1 1 7 3151 1 1 29 ARG HH22 H 7.162 -8.082 -3.493 1.00 . A A . 29 ARG HH22 1 1 7 3152 1 1 29 ARG N N 6.845 -1.974 1.305 1.00 . A A . 29 ARG N 1 1 7 3153 1 1 29 ARG NE N 8.177 -6.357 -1.065 1.00 . A A . 29 ARG NE 1 1 7 3154 1 1 29 ARG NH1 N 6.047 -6.929 -1.604 1.00 . A A . 29 ARG NH1 1 1 7 3155 1 1 29 ARG NH2 N 7.792 -7.638 -2.871 1.00 . A A . 29 ARG NH2 1 1 7 3156 1 1 29 ARG O O 6.019 -4.903 3.215 1.00 . A A . 29 ARG O 1 1 7 3157 1 1 29 ARG OXT O 7.938 -4.066 2.707 1.00 . A A . 29 ARG OXT 1 1 8 3158 1 1 1 GLY C C -10.098 -0.446 -4.556 1.00 . A A . 1 GLY C 1 1 8 3159 1 1 1 GLY CA C -11.487 -0.295 -5.176 1.00 . A A . 1 GLY CA 1 1 8 3160 1 1 1 GLY H1 H -12.123 -1.762 -3.845 1.00 . A A . 1 GLY H1 1 1 8 3161 1 1 1 GLY H2 H -12.057 -2.278 -5.461 1.00 . A A . 1 GLY H2 1 1 8 3162 1 1 1 GLY H3 H -13.314 -1.264 -4.943 1.00 . A A . 1 GLY H3 1 1 8 3163 1 1 1 GLY HA2 H -11.401 -0.214 -6.251 1.00 . A A . 1 GLY HA2 1 1 8 3164 1 1 1 GLY HA3 H -11.959 0.591 -4.783 1.00 . A A . 1 GLY HA3 1 1 8 3165 1 1 1 GLY N N -12.307 -1.490 -4.830 1.00 . A A . 1 GLY N 1 1 8 3166 1 1 1 GLY O O -9.923 -1.148 -3.581 1.00 . A A . 1 GLY O 1 1 8 3167 1 1 2 CYS C C -6.792 1.097 -5.253 1.00 . A A . 2 CYS C 1 1 8 3168 1 1 2 CYS CA C -7.725 0.106 -4.546 1.00 . A A . 2 CYS CA 1 1 8 3169 1 1 2 CYS CB C -7.271 -1.338 -4.801 1.00 . A A . 2 CYS CB 1 1 8 3170 1 1 2 CYS H H -9.274 0.766 -5.897 1.00 . A A . 2 CYS H 1 1 8 3171 1 1 2 CYS HA H -7.743 0.301 -3.486 1.00 . A A . 2 CYS HA 1 1 8 3172 1 1 2 CYS HB2 H -6.454 -1.574 -4.140 1.00 . A A . 2 CYS HB2 1 1 8 3173 1 1 2 CYS HB3 H -8.094 -2.014 -4.612 1.00 . A A . 2 CYS HB3 1 1 8 3174 1 1 2 CYS N N -9.110 0.206 -5.110 1.00 . A A . 2 CYS N 1 1 8 3175 1 1 2 CYS O O -7.070 1.542 -6.348 1.00 . A A . 2 CYS O 1 1 8 3176 1 1 2 CYS SG S -6.726 -1.523 -6.522 1.00 . A A . 2 CYS SG 1 1 8 3177 1 1 3 LYS C C -3.382 1.703 -5.517 1.00 . A A . 3 LYS C 1 1 8 3178 1 1 3 LYS CA C -4.734 2.388 -5.300 1.00 . A A . 3 LYS CA 1 1 8 3179 1 1 3 LYS CB C -4.587 3.582 -4.343 1.00 . A A . 3 LYS CB 1 1 8 3180 1 1 3 LYS CD C -5.840 5.228 -2.914 1.00 . A A . 3 LYS CD 1 1 8 3181 1 1 3 LYS CE C -6.428 4.703 -1.599 1.00 . A A . 3 LYS CE 1 1 8 3182 1 1 3 LYS CG C -5.971 4.147 -3.997 1.00 . A A . 3 LYS CG 1 1 8 3183 1 1 3 LYS H H -5.477 1.062 -3.764 1.00 . A A . 3 LYS H 1 1 8 3184 1 1 3 LYS HA H -5.136 2.723 -6.246 1.00 . A A . 3 LYS HA 1 1 8 3185 1 1 3 LYS HB2 H -4.078 3.267 -3.443 1.00 . A A . 3 LYS HB2 1 1 8 3186 1 1 3 LYS HB3 H -4.003 4.348 -4.828 1.00 . A A . 3 LYS HB3 1 1 8 3187 1 1 3 LYS HD2 H -4.798 5.478 -2.776 1.00 . A A . 3 LYS HD2 1 1 8 3188 1 1 3 LYS HD3 H -6.384 6.111 -3.222 1.00 . A A . 3 LYS HD3 1 1 8 3189 1 1 3 LYS HE2 H -7.357 4.184 -1.787 1.00 . A A . 3 LYS HE2 1 1 8 3190 1 1 3 LYS HE3 H -5.724 4.051 -1.106 1.00 . A A . 3 LYS HE3 1 1 8 3191 1 1 3 LYS HG2 H -6.417 4.577 -4.885 1.00 . A A . 3 LYS HG2 1 1 8 3192 1 1 3 LYS HG3 H -6.601 3.351 -3.634 1.00 . A A . 3 LYS HG3 1 1 8 3193 1 1 3 LYS HZ1 H -5.821 6.516 -0.752 1.00 . A A . 3 LYS HZ1 1 1 8 3194 1 1 3 LYS HZ2 H -6.892 5.609 0.219 1.00 . A A . 3 LYS HZ2 1 1 8 3195 1 1 3 LYS HZ3 H -7.474 6.449 -1.145 1.00 . A A . 3 LYS HZ3 1 1 8 3196 1 1 3 LYS N N -5.686 1.436 -4.644 1.00 . A A . 3 LYS N 1 1 8 3197 1 1 3 LYS NZ N -6.672 5.910 -0.762 1.00 . A A . 3 LYS NZ 1 1 8 3198 1 1 3 LYS O O -3.185 0.565 -5.130 1.00 . A A . 3 LYS O 1 1 8 3199 1 1 4 LEU C C -0.172 2.066 -5.205 1.00 . A A . 4 LEU C 1 1 8 3200 1 1 4 LEU CA C -1.111 1.792 -6.396 1.00 . A A . 4 LEU CA 1 1 8 3201 1 1 4 LEU CB C -0.617 2.475 -7.688 1.00 . A A . 4 LEU CB 1 1 8 3202 1 1 4 LEU CD1 C -1.498 0.438 -8.875 1.00 . A A . 4 LEU CD1 1 1 8 3203 1 1 4 LEU CD2 C -2.802 2.559 -8.928 1.00 . A A . 4 LEU CD2 1 1 8 3204 1 1 4 LEU CG C -1.396 1.961 -8.914 1.00 . A A . 4 LEU CG 1 1 8 3205 1 1 4 LEU H H -2.649 3.293 -6.438 1.00 . A A . 4 LEU H 1 1 8 3206 1 1 4 LEU HA H -1.201 0.730 -6.555 1.00 . A A . 4 LEU HA 1 1 8 3207 1 1 4 LEU HB2 H -0.756 3.537 -7.600 1.00 . A A . 4 LEU HB2 1 1 8 3208 1 1 4 LEU HB3 H 0.434 2.268 -7.829 1.00 . A A . 4 LEU HB3 1 1 8 3209 1 1 4 LEU HD11 H -2.277 0.151 -8.187 1.00 . A A . 4 LEU HD11 1 1 8 3210 1 1 4 LEU HD12 H -0.555 0.022 -8.552 1.00 . A A . 4 LEU HD12 1 1 8 3211 1 1 4 LEU HD13 H -1.735 0.071 -9.862 1.00 . A A . 4 LEU HD13 1 1 8 3212 1 1 4 LEU HD21 H -3.093 2.769 -9.945 1.00 . A A . 4 LEU HD21 1 1 8 3213 1 1 4 LEU HD22 H -2.808 3.472 -8.354 1.00 . A A . 4 LEU HD22 1 1 8 3214 1 1 4 LEU HD23 H -3.492 1.855 -8.494 1.00 . A A . 4 LEU HD23 1 1 8 3215 1 1 4 LEU HG H -0.873 2.257 -9.816 1.00 . A A . 4 LEU HG 1 1 8 3216 1 1 4 LEU N N -2.457 2.386 -6.137 1.00 . A A . 4 LEU N 1 1 8 3217 1 1 4 LEU O O -0.550 1.899 -4.061 1.00 . A A . 4 LEU O 1 1 8 3218 1 1 5 THR C C 1.872 4.146 -3.815 1.00 . A A . 5 THR C 1 1 8 3219 1 1 5 THR CA C 2.007 2.711 -4.345 1.00 . A A . 5 THR CA 1 1 8 3220 1 1 5 THR CB C 3.406 2.484 -4.951 1.00 . A A . 5 THR CB 1 1 8 3221 1 1 5 THR CG2 C 4.152 1.425 -4.138 1.00 . A A . 5 THR CG2 1 1 8 3222 1 1 5 THR H H 1.351 2.570 -6.377 1.00 . A A . 5 THR H 1 1 8 3223 1 1 5 THR HA H 1.836 2.003 -3.550 1.00 . A A . 5 THR HA 1 1 8 3224 1 1 5 THR HB H 3.962 3.408 -4.918 1.00 . A A . 5 THR HB 1 1 8 3225 1 1 5 THR HG1 H 4.042 2.396 -6.796 1.00 . A A . 5 THR HG1 1 1 8 3226 1 1 5 THR HG21 H 3.668 1.296 -3.180 1.00 . A A . 5 THR HG21 1 1 8 3227 1 1 5 THR HG22 H 5.174 1.740 -3.981 1.00 . A A . 5 THR HG22 1 1 8 3228 1 1 5 THR HG23 H 4.144 0.489 -4.676 1.00 . A A . 5 THR HG23 1 1 8 3229 1 1 5 THR N N 1.050 2.459 -5.457 1.00 . A A . 5 THR N 1 1 8 3230 1 1 5 THR O O 1.351 4.371 -2.735 1.00 . A A . 5 THR O 1 1 8 3231 1 1 5 THR OG1 O 3.293 2.044 -6.303 1.00 . A A . 5 THR OG1 1 1 8 3232 1 1 6 PHE C C 0.851 7.102 -4.125 1.00 . A A . 6 PHE C 1 1 8 3233 1 1 6 PHE CA C 2.278 6.538 -4.080 1.00 . A A . 6 PHE CA 1 1 8 3234 1 1 6 PHE CB C 3.205 7.322 -5.021 1.00 . A A . 6 PHE CB 1 1 8 3235 1 1 6 PHE CD1 C 5.195 6.988 -3.505 1.00 . A A . 6 PHE CD1 1 1 8 3236 1 1 6 PHE CD2 C 4.654 9.235 -4.239 1.00 . A A . 6 PHE CD2 1 1 8 3237 1 1 6 PHE CE1 C 6.278 7.488 -2.774 1.00 . A A . 6 PHE CE1 1 1 8 3238 1 1 6 PHE CE2 C 5.739 9.733 -3.510 1.00 . A A . 6 PHE CE2 1 1 8 3239 1 1 6 PHE CG C 4.379 7.862 -4.237 1.00 . A A . 6 PHE CG 1 1 8 3240 1 1 6 PHE CZ C 6.553 8.859 -2.779 1.00 . A A . 6 PHE CZ 1 1 8 3241 1 1 6 PHE H H 2.759 4.908 -5.402 1.00 . A A . 6 PHE H 1 1 8 3242 1 1 6 PHE HA H 2.661 6.602 -3.073 1.00 . A A . 6 PHE HA 1 1 8 3243 1 1 6 PHE HB2 H 3.561 6.674 -5.806 1.00 . A A . 6 PHE HB2 1 1 8 3244 1 1 6 PHE HB3 H 2.659 8.147 -5.457 1.00 . A A . 6 PHE HB3 1 1 8 3245 1 1 6 PHE HD1 H 4.987 5.929 -3.502 1.00 . A A . 6 PHE HD1 1 1 8 3246 1 1 6 PHE HD2 H 4.027 9.912 -4.802 1.00 . A A . 6 PHE HD2 1 1 8 3247 1 1 6 PHE HE1 H 6.906 6.813 -2.211 1.00 . A A . 6 PHE HE1 1 1 8 3248 1 1 6 PHE HE2 H 5.951 10.790 -3.513 1.00 . A A . 6 PHE HE2 1 1 8 3249 1 1 6 PHE HZ H 7.388 9.245 -2.217 1.00 . A A . 6 PHE HZ 1 1 8 3250 1 1 6 PHE N N 2.346 5.114 -4.551 1.00 . A A . 6 PHE N 1 1 8 3251 1 1 6 PHE O O 0.652 8.271 -4.403 1.00 . A A . 6 PHE O 1 1 8 3252 1 1 7 TRP C C -1.953 7.022 -2.351 1.00 . A A . 7 TRP C 1 1 8 3253 1 1 7 TRP CA C -1.529 6.830 -3.807 1.00 . A A . 7 TRP CA 1 1 8 3254 1 1 7 TRP CB C -2.371 5.749 -4.480 1.00 . A A . 7 TRP CB 1 1 8 3255 1 1 7 TRP CD1 C -0.858 5.637 -6.502 1.00 . A A . 7 TRP CD1 1 1 8 3256 1 1 7 TRP CD2 C -3.034 5.785 -7.058 1.00 . A A . 7 TRP CD2 1 1 8 3257 1 1 7 TRP CE2 C -2.299 5.741 -8.270 1.00 . A A . 7 TRP CE2 1 1 8 3258 1 1 7 TRP CE3 C -4.437 5.877 -7.132 1.00 . A A . 7 TRP CE3 1 1 8 3259 1 1 7 TRP CG C -2.091 5.732 -5.948 1.00 . A A . 7 TRP CG 1 1 8 3260 1 1 7 TRP CH2 C -4.331 5.871 -9.561 1.00 . A A . 7 TRP CH2 1 1 8 3261 1 1 7 TRP CZ2 C -2.937 5.782 -9.507 1.00 . A A . 7 TRP CZ2 1 1 8 3262 1 1 7 TRP CZ3 C -5.079 5.918 -8.372 1.00 . A A . 7 TRP CZ3 1 1 8 3263 1 1 7 TRP H H 0.025 5.375 -3.565 1.00 . A A . 7 TRP H 1 1 8 3264 1 1 7 TRP HA H -1.596 7.757 -4.357 1.00 . A A . 7 TRP HA 1 1 8 3265 1 1 7 TRP HB2 H -2.124 4.788 -4.055 1.00 . A A . 7 TRP HB2 1 1 8 3266 1 1 7 TRP HB3 H -3.417 5.957 -4.315 1.00 . A A . 7 TRP HB3 1 1 8 3267 1 1 7 TRP HD1 H 0.073 5.567 -5.952 1.00 . A A . 7 TRP HD1 1 1 8 3268 1 1 7 TRP HE1 H -0.232 5.604 -8.512 1.00 . A A . 7 TRP HE1 1 1 8 3269 1 1 7 TRP HE3 H -5.028 5.911 -6.226 1.00 . A A . 7 TRP HE3 1 1 8 3270 1 1 7 TRP HH2 H -4.834 5.904 -10.515 1.00 . A A . 7 TRP HH2 1 1 8 3271 1 1 7 TRP HZ2 H -2.355 5.746 -10.417 1.00 . A A . 7 TRP HZ2 1 1 8 3272 1 1 7 TRP HZ3 H -6.156 5.979 -8.412 1.00 . A A . 7 TRP HZ3 1 1 8 3273 1 1 7 TRP N N -0.142 6.309 -3.816 1.00 . A A . 7 TRP N 1 1 8 3274 1 1 7 TRP NE1 N -0.979 5.652 -7.877 1.00 . A A . 7 TRP NE1 1 1 8 3275 1 1 7 TRP O O -2.068 6.059 -1.618 1.00 . A A . 7 TRP O 1 1 8 3276 1 1 8 LYS C C -3.451 7.424 0.029 1.00 . A A . 8 LYS C 1 1 8 3277 1 1 8 LYS CA C -2.535 8.529 -0.508 1.00 . A A . 8 LYS CA 1 1 8 3278 1 1 8 LYS CB C -3.276 9.870 -0.545 1.00 . A A . 8 LYS CB 1 1 8 3279 1 1 8 LYS CD C -1.583 11.481 0.361 1.00 . A A . 8 LYS CD 1 1 8 3280 1 1 8 LYS CE C -1.132 12.247 1.614 1.00 . A A . 8 LYS CE 1 1 8 3281 1 1 8 LYS CG C -2.876 10.716 0.665 1.00 . A A . 8 LYS CG 1 1 8 3282 1 1 8 LYS H H -2.018 8.994 -2.549 1.00 . A A . 8 LYS H 1 1 8 3283 1 1 8 LYS HA H -1.654 8.610 0.109 1.00 . A A . 8 LYS HA 1 1 8 3284 1 1 8 LYS HB2 H -3.027 10.400 -1.453 1.00 . A A . 8 LYS HB2 1 1 8 3285 1 1 8 LYS HB3 H -4.341 9.691 -0.516 1.00 . A A . 8 LYS HB3 1 1 8 3286 1 1 8 LYS HD2 H -0.810 10.785 0.068 1.00 . A A . 8 LYS HD2 1 1 8 3287 1 1 8 LYS HD3 H -1.761 12.183 -0.439 1.00 . A A . 8 LYS HD3 1 1 8 3288 1 1 8 LYS HE2 H -1.796 12.035 2.442 1.00 . A A . 8 LYS HE2 1 1 8 3289 1 1 8 LYS HE3 H -0.114 11.990 1.871 1.00 . A A . 8 LYS HE3 1 1 8 3290 1 1 8 LYS HG2 H -3.669 11.420 0.887 1.00 . A A . 8 LYS HG2 1 1 8 3291 1 1 8 LYS HG3 H -2.722 10.071 1.516 1.00 . A A . 8 LYS HG3 1 1 8 3292 1 1 8 LYS HZ1 H -0.989 14.282 2.068 1.00 . A A . 8 LYS HZ1 1 1 8 3293 1 1 8 LYS HZ2 H -2.170 13.921 0.904 1.00 . A A . 8 LYS HZ2 1 1 8 3294 1 1 8 LYS HZ3 H -0.525 13.899 0.484 1.00 . A A . 8 LYS HZ3 1 1 8 3295 1 1 8 LYS N N -2.146 8.251 -1.929 1.00 . A A . 8 LYS N 1 1 8 3296 1 1 8 LYS NZ N -1.210 13.693 1.240 1.00 . A A . 8 LYS NZ 1 1 8 3297 1 1 8 LYS O O -4.625 7.360 -0.292 1.00 . A A . 8 LYS O 1 1 8 3298 1 1 9 CYS C C -3.863 5.505 2.883 1.00 . A A . 9 CYS C 1 1 8 3299 1 1 9 CYS CA C -3.738 5.412 1.358 1.00 . A A . 9 CYS CA 1 1 8 3300 1 1 9 CYS CB C -2.994 4.136 0.925 1.00 . A A . 9 CYS CB 1 1 8 3301 1 1 9 CYS H H -1.947 6.597 1.036 1.00 . A A . 9 CYS H 1 1 8 3302 1 1 9 CYS HA H -4.718 5.426 0.908 1.00 . A A . 9 CYS HA 1 1 8 3303 1 1 9 CYS HB2 H -3.599 3.597 0.210 1.00 . A A . 9 CYS HB2 1 1 8 3304 1 1 9 CYS HB3 H -2.058 4.409 0.461 1.00 . A A . 9 CYS HB3 1 1 8 3305 1 1 9 CYS N N -2.909 6.535 0.818 1.00 . A A . 9 CYS N 1 1 8 3306 1 1 9 CYS O O -2.975 5.987 3.561 1.00 . A A . 9 CYS O 1 1 8 3307 1 1 9 CYS SG S -2.669 3.072 2.353 1.00 . A A . 9 CYS SG 1 1 8 3308 1 1 10 LYS C C -4.741 3.774 5.547 1.00 . A A . 10 LYS C 1 1 8 3309 1 1 10 LYS CA C -5.172 5.098 4.896 1.00 . A A . 10 LYS CA 1 1 8 3310 1 1 10 LYS CB C -6.677 5.320 5.069 1.00 . A A . 10 LYS CB 1 1 8 3311 1 1 10 LYS CD C -7.010 7.572 6.120 1.00 . A A . 10 LYS CD 1 1 8 3312 1 1 10 LYS CE C -8.088 8.201 7.021 1.00 . A A . 10 LYS CE 1 1 8 3313 1 1 10 LYS CG C -6.938 6.062 6.379 1.00 . A A . 10 LYS CG 1 1 8 3314 1 1 10 LYS H H -5.669 4.670 2.845 1.00 . A A . 10 LYS H 1 1 8 3315 1 1 10 LYS HA H -4.625 5.924 5.326 1.00 . A A . 10 LYS HA 1 1 8 3316 1 1 10 LYS HB2 H -7.054 5.903 4.242 1.00 . A A . 10 LYS HB2 1 1 8 3317 1 1 10 LYS HB3 H -7.181 4.363 5.095 1.00 . A A . 10 LYS HB3 1 1 8 3318 1 1 10 LYS HD2 H -6.051 8.018 6.343 1.00 . A A . 10 LYS HD2 1 1 8 3319 1 1 10 LYS HD3 H -7.259 7.752 5.086 1.00 . A A . 10 LYS HD3 1 1 8 3320 1 1 10 LYS HE2 H -8.045 7.767 8.011 1.00 . A A . 10 LYS HE2 1 1 8 3321 1 1 10 LYS HE3 H -7.951 9.271 7.075 1.00 . A A . 10 LYS HE3 1 1 8 3322 1 1 10 LYS HG2 H -7.874 5.720 6.798 1.00 . A A . 10 LYS HG2 1 1 8 3323 1 1 10 LYS HG3 H -6.139 5.855 7.075 1.00 . A A . 10 LYS HG3 1 1 8 3324 1 1 10 LYS HZ1 H -9.374 6.917 5.989 1.00 . A A . 10 LYS HZ1 1 1 8 3325 1 1 10 LYS HZ2 H -9.565 8.557 5.593 1.00 . A A . 10 LYS HZ2 1 1 8 3326 1 1 10 LYS HZ3 H -10.154 7.963 7.067 1.00 . A A . 10 LYS HZ3 1 1 8 3327 1 1 10 LYS N N -4.966 5.049 3.419 1.00 . A A . 10 LYS N 1 1 8 3328 1 1 10 LYS NZ N -9.392 7.885 6.366 1.00 . A A . 10 LYS NZ 1 1 8 3329 1 1 10 LYS O O -4.318 3.745 6.690 1.00 . A A . 10 LYS O 1 1 8 3330 1 1 11 ASN C C -3.651 0.554 4.359 1.00 . A A . 11 ASN C 1 1 8 3331 1 1 11 ASN CA C -4.446 1.357 5.407 1.00 . A A . 11 ASN CA 1 1 8 3332 1 1 11 ASN CB C -5.770 0.673 5.791 1.00 . A A . 11 ASN CB 1 1 8 3333 1 1 11 ASN CG C -5.794 -0.775 5.302 1.00 . A A . 11 ASN CG 1 1 8 3334 1 1 11 ASN H H -5.194 2.726 3.916 1.00 . A A . 11 ASN H 1 1 8 3335 1 1 11 ASN HA H -3.842 1.508 6.290 1.00 . A A . 11 ASN HA 1 1 8 3336 1 1 11 ASN HB2 H -5.876 0.685 6.866 1.00 . A A . 11 ASN HB2 1 1 8 3337 1 1 11 ASN HB3 H -6.591 1.212 5.347 1.00 . A A . 11 ASN HB3 1 1 8 3338 1 1 11 ASN HD21 H -7.041 -0.392 3.821 1.00 . A A . 11 ASN HD21 1 1 8 3339 1 1 11 ASN HD22 H -6.562 -2.005 3.959 1.00 . A A . 11 ASN HD22 1 1 8 3340 1 1 11 ASN N N -4.848 2.679 4.833 1.00 . A A . 11 ASN N 1 1 8 3341 1 1 11 ASN ND2 N -6.522 -1.083 4.273 1.00 . A A . 11 ASN ND2 1 1 8 3342 1 1 11 ASN O O -3.885 0.672 3.173 1.00 . A A . 11 ASN O 1 1 8 3343 1 1 11 ASN OD1 O -5.133 -1.632 5.858 1.00 . A A . 11 ASN OD1 1 1 8 3344 1 1 12 LYS C C -2.720 -1.865 2.855 1.00 . A A . 12 LYS C 1 1 8 3345 1 1 12 LYS CA C -1.865 -1.037 3.834 1.00 . A A . 12 LYS CA 1 1 8 3346 1 1 12 LYS CB C -0.982 -1.942 4.713 1.00 . A A . 12 LYS CB 1 1 8 3347 1 1 12 LYS CD C -1.052 -3.384 6.764 1.00 . A A . 12 LYS CD 1 1 8 3348 1 1 12 LYS CE C -0.368 -4.726 6.451 1.00 . A A . 12 LYS CE 1 1 8 3349 1 1 12 LYS CG C -1.841 -2.909 5.541 1.00 . A A . 12 LYS CG 1 1 8 3350 1 1 12 LYS H H -2.535 -0.310 5.751 1.00 . A A . 12 LYS H 1 1 8 3351 1 1 12 LYS HA H -1.232 -0.363 3.275 1.00 . A A . 12 LYS HA 1 1 8 3352 1 1 12 LYS HB2 H -0.323 -2.509 4.081 1.00 . A A . 12 LYS HB2 1 1 8 3353 1 1 12 LYS HB3 H -0.394 -1.330 5.380 1.00 . A A . 12 LYS HB3 1 1 8 3354 1 1 12 LYS HD2 H -0.302 -2.647 7.018 1.00 . A A . 12 LYS HD2 1 1 8 3355 1 1 12 LYS HD3 H -1.727 -3.511 7.594 1.00 . A A . 12 LYS HD3 1 1 8 3356 1 1 12 LYS HE2 H -0.851 -5.206 5.611 1.00 . A A . 12 LYS HE2 1 1 8 3357 1 1 12 LYS HE3 H 0.683 -4.578 6.244 1.00 . A A . 12 LYS HE3 1 1 8 3358 1 1 12 LYS HG2 H -2.741 -2.407 5.869 1.00 . A A . 12 LYS HG2 1 1 8 3359 1 1 12 LYS HG3 H -2.107 -3.760 4.934 1.00 . A A . 12 LYS HG3 1 1 8 3360 1 1 12 LYS HZ1 H 0.097 -5.188 8.432 1.00 . A A . 12 LYS HZ1 1 1 8 3361 1 1 12 LYS HZ2 H -0.270 -6.541 7.474 1.00 . A A . 12 LYS HZ2 1 1 8 3362 1 1 12 LYS HZ3 H -1.514 -5.521 8.015 1.00 . A A . 12 LYS HZ3 1 1 8 3363 1 1 12 LYS N N -2.707 -0.244 4.793 1.00 . A A . 12 LYS N 1 1 8 3364 1 1 12 LYS NZ N -0.528 -5.553 7.686 1.00 . A A . 12 LYS NZ 1 1 8 3365 1 1 12 LYS O O -2.415 -1.942 1.684 1.00 . A A . 12 LYS O 1 1 8 3366 1 1 13 LYS C C -5.479 -2.394 1.456 1.00 . A A . 13 LYS C 1 1 8 3367 1 1 13 LYS CA C -4.642 -3.293 2.390 1.00 . A A . 13 LYS CA 1 1 8 3368 1 1 13 LYS CB C -5.560 -4.120 3.304 1.00 . A A . 13 LYS CB 1 1 8 3369 1 1 13 LYS CD C -6.336 -6.495 3.477 1.00 . A A . 13 LYS CD 1 1 8 3370 1 1 13 LYS CE C -6.025 -7.609 4.488 1.00 . A A . 13 LYS CE 1 1 8 3371 1 1 13 LYS CG C -5.113 -5.587 3.304 1.00 . A A . 13 LYS CG 1 1 8 3372 1 1 13 LYS H H -4.023 -2.400 4.264 1.00 . A A . 13 LYS H 1 1 8 3373 1 1 13 LYS HA H -4.025 -3.954 1.804 1.00 . A A . 13 LYS HA 1 1 8 3374 1 1 13 LYS HB2 H -5.518 -3.731 4.312 1.00 . A A . 13 LYS HB2 1 1 8 3375 1 1 13 LYS HB3 H -6.576 -4.059 2.938 1.00 . A A . 13 LYS HB3 1 1 8 3376 1 1 13 LYS HD2 H -7.171 -5.907 3.832 1.00 . A A . 13 LYS HD2 1 1 8 3377 1 1 13 LYS HD3 H -6.588 -6.936 2.523 1.00 . A A . 13 LYS HD3 1 1 8 3378 1 1 13 LYS HE2 H -5.483 -8.410 4.005 1.00 . A A . 13 LYS HE2 1 1 8 3379 1 1 13 LYS HE3 H -5.456 -7.216 5.317 1.00 . A A . 13 LYS HE3 1 1 8 3380 1 1 13 LYS HG2 H -4.627 -5.812 2.364 1.00 . A A . 13 LYS HG2 1 1 8 3381 1 1 13 LYS HG3 H -4.422 -5.753 4.117 1.00 . A A . 13 LYS HG3 1 1 8 3382 1 1 13 LYS HZ1 H -7.845 -7.329 5.473 1.00 . A A . 13 LYS HZ1 1 1 8 3383 1 1 13 LYS HZ2 H -7.219 -8.898 5.611 1.00 . A A . 13 LYS HZ2 1 1 8 3384 1 1 13 LYS HZ3 H -7.934 -8.396 4.158 1.00 . A A . 13 LYS HZ3 1 1 8 3385 1 1 13 LYS N N -3.785 -2.477 3.315 1.00 . A A . 13 LYS N 1 1 8 3386 1 1 13 LYS NZ N -7.355 -8.092 4.966 1.00 . A A . 13 LYS NZ 1 1 8 3387 1 1 13 LYS O O -6.277 -2.879 0.674 1.00 . A A . 13 LYS O 1 1 8 3388 1 1 14 GLU C C -5.493 -0.128 -0.772 1.00 . A A . 14 GLU C 1 1 8 3389 1 1 14 GLU CA C -6.099 -0.180 0.644 1.00 . A A . 14 GLU CA 1 1 8 3390 1 1 14 GLU CB C -5.997 1.186 1.332 1.00 . A A . 14 GLU CB 1 1 8 3391 1 1 14 GLU CD C -7.292 3.320 1.498 1.00 . A A . 14 GLU CD 1 1 8 3392 1 1 14 GLU CG C -6.820 2.210 0.559 1.00 . A A . 14 GLU CG 1 1 8 3393 1 1 14 GLU H H -4.672 -0.710 2.155 1.00 . A A . 14 GLU H 1 1 8 3394 1 1 14 GLU HA H -7.130 -0.495 0.600 1.00 . A A . 14 GLU HA 1 1 8 3395 1 1 14 GLU HB2 H -6.374 1.106 2.340 1.00 . A A . 14 GLU HB2 1 1 8 3396 1 1 14 GLU HB3 H -4.965 1.499 1.356 1.00 . A A . 14 GLU HB3 1 1 8 3397 1 1 14 GLU HG2 H -6.215 2.631 -0.226 1.00 . A A . 14 GLU HG2 1 1 8 3398 1 1 14 GLU HG3 H -7.674 1.718 0.127 1.00 . A A . 14 GLU HG3 1 1 8 3399 1 1 14 GLU N N -5.313 -1.093 1.525 1.00 . A A . 14 GLU N 1 1 8 3400 1 1 14 GLU O O -6.156 0.235 -1.729 1.00 . A A . 14 GLU O 1 1 8 3401 1 1 14 GLU OE1 O -8.204 3.075 2.270 1.00 . A A . 14 GLU OE1 1 1 8 3402 1 1 14 GLU OE2 O -6.730 4.399 1.436 1.00 . A A . 14 GLU OE2 1 1 8 3403 1 1 15 CYS C C -3.625 -1.821 -2.926 1.00 . A A . 15 CYS C 1 1 8 3404 1 1 15 CYS CA C -3.609 -0.435 -2.275 1.00 . A A . 15 CYS CA 1 1 8 3405 1 1 15 CYS CB C -2.163 0.018 -2.047 1.00 . A A . 15 CYS CB 1 1 8 3406 1 1 15 CYS H H -3.720 -0.767 -0.142 1.00 . A A . 15 CYS H 1 1 8 3407 1 1 15 CYS HA H -4.118 0.281 -2.903 1.00 . A A . 15 CYS HA 1 1 8 3408 1 1 15 CYS HB2 H -1.663 -0.688 -1.403 1.00 . A A . 15 CYS HB2 1 1 8 3409 1 1 15 CYS HB3 H -1.646 0.064 -2.997 1.00 . A A . 15 CYS HB3 1 1 8 3410 1 1 15 CYS N N -4.241 -0.478 -0.919 1.00 . A A . 15 CYS N 1 1 8 3411 1 1 15 CYS O O -3.605 -2.835 -2.250 1.00 . A A . 15 CYS O 1 1 8 3412 1 1 15 CYS SG S -2.146 1.658 -1.274 1.00 . A A . 15 CYS SG 1 1 8 3413 1 1 16 CYS C C -2.207 -3.775 -4.861 1.00 . A A . 16 CYS C 1 1 8 3414 1 1 16 CYS CA C -3.623 -3.198 -4.924 1.00 . A A . 16 CYS CA 1 1 8 3415 1 1 16 CYS CB C -4.042 -2.924 -6.369 1.00 . A A . 16 CYS CB 1 1 8 3416 1 1 16 CYS H H -3.626 -1.040 -4.759 1.00 . A A . 16 CYS H 1 1 8 3417 1 1 16 CYS HA H -4.325 -3.866 -4.454 1.00 . A A . 16 CYS HA 1 1 8 3418 1 1 16 CYS HB2 H -3.877 -1.882 -6.601 1.00 . A A . 16 CYS HB2 1 1 8 3419 1 1 16 CYS HB3 H -3.455 -3.537 -7.037 1.00 . A A . 16 CYS HB3 1 1 8 3420 1 1 16 CYS N N -3.634 -1.872 -4.233 1.00 . A A . 16 CYS N 1 1 8 3421 1 1 16 CYS O O -1.251 -3.041 -4.712 1.00 . A A . 16 CYS O 1 1 8 3422 1 1 16 CYS SG S -5.800 -3.319 -6.568 1.00 . A A . 16 CYS SG 1 1 8 3423 1 1 17 GLY C C -0.161 -5.473 -3.448 1.00 . A A . 17 GLY C 1 1 8 3424 1 1 17 GLY CA C -0.691 -5.679 -4.869 1.00 . A A . 17 GLY CA 1 1 8 3425 1 1 17 GLY H H -2.844 -5.651 -5.056 1.00 . A A . 17 GLY H 1 1 8 3426 1 1 17 GLY HA2 H -0.742 -6.735 -5.092 1.00 . A A . 17 GLY HA2 1 1 8 3427 1 1 17 GLY HA3 H -0.033 -5.189 -5.569 1.00 . A A . 17 GLY HA3 1 1 8 3428 1 1 17 GLY N N -2.061 -5.075 -4.951 1.00 . A A . 17 GLY N 1 1 8 3429 1 1 17 GLY O O 0.837 -4.814 -3.247 1.00 . A A . 17 GLY O 1 1 8 3430 1 1 18 TRP C C 0.746 -5.035 -0.764 1.00 . A A . 18 TRP C 1 1 8 3431 1 1 18 TRP CA C -0.494 -5.908 -1.021 1.00 . A A . 18 TRP CA 1 1 8 3432 1 1 18 TRP CB C -0.249 -7.349 -0.556 1.00 . A A . 18 TRP CB 1 1 8 3433 1 1 18 TRP CD1 C -2.620 -7.337 0.344 1.00 . A A . 18 TRP CD1 1 1 8 3434 1 1 18 TRP CD2 C -1.937 -9.389 -0.278 1.00 . A A . 18 TRP CD2 1 1 8 3435 1 1 18 TRP CE2 C -3.262 -9.529 0.199 1.00 . A A . 18 TRP CE2 1 1 8 3436 1 1 18 TRP CE3 C -1.271 -10.540 -0.732 1.00 . A A . 18 TRP CE3 1 1 8 3437 1 1 18 TRP CG C -1.552 -7.987 -0.178 1.00 . A A . 18 TRP CG 1 1 8 3438 1 1 18 TRP CH2 C -3.227 -11.902 -0.231 1.00 . A A . 18 TRP CH2 1 1 8 3439 1 1 18 TRP CZ2 C -3.903 -10.767 0.222 1.00 . A A . 18 TRP CZ2 1 1 8 3440 1 1 18 TRP CZ3 C -1.912 -11.790 -0.709 1.00 . A A . 18 TRP CZ3 1 1 8 3441 1 1 18 TRP H H -1.660 -6.543 -2.716 1.00 . A A . 18 TRP H 1 1 8 3442 1 1 18 TRP HA H -1.331 -5.503 -0.481 1.00 . A A . 18 TRP HA 1 1 8 3443 1 1 18 TRP HB2 H 0.206 -7.912 -1.357 1.00 . A A . 18 TRP HB2 1 1 8 3444 1 1 18 TRP HB3 H 0.410 -7.347 0.300 1.00 . A A . 18 TRP HB3 1 1 8 3445 1 1 18 TRP HD1 H -2.672 -6.277 0.549 1.00 . A A . 18 TRP HD1 1 1 8 3446 1 1 18 TRP HE1 H -4.520 -8.038 0.930 1.00 . A A . 18 TRP HE1 1 1 8 3447 1 1 18 TRP HE3 H -0.259 -10.463 -1.101 1.00 . A A . 18 TRP HE3 1 1 8 3448 1 1 18 TRP HH2 H -3.715 -12.866 -0.215 1.00 . A A . 18 TRP HH2 1 1 8 3449 1 1 18 TRP HZ2 H -4.917 -10.849 0.592 1.00 . A A . 18 TRP HZ2 1 1 8 3450 1 1 18 TRP HZ3 H -1.391 -12.669 -1.058 1.00 . A A . 18 TRP HZ3 1 1 8 3451 1 1 18 TRP N N -0.854 -6.036 -2.480 1.00 . A A . 18 TRP N 1 1 8 3452 1 1 18 TRP NE1 N -3.635 -8.250 0.561 1.00 . A A . 18 TRP NE1 1 1 8 3453 1 1 18 TRP O O 1.817 -5.521 -0.444 1.00 . A A . 18 TRP O 1 1 8 3454 1 1 19 ASN C C 1.593 -2.267 0.816 1.00 . A A . 19 ASN C 1 1 8 3455 1 1 19 ASN CA C 1.723 -2.814 -0.608 1.00 . A A . 19 ASN CA 1 1 8 3456 1 1 19 ASN CB C 1.577 -1.692 -1.639 1.00 . A A . 19 ASN CB 1 1 8 3457 1 1 19 ASN CG C 2.921 -1.447 -2.326 1.00 . A A . 19 ASN CG 1 1 8 3458 1 1 19 ASN H H -0.289 -3.383 -1.105 1.00 . A A . 19 ASN H 1 1 8 3459 1 1 19 ASN HA H 2.670 -3.321 -0.739 1.00 . A A . 19 ASN HA 1 1 8 3460 1 1 19 ASN HB2 H 0.843 -1.980 -2.377 1.00 . A A . 19 ASN HB2 1 1 8 3461 1 1 19 ASN HB3 H 1.253 -0.789 -1.144 1.00 . A A . 19 ASN HB3 1 1 8 3462 1 1 19 ASN HD21 H 3.601 -0.245 -0.906 1.00 . A A . 19 ASN HD21 1 1 8 3463 1 1 19 ASN HD22 H 4.661 -0.502 -2.202 1.00 . A A . 19 ASN HD22 1 1 8 3464 1 1 19 ASN N N 0.588 -3.744 -0.872 1.00 . A A . 19 ASN N 1 1 8 3465 1 1 19 ASN ND2 N 3.799 -0.668 -1.763 1.00 . A A . 19 ASN ND2 1 1 8 3466 1 1 19 ASN O O 0.547 -2.363 1.426 1.00 . A A . 19 ASN O 1 1 8 3467 1 1 19 ASN OD1 O 3.180 -1.972 -3.387 1.00 . A A . 19 ASN OD1 1 1 8 3468 1 1 20 ALA C C 2.355 0.332 2.765 1.00 . A A . 20 ALA C 1 1 8 3469 1 1 20 ALA CA C 2.559 -1.179 2.753 1.00 . A A . 20 ALA CA 1 1 8 3470 1 1 20 ALA CB C 3.902 -1.511 3.388 1.00 . A A . 20 ALA CB 1 1 8 3471 1 1 20 ALA H H 3.477 -1.641 0.858 1.00 . A A . 20 ALA H 1 1 8 3472 1 1 20 ALA HA H 1.771 -1.670 3.294 1.00 . A A . 20 ALA HA 1 1 8 3473 1 1 20 ALA HB1 H 4.671 -0.922 2.909 1.00 . A A . 20 ALA HB1 1 1 8 3474 1 1 20 ALA HB2 H 4.117 -2.560 3.257 1.00 . A A . 20 ALA HB2 1 1 8 3475 1 1 20 ALA HB3 H 3.874 -1.276 4.444 1.00 . A A . 20 ALA HB3 1 1 8 3476 1 1 20 ALA N N 2.639 -1.707 1.359 1.00 . A A . 20 ALA N 1 1 8 3477 1 1 20 ALA O O 3.064 1.072 2.104 1.00 . A A . 20 ALA O 1 1 8 3478 1 1 21 CYS C C 2.145 2.806 4.721 1.00 . A A . 21 CYS C 1 1 8 3479 1 1 21 CYS CA C 1.200 2.268 3.647 1.00 . A A . 21 CYS CA 1 1 8 3480 1 1 21 CYS CB C -0.268 2.427 4.054 1.00 . A A . 21 CYS CB 1 1 8 3481 1 1 21 CYS H H 0.889 0.183 4.094 1.00 . A A . 21 CYS H 1 1 8 3482 1 1 21 CYS HA H 1.389 2.748 2.699 1.00 . A A . 21 CYS HA 1 1 8 3483 1 1 21 CYS HB2 H -0.812 1.529 3.800 1.00 . A A . 21 CYS HB2 1 1 8 3484 1 1 21 CYS HB3 H -0.338 2.595 5.116 1.00 . A A . 21 CYS HB3 1 1 8 3485 1 1 21 CYS N N 1.424 0.799 3.546 1.00 . A A . 21 CYS N 1 1 8 3486 1 1 21 CYS O O 1.936 2.593 5.902 1.00 . A A . 21 CYS O 1 1 8 3487 1 1 21 CYS SG S -0.985 3.827 3.164 1.00 . A A . 21 CYS SG 1 1 8 3488 1 1 22 ALA C C 4.401 5.464 5.250 1.00 . A A . 22 ALA C 1 1 8 3489 1 1 22 ALA CA C 4.200 3.947 5.331 1.00 . A A . 22 ALA CA 1 1 8 3490 1 1 22 ALA CB C 5.500 3.220 4.981 1.00 . A A . 22 ALA CB 1 1 8 3491 1 1 22 ALA H H 3.378 3.578 3.364 1.00 . A A . 22 ALA H 1 1 8 3492 1 1 22 ALA HA H 3.888 3.666 6.323 1.00 . A A . 22 ALA HA 1 1 8 3493 1 1 22 ALA HB1 H 5.442 2.196 5.318 1.00 . A A . 22 ALA HB1 1 1 8 3494 1 1 22 ALA HB2 H 6.329 3.712 5.469 1.00 . A A . 22 ALA HB2 1 1 8 3495 1 1 22 ALA HB3 H 5.647 3.238 3.907 1.00 . A A . 22 ALA HB3 1 1 8 3496 1 1 22 ALA N N 3.211 3.453 4.324 1.00 . A A . 22 ALA N 1 1 8 3497 1 1 22 ALA O O 3.957 6.200 6.109 1.00 . A A . 22 ALA O 1 1 8 3498 1 1 23 LEU C C 4.095 8.160 3.671 1.00 . A A . 23 LEU C 1 1 8 3499 1 1 23 LEU CA C 5.363 7.407 4.118 1.00 . A A . 23 LEU CA 1 1 8 3500 1 1 23 LEU CB C 6.458 7.506 3.037 1.00 . A A . 23 LEU CB 1 1 8 3501 1 1 23 LEU CD1 C 7.747 6.232 4.827 1.00 . A A . 23 LEU CD1 1 1 8 3502 1 1 23 LEU CD2 C 8.641 6.390 2.512 1.00 . A A . 23 LEU CD2 1 1 8 3503 1 1 23 LEU CG C 7.853 7.136 3.593 1.00 . A A . 23 LEU CG 1 1 8 3504 1 1 23 LEU H H 5.459 5.316 3.575 1.00 . A A . 23 LEU H 1 1 8 3505 1 1 23 LEU HA H 5.730 7.806 5.049 1.00 . A A . 23 LEU HA 1 1 8 3506 1 1 23 LEU HB2 H 6.213 6.835 2.226 1.00 . A A . 23 LEU HB2 1 1 8 3507 1 1 23 LEU HB3 H 6.486 8.517 2.657 1.00 . A A . 23 LEU HB3 1 1 8 3508 1 1 23 LEU HD11 H 7.106 6.695 5.562 1.00 . A A . 23 LEU HD11 1 1 8 3509 1 1 23 LEU HD12 H 8.731 6.087 5.250 1.00 . A A . 23 LEU HD12 1 1 8 3510 1 1 23 LEU HD13 H 7.338 5.277 4.539 1.00 . A A . 23 LEU HD13 1 1 8 3511 1 1 23 LEU HD21 H 8.619 5.327 2.718 1.00 . A A . 23 LEU HD21 1 1 8 3512 1 1 23 LEU HD22 H 9.665 6.735 2.512 1.00 . A A . 23 LEU HD22 1 1 8 3513 1 1 23 LEU HD23 H 8.196 6.577 1.546 1.00 . A A . 23 LEU HD23 1 1 8 3514 1 1 23 LEU HG H 8.384 8.039 3.858 1.00 . A A . 23 LEU HG 1 1 8 3515 1 1 23 LEU N N 5.094 5.935 4.242 1.00 . A A . 23 LEU N 1 1 8 3516 1 1 23 LEU O O 4.120 8.906 2.715 1.00 . A A . 23 LEU O 1 1 8 3517 1 1 24 GLY C C 1.162 8.046 2.663 1.00 . A A . 24 GLY C 1 1 8 3518 1 1 24 GLY CA C 1.727 8.672 3.947 1.00 . A A . 24 GLY CA 1 1 8 3519 1 1 24 GLY H H 2.983 7.365 5.122 1.00 . A A . 24 GLY H 1 1 8 3520 1 1 24 GLY HA2 H 0.998 8.579 4.740 1.00 . A A . 24 GLY HA2 1 1 8 3521 1 1 24 GLY HA3 H 1.933 9.717 3.770 1.00 . A A . 24 GLY HA3 1 1 8 3522 1 1 24 GLY N N 2.990 7.971 4.350 1.00 . A A . 24 GLY N 1 1 8 3523 1 1 24 GLY O O 0.184 8.519 2.112 1.00 . A A . 24 GLY O 1 1 8 3524 1 1 25 ILE C C 1.724 4.850 0.954 1.00 . A A . 25 ILE C 1 1 8 3525 1 1 25 ILE CA C 1.277 6.315 0.941 1.00 . A A . 25 ILE CA 1 1 8 3526 1 1 25 ILE CB C 1.931 7.034 -0.252 1.00 . A A . 25 ILE CB 1 1 8 3527 1 1 25 ILE CD1 C 3.365 8.939 -1.025 1.00 . A A . 25 ILE CD1 1 1 8 3528 1 1 25 ILE CG1 C 2.771 8.238 0.198 1.00 . A A . 25 ILE CG1 1 1 8 3529 1 1 25 ILE CG2 C 0.856 7.516 -1.209 1.00 . A A . 25 ILE CG2 1 1 8 3530 1 1 25 ILE H H 2.548 6.618 2.647 1.00 . A A . 25 ILE H 1 1 8 3531 1 1 25 ILE HA H 0.203 6.385 0.874 1.00 . A A . 25 ILE HA 1 1 8 3532 1 1 25 ILE HB H 2.561 6.334 -0.769 1.00 . A A . 25 ILE HB 1 1 8 3533 1 1 25 ILE HD11 H 3.692 9.931 -0.748 1.00 . A A . 25 ILE HD11 1 1 8 3534 1 1 25 ILE HD12 H 2.615 9.012 -1.799 1.00 . A A . 25 ILE HD12 1 1 8 3535 1 1 25 ILE HD13 H 4.206 8.373 -1.392 1.00 . A A . 25 ILE HD13 1 1 8 3536 1 1 25 ILE HG12 H 2.145 8.932 0.741 1.00 . A A . 25 ILE HG12 1 1 8 3537 1 1 25 ILE HG13 H 3.570 7.898 0.838 1.00 . A A . 25 ILE HG13 1 1 8 3538 1 1 25 ILE HG21 H 1.312 8.120 -1.980 1.00 . A A . 25 ILE HG21 1 1 8 3539 1 1 25 ILE HG22 H 0.129 8.104 -0.671 1.00 . A A . 25 ILE HG22 1 1 8 3540 1 1 25 ILE HG23 H 0.374 6.664 -1.660 1.00 . A A . 25 ILE HG23 1 1 8 3541 1 1 25 ILE N N 1.767 6.983 2.184 1.00 . A A . 25 ILE N 1 1 8 3542 1 1 25 ILE O O 2.342 4.395 1.898 1.00 . A A . 25 ILE O 1 1 8 3543 1 1 26 CYS C C 3.274 2.608 -0.750 1.00 . A A . 26 CYS C 1 1 8 3544 1 1 26 CYS CA C 1.882 2.685 -0.131 1.00 . A A . 26 CYS CA 1 1 8 3545 1 1 26 CYS CB C 0.848 1.971 -1.003 1.00 . A A . 26 CYS CB 1 1 8 3546 1 1 26 CYS H H 0.963 4.508 -0.862 1.00 . A A . 26 CYS H 1 1 8 3547 1 1 26 CYS HA H 1.883 2.265 0.859 1.00 . A A . 26 CYS HA 1 1 8 3548 1 1 26 CYS HB2 H 0.554 2.614 -1.818 1.00 . A A . 26 CYS HB2 1 1 8 3549 1 1 26 CYS HB3 H 1.276 1.061 -1.400 1.00 . A A . 26 CYS HB3 1 1 8 3550 1 1 26 CYS N N 1.442 4.114 -0.090 1.00 . A A . 26 CYS N 1 1 8 3551 1 1 26 CYS O O 3.471 3.027 -1.868 1.00 . A A . 26 CYS O 1 1 8 3552 1 1 26 CYS SG S -0.597 1.570 0.014 1.00 . A A . 26 CYS SG 1 1 8 3553 1 1 27 MET C C 6.430 0.818 -0.142 1.00 . A A . 27 MET C 1 1 8 3554 1 1 27 MET CA C 5.623 2.031 -0.643 1.00 . A A . 27 MET CA 1 1 8 3555 1 1 27 MET CB C 6.288 3.359 -0.250 1.00 . A A . 27 MET CB 1 1 8 3556 1 1 27 MET CE C 8.676 5.190 -1.282 1.00 . A A . 27 MET CE 1 1 8 3557 1 1 27 MET CG C 6.074 4.388 -1.359 1.00 . A A . 27 MET CG 1 1 8 3558 1 1 27 MET H H 4.085 1.756 0.866 1.00 . A A . 27 MET H 1 1 8 3559 1 1 27 MET HA H 5.545 1.984 -1.713 1.00 . A A . 27 MET HA 1 1 8 3560 1 1 27 MET HB2 H 5.851 3.724 0.667 1.00 . A A . 27 MET HB2 1 1 8 3561 1 1 27 MET HB3 H 7.347 3.203 -0.106 1.00 . A A . 27 MET HB3 1 1 8 3562 1 1 27 MET HE1 H 9.681 4.842 -1.489 1.00 . A A . 27 MET HE1 1 1 8 3563 1 1 27 MET HE2 H 8.409 4.924 -0.274 1.00 . A A . 27 MET HE2 1 1 8 3564 1 1 27 MET HE3 H 8.631 6.267 -1.389 1.00 . A A . 27 MET HE3 1 1 8 3565 1 1 27 MET HG2 H 5.200 4.118 -1.931 1.00 . A A . 27 MET HG2 1 1 8 3566 1 1 27 MET HG3 H 5.926 5.363 -0.918 1.00 . A A . 27 MET HG3 1 1 8 3567 1 1 27 MET N N 4.251 2.090 -0.045 1.00 . A A . 27 MET N 1 1 8 3568 1 1 27 MET O O 6.572 -0.141 -0.869 1.00 . A A . 27 MET O 1 1 8 3569 1 1 27 MET SD S 7.524 4.418 -2.449 1.00 . A A . 27 MET SD 1 1 8 3570 1 1 28 PRO C C 6.899 -1.427 1.960 1.00 . A A . 28 PRO C 1 1 8 3571 1 1 28 PRO CA C 7.780 -0.220 1.611 1.00 . A A . 28 PRO CA 1 1 8 3572 1 1 28 PRO CB C 8.410 0.384 2.866 1.00 . A A . 28 PRO CB 1 1 8 3573 1 1 28 PRO CD C 6.834 1.995 2.027 1.00 . A A . 28 PRO CD 1 1 8 3574 1 1 28 PRO CG C 7.477 1.468 3.282 1.00 . A A . 28 PRO CG 1 1 8 3575 1 1 28 PRO HA H 8.549 -0.504 0.913 1.00 . A A . 28 PRO HA 1 1 8 3576 1 1 28 PRO HB2 H 8.497 -0.363 3.643 1.00 . A A . 28 PRO HB2 1 1 8 3577 1 1 28 PRO HB3 H 9.375 0.803 2.635 1.00 . A A . 28 PRO HB3 1 1 8 3578 1 1 28 PRO HD2 H 5.795 2.233 2.202 1.00 . A A . 28 PRO HD2 1 1 8 3579 1 1 28 PRO HD3 H 7.369 2.860 1.667 1.00 . A A . 28 PRO HD3 1 1 8 3580 1 1 28 PRO HG2 H 6.725 1.073 3.952 1.00 . A A . 28 PRO HG2 1 1 8 3581 1 1 28 PRO HG3 H 8.027 2.256 3.767 1.00 . A A . 28 PRO HG3 1 1 8 3582 1 1 28 PRO N N 6.955 0.896 1.065 1.00 . A A . 28 PRO N 1 1 8 3583 1 1 28 PRO O O 6.604 -1.672 3.115 1.00 . A A . 28 PRO O 1 1 8 3584 1 1 29 ARG C C 6.220 -4.327 2.220 1.00 . A A . 29 ARG C 1 1 8 3585 1 1 29 ARG CA C 5.590 -3.361 1.206 1.00 . A A . 29 ARG CA 1 1 8 3586 1 1 29 ARG CB C 5.410 -4.031 -0.172 1.00 . A A . 29 ARG CB 1 1 8 3587 1 1 29 ARG CD C 6.200 -6.377 -0.548 1.00 . A A . 29 ARG CD 1 1 8 3588 1 1 29 ARG CG C 6.621 -4.903 -0.526 1.00 . A A . 29 ARG CG 1 1 8 3589 1 1 29 ARG CZ C 7.592 -7.592 1.064 1.00 . A A . 29 ARG CZ 1 1 8 3590 1 1 29 ARG H H 6.724 -1.928 0.050 1.00 . A A . 29 ARG H 1 1 8 3591 1 1 29 ARG HA H 4.630 -3.037 1.570 1.00 . A A . 29 ARG HA 1 1 8 3592 1 1 29 ARG HB2 H 4.521 -4.646 -0.158 1.00 . A A . 29 ARG HB2 1 1 8 3593 1 1 29 ARG HB3 H 5.297 -3.265 -0.923 1.00 . A A . 29 ARG HB3 1 1 8 3594 1 1 29 ARG HD2 H 5.399 -6.554 0.157 1.00 . A A . 29 ARG HD2 1 1 8 3595 1 1 29 ARG HD3 H 5.891 -6.662 -1.542 1.00 . A A . 29 ARG HD3 1 1 8 3596 1 1 29 ARG HE H 8.102 -7.338 -0.845 1.00 . A A . 29 ARG HE 1 1 8 3597 1 1 29 ARG HG2 H 6.988 -4.620 -1.502 1.00 . A A . 29 ARG HG2 1 1 8 3598 1 1 29 ARG HG3 H 7.402 -4.761 0.207 1.00 . A A . 29 ARG HG3 1 1 8 3599 1 1 29 ARG HH11 H 5.943 -6.741 1.826 1.00 . A A . 29 ARG HH11 1 1 8 3600 1 1 29 ARG HH12 H 6.901 -7.638 2.947 1.00 . A A . 29 ARG HH12 1 1 8 3601 1 1 29 ARG HH21 H 9.306 -8.539 0.622 1.00 . A A . 29 ARG HH21 1 1 8 3602 1 1 29 ARG HH22 H 8.785 -8.675 2.263 1.00 . A A . 29 ARG HH22 1 1 8 3603 1 1 29 ARG N N 6.471 -2.167 0.964 1.00 . A A . 29 ARG N 1 1 8 3604 1 1 29 ARG NE N 7.421 -7.144 -0.162 1.00 . A A . 29 ARG NE 1 1 8 3605 1 1 29 ARG NH1 N 6.741 -7.306 2.015 1.00 . A A . 29 ARG NH1 1 1 8 3606 1 1 29 ARG NH2 N 8.641 -8.326 1.337 1.00 . A A . 29 ARG NH2 1 1 8 3607 1 1 29 ARG O O 7.435 -4.335 2.341 1.00 . A A . 29 ARG O 1 1 8 3608 1 1 29 ARG OXT O 5.470 -5.046 2.860 1.00 . A A . 29 ARG OXT 1 1 9 3609 1 1 1 GLY C C -9.842 0.777 -5.403 1.00 . A A . 1 GLY C 1 1 9 3610 1 1 1 GLY CA C -11.073 0.491 -6.265 1.00 . A A . 1 GLY CA 1 1 9 3611 1 1 1 GLY H1 H -10.590 2.364 -7.056 1.00 . A A . 1 GLY H1 1 1 9 3612 1 1 1 GLY H2 H -12.242 1.980 -7.146 1.00 . A A . 1 GLY H2 1 1 9 3613 1 1 1 GLY H3 H -11.138 1.250 -8.210 1.00 . A A . 1 GLY H3 1 1 9 3614 1 1 1 GLY HA2 H -11.942 0.411 -5.629 1.00 . A A . 1 GLY HA2 1 1 9 3615 1 1 1 GLY HA3 H -10.930 -0.437 -6.798 1.00 . A A . 1 GLY HA3 1 1 9 3616 1 1 1 GLY N N -11.277 1.605 -7.242 1.00 . A A . 1 GLY N 1 1 9 3617 1 1 1 GLY O O -9.737 1.825 -4.793 1.00 . A A . 1 GLY O 1 1 9 3618 1 1 2 CYS C C -6.725 1.051 -5.259 1.00 . A A . 2 CYS C 1 1 9 3619 1 1 2 CYS CA C -7.675 0.095 -4.522 1.00 . A A . 2 CYS CA 1 1 9 3620 1 1 2 CYS CB C -7.026 -1.288 -4.333 1.00 . A A . 2 CYS CB 1 1 9 3621 1 1 2 CYS H H -9.006 -0.972 -5.851 1.00 . A A . 2 CYS H 1 1 9 3622 1 1 2 CYS HA H -7.944 0.506 -3.559 1.00 . A A . 2 CYS HA 1 1 9 3623 1 1 2 CYS HB2 H -6.066 -1.164 -3.859 1.00 . A A . 2 CYS HB2 1 1 9 3624 1 1 2 CYS HB3 H -7.656 -1.899 -3.701 1.00 . A A . 2 CYS HB3 1 1 9 3625 1 1 2 CYS N N -8.906 -0.138 -5.348 1.00 . A A . 2 CYS N 1 1 9 3626 1 1 2 CYS O O -6.925 1.355 -6.418 1.00 . A A . 2 CYS O 1 1 9 3627 1 1 2 CYS SG S -6.796 -2.106 -5.936 1.00 . A A . 2 CYS SG 1 1 9 3628 1 1 3 LYS C C -3.406 1.747 -5.549 1.00 . A A . 3 LYS C 1 1 9 3629 1 1 3 LYS CA C -4.741 2.452 -5.297 1.00 . A A . 3 LYS CA 1 1 9 3630 1 1 3 LYS CB C -4.535 3.644 -4.352 1.00 . A A . 3 LYS CB 1 1 9 3631 1 1 3 LYS CD C -5.665 5.700 -3.483 1.00 . A A . 3 LYS CD 1 1 9 3632 1 1 3 LYS CE C -6.874 6.145 -2.643 1.00 . A A . 3 LYS CE 1 1 9 3633 1 1 3 LYS CG C -5.885 4.278 -4.010 1.00 . A A . 3 LYS CG 1 1 9 3634 1 1 3 LYS H H -5.542 1.259 -3.675 1.00 . A A . 3 LYS H 1 1 9 3635 1 1 3 LYS HA H -5.167 2.792 -6.230 1.00 . A A . 3 LYS HA 1 1 9 3636 1 1 3 LYS HB2 H -4.045 3.313 -3.449 1.00 . A A . 3 LYS HB2 1 1 9 3637 1 1 3 LYS HB3 H -3.916 4.374 -4.846 1.00 . A A . 3 LYS HB3 1 1 9 3638 1 1 3 LYS HD2 H -4.773 5.720 -2.872 1.00 . A A . 3 LYS HD2 1 1 9 3639 1 1 3 LYS HD3 H -5.541 6.377 -4.318 1.00 . A A . 3 LYS HD3 1 1 9 3640 1 1 3 LYS HE2 H -7.115 7.181 -2.851 1.00 . A A . 3 LYS HE2 1 1 9 3641 1 1 3 LYS HE3 H -7.728 5.516 -2.843 1.00 . A A . 3 LYS HE3 1 1 9 3642 1 1 3 LYS HG2 H -6.499 4.312 -4.900 1.00 . A A . 3 LYS HG2 1 1 9 3643 1 1 3 LYS HG3 H -6.375 3.688 -3.257 1.00 . A A . 3 LYS HG3 1 1 9 3644 1 1 3 LYS HZ1 H -6.123 5.004 -1.051 1.00 . A A . 3 LYS HZ1 1 1 9 3645 1 1 3 LYS HZ2 H -7.251 6.197 -0.593 1.00 . A A . 3 LYS HZ2 1 1 9 3646 1 1 3 LYS HZ3 H -5.666 6.651 -1.009 1.00 . A A . 3 LYS HZ3 1 1 9 3647 1 1 3 LYS N N -5.692 1.521 -4.607 1.00 . A A . 3 LYS N 1 1 9 3648 1 1 3 LYS NZ N -6.448 5.989 -1.220 1.00 . A A . 3 LYS NZ 1 1 9 3649 1 1 3 LYS O O -3.208 0.613 -5.160 1.00 . A A . 3 LYS O 1 1 9 3650 1 1 4 LEU C C -0.196 2.023 -5.293 1.00 . A A . 4 LEU C 1 1 9 3651 1 1 4 LEU CA C -1.155 1.791 -6.479 1.00 . A A . 4 LEU CA 1 1 9 3652 1 1 4 LEU CB C -0.656 2.483 -7.761 1.00 . A A . 4 LEU CB 1 1 9 3653 1 1 4 LEU CD1 C -1.536 0.437 -8.943 1.00 . A A . 4 LEU CD1 1 1 9 3654 1 1 4 LEU CD2 C -2.837 2.564 -9.003 1.00 . A A . 4 LEU CD2 1 1 9 3655 1 1 4 LEU CG C -1.431 1.965 -8.986 1.00 . A A . 4 LEU CG 1 1 9 3656 1 1 4 LEU H H -2.674 3.324 -6.499 1.00 . A A . 4 LEU H 1 1 9 3657 1 1 4 LEU HA H -1.270 0.734 -6.658 1.00 . A A . 4 LEU HA 1 1 9 3658 1 1 4 LEU HB2 H -0.799 3.547 -7.671 1.00 . A A . 4 LEU HB2 1 1 9 3659 1 1 4 LEU HB3 H 0.394 2.275 -7.898 1.00 . A A . 4 LEU HB3 1 1 9 3660 1 1 4 LEU HD11 H -1.675 0.060 -9.945 1.00 . A A . 4 LEU HD11 1 1 9 3661 1 1 4 LEU HD12 H -2.377 0.151 -8.328 1.00 . A A . 4 LEU HD12 1 1 9 3662 1 1 4 LEU HD13 H -0.628 0.025 -8.528 1.00 . A A . 4 LEU HD13 1 1 9 3663 1 1 4 LEU HD21 H -3.532 1.867 -8.559 1.00 . A A . 4 LEU HD21 1 1 9 3664 1 1 4 LEU HD22 H -3.128 2.765 -10.021 1.00 . A A . 4 LEU HD22 1 1 9 3665 1 1 4 LEU HD23 H -2.840 3.485 -8.440 1.00 . A A . 4 LEU HD23 1 1 9 3666 1 1 4 LEU HG H -0.908 2.256 -9.884 1.00 . A A . 4 LEU HG 1 1 9 3667 1 1 4 LEU N N -2.487 2.413 -6.197 1.00 . A A . 4 LEU N 1 1 9 3668 1 1 4 LEU O O -0.542 1.775 -4.150 1.00 . A A . 4 LEU O 1 1 9 3669 1 1 5 THR C C 1.881 4.121 -3.874 1.00 . A A . 5 THR C 1 1 9 3670 1 1 5 THR CA C 1.973 2.684 -4.418 1.00 . A A . 5 THR CA 1 1 9 3671 1 1 5 THR CB C 3.369 2.417 -5.022 1.00 . A A . 5 THR CB 1 1 9 3672 1 1 5 THR CG2 C 4.116 1.399 -4.153 1.00 . A A . 5 THR CG2 1 1 9 3673 1 1 5 THR H H 1.296 2.656 -6.448 1.00 . A A . 5 THR H 1 1 9 3674 1 1 5 THR HA H 1.779 1.979 -3.626 1.00 . A A . 5 THR HA 1 1 9 3675 1 1 5 THR HB H 3.934 3.342 -5.042 1.00 . A A . 5 THR HB 1 1 9 3676 1 1 5 THR HG1 H 4.127 1.904 -6.748 1.00 . A A . 5 THR HG1 1 1 9 3677 1 1 5 THR HG21 H 3.788 1.488 -3.128 1.00 . A A . 5 THR HG21 1 1 9 3678 1 1 5 THR HG22 H 5.181 1.591 -4.208 1.00 . A A . 5 THR HG22 1 1 9 3679 1 1 5 THR HG23 H 3.905 0.403 -4.502 1.00 . A A . 5 THR HG23 1 1 9 3680 1 1 5 THR N N 1.011 2.475 -5.536 1.00 . A A . 5 THR N 1 1 9 3681 1 1 5 THR O O 1.384 4.354 -2.788 1.00 . A A . 5 THR O 1 1 9 3682 1 1 5 THR OG1 O 3.249 1.905 -6.352 1.00 . A A . 5 THR OG1 1 1 9 3683 1 1 6 PHE C C 0.910 7.099 -4.202 1.00 . A A . 6 PHE C 1 1 9 3684 1 1 6 PHE CA C 2.319 6.500 -4.127 1.00 . A A . 6 PHE CA 1 1 9 3685 1 1 6 PHE CB C 3.299 7.269 -5.030 1.00 . A A . 6 PHE CB 1 1 9 3686 1 1 6 PHE CD1 C 5.054 6.986 -3.236 1.00 . A A . 6 PHE CD1 1 1 9 3687 1 1 6 PHE CD2 C 4.872 9.123 -4.369 1.00 . A A . 6 PHE CD2 1 1 9 3688 1 1 6 PHE CE1 C 6.102 7.481 -2.456 1.00 . A A . 6 PHE CE1 1 1 9 3689 1 1 6 PHE CE2 C 5.925 9.626 -3.588 1.00 . A A . 6 PHE CE2 1 1 9 3690 1 1 6 PHE CG C 4.438 7.805 -4.194 1.00 . A A . 6 PHE CG 1 1 9 3691 1 1 6 PHE CZ C 6.540 8.804 -2.630 1.00 . A A . 6 PHE CZ 1 1 9 3692 1 1 6 PHE H H 2.751 4.880 -5.478 1.00 . A A . 6 PHE H 1 1 9 3693 1 1 6 PHE HA H 2.669 6.540 -3.104 1.00 . A A . 6 PHE HA 1 1 9 3694 1 1 6 PHE HB2 H 3.694 6.611 -5.788 1.00 . A A . 6 PHE HB2 1 1 9 3695 1 1 6 PHE HB3 H 2.784 8.092 -5.493 1.00 . A A . 6 PHE HB3 1 1 9 3696 1 1 6 PHE HD1 H 4.716 5.970 -3.105 1.00 . A A . 6 PHE HD1 1 1 9 3697 1 1 6 PHE HD2 H 4.399 9.756 -5.108 1.00 . A A . 6 PHE HD2 1 1 9 3698 1 1 6 PHE HE1 H 6.574 6.846 -1.719 1.00 . A A . 6 PHE HE1 1 1 9 3699 1 1 6 PHE HE2 H 6.264 10.649 -3.721 1.00 . A A . 6 PHE HE2 1 1 9 3700 1 1 6 PHE HZ H 7.354 9.192 -2.027 1.00 . A A . 6 PHE HZ 1 1 9 3701 1 1 6 PHE N N 2.359 5.085 -4.613 1.00 . A A . 6 PHE N 1 1 9 3702 1 1 6 PHE O O 0.737 8.259 -4.513 1.00 . A A . 6 PHE O 1 1 9 3703 1 1 7 TRP C C -1.900 7.109 -2.434 1.00 . A A . 7 TRP C 1 1 9 3704 1 1 7 TRP CA C -1.479 6.887 -3.886 1.00 . A A . 7 TRP CA 1 1 9 3705 1 1 7 TRP CB C -2.328 5.801 -4.530 1.00 . A A . 7 TRP CB 1 1 9 3706 1 1 7 TRP CD1 C -0.830 5.640 -6.554 1.00 . A A . 7 TRP CD1 1 1 9 3707 1 1 7 TRP CD2 C -3.002 5.816 -7.098 1.00 . A A . 7 TRP CD2 1 1 9 3708 1 1 7 TRP CE2 C -2.283 5.748 -8.313 1.00 . A A . 7 TRP CE2 1 1 9 3709 1 1 7 TRP CE3 C -4.401 5.924 -7.162 1.00 . A A . 7 TRP CE3 1 1 9 3710 1 1 7 TRP CG C -2.056 5.758 -5.997 1.00 . A A . 7 TRP CG 1 1 9 3711 1 1 7 TRP CH2 C -4.321 5.897 -9.594 1.00 . A A . 7 TRP CH2 1 1 9 3712 1 1 7 TRP CZ2 C -2.931 5.789 -9.550 1.00 . A A . 7 TRP CZ2 1 1 9 3713 1 1 7 TRP CZ3 C -5.055 5.964 -8.403 1.00 . A A . 7 TRP CZ3 1 1 9 3714 1 1 7 TRP H H 0.049 5.411 -3.598 1.00 . A A . 7 TRP H 1 1 9 3715 1 1 7 TRP HA H -1.527 7.802 -4.460 1.00 . A A . 7 TRP HA 1 1 9 3716 1 1 7 TRP HB2 H -2.080 4.848 -4.085 1.00 . A A . 7 TRP HB2 1 1 9 3717 1 1 7 TRP HB3 H -3.366 6.019 -4.359 1.00 . A A . 7 TRP HB3 1 1 9 3718 1 1 7 TRP HD1 H 0.101 5.564 -6.011 1.00 . A A . 7 TRP HD1 1 1 9 3719 1 1 7 TRP HE1 H -0.219 5.587 -8.564 1.00 . A A . 7 TRP HE1 1 1 9 3720 1 1 7 TRP HE3 H -4.978 5.972 -6.250 1.00 . A A . 7 TRP HE3 1 1 9 3721 1 1 7 TRP HH2 H -4.831 5.928 -10.545 1.00 . A A . 7 TRP HH2 1 1 9 3722 1 1 7 TRP HZ2 H -2.362 5.736 -10.466 1.00 . A A . 7 TRP HZ2 1 1 9 3723 1 1 7 TRP HZ3 H -6.130 6.045 -8.440 1.00 . A A . 7 TRP HZ3 1 1 9 3724 1 1 7 TRP N N -0.100 6.338 -3.878 1.00 . A A . 7 TRP N 1 1 9 3725 1 1 7 TRP NE1 N -0.961 5.648 -7.926 1.00 . A A . 7 TRP NE1 1 1 9 3726 1 1 7 TRP O O -2.041 6.157 -1.688 1.00 . A A . 7 TRP O 1 1 9 3727 1 1 8 LYS C C -3.363 7.553 -0.032 1.00 . A A . 8 LYS C 1 1 9 3728 1 1 8 LYS CA C -2.449 8.647 -0.599 1.00 . A A . 8 LYS CA 1 1 9 3729 1 1 8 LYS CB C -3.189 9.992 -0.644 1.00 . A A . 8 LYS CB 1 1 9 3730 1 1 8 LYS CD C -1.420 11.770 -0.730 1.00 . A A . 8 LYS CD 1 1 9 3731 1 1 8 LYS CE C -1.373 13.260 -0.356 1.00 . A A . 8 LYS CE 1 1 9 3732 1 1 8 LYS CG C -2.414 11.035 0.175 1.00 . A A . 8 LYS CG 1 1 9 3733 1 1 8 LYS H H -1.915 9.082 -2.654 1.00 . A A . 8 LYS H 1 1 9 3734 1 1 8 LYS HA H -1.563 8.737 0.009 1.00 . A A . 8 LYS HA 1 1 9 3735 1 1 8 LYS HB2 H -3.276 10.327 -1.666 1.00 . A A . 8 LYS HB2 1 1 9 3736 1 1 8 LYS HB3 H -4.176 9.871 -0.221 1.00 . A A . 8 LYS HB3 1 1 9 3737 1 1 8 LYS HD2 H -0.438 11.337 -0.605 1.00 . A A . 8 LYS HD2 1 1 9 3738 1 1 8 LYS HD3 H -1.727 11.671 -1.760 1.00 . A A . 8 LYS HD3 1 1 9 3739 1 1 8 LYS HE2 H -0.755 13.799 -1.059 1.00 . A A . 8 LYS HE2 1 1 9 3740 1 1 8 LYS HE3 H -2.371 13.674 -0.337 1.00 . A A . 8 LYS HE3 1 1 9 3741 1 1 8 LYS HG2 H -3.110 11.744 0.602 1.00 . A A . 8 LYS HG2 1 1 9 3742 1 1 8 LYS HG3 H -1.877 10.539 0.970 1.00 . A A . 8 LYS HG3 1 1 9 3743 1 1 8 LYS HZ1 H -0.439 14.274 1.202 1.00 . A A . 8 LYS HZ1 1 1 9 3744 1 1 8 LYS HZ2 H 0.028 12.646 1.064 1.00 . A A . 8 LYS HZ2 1 1 9 3745 1 1 8 LYS HZ3 H -1.489 13.043 1.716 1.00 . A A . 8 LYS HZ3 1 1 9 3746 1 1 8 LYS N N -2.065 8.344 -2.025 1.00 . A A . 8 LYS N 1 1 9 3747 1 1 8 LYS NZ N -0.773 13.308 1.009 1.00 . A A . 8 LYS NZ 1 1 9 3748 1 1 8 LYS O O -4.544 7.483 -0.341 1.00 . A A . 8 LYS O 1 1 9 3749 1 1 9 CYS C C -3.720 5.642 2.868 1.00 . A A . 9 CYS C 1 1 9 3750 1 1 9 CYS CA C -3.653 5.570 1.340 1.00 . A A . 9 CYS CA 1 1 9 3751 1 1 9 CYS CB C -2.966 4.273 0.893 1.00 . A A . 9 CYS CB 1 1 9 3752 1 1 9 CYS H H -1.860 6.742 0.990 1.00 . A A . 9 CYS H 1 1 9 3753 1 1 9 CYS HA H -4.648 5.608 0.924 1.00 . A A . 9 CYS HA 1 1 9 3754 1 1 9 CYS HB2 H -3.393 3.438 1.426 1.00 . A A . 9 CYS HB2 1 1 9 3755 1 1 9 CYS HB3 H -3.124 4.132 -0.168 1.00 . A A . 9 CYS HB3 1 1 9 3756 1 1 9 CYS N N -2.820 6.681 0.773 1.00 . A A . 9 CYS N 1 1 9 3757 1 1 9 CYS O O -3.083 6.468 3.495 1.00 . A A . 9 CYS O 1 1 9 3758 1 1 9 CYS SG S -1.184 4.348 1.232 1.00 . A A . 9 CYS SG 1 1 9 3759 1 1 10 LYS C C -4.041 3.445 5.498 1.00 . A A . 10 LYS C 1 1 9 3760 1 1 10 LYS CA C -4.618 4.763 4.958 1.00 . A A . 10 LYS CA 1 1 9 3761 1 1 10 LYS CB C -6.126 4.855 5.235 1.00 . A A . 10 LYS CB 1 1 9 3762 1 1 10 LYS CD C -8.219 6.124 4.725 1.00 . A A . 10 LYS CD 1 1 9 3763 1 1 10 LYS CE C -8.782 5.556 3.417 1.00 . A A . 10 LYS CE 1 1 9 3764 1 1 10 LYS CG C -6.691 6.158 4.653 1.00 . A A . 10 LYS CG 1 1 9 3765 1 1 10 LYS H H -5.002 4.121 2.935 1.00 . A A . 10 LYS H 1 1 9 3766 1 1 10 LYS HA H -4.104 5.610 5.390 1.00 . A A . 10 LYS HA 1 1 9 3767 1 1 10 LYS HB2 H -6.624 4.015 4.774 1.00 . A A . 10 LYS HB2 1 1 9 3768 1 1 10 LYS HB3 H -6.298 4.836 6.300 1.00 . A A . 10 LYS HB3 1 1 9 3769 1 1 10 LYS HD2 H -8.526 5.499 5.552 1.00 . A A . 10 LYS HD2 1 1 9 3770 1 1 10 LYS HD3 H -8.596 7.125 4.871 1.00 . A A . 10 LYS HD3 1 1 9 3771 1 1 10 LYS HE2 H -8.785 6.320 2.649 1.00 . A A . 10 LYS HE2 1 1 9 3772 1 1 10 LYS HE3 H -8.202 4.703 3.096 1.00 . A A . 10 LYS HE3 1 1 9 3773 1 1 10 LYS HG2 H -6.320 6.997 5.225 1.00 . A A . 10 LYS HG2 1 1 9 3774 1 1 10 LYS HG3 H -6.379 6.261 3.623 1.00 . A A . 10 LYS HG3 1 1 9 3775 1 1 10 LYS HZ1 H -10.714 5.944 4.110 1.00 . A A . 10 LYS HZ1 1 1 9 3776 1 1 10 LYS HZ2 H -10.164 4.374 4.448 1.00 . A A . 10 LYS HZ2 1 1 9 3777 1 1 10 LYS HZ3 H -10.645 4.789 2.873 1.00 . A A . 10 LYS HZ3 1 1 9 3778 1 1 10 LYS N N -4.495 4.775 3.470 1.00 . A A . 10 LYS N 1 1 9 3779 1 1 10 LYS NZ N -10.180 5.134 3.737 1.00 . A A . 10 LYS NZ 1 1 9 3780 1 1 10 LYS O O -3.080 3.433 6.238 1.00 . A A . 10 LYS O 1 1 9 3781 1 1 11 ASN C C -3.446 0.269 4.415 1.00 . A A . 11 ASN C 1 1 9 3782 1 1 11 ASN CA C -4.106 1.015 5.579 1.00 . A A . 11 ASN CA 1 1 9 3783 1 1 11 ASN CB C -5.336 0.265 6.094 1.00 . A A . 11 ASN CB 1 1 9 3784 1 1 11 ASN CG C -6.305 -0.021 4.948 1.00 . A A . 11 ASN CG 1 1 9 3785 1 1 11 ASN H H -5.384 2.372 4.499 1.00 . A A . 11 ASN H 1 1 9 3786 1 1 11 ASN HA H -3.401 1.149 6.382 1.00 . A A . 11 ASN HA 1 1 9 3787 1 1 11 ASN HB2 H -5.021 -0.668 6.534 1.00 . A A . 11 ASN HB2 1 1 9 3788 1 1 11 ASN HB3 H -5.833 0.865 6.839 1.00 . A A . 11 ASN HB3 1 1 9 3789 1 1 11 ASN HD21 H -6.191 -1.987 5.170 1.00 . A A . 11 ASN HD21 1 1 9 3790 1 1 11 ASN HD22 H -7.230 -1.453 3.942 1.00 . A A . 11 ASN HD22 1 1 9 3791 1 1 11 ASN N N -4.616 2.337 5.112 1.00 . A A . 11 ASN N 1 1 9 3792 1 1 11 ASN ND2 N -6.597 -1.256 4.659 1.00 . A A . 11 ASN ND2 1 1 9 3793 1 1 11 ASN O O -3.828 0.415 3.271 1.00 . A A . 11 ASN O 1 1 9 3794 1 1 11 ASN OD1 O -6.800 0.889 4.312 1.00 . A A . 11 ASN OD1 1 1 9 3795 1 1 12 LYS C C -2.672 -2.146 2.785 1.00 . A A . 12 LYS C 1 1 9 3796 1 1 12 LYS CA C -1.728 -1.258 3.620 1.00 . A A . 12 LYS CA 1 1 9 3797 1 1 12 LYS CB C -0.690 -2.114 4.360 1.00 . A A . 12 LYS CB 1 1 9 3798 1 1 12 LYS CD C -0.346 -3.808 6.182 1.00 . A A . 12 LYS CD 1 1 9 3799 1 1 12 LYS CE C -0.045 -2.988 7.450 1.00 . A A . 12 LYS CE 1 1 9 3800 1 1 12 LYS CG C -1.392 -3.079 5.323 1.00 . A A . 12 LYS CG 1 1 9 3801 1 1 12 LYS H H -2.150 -0.598 5.628 1.00 . A A . 12 LYS H 1 1 9 3802 1 1 12 LYS HA H -1.218 -0.560 2.977 1.00 . A A . 12 LYS HA 1 1 9 3803 1 1 12 LYS HB2 H -0.116 -2.677 3.642 1.00 . A A . 12 LYS HB2 1 1 9 3804 1 1 12 LYS HB3 H -0.027 -1.472 4.920 1.00 . A A . 12 LYS HB3 1 1 9 3805 1 1 12 LYS HD2 H -0.731 -4.779 6.462 1.00 . A A . 12 LYS HD2 1 1 9 3806 1 1 12 LYS HD3 H 0.563 -3.935 5.612 1.00 . A A . 12 LYS HD3 1 1 9 3807 1 1 12 LYS HE2 H 0.970 -3.170 7.782 1.00 . A A . 12 LYS HE2 1 1 9 3808 1 1 12 LYS HE3 H -0.194 -1.935 7.264 1.00 . A A . 12 LYS HE3 1 1 9 3809 1 1 12 LYS HG2 H -2.060 -2.525 5.962 1.00 . A A . 12 LYS HG2 1 1 9 3810 1 1 12 LYS HG3 H -1.957 -3.806 4.755 1.00 . A A . 12 LYS HG3 1 1 9 3811 1 1 12 LYS HZ1 H -0.828 -4.466 8.703 1.00 . A A . 12 LYS HZ1 1 1 9 3812 1 1 12 LYS HZ2 H -1.991 -3.390 8.097 1.00 . A A . 12 LYS HZ2 1 1 9 3813 1 1 12 LYS HZ3 H -0.942 -2.894 9.334 1.00 . A A . 12 LYS HZ3 1 1 9 3814 1 1 12 LYS N N -2.445 -0.513 4.700 1.00 . A A . 12 LYS N 1 1 9 3815 1 1 12 LYS NZ N -1.024 -3.471 8.472 1.00 . A A . 12 LYS NZ 1 1 9 3816 1 1 12 LYS O O -2.349 -2.513 1.675 1.00 . A A . 12 LYS O 1 1 9 3817 1 1 13 LYS C C -5.636 -2.595 1.556 1.00 . A A . 13 LYS C 1 1 9 3818 1 1 13 LYS CA C -4.743 -3.396 2.522 1.00 . A A . 13 LYS CA 1 1 9 3819 1 1 13 LYS CB C -5.591 -4.110 3.581 1.00 . A A . 13 LYS CB 1 1 9 3820 1 1 13 LYS CD C -6.795 -6.131 2.692 1.00 . A A . 13 LYS CD 1 1 9 3821 1 1 13 LYS CE C -7.426 -7.246 3.536 1.00 . A A . 13 LYS CE 1 1 9 3822 1 1 13 LYS CG C -5.511 -5.627 3.369 1.00 . A A . 13 LYS CG 1 1 9 3823 1 1 13 LYS H H -4.067 -2.220 4.207 1.00 . A A . 13 LYS H 1 1 9 3824 1 1 13 LYS HA H -4.170 -4.120 1.971 1.00 . A A . 13 LYS HA 1 1 9 3825 1 1 13 LYS HB2 H -5.215 -3.863 4.566 1.00 . A A . 13 LYS HB2 1 1 9 3826 1 1 13 LYS HB3 H -6.616 -3.784 3.499 1.00 . A A . 13 LYS HB3 1 1 9 3827 1 1 13 LYS HD2 H -7.499 -5.316 2.600 1.00 . A A . 13 LYS HD2 1 1 9 3828 1 1 13 LYS HD3 H -6.559 -6.517 1.710 1.00 . A A . 13 LYS HD3 1 1 9 3829 1 1 13 LYS HE2 H -6.657 -7.900 3.930 1.00 . A A . 13 LYS HE2 1 1 9 3830 1 1 13 LYS HE3 H -8.004 -6.821 4.342 1.00 . A A . 13 LYS HE3 1 1 9 3831 1 1 13 LYS HG2 H -4.663 -5.861 2.742 1.00 . A A . 13 LYS HG2 1 1 9 3832 1 1 13 LYS HG3 H -5.395 -6.117 4.326 1.00 . A A . 13 LYS HG3 1 1 9 3833 1 1 13 LYS HZ1 H -7.751 -8.509 1.907 1.00 . A A . 13 LYS HZ1 1 1 9 3834 1 1 13 LYS HZ2 H -8.958 -7.330 2.120 1.00 . A A . 13 LYS HZ2 1 1 9 3835 1 1 13 LYS HZ3 H -8.890 -8.678 3.150 1.00 . A A . 13 LYS HZ3 1 1 9 3836 1 1 13 LYS N N -3.820 -2.512 3.305 1.00 . A A . 13 LYS N 1 1 9 3837 1 1 13 LYS NZ N -8.321 -7.996 2.606 1.00 . A A . 13 LYS NZ 1 1 9 3838 1 1 13 LYS O O -6.527 -3.152 0.938 1.00 . A A . 13 LYS O 1 1 9 3839 1 1 14 GLU C C -5.595 -0.372 -0.909 1.00 . A A . 14 GLU C 1 1 9 3840 1 1 14 GLU CA C -6.277 -0.527 0.463 1.00 . A A . 14 GLU CA 1 1 9 3841 1 1 14 GLU CB C -6.515 0.841 1.140 1.00 . A A . 14 GLU CB 1 1 9 3842 1 1 14 GLU CD C -5.823 3.181 0.637 1.00 . A A . 14 GLU CD 1 1 9 3843 1 1 14 GLU CG C -5.313 1.777 0.931 1.00 . A A . 14 GLU CG 1 1 9 3844 1 1 14 GLU H H -4.700 -0.863 1.900 1.00 . A A . 14 GLU H 1 1 9 3845 1 1 14 GLU HA H -7.222 -1.033 0.335 1.00 . A A . 14 GLU HA 1 1 9 3846 1 1 14 GLU HB2 H -7.397 1.298 0.715 1.00 . A A . 14 GLU HB2 1 1 9 3847 1 1 14 GLU HB3 H -6.672 0.694 2.199 1.00 . A A . 14 GLU HB3 1 1 9 3848 1 1 14 GLU HG2 H -4.708 1.793 1.824 1.00 . A A . 14 GLU HG2 1 1 9 3849 1 1 14 GLU HG3 H -4.723 1.431 0.099 1.00 . A A . 14 GLU HG3 1 1 9 3850 1 1 14 GLU N N -5.419 -1.309 1.405 1.00 . A A . 14 GLU N 1 1 9 3851 1 1 14 GLU O O -6.229 -0.012 -1.884 1.00 . A A . 14 GLU O 1 1 9 3852 1 1 14 GLU OE1 O -6.275 3.835 1.559 1.00 . A A . 14 GLU OE1 1 1 9 3853 1 1 14 GLU OE2 O -5.744 3.592 -0.510 1.00 . A A . 14 GLU OE2 1 1 9 3854 1 1 15 CYS C C -3.726 -1.802 -3.125 1.00 . A A . 15 CYS C 1 1 9 3855 1 1 15 CYS CA C -3.626 -0.501 -2.324 1.00 . A A . 15 CYS CA 1 1 9 3856 1 1 15 CYS CB C -2.159 -0.197 -1.988 1.00 . A A . 15 CYS CB 1 1 9 3857 1 1 15 CYS H H -3.808 -0.938 -0.219 1.00 . A A . 15 CYS H 1 1 9 3858 1 1 15 CYS HA H -4.053 0.317 -2.883 1.00 . A A . 15 CYS HA 1 1 9 3859 1 1 15 CYS HB2 H -1.784 -0.956 -1.318 1.00 . A A . 15 CYS HB2 1 1 9 3860 1 1 15 CYS HB3 H -1.572 -0.196 -2.896 1.00 . A A . 15 CYS HB3 1 1 9 3861 1 1 15 CYS N N -4.317 -0.642 -1.005 1.00 . A A . 15 CYS N 1 1 9 3862 1 1 15 CYS O O -3.930 -2.872 -2.575 1.00 . A A . 15 CYS O 1 1 9 3863 1 1 15 CYS SG S -2.048 1.429 -1.193 1.00 . A A . 15 CYS SG 1 1 9 3864 1 1 16 CYS C C -2.307 -3.728 -5.129 1.00 . A A . 16 CYS C 1 1 9 3865 1 1 16 CYS CA C -3.640 -2.975 -5.242 1.00 . A A . 16 CYS CA 1 1 9 3866 1 1 16 CYS CB C -3.880 -2.512 -6.684 1.00 . A A . 16 CYS CB 1 1 9 3867 1 1 16 CYS H H -3.405 -0.859 -4.847 1.00 . A A . 16 CYS H 1 1 9 3868 1 1 16 CYS HA H -4.454 -3.597 -4.908 1.00 . A A . 16 CYS HA 1 1 9 3869 1 1 16 CYS HB2 H -2.959 -2.114 -7.090 1.00 . A A . 16 CYS HB2 1 1 9 3870 1 1 16 CYS HB3 H -4.199 -3.351 -7.279 1.00 . A A . 16 CYS HB3 1 1 9 3871 1 1 16 CYS N N -3.575 -1.730 -4.419 1.00 . A A . 16 CYS N 1 1 9 3872 1 1 16 CYS O O -1.254 -3.183 -5.414 1.00 . A A . 16 CYS O 1 1 9 3873 1 1 16 CYS SG S -5.163 -1.228 -6.726 1.00 . A A . 16 CYS SG 1 1 9 3874 1 1 17 GLY C C -0.440 -5.350 -3.211 1.00 . A A . 17 GLY C 1 1 9 3875 1 1 17 GLY CA C -1.068 -5.728 -4.554 1.00 . A A . 17 GLY CA 1 1 9 3876 1 1 17 GLY H H -3.187 -5.378 -4.460 1.00 . A A . 17 GLY H 1 1 9 3877 1 1 17 GLY HA2 H -1.276 -6.791 -4.584 1.00 . A A . 17 GLY HA2 1 1 9 3878 1 1 17 GLY HA3 H -0.391 -5.466 -5.352 1.00 . A A . 17 GLY HA3 1 1 9 3879 1 1 17 GLY N N -2.337 -4.961 -4.701 1.00 . A A . 17 GLY N 1 1 9 3880 1 1 17 GLY O O 0.340 -4.425 -3.138 1.00 . A A . 17 GLY O 1 1 9 3881 1 1 18 TRP C C 0.818 -4.759 -0.734 1.00 . A A . 18 TRP C 1 1 9 3882 1 1 18 TRP CA C -0.329 -5.770 -0.766 1.00 . A A . 18 TRP CA 1 1 9 3883 1 1 18 TRP CB C 0.140 -7.128 -0.238 1.00 . A A . 18 TRP CB 1 1 9 3884 1 1 18 TRP CD1 C -1.294 -6.649 1.810 1.00 . A A . 18 TRP CD1 1 1 9 3885 1 1 18 TRP CD2 C -0.816 -8.842 1.570 1.00 . A A . 18 TRP CD2 1 1 9 3886 1 1 18 TRP CE2 C -1.613 -8.726 2.731 1.00 . A A . 18 TRP CE2 1 1 9 3887 1 1 18 TRP CE3 C -0.374 -10.125 1.193 1.00 . A A . 18 TRP CE3 1 1 9 3888 1 1 18 TRP CG C -0.628 -7.508 0.997 1.00 . A A . 18 TRP CG 1 1 9 3889 1 1 18 TRP CH2 C -1.509 -11.110 3.103 1.00 . A A . 18 TRP CH2 1 1 9 3890 1 1 18 TRP CZ2 C -1.958 -9.843 3.494 1.00 . A A . 18 TRP CZ2 1 1 9 3891 1 1 18 TRP CZ3 C -0.722 -11.250 1.956 1.00 . A A . 18 TRP CZ3 1 1 9 3892 1 1 18 TRP H H -1.486 -6.756 -2.289 1.00 . A A . 18 TRP H 1 1 9 3893 1 1 18 TRP HA H -1.144 -5.413 -0.162 1.00 . A A . 