NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
395582 | 1ry3 | 6069 | cing | 4-filtered-FRED | STAR | entry | full | 161 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1ry3 # This FRED archive file contains, for PDB entry <1ry3>: # # - 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_1ry3 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1ry3 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state unknown _Assembly.Molecular_mass 3015.52 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 $Bacteriocin_carnobacteriocin_B2 A . 1 1 stop_ save_ save_Bacteriocin_carnobacteriocin_B2 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Bacteriocin carnobacteriocin B2" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code MNSVKELNVKEMKQLHGGVNYGNGVSCSKTKCSVNWGQAFQERYTAGINSFVSGVASGAGSIGR _Entity.Number_of_monomers 64 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 MET . 1 1 2 ASN . 1 1 3 SER . 1 1 4 VAL . 1 1 5 LYS . 1 1 6 GLU . 1 1 7 LEU . 1 1 8 ASN . 1 1 9 VAL . 1 1 10 LYS . 1 1 11 GLU . 1 1 12 MET . 1 1 13 LYS . 1 1 14 GLN . 1 1 15 LEU . 1 1 16 HIS . 1 1 17 GLY . 1 1 18 GLY . 1 1 19 VAL . 1 1 20 ASN . 1 1 21 TYR . 1 1 22 GLY . 1 1 23 ASN . 1 1 24 GLY . 1 1 25 VAL . 1 1 26 SER . 1 1 27 CYS . 1 1 28 SER . 1 1 29 LYS . 1 1 30 THR . 1 1 31 LYS . 1 1 32 CYS . 1 1 33 SER . 1 1 34 VAL . 1 1 35 ASN . 1 1 36 TRP . 1 1 37 GLY . 1 1 38 GLN . 1 1 39 ALA . 1 1 40 PHE . 1 1 41 GLN . 1 1 42 GLU . 1 1 43 ARG . 1 1 44 TYR . 1 1 45 THR . 1 1 46 ALA . 1 1 47 GLY . 1 1 48 ILE . 1 1 49 ASN . 1 1 50 SER . 1 1 51 PHE . 1 1 52 VAL . 1 1 53 SER . 1 1 54 GLY . 1 1 55 VAL . 1 1 56 ALA . 1 1 57 SER . 1 1 58 GLY . 1 1 59 ALA . 1 1 60 GLY . 1 1 61 SER . 1 1 62 ILE . 1 1 63 GLY . 1 1 64 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 MET 1 1 1 1 ASN 2 2 1 1 SER 3 3 1 1 VAL 4 4 1 1 LYS 5 5 1 1 GLU 6 6 1 1 LEU 7 7 1 1 ASN 8 8 1 1 VAL 9 9 1 1 LYS 10 10 1 1 GLU 11 11 1 1 MET 12 12 1 1 LYS 13 13 1 1 GLN 14 14 1 1 LEU 15 15 1 1 HIS 16 16 1 1 GLY 17 17 1 1 GLY 18 18 1 1 VAL 19 19 1 1 ASN 20 20 1 1 TYR 21 21 1 1 GLY 22 22 1 1 ASN 23 23 1 1 GLY 24 24 1 1 VAL 25 25 1 1 SER 26 26 1 1 CYS 27 27 1 1 SER 28 28 1 1 LYS 29 29 1 1 THR 30 30 1 1 LYS 31 31 1 1 CYS 32 32 1 1 SER 33 33 1 1 VAL 34 34 1 1 ASN 35 35 1 1 TRP 36 36 1 1 GLY 37 37 1 1 GLN 38 38 1 1 ALA 39 39 1 1 PHE 40 40 1 1 GLN 41 41 1 1 GLU 42 42 1 1 ARG 43 43 1 1 TYR 44 44 1 1 THR 45 45 1 1 ALA 46 46 1 1 GLY 47 47 1 1 ILE 48 48 1 1 ASN 49 49 1 1 SER 50 50 1 1 PHE 51 51 1 1 VAL 52 52 1 1 SER 53 53 1 1 GLY 54 54 1 1 VAL 55 55 1 1 ALA 56 56 1 1 SER 57 57 1 1 GLY 58 58 1 1 ALA 59 59 1 1 GLY 60 60 1 1 SER 61 61 1 1 ILE 62 62 1 1 GLY 63 63 1 1 ARG 64 64 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 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 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 20 ASN H . 2 . HN 1 1 1 1 2 1 1 21 TYR H . 3 . HN 1 1 2 1 1 1 1 20 ASN HA . 2 . HA 1 1 2 1 2 1 1 21 TYR H . 3 . HN 1 1 3 1 1 1 1 21 TYR H . 3 . HN 1 1 3 1 2 1 1 21 TYR QB . 3 . HB# 1 1 4 1 1 1 1 21 TYR H . 3 . HN 1 1 4 1 2 1 1 22 GLY H . 4 . HN 1 1 5 1 1 1 1 21 TYR HA . 3 . HA 1 1 5 1 2 1 1 22 GLY H . 4 . HN 1 1 6 1 1 1 1 21 TYR QB . 3 . HB# 1 1 6 1 2 1 1 22 GLY H . 4 . HN 1 1 7 1 1 1 1 22 GLY H . 4 . HN 1 1 7 1 2 1 1 23 ASN H . 5 . HN 1 1 8 1 1 1 1 23 ASN H . 5 . HN 1 1 8 1 2 1 1 24 GLY H . 6 . HN 1 1 9 1 1 1 1 24 GLY H . 6 . HN 1 1 9 1 2 1 1 25 VAL H . 7 . HN 1 1 10 1 1 1 1 25 VAL H . 7 . HN 1 1 10 1 2 1 1 26 SER H . 8 . HN 1 1 11 1 1 1 1 26 SER HA . 8 . HA 1 1 11 1 2 1 1 27 CYS H . 9 . HN 1 1 12 1 1 1 1 27 CYS H . 9 . HN 1 1 12 1 2 1 1 27 CYS QB . 9 . HB# 1 1 13 1 1 1 1 27 CYS H . 9 . HN 1 1 13 1 2 1 1 32 CYS HA . 14 . HA 1 1 14 1 1 1 1 27 CYS HA . 9 . HA 1 1 14 1 2 1 1 28 SER H . 10 . HN 1 1 15 1 1 1 1 27 CYS HA . 9 . HA 1 1 15 1 2 1 1 30 THR H . 12 . HN 1 1 16 1 1 1 1 27 CYS HA . 9 . HA 1 1 16 1 2 1 1 32 CYS HA . 14 . HA 1 1 17 1 1 1 1 27 CYS HA . 9 . HA 1 1 17 1 2 1 1 32 CYS QB . 14 . HB# 1 1 18 1 1 1 1 27 CYS QB . 9 . HB# 1 1 18 1 2 1 1 28 SER H . 10 . HN 1 1 19 1 1 1 1 27 CYS QB . 9 . HB# 1 1 19 1 2 1 1 30 THR H . 12 . HN 1 1 20 1 1 1 1 27 CYS QB . 9 . HB# 1 1 20 1 2 1 1 32 CYS HA . 14 . HA 1 1 21 1 1 1 1 28 SER H . 10 . HN 1 1 21 1 2 1 1 29 LYS H . 11 . HN 1 1 22 1 1 1 1 28 SER H . 10 . HN 1 1 22 1 2 1 1 29 LYS QB . 11 . HB# 1 1 23 1 1 1 1 28 SER H . 10 . HN 1 1 23 1 2 1 1 32 CYS HA . 14 . HA 1 1 24 1 1 1 1 28 SER HA . 10 . HA 1 1 24 1 2 1 1 28 SER QB . 10 . HB# 1 1 25 1 1 1 1 28 SER HA . 10 . HA 1 1 25 1 2 1 1 29 LYS H . 11 . HN 1 1 26 1 1 1 1 28 SER QB . 10 . HB# 1 1 26 1 2 1 1 29 LYS H . 11 . HN 1 1 27 1 1 1 1 29 LYS H . 11 . HN 1 1 27 1 2 1 1 29 LYS QB . 11 . HB# 1 1 28 1 1 1 1 29 LYS H . 11 . HN 1 1 28 1 2 1 1 30 THR H . 12 . HN 1 1 29 1 1 1 1 29 LYS HA . 11 . HA 1 1 29 1 2 1 1 29 LYS QB . 11 . HB# 1 1 30 1 1 1 1 29 LYS HA . 11 . HA 1 1 30 1 2 1 1 30 THR H . 12 . HN 1 1 31 1 1 1 1 29 LYS QB . 11 . HB# 1 1 31 1 2 1 1 30 THR H . 12 . HN 1 1 32 1 1 1 1 30 THR H . 12 . HN 1 1 32 1 2 1 1 30 THR HA . 12 . HA 1 1 33 1 1 1 1 30 THR HA . 12 . HA 1 1 33 1 2 1 1 31 LYS H . 13 . HN 1 1 34 1 1 1 1 31 LYS H . 13 . HN 1 1 34 1 2 1 1 31 LYS HA . 13 . HA 1 1 35 1 1 1 1 31 LYS H . 13 . HN 1 1 35 1 2 1 1 32 CYS H . 14 . HN 1 1 36 1 1 1 1 31 LYS HA . 13 . HA 1 1 36 1 2 1 1 32 CYS H . 14 . HN 1 1 37 1 1 1 1 32 CYS H . 14 . HN 1 1 37 1 2 1 1 32 CYS QB . 14 . HB# 1 1 38 1 1 1 1 32 CYS H . 14 . HN 1 1 38 1 2 1 1 33 SER H . 15 . HN 1 1 39 1 1 1 1 32 CYS HA . 14 . HA 1 1 39 1 2 1 1 33 SER H . 15 . HN 1 1 40 1 1 1 1 32 CYS QB . 14 . HB# 1 1 40 1 2 1 1 33 SER H . 15 . HN 1 1 41 1 1 1 1 33 SER H . 15 . HN 1 1 41 1 2 1 1 34 VAL H . 16 . HN 1 1 42 1 1 1 1 33 SER HA . 15 . HA 1 1 42 1 2 1 1 33 SER QB . 15 . HB# 1 1 43 1 1 1 1 33 SER HA . 15 . HA 1 1 43 1 2 1 1 34 VAL H . 16 . HN 1 1 44 1 1 1 1 33 SER QB . 15 . HB# 1 1 44 1 2 1 1 34 VAL H . 16 . HN 1 1 45 1 1 1 1 34 VAL H . 16 . HN 1 1 45 1 2 1 1 35 ASN H . 17 . HN 1 1 46 1 1 1 1 34 VAL HA . 16 . HA 1 1 46 1 2 1 1 35 ASN H . 17 . HN 1 1 47 1 1 1 1 35 ASN H . 17 . HN 1 1 47 1 2 1 1 36 TRP H . 18 . HN 1 1 48 1 1 1 1 35 ASN H . 17 . HN 1 1 48 1 2 1 1 36 TRP HA . 18 . HA 1 1 49 1 1 1 1 35 ASN HA . 17 . HA 1 1 49 1 2 1 1 36 TRP H . 18 . HN 1 1 50 1 1 1 1 35 ASN HA . 17 . HA 1 1 50 1 2 1 1 37 GLY H . 19 . HN 1 1 51 1 1 1 1 36 TRP H . 18 . HN 1 1 51 1 2 1 1 36 TRP HA . 18 . HA 1 1 52 1 1 1 1 36 TRP H . 18 . HN 1 1 52 1 2 1 1 36 TRP QB . 18 . HB# 1 1 53 1 1 1 1 36 TRP H . 18 . HN 1 1 53 1 2 1 1 37 GLY H . 19 . HN 1 1 54 1 1 1 1 36 TRP HA . 18 . HA 1 1 54 1 2 1 1 37 GLY H . 19 . HN 1 1 55 1 1 1 1 36 TRP HA . 18 . HA 1 1 55 1 2 1 1 39 ALA H . 21 . HN 1 1 56 1 1 1 1 36 TRP QB . 18 . HB# 1 1 56 1 2 1 1 37 GLY H . 19 . HN 1 1 57 1 1 1 1 37 GLY H . 19 . HN 1 1 57 1 2 1 1 38 GLN H . 20 . HN 1 1 58 1 1 1 1 37 GLY H . 19 . HN 1 1 58 1 2 1 1 40 PHE QB . 22 . HB# 1 1 59 1 1 1 1 39 ALA H . 21 . HN 1 1 59 1 2 1 1 39 ALA HA . 21 . HA 1 1 60 1 1 1 1 39 ALA H . 21 . HN 1 1 60 1 2 1 1 40 PHE H . 22 . HN 1 1 61 1 1 1 1 39 ALA H . 21 . HN 1 1 61 1 2 1 1 40 PHE QB . 22 . HB# 1 1 62 1 1 1 1 39 ALA H . 21 . HN 1 1 62 1 2 1 1 41 GLN H . 23 . HN 1 1 63 1 1 1 1 39 ALA HA . 21 . HA 1 1 63 1 2 1 1 40 PHE H . 22 . HN 1 1 64 1 1 1 1 39 ALA HA . 21 . HA 1 1 64 1 2 1 1 42 GLU H . 24 . HN 1 1 65 1 1 1 1 39 ALA HA . 21 . HA 1 1 65 1 2 1 1 42 GLU QB . 24 . HB# 1 1 66 1 1 1 1 39 ALA HA . 21 . HA 1 1 66 1 2 1 1 42 GLU QG . 24 . HG# 1 1 67 1 1 1 1 40 PHE H . 22 . HN 1 1 67 1 2 1 1 40 PHE HA . 22 . HA 1 1 68 1 1 1 1 40 PHE H . 22 . HN 1 1 68 1 2 1 1 40 PHE QB . 22 . HB# 1 1 69 1 1 1 1 40 PHE HA . 22 . HA 1 1 69 1 2 1 1 41 GLN HA . 23 . HA 1 1 70 1 1 1 1 40 PHE HA . 22 . HA 1 1 70 1 2 1 1 43 ARG H . 25 . HN 1 1 71 1 1 1 1 40 PHE HA . 22 . HA 1 1 71 1 2 1 1 43 ARG QB . 25 . HB# 1 1 72 1 1 1 1 40 PHE QB . 22 . HB# 1 1 72 1 2 1 1 41 GLN H . 23 . HN 1 1 73 1 1 1 1 41 GLN H . 23 . HN 1 1 73 1 2 1 1 41 GLN QB . 23 . HB# 1 1 74 1 1 1 1 41 GLN H . 23 . HN 1 1 74 1 2 1 1 42 GLU H . 24 . HN 1 1 75 1 1 1 1 41 GLN HA . 23 . HA 1 1 75 1 2 1 1 41 GLN QB . 23 . HB# 1 1 76 1 1 1 1 41 GLN HA . 23 . HA 1 1 76 1 2 1 1 42 GLU H . 24 . HN 1 1 77 1 1 1 1 41 GLN HA . 23 . HA 1 1 77 1 2 1 1 44 TYR H . 26 . HN 1 1 78 1 1 1 1 41 GLN HA . 23 . HA 1 1 78 1 2 1 1 44 TYR QB . 26 . HB# 1 1 79 1 1 1 1 42 GLU H . 24 . HN 1 1 79 1 2 1 1 42 GLU HA . 24 . HA 1 1 80 1 1 1 1 42 GLU H . 24 . HN 1 1 80 1 2 1 1 42 GLU QB . 24 . HB# 1 1 81 1 1 1 1 42 GLU H . 24 . HN 1 1 81 1 2 1 1 42 GLU QG . 24 . HG# 1 1 82 1 1 1 1 42 GLU H . 24 . HN 1 1 82 1 2 1 1 43 ARG H . 25 . HN 1 1 83 1 1 1 1 42 GLU H . 24 . HN 1 1 83 1 2 1 1 43 ARG QG . 25 . HG# 1 1 84 1 1 1 1 42 GLU HA . 24 . HA 1 1 84 1 2 1 1 42 GLU QB . 24 . HB# 1 1 85 1 1 1 1 42 GLU HA . 24 . HA 1 1 85 1 2 1 1 42 GLU QG . 24 . HG# 1 1 86 1 1 1 1 42 GLU HA . 24 . HA 1 1 86 1 2 1 1 43 ARG H . 25 . HN 1 1 87 1 1 1 1 42 GLU HA . 24 . HA 1 1 87 1 2 1 1 45 THR H . 27 . HN 1 1 88 1 1 1 1 42 GLU QB . 24 . HB# 1 1 88 1 2 1 1 43 ARG H . 25 . HN 1 1 89 1 1 1 1 42 GLU QG . 24 . HG# 1 1 89 1 2 1 1 43 ARG H . 25 . HN 1 1 90 1 1 1 1 43 ARG H . 25 . HN 1 1 90 1 2 1 1 43 ARG HA . 25 . HA 1 1 91 1 1 1 1 43 ARG H . 25 . HN 1 1 91 1 2 1 1 43 ARG QB . 25 . HB# 1 1 92 1 1 1 1 43 ARG H . 25 . HN 1 1 92 1 2 1 1 43 ARG QG . 25 . HG# 1 1 93 1 1 1 1 43 ARG H . 25 . HN 1 1 93 1 2 1 1 44 TYR H . 26 . HN 1 1 94 1 1 1 1 43 ARG H . 25 . HN 1 1 94 1 2 1 1 45 THR H . 27 . HN 1 1 95 1 1 1 1 43 ARG HA . 25 . HA 1 1 95 1 2 1 1 43 ARG QB . 25 . HB# 1 1 96 1 1 1 1 43 ARG HA . 25 . HA 1 1 96 1 2 1 1 44 TYR H . 26 . HN 1 1 97 1 1 1 1 43 ARG HA . 25 . HA 1 1 97 1 2 1 1 46 ALA H . 28 . HN 1 1 98 1 1 1 1 43 ARG QB . 25 . HB# 1 1 98 1 2 1 1 44 TYR H . 26 . HN 1 1 99 1 1 1 1 43 ARG QB . 25 . HB# 1 1 99 1 2 1 1 45 THR H . 27 . HN 1 1 100 1 1 1 1 44 TYR H . 26 . HN 1 1 100 1 2 1 1 44 TYR HA . 26 . HA 1 1 101 1 1 1 1 44 TYR H . 26 . HN 1 1 101 1 2 1 1 44 TYR QB . 26 . HB# 1 1 102 1 1 1 1 44 TYR H . 26 . HN 1 1 102 1 2 1 1 45 THR H . 27 . HN 1 1 103 1 1 1 1 44 TYR HA . 26 . HA 1 1 103 1 2 1 1 44 TYR QB . 26 . HB# 1 1 104 1 1 1 1 44 TYR HA . 26 . HA 1 1 104 1 2 1 1 45 THR H . 27 . HN 1 1 105 1 1 1 1 44 TYR HA . 26 . HA 1 1 105 1 2 1 1 47 GLY H . 29 . HN 1 1 106 1 1 1 1 44 TYR QB . 26 . HB# 1 1 106 1 2 1 1 45 THR H . 27 . HN 1 1 107 1 1 1 1 45 THR HA . 27 . HA 1 1 107 1 2 1 1 46 ALA H . 28 . HN 1 1 108 1 1 1 1 45 THR HA . 27 . HA 1 1 108 1 2 1 1 48 ILE H . 30 . HN 1 1 109 1 1 1 1 46 ALA H . 28 . HN 1 1 109 1 2 1 1 46 ALA HA . 28 . HA 1 1 110 1 1 1 1 46 ALA HA . 28 . HA 1 1 110 1 2 1 1 47 GLY H . 29 . HN 1 1 111 1 1 1 1 47 GLY H . 29 . HN 1 1 111 1 2 1 1 48 ILE H . 30 . HN 1 1 112 1 1 1 1 48 ILE H . 30 . HN 1 1 112 1 2 1 1 49 ASN H . 31 . HN 1 1 113 1 1 1 1 49 ASN H . 31 . HN 1 1 113 1 2 1 1 49 ASN HA . 31 . HA 1 1 114 1 1 1 1 49 ASN HA . 31 . HA 1 1 114 1 2 1 1 50 SER H . 32 . HN 1 1 115 1 1 1 1 49 ASN HA . 31 . HA 1 1 115 1 2 1 1 52 VAL H . 34 . HN 1 1 116 1 1 1 1 49 ASN HA . 31 . HA 1 1 116 1 2 1 1 53 SER H . 35 . HN 1 1 117 1 1 1 1 50 SER H . 32 . HN 1 1 117 1 2 1 1 50 SER HA . 32 . HA 1 1 118 1 1 1 1 50 SER H . 32 . HN 1 1 118 1 2 1 1 50 SER QB . 32 . HB# 1 1 119 1 1 1 1 50 SER H . 32 . HN 1 1 119 1 2 1 1 51 PHE H . 33 . HN 1 1 120 1 1 1 1 50 SER H . 32 . HN 1 1 120 1 2 1 1 51 PHE QB . 33 . HB# 1 1 121 1 1 1 1 50 SER H . 32 . HN 1 1 121 1 2 1 1 52 VAL H . 34 . HN 1 1 122 1 1 1 1 50 SER HA . 32 . HA 1 1 122 1 2 1 1 50 SER QB . 32 . HB# 1 1 123 1 1 1 1 50 SER HA . 32 . HA 1 1 123 1 2 1 1 51 PHE H . 33 . HN 1 1 124 1 1 1 1 50 SER HA . 32 . HA 1 1 124 1 2 1 1 53 SER H . 35 . HN 1 1 125 1 1 1 1 50 SER QB . 32 . HB# 1 1 125 1 2 1 1 51 PHE H . 33 . HN 1 1 126 1 1 1 1 51 PHE H . 33 . HN 1 1 126 1 2 1 1 51 PHE HA . 33 . HA 1 1 127 1 1 1 1 51 PHE H . 33 . HN 1 1 127 1 2 1 1 51 PHE QB . 33 . HB# 1 1 128 1 1 1 1 51 PHE H . 33 . HN 1 1 128 1 2 1 1 52 VAL H . 34 . HN 1 1 129 1 1 1 1 51 PHE HA . 33 . HA 1 1 129 1 2 1 1 52 VAL H . 34 . HN 1 1 130 1 1 1 1 51 PHE HA . 33 . HA 1 1 130 1 2 1 1 54 GLY H . 36 . HN 1 1 131 1 1 1 1 51 PHE QB . 33 . HB# 1 1 131 1 2 1 1 52 VAL H . 34 . HN 1 1 132 1 1 1 1 52 VAL H . 34 . HN 1 1 132 1 2 1 1 52 VAL HA . 34 . HA 1 1 133 1 1 1 1 52 VAL H . 34 . HN 1 1 133 1 2 1 1 53 SER H . 35 . HN 1 1 134 1 1 1 1 52 VAL H . 34 . HN 1 1 134 1 2 1 1 54 GLY H . 36 . HN 1 1 135 1 1 1 1 52 VAL HA . 34 . HA 1 1 135 1 2 1 1 53 SER H . 35 . HN 1 1 136 1 1 1 1 52 VAL HA . 34 . HA 1 1 136 1 2 1 1 54 GLY H . 36 . HN 1 1 137 1 1 1 1 52 VAL HA . 34 . HA 1 1 137 1 2 1 1 55 VAL H . 37 . HN 1 1 138 1 1 1 1 52 VAL HA . 34 . HA 1 1 138 1 2 1 1 56 ALA H . 38 . HN 1 1 139 1 1 1 1 53 SER H . 35 . HN 1 1 139 1 2 1 1 53 SER HA . 35 . HA 1 1 140 1 1 1 1 53 SER H . 35 . HN 1 1 140 1 2 1 1 54 GLY H . 36 . HN 1 1 141 1 1 1 1 53 SER H . 35 . HN 1 1 141 1 2 1 1 57 SER HA . 39 . HA 1 1 142 1 1 1 1 53 SER HA . 35 . HA 1 1 142 1 2 1 1 54 GLY H . 36 . HN 1 1 143 1 1 1 1 53 SER HA . 35 . HA 1 1 143 1 2 1 1 56 ALA H . 38 . HN 1 1 144 1 1 1 1 53 SER HA . 35 . HA 1 1 144 1 2 1 1 57 SER H . 39 . HN 1 1 145 1 1 1 1 55 VAL H . 37 . HN 1 1 145 1 2 1 1 56 ALA H . 38 . HN 1 1 146 1 1 1 1 55 VAL H . 37 . HN 1 1 146 1 2 1 1 56 ALA HA . 38 . HA 1 1 147 1 1 1 1 56 ALA H . 38 . HN 1 1 147 1 2 1 1 56 ALA HA . 38 . HA 1 1 148 1 1 1 1 56 ALA H . 38 . HN 1 1 148 1 2 1 1 57 SER H . 39 . HN 1 1 149 1 1 1 1 56 ALA H . 38 . HN 1 1 149 1 2 1 1 57 SER QB . 39 . HB# 1 1 150 1 1 1 1 56 ALA HA . 38 . HA 1 1 150 1 2 1 1 57 SER H . 39 . HN 1 1 151 1 1 1 1 57 SER H . 39 . HN 1 1 151 1 2 1 1 57 SER HA . 39 . HA 1 1 152 1 1 1 1 57 SER H . 39 . HN 1 1 152 1 2 1 1 57 SER QB . 39 . HB# 1 1 153 1 1 1 1 57 SER HA . 39 . HA 1 1 153 1 2 1 1 57 SER QB . 39 . HB# 1 1 154 1 1 1 1 57 SER HA . 39 . HA 1 1 154 1 2 1 1 58 GLY H . 40 . HN 1 1 155 1 1 1 1 58 GLY H . 40 . HN 1 1 155 1 2 1 1 59 ALA H . 41 . HN 1 1 156 1 1 1 1 60 GLY H . 42 . HN 1 1 156 1 2 1 1 61 SER H . 43 . HN 1 1 157 1 1 1 1 61 SER H . 43 . HN 1 1 157 1 2 1 1 62 ILE H . 44 . HN 1 1 158 1 1 1 1 61 SER H . 43 . HN 1 1 158 1 2 1 1 63 GLY H . 45 . HN 1 1 159 1 1 1 1 62 ILE H . 44 . HN 1 1 159 1 2 1 1 63 GLY H . 45 . HN 1 1 160 1 1 1 1 62 ILE HA . 44 . HA 1 1 160 1 2 1 1 63 GLY H . 45 . HN 1 1 161 1 1 1 1 63 GLY H . 45 . HN 1 1 161 1 2 1 1 64 ARG H . 46 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.4 1.8 3.4 1 1 2 1 . . . . . 2.8 1.8 2.8 1 1 3 1 . . . . . 3.4 1.8 3.4 1 1 4 1 . . . . . 5.0 1.8 5.0 1 1 5 1 . . . . . 2.8 1.8 2.8 1 1 6 1 . . . . . 5.0 1.8 5.0 1 1 7 1 . . . . . 3.4 1.8 3.4 1 1 8 1 . . . . . 3.4 1.8 3.4 1 1 9 1 . . . . . 3.4 1.8 3.4 1 1 10 1 . . . . . 5.0 1.8 5.0 1 1 11 1 . . . . . 2.8 1.8 2.8 1 1 12 1 . . . . . 2.8 1.8 2.8 1 1 13 1 . . . . . 5.0 1.8 5.0 1 1 14 1 . . . . . 3.4 1.8 3.4 1 1 15 1 . . . . . 5.0 1.8 5.0 1 1 16 1 . . . . . 3.4 1.8 3.4 1 1 17 1 . . . . . 5.0 1.8 5.0 1 1 18 1 . . . . . 3.4 1.8 3.4 1 1 19 1 . . . . . 5.0 1.8 5.0 1 1 20 1 . . . . . 5.0 1.8 5.0 1 1 21 1 . . . . . 5.0 1.8 5.0 1 1 22 1 . . . . . 5.0 1.8 5.0 1 1 23 1 . . . . . 5.0 1.8 5.0 1 1 24 1 . . . . . 2.8 1.8 2.8 1 1 25 1 . . . . . 3.4 1.8 3.4 1 1 26 1 . . . . . 3.4 1.8 3.4 1 1 27 1 . . . . . 2.8 1.8 2.8 1 1 28 1 . . . . . 3.4 1.8 3.4 1 1 29 1 . . . . . 2.8 1.8 2.8 1 1 30 1 . . . . . 3.4 1.8 3.4 1 1 31 1 . . . . . 3.4 1.8 3.4 1 1 32 1 . . . . . 2.8 1.8 2.8 1 1 33 1 . . . . . 5.0 1.8 5.0 1 1 34 1 . . . . . 2.8 1.8 2.8 1 1 35 1 . . . . . 5.0 1.8 5.0 1 1 36 1 . . . . . 2.8 1.8 2.8 1 1 37 1 . . . . . 3.4 1.8 3.4 1 1 38 1 . . . . . 3.4 1.8 3.4 1 1 39 1 . . . . . 3.4 1.8 3.4 1 1 40 1 . . . . . 5.0 1.8 5.0 1 1 41 1 . . . . . 5.0 1.8 5.0 1 1 42 1 . . . . . 2.8 1.8 2.8 1 1 43 1 . . . . . 2.8 1.8 2.8 1 1 44 1 . . . . . 5.0 1.8 5.0 1 1 45 1 . . . . . 5.0 1.8 5.0 1 1 46 1 . . . . . 2.8 1.8 2.8 1 1 47 1 . . . . . 3.4 1.8 3.4 1 1 48 1 . . . . . 5.0 1.8 5.0 1 1 49 1 . . . . . 2.8 1.8 2.8 1 1 50 1 . . . . . 5.0 1.8 5.0 1 1 51 1 . . . . . 2.8 1.8 2.8 1 1 52 1 . . . . . 3.4 1.8 3.4 1 1 53 1 . . . . . 2.8 1.8 2.8 1 1 54 1 . . . . . 5.0 1.8 5.0 1 1 55 1 . . . . . 5.0 1.8 5.0 1 1 56 1 . . . . . 5.0 1.8 5.0 1 1 57 1 . . . . . 3.4 1.8 3.4 1 1 58 1 . . . . . 5.0 1.8 5.0 1 1 59 1 . . . . . 2.8 1.8 2.8 1 1 60 1 . . . . . 3.4 1.8 3.4 1 1 61 1 . . . . . 5.0 1.8 5.0 1 1 62 1 . . . . . 5.0 1.8 5.0 1 1 63 1 . . . . . 2.8 1.8 2.8 1 1 64 1 . . . . . 5.0 1.8 5.0 1 1 65 1 . . . . . 5.0 1.8 5.0 1 1 66 1 . . . . . 5.0 1.8 5.0 1 1 67 1 . . . . . 2.8 1.8 2.8 1 1 68 1 . . . . . 2.8 1.8 2.8 1 1 69 1 . . . . . 5.0 1.8 5.0 1 1 70 1 . . . . . 5.0 1.8 5.0 1 1 71 1 . . . . . 3.4 1.8 3.4 1 1 72 1 . . . . . 3.4 1.8 3.4 1 1 73 1 . . . . . 2.8 1.8 2.8 1 1 74 1 . . . . . 3.4 1.8 3.4 1 1 75 1 . . . . . 2.8 1.8 2.8 1 1 76 1 . . . . . 5.0 1.8 5.0 1 1 77 1 . . . . . 5.0 1.8 5.0 1 1 78 1 . . . . . 5.0 1.8 5.0 1 1 79 1 . . . . . 2.8 1.8 2.8 1 1 80 1 . . . . . 2.8 1.8 2.8 1 1 81 1 . . . . . 3.4 1.8 3.4 1 1 82 1 . . . . . 3.4 1.8 3.4 1 1 83 1 . . . . . 5.0 1.8 5.0 1 1 84 1 . . . . . 2.8 1.8 2.8 1 1 85 1 . . . . . 3.4 1.8 3.4 1 1 86 1 . . . . . 5.0 1.8 5.0 1 1 87 1 . . . . . 5.0 1.8 5.0 1 1 88 1 . . . . . 3.4 1.8 3.4 1 1 89 1 . . . . . 5.0 1.8 5.0 1 1 90 1 . . . . . 2.8 1.8 2.8 1 1 91 1 . . . . . 2.8 1.8 2.8 1 1 92 1 . . . . . 5.0 1.8 5.0 1 1 93 1 . . . . . 3.4 1.8 3.4 1 1 94 1 . . . . . 5.0 1.8 5.0 1 1 95 1 . . . . . 2.8 1.8 2.8 1 1 96 1 . . . . . 3.4 1.8 3.4 1 1 97 1 . . . . . 3.4 1.8 3.4 1 1 98 1 . . . . . 3.4 1.8 3.4 1 1 99 1 . . . . . 5.0 1.8 5.0 1 1 100 1 . . . . . 2.8 1.8 2.8 1 1 101 1 . . . . . 2.8 1.8 2.8 1 1 102 1 . . . . . 3.4 1.8 3.4 1 1 103 1 . . . . . 2.8 1.8 2.8 1 1 104 1 . . . . . 5.0 1.8 5.0 1 1 105 1 . . . . . 5.0 1.8 5.0 1 1 106 1 . . . . . 3.4 1.8 3.4 1 1 107 1 . . . . . 5.0 1.8 5.0 1 1 108 1 . . . . . 5.0 1.8 5.0 1 1 109 1 . . . . . 2.8 1.8 2.8 1 1 110 1 . . . . . 5.0 1.8 5.0 1 1 111 1 . . . . . 3.4 1.8 3.4 1 1 112 1 . . . . . 3.4 1.8 3.4 1 1 113 1 . . . . . 2.8 1.8 2.8 1 1 114 1 . . . . . 5.0 1.8 5.0 1 1 115 1 . . . . . 5.0 1.8 5.0 1 1 116 1 . . . . . 5.0 1.8 5.0 1 1 117 1 . . . . . 2.8 1.8 2.8 1 1 118 1 . . . . . 2.8 1.8 2.8 1 1 119 1 . . . . . 2.8 1.8 2.8 1 1 120 1 . . . . . 5.0 1.8 5.0 1 1 121 1 . . . . . 5.0 1.8 5.0 1 1 122 1 . . . . . 2.8 1.8 2.8 1 1 123 1 . . . . . 5.0 1.8 5.0 1 1 124 1 . . . . . 5.0 1.8 5.0 1 1 125 1 . . . . . 3.4 1.8 3.4 1 1 126 1 . . . . . 2.8 1.8 2.8 1 1 127 1 . . . . . 2.8 1.8 2.8 1 1 128 1 . . . . . 3.4 1.8 3.4 1 1 129 1 . . . . . 5.0 1.8 5.0 1 1 130 1 . . . . . 5.0 1.8 5.0 1 1 131 1 . . . . . 3.4 1.8 3.4 1 1 132 1 . . . . . 2.8 1.8 2.8 1 1 133 1 . . . . . 3.4 1.8 3.4 1 1 134 1 . . . . . 5.0 1.8 5.0 1 1 135 1 . . . . . 5.0 1.8 5.0 1 1 136 1 . . . . . 5.0 1.8 5.0 1 1 137 1 . . . . . 5.0 1.8 5.0 1 1 138 1 . . . . . 5.0 1.8 5.0 1 1 139 1 . . . . . 2.8 1.8 2.8 1 1 140 1 . . . . . 3.4 1.8 3.4 1 1 141 1 . . . . . 5.0 1.8 5.0 1 1 142 1 . . . . . 3.4 1.8 3.4 1 1 143 1 . . . . . 3.4 1.8 3.4 1 1 144 1 . . . . . 5.0 1.8 5.0 1 1 145 1 . . . . . 3.4 1.8 3.4 1 1 146 1 . . . . . 5.0 1.8 5.0 1 1 147 1 . . . . . 2.8 1.8 2.8 1 1 148 1 . . . . . 2.8 1.8 2.8 1 1 149 1 . . . . . 5.0 1.8 5.0 1 1 150 1 . . . . . 5.0 1.8 5.0 1 1 151 1 . . . . . 2.8 1.8 2.8 1 1 152 1 . . . . . 2.8 1.8 2.8 1 1 153 1 . . . . . 2.8 1.8 2.8 1 1 154 1 . . . . . 5.0 1.8 5.0 1 1 155 1 . . . . . 2.8 1.8 2.8 1 1 156 1 . . . . . 3.4 1.8 3.4 1 1 157 1 . . . . . 3.4 1.8 3.4 1 1 158 1 . . . . . 5.0 1.8 5.0 1 1 159 1 . . . . . 3.4 1.8 3.4 1 1 160 1 . . . . . 2.8 1.8 2.8 1 1 161 1 . . . . . 5.0 1.8 5.0 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 20 ASN C C -8.533 8.836 0.025 1.00 . A A . 1 VAL C 1 1 1 2 1 1 20 ASN CA C -8.924 7.797 1.071 1.00 . A A . 1 VAL CA 1 1 1 3 1 1 20 ASN CB C -7.837 7.749 2.161 1.00 . A A . 1 VAL CB 1 1 1 4 1 1 20 ASN H H -8.357 6.017 0.076 1.00 . A A . 1 VAL H 1 1 1 5 1 1 20 ASN HA H -9.854 8.097 1.532 1.00 . A A . 1 VAL HA 1 1 1 6 1 1 20 ASN N N -9.125 6.488 0.462 1.00 . A A . 1 VAL N 1 1 1 7 1 1 20 ASN O O -8.122 8.492 -1.083 1.00 . A A . 1 VAL O 1 1 1 8 1 1 21 TYR C C -7.624 12.328 0.229 1.00 . A A . 2 ASN C 1 1 1 9 1 1 21 TYR CA C -8.324 11.199 -0.520 1.00 . A A . 2 ASN CA 1 1 1 10 1 1 21 TYR CB C -9.584 11.729 -1.207 1.00 . A A . 2 ASN CB 1 1 1 11 1 1 21 TYR CG C -9.319 12.184 -2.629 1.00 . A A . 2 ASN CG 1 1 1 12 1 1 21 TYR H H -8.996 10.318 1.284 1.00 . A A . 2 ASN H 1 1 1 13 1 1 21 TYR HA H -7.652 10.810 -1.270 1.00 . A A . 2 ASN HA 1 1 1 14 1 1 21 TYR HB2 H -10.329 10.948 -1.232 1.00 . A A . 2 ASN HB2 1 1 1 15 1 1 21 TYR HB3 H -9.967 12.568 -0.645 1.00 . A A . 2 ASN HB3 1 1 1 16 1 1 21 TYR N N -8.664 10.108 0.386 1.00 . A A . 2 ASN N 1 1 1 17 1 1 21 TYR O O -8.234 13.350 0.543 1.00 . A A . 2 ASN O 1 1 1 18 1 1 22 GLY C C -6.106 13.354 2.635 1.00 . A A . 3 TYR C 1 1 1 19 1 1 22 GLY CA C -5.555 13.136 1.227 1.00 . A A . 3 TYR CA 1 1 1 20 1 1 22 GLY H H -5.910 11.299 0.237 1.00 . A A . 3 TYR H 1 1 1 21 1 1 22 GLY N N -6.340 12.135 0.513 1.00 . A A . 3 TYR N 1 1 1 22 1 1 22 GLY O O -6.644 14.416 2.948 1.00 . A A . 3 TYR O 1 1 1 23 1 1 23 ASN C C -5.400 12.940 5.805 1.00 . A A . 4 GLY C 1 1 1 24 1 1 23 ASN CA C -6.457 12.434 4.843 1.00 . A A . 4 GLY CA 1 1 1 25 1 1 23 ASN H H -5.533 11.514 3.175 1.00 . A A . 4 GLY H 1 1 1 26 1 1 23 ASN N N -5.969 12.337 3.480 1.00 . A A . 4 GLY N 1 1 1 27 1 1 23 ASN O O -5.124 12.306 6.823 1.00 . A A . 4 GLY O 1 1 1 28 1 1 24 GLY C C -4.374 15.659 7.326 1.00 . A A . 5 ASN C 1 1 1 29 1 1 24 GLY CA C -3.774 14.675 6.324 1.00 . A A . 5 ASN CA 1 1 1 30 1 1 24 GLY H H -5.071 14.542 4.656 1.00 . A A . 5 ASN H 1 1 1 31 1 1 24 GLY N N -4.807 14.084 5.481 1.00 . A A . 5 ASN N 1 1 1 32 1 1 24 GLY O O -3.741 16.003 8.325 1.00 . A A . 5 ASN O 1 1 1 33 1 1 25 VAL C C -7.168 16.365 8.940 1.00 . A A . 6 GLY C 1 1 1 34 1 1 25 VAL CA C -6.253 17.049 7.943 1.00 . A A . 6 GLY CA 1 1 1 35 1 1 25 VAL H H -6.051 15.802 6.245 1.00 . A A . 6 GLY H 1 1 1 36 1 1 25 VAL N N -5.595 16.109 7.054 1.00 . A A . 6 GLY N 1 1 1 37 1 1 25 VAL O O -8.351 16.693 9.033 1.00 . A A . 6 GLY O 1 1 1 38 1 1 26 SER C C -7.461 15.453 11.997 1.00 . A A . 7 VAL C 1 1 1 39 1 1 26 SER CA C -7.396 14.681 10.683 1.00 . A A . 7 VAL CA 1 1 1 40 1 1 26 SER CB C -6.800 13.284 10.950 1.00 . A A . 7 VAL CB 1 1 1 41 1 1 26 SER H H -5.672 15.196 9.567 1.00 . A A . 7 VAL H 1 1 1 42 1 1 26 SER HA H -8.398 14.555 10.300 1.00 . A A . 7 VAL HA 1 1 1 43 1 1 26 SER N N -6.620 15.412 9.687 1.00 . A A . 7 VAL N 1 1 1 44 1 1 26 SER O O -6.664 16.360 12.235 1.00 . A A . 7 VAL O 1 1 1 45 1 1 27 CYS C C -8.760 14.734 15.259 1.00 . A A . 8 SER C 1 1 1 46 1 1 27 CYS CA C -8.584 15.752 14.136 1.00 . A A . 8 SER CA 1 1 1 47 1 1 27 CYS CB C -9.788 16.695 14.095 1.00 . A A . 8 SER CB 1 1 1 48 1 1 27 CYS H H -9.024 14.361 12.603 1.00 . A A . 8 SER H 1 1 1 49 1 1 27 CYS HA H -7.693 16.331 14.329 1.00 . A A . 8 SER HA 1 1 1 50 1 1 27 CYS HB2 H -10.650 16.159 13.726 1.00 . A A . 8 SER HB2 1 1 1 51 1 1 27 CYS HB3 H -9.990 17.061 15.091 1.00 . A A . 8 SER HB3 1 1 1 52 1 1 27 CYS N N -8.417 15.089 12.848 1.00 . A A . 8 SER N 1 1 1 53 1 1 27 CYS O O -8.776 13.526 15.020 1.00 . A A . 8 SER O 1 1 1 54 1 1 28 SER C C -10.511 13.880 17.747 1.00 . A A . 9 CYS C 1 1 1 55 1 1 28 SER CA C -9.069 14.369 17.649 1.00 . A A . 9 CYS CA 1 1 1 56 1 1 28 SER CB C -8.690 15.106 18.942 1.00 . A A . 9 CYS CB 1 1 1 57 1 1 28 SER H H -8.872 16.203 16.608 1.00 . A A . 9 CYS H 1 1 1 58 1 1 28 SER HA H -8.418 13.515 17.528 1.00 . A A . 9 CYS HA 1 1 1 59 1 1 28 SER HB2 H -9.567 15.599 19.333 1.00 . A A . 9 CYS HB2 1 1 1 60 1 1 28 SER HB3 H -8.341 14.384 19.666 1.00 . A A . 9 CYS HB3 1 1 1 61 1 1 28 SER N N -8.893 15.232 16.484 1.00 . A A . 9 CYS N 1 1 1 62 1 1 28 SER O O -11.435 14.675 17.917 1.00 . A A . 9 CYS O 1 1 1 63 1 1 29 LYS C C -11.947 10.490 18.050 1.00 . A A . 10 SER C 1 1 1 64 1 1 29 LYS CA C -12.030 11.977 17.728 1.00 . A A . 10 SER CA 1 1 1 65 1 1 29 LYS CB C -12.792 12.182 16.421 1.00 . A A . 10 SER CB 1 1 1 66 1 1 29 LYS H H -9.922 11.983 17.513 1.00 . A A . 10 SER H 1 1 1 67 1 1 29 LYS HA H -12.561 12.475 18.525 1.00 . A A . 10 SER HA 1 1 1 68 1 1 29 LYS HB2 H -13.613 11.482 16.376 1.00 . A A . 10 SER HB2 1 1 1 69 1 1 29 LYS HB3 H -13.176 13.190 16.385 1.00 . A A . 10 SER HB3 1 1 1 70 1 1 29 LYS N N -10.698 12.568 17.644 1.00 . A A . 10 SER N 1 1 1 71 1 1 29 LYS O O -11.504 9.689 17.227 1.00 . A A . 10 SER O 1 1 1 72 1 1 30 THR C C -10.959 8.179 19.840 1.00 . A A . 11 LYS C 1 1 1 73 1 1 30 THR CA C -12.375 8.741 19.700 1.00 . A A . 11 LYS CA 1 1 1 74 1 1 30 THR CB C -13.187 7.891 18.732 1.00 . A A . 11 LYS CB 1 1 1 75 1 1 30 THR H H -12.735 10.814 19.849 1.00 . A A . 11 LYS H 1 1 1 76 1 1 30 THR HA H -12.847 8.707 20.665 1.00 . A A . 11 LYS HA 1 1 1 77 1 1 30 THR N N -12.384 10.130 19.252 1.00 . A A . 11 LYS N 1 1 1 78 1 1 30 THR O O -10.763 7.130 20.455 1.00 . A A . 11 LYS O 1 1 1 79 1 1 31 LYS C C -7.652 9.625 19.266 1.00 . A A . 12 THR C 1 1 1 80 1 1 31 LYS CA C -8.598 8.428 19.343 1.00 . A A . 12 THR CA 1 1 1 81 1 1 31 LYS CB C -8.329 7.421 18.220 1.00 . A A . 12 THR CB 1 1 1 82 1 1 31 LYS H H -10.178 9.692 18.802 1.00 . A A . 12 THR H 1 1 1 83 1 1 31 LYS HA H -8.460 7.940 20.291 1.00 . A A . 12 THR HA 1 1 1 84 1 1 31 LYS N N -9.976 8.869 19.274 1.00 . A A . 12 THR N 1 1 1 85 1 1 31 LYS O O -8.056 10.721 18.878 1.00 . A A . 12 THR O 1 1 1 86 1 1 32 CYS C C -5.347 11.136 18.229 1.00 . A A . 13 LYS C 1 1 1 87 1 1 32 CYS CA C -5.397 10.476 19.604 1.00 . A A . 13 LYS CA 1 1 1 88 1 1 32 CYS CB C -4.017 9.924 19.968 1.00 . A A . 13 LYS CB 1 1 1 89 1 1 32 CYS H H -6.128 8.516 19.936 1.00 . A A . 13 LYS H 1 1 1 90 1 1 32 CYS HA H -5.682 11.218 20.336 1.00 . A A . 13 LYS HA 1 1 1 91 1 1 32 CYS HB2 H -3.286 10.711 19.856 1.00 . A A . 13 LYS HB2 1 1 1 92 1 1 32 CYS HB3 H -4.032 9.603 20.999 1.00 . A A . 13 LYS HB3 1 1 1 93 1 1 32 CYS N N -6.393 9.410 19.636 1.00 . A A . 13 LYS N 1 1 1 94 1 1 32 CYS O O -5.573 10.485 17.209 1.00 . A A . 13 LYS O 1 1 1 95 1 1 33 SER C C -3.509 13.426 16.570 1.00 . A A . 14 CYS C 1 1 1 96 1 1 33 SER CA C -4.963 13.175 16.955 1.00 . A A . 14 CYS CA 1 1 1 97 1 1 33 SER CB C -5.717 14.507 17.051 1.00 . A A . 14 CYS CB 1 1 1 98 1 1 33 SER H H -4.872 12.892 19.054 1.00 . A A . 14 CYS H 1 1 1 99 1 1 33 SER HA H -5.425 12.572 16.187 1.00 . A A . 14 CYS HA 1 1 1 100 1 1 33 SER HB2 H -5.292 15.201 16.343 1.00 . A A . 14 CYS HB2 1 1 1 101 1 1 33 SER HB3 H -6.754 14.340 16.799 1.00 . A A . 14 CYS HB3 1 1 1 102 1 1 33 SER N N -5.046 12.431 18.209 1.00 . A A . 14 CYS N 1 1 1 103 1 1 33 SER O O -3.119 14.555 16.268 1.00 . A A . 14 CYS O 1 1 1 104 1 1 34 VAL C C -0.907 11.380 15.235 1.00 . A A . 15 SER C 1 1 1 105 1 1 34 VAL CA C -1.298 12.465 16.233 1.00 . A A . 15 SER CA 1 1 1 106 1 1 34 VAL CB C -0.431 12.355 17.489 1.00 . A A . 15 SER CB 1 1 1 107 1 1 34 VAL H H -3.079 11.491 16.830 1.00 . A A . 15 SER H 1 1 1 108 1 1 34 VAL HA H -1.136 13.431 15.779 1.00 . A A . 15 SER HA 1 1 1 109 1 1 34 VAL N N -2.710 12.364 16.582 1.00 . A A . 15 SER N 1 1 1 110 1 1 34 VAL O O -1.457 10.279 15.255 1.00 . A A . 15 SER O 1 1 1 111 1 1 35 ASN C C 1.990 10.451 13.518 1.00 . A A . 16 VAL C 1 1 1 112 1 1 35 ASN CA C 0.503 10.750 13.355 1.00 . A A . 16 VAL CA 1 1 1 113 1 1 35 ASN CB C 0.249 11.278 11.930 1.00 . A A . 16 VAL CB 1 1 1 114 1 1 35 ASN H H 0.442 12.593 14.395 1.00 . A A . 16 VAL H 1 1 1 115 1 1 35 ASN HA H -0.054 9.833 13.482 1.00 . A A . 16 VAL HA 1 1 1 116 1 1 35 ASN N N 0.043 11.699 14.362 1.00 . A A . 16 VAL N 1 1 1 117 1 1 35 ASN O O 2.741 11.260 14.063 1.00 . A A . 16 VAL O 1 1 1 118 1 1 36 TRP C C 4.474 8.959 11.755 1.00 . A A . 17 ASN C 1 1 1 119 1 1 36 TRP CA C 3.804 8.875 13.123 1.00 . A A . 17 ASN CA 1 1 1 120 1 1 36 TRP CB C 3.908 7.451 13.672 1.00 . A A . 17 ASN CB 1 1 1 121 1 1 36 TRP CG C 5.253 7.176 14.315 1.00 . A A . 17 ASN CG 1 1 1 122 1 1 36 TRP H H 1.761 8.685 12.611 1.00 . A A . 17 ASN H 1 1 1 123 1 1 36 TRP HA H 4.307 9.551 13.799 1.00 . A A . 17 ASN HA 1 1 1 124 1 1 36 TRP HB2 H 3.138 7.300 14.414 1.00 . A A . 17 ASN HB2 1 1 1 125 1 1 36 TRP HB3 H 3.765 6.749 12.863 1.00 . A A . 17 ASN HB3 1 1 1 126 1 1 36 TRP N N 2.408 9.285 13.037 1.00 . A A . 17 ASN N 1 1 1 127 1 1 36 TRP O O 4.920 7.951 11.205 1.00 . A A . 17 ASN O 1 1 1 128 1 1 37 GLY C C 6.671 10.388 9.969 1.00 . A A . 18 TRP C 1 1 1 129 1 1 37 GLY CA C 5.142 10.394 9.903 1.00 . A A . 18 TRP CA 1 1 1 130 1 1 37 GLY H H 4.158 10.929 11.692 1.00 . A A . 18 TRP H 1 1 1 131 1 1 37 GLY N N 4.535 10.170 11.208 1.00 . A A . 18 TRP N 1 1 1 132 1 1 37 GLY O O 7.337 10.738 8.994 1.00 . A A . 18 TRP O 1 1 1 133 1 1 38 GLN C C 9.188 8.529 11.390 1.00 . A A . 19 GLY C 1 1 1 134 1 1 38 GLN CA C 8.670 9.948 11.257 1.00 . A A . 19 GLY CA 1 1 1 135 1 1 38 GLN H H 6.658 9.721 11.858 1.00 . A A . 19 GLY H 1 1 1 136 1 1 38 GLN N N 7.227 9.990 11.111 1.00 . A A . 19 GLY N 1 1 1 137 1 1 38 GLN O O 9.890 8.026 10.508 1.00 . A A . 19 GLY O 1 1 1 138 1 1 39 ALA C C 8.864 5.610 11.565 1.00 . A A . 20 GLN C 1 1 1 139 1 1 39 ALA CA C 9.262 6.504 12.731 1.00 . A A . 20 GLN CA 1 1 1 140 1 1 39 ALA CB C 8.660 5.975 14.036 1.00 . A A . 20 GLN CB 1 1 1 141 1 1 39 ALA H H 8.269 8.324 13.155 1.00 . A A . 20 GLN H 1 1 1 142 1 1 39 ALA HA H 10.340 6.502 12.812 1.00 . A A . 20 GLN HA 1 1 1 143 1 1 39 ALA HB2 H 8.026 6.738 14.462 1.00 . A A . 20 GLN HB2 1 1 1 144 1 1 39 ALA HB3 H 8.061 5.103 13.818 1.00 . A A . 20 GLN HB3 1 1 1 145 1 1 39 ALA N N 8.834 7.876 12.492 1.00 . A A . 20 GLN N 1 1 1 146 1 1 39 ALA O O 9.726 5.087 10.858 1.00 . A A . 20 GLN O 1 1 1 147 1 1 40 PHE C C 7.463 5.194 8.900 1.00 . A A . 21 ALA C 1 1 1 148 1 1 40 PHE CA C 7.094 4.609 10.249 1.00 . A A . 21 ALA CA 1 1 1 149 1 1 40 PHE CB C 5.609 4.322 10.338 1.00 . A A . 21 ALA CB 1 1 1 150 1 1 40 PHE H H 6.908 5.883 11.934 1.00 . A A . 21 ALA H 1 1 1 151 1 1 40 PHE HA H 7.616 3.692 10.337 1.00 . A A . 21 ALA HA 1 1 1 152 1 1 40 PHE HB2 H 5.063 5.068 9.781 1.00 . A A . 21 ALA HB2 1 1 1 153 1 1 40 PHE HB3 H 5.299 4.341 11.372 1.00 . A A . 21 ALA HB3 1 1 1 154 1 1 40 PHE N N 7.559 5.439 11.352 1.00 . A A . 21 ALA N 1 1 1 155 1 1 40 PHE O O 7.242 4.583 7.855 1.00 . A A . 21 ALA O 1 1 1 156 1 1 41 GLN C C 9.738 6.238 7.242 1.00 . A A . 22 PHE C 1 1 1 157 1 1 41 GLN CA C 8.536 7.013 7.738 1.00 . A A . 22 PHE CA 1 1 1 158 1 1 41 GLN CB C 8.913 8.468 8.018 1.00 . A A . 22 PHE CB 1 1 1 159 1 1 41 GLN CG C 8.650 9.389 6.860 1.00 . A A . 22 PHE CG 1 1 1 160 1 1 41 GLN H H 8.243 6.748 9.804 1.00 . A A . 22 PHE H 1 1 1 161 1 1 41 GLN HA H 7.750 6.971 7.003 1.00 . A A . 22 PHE HA 1 1 1 162 1 1 41 GLN HB2 H 8.343 8.823 8.862 1.00 . A A . 22 PHE HB2 1 1 1 163 1 1 41 GLN HB3 H 9.966 8.521 8.254 1.00 . A A . 22 PHE HB3 1 1 1 164 1 1 41 GLN N N 8.070 6.354 8.942 1.00 . A A . 22 PHE N 1 1 1 165 1 1 41 GLN O O 9.894 5.981 6.049 1.00 . A A . 22 PHE O 1 1 1 166 1 1 42 GLU C C 11.298 3.586 7.624 1.00 . A A . 23 GLN C 1 1 1 167 1 1 42 GLU CA C 11.731 5.022 7.924 1.00 . A A . 23 GLN CA 1 1 1 168 1 1 42 GLU CB C 12.685 5.051 9.123 1.00 . A A . 23 GLN CB 1 1 1 169 1 1 42 GLU CD C 14.721 6.116 10.172 1.00 . A A . 23 GLN CD 1 1 1 170 1 1 42 GLU CG C 13.903 5.935 8.909 1.00 . A A . 23 GLN CG 1 1 1 171 1 1 42 GLU H H 10.344 6.044 9.137 1.00 . A A . 23 GLN H 1 1 1 172 1 1 42 GLU HA H 12.228 5.434 7.058 1.00 . A A . 23 GLN HA 1 1 1 173 1 1 42 GLU HB2 H 12.146 5.420 9.988 1.00 . A A . 23 GLN HB2 1 1 1 174 1 1 42 GLU HB3 H 13.026 4.046 9.324 1.00 . A A . 23 GLN HB3 1 1 1 175 1 1 42 GLU HG2 H 14.530 5.485 8.154 1.00 . A A . 23 GLN HG2 1 1 1 176 1 1 42 GLU HG3 H 13.573 6.905 8.569 1.00 . A A . 23 GLN HG3 1 1 1 177 1 1 42 GLU N N 10.558 5.826 8.203 1.00 . A A . 23 GLN N 1 1 1 178 1 1 42 GLU O O 12.019 2.828 6.975 1.00 . A A . 23 GLN O 1 1 1 179 1 1 42 GLU OE1 O 15.121 5.143 10.812 1.00 . A A . 23 GLN OE1 1 1 1 180 1 1 43 ARG C C 9.258 1.667 6.408 1.00 . A A . 24 GLU C 1 1 1 181 1 1 43 ARG CA C 9.546 1.899 7.886 1.00 . A A . 24 GLU CA 1 1 1 182 1 1 43 ARG CB C 8.262 1.717 8.698 1.00 . A A . 24 GLU CB 1 1 1 183 1 1 43 ARG CD C 7.304 0.550 10.724 1.00 . A A . 24 GLU CD 1 1 1 184 1 1 43 ARG CG C 8.506 1.253 10.125 1.00 . A A . 24 GLU CG 1 1 1 185 1 1 43 ARG H H 9.574 3.883 8.603 1.00 . A A . 24 GLU H 1 1 1 186 1 1 43 ARG HA H 10.271 1.182 8.221 1.00 . A A . 24 GLU HA 1 1 1 187 1 1 43 ARG HB2 H 7.734 2.656 8.732 1.00 . A A . 24 GLU HB2 1 1 1 188 1 1 43 ARG HB3 H 7.640 0.983 8.207 1.00 . A A . 24 GLU HB3 1 1 1 189 1 1 43 ARG HG2 H 9.342 0.570 10.130 1.00 . A A . 24 GLU HG2 1 1 1 190 1 1 43 ARG HG3 H 8.743 2.114 10.734 1.00 . A A . 24 GLU HG3 1 1 1 191 1 1 43 ARG N N 10.100 3.229 8.100 1.00 . A A . 24 GLU N 1 1 1 192 1 1 43 ARG O O 9.706 0.681 5.822 1.00 . A A . 24 GLU O 1 1 1 193 1 1 44 TYR C C 9.395 2.535 3.521 1.00 . A A . 25 ARG C 1 1 1 194 1 1 44 TYR CA C 8.152 2.493 4.400 1.00 . A A . 25 ARG CA 1 1 1 195 1 1 44 TYR CB C 7.201 3.628 4.016 1.00 . A A . 25 ARG CB 1 1 1 196 1 1 44 TYR CG C 5.736 3.306 4.262 1.00 . A A . 25 ARG CG 1 1 1 197 1 1 44 TYR CZ C 2.593 3.229 3.588 1.00 . A A . 25 ARG CZ 1 1 1 198 1 1 44 TYR H H 8.181 3.349 6.334 1.00 . A A . 25 ARG H 1 1 1 199 1 1 44 TYR HA H 7.654 1.551 4.248 1.00 . A A . 25 ARG HA 1 1 1 200 1 1 44 TYR HB2 H 7.456 4.506 4.592 1.00 . A A . 25 ARG HB2 1 1 1 201 1 1 44 TYR HB3 H 7.328 3.849 2.966 1.00 . A A . 25 ARG HB3 1 1 1 202 1 1 44 TYR HD2 H 4.455 5.006 4.253 1.00 . A A . 25 ARG HD2 1 1 1 203 1 1 44 TYR N N 8.506 2.587 5.811 1.00 . A A . 25 ARG N 1 1 1 204 1 1 44 TYR O O 9.415 1.972 2.426 1.00 . A A . 25 ARG O 1 1 1 205 1 1 45 THR C C 12.369 1.967 3.159 1.00 . A A . 26 TYR C 1 1 1 206 1 1 45 THR CA C 11.680 3.322 3.274 1.00 . A A . 26 TYR CA 1 1 1 207 1 1 45 THR CB C 12.608 4.328 3.958 1.00 . A A . 26 TYR CB 1 1 1 208 1 1 45 THR H H 10.348 3.627 4.886 1.00 . A A . 26 TYR H 1 1 1 209 1 1 45 THR HA H 11.446 3.679 2.283 1.00 . A A . 26 TYR HA 1 1 1 210 1 1 45 THR N N 10.429 3.204 4.010 1.00 . A A . 26 TYR N 1 1 1 211 1 1 45 THR O O 13.000 1.663 2.147 1.00 . A A . 26 TYR O 1 1 1 212 1 1 46 ALA C C 12.020 -1.156 3.404 1.00 . A A . 27 THR C 1 1 1 213 1 1 46 ALA CA C 12.850 -0.170 4.220 1.00 . A A . 27 THR CA 1 1 1 214 1 1 46 ALA CB C 12.991 -0.670 5.659 1.00 . A A . 27 THR CB 1 1 1 215 1 1 46 ALA H H 11.725 1.454 4.981 1.00 . A A . 27 THR H 1 1 1 216 1 1 46 ALA HA H 13.831 -0.090 3.777 1.00 . A A . 27 THR HA 1 1 1 217 1 1 46 ALA N N 12.242 1.155 4.203 1.00 . A A . 27 THR N 1 1 1 218 1 1 46 ALA O O 12.556 -1.904 2.586 1.00 . A A . 27 THR O 1 1 1 219 1 1 47 GLY C C 9.791 -1.722 1.424 1.00 . A A . 28 ALA C 1 1 1 220 1 1 47 GLY CA C 9.808 -2.042 2.915 1.00 . A A . 28 ALA CA 1 1 1 221 1 1 47 GLY H H 10.343 -0.531 4.294 1.00 . A A . 28 ALA H 1 1 1 222 1 1 47 GLY N N 10.711 -1.150 3.630 1.00 . A A . 28 ALA N 1 1 1 223 1 1 47 GLY O O 9.597 -2.607 0.591 1.00 . A A . 28 ALA O 1 1 1 224 1 1 48 ILE C C 11.202 -0.563 -1.054 1.00 . A A . 29 GLY C 1 1 1 225 1 1 48 ILE CA C 10.000 -0.035 -0.295 1.00 . A A . 29 GLY CA 1 1 1 226 1 1 48 ILE H H 10.145 0.211 1.803 1.00 . A A . 29 GLY H 1 1 1 227 1 1 48 ILE N N 9.996 -0.450 1.095 1.00 . A A . 29 GLY N 1 1 1 228 1 1 48 ILE O O 11.054 -1.232 -2.076 1.00 . A A . 29 GLY O 1 1 1 229 1 1 49 ASN C C 13.676 -2.234 -1.275 1.00 . A A . 30 ILE C 1 1 1 230 1 1 49 ASN CA C 13.628 -0.711 -1.189 1.00 . A A . 30 ILE CA 1 1 1 231 1 1 49 ASN CB C 14.870 -0.203 -0.429 1.00 . A A . 30 ILE CB 1 1 1 232 1 1 49 ASN H H 12.449 0.275 0.267 1.00 . A A . 30 ILE H 1 1 1 233 1 1 49 ASN HA H 13.653 -0.304 -2.189 1.00 . A A . 30 ILE HA 1 1 1 234 1 1 49 ASN N N 12.396 -0.262 -0.552 1.00 . A A . 30 ILE N 1 1 1 235 1 1 49 ASN O O 14.215 -2.793 -2.230 1.00 . A A . 30 ILE O 1 1 1 236 1 1 50 SER C C 12.448 -4.914 -1.512 1.00 . A A . 31 ASN C 1 1 1 237 1 1 50 SER CA C 13.084 -4.358 -0.242 1.00 . A A . 31 ASN CA 1 1 1 238 1 1 50 SER CB C 12.318 -4.852 0.986 1.00 . A A . 31 ASN CB 1 1 1 239 1 1 50 SER H H 12.691 -2.399 0.459 1.00 . A A . 31 ASN H 1 1 1 240 1 1 50 SER HA H 14.105 -4.706 -0.184 1.00 . A A . 31 ASN HA 1 1 1 241 1 1 50 SER HB2 H 12.682 -4.335 1.862 1.00 . A A . 31 ASN HB2 1 1 1 242 1 1 50 SER HB3 H 11.267 -4.637 0.857 1.00 . A A . 31 ASN HB3 1 1 1 243 1 1 50 SER N N 13.107 -2.899 -0.274 1.00 . A A . 31 ASN N 1 1 1 244 1 1 50 SER O O 13.059 -5.709 -2.227 1.00 . A A . 31 ASN O 1 1 1 245 1 1 51 PHE C C 11.256 -4.513 -4.239 1.00 . A A . 32 SER C 1 1 1 246 1 1 51 PHE CA C 10.509 -4.934 -2.978 1.00 . A A . 32 SER CA 1 1 1 247 1 1 51 PHE CB C 9.090 -4.364 -2.995 1.00 . A A . 32 SER CB 1 1 1 248 1 1 51 PHE H H 10.789 -3.848 -1.185 1.00 . A A . 32 SER H 1 1 1 249 1 1 51 PHE HA H 10.457 -6.012 -2.946 1.00 . A A . 32 SER HA 1 1 1 250 1 1 51 PHE HB2 H 8.657 -4.450 -2.010 1.00 . A A . 32 SER HB2 1 1 1 251 1 1 51 PHE HB3 H 9.125 -3.324 -3.283 1.00 . A A . 32 SER HB3 1 1 1 252 1 1 51 PHE N N 11.222 -4.485 -1.790 1.00 . A A . 32 SER N 1 1 1 253 1 1 51 PHE O O 11.236 -5.215 -5.250 1.00 . A A . 32 SER O 1 1 1 254 1 1 52 VAL C C 13.846 -3.762 -5.631 1.00 . A A . 33 PHE C 1 1 1 255 1 1 52 VAL CA C 12.675 -2.843 -5.298 1.00 . A A . 33 PHE CA 1 1 1 256 1 1 52 VAL CB C 13.187 -1.434 -4.990 1.00 . A A . 33 PHE CB 1 1 1 257 1 1 52 VAL H H 11.895 -2.850 -3.333 1.00 . A A . 33 PHE H 1 1 1 258 1 1 52 VAL HA H 12.013 -2.799 -6.148 1.00 . A A . 33 PHE HA 1 1 1 259 1 1 52 VAL N N 11.917 -3.362 -4.168 1.00 . A A . 33 PHE N 1 1 1 260 1 1 52 VAL O O 14.133 -4.022 -6.801 1.00 . A A . 33 PHE O 1 1 1 261 1 1 53 SER C C 15.276 -6.349 -5.633 1.00 . A A . 34 VAL C 1 1 1 262 1 1 53 SER CA C 15.656 -5.147 -4.775 1.00 . A A . 34 VAL CA 1 1 1 263 1 1 53 SER CB C 16.213 -5.634 -3.421 1.00 . A A . 34 VAL CB 1 1 1 264 1 1 53 SER H H 14.239 -4.014 -3.685 1.00 . A A . 34 VAL H 1 1 1 265 1 1 53 SER HA H 16.433 -4.593 -5.284 1.00 . A A . 34 VAL HA 1 1 1 266 1 1 53 SER N N 14.517 -4.255 -4.594 1.00 . A A . 34 VAL N 1 1 1 267 1 1 53 SER O O 15.660 -6.428 -6.795 1.00 . A A . 34 VAL O 1 1 1 268 1 1 54 GLY C C 13.559 -8.176 -7.126 1.00 . A A . 35 SER C 1 1 1 269 1 1 54 GLY CA C 14.138 -8.487 -5.769 1.00 . A A . 35 SER CA 1 1 1 270 1 1 54 GLY H H 14.285 -7.203 -4.124 1.00 . A A . 35 SER H 1 1 1 271 1 1 54 GLY N N 14.536 -7.292 -5.055 1.00 . A A . 35 SER N 1 1 1 272 1 1 54 GLY O O 14.047 -8.689 -8.133 1.00 . A A . 35 SER O 1 1 1 273 1 1 55 VAL C C 13.066 -6.950 -9.510 1.00 . A A . 36 GLY C 1 1 1 274 1 1 55 VAL CA C 11.976 -6.978 -8.461 1.00 . A A . 36 GLY CA 1 1 1 275 1 1 55 VAL H H 12.209 -6.937 -6.348 1.00 . A A . 36 GLY H 1 1 1 276 1 1 55 VAL N N 12.547 -7.330 -7.174 1.00 . A A . 36 GLY N 1 1 1 277 1 1 55 VAL O O 12.918 -7.490 -10.606 1.00 . A A . 36 GLY O 1 1 1 278 1 1 56 ALA C C 16.311 -7.441 -9.736 1.00 . A A . 37 VAL C 1 1 1 279 1 1 56 ALA CA C 15.357 -6.262 -9.966 1.00 . A A . 37 VAL CA 1 1 1 280 1 1 56 ALA CB C 16.118 -4.942 -9.726 1.00 . A A . 37 VAL CB 1 1 1 281 1 1 56 ALA H H 14.243 -5.977 -8.227 1.00 . A A . 37 VAL H 1 1 1 282 1 1 56 ALA HA H 15.024 -6.279 -10.986 1.00 . A A . 37 VAL HA 1 1 1 283 1 1 56 ALA N N 14.189 -6.346 -9.126 1.00 . A A . 37 VAL N 1 1 1 284 1 1 56 ALA O O 16.475 -8.307 -10.595 1.00 . A A . 37 VAL O 1 1 1 285 1 1 57 SER C C 17.365 -9.698 -7.602 1.00 . A A . 38 ALA C 1 1 1 286 1 1 57 SER CA C 17.954 -8.429 -8.200 1.00 . A A . 38 ALA CA 1 1 1 287 1 1 57 SER CB C 18.955 -7.829 -7.219 1.00 . A A . 38 ALA CB 1 1 1 288 1 1 57 SER H H 16.799 -6.697 -7.944 1.00 . A A . 38 ALA H 1 1 1 289 1 1 57 SER HA H 18.488 -8.684 -9.091 1.00 . A A . 38 ALA HA 1 1 1 290 1 1 57 SER HB2 H 19.951 -8.161 -7.473 1.00 . A A . 38 ALA HB2 1 1 1 291 1 1 57 SER HB3 H 18.713 -8.149 -6.209 1.00 . A A . 38 ALA HB3 1 1 1 292 1 1 57 SER N N 16.971 -7.423 -8.572 1.00 . A A . 38 ALA N 1 1 1 293 1 1 57 SER O O 17.353 -10.762 -8.222 1.00 . A A . 38 ALA O 1 1 1 294 1 1 58 GLY C C 15.132 -11.282 -6.120 1.00 . A A . 39 SER C 1 1 1 295 1 1 58 GLY CA C 16.416 -10.663 -5.558 1.00 . A A . 39 SER CA 1 1 1 296 1 1 58 GLY H H 17.034 -8.687 -5.925 1.00 . A A . 39 SER H 1 1 1 297 1 1 58 GLY N N 16.945 -9.565 -6.352 1.00 . A A . 39 SER N 1 1 1 298 1 1 58 GLY O O 14.536 -12.153 -5.486 1.00 . A A . 39 SER O 1 1 1 299 1 1 59 ALA C C 13.739 -12.016 -9.242 1.00 . A A . 40 GLY C 1 1 1 300 1 1 59 ALA CA C 13.491 -11.374 -7.892 1.00 . A A . 40 GLY CA 1 1 1 301 1 1 59 ALA H H 15.202 -10.139 -7.767 1.00 . A A . 40 GLY H 1 1 1 302 1 1 59 ALA N N 14.702 -10.838 -7.298 1.00 . A A . 40 GLY N 1 1 1 303 1 1 59 ALA O O 13.328 -13.152 -9.481 1.00 . A A . 40 GLY O 1 1 1 304 1 1 60 GLY C C 13.440 -12.265 -12.172 1.00 . A A . 41 ALA C 1 1 1 305 1 1 60 GLY CA C 14.708 -11.792 -11.466 1.00 . A A . 41 ALA CA 1 1 1 306 1 1 60 GLY H H 14.709 -10.388 -9.881 1.00 . A A . 41 ALA H 1 1 1 307 1 1 60 GLY N N 14.409 -11.288 -10.130 1.00 . A A . 41 ALA N 1 1 1 308 1 1 60 GLY O O 13.448 -13.276 -12.874 1.00 . A A . 41 ALA O 1 1 1 309 1 1 61 SER C C 10.291 -10.678 -13.042 1.00 . A A . 42 GLY C 1 1 1 310 1 1 61 SER CA C 11.091 -11.889 -12.600 1.00 . A A . 42 GLY CA 1 1 1 311 1 1 61 SER H H 12.404 -10.733 -11.406 1.00 . A A . 42 GLY H 1 1 1 312 1 1 61 SER N N 12.351 -11.528 -11.978 1.00 . A A . 42 GLY N 1 1 1 313 1 1 61 SER O O 9.061 -10.702 -13.030 1.00 . A A . 42 GLY O 1 1 1 314 1 1 62 ILE C C 10.340 -8.292 -15.403 1.00 . A A . 43 SER C 1 1 1 315 1 1 62 ILE CA C 10.336 -8.394 -13.880 1.00 . A A . 43 SER CA 1 1 1 316 1 1 62 ILE CB C 11.024 -7.171 -13.271 1.00 . A A . 43 SER CB 1 1 1 317 1 1 62 ILE H H 11.970 -9.660 -13.419 1.00 . A A . 43 SER H 1 1 1 318 1 1 62 ILE HA H 9.314 -8.425 -13.540 1.00 . A A . 43 SER HA 1 1 1 319 1 1 62 ILE N N 10.991 -9.618 -13.432 1.00 . A A . 43 SER N 1 1 1 320 1 1 62 ILE O O 9.518 -7.586 -15.987 1.00 . A A . 43 SER O 1 1 1 321 1 1 63 GLY C C 11.248 -7.597 -18.075 1.00 . A A . 44 ILE C 1 1 1 322 1 1 63 GLY CA C 11.393 -9.004 -17.494 1.00 . A A . 44 ILE CA 1 1 1 323 1 1 63 GLY H H 11.893 -9.544 -15.509 1.00 . A A . 44 ILE H 1 1 1 324 1 1 63 GLY N N 11.271 -9.003 -16.036 1.00 . A A . 44 ILE N 1 1 1 325 1 1 63 GLY O O 10.535 -7.386 -19.056 1.00 . A A . 44 ILE O 1 1 1 326 1 1 64 ARG C C 13.191 -4.781 -18.490 1.00 . A A . 45 GLY C 1 1 1 327 1 1 64 ARG CA C 11.868 -5.265 -17.929 1.00 . A A . 45 GLY CA 1 1 1 328 1 1 64 ARG H H 12.485 -6.864 -16.685 1.00 . A A . 45 GLY H 1 1 1 329 1 1 64 ARG N N 11.932 -6.638 -17.461 1.00 . A A . 45 GLY N 1 1 1 330 1 1 64 ARG O O 13.499 -3.591 -18.426 1.00 . A A . 45 GLY O 1 1 2 331 1 1 20 ASN C C -8.234 8.972 -3.013 1.00 . A A . 1 VAL C 1 1 2 332 1 1 20 ASN CA C -9.369 8.433 -3.880 1.00 . A A . 1 VAL CA 1 1 2 333 1 1 20 ASN CB C -9.465 6.905 -3.697 1.00 . A A . 1 VAL CB 1 1 2 334 1 1 20 ASN H H -8.529 8.287 -5.816 1.00 . A A . 1 VAL H 1 1 2 335 1 1 20 ASN HA H -10.299 8.873 -3.549 1.00 . A A . 1 VAL HA 1 1 2 336 1 1 20 ASN N N -9.175 8.791 -5.279 1.00 . A A . 1 VAL N 1 1 2 337 1 1 20 ASN O O -7.059 8.742 -3.299 1.00 . A A . 1 VAL O 1 1 2 338 1 1 21 TYR C C -8.242 10.635 0.285 1.00 . A A . 2 ASN C 1 1 2 339 1 1 21 TYR CA C -7.604 10.258 -1.046 1.00 . A A . 2 ASN CA 1 1 2 340 1 1 21 TYR CB C -6.947 11.487 -1.679 1.00 . A A . 2 ASN CB 1 1 2 341 1 1 21 TYR CG C -5.747 11.125 -2.532 1.00 . A A . 2 ASN CG 1 1 2 342 1 1 21 TYR H H -9.546 9.836 -1.776 1.00 . A A . 2 ASN H 1 1 2 343 1 1 21 TYR HA H -6.849 9.507 -0.869 1.00 . A A . 2 ASN HA 1 1 2 344 1 1 21 TYR HB2 H -7.670 11.992 -2.303 1.00 . A A . 2 ASN HB2 1 1 2 345 1 1 21 TYR HB3 H -6.622 12.156 -0.897 1.00 . A A . 2 ASN HB3 1 1 2 346 1 1 21 TYR N N -8.593 9.689 -1.954 1.00 . A A . 2 ASN N 1 1 2 347 1 1 21 TYR O O -7.892 11.650 0.889 1.00 . A A . 2 ASN O 1 1 2 348 1 1 22 GLY C C -10.850 8.919 2.294 1.00 . A A . 3 TYR C 1 1 2 349 1 1 22 GLY CA C -9.868 10.047 1.997 1.00 . A A . 3 TYR CA 1 1 2 350 1 1 22 GLY H H -9.407 9.017 0.207 1.00 . A A . 3 TYR H 1 1 2 351 1 1 22 GLY N N -9.177 9.809 0.736 1.00 . A A . 3 TYR N 1 1 2 352 1 1 22 GLY O O -11.957 9.155 2.778 1.00 . A A . 3 TYR O 1 1 2 353 1 1 23 ASN C C -10.510 5.242 2.281 1.00 . A A . 4 GLY C 1 1 2 354 1 1 23 ASN CA C -11.288 6.543 2.235 1.00 . A A . 4 GLY CA 1 1 2 355 1 1 23 ASN H H -9.544 7.567 1.611 1.00 . A A . 4 GLY H 1 1 2 356 1 1 23 ASN N N -10.436 7.692 1.997 1.00 . A A . 4 GLY N 1 1 2 357 1 1 23 ASN O O -10.889 4.262 1.641 1.00 . A A . 4 GLY O 1 1 2 358 1 1 24 GLY C C -8.735 3.408 4.543 1.00 . A A . 5 ASN C 1 1 2 359 1 1 24 GLY CA C -8.584 4.044 3.163 1.00 . A A . 5 ASN CA 1 1 2 360 1 1 24 GLY H H -9.166 6.047 3.523 1.00 . A A . 5 ASN H 1 1 2 361 1 1 24 GLY N N -9.417 5.235 3.038 1.00 . A A . 5 ASN N 1 1 2 362 1 1 24 GLY O O -8.438 2.228 4.728 1.00 . A A . 5 ASN O 1 1 2 363 1 1 25 VAL C C -9.228 4.769 7.907 1.00 . A A . 6 GLY C 1 1 2 364 1 1 25 VAL CA C -9.379 3.688 6.854 1.00 . A A . 6 GLY CA 1 1 2 365 1 1 25 VAL H H -9.419 5.126 5.302 1.00 . A A . 6 GLY H 1 1 2 366 1 1 25 VAL N N -9.198 4.195 5.507 1.00 . A A . 6 GLY N 1 1 2 367 1 1 25 VAL O O -8.394 4.656 8.805 1.00 . A A . 6 GLY O 1 1 2 368 1 1 26 SER C C -10.614 6.528 10.078 1.00 . A A . 7 VAL C 1 1 2 369 1 1 26 SER CA C -9.986 6.924 8.746 1.00 . A A . 7 VAL CA 1 1 2 370 1 1 26 SER CB C -10.709 8.171 8.202 1.00 . A A . 7 VAL CB 1 1 2 371 1 1 26 SER H H -10.678 5.851 7.058 1.00 . A A . 7 VAL H 1 1 2 372 1 1 26 SER HA H -8.949 7.178 8.910 1.00 . A A . 7 VAL HA 1 1 2 373 1 1 26 SER N N -10.035 5.819 7.796 1.00 . A A . 7 VAL N 1 1 2 374 1 1 26 SER O O -11.358 5.551 10.158 1.00 . A A . 7 VAL O 1 1 2 375 1 1 27 CYS C C -10.601 5.583 12.867 1.00 . A A . 8 SER C 1 1 2 376 1 1 27 CYS CA C -10.847 7.030 12.451 1.00 . A A . 8 SER CA 1 1 2 377 1 1 27 CYS CB C -12.342 7.340 12.482 1.00 . A A . 8 SER CB 1 1 2 378 1 1 27 CYS H H -9.716 8.061 10.993 1.00 . A A . 8 SER H 1 1 2 379 1 1 27 CYS HA H -10.341 7.682 13.147 1.00 . A A . 8 SER HA 1 1 2 380 1 1 27 CYS HB2 H -12.546 8.163 11.814 1.00 . A A . 8 SER HB2 1 1 2 381 1 1 27 CYS HB3 H -12.895 6.469 12.159 1.00 . A A . 8 SER HB3 1 1 2 382 1 1 27 CYS N N -10.312 7.295 11.121 1.00 . A A . 8 SER N 1 1 2 383 1 1 27 CYS O O -10.014 4.802 12.117 1.00 . A A . 8 SER O 1 1 2 384 1 1 28 SER C C -11.860 2.914 13.924 1.00 . A A . 9 CYS C 1 1 2 385 1 1 28 SER CA C -10.876 3.879 14.583 1.00 . A A . 9 CYS CA 1 1 2 386 1 1 28 SER CB C -11.069 3.861 16.101 1.00 . A A . 9 CYS CB 1 1 2 387 1 1 28 SER H H -11.508 5.899 14.619 1.00 . A A . 9 CYS H 1 1 2 388 1 1 28 SER HA H -9.868 3.565 14.351 1.00 . A A . 9 CYS HA 1 1 2 389 1 1 28 SER HB2 H -11.494 4.802 16.414 1.00 . A A . 9 CYS HB2 1 1 2 390 1 1 28 SER HB3 H -11.747 3.061 16.362 1.00 . A A . 9 CYS HB3 1 1 2 391 1 1 28 SER N N -11.050 5.232 14.066 1.00 . A A . 9 CYS N 1 1 2 392 1 1 28 SER O O -13.068 3.148 13.925 1.00 . A A . 9 CYS O 1 1 2 393 1 1 29 LYS C C -11.355 -0.439 12.435 1.00 . A A . 10 SER C 1 1 2 394 1 1 29 LYS CA C -12.163 0.818 12.723 1.00 . A A . 10 SER CA 1 1 2 395 1 1 29 LYS CB C -12.757 1.360 11.426 1.00 . A A . 10 SER CB 1 1 2 396 1 1 29 LYS H H -10.363 1.694 13.413 1.00 . A A . 10 SER H 1 1 2 397 1 1 29 LYS HA H -12.967 0.566 13.398 1.00 . A A . 10 SER HA 1 1 2 398 1 1 29 LYS HB2 H -13.081 0.531 10.815 1.00 . A A . 10 SER HB2 1 1 2 399 1 1 29 LYS HB3 H -13.602 1.990 11.656 1.00 . A A . 10 SER HB3 1 1 2 400 1 1 29 LYS N N -11.334 1.826 13.375 1.00 . A A . 10 SER N 1 1 2 401 1 1 29 LYS O O -10.490 -0.450 11.559 1.00 . A A . 10 SER O 1 1 2 402 1 1 30 THR C C -9.464 -2.669 13.338 1.00 . A A . 11 LYS C 1 1 2 403 1 1 30 THR CA C -10.958 -2.772 13.026 1.00 . A A . 11 LYS CA 1 1 2 404 1 1 30 THR CB C -11.169 -3.294 11.610 1.00 . A A . 11 LYS CB 1 1 2 405 1 1 30 THR H H -12.349 -1.418 13.851 1.00 . A A . 11 LYS H 1 1 2 406 1 1 30 THR HA H -11.399 -3.467 13.718 1.00 . A A . 11 LYS HA 1 1 2 407 1 1 30 THR N N -11.647 -1.496 13.183 1.00 . A A . 11 LYS N 1 1 2 408 1 1 30 THR O O -8.768 -3.683 13.403 1.00 . A A . 11 LYS O 1 1 2 409 1 1 31 LYS C C -7.392 0.051 14.639 1.00 . A A . 12 THR C 1 1 2 410 1 1 31 LYS CA C -7.569 -1.232 13.830 1.00 . A A . 12 THR CA 1 1 2 411 1 1 31 LYS CB C -6.769 -1.190 12.523 1.00 . A A . 12 THR CB 1 1 2 412 1 1 31 LYS H H -9.557 -0.679 13.471 1.00 . A A . 12 THR H 1 1 2 413 1 1 31 LYS HA H -7.229 -2.063 14.421 1.00 . A A . 12 THR HA 1 1 2 414 1 1 31 LYS N N -8.970 -1.449 13.528 1.00 . A A . 12 THR N 1 1 2 415 1 1 31 LYS O O -8.295 0.885 14.701 1.00 . A A . 12 THR O 1 1 2 416 1 1 32 CYS C C -6.034 2.656 15.190 1.00 . A A . 13 LYS C 1 1 2 417 1 1 32 CYS CA C -5.938 1.397 16.048 1.00 . A A . 13 LYS CA 1 1 2 418 1 1 32 CYS CB C -4.545 1.295 16.673 1.00 . A A . 13 LYS CB 1 1 2 419 1 1 32 CYS H H -5.538 -0.486 15.164 1.00 . A A . 13 LYS H 1 1 2 420 1 1 32 CYS HA H -6.675 1.455 16.835 1.00 . A A . 13 LYS HA 1 1 2 421 1 1 32 CYS HB2 H -4.310 2.235 17.153 1.00 . A A . 13 LYS HB2 1 1 2 422 1 1 32 CYS HB3 H -4.555 0.515 17.420 1.00 . A A . 13 LYS HB3 1 1 2 423 1 1 32 CYS N N -6.224 0.209 15.252 1.00 . A A . 13 LYS N 1 1 2 424 1 1 32 CYS O O -5.620 2.659 14.030 1.00 . A A . 13 LYS O 1 1 2 425 1 1 33 SER C C -5.584 5.942 15.398 1.00 . A A . 14 CYS C 1 1 2 426 1 1 33 SER CA C -6.721 4.986 15.047 1.00 . A A . 14 CYS CA 1 1 2 427 1 1 33 SER CB C -8.072 5.649 15.347 1.00 . A A . 14 CYS CB 1 1 2 428 1 1 33 SER H H -6.884 3.660 16.694 1.00 . A A . 14 CYS H 1 1 2 429 1 1 33 SER HA H -6.672 4.766 13.991 1.00 . A A . 14 CYS HA 1 1 2 430 1 1 33 SER HB2 H -7.993 6.708 15.156 1.00 . A A . 14 CYS HB2 1 1 2 431 1 1 33 SER HB3 H -8.818 5.229 14.690 1.00 . A A . 14 CYS HB3 1 1 2 432 1 1 33 SER N N -6.577 3.723 15.766 1.00 . A A . 14 CYS N 1 1 2 433 1 1 33 SER O O -5.815 7.098 15.754 1.00 . A A . 14 CYS O 1 1 2 434 1 1 34 VAL C C -2.137 6.140 14.491 1.00 . A A . 15 SER C 1 1 2 435 1 1 34 VAL CA C -3.179 6.256 15.600 1.00 . A A . 15 SER CA 1 1 2 436 1 1 34 VAL CB C -2.571 5.825 16.935 1.00 . A A . 15 SER CB 1 1 2 437 1 1 34 VAL H H -4.233 4.520 15.005 1.00 . A A . 15 SER H 1 1 2 438 1 1 34 VAL HA H -3.494 7.286 15.674 1.00 . A A . 15 SER HA 1 1 2 439 1 1 34 VAL N N -4.354 5.449 15.294 1.00 . A A . 15 SER N 1 1 2 440 1 1 34 VAL O O -1.276 5.261 14.524 1.00 . A A . 15 SER O 1 1 2 441 1 1 35 ASN C C 0.148 7.195 12.866 1.00 . A A . 16 VAL C 1 1 2 442 1 1 35 ASN CA C -1.293 7.035 12.389 1.00 . A A . 16 VAL CA 1 1 2 443 1 1 35 ASN CB C -1.627 8.161 11.391 1.00 . A A . 16 VAL CB 1 1 2 444 1 1 35 ASN H H -2.934 7.708 13.543 1.00 . A A . 16 VAL H 1 1 2 445 1 1 35 ASN HA H -1.389 6.088 11.877 1.00 . A A . 16 VAL HA 1 1 2 446 1 1 35 ASN N N -2.224 7.033 13.511 1.00 . A A . 16 VAL N 1 1 2 447 1 1 35 ASN O O 0.397 7.670 13.974 1.00 . A A . 16 VAL O 1 1 2 448 1 1 36 TRP C C 3.306 7.405 11.150 1.00 . A A . 17 ASN C 1 1 2 449 1 1 36 TRP CA C 2.510 6.899 12.348 1.00 . A A . 17 ASN CA 1 1 2 450 1 1 36 TRP CB C 3.050 5.539 12.796 1.00 . A A . 17 ASN CB 1 1 2 451 1 1 36 TRP CG C 2.899 5.321 14.289 1.00 . A A . 17 ASN CG 1 1 2 452 1 1 36 TRP H H 0.831 6.430 11.150 1.00 . A A . 17 ASN H 1 1 2 453 1 1 36 TRP HA H 2.614 7.604 13.159 1.00 . A A . 17 ASN HA 1 1 2 454 1 1 36 TRP HB2 H 2.513 4.757 12.282 1.00 . A A . 17 ASN HB2 1 1 2 455 1 1 36 TRP HB3 H 4.099 5.474 12.546 1.00 . A A . 17 ASN HB3 1 1 2 456 1 1 36 TRP N N 1.093 6.798 12.019 1.00 . A A . 17 ASN N 1 1 2 457 1 1 36 TRP O O 3.966 6.629 10.457 1.00 . A A . 17 ASN O 1 1 2 458 1 1 37 GLY C C 5.433 9.491 10.079 1.00 . A A . 18 TRP C 1 1 2 459 1 1 37 GLY CA C 3.939 9.322 9.790 1.00 . A A . 18 TRP CA 1 1 2 460 1 1 37 GLY H H 2.687 9.272 11.489 1.00 . A A . 18 TRP H 1 1 2 461 1 1 37 GLY N N 3.234 8.709 10.907 1.00 . A A . 18 TRP N 1 1 2 462 1 1 37 GLY O O 6.163 10.062 9.270 1.00 . A A . 18 TRP O 1 1 2 463 1 1 38 GLN C C 7.962 7.742 11.649 1.00 . A A . 19 GLY C 1 1 2 464 1 1 38 GLN CA C 7.290 9.099 11.579 1.00 . A A . 19 GLY CA 1 1 2 465 1 1 38 GLN H H 5.267 8.544 11.838 1.00 . A A . 19 GLY H 1 1 2 466 1 1 38 GLN N N 5.885 8.991 11.226 1.00 . A A . 19 GLY N 1 1 2 467 1 1 38 GLN O O 8.905 7.461 10.904 1.00 . A A . 19 GLY O 1 1 2 468 1 1 39 ALA C C 7.987 4.803 11.374 1.00 . A A . 20 GLN C 1 1 2 469 1 1 39 ALA CA C 8.025 5.553 12.697 1.00 . A A . 20 GLN CA 1 1 2 470 1 1 39 ALA CB C 7.256 4.775 13.766 1.00 . A A . 20 GLN CB 1 1 2 471 1 1 39 ALA H H 6.716 7.164 13.102 1.00 . A A . 20 GLN H 1 1 2 472 1 1 39 ALA HA H 9.057 5.655 13.004 1.00 . A A . 20 GLN HA 1 1 2 473 1 1 39 ALA HB2 H 6.794 5.479 14.443 1.00 . A A . 20 GLN HB2 1 1 2 474 1 1 39 ALA HB3 H 6.486 4.191 13.286 1.00 . A A . 20 GLN HB3 1 1 2 475 1 1 39 ALA N N 7.471 6.890 12.541 1.00 . A A . 20 GLN N 1 1 2 476 1 1 39 ALA O O 9.032 4.473 10.814 1.00 . A A . 20 GLN O 1 1 2 477 1 1 40 PHE C C 7.214 4.624 8.437 1.00 . A A . 21 ALA C 1 1 2 478 1 1 40 PHE CA C 6.660 3.825 9.600 1.00 . A A . 21 ALA CA 1 1 2 479 1 1 40 PHE CB C 5.238 3.374 9.334 1.00 . A A . 21 ALA CB 1 1 2 480 1 1 40 PHE H H 5.978 4.822 11.344 1.00 . A A . 21 ALA H 1 1 2 481 1 1 40 PHE HA H 7.269 2.965 9.692 1.00 . A A . 21 ALA HA 1 1 2 482 1 1 40 PHE HB2 H 5.263 2.456 8.762 1.00 . A A . 21 ALA HB2 1 1 2 483 1 1 40 PHE HB3 H 4.716 4.135 8.774 1.00 . A A . 21 ALA HB3 1 1 2 484 1 1 40 PHE N N 6.784 4.535 10.866 1.00 . A A . 21 ALA N 1 1 2 485 1 1 40 PHE O O 7.303 4.133 7.312 1.00 . A A . 21 ALA O 1 1 2 486 1 1 41 GLN C C 9.599 6.103 7.418 1.00 . A A . 22 PHE C 1 1 2 487 1 1 41 GLN CA C 8.239 6.686 7.730 1.00 . A A . 22 PHE CA 1 1 2 488 1 1 41 GLN CB C 8.378 8.124 8.233 1.00 . A A . 22 PHE CB 1 1 2 489 1 1 41 GLN CG C 8.651 9.116 7.137 1.00 . A A . 22 PHE CG 1 1 2 490 1 1 41 GLN H H 7.567 6.126 9.646 1.00 . A A . 22 PHE H 1 1 2 491 1 1 41 GLN HA H 7.623 6.664 6.845 1.00 . A A . 22 PHE HA 1 1 2 492 1 1 41 GLN HB2 H 7.465 8.415 8.727 1.00 . A A . 22 PHE HB2 1 1 2 493 1 1 41 GLN HB3 H 9.196 8.174 8.935 1.00 . A A . 22 PHE HB3 1 1 2 494 1 1 41 GLN N N 7.631 5.831 8.731 1.00 . A A . 22 PHE N 1 1 2 495 1 1 41 GLN O O 10.002 5.984 6.260 1.00 . A A . 22 PHE O 1 1 2 496 1 1 42 GLU C C 11.382 3.629 7.831 1.00 . A A . 23 GLN C 1 1 2 497 1 1 42 GLU CA C 11.568 5.047 8.374 1.00 . A A . 23 GLN CA 1 1 2 498 1 1 42 GLU CB C 12.252 5.008 9.744 1.00 . A A . 23 GLN CB 1 1 2 499 1 1 42 GLU CD C 13.528 6.465 11.366 1.00 . A A . 23 GLN CD 1 1 2 500 1 1 42 GLU CG C 13.329 6.066 9.916 1.00 . A A . 23 GLN CG 1 1 2 501 1 1 42 GLU H H 9.865 5.786 9.373 1.00 . A A . 23 GLN H 1 1 2 502 1 1 42 GLU HA H 12.173 5.618 7.684 1.00 . A A . 23 GLN HA 1 1 2 503 1 1 42 GLU HB2 H 11.502 5.159 10.513 1.00 . A A . 23 GLN HB2 1 1 2 504 1 1 42 GLU HB3 H 12.705 4.038 9.882 1.00 . A A . 23 GLN HB3 1 1 2 505 1 1 42 GLU HG2 H 14.261 5.678 9.534 1.00 . A A . 23 GLN HG2 1 1 2 506 1 1 42 GLU HG3 H 13.047 6.944 9.353 1.00 . A A . 23 GLN HG3 1 1 2 507 1 1 42 GLU N N 10.273 5.688 8.484 1.00 . A A . 23 GLN N 1 1 2 508 1 1 42 GLU O O 12.301 3.042 7.262 1.00 . A A . 23 GLN O 1 1 2 509 1 1 42 GLU OE1 O 14.223 5.782 12.119 1.00 . A A . 23 GLN OE1 1 1 2 510 1 1 43 ARG C C 9.740 1.716 6.025 1.00 . A A . 24 GLU C 1 1 2 511 1 1 43 ARG CA C 9.833 1.756 7.546 1.00 . A A . 24 GLU CA 1 1 2 512 1 1 43 ARG CB C 8.506 1.297 8.154 1.00 . A A . 24 GLU CB 1 1 2 513 1 1 43 ARG CD C 9.588 -0.241 9.842 1.00 . A A . 24 GLU CD 1 1 2 514 1 1 43 ARG CG C 8.614 0.900 9.618 1.00 . A A . 24 GLU CG 1 1 2 515 1 1 43 ARG H H 9.484 3.618 8.470 1.00 . A A . 24 GLU H 1 1 2 516 1 1 43 ARG HA H 10.608 1.090 7.869 1.00 . A A . 24 GLU HA 1 1 2 517 1 1 43 ARG HB2 H 7.789 2.099 8.072 1.00 . A A . 24 GLU HB2 1 1 2 518 1 1 43 ARG HB3 H 8.145 0.445 7.598 1.00 . A A . 24 GLU HB3 1 1 2 519 1 1 43 ARG HG2 H 8.948 1.754 10.186 1.00 . A A . 24 GLU HG2 1 1 2 520 1 1 43 ARG HG3 H 7.638 0.594 9.968 1.00 . A A . 24 GLU HG3 1 1 2 521 1 1 43 ARG N N 10.170 3.094 8.013 1.00 . A A . 24 GLU N 1 1 2 522 1 1 43 ARG O O 10.313 0.837 5.380 1.00 . A A . 24 GLU O 1 1 2 523 1 1 44 TYR C C 10.180 2.790 3.296 1.00 . A A . 25 ARG C 1 1 2 524 1 1 44 TYR CA C 8.836 2.750 4.011 1.00 . A A . 25 ARG CA 1 1 2 525 1 1 44 TYR CB C 8.009 3.983 3.639 1.00 . A A . 25 ARG CB 1 1 2 526 1 1 44 TYR CG C 6.510 3.727 3.623 1.00 . A A . 25 ARG CG 1 1 2 527 1 1 44 TYR CZ C 3.751 4.023 2.013 1.00 . A A . 25 ARG CZ 1 1 2 528 1 1 44 TYR H H 8.577 3.343 6.027 1.00 . A A . 25 ARG H 1 1 2 529 1 1 44 TYR HA H 8.309 1.866 3.699 1.00 . A A . 25 ARG HA 1 1 2 530 1 1 44 TYR HB2 H 8.211 4.766 4.353 1.00 . A A . 25 ARG HB2 1 1 2 531 1 1 44 TYR HB3 H 8.305 4.317 2.656 1.00 . A A . 25 ARG HB3 1 1 2 532 1 1 44 TYR HD2 H 6.359 3.867 1.504 1.00 . A A . 25 ARG HD2 1 1 2 533 1 1 44 TYR N N 9.011 2.674 5.458 1.00 . A A . 25 ARG N 1 1 2 534 1 1 44 TYR O O 10.303 2.339 2.157 1.00 . A A . 25 ARG O 1 1 2 535 1 1 45 THR C C 13.097 2.028 3.169 1.00 . A A . 26 TYR C 1 1 2 536 1 1 45 THR CA C 12.522 3.419 3.405 1.00 . A A . 26 TYR CA 1 1 2 537 1 1 45 THR CB C 13.440 4.218 4.332 1.00 . A A . 26 TYR CB 1 1 2 538 1 1 45 THR H H 11.022 3.664 4.875 1.00 . A A . 26 TYR H 1 1 2 539 1 1 45 THR HA H 12.445 3.932 2.459 1.00 . A A . 26 TYR HA 1 1 2 540 1 1 45 THR N N 11.184 3.326 3.973 1.00 . A A . 26 TYR N 1 1 2 541 1 1 45 THR O O 13.604 1.728 2.088 1.00 . A A . 26 TYR O 1 1 2 542 1 1 46 ALA C C 12.539 -1.066 3.320 1.00 . A A . 27 THR C 1 1 2 543 1 1 46 ALA CA C 13.511 -0.184 4.096 1.00 . A A . 27 THR CA 1 1 2 544 1 1 46 ALA CB C 13.739 -0.759 5.495 1.00 . A A . 27 THR CB 1 1 2 545 1 1 46 ALA H H 12.587 1.478 5.022 1.00 . A A . 27 THR H 1 1 2 546 1 1 46 ALA HA H 14.454 -0.155 3.568 1.00 . A A . 27 THR HA 1 1 2 547 1 1 46 ALA N N 13.007 1.180 4.188 1.00 . A A . 27 THR N 1 1 2 548 1 1 46 ALA O O 12.949 -1.905 2.519 1.00 . A A . 27 THR O 1 1 2 549 1 1 47 GLY C C 10.144 -1.291 1.408 1.00 . A A . 28 ALA C 1 1 2 550 1 1 47 GLY CA C 10.215 -1.645 2.889 1.00 . A A . 28 ALA CA 1 1 2 551 1 1 47 GLY H H 10.980 -0.187 4.212 1.00 . A A . 28 ALA H 1 1 2 552 1 1 47 GLY N N 11.246 -0.869 3.564 1.00 . A A . 28 ALA N 1 1 2 553 1 1 47 GLY O O 9.895 -2.154 0.565 1.00 . A A . 28 ALA O 1 1 2 554 1 1 48 ILE C C 11.434 -0.171 -1.117 1.00 . A A . 29 GLY C 1 1 2 555 1 1 48 ILE CA C 10.321 0.428 -0.281 1.00 . A A . 29 GLY CA 1 1 2 556 1 1 48 ILE H H 10.557 0.624 1.814 1.00 . A A . 29 GLY H 1 1 2 557 1 1 48 ILE N N 10.365 -0.018 1.099 1.00 . A A . 29 GLY N 1 1 2 558 1 1 48 ILE O O 11.178 -0.821 -2.130 1.00 . A A . 29 GLY O 1 1 2 559 1 1 49 ASN C C 13.778 -2.004 -1.480 1.00 . A A . 30 ILE C 1 1 2 560 1 1 49 ASN CA C 13.830 -0.481 -1.403 1.00 . A A . 30 ILE CA 1 1 2 561 1 1 49 ASN CB C 15.148 -0.047 -0.729 1.00 . A A . 30 ILE CB 1 1 2 562 1 1 49 ASN H H 12.814 0.569 0.128 1.00 . A A . 30 ILE H 1 1 2 563 1 1 49 ASN HA H 13.814 -0.080 -2.405 1.00 . A A . 30 ILE HA 1 1 2 564 1 1 49 ASN N N 12.674 0.045 -0.689 1.00 . A A . 30 ILE N 1 1 2 565 1 1 49 ASN O O 14.314 -2.607 -2.411 1.00 . A A . 30 ILE O 1 1 2 566 1 1 50 SER C C 12.380 -4.602 -1.746 1.00 . A A . 31 ASN C 1 1 2 567 1 1 50 SER CA C 13.002 -4.075 -0.457 1.00 . A A . 31 ASN CA 1 1 2 568 1 1 50 SER CB C 12.158 -4.503 0.746 1.00 . A A . 31 ASN CB 1 1 2 569 1 1 50 SER H H 12.720 -2.088 0.214 1.00 . A A . 31 ASN H 1 1 2 570 1 1 50 SER HA H 13.995 -4.491 -0.356 1.00 . A A . 31 ASN HA 1 1 2 571 1 1 50 SER HB2 H 12.113 -3.690 1.453 1.00 . A A . 31 ASN HB2 1 1 2 572 1 1 50 SER HB3 H 11.159 -4.739 0.410 1.00 . A A . 31 ASN HB3 1 1 2 573 1 1 50 SER N N 13.128 -2.622 -0.498 1.00 . A A . 31 ASN N 1 1 2 574 1 1 50 SER O O 13.034 -5.297 -2.523 1.00 . A A . 31 ASN O 1 1 2 575 1 1 51 PHE C C 11.166 -4.253 -4.422 1.00 . A A . 32 SER C 1 1 2 576 1 1 51 PHE CA C 10.410 -4.693 -3.172 1.00 . A A . 32 SER CA 1 1 2 577 1 1 51 PHE CB C 8.990 -4.123 -3.192 1.00 . A A . 32 SER CB 1 1 2 578 1 1 51 PHE H H 10.646 -3.700 -1.318 1.00 . A A . 32 SER H 1 1 2 579 1 1 51 PHE HA H 10.357 -5.771 -3.157 1.00 . A A . 32 SER HA 1 1 2 580 1 1 51 PHE HB2 H 8.995 -3.167 -3.695 1.00 . A A . 32 SER HB2 1 1 2 581 1 1 51 PHE HB3 H 8.338 -4.804 -3.720 1.00 . A A . 32 SER HB3 1 1 2 582 1 1 51 PHE N N 11.114 -4.260 -1.971 1.00 . A A . 32 SER N 1 1 2 583 1 1 51 PHE O O 11.143 -4.933 -5.448 1.00 . A A . 32 SER O 1 1 2 584 1 1 52 VAL C C 13.750 -3.532 -5.797 1.00 . A A . 33 PHE C 1 1 2 585 1 1 52 VAL CA C 12.616 -2.576 -5.430 1.00 . A A . 33 PHE CA 1 1 2 586 1 1 52 VAL CB C 13.166 -1.190 -5.061 1.00 . A A . 33 PHE CB 1 1 2 587 1 1 52 VAL H H 11.823 -2.623 -3.472 1.00 . A A . 33 PHE H 1 1 2 588 1 1 52 VAL HA H 11.955 -2.480 -6.277 1.00 . A A . 33 PHE HA 1 1 2 589 1 1 52 VAL N N 11.842 -3.114 -4.319 1.00 . A A . 33 PHE N 1 1 2 590 1 1 52 VAL O O 13.828 -4.017 -6.927 1.00 . A A . 33 PHE O 1 1 2 591 1 1 53 SER C C 15.271 -6.050 -5.575 1.00 . A A . 34 VAL C 1 1 2 592 1 1 53 SER CA C 15.753 -4.702 -5.054 1.00 . A A . 34 VAL CA 1 1 2 593 1 1 53 SER CB C 16.575 -4.913 -3.765 1.00 . A A . 34 VAL CB 1 1 2 594 1 1 53 SER H H 14.511 -3.389 -3.951 1.00 . A A . 34 VAL H 1 1 2 595 1 1 53 SER HA H 16.395 -4.254 -5.800 1.00 . A A . 34 VAL HA 1 1 2 596 1 1 53 SER N N 14.626 -3.802 -4.831 1.00 . A A . 34 VAL N 1 1 2 597 1 1 53 SER O O 15.438 -6.359 -6.752 1.00 . A A . 34 VAL O 1 1 2 598 1 1 54 GLY C C 13.379 -8.138 -6.327 1.00 . A A . 35 SER C 1 1 2 599 1 1 54 GLY CA C 14.214 -8.172 -5.073 1.00 . A A . 35 SER CA 1 1 2 600 1 1 54 GLY H H 14.608 -6.590 -3.768 1.00 . A A . 35 SER H 1 1 2 601 1 1 54 GLY N N 14.688 -6.861 -4.694 1.00 . A A . 35 SER N 1 1 2 602 1 1 54 GLY O O 13.671 -8.860 -7.279 1.00 . A A . 35 SER O 1 1 2 603 1 1 55 VAL C C 12.428 -7.404 -8.771 1.00 . A A . 36 GLY C 1 1 2 604 1 1 55 VAL CA C 11.552 -7.202 -7.553 1.00 . A A . 36 GLY CA 1 1 2 605 1 1 55 VAL H H 12.187 -6.726 -5.581 1.00 . A A . 36 GLY H 1 1 2 606 1 1 55 VAL N N 12.364 -7.293 -6.355 1.00 . A A . 36 GLY N 1 1 2 607 1 1 55 VAL O O 12.091 -8.151 -9.690 1.00 . A A . 36 GLY O 1 1 2 608 1 1 56 ALA C C 15.586 -7.985 -9.483 1.00 . A A . 37 VAL C 1 1 2 609 1 1 56 ALA CA C 14.581 -6.863 -9.766 1.00 . A A . 37 VAL CA 1 1 2 610 1 1 56 ALA CB C 15.341 -5.531 -9.945 1.00 . A A . 37 VAL CB 1 1 2 611 1 1 56 ALA H H 13.800 -6.216 -7.946 1.00 . A A . 37 VAL H 1 1 2 612 1 1 56 ALA HA H 14.067 -7.082 -10.681 1.00 . A A . 37 VAL HA 1 1 2 613 1 1 56 ALA N N 13.589 -6.756 -8.728 1.00 . A A . 37 VAL N 1 1 2 614 1 1 56 ALA O O 15.595 -9.018 -10.153 1.00 . A A . 37 VAL O 1 1 2 615 1 1 57 SER C C 17.079 -9.767 -7.173 1.00 . A A . 38 ALA C 1 1 2 616 1 1 57 SER CA C 17.517 -8.666 -8.129 1.00 . A A . 38 ALA CA 1 1 2 617 1 1 57 SER CB C 18.685 -7.902 -7.515 1.00 . A A . 38 ALA CB 1 1 2 618 1 1 57 SER H H 16.405 -6.890 -8.021 1.00 . A A . 38 ALA H 1 1 2 619 1 1 57 SER HA H 17.866 -9.117 -9.035 1.00 . A A . 38 ALA HA 1 1 2 620 1 1 57 SER HB2 H 18.591 -6.852 -7.749 1.00 . A A . 38 ALA HB2 1 1 2 621 1 1 57 SER HB3 H 19.614 -8.279 -7.918 1.00 . A A . 38 ALA HB3 1 1 2 622 1 1 57 SER N N 16.462 -7.737 -8.502 1.00 . A A . 38 ALA N 1 1 2 623 1 1 57 SER O O 16.962 -10.935 -7.539 1.00 . A A . 38 ALA O 1 1 2 624 1 1 58 GLY C C 15.214 -10.946 -4.973 1.00 . A A . 39 SER C 1 1 2 625 1 1 58 GLY CA C 16.575 -10.253 -4.825 1.00 . A A . 39 SER CA 1 1 2 626 1 1 58 GLY H H 17.074 -8.416 -5.716 1.00 . A A . 39 SER H 1 1 2 627 1 1 58 GLY N N 16.915 -9.361 -5.922 1.00 . A A . 39 SER N 1 1 2 628 1 1 58 GLY O O 14.763 -11.630 -4.054 1.00 . A A . 39 SER O 1 1 2 629 1 1 59 ALA C C 13.104 -11.933 -7.741 1.00 . A A . 40 GLY C 1 1 2 630 1 1 59 ALA CA C 13.266 -11.398 -6.332 1.00 . A A . 40 GLY CA 1 1 2 631 1 1 59 ALA H H 14.950 -10.218 -6.826 1.00 . A A . 40 GLY H 1 1 2 632 1 1 59 ALA N N 14.559 -10.773 -6.120 1.00 . A A . 40 GLY N 1 1 2 633 1 1 59 ALA O O 13.037 -13.145 -7.947 1.00 . A A . 40 GLY O 1 1 2 634 1 1 60 GLY C C 11.638 -12.272 -10.309 1.00 . A A . 41 ALA C 1 1 2 635 1 1 60 GLY CA C 12.885 -11.414 -10.109 1.00 . A A . 41 ALA CA 1 1 2 636 1 1 60 GLY H H 13.101 -10.077 -8.484 1.00 . A A . 41 ALA H 1 1 2 637 1 1 60 GLY N N 13.041 -11.028 -8.712 1.00 . A A . 41 ALA N 1 1 2 638 1 1 60 GLY O O 11.712 -13.379 -10.842 1.00 . A A . 41 ALA O 1 1 2 639 1 1 61 SER C C 9.010 -13.451 -8.881 1.00 . A A . 42 GLY C 1 1 2 640 1 1 61 SER CA C 9.248 -12.479 -10.020 1.00 . A A . 42 GLY CA 1 1 2 641 1 1 61 SER H H 10.496 -10.863 -9.464 1.00 . A A . 42 GLY H 1 1 2 642 1 1 61 SER N N 10.494 -11.751 -9.880 1.00 . A A . 42 GLY N 1 1 2 643 1 1 61 SER O O 9.124 -14.664 -9.055 1.00 . A A . 42 GLY O 1 1 2 644 1 1 62 ILE C C 6.939 -13.739 -6.180 1.00 . A A . 43 SER C 1 1 2 645 1 1 62 ILE CA C 8.423 -13.743 -6.535 1.00 . A A . 43 SER CA 1 1 2 646 1 1 62 ILE CB C 9.250 -13.249 -5.347 1.00 . A A . 43 SER CB 1 1 2 647 1 1 62 ILE H H 8.603 -11.942 -7.632 1.00 . A A . 43 SER H 1 1 2 648 1 1 62 ILE HA H 8.720 -14.755 -6.774 1.00 . A A . 43 SER HA 1 1 2 649 1 1 62 ILE N N 8.679 -12.916 -7.710 1.00 . A A . 43 SER N 1 1 2 650 1 1 62 ILE O O 6.557 -13.350 -5.075 1.00 . A A . 43 SER O 1 1 2 651 1 1 63 GLY C C 4.142 -12.951 -6.257 1.00 . A A . 44 ILE C 1 1 2 652 1 1 63 GLY CA C 4.661 -14.225 -6.924 1.00 . A A . 44 ILE CA 1 1 2 653 1 1 63 GLY H H 6.479 -14.468 -7.984 1.00 . A A . 44 ILE H 1 1 2 654 1 1 63 GLY N N 6.109 -14.173 -7.125 1.00 . A A . 44 ILE N 1 1 2 655 1 1 63 GLY O O 3.260 -12.995 -5.401 1.00 . A A . 44 ILE O 1 1 2 656 1 1 64 ARG C C 3.270 -9.825 -6.967 1.00 . A A . 45 GLY C 1 1 2 657 1 1 64 ARG CA C 4.283 -10.544 -6.096 1.00 . A A . 45 GLY CA 1 1 2 658 1 1 64 ARG H H 5.397 -11.838 -7.348 1.00 . A A . 45 GLY H 1 1 2 659 1 1 64 ARG N N 4.698 -11.814 -6.661 1.00 . A A . 45 GLY N 1 1 2 660 1 1 64 ARG O O 2.231 -10.386 -7.312 1.00 . A A . 45 GLY O 1 1 3 661 1 1 20 ASN C C -4.866 -6.545 18.814 1.00 . A A . 1 VAL C 1 1 3 662 1 1 20 ASN CA C -4.666 -5.149 18.221 1.00 . A A . 1 VAL CA 1 1 3 663 1 1 20 ASN CB C -5.087 -4.081 19.256 1.00 . A A . 1 VAL CB 1 1 3 664 1 1 20 ASN H H -4.943 -4.568 16.204 1.00 . A A . 1 VAL H 1 1 3 665 1 1 20 ASN HA H -3.615 -5.012 18.010 1.00 . A A . 1 VAL HA 1 1 3 666 1 1 20 ASN N N -5.396 -4.988 16.965 1.00 . A A . 1 VAL N 1 1 3 667 1 1 20 ASN O O -5.405 -7.436 18.158 1.00 . A A . 1 VAL O 1 1 3 668 1 1 21 TYR C C -5.139 -7.829 22.130 1.00 . A A . 2 ASN C 1 1 3 669 1 1 21 TYR CA C -4.560 -8.012 20.731 1.00 . A A . 2 ASN CA 1 1 3 670 1 1 21 TYR CB C -3.202 -8.712 20.814 1.00 . A A . 2 ASN CB 1 1 3 671 1 1 21 TYR CG C -2.940 -9.608 19.619 1.00 . A A . 2 ASN CG 1 1 3 672 1 1 21 TYR H H -4.005 -5.982 20.529 1.00 . A A . 2 ASN H 1 1 3 673 1 1 21 TYR HA H -5.235 -8.624 20.151 1.00 . A A . 2 ASN HA 1 1 3 674 1 1 21 TYR HB2 H -2.422 -7.966 20.858 1.00 . A A . 2 ASN HB2 1 1 3 675 1 1 21 TYR HB3 H -3.168 -9.316 21.709 1.00 . A A . 2 ASN HB3 1 1 3 676 1 1 21 TYR N N -4.428 -6.727 20.056 1.00 . A A . 2 ASN N 1 1 3 677 1 1 21 TYR O O -4.428 -7.941 23.129 1.00 . A A . 2 ASN O 1 1 3 678 1 1 22 GLY C C -6.576 -6.107 24.181 1.00 . A A . 3 TYR C 1 1 3 679 1 1 22 GLY CA C -7.116 -7.345 23.469 1.00 . A A . 3 TYR CA 1 1 3 680 1 1 22 GLY H H -6.950 -7.469 21.362 1.00 . A A . 3 TYR H 1 1 3 681 1 1 22 GLY N N -6.437 -7.546 22.194 1.00 . A A . 3 TYR N 1 1 3 682 1 1 22 GLY O O -6.390 -6.107 25.398 1.00 . A A . 3 TYR O 1 1 3 683 1 1 23 ASN C C -4.372 -3.557 23.593 1.00 . A A . 4 GLY C 1 1 3 684 1 1 23 ASN CA C -5.813 -3.820 23.984 1.00 . A A . 4 GLY CA 1 1 3 685 1 1 23 ASN H H -6.496 -5.109 22.448 1.00 . A A . 4 GLY H 1 1 3 686 1 1 23 ASN N N -6.327 -5.051 23.412 1.00 . A A . 4 GLY N 1 1 3 687 1 1 23 ASN O O -4.027 -2.449 23.180 1.00 . A A . 4 GLY O 1 1 3 688 1 1 24 GLY C C -1.382 -3.462 24.257 1.00 . A A . 5 ASN C 1 1 3 689 1 1 24 GLY CA C -2.118 -4.465 23.366 1.00 . A A . 5 ASN CA 1 1 3 690 1 1 24 GLY H H -3.867 -5.436 24.037 1.00 . A A . 5 ASN H 1 1 3 691 1 1 24 GLY N N -3.529 -4.580 23.715 1.00 . A A . 5 ASN N 1 1 3 692 1 1 24 GLY O O -0.207 -3.170 24.030 1.00 . A A . 5 ASN O 1 1 3 693 1 1 25 VAL C C -0.935 -0.752 25.441 1.00 . A A . 6 GLY C 1 1 3 694 1 1 25 VAL CA C -1.452 -1.980 26.165 1.00 . A A . 6 GLY CA 1 1 3 695 1 1 25 VAL H H -2.997 -3.205 25.403 1.00 . A A . 6 GLY H 1 1 3 696 1 1 25 VAL N N -2.068 -2.939 25.266 1.00 . A A . 6 GLY N 1 1 3 697 1 1 25 VAL O O 0.158 -0.267 25.729 1.00 . A A . 6 GLY O 1 1 3 698 1 1 26 SER C C -2.062 2.178 24.253 1.00 . A A . 7 VAL C 1 1 3 699 1 1 26 SER CA C -1.343 0.933 23.731 1.00 . A A . 7 VAL CA 1 1 3 700 1 1 26 SER CB C -1.633 0.731 22.222 1.00 . A A . 7 VAL CB 1 1 3 701 1 1 26 SER H H -2.586 -0.678 24.314 1.00 . A A . 7 VAL H 1 1 3 702 1 1 26 SER HA H -0.279 1.076 23.852 1.00 . A A . 7 VAL HA 1 1 3 703 1 1 26 SER N N -1.725 -0.247 24.498 1.00 . A A . 7 VAL N 1 1 3 704 1 1 26 SER O O -2.552 2.195 25.382 1.00 . A A . 7 VAL O 1 1 3 705 1 1 27 CYS C C -3.294 5.194 22.570 1.00 . A A . 8 SER C 1 1 3 706 1 1 27 CYS CA C -2.774 4.461 23.803 1.00 . A A . 8 SER CA 1 1 3 707 1 1 27 CYS CB C -1.805 5.359 24.575 1.00 . A A . 8 SER CB 1 1 3 708 1 1 27 CYS H H -1.708 3.135 22.543 1.00 . A A . 8 SER H 1 1 3 709 1 1 27 CYS HA H -3.610 4.217 24.441 1.00 . A A . 8 SER HA 1 1 3 710 1 1 27 CYS HB2 H -0.797 5.176 24.233 1.00 . A A . 8 SER HB2 1 1 3 711 1 1 27 CYS HB3 H -2.061 6.394 24.401 1.00 . A A . 8 SER HB3 1 1 3 712 1 1 27 CYS N N -2.118 3.214 23.427 1.00 . A A . 8 SER N 1 1 3 713 1 1 27 CYS O O -2.567 5.377 21.593 1.00 . A A . 8 SER O 1 1 3 714 1 1 28 SER C C -5.630 7.712 21.932 1.00 . A A . 9 CYS C 1 1 3 715 1 1 28 SER CA C -5.174 6.320 21.506 1.00 . A A . 9 CYS CA 1 1 3 716 1 1 28 SER CB C -6.365 5.525 20.961 1.00 . A A . 9 CYS CB 1 1 3 717 1 1 28 SER H H -5.085 5.431 23.426 1.00 . A A . 9 CYS H 1 1 3 718 1 1 28 SER HA H -4.434 6.420 20.726 1.00 . A A . 9 CYS HA 1 1 3 719 1 1 28 SER HB2 H -7.224 5.706 21.588 1.00 . A A . 9 CYS HB2 1 1 3 720 1 1 28 SER HB3 H -6.581 5.859 19.958 1.00 . A A . 9 CYS HB3 1 1 3 721 1 1 28 SER N N -4.556 5.610 22.621 1.00 . A A . 9 CYS N 1 1 3 722 1 1 28 SER O O -6.525 7.855 22.766 1.00 . A A . 9 CYS O 1 1 3 723 1 1 29 LYS C C -4.961 11.050 20.525 1.00 . A A . 10 SER C 1 1 3 724 1 1 29 LYS CA C -5.356 10.119 21.667 1.00 . A A . 10 SER CA 1 1 3 725 1 1 29 LYS CB C -4.663 10.556 22.959 1.00 . A A . 10 SER CB 1 1 3 726 1 1 29 LYS H H -4.308 8.558 20.693 1.00 . A A . 10 SER H 1 1 3 727 1 1 29 LYS HA H -6.424 10.171 21.807 1.00 . A A . 10 SER HA 1 1 3 728 1 1 29 LYS HB2 H -3.614 10.306 22.905 1.00 . A A . 10 SER HB2 1 1 3 729 1 1 29 LYS HB3 H -4.773 11.625 23.078 1.00 . A A . 10 SER HB3 1 1 3 730 1 1 29 LYS N N -5.012 8.736 21.352 1.00 . A A . 10 SER N 1 1 3 731 1 1 29 LYS O O -3.781 11.191 20.207 1.00 . A A . 10 SER O 1 1 3 732 1 1 30 THR C C -5.106 11.916 17.600 1.00 . A A . 11 LYS C 1 1 3 733 1 1 30 THR CA C -5.725 12.610 18.811 1.00 . A A . 11 LYS CA 1 1 3 734 1 1 30 THR CB C -4.821 13.740 19.282 1.00 . A A . 11 LYS CB 1 1 3 735 1 1 30 THR H H -6.873 11.539 20.221 1.00 . A A . 11 LYS H 1 1 3 736 1 1 30 THR HA H -6.673 13.023 18.521 1.00 . A A . 11 LYS HA 1 1 3 737 1 1 30 THR N N -5.959 11.687 19.915 1.00 . A A . 11 LYS N 1 1 3 738 1 1 30 THR O O -4.782 12.562 16.604 1.00 . A A . 11 LYS O 1 1 3 739 1 1 31 LYS C C -4.896 8.398 16.636 1.00 . A A . 12 THR C 1 1 3 740 1 1 31 LYS CA C -4.367 9.830 16.607 1.00 . A A . 12 THR CA 1 1 3 741 1 1 31 LYS CB C -2.838 9.869 16.717 1.00 . A A . 12 THR CB 1 1 3 742 1 1 31 LYS H H -5.219 10.141 18.497 1.00 . A A . 12 THR H 1 1 3 743 1 1 31 LYS HA H -4.663 10.290 15.682 1.00 . A A . 12 THR HA 1 1 3 744 1 1 31 LYS N N -4.943 10.602 17.689 1.00 . A A . 12 THR N 1 1 3 745 1 1 31 LYS O O -5.480 7.967 17.631 1.00 . A A . 12 THR O 1 1 3 746 1 1 32 CYS C C -4.656 5.479 16.672 1.00 . A A . 13 LYS C 1 1 3 747 1 1 32 CYS CA C -5.143 6.279 15.466 1.00 . A A . 13 LYS CA 1 1 3 748 1 1 32 CYS CB C -4.645 5.630 14.173 1.00 . A A . 13 LYS CB 1 1 3 749 1 1 32 CYS H H -4.214 8.058 14.787 1.00 . A A . 13 LYS H 1 1 3 750 1 1 32 CYS HA H -6.223 6.285 15.465 1.00 . A A . 13 LYS HA 1 1 3 751 1 1 32 CYS HB2 H -3.726 6.112 13.872 1.00 . A A . 13 LYS HB2 1 1 3 752 1 1 32 CYS HB3 H -4.448 4.585 14.360 1.00 . A A . 13 LYS HB3 1 1 3 753 1 1 32 CYS N N -4.688 7.663 15.549 1.00 . A A . 13 LYS N 1 1 3 754 1 1 32 CYS O O -3.956 6.007 17.536 1.00 . A A . 13 LYS O 1 1 3 755 1 1 33 SER C C -3.367 2.555 17.480 1.00 . A A . 14 CYS C 1 1 3 756 1 1 33 SER CA C -4.625 3.344 17.832 1.00 . A A . 14 CYS CA 1 1 3 757 1 1 33 SER CB C -5.758 2.386 18.199 1.00 . A A . 14 CYS CB 1 1 3 758 1 1 33 SER H H -5.587 3.837 16.011 1.00 . A A . 14 CYS H 1 1 3 759 1 1 33 SER HA H -4.411 3.975 18.682 1.00 . A A . 14 CYS HA 1 1 3 760 1 1 33 SER HB2 H -6.217 2.020 17.292 1.00 . A A . 14 CYS HB2 1 1 3 761 1 1 33 SER HB3 H -5.350 1.552 18.752 1.00 . A A . 14 CYS HB3 1 1 3 762 1 1 33 SER N N -5.028 4.206 16.728 1.00 . A A . 14 CYS N 1 1 3 763 1 1 33 SER O O -3.196 1.415 17.912 1.00 . A A . 14 CYS O 1 1 3 764 1 1 34 VAL C C -0.247 3.565 15.777 1.00 . A A . 15 SER C 1 1 3 765 1 1 34 VAL CA C -1.246 2.529 16.281 1.00 . A A . 15 SER CA 1 1 3 766 1 1 34 VAL CB C -1.520 1.491 15.190 1.00 . A A . 15 SER CB 1 1 3 767 1 1 34 VAL H H -2.682 4.077 16.380 1.00 . A A . 15 SER H 1 1 3 768 1 1 34 VAL HA H -0.829 2.031 17.145 1.00 . A A . 15 SER HA 1 1 3 769 1 1 34 VAL N N -2.490 3.170 16.692 1.00 . A A . 15 SER N 1 1 3 770 1 1 34 VAL O O -0.064 3.729 14.571 1.00 . A A . 15 SER O 1 1 3 771 1 1 35 ASN C C 2.443 4.736 15.418 1.00 . A A . 16 VAL C 1 1 3 772 1 1 35 ASN CA C 1.374 5.290 16.354 1.00 . A A . 16 VAL CA 1 1 3 773 1 1 35 ASN CB C 2.062 5.875 17.604 1.00 . A A . 16 VAL CB 1 1 3 774 1 1 35 ASN H H 0.207 4.092 17.654 1.00 . A A . 16 VAL H 1 1 3 775 1 1 35 ASN HA H 0.850 6.090 15.851 1.00 . A A . 16 VAL HA 1 1 3 776 1 1 35 ASN N N 0.396 4.266 16.708 1.00 . A A . 16 VAL N 1 1 3 777 1 1 35 ASN O O 2.875 3.592 15.563 1.00 . A A . 16 VAL O 1 1 3 778 1 1 36 TRP C C 4.177 6.283 12.516 1.00 . A A . 17 ASN C 1 1 3 779 1 1 36 TRP CA C 3.886 5.155 13.502 1.00 . A A . 17 ASN CA 1 1 3 780 1 1 36 TRP CB C 3.439 3.900 12.747 1.00 . A A . 17 ASN CB 1 1 3 781 1 1 36 TRP CG C 2.204 4.141 11.898 1.00 . A A . 17 ASN CG 1 1 3 782 1 1 36 TRP H H 2.483 6.457 14.403 1.00 . A A . 17 ASN H 1 1 3 783 1 1 36 TRP HA H 4.788 4.932 14.052 1.00 . A A . 17 ASN HA 1 1 3 784 1 1 36 TRP HB2 H 4.238 3.575 12.102 1.00 . A A . 17 ASN HB2 1 1 3 785 1 1 36 TRP HB3 H 3.216 3.119 13.458 1.00 . A A . 17 ASN HB3 1 1 3 786 1 1 36 TRP N N 2.866 5.557 14.463 1.00 . A A . 17 ASN N 1 1 3 787 1 1 36 TRP O O 4.361 6.046 11.323 1.00 . A A . 17 ASN O 1 1 3 788 1 1 37 GLY C C 5.950 8.799 11.845 1.00 . A A . 18 TRP C 1 1 3 789 1 1 37 GLY CA C 4.468 8.674 12.184 1.00 . A A . 18 TRP CA 1 1 3 790 1 1 37 GLY H H 4.047 7.639 13.976 1.00 . A A . 18 TRP H 1 1 3 791 1 1 37 GLY N N 4.208 7.512 13.021 1.00 . A A . 18 TRP N 1 1 3 792 1 1 37 GLY O O 6.311 9.163 10.727 1.00 . A A . 18 TRP O 1 1 3 793 1 1 38 GLN C C 8.860 7.219 12.376 1.00 . A A . 19 GLY C 1 1 3 794 1 1 38 GLN CA C 8.236 8.579 12.601 1.00 . A A . 19 GLY CA 1 1 3 795 1 1 38 GLN H H 6.456 8.209 13.689 1.00 . A A . 19 GLY H 1 1 3 796 1 1 38 GLN N N 6.803 8.495 12.818 1.00 . A A . 19 GLY N 1 1 3 797 1 1 38 GLN O O 9.601 7.011 11.411 1.00 . A A . 19 GLY O 1 1 3 798 1 1 39 ALA C C 8.755 4.349 11.784 1.00 . A A . 