18 TRP HA 1 1 9 3894 1 1 18 TRP HB2 H -0.017 -7.877 -0.995 1.00 . A A . 18 TRP HB2 1 1 9 3895 1 1 18 TRP HB3 H 1.193 -7.070 -0.002 1.00 . A A . 18 TRP HB3 1 1 9 3896 1 1 18 TRP HD1 H -1.364 -5.574 1.677 1.00 . A A . 18 TRP HD1 1 1 9 3897 1 1 18 TRP HE1 H -2.424 -6.985 3.558 1.00 . A A . 18 TRP HE1 1 1 9 3898 1 1 18 TRP HE3 H 0.235 -10.243 0.306 1.00 . A A . 18 TRP HE3 1 1 9 3899 1 1 18 TRP HH2 H -1.773 -11.983 3.688 1.00 . A A . 18 TRP HH2 1 1 9 3900 1 1 18 TRP HZ2 H -2.568 -9.730 4.380 1.00 . A A . 18 TRP HZ2 1 1 9 3901 1 1 18 TRP HZ3 H -0.378 -12.230 1.661 1.00 . A A . 18 TRP HZ3 1 1 9 3902 1 1 18 TRP N N -0.828 -6.046 -2.161 1.00 . A A . 18 TRP N 1 1 9 3903 1 1 18 TRP NE1 N -1.881 -7.370 2.834 1.00 . A A . 18 TRP NE1 1 1 9 3904 1 1 18 TRP O O 1.966 -5.097 -0.943 1.00 . A A . 18 TRP O 1 1 9 3905 1 1 19 ASN C C 1.460 -1.715 0.937 1.00 . A A . 19 ASN C 1 1 9 3906 1 1 19 ASN CA C 1.569 -2.464 -0.396 1.00 . A A . 19 ASN CA 1 1 9 3907 1 1 19 ASN CB C 1.268 -1.527 -1.567 1.00 . A A . 19 ASN CB 1 1 9 3908 1 1 19 ASN CG C 2.578 -1.037 -2.198 1.00 . A A . 19 ASN CG 1 1 9 3909 1 1 19 ASN H H -0.432 -3.278 -0.285 1.00 . A A . 19 ASN H 1 1 9 3910 1 1 19 ASN HA H 2.555 -2.907 -0.512 1.00 . A A . 19 ASN HA 1 1 9 3911 1 1 19 ASN HB2 H 0.686 -2.054 -2.306 1.00 . A A . 19 ASN HB2 1 1 9 3912 1 1 19 ASN HB3 H 0.710 -0.674 -1.208 1.00 . A A . 19 ASN HB3 1 1 9 3913 1 1 19 ASN HD21 H 3.289 -0.294 -0.492 1.00 . A A . 19 ASN HD21 1 1 9 3914 1 1 19 ASN HD22 H 4.299 -0.105 -1.843 1.00 . A A . 19 ASN HD22 1 1 9 3915 1 1 19 ASN N N 0.507 -3.517 -0.460 1.00 . A A . 19 ASN N 1 1 9 3916 1 1 19 ASN ND2 N 3.463 -0.431 -1.448 1.00 . A A . 19 ASN ND2 1 1 9 3917 1 1 19 ASN O O 0.414 -1.191 1.279 1.00 . A A . 19 ASN O 1 1 9 3918 1 1 19 ASN OD1 O 2.797 -1.205 -3.381 1.00 . A A . 19 ASN OD1 1 1 9 3919 1 1 20 ALA C C 2.248 0.500 2.898 1.00 . A A . 20 ALA C 1 1 9 3920 1 1 20 ALA CA C 2.454 -1.005 3.030 1.00 . A A . 20 ALA CA 1 1 9 3921 1 1 20 ALA CB C 3.809 -1.284 3.659 1.00 . A A . 20 ALA CB 1 1 9 3922 1 1 20 ALA H H 3.346 -2.127 1.418 1.00 . A A . 20 ALA H 1 1 9 3923 1 1 20 ALA HA H 1.678 -1.436 3.639 1.00 . A A . 20 ALA HA 1 1 9 3924 1 1 20 ALA HB1 H 4.049 -2.329 3.541 1.00 . A A . 20 ALA HB1 1 1 9 3925 1 1 20 ALA HB2 H 3.774 -1.033 4.704 1.00 . A A . 20 ALA HB2 1 1 9 3926 1 1 20 ALA HB3 H 4.562 -0.686 3.163 1.00 . A A . 20 ALA HB3 1 1 9 3927 1 1 20 ALA N N 2.512 -1.681 1.702 1.00 . A A . 20 ALA N 1 1 9 3928 1 1 20 ALA O O 3.060 1.203 2.322 1.00 . A A . 20 ALA O 1 1 9 3929 1 1 21 CYS C C 1.813 3.075 4.584 1.00 . A A . 21 CYS C 1 1 9 3930 1 1 21 CYS CA C 0.971 2.483 3.444 1.00 . A A . 21 CYS CA 1 1 9 3931 1 1 21 CYS CB C -0.533 2.663 3.686 1.00 . A A . 21 CYS CB 1 1 9 3932 1 1 21 CYS H H 0.580 0.435 3.972 1.00 . A A . 21 CYS H 1 1 9 3933 1 1 21 CYS HA H 1.257 2.888 2.488 1.00 . A A . 21 CYS HA 1 1 9 3934 1 1 21 CYS HB2 H -1.084 1.961 3.080 1.00 . A A . 21 CYS HB2 1 1 9 3935 1 1 21 CYS HB3 H -0.750 2.485 4.728 1.00 . A A . 21 CYS HB3 1 1 9 3936 1 1 21 CYS N N 1.196 1.012 3.477 1.00 . A A . 21 CYS N 1 1 9 3937 1 1 21 CYS O O 1.380 3.148 5.718 1.00 . A A . 21 CYS O 1 1 9 3938 1 1 21 CYS SG S -1.029 4.353 3.247 1.00 . A A . 21 CYS SG 1 1 9 3939 1 1 22 ALA C C 4.256 5.420 5.274 1.00 . A A . 22 ALA C 1 1 9 3940 1 1 22 ALA CA C 3.956 3.922 5.380 1.00 . A A . 22 ALA CA 1 1 9 3941 1 1 22 ALA CB C 5.239 3.109 5.172 1.00 . A A . 22 ALA CB 1 1 9 3942 1 1 22 ALA H H 3.386 3.299 3.388 1.00 . A A . 22 ALA H 1 1 9 3943 1 1 22 ALA HA H 3.543 3.700 6.353 1.00 . A A . 22 ALA HA 1 1 9 3944 1 1 22 ALA HB1 H 5.469 3.061 4.111 1.00 . A A . 22 ALA HB1 1 1 9 3945 1 1 22 ALA HB2 H 5.097 2.107 5.551 1.00 . A A . 22 ALA HB2 1 1 9 3946 1 1 22 ALA HB3 H 6.056 3.580 5.695 1.00 . A A . 22 ALA HB3 1 1 9 3947 1 1 22 ALA N N 3.043 3.424 4.300 1.00 . A A . 22 ALA N 1 1 9 3948 1 1 22 ALA O O 3.849 6.198 6.118 1.00 . A A . 22 ALA O 1 1 9 3949 1 1 23 LEU C C 4.140 8.090 3.674 1.00 . A A . 23 LEU C 1 1 9 3950 1 1 23 LEU CA C 5.352 7.276 4.151 1.00 . A A . 23 LEU CA 1 1 9 3951 1 1 23 LEU CB C 6.505 7.351 3.111 1.00 . A A . 23 LEU CB 1 1 9 3952 1 1 23 LEU CD1 C 8.598 6.288 2.220 1.00 . A A . 23 LEU CD1 1 1 9 3953 1 1 23 LEU CD2 C 7.899 5.807 4.556 1.00 . A A . 23 LEU CD2 1 1 9 3954 1 1 23 LEU CG C 7.394 6.084 3.135 1.00 . A A . 23 LEU CG 1 1 9 3955 1 1 23 LEU H H 5.316 5.175 3.629 1.00 . A A . 23 LEU H 1 1 9 3956 1 1 23 LEU HA H 5.700 7.650 5.101 1.00 . A A . 23 LEU HA 1 1 9 3957 1 1 23 LEU HB2 H 6.086 7.468 2.123 1.00 . A A . 23 LEU HB2 1 1 9 3958 1 1 23 LEU HB3 H 7.117 8.211 3.336 1.00 . A A . 23 LEU HB3 1 1 9 3959 1 1 23 LEU HD11 H 9.287 6.981 2.679 1.00 . A A . 23 LEU HD11 1 1 9 3960 1 1 23 LEU HD12 H 8.262 6.686 1.272 1.00 . A A . 23 LEU HD12 1 1 9 3961 1 1 23 LEU HD13 H 9.091 5.341 2.061 1.00 . A A . 23 LEU HD13 1 1 9 3962 1 1 23 LEU HD21 H 7.112 6.015 5.265 1.00 . A A . 23 LEU HD21 1 1 9 3963 1 1 23 LEU HD22 H 8.749 6.439 4.767 1.00 . A A . 23 LEU HD22 1 1 9 3964 1 1 23 LEU HD23 H 8.191 4.768 4.636 1.00 . A A . 23 LEU HD23 1 1 9 3965 1 1 23 LEU HG H 6.829 5.237 2.781 1.00 . A A . 23 LEU HG 1 1 9 3966 1 1 23 LEU N N 4.987 5.824 4.277 1.00 . A A . 23 LEU N 1 1 9 3967 1 1 23 LEU O O 4.210 8.792 2.683 1.00 . A A . 23 LEU O 1 1 9 3968 1 1 24 GLY C C 1.217 8.108 2.649 1.00 . A A . 24 GLY C 1 1 9 3969 1 1 24 GLY CA C 1.802 8.744 3.922 1.00 . A A . 24 GLY CA 1 1 9 3970 1 1 24 GLY H H 2.978 7.411 5.149 1.00 . A A . 24 GLY H 1 1 9 3971 1 1 24 GLY HA2 H 1.064 8.721 4.713 1.00 . A A . 24 GLY HA2 1 1 9 3972 1 1 24 GLY HA3 H 2.070 9.771 3.710 1.00 . A A . 24 GLY HA3 1 1 9 3973 1 1 24 GLY N N 3.023 7.992 4.357 1.00 . A A . 24 GLY N 1 1 9 3974 1 1 24 GLY O O 0.211 8.559 2.132 1.00 . A A . 24 GLY O 1 1 9 3975 1 1 25 ILE C C 1.774 4.941 0.907 1.00 . A A . 25 ILE C 1 1 9 3976 1 1 25 ILE CA C 1.321 6.401 0.911 1.00 . A A . 25 ILE CA 1 1 9 3977 1 1 25 ILE CB C 1.949 7.135 -0.289 1.00 . A A . 25 ILE CB 1 1 9 3978 1 1 25 ILE CD1 C 3.180 9.159 -1.093 1.00 . A A . 25 ILE CD1 1 1 9 3979 1 1 25 ILE CG1 C 2.649 8.437 0.139 1.00 . A A . 25 ILE CG1 1 1 9 3980 1 1 25 ILE CG2 C 0.867 7.464 -1.306 1.00 . A A . 25 ILE CG2 1 1 9 3981 1 1 25 ILE H H 2.634 6.715 2.580 1.00 . A A . 25 ILE H 1 1 9 3982 1 1 25 ILE HA H 0.245 6.462 0.870 1.00 . A A . 25 ILE HA 1 1 9 3983 1 1 25 ILE HB H 2.664 6.478 -0.751 1.00 . A A . 25 ILE HB 1 1 9 3984 1 1 25 ILE HD11 H 2.352 9.558 -1.660 1.00 . A A . 25 ILE HD11 1 1 9 3985 1 1 25 ILE HD12 H 3.735 8.465 -1.704 1.00 . A A . 25 ILE HD12 1 1 9 3986 1 1 25 ILE HD13 H 3.826 9.966 -0.781 1.00 . A A . 25 ILE HD13 1 1 9 3987 1 1 25 ILE HG12 H 1.945 9.077 0.646 1.00 . A A . 25 ILE HG12 1 1 9 3988 1 1 25 ILE HG13 H 3.470 8.207 0.794 1.00 . A A . 25 ILE HG13 1 1 9 3989 1 1 25 ILE HG21 H 0.504 6.550 -1.747 1.00 . A A . 25 ILE HG21 1 1 9 3990 1 1 25 ILE HG22 H 1.281 8.099 -2.072 1.00 . A A . 25 ILE HG22 1 1 9 3991 1 1 25 ILE HG23 H 0.053 7.974 -0.813 1.00 . A A . 25 ILE HG23 1 1 9 3992 1 1 25 ILE N N 1.832 7.064 2.146 1.00 . A A . 25 ILE N 1 1 9 3993 1 1 25 ILE O O 2.432 4.490 1.830 1.00 . A A . 25 ILE O 1 1 9 3994 1 1 26 CYS C C 3.339 2.723 -0.739 1.00 . A A . 26 CYS C 1 1 9 3995 1 1 26 CYS CA C 1.917 2.777 -0.175 1.00 . A A . 26 CYS CA 1 1 9 3996 1 1 26 CYS CB C 0.913 2.051 -1.084 1.00 . A A . 26 CYS CB 1 1 9 3997 1 1 26 CYS H H 0.958 4.586 -0.883 1.00 . A A . 26 CYS H 1 1 9 3998 1 1 26 CYS HA H 1.896 2.344 0.814 1.00 . A A . 26 CYS HA 1 1 9 3999 1 1 26 CYS HB2 H 0.476 2.749 -1.779 1.00 . A A . 26 CYS HB2 1 1 9 4000 1 1 26 CYS HB3 H 1.417 1.264 -1.633 1.00 . A A . 26 CYS HB3 1 1 9 4001 1 1 26 CYS N N 1.464 4.201 -0.126 1.00 . A A . 26 CYS N 1 1 9 4002 1 1 26 CYS O O 3.593 3.178 -1.839 1.00 . A A . 26 CYS O 1 1 9 4003 1 1 26 CYS SG S -0.385 1.325 -0.050 1.00 . A A . 26 CYS SG 1 1 9 4004 1 1 27 MET C C 6.431 0.900 -0.095 1.00 . A A . 27 MET C 1 1 9 4005 1 1 27 MET CA C 5.674 2.165 -0.535 1.00 . A A . 27 MET CA 1 1 9 4006 1 1 27 MET CB C 6.332 3.429 0.015 1.00 . A A . 27 MET CB 1 1 9 4007 1 1 27 MET CE C 8.012 3.217 -2.545 1.00 . A A . 27 MET CE 1 1 9 4008 1 1 27 MET CG C 6.203 4.555 -0.997 1.00 . A A . 27 MET CG 1 1 9 4009 1 1 27 MET H H 4.087 1.850 0.894 1.00 . A A . 27 MET H 1 1 9 4010 1 1 27 MET HA H 5.647 2.219 -1.606 1.00 . A A . 27 MET HA 1 1 9 4011 1 1 27 MET HB2 H 5.836 3.724 0.929 1.00 . A A . 27 MET HB2 1 1 9 4012 1 1 27 MET HB3 H 7.373 3.241 0.212 1.00 . A A . 27 MET HB3 1 1 9 4013 1 1 27 MET HE1 H 7.090 2.926 -3.028 1.00 . A A . 27 MET HE1 1 1 9 4014 1 1 27 MET HE2 H 8.264 2.491 -1.786 1.00 . A A . 27 MET HE2 1 1 9 4015 1 1 27 MET HE3 H 8.806 3.260 -3.276 1.00 . A A . 27 MET HE3 1 1 9 4016 1 1 27 MET HG2 H 5.470 4.287 -1.746 1.00 . A A . 27 MET HG2 1 1 9 4017 1 1 27 MET HG3 H 5.882 5.450 -0.488 1.00 . A A . 27 MET HG3 1 1 9 4018 1 1 27 MET N N 4.285 2.199 -0.002 1.00 . A A . 27 MET N 1 1 9 4019 1 1 27 MET O O 6.707 0.060 -0.915 1.00 . A A . 27 MET O 1 1 9 4020 1 1 27 MET SD S 7.810 4.846 -1.784 1.00 . A A . 27 MET SD 1 1 9 4021 1 1 28 PRO C C 6.648 -1.621 1.684 1.00 . A A . 28 PRO C 1 1 9 4022 1 1 28 PRO CA C 7.522 -0.359 1.698 1.00 . A A . 28 PRO CA 1 1 9 4023 1 1 28 PRO CB C 7.902 0.062 3.119 1.00 . A A . 28 PRO CB 1 1 9 4024 1 1 28 PRO CD C 6.462 1.787 2.241 1.00 . A A . 28 PRO CD 1 1 9 4025 1 1 28 PRO CG C 6.872 1.076 3.505 1.00 . A A . 28 PRO CG 1 1 9 4026 1 1 28 PRO HA H 8.415 -0.514 1.118 1.00 . A A . 28 PRO HA 1 1 9 4027 1 1 28 PRO HB2 H 7.875 -0.788 3.791 1.00 . A A . 28 PRO HB2 1 1 9 4028 1 1 28 PRO HB3 H 8.885 0.517 3.126 1.00 . A A . 28 PRO HB3 1 1 9 4029 1 1 28 PRO HD2 H 5.404 2.021 2.263 1.00 . A A . 28 PRO HD2 1 1 9 4030 1 1 28 PRO HD3 H 7.043 2.687 2.096 1.00 . A A . 28 PRO HD3 1 1 9 4031 1 1 28 PRO HG2 H 6.023 0.576 3.947 1.00 . A A . 28 PRO HG2 1 1 9 4032 1 1 28 PRO HG3 H 7.289 1.785 4.207 1.00 . A A . 28 PRO HG3 1 1 9 4033 1 1 28 PRO N N 6.761 0.816 1.178 1.00 . A A . 28 PRO N 1 1 9 4034 1 1 28 PRO O O 6.230 -2.093 2.721 1.00 . A A . 28 PRO O 1 1 9 4035 1 1 29 ARG C C 5.191 -4.082 1.618 1.00 . A A . 29 ARG C 1 1 9 4036 1 1 29 ARG CA C 5.528 -3.374 0.296 1.00 . A A . 29 ARG CA 1 1 9 4037 1 1 29 ARG CB C 6.357 -4.316 -0.600 1.00 . A A . 29 ARG CB 1 1 9 4038 1 1 29 ARG CD C 5.856 -2.902 -2.643 1.00 . A A . 29 ARG CD 1 1 9 4039 1 1 29 ARG CG C 6.962 -3.555 -1.784 1.00 . A A . 29 ARG CG 1 1 9 4040 1 1 29 ARG CZ C 6.894 -3.064 -4.850 1.00 . A A . 29 ARG CZ 1 1 9 4041 1 1 29 ARG H H 6.749 -1.688 -0.293 1.00 . A A . 29 ARG H 1 1 9 4042 1 1 29 ARG HA H 4.616 -3.108 -0.214 1.00 . A A . 29 ARG HA 1 1 9 4043 1 1 29 ARG HB2 H 7.158 -4.753 -0.017 1.00 . A A . 29 ARG HB2 1 1 9 4044 1 1 29 ARG HB3 H 5.721 -5.104 -0.971 1.00 . A A . 29 ARG HB3 1 1 9 4045 1 1 29 ARG HD2 H 5.137 -3.645 -2.970 1.00 . A A . 29 ARG HD2 1 1 9 4046 1 1 29 ARG HD3 H 5.359 -2.119 -2.092 1.00 . A A . 29 ARG HD3 1 1 9 4047 1 1 29 ARG HE H 6.814 -1.368 -3.808 1.00 . A A . 29 ARG HE 1 1 9 4048 1 1 29 ARG HG2 H 7.627 -2.791 -1.409 1.00 . A A . 29 ARG HG2 1 1 9 4049 1 1 29 ARG HG3 H 7.524 -4.249 -2.387 1.00 . A A . 29 ARG HG3 1 1 9 4050 1 1 29 ARG HH11 H 6.063 -4.759 -4.145 1.00 . A A . 29 ARG HH11 1 1 9 4051 1 1 29 ARG HH12 H 6.810 -4.890 -5.696 1.00 . A A . 29 ARG HH12 1 1 9 4052 1 1 29 ARG HH21 H 7.805 -1.582 -5.829 1.00 . A A . 29 ARG HH21 1 1 9 4053 1 1 29 ARG HH22 H 7.783 -3.109 -6.640 1.00 . A A . 29 ARG HH22 1 1 9 4054 1 1 29 ARG N N 6.382 -2.139 0.497 1.00 . A A . 29 ARG N 1 1 9 4055 1 1 29 ARG NE N 6.574 -2.320 -3.815 1.00 . A A . 29 ARG NE 1 1 9 4056 1 1 29 ARG NH1 N 6.562 -4.335 -4.898 1.00 . A A . 29 ARG NH1 1 1 9 4057 1 1 29 ARG NH2 N 7.544 -2.546 -5.848 1.00 . A A . 29 ARG NH2 1 1 9 4058 1 1 29 ARG O O 4.069 -3.939 2.074 1.00 . A A . 29 ARG O 1 1 9 4059 1 1 29 ARG OXT O 6.055 -4.763 2.144 1.00 . A A . 29 ARG OXT 1 1 10 4060 1 1 1 GLY C C -8.951 2.040 -2.702 1.00 . A A . 1 GLY C 1 1 10 4061 1 1 1 GLY CA C -10.257 2.720 -2.286 1.00 . A A . 1 GLY CA 1 1 10 4062 1 1 1 GLY H1 H -10.798 3.603 -0.482 1.00 . A A . 1 GLY H1 1 1 10 4063 1 1 1 GLY H2 H -9.417 2.615 -0.376 1.00 . A A . 1 GLY H2 1 1 10 4064 1 1 1 GLY H3 H -10.963 1.919 -0.499 1.00 . A A . 1 GLY H3 1 1 10 4065 1 1 1 GLY HA2 H -11.095 2.190 -2.710 1.00 . A A . 1 GLY HA2 1 1 10 4066 1 1 1 GLY HA3 H -10.258 3.738 -2.640 1.00 . A A . 1 GLY HA3 1 1 10 4067 1 1 1 GLY N N -10.369 2.713 -0.800 1.00 . A A . 1 GLY N 1 1 10 4068 1 1 1 GLY O O -7.882 2.445 -2.294 1.00 . A A . 1 GLY O 1 1 10 4069 1 1 2 CYS C C -6.904 1.204 -4.829 1.00 . A A . 2 CYS C 1 1 10 4070 1 1 2 CYS CA C -7.784 0.300 -3.950 1.00 . A A . 2 CYS CA 1 1 10 4071 1 1 2 CYS CB C -8.283 -0.903 -4.756 1.00 . A A . 2 CYS CB 1 1 10 4072 1 1 2 CYS H H -9.900 0.706 -3.829 1.00 . A A . 2 CYS H 1 1 10 4073 1 1 2 CYS HA H -7.232 -0.041 -3.090 1.00 . A A . 2 CYS HA 1 1 10 4074 1 1 2 CYS HB2 H -9.253 -1.201 -4.394 1.00 . A A . 2 CYS HB2 1 1 10 4075 1 1 2 CYS HB3 H -8.364 -0.627 -5.799 1.00 . A A . 2 CYS HB3 1 1 10 4076 1 1 2 CYS N N -9.025 1.013 -3.511 1.00 . A A . 2 CYS N 1 1 10 4077 1 1 2 CYS O O -7.366 1.785 -5.793 1.00 . A A . 2 CYS O 1 1 10 4078 1 1 2 CYS SG S -7.121 -2.287 -4.579 1.00 . A A . 2 CYS SG 1 1 10 4079 1 1 3 LYS C C -3.363 1.510 -5.506 1.00 . A A . 3 LYS C 1 1 10 4080 1 1 3 LYS CA C -4.722 2.189 -5.320 1.00 . A A . 3 LYS CA 1 1 10 4081 1 1 3 LYS CB C -4.548 3.485 -4.528 1.00 . A A . 3 LYS CB 1 1 10 4082 1 1 3 LYS CD C -5.694 5.642 -3.995 1.00 . A A . 3 LYS CD 1 1 10 4083 1 1 3 LYS CE C -7.030 6.387 -4.061 1.00 . A A . 3 LYS CE 1 1 10 4084 1 1 3 LYS CG C -5.906 4.154 -4.299 1.00 . A A . 3 LYS CG 1 1 10 4085 1 1 3 LYS H H -5.289 0.851 -3.719 1.00 . A A . 3 LYS H 1 1 10 4086 1 1 3 LYS HA H -5.153 2.406 -6.284 1.00 . A A . 3 LYS HA 1 1 10 4087 1 1 3 LYS HB2 H -4.082 3.270 -3.578 1.00 . A A . 3 LYS HB2 1 1 10 4088 1 1 3 LYS HB3 H -3.919 4.151 -5.091 1.00 . A A . 3 LYS HB3 1 1 10 4089 1 1 3 LYS HD2 H -5.276 5.749 -3.001 1.00 . A A . 3 LYS HD2 1 1 10 4090 1 1 3 LYS HD3 H -5.012 6.063 -4.717 1.00 . A A . 3 LYS HD3 1 1 10 4091 1 1 3 LYS HE2 H -7.820 5.773 -3.651 1.00 . A A . 3 LYS HE2 1 1 10 4092 1 1 3 LYS HE3 H -6.963 7.321 -3.526 1.00 . A A . 3 LYS HE3 1 1 10 4093 1 1 3 LYS HG2 H -6.516 4.045 -5.186 1.00 . A A . 3 LYS HG2 1 1 10 4094 1 1 3 LYS HG3 H -6.400 3.682 -3.464 1.00 . A A . 3 LYS HG3 1 1 10 4095 1 1 3 LYS HZ1 H -6.575 7.335 -5.861 1.00 . A A . 3 LYS HZ1 1 1 10 4096 1 1 3 LYS HZ2 H -8.229 7.031 -5.638 1.00 . A A . 3 LYS HZ2 1 1 10 4097 1 1 3 LYS HZ3 H -7.181 5.761 -6.046 1.00 . A A . 3 LYS HZ3 1 1 10 4098 1 1 3 LYS N N -5.639 1.328 -4.502 1.00 . A A . 3 LYS N 1 1 10 4099 1 1 3 LYS NZ N -7.271 6.646 -5.511 1.00 . A A . 3 LYS NZ 1 1 10 4100 1 1 3 LYS O O -3.123 0.418 -5.020 1.00 . A A . 3 LYS O 1 1 10 4101 1 1 4 LEU C C -0.194 1.948 -5.281 1.00 . A A . 4 LEU C 1 1 10 4102 1 1 4 LEU CA C -1.123 1.592 -6.454 1.00 . A A . 4 LEU CA 1 1 10 4103 1 1 4 LEU CB C -0.666 2.253 -7.763 1.00 . A A . 4 LEU CB 1 1 10 4104 1 1 4 LEU CD1 C -2.455 0.795 -8.775 1.00 . A A . 4 LEU CD1 1 1 10 4105 1 1 4 LEU CD2 C -1.069 2.273 -10.229 1.00 . A A . 4 LEU CD2 1 1 10 4106 1 1 4 LEU CG C -1.060 1.392 -8.975 1.00 . A A . 4 LEU CG 1 1 10 4107 1 1 4 LEU H H -2.707 3.036 -6.587 1.00 . A A . 4 LEU H 1 1 10 4108 1 1 4 LEU HA H -1.181 0.522 -6.579 1.00 . A A . 4 LEU HA 1 1 10 4109 1 1 4 LEU HB2 H -1.137 3.219 -7.850 1.00 . A A . 4 LEU HB2 1 1 10 4110 1 1 4 LEU HB3 H 0.406 2.382 -7.754 1.00 . A A . 4 LEU HB3 1 1 10 4111 1 1 4 LEU HD11 H -2.426 0.064 -7.980 1.00 . A A . 4 LEU HD11 1 1 10 4112 1 1 4 LEU HD12 H -2.776 0.325 -9.690 1.00 . A A . 4 LEU HD12 1 1 10 4113 1 1 4 LEU HD13 H -3.147 1.583 -8.515 1.00 . A A . 4 LEU HD13 1 1 10 4114 1 1 4 LEU HD21 H -1.808 3.054 -10.110 1.00 . A A . 4 LEU HD21 1 1 10 4115 1 1 4 LEU HD22 H -1.320 1.672 -11.095 1.00 . A A . 4 LEU HD22 1 1 10 4116 1 1 4 LEU HD23 H -0.096 2.716 -10.368 1.00 . A A . 4 LEU HD23 1 1 10 4117 1 1 4 LEU HG H -0.344 0.597 -9.098 1.00 . A A . 4 LEU HG 1 1 10 4118 1 1 4 LEU N N -2.478 2.161 -6.212 1.00 . A A . 4 LEU N 1 1 10 4119 1 1 4 LEU O O -0.642 2.155 -4.168 1.00 . A A . 4 LEU O 1 1 10 4120 1 1 5 THR C C 1.942 3.767 -3.931 1.00 . A A . 5 THR C 1 1 10 4121 1 1 5 THR CA C 2.060 2.304 -4.416 1.00 . A A . 5 THR CA 1 1 10 4122 1 1 5 THR CB C 3.451 2.037 -5.012 1.00 . A A . 5 THR CB 1 1 10 4123 1 1 5 THR CG2 C 4.259 1.179 -4.041 1.00 . A A . 5 THR CG2 1 1 10 4124 1 1 5 THR H H 1.430 1.792 -6.408 1.00 . A A . 5 THR H 1 1 10 4125 1 1 5 THR HA H 1.895 1.631 -3.592 1.00 . A A . 5 THR HA 1 1 10 4126 1 1 5 THR HB H 3.958 2.973 -5.166 1.00 . A A . 5 THR HB 1 1 10 4127 1 1 5 THR HG1 H 4.196 1.301 -6.674 1.00 . A A . 5 THR HG1 1 1 10 4128 1 1 5 THR HG21 H 4.978 1.794 -3.517 1.00 . A A . 5 THR HG21 1 1 10 4129 1 1 5 THR HG22 H 4.774 0.408 -4.594 1.00 . A A . 5 THR HG22 1 1 10 4130 1 1 5 THR HG23 H 3.595 0.719 -3.323 1.00 . A A . 5 THR HG23 1 1 10 4131 1 1 5 THR N N 1.091 1.992 -5.511 1.00 . A A . 5 THR N 1 1 10 4132 1 1 5 THR O O 1.377 4.032 -2.888 1.00 . A A . 5 THR O 1 1 10 4133 1 1 5 THR OG1 O 3.325 1.346 -6.256 1.00 . A A . 5 THR OG1 1 1 10 4134 1 1 6 PHE C C 0.999 6.743 -4.300 1.00 . A A . 6 PHE C 1 1 10 4135 1 1 6 PHE CA C 2.411 6.145 -4.169 1.00 . A A . 6 PHE CA 1 1 10 4136 1 1 6 PHE CB C 3.417 6.907 -5.034 1.00 . A A . 6 PHE CB 1 1 10 4137 1 1 6 PHE CD1 C 4.969 6.894 -3.029 1.00 . A A . 6 PHE CD1 1 1 10 4138 1 1 6 PHE CD2 C 4.857 8.891 -4.408 1.00 . A A . 6 PHE CD2 1 1 10 4139 1 1 6 PHE CE1 C 5.908 7.521 -2.201 1.00 . A A . 6 PHE CE1 1 1 10 4140 1 1 6 PHE CE2 C 5.798 9.512 -3.574 1.00 . A A . 6 PHE CE2 1 1 10 4141 1 1 6 PHE CG C 4.436 7.577 -4.137 1.00 . A A . 6 PHE CG 1 1 10 4142 1 1 6 PHE CZ C 6.322 8.826 -2.475 1.00 . A A . 6 PHE CZ 1 1 10 4143 1 1 6 PHE H H 2.946 4.504 -5.472 1.00 . A A . 6 PHE H 1 1 10 4144 1 1 6 PHE HA H 2.727 6.200 -3.139 1.00 . A A . 6 PHE HA 1 1 10 4145 1 1 6 PHE HB2 H 3.919 6.220 -5.697 1.00 . A A . 6 PHE HB2 1 1 10 4146 1 1 6 PHE HB3 H 2.903 7.660 -5.617 1.00 . A A . 6 PHE HB3 1 1 10 4147 1 1 6 PHE HD1 H 4.657 5.881 -2.809 1.00 . A A . 6 PHE HD1 1 1 10 4148 1 1 6 PHE HD2 H 4.456 9.429 -5.256 1.00 . A A . 6 PHE HD2 1 1 10 4149 1 1 6 PHE HE1 H 6.315 6.992 -1.345 1.00 . A A . 6 PHE HE1 1 1 10 4150 1 1 6 PHE HE2 H 6.125 10.520 -3.783 1.00 . A A . 6 PHE HE2 1 1 10 4151 1 1 6 PHE HZ H 7.046 9.302 -1.838 1.00 . A A . 6 PHE HZ 1 1 10 4152 1 1 6 PHE N N 2.481 4.720 -4.644 1.00 . A A . 6 PHE N 1 1 10 4153 1 1 6 PHE O O 0.833 7.880 -4.702 1.00 . A A . 6 PHE O 1 1 10 4154 1 1 7 TRP C C -1.889 6.773 -2.559 1.00 . A A . 7 TRP C 1 1 10 4155 1 1 7 TRP CA C -1.399 6.555 -3.990 1.00 . A A . 7 TRP CA 1 1 10 4156 1 1 7 TRP CB C -2.217 5.479 -4.695 1.00 . A A . 7 TRP CB 1 1 10 4157 1 1 7 TRP CD1 C -0.593 5.403 -6.635 1.00 . A A . 7 TRP CD1 1 1 10 4158 1 1 7 TRP CD2 C -2.739 5.459 -7.307 1.00 . A A . 7 TRP CD2 1 1 10 4159 1 1 7 TRP CE2 C -1.945 5.419 -8.477 1.00 . A A . 7 TRP CE2 1 1 10 4160 1 1 7 TRP CE3 C -4.135 5.496 -7.453 1.00 . A A . 7 TRP CE3 1 1 10 4161 1 1 7 TRP CG C -1.856 5.448 -6.149 1.00 . A A . 7 TRP CG 1 1 10 4162 1 1 7 TRP CH2 C -3.911 5.456 -9.873 1.00 . A A . 7 TRP CH2 1 1 10 4163 1 1 7 TRP CZ2 C -2.517 5.419 -9.747 1.00 . A A . 7 TRP CZ2 1 1 10 4164 1 1 7 TRP CZ3 C -4.718 5.493 -8.728 1.00 . A A . 7 TRP CZ3 1 1 10 4165 1 1 7 TRP H H 0.129 5.098 -3.580 1.00 . A A . 7 TRP H 1 1 10 4166 1 1 7 TRP HA H -1.427 7.475 -4.551 1.00 . A A . 7 TRP HA 1 1 10 4167 1 1 7 TRP HB2 H -2.014 4.517 -4.248 1.00 . A A . 7 TRP HB2 1 1 10 4168 1 1 7 TRP HB3 H -3.264 5.708 -4.590 1.00 . A A . 7 TRP HB3 1 1 10 4169 1 1 7 TRP HD1 H 0.309 5.384 -6.041 1.00 . A A . 7 TRP HD1 1 1 10 4170 1 1 7 TRP HE1 H 0.139 5.355 -8.601 1.00 . A A . 7 TRP HE1 1 1 10 4171 1 1 7 TRP HE3 H -4.761 5.520 -6.580 1.00 . A A . 7 TRP HE3 1 1 10 4172 1 1 7 TRP HH2 H -4.368 5.453 -10.853 1.00 . A A . 7 TRP HH2 1 1 10 4173 1 1 7 TRP HZ2 H -1.889 5.392 -10.627 1.00 . A A . 7 TRP HZ2 1 1 10 4174 1 1 7 TRP HZ3 H -5.795 5.522 -8.828 1.00 . A A . 7 TRP HZ3 1 1 10 4175 1 1 7 TRP N N -0.016 6.008 -3.928 1.00 . A A . 7 TRP N 1 1 10 4176 1 1 7 TRP NE1 N -0.643 5.388 -8.010 1.00 . A A . 7 TRP NE1 1 1 10 4177 1 1 7 TRP O O -2.029 5.826 -1.813 1.00 . A A . 7 TRP O 1 1 10 4178 1 1 8 LYS C C -3.449 7.200 -0.201 1.00 . A A . 8 LYS C 1 1 10 4179 1 1 8 LYS CA C -2.557 8.318 -0.760 1.00 . A A . 8 LYS CA 1 1 10 4180 1 1 8 LYS CB C -3.341 9.633 -0.870 1.00 . A A . 8 LYS CB 1 1 10 4181 1 1 8 LYS CD C -2.074 11.550 0.113 1.00 . A A . 8 LYS CD 1 1 10 4182 1 1 8 LYS CE C -2.200 12.663 1.159 1.00 . A A . 8 LYS CE 1 1 10 4183 1 1 8 LYS CG C -3.119 10.469 0.394 1.00 . A A . 8 LYS CG 1 1 10 4184 1 1 8 LYS H H -1.955 8.752 -2.784 1.00 . A A . 8 LYS H 1 1 10 4185 1 1 8 LYS HA H -1.701 8.464 -0.122 1.00 . A A . 8 LYS HA 1 1 10 4186 1 1 8 LYS HB2 H -2.999 10.188 -1.732 1.00 . A A . 8 LYS HB2 1 1 10 4187 1 1 8 LYS HB3 H -4.396 9.418 -0.978 1.00 . A A . 8 LYS HB3 1 1 10 4188 1 1 8 LYS HD2 H -1.084 11.114 0.152 1.00 . A A . 8 LYS HD2 1 1 10 4189 1 1 8 LYS HD3 H -2.245 11.964 -0.870 1.00 . A A . 8 LYS HD3 1 1 10 4190 1 1 8 LYS HE2 H -2.495 13.587 0.682 1.00 . A A . 8 LYS HE2 1 1 10 4191 1 1 8 LYS HE3 H -2.917 12.386 1.917 1.00 . A A . 8 LYS HE3 1 1 10 4192 1 1 8 LYS HG2 H -4.050 10.934 0.690 1.00 . A A . 8 LYS HG2 1 1 10 4193 1 1 8 LYS HG3 H -2.768 9.829 1.191 1.00 . A A . 8 LYS HG3 1 1 10 4194 1 1 8 LYS HZ1 H -0.911 13.411 2.613 1.00 . A A . 8 LYS HZ1 1 1 10 4195 1 1 8 LYS HZ2 H -0.196 13.244 1.082 1.00 . A A . 8 LYS HZ2 1 1 10 4196 1 1 8 LYS HZ3 H -0.483 11.872 2.051 1.00 . A A . 8 LYS HZ3 1 1 10 4197 1 1 8 LYS N N -2.109 8.013 -2.163 1.00 . A A . 8 LYS N 1 1 10 4198 1 1 8 LYS NZ N -0.844 12.805 1.769 1.00 . A A . 8 LYS NZ 1 1 10 4199 1 1 8 LYS O O -4.608 7.081 -0.555 1.00 . A A . 8 LYS O 1 1 10 4200 1 1 9 CYS C C -4.032 5.485 2.702 1.00 . A A . 9 CYS C 1 1 10 4201 1 1 9 CYS CA C -3.728 5.252 1.221 1.00 . A A . 9 CYS CA 1 1 10 4202 1 1 9 CYS CB C -2.885 3.974 1.045 1.00 . A A . 9 CYS CB 1 1 10 4203 1 1 9 CYS H H -1.962 6.479 0.914 1.00 . A A . 9 CYS H 1 1 10 4204 1 1 9 CYS HA H -4.648 5.153 0.667 1.00 . A A . 9 CYS HA 1 1 10 4205 1 1 9 CYS HB2 H -3.319 3.177 1.631 1.00 . A A . 9 CYS HB2 1 1 10 4206 1 1 9 CYS HB3 H -2.886 3.688 0.004 1.00 . A A . 9 CYS HB3 1 1 10 4207 1 1 9 CYS N N -2.910 6.372 0.654 1.00 . A A . 9 CYS N 1 1 10 4208 1 1 9 CYS O O -3.275 6.123 3.415 1.00 . A A . 9 CYS O 1 1 10 4209 1 1 9 CYS SG S -1.175 4.247 1.589 1.00 . A A . 9 CYS SG 1 1 10 4210 1 1 10 LYS C C -4.857 3.952 5.400 1.00 . A A . 10 LYS C 1 1 10 4211 1 1 10 LYS CA C -5.486 5.107 4.612 1.00 . A A . 10 LYS CA 1 1 10 4212 1 1 10 LYS CB C -7.013 5.016 4.674 1.00 . A A . 10 LYS CB 1 1 10 4213 1 1 10 LYS CD C -7.487 7.285 5.639 1.00 . A A . 10 LYS CD 1 1 10 4214 1 1 10 LYS CE C -8.484 6.832 6.714 1.00 . A A . 10 LYS CE 1 1 10 4215 1 1 10 LYS CG C -7.620 6.392 4.399 1.00 . A A . 10 LYS CG 1 1 10 4216 1 1 10 LYS H H -5.725 4.447 2.573 1.00 . A A . 10 LYS H 1 1 10 4217 1 1 10 LYS HA H -5.150 6.057 4.994 1.00 . A A . 10 LYS HA 1 1 10 4218 1 1 10 LYS HB2 H -7.362 4.315 3.926 1.00 . A A . 10 LYS HB2 1 1 10 4219 1 1 10 LYS HB3 H -7.317 4.675 5.652 1.00 . A A . 10 LYS HB3 1 1 10 4220 1 1 10 LYS HD2 H -6.481 7.219 6.025 1.00 . A A . 10 LYS HD2 1 1 10 4221 1 1 10 LYS HD3 H -7.700 8.308 5.367 1.00 . A A . 10 LYS HD3 1 1 10 4222 1 1 10 LYS HE2 H -9.109 7.663 7.018 1.00 . A A . 10 LYS HE2 1 1 10 4223 1 1 10 LYS HE3 H -9.093 6.019 6.349 1.00 . A A . 10 LYS HE3 1 1 10 4224 1 1 10 LYS HG2 H -7.100 6.852 3.572 1.00 . A A . 10 LYS HG2 1 1 10 4225 1 1 10 LYS HG3 H -8.661 6.276 4.149 1.00 . A A . 10 LYS HG3 1 1 10 4226 1 1 10 LYS HZ1 H -7.138 7.179 8.267 1.00 . A A . 10 LYS HZ1 1 1 10 4227 1 1 10 LYS HZ2 H -6.958 5.662 7.527 1.00 . A A . 10 LYS HZ2 1 1 10 4228 1 1 10 LYS HZ3 H -8.254 5.946 8.586 1.00 . A A . 10 LYS HZ3 1 1 10 4229 1 1 10 LYS N N -5.132 4.958 3.172 1.00 . A A . 10 LYS N 1 1 10 4230 1 1 10 LYS NZ N -7.644 6.370 7.856 1.00 . A A . 10 LYS NZ 1 1 10 4231 1 1 10 LYS O O -4.405 4.119 6.516 1.00 . A A . 10 LYS O 1 1 10 4232 1 1 11 ASN C C -3.360 0.790 4.554 1.00 . A A . 11 ASN C 1 1 10 4233 1 1 11 ASN CA C -4.227 1.605 5.522 1.00 . A A . 11 ASN CA 1 1 10 4234 1 1 11 ASN CB C -5.407 0.771 6.031 1.00 . A A . 11 ASN CB 1 1 10 4235 1 1 11 ASN CG C -6.167 0.160 4.850 1.00 . A A . 11 ASN CG 1 1 10 4236 1 1 11 ASN H H -5.196 2.665 3.916 1.00 . A A . 11 ASN H 1 1 10 4237 1 1 11 ASN HA H -3.632 1.940 6.359 1.00 . A A . 11 ASN HA 1 1 10 4238 1 1 11 ASN HB2 H -5.034 -0.019 6.669 1.00 . A A . 11 ASN HB2 1 1 10 4239 1 1 11 ASN HB3 H -6.069 1.404 6.599 1.00 . A A . 11 ASN HB3 1 1 10 4240 1 1 11 ASN HD21 H -7.719 1.347 5.070 1.00 . A A . 11 ASN HD21 1 1 10 4241 1 1 11 ASN HD22 H -7.833 0.247 3.789 1.00 . A A . 11 ASN HD22 1 1 10 4242 1 1 11 ASN N N -4.827 2.775 4.820 1.00 . A A . 11 ASN N 1 1 10 4243 1 1 11 ASN ND2 N -7.338 0.621 4.545 1.00 . A A . 11 ASN ND2 1 1 10 4244 1 1 11 ASN O O -3.048 1.219 3.460 1.00 . A A . 11 ASN O 1 1 10 4245 1 1 11 ASN OD1 O -5.689 -0.743 4.203 1.00 . A A . 11 ASN OD1 1 1 10 4246 1 1 12 LYS C C -2.872 -1.970 2.989 1.00 . A A . 12 LYS C 1 1 10 4247 1 1 12 LYS CA C -2.084 -1.259 4.112 1.00 . A A . 12 LYS CA 1 1 10 4248 1 1 12 LYS CB C -1.495 -2.283 5.091 1.00 . A A . 12 LYS CB 1 1 10 4249 1 1 12 LYS CD C 0.088 -4.201 5.369 1.00 . A A . 12 LYS CD 1 1 10 4250 1 1 12 LYS CE C 1.037 -5.171 4.648 1.00 . A A . 12 LYS CE 1 1 10 4251 1 1 12 LYS CG C -0.515 -3.213 4.362 1.00 . A A . 12 LYS CG 1 1 10 4252 1 1 12 LYS H H -3.229 -0.691 5.855 1.00 . A A . 12 LYS H 1 1 10 4253 1 1 12 LYS HA H -1.287 -0.672 3.685 1.00 . A A . 12 LYS HA 1 1 10 4254 1 1 12 LYS HB2 H -0.975 -1.761 5.884 1.00 . A A . 12 LYS HB2 1 1 10 4255 1 1 12 LYS HB3 H -2.293 -2.869 5.515 1.00 . A A . 12 LYS HB3 1 1 10 4256 1 1 12 LYS HD2 H 0.639 -3.650 6.117 1.00 . A A . 12 LYS HD2 1 1 10 4257 1 1 12 LYS HD3 H -0.703 -4.761 5.845 1.00 . A A . 12 LYS HD3 1 1 10 4258 1 1 12 LYS HE2 H 0.547 -5.594 3.781 1.00 . A A . 12 LYS HE2 1 1 10 4259 1 1 12 LYS HE3 H 1.949 -4.668 4.356 1.00 . A A . 12 LYS HE3 1 1 10 4260 1 1 12 LYS HG2 H -1.042 -3.756 3.592 1.00 . A A . 12 LYS HG2 1 1 10 4261 1 1 12 LYS HG3 H 0.277 -2.630 3.918 1.00 . A A . 12 LYS HG3 1 1 10 4262 1 1 12 LYS HZ1 H 1.513 -5.825 6.576 1.00 . A A . 12 LYS HZ1 1 1 10 4263 1 1 12 LYS HZ2 H 2.187 -6.767 5.335 1.00 . A A . 12 LYS HZ2 1 1 10 4264 1 1 12 LYS HZ3 H 0.536 -6.900 5.697 1.00 . A A . 12 LYS HZ3 1 1 10 4265 1 1 12 LYS N N -2.961 -0.385 4.968 1.00 . A A . 12 LYS N 1 1 10 4266 1 1 12 LYS NZ N 1.340 -6.244 5.640 1.00 . A A . 12 LYS NZ 1 1 10 4267 1 1 12 LYS O O -2.518 -1.877 1.830 1.00 . A A . 12 LYS O 1 1 10 4268 1 1 13 LYS C C -5.350 -2.402 1.259 1.00 . A A . 13 LYS C 1 1 10 4269 1 1 13 LYS CA C -4.718 -3.404 2.252 1.00 . A A . 13 LYS CA 1 1 10 4270 1 1 13 LYS CB C -5.809 -4.201 3.006 1.00 . A A . 13 LYS CB 1 1 10 4271 1 1 13 LYS CD C -8.008 -4.044 4.180 1.00 . A A . 13 LYS CD 1 1 10 4272 1 1 13 LYS CE C -8.923 -4.298 2.977 1.00 . A A . 13 LYS CE 1 1 10 4273 1 1 13 LYS CG C -6.775 -3.255 3.731 1.00 . A A . 13 LYS CG 1 1 10 4274 1 1 13 LYS H H -4.194 -2.755 4.255 1.00 . A A . 13 LYS H 1 1 10 4275 1 1 13 LYS HA H -4.079 -4.095 1.714 1.00 . A A . 13 LYS HA 1 1 10 4276 1 1 13 LYS HB2 H -6.366 -4.796 2.294 1.00 . A A . 13 LYS HB2 1 1 10 4277 1 1 13 LYS HB3 H -5.341 -4.858 3.725 1.00 . A A . 13 LYS HB3 1 1 10 4278 1 1 13 LYS HD2 H -7.694 -4.991 4.598 1.00 . A A . 13 LYS HD2 1 1 10 4279 1 1 13 LYS HD3 H -8.543 -3.479 4.928 1.00 . A A . 13 LYS HD3 1 1 10 4280 1 1 13 LYS HE2 H -8.495 -3.861 2.080 1.00 . A A . 13 LYS HE2 1 1 10 4281 1 1 13 LYS HE3 H -9.078 -5.358 2.839 1.00 . A A . 13 LYS HE3 1 1 10 4282 1 1 13 LYS HG2 H -6.286 -2.830 4.598 1.00 . A A . 13 LYS HG2 1 1 10 4283 1 1 13 LYS HG3 H -7.079 -2.464 3.065 1.00 . A A . 13 LYS HG3 1 1 10 4284 1 1 13 LYS HZ1 H -10.607 -4.058 4.180 1.00 . A A . 13 LYS HZ1 1 1 10 4285 1 1 13 LYS HZ2 H -10.886 -3.754 2.532 1.00 . A A . 13 LYS HZ2 1 1 10 4286 1 1 13 LYS HZ3 H -10.049 -2.620 3.476 1.00 . A A . 13 LYS HZ3 1 1 10 4287 1 1 13 LYS N N -3.925 -2.686 3.317 1.00 . A A . 13 LYS N 1 1 10 4288 1 1 13 LYS NZ N -10.213 -3.634 3.319 1.00 . A A . 13 LYS NZ 1 1 10 4289 1 1 13 LYS O O -5.842 -2.786 0.213 1.00 . A A . 13 LYS O 1 1 10 4290 1 1 14 GLU C C -5.179 -0.104 -0.704 1.00 . A A . 14 GLU C 1 1 10 4291 1 1 14 GLU CA C -5.931 -0.109 0.645 1.00 . A A . 14 GLU CA 1 1 10 4292 1 1 14 GLU CB C -5.752 1.227 1.378 1.00 . A A . 14 GLU CB 1 1 10 4293 1 1 14 GLU CD C -7.382 3.089 1.069 1.00 . A A . 14 GLU CD 1 1 10 4294 1 1 14 GLU CG C -6.165 2.393 0.477 1.00 . A A . 14 GLU CG 1 1 10 4295 1 1 14 GLU H H -4.947 -0.828 2.415 1.00 . A A . 14 GLU H 1 1 10 4296 1 1 14 GLU HA H -6.981 -0.307 0.489 1.00 . A A . 14 GLU HA 1 1 10 4297 1 1 14 GLU HB2 H -6.371 1.229 2.263 1.00 . A A . 14 GLU HB2 1 1 10 4298 1 1 14 GLU HB3 H -4.718 1.344 1.662 1.00 . A A . 14 GLU HB3 1 1 10 4299 1 1 14 GLU HG2 H -5.353 3.098 0.404 1.00 . A A . 14 GLU HG2 1 1 10 4300 1 1 14 GLU HG3 H -6.407 2.028 -0.507 1.00 . A A . 14 GLU HG3 1 1 10 4301 1 1 14 GLU N N -5.341 -1.123 1.571 1.00 . A A . 14 GLU N 1 1 10 4302 1 1 14 GLU O O -5.707 0.327 -1.712 1.00 . A A . 14 GLU O 1 1 10 4303 1 1 14 GLU OE1 O -8.464 2.533 0.971 1.00 . A A . 14 GLU OE1 1 1 10 4304 1 1 14 GLU OE2 O -7.218 4.172 1.596 1.00 . A A . 14 GLU OE2 1 1 10 4305 1 1 15 CYS C C -3.484 -1.902 -2.787 1.00 . A A . 15 CYS C 1 1 10 4306 1 1 15 CYS CA C -3.204 -0.592 -2.038 1.00 . A A . 15 CYS CA 1 1 10 4307 1 1 15 CYS CB C -1.713 -0.494 -1.680 1.00 . A A . 15 CYS CB 1 1 10 4308 1 1 15 CYS H H -3.537 -0.925 0.076 1.00 . A A . 15 CYS H 1 1 10 4309 1 1 15 CYS HA H -3.493 0.251 -2.648 1.00 . A A . 15 CYS HA 1 1 10 4310 1 1 15 CYS HB2 H -1.296 -1.489 -1.597 1.00 . A A . 15 CYS HB2 1 1 10 4311 1 1 15 CYS HB3 H -1.200 0.040 -2.467 1.00 . A A . 15 CYS HB3 1 1 10 4312 1 1 15 CYS N N -3.956 -0.576 -0.741 1.00 . A A . 15 CYS N 1 1 10 4313 1 1 15 CYS O O -3.269 -2.976 -2.259 1.00 . A A . 15 CYS O 1 1 10 4314 1 1 15 CYS SG S -1.482 0.386 -0.112 1.00 . A A . 15 CYS SG 1 1 10 4315 1 1 16 CYS C C -2.998 -3.944 -4.837 1.00 . A A . 16 CYS C 1 1 10 4316 1 1 16 CYS CA C -4.234 -3.054 -4.818 1.00 . A A . 16 CYS CA 1 1 10 4317 1 1 16 CYS CB C -4.577 -2.573 -6.232 1.00 . A A . 16 CYS CB 1 1 10 4318 1 1 16 CYS H H -4.096 -0.933 -4.425 1.00 . A A . 16 CYS H 1 1 10 4319 1 1 16 CYS HA H -5.069 -3.589 -4.395 1.00 . A A . 16 CYS HA 1 1 10 4320 1 1 16 CYS HB2 H -4.179 -1.582 -6.382 1.00 . A A . 16 CYS HB2 1 1 10 4321 1 1 16 CYS HB3 H -4.137 -3.249 -6.953 1.00 . A A . 16 CYS HB3 1 1 10 4322 1 1 16 CYS N N -3.947 -1.816 -4.021 1.00 . A A . 16 CYS N 1 1 10 4323 1 1 16 CYS O O -3.064 -5.112 -4.506 1.00 . A A . 16 CYS O 1 1 10 4324 1 1 16 CYS SG S -6.381 -2.543 -6.442 1.00 . A A . 16 CYS SG 1 1 10 4325 1 1 17 GLY C C -0.154 -4.329 -3.757 1.00 . A A . 17 GLY C 1 1 10 4326 1 1 17 GLY CA C -0.615 -4.202 -5.197 1.00 . A A . 17 GLY CA 1 1 10 4327 1 1 17 GLY H H -1.832 -2.447 -5.429 1.00 . A A . 17 GLY H 1 1 10 4328 1 1 17 GLY HA2 H -0.809 -5.182 -5.609 1.00 . A A . 17 GLY HA2 1 1 10 4329 1 1 17 GLY HA3 H 0.145 -3.702 -5.774 1.00 . A A . 17 GLY HA3 1 1 10 4330 1 1 17 GLY N N -1.865 -3.396 -5.192 1.00 . A A . 17 GLY N 1 1 10 4331 1 1 17 GLY O O 0.371 -3.387 -3.199 1.00 . A A . 17 GLY O 1 1 10 4332 1 1 18 TRP C C 1.255 -4.909 -1.347 1.00 . A A . 18 TRP C 1 1 10 4333 1 1 18 TRP CA C -0.007 -5.686 -1.719 1.00 . A A . 18 TRP CA 1 1 10 4334 1 1 18 TRP CB C 0.217 -7.196 -1.586 1.00 . A A . 18 TRP CB 1 1 10 4335 1 1 18 TRP CD1 C -2.205 -7.363 -0.848 1.00 . A A . 18 TRP CD1 1 1 10 4336 1 1 18 TRP CD2 C -1.483 -9.229 -1.881 1.00 . A A . 18 TRP CD2 1 1 10 4337 1 1 18 TRP CE2 C -2.834 -9.455 -1.529 1.00 . A A . 18 TRP CE2 1 1 10 4338 1 1 18 TRP CE3 C -0.794 -10.253 -2.547 1.00 . A A . 18 TRP CE3 1 1 10 4339 1 1 18 TRP CG C -1.105 -7.890 -1.441 1.00 . A A . 18 TRP CG 1 1 10 4340 1 1 18 TRP CH2 C -2.778 -11.663 -2.487 1.00 . A A . 18 TRP CH2 1 1 10 4341 1 1 18 TRP CZ2 C -3.479 -10.655 -1.824 1.00 . A A . 18 TRP CZ2 1 1 10 4342 1 1 18 TRP CZ3 C -1.441 -11.464 -2.846 1.00 . A A . 18 TRP CZ3 1 1 10 4343 1 1 18 TRP H H -0.850 -6.181 -3.634 1.00 . A A . 18 TRP H 1 1 10 4344 1 1 18 TRP HA H -0.818 -5.386 -1.078 1.00 . A A . 18 TRP HA 1 1 10 4345 1 1 18 TRP HB2 H 0.721 -7.569 -2.468 1.00 . A A . 18 TRP HB2 1 1 10 4346 1 1 18 TRP HB3 H 0.827 -7.395 -0.717 1.00 . A A . 18 TRP HB3 1 1 10 4347 1 1 18 TRP HD1 H -2.271 -6.383 -0.406 1.00 . A A . 18 TRP HD1 1 1 10 4348 1 1 18 TRP HE1 H -4.132 -8.152 -0.545 1.00 . A A . 18 TRP HE1 1 1 10 4349 1 1 18 TRP HE3 H 0.241 -10.110 -2.830 1.00 . A A . 18 TRP HE3 1 1 10 4350 1 1 18 TRP HH2 H -3.265 -12.595 -2.723 1.00 . A A . 18 TRP HH2 1 1 10 4351 1 1 18 TRP HZ2 H -4.516 -10.796 -1.546 1.00 . A A . 18 TRP HZ2 1 1 10 4352 1 1 18 TRP HZ3 H -0.903 -12.250 -3.360 1.00 . A A . 18 TRP HZ3 1 1 10 4353 1 1 18 TRP N N -0.388 -5.467 -3.151 1.00 . A A . 18 TRP N 1 1 10 4354 1 1 18 TRP NE1 N -3.229 -8.289 -0.903 1.00 . A A . 18 TRP NE1 1 1 10 4355 1 1 18 TRP O O 2.363 -5.305 -1.649 1.00 . A A . 18 TRP O 1 1 10 4356 1 1 19 ASN C C 1.932 -2.392 1.127 1.00 . A A . 19 ASN C 1 1 10 4357 1 1 19 ASN CA C 2.209 -2.925 -0.287 1.00 . A A . 19 ASN CA 1 1 10 4358 1 1 19 ASN CB C 2.206 -1.796 -1.324 1.00 . A A . 19 ASN CB 1 1 10 4359 1 1 19 ASN CG C 3.538 -1.048 -1.292 1.00 . A A . 19 ASN CG 1 1 10 4360 1 1 19 ASN H H 0.151 -3.514 -0.494 1.00 . A A . 19 ASN H 1 1 10 4361 1 1 19 ASN HA H 3.146 -3.466 -0.321 1.00 . A A . 19 ASN HA 1 1 10 4362 1 1 19 ASN HB2 H 2.055 -2.219 -2.308 1.00 . A A . 19 ASN HB2 1 1 10 4363 1 1 19 ASN HB3 H 1.406 -1.108 -1.099 1.00 . A A . 19 ASN HB3 1 1 10 4364 1 1 19 ASN HD21 H 4.218 -1.828 -2.990 1.00 . A A . 19 ASN HD21 1 1 10 4365 1 1 19 ASN HD22 H 5.247 -0.710 -2.239 1.00 . A A . 19 ASN HD22 1 1 10 4366 1 1 19 ASN N N 1.067 -3.792 -0.703 1.00 . A A . 19 ASN N 1 1 10 4367 1 1 19 ASN ND2 N 4.407 -1.214 -2.249 1.00 . A A . 19 ASN ND2 1 1 10 4368 1 1 19 ASN O O 0.972 -2.794 1.762 1.00 . A A . 19 ASN O 1 1 10 4369 1 1 19 ASN OD1 O 3.797 -0.314 -0.369 1.00 . A A . 19 ASN OD1 1 1 10 4370 1 1 20 ALA C C 2.262 0.536 2.976 1.00 . A A . 20 ALA C 1 1 10 4371 1 1 20 ALA CA C 2.515 -0.972 3.005 1.00 . A A . 20 ALA CA 1 1 10 4372 1 1 20 ALA CB C 3.806 -1.263 3.770 1.00 . A A . 20 ALA CB 1 1 10 4373 1 1 20 ALA H H 3.521 -1.191 1.111 1.00 . A A . 20 ALA H 1 1 10 4374 1 1 20 ALA HA H 1.690 -1.484 3.467 1.00 . A A . 20 ALA HA 1 1 10 4375 1 1 20 ALA HB1 H 4.600 -0.648 3.374 1.00 . A A . 20 ALA HB1 1 1 10 4376 1 1 20 ALA HB2 H 4.067 -2.305 3.660 1.00 . A A . 20 ALA HB2 1 1 10 4377 1 1 20 ALA HB3 H 3.667 -1.036 4.818 1.00 . A A . 20 ALA HB3 1 1 10 4378 1 1 20 ALA N N 2.749 -1.505 1.633 1.00 . A A . 20 ALA N 1 1 10 4379 1 1 20 ALA O O 3.041 1.302 2.433 1.00 . A A . 20 ALA O 1 1 10 4380 1 1 21 CYS C C 1.796 3.017 4.765 1.00 . A A . 21 CYS C 1 1 10 4381 1 1 21 CYS CA C 0.906 2.437 3.664 1.00 . A A . 21 CYS CA 1 1 10 4382 1 1 21 CYS CB C -0.584 2.529 4.025 1.00 . A A . 21 CYS CB 1 1 10 4383 1 1 21 CYS H H 0.610 0.335 4.056 1.00 . A A . 21 CYS H 1 1 10 4384 1 1 21 CYS HA H 1.106 2.912 2.715 1.00 . A A . 21 CYS HA 1 1 10 4385 1 1 21 CYS HB2 H -1.128 1.778 3.475 1.00 . A A . 21 CYS HB2 1 1 10 4386 1 1 21 CYS HB3 H -0.711 2.353 5.084 1.00 . A A . 21 CYS HB3 1 1 10 4387 1 1 21 CYS N N 1.198 0.972 3.600 1.00 . A A . 21 CYS N 1 1 10 4388 1 1 21 CYS O O 1.423 3.051 5.925 1.00 . A A . 21 CYS O 1 1 10 4389 1 1 21 CYS SG S -1.242 4.164 3.607 1.00 . A A . 21 CYS SG 1 1 10 4390 1 1 22 ALA C C 4.229 5.416 5.309 1.00 . A A . 22 ALA C 1 1 10 4391 1 1 22 ALA CA C 3.956 3.916 5.448 1.00 . A A . 22 ALA CA 1 1 10 4392 1 1 22 ALA CB C 5.244 3.117 5.206 1.00 . A A . 22 ALA CB 1 1 10 4393 1 1 22 ALA H H 3.288 3.327 3.486 1.00 . A A . 22 ALA H 1 1 10 4394 1 1 22 ALA HA H 3.580 3.705 6.434 1.00 . A A . 22 ALA HA 1 1 10 4395 1 1 22 ALA HB1 H 6.060 3.582 5.741 1.00 . A A . 22 ALA HB1 1 1 10 4396 1 1 22 ALA HB2 H 5.471 3.106 4.146 1.00 . A A . 22 ALA HB2 1 1 10 4397 1 1 22 ALA HB3 H 5.118 2.102 5.556 1.00 . A A . 22 ALA HB3 1 1 10 4398 1 1 22 ALA N N 3.000 3.409 4.418 1.00 . A A . 22 ALA N 1 1 10 4399 1 1 22 ALA O O 3.875 6.193 6.172 1.00 . A A . 22 ALA O 1 1 10 4400 1 1 23 LEU C C 3.983 8.059 3.604 1.00 . A A . 23 LEU C 1 1 10 4401 1 1 23 LEU CA C 5.222 7.276 4.077 1.00 . A A . 23 LEU CA 1 1 10 4402 1 1 23 LEU CB C 6.323 7.297 3.001 1.00 . A A . 23 LEU CB 1 1 10 4403 1 1 23 LEU CD1 C 7.564 6.082 4.867 1.00 . A A . 23 LEU CD1 1 1 10 4404 1 1 23 LEU CD2 C 8.475 6.086 2.554 1.00 . A A . 23 LEU CD2 1 1 10 4405 1 1 23 LEU CG C 7.702 6.909 3.586 1.00 . A A . 23 LEU CG 1 1 10 4406 1 1 23 LEU H H 5.185 5.171 3.584 1.00 . A A . 23 LEU H 1 1 10 4407 1 1 23 LEU HA H 5.596 7.691 4.998 1.00 . A A . 23 LEU HA 1 1 10 4408 1 1 23 LEU HB2 H 6.064 6.607 2.212 1.00 . A A . 23 LEU HB2 1 1 10 4409 1 1 23 LEU HB3 H 6.388 8.294 2.588 1.00 . A A . 23 LEU HB3 1 1 10 4410 1 1 23 LEU HD11 H 7.113 5.129 4.636 1.00 . A A . 23 LEU HD11 1 1 10 4411 1 1 23 LEU HD12 H 6.947 6.613 5.574 1.00 . A A . 23 LEU HD12 1 1 10 4412 1 1 23 LEU HD13 H 8.543 5.920 5.296 1.00 . A A . 23 LEU HD13 1 1 10 4413 1 1 23 LEU HD21 H 8.371 5.030 2.778 1.00 . A A . 23 LEU HD21 1 1 10 4414 1 1 23 LEU HD22 H 9.519 6.358 2.590 1.00 . A A . 23 LEU HD22 1 1 10 4415 1 1 23 LEU HD23 H 8.083 6.286 1.571 1.00 . A A . 23 LEU HD23 1 1 10 4416 1 1 23 LEU HG H 8.260 7.807 3.805 1.00 . A A . 23 LEU HG 1 1 10 4417 1 1 23 LEU N N 4.888 5.824 4.253 1.00 . A A . 23 LEU N 1 1 10 4418 1 1 23 LEU O O 4.032 8.786 2.634 1.00 . A A . 23 LEU O 1 1 10 4419 1 1 24 GLY C C 1.056 7.955 2.590 1.00 . A A . 24 GLY C 1 1 10 4420 1 1 24 GLY CA C 1.623 8.607 3.863 1.00 . A A . 24 GLY CA 1 1 10 4421 1 1 24 GLY H H 2.856 7.302 5.050 1.00 . A A . 24 GLY H 1 1 10 4422 1 1 24 GLY HA2 H 0.896 8.530 4.659 1.00 . A A . 24 GLY HA2 1 1 10 4423 1 1 24 GLY HA3 H 1.837 9.648 3.668 1.00 . A A . 24 GLY HA3 1 1 10 4424 1 1 24 GLY N N 2.874 7.901 4.277 1.00 . A A . 24 GLY N 1 1 10 4425 1 1 24 GLY O O 0.059 8.398 2.049 1.00 . A A . 24 GLY O 1 1 10 4426 1 1 25 ILE C C 1.706 4.763 0.889 1.00 . A A . 25 ILE C 1 1 10 4427 1 1 25 ILE CA C 1.209 6.215 0.871 1.00 . A A . 25 ILE CA 1 1 10 4428 1 1 25 ILE CB C 1.829 6.962 -0.328 1.00 . A A . 25 ILE CB 1 1 10 4429 1 1 25 ILE CD1 C 2.958 9.050 -1.143 1.00 . A A . 25 ILE CD1 1 1 10 4430 1 1 25 ILE CG1 C 2.379 8.339 0.082 1.00 . A A . 25 ILE CG1 1 1 10 4431 1 1 25 ILE CG2 C 0.766 7.165 -1.395 1.00 . A A . 25 ILE CG2 1 1 10 4432 1 1 25 ILE H H 2.487 6.559 2.557 1.00 . A A . 25 ILE H 1 1 10 4433 1 1 25 ILE HA H 0.133 6.244 0.813 1.00 . A A . 25 ILE HA 1 1 10 4434 1 1 25 ILE HB H 2.623 6.361 -0.734 1.00 . A A . 25 ILE HB 1 1 10 4435 1 1 25 ILE HD11 H 4.029 8.919 -1.156 1.00 . A A . 25 ILE HD11 1 1 10 4436 1 1 25 ILE HD12 H 2.726 10.102 -1.092 1.00 . A A . 25 ILE HD12 1 1 10 4437 1 1 25 ILE HD13 H 2.532 8.629 -2.042 1.00 . A A . 25 ILE HD13 1 1 10 4438 1 1 25 ILE HG12 H 1.580 8.937 0.501 1.00 . A A . 25 ILE HG12 1 1 10 4439 1 1 25 ILE HG13 H 3.156 8.212 0.820 1.00 . A A . 25 ILE HG13 1 1 10 4440 1 1 25 ILE HG21 H -0.105 7.616 -0.946 1.00 . A A . 25 ILE HG21 1 1 10 4441 1 1 25 ILE HG22 H 0.498 6.209 -1.822 1.00 . A A . 25 ILE HG22 1 1 10 4442 1 1 25 ILE HG23 H 1.149 7.812 -2.170 1.00 . A A . 25 ILE HG23 1 1 10 4443 1 1 25 ILE N N 1.688 6.904 2.104 1.00 . A A . 25 ILE N 1 1 10 4444 1 1 25 ILE O O 2.352 4.332 1.831 1.00 . A A . 25 ILE O 1 1 10 4445 1 1 26 CYS C C 3.367 2.590 -0.724 1.00 . A A . 26 CYS C 1 1 10 4446 1 1 26 CYS CA C 1.933 2.604 -0.179 1.00 . A A . 26 CYS CA 1 1 10 4447 1 1 26 CYS CB C 0.976 1.854 -1.121 1.00 . A A . 26 CYS CB 1 1 10 4448 1 1 26 CYS H H 0.955 4.388 -0.920 1.00 . A A . 26 CYS H 1 1 10 4449 1 1 26 CYS HA H 1.899 2.175 0.807 1.00 . A A . 26 CYS HA 1 1 10 4450 1 1 26 CYS HB2 H 1.136 2.181 -2.132 1.00 . A A . 26 CYS HB2 1 1 10 4451 1 1 26 CYS HB3 H 1.165 0.797 -1.058 1.00 . A A . 26 CYS HB3 1 1 10 4452 1 1 26 CYS N N 1.447 4.016 -0.149 1.00 . A A . 26 CYS N 1 1 10 4453 1 1 26 CYS O O 3.608 3.011 -1.838 1.00 . A A . 26 CYS O 1 1 10 4454 1 1 26 CYS SG S -0.746 2.186 -0.658 1.00 . A A . 26 CYS SG 1 1 10 4455 1 1 27 MET C C 6.500 0.868 -0.053 1.00 . A A . 27 MET C 1 1 10 4456 1 1 27 MET CA C 5.725 2.129 -0.474 1.00 . A A . 27 MET CA 1 1 10 4457 1 1 27 MET CB C 6.363 3.392 0.115 1.00 . A A . 27 MET CB 1 1 10 4458 1 1 27 MET CE C 7.585 4.312 -3.187 1.00 . A A . 27 MET CE 1 1 10 4459 1 1 27 MET CG C 6.196 4.553 -0.863 1.00 . A A . 27 MET CG 1 1 10 4460 1 1 27 MET H H 4.120 1.804 0.943 1.00 . A A . 27 MET H 1 1 10 4461 1 1 27 MET HA H 5.725 2.206 -1.543 1.00 . A A . 27 MET HA 1 1 10 4462 1 1 27 MET HB2 H 5.876 3.636 1.048 1.00 . A A . 27 MET HB2 1 1 10 4463 1 1 27 MET HB3 H 7.414 3.218 0.290 1.00 . A A . 27 MET HB3 1 1 10 4464 1 1 27 MET HE1 H 7.071 3.364 -3.115 1.00 . A A . 27 MET HE1 1 1 10 4465 1 1 27 MET HE2 H 8.549 4.162 -3.647 1.00 . A A . 27 MET HE2 1 1 10 4466 1 1 27 MET HE3 H 7.007 5.000 -3.788 1.00 . A A . 27 MET HE3 1 1 10 4467 1 1 27 MET HG2 H 5.539 4.257 -1.670 1.00 . A A . 27 MET HG2 1 1 10 4468 1 1 27 MET HG3 H 5.768 5.399 -0.346 1.00 . A A . 27 MET HG3 1 1 10 4469 1 1 27 MET N N 4.323 2.134 0.040 1.00 . A A . 27 MET N 1 1 10 4470 1 1 27 MET O O 6.856 0.064 -0.895 1.00 . A A . 27 MET O 1 1 10 4471 1 1 27 MET SD S 7.814 5.006 -1.530 1.00 . A A . 27 MET SD 1 1 10 4472 1 1 28 PRO C C 6.800 -1.708 1.750 1.00 . A A . 28 PRO C 1 1 10 4473 1 1 28 PRO CA C 7.596 -0.398 1.721 1.00 . A A . 28 PRO CA 1 1 10 4474 1 1 28 PRO CB C 8.000 0.036 3.132 1.00 . A A . 28 PRO CB 1 1 10 4475 1 1 28 PRO CD C 6.398 1.661 2.316 1.00 . A A . 28 PRO CD 1 1 10 4476 1 1 28 PRO CG C 6.947 1.007 3.559 1.00 . A A . 28 PRO CG 1 1 10 4477 1 1 28 PRO HA H 8.474 -0.521 1.108 1.00 . A A . 28 PRO HA 1 1 10 4478 1 1 28 PRO HB2 H 8.020 -0.816 3.801 1.00 . A A . 28 PRO HB2 1 1 10 4479 1 1 28 PRO HB3 H 8.963 0.526 3.118 1.00 . A A . 28 PRO HB3 1 1 10 4480 1 1 28 PRO HD2 H 5.321 1.744 2.376 1.00 . A A . 28 PRO HD2 1 1 10 4481 1 1 28 PRO HD3 H 6.846 2.632 2.164 1.00 . A A . 28 PRO HD3 1 1 10 4482 1 1 28 PRO HG2 H 6.158 0.484 4.086 1.00 . A A . 28 PRO HG2 1 1 10 4483 1 1 28 PRO HG3 H 7.383 1.752 4.199 1.00 . A A . 28 PRO HG3 1 1 10 4484 1 1 28 PRO N N 6.788 0.753 1.227 1.00 . A A . 28 PRO N 1 1 10 4485 1 1 28 PRO O O 6.191 -2.051 2.739 1.00 . A A . 28 PRO O 1 1 10 4486 1 1 29 ARG C C 6.713 -4.738 1.647 1.00 . A A . 29 ARG C 1 1 10 4487 1 1 29 ARG CA C 6.124 -3.761 0.609 1.00 . A A . 29 ARG CA 1 1 10 4488 1 1 29 ARG CB C 6.364 -4.253 -0.831 1.00 . A A . 29 ARG CB 1 1 10 4489 1 1 29 ARG CD C 4.936 -6.306 -0.701 1.00 . A A . 29 ARG CD 1 1 10 4490 1 1 29 ARG CG C 6.363 -5.785 -0.899 1.00 . A A . 29 ARG CG 1 1 10 4491 1 1 29 ARG CZ C 5.413 -8.578 0.076 1.00 . A A . 29 ARG CZ 1 1 10 4492 1 1 29 ARG H H 7.366 -2.136 -0.088 1.00 . A A . 29 ARG H 1 1 10 4493 1 1 29 ARG HA H 5.072 -3.617 0.779 1.00 . A A . 29 ARG HA 1 1 10 4494 1 1 29 ARG HB2 H 5.581 -3.869 -1.465 1.00 . A A . 29 ARG HB2 1 1 10 4495 1 1 29 ARG HB3 H 7.319 -3.884 -1.182 1.00 . A A . 29 ARG HB3 1 1 10 4496 1 1 29 ARG HD2 H 4.586 -6.071 0.294 1.00 . A A . 29 ARG HD2 1 1 10 4497 1 1 29 ARG HD3 H 4.279 -5.872 -1.437 1.00 . A A . 29 ARG HD3 1 1 10 4498 1 1 29 ARG HE H 4.758 -8.174 -1.764 1.00 . A A . 29 ARG HE 1 1 10 4499 1 1 29 ARG HG2 H 6.729 -6.095 -1.865 1.00 . A A . 29 ARG HG2 1 1 10 4500 1 1 29 ARG HG3 H 7.003 -6.186 -0.128 1.00 . A A . 29 ARG HG3 1 1 10 4501 1 1 29 ARG HH11 H 5.787 -7.096 1.381 1.00 . A A . 29 ARG HH11 1 1 10 4502 1 1 29 ARG HH12 H 6.076 -8.696 1.962 1.00 . A A . 29 ARG HH12 1 1 10 4503 1 1 29 ARG HH21 H 5.156 -10.247 -0.991 1.00 . A A . 29 ARG HH21 1 1 10 4504 1 1 29 ARG HH22 H 5.729 -10.472 0.621 1.00 . A A . 29 ARG HH22 1 1 10 4505 1 1 29 ARG N N 6.843 -2.444 0.675 1.00 . A A . 29 ARG N 1 1 10 4506 1 1 29 ARG NE N 5.022 -7.784 -0.898 1.00 . A A . 29 ARG NE 1 1 10 4507 1 1 29 ARG NH1 N 5.790 -8.087 1.228 1.00 . A A . 29 ARG NH1 1 1 10 4508 1 1 29 ARG NH2 N 5.436 -9.863 -0.111 1.00 . A A . 29 ARG NH2 1 1 10 4509 1 1 29 ARG O O 5.976 -5.577 2.150 1.00 . A A . 29 ARG O 1 1 10 4510 1 1 29 ARG OXT O 7.895 -4.638 1.918 1.00 . A A . 29 ARG OXT 1 1 11 4511 1 1 1 GLY C C -10.072 -0.681 -4.860 1.00 . A A . 1 GLY C 1 1 11 4512 1 1 1 GLY CA C -11.239 -0.897 -5.826 1.00 . A A . 1 GLY CA 1 1 11 4513 1 1 1 GLY H1 H -11.393 -2.949 -5.493 1.00 . A A . 1 GLY H1 1 1 11 4514 1 1 1 GLY H2 H -10.333 -2.532 -6.751 1.00 . A A . 1 GLY H2 1 1 11 4515 1 1 1 GLY H3 H -12.008 -2.445 -6.992 1.00 . A A . 1 GLY H3 1 1 11 4516 1 1 1 GLY HA2 H -11.138 -0.232 -6.672 1.00 . A A . 1 GLY HA2 1 1 11 4517 1 1 1 GLY HA3 H -12.167 -0.686 -5.315 1.00 . A A . 1 GLY HA3 1 1 11 4518 1 1 1 GLY N N -11.242 -2.313 -6.302 1.00 . A A . 1 GLY N 1 1 11 4519 1 1 1 GLY O O -10.117 -1.099 -3.721 1.00 . A A . 1 GLY O 1 1 11 4520 1 1 2 CYS C C -6.854 1.142 -5.136 1.00 . A A . 2 CYS C 1 1 11 4521 1 1 2 CYS CA C -7.843 0.214 -4.418 1.00 . A A . 2 CYS CA 1 1 11 4522 1 1 2 CYS CB C -7.215 -1.167 -4.170 1.00 . A A . 2 CYS CB 1 1 11 4523 1 1 2 CYS H H -9.008 0.297 -6.231 1.00 . A A . 2 CYS H 1 1 11 4524 1 1 2 CYS HA H -8.159 0.649 -3.482 1.00 . A A . 2 CYS HA 1 1 11 4525 1 1 2 CYS HB2 H -6.224 -1.043 -3.761 1.00 . A A . 2 CYS HB2 1 1 11 4526 1 1 2 CYS HB3 H -7.823 -1.718 -3.465 1.00 . A A . 2 CYS HB3 1 1 11 4527 1 1 2 CYS N N -9.024 -0.034 -5.305 1.00 . A A . 2 CYS N 1 1 11 4528 1 1 2 CYS O O -7.078 1.528 -6.271 1.00 . A A . 2 CYS O 1 1 11 4529 1 1 2 CYS SG S -7.105 -2.090 -5.727 1.00 . A A . 2 CYS SG 1 1 11 4530 1 1 3 LYS C C -3.471 1.658 -5.460 1.00 . A A . 3 LYS C 1 1 11 4531 1 1 3 LYS CA C -4.778 2.411 -5.173 1.00 . A A . 3 LYS CA 1 1 11 4532 1 1 3 LYS CB C -4.533 3.571 -4.201 1.00 . A A . 3 LYS CB 1 1 11 4533 1 1 3 LYS CD C -5.762 5.640 -3.504 1.00 . A A . 3 LYS CD 1 1 11 4534 1 1 3 LYS CE C -7.101 6.306 -3.845 1.00 . A A . 3 LYS CE 1 1 11 4535 1 1 3 LYS CG C -5.873 4.128 -3.705 1.00 . A A . 3 LYS CG 1 1 11 4536 1 1 3 LYS H H -5.601 1.189 -3.583 1.00 . A A . 3 LYS H 1 1 11 4537 1 1 3 LYS HA H -5.191 2.791 -6.096 1.00 . A A . 3 LYS HA 1 1 11 4538 1 1 3 LYS HB2 H -3.943 3.228 -3.360 1.00 . A A . 3 LYS HB2 1 1 11 4539 1 1 3 LYS HB3 H -3.998 4.347 -4.718 1.00 . A A . 3 LYS HB3 1 1 11 4540 1 1 3 LYS HD2 H -5.506 5.848 -2.475 1.00 . A A . 3 LYS HD2 1 1 11 4541 1 1 3 LYS HD3 H -4.995 6.034 -4.151 1.00 . A A . 3 LYS HD3 1 1 11 4542 1 1 3 LYS HE2 H -6.960 7.367 -4.009 1.00 . A A . 3 LYS HE2 1 1 11 4543 1 1 3 LYS HE3 H -7.541 5.846 -4.716 1.00 . A A . 3 LYS HE3 1 1 11 4544 1 1 3 LYS HG2 H -6.643 3.915 -4.437 1.00 . A A . 3 LYS HG2 1 1 11 4545 1 1 3 LYS HG3 H -6.129 3.661 -2.769 1.00 . A A . 3 LYS HG3 1 1 11 4546 1 1 3 LYS HZ1 H -8.111 5.058 -2.514 1.00 . A A . 3 LYS HZ1 1 1 11 4547 1 1 3 LYS HZ2 H -8.885 6.541 -2.804 1.00 . A A . 3 LYS HZ2 1 1 11 4548 1 1 3 LYS HZ3 H -7.512 6.478 -1.811 1.00 . A A . 3 LYS HZ3 1 1 11 4549 1 1 3 LYS N N -5.769 1.506 -4.500 1.00 . A A . 3 LYS N 1 1 11 4550 1 1 3 LYS NZ N -7.965 6.078 -2.654 1.00 . A A . 3 LYS NZ 1 1 11 4551 1 1 3 LYS O O -3.326 0.504 -5.121 1.00 . A A . 3 LYS O 1 1 11 4552 1 1 4 LEU C C -0.207 1.837 -5.289 1.00 . A A . 4 LEU C 1 1 11 4553 1 1 4 LEU CA C -1.233 1.631 -6.425 1.00 . A A . 4 LEU CA 1 1 11 4554 1 1 4 LEU CB C -0.773 2.284 -7.746 1.00 . A A . 4 LEU CB 1 1 11 4555 1 1 4 LEU CD1 C -1.666 0.224 -8.865 1.00 . A A . 4 LEU CD1 1 1 11 4556 1 1 4 LEU CD2 C -3.013 2.319 -8.881 1.00 . A A . 4 LEU CD2 1 1 11 4557 1 1 4 LEU CG C -1.595 1.749 -8.929 1.00 . A A . 4 LEU CG 1 1 11 4558 1 1 4 LEU H H -2.673 3.231 -6.363 1.00 . A A . 4 LEU H 1 1 11 4559 1 1 4 LEU HA H -1.396 0.577 -6.580 1.00 . A A . 4 LEU HA 1 1 11 4560 1 1 4 LEU HB2 H -0.901 3.350 -7.678 1.00 . A A . 4 LEU HB2 1 1 11 4561 1 1 4 LEU HB3 H 0.267 2.060 -7.916 1.00 . A A . 4 LEU HB3 1 1 11 4562 1 1 4 LEU HD11 H -1.747 -0.174 -9.865 1.00 . A A . 4 LEU HD11 1 1 11 4563 1 1 4 LEU HD12 H -2.532 -0.070 -8.289 1.00 . A A . 4 LEU HD12 1 1 11 4564 1 1 4 LEU HD13 H -0.773 -0.159 -8.394 1.00 . A A . 4 LEU HD13 1 1 11 4565 1 1 4 LEU HD21 H -3.355 2.514 -9.888 1.00 . A A . 4 LEU HD21 1 1 11 4566 1 1 4 LEU HD22 H -3.012 3.236 -8.316 1.00 . A A . 4 LEU HD22 1 1 11 4567 1 1 4 LEU HD23 H -3.673 1.605 -8.412 1.00 . A A . 4 LEU HD23 1 1 11 4568 1 1 4 LEU HG H -1.120 2.043 -9.854 1.00 . A A . 4 LEU HG 1 1 11 4569 1 1 4 LEU N N -2.528 2.304 -6.094 1.00 . A A . 4 LEU N 1 1 11 4570 1 1 4 LEU O O -0.506 1.595 -4.133 1.00 . A A . 4 LEU O 1 1 11 4571 1 1 5 THR C C 1.999 3.888 -3.986 1.00 . A A . 5 THR C 1 1 11 4572 1 1 5 THR CA C 2.032 2.452 -4.541 1.00 . A A . 5 THR CA 1 1 11 4573 1 1 5 THR CB C 3.360 2.131 -5.251 1.00 . A A . 5 THR CB 1 1 11 4574 1 1 5 THR CG2 C 4.552 2.434 -4.337 1.00 . A A . 5 THR CG2 1 1 11 4575 1 1 5 THR H H 1.228 2.438 -6.532 1.00 . A A . 5 THR H 1 1 11 4576 1 1 5 THR HA H 1.872 1.746 -3.743 1.00 . A A . 5 THR HA 1 1 11 4577 1 1 5 THR HB H 3.441 2.727 -6.147 1.00 . A A . 5 THR HB 1 1 11 4578 1 1 5 THR HG1 H 4.110 0.598 -6.193 1.00 . A A . 5 THR HG1 1 1 11 4579 1 1 5 THR HG21 H 4.366 3.347 -3.790 1.00 . A A . 5 THR HG21 1 1 11 4580 1 1 5 THR HG22 H 5.442 2.552 -4.933 1.00 . A A . 5 THR HG22 1 1 11 4581 1 1 5 THR HG23 H 4.691 1.615 -3.645 1.00 . A A . 5 THR HG23 1 1 11 4582 1 1 5 THR N N 0.997 2.262 -5.600 1.00 . A A . 5 THR N 1 1 11 4583 1 1 5 THR O O 1.559 4.116 -2.876 1.00 . A A . 5 THR O 1 1 11 4584 1 1 5 THR OG1 O 3.371 0.750 -5.598 1.00 . A A . 5 THR OG1 1 1 11 4585 1 1 6 PHE C C 1.063 6.891 -4.240 1.00 . A A . 6 PHE C 1 1 11 4586 1 1 6 PHE CA C 2.467 6.268 -4.231 1.00 . A A . 6 PHE CA 1 1 11 4587 1 1 6 PHE CB C 3.402 7.031 -5.174 1.00 . A A . 6 PHE CB 1 1 11 4588 1 1 6 PHE CD1 C 5.511 6.557 -3.868 1.00 . A A . 6 PHE CD1 1 1 11 4589 1 1 6 PHE CD2 C 4.851 8.863 -4.216 1.00 . A A . 6 PHE CD2 1 1 11 4590 1 1 6 PHE CE1 C 6.633 6.986 -3.151 1.00 . A A . 6 PHE CE1 1 1 11 4591 1 1 6 PHE CE2 C 5.973 9.291 -3.501 1.00 . A A . 6 PHE CE2 1 1 11 4592 1 1 6 PHE CG C 4.617 7.495 -4.404 1.00 . A A . 6 PHE CG 1 1 11 4593 1 1 6 PHE CZ C 6.866 8.354 -2.967 1.00 . A A . 6 PHE CZ 1 1 11 4594 1 1 6 PHE H H 2.806 4.659 -5.617 1.00 . A A . 6 PHE H 1 1 11 4595 1 1 6 PHE HA H 2.870 6.296 -3.230 1.00 . A A . 6 PHE HA 1 1 11 4596 1 1 6 PHE HB2 H 3.710 6.385 -5.978 1.00 . A A . 6 PHE HB2 1 1 11 4597 1 1 6 PHE HB3 H 2.887 7.891 -5.578 1.00 . A A . 6 PHE HB3 1 1 11 4598 1 1 6 PHE HD1 H 5.337 5.501 -4.007 1.00 . A A . 6 PHE HD1 1 1 11 4599 1 1 6 PHE HD2 H 4.166 9.590 -4.624 1.00 . A A . 6 PHE HD2 1 1 11 4600 1 1 6 PHE HE1 H 7.320 6.259 -2.740 1.00 . A A . 6 PHE HE1 1 1 11 4601 1 1 6 PHE HE2 H 6.149 10.348 -3.359 1.00 . A A . 6 PHE HE2 1 1 11 4602 1 1 6 PHE HZ H 7.736 8.685 -2.413 1.00 . A A . 6 PHE HZ 1 1 11 4603 1 1 6 PHE N N 2.460 4.856 -4.736 1.00 . A A . 6 PHE N 1 1 11 4604 1 1 6 PHE O O 0.900 8.066 -4.514 1.00 . A A . 6 PHE O 1 1 11 4605 1 1 7 TRP C C -1.665 6.985 -2.396 1.00 . A A . 7 TRP C 1 1 11 4606 1 1 7 TRP CA C -1.320 6.710 -3.857 1.00 . A A . 7 TRP CA 1 1 11 4607 1 1 7 TRP CB C -2.230 5.630 -4.441 1.00 . A A . 7 TRP CB 1 1 11 4608 1 1 7 TRP CD1 C -0.865 5.467 -6.566 1.00 . A A . 7 TRP CD1 1 1 11 4609 1 1 7 TRP CD2 C -3.071 5.607 -6.964 1.00 . A A . 7 TRP CD2 1 1 11 4610 1 1 7 TRP CE2 C -2.432 5.537 -8.224 1.00 . A A . 7 TRP CE2 1 1 11 4611 1 1 7 TRP CE3 C -4.475 5.695 -6.937 1.00 . A A . 7 TRP CE3 1 1 11 4612 1 1 7 TRP CG C -2.054 5.575 -5.927 1.00 . A A . 7 TRP CG 1 1 11 4613 1 1 7 TRP CH2 C -4.554 5.640 -9.369 1.00 . A A . 7 TRP CH2 1 1 11 4614 1 1 7 TRP CZ2 C -3.161 5.554 -9.414 1.00 . A A . 7 TRP CZ2 1 1 11 4615 1 1 7 TRP CZ3 C -5.211 5.711 -8.134 1.00 . A A . 7 TRP CZ3 1 1 11 4616 1 1 7 TRP H H 0.186 5.199 -3.655 1.00 . A A . 7 TRP H 1 1 11 4617 1 1 7 TRP HA H -1.379 7.613 -4.445 1.00 . A A . 7 TRP HA 1 1 11 4618 1 1 7 TRP HB2 H -1.976 4.672 -4.012 1.00 . A A . 7 TRP HB2 1 1 11 4619 1 1 7 TRP HB3 H -3.253 5.868 -4.209 1.00 . A A . 7 TRP HB3 1 1 11 4620 1 1 7 TRP HD1 H 0.099 5.410 -6.088 1.00 . A A . 7 TRP HD1 1 1 11 4621 1 1 7 TRP HE1 H -0.393 5.399 -8.610 1.00 . A A . 7 TRP HE1 1 1 11 4622 1 1 7 TRP HE3 H -4.992 5.748 -5.988 1.00 . A A . 7 TRP HE3 1 1 11 4623 1 1 7 TRP HH2 H -5.126 5.649 -10.289 1.00 . A A . 7 TRP HH2 1 1 11 4624 1 1 7 TRP HZ2 H -2.651 5.498 -10.366 1.00 . A A . 7 TRP HZ2 1 1 11 4625 1 1 7 TRP HZ3 H -6.290 5.772 -8.102 1.00 . A A . 7 TRP HZ3 1 1 11 4626 1 1 7 TRP N N 0.049 6.136 -3.904 1.00 . A A . 7 TRP N 1 1 11 4627 1 1 7 TRP NE1 N -1.089 5.458 -7.926 1.00 . A A . 7 TRP NE1 1 1 11 4628 1 1 7 TRP O O -1.597 6.094 -1.570 1.00 . A A . 7 TRP O 1 1 11 4629 1 1 8 LYS C C -3.264 7.506 -0.037 1.00 . A A . 8 LYS C 1 1 11 4630 1 1 8 LYS CA C -2.310 8.549 -0.636 1.00 . A A . 8 LYS CA 1 1 11 4631 1 1 8 LYS CB C -2.968 9.938 -0.678 1.00 . A A . 8 LYS CB 1 1 11 4632 1 1 8 LYS CD C -1.094 11.604 -0.779 1.00 . A A . 8 LYS CD 1 1 11 4633 1 1 8 LYS CE C -0.457 12.797 -0.052 1.00 . A A . 8 LYS CE 1 1 11 4634 1 1 8 LYS CG C -2.134 10.939 0.132 1.00 . A A . 8 LYS CG 1 1 11 4635 1 1 8 LYS H H -2.010 8.909 -2.745 1.00 . A A . 8 LYS H 1 1 11 4636 1 1 8 LYS HA H -1.397 8.587 -0.059 1.00 . A A . 8 LYS HA 1 1 11 4637 1 1 8 LYS HB2 H -3.036 10.271 -1.703 1.00 . A A . 8 LYS HB2 1 1 11 4638 1 1 8 LYS HB3 H -3.961 9.875 -0.256 1.00 . A A . 8 LYS HB3 1 1 11 4639 1 1 8 LYS HD2 H -0.326 10.885 -1.030 1.00 . A A . 8 LYS HD2 1 1 11 4640 1 1 8 LYS HD3 H -1.574 11.946 -1.684 1.00 . A A . 8 LYS HD3 1 1 11 4641 1 1 8 LYS HE2 H -0.569 12.688 1.019 1.00 . A A . 8 LYS HE2 1 1 11 4642 1 1 8 LYS HE3 H 0.588 12.882 -0.312 1.00 . A A . 8 LYS HE3 1 1 11 4643 1 1 8 LYS HG2 H -2.784 11.695 0.546 1.00 . A A . 8 LYS HG2 1 1 11 4644 1 1 8 LYS HG3 H -1.628 10.422 0.935 1.00 . A A . 8 LYS HG3 1 1 11 4645 1 1 8 LYS HZ1 H -1.142 14.057 -1.572 1.00 . A A . 8 LYS HZ1 1 1 11 4646 1 1 8 LYS HZ2 H -0.784 14.856 -0.118 1.00 . A A . 8 LYS HZ2 1 1 11 4647 1 1 8 LYS HZ3 H -2.199 13.930 -0.252 1.00 . A A . 8 LYS HZ3 1 1 11 4648 1 1 8 LYS N N -1.995 8.209 -2.063 1.00 . A A . 8 LYS N 1 1 11 4649 1 1 8 LYS NZ N -1.202 13.999 -0.535 1.00 . A A . 8 LYS NZ 1 1 11 4650 1 1 8 LYS O O -4.461 7.525 -0.269 1.00 . A A . 8 LYS O 1 1 11 4651 1 1 9 CYS C C -3.616 5.670 2.855 1.00 . A A . 9 CYS C 1 1 11 4652 1 1 9 CYS CA C -3.577 5.520 1.327 1.00 . A A . 9 CYS CA 1 1 11 4653 1 1 9 CYS CB C -2.903 4.206 0.897 1.00 . A A . 9 CYS CB 1 1 11 4654 1 1 9 CYS H H -1.758 6.593 0.873 1.00 . A A . 9 CYS H 1 1 11 4655 1 1 9 CYS HA H -4.575 5.564 0.924 1.00 . A A . 9 CYS HA 1 1 11 4656 1 1 9 CYS HB2 H -3.498 3.739 0.126 1.00 . A A . 9 CYS HB2 1 1 11 4657 1 1 9 CYS HB3 H -1.921 4.420 0.501 1.00 . A A . 9 CYS HB3 1 1 11 4658 1 1 9 CYS N N -2.728 6.588 0.717 1.00 . A A . 9 CYS N 1 1 11 4659 1 1 9 CYS O O -2.816 6.382 3.440 1.00 . A A . 9 CYS O 1 1 11 4660 1 1 9 CYS SG S -2.749 3.071 2.303 1.00 . A A . 9 CYS SG 1 1 11 4661 1 1 10 LYS C C -4.258 3.742 5.618 1.00 . A A . 10 LYS C 1 1 11 4662 1 1 10 LYS CA C -4.636 5.088 4.989 1.00 . A A . 10 LYS CA 1 1 11 4663 1 1 10 LYS CB C -6.104 5.423 5.285 1.00 . A A . 10 LYS CB 1 1 11 4664 1 1 10 LYS CD C -6.228 7.089 7.157 1.00 . A A . 10 LYS CD 1 1 11 4665 1 1 10 LYS CE C -5.310 8.258 7.536 1.00 . A A . 10 LYS CE 1 1 11 4666 1 1 10 LYS CG C -6.230 6.909 5.632 1.00 . A A . 10 LYS CG 1 1 11 4667 1 1 10 LYS H H -5.169 4.432 2.997 1.00 . A A . 10 LYS H 1 1 11 4668 1 1 10 LYS HA H -3.997 5.869 5.363 1.00 . A A . 10 LYS HA 1 1 11 4669 1 1 10 LYS HB2 H -6.707 5.203 4.414 1.00 . A A . 10 LYS HB2 1 1 11 4670 1 1 10 LYS HB3 H -6.447 4.830 6.120 1.00 . A A . 10 LYS HB3 1 1 11 4671 1 1 10 LYS HD2 H -7.234 7.298 7.496 1.00 . A A . 10 LYS HD2 1 1 11 4672 1 1 10 LYS HD3 H -5.869 6.186 7.623 1.00 . A A . 10 LYS HD3 1 1 11 4673 1 1 10 LYS HE2 H -4.365 8.177 7.014 1.00 . A A . 10 LYS HE2 1 1 11 4674 1 1 10 LYS HE3 H -5.787 9.198 7.304 1.00 . A A . 10 LYS HE3 1 1 11 4675 1 1 10 LYS HG2 H -5.400 7.454 5.202 1.00 . A A . 10 LYS HG2 1 1 11 4676 1 1 10 LYS HG3 H -7.156 7.292 5.229 1.00 . A A . 10 LYS HG3 1 1 11 4677 1 1 10 LYS HZ1 H -5.952 8.470 9.508 1.00 . A A . 10 LYS HZ1 1 1 11 4678 1 1 10 LYS HZ2 H -4.290 8.725 9.293 1.00 . A A . 10 LYS HZ2 1 1 11 4679 1 1 10 LYS HZ3 H -4.917 7.152 9.263 1.00 . A A . 10 LYS HZ3 1 1 11 4680 1 1 10 LYS N N -4.538 5.002 3.500 1.00 . A A . 10 LYS N 1 1 11 4681 1 1 10 LYS NZ N -5.102 8.140 9.009 1.00 . A A . 10 LYS NZ 1 1 11 4682 1 1 10 LYS O O -3.493 3.683 6.560 1.00 . A A . 10 LYS O 1 1 11 4683 1 1 11 ASN C C -3.648 0.490 4.656 1.00 . A A . 11 ASN C 1 1 11 4684 1 1 11 ASN CA C -4.448 1.319 5.676 1.00 . A A . 11 ASN CA 1 1 11 4685 1 1 11 ASN CB C -5.793 0.657 6.006 1.00 . A A . 11 ASN CB 1 1 11 4686 1 1 11 ASN CG C -6.609 0.453 4.731 1.00 . A A . 11 ASN CG 1 1 11 4687 1 1 11 ASN H H -5.399 2.726 4.341 1.00 . A A . 11 ASN H 1 1 11 4688 1 1 11 ASN HA H -3.872 1.443 6.583 1.00 . A A . 11 ASN HA 1 1 11 4689 1 1 11 ASN HB2 H -5.615 -0.300 6.472 1.00 . A A . 11 ASN HB2 1 1 11 4690 1 1 11 ASN HB3 H -6.349 1.287 6.686 1.00 . A A . 11 ASN HB3 1 1 11 4691 1 1 11 ASN HD21 H -6.413 -1.514 4.745 1.00 . A A . 11 ASN HD21 1 1 11 4692 1 1 11 ASN HD22 H -7.306 -0.884 3.451 1.00 . A A . 11 ASN HD22 1 1 11 4693 1 1 11 ASN N N -4.784 2.660 5.104 1.00 . A A . 11 ASN N 1 1 11 4694 1 1 11 ASN ND2 N -6.793 -0.749 4.273 1.00 . A A . 11 ASN ND2 1 1 11 4695 1 1 11 ASN O O -3.864 0.573 3.465 1.00 . A A . 11 ASN O 1 1 11 4696 1 1 11 ASN OD1 O -7.093 1.404 4.149 1.00 . A A . 11 ASN OD1 1 1 11 4697 1 1 12 LYS C C -2.723 -2.084 3.337 1.00 . A A . 12 LYS C 1 1 11 4698 1 1 12 LYS CA C -1.873 -1.129 4.196 1.00 . A A . 12 LYS CA 1 1 11 4699 1 1 12 LYS CB C -0.931 -1.923 5.129 1.00 . A A . 12 LYS CB 1 1 11 4700 1 1 12 LYS CD C 1.112 -3.403 4.979 1.00 . A A . 12 LYS CD 1 1 11 4701 1 1 12 LYS CE C 1.921 -4.283 4.007 1.00 . A A . 12 LYS CE 1 1 11 4702 1 1 12 LYS CG C -0.251 -3.066 4.354 1.00 . A A . 12 LYS CG 1 1 11 4703 1 1 12 LYS H H -2.565 -0.339 6.089 1.00 . A A . 12 LYS H 1 1 11 4704 1 1 12 LYS HA H -1.290 -0.485 3.556 1.00 . A A . 12 LYS HA 1 1 11 4705 1 1 12 LYS HB2 H -0.178 -1.257 5.521 1.00 . A A . 12 LYS HB2 1 1 11 4706 1 1 12 LYS HB3 H -1.505 -2.336 5.944 1.00 . A A . 12 LYS HB3 1 1 11 4707 1 1 12 LYS HD2 H 1.653 -2.489 5.172 1.00 . A A . 12 LYS HD2 1 1 11 4708 1 1 12 LYS HD3 H 0.961 -3.937 5.905 1.00 . A A . 12 LYS HD3 1 1 11 4709 1 1 12 LYS HE2 H 1.288 -5.057 3.590 1.00 . A A . 12 LYS HE2 1 1 11 4710 1 1 12 LYS HE3 H 2.337 -3.680 3.215 1.00 . A A . 12 LYS HE3 1 1 11 4711 1 1 12 LYS HG2 H -0.884 -3.940 4.383 1.00 . A A . 12 LYS HG2 1 1 11 4712 1 1 12 LYS HG3 H -0.111 -2.766 3.330 1.00 . A A . 12 LYS HG3 1 1 11 4713 1 1 12 LYS HZ1 H 3.110 -4.398 5.728 1.00 . A A . 12 LYS HZ1 1 1 11 4714 1 1 12 LYS HZ2 H 3.933 -4.807 4.294 1.00 . A A . 12 LYS HZ2 1 1 11 4715 1 1 12 LYS HZ3 H 2.819 -5.895 4.987 1.00 . A A . 12 LYS HZ3 1 1 11 4716 1 1 12 LYS N N -2.718 -0.300 5.122 1.00 . A A . 12 LYS N 1 1 11 4717 1 1 12 LYS NZ N 3.022 -4.889 4.820 1.00 . A A . 12 LYS NZ 1 1 11 4718 1 1 12 LYS O O -2.265 -2.571 2.321 1.00 . A A . 12 LYS O 1 1 11 4719 1 1 13 LYS C C -5.602 -2.589 1.837 1.00 . A A . 13 LYS C 1 1 11 4720 1 1 13 LYS CA C -4.769 -3.320 2.911 1.00 . A A . 13 LYS CA 1 1 11 4721 1 1 13 LYS CB C -5.692 -4.036 3.915 1.00 . A A . 13 LYS CB 1 1 11 4722 1 1 13 LYS CD C -5.672 -5.599 5.885 1.00 . A A . 13 LYS CD 1 1 11 4723 1 1 13 LYS CE C -6.054 -5.095 7.286 1.00 . A A . 13 LYS CE 1 1 11 4724 1 1 13 LYS CG C -4.886 -4.513 5.134 1.00 . A A . 13 LYS CG 1 1 11 4725 1 1 13 LYS H H -4.300 -1.986 4.548 1.00 . A A . 13 LYS H 1 1 11 4726 1 1 13 LYS HA H -4.129 -4.047 2.438 1.00 . A A . 13 LYS HA 1 1 11 4727 1 1 13 LYS HB2 H -6.468 -3.357 4.237 1.00 . A A . 13 LYS HB2 1 1 11 4728 1 1 13 LYS HB3 H -6.142 -4.890 3.431 1.00 . A A . 13 LYS HB3 1 1 11 4729 1 1 13 LYS HD2 H -6.570 -5.840 5.332 1.00 . A A . 13 LYS HD2 1 1 11 4730 1 1 13 LYS HD3 H -5.060 -6.483 5.976 1.00 . A A . 13 LYS HD3 1 1 11 4731 1 1 13 LYS HE2 H -5.657 -4.103 7.449 1.00 . A A . 13 LYS HE2 1 1 11 4732 1 1 13 LYS HE3 H -7.129 -5.091 7.400 1.00 . A A . 13 LYS HE3 1 1 11 4733 1 1 13 LYS HG2 H -3.941 -4.918 4.803 1.00 . A A . 13 LYS HG2 1 1 11 4734 1 1 13 LYS HG3 H -4.707 -3.677 5.796 1.00 . A A . 13 LYS HG3 1 1 11 4735 1 1 13 LYS HZ1 H -5.636 -5.757 9.218 1.00 . A A . 13 LYS HZ1 1 1 11 4736 1 1 13 LYS HZ2 H -4.413 -6.109 8.096 1.00 . A A . 13 LYS HZ2 1 1 11 4737 1 1 13 LYS HZ3 H -5.853 -7.012 8.099 1.00 . A A . 13 LYS HZ3 1 1 11 4738 1 1 13 LYS N N -3.940 -2.374 3.725 1.00 . A A . 13 LYS N 1 1 11 4739 1 1 13 LYS NZ N -5.443 -6.066 8.244 1.00 . A A . 13 LYS NZ 1 1 11 4740 1 1 13 LYS O O -6.460 -3.187 1.221 1.00 . A A . 13 LYS O 1 1 11 4741 1 1 14 GLU C C -5.408 -0.510 -0.797 1.00 . A A . 14 GLU C 1 1 11 4742 1 1 14 GLU CA C -6.176 -0.610 0.535 1.00 . A A . 14 GLU CA 1 1 11 4743 1 1 14 GLU CB C -6.491 0.785 1.101 1.00 . A A . 14 GLU CB 1 1 11 4744 1 1 14 GLU CD C -5.794 3.156 0.685 1.00 . A A . 14 GLU CD 1 1 11 4745 1 1 14 GLU CG C -5.293 1.731 0.933 1.00 . A A . 14 GLU CG 1 1 11 4746 1 1 14 GLU H H -4.668 -0.831 2.083 1.00 . A A . 14 GLU H 1 1 11 4747 1 1 14 GLU HA H -7.100 -1.144 0.377 1.00 . A A . 14 GLU HA 1 1 11 4748 1 1 14 GLU HB2 H -7.342 1.192 0.576 1.00 . A A . 14 GLU HB2 1 1 11 4749 1 1 14 GLU HB3 H -6.732 0.696 2.148 1.00 . A A . 14 GLU HB3 1 1 11 4750 1 1 14 GLU HG2 H -4.694 1.714 1.829 1.00 . A A . 14 GLU HG2 1 1 11 4751 1 1 14 GLU HG3 H -4.694 1.412 0.095 1.00 . A A . 14 GLU HG3 1 1 11 4752 1 1 14 GLU N N -5.367 -1.316 1.588 1.00 . A A . 14 GLU N 1 1 11 4753 1 1 14 GLU O O -5.976 -0.161 -1.818 1.00 . A A . 14 GLU O 1 1 11 4754 1 1 14 GLU OE1 O -6.153 3.814 1.643 1.00 . A A . 14 GLU OE1 1 1 11 4755 1 1 14 GLU OE2 O -5.793 3.575 -0.461 1.00 . A A . 14 GLU OE2 1 1 11 4756 1 1 15 CYS C C -3.682 -1.938 -2.982 1.00 . A A . 15 CYS C 1 1 11 4757 1 1 15 CYS CA C -3.365 -0.719 -2.098 1.00 . A A . 15 CYS CA 1 1 11 4758 1 1 15 CYS CB C -1.872 -0.717 -1.724 1.00 . A A . 15 CYS CB 1 1 11 4759 1 1 15 CYS H H -3.679 -1.085 0.019 1.00 . A A . 15 CYS H 1 1 11 4760 1 1 15 CYS HA H -3.613 0.192 -2.617 1.00 . A A . 15 CYS HA 1 1 11 4761 1 1 15 CYS HB2 H -1.524 -1.737 -1.661 1.00 . A A . 15 CYS HB2 1 1 11 4762 1 1 15 CYS HB3 H -1.312 -0.199 -2.491 1.00 . A A . 15 CYS HB3 1 1 11 4763 1 1 15 CYS N N -4.130 -0.807 -0.809 1.00 . A A . 15 CYS N 1 1 11 4764 1 1 15 CYS O O -3.769 -3.049 -2.500 1.00 . A A . 15 CYS O 1 1 11 4765 1 1 15 CYS SG S -1.605 0.103 -0.123 1.00 . A A . 15 CYS SG 1 1 11 4766 1 1 16 CYS C C -2.984 -3.899 -5.102 1.00 . A A . 16 CYS C 1 1 11 4767 1 1 16 CYS CA C -4.129 -2.890 -5.194 1.00 . A A . 16 CYS CA 1 1 11 4768 1 1 16 CYS CB C -4.201 -2.291 -6.605 1.00 . A A . 16 CYS CB 1 1 11 4769 1 1 16 CYS H H -3.748 -0.834 -4.639 1.00 . A A . 16 CYS H 1 1 11 4770 1 1 16 CYS HA H -5.062 -3.363 -4.935 1.00 . A A . 16 CYS HA 1 1 11 4771 1 1 16 CYS HB2 H -3.292 -1.742 -6.807 1.00 . A A . 16 CYS HB2 1 1 11 4772 1 1 16 CYS HB3 H -4.303 -3.086 -7.327 1.00 . A A . 16 CYS HB3 1 1 11 4773 1 1 16 CYS N N -3.838 -1.743 -4.272 1.00 . A A . 16 CYS N 1 1 11 4774 1 1 16 CYS O O -3.190 -5.054 -4.788 1.00 . A A . 16 CYS O 1 1 11 4775 1 1 16 CYS SG S -5.620 -1.170 -6.737 1.00 . A A . 16 CYS SG 1 1 11 4776 1 1 17 GLY C C -0.206 -4.403 -3.754 1.00 . A A . 17 GLY C 1 1 11 4777 1 1 17 GLY CA C -0.614 -4.385 -5.223 1.00 . A A . 17 GLY CA 1 1 11 4778 1 1 17 GLY H H -1.624 -2.519 -5.565 1.00 . A A . 17 GLY H 1 1 11 4779 1 1 17 GLY HA2 H -0.902 -5.379 -5.541 1.00 . A A . 17 GLY HA2 1 1 11 4780 1 1 17 GLY HA3 H 0.206 -4.029 -5.824 1.00 . A A . 17 GLY HA3 1 1 11 4781 1 1 17 GLY N N -1.774 -3.461 -5.340 1.00 . A A . 17 GLY N 1 1 11 4782 1 1 17 GLY O O 0.405 -3.468 -3.278 1.00 . A A . 17 GLY O 1 1 11 4783 1 1 18 TRP C C 1.036 -4.857 -1.181 1.00 . A A . 18 TRP C 1 1 11 4784 1 1 18 TRP CA C -0.288 -5.540 -1.561 1.00 . A A . 18 TRP CA 1 1 11 4785 1 1 18 TRP CB C -0.216 -7.044 -1.270 1.00 . A A . 18 TRP CB 1 1 11 4786 1 1 18 TRP CD1 C -2.350 -6.879 0.091 1.00 . A A . 18 TRP CD1 1 1 11 4787 1 1 18 TRP CD2 C -2.225 -8.782 -1.100 1.00 . A A . 18 TRP CD2 1 1 11 4788 1 1 18 TRP CE2 C -3.452 -8.822 -0.397 1.00 . A A . 18 TRP CE2 1 1 11 4789 1 1 18 TRP CE3 C -1.904 -9.869 -1.930 1.00 . A A . 18 TRP CE3 1 1 11 4790 1 1 18 TRP CG C -1.543 -7.537 -0.777 1.00 . A A . 18 TRP CG 1 1 11 4791 1 1 18 TRP CH2 C -3.993 -10.974 -1.343 1.00 . A A . 18 TRP CH2 1 1 11 4792 1 1 18 TRP CZ2 C -4.327 -9.901 -0.513 1.00 . A A . 18 TRP CZ2 1 1 11 4793 1 1 18 TRP CZ3 C -2.783 -10.958 -2.050 1.00 . A A . 18 TRP CZ3 1 1 11 4794 1 1 18 TRP H H -1.123 -6.139 -3.460 1.00 . A A . 18 TRP H 1 1 11 4795 1 1 18 TRP HA H -1.095 -5.106 -0.992 1.00 . A A . 18 TRP HA 1 1 11 4796 1 1 18 TRP HB2 H 0.048 -7.571 -2.175 1.00 . A A . 18 TRP HB2 1 1 11 4797 1 1 18 TRP HB3 H 0.537 -7.228 -0.517 1.00 . A A . 18 TRP HB3 1 1 11 4798 1 1 18 TRP HD1 H -2.146 -5.916 0.535 1.00 . A A . 18 TRP HD1 1 1 11 4799 1 1 18 TRP HE1 H -4.225 -7.392 0.901 1.00 . A A . 18 TRP HE1 1 1 11 4800 1 1 18 TRP HE3 H -0.973 -9.869 -2.478 1.00 . A A . 18 TRP HE3 1 1 11 4801 1 1 18 TRP HH2 H -4.666 -11.813 -1.439 1.00 . A A . 18 TRP HH2 1 1 11 4802 1 1 18 TRP HZ2 H -5.260 -9.907 0.035 1.00 . A A . 18 TRP HZ2 1 1 11 4803 1 1 18 TRP HZ3 H -2.526 -11.787 -2.692 1.00 . A A . 18 TRP HZ3 1 1 11 4804 1 1 18 TRP N N -0.591 -5.434 -3.035 1.00 . A A . 18 TRP N 1 1 11 4805 1 1 18 TRP NE1 N -3.481 -7.641 0.315 1.00 . A A . 18 TRP NE1 1 1 11 4806 1 1 18 TRP O O 2.088 -5.470 -1.162 1.00 . A A . 18 TRP O 1 1 11 4807 1 1 19 ASN C C 1.957 -2.334 0.994 1.00 . A A . 19 ASN C 1 1 11 4808 1 1 19 ASN CA C 2.179 -2.829 -0.433 1.00 . A A . 19 ASN CA 1 1 11 4809 1 1 19 ASN CB C 2.287 -1.656 -1.423 1.00 . A A . 19 ASN CB 1 1 11 4810 1 1 19 ASN CG C 3.723 -1.559 -1.966 1.00 . A A . 19 ASN CG 1 1 11 4811 1 1 19 ASN H H 0.093 -3.150 -0.856 1.00 . A A . 19 ASN H 1 1 11 4812 1 1 19 ASN HA H 3.063 -3.449 -0.485 1.00 . A A . 19 ASN HA 1 1 11 4813 1 1 19 ASN HB2 H 1.604 -1.819 -2.246 1.00 . A A . 19 ASN HB2 1 1 11 4814 1 1 19 ASN HB3 H 2.031 -0.737 -0.921 1.00 . A A . 19 ASN HB3 1 1 11 4815 1 1 19 ASN HD21 H 3.646 0.395 -2.299 1.00 . A A . 19 ASN HD21 1 1 11 4816 1 1 19 ASN HD22 H 5.112 -0.351 -2.702 1.00 . A A . 19 ASN HD22 1 1 11 4817 1 1 19 ASN N N 0.965 -3.597 -0.849 1.00 . A A . 19 ASN N 1 1 11 4818 1 1 19 ASN ND2 N 4.198 -0.409 -2.353 1.00 . A A . 19 ASN ND2 1 1 11 4819 1 1 19 ASN O O 1.023 -2.749 1.647 1.00 . A A . 19 ASN O 1 1 11 4820 1 1 19 ASN OD1 O 4.422 -2.545 -2.036 1.00 . A A . 19 ASN OD1 1 1 11 4821 1 1 20 ALA C C 2.278 0.515 2.931 1.00 . A A . 20 ALA C 1 1 11 4822 1 1 20 ALA CA C 2.567 -0.981 2.893 1.00 . A A . 20 ALA CA 1 1 11 4823 1 1 20 ALA CB C 3.869 -1.265 3.633 1.00 . A A . 20 ALA CB 1 1 11 4824 1 1 20 ALA H H 3.538 -1.131 0.965 1.00 . A A . 20 ALA H 1 1 11 4825 1 1 20 ALA HA H 1.762 -1.527 3.351 1.00 . A A . 20 ALA HA 1 1 11 4826 1 1 20 ALA HB1 H 4.099 -2.316 3.583 1.00 . A A . 20 ALA HB1 1 1 11 4827 1 1 20 ALA HB2 H 3.766 -0.963 4.667 1.00 . A A . 20 ALA HB2 1 1 11 4828 1 1 20 ALA HB3 H 4.668 -0.702 3.174 1.00 . A A . 20 ALA HB3 1 1 11 4829 1 1 20 ALA N N 2.784 -1.463 1.495 1.00 . A A . 20 ALA N 1 1 11 4830 1 1 20 ALA O O 2.993 1.310 2.348 1.00 . A A . 20 ALA O 1 1 11 4831 1 1 21 CYS C C 1.887 2.950 4.823 1.00 . A A . 21 CYS C 1 1 11 4832 1 1 21 CYS CA C 0.948 2.360 3.767 1.00 . A A . 21 CYS CA 1 1 11 4833 1 1 21 CYS CB C -0.514 2.439 4.217 1.00 . A A . 21 CYS CB 1 1 11 4834 1 1 21 CYS H H 0.720 0.250 4.125 1.00 . A A . 21 CYS H 1 1 11 4835 1 1 21 CYS HA H 1.073 2.857 2.820 1.00 . A A . 21 CYS HA 1 1 11 4836 1 1 21 CYS HB2 H -1.036 1.542 3.914 1.00 . A A . 21 CYS HB2 1 1 11 4837 1 1 21 CYS HB3 H -0.560 2.538 5.291 1.00 . A A . 21 CYS HB3 1 1 11 4838 1 1 21 CYS N N 1.260 0.908 3.645 1.00 . A A . 21 CYS N 1 1 11 4839 1 1 21 CYS O O 1.610 2.907 6.009 1.00 . A A . 21 CYS O 1 1 11 4840 1 1 21 CYS SG S -1.291 3.874 3.444 1.00 . A A . 21 CYS SG 1 1 11 4841 1 1 22 ALA C C 4.153 5.524 5.251 1.00 . A A . 22 ALA C 1 1 11 4842 1 1 22 ALA CA C 4.003 4.005 5.382 1.00 . A A . 22 ALA CA 1 1 11 4843 1 1 22 ALA CB C 5.314 3.298 5.029 1.00 . A A . 22 ALA CB 1 1 11 4844 1 1 22 ALA H H 3.227 3.451 3.443 1.00 . A A . 22 ALA H 1 1 11 4845 1 1 22 ALA HA H 3.711 3.751 6.389 1.00 . A A . 22 ALA HA 1 1 11 4846 1 1 22 ALA HB1 H 5.300 2.296 5.428 1.00 . A A . 22 ALA HB1 1 1 11 4847 1 1 22 ALA HB2 H 6.143 3.846 5.453 1.00 . A A . 22 ALA HB2 1 1 11 4848 1 1 22 ALA HB3 H 5.424 3.255 3.952 1.00 . A A . 22 ALA HB3 1 1 11 4849 1 1 22 ALA N N 3.016 3.459 4.403 1.00 . A A . 22 ALA N 1 1 11 4850 1 1 22 ALA O O 3.617 6.276 6.040 1.00 . A A . 22 ALA O 1 1 11 4851 1 1 23 LEU C C 3.840 8.129 3.543 1.00 . A A . 23 LEU C 1 1 11 4852 1 1 23 LEU CA C 5.103 7.458 4.115 1.00 . A A . 23 LEU CA 1 1 11 4853 1 1 23 LEU CB C 6.276 7.573 3.127 1.00 . A A . 23 LEU CB 1 1 11 4854 1 1 23 LEU CD1 C 7.472 6.439 5.071 1.00 . A A . 23 LEU CD1 1 1 11 4855 1 1 23 LEU CD2 C 8.563 6.582 2.841 1.00 . A A . 23 LEU CD2 1 1 11 4856 1 1 23 LEU CG C 7.636 7.308 3.818 1.00 . A A . 23 LEU CG 1 1 11 4857 1 1 23 LEU H H 5.327 5.361 3.658 1.00 . A A . 23 LEU H 1 1 11 4858 1 1 23 LEU HA H 5.372 7.907 5.058 1.00 . A A . 23 LEU HA 1 1 11 4859 1 1 23 LEU HB2 H 6.136 6.858 2.331 1.00 . A A . 23 LEU HB2 1 1 11 4860 1 1 23 LEU HB3 H 6.281 8.570 2.704 1.00 . A A . 23 LEU HB3 1 1 11 4861 1 1 23 LEU HD11 H 6.753 6.890 5.739 1.00 . A A . 23 LEU HD11 1 1 11 4862 1 1 23 LEU HD12 H 8.425 6.357 5.576 1.00 . A A . 23 LEU HD12 1 1 11 4863 1 1 23 LEU HD13 H 7.131 5.456 4.787 1.00 . A A . 23 LEU HD13 1 1 11 4864 1 1 23 LEU HD21 H 9.588 6.808 3.087 1.00 . A A . 23 LEU HD21 1 1 11 4865 1 1 23 LEU HD22 H 8.353 6.905 1.833 1.00 . A A . 23 LEU HD22 1 1 11 4866 1 1 23 LEU HD23 H 8.402 5.515 2.918 1.00 . A A . 23 LEU HD23 1 1 11 4867 1 1 23 LEU HG H 8.081 8.253 4.098 1.00 . A A . 23 LEU HG 1 1 11 4868 1 1 23 LEU N N 4.894 5.985 4.276 1.00 . A A . 23 LEU N 1 1 11 4869 1 1 23 LEU O O 3.900 8.825 2.549 1.00 . A A . 23 LEU O 1 1 11 4870 1 1 24 GLY C C 1.027 7.873 2.312 1.00 . A A . 24 GLY C 1 1 11 4871 1 1 24 GLY CA C 1.441 8.541 3.633 1.00 . A A . 24 GLY CA 1 1 11 4872 1 1 24 GLY H H 2.671 7.352 4.955 1.00 . A A . 24 GLY H 1 1 11 4873 1 1 24 GLY HA2 H 0.653 8.420 4.363 1.00 . A A . 24 GLY HA2 1 1 11 4874 1 1 24 GLY HA3 H 1.609 9.591 3.457 1.00 . A A . 24 GLY HA3 1 1 11 4875 1 1 24 GLY N N 2.702 7.919 4.154 1.00 . A A . 24 GLY N 1 1 11 4876 1 1 24 GLY O O 0.131 8.342 1.631 1.00 . A A . 24 GLY O 1 1 11 4877 1 1 25 ILE C C 1.651 4.606 0.761 1.00 . A A . 25 ILE C 1 1 11 4878 1 1 25 ILE CA C 1.301 6.089 0.667 1.00 . A A . 25 ILE CA 1 1 11 4879 1 1 25 ILE CB C 2.135 6.732 -0.455 1.00 . A A . 25 ILE CB 1 1 11 4880 1 1 25 ILE CD1 C 3.955 8.331 -1.046 1.00 . A A . 25 ILE CD1 1 1 11 4881 1 1 25 ILE CG1 C 3.204 7.674 0.107 1.00 . A A . 25 ILE CG1 1 1 11 4882 1 1 25 ILE CG2 C 1.220 7.521 -1.382 1.00 . A A . 25 ILE CG2 1 1 11 4883 1 1 25 ILE H H 2.375 6.415 2.507 1.00 . A A . 25 ILE H 1 1 11 4884 1 1 25 ILE HA H 0.251 6.217 0.456 1.00 . A A . 25 ILE HA 1 1 11 4885 1 1 25 ILE HB H 2.610 5.949 -1.022 1.00 . A A . 25 ILE HB 1 1 11 4886 1 1 25 ILE HD11 H 4.638 9.068 -0.656 1.00 . A A . 25 ILE HD11 1 1 11 4887 1 1 25 ILE HD12 H 3.247 8.808 -1.707 1.00 . A A . 25 ILE HD12 1 1 11 4888 1 1 25 ILE HD13 H 4.506 7.579 -1.592 1.00 . A A . 25 ILE HD13 1 1 11 4889 1 1 25 ILE HG12 H 2.729 8.436 0.705 1.00 . A A . 25 ILE HG12 1 1 11 4890 1 1 25 ILE HG13 H 3.897 7.114 0.715 1.00 . A A . 25 ILE HG13 1 1 11 4891 1 1 25 ILE HG21 H 0.652 8.235 -0.809 1.00 . A A . 25 ILE HG21 1 1 11 4892 1 1 25 ILE HG22 H 0.550 6.839 -1.880 1.00 . A A . 25 ILE HG22 1 1 11 4893 1 1 25 ILE HG23 H 1.816 8.039 -2.120 1.00 . A A . 25 ILE HG23 1 1 11 4894 1 1 25 ILE N N 1.660 6.783 1.944 1.00 . A A . 25 ILE N 1 1 11 4895 1 1 25 ILE O O 2.231 4.154 1.732 1.00 . A A . 25 ILE O 1 1 11 4896 1 1 26 CYS C C 3.108 2.232 -0.794 1.00 . A A . 26 CYS C 1 1 11 4897 1 1 26 CYS CA C 1.682 2.401 -0.259 1.00 . A A . 26 CYS CA 1 1 11 4898 1 1 26 CYS CB C 0.670 1.768 -1.224 1.00 . A A . 26 CYS CB 1 1 11 4899 1 1 26 CYS H H 0.905 4.262 -1.052 1.00 . A A . 26 CYS H 1 1 11 4900 1 1 26 CYS HA H 1.584 1.981 0.728 1.00 . A A . 26 CYS HA 1 1 11 4901 1 1 26 CYS HB2 H 0.749 2.248 -2.187 1.00 . A A . 26 CYS HB2 1 1 11 4902 1 1 26 CYS HB3 H 0.882 0.719 -1.333 1.00 . A A . 26 CYS HB3 1 1 11 4903 1 1 26 CYS N N 1.341 3.857 -0.259 1.00 . A A . 26 CYS N 1 1 11 4904 1 1 26 CYS O O 3.331 2.383 -1.971 1.00 . A A . 26 CYS O 1 1 11 4905 1 1 26 CYS SG S -1.013 1.980 -0.589 1.00 . A A . 26 CYS SG 1 1 11 4906 1 1 27 MET C C 6.285 0.670 0.111 1.00 . A A . 27 MET C 1 1 11 4907 1 1 27 MET CA C 5.474 1.820 -0.523 1.00 . A A . 27 MET CA 1 1 11 4908 1 1 27 MET CB C 6.121 3.188 -0.266 1.00 . A A . 27 MET CB 1 1 11 4909 1 1 27 MET CE C 8.673 4.274 -1.806 1.00 . A A . 27 MET CE 1 1 11 4910 1 1 27 MET CG C 5.973 4.065 -1.508 1.00 . A A . 27 MET CG 1 1 11 4911 1 1 27 MET H H 3.917 1.828 0.993 1.00 . A A . 27 MET H 1 1 11 4912 1 1 27 MET HA H 5.416 1.662 -1.585 1.00 . A A . 27 MET HA 1 1 11 4913 1 1 27 MET HB2 H 5.631 3.665 0.571 1.00 . A A . 27 MET HB2 1 1 11 4914 1 1 27 MET HB3 H 7.170 3.056 -0.043 1.00 . A A . 27 MET HB3 1 1 11 4915 1 1 27 MET HE1 H 9.398 3.484 -1.652 1.00 . A A . 27 MET HE1 1 1 11 4916 1 1 27 MET HE2 H 8.354 4.655 -0.850 1.00 . A A . 27 MET HE2 1 1 11 4917 1 1 27 MET HE3 H 9.124 5.075 -2.378 1.00 . A A . 27 MET HE3 1 1 11 4918 1 1 27 MET HG2 H 4.996 3.912 -1.943 1.00 . A A . 27 MET HG2 1 1 11 4919 1 1 27 MET HG3 H 6.084 5.102 -1.229 1.00 . A A . 27 MET HG3 1 1 11 4920 1 1 27 MET N N 4.087 1.943 0.031 1.00 . A A . 27 MET N 1 1 11 4921 1 1 27 MET O O 6.431 -0.369 -0.502 1.00 . A A . 27 MET O 1 1 11 4922 1 1 27 MET SD S 7.248 3.621 -2.713 1.00 . A A . 27 MET SD 1 1 11 4923 1 1 28 PRO C C 6.829 -1.343 2.396 1.00 . A A . 28 PRO C 1 1 11 4924 1 1 28 PRO CA C 7.673 -0.149 1.946 1.00 . A A . 28 PRO CA 1 1 11 4925 1 1 28 PRO CB C 8.282 0.586 3.147 1.00 . A A . 28 PRO CB 1 1 11 4926 1 1 28 PRO CD C 6.714 2.092 2.130 1.00 . A A . 28 PRO CD 1 1 11 4927 1 1 28 PRO CG C 7.318 1.680 3.447 1.00 . A A . 28 PRO CG 1 1 11 4928 1 1 28 PRO HA H 8.451 -0.468 1.275 1.00 . A A . 28 PRO HA 1 1 11 4929 1 1 28 PRO HB2 H 8.378 -0.076 3.996 1.00 . A A . 28 PRO HB2 1 1 11 4930 1 1 28 PRO HB3 H 9.240 1.011 2.891 1.00 . A A . 28 PRO HB3 1 1 11 4931 1 1 28 PRO HD2 H 5.679 2.371 2.254 1.00 . A A . 28 PRO HD2 1 1 11 4932 1 1 28 PRO HD3 H 7.278 2.902 1.692 1.00 . A A . 28 PRO HD3 1 1 11 4933 1 1 28 PRO HG2 H 6.550 1.322 4.125 1.00 . A A . 28 PRO HG2 1 1 11 4934 1 1 28 PRO HG3 H 7.842 2.513 3.885 1.00 . A A . 28 PRO HG3 1 1 11 4935 1 1 28 PRO N N 6.832 0.893 1.291 1.00 . A A . 28 PRO N 1 1 11 4936 1 1 28 PRO O O 6.534 -1.491 3.567 1.00 . A A . 28 PRO O 1 1 11 4937 1 1 29 ARG C C 6.187 -4.182 2.980 1.00 . A A . 29 ARG C 1 1 11 4938 1 1 29 ARG CA C 5.606 -3.390 1.797 1.00 . A A . 29 ARG CA 1 1 11 4939 1 1 29 ARG CB C 5.597 -4.243 0.517 1.00 . A A . 29 ARG CB 1 1 11 4940 1 1 29 ARG CD C 7.235 -6.135 0.588 1.00 . A A . 29 ARG CD 1 1 11 4941 1 1 29 ARG CG C 7.023 -4.682 0.157 1.00 . A A . 29 ARG CG 1 1 11 4942 1 1 29 ARG CZ C 8.775 -7.879 -0.155 1.00 . A A . 29 ARG CZ 1 1 11 4943 1 1 29 ARG H H 6.706 -2.020 0.535 1.00 . A A . 29 ARG H 1 1 11 4944 1 1 29 ARG HA H 4.599 -3.085 2.023 1.00 . A A . 29 ARG HA 1 1 11 4945 1 1 29 ARG HB2 H 4.983 -5.116 0.676 1.00 . A A . 29 ARG HB2 1 1 11 4946 1 1 29 ARG HB3 H 5.187 -3.663 -0.296 1.00 . A A . 29 ARG HB3 1 1 11 4947 1 1 29 ARG HD2 H 7.539 -6.172 1.627 1.00 . A A . 29 ARG HD2 1 1 11 4948 1 1 29 ARG HD3 H 6.331 -6.707 0.442 1.00 . A A . 29 ARG HD3 1 1 11 4949 1 1 29 ARG HE H 8.704 -6.076 -0.995 1.00 . A A . 29 ARG HE 1 1 11 4950 1 1 29 ARG HG2 H 7.164 -4.595 -0.911 1.00 . A A . 29 ARG HG2 1 1 11 4951 1 1 29 ARG HG3 H 7.731 -4.048 0.665 1.00 . A A . 29 ARG HG3 1 1 11 4952 1 1 29 ARG HH11 H 7.549 -8.343 1.366 1.00 . A A . 29 ARG HH11 1 1 11 4953 1 1 29 ARG HH12 H 8.623 -9.600 0.865 1.00 . A A . 29 ARG HH12 1 1 11 4954 1 1 29 ARG HH21 H 10.106 -7.715 -1.648 1.00 . A A . 29 ARG HH21 1 1 11 4955 1 1 29 ARG HH22 H 10.086 -9.239 -0.828 1.00 . A A . 29 ARG HH22 1 1 11 4956 1 1 29 ARG N N 6.444 -2.185 1.466 1.00 . A A . 29 ARG N 1 1 11 4957 1 1 29 ARG NE N 8.325 -6.656 -0.298 1.00 . A A . 29 ARG NE 1 1 11 4958 1 1 29 ARG NH1 N 8.277 -8.667 0.764 1.00 . A A . 29 ARG NH1 1 1 11 4959 1 1 29 ARG NH2 N 9.728 -8.313 -0.941 1.00 . A A . 29 ARG NH2 1 1 11 4960 1 1 29 ARG O O 5.397 -4.702 3.752 1.00 . A A . 29 ARG O 1 1 11 4961 1 1 29 ARG OXT O 7.403 -4.260 3.096 1.00 . A A . 29 ARG OXT 1 1 12 4962 1 1 1 GLY C C -10.163 -0.349 -4.998 1.00 . A A . 1 GLY C 1 1 12 4963 1 1 1 GLY CA C -11.240 -0.635 -6.052 1.00 . A A . 1 GLY CA 1 1 12 4964 1 1 1 GLY H1 H -9.896 -2.075 -6.760 1.00 . A A . 1 GLY H1 1 1 12 4965 1 1 1 GLY H2 H -11.268 -1.865 -7.742 1.00 . A A . 1 GLY H2 1 1 12 4966 1 1 1 GLY H3 H -11.391 -2.705 -6.268 1.00 . A A . 1 GLY H3 1 1 12 4967 1 1 1 GLY HA2 H -11.271 0.172 -6.769 1.00 . A A . 1 GLY HA2 1 1 12 4968 1 1 1 GLY HA3 H -12.201 -0.719 -5.566 1.00 . A A . 1 GLY HA3 1 1 12 4969 1 1 1 GLY N N -10.924 -1.917 -6.759 1.00 . A A . 1 GLY N 1 1 12 4970 1 1 1 GLY O O -10.332 -0.644 -3.832 1.00 . A A . 1 GLY O 1 1 12 4971 1 1 2 CYS C C -6.915 1.447 -5.065 1.00 . A A . 2 CYS C 1 1 12 4972 1 1 2 CYS CA C -7.954 0.514 -4.418 1.00 . A A . 2 CYS CA 1 1 12 4973 1 1 2 CYS CB C -7.337 -0.858 -4.091 1.00 . A A . 2 CYS CB 1 1 12 4974 1 1 2 CYS H H -8.941 0.452 -6.344 1.00 . A A . 2 CYS H 1 1 12 4975 1 1 2 CYS HA H -8.355 0.960 -3.519 1.00 . A A . 2 CYS HA 1 1 12 4976 1 1 2 CYS HB2 H -6.374 -0.718 -3.628 1.00 . A A . 2 CYS HB2 1 1 12 4977 1 1 2 CYS HB3 H -7.984 -1.394 -3.411 1.00 . A A . 2 CYS HB3 1 1 12 4978 1 1 2 CYS N N -9.055 0.218 -5.397 1.00 . A A . 2 CYS N 1 1 12 4979 1 1 2 CYS O O -7.140 1.980 -6.135 1.00 . A A . 2 CYS O 1 1 12 4980 1 1 2 CYS SG S -7.130 -1.820 -5.609 1.00 . A A . 2 CYS SG 1 1 12 4981 1 1 3 LYS C C -3.447 1.806 -5.309 1.00 . A A . 3 LYS C 1 1 12 4982 1 1 3 LYS CA C -4.752 2.557 -5.045 1.00 . A A . 3 LYS CA 1 1 12 4983 1 1 3 LYS CB C -4.508 3.681 -4.030 1.00 . A A . 3 LYS CB 1 1 12 4984 1 1 3 LYS CD C -5.547 5.339 -2.477 1.00 . A A . 3 LYS CD 1 1 12 4985 1 1 3 LYS CE C -6.858 6.026 -2.068 1.00 . A A . 3 LYS CE 1 1 12 4986 1 1 3 LYS CG C -5.837 4.243 -3.509 1.00 . A A . 3 LYS CG 1 1 12 4987 1 1 3 LYS H H -5.610 1.217 -3.573 1.00 . A A . 3 LYS H 1 1 12 4988 1 1 3 LYS HA H -5.119 2.975 -5.965 1.00 . A A . 3 LYS HA 1 1 12 4989 1 1 3 LYS HB2 H -3.918 3.306 -3.203 1.00 . A A . 3 LYS HB2 1 1 12 4990 1 1 3 LYS HB3 H -3.967 4.470 -4.519 1.00 . A A . 3 LYS HB3 1 1 12 4991 1 1 3 LYS HD2 H -5.088 4.895 -1.603 1.00 . A A . 3 LYS HD2 1 1 12 4992 1 1 3 LYS HD3 H -4.877 6.071 -2.904 1.00 . A A . 3 LYS HD3 1 1 12 4993 1 1 3 LYS HE2 H -7.580 5.961 -2.871 1.00 . A A . 3 LYS HE2 1 1 12 4994 1 1 3 LYS HE3 H -7.252 5.576 -1.168 1.00 . A A . 3 LYS HE3 1 1 12 4995 1 1 3 LYS HG2 H -6.399 4.657 -4.333 1.00 . A A . 3 LYS HG2 1 1 12 4996 1 1 3 LYS HG3 H -6.408 3.456 -3.043 1.00 . A A . 3 LYS HG3 1 1 12 4997 1 1 3 LYS HZ1 H -7.288 7.933 -1.347 1.00 . A A . 3 LYS HZ1 1 1 12 4998 1 1 3 LYS HZ2 H -6.279 7.924 -2.708 1.00 . A A . 3 LYS HZ2 1 1 12 4999 1 1 3 LYS HZ3 H -5.654 7.489 -1.179 1.00 . A A . 3 LYS HZ3 1 1 12 5000 1 1 3 LYS N N -5.782 1.653 -4.437 1.00 . A A . 3 LYS N 1 1 12 5001 1 1 3 LYS NZ N -6.492 7.449 -1.808 1.00 . A A . 3 LYS NZ 1 1 12 5002 1 1 3 LYS O O -3.247 0.691 -4.858 1.00 . A A . 3 LYS O 1 1 12 5003 1 1 4 LEU C C -0.227 2.093 -5.243 1.00 . A A . 4 LEU C 1 1 12 5004 1 1 4 LEU CA C -1.244 1.792 -6.362 1.00 . A A . 4 LEU CA 1 1 12 5005 1 1 4 LEU CB C -0.833 2.438 -7.697 1.00 . A A . 4 LEU CB 1 1 12 5006 1 1 4 LEU CD1 C -2.838 1.112 -8.509 1.00 . A A . 4 LEU CD1 1 1 12 5007 1 1 4 LEU CD2 C -1.659 2.684 -10.047 1.00 . A A . 4 LEU CD2 1 1 12 5008 1 1 4 LEU CG C -1.472 1.699 -8.889 1.00 . A A . 4 LEU CG 1 1 12 5009 1 1 4 LEU H H -2.758 3.323 -6.380 1.00 . A A . 4 LEU H 1 1 12 5010 1 1 4 LEU HA H -1.360 0.729 -6.488 1.00 . A A . 4 LEU HA 1 1 12 5011 1 1 4 LEU HB2 H -1.153 3.468 -7.704 1.00 . A A . 4 LEU HB2 1 1 12 5012 1 1 4 LEU HB3 H 0.239 2.403 -7.799 1.00 . A A . 4 LEU HB3 1 1 12 5013 1 1 4 LEU HD11 H -3.494 1.907 -8.178 1.00 . A A . 4 LEU HD11 1 1 12 5014 1 1 4 LEU HD12 H -2.714 0.395 -7.714 1.00 . A A . 4 LEU HD12 1 1 12 5015 1 1 4 LEU HD13 H -3.271 0.623 -9.369 1.00 . A A . 4 LEU HD13 1 1 12 5016 1 1 4 LEU HD21 H -0.728 3.194 -10.243 1.00 . A A . 4 LEU HD21 1 1 12 5017 1 1 4 LEU HD22 H -2.419 3.406 -9.784 1.00 . A A . 4 LEU HD22 1 1 12 5018 1 1 4 LEU HD23 H -1.966 2.144 -10.931 1.00 . A A . 4 LEU HD23 1 1 12 5019 1 1 4 LEU HG H -0.818 0.899 -9.205 1.00 . A A . 4 LEU HG 1 1 12 5020 1 1 4 LEU N N -2.559 2.426 -6.039 1.00 . A A . 4 LEU N 1 1 12 5021 1 1 4 LEU O O -0.592 2.250 -4.089 1.00 . A A . 4 LEU O 1 1 12 5022 1 1 5 THR C C 2.056 3.879 -4.043 1.00 . A A . 5 THR C 1 1 12 5023 1 1 5 THR CA C 2.081 2.414 -4.520 1.00 . A A . 5 THR CA 1 1 12 5024 1 1 5 THR CB C 3.427 2.085 -5.193 1.00 . A A . 5 THR CB 1 1 12 5025 1 1 5 THR CG2 C 4.222 1.114 -4.312 1.00 . A A . 5 THR CG2 1 1 12 5026 1 1 5 THR H H 1.320 2.009 -6.486 1.00 . A A . 5 THR H 1 1 12 5027 1 1 5 THR HA H 1.928 1.757 -3.683 1.00 . A A . 5 THR HA 1 1 12 5028 1 1 5 THR HB H 3.991 2.993 -5.315 1.00 . A A . 5 THR HB 1 1 12 5029 1 1 5 THR HG1 H 4.014 1.595 -6.996 1.00 . A A . 5 THR HG1 1 1 12 5030 1 1 5 THR HG21 H 3.548 0.390 -3.881 1.00 . A A . 5 THR HG21 1 1 12 5031 1 1 5 THR HG22 H 4.712 1.664 -3.521 1.00 . A A . 5 THR HG22 1 1 12 5032 1 1 5 THR HG23 H 4.964 0.604 -4.909 1.00 . A A . 5 THR HG23 1 1 12 5033 1 1 5 THR N N 1.041 2.154 -5.562 1.00 . A A . 5 THR N 1 1 12 5034 1 1 5 THR O O 1.650 4.167 -2.933 1.00 . A A . 5 THR O 1 1 12 5035 1 1 5 THR OG1 O 3.208 1.492 -6.475 1.00 . A A . 5 THR OG1 1 1 12 5036 1 1 6 PHE C C 1.133 6.871 -4.368 1.00 . A A . 6 PHE C 1 1 12 5037 1 1 6 PHE CA C 2.531 6.240 -4.432 1.00 . A A . 6 PHE CA 1 1 12 5038 1 1 6 PHE CB C 3.398 6.950 -5.480 1.00 . A A . 6 PHE CB 1 1 12 5039 1 1 6 PHE CD1 C 5.404 6.666 -3.968 1.00 . A A . 6 PHE CD1 1 1 12 5040 1 1 6 PHE CD2 C 5.653 6.207 -6.335 1.00 . A A . 6 PHE CD2 1 1 12 5041 1 1 6 PHE CE1 C 6.751 6.338 -3.764 1.00 . A A . 6 PHE CE1 1 1 12 5042 1 1 6 PHE CE2 C 6.999 5.877 -6.129 1.00 . A A . 6 PHE CE2 1 1 12 5043 1 1 6 PHE CG C 4.853 6.600 -5.255 1.00 . A A . 6 PHE CG 1 1 12 5044 1 1 6 PHE CZ C 7.548 5.945 -4.843 1.00 . A A . 6 PHE CZ 1 1 12 5045 1 1 6 PHE H H 2.831 4.554 -5.735 1.00 . A A . 6 PHE H 1 1 12 5046 1 1 6 PHE HA H 3.005 6.323 -3.468 1.00 . A A . 6 PHE HA 1 1 12 5047 1 1 6 PHE HB2 H 3.097 6.635 -6.469 1.00 . A A . 6 PHE HB2 1 1 12 5048 1 1 6 PHE HB3 H 3.267 8.020 -5.391 1.00 . A A . 6 PHE HB3 1 1 12 5049 1 1 6 PHE HD1 H 4.791 6.968 -3.133 1.00 . A A . 6 PHE HD1 1 1 12 5050 1 1 6 PHE HD2 H 5.231 6.155 -7.330 1.00 . A A . 6 PHE HD2 1 1 12 5051 1 1 6 PHE HE1 H 7.176 6.387 -2.768 1.00 . A A . 6 PHE HE1 1 1 12 5052 1 1 6 PHE HE2 H 7.619 5.573 -6.967 1.00 . A A . 6 PHE HE2 1 1 12 5053 1 1 6 PHE HZ H 8.586 5.686 -4.684 1.00 . A A . 6 PHE HZ 1 1 12 5054 1 1 6 PHE N N 2.499 4.803 -4.856 1.00 . A A . 6 PHE N 1 1 12 5055 1 1 6 PHE O O 0.975 8.047 -4.628 1.00 . A A . 6 PHE O 1 1 12 5056 1 1 7 TRP C C -1.518 6.985 -2.391 1.00 . A A . 7 TRP C 1 1 12 5057 1 1 7 TRP CA C -1.224 6.748 -3.867 1.00 . A A . 7 TRP CA 1 1 12 5058 1 1 7 TRP CB C -2.185 5.728 -4.455 1.00 . A A . 7 TRP CB 1 1 12 5059 1 1 7 TRP CD1 C -0.873 5.658 -6.608 1.00 . A A . 7 TRP CD1 1 1 12 5060 1 1 7 TRP CD2 C -3.095 5.742 -6.954 1.00 . A A . 7 TRP CD2 1 1 12 5061 1 1 7 TRP CE2 C -2.487 5.715 -8.229 1.00 . A A . 7 TRP CE2 1 1 12 5062 1 1 7 TRP CE3 C -4.499 5.793 -6.892 1.00 . A A . 7 TRP CE3 1 1 12 5063 1 1 7 TRP CG C -2.046 5.710 -5.941 1.00 . A A . 7 TRP CG 1 1 12 5064 1 1 7 TRP CH2 C -4.633 5.789 -9.323 1.00 . A A . 7 TRP CH2 1 1 12 5065 1 1 7 TRP CZ2 C -3.240 5.737 -9.401 1.00 . A A . 7 TRP CZ2 1 1 12 5066 1 1 7 TRP CZ3 C -5.263 5.816 -8.071 1.00 . A A . 7 TRP CZ3 1 1 12 5067 1 1 7 TRP H H 0.254 5.190 -3.745 1.00 . A A . 7 TRP H 1 1 12 5068 1 1 7 TRP HA H -1.273 7.673 -4.418 1.00 . A A . 7 TRP HA 1 1 12 5069 1 1 7 TRP HB2 H -1.960 4.747 -4.060 1.00 . A A . 7 TRP HB2 1 1 12 5070 1 1 7 TRP HB3 H -3.190 6.003 -4.191 1.00 . A A . 7 TRP HB3 1 1 12 5071 1 1 7 TRP HD1 H 0.108 5.620 -6.153 1.00 . A A . 7 TRP HD1 1 1 12 5072 1 1 7 TRP HE1 H -0.446 5.635 -8.670 1.00 . A A . 7 TRP HE1 1 1 12 5073 1 1 7 TRP HE3 H -4.990 5.809 -5.934 1.00 . A A . 7 TRP HE3 1 1 12 5074 1 1 7 TRP HH2 H -5.222 5.804 -10.227 1.00 . A A . 7 TRP HH2 1 1 12 5075 1 1 7 TRP HZ2 H -2.748 5.717 -10.365 1.00 . A A . 7 TRP HZ2 1 1 12 5076 1 1 7 TRP HZ3 H -6.339 5.854 -8.014 1.00 . A A . 7 TRP HZ3 1 1 12 5077 1 1 7 TRP N N 0.124 6.134 -3.984 1.00 . A A . 7 TRP N 1 1 12 5078 1 1 7 TRP NE1 N -1.131 5.664 -7.964 1.00 . A A . 7 TRP NE1 1 1 12 5079 1 1 7 TRP O O -1.350 6.095 -1.578 1.00 . A A . 7 TRP O 1 1 12 5080 1 1 8 LYS C C -3.208 7.441 -0.045 1.00 . A A . 8 LYS C 1 1 12 5081 1 1 8 LYS CA C -2.222 8.474 -0.601 1.00 . A A . 8 LYS CA 1 1 12 5082 1 1 8 LYS CB C -2.817 9.889 -0.624 1.00 . A A . 8 LYS CB 1 1 12 5083 1 1 8 LYS CD C -4.994 10.415 0.452 1.00 . A A . 8 LYS CD 1 1 12 5084 1 1 8 LYS CE C -5.327 11.908 0.577 1.00 . A A . 8 LYS CE 1 1 12 5085 1 1 8 LYS CG C -3.504 10.197 0.703 1.00 . A A . 8 LYS CG 1 1 12 5086 1 1 8 LYS H H -2.055 8.878 -2.702 1.00 . A A . 8 LYS H 1 1 12 5087 1 1 8 LYS HA H -1.305 8.466 -0.031 1.00 . A A . 8 LYS HA 1 1 12 5088 1 1 8 LYS HB2 H -2.026 10.606 -0.789 1.00 . A A . 8 LYS HB2 1 1 12 5089 1 1 8 LYS HB3 H -3.538 9.960 -1.424 1.00 . A A . 8 LYS HB3 1 1 12 5090 1 1 8 LYS HD2 H -5.239 10.068 -0.543 1.00 . A A . 8 LYS HD2 1 1 12 5091 1 1 8 LYS HD3 H -5.567 9.858 1.179 1.00 . A A . 8 LYS HD3 1 1 12 5092 1 1 8 LYS HE2 H -6.012 12.072 1.398 1.00 . A A . 8 LYS HE2 1 1 12 5093 1 1 8 LYS HE3 H -4.426 12.484 0.718 1.00 . A A . 8 LYS HE3 1 1 12 5094 1 1 8 LYS HG2 H -3.368 9.367 1.380 1.00 . A A . 8 LYS HG2 1 1 12 5095 1 1 8 LYS HG3 H -3.074 11.088 1.132 1.00 . A A . 8 LYS HG3 1 1 12 5096 1 1 8 LYS HZ1 H -6.171 13.294 -0.729 1.00 . A A . 8 LYS HZ1 1 1 12 5097 1 1 8 LYS HZ2 H -6.858 11.745 -0.832 1.00 . A A . 8 LYS HZ2 1 1 12 5098 1 1 8 LYS HZ3 H -5.326 12.046 -1.507 1.00 . A A . 8 LYS HZ3 1 1 12 5099 1 1 8 LYS N N -1.935 8.176 -2.033 1.00 . A A . 8 LYS N 1 1 12 5100 1 1 8 LYS NZ N -5.968 12.275 -0.719 1.00 . A A . 8 LYS NZ 1 1 12 5101 1 1 8 LYS O O -4.405 7.510 -0.285 1.00 . A A . 8 LYS O 1 1 12 5102 1 1 9 CYS C C -3.764 5.599 2.753 1.00 . A A . 9 CYS C 1 1 12 5103 1 1 9 CYS CA C -3.591 5.407 1.238 1.00 . A A . 9 CYS CA 1 1 12 5104 1 1 9 CYS CB C -2.876 4.085 0.912 1.00 . A A . 9 CYS CB 1 1 12 5105 1 1 9 CYS H H -1.730 6.431 0.831 1.00 . A A . 9 CYS H 1 1 12 5106 1 1 9 CYS HA H -4.551 5.428 0.747 1.00 . A A . 9 CYS HA 1 1 12 5107 1 1 9 CYS HB2 H -3.448 3.557 0.167 1.00 . A A . 9 CYS HB2 1 1 12 5108 1 1 9 CYS HB3 H -1.891 4.295 0.518 1.00 . A A . 9 CYS HB3 1 1 12 5109 1 1 9 CYS N N -2.705 6.468 0.675 1.00 . A A . 9 CYS N 1 1 12 5110 1 1 9 CYS O O -3.023 6.327 3.387 1.00 . A A . 9 CYS O 1 1 12 5111 1 1 9 CYS SG S -2.723 3.041 2.388 1.00 . A A . 9 CYS SG 1 1 12 5112 1 1 10 LYS C C -4.651 3.738 5.493 1.00 . A A . 10 LYS C 1 1 12 5113 1 1 10 LYS CA C -4.983 5.064 4.797 1.00 . A A . 10 LYS CA 1 1 12 5114 1 1 10 LYS CB C -6.479 5.365 4.925 1.00 . A A . 10 LYS CB 1 1 12 5115 1 1 10 LYS CD C -8.171 6.960 5.845 1.00 . A A . 10 LYS CD 1 1 12 5116 1 1 10 LYS CE C -8.465 8.183 4.969 1.00 . A A . 10 LYS CE 1 1 12 5117 1 1 10 LYS CG C -6.679 6.618 5.776 1.00 . A A . 10 LYS CG 1 1 12 5118 1 1 10 LYS H H -5.323 4.367 2.791 1.00 . A A . 10 LYS H 1 1 12 5119 1 1 10 LYS HA H -4.406 5.871 5.217 1.00 . A A . 10 LYS HA 1 1 12 5120 1 1 10 LYS HB2 H -6.901 5.524 3.942 1.00 . A A . 10 LYS HB2 1 1 12 5121 1 1 10 LYS HB3 H -6.973 4.527 5.396 1.00 . A A . 10 LYS HB3 1 1 12 5122 1 1 10 LYS HD2 H -8.748 6.117 5.496 1.00 . A A . 10 LYS HD2 1 1 12 5123 1 1 10 LYS HD3 H -8.440 7.181 6.868 1.00 . A A . 10 LYS HD3 1 1 12 5124 1 1 10 LYS HE2 H -7.938 9.048 5.347 1.00 . A A . 10 LYS HE2 1 1 12 5125 1 1 10 LYS HE3 H -8.183 7.989 3.944 1.00 . A A . 10 LYS HE3 1 1 12 5126 1 1 10 LYS HG2 H -6.304 6.437 6.775 1.00 . A A . 10 LYS HG2 1 1 12 5127 1 1 10 LYS HG3 H -6.139 7.440 5.335 1.00 . A A . 10 LYS HG3 1 1 12 5128 1 1 10 LYS HZ1 H -10.198 9.256 4.544 1.00 . A A . 10 LYS HZ1 1 1 12 5129 1 1 10 LYS HZ2 H -10.214 8.502 6.060 1.00 . A A . 10 LYS HZ2 1 1 12 5130 1 1 10 LYS HZ3 H -10.441 7.582 4.650 1.00 . A A . 10 LYS HZ3 1 1 12 5131 1 1 10 LYS N N -4.742 4.947 3.329 1.00 . A A . 10 LYS N 1 1 12 5132 1 1 10 LYS NZ N -9.939 8.393 5.063 1.00 . A A . 10 LYS NZ 1 1 12 5133 1 1 10 LYS O O -4.092 3.719 6.573 1.00 . A A . 10 LYS O 1 1 12 5134 1 1 11 ASN C C -3.798 0.480 4.594 1.00 . A A . 11 ASN C 1 1 12 5135 1 1 11 ASN CA C -4.722 1.304 5.504 1.00 . A A . 11 ASN CA 1 1 12 5136 1 1 11 ASN CB C -6.102 0.651 5.671 1.00 . A A . 11 ASN CB 1 1 12 5137 1 1 11 ASN CG C -6.036 -0.847 5.373 1.00 . A A . 11 ASN CG 1 1 12 5138 1 1 11 ASN H H -5.463 2.677 4.016 1.00 . A A . 11 ASN H 1 1 12 5139 1 1 11 ASN HA H -4.262 1.439 6.470 1.00 . A A . 11 ASN HA 1 1 12 5140 1 1 11 ASN HB2 H -6.446 0.798 6.686 1.00 . A A . 11 ASN HB2 1 1 12 5141 1 1 11 ASN HB3 H -6.801 1.116 4.994 1.00 . A A . 11 ASN HB3 1 1 12 5142 1 1 11 ASN HD21 H -7.167 -0.707 3.757 1.00 . A A . 11 ASN HD21 1 1 12 5143 1 1 11 ASN HD22 H -6.643 -2.268 4.141 1.00 . A A . 11 ASN HD22 1 1 12 5144 1 1 11 ASN N N -5.005 2.632 4.885 1.00 . A A . 11 ASN N 1 1 12 5145 1 1 11 ASN ND2 N -6.662 -1.313 4.335 1.00 . A A . 11 ASN ND2 1 1 12 5146 1 1 11 ASN O O -3.866 0.553 3.384 1.00 . A A . 11 ASN O 1 1 12 5147 1 1 11 ASN OD1 O -5.401 -1.598 6.089 1.00 . A A . 11 ASN OD1 1 1 12 5148 1 1 12 LYS C C -2.676 -2.071 3.425 1.00 . A A . 12 LYS C 1 1 12 5149 1 1 12 LYS CA C -1.957 -1.126 4.393 1.00 . A A . 12 LYS CA 1 1 12 5150 1 1 12 LYS CB C -1.171 -1.922 5.447 1.00 . A A . 12 LYS CB 1 1 12 5151 1 1 12 LYS CD C 1.199 -2.734 5.639 1.00 . A A . 12 LYS CD 1 1 12 5152 1 1 12 LYS CE C 1.289 -4.022 6.474 1.00 . A A . 12 LYS CE 1 1 12 5153 1 1 12 LYS CG C -0.072 -2.756 4.774 1.00 . A A . 12 LYS CG 1 1 12 5154 1 1 12 LYS H H -2.903 -0.322 6.163 1.00 . A A . 12 LYS H 1 1 12 5155 1 1 12 LYS HA H -1.288 -0.487 3.841 1.00 . A A . 12 LYS HA 1 1 12 5156 1 1 12 LYS HB2 H -0.720 -1.234 6.146 1.00 . A A . 12 LYS HB2 1 1 12 5157 1 1 12 LYS HB3 H -1.844 -2.579 5.977 1.00 . A A . 12 LYS HB3 1 1 12 5158 1 1 12 LYS HD2 H 2.066 -2.662 4.997 1.00 . A A . 12 LYS HD2 1 1 12 5159 1 1 12 LYS HD3 H 1.169 -1.880 6.299 1.00 . A A . 12 LYS HD3 1 1 12 5160 1 1 12 LYS HE2 H 0.388 -4.153 7.058 1.00 . A A . 12 LYS HE2 1 1 12 5161 1 1 12 LYS HE3 H 1.445 -4.876 5.830 1.00 . A A . 12 LYS HE3 1 1 12 5162 1 1 12 LYS HG2 H -0.415 -3.775 4.661 1.00 . A A . 12 LYS HG2 1 1 12 5163 1 1 12 LYS HG3 H 0.149 -2.345 3.800 1.00 . A A . 12 LYS HG3 1 1 12 5164 1 1 12 LYS HZ1 H 3.334 -3.733 6.798 1.00 . A A . 12 LYS HZ1 1 1 12 5165 1 1 12 LYS HZ2 H 2.567 -4.664 7.994 1.00 . A A . 12 LYS HZ2 1 1 12 5166 1 1 12 LYS HZ3 H 2.339 -2.983 7.949 1.00 . A A . 12 LYS HZ3 1 1 12 5167 1 1 12 LYS N N -2.926 -0.294 5.186 1.00 . A A . 12 LYS N 1 1 12 5168 1 1 12 LYS NZ N 2.469 -3.835 7.370 1.00 . A A . 12 LYS NZ 1 1 12 5169 1 1 12 LYS O O -2.238 -2.269 2.308 1.00 . A A . 12 LYS O 1 1 12 5170 1 1 13 LYS C C -5.399 -2.839 1.927 1.00 . A A . 13 LYS C 1 1 12 5171 1 1 13 LYS CA C -4.486 -3.597 2.914 1.00 . A A . 13 LYS CA 1 1 12 5172 1 1 13 LYS CB C -5.318 -4.504 3.830 1.00 . A A . 13 LYS CB 1 1 12 5173 1 1 13 LYS CD C -5.172 -6.699 5.038 1.00 . A A . 13 LYS CD 1 1 12 5174 1 1 13 LYS CE C -5.017 -6.936 6.547 1.00 . A A . 13 LYS CE 1 1 12 5175 1 1 13 LYS CG C -4.395 -5.442 4.619 1.00 . A A . 13 LYS CG 1 1 12 5176 1 1 13 LYS H H -4.108 -2.494 4.736 1.00 . A A . 13 LYS H 1 1 12 5177 1 1 13 LYS HA H -3.774 -4.195 2.368 1.00 . A A . 13 LYS HA 1 1 12 5178 1 1 13 LYS HB2 H -5.886 -3.898 4.519 1.00 . A A . 13 LYS HB2 1 1 12 5179 1 1 13 LYS HB3 H -5.995 -5.093 3.228 1.00 . A A . 13 LYS HB3 1 1 12 5180 1 1 13 LYS HD2 H -6.219 -6.569 4.803 1.00 . A A . 13 LYS HD2 1 1 12 5181 1 1 13 LYS HD3 H -4.788 -7.550 4.499 1.00 . A A . 13 LYS HD3 1 1 12 5182 1 1 13 LYS HE2 H -5.026 -5.994 7.079 1.00 . A A . 13 LYS HE2 1 1 12 5183 1 1 13 LYS HE3 H -5.809 -7.579 6.909 1.00 . A A . 13 LYS HE3 1 1 12 5184 1 1 13 LYS HG2 H -3.556 -5.724 3.999 1.00 . A A . 13 LYS HG2 1 1 12 5185 1 1 13 LYS HG3 H -4.037 -4.931 5.500 1.00 . A A . 13 LYS HG3 1 1 12 5186 1 1 13 LYS HZ1 H -3.626 -8.404 6.038 1.00 . A A . 13 LYS HZ1 1 1 12 5187 1 1 13 LYS HZ2 H -3.614 -7.979 7.680 1.00 . A A . 13 LYS HZ2 1 1 12 5188 1 1 13 LYS HZ3 H -2.936 -6.935 6.525 1.00 . A A . 13 LYS HZ3 1 1 12 5189 1 1 13 LYS N N -3.767 -2.661 3.832 1.00 . A A . 13 LYS N 1 1 12 5190 1 1 13 LYS NZ N -3.700 -7.613 6.706 1.00 . A A . 13 LYS NZ 1 1 12 5191 1 1 13 LYS O O -6.287 -3.423 1.341 1.00 . A A . 13 LYS O 1 1 12 5192 1 1 14 GLU C C -5.354 -0.644 -0.594 1.00 . A A . 14 GLU C 1 1 12 5193 1 1 14 GLU CA C -6.067 -0.802 0.766 1.00 . A A . 14 GLU CA 1 1 12 5194 1 1 14 GLU CB C -6.347 0.556 1.440 1.00 . A A . 14 GLU CB 1 1 12 5195 1 1 14 GLU CD C -6.237 3.025 1.074 1.00 . A A . 14 GLU CD 1 1 12 5196 1 1 14 GLU CG C -5.577 1.687 0.747 1.00 . A A . 14 GLU CG 1 1 12 5197 1 1 14 GLU H H -4.477 -1.090 2.201 1.00 . A A . 14 GLU H 1 1 12 5198 1 1 14 GLU HA H -6.997 -1.329 0.626 1.00 . A A . 14 GLU HA 1 1 12 5199 1 1 14 GLU HB2 H -7.403 0.764 1.377 1.00 . A A . 14 GLU HB2 1 1 12 5200 1 1 14 GLU HB3 H -6.055 0.514 2.481 1.00 . A A . 14 GLU HB3 1 1 12 5201 1 1 14 GLU HG2 H -4.555 1.694 1.096 1.00 . A A . 14 GLU HG2 1 1 12 5202 1 1 14 GLU HG3 H -5.595 1.535 -0.320 1.00 . A A . 14 GLU HG3 1 1 12 5203 1 1 14 GLU N N -5.196 -1.554 1.729 1.00 . A A . 14 GLU N 1 1 12 5204 1 1 14 GLU O O -5.989 -0.376 -1.602 1.00 . A A . 14 GLU O 1 1 12 5205 1 1 14 GLU OE1 O -6.534 3.251 2.235 1.00 . A A . 14 GLU OE1 1 1 12 5206 1 1 14 GLU OE2 O -6.433 3.806 0.162 1.00 . A A . 14 GLU OE2 1 1 12 5207 1 1 15 CYS C C -3.642 -1.893 -2.838 1.00 . A A . 15 CYS C 1 1 12 5208 1 1 15 CYS CA C -3.322 -0.684 -1.945 1.00 . A A . 15 CYS CA 1 1 12 5209 1 1 15 CYS CB C -1.820 -0.658 -1.610 1.00 . A A . 15 CYS CB 1 1 12 5210 1 1 15 CYS H H -3.557 -1.038 0.185 1.00 . A A . 15 CYS H 1 1 12 5211 1 1 15 CYS HA H -3.604 0.231 -2.440 1.00 . A A . 15 CYS HA 1 1 12 5212 1 1 15 CYS HB2 H -1.455 -1.670 -1.526 1.00 . A A . 15 CYS HB2 1 1 12 5213 1 1 15 CYS HB3 H -1.291 -0.157 -2.409 1.00 . A A . 15 CYS HB3 1 1 12 5214 1 1 15 CYS N N -4.050 -0.816 -0.638 1.00 . A A . 15 CYS N 1 1 12 5215 1 1 15 CYS O O -3.715 -3.010 -2.367 1.00 . A A . 15 CYS O 1 1 12 5216 1 1 15 CYS SG S -1.517 0.223 -0.049 1.00 . A A . 15 CYS SG 1 1 12 5217 1 1 16 CYS C C -3.033 -3.862 -4.967 1.00 . A A . 16 CYS C 1 1 12 5218 1 1 16 CYS CA C -4.150 -2.829 -5.033 1.00 . A A . 16 CYS CA 1 1 12 5219 1 1 16 CYS CB C -4.248 -2.237 -6.443 1.00 . A A . 16 CYS CB 1 1 12 5220 1 1 16 CYS H H -3.764 -0.769 -4.471 1.00 . A A . 16 CYS H 1 1 12 5221 1 1 16 CYS HA H -5.084 -3.287 -4.753 1.00 . A A . 16 CYS HA 1 1 12 5222 1 1 16 CYS HB2 H -3.301 -1.798 -6.715 1.00 . A A . 16 CYS HB2 1 1 12 5223 1 1 16 CYS HB3 H -4.494 -3.022 -7.142 1.00 . A A . 16 CYS HB3 1 1 12 5224 1 1 16 CYS N N -3.832 -1.681 -4.115 1.00 . A A . 16 CYS N 1 1 12 5225 1 1 16 CYS O O -3.239 -4.979 -4.541 1.00 . A A . 16 CYS O 1 1 12 5226 1 1 16 CYS SG S -5.532 -0.964 -6.496 1.00 . A A . 16 CYS SG 1 1 12 5227 1 1 17 GLY C C -0.266 -4.500 -3.825 1.00 . A A . 17 GLY C 1 1 12 5228 1 1 17 GLY CA C -0.714 -4.445 -5.280 1.00 . A A . 17 GLY CA 1 1 12 5229 1 1 17 GLY H H -1.699 -2.578 -5.686 1.00 . A A . 17 GLY H 1 1 12 5230 1 1 17 GLY HA2 H -1.035 -5.424 -5.607 1.00 . A A . 17 GLY HA2 1 1 12 5231 1 1 17 GLY HA3 H 0.104 -4.102 -5.895 1.00 . A A . 17 GLY HA3 1 1 12 5232 1 1 17 GLY N N -1.847 -3.490 -5.361 1.00 . A A . 17 GLY N 1 1 12 5233 1 1 17 GLY O O 0.362 -3.583 -3.349 1.00 . A A . 17 GLY O 1 1 12 5234 1 1 18 TRP C C 1.002 -4.897 -1.303 1.00 . A A . 18 TRP C 1 1 12 5235 1 1 18 TRP CA C -0.259 -5.694 -1.663 1.00 . A A . 18 TRP CA 1 1 12 5236 1 1 18 TRP CB C -0.032 -7.195 -1.454 1.00 . A A . 18 TRP CB 1 1 12 5237 1 1 18 TRP CD1 C -2.347 -7.375 -0.420 1.00 . A A . 18 TRP CD1 1 1 12 5238 1 1 18 TRP CD2 C -1.817 -9.169 -1.674 1.00 . A A . 18 TRP CD2 1 1 12 5239 1 1 18 TRP CE2 C -3.118 -9.397 -1.161 1.00 . A A . 18 TRP CE2 1 1 12 5240 1 1 18 TRP CE3 C -1.250 -10.156 -2.501 1.00 . A A . 18 TRP CE3 1 1 12 5241 1 1 18 TRP CG C -1.345 -7.877 -1.186 1.00 . A A . 18 TRP CG 1 1 12 5242 1 1 18 TRP CH2 C -3.249 -11.528 -2.281 1.00 . A A . 18 TRP CH2 1 1 12 5243 1 1 18 TRP CZ2 C -3.828 -10.558 -1.458 1.00 . A A . 18 TRP CZ2 1 1 12 5244 1 1 18 TRP CZ3 C -1.966 -11.328 -2.802 1.00 . A A . 18 TRP CZ3 1 1 12 5245 1 1 18 TRP H H -1.163 -6.249 -3.551 1.00 . A A . 18 TRP H 1 1 12 5246 1 1 18 TRP HA H -1.081 -5.366 -1.049 1.00 . A A . 18 TRP HA 1 1 12 5247 1 1 18 TRP HB2 H 0.413 -7.613 -2.344 1.00 . A A . 18 TRP HB2 1 1 12 5248 1 1 18 TRP HB3 H 0.634 -7.346 -0.616 1.00 . A A . 18 TRP HB3 1 1 12 5249 1 1 18 TRP HD1 H -2.327 -6.427 0.101 1.00 . A A . 18 TRP HD1 1 1 12 5250 1 1 18 TRP HE1 H -4.244 -8.156 0.080 1.00 . A A . 18 TRP HE1 1 1 12 5251 1 1 18 TRP HE3 H -0.265 -10.012 -2.911 1.00 . A A . 18 TRP HE3 1 1 12 5252 1 1 18 TRP HH2 H -3.793 -12.430 -2.519 1.00 . A A . 18 TRP HH2 1 1 12 5253 1 1 18 TRP HZ2 H -4.817 -10.711 -1.055 1.00 . A A . 18 TRP HZ2 1 1 12 5254 1 1 18 TRP HZ3 H -1.522 -12.078 -3.439 1.00 . A A . 18 TRP HZ3 1 1 12 5255 1 1 18 TRP N N -0.623 -5.551 -3.122 1.00 . A A . 18 TRP N 1 1 12 5256 1 1 18 TRP NE1 N -3.394 -8.279 -0.404 1.00 . A A . 18 TRP NE1 1 1 12 5257 1 1 18 TRP O O 2.114 -5.370 -1.427 1.00 . A A . 18 TRP O 1 1 12 5258 1 1 19 ASN C C 1.809 -2.396 0.991 1.00 . A A . 19 ASN C 1 1 12 5259 1 1 19 ASN CA C 1.963 -2.809 -0.474 1.00 . A A . 19 ASN CA 1 1 12 5260 1 1 19 ASN CB C 1.842 -1.586 -1.388 1.00 . A A . 19 ASN CB 1 1 12 5261 1 1 19 ASN CG C 3.056 -1.493 -2.317 1.00 . A A . 19 ASN CG 1 1 12 5262 1 1 19 ASN H H -0.100 -3.342 -0.770 1.00 . A A . 19 ASN H 1 1 12 5263 1 1 19 ASN HA H 2.907 -3.306 -0.634 1.00 . A A . 19 ASN HA 1 1 12 5264 1 1 19 ASN HB2 H 0.945 -1.673 -1.985 1.00 . A A . 19 ASN HB2 1 1 12 5265 1 1 19 ASN HB3 H 1.789 -0.692 -0.785 1.00 . A A . 19 ASN HB3 1 1 12 5266 1 1 19 ASN HD21 H 4.221 -0.626 -0.967 1.00 . A A . 19 ASN HD21 1 1 12 5267 1 1 19 ASN HD22 H 4.932 -0.887 -2.480 1.00 . A A . 19 ASN HD22 1 1 12 5268 1 1 19 ASN N N 0.814 -3.684 -0.857 1.00 . A A . 19 ASN N 1 1 12 5269 1 1 19 ASN ND2 N 4.161 -0.961 -1.883 1.00 . A A . 19 ASN ND2 1 1 12 5270 1 1 19 ASN O O 0.928 -2.866 1.686 1.00 . A A . 19 ASN O 1 1 12 5271 1 1 19 ASN OD1 O 2.997 -1.908 -3.450 1.00 . A A . 19 ASN OD1 1 1 12 5272 1 1 20 ALA C C 2.286 0.434 2.944 1.00 . A A . 20 ALA C 1 1 12 5273 1 1 20 ALA CA C 2.537 -1.068 2.877 1.00 . A A . 20 ALA CA 1 1 12 5274 1 1 20 ALA CB C 3.892 -1.393 3.494 1.00 . A A . 20 ALA CB 1 1 12 5275 1 1 20 ALA H H 3.340 -1.142 0.883 1.00 . A A . 20 ALA H 1 1 12 5276 1 1 20 ALA HA H 1.758 -1.609 3.388 1.00 . A A . 20 ALA HA 1 1 12 5277 1 1 20 ALA HB1 H 3.925 -1.028 4.511 1.00 . A A . 20 ALA HB1 1 1 12 5278 1 1 20 ALA HB2 H 4.671 -0.913 2.917 1.00 . A A . 20 ALA HB2 1 1 12 5279 1 1 20 ALA HB3 H 4.048 -2.461 3.491 1.00 . A A . 20 ALA HB3 1 1 12 5280 1 1 20 ALA N N 2.644 -1.513 1.460 1.00 . A A . 20 ALA N 1 1 12 5281 1 1 20 ALA O O 3.005 1.219 2.343 1.00 . A A . 20 ALA O 1 1 12 5282 1 1 21 CYS C C 1.999 2.877 4.840 1.00 . A A . 21 CYS C 1 1 12 5283 1 1 21 CYS CA C 1.028 2.312 3.806 1.00 . A A . 21 CYS CA 1 1 12 5284 1 1 21 CYS CB C -0.425 2.447 4.271 1.00 . A A . 21 CYS CB 1 1 12 5285 1 1 21 CYS H H 0.746 0.203 4.170 1.00 . A A . 21 CYS H 1 1 12 5286 1 1 21 CYS HA H 1.163 2.802 2.855 1.00 . A A . 21 CYS HA 1 1 12 5287 1 1 21 CYS HB2 H -0.965 1.545 4.034 1.00 . A A . 21 CYS HB2 1 1 12 5288 1 1 21 CYS HB3 H -0.448 2.614 5.336 1.00 . A A . 21 CYS HB3 1 1 12 5289 1 1 21 CYS N N 1.294 0.849 3.681 1.00 . A A . 21 CYS N 1 1 12 5290 1 1 21 CYS O O 1.859 2.645 6.028 1.00 . A A . 21 CYS O 1 1 12 5291 1 1 21 CYS SG S -1.193 3.852 3.425 1.00 . A A . 21 CYS SG 1 1 12 5292 1 1 22 ALA C C 4.142 5.641 5.231 1.00 . A A . 22 ALA C 1 1 12 5293 1 1 22 ALA CA C 4.020 4.116 5.344 1.00 . A A . 22 ALA CA 1 1 12 5294 1 1 22 ALA CB C 5.324 3.435 4.928 1.00 . A A . 22 ALA CB 1 1 12 5295 1 1 22 ALA H H 3.111 3.720 3.428 1.00 . A A . 22 ALA H 1 1 12 5296 1 1 22 ALA HA H 3.774 3.837 6.355 1.00 . A A . 22 ALA HA 1 1 12 5297 1 1 22 ALA HB1 H 5.375 3.370 3.848 1.00 . A A . 22 ALA HB1 1 1 12 5298 1 1 22 ALA HB2 H 5.361 2.442 5.351 1.00 . A A . 22 ALA HB2 1 1 12 5299 1 1 22 ALA HB3 H 6.162 4.012 5.292 1.00 . A A . 22 ALA HB3 1 1 12 5300 1 1 22 ALA N N 3.007 3.576 4.394 1.00 . A A . 22 ALA N 1 1 12 5301 1 1 22 ALA O O 3.552 6.375 5.997 1.00 . A A . 22 ALA O 1 1 12 5302 1 1 23 LEU C C 3.811 8.240 3.547 1.00 . A A . 23 LEU C 1 1 12 5303 1 1 23 LEU CA C 5.086 7.602 4.123 1.00 . A A . 23 LEU CA 1 1 12 5304 1 1 23 LEU CB C 6.261 7.748 3.137 1.00 . A A . 23 LEU CB 1 1 12 5305 1 1 23 LEU CD1 C 7.469 6.645 5.093 1.00 . A A . 23 LEU CD1 1 1 12 5306 1 1 23 LEU CD2 C 8.519 6.703 2.841 1.00 . A A . 23 LEU CD2 1 1 12 5307 1 1 23 LEU CG C 7.624 7.476 3.814 1.00 . A A . 23 LEU CG 1 1 12 5308 1 1 23 LEU H H 5.373 5.511 3.680 1.00 . A A . 23 LEU H 1 1 12 5309 1 1 23 LEU HA H 5.338 8.058 5.068 1.00 . A A . 23 LEU HA 1 1 12 5310 1 1 23 LEU HB2 H 6.128 7.052 2.322 1.00 . A A . 23 LEU HB2 1 1 12 5311 1 1 23 LEU HB3 H 6.260 8.753 2.742 1.00 . A A . 23 LEU HB3 1 1 12 5312 1 1 23 LEU HD11 H 7.142 5.650 4.838 1.00 . A A . 23 LEU HD11 1 1 12 5313 1 1 23 LEU HD12 H 6.743 7.112 5.743 1.00 . A A . 23 LEU HD12 1 1 12 5314 1 1 23 LEU HD13 H 8.420 6.589 5.602 1.00 . A A . 23 LEU HD13 1 1 12 5315 1 1 23 LEU HD21 H 8.250 5.657 2.859 1.00 . A A . 23 LEU HD21 1 1 12 5316 1 1 23 LEU HD22 H 9.550 6.815 3.137 1.00 . A A . 23 LEU HD22 1 1 12 5317 1 1 23 LEU HD23 H 8.385 7.091 1.840 1.00 . A A . 23 LEU HD23 1 1 12 5318 1 1 23 LEU HG H 8.097 8.416 4.059 1.00 . A A . 23 LEU HG 1 1 12 5319 1 1 23 LEU N N 4.907 6.121 4.283 1.00 . A A . 23 LEU N 1 1 12 5320 1 1 23 LEU O O 3.859 8.954 2.565 1.00 . A A . 23 LEU O 1 1 12 5321 1 1 24 GLY C C 1.021 7.903 2.290 1.00 . A A . 24 GLY C 1 1 12 5322 1 1 24 GLY CA C 1.398 8.570 3.618 1.00 . A A . 24 GLY CA 1 1 12 5323 1 1 24 GLY H H 2.651 7.406 4.932 1.00 . A A . 24 GLY H 1 1 12 5324 1 1 24 GLY HA2 H 0.606 8.412 4.337 1.00 . A A . 24 GLY HA2 1 1 12 5325 1 1 24 GLY HA3 H 1.529 9.629 3.455 1.00 . A A . 24 GLY HA3 1 1 12 5326 1 1 24 GLY N N 2.669 7.986 4.141 1.00 . A A . 24 GLY N 1 1 12 5327 1 1 24 GLY O O 0.134 8.359 1.594 1.00 . A A . 24 GLY O 1 1 12 5328 1 1 25 ILE C C 1.699 4.643 0.744 1.00 . A A . 25 ILE C 1 1 12 5329 1 1 25 ILE CA C 1.361 6.135 0.641 1.00 . A A . 25 ILE CA 1 1 12 5330 1 1 25 ILE CB C 2.239 6.767 -0.453 1.00 . A A . 25 ILE CB 1 1 12 5331 1 1 25 ILE CD1 C 3.999 8.451 -1.019 1.00 . A A . 25 ILE CD1 1 1 12 5332 1 1 25 ILE CG1 C 3.206 7.810 0.122 1.00 . A A . 25 ILE CG1 1 1 12 5333 1 1 25 ILE CG2 C 1.356 7.431 -1.501 1.00 . A A . 25 ILE CG2 1 1 12 5334 1 1 25 ILE H H 2.390 6.478 2.509 1.00 . A A . 25 ILE H 1 1 12 5335 1 1 25 ILE HA H 0.323 6.269 0.394 1.00 . A A . 25 ILE HA 1 1 12 5336 1 1 25 ILE HB H 2.802 5.983 -0.928 1.00 . A A . 25 ILE HB 1 1 12 5337 1 1 25 ILE HD11 H 4.832 7.817 -1.283 1.00 . A A . 25 ILE HD11 1 1 12 5338 1 1 25 ILE HD12 H 4.367 9.414 -0.702 1.00 . A A . 25 ILE HD12 1 1 12 5339 1 1 25 ILE HD13 H 3.353 8.577 -1.875 1.00 . A A . 25 ILE HD13 1 1 12 5340 1 1 25 ILE HG12 H 2.646 8.572 0.641 1.00 . A A . 25 ILE HG12 1 1 12 5341 1 1 25 ILE HG13 H 3.889 7.331 0.808 1.00 . A A . 25 ILE HG13 1 1 12 5342 1 1 25 ILE HG21 H 0.778 6.674 -2.003 1.00 . A A . 25 ILE HG21 1 1 12 5343 1 1 25 ILE HG22 H 1.976 7.945 -2.224 1.00 . A A . 25 ILE HG22 1 1 12 5344 1 1 25 ILE HG23 H 0.693 8.138 -1.025 1.00 . A A . 25 ILE HG23 1 1 12 5345 1 1 25 ILE N N 1.683 6.829 1.930 1.00 . A A . 25 ILE N 1 1 12 5346 1 1 25 ILE O O 2.194 4.174 1.752 1.00 . A A . 25 ILE O 1 1 12 5347 1 1 26 CYS C C 3.220 2.265 -0.840 1.00 . A A . 26 CYS C 1 1 12 5348 1 1 26 CYS CA C 1.801 2.447 -0.292 1.00 . A A . 26 CYS CA 1 1 12 5349 1 1 26 CYS CB C 0.777 1.812 -1.240 1.00 . A A . 26 CYS CB 1 1 12 5350 1 1 26 CYS H H 1.099 4.316 -1.129 1.00 . A A . 26 CYS H 1 1 12 5351 1 1 26 CYS HA H 1.705 2.035 0.702 1.00 . A A . 26 CYS HA 1 1 12 5352 1 1 26 CYS HB2 H 0.866 2.268 -2.215 1.00 . A A . 26 CYS HB2 1 1 12 5353 1 1 26 CYS HB3 H 0.971 0.758 -1.329 1.00 . A A . 26 CYS HB3 1 1 12 5354 1 1 26 CYS N N 1.468 3.904 -0.307 1.00 . A A . 26 CYS N 1 1 12 5355 1 1 26 CYS O O 3.448 2.476 -2.010 1.00 . A A . 26 CYS O 1 1 12 5356 1 1 26 CYS SG S -0.902 2.068 -0.611 1.00 . A A . 26 CYS SG 1 1 12 5357 1 1 27 MET C C 6.409 0.660 0.078 1.00 . A A . 27 MET C 1 1 12 5358 1 1 27 MET CA C 5.573 1.764 -0.598 1.00 . A A . 27 MET CA 1 1 12 5359 1 1 27 MET CB C 6.213 3.141 -0.400 1.00 . A A . 27 MET CB 1 1 12 5360 1 1 27 MET CE C 7.333 2.291 -3.574 1.00 . A A . 