20 GLN C 1 1 3 799 1 1 39 ALA CA C 9.080 4.930 13.151 1.00 . A A . 20 GLN CA 1 1 3 800 1 1 39 ALA CB C 8.510 4.036 14.254 1.00 . A A . 20 GLN CB 1 1 3 801 1 1 39 ALA H H 7.951 6.501 14.006 1.00 . A A . 20 GLN H 1 1 3 802 1 1 39 ALA HA H 10.155 4.982 13.256 1.00 . A A . 20 GLN HA 1 1 3 803 1 1 39 ALA HB2 H 8.465 4.602 15.173 1.00 . A A . 20 GLN HB2 1 1 3 804 1 1 39 ALA HB3 H 7.510 3.736 13.978 1.00 . A A . 20 GLN HB3 1 1 3 805 1 1 39 ALA N N 8.552 6.280 13.263 1.00 . A A . 20 GLN N 1 1 3 806 1 1 39 ALA O O 9.658 4.042 11.005 1.00 . A A . 20 GLN O 1 1 3 807 1 1 40 PHE C C 7.458 4.593 9.044 1.00 . A A . 21 ALA C 1 1 3 808 1 1 40 PHE CA C 7.068 3.675 10.185 1.00 . A A . 21 ALA CA 1 1 3 809 1 1 40 PHE CB C 5.596 3.330 10.138 1.00 . A A . 21 ALA CB 1 1 3 810 1 1 40 PHE H H 6.778 4.480 12.125 1.00 . A A . 21 ALA H 1 1 3 811 1 1 40 PHE HA H 7.622 2.783 10.061 1.00 . A A . 21 ALA HA 1 1 3 812 1 1 40 PHE HB2 H 5.381 2.578 10.884 1.00 . A A . 21 ALA HB2 1 1 3 813 1 1 40 PHE HB3 H 5.353 2.944 9.159 1.00 . A A . 21 ALA HB3 1 1 3 814 1 1 40 PHE N N 7.464 4.209 11.479 1.00 . A A . 21 ALA N 1 1 3 815 1 1 40 PHE O O 7.326 4.247 7.870 1.00 . A A . 21 ALA O 1 1 3 816 1 1 41 GLN C C 9.705 6.113 7.794 1.00 . A A . 22 PHE C 1 1 3 817 1 1 41 GLN CA C 8.459 6.697 8.425 1.00 . A A . 22 PHE CA 1 1 3 818 1 1 41 GLN CB C 8.769 8.046 9.077 1.00 . A A . 22 PHE CB 1 1 3 819 1 1 41 GLN CG C 8.601 9.214 8.147 1.00 . A A . 22 PHE CG 1 1 3 820 1 1 41 GLN H H 8.093 5.914 10.345 1.00 . A A . 22 PHE H 1 1 3 821 1 1 41 GLN HA H 7.697 6.818 7.672 1.00 . A A . 22 PHE HA 1 1 3 822 1 1 41 GLN HB2 H 8.108 8.191 9.917 1.00 . A A . 22 PHE HB2 1 1 3 823 1 1 41 GLN HB3 H 9.791 8.042 9.426 1.00 . A A . 22 PHE HB3 1 1 3 824 1 1 41 GLN N N 7.985 5.737 9.403 1.00 . A A . 22 PHE N 1 1 3 825 1 1 41 GLN O O 9.902 6.168 6.580 1.00 . A A . 22 PHE O 1 1 3 826 1 1 42 GLU C C 11.371 3.491 7.590 1.00 . A A . 23 GLN C 1 1 3 827 1 1 42 GLU CA C 11.731 4.836 8.222 1.00 . A A . 23 GLN CA 1 1 3 828 1 1 42 GLU CB C 12.666 4.630 9.417 1.00 . A A . 23 GLN CB 1 1 3 829 1 1 42 GLU CD C 13.784 6.513 10.680 1.00 . A A . 23 GLN CD 1 1 3 830 1 1 42 GLU CG C 13.824 5.615 9.459 1.00 . A A . 23 GLN CG 1 1 3 831 1 1 42 GLU H H 10.270 5.475 9.602 1.00 . A A . 23 GLN H 1 1 3 832 1 1 42 GLU HA H 12.218 5.458 7.485 1.00 . A A . 23 GLN HA 1 1 3 833 1 1 42 GLU HB2 H 12.094 4.739 10.331 1.00 . A A . 23 GLN HB2 1 1 3 834 1 1 42 GLU HB3 H 13.073 3.631 9.375 1.00 . A A . 23 GLN HB3 1 1 3 835 1 1 42 GLU HG2 H 14.751 5.062 9.469 1.00 . A A . 23 GLN HG2 1 1 3 836 1 1 42 GLU HG3 H 13.786 6.233 8.574 1.00 . A A . 23 GLN HG3 1 1 3 837 1 1 42 GLU N N 10.517 5.503 8.651 1.00 . A A . 23 GLN N 1 1 3 838 1 1 42 GLU O O 12.137 2.933 6.805 1.00 . A A . 23 GLN O 1 1 3 839 1 1 42 GLU OE1 O 13.244 7.619 10.634 1.00 . A A . 23 GLN OE1 1 1 3 840 1 1 43 ARG C C 9.415 1.812 5.922 1.00 . A A . 24 GLU C 1 1 3 841 1 1 43 ARG CA C 9.698 1.712 7.417 1.00 . A A . 24 GLU CA 1 1 3 842 1 1 43 ARG CB C 8.429 1.280 8.151 1.00 . A A . 24 GLU CB 1 1 3 843 1 1 43 ARG CD C 9.612 -0.548 9.430 1.00 . A A . 24 GLU CD 1 1 3 844 1 1 43 ARG CG C 8.695 0.655 9.512 1.00 . A A . 24 GLU CG 1 1 3 845 1 1 43 ARG H H 9.622 3.478 8.567 1.00 . A A . 24 GLU H 1 1 3 846 1 1 43 ARG HA H 10.459 0.974 7.582 1.00 . A A . 24 GLU HA 1 1 3 847 1 1 43 ARG HB2 H 7.796 2.142 8.291 1.00 . A A . 24 GLU HB2 1 1 3 848 1 1 43 ARG HB3 H 7.905 0.556 7.544 1.00 . A A . 24 GLU HB3 1 1 3 849 1 1 43 ARG HG2 H 9.155 1.396 10.150 1.00 . A A . 24 GLU HG2 1 1 3 850 1 1 43 ARG HG3 H 7.754 0.346 9.942 1.00 . A A . 24 GLU HG3 1 1 3 851 1 1 43 ARG N N 10.184 2.982 7.941 1.00 . A A . 24 GLU N 1 1 3 852 1 1 43 ARG O O 9.894 0.998 5.133 1.00 . A A . 24 GLU O 1 1 3 853 1 1 44 TYR C C 9.513 3.151 3.273 1.00 . A A . 25 ARG C 1 1 3 854 1 1 44 TYR CA C 8.272 3.027 4.145 1.00 . A A . 25 ARG CA 1 1 3 855 1 1 44 TYR CB C 7.406 4.280 4.003 1.00 . A A . 25 ARG CB 1 1 3 856 1 1 44 TYR CG C 5.925 4.027 4.235 1.00 . A A . 25 ARG CG 1 1 3 857 1 1 44 TYR CZ C 2.981 4.596 5.268 1.00 . A A . 25 ARG CZ 1 1 3 858 1 1 44 TYR H H 8.276 3.427 6.223 1.00 . A A . 25 ARG H 1 1 3 859 1 1 44 TYR HA H 7.707 2.171 3.819 1.00 . A A . 25 ARG HA 1 1 3 860 1 1 44 TYR HB2 H 7.738 5.017 4.719 1.00 . A A . 25 ARG HB2 1 1 3 861 1 1 44 TYR HB3 H 7.529 4.679 3.006 1.00 . A A . 25 ARG HB3 1 1 3 862 1 1 44 TYR HD2 H 5.839 6.125 4.589 1.00 . A A . 25 ARG HD2 1 1 3 863 1 1 44 TYR N N 8.628 2.816 5.544 1.00 . A A . 25 ARG N 1 1 3 864 1 1 44 TYR O O 9.491 2.812 2.089 1.00 . A A . 25 ARG O 1 1 3 865 1 1 45 THR C C 12.465 2.446 2.821 1.00 . A A . 26 TYR C 1 1 3 866 1 1 45 THR CA C 11.848 3.801 3.145 1.00 . A A . 26 TYR CA 1 1 3 867 1 1 45 THR CB C 12.826 4.644 3.966 1.00 . A A . 26 TYR CB 1 1 3 868 1 1 45 THR H H 10.547 3.883 4.808 1.00 . A A . 26 TYR H 1 1 3 869 1 1 45 THR HA H 11.630 4.314 2.223 1.00 . A A . 26 TYR HA 1 1 3 870 1 1 45 THR N N 10.594 3.634 3.865 1.00 . A A . 26 TYR N 1 1 3 871 1 1 45 THR O O 12.913 2.207 1.699 1.00 . A A . 26 TYR O 1 1 3 872 1 1 46 ALA C C 12.059 -0.676 2.888 1.00 . A A . 27 THR C 1 1 3 873 1 1 46 ALA CA C 13.039 0.224 3.631 1.00 . A A . 27 THR CA 1 1 3 874 1 1 46 ALA CB C 13.390 -0.392 4.987 1.00 . A A . 27 THR CB 1 1 3 875 1 1 46 ALA H H 12.108 1.807 4.682 1.00 . A A . 27 THR H 1 1 3 876 1 1 46 ALA HA H 13.941 0.318 3.045 1.00 . A A . 27 THR HA 1 1 3 877 1 1 46 ALA N N 12.482 1.559 3.811 1.00 . A A . 27 THR N 1 1 3 878 1 1 46 ALA O O 12.462 -1.532 2.100 1.00 . A A . 27 THR O 1 1 3 879 1 1 47 GLY C C 9.714 -1.018 0.992 1.00 . A A . 28 ALA C 1 1 3 880 1 1 47 GLY CA C 9.733 -1.269 2.494 1.00 . A A . 28 ALA CA 1 1 3 881 1 1 47 GLY H H 10.508 0.221 3.778 1.00 . A A . 28 ALA H 1 1 3 882 1 1 47 GLY N N 10.769 -0.477 3.142 1.00 . A A . 28 ALA N 1 1 3 883 1 1 47 GLY O O 9.424 -1.918 0.204 1.00 . A A . 28 ALA O 1 1 3 884 1 1 48 ILE C C 11.239 -0.017 -1.535 1.00 . A A . 29 GLY C 1 1 3 885 1 1 48 ILE CA C 10.043 0.564 -0.806 1.00 . A A . 29 GLY CA 1 1 3 886 1 1 48 ILE H H 10.250 0.890 1.275 1.00 . A A . 29 GLY H 1 1 3 887 1 1 48 ILE N N 10.028 0.213 0.601 1.00 . A A . 29 GLY N 1 1 3 888 1 1 48 ILE O O 11.085 -0.702 -2.546 1.00 . A A . 29 GLY O 1 1 3 889 1 1 49 ASN C C 13.703 -1.770 -1.595 1.00 . A A . 30 ILE C 1 1 3 890 1 1 49 ASN CA C 13.659 -0.246 -1.629 1.00 . A A . 30 ILE CA 1 1 3 891 1 1 49 ASN CB C 14.911 0.313 -0.924 1.00 . A A . 30 ILE CB 1 1 3 892 1 1 49 ASN H H 12.493 0.807 -0.211 1.00 . A A . 30 ILE H 1 1 3 893 1 1 49 ASN HA H 13.675 0.081 -2.659 1.00 . A A . 30 ILE HA 1 1 3 894 1 1 49 ASN N N 12.434 0.256 -1.019 1.00 . A A . 30 ILE N 1 1 3 895 1 1 49 ASN O O 14.294 -2.403 -2.470 1.00 . A A . 30 ILE O 1 1 3 896 1 1 50 SER C C 12.432 -4.459 -1.673 1.00 . A A . 31 ASN C 1 1 3 897 1 1 50 SER CA C 13.039 -3.807 -0.436 1.00 . A A . 31 ASN CA 1 1 3 898 1 1 50 SER CB C 12.239 -4.199 0.810 1.00 . A A . 31 ASN CB 1 1 3 899 1 1 50 SER H H 12.618 -1.798 0.086 1.00 . A A . 31 ASN H 1 1 3 900 1 1 50 SER HA H 14.057 -4.153 -0.325 1.00 . A A . 31 ASN HA 1 1 3 901 1 1 50 SER HB2 H 11.622 -3.366 1.109 1.00 . A A . 31 ASN HB2 1 1 3 902 1 1 50 SER HB3 H 11.609 -5.044 0.574 1.00 . A A . 31 ASN HB3 1 1 3 903 1 1 50 SER N N 13.073 -2.355 -0.580 1.00 . A A . 31 ASN N 1 1 3 904 1 1 50 SER O O 13.056 -5.306 -2.311 1.00 . A A . 31 ASN O 1 1 3 905 1 1 51 PHE C C 11.309 -4.298 -4.450 1.00 . A A . 32 SER C 1 1 3 906 1 1 51 PHE CA C 10.524 -4.595 -3.176 1.00 . A A . 32 SER CA 1 1 3 907 1 1 51 PHE CB C 9.115 -4.008 -3.283 1.00 . A A . 32 SER CB 1 1 3 908 1 1 51 PHE H H 10.766 -3.372 -1.467 1.00 . A A . 32 SER H 1 1 3 909 1 1 51 PHE HA H 10.453 -5.664 -3.052 1.00 . A A . 32 SER HA 1 1 3 910 1 1 51 PHE HB2 H 8.530 -4.325 -2.430 1.00 . A A . 32 SER HB2 1 1 3 911 1 1 51 PHE HB3 H 9.177 -2.930 -3.295 1.00 . A A . 32 SER HB3 1 1 3 912 1 1 51 PHE N N 11.212 -4.053 -2.011 1.00 . A A . 32 SER N 1 1 3 913 1 1 51 PHE O O 11.302 -5.086 -5.396 1.00 . A A . 32 SER O 1 1 3 914 1 1 52 VAL C C 13.923 -3.730 -5.858 1.00 . A A . 33 PHE C 1 1 3 915 1 1 52 VAL CA C 12.780 -2.750 -5.617 1.00 . A A . 33 PHE CA 1 1 3 916 1 1 52 VAL CB C 13.333 -1.338 -5.413 1.00 . A A . 33 PHE CB 1 1 3 917 1 1 52 VAL H H 11.954 -2.570 -3.679 1.00 . A A . 33 PHE H 1 1 3 918 1 1 52 VAL HA H 12.132 -2.752 -6.481 1.00 . A A . 33 PHE HA 1 1 3 919 1 1 52 VAL N N 11.986 -3.155 -4.464 1.00 . A A . 33 PHE N 1 1 3 920 1 1 52 VAL O O 14.071 -4.271 -6.955 1.00 . A A . 33 PHE O 1 1 3 921 1 1 53 SER C C 15.404 -6.248 -5.404 1.00 . A A . 34 VAL C 1 1 3 922 1 1 53 SER CA C 15.857 -4.876 -4.923 1.00 . A A . 34 VAL CA 1 1 3 923 1 1 53 SER CB C 16.586 -5.019 -3.571 1.00 . A A . 34 VAL CB 1 1 3 924 1 1 53 SER H H 14.556 -3.500 -3.976 1.00 . A A . 34 VAL H 1 1 3 925 1 1 53 SER HA H 16.553 -4.469 -5.644 1.00 . A A . 34 VAL HA 1 1 3 926 1 1 53 SER N N 14.728 -3.958 -4.824 1.00 . A A . 34 VAL N 1 1 3 927 1 1 53 SER O O 15.659 -6.622 -6.544 1.00 . A A . 34 VAL O 1 1 3 928 1 1 54 GLY C C 13.566 -8.378 -6.189 1.00 . A A . 35 SER C 1 1 3 929 1 1 54 GLY CA C 14.291 -8.339 -4.868 1.00 . A A . 35 SER CA 1 1 3 930 1 1 54 GLY H H 14.602 -6.682 -3.629 1.00 . A A . 35 SER H 1 1 3 931 1 1 54 GLY N N 14.748 -7.007 -4.531 1.00 . A A . 35 SER N 1 1 3 932 1 1 54 GLY O O 13.961 -9.125 -7.083 1.00 . A A . 35 SER O 1 1 3 933 1 1 55 VAL C C 12.789 -7.789 -8.736 1.00 . A A . 36 GLY C 1 1 3 934 1 1 55 VAL CA C 11.817 -7.561 -7.597 1.00 . A A . 36 GLY CA 1 1 3 935 1 1 55 VAL H H 12.266 -6.991 -5.599 1.00 . A A . 36 GLY H 1 1 3 936 1 1 55 VAL N N 12.529 -7.576 -6.335 1.00 . A A . 36 GLY N 1 1 3 937 1 1 55 VAL O O 12.545 -8.589 -9.639 1.00 . A A . 36 GLY O 1 1 3 938 1 1 56 ALA C C 16.013 -8.279 -9.208 1.00 . A A . 37 VAL C 1 1 3 939 1 1 56 ALA CA C 14.988 -7.212 -9.609 1.00 . A A . 37 VAL CA 1 1 3 940 1 1 56 ALA CB C 15.710 -5.862 -9.797 1.00 . A A . 37 VAL CB 1 1 3 941 1 1 56 ALA H H 14.057 -6.508 -7.881 1.00 . A A . 37 VAL H 1 1 3 942 1 1 56 ALA HA H 14.547 -7.489 -10.547 1.00 . A A . 37 VAL HA 1 1 3 943 1 1 56 ALA N N 13.922 -7.095 -8.646 1.00 . A A . 37 VAL N 1 1 3 944 1 1 56 ALA O O 16.132 -9.323 -9.850 1.00 . A A . 37 VAL O 1 1 3 945 1 1 57 SER C C 17.368 -9.932 -6.726 1.00 . A A . 38 ALA C 1 1 3 946 1 1 57 SER CA C 17.841 -8.834 -7.666 1.00 . A A . 38 ALA CA 1 1 3 947 1 1 57 SER CB C 18.908 -7.999 -6.968 1.00 . A A . 38 ALA CB 1 1 3 948 1 1 57 SER H H 16.639 -7.118 -7.704 1.00 . A A . 38 ALA H 1 1 3 949 1 1 57 SER HA H 18.295 -9.288 -8.523 1.00 . A A . 38 ALA HA 1 1 3 950 1 1 57 SER HB2 H 19.886 -8.349 -7.260 1.00 . A A . 38 ALA HB2 1 1 3 951 1 1 57 SER HB3 H 18.797 -8.094 -5.890 1.00 . A A . 38 ALA HB3 1 1 3 952 1 1 57 SER N N 16.782 -7.968 -8.158 1.00 . A A . 38 ALA N 1 1 3 953 1 1 57 SER O O 17.339 -11.114 -7.070 1.00 . A A . 38 ALA O 1 1 3 954 1 1 58 GLY C C 15.341 -11.128 -4.685 1.00 . A A . 39 SER C 1 1 3 955 1 1 58 GLY CA C 16.663 -10.393 -4.428 1.00 . A A . 39 SER CA 1 1 3 956 1 1 58 GLY H H 17.159 -8.552 -5.311 1.00 . A A . 39 SER H 1 1 3 957 1 1 58 GLY N N 17.066 -9.508 -5.507 1.00 . A A . 39 SER N 1 1 3 958 1 1 58 GLY O O 14.805 -11.774 -3.784 1.00 . A A . 39 SER O 1 1 3 959 1 1 59 ALA C C 13.551 -12.239 -7.649 1.00 . A A . 40 GLY C 1 1 3 960 1 1 59 ALA CA C 13.572 -11.705 -6.230 1.00 . A A . 40 GLY CA 1 1 3 961 1 1 59 ALA H H 15.276 -10.511 -6.592 1.00 . A A . 40 GLY H 1 1 3 962 1 1 59 ALA N N 14.818 -11.035 -5.906 1.00 . A A . 40 GLY N 1 1 3 963 1 1 59 ALA O O 13.517 -13.450 -7.864 1.00 . A A . 40 GLY O 1 1 3 964 1 1 60 GLY C C 12.341 -12.588 -10.346 1.00 . A A . 41 ALA C 1 1 3 965 1 1 60 GLY CA C 13.551 -11.715 -10.028 1.00 . A A . 41 ALA CA 1 1 3 966 1 1 60 GLY H H 13.596 -10.381 -8.386 1.00 . A A . 41 ALA H 1 1 3 967 1 1 60 GLY N N 13.569 -11.331 -8.620 1.00 . A A . 41 ALA N 1 1 3 968 1 1 60 GLY O O 12.396 -13.443 -11.229 1.00 . A A . 41 ALA O 1 1 3 969 1 1 61 SER C C 10.255 -14.625 -9.618 1.00 . A A . 42 GLY C 1 1 3 970 1 1 61 SER CA C 10.043 -13.141 -9.840 1.00 . A A . 42 GLY CA 1 1 3 971 1 1 61 SER H H 11.266 -11.672 -8.929 1.00 . A A . 42 GLY H 1 1 3 972 1 1 61 SER N N 11.250 -12.367 -9.620 1.00 . A A . 42 GLY N 1 1 3 973 1 1 61 SER O O 10.024 -15.434 -10.517 1.00 . A A . 42 GLY O 1 1 3 974 1 1 62 ILE C C 9.633 -17.129 -7.851 1.00 . A A . 43 SER C 1 1 3 975 1 1 62 ILE CA C 10.943 -16.383 -8.079 1.00 . A A . 43 SER CA 1 1 3 976 1 1 62 ILE CB C 11.825 -16.482 -6.834 1.00 . A A . 43 SER CB 1 1 3 977 1 1 62 ILE H H 10.864 -14.294 -7.742 1.00 . A A . 43 SER H 1 1 3 978 1 1 62 ILE HA H 11.456 -16.836 -8.910 1.00 . A A . 43 SER HA 1 1 3 979 1 1 62 ILE N N 10.697 -14.985 -8.417 1.00 . A A . 43 SER N 1 1 3 980 1 1 62 ILE O O 9.559 -18.345 -8.029 1.00 . A A . 43 SER O 1 1 3 981 1 1 63 GLY C C 6.210 -15.906 -7.148 1.00 . A A . 44 ILE C 1 1 3 982 1 1 63 GLY CA C 7.295 -16.979 -7.198 1.00 . A A . 44 ILE CA 1 1 3 983 1 1 63 GLY H H 8.729 -15.431 -7.330 1.00 . A A . 44 ILE H 1 1 3 984 1 1 63 GLY N N 8.604 -16.392 -7.455 1.00 . A A . 44 ILE N 1 1 3 985 1 1 63 GLY O O 5.431 -15.837 -6.196 1.00 . A A . 44 ILE O 1 1 3 986 1 1 64 ARG C C 5.800 -12.636 -8.376 1.00 . A A . 45 GLY C 1 1 3 987 1 1 64 ARG CA C 5.174 -14.009 -8.233 1.00 . A A . 45 GLY CA 1 1 3 988 1 1 64 ARG H H 6.811 -15.170 -8.909 1.00 . A A . 45 GLY H 1 1 3 989 1 1 64 ARG N N 6.165 -15.068 -8.179 1.00 . A A . 45 GLY N 1 1 3 990 1 1 64 ARG O O 5.816 -12.063 -9.465 1.00 . A A . 45 GLY O 1 1 4 991 1 1 20 ASN C C -16.083 -4.815 14.576 1.00 . A A . 1 VAL C 1 1 4 992 1 1 20 ASN CA C -15.424 -6.191 14.563 1.00 . A A . 1 VAL CA 1 1 4 993 1 1 20 ASN CB C -13.962 -6.050 14.095 1.00 . A A . 1 VAL CB 1 1 4 994 1 1 20 ASN H H -16.577 -6.789 12.891 1.00 . A A . 1 VAL H 1 1 4 995 1 1 20 ASN HA H -15.421 -6.587 15.568 1.00 . A A . 1 VAL HA 1 1 4 996 1 1 20 ASN N N -16.165 -7.120 13.717 1.00 . A A . 1 VAL N 1 1 4 997 1 1 20 ASN O O -16.618 -4.362 13.563 1.00 . A A . 1 VAL O 1 1 4 998 1 1 21 TYR C C -15.919 -2.029 16.957 1.00 . A A . 2 ASN C 1 1 4 999 1 1 21 TYR CA C -16.634 -2.831 15.873 1.00 . A A . 2 ASN CA 1 1 4 1000 1 1 21 TYR CB C -18.123 -2.949 16.204 1.00 . A A . 2 ASN CB 1 1 4 1001 1 1 21 TYR CG C -18.919 -1.748 15.731 1.00 . A A . 2 ASN CG 1 1 4 1002 1 1 21 TYR H H -15.600 -4.568 16.500 1.00 . A A . 2 ASN H 1 1 4 1003 1 1 21 TYR HA H -16.525 -2.315 14.930 1.00 . A A . 2 ASN HA 1 1 4 1004 1 1 21 TYR HB2 H -18.522 -3.832 15.729 1.00 . A A . 2 ASN HB2 1 1 4 1005 1 1 21 TYR HB3 H -18.241 -3.037 17.275 1.00 . A A . 2 ASN HB3 1 1 4 1006 1 1 21 TYR N N -16.041 -4.154 15.728 1.00 . A A . 2 ASN N 1 1 4 1007 1 1 21 TYR O O -16.531 -1.604 17.937 1.00 . A A . 2 ASN O 1 1 4 1008 1 1 22 GLY C C -13.846 -1.745 19.106 1.00 . A A . 3 TYR C 1 1 4 1009 1 1 22 GLY CA C -13.819 -1.075 17.735 1.00 . A A . 3 TYR CA 1 1 4 1010 1 1 22 GLY H H -14.186 -2.189 15.973 1.00 . A A . 3 TYR H 1 1 4 1011 1 1 22 GLY N N -14.618 -1.826 16.774 1.00 . A A . 3 TYR N 1 1 4 1012 1 1 22 GLY O O -14.584 -1.328 19.999 1.00 . A A . 3 TYR O 1 1 4 1013 1 1 23 ASN C C -11.859 -3.010 21.422 1.00 . A A . 4 GLY C 1 1 4 1014 1 1 23 ASN CA C -12.983 -3.498 20.529 1.00 . A A . 4 GLY CA 1 1 4 1015 1 1 23 ASN H H -12.471 -3.076 18.519 1.00 . A A . 4 GLY H 1 1 4 1016 1 1 23 ASN N N -13.036 -2.788 19.266 1.00 . A A . 4 GLY N 1 1 4 1017 1 1 23 ASN O O -11.970 -1.958 22.051 1.00 . A A . 4 GLY O 1 1 4 1018 1 1 24 GLY C C -8.481 -2.878 21.440 1.00 . A A . 5 ASN C 1 1 4 1019 1 1 24 GLY CA C -9.624 -3.413 22.298 1.00 . A A . 5 ASN CA 1 1 4 1020 1 1 24 GLY H H -10.744 -4.602 20.950 1.00 . A A . 5 ASN H 1 1 4 1021 1 1 24 GLY N N -10.773 -3.774 21.476 1.00 . A A . 5 ASN N 1 1 4 1022 1 1 24 GLY O O -7.597 -2.179 21.934 1.00 . A A . 5 ASN O 1 1 4 1023 1 1 25 VAL C C -7.143 -3.773 18.175 1.00 . A A . 6 GLY C 1 1 4 1024 1 1 25 VAL CA C -7.466 -2.755 19.250 1.00 . A A . 6 GLY CA 1 1 4 1025 1 1 25 VAL H H -9.234 -3.770 19.816 1.00 . A A . 6 GLY H 1 1 4 1026 1 1 25 VAL N N -8.505 -3.211 20.155 1.00 . A A . 6 GLY N 1 1 4 1027 1 1 25 VAL O O -5.974 -4.035 17.894 1.00 . A A . 6 GLY O 1 1 4 1028 1 1 26 SER C C -6.903 -6.330 16.827 1.00 . A A . 7 VAL C 1 1 4 1029 1 1 26 SER CA C -8.032 -5.343 16.516 1.00 . A A . 7 VAL CA 1 1 4 1030 1 1 26 SER CB C -7.803 -4.667 15.140 1.00 . A A . 7 VAL CB 1 1 4 1031 1 1 26 SER H H -9.091 -4.085 17.846 1.00 . A A . 7 VAL H 1 1 4 1032 1 1 26 SER HA H -8.957 -5.899 16.459 1.00 . A A . 7 VAL HA 1 1 4 1033 1 1 26 SER N N -8.186 -4.346 17.573 1.00 . A A . 7 VAL N 1 1 4 1034 1 1 26 SER O O -6.474 -6.457 17.974 1.00 . A A . 7 VAL O 1 1 4 1035 1 1 27 CYS C C -4.374 -7.917 14.795 1.00 . A A . 8 SER C 1 1 4 1036 1 1 27 CYS CA C -5.357 -7.996 15.958 1.00 . A A . 8 SER CA 1 1 4 1037 1 1 27 CYS CB C -5.934 -9.409 16.059 1.00 . A A . 8 SER CB 1 1 4 1038 1 1 27 CYS H H -6.815 -6.874 14.912 1.00 . A A . 8 SER H 1 1 4 1039 1 1 27 CYS HA H -4.833 -7.764 16.873 1.00 . A A . 8 SER HA 1 1 4 1040 1 1 27 CYS HB2 H -6.758 -9.510 15.369 1.00 . A A . 8 SER HB2 1 1 4 1041 1 1 27 CYS HB3 H -5.166 -10.128 15.810 1.00 . A A . 8 SER HB3 1 1 4 1042 1 1 27 CYS N N -6.431 -7.023 15.799 1.00 . A A . 8 SER N 1 1 4 1043 1 1 27 CYS O O -4.745 -8.124 13.640 1.00 . A A . 8 SER O 1 1 4 1044 1 1 28 SER C C -2.084 -8.704 13.148 1.00 . A A . 9 CYS C 1 1 4 1045 1 1 28 SER CA C -2.076 -7.499 14.086 1.00 . A A . 9 CYS CA 1 1 4 1046 1 1 28 SER CB C -0.691 -7.364 14.725 1.00 . A A . 9 CYS CB 1 1 4 1047 1 1 28 SER H H -2.885 -7.451 16.045 1.00 . A A . 9 CYS H 1 1 4 1048 1 1 28 SER HA H -2.277 -6.608 13.508 1.00 . A A . 9 CYS HA 1 1 4 1049 1 1 28 SER HB2 H 0.054 -7.696 14.020 1.00 . A A . 9 CYS HB2 1 1 4 1050 1 1 28 SER HB3 H -0.515 -6.326 14.959 1.00 . A A . 9 CYS HB3 1 1 4 1051 1 1 28 SER N N -3.117 -7.610 15.107 1.00 . A A . 9 CYS N 1 1 4 1052 1 1 28 SER O O -2.816 -9.670 13.365 1.00 . A A . 9 CYS O 1 1 4 1053 1 1 29 LYS C C 0.075 -9.528 10.256 1.00 . A A . 10 SER C 1 1 4 1054 1 1 29 LYS CA C -1.154 -9.717 11.137 1.00 . A A . 10 SER CA 1 1 4 1055 1 1 29 LYS CB C -2.409 -9.784 10.269 1.00 . A A . 10 SER CB 1 1 4 1056 1 1 29 LYS H H -0.698 -7.840 11.998 1.00 . A A . 10 SER H 1 1 4 1057 1 1 29 LYS HA H -1.052 -10.644 11.680 1.00 . A A . 10 SER HA 1 1 4 1058 1 1 29 LYS HB2 H -2.203 -10.384 9.396 1.00 . A A . 10 SER HB2 1 1 4 1059 1 1 29 LYS HB3 H -3.210 -10.236 10.834 1.00 . A A . 10 SER HB3 1 1 4 1060 1 1 29 LYS N N -1.258 -8.637 12.110 1.00 . A A . 10 SER N 1 1 4 1061 1 1 29 LYS O O 0.132 -8.607 9.441 1.00 . A A . 10 SER O 1 1 4 1062 1 1 30 THR C C 3.034 -9.029 9.869 1.00 . A A . 11 LYS C 1 1 4 1063 1 1 30 THR CA C 2.289 -10.345 9.654 1.00 . A A . 11 LYS CA 1 1 4 1064 1 1 30 THR CB C 1.967 -10.521 8.178 1.00 . A A . 11 LYS CB 1 1 4 1065 1 1 30 THR H H 0.943 -11.117 11.085 1.00 . A A . 11 LYS H 1 1 4 1066 1 1 30 THR HA H 2.920 -11.153 9.972 1.00 . A A . 11 LYS HA 1 1 4 1067 1 1 30 THR N N 1.055 -10.407 10.428 1.00 . A A . 11 LYS N 1 1 4 1068 1 1 30 THR O O 4.035 -8.758 9.207 1.00 . A A . 11 LYS O 1 1 4 1069 1 1 31 LYS C C 2.887 -6.535 12.542 1.00 . A A . 12 THR C 1 1 4 1070 1 1 31 LYS CA C 3.156 -6.934 11.090 1.00 . A A . 12 THR CA 1 1 4 1071 1 1 31 LYS CB C 2.628 -5.883 10.107 1.00 . A A . 12 THR CB 1 1 4 1072 1 1 31 LYS H H 1.750 -8.479 11.287 1.00 . A A . 12 THR H 1 1 4 1073 1 1 31 LYS HA H 4.215 -7.042 10.954 1.00 . A A . 12 THR HA 1 1 4 1074 1 1 31 LYS N N 2.542 -8.215 10.794 1.00 . A A . 12 THR N 1 1 4 1075 1 1 31 LYS O O 2.025 -7.113 13.203 1.00 . A A . 12 THR O 1 1 4 1076 1 1 32 CYS C C 2.008 -4.711 14.689 1.00 . A A . 13 LYS C 1 1 4 1077 1 1 32 CYS CA C 3.464 -5.073 14.404 1.00 . A A . 13 LYS CA 1 1 4 1078 1 1 32 CYS CB C 4.366 -3.862 14.658 1.00 . A A . 13 LYS CB 1 1 4 1079 1 1 32 CYS H H 4.302 -5.122 12.458 1.00 . A A . 13 LYS H 1 1 4 1080 1 1 32 CYS HA H 3.759 -5.874 15.065 1.00 . A A . 13 LYS HA 1 1 4 1081 1 1 32 CYS HB2 H 5.016 -3.727 13.807 1.00 . A A . 13 LYS HB2 1 1 4 1082 1 1 32 CYS HB3 H 3.748 -2.983 14.772 1.00 . A A . 13 LYS HB3 1 1 4 1083 1 1 32 CYS N N 3.629 -5.546 13.032 1.00 . A A . 13 LYS N 1 1 4 1084 1 1 32 CYS O O 1.255 -4.362 13.780 1.00 . A A . 13 LYS O 1 1 4 1085 1 1 33 SER C C 0.173 -3.081 16.958 1.00 . A A . 14 CYS C 1 1 4 1086 1 1 33 SER CA C 0.251 -4.485 16.364 1.00 . A A . 14 CYS CA 1 1 4 1087 1 1 33 SER CB C -0.268 -5.509 17.385 1.00 . A A . 14 CYS CB 1 1 4 1088 1 1 33 SER H H 2.264 -5.087 16.637 1.00 . A A . 14 CYS H 1 1 4 1089 1 1 33 SER HA H -0.374 -4.523 15.481 1.00 . A A . 14 CYS HA 1 1 4 1090 1 1 33 SER HB2 H -0.213 -5.078 18.373 1.00 . A A . 14 CYS HB2 1 1 4 1091 1 1 33 SER HB3 H -1.300 -5.737 17.158 1.00 . A A . 14 CYS HB3 1 1 4 1092 1 1 33 SER N N 1.618 -4.801 15.958 1.00 . A A . 14 CYS N 1 1 4 1093 1 1 33 SER O O -0.566 -2.844 17.914 1.00 . A A . 14 CYS O 1 1 4 1094 1 1 34 VAL C C 1.055 0.210 15.716 1.00 . A A . 15 SER C 1 1 4 1095 1 1 34 VAL CA C 0.955 -0.779 16.874 1.00 . A A . 15 SER CA 1 1 4 1096 1 1 34 VAL CB C 2.122 -0.568 17.842 1.00 . A A . 15 SER CB 1 1 4 1097 1 1 34 VAL H H 1.510 -2.404 15.635 1.00 . A A . 15 SER H 1 1 4 1098 1 1 34 VAL HA H 0.029 -0.603 17.400 1.00 . A A . 15 SER HA 1 1 4 1099 1 1 34 VAL N N 0.941 -2.155 16.392 1.00 . A A . 15 SER N 1 1 4 1100 1 1 34 VAL O O 1.655 -0.087 14.682 1.00 . A A . 15 SER O 1 1 4 1101 1 1 35 ASN C C 1.636 3.402 15.111 1.00 . A A . 16 VAL C 1 1 4 1102 1 1 35 ASN CA C 0.487 2.424 14.874 1.00 . A A . 16 VAL CA 1 1 4 1103 1 1 35 ASN CB C -0.845 3.199 14.834 1.00 . A A . 16 VAL CB 1 1 4 1104 1 1 35 ASN H H 0.005 1.563 16.746 1.00 . A A . 16 VAL H 1 1 4 1105 1 1 35 ASN HA H 0.629 1.943 13.917 1.00 . A A . 16 VAL HA 1 1 4 1106 1 1 35 ASN N N 0.465 1.386 15.899 1.00 . A A . 16 VAL N 1 1 4 1107 1 1 35 ASN O O 2.163 3.494 16.220 1.00 . A A . 16 VAL O 1 1 4 1108 1 1 36 TRP C C 3.327 5.799 12.829 1.00 . A A . 17 ASN C 1 1 4 1109 1 1 36 TRP CA C 3.105 5.096 14.165 1.00 . A A . 17 ASN CA 1 1 4 1110 1 1 36 TRP CB C 4.396 4.405 14.615 1.00 . A A . 17 ASN CB 1 1 4 1111 1 1 36 TRP CG C 5.012 5.067 15.833 1.00 . A A . 17 ASN CG 1 1 4 1112 1 1 36 TRP H H 1.562 4.012 13.208 1.00 . A A . 17 ASN H 1 1 4 1113 1 1 36 TRP HA H 2.826 5.833 14.903 1.00 . A A . 17 ASN HA 1 1 4 1114 1 1 36 TRP HB2 H 4.179 3.376 14.860 1.00 . A A . 17 ASN HB2 1 1 4 1115 1 1 36 TRP HB3 H 5.115 4.435 13.810 1.00 . A A . 17 ASN HB3 1 1 4 1116 1 1 36 TRP N N 2.019 4.128 14.066 1.00 . A A . 17 ASN N 1 1 4 1117 1 1 36 TRP O O 3.993 5.268 11.941 1.00 . A A . 17 ASN O 1 1 4 1118 1 1 37 GLY C C 4.295 8.365 11.321 1.00 . A A . 18 TRP C 1 1 4 1119 1 1 37 GLY CA C 2.894 7.770 11.469 1.00 . A A . 18 TRP CA 1 1 4 1120 1 1 37 GLY H H 2.241 7.359 13.436 1.00 . A A . 18 TRP H 1 1 4 1121 1 1 37 GLY N N 2.762 6.994 12.696 1.00 . A A . 18 TRP N 1 1 4 1122 1 1 37 GLY O O 4.597 9.007 10.316 1.00 . A A . 18 TRP O 1 1 4 1123 1 1 38 GLN C C 7.533 7.556 12.203 1.00 . A A . 19 GLY C 1 1 4 1124 1 1 38 GLN CA C 6.505 8.668 12.261 1.00 . A A . 19 GLY CA 1 1 4 1125 1 1 38 GLN H H 4.863 7.630 13.097 1.00 . A A . 19 GLY H 1 1 4 1126 1 1 38 GLN N N 5.150 8.149 12.319 1.00 . A A . 19 GLY N 1 1 4 1127 1 1 38 GLN O O 8.400 7.537 11.326 1.00 . A A . 19 GLY O 1 1 4 1128 1 1 39 ALA C C 8.292 4.704 11.880 1.00 . A A . 20 GLN C 1 1 4 1129 1 1 39 ALA CA C 8.354 5.493 13.180 1.00 . A A . 20 GLN CA 1 1 4 1130 1 1 39 ALA CB C 8.030 4.583 14.367 1.00 . A A . 20 GLN CB 1 1 4 1131 1 1 39 ALA H H 6.717 6.679 13.803 1.00 . A A . 20 GLN H 1 1 4 1132 1 1 39 ALA HA H 9.353 5.887 13.296 1.00 . A A . 20 GLN HA 1 1 4 1133 1 1 39 ALA HB2 H 7.692 5.193 15.191 1.00 . A A . 20 GLN HB2 1 1 4 1134 1 1 39 ALA HB3 H 7.237 3.907 14.082 1.00 . A A . 20 GLN HB3 1 1 4 1135 1 1 39 ALA N N 7.431 6.617 13.135 1.00 . A A . 20 GLN N 1 1 4 1136 1 1 39 ALA O O 9.259 4.680 11.118 1.00 . A A . 20 GLN O 1 1 4 1137 1 1 40 PHE C C 7.049 4.151 9.150 1.00 . A A . 21 ALA C 1 1 4 1138 1 1 40 PHE CA C 7.007 3.286 10.393 1.00 . A A . 21 ALA CA 1 1 4 1139 1 1 40 PHE CB C 5.767 2.415 10.418 1.00 . A A . 21 ALA CB 1 1 4 1140 1 1 40 PHE H H 6.408 4.114 12.252 1.00 . A A . 21 ALA H 1 1 4 1141 1 1 40 PHE HA H 7.855 2.654 10.350 1.00 . A A . 21 ALA HA 1 1 4 1142 1 1 40 PHE HB2 H 5.521 2.166 11.438 1.00 . A A . 21 ALA HB2 1 1 4 1143 1 1 40 PHE HB3 H 5.964 1.508 9.861 1.00 . A A . 21 ALA HB3 1 1 4 1144 1 1 40 PHE N N 7.154 4.061 11.618 1.00 . A A . 21 ALA N 1 1 4 1145 1 1 40 PHE O O 7.046 3.651 8.025 1.00 . A A . 21 ALA O 1 1 4 1146 1 1 41 GLN C C 8.648 6.230 7.693 1.00 . A A . 22 PHE C 1 1 4 1147 1 1 41 GLN CA C 7.255 6.380 8.261 1.00 . A A . 22 PHE CA 1 1 4 1148 1 1 41 GLN CB C 7.014 7.818 8.722 1.00 . A A . 22 PHE CB 1 1 4 1149 1 1 41 GLN CG C 7.025 8.818 7.600 1.00 . A A . 22 PHE CG 1 1 4 1150 1 1 41 GLN H H 7.185 5.754 10.270 1.00 . A A . 22 PHE H 1 1 4 1151 1 1 41 GLN HA H 6.530 6.109 7.511 1.00 . A A . 22 PHE HA 1 1 4 1152 1 1 41 GLN HB2 H 6.055 7.876 9.209 1.00 . A A . 22 PHE HB2 1 1 4 1153 1 1 41 GLN HB3 H 7.786 8.098 9.422 1.00 . A A . 22 PHE HB3 1 1 4 1154 1 1 41 GLN N N 7.144 5.441 9.360 1.00 . A A . 22 PHE N 1 1 4 1155 1 1 41 GLN O O 8.852 6.186 6.479 1.00 . A A . 22 PHE O 1 1 4 1156 1 1 42 GLU C C 11.158 4.445 7.745 1.00 . A A . 23 GLN C 1 1 4 1157 1 1 42 GLU CA C 10.989 5.879 8.248 1.00 . A A . 23 GLN CA 1 1 4 1158 1 1 42 GLU CB C 11.890 6.128 9.462 1.00 . A A . 23 GLN CB 1 1 4 1159 1 1 42 GLU CD C 13.941 7.392 8.699 1.00 . A A . 23 GLN CD 1 1 4 1160 1 1 42 GLU CG C 12.609 7.466 9.420 1.00 . A A . 23 GLN CG 1 1 4 1161 1 1 42 GLU H H 9.353 6.104 9.560 1.00 . A A . 23 GLN H 1 1 4 1162 1 1 42 GLU HA H 11.246 6.568 7.458 1.00 . A A . 23 GLN HA 1 1 4 1163 1 1 42 GLU HB2 H 11.284 6.096 10.360 1.00 . A A . 23 GLN HB2 1 1 4 1164 1 1 42 GLU HB3 H 12.634 5.346 9.512 1.00 . A A . 23 GLN HB3 1 1 4 1165 1 1 42 GLU HG2 H 11.981 8.182 8.909 1.00 . A A . 23 GLN HG2 1 1 4 1166 1 1 42 GLU HG3 H 12.783 7.800 10.432 1.00 . A A . 23 GLN HG3 1 1 4 1167 1 1 42 GLU N N 9.601 6.095 8.608 1.00 . A A . 23 GLN N 1 1 4 1168 1 1 42 GLU O O 12.094 4.136 7.008 1.00 . A A . 23 GLN O 1 1 4 1169 1 1 42 GLU OE1 O 15.000 7.392 9.326 1.00 . A A . 23 GLN OE1 1 1 4 1170 1 1 43 ARG C C 9.963 2.037 6.255 1.00 . A A . 24 GLU C 1 1 4 1171 1 1 43 ARG CA C 10.243 2.174 7.747 1.00 . A A . 24 GLU CA 1 1 4 1172 1 1 43 ARG CB C 9.206 1.376 8.541 1.00 . A A . 24 GLU CB 1 1 4 1173 1 1 43 ARG CD C 10.928 0.189 9.956 1.00 . A A . 24 GLU CD 1 1 4 1174 1 1 43 ARG CG C 9.660 1.019 9.947 1.00 . A A . 24 GLU CG 1 1 4 1175 1 1 43 ARG H H 9.504 3.887 8.732 1.00 . A A . 24 GLU H 1 1 4 1176 1 1 43 ARG HA H 11.218 1.780 7.961 1.00 . A A . 24 GLU HA 1 1 4 1177 1 1 43 ARG HB2 H 8.300 1.957 8.613 1.00 . A A . 24 GLU HB2 1 1 4 1178 1 1 43 ARG HB3 H 8.993 0.459 8.011 1.00 . A A . 24 GLU HB3 1 1 4 1179 1 1 43 ARG HG2 H 9.840 1.931 10.496 1.00 . A A . 24 GLU HG2 1 1 4 1180 1 1 43 ARG HG3 H 8.875 0.458 10.432 1.00 . A A . 24 GLU HG3 1 1 4 1181 1 1 43 ARG N N 10.225 3.574 8.151 1.00 . A A . 24 GLU N 1 1 4 1182 1 1 43 ARG O O 10.524 1.171 5.584 1.00 . A A . 24 GLU O 1 1 4 1183 1 1 44 TYR C C 9.964 2.966 3.444 1.00 . A A . 25 ARG C 1 1 4 1184 1 1 44 TYR CA C 8.727 2.881 4.330 1.00 . A A . 25 ARG CA 1 1 4 1185 1 1 44 TYR CB C 7.772 4.033 4.013 1.00 . A A . 25 ARG CB 1 1 4 1186 1 1 44 TYR CG C 6.308 3.687 4.237 1.00 . A A . 25 ARG CG 1 1 4 1187 1 1 44 TYR CZ C 4.038 5.071 6.008 1.00 . A A . 25 ARG CZ 1 1 4 1188 1 1 44 TYR H H 8.676 3.566 6.333 1.00 . A A . 25 ARG H 1 1 4 1189 1 1 44 TYR HA H 8.228 1.948 4.134 1.00 . A A . 25 ARG HA 1 1 4 1190 1 1 44 TYR HB2 H 8.020 4.876 4.639 1.00 . A A . 25 ARG HB2 1 1 4 1191 1 1 44 TYR HB3 H 7.897 4.315 2.977 1.00 . A A . 25 ARG HB3 1 1 4 1192 1 1 44 TYR HD2 H 5.940 5.590 3.355 1.00 . A A . 25 ARG HD2 1 1 4 1193 1 1 44 TYR N N 9.089 2.901 5.744 1.00 . A A . 25 ARG N 1 1 4 1194 1 1 44 TYR O O 9.972 2.464 2.321 1.00 . A A . 25 ARG O 1 1 4 1195 1 1 45 THR C C 12.890 2.380 2.982 1.00 . A A . 26 TYR C 1 1 4 1196 1 1 45 THR CA C 12.255 3.744 3.224 1.00 . A A . 26 TYR CA 1 1 4 1197 1 1 45 THR CB C 13.224 4.645 3.992 1.00 . A A . 26 TYR CB 1 1 4 1198 1 1 45 THR H H 10.938 3.970 4.863 1.00 . A A . 26 TYR H 1 1 4 1199 1 1 45 THR HA H 12.026 4.198 2.274 1.00 . A A . 26 TYR HA 1 1 4 1200 1 1 45 THR N N 11.007 3.598 3.962 1.00 . A A . 26 TYR N 1 1 4 1201 1 1 45 THR O O 13.274 2.051 1.860 1.00 . A A . 26 TYR O 1 1 4 1202 1 1 46 ALA C C 12.652 -0.677 3.170 1.00 . A A . 27 THR C 1 1 4 1203 1 1 46 ALA CA C 13.570 0.255 3.954 1.00 . A A . 27 THR CA 1 1 4 1204 1 1 46 ALA CB C 13.820 -0.310 5.354 1.00 . A A . 27 THR CB 1 1 4 1205 1 1 46 ALA H H 12.660 1.907 4.911 1.00 . A A . 27 THR H 1 1 4 1206 1 1 46 ALA HA H 14.513 0.336 3.433 1.00 . A A . 27 THR HA 1 1 4 1207 1 1 46 ALA N N 12.990 1.589 4.045 1.00 . A A . 27 THR N 1 1 4 1208 1 1 46 ALA O O 13.112 -1.497 2.377 1.00 . A A . 27 THR O 1 1 4 1209 1 1 47 GLY C C 10.371 -1.089 1.212 1.00 . A A . 28 ALA C 1 1 4 1210 1 1 47 GLY CA C 10.362 -1.363 2.710 1.00 . A A . 28 ALA CA 1 1 4 1211 1 1 47 GLY H H 11.044 0.134 4.039 1.00 . A A . 28 ALA H 1 1 4 1212 1 1 47 GLY N N 11.349 -0.540 3.396 1.00 . A A . 28 ALA N 1 1 4 1213 1 1 47 GLY O O 10.133 -1.987 0.404 1.00 . A A . 28 ALA O 1 1 4 1214 1 1 48 ILE C C 11.815 -0.155 -1.300 1.00 . A A . 29 GLY C 1 1 4 1215 1 1 48 ILE CA C 10.688 0.529 -0.556 1.00 . A A . 29 GLY CA 1 1 4 1216 1 1 48 ILE H H 10.833 0.831 1.534 1.00 . A A . 29 GLY H 1 1 4 1217 1 1 48 ILE N N 10.650 0.159 0.845 1.00 . A A . 29 GLY N 1 1 4 1218 1 1 48 ILE O O 11.601 -0.751 -2.356 1.00 . A A . 29 GLY O 1 1 4 1219 1 1 49 ASN C C 13.989 -2.202 -1.498 1.00 . A A . 30 ILE C 1 1 4 1220 1 1 49 ASN CA C 14.186 -0.695 -1.362 1.00 . A A . 30 ILE CA 1 1 4 1221 1 1 49 ASN CB C 15.467 -0.423 -0.550 1.00 . A A . 30 ILE CB 1 1 4 1222 1 1 49 ASN H H 13.127 0.412 0.099 1.00 . A A . 30 ILE H 1 1 4 1223 1 1 49 ASN HA H 14.310 -0.268 -2.346 1.00 . A A . 30 ILE HA 1 1 4 1224 1 1 49 ASN N N 13.021 -0.074 -0.746 1.00 . A A . 30 ILE N 1 1 4 1225 1 1 49 ASN O O 14.507 -2.823 -2.426 1.00 . A A . 30 ILE O 1 1 4 1226 1 1 50 SER C C 12.328 -4.620 -1.922 1.00 . A A . 31 ASN C 1 1 4 1227 1 1 50 SER CA C 12.960 -4.216 -0.595 1.00 . A A . 31 ASN CA 1 1 4 1228 1 1 50 SER CB C 12.038 -4.603 0.565 1.00 . A A . 31 ASN CB 1 1 4 1229 1 1 50 SER H H 12.841 -2.234 0.141 1.00 . A A . 31 ASN H 1 1 4 1230 1 1 50 SER HA H 13.900 -4.734 -0.484 1.00 . A A . 31 ASN HA 1 1 4 1231 1 1 50 SER HB2 H 11.459 -3.740 0.859 1.00 . A A . 31 ASN HB2 1 1 4 1232 1 1 50 SER HB3 H 11.369 -5.386 0.239 1.00 . A A . 31 ASN HB3 1 1 4 1233 1 1 50 SER N N 13.230 -2.783 -0.572 1.00 . A A . 31 ASN N 1 1 4 1234 1 1 50 SER O O 12.805 -5.532 -2.597 1.00 . A A . 31 ASN O 1 1 4 1235 1 1 51 PHE C C 11.518 -3.999 -4.727 1.00 . A A . 32 SER C 1 1 4 1236 1 1 51 PHE CA C 10.571 -4.205 -3.551 1.00 . A A . 32 SER CA 1 1 4 1237 1 1 51 PHE CB C 9.344 -3.304 -3.701 1.00 . A A . 32 SER CB 1 1 4 1238 1 1 51 PHE H H 10.929 -3.204 -1.721 1.00 . A A . 32 SER H 1 1 4 1239 1 1 51 PHE HA H 10.253 -5.237 -3.534 1.00 . A A . 32 SER HA 1 1 4 1240 1 1 51 PHE HB2 H 8.672 -3.473 -2.872 1.00 . A A . 32 SER HB2 1 1 4 1241 1 1 51 PHE HB3 H 9.657 -2.271 -3.705 1.00 . A A . 32 SER HB3 1 1 4 1242 1 1 51 PHE N N 11.258 -3.925 -2.297 1.00 . A A . 32 SER N 1 1 4 1243 1 1 51 PHE O O 11.435 -4.697 -5.738 1.00 . A A . 32 SER O 1 1 4 1244 1 1 52 VAL C C 14.293 -3.950 -5.871 1.00 . A A . 33 PHE C 1 1 4 1245 1 1 52 VAL CA C 13.399 -2.738 -5.619 1.00 . A A . 33 PHE CA 1 1 4 1246 1 1 52 VAL CB C 14.236 -1.512 -5.214 1.00 . A A . 33 PHE CB 1 1 4 1247 1 1 52 VAL H H 12.442 -2.521 -3.747 1.00 . A A . 33 PHE H 1 1 4 1248 1 1 52 VAL HA H 12.858 -2.511 -6.524 1.00 . A A . 33 PHE HA 1 1 4 1249 1 1 52 VAL N N 12.425 -3.037 -4.580 1.00 . A A . 33 PHE N 1 1 4 1250 1 1 52 VAL O O 14.388 -4.444 -6.997 1.00 . A A . 33 PHE O 1 1 4 1251 1 1 53 SER C C 15.076 -6.771 -5.534 1.00 . A A . 34 VAL C 1 1 4 1252 1 1 53 SER CA C 15.817 -5.592 -4.920 1.00 . A A . 34 VAL CA 1 1 4 1253 1 1 53 SER CB C 16.385 -6.003 -3.548 1.00 . A A . 34 VAL CB 1 1 4 1254 1 1 53 SER H H 14.819 -4.002 -3.941 1.00 . A A . 34 VAL H 1 1 4 1255 1 1 53 SER HA H 16.643 -5.325 -5.567 1.00 . A A . 34 VAL HA 1 1 4 1256 1 1 53 SER N N 14.939 -4.433 -4.813 1.00 . A A . 34 VAL N 1 1 4 1257 1 1 53 SER O O 15.352 -7.157 -6.665 1.00 . A A . 34 VAL O 1 1 4 1258 1 1 54 GLY C C 12.835 -8.265 -6.645 1.00 . A A . 35 SER C 1 1 4 1259 1 1 54 GLY CA C 13.389 -8.490 -5.261 1.00 . A A . 35 SER CA 1 1 4 1260 1 1 54 GLY H H 13.980 -7.030 -3.885 1.00 . A A . 35 SER H 1 1 4 1261 1 1 54 GLY N N 14.142 -7.351 -4.785 1.00 . A A . 35 SER N 1 1 4 1262 1 1 54 GLY O O 13.086 -9.067 -7.544 1.00 . A A . 35 SER O 1 1 4 1263 1 1 55 VAL C C 12.572 -7.377 -9.205 1.00 . A A . 36 GLY C 1 1 4 1264 1 1 55 VAL CA C 11.586 -6.902 -8.160 1.00 . A A . 36 GLY CA 1 1 4 1265 1 1 55 VAL H H 11.961 -6.563 -6.095 1.00 . A A . 36 GLY H 1 1 4 1266 1 1 55 VAL N N 12.113 -7.178 -6.838 1.00 . A A . 36 GLY N 1 1 4 1267 1 1 55 VAL O O 12.211 -8.042 -10.176 1.00 . A A . 36 GLY O 1 1 4 1268 1 1 56 ALA C C 15.536 -8.799 -9.362 1.00 . A A . 37 VAL C 1 1 4 1269 1 1 56 ALA CA C 14.930 -7.463 -9.805 1.00 . A A . 37 VAL CA 1 1 4 1270 1 1 56 ALA CB C 16.037 -6.389 -9.835 1.00 . A A . 37 VAL CB 1 1 4 1271 1 1 56 ALA H H 14.051 -6.560 -8.143 1.00 . A A . 37 VAL H 1 1 4 1272 1 1 56 ALA HA H 14.540 -7.571 -10.799 1.00 . A A . 37 VAL HA 1 1 4 1273 1 1 56 ALA N N 13.840 -7.057 -8.954 1.00 . A A . 37 VAL N 1 1 4 1274 1 1 56 ALA O O 15.411 -9.814 -10.048 1.00 . A A . 37 VAL O 1 1 4 1275 1 1 57 SER C C 16.044 -10.852 -6.856 1.00 . A A . 38 ALA C 1 1 4 1276 1 1 57 SER CA C 16.924 -9.921 -7.677 1.00 . A A . 38 ALA CA 1 1 4 1277 1 1 57 SER CB C 18.105 -9.466 -6.826 1.00 . A A . 38 ALA CB 1 1 4 1278 1 1 57 SER H H 16.306 -7.919 -7.738 1.00 . A A . 38 ALA H 1 1 4 1279 1 1 57 SER HA H 17.319 -10.467 -8.508 1.00 . A A . 38 ALA HA 1 1 4 1280 1 1 57 SER HB2 H 18.357 -8.445 -7.077 1.00 . A A . 38 ALA HB2 1 1 4 1281 1 1 57 SER HB3 H 18.955 -10.103 -7.017 1.00 . A A . 38 ALA HB3 1 1 4 1282 1 1 57 SER N N 16.237 -8.762 -8.224 1.00 . A A . 38 ALA N 1 1 4 1283 1 1 57 SER O O 15.707 -11.960 -7.272 1.00 . A A . 38 ALA O 1 1 4 1284 1 1 58 GLY C C 13.542 -11.461 -5.098 1.00 . A A . 39 SER C 1 1 4 1285 1 1 58 GLY CA C 14.979 -11.147 -4.667 1.00 . A A . 39 SER CA 1 1 4 1286 1 1 58 GLY H H 16.094 -9.515 -5.387 1.00 . A A . 39 SER H 1 1 4 1287 1 1 58 GLY N N 15.745 -10.393 -5.648 1.00 . A A . 39 SER N 1 1 4 1288 1 1 58 GLY O O 12.758 -11.982 -4.305 1.00 . A A . 39 SER O 1 1 4 1289 1 1 59 ALA C C 11.824 -12.424 -7.952 1.00 . A A . 40 GLY C 1 1 4 1290 1 1 59 ALA CA C 11.849 -11.413 -6.823 1.00 . A A . 40 GLY CA 1 1 4 1291 1 1 59 ALA H H 13.846 -10.730 -6.942 1.00 . A A . 40 GLY H 1 1 4 1292 1 1 59 ALA N N 13.193 -11.147 -6.344 1.00 . A A . 40 GLY N 1 1 4 1293 1 1 59 ALA O O 11.040 -12.296 -8.893 1.00 . A A . 40 GLY O 1 1 4 1294 1 1 60 GLY C C 13.495 -15.698 -8.359 1.00 . A A . 41 ALA C 1 1 4 1295 1 1 60 GLY CA C 12.758 -14.471 -8.877 1.00 . A A . 41 ALA CA 1 1 4 1296 1 1 60 GLY H H 13.280 -13.482 -7.087 1.00 . A A . 41 ALA H 1 1 4 1297 1 1 60 GLY N N 12.684 -13.433 -7.859 1.00 . A A . 41 ALA N 1 1 4 1298 1 1 60 GLY O O 12.878 -16.667 -7.916 1.00 . A A . 41 ALA O 1 1 4 1299 1 1 61 SER C C 16.413 -17.410 -9.071 1.00 . A A . 42 GLY C 1 1 4 1300 1 1 61 SER CA C 15.626 -16.757 -7.952 1.00 . A A . 42 GLY CA 1 1 4 1301 1 1 61 SER H H 15.241 -14.847 -8.781 1.00 . A A . 42 GLY H 1 1 4 1302 1 1 61 SER N N 14.815 -15.647 -8.418 1.00 . A A . 42 GLY N 1 1 4 1303 1 1 61 SER O O 17.563 -17.804 -8.883 1.00 . A A . 42 GLY O 1 1 4 1304 1 1 62 ILE C C 17.091 -17.074 -12.276 1.00 . A A . 43 SER C 1 1 4 1305 1 1 62 ILE CA C 16.438 -18.135 -11.396 1.00 . A A . 43 SER CA 1 1 4 1306 1 1 62 ILE CB C 15.422 -18.939 -12.209 1.00 . A A . 43 SER CB 1 1 4 1307 1 1 62 ILE H H 14.872 -17.191 -10.328 1.00 . A A . 43 SER H 1 1 4 1308 1 1 62 ILE HA H 17.203 -18.803 -11.030 1.00 . A A . 43 SER HA 1 1 4 1309 1 1 62 ILE N N 15.790 -17.524 -10.240 1.00 . A A . 43 SER N 1 1 4 1310 1 1 62 ILE O O 16.951 -17.097 -13.499 1.00 . A A . 43 SER O 1 1 4 1311 1 1 63 GLY C C 17.604 -14.466 -13.450 1.00 . A A . 44 ILE C 1 1 4 1312 1 1 63 GLY CA C 18.489 -15.067 -12.357 1.00 . A A . 44 ILE CA 1 1 4 1313 1 1 63 GLY H H 17.878 -16.185 -10.666 1.00 . A A . 44 ILE H 1 1 4 1314 1 1 63 GLY N N 17.806 -16.145 -11.643 1.00 . A A . 44 ILE N 1 1 4 1315 1 1 63 GLY O O 18.050 -14.240 -14.575 1.00 . A A . 44 ILE O 1 1 4 1316 1 1 64 ARG C C 14.875 -14.668 -15.034 1.00 . A A . 45 GLY C 1 1 4 1317 1 1 64 ARG CA C 15.419 -13.636 -14.064 1.00 . A A . 45 GLY CA 1 1 4 1318 1 1 64 ARG H H 16.046 -14.408 -12.195 1.00 . A A . 45 GLY H 1 1 4 1319 1 1 64 ARG N N 16.347 -14.209 -13.107 1.00 . A A . 45 GLY N 1 1 4 1320 1 1 64 ARG O O 13.874 -15.327 -14.751 1.00 . A A . 45 GLY O 1 1 5 1321 1 1 20 ASN C C 12.134 13.277 30.947 1.00 . A A . 1 VAL C 1 1 5 1322 1 1 20 ASN CA C 13.475 12.818 30.387 1.00 . A A . 1 VAL CA 1 1 5 1323 1 1 20 ASN CB C 13.360 11.344 29.957 1.00 . A A . 1 VAL CB 1 1 5 1324 1 1 20 ASN H H 15.071 12.231 31.647 1.00 . A A . 1 VAL H 1 1 5 1325 1 1 20 ASN HA H 13.711 13.409 29.513 1.00 . A A . 1 VAL HA 1 1 5 1326 1 1 20 ASN N N 14.545 13.006 31.359 1.00 . A A . 1 VAL N 1 1 5 1327 1 1 20 ASN O O 11.491 12.561 31.714 1.00 . A A . 1 VAL O 1 1 5 1328 1 1 21 TYR C C 9.971 16.139 30.085 1.00 . A A . 2 ASN C 1 1 5 1329 1 1 21 TYR CA C 10.451 15.034 31.019 1.00 . A A . 