27 MET CE 1 1 12 5361 1 1 27 MET CG C 6.182 3.914 -1.713 1.00 . A A . 27 MET CG 1 1 12 5362 1 1 27 MET H H 4.018 1.748 0.921 1.00 . A A . 27 MET H 1 1 12 5363 1 1 27 MET HA H 5.506 1.562 -1.649 1.00 . A A . 27 MET HA 1 1 12 5364 1 1 27 MET HB2 H 5.666 3.687 0.351 1.00 . A A . 27 MET HB2 1 1 12 5365 1 1 27 MET HB3 H 7.239 3.019 -0.081 1.00 . A A . 27 MET HB3 1 1 12 5366 1 1 27 MET HE1 H 8.164 2.044 -4.220 1.00 . A A . 27 MET HE1 1 1 12 5367 1 1 27 MET HE2 H 6.472 2.532 -4.175 1.00 . A A . 27 MET HE2 1 1 12 5368 1 1 27 MET HE3 H 7.104 1.449 -2.936 1.00 . A A . 27 MET HE3 1 1 12 5369 1 1 27 MET HG2 H 5.387 3.535 -2.336 1.00 . A A . 27 MET HG2 1 1 12 5370 1 1 27 MET HG3 H 6.008 4.959 -1.506 1.00 . A A . 27 MET HG3 1 1 12 5371 1 1 27 MET N N 4.189 1.904 -0.031 1.00 . A A . 27 MET N 1 1 12 5372 1 1 27 MET O O 6.619 -0.377 -0.516 1.00 . A A . 27 MET O 1 1 12 5373 1 1 27 MET SD S 7.774 3.714 -2.555 1.00 . A A . 27 MET SD 1 1 12 5374 1 1 28 PRO C C 6.971 -1.322 2.406 1.00 . A A . 28 PRO C 1 1 12 5375 1 1 28 PRO CA C 7.759 -0.067 1.986 1.00 . A A . 28 PRO CA 1 1 12 5376 1 1 28 PRO CB C 8.252 0.708 3.208 1.00 . A A . 28 PRO CB 1 1 12 5377 1 1 28 PRO CD C 6.685 2.132 2.074 1.00 . A A . 28 PRO CD 1 1 12 5378 1 1 28 PRO CG C 7.215 1.755 3.429 1.00 . A A . 28 PRO CG 1 1 12 5379 1 1 28 PRO HA H 8.597 -0.347 1.367 1.00 . A A . 28 PRO HA 1 1 12 5380 1 1 28 PRO HB2 H 8.320 0.055 4.063 1.00 . A A . 28 PRO HB2 1 1 12 5381 1 1 28 PRO HB3 H 9.209 1.175 3.009 1.00 . A A . 28 PRO HB3 1 1 12 5382 1 1 28 PRO HD2 H 5.632 2.384 2.128 1.00 . A A . 28 PRO HD2 1 1 12 5383 1 1 28 PRO HD3 H 7.252 2.953 1.658 1.00 . A A . 28 PRO HD3 1 1 12 5384 1 1 28 PRO HG2 H 6.420 1.358 4.045 1.00 . A A . 28 PRO HG2 1 1 12 5385 1 1 28 PRO HG3 H 7.656 2.616 3.899 1.00 . A A . 28 PRO HG3 1 1 12 5386 1 1 28 PRO N N 6.893 0.921 1.274 1.00 . A A . 28 PRO N 1 1 12 5387 1 1 28 PRO O O 6.646 -1.502 3.565 1.00 . A A . 28 PRO O 1 1 12 5388 1 1 29 ARG C C 6.664 -4.258 2.852 1.00 . A A . 29 ARG C 1 1 12 5389 1 1 29 ARG CA C 5.934 -3.446 1.769 1.00 . A A . 29 ARG CA 1 1 12 5390 1 1 29 ARG CB C 5.914 -4.232 0.448 1.00 . A A . 29 ARG CB 1 1 12 5391 1 1 29 ARG CD C 4.743 -6.452 0.340 1.00 . A A . 29 ARG CD 1 1 12 5392 1 1 29 ARG CG C 4.560 -4.931 0.285 1.00 . A A . 29 ARG CG 1 1 12 5393 1 1 29 ARG CZ C 6.213 -7.768 1.782 1.00 . A A . 29 ARG CZ 1 1 12 5394 1 1 29 ARG H H 6.957 -1.997 0.545 1.00 . A A . 29 ARG H 1 1 12 5395 1 1 29 ARG HA H 4.925 -3.223 2.078 1.00 . A A . 29 ARG HA 1 1 12 5396 1 1 29 ARG HB2 H 6.069 -3.553 -0.373 1.00 . A A . 29 ARG HB2 1 1 12 5397 1 1 29 ARG HB3 H 6.704 -4.973 0.457 1.00 . A A . 29 ARG HB3 1 1 12 5398 1 1 29 ARG HD2 H 3.781 -6.940 0.328 1.00 . A A . 29 ARG HD2 1 1 12 5399 1 1 29 ARG HD3 H 5.349 -6.783 -0.489 1.00 . A A . 29 ARG HD3 1 1 12 5400 1 1 29 ARG HE H 5.361 -6.066 2.366 1.00 . A A . 29 ARG HE 1 1 12 5401 1 1 29 ARG HG2 H 3.899 -4.621 1.078 1.00 . A A . 29 ARG HG2 1 1 12 5402 1 1 29 ARG HG3 H 4.129 -4.662 -0.667 1.00 . A A . 29 ARG HG3 1 1 12 5403 1 1 29 ARG HH11 H 5.803 -8.567 -0.015 1.00 . A A . 29 ARG HH11 1 1 12 5404 1 1 29 ARG HH12 H 6.905 -9.469 0.961 1.00 . A A . 29 ARG HH12 1 1 12 5405 1 1 29 ARG HH21 H 6.790 -7.224 3.617 1.00 . A A . 29 ARG HH21 1 1 12 5406 1 1 29 ARG HH22 H 7.462 -8.710 3.030 1.00 . A A . 29 ARG HH22 1 1 12 5407 1 1 29 ARG N N 6.679 -2.183 1.463 1.00 . A A . 29 ARG N 1 1 12 5408 1 1 29 ARG NE N 5.448 -6.715 1.628 1.00 . A A . 29 ARG NE 1 1 12 5409 1 1 29 ARG NH1 N 6.313 -8.670 0.836 1.00 . A A . 29 ARG NH1 1 1 12 5410 1 1 29 ARG NH2 N 6.872 -7.914 2.893 1.00 . A A . 29 ARG NH2 1 1 12 5411 1 1 29 ARG O O 7.883 -4.218 2.887 1.00 . A A . 29 ARG O 1 1 12 5412 1 1 29 ARG OXT O 5.988 -4.930 3.613 1.00 . A A . 29 ARG OXT 1 1 13 5413 1 1 1 GLY C C -9.803 1.522 -4.780 1.00 . A A . 1 GLY C 1 1 13 5414 1 1 1 GLY CA C -11.238 1.657 -5.300 1.00 . A A . 1 GLY CA 1 1 13 5415 1 1 1 GLY H1 H -12.023 2.676 -6.935 1.00 . A A . 1 GLY H1 1 1 13 5416 1 1 1 GLY H2 H -10.418 3.095 -6.570 1.00 . A A . 1 GLY H2 1 1 13 5417 1 1 1 GLY H3 H -11.694 3.665 -5.604 1.00 . A A . 1 GLY H3 1 1 13 5418 1 1 1 GLY HA2 H -11.918 1.749 -4.467 1.00 . A A . 1 GLY HA2 1 1 13 5419 1 1 1 GLY HA3 H -11.493 0.780 -5.872 1.00 . A A . 1 GLY HA3 1 1 13 5420 1 1 1 GLY N N -11.351 2.865 -6.168 1.00 . A A . 1 GLY N 1 1 13 5421 1 1 1 GLY O O -9.255 2.438 -4.189 1.00 . A A . 1 GLY O 1 1 13 5422 1 1 2 CYS C C -6.825 1.115 -5.273 1.00 . A A . 2 CYS C 1 1 13 5423 1 1 2 CYS CA C -7.779 0.190 -4.509 1.00 . A A . 2 CYS CA 1 1 13 5424 1 1 2 CYS CB C -7.453 -1.278 -4.806 1.00 . A A . 2 CYS CB 1 1 13 5425 1 1 2 CYS H H -9.644 -0.338 -5.470 1.00 . A A . 2 CYS H 1 1 13 5426 1 1 2 CYS HA H -7.717 0.375 -3.447 1.00 . A A . 2 CYS HA 1 1 13 5427 1 1 2 CYS HB2 H -6.509 -1.535 -4.354 1.00 . A A . 2 CYS HB2 1 1 13 5428 1 1 2 CYS HB3 H -8.230 -1.909 -4.399 1.00 . A A . 2 CYS HB3 1 1 13 5429 1 1 2 CYS N N -9.186 0.387 -4.991 1.00 . A A . 2 CYS N 1 1 13 5430 1 1 2 CYS O O -7.130 1.567 -6.364 1.00 . A A . 2 CYS O 1 1 13 5431 1 1 2 CYS SG S -7.353 -1.528 -6.600 1.00 . A A . 2 CYS SG 1 1 13 5432 1 1 3 LYS C C -3.353 1.590 -5.603 1.00 . A A . 3 LYS C 1 1 13 5433 1 1 3 LYS CA C -4.702 2.293 -5.435 1.00 . A A . 3 LYS CA 1 1 13 5434 1 1 3 LYS CB C -4.564 3.541 -4.557 1.00 . A A . 3 LYS CB 1 1 13 5435 1 1 3 LYS CD C -5.838 5.308 -3.299 1.00 . A A . 3 LYS CD 1 1 13 5436 1 1 3 LYS CE C -6.300 4.901 -1.893 1.00 . A A . 3 LYS CE 1 1 13 5437 1 1 3 LYS CG C -5.957 4.115 -4.257 1.00 . A A . 3 LYS CG 1 1 13 5438 1 1 3 LYS H H -5.439 1.023 -3.844 1.00 . A A . 3 LYS H 1 1 13 5439 1 1 3 LYS HA H -5.090 2.570 -6.400 1.00 . A A . 3 LYS HA 1 1 13 5440 1 1 3 LYS HB2 H -4.062 3.286 -3.633 1.00 . A A . 3 LYS HB2 1 1 13 5441 1 1 3 LYS HB3 H -3.986 4.280 -5.085 1.00 . A A . 3 LYS HB3 1 1 13 5442 1 1 3 LYS HD2 H -4.808 5.634 -3.255 1.00 . A A . 3 LYS HD2 1 1 13 5443 1 1 3 LYS HD3 H -6.455 6.122 -3.656 1.00 . A A . 3 LYS HD3 1 1 13 5444 1 1 3 LYS HE2 H -5.854 3.957 -1.612 1.00 . A A . 3 LYS HE2 1 1 13 5445 1 1 3 LYS HE3 H -6.040 5.666 -1.178 1.00 . A A . 3 LYS HE3 1 1 13 5446 1 1 3 LYS HG2 H -6.414 4.440 -5.179 1.00 . A A . 3 LYS HG2 1 1 13 5447 1 1 3 LYS HG3 H -6.567 3.353 -3.803 1.00 . A A . 3 LYS HG3 1 1 13 5448 1 1 3 LYS HZ1 H -8.212 5.713 -2.075 1.00 . A A . 3 LYS HZ1 1 1 13 5449 1 1 3 LYS HZ2 H -8.144 4.316 -1.100 1.00 . A A . 3 LYS HZ2 1 1 13 5450 1 1 3 LYS HZ3 H -8.047 4.188 -2.797 1.00 . A A . 3 LYS HZ3 1 1 13 5451 1 1 3 LYS N N -5.671 1.399 -4.722 1.00 . A A . 3 LYS N 1 1 13 5452 1 1 3 LYS NZ N -7.786 4.772 -1.979 1.00 . A A . 3 LYS NZ 1 1 13 5453 1 1 3 LYS O O -3.193 0.432 -5.251 1.00 . A A . 3 LYS O 1 1 13 5454 1 1 4 LEU C C -0.123 1.995 -5.171 1.00 . A A . 4 LEU C 1 1 13 5455 1 1 4 LEU CA C -1.040 1.680 -6.369 1.00 . A A . 4 LEU CA 1 1 13 5456 1 1 4 LEU CB C -0.524 2.327 -7.676 1.00 . A A . 4 LEU CB 1 1 13 5457 1 1 4 LEU CD1 C -1.278 0.254 -8.858 1.00 . A A . 4 LEU CD1 1 1 13 5458 1 1 4 LEU CD2 C -2.713 2.285 -8.899 1.00 . A A . 4 LEU CD2 1 1 13 5459 1 1 4 LEU CG C -1.273 1.775 -8.896 1.00 . A A . 4 LEU CG 1 1 13 5460 1 1 4 LEU H H -2.555 3.205 -6.430 1.00 . A A . 4 LEU H 1 1 13 5461 1 1 4 LEU HA H -1.128 0.615 -6.496 1.00 . A A . 4 LEU HA 1 1 13 5462 1 1 4 LEU HB2 H -0.670 3.392 -7.628 1.00 . A A . 4 LEU HB2 1 1 13 5463 1 1 4 LEU HB3 H 0.529 2.120 -7.790 1.00 . A A . 4 LEU HB3 1 1 13 5464 1 1 4 LEU HD11 H -2.066 -0.089 -8.204 1.00 . A A . 4 LEU HD11 1 1 13 5465 1 1 4 LEU HD12 H -0.324 -0.097 -8.496 1.00 . A A . 4 LEU HD12 1 1 13 5466 1 1 4 LEU HD13 H -1.451 -0.122 -9.852 1.00 . A A . 4 LEU HD13 1 1 13 5467 1 1 4 LEU HD21 H -3.062 2.364 -9.914 1.00 . A A . 4 LEU HD21 1 1 13 5468 1 1 4 LEU HD22 H -2.748 3.258 -8.427 1.00 . A A . 4 LEU HD22 1 1 13 5469 1 1 4 LEU HD23 H -3.343 1.597 -8.357 1.00 . A A . 4 LEU HD23 1 1 13 5470 1 1 4 LEU HG H -0.775 2.109 -9.799 1.00 . A A . 4 LEU HG 1 1 13 5471 1 1 4 LEU N N -2.389 2.283 -6.151 1.00 . A A . 4 LEU N 1 1 13 5472 1 1 4 LEU O O -0.530 1.907 -4.031 1.00 . A A . 4 LEU O 1 1 13 5473 1 1 5 THR C C 1.932 4.093 -3.822 1.00 . A A . 5 THR C 1 1 13 5474 1 1 5 THR CA C 2.066 2.638 -4.312 1.00 . A A . 5 THR CA 1 1 13 5475 1 1 5 THR CB C 3.463 2.394 -4.909 1.00 . A A . 5 THR CB 1 1 13 5476 1 1 5 THR CG2 C 4.228 1.397 -4.025 1.00 . A A . 5 THR CG2 1 1 13 5477 1 1 5 THR H H 1.429 2.395 -6.337 1.00 . A A . 5 THR H 1 1 13 5478 1 1 5 THR HA H 1.903 1.955 -3.496 1.00 . A A . 5 THR HA 1 1 13 5479 1 1 5 THR HB H 3.997 3.329 -4.937 1.00 . A A . 5 THR HB 1 1 13 5480 1 1 5 THR HG1 H 4.105 2.182 -6.752 1.00 . A A . 5 THR HG1 1 1 13 5481 1 1 5 THR HG21 H 4.246 0.422 -4.493 1.00 . A A . 5 THR HG21 1 1 13 5482 1 1 5 THR HG22 H 3.740 1.326 -3.062 1.00 . A A . 5 THR HG22 1 1 13 5483 1 1 5 THR HG23 H 5.240 1.741 -3.889 1.00 . A A . 5 THR HG23 1 1 13 5484 1 1 5 THR N N 1.113 2.342 -5.420 1.00 . A A . 5 THR N 1 1 13 5485 1 1 5 THR O O 1.379 4.352 -2.773 1.00 . A A . 5 THR O 1 1 13 5486 1 1 5 THR OG1 O 3.348 1.875 -6.236 1.00 . A A . 5 THR OG1 1 1 13 5487 1 1 6 PHE C C 0.914 7.040 -4.220 1.00 . A A . 6 PHE C 1 1 13 5488 1 1 6 PHE CA C 2.342 6.479 -4.113 1.00 . A A . 6 PHE CA 1 1 13 5489 1 1 6 PHE CB C 3.300 7.251 -5.025 1.00 . A A . 6 PHE CB 1 1 13 5490 1 1 6 PHE CD1 C 5.154 6.976 -3.336 1.00 . A A . 6 PHE CD1 1 1 13 5491 1 1 6 PHE CD2 C 4.748 9.171 -4.279 1.00 . A A . 6 PHE CD2 1 1 13 5492 1 1 6 PHE CE1 C 6.196 7.497 -2.562 1.00 . A A . 6 PHE CE1 1 1 13 5493 1 1 6 PHE CE2 C 5.793 9.696 -3.505 1.00 . A A . 6 PHE CE2 1 1 13 5494 1 1 6 PHE CG C 4.430 7.814 -4.195 1.00 . A A . 6 PHE CG 1 1 13 5495 1 1 6 PHE CZ C 6.519 8.859 -2.645 1.00 . A A . 6 PHE CZ 1 1 13 5496 1 1 6 PHE H H 2.874 4.831 -5.403 1.00 . A A . 6 PHE H 1 1 13 5497 1 1 6 PHE HA H 2.682 6.559 -3.093 1.00 . A A . 6 PHE HA 1 1 13 5498 1 1 6 PHE HB2 H 3.701 6.587 -5.779 1.00 . A A . 6 PHE HB2 1 1 13 5499 1 1 6 PHE HB3 H 2.770 8.059 -5.507 1.00 . A A . 6 PHE HB3 1 1 13 5500 1 1 6 PHE HD1 H 4.905 5.930 -3.274 1.00 . A A . 6 PHE HD1 1 1 13 5501 1 1 6 PHE HD2 H 4.191 9.814 -4.940 1.00 . A A . 6 PHE HD2 1 1 13 5502 1 1 6 PHE HE1 H 6.750 6.850 -1.899 1.00 . A A . 6 PHE HE1 1 1 13 5503 1 1 6 PHE HE2 H 6.037 10.744 -3.570 1.00 . A A . 6 PHE HE2 1 1 13 5504 1 1 6 PHE HZ H 7.323 9.262 -2.048 1.00 . A A . 6 PHE HZ 1 1 13 5505 1 1 6 PHE N N 2.432 5.050 -4.563 1.00 . A A . 6 PHE N 1 1 13 5506 1 1 6 PHE O O 0.725 8.201 -4.537 1.00 . A A . 6 PHE O 1 1 13 5507 1 1 7 TRP C C -1.941 6.971 -2.527 1.00 . A A . 7 TRP C 1 1 13 5508 1 1 7 TRP CA C -1.481 6.759 -3.971 1.00 . A A . 7 TRP CA 1 1 13 5509 1 1 7 TRP CB C -2.293 5.657 -4.644 1.00 . A A . 7 TRP CB 1 1 13 5510 1 1 7 TRP CD1 C -0.701 5.511 -6.603 1.00 . A A . 7 TRP CD1 1 1 13 5511 1 1 7 TRP CD2 C -2.854 5.631 -7.243 1.00 . A A . 7 TRP CD2 1 1 13 5512 1 1 7 TRP CE2 C -2.076 5.565 -8.427 1.00 . A A . 7 TRP CE2 1 1 13 5513 1 1 7 TRP CE3 C -4.254 5.710 -7.369 1.00 . A A . 7 TRP CE3 1 1 13 5514 1 1 7 TRP CG C -1.956 5.603 -6.100 1.00 . A A . 7 TRP CG 1 1 13 5515 1 1 7 TRP CH2 C -4.061 5.647 -9.797 1.00 . A A . 7 TRP CH2 1 1 13 5516 1 1 7 TRP CZ2 C -2.670 5.572 -9.689 1.00 . A A . 7 TRP CZ2 1 1 13 5517 1 1 7 TRP CZ3 C -4.852 5.716 -8.639 1.00 . A A . 7 TRP CZ3 1 1 13 5518 1 1 7 TRP H H 0.069 5.324 -3.637 1.00 . A A . 7 TRP H 1 1 13 5519 1 1 7 TRP HA H -1.537 7.675 -4.543 1.00 . A A . 7 TRP HA 1 1 13 5520 1 1 7 TRP HB2 H -2.063 4.709 -4.187 1.00 . A A . 7 TRP HB2 1 1 13 5521 1 1 7 TRP HB3 H -3.342 5.872 -4.520 1.00 . A A . 7 TRP HB3 1 1 13 5522 1 1 7 TRP HD1 H 0.208 5.471 -6.020 1.00 . A A . 7 TRP HD1 1 1 13 5523 1 1 7 TRP HE1 H -0.005 5.447 -8.585 1.00 . A A . 7 TRP HE1 1 1 13 5524 1 1 7 TRP HE3 H -4.877 5.759 -6.483 1.00 . A A . 7 TRP HE3 1 1 13 5525 1 1 7 TRP HH2 H -4.529 5.646 -10.772 1.00 . A A . 7 TRP HH2 1 1 13 5526 1 1 7 TRP HZ2 H -2.063 5.514 -10.572 1.00 . A A . 7 TRP HZ2 1 1 13 5527 1 1 7 TRP HZ3 H -5.931 5.765 -8.728 1.00 . A A . 7 TRP HZ3 1 1 13 5528 1 1 7 TRP N N -0.090 6.250 -3.924 1.00 . A A . 7 TRP N 1 1 13 5529 1 1 7 TRP NE1 N -0.773 5.502 -7.982 1.00 . A A . 7 TRP NE1 1 1 13 5530 1 1 7 TRP O O -2.055 6.017 -1.780 1.00 . A A . 7 TRP O 1 1 13 5531 1 1 8 LYS C C -3.459 7.386 -0.148 1.00 . A A . 8 LYS C 1 1 13 5532 1 1 8 LYS CA C -2.583 8.510 -0.716 1.00 . A A . 8 LYS CA 1 1 13 5533 1 1 8 LYS CB C -3.372 9.823 -0.796 1.00 . A A . 8 LYS CB 1 1 13 5534 1 1 8 LYS CD C -1.490 11.417 -1.265 1.00 . A A . 8 LYS CD 1 1 13 5535 1 1 8 LYS CE C -1.017 12.841 -0.941 1.00 . A A . 8 LYS CE 1 1 13 5536 1 1 8 LYS CG C -2.531 10.973 -0.228 1.00 . A A . 8 LYS CG 1 1 13 5537 1 1 8 LYS H H -2.031 8.947 -2.755 1.00 . A A . 8 LYS H 1 1 13 5538 1 1 8 LYS HA H -1.713 8.649 -0.095 1.00 . A A . 8 LYS HA 1 1 13 5539 1 1 8 LYS HB2 H -3.621 10.032 -1.826 1.00 . A A . 8 LYS HB2 1 1 13 5540 1 1 8 LYS HB3 H -4.283 9.731 -0.220 1.00 . A A . 8 LYS HB3 1 1 13 5541 1 1 8 LYS HD2 H -0.647 10.741 -1.237 1.00 . A A . 8 LYS HD2 1 1 13 5542 1 1 8 LYS HD3 H -1.931 11.402 -2.252 1.00 . A A . 8 LYS HD3 1 1 13 5543 1 1 8 LYS HE2 H -1.844 13.534 -1.002 1.00 . A A . 8 LYS HE2 1 1 13 5544 1 1 8 LYS HE3 H -0.571 12.871 0.044 1.00 . A A . 8 LYS HE3 1 1 13 5545 1 1 8 LYS HG2 H -3.180 11.803 0.008 1.00 . A A . 8 LYS HG2 1 1 13 5546 1 1 8 LYS HG3 H -2.024 10.645 0.669 1.00 . A A . 8 LYS HG3 1 1 13 5547 1 1 8 LYS HZ1 H -0.424 13.130 -2.919 1.00 . A A . 8 LYS HZ1 1 1 13 5548 1 1 8 LYS HZ2 H 0.786 12.467 -1.926 1.00 . A A . 8 LYS HZ2 1 1 13 5549 1 1 8 LYS HZ3 H 0.388 14.113 -1.803 1.00 . A A . 8 LYS HZ3 1 1 13 5550 1 1 8 LYS N N -2.165 8.207 -2.126 1.00 . A A . 8 LYS N 1 1 13 5551 1 1 8 LYS NZ N 0.009 13.163 -1.975 1.00 . A A . 8 LYS NZ 1 1 13 5552 1 1 8 LYS O O -4.619 7.251 -0.492 1.00 . A A . 8 LYS O 1 1 13 5553 1 1 9 CYS C C -3.778 5.563 2.791 1.00 . A A . 9 CYS C 1 1 13 5554 1 1 9 CYS CA C -3.674 5.428 1.266 1.00 . A A . 9 CYS CA 1 1 13 5555 1 1 9 CYS CB C -2.890 4.173 0.857 1.00 . A A . 9 CYS CB 1 1 13 5556 1 1 9 CYS H H -1.946 6.683 0.932 1.00 . A A . 9 CYS H 1 1 13 5557 1 1 9 CYS HA H -4.661 5.397 0.827 1.00 . A A . 9 CYS HA 1 1 13 5558 1 1 9 CYS HB2 H -3.447 3.631 0.109 1.00 . A A . 9 CYS HB2 1 1 13 5559 1 1 9 CYS HB3 H -1.935 4.463 0.446 1.00 . A A . 9 CYS HB3 1 1 13 5560 1 1 9 CYS N N -2.894 6.563 0.692 1.00 . A A . 9 CYS N 1 1 13 5561 1 1 9 CYS O O -2.943 6.182 3.431 1.00 . A A . 9 CYS O 1 1 13 5562 1 1 9 CYS SG S -2.616 3.093 2.285 1.00 . A A . 9 CYS SG 1 1 13 5563 1 1 10 LYS C C -4.571 3.743 5.497 1.00 . A A . 10 LYS C 1 1 13 5564 1 1 10 LYS CA C -4.989 5.064 4.841 1.00 . A A . 10 LYS CA 1 1 13 5565 1 1 10 LYS CB C -6.489 5.313 5.044 1.00 . A A . 10 LYS CB 1 1 13 5566 1 1 10 LYS CD C -8.228 6.060 6.681 1.00 . A A . 10 LYS CD 1 1 13 5567 1 1 10 LYS CE C -8.477 7.361 7.459 1.00 . A A . 10 LYS CE 1 1 13 5568 1 1 10 LYS CG C -6.723 5.877 6.447 1.00 . A A . 10 LYS CG 1 1 13 5569 1 1 10 LYS H H -5.459 4.499 2.814 1.00 . A A . 10 LYS H 1 1 13 5570 1 1 10 LYS HA H -4.421 5.882 5.250 1.00 . A A . 10 LYS HA 1 1 13 5571 1 1 10 LYS HB2 H -6.841 6.019 4.306 1.00 . A A . 10 LYS HB2 1 1 13 5572 1 1 10 LYS HB3 H -7.029 4.382 4.939 1.00 . A A . 10 LYS HB3 1 1 13 5573 1 1 10 LYS HD2 H -8.737 6.107 5.727 1.00 . A A . 10 LYS HD2 1 1 13 5574 1 1 10 LYS HD3 H -8.604 5.224 7.247 1.00 . A A . 10 LYS HD3 1 1 13 5575 1 1 10 LYS HE2 H -7.551 7.732 7.875 1.00 . A A . 10 LYS HE2 1 1 13 5576 1 1 10 LYS HE3 H -8.923 8.106 6.814 1.00 . A A . 10 LYS HE3 1 1 13 5577 1 1 10 LYS HG2 H -6.323 5.191 7.183 1.00 . A A . 10 LYS HG2 1 1 13 5578 1 1 10 LYS HG3 H -6.223 6.829 6.536 1.00 . A A . 10 LYS HG3 1 1 13 5579 1 1 10 LYS HZ1 H -9.909 7.855 8.889 1.00 . A A . 10 LYS HZ1 1 1 13 5580 1 1 10 LYS HZ2 H -8.910 6.557 9.333 1.00 . A A . 10 LYS HZ2 1 1 13 5581 1 1 10 LYS HZ3 H -10.138 6.326 8.184 1.00 . A A . 10 LYS HZ3 1 1 13 5582 1 1 10 LYS N N -4.801 4.987 3.366 1.00 . A A . 10 LYS N 1 1 13 5583 1 1 10 LYS NZ N -9.429 6.997 8.548 1.00 . A A . 10 LYS NZ 1 1 13 5584 1 1 10 LYS O O -4.027 3.730 6.587 1.00 . A A . 10 LYS O 1 1 13 5585 1 1 11 ASN C C -3.588 0.489 4.499 1.00 . A A . 11 ASN C 1 1 13 5586 1 1 11 ASN CA C -4.427 1.315 5.476 1.00 . A A . 11 ASN CA 1 1 13 5587 1 1 11 ASN CB C -5.744 0.605 5.817 1.00 . A A . 11 ASN CB 1 1 13 5588 1 1 11 ASN CG C -6.617 0.474 4.565 1.00 . A A . 11 ASN CG 1 1 13 5589 1 1 11 ASN H H -5.266 2.646 3.974 1.00 . A A . 11 ASN H 1 1 13 5590 1 1 11 ASN HA H -3.867 1.491 6.382 1.00 . A A . 11 ASN HA 1 1 13 5591 1 1 11 ASN HB2 H -5.530 -0.376 6.209 1.00 . A A . 11 ASN HB2 1 1 13 5592 1 1 11 ASN HB3 H -6.276 1.181 6.562 1.00 . A A . 11 ASN HB3 1 1 13 5593 1 1 11 ASN HD21 H -6.176 -1.432 4.264 1.00 . A A . 11 ASN HD21 1 1 13 5594 1 1 11 ASN HD22 H -7.234 -0.744 3.136 1.00 . A A . 11 ASN HD22 1 1 13 5595 1 1 11 ASN N N -4.819 2.626 4.856 1.00 . A A . 11 ASN N 1 1 13 5596 1 1 11 ASN ND2 N -6.681 -0.664 3.939 1.00 . A A . 11 ASN ND2 1 1 13 5597 1 1 11 ASN O O -3.736 0.588 3.303 1.00 . A A . 11 ASN O 1 1 13 5598 1 1 11 ASN OD1 O -7.255 1.420 4.159 1.00 . A A . 11 ASN OD1 1 1 13 5599 1 1 12 LYS C C -2.646 -2.006 3.152 1.00 . A A . 12 LYS C 1 1 13 5600 1 1 12 LYS CA C -1.815 -1.142 4.119 1.00 . A A . 12 LYS CA 1 1 13 5601 1 1 12 LYS CB C -0.962 -2.008 5.063 1.00 . A A . 12 LYS CB 1 1 13 5602 1 1 12 LYS CD C -1.324 -3.380 7.134 1.00 . A A . 12 LYS CD 1 1 13 5603 1 1 12 LYS CE C -0.081 -4.277 7.097 1.00 . A A . 12 LYS CE 1 1 13 5604 1 1 12 LYS CG C -1.813 -3.109 5.708 1.00 . A A . 12 LYS CG 1 1 13 5605 1 1 12 LYS H H -2.585 -0.371 5.975 1.00 . A A . 12 LYS H 1 1 13 5606 1 1 12 LYS HA H -1.169 -0.494 3.549 1.00 . A A . 12 LYS HA 1 1 13 5607 1 1 12 LYS HB2 H -0.166 -2.463 4.496 1.00 . A A . 12 LYS HB2 1 1 13 5608 1 1 12 LYS HB3 H -0.540 -1.385 5.835 1.00 . A A . 12 LYS HB3 1 1 13 5609 1 1 12 LYS HD2 H -1.085 -2.446 7.617 1.00 . A A . 12 LYS HD2 1 1 13 5610 1 1 12 LYS HD3 H -2.108 -3.880 7.687 1.00 . A A . 12 LYS HD3 1 1 13 5611 1 1 12 LYS HE2 H -0.335 -5.253 6.699 1.00 . A A . 12 LYS HE2 1 1 13 5612 1 1 12 LYS HE3 H 0.695 -3.820 6.505 1.00 . A A . 12 LYS HE3 1 1 13 5613 1 1 12 LYS HG2 H -2.844 -2.795 5.739 1.00 . A A . 12 LYS HG2 1 1 13 5614 1 1 12 LYS HG3 H -1.730 -4.016 5.124 1.00 . A A . 12 LYS HG3 1 1 13 5615 1 1 12 LYS HZ1 H 1.345 -4.707 8.552 1.00 . A A . 12 LYS HZ1 1 1 13 5616 1 1 12 LYS HZ2 H -0.246 -5.080 9.016 1.00 . A A . 12 LYS HZ2 1 1 13 5617 1 1 12 LYS HZ3 H 0.279 -3.466 8.985 1.00 . A A . 12 LYS HZ3 1 1 13 5618 1 1 12 LYS N N -2.692 -0.318 5.009 1.00 . A A . 12 LYS N 1 1 13 5619 1 1 12 LYS NZ N 0.356 -4.389 8.519 1.00 . A A . 12 LYS NZ 1 1 13 5620 1 1 12 LYS O O -2.220 -2.280 2.052 1.00 . A A . 12 LYS O 1 1 13 5621 1 1 13 LYS C C -5.445 -2.321 1.631 1.00 . A A . 13 LYS C 1 1 13 5622 1 1 13 LYS CA C -4.675 -3.234 2.612 1.00 . A A . 13 LYS CA 1 1 13 5623 1 1 13 LYS CB C -5.657 -4.008 3.512 1.00 . A A . 13 LYS CB 1 1 13 5624 1 1 13 LYS CD C -5.794 -5.788 5.278 1.00 . A A . 13 LYS CD 1 1 13 5625 1 1 13 LYS CE C -5.483 -5.945 6.775 1.00 . A A . 13 LYS CE 1 1 13 5626 1 1 13 LYS CG C -4.910 -4.686 4.675 1.00 . A A . 13 LYS CG 1 1 13 5627 1 1 13 LYS H H -4.167 -2.166 4.420 1.00 . A A . 13 LYS H 1 1 13 5628 1 1 13 LYS HA H -4.056 -3.929 2.060 1.00 . A A . 13 LYS HA 1 1 13 5629 1 1 13 LYS HB2 H -6.395 -3.327 3.906 1.00 . A A . 13 LYS HB2 1 1 13 5630 1 1 13 LYS HB3 H -6.153 -4.766 2.920 1.00 . A A . 13 LYS HB3 1 1 13 5631 1 1 13 LYS HD2 H -6.832 -5.524 5.151 1.00 . A A . 13 LYS HD2 1 1 13 5632 1 1 13 LYS HD3 H -5.597 -6.725 4.775 1.00 . A A . 13 LYS HD3 1 1 13 5633 1 1 13 LYS HE2 H -4.850 -6.808 6.936 1.00 . A A . 13 LYS HE2 1 1 13 5634 1 1 13 LYS HE3 H -5.005 -5.056 7.156 1.00 . A A . 13 LYS HE3 1 1 13 5635 1 1 13 LYS HG2 H -3.990 -5.121 4.311 1.00 . A A . 13 LYS HG2 1 1 13 5636 1 1 13 LYS HG3 H -4.686 -3.954 5.435 1.00 . A A . 13 LYS HG3 1 1 13 5637 1 1 13 LYS HZ1 H -7.469 -5.393 7.143 1.00 . A A . 13 LYS HZ1 1 1 13 5638 1 1 13 LYS HZ2 H -6.683 -6.090 8.478 1.00 . A A . 13 LYS HZ2 1 1 13 5639 1 1 13 LYS HZ3 H -7.204 -7.064 7.183 1.00 . A A . 13 LYS HZ3 1 1 13 5640 1 1 13 LYS N N -3.829 -2.412 3.537 1.00 . A A . 13 LYS N 1 1 13 5641 1 1 13 LYS NZ N -6.810 -6.137 7.441 1.00 . A A . 13 LYS NZ 1 1 13 5642 1 1 13 LYS O O -6.374 -2.753 0.977 1.00 . A A . 13 LYS O 1 1 13 5643 1 1 14 GLU C C -5.106 -0.171 -0.799 1.00 . A A . 14 GLU C 1 1 13 5644 1 1 14 GLU CA C -5.771 -0.133 0.592 1.00 . A A . 14 GLU CA 1 1 13 5645 1 1 14 GLU CB C -5.620 1.256 1.241 1.00 . A A . 14 GLU CB 1 1 13 5646 1 1 14 GLU CD C -6.980 3.333 0.916 1.00 . A A . 14 GLU CD 1 1 13 5647 1 1 14 GLU CG C -6.023 2.349 0.251 1.00 . A A . 14 GLU CG 1 1 13 5648 1 1 14 GLU H H -4.318 -0.733 2.064 1.00 . A A . 14 GLU H 1 1 13 5649 1 1 14 GLU HA H -6.815 -0.392 0.517 1.00 . A A . 14 GLU HA 1 1 13 5650 1 1 14 GLU HB2 H -6.254 1.315 2.115 1.00 . A A . 14 GLU HB2 1 1 13 5651 1 1 14 GLU HB3 H -4.591 1.403 1.535 1.00 . A A . 14 GLU HB3 1 1 13 5652 1 1 14 GLU HG2 H -5.142 2.872 -0.088 1.00 . A A . 14 GLU HG2 1 1 13 5653 1 1 14 GLU HG3 H -6.512 1.895 -0.586 1.00 . A A . 14 GLU HG3 1 1 13 5654 1 1 14 GLU N N -5.066 -1.066 1.526 1.00 . A A . 14 GLU N 1 1 13 5655 1 1 14 GLU O O -5.721 0.158 -1.804 1.00 . A A . 14 GLU O 1 1 13 5656 1 1 14 GLU OE1 O -6.656 3.820 1.981 1.00 . A A . 14 GLU OE1 1 1 13 5657 1 1 14 GLU OE2 O -8.018 3.595 0.337 1.00 . A A . 14 GLU OE2 1 1 13 5658 1 1 15 CYS C C -3.579 -1.949 -2.905 1.00 . A A . 15 CYS C 1 1 13 5659 1 1 15 CYS CA C -3.181 -0.645 -2.207 1.00 . A A . 15 CYS CA 1 1 13 5660 1 1 15 CYS CB C -1.660 -0.612 -1.944 1.00 . A A . 15 CYS CB 1 1 13 5661 1 1 15 CYS H H -3.389 -0.854 -0.063 1.00 . A A . 15 CYS H 1 1 13 5662 1 1 15 CYS HA H -3.467 0.200 -2.812 1.00 . A A . 15 CYS HA 1 1 13 5663 1 1 15 CYS HB2 H -1.263 -1.610 -2.050 1.00 . A A . 15 CYS HB2 1 1 13 5664 1 1 15 CYS HB3 H -1.192 0.032 -2.676 1.00 . A A . 15 CYS HB3 1 1 13 5665 1 1 15 CYS N N -3.863 -0.579 -0.875 1.00 . A A . 15 CYS N 1 1 13 5666 1 1 15 CYS O O -3.589 -2.998 -2.293 1.00 . A A . 15 CYS O 1 1 13 5667 1 1 15 CYS SG S -1.282 0.003 -0.273 1.00 . A A . 15 CYS SG 1 1 13 5668 1 1 16 CYS C C -3.245 -4.210 -4.788 1.00 . A A . 16 CYS C 1 1 13 5669 1 1 16 CYS CA C -4.342 -3.149 -4.883 1.00 . A A . 16 CYS CA 1 1 13 5670 1 1 16 CYS CB C -4.585 -2.745 -6.345 1.00 . A A . 16 CYS CB 1 1 13 5671 1 1 16 CYS H H -3.914 -1.034 -4.644 1.00 . A A . 16 CYS H 1 1 13 5672 1 1 16 CYS HA H -5.255 -3.530 -4.454 1.00 . A A . 16 CYS HA 1 1 13 5673 1 1 16 CYS HB2 H -4.465 -1.676 -6.454 1.00 . A A . 16 CYS HB2 1 1 13 5674 1 1 16 CYS HB3 H -3.875 -3.253 -6.984 1.00 . A A . 16 CYS HB3 1 1 13 5675 1 1 16 CYS N N -3.923 -1.895 -4.170 1.00 . A A . 16 CYS N 1 1 13 5676 1 1 16 CYS O O -3.470 -5.300 -4.298 1.00 . A A . 16 CYS O 1 1 13 5677 1 1 16 CYS SG S -6.268 -3.217 -6.824 1.00 . A A . 16 CYS SG 1 1 13 5678 1 1 17 GLY C C -0.419 -4.859 -3.714 1.00 . A A . 17 GLY C 1 1 13 5679 1 1 17 GLY CA C -0.950 -4.887 -5.141 1.00 . A A . 17 GLY CA 1 1 13 5680 1 1 17 GLY H H -1.895 -3.011 -5.614 1.00 . A A . 17 GLY H 1 1 13 5681 1 1 17 GLY HA2 H -1.316 -5.877 -5.381 1.00 . A A . 17 GLY HA2 1 1 13 5682 1 1 17 GLY HA3 H -0.161 -4.615 -5.822 1.00 . A A . 17 GLY HA3 1 1 13 5683 1 1 17 GLY N N -2.061 -3.900 -5.236 1.00 . A A . 17 GLY N 1 1 13 5684 1 1 17 GLY O O 0.301 -3.951 -3.352 1.00 . A A . 17 GLY O 1 1 13 5685 1 1 18 TRP C C 0.895 -5.075 -1.219 1.00 . A A . 18 TRP C 1 1 13 5686 1 1 18 TRP CA C -0.364 -5.905 -1.469 1.00 . A A . 18 TRP CA 1 1 13 5687 1 1 18 TRP CB C -0.089 -7.390 -1.195 1.00 . A A . 18 TRP CB 1 1 13 5688 1 1 18 TRP CD1 C -1.858 -7.230 0.629 1.00 . A A . 18 TRP CD1 1 1 13 5689 1 1 18 TRP CD2 C -1.527 -9.338 -0.087 1.00 . A A . 18 TRP CD2 1 1 13 5690 1 1 18 TRP CE2 C -2.522 -9.400 0.916 1.00 . A A . 18 TRP CE2 1 1 13 5691 1 1 18 TRP CE3 C -1.135 -10.536 -0.709 1.00 . A A . 18 TRP CE3 1 1 13 5692 1 1 18 TRP CG C -1.117 -7.949 -0.253 1.00 . A A . 18 TRP CG 1 1 13 5693 1 1 18 TRP CH2 C -2.710 -11.789 0.661 1.00 . A A . 18 TRP CH2 1 1 13 5694 1 1 18 TRP CZ2 C -3.107 -10.608 1.291 1.00 . A A . 18 TRP CZ2 1 1 13 5695 1 1 18 TRP CZ3 C -1.724 -11.753 -0.336 1.00 . A A . 18 TRP CZ3 1 1 13 5696 1 1 18 TRP H H -1.406 -6.518 -3.250 1.00 . A A . 18 TRP H 1 1 13 5697 1 1 18 TRP HA H -1.158 -5.563 -0.828 1.00 . A A . 18 TRP HA 1 1 13 5698 1 1 18 TRP HB2 H -0.122 -7.939 -2.125 1.00 . A A . 18 TRP HB2 1 1 13 5699 1 1 18 TRP HB3 H 0.892 -7.497 -0.755 1.00 . A A . 18 TRP HB3 1 1 13 5700 1 1 18 TRP HD1 H -1.807 -6.157 0.772 1.00 . A A . 18 TRP HD1 1 1 13 5701 1 1 18 TRP HE1 H -3.315 -7.829 2.028 1.00 . A A . 18 TRP HE1 1 1 13 5702 1 1 18 TRP HE3 H -0.375 -10.520 -1.474 1.00 . A A . 18 TRP HE3 1 1 13 5703 1 1 18 TRP HH2 H -3.161 -12.727 0.942 1.00 . A A . 18 TRP HH2 1 1 13 5704 1 1 18 TRP HZ2 H -3.865 -10.631 2.058 1.00 . A A . 18 TRP HZ2 1 1 13 5705 1 1 18 TRP HZ3 H -1.417 -12.667 -0.822 1.00 . A A . 18 TRP HZ3 1 1 13 5706 1 1 18 TRP N N -0.803 -5.833 -2.907 1.00 . A A . 18 TRP N 1 1 13 5707 1 1 18 TRP NE1 N -2.683 -8.093 1.328 1.00 . A A . 18 TRP NE1 1 1 13 5708 1 1 18 TRP O O 1.999 -5.474 -1.555 1.00 . A A . 18 TRP O 1 1 13 5709 1 1 19 ASN C C 1.727 -2.408 1.034 1.00 . A A . 19 ASN C 1 1 13 5710 1 1 19 ASN CA C 1.879 -3.021 -0.369 1.00 . A A . 19 ASN CA 1 1 13 5711 1 1 19 ASN CB C 1.797 -1.954 -1.461 1.00 . A A . 19 ASN CB 1 1 13 5712 1 1 19 ASN CG C 2.942 -0.958 -1.308 1.00 . A A . 19 ASN CG 1 1 13 5713 1 1 19 ASN H H -0.189 -3.637 -0.407 1.00 . A A . 19 ASN H 1 1 13 5714 1 1 19 ASN HA H 2.814 -3.558 -0.449 1.00 . A A . 19 ASN HA 1 1 13 5715 1 1 19 ASN HB2 H 1.858 -2.426 -2.432 1.00 . A A . 19 ASN HB2 1 1 13 5716 1 1 19 ASN HB3 H 0.857 -1.433 -1.374 1.00 . A A . 19 ASN HB3 1 1 13 5717 1 1 19 ASN HD21 H 4.090 -1.812 -2.680 1.00 . A A . 19 ASN HD21 1 1 13 5718 1 1 19 ASN HD22 H 4.739 -0.428 -1.947 1.00 . A A . 19 ASN HD22 1 1 13 5719 1 1 19 ASN N N 0.721 -3.920 -0.650 1.00 . A A . 19 ASN N 1 1 13 5720 1 1 19 ASN ND2 N 4.014 -1.079 -2.035 1.00 . A A . 19 ASN ND2 1 1 13 5721 1 1 19 ASN O O 0.681 -2.497 1.649 1.00 . A A . 19 ASN O 1 1 13 5722 1 1 19 ASN OD1 O 2.862 -0.065 -0.503 1.00 . A A . 19 ASN OD1 1 1 13 5723 1 1 20 ALA C C 2.450 0.285 2.882 1.00 . A A . 20 ALA C 1 1 13 5724 1 1 20 ALA CA C 2.676 -1.223 2.927 1.00 . A A . 20 ALA CA 1 1 13 5725 1 1 20 ALA CB C 4.031 -1.512 3.565 1.00 . A A . 20 ALA CB 1 1 13 5726 1 1 20 ALA H H 3.607 -1.761 1.059 1.00 . A A . 20 ALA H 1 1 13 5727 1 1 20 ALA HA H 1.896 -1.705 3.493 1.00 . A A . 20 ALA HA 1 1 13 5728 1 1 20 ALA HB1 H 4.328 -2.524 3.337 1.00 . A A . 20 ALA HB1 1 1 13 5729 1 1 20 ALA HB2 H 3.963 -1.388 4.637 1.00 . A A . 20 ALA HB2 1 1 13 5730 1 1 20 ALA HB3 H 4.763 -0.821 3.171 1.00 . A A . 20 ALA HB3 1 1 13 5731 1 1 20 ALA N N 2.765 -1.812 1.558 1.00 . A A . 20 ALA N 1 1 13 5732 1 1 20 ALA O O 3.192 1.018 2.249 1.00 . A A . 20 ALA O 1 1 13 5733 1 1 21 CYS C C 2.138 2.799 4.746 1.00 . A A . 21 CYS C 1 1 13 5734 1 1 21 CYS CA C 1.225 2.232 3.658 1.00 . A A . 21 CYS CA 1 1 13 5735 1 1 21 CYS CB C -0.251 2.404 4.033 1.00 . A A . 21 CYS CB 1 1 13 5736 1 1 21 CYS H H 0.920 0.155 4.136 1.00 . A A . 21 CYS H 1 1 13 5737 1 1 21 CYS HA H 1.432 2.690 2.706 1.00 . A A . 21 CYS HA 1 1 13 5738 1 1 21 CYS HB2 H -0.799 1.516 3.763 1.00 . A A . 21 CYS HB2 1 1 13 5739 1 1 21 CYS HB3 H -0.340 2.569 5.097 1.00 . A A . 21 CYS HB3 1 1 13 5740 1 1 21 CYS N N 1.468 0.762 3.601 1.00 . A A . 21 CYS N 1 1 13 5741 1 1 21 CYS O O 1.946 2.533 5.919 1.00 . A A . 21 CYS O 1 1 13 5742 1 1 21 CYS SG S -0.938 3.818 3.141 1.00 . A A . 21 CYS SG 1 1 13 5743 1 1 22 ALA C C 4.276 5.566 5.298 1.00 . A A . 22 ALA C 1 1 13 5744 1 1 22 ALA CA C 4.105 4.051 5.402 1.00 . A A . 22 ALA CA 1 1 13 5745 1 1 22 ALA CB C 5.425 3.344 5.102 1.00 . A A . 22 ALA CB 1 1 13 5746 1 1 22 ALA H H 3.316 3.687 3.418 1.00 . A A . 22 ALA H 1 1 13 5747 1 1 22 ALA HA H 3.769 3.783 6.388 1.00 . A A . 22 ALA HA 1 1 13 5748 1 1 22 ALA HB1 H 6.238 3.880 5.571 1.00 . A A . 22 ALA HB1 1 1 13 5749 1 1 22 ALA HB2 H 5.581 3.312 4.034 1.00 . A A . 22 ALA HB2 1 1 13 5750 1 1 22 ALA HB3 H 5.389 2.335 5.490 1.00 . A A . 22 ALA HB3 1 1 13 5751 1 1 22 ALA N N 3.158 3.523 4.373 1.00 . A A . 22 ALA N 1 1 13 5752 1 1 22 ALA O O 3.806 6.304 6.138 1.00 . A A . 22 ALA O 1 1 13 5753 1 1 23 LEU C C 3.913 8.204 3.663 1.00 . A A . 23 LEU C 1 1 13 5754 1 1 23 LEU CA C 5.196 7.510 4.152 1.00 . A A . 23 LEU CA 1 1 13 5755 1 1 23 LEU CB C 6.319 7.630 3.107 1.00 . A A . 23 LEU CB 1 1 13 5756 1 1 23 LEU CD1 C 7.574 6.408 4.968 1.00 . A A . 23 LEU CD1 1 1 13 5757 1 1 23 LEU CD2 C 8.491 6.450 2.656 1.00 . A A . 23 LEU CD2 1 1 13 5758 1 1 23 LEU CG C 7.705 7.257 3.695 1.00 . A A . 23 LEU CG 1 1 13 5759 1 1 23 LEU H H 5.355 5.418 3.640 1.00 . A A . 23 LEU H 1 1 13 5760 1 1 23 LEU HA H 5.517 7.931 5.093 1.00 . A A . 23 LEU HA 1 1 13 5761 1 1 23 LEU HB2 H 6.098 6.974 2.280 1.00 . A A . 23 LEU HB2 1 1 13 5762 1 1 23 LEU HB3 H 6.350 8.650 2.748 1.00 . A A . 23 LEU HB3 1 1 13 5763 1 1 23 LEU HD11 H 8.542 6.320 5.441 1.00 . A A . 23 LEU HD11 1 1 13 5764 1 1 23 LEU HD12 H 7.214 5.423 4.709 1.00 . A A . 23 LEU HD12 1 1 13 5765 1 1 23 LEU HD13 H 6.883 6.877 5.650 1.00 . A A . 23 LEU HD13 1 1 13 5766 1 1 23 LEU HD21 H 8.309 5.393 2.806 1.00 . A A . 23 LEU HD21 1 1 13 5767 1 1 23 LEU HD22 H 9.543 6.653 2.767 1.00 . A A . 23 LEU HD22 1 1 13 5768 1 1 23 LEU HD23 H 8.171 6.732 1.661 1.00 . A A . 23 LEU HD23 1 1 13 5769 1 1 23 LEU HG H 8.244 8.163 3.928 1.00 . A A . 23 LEU HG 1 1 13 5770 1 1 23 LEU N N 4.967 6.034 4.294 1.00 . A A . 23 LEU N 1 1 13 5771 1 1 23 LEU O O 3.920 8.908 2.674 1.00 . A A . 23 LEU O 1 1 13 5772 1 1 24 GLY C C 1.004 7.978 2.623 1.00 . A A . 24 GLY C 1 1 13 5773 1 1 24 GLY CA C 1.526 8.644 3.908 1.00 . A A . 24 GLY CA 1 1 13 5774 1 1 24 GLY H H 2.818 7.429 5.141 1.00 . A A . 24 GLY H 1 1 13 5775 1 1 24 GLY HA2 H 0.788 8.538 4.692 1.00 . A A . 24 GLY HA2 1 1 13 5776 1 1 24 GLY HA3 H 1.697 9.694 3.720 1.00 . A A . 24 GLY HA3 1 1 13 5777 1 1 24 GLY N N 2.808 8.004 4.342 1.00 . A A . 24 GLY N 1 1 13 5778 1 1 24 GLY O O 0.014 8.400 2.059 1.00 . A A . 24 GLY O 1 1 13 5779 1 1 25 ILE C C 1.668 4.800 0.915 1.00 . A A . 25 ILE C 1 1 13 5780 1 1 25 ILE CA C 1.202 6.257 0.903 1.00 . A A . 25 ILE CA 1 1 13 5781 1 1 25 ILE CB C 1.857 6.995 -0.286 1.00 . A A . 25 ILE CB 1 1 13 5782 1 1 25 ILE CD1 C 3.168 8.982 -1.056 1.00 . A A . 25 ILE CD1 1 1 13 5783 1 1 25 ILE CG1 C 2.596 8.263 0.164 1.00 . A A . 25 ILE CG1 1 1 13 5784 1 1 25 ILE CG2 C 0.782 7.382 -1.296 1.00 . A A . 25 ILE CG2 1 1 13 5785 1 1 25 ILE H H 2.453 6.613 2.618 1.00 . A A . 25 ILE H 1 1 13 5786 1 1 25 ILE HA H 0.129 6.307 0.821 1.00 . A A . 25 ILE HA 1 1 13 5787 1 1 25 ILE HB H 2.552 6.327 -0.765 1.00 . A A . 25 ILE HB 1 1 13 5788 1 1 25 ILE HD11 H 3.992 8.412 -1.460 1.00 . A A . 25 ILE HD11 1 1 13 5789 1 1 25 ILE HD12 H 3.517 9.960 -0.764 1.00 . A A . 25 ILE HD12 1 1 13 5790 1 1 25 ILE HD13 H 2.399 9.084 -1.808 1.00 . A A . 25 ILE HD13 1 1 13 5791 1 1 25 ILE HG12 H 1.909 8.921 0.677 1.00 . A A . 25 ILE HG12 1 1 13 5792 1 1 25 ILE HG13 H 3.401 7.993 0.828 1.00 . A A . 25 ILE HG13 1 1 13 5793 1 1 25 ILE HG21 H 0.373 6.490 -1.743 1.00 . A A . 25 ILE HG21 1 1 13 5794 1 1 25 ILE HG22 H 1.222 7.999 -2.066 1.00 . A A . 25 ILE HG22 1 1 13 5795 1 1 25 ILE HG23 H -0.002 7.932 -0.798 1.00 . A A . 25 ILE HG23 1 1 13 5796 1 1 25 ILE N N 1.661 6.944 2.151 1.00 . A A . 25 ILE N 1 1 13 5797 1 1 25 ILE O O 2.317 4.355 1.849 1.00 . A A . 25 ILE O 1 1 13 5798 1 1 26 CYS C C 3.259 2.612 -0.725 1.00 . A A . 26 CYS C 1 1 13 5799 1 1 26 CYS CA C 1.824 2.642 -0.190 1.00 . A A . 26 CYS CA 1 1 13 5800 1 1 26 CYS CB C 0.866 1.953 -1.178 1.00 . A A . 26 CYS CB 1 1 13 5801 1 1 26 CYS H H 0.875 4.461 -0.885 1.00 . A A . 26 CYS H 1 1 13 5802 1 1 26 CYS HA H 1.764 2.176 0.780 1.00 . A A . 26 CYS HA 1 1 13 5803 1 1 26 CYS HB2 H 0.884 2.479 -2.118 1.00 . A A . 26 CYS HB2 1 1 13 5804 1 1 26 CYS HB3 H 1.184 0.939 -1.333 1.00 . A A . 26 CYS HB3 1 1 13 5805 1 1 26 CYS N N 1.372 4.065 -0.126 1.00 . A A . 26 CYS N 1 1 13 5806 1 1 26 CYS O O 3.520 3.101 -1.803 1.00 . A A . 26 CYS O 1 1 13 5807 1 1 26 CYS SG S -0.825 1.959 -0.523 1.00 . A A . 26 CYS SG 1 1 13 5808 1 1 27 MET C C 6.441 0.837 -0.015 1.00 . A A . 27 MET C 1 1 13 5809 1 1 27 MET CA C 5.609 2.040 -0.522 1.00 . A A . 27 MET CA 1 1 13 5810 1 1 27 MET CB C 6.225 3.366 -0.058 1.00 . A A . 27 MET CB 1 1 13 5811 1 1 27 MET CE C 8.594 5.419 -0.826 1.00 . A A . 27 MET CE 1 1 13 5812 1 1 27 MET CG C 6.087 4.410 -1.163 1.00 . A A . 27 MET CG 1 1 13 5813 1 1 27 MET H H 3.984 1.663 0.878 1.00 . A A . 27 MET H 1 1 13 5814 1 1 27 MET HA H 5.588 2.029 -1.593 1.00 . A A . 27 MET HA 1 1 13 5815 1 1 27 MET HB2 H 5.715 3.714 0.830 1.00 . A A . 27 MET HB2 1 1 13 5816 1 1 27 MET HB3 H 7.271 3.217 0.163 1.00 . A A . 27 MET HB3 1 1 13 5817 1 1 27 MET HE1 H 9.572 4.964 -0.721 1.00 . A A . 27 MET HE1 1 1 13 5818 1 1 27 MET HE2 H 8.080 5.374 0.120 1.00 . A A . 27 MET HE2 1 1 13 5819 1 1 27 MET HE3 H 8.704 6.453 -1.125 1.00 . A A . 27 MET HE3 1 1 13 5820 1 1 27 MET HG2 H 5.294 4.119 -1.832 1.00 . A A . 27 MET HG2 1 1 13 5821 1 1 27 MET HG3 H 5.851 5.369 -0.723 1.00 . A A . 27 MET HG3 1 1 13 5822 1 1 27 MET N N 4.203 2.057 0.004 1.00 . A A . 27 MET N 1 1 13 5823 1 1 27 MET O O 6.719 -0.057 -0.786 1.00 . A A . 27 MET O 1 1 13 5824 1 1 27 MET SD S 7.643 4.526 -2.081 1.00 . A A . 27 MET SD 1 1 13 5825 1 1 28 PRO C C 6.948 -1.508 2.035 1.00 . A A . 28 PRO C 1 1 13 5826 1 1 28 PRO CA C 7.719 -0.207 1.798 1.00 . A A . 28 PRO CA 1 1 13 5827 1 1 28 PRO CB C 8.216 0.390 3.118 1.00 . A A . 28 PRO CB 1 1 13 5828 1 1 28 PRO CD C 6.564 1.914 2.239 1.00 . A A . 28 PRO CD 1 1 13 5829 1 1 28 PRO CG C 7.173 1.387 3.509 1.00 . A A . 28 PRO CG 1 1 13 5830 1 1 28 PRO HA H 8.562 -0.387 1.145 1.00 . A A . 28 PRO HA 1 1 13 5831 1 1 28 PRO HB2 H 8.307 -0.379 3.875 1.00 . A A . 28 PRO HB2 1 1 13 5832 1 1 28 PRO HB3 H 9.161 0.891 2.971 1.00 . A A . 28 PRO HB3 1 1 13 5833 1 1 28 PRO HD2 H 5.497 2.037 2.357 1.00 . A A . 28 PRO HD2 1 1 13 5834 1 1 28 PRO HD3 H 7.027 2.847 1.957 1.00 . A A . 28 PRO HD3 1 1 13 5835 1 1 28 PRO HG2 H 6.413 0.908 4.112 1.00 . A A . 28 PRO HG2 1 1 13 5836 1 1 28 PRO HG3 H 7.626 2.196 4.057 1.00 . A A . 28 PRO HG3 1 1 13 5837 1 1 28 PRO N N 6.860 0.879 1.236 1.00 . A A . 28 PRO N 1 1 13 5838 1 1 28 PRO O O 6.723 -1.909 3.164 1.00 . A A . 28 PRO O 1 1 13 5839 1 1 29 ARG C C 6.736 -4.572 1.715 1.00 . A A . 29 ARG C 1 1 13 5840 1 1 29 ARG CA C 5.820 -3.476 1.130 1.00 . A A . 29 ARG CA 1 1 13 5841 1 1 29 ARG CB C 5.354 -3.847 -0.291 1.00 . A A . 29 ARG CB 1 1 13 5842 1 1 29 ARG CD C 6.912 -3.257 -2.181 1.00 . A A . 29 ARG CD 1 1 13 5843 1 1 29 ARG CG C 6.543 -4.329 -1.142 1.00 . A A . 29 ARG CG 1 1 13 5844 1 1 29 ARG CZ C 9.108 -2.648 -3.079 1.00 . A A . 29 ARG CZ 1 1 13 5845 1 1 29 ARG H H 6.775 -1.833 0.094 1.00 . A A . 29 ARG H 1 1 13 5846 1 1 29 ARG HA H 4.963 -3.336 1.774 1.00 . A A . 29 ARG HA 1 1 13 5847 1 1 29 ARG HB2 H 4.616 -4.636 -0.232 1.00 . A A . 29 ARG HB2 1 1 13 5848 1 1 29 ARG HB3 H 4.919 -2.979 -0.754 1.00 . A A . 29 ARG HB3 1 1 13 5849 1 1 29 ARG HD2 H 6.273 -3.344 -3.043 1.00 . A A . 29 ARG HD2 1 1 13 5850 1 1 29 ARG HD3 H 6.843 -2.267 -1.752 1.00 . A A . 29 ARG HD3 1 1 13 5851 1 1 29 ARG HE H 8.680 -4.463 -2.386 1.00 . A A . 29 ARG HE 1 1 13 5852 1 1 29 ARG HG2 H 7.390 -4.520 -0.497 1.00 . A A . 29 ARG HG2 1 1 13 5853 1 1 29 ARG HG3 H 6.274 -5.242 -1.652 1.00 . A A . 29 ARG HG3 1 1 13 5854 1 1 29 ARG HH11 H 7.730 -1.203 -3.063 1.00 . A A . 29 ARG HH11 1 1 13 5855 1 1 29 ARG HH12 H 9.268 -0.744 -3.695 1.00 . A A . 29 ARG HH12 1 1 13 5856 1 1 29 ARG HH21 H 10.694 -3.875 -3.222 1.00 . A A . 29 ARG HH21 1 1 13 5857 1 1 29 ARG HH22 H 10.954 -2.260 -3.790 1.00 . A A . 29 ARG HH22 1 1 13 5858 1 1 29 ARG N N 6.563 -2.179 0.983 1.00 . A A . 29 ARG N 1 1 13 5859 1 1 29 ARG NE N 8.328 -3.563 -2.550 1.00 . A A . 29 ARG NE 1 1 13 5860 1 1 29 ARG NH1 N 8.663 -1.438 -3.294 1.00 . A A . 29 ARG NH1 1 1 13 5861 1 1 29 ARG NH2 N 10.347 -2.951 -3.386 1.00 . A A . 29 ARG NH2 1 1 13 5862 1 1 29 ARG O O 7.944 -4.434 1.625 1.00 . A A . 29 ARG O 1 1 13 5863 1 1 29 ARG OXT O 6.207 -5.526 2.255 1.00 . A A . 29 ARG OXT 1 1 14 5864 1 1 1 GLY C C -9.830 0.866 -4.195 1.00 . A A . 1 GLY C 1 1 14 5865 1 1 1 GLY CA C -11.276 1.001 -4.688 1.00 . A A . 1 GLY CA 1 1 14 5866 1 1 1 GLY H1 H -13.028 1.816 -3.913 1.00 . A A . 1 GLY H1 1 1 14 5867 1 1 1 GLY H2 H -11.778 2.944 -4.130 1.00 . A A . 1 GLY H2 1 1 14 5868 1 1 1 GLY H3 H -11.717 1.844 -2.838 1.00 . A A . 1 GLY H3 1 1 14 5869 1 1 1 GLY HA2 H -11.767 0.037 -4.638 1.00 . A A . 1 GLY HA2 1 1 14 5870 1 1 1 GLY HA3 H -11.275 1.351 -5.709 1.00 . A A . 1 GLY HA3 1 1 14 5871 1 1 1 GLY N N -12.005 1.975 -3.828 1.00 . A A . 1 GLY N 1 1 14 5872 1 1 1 GLY O O -9.471 1.392 -3.157 1.00 . A A . 1 GLY O 1 1 14 5873 1 1 2 CYS C C -6.692 1.068 -5.164 1.00 . A A . 2 CYS C 1 1 14 5874 1 1 2 CYS CA C -7.573 0.005 -4.500 1.00 . A A . 2 CYS CA 1 1 14 5875 1 1 2 CYS CB C -7.178 -1.389 -4.994 1.00 . A A . 2 CYS CB 1 1 14 5876 1 1 2 CYS H H -9.311 -0.240 -5.763 1.00 . A A . 2 CYS H 1 1 14 5877 1 1 2 CYS HA H -7.487 0.056 -3.425 1.00 . A A . 2 CYS HA 1 1 14 5878 1 1 2 CYS HB2 H -6.218 -1.661 -4.579 1.00 . A A . 2 CYS HB2 1 1 14 5879 1 1 2 CYS HB3 H -7.921 -2.106 -4.678 1.00 . A A . 2 CYS HB3 1 1 14 5880 1 1 2 CYS N N -9.000 0.173 -4.927 1.00 . A A . 2 CYS N 1 1 14 5881 1 1 2 CYS O O -7.063 1.651 -6.162 1.00 . A A . 2 CYS O 1 1 14 5882 1 1 2 CYS SG S -7.078 -1.378 -6.809 1.00 . A A . 2 CYS SG 1 1 14 5883 1 1 3 LYS C C -3.241 1.676 -5.534 1.00 . A A . 3 LYS C 1 1 14 5884 1 1 3 LYS CA C -4.600 2.317 -5.239 1.00 . A A . 3 LYS CA 1 1 14 5885 1 1 3 LYS CB C -4.439 3.442 -4.214 1.00 . A A . 3 LYS CB 1 1 14 5886 1 1 3 LYS CD C -5.638 5.308 -3.075 1.00 . A A . 3 LYS CD 1 1 14 5887 1 1 3 LYS CE C -6.858 5.593 -2.189 1.00 . A A . 3 LYS CE 1 1 14 5888 1 1 3 LYS CG C -5.810 3.961 -3.782 1.00 . A A . 3 LYS CG 1 1 14 5889 1 1 3 LYS H H -5.249 0.815 -3.825 1.00 . A A . 3 LYS H 1 1 14 5890 1 1 3 LYS HA H -5.027 2.710 -6.149 1.00 . A A . 3 LYS HA 1 1 14 5891 1 1 3 LYS HB2 H -3.894 3.083 -3.352 1.00 . A A . 3 LYS HB2 1 1 14 5892 1 1 3 LYS HB3 H -3.889 4.246 -4.672 1.00 . A A . 3 LYS HB3 1 1 14 5893 1 1 3 LYS HD2 H -4.744 5.281 -2.467 1.00 . A A . 3 LYS HD2 1 1 14 5894 1 1 3 LYS HD3 H -5.543 6.089 -3.815 1.00 . A A . 3 LYS HD3 1 1 14 5895 1 1 3 LYS HE2 H -7.243 6.583 -2.393 1.00 . A A . 3 LYS HE2 1 1 14 5896 1 1 3 LYS HE3 H -7.624 4.847 -2.350 1.00 . A A . 3 LYS HE3 1 1 14 5897 1 1 3 LYS HG2 H -6.434 4.089 -4.656 1.00 . A A . 3 LYS HG2 1 1 14 5898 1 1 3 LYS HG3 H -6.271 3.254 -3.108 1.00 . A A . 3 LYS HG3 1 1 14 5899 1 1 3 LYS HZ1 H -5.685 6.299 -0.612 1.00 . A A . 3 LYS HZ1 1 1 14 5900 1 1 3 LYS HZ2 H -5.858 4.593 -0.647 1.00 . A A . 3 LYS HZ2 1 1 14 5901 1 1 3 LYS HZ3 H -7.147 5.581 -0.125 1.00 . A A . 3 LYS HZ3 1 1 14 5902 1 1 3 LYS N N -5.523 1.309 -4.624 1.00 . A A . 3 LYS N 1 1 14 5903 1 1 3 LYS NZ N -6.351 5.511 -0.790 1.00 . A A . 3 LYS NZ 1 1 14 5904 1 1 3 LYS O O -2.968 0.562 -5.122 1.00 . A A . 3 LYS O 1 1 14 5905 1 1 4 LEU C C -0.090 2.074 -5.383 1.00 . A A . 4 LEU C 1 1 14 5906 1 1 4 LEU CA C -1.041 1.828 -6.567 1.00 . A A . 4 LEU CA 1 1 14 5907 1 1 4 LEU CB C -0.600 2.586 -7.835 1.00 . A A . 4 LEU CB 1 1 14 5908 1 1 4 LEU CD1 C -0.963 0.482 -9.143 1.00 . A A . 4 LEU CD1 1 1 14 5909 1 1 4 LEU CD2 C -2.768 2.196 -9.021 1.00 . A A . 4 LEU CD2 1 1 14 5910 1 1 4 LEU CG C -1.257 1.978 -9.077 1.00 . A A . 4 LEU CG 1 1 14 5911 1 1 4 LEU H H -2.643 3.266 -6.550 1.00 . A A . 4 LEU H 1 1 14 5912 1 1 4 LEU HA H -1.106 0.773 -6.772 1.00 . A A . 4 LEU HA 1 1 14 5913 1 1 4 LEU HB2 H -0.888 3.618 -7.751 1.00 . A A . 4 LEU HB2 1 1 14 5914 1 1 4 LEU HB3 H 0.468 2.525 -7.945 1.00 . A A . 4 LEU HB3 1 1 14 5915 1 1 4 LEU HD11 H -1.765 -0.064 -8.669 1.00 . A A . 4 LEU HD11 1 1 14 5916 1 1 4 LEU HD12 H -0.034 0.278 -8.633 1.00 . A A . 4 LEU HD12 1 1 14 5917 1 1 4 LEU HD13 H -0.882 0.179 -10.175 1.00 . A A . 4 LEU HD13 1 1 14 5918 1 1 4 LEU HD21 H -3.219 1.437 -8.399 1.00 . A A . 4 LEU HD21 1 1 14 5919 1 1 4 LEU HD22 H -3.178 2.136 -10.018 1.00 . A A . 4 LEU HD22 1 1 14 5920 1 1 4 LEU HD23 H -2.971 3.170 -8.608 1.00 . A A . 4 LEU HD23 1 1 14 5921 1 1 4 LEU HG H -0.861 2.456 -9.961 1.00 . A A . 4 LEU HG 1 1 14 5922 1 1 4 LEU N N -2.392 2.374 -6.238 1.00 . A A . 4 LEU N 1 1 14 5923 1 1 4 LEU O O -0.488 1.977 -4.234 1.00 . A A . 4 LEU O 1 1 14 5924 1 1 5 THR C C 2.008 4.036 -3.993 1.00 . A A . 5 THR C 1 1 14 5925 1 1 5 THR CA C 2.113 2.597 -4.523 1.00 . A A . 5 THR CA 1 1 14 5926 1 1 5 THR CB C 3.507 2.329 -5.120 1.00 . A A . 5 THR CB 1 1 14 5927 1 1 5 THR CG2 C 4.262 1.342 -4.232 1.00 . A A . 5 THR CG2 1 1 14 5928 1 1 5 THR H H 1.461 2.434 -6.561 1.00 . A A . 5 THR H 1 1 14 5929 1 1 5 THR HA H 1.919 1.898 -3.724 1.00 . A A . 5 THR HA 1 1 14 5930 1 1 5 THR HB H 4.061 3.252 -5.165 1.00 . A A . 5 THR HB 1 1 14 5931 1 1 5 THR HG1 H 3.765 2.418 -7.054 1.00 . A A . 5 THR HG1 1 1 14 5932 1 1 5 THR HG21 H 3.560 0.650 -3.791 1.00 . A A . 5 THR HG21 1 1 14 5933 1 1 5 THR HG22 H 4.776 1.878 -3.446 1.00 . A A . 5 THR HG22 1 1 14 5934 1 1 5 THR HG23 H 4.980 0.800 -4.827 1.00 . A A . 5 THR HG23 1 1 14 5935 1 1 5 THR N N 1.152 2.372 -5.639 1.00 . A A . 5 THR N 1 1 14 5936 1 1 5 THR O O 1.540 4.267 -2.894 1.00 . A A . 5 THR O 1 1 14 5937 1 1 5 THR OG1 O 3.387 1.783 -6.434 1.00 . A A . 5 THR OG1 1 1 14 5938 1 1 6 PHE C C 0.971 7.007 -4.274 1.00 . A A . 6 PHE C 1 1 14 5939 1 1 6 PHE CA C 2.397 6.425 -4.260 1.00 . A A . 6 PHE CA 1 1 14 5940 1 1 6 PHE CB C 3.319 7.215 -5.204 1.00 . A A . 6 PHE CB 1 1 14 5941 1 1 6 PHE CD1 C 5.273 6.860 -3.648 1.00 . A A . 6 PHE CD1 1 1 14 5942 1 1 6 PHE CD2 C 4.850 9.092 -4.497 1.00 . A A . 6 PHE CD2 1 1 14 5943 1 1 6 PHE CE1 C 6.374 7.342 -2.930 1.00 . A A . 6 PHE CE1 1 1 14 5944 1 1 6 PHE CE2 C 5.954 9.572 -3.777 1.00 . A A . 6 PHE CE2 1 1 14 5945 1 1 6 PHE CG C 4.509 7.734 -4.431 1.00 . A A . 6 PHE CG 1 1 14 5946 1 1 6 PHE CZ C 6.713 8.697 -2.993 1.00 . A A . 6 PHE CZ 1 1 14 5947 1 1 6 PHE H H 2.824 4.805 -5.618 1.00 . A A . 6 PHE H 1 1 14 5948 1 1 6 PHE HA H 2.791 6.471 -3.259 1.00 . A A . 6 PHE HA 1 1 14 5949 1 1 6 PHE HB2 H 3.663 6.571 -6.000 1.00 . A A . 6 PHE HB2 1 1 14 5950 1 1 6 PHE HB3 H 2.774 8.047 -5.625 1.00 . A A . 6 PHE HB3 1 1 14 5951 1 1 6 PHE HD1 H 5.011 5.813 -3.598 1.00 . A A . 6 PHE HD1 1 1 14 5952 1 1 6 PHE HD2 H 4.262 9.767 -5.102 1.00 . A A . 6 PHE HD2 1 1 14 5953 1 1 6 PHE HE1 H 6.962 6.666 -2.323 1.00 . A A . 6 PHE HE1 1 1 14 5954 1 1 6 PHE HE2 H 6.218 10.617 -3.825 1.00 . A A . 6 PHE HE2 1 1 14 5955 1 1 6 PHE HZ H 7.565 9.067 -2.438 1.00 . A A . 6 PHE HZ 1 1 14 5956 1 1 6 PHE N N 2.448 5.007 -4.746 1.00 . A A . 6 PHE N 1 1 14 5957 1 1 6 PHE O O 0.777 8.179 -4.540 1.00 . A A . 6 PHE O 1 1 14 5958 1 1 7 TRP C C -1.795 6.999 -2.444 1.00 . A A . 7 TRP C 1 1 14 5959 1 1 7 TRP CA C -1.413 6.766 -3.906 1.00 . A A . 7 TRP CA 1 1 14 5960 1 1 7 TRP CB C -2.286 5.684 -4.521 1.00 . A A . 7 TRP CB 1 1 14 5961 1 1 7 TRP CD1 C -0.881 5.695 -6.619 1.00 . A A . 7 TRP CD1 1 1 14 5962 1 1 7 TRP CD2 C -3.087 5.578 -7.057 1.00 . A A . 7 TRP CD2 1 1 14 5963 1 1 7 TRP CE2 C -2.423 5.590 -8.305 1.00 . A A . 7 TRP CE2 1 1 14 5964 1 1 7 TRP CE3 C -4.494 5.497 -7.051 1.00 . A A . 7 TRP CE3 1 1 14 5965 1 1 7 TRP CG C -2.085 5.659 -6.001 1.00 . A A . 7 TRP CG 1 1 14 5966 1 1 7 TRP CH2 C -4.523 5.444 -9.487 1.00 . A A . 7 TRP CH2 1 1 14 5967 1 1 7 TRP CZ2 C -3.127 5.527 -9.506 1.00 . A A . 7 TRP CZ2 1 1 14 5968 1 1 7 TRP CZ3 C -5.207 5.429 -8.260 1.00 . A A . 7 TRP CZ3 1 1 14 5969 1 1 7 TRP H H 0.132 5.289 -3.707 1.00 . A A . 7 TRP H 1 1 14 5970 1 1 7 TRP HA H -1.486 7.682 -4.476 1.00 . A A . 7 TRP HA 1 1 14 5971 1 1 7 TRP HB2 H -2.017 4.726 -4.101 1.00 . A A . 7 TRP HB2 1 1 14 5972 1 1 7 TRP HB3 H -3.320 5.895 -4.301 1.00 . A A . 7 TRP HB3 1 1 14 5973 1 1 7 TRP HD1 H 0.078 5.745 -6.124 1.00 . A A . 7 TRP HD1 1 1 14 5974 1 1 7 TRP HE1 H -0.368 5.700 -8.654 1.00 . A A . 7 TRP HE1 1 1 14 5975 1 1 7 TRP HE3 H -5.029 5.487 -6.112 1.00 . A A . 7 TRP HE3 1 1 14 5976 1 1 7 TRP HH2 H -5.071 5.390 -10.417 1.00 . A A . 7 TRP HH2 1 1 14 5977 1 1 7 TRP HZ2 H -2.597 5.539 -10.447 1.00 . A A . 7 TRP HZ2 1 1 14 5978 1 1 7 TRP HZ3 H -6.287 5.360 -8.243 1.00 . A A . 7 TRP HZ3 1 1 14 5979 1 1 7 TRP N N -0.028 6.223 -3.949 1.00 . A A . 7 TRP N 1 1 14 5980 1 1 7 TRP NE1 N -1.079 5.672 -7.984 1.00 . A A . 7 TRP NE1 1 1 14 5981 1 1 7 TRP O O -1.759 6.081 -1.644 1.00 . A A . 7 TRP O 1 1 14 5982 1 1 8 LYS C C -3.358 7.436 -0.053 1.00 . A A . 8 LYS C 1 1 14 5983 1 1 8 LYS CA C -2.490 8.539 -0.672 1.00 . A A . 8 LYS CA 1 1 14 5984 1 1 8 LYS CB C -3.270 9.857 -0.759 1.00 . A A . 8 LYS CB 1 1 14 5985 1 1 8 LYS CD C -2.608 11.908 0.505 1.00 . A A . 8 LYS CD 1 1 14 5986 1 1 8 LYS CE C -3.059 12.797 1.673 1.00 . A A . 8 LYS CE 1 1 14 5987 1 1 8 LYS CG C -3.290 10.542 0.609 1.00 . A A . 8 LYS CG 1 1 14 5988 1 1 8 LYS H H -2.127 8.929 -2.752 1.00 . A A . 8 LYS H 1 1 14 5989 1 1 8 LYS HA H -1.592 8.680 -0.089 1.00 . A A . 8 LYS HA 1 1 14 5990 1 1 8 LYS HB2 H -2.796 10.508 -1.480 1.00 . A A . 8 LYS HB2 1 1 14 5991 1 1 8 LYS HB3 H -4.283 9.653 -1.068 1.00 . A A . 8 LYS HB3 1 1 14 5992 1 1 8 LYS HD2 H -1.535 11.774 0.547 1.00 . A A . 8 LYS HD2 1 1 14 5993 1 1 8 LYS HD3 H -2.875 12.375 -0.430 1.00 . A A . 8 LYS HD3 1 1 14 5994 1 1 8 LYS HE2 H -3.264 12.190 2.544 1.00 . A A . 8 LYS HE2 1 1 14 5995 1 1 8 LYS HE3 H -2.298 13.530 1.901 1.00 . A A . 8 LYS HE3 1 1 14 5996 1 1 8 LYS HG2 H -4.312 10.670 0.929 1.00 . A A . 8 LYS HG2 1 1 14 5997 1 1 8 LYS HG3 H -2.761 9.932 1.327 1.00 . A A . 8 LYS HG3 1 1 14 5998 1 1 8 LYS HZ1 H -4.936 13.638 2.022 1.00 . A A . 8 LYS HZ1 1 1 14 5999 1 1 8 LYS HZ2 H -4.794 12.889 0.506 1.00 . A A . 8 LYS HZ2 1 1 14 6000 1 1 8 LYS HZ3 H -4.066 14.398 0.784 1.00 . A A . 8 LYS HZ3 1 1 14 6001 1 1 8 LYS N N -2.131 8.216 -2.088 1.00 . A A . 8 LYS N 1 1 14 6002 1 1 8 LYS NZ N -4.306 13.478 1.210 1.00 . A A . 8 LYS NZ 1 1 14 6003 1 1 8 LYS O O -4.546 7.332 -0.323 1.00 . A A . 8 LYS O 1 1 14 6004 1 1 9 CYS C C -3.731 5.739 2.906 1.00 . A A . 9 CYS C 1 1 14 6005 1 1 9 CYS CA C -3.553 5.503 1.403 1.00 . A A . 9 CYS CA 1 1 14 6006 1 1 9 CYS CB C -2.733 4.228 1.163 1.00 . A A . 9 CYS CB 1 1 14 6007 1 1 9 CYS H H -1.806 6.706 0.958 1.00 . A A . 9 CYS H 1 1 14 6008 1 1 9 CYS HA H -4.517 5.407 0.926 1.00 . A A . 9 CYS HA 1 1 14 6009 1 1 9 CYS HB2 H -3.216 3.393 1.653 1.00 . A A . 9 CYS HB2 1 1 14 6010 1 1 9 CYS HB3 H -2.680 4.033 0.100 1.00 . A A . 9 CYS HB3 1 1 14 6011 1 1 9 CYS N N -2.770 6.606 0.768 1.00 . A A . 9 CYS N 1 1 14 6012 1 1 9 CYS O O -3.042 6.536 3.512 1.00 . A A . 9 CYS O 1 1 14 6013 1 1 9 CYS SG S -1.055 4.428 1.825 1.00 . A A . 9 CYS SG 1 1 14 6014 1 1 10 LYS C C -4.522 3.823 5.663 1.00 . A A . 10 LYS C 1 1 14 6015 1 1 10 LYS CA C -4.867 5.155 4.979 1.00 . A A . 10 LYS CA 1 1 14 6016 1 1 10 LYS CB C -6.353 5.503 5.143 1.00 . A A . 10 LYS CB 1 1 14 6017 1 1 10 LYS CD C -8.555 4.859 4.153 1.00 . A A . 10 LYS CD 1 1 14 6018 1 1 10 LYS CE C -9.111 3.871 3.124 1.00 . A A . 10 LYS CE 1 1 14 6019 1 1 10 LYS CG C -7.232 4.326 4.706 1.00 . A A . 10 LYS CG 1 1 14 6020 1 1 10 LYS H H -5.175 4.385 2.991 1.00 . A A . 10 LYS H 1 1 14 6021 1 1 10 LYS HA H -4.254 5.949 5.383 1.00 . A A . 10 LYS HA 1 1 14 6022 1 1 10 LYS HB2 H -6.553 5.730 6.180 1.00 . A A . 10 LYS HB2 1 1 14 6023 1 1 10 LYS HB3 H -6.584 6.365 4.536 1.00 . A A . 10 LYS HB3 1 1 14 6024 1 1 10 LYS HD2 H -9.260 4.988 4.963 1.00 . A A . 10 LYS HD2 1 1 14 6025 1 1 10 LYS HD3 H -8.382 5.813 3.673 1.00 . A A . 10 LYS HD3 1 1 14 6026 1 1 10 LYS HE2 H -9.643 4.405 2.351 1.00 . A A . 10 LYS HE2 1 1 14 6027 1 1 10 LYS HE3 H -8.309 3.289 2.692 1.00 . A A . 10 LYS HE3 1 1 14 6028 1 1 10 LYS HG2 H -6.723 3.757 3.940 1.00 . A A . 10 LYS HG2 1 1 14 6029 1 1 10 LYS HG3 H -7.430 3.693 5.558 1.00 . A A . 10 LYS HG3 1 1 14 6030 1 1 10 LYS HZ1 H -10.821 3.544 4.276 1.00 . A A . 10 LYS HZ1 1 1 14 6031 1 1 10 LYS HZ2 H -9.528 2.504 4.647 1.00 . A A . 10 LYS HZ2 1 1 14 6032 1 1 10 LYS HZ3 H -10.433 2.268 3.229 1.00 . A A . 10 LYS HZ3 1 1 14 6033 1 1 10 LYS N N -4.642 5.026 3.510 1.00 . A A . 10 LYS N 1 1 14 6034 1 1 10 LYS NZ N -10.043 2.981 3.877 1.00 . A A . 10 LYS NZ 1 1 14 6035 1 1 10 LYS O O -4.167 3.785 6.821 1.00 . A A . 10 LYS O 1 1 14 6036 1 1 11 ASN C C -3.287 0.685 4.584 1.00 . A A . 11 ASN C 1 1 14 6037 1 1 11 ASN CA C -4.282 1.393 5.516 1.00 . A A . 11 ASN CA 1 1 14 6038 1 1 11 ASN CB C -5.622 0.645 5.564 1.00 . A A . 11 ASN CB 1 1 14 6039 1 1 11 ASN CG C -5.397 -0.822 5.938 1.00 . A A . 11 ASN CG 1 1 14 6040 1 1 11 ASN H H -4.887 2.787 4.006 1.00 . A A . 11 ASN H 1 1 14 6041 1 1 11 ASN HA H -3.870 1.498 6.510 1.00 . A A . 11 ASN HA 1 1 14 6042 1 1 11 ASN HB2 H -6.263 1.101 6.302 1.00 . A A . 11 ASN HB2 1 1 14 6043 1 1 11 ASN HB3 H -6.096 0.701 4.595 1.00 . A A . 11 ASN HB3 1 1 14 6044 1 1 11 ASN HD21 H -6.753 -1.507 4.663 1.00 . A A . 11 ASN HD21 1 1 14 6045 1 1 11 ASN HD22 H -5.956 -2.689 5.580 1.00 . A A . 11 ASN HD22 1 1 14 6046 1 1 11 ASN N N -4.611 2.730 4.940 1.00 . A A . 11 ASN N 1 1 14 6047 1 1 11 ASN ND2 N -6.092 -1.748 5.345 1.00 . A A . 11 ASN ND2 1 1 14 6048 1 1 11 ASN O O -3.074 1.106 3.465 1.00 . A A . 11 ASN O 1 1 14 6049 1 1 11 ASN OD1 O -4.564 -1.130 6.769 1.00 . A A . 11 ASN OD1 1 1 14 6050 1 1 12 LYS C C -2.414 -2.033 3.172 1.00 . A A . 12 LYS C 1 1 14 6051 1 1 12 LYS CA C -1.694 -1.086 4.144 1.00 . A A . 12 LYS CA 1 1 14 6052 1 1 12 LYS CB C -0.768 -1.848 5.120 1.00 . A A . 12 LYS CB 1 1 14 6053 1 1 12 LYS CD C 0.617 -3.902 5.491 1.00 . A A . 12 LYS CD 1 1 14 6054 1 1 12 LYS CE C 1.787 -4.416 4.635 1.00 . A A . 12 LYS CE 1 1 14 6055 1 1 12 LYS CG C -0.442 -3.249 4.592 1.00 . A A . 12 LYS CG 1 1 14 6056 1 1 12 LYS H H -2.850 -0.701 5.933 1.00 . A A . 12 LYS H 1 1 14 6057 1 1 12 LYS HA H -1.123 -0.366 3.581 1.00 . A A . 12 LYS HA 1 1 14 6058 1 1 12 LYS HB2 H 0.147 -1.292 5.236 1.00 . A A . 12 LYS HB2 1 1 14 6059 1 1 12 LYS HB3 H -1.255 -1.936 6.080 1.00 . A A . 12 LYS HB3 1 1 14 6060 1 1 12 LYS HD2 H 0.981 -3.177 6.205 1.00 . A A . 12 LYS HD2 1 1 14 6061 1 1 12 LYS HD3 H 0.171 -4.733 6.020 1.00 . A A . 12 LYS HD3 1 1 14 6062 1 1 12 LYS HE2 H 1.600 -5.435 4.318 1.00 . A A . 12 LYS HE2 1 1 14 6063 1 1 12 LYS HE3 H 1.935 -3.779 3.779 1.00 . A A . 12 LYS HE3 1 1 14 6064 1 1 12 LYS HG2 H -1.337 -3.852 4.597 1.00 . A A . 12 LYS HG2 1 1 14 6065 1 1 12 LYS HG3 H -0.063 -3.177 3.583 1.00 . A A . 12 LYS HG3 1 1 14 6066 1 1 12 LYS HZ1 H 3.850 -4.563 4.950 1.00 . A A . 12 LYS HZ1 1 1 14 6067 1 1 12 LYS HZ2 H 2.902 -5.079 6.274 1.00 . A A . 12 LYS HZ2 1 1 14 6068 1 1 12 LYS HZ3 H 3.075 -3.421 5.944 1.00 . A A . 12 LYS HZ3 1 1 14 6069 1 1 12 LYS N N -2.673 -0.375 5.023 1.00 . A A . 12 LYS N 1 1 14 6070 1 1 12 LYS NZ N 2.987 -4.364 5.521 1.00 . A A . 12 LYS NZ 1 1 14 6071 1 1 12 LYS O O -1.997 -2.204 2.045 1.00 . A A . 12 LYS O 1 1 14 6072 1 1 13 LYS C C -5.178 -2.843 1.730 1.00 . A A . 13 LYS C 1 1 14 6073 1 1 13 LYS CA C -4.216 -3.588 2.682 1.00 . A A . 13 LYS CA 1 1 14 6074 1 1 13 LYS CB C -4.996 -4.521 3.611 1.00 . A A . 13 LYS CB 1 1 14 6075 1 1 13 LYS CD C -6.384 -6.285 2.488 1.00 . A A . 13 LYS CD 1 1 14 6076 1 1 13 LYS CE C -7.133 -7.191 3.478 1.00 . A A . 13 LYS CE 1 1 14 6077 1 1 13 LYS CG C -4.993 -5.944 3.038 1.00 . A A . 13 LYS CG 1 1 14 6078 1 1 13 LYS H H -3.806 -2.500 4.507 1.00 . A A . 13 LYS H 1 1 14 6079 1 1 13 LYS HA H -3.508 -4.167 2.108 1.00 . A A . 13 LYS HA 1 1 14 6080 1 1 13 LYS HB2 H -4.534 -4.525 4.588 1.00 . A A . 13 LYS HB2 1 1 14 6081 1 1 13 LYS HB3 H -6.015 -4.170 3.696 1.00 . A A . 13 LYS HB3 1 1 14 6082 1 1 13 LYS HD2 H -6.945 -5.372 2.340 1.00 . A A . 13 LYS HD2 1 1 14 6083 1 1 13 LYS HD3 H -6.278 -6.799 1.543 1.00 . A A . 13 LYS HD3 1 1 14 6084 1 1 13 LYS HE2 H -6.441 -7.866 3.968 1.00 . A A . 13 LYS HE2 1 1 14 6085 1 1 13 LYS HE3 H -7.658 -6.593 4.210 1.00 . A A . 13 LYS HE3 1 1 14 6086 1 1 13 LYS HG2 H -4.265 -6.010 2.240 1.00 . A A . 13 LYS HG2 1 1 14 6087 1 1 13 LYS HG3 H -4.736 -6.642 3.819 1.00 . A A . 13 LYS HG3 1 1 14 6088 1 1 13 LYS HZ1 H -8.879 -7.328 2.345 1.00 . A A . 13 LYS HZ1 1 1 14 6089 1 1 13 LYS HZ2 H -8.513 -8.734 3.219 1.00 . A A . 13 LYS HZ2 1 1 14 6090 1 1 13 LYS HZ3 H -7.635 -8.353 1.816 1.00 . A A . 13 LYS HZ3 1 1 14 6091 1 1 13 LYS N N -3.486 -2.648 3.593 1.00 . A A . 13 LYS N 1 1 14 6092 1 1 13 LYS NZ N -8.113 -7.960 2.652 1.00 . A A . 13 LYS NZ 1 1 14 6093 1 1 13 LYS O O -6.007 -3.456 1.090 1.00 . A A . 