2 ASN CA 1 1 5 1330 1 1 21 TYR CB C 10.598 15.575 32.445 1.00 . A A . 2 ASN CB 1 1 5 1331 1 1 21 TYR CG C 9.593 14.963 33.401 1.00 . A A . 2 ASN CG 1 1 5 1332 1 1 21 TYR H H 12.273 15.001 29.943 1.00 . A A . 2 ASN H 1 1 5 1333 1 1 21 TYR HA H 9.722 14.239 31.019 1.00 . A A . 2 ASN HA 1 1 5 1334 1 1 21 TYR HB2 H 11.590 15.354 32.806 1.00 . A A . 2 ASN HB2 1 1 5 1335 1 1 21 TYR HB3 H 10.453 16.645 32.437 1.00 . A A . 2 ASN HB3 1 1 5 1336 1 1 21 TYR N N 11.717 14.477 30.557 1.00 . A A . 2 ASN N 1 1 5 1337 1 1 21 TYR O O 9.429 17.152 30.527 1.00 . A A . 2 ASN O 1 1 5 1338 1 1 22 GLY C C 10.040 16.390 26.378 1.00 . A A . 3 TYR C 1 1 5 1339 1 1 22 GLY CA C 9.764 16.910 27.785 1.00 . A A . 3 TYR CA 1 1 5 1340 1 1 22 GLY H H 10.610 15.107 28.497 1.00 . A A . 3 TYR H 1 1 5 1341 1 1 22 GLY N N 10.173 15.935 28.788 1.00 . A A . 3 TYR N 1 1 5 1342 1 1 22 GLY O O 10.448 17.143 25.495 1.00 . A A . 3 TYR O 1 1 5 1343 1 1 23 ASN C C 8.761 13.963 24.257 1.00 . A A . 4 GLY C 1 1 5 1344 1 1 23 ASN CA C 10.038 14.492 24.880 1.00 . A A . 4 GLY CA 1 1 5 1345 1 1 23 ASN H H 9.484 14.548 26.923 1.00 . A A . 4 GLY H 1 1 5 1346 1 1 23 ASN N N 9.811 15.097 26.180 1.00 . A A . 4 GLY N 1 1 5 1347 1 1 23 ASN O O 8.014 14.710 23.625 1.00 . A A . 4 GLY O 1 1 5 1348 1 1 24 GLY C C 6.050 12.783 24.311 1.00 . A A . 5 ASN C 1 1 5 1349 1 1 24 GLY CA C 7.313 12.038 23.883 1.00 . A A . 5 ASN CA 1 1 5 1350 1 1 24 GLY H H 9.146 12.127 24.946 1.00 . A A . 5 ASN H 1 1 5 1351 1 1 24 GLY N N 8.510 12.669 24.435 1.00 . A A . 5 ASN N 1 1 5 1352 1 1 24 GLY O O 5.577 13.675 23.606 1.00 . A A . 5 ASN O 1 1 5 1353 1 1 25 VAL C C 3.176 13.046 24.959 1.00 . A A . 6 GLY C 1 1 5 1354 1 1 25 VAL CA C 4.310 13.059 25.966 1.00 . A A . 6 GLY CA 1 1 5 1355 1 1 25 VAL H H 5.933 11.702 25.977 1.00 . A A . 6 GLY H 1 1 5 1356 1 1 25 VAL N N 5.511 12.416 25.463 1.00 . A A . 6 GLY N 1 1 5 1357 1 1 25 VAL O O 2.739 14.099 24.492 1.00 . A A . 6 GLY O 1 1 5 1358 1 1 26 SER C C 0.260 11.670 24.361 1.00 . A A . 7 VAL C 1 1 5 1359 1 1 26 SER CA C 1.614 11.706 23.659 1.00 . A A . 7 VAL CA 1 1 5 1360 1 1 26 SER CB C 1.773 10.428 22.813 1.00 . A A . 7 VAL CB 1 1 5 1361 1 1 26 SER H H 3.092 11.049 25.024 1.00 . A A . 7 VAL H 1 1 5 1362 1 1 26 SER HA H 1.640 12.558 22.993 1.00 . A A . 7 VAL HA 1 1 5 1363 1 1 26 SER N N 2.701 11.852 24.620 1.00 . A A . 7 VAL N 1 1 5 1364 1 1 26 SER O O 0.180 11.421 25.564 1.00 . A A . 7 VAL O 1 1 5 1365 1 1 27 CYS C C -3.186 11.759 23.034 1.00 . A A . 8 SER C 1 1 5 1366 1 1 27 CYS CA C -2.152 11.918 24.146 1.00 . A A . 8 SER CA 1 1 5 1367 1 1 27 CYS CB C -2.409 13.210 24.922 1.00 . A A . 8 SER CB 1 1 5 1368 1 1 27 CYS H H -0.671 12.113 22.649 1.00 . A A . 8 SER H 1 1 5 1369 1 1 27 CYS HA H -2.235 11.079 24.821 1.00 . A A . 8 SER HA 1 1 5 1370 1 1 27 CYS HB2 H -1.501 13.794 24.953 1.00 . A A . 8 SER HB2 1 1 5 1371 1 1 27 CYS HB3 H -3.184 13.778 24.428 1.00 . A A . 8 SER HB3 1 1 5 1372 1 1 27 CYS N N -0.801 11.920 23.600 1.00 . A A . 8 SER N 1 1 5 1373 1 1 27 CYS O O -2.897 12.009 21.864 1.00 . A A . 8 SER O 1 1 5 1374 1 1 28 SER C C -6.725 11.901 22.885 1.00 . A A . 9 CYS C 1 1 5 1375 1 1 28 SER CA C -5.469 11.153 22.444 1.00 . A A . 9 CYS CA 1 1 5 1376 1 1 28 SER CB C -5.771 9.661 22.275 1.00 . A A . 9 CYS CB 1 1 5 1377 1 1 28 SER H H -4.562 11.160 24.357 1.00 . A A . 9 CYS H 1 1 5 1378 1 1 28 SER HA H -5.139 11.557 21.500 1.00 . A A . 9 CYS HA 1 1 5 1379 1 1 28 SER HB2 H -4.840 9.119 22.226 1.00 . A A . 9 CYS HB2 1 1 5 1380 1 1 28 SER HB3 H -6.336 9.319 23.129 1.00 . A A . 9 CYS HB3 1 1 5 1381 1 1 28 SER N N -4.391 11.343 23.410 1.00 . A A . 9 CYS N 1 1 5 1382 1 1 28 SER O O -6.835 12.316 24.040 1.00 . A A . 9 CYS O 1 1 5 1383 1 1 29 LYS C C -8.633 14.239 22.625 1.00 . A A . 10 SER C 1 1 5 1384 1 1 29 LYS CA C -8.910 12.787 22.252 1.00 . A A . 10 SER CA 1 1 5 1385 1 1 29 LYS CB C -9.634 12.105 23.401 1.00 . A A . 10 SER CB 1 1 5 1386 1 1 29 LYS H H -7.512 11.733 21.055 1.00 . A A . 10 SER H 1 1 5 1387 1 1 29 LYS HA H -9.531 12.758 21.371 1.00 . A A . 10 SER HA 1 1 5 1388 1 1 29 LYS HB2 H -8.907 11.612 24.025 1.00 . A A . 10 SER HB2 1 1 5 1389 1 1 29 LYS HB3 H -10.157 12.850 23.979 1.00 . A A . 10 SER HB3 1 1 5 1390 1 1 29 LYS N N -7.663 12.078 21.959 1.00 . A A . 10 SER N 1 1 5 1391 1 1 29 LYS O O -9.466 14.913 23.233 1.00 . A A . 10 SER O 1 1 5 1392 1 1 30 THR C C -5.896 16.484 21.603 1.00 . A A . 11 LYS C 1 1 5 1393 1 1 30 THR CA C -7.031 16.071 22.531 1.00 . A A . 11 LYS CA 1 1 5 1394 1 1 30 THR CB C -6.590 16.200 23.989 1.00 . A A . 11 LYS CB 1 1 5 1395 1 1 30 THR H H -6.854 14.102 21.782 1.00 . A A . 11 LYS H 1 1 5 1396 1 1 30 THR HA H -7.865 16.718 22.356 1.00 . A A . 11 LYS HA 1 1 5 1397 1 1 30 THR N N -7.456 14.703 22.253 1.00 . A A . 11 LYS N 1 1 5 1398 1 1 30 THR O O -5.804 17.639 21.185 1.00 . A A . 11 LYS O 1 1 5 1399 1 1 31 LYS C C -3.550 14.478 19.670 1.00 . A A . 12 THR C 1 1 5 1400 1 1 31 LYS CA C -3.904 15.763 20.418 1.00 . A A . 12 THR CA 1 1 5 1401 1 1 31 LYS CB C -2.721 16.285 21.248 1.00 . A A . 12 THR CB 1 1 5 1402 1 1 31 LYS H H -5.169 14.640 21.657 1.00 . A A . 12 THR H 1 1 5 1403 1 1 31 LYS HA H -4.192 16.513 19.704 1.00 . A A . 12 THR HA 1 1 5 1404 1 1 31 LYS N N -5.037 15.529 21.290 1.00 . A A . 12 THR N 1 1 5 1405 1 1 31 LYS O O -4.044 13.403 20.010 1.00 . A A . 12 THR O 1 1 5 1406 1 1 32 CYS C C -2.266 12.155 18.639 1.00 . A A . 13 LYS C 1 1 5 1407 1 1 32 CYS CA C -2.285 13.453 17.831 1.00 . A A . 13 LYS CA 1 1 5 1408 1 1 32 CYS CB C -0.900 13.711 17.234 1.00 . A A . 13 LYS CB 1 1 5 1409 1 1 32 CYS H H -2.357 15.489 18.421 1.00 . A A . 13 LYS H 1 1 5 1410 1 1 32 CYS HA H -2.995 13.346 17.024 1.00 . A A . 13 LYS HA 1 1 5 1411 1 1 32 CYS HB2 H -0.220 13.972 18.032 1.00 . A A . 13 LYS HB2 1 1 5 1412 1 1 32 CYS HB3 H -0.552 12.806 16.758 1.00 . A A . 13 LYS HB3 1 1 5 1413 1 1 32 CYS N N -2.705 14.600 18.644 1.00 . A A . 13 LYS N 1 1 5 1414 1 1 32 CYS O O -1.575 12.052 19.652 1.00 . A A . 13 LYS O 1 1 5 1415 1 1 33 SER C C -2.073 8.904 18.313 1.00 . A A . 14 CYS C 1 1 5 1416 1 1 33 SER CA C -3.114 9.879 18.859 1.00 . A A . 14 CYS CA 1 1 5 1417 1 1 33 SER CB C -4.514 9.283 18.698 1.00 . A A . 14 CYS CB 1 1 5 1418 1 1 33 SER H H -3.564 11.315 17.370 1.00 . A A . 14 CYS H 1 1 5 1419 1 1 33 SER HA H -2.924 10.044 19.909 1.00 . A A . 14 CYS HA 1 1 5 1420 1 1 33 SER HB2 H -4.698 9.094 17.650 1.00 . A A . 14 CYS HB2 1 1 5 1421 1 1 33 SER HB3 H -4.564 8.349 19.240 1.00 . A A . 14 CYS HB3 1 1 5 1422 1 1 33 SER N N -3.034 11.170 18.181 1.00 . A A . 14 CYS N 1 1 5 1423 1 1 33 SER O O -2.350 7.716 18.147 1.00 . A A . 14 CYS O 1 1 5 1424 1 1 34 VAL C C 1.516 8.870 18.224 1.00 . A A . 15 SER C 1 1 5 1425 1 1 34 VAL CA C 0.200 8.577 17.508 1.00 . A A . 15 SER CA 1 1 5 1426 1 1 34 VAL CB C 0.363 8.808 16.004 1.00 . A A . 15 SER CB 1 1 5 1427 1 1 34 VAL H H -0.710 10.363 18.187 1.00 . A A . 15 SER H 1 1 5 1428 1 1 34 VAL HA H -0.066 7.545 17.679 1.00 . A A . 15 SER HA 1 1 5 1429 1 1 34 VAL N N -0.875 9.410 18.035 1.00 . A A . 15 SER N 1 1 5 1430 1 1 34 VAL O O 1.719 9.967 18.745 1.00 . A A . 15 SER O 1 1 5 1431 1 1 35 ASN C C 4.769 8.480 17.900 1.00 . A A . 16 VAL C 1 1 5 1432 1 1 35 ASN CA C 3.699 8.033 18.895 1.00 . A A . 16 VAL CA 1 1 5 1433 1 1 35 ASN CB C 4.144 6.720 19.570 1.00 . A A . 16 VAL CB 1 1 5 1434 1 1 35 ASN H H 2.184 7.031 17.811 1.00 . A A . 16 VAL H 1 1 5 1435 1 1 35 ASN HA H 3.599 8.789 19.662 1.00 . A A . 16 VAL HA 1 1 5 1436 1 1 35 ASN N N 2.404 7.882 18.244 1.00 . A A . 16 VAL N 1 1 5 1437 1 1 35 ASN O O 5.852 7.899 17.831 1.00 . A A . 16 VAL O 1 1 5 1438 1 1 36 TRP C C 5.535 9.085 14.964 1.00 . A A . 17 ASN C 1 1 5 1439 1 1 36 TRP CA C 5.383 10.048 16.136 1.00 . A A . 17 ASN CA 1 1 5 1440 1 1 36 TRP CB C 6.751 10.323 16.771 1.00 . A A . 17 ASN CB 1 1 5 1441 1 1 36 TRP CG C 7.129 11.792 16.716 1.00 . A A . 17 ASN CG 1 1 5 1442 1 1 36 TRP H H 3.576 9.937 17.229 1.00 . A A . 17 ASN H 1 1 5 1443 1 1 36 TRP HA H 4.975 10.978 15.768 1.00 . A A . 17 ASN HA 1 1 5 1444 1 1 36 TRP HB2 H 6.727 10.016 17.806 1.00 . A A . 17 ASN HB2 1 1 5 1445 1 1 36 TRP HB3 H 7.506 9.755 16.248 1.00 . A A . 17 ASN HB3 1 1 5 1446 1 1 36 TRP N N 4.454 9.518 17.129 1.00 . A A . 17 ASN N 1 1 5 1447 1 1 36 TRP O O 6.290 8.115 15.037 1.00 . A A . 17 ASN O 1 1 5 1448 1 1 37 GLY C C 6.195 8.677 11.958 1.00 . A A . 18 TRP C 1 1 5 1449 1 1 37 GLY CA C 4.863 8.522 12.694 1.00 . A A . 18 TRP CA 1 1 5 1450 1 1 37 GLY H H 4.229 10.145 13.888 1.00 . A A . 18 TRP H 1 1 5 1451 1 1 37 GLY N N 4.811 9.360 13.885 1.00 . A A . 18 TRP N 1 1 5 1452 1 1 37 GLY O O 6.480 7.941 11.013 1.00 . A A . 18 TRP O 1 1 5 1453 1 1 38 GLN C C 9.128 8.595 11.689 1.00 . A A . 19 GLY C 1 1 5 1454 1 1 38 GLN CA C 8.303 9.863 11.769 1.00 . A A . 19 GLY CA 1 1 5 1455 1 1 38 GLN H H 6.736 10.188 13.152 1.00 . A A . 19 GLY H 1 1 5 1456 1 1 38 GLN N N 7.011 9.636 12.397 1.00 . A A . 19 GLY N 1 1 5 1457 1 1 38 GLN O O 9.603 8.213 10.616 1.00 . A A . 19 GLY O 1 1 5 1458 1 1 39 ALA C C 9.463 5.716 11.835 1.00 . A A . 20 GLN C 1 1 5 1459 1 1 39 ALA CA C 10.037 6.682 12.860 1.00 . A A . 20 GLN CA 1 1 5 1460 1 1 39 ALA CB C 9.988 6.061 14.258 1.00 . A A . 20 GLN CB 1 1 5 1461 1 1 39 ALA H H 8.870 8.262 13.646 1.00 . A A . 20 GLN H 1 1 5 1462 1 1 39 ALA HA H 11.062 6.901 12.600 1.00 . A A . 20 GLN HA 1 1 5 1463 1 1 39 ALA HB2 H 10.133 6.840 14.991 1.00 . A A . 20 GLN HB2 1 1 5 1464 1 1 39 ALA HB3 H 9.016 5.614 14.407 1.00 . A A . 20 GLN HB3 1 1 5 1465 1 1 39 ALA N N 9.283 7.924 12.824 1.00 . A A . 20 GLN N 1 1 5 1466 1 1 39 ALA O O 10.173 5.238 10.951 1.00 . A A . 20 GLN O 1 1 5 1467 1 1 40 PHE C C 7.463 5.123 9.602 1.00 . A A . 21 ALA C 1 1 5 1468 1 1 40 PHE CA C 7.495 4.558 11.008 1.00 . A A . 21 ALA CA 1 1 5 1469 1 1 40 PHE CB C 6.106 4.193 11.482 1.00 . A A . 21 ALA CB 1 1 5 1470 1 1 40 PHE H H 7.643 5.872 12.661 1.00 . A A . 21 ALA H 1 1 5 1471 1 1 40 PHE HA H 8.079 3.679 10.973 1.00 . A A . 21 ALA HA 1 1 5 1472 1 1 40 PHE HB2 H 5.589 5.087 11.804 1.00 . A A . 21 ALA HB2 1 1 5 1473 1 1 40 PHE HB3 H 6.182 3.500 12.305 1.00 . A A . 21 ALA HB3 1 1 5 1474 1 1 40 PHE N N 8.163 5.449 11.947 1.00 . A A . 21 ALA N 1 1 5 1475 1 1 40 PHE O O 7.071 4.449 8.649 1.00 . A A . 21 ALA O 1 1 5 1476 1 1 41 GLN C C 9.124 6.337 7.426 1.00 . A A . 22 PHE C 1 1 5 1477 1 1 41 GLN CA C 7.995 6.995 8.184 1.00 . A A . 22 PHE CA 1 1 5 1478 1 1 41 GLN CB C 8.240 8.498 8.328 1.00 . A A . 22 PHE CB 1 1 5 1479 1 1 41 GLN CG C 7.794 9.296 7.136 1.00 . A A . 22 PHE CG 1 1 5 1480 1 1 41 GLN H H 8.239 6.790 10.266 1.00 . A A . 22 PHE H 1 1 5 1481 1 1 41 GLN HA H 7.067 6.821 7.662 1.00 . A A . 22 PHE HA 1 1 5 1482 1 1 41 GLN HB2 H 7.705 8.863 9.191 1.00 . A A . 22 PHE HB2 1 1 5 1483 1 1 41 GLN HB3 H 9.298 8.670 8.467 1.00 . A A . 22 PHE HB3 1 1 5 1484 1 1 41 GLN N N 7.916 6.343 9.478 1.00 . A A . 22 PHE N 1 1 5 1485 1 1 41 GLN O O 9.008 6.017 6.242 1.00 . A A . 22 PHE O 1 1 5 1486 1 1 42 GLU C C 11.032 3.915 7.465 1.00 . A A . 23 GLN C 1 1 5 1487 1 1 42 GLU CA C 11.358 5.403 7.603 1.00 . A A . 23 GLN CA 1 1 5 1488 1 1 42 GLU CB C 12.581 5.600 8.505 1.00 . A A . 23 GLN CB 1 1 5 1489 1 1 42 GLU CD C 13.575 7.922 8.471 1.00 . A A . 23 GLN CD 1 1 5 1490 1 1 42 GLU CG C 13.636 6.515 7.908 1.00 . A A . 23 GLN CG 1 1 5 1491 1 1 42 GLU H H 10.208 6.338 9.107 1.00 . A A . 23 GLN H 1 1 5 1492 1 1 42 GLU HA H 11.560 5.815 6.625 1.00 . A A . 23 GLN HA 1 1 5 1493 1 1 42 GLU HB2 H 12.256 6.026 9.444 1.00 . A A . 23 GLN HB2 1 1 5 1494 1 1 42 GLU HB3 H 13.035 4.638 8.694 1.00 . A A . 23 GLN HB3 1 1 5 1495 1 1 42 GLU HG2 H 14.613 6.104 8.117 1.00 . A A . 23 GLN HG2 1 1 5 1496 1 1 42 GLU HG3 H 13.489 6.564 6.839 1.00 . A A . 23 GLN HG3 1 1 5 1497 1 1 42 GLU N N 10.206 6.087 8.155 1.00 . A A . 23 GLN N 1 1 5 1498 1 1 42 GLU O O 11.631 3.208 6.655 1.00 . A A . 23 GLN O 1 1 5 1499 1 1 42 GLU OE1 O 13.680 8.124 9.681 1.00 . A A . 23 GLN OE1 1 1 5 1500 1 1 43 ARG C C 9.107 1.706 6.841 1.00 . A A . 24 GLU C 1 1 5 1501 1 1 43 ARG CA C 9.627 2.062 8.227 1.00 . A A . 24 GLU CA 1 1 5 1502 1 1 43 ARG CB C 8.539 1.805 9.271 1.00 . A A . 24 GLU CB 1 1 5 1503 1 1 43 ARG CD C 9.614 0.026 10.707 1.00 . A A . 24 GLU CD 1 1 5 1504 1 1 43 ARG CG C 9.086 1.447 10.642 1.00 . A A . 24 GLU CG 1 1 5 1505 1 1 43 ARG H H 9.612 4.073 8.876 1.00 . A A . 24 GLU H 1 1 5 1506 1 1 43 ARG HA H 10.477 1.448 8.455 1.00 . A A . 24 GLU HA 1 1 5 1507 1 1 43 ARG HB2 H 7.932 2.689 9.368 1.00 . A A . 24 GLU HB2 1 1 5 1508 1 1 43 ARG HB3 H 7.918 0.989 8.932 1.00 . A A . 24 GLU HB3 1 1 5 1509 1 1 43 ARG HG2 H 9.891 2.124 10.883 1.00 . A A . 24 GLU HG2 1 1 5 1510 1 1 43 ARG HG3 H 8.296 1.555 11.371 1.00 . A A . 24 GLU HG3 1 1 5 1511 1 1 43 ARG N N 10.057 3.455 8.260 1.00 . A A . 24 GLU N 1 1 5 1512 1 1 43 ARG O O 9.407 0.640 6.304 1.00 . A A . 24 GLU O 1 1 5 1513 1 1 44 TYR C C 8.839 2.485 3.875 1.00 . A A . 25 ARG C 1 1 5 1514 1 1 44 TYR CA C 7.756 2.419 4.944 1.00 . A A . 25 ARG CA 1 1 5 1515 1 1 44 TYR CB C 6.679 3.472 4.671 1.00 . A A . 25 ARG CB 1 1 5 1516 1 1 44 TYR CG C 5.298 3.071 5.165 1.00 . A A . 25 ARG CG 1 1 5 1517 1 1 44 TYR CZ C 4.946 3.594 1.783 1.00 . A A . 25 ARG CZ 1 1 5 1518 1 1 44 TYR H H 8.128 3.444 6.750 1.00 . A A . 25 ARG H 1 1 5 1519 1 1 44 TYR HA H 7.309 1.444 4.923 1.00 . A A . 25 ARG HA 1 1 5 1520 1 1 44 TYR HB2 H 6.960 4.393 5.165 1.00 . A A . 25 ARG HB2 1 1 5 1521 1 1 44 TYR HB3 H 6.624 3.647 3.607 1.00 . A A . 25 ARG HB3 1 1 5 1522 1 1 44 TYR HD2 H 4.717 1.763 3.588 1.00 . A A . 25 ARG HD2 1 1 5 1523 1 1 44 TYR N N 8.325 2.616 6.269 1.00 . A A . 25 ARG N 1 1 5 1524 1 1 44 TYR O O 8.746 1.832 2.836 1.00 . A A . 25 ARG O 1 1 5 1525 1 1 45 THR C C 11.729 2.117 3.055 1.00 . A A . 26 TYR C 1 1 5 1526 1 1 45 THR CA C 10.977 3.432 3.216 1.00 . A A . 26 TYR CA 1 1 5 1527 1 1 45 THR CB C 11.931 4.525 3.705 1.00 . A A . 26 TYR CB 1 1 5 1528 1 1 45 THR H H 9.880 3.764 4.992 1.00 . A A . 26 TYR H 1 1 5 1529 1 1 45 THR HA H 10.571 3.722 2.260 1.00 . A A . 26 TYR HA 1 1 5 1530 1 1 45 THR N N 9.867 3.277 4.145 1.00 . A A . 26 TYR N 1 1 5 1531 1 1 45 THR O O 12.090 1.727 1.945 1.00 . A A . 26 TYR O 1 1 5 1532 1 1 46 ALA C C 11.913 -0.864 3.314 1.00 . A A . 27 THR C 1 1 5 1533 1 1 46 ALA CA C 12.664 0.159 4.159 1.00 . A A . 27 THR CA 1 1 5 1534 1 1 46 ALA CB C 12.838 -0.365 5.586 1.00 . A A . 27 THR CB 1 1 5 1535 1 1 46 ALA H H 11.644 1.797 5.026 1.00 . A A . 27 THR H 1 1 5 1536 1 1 46 ALA HA H 13.637 0.323 3.723 1.00 . A A . 27 THR HA 1 1 5 1537 1 1 46 ALA N N 11.959 1.434 4.172 1.00 . A A . 27 THR N 1 1 5 1538 1 1 46 ALA O O 12.522 -1.669 2.609 1.00 . A A . 27 THR O 1 1 5 1539 1 1 47 GLY C C 9.924 -1.538 1.131 1.00 . A A . 28 ALA C 1 1 5 1540 1 1 47 GLY CA C 9.752 -1.750 2.631 1.00 . A A . 28 ALA CA 1 1 5 1541 1 1 47 GLY H H 10.158 -0.163 3.969 1.00 . A A . 28 ALA H 1 1 5 1542 1 1 47 GLY N N 10.586 -0.828 3.389 1.00 . A A . 28 ALA N 1 1 5 1543 1 1 47 GLY O O 9.912 -2.492 0.353 1.00 . A A . 28 ALA O 1 1 5 1544 1 1 48 ILE C C 11.560 -0.506 -1.235 1.00 . A A . 29 GLY C 1 1 5 1545 1 1 48 ILE CA C 10.258 0.034 -0.675 1.00 . A A . 29 GLY CA 1 1 5 1546 1 1 48 ILE H H 10.086 0.439 1.398 1.00 . A A . 29 GLY H 1 1 5 1547 1 1 48 ILE N N 10.085 -0.281 0.732 1.00 . A A . 29 GLY N 1 1 5 1548 1 1 48 ILE O O 11.604 -0.984 -2.368 1.00 . A A . 29 GLY O 1 1 5 1549 1 1 49 ASN C C 13.891 -2.405 -1.165 1.00 . A A . 30 ILE C 1 1 5 1550 1 1 49 ASN CA C 13.930 -0.912 -0.862 1.00 . A A . 30 ILE CA 1 1 5 1551 1 1 49 ASN CB C 15.004 -0.641 0.211 1.00 . A A . 30 ILE CB 1 1 5 1552 1 1 49 ASN H H 12.522 -0.035 0.453 1.00 . A A . 30 ILE H 1 1 5 1553 1 1 49 ASN HA H 14.208 -0.380 -1.761 1.00 . A A . 30 ILE HA 1 1 5 1554 1 1 49 ASN N N 12.621 -0.427 -0.440 1.00 . A A . 30 ILE N 1 1 5 1555 1 1 49 ASN O O 14.513 -2.872 -2.119 1.00 . A A . 30 ILE O 1 1 5 1556 1 1 50 SER C C 12.448 -4.920 -1.894 1.00 . A A . 31 ASN C 1 1 5 1557 1 1 50 SER CA C 13.036 -4.594 -0.526 1.00 . A A . 31 ASN CA 1 1 5 1558 1 1 50 SER CB C 12.165 -5.196 0.578 1.00 . A A . 31 ASN CB 1 1 5 1559 1 1 50 SER H H 12.684 -2.721 0.397 1.00 . A A . 31 ASN H 1 1 5 1560 1 1 50 SER HA H 14.027 -5.019 -0.463 1.00 . A A . 31 ASN HA 1 1 5 1561 1 1 50 SER HB2 H 12.095 -4.495 1.396 1.00 . A A . 31 ASN HB2 1 1 5 1562 1 1 50 SER HB3 H 11.175 -5.384 0.185 1.00 . A A . 31 ASN HB3 1 1 5 1563 1 1 50 SER N N 13.158 -3.151 -0.346 1.00 . A A . 31 ASN N 1 1 5 1564 1 1 50 SER O O 12.955 -5.785 -2.609 1.00 . A A . 31 ASN O 1 1 5 1565 1 1 51 PHE C C 11.682 -4.152 -4.688 1.00 . A A . 32 SER C 1 1 5 1566 1 1 51 PHE CA C 10.722 -4.436 -3.539 1.00 . A A . 32 SER CA 1 1 5 1567 1 1 51 PHE CB C 9.483 -3.545 -3.659 1.00 . A A . 32 SER CB 1 1 5 1568 1 1 51 PHE H H 11.019 -3.545 -1.642 1.00 . A A . 32 SER H 1 1 5 1569 1 1 51 PHE HA H 10.416 -5.470 -3.587 1.00 . A A . 32 SER HA 1 1 5 1570 1 1 51 PHE HB2 H 9.583 -2.703 -2.991 1.00 . A A . 32 SER HB2 1 1 5 1571 1 1 51 PHE HB3 H 9.394 -3.190 -4.675 1.00 . A A . 32 SER HB3 1 1 5 1572 1 1 51 PHE N N 11.376 -4.222 -2.254 1.00 . A A . 32 SER N 1 1 5 1573 1 1 51 PHE O O 11.619 -4.792 -5.737 1.00 . A A . 32 SER O 1 1 5 1574 1 1 52 VAL C C 14.495 -3.975 -5.792 1.00 . A A . 33 PHE C 1 1 5 1575 1 1 52 VAL CA C 13.550 -2.816 -5.495 1.00 . A A . 33 PHE CA 1 1 5 1576 1 1 52 VAL CB C 14.349 -1.595 -5.038 1.00 . A A . 33 PHE CB 1 1 5 1577 1 1 52 VAL H H 12.573 -2.714 -3.622 1.00 . A A . 33 PHE H 1 1 5 1578 1 1 52 VAL HA H 13.011 -2.565 -6.396 1.00 . A A . 33 PHE HA 1 1 5 1579 1 1 52 VAL N N 12.573 -3.187 -4.480 1.00 . A A . 33 PHE N 1 1 5 1580 1 1 52 VAL O O 14.731 -4.319 -6.951 1.00 . A A . 33 PHE O 1 1 5 1581 1 1 53 SER C C 15.338 -6.808 -5.719 1.00 . A A . 34 VAL C 1 1 5 1582 1 1 53 SER CA C 15.957 -5.695 -4.881 1.00 . A A . 34 VAL CA 1 1 5 1583 1 1 53 SER CB C 16.380 -6.259 -3.510 1.00 . A A . 34 VAL CB 1 1 5 1584 1 1 53 SER H H 14.808 -4.256 -3.836 1.00 . A A . 34 VAL H 1 1 5 1585 1 1 53 SER HA H 16.841 -5.332 -5.387 1.00 . A A . 34 VAL HA 1 1 5 1586 1 1 53 SER N N 15.034 -4.575 -4.735 1.00 . A A . 34 VAL N 1 1 5 1587 1 1 53 SER O O 15.718 -7.002 -6.868 1.00 . A A . 34 VAL O 1 1 5 1588 1 1 54 GLY C C 13.296 -8.262 -7.211 1.00 . A A . 35 SER C 1 1 5 1589 1 1 54 GLY CA C 13.764 -8.648 -5.832 1.00 . A A . 35 SER CA 1 1 5 1590 1 1 54 GLY H H 14.157 -7.381 -4.216 1.00 . A A . 35 SER H 1 1 5 1591 1 1 54 GLY N N 14.399 -7.549 -5.138 1.00 . A A . 35 SER N 1 1 5 1592 1 1 54 GLY O O 13.701 -8.886 -8.192 1.00 . A A . 35 SER O 1 1 5 1593 1 1 55 VAL C C 13.112 -7.036 -9.637 1.00 . A A . 36 GLY C 1 1 5 1594 1 1 55 VAL CA C 12.015 -6.812 -8.616 1.00 . A A . 36 GLY CA 1 1 5 1595 1 1 55 VAL H H 12.192 -6.766 -6.499 1.00 . A A . 36 GLY H 1 1 5 1596 1 1 55 VAL N N 12.471 -7.237 -7.307 1.00 . A A . 36 GLY N 1 1 5 1597 1 1 55 VAL O O 12.881 -7.570 -10.722 1.00 . A A . 36 GLY O 1 1 5 1598 1 1 56 ALA C C 16.200 -8.169 -9.769 1.00 . A A . 37 VAL C 1 1 5 1599 1 1 56 ALA CA C 15.502 -6.835 -10.051 1.00 . A A . 37 VAL CA 1 1 5 1600 1 1 56 ALA CB C 16.504 -5.683 -9.830 1.00 . A A . 37 VAL CB 1 1 5 1601 1 1 56 ALA H H 14.433 -6.277 -8.351 1.00 . A A . 37 VAL H 1 1 5 1602 1 1 56 ALA HA H 15.192 -6.818 -11.077 1.00 . A A . 37 VAL HA 1 1 5 1603 1 1 56 ALA N N 14.325 -6.657 -9.240 1.00 . A A . 37 VAL N 1 1 5 1604 1 1 56 ALA O O 16.211 -9.073 -10.604 1.00 . A A . 37 VAL O 1 1 5 1605 1 1 57 SER C C 16.730 -10.531 -7.569 1.00 . A A . 38 ALA C 1 1 5 1606 1 1 57 SER CA C 17.577 -9.421 -8.170 1.00 . A A . 38 ALA CA 1 1 5 1607 1 1 57 SER CB C 18.652 -9.012 -7.170 1.00 . A A . 38 ALA CB 1 1 5 1608 1 1 57 SER H H 16.780 -7.491 -7.978 1.00 . A A . 38 ALA H 1 1 5 1609 1 1 57 SER HA H 18.071 -9.798 -9.041 1.00 . A A . 38 ALA HA 1 1 5 1610 1 1 57 SER HB2 H 18.793 -7.941 -7.210 1.00 . A A . 38 ALA HB2 1 1 5 1611 1 1 57 SER HB3 H 19.580 -9.505 -7.416 1.00 . A A . 38 ALA HB3 1 1 5 1612 1 1 57 SER N N 16.821 -8.252 -8.588 1.00 . A A . 38 ALA N 1 1 5 1613 1 1 57 SER O O 16.524 -11.586 -8.170 1.00 . A A . 38 ALA O 1 1 5 1614 1 1 58 GLY C C 14.155 -11.554 -6.121 1.00 . A A . 39 SER C 1 1 5 1615 1 1 58 GLY CA C 15.544 -11.237 -5.549 1.00 . A A . 39 SER CA 1 1 5 1616 1 1 58 GLY H H 16.556 -9.432 -5.924 1.00 . A A . 39 SER H 1 1 5 1617 1 1 58 GLY N N 16.306 -10.284 -6.339 1.00 . A A . 39 SER N 1 1 5 1618 1 1 58 GLY O O 13.327 -12.158 -5.440 1.00 . A A . 39 SER O 1 1 5 1619 1 1 59 ALA C C 12.737 -12.263 -9.236 1.00 . A A . 40 GLY C 1 1 5 1620 1 1 59 ALA CA C 12.616 -11.419 -7.982 1.00 . A A . 40 GLY CA 1 1 5 1621 1 1 59 ALA H H 14.590 -10.674 -7.873 1.00 . A A . 40 GLY H 1 1 5 1622 1 1 59 ALA N N 13.903 -11.153 -7.367 1.00 . A A . 40 GLY N 1 1 5 1623 1 1 59 ALA O O 12.045 -12.021 -10.225 1.00 . A A . 40 GLY O 1 1 5 1624 1 1 60 GLY C C 14.566 -15.406 -9.914 1.00 . A A . 41 ALA C 1 1 5 1625 1 1 60 GLY CA C 13.831 -14.138 -10.330 1.00 . A A . 41 ALA CA 1 1 5 1626 1 1 60 GLY H H 14.139 -13.398 -8.378 1.00 . A A . 41 ALA H 1 1 5 1627 1 1 60 GLY N N 13.620 -13.255 -9.194 1.00 . A A . 41 ALA N 1 1 5 1628 1 1 60 GLY O O 13.948 -16.441 -9.661 1.00 . A A . 41 ALA O 1 1 5 1629 1 1 61 SER C C 18.145 -16.099 -9.236 1.00 . A A . 42 GLY C 1 1 5 1630 1 1 61 SER CA C 16.690 -16.459 -9.457 1.00 . A A . 42 GLY CA 1 1 5 1631 1 1 61 SER H H 16.312 -14.464 -10.057 1.00 . A A . 42 GLY H 1 1 5 1632 1 1 61 SER N N 15.884 -15.315 -9.844 1.00 . A A . 42 GLY N 1 1 5 1633 1 1 61 SER O O 18.520 -15.634 -8.160 1.00 . A A . 42 GLY O 1 1 5 1634 1 1 62 ILE C C 21.004 -15.833 -11.553 1.00 . A A . 43 SER C 1 1 5 1635 1 1 62 ILE CA C 20.392 -16.011 -10.169 1.00 . A A . 43 SER CA 1 1 5 1636 1 1 62 ILE CB C 21.125 -17.118 -9.411 1.00 . A A . 43 SER CB 1 1 5 1637 1 1 62 ILE H H 18.608 -16.687 -11.088 1.00 . A A . 43 SER H 1 1 5 1638 1 1 62 ILE HA H 20.495 -15.090 -9.630 1.00 . A A . 43 SER HA 1 1 5 1639 1 1 62 ILE N N 18.968 -16.315 -10.258 1.00 . A A . 43 SER N 1 1 5 1640 1 1 62 ILE O O 21.852 -14.965 -11.764 1.00 . A A . 43 SER O 1 1 5 1641 1 1 63 GLY C C 22.583 -16.654 -13.900 1.00 . A A . 44 ILE C 1 1 5 1642 1 1 63 GLY CA C 21.057 -16.603 -13.859 1.00 . A A . 44 ILE CA 1 1 5 1643 1 1 63 GLY H H 19.889 -17.318 -12.254 1.00 . A A . 44 ILE H 1 1 5 1644 1 1 63 GLY N N 20.564 -16.658 -12.490 1.00 . A A . 44 ILE N 1 1 5 1645 1 1 63 GLY O O 23.243 -15.642 -14.139 1.00 . A A . 44 ILE O 1 1 5 1646 1 1 64 ARG C C 25.020 -19.199 -14.495 1.00 . A A . 45 GLY C 1 1 5 1647 1 1 64 ARG CA C 24.579 -18.000 -13.678 1.00 . A A . 45 GLY CA 1 1 5 1648 1 1 64 ARG H H 22.561 -18.610 -13.479 1.00 . A A . 45 GLY H 1 1 5 1649 1 1 64 ARG N N 23.137 -17.839 -13.664 1.00 . A A . 45 GLY N 1 1 5 1650 1 1 64 ARG O O 25.634 -20.127 -13.967 1.00 . A A . 45 GLY O 1 1 6 1651 1 1 20 ASN C C -4.391 0.299 31.902 1.00 . A A . 1 VAL C 1 1 6 1652 1 1 20 ASN CA C -5.859 0.418 31.505 1.00 . A A . 1 VAL CA 1 1 6 1653 1 1 20 ASN CB C -6.326 1.869 31.735 1.00 . A A . 1 VAL CB 1 1 6 1654 1 1 20 ASN H H -6.717 -0.469 33.224 1.00 . A A . 1 VAL H 1 1 6 1655 1 1 20 ASN HA H -5.957 0.192 30.452 1.00 . A A . 1 VAL HA 1 1 6 1656 1 1 20 ASN N N -6.681 -0.531 32.246 1.00 . A A . 1 VAL N 1 1 6 1657 1 1 20 ASN O O -3.999 0.709 32.994 1.00 . A A . 1 VAL O 1 1 6 1658 1 1 21 TYR C C -1.336 -0.050 30.040 1.00 . A A . 2 ASN C 1 1 6 1659 1 1 21 TYR CA C -2.160 -0.436 31.265 1.00 . A A . 2 ASN CA 1 1 6 1660 1 1 21 TYR CB C -1.864 -1.883 31.663 1.00 . A A . 2 ASN CB 1 1 6 1661 1 1 21 TYR CG C -1.846 -2.077 33.167 1.00 . A A . 2 ASN CG 1 1 6 1662 1 1 21 TYR H H -3.957 -0.570 30.155 1.00 . A A . 2 ASN H 1 1 6 1663 1 1 21 TYR HA H -1.892 0.216 32.084 1.00 . A A . 2 ASN HA 1 1 6 1664 1 1 21 TYR HB2 H -2.624 -2.527 31.246 1.00 . A A . 2 ASN HB2 1 1 6 1665 1 1 21 TYR HB3 H -0.900 -2.169 31.268 1.00 . A A . 2 ASN HB3 1 1 6 1666 1 1 21 TYR N N -3.585 -0.264 31.007 1.00 . A A . 2 ASN N 1 1 6 1667 1 1 21 TYR O O -0.700 -0.898 29.413 1.00 . A A . 2 ASN O 1 1 6 1668 1 1 22 GLY C C -1.074 1.060 27.267 1.00 . A A . 3 TYR C 1 1 6 1669 1 1 22 GLY CA C -0.608 1.735 28.554 1.00 . A A . 3 TYR CA 1 1 6 1670 1 1 22 GLY H H -1.880 1.863 30.240 1.00 . A A . 3 TYR H 1 1 6 1671 1 1 22 GLY N N -1.353 1.235 29.703 1.00 . A A . 3 TYR N 1 1 6 1672 1 1 22 GLY O O -0.267 0.725 26.400 1.00 . A A . 3 TYR O 1 1 6 1673 1 1 23 ASN C C -3.975 1.095 25.273 1.00 . A A . 4 GLY C 1 1 6 1674 1 1 23 ASN CA C -2.937 0.233 25.966 1.00 . A A . 4 GLY CA 1 1 6 1675 1 1 23 ASN H H -2.980 1.154 27.872 1.00 . A A . 4 GLY H 1 1 6 1676 1 1 23 ASN N N -2.384 0.866 27.149 1.00 . A A . 4 GLY N 1 1 6 1677 1 1 23 ASN O O -4.806 0.590 24.519 1.00 . A A . 4 GLY O 1 1 6 1678 1 1 24 GLY C C -4.174 4.271 23.947 1.00 . A A . 5 ASN C 1 1 6 1679 1 1 24 GLY CA C -4.874 3.332 24.925 1.00 . A A . 5 ASN CA 1 1 6 1680 1 1 24 GLY H H -3.243 2.743 26.140 1.00 . A A . 5 ASN H 1 1 6 1681 1 1 24 GLY N N -3.929 2.399 25.529 1.00 . A A . 5 ASN N 1 1 6 1682 1 1 24 GLY O O -4.813 4.868 23.079 1.00 . A A . 5 ASN O 1 1 6 1683 1 1 25 VAL C C -0.928 5.924 23.922 1.00 . A A . 6 GLY C 1 1 6 1684 1 1 25 VAL CA C -2.098 5.269 23.213 1.00 . A A . 6 GLY CA 1 1 6 1685 1 1 25 VAL H H -2.403 3.901 24.798 1.00 . A A . 6 GLY H 1 1 6 1686 1 1 25 VAL N N -2.860 4.400 24.091 1.00 . A A . 6 GLY N 1 1 6 1687 1 1 25 VAL O O -0.787 7.146 23.896 1.00 . A A . 6 GLY O 1 1 6 1688 1 1 26 SER C C 0.775 6.858 26.077 1.00 . A A . 7 VAL C 1 1 6 1689 1 1 26 SER CA C 1.084 5.588 25.280 1.00 . A A . 7 VAL CA 1 1 6 1690 1 1 26 SER CB C 2.275 5.824 24.316 1.00 . A A . 7 VAL CB 1 1 6 1691 1 1 26 SER H H -0.263 4.139 24.530 1.00 . A A . 7 VAL H 1 1 6 1692 1 1 26 SER HA H 1.373 4.815 25.976 1.00 . A A . 7 VAL HA 1 1 6 1693 1 1 26 SER N N -0.090 5.103 24.555 1.00 . A A . 7 VAL N 1 1 6 1694 1 1 26 SER O O -0.385 7.174 26.336 1.00 . A A . 7 VAL O 1 1 6 1695 1 1 27 CYS C C 2.709 9.841 26.806 1.00 . A A . 8 SER C 1 1 6 1696 1 1 27 CYS CA C 1.669 8.808 27.227 1.00 . A A . 8 SER CA 1 1 6 1697 1 1 27 CYS CB C 1.796 8.521 28.724 1.00 . A A . 8 SER CB 1 1 6 1698 1 1 27 CYS H H 2.720 7.270 26.221 1.00 . A A . 8 SER H 1 1 6 1699 1 1 27 CYS HA H 0.685 9.202 27.026 1.00 . A A . 8 SER HA 1 1 6 1700 1 1 27 CYS HB2 H 2.644 7.875 28.895 1.00 . A A . 8 SER HB2 1 1 6 1701 1 1 27 CYS HB3 H 1.938 9.450 29.255 1.00 . A A . 8 SER HB3 1 1 6 1702 1 1 27 CYS N N 1.822 7.576 26.460 1.00 . A A . 8 SER N 1 1 6 1703 1 1 27 CYS O O 3.822 9.492 26.414 1.00 . A A . 8 SER O 1 1 6 1704 1 1 28 SER C C 4.460 12.232 27.425 1.00 . A A . 9 CYS C 1 1 6 1705 1 1 28 SER CA C 3.240 12.197 26.512 1.00 . A A . 9 CYS CA 1 1 6 1706 1 1 28 SER CB C 2.513 13.541 26.565 1.00 . A A . 9 CYS CB 1 1 6 1707 1 1 28 SER H H 1.436 11.332 27.205 1.00 . A A . 9 CYS H 1 1 6 1708 1 1 28 SER HA H 3.569 12.016 25.501 1.00 . A A . 9 CYS HA 1 1 6 1709 1 1 28 SER HB2 H 1.783 13.517 27.358 1.00 . A A . 9 CYS HB2 1 1 6 1710 1 1 28 SER HB3 H 3.234 14.321 26.769 1.00 . A A . 9 CYS HB3 1 1 6 1711 1 1 28 SER N N 2.337 11.115 26.887 1.00 . A A . 9 CYS N 1 1 6 1712 1 1 28 SER O O 4.336 12.399 28.639 1.00 . A A . 9 CYS O 1 1 6 1713 1 1 29 LYS C C 8.073 11.915 26.647 1.00 . A A . 10 SER C 1 1 6 1714 1 1 29 LYS CA C 6.883 12.089 27.582 1.00 . A A . 10 SER CA 1 1 6 1715 1 1 29 LYS CB C 6.886 10.986 28.640 1.00 . A A . 10 SER CB 1 1 6 1716 1 1 29 LYS H H 5.666 11.947 25.859 1.00 . A A . 10 SER H 1 1 6 1717 1 1 29 LYS HA H 6.963 13.048 28.073 1.00 . A A . 10 SER HA 1 1 6 1718 1 1 29 LYS HB2 H 7.898 10.816 28.975 1.00 . A A . 10 SER HB2 1 1 6 1719 1 1 29 LYS HB3 H 6.276 11.291 29.477 1.00 . A A . 10 SER HB3 1 1 6 1720 1 1 29 LYS N N 5.636 12.075 26.831 1.00 . A A . 10 SER N 1 1 6 1721 1 1 29 LYS O O 8.247 10.860 26.039 1.00 . A A . 10 SER O 1 1 6 1722 1 1 30 THR C C 9.698 12.680 24.223 1.00 . A A . 11 LYS C 1 1 6 1723 1 1 30 THR CA C 10.069 12.917 25.682 1.00 . A A . 11 LYS CA 1 1 6 1724 1 1 30 THR CB C 10.994 11.814 26.160 1.00 . A A . 11 LYS CB 1 1 6 1725 1 1 30 THR H H 8.706 13.763 27.054 1.00 . A A . 11 LYS H 1 1 6 1726 1 1 30 THR HA H 10.574 13.863 25.764 1.00 . A A . 11 LYS HA 1 1 6 1727 1 1 30 THR N N 8.892 12.956 26.540 1.00 . A A . 11 LYS N 1 1 6 1728 1 1 30 THR O O 10.561 12.393 23.393 1.00 . A A . 11 LYS O 1 1 6 1729 1 1 31 LYS C C 6.690 13.404 22.249 1.00 . A A . 12 THR C 1 1 6 1730 1 1 31 LYS CA C 7.938 12.567 22.563 1.00 . A A . 12 THR CA 1 1 6 1731 1 1 31 LYS CB C 7.671 11.070 22.364 1.00 . A A . 12 THR CB 1 1 6 1732 1 1 31 LYS H H 7.778 13.002 24.615 1.00 . A A . 12 THR H 1 1 6 1733 1 1 31 LYS HA H 8.724 12.867 21.896 1.00 . A A . 12 THR HA 1 1 6 1734 1 1 31 LYS N N 8.414 12.786 23.916 1.00 . A A . 12 THR N 1 1 6 1735 1 1 31 LYS O O 6.246 13.451 21.102 1.00 . A A . 12 THR O 1 1 6 1736 1 1 32 CYS C C 3.818 14.124 22.415 1.00 . A A . 13 LYS C 1 1 6 1737 1 1 32 CYS CA C 4.950 14.905 23.063 1.00 . A A . 13 LYS CA 1 1 6 1738 1 1 32 CYS CB C 5.309 16.088 22.192 1.00 . A A . 13 LYS CB 1 1 6 1739 1 1 32 CYS H H 6.526 14.012 24.150 1.00 . A A . 13 LYS H 1 1 6 1740 1 1 32 CYS HA H 4.625 15.251 24.026 1.00 . A A . 13 LYS HA 1 1 6 1741 1 1 32 CYS HB2 H 6.375 16.239 22.251 1.00 . A A . 13 LYS HB2 1 1 6 1742 1 1 32 CYS HB3 H 5.042 15.848 21.177 1.00 . A A . 13 LYS HB3 1 1 6 1743 1 1 32 CYS N N 6.133 14.071 23.260 1.00 . A A . 13 LYS N 1 1 6 1744 1 1 32 CYS O O 2.952 14.688 21.748 1.00 . A A . 13 LYS O 1 1 6 1745 1 1 33 SER C C 2.955 11.842 20.552 1.00 . A A . 14 CYS C 1 1 6 1746 1 1 33 SER CA C 2.848 11.919 22.071 1.00 . A A . 14 CYS CA 1 1 6 1747 1 1 33 SER CB C 1.436 12.359 22.472 1.00 . A A . 14 CYS CB 1 1 6 1748 1 1 33 SER H H 4.580 12.474 23.156 1.00 . A A . 14 CYS H 1 1 6 1749 1 1 33 SER HA H 3.036 10.937 22.481 1.00 . A A . 14 CYS HA 1 1 6 1750 1 1 33 SER HB2 H 1.299 13.395 22.206 1.00 . A A . 14 CYS HB2 1 1 6 1751 1 1 33 SER HB3 H 0.716 11.759 21.934 1.00 . A A . 14 CYS HB3 1 1 6 1752 1 1 33 SER N N 3.851 12.829 22.620 1.00 . A A . 14 CYS N 1 1 6 1753 1 1 33 SER O O 2.411 12.684 19.837 1.00 . A A . 14 CYS O 1 1 6 1754 1 1 34 VAL C C 3.799 9.152 18.275 1.00 . A A . 15 SER C 1 1 6 1755 1 1 34 VAL CA C 3.837 10.634 18.633 1.00 . A A . 15 SER CA 1 1 6 1756 1 1 34 VAL CB C 5.162 11.247 18.176 1.00 . A A . 15 SER CB 1 1 6 1757 1 1 34 VAL H H 4.067 10.186 20.688 1.00 . A A . 15 SER H 1 1 6 1758 1 1 34 VAL HA H 3.025 11.135 18.127 1.00 . A A . 15 SER HA 1 1 6 1759 1 1 34 VAL N N 3.658 10.825 20.067 1.00 . A A . 15 SER N 1 1 6 1760 1 1 34 VAL O O 4.276 8.308 19.032 1.00 . A A . 15 SER O 1 1 6 1761 1 1 35 ASN C C 4.273 7.113 15.709 1.00 . A A . 16 VAL C 1 1 6 1762 1 1 35 ASN CA C 3.130 7.461 16.658 1.00 . A A . 16 VAL CA 1 1 6 1763 1 1 35 ASN CB C 1.781 7.197 15.956 1.00 . A A . 16 VAL CB 1 1 6 1764 1 1 35 ASN H H 2.866 9.558 16.553 1.00 . A A . 16 VAL H 1 1 6 1765 1 1 35 ASN HA H 3.190 6.820 17.526 1.00 . A A . 16 VAL HA 1 1 6 1766 1 1 35 ASN N N 3.228 8.842 17.115 1.00 . A A . 16 VAL N 1 1 6 1767 1 1 35 ASN O O 4.076 6.435 14.700 1.00 . A A . 16 VAL O 1 1 6 1768 1 1 36 TRP C C 6.514 7.995 13.857 1.00 . A A . 17 ASN C 1 1 6 1769 1 1 36 TRP CA C 6.650 7.326 15.220 1.00 . A A . 17 ASN CA 1 1 6 1770 1 1 36 TRP CB C 6.862 5.820 15.050 1.00 . A A . 17 ASN CB 1 1 6 1771 1 1 36 TRP CG C 6.755 5.068 16.362 1.00 . A A . 17 ASN CG 1 1 6 1772 1 1 36 TRP H H 5.567 8.119 16.853 1.00 . A A . 17 ASN H 1 1 6 1773 1 1 36 TRP HA H 7.505 7.745 15.730 1.00 . A A . 17 ASN HA 1 1 6 1774 1 1 36 TRP HB2 H 6.115 5.434 14.373 1.00 . A A . 17 ASN HB2 1 1 6 1775 1 1 36 TRP HB3 H 7.843 5.646 14.635 1.00 . A A . 17 ASN HB3 1 1 6 1776 1 1 36 TRP N N 5.473 7.583 16.040 1.00 . A A . 17 ASN N 1 1 6 1777 1 1 36 TRP O O 6.694 7.359 12.818 1.00 . A A . 17 ASN O 1 1 6 1778 1 1 37 GLY C C 7.325 10.084 11.836 1.00 . A A . 18 TRP C 1 1 6 1779 1 1 37 GLY CA C 6.026 10.045 12.639 1.00 . A A . 18 TRP CA 1 1 6 1780 1 1 37 GLY H H 6.059 9.734 14.731 1.00 . A A . 18 TRP H 1 1 6 1781 1 1 37 GLY N N 6.192 9.284 13.871 1.00 . A A . 18 TRP N 1 1 6 1782 1 1 37 GLY O O 7.309 10.304 10.625 1.00 . A A . 18 TRP O 1 1 6 1783 1 1 38 GLN C C 10.334 8.494 11.738 1.00 . A A . 19 GLY C 1 1 6 1784 1 1 38 GLN CA C 9.734 9.880 11.847 1.00 . A A . 19 GLY CA 1 1 6 1785 1 1 38 GLN H H 8.400 9.694 13.479 1.00 . A A . 19 GLY H 1 1 6 1786 1 1 38 GLN N N 8.447 9.867 12.516 1.00 . A A . 19 GLY N 1 1 6 1787 1 1 38 GLN O O 10.753 8.069 10.659 1.00 . A A . 19 GLY O 1 1 6 1788 1 1 39 ALA C C 10.213 5.566 11.837 1.00 . A A . 20 GLN C 1 1 6 1789 1 1 39 ALA CA C 10.911 6.429 12.877 1.00 . A A . 20 GLN CA 1 1 6 1790 1 1 39 ALA CB C 10.756 5.810 14.268 1.00 . A A . 20 GLN CB 1 1 6 1791 1 1 39 ALA H H 10.012 8.166 13.684 1.00 . A A . 20 GLN H 1 1 6 1792 1 1 39 ALA HA H 11.961 6.488 12.629 1.00 . A A . 20 GLN HA 1 1 6 1793 1 1 39 ALA HB2 H 9.877 6.226 14.738 1.00 . A A . 20 GLN HB2 1 1 6 1794 1 1 39 ALA HB3 H 10.624 4.743 14.161 1.00 . A A . 20 GLN HB3 1 1 6 1795 1 1 39 ALA N N 10.367 7.780 12.857 1.00 . A A . 20 GLN N 1 1 6 1796 1 1 39 ALA O O 10.840 5.106 10.883 1.00 . A A . 20 GLN O 1 1 6 1797 1 1 40 PHE C C 8.087 5.207 9.692 1.00 . A A . 21 ALA C 1 1 6 1798 1 1 40 PHE CA C 8.154 4.555 11.058 1.00 . A A . 21 ALA CA 1 1 6 1799 1 1 40 PHE CB C 6.772 4.215 11.577 1.00 . A A . 21 ALA CB 1 1 6 1800 1 1 40 PHE H H 8.453 5.754 12.781 1.00 . A A . 21 ALA H 1 1 6 1801 1 1 40 PHE HA H 8.697 3.655 10.942 1.00 . A A . 21 ALA HA 1 1 6 1802 1 1 40 PHE HB2 H 6.065 4.950 11.226 1.00 . A A . 21 ALA HB2 1 1 6 1803 1 1 40 PHE HB3 H 6.784 4.208 12.656 1.00 . A A . 21 ALA HB3 1 1 6 1804 1 1 40 PHE N N 8.909 5.356 12.011 1.00 . A A . 21 ALA N 1 1 6 1805 1 1 40 PHE O O 7.589 4.624 8.729 1.00 . A A . 21 ALA O 1 1 6 1806 1 1 41 GLN C C 9.731 6.426 7.490 1.00 . A A . 22 PHE C 1 1 6 1807 1 1 41 GLN CA C 8.700 7.118 8.357 1.00 . A A . 22 PHE CA 1 1 6 1808 1 1 41 GLN CB C 9.081 8.583 8.584 1.00 . A A . 22 PHE CB 1 1 6 1809 1 1 41 GLN CG C 8.565 9.510 7.520 1.00 . A A . 22 PHE CG 1 1 6 1810 1 1 41 GLN H H 9.042 6.764 10.403 1.00 . A A . 22 PHE H 1 1 6 1811 1 1 41 GLN HA H 7.734 7.059 7.883 1.00 . A A . 22 PHE HA 1 1 6 1812 1 1 41 GLN HB2 H 8.682 8.910 9.532 1.00 . A A . 22 PHE HB2 1 1 6 1813 1 1 41 GLN HB3 H 10.159 8.667 8.605 1.00 . A A . 22 PHE HB3 1 1 6 1814 1 1 41 GLN N N 8.636 6.393 9.611 1.00 . A A . 22 PHE N 1 1 6 1815 1 1 41 GLN O O 9.541 6.230 6.290 1.00 . A A . 22 PHE O 1 1 6 1816 1 1 42 GLU C C 11.444 3.826 7.296 1.00 . A A . 23 GLN C 1 1 6 1817 1 1 42 GLU CA C 11.877 5.279 7.493 1.00 . A A . 23 GLN CA 1 1 6 1818 1 1 42 GLU CB C 13.153 5.342 8.339 1.00 . A A . 23 GLN CB 1 1 6 1819 1 1 42 GLU CD C 15.602 5.949 8.239 1.00 . A A . 23 GLN CD 1 1 6 1820 1 1 42 GLU CG C 14.196 6.304 7.795 1.00 . A A . 23 GLN CG 1 1 6 1821 1 1 42 GLU H H 10.870 6.175 9.113 1.00 . A A . 23 GLN H 1 1 6 1822 1 1 42 GLU HA H 12.060 5.730 6.531 1.00 . A A . 23 GLN HA 1 1 6 1823 1 1 42 GLU HB2 H 12.892 5.655 9.342 1.00 . A A . 23 GLN HB2 1 1 6 1824 1 1 42 GLU HB3 H 13.592 4.356 8.383 1.00 . A A . 23 GLN HB3 1 1 6 1825 1 1 42 GLU HG2 H 14.160 6.283 6.717 1.00 . A A . 23 GLN HG2 1 1 6 1826 1 1 42 GLU HG3 H 13.964 7.300 8.144 1.00 . A A . 23 GLN HG3 1 1 6 1827 1 1 42 GLU N N 10.810 6.010 8.147 1.00 . A A . 23 GLN N 1 1 6 1828 1 1 42 GLU O O 11.968 3.118 6.437 1.00 . A A . 23 GLN O 1 1 6 1829 1 1 42 GLU OE1 O 15.951 6.091 9.411 1.00 . A A . 23 GLN OE1 1 1 6 1830 1 1 43 ARG C C 9.250 1.803 6.689 1.00 . A A . 24 GLU C 1 1 6 1831 1 1 43 ARG CA C 9.941 2.040 8.028 1.00 . A A . 24 GLU CA 1 1 6 1832 1 1 43 ARG CB C 8.955 1.784 9.169 1.00 . A A . 24 GLU CB 1 1 6 1833 1 1 43 ARG CD C 8.634 1.228 11.611 1.00 . A A . 24 GLU CD 1 1 6 1834 1 1 43 ARG CG C 9.628 1.427 10.484 1.00 . A A . 24 GLU CG 1 1 6 1835 1 1 43 ARG H H 10.088 4.013 8.761 1.00 . A A . 24 GLU H 1 1 6 1836 1 1 43 ARG HA H 10.765 1.360 8.125 1.00 . A A . 24 GLU HA 1 1 6 1837 1 1 43 ARG HB2 H 8.361 2.671 9.321 1.00 . A A . 24 GLU HB2 1 1 6 1838 1 1 43 ARG HB3 H 8.303 0.969 8.891 1.00 . A A . 24 GLU HB3 1 1 6 1839 1 1 43 ARG HG2 H 10.187 0.513 10.351 1.00 . A A . 24 GLU HG2 1 1 6 1840 1 1 43 ARG HG3 H 10.303 2.225 10.756 1.00 . A A . 24 GLU HG3 1 1 6 1841 1 1 43 ARG N N 10.467 3.397 8.103 1.00 . A A . 24 GLU N 1 1 6 1842 1 1 43 ARG O O 9.416 0.753 6.068 1.00 . A A . 24 GLU O 1 1 6 1843 1 1 44 TYR C C 8.703 2.666 3.814 1.00 . A A . 25 ARG C 1 1 6 1844 1 1 44 TYR CA C 7.746 2.697 4.996 1.00 . A A . 25 ARG CA 1 1 6 1845 1 1 44 TYR CB C 6.778 3.874 4.858 1.00 . A A . 25 ARG CB 1 1 6 1846 1 1 44 TYR CG C 5.398 3.597 5.433 1.00 . A A . 25 ARG CG 1 1 6 1847 1 1 44 TYR CZ C 2.868 4.995 3.056 1.00 . A A . 25 ARG CZ 1 1 6 1848 1 1 44 TYR H H 8.378 3.597 6.801 1.00 . A A . 25 ARG H 1 1 6 1849 1 1 44 TYR HA H 7.187 1.782 5.008 1.00 . A A . 25 ARG HA 1 1 6 1850 1 1 44 TYR HB2 H 7.193 4.729 5.374 1.00 . A A . 25 ARG HB2 1 1 6 1851 1 1 44 TYR HB3 H 6.669 4.115 3.811 1.00 . A A . 25 ARG HB3 1 1 6 1852 1 1 44 TYR HD2 H 4.794 3.053 3.464 1.00 . A A . 25 ARG HD2 1 1 6 1853 1 1 44 TYR N N 8.471 2.789 6.256 1.00 . A A . 25 ARG N 1 1 6 1854 1 1 44 TYR O O 8.422 2.044 2.789 1.00 . A A . 25 ARG O 1 1 6 1855 1 1 45 THR C C 11.435 2.005 2.672 1.00 . A A . 26 TYR C 1 1 6 1856 1 1 45 THR CA C 10.838 3.388 2.910 1.00 . A A . 26 TYR CA 1 1 6 1857 1 1 45 THR CB C 11.943 4.384 3.267 1.00 . A A . 26 TYR CB 1 1 6 1858 1 1 45 THR H H 9.996 3.809 4.804 1.00 . A A . 26 TYR H 1 1 6 1859 1 1 45 THR HA H 10.348 3.714 2.007 1.00 . A A . 26 TYR HA 1 1 6 1860 1 1 45 THR N N 9.833 3.338 3.964 1.00 . A A . 26 TYR N 1 1 6 1861 1 1 45 THR O O 11.550 1.557 1.532 1.00 . A A . 