13 LYS O 1 1 14 6094 1 1 14 GLU C C -5.328 -0.648 -0.702 1.00 . A A . 14 GLU C 1 1 14 6095 1 1 14 GLU CA C -5.992 -0.806 0.672 1.00 . A A . 14 GLU CA 1 1 14 6096 1 1 14 GLU CB C -6.265 0.561 1.319 1.00 . A A . 14 GLU CB 1 1 14 6097 1 1 14 GLU CD C -5.440 2.871 0.814 1.00 . A A . 14 GLU CD 1 1 14 6098 1 1 14 GLU CG C -5.023 1.466 1.252 1.00 . A A . 14 GLU CG 1 1 14 6099 1 1 14 GLU H H -4.404 -1.047 2.119 1.00 . A A . 14 GLU H 1 1 14 6100 1 1 14 GLU HA H -6.921 -1.346 0.565 1.00 . A A . 14 GLU HA 1 1 14 6101 1 1 14 GLU HB2 H -7.082 1.042 0.798 1.00 . A A . 14 GLU HB2 1 1 14 6102 1 1 14 GLU HB3 H -6.542 0.413 2.350 1.00 . A A . 14 GLU HB3 1 1 14 6103 1 1 14 GLU HG2 H -4.570 1.519 2.230 1.00 . A A . 14 GLU HG2 1 1 14 6104 1 1 14 GLU HG3 H -4.310 1.070 0.545 1.00 . A A . 14 GLU HG3 1 1 14 6105 1 1 14 GLU N N -5.077 -1.538 1.611 1.00 . A A . 14 GLU N 1 1 14 6106 1 1 14 GLU O O -5.986 -0.400 -1.698 1.00 . A A . 14 GLU O 1 1 14 6107 1 1 14 GLU OE1 O -6.035 3.572 1.617 1.00 . A A . 14 GLU OE1 1 1 14 6108 1 1 14 GLU OE2 O -5.137 3.243 -0.306 1.00 . A A . 14 GLU OE2 1 1 14 6109 1 1 15 CYS C C -3.722 -1.897 -2.959 1.00 . A A . 15 CYS C 1 1 14 6110 1 1 15 CYS CA C -3.351 -0.677 -2.106 1.00 . A A . 15 CYS CA 1 1 14 6111 1 1 15 CYS CB C -1.837 -0.656 -1.833 1.00 . A A . 15 CYS CB 1 1 14 6112 1 1 15 CYS H H -3.510 -1.014 0.031 1.00 . A A . 15 CYS H 1 1 14 6113 1 1 15 CYS HA H -3.653 0.235 -2.597 1.00 . A A . 15 CYS HA 1 1 14 6114 1 1 15 CYS HB2 H -1.463 -1.668 -1.844 1.00 . A A . 15 CYS HB2 1 1 14 6115 1 1 15 CYS HB3 H -1.343 -0.087 -2.610 1.00 . A A . 15 CYS HB3 1 1 14 6116 1 1 15 CYS N N -4.030 -0.802 -0.778 1.00 . A A . 15 CYS N 1 1 14 6117 1 1 15 CYS O O -3.948 -2.969 -2.431 1.00 . A A . 15 CYS O 1 1 14 6118 1 1 15 CYS SG S -1.479 0.096 -0.214 1.00 . A A . 15 CYS SG 1 1 14 6119 1 1 16 CYS C C -3.070 -4.017 -4.963 1.00 . A A . 16 CYS C 1 1 14 6120 1 1 16 CYS CA C -4.144 -2.940 -5.118 1.00 . A A . 16 CYS CA 1 1 14 6121 1 1 16 CYS CB C -4.216 -2.425 -6.564 1.00 . A A . 16 CYS CB 1 1 14 6122 1 1 16 CYS H H -3.603 -0.882 -4.678 1.00 . A A . 16 CYS H 1 1 14 6123 1 1 16 CYS HA H -5.097 -3.343 -4.821 1.00 . A A . 16 CYS HA 1 1 14 6124 1 1 16 CYS HB2 H -4.108 -1.352 -6.578 1.00 . A A . 16 CYS HB2 1 1 14 6125 1 1 16 CYS HB3 H -3.421 -2.873 -7.143 1.00 . A A . 16 CYS HB3 1 1 14 6126 1 1 16 CYS N N -3.789 -1.757 -4.264 1.00 . A A . 16 CYS N 1 1 14 6127 1 1 16 CYS O O -3.333 -5.088 -4.457 1.00 . A A . 16 CYS O 1 1 14 6128 1 1 16 CYS SG S -5.814 -2.886 -7.286 1.00 . A A . 16 CYS SG 1 1 14 6129 1 1 17 GLY C C -0.361 -4.689 -3.716 1.00 . A A . 17 GLY C 1 1 14 6130 1 1 17 GLY CA C -0.776 -4.742 -5.178 1.00 . A A . 17 GLY CA 1 1 14 6131 1 1 17 GLY H H -1.646 -2.858 -5.735 1.00 . A A . 17 GLY H 1 1 14 6132 1 1 17 GLY HA2 H -1.146 -5.728 -5.420 1.00 . A A . 17 GLY HA2 1 1 14 6133 1 1 17 GLY HA3 H 0.071 -4.500 -5.801 1.00 . A A . 17 GLY HA3 1 1 14 6134 1 1 17 GLY N N -1.855 -3.736 -5.356 1.00 . A A . 17 GLY N 1 1 14 6135 1 1 17 GLY O O 0.249 -3.732 -3.291 1.00 . A A . 17 GLY O 1 1 14 6136 1 1 18 TRP C C 0.786 -4.863 -1.132 1.00 . A A . 18 TRP C 1 1 14 6137 1 1 18 TRP CA C -0.431 -5.728 -1.471 1.00 . A A . 18 TRP CA 1 1 14 6138 1 1 18 TRP CB C -0.154 -7.202 -1.136 1.00 . A A . 18 TRP CB 1 1 14 6139 1 1 18 TRP CD1 C -1.128 -6.781 1.181 1.00 . A A . 18 TRP CD1 1 1 14 6140 1 1 18 TRP CD2 C -1.504 -8.875 0.443 1.00 . A A . 18 TRP CD2 1 1 14 6141 1 1 18 TRP CE2 C -2.091 -8.785 1.729 1.00 . A A . 18 TRP CE2 1 1 14 6142 1 1 18 TRP CE3 C -1.603 -10.099 -0.245 1.00 . A A . 18 TRP CE3 1 1 14 6143 1 1 18 TRP CG C -0.896 -7.592 0.115 1.00 . A A . 18 TRP CG 1 1 14 6144 1 1 18 TRP CH2 C -2.841 -11.079 1.608 1.00 . A A . 18 TRP CH2 1 1 14 6145 1 1 18 TRP CZ2 C -2.750 -9.873 2.308 1.00 . A A . 18 TRP CZ2 1 1 14 6146 1 1 18 TRP CZ3 C -2.268 -11.193 0.334 1.00 . A A . 18 TRP CZ3 1 1 14 6147 1 1 18 TRP H H -1.272 -6.414 -3.345 1.00 . A A . 18 TRP H 1 1 14 6148 1 1 18 TRP HA H -1.288 -5.387 -0.913 1.00 . A A . 18 TRP HA 1 1 14 6149 1 1 18 TRP HB2 H -0.480 -7.826 -1.956 1.00 . A A . 18 TRP HB2 1 1 14 6150 1 1 18 TRP HB3 H 0.909 -7.344 -0.984 1.00 . A A . 18 TRP HB3 1 1 14 6151 1 1 18 TRP HD1 H -0.815 -5.750 1.269 1.00 . A A . 18 TRP HD1 1 1 14 6152 1 1 18 TRP HE1 H -2.117 -7.146 3.004 1.00 . A A . 18 TRP HE1 1 1 14 6153 1 1 18 TRP HE3 H -1.162 -10.199 -1.229 1.00 . A A . 18 TRP HE3 1 1 14 6154 1 1 18 TRP HH2 H -3.352 -11.924 2.049 1.00 . A A . 18 TRP HH2 1 1 14 6155 1 1 18 TRP HZ2 H -3.191 -9.781 3.289 1.00 . A A . 18 TRP HZ2 1 1 14 6156 1 1 18 TRP HZ3 H -2.338 -12.127 -0.206 1.00 . A A . 18 TRP HZ3 1 1 14 6157 1 1 18 TRP N N -0.742 -5.689 -2.948 1.00 . A A . 18 TRP N 1 1 14 6158 1 1 18 TRP NE1 N -1.831 -7.495 2.138 1.00 . A A . 18 TRP NE1 1 1 14 6159 1 1 18 TRP O O 1.920 -5.287 -1.233 1.00 . A A . 18 TRP O 1 1 14 6160 1 1 19 ASN C C 1.581 -2.359 1.082 1.00 . A A . 19 ASN C 1 1 14 6161 1 1 19 ASN CA C 1.656 -2.717 -0.407 1.00 . A A . 19 ASN CA 1 1 14 6162 1 1 19 ASN CB C 1.392 -1.471 -1.266 1.00 . A A . 19 ASN CB 1 1 14 6163 1 1 19 ASN CG C 2.560 -1.199 -2.220 1.00 . A A . 19 ASN CG 1 1 14 6164 1 1 19 ASN H H -0.381 -3.337 -0.687 1.00 . A A . 19 ASN H 1 1 14 6165 1 1 19 ASN HA H 2.605 -3.155 -0.654 1.00 . A A . 19 ASN HA 1 1 14 6166 1 1 19 ASN HB2 H 0.496 -1.630 -1.846 1.00 . A A . 19 ASN HB2 1 1 14 6167 1 1 19 ASN HB3 H 1.251 -0.617 -0.622 1.00 . A A . 19 ASN HB3 1 1 14 6168 1 1 19 ASN HD21 H 3.916 -1.009 -0.790 1.00 . A A . 19 ASN HD21 1 1 14 6169 1 1 19 ASN HD22 H 4.495 -0.797 -2.369 1.00 . A A . 19 ASN HD22 1 1 14 6170 1 1 19 ASN N N 0.543 -3.646 -0.746 1.00 . A A . 19 ASN N 1 1 14 6171 1 1 19 ASN ND2 N 3.755 -0.989 -1.751 1.00 . A A . 19 ASN ND2 1 1 14 6172 1 1 19 ASN O O 0.974 -3.061 1.864 1.00 . A A . 19 ASN O 1 1 14 6173 1 1 19 ASN OD1 O 2.370 -1.153 -3.415 1.00 . A A . 19 ASN OD1 1 1 14 6174 1 1 20 ALA C C 1.975 0.675 2.978 1.00 . A A . 20 ALA C 1 1 14 6175 1 1 20 ALA CA C 2.119 -0.840 2.899 1.00 . A A . 20 ALA CA 1 1 14 6176 1 1 20 ALA CB C 3.448 -1.270 3.512 1.00 . A A . 20 ALA CB 1 1 14 6177 1 1 20 ALA H H 2.648 -0.711 0.823 1.00 . A A . 20 ALA H 1 1 14 6178 1 1 20 ALA HA H 1.300 -1.324 3.408 1.00 . A A . 20 ALA HA 1 1 14 6179 1 1 20 ALA HB1 H 3.463 -2.342 3.634 1.00 . A A . 20 ALA HB1 1 1 14 6180 1 1 20 ALA HB2 H 3.571 -0.797 4.476 1.00 . A A . 20 ALA HB2 1 1 14 6181 1 1 20 ALA HB3 H 4.254 -0.971 2.860 1.00 . A A . 20 ALA HB3 1 1 14 6182 1 1 20 ALA N N 2.175 -1.264 1.472 1.00 . A A . 20 ALA N 1 1 14 6183 1 1 20 ALA O O 2.749 1.415 2.387 1.00 . A A . 20 ALA O 1 1 14 6184 1 1 21 CYS C C 1.800 3.119 4.895 1.00 . A A . 21 CYS C 1 1 14 6185 1 1 21 CYS CA C 0.805 2.605 3.858 1.00 . A A . 21 CYS CA 1 1 14 6186 1 1 21 CYS CB C -0.645 2.764 4.328 1.00 . A A . 21 CYS CB 1 1 14 6187 1 1 21 CYS H H 0.417 0.519 4.186 1.00 . A A . 21 CYS H 1 1 14 6188 1 1 21 CYS HA H 0.949 3.101 2.915 1.00 . A A . 21 CYS HA 1 1 14 6189 1 1 21 CYS HB2 H -1.251 1.999 3.872 1.00 . A A . 21 CYS HB2 1 1 14 6190 1 1 21 CYS HB3 H -0.695 2.663 5.403 1.00 . A A . 21 CYS HB3 1 1 14 6191 1 1 21 CYS N N 1.004 1.138 3.711 1.00 . A A . 21 CYS N 1 1 14 6192 1 1 21 CYS O O 1.498 3.198 6.069 1.00 . A A . 21 CYS O 1 1 14 6193 1 1 21 CYS SG S -1.273 4.390 3.835 1.00 . A A . 21 CYS SG 1 1 14 6194 1 1 22 ALA C C 4.296 5.406 5.289 1.00 . A A . 22 ALA C 1 1 14 6195 1 1 22 ALA CA C 4.037 3.901 5.427 1.00 . A A . 22 ALA CA 1 1 14 6196 1 1 22 ALA CB C 5.290 3.104 5.062 1.00 . A A . 22 ALA CB 1 1 14 6197 1 1 22 ALA H H 3.218 3.329 3.514 1.00 . A A . 22 ALA H 1 1 14 6198 1 1 22 ALA HA H 3.741 3.667 6.434 1.00 . A A . 22 ALA HA 1 1 14 6199 1 1 22 ALA HB1 H 6.153 3.560 5.525 1.00 . A A . 22 ALA HB1 1 1 14 6200 1 1 22 ALA HB2 H 5.416 3.096 3.986 1.00 . A A . 22 ALA HB2 1 1 14 6201 1 1 22 ALA HB3 H 5.187 2.091 5.421 1.00 . A A . 22 ALA HB3 1 1 14 6202 1 1 22 ALA N N 2.997 3.432 4.468 1.00 . A A . 22 ALA N 1 1 14 6203 1 1 22 ALA O O 3.892 6.189 6.127 1.00 . A A . 22 ALA O 1 1 14 6204 1 1 23 LEU C C 4.053 8.034 3.568 1.00 . A A . 23 LEU C 1 1 14 6205 1 1 23 LEU CA C 5.293 7.272 4.060 1.00 . A A . 23 LEU CA 1 1 14 6206 1 1 23 LEU CB C 6.403 7.300 2.991 1.00 . A A . 23 LEU CB 1 1 14 6207 1 1 23 LEU CD1 C 7.686 6.177 4.883 1.00 . A A . 23 LEU CD1 1 1 14 6208 1 1 23 LEU CD2 C 8.656 6.274 2.594 1.00 . A A . 23 LEU CD2 1 1 14 6209 1 1 23 LEU CG C 7.792 7.024 3.610 1.00 . A A . 23 LEU CG 1 1 14 6210 1 1 23 LEU H H 5.303 5.163 3.598 1.00 . A A . 23 LEU H 1 1 14 6211 1 1 23 LEU HA H 5.656 7.703 4.980 1.00 . A A . 23 LEU HA 1 1 14 6212 1 1 23 LEU HB2 H 6.190 6.555 2.239 1.00 . A A . 23 LEU HB2 1 1 14 6213 1 1 23 LEU HB3 H 6.412 8.276 2.524 1.00 . A A . 23 LEU HB3 1 1 14 6214 1 1 23 LEU HD11 H 8.674 6.010 5.284 1.00 . A A . 23 LEU HD11 1 1 14 6215 1 1 23 LEU HD12 H 7.228 5.227 4.650 1.00 . A A . 23 LEU HD12 1 1 14 6216 1 1 23 LEU HD13 H 7.085 6.696 5.614 1.00 . A A . 23 LEU HD13 1 1 14 6217 1 1 23 LEU HD21 H 8.315 6.497 1.593 1.00 . A A . 23 LEU HD21 1 1 14 6218 1 1 23 LEU HD22 H 8.584 5.208 2.771 1.00 . A A . 23 LEU HD22 1 1 14 6219 1 1 23 LEU HD23 H 9.684 6.587 2.699 1.00 . A A . 23 LEU HD23 1 1 14 6220 1 1 23 LEU HG H 8.264 7.964 3.849 1.00 . A A . 23 LEU HG 1 1 14 6221 1 1 23 LEU N N 4.980 5.815 4.249 1.00 . A A . 23 LEU N 1 1 14 6222 1 1 23 LEU O O 4.106 8.763 2.598 1.00 . A A . 23 LEU O 1 1 14 6223 1 1 24 GLY C C 1.171 7.952 2.480 1.00 . A A . 24 GLY C 1 1 14 6224 1 1 24 GLY CA C 1.686 8.560 3.799 1.00 . A A . 24 GLY CA 1 1 14 6225 1 1 24 GLY H H 2.917 7.267 5.008 1.00 . A A . 24 GLY H 1 1 14 6226 1 1 24 GLY HA2 H 0.933 8.443 4.566 1.00 . A A . 24 GLY HA2 1 1 14 6227 1 1 24 GLY HA3 H 1.888 9.611 3.654 1.00 . A A . 24 GLY HA3 1 1 14 6228 1 1 24 GLY N N 2.936 7.863 4.228 1.00 . A A . 24 GLY N 1 1 14 6229 1 1 24 GLY O O 0.249 8.470 1.876 1.00 . A A . 24 GLY O 1 1 14 6230 1 1 25 ILE C C 1.654 4.723 0.772 1.00 . A A . 25 ILE C 1 1 14 6231 1 1 25 ILE CA C 1.308 6.218 0.753 1.00 . A A . 25 ILE CA 1 1 14 6232 1 1 25 ILE CB C 2.071 6.900 -0.397 1.00 . A A . 25 ILE CB 1 1 14 6233 1 1 25 ILE CD1 C 3.679 8.689 -1.073 1.00 . A A . 25 ILE CD1 1 1 14 6234 1 1 25 ILE CG1 C 2.996 8.010 0.110 1.00 . A A . 25 ILE CG1 1 1 14 6235 1 1 25 ILE CG2 C 1.075 7.502 -1.375 1.00 . A A . 25 ILE CG2 1 1 14 6236 1 1 25 ILE H H 2.494 6.458 2.537 1.00 . A A . 25 ILE H 1 1 14 6237 1 1 25 ILE HA H 0.248 6.357 0.620 1.00 . A A . 25 ILE HA 1 1 14 6238 1 1 25 ILE HB H 2.653 6.151 -0.909 1.00 . A A . 25 ILE HB 1 1 14 6239 1 1 25 ILE HD11 H 3.492 9.750 -1.028 1.00 . A A . 25 ILE HD11 1 1 14 6240 1 1 25 ILE HD12 H 3.281 8.291 -1.994 1.00 . A A . 25 ILE HD12 1 1 14 6241 1 1 25 ILE HD13 H 4.742 8.509 -1.030 1.00 . A A . 25 ILE HD13 1 1 14 6242 1 1 25 ILE HG12 H 2.413 8.739 0.651 1.00 . A A . 25 ILE HG12 1 1 14 6243 1 1 25 ILE HG13 H 3.743 7.586 0.762 1.00 . A A . 25 ILE HG13 1 1 14 6244 1 1 25 ILE HG21 H 0.467 6.716 -1.795 1.00 . A A . 25 ILE HG21 1 1 14 6245 1 1 25 ILE HG22 H 1.612 8.001 -2.169 1.00 . A A . 25 ILE HG22 1 1 14 6246 1 1 25 ILE HG23 H 0.449 8.214 -0.860 1.00 . A A . 25 ILE HG23 1 1 14 6247 1 1 25 ILE N N 1.758 6.861 2.030 1.00 . A A . 25 ILE N 1 1 14 6248 1 1 25 ILE O O 2.233 4.226 1.721 1.00 . A A . 25 ILE O 1 1 14 6249 1 1 26 CYS C C 3.106 2.386 -0.836 1.00 . A A . 26 CYS C 1 1 14 6250 1 1 26 CYS CA C 1.676 2.549 -0.322 1.00 . A A . 26 CYS CA 1 1 14 6251 1 1 26 CYS CB C 0.679 1.928 -1.309 1.00 . A A . 26 CYS CB 1 1 14 6252 1 1 26 CYS H H 0.893 4.442 -1.056 1.00 . A A . 26 CYS H 1 1 14 6253 1 1 26 CYS HA H 1.566 2.101 0.651 1.00 . A A . 26 CYS HA 1 1 14 6254 1 1 26 CYS HB2 H 0.710 2.469 -2.242 1.00 . A A . 26 CYS HB2 1 1 14 6255 1 1 26 CYS HB3 H 0.939 0.896 -1.489 1.00 . A A . 26 CYS HB3 1 1 14 6256 1 1 26 CYS N N 1.336 4.009 -0.279 1.00 . A A . 26 CYS N 1 1 14 6257 1 1 26 CYS O O 3.369 2.622 -1.993 1.00 . A A . 26 CYS O 1 1 14 6258 1 1 26 CYS SG S -0.994 2.016 -0.619 1.00 . A A . 26 CYS SG 1 1 14 6259 1 1 27 MET C C 6.189 0.667 0.076 1.00 . A A . 27 MET C 1 1 14 6260 1 1 27 MET CA C 5.442 1.876 -0.532 1.00 . A A . 27 MET CA 1 1 14 6261 1 1 27 MET CB C 6.124 3.208 -0.201 1.00 . A A . 27 MET CB 1 1 14 6262 1 1 27 MET CE C 7.537 2.696 -3.033 1.00 . A A . 27 MET CE 1 1 14 6263 1 1 27 MET CG C 5.962 4.174 -1.375 1.00 . A A . 27 MET CG 1 1 14 6264 1 1 27 MET H H 3.844 1.825 0.937 1.00 . A A . 27 MET H 1 1 14 6265 1 1 27 MET HA H 5.408 1.761 -1.600 1.00 . A A . 27 MET HA 1 1 14 6266 1 1 27 MET HB2 H 5.673 3.637 0.682 1.00 . A A . 27 MET HB2 1 1 14 6267 1 1 27 MET HB3 H 7.174 3.037 -0.022 1.00 . A A . 27 MET HB3 1 1 14 6268 1 1 27 MET HE1 H 8.367 2.628 -3.722 1.00 . A A . 27 MET HE1 1 1 14 6269 1 1 27 MET HE2 H 6.614 2.553 -3.571 1.00 . A A . 27 MET HE2 1 1 14 6270 1 1 27 MET HE3 H 7.630 1.935 -2.270 1.00 . A A . 27 MET HE3 1 1 14 6271 1 1 27 MET HG2 H 5.206 3.803 -2.052 1.00 . A A . 27 MET HG2 1 1 14 6272 1 1 27 MET HG3 H 5.663 5.142 -1.003 1.00 . A A . 27 MET HG3 1 1 14 6273 1 1 27 MET N N 4.048 2.006 -0.009 1.00 . A A . 27 MET N 1 1 14 6274 1 1 27 MET O O 6.248 -0.368 -0.552 1.00 . A A . 27 MET O 1 1 14 6275 1 1 27 MET SD S 7.538 4.328 -2.253 1.00 . A A . 27 MET SD 1 1 14 6276 1 1 28 PRO C C 6.564 -1.399 2.368 1.00 . A A . 28 PRO C 1 1 14 6277 1 1 28 PRO CA C 7.513 -0.297 1.889 1.00 . A A . 28 PRO CA 1 1 14 6278 1 1 28 PRO CB C 8.207 0.357 3.071 1.00 . A A . 28 PRO CB 1 1 14 6279 1 1 28 PRO CD C 6.736 2.017 2.116 1.00 . A A . 28 PRO CD 1 1 14 6280 1 1 28 PRO CG C 7.366 1.549 3.399 1.00 . A A . 28 PRO CG 1 1 14 6281 1 1 28 PRO HA H 8.247 -0.697 1.201 1.00 . A A . 28 PRO HA 1 1 14 6282 1 1 28 PRO HB2 H 8.231 -0.331 3.906 1.00 . A A . 28 PRO HB2 1 1 14 6283 1 1 28 PRO HB3 H 9.203 0.664 2.802 1.00 . A A . 28 PRO HB3 1 1 14 6284 1 1 28 PRO HD2 H 5.719 2.345 2.293 1.00 . A A . 28 PRO HD2 1 1 14 6285 1 1 28 PRO HD3 H 7.317 2.807 1.663 1.00 . A A . 28 PRO HD3 1 1 14 6286 1 1 28 PRO HG2 H 6.600 1.266 4.107 1.00 . A A . 28 PRO HG2 1 1 14 6287 1 1 28 PRO HG3 H 7.983 2.326 3.808 1.00 . A A . 28 PRO HG3 1 1 14 6288 1 1 28 PRO N N 6.752 0.823 1.260 1.00 . A A . 28 PRO N 1 1 14 6289 1 1 28 PRO O O 6.169 -1.432 3.520 1.00 . A A . 28 PRO O 1 1 14 6290 1 1 29 ARG C C 5.766 -4.185 3.070 1.00 . A A . 29 ARG C 1 1 14 6291 1 1 29 ARG CA C 5.257 -3.400 1.852 1.00 . A A . 29 ARG CA 1 1 14 6292 1 1 29 ARG CB C 5.164 -4.298 0.603 1.00 . A A . 29 ARG CB 1 1 14 6293 1 1 29 ARG CD C 6.337 -6.467 0.977 1.00 . A A . 29 ARG CD 1 1 14 6294 1 1 29 ARG CG C 6.476 -5.056 0.395 1.00 . A A . 29 ARG CG 1 1 14 6295 1 1 29 ARG CZ C 5.467 -8.570 0.057 1.00 . A A . 29 ARG CZ 1 1 14 6296 1 1 29 ARG H H 6.537 -2.217 0.570 1.00 . A A . 29 ARG H 1 1 14 6297 1 1 29 ARG HA H 4.285 -2.994 2.072 1.00 . A A . 29 ARG HA 1 1 14 6298 1 1 29 ARG HB2 H 4.362 -5.006 0.739 1.00 . A A . 29 ARG HB2 1 1 14 6299 1 1 29 ARG HB3 H 4.958 -3.686 -0.269 1.00 . A A . 29 ARG HB3 1 1 14 6300 1 1 29 ARG HD2 H 7.313 -6.863 1.231 1.00 . A A . 29 ARG HD2 1 1 14 6301 1 1 29 ARG HD3 H 5.701 -6.450 1.854 1.00 . A A . 29 ARG HD3 1 1 14 6302 1 1 29 ARG HE H 5.468 -6.870 -0.965 1.00 . A A . 29 ARG HE 1 1 14 6303 1 1 29 ARG HG2 H 6.696 -5.115 -0.662 1.00 . A A . 29 ARG HG2 1 1 14 6304 1 1 29 ARG HG3 H 7.275 -4.532 0.900 1.00 . A A . 29 ARG HG3 1 1 14 6305 1 1 29 ARG HH11 H 6.104 -8.622 1.960 1.00 . A A . 29 ARG HH11 1 1 14 6306 1 1 29 ARG HH12 H 5.558 -10.128 1.311 1.00 . A A . 29 ARG HH12 1 1 14 6307 1 1 29 ARG HH21 H 4.724 -8.832 -1.790 1.00 . A A . 29 ARG HH21 1 1 14 6308 1 1 29 ARG HH22 H 4.783 -10.248 -0.800 1.00 . A A . 29 ARG HH22 1 1 14 6309 1 1 29 ARG N N 6.197 -2.288 1.484 1.00 . A A . 29 ARG N 1 1 14 6310 1 1 29 ARG NE N 5.699 -7.288 -0.111 1.00 . A A . 29 ARG NE 1 1 14 6311 1 1 29 ARG NH1 N 5.725 -9.148 1.199 1.00 . A A . 29 ARG NH1 1 1 14 6312 1 1 29 ARG NH2 N 4.947 -9.268 -0.916 1.00 . A A . 29 ARG NH2 1 1 14 6313 1 1 29 ARG O O 6.968 -4.323 3.218 1.00 . A A . 29 ARG O 1 1 14 6314 1 1 29 ARG OXT O 4.934 -4.627 3.840 1.00 . A A . 29 ARG OXT 1 1 15 6315 1 1 1 GLY C C -10.259 0.113 -3.991 1.00 . A A . 1 GLY C 1 1 15 6316 1 1 1 GLY CA C -11.645 0.427 -4.572 1.00 . A A . 1 GLY CA 1 1 15 6317 1 1 1 GLY H1 H -13.251 -0.840 -4.189 1.00 . A A . 1 GLY H1 1 1 15 6318 1 1 1 GLY H2 H -11.796 -1.653 -4.517 1.00 . A A . 1 GLY H2 1 1 15 6319 1 1 1 GLY H3 H -12.668 -0.920 -5.777 1.00 . A A . 1 GLY H3 1 1 15 6320 1 1 1 GLY HA2 H -11.535 0.937 -5.519 1.00 . A A . 1 GLY HA2 1 1 15 6321 1 1 1 GLY HA3 H -12.187 1.060 -3.884 1.00 . A A . 1 GLY HA3 1 1 15 6322 1 1 1 GLY N N -12.397 -0.842 -4.779 1.00 . A A . 1 GLY N 1 1 15 6323 1 1 1 GLY O O -10.140 -0.527 -2.965 1.00 . A A . 1 GLY O 1 1 15 6324 1 1 2 CYS C C -6.809 1.090 -4.944 1.00 . A A . 2 CYS C 1 1 15 6325 1 1 2 CYS CA C -7.826 0.270 -4.139 1.00 . A A . 2 CYS CA 1 1 15 6326 1 1 2 CYS CB C -7.610 -1.232 -4.364 1.00 . A A . 2 CYS CB 1 1 15 6327 1 1 2 CYS H H -9.333 1.055 -5.478 1.00 . A A . 2 CYS H 1 1 15 6328 1 1 2 CYS HA H -7.755 0.503 -3.088 1.00 . A A . 2 CYS HA 1 1 15 6329 1 1 2 CYS HB2 H -6.605 -1.499 -4.073 1.00 . A A . 2 CYS HB2 1 1 15 6330 1 1 2 CYS HB3 H -8.317 -1.795 -3.769 1.00 . A A . 2 CYS HB3 1 1 15 6331 1 1 2 CYS N N -9.212 0.548 -4.645 1.00 . A A . 2 CYS N 1 1 15 6332 1 1 2 CYS O O -7.092 1.510 -6.048 1.00 . A A . 2 CYS O 1 1 15 6333 1 1 2 CYS SG S -7.857 -1.620 -6.116 1.00 . A A . 2 CYS SG 1 1 15 6334 1 1 3 LYS C C -3.335 1.333 -5.388 1.00 . A A . 3 LYS C 1 1 15 6335 1 1 3 LYS CA C -4.626 2.135 -5.161 1.00 . A A . 3 LYS CA 1 1 15 6336 1 1 3 LYS CB C -4.332 3.365 -4.293 1.00 . A A . 3 LYS CB 1 1 15 6337 1 1 3 LYS CD C -5.582 4.340 -2.363 1.00 . A A . 3 LYS CD 1 1 15 6338 1 1 3 LYS CE C -6.820 5.140 -1.936 1.00 . A A . 3 LYS CE 1 1 15 6339 1 1 3 LYS CG C -5.637 4.048 -3.863 1.00 . A A . 3 LYS CG 1 1 15 6340 1 1 3 LYS H H -5.433 0.991 -3.508 1.00 . A A . 3 LYS H 1 1 15 6341 1 1 3 LYS HA H -5.038 2.449 -6.107 1.00 . A A . 3 LYS HA 1 1 15 6342 1 1 3 LYS HB2 H -3.773 3.062 -3.419 1.00 . A A . 3 LYS HB2 1 1 15 6343 1 1 3 LYS HB3 H -3.746 4.061 -4.866 1.00 . A A . 3 LYS HB3 1 1 15 6344 1 1 3 LYS HD2 H -5.558 3.407 -1.823 1.00 . A A . 3 LYS HD2 1 1 15 6345 1 1 3 LYS HD3 H -4.693 4.909 -2.139 1.00 . A A . 3 LYS HD3 1 1 15 6346 1 1 3 LYS HE2 H -7.671 4.866 -2.543 1.00 . A A . 3 LYS HE2 1 1 15 6347 1 1 3 LYS HE3 H -7.038 4.970 -0.889 1.00 . A A . 3 LYS HE3 1 1 15 6348 1 1 3 LYS HG2 H -5.755 4.974 -4.408 1.00 . A A . 3 LYS HG2 1 1 15 6349 1 1 3 LYS HG3 H -6.476 3.400 -4.071 1.00 . A A . 3 LYS HG3 1 1 15 6350 1 1 3 LYS HZ1 H -7.311 7.161 -2.049 1.00 . A A . 3 LYS HZ1 1 1 15 6351 1 1 3 LYS HZ2 H -6.078 6.695 -3.116 1.00 . A A . 3 LYS HZ2 1 1 15 6352 1 1 3 LYS HZ3 H -5.742 6.870 -1.455 1.00 . A A . 3 LYS HZ3 1 1 15 6353 1 1 3 LYS N N -5.638 1.330 -4.404 1.00 . A A . 3 LYS N 1 1 15 6354 1 1 3 LYS NZ N -6.461 6.573 -2.157 1.00 . A A . 3 LYS NZ 1 1 15 6355 1 1 3 LYS O O -3.280 0.142 -5.145 1.00 . A A . 3 LYS O 1 1 15 6356 1 1 4 LEU C C 0.006 1.656 -4.993 1.00 . A A . 4 LEU C 1 1 15 6357 1 1 4 LEU CA C -0.997 1.315 -6.118 1.00 . A A . 4 LEU CA 1 1 15 6358 1 1 4 LEU CB C -0.538 1.871 -7.480 1.00 . A A . 4 LEU CB 1 1 15 6359 1 1 4 LEU CD1 C -1.401 -0.268 -8.459 1.00 . A A . 4 LEU CD1 1 1 15 6360 1 1 4 LEU CD2 C -2.767 1.809 -8.634 1.00 . A A . 4 LEU CD2 1 1 15 6361 1 1 4 LEU CG C -1.345 1.247 -8.629 1.00 . A A . 4 LEU CG 1 1 15 6362 1 1 4 LEU H H -2.394 2.951 -6.041 1.00 . A A . 4 LEU H 1 1 15 6363 1 1 4 LEU HA H -1.136 0.249 -6.183 1.00 . A A . 4 LEU HA 1 1 15 6364 1 1 4 LEU HB2 H -0.681 2.941 -7.492 1.00 . A A . 4 LEU HB2 1 1 15 6365 1 1 4 LEU HB3 H 0.507 1.654 -7.625 1.00 . A A . 4 LEU HB3 1 1 15 6366 1 1 4 LEU HD11 H -1.621 -0.726 -9.412 1.00 . A A . 4 LEU HD11 1 1 15 6367 1 1 4 LEU HD12 H -2.174 -0.521 -7.750 1.00 . A A . 4 LEU HD12 1 1 15 6368 1 1 4 LEU HD13 H -0.448 -0.625 -8.098 1.00 . A A . 4 LEU HD13 1 1 15 6369 1 1 4 LEU HD21 H -3.433 1.113 -8.147 1.00 . A A . 4 LEU HD21 1 1 15 6370 1 1 4 LEU HD22 H -3.088 1.962 -9.654 1.00 . A A . 4 LEU HD22 1 1 15 6371 1 1 4 LEU HD23 H -2.782 2.752 -8.109 1.00 . A A . 4 LEU HD23 1 1 15 6372 1 1 4 LEU HG H -0.863 1.480 -9.569 1.00 . A A . 4 LEU HG 1 1 15 6373 1 1 4 LEU N N -2.303 1.995 -5.856 1.00 . A A . 4 LEU N 1 1 15 6374 1 1 4 LEU O O -0.291 1.483 -3.823 1.00 . A A . 4 LEU O 1 1 15 6375 1 1 5 THR C C 2.060 3.942 -3.861 1.00 . A A . 5 THR C 1 1 15 6376 1 1 5 THR CA C 2.185 2.467 -4.265 1.00 . A A . 5 THR CA 1 1 15 6377 1 1 5 THR CB C 3.572 2.191 -4.892 1.00 . A A . 5 THR CB 1 1 15 6378 1 1 5 THR CG2 C 4.457 1.431 -3.895 1.00 . A A . 5 THR CG2 1 1 15 6379 1 1 5 THR H H 1.418 2.262 -6.260 1.00 . A A . 5 THR H 1 1 15 6380 1 1 5 THR HA H 2.042 1.829 -3.406 1.00 . A A . 5 THR HA 1 1 15 6381 1 1 5 THR HB H 4.049 3.129 -5.128 1.00 . A A . 5 THR HB 1 1 15 6382 1 1 5 THR HG1 H 3.301 0.493 -5.846 1.00 . A A . 5 THR HG1 1 1 15 6383 1 1 5 THR HG21 H 5.395 1.962 -3.770 1.00 . A A . 5 THR HG21 1 1 15 6384 1 1 5 THR HG22 H 4.649 0.436 -4.265 1.00 . A A . 5 THR HG22 1 1 15 6385 1 1 5 THR HG23 H 3.954 1.365 -2.944 1.00 . A A . 5 THR HG23 1 1 15 6386 1 1 5 THR N N 1.185 2.131 -5.323 1.00 . A A . 5 THR N 1 1 15 6387 1 1 5 THR O O 1.531 4.259 -2.815 1.00 . A A . 5 THR O 1 1 15 6388 1 1 5 THR OG1 O 3.427 1.421 -6.090 1.00 . A A . 5 THR OG1 1 1 15 6389 1 1 6 PHE C C 1.056 6.872 -4.455 1.00 . A A . 6 PHE C 1 1 15 6390 1 1 6 PHE CA C 2.475 6.303 -4.324 1.00 . A A . 6 PHE CA 1 1 15 6391 1 1 6 PHE CB C 3.428 6.999 -5.300 1.00 . A A . 6 PHE CB 1 1 15 6392 1 1 6 PHE CD1 C 5.283 6.305 -3.737 1.00 . A A . 6 PHE CD1 1 1 15 6393 1 1 6 PHE CD2 C 5.702 6.291 -6.122 1.00 . A A . 6 PHE CD2 1 1 15 6394 1 1 6 PHE CE1 C 6.585 5.861 -3.507 1.00 . A A . 6 PHE CE1 1 1 15 6395 1 1 6 PHE CE2 C 7.010 5.848 -5.889 1.00 . A A . 6 PHE CE2 1 1 15 6396 1 1 6 PHE CG C 4.839 6.521 -5.045 1.00 . A A . 6 PHE CG 1 1 15 6397 1 1 6 PHE CZ C 7.448 5.632 -4.582 1.00 . A A . 6 PHE CZ 1 1 15 6398 1 1 6 PHE H H 2.964 4.569 -5.507 1.00 . A A . 6 PHE H 1 1 15 6399 1 1 6 PHE HA H 2.831 6.450 -3.319 1.00 . A A . 6 PHE HA 1 1 15 6400 1 1 6 PHE HB2 H 3.141 6.766 -6.316 1.00 . A A . 6 PHE HB2 1 1 15 6401 1 1 6 PHE HB3 H 3.382 8.070 -5.153 1.00 . A A . 6 PHE HB3 1 1 15 6402 1 1 6 PHE HD1 H 4.619 6.481 -2.904 1.00 . A A . 6 PHE HD1 1 1 15 6403 1 1 6 PHE HD2 H 5.360 6.458 -7.135 1.00 . A A . 6 PHE HD2 1 1 15 6404 1 1 6 PHE HE1 H 6.922 5.693 -2.498 1.00 . A A . 6 PHE HE1 1 1 15 6405 1 1 6 PHE HE2 H 7.680 5.671 -6.719 1.00 . A A . 6 PHE HE2 1 1 15 6406 1 1 6 PHE HZ H 8.453 5.288 -4.401 1.00 . A A . 6 PHE HZ 1 1 15 6407 1 1 6 PHE N N 2.544 4.845 -4.673 1.00 . A A . 6 PHE N 1 1 15 6408 1 1 6 PHE O O 0.867 7.993 -4.888 1.00 . A A . 6 PHE O 1 1 15 6409 1 1 7 TRP C C -1.757 6.955 -2.665 1.00 . A A . 7 TRP C 1 1 15 6410 1 1 7 TRP CA C -1.325 6.642 -4.094 1.00 . A A . 7 TRP CA 1 1 15 6411 1 1 7 TRP CB C -2.157 5.499 -4.661 1.00 . A A . 7 TRP CB 1 1 15 6412 1 1 7 TRP CD1 C -0.625 5.164 -6.639 1.00 . A A . 7 TRP CD1 1 1 15 6413 1 1 7 TRP CD2 C -2.790 5.269 -7.231 1.00 . A A . 7 TRP CD2 1 1 15 6414 1 1 7 TRP CE2 C -2.050 5.093 -8.422 1.00 . A A . 7 TRP CE2 1 1 15 6415 1 1 7 TRP CE3 C -4.187 5.363 -7.324 1.00 . A A . 7 TRP CE3 1 1 15 6416 1 1 7 TRP CG C -1.861 5.324 -6.113 1.00 . A A . 7 TRP CG 1 1 15 6417 1 1 7 TRP CH2 C -4.065 5.103 -9.742 1.00 . A A . 7 TRP CH2 1 1 15 6418 1 1 7 TRP CZ2 C -2.674 5.011 -9.663 1.00 . A A . 7 TRP CZ2 1 1 15 6419 1 1 7 TRP CZ3 C -4.826 5.277 -8.575 1.00 . A A . 7 TRP CZ3 1 1 15 6420 1 1 7 TRP H H 0.238 5.246 -3.667 1.00 . A A . 7 TRP H 1 1 15 6421 1 1 7 TRP HA H -1.392 7.512 -4.727 1.00 . A A . 7 TRP HA 1 1 15 6422 1 1 7 TRP HB2 H -1.921 4.586 -4.133 1.00 . A A . 7 TRP HB2 1 1 15 6423 1 1 7 TRP HB3 H -3.201 5.729 -4.534 1.00 . A A . 7 TRP HB3 1 1 15 6424 1 1 7 TRP HD1 H 0.295 5.146 -6.075 1.00 . A A . 7 TRP HD1 1 1 15 6425 1 1 7 TRP HE1 H 0.021 4.915 -8.627 1.00 . A A . 7 TRP HE1 1 1 15 6426 1 1 7 TRP HE3 H -4.771 5.496 -6.428 1.00 . A A . 7 TRP HE3 1 1 15 6427 1 1 7 TRP HH2 H -4.555 5.034 -10.700 1.00 . A A . 7 TRP HH2 1 1 15 6428 1 1 7 TRP HZ2 H -2.087 4.873 -10.558 1.00 . A A . 7 TRP HZ2 1 1 15 6429 1 1 7 TRP HZ3 H -5.902 5.345 -8.638 1.00 . A A . 7 TRP HZ3 1 1 15 6430 1 1 7 TRP N N 0.065 6.130 -4.043 1.00 . A A . 7 TRP N 1 1 15 6431 1 1 7 TRP NE1 N -0.733 5.035 -8.008 1.00 . A A . 7 TRP NE1 1 1 15 6432 1 1 7 TRP O O -1.823 6.064 -1.839 1.00 . A A . 7 TRP O 1 1 15 6433 1 1 8 LYS C C -3.343 7.524 -0.360 1.00 . A A . 8 LYS C 1 1 15 6434 1 1 8 LYS CA C -2.417 8.586 -0.964 1.00 . A A . 8 LYS CA 1 1 15 6435 1 1 8 LYS CB C -3.144 9.931 -1.096 1.00 . A A . 8 LYS CB 1 1 15 6436 1 1 8 LYS CD C -1.415 11.556 -0.275 1.00 . A A . 8 LYS CD 1 1 15 6437 1 1 8 LYS CE C -0.721 12.882 -0.621 1.00 . A A . 8 LYS CE 1 1 15 6438 1 1 8 LYS CG C -2.149 11.021 -1.511 1.00 . A A . 8 LYS CG 1 1 15 6439 1 1 8 LYS H H -1.927 8.890 -3.048 1.00 . A A . 8 LYS H 1 1 15 6440 1 1 8 LYS HA H -1.538 8.701 -0.346 1.00 . A A . 8 LYS HA 1 1 15 6441 1 1 8 LYS HB2 H -3.916 9.846 -1.848 1.00 . A A . 8 LYS HB2 1 1 15 6442 1 1 8 LYS HB3 H -3.591 10.194 -0.151 1.00 . A A . 8 LYS HB3 1 1 15 6443 1 1 8 LYS HD2 H -2.123 11.714 0.528 1.00 . A A . 8 LYS HD2 1 1 15 6444 1 1 8 LYS HD3 H -0.673 10.837 0.041 1.00 . A A . 8 LYS HD3 1 1 15 6445 1 1 8 LYS HE2 H 0.087 13.071 0.074 1.00 . A A . 8 LYS HE2 1 1 15 6446 1 1 8 LYS HE3 H -0.346 12.857 -1.633 1.00 . A A . 8 LYS HE3 1 1 15 6447 1 1 8 LYS HG2 H -1.430 10.608 -2.205 1.00 . A A . 8 LYS HG2 1 1 15 6448 1 1 8 LYS HG3 H -2.684 11.829 -1.988 1.00 . A A . 8 LYS HG3 1 1 15 6449 1 1 8 LYS HZ1 H -2.718 13.504 -0.546 1.00 . A A . 8 LYS HZ1 1 1 15 6450 1 1 8 LYS HZ2 H -1.666 14.626 -1.261 1.00 . A A . 8 LYS HZ2 1 1 15 6451 1 1 8 LYS HZ3 H -1.668 14.419 0.423 1.00 . A A . 8 LYS HZ3 1 1 15 6452 1 1 8 LYS N N -2.016 8.202 -2.361 1.00 . A A . 8 LYS N 1 1 15 6453 1 1 8 LYS NZ N -1.773 13.934 -0.491 1.00 . A A . 8 LYS NZ 1 1 15 6454 1 1 8 LYS O O -4.523 7.452 -0.675 1.00 . A A . 8 LYS O 1 1 15 6455 1 1 9 CYS C C -3.631 5.719 2.616 1.00 . A A . 9 CYS C 1 1 15 6456 1 1 9 CYS CA C -3.629 5.599 1.089 1.00 . A A . 9 CYS CA 1 1 15 6457 1 1 9 CYS CB C -2.951 4.302 0.624 1.00 . A A . 9 CYS CB 1 1 15 6458 1 1 9 CYS H H -1.844 6.753 0.692 1.00 . A A . 9 CYS H 1 1 15 6459 1 1 9 CYS HA H -4.638 5.638 0.710 1.00 . A A . 9 CYS HA 1 1 15 6460 1 1 9 CYS HB2 H -3.587 3.814 -0.099 1.00 . A A . 9 CYS HB2 1 1 15 6461 1 1 9 CYS HB3 H -2.004 4.539 0.160 1.00 . A A . 9 CYS HB3 1 1 15 6462 1 1 9 CYS N N -2.806 6.683 0.478 1.00 . A A . 9 CYS N 1 1 15 6463 1 1 9 CYS O O -2.768 6.350 3.200 1.00 . A A . 9 CYS O 1 1 15 6464 1 1 9 CYS SG S -2.681 3.181 2.024 1.00 . A A . 9 CYS SG 1 1 15 6465 1 1 10 LYS C C -4.406 3.791 5.364 1.00 . A A . 10 LYS C 1 1 15 6466 1 1 10 LYS CA C -4.666 5.180 4.752 1.00 . A A . 10 LYS CA 1 1 15 6467 1 1 10 LYS CB C -6.093 5.644 5.066 1.00 . A A . 10 LYS CB 1 1 15 6468 1 1 10 LYS CD C -7.333 7.814 5.320 1.00 . A A . 10 LYS CD 1 1 15 6469 1 1 10 LYS CE C -8.292 8.621 4.429 1.00 . A A . 10 LYS CE 1 1 15 6470 1 1 10 LYS CG C -6.340 7.029 4.450 1.00 . A A . 10 LYS CG 1 1 15 6471 1 1 10 LYS H H -5.275 4.614 2.763 1.00 . A A . 10 LYS H 1 1 15 6472 1 1 10 LYS HA H -3.957 5.896 5.134 1.00 . A A . 10 LYS HA 1 1 15 6473 1 1 10 LYS HB2 H -6.798 4.936 4.654 1.00 . A A . 10 LYS HB2 1 1 15 6474 1 1 10 LYS HB3 H -6.224 5.701 6.137 1.00 . A A . 10 LYS HB3 1 1 15 6475 1 1 10 LYS HD2 H -7.901 7.120 5.926 1.00 . A A . 10 LYS HD2 1 1 15 6476 1 1 10 LYS HD3 H -6.786 8.487 5.965 1.00 . A A . 10 LYS HD3 1 1 15 6477 1 1 10 LYS HE2 H -8.064 8.452 3.385 1.00 . A A . 10 LYS HE2 1 1 15 6478 1 1 10 LYS HE3 H -9.315 8.348 4.639 1.00 . A A . 10 LYS HE3 1 1 15 6479 1 1 10 LYS HG2 H -5.404 7.567 4.395 1.00 . A A . 10 LYS HG2 1 1 15 6480 1 1 10 LYS HG3 H -6.747 6.912 3.456 1.00 . A A . 10 LYS HG3 1 1 15 6481 1 1 10 LYS HZ1 H -8.193 10.181 5.814 1.00 . A A . 10 LYS HZ1 1 1 15 6482 1 1 10 LYS HZ2 H -8.746 10.652 4.283 1.00 . A A . 10 LYS HZ2 1 1 15 6483 1 1 10 LYS HZ3 H -7.096 10.336 4.526 1.00 . A A . 10 LYS HZ3 1 1 15 6484 1 1 10 LYS N N -4.593 5.117 3.262 1.00 . A A . 10 LYS N 1 1 15 6485 1 1 10 LYS NZ N -8.063 10.053 4.789 1.00 . A A . 10 LYS NZ 1 1 15 6486 1 1 10 LYS O O -3.918 3.682 6.472 1.00 . A A . 10 LYS O 1 1 15 6487 1 1 11 ASN C C -3.519 0.584 4.365 1.00 . A A . 11 ASN C 1 1 15 6488 1 1 11 ASN CA C -4.517 1.363 5.225 1.00 . A A . 11 ASN CA 1 1 15 6489 1 1 11 ASN CB C -5.895 0.706 5.162 1.00 . A A . 11 ASN CB 1 1 15 6490 1 1 11 ASN CG C -5.896 -0.570 5.990 1.00 . A A . 11 ASN CG 1 1 15 6491 1 1 11 ASN H H -5.145 2.826 3.782 1.00 . A A . 11 ASN H 1 1 15 6492 1 1 11 ASN HA H -4.178 1.417 6.247 1.00 . A A . 11 ASN HA 1 1 15 6493 1 1 11 ASN HB2 H -6.637 1.389 5.549 1.00 . A A . 11 ASN HB2 1 1 15 6494 1 1 11 ASN HB3 H -6.132 0.463 4.138 1.00 . A A . 11 ASN HB3 1 1 15 6495 1 1 11 ASN HD21 H -7.289 0.082 7.232 1.00 . A A . 11 ASN HD21 1 1 15 6496 1 1 11 ASN HD22 H -6.707 -1.481 7.539 1.00 . A A . 11 ASN HD22 1 1 15 6497 1 1 11 ASN N N -4.737 2.730 4.669 1.00 . A A . 11 ASN N 1 1 15 6498 1 1 11 ASN ND2 N -6.693 -0.664 7.007 1.00 . A A . 11 ASN ND2 1 1 15 6499 1 1 11 ASN O O -3.415 0.788 3.178 1.00 . A A . 11 ASN O 1 1 15 6500 1 1 11 ASN OD1 O -5.155 -1.493 5.711 1.00 . A A . 11 ASN OD1 1 1 15 6501 1 1 12 LYS C C -2.536 -2.185 3.314 1.00 . A A . 12 LYS C 1 1 15 6502 1 1 12 LYS CA C -1.813 -1.114 4.153 1.00 . A A . 12 LYS CA 1 1 15 6503 1 1 12 LYS CB C -0.863 -1.744 5.186 1.00 . A A . 12 LYS CB 1 1 15 6504 1 1 12 LYS CD C -0.606 -3.482 6.987 1.00 . A A . 12 LYS CD 1 1 15 6505 1 1 12 LYS CE C 0.099 -4.744 6.470 1.00 . A A . 12 LYS CE 1 1 15 6506 1 1 12 LYS CG C -1.543 -2.924 5.904 1.00 . A A . 12 LYS CG 1 1 15 6507 1 1 12 LYS H H -2.887 -0.481 5.908 1.00 . A A . 12 LYS H 1 1 15 6508 1 1 12 LYS HA H -1.257 -0.460 3.498 1.00 . A A . 12 LYS HA 1 1 15 6509 1 1 12 LYS HB2 H 0.018 -2.097 4.682 1.00 . A A . 12 LYS HB2 1 1 15 6510 1 1 12 LYS HB3 H -0.582 -0.999 5.916 1.00 . A A . 12 LYS HB3 1 1 15 6511 1 1 12 LYS HD2 H 0.132 -2.734 7.242 1.00 . A A . 12 LYS HD2 1 1 15 6512 1 1 12 LYS HD3 H -1.182 -3.729 7.869 1.00 . A A . 12 LYS HD3 1 1 15 6513 1 1 12 LYS HE2 H -0.609 -5.559 6.381 1.00 . A A . 12 LYS HE2 1 1 15 6514 1 1 12 LYS HE3 H 0.570 -4.550 5.516 1.00 . A A . 12 LYS HE3 1 1 15 6515 1 1 12 LYS HG2 H -2.458 -2.583 6.362 1.00 . A A . 12 LYS HG2 1 1 15 6516 1 1 12 LYS HG3 H -1.764 -3.701 5.188 1.00 . A A . 12 LYS HG3 1 1 15 6517 1 1 12 LYS HZ1 H 1.783 -5.786 7.115 1.00 . A A . 12 LYS HZ1 1 1 15 6518 1 1 12 LYS HZ2 H 0.676 -5.431 8.356 1.00 . A A . 12 LYS HZ2 1 1 15 6519 1 1 12 LYS HZ3 H 1.684 -4.211 7.728 1.00 . A A . 12 LYS HZ3 1 1 15 6520 1 1 12 LYS N N -2.790 -0.320 4.952 1.00 . A A . 12 LYS N 1 1 15 6521 1 1 12 LYS NZ N 1.136 -5.064 7.495 1.00 . A A . 12 LYS NZ 1 1 15 6522 1 1 12 LYS O O -1.996 -2.679 2.347 1.00 . A A . 12 LYS O 1 1 15 6523 1 1 13 LYS C C -5.413 -2.962 1.832 1.00 . A A . 13 LYS C 1 1 15 6524 1 1 13 LYS CA C -4.461 -3.593 2.864 1.00 . A A . 13 LYS CA 1 1 15 6525 1 1 13 LYS CB C -5.217 -4.448 3.893 1.00 . A A . 13 LYS CB 1 1 15 6526 1 1 13 LYS CD C -7.282 -4.661 5.305 1.00 . A A . 13 LYS CD 1 1 15 6527 1 1 13 LYS CE C -8.700 -5.058 4.866 1.00 . A A . 13 LYS CE 1 1 15 6528 1 1 13 LYS CG C -6.600 -3.848 4.196 1.00 . A A . 13 LYS CG 1 1 15 6529 1 1 13 LYS H H -4.179 -2.150 4.448 1.00 . A A . 13 LYS H 1 1 15 6530 1 1 13 LYS HA H -3.741 -4.209 2.348 1.00 . A A . 13 LYS HA 1 1 15 6531 1 1 13 LYS HB2 H -5.340 -5.445 3.498 1.00 . A A . 13 LYS HB2 1 1 15 6532 1 1 13 LYS HB3 H -4.641 -4.496 4.805 1.00 . A A . 13 LYS HB3 1 1 15 6533 1 1 13 LYS HD2 H -6.707 -5.552 5.505 1.00 . A A . 13 LYS HD2 1 1 15 6534 1 1 13 LYS HD3 H -7.342 -4.062 6.201 1.00 . A A . 13 LYS HD3 1 1 15 6535 1 1 13 LYS HE2 H -9.360 -4.199 4.912 1.00 . A A . 13 LYS HE2 1 1 15 6536 1 1 13 LYS HE3 H -8.684 -5.463 3.865 1.00 . A A . 13 LYS HE3 1 1 15 6537 1 1 13 LYS HG2 H -6.485 -2.824 4.519 1.00 . A A . 13 LYS HG2 1 1 15 6538 1 1 13 LYS HG3 H -7.209 -3.877 3.304 1.00 . A A . 13 LYS HG3 1 1 15 6539 1 1 13 LYS HZ1 H -8.702 -5.934 6.766 1.00 . A A . 13 LYS HZ1 1 1 15 6540 1 1 13 LYS HZ2 H -8.860 -7.048 5.492 1.00 . A A . 13 LYS HZ2 1 1 15 6541 1 1 13 LYS HZ3 H -10.172 -6.070 5.935 1.00 . A A . 13 LYS HZ3 1 1 15 6542 1 1 13 LYS N N -3.746 -2.551 3.665 1.00 . A A . 13 LYS N 1 1 15 6543 1 1 13 LYS NZ N -9.139 -6.105 5.837 1.00 . A A . 13 LYS NZ 1 1 15 6544 1 1 13 LYS O O -6.071 -3.665 1.090 1.00 . A A . 13 LYS O 1 1 15 6545 1 1 14 GLU C C -5.679 -0.840 -0.602 1.00 . A A . 14 GLU C 1 1 15 6546 1 1 14 GLU CA C -6.398 -1.029 0.746 1.00 . A A . 14 GLU CA 1 1 15 6547 1 1 14 GLU CB C -6.858 0.312 1.333 1.00 . A A . 14 GLU CB 1 1 15 6548 1 1 14 GLU CD C -5.992 2.648 1.442 1.00 . A A . 14 GLU CD 1 1 15 6549 1 1 14 GLU CG C -5.658 1.182 1.702 1.00 . A A . 14 GLU CG 1 1 15 6550 1 1 14 GLU H H -4.945 -1.091 2.349 1.00 . A A . 14 GLU H 1 1 15 6551 1 1 14 GLU HA H -7.254 -1.661 0.603 1.00 . A A . 14 GLU HA 1 1 15 6552 1 1 14 GLU HB2 H -7.461 0.828 0.599 1.00 . A A . 14 GLU HB2 1 1 15 6553 1 1 14 GLU HB3 H -7.453 0.129 2.218 1.00 . A A . 14 GLU HB3 1 1 15 6554 1 1 14 GLU HG2 H -5.427 1.045 2.749 1.00 . A A . 14 GLU HG2 1 1 15 6555 1 1 14 GLU HG3 H -4.805 0.897 1.105 1.00 . A A . 14 GLU HG3 1 1 15 6556 1 1 14 GLU N N -5.487 -1.653 1.758 1.00 . A A . 14 GLU N 1 1 15 6557 1 1 14 GLU O O -6.312 -0.603 -1.618 1.00 . A A . 14 GLU O 1 1 15 6558 1 1 14 GLU OE1 O -5.861 3.077 0.314 1.00 . A A . 14 GLU OE1 1 1 15 6559 1 1 14 GLU OE2 O -6.374 3.321 2.379 1.00 . A A . 14 GLU OE2 1 1 15 6560 1 1 15 CYS C C -3.843 -2.101 -2.778 1.00 . A A . 15 CYS C 1 1 15 6561 1 1 15 CYS CA C -3.659 -0.818 -1.949 1.00 . A A . 15 CYS CA 1 1 15 6562 1 1 15 CYS CB C -2.185 -0.604 -1.602 1.00 . A A . 15 CYS CB 1 1 15 6563 1 1 15 CYS H H -3.868 -1.184 0.178 1.00 . A A . 15 CYS H 1 1 15 6564 1 1 15 CYS HA H -4.037 0.036 -2.484 1.00 . A A . 15 CYS HA 1 1 15 6565 1 1 15 CYS HB2 H -1.913 -1.237 -0.772 1.00 . A A . 15 CYS HB2 1 1 15 6566 1 1 15 CYS HB3 H -1.577 -0.854 -2.460 1.00 . A A . 15 CYS HB3 1 1 15 6567 1 1 15 CYS N N -4.373 -0.969 -0.641 1.00 . A A . 15 CYS N 1 1 15 6568 1 1 15 CYS O O -3.589 -3.189 -2.305 1.00 . A A . 15 CYS O 1 1 15 6569 1 1 15 CYS SG S -1.904 1.130 -1.159 1.00 . A A . 15 CYS SG 1 1 15 6570 1 1 16 CYS C C -3.202 -3.975 -5.038 1.00 . A A . 16 CYS C 1 1 15 6571 1 1 16 CYS CA C -4.513 -3.203 -4.854 1.00 . A A . 16 CYS CA 1 1 15 6572 1 1 16 CYS CB C -5.028 -2.694 -6.205 1.00 . A A . 16 CYS CB 1 1 15 6573 1 1 16 CYS H H -4.501 -1.095 -4.364 1.00 . A A . 16 CYS H 1 1 15 6574 1 1 16 CYS HA H -5.254 -3.841 -4.401 1.00 . A A . 16 CYS HA 1 1 15 6575 1 1 16 CYS HB2 H -4.998 -1.616 -6.225 1.00 . A A . 16 CYS HB2 1 1 15 6576 1 1 16 CYS HB3 H -4.407 -3.087 -6.999 1.00 . A A . 16 CYS HB3 1 1 15 6577 1 1 16 CYS N N -4.296 -1.983 -4.005 1.00 . A A . 16 CYS N 1 1 15 6578 1 1 16 CYS O O -3.155 -5.175 -4.861 1.00 . A A . 16 CYS O 1 1 15 6579 1 1 16 CYS SG S -6.732 -3.261 -6.441 1.00 . A A . 16 CYS SG 1 1 15 6580 1 1 17 GLY C C -0.229 -4.230 -4.170 1.00 . A A . 17 GLY C 1 1 15 6581 1 1 17 GLY CA C -0.834 -3.996 -5.554 1.00 . A A . 17 GLY CA 1 1 15 6582 1 1 17 GLY H H -2.197 -2.333 -5.508 1.00 . A A . 17 GLY H 1 1 15 6583 1 1 17 GLY HA2 H -0.992 -4.942 -6.052 1.00 . A A . 17 GLY HA2 1 1 15 6584 1 1 17 GLY HA3 H -0.168 -3.381 -6.140 1.00 . A A . 17 GLY HA3 1 1 15 6585 1 1 17 GLY N N -2.139 -3.299 -5.378 1.00 . A A . 17 GLY N 1 1 15 6586 1 1 17 GLY O O 0.683 -3.532 -3.779 1.00 . A A . 17 GLY O 1 1 15 6587 1 1 18 TRP C C 0.955 -4.726 -1.638 1.00 . A A . 18 TRP C 1 1 15 6588 1 1 18 TRP CA C -0.294 -5.525 -2.035 1.00 . A A . 18 TRP CA 1 1 15 6589 1 1 18 TRP CB C 0.013 -7.028 -2.056 1.00 . A A . 18 TRP CB 1 1 15 6590 1 1 18 TRP CD1 C -1.610 -7.267 -0.129 1.00 . A A . 18 TRP CD1 1 1 15 6591 1 1 18 TRP CD2 C -1.465 -9.131 -1.385 1.00 . A A . 18 TRP CD2 1 1 15 6592 1 1 18 TRP CE2 C -2.395 -9.405 -0.357 1.00 . A A . 18 TRP CE2 1 1 15 6593 1 1 18 TRP CE3 C -1.189 -10.150 -2.315 1.00 . A A . 18 TRP CE3 1 1 15 6594 1 1 18 TRP CG C -0.983 -7.766 -1.220 1.00 . A A . 18 TRP CG 1 1 15 6595 1 1 18 TRP CH2 C -2.745 -11.637 -1.191 1.00 . A A . 18 TRP CH2 1 1 15 6596 1 1 18 TRP CZ2 C -3.030 -10.642 -0.257 1.00 . A A . 18 TRP CZ2 1 1 15 6597 1 1 18 TRP CZ3 C -1.828 -11.394 -2.216 1.00 . A A . 18 TRP CZ3 1 1 15 6598 1 1 18 TRP H H -1.520 -5.701 -3.804 1.00 . A A . 18 TRP H 1 1 15 6599 1 1 18 TRP HA H -1.087 -5.330 -1.330 1.00 . A A . 18 TRP HA 1 1 15 6600 1 1 18 TRP HB2 H -0.033 -7.393 -3.072 1.00 . A A . 18 TRP HB2 1 1 15 6601 1 1 18 TRP HB3 H 1.005 -7.200 -1.662 1.00 . A A . 18 TRP HB3 1 1 15 6602 1 1 18 TRP HD1 H -1.480 -6.272 0.276 1.00 . A A . 18 TRP HD1 1 1 15 6603 1 1 18 TRP HE1 H -3.022 -8.128 1.169 1.00 . A A . 18 TRP HE1 1 1 15 6604 1 1 18 TRP HE3 H -0.484 -9.977 -3.114 1.00 . A A . 18 TRP HE3 1 1 15 6605 1 1 18 TRP HH2 H -3.231 -12.598 -1.120 1.00 . A A . 18 TRP HH2 1 1 15 6606 1 1 18 TRP HZ2 H -3.739 -10.830 0.536 1.00 . A A . 18 TRP HZ2 1 1 15 6607 1 1 18 TRP HZ3 H -1.612 -12.169 -2.934 1.00 . A A . 18 TRP HZ3 1 1 15 6608 1 1 18 TRP N N -0.767 -5.193 -3.433 1.00 . A A . 18 TRP N 1 1 15 6609 1 1 18 TRP NE1 N -2.450 -8.238 0.383 1.00 . A A . 18 TRP NE1 1 1 15 6610 1 1 18 TRP O O 2.070 -5.086 -1.972 1.00 . A A . 18 TRP O 1 1 15 6611 1 1 19 ASN C C 1.688 -2.271 0.903 1.00 . A A . 19 ASN C 1 1 15 6612 1 1 19 ASN CA C 1.921 -2.792 -0.518 1.00 . A A . 19 ASN CA 1 1 15 6613 1 1 19 ASN CB C 1.933 -1.649 -1.537 1.00 . A A . 19 ASN CB 1 1 15 6614 1 1 19 ASN CG C 3.115 -0.723 -1.268 1.00 . A A . 19 ASN CG 1 1 15 6615 1 1 19 ASN H H -0.144 -3.378 -0.684 1.00 . A A . 19 ASN H 1 1 15 6616 1 1 19 ASN HA H 2.844 -3.348 -0.571 1.00 . A A . 19 ASN HA 1 1 15 6617 1 1 19 ASN HB2 H 2.017 -2.058 -2.533 1.00 . A A . 19 ASN HB2 1 1 15 6618 1 1 19 ASN HB3 H 1.014 -1.090 -1.454 1.00 . A A . 19 ASN HB3 1 1 15 6619 1 1 19 ASN HD21 H 4.233 -1.444 -2.737 1.00 . A A . 19 ASN HD21 1 1 15 6620 1 1 19 ASN HD22 H 4.934 -0.190 -1.836 1.00 . A A . 19 ASN HD22 1 1 15 6621 1 1 19 ASN N N 0.767 -3.643 -0.936 1.00 . A A . 19 ASN N 1 1 15 6622 1 1 19 ASN ND2 N 4.181 -0.794 -2.008 1.00 . A A . 19 ASN ND2 1 1 15 6623 1 1 19 ASN O O 0.609 -2.404 1.445 1.00 . A A . 19 ASN O 1 1 15 6624 1 1 19 ASN OD1 O 3.065 0.077 -0.370 1.00 . A A . 19 ASN OD1 1 1 15 6625 1 1 20 ALA C C 2.345 0.344 2.916 1.00 . A A . 20 ALA C 1 1 15 6626 1 1 20 ALA CA C 2.516 -1.174 2.900 1.00 . A A . 20 ALA CA 1 1 15 6627 1 1 20 ALA CB C 3.810 -1.550 3.610 1.00 . A A . 20 ALA CB 1 1 15 6628 1 1 20 ALA H H 3.544 -1.586 1.056 1.00 . A A . 20 ALA H 1 1 15 6629 1 1 20 ALA HA H 1.683 -1.656 3.383 1.00 . A A . 20 ALA HA 1 1 15 6630 1 1 20 ALA HB1 H 3.660 -1.516 4.675 1.00 . A A . 20 ALA HB1 1 1 15 6631 1 1 20 ALA HB2 H 4.586 -0.845 3.332 1.00 . A A . 20 ALA HB2 1 1 15 6632 1 1 20 ALA HB3 H 4.106 -2.547 3.317 1.00 . A A . 20 ALA HB3 1 1 15 6633 1 1 20 ALA N N 2.683 -1.685 1.512 1.00 . A A . 20 ALA N 1 1 15 6634 1 1 20 ALA O O 3.183 1.084 2.430 1.00 . A A . 20 ALA O 1 1 15 6635 1 1 21 CYS C C 1.925 2.808 4.748 1.00 . A A . 21 CYS C 1 1 15 6636 1 1 21 CYS CA C 1.067 2.285 3.603 1.00 . A A . 21 CYS CA 1 1 15 6637 1 1 21 CYS CB C -0.423 2.479 3.899 1.00 . A A . 21 CYS CB 1 1 15 6638 1 1 21 CYS H H 0.647 0.197 3.919 1.00 . A A . 21 CYS H 1 1 15 6639 1 1 21 CYS HA H 1.334 2.765 2.680 1.00 . A A . 21 CYS HA 1 1 15 6640 1 1 21 CYS HB2 H -0.966 1.592 3.614 1.00 . A A . 21 CYS HB2 1 1 15 6641 1 1 21 CYS HB3 H -0.562 2.658 4.957 1.00 . A A . 21 CYS HB3 1 1 15 6642 1 1 21 CYS N N 1.282 0.811 3.508 1.00 . A A . 21 CYS N 1 1 15 6643 1 1 21 CYS O O 1.670 2.522 5.902 1.00 . A A . 21 CYS O 1 1 15 6644 1 1 21 CYS SG S -1.037 3.898 2.953 1.00 . A A . 21 CYS SG 1 1 15 6645 1 1 22 ALA C C 4.114 5.541 5.402 1.00 . A A . 22 ALA C 1 1 15 6646 1 1 22 ALA CA C 3.867 4.032 5.517 1.00 . A A . 22 ALA CA 1 1 15 6647 1 1 22 ALA CB C 5.176 3.260 5.305 1.00 . A A . 22 ALA CB 1 1 15 6648 1 1 22 ALA H H 3.166 3.717 3.493 1.00 . A A . 22 ALA H 1 1 15 6649 1 1 22 ALA HA H 3.459 3.797 6.486 1.00 . A A . 22 ALA HA 1 1 15 6650 1 1 22 ALA HB1 H 5.421 3.260 4.252 1.00 . A A . 22 ALA HB1 1 1 15 6651 1 1 22 ALA HB2 H 5.057 2.243 5.648 1.00 . A A . 22 ALA HB2 1 1 15 6652 1 1 22 ALA HB3 H 5.972 3.737 5.858 1.00 . A A . 22 ALA HB3 1 1 15 6653 1 1 22 ALA N N 2.964 3.532 4.439 1.00 . A A . 22 ALA N 1 1 15 6654 1 1 22 ALA O O 3.629 6.315 6.204 1.00 . A A . 22 ALA O 1 1 15 6655 1 1 23 LEU C C 3.993 8.180 3.711 1.00 . A A . 23 LEU C 1 1 15 6656 1 1 23 LEU CA C 5.201 7.416 4.280 1.00 . A A . 23 LEU CA 1 1 15 6657 1 1 23 LEU CB C 6.388 7.459 3.298 1.00 . A A . 23 LEU CB 1 1 15 6658 1 1 23 LEU CD1 C 7.482 6.190 5.230 1.00 . A A . 23 LEU CD1 1 1 15 6659 1 1 23 LEU CD2 C 8.572 6.255 2.991 1.00 . A A . 23 LEU CD2 1 1 15 6660 1 1 23 LEU CG C 7.721 7.056 3.982 1.00 . A A . 23 LEU CG 1 1 15 6661 1 1 23 LEU H H 5.277 5.310 3.811 1.00 . A A . 23 LEU H 1 1 15 6662 1 1 23 LEU HA H 5.494 7.835 5.227 1.00 . A A . 23 LEU HA 1 1 15 6663 1 1 23 LEU HB2 H 6.194 6.784 2.478 1.00 . A A . 23 LEU HB2 1 1 15 6664 1 1 23 LEU HB3 H 6.482 8.464 2.909 1.00 . A A . 23 LEU HB3 1 1 15 6665 1 1 23 LEU HD11 H 6.761 6.669 5.875 1.00 . A A . 23 LEU HD11 1 1 15 6666 1 1 23 LEU HD12 H 8.413 6.066 5.763 1.00 . A A . 23 LEU HD12 1 1 15 6667 1 1 23 LEU HD13 H 7.110 5.221 4.930 1.00 . A A . 23 LEU HD13 1 1 15 6668 1 1 23 LEU HD21 H 8.400 5.196 3.138 1.00 . A A . 23 LEU HD21 1 1 15 6669 1 1 23 LEU HD22 H 9.619 6.473 3.155 1.00 . A A . 23 LEU HD22 1 1 15 6670 1 1 23 LEU HD23 H 8.303 6.526 1.982 1.00 . A A . 23 LEU HD23 1 1 15 6671 1 1 23 LEU HG H 8.256 7.950 4.269 1.00 . A A . 23 LEU HG 1 1 15 6672 1 1 23 LEU N N 4.885 5.958 4.432 1.00 . A A . 23 LEU N 1 1 15 6673 1 1 23 LEU O O 4.090 8.846 2.698 1.00 . A A . 23 LEU O 1 1 15 6674 1 1 24 GLY C C 1.113 8.124 2.548 1.00 . A A . 24 GLY C 1 1 15 6675 1 1 24 GLY CA C 1.626 8.787 3.845 1.00 . A A . 24 GLY CA 1 1 15 6676 1 1 24 GLY H H 2.794 7.535 5.162 1.00 . A A . 24 GLY H 1 1 15 6677 1 1 24 GLY HA2 H 0.853 8.743 4.600 1.00 . A A . 24 GLY HA2 1 1 15 6678 1 1 24 GLY HA3 H 1.867 9.819 3.642 1.00 . A A . 24 GLY HA3 1 1 15 6679 1 1 24 GLY N N 2.850 8.080 4.349 1.00 . A A . 24 GLY N 1 1 15 6680 1 1 24 GLY O O 0.166 8.588 1.944 1.00 . A A . 24 GLY O 1 1 15 6681 1 1 25 ILE C C 1.730 4.905 0.932 1.00 . A A . 25 ILE C 1 1 15 6682 1 1 25 ILE CA C 1.298 6.367 0.853 1.00 . A A . 25 ILE CA 1 1 15 6683 1 1 25 ILE CB C 2.043 7.051 -0.319 1.00 . A A . 25 ILE CB 1 1 15 6684 1 1 25 ILE CD1 C 3.310 9.060 -1.105 1.00 . A A . 25 ILE CD1 1 1 15 6685 1 1 25 ILE CG1 C 2.678 8.382 0.108 1.00 . A A . 25 ILE CG1 1 1 15 6686 1 1 25 ILE CG2 C 1.070 7.316 -1.464 1.00 . A A . 25 ILE CG2 1 1 15 6687 1 1 25 ILE H H 2.497 6.695 2.608 1.00 . A A . 25 ILE H 1 1 15 6688 1 1 25 ILE HA H 0.233 6.449 0.720 1.00 . A A . 25 ILE HA 1 1 15 6689 1 1 25 ILE HB H 2.811 6.383 -0.670 1.00 . A A . 25 ILE HB 1 1 15 6690 1 1 25 ILE HD11 H 2.591 9.727 -1.556 1.00 . A A . 25 ILE HD11 1 1 15 6691 1 1 25 ILE HD12 H 3.607 8.311 -1.822 1.00 . A A . 25 ILE HD12 1 1 15 6692 1 1 25 ILE HD13 H 4.176 9.624 -0.791 1.00 . A A . 25 ILE HD13 1 1 15 6693 1 1 25 ILE HG12 H 1.918 9.027 0.524 1.00 . A A . 25 ILE HG12 1 1 15 6694 1 1 25 ILE HG13 H 3.438 8.198 0.851 1.00 . A A . 25 ILE HG13 1 1 15 6695 1 1 25 ILE HG21 H 0.319 8.021 -1.143 1.00 . A A . 25 ILE HG21 1 1 15 6696 1 1 25 ILE HG22 H 0.599 6.392 -1.757 1.00 . A A . 25 ILE HG22 1 1 15 6697 1 1 25 ILE HG23 H 1.615 7.726 -2.303 1.00 . A A . 25 ILE HG23 1 1 15 6698 1 1 25 ILE N N 1.736 7.057 2.110 1.00 . A A . 25 ILE N 1 1 15 6699 1 1 25 ILE O O 2.314 4.483 1.917 1.00 . A A . 25 ILE O 1 1 15 6700 1 1 26 CYS C C 3.415 2.705 -0.578 1.00 . A A . 26 CYS C 1 1 15 6701 1 1 26 CYS CA C 1.970 2.718 -0.080 1.00 . A A . 26 CYS CA 1 1 15 6702 1 1 26 CYS CB C 1.031 1.942 -1.020 1.00 . A A . 26 CYS CB 1 1 15 6703 1 1 26 CYS H H 1.078 4.506 -0.914 1.00 . A A . 26 CYS H 1 1 15 6704 1 1 26 CYS HA H 1.912 2.318 0.920 1.00 . A A . 26 CYS HA 1 1 15 6705 1 1 26 CYS HB2 H 0.555 2.626 -1.703 1.00 . A A . 26 CYS HB2 1 1 15 6706 1 1 26 CYS HB3 H 1.603 1.216 -1.580 1.00 . A A . 26 CYS HB3 1 1 15 6707 1 1 26 CYS N N 1.505 4.138 -0.104 1.00 . A A . 26 CYS N 1 1 15 6708 1 1 26 CYS O O 3.703 3.193 -1.655 1.00 . A A . 26 CYS O 1 1 15 6709 1 1 26 CYS SG S -0.226 1.086 -0.032 1.00 . A A . 26 CYS SG 1 1 15 6710 1 1 27 MET C C 6.528 0.935 0.193 1.00 . A A . 27 MET C 1 1 15 6711 1 1 27 MET CA C 5.754 2.193 -0.269 1.00 . A A . 27 MET CA 1 1 15 6712 1 1 27 MET CB C 6.340 3.479 0.335 1.00 . A A . 27 MET CB 1 1 15 6713 1 1 27 MET CE C 5.965 7.371 -0.054 1.00 . A A . 27 MET CE 1 1 15 6714 1 1 27 MET CG C 5.938 4.691 -0.504 1.00 . A A . 27 MET CG 1 1 15 6715 1 1 27 MET H H 4.094 1.802 1.067 1.00 . A A . 27 MET H 1 1 15 6716 1 1 27 MET HA H 5.786 2.262 -1.343 1.00 . A A . 27 MET HA 1 1 15 6717 1 1 27 MET HB2 H 5.956 3.607 1.332 1.00 . A A . 27 MET HB2 1 1 15 6718 1 1 27 MET HB3 H 7.414 3.403 0.370 1.00 . A A . 27 MET HB3 1 1 15 6719 1 1 27 MET HE1 H 5.529 7.608 -1.015 1.00 . A A . 27 MET HE1 1 1 15 6720 1 1 27 MET HE2 H 6.471 8.241 0.333 1.00 . A A . 27 MET HE2 1 1 15 6721 1 1 27 MET HE3 H 5.185 7.077 0.637 1.00 . A A . 27 MET HE3 1 1 15 6722 1 1 27 MET HG2 H 5.903 4.418 -1.549 1.00 . A A . 27 MET HG2 1 1 15 6723 1 1 27 MET HG3 H 4.960 5.028 -0.192 1.00 . A A . 27 MET HG3 1 1 15 6724 1 1 27 MET N N 4.334 2.181 0.189 1.00 . A A . 27 MET N 1 1 15 6725 1 1 27 MET O O 6.803 0.068 -0.617 1.00 . A A . 27 MET O 1 1 15 6726 1 1 27 MET SD S 7.144 6.014 -0.249 1.00 . A A . 27 MET SD 1 1 15 6727 1 1 28 PRO C C 6.790 -1.541 2.110 1.00 . A A . 28 PRO C 1 1 15 6728 1 1 28 PRO CA C 7.661 -0.276 1.998 1.00 . A A . 28 PRO CA 1 1 15 6729 1 1 28 PRO CB C 8.107 0.209 3.380 1.00 . A A . 28 PRO CB 1 1 15 6730 1 1 28 PRO CD C 6.594 1.870 2.512 1.00 . A A . 28 PRO CD 1 1 15 6731 1 1 28 PRO CG C 7.090 1.226 3.778 1.00 . A A . 28 PRO CG 1 1 15 6732 1 1 28 PRO HA H 8.522 -0.465 1.380 1.00 . A A . 28 PRO HA 1 1 15 6733 1 1 28 PRO HB2 H 8.120 -0.614 4.079 1.00 . A A . 28 PRO HB2 1 1 15 6734 1 1 28 PRO HB3 H 9.083 0.671 3.321 1.00 . A A . 28 PRO HB3 1 1 15 6735 1 1 28 PRO HD2 H 5.533 2.062 2.575 1.00 . A A . 28 PRO HD2 1 1 15 6736 1 1 28 PRO HD3 H 7.136 2.784 2.315 1.00 . A A . 28 PRO HD3 1 1 15 6737 1 1 28 PRO HG2 H 6.272 0.744 4.295 1.00 . A A . 28 PRO HG2 1 1 15 6738 1 1 28 PRO HG3 H 7.542 1.971 4.412 1.00 . A A . 28 PRO HG3 1 1 15 6739 1 1 28 PRO N N 6.881 0.881 1.465 1.00 . A A . 28 PRO N 1 1 15 6740 1 1 28 PRO O O 6.489 -2.006 3.197 1.00 . A A . 28 PRO O 1 1 15 6741 1 1 29 ARG C C 6.197 -4.470 1.773 1.00 . A A . 29 ARG C 1 1 15 6742 1 1 29 ARG CA C 5.533 -3.327 0.999 1.00 . A A . 29 ARG CA 1 1 15 6743 1 1 29 ARG CB C 5.338 -3.703 -0.479 1.00 . A A . 29 ARG CB 1 1 15 6744 1 1 29 ARG CD C 6.913 -2.732 -2.174 1.00 . A A . 29 ARG CD 1 1 15 6745 1 1 29 ARG CG C 6.696 -3.873 -1.178 1.00 . A A . 29 ARG CG 1 1 15 6746 1 1 29 ARG CZ C 9.153 -3.406 -2.904 1.00 . A A . 29 ARG CZ 1 1 15 6747 1 1 29 ARG H H 6.656 -1.697 0.139 1.00 . A A . 29 ARG H 1 1 15 6748 1 1 29 ARG HA H 4.578 -3.105 1.442 1.00 . A A . 29 ARG HA 1 1 15 6749 1 1 29 ARG HB2 H 4.782 -4.630 -0.539 1.00 . A A . 29 ARG HB2 1 1 15 6750 1 1 29 ARG HB3 H 4.774 -2.923 -0.973 1.00 . A A . 29 ARG HB3 1 1 15 6751 1 1 29 ARG HD2 H 6.511 -2.993 -3.146 1.00 . A A . 29 ARG HD2 1 1 15 6752 1 1 29 ARG HD3 H 6.455 -1.826 -1.808 1.00 . A A . 29 ARG HD3 1 1 15 6753 1 1 29 ARG HE H 8.813 -1.806 -1.764 1.00 . A A . 29 ARG HE 1 1 15 6754 1 1 29 ARG HG2 H 7.486 -3.857 -0.441 1.00 . A A . 29 ARG HG2 1 1 15 6755 1 1 29 ARG HG3 H 6.714 -4.816 -1.703 1.00 . A A . 29 ARG HG3 1 1 15 6756 1 1 29 ARG HH11 H 7.623 -4.540 -3.531 1.00 . A A . 29 ARG HH11 1 1 15 6757 1 1 29 ARG HH12 H 9.193 -5.055 -4.038 1.00 . A A . 29 ARG HH12 1 1 15 6758 1 1 29 ARG HH21 H 10.870 -2.489 -2.419 1.00 . A A . 29 ARG HH21 1 1 15 6759 1 1 29 ARG HH22 H 11.030 -3.900 -3.410 1.00 . A A . 29 ARG HH22 1 1 15 6760 1 1 29 ARG N N 6.392 -2.097 0.991 1.00 . A A . 29 ARG N 1 1 15 6761 1 1 29 ARG NE N 8.397 -2.558 -2.238 1.00 . A A . 29 ARG NE 1 1 15 6762 1 1 29 ARG NH1 N 8.615 -4.409 -3.543 1.00 . A A . 29 ARG NH1 1 1 15 6763 1 1 29 ARG NH2 N 10.450 -3.251 -2.915 1.00 . A A . 29 ARG NH2 1 1 15 6764 1 1 29 ARG O O 7.367 -4.729 1.547 1.00 . A A . 29 ARG O 1 1 15 6765 1 1 29 ARG OXT O 5.518 -5.070 2.584 1.00 . A A . 29 ARG OXT 1 1 16 6766 1 1 1 GLY C C -10.334 0.069 -4.260 1.00 . A A . 1 GLY C 1 1 16 6767 1 1 1 GLY CA C -11.622 0.057 -5.089 1.00 . A A . 1 GLY CA 1 1 16 6768 1 1 1 GLY H1 H -13.431 0.731 -4.307 1.00 . A A . 1 GLY H1 1 1 16 6769 1 1 1 GLY H2 H -12.478 -0.133 -3.199 1.00 . A A . 1 GLY H2 1 1 16 6770 1 1 1 GLY H3 H -13.315 -0.954 -4.426 1.00 . A A . 1 GLY H3 1 1 16 6771 1 1 1 GLY HA2 H -11.596 -0.771 -5.779 1.00 . A A . 1 GLY HA2 1 1 16 6772 1 1 1 GLY HA3 H -11.702 0.982 -5.641 1.00 . A A . 1 GLY HA3 1 1 16 6773 1 1 1 GLY N N -12.800 -0.086 -4.187 1.00 . A A . 1 GLY N 1 1 16 6774 1 1 1 GLY O O -10.331 -0.293 -3.098 1.00 . A A . 1 GLY O 1 1 16 6775 1 1 2 CYS C C -6.910 1.348 -4.892 1.00 . A A . 2 CYS C 1 1 16 6776 1 1 2 CYS CA C -7.940 0.526 -4.105 1.00 . A A . 2 CYS CA 1 1 16 6777 1 1 2 CYS CB C -7.488 -0.939 -3.981 1.00 . A A . 2 CYS CB 1 1 16 6778 1 1 2 CYS H H -9.273 0.771 -5.789 1.00 . A A . 2 CYS H 1 1 16 6779 1 1 2 CYS HA H -8.086 0.951 -3.125 1.00 . A A . 2 CYS HA 1 1 16 6780 1 1 2 CYS HB2 H -6.487 -0.966 -3.583 1.00 . A A . 2 CYS HB2 1 1 16 6781 1 1 2 CYS HB3 H -8.152 -1.467 -3.311 1.00 . A A . 2 CYS HB3 1 1 16 6782 1 1 2 CYS N N -9.241 0.483 -4.850 1.00 . A A . 2 CYS N 1 1 16 6783 1 1 2 CYS O O -7.163 1.765 -6.006 1.00 . A A . 2 CYS O 1 1 16 6784 1 1 2 CYS SG S -7.502 -1.745 -5.606 1.00 . A A . 2 CYS SG 1 1 16 6785 1 1 3 LYS C C -3.450 1.574 -5.312 1.00 . A A . 3 LYS C 1 1 16 6786 1 1 3 LYS CA C -4.722 2.399 -5.068 1.00 . A A . 3 LYS CA 1 1 16 6787 1 1 3 LYS CB C -4.407 3.606 -4.178 1.00 . A A . 3 LYS CB 1 1 16 6788 1 1 3 LYS CD C -5.361 5.694 -3.178 1.00 . A A . 3 LYS CD 1 1 16 6789 1 1 3 LYS CE C -6.645 6.386 -2.709 1.00 . A A . 3 LYS CE 1 1 16 6790 1 1 3 LYS CG C -5.700 4.318 -3.764 1.00 . A A . 3 LYS CG 1 1 16 6791 1 1 3 LYS H H -5.555 1.260 -3.431 1.00 . A A . 3 LYS H 1 1 16 6792 1 1 3 LYS HA H -5.128 2.739 -6.008 1.00 . A A . 3 LYS HA 1 1 16 6793 1 1 3 LYS HB2 H -3.870 3.281 -3.298 1.00 . A A . 3 LYS HB2 1 1 16 6794 1 1 3 LYS HB3 H -3.792 4.291 -4.734 1.00 . A A . 3 LYS HB3 1 1 16 6795 1 1 3 LYS HD2 H -4.692 5.570 -2.342 1.00 . A A . 3 LYS HD2 1 1 16 6796 1 1 3 LYS HD3 H -4.885 6.300 -3.936 1.00 . A A . 3 LYS HD3 1 1 16 6797 1 1 3 LYS HE2 H -7.332 6.495 -3.538 1.00 . A A . 3 LYS HE2 1 1 16 6798 1 1 3 LYS HE3 H -7.106 5.823 -1.911 1.00 . A A . 3 LYS HE3 1 1 16 6799 1 1 3 LYS HG2 H -6.334 4.442 -4.631 1.00 . A A . 3 LYS HG2 1 1 16 6800 1 1 3 LYS HG3 H -6.216 3.732 -3.021 1.00 . A A . 3 LYS HG3 1 1 16 6801 1 1 3 LYS HZ1 H -7.036 8.252 -1.878 1.00 . A A . 3 LYS HZ1 1 1 16 6802 1 1 3 LYS HZ2 H -5.752 8.249 -2.982 1.00 . A A . 3 LYS HZ2 1 1 16 6803 1 1 3 LYS HZ3 H -5.531 7.604 -1.420 1.00 . A A . 3 LYS HZ3 1 1 16 6804 1 1 3 LYS N N -5.750 1.596 -4.329 1.00 . A A . 3 LYS N 1 1 16 6805 1 1 3 LYS NZ N -6.209 7.721 -2.211 1.00 . A A . 3 LYS NZ 1 1 16 6806 1 1 3 LYS O O -3.353 0.427 -4.911 1.00 . A A . 3 LYS O 1 1 16 6807 1 1 4 LEU C C -0.176 1.668 -5.130 1.00 . A A . 4 LEU C 1 1 16 6808 1 1 4 LEU CA C -1.201 1.424 -6.266 1.00 . A A . 4 LEU CA 1 1 16 6809 1 1 4 LEU CB C -0.736 1.993 -7.627 1.00 . A A . 4 LEU CB 1 1 16 6810 1 1 4 LEU CD1 C -2.894 0.893 -8.394 1.00 . A A . 4 LEU CD1 1 1 16 6811 1 1 4 LEU CD2 C -1.562 2.291 -9.967 1.00 . A A . 4 LEU CD2 1 1 16 6812 1 1 4 LEU CG C -1.473 1.306 -8.797 1.00 . A A . 4 LEU CG 1 1 16 6813 1 1 4 LEU H H -2.592 3.078 -6.285 1.00 . A A . 4 LEU H 1 1 16 6814 1 1 4 LEU HA H -1.392 0.369 -6.362 1.00 . A A . 4 LEU HA 1 1 16 6815 1 1 4 LEU HB2 H -0.938 3.049 -7.658 1.00 . A A . 4 LEU HB2 1 1 16 6816 1 1 4 LEU HB3 H 0.324 1.833 -7.750 1.00 . A A . 4 LEU HB3 1 1 16 6817 1 1 4 LEU HD11 H -3.457 1.769 -8.116 1.00 . A A . 4 LEU HD11 1 1 16 6818 1 1 4 LEU HD12 H -2.850 0.211 -7.556 1.00 . A A . 4 LEU HD12 1 1 16 6819 1 1 4 LEU HD13 H -3.375 0.406 -9.228 1.00 . A A . 4 LEU HD13 1 1 16 6820 1 1 4 LEU HD21 H -1.800 1.759 -10.879 1.00 . A A . 4 LEU HD21 1 1 16 6821 1 1 4 LEU HD22 H -0.615 2.796 -10.083 1.00 . A A . 4 LEU HD22 1 1 16 6822 1 1 4 LEU HD23 H -2.333 3.020 -9.762 1.00 . A A . 4 LEU HD23 1 1 16 6823 1 1 4 LEU HG H -0.918 0.432 -9.105 1.00 . A A . 4 LEU HG 1 1 16 6824 1 1 4 LEU N N -2.480 2.155 -5.973 1.00 . A A . 4 LEU N 1 1 16 6825 1 1 4 LEU O O -0.501 1.507 -3.965 1.00 . A A . 4 LEU O 1 1 16 6826 1 1 5 THR C C 2.066 3.729 -3.921 1.00 . A A . 5 THR C 1 1 16 6827 1 1 5 THR CA C 2.066 2.254 -4.373 1.00 . A A . 5 THR CA 1 1 16 6828 1 1 5 THR CB C 3.405 1.857 -5.027 1.00 . A A . 5 THR CB 1 1 16 6829 1 1 5 THR CG2 C 4.529 1.900 -3.984 1.00 . A A . 5 THR CG2 1 1 16 6830 1 1 5 THR H H 1.306 2.145 -6.371 1.00 . A A . 5 THR H 1 1 16 6831 1 1 5 THR HA H 1.871 1.610 -3.529 1.00 . A A . 5 THR HA 1 1 16 6832 1 1 5 THR HB H 3.633 2.554 -5.814 1.00 . A A . 5 THR HB 1 1 16 6833 1 1 5 THR HG1 H 3.175 -0.091 -4.854 1.00 . A A . 5 THR HG1 1 1 16 6834 1 1 5 THR HG21 H 5.431 1.473 -4.402 1.00 . A A . 5 THR HG21 1 1 16 6835 1 1 5 THR HG22 H 4.236 1.337 -3.115 1.00 . A A . 5 THR HG22 1 1 16 6836 1 1 5 THR HG23 H 4.712 2.928 -3.695 1.00 . A A . 5 THR HG23 1 1 16 6837 1 1 5 THR N N 1.048 2.032 -5.440 1.00 . A A . 5 THR N 1 1 16 6838 1 1 5 THR O O 1.623 4.049 -2.837 1.00 . A A . 5 THR O 1 1 16 6839 1 1 5 THR OG1 O 3.305 0.540 -5.582 1.00 . A A . 5 THR OG1 1 1 16 6840 1 1 6 PHE C C 1.220 6.745 -4.388 1.00 . A A . 6 PHE C 1 1 16 6841 1 1 6 PHE CA C 2.606 6.079 -4.342 1.00 . A A . 6 PHE CA 1 1 16 6842 1 1 6 PHE CB C 3.570 6.739 -5.342 1.00 . A A . 6 PHE CB 1 1 16 6843 1 1 6 PHE CD1 C 5.507 6.051 -3.873 1.00 . A A . 6 PHE CD1 1 1 16 6844 1 1 6 PHE CD2 C 5.462 8.298 -4.782 1.00 . A A . 6 PHE CD2 1 1 16 6845 1 1 6 PHE CE1 C 6.719 6.334 -3.235 1.00 . A A . 6 PHE CE1 1 1 16 6846 1 1 6 PHE CE2 C 6.672 8.581 -4.147 1.00 . A A . 6 PHE CE2 1 1 16 6847 1 1 6 PHE CG C 4.877 7.037 -4.648 1.00 . A A . 6 PHE CG 1 1 16 6848 1 1 6 PHE CZ C 7.305 7.600 -3.372 1.00 . A A . 6 PHE CZ 1 1 16 6849 1 1 6 PHE H H 2.914 4.354 -5.600 1.00 . A A . 6 PHE H 1 1 16 6850 1 1 6 PHE HA H 3.015 6.169 -3.349 1.00 . A A . 6 PHE HA 1 1 16 6851 1 1 6 PHE HB2 H 3.750 6.074 -6.171 1.00 . A A . 6 PHE HB2 1 1 16 6852 1 1 6 PHE HB3 H 3.144 7.667 -5.711 1.00 . A A . 6 PHE HB3 1 1 16 6853 1 1 6 PHE HD1 H 5.057 5.076 -3.761 1.00 . A A . 6 PHE HD1 1 1 16 6854 1 1 6 PHE HD2 H 4.978 9.058 -5.376 1.00 . A A . 6 PHE HD2 1 1 16 6855 1 1 6 PHE HE1 H 7.199 5.573 -2.637 1.00 . A A . 6 PHE HE1 1 1 16 6856 1 1 6 PHE HE2 H 7.116 9.556 -4.259 1.00 . A A . 6 PHE HE2 1 1 16 6857 1 1 6 PHE HZ H 8.243 7.819 -2.882 1.00 . A A . 6 PHE HZ 1 1 16 6858 1 1 6 PHE N N 2.562 4.629 -4.737 1.00 . A A . 6 PHE N 1 1 16 6859 1 1 6 PHE O O 1.088 7.898 -4.765 1.00 . A A . 6 PHE O 1 1 16 6860 1 1 7 TRP C C -1.527 6.972 -2.490 1.00 . A A . 7 TRP C 1 1 16 6861 1 1 7 TRP CA C -1.162 6.665 -3.941 1.00 . A A . 7 TRP CA 1 1 16 6862 1 1 7 TRP CB C -2.094 5.603 -4.519 1.00 . A A . 7 TRP CB 1 1 16 6863 1 1 7 TRP CD1 C -0.695 5.315 -6.595 1.00 . A A . 7 TRP CD1 1 1 16 6864 1 1 7 TRP CD2 C -2.884 5.544 -7.049 1.00 . A A . 7 TRP CD2 1 1 16 6865 1 1 7 TRP CE2 C -2.221 5.396 -8.290 1.00 . A A . 7 TRP CE2 1 1 16 6866 1 1 7 TRP CE3 C -4.285 5.696 -7.057 1.00 . A A . 7 TRP CE3 1 1 16 6867 1 1 7 TRP CG C -1.889 5.496 -5.990 1.00 . A A . 7 TRP CG 1 1 16 6868 1 1 7 TRP CH2 C -4.309 5.559 -9.488 1.00 . A A . 7 TRP CH2 1 1 16 6869 1 1 7 TRP CZ2 C -2.919 5.410 -9.496 1.00 . A A . 7 TRP CZ2 1 1 16 6870 1 1 7 TRP CZ3 C -4.990 5.706 -8.270 1.00 . A A . 7 TRP CZ3 1 1 16 6871 1 1 7 TRP H H 0.308 5.145 -3.633 1.00 . A A . 7 TRP H 1 1 16 6872 1 1 7 TRP HA H -1.189 7.558 -4.543 1.00 . A A . 7 TRP HA 1 1 16 6873 1 1 7 TRP HB2 H -1.886 4.649 -4.060 1.00 . A A . 7 TRP HB2 1 1 16 6874 1 1 7 TRP HB3 H -3.113 5.884 -4.320 1.00 . A A . 7 TRP HB3 1 1 16 6875 1 1 7 TRP HD1 H 0.260 5.234 -6.091 1.00 . A A . 7 TRP HD1 1 1 16 6876 1 1 7 TRP HE1 H -0.179 5.149 -8.621 1.00 . A A . 7 TRP HE1 1 1 16 6877 1 1 7 TRP HE3 H -4.823 5.806 -6.125 1.00 . A A . 7 TRP HE3 1 1 16 6878 1 1 7 TRP HH2 H -4.859 5.566 -10.419 1.00 . A A . 7 TRP HH2 1 1 16 6879 1 1 7 TRP HZ2 H -2.390 5.295 -10.432 1.00 . A A . 7 TRP HZ2 1 1 16 6880 1 1 7 TRP HZ3 H -6.065 5.822 -8.268 1.00 . A A . 7 TRP HZ3 1 1 16 6881 1 1 7 TRP N N 0.190 6.056 -3.965 1.00 . A A . 7 TRP N 1 1 16 6882 1 1 7 TRP NE1 N -0.887 5.267 -7.957 1.00 . A A . 7 TRP NE1 1 1 16 6883 1 1 7 TRP O O -1.475 6.098 -1.644 1.00 . A A . 7 TRP O 1 1 16 6884 1 1 8 LYS C C -3.200 7.555 -0.209 1.00 . A A . 8 LYS C 1 1 16 6885 1 1 8 LYS CA C -2.219 8.577 -0.792 1.00 . A A . 8 LYS CA 1 1 16 6886 1 1 8 LYS CB C -2.848 9.972 -0.922 1.00 . A A . 8 LYS CB 1 1 16 6887 1 1 8 LYS CD C -5.115 10.583 -0.086 1.00 . A A . 8 LYS CD 1 1 16 6888 1 1 8 LYS CE C -5.491 12.043 0.213 1.00 . A A . 8 LYS CE 1 1 16 6889 1 1 8 LYS CG C -3.661 10.327 0.327 1.00 . A A . 8 LYS CG 1 1 16 6890 1 1 8 LYS H H -1.893 8.885 -2.892 1.00 . A A . 8 LYS H 1 1 16 6891 1 1 8 LYS HA H -1.326 8.633 -0.188 1.00 . A A . 8 LYS HA 1 1 16 6892 1 1 8 LYS HB2 H -2.061 10.700 -1.053 1.00 . A A . 8 LYS HB2 1 1 16 6893 1 1 8 LYS HB3 H -3.496 9.989 -1.785 1.00 . A A . 8 LYS HB3 1 1 16 6894 1 1 8 LYS HD2 H -5.222 10.386 -1.146 1.00 . A A . 8 LYS HD2 1 1 16 6895 1 1 8 LYS HD3 H -5.767 9.923 0.468 1.00 . A A . 8 LYS HD3 1 1 16 6896 1 1 8 LYS HE2 H -6.345 12.081 0.878 1.00 . A A . 8 LYS HE2 1 1 16 6897 1 1 8 LYS HE3 H -4.653 12.562 0.651 1.00 . A A . 8 LYS HE3 1 1 16 6898 1 1 8 LYS HG2 H -3.620 9.509 1.032 1.00 . A A . 8 LYS HG2 1 1 16 6899 1 1 8 LYS HG3 H -3.252 11.217 0.784 1.00 . A A . 8 LYS HG3 1 1 16 6900 1 1 8 LYS HZ1 H -5.082 12.437 -1.795 1.00 . A A . 8 LYS HZ1 1 1 16 6901 1 1 8 LYS HZ2 H -5.922 13.681 -1.008 1.00 . A A . 8 LYS HZ2 1 1 16 6902 1 1 8 LYS HZ3 H -6.734 12.258 -1.456 1.00 . A A . 8 LYS HZ3 1 1 16 6903 1 1 8 LYS N N -1.872 8.201 -2.193 1.00 . A A . 8 LYS N 1 1 16 6904 1 1 8 LYS NZ N -5.833 12.648 -1.110 1.00 . A A . 8 LYS NZ 1 1 16 6905 1 1 8 LYS O O -4.390 7.592 -0.489 1.00 . A A . 8 LYS O 1 1 16 6906 1 1 9 CYS C C -3.679 5.689 2.691 1.00 . A A . 9 CYS C 1 1 16 6907 1 1 9 CYS CA C -3.603 5.580 1.158 1.00 . A A . 9 CYS CA 1 1 16 6908 1 1 9 CYS CB C -2.996 4.225 0.753 1.00 . A A . 9 CYS CB 1 1 16 6909 1 1 9 CYS H H -1.728 6.610 0.750 1.00 . A A . 9 CYS H 1 1 16 6910 1 1 9 CYS HA H -4.590 5.671 0.732 1.00 . A A . 9 CYS HA 1 1 16 6911 1 1 9 CYS HB2 H -3.512 3.439 1.282 1.00 . A A . 9 CYS HB2 1 1 16 6912 1 1 9 CYS HB3 H -3.123 4.076 -0.308 1.00 . A A . 9 CYS HB3 1 1 16 6913 1 1 9 CYS N N -2.701 6.627 0.571 1.00 . A A . 9 CYS N 1 1 16 6914 1 1 9 CYS O O -3.058 6.537 3.297 1.00 . A A . 9 CYS O 1 1 16 6915 1 1 9 CYS SG S -1.230 4.154 1.166 1.00 . A A . 9 CYS SG 1 1 16 6916 1 1 10 LYS C C -4.147 3.491 5.373 1.00 . A A . 10 LYS C 1 1 16 6917 1 1 10 LYS CA C -4.569 4.850 4.804 1.00 . A A . 10 LYS CA 1 1 16 6918 1 1 10 LYS CB C -6.056 5.095 5.072 1.00 . A A . 10 LYS CB 1 1 16 6919 1 1 10 LYS CD C -6.861 6.732 3.346 1.00 . A A . 10 LYS CD 1 1 16 6920 1 1 10 LYS CE C -8.344 7.124 3.315 1.00 . A A . 10 LYS CE 1 1 16 6921 1 1 10 LYS CG C -6.400 6.564 4.799 1.00 . A A . 10 LYS CG 1 1 16 6922 1 1 10 LYS H H -4.944 4.147 2.796 1.00 . A A . 10 LYS H 1 1 16 6923 1 1 10 LYS HA H -3.972 5.645 5.232 1.00 . A A . 10 LYS HA 1 1 16 6924 1 1 10 LYS HB2 H -6.642 4.458 4.426 1.00 . A A . 10 LYS HB2 1 1 16 6925 1 1 10 LYS HB3 H -6.280 4.861 6.105 1.00 . A A . 10 LYS HB3 1 1 16 6926 1 1 10 LYS HD2 H -6.271 7.508 2.873 1.00 . A A . 10 LYS HD2 1 1 16 6927 1 1 10 LYS HD3 H -6.723 5.803 2.811 1.00 . A A . 10 LYS HD3 1 1 16 6928 1 1 10 LYS HE2 H -8.536 7.910 4.035 1.00 . A A . 10 LYS HE2 1 1 16 6929 1 1 10 LYS HE3 H -8.625 7.448 2.324 1.00 . A A . 10 LYS HE3 1 1 16 6930 1 1 10 LYS HG2 H -7.189 6.874 5.466 1.00 . A A . 10 LYS HG2 1 1 16 6931 1 1 10 LYS HG3 H -5.525 7.173 4.971 1.00 . A A . 10 LYS HG3 1 1 16 6932 1 1 10 LYS HZ1 H -8.771 5.092 3.088 1.00 . A A . 10 LYS HZ1 1 1 16 6933 1 1 10 LYS HZ2 H -10.108 6.045 3.522 1.00 . A A . 10 LYS HZ2 1 1 16 6934 1 1 10 LYS HZ3 H -8.928 5.661 4.681 1.00 . A A . 10 LYS HZ3 1 1 16 6935 1 1 10 LYS N N -4.443 4.824 3.314 1.00 . A A . 10 LYS N 1 1 16 6936 1 1 10 LYS NZ N -9.092 5.887 3.678 1.00 . A A . 10 LYS NZ 1 1 16 6937 1 1 10 LYS O O -3.377 3.409 6.313 1.00 . A A . 10 LYS O 1 1 16 6938 1 1 11 ASN C C -3.362 0.369 4.271 1.00 . A A . 11 ASN C 1 1 16 6939 1 1 11 ASN CA C -4.283 1.060 5.294 1.00 . A A . 11 ASN CA 1 1 16 6940 1 1 11 ASN CB C -5.625 0.333 5.437 1.00 . A A . 11 ASN CB 1 1 16 6941 1 1 11 ASN CG C -5.452 -1.185 5.261 1.00 . A A . 11 ASN CG 1 1 16 6942 1 1 11 ASN H H -5.260 2.515 4.048 1.00 . A A . 11 ASN H 1 1 16 6943 1 1 11 ASN HA H -3.797 1.128 6.254 1.00 . A A . 11 ASN HA 1 1 16 6944 1 1 11 ASN HB2 H -6.033 0.533 6.417 1.00 . A A . 11 ASN HB2 1 1 16 6945 1 1 11 ASN HB3 H -6.307 0.705 4.686 1.00 . A A . 11 ASN HB3 1 1 16 6946 1 1 11 ASN HD21 H -7.022 -1.344 4.077 1.00 . A A . 11 ASN HD21 1 1 16 6947 1 1 11 ASN HD22 H -6.205 -2.791 4.396 1.00 . A A . 11 ASN HD22 1 1 16 6948 1 1 11 ASN N N -4.646 2.423 4.803 1.00 . A A . 11 ASN N 1 1 16 6949 1 1 11 ASN ND2 N -6.293 -1.826 4.514 1.00 . A A . 11 ASN ND2 1 1 16 6950 1 1 11 ASN O O -3.412 0.643 3.088 1.00 . A A . 11 ASN O 1 1 16 6951 1 1 11 ASN OD1 O -4.549 -1.788 5.803 1.00 . A A . 11 ASN OD1 1 1 16 6952 1 1 12 LYS C C -2.373 -2.202 2.875 1.00 . A A . 12 LYS C 1 1 16 6953 1 1 12 LYS CA C -1.597 -1.232 3.783 1.00 . A A . 12 LYS CA 1 1 16 6954 1 1 12 LYS CB C -0.591 -1.982 4.674 1.00 . A A . 12 LYS CB 1 1 16 6955 1 1 12 LYS CD C -0.296 -3.866 6.296 1.00 . A A . 12 LYS CD 1 1 16 6956 1 1 12 LYS CE C -0.168 -3.608 7.805 1.00 . A A . 12 LYS CE 1 1 16 6957 1 1 12 LYS CG C -1.312 -2.896 5.675 1.00 . A A . 12 LYS CG 1 1 16 6958 1 1 12 LYS H H -2.499 -0.725 5.670 1.00 . A A . 12 LYS H 1 1 16 6959 1 1 12 LYS HA H -1.070 -0.512 3.175 1.00 . A A . 12 LYS HA 1 1 16 6960 1 1 12 LYS HB2 H 0.055 -2.577 4.054 1.00 . A A . 12 LYS HB2 1 1 16 6961 1 1 12 LYS HB3 H 0.009 -1.264 5.218 1.00 . A A . 12 LYS HB3 1 1 16 6962 1 1 12 LYS HD2 H -0.632 -4.882 6.135 1.00 . A A . 12 LYS HD2 1 1 16 6963 1 1 12 LYS HD3 H 0.668 -3.733 5.824 1.00 . A A . 12 LYS HD3 1 1 16 6964 1 1 12 LYS HE2 H -0.810 -2.791 8.099 1.00 . A A . 12 LYS HE2 1 1 16 6965 1 1 12 LYS HE3 H -0.421 -4.502 8.359 1.00 . A A . 12 LYS HE3 1 1 16 6966 1 1 12 LYS HG2 H -1.763 -2.296 6.451 1.00 . A A . 12 LYS HG2 1 1 16 6967 1 1 12 LYS HG3 H -2.075 -3.461 5.163 1.00 . A A . 12 LYS HG3 1 1 16 6968 1 1 12 LYS HZ1 H 1.873 -3.933 7.528 1.00 . A A . 12 LYS HZ1 1 1 16 6969 1 1 12 LYS HZ2 H 1.471 -3.304 9.052 1.00 . A A . 12 LYS HZ2 1 1 16 6970 1 1 12 LYS HZ3 H 1.451 -2.298 7.686 1.00 . A A . 12 LYS HZ3 1 1 16 6971 1 1 12 LYS N N -2.520 -0.522 4.721 1.00 . A A . 12 LYS N 1 1 16 6972 1 1 12 LYS NZ N 1.263 -3.259 8.033 1.00 . A A . 12 LYS NZ 1 1 16 6973 1 1 12 LYS O O -2.085 -2.325 1.698 1.00 . A A . 12 LYS O 1 1 16 6974 1 1 13 LYS C C -5.198 -3.037 1.700 1.00 . A A . 13 LYS C 1 1 16 6975 1 1 13 LYS CA C -4.154 -3.813 2.536 1.00 . A A . 13 LYS CA 1 1 16 6976 1 1 13 LYS CB C -4.828 -4.797 3.499 1.00 . A A . 13 LYS CB 1 1 16 6977 1 1 13 LYS CD C -4.417 -6.863 4.867 1.00 . A A . 13 LYS CD 1 1 16 6978 1 1 13 LYS CE C -4.407 -8.357 4.512 1.00 . A A . 13 LYS CE 1 1 16 6979 1 1 13 LYS CG C -3.947 -6.047 3.657 1.00 . A A . 13 LYS CG 1 1 16 6980 1 1 13 LYS H H -3.604 -2.745 4.338 1.00 . A A . 13 LYS H 1 1 16 6981 1 1 13 LYS HA H -3.486 -4.348 1.879 1.00 . A A . 13 LYS HA 1 1 16 6982 1 1 13 LYS HB2 H -4.964 -4.325 4.463 1.00 . A A . 13 LYS HB2 1 1 16 6983 1 1 13 LYS HB3 H -5.788 -5.087 3.101 1.00 . A A . 13 LYS HB3 1 1 16 6984 1 1 13 LYS HD2 H -3.755 -6.680 5.704 1.00 . A A . 13 LYS HD2 1 1 16 6985 1 1 13 LYS HD3 H -5.421 -6.565 5.133 1.00 . A A . 13 LYS HD3 1 1 16 6986 1 1 13 LYS HE2 H -5.418 -8.739 4.475 1.00 . A A . 13 LYS HE2 1 1 16 6987 1 1 13 LYS HE3 H -3.910 -8.516 3.565 1.00 . A A . 13 LYS HE3 1 1 16 6988 1 1 13 LYS HG2 H -4.022 -6.653 2.769 1.00 . A A . 13 LYS HG2 1 1 16 6989 1 1 13 LYS HG3 H -2.918 -5.748 3.806 1.00 . A A . 13 LYS HG3 1 1 16 6990 1 1 13 LYS HZ1 H -3.741 -10.053 5.516 1.00 . A A . 13 LYS HZ1 1 1 16 6991 1 1 13 LYS HZ2 H -4.018 -8.720 6.527 1.00 . A A . 13 LYS HZ2 1 1 16 6992 1 1 13 LYS HZ3 H -2.634 -8.769 5.538 1.00 . A A . 13 LYS HZ3 1 1 16 6993 1 1 13 LYS N N -3.366 -2.872 3.395 1.00 . A A . 13 LYS N 1 1 16 6994 1 1 13 LYS NZ N -3.641 -9.022 5.606 1.00 . A A . 13 LYS NZ 1 1 16 6995 1 1 13 LYS O O -6.000 -3.621 1.002 1.00 . A A . 13 LYS O 1 1 16 6996 1 1 14 GLU C C -5.652 -0.755 -0.484 1.00 . A A . 14 GLU C 1 1 16 6997 1 1 14 GLU CA C -6.145 -0.900 0.963 1.00 . A A . 14 GLU CA 1 1 16 6998 1 1 14 GLU CB C -6.160 0.463 1.675 1.00 . A A . 14 GLU CB 1 1 16 6999 1 1 14 GLU CD C -7.175 2.754 1.647 1.00 . A A . 14 GLU CD 1 1 16 7000 1 1 14 GLU CG C -6.956 1.466 0.843 1.00 . A A . 14 GLU CG 1 1 16 7001 1 1 14 GLU H H -4.518 -1.271 2.321 1.00 . A A . 14 GLU H 1 1 16 7002 1 1 14 GLU HA H -7.127 -1.335 0.984 1.00 . A A . 14 GLU HA 1 1 16 7003 1 1 14 GLU HB2 H -6.624 0.357 2.647 1.00 . A A . 14 GLU HB2 1 1 16 7004 1 1 14 GLU HB3 H -5.149 0.822 1.799 1.00 . A A . 14 GLU HB3 1 1 16 7005 1 1 14 GLU HG2 H -6.416 1.692 -0.068 1.00 . A A . 14 GLU HG2 1 1 16 7006 1 1 14 GLU HG3 H -7.906 1.029 0.595 1.00 . A A . 14 GLU HG3 1 1 16 7007 1 1 14 GLU N N -5.179 -1.723 1.759 1.00 . A A . 14 GLU N 1 1 16 7008 1 1 14 GLU O O -6.432 -0.559 -1.397 1.00 . A A . 14 GLU O 1 1 16 7009 1 1 14 GLU OE1 O -6.209 3.462 1.865 1.00 . A A . 14 GLU OE1 1 1 16 7010 1 1 14 GLU OE2 O -8.304 3.007 2.032 1.00 . A A . 14 GLU OE2 1 1 16 7011 1 1 15 CYS C C -4.091 -1.994 -2.894 1.00 . A A . 15 CYS C 1 1 16 7012 1 1 15 CYS CA C -3.825 -0.714 -2.089 1.00 . A A . 15 CYS CA 1 1 16 7013 1 1 15 CYS CB C -2.315 -0.481 -1.920 1.00 . A A . 15 CYS CB 1 1 16 7014 1 1 15 CYS H H -3.756 -1.009 0.053 1.00 . A A . 15 CYS H 1 1 16 7015 1 1 15 CYS HA H -4.279 0.135 -2.577 1.00 . A A . 15 CYS HA 1 1 16 7016 1 1 15 CYS HB2 H -1.911 -1.191 -1.214 1.00 . A A . 15 CYS HB2 1 1 16 7017 1 1 15 CYS HB3 H -1.823 -0.600 -2.875 1.00 . A A . 15 CYS HB3 1 1 16 7018 1 1 15 CYS N N -4.366 -0.849 -0.699 1.00 . A A . 15 CYS N 1 1 16 7019 1 1 15 CYS O O -4.147 -3.075 -2.348 1.00 . A A . 15 CYS O 1 1 16 7020 1 1 15 CYS SG S -2.043 1.208 -1.310 1.00 . A A . 15 CYS SG 1 1 16 7021 1 1 16 CYS C C -3.271 -4.031 -4.947 1.00 . A A . 16 CYS C 1 1 16 7022 1 1 16 CYS CA C -4.494 -3.117 -5.016 1.00 . A A . 16 CYS CA 1 1 16 7023 1 1 16 CYS CB C -4.726 -2.633 -6.454 1.00 . A A . 16 CYS CB 1 1 16 7024 1 1 16 CYS H H -4.190 -1.001 -4.621 1.00 . A A . 16 CYS H 1 1 16 7025 1 1 16 CYS HA H -5.366 -3.638 -4.657 1.00 . A A . 16 CYS HA 1 1 16 7026 1 1 16 CYS HB2 H -3.777 -2.404 -6.914 1.00 . A A . 16 CYS HB2 1 1 16 7027 1 1 16 CYS HB3 H -5.209 -3.423 -7.017 1.00 . A A . 16 CYS HB3 1 1 16 7028 1 1 16 CYS N N -4.246 -1.887 -4.190 1.00 . A A . 16 CYS N 1 1 16 7029 1 1 16 CYS O O -3.353 -5.147 -4.469 1.00 . A A . 16 CYS O 1 1 16 7030 1 1 16 CYS SG S -5.778 -1.159 -6.466 1.00 . A A . 16 CYS SG 1 1 16 7031 1 1 17 GLY C C -0.399 -4.330 -3.894 1.00 . A A . 17 GLY C 1 1 16 7032 1 1 17 GLY CA C -0.909 -4.394 -5.331 1.00 . A A . 17 GLY CA 1 1 16 7033 1 1 17 GLY H H -2.096 -2.653 -5.762 1.00 . A A . 17 GLY H 1 1 16 7034 1 1 17 GLY HA2 H -1.140 -5.418 -5.595 1.00 . A A . 17 GLY HA2 1 1 16 7035 1 1 17 GLY HA3 H -0.155 -4.004 -5.996 1.00 . A A . 17 GLY HA3 1 1 16 7036 1 1 17 GLY N N -2.138 -3.560 -5.398 1.00 . A A . 17 GLY N 1 1 16 7037 1 1 17 GLY O O 0.176 -3.343 -3.492 1.00 . A A . 17 GLY O 1 1 16 7038 1 1 18 TRP C C 0.965 -4.469 -1.395 1.00 . A A . 18 TRP C 1 1 16 7039 1 1 18 TRP CA C -0.229 -5.392 -1.671 1.00 . A A . 18 TRP CA 1 1 16 7040 1 1 18 TRP CB C 0.130 -6.852 -1.396 1.00 . A A . 18 TRP CB 1 1 16 7041 1 1 18 TRP CD1 C -2.163 -7.299 -0.406 1.00 . A A . 18 TRP CD1 1 1 16 7042 1 1 18 TRP CD2 C -1.518 -8.892 -1.864 1.00 . A A . 18 TRP CD2 1 1 16 7043 1 1 18 TRP CE2 C -2.799 -9.264 -1.394 1.00 . A A . 18 TRP CE2 1 1 16 7044 1 1 18 TRP CE3 C -0.883 -9.733 -2.802 1.00 . A A . 18 TRP CE3 1 1 16 7045 1 1 18 TRP CG C -1.131 -7.641 -1.220 1.00 . A A . 18 TRP CG 1 1 16 7046 1 1 18 TRP CH2 C -2.785 -11.251 -2.768 1.00 . A A . 18 TRP CH2 1 1 16 7047 1 1 18 TRP CZ2 C -3.429 -10.428 -1.838 1.00 . A A . 18 TRP CZ2 1 1 16 7048 1 1 18 TRP CZ3 C -1.516 -10.907 -3.249 1.00 . A A . 18 TRP CZ3 1 1 16 7049 1 1 18 TRP H H -1.155 -6.117 -3.486 1.00 . A A . 18 TRP H 1 1 16 7050 1 1 18 TRP HA H -1.057 -5.107 -1.046 1.00 . A A . 18 TRP HA 1 1 16 7051 1 1 18 TRP HB2 H 0.692 -7.247 -2.230 1.00 . A A . 18 TRP HB2 1 1 16 7052 1 1 18 TRP HB3 H 0.730 -6.912 -0.498 1.00 . A A . 18 TRP HB3 1 1 16 7053 1 1 18 TRP HD1 H -2.204 -6.415 0.218 1.00 . A A . 18 TRP HD1 1 1 16 7054 1 1 18 TRP HE1 H -4.008 -8.251 -0.022 1.00 . A A . 18 TRP HE1 1 1 16 7055 1 1 18 TRP HE3 H 0.095 -9.475 -3.181 1.00 . A A . 18 TRP HE3 1 1 16 7056 1 1 18 TRP HH2 H -3.268 -12.153 -3.115 1.00 . A A . 18 TRP HH2 1 1 16 7057 1 1 18 TRP HZ2 H -4.407 -10.689 -1.461 1.00 . A A . 18 TRP HZ2 1 1 16 7058 1 1 18 TRP HZ3 H -1.024 -11.547 -3.970 1.00 . A A . 18 TRP HZ3 1 1 16 7059 1 1 18 TRP N N -0.652 -5.360 -3.118 1.00 . A A . 18 TRP N 1 1 16 7060 1 1 18 TRP NE1 N -3.153 -8.261 -0.508 1.00 . A A . 18 TRP NE1 1 1 16 7061 1 1 18 TRP O O 2.114 -4.808 -1.624 1.00 . A A . 18 TRP O 1 1 16 7062 1 1 19 ASN C C 1.512 -1.721 0.787 1.00 . A A . 19 ASN C 1 1 16 7063 1 1 19 ASN CA C 1.749 -2.302 -0.607 1.00 . A A . 19 ASN CA 1 1 16 7064 1 1 19 ASN CB C 1.580 -1.222 -1.678 1.00 . A A . 19 ASN CB 1 1 16 7065 1 1 19 ASN CG C 2.934 -0.850 -2.285 1.00 . A A . 19 ASN CG 1 1 16 7066 1 1 19 ASN H H -0.257 -3.060 -0.746 1.00 . A A . 19 ASN H 1 1 16 7067 1 1 19 ASN HA H 2.724 -2.756 -0.677 1.00 . A A . 19 ASN HA 1 1 16 7068 1 1 19 ASN HB2 H 0.933 -1.598 -2.455 1.00 . A A . 19 ASN HB2 1 1 16 7069 1 1 19 ASN HB3 H 1.129 -0.351 -1.233 1.00 . A A . 19 ASN HB3 1 1 16 7070 1 1 19 ASN HD21 H 3.755 -0.368 -0.554 1.00 . A A . 19 ASN HD21 1 1 16 7071 1 1 19 ASN HD22 H 4.758 -0.196 -1.910 1.00 . A A . 19 ASN HD22 1 1 16 7072 1 1 19 ASN N N 0.679 -3.294 -0.910 1.00 . A A . 19 ASN N 1 1 16 7073 1 1 19 ASN ND2 N 3.893 -0.439 -1.518 1.00 . A A . 19 ASN ND2 1 1 16 7074 1 1 19 ASN O O 0.391 -1.433 1.162 1.00 . A A . 19 ASN O 1 1 16 7075 1 1 19 ASN OD1 O 3.113 -0.925 -3.483 1.00 . A A . 19 ASN OD1 1 1 16 7076 1 1 20 ALA C C 2.163 0.520 2.908 1.00 . A A . 20 ALA C 1 1 16 7077 1 1 20 ALA CA C 2.344 -1.001 2.939 1.00 . A A . 20 ALA CA 1 1 16 7078 1 1 20 ALA CB C 3.616 -1.365 3.696 1.00 . A A . 20 ALA CB 1 1 16 7079 1 1 20 ALA H H 3.439 -1.796 1.254 1.00 . A A . 20 ALA H 1 1 16 7080 1 1 20 ALA HA H 1.496 -1.468 3.412 1.00 . A A . 20 ALA HA 1 1 16 7081 1 1 20 ALA HB1 H 3.850 -0.590 4.413 1.00 . A A . 20 ALA HB1 1 1 16 7082 1 1 20 ALA HB2 H 4.428 -1.460 2.995 1.00 . A A . 20 ALA HB2 1 1 16 7083 1 1 20 ALA HB3 H 3.475 -2.305 4.211 1.00 . A A . 20 ALA HB3 1 1 16 7084 1 1 20 ALA N N 2.540 -1.554 1.562 1.00 . A A . 20 ALA N 1 1 16 7085 1 1 20 ALA O O 3.010 1.246 2.420 1.00 . A A . 20 ALA O 1 1 16 7086 1 1 21 CYS C C 1.691 3.050 4.657 1.00 . A A . 21 CYS C 1 1 16 7087 1 1 21 CYS CA C 0.865 2.488 3.500 1.00 . A A . 21 CYS CA 1 1 16 7088 1 1 21 CYS CB C -0.633 2.670 3.749 1.00 . A A . 21 CYS CB 1 1 16 7089 1 1 21 CYS H H 0.434 0.405 3.869 1.00 . A A . 21 CYS H 1 1 16 7090 1 1 21 CYS HA H 1.152 2.940 2.567 1.00 . A A . 21 CYS HA 1 1 16 7091 1 1 21 CYS HB2 H -1.183 1.908 3.210 1.00 . A A . 21 CYS HB2 1 1 16 7092 1 1 21 CYS HB3 H -0.836 2.578 4.806 1.00 . A A . 21 CYS HB3 1 1 16 7093 1 1 21 CYS N N 1.084 1.008 3.458 1.00 . A A . 21 CYS N 1 1 16 7094 1 1 21 CYS O O 1.310 2.934 5.808 1.00 . A A . 21 CYS O 1 1 16 7095 1 1 21 CYS SG S -1.147 4.307 3.184 1.00 . A A . 21 CYS SG 1 1 16 7096 1 1 22 ALA C C 3.967 5.629 5.351 1.00 . A A . 22 ALA C 1 1 16 7097 1 1 22 ALA CA C 3.714 4.125 5.471 1.00 . A A . 22 ALA CA 1 1 16 7098 1 1 22 ALA CB C 5.025 3.349 5.316 1.00 . A A . 22 ALA CB 1 1 16 7099 1 1 22 ALA H H 3.143 3.659 3.442 1.00 . A A . 22 ALA H 1 1 16 7100 1 1 22 ALA HA H 3.281 3.903 6.430 1.00 . A A . 22 ALA HA 1 1 16 7101 1 1 22 ALA HB1 H 4.879 2.325 5.632 1.00 . A A . 22 ALA HB1 1 1 16 7102 1 1 22 ALA HB2 H 5.791 3.805 5.924 1.00 . A A . 22 ALA HB2 1 1 16 7103 1 1 22 ALA HB3 H 5.336 3.363 4.276 1.00 . A A . 22 ALA HB3 1 1 16 7104 1 1 22 ALA N N 2.842 3.608 4.372 1.00 . A A . 22 ALA N 1 1 16 7105 1 1 22 ALA O O 3.416 6.420 6.096 1.00 . A A . 22 ALA O 1 1 16 7106 1 1 23 LEU C C 3.962 8.243 3.628 1.00 . A A . 23 LEU C 1 1 16 7107 1 1 23 LEU CA C 5.135 7.490 4.289 1.00 . A A . 23 LEU CA 1 1 16 7108 1 1 23 LEU CB C 6.379 7.520 3.384 1.00 . A A . 23 LEU CB 1 1 16 7109 1 1 23 LEU CD1 C 7.369 6.327 5.403 1.00 . A A . 23 LEU CD1 1 1 16 7110 1 1 23 LEU CD2 C 8.633 6.425 3.259 1.00 . A A . 23 LEU CD2 1 1 16 7111 1 1 23 LEU CG C 7.669 7.190 4.172 1.00 . A A . 23 LEU CG 1 1 16 7112 1 1 23 LEU H H 5.261 5.379 3.867 1.00 . A A . 23 LEU H 1 1 16 7113 1 1 23 LEU HA H 5.367 7.928 5.246 1.00 . A A . 23 LEU HA 1 1 16 7114 1 1 23 LEU HB2 H 6.253 6.796 2.589 1.00 . A A . 23 LEU HB2 1 1 16 7115 1 1 23 LEU HB3 H 6.475 8.503 2.948 1.00 . A A . 23 LEU HB3 1 1 16 7116 1 1 23 LEU HD11 H 6.625 6.815 6.015 1.00 . A A . 23 LEU HD11 1 1 16 7117 1 1 23 LEU HD12 H 8.274 6.195 5.974 1.00 . A A . 23 LEU HD12 1 1 16 7118 1 1 23 LEU HD13 H 7.000 5.361 5.088 1.00 . A A . 23 LEU HD13 1 1 16 7119 1 1 23 LEU HD21 H 8.481 5.360 3.380 1.00 . A A . 23 LEU HD21 1 1 16 7120 1 1 23 LEU HD22 H 9.649 6.675 3.520 1.00 . A A . 23 LEU HD22 1 1 16 7121 1 1 23 LEU HD23 H 8.449 6.698 2.230 1.00 . A A . 23 LEU HD23 1 1 16 7122 1 1 23 LEU HG H 8.135 8.108 4.486 1.00 . A A . 23 LEU HG 1 1 16 7123 1 1 23 LEU N N 4.815 6.034 4.441 1.00 . A A . 23 LEU N 1 1 16 7124 1 1 23 LEU O O 4.132 8.899 2.623 1.00 . A A . 23 LEU O 1 1 16 7125 1 1 24 GLY C C 1.169 8.154 2.295 1.00 . A A . 24 GLY C 1 1 16 7126 1 1 24 GLY CA C 1.602 8.855 3.585 1.00 . A A . 24 GLY CA 1 1 16 7127 1 1 24 GLY H H 2.662 7.615 4.999 1.00 . A A . 24 GLY H 1 1 16 7128 1 1 24 GLY HA2 H 0.782 8.845 4.285 1.00 . A A . 24 GLY HA2 1 1 16 7129 1 1 24 GLY HA3 H 1.873 9.876 3.361 1.00 . A A . 24 GLY HA3 1 1 16 7130 1 1 24 GLY N N 2.779 8.150 4.186 1.00 . A A . 24 GLY N 1 1 16 7131 1 1 24 GLY O O 0.244 8.586 1.624 1.00 . A A . 24 GLY O 1 1 16 7132 1 1 25 ILE C C 1.777 4.848 0.835 1.00 . A A . 25 ILE C 1 1 16 7133 1 1 25 ILE CA C 1.438 6.334 0.688 1.00 . A A . 25 ILE CA 1 1 16 7134 1 1 25 ILE CB C 2.277 6.914 -0.459 1.00 . A A . 25 ILE CB 1 1 16 7135 1 1 25 ILE CD1 C 3.982 8.588 -1.162 1.00 . A A . 25 ILE CD1 1 1 16 7136 1 1 25 ILE CG1 C 3.200 8.035 0.023 1.00 . A A . 25 ILE CG1 1 1 16 7137 1 1 25 ILE CG2 C 1.364 7.456 -1.550 1.00 . A A . 25 ILE CG2 1 1 16 7138 1 1 25 ILE H H 2.548 6.729 2.490 1.00 . A A . 25 ILE H 1 1 16 7139 1 1 25 ILE HA H 0.389 6.468 0.483 1.00 . A A . 25 ILE HA 1 1 16 7140 1 1 25 ILE HB H 2.868 6.120 -0.874 1.00 . A A . 25 ILE HB 1 1 16 7141 1 1 25 ILE HD11 H 3.290 8.932 -1.919 1.00 . A A . 25 ILE HD11 1 1 16 7142 1 1 25 ILE HD12 H 4.607 7.811 -1.574 1.00 . A A . 25 ILE HD12 1 1 16 7143 1 1 25 ILE HD13 H 4.596 9.410 -0.832 1.00 . A A . 25 ILE HD13 1 1 16 7144 1 1 25 ILE HG12 H 2.610 8.823 0.468 1.00 . A A . 25 ILE HG12 1 1 16 7145 1 1 25 ILE HG13 H 3.888 7.641 0.754 1.00 . A A . 25 ILE HG13 1 1 16 7146 1 1 25 ILE HG21 H 0.755 8.255 -1.155 1.00 . A A . 25 ILE HG21 1 1 16 7147 1 1 25 ILE HG22 H 0.735 6.663 -1.913 1.00 . A A . 25 ILE HG22 1 1 16 7148 1 1 25 ILE HG23 H 1.970 7.833 -2.365 1.00 . A A . 25 ILE HG23 1 1 16 7149 1 1 25 ILE N N 1.816 7.069 1.936 1.00 . A A . 25 ILE N 1 1 16 7150 1 1 25 ILE O O 2.343 4.419 1.828 1.00 . A A . 25 ILE O 1 1 16 7151 1 1 26 CYS C C 3.303 2.485 -0.553 1.00 . A A . 26 CYS C 1 1 16 7152 1 1 26 CYS CA C 1.854 2.613 -0.094 1.00 . A A . 26 CYS CA 1 1 16 7153 1 1 26 CYS CB C 0.890 1.923 -1.062 1.00 . A A . 26 CYS CB 1 1 16 7154 1 1 26 CYS H H 1.086 4.419 -0.990 1.00 . A A . 26 CYS H 1 1 16 7155 1 1 26 CYS HA H 1.731 2.234 0.907 1.00 . A A . 26 CYS HA 1 1 16 7156 1 1 26 CYS HB2 H 0.443 2.660 -1.709 1.00 . A A . 26 CYS HB2 1 1 16 7157 1 1 26 CYS HB3 H 1.432 1.206 -1.658 1.00 . A A . 26 CYS HB3 1 1 16 7158 1 1 26 CYS N N 1.494 4.056 -0.166 1.00 . A A . 26 CYS N 1 1 16 7159 1 1 26 CYS O O 3.617 2.823 -1.673 1.00 . A A . 26 CYS O 1 1 16 7160 1 1 26 CYS SG S -0.409 1.075 -0.127 1.00 . A A . 26 CYS SG 1 1 16 7161 1 1 27 MET C C 6.403 0.781 0.439 1.00 . A A . 27 MET C 1 1 16 7162 1 1 27 MET CA C 5.633 1.999 -0.146 1.00 . A A . 27 MET CA 1 1 16 7163 1 1 27 MET CB C 6.222 3.340 0.324 1.00 . A A . 27 MET CB 1 1 16 7164 1 1 27 MET CE C 8.344 5.414 -0.421 1.00 . A A . 27 MET CE 1 1 16 7165 1 1 27 MET CG C 5.796 4.479 -0.610 1.00 . A A . 27 MET CG 1 1 16 7166 1 1 27 MET H H 3.952 1.822 1.216 1.00 . A A . 27 MET H 1 1 16 7167 1 1 27 MET HA H 5.669 1.960 -1.220 1.00 . A A . 27 MET HA 1 1 16 7168 1 1 27 MET HB2 H 5.863 3.561 1.318 1.00 . A A . 27 MET HB2 1 1 16 7169 1 1 27 MET HB3 H 7.294 3.271 0.339 1.00 . A A . 27 MET HB3 1 1 16 7170 1 1 27 MET HE1 H 8.808 5.158 0.522 1.00 . A A . 27 MET HE1 1 1 16 7171 1 1 27 MET HE2 H 8.917 6.191 -0.901 1.00 . A A . 27 MET HE2 1 1 16 7172 1 1 27 MET HE3 H 8.322 4.540 -1.062 1.00 . A A . 27 MET HE3 1 1 16 7173 1 1 27 MET HG2 H 6.045 4.231 -1.629 1.00 . A A . 27 MET HG2 1 1 16 7174 1 1 27 MET HG3 H 4.729 4.632 -0.529 1.00 . A A . 27 MET HG3 1 1 16 7175 1 1 27 MET N N 4.207 2.060 0.295 1.00 . A A . 27 MET N 1 1 16 7176 1 1 27 MET O O 6.610 -0.188 -0.267 1.00 . A A . 27 MET O 1 1 16 7177 1 1 27 MET SD S 6.655 5.995 -0.123 1.00 . A A . 27 MET SD 1 1 16 7178 1 1 28 PRO C C 6.745 -1.444 2.641 1.00 . A A . 28 PRO C 1 1 16 7179 1 1 28 PRO CA C 7.618 -0.220 2.324 1.00 . A A . 28 PRO CA 1 1 16 7180 1 1 28 PRO CB C 8.142 0.419 3.604 1.00 . A A . 28 PRO CB 1 1 16 7181 1 1 28 PRO CD C 6.619 1.999 2.609 1.00 . A A . 28 PRO CD 1 1 16 7182 1 1 28 PRO CG C 7.165 1.503 3.918 1.00 . A A . 28 PRO CG 1 1 16 7183 1 1 28 PRO HA H 8.449 -0.499 1.699 1.00 . A A . 28 PRO HA 1 1 16 7184 1 1 28 PRO HB2 H 8.174 -0.307 4.403 1.00 . A A . 28 PRO HB2 1 1 16 7185 1 1 28 PRO HB3 H 9.121 0.846 3.439 1.00 . A A . 28 PRO HB3 1 1 16 7186 1 1 28 PRO HD2 H 5.564 2.233 2.694 1.00 . A A . 28 PRO HD2 1 1 16 7187 1 1 28 PRO HD3 H 7.171 2.865 2.270 1.00 . A A . 28 PRO HD3 1 1 16 7188 1 1 28 PRO HG2 H 6.368 1.106 4.528 1.00 . A A . 28 PRO HG2 1 1 16 7189 1 1 28 PRO HG3 H 7.661 2.307 4.431 1.00 . A A . 28 PRO HG3 1 1 16 7190 1 1 28 PRO N N 6.827 0.879 1.686 1.00 . A A . 28 PRO N 1 1 16 7191 1 1 28 PRO O O 6.361 -1.654 3.773 1.00 . A A . 28 PRO O 1 1 16 7192 1 1 29 ARG C C 6.142 -4.309 3.023 1.00 . A A . 29 ARG C 1 1 16 7193 1 1 29 ARG CA C 5.596 -3.469 1.855 1.00 . A A . 29 ARG CA 1 1 16 7194 1 1 29 ARG CB C 5.676 -4.251 0.534 1.00 . A A . 29 ARG CB 1 1 16 7195 1 1 29 ARG CD C 6.128 -3.428 -1.778 1.00 . A A . 29 ARG CD 1 1 16 7196 1 1 29 ARG CG C 5.124 -3.406 -0.622 1.00 . A A . 29 ARG CG 1 1 16 7197 1 1 29 ARG CZ C 6.162 -4.604 -3.918 1.00 . A A . 29 ARG CZ 1 1 16 7198 1 1 29 ARG H H 6.777 -2.028 0.751 1.00 . A A . 29 ARG H 1 1 16 7199 1 1 29 ARG HA H 4.581 -3.182 2.053 1.00 . A A . 29 ARG HA 1 1 16 7200 1 1 29 ARG HB2 H 6.708 -4.496 0.330 1.00 . A A . 29 ARG HB2 1 1 16 7201 1 1 29 ARG HB3 H 5.104 -5.163 0.615 1.00 . A A . 29 ARG HB3 1 1 16 7202 1 1 29 ARG HD2 H 6.233 -2.437 -2.205 1.00 . A A . 29 ARG HD2 1 1 16 7203 1 1 29 ARG HD3 H 7.083 -3.792 -1.435 1.00 . A A . 29 ARG HD3 1 1 16 7204 1 1 29 ARG HE H 4.697 -4.827 -2.588 1.00 . A A . 29 ARG HE 1 1 16 7205 1 1 29 ARG HG2 H 4.182 -3.817 -0.952 1.00 . A A . 29 ARG HG2 1 1 16 7206 1 1 29 ARG HG3 H 4.980 -2.388 -0.291 1.00 . A A . 29 ARG HG3 1 1 16 7207 1 1 29 ARG HH11 H 7.708 -3.374 -3.556 1.00 . A A . 29 ARG HH11 1 1 16 7208 1 1 29 ARG HH12 H 7.759 -4.194 -5.076 1.00 . A A . 29 ARG HH12 1 1 16 7209 1 1 29 ARG HH21 H 4.750 -5.870 -4.579 1.00 . A A . 29 ARG HH21 1 1 16 7210 1 1 29 ARG HH22 H 6.080 -5.609 -5.653 1.00 . A A . 29 ARG HH22 1 1 16 7211 1 1 29 ARG N N 6.443 -2.242 1.643 1.00 . A A . 29 ARG N 1 1 16 7212 1 1 29 ARG NE N 5.549 -4.373 -2.781 1.00 . A A . 29 ARG NE 1 1 16 7213 1 1 29 ARG NH1 N 7.298 -4.008 -4.203 1.00 . A A . 29 ARG NH1 1 1 16 7214 1 1 29 ARG NH2 N 5.620 -5.422 -4.786 1.00 . A A . 29 ARG NH2 1 1 16 7215 1 1 29 ARG O O 5.398 -4.546 3.957 1.00 . A A . 29 ARG O 1 1 16 7216 1 1 29 ARG OXT O 7.298 -4.697 2.971 1.00 . A A . 29 ARG OXT 1 1 17 7217 1 1 1 GLY C C -10.169 -0.109 -3.830 1.00 . A A . 1 GLY C 1 1 17 7218 1 1 1 GLY CA C -11.622 0.155 -4.240 1.00 . A A . 1 GLY CA 1 1 17 7219 1 1 1 GLY H1 H -12.371 1.122 -2.559 1.00 . A A . 1 GLY H1 1 1 17 7220 1 1 1 GLY H2 H -12.174 -0.550 -2.360 1.00 . A A . 1 GLY H2 1 1 17 7221 1 1 1 GLY H3 H -13.467 0.047 -3.279 1.00 . A A . 1 GLY H3 1 1 17 7222 1 1 1 GLY HA2 H -11.971 -0.637 -4.895 1.00 . A A . 1 GLY HA2 1 1 17 7223 1 1 1 GLY HA3 H -11.684 1.102 -4.754 1.00 . A A . 1 GLY HA3 1 1 17 7224 1 1 1 GLY N N -12.474 0.197 -3.019 1.00 . A A . 1 GLY N 1 1 17 7225 1 1 1 GLY O O -9.910 -0.663 -2.778 1.00 . A A . 1 GLY O 1 1 17 7226 1 1 2 CYS C C -6.872 1.011 -5.060 1.00 . A A . 2 CYS C 1 1 17 7227 1 1 2 CYS CA C -7.786 0.047 -4.290 1.00 . A A . 2 CYS CA 1 1 17 7228 1 1 2 CYS CB C -7.505 -1.403 -4.706 1.00 . A A . 2 CYS CB 1 1 17 7229 1 1 2 CYS H H -9.448 0.722 -5.490 1.00 . A A . 2 CYS H 1 1 17 7230 1 1 2 CYS HA H -7.642 0.156 -3.227 1.00 . A A . 2 CYS HA 1 1 17 7231 1 1 2 CYS HB2 H -6.581 -1.734 -4.258 1.00 . A A . 2 CYS HB2 1 1 17 7232 1 1 2 CYS HB3 H -8.311 -2.039 -4.368 1.00 . A A . 2 CYS HB3 1 1 17 7233 1 1 2 CYS N N -9.220 0.280 -4.646 1.00 . A A . 2 CYS N 1 1 17 7234 1 1 2 CYS O O -7.221 1.491 -6.124 1.00 . A A . 2 CYS O 1 1 17 7235 1 1 2 CYS SG S -7.370 -1.507 -6.512 1.00 . A A . 2 CYS SG 1 1 17 7236 1 1 3 LYS C C -3.431 1.478 -5.520 1.00 . A A . 3 LYS C 1 1 17 7237 1 1 3 LYS CA C -4.751 2.207 -5.238 1.00 . A A . 3 LYS CA 1 1 17 7238 1 1 3 LYS CB C -4.517 3.397 -4.299 1.00 . A A . 3 LYS CB 1 1 17 7239 1 1 3 LYS CD C -5.705 4.767 -2.561 1.00 . A A . 3 LYS CD 1 1 17 7240 1 1 3 LYS CE C -6.920 5.679 -2.350 1.00 . A A . 3 LYS CE 1 1 17 7241 1 1 3 LYS CG C -5.860 4.007 -3.886 1.00 . A A . 3 LYS CG 1 1 17 7242 1 1 3 LYS H H -5.453 0.882 -3.676 1.00 . A A . 3 LYS H 1 1 17 7243 1 1 3 LYS HA H -5.183 2.553 -6.162 1.00 . A A . 3 LYS HA 1 1 17 7244 1 1 3 LYS HB2 H -3.972 3.077 -3.423 1.00 . A A . 3 LYS HB2 1 1 17 7245 1 1 3 LYS HB3 H -3.937 4.140 -4.819 1.00 . A A . 3 LYS HB3 1 1 17 7246 1 1 3 LYS HD2 H -5.640 4.059 -1.745 1.00 . A A . 3 LYS HD2 1 1 17 7247 1 1 3 LYS HD3 H -4.808 5.367 -2.590 1.00 . A A . 3 LYS HD3 1 1 17 7248 1 1 3 LYS HE2 H -6.912 6.486 -3.069 1.00 . A A . 3 LYS HE2 1 1 17 7249 1 1 3 LYS HE3 H -7.836 5.111 -2.438 1.00 . A A . 3 LYS HE3 1 1 17 7250 1 1 3 LYS HG2 H -6.194 4.689 -4.656 1.00 . A A . 3 LYS HG2 1 1 17 7251 1 1 3 LYS HG3 H -6.587 3.220 -3.764 1.00 . A A . 3 LYS HG3 1 1 17 7252 1 1 3 LYS HZ1 H -7.610 6.806 -0.742 1.00 . A A . 3 LYS HZ1 1 1 17 7253 1 1 3 LYS HZ2 H -5.915 6.790 -0.890 1.00 . A A . 3 LYS HZ2 1 1 17 7254 1 1 3 LYS HZ3 H -6.736 5.420 -0.282 1.00 . A A . 3 LYS HZ3 1 1 17 7255 1 1 3 LYS N N -5.705 1.287 -4.533 1.00 . A A . 3 LYS N 1 1 17 7256 1 1 3 LYS NZ N -6.786 6.215 -0.966 1.00 . A A . 3 LYS NZ 1 1 17 7257 1 1 3 LYS O O -3.300 0.297 -5.257 1.00 . A A . 3 LYS O 1 1 17 7258 1 1 4 LEU C C -0.146 1.754 -5.228 1.00 . A A . 4 LEU C 1 1 17 7259 1 1 4 LEU CA C -1.147 1.520 -6.380 1.00 . A A . 4 LEU CA 1 1 17 7260 1 1 4 LEU CB C -0.683 2.178 -7.691 1.00 . A A . 4 LEU CB 1 1 17 7261 1 1 4 LEU CD1 C -1.350 0.079 -8.881 1.00 . A A . 4 LEU CD1 1 1 17 7262 1 1 4 LEU CD2 C -2.930 2.010 -8.801 1.00 . A A . 4 LEU CD2 1 1 17 7263 1 1 4 LEU CG C -1.457 1.603 -8.886 1.00 . A A . 4 LEU CG 1 1 17 7264 1 1 4 LEU H H -2.598 3.113 -6.273 1.00 . A A . 4 LEU H 1 1 17 7265 1 1 4 LEU HA H -1.286 0.461 -6.533 1.00 . A A . 4 LEU HA 1 1 17 7266 1 1 4 LEU HB2 H -0.854 3.239 -7.633 1.00 . A A . 4 LEU HB2 1 1 17 7267 1 1 4 LEU HB3 H 0.367 1.993 -7.837 1.00 . A A . 4 LEU HB3 1 1 17 7268 1 1 4 LEU HD11 H -2.044 -0.327 -8.162 1.00 . A A . 4 LEU HD11 1 1 17 7269 1 1 4 LEU HD12 H -0.344 -0.207 -8.613 1.00 . A A . 4 LEU HD12 1 1 17 7270 1 1 4 LEU HD13 H -1.583 -0.301 -9.865 1.00 . A A . 4 LEU HD13 1 1 17 7271 1 1 4 LEU HD21 H -3.454 1.327 -8.150 1.00 . A A . 4 LEU HD21 1 1 17 7272 1 1 4 LEU HD22 H -3.369 1.979 -9.786 1.00 . A A . 4 LEU HD22 1 1 17 7273 1 1 4 LEU HD23 H -3.002 3.011 -8.404 1.00 . A A . 4 LEU HD23 1 1 17 7274 1 1 4 LEU HG H -1.033 1.986 -9.802 1.00 . A A . 4 LEU HG 1 1 17 7275 1 1 4 LEU N N -2.460 2.169 -6.063 1.00 . A A . 4 LEU N 1 1 17 7276 1 1 4 LEU O O -0.448 1.483 -4.084 1.00 . A A . 4 LEU O 1 1 17 7277 1 1 5 THR C C 1.949 3.878 -3.868 1.00 . A A . 5 THR C 1 1 17 7278 1 1 5 THR CA C 2.049 2.451 -4.432 1.00 . A A . 5 THR CA 1 1 17 7279 1 1 5 THR CB C 3.419 2.192 -5.095 1.00 . A A . 5 THR CB 1 1 17 7280 1 1 5 THR CG2 C 4.338 1.459 -4.116 1.00 . A A . 5 THR CG2 1 1 17 7281 1 1 5 THR H H 1.277 2.435 -6.438 1.00 . A A . 5 THR H 1 1 17 7282 1 1 5 THR HA H 1.890 1.734 -3.639 1.00 . A A . 5 THR HA 1 1 17 7283 1 1 5 THR HB H 3.872 3.132 -5.364 1.00 . A A . 5 THR HB 1 1 17 7284 1 1 5 THR HG1 H 2.763 0.593 -6.030 1.00 . A A . 5 THR HG1 1 1 17 7285 1 1 5 THR HG21 H 5.354 1.786 -4.265 1.00 . A A . 5 THR HG21 1 1 17 7286 1 1 5 THR HG22 H 4.270 0.392 -4.289 1.00 . A A . 5 THR HG22 1 1 17 7287 1 1 5 THR HG23 H 4.037 1.679 -3.105 1.00 . A A . 5 THR HG23 1 1 17 7288 1 1 5 THR N N 1.042 2.234 -5.515 1.00 . A A . 5 THR N 1 1 17 7289 1 1 5 THR O O 1.386 4.092 -2.811 1.00 . A A . 5 THR O 1 1 17 7290 1 1 5 THR OG1 O 3.256 1.394 -6.268 1.00 . A A . 5 THR OG1 1 1 17 7291 1 1 6 PHE C C 1.009 6.860 -4.154 1.00 . A A . 6 PHE C 1 1 17 7292 1 1 6 PHE CA C 2.419 6.260 -4.020 1.00 . A A . 6 PHE CA 1 1 17 7293 1 1 6 PHE CB C 3.428 7.072 -4.847 1.00 . A A . 6 PHE CB 1 1 17 7294 1 1 6 PHE CD1 C 4.825 7.235 -2.727 1.00 . A A . 6 PHE CD1 1 1 17 7295 1 1 6 PHE CD2 C 5.951 7.128 -4.871 1.00 . A A . 6 PHE CD2 1 1 17 7296 1 1 6 PHE CE1 C 6.068 7.302 -2.083 1.00 . A A . 6 PHE CE1 1 1 17 7297 1 1 6 PHE CE2 C 7.187 7.196 -4.226 1.00 . A A . 6 PHE CE2 1 1 17 7298 1 1 6 PHE CG C 4.766 7.146 -4.128 1.00 . A A . 6 PHE CG 1 1 17 7299 1 1 6 PHE CZ C 7.243 7.284 -2.833 1.00 . A A . 6 PHE CZ 1 1 17 7300 1 1 6 PHE H H 2.937 4.679 -5.386 1.00 . A A . 6 PHE H 1 1 17 7301 1 1 6 PHE HA H 2.713 6.268 -2.983 1.00 . A A . 6 PHE HA 1 1 17 7302 1 1 6 PHE HB2 H 3.563 6.596 -5.806 1.00 . A A . 6 PHE HB2 1 1 17 7303 1 1 6 PHE HB3 H 3.045 8.072 -4.997 1.00 . A A . 6 PHE HB3 1 1 17 7304 1 1 6 PHE HD1 H 3.914 7.253 -2.145 1.00 . A A . 6 PHE HD1 1 1 17 7305 1 1 6 PHE HD2 H 5.908 7.059 -5.946 1.00 . A A . 6 PHE HD2 1 1 17 7306 1 1 6 PHE HE1 H 6.118 7.362 -1.003 1.00 . A A . 6 PHE HE1 1 1 17 7307 1 1 6 PHE HE2 H 8.099 7.182 -4.802 1.00 . A A . 6 PHE HE2 1 1 17 7308 1 1 6 PHE HZ H 8.197 7.337 -2.337 1.00 . A A . 6 PHE HZ 1 1 17 7309 1 1 6 PHE N N 2.484 4.860 -4.546 1.00 . A A . 6 PHE N 1 1 17 7310 1 1 6 PHE O O 0.852 8.025 -4.468 1.00 . A A . 6 PHE O 1 1 17 7311 1 1 7 TRP C C -1.870 6.894 -2.505 1.00 . A A . 7 TRP C 1 1 17 7312 1 1 7 TRP CA C -1.399 6.641 -3.936 1.00 . A A . 7 TRP CA 1 1 17 7313 1 1 7 TRP CB C -2.241 5.545 -4.588 1.00 . A A . 7 TRP CB 1 1 17 7314 1 1 7 TRP CD1 C -0.673 5.352 -6.553 1.00 . A A . 7 TRP CD1 1 1 17 7315 1 1 7 TRP CD2 C -2.829 5.478 -7.171 1.00 . A A . 7 TRP CD2 1 1 17 7316 1 1 7 TRP CE2 C -2.070 5.393 -8.359 1.00 . A A . 7 TRP CE2 1 1 17 7317 1 1 7 TRP CE3 C -4.225 5.561 -7.284 1.00 . A A . 7 TRP CE3 1 1 17 7318 1 1 7 TRP CG C -1.917 5.465 -6.040 1.00 . A A . 7 TRP CG 1 1 17 7319 1 1 7 TRP CH2 C -4.069 5.476 -9.705 1.00 . A A . 7 TRP CH2 1 1 17 7320 1 1 7 TRP CZ2 C -2.677 5.392 -9.614 1.00 . A A . 7 TRP CZ2 1 1 17 7321 1 1 7 TRP CZ3 C -4.838 5.558 -8.545 1.00 . A A . 7 TRP CZ3 1 1 17 7322 1 1 7 TRP H H 0.118 5.172 -3.587 1.00 . A A . 7 TRP H 1 1 17 7323 1 1 7 TRP HA H -1.432 7.545 -4.523 1.00 . A A . 7 TRP HA 1 1 17 7324 1 1 7 TRP HB2 H -2.031 4.595 -4.112 1.00 . A A . 7 TRP HB2 1 1 17 7325 1 1 7 TRP HB3 H -3.285 5.781 -4.467 1.00 . A A . 7 TRP HB3 1 1 17 7326 1 1 7 TRP HD1 H 0.247 5.302 -5.978 1.00 . A A . 7 TRP HD1 1 1 17 7327 1 1 7 TRP HE1 H 0.004 5.255 -8.542 1.00 . A A . 7 TRP HE1 1 1 17 7328 1 1 7 TRP HE3 H -4.832 5.616 -6.397 1.00 . A A . 7 TRP HE3 1 1 17 7329 1 1 7 TRP HH2 H -4.552 5.477 -10.669 1.00 . A A . 7 TRP HH2 1 1 17 7330 1 1 7 TRP HZ2 H -2.079 5.327 -10.508 1.00 . A A . 7 TRP HZ2 1 1 17 7331 1 1 7 TRP HZ3 H -5.914 5.626 -8.620 1.00 . A A . 7 TRP HZ3 1 1 17 7332 1 1 7 TRP N N -0.017 6.096 -3.873 1.00 . A A . 7 TRP N 1 1 17 7333 1 1 7 TRP NE1 N -0.760 5.323 -7.930 1.00 . A A . 7 TRP NE1 1 1 17 7334 1 1 7 TRP O O -2.042 5.958 -1.751 1.00 . A A . 7 TRP O 1 1 17 7335 1 1 8 LYS C C -3.378 7.372 -0.173 1.00 . A A . 8 LYS C 1 1 17 7336 1 1 8 LYS CA C -2.479 8.480 -0.725 1.00 . A A . 8 LYS CA 1 1 17 7337 1 1 8 LYS CB C -3.253 9.801 -0.838 1.00 . A A . 8 LYS CB 1 1 17 7338 1 1 8 LYS CD C -1.601 11.422 -1.805 1.00 . A A . 8 LYS CD 1 1 17 7339 1 1 8 LYS CE C -1.623 12.957 -1.914 1.00 . A A . 8 LYS CE 1 1 17 7340 1 1 8 LYS CG C -2.322 10.979 -0.526 1.00 . A A . 8 LYS CG 1 1 17 7341 1 1 8 LYS H H -1.866 8.871 -2.761 1.00 . A A . 8 LYS H 1 1 17 7342 1 1 8 LYS HA H -1.614 8.608 -0.089 1.00 . A A . 8 LYS HA 1 1 17 7343 1 1 8 LYS HB2 H -3.646 9.904 -1.838 1.00 . A A . 8 LYS HB2 1 1 17 7344 1 1 8 LYS HB3 H -4.072 9.799 -0.130 1.00 . A A . 8 LYS HB3 1 1 17 7345 1 1 8 LYS HD2 H -0.575 11.081 -1.769 1.00 . A A . 8 LYS HD2 1 1 17 7346 1 1 8 LYS HD3 H -2.092 10.992 -2.662 1.00 . A A . 8 LYS HD3 1 1 17 7347 1 1 8 LYS HE2 H -1.436 13.403 -0.949 1.00 . A A . 8 LYS HE2 1 1 17 7348 1 1 8 LYS HE3 H -0.885 13.293 -2.629 1.00 . A A . 8 LYS HE3 1 1 17 7349 1 1 8 LYS HG2 H -2.904 11.804 -0.133 1.00 . A A . 8 LYS HG2 1 1 17 7350 1 1 8 LYS HG3 H -1.591 10.677 0.210 1.00 . A A . 8 LYS HG3 1 1 17 7351 1 1 8 LYS HZ1 H -3.099 13.034 -3.390 1.00 . A A . 8 LYS HZ1 1 1 17 7352 1 1 8 LYS HZ2 H -3.140 14.334 -2.304 1.00 . A A . 8 LYS HZ2 1 1 17 7353 1 1 8 LYS HZ3 H -3.705 12.807 -1.826 1.00 . A A . 8 LYS HZ3 1 1 17 7354 1 1 8 LYS N N -2.044 8.145 -2.127 1.00 . A A . 8 LYS N 1 1 17 7355 1 1 8 LYS NZ N -2.994 13.305 -2.393 1.00 . A A . 8 LYS NZ 1 1 17 7356 1 1 8 LYS O O -4.534 7.257 -0.541 1.00 . A A . 8 LYS O 1 1 17 7357 1 1 9 CYS C C -3.902 5.550 2.709 1.00 . A A . 9 CYS C 1 1 17 7358 1 1 9 CYS CA C -3.643 5.396 1.207 1.00 . A A . 9 CYS CA 1 1 17 7359 1 1 9 CYS CB C -2.797 4.149 0.901 1.00 . A A . 9 CYS CB 1 1 17 7360 1 1 9 CYS H H -1.886 6.635 0.912 1.00 . A A . 9 CYS H 1 1 17 7361 1 1 9 CYS HA H -4.579 5.332 0.677 1.00 . A A . 9 CYS HA 1 1 17 7362 1 1 9 CYS HB2 H -3.290 3.561 0.142 1.00 . A A . 9 CYS HB2 1 1 17 7363 1 1 9 CYS HB3 H -1.828 4.457 0.536 1.00 . A A . 9 CYS HB3 1 1 17 7364 1 1 9 CYS N N -2.835 6.534 0.666 1.00 . A A . 9 CYS N 1 1 17 7365 1 1 9 CYS O O -3.180 6.235 3.413 1.00 . A A . 9 CYS O 1 1 17 7366 1 1 9 CYS SG S -2.580 3.135 2.390 1.00 . A A . 9 CYS SG 1 1 17 7367 1 1 10 LYS C C -4.761 3.694 5.334 1.00 . A A . 10 LYS C 1 1 17 7368 1 1 10 LYS CA C -5.266 4.967 4.645 1.00 . A A . 10 LYS CA 1 1 17 7369 1 1 10 LYS CB C -6.793 5.044 4.703 1.00 . A A . 10 LYS CB 1 1 17 7370 1 1 10 LYS CD C -7.207 5.757 7.066 1.00 . A A . 10 LYS CD 1 1 17 7371 1 1 10 LYS CE C -7.958 6.775 7.934 1.00 . A A . 10 LYS CE 1 1 17 7372 1 1 10 LYS CG C -7.216 6.209 5.600 1.00 . A A . 10 LYS CG 1 1 17 7373 1 1 10 LYS H H -5.486 4.362 2.594 1.00 . A A . 10 LYS H 1 1 17 7374 1 1 10 LYS HA H -4.827 5.843 5.099 1.00 . A A . 10 LYS HA 1 1 17 7375 1 1 10 LYS HB2 H -7.180 5.196 3.703 1.00 . A A . 10 LYS HB2 1 1 17 7376 1 1 10 LYS HB3 H -7.183 4.120 5.101 1.00 . A A . 10 LYS HB3 1 1 17 7377 1 1 10 LYS HD2 H -7.688 4.791 7.147 1.00 . A A . 10 LYS HD2 1 1 17 7378 1 1 10 LYS HD3 H -6.186 5.677 7.412 1.00 . A A . 10 LYS HD3 1 1 17 7379 1 1 10 LYS HE2 H -8.924 7.000 7.498 1.00 . A A . 10 LYS HE2 1 1 17 7380 1 1 10 LYS HE3 H -8.078 6.397 8.938 1.00 . A A . 10 LYS HE3 1 1 17 7381 1 1 10 LYS HG2 H -6.522 7.030 5.471 1.00 . A A . 10 LYS HG2 1 1 17 7382 1 1 10 LYS HG3 H -8.208 6.528 5.329 1.00 . A A . 10 LYS HG3 1 1 17 7383 1 1 10 LYS HZ1 H -7.469 8.679 8.631 1.00 . A A . 10 LYS HZ1 1 1 17 7384 1 1 10 LYS HZ2 H -7.075 8.424 7.002 1.00 . A A . 10 LYS HZ2 1 1 17 7385 1 1 10 LYS HZ3 H -6.128 7.730 8.228 1.00 . A A . 10 LYS HZ3 1 1 17 7386 1 1 10 LYS N N -4.933 4.904 3.194 1.00 . A A . 10 LYS N 1 1 17 7387 1 1 10 LYS NZ N -7.094 7.991 7.947 1.00 . A A . 10 LYS NZ 1 1 17 7388 1 1 10 LYS O O -4.086 3.750 6.342 1.00 . A A . 10 LYS O 1 1 17 7389 1 1 11 ASN C C -3.714 0.519 4.382 1.00 . A A . 11 ASN C 1 1 17 7390 1 1 11 ASN CA C -4.594 1.267 5.396 1.00 . A A . 11 ASN CA 1 1 17 7391 1 1 11 ASN CB C -5.868 0.488 5.761 1.00 . A A . 11 ASN CB 1 1 17 7392 1 1 11 ASN CG C -5.954 -0.824 4.981 1.00 . A A . 11 ASN CG 1 1 17 7393 1 1 11 ASN H H -5.608 2.521 3.963 1.00 . A A . 11 ASN H 1 1 17 7394 1 1 11 ASN HA H -4.028 1.478 6.292 1.00 . A A . 11 ASN HA 1 1 17 7395 1 1 11 ASN HB2 H -5.857 0.268 6.820 1.00 . A A . 11 ASN HB2 1 1 17 7396 1 1 11 ASN HB3 H -6.734 1.093 5.538 1.00 . A A . 11 ASN HB3 1 1 17 7397 1 1 11 ASN HD21 H -7.153 -0.076 3.605 1.00 . A A . 11 ASN HD21 1 1 17 7398 1 1 11 ASN HD22 H -6.750 -1.707 3.402 1.00 . A A . 11 ASN HD22 1 1 17 7399 1 1 11 ASN N N -5.071 2.546 4.785 1.00 . A A . 11 ASN N 1 1 17 7400 1 1 11 ASN ND2 N -6.677 -0.872 3.905 1.00 . A A . 11 ASN ND2 1 1 17 7401 1 1 11 ASN O O -3.825 0.711 3.188 1.00 . A A . 11 ASN O 1 1 17 7402 1 1 11 ASN OD1 O -5.344 -1.809 5.346 1.00 . A A . 11 ASN OD1 1 1 17 7403 1 1 12 LYS C C -2.682 -1.922 2.904 1.00 . A A . 12 LYS C 1 1 17 7404 1 1 12 LYS CA C -1.909 -1.045 3.912 1.00 . A A . 12 LYS CA 1 1 17 7405 1 1 12 LYS CB C -0.994 -1.887 4.819 1.00 . A A . 12 LYS CB 1 1 17 7406 1 1 12 LYS CD C -1.247 -3.303 6.880 1.00 . A A . 12 LYS CD 1 1 17 7407 1 1 12 LYS CE C -1.676 -4.701 7.351 1.00 . A A . 12 LYS CE 1 1 17 7408 1 1 12 LYS CG C -1.774 -3.046 5.458 1.00 . A A . 12 LYS CG 1 1 17 7409 1 1 12 LYS H H -2.742 -0.447 5.809 1.00 . A A . 12 LYS H 1 1 17 7410 1 1 12 LYS HA H -1.305 -0.327 3.373 1.00 . A A . 12 LYS HA 1 1 17 7411 1 1 12 LYS HB2 H -0.186 -2.284 4.232 1.00 . A A . 12 LYS HB2 1 1 17 7412 1 1 12 LYS HB3 H -0.592 -1.258 5.599 1.00 . A A . 12 LYS HB3 1 1 17 7413 1 1 12 LYS HD2 H -0.169 -3.235 6.881 1.00 . A A . 12 LYS HD2 1 1 17 7414 1 1 12 LYS HD3 H -1.656 -2.559 7.550 1.00 . A A . 12 LYS HD3 1 1 17 7415 1 1 12 LYS HE2 H -2.733 -4.848 7.173 1.00 . A A . 12 LYS HE2 1 1 17 7416 1 1 12 LYS HE3 H -1.099 -5.461 6.845 1.00 . A A . 12 LYS HE3 1 1 17 7417 1 1 12 LYS HG2 H -2.824 -2.795 5.502 1.00 . A A . 12 LYS HG2 1 1 17 7418 1 1 12 LYS HG3 H -1.641 -3.937 4.860 1.00 . A A . 12 LYS HG3 1 1 17 7419 1 1 12 LYS HZ1 H -1.752 -5.623 9.225 1.00 . A A . 12 LYS HZ1 1 1 17 7420 1 1 12 LYS HZ2 H -1.851 -3.932 9.288 1.00 . A A . 12 LYS HZ2 1 1 17 7421 1 1 12 LYS HZ3 H -0.361 -4.687 8.979 1.00 . A A . 12 LYS HZ3 1 1 17 7422 1 1 12 LYS N N -2.823 -0.315 4.848 1.00 . A A . 12 LYS N 1 1 17 7423 1 1 12 LYS NZ N -1.386 -4.736 8.817 1.00 . A A . 12 LYS NZ 1 1 17 7424 1 1 12 LYS O O -2.271 -2.060 1.770 1.00 . A A . 12 LYS O 1 1 17 7425 1 1 13 LYS C C -5.377 -2.486 1.343 1.00 . A A . 13 LYS C 1 1 17 7426 1 1 13 LYS CA C -4.565 -3.355 2.326 1.00 . A A . 13 LYS CA 1 1 17 7427 1 1 13 LYS CB C -5.507 -4.218 3.180 1.00 . A A . 13 LYS CB 1 1 17 7428 1 1 13 LYS CD C -5.475 -6.552 4.110 1.00 . A A . 13 LYS CD 1 1 17 7429 1 1 13 LYS CE C -6.874 -7.191 4.143 1.00 . A A . 13 LYS CE 1 1 17 7430 1 1 13 LYS CG C -5.309 -5.703 2.840 1.00 . A A . 13 LYS CG 1 1 17 7431 1 1 13 LYS H H -4.120 -2.371 4.211 1.00 . A A . 13 LYS H 1 1 17 7432 1 1 13 LYS HA H -3.884 -3.989 1.778 1.00 . A A . 13 LYS HA 1 1 17 7433 1 1 13 LYS HB2 H -5.299 -4.055 4.227 1.00 . A A . 13 LYS HB2 1 1 17 7434 1 1 13 LYS HB3 H -6.528 -3.942 2.969 1.00 . A A . 13 LYS HB3 1 1 17 7435 1 1 13 LYS HD2 H -4.722 -7.328 4.123 1.00 . A A . 13 LYS HD2 1 1 17 7436 1 1 13 LYS HD3 H -5.349 -5.923 4.978 1.00 . A A . 13 LYS HD3 1 1 17 7437 1 1 13 LYS HE2 H -7.155 -7.418 5.165 1.00 . A A . 13 LYS HE2 1 1 17 7438 1 1 13 LYS HE3 H -7.599 -6.529 3.696 1.00 . A A . 13 LYS HE3 1 1 17 7439 1 1 13 LYS HG2 H -6.042 -6.004 2.106 1.00 . A A . 13 LYS HG2 1 1 17 7440 1 1 13 LYS HG3 H -4.316 -5.852 2.438 1.00 . A A . 13 LYS HG3 1 1 17 7441 1 1 13 LYS HZ1 H -7.486 -9.127 3.671 1.00 . A A . 13 LYS HZ1 1 1 17 7442 1 1 13 LYS HZ2 H -5.823 -8.867 3.457 1.00 . A A . 13 LYS HZ2 1 1 17 7443 1 1 13 LYS HZ3 H -6.941 -8.239 2.341 1.00 . A A . 13 LYS HZ3 1 1 17 7444 1 1 13 LYS N N -3.793 -2.500 3.293 1.00 . A A . 13 LYS N 1 1 17 7445 1 1 13 LYS NZ N -6.769 -8.448 3.342 1.00 . A A . 13 LYS NZ 1 1 17 7446 1 1 13 LYS O O -6.106 -3.001 0.515 1.00 . A A . 13 LYS O 1 1 17 7447 1 1 14 GLU C C -5.416 -0.336 -0.914 1.00 . A A . 14 GLU C 1 1 17 7448 1 1 14 GLU CA C -6.029 -0.294 0.495 1.00 . A A . 14 GLU CA 1 1 17 7449 1 1 14 GLU CB C -5.901 1.110 1.096 1.00 . A A . 14 GLU CB 1 1 17 7450 1 1 14 GLU CD C -7.068 3.314 1.074 1.00 . A A . 14 GLU CD 1 1 17 7451 1 1 14 GLU CG C -6.693 2.093 0.243 1.00 . A A . 14 GLU CG 1 1 17 7452 1 1 14 GLU H H -4.680 -0.773 2.093 1.00 . A A . 14 GLU H 1 1 17 7453 1 1 14 GLU HA H -7.069 -0.585 0.466 1.00 . A A . 14 GLU HA 1 1 17 7454 1 1 14 GLU HB2 H -6.289 1.113 2.104 1.00 . A A . 14 GLU HB2 1 1 17 7455 1 1 14 GLU HB3 H -4.860 1.405 1.110 1.00 . A A . 14 GLU HB3 1 1 17 7456 1 1 14 GLU HG2 H -6.093 2.396 -0.601 1.00 . A A . 14 GLU HG2 1 1 17 7457 1 1 14 GLU HG3 H -7.590 1.611 -0.109 1.00 . A A . 14 GLU HG3 1 1 17 7458 1 1 14 GLU N N -5.266 -1.177 1.424 1.00 . A A . 14 GLU N 1 1 17 7459 1 1 14 GLU O O -6.107 -0.192 -1.903 1.00 . A A . 14 GLU O 1 1 17 7460 1 1 14 GLU OE1 O -7.871 3.173 1.973 1.00 . A A . 14 GLU OE1 1 1 17 7461 1 1 14 GLU OE2 O -6.544 4.374 0.796 1.00 . A A . 14 GLU OE2 1 1 17 7462 1 1 15 CYS C C -3.749 -1.951 -3.004 1.00 . A A . 15 CYS C 1 1 17 7463 1 1 15 CYS CA C -3.488 -0.585 -2.364 1.00 . A A . 15 CYS CA 1 1 17 7464 1 1 15 CYS CB C -1.996 -0.365 -2.108 1.00 . A A . 15 CYS CB 1 1 17 7465 1 1 15 CYS H H -3.586 -0.648 -0.202 1.00 . A A . 15 CYS H 1 1 17 7466 1 1 15 CYS HA H -3.873 0.202 -2.992 1.00 . A A . 15 CYS HA 1 1 17 7467 1 1 15 CYS HB2 H -1.619 -1.147 -1.467 1.00 . A A . 15 CYS HB2 1 1 17 7468 1 1 15 CYS HB3 H -1.461 -0.374 -3.046 1.00 . A A . 15 CYS HB3 1 1 17 7469 1 1 15 CYS N N -4.131 -0.531 -1.014 1.00 . A A . 15 CYS N 1 1 17 7470 1 1 15 CYS O O -3.562 -2.973 -2.374 1.00 . A A . 15 CYS O 1 1 17 7471 1 1 15 CYS SG S -1.771 1.247 -1.298 1.00 . A A . 15 CYS SG 1 1 17 7472 1 1 16 CYS C C -3.257 -4.207 -4.758 1.00 . A A . 16 CYS C 1 1 17 7473 1 1 16 CYS CA C -4.462 -3.288 -4.933 1.00 . A A . 16 CYS CA 1 1 17 7474 1 1 16 CYS CB C -4.683 -2.943 -6.412 1.00 . A A . 16 CYS CB 1 1 17 7475 1 1 16 CYS H H -4.327 -1.133 -4.727 1.00 . A A . 16 CYS H 1 1 17 7476 1 1 16 CYS HA H -5.344 -3.750 -4.523 1.00 . A A . 16 CYS HA 1 1 17 7477 1 1 16 CYS HB2 H -4.446 -1.904 -6.582 1.00 . A A . 16 CYS HB2 1 1 17 7478 1 1 16 CYS HB3 H -4.040 -3.563 -7.021 1.00 . A A . 16 CYS HB3 1 1 17 7479 1 1 16 CYS N N -4.185 -1.977 -4.244 1.00 . A A . 16 CYS N 1 1 17 7480 1 1 16 CYS O O -3.364 -5.278 -4.192 1.00 . A A . 16 CYS O 1 1 17 7481 1 1 16 CYS SG S -6.412 -3.255 -6.855 1.00 . A A . 16 CYS SG 1 1 17 7482 1 1 17 GLY C C -0.526 -4.471 -3.512 1.00 . A A . 17 GLY C 1 1 17 7483 1 1 17 GLY CA C -0.892 -4.615 -4.985 1.00 . A A . 17 GLY CA 1 1 17 7484 1 1 17 GLY H H -2.029 -2.900 -5.610 1.00 . A A . 17 GLY H 1 1 17 7485 1 1 17 GLY HA2 H -1.112 -5.647 -5.219 1.00 . A A . 17 GLY HA2 1 1 17 7486 1 1 17 GLY HA3 H -0.080 -4.257 -5.597 1.00 . A A . 17 GLY HA3 1 1 17 7487 1 1 17 GLY N N -2.102 -3.781 -5.191 1.00 . A A . 17 GLY N 1 1 17 7488 1 1 17 GLY O O -0.043 -3.438 -3.104 1.00 . A A . 17 GLY O 1 1 17 7489 1 1 18 TRP C C 0.775 -4.679 -0.930 1.00 . A A . 18 TRP C 1 1 17 7490 1 1 18 TRP CA C -0.538 -5.408 -1.233 1.00 . A A . 18 TRP CA 1 1 17 7491 1 1 18 TRP CB C -0.486 -6.865 -0.770 1.00 . A A . 18 TRP CB 1 1 17 7492 1 1 18 TRP CD1 C -2.990 -6.742 -0.404 1.00 . A A . 18 TRP CD1 1 1 17 7493 1 1 18 TRP CD2 C -2.317 -8.772 -1.104 1.00 . A A . 18 TRP CD2 1 1 17 7494 1 1 18 TRP CE2 C -3.723 -8.839 -0.945 1.00 . A A . 18 TRP CE2 1 1 17 7495 1 1 18 TRP CE3 C -1.644 -9.927 -1.541 1.00 . A A . 18 TRP CE3 1 1 17 7496 1 1 18 TRP CG C -1.874 -7.428 -0.754 1.00 . A A . 18 TRP CG 1 1 17 7497 1 1 18 TRP CH2 C -3.751 -11.147 -1.643 1.00 . A A . 18 TRP CH2 1 1 17 7498 1 1 18 TRP CZ2 C -4.435 -10.009 -1.208 1.00 . A A . 18 TRP CZ2 1 1 17 7499 1 1 18 TRP CZ3 C -2.358 -11.108 -1.808 1.00 . A A . 18 TRP CZ3 1 1 17 7500 1 1 18 TRP H H -1.244 -6.271 -3.086 1.00 . A A . 18 TRP H 1 1 17 7501 1 1 18 TRP HA H -1.354 -4.907 -0.736 1.00 . A A . 18 TRP HA 1 1 17 7502 1 1 18 TRP HB2 H 0.130 -7.434 -1.450 1.00 . A A . 18 TRP HB2 1 1 17 7503 1 1 18 TRP HB3 H -0.065 -6.912 0.224 1.00 . A A . 18 TRP HB3 1 1 17 7504 1 1 18 TRP HD1 H -3.019 -5.710 -0.089 1.00 . A A . 18 TRP HD1 1 1 17 7505 1 1 18 TRP HE1 H -5.014 -7.326 -0.324 1.00 . A A . 18 TRP HE1 1 1 17 7506 1 1 18 TRP HE3 H -0.574 -9.904 -1.671 1.00 . A A . 18 TRP HE3 1 1 17 7507 1 1 18 TRP HH2 H -4.295 -12.058 -1.851 1.00 . A A . 18 TRP HH2 1 1 17 7508 1 1 18 TRP HZ2 H -5.510 -10.035 -1.080 1.00 . A A . 18 TRP HZ2 1 1 17 7509 1 1 18 TRP HZ3 H -1.831 -11.989 -2.145 1.00 . A A . 18 TRP HZ3 1 1 17 7510 1 1 18 TRP N N -0.811 -5.474 -2.714 1.00 . A A . 18 TRP N 1 1 17 7511 1 1 18 TRP NE1 N -4.085 -7.578 -0.516 1.00 . A A . 18 TRP NE1 1 1 17 7512 1 1 18 TRP O O 1.838 -5.273 -0.846 1.00 . A A . 18 TRP O 1 1 17 7513 1 1 19 ASN C C 1.837 -2.144 1.023 1.00 . A A . 19 ASN C 1 1 17 7514 1 1 19 ASN CA C 1.868 -2.549 -0.456 1.00 . A A . 19 ASN CA 1 1 17 7515 1 1 19 ASN CB C 1.689 -1.300 -1.326 1.00 . A A . 19 ASN CB 1 1 17 7516 1 1 19 ASN CG C 2.841 -1.170 -2.323 1.00 . A A . 19 ASN CG 1 1 17 7517 1 1 19 ASN H H -0.201 -2.966 -0.836 1.00 . A A . 19 ASN H 1 1 17 7518 1 1 19 ASN HA H 2.791 -3.060 -0.712 1.00 . A A . 19 ASN HA 1 1 17 7519 1 1 19 ASN HB2 H 0.764 -1.371 -1.872 1.00 . A A . 19 ASN HB2 1 1 17 7520 1 1 19 ASN HB3 H 1.660 -0.427 -0.695 1.00 . A A . 19 ASN HB3 1 1 17 7521 1 1 19 ASN HD21 H 4.151 -0.615 -0.954 1.00 . A A . 19 ASN HD21 1 1 17 7522 1 1 19 ASN HD22 H 4.757 -0.719 -2.523 1.00 . A A . 19 ASN HD22 1 1 17 7523 1 1 19 ASN N N 0.678 -3.389 -0.759 1.00 . A A . 19 ASN N 1 1 17 7524 1 1 19 ASN ND2 N 4.012 -0.802 -1.896 1.00 . A A . 19 ASN ND2 1 1 17 7525 1 1 19 ASN O O 0.886 -2.420 1.729 1.00 . A A . 19 ASN O 1 1 17 7526 1 1 19 ASN OD1 O 2.663 -1.372 -3.509 1.00 . A A . 19 ASN OD1 1 1 17 7527 1 1 20 ALA C C 2.604 0.471 2.986 1.00 . A A . 20 ALA C 1 1 17 7528 1 1 20 ALA CA C 2.862 -1.031 2.920 1.00 . A A . 20 ALA CA 1 1 17 7529 1 1 20 ALA CB C 4.266 -1.354 3.439 1.00 . A A . 20 ALA CB 1 1 17 7530 1 1 20 ALA H H 3.603 -1.238 0.906 1.00 . A A . 20 ALA H 1 1 17 7531 1 1 20 ALA HA H 2.118 -1.570 3.488 1.00 . A A . 20 ALA HA 1 1 17 7532 1 1 20 ALA HB1 H 4.413 -0.886 4.403 1.00 . A A . 20 ALA HB1 1 1 17 7533 1 1 20 ALA HB2 H 5.000 -0.978 2.743 1.00 . A A . 20 ALA HB2 1 1 17 7534 1 1 20 ALA HB3 H 4.376 -2.422 3.536 1.00 . A A . 20 ALA HB3 1 1 17 7535 1 1 20 ALA N N 2.852 -1.468 1.494 1.00 . A A . 20 ALA N 1 1 17 7536 1 1 20 ALA O O 3.364 1.260 2.455 1.00 . A A . 20 ALA O 1 1 17 7537 1 1 21 CYS C C 2.201 2.899 4.838 1.00 . A A . 21 CYS C 1 1 17 7538 1 1 21 CYS CA C 1.287 2.339 3.751 1.00 . A A . 21 CYS CA 1 1 17 7539 1 1 21 CYS CB C -0.192 2.459 4.128 1.00 . A A . 21 CYS CB 1 1 17 7540 1 1 21 CYS H H 0.965 0.233 4.081 1.00 . A A . 21 CYS H 1 1 17 7541 1 1 21 CYS HA H 1.478 2.825 2.811 1.00 . A A . 21 CYS HA 1 1 17 7542 1 1 21 CYS HB2 H -0.713 1.559 3.835 1.00 . A A . 21 CYS HB2 1 1 17 7543 1 1 21 CYS HB3 H -0.285 2.593 5.194 1.00 . A A . 21 CYS HB3 1 1 17 7544 1 1 21 CYS N N 1.558 0.879 3.647 1.00 . A A . 21 CYS N 1 1 17 7545 1 1 21 CYS O O 1.953 2.725 6.017 1.00 . A A . 21 CYS O 1 1 17 7546 1 1 21 CYS SG S -0.920 3.879 3.272 1.00 . A A . 21 CYS SG 1 1 17 7547 1 1 22 ALA C C 4.391 5.567 5.365 1.00 . A A . 22 ALA C 1 1 17 7548 1 1 22 ALA CA C 4.248 4.045 5.455 1.00 . A A . 22 ALA CA 1 1 17 7549 1 1 22 ALA CB C 5.577 3.365 5.118 1.00 . A A . 22 ALA CB 1 1 17 7550 1 1 22 ALA H H 3.473 3.611 3.488 1.00 . A A . 22 ALA H 1 1 17 7551 1 1 22 ALA HA H 3.936 3.761 6.447 1.00 . A A . 22 ALA HA 1 1 17 7552 1 1 22 ALA HB1 H 5.711 3.345 4.046 1.00 . A A . 22 ALA HB1 1 1 17 7553 1 1 22 ALA HB2 H 5.568 2.355 5.499 1.00 . A A . 22 ALA HB2 1 1 17 7554 1 1 22 ALA HB3 H 6.386 3.915 5.574 1.00 . A A . 22 ALA HB3 1 1 17 7555 1 1 22 ALA N N 3.282 3.520 4.446 1.00 . A A . 22 ALA N 1 1 17 7556 1 1 22 ALA O O 3.914 6.285 6.219 1.00 . A A . 22 ALA O 1 1 17 7557 1 1 23 LEU C C 3.924 8.212 3.775 1.00 . A A . 