26 TYR O 1 1 6 1862 1 1 46 ALA C C 11.398 -0.977 3.037 1.00 . A A . 27 THR C 1 1 6 1863 1 1 46 ALA CA C 12.387 -0.001 3.663 1.00 . A A . 27 THR CA 1 1 6 1864 1 1 46 ALA CB C 12.803 -0.497 5.049 1.00 . A A . 27 THR CB 1 1 6 1865 1 1 46 ALA H H 11.685 1.742 4.638 1.00 . A A . 27 THR H 1 1 6 1866 1 1 46 ALA HA H 13.262 0.060 3.034 1.00 . A A . 27 THR HA 1 1 6 1867 1 1 46 ALA N N 11.807 1.333 3.756 1.00 . A A . 27 THR N 1 1 6 1868 1 1 46 ALA O O 11.788 -1.902 2.325 1.00 . A A . 27 THR O 1 1 6 1869 1 1 47 GLY C C 9.022 -1.543 1.245 1.00 . A A . 28 ALA C 1 1 6 1870 1 1 47 GLY CA C 9.068 -1.624 2.767 1.00 . A A . 28 ALA CA 1 1 6 1871 1 1 47 GLY H H 9.862 -0.010 3.880 1.00 . A A . 28 ALA H 1 1 6 1872 1 1 47 GLY N N 10.113 -0.763 3.306 1.00 . A A . 28 ALA N 1 1 6 1873 1 1 47 GLY O O 8.806 -2.548 0.568 1.00 . A A . 28 ALA O 1 1 6 1874 1 1 48 ILE C C 10.432 -0.721 -1.406 1.00 . A A . 29 GLY C 1 1 6 1875 1 1 48 ILE CA C 9.202 -0.152 -0.724 1.00 . A A . 29 GLY CA 1 1 6 1876 1 1 48 ILE H H 9.391 0.422 1.305 1.00 . A A . 29 GLY H 1 1 6 1877 1 1 48 ILE N N 9.225 -0.342 0.715 1.00 . A A . 29 GLY N 1 1 6 1878 1 1 48 ILE O O 10.322 -1.436 -2.402 1.00 . A A . 29 GLY O 1 1 6 1879 1 1 49 ASN C C 12.890 -2.411 -1.476 1.00 . A A . 30 ILE C 1 1 6 1880 1 1 49 ASN CA C 12.860 -0.885 -1.434 1.00 . A A . 30 ILE CA 1 1 6 1881 1 1 49 ASN CB C 14.073 -0.374 -0.631 1.00 . A A . 30 ILE CB 1 1 6 1882 1 1 49 ASN H H 11.628 0.173 -0.076 1.00 . A A . 30 ILE H 1 1 6 1883 1 1 49 ASN HA H 12.937 -0.507 -2.442 1.00 . A A . 30 ILE HA 1 1 6 1884 1 1 49 ASN N N 11.606 -0.401 -0.869 1.00 . A A . 30 ILE N 1 1 6 1885 1 1 49 ASN O O 13.520 -3.004 -2.349 1.00 . A A . 30 ILE O 1 1 6 1886 1 1 50 SER C C 11.768 -5.097 -1.804 1.00 . A A . 31 ASN C 1 1 6 1887 1 1 50 SER CA C 12.144 -4.496 -0.453 1.00 . A A . 31 ASN CA 1 1 6 1888 1 1 50 SER CB C 11.139 -4.937 0.615 1.00 . A A . 31 ASN CB 1 1 6 1889 1 1 50 SER H H 11.716 -2.509 0.141 1.00 . A A . 31 ASN H 1 1 6 1890 1 1 50 SER HA H 13.127 -4.852 -0.177 1.00 . A A . 31 ASN HA 1 1 6 1891 1 1 50 SER HB2 H 10.516 -4.097 0.881 1.00 . A A . 31 ASN HB2 1 1 6 1892 1 1 50 SER HB3 H 10.520 -5.728 0.217 1.00 . A A . 31 ASN HB3 1 1 6 1893 1 1 50 SER N N 12.199 -3.039 -0.526 1.00 . A A . 31 ASN N 1 1 6 1894 1 1 50 SER O O 12.567 -5.796 -2.427 1.00 . A A . 31 ASN O 1 1 6 1895 1 1 51 PHE C C 11.003 -4.872 -4.663 1.00 . A A . 32 SER C 1 1 6 1896 1 1 51 PHE CA C 10.076 -5.320 -3.538 1.00 . A A . 32 SER CA 1 1 6 1897 1 1 51 PHE CB C 8.650 -4.834 -3.808 1.00 . A A . 32 SER CB 1 1 6 1898 1 1 51 PHE H H 9.959 -4.245 -1.717 1.00 . A A . 32 SER H 1 1 6 1899 1 1 51 PHE HA H 10.079 -6.398 -3.491 1.00 . A A . 32 SER HA 1 1 6 1900 1 1 51 PHE HB2 H 8.561 -3.801 -3.509 1.00 . A A . 32 SER HB2 1 1 6 1901 1 1 51 PHE HB3 H 8.436 -4.923 -4.864 1.00 . A A . 32 SER HB3 1 1 6 1902 1 1 51 PHE N N 10.549 -4.812 -2.256 1.00 . A A . 32 SER N 1 1 6 1903 1 1 51 PHE O O 11.200 -5.589 -5.644 1.00 . A A . 32 SER O 1 1 6 1904 1 1 52 VAL C C 13.774 -3.956 -5.552 1.00 . A A . 33 PHE C 1 1 6 1905 1 1 52 VAL CA C 12.489 -3.132 -5.495 1.00 . A A . 33 PHE CA 1 1 6 1906 1 1 52 VAL CB C 12.796 -1.663 -5.163 1.00 . A A . 33 PHE CB 1 1 6 1907 1 1 52 VAL H H 11.379 -3.163 -3.699 1.00 . A A . 33 PHE H 1 1 6 1908 1 1 52 VAL HA H 12.000 -3.181 -6.456 1.00 . A A . 33 PHE HA 1 1 6 1909 1 1 52 VAL N N 11.575 -3.683 -4.505 1.00 . A A . 33 PHE N 1 1 6 1910 1 1 52 VAL O O 14.364 -4.135 -6.621 1.00 . A A . 33 PHE O 1 1 6 1911 1 1 53 SER C C 15.348 -6.437 -5.294 1.00 . A A . 34 VAL C 1 1 6 1912 1 1 53 SER CA C 15.414 -5.266 -4.321 1.00 . A A . 34 VAL CA 1 1 6 1913 1 1 53 SER CB C 15.651 -5.800 -2.893 1.00 . A A . 34 VAL CB 1 1 6 1914 1 1 53 SER H H 13.688 -4.289 -3.581 1.00 . A A . 34 VAL H 1 1 6 1915 1 1 53 SER HA H 16.250 -4.637 -4.593 1.00 . A A . 34 VAL HA 1 1 6 1916 1 1 53 SER N N 14.201 -4.462 -4.398 1.00 . A A . 34 VAL N 1 1 6 1917 1 1 53 SER O O 16.053 -6.448 -6.300 1.00 . A A . 34 VAL O 1 1 6 1918 1 1 54 GLY C C 14.205 -8.224 -7.287 1.00 . A A . 35 SER C 1 1 6 1919 1 1 54 GLY CA C 14.390 -8.593 -5.835 1.00 . A A . 35 SER CA 1 1 6 1920 1 1 54 GLY H H 14.001 -7.389 -4.168 1.00 . A A . 35 SER H 1 1 6 1921 1 1 54 GLY N N 14.515 -7.426 -4.990 1.00 . A A . 35 SER N 1 1 6 1922 1 1 54 GLY O O 14.957 -8.692 -8.140 1.00 . A A . 35 SER O 1 1 6 1923 1 1 55 VAL C C 14.386 -6.877 -9.645 1.00 . A A . 36 GLY C 1 1 6 1924 1 1 55 VAL CA C 13.043 -6.962 -8.952 1.00 . A A . 36 GLY CA 1 1 6 1925 1 1 55 VAL H H 12.682 -7.013 -6.858 1.00 . A A . 36 GLY H 1 1 6 1926 1 1 55 VAL N N 13.238 -7.373 -7.575 1.00 . A A . 36 GLY N 1 1 6 1927 1 1 55 VAL O O 14.568 -7.368 -10.759 1.00 . A A . 36 GLY O 1 1 6 1928 1 1 56 ALA C C 17.571 -7.327 -8.950 1.00 . A A . 37 VAL C 1 1 6 1929 1 1 56 ALA CA C 16.696 -6.151 -9.397 1.00 . A A . 37 VAL CA 1 1 6 1930 1 1 56 ALA CB C 17.326 -4.831 -8.904 1.00 . A A . 37 VAL CB 1 1 6 1931 1 1 56 ALA H H 15.127 -5.954 -8.039 1.00 . A A . 37 VAL H 1 1 6 1932 1 1 56 ALA HA H 16.666 -6.131 -10.468 1.00 . A A . 37 VAL HA 1 1 6 1933 1 1 56 ALA N N 15.339 -6.282 -8.931 1.00 . A A . 37 VAL N 1 1 6 1934 1 1 56 ALA O O 17.981 -8.160 -9.758 1.00 . A A . 37 VAL O 1 1 6 1935 1 1 57 SER C C 18.035 -9.657 -6.693 1.00 . A A . 38 ALA C 1 1 6 1936 1 1 57 SER CA C 18.744 -8.360 -7.059 1.00 . A A . 38 ALA CA 1 1 6 1937 1 1 57 SER CB C 19.430 -7.796 -5.820 1.00 . A A . 38 ALA CB 1 1 6 1938 1 1 57 SER H H 17.533 -6.648 -7.068 1.00 . A A . 38 ALA H 1 1 6 1939 1 1 57 SER HA H 19.506 -8.577 -7.779 1.00 . A A . 38 ALA HA 1 1 6 1940 1 1 57 SER HB2 H 19.331 -6.722 -5.811 1.00 . A A . 38 ALA HB2 1 1 6 1941 1 1 57 SER HB3 H 20.476 -8.062 -5.834 1.00 . A A . 38 ALA HB3 1 1 6 1942 1 1 57 SER N N 17.883 -7.348 -7.650 1.00 . A A . 38 ALA N 1 1 6 1943 1 1 57 SER O O 18.209 -10.694 -7.332 1.00 . A A . 38 ALA O 1 1 6 1944 1 1 58 GLY C C 15.505 -11.311 -5.930 1.00 . A A . 39 SER C 1 1 6 1945 1 1 58 GLY CA C 16.584 -10.707 -5.021 1.00 . A A . 39 SER CA 1 1 6 1946 1 1 58 GLY H H 17.248 -8.714 -5.132 1.00 . A A . 39 SER H 1 1 6 1947 1 1 58 GLY N N 17.290 -9.575 -5.601 1.00 . A A . 39 SER N 1 1 6 1948 1 1 58 GLY O O 14.752 -12.186 -5.501 1.00 . A A . 39 SER O 1 1 6 1949 1 1 59 ALA C C 15.051 -11.969 -9.349 1.00 . A A . 40 GLY C 1 1 6 1950 1 1 59 ALA CA C 14.433 -11.376 -8.097 1.00 . A A . 40 GLY CA 1 1 6 1951 1 1 59 ALA H H 16.043 -10.153 -7.480 1.00 . A A . 40 GLY H 1 1 6 1952 1 1 59 ALA N N 15.428 -10.853 -7.179 1.00 . A A . 40 GLY N 1 1 6 1953 1 1 59 ALA O O 14.552 -12.957 -9.888 1.00 . A A . 40 GLY O 1 1 6 1954 1 1 60 GLY C C 18.188 -11.167 -11.157 1.00 . A A . 41 ALA C 1 1 6 1955 1 1 60 GLY CA C 16.826 -11.836 -11.007 1.00 . A A . 41 ALA CA 1 1 6 1956 1 1 60 GLY H H 16.491 -10.585 -9.342 1.00 . A A . 41 ALA H 1 1 6 1957 1 1 60 GLY N N 16.140 -11.365 -9.813 1.00 . A A . 41 ALA N 1 1 6 1958 1 1 60 GLY O O 18.487 -10.568 -12.192 1.00 . A A . 41 ALA O 1 1 6 1959 1 1 61 SER C C 21.030 -10.730 -8.810 1.00 . A A . 42 GLY C 1 1 6 1960 1 1 61 SER CA C 20.331 -10.672 -10.154 1.00 . A A . 42 GLY CA 1 1 6 1961 1 1 61 SER H H 18.718 -11.761 -9.321 1.00 . A A . 42 GLY H 1 1 6 1962 1 1 61 SER N N 19.011 -11.272 -10.119 1.00 . A A . 42 GLY N 1 1 6 1963 1 1 61 SER O O 21.392 -9.698 -8.246 1.00 . A A . 42 GLY O 1 1 6 1964 1 1 62 ILE C C 23.316 -12.613 -7.201 1.00 . A A . 43 SER C 1 1 6 1965 1 1 62 ILE CA C 21.880 -12.130 -7.010 1.00 . A A . 43 SER CA 1 1 6 1966 1 1 62 ILE CB C 21.099 -13.130 -6.156 1.00 . A A . 43 SER CB 1 1 6 1967 1 1 62 ILE H H 20.911 -12.725 -8.794 1.00 . A A . 43 SER H 1 1 6 1968 1 1 62 ILE HA H 21.899 -11.176 -6.504 1.00 . A A . 43 SER HA 1 1 6 1969 1 1 62 ILE N N 21.221 -11.940 -8.296 1.00 . A A . 43 SER N 1 1 6 1970 1 1 62 ILE O O 23.688 -13.691 -6.734 1.00 . A A . 43 SER O 1 1 6 1971 1 1 63 GLY C C 25.660 -13.582 -8.634 1.00 . A A . 44 ILE C 1 1 6 1972 1 1 63 GLY CA C 25.516 -12.142 -8.142 1.00 . A A . 44 ILE CA 1 1 6 1973 1 1 63 GLY H H 23.765 -10.962 -8.228 1.00 . A A . 44 ILE H 1 1 6 1974 1 1 63 GLY N N 24.119 -11.806 -7.888 1.00 . A A . 44 ILE N 1 1 6 1975 1 1 63 GLY O O 26.191 -14.441 -7.930 1.00 . A A . 44 ILE O 1 1 6 1976 1 1 64 ARG C C 26.176 -15.228 -11.626 1.00 . A A . 45 GLY C 1 1 6 1977 1 1 64 ARG CA C 25.267 -15.170 -10.414 1.00 . A A . 45 GLY CA 1 1 6 1978 1 1 64 ARG H H 24.769 -13.113 -10.364 1.00 . A A . 45 GLY H 1 1 6 1979 1 1 64 ARG N N 25.182 -13.837 -9.848 1.00 . A A . 45 GLY N 1 1 6 1980 1 1 64 ARG O O 26.791 -16.259 -11.900 1.00 . A A . 45 GLY O 1 1 7 1981 1 1 20 ASN C C 3.116 18.597 5.629 1.00 . A A . 1 VAL C 1 1 7 1982 1 1 20 ASN CA C 2.821 18.855 7.102 1.00 . A A . 1 VAL CA 1 1 7 1983 1 1 20 ASN CB C 3.459 17.735 7.946 1.00 . A A . 1 VAL CB 1 1 7 1984 1 1 20 ASN H H 0.910 18.172 7.701 1.00 . A A . 1 VAL H 1 1 7 1985 1 1 20 ASN HA H 3.268 19.795 7.391 1.00 . A A . 1 VAL HA 1 1 7 1986 1 1 20 ASN N N 1.385 18.948 7.341 1.00 . A A . 1 VAL N 1 1 7 1987 1 1 20 ASN O O 2.201 18.505 4.811 1.00 . A A . 1 VAL O 1 1 7 1988 1 1 21 TYR C C 5.826 17.097 3.857 1.00 . A A . 2 ASN C 1 1 7 1989 1 1 21 TYR CA C 4.811 18.234 3.921 1.00 . A A . 2 ASN CA 1 1 7 1990 1 1 21 TYR CB C 5.407 19.504 3.310 1.00 . A A . 2 ASN CB 1 1 7 1991 1 1 21 TYR CG C 5.164 19.596 1.816 1.00 . A A . 2 ASN CG 1 1 7 1992 1 1 21 TYR H H 5.080 18.566 5.995 1.00 . A A . 2 ASN H 1 1 7 1993 1 1 21 TYR HA H 3.935 17.952 3.358 1.00 . A A . 2 ASN HA 1 1 7 1994 1 1 21 TYR HB2 H 4.960 20.368 3.781 1.00 . A A . 2 ASN HB2 1 1 7 1995 1 1 21 TYR HB3 H 6.473 19.515 3.484 1.00 . A A . 2 ASN HB3 1 1 7 1996 1 1 21 TYR N N 4.397 18.483 5.298 1.00 . A A . 2 ASN N 1 1 7 1997 1 1 21 TYR O O 6.882 17.225 3.235 1.00 . A A . 2 ASN O 1 1 7 1998 1 1 22 GLY C C 7.720 15.164 5.161 1.00 . A A . 3 TYR C 1 1 7 1999 1 1 22 GLY CA C 6.378 14.822 4.521 1.00 . A A . 3 TYR CA 1 1 7 2000 1 1 22 GLY H H 4.642 15.942 4.981 1.00 . A A . 3 TYR H 1 1 7 2001 1 1 22 GLY N N 5.497 15.984 4.504 1.00 . A A . 3 TYR N 1 1 7 2002 1 1 22 GLY O O 8.711 15.388 4.467 1.00 . A A . 3 TYR O 1 1 7 2003 1 1 23 ASN C C 9.222 14.579 8.364 1.00 . A A . 4 GLY C 1 1 7 2004 1 1 23 ASN CA C 8.968 15.518 7.202 1.00 . A A . 4 GLY CA 1 1 7 2005 1 1 23 ASN H H 6.923 15.016 6.992 1.00 . A A . 4 GLY H 1 1 7 2006 1 1 23 ASN N N 7.743 15.203 6.490 1.00 . A A . 4 GLY N 1 1 7 2007 1 1 23 ASN O O 9.569 13.415 8.166 1.00 . A A . 4 GLY O 1 1 7 2008 1 1 24 GLY C C 7.992 14.184 11.619 1.00 . A A . 5 ASN C 1 1 7 2009 1 1 24 GLY CA C 9.265 14.285 10.781 1.00 . A A . 5 ASN CA 1 1 7 2010 1 1 24 GLY H H 8.775 16.022 9.672 1.00 . A A . 5 ASN H 1 1 7 2011 1 1 24 GLY N N 9.050 15.087 9.580 1.00 . A A . 5 ASN N 1 1 7 2012 1 1 24 GLY O O 7.840 13.263 12.421 1.00 . A A . 5 ASN O 1 1 7 2013 1 1 25 VAL C C 6.060 15.196 13.675 1.00 . A A . 6 GLY C 1 1 7 2014 1 1 25 VAL CA C 5.838 15.129 12.176 1.00 . A A . 6 GLY CA 1 1 7 2015 1 1 25 VAL H H 7.258 15.841 10.778 1.00 . A A . 6 GLY H 1 1 7 2016 1 1 25 VAL N N 7.084 15.134 11.430 1.00 . A A . 6 GLY N 1 1 7 2017 1 1 25 VAL O O 5.497 14.401 14.429 1.00 . A A . 6 GLY O 1 1 7 2018 1 1 26 SER C C 6.223 17.331 16.153 1.00 . A A . 7 VAL C 1 1 7 2019 1 1 26 SER CA C 7.181 16.317 15.522 1.00 . A A . 7 VAL CA 1 1 7 2020 1 1 26 SER CB C 8.638 16.784 15.726 1.00 . A A . 7 VAL CB 1 1 7 2021 1 1 26 SER H H 7.302 16.749 13.461 1.00 . A A . 7 VAL H 1 1 7 2022 1 1 26 SER HA H 7.055 15.362 16.011 1.00 . A A . 7 VAL HA 1 1 7 2023 1 1 26 SER N N 6.882 16.145 14.108 1.00 . A A . 7 VAL N 1 1 7 2024 1 1 26 SER O O 5.194 17.664 15.567 1.00 . A A . 7 VAL O 1 1 7 2025 1 1 27 CYS C C 4.305 18.285 18.204 1.00 . A A . 8 SER C 1 1 7 2026 1 1 27 CYS CA C 5.734 18.795 18.037 1.00 . A A . 8 SER CA 1 1 7 2027 1 1 27 CYS CB C 5.737 20.116 17.274 1.00 . A A . 8 SER CB 1 1 7 2028 1 1 27 CYS H H 7.395 17.527 17.760 1.00 . A A . 8 SER H 1 1 7 2029 1 1 27 CYS HA H 6.162 18.956 19.016 1.00 . A A . 8 SER HA 1 1 7 2030 1 1 27 CYS HB2 H 6.698 20.245 16.800 1.00 . A A . 8 SER HB2 1 1 7 2031 1 1 27 CYS HB3 H 4.963 20.096 16.522 1.00 . A A . 8 SER HB3 1 1 7 2032 1 1 27 CYS N N 6.565 17.821 17.342 1.00 . A A . 8 SER N 1 1 7 2033 1 1 27 CYS O O 3.943 17.236 17.669 1.00 . A A . 8 SER O 1 1 7 2034 1 1 28 SER C C 1.158 19.563 18.421 1.00 . A A . 9 CYS C 1 1 7 2035 1 1 28 SER CA C 2.112 18.654 19.190 1.00 . A A . 9 CYS CA 1 1 7 2036 1 1 28 SER CB C 1.792 18.715 20.687 1.00 . A A . 9 CYS CB 1 1 7 2037 1 1 28 SER H H 3.847 19.855 19.352 1.00 . A A . 9 CYS H 1 1 7 2038 1 1 28 SER HA H 1.980 17.640 18.845 1.00 . A A . 9 CYS HA 1 1 7 2039 1 1 28 SER HB2 H 1.621 19.743 20.968 1.00 . A A . 9 CYS HB2 1 1 7 2040 1 1 28 SER HB3 H 0.898 18.142 20.878 1.00 . A A . 9 CYS HB3 1 1 7 2041 1 1 28 SER N N 3.499 19.032 18.950 1.00 . A A . 9 CYS N 1 1 7 2042 1 1 28 SER O O 1.071 20.760 18.691 1.00 . A A . 9 CYS O 1 1 7 2043 1 1 29 LYS C C -1.516 18.810 15.990 1.00 . A A . 10 SER C 1 1 7 2044 1 1 29 LYS CA C -0.508 19.740 16.656 1.00 . A A . 10 SER CA 1 1 7 2045 1 1 29 LYS CB C 0.222 20.560 15.595 1.00 . A A . 10 SER CB 1 1 7 2046 1 1 29 LYS H H 0.554 18.025 17.296 1.00 . A A . 10 SER H 1 1 7 2047 1 1 29 LYS HA H -1.039 20.411 17.315 1.00 . A A . 10 SER HA 1 1 7 2048 1 1 29 LYS HB2 H -0.461 20.790 14.791 1.00 . A A . 10 SER HB2 1 1 7 2049 1 1 29 LYS HB3 H 0.579 21.479 16.037 1.00 . A A . 10 SER HB3 1 1 7 2050 1 1 29 LYS N N 0.442 18.983 17.462 1.00 . A A . 10 SER N 1 1 7 2051 1 1 29 LYS O O -1.165 18.027 15.106 1.00 . A A . 10 SER O 1 1 7 2052 1 1 30 THR C C -3.598 16.589 16.098 1.00 . A A . 11 LYS C 1 1 7 2053 1 1 30 THR CA C -3.840 18.083 15.868 1.00 . A A . 11 LYS CA 1 1 7 2054 1 1 30 THR CB C -3.982 18.366 14.380 1.00 . A A . 11 LYS CB 1 1 7 2055 1 1 30 THR H H -2.983 19.554 17.115 1.00 . A A . 11 LYS H 1 1 7 2056 1 1 30 THR HA H -4.757 18.362 16.363 1.00 . A A . 11 LYS HA 1 1 7 2057 1 1 30 THR N N -2.770 18.907 16.418 1.00 . A A . 11 LYS N 1 1 7 2058 1 1 30 THR O O -4.393 15.755 15.666 1.00 . A A . 11 LYS O 1 1 7 2059 1 1 31 LYS C C -1.366 14.738 18.339 1.00 . A A . 12 THR C 1 1 7 2060 1 1 31 LYS CA C -2.179 14.865 17.055 1.00 . A A . 12 THR CA 1 1 7 2061 1 1 31 LYS CB C -1.422 14.257 15.886 1.00 . A A . 12 THR CB 1 1 7 2062 1 1 31 LYS H H -1.910 16.948 17.104 1.00 . A A . 12 THR H 1 1 7 2063 1 1 31 LYS HA H -3.089 14.341 17.176 1.00 . A A . 12 THR HA 1 1 7 2064 1 1 31 LYS N N -2.505 16.252 16.777 1.00 . A A . 12 THR N 1 1 7 2065 1 1 31 LYS O O -1.065 15.736 18.996 1.00 . A A . 12 THR O 1 1 7 2066 1 1 32 CYS C C 1.194 13.785 19.731 1.00 . A A . 13 LYS C 1 1 7 2067 1 1 32 CYS CA C -0.226 13.253 19.891 1.00 . A A . 13 LYS CA 1 1 7 2068 1 1 32 CYS CB C -0.193 11.754 20.195 1.00 . A A . 13 LYS CB 1 1 7 2069 1 1 32 CYS H H -1.275 12.754 18.126 1.00 . A A . 13 LYS H 1 1 7 2070 1 1 32 CYS HA H -0.703 13.767 20.710 1.00 . A A . 13 LYS HA 1 1 7 2071 1 1 32 CYS HB2 H 0.499 11.580 21.005 1.00 . A A . 13 LYS HB2 1 1 7 2072 1 1 32 CYS HB3 H -1.179 11.439 20.501 1.00 . A A . 13 LYS HB3 1 1 7 2073 1 1 32 CYS N N -1.010 13.508 18.690 1.00 . A A . 13 LYS N 1 1 7 2074 1 1 32 CYS O O 1.598 14.183 18.638 1.00 . A A . 13 LYS O 1 1 7 2075 1 1 33 SER C C 4.305 13.106 20.687 1.00 . A A . 14 CYS C 1 1 7 2076 1 1 33 SER CA C 3.325 14.269 20.799 1.00 . A A . 14 CYS CA 1 1 7 2077 1 1 33 SER CB C 3.627 15.087 22.055 1.00 . A A . 14 CYS CB 1 1 7 2078 1 1 33 SER H H 1.573 13.457 21.667 1.00 . A A . 14 CYS H 1 1 7 2079 1 1 33 SER HA H 3.437 14.904 19.932 1.00 . A A . 14 CYS HA 1 1 7 2080 1 1 33 SER HB2 H 3.721 14.418 22.898 1.00 . A A . 14 CYS HB2 1 1 7 2081 1 1 33 SER HB3 H 4.559 15.615 21.915 1.00 . A A . 14 CYS HB3 1 1 7 2082 1 1 33 SER N N 1.948 13.788 20.824 1.00 . A A . 14 CYS N 1 1 7 2083 1 1 33 SER O O 5.426 13.175 21.191 1.00 . A A . 14 CYS O 1 1 7 2084 1 1 34 VAL C C 4.273 10.067 18.615 1.00 . A A . 15 SER C 1 1 7 2085 1 1 34 VAL CA C 4.711 10.859 19.843 1.00 . A A . 15 SER CA 1 1 7 2086 1 1 34 VAL CB C 4.651 9.971 21.087 1.00 . A A . 15 SER CB 1 1 7 2087 1 1 34 VAL H H 2.970 12.044 19.644 1.00 . A A . 15 SER H 1 1 7 2088 1 1 34 VAL HA H 5.726 11.193 19.697 1.00 . A A . 15 SER HA 1 1 7 2089 1 1 34 VAL N N 3.873 12.038 20.022 1.00 . A A . 15 SER N 1 1 7 2090 1 1 34 VAL O O 4.273 8.836 18.625 1.00 . A A . 15 SER O 1 1 7 2091 1 1 35 ASN C C 4.623 9.434 15.634 1.00 . A A . 16 VAL C 1 1 7 2092 1 1 35 ASN CA C 3.464 10.150 16.322 1.00 . A A . 16 VAL CA 1 1 7 2093 1 1 35 ASN CB C 2.854 11.179 15.350 1.00 . A A . 16 VAL CB 1 1 7 2094 1 1 35 ASN H H 3.927 11.762 17.614 1.00 . A A . 16 VAL H 1 1 7 2095 1 1 35 ASN HA H 2.704 9.425 16.571 1.00 . A A . 16 VAL HA 1 1 7 2096 1 1 35 ASN N N 3.904 10.783 17.559 1.00 . A A . 16 VAL N 1 1 7 2097 1 1 35 ASN O O 5.790 9.739 15.883 1.00 . A A . 16 VAL O 1 1 7 2098 1 1 36 TRP C C 5.534 8.303 12.653 1.00 . A A . 17 ASN C 1 1 7 2099 1 1 36 TRP CA C 5.308 7.724 14.045 1.00 . A A . 17 ASN CA 1 1 7 2100 1 1 36 TRP CB C 4.897 6.254 13.941 1.00 . A A . 17 ASN CB 1 1 7 2101 1 1 36 TRP CG C 5.191 5.480 15.211 1.00 . A A . 17 ASN CG 1 1 7 2102 1 1 36 TRP H H 3.346 8.284 14.612 1.00 . A A . 17 ASN H 1 1 7 2103 1 1 36 TRP HA H 6.229 7.792 14.602 1.00 . A A . 17 ASN HA 1 1 7 2104 1 1 36 TRP HB2 H 3.837 6.196 13.744 1.00 . A A . 17 ASN HB2 1 1 7 2105 1 1 36 TRP HB3 H 5.436 5.794 13.126 1.00 . A A . 17 ASN HB3 1 1 7 2106 1 1 36 TRP N N 4.293 8.482 14.768 1.00 . A A . 17 ASN N 1 1 7 2107 1 1 36 TRP O O 5.732 7.566 11.687 1.00 . A A . 17 ASN O 1 1 7 2108 1 1 37 GLY C C 7.157 10.169 10.818 1.00 . A A . 18 TRP C 1 1 7 2109 1 1 37 GLY CA C 5.710 10.309 11.288 1.00 . A A . 18 TRP CA 1 1 7 2110 1 1 37 GLY H H 5.344 10.159 13.363 1.00 . A A . 18 TRP H 1 1 7 2111 1 1 37 GLY N N 5.506 9.628 12.559 1.00 . A A . 18 TRP N 1 1 7 2112 1 1 37 GLY O O 7.453 10.333 9.634 1.00 . A A . 18 TRP O 1 1 7 2113 1 1 38 GLN C C 9.886 8.250 11.466 1.00 . A A . 19 GLY C 1 1 7 2114 1 1 38 GLN CA C 9.455 9.700 11.414 1.00 . A A . 19 GLY CA 1 1 7 2115 1 1 38 GLN H H 7.759 9.738 12.678 1.00 . A A . 19 GLY H 1 1 7 2116 1 1 38 GLN N N 8.053 9.861 11.752 1.00 . A A . 19 GLY N 1 1 7 2117 1 1 38 GLN O O 10.528 7.745 10.541 1.00 . A A . 19 GLY O 1 1 7 2118 1 1 39 ALA C C 9.372 5.375 11.494 1.00 . A A . 20 GLN C 1 1 7 2119 1 1 39 ALA CA C 9.861 6.162 12.699 1.00 . A A . 20 GLN CA 1 1 7 2120 1 1 39 ALA CB C 9.250 5.596 13.984 1.00 . A A . 20 GLN CB 1 1 7 2121 1 1 39 ALA H H 8.998 8.015 13.243 1.00 . A A . 20 GLN H 1 1 7 2122 1 1 39 ALA HA H 10.937 6.083 12.751 1.00 . A A . 20 GLN HA 1 1 7 2123 1 1 39 ALA HB2 H 9.443 6.284 14.793 1.00 . A A . 20 GLN HB2 1 1 7 2124 1 1 39 ALA HB3 H 8.182 5.502 13.850 1.00 . A A . 20 GLN HB3 1 1 7 2125 1 1 39 ALA N N 9.519 7.567 12.544 1.00 . A A . 20 GLN N 1 1 7 2126 1 1 39 ALA O O 10.171 4.809 10.749 1.00 . A A . 20 GLN O 1 1 7 2127 1 1 40 PHE C C 7.914 5.262 8.834 1.00 . A A . 21 ALA C 1 1 7 2128 1 1 40 PHE CA C 7.498 4.642 10.150 1.00 . A A . 21 ALA CA 1 1 7 2129 1 1 40 PHE CB C 5.994 4.506 10.246 1.00 . A A . 21 ALA CB 1 1 7 2130 1 1 40 PHE H H 7.460 5.829 11.905 1.00 . A A . 21 ALA H 1 1 7 2131 1 1 40 PHE HA H 7.920 3.676 10.178 1.00 . A A . 21 ALA HA 1 1 7 2132 1 1 40 PHE HB2 H 5.700 3.558 9.818 1.00 . A A . 21 ALA HB2 1 1 7 2133 1 1 40 PHE HB3 H 5.525 5.311 9.702 1.00 . A A . 21 ALA HB3 1 1 7 2134 1 1 40 PHE N N 8.056 5.352 11.290 1.00 . A A . 21 ALA N 1 1 7 2135 1 1 40 PHE O O 7.689 4.703 7.761 1.00 . A A . 21 ALA O 1 1 7 2136 1 1 41 GLN C C 10.192 6.196 7.195 1.00 . A A . 22 PHE C 1 1 7 2137 1 1 41 GLN CA C 9.085 7.064 7.754 1.00 . A A . 22 PHE CA 1 1 7 2138 1 1 41 GLN CB C 9.614 8.458 8.099 1.00 . A A . 22 PHE CB 1 1 7 2139 1 1 41 GLN CG C 9.582 9.415 6.941 1.00 . A A . 22 PHE CG 1 1 7 2140 1 1 41 GLN H H 8.747 6.741 9.810 1.00 . A A . 22 PHE H 1 1 7 2141 1 1 41 GLN HA H 8.288 7.142 7.032 1.00 . A A . 22 PHE HA 1 1 7 2142 1 1 41 GLN HB2 H 9.014 8.877 8.893 1.00 . A A . 22 PHE HB2 1 1 7 2143 1 1 41 GLN HB3 H 10.638 8.375 8.432 1.00 . A A . 22 PHE HB3 1 1 7 2144 1 1 41 GLN N N 8.569 6.389 8.930 1.00 . A A . 22 PHE N 1 1 7 2145 1 1 41 GLN O O 10.326 6.015 5.985 1.00 . A A . 22 PHE O 1 1 7 2146 1 1 42 GLU C C 11.466 3.322 7.496 1.00 . A A . 23 GLN C 1 1 7 2147 1 1 42 GLU CA C 12.034 4.713 7.782 1.00 . A A . 23 GLN CA 1 1 7 2148 1 1 42 GLU CB C 13.044 4.647 8.931 1.00 . A A . 23 GLN CB 1 1 7 2149 1 1 42 GLU CD C 15.272 4.705 7.740 1.00 . A A . 23 GLN CD 1 1 7 2150 1 1 42 GLU CG C 14.318 5.434 8.667 1.00 . A A . 23 GLN CG 1 1 7 2151 1 1 42 GLU H H 10.762 5.794 9.068 1.00 . A A . 23 GLN H 1 1 7 2152 1 1 42 GLU HA H 12.523 5.086 6.895 1.00 . A A . 23 GLN HA 1 1 7 2153 1 1 42 GLU HB2 H 12.581 5.041 9.827 1.00 . A A . 23 GLN HB2 1 1 7 2154 1 1 42 GLU HB3 H 13.313 3.614 9.101 1.00 . A A . 23 GLN HB3 1 1 7 2155 1 1 42 GLU HG2 H 14.054 6.379 8.216 1.00 . A A . 23 GLN HG2 1 1 7 2156 1 1 42 GLU HG3 H 14.818 5.612 9.607 1.00 . A A . 23 GLN HG3 1 1 7 2157 1 1 42 GLU N N 10.955 5.620 8.120 1.00 . A A . 23 GLN N 1 1 7 2158 1 1 42 GLU O O 12.066 2.536 6.761 1.00 . A A . 23 GLN O 1 1 7 2159 1 1 42 GLU OE1 O 14.851 3.925 6.886 1.00 . A A . 23 GLN OE1 1 1 7 2160 1 1 43 ARG C C 9.125 1.594 6.468 1.00 . A A . 24 GLU C 1 1 7 2161 1 1 43 ARG CA C 9.657 1.730 7.891 1.00 . A A . 24 GLU CA 1 1 7 2162 1 1 43 ARG CB C 8.541 1.507 8.929 1.00 . A A . 24 GLU CB 1 1 7 2163 1 1 43 ARG CD C 6.064 1.165 9.305 1.00 . A A . 24 GLU CD 1 1 7 2164 1 1 43 ARG CG C 7.128 1.819 8.445 1.00 . A A . 24 GLU CG 1 1 7 2165 1 1 43 ARG H H 9.871 3.687 8.659 1.00 . A A . 24 GLU H 1 1 7 2166 1 1 43 ARG HA H 10.406 0.981 8.043 1.00 . A A . 24 GLU HA 1 1 7 2167 1 1 43 ARG HB2 H 8.562 0.472 9.236 1.00 . A A . 24 GLU HB2 1 1 7 2168 1 1 43 ARG HB3 H 8.746 2.124 9.790 1.00 . A A . 24 GLU HB3 1 1 7 2169 1 1 43 ARG HG2 H 6.978 2.885 8.470 1.00 . A A . 24 GLU HG2 1 1 7 2170 1 1 43 ARG HG3 H 7.016 1.463 7.433 1.00 . A A . 24 GLU HG3 1 1 7 2171 1 1 43 ARG N N 10.301 3.024 8.085 1.00 . A A . 24 GLU N 1 1 7 2172 1 1 43 ARG O O 9.328 0.572 5.812 1.00 . A A . 24 GLU O 1 1 7 2173 1 1 44 TYR C C 9.001 2.589 3.607 1.00 . A A . 25 ARG C 1 1 7 2174 1 1 44 TYR CA C 7.891 2.632 4.647 1.00 . A A . 25 ARG CA 1 1 7 2175 1 1 44 TYR CB C 7.014 3.866 4.427 1.00 . A A . 25 ARG CB 1 1 7 2176 1 1 44 TYR CG C 5.562 3.661 4.828 1.00 . A A . 25 ARG CG 1 1 7 2177 1 1 44 TYR CZ C 3.570 5.577 2.327 1.00 . A A . 25 ARG CZ 1 1 7 2178 1 1 44 TYR H H 8.319 3.422 6.561 1.00 . A A . 25 ARG H 1 1 7 2179 1 1 44 TYR HA H 7.288 1.749 4.543 1.00 . A A . 25 ARG HA 1 1 7 2180 1 1 44 TYR HB2 H 7.413 4.684 5.010 1.00 . A A . 25 ARG HB2 1 1 7 2181 1 1 44 TYR HB3 H 7.043 4.133 3.381 1.00 . A A . 25 ARG HB3 1 1 7 2182 1 1 44 TYR HD2 H 5.161 3.469 2.746 1.00 . A A . 25 ARG HD2 1 1 7 2183 1 1 44 TYR N N 8.446 2.635 5.993 1.00 . A A . 25 ARG N 1 1 7 2184 1 1 44 TYR O O 8.834 2.029 2.523 1.00 . A A . 25 ARG O 1 1 7 2185 1 1 45 THR C C 11.859 1.811 2.875 1.00 . A A . 26 TYR C 1 1 7 2186 1 1 45 THR CA C 11.283 3.211 3.056 1.00 . A A . 26 TYR CA 1 1 7 2187 1 1 45 THR CB C 12.358 4.154 3.601 1.00 . A A . 26 TYR CB 1 1 7 2188 1 1 45 THR H H 10.202 3.602 4.828 1.00 . A A . 26 TYR H 1 1 7 2189 1 1 45 THR HA H 10.947 3.576 2.099 1.00 . A A . 26 TYR HA 1 1 7 2190 1 1 45 THR N N 10.136 3.180 3.950 1.00 . A A . 26 TYR N 1 1 7 2191 1 1 45 THR O O 12.180 1.399 1.760 1.00 . A A . 26 TYR O 1 1 7 2192 1 1 46 ALA C C 11.570 -1.202 3.184 1.00 . A A . 27 THR C 1 1 7 2193 1 1 46 ALA CA C 12.513 -0.275 3.942 1.00 . A A . 27 THR CA 1 1 7 2194 1 1 46 ALA CB C 12.731 -0.799 5.363 1.00 . A A . 27 THR CB 1 1 7 2195 1 1 46 ALA H H 11.706 1.464 4.838 1.00 . A A . 27 THR H 1 1 7 2196 1 1 46 ALA HA H 13.462 -0.247 3.429 1.00 . A A . 27 THR HA 1 1 7 2197 1 1 46 ALA N N 11.982 1.082 3.979 1.00 . A A . 27 THR N 1 1 7 2198 1 1 46 ALA O O 12.009 -2.096 2.461 1.00 . A A . 27 THR O 1 1 7 2199 1 1 47 GLY C C 9.287 -1.563 1.178 1.00 . A A . 28 ALA C 1 1 7 2200 1 1 47 GLY CA C 9.262 -1.792 2.685 1.00 . A A . 28 ALA CA 1 1 7 2201 1 1 47 GLY H H 9.981 -0.252 3.942 1.00 . A A . 28 ALA H 1 1 7 2202 1 1 47 GLY N N 10.269 -0.981 3.353 1.00 . A A . 28 ALA N 1 1 7 2203 1 1 47 GLY O O 9.074 -2.489 0.396 1.00 . A A . 28 ALA O 1 1 7 2204 1 1 48 ILE C C 10.849 -0.512 -1.309 1.00 . A A . 29 GLY C 1 1 7 2205 1 1 48 ILE CA C 9.595 0.007 -0.634 1.00 . A A . 29 GLY CA 1 1 7 2206 1 1 48 ILE H H 9.709 0.375 1.448 1.00 . A A . 29 GLY H 1 1 7 2207 1 1 48 ILE N N 9.547 -0.322 0.778 1.00 . A A . 29 GLY N 1 1 7 2208 1 1 48 ILE O O 10.772 -1.227 -2.308 1.00 . A A . 29 GLY O 1 1 7 2209 1 1 49 ASN C C 13.384 -2.111 -1.329 1.00 . A A . 30 ILE C 1 1 7 2210 1 1 49 ASN CA C 13.281 -0.589 -1.320 1.00 . A A . 30 ILE CA 1 1 7 2211 1 1 49 ASN CB C 14.470 -0.001 -0.533 1.00 . A A . 30 ILE CB 1 1 7 2212 1 1 49 ASN H H 12.003 0.418 0.033 1.00 . A A . 30 ILE H 1 1 7 2213 1 1 49 ASN HA H 13.339 -0.229 -2.336 1.00 . A A . 30 ILE HA 1 1 7 2214 1 1 49 ASN N N 12.007 -0.153 -0.763 1.00 . A A . 30 ILE N 1 1 7 2215 1 1 49 ASN O O 13.977 -2.697 -2.234 1.00 . A A . 30 ILE O 1 1 7 2216 1 1 50 SER C C 12.320 -4.849 -1.497 1.00 . A A . 31 ASN C 1 1 7 2217 1 1 50 SER CA C 12.825 -4.204 -0.210 1.00 . A A . 31 ASN CA 1 1 7 2218 1 1 50 SER CB C 11.978 -4.666 0.977 1.00 . A A . 31 ASN CB 1 1 7 2219 1 1 50 SER H H 12.341 -2.226 0.374 1.00 . A A . 31 ASN H 1 1 7 2220 1 1 50 SER HA H 13.850 -4.507 -0.050 1.00 . A A . 31 ASN HA 1 1 7 2221 1 1 50 SER HB2 H 11.308 -3.870 1.265 1.00 . A A . 31 ASN HB2 1 1 7 2222 1 1 50 SER HB3 H 11.399 -5.531 0.687 1.00 . A A . 31 ASN HB3 1 1 7 2223 1 1 50 SER N N 12.800 -2.748 -0.316 1.00 . A A . 31 ASN N 1 1 7 2224 1 1 50 SER O O 13.078 -5.497 -2.218 1.00 . A A . 31 ASN O 1 1 7 2225 1 1 51 PHE C C 11.169 -4.700 -4.231 1.00 . A A . 32 SER C 1 1 7 2226 1 1 51 PHE CA C 10.439 -5.212 -2.994 1.00 . A A . 32 SER CA 1 1 7 2227 1 1 51 PHE CB C 8.955 -4.846 -3.072 1.00 . A A . 32 SER CB 1 1 7 2228 1 1 51 PHE H H 10.482 -4.125 -1.178 1.00 . A A . 32 SER H 1 1 7 2229 1 1 51 PHE HA H 10.536 -6.287 -2.951 1.00 . A A . 32 SER HA 1 1 7 2230 1 1 51 PHE HB2 H 8.857 -3.786 -3.251 1.00 . A A . 32 SER HB2 1 1 7 2231 1 1 51 PHE HB3 H 8.494 -5.393 -3.882 1.00 . A A . 32 SER HB3 1 1 7 2232 1 1 51 PHE N N 11.036 -4.657 -1.787 1.00 . A A . 32 SER N 1 1 7 2233 1 1 51 PHE O O 11.258 -5.391 -5.246 1.00 . A A . 32 SER O 1 1 7 2234 1 1 52 VAL C C 13.713 -3.646 -5.513 1.00 . A A . 33 PHE C 1 1 7 2235 1 1 52 VAL CA C 12.427 -2.870 -5.229 1.00 . A A . 33 PHE CA 1 1 7 2236 1 1 52 VAL CB C 12.738 -1.403 -4.893 1.00 . A A . 33 PHE CB 1 1 7 2237 1 1 52 VAL H H 11.593 -2.987 -3.294 1.00 . A A . 33 PHE H 1 1 7 2238 1 1 52 VAL HA H 11.799 -2.906 -6.105 1.00 . A A . 33 PHE HA 1 1 7 2239 1 1 52 VAL N N 11.696 -3.483 -4.130 1.00 . A A . 33 PHE N 1 1 7 2240 1 1 52 VAL O O 14.045 -3.919 -6.666 1.00 . A A . 33 PHE O 1 1 7 2241 1 1 53 SER C C 15.458 -6.025 -5.389 1.00 . A A . 34 VAL C 1 1 7 2242 1 1 53 SER CA C 15.677 -4.748 -4.586 1.00 . A A . 34 VAL CA 1 1 7 2243 1 1 53 SER CB C 16.282 -5.099 -3.210 1.00 . A A . 34 VAL CB 1 1 7 2244 1 1 53 SER H H 14.115 -3.758 -3.554 1.00 . A A . 34 VAL H 1 1 7 2245 1 1 53 SER HA H 16.381 -4.122 -5.119 1.00 . A A . 34 VAL HA 1 1 7 2246 1 1 53 SER N N 14.432 -4.002 -4.449 1.00 . A A . 34 VAL N 1 1 7 2247 1 1 53 SER O O 15.860 -6.109 -6.545 1.00 . A A . 34 VAL O 1 1 7 2248 1 1 54 GLY C C 13.991 -8.115 -6.800 1.00 . A A . 35 SER C 1 1 7 2249 1 1 54 GLY CA C 14.595 -8.292 -5.428 1.00 . A A . 35 SER CA 1 1 7 2250 1 1 54 GLY H H 14.567 -6.925 -3.845 1.00 . A A . 35 SER H 1 1 7 2251 1 1 54 GLY N N 14.836 -7.024 -4.770 1.00 . A A . 35 SER N 1 1 7 2252 1 1 54 GLY O O 14.536 -8.623 -7.779 1.00 . A A . 35 SER O 1 1 7 2253 1 1 55 VAL C C 13.388 -7.061 -9.239 1.00 . A A . 36 GLY C 1 1 7 2254 1 1 55 VAL CA C 12.298 -7.168 -8.195 1.00 . A A . 36 GLY CA 1 1 7 2255 1 1 55 VAL H H 12.511 -6.990 -6.087 1.00 . A A . 36 GLY H 1 1 7 2256 1 1 55 VAL N N 12.895 -7.388 -6.891 1.00 . A A . 36 GLY N 1 1 7 2257 1 1 55 VAL O O 13.315 -7.664 -10.310 1.00 . A A . 36 GLY O 1 1 7 2258 1 1 56 ALA C C 16.673 -7.172 -9.424 1.00 . A A . 37 VAL C 1 1 7 2259 1 1 56 ALA CA C 15.586 -6.130 -9.715 1.00 . A A . 37 VAL CA 1 1 7 2260 1 1 56 ALA CB C 16.177 -4.716 -9.539 1.00 . A A . 37 VAL CB 1 1 7 2261 1 1 56 ALA H H 14.429 -5.900 -7.999 1.00 . A A . 37 VAL H 1 1 7 2262 1 1 56 ALA HA H 15.268 -6.238 -10.733 1.00 . A A . 37 VAL HA 1 1 7 2263 1 1 56 ALA N N 14.427 -6.313 -8.879 1.00 . A A . 37 VAL N 1 1 7 2264 1 1 56 ALA O O 16.943 -8.056 -10.237 1.00 . A A . 37 VAL O 1 1 7 2265 1 1 57 SER C C 17.969 -9.176 -7.185 1.00 . A A . 38 ALA C 1 1 7 2266 1 1 57 SER CA C 18.412 -7.878 -7.845 1.00 . A A . 38 ALA CA 1 1 7 2267 1 1 57 SER CB C 19.334 -7.119 -6.896 1.00 . A A . 38 ALA CB 1 1 7 2268 1 1 57 SER H H 17.060 -6.285 -7.673 1.00 . A A . 38 ALA H 1 1 7 2269 1 1 57 SER HA H 18.975 -8.115 -8.723 1.00 . A A . 38 ALA HA 1 1 7 2270 1 1 57 SER HB2 H 19.169 -7.458 -5.877 1.00 . A A . 38 ALA HB2 1 1 7 2271 1 1 57 SER HB3 H 19.124 -6.062 -6.960 1.00 . A A . 38 ALA HB3 1 1 7 2272 1 1 57 SER N N 17.320 -7.016 -8.264 1.00 . A A . 38 ALA N 1 1 7 2273 1 1 57 SER O O 18.077 -10.262 -7.752 1.00 . A A . 38 ALA O 1 1 7 2274 1 1 58 GLY C C 15.913 -10.917 -5.614 1.00 . A A . 39 SER C 1 1 7 2275 1 1 58 GLY CA C 17.131 -10.141 -5.095 1.00 . A A . 39 SER CA 1 1 7 2276 1 1 58 GLY H H 17.525 -8.127 -5.557 1.00 . A A . 39 SER H 1 1 7 2277 1 1 58 GLY N N 17.535 -9.029 -5.941 1.00 . A A . 39 SER N 1 1 7 2278 1 1 58 GLY O O 15.373 -11.768 -4.907 1.00 . A A . 39 SER O 1 1 7 2279 1 1 59 ALA C C 14.392 -11.413 -8.911 1.00 . A A . 40 GLY C 1 1 7 2280 1 1 59 ALA CA C 14.334 -11.322 -7.398 1.00 . A A . 40 GLY CA 1 1 7 2281 1 1 59 ALA H H 15.935 -9.944 -7.369 1.00 . A A . 40 GLY H 1 1 7 2282 1 1 59 ALA N N 15.480 -10.629 -6.840 1.00 . A A . 40 GLY N 1 1 7 2283 1 1 59 ALA O O 13.480 -10.961 -9.602 1.00 . A A . 40 GLY O 1 1 7 2284 1 1 60 GLY C C 16.404 -13.431 -11.190 1.00 . A A . 41 ALA C 1 1 7 2285 1 1 60 GLY CA C 15.641 -12.152 -10.859 1.00 . A A . 41 ALA CA 1 1 7 2286 1 1 60 GLY H H 16.157 -12.340 -8.826 1.00 . A A . 41 ALA H 1 1 7 2287 1 1 60 GLY N N 15.467 -12.000 -9.425 1.00 . A A . 41 ALA N 1 1 7 2288 1 1 60 GLY O O 17.553 -13.386 -11.628 1.00 . A A . 41 ALA O 1 1 7 2289 1 1 61 SER C C 17.612 -16.093 -10.404 1.00 . A A . 42 GLY C 1 1 7 2290 1 1 61 SER CA C 16.384 -15.847 -11.260 1.00 . A A . 42 GLY CA 1 1 7 2291 1 1 61 SER H H 14.840 -14.546 -10.627 1.00 . A A . 42 GLY H 1 1 7 2292 1 1 61 SER N N 15.754 -14.571 -10.978 1.00 . A A . 42 GLY N 1 1 7 2293 1 1 61 SER O O 18.719 -15.699 -10.770 1.00 . A A . 42 GLY O 1 1 7 2294 1 1 62 ILE C C 19.349 -18.205 -8.878 1.00 . A A . 43 SER C 1 1 7 2295 1 1 62 ILE CA C 18.515 -17.046 -8.355 1.00 . A A . 43 SER CA 1 1 7 2296 1 1 62 ILE CB C 17.978 -17.376 -6.960 1.00 . A A . 43 SER CB 1 1 7 2297 1 1 62 ILE H H 16.508 -17.036 -9.029 1.00 . A A . 43 SER H 1 1 7 2298 1 1 62 ILE HA H 19.138 -16.178 -8.293 1.00 . A A . 43 SER HA 1 1 7 2299 1 1 62 ILE N N 17.415 -16.747 -9.264 1.00 . A A . 43 SER N 1 1 7 2300 1 1 62 ILE O O 20.517 -18.042 -9.228 1.00 . A A . 43 SER O 1 1 7 2301 1 1 63 GLY C C 18.872 -20.985 -10.777 1.00 . A A . 44 ILE C 1 1 7 2302 1 1 63 GLY CA C 19.398 -20.577 -9.404 1.00 . A A . 44 ILE CA 1 1 7 2303 1 1 63 GLY H H 17.803 -19.420 -8.630 1.00 . A A . 44 ILE H 1 1 7 2304 1 1 63 GLY N N 18.732 -19.372 -8.926 1.00 . A A . 44 ILE N 1 1 7 2305 1 1 63 GLY O O 18.671 -22.168 -11.052 1.00 . A A . 44 ILE O 1 1 7 2306 1 1 64 ARG C C 18.975 -19.592 -14.051 1.00 . A A . 45 GLY C 1 1 7 2307 1 1 64 ARG CA C 18.152 -20.270 -12.972 1.00 . A A . 45 GLY CA 1 1 7 2308 1 1 64 ARG H H 18.831 -19.072 -11.364 1.00 . A A . 45 GLY H 1 1 7 2309 1 1 64 ARG N N 18.653 -19.995 -11.637 1.00 . A A . 45 GLY N 1 1 7 2310 1 1 64 ARG O O 19.988 -20.130 -14.497 1.00 . A A . 45 GLY O 1 1 8 2311 1 1 20 ASN C C -11.936 5.925 18.963 1.00 . A A . 1 VAL C 1 1 8 2312 1 1 20 ASN CA C -12.857 4.720 19.119 1.00 . A A . 1 VAL CA 1 1 8 2313 1 1 20 ASN CB C -12.708 3.811 17.884 1.00 . A A . 1 VAL CB 1 1 8 2314 1 1 20 ASN H H -14.847 5.149 18.539 1.00 . A A . 1 VAL H 1 1 8 2315 1 1 20 ASN HA H -12.556 4.160 19.991 1.00 . A A . 1 VAL HA 1 1 8 2316 1 1 20 ASN N N -14.241 5.139 19.308 1.00 . A A . 1 VAL N 1 1 8 2317 1 1 20 ASN O O -12.100 6.730 18.047 1.00 . A A . 1 VAL O 1 1 8 2318 1 1 21 TYR C C -8.777 6.833 20.651 1.00 . A A . 2 ASN C 1 1 8 2319 1 1 21 TYR CA C -10.020 7.151 19.826 1.00 . A A . 2 ASN CA 1 1 8 2320 1 1 21 TYR CB C -10.684 8.432 20.342 1.00 . A A . 2 ASN CB 1 1 8 2321 1 1 21 TYR CG C -10.570 9.578 19.356 1.00 . A A . 2 ASN CG 1 1 8 2322 1 1 21 TYR H H -10.887 5.369 20.572 1.00 . A A . 2 ASN H 1 1 8 2323 1 1 21 TYR HA H -9.726 7.298 18.798 1.00 . A A . 2 ASN HA 1 1 8 2324 1 1 21 TYR HB2 H -11.732 8.239 20.520 1.00 . A A . 2 ASN HB2 1 1 8 2325 1 1 21 TYR HB3 H -10.214 8.728 21.268 1.00 . A A . 2 ASN HB3 1 1 8 2326 1 1 21 TYR N N -10.967 6.043 19.865 1.00 . A A . 2 ASN N 1 1 8 2327 1 1 21 TYR O O -8.243 7.697 21.348 1.00 . A A . 2 ASN O 1 1 8 2328 1 1 22 GLY C C -6.810 3.698 20.997 1.00 . A A . 3 TYR C 1 1 8 2329 1 1 22 GLY CA C -7.139 5.155 21.306 1.00 . A A . 3 TYR CA 1 1 8 2330 1 1 22 GLY H H -8.789 4.945 19.995 1.00 . A A . 3 TYR H 1 1 8 2331 1 1 22 GLY N N -8.320 5.588 20.568 1.00 . A A . 3 TYR N 1 1 8 2332 1 1 22 GLY O O -6.422 2.937 21.885 1.00 . A A . 3 TYR O 1 1 8 2333 1 1 23 ASN C C -5.696 1.876 18.185 1.00 . A A . 4 GLY C 1 1 8 2334 1 1 23 ASN CA C -6.685 1.951 19.332 1.00 . A A . 4 GLY CA 1 1 8 2335 1 1 23 ASN H H -7.280 3.966 19.072 1.00 . A A . 4 GLY H 1 1 8 2336 1 1 23 ASN N N -6.969 3.316 19.736 1.00 . A A . 4 GLY N 1 1 8 2337 1 1 23 ASN O O -5.983 1.278 17.149 1.00 . A A . 4 GLY O 1 1 8 2338 1 1 24 GLY C C -2.715 1.178 17.359 1.00 . A A . 5 ASN C 1 1 8 2339 1 1 24 GLY CA C -3.497 2.482 17.339 1.00 . A A . 5 ASN CA 1 1 8 2340 1 1 24 GLY H H -4.358 2.946 19.218 1.00 . A A . 5 ASN H 1 1 8 2341 1 1 24 GLY N N -4.530 2.485 18.370 1.00 . A A . 5 ASN N 1 1 8 2342 1 1 24 GLY O O -2.281 0.681 16.319 1.00 . A A . 5 ASN O 1 1 8 2343 1 1 25 VAL C C -0.354 -0.482 18.324 1.00 . A A . 6 GLY C 1 1 8 2344 1 1 25 VAL CA C -1.815 -0.614 18.704 1.00 . A A . 6 GLY CA 1 1 8 2345 1 1 25 VAL H H -2.916 1.081 19.335 1.00 . A A . 6 GLY H 1 1 8 2346 1 1 25 VAL N N -2.543 0.632 18.551 1.00 . A A . 6 GLY N 1 1 8 2347 1 1 25 VAL O O 0.207 -1.360 17.671 1.00 . A A . 6 GLY O 1 1 8 2348 1 1 26 SER C C 2.526 0.742 19.689 1.00 . A A . 7 VAL C 1 1 8 2349 1 1 26 SER CA C 1.668 0.870 18.434 1.00 . A A . 7 VAL CA 1 1 8 2350 1 1 26 SER CB C 1.876 2.270 17.825 1.00 . A A . 7 VAL CB 1 1 8 2351 1 1 26 SER H H -0.239 1.286 19.253 1.00 . A A . 7 VAL H 1 1 8 2352 1 1 26 SER HA H 1.990 0.133 17.713 1.00 . A A . 7 VAL HA 1 1 8 2353 1 1 26 SER N N 0.263 0.623 18.735 1.00 . A A . 7 VAL N 1 1 8 2354 1 1 26 SER O O 2.017 0.787 20.809 1.00 . A A . 7 VAL O 1 1 8 2355 1 1 27 CYS C C 5.697 1.642 20.690 1.00 . A A . 8 SER C 1 1 8 2356 1 1 27 CYS CA C 4.759 0.443 20.610 1.00 . A A . 8 SER CA 1 1 8 2357 1 1 27 CYS CB C 5.569 -0.847 20.471 1.00 . A A . 8 SER CB 1 1 8 2358 1 1 27 CYS H H 4.177 0.549 18.578 1.00 . A A . 8 SER H 1 1 8 2359 1 1 27 CYS HA H 4.178 0.395 21.519 1.00 . A A . 8 SER HA 1 1 8 2360 1 1 27 CYS HB2 H 5.052 -1.525 19.809 1.00 . A A . 8 SER HB2 1 1 8 2361 1 1 27 CYS HB3 H 6.542 -0.615 20.063 1.00 . A A . 8 SER HB3 1 1 8 2362 1 1 27 CYS N N 3.830 0.579 19.494 1.00 . A A . 8 SER N 1 1 8 2363 1 1 27 CYS O O 5.905 2.349 19.704 1.00 . A A . 8 SER O 1 1 8 2364 1 1 28 SER C C 8.624 2.544 21.844 1.00 . A A . 9 CYS C 1 1 8 2365 1 1 28 SER CA C 7.181 2.975 22.084 1.00 . A A . 9 CYS CA 1 1 8 2366 1 1 28 SER CB C 7.032 3.521 23.506 1.00 . A A . 9 CYS CB 1 1 8 2367 1 1 28 SER H H 6.057 1.265 22.620 1.00 . A A . 9 CYS H 1 1 8 2368 1 1 28 SER HA H 6.929 3.754 21.381 1.00 . A A . 9 CYS HA 1 1 8 2369 1 1 28 SER HB2 H 6.582 2.764 24.130 1.00 . A A . 9 CYS HB2 1 1 8 2370 1 1 28 SER HB3 H 8.010 3.767 23.896 1.00 . A A . 9 CYS HB3 1 1 8 2371 1 1 28 SER N N 6.263 1.864 21.872 1.00 . A A . 9 CYS N 1 1 8 2372 1 1 28 SER O O 9.062 1.506 22.340 1.00 . A A . 9 CYS O 1 1 8 2373 1 1 29 LYS C C 11.481 4.295 20.285 1.00 . A A . 10 SER C 1 1 8 2374 1 1 29 LYS CA C 10.755 3.055 20.787 1.00 . A A . 10 SER CA 1 1 8 2375 1 1 29 LYS CB C 10.859 1.941 19.748 1.00 . A A . 10 SER CB 1 1 8 2376 1 1 29 LYS H H 8.954 4.166 20.724 1.00 . A A . 10 SER H 1 1 8 2377 1 1 29 LYS HA H 11.226 2.724 21.701 1.00 . A A . 10 SER HA 1 1 8 2378 1 1 29 LYS HB2 H 11.805 2.024 19.235 1.00 . A A . 10 SER HB2 1 1 8 2379 1 1 29 LYS HB3 H 10.801 0.984 20.244 1.00 . A A . 10 SER HB3 1 1 8 2380 1 1 29 LYS N N 9.359 3.351 21.087 1.00 . A A . 10 SER N 1 1 8 2381 1 1 29 LYS O O 11.235 4.770 19.176 1.00 . A A . 10 SER O 1 1 8 2382 1 1 30 THR C C 12.285 7.216 20.494 1.00 . A A . 11 LYS C 1 1 8 2383 1 1 30 THR CA C 13.165 5.993 20.768 1.00 . A A . 11 LYS CA 1 1 8 2384 1 1 30 THR CB C 14.026 5.693 19.548 1.00 . A A . 11 LYS CB 1 1 8 2385 1 1 30 THR H H 12.538 4.376 21.970 1.00 . A A . 11 LYS H 1 1 8 2386 1 1 30 THR HA H 13.813 6.214 21.601 1.00 . A A . 11 LYS HA 1 1 8 2387 1 1 30 THR N N 12.384 4.811 21.111 1.00 . A A . 11 LYS N 1 1 8 2388 1 1 30 THR O O 12.791 8.281 20.143 1.00 . A A . 11 LYS O 1 1 8 2389 1 1 31 LYS C C 8.797 8.024 21.281 1.00 . A A . 12 THR C 1 1 8 2390 1 1 31 LYS CA C 10.051 8.165 20.423 1.00 . A A . 12 THR CA 1 1 8 2391 1 1 31 LYS CB C 9.680 8.240 18.951 1.00 . A A . 12 THR CB 1 1 8 2392 1 1 31 LYS H H 10.620 6.207 20.938 1.00 . A A . 12 THR H 1 1 8 2393 1 1 31 LYS HA H 10.545 9.059 20.692 1.00 . A A . 12 THR HA 1 1 8 2394 1 1 31 LYS N N 10.973 7.066 20.655 1.00 . A A . 12 THR N 1 1 8 2395 1 1 31 LYS O O 8.736 7.184 22.178 1.00 . A A . 12 THR O 1 1 8 2396 1 1 32 CYS C C 5.713 7.602 21.350 1.00 . A A . 13 LYS C 1 1 8 2397 1 1 32 CYS CA C 6.544 8.822 21.735 1.00 . A A . 13 LYS CA 1 1 8 2398 1 1 32 CYS CB C 5.745 10.101 21.477 1.00 . A A . 13 LYS CB 1 1 8 2399 1 1 32 CYS H H 7.904 9.498 20.272 1.00 . A A . 13 LYS H 1 1 8 2400 1 1 32 CYS HA H 6.784 8.765 22.783 1.00 . A A . 13 LYS HA 1 1 8 2401 1 1 32 CYS HB2 H 5.808 10.344 20.425 1.00 . A A . 13 LYS HB2 1 1 8 2402 1 1 32 CYS HB3 H 4.712 9.928 21.735 1.00 . A A . 13 LYS HB3 1 1 8 2403 1 1 32 CYS N N 7.796 8.852 20.996 1.00 . A A . 13 LYS N 1 1 8 2404 1 1 32 CYS O O 6.148 6.769 20.554 1.00 . A A . 13 LYS O 1 1 8 2405 1 1 33 SER C C 2.430 6.835 20.799 1.00 . A A . 14 CYS C 1 1 8 2406 1 1 33 SER CA C 3.624 6.383 21.636 1.00 . A A . 14 CYS CA 1 1 8 2407 1 1 33 SER CB C 3.137 5.752 22.943 1.00 . A A . 14 CYS CB 1 1 8 2408 1 1 33 SER H H 4.225 8.197 22.546 1.00 . A A . 14 CYS H 1 1 8 2409 1 1 33 SER HA H 4.184 5.646 21.078 1.00 . A A . 14 CYS HA 1 1 8 2410 1 1 33 SER HB2 H 3.191 6.488 23.731 1.00 . A A . 14 CYS HB2 1 1 8 2411 1 1 33 SER HB3 H 2.111 5.436 22.823 1.00 . A A . 14 CYS HB3 1 1 8 2412 1 1 33 SER N N 4.515 7.502 21.920 1.00 . A A . 14 CYS N 1 1 8 2413 1 1 33 SER O O 1.307 6.371 20.999 1.00 . A A . 14 CYS O 1 1 8 2414 1 1 34 VAL C C 2.153 8.620 17.618 1.00 . A A . 15 SER C 1 1 8 2415 1 1 34 VAL CA C 1.616 8.254 18.998 1.00 . A A . 15 SER CA 1 1 8 2416 1 1 34 VAL CB C 0.955 9.475 19.640 1.00 . A A . 15 SER CB 1 1 8 2417 1 1 34 VAL H H 3.590 8.079 19.745 1.00 . A A . 15 SER H 1 1 8 2418 1 1 34 VAL HA H 0.876 7.475 18.887 1.00 . A A . 15 SER HA 1 1 8 2419 1 1 34 VAL N N 2.677 7.744 19.860 1.00 . A A . 15 SER N 1 1 8 2420 1 1 34 VAL O O 3.226 9.213 17.500 1.00 . A A . 15 SER O 1 1 8 2421 1 1 35 ASN C C 3.255 8.616 14.959 1.00 . A A . 16 VAL C 1 1 8 2422 1 1 35 ASN CA C 1.744 8.537 15.185 1.00 . A A . 16 VAL CA 1 1 8 2423 1 1 35 ASN CB C 1.087 9.838 14.681 1.00 . A A . 16 VAL CB 1 1 8 2424 1 1 35 ASN H H 0.545 7.795 16.767 1.00 . A A . 16 VAL H 1 1 8 2425 1 1 35 ASN HA H 1.356 7.722 14.590 1.00 . A A . 16 VAL HA 1 1 8 2426 1 1 35 ASN N N 1.388 8.262 16.583 1.00 . A A . 16 VAL N 1 1 8 2427 1 1 35 ASN O O 3.883 9.640 15.226 1.00 . A A . 16 VAL O 1 1 8 2428 1 1 36 TRP C C 5.546 7.980 12.763 1.00 . A A . 17 ASN C 1 1 8 2429 1 1 36 TRP CA C 5.255 7.476 14.174 1.00 . A A . 17 ASN CA 1 1 8 2430 1 1 36 TRP CB C 5.775 6.047 14.344 1.00 . A A . 17 ASN CB 1 1 8 2431 1 1 36 TRP CG C 5.764 5.595 15.791 1.00 . A A . 17 ASN CG 1 1 8 2432 1 1 36 TRP H H 3.271 6.750 14.247 1.00 . A A . 17 ASN H 1 1 8 2433 1 1 36 TRP HA H 5.754 8.119 14.883 1.00 . A A . 17 ASN HA 1 1 8 2434 1 1 36 TRP HB2 H 5.152 5.375 13.772 1.00 . A A . 17 ASN HB2 1 1 8 2435 1 1 36 TRP HB3 H 6.788 5.994 13.975 1.00 . A A . 17 ASN HB3 1 1 8 2436 1 1 36 TRP N N 3.826 7.530 14.450 1.00 . A A . 17 ASN N 1 1 8 2437 1 1 36 TRP O O 6.161 7.283 11.955 1.00 . A A . 17 ASN O 1 1 8 2438 1 1 37 GLY C C 6.770 9.795 10.761 1.00 . A A . 18 TRP C 1 1 8 2439 1 1 37 GLY CA C 5.296 9.805 11.162 1.00 . A A . 18 TRP CA 1 1 8 2440 1 1 37 GLY H H 4.608 9.700 13.162 1.00 . A A . 18 TRP H 1 1 8 2441 1 1 37 GLY N N 5.094 9.197 12.474 1.00 . A A . 18 TRP N 1 1 8 2442 1 1 37 GLY O O 7.098 9.859 9.577 1.00 . A A . 18 TRP O 1 1 8 2443 1 1 38 GLN C C 9.658 8.295 11.551 1.00 . A A . 19 GLY C 1 1 8 2444 1 1 38 GLN CA C 9.080 9.694 11.473 1.00 . A A . 19 GLY CA 1 1 8 2445 1 1 38 GLN H H 7.337 9.665 12.677 1.00 . A A . 19 GLY H 1 1 8 2446 1 1 38 GLN N N 7.654 9.714 11.751 1.00 . A A . 19 GLY N 1 1 8 2447 1 1 38 GLN O O 10.346 7.840 10.633 1.00 . A A . 19 GLY O 1 1 8 2448 1 1 39 ALA C C 9.454 5.383 11.638 1.00 . A A . 20 GLN C 1 1 8 2449 1 1 39 ALA CA C 9.858 6.242 12.826 1.00 . A A . 20 GLN CA 1 1 8 2450 1 1 39 ALA CB C 9.319 5.642 14.127 1.00 . A A . 20 GLN CB 1 1 8 2451 1 1 39 ALA H H 8.809 8.006 13.340 1.00 . A A . 20 GLN H 1 1 8 2452 1 1 39 ALA HA H 10.938 6.280 12.872 1.00 . A A . 20 GLN HA 1 1 8 2453 1 1 39 ALA HB2 H 8.878 6.431 14.717 1.00 . A A . 20 GLN HB2 1 1 8 2454 1 1 39 ALA HB3 H 8.557 4.916 13.888 1.00 . A A . 20 GLN HB3 1 1 8 2455 1 1 39 ALA N N 9.368 7.600 12.646 1.00 . A A . 20 GLN N 1 1 8 2456 1 1 39 ALA O O 10.309 4.865 10.920 1.00 . A A . 20 GLN O 1 1 8 2457 1 1 40 PHE C C 8.052 5.072 8.963 1.00 . A A . 21 ALA C 1 1 8 2458 1 1 40 PHE CA C 7.670 4.455 10.292 1.00 . A A . 21 ALA CA 1 1 8 2459 1 1 40 PHE CB C 6.182 4.192 10.369 1.00 . A A . 21 ALA CB 1 1 8 2460 1 1 40 PHE H H 7.504 5.685 12.010 1.00 . A A . 21 ALA H 1 1 8 2461 1 1 40 PHE HA H 8.175 3.529 10.352 1.00 . A A . 21 ALA HA 1 1 8 2462 1 1 40 PHE HB2 H 5.914 3.946 11.385 1.00 . A A . 21 ALA HB2 1 1 8 2463 1 1 40 PHE HB3 H 5.940 3.362 9.719 1.00 . A A . 21 ALA HB3 1 1 8 2464 1 1 40 PHE N N 8.148 5.243 11.418 1.00 . A A . 21 ALA N 1 1 8 2465 1 1 40 PHE O O 7.880 4.467 7.905 1.00 . A A . 21 ALA O 1 1 8 2466 1 1 41 GLN C C 10.272 6.137 7.321 1.00 . A A . 22 PHE C 1 1 8 2467 1 1 41 GLN CA C 9.092 6.930 7.842 1.00 . A A . 22 PHE CA 1 1 8 2468 1 1 41 GLN CB C 9.507 8.371 8.145 1.00 . A A . 22 PHE CB 1 1 8 2469 1 1 41 GLN CG C 9.424 9.280 6.951 1.00 . A A . 22 PHE CG 1 1 8 2470 1 1 41 GLN H H 8.761 6.638 9.904 1.00 . A A . 22 PHE H 1 1 8 2471 1 1 41 GLN HA H 8.300 6.919 7.110 1.00 . A A . 22 PHE HA 1 1 8 2472 1 1 41 GLN HB2 H 8.862 8.770 8.913 1.00 . A A . 22 PHE HB2 1 1 8 2473 1 1 41 GLN HB3 H 10.526 8.378 8.497 1.00 . A A . 22 PHE HB3 1 1 8 2474 1 1 41 GLN N N 8.620 6.249 9.033 1.00 . A A . 22 PHE N 1 1 8 2475 1 1 41 GLN O O 10.422 5.911 6.120 1.00 . A A . 22 PHE O 1 1 8 2476 1 1 42 GLU C C 11.758 3.422 7.673 1.00 . A A . 23 GLN C 1 1 8 2477 1 1 42 GLU CA C 12.229 4.846 7.966 1.00 . A A . 23 GLN CA 1 1 8 2478 1 1 42 GLU CB C 13.208 4.849 9.145 1.00 . A A . 23 GLN CB 1 1 8 2479 1 1 42 GLU CD C 14.294 7.113 8.871 1.00 . A A . 23 GLN CD 1 1 8 2480 1 1 42 GLU CG C 14.493 5.611 8.866 1.00 . A A . 23 GLN CG 1 1 8 2481 1 1 42 GLU H H 10.870 5.874 9.211 1.00 . A A . 23 GLN H 1 1 8 2482 1 1 42 GLU HA H 12.717 5.248 7.091 1.00 . A A . 23 GLN HA 1 1 8 2483 1 1 42 GLU HB2 H 12.723 5.303 10.001 1.00 . A A . 23 GLN HB2 1 1 8 2484 1 1 42 GLU HB3 H 13.464 3.829 9.389 1.00 . A A . 23 GLN HB3 1 1 8 2485 1 1 42 GLU HG2 H 15.219 5.357 9.626 1.00 . A A . 23 GLN HG2 1 1 8 2486 1 1 42 GLU HG3 H 14.869 5.314 7.898 1.00 . A A . 23 GLN HG3 1 1 8 2487 1 1 42 GLU N N 11.080 5.675 8.270 1.00 . A A . 23 GLN N 1 1 8 2488 1 1 42 GLU O O 12.414 2.674 6.947 1.00 . A A . 23 GLN O 1 1 8 2489 1 1 42 GLU OE1 O 14.530 7.779 9.880 1.00 . A A . 23 GLN OE1 1 1 8 2490 1 1 43 ARG C C 9.357 1.627 6.686 1.00 . A A . 24 GLU C 1 1 8 2491 1 1 43 ARG CA C 10.032 1.734 8.052 1.00 . A A . 24 GLU CA 1 1 8 2492 1 1 43 ARG CB C 9.050 1.400 9.189 1.00 . A A . 24 GLU CB 1 1 8 2493 1 1 43 ARG CD C 6.664 0.997 9.925 1.00 . A A . 24 GLU CD 1 1 8 2494 1 1 43 ARG CG C 7.575 1.486 8.815 1.00 . A A . 24 GLU CG 1 1 8 2495 1 1 43 ARG H H 10.131 3.699 8.811 1.00 . A A . 24 GLU H 1 1 8 2496 1 1 43 ARG HA H 10.837 1.035 8.089 1.00 . A A . 24 GLU HA 1 1 8 2497 1 1 43 ARG HB2 H 9.248 0.393 9.526 1.00 . A A . 24 GLU HB2 1 1 8 2498 1 1 43 ARG HB3 H 9.231 2.079 10.008 1.00 . A A . 24 GLU HB3 1 1 8 2499 1 1 43 ARG HG2 H 7.330 2.513 8.596 1.00 . A A . 24 GLU HG2 1 1 8 2500 1 1 43 ARG HG3 H 7.403 0.881 7.937 1.00 . A A . 24 GLU HG3 1 1 8 2501 1 1 43 ARG N N 10.605 3.058 8.246 1.00 . A A . 24 GLU N 1 1 8 2502 1 1 43 ARG O O 9.341 0.559 6.073 1.00 . A A . 24 GLU O 1 1 8 2503 1 1 44 TYR C C 9.136 2.701 3.786 1.00 . A A . 25 ARG C 1 1 8 2504 1 1 44 TYR CA C 8.128 2.769 4.925 1.00 . A A . 25 ARG CA 1 1 8 2505 1 1 44 TYR CB C 7.263 4.030 4.801 1.00 . A A . 25 ARG CB 1 1 8 2506 1 1 44 TYR CG C 8.050 5.318 4.597 1.00 . A A . 25 ARG CG 1 1 8 2507 1 1 44 TYR CZ C 6.826 6.844 1.411 1.00 . A A . 25 ARG CZ 1 1 8 2508 1 1 44 TYR H H 8.845 3.557 6.750 1.00 . A A . 25 ARG H 1 1 8 2509 1 1 44 TYR HA H 7.494 1.906 4.873 1.00 . A A . 25 ARG HA 1 1 8 2510 1 1 44 TYR HB2 H 6.597 3.910 3.963 1.00 . A A . 25 ARG HB2 1 1 8 2511 1 1 44 TYR HB3 H 6.678 4.134 5.702 1.00 . A A . 25 ARG HB3 1 1 8 2512 1 1 44 TYR HD2 H 6.228 6.307 4.109 1.00 . A A . 25 ARG HD2 1 1 8 2513 1 1 44 TYR N N 8.801 2.739 6.216 1.00 . A A . 25 ARG N 1 1 8 2514 1 1 44 TYR O O 8.877 2.105 2.740 1.00 . A A . 25 ARG O 1 1 8 2515 1 1 45 THR C C 11.908 1.953 2.773 1.00 . A A . 26 TYR C 1 1 8 2516 1 1 45 THR CA C 11.348 3.352 3.012 1.00 . A A . 26 TYR CA 1 1 8 2517 1 1 45 THR CB C 12.467 4.292 3.465 1.00 . A A . 26 TYR CB 1 1 8 2518 1 1 45 THR H H 10.411 3.776 4.861 1.00 . A A . 26 TYR H 1 1 8 2519 1 1 45 THR HA H 10.930 3.722 2.090 1.00 . A A . 26 TYR HA 1 1 8 2520 1 1 45 THR N N 10.282 3.322 4.005 1.00 . A A . 26 TYR N 1 1 8 2521 1 1 45 THR O O 12.332 1.625 1.665 1.00 . A A . 26 TYR O 1 1 8 2522 1 1 46 ALA C C 11.414 -1.135 3.014 1.00 . A A . 27 THR C 1 1 8 2523 1 1 46 ALA CA C 12.415 -0.229 3.722 1.00 . A A . 27 THR CA 1 1 8 2524 1 1 46 ALA CB C 12.723 -0.780 5.116 1.00 . A A . 27 THR CB 1 1 8 2525 1 1 46 ALA H H 11.555 1.455 4.676 1.00 . A A . 27 THR H 1 1 8 2526 1 1 46 ALA HA H 13.328 -0.201 3.146 1.00 . A A . 27 THR HA 1 1 8 2527 1 1 46 ALA N N 11.906 1.134 3.819 1.00 . A A . 27 THR N 1 1 8 2528 1 1 46 ALA O O 11.797 -2.029 2.259 1.00 . A A . 27 THR O 1 1 8 2529 1 1 47 GLY C C 9.048 -1.510 1.140 1.00 . A A . 28 ALA C 1 1 8 2530 1 1 47 GLY CA C 9.073 -1.697 2.653 1.00 . A A . 28 ALA CA 1 1 8 2531 1 1 47 GLY H H 9.888 -0.177 3.878 1.00 . A A . 28 ALA H 1 1 8 2532 1 1 47 GLY N N 10.131 -0.900 3.265 1.00 . A A . 28 ALA N 1 1 8 2533 1 1 47 GLY O O 8.971 -2.480 0.387 1.00 . A A . 28 ALA O 1 1 8 2534 1 1 48 ILE C C 10.316 -0.490 -1.438 1.00 . A A . 29 GLY C 1 1 8 2535 1 1 48 ILE CA C 9.088 0.033 -0.722 1.00 . A A . 29 GLY CA 1 1 8 2536 1 1 48 ILE H H 9.166 0.477 1.348 1.00 . A A . 29 GLY H 1 1 8 2537 1 1 48 ILE N N 9.108 -0.256 0.701 1.00 . A A . 29 GLY N 1 1 8 2538 1 1 48 ILE O O 10.209 -1.294 -2.365 1.00 . A A . 29 GLY O 1 1 8 2539 1 1 49 ASN C C 12.892 -1.979 -1.566 1.00 . A A . 30 ILE C 1 1 8 2540 1 1 49 ASN CA C 12.744 -0.459 -1.616 1.00 . A A . 30 ILE CA 1 1 8 2541 1 1 49 ASN CB C 13.955 0.194 -0.919 1.00 . A A . 30 ILE CB 1 1 8 2542 1 1 49 ASN H H 11.509 0.606 -0.267 1.00 . A A . 30 ILE H 1 1 8 2543 1 1 49 ASN HA H 12.738 -0.143 -2.649 1.00 . A A . 30 ILE HA 1 1 8 2544 1 1 49 ASN N N 11.489 -0.033 -1.010 1.00 . A A . 30 ILE N 1 1 8 2545 1 1 49 ASN O O 13.566 -2.573 -2.407 1.00 . A A . 30 ILE O 1 1 8 2546 1 1 50 SER C C 11.949 -4.758 -1.724 1.00 . A A . 31 ASN C 1 1 8 2547 1 1 50 SER CA C 12.316 -4.054 -0.420 1.00 . A A . 31 ASN CA 1 1 8 2548 1 1 50 SER CB C 11.378 -4.505 0.703 1.00 . A A . 31 ASN CB 1 1 8 2549 1 1 50 SER H H 11.733 -2.075 0.062 1.00 . A A . 31 ASN H 1 1 8 2550 1 1 50 SER HA H 13.330 -4.316 -0.158 1.00 . A A . 31 ASN HA 1 1 8 2551 1 1 50 SER HB2 H 10.825 -3.653 1.066 1.00 . A A . 31 ASN HB2 1 1 8 2552 1 1 50 SER HB3 H 10.686 -5.239 0.315 1.00 . A A . 31 ASN HB3 1 1 8 2553 1 1 50 SER N N 12.255 -2.602 -0.577 1.00 . A A . 31 ASN N 1 1 8 2554 1 1 50 SER O O 12.789 -5.407 -2.348 1.00 . A A . 31 ASN O 1 1 8 2555 1 1 51 PHE C C 11.054 -4.771 -4.554 1.00 . A A . 32 SER C 1 1 8 2556 1 1 51 PHE CA C 10.218 -5.238 -3.367 1.00 . A A . 32 SER CA 1 1 8 2557 1 1 51 PHE CB C 8.745 -4.902 -3.601 1.00 . A A . 32 SER CB 1 1 8 2558 1 1 51 PHE H H 10.069 -4.086 -1.596 1.00 . A A . 32 SER H 1 1 8 2559 1 1 51 PHE HA H 10.324 -6.308 -3.264 1.00 . A A . 32 SER HA 1 1 8 2560 1 1 51 PHE HB2 H 8.540 -3.910 -3.228 1.00 . A A . 32 SER HB2 1 1 8 2561 1 1 51 PHE HB3 H 8.533 -4.939 -4.660 1.00 . A A . 32 SER HB3 1 1 8 2562 1 1 51 PHE N N 10.691 -4.619 -2.133 1.00 . A A . 32 SER N 1 1 8 2563 1 1 51 PHE O O 11.279 -5.521 -5.503 1.00 . A A . 32 SER O 1 1 8 2564 1 1 52 VAL C C 13.658 -3.698 -5.668 1.00 . A A . 33 PHE C 1 1 8 2565 1 1 52 VAL CA C 12.329 -2.952 -5.549 1.00 . A A . 33 PHE CA 1 1 8 2566 1 1 52 VAL CB C 12.562 -1.457 -5.277 1.00 . A A . 33 PHE CB 1 1 8 2567 1 1 52 VAL H H 11.301 -2.979 -3.702 1.00 . A A . 33 PHE H 1 1 8 2568 1 1 52 VAL HA H 11.786 -3.059 -6.474 1.00 . A A . 33 PHE HA 1 1 8 2569 1 1 52 VAL N N 11.514 -3.526 -4.487 1.00 . A A . 33 PHE N 1 1 8 2570 1 1 52 VAL O O 14.107 -4.016 -6.772 1.00 . A A . 33 PHE O 1 1 8 2571 1 1 53 SER C C 15.462 -6.001 -5.261 1.00 . A A . 34 VAL C 1 1 8 2572 1 1 53 SER CA C 15.558 -4.681 -4.507 1.00 . A A . 34 VAL CA 1 1 8 2573 1 1 53 SER CB C 16.038 -4.947 -3.064 1.00 . A A . 34 VAL CB 1 1 8 2574 1 1 53 SER H H 13.876 -3.697 -3.679 1.00 . A A . 34 VAL H 1 1 8 2575 1 1 53 SER HA H 16.292 -4.056 -4.999 1.00 . A A . 34 VAL HA 1 1 8 2576 1 1 53 SER N N 14.282 -3.974 -4.526 1.00 . A A . 34 VAL N 1 1 8 2577 1 1 53 SER O O 15.997 -6.131 -6.356 1.00 . A A . 34 VAL O 1 1 8 2578 1 1 54 GLY C C 14.212 -8.200 -6.719 1.00 . A A . 35 SER C 1 1 8 2579 1 1 54 GLY CA C 14.655 -8.286 -5.280 1.00 . A A . 35 SER CA 1 1 8 2580 1 1 54 GLY H H 14.413 -6.851 -3.789 1.00 . A A . 35 SER H 1 1 8 2581 1 1 54 GLY N N 14.792 -6.986 -4.669 1.00 . A A . 35 SER N 1 1 8 2582 1 1 54 GLY O O 14.899 -8.710 -7.602 1.00 . A A . 35 SER O 1 1 8 2583 1 1 55 VAL C C 13.836 -7.309 -9.266 1.00 . A A . 36 GLY C 1 1 8 2584 1 1 55 VAL CA C 12.640 -7.412 -8.341 1.00 . A A . 36 GLY CA 1 1 8 2585 1 1 55 VAL H H 12.594 -7.145 -6.233 1.00 . A A . 36 GLY H 1 1 8 2586 1 1 55 VAL N N 13.093 -7.546 -6.970 1.00 . A A . 36 GLY N 1 1 8 2587 1 1 55 VAL O O 13.905 -7.968 -10.303 1.00 . A A . 36 GLY O 1 1 8 2588 1 1 56 ALA C C 17.120 -7.293 -9.089 1.00 . A A . 37 VAL C 1 1 8 2589 1 1 56 ALA CA C 16.037 -6.309 -9.550 1.00 . A A . 37 VAL CA 1 1 8 2590 1 1 56 ALA CB C 16.555 -4.867 -9.382 1.00 . A A . 37 VAL CB 1 1 8 2591 1 1 56 ALA H H 14.689 -6.041 -7.984 1.00 . A A . 37 VAL H 1 1 8 2592 1 1 56 ALA HA H 15.837 -6.475 -10.593 1.00 . A A . 37 VAL HA 1 1 8 2593 1 1 56 ALA N N 14.800 -6.499 -8.837 1.00 . A A . 37 VAL N 1 1 8 2594 1 1 56 ALA O O 17.516 -8.198 -9.823 1.00 . A A . 37 VAL O 1 1 8 2595 1 1 57 SER C C 18.227 -9.142 -6.613 1.00 . A A . 38 ALA C 1 1 8 2596 1 1 57 SER CA C 18.689 -7.857 -7.285 1.00 . A A . 38 ALA CA 1 1 8 2597 1 1 57 SER CB C 19.465 -7.015 -6.278 1.00 . A A . 38 ALA CB 1 1 8 2598 1 1 57 SER H H 17.267 -6.316 -7.349 1.00 . A A . 38 ALA H 1 1 8 2599 1 1 57 SER HA H 19.360 -8.106 -8.080 1.00 . A A . 38 ALA HA 1 1 8 2600 1 1 57 SER HB2 H 19.148 -7.269 -5.270 1.00 . A A . 38 ALA HB2 1 1 8 2601 1 1 57 SER HB3 H 19.274 -5.968 -6.460 1.00 . A A . 38 ALA HB3 1 1 8 2602 1 1 57 SER N N 17.621 -7.060 -7.870 1.00 . A A . 38 ALA N 1 1 8 2603 1 1 57 SER O O 18.454 -10.248 -7.102 1.00 . A A . 38 ALA O 1 1 8 2604 1 1 58 GLY C C 16.095 -10.922 -5.212 1.00 . A A . 39 SER C 1 1 8 2605 1 1 58 GLY CA C 17.186 -10.045 -4.586 1.00 . A A . 39 SER CA 1 1 8 2606 1 1 58 GLY H H 17.539 -8.041 -5.109 1.00 . A A . 39 SER H 1 1 8 2607 1 1 58 GLY N N 17.637 -8.957 -5.439 1.00 . A A . 39 SER N 1 1 8 2608 1 1 58 GLY O O 15.591 -11.841 -4.566 1.00 . A A . 39 SER O 1 1 8 2609 1 1 59 ALA C C 15.285 -12.403 -8.132 1.00 . A A . 40 GLY C 1 1 8 2610 1 1 59 ALA CA C 14.706 -11.433 -7.123 1.00 . A A . 40 GLY CA 1 1 8 2611 1 1 59 ALA H H 16.155 -9.905 -6.938 1.00 . A A . 40 GLY H 1 1 8 2612 1 1 59 ALA N N 15.731 -10.646 -6.461 1.00 . A A . 40 GLY N 1 1 8 2613 1 1 59 ALA O O 14.695 -13.448 -8.409 1.00 . A A . 40 GLY O 1 1 8 2614 1 1 60 GLY C C 18.532 -12.431 -9.924 1.00 . A A . 41 ALA C 1 1 8 2615 1 1 60 GLY CA C 17.108 -12.904 -9.664 1.00 . A A . 41 ALA CA 1 1 8 2616 1 1 60 GLY H H 16.864 -11.216 -8.419 1.00 . A A . 41 ALA H 1 1 8 2617 1 1 60 GLY N N 16.444 -12.059 -8.682 1.00 . A A . 41 ALA N 1 1 8 2618 1 1 60 GLY O O 19.490 -12.974 -9.373 1.00 . A A . 41 ALA O 1 1 8 2619 1 1 61 SER C C 20.725 -11.744 -12.075 1.00 . A A . 42 GLY C 1 1 8 2620 1 1 61 SER CA C 19.965 -10.877 -11.090 1.00 . A A . 42 GLY CA 1 1 8 2621 1 1 61 SER H H 17.855 -11.035 -11.165 1.00 . A A . 42 GLY H 1 1 8 2622 1 1 61 SER N N 18.658 -11.418 -10.764 1.00 . A A . 42 GLY N 1 1 8 2623 1 1 61 SER O O 21.609 -12.507 -11.687 1.00 . A A . 42 GLY O 1 1 8 2624 1 1 62 ILE C C 20.948 -11.689 -15.743 1.00 . A A . 43 SER C 1 1 8 2625 1 1 62 ILE CA C 21.037 -12.402 -14.397 1.00 . A A . 43 SER CA 1 1 8 2626 1 1 62 ILE CB C 20.408 -13.792 -14.501 1.00 . A A . 43 SER CB 1 1 8 2627 1 1 62 ILE H H 19.669 -10.998 -13.600 1.00 . A A . 43 SER H 1 1 8 2628 1 1 62 ILE HA H 22.078 -12.507 -14.128 1.00 . A A . 43 SER HA 1 1 8 2629 1 1 62 ILE N N 20.381 -11.625 -13.353 1.00 . A A . 43 SER N 1 1 8 2630 1 1 62 ILE O O 20.890 -12.327 -16.794 1.00 . A A . 43 SER O 1 1 8 2631 1 1 63 GLY C C 22.057 -8.630 -17.049 1.00 . A A . 44 ILE C 1 1 8 2632 1 1 63 GLY CA C 20.854 -9.558 -16.919 1.00 . A A . 44 ILE CA 1 1 8 2633 1 1 63 GLY H H 20.985 -9.907 -14.835 1.00 . A A . 44 ILE H 1 1 8 2634 1 1 63 GLY N N 20.937 -10.359 -15.704 1.00 . A A . 44 ILE N 1 1 8 2635 1 1 63 GLY O O 21.925 -7.474 -17.452 1.00 . A A . 44 ILE O 1 1 8 2636 1 1 64 ARG C C 25.564 -9.076 -17.513 1.00 . A A . 45 GLY C 1 1 8 2637 1 1 64 ARG CA C 24.446 -8.351 -16.790 1.00 . A A . 45 GLY CA 1 1 8 2638 1 1 64 ARG H H 23.279 -10.072 -16.391 1.00 . A A . 45 GLY H 1 1 8 2639 1 1 64 ARG N N 23.234 -9.145 -16.705 1.00 . A A . 45 GLY N 1 1 8 2640 1 1 64 ARG O O 25.574 -9.147 -18.742 1.00 . A A . 45 GLY O 1 1 9 2641 1 1 20 ASN C C -8.632 -14.566 32.662 1.00 . A A . 1 VAL C 1 1 9 2642 1 1 20 ASN CA C -9.322 -13.286 33.122 1.00 . A A . 1 VAL CA 1 1 9 2643 1 1 20 ASN CB C -8.314 -12.427 33.909 1.00 . A A . 1 VAL CB 1 1 9 2644 1 1 20 ASN H H -10.549 -14.435 34.407 1.00 . A A . 1 VAL H 1 1 9 2645 1 1 20 ASN HA H -9.639 -12.727 32.253 1.00 . A A . 1 VAL HA 1 1 9 2646 1 1 20 ASN N N -10.504 -13.585 33.922 1.00 . A A . 1 VAL N 1 1 9 2647 1 1 20 ASN O O -7.820 -15.139 33.388 1.00 . A A . 1 VAL O 1 1 9 2648 1 1 21 TYR C C -7.939 -16.005 29.450 1.00 . A A . 2 ASN C 1 1 9 2649 1 1 21 TYR CA C -8.372 -16.222 30.897 1.00 . A A . 2 ASN CA 1 1 9 2650 1 1 21 TYR CB C -9.368 -17.379 30.976 1.00 . A A . 2 ASN CB 1 1 9 2651 1 1 21 TYR CG C -8.734 -18.714 30.633 1.00 . A A . 2 ASN CG 1 1 9 2652 1 1 21 TYR H H -9.614 -14.508 30.922 1.00 . A A . 2 ASN H 1 1 9 2653 1 1 21 TYR HA H -7.502 -16.467 31.487 1.00 . A A . 2 ASN HA 1 1 9 2654 1 1 21 TYR HB2 H -9.765 -17.438 31.979 1.00 . A A . 2 ASN HB2 1 1 9 2655 1 1 21 TYR HB3 H -10.179 -17.198 30.284 1.00 . A A . 2 ASN HB3 1 1 9 2656 1 1 21 TYR N N -8.961 -15.009 31.453 1.00 . A A . 2 ASN N 1 1 9 2657 1 1 21 TYR O O -8.592 -16.477 28.518 1.00 . A A . 2 ASN O 1 1 9 2658 1 1 22 GLY C C -7.331 -14.235 27.105 1.00 . A A . 3 TYR C 1 1 9 2659 1 1 22 GLY CA C -6.314 -15.013 27.935 1.00 . A A . 3 TYR CA 1 1 9 2660 1 1 22 GLY H H -6.356 -14.942 30.050 1.00 . A A . 3 TYR H 1 1 9 2661 1 1 22 GLY N N -6.834 -15.290 29.269 1.00 . A A . 3 TYR N 1 1 9 2662 1 1 22 GLY O O -8.022 -14.802 26.258 1.00 . A A . 3 TYR O 1 1 9 2663 1 1 23 ASN C C -8.303 -10.647 27.061 1.00 . A A . 4 GLY C 1 1 9 2664 1 1 23 ASN CA C -8.354 -12.098 26.623 1.00 . A A . 4 GLY CA 1 1 9 2665 1 1 23 ASN H H -6.844 -12.534 28.041 1.00 . A A . 4 GLY H 1 1 9 2666 1 1 23 ASN N N -7.419 -12.932 27.354 1.00 . A A . 4 GLY N 1 1 9 2667 1 1 23 ASN O O -9.337 -9.985 27.163 1.00 . A A . 4 GLY O 1 1 9 2668 1 1 24 GLY C C -7.182 -7.795 26.606 1.00 . A A . 5 ASN C 1 1 9 2669 1 1 24 GLY CA C -6.916 -8.769 27.751 1.00 . A A . 5 ASN CA 1 1 9 2670 1 1 24 GLY H H -6.312 -10.728 27.222 1.00 . A A . 5 ASN H 1 1 9 2671 1 1 24 GLY N N -7.098 -10.151 27.321 1.00 . A A . 5 ASN N 1 1 9 2672 1 1 24 GLY O O -7.444 -6.613 26.833 1.00 . A A . 5 ASN O 1 1 9 2673 1 1 25 VAL C C -6.124 -6.654 23.823 1.00 . A A . 6 GLY C 1 1 9 2674 1 1 25 VAL CA C -7.350 -7.455 24.219 1.00 . A A . 6 GLY CA 1 1 9 2675 1 1 25 VAL H H -6.901 -9.244 25.257 1.00 . A A . 6 GLY H 1 1 9 2676 1 1 25 VAL N N -7.113 -8.296 25.377 1.00 . A A . 6 GLY N 1 1 9 2677 1 1 25 VAL O O -6.008 -5.477 24.162 1.00 . A A . 6 GLY O 1 1 9 2678 1 1 26 SER C C -4.301 -5.423 21.787 1.00 . A A . 7 VAL C 1 1 9 2679 1 1 26 SER CA C -3.985 -6.636 22.663 1.00 . A A . 7 VAL CA 1 1 9 2680 1 1 26 SER CB C -3.061 -7.623 21.905 1.00 . A A . 7 VAL CB 1 1 9 2681 1 1 26 SER H H -5.357 -8.234 22.866 1.00 . A A . 7 VAL H 1 1 9 2682 1 1 26 SER HA H -3.459 -6.295 23.544 1.00 . A A . 7 VAL HA 1 1 9 2683 1 1 26 SER N N -5.208 -7.295 23.104 1.00 . A A . 7 VAL N 1 1 9 2684 1 1 26 SER O O -5.420 -4.910 21.799 1.00 . A A . 7 VAL O 1 1 9 2685 1 1 27 CYS C C -4.431 -4.154 19.002 1.00 . A A . 8 SER C 1 1 9 2686 1 1 27 CYS CA C -3.476 -3.825 20.147 1.00 . A A . 8 SER CA 1 1 9 2687 1 1 27 CYS CB C -2.121 -3.385 19.588 1.00 . A A . 8 SER CB 1 1 9 2688 1 1 27 CYS H H -2.444 -5.428 21.065 1.00 . A A . 8 SER H 1 1 9 2689 1 1 27 CYS HA H -3.894 -3.017 20.728 1.00 . A A . 8 SER HA 1 1 9 2690 1 1 27 CYS HB2 H -1.839 -4.041 18.777 1.00 . A A . 8 SER HB2 1 1 9 2691 1 1 27 CYS HB3 H -2.195 -2.372 19.222 1.00 . A A . 8 SER HB3 1 1 9 2692 1 1 27 CYS N N -3.309 -4.973 21.030 1.00 . A A . 8 SER N 1 1 9 2693 1 1 27 CYS O O -5.151 -5.152 19.050 1.00 . A A . 8 SER O 1 1 9 2694 1 1 28 SER C C -6.743 -3.741 17.240 1.00 . A A . 9 CYS C 1 1 9 2695 1 1 28 SER CA C -5.290 -3.514 16.813 1.00 . A A . 9 CYS CA 1 1 9 2696 1 1 28 SER CB C -4.776 -4.697 15.988 1.00 . A A . 9 CYS CB 1 1 9 2697 1 1 28 SER H H -3.829 -2.538 17.990 1.00 . A A . 9 CYS H 1 1 9 2698 1 1 28 SER HA H -5.243 -2.620 16.208 1.00 . A A . 9 CYS HA 1 1 9 2699 1 1 28 SER HB2 H -3.738 -4.865 16.231 1.00 . A A . 9 CYS HB2 1 1 9 2700 1 1 28 SER HB3 H -5.348 -5.578 16.238 1.00 . A A . 9 CYS HB3 1 1 9 2701 1 1 28 SER N N -4.429 -3.312 17.972 1.00 . A A . 9 CYS N 1 1 9 2702 1 1 28 SER O O -7.164 -3.269 18.296 1.00 . A A . 9 CYS O 1 1 9 2703 1 1 29 LYS C C -9.790 -3.520 16.455 1.00 . A A . 10 SER C 1 1 9 2704 1 1 29 LYS CA C -8.916 -4.743 16.707 1.00 . A A . 10 SER CA 1 1 9 2705 1 1 29 LYS CB C -9.071 -5.173 18.158 1.00 . A A . 10 SER CB 1 1 9 2706 1 1 29 LYS H H -7.118 -4.805 15.585 1.00 . A A . 10 SER H 1 1 9 2707 1 1 29 LYS HA H -9.238 -5.547 16.063 1.00 . A A . 10 SER HA 1 1 9 2708 1 1 29 LYS HB2 H -8.151 -5.621 18.494 1.00 . A A . 10 SER HB2 1 1 9 2709 1 1 29 LYS HB3 H -9.286 -4.300 18.753 1.00 . A A . 10 SER HB3 1 1 9 2710 1 1 29 LYS N N -7.508 -4.459 16.415 1.00 . A A . 10 SER N 1 1 9 2711 1 1 29 LYS O O -10.918 -3.432 16.943 1.00 . A A . 10 SER O 1 1 9 2712 1 1 30 THR C C -9.544 -0.855 13.975 1.00 . A A . 11 LYS C 1 1 9 2713 1 1 30 THR CA C -9.975 -1.362 15.344 1.00 . A A . 11 LYS CA 1 1 9 2714 1 1 30 THR CB C -9.724 -0.285 16.402 1.00 . A A . 11 LYS CB 1 1 9 2715 1 1 30 THR H H -8.362 -2.732 15.341 1.00 . A A . 11 LYS H 1 1 9 2716 1 1 30 THR HA H -11.023 -1.589 15.313 1.00 . A A . 11 LYS HA 1 1 9 2717 1 1 30 THR N N -9.261 -2.589 15.687 1.00 . A A . 11 LYS N 1 1 9 2718 1 1 30 THR O O -10.361 -0.400 13.176 1.00 . A A . 11 LYS O 1 1 9 2719 1 1 31 LYS C C -6.424 -1.346 12.149 1.00 . A A . 12 THR C 1 1 9 2720 1 1 31 LYS CA C -7.672 -0.520 12.459 1.00 . A A . 12 THR CA 1 1 9 2721 1 1 31 LYS CB C -7.340 0.964 12.511 1.00 . A A . 12 THR CB 1 1 9 2722 1 1 31 LYS H H -7.667 -1.327 14.400 1.00 . A A . 12 THR H 1 1 9 2723 1 1 31 LYS HA H -8.390 -0.685 11.702 1.00 . A A . 12 THR HA 1 1 9 2724 1 1 31 LYS N N -8.251 -0.950 13.720 1.00 . A A . 12 THR N 1 1 9 2725 1 1 31 LYS O O -6.296 -2.476 12.616 1.00 . A A . 12 THR O 1 1 9 2726 1 1 32 CYS C C -3.523 -1.913 12.289 1.00 . A A . 13 LYS C 1 1 9 2727 1 1 32 CYS CA C -4.274 -1.497 11.026 1.00 . A A . 13 LYS CA 1 1 9 2728 1 1 32 CYS CB C -3.379 -0.619 10.150 1.00 . A A . 13 LYS CB 1 1 9 2729 1 1 32 CYS H H -5.645 0.117 11.023 1.00 . A A . 13 LYS H 1 1 9 2730 1 1 32 CYS HA H -4.547 -2.384 10.474 1.00 . A A . 13 LYS HA 1 1 9 2731 1 1 32 CYS HB2 H -3.329 0.370 10.583 1.00 . A A . 13 LYS HB2 1 1 9 2732 1 1 32 CYS HB3 H -2.386 -1.044 10.129 1.00 . A A . 13 LYS HB3 1 1 9 2733 1 1 32 CYS N N -5.502 -0.788 11.369 1.00 . A A . 13 LYS N 1 1 9 2734 1 1 32 CYS O O -3.594 -1.234 13.313 1.00 . A A . 13 LYS O 1 1 9 2735 1 1 33 SER C C -0.624 -2.979 13.361 1.00 . A A . 14 CYS C 1 1 9 2736 1 1 33 SER CA C -2.050 -3.528 13.360 1.00 . A A . 14 CYS CA 1 1 9 2737 1 1 33 SER CB C -2.015 -5.060 13.355 1.00 . A A . 14 CYS CB 1 1 9 2738 1 1 33 SER H H -2.790 -3.533 11.373 1.00 . A A . 14 CYS H 1 1 9 2739 1 1 33 SER HA H -2.552 -3.193 14.256 1.00 . A A . 14 CYS HA 1 1 9 2740 1 1 33 SER HB2 H -1.519 -5.396 12.457 1.00 . A A . 14 CYS HB2 1 1 9 2741 1 1 33 SER HB3 H -1.454 -5.398 14.215 1.00 . A A . 14 CYS HB3 1 1 9 2742 1 1 33 SER N N -2.808 -3.031 12.214 1.00 . A A . 14 CYS N 1 1 9 2743 1 1 33 SER O O 0.267 -3.549 13.992 1.00 . A A . 14 CYS O 1 1 9 2744 1 1 34 VAL C C 0.803 0.193 12.111 1.00 . A A . 15 SER C 1 1 9 2745 1 1 34 VAL CA C 0.909 -1.254 12.583 1.00 . A A . 15 SER CA 1 1 9 2746 1 1 34 VAL CB C 1.816 -2.048 11.640 1.00 . A A . 15 SER CB 1 1 9 2747 1 1 34 VAL H H -1.155 -1.458 12.174 1.00 . A A . 15 SER H 1 1 9 2748 1 1 34 VAL HA H 1.335 -1.267 13.574 1.00 . A A . 15 SER HA 1 1 9 2749 1 1 34 VAL N N -0.410 -1.871 12.655 1.00 . A A . 15 SER N 1 1 9 2750 1 1 34 VAL O O 1.157 0.515 10.976 1.00 . A A . 15 SER O 1 1 9 2751 1 1 35 ASN C C 1.271 3.310 13.285 1.00 . A A . 16 VAL C 1 1 9 2752 1 1 35 ASN CA C 0.158 2.473 12.662 1.00 . A A . 16 VAL CA 1 1 9 2753 1 1 35 ASN CB C -1.202 3.014 13.138 1.00 . A A . 16 VAL CB 1 1 9 2754 1 1 35 ASN H H 0.047 0.745 13.878 1.00 . A A . 16 VAL H 1 1 9 2755 1 1 35 ASN HA H 0.206 2.574 11.587 1.00 . A A . 16 VAL HA 1 1 9 2756 1 1 35 ASN N N 0.313 1.061 12.989 1.00 . A A . 16 VAL N 1 1 9 2757 1 1 35 ASN O O 1.572 3.177 14.471 1.00 . A A . 16 VAL O 1 1 9 2758 1 1 36 TRP C C 3.407 5.980 11.832 1.00 . A A . 17 ASN C 1 1 9 2759 1 1 36 TRP CA C 2.956 5.035 12.942 1.00 . A A . 17 ASN CA 1 1 9 2760 1 1 36 TRP CB C 4.139 4.194 13.426 1.00 . A A . 17 ASN CB 1 1 9 2761 1 1 36 TRP CG C 4.134 4.003 14.930 1.00 . A A . 17 ASN CG 1 1 9 2762 1 1 36 TRP H H 1.589 4.231 11.541 1.00 . A A . 17 ASN H 1 1 9 2763 1 1 36 TRP HA H 2.579 5.622 13.766 1.00 . A A . 17 ASN HA 1 1 9 2764 1 1 36 TRP HB2 H 4.096 3.223 12.959 1.00 . A A . 17 ASN HB2 1 1 9 2765 1 1 36 TRP HB3 H 5.060 4.684 13.147 1.00 . A A . 17 ASN HB3 1 1 9 2766 1 1 36 TRP N N 1.876 4.173 12.476 1.00 . A A . 17 ASN N 1 1 9 2767 1 1 36 TRP O O 4.222 5.614 10.985 1.00 . A A . 17 ASN O 1 1 9 2768 1 1 37 GLY C C 4.695 8.535 10.863 1.00 . A A . 18 TRP C 1 1 9 2769 1 1 37 GLY CA C 3.207 8.190 10.830 1.00 . A A . 18 TRP CA 1 1 9 2770 1 1 37 GLY H H 2.220 7.423 12.538 1.00 . A A . 18 TRP H 1 1 9 2771 1 1 37 GLY N N 2.867 7.193 11.839 1.00 . A A . 18 TRP N 1 1 9 2772 1 1 37 GLY O O 5.233 9.078 9.900 1.00 . A A . 18 TRP O 1 1 9 2773 1 1 38 GLN C C 7.615 7.240 12.044 1.00 . A A . 19 GLY C 1 1 9 2774 1 1 38 GLN CA C 6.773 8.499 12.098 1.00 . A A . 19 GLY CA 1 1 9 2775 1 1 38 GLN H H 4.878 7.784 12.711 1.00 . A A . 19 GLY H 1 1 9 2776 1 1 38 GLN N N 5.355 8.216 11.973 1.00 . A A . 19 GLY N 1 1 9 2777 1 1 38 GLN O O 8.552 7.138 11.247 1.00 . A A . 19 GLY O 1 1 9 2778 1 1 39 ALA C C 8.043 4.380 11.540 1.00 . A A . 20 GLN C 1 1 9 2779 1 1 39 ALA CA C 8.004 5.011 12.924 1.00 . A A . 20 GLN CA 1 1 9 2780 1 1 39 ALA CB C 7.365 4.051 13.929 1.00 . A A . 20 GLN CB 1 1 9 2781 1 1 39 ALA H H 6.518 6.406 13.493 1.00 . A A . 20 GLN H 1 1 9 2782 1 1 39 ALA HA H 9.020 5.224 13.231 1.00 . A A . 20 GLN HA 1 1 9 2783 1 1 39 ALA HB2 H 6.645 4.595 14.521 1.00 . A A . 20 GLN HB2 1 1 9 2784 1 1 39 ALA HB3 H 6.854 3.267 13.388 1.00 . A A . 20 GLN HB3 1 1 9 2785 1 1 39 ALA N N 7.276 6.271 12.887 1.00 . A A . 20 GLN N 1 1 9 2786 1 1 39 ALA O O 9.113 4.228 10.954 1.00 . A A . 20 GLN O 1 1 9 2787 1 1 40 PHE C C 7.270 4.379 8.606 1.00 . A A . 21 ALA C 1 1 9 2788 1 1 40 PHE CA C 6.824 3.417 9.686 1.00 . A A . 21 ALA CA 1 1 9 2789 1 1 40 PHE CB C 5.465 2.828 9.374 1.00 . A A . 21 ALA CB 1 1 9 2790 1 1 40 PHE H H 6.044 4.166 11.510 1.00 . A A . 21 ALA H 1 1 9 2791 1 1 40 PHE HA H 7.530 2.632 9.701 1.00 . A A . 21 ALA HA 1 1 9 2792 1 1 40 PHE HB2 H 5.593 1.978 8.718 1.00 . A A . 21 ALA HB2 1 1 9 2793 1 1 40 PHE HB3 H 4.852 3.571 8.888 1.00 . A A . 21 ALA HB3 1 1 9 2794 1 1 40 PHE N N 6.875 4.018 11.010 1.00 . A A . 21 ALA N 1 1 9 2795 1 1 40 PHE O O 7.451 4.001 7.449 1.00 . A A . 21 ALA O 1 1 9 2796 1 1 41 GLN C C 9.401 6.246 7.722 1.00 . A A . 22 PHE C 1 1 9 2797 1 1 41 GLN CA C 7.984 6.626 8.099 1.00 . A A . 22 PHE CA 1 1 9 2798 1 1 41 GLN CB C 7.954 8.009 8.752 1.00 . A A . 22 PHE CB 1 1 9 2799 1 1 41 GLN CG C 7.812 9.136 7.767 1.00 . A A . 22 PHE CG 1 1 9 2800 1 1 41 GLN H H 7.371 5.808 9.943 1.00 . A A . 22 PHE H 1 1 9 2801 1 1 41 GLN HA H 7.362 6.622 7.218 1.00 . A A . 22 PHE HA 1 1 9 2802 1 1 41 GLN HB2 H 7.122 8.059 9.437 1.00 . A A . 22 PHE HB2 1 1 9 2803 1 1 41 GLN HB3 H 8.874 8.161 9.300 1.00 . A A . 22 PHE HB3 1 1 9 2804 1 1 41 GLN N N 7.494 5.605 9.007 1.00 . A A . 22 PHE N 1 1 9 2805 1 1 41 GLN O O 9.808 6.334 6.565 1.00 . A A . 22 PHE O 1 1 9 2806 1 1 42 GLU C C 11.455 3.907 7.917 1.00 . A A . 23 GLN C 1 1 9 2807 1 1 42 GLU CA C 11.483 5.299 8.550 1.00 . A A . 23 GLN CA 1 1 9 2808 1 1 42 GLU CB C 12.203 5.253 9.902 1.00 . A A . 23 GLN CB 1 1 9 2809 1 1 42 GLU CD C 14.334 6.385 9.155 1.00 . A A . 23 GLN CD 1 1 9 2810 1 1 42 GLU CG C 13.164 6.410 10.119 1.00 . A A . 23 GLN CG 1 1 9 2811 1 1 42 GLU H H 9.711 5.699 9.619 1.00 . A A . 23 GLN H 1 1 9 2812 1 1 42 GLU HA H 11.996 5.983 7.891 1.00 . A A . 23 GLN HA 1 1 9 2813 1 1 42 GLU HB2 H 11.463 5.273 10.693 1.00 . A A . 23 GLN HB2 1 1 9 2814 1 1 42 GLU HB3 H 12.762 4.331 9.969 1.00 . A A . 23 GLN HB3 1 1 9 2815 1 1 42 GLU HG2 H 12.627 7.337 9.984 1.00 . A A . 23 GLN HG2 1 1 9 2816 1 1 42 GLU HG3 H 13.546 6.360 11.128 1.00 . A A . 23 GLN HG3 1 1 9 2817 1 1 42 GLU N N 10.123 5.768 8.730 1.00 . A A . 23 GLN N 1 1 9 2818 1 1 42 GLU O O 12.410 3.487 7.264 1.00 . A A . 23 GLN O 1 1 9 2819 1 1 42 GLU OE1 O 14.763 5.321 8.707 1.00 . A A . 23 GLN OE1 1 1 9 2820 1 1 43 ARG C C 9.840 1.908 6.086 1.00 . A A . 24 GLU C 1 1 9 2821 1 1 43 ARG CA C 10.156 1.862 7.577 1.00 . A A . 24 GLU CA 1 1 9 2822 1 1 43 ARG CB C 9.035 1.131 8.319 1.00 . A A . 24 GLU CB 1 1 9 2823 1 1 43 ARG CD C 10.323 -0.129 10.088 1.00 . A A . 24 GLU CD 1 1 9 2824 1 1 43 ARG CG C 9.304 0.956 9.805 1.00 . A A . 24 GLU CG 1 1 9 2825 1 1 43 ARG H H 9.617 3.594 8.646 1.00 . A A . 24 GLU H 1 1 9 2826 1 1 43 ARG HA H 11.069 1.325 7.723 1.00 . A A . 24 GLU HA 1 1 9 2827 1 1 43 ARG HB2 H 8.119 1.688 8.200 1.00 . A A . 24 GLU HB2 1 1 9 2828 1 1 43 ARG HB3 H 8.910 0.152 7.881 1.00 . A A . 24 GLU HB3 1 1 9 2829 1 1 43 ARG HG2 H 9.676 1.889 10.203 1.00 . A A . 24 GLU HG2 1 1 9 2830 1 1 43 ARG HG3 H 8.379 0.699 10.298 1.00 . A A . 24 GLU HG3 1 1 9 2831 1 1 43 ARG N N 10.337 3.200 8.118 1.00 . A A . 24 GLU N 1 1 9 2832 1 1 43 ARG O O 10.329 1.084 5.312 1.00 . A A . 24 GLU O 1 1 9 2833 1 1 44 TYR C C 9.847 3.119 3.386 1.00 . A A . 25 ARG C 1 1 9 2834 1 1 44 TYR CA C 8.625 3.024 4.291 1.00 . A A . 25 ARG CA 1 1 9 2835 1 1 44 TYR CB C 7.744 4.262 4.115 1.00 . A A . 25 ARG CB 1 1 9 2836 1 1 44 TYR CG C 6.294 4.035 4.510 1.00 . A A . 25 ARG CG 1 1 9 2837 1 1 44 TYR CZ C 4.338 3.736 1.352 1.00 . A A . 25 ARG CZ 1 1 9 2838 1 1 44 TYR H H 8.655 3.496 6.355 1.00 . A A . 25 ARG H 1 1 9 2839 1 1 44 TYR HA H 8.063 2.151 4.014 1.00 . A A . 25 ARG HA 1 1 9 2840 1 1 44 TYR HB2 H 8.141 5.061 4.724 1.00 . A A . 25 ARG HB2 1 1 9 2841 1 1 44 TYR HB3 H 7.772 4.564 3.078 1.00 . A A . 25 ARG HB3 1 1 9 2842 1 1 44 TYR HD2 H 4.345 4.615 3.875 1.00 . A A . 25 ARG HD2 1 1 9 2843 1 1 44 TYR N N 9.015 2.872 5.690 1.00 . A A . 25 ARG N 1 1 9 2844 1 1 44 TYR O O 9.809 2.704 2.227 1.00 . A A . 25 ARG O 1 1 9 2845 1 1 45 THR C C 12.774 2.441 2.876 1.00 . A A . 26 TYR C 1 1 9 2846 1 1 45 THR CA C 12.165 3.807 3.170 1.00 . A A . 26 TYR CA 1 1 9 2847 1 1 45 THR CB C 13.163 4.674 3.941 1.00 . A A . 26 TYR CB 1 1 9 2848 1 1 45 THR H H 10.894 3.967 4.850 1.00 . A A . 26 TYR H 1 1 9 2849 1 1 45 THR HA H 11.927 4.292 2.236 1.00 . A A . 26 TYR HA 1 1 9 2850 1 1 45 THR N N 10.928 3.662 3.924 1.00 . A A . 26 TYR N 1 1 9 2851 1 1 45 THR O O 13.112 2.132 1.733 1.00 . A A . 26 TYR O 1 1 9 2852 1 1 46 ALA C C 12.486 -0.628 3.044 1.00 . A A . 27 THR C 1 1 9 2853 1 1 46 ALA CA C 13.463 0.287 3.774 1.00 . A A . 27 THR CA 1 1 9 2854 1 1 46 ALA CB C 13.800 -0.297 5.147 1.00 . A A . 27 THR CB 1 1 9 2855 1 1 46 ALA H H 12.610 1.928 4.801 1.00 . A A . 27 THR H 1 1 9 2856 1 1 46 ALA HA H 14.369 0.366 3.192 1.00 . A A . 27 THR HA 1 1 9 2857 1 1 46 ALA N N 12.903 1.625 3.916 1.00 . A A . 27 THR N 1 1 9 2858 1 1 46 ALA O O 12.893 -1.518 2.297 1.00 . A A . 27 THR O 1 1 9 2859 1 1 47 GLY C C 10.186 -1.019 1.112 1.00 . A A . 28 ALA C 1 1 9 2860 1 1 47 GLY CA C 10.159 -1.200 2.625 1.00 . A A . 28 ALA CA 1 1 9 2861 1 1 47 GLY H H 10.933 0.325 3.867 1.00 . A A . 28 ALA H 1 1 9 2862 1 1 47 GLY N N 11.195 -0.399 3.263 1.00 . A A . 28 ALA N 1 1 9 2863 1 1 47 GLY O O 9.916 -1.954 0.358 1.00 . A A . 28 ALA O 1 1 9 2864 1 1 48 ILE C C 11.750 -0.206 -1.422 1.00 . A A . 29 GLY C 1 1 9 2865 1 1 48 ILE CA C 10.577 0.476 -0.747 1.00 . A A . 29 GLY CA 1 1 9 2866 1 1 48 ILE H H 10.723 0.898 1.322 1.00 . A A . 29 GLY H 1 1 9 2867 1 1 48 ILE N N 10.517 0.192 0.674 1.00 . A A . 29 GLY N 1 1 9 2868 1 1 48 ILE O O 11.588 -0.860 -2.452 1.00 . A A . 29 GLY O 1 1 9 2869 1 1 49 ASN C C 14.020 -2.181 -1.423 1.00 . A A . 30 ILE C 1 1 9 2870 1 1 49 ASN CA C 14.140 -0.661 -1.393 1.00 . A A . 30 ILE CA 1 1 9 2871 1 1 49 ASN CB C 15.391 -0.265 -0.587 1.00 . A A . 30 ILE CB 1 1 9 2872 1 1 49 ASN H H 13.002 0.479 -0.020 1.00 . A A . 30 ILE H 1 1 9 2873 1 1 49 ASN HA H 14.260 -0.299 -2.403 1.00 . A A . 30 ILE HA 1 1 9 2874 1 1 49 ASN N N 12.936 -0.053 -0.840 1.00 . A A . 30 ILE N 1 1 9 2875 1 1 49 ASN O O 14.516 -2.835 -2.339 1.00 . A A . 30 ILE O 1 1 9 2876 1 1 50 SER C C 12.485 -4.709 -1.590 1.00 . A A . 31 ASN C 1 1 9 2877 1 1 50 SER CA C 13.161 -4.182 -0.330 1.00 . A A . 31 ASN CA 1 1 9 2878 1 1 50 SER CB C 12.323 -4.536 0.901 1.00 . A A . 31 ASN CB 1 1 9 2879 1 1 50 SER H H 12.976 -2.163 0.283 1.00 . A A . 31 ASN H 1 1 9 2880 1 1 50 SER HA H 14.134 -4.641 -0.238 1.00 . A A . 31 ASN HA 1 1 9 2881 1 1 50 SER HB2 H 12.651 -3.936 1.736 1.00 . A A . 31 ASN HB2 1 1 9 2882 1 1 50 SER HB3 H 11.285 -4.323 0.695 1.00 . A A . 31 ASN HB3 1 1 9 2883 1 1 50 SER N N 13.352 -2.737 -0.416 1.00 . A A . 31 ASN N 1 1 9 2884 1 1 50 SER O O 13.052 -5.527 -2.314 1.00 . A A . 31 ASN O 1 1 9 2885 1 1 51 PHE C C 11.309 -4.282 -4.298 1.00 . A A . 32 SER C 1 1 9 2886 1 1 51 PHE CA C 10.532 -4.638 -3.038 1.00 . A A . 32 SER CA 1 1 9 2887 1 1 51 PHE CB C 9.157 -3.969 -3.064 1.00 . A A . 32 SER CB 1 1 9 2888 1 1 51 PHE H H 10.879 -3.567 -1.245 1.00 . A A . 32 SER H 1 1 9 2889 1 1 51 PHE HA H 10.405 -5.709 -2.994 1.00 . A A . 32 SER HA 1 1 9 2890 1 1 51 PHE HB2 H 8.726 -4.074 -4.049 1.00 . A A . 32 SER HB2 1 1 9 2891 1 1 51 PHE HB3 H 8.514 -4.443 -2.337 1.00 . A A . 32 SER HB3 1 1 9 2892 1 1 51 PHE N N 11.276 -4.224 -1.855 1.00 . A A . 32 SER N 1 1 9 2893 1 1 51 PHE O O 11.267 -5.002 -5.296 1.00 . A A . 32 SER O 1 1 9 2894 1 1 52 VAL C C 13.887 -3.744 -5.721 1.00 . A A . 33 PHE C 1 1 9 2895 1 1 52 VAL CA C 12.831 -2.702 -5.361 1.00 . A A . 33 PHE CA 1 1 9 2896 1 1 52 VAL CB C 13.484 -1.355 -5.011 1.00 . A A . 33 PHE CB 1 1 9 2897 1 1 52 VAL H H 12.021 -2.641 -3.409 1.00 . A A . 33 PHE H 1 1 9 2898 1 1 52 VAL HA H 12.172 -2.566 -6.205 1.00 . A A . 33 PHE HA 1 1 9 2899 1 1 52 VAL N N 12.028 -3.165 -4.237 1.00 . A A . 33 PHE N 1 1 9 2900 1 1 52 VAL O O 13.960 -4.204 -6.862 1.00 . A A . 33 PHE O 1 1 9 2901 1 1 53 SER C C 15.169 -6.397 -5.516 1.00 . A A . 34 VAL C 1 1 9 2902 1 1 53 SER CA C 15.749 -5.109 -4.944 1.00 . A A . 34 VAL CA 1 1 9 2903 1 1 53 SER CB C 16.499 -5.418 -3.633 1.00 . A A . 34 VAL CB 1 1 9 2904 1 1 53 SER H H 14.588 -3.719 -3.848 1.00 . A A . 34 VAL H 1 1 9 2905 1 1 53 SER HA H 16.454 -4.701 -5.655 1.00 . A A . 34 VAL HA 1 1 9 2906 1 1 53 SER N N 14.700 -4.117 -4.737 1.00 . A A . 34 VAL N 1 1 9 2907 1 1 53 SER O O 15.389 -6.715 -6.677 1.00 . A A . 34 VAL O 1 1 9 2908 1 1 54 GLY C C 13.134 -8.284 -6.434 1.00 . A A . 35 SER C 1 1 9 2909 1 1 54 GLY CA C 13.855 -8.399 -5.115 1.00 . A A . 35 SER CA 1 1 9 2910 1 1 54 GLY H H 14.322 -6.864 -3.773 1.00 . A A . 35 SER H 1 1 9 2911 1 1 54 GLY N N 14.440 -7.143 -4.693 1.00 . A A . 35 SER N 1 1 9 2912 1 1 54 GLY O O 13.473 -8.994 -7.381 1.00 . A A . 35 SER O 1 1 9 2913 1 1 55 VAL C C 12.415 -7.460 -8.933 1.00 . A A . 36 GLY C 1 1 9 2914 1 1 55 VAL CA C 11.462 -7.230 -7.779 1.00 . A A . 36 GLY CA 1 1 9 2915 1 1 55 VAL H H 11.946 -6.844 -5.745 1.00 . A A . 36 GLY H 1 1 9 2916 1 1 55 VAL N N 12.165 -7.394 -6.520 1.00 . A A . 36 GLY N 1 1 9 2917 1 1 55 VAL O O 12.112 -8.181 -9.884 1.00 . A A . 36 GLY O 1 1 9 2918 1 1 56 ALA C C 15.597 -8.160 -9.454 1.00 . A A . 37 VAL C 1 1 9 2919 1 1 56 ALA CA C 14.652 -6.996 -9.781 1.00 . A A . 37 VAL CA 1 1 9 2920 1 1 56 ALA CB C 15.475 -5.697 -9.886 1.00 . A A . 37 VAL CB 1 1 9 2921 1 1 56 ALA H H 13.775 -6.334 -8.008 1.00 . A A . 37 VAL H 1 1 9 2922 1 1 56 ALA HA H 14.191 -7.179 -10.734 1.00 . A A . 