23 LEU C 1 1 17 7558 1 1 23 LEU CA C 5.240 7.551 4.227 1.00 . A A . 23 LEU CA 1 1 17 7559 1 1 23 LEU CB C 6.332 7.766 3.154 1.00 . A A . 23 LEU CB 1 1 17 7560 1 1 23 LEU CD1 C 7.702 6.380 4.816 1.00 . A A . 23 LEU CD1 1 1 17 7561 1 1 23 LEU CD2 C 7.498 5.654 2.441 1.00 . A A . 23 LEU CD2 1 1 17 7562 1 1 23 LEU CG C 7.580 6.869 3.366 1.00 . A A . 23 LEU CG 1 1 17 7563 1 1 23 LEU H H 5.438 5.469 3.676 1.00 . A A . 23 LEU H 1 1 17 7564 1 1 23 LEU HA H 5.563 7.966 5.168 1.00 . A A . 23 LEU HA 1 1 17 7565 1 1 23 LEU HB2 H 5.913 7.555 2.181 1.00 . A A . 23 LEU HB2 1 1 17 7566 1 1 23 LEU HB3 H 6.639 8.805 3.176 1.00 . A A . 23 LEU HB3 1 1 17 7567 1 1 23 LEU HD11 H 8.727 6.481 5.140 1.00 . A A . 23 LEU HD11 1 1 17 7568 1 1 23 LEU HD12 H 7.412 5.339 4.868 1.00 . A A . 23 LEU HD12 1 1 17 7569 1 1 23 LEU HD13 H 7.062 6.966 5.455 1.00 . A A . 23 LEU HD13 1 1 17 7570 1 1 23 LEU HD21 H 8.349 5.654 1.775 1.00 . A A . 23 LEU HD21 1 1 17 7571 1 1 23 LEU HD22 H 6.588 5.698 1.863 1.00 . A A . 23 LEU HD22 1 1 17 7572 1 1 23 LEU HD23 H 7.507 4.752 3.035 1.00 . A A . 23 LEU HD23 1 1 17 7573 1 1 23 LEU HG H 8.463 7.440 3.116 1.00 . A A . 23 LEU HG 1 1 17 7574 1 1 23 LEU N N 5.053 6.066 4.350 1.00 . A A . 23 LEU N 1 1 17 7575 1 1 23 LEU O O 3.892 8.934 2.802 1.00 . A A . 23 LEU O 1 1 17 7576 1 1 24 GLY C C 1.001 7.883 2.775 1.00 . A A . 24 GLY C 1 1 17 7577 1 1 24 GLY CA C 1.525 8.556 4.058 1.00 . A A . 24 GLY CA 1 1 17 7578 1 1 24 GLY H H 2.880 7.366 5.244 1.00 . A A . 24 GLY H 1 1 17 7579 1 1 24 GLY HA2 H 0.803 8.418 4.853 1.00 . A A . 24 GLY HA2 1 1 17 7580 1 1 24 GLY HA3 H 1.656 9.613 3.876 1.00 . A A . 24 GLY HA3 1 1 17 7581 1 1 24 GLY N N 2.836 7.957 4.464 1.00 . A A . 24 GLY N 1 1 17 7582 1 1 24 GLY O O -0.040 8.247 2.260 1.00 . A A . 24 GLY O 1 1 17 7583 1 1 25 ILE C C 1.794 4.780 0.984 1.00 . A A . 25 ILE C 1 1 17 7584 1 1 25 ILE CA C 1.255 6.216 1.003 1.00 . A A . 25 ILE CA 1 1 17 7585 1 1 25 ILE CB C 1.854 7.007 -0.174 1.00 . A A . 25 ILE CB 1 1 17 7586 1 1 25 ILE CD1 C 2.795 9.184 -0.976 1.00 . A A . 25 ILE CD1 1 1 17 7587 1 1 25 ILE CG1 C 2.218 8.440 0.231 1.00 . A A . 25 ILE CG1 1 1 17 7588 1 1 25 ILE CG2 C 0.830 7.060 -1.293 1.00 . A A . 25 ILE CG2 1 1 17 7589 1 1 25 ILE H H 2.542 6.619 2.681 1.00 . A A . 25 ILE H 1 1 17 7590 1 1 25 ILE HA H 0.178 6.220 0.940 1.00 . A A . 25 ILE HA 1 1 17 7591 1 1 25 ILE HB H 2.733 6.496 -0.530 1.00 . A A . 25 ILE HB 1 1 17 7592 1 1 25 ILE HD11 H 2.555 10.233 -0.902 1.00 . A A . 25 ILE HD11 1 1 17 7593 1 1 25 ILE HD12 H 2.371 8.779 -1.882 1.00 . A A . 25 ILE HD12 1 1 17 7594 1 1 25 ILE HD13 H 3.867 9.058 -0.993 1.00 . A A . 25 ILE HD13 1 1 17 7595 1 1 25 ILE HG12 H 1.333 8.952 0.580 1.00 . A A . 25 ILE HG12 1 1 17 7596 1 1 25 ILE HG13 H 2.953 8.415 1.019 1.00 . A A . 25 ILE HG13 1 1 17 7597 1 1 25 ILE HG21 H -0.152 7.221 -0.875 1.00 . A A . 25 ILE HG21 1 1 17 7598 1 1 25 ILE HG22 H 0.848 6.127 -1.832 1.00 . A A . 25 ILE HG22 1 1 17 7599 1 1 25 ILE HG23 H 1.075 7.870 -1.962 1.00 . A A . 25 ILE HG23 1 1 17 7600 1 1 25 ILE N N 1.710 6.905 2.252 1.00 . A A . 25 ILE N 1 1 17 7601 1 1 25 ILE O O 2.474 4.359 1.905 1.00 . A A . 25 ILE O 1 1 17 7602 1 1 26 CYS C C 3.506 2.682 -0.662 1.00 . A A . 26 CYS C 1 1 17 7603 1 1 26 CYS CA C 2.079 2.634 -0.118 1.00 . A A . 26 CYS CA 1 1 17 7604 1 1 26 CYS CB C 1.169 1.856 -1.072 1.00 . A A . 26 CYS CB 1 1 17 7605 1 1 26 CYS H H 1.012 4.395 -0.820 1.00 . A A . 26 CYS H 1 1 17 7606 1 1 26 CYS HA H 2.064 2.185 0.861 1.00 . A A . 26 CYS HA 1 1 17 7607 1 1 26 CYS HB2 H 0.722 2.531 -1.779 1.00 . A A . 26 CYS HB2 1 1 17 7608 1 1 26 CYS HB3 H 1.753 1.123 -1.603 1.00 . A A . 26 CYS HB3 1 1 17 7609 1 1 26 CYS N N 1.535 4.031 -0.061 1.00 . A A . 26 CYS N 1 1 17 7610 1 1 26 CYS O O 3.759 3.301 -1.676 1.00 . A A . 26 CYS O 1 1 17 7611 1 1 26 CYS SG S -0.137 1.023 -0.135 1.00 . A A . 26 CYS SG 1 1 17 7612 1 1 27 MET C C 6.699 0.905 -0.074 1.00 . A A . 27 MET C 1 1 17 7613 1 1 27 MET CA C 5.857 2.114 -0.514 1.00 . A A . 27 MET CA 1 1 17 7614 1 1 27 MET CB C 6.430 3.411 0.062 1.00 . A A . 27 MET CB 1 1 17 7615 1 1 27 MET CE C 7.915 3.774 -3.199 1.00 . A A . 27 MET CE 1 1 17 7616 1 1 27 MET CG C 6.449 4.486 -1.020 1.00 . A A . 27 MET CG 1 1 17 7617 1 1 27 MET H H 4.242 1.571 0.820 1.00 . A A . 27 MET H 1 1 17 7618 1 1 27 MET HA H 5.852 2.178 -1.586 1.00 . A A . 27 MET HA 1 1 17 7619 1 1 27 MET HB2 H 5.818 3.743 0.886 1.00 . A A . 27 MET HB2 1 1 17 7620 1 1 27 MET HB3 H 7.441 3.238 0.410 1.00 . A A . 27 MET HB3 1 1 17 7621 1 1 27 MET HE1 H 7.586 2.766 -2.992 1.00 . A A . 27 MET HE1 1 1 17 7622 1 1 27 MET HE2 H 8.851 3.742 -3.735 1.00 . A A . 27 MET HE2 1 1 17 7623 1 1 27 MET HE3 H 7.175 4.285 -3.801 1.00 . A A . 27 MET HE3 1 1 17 7624 1 1 27 MET HG2 H 5.792 4.196 -1.829 1.00 . A A . 27 MET HG2 1 1 17 7625 1 1 27 MET HG3 H 6.113 5.421 -0.602 1.00 . A A . 27 MET HG3 1 1 17 7626 1 1 27 MET N N 4.451 2.057 -0.003 1.00 . A A . 27 MET N 1 1 17 7627 1 1 27 MET O O 7.124 0.130 -0.905 1.00 . A A . 27 MET O 1 1 17 7628 1 1 27 MET SD S 8.140 4.668 -1.641 1.00 . A A . 27 MET SD 1 1 17 7629 1 1 28 PRO C C 7.171 -1.712 1.599 1.00 . A A . 28 PRO C 1 1 17 7630 1 1 28 PRO CA C 7.805 -0.308 1.748 1.00 . A A . 28 PRO CA 1 1 17 7631 1 1 28 PRO CB C 7.990 0.071 3.218 1.00 . A A . 28 PRO CB 1 1 17 7632 1 1 28 PRO CD C 6.486 1.689 2.289 1.00 . A A . 28 PRO CD 1 1 17 7633 1 1 28 PRO CG C 6.820 0.936 3.546 1.00 . A A . 28 PRO CG 1 1 17 7634 1 1 28 PRO HA H 8.767 -0.290 1.262 1.00 . A A . 28 PRO HA 1 1 17 7635 1 1 28 PRO HB2 H 7.997 -0.815 3.837 1.00 . A A . 28 PRO HB2 1 1 17 7636 1 1 28 PRO HB3 H 8.905 0.630 3.348 1.00 . A A . 28 PRO HB3 1 1 17 7637 1 1 28 PRO HD2 H 5.420 1.855 2.219 1.00 . A A . 28 PRO HD2 1 1 17 7638 1 1 28 PRO HD3 H 7.018 2.630 2.253 1.00 . A A . 28 PRO HD3 1 1 17 7639 1 1 28 PRO HG2 H 5.982 0.326 3.854 1.00 . A A . 28 PRO HG2 1 1 17 7640 1 1 28 PRO HG3 H 7.084 1.629 4.328 1.00 . A A . 28 PRO HG3 1 1 17 7641 1 1 28 PRO N N 6.953 0.800 1.214 1.00 . A A . 28 PRO N 1 1 17 7642 1 1 28 PRO O O 7.086 -2.460 2.558 1.00 . A A . 28 PRO O 1 1 17 7643 1 1 29 ARG C C 5.879 -3.646 -1.315 1.00 . A A . 29 ARG C 1 1 17 7644 1 1 29 ARG CA C 6.182 -3.444 0.177 1.00 . A A . 29 ARG CA 1 1 17 7645 1 1 29 ARG CB C 4.890 -3.489 0.981 1.00 . A A . 29 ARG CB 1 1 17 7646 1 1 29 ARG CD C 4.565 -4.928 3.004 1.00 . A A . 29 ARG CD 1 1 17 7647 1 1 29 ARG CG C 4.650 -4.915 1.475 1.00 . A A . 29 ARG CG 1 1 17 7648 1 1 29 ARG CZ C 6.544 -5.317 4.410 1.00 . A A . 29 ARG CZ 1 1 17 7649 1 1 29 ARG H H 6.870 -1.480 -0.352 1.00 . A A . 29 ARG H 1 1 17 7650 1 1 29 ARG HA H 6.861 -4.207 0.525 1.00 . A A . 29 ARG HA 1 1 17 7651 1 1 29 ARG HB2 H 4.968 -2.824 1.822 1.00 . A A . 29 ARG HB2 1 1 17 7652 1 1 29 ARG HB3 H 4.076 -3.188 0.353 1.00 . A A . 29 ARG HB3 1 1 17 7653 1 1 29 ARG HD2 H 3.868 -4.172 3.339 1.00 . A A . 29 ARG HD2 1 1 17 7654 1 1 29 ARG HD3 H 4.261 -5.899 3.347 1.00 . A A . 29 ARG HD3 1 1 17 7655 1 1 29 ARG HE H 6.428 -3.838 3.073 1.00 . A A . 29 ARG HE 1 1 17 7656 1 1 29 ARG HG2 H 3.726 -5.286 1.058 1.00 . A A . 29 ARG HG2 1 1 17 7657 1 1 29 ARG HG3 H 5.464 -5.547 1.156 1.00 . A A . 29 ARG HG3 1 1 17 7658 1 1 29 ARG HH11 H 5.028 -6.608 4.708 1.00 . A A . 29 ARG HH11 1 1 17 7659 1 1 29 ARG HH12 H 6.424 -6.866 5.688 1.00 . A A . 29 ARG HH12 1 1 17 7660 1 1 29 ARG HH21 H 8.210 -4.198 4.361 1.00 . A A . 29 ARG HH21 1 1 17 7661 1 1 29 ARG HH22 H 8.219 -5.502 5.498 1.00 . A A . 29 ARG HH22 1 1 17 7662 1 1 29 ARG N N 6.767 -2.087 0.406 1.00 . A A . 29 ARG N 1 1 17 7663 1 1 29 ARG NE N 5.950 -4.607 3.474 1.00 . A A . 29 ARG NE 1 1 17 7664 1 1 29 ARG NH1 N 5.951 -6.342 4.977 1.00 . A A . 29 ARG NH1 1 1 17 7665 1 1 29 ARG NH2 N 7.750 -4.980 4.785 1.00 . A A . 29 ARG NH2 1 1 17 7666 1 1 29 ARG O O 5.477 -4.736 -1.674 1.00 . A A . 29 ARG O 1 1 17 7667 1 1 29 ARG OXT O 6.058 -2.707 -2.070 1.00 . A A . 29 ARG OXT 1 1 18 7668 1 1 1 GLY C C -9.833 1.269 -5.054 1.00 . A A . 1 GLY C 1 1 18 7669 1 1 1 GLY CA C -11.225 1.285 -5.680 1.00 . A A . 1 GLY CA 1 1 18 7670 1 1 1 GLY H1 H -10.564 2.164 -7.451 1.00 . A A . 1 GLY H1 1 1 18 7671 1 1 1 GLY H2 H -12.036 1.331 -7.594 1.00 . A A . 1 GLY H2 1 1 18 7672 1 1 1 GLY H3 H -10.581 0.469 -7.483 1.00 . A A . 1 GLY H3 1 1 18 7673 1 1 1 GLY HA2 H -11.764 2.159 -5.344 1.00 . A A . 1 GLY HA2 1 1 18 7674 1 1 1 GLY HA3 H -11.759 0.396 -5.382 1.00 . A A . 1 GLY HA3 1 1 18 7675 1 1 1 GLY N N -11.092 1.315 -7.165 1.00 . A A . 1 GLY N 1 1 18 7676 1 1 1 GLY O O -9.329 2.288 -4.624 1.00 . A A . 1 GLY O 1 1 18 7677 1 1 2 CYS C C -6.867 0.957 -5.186 1.00 . A A . 2 CYS C 1 1 18 7678 1 1 2 CYS CA C -7.832 0.040 -4.415 1.00 . A A . 2 CYS CA 1 1 18 7679 1 1 2 CYS CB C -7.418 -1.427 -4.576 1.00 . A A . 2 CYS CB 1 1 18 7680 1 1 2 CYS H H -9.634 -0.682 -5.363 1.00 . A A . 2 CYS H 1 1 18 7681 1 1 2 CYS HA H -7.854 0.308 -3.374 1.00 . A A . 2 CYS HA 1 1 18 7682 1 1 2 CYS HB2 H -6.413 -1.561 -4.205 1.00 . A A . 2 CYS HB2 1 1 18 7683 1 1 2 CYS HB3 H -8.094 -2.055 -4.016 1.00 . A A . 2 CYS HB3 1 1 18 7684 1 1 2 CYS N N -9.206 0.124 -5.006 1.00 . A A . 2 CYS N 1 1 18 7685 1 1 2 CYS O O -7.075 1.240 -6.352 1.00 . A A . 2 CYS O 1 1 18 7686 1 1 2 CYS SG S -7.477 -1.881 -6.333 1.00 . A A . 2 CYS SG 1 1 18 7687 1 1 3 LYS C C -3.514 1.597 -5.485 1.00 . A A . 3 LYS C 1 1 18 7688 1 1 3 LYS CA C -4.851 2.312 -5.277 1.00 . A A . 3 LYS CA 1 1 18 7689 1 1 3 LYS CB C -4.669 3.551 -4.388 1.00 . A A . 3 LYS CB 1 1 18 7690 1 1 3 LYS CD C -6.105 4.289 -2.461 1.00 . A A . 3 LYS CD 1 1 18 7691 1 1 3 LYS CE C -5.662 5.710 -2.089 1.00 . A A . 3 LYS CE 1 1 18 7692 1 1 3 LYS CG C -6.037 4.114 -3.984 1.00 . A A . 3 LYS CG 1 1 18 7693 1 1 3 LYS H H -5.668 1.181 -3.624 1.00 . A A . 3 LYS H 1 1 18 7694 1 1 3 LYS HA H -5.253 2.606 -6.230 1.00 . A A . 3 LYS HA 1 1 18 7695 1 1 3 LYS HB2 H -4.101 3.285 -3.508 1.00 . A A . 3 LYS HB2 1 1 18 7696 1 1 3 LYS HB3 H -4.128 4.304 -4.945 1.00 . A A . 3 LYS HB3 1 1 18 7697 1 1 3 LYS HD2 H -7.122 4.127 -2.131 1.00 . A A . 3 LYS HD2 1 1 18 7698 1 1 3 LYS HD3 H -5.455 3.569 -1.984 1.00 . A A . 3 LYS HD3 1 1 18 7699 1 1 3 LYS HE2 H -4.668 5.689 -1.660 1.00 . A A . 3 LYS HE2 1 1 18 7700 1 1 3 LYS HE3 H -5.681 6.348 -2.960 1.00 . A A . 3 LYS HE3 1 1 18 7701 1 1 3 LYS HG2 H -6.188 5.069 -4.465 1.00 . A A . 3 LYS HG2 1 1 18 7702 1 1 3 LYS HG3 H -6.814 3.433 -4.301 1.00 . A A . 3 LYS HG3 1 1 18 7703 1 1 3 LYS HZ1 H -7.556 6.399 -1.548 1.00 . A A . 3 LYS HZ1 1 1 18 7704 1 1 3 LYS HZ2 H -6.287 7.077 -0.647 1.00 . A A . 3 LYS HZ2 1 1 18 7705 1 1 3 LYS HZ3 H -6.790 5.476 -0.339 1.00 . A A . 3 LYS HZ3 1 1 18 7706 1 1 3 LYS N N -5.820 1.421 -4.558 1.00 . A A . 3 LYS N 1 1 18 7707 1 1 3 LYS NZ N -6.649 6.199 -1.083 1.00 . A A . 3 LYS NZ 1 1 18 7708 1 1 3 LYS O O -3.348 0.441 -5.119 1.00 . A A . 3 LYS O 1 1 18 7709 1 1 4 LEU C C -0.290 1.991 -5.132 1.00 . A A . 4 LEU C 1 1 18 7710 1 1 4 LEU CA C -1.229 1.661 -6.307 1.00 . A A . 4 LEU CA 1 1 18 7711 1 1 4 LEU CB C -0.722 2.287 -7.626 1.00 . A A . 4 LEU CB 1 1 18 7712 1 1 4 LEU CD1 C -1.709 0.264 -8.751 1.00 . A A . 4 LEU CD1 1 1 18 7713 1 1 4 LEU CD2 C -2.910 2.439 -8.831 1.00 . A A . 4 LEU CD2 1 1 18 7714 1 1 4 LEU CG C -1.537 1.777 -8.828 1.00 . A A . 4 LEU CG 1 1 18 7715 1 1 4 LEU H H -2.731 3.205 -6.351 1.00 . A A . 4 LEU H 1 1 18 7716 1 1 4 LEU HA H -1.322 0.592 -6.418 1.00 . A A . 4 LEU HA 1 1 18 7717 1 1 4 LEU HB2 H -0.811 3.359 -7.567 1.00 . A A . 4 LEU HB2 1 1 18 7718 1 1 4 LEU HB3 H 0.312 2.026 -7.774 1.00 . A A . 4 LEU HB3 1 1 18 7719 1 1 4 LEU HD11 H -2.100 -0.100 -9.690 1.00 . A A . 4 LEU HD11 1 1 18 7720 1 1 4 LEU HD12 H -2.400 0.024 -7.958 1.00 . A A . 4 LEU HD12 1 1 18 7721 1 1 4 LEU HD13 H -0.754 -0.199 -8.553 1.00 . A A . 4 LEU HD13 1 1 18 7722 1 1 4 LEU HD21 H -2.867 3.351 -8.258 1.00 . A A . 4 LEU HD21 1 1 18 7723 1 1 4 LEU HD22 H -3.629 1.770 -8.389 1.00 . A A . 4 LEU HD22 1 1 18 7724 1 1 4 LEU HD23 H -3.202 2.666 -9.847 1.00 . A A . 4 LEU HD23 1 1 18 7725 1 1 4 LEU HG H -1.018 2.029 -9.742 1.00 . A A . 4 LEU HG 1 1 18 7726 1 1 4 LEU N N -2.564 2.279 -6.067 1.00 . A A . 4 LEU N 1 1 18 7727 1 1 4 LEU O O -0.719 2.100 -3.999 1.00 . A A . 4 LEU O 1 1 18 7728 1 1 5 THR C C 1.868 3.906 -3.867 1.00 . A A . 5 THR C 1 1 18 7729 1 1 5 THR CA C 1.959 2.433 -4.306 1.00 . A A . 5 THR CA 1 1 18 7730 1 1 5 THR CB C 3.349 2.126 -4.901 1.00 . A A . 5 THR CB 1 1 18 7731 1 1 5 THR CG2 C 4.178 1.331 -3.886 1.00 . A A . 5 THR CG2 1 1 18 7732 1 1 5 THR H H 1.293 2.022 -6.310 1.00 . A A . 5 THR H 1 1 18 7733 1 1 5 THR HA H 1.779 1.787 -3.465 1.00 . A A . 5 THR HA 1 1 18 7734 1 1 5 THR HB H 3.854 3.055 -5.120 1.00 . A A . 5 THR HB 1 1 18 7735 1 1 5 THR HG1 H 4.003 1.500 -6.636 1.00 . A A . 5 THR HG1 1 1 18 7736 1 1 5 THR HG21 H 4.916 1.980 -3.438 1.00 . A A . 5 THR HG21 1 1 18 7737 1 1 5 THR HG22 H 4.671 0.509 -4.379 1.00 . A A . 5 THR HG22 1 1 18 7738 1 1 5 THR HG23 H 3.527 0.946 -3.113 1.00 . A A . 5 THR HG23 1 1 18 7739 1 1 5 THR N N 0.978 2.131 -5.394 1.00 . A A . 5 THR N 1 1 18 7740 1 1 5 THR O O 1.381 4.210 -2.797 1.00 . A A . 5 THR O 1 1 18 7741 1 1 5 THR OG1 O 3.210 1.369 -6.101 1.00 . A A . 5 THR OG1 1 1 18 7742 1 1 6 PHE C C 0.893 6.875 -4.345 1.00 . A A . 6 PHE C 1 1 18 7743 1 1 6 PHE CA C 2.308 6.271 -4.276 1.00 . A A . 6 PHE CA 1 1 18 7744 1 1 6 PHE CB C 3.243 6.976 -5.268 1.00 . A A . 6 PHE CB 1 1 18 7745 1 1 6 PHE CD1 C 5.251 6.242 -3.935 1.00 . A A . 6 PHE CD1 1 1 18 7746 1 1 6 PHE CD2 C 5.088 8.562 -4.625 1.00 . A A . 6 PHE CD2 1 1 18 7747 1 1 6 PHE CE1 C 6.476 6.515 -3.308 1.00 . A A . 6 PHE CE1 1 1 18 7748 1 1 6 PHE CE2 C 6.315 8.835 -3.997 1.00 . A A . 6 PHE CE2 1 1 18 7749 1 1 6 PHE CG C 4.558 7.265 -4.596 1.00 . A A . 6 PHE CG 1 1 18 7750 1 1 6 PHE CZ C 7.006 7.811 -3.337 1.00 . A A . 6 PHE CZ 1 1 18 7751 1 1 6 PHE H H 2.741 4.562 -5.522 1.00 . A A . 6 PHE H 1 1 18 7752 1 1 6 PHE HA H 2.699 6.387 -3.279 1.00 . A A . 6 PHE HA 1 1 18 7753 1 1 6 PHE HB2 H 3.415 6.342 -6.124 1.00 . A A . 6 PHE HB2 1 1 18 7754 1 1 6 PHE HB3 H 2.796 7.905 -5.591 1.00 . A A . 6 PHE HB3 1 1 18 7755 1 1 6 PHE HD1 H 4.847 5.245 -3.909 1.00 . A A . 6 PHE HD1 1 1 18 7756 1 1 6 PHE HD2 H 4.558 9.351 -5.132 1.00 . A A . 6 PHE HD2 1 1 18 7757 1 1 6 PHE HE1 H 7.011 5.725 -2.796 1.00 . A A . 6 PHE HE1 1 1 18 7758 1 1 6 PHE HE2 H 6.727 9.837 -4.017 1.00 . A A . 6 PHE HE2 1 1 18 7759 1 1 6 PHE HZ H 7.948 8.020 -2.851 1.00 . A A . 6 PHE HZ 1 1 18 7760 1 1 6 PHE N N 2.344 4.822 -4.670 1.00 . A A . 6 PHE N 1 1 18 7761 1 1 6 PHE O O 0.715 8.008 -4.764 1.00 . A A . 6 PHE O 1 1 18 7762 1 1 7 TRP C C -1.911 6.946 -2.455 1.00 . A A . 7 TRP C 1 1 18 7763 1 1 7 TRP CA C -1.486 6.719 -3.905 1.00 . A A . 7 TRP CA 1 1 18 7764 1 1 7 TRP CB C -2.361 5.664 -4.575 1.00 . A A . 7 TRP CB 1 1 18 7765 1 1 7 TRP CD1 C -0.812 5.450 -6.551 1.00 . A A . 7 TRP CD1 1 1 18 7766 1 1 7 TRP CD2 C -2.958 5.703 -7.164 1.00 . A A . 7 TRP CD2 1 1 18 7767 1 1 7 TRP CE2 C -2.203 5.608 -8.357 1.00 . A A . 7 TRP CE2 1 1 18 7768 1 1 7 TRP CE3 C -4.350 5.862 -7.271 1.00 . A A . 7 TRP CE3 1 1 18 7769 1 1 7 TRP CG C -2.045 5.611 -6.034 1.00 . A A . 7 TRP CG 1 1 18 7770 1 1 7 TRP CH2 C -4.193 5.816 -9.695 1.00 . A A . 7 TRP CH2 1 1 18 7771 1 1 7 TRP CZ2 C -2.810 5.664 -9.610 1.00 . A A . 7 TRP CZ2 1 1 18 7772 1 1 7 TRP CZ3 C -4.962 5.917 -8.529 1.00 . A A . 7 TRP CZ3 1 1 18 7773 1 1 7 TRP H H 0.044 5.258 -3.540 1.00 . A A . 7 TRP H 1 1 18 7774 1 1 7 TRP HA H -1.518 7.638 -4.464 1.00 . A A . 7 TRP HA 1 1 18 7775 1 1 7 TRP HB2 H -2.179 4.702 -4.127 1.00 . A A . 7 TRP HB2 1 1 18 7776 1 1 7 TRP HB3 H -3.396 5.929 -4.444 1.00 . A A . 7 TRP HB3 1 1 18 7777 1 1 7 TRP HD1 H 0.098 5.342 -5.976 1.00 . A A . 7 TRP HD1 1 1 18 7778 1 1 7 TRP HE1 H -0.143 5.383 -8.542 1.00 . A A . 7 TRP HE1 1 1 18 7779 1 1 7 TRP HE3 H -4.954 5.940 -6.373 1.00 . A A . 7 TRP HE3 1 1 18 7780 1 1 7 TRP HH2 H -4.671 5.857 -10.662 1.00 . A A . 7 TRP HH2 1 1 18 7781 1 1 7 TRP HZ2 H -2.221 5.582 -10.508 1.00 . A A . 7 TRP HZ2 1 1 18 7782 1 1 7 TRP HZ3 H -6.033 6.033 -8.604 1.00 . A A . 7 TRP HZ3 1 1 18 7783 1 1 7 TRP N N -0.110 6.157 -3.903 1.00 . A A . 7 TRP N 1 1 18 7784 1 1 7 TRP NE1 N -0.901 5.468 -7.927 1.00 . A A . 7 TRP NE1 1 1 18 7785 1 1 7 TRP O O -2.149 6.000 -1.730 1.00 . A A . 7 TRP O 1 1 18 7786 1 1 8 LYS C C -3.314 7.480 -0.031 1.00 . A A . 8 LYS C 1 1 18 7787 1 1 8 LYS CA C -2.346 8.521 -0.600 1.00 . A A . 8 LYS CA 1 1 18 7788 1 1 8 LYS CB C -3.000 9.914 -0.644 1.00 . A A . 8 LYS CB 1 1 18 7789 1 1 8 LYS CD C -5.353 10.172 -1.468 1.00 . A A . 8 LYS CD 1 1 18 7790 1 1 8 LYS CE C -6.130 11.051 -2.461 1.00 . A A . 8 LYS CE 1 1 18 7791 1 1 8 LYS CG C -3.890 10.062 -1.893 1.00 . A A . 8 LYS CG 1 1 18 7792 1 1 8 LYS H H -1.749 8.925 -2.640 1.00 . A A . 8 LYS H 1 1 18 7793 1 1 8 LYS HA H -1.455 8.561 0.009 1.00 . A A . 8 LYS HA 1 1 18 7794 1 1 8 LYS HB2 H -3.601 10.048 0.244 1.00 . A A . 8 LYS HB2 1 1 18 7795 1 1 8 LYS HB3 H -2.226 10.668 -0.666 1.00 . A A . 8 LYS HB3 1 1 18 7796 1 1 8 LYS HD2 H -5.787 9.184 -1.446 1.00 . A A . 8 LYS HD2 1 1 18 7797 1 1 8 LYS HD3 H -5.405 10.609 -0.484 1.00 . A A . 8 LYS HD3 1 1 18 7798 1 1 8 LYS HE2 H -5.866 10.798 -3.480 1.00 . A A . 8 LYS HE2 1 1 18 7799 1 1 8 LYS HE3 H -7.197 10.935 -2.313 1.00 . A A . 8 LYS HE3 1 1 18 7800 1 1 8 LYS HG2 H -3.604 10.947 -2.441 1.00 . A A . 8 LYS HG2 1 1 18 7801 1 1 8 LYS HG3 H -3.771 9.196 -2.523 1.00 . A A . 8 LYS HG3 1 1 18 7802 1 1 8 LYS HZ1 H -4.687 12.515 -2.105 1.00 . A A . 8 LYS HZ1 1 1 18 7803 1 1 8 LYS HZ2 H -6.124 12.729 -1.225 1.00 . A A . 8 LYS HZ2 1 1 18 7804 1 1 8 LYS HZ3 H -6.080 13.092 -2.883 1.00 . A A . 8 LYS HZ3 1 1 18 7805 1 1 8 LYS N N -1.971 8.194 -2.025 1.00 . A A . 8 LYS N 1 1 18 7806 1 1 8 LYS NZ N -5.723 12.450 -2.146 1.00 . A A . 8 LYS NZ 1 1 18 7807 1 1 8 LYS O O -4.506 7.510 -0.291 1.00 . A A . 8 LYS O 1 1 18 7808 1 1 9 CYS C C -3.835 5.613 2.800 1.00 . A A . 9 CYS C 1 1 18 7809 1 1 9 CYS CA C -3.682 5.472 1.286 1.00 . A A . 9 CYS CA 1 1 18 7810 1 1 9 CYS CB C -2.998 4.141 0.942 1.00 . A A . 9 CYS CB 1 1 18 7811 1 1 9 CYS H H -1.835 6.530 0.896 1.00 . A A . 9 CYS H 1 1 18 7812 1 1 9 CYS HA H -4.651 5.509 0.815 1.00 . A A . 9 CYS HA 1 1 18 7813 1 1 9 CYS HB2 H -3.453 3.347 1.514 1.00 . A A . 9 CYS HB2 1 1 18 7814 1 1 9 CYS HB3 H -3.125 3.938 -0.109 1.00 . A A . 9 CYS HB3 1 1 18 7815 1 1 9 CYS N N -2.802 6.541 0.721 1.00 . A A . 9 CYS N 1 1 18 7816 1 1 9 CYS O O -3.152 6.393 3.435 1.00 . A A . 9 CYS O 1 1 18 7817 1 1 9 CYS SG S -1.225 4.211 1.335 1.00 . A A . 9 CYS SG 1 1 18 7818 1 1 10 LYS C C -4.383 3.630 5.505 1.00 . A A . 10 LYS C 1 1 18 7819 1 1 10 LYS CA C -4.941 4.902 4.852 1.00 . A A . 10 LYS CA 1 1 18 7820 1 1 10 LYS CB C -6.461 4.973 5.041 1.00 . A A . 10 LYS CB 1 1 18 7821 1 1 10 LYS CD C -7.462 6.978 6.168 1.00 . A A . 10 LYS CD 1 1 18 7822 1 1 10 LYS CE C -8.981 6.774 6.255 1.00 . A A . 10 LYS CE 1 1 18 7823 1 1 10 LYS CG C -6.942 6.413 4.840 1.00 . A A . 10 LYS CG 1 1 18 7824 1 1 10 LYS H H -5.261 4.229 2.828 1.00 . A A . 10 LYS H 1 1 18 7825 1 1 10 LYS HA H -4.472 5.779 5.273 1.00 . A A . 10 LYS HA 1 1 18 7826 1 1 10 LYS HB2 H -6.944 4.328 4.318 1.00 . A A . 10 LYS HB2 1 1 18 7827 1 1 10 LYS HB3 H -6.714 4.643 6.037 1.00 . A A . 10 LYS HB3 1 1 18 7828 1 1 10 LYS HD2 H -6.985 6.463 6.990 1.00 . A A . 10 LYS HD2 1 1 18 7829 1 1 10 LYS HD3 H -7.236 8.032 6.225 1.00 . A A . 10 LYS HD3 1 1 18 7830 1 1 10 LYS HE2 H -9.311 6.083 5.492 1.00 . A A . 10 LYS HE2 1 1 18 7831 1 1 10 LYS HE3 H -9.256 6.411 7.235 1.00 . A A . 10 LYS HE3 1 1 18 7832 1 1 10 LYS HG2 H -6.122 7.023 4.490 1.00 . A A . 10 LYS HG2 1 1 18 7833 1 1 10 LYS HG3 H -7.737 6.427 4.110 1.00 . A A . 10 LYS HG3 1 1 18 7834 1 1 10 LYS HZ1 H -9.329 8.464 5.077 1.00 . A A . 10 LYS HZ1 1 1 18 7835 1 1 10 LYS HZ2 H -9.222 8.790 6.743 1.00 . A A . 10 LYS HZ2 1 1 18 7836 1 1 10 LYS HZ3 H -10.614 8.061 6.106 1.00 . A A . 10 LYS HZ3 1 1 18 7837 1 1 10 LYS N N -4.729 4.849 3.375 1.00 . A A . 10 LYS N 1 1 18 7838 1 1 10 LYS NZ N -9.579 8.124 6.027 1.00 . A A . 10 LYS NZ 1 1 18 7839 1 1 10 LYS O O -3.798 3.671 6.569 1.00 . A A . 10 LYS O 1 1 18 7840 1 1 11 ASN C C -3.285 0.432 4.360 1.00 . A A . 11 ASN C 1 1 18 7841 1 1 11 ASN CA C -4.036 1.214 5.442 1.00 . A A . 11 ASN CA 1 1 18 7842 1 1 11 ASN CB C -5.272 0.436 5.925 1.00 . A A . 11 ASN CB 1 1 18 7843 1 1 11 ASN CG C -6.368 0.467 4.855 1.00 . A A . 11 ASN CG 1 1 18 7844 1 1 11 ASN H H -5.030 2.487 4.005 1.00 . A A . 11 ASN H 1 1 18 7845 1 1 11 ASN HA H -3.383 1.416 6.277 1.00 . A A . 11 ASN HA 1 1 18 7846 1 1 11 ASN HB2 H -4.993 -0.586 6.122 1.00 . A A . 11 ASN HB2 1 1 18 7847 1 1 11 ASN HB3 H -5.643 0.889 6.830 1.00 . A A . 11 ASN HB3 1 1 18 7848 1 1 11 ASN HD21 H -5.970 -1.349 4.176 1.00 . A A . 11 ASN HD21 1 1 18 7849 1 1 11 ASN HD22 H -7.241 -0.543 3.396 1.00 . A A . 11 ASN HD22 1 1 18 7850 1 1 11 ASN N N -4.556 2.497 4.868 1.00 . A A . 11 ASN N 1 1 18 7851 1 1 11 ASN ND2 N -6.540 -0.563 4.081 1.00 . A A . 11 ASN ND2 1 1 18 7852 1 1 11 ASN O O -3.424 0.708 3.183 1.00 . A A . 11 ASN O 1 1 18 7853 1 1 11 ASN OD1 O -7.082 1.438 4.729 1.00 . A A . 11 ASN OD1 1 1 18 7854 1 1 12 LYS C C -2.644 -2.041 2.748 1.00 . A A . 12 LYS C 1 1 18 7855 1 1 12 LYS CA C -1.704 -1.312 3.729 1.00 . A A . 12 LYS CA 1 1 18 7856 1 1 12 LYS CB C -0.852 -2.309 4.533 1.00 . A A . 12 LYS CB 1 1 18 7857 1 1 12 LYS CD C -0.955 -3.880 6.478 1.00 . A A . 12 LYS CD 1 1 18 7858 1 1 12 LYS CE C -0.880 -5.407 6.355 1.00 . A A . 12 LYS CE 1 1 18 7859 1 1 12 LYS CG C -1.741 -3.298 5.294 1.00 . A A . 12 LYS CG 1 1 18 7860 1 1 12 LYS H H -2.369 -0.723 5.696 1.00 . A A . 12 LYS H 1 1 18 7861 1 1 12 LYS HA H -1.054 -0.650 3.180 1.00 . A A . 12 LYS HA 1 1 18 7862 1 1 12 LYS HB2 H -0.219 -2.853 3.856 1.00 . A A . 12 LYS HB2 1 1 18 7863 1 1 12 LYS HB3 H -0.236 -1.768 5.237 1.00 . A A . 12 LYS HB3 1 1 18 7864 1 1 12 LYS HD2 H 0.045 -3.470 6.482 1.00 . A A . 12 LYS HD2 1 1 18 7865 1 1 12 LYS HD3 H -1.452 -3.621 7.401 1.00 . A A . 12 LYS HD3 1 1 18 7866 1 1 12 LYS HE2 H -1.795 -5.858 6.721 1.00 . A A . 12 LYS HE2 1 1 18 7867 1 1 12 LYS HE3 H -0.703 -5.697 5.330 1.00 . A A . 12 LYS HE3 1 1 18 7868 1 1 12 LYS HG2 H -2.619 -2.787 5.660 1.00 . A A . 12 LYS HG2 1 1 18 7869 1 1 12 LYS HG3 H -2.036 -4.096 4.630 1.00 . A A . 12 LYS HG3 1 1 18 7870 1 1 12 LYS HZ1 H 0.312 -6.857 7.278 1.00 . A A . 12 LYS HZ1 1 1 18 7871 1 1 12 LYS HZ2 H 0.174 -5.414 8.163 1.00 . A A . 12 LYS HZ2 1 1 18 7872 1 1 12 LYS HZ3 H 1.165 -5.479 6.784 1.00 . A A . 12 LYS HZ3 1 1 18 7873 1 1 12 LYS N N -2.477 -0.528 4.742 1.00 . A A . 12 LYS N 1 1 18 7874 1 1 12 LYS NZ N 0.277 -5.819 7.208 1.00 . A A . 12 LYS NZ 1 1 18 7875 1 1 12 LYS O O -2.337 -2.178 1.582 1.00 . A A . 12 LYS O 1 1 18 7876 1 1 13 LYS C C -5.470 -2.164 1.367 1.00 . A A . 13 LYS C 1 1 18 7877 1 1 13 LYS CA C -4.744 -3.183 2.274 1.00 . A A . 13 LYS CA 1 1 18 7878 1 1 13 LYS CB C -5.744 -3.898 3.195 1.00 . A A . 13 LYS CB 1 1 18 7879 1 1 13 LYS CD C -7.388 -5.780 3.390 1.00 . A A . 13 LYS CD 1 1 18 7880 1 1 13 LYS CE C -8.165 -6.856 2.619 1.00 . A A . 13 LYS CE 1 1 18 7881 1 1 13 LYS CG C -6.437 -5.041 2.440 1.00 . A A . 13 LYS CG 1 1 18 7882 1 1 13 LYS H H -4.028 -2.356 4.138 1.00 . A A . 13 LYS H 1 1 18 7883 1 1 13 LYS HA H -4.217 -3.911 1.674 1.00 . A A . 13 LYS HA 1 1 18 7884 1 1 13 LYS HB2 H -5.219 -4.301 4.048 1.00 . A A . 13 LYS HB2 1 1 18 7885 1 1 13 LYS HB3 H -6.487 -3.190 3.532 1.00 . A A . 13 LYS HB3 1 1 18 7886 1 1 13 LYS HD2 H -6.816 -6.247 4.180 1.00 . A A . 13 LYS HD2 1 1 18 7887 1 1 13 LYS HD3 H -8.085 -5.076 3.820 1.00 . A A . 13 LYS HD3 1 1 18 7888 1 1 13 LYS HE2 H -8.392 -6.512 1.619 1.00 . A A . 13 LYS HE2 1 1 18 7889 1 1 13 LYS HE3 H -7.596 -7.775 2.579 1.00 . A A . 13 LYS HE3 1 1 18 7890 1 1 13 LYS HG2 H -6.999 -4.636 1.610 1.00 . A A . 13 LYS HG2 1 1 18 7891 1 1 13 LYS HG3 H -5.694 -5.732 2.070 1.00 . A A . 13 LYS HG3 1 1 18 7892 1 1 13 LYS HZ1 H -9.874 -7.957 3.101 1.00 . A A . 13 LYS HZ1 1 1 18 7893 1 1 13 LYS HZ2 H -10.078 -6.279 3.233 1.00 . A A . 13 LYS HZ2 1 1 18 7894 1 1 13 LYS HZ3 H -9.204 -7.126 4.416 1.00 . A A . 13 LYS HZ3 1 1 18 7895 1 1 13 LYS N N -3.791 -2.488 3.200 1.00 . A A . 13 LYS N 1 1 18 7896 1 1 13 LYS NZ N -9.422 -7.069 3.400 1.00 . A A . 13 LYS NZ 1 1 18 7897 1 1 13 LYS O O -6.334 -2.526 0.593 1.00 . A A . 13 LYS O 1 1 18 7898 1 1 14 GLU C C -5.270 0.058 -0.848 1.00 . A A . 14 GLU C 1 1 18 7899 1 1 14 GLU CA C -5.809 0.127 0.595 1.00 . A A . 14 GLU CA 1 1 18 7900 1 1 14 GLU CB C -5.468 1.469 1.251 1.00 . A A . 14 GLU CB 1 1 18 7901 1 1 14 GLU CD C -6.906 3.519 1.141 1.00 . A A . 14 GLU CD 1 1 18 7902 1 1 14 GLU CG C -5.947 2.617 0.362 1.00 . A A . 14 GLU CG 1 1 18 7903 1 1 14 GLU H H -4.436 -0.610 2.079 1.00 . A A . 14 GLU H 1 1 18 7904 1 1 14 GLU HA H -6.880 -0.026 0.603 1.00 . A A . 14 GLU HA 1 1 18 7905 1 1 14 GLU HB2 H -5.957 1.532 2.214 1.00 . A A . 14 GLU HB2 1 1 18 7906 1 1 14 GLU HB3 H -4.400 1.542 1.386 1.00 . A A . 14 GLU HB3 1 1 18 7907 1 1 14 GLU HG2 H -5.099 3.192 0.029 1.00 . A A . 14 GLU HG2 1 1 18 7908 1 1 14 GLU HG3 H -6.461 2.212 -0.489 1.00 . A A . 14 GLU HG3 1 1 18 7909 1 1 14 GLU N N -5.133 -0.893 1.452 1.00 . A A . 14 GLU N 1 1 18 7910 1 1 14 GLU O O -5.962 0.390 -1.798 1.00 . A A . 14 GLU O 1 1 18 7911 1 1 14 GLU OE1 O -7.854 2.999 1.699 1.00 . A A . 14 GLU OE1 1 1 18 7912 1 1 14 GLU OE2 O -6.682 4.716 1.154 1.00 . A A . 14 GLU OE2 1 1 18 7913 1 1 15 CYS C C -3.744 -1.908 -2.952 1.00 . A A . 15 CYS C 1 1 18 7914 1 1 15 CYS CA C -3.506 -0.490 -2.422 1.00 . A A . 15 CYS CA 1 1 18 7915 1 1 15 CYS CB C -1.992 -0.168 -2.382 1.00 . A A . 15 CYS CB 1 1 18 7916 1 1 15 CYS H H -3.518 -0.678 -0.260 1.00 . A A . 15 CYS H 1 1 18 7917 1 1 15 CYS HA H -4.008 0.221 -3.060 1.00 . A A . 15 CYS HA 1 1 18 7918 1 1 15 CYS HB2 H -1.467 -0.871 -3.010 1.00 . A A . 15 CYS HB2 1 1 18 7919 1 1 15 CYS HB3 H -1.842 0.825 -2.772 1.00 . A A . 15 CYS HB3 1 1 18 7920 1 1 15 CYS N N -4.053 -0.390 -1.030 1.00 . A A . 15 CYS N 1 1 18 7921 1 1 15 CYS O O -3.622 -2.877 -2.224 1.00 . A A . 15 CYS O 1 1 18 7922 1 1 15 CYS SG S -1.308 -0.257 -0.698 1.00 . A A . 15 CYS SG 1 1 18 7923 1 1 16 CYS C C -3.097 -4.258 -4.655 1.00 . A A . 16 CYS C 1 1 18 7924 1 1 16 CYS CA C -4.355 -3.406 -4.770 1.00 . A A . 16 CYS CA 1 1 18 7925 1 1 16 CYS CB C -4.747 -3.201 -6.234 1.00 . A A . 16 CYS CB 1 1 18 7926 1 1 16 CYS H H -4.195 -1.241 -4.778 1.00 . A A . 16 CYS H 1 1 18 7927 1 1 16 CYS HA H -5.164 -3.872 -4.237 1.00 . A A . 16 CYS HA 1 1 18 7928 1 1 16 CYS HB2 H -4.596 -2.168 -6.512 1.00 . A A . 16 CYS HB2 1 1 18 7929 1 1 16 CYS HB3 H -4.139 -3.836 -6.862 1.00 . A A . 16 CYS HB3 1 1 18 7930 1 1 16 CYS N N -4.097 -2.040 -4.210 1.00 . A A . 16 CYS N 1 1 18 7931 1 1 16 CYS O O -3.120 -5.322 -4.068 1.00 . A A . 16 CYS O 1 1 18 7932 1 1 16 CYS SG S -6.492 -3.642 -6.444 1.00 . A A . 16 CYS SG 1 1 18 7933 1 1 17 GLY C C -0.336 -4.567 -3.583 1.00 . A A . 17 GLY C 1 1 18 7934 1 1 17 GLY CA C -0.738 -4.582 -5.059 1.00 . A A . 17 GLY CA 1 1 18 7935 1 1 17 GLY H H -1.987 -2.925 -5.635 1.00 . A A . 17 GLY H 1 1 18 7936 1 1 17 GLY HA2 H -0.904 -5.599 -5.392 1.00 . A A . 17 GLY HA2 1 1 18 7937 1 1 17 GLY HA3 H 0.042 -4.127 -5.648 1.00 . A A . 17 GLY HA3 1 1 18 7938 1 1 17 GLY N N -1.995 -3.793 -5.182 1.00 . A A . 17 GLY N 1 1 18 7939 1 1 17 GLY O O 0.136 -3.563 -3.091 1.00 . A A . 17 GLY O 1 1 18 7940 1 1 18 TRP C C 1.035 -4.933 -1.073 1.00 . A A . 18 TRP C 1 1 18 7941 1 1 18 TRP CA C -0.234 -5.728 -1.413 1.00 . A A . 18 TRP CA 1 1 18 7942 1 1 18 TRP CB C -0.055 -7.219 -1.104 1.00 . A A . 18 TRP CB 1 1 18 7943 1 1 18 TRP CD1 C -2.313 -7.128 0.043 1.00 . A A . 18 TRP CD1 1 1 18 7944 1 1 18 TRP CD2 C -1.896 -9.130 -0.893 1.00 . A A . 18 TRP CD2 1 1 18 7945 1 1 18 TRP CE2 C -3.178 -9.218 -0.299 1.00 . A A . 18 TRP CE2 1 1 18 7946 1 1 18 TRP CE3 C -1.394 -10.259 -1.557 1.00 . A A . 18 TRP CE3 1 1 18 7947 1 1 18 TRP CG C -1.368 -7.793 -0.665 1.00 . A A . 18 TRP CG 1 1 18 7948 1 1 18 TRP CH2 C -3.414 -11.506 -1.016 1.00 . A A . 18 TRP CH2 1 1 18 7949 1 1 18 TRP CZ2 C -3.928 -10.390 -0.353 1.00 . A A . 18 TRP CZ2 1 1 18 7950 1 1 18 TRP CZ3 C -2.147 -11.442 -1.613 1.00 . A A . 18 TRP CZ3 1 1 18 7951 1 1 18 TRP H H -0.977 -6.425 -3.311 1.00 . A A . 18 TRP H 1 1 18 7952 1 1 18 TRP HA H -1.064 -5.341 -0.841 1.00 . A A . 18 TRP HA 1 1 18 7953 1 1 18 TRP HB2 H 0.289 -7.732 -1.991 1.00 . A A . 18 TRP HB2 1 1 18 7954 1 1 18 TRP HB3 H 0.671 -7.341 -0.314 1.00 . A A . 18 TRP HB3 1 1 18 7955 1 1 18 TRP HD1 H -2.243 -6.103 0.381 1.00 . A A . 18 TRP HD1 1 1 18 7956 1 1 18 TRP HE1 H -4.204 -7.737 0.748 1.00 . A A . 18 TRP HE1 1 1 18 7957 1 1 18 TRP HE3 H -0.421 -10.223 -2.020 1.00 . A A . 18 TRP HE3 1 1 18 7958 1 1 18 TRP HH2 H -3.989 -12.419 -1.063 1.00 . A A . 18 TRP HH2 1 1 18 7959 1 1 18 TRP HZ2 H -4.905 -10.434 0.107 1.00 . A A . 18 TRP HZ2 1 1 18 7960 1 1 18 TRP HZ3 H -1.750 -12.306 -2.123 1.00 . A A . 18 TRP HZ3 1 1 18 7961 1 1 18 TRP N N -0.559 -5.656 -2.878 1.00 . A A . 18 TRP N 1 1 18 7962 1 1 18 TRP NE1 N -3.385 -7.973 0.260 1.00 . A A . 18 TRP NE1 1 1 18 7963 1 1 18 TRP O O 2.152 -5.401 -1.219 1.00 . A A . 18 TRP O 1 1 18 7964 1 1 19 ASN C C 1.744 -2.259 1.130 1.00 . A A . 19 ASN C 1 1 18 7965 1 1 19 ASN CA C 1.988 -2.848 -0.258 1.00 . A A . 19 ASN CA 1 1 18 7966 1 1 19 ASN CB C 1.987 -1.767 -1.338 1.00 . A A . 19 ASN CB 1 1 18 7967 1 1 19 ASN CG C 3.277 -0.959 -1.255 1.00 . A A . 19 ASN CG 1 1 18 7968 1 1 19 ASN H H -0.072 -3.392 -0.523 1.00 . A A . 19 ASN H 1 1 18 7969 1 1 19 ASN HA H 2.918 -3.391 -0.280 1.00 . A A . 19 ASN HA 1 1 18 7970 1 1 19 ASN HB2 H 1.919 -2.234 -2.309 1.00 . A A . 19 ASN HB2 1 1 18 7971 1 1 19 ASN HB3 H 1.141 -1.116 -1.192 1.00 . A A . 19 ASN HB3 1 1 18 7972 1 1 19 ASN HD21 H 4.052 -1.727 -2.908 1.00 . A A . 19 ASN HD21 1 1 18 7973 1 1 19 ASN HD22 H 5.014 -0.575 -2.120 1.00 . A A . 19 ASN HD22 1 1 18 7974 1 1 19 ASN N N 0.846 -3.727 -0.621 1.00 . A A . 19 ASN N 1 1 18 7975 1 1 19 ASN ND2 N 4.189 -1.102 -2.169 1.00 . A A . 19 ASN ND2 1 1 18 7976 1 1 19 ASN O O 0.690 -2.444 1.711 1.00 . A A . 19 ASN O 1 1 18 7977 1 1 19 ASN OD1 O 3.454 -0.192 -0.343 1.00 . A A . 19 ASN OD1 1 1 18 7978 1 1 20 ALA C C 2.283 0.514 2.987 1.00 . A A . 20 ALA C 1 1 18 7979 1 1 20 ALA CA C 2.499 -0.999 3.044 1.00 . A A . 20 ALA CA 1 1 18 7980 1 1 20 ALA CB C 3.787 -1.315 3.790 1.00 . A A . 20 ALA CB 1 1 18 7981 1 1 20 ALA H H 3.548 -1.433 1.214 1.00 . A A . 20 ALA H 1 1 18 7982 1 1 20 ALA HA H 1.670 -1.482 3.532 1.00 . A A . 20 ALA HA 1 1 18 7983 1 1 20 ALA HB1 H 4.254 -2.183 3.351 1.00 . A A . 20 ALA HB1 1 1 18 7984 1 1 20 ALA HB2 H 3.567 -1.511 4.829 1.00 . A A . 20 ALA HB2 1 1 18 7985 1 1 20 ALA HB3 H 4.462 -0.471 3.718 1.00 . A A . 20 ALA HB3 1 1 18 7986 1 1 20 ALA N N 2.699 -1.569 1.685 1.00 . A A . 20 ALA N 1 1 18 7987 1 1 20 ALA O O 3.109 1.253 2.475 1.00 . A A . 20 ALA O 1 1 18 7988 1 1 21 CYS C C 1.786 3.061 4.683 1.00 . A A . 21 CYS C 1 1 18 7989 1 1 21 CYS CA C 0.943 2.459 3.551 1.00 . A A . 21 CYS CA 1 1 18 7990 1 1 21 CYS CB C -0.558 2.600 3.828 1.00 . A A . 21 CYS CB 1 1 18 7991 1 1 21 CYS H H 0.563 0.372 3.968 1.00 . A A . 21 CYS H 1 1 18 7992 1 1 21 CYS HA H 1.197 2.897 2.602 1.00 . A A . 21 CYS HA 1 1 18 7993 1 1 21 CYS HB2 H -1.097 1.858 3.257 1.00 . A A . 21 CYS HB2 1 1 18 7994 1 1 21 CYS HB3 H -0.744 2.447 4.882 1.00 . A A . 21 CYS HB3 1 1 18 7995 1 1 21 CYS N N 1.197 0.986 3.538 1.00 . A A . 21 CYS N 1 1 18 7996 1 1 21 CYS O O 1.342 3.180 5.807 1.00 . A A . 21 CYS O 1 1 18 7997 1 1 21 CYS SG S -1.121 4.255 3.353 1.00 . A A . 21 CYS SG 1 1 18 7998 1 1 22 ALA C C 4.190 5.413 5.351 1.00 . A A . 22 ALA C 1 1 18 7999 1 1 22 ALA CA C 3.935 3.904 5.471 1.00 . A A . 22 ALA CA 1 1 18 8000 1 1 22 ALA CB C 5.241 3.125 5.263 1.00 . A A . 22 ALA CB 1 1 18 8001 1 1 22 ALA H H 3.374 3.231 3.496 1.00 . A A . 22 ALA H 1 1 18 8002 1 1 22 ALA HA H 3.533 3.675 6.442 1.00 . A A . 22 ALA HA 1 1 18 8003 1 1 22 ALA HB1 H 5.512 3.145 4.213 1.00 . A A . 22 ALA HB1 1 1 18 8004 1 1 22 ALA HB2 H 5.104 2.102 5.577 1.00 . A A . 22 ALA HB2 1 1 18 8005 1 1 22 ALA HB3 H 6.032 3.577 5.845 1.00 . A A . 22 ALA HB3 1 1 18 8006 1 1 22 ALA N N 3.026 3.381 4.401 1.00 . A A . 22 ALA N 1 1 18 8007 1 1 22 ALA O O 3.751 6.193 6.175 1.00 . A A . 22 ALA O 1 1 18 8008 1 1 23 LEU C C 4.032 8.043 3.652 1.00 . A A . 23 LEU C 1 1 18 8009 1 1 23 LEU CA C 5.249 7.276 4.196 1.00 . A A . 23 LEU CA 1 1 18 8010 1 1 23 LEU CB C 6.413 7.303 3.185 1.00 . A A . 23 LEU CB 1 1 18 8011 1 1 23 LEU CD1 C 7.568 6.044 5.066 1.00 . A A . 23 LEU CD1 1 1 18 8012 1 1 23 LEU CD2 C 8.693 6.316 2.866 1.00 . A A . 23 LEU CD2 1 1 18 8013 1 1 23 LEU CG C 7.758 6.985 3.874 1.00 . A A . 23 LEU CG 1 1 18 8014 1 1 23 LEU H H 5.284 5.172 3.719 1.00 . A A . 23 LEU H 1 1 18 8015 1 1 23 LEU HA H 5.569 7.697 5.136 1.00 . A A . 23 LEU HA 1 1 18 8016 1 1 23 LEU HB2 H 6.229 6.581 2.404 1.00 . A A . 23 LEU HB2 1 1 18 8017 1 1 23 LEU HB3 H 6.471 8.289 2.744 1.00 . A A . 23 LEU HB3 1 1 18 8018 1 1 23 LEU HD11 H 8.520 5.893 5.557 1.00 . A A . 23 LEU HD11 1 1 18 8019 1 1 23 LEU HD12 H 7.192 5.094 4.722 1.00 . A A . 23 LEU HD12 1 1 18 8020 1 1 23 LEU HD13 H 6.870 6.479 5.766 1.00 . A A . 23 LEU HD13 1 1 18 8021 1 1 23 LEU HD21 H 8.562 5.244 2.909 1.00 . A A . 23 LEU HD21 1 1 18 8022 1 1 23 LEU HD22 H 9.716 6.564 3.111 1.00 . A A . 23 LEU HD22 1 1 18 8023 1 1 23 LEU HD23 H 8.466 6.670 1.872 1.00 . A A . 23 LEU HD23 1 1 18 8024 1 1 23 LEU HG H 8.209 7.905 4.216 1.00 . A A . 23 LEU HG 1 1 18 8025 1 1 23 LEU N N 4.924 5.824 4.356 1.00 . A A . 23 LEU N 1 1 18 8026 1 1 23 LEU O O 4.123 8.736 2.661 1.00 . A A . 23 LEU O 1 1 18 8027 1 1 24 GLY C C 1.151 7.983 2.503 1.00 . A A . 24 GLY C 1 1 18 8028 1 1 24 GLY CA C 1.669 8.635 3.796 1.00 . A A . 24 GLY CA 1 1 18 8029 1 1 24 GLY H H 2.832 7.351 5.085 1.00 . A A . 24 GLY H 1 1 18 8030 1 1 24 GLY HA2 H 0.897 8.588 4.553 1.00 . A A . 24 GLY HA2 1 1 18 8031 1 1 24 GLY HA3 H 1.918 9.665 3.601 1.00 . A A . 24 GLY HA3 1 1 18 8032 1 1 24 GLY N N 2.889 7.918 4.287 1.00 . A A . 24 GLY N 1 1 18 8033 1 1 24 GLY O O 0.200 8.457 1.902 1.00 . A A . 24 GLY O 1 1 18 8034 1 1 25 ILE C C 1.734 4.753 0.875 1.00 . A A . 25 ILE C 1 1 18 8035 1 1 25 ILE CA C 1.312 6.219 0.820 1.00 . A A . 25 ILE CA 1 1 18 8036 1 1 25 ILE CB C 2.038 6.894 -0.356 1.00 . A A . 25 ILE CB 1 1 18 8037 1 1 25 ILE CD1 C 3.565 8.721 -1.123 1.00 . A A . 25 ILE CD1 1 1 18 8038 1 1 25 ILE CG1 C 2.870 8.100 0.095 1.00 . A A . 25 ILE CG1 1 1 18 8039 1 1 25 ILE CG2 C 1.019 7.352 -1.389 1.00 . A A . 25 ILE CG2 1 1 18 8040 1 1 25 ILE H H 2.518 6.538 2.567 1.00 . A A . 25 ILE H 1 1 18 8041 1 1 25 ILE HA H 0.244 6.310 0.698 1.00 . A A . 25 ILE HA 1 1 18 8042 1 1 25 ILE HB H 2.688 6.164 -0.812 1.00 . A A . 25 ILE HB 1 1 18 8043 1 1 25 ILE HD11 H 3.197 8.251 -2.021 1.00 . A A . 25 ILE HD11 1 1 18 8044 1 1 25 ILE HD12 H 4.631 8.567 -1.045 1.00 . A A . 25 ILE HD12 1 1 18 8045 1 1 25 ILE HD13 H 3.354 9.778 -1.156 1.00 . A A . 25 ILE HD13 1 1 18 8046 1 1 25 ILE HG12 H 2.224 8.831 0.560 1.00 . A A . 25 ILE HG12 1 1 18 8047 1 1 25 ILE HG13 H 3.615 7.774 0.808 1.00 . A A . 25 ILE HG13 1 1 18 8048 1 1 25 ILE HG21 H 0.443 6.503 -1.724 1.00 . A A . 25 ILE HG21 1 1 18 8049 1 1 25 ILE HG22 H 1.536 7.790 -2.233 1.00 . A A . 25 ILE HG22 1 1 18 8050 1 1 25 ILE HG23 H 0.362 8.085 -0.947 1.00 . A A . 25 ILE HG23 1 1 18 8051 1 1 25 ILE N N 1.762 6.905 2.068 1.00 . A A . 25 ILE N 1 1 18 8052 1 1 25 ILE O O 2.407 4.331 1.800 1.00 . A A . 25 ILE O 1 1 18 8053 1 1 26 CYS C C 3.280 2.545 -0.651 1.00 . A A . 26 CYS C 1 1 18 8054 1 1 26 CYS CA C 1.845 2.564 -0.133 1.00 . A A . 26 CYS CA 1 1 18 8055 1 1 26 CYS CB C 0.892 1.830 -1.087 1.00 . A A . 26 CYS CB 1 1 18 8056 1 1 26 CYS H H 0.904 4.352 -0.897 1.00 . A A . 26 CYS H 1 1 18 8057 1 1 26 CYS HA H 1.790 2.142 0.859 1.00 . A A . 26 CYS HA 1 1 18 8058 1 1 26 CYS HB2 H 0.786 2.399 -1.996 1.00 . A A . 26 CYS HB2 1 1 18 8059 1 1 26 CYS HB3 H 1.296 0.859 -1.318 1.00 . A A . 26 CYS HB3 1 1 18 8060 1 1 26 CYS N N 1.400 3.984 -0.127 1.00 . A A . 26 CYS N 1 1 18 8061 1 1 26 CYS O O 3.530 2.928 -1.776 1.00 . A A . 26 CYS O 1 1 18 8062 1 1 26 CYS SG S -0.728 1.639 -0.294 1.00 . A A . 26 CYS SG 1 1 18 8063 1 1 27 MET C C 6.437 0.925 0.116 1.00 . A A . 27 MET C 1 1 18 8064 1 1 27 MET CA C 5.641 2.171 -0.342 1.00 . A A . 27 MET CA 1 1 18 8065 1 1 27 MET CB C 6.206 3.475 0.227 1.00 . A A . 27 MET CB 1 1 18 8066 1 1 27 MET CE C 8.378 5.421 -0.669 1.00 . A A . 27 MET CE 1 1 18 8067 1 1 27 MET CG C 5.749 4.666 -0.617 1.00 . A A . 27 MET CG 1 1 18 8068 1 1 27 MET H H 4.034 1.860 1.071 1.00 . A A . 27 MET H 1 1 18 8069 1 1 27 MET HA H 5.648 2.222 -1.413 1.00 . A A . 27 MET HA 1 1 18 8070 1 1 27 MET HB2 H 5.845 3.605 1.235 1.00 . A A . 27 MET HB2 1 1 18 8071 1 1 27 MET HB3 H 7.282 3.428 0.236 1.00 . A A . 27 MET HB3 1 1 18 8072 1 1 27 MET HE1 H 8.238 4.623 -1.386 1.00 . A A . 27 MET HE1 1 1 18 8073 1 1 27 MET HE2 H 8.875 5.032 0.205 1.00 . A A . 27 MET HE2 1 1 18 8074 1 1 27 MET HE3 H 8.984 6.202 -1.106 1.00 . A A . 27 MET HE3 1 1 18 8075 1 1 27 MET HG2 H 5.850 4.438 -1.668 1.00 . A A . 27 MET HG2 1 1 18 8076 1 1 27 MET HG3 H 4.713 4.885 -0.398 1.00 . A A . 27 MET HG3 1 1 18 8077 1 1 27 MET N N 4.236 2.150 0.150 1.00 . A A . 27 MET N 1 1 18 8078 1 1 27 MET O O 6.586 -0.010 -0.652 1.00 . A A . 27 MET O 1 1 18 8079 1 1 27 MET SD S 6.766 6.107 -0.200 1.00 . A A . 27 MET SD 1 1 18 8080 1 1 28 PRO C C 6.877 -1.376 2.261 1.00 . A A . 28 PRO C 1 1 18 8081 1 1 28 PRO CA C 7.763 -0.212 1.821 1.00 . A A . 28 PRO CA 1 1 18 8082 1 1 28 PRO CB C 8.512 0.355 3.021 1.00 . A A . 28 PRO CB 1 1 18 8083 1 1 28 PRO CD C 6.856 1.989 2.344 1.00 . A A . 28 PRO CD 1 1 18 8084 1 1 28 PRO CG C 7.659 1.472 3.512 1.00 . A A . 28 PRO CG 1 1 18 8085 1 1 28 PRO HA H 8.459 -0.537 1.070 1.00 . A A . 28 PRO HA 1 1 18 8086 1 1 28 PRO HB2 H 8.612 -0.404 3.787 1.00 . A A . 28 PRO HB2 1 1 18 8087 1 1 28 PRO HB3 H 9.481 0.729 2.731 1.00 . A A . 28 PRO HB3 1 1 18 8088 1 1 28 PRO HD2 H 5.825 2.140 2.636 1.00 . A A . 28 PRO HD2 1 1 18 8089 1 1 28 PRO HD3 H 7.289 2.901 1.972 1.00 . A A . 28 PRO HD3 1 1 18 8090 1 1 28 PRO HG2 H 6.998 1.109 4.286 1.00 . A A . 28 PRO HG2 1 1 18 8091 1 1 28 PRO HG3 H 8.282 2.257 3.901 1.00 . A A . 28 PRO HG3 1 1 18 8092 1 1 28 PRO N N 6.955 0.940 1.328 1.00 . A A . 28 PRO N 1 1 18 8093 1 1 28 PRO O O 6.434 -1.423 3.396 1.00 . A A . 28 PRO O 1 1 18 8094 1 1 29 ARG C C 6.367 -4.282 2.877 1.00 . A A . 29 ARG C 1 1 18 8095 1 1 29 ARG CA C 5.775 -3.501 1.709 1.00 . A A . 29 ARG CA 1 1 18 8096 1 1 29 ARG CB C 5.758 -4.381 0.436 1.00 . A A . 29 ARG CB 1 1 18 8097 1 1 29 ARG CD C 6.439 -3.464 -1.773 1.00 . A A . 29 ARG CD 1 1 18 8098 1 1 29 ARG CG C 5.297 -3.559 -0.765 1.00 . A A . 29 ARG CG 1 1 18 8099 1 1 29 ARG CZ C 6.703 -4.722 -3.860 1.00 . A A . 29 ARG CZ 1 1 18 8100 1 1 29 ARG H H 7.026 -2.221 0.484 1.00 . A A . 29 ARG H 1 1 18 8101 1 1 29 ARG HA H 4.777 -3.185 1.952 1.00 . A A . 29 ARG HA 1 1 18 8102 1 1 29 ARG HB2 H 6.750 -4.757 0.247 1.00 . A A . 29 ARG HB2 1 1 18 8103 1 1 29 ARG HB3 H 5.082 -5.217 0.579 1.00 . A A . 29 ARG HB3 1 1 18 8104 1 1 29 ARG HD2 H 6.323 -2.581 -2.385 1.00 . A A . 29 ARG HD2 1 1 18 8105 1 1 29 ARG HD3 H 7.385 -3.445 -1.259 1.00 . A A . 29 ARG HD3 1 1 18 8106 1 1 29 ARG HE H 5.945 -5.520 -2.191 1.00 . A A . 29 ARG HE 1 1 18 8107 1 1 29 ARG HG2 H 4.436 -4.032 -1.232 1.00 . A A . 29 ARG HG2 1 1 18 8108 1 1 29 ARG HG3 H 5.032 -2.571 -0.433 1.00 . A A . 29 ARG HG3 1 1 18 8109 1 1 29 ARG HH11 H 7.421 -2.847 -3.875 1.00 . A A . 29 ARG HH11 1 1 18 8110 1 1 29 ARG HH12 H 7.554 -3.696 -5.366 1.00 . A A . 29 ARG HH12 1 1 18 8111 1 1 29 ARG HH21 H 6.115 -6.611 -4.158 1.00 . A A . 29 ARG HH21 1 1 18 8112 1 1 29 ARG HH22 H 6.823 -5.834 -5.536 1.00 . A A . 29 ARG HH22 1 1 18 8113 1 1 29 ARG N N 6.635 -2.306 1.375 1.00 . A A . 29 ARG N 1 1 18 8114 1 1 29 ARG NE N 6.328 -4.705 -2.594 1.00 . A A . 29 ARG NE 1 1 18 8115 1 1 29 ARG NH1 N 7.265 -3.669 -4.407 1.00 . A A . 29 ARG NH1 1 1 18 8116 1 1 29 ARG NH2 N 6.530 -5.802 -4.574 1.00 . A A . 29 ARG NH2 1 1 18 8117 1 1 29 ARG O O 5.614 -4.620 3.768 1.00 . A A . 29 ARG O 1 1 18 8118 1 1 29 ARG OXT O 7.558 -4.531 2.860 1.00 . A A . 29 ARG OXT 1 1 19 8119 1 1 1 GLY C C -9.957 0.092 -3.797 1.00 . A A . 1 GLY C 1 1 19 8120 1 1 1 GLY CA C -11.323 0.778 -3.698 1.00 . A A . 1 GLY CA 1 1 19 8121 1 1 1 GLY H1 H -12.989 -0.270 -4.379 1.00 . A A . 1 GLY H1 1 1 19 8122 1 1 1 GLY H2 H -12.965 -0.024 -2.700 1.00 . A A . 1 GLY H2 1 1 19 8123 1 1 1 GLY H3 H -11.948 -1.187 -3.407 1.00 . A A . 1 GLY H3 1 1 19 8124 1 1 1 GLY HA2 H -11.513 1.348 -4.597 1.00 . A A . 1 GLY HA2 1 1 19 8125 1 1 1 GLY HA3 H -11.330 1.435 -2.845 1.00 . A A . 1 GLY HA3 1 1 19 8126 1 1 1 GLY N N -12.386 -0.254 -3.533 1.00 . A A . 1 GLY N 1 1 19 8127 1 1 1 GLY O O -9.779 -1.020 -3.338 1.00 . A A . 1 GLY O 1 1 19 8128 1 1 2 CYS C C -6.668 1.125 -5.167 1.00 . A A . 2 CYS C 1 1 19 8129 1 1 2 CYS CA C -7.635 0.119 -4.541 1.00 . A A . 2 CYS CA 1 1 19 8130 1 1 2 CYS CB C -7.831 -1.078 -5.479 1.00 . A A . 2 CYS CB 1 1 19 8131 1 1 2 CYS H H -9.162 1.629 -4.774 1.00 . A A . 2 CYS H 1 1 19 8132 1 1 2 CYS HA H -7.268 -0.213 -3.583 1.00 . A A . 2 CYS HA 1 1 19 8133 1 1 2 CYS HB2 H -8.785 -1.540 -5.281 1.00 . A A . 2 CYS HB2 1 1 19 8134 1 1 2 CYS HB3 H -7.802 -0.736 -6.503 1.00 . A A . 2 CYS HB3 1 1 19 8135 1 1 2 CYS N N -8.992 0.736 -4.400 1.00 . A A . 2 CYS N 1 1 19 8136 1 1 2 CYS O O -6.823 1.510 -6.310 1.00 . A A . 2 CYS O 1 1 19 8137 1 1 2 CYS SG S -6.507 -2.285 -5.212 1.00 . A A . 2 CYS SG 1 1 19 8138 1 1 3 LYS C C -3.365 1.868 -5.300 1.00 . A A . 3 LYS C 1 1 19 8139 1 1 3 LYS CA C -4.700 2.545 -5.003 1.00 . A A . 3 LYS CA 1 1 19 8140 1 1 3 LYS CB C -4.495 3.634 -3.940 1.00 . A A . 3 LYS CB 1 1 19 8141 1 1 3 LYS CD C -5.687 4.162 -1.801 1.00 . A A . 3 LYS CD 1 1 19 8142 1 1 3 LYS CE C -6.596 5.275 -1.265 1.00 . A A . 3 LYS CE 1 1 19 8143 1 1 3 LYS CG C -5.832 4.062 -3.325 1.00 . A A . 3 LYS CG 1 1 19 8144 1 1 3 LYS H H -5.564 1.238 -3.514 1.00 . A A . 3 LYS H 1 1 19 8145 1 1 3 LYS HA H -5.092 2.983 -5.905 1.00 . A A . 3 LYS HA 1 1 19 8146 1 1 3 LYS HB2 H -3.842 3.262 -3.165 1.00 . A A . 3 LYS HB2 1 1 19 8147 1 1 3 LYS HB3 H -4.033 4.488 -4.404 1.00 . A A . 3 LYS HB3 1 1 19 8148 1 1 3 LYS HD2 H -5.962 3.218 -1.348 1.00 . A A . 3 LYS HD2 1 1 19 8149 1 1 3 LYS HD3 H -4.659 4.390 -1.554 1.00 . A A . 3 LYS HD3 1 1 19 8150 1 1 3 LYS HE2 H -6.227 5.636 -0.313 1.00 . A A . 3 LYS HE2 1 1 19 8151 1 1 3 LYS HE3 H -6.657 6.086 -1.976 1.00 . A A . 3 LYS HE3 1 1 19 8152 1 1 3 LYS HG2 H -6.120 5.023 -3.726 1.00 . A A . 3 LYS HG2 1 1 19 8153 1 1 3 LYS HG3 H -6.587 3.335 -3.568 1.00 . A A . 3 LYS HG3 1 1 19 8154 1 1 3 LYS HZ1 H -8.228 4.204 -1.998 1.00 . A A . 3 LYS HZ1 1 1 19 8155 1 1 3 LYS HZ2 H -8.629 5.359 -0.826 1.00 . A A . 3 LYS HZ2 1 1 19 8156 1 1 3 LYS HZ3 H -7.883 3.896 -0.360 1.00 . A A . 3 LYS HZ3 1 1 19 8157 1 1 3 LYS N N -5.673 1.558 -4.433 1.00 . A A . 3 LYS N 1 1 19 8158 1 1 3 LYS NZ N -7.934 4.637 -1.103 1.00 . A A . 3 LYS NZ 1 1 19 8159 1 1 3 LYS O O -3.107 0.757 -4.875 1.00 . A A . 3 LYS O 1 1 19 8160 1 1 4 LEU C C -0.201 2.258 -5.215 1.00 . A A . 4 LEU C 1 1 19 8161 1 1 4 LEU CA C -1.180 1.967 -6.358 1.00 . A A . 4 LEU CA 1 1 19 8162 1 1 4 LEU CB C -0.748 2.681 -7.652 1.00 . A A . 4 LEU CB 1 1 19 8163 1 1 4 LEU CD1 C -0.872 0.510 -8.899 1.00 . A A . 4 LEU CD1 1 1 19 8164 1 1 4 LEU CD2 C -2.862 1.999 -8.805 1.00 . A A . 4 LEU CD2 1 1 19 8165 1 1 4 LEU CG C -1.335 1.964 -8.872 1.00 . A A . 4 LEU CG 1 1 19 8166 1 1 4 LEU H H -2.752 3.431 -6.345 1.00 . A A . 4 LEU H 1 1 19 8167 1 1 4 LEU HA H -1.255 0.911 -6.525 1.00 . A A . 4 LEU HA 1 1 19 8168 1 1 4 LEU HB2 H -1.104 3.697 -7.631 1.00 . A A . 4 LEU HB2 1 1 19 8169 1 1 4 LEU HB3 H 0.328 2.682 -7.724 1.00 . A A . 4 LEU HB3 1 1 19 8170 1 1 4 LEU HD11 H 0.160 0.454 -8.590 1.00 . A A . 4 LEU HD11 1 1 19 8171 1 1 4 LEU HD12 H -0.972 0.124 -9.902 1.00 . A A . 4 LEU HD12 1 1 19 8172 1 1 4 LEU HD13 H -1.480 -0.073 -8.225 1.00 . A A . 4 LEU HD13 1 1 19 8173 1 1 4 LEU HD21 H -3.190 3.011 -8.627 1.00 . A A . 4 LEU HD21 1 1 19 8174 1 1 4 LEU HD22 H -3.197 1.365 -8.000 1.00 . A A . 4 LEU HD22 1 1 19 8175 1 1 4 LEU HD23 H -3.268 1.640 -9.739 1.00 . A A . 4 LEU HD23 1 1 19 8176 1 1 4 LEU HG H -1.004 2.462 -9.772 1.00 . A A . 4 LEU HG 1 1 19 8177 1 1 4 LEU N N -2.514 2.539 -6.023 1.00 . A A . 4 LEU N 1 1 19 8178 1 1 4 LEU O O -0.597 2.481 -4.083 1.00 . A A . 4 LEU O 1 1 19 8179 1 1 5 THR C C 2.015 3.968 -3.931 1.00 . A A . 5 THR C 1 1 19 8180 1 1 5 THR CA C 2.079 2.508 -4.429 1.00 . A A . 5 THR CA 1 1 19 8181 1 1 5 THR CB C 3.441 2.215 -5.088 1.00 . A A . 5 THR CB 1 1 19 8182 1 1 5 THR CG2 C 4.228 1.240 -4.215 1.00 . A A . 5 THR CG2 1 1 19 8183 1 1 5 THR H H 1.363 2.057 -6.401 1.00 . A A . 5 THR H 1 1 19 8184 1 1 5 THR HA H 1.927 1.834 -3.600 1.00 . A A . 5 THR HA 1 1 19 8185 1 1 5 THR HB H 3.998 3.131 -5.177 1.00 . A A . 5 THR HB 1 1 19 8186 1 1 5 THR HG1 H 3.194 0.693 -6.304 1.00 . A A . 5 THR HG1 1 1 19 8187 1 1 5 THR HG21 H 3.568 0.462 -3.865 1.00 . A A . 5 THR HG21 1 1 19 8188 1 1 5 THR HG22 H 4.640 1.769 -3.370 1.00 . A A . 5 THR HG22 1 1 19 8189 1 1 5 THR HG23 H 5.029 0.802 -4.793 1.00 . A A . 5 THR HG23 1 1 19 8190 1 1 5 THR N N 1.066 2.248 -5.493 1.00 . A A . 5 THR N 1 1 19 8191 1 1 5 THR O O 1.531 4.236 -2.849 1.00 . A A . 5 THR O 1 1 19 8192 1 1 5 THR OG1 O 3.253 1.655 -6.391 1.00 . A A . 5 THR OG1 1 1 19 8193 1 1 6 PHE C C 1.112 6.970 -4.277 1.00 . A A . 6 PHE C 1 1 19 8194 1 1 6 PHE CA C 2.512 6.336 -4.260 1.00 . A A . 6 PHE CA 1 1 19 8195 1 1 6 PHE CB C 3.434 7.055 -5.252 1.00 . A A . 6 PHE CB 1 1 19 8196 1 1 6 PHE CD1 C 5.297 7.096 -3.542 1.00 . A A . 6 PHE CD1 1 1 19 8197 1 1 6 PHE CD2 C 5.807 6.373 -5.800 1.00 . A A . 6 PHE CD2 1 1 19 8198 1 1 6 PHE CE1 C 6.636 6.889 -3.178 1.00 . A A . 6 PHE CE1 1 1 19 8199 1 1 6 PHE CE2 C 7.142 6.169 -5.433 1.00 . A A . 6 PHE CE2 1 1 19 8200 1 1 6 PHE CG C 4.879 6.838 -4.855 1.00 . A A . 6 PHE CG 1 1 19 8201 1 1 6 PHE CZ C 7.556 6.427 -4.120 1.00 . A A . 6 PHE CZ 1 1 19 8202 1 1 6 PHE H H 2.900 4.659 -5.558 1.00 . A A . 6 PHE H 1 1 19 8203 1 1 6 PHE HA H 2.933 6.408 -3.270 1.00 . A A . 6 PHE HA 1 1 19 8204 1 1 6 PHE HB2 H 3.273 6.668 -6.249 1.00 . A A . 6 PHE HB2 1 1 19 8205 1 1 6 PHE HB3 H 3.219 8.110 -5.236 1.00 . A A . 6 PHE HB3 1 1 19 8206 1 1 6 PHE HD1 H 4.591 7.453 -2.812 1.00 . A A . 6 PHE HD1 1 1 19 8207 1 1 6 PHE HD2 H 5.493 6.173 -6.811 1.00 . A A . 6 PHE HD2 1 1 19 8208 1 1 6 PHE HE1 H 6.958 7.085 -2.164 1.00 . A A . 6 PHE HE1 1 1 19 8209 1 1 6 PHE HE2 H 7.855 5.808 -6.164 1.00 . A A . 6 PHE HE2 1 1 19 8210 1 1 6 PHE HZ H 8.587 6.267 -3.833 1.00 . A A . 6 PHE HZ 1 1 19 8211 1 1 6 PHE N N 2.509 4.902 -4.700 1.00 . A A . 6 PHE N 1 1 19 8212 1 1 6 PHE O O 0.966 8.141 -4.574 1.00 . A A . 6 PHE O 1 1 19 8213 1 1 7 TRP C C -1.670 7.061 -2.448 1.00 . A A . 7 TRP C 1 1 19 8214 1 1 7 TRP CA C -1.278 6.829 -3.905 1.00 . A A . 7 TRP CA 1 1 19 8215 1 1 7 TRP CB C -2.195 5.797 -4.569 1.00 . A A . 7 TRP CB 1 1 19 8216 1 1 7 TRP CD1 C -0.682 5.793 -6.602 1.00 . A A . 7 TRP CD1 1 1 19 8217 1 1 7 TRP CD2 C -2.863 5.691 -7.145 1.00 . A A . 7 TRP CD2 1 1 19 8218 1 1 7 TRP CE2 C -2.142 5.696 -8.361 1.00 . A A . 7 TRP CE2 1 1 19 8219 1 1 7 TRP CE3 C -4.260 5.627 -7.202 1.00 . A A . 7 TRP CE3 1 1 19 8220 1 1 7 TRP CG C -1.914 5.764 -6.044 1.00 . A A . 7 TRP CG 1 1 19 8221 1 1 7 TRP CH2 C -4.178 5.572 -9.633 1.00 . A A . 7 TRP CH2 1 1 19 8222 1 1 7 TRP CZ2 C -2.787 5.638 -9.591 1.00 . A A . 7 TRP CZ2 1 1 19 8223 1 1 7 TRP CZ3 C -4.916 5.566 -8.436 1.00 . A A . 7 TRP CZ3 1 1 19 8224 1 1 7 TRP H H 0.215 5.301 -3.670 1.00 . A A . 7 TRP H 1 1 19 8225 1 1 7 TRP HA H -1.299 7.758 -4.457 1.00 . A A . 7 TRP HA 1 1 19 8226 1 1 7 TRP HB2 H -2.023 4.818 -4.138 1.00 . A A . 7 TRP HB2 1 1 19 8227 1 1 7 TRP HB3 H -3.220 6.081 -4.407 1.00 . A A . 7 TRP HB3 1 1 19 8228 1 1 7 TRP HD1 H 0.248 5.836 -6.064 1.00 . A A . 7 TRP HD1 1 1 19 8229 1 1 7 TRP HE1 H -0.071 5.784 -8.614 1.00 . A A . 7 TRP HE1 1 1 19 8230 1 1 7 TRP HE3 H -4.838 5.621 -6.282 1.00 . A A . 7 TRP HE3 1 1 19 8231 1 1 7 TRP HH2 H -4.689 5.524 -10.585 1.00 . A A . 7 TRP HH2 1 1 19 8232 1 1 7 TRP HZ2 H -2.217 5.640 -10.509 1.00 . A A . 7 TRP HZ2 1 1 19 8233 1 1 7 TRP HZ3 H -5.998 5.512 -8.463 1.00 . A A . 7 TRP HZ3 1 1 19 8234 1 1 7 TRP N N 0.087 6.235 -3.934 1.00 . A A . 7 TRP N 1 1 19 8235 1 1 7 TRP NE1 N -0.815 5.763 -7.975 1.00 . A A . 7 TRP NE1 1 1 19 8236 1 1 7 TRP O O -1.643 6.143 -1.651 1.00 . A A . 7 TRP O 1 1 19 8237 1 1 8 LYS C C -3.321 7.503 -0.125 1.00 . A A . 8 LYS C 1 1 19 8238 1 1 8 LYS CA C -2.386 8.587 -0.672 1.00 . A A . 8 LYS CA 1 1 19 8239 1 1 8 LYS CB C -3.099 9.948 -0.721 1.00 . A A . 8 LYS CB 1 1 19 8240 1 1 8 LYS CD C -1.420 11.323 0.532 1.00 . A A . 8 LYS CD 1 1 19 8241 1 1 8 LYS CE C -0.550 12.588 0.476 1.00 . A A . 8 LYS CE 1 1 19 8242 1 1 8 LYS CG C -2.063 11.073 -0.836 1.00 . A A . 8 LYS CG 1 1 19 8243 1 1 8 LYS H H -2.000 8.999 -2.758 1.00 . A A . 8 LYS H 1 1 19 8244 1 1 8 LYS HA H -1.500 8.658 -0.061 1.00 . A A . 8 LYS HA 1 1 19 8245 1 1 8 LYS HB2 H -3.758 9.977 -1.577 1.00 . A A . 8 LYS HB2 1 1 19 8246 1 1 8 LYS HB3 H -3.676 10.084 0.181 1.00 . A A . 8 LYS HB3 1 1 19 8247 1 1 8 LYS HD2 H -2.194 11.450 1.277 1.00 . A A . 8 LYS HD2 1 1 19 8248 1 1 8 LYS HD3 H -0.801 10.479 0.798 1.00 . A A . 8 LYS HD3 1 1 19 8249 1 1 8 LYS HE2 H 0.196 12.563 1.258 1.00 . A A . 8 LYS HE2 1 1 19 8250 1 1 8 LYS HE3 H -0.078 12.677 -0.492 1.00 . A A . 8 LYS HE3 1 1 19 8251 1 1 8 LYS HG2 H -1.297 10.788 -1.546 1.00 . A A . 8 LYS HG2 1 1 19 8252 1 1 8 LYS HG3 H -2.547 11.977 -1.176 1.00 . A A . 8 LYS HG3 1 1 19 8253 1 1 8 LYS HZ1 H -2.243 13.702 -0.028 1.00 . A A . 8 LYS HZ1 1 1 19 8254 1 1 8 LYS HZ2 H -0.971 14.625 0.606 1.00 . A A . 8 LYS HZ2 1 1 19 8255 1 1 8 LYS HZ3 H -1.917 13.663 1.636 1.00 . A A . 8 LYS HZ3 1 1 19 8256 1 1 8 LYS N N -2.008 8.280 -2.092 1.00 . A A . 8 LYS N 1 1 19 8257 1 1 8 LYS NZ N -1.490 13.728 0.689 1.00 . A A . 8 LYS NZ 1 1 19 8258 1 1 8 LYS O O -4.509 7.504 -0.384 1.00 . A A . 8 LYS O 1 1 19 8259 1 1 9 CYS C C -3.743 5.567 2.675 1.00 . A A . 9 CYS C 1 1 19 8260 1 1 9 CYS CA C -3.632 5.465 1.151 1.00 . A A . 9 CYS CA 1 1 19 8261 1 1 9 CYS CB C -2.916 4.171 0.724 1.00 . A A . 9 CYS CB 1 1 19 8262 1 1 9 CYS H H -1.812 6.577 0.782 1.00 . A A . 9 CYS H 1 1 19 8263 1 1 9 CYS HA H -4.615 5.499 0.705 1.00 . A A . 9 CYS HA 1 1 19 8264 1 1 9 CYS HB2 H -3.512 3.661 -0.020 1.00 . A A . 9 CYS HB2 1 1 19 8265 1 1 9 CYS HB3 H -1.954 4.415 0.301 1.00 . A A . 9 CYS HB3 1 1 19 8266 1 1 9 CYS N N -2.782 6.567 0.606 1.00 . A A . 9 CYS N 1 1 19 8267 1 1 9 CYS O O -2.912 6.171 3.330 1.00 . A A . 9 CYS O 1 1 19 8268 1 1 9 CYS SG S -2.681 3.074 2.146 1.00 . A A . 9 CYS SG 1 1 19 8269 1 1 10 LYS C C -4.642 3.610 5.308 1.00 . A A . 10 LYS C 1 1 19 8270 1 1 10 LYS CA C -4.933 4.996 4.716 1.00 . A A . 10 LYS CA 1 1 19 8271 1 1 10 LYS CB C -6.394 5.421 4.970 1.00 . A A . 10 LYS CB 1 1 19 8272 1 1 10 LYS CD C -8.571 4.207 5.265 1.00 . A A . 10 LYS CD 1 1 19 8273 1 1 10 LYS CE C -9.871 4.593 4.542 1.00 . A A . 10 LYS CE 1 1 19 8274 1 1 10 LYS CG C -7.373 4.420 4.332 1.00 . A A . 10 LYS CG 1 1 19 8275 1 1 10 LYS H H -5.403 4.475 2.676 1.00 . A A . 10 LYS H 1 1 19 8276 1 1 10 LYS HA H -4.262 5.724 5.149 1.00 . A A . 10 LYS HA 1 1 19 8277 1 1 10 LYS HB2 H -6.568 5.460 6.035 1.00 . A A . 10 LYS HB2 1 1 19 8278 1 1 10 LYS HB3 H -6.561 6.400 4.547 1.00 . A A . 10 LYS HB3 1 1 19 8279 1 1 10 LYS HD2 H -8.614 3.169 5.556 1.00 . A A . 10 LYS HD2 1 1 19 8280 1 1 10 LYS HD3 H -8.453 4.825 6.144 1.00 . A A . 10 LYS HD3 1 1 19 8281 1 1 10 LYS HE2 H -9.657 5.273 3.726 1.00 . A A . 10 LYS HE2 1 1 19 8282 1 1 10 LYS HE3 H -10.372 3.710 4.174 1.00 . A A . 10 LYS HE3 1 1 19 8283 1 1 10 LYS HG2 H -7.716 4.806 3.384 1.00 . A A . 10 LYS HG2 1 1 19 8284 1 1 10 LYS HG3 H -6.874 3.477 4.175 1.00 . A A . 10 LYS HG3 1 1 19 8285 1 1 10 LYS HZ1 H -11.606 5.587 5.150 1.00 . A A . 10 LYS HZ1 1 1 19 8286 1 1 10 LYS HZ2 H -10.208 6.087 5.969 1.00 . A A . 10 LYS HZ2 1 1 19 8287 1 1 10 LYS HZ3 H -10.928 4.599 6.349 1.00 . A A . 10 LYS HZ3 1 1 19 8288 1 1 10 LYS N N -4.758 4.965 3.237 1.00 . A A . 10 LYS N 1 1 19 8289 1 1 10 LYS NZ N -10.713 5.268 5.580 1.00 . A A . 10 LYS NZ 1 1 19 8290 1 1 10 LYS O O -4.233 3.492 6.448 1.00 . A A . 10 LYS O 1 1 19 8291 1 1 11 ASN C C -3.641 0.419 4.152 1.00 . A A . 