37 VAL HA 1 1 9 2923 1 1 56 ALA N N 13.596 -6.860 -8.807 1.00 . A A . 37 VAL N 1 1 9 2924 1 1 56 ALA O O 15.660 -9.154 -10.178 1.00 . A A . 37 VAL O 1 1 9 2925 1 1 57 SER C C 16.814 -10.093 -7.095 1.00 . A A . 38 ALA C 1 1 9 2926 1 1 57 SER CA C 17.362 -8.953 -7.939 1.00 . A A . 38 ALA CA 1 1 9 2927 1 1 57 SER CB C 18.464 -8.239 -7.161 1.00 . A A . 38 ALA CB 1 1 9 2928 1 1 57 SER H H 16.271 -7.165 -7.856 1.00 . A A . 38 ALA H 1 1 9 2929 1 1 57 SER HA H 17.804 -9.362 -8.823 1.00 . A A . 38 ALA HA 1 1 9 2930 1 1 57 SER HB2 H 18.303 -8.374 -6.095 1.00 . A A . 38 ALA HB2 1 1 9 2931 1 1 57 SER HB3 H 18.445 -7.186 -7.396 1.00 . A A . 38 ALA HB3 1 1 9 2932 1 1 57 SER N N 16.366 -7.986 -8.374 1.00 . A A . 38 ALA N 1 1 9 2933 1 1 57 SER O O 16.730 -11.241 -7.532 1.00 . A A . 38 ALA O 1 1 9 2934 1 1 58 GLY C C 14.713 -11.360 -5.189 1.00 . A A . 39 SER C 1 1 9 2935 1 1 58 GLY CA C 16.050 -10.695 -4.847 1.00 . A A . 39 SER CA 1 1 9 2936 1 1 58 GLY H H 16.656 -8.820 -5.577 1.00 . A A . 39 SER H 1 1 9 2937 1 1 58 GLY N N 16.516 -9.751 -5.849 1.00 . A A . 39 SER N 1 1 9 2938 1 1 58 GLY O O 14.170 -12.115 -4.383 1.00 . A A . 39 SER O 1 1 9 2939 1 1 59 ALA C C 12.927 -13.192 -6.692 1.00 . A A . 40 GLY C 1 1 9 2940 1 1 59 ALA CA C 12.918 -11.679 -6.784 1.00 . A A . 40 GLY CA 1 1 9 2941 1 1 59 ALA H H 14.647 -10.482 -6.989 1.00 . A A . 40 GLY H 1 1 9 2942 1 1 59 ALA N N 14.182 -11.087 -6.380 1.00 . A A . 40 GLY N 1 1 9 2943 1 1 59 ALA O O 11.933 -13.802 -6.298 1.00 . A A . 40 GLY O 1 1 9 2944 1 1 60 GLY C C 13.107 -15.932 -7.843 1.00 . A A . 41 ALA C 1 1 9 2945 1 1 60 GLY CA C 14.188 -15.250 -7.010 1.00 . A A . 41 ALA CA 1 1 9 2946 1 1 60 GLY H H 14.810 -13.257 -7.358 1.00 . A A . 41 ALA H 1 1 9 2947 1 1 60 GLY N N 14.053 -13.799 -7.055 1.00 . A A . 41 ALA N 1 1 9 2948 1 1 60 GLY O O 12.618 -17.004 -7.485 1.00 . A A . 41 ALA O 1 1 9 2949 1 1 61 SER C C 10.330 -15.358 -9.488 1.00 . A A . 42 GLY C 1 1 9 2950 1 1 61 SER CA C 11.719 -15.867 -9.820 1.00 . A A . 42 GLY CA 1 1 9 2951 1 1 61 SER H H 13.163 -14.452 -9.190 1.00 . A A . 42 GLY H 1 1 9 2952 1 1 61 SER N N 12.738 -15.304 -8.955 1.00 . A A . 42 GLY N 1 1 9 2953 1 1 61 SER O O 9.579 -14.955 -10.377 1.00 . A A . 42 GLY O 1 1 9 2954 1 1 62 ILE C C 7.555 -15.535 -8.566 1.00 . A A . 43 SER C 1 1 9 2955 1 1 62 ILE CA C 8.682 -14.907 -7.747 1.00 . A A . 43 SER CA 1 1 9 2956 1 1 62 ILE CB C 8.610 -13.383 -7.835 1.00 . A A . 43 SER CB 1 1 9 2957 1 1 62 ILE H H 10.633 -15.701 -7.541 1.00 . A A . 43 SER H 1 1 9 2958 1 1 62 ILE HA H 8.567 -15.204 -6.716 1.00 . A A . 43 SER HA 1 1 9 2959 1 1 62 ILE N N 9.988 -15.373 -8.202 1.00 . A A . 43 SER N 1 1 9 2960 1 1 62 ILE O O 6.728 -14.831 -9.145 1.00 . A A . 43 SER O 1 1 9 2961 1 1 63 GLY C C 6.309 -17.010 -10.746 1.00 . A A . 44 ILE C 1 1 9 2962 1 1 63 GLY CA C 6.507 -17.594 -9.346 1.00 . A A . 44 ILE CA 1 1 9 2963 1 1 63 GLY H H 8.212 -17.368 -8.119 1.00 . A A . 44 ILE H 1 1 9 2964 1 1 63 GLY N N 7.529 -16.865 -8.605 1.00 . A A . 44 ILE N 1 1 9 2965 1 1 63 GLY O O 5.292 -16.378 -11.029 1.00 . A A . 44 ILE O 1 1 9 2966 1 1 64 ARG C C 6.053 -17.315 -13.746 1.00 . A A . 45 GLY C 1 1 9 2967 1 1 64 ARG CA C 7.209 -16.716 -12.970 1.00 . A A . 45 GLY CA 1 1 9 2968 1 1 64 ARG H H 8.080 -17.736 -11.332 1.00 . A A . 45 GLY H 1 1 9 2969 1 1 64 ARG N N 7.292 -17.226 -11.614 1.00 . A A . 45 GLY N 1 1 9 2970 1 1 64 ARG O O 5.494 -16.671 -14.634 1.00 . A A . 45 GLY O 1 1 10 2971 1 1 20 ASN C C -7.383 6.154 29.850 1.00 . A A . 1 VAL C 1 1 10 2972 1 1 20 ASN CA C -7.326 6.470 31.341 1.00 . A A . 1 VAL CA 1 1 10 2973 1 1 20 ASN CB C -6.206 7.498 31.592 1.00 . A A . 1 VAL CB 1 1 10 2974 1 1 20 ASN H H -6.610 4.519 31.743 1.00 . A A . 1 VAL H 1 1 10 2975 1 1 20 ASN HA H -8.264 6.912 31.642 1.00 . A A . 1 VAL HA 1 1 10 2976 1 1 20 ASN N N -7.123 5.261 32.128 1.00 . A A . 1 VAL N 1 1 10 2977 1 1 20 ASN O O -6.924 5.099 29.411 1.00 . A A . 1 VAL O 1 1 10 2978 1 1 21 TYR C C -8.323 8.234 26.950 1.00 . A A . 2 ASN C 1 1 10 2979 1 1 21 TYR CA C -8.066 6.897 27.634 1.00 . A A . 2 ASN CA 1 1 10 2980 1 1 21 TYR CB C -9.193 5.914 27.310 1.00 . A A . 2 ASN CB 1 1 10 2981 1 1 21 TYR CG C -8.673 4.598 26.764 1.00 . A A . 2 ASN CG 1 1 10 2982 1 1 21 TYR H H -8.295 7.897 29.485 1.00 . A A . 2 ASN H 1 1 10 2983 1 1 21 TYR HA H -7.131 6.494 27.273 1.00 . A A . 2 ASN HA 1 1 10 2984 1 1 21 TYR HB2 H -9.756 5.711 28.209 1.00 . A A . 2 ASN HB2 1 1 10 2985 1 1 21 TYR HB3 H -9.849 6.355 26.572 1.00 . A A . 2 ASN HB3 1 1 10 2986 1 1 21 TYR N N -7.949 7.075 29.077 1.00 . A A . 2 ASN N 1 1 10 2987 1 1 21 TYR O O -9.471 8.623 26.739 1.00 . A A . 2 ASN O 1 1 10 2988 1 1 22 GLY C C -8.107 11.218 26.857 1.00 . A A . 3 TYR C 1 1 10 2989 1 1 22 GLY CA C -7.361 10.235 25.959 1.00 . A A . 3 TYR CA 1 1 10 2990 1 1 22 GLY H H -6.357 8.578 26.811 1.00 . A A . 3 TYR H 1 1 10 2991 1 1 22 GLY N N -7.247 8.938 26.612 1.00 . A A . 3 TYR N 1 1 10 2992 1 1 22 GLY O O -7.938 11.209 28.076 1.00 . A A . 3 TYR O 1 1 10 2993 1 1 23 ASN C C -8.917 14.304 27.286 1.00 . A A . 4 GLY C 1 1 10 2994 1 1 23 ASN CA C -9.691 13.027 27.010 1.00 . A A . 4 GLY CA 1 1 10 2995 1 1 23 ASN H H -9.011 12.014 25.283 1.00 . A A . 4 GLY H 1 1 10 2996 1 1 23 ASN N N -8.929 12.054 26.252 1.00 . A A . 4 GLY N 1 1 10 2997 1 1 23 ASN O O -9.478 15.278 27.787 1.00 . A A . 4 GLY O 1 1 10 2998 1 1 24 GLY C C -5.575 15.461 26.264 1.00 . A A . 5 ASN C 1 1 10 2999 1 1 24 GLY CA C -6.784 15.473 27.187 1.00 . A A . 5 ASN CA 1 1 10 3000 1 1 24 GLY H H -7.230 13.500 26.570 1.00 . A A . 5 ASN H 1 1 10 3001 1 1 24 GLY N N -7.625 14.302 26.965 1.00 . A A . 5 ASN N 1 1 10 3002 1 1 24 GLY O O -5.209 16.483 25.683 1.00 . A A . 5 ASN O 1 1 10 3003 1 1 25 VAL C C -3.012 12.892 25.581 1.00 . A A . 6 GLY C 1 1 10 3004 1 1 25 VAL CA C -3.797 14.156 25.285 1.00 . A A . 6 GLY CA 1 1 10 3005 1 1 25 VAL H H -5.308 13.527 26.627 1.00 . A A . 6 GLY H 1 1 10 3006 1 1 25 VAL N N -4.963 14.296 26.137 1.00 . A A . 6 GLY N 1 1 10 3007 1 1 25 VAL O O -1.825 12.954 25.895 1.00 . A A . 6 GLY O 1 1 10 3008 1 1 26 SER C C -2.126 10.491 26.944 1.00 . A A . 7 VAL C 1 1 10 3009 1 1 26 SER CA C -3.056 10.447 25.728 1.00 . A A . 7 VAL CA 1 1 10 3010 1 1 26 SER CB C -2.295 9.945 24.475 1.00 . A A . 7 VAL CB 1 1 10 3011 1 1 26 SER H H -4.626 11.770 25.217 1.00 . A A . 7 VAL H 1 1 10 3012 1 1 26 SER HA H -3.849 9.743 25.936 1.00 . A A . 7 VAL HA 1 1 10 3013 1 1 26 SER N N -3.682 11.745 25.476 1.00 . A A . 7 VAL N 1 1 10 3014 1 1 26 SER O O -2.218 11.394 27.775 1.00 . A A . 7 VAL O 1 1 10 3015 1 1 27 CYS C C 1.053 8.894 27.678 1.00 . A A . 8 SER C 1 1 10 3016 1 1 27 CYS CA C -0.294 9.434 28.146 1.00 . A A . 8 SER CA 1 1 10 3017 1 1 27 CYS CB C -0.854 8.547 29.259 1.00 . A A . 8 SER CB 1 1 10 3018 1 1 27 CYS H H -1.217 8.822 26.342 1.00 . A A . 8 SER H 1 1 10 3019 1 1 27 CYS HA H -0.153 10.433 28.531 1.00 . A A . 8 SER HA 1 1 10 3020 1 1 27 CYS HB2 H -1.313 7.672 28.824 1.00 . A A . 8 SER HB2 1 1 10 3021 1 1 27 CYS HB3 H -0.049 8.244 29.914 1.00 . A A . 8 SER HB3 1 1 10 3022 1 1 27 CYS N N -1.239 9.511 27.037 1.00 . A A . 8 SER N 1 1 10 3023 1 1 27 CYS O O 1.116 7.984 26.852 1.00 . A A . 8 SER O 1 1 10 3024 1 1 28 SER C C 3.827 7.709 28.521 1.00 . A A . 9 CYS C 1 1 10 3025 1 1 28 SER CA C 3.478 9.036 27.855 1.00 . A A . 9 CYS CA 1 1 10 3026 1 1 28 SER CB C 4.495 10.107 28.259 1.00 . A A . 9 CYS CB 1 1 10 3027 1 1 28 SER H H 2.014 10.181 28.869 1.00 . A A . 9 CYS H 1 1 10 3028 1 1 28 SER HA H 3.511 8.907 26.782 1.00 . A A . 9 CYS HA 1 1 10 3029 1 1 28 SER HB2 H 4.030 10.790 28.955 1.00 . A A . 9 CYS HB2 1 1 10 3030 1 1 28 SER HB3 H 5.338 9.632 28.739 1.00 . A A . 9 CYS HB3 1 1 10 3031 1 1 28 SER N N 2.130 9.460 28.214 1.00 . A A . 9 CYS N 1 1 10 3032 1 1 28 SER O O 3.719 7.569 29.740 1.00 . A A . 9 CYS O 1 1 10 3033 1 1 29 LYS C C 5.609 4.728 27.316 1.00 . A A . 10 SER C 1 1 10 3034 1 1 29 LYS CA C 4.614 5.424 28.237 1.00 . A A . 10 SER CA 1 1 10 3035 1 1 29 LYS CB C 3.374 4.550 28.413 1.00 . A A . 10 SER CB 1 1 10 3036 1 1 29 LYS H H 4.316 6.908 26.754 1.00 . A A . 10 SER H 1 1 10 3037 1 1 29 LYS HA H 5.079 5.570 29.201 1.00 . A A . 10 SER HA 1 1 10 3038 1 1 29 LYS HB2 H 2.906 4.397 27.453 1.00 . A A . 10 SER HB2 1 1 10 3039 1 1 29 LYS HB3 H 3.668 3.598 28.827 1.00 . A A . 10 SER HB3 1 1 10 3040 1 1 29 LYS N N 4.248 6.737 27.717 1.00 . A A . 10 SER N 1 1 10 3041 1 1 29 LYS O O 5.272 4.333 26.199 1.00 . A A . 10 SER O 1 1 10 3042 1 1 30 THR C C 8.202 4.635 25.724 1.00 . A A . 11 LYS C 1 1 10 3043 1 1 30 THR CA C 7.895 3.917 27.038 1.00 . A A . 11 LYS CA 1 1 10 3044 1 1 30 THR CB C 7.502 2.471 26.765 1.00 . A A . 11 LYS CB 1 1 10 3045 1 1 30 THR H H 7.033 4.897 28.698 1.00 . A A . 11 LYS H 1 1 10 3046 1 1 30 THR HA H 8.784 3.925 27.643 1.00 . A A . 11 LYS HA 1 1 10 3047 1 1 30 THR N N 6.837 4.573 27.799 1.00 . A A . 11 LYS N 1 1 10 3048 1 1 30 THR O O 9.057 4.194 24.957 1.00 . A A . 11 LYS O 1 1 10 3049 1 1 31 LYS C C 7.367 7.964 24.460 1.00 . A A . 12 THR C 1 1 10 3050 1 1 31 LYS CA C 7.716 6.493 24.244 1.00 . A A . 12 THR CA 1 1 10 3051 1 1 31 LYS CB C 6.886 5.877 23.113 1.00 . A A . 12 THR CB 1 1 10 3052 1 1 31 LYS H H 6.845 6.049 26.099 1.00 . A A . 12 THR H 1 1 10 3053 1 1 31 LYS HA H 8.758 6.420 23.991 1.00 . A A . 12 THR HA 1 1 10 3054 1 1 31 LYS N N 7.507 5.735 25.462 1.00 . A A . 12 THR N 1 1 10 3055 1 1 31 LYS O O 6.683 8.314 25.422 1.00 . A A . 12 THR O 1 1 10 3056 1 1 32 CYS C C 6.054 10.507 23.658 1.00 . A A . 13 LYS C 1 1 10 3057 1 1 32 CYS CA C 7.558 10.250 23.652 1.00 . A A . 13 LYS CA 1 1 10 3058 1 1 32 CYS CB C 8.213 10.996 22.488 1.00 . A A . 13 LYS CB 1 1 10 3059 1 1 32 CYS H H 8.369 8.484 22.808 1.00 . A A . 13 LYS H 1 1 10 3060 1 1 32 CYS HA H 7.977 10.608 24.580 1.00 . A A . 13 LYS HA 1 1 10 3061 1 1 32 CYS HB2 H 8.353 10.309 21.667 1.00 . A A . 13 LYS HB2 1 1 10 3062 1 1 32 CYS HB3 H 7.558 11.794 22.170 1.00 . A A . 13 LYS HB3 1 1 10 3063 1 1 32 CYS N N 7.833 8.821 23.556 1.00 . A A . 13 LYS N 1 1 10 3064 1 1 32 CYS O O 5.260 9.603 23.398 1.00 . A A . 13 LYS O 1 1 10 3065 1 1 33 SER C C 3.767 12.544 22.619 1.00 . A A . 14 CYS C 1 1 10 3066 1 1 33 SER CA C 4.256 12.108 23.997 1.00 . A A . 14 CYS CA 1 1 10 3067 1 1 33 SER CB C 4.026 13.226 25.015 1.00 . A A . 14 CYS CB 1 1 10 3068 1 1 33 SER H H 6.343 12.422 24.156 1.00 . A A . 14 CYS H 1 1 10 3069 1 1 33 SER HA H 3.697 11.234 24.303 1.00 . A A . 14 CYS HA 1 1 10 3070 1 1 33 SER HB2 H 4.868 13.901 24.993 1.00 . A A . 14 CYS HB2 1 1 10 3071 1 1 33 SER HB3 H 3.130 13.767 24.747 1.00 . A A . 14 CYS HB3 1 1 10 3072 1 1 33 SER N N 5.666 11.742 23.957 1.00 . A A . 14 CYS N 1 1 10 3073 1 1 33 SER O O 3.200 13.626 22.462 1.00 . A A . 14 CYS O 1 1 10 3074 1 1 34 VAL C C 3.532 10.723 19.409 1.00 . A A . 15 SER C 1 1 10 3075 1 1 34 VAL CA C 3.573 11.992 20.256 1.00 . A A . 15 SER CA 1 1 10 3076 1 1 34 VAL CB C 4.520 13.012 19.622 1.00 . A A . 15 SER CB 1 1 10 3077 1 1 34 VAL H H 4.446 10.848 21.808 1.00 . A A . 15 SER H 1 1 10 3078 1 1 34 VAL HA H 2.580 12.414 20.298 1.00 . A A . 15 SER HA 1 1 10 3079 1 1 34 VAL N N 3.990 11.695 21.621 1.00 . A A . 15 SER N 1 1 10 3080 1 1 34 VAL O O 4.023 9.673 19.823 1.00 . A A . 15 SER O 1 1 10 3081 1 1 35 ASN C C 4.160 9.446 16.590 1.00 . A A . 16 VAL C 1 1 10 3082 1 1 35 ASN CA C 2.841 9.694 17.313 1.00 . A A . 16 VAL CA 1 1 10 3083 1 1 35 ASN CB C 1.728 9.910 16.269 1.00 . A A . 16 VAL CB 1 1 10 3084 1 1 35 ASN H H 2.574 11.695 17.948 1.00 . A A . 16 VAL H 1 1 10 3085 1 1 35 ASN HA H 2.592 8.820 17.899 1.00 . A A . 16 VAL HA 1 1 10 3086 1 1 35 ASN N N 2.945 10.830 18.221 1.00 . A A . 16 VAL N 1 1 10 3087 1 1 35 ASN O O 5.017 10.328 16.521 1.00 . A A . 16 VAL O 1 1 10 3088 1 1 36 TRP C C 5.434 8.269 13.860 1.00 . A A . 17 ASN C 1 1 10 3089 1 1 36 TRP CA C 5.536 7.877 15.332 1.00 . A A . 17 ASN CA 1 1 10 3090 1 1 36 TRP CB C 5.797 6.375 15.458 1.00 . A A . 17 ASN CB 1 1 10 3091 1 1 36 TRP CG C 4.612 5.542 15.009 1.00 . A A . 17 ASN CG 1 1 10 3092 1 1 36 TRP H H 3.602 7.580 16.139 1.00 . A A . 17 ASN H 1 1 10 3093 1 1 36 TRP HA H 6.359 8.415 15.780 1.00 . A A . 17 ASN HA 1 1 10 3094 1 1 36 TRP HB2 H 6.649 6.111 14.850 1.00 . A A . 17 ASN HB2 1 1 10 3095 1 1 36 TRP HB3 H 6.010 6.138 16.491 1.00 . A A . 17 ASN HB3 1 1 10 3096 1 1 36 TRP N N 4.320 8.240 16.052 1.00 . A A . 17 ASN N 1 1 10 3097 1 1 36 TRP O O 5.632 7.442 12.970 1.00 . A A . 17 ASN O 1 1 10 3098 1 1 37 GLY C C 6.350 10.159 11.561 1.00 . A A . 18 TRP C 1 1 10 3099 1 1 37 GLY CA C 4.990 10.045 12.253 1.00 . A A . 18 TRP CA 1 1 10 3100 1 1 37 GLY H H 4.975 10.146 14.363 1.00 . A A . 18 TRP H 1 1 10 3101 1 1 37 GLY N N 5.123 9.537 13.613 1.00 . A A . 18 TRP N 1 1 10 3102 1 1 37 GLY O O 6.421 10.429 10.363 1.00 . A A . 18 TRP O 1 1 10 3103 1 1 38 GLN C C 9.468 8.703 11.736 1.00 . A A . 19 GLY C 1 1 10 3104 1 1 38 GLN CA C 8.760 10.042 11.749 1.00 . A A . 19 GLY CA 1 1 10 3105 1 1 38 GLN H H 7.316 9.742 13.267 1.00 . A A . 19 GLY H 1 1 10 3106 1 1 38 GLN N N 7.426 9.955 12.318 1.00 . A A . 19 GLY N 1 1 10 3107 1 1 38 GLN O O 9.999 8.279 10.706 1.00 . A A . 19 GLY O 1 1 10 3108 1 1 39 ALA C C 9.574 5.779 11.930 1.00 . A A . 20 GLN C 1 1 10 3109 1 1 39 ALA CA C 10.115 6.726 12.988 1.00 . A A . 20 GLN CA 1 1 10 3110 1 1 39 ALA CB C 9.903 6.136 14.384 1.00 . A A . 20 GLN CB 1 1 10 3111 1 1 39 ALA H H 9.028 8.411 13.665 1.00 . A A . 20 GLN H 1 1 10 3112 1 1 39 ALA HA H 11.175 6.863 12.818 1.00 . A A . 20 GLN HA 1 1 10 3113 1 1 39 ALA HB2 H 8.844 6.118 14.597 1.00 . A A . 20 GLN HB2 1 1 10 3114 1 1 39 ALA HB3 H 10.281 5.125 14.396 1.00 . A A . 20 GLN HB3 1 1 10 3115 1 1 39 ALA N N 9.471 8.028 12.880 1.00 . A A . 20 GLN N 1 1 10 3116 1 1 39 ALA O O 10.305 5.366 11.029 1.00 . A A . 20 GLN O 1 1 10 3117 1 1 40 PHE C C 7.660 5.164 9.661 1.00 . A A . 21 ALA C 1 1 10 3118 1 1 40 PHE CA C 7.691 4.550 11.044 1.00 . A A . 21 ALA CA 1 1 10 3119 1 1 40 PHE CB C 6.319 4.074 11.468 1.00 . A A . 21 ALA CB 1 1 10 3120 1 1 40 PHE H H 7.744 5.801 12.754 1.00 . A A . 21 ALA H 1 1 10 3121 1 1 40 PHE HA H 8.330 3.711 10.990 1.00 . A A . 21 ALA HA 1 1 10 3122 1 1 40 PHE HB2 H 5.568 4.562 10.867 1.00 . A A . 21 ALA HB2 1 1 10 3123 1 1 40 PHE HB3 H 6.161 4.307 12.509 1.00 . A A . 21 ALA HB3 1 1 10 3124 1 1 40 PHE N N 8.290 5.441 12.025 1.00 . A A . 21 ALA N 1 1 10 3125 1 1 40 PHE O O 7.344 4.503 8.673 1.00 . A A . 21 ALA O 1 1 10 3126 1 1 41 GLN C C 9.287 6.524 7.559 1.00 . A A . 22 PHE C 1 1 10 3127 1 1 41 GLN CA C 8.127 7.119 8.333 1.00 . A A . 22 PHE CA 1 1 10 3128 1 1 41 GLN CB C 8.339 8.618 8.551 1.00 . A A . 22 PHE CB 1 1 10 3129 1 1 41 GLN CG C 7.828 9.468 7.424 1.00 . A A . 22 PHE CG 1 1 10 3130 1 1 41 GLN H H 8.321 6.846 10.412 1.00 . A A . 22 PHE H 1 1 10 3131 1 1 41 GLN HA H 7.210 6.951 7.791 1.00 . A A . 22 PHE HA 1 1 10 3132 1 1 41 GLN HB2 H 7.828 8.921 9.454 1.00 . A A . 22 PHE HB2 1 1 10 3133 1 1 41 GLN HB3 H 9.396 8.813 8.660 1.00 . A A . 22 PHE HB3 1 1 10 3134 1 1 41 GLN N N 8.044 6.412 9.597 1.00 . A A . 22 PHE N 1 1 10 3135 1 1 41 GLN O O 9.236 6.361 6.339 1.00 . A A . 22 PHE O 1 1 10 3136 1 1 42 GLU C C 11.230 4.041 7.531 1.00 . A A . 23 GLN C 1 1 10 3137 1 1 42 GLU CA C 11.502 5.531 7.759 1.00 . A A . 23 GLN CA 1 1 10 3138 1 1 42 GLU CB C 12.688 5.723 8.712 1.00 . A A . 23 GLN CB 1 1 10 3139 1 1 42 GLU CD C 15.195 5.459 8.893 1.00 . A A . 23 GLN CD 1 1 10 3140 1 1 42 GLU CG C 13.899 4.866 8.375 1.00 . A A . 23 GLN CG 1 1 10 3141 1 1 42 GLU H H 10.271 6.301 9.284 1.00 . A A . 23 GLN H 1 1 10 3142 1 1 42 GLU HA H 11.724 6.000 6.812 1.00 . A A . 23 GLN HA 1 1 10 3143 1 1 42 GLU HB2 H 12.992 6.759 8.683 1.00 . A A . 23 GLN HB2 1 1 10 3144 1 1 42 GLU HB3 H 12.371 5.482 9.719 1.00 . A A . 23 GLN HB3 1 1 10 3145 1 1 42 GLU HG2 H 13.766 3.889 8.817 1.00 . A A . 23 GLN HG2 1 1 10 3146 1 1 42 GLU HG3 H 13.967 4.768 7.302 1.00 . A A . 23 GLN HG3 1 1 10 3147 1 1 42 GLU N N 10.320 6.161 8.312 1.00 . A A . 23 GLN N 1 1 10 3148 1 1 42 GLU O O 11.902 3.393 6.728 1.00 . A A . 23 GLN O 1 1 10 3149 1 1 42 GLU OE1 O 15.713 6.427 8.336 1.00 . A A . 23 GLN OE1 1 1 10 3150 1 1 43 ARG C C 9.289 1.814 6.734 1.00 . A A . 24 GLU C 1 1 10 3151 1 1 43 ARG CA C 9.867 2.100 8.119 1.00 . A A . 24 GLU CA 1 1 10 3152 1 1 43 ARG CB C 8.874 1.692 9.219 1.00 . A A . 24 GLU CB 1 1 10 3153 1 1 43 ARG CD C 6.862 0.426 8.361 1.00 . A A . 24 GLU CD 1 1 10 3154 1 1 43 ARG CG C 7.406 1.764 8.819 1.00 . A A . 24 GLU CG 1 1 10 3155 1 1 43 ARG H H 9.732 4.072 8.866 1.00 . A A . 24 GLU H 1 1 10 3156 1 1 43 ARG HA H 10.762 1.525 8.243 1.00 . A A . 24 GLU HA 1 1 10 3157 1 1 43 ARG HB2 H 9.088 0.676 9.514 1.00 . A A . 24 GLU HB2 1 1 10 3158 1 1 43 ARG HB3 H 9.024 2.336 10.069 1.00 . A A . 24 GLU HB3 1 1 10 3159 1 1 43 ARG HG2 H 6.830 2.094 9.671 1.00 . A A . 24 GLU HG2 1 1 10 3160 1 1 43 ARG HG3 H 7.296 2.475 8.017 1.00 . A A . 24 GLU HG3 1 1 10 3161 1 1 43 ARG N N 10.232 3.506 8.245 1.00 . A A . 24 GLU N 1 1 10 3162 1 1 43 ARG O O 9.499 0.742 6.168 1.00 . A A . 24 GLU O 1 1 10 3163 1 1 44 TYR C C 8.983 2.695 3.784 1.00 . A A . 25 ARG C 1 1 10 3164 1 1 44 TYR CA C 7.938 2.652 4.890 1.00 . A A . 25 ARG CA 1 1 10 3165 1 1 44 TYR CB C 6.900 3.757 4.680 1.00 . A A . 25 ARG CB 1 1 10 3166 1 1 44 TYR CG C 5.520 3.401 5.208 1.00 . A A . 25 ARG CG 1 1 10 3167 1 1 44 TYR CZ C 1.957 4.054 4.368 1.00 . A A . 25 ARG CZ 1 1 10 3168 1 1 44 TYR H H 8.422 3.613 6.707 1.00 . A A . 25 ARG H 1 1 10 3169 1 1 44 TYR HA H 7.445 1.699 4.861 1.00 . A A . 25 ARG HA 1 1 10 3170 1 1 44 TYR HB2 H 7.235 4.652 5.187 1.00 . A A . 25 ARG HB2 1 1 10 3171 1 1 44 TYR HB3 H 6.817 3.961 3.624 1.00 . A A . 25 ARG HB3 1 1 10 3172 1 1 44 TYR HD2 H 4.645 5.111 4.288 1.00 . A A . 25 ARG HD2 1 1 10 3173 1 1 44 TYR N N 8.556 2.786 6.202 1.00 . A A . 25 ARG N 1 1 10 3174 1 1 44 TYR O O 8.815 2.083 2.730 1.00 . A A . 25 ARG O 1 1 10 3175 1 1 45 THR C C 11.838 2.209 2.856 1.00 . A A . 26 TYR C 1 1 10 3176 1 1 45 THR CA C 11.140 3.549 3.065 1.00 . A A . 26 TYR CA 1 1 10 3177 1 1 45 THR CB C 12.150 4.604 3.526 1.00 . A A . 26 TYR CB 1 1 10 3178 1 1 45 THR H H 10.133 3.882 4.893 1.00 . A A . 26 TYR H 1 1 10 3179 1 1 45 THR HA H 10.706 3.865 2.129 1.00 . A A . 26 TYR HA 1 1 10 3180 1 1 45 THR N N 10.062 3.422 4.035 1.00 . A A . 26 TYR N 1 1 10 3181 1 1 45 THR O O 12.055 1.779 1.723 1.00 . A A . 26 TYR O 1 1 10 3182 1 1 46 ALA C C 11.941 -0.802 3.306 1.00 . A A . 27 THR C 1 1 10 3183 1 1 46 ALA CA C 12.858 0.261 3.901 1.00 . A A . 27 THR CA 1 1 10 3184 1 1 46 ALA CB C 13.310 -0.164 5.299 1.00 . A A . 27 THR CB 1 1 10 3185 1 1 46 ALA H H 11.984 1.948 4.832 1.00 . A A . 27 THR H 1 1 10 3186 1 1 46 ALA HA H 13.725 0.367 3.268 1.00 . A A . 27 THR HA 1 1 10 3187 1 1 46 ALA N N 12.185 1.554 3.959 1.00 . A A . 27 THR N 1 1 10 3188 1 1 46 ALA O O 12.397 -1.710 2.610 1.00 . A A . 27 THR O 1 1 10 3189 1 1 47 GLY C C 9.586 -1.583 1.556 1.00 . A A . 28 ALA C 1 1 10 3190 1 1 47 GLY CA C 9.668 -1.637 3.076 1.00 . A A . 28 ALA CA 1 1 10 3191 1 1 47 GLY H H 10.343 0.058 4.145 1.00 . A A . 28 ALA H 1 1 10 3192 1 1 47 GLY N N 10.647 -0.686 3.584 1.00 . A A . 28 ALA N 1 1 10 3193 1 1 47 GLY O O 9.312 -2.590 0.903 1.00 . A A . 28 ALA O 1 1 10 3194 1 1 48 ILE C C 10.983 -0.814 -1.143 1.00 . A A . 29 GLY C 1 1 10 3195 1 1 48 ILE CA C 9.767 -0.237 -0.444 1.00 . A A . 29 GLY CA 1 1 10 3196 1 1 48 ILE H H 10.033 0.368 1.567 1.00 . A A . 29 GLY H 1 1 10 3197 1 1 48 ILE N N 9.821 -0.400 0.997 1.00 . A A . 29 GLY N 1 1 10 3198 1 1 48 ILE O O 10.868 -1.397 -2.222 1.00 . A A . 29 GLY O 1 1 10 3199 1 1 49 ASN C C 13.324 -2.678 -1.295 1.00 . A A . 30 ILE C 1 1 10 3200 1 1 49 ASN CA C 13.391 -1.165 -1.098 1.00 . A A . 30 ILE CA 1 1 10 3201 1 1 49 ASN CB C 14.603 -0.823 -0.209 1.00 . A A . 30 ILE CB 1 1 10 3202 1 1 49 ASN H H 12.178 -0.182 0.332 1.00 . A A . 30 ILE H 1 1 10 3203 1 1 49 ASN HA H 13.532 -0.694 -2.060 1.00 . A A . 30 ILE HA 1 1 10 3204 1 1 49 ASN N N 12.150 -0.654 -0.527 1.00 . A A . 30 ILE N 1 1 10 3205 1 1 49 ASN O O 13.957 -3.223 -2.198 1.00 . A A . 30 ILE O 1 1 10 3206 1 1 50 SER C C 11.940 -5.219 -1.920 1.00 . A A . 31 ASN C 1 1 10 3207 1 1 50 SER CA C 12.403 -4.799 -0.529 1.00 . A A . 31 ASN CA 1 1 10 3208 1 1 50 SER CB C 11.408 -5.292 0.523 1.00 . A A . 31 ASN CB 1 1 10 3209 1 1 50 SER H H 12.072 -2.859 0.254 1.00 . A A . 31 ASN H 1 1 10 3210 1 1 50 SER HA H 13.368 -5.243 -0.335 1.00 . A A . 31 ASN HA 1 1 10 3211 1 1 50 SER HB2 H 11.553 -4.734 1.436 1.00 . A A . 31 ASN HB2 1 1 10 3212 1 1 50 SER HB3 H 10.403 -5.129 0.163 1.00 . A A . 31 ASN HB3 1 1 10 3213 1 1 50 SER N N 12.553 -3.349 -0.445 1.00 . A A . 31 ASN N 1 1 10 3214 1 1 50 SER O O 12.592 -6.025 -2.584 1.00 . A A . 31 ASN O 1 1 10 3215 1 1 51 PHE C C 11.254 -4.585 -4.768 1.00 . A A . 32 SER C 1 1 10 3216 1 1 51 PHE CA C 10.270 -4.979 -3.672 1.00 . A A . 32 SER CA 1 1 10 3217 1 1 51 PHE CB C 8.935 -4.259 -3.879 1.00 . A A . 32 SER CB 1 1 10 3218 1 1 51 PHE H H 10.342 -4.027 -1.784 1.00 . A A . 32 SER H 1 1 10 3219 1 1 51 PHE HA H 10.106 -6.045 -3.716 1.00 . A A . 32 SER HA 1 1 10 3220 1 1 51 PHE HB2 H 8.801 -3.525 -3.098 1.00 . A A . 32 SER HB2 1 1 10 3221 1 1 51 PHE HB3 H 8.938 -3.766 -4.840 1.00 . A A . 32 SER HB3 1 1 10 3222 1 1 51 PHE N N 10.815 -4.665 -2.357 1.00 . A A . 32 SER N 1 1 10 3223 1 1 51 PHE O O 11.347 -5.248 -5.801 1.00 . A A . 32 SER O 1 1 10 3224 1 1 52 VAL C C 14.091 -4.031 -5.685 1.00 . A A . 33 PHE C 1 1 10 3225 1 1 52 VAL CA C 12.967 -3.017 -5.497 1.00 . A A . 33 PHE CA 1 1 10 3226 1 1 52 VAL CB C 13.542 -1.676 -5.038 1.00 . A A . 33 PHE CB 1 1 10 3227 1 1 52 VAL H H 11.868 -3.018 -3.691 1.00 . A A . 33 PHE H 1 1 10 3228 1 1 52 VAL HA H 12.461 -2.878 -6.439 1.00 . A A . 33 PHE HA 1 1 10 3229 1 1 52 VAL N N 11.988 -3.502 -4.533 1.00 . A A . 33 PHE N 1 1 10 3230 1 1 52 VAL O O 14.562 -4.253 -6.803 1.00 . A A . 33 PHE O 1 1 10 3231 1 1 53 SER C C 15.266 -6.743 -5.628 1.00 . A A . 34 VAL C 1 1 10 3232 1 1 53 SER CA C 15.588 -5.635 -4.631 1.00 . A A . 34 VAL CA 1 1 10 3233 1 1 53 SER CB C 15.845 -6.253 -3.240 1.00 . A A . 34 VAL CB 1 1 10 3234 1 1 53 SER H H 14.105 -4.428 -3.725 1.00 . A A . 34 VAL H 1 1 10 3235 1 1 53 SER HA H 16.490 -5.134 -4.954 1.00 . A A . 34 VAL HA 1 1 10 3236 1 1 53 SER N N 14.518 -4.646 -4.586 1.00 . A A . 34 VAL N 1 1 10 3237 1 1 53 SER O O 15.859 -6.807 -6.697 1.00 . A A . 34 VAL O 1 1 10 3238 1 1 54 GLY C C 13.707 -8.306 -7.544 1.00 . A A . 35 SER C 1 1 10 3239 1 1 54 GLY CA C 13.968 -8.734 -6.122 1.00 . A A . 35 SER CA 1 1 10 3240 1 1 54 GLY H H 13.923 -7.552 -4.396 1.00 . A A . 35 SER H 1 1 10 3241 1 1 54 GLY N N 14.339 -7.623 -5.268 1.00 . A A . 35 SER N 1 1 10 3242 1 1 54 GLY O O 14.356 -8.804 -8.462 1.00 . A A . 35 SER O 1 1 10 3243 1 1 55 VAL C C 13.800 -6.932 -9.899 1.00 . A A . 36 GLY C 1 1 10 3244 1 1 55 VAL CA C 12.520 -6.921 -9.089 1.00 . A A . 36 GLY CA 1 1 10 3245 1 1 55 VAL H H 12.311 -7.005 -6.975 1.00 . A A . 36 GLY H 1 1 10 3246 1 1 55 VAL N N 12.787 -7.381 -7.739 1.00 . A A . 36 GLY N 1 1 10 3247 1 1 55 VAL O O 13.841 -7.414 -11.032 1.00 . A A . 36 GLY O 1 1 10 3248 1 1 56 ALA C C 16.999 -7.637 -9.511 1.00 . A A . 37 VAL C 1 1 10 3249 1 1 56 ALA CA C 16.174 -6.390 -9.858 1.00 . A A . 37 VAL CA 1 1 10 3250 1 1 56 ALA CB C 16.946 -5.135 -9.401 1.00 . A A . 37 VAL CB 1 1 10 3251 1 1 56 ALA H H 14.754 -6.097 -8.361 1.00 . A A . 37 VAL H 1 1 10 3252 1 1 56 ALA HA H 16.052 -6.338 -10.925 1.00 . A A . 37 VAL HA 1 1 10 3253 1 1 56 ALA N N 14.858 -6.427 -9.271 1.00 . A A . 37 VAL N 1 1 10 3254 1 1 56 ALA O O 17.316 -8.454 -10.376 1.00 . A A . 37 VAL O 1 1 10 3255 1 1 57 SER C C 17.458 -10.081 -7.367 1.00 . A A . 38 ALA C 1 1 10 3256 1 1 57 SER CA C 18.214 -8.811 -7.727 1.00 . A A . 38 ALA CA 1 1 10 3257 1 1 57 SER CB C 18.993 -8.330 -6.508 1.00 . A A . 38 ALA CB 1 1 10 3258 1 1 57 SER H H 17.104 -7.037 -7.606 1.00 . A A . 38 ALA H 1 1 10 3259 1 1 57 SER HA H 18.925 -9.040 -8.494 1.00 . A A . 38 ALA HA 1 1 10 3260 1 1 57 SER HB2 H 18.506 -8.682 -5.602 1.00 . A A . 38 ALA HB2 1 1 10 3261 1 1 57 SER HB3 H 19.023 -7.251 -6.503 1.00 . A A . 38 ALA HB3 1 1 10 3262 1 1 57 SER N N 17.382 -7.730 -8.233 1.00 . A A . 38 ALA N 1 1 10 3263 1 1 57 SER O O 17.549 -11.105 -8.046 1.00 . A A . 38 ALA O 1 1 10 3264 1 1 58 GLY C C 14.896 -11.634 -6.544 1.00 . A A . 39 SER C 1 1 10 3265 1 1 58 GLY CA C 16.038 -11.117 -5.662 1.00 . A A . 39 SER CA 1 1 10 3266 1 1 58 GLY H H 16.791 -9.157 -5.739 1.00 . A A . 39 SER H 1 1 10 3267 1 1 58 GLY N N 16.771 -10.001 -6.237 1.00 . A A . 39 SER N 1 1 10 3268 1 1 58 GLY O O 14.155 -12.530 -6.139 1.00 . A A . 39 SER O 1 1 10 3269 1 1 59 ALA C C 14.029 -11.254 -10.097 1.00 . A A . 40 GLY C 1 1 10 3270 1 1 59 ALA CA C 13.697 -11.512 -8.641 1.00 . A A . 40 GLY CA 1 1 10 3271 1 1 59 ALA H H 15.362 -10.367 -8.025 1.00 . A A . 40 GLY H 1 1 10 3272 1 1 59 ALA N N 14.753 -11.077 -7.744 1.00 . A A . 40 GLY N 1 1 10 3273 1 1 59 ALA O O 13.197 -10.747 -10.851 1.00 . A A . 40 GLY O 1 1 10 3274 1 1 60 GLY C C 14.837 -12.210 -12.843 1.00 . A A . 41 ALA C 1 1 10 3275 1 1 60 GLY CA C 15.689 -11.404 -11.870 1.00 . A A . 41 ALA CA 1 1 10 3276 1 1 60 GLY H H 15.868 -12.000 -9.848 1.00 . A A . 41 ALA H 1 1 10 3277 1 1 60 GLY N N 15.249 -11.602 -10.496 1.00 . A A . 41 ALA N 1 1 10 3278 1 1 60 GLY O O 13.850 -11.711 -13.382 1.00 . A A . 41 ALA O 1 1 10 3279 1 1 61 SER C C 15.324 -15.491 -14.455 1.00 . A A . 42 GLY C 1 1 10 3280 1 1 61 SER CA C 14.492 -14.320 -13.970 1.00 . A A . 42 GLY CA 1 1 10 3281 1 1 61 SER H H 16.019 -13.794 -12.602 1.00 . A A . 42 GLY H 1 1 10 3282 1 1 61 SER N N 15.226 -13.457 -13.062 1.00 . A A . 42 GLY N 1 1 10 3283 1 1 61 SER O O 15.472 -15.701 -15.658 1.00 . A A . 42 GLY O 1 1 10 3284 1 1 62 ILE C C 17.757 -17.067 -14.879 1.00 . A A . 43 SER C 1 1 10 3285 1 1 62 ILE CA C 16.691 -17.417 -13.843 1.00 . A A . 43 SER CA 1 1 10 3286 1 1 62 ILE CB C 15.808 -18.553 -14.358 1.00 . A A . 43 SER CB 1 1 10 3287 1 1 62 ILE H H 15.712 -16.040 -12.572 1.00 . A A . 43 SER H 1 1 10 3288 1 1 62 ILE HA H 17.182 -17.741 -12.938 1.00 . A A . 43 SER HA 1 1 10 3289 1 1 62 ILE N N 15.870 -16.257 -13.513 1.00 . A A . 43 SER N 1 1 10 3290 1 1 62 ILE O O 18.196 -17.925 -15.646 1.00 . A A . 43 SER O 1 1 10 3291 1 1 63 GLY C C 20.525 -15.173 -15.144 1.00 . A A . 44 ILE C 1 1 10 3292 1 1 63 GLY CA C 19.176 -15.339 -15.833 1.00 . A A . 44 ILE CA 1 1 10 3293 1 1 63 GLY H H 17.786 -15.166 -14.268 1.00 . A A . 44 ILE H 1 1 10 3294 1 1 63 GLY N N 18.168 -15.804 -14.898 1.00 . A A . 44 ILE N 1 1 10 3295 1 1 63 GLY O O 21.283 -14.252 -15.446 1.00 . A A . 44 ILE O 1 1 10 3296 1 1 64 ARG C C 22.598 -17.395 -13.133 1.00 . A A . 45 GLY C 1 1 10 3297 1 1 64 ARG CA C 22.073 -16.018 -13.492 1.00 . A A . 45 GLY CA 1 1 10 3298 1 1 64 ARG H H 20.171 -16.784 -14.022 1.00 . A A . 45 GLY H 1 1 10 3299 1 1 64 ARG N N 20.816 -16.075 -14.217 1.00 . A A . 45 GLY N 1 1 10 3300 1 1 64 ARG O O 23.156 -17.590 -12.053 1.00 . A A . 45 GLY O 1 1 11 3301 1 1 20 ASN C C -10.749 9.096 1.039 1.00 . A A . 1 VAL C 1 1 11 3302 1 1 20 ASN CA C -11.529 7.786 1.137 1.00 . A A . 1 VAL CA 1 1 11 3303 1 1 20 ASN CB C -11.413 7.240 2.573 1.00 . A A . 1 VAL CB 1 1 11 3304 1 1 20 ASN H H -10.904 5.884 0.446 1.00 . A A . 1 VAL H 1 1 11 3305 1 1 20 ASN HA H -12.572 7.985 0.935 1.00 . A A . 1 VAL HA 1 1 11 3306 1 1 20 ASN N N -11.060 6.807 0.159 1.00 . A A . 1 VAL N 1 1 11 3307 1 1 20 ASN O O -9.643 9.132 0.501 1.00 . A A . 1 VAL O 1 1 11 3308 1 1 21 TYR C C -10.762 12.137 2.912 1.00 . A A . 2 ASN C 1 1 11 3309 1 1 21 TYR CA C -10.698 11.479 1.538 1.00 . A A . 2 ASN CA 1 1 11 3310 1 1 21 TYR CB C -11.371 12.376 0.497 1.00 . A A . 2 ASN CB 1 1 11 3311 1 1 21 TYR CG C -10.405 13.366 -0.123 1.00 . A A . 2 ASN CG 1 1 11 3312 1 1 21 TYR H H -12.216 10.075 1.980 1.00 . A A . 2 ASN H 1 1 11 3313 1 1 21 TYR HA H -9.663 11.339 1.266 1.00 . A A . 2 ASN HA 1 1 11 3314 1 1 21 TYR HB2 H -11.779 11.760 -0.290 1.00 . A A . 2 ASN HB2 1 1 11 3315 1 1 21 TYR HB3 H -12.170 12.928 0.969 1.00 . A A . 2 ASN HB3 1 1 11 3316 1 1 21 TYR N N -11.335 10.168 1.564 1.00 . A A . 2 ASN N 1 1 11 3317 1 1 21 TYR O O -11.557 13.048 3.140 1.00 . A A . 2 ASN O 1 1 11 3318 1 1 22 GLY C C -11.191 11.943 5.910 1.00 . A A . 3 TYR C 1 1 11 3319 1 1 22 GLY CA C -9.875 12.196 5.183 1.00 . A A . 3 TYR CA 1 1 11 3320 1 1 22 GLY H H -9.317 10.931 3.579 1.00 . A A . 3 TYR H 1 1 11 3321 1 1 22 GLY N N -9.920 11.662 3.824 1.00 . A A . 3 TYR N 1 1 11 3322 1 1 22 GLY O O -11.972 12.866 6.143 1.00 . A A . 3 TYR O 1 1 11 3323 1 1 23 ASN C C -12.598 8.930 7.545 1.00 . A A . 4 GLY C 1 1 11 3324 1 1 23 ASN CA C -12.651 10.329 6.964 1.00 . A A . 4 GLY CA 1 1 11 3325 1 1 23 ASN H H -10.771 9.992 6.053 1.00 . A A . 4 GLY H 1 1 11 3326 1 1 23 ASN N N -11.430 10.685 6.265 1.00 . A A . 4 GLY N 1 1 11 3327 1 1 23 ASN O O -13.623 8.256 7.653 1.00 . A A . 4 GLY O 1 1 11 3328 1 1 24 GLY C C -11.275 7.211 10.021 1.00 . A A . 5 ASN C 1 1 11 3329 1 1 24 GLY CA C -11.217 7.165 8.497 1.00 . A A . 5 ASN CA 1 1 11 3330 1 1 24 GLY H H -10.623 9.078 7.811 1.00 . A A . 5 ASN H 1 1 11 3331 1 1 24 GLY N N -11.401 8.493 7.922 1.00 . A A . 5 ASN N 1 1 11 3332 1 1 24 GLY O O -11.531 6.200 10.673 1.00 . A A . 5 ASN O 1 1 11 3333 1 1 25 VAL C C -9.683 8.689 12.624 1.00 . A A . 6 GLY C 1 1 11 3334 1 1 25 VAL CA C -11.069 8.546 12.024 1.00 . A A . 6 GLY CA 1 1 11 3335 1 1 25 VAL H H -10.840 9.163 10.013 1.00 . A A . 6 GLY H 1 1 11 3336 1 1 25 VAL N N -11.037 8.392 10.582 1.00 . A A . 6 GLY N 1 1 11 3337 1 1 25 VAL O O -8.976 7.699 12.811 1.00 . A A . 6 GLY O 1 1 11 3338 1 1 26 SER C C -8.079 10.410 15.008 1.00 . A A . 7 VAL C 1 1 11 3339 1 1 26 SER CA C -7.982 10.193 13.510 1.00 . A A . 7 VAL CA 1 1 11 3340 1 1 26 SER CB C -7.379 11.450 12.906 1.00 . A A . 7 VAL CB 1 1 11 3341 1 1 26 SER H H -9.904 10.673 12.755 1.00 . A A . 7 VAL H 1 1 11 3342 1 1 26 SER HA H -7.344 9.358 13.313 1.00 . A A . 7 VAL HA 1 1 11 3343 1 1 26 SER N N -9.295 9.925 12.926 1.00 . A A . 7 VAL N 1 1 11 3344 1 1 26 SER O O -7.181 10.965 15.642 1.00 . A A . 7 VAL O 1 1 11 3345 1 1 27 CYS C C -8.797 8.940 17.749 1.00 . A A . 8 SER C 1 1 11 3346 1 1 27 CYS CA C -9.451 10.080 16.975 1.00 . A A . 8 SER CA 1 1 11 3347 1 1 27 CYS CB C -10.960 10.082 17.226 1.00 . A A . 8 SER CB 1 1 11 3348 1 1 27 CYS H H -9.824 9.549 14.961 1.00 . A A . 8 SER H 1 1 11 3349 1 1 27 CYS HA H -9.037 11.016 17.317 1.00 . A A . 8 SER HA 1 1 11 3350 1 1 27 CYS HB2 H -11.471 10.428 16.339 1.00 . A A . 8 SER HB2 1 1 11 3351 1 1 27 CYS HB3 H -11.285 9.078 17.459 1.00 . A A . 8 SER HB3 1 1 11 3352 1 1 27 CYS N N -9.176 9.963 15.548 1.00 . A A . 8 SER N 1 1 11 3353 1 1 27 CYS O O -8.578 7.855 17.210 1.00 . A A . 8 SER O 1 1 11 3354 1 1 28 SER C C -8.734 6.947 19.983 1.00 . A A . 9 CYS C 1 1 11 3355 1 1 28 SER CA C -7.856 8.189 19.865 1.00 . A A . 9 CYS CA 1 1 11 3356 1 1 28 SER CB C -7.579 8.764 21.255 1.00 . A A . 9 CYS CB 1 1 11 3357 1 1 28 SER H H -8.684 10.078 19.390 1.00 . A A . 9 CYS H 1 1 11 3358 1 1 28 SER HA H -6.917 7.910 19.407 1.00 . A A . 9 CYS HA 1 1 11 3359 1 1 28 SER HB2 H -8.207 9.629 21.409 1.00 . A A . 9 CYS HB2 1 1 11 3360 1 1 28 SER HB3 H -7.813 8.017 21.999 1.00 . A A . 9 CYS HB3 1 1 11 3361 1 1 28 SER N N -8.486 9.195 19.016 1.00 . A A . 9 CYS N 1 1 11 3362 1 1 28 SER O O -9.892 7.031 20.391 1.00 . A A . 9 CYS O 1 1 11 3363 1 1 29 LYS C C -7.956 3.365 19.915 1.00 . A A . 10 SER C 1 1 11 3364 1 1 29 LYS CA C -8.906 4.536 19.699 1.00 . A A . 10 SER CA 1 1 11 3365 1 1 29 LYS CB C -9.722 4.314 18.428 1.00 . A A . 10 SER CB 1 1 11 3366 1 1 29 LYS H H -7.245 5.795 19.314 1.00 . A A . 10 SER H 1 1 11 3367 1 1 29 LYS HA H -9.579 4.595 20.542 1.00 . A A . 10 SER HA 1 1 11 3368 1 1 29 LYS HB2 H -9.068 3.972 17.640 1.00 . A A . 10 SER HB2 1 1 11 3369 1 1 29 LYS HB3 H -10.476 3.566 18.620 1.00 . A A . 10 SER HB3 1 1 11 3370 1 1 29 LYS N N -8.173 5.797 19.627 1.00 . A A . 10 SER N 1 1 11 3371 1 1 29 LYS O O -7.187 3.001 19.025 1.00 . A A . 10 SER O 1 1 11 3372 1 1 30 THR C C -5.686 1.976 21.375 1.00 . A A . 11 LYS C 1 1 11 3373 1 1 30 THR CA C -7.176 1.642 21.456 1.00 . A A . 11 LYS CA 1 1 11 3374 1 1 30 THR CB C -7.498 0.469 20.540 1.00 . A A . 11 LYS CB 1 1 11 3375 1 1 30 THR H H -8.661 3.112 21.760 1.00 . A A . 11 LYS H 1 1 11 3376 1 1 30 THR HA H -7.407 1.363 22.468 1.00 . A A . 11 LYS HA 1 1 11 3377 1 1 30 THR N N -8.020 2.778 21.105 1.00 . A A . 11 LYS N 1 1 11 3378 1 1 30 THR O O -4.839 1.115 21.615 1.00 . A A . 11 LYS O 1 1 11 3379 1 1 31 LYS C C -3.868 5.144 21.211 1.00 . A A . 12 THR C 1 1 11 3380 1 1 31 LYS CA C -3.986 3.648 20.929 1.00 . A A . 12 THR CA 1 1 11 3381 1 1 31 LYS CB C -3.452 3.291 19.538 1.00 . A A . 12 THR CB 1 1 11 3382 1 1 31 LYS H H -6.071 3.863 20.862 1.00 . A A . 12 THR H 1 1 11 3383 1 1 31 LYS HA H -3.420 3.112 21.670 1.00 . A A . 12 THR HA 1 1 11 3384 1 1 31 LYS N N -5.367 3.219 21.037 1.00 . A A . 12 THR N 1 1 11 3385 1 1 31 LYS O O -4.864 5.868 21.185 1.00 . A A . 12 THR O 1 1 11 3386 1 1 32 CYS C C -2.900 7.875 20.577 1.00 . A A . 13 LYS C 1 1 11 3387 1 1 32 CYS CA C -2.416 7.019 21.744 1.00 . A A . 13 LYS CA 1 1 11 3388 1 1 32 CYS CB C -0.930 7.274 22.002 1.00 . A A . 13 LYS CB 1 1 11 3389 1 1 32 CYS H H -1.891 4.985 21.473 1.00 . A A . 13 LYS H 1 1 11 3390 1 1 32 CYS HA H -2.978 7.283 22.627 1.00 . A A . 13 LYS HA 1 1 11 3391 1 1 32 CYS HB2 H -0.352 6.530 21.474 1.00 . A A . 13 LYS HB2 1 1 11 3392 1 1 32 CYS HB3 H -0.673 8.252 21.624 1.00 . A A . 13 LYS HB3 1 1 11 3393 1 1 32 CYS N N -2.650 5.605 21.470 1.00 . A A . 13 LYS N 1 1 11 3394 1 1 32 CYS O O -3.330 7.350 19.549 1.00 . A A . 13 LYS O 1 1 11 3395 1 1 33 SER C C -2.081 10.568 18.840 1.00 . A A . 14 CYS C 1 1 11 3396 1 1 33 SER CA C -3.264 10.107 19.689 1.00 . A A . 14 CYS CA 1 1 11 3397 1 1 33 SER CB C -3.965 11.323 20.299 1.00 . A A . 14 CYS CB 1 1 11 3398 1 1 33 SER H H -2.478 9.554 21.577 1.00 . A A . 14 CYS H 1 1 11 3399 1 1 33 SER HA H -3.964 9.579 19.057 1.00 . A A . 14 CYS HA 1 1 11 3400 1 1 33 SER HB2 H -3.506 11.555 21.248 1.00 . A A . 14 CYS HB2 1 1 11 3401 1 1 33 SER HB3 H -3.849 12.166 19.634 1.00 . A A . 14 CYS HB3 1 1 11 3402 1 1 33 SER N N -2.830 9.191 20.737 1.00 . A A . 14 CYS N 1 1 11 3403 1 1 33 SER O O -2.118 11.643 18.241 1.00 . A A . 14 CYS O 1 1 11 3404 1 1 34 VAL C C 0.584 8.900 17.148 1.00 . A A . 15 SER C 1 1 11 3405 1 1 34 VAL CA C 0.157 10.080 18.016 1.00 . A A . 15 SER CA 1 1 11 3406 1 1 34 VAL CB C 1.302 10.487 18.945 1.00 . A A . 15 SER CB 1 1 11 3407 1 1 34 VAL H H -1.060 8.907 19.289 1.00 . A A . 15 SER H 1 1 11 3408 1 1 34 VAL HA H -0.087 10.913 17.374 1.00 . A A . 15 SER HA 1 1 11 3409 1 1 34 VAL N N -1.033 9.751 18.792 1.00 . A A . 15 SER N 1 1 11 3410 1 1 34 VAL O O 1.084 7.895 17.652 1.00 . A A . 15 SER O 1 1 11 3411 1 1 35 ASN C C 2.259 7.823 14.809 1.00 . A A . 16 VAL C 1 1 11 3412 1 1 35 ASN CA C 0.744 7.980 14.900 1.00 . A A . 16 VAL CA 1 1 11 3413 1 1 35 ASN CB C 0.183 8.270 13.493 1.00 . A A . 16 VAL CB 1 1 11 3414 1 1 35 ASN H H -0.022 9.858 15.503 1.00 . A A . 16 VAL H 1 1 11 3415 1 1 35 ASN HA H 0.315 7.053 15.253 1.00 . A A . 16 VAL HA 1 1 11 3416 1 1 35 ASN N N 0.382 9.032 15.842 1.00 . A A . 16 VAL N 1 1 11 3417 1 1 35 ASN O O 3.009 8.704 15.228 1.00 . A A . 16 VAL O 1 1 11 3418 1 1 36 TRP C C 4.658 7.047 12.821 1.00 . A A . 17 ASN C 1 1 11 3419 1 1 36 TRP CA C 4.127 6.424 14.108 1.00 . A A . 17 ASN CA 1 1 11 3420 1 1 36 TRP CB C 4.383 4.915 14.107 1.00 . A A . 17 ASN CB 1 1 11 3421 1 1 36 TRP CG C 4.181 4.294 15.476 1.00 . A A . 17 ASN CG 1 1 11 3422 1 1 36 TRP H H 2.056 6.035 13.941 1.00 . A A . 17 ASN H 1 1 11 3423 1 1 36 TRP HA H 4.640 6.869 14.948 1.00 . A A . 17 ASN HA 1 1 11 3424 1 1 36 TRP HB2 H 3.704 4.441 13.415 1.00 . A A . 17 ASN HB2 1 1 11 3425 1 1 36 TRP HB3 H 5.400 4.729 13.793 1.00 . A A . 17 ASN HB3 1 1 11 3426 1 1 36 TRP N N 2.702 6.696 14.257 1.00 . A A . 17 ASN N 1 1 11 3427 1 1 36 TRP O O 5.238 6.363 11.976 1.00 . A A . 17 ASN O 1 1 11 3428 1 1 37 GLY C C 6.421 9.136 11.404 1.00 . A A . 18 TRP C 1 1 11 3429 1 1 37 GLY CA C 4.894 9.078 11.494 1.00 . A A . 18 TRP CA 1 1 11 3430 1 1 37 GLY H H 3.973 8.835 13.382 1.00 . A A . 18 TRP H 1 1 11 3431 1 1 37 GLY N N 4.447 8.351 12.677 1.00 . A A . 18 TRP N 1 1 11 3432 1 1 37 GLY O O 6.967 9.584 10.398 1.00 . A A . 18 TRP O 1 1 11 3433 1 1 38 GLN C C 9.148 7.309 12.285 1.00 . A A . 19 GLY C 1 1 11 3434 1 1 38 GLN CA C 8.559 8.698 12.451 1.00 . A A . 19 GLY CA 1 1 11 3435 1 1 38 GLN H H 6.625 8.338 13.233 1.00 . A A . 19 GLY H 1 1 11 3436 1 1 38 GLN N N 7.106 8.684 12.454 1.00 . A A . 19 GLY N 1 1 11 3437 1 1 38 GLN O O 9.875 7.039 11.323 1.00 . A A . 19 GLY O 1 1 11 3438 1 1 39 ALA C C 8.983 4.415 11.827 1.00 . A A . 20 GLN C 1 1 11 3439 1 1 39 ALA CA C 9.334 5.053 13.162 1.00 . A A . 20 GLN CA 1 1 11 3440 1 1 39 ALA CB C 8.764 4.221 14.313 1.00 . A A . 20 GLN CB 1 1 11 3441 1 1 39 ALA H H 8.248 6.686 13.959 1.00 . A A . 20 GLN H 1 1 11 3442 1 1 39 ALA HA H 10.411 5.091 13.251 1.00 . A A . 20 GLN HA 1 1 11 3443 1 1 39 ALA HB2 H 8.388 4.890 15.074 1.00 . A A . 20 GLN HB2 1 1 11 3444 1 1 39 ALA HB3 H 7.948 3.620 13.940 1.00 . A A . 20 GLN HB3 1 1 11 3445 1 1 39 ALA N N 8.833 6.419 13.219 1.00 . A A . 20 GLN N 1 1 11 3446 1 1 39 ALA O O 9.870 4.058 11.053 1.00 . A A . 