11 ASN C 1 1 19 8292 1 1 11 ASN CA C -4.582 1.189 5.080 1.00 . A A . 11 ASN CA 1 1 19 8293 1 1 11 ASN CB C -5.945 0.506 5.105 1.00 . A A . 11 ASN CB 1 1 19 8294 1 1 11 ASN CG C -5.889 -0.708 6.021 1.00 . A A . 11 ASN CG 1 1 19 8295 1 1 11 ASN H H -5.181 2.661 3.634 1.00 . A A . 11 ASN H 1 1 19 8296 1 1 11 ASN HA H -4.179 1.242 6.078 1.00 . A A . 11 ASN HA 1 1 19 8297 1 1 11 ASN HB2 H -6.689 1.199 5.470 1.00 . A A . 11 ASN HB2 1 1 19 8298 1 1 11 ASN HB3 H -6.207 0.188 4.108 1.00 . A A . 11 ASN HB3 1 1 19 8299 1 1 11 ASN HD21 H -7.194 0.048 7.297 1.00 . A A . 11 ASN HD21 1 1 19 8300 1 1 11 ASN HD22 H -6.602 -1.494 7.681 1.00 . A A . 11 ASN HD22 1 1 19 8301 1 1 11 ASN N N -4.849 2.557 4.550 1.00 . A A . 11 ASN N 1 1 19 8302 1 1 11 ASN ND2 N -6.620 -0.720 7.089 1.00 . A A . 11 ASN ND2 1 1 19 8303 1 1 11 ASN O O -3.738 0.504 2.944 1.00 . A A . 11 ASN O 1 1 19 8304 1 1 11 ASN OD1 O -5.165 -1.650 5.761 1.00 . A A . 11 ASN OD1 1 1 19 8305 1 1 12 LYS C C -2.613 -2.244 3.093 1.00 . A A . 12 LYS C 1 1 19 8306 1 1 12 LYS CA C -1.829 -1.146 3.840 1.00 . A A . 12 LYS CA 1 1 19 8307 1 1 12 LYS CB C -0.787 -1.749 4.790 1.00 . A A . 12 LYS CB 1 1 19 8308 1 1 12 LYS CD C -0.375 -3.497 6.537 1.00 . A A . 12 LYS CD 1 1 19 8309 1 1 12 LYS CE C -0.463 -3.278 8.058 1.00 . A A . 12 LYS CE 1 1 19 8310 1 1 12 LYS CG C -1.453 -2.665 5.825 1.00 . A A . 12 LYS CG 1 1 19 8311 1 1 12 LYS H H -2.700 -0.428 5.672 1.00 . A A . 12 LYS H 1 1 19 8312 1 1 12 LYS HA H -1.340 -0.495 3.132 1.00 . A A . 12 LYS HA 1 1 19 8313 1 1 12 LYS HB2 H -0.082 -2.324 4.216 1.00 . A A . 12 LYS HB2 1 1 19 8314 1 1 12 LYS HB3 H -0.269 -0.953 5.299 1.00 . A A . 12 LYS HB3 1 1 19 8315 1 1 12 LYS HD2 H -0.530 -4.544 6.314 1.00 . A A . 12 LYS HD2 1 1 19 8316 1 1 12 LYS HD3 H 0.601 -3.196 6.185 1.00 . A A . 12 LYS HD3 1 1 19 8317 1 1 12 LYS HE2 H -0.989 -2.357 8.270 1.00 . A A . 12 LYS HE2 1 1 19 8318 1 1 12 LYS HE3 H -0.961 -4.111 8.529 1.00 . A A . 12 LYS HE3 1 1 19 8319 1 1 12 LYS HG2 H -1.989 -2.068 6.550 1.00 . A A . 12 LYS HG2 1 1 19 8320 1 1 12 LYS HG3 H -2.140 -3.329 5.324 1.00 . A A . 12 LYS HG3 1 1 19 8321 1 1 12 LYS HZ1 H 1.227 -2.191 8.615 1.00 . A A . 12 LYS HZ1 1 1 19 8322 1 1 12 LYS HZ2 H 1.586 -3.666 7.860 1.00 . A A . 12 LYS HZ2 1 1 19 8323 1 1 12 LYS HZ3 H 1.035 -3.638 9.468 1.00 . A A . 12 LYS HZ3 1 1 19 8324 1 1 12 LYS N N -2.751 -0.353 4.701 1.00 . A A . 12 LYS N 1 1 19 8325 1 1 12 LYS NZ N 0.952 -3.188 8.534 1.00 . A A . 12 LYS NZ 1 1 19 8326 1 1 12 LYS O O -2.160 -2.760 2.091 1.00 . A A . 12 LYS O 1 1 19 8327 1 1 13 LYS C C -5.557 -3.041 1.844 1.00 . A A . 13 LYS C 1 1 19 8328 1 1 13 LYS CA C -4.595 -3.654 2.882 1.00 . A A . 13 LYS CA 1 1 19 8329 1 1 13 LYS CB C -5.384 -4.354 3.997 1.00 . A A . 13 LYS CB 1 1 19 8330 1 1 13 LYS CD C -5.697 -6.517 5.223 1.00 . A A . 13 LYS CD 1 1 19 8331 1 1 13 LYS CE C -5.509 -8.026 4.991 1.00 . A A . 13 LYS CE 1 1 19 8332 1 1 13 LYS CG C -4.761 -5.726 4.304 1.00 . A A . 13 LYS CG 1 1 19 8333 1 1 13 LYS H H -4.143 -2.166 4.376 1.00 . A A . 13 LYS H 1 1 19 8334 1 1 13 LYS HA H -3.943 -4.365 2.400 1.00 . A A . 13 LYS HA 1 1 19 8335 1 1 13 LYS HB2 H -5.366 -3.743 4.887 1.00 . A A . 13 LYS HB2 1 1 19 8336 1 1 13 LYS HB3 H -6.406 -4.491 3.678 1.00 . A A . 13 LYS HB3 1 1 19 8337 1 1 13 LYS HD2 H -5.482 -6.275 6.254 1.00 . A A . 13 LYS HD2 1 1 19 8338 1 1 13 LYS HD3 H -6.722 -6.248 5.002 1.00 . A A . 13 LYS HD3 1 1 19 8339 1 1 13 LYS HE2 H -6.454 -8.484 4.731 1.00 . A A . 13 LYS HE2 1 1 19 8340 1 1 13 LYS HE3 H -4.781 -8.204 4.211 1.00 . A A . 13 LYS HE3 1 1 19 8341 1 1 13 LYS HG2 H -4.622 -6.270 3.382 1.00 . A A . 13 LYS HG2 1 1 19 8342 1 1 13 LYS HG3 H -3.808 -5.593 4.793 1.00 . A A . 13 LYS HG3 1 1 19 8343 1 1 13 LYS HZ1 H -4.120 -8.090 6.549 1.00 . A A . 13 LYS HZ1 1 1 19 8344 1 1 13 LYS HZ2 H -4.840 -9.588 6.200 1.00 . A A . 13 LYS HZ2 1 1 19 8345 1 1 13 LYS HZ3 H -5.717 -8.402 7.034 1.00 . A A . 13 LYS HZ3 1 1 19 8346 1 1 13 LYS N N -3.789 -2.598 3.569 1.00 . A A . 13 LYS N 1 1 19 8347 1 1 13 LYS NZ N -5.009 -8.564 6.290 1.00 . A A . 13 LYS NZ 1 1 19 8348 1 1 13 LYS O O -6.242 -3.765 1.141 1.00 . A A . 13 LYS O 1 1 19 8349 1 1 14 GLU C C -5.788 -0.690 -0.559 1.00 . A A . 14 GLU C 1 1 19 8350 1 1 14 GLU CA C -6.548 -1.128 0.710 1.00 . A A . 14 GLU CA 1 1 19 8351 1 1 14 GLU CB C -7.230 0.057 1.403 1.00 . A A . 14 GLU CB 1 1 19 8352 1 1 14 GLU CD C -6.709 2.520 1.211 1.00 . A A . 14 GLU CD 1 1 19 8353 1 1 14 GLU CG C -6.214 1.158 1.726 1.00 . A A . 14 GLU CG 1 1 19 8354 1 1 14 GLU H H -5.067 -1.150 2.286 1.00 . A A . 14 GLU H 1 1 19 8355 1 1 14 GLU HA H -7.294 -1.852 0.442 1.00 . A A . 14 GLU HA 1 1 19 8356 1 1 14 GLU HB2 H -7.993 0.456 0.751 1.00 . A A . 14 GLU HB2 1 1 19 8357 1 1 14 GLU HB3 H -7.686 -0.282 2.318 1.00 . A A . 14 GLU HB3 1 1 19 8358 1 1 14 GLU HG2 H -6.086 1.211 2.796 1.00 . A A . 14 GLU HG2 1 1 19 8359 1 1 14 GLU HG3 H -5.264 0.925 1.266 1.00 . A A . 14 GLU HG3 1 1 19 8360 1 1 14 GLU N N -5.622 -1.729 1.724 1.00 . A A . 14 GLU N 1 1 19 8361 1 1 14 GLU O O -6.356 -0.087 -1.456 1.00 . A A . 14 GLU O 1 1 19 8362 1 1 14 GLU OE1 O -7.751 2.573 0.572 1.00 . A A . 14 GLU OE1 1 1 19 8363 1 1 14 GLU OE2 O -6.034 3.496 1.458 1.00 . A A . 14 GLU OE2 1 1 19 8364 1 1 15 CYS C C -3.643 -1.841 -2.817 1.00 . A A . 15 CYS C 1 1 19 8365 1 1 15 CYS CA C -3.744 -0.632 -1.878 1.00 . A A . 15 CYS CA 1 1 19 8366 1 1 15 CYS CB C -2.351 -0.240 -1.380 1.00 . A A . 15 CYS CB 1 1 19 8367 1 1 15 CYS H H -4.083 -1.508 0.066 1.00 . A A . 15 CYS H 1 1 19 8368 1 1 15 CYS HA H -4.208 0.202 -2.379 1.00 . A A . 15 CYS HA 1 1 19 8369 1 1 15 CYS HB2 H -2.218 -0.581 -0.368 1.00 . A A . 15 CYS HB2 1 1 19 8370 1 1 15 CYS HB3 H -1.602 -0.696 -2.013 1.00 . A A . 15 CYS HB3 1 1 19 8371 1 1 15 CYS N N -4.520 -1.008 -0.658 1.00 . A A . 15 CYS N 1 1 19 8372 1 1 15 CYS O O -3.527 -2.966 -2.373 1.00 . A A . 15 CYS O 1 1 19 8373 1 1 15 CYS SG S -2.171 1.560 -1.437 1.00 . A A . 15 CYS SG 1 1 19 8374 1 1 16 CYS C C -2.150 -3.387 -4.936 1.00 . A A . 16 CYS C 1 1 19 8375 1 1 16 CYS CA C -3.542 -2.760 -5.068 1.00 . A A . 16 CYS CA 1 1 19 8376 1 1 16 CYS CB C -3.732 -2.150 -6.463 1.00 . A A . 16 CYS CB 1 1 19 8377 1 1 16 CYS H H -3.732 -0.698 -4.444 1.00 . A A . 16 CYS H 1 1 19 8378 1 1 16 CYS HA H -4.308 -3.499 -4.877 1.00 . A A . 16 CYS HA 1 1 19 8379 1 1 16 CYS HB2 H -3.442 -1.110 -6.446 1.00 . A A . 16 CYS HB2 1 1 19 8380 1 1 16 CYS HB3 H -3.115 -2.680 -7.176 1.00 . A A . 16 CYS HB3 1 1 19 8381 1 1 16 CYS N N -3.661 -1.618 -4.106 1.00 . A A . 16 CYS N 1 1 19 8382 1 1 16 CYS O O -1.176 -2.697 -4.673 1.00 . A A . 16 CYS O 1 1 19 8383 1 1 16 CYS SG S -5.473 -2.284 -6.950 1.00 . A A . 16 CYS SG 1 1 19 8384 1 1 17 GLY C C -0.248 -5.163 -3.498 1.00 . A A . 17 GLY C 1 1 19 8385 1 1 17 GLY CA C -0.714 -5.342 -4.941 1.00 . A A . 17 GLY CA 1 1 19 8386 1 1 17 GLY H H -2.846 -5.226 -5.277 1.00 . A A . 17 GLY H 1 1 19 8387 1 1 17 GLY HA2 H -0.801 -6.395 -5.167 1.00 . A A . 17 GLY HA2 1 1 19 8388 1 1 17 GLY HA3 H -0.003 -4.877 -5.609 1.00 . A A . 17 GLY HA3 1 1 19 8389 1 1 17 GLY N N -2.046 -4.685 -5.088 1.00 . A A . 17 GLY N 1 1 19 8390 1 1 17 GLY O O 0.798 -4.603 -3.249 1.00 . A A . 17 GLY O 1 1 19 8391 1 1 18 TRP C C 0.541 -4.737 -0.787 1.00 . A A . 18 TRP C 1 1 19 8392 1 1 18 TRP CA C -0.761 -5.501 -1.083 1.00 . A A . 18 TRP CA 1 1 19 8393 1 1 18 TRP CB C -0.665 -6.951 -0.586 1.00 . A A . 18 TRP CB 1 1 19 8394 1 1 18 TRP CD1 C -3.104 -6.975 0.090 1.00 . A A . 18 TRP CD1 1 1 19 8395 1 1 18 TRP CD2 C -2.504 -8.819 -1.051 1.00 . A A . 18 TRP CD2 1 1 19 8396 1 1 18 TRP CE2 C -3.876 -8.962 -0.740 1.00 . A A . 18 TRP CE2 1 1 19 8397 1 1 18 TRP CE3 C -1.877 -9.848 -1.770 1.00 . A A . 18 TRP CE3 1 1 19 8398 1 1 18 TRP CG C -2.035 -7.548 -0.513 1.00 . A A . 18 TRP CG 1 1 19 8399 1 1 18 TRP CH2 C -3.962 -11.102 -1.846 1.00 . A A . 18 TRP CH2 1 1 19 8400 1 1 18 TRP CZ2 C -4.601 -10.087 -1.128 1.00 . A A . 18 TRP CZ2 1 1 19 8401 1 1 18 TRP CZ3 C -2.603 -10.984 -2.165 1.00 . A A . 18 TRP CZ3 1 1 19 8402 1 1 18 TRP H H -1.896 -6.050 -2.832 1.00 . A A . 18 TRP H 1 1 19 8403 1 1 18 TRP HA H -1.586 -5.014 -0.594 1.00 . A A . 18 TRP HA 1 1 19 8404 1 1 18 TRP HB2 H -0.058 -7.526 -1.270 1.00 . A A . 18 TRP HB2 1 1 19 8405 1 1 18 TRP HB3 H -0.214 -6.969 0.395 1.00 . A A . 18 TRP HB3 1 1 19 8406 1 1 18 TRP HD1 H -3.102 -6.017 0.594 1.00 . A A . 18 TRP HD1 1 1 19 8407 1 1 18 TRP HE1 H -5.096 -7.630 0.306 1.00 . A A . 18 TRP HE1 1 1 19 8408 1 1 18 TRP HE3 H -0.832 -9.767 -2.020 1.00 . A A . 18 TRP HE3 1 1 19 8409 1 1 18 TRP HH2 H -4.516 -11.976 -2.151 1.00 . A A . 18 TRP HH2 1 1 19 8410 1 1 18 TRP HZ2 H -5.648 -10.175 -0.878 1.00 . A A . 18 TRP HZ2 1 1 19 8411 1 1 18 TRP HZ3 H -2.108 -11.769 -2.720 1.00 . A A . 18 TRP HZ3 1 1 19 8412 1 1 18 TRP N N -1.055 -5.625 -2.559 1.00 . A A . 18 TRP N 1 1 19 8413 1 1 18 TRP NE1 N -4.197 -7.812 -0.042 1.00 . A A . 18 TRP NE1 1 1 19 8414 1 1 18 TRP O O 1.551 -5.309 -0.426 1.00 . A A . 18 TRP O 1 1 19 8415 1 1 19 ASN C C 1.597 -1.971 0.742 1.00 . A A . 19 ASN C 1 1 19 8416 1 1 19 ASN CA C 1.712 -2.594 -0.656 1.00 . A A . 19 ASN CA 1 1 19 8417 1 1 19 ASN CB C 1.674 -1.510 -1.732 1.00 . A A . 19 ASN CB 1 1 19 8418 1 1 19 ASN CG C 3.069 -1.296 -2.307 1.00 . A A . 19 ASN CG 1 1 19 8419 1 1 19 ASN H H -0.331 -3.009 -1.204 1.00 . A A . 19 ASN H 1 1 19 8420 1 1 19 ASN HA H 2.624 -3.176 -0.743 1.00 . A A . 19 ASN HA 1 1 19 8421 1 1 19 ASN HB2 H 1.005 -1.817 -2.523 1.00 . A A . 19 ASN HB2 1 1 19 8422 1 1 19 ASN HB3 H 1.321 -0.589 -1.300 1.00 . A A . 19 ASN HB3 1 1 19 8423 1 1 19 ASN HD21 H 3.711 -0.254 -0.749 1.00 . A A . 19 ASN HD21 1 1 19 8424 1 1 19 ASN HD22 H 4.842 -0.471 -1.997 1.00 . A A . 19 ASN HD22 1 1 19 8425 1 1 19 ASN N N 0.504 -3.437 -0.926 1.00 . A A . 19 ASN N 1 1 19 8426 1 1 19 ASN ND2 N 3.946 -0.620 -1.626 1.00 . A A . 19 ASN ND2 1 1 19 8427 1 1 19 ASN O O 0.512 -1.666 1.203 1.00 . A A . 19 ASN O 1 1 19 8428 1 1 19 ASN OD1 O 3.366 -1.751 -3.389 1.00 . A A . 19 ASN OD1 1 1 19 8429 1 1 20 ALA C C 2.390 0.313 2.762 1.00 . A A . 20 ALA C 1 1 19 8430 1 1 20 ALA CA C 2.644 -1.195 2.795 1.00 . A A . 20 ALA CA 1 1 19 8431 1 1 20 ALA CB C 4.019 -1.454 3.398 1.00 . A A . 20 ALA CB 1 1 19 8432 1 1 20 ALA H H 3.565 -2.037 1.023 1.00 . A A . 20 ALA H 1 1 19 8433 1 1 20 ALA HA H 1.887 -1.688 3.386 1.00 . A A . 20 ALA HA 1 1 19 8434 1 1 20 ALA HB1 H 4.782 -1.140 2.697 1.00 . A A . 20 ALA HB1 1 1 19 8435 1 1 20 ALA HB2 H 4.136 -2.505 3.613 1.00 . A A . 20 ALA HB2 1 1 19 8436 1 1 20 ALA HB3 H 4.120 -0.888 4.312 1.00 . A A . 20 ALA HB3 1 1 19 8437 1 1 20 ALA N N 2.699 -1.783 1.417 1.00 . A A . 20 ALA N 1 1 19 8438 1 1 20 ALA O O 3.106 1.056 2.124 1.00 . A A . 20 ALA O 1 1 19 8439 1 1 21 CYS C C 2.050 2.807 4.650 1.00 . A A . 21 CYS C 1 1 19 8440 1 1 21 CYS CA C 1.142 2.234 3.553 1.00 . A A . 21 CYS CA 1 1 19 8441 1 1 21 CYS CB C -0.341 2.357 3.911 1.00 . A A . 21 CYS CB 1 1 19 8442 1 1 21 CYS H H 0.875 0.156 4.025 1.00 . A A . 21 CYS H 1 1 19 8443 1 1 21 CYS HA H 1.344 2.700 2.601 1.00 . A A . 21 CYS HA 1 1 19 8444 1 1 21 CYS HB2 H -0.863 1.468 3.588 1.00 . A A . 21 CYS HB2 1 1 19 8445 1 1 21 CYS HB3 H -0.454 2.468 4.977 1.00 . A A . 21 CYS HB3 1 1 19 8446 1 1 21 CYS N N 1.410 0.771 3.488 1.00 . A A . 21 CYS N 1 1 19 8447 1 1 21 CYS O O 1.833 2.568 5.825 1.00 . A A . 21 CYS O 1 1 19 8448 1 1 21 CYS SG S -1.041 3.797 3.072 1.00 . A A . 21 CYS SG 1 1 19 8449 1 1 22 ALA C C 4.244 5.528 5.265 1.00 . A A . 22 ALA C 1 1 19 8450 1 1 22 ALA CA C 4.057 4.006 5.315 1.00 . A A . 22 ALA CA 1 1 19 8451 1 1 22 ALA CB C 5.374 3.303 4.979 1.00 . A A . 22 ALA CB 1 1 19 8452 1 1 22 ALA H H 3.286 3.633 3.324 1.00 . A A . 22 ALA H 1 1 19 8453 1 1 22 ALA HA H 3.735 3.710 6.301 1.00 . A A . 22 ALA HA 1 1 19 8454 1 1 22 ALA HB1 H 6.195 3.856 5.407 1.00 . A A . 22 ALA HB1 1 1 19 8455 1 1 22 ALA HB2 H 5.496 3.250 3.901 1.00 . A A . 22 ALA HB2 1 1 19 8456 1 1 22 ALA HB3 H 5.363 2.303 5.388 1.00 . A A . 22 ALA HB3 1 1 19 8457 1 1 22 ALA N N 3.101 3.496 4.279 1.00 . A A . 22 ALA N 1 1 19 8458 1 1 22 ALA O O 3.767 6.242 6.125 1.00 . A A . 22 ALA O 1 1 19 8459 1 1 23 LEU C C 3.973 8.239 3.707 1.00 . A A . 23 LEU C 1 1 19 8460 1 1 23 LEU CA C 5.222 7.505 4.222 1.00 . A A . 23 LEU CA 1 1 19 8461 1 1 23 LEU CB C 6.400 7.707 3.235 1.00 . A A . 23 LEU CB 1 1 19 8462 1 1 23 LEU CD1 C 8.592 6.858 2.377 1.00 . A A . 23 LEU CD1 1 1 19 8463 1 1 23 LEU CD2 C 7.865 6.233 4.670 1.00 . A A . 23 LEU CD2 1 1 19 8464 1 1 23 LEU CG C 7.382 6.517 3.245 1.00 . A A . 23 LEU CG 1 1 19 8465 1 1 23 LEU H H 5.360 5.430 3.630 1.00 . A A . 23 LEU H 1 1 19 8466 1 1 23 LEU HA H 5.495 7.884 5.196 1.00 . A A . 23 LEU HA 1 1 19 8467 1 1 23 LEU HB2 H 6.006 7.831 2.236 1.00 . A A . 23 LEU HB2 1 1 19 8468 1 1 23 LEU HB3 H 6.934 8.605 3.511 1.00 . A A . 23 LEU HB3 1 1 19 8469 1 1 23 LEU HD11 H 9.208 7.580 2.891 1.00 . A A . 23 LEU HD11 1 1 19 8470 1 1 23 LEU HD12 H 8.257 7.274 1.439 1.00 . A A . 23 LEU HD12 1 1 19 8471 1 1 23 LEU HD13 H 9.165 5.962 2.191 1.00 . A A . 23 LEU HD13 1 1 19 8472 1 1 23 LEU HD21 H 8.252 5.223 4.725 1.00 . A A . 23 LEU HD21 1 1 19 8473 1 1 23 LEU HD22 H 7.043 6.342 5.360 1.00 . A A . 23 LEU HD22 1 1 19 8474 1 1 23 LEU HD23 H 8.647 6.931 4.928 1.00 . A A . 23 LEU HD23 1 1 19 8475 1 1 23 LEU HG H 6.897 5.640 2.842 1.00 . A A . 23 LEU HG 1 1 19 8476 1 1 23 LEU N N 4.968 6.025 4.294 1.00 . A A . 23 LEU N 1 1 19 8477 1 1 23 LEU O O 4.037 8.982 2.749 1.00 . A A . 23 LEU O 1 1 19 8478 1 1 24 GLY C C 1.106 8.087 2.535 1.00 . A A . 24 GLY C 1 1 19 8479 1 1 24 GLY CA C 1.589 8.721 3.850 1.00 . A A . 24 GLY CA 1 1 19 8480 1 1 24 GLY H H 2.795 7.430 5.098 1.00 . A A . 24 GLY H 1 1 19 8481 1 1 24 GLY HA2 H 0.819 8.624 4.600 1.00 . A A . 24 GLY HA2 1 1 19 8482 1 1 24 GLY HA3 H 1.795 9.769 3.682 1.00 . A A . 24 GLY HA3 1 1 19 8483 1 1 24 GLY N N 2.835 8.037 4.325 1.00 . A A . 24 GLY N 1 1 19 8484 1 1 24 GLY O O 0.164 8.556 1.919 1.00 . A A . 24 GLY O 1 1 19 8485 1 1 25 ILE C C 1.719 4.875 0.890 1.00 . A A . 25 ILE C 1 1 19 8486 1 1 25 ILE CA C 1.331 6.356 0.829 1.00 . A A . 25 ILE CA 1 1 19 8487 1 1 25 ILE CB C 2.097 7.041 -0.318 1.00 . A A . 25 ILE CB 1 1 19 8488 1 1 25 ILE CD1 C 3.573 8.936 -1.020 1.00 . A A . 25 ILE CD1 1 1 19 8489 1 1 25 ILE CG1 C 2.856 8.289 0.161 1.00 . A A . 25 ILE CG1 1 1 19 8490 1 1 25 ILE CG2 C 1.118 7.448 -1.406 1.00 . A A . 25 ILE CG2 1 1 19 8491 1 1 25 ILE H H 2.498 6.664 2.610 1.00 . A A . 25 ILE H 1 1 19 8492 1 1 25 ILE HA H 0.271 6.457 0.680 1.00 . A A . 25 ILE HA 1 1 19 8493 1 1 25 ILE HB H 2.795 6.335 -0.733 1.00 . A A . 25 ILE HB 1 1 19 8494 1 1 25 ILE HD11 H 4.586 8.567 -1.074 1.00 . A A . 25 ILE HD11 1 1 19 8495 1 1 25 ILE HD12 H 3.587 10.008 -0.885 1.00 . A A . 25 ILE HD12 1 1 19 8496 1 1 25 ILE HD13 H 3.050 8.695 -1.932 1.00 . A A . 25 ILE HD13 1 1 19 8497 1 1 25 ILE HG12 H 2.162 8.997 0.589 1.00 . A A . 25 ILE HG12 1 1 19 8498 1 1 25 ILE HG13 H 3.583 8.002 0.904 1.00 . A A . 25 ILE HG13 1 1 19 8499 1 1 25 ILE HG21 H 0.337 8.059 -0.979 1.00 . A A . 25 ILE HG21 1 1 19 8500 1 1 25 ILE HG22 H 0.686 6.561 -1.844 1.00 . A A . 25 ILE HG22 1 1 19 8501 1 1 25 ILE HG23 H 1.640 8.007 -2.167 1.00 . A A . 25 ILE HG23 1 1 19 8502 1 1 25 ILE N N 1.743 7.025 2.099 1.00 . A A . 25 ILE N 1 1 19 8503 1 1 25 ILE O O 2.250 4.403 1.883 1.00 . A A . 25 ILE O 1 1 19 8504 1 1 26 CYS C C 3.268 2.535 -0.771 1.00 . A A . 26 CYS C 1 1 19 8505 1 1 26 CYS CA C 1.877 2.695 -0.155 1.00 . A A . 26 CYS CA 1 1 19 8506 1 1 26 CYS CB C 0.809 2.005 -1.002 1.00 . A A . 26 CYS CB 1 1 19 8507 1 1 26 CYS H H 1.090 4.542 -0.976 1.00 . A A . 26 CYS H 1 1 19 8508 1 1 26 CYS HA H 1.859 2.309 0.851 1.00 . A A . 26 CYS HA 1 1 19 8509 1 1 26 CYS HB2 H 0.659 2.561 -1.917 1.00 . A A . 26 CYS HB2 1 1 19 8510 1 1 26 CYS HB3 H 1.128 1.007 -1.236 1.00 . A A . 26 CYS HB3 1 1 19 8511 1 1 26 CYS N N 1.495 4.141 -0.165 1.00 . A A . 26 CYS N 1 1 19 8512 1 1 26 CYS O O 3.470 2.848 -1.922 1.00 . A A . 26 CYS O 1 1 19 8513 1 1 26 CYS SG S -0.739 1.943 -0.065 1.00 . A A . 26 CYS SG 1 1 19 8514 1 1 27 MET C C 6.445 0.790 -0.032 1.00 . A A . 27 MET C 1 1 19 8515 1 1 27 MET CA C 5.606 1.945 -0.621 1.00 . A A . 27 MET CA 1 1 19 8516 1 1 27 MET CB C 6.273 3.297 -0.356 1.00 . A A . 27 MET CB 1 1 19 8517 1 1 27 MET CE C 7.092 2.927 -3.930 1.00 . A A . 27 MET CE 1 1 19 8518 1 1 27 MET CG C 6.249 4.127 -1.631 1.00 . A A . 27 MET CG 1 1 19 8519 1 1 27 MET H H 4.073 1.838 0.919 1.00 . A A . 27 MET H 1 1 19 8520 1 1 27 MET HA H 5.515 1.808 -1.679 1.00 . A A . 27 MET HA 1 1 19 8521 1 1 27 MET HB2 H 5.744 3.821 0.425 1.00 . A A . 27 MET HB2 1 1 19 8522 1 1 27 MET HB3 H 7.300 3.140 -0.055 1.00 . A A . 27 MET HB3 1 1 19 8523 1 1 27 MET HE1 H 6.773 1.951 -3.589 1.00 . A A . 27 MET HE1 1 1 19 8524 1 1 27 MET HE2 H 7.839 2.809 -4.698 1.00 . A A . 27 MET HE2 1 1 19 8525 1 1 27 MET HE3 H 6.247 3.467 -4.337 1.00 . A A . 27 MET HE3 1 1 19 8526 1 1 27 MET HG2 H 5.408 3.827 -2.238 1.00 . A A . 27 MET HG2 1 1 19 8527 1 1 27 MET HG3 H 6.154 5.171 -1.377 1.00 . A A . 27 MET HG3 1 1 19 8528 1 1 27 MET N N 4.238 2.074 -0.023 1.00 . A A . 27 MET N 1 1 19 8529 1 1 27 MET O O 6.649 -0.203 -0.701 1.00 . A A . 27 MET O 1 1 19 8530 1 1 27 MET SD S 7.792 3.855 -2.544 1.00 . A A . 27 MET SD 1 1 19 8531 1 1 28 PRO C C 7.047 -1.344 2.169 1.00 . A A . 28 PRO C 1 1 19 8532 1 1 28 PRO CA C 7.817 -0.069 1.804 1.00 . A A . 28 PRO CA 1 1 19 8533 1 1 28 PRO CB C 8.349 0.631 3.055 1.00 . A A . 28 PRO CB 1 1 19 8534 1 1 28 PRO CD C 6.739 2.120 2.063 1.00 . A A . 28 PRO CD 1 1 19 8535 1 1 28 PRO CG C 7.331 1.677 3.371 1.00 . A A . 28 PRO CG 1 1 19 8536 1 1 28 PRO HA H 8.646 -0.311 1.153 1.00 . A A . 28 PRO HA 1 1 19 8537 1 1 28 PRO HB2 H 8.438 -0.072 3.872 1.00 . A A . 28 PRO HB2 1 1 19 8538 1 1 28 PRO HB3 H 9.302 1.096 2.849 1.00 . A A . 28 PRO HB3 1 1 19 8539 1 1 28 PRO HD2 H 5.684 2.332 2.175 1.00 . A A . 28 PRO HD2 1 1 19 8540 1 1 28 PRO HD3 H 7.265 2.980 1.681 1.00 . A A . 28 PRO HD3 1 1 19 8541 1 1 28 PRO HG2 H 6.566 1.257 4.007 1.00 . A A . 28 PRO HG2 1 1 19 8542 1 1 28 PRO HG3 H 7.804 2.514 3.858 1.00 . A A . 28 PRO HG3 1 1 19 8543 1 1 28 PRO N N 6.942 0.967 1.174 1.00 . A A . 28 PRO N 1 1 19 8544 1 1 28 PRO O O 6.883 -1.661 3.334 1.00 . A A . 28 PRO O 1 1 19 8545 1 1 29 ARG C C 6.776 -4.319 2.233 1.00 . A A . 29 ARG C 1 1 19 8546 1 1 29 ARG CA C 5.852 -3.356 1.484 1.00 . A A . 29 ARG CA 1 1 19 8547 1 1 29 ARG CB C 5.464 -3.947 0.122 1.00 . A A . 29 ARG CB 1 1 19 8548 1 1 29 ARG CD C 5.636 -6.455 0.103 1.00 . A A . 29 ARG CD 1 1 19 8549 1 1 29 ARG CG C 4.699 -5.260 0.339 1.00 . A A . 29 ARG CG 1 1 19 8550 1 1 29 ARG CZ C 5.888 -7.849 2.122 1.00 . A A . 29 ARG CZ 1 1 19 8551 1 1 29 ARG H H 6.732 -1.809 0.255 1.00 . A A . 29 ARG H 1 1 19 8552 1 1 29 ARG HA H 4.969 -3.157 2.066 1.00 . A A . 29 ARG HA 1 1 19 8553 1 1 29 ARG HB2 H 4.835 -3.250 -0.407 1.00 . A A . 29 ARG HB2 1 1 19 8554 1 1 29 ARG HB3 H 6.354 -4.140 -0.455 1.00 . A A . 29 ARG HB3 1 1 19 8555 1 1 29 ARG HD2 H 5.547 -6.798 -0.915 1.00 . A A . 29 ARG HD2 1 1 19 8556 1 1 29 ARG HD3 H 6.654 -6.174 0.311 1.00 . A A . 29 ARG HD3 1 1 19 8557 1 1 29 ARG HE H 4.327 -7.980 0.886 1.00 . A A . 29 ARG HE 1 1 19 8558 1 1 29 ARG HG2 H 4.324 -5.293 1.349 1.00 . A A . 29 ARG HG2 1 1 19 8559 1 1 29 ARG HG3 H 3.875 -5.312 -0.353 1.00 . A A . 29 ARG HG3 1 1 19 8560 1 1 29 ARG HH11 H 7.351 -6.509 1.816 1.00 . A A . 29 ARG HH11 1 1 19 8561 1 1 29 ARG HH12 H 7.525 -7.495 3.223 1.00 . A A . 29 ARG HH12 1 1 19 8562 1 1 29 ARG HH21 H 4.595 -9.265 2.710 1.00 . A A . 29 ARG HH21 1 1 19 8563 1 1 29 ARG HH22 H 5.978 -9.045 3.728 1.00 . A A . 29 ARG HH22 1 1 19 8564 1 1 29 ARG N N 6.586 -2.084 1.186 1.00 . A A . 29 ARG N 1 1 19 8565 1 1 29 ARG NE N 5.174 -7.518 1.059 1.00 . A A . 29 ARG NE 1 1 19 8566 1 1 29 ARG NH1 N 7.008 -7.242 2.400 1.00 . A A . 29 ARG NH1 1 1 19 8567 1 1 29 ARG NH2 N 5.456 -8.796 2.912 1.00 . A A . 29 ARG NH2 1 1 19 8568 1 1 29 ARG O O 6.473 -4.631 3.367 1.00 . A A . 29 ARG O 1 1 19 8569 1 1 29 ARG OXT O 7.766 -4.736 1.654 1.00 . A A . 29 ARG OXT 1 1 20 8570 1 1 1 GLY C C -10.190 0.670 -3.753 1.00 . A A . 1 GLY C 1 1 20 8571 1 1 1 GLY CA C -11.609 1.204 -3.981 1.00 . A A . 1 GLY CA 1 1 20 8572 1 1 1 GLY H1 H -13.526 0.396 -4.036 1.00 . A A . 1 GLY H1 1 1 20 8573 1 1 1 GLY H2 H -12.344 -0.669 -3.440 1.00 . A A . 1 GLY H2 1 1 20 8574 1 1 1 GLY H3 H -12.437 -0.336 -5.103 1.00 . A A . 1 GLY H3 1 1 20 8575 1 1 1 GLY HA2 H -11.625 1.823 -4.865 1.00 . A A . 1 GLY HA2 1 1 20 8576 1 1 1 GLY HA3 H -11.906 1.793 -3.125 1.00 . A A . 1 GLY HA3 1 1 20 8577 1 1 1 GLY N N -12.550 0.063 -4.154 1.00 . A A . 1 GLY N 1 1 20 8578 1 1 1 GLY O O -9.859 0.216 -2.677 1.00 . A A . 1 GLY O 1 1 20 8579 1 1 2 CYS C C -6.976 1.147 -5.324 1.00 . A A . 2 CYS C 1 1 20 8580 1 1 2 CYS CA C -7.946 0.214 -4.595 1.00 . A A . 2 CYS CA 1 1 20 8581 1 1 2 CYS CB C -7.939 -1.179 -5.235 1.00 . A A . 2 CYS CB 1 1 20 8582 1 1 2 CYS H H -9.635 1.092 -5.618 1.00 . A A . 2 CYS H 1 1 20 8583 1 1 2 CYS HA H -7.691 0.141 -3.549 1.00 . A A . 2 CYS HA 1 1 20 8584 1 1 2 CYS HB2 H -8.779 -1.750 -4.866 1.00 . A A . 2 CYS HB2 1 1 20 8585 1 1 2 CYS HB3 H -8.013 -1.082 -6.307 1.00 . A A . 2 CYS HB3 1 1 20 8586 1 1 2 CYS N N -9.350 0.718 -4.756 1.00 . A A . 2 CYS N 1 1 20 8587 1 1 2 CYS O O -7.268 1.626 -6.403 1.00 . A A . 2 CYS O 1 1 20 8588 1 1 2 CYS SG S -6.401 -2.034 -4.810 1.00 . A A . 2 CYS SG 1 1 20 8589 1 1 3 LYS C C -3.499 1.636 -5.580 1.00 . A A . 3 LYS C 1 1 20 8590 1 1 3 LYS CA C -4.854 2.333 -5.414 1.00 . A A . 3 LYS CA 1 1 20 8591 1 1 3 LYS CB C -4.731 3.558 -4.489 1.00 . A A . 3 LYS CB 1 1 20 8592 1 1 3 LYS CD C -6.287 5.504 -4.106 1.00 . A A . 3 LYS CD 1 1 20 8593 1 1 3 LYS CE C -7.459 5.818 -5.048 1.00 . A A . 3 LYS CE 1 1 20 8594 1 1 3 LYS CG C -6.118 3.981 -3.985 1.00 . A A . 3 LYS CG 1 1 20 8595 1 1 3 LYS H H -5.625 1.022 -3.870 1.00 . A A . 3 LYS H 1 1 20 8596 1 1 3 LYS HA H -5.225 2.639 -6.378 1.00 . A A . 3 LYS HA 1 1 20 8597 1 1 3 LYS HB2 H -4.098 3.312 -3.646 1.00 . A A . 3 LYS HB2 1 1 20 8598 1 1 3 LYS HB3 H -4.289 4.373 -5.039 1.00 . A A . 3 LYS HB3 1 1 20 8599 1 1 3 LYS HD2 H -6.489 5.920 -3.126 1.00 . A A . 3 LYS HD2 1 1 20 8600 1 1 3 LYS HD3 H -5.381 5.939 -4.498 1.00 . A A . 3 LYS HD3 1 1 20 8601 1 1 3 LYS HE2 H -7.385 5.222 -5.949 1.00 . A A . 3 LYS HE2 1 1 20 8602 1 1 3 LYS HE3 H -8.401 5.632 -4.552 1.00 . A A . 3 LYS HE3 1 1 20 8603 1 1 3 LYS HG2 H -6.879 3.489 -4.571 1.00 . A A . 3 LYS HG2 1 1 20 8604 1 1 3 LYS HG3 H -6.222 3.694 -2.950 1.00 . A A . 3 LYS HG3 1 1 20 8605 1 1 3 LYS HZ1 H -7.284 7.821 -4.491 1.00 . A A . 3 LYS HZ1 1 1 20 8606 1 1 3 LYS HZ2 H -8.161 7.574 -5.920 1.00 . A A . 3 LYS HZ2 1 1 20 8607 1 1 3 LYS HZ3 H -6.470 7.434 -5.928 1.00 . A A . 3 LYS HZ3 1 1 20 8608 1 1 3 LYS N N -5.834 1.417 -4.745 1.00 . A A . 3 LYS N 1 1 20 8609 1 1 3 LYS NZ N -7.330 7.269 -5.370 1.00 . A A . 3 LYS NZ 1 1 20 8610 1 1 3 LYS O O -3.321 0.504 -5.178 1.00 . A A . 3 LYS O 1 1 20 8611 1 1 4 LEU C C -0.297 2.016 -5.188 1.00 . A A . 4 LEU C 1 1 20 8612 1 1 4 LEU CA C -1.210 1.694 -6.385 1.00 . A A . 4 LEU CA 1 1 20 8613 1 1 4 LEU CB C -0.677 2.319 -7.690 1.00 . A A . 4 LEU CB 1 1 20 8614 1 1 4 LEU CD1 C -1.567 0.240 -8.781 1.00 . A A . 4 LEU CD1 1 1 20 8615 1 1 4 LEU CD2 C -2.803 2.386 -9.010 1.00 . A A . 4 LEU CD2 1 1 20 8616 1 1 4 LEU CG C -1.418 1.754 -8.912 1.00 . A A . 4 LEU CG 1 1 20 8617 1 1 4 LEU H H -2.730 3.212 -6.494 1.00 . A A . 4 LEU H 1 1 20 8618 1 1 4 LEU HA H -1.306 0.625 -6.501 1.00 . A A . 4 LEU HA 1 1 20 8619 1 1 4 LEU HB2 H -0.818 3.385 -7.655 1.00 . A A . 4 LEU HB2 1 1 20 8620 1 1 4 LEU HB3 H 0.372 2.103 -7.789 1.00 . A A . 4 LEU HB3 1 1 20 8621 1 1 4 LEU HD11 H -2.376 0.017 -8.104 1.00 . A A . 4 LEU HD11 1 1 20 8622 1 1 4 LEU HD12 H -0.648 -0.182 -8.401 1.00 . A A . 4 LEU HD12 1 1 20 8623 1 1 4 LEU HD13 H -1.784 -0.179 -9.752 1.00 . A A . 4 LEU HD13 1 1 20 8624 1 1 4 LEU HD21 H -3.549 1.670 -8.701 1.00 . A A . 4 LEU HD21 1 1 20 8625 1 1 4 LEU HD22 H -2.990 2.685 -10.030 1.00 . A A . 4 LEU HD22 1 1 20 8626 1 1 4 LEU HD23 H -2.845 3.250 -8.369 1.00 . A A . 4 LEU HD23 1 1 20 8627 1 1 4 LEU HG H -0.856 1.981 -9.805 1.00 . A A . 4 LEU HG 1 1 20 8628 1 1 4 LEU N N -2.554 2.306 -6.178 1.00 . A A . 4 LEU N 1 1 20 8629 1 1 4 LEU O O -0.739 2.046 -4.053 1.00 . A A . 4 LEU O 1 1 20 8630 1 1 5 THR C C 1.807 4.004 -3.879 1.00 . A A . 5 THR C 1 1 20 8631 1 1 5 THR CA C 1.912 2.534 -4.312 1.00 . A A . 5 THR CA 1 1 20 8632 1 1 5 THR CB C 3.319 2.229 -4.873 1.00 . A A . 5 THR CB 1 1 20 8633 1 1 5 THR CG2 C 4.046 1.244 -3.952 1.00 . A A . 5 THR CG2 1 1 20 8634 1 1 5 THR H H 1.302 2.196 -6.337 1.00 . A A . 5 THR H 1 1 20 8635 1 1 5 THR HA H 1.707 1.887 -3.477 1.00 . A A . 5 THR HA 1 1 20 8636 1 1 5 THR HB H 3.883 3.140 -4.923 1.00 . A A . 5 THR HB 1 1 20 8637 1 1 5 THR HG1 H 4.083 1.737 -6.605 1.00 . A A . 5 THR HG1 1 1 20 8638 1 1 5 THR HG21 H 3.550 1.212 -2.991 1.00 . A A . 5 THR HG21 1 1 20 8639 1 1 5 THR HG22 H 5.071 1.562 -3.813 1.00 . A A . 5 THR HG22 1 1 20 8640 1 1 5 THR HG23 H 4.033 0.259 -4.396 1.00 . A A . 5 THR HG23 1 1 20 8641 1 1 5 THR N N 0.967 2.238 -5.427 1.00 . A A . 5 THR N 1 1 20 8642 1 1 5 THR O O 1.296 4.311 -2.821 1.00 . A A . 5 THR O 1 1 20 8643 1 1 5 THR OG1 O 3.219 1.663 -6.180 1.00 . A A . 5 THR OG1 1 1 20 8644 1 1 6 PHE C C 0.837 6.953 -4.326 1.00 . A A . 6 PHE C 1 1 20 8645 1 1 6 PHE CA C 2.261 6.371 -4.313 1.00 . A A . 6 PHE CA 1 1 20 8646 1 1 6 PHE CB C 3.136 7.069 -5.367 1.00 . A A . 6 PHE CB 1 1 20 8647 1 1 6 PHE CD1 C 5.154 6.771 -3.870 1.00 . A A . 6 PHE CD1 1 1 20 8648 1 1 6 PHE CD2 C 5.380 6.295 -6.238 1.00 . A A . 6 PHE CD2 1 1 20 8649 1 1 6 PHE CE1 C 6.498 6.432 -3.672 1.00 . A A . 6 PHE CE1 1 1 20 8650 1 1 6 PHE CE2 C 6.727 5.956 -6.042 1.00 . A A . 6 PHE CE2 1 1 20 8651 1 1 6 PHE CG C 4.594 6.702 -5.152 1.00 . A A . 6 PHE CG 1 1 20 8652 1 1 6 PHE CZ C 7.285 6.024 -4.759 1.00 . A A . 6 PHE CZ 1 1 20 8653 1 1 6 PHE H H 2.706 4.639 -5.513 1.00 . A A . 6 PHE H 1 1 20 8654 1 1 6 PHE HA H 2.699 6.512 -3.336 1.00 . A A . 6 PHE HA 1 1 20 8655 1 1 6 PHE HB2 H 2.830 6.756 -6.353 1.00 . A A . 6 PHE HB2 1 1 20 8656 1 1 6 PHE HB3 H 3.018 8.140 -5.279 1.00 . A A . 6 PHE HB3 1 1 20 8657 1 1 6 PHE HD1 H 4.548 7.085 -3.033 1.00 . A A . 6 PHE HD1 1 1 20 8658 1 1 6 PHE HD2 H 4.947 6.242 -7.228 1.00 . A A . 6 PHE HD2 1 1 20 8659 1 1 6 PHE HE1 H 6.926 6.487 -2.681 1.00 . A A . 6 PHE HE1 1 1 20 8660 1 1 6 PHE HE2 H 7.332 5.645 -6.880 1.00 . A A . 6 PHE HE2 1 1 20 8661 1 1 6 PHE HZ H 8.323 5.765 -4.606 1.00 . A A . 6 PHE HZ 1 1 20 8662 1 1 6 PHE N N 2.296 4.914 -4.679 1.00 . A A . 6 PHE N 1 1 20 8663 1 1 6 PHE O O 0.635 8.100 -4.682 1.00 . A A . 6 PHE O 1 1 20 8664 1 1 7 TRP C C -1.878 6.986 -2.395 1.00 . A A . 7 TRP C 1 1 20 8665 1 1 7 TRP CA C -1.521 6.743 -3.858 1.00 . A A . 7 TRP CA 1 1 20 8666 1 1 7 TRP CB C -2.398 5.655 -4.479 1.00 . A A . 7 TRP CB 1 1 20 8667 1 1 7 TRP CD1 C -0.935 5.501 -6.533 1.00 . A A . 7 TRP CD1 1 1 20 8668 1 1 7 TRP CD2 C -3.121 5.628 -7.048 1.00 . A A . 7 TRP CD2 1 1 20 8669 1 1 7 TRP CE2 C -2.418 5.555 -8.272 1.00 . A A . 7 TRP CE2 1 1 20 8670 1 1 7 TRP CE3 C -4.526 5.708 -7.093 1.00 . A A . 7 TRP CE3 1 1 20 8671 1 1 7 TRP CG C -2.154 5.602 -5.957 1.00 . A A . 7 TRP CG 1 1 20 8672 1 1 7 TRP CH2 C -4.474 5.645 -9.524 1.00 . A A . 7 TRP CH2 1 1 20 8673 1 1 7 TRP CZ2 C -3.078 5.564 -9.495 1.00 . A A . 7 TRP CZ2 1 1 20 8674 1 1 7 TRP CZ3 C -5.197 5.713 -8.328 1.00 . A A . 7 TRP CZ3 1 1 20 8675 1 1 7 TRP H H 0.024 5.293 -3.587 1.00 . A A . 7 TRP H 1 1 20 8676 1 1 7 TRP HA H -1.589 7.656 -4.425 1.00 . A A . 7 TRP HA 1 1 20 8677 1 1 7 TRP HB2 H -2.154 4.702 -4.035 1.00 . A A . 7 TRP HB2 1 1 20 8678 1 1 7 TRP HB3 H -3.435 5.882 -4.294 1.00 . A A . 7 TRP HB3 1 1 20 8679 1 1 7 TRP HD1 H 0.010 5.446 -6.005 1.00 . A A . 7 TRP HD1 1 1 20 8680 1 1 7 TRP HE1 H -0.361 5.427 -8.548 1.00 . A A . 7 TRP HE1 1 1 20 8681 1 1 7 TRP HE3 H -5.091 5.762 -6.172 1.00 . A A . 7 TRP HE3 1 1 20 8682 1 1 7 TRP HH2 H -4.993 5.649 -10.469 1.00 . A A . 7 TRP HH2 1 1 20 8683 1 1 7 TRP HZ2 H -2.516 5.507 -10.415 1.00 . A A . 7 TRP HZ2 1 1 20 8684 1 1 7 TRP HZ3 H -6.275 5.774 -8.353 1.00 . A A . 7 TRP HZ3 1 1 20 8685 1 1 7 TRP N N -0.144 6.202 -3.903 1.00 . A A . 7 TRP N 1 1 20 8686 1 1 7 TRP NE1 N -1.091 5.484 -7.904 1.00 . A A . 7 TRP NE1 1 1 20 8687 1 1 7 TRP O O -2.007 6.049 -1.630 1.00 . A A . 7 TRP O 1 1 20 8688 1 1 8 LYS C C -3.304 7.580 0.032 1.00 . A A . 8 LYS C 1 1 20 8689 1 1 8 LYS CA C -2.295 8.570 -0.566 1.00 . A A . 8 LYS CA 1 1 20 8690 1 1 8 LYS CB C -2.870 9.994 -0.576 1.00 . A A . 8 LYS CB 1 1 20 8691 1 1 8 LYS CD C -5.255 10.468 -1.207 1.00 . A A . 8 LYS CD 1 1 20 8692 1 1 8 LYS CE C -5.727 11.843 -1.707 1.00 . A A . 8 LYS CE 1 1 20 8693 1 1 8 LYS CG C -3.852 10.178 -1.746 1.00 . A A . 8 LYS CG 1 1 20 8694 1 1 8 LYS H H -1.844 8.958 -2.643 1.00 . A A . 8 LYS H 1 1 20 8695 1 1 8 LYS HA H -1.383 8.555 0.015 1.00 . A A . 8 LYS HA 1 1 20 8696 1 1 8 LYS HB2 H -3.387 10.173 0.357 1.00 . A A . 8 LYS HB2 1 1 20 8697 1 1 8 LYS HB3 H -2.062 10.705 -0.673 1.00 . A A . 8 LYS HB3 1 1 20 8698 1 1 8 LYS HD2 H -5.931 9.704 -1.557 1.00 . A A . 8 LYS HD2 1 1 20 8699 1 1 8 LYS HD3 H -5.233 10.465 -0.128 1.00 . A A . 8 LYS HD3 1 1 20 8700 1 1 8 LYS HE2 H -4.878 12.498 -1.853 1.00 . A A . 8 LYS HE2 1 1 20 8701 1 1 8 LYS HE3 H -6.283 11.739 -2.627 1.00 . A A . 8 LYS HE3 1 1 20 8702 1 1 8 LYS HG2 H -3.525 11.004 -2.362 1.00 . A A . 8 LYS HG2 1 1 20 8703 1 1 8 LYS HG3 H -3.883 9.277 -2.340 1.00 . A A . 8 LYS HG3 1 1 20 8704 1 1 8 LYS HZ1 H -6.111 12.343 0.281 1.00 . A A . 8 LYS HZ1 1 1 20 8705 1 1 8 LYS HZ2 H -7.472 11.784 -0.573 1.00 . A A . 8 LYS HZ2 1 1 20 8706 1 1 8 LYS HZ3 H -6.876 13.349 -0.846 1.00 . A A . 8 LYS HZ3 1 1 20 8707 1 1 8 LYS N N -1.988 8.235 -1.999 1.00 . A A . 8 LYS N 1 1 20 8708 1 1 8 LYS NZ N -6.612 12.367 -0.630 1.00 . A A . 8 LYS NZ 1 1 20 8709 1 1 8 LYS O O -4.497 7.674 -0.197 1.00 . A A . 8 LYS O 1 1 20 8710 1 1 9 CYS C C -3.688 5.702 2.936 1.00 . A A . 9 CYS C 1 1 20 8711 1 1 9 CYS CA C -3.727 5.612 1.409 1.00 . A A . 9 CYS CA 1 1 20 8712 1 1 9 CYS CB C -3.196 4.247 0.946 1.00 . A A . 9 CYS CB 1 1 20 8713 1 1 9 CYS H H -1.849 6.583 0.943 1.00 . A A . 9 CYS H 1 1 20 8714 1 1 9 CYS HA H -4.737 5.747 1.055 1.00 . A A . 9 CYS HA 1 1 20 8715 1 1 9 CYS HB2 H -3.692 3.467 1.502 1.00 . A A . 9 CYS HB2 1 1 20 8716 1 1 9 CYS HB3 H -3.413 4.124 -0.106 1.00 . A A . 9 CYS HB3 1 1 20 8717 1 1 9 CYS N N -2.820 6.630 0.788 1.00 . A A . 9 CYS N 1 1 20 8718 1 1 9 CYS O O -2.856 6.382 3.505 1.00 . A A . 9 CYS O 1 1 20 8719 1 1 9 CYS SG S -1.398 4.125 1.213 1.00 . A A . 9 CYS SG 1 1 20 8720 1 1 10 LYS C C -4.214 3.676 5.670 1.00 . A A . 10 LYS C 1 1 20 8721 1 1 10 LYS CA C -4.592 5.053 5.094 1.00 . A A . 10 LYS CA 1 1 20 8722 1 1 10 LYS CB C -6.030 5.425 5.471 1.00 . A A . 10 LYS CB 1 1 20 8723 1 1 10 LYS CD C -6.693 7.244 7.077 1.00 . A A . 10 LYS CD 1 1 20 8724 1 1 10 LYS CE C -5.672 8.196 7.719 1.00 . A A . 10 LYS CE 1 1 20 8725 1 1 10 LYS CG C -6.091 5.837 6.947 1.00 . A A . 10 LYS CG 1 1 20 8726 1 1 10 LYS H H -5.253 4.478 3.125 1.00 . A A . 10 LYS H 1 1 20 8727 1 1 10 LYS HA H -3.911 5.808 5.456 1.00 . A A . 10 LYS HA 1 1 20 8728 1 1 10 LYS HB2 H -6.363 6.244 4.850 1.00 . A A . 10 LYS HB2 1 1 20 8729 1 1 10 LYS HB3 H -6.673 4.571 5.311 1.00 . A A . 10 LYS HB3 1 1 20 8730 1 1 10 LYS HD2 H -6.958 7.613 6.096 1.00 . A A . 10 LYS HD2 1 1 20 8731 1 1 10 LYS HD3 H -7.580 7.200 7.694 1.00 . A A . 10 LYS HD3 1 1 20 8732 1 1 10 LYS HE2 H -4.681 7.997 7.332 1.00 . A A . 10 LYS HE2 1 1 20 8733 1 1 10 LYS HE3 H -5.948 9.221 7.535 1.00 . A A . 10 LYS HE3 1 1 20 8734 1 1 10 LYS HG2 H -6.710 5.131 7.482 1.00 . A A . 10 LYS HG2 1 1 20 8735 1 1 10 LYS HG3 H -5.097 5.831 7.365 1.00 . A A . 10 LYS HG3 1 1 20 8736 1 1 10 LYS HZ1 H -4.979 8.449 9.673 1.00 . A A . 10 LYS HZ1 1 1 20 8737 1 1 10 LYS HZ2 H -5.576 6.894 9.351 1.00 . A A . 10 LYS HZ2 1 1 20 8738 1 1 10 LYS HZ3 H -6.651 8.194 9.564 1.00 . A A . 10 LYS HZ3 1 1 20 8739 1 1 10 LYS N N -4.582 5.017 3.605 1.00 . A A . 10 LYS N 1 1 20 8740 1 1 10 LYS NZ N -5.725 7.910 9.185 1.00 . A A . 10 LYS NZ 1 1 20 8741 1 1 10 LYS O O -3.762 3.580 6.795 1.00 . A A . 10 LYS O 1 1 20 8742 1 1 11 ASN C C -3.353 0.388 4.398 1.00 . A A . 11 ASN C 1 1 20 8743 1 1 11 ASN CA C -4.047 1.255 5.462 1.00 . A A . 11 ASN CA 1 1 20 8744 1 1 11 ASN CB C -5.376 0.622 5.901 1.00 . A A . 11 ASN CB 1 1 20 8745 1 1 11 ASN CG C -6.376 0.634 4.740 1.00 . A A . 11 ASN CG 1 1 20 8746 1 1 11 ASN H H -4.771 2.694 4.017 1.00 . A A . 11 ASN H 1 1 20 8747 1 1 11 ASN HA H -3.403 1.362 6.319 1.00 . A A . 11 ASN HA 1 1 20 8748 1 1 11 ASN HB2 H -5.200 -0.394 6.215 1.00 . A A . 11 ASN HB2 1 1 20 8749 1 1 11 ASN HB3 H -5.786 1.183 6.728 1.00 . A A . 11 ASN HB3 1 1 20 8750 1 1 11 ASN HD21 H -6.244 -1.308 4.409 1.00 . A A . 11 ASN HD21 1 1 20 8751 1 1 11 ASN HD22 H -7.306 -0.475 3.390 1.00 . A A . 11 ASN HD22 1 1 20 8752 1 1 11 ASN N N -4.398 2.610 4.923 1.00 . A A . 11 ASN N 1 1 20 8753 1 1 11 ASN ND2 N -6.662 -0.475 4.130 1.00 . A A . 11 ASN ND2 1 1 20 8754 1 1 11 ASN O O -3.463 0.625 3.209 1.00 . A A . 11 ASN O 1 1 20 8755 1 1 11 ASN OD1 O -6.908 1.666 4.396 1.00 . A A . 11 ASN OD1 1 1 20 8756 1 1 12 LYS C C -2.860 -2.205 2.896 1.00 . A A . 12 LYS C 1 1 20 8757 1 1 12 LYS CA C -1.900 -1.532 3.888 1.00 . A A . 12 LYS CA 1 1 20 8758 1 1 12 LYS CB C -1.236 -2.568 4.814 1.00 . A A . 12 LYS CB 1 1 20 8759 1 1 12 LYS CD C 0.479 -4.399 4.787 1.00 . A A . 12 LYS CD 1 1 20 8760 1 1 12 LYS CE C -0.060 -5.555 5.648 1.00 . A A . 12 LYS CE 1 1 20 8761 1 1 12 LYS CG C -0.668 -3.740 4.005 1.00 . A A . 12 LYS CG 1 1 20 8762 1 1 12 LYS H H -2.560 -0.766 5.799 1.00 . A A . 12 LYS H 1 1 20 8763 1 1 12 LYS HA H -1.145 -0.985 3.347 1.00 . A A . 12 LYS HA 1 1 20 8764 1 1 12 LYS HB2 H -0.435 -2.090 5.360 1.00 . A A . 12 LYS HB2 1 1 20 8765 1 1 12 LYS HB3 H -1.969 -2.942 5.514 1.00 . A A . 12 LYS HB3 1 1 20 8766 1 1 12 LYS HD2 H 1.211 -4.785 4.090 1.00 . A A . 12 LYS HD2 1 1 20 8767 1 1 12 LYS HD3 H 0.946 -3.663 5.424 1.00 . A A . 12 LYS HD3 1 1 20 8768 1 1 12 LYS HE2 H -1.132 -5.643 5.532 1.00 . A A . 12 LYS HE2 1 1 20 8769 1 1 12 LYS HE3 H 0.423 -6.481 5.373 1.00 . A A . 12 LYS HE3 1 1 20 8770 1 1 12 LYS HG2 H -1.449 -4.464 3.823 1.00 . A A . 12 LYS HG2 1 1 20 8771 1 1 12 LYS HG3 H -0.292 -3.374 3.060 1.00 . A A . 12 LYS HG3 1 1 20 8772 1 1 12 LYS HZ1 H -0.194 -5.867 7.708 1.00 . A A . 12 LYS HZ1 1 1 20 8773 1 1 12 LYS HZ2 H -0.017 -4.234 7.270 1.00 . A A . 12 LYS HZ2 1 1 20 8774 1 1 12 LYS HZ3 H 1.310 -5.290 7.198 1.00 . A A . 12 LYS HZ3 1 1 20 8775 1 1 12 LYS N N -2.632 -0.617 4.834 1.00 . A A . 12 LYS N 1 1 20 8776 1 1 12 LYS NZ N 0.284 -5.207 7.059 1.00 . A A . 12 LYS NZ 1 1 20 8777 1 1 12 LYS O O -2.506 -2.451 1.762 1.00 . A A . 12 LYS O 1 1 20 8778 1 1 13 LYS C C -5.736 -2.084 1.483 1.00 . A A . 13 LYS C 1 1 20 8779 1 1 13 LYS CA C -5.034 -3.142 2.355 1.00 . A A . 13 LYS CA 1 1 20 8780 1 1 13 LYS CB C -6.055 -3.850 3.247 1.00 . A A . 13 LYS CB 1 1 20 8781 1 1 13 LYS CD C -7.800 -5.649 3.066 1.00 . A A . 13 LYS CD 1 1 20 8782 1 1 13 LYS CE C -7.777 -7.029 3.739 1.00 . A A . 13 LYS CE 1 1 20 8783 1 1 13 LYS CG C -6.372 -5.239 2.677 1.00 . A A . 13 LYS CG 1 1 20 8784 1 1 13 LYS H H -4.340 -2.286 4.215 1.00 . A A . 13 LYS H 1 1 20 8785 1 1 13 LYS HA H -4.526 -3.863 1.733 1.00 . A A . 13 LYS HA 1 1 20 8786 1 1 13 LYS HB2 H -5.651 -3.950 4.245 1.00 . A A . 13 LYS HB2 1 1 20 8787 1 1 13 LYS HB3 H -6.958 -3.262 3.280 1.00 . A A . 13 LYS HB3 1 1 20 8788 1 1 13 LYS HD2 H -8.211 -4.920 3.751 1.00 . A A . 13 LYS HD2 1 1 20 8789 1 1 13 LYS HD3 H -8.413 -5.694 2.177 1.00 . A A . 13 LYS HD3 1 1 20 8790 1 1 13 LYS HE2 H -7.250 -7.740 3.116 1.00 . A A . 13 LYS HE2 1 1 20 8791 1 1 13 LYS HE3 H -7.313 -6.965 4.712 1.00 . A A . 13 LYS HE3 1 1 20 8792 1 1 13 LYS HG2 H -6.288 -5.209 1.600 1.00 . A A . 13 LYS HG2 1 1 20 8793 1 1 13 LYS HG3 H -5.671 -5.960 3.072 1.00 . A A . 13 LYS HG3 1 1 20 8794 1 1 13 LYS HZ1 H -9.717 -6.709 4.443 1.00 . A A . 13 LYS HZ1 1 1 20 8795 1 1 13 LYS HZ2 H -9.270 -8.344 4.355 1.00 . A A . 13 LYS HZ2 1 1 20 8796 1 1 13 LYS HZ3 H -9.645 -7.494 2.938 1.00 . A A . 13 LYS HZ3 1 1 20 8797 1 1 13 LYS N N -4.067 -2.496 3.300 1.00 . A A . 13 LYS N 1 1 20 8798 1 1 13 LYS NZ N -9.209 -7.419 3.880 1.00 . A A . 13 LYS NZ 1 1 20 8799 1 1 13 LYS O O -6.761 -2.351 0.885 1.00 . A A . 13 LYS O 1 1 20 8800 1 1 14 GLU C C -5.254 0.179 -0.832 1.00 . A A . 14 GLU C 1 1 20 8801 1 1 14 GLU CA C -5.839 0.176 0.589 1.00 . A A . 14 GLU CA 1 1 20 8802 1 1 14 GLU CB C -5.492 1.465 1.329 1.00 . A A . 14 GLU CB 1 1 20 8803 1 1 14 GLU CD C -7.236 3.220 1.632 1.00 . A A . 14 GLU CD 1 1 20 8804 1 1 14 GLU CG C -6.197 2.645 0.677 1.00 . A A . 14 GLU CG 1 1 20 8805 1 1 14 GLU H H -4.384 -0.682 1.897 1.00 . A A . 14 GLU H 1 1 20 8806 1 1 14 GLU HA H -6.909 0.045 0.558 1.00 . A A . 14 GLU HA 1 1 20 8807 1 1 14 GLU HB2 H -5.810 1.383 2.358 1.00 . A A . 14 GLU HB2 1 1 20 8808 1 1 14 GLU HB3 H -4.425 1.621 1.294 1.00 . A A . 14 GLU HB3 1 1 20 8809 1 1 14 GLU HG2 H -5.469 3.397 0.437 1.00 . A A . 14 GLU HG2 1 1 20 8810 1 1 14 GLU HG3 H -6.685 2.318 -0.224 1.00 . A A . 14 GLU HG3 1 1 20 8811 1 1 14 GLU N N -5.204 -0.887 1.409 1.00 . A A . 14 GLU N 1 1 20 8812 1 1 14 GLU O O -5.883 0.650 -1.767 1.00 . A A . 14 GLU O 1 1 20 8813 1 1 14 GLU OE1 O -6.876 4.075 2.421 1.00 . A A . 14 GLU OE1 1 1 20 8814 1 1 14 GLU OE2 O -8.377 2.796 1.560 1.00 . A A . 14 GLU OE2 1 1 20 8815 1 1 15 CYS C C -3.460 -1.757 -2.989 1.00 . A A . 15 CYS C 1 1 20 8816 1 1 15 CYS CA C -3.489 -0.340 -2.404 1.00 . A A . 15 CYS CA 1 1 20 8817 1 1 15 CYS CB C -2.071 0.237 -2.314 1.00 . A A . 15 CYS CB 1 1 20 8818 1 1 15 CYS H H -3.563 -0.720 -0.260 1.00 . A A . 15 CYS H 1 1 20 8819 1 1 15 CYS HA H -4.089 0.293 -3.038 1.00 . A A . 15 CYS HA 1 1 20 8820 1 1 15 CYS HB2 H -1.502 -0.091 -3.168 1.00 . A A . 15 CYS HB2 1 1 20 8821 1 1 15 CYS HB3 H -2.129 1.317 -2.320 1.00 . A A . 15 CYS HB3 1 1 20 8822 1 1 15 CYS N N -4.066 -0.336 -1.018 1.00 . A A . 15 CYS N 1 1 20 8823 1 1 15 CYS O O -3.321 -2.738 -2.278 1.00 . A A . 15 CYS O 1 1 20 8824 1 1 15 CYS SG S -1.240 -0.308 -0.802 1.00 . A A . 15 CYS SG 1 1 20 8825 1 1 16 CYS C C -2.158 -3.789 -4.904 1.00 . A A . 16 CYS C 1 1 20 8826 1 1 16 CYS CA C -3.570 -3.197 -4.963 1.00 . A A . 16 CYS CA 1 1 20 8827 1 1 16 CYS CB C -3.977 -2.930 -6.418 1.00 . A A . 16 CYS CB 1 1 20 8828 1 1 16 CYS H H -3.690 -1.043 -4.830 1.00 . A A . 16 CYS H 1 1 20 8829 1 1 16 CYS HA H -4.281 -3.860 -4.497 1.00 . A A . 16 CYS HA 1 1 20 8830 1 1 16 CYS HB2 H -3.552 -1.994 -6.746 1.00 . A A . 16 CYS HB2 1 1 20 8831 1 1 16 CYS HB3 H -3.607 -3.729 -7.045 1.00 . A A . 16 CYS HB3 1 1 20 8832 1 1 16 CYS N N -3.588 -1.859 -4.290 1.00 . A A . 16 CYS N 1 1 20 8833 1 1 16 CYS O O -1.180 -3.070 -4.779 1.00 . A A . 16 CYS O 1 1 20 8834 1 1 16 CYS SG S -5.785 -2.851 -6.554 1.00 . A A . 16 CYS SG 1 1 20 8835 1 1 17 GLY C C -0.132 -5.510 -3.505 1.00 . A A . 17 GLY C 1 1 20 8836 1 1 17 GLY CA C -0.684 -5.722 -4.914 1.00 . A A . 17 GLY CA 1 1 20 8837 1 1 17 GLY H H -2.835 -5.652 -5.075 1.00 . A A . 17 GLY H 1 1 20 8838 1 1 17 GLY HA2 H -0.764 -6.781 -5.120 1.00 . A A . 17 GLY HA2 1 1 20 8839 1 1 17 GLY HA3 H -0.030 -5.254 -5.634 1.00 . A A . 17 GLY HA3 1 1 20 8840 1 1 17 GLY N N -2.037 -5.090 -4.983 1.00 . A A . 17 GLY N 1 1 20 8841 1 1 17 GLY O O 0.894 -4.886 -3.330 1.00 . A A . 17 GLY O 1 1 20 8842 1 1 18 TRP C C 0.857 -5.080 -0.862 1.00 . A A . 18 TRP C 1 1 20 8843 1 1 18 TRP CA C -0.443 -5.878 -1.066 1.00 . A A . 18 TRP CA 1 1 20 8844 1 1 18 TRP CB C -0.291 -7.316 -0.555 1.00 . A A . 18 TRP CB 1 1 20 8845 1 1 18 TRP CD1 C -2.586 -7.144 0.509 1.00 . A A . 18 TRP CD1 1 1 20 8846 1 1 18 TRP CD2 C -2.186 -9.175 -0.380 1.00 . A A . 18 TRP CD2 1 1 20 8847 1 1 18 TRP CE2 C -3.490 -9.220 0.176 1.00 . A A . 18 TRP CE2 1 1 20 8848 1 1 18 TRP CE3 C -1.693 -10.335 -1.004 1.00 . A A . 18 TRP CE3 1 1 20 8849 1 1 18 TRP CG C -1.633 -7.847 -0.154 1.00 . A A . 18 TRP CG 1 1 20 8850 1 1 18 TRP CH2 C -3.760 -11.515 -0.511 1.00 . A A . 18 TRP CH2 1 1 20 8851 1 1 18 TRP CZ2 C -4.269 -10.374 0.111 1.00 . A A . 18 TRP CZ2 1 1 20 8852 1 1 18 TRP CZ3 C -2.478 -11.496 -1.068 1.00 . A A . 18 TRP CZ3 1 1 20 8853 1 1 18 TRP H H -1.665 -6.502 -2.724 1.00 . A A . 18 TRP H 1 1 20 8854 1 1 18 TRP HA H -1.240 -5.397 -0.529 1.00 . A A . 18 TRP HA 1 1 20 8855 1 1 18 TRP HB2 H 0.120 -7.933 -1.337 1.00 . A A . 18 TRP HB2 1 1 20 8856 1 1 18 TRP HB3 H 0.371 -7.327 0.300 1.00 . A A . 18 TRP HB3 1 1 20 8857 1 1 18 TRP HD1 H -2.503 -6.111 0.833 1.00 . A A . 18 TRP HD1 1 1 20 8858 1 1 18 TRP HE1 H -4.513 -7.693 1.159 1.00 . A A . 18 TRP HE1 1 1 20 8859 1 1 18 TRP HE3 H -0.706 -10.335 -1.436 1.00 . A A . 18 TRP HE3 1 1 20 8860 1 1 18 TRP HH2 H -4.355 -12.414 -0.565 1.00 . A A . 18 TRP HH2 1 1 20 8861 1 1 18 TRP HZ2 H -5.257 -10.387 0.541 1.00 . A A . 18 TRP HZ2 1 1 20 8862 1 1 18 TRP HZ3 H -2.091 -12.381 -1.547 1.00 . A A . 18 TRP HZ3 1 1 20 8863 1 1 18 TRP N N -0.837 -6.023 -2.514 1.00 . A A . 18 TRP N 1 1 20 8864 1 1 18 TRP NE1 N -3.687 -7.959 0.703 1.00 . A A . 18 TRP NE1 1 1 20 8865 1 1 18 TRP O O 1.955 -5.606 -0.927 1.00 . A A . 18 TRP O 1 1 20 8866 1 1 19 ASN C C 1.716 -2.233 1.000 1.00 . A A . 19 ASN C 1 1 20 8867 1 1 19 ASN CA C 1.888 -2.917 -0.360 1.00 . A A . 19 ASN CA 1 1 20 8868 1 1 19 ASN CB C 1.850 -1.910 -1.509 1.00 . A A . 19 ASN CB 1 1 20 8869 1 1 19 ASN CG C 3.031 -0.951 -1.380 1.00 . A A . 19 ASN CG 1 1 20 8870 1 1 19 ASN H H -0.192 -3.430 -0.540 1.00 . A A . 19 ASN H 1 1 20 8871 1 1 19 ASN HA H 2.813 -3.475 -0.386 1.00 . A A . 19 ASN HA 1 1 20 8872 1 1 19 ASN HB2 H 1.910 -2.440 -2.453 1.00 . A A . 19 ASN HB2 1 1 20 8873 1 1 19 ASN HB3 H 0.927 -1.353 -1.470 1.00 . A A . 19 ASN HB3 1 1 20 8874 1 1 19 ASN HD21 H 4.136 -1.843 -2.766 1.00 . A A . 19 ASN HD21 1 1 20 8875 1 1 19 ASN HD22 H 4.835 -0.476 -2.047 1.00 . A A . 19 ASN HD22 1 1 20 8876 1 1 19 ASN N N 0.712 -3.808 -0.598 1.00 . A A . 19 ASN N 1 1 20 8877 1 1 19 ASN ND2 N 4.089 -1.105 -2.124 1.00 . A A . 19 ASN ND2 1 1 20 8878 1 1 19 ASN O O 0.635 -2.214 1.555 1.00 . A A . 19 ASN O 1 1 20 8879 1 1 19 ASN OD1 O 2.996 -0.053 -0.576 1.00 . A A . 19 ASN OD1 1 1 20 8880 1 1 20 ALA C C 2.364 0.441 2.799 1.00 . A A . 20 ALA C 1 1 20 8881 1 1 20 ALA CA C 2.644 -1.058 2.898 1.00 . A A . 20 ALA CA 1 1 20 8882 1 1 20 ALA CB C 3.992 -1.283 3.570 1.00 . A A . 20 ALA CB 1 1 20 8883 1 1 20 ALA H H 3.634 -1.737 1.103 1.00 . A A . 20 ALA H 1 1 20 8884 1 1 20 ALA HA H 1.870 -1.541 3.473 1.00 . A A . 20 ALA HA 1 1 20 8885 1 1 20 ALA HB1 H 4.765 -0.812 2.979 1.00 . A A . 20 ALA HB1 1 1 20 8886 1 1 20 ALA HB2 H 4.189 -2.342 3.646 1.00 . A A . 20 ALA HB2 1 1 20 8887 1 1 20 ALA HB3 H 3.979 -0.846 4.556 1.00 . A A . 20 ALA HB3 1 1 20 8888 1 1 20 ALA N N 2.764 -1.699 1.556 1.00 . A A . 20 ALA N 1 1 20 8889 1 1 20 ALA O O 3.169 1.204 2.292 1.00 . A A . 20 ALA O 1 1 20 8890 1 1 21 CYS C C 1.777 2.944 4.475 1.00 . A A . 21 CYS C 1 1 20 8891 1 1 21 CYS CA C 0.951 2.336 3.345 1.00 . A A . 21 CYS CA 1 1 20 8892 1 1 21 CYS CB C -0.557 2.443 3.619 1.00 . A A . 21 CYS CB 1 1 20 8893 1 1 21 CYS H H 0.656 0.247 3.788 1.00 . A A . 21 CYS H 1 1 20 8894 1 1 21 CYS HA H 1.203 2.782 2.399 1.00 . A A . 21 CYS HA 1 1 20 8895 1 1 21 CYS HB2 H -1.084 1.721 3.014 1.00 . A A . 21 CYS HB2 1 1 20 8896 1 1 21 CYS HB3 H -0.748 2.238 4.663 1.00 . A A . 21 CYS HB3 1 1 20 8897 1 1 21 CYS N N 1.259 0.876 3.342 1.00 . A A . 21 CYS N 1 1 20 8898 1 1 21 CYS O O 1.337 3.022 5.606 1.00 . A A . 21 CYS O 1 1 20 8899 1 1 21 CYS SG S -1.144 4.113 3.220 1.00 . A A . 21 CYS SG 1 1 20 8900 1 1 22 ALA C C 4.019 5.343 5.289 1.00 . A A . 22 ALA C 1 1 20 8901 1 1 22 ALA CA C 3.906 3.808 5.264 1.00 . A A . 22 ALA CA 1 1 20 8902 1 1 22 ALA CB C 5.268 3.178 4.947 1.00 . A A . 22 ALA CB 1 1 20 8903 1 1 22 ALA H H 3.348 3.155 3.282 1.00 . A A . 22 ALA H 1 1 20 8904 1 1 22 ALA HA H 3.567 3.453 6.226 1.00 . A A . 22 ALA HA 1 1 20 8905 1 1 22 ALA HB1 H 6.028 3.631 5.568 1.00 . A A . 22 ALA HB1 1 1 20 8906 1 1 22 ALA HB2 H 5.509 3.346 3.904 1.00 . A A . 22 ALA HB2 1 1 20 8907 1 1 22 ALA HB3 H 5.232 2.116 5.140 1.00 . A A . 22 ALA HB3 1 1 20 8908 1 1 22 ALA N N 3.005 3.291 4.192 1.00 . A A . 22 ALA N 1 1 20 8909 1 1 22 ALA O O 3.374 6.000 6.078 1.00 . A A . 22 ALA O 1 1 20 8910 1 1 23 LEU C C 3.867 8.134 3.889 1.00 . A A . 23 LEU C 1 1 20 8911 1 1 23 LEU CA C 5.084 7.395 4.476 1.00 . A A . 23 LEU CA 1 1 20 8912 1 1 23 LEU CB C 6.341 7.617 3.605 1.00 . A A . 23 LEU CB 1 1 20 8913 1 1 23 LEU CD1 C 7.392 6.208 5.456 1.00 . A A . 23 LEU CD1 1 1 20 8914 1 1 23 LEU CD2 C 8.663 6.698 3.372 1.00 . A A . 23 LEU CD2 1 1 20 8915 1 1 23 LEU CG C 7.643 7.260 4.366 1.00 . A A . 23 LEU CG 1 1 20 8916 1 1 23 LEU H H 5.409 5.348 3.869 1.00 . A A . 23 LEU H 1 1 20 8917 1 1 23 LEU HA H 5.275 7.740 5.480 1.00 . A A . 23 LEU HA 1 1 20 8918 1 1 23 LEU HB2 H 6.273 7.003 2.723 1.00 . A A . 23 LEU HB2 1 1 20 8919 1 1 23 LEU HB3 H 6.384 8.656 3.306 1.00 . A A . 23 LEU HB3 1 1 20 8920 1 1 23 LEU HD11 H 8.280 6.101 6.061 1.00 . A A . 23 LEU HD11 1 1 20 8921 1 1 23 LEU HD12 H 7.156 5.260 4.995 1.00 . A A . 23 LEU HD12 1 1 20 8922 1 1 23 LEU HD13 H 6.568 6.522 6.078 1.00 . A A . 23 LEU HD13 1 1 20 8923 1 1 23 LEU HD21 H 8.597 5.616 3.351 1.00 . A A . 23 LEU HD21 1 1 20 8924 1 1 23 LEU HD22 H 9.660 6.989 3.672 1.00 . A A . 23 LEU HD22 1 1 20 8925 1 1 23 LEU HD23 H 8.459 7.088 2.387 1.00 . A A . 23 LEU HD23 1 1 20 8926 1 1 23 LEU HG H 8.048 8.152 4.824 1.00 . A A . 23 LEU HG 1 1 20 8927 1 1 23 LEU N N 4.875 5.907 4.467 1.00 . A A . 23 LEU N 1 1 20 8928 1 1 23 LEU O O 3.988 8.910 2.959 1.00 . A A . 23 LEU O 1 1 20 8929 1 1 24 GLY C C 0.993 7.951 2.608 1.00 . A A . 24 GLY C 1 1 20 8930 1 1 24 GLY CA C 1.470 8.594 3.921 1.00 . A A . 24 GLY CA 1 1 20 8931 1 1 24 GLY H H 2.629 7.283 5.189 1.00 . A A . 24 GLY H 1 1 20 8932 1 1 24 GLY HA2 H 0.686 8.515 4.661 1.00 . A A . 24 GLY HA2 1 1 20 8933 1 1 24 GLY HA3 H 1.691 9.635 3.747 1.00 . A A . 24 GLY HA3 1 1 20 8934 1 1 24 GLY N N 2.697 7.906 4.434 1.00 . A A . 24 GLY N 1 1 20 8935 1 1 24 GLY O O 0.017 8.384 2.022 1.00 . A A . 24 GLY O 1 1 20 8936 1 1 25 ILE C C 1.704 4.809 0.883 1.00 . A A . 25 ILE C 1 1 20 8937 1 1 25 ILE CA C 1.248 6.266 0.861 1.00 . A A . 25 ILE CA 1 1 20 8938 1 1 25 ILE CB C 1.976 6.996 -0.286 1.00 . A A . 25 ILE CB 1 1 20 8939 1 1 25 ILE CD1 C 3.354 8.959 -0.992 1.00 . A A . 25 ILE CD1 1 1 20 8940 1 1 25 ILE CG1 C 2.587 8.328 0.174 1.00 . A A . 25 ILE CG1 1 1 20 8941 1 1 25 ILE CG2 C 1.002 7.279 -1.412 1.00 . A A . 25 ILE CG2 1 1 20 8942 1 1 25 ILE H H 2.442 6.589 2.622 1.00 . A A . 25 ILE H 1 1 20 8943 1 1 25 ILE HA H 0.181 6.332 0.725 1.00 . A A . 25 ILE HA 1 1 20 8944 1 1 25 ILE HB H 2.751 6.356 -0.657 1.00 . A A . 25 ILE HB 1 1 20 8945 1 1 25 ILE HD11 H 3.430 10.026 -0.840 1.00 . A A . 25 ILE HD11 1 1 20 8946 1 1 25 ILE HD12 H 2.826 8.763 -1.913 1.00 . A A . 25 ILE HD12 1 1 20 8947 1 1 25 ILE HD13 H 4.343 8.530 -1.045 1.00 . A A . 25 ILE HD13 1 1 20 8948 1 1 25 ILE HG12 H 1.799 8.997 0.490 1.00 . A A . 25 ILE HG12 1 1 20 8949 1 1 25 ILE HG13 H 3.263 8.156 0.997 1.00 . A A . 25 ILE HG13 1 1 20 8950 1 1 25 ILE HG21 H 0.547 6.355 -1.734 1.00 . A A . 25 ILE HG21 1 1 20 8951 1 1 25 ILE HG22 H 1.541 7.724 -2.235 1.00 . A A . 25 ILE HG22 1 1 20 8952 1 1 25 ILE HG23 H 0.240 7.961 -1.069 1.00 . A A . 25 ILE HG23 1 1 20 8953 1 1 25 ILE N N 1.663 6.928 2.137 1.00 . A A . 25 ILE N 1 1 20 8954 1 1 25 ILE O O 2.378 4.383 1.802 1.00 . A A . 25 ILE O 1 1 20 8955 1 1 26 CYS C C 3.272 2.630 -0.760 1.00 . A A . 26 CYS C 1 1 20 8956 1 1 26 CYS CA C 1.875 2.634 -0.156 1.00 . A A . 26 CYS CA 1 1 20 8957 1 1 26 CYS CB C 0.874 1.866 -1.017 1.00 . A A . 26 CYS CB 1 1 20 8958 1 1 26 CYS H H 0.893 4.414 -0.903 1.00 . A A . 26 CYS H 1 1 20 8959 1 1 26 CYS HA H 1.897 2.230 0.842 1.00 . A A . 26 CYS HA 1 1 20 8960 1 1 26 CYS HB2 H 0.550 2.490 -1.834 1.00 . A A . 26 CYS HB2 1 1 20 8961 1 1 26 CYS HB3 H 1.339 0.976 -1.409 1.00 . A A . 26 CYS HB3 1 1 20 8962 1 1 26 CYS N N 1.397 4.048 -0.134 1.00 . A A . 26 CYS N 1 1 20 8963 1 1 26 CYS O O 3.468 3.092 -1.867 1.00 . A A . 26 CYS O 1 1 20 8964 1 1 26 CYS SG S -0.549 1.408 0.010 1.00 . A A . 26 CYS SG 1 1 20 8965 1 1 27 MET C C 6.493 1.006 -0.097 1.00 . A A . 27 MET C 1 1 20 8966 1 1 27 MET CA C 5.634 2.188 -0.605 1.00 . A A . 27 MET CA 1 1 20 8967 1 1 27 MET CB C 6.186 3.547 -0.147 1.00 . A A . 27 MET CB 1 1 20 8968 1 1 27 MET CE C 5.044 6.375 0.946 1.00 . A A . 27 MET CE 1 1 20 8969 1 1 27 MET CG C 5.663 4.666 -1.054 1.00 . A A . 27 MET CG 1 1 20 8970 1 1 27 MET H H 4.095 1.802 0.862 1.00 . A A . 27 MET H 1 1 20 8971 1 1 27 MET HA H 5.588 2.168 -1.682 1.00 . A A . 27 MET HA 1 1 20 8972 1 1 27 MET HB2 H 5.857 3.738 0.861 1.00 . A A . 27 MET HB2 1 1 20 8973 1 1 27 MET HB3 H 7.264 3.529 -0.173 1.00 . A A . 27 MET HB3 1 1 20 8974 1 1 27 MET HE1 H 4.985 7.399 1.286 1.00 . A A . 27 MET HE1 1 1 20 8975 1 1 27 MET HE2 H 5.370 5.747 1.760 1.00 . A A . 27 MET HE2 1 1 20 8976 1 1 27 MET HE3 H 4.072 6.046 0.609 1.00 . A A . 27 MET HE3 1 1 20 8977 1 1 27 MET HG2 H 6.029 4.528 -2.060 1.00 . A A . 27 MET HG2 1 1 20 8978 1 1 27 MET HG3 H 4.586 4.645 -1.061 1.00 . A A . 27 MET HG3 1 1 20 8979 1 1 27 MET N N 4.258 2.156 -0.044 1.00 . A A . 27 MET N 1 1 20 8980 1 1 27 MET O O 6.681 0.050 -0.826 1.00 . A A . 27 MET O 1 1 20 8981 1 1 27 MET SD S 6.228 6.261 -0.417 1.00 . A A . 27 MET SD 1 1 20 8982 1 1 28 PRO C C 7.054 -1.195 2.103 1.00 . A A . 28 PRO C 1 1 20 8983 1 1 28 PRO CA C 7.880 0.022 1.663 1.00 . A A . 28 PRO CA 1 1 20 8984 1 1 28 PRO CB C 8.551 0.679 2.868 1.00 . A A . 28 PRO CB 1 1 20 8985 1 1 28 PRO CD C 6.851 2.202 2.075 1.00 . A A . 28 PRO CD 1 1 20 8986 1 1 28 PRO CG C 7.608 1.752 3.297 1.00 . A A . 28 PRO CG 1 1 20 8987 1 1 28 PRO HA H 8.623 -0.269 0.940 1.00 . A A . 28 PRO HA 1 1 20 8988 1 1 28 PRO HB2 H 8.690 -0.042 3.657 1.00 . A A . 28 PRO HB2 1 1 20 8989 1 1 28 PRO HB3 H 9.495 1.121 2.582 1.00 . A A . 28 PRO HB3 1 1 20 8990 1 1 28 PRO HD2 H 5.807 2.350 2.314 1.00 . A A . 28 PRO HD2 1 1 20 8991 1 1 28 PRO HD3 H 7.284 3.108 1.681 1.00 . A A . 28 PRO HD3 1 1 20 8992 1 1 28 PRO HG2 H 6.920 1.365 4.037 1.00 . A A . 28 PRO HG2 1 1 20 8993 1 1 28 PRO HG3 H 8.159 2.580 3.705 1.00 . A A . 28 PRO HG3 1 1 20 8994 1 1 28 PRO N N 7.014 1.105 1.114 1.00 . A A . 28 PRO N 1 1 20 8995 1 1 28 PRO O O 6.820 -1.402 3.279 1.00 . A A . 28 PRO O 1 1 20 8996 1 1 29 ARG C C 6.657 -4.211 2.330 1.00 . A A . 29 ARG C 1 1 20 8997 1 1 29 ARG CA C 5.825 -3.220 1.506 1.00 . A A . 29 ARG CA 1 1 20 8998 1 1 29 ARG CB C 5.433 -3.844 0.162 1.00 . A A . 29 ARG CB 1 1 20 8999 1 1 29 ARG CD C 6.729 -3.574 -1.964 1.00 . A A . 29 ARG CD 1 1 20 9000 1 1 29 ARG CG C 6.686 -4.280 -0.607 1.00 . A A . 29 ARG CG 1 1 20 9001 1 1 29 ARG CZ C 5.909 -4.252 -4.169 1.00 . A A . 29 ARG CZ 1 1 20 9002 1 1 29 ARG H H 6.835 -1.802 0.226 1.00 . A A . 29 ARG H 1 1 20 9003 1 1 29 ARG HA H 4.941 -2.944 2.053 1.00 . A A . 29 ARG HA 1 1 20 9004 1 1 29 ARG HB2 H 4.813 -4.709 0.345 1.00 . A A . 29 ARG HB2 1 1 20 9005 1 1 29 ARG HB3 H 4.881 -3.125 -0.424 1.00 . A A . 29 ARG HB3 1 1 20 9006 1 1 29 ARG HD2 H 6.319 -2.578 -1.877 1.00 . A A . 29 ARG HD2 1 1 20 9007 1 1 29 ARG HD3 H 7.743 -3.536 -2.331 1.00 . A A . 29 ARG HD3 1 1 20 9008 1 1 29 ARG HE H 5.315 -5.122 -2.481 1.00 . A A . 29 ARG HE 1 1 20 9009 1 1 29 ARG HG2 H 7.569 -4.020 -0.039 1.00 . A A . 29 ARG HG2 1 1 20 9010 1 1 29 ARG HG3 H 6.660 -5.348 -0.757 1.00 . A A . 29 ARG HG3 1 1 20 9011 1 1 29 ARG HH11 H 7.186 -2.709 -4.128 1.00 . A A . 29 ARG HH11 1 1 20 9012 1 1 29 ARG HH12 H 6.670 -3.200 -5.702 1.00 . A A . 29 ARG HH12 1 1 20 9013 1 1 29 ARG HH21 H 4.641 -5.760 -4.531 1.00 . A A . 29 ARG HH21 1 1 20 9014 1 1 29 ARG HH22 H 5.196 -4.900 -5.925 1.00 . A A . 29 ARG HH22 1 1 20 9015 1 1 29 ARG N N 6.625 -2.001 1.161 1.00 . A A . 29 ARG N 1 1 20 9016 1 1 29 ARG NE N 5.884 -4.421 -2.868 1.00 . A A . 29 ARG NE 1 1 20 9017 1 1 29 ARG NH1 N 6.641 -3.313 -4.709 1.00 . A A . 29 ARG NH1 1 1 20 9018 1 1 29 ARG NH2 N 5.199 -5.033 -4.937 1.00 . A A . 29 ARG NH2 1 1 20 9019 1 1 29 ARG O O 7.871 -4.162 2.235 1.00 . A A . 29 ARG O 1 1 20 9020 1 1 29 ARG OXT O 6.063 -5.006 3.041 1.00 . A A . 29 ARG OXT 1 1 stop_ save_
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