20 GLN O 1 1 11 3447 1 1 40 PHE C C 7.657 4.537 9.094 1.00 . A A . 21 ALA C 1 1 11 3448 1 1 40 PHE CA C 7.264 3.686 10.285 1.00 . A A . 21 ALA CA 1 1 11 3449 1 1 40 PHE CB C 5.782 3.370 10.273 1.00 . A A . 21 ALA CB 1 1 11 3450 1 1 40 PHE H H 7.014 4.583 12.192 1.00 . A A . 21 ALA H 1 1 11 3451 1 1 40 PHE HA H 7.799 2.777 10.199 1.00 . A A . 21 ALA HA 1 1 11 3452 1 1 40 PHE HB2 H 5.236 4.215 9.883 1.00 . A A . 21 ALA HB2 1 1 11 3453 1 1 40 PHE HB3 H 5.451 3.153 11.276 1.00 . A A . 21 ALA HB3 1 1 11 3454 1 1 40 PHE N N 7.687 4.276 11.547 1.00 . A A . 21 ALA N 1 1 11 3455 1 1 40 PHE O O 7.480 4.142 7.941 1.00 . A A . 21 ALA O 1 1 11 3456 1 1 41 GLN C C 9.940 5.898 7.730 1.00 . A A . 22 PHE C 1 1 11 3457 1 1 41 GLN CA C 8.727 6.562 8.343 1.00 . A A . 22 PHE CA 1 1 11 3458 1 1 41 GLN CB C 9.100 7.933 8.906 1.00 . A A . 22 PHE CB 1 1 11 3459 1 1 41 GLN CG C 9.062 9.032 7.883 1.00 . A A . 22 PHE CG 1 1 11 3460 1 1 41 GLN H H 8.386 5.893 10.310 1.00 . A A . 22 PHE H 1 1 11 3461 1 1 41 GLN HA H 7.956 6.666 7.596 1.00 . A A . 22 PHE HA 1 1 11 3462 1 1 41 GLN HB2 H 8.412 8.188 9.696 1.00 . A A . 22 PHE HB2 1 1 11 3463 1 1 41 GLN HB3 H 10.101 7.888 9.308 1.00 . A A . 22 PHE HB3 1 1 11 3464 1 1 41 GLN N N 8.241 5.675 9.381 1.00 . A A . 22 PHE N 1 1 11 3465 1 1 41 GLN O O 10.097 5.832 6.511 1.00 . A A . 22 PHE O 1 1 11 3466 1 1 42 GLU C C 11.531 3.284 7.607 1.00 . A A . 23 GLN C 1 1 11 3467 1 1 42 GLU CA C 11.953 4.624 8.212 1.00 . A A . 23 GLN CA 1 1 11 3468 1 1 42 GLU CB C 12.867 4.399 9.420 1.00 . A A . 23 GLN CB 1 1 11 3469 1 1 42 GLU CD C 15.367 4.463 9.059 1.00 . A A . 23 GLN CD 1 1 11 3470 1 1 42 GLU CG C 14.122 5.258 9.401 1.00 . A A . 23 GLN CG 1 1 11 3471 1 1 42 GLU H H 10.551 5.422 9.573 1.00 . A A . 23 GLN H 1 1 11 3472 1 1 42 GLU HA H 12.475 5.204 7.466 1.00 . A A . 23 GLN HA 1 1 11 3473 1 1 42 GLU HB2 H 12.315 4.624 10.324 1.00 . A A . 23 GLN HB2 1 1 11 3474 1 1 42 GLU HB3 H 13.167 3.362 9.442 1.00 . A A . 23 GLN HB3 1 1 11 3475 1 1 42 GLU HG2 H 13.997 6.038 8.665 1.00 . A A . 23 GLN HG2 1 1 11 3476 1 1 42 GLU HG3 H 14.251 5.702 10.377 1.00 . A A . 23 GLN HG3 1 1 11 3477 1 1 42 GLU N N 10.768 5.356 8.616 1.00 . A A . 23 GLN N 1 1 11 3478 1 1 42 GLU O O 12.261 2.684 6.819 1.00 . A A . 23 GLN O 1 1 11 3479 1 1 42 GLU OE1 O 16.424 4.655 9.662 1.00 . A A . 23 GLN OE1 1 1 11 3480 1 1 43 ARG C C 9.425 1.680 6.015 1.00 . A A . 24 GLU C 1 1 11 3481 1 1 43 ARG CA C 9.783 1.574 7.493 1.00 . A A . 24 GLU CA 1 1 11 3482 1 1 43 ARG CB C 8.544 1.178 8.298 1.00 . A A . 24 GLU CB 1 1 11 3483 1 1 43 ARG CD C 7.631 0.136 10.411 1.00 . A A . 24 GLU CD 1 1 11 3484 1 1 43 ARG CG C 8.867 0.617 9.674 1.00 . A A . 24 GLU CG 1 1 11 3485 1 1 43 ARG H H 9.800 3.359 8.614 1.00 . A A . 24 GLU H 1 1 11 3486 1 1 43 ARG HA H 10.532 0.816 7.620 1.00 . A A . 24 GLU HA 1 1 11 3487 1 1 43 ARG HB2 H 7.918 2.047 8.424 1.00 . A A . 24 GLU HB2 1 1 11 3488 1 1 43 ARG HB3 H 7.997 0.428 7.747 1.00 . A A . 24 GLU HB3 1 1 11 3489 1 1 43 ARG HG2 H 9.546 -0.214 9.560 1.00 . A A . 24 GLU HG2 1 1 11 3490 1 1 43 ARG HG3 H 9.340 1.390 10.261 1.00 . A A . 24 GLU HG3 1 1 11 3491 1 1 43 ARG N N 10.331 2.829 7.986 1.00 . A A . 24 GLU N 1 1 11 3492 1 1 43 ARG O O 9.864 0.871 5.198 1.00 . A A . 24 GLU O 1 1 11 3493 1 1 44 TYR C C 9.391 3.059 3.376 1.00 . A A . 25 ARG C 1 1 11 3494 1 1 44 TYR CA C 8.192 2.901 4.301 1.00 . A A . 25 ARG CA 1 1 11 3495 1 1 44 TYR CB C 7.295 4.136 4.211 1.00 . A A . 25 ARG CB 1 1 11 3496 1 1 44 TYR CG C 5.881 3.900 4.713 1.00 . A A . 25 ARG CG 1 1 11 3497 1 1 44 TYR CZ C 3.945 3.406 1.571 1.00 . A A . 25 ARG CZ 1 1 11 3498 1 1 44 TYR H H 8.300 3.293 6.379 1.00 . A A . 25 ARG H 1 1 11 3499 1 1 44 TYR HA H 7.633 2.037 3.992 1.00 . A A . 25 ARG HA 1 1 11 3500 1 1 44 TYR HB2 H 7.734 4.930 4.797 1.00 . A A . 25 ARG HB2 1 1 11 3501 1 1 44 TYR HB3 H 7.239 4.452 3.178 1.00 . A A . 25 ARG HB3 1 1 11 3502 1 1 44 TYR HD2 H 5.602 2.136 3.553 1.00 . A A . 25 ARG HD2 1 1 11 3503 1 1 44 TYR N N 8.618 2.684 5.680 1.00 . A A . 25 ARG N 1 1 11 3504 1 1 44 TYR O O 9.335 2.703 2.200 1.00 . A A . 25 ARG O 1 1 11 3505 1 1 45 THR C C 12.280 2.460 2.708 1.00 . A A . 26 TYR C 1 1 11 3506 1 1 45 THR CA C 11.694 3.797 3.148 1.00 . A A . 26 TYR CA 1 1 11 3507 1 1 45 THR CB C 12.724 4.572 3.973 1.00 . A A . 26 TYR CB 1 1 11 3508 1 1 45 THR H H 10.455 3.851 4.861 1.00 . A A . 26 TYR H 1 1 11 3509 1 1 45 THR HA H 11.440 4.372 2.273 1.00 . A A . 26 TYR HA 1 1 11 3510 1 1 45 THR N N 10.476 3.593 3.919 1.00 . A A . 26 TYR N 1 1 11 3511 1 1 45 THR O O 12.572 2.256 1.530 1.00 . A A . 26 TYR O 1 1 11 3512 1 1 46 ALA C C 11.957 -0.627 2.644 1.00 . A A . 27 THR C 1 1 11 3513 1 1 46 ALA CA C 12.985 0.230 3.376 1.00 . A A . 27 THR CA 1 1 11 3514 1 1 46 ALA CB C 13.413 -0.461 4.672 1.00 . A A . 27 THR CB 1 1 11 3515 1 1 46 ALA H H 12.185 1.773 4.583 1.00 . A A . 27 THR H 1 1 11 3516 1 1 46 ALA HA H 13.849 0.356 2.742 1.00 . A A . 27 THR HA 1 1 11 3517 1 1 46 ALA N N 12.442 1.551 3.663 1.00 . A A . 27 THR N 1 1 11 3518 1 1 46 ALA O O 12.311 -1.473 1.822 1.00 . A A . 27 THR O 1 1 11 3519 1 1 47 GLY C C 9.595 -0.934 0.810 1.00 . A A . 28 ALA C 1 1 11 3520 1 1 47 GLY CA C 9.602 -1.146 2.319 1.00 . A A . 28 ALA CA 1 1 11 3521 1 1 47 GLY H H 10.466 0.289 3.611 1.00 . A A . 28 ALA H 1 1 11 3522 1 1 47 GLY N N 10.684 -0.399 2.948 1.00 . A A . 28 ALA N 1 1 11 3523 1 1 47 GLY O O 9.470 -1.886 0.040 1.00 . A A . 28 ALA O 1 1 11 3524 1 1 48 ILE C C 10.945 0.042 -1.732 1.00 . A A . 29 GLY C 1 1 11 3525 1 1 48 ILE CA C 9.743 0.633 -1.024 1.00 . A A . 29 GLY CA 1 1 11 3526 1 1 48 ILE H H 9.832 1.039 1.051 1.00 . A A . 29 GLY H 1 1 11 3527 1 1 48 ILE N N 9.733 0.320 0.392 1.00 . A A . 29 GLY N 1 1 11 3528 1 1 48 ILE O O 10.803 -0.661 -2.732 1.00 . A A . 29 GLY O 1 1 11 3529 1 1 49 ASN C C 13.403 -1.712 -1.729 1.00 . A A . 30 ILE C 1 1 11 3530 1 1 49 ASN CA C 13.367 -0.187 -1.784 1.00 . A A . 30 ILE CA 1 1 11 3531 1 1 49 ASN CB C 14.600 0.380 -1.054 1.00 . A A . 30 ILE CB 1 1 11 3532 1 1 49 ASN H H 12.178 0.886 -0.404 1.00 . A A . 30 ILE H 1 1 11 3533 1 1 49 ASN HA H 13.406 0.129 -2.816 1.00 . A A . 30 ILE HA 1 1 11 3534 1 1 49 ASN N N 12.132 0.324 -1.206 1.00 . A A . 30 ILE N 1 1 11 3535 1 1 49 ASN O O 14.014 -2.359 -2.580 1.00 . A A . 30 ILE O 1 1 11 3536 1 1 50 SER C C 12.177 -4.401 -1.829 1.00 . A A . 31 ASN C 1 1 11 3537 1 1 50 SER CA C 12.688 -3.728 -0.559 1.00 . A A . 31 ASN CA 1 1 11 3538 1 1 50 SER CB C 11.792 -4.094 0.626 1.00 . A A . 31 ASN CB 1 1 11 3539 1 1 50 SER H H 12.270 -1.708 -0.084 1.00 . A A . 31 ASN H 1 1 11 3540 1 1 50 SER HA H 13.692 -4.075 -0.361 1.00 . A A . 31 ASN HA 1 1 11 3541 1 1 50 SER HB2 H 11.229 -3.223 0.928 1.00 . A A . 31 ASN HB2 1 1 11 3542 1 1 50 SER HB3 H 11.106 -4.874 0.327 1.00 . A A . 31 ASN HB3 1 1 11 3543 1 1 50 SER N N 12.740 -2.278 -0.726 1.00 . A A . 31 ASN N 1 1 11 3544 1 1 50 SER O O 12.914 -5.124 -2.498 1.00 . A A . 31 ASN O 1 1 11 3545 1 1 51 PHE C C 11.132 -4.366 -4.591 1.00 . A A . 32 SER C 1 1 11 3546 1 1 51 PHE CA C 10.311 -4.726 -3.358 1.00 . A A . 32 SER CA 1 1 11 3547 1 1 51 PHE CB C 8.873 -4.234 -3.523 1.00 . A A . 32 SER CB 1 1 11 3548 1 1 51 PHE H H 10.376 -3.560 -1.592 1.00 . A A . 32 SER H 1 1 11 3549 1 1 51 PHE HA H 10.307 -5.800 -3.244 1.00 . A A . 32 SER HA 1 1 11 3550 1 1 51 PHE HB2 H 8.404 -4.167 -2.553 1.00 . A A . 32 SER HB2 1 1 11 3551 1 1 51 PHE HB3 H 8.880 -3.258 -3.987 1.00 . A A . 32 SER HB3 1 1 11 3552 1 1 51 PHE N N 10.913 -4.150 -2.160 1.00 . A A . 32 SER N 1 1 11 3553 1 1 51 PHE O O 11.216 -5.138 -5.547 1.00 . A A . 32 SER O 1 1 11 3554 1 1 52 VAL C C 13.782 -3.626 -5.837 1.00 . A A . 33 PHE C 1 1 11 3555 1 1 52 VAL CA C 12.568 -2.714 -5.656 1.00 . A A . 33 PHE CA 1 1 11 3556 1 1 52 VAL CB C 13.004 -1.264 -5.397 1.00 . A A . 33 PHE CB 1 1 11 3557 1 1 52 VAL H H 11.641 -2.621 -3.762 1.00 . A A . 33 PHE H 1 1 11 3558 1 1 52 VAL HA H 11.971 -2.748 -6.554 1.00 . A A . 33 PHE HA 1 1 11 3559 1 1 52 VAL N N 11.743 -3.186 -4.554 1.00 . A A . 33 PHE N 1 1 11 3560 1 1 52 VAL O O 13.966 -4.234 -6.893 1.00 . A A . 33 PHE O 1 1 11 3561 1 1 53 SER C C 15.425 -5.992 -5.219 1.00 . A A . 34 VAL C 1 1 11 3562 1 1 53 SER CA C 15.790 -4.566 -4.834 1.00 . A A . 34 VAL CA 1 1 11 3563 1 1 53 SER CB C 16.526 -4.580 -3.479 1.00 . A A . 34 VAL CB 1 1 11 3564 1 1 53 SER H H 14.399 -3.222 -3.976 1.00 . A A . 34 VAL H 1 1 11 3565 1 1 53 SER HA H 16.459 -4.163 -5.583 1.00 . A A . 34 VAL HA 1 1 11 3566 1 1 53 SER N N 14.602 -3.723 -4.792 1.00 . A A . 34 VAL N 1 1 11 3567 1 1 53 SER O O 15.776 -6.455 -6.297 1.00 . A A . 34 VAL O 1 1 11 3568 1 1 54 GLY C C 13.718 -8.244 -5.935 1.00 . A A . 35 SER C 1 1 11 3569 1 1 54 GLY CA C 14.338 -8.061 -4.575 1.00 . A A . 35 SER CA 1 1 11 3570 1 1 54 GLY H H 14.499 -6.288 -3.478 1.00 . A A . 35 SER H 1 1 11 3571 1 1 54 GLY N N 14.727 -6.690 -4.330 1.00 . A A . 35 SER N 1 1 11 3572 1 1 54 GLY O O 14.205 -9.049 -6.727 1.00 . A A . 35 SER O 1 1 11 3573 1 1 55 VAL C C 13.121 -7.915 -8.571 1.00 . A A . 36 GLY C 1 1 11 3574 1 1 55 VAL CA C 12.058 -7.617 -7.536 1.00 . A A . 36 GLY CA 1 1 11 3575 1 1 55 VAL H H 12.335 -6.861 -5.569 1.00 . A A . 36 GLY H 1 1 11 3576 1 1 55 VAL N N 12.671 -7.497 -6.227 1.00 . A A . 36 GLY N 1 1 11 3577 1 1 55 VAL O O 12.979 -8.814 -9.399 1.00 . A A . 36 GLY O 1 1 11 3578 1 1 56 ALA C C 16.390 -8.300 -8.765 1.00 . A A . 37 VAL C 1 1 11 3579 1 1 56 ALA CA C 15.354 -7.331 -9.345 1.00 . A A . 37 VAL CA 1 1 11 3580 1 1 56 ALA CB C 16.035 -5.976 -9.630 1.00 . A A . 37 VAL CB 1 1 11 3581 1 1 56 ALA H H 14.270 -6.493 -7.770 1.00 . A A . 37 VAL H 1 1 11 3582 1 1 56 ALA HA H 14.994 -7.727 -10.274 1.00 . A A . 37 VAL HA 1 1 11 3583 1 1 56 ALA N N 14.215 -7.163 -8.476 1.00 . A A . 37 VAL N 1 1 11 3584 1 1 56 ALA O O 16.617 -9.386 -9.298 1.00 . A A . 37 VAL O 1 1 11 3585 1 1 57 SER C C 17.611 -9.655 -6.045 1.00 . A A . 38 ALA C 1 1 11 3586 1 1 57 SER CA C 18.104 -8.613 -7.037 1.00 . A A . 38 ALA CA 1 1 11 3587 1 1 57 SER CB C 19.061 -7.658 -6.332 1.00 . A A . 38 ALA CB 1 1 11 3588 1 1 57 SER H H 16.826 -6.978 -7.329 1.00 . A A . 38 ALA H 1 1 11 3589 1 1 57 SER HA H 18.654 -9.109 -7.810 1.00 . A A . 38 ALA HA 1 1 11 3590 1 1 57 SER HB2 H 18.840 -7.640 -5.268 1.00 . A A . 38 ALA HB2 1 1 11 3591 1 1 57 SER HB3 H 18.942 -6.666 -6.740 1.00 . A A . 38 ALA HB3 1 1 11 3592 1 1 57 SER N N 17.049 -7.856 -7.690 1.00 . A A . 38 ALA N 1 1 11 3593 1 1 57 SER O O 17.681 -10.860 -6.283 1.00 . A A . 38 ALA O 1 1 11 3594 1 1 58 GLY C C 15.464 -10.785 -4.077 1.00 . A A . 39 SER C 1 1 11 3595 1 1 58 GLY CA C 16.730 -9.968 -3.784 1.00 . A A . 39 SER CA 1 1 11 3596 1 1 58 GLY H H 17.198 -8.178 -4.782 1.00 . A A . 39 SER H 1 1 11 3597 1 1 58 GLY N N 17.177 -9.150 -4.899 1.00 . A A . 39 SER N 1 1 11 3598 1 1 58 GLY O O 14.856 -11.336 -3.159 1.00 . A A . 39 SER O 1 1 11 3599 1 1 59 ALA C C 14.218 -13.046 -6.132 1.00 . A A . 40 GLY C 1 1 11 3600 1 1 59 ALA CA C 13.889 -11.630 -5.707 1.00 . A A . 40 GLY CA 1 1 11 3601 1 1 59 ALA H H 15.586 -10.418 -6.046 1.00 . A A . 40 GLY H 1 1 11 3602 1 1 59 ALA N N 15.072 -10.868 -5.348 1.00 . A A . 40 GLY N 1 1 11 3603 1 1 59 ALA O O 13.475 -13.662 -6.897 1.00 . A A . 40 GLY O 1 1 11 3604 1 1 60 GLY C C 16.925 -15.350 -5.069 1.00 . A A . 41 ALA C 1 1 11 3605 1 1 60 GLY CA C 15.765 -14.915 -5.958 1.00 . A A . 41 ALA CA 1 1 11 3606 1 1 60 GLY H H 15.881 -13.023 -5.028 1.00 . A A . 41 ALA H 1 1 11 3607 1 1 60 GLY N N 15.335 -13.564 -5.632 1.00 . A A . 41 ALA N 1 1 11 3608 1 1 60 GLY O O 17.810 -16.088 -5.502 1.00 . A A . 41 ALA O 1 1 11 3609 1 1 61 SER C C 17.798 -16.628 -2.299 1.00 . A A . 42 GLY C 1 1 11 3610 1 1 61 SER CA C 17.969 -15.239 -2.890 1.00 . A A . 42 GLY CA 1 1 11 3611 1 1 61 SER H H 16.182 -14.303 -3.533 1.00 . A A . 42 GLY H 1 1 11 3612 1 1 61 SER N N 16.913 -14.888 -3.823 1.00 . A A . 42 GLY N 1 1 11 3613 1 1 61 SER O O 18.630 -17.078 -1.512 1.00 . A A . 42 GLY O 1 1 11 3614 1 1 62 ILE C C 16.767 -19.704 -3.240 1.00 . A A . 43 SER C 1 1 11 3615 1 1 62 ILE CA C 16.453 -18.654 -2.178 1.00 . A A . 43 SER CA 1 1 11 3616 1 1 62 ILE CB C 14.992 -18.775 -1.743 1.00 . A A . 43 SER CB 1 1 11 3617 1 1 62 ILE H H 16.093 -16.905 -3.310 1.00 . A A . 43 SER H 1 1 11 3618 1 1 62 ILE HA H 17.090 -18.822 -1.324 1.00 . A A . 43 SER HA 1 1 11 3619 1 1 62 ILE N N 16.720 -17.311 -2.679 1.00 . A A . 43 SER N 1 1 11 3620 1 1 62 ILE O O 16.241 -20.816 -3.199 1.00 . A A . 43 SER O 1 1 11 3621 1 1 63 GLY C C 19.427 -20.785 -5.043 1.00 . A A . 44 ILE C 1 1 11 3622 1 1 63 GLY CA C 18.009 -20.261 -5.256 1.00 . A A . 44 ILE CA 1 1 11 3623 1 1 63 GLY H H 18.015 -18.447 -4.171 1.00 . A A . 44 ILE H 1 1 11 3624 1 1 63 GLY N N 17.627 -19.346 -4.189 1.00 . A A . 44 ILE N 1 1 11 3625 1 1 63 GLY O O 20.196 -20.937 -5.991 1.00 . A A . 44 ILE O 1 1 11 3626 1 1 64 ARG C C 21.332 -22.942 -4.041 1.00 . A A . 45 GLY C 1 1 11 3627 1 1 64 ARG CA C 21.083 -21.563 -3.464 1.00 . A A . 45 GLY CA 1 1 11 3628 1 1 64 ARG H H 19.104 -20.914 -3.073 1.00 . A A . 45 GLY H 1 1 11 3629 1 1 64 ARG N N 19.762 -21.057 -3.787 1.00 . A A . 45 GLY N 1 1 11 3630 1 1 64 ARG O O 21.933 -23.078 -5.108 1.00 . A A . 45 GLY O 1 1 12 3631 1 1 20 ASN C C -13.486 -9.069 26.709 1.00 . A A . 1 VAL C 1 1 12 3632 1 1 20 ASN CA C -14.205 -10.167 25.934 1.00 . A A . 1 VAL CA 1 1 12 3633 1 1 20 ASN CB C -15.171 -9.518 24.925 1.00 . A A . 1 VAL CB 1 1 12 3634 1 1 20 ASN H H -15.719 -10.765 27.287 1.00 . A A . 1 VAL H 1 1 12 3635 1 1 20 ASN HA H -13.476 -10.743 25.382 1.00 . A A . 1 VAL HA 1 1 12 3636 1 1 20 ASN N N -14.906 -11.074 26.834 1.00 . A A . 1 VAL N 1 1 12 3637 1 1 20 ASN O O -14.054 -8.463 27.616 1.00 . A A . 1 VAL O 1 1 12 3638 1 1 21 TYR C C -10.377 -7.234 26.058 1.00 . A A . 2 ASN C 1 1 12 3639 1 1 21 TYR CA C -11.434 -7.794 27.007 1.00 . A A . 2 ASN CA 1 1 12 3640 1 1 21 TYR CB C -10.767 -8.367 28.259 1.00 . A A . 2 ASN CB 1 1 12 3641 1 1 21 TYR CG C -11.550 -8.062 29.522 1.00 . A A . 2 ASN CG 1 1 12 3642 1 1 21 TYR H H -11.835 -9.337 25.614 1.00 . A A . 2 ASN H 1 1 12 3643 1 1 21 TYR HA H -12.098 -6.994 27.297 1.00 . A A . 2 ASN HA 1 1 12 3644 1 1 21 TYR HB2 H -10.687 -9.439 28.159 1.00 . A A . 2 ASN HB2 1 1 12 3645 1 1 21 TYR HB3 H -9.778 -7.945 28.361 1.00 . A A . 2 ASN HB3 1 1 12 3646 1 1 21 TYR N N -12.233 -8.820 26.345 1.00 . A A . 2 ASN N 1 1 12 3647 1 1 21 TYR O O -9.177 -7.379 26.292 1.00 . A A . 2 ASN O 1 1 12 3648 1 1 22 GLY C C -9.015 -7.079 23.402 1.00 . A A . 3 TYR C 1 1 12 3649 1 1 22 GLY CA C -9.927 -6.012 24.000 1.00 . A A . 3 TYR CA 1 1 12 3650 1 1 22 GLY H H -11.800 -6.511 24.853 1.00 . A A . 3 TYR H 1 1 12 3651 1 1 22 GLY N N -10.832 -6.594 24.985 1.00 . A A . 3 TYR N 1 1 12 3652 1 1 22 GLY O O -7.827 -6.845 23.182 1.00 . A A . 3 TYR O 1 1 12 3653 1 1 23 ASN C C -8.502 -10.430 23.577 1.00 . A A . 4 GLY C 1 1 12 3654 1 1 23 ASN CA C -8.804 -9.339 22.569 1.00 . A A . 4 GLY CA 1 1 12 3655 1 1 23 ASN H H -10.532 -8.384 23.335 1.00 . A A . 4 GLY H 1 1 12 3656 1 1 23 ASN N N -9.580 -8.253 23.140 1.00 . A A . 4 GLY N 1 1 12 3657 1 1 23 ASN O O -8.303 -11.587 23.208 1.00 . A A . 4 GLY O 1 1 12 3658 1 1 24 GLY C C -6.796 -11.603 25.834 1.00 . A A . 5 ASN C 1 1 12 3659 1 1 24 GLY CA C -8.204 -11.017 25.927 1.00 . A A . 5 ASN CA 1 1 12 3660 1 1 24 GLY H H -8.653 -9.133 25.088 1.00 . A A . 5 ASN H 1 1 12 3661 1 1 24 GLY N N -8.475 -10.063 24.857 1.00 . A A . 5 ASN N 1 1 12 3662 1 1 24 GLY O O -6.443 -12.506 26.592 1.00 . A A . 5 ASN O 1 1 12 3663 1 1 25 VAL C C -3.623 -10.461 24.669 1.00 . A A . 6 GLY C 1 1 12 3664 1 1 25 VAL CA C -4.639 -11.583 24.743 1.00 . A A . 6 GLY CA 1 1 12 3665 1 1 25 VAL H H -6.325 -10.376 24.330 1.00 . A A . 6 GLY H 1 1 12 3666 1 1 25 VAL N N -5.995 -11.091 24.906 1.00 . A A . 6 GLY N 1 1 12 3667 1 1 25 VAL O O -2.929 -10.310 23.663 1.00 . A A . 6 GLY O 1 1 12 3668 1 1 26 SER C C -2.533 -7.775 24.501 1.00 . A A . 7 VAL C 1 1 12 3669 1 1 26 SER CA C -2.604 -8.551 25.820 1.00 . A A . 7 VAL CA 1 1 12 3670 1 1 26 SER CB C -1.191 -9.028 26.244 1.00 . A A . 7 VAL CB 1 1 12 3671 1 1 26 SER H H -4.119 -9.855 26.507 1.00 . A A . 7 VAL H 1 1 12 3672 1 1 26 SER HA H -2.970 -7.882 26.585 1.00 . A A . 7 VAL HA 1 1 12 3673 1 1 26 SER N N -3.538 -9.673 25.741 1.00 . A A . 7 VAL N 1 1 12 3674 1 1 26 SER O O -3.415 -7.892 23.650 1.00 . A A . 7 VAL O 1 1 12 3675 1 1 27 CYS C C -0.148 -6.766 22.298 1.00 . A A . 8 SER C 1 1 12 3676 1 1 27 CYS CA C -1.281 -6.189 23.143 1.00 . A A . 8 SER CA 1 1 12 3677 1 1 27 CYS CB C -0.988 -4.735 23.523 1.00 . A A . 8 SER CB 1 1 12 3678 1 1 27 CYS H H -0.815 -6.939 25.063 1.00 . A A . 8 SER H 1 1 12 3679 1 1 27 CYS HA H -2.192 -6.222 22.567 1.00 . A A . 8 SER HA 1 1 12 3680 1 1 27 CYS HB2 H -1.090 -4.616 24.591 1.00 . A A . 8 SER HB2 1 1 12 3681 1 1 27 CYS HB3 H 0.019 -4.482 23.229 1.00 . A A . 8 SER HB3 1 1 12 3682 1 1 27 CYS N N -1.480 -6.985 24.347 1.00 . A A . 8 SER N 1 1 12 3683 1 1 27 CYS O O 0.206 -7.934 22.443 1.00 . A A . 8 SER O 1 1 12 3684 1 1 28 SER C C 1.416 -7.753 20.046 1.00 . A A . 9 CYS C 1 1 12 3685 1 1 28 SER CA C 1.517 -6.317 20.549 1.00 . A A . 9 CYS CA 1 1 12 3686 1 1 28 SER CB C 2.854 -6.093 21.239 1.00 . A A . 9 CYS CB 1 1 12 3687 1 1 28 SER H H 0.096 -5.014 21.374 1.00 . A A . 9 CYS H 1 1 12 3688 1 1 28 SER HA H 1.473 -5.665 19.690 1.00 . A A . 9 CYS HA 1 1 12 3689 1 1 28 SER HB2 H 3.566 -6.811 20.869 1.00 . A A . 9 CYS HB2 1 1 12 3690 1 1 28 SER HB3 H 3.187 -5.105 20.992 1.00 . A A . 9 CYS HB3 1 1 12 3691 1 1 28 SER N N 0.418 -5.931 21.425 1.00 . A A . 9 CYS N 1 1 12 3692 1 1 28 SER O O 1.635 -8.712 20.785 1.00 . A A . 9 CYS O 1 1 12 3693 1 1 29 LYS C C 1.827 -9.185 16.834 1.00 . A A . 10 SER C 1 1 12 3694 1 1 29 LYS CA C 1.005 -9.177 18.114 1.00 . A A . 10 SER CA 1 1 12 3695 1 1 29 LYS CB C -0.452 -9.509 17.802 1.00 . A A . 10 SER CB 1 1 12 3696 1 1 29 LYS H H 0.979 -7.064 18.231 1.00 . A A . 10 SER H 1 1 12 3697 1 1 29 LYS HA H 1.403 -9.920 18.790 1.00 . A A . 10 SER HA 1 1 12 3698 1 1 29 LYS HB2 H -0.773 -8.938 16.944 1.00 . A A . 10 SER HB2 1 1 12 3699 1 1 29 LYS HB3 H -0.536 -10.564 17.585 1.00 . A A . 10 SER HB3 1 1 12 3700 1 1 29 LYS N N 1.113 -7.877 18.763 1.00 . A A . 10 SER N 1 1 12 3701 1 1 29 LYS O O 1.497 -8.495 15.868 1.00 . A A . 10 SER O 1 1 12 3702 1 1 30 THR C C 4.410 -8.692 15.345 1.00 . A A . 11 LYS C 1 1 12 3703 1 1 30 THR CA C 3.786 -10.047 15.678 1.00 . A A . 11 LYS CA 1 1 12 3704 1 1 30 THR CB C 2.999 -10.563 14.485 1.00 . A A . 11 LYS CB 1 1 12 3705 1 1 30 THR H H 3.113 -10.480 17.631 1.00 . A A . 11 LYS H 1 1 12 3706 1 1 30 THR HA H 4.572 -10.743 15.909 1.00 . A A . 11 LYS HA 1 1 12 3707 1 1 30 THR N N 2.905 -9.959 16.836 1.00 . A A . 11 LYS N 1 1 12 3708 1 1 30 THR O O 5.078 -8.542 14.322 1.00 . A A . 11 LYS O 1 1 12 3709 1 1 31 LYS C C 4.926 -5.684 17.363 1.00 . A A . 12 THR C 1 1 12 3710 1 1 31 LYS CA C 4.713 -6.377 16.015 1.00 . A A . 12 THR CA 1 1 12 3711 1 1 31 LYS CB C 3.757 -5.586 15.114 1.00 . A A . 12 THR CB 1 1 12 3712 1 1 31 LYS H H 3.650 -7.892 17.000 1.00 . A A . 12 THR H 1 1 12 3713 1 1 31 LYS HA H 5.662 -6.472 15.522 1.00 . A A . 12 THR HA 1 1 12 3714 1 1 31 LYS N N 4.184 -7.713 16.211 1.00 . A A . 12 THR N 1 1 12 3715 1 1 31 LYS O O 4.436 -6.149 18.392 1.00 . A A . 12 THR O 1 1 12 3716 1 1 32 CYS C C 4.667 -3.603 19.395 1.00 . A A . 13 LYS C 1 1 12 3717 1 1 32 CYS CA C 5.937 -3.819 18.571 1.00 . A A . 13 LYS CA 1 1 12 3718 1 1 32 CYS CB C 6.572 -2.470 18.227 1.00 . A A . 13 LYS CB 1 1 12 3719 1 1 32 CYS H H 6.024 -4.253 16.499 1.00 . A A . 13 LYS H 1 1 12 3720 1 1 32 CYS HA H 6.636 -4.394 19.160 1.00 . A A . 13 LYS HA 1 1 12 3721 1 1 32 CYS HB2 H 6.258 -2.180 17.235 1.00 . A A . 13 LYS HB2 1 1 12 3722 1 1 32 CYS HB3 H 6.228 -1.731 18.935 1.00 . A A . 13 LYS HB3 1 1 12 3723 1 1 32 CYS N N 5.659 -4.573 17.350 1.00 . A A . 13 LYS N 1 1 12 3724 1 1 32 CYS O O 3.560 -3.883 18.933 1.00 . A A . 13 LYS O 1 1 12 3725 1 1 33 SER C C 3.423 -1.357 21.612 1.00 . A A . 14 CYS C 1 1 12 3726 1 1 33 SER CA C 3.712 -2.852 21.510 1.00 . A A . 14 CYS CA 1 1 12 3727 1 1 33 SER CB C 4.003 -3.429 22.899 1.00 . A A . 14 CYS CB 1 1 12 3728 1 1 33 SER H H 5.747 -2.903 20.926 1.00 . A A . 14 CYS H 1 1 12 3729 1 1 33 SER HA H 2.843 -3.345 21.096 1.00 . A A . 14 CYS HA 1 1 12 3730 1 1 33 SER HB2 H 4.817 -4.134 22.823 1.00 . A A . 14 CYS HB2 1 1 12 3731 1 1 33 SER HB3 H 4.292 -2.626 23.561 1.00 . A A . 14 CYS HB3 1 1 12 3732 1 1 33 SER N N 4.839 -3.104 20.616 1.00 . A A . 14 CYS N 1 1 12 3733 1 1 33 SER O O 3.077 -0.853 22.681 1.00 . A A . 14 CYS O 1 1 12 3734 1 1 34 VAL C C 3.117 1.257 19.021 1.00 . A A . 15 SER C 1 1 12 3735 1 1 34 VAL CA C 3.321 0.782 20.455 1.00 . A A . 15 SER CA 1 1 12 3736 1 1 34 VAL CB C 4.487 1.538 21.095 1.00 . A A . 15 SER CB 1 1 12 3737 1 1 34 VAL H H 3.845 -1.114 19.674 1.00 . A A . 15 SER H 1 1 12 3738 1 1 34 VAL HA H 2.422 0.980 21.019 1.00 . A A . 15 SER HA 1 1 12 3739 1 1 34 VAL N N 3.567 -0.655 20.494 1.00 . A A . 15 SER N 1 1 12 3740 1 1 34 VAL O O 3.582 0.623 18.074 1.00 . A A . 15 SER O 1 1 12 3741 1 1 35 ASN C C 3.461 3.229 16.806 1.00 . A A . 16 VAL C 1 1 12 3742 1 1 35 ASN CA C 2.158 2.938 17.546 1.00 . A A . 16 VAL CA 1 1 12 3743 1 1 35 ASN CB C 1.325 4.232 17.638 1.00 . A A . 16 VAL CB 1 1 12 3744 1 1 35 ASN H H 2.076 2.841 19.659 1.00 . A A . 16 VAL H 1 1 12 3745 1 1 35 ASN HA H 1.592 2.210 16.983 1.00 . A A . 16 VAL HA 1 1 12 3746 1 1 35 ASN N N 2.421 2.378 18.867 1.00 . A A . 16 VAL N 1 1 12 3747 1 1 35 ASN O O 4.484 3.521 17.423 1.00 . A A . 16 VAL O 1 1 12 3748 1 1 36 TRP C C 4.322 4.499 13.640 1.00 . A A . 17 ASN C 1 1 12 3749 1 1 36 TRP CA C 4.593 3.395 14.659 1.00 . A A . 17 ASN CA 1 1 12 3750 1 1 36 TRP CB C 5.020 2.112 13.943 1.00 . A A . 17 ASN CB 1 1 12 3751 1 1 36 TRP CG C 3.901 1.511 13.114 1.00 . A A . 17 ASN CG 1 1 12 3752 1 1 36 TRP H H 2.570 2.903 15.046 1.00 . A A . 17 ASN H 1 1 12 3753 1 1 36 TRP HA H 5.391 3.714 15.312 1.00 . A A . 17 ASN HA 1 1 12 3754 1 1 36 TRP HB2 H 5.849 2.332 13.288 1.00 . A A . 17 ASN HB2 1 1 12 3755 1 1 36 TRP HB3 H 5.332 1.384 14.677 1.00 . A A . 17 ASN HB3 1 1 12 3756 1 1 36 TRP N N 3.415 3.143 15.481 1.00 . A A . 17 ASN N 1 1 12 3757 1 1 36 TRP O O 4.587 4.338 12.448 1.00 . A A . 17 ASN O 1 1 12 3758 1 1 37 GLY C C 4.757 7.421 12.752 1.00 . A A . 18 TRP C 1 1 12 3759 1 1 37 GLY CA C 3.482 6.749 13.252 1.00 . A A . 18 TRP CA 1 1 12 3760 1 1 37 GLY H H 3.600 5.687 15.074 1.00 . A A . 18 TRP H 1 1 12 3761 1 1 37 GLY N N 3.791 5.619 14.118 1.00 . A A . 18 TRP N 1 1 12 3762 1 1 37 GLY O O 4.796 7.953 11.644 1.00 . A A . 18 TRP O 1 1 12 3763 1 1 38 GLN C C 8.112 6.950 12.858 1.00 . A A . 19 GLY C 1 1 12 3764 1 1 38 GLN CA C 7.064 7.989 13.199 1.00 . A A . 19 GLY CA 1 1 12 3765 1 1 38 GLN H H 5.709 6.943 14.444 1.00 . A A . 19 GLY H 1 1 12 3766 1 1 38 GLN N N 5.799 7.385 13.575 1.00 . A A . 19 GLY N 1 1 12 3767 1 1 38 GLN O O 8.786 7.042 11.829 1.00 . A A . 19 GLY O 1 1 12 3768 1 1 39 ALA C C 8.988 4.252 12.129 1.00 . A A . 20 GLN C 1 1 12 3769 1 1 39 ALA CA C 9.210 4.882 13.496 1.00 . A A . 20 GLN CA 1 1 12 3770 1 1 39 ALA CB C 9.101 3.822 14.595 1.00 . A A . 20 GLN CB 1 1 12 3771 1 1 39 ALA H H 7.676 5.921 14.517 1.00 . A A . 20 GLN H 1 1 12 3772 1 1 39 ALA HA H 10.199 5.318 13.519 1.00 . A A . 20 GLN HA 1 1 12 3773 1 1 39 ALA HB2 H 8.395 4.161 15.339 1.00 . A A . 20 GLN HB2 1 1 12 3774 1 1 39 ALA HB3 H 8.737 2.902 14.160 1.00 . A A . 20 GLN HB3 1 1 12 3775 1 1 39 ALA N N 8.245 5.948 13.719 1.00 . A A . 20 GLN N 1 1 12 3776 1 1 39 ALA O O 9.865 4.305 11.266 1.00 . A A . 20 GLN O 1 1 12 3777 1 1 40 PHE C C 7.437 4.065 9.521 1.00 . A A . 21 ALA C 1 1 12 3778 1 1 40 PHE CA C 7.505 3.048 10.641 1.00 . A A . 21 ALA CA 1 1 12 3779 1 1 40 PHE CB C 6.247 2.207 10.699 1.00 . A A . 21 ALA CB 1 1 12 3780 1 1 40 PHE H H 7.140 3.657 12.639 1.00 . A A . 21 ALA H 1 1 12 3781 1 1 40 PHE HA H 8.321 2.413 10.426 1.00 . A A . 21 ALA HA 1 1 12 3782 1 1 40 PHE HB2 H 6.301 1.538 11.544 1.00 . A A . 21 ALA HB2 1 1 12 3783 1 1 40 PHE HB3 H 6.166 1.632 9.788 1.00 . A A . 21 ALA HB3 1 1 12 3784 1 1 40 PHE N N 7.811 3.664 11.925 1.00 . A A . 21 ALA N 1 1 12 3785 1 1 40 PHE O O 7.355 3.715 8.343 1.00 . A A . 21 ALA O 1 1 12 3786 1 1 41 GLN C C 8.839 6.328 8.179 1.00 . A A . 22 PHE C 1 1 12 3787 1 1 41 GLN CA C 7.527 6.401 8.931 1.00 . A A . 22 PHE CA 1 1 12 3788 1 1 41 GLN CB C 7.375 7.760 9.619 1.00 . A A . 22 PHE CB 1 1 12 3789 1 1 41 GLN CG C 6.798 8.823 8.726 1.00 . A A . 22 PHE CG 1 1 12 3790 1 1 41 GLN H H 7.627 5.505 10.837 1.00 . A A . 22 PHE H 1 1 12 3791 1 1 41 GLN HA H 6.711 6.244 8.243 1.00 . A A . 22 PHE HA 1 1 12 3792 1 1 41 GLN HB2 H 6.722 7.653 10.473 1.00 . A A . 22 PHE HB2 1 1 12 3793 1 1 41 GLN HB3 H 8.345 8.097 9.952 1.00 . A A . 22 PHE HB3 1 1 12 3794 1 1 41 GLN N N 7.522 5.317 9.896 1.00 . A A . 22 PHE N 1 1 12 3795 1 1 41 GLN O O 8.895 6.492 6.960 1.00 . A A . 22 PHE O 1 1 12 3796 1 1 42 GLU C C 11.301 4.485 7.691 1.00 . A A . 23 GLN C 1 1 12 3797 1 1 42 GLU CA C 11.216 5.852 8.371 1.00 . A A . 23 GLN CA 1 1 12 3798 1 1 42 GLU CB C 12.273 5.964 9.475 1.00 . A A . 23 GLN CB 1 1 12 3799 1 1 42 GLU CD C 13.084 7.875 10.915 1.00 . A A . 23 GLN CD 1 1 12 3800 1 1 42 GLU CG C 12.974 7.313 9.512 1.00 . A A . 23 GLN CG 1 1 12 3801 1 1 42 GLU H H 9.757 5.873 9.895 1.00 . A A . 23 GLN H 1 1 12 3802 1 1 42 GLU HA H 11.377 6.627 7.636 1.00 . A A . 23 GLN HA 1 1 12 3803 1 1 42 GLU HB2 H 11.795 5.804 10.433 1.00 . A A . 23 GLN HB2 1 1 12 3804 1 1 42 GLU HB3 H 13.019 5.199 9.323 1.00 . A A . 23 GLN HB3 1 1 12 3805 1 1 42 GLU HG2 H 13.968 7.199 9.107 1.00 . A A . 23 GLN HG2 1 1 12 3806 1 1 42 GLU HG3 H 12.416 8.011 8.903 1.00 . A A . 23 GLN HG3 1 1 12 3807 1 1 42 GLU N N 9.890 6.023 8.932 1.00 . A A . 23 GLN N 1 1 12 3808 1 1 42 GLU O O 12.126 4.267 6.804 1.00 . A A . 23 GLN O 1 1 12 3809 1 1 42 GLU OE1 O 12.277 7.556 11.789 1.00 . A A . 23 GLN OE1 1 1 12 3810 1 1 43 ARG C C 9.896 2.240 6.122 1.00 . A A . 24 GLU C 1 1 12 3811 1 1 43 ARG CA C 10.377 2.221 7.569 1.00 . A A . 24 GLU CA 1 1 12 3812 1 1 43 ARG CB C 9.454 1.334 8.404 1.00 . A A . 24 GLU CB 1 1 12 3813 1 1 43 ARG CD C 9.124 0.031 10.543 1.00 . A A . 24 GLU CD 1 1 12 3814 1 1 43 ARG CG C 10.077 0.863 9.708 1.00 . A A . 24 GLU CG 1 1 12 3815 1 1 43 ARG H H 9.797 3.809 8.829 1.00 . A A . 24 GLU H 1 1 12 3816 1 1 43 ARG HA H 11.368 1.814 7.604 1.00 . A A . 24 GLU HA 1 1 12 3817 1 1 43 ARG HB2 H 8.556 1.886 8.637 1.00 . A A . 24 GLU HB2 1 1 12 3818 1 1 43 ARG HB3 H 9.189 0.463 7.823 1.00 . A A . 24 GLU HB3 1 1 12 3819 1 1 43 ARG HG2 H 10.947 0.265 9.480 1.00 . A A . 24 GLU HG2 1 1 12 3820 1 1 43 ARG HG3 H 10.377 1.727 10.282 1.00 . A A . 24 GLU HG3 1 1 12 3821 1 1 43 ARG N N 10.427 3.569 8.122 1.00 . A A . 24 GLU N 1 1 12 3822 1 1 43 ARG O O 10.243 1.364 5.329 1.00 . A A . 24 GLU O 1 1 12 3823 1 1 44 TYR C C 9.655 3.326 3.393 1.00 . A A . 25 ARG C 1 1 12 3824 1 1 44 TYR CA C 8.548 3.375 4.435 1.00 . A A . 25 ARG CA 1 1 12 3825 1 1 44 TYR CB C 7.756 4.677 4.306 1.00 . A A . 25 ARG CB 1 1 12 3826 1 1 44 TYR CG C 8.617 5.931 4.303 1.00 . A A . 25 ARG CG 1 1 12 3827 1 1 44 TYR CZ C 8.438 8.529 1.651 1.00 . A A . 25 ARG CZ 1 1 12 3828 1 1 44 TYR H H 8.842 3.907 6.463 1.00 . A A . 25 ARG H 1 1 12 3829 1 1 44 TYR HA H 7.887 2.545 4.267 1.00 . A A . 25 ARG HA 1 1 12 3830 1 1 44 TYR HB2 H 7.195 4.651 3.385 1.00 . A A . 25 ARG HB2 1 1 12 3831 1 1 44 TYR HB3 H 7.067 4.745 5.135 1.00 . A A . 25 ARG HB3 1 1 12 3832 1 1 44 TYR HD2 H 9.871 6.196 2.602 1.00 . A A . 25 ARG HD2 1 1 12 3833 1 1 44 TYR N N 9.087 3.242 5.785 1.00 . A A . 25 ARG N 1 1 12 3834 1 1 44 TYR O O 9.484 2.770 2.308 1.00 . A A . 25 ARG O 1 1 12 3835 1 1 45 THR C C 12.444 2.510 2.595 1.00 . A A . 26 TYR C 1 1 12 3836 1 1 45 THR CA C 11.941 3.927 2.846 1.00 . A A . 26 TYR CA 1 1 12 3837 1 1 45 THR CB C 13.060 4.783 3.445 1.00 . A A . 26 TYR CB 1 1 12 3838 1 1 45 THR H H 10.857 4.318 4.619 1.00 . A A . 26 TYR H 1 1 12 3839 1 1 45 THR HA H 11.627 4.360 1.910 1.00 . A A . 26 TYR HA 1 1 12 3840 1 1 45 THR N N 10.792 3.903 3.738 1.00 . A A . 26 TYR N 1 1 12 3841 1 1 45 THR O O 12.883 2.178 1.493 1.00 . A A . 26 TYR O 1 1 12 3842 1 1 46 ALA C C 11.893 -0.499 2.599 1.00 . A A . 27 THR C 1 1 12 3843 1 1 46 ALA CA C 12.807 0.292 3.526 1.00 . A A . 27 THR CA 1 1 12 3844 1 1 46 ALA CB C 12.837 -0.358 4.910 1.00 . A A . 27 THR CB 1 1 12 3845 1 1 46 ALA H H 12.001 2.002 4.476 1.00 . A A . 27 THR H 1 1 12 3846 1 1 46 ALA HA H 13.806 0.290 3.115 1.00 . A A . 27 THR HA 1 1 12 3847 1 1 46 ALA N N 12.367 1.677 3.627 1.00 . A A . 27 THR N 1 1 12 3848 1 1 46 ALA O O 12.359 -1.220 1.718 1.00 . A A . 27 THR O 1 1 12 3849 1 1 47 GLY C C 9.818 -0.760 0.502 1.00 . A A . 28 ALA C 1 1 12 3850 1 1 47 GLY CA C 9.603 -1.055 1.981 1.00 . A A . 28 ALA CA 1 1 12 3851 1 1 47 GLY H H 10.274 0.236 3.520 1.00 . A A . 28 ALA H 1 1 12 3852 1 1 47 GLY N N 10.585 -0.357 2.802 1.00 . A A . 28 ALA N 1 1 12 3853 1 1 47 GLY O O 9.556 -1.604 -0.355 1.00 . A A . 28 ALA O 1 1 12 3854 1 1 48 ILE C C 11.666 0.027 -1.799 1.00 . A A . 29 GLY C 1 1 12 3855 1 1 48 ILE CA C 10.545 0.829 -1.168 1.00 . A A . 29 GLY CA 1 1 12 3856 1 1 48 ILE H H 10.492 1.075 0.934 1.00 . A A . 29 GLY H 1 1 12 3857 1 1 48 ILE N N 10.300 0.444 0.209 1.00 . A A . 29 GLY N 1 1 12 3858 1 1 48 ILE O O 11.467 -0.636 -2.816 1.00 . A A . 29 GLY O 1 1 12 3859 1 1 49 ASN C C 13.781 -2.148 -1.619 1.00 . A A . 30 ILE C 1 1 12 3860 1 1 49 ASN CA C 14.005 -0.640 -1.701 1.00 . A A . 30 ILE CA 1 1 12 3861 1 1 49 ASN CB C 15.289 -0.260 -0.928 1.00 . A A . 30 ILE CB 1 1 12 3862 1 1 49 ASN H H 12.945 0.634 -0.384 1.00 . A A . 30 ILE H 1 1 12 3863 1 1 49 ASN HA H 14.138 -0.364 -2.737 1.00 . A A . 30 ILE HA 1 1 12 3864 1 1 49 ASN N N 12.848 0.088 -1.193 1.00 . A A . 30 ILE N 1 1 12 3865 1 1 49 ASN O O 14.282 -2.904 -2.449 1.00 . A A . 30 ILE O 1 1 12 3866 1 1 50 SER C C 12.164 -4.615 -1.694 1.00 . A A . 31 ASN C 1 1 12 3867 1 1 50 SER CA C 12.739 -3.997 -0.423 1.00 . A A . 31 ASN CA 1 1 12 3868 1 1 50 SER CB C 11.761 -4.192 0.738 1.00 . A A . 31 ASN CB 1 1 12 3869 1 1 50 SER H H 12.655 -1.927 0.017 1.00 . A A . 31 ASN H 1 1 12 3870 1 1 50 SER HA H 13.668 -4.494 -0.185 1.00 . A A . 31 ASN HA 1 1 12 3871 1 1 50 SER HB2 H 11.827 -3.344 1.403 1.00 . A A . 31 ASN HB2 1 1 12 3872 1 1 50 SER HB3 H 10.757 -4.260 0.347 1.00 . A A . 31 ASN HB3 1 1 12 3873 1 1 50 SER N N 13.027 -2.578 -0.613 1.00 . A A . 31 ASN N 1 1 12 3874 1 1 50 SER O O 12.795 -5.462 -2.325 1.00 . A A . 31 ASN O 1 1 12 3875 1 1 51 PHE C C 11.158 -4.436 -4.501 1.00 . A A . 32 SER C 1 1 12 3876 1 1 51 PHE CA C 10.305 -4.691 -3.263 1.00 . A A . 32 SER CA 1 1 12 3877 1 1 51 PHE CB C 8.931 -4.039 -3.431 1.00 . A A . 32 SER CB 1 1 12 3878 1 1 51 PHE H H 10.510 -3.504 -1.522 1.00 . A A . 32 SER H 1 1 12 3879 1 1 51 PHE HA H 10.176 -5.757 -3.143 1.00 . A A . 32 SER HA 1 1 12 3880 1 1 51 PHE HB2 H 8.917 -3.094 -2.910 1.00 . A A . 32 SER HB2 1 1 12 3881 1 1 51 PHE HB3 H 8.738 -3.875 -4.481 1.00 . A A . 32 SER HB3 1 1 12 3882 1 1 51 PHE N N 10.963 -4.183 -2.065 1.00 . A A . 32 SER N 1 1 12 3883 1 1 51 PHE O O 11.122 -5.204 -5.463 1.00 . A A . 32 SER O 1 1 12 3884 1 1 52 VAL C C 13.919 -4.011 -5.747 1.00 . A A . 33 PHE C 1 1 12 3885 1 1 52 VAL CA C 12.790 -2.992 -5.586 1.00 . A A . 33 PHE CA 1 1 12 3886 1 1 52 VAL CB C 13.351 -1.578 -5.376 1.00 . A A . 33 PHE CB 1 1 12 3887 1 1 52 VAL H H 11.913 -2.778 -3.676 1.00 . A A . 33 PHE H 1 1 12 3888 1 1 52 VAL HA H 12.188 -2.999 -6.480 1.00 . A A . 33 PHE HA 1 1 12 3889 1 1 52 VAL N N 11.927 -3.351 -4.469 1.00 . A A . 33 PHE N 1 1 12 3890 1 1 52 VAL O O 14.192 -4.482 -6.853 1.00 . A A . 33 PHE O 1 1 12 3891 1 1 53 SER C C 15.227 -6.618 -5.307 1.00 . A A . 34 VAL C 1 1 12 3892 1 1 53 SER CA C 15.667 -5.310 -4.663 1.00 . A A . 34 VAL CA 1 1 12 3893 1 1 53 SER CB C 16.207 -5.593 -3.245 1.00 . A A . 34 VAL CB 1 1 12 3894 1 1 53 SER H H 14.309 -3.943 -3.785 1.00 . A A . 34 VAL H 1 1 12 3895 1 1 53 SER HA H 16.468 -4.885 -5.253 1.00 . A A . 34 VAL HA 1 1 12 3896 1 1 53 SER N N 14.570 -4.349 -4.637 1.00 . A A . 34 VAL N 1 1 12 3897 1 1 53 SER O O 15.625 -6.923 -6.429 1.00 . A A . 34 VAL O 1 1 12 3898 1 1 54 GLY C C 13.421 -8.568 -6.506 1.00 . A A . 35 SER C 1 1 12 3899 1 1 54 GLY CA C 13.962 -8.674 -5.103 1.00 . A A . 35 SER CA 1 1 12 3900 1 1 54 GLY H H 14.160 -7.136 -3.699 1.00 . A A . 35 SER H 1 1 12 3901 1 1 54 GLY N N 14.421 -7.400 -4.595 1.00 . A A . 35 SER N 1 1 12 3902 1 1 54 GLY O O 13.867 -9.296 -7.392 1.00 . A A . 35 SER O 1 1 12 3903 1 1 55 VAL C C 13.064 -7.743 -9.074 1.00 . A A . 36 GLY C 1 1 12 3904 1 1 55 VAL CA C 11.961 -7.499 -8.068 1.00 . A A . 36 GLY CA 1 1 12 3905 1 1 55 VAL H H 12.183 -7.093 -5.993 1.00 . A A . 36 GLY H 1 1 12 3906 1 1 55 VAL N N 12.489 -7.660 -6.727 1.00 . A A . 36 GLY N 1 1 12 3907 1 1 55 VAL O O 12.890 -8.458 -10.061 1.00 . A A . 36 GLY O 1 1 12 3908 1 1 56 ALA C C 16.261 -8.515 -9.110 1.00 . A A . 37 VAL C 1 1 12 3909 1 1 56 ALA CA C 15.409 -7.329 -9.575 1.00 . A A . 37 VAL CA 1 1 12 3910 1 1 56 ALA CB C 16.268 -6.048 -9.558 1.00 . A A . 37 VAL CB 1 1 12 3911 1 1 56 ALA H H 14.297 -6.652 -7.947 1.00 . A A . 37 VAL H 1 1 12 3912 1 1 56 ALA HA H 15.090 -7.507 -10.583 1.00 . A A . 37 VAL HA 1 1 12 3913 1 1 56 ALA N N 14.226 -7.170 -8.769 1.00 . A A . 37 VAL N 1 1 12 3914 1 1 56 ALA O O 16.354 -9.538 -9.789 1.00 . A A . 37 VAL O 1 1 12 3915 1 1 57 SER C C 17.113 -10.415 -6.581 1.00 . A A . 38 ALA C 1 1 12 3916 1 1 57 SER CA C 17.808 -9.332 -7.391 1.00 . A A . 38 ALA CA 1 1 12 3917 1 1 57 SER CB C 18.858 -8.650 -6.519 1.00 . A A . 38 ALA CB 1 1 12 3918 1 1 57 SER H H 16.805 -7.492 -7.479 1.00 . A A . 38 ALA H 1 1 12 3919 1 1 57 SER HA H 18.320 -9.792 -8.211 1.00 . A A . 38 ALA HA 1 1 12 3920 1 1 57 SER HB2 H 18.882 -7.595 -6.745 1.00 . A A . 38 ALA HB2 1 1 12 3921 1 1 57 SER HB3 H 19.827 -9.084 -6.717 1.00 . A A . 38 ALA HB3 1 1 12 3922 1 1 57 SER N N 16.916 -8.335 -7.959 1.00 . A A . 38 ALA N 1 1 12 3923 1 1 57 SER O O 17.014 -11.572 -6.993 1.00 . A A . 38 ALA O 1 1 12 3924 1 1 58 GLY C C 14.743 -11.505 -4.866 1.00 . A A . 39 SER C 1 1 12 3925 1 1 58 GLY CA C 16.080 -10.903 -4.412 1.00 . A A . 39 SER CA 1 1 12 3926 1 1 58 GLY H H 16.864 -9.087 -5.126 1.00 . A A . 39 SER H 1 1 12 3927 1 1 58 GLY N N 16.701 -10.018 -5.386 1.00 . A A . 39 SER N 1 1 12 3928 1 1 58 GLY O O 14.062 -12.163 -4.080 1.00 . A A . 39 SER O 1 1 12 3929 1 1 59 ALA C C 13.326 -12.815 -7.759 1.00 . A A . 40 GLY C 1 1 12 3930 1 1 59 ALA CA C 13.117 -11.827 -6.627 1.00 . A A . 40 GLY CA 1 1 12 3931 1 1 59 ALA H H 14.938 -10.757 -6.721 1.00 . A A . 40 GLY H 1 1 12 3932 1 1 59 ALA N N 14.368 -11.287 -6.127 1.00 . A A . 40 GLY N 1 1 12 3933 1 1 59 ALA O O 13.311 -14.027 -7.545 1.00 . A A . 40 GLY O 1 1 12 3934 1 1 60 GLY C C 15.105 -13.800 -10.093 1.00 . A A . 41 ALA C 1 1 12 3935 1 1 60 GLY CA C 13.732 -13.136 -10.135 1.00 . A A . 41 ALA CA 1 1 12 3936 1 1 60 GLY H H 13.521 -11.323 -9.074 1.00 . A A . 41 ALA H 1 1 12 3937 1 1 60 GLY N N 13.521 -12.295 -8.967 1.00 . A A . 41 ALA N 1 1 12 3938 1 1 60 GLY O O 16.014 -13.416 -10.828 1.00 . A A . 41 ALA O 1 1 12 3939 1 1 61 SER C C 16.379 -16.809 -8.354 1.00 . A A . 42 GLY C 1 1 12 3940 1 1 61 SER CA C 16.511 -15.499 -9.106 1.00 . A A . 42 GLY CA 1 1 12 3941 1 1 61 SER H H 14.487 -15.062 -8.668 1.00 . A A . 42 GLY H 1 1 12 3942 1 1 61 SER N N 15.246 -14.799 -9.228 1.00 . A A . 42 GLY N 1 1 12 3943 1 1 61 SER O O 16.293 -17.876 -8.963 1.00 . A A . 42 GLY O 1 1 12 3944 1 1 62 ILE C C 14.958 -18.675 -6.501 1.00 . A A . 43 SER C 1 1 12 3945 1 1 62 ILE CA C 16.242 -17.916 -6.190 1.00 . A A . 43 SER CA 1 1 12 3946 1 1 62 ILE CB C 16.283 -17.529 -4.709 1.00 . A A . 43 SER CB 1 1 12 3947 1 1 62 ILE H H 16.436 -15.849 -6.601 1.00 . A A . 43 SER H 1 1 12 3948 1 1 62 ILE HA H 17.075 -18.556 -6.404 1.00 . A A . 43 SER HA 1 1 12 3949 1 1 62 ILE N N 16.364 -16.728 -7.027 1.00 . A A . 43 SER N 1 1 12 3950 1 1 62 ILE O O 14.967 -19.663 -7.233 1.00 . A A . 43 SER O 1 1 12 3951 1 1 63 GLY C C 11.529 -17.806 -6.622 1.00 . A A . 44 ILE C 1 1 12 3952 1 1 63 GLY CA C 12.558 -18.827 -6.143 1.00 . A A . 44 ILE CA 1 1 12 3953 1 1 63 GLY H H 13.926 -17.414 -5.364 1.00 . A A . 44 ILE H 1 1 12 3954 1 1 63 GLY N N 13.859 -18.203 -5.936 1.00 . A A . 44 ILE N 1 1 12 3955 1 1 63 GLY O O 10.464 -17.651 -6.022 1.00 . A A . 44 ILE O 1 1 12 3956 1 1 64 ARG C C 10.047 -16.675 -9.327 1.00 . A A . 45 GLY C 1 1 12 3957 1 1 64 ARG CA C 10.950 -16.113 -8.247 1.00 . A A . 45 GLY CA 1 1 12 3958 1 1 64 ARG H H 12.717 -17.276 -8.143 1.00 . A A . 45 GLY H 1 1 12 3959 1 1 64 ARG N N 11.855 -17.110 -7.706 1.00 . A A . 45 GLY N 1 1 12 3960 1 1 64 ARG O O 9.861 -16.055 -10.375 1.00 . A A . 45 GLY O 1 1 13 3961 1 1 20 ASN C C -3.694 16.618 2.905 1.00 . A A . 1 VAL C 1 1 13 3962 1 1 20 ASN CA C -2.527 15.763 3.392 1.00 . A A . 1 VAL CA 1 1 13 3963 1 1 20 ASN CB C -1.391 16.687 3.878 1.00 . A A . 1 VAL CB 1 1 13 3964 1 1 20 ASN H H -2.526 14.866 1.475 1.00 . A A . 1 VAL H 1 1 13 3965 1 1 20 ASN HA H -2.857 15.162 4.226 1.00 . A A . 1 VAL HA 1 1 13 3966 1 1 20 ASN N N -2.068 14.861 2.341 1.00 . A A . 1 VAL N 1 1 13 3967 1 1 20 ASN O O -3.527 17.477 2.039 1.00 . A A . 1 VAL O 1 1 13 3968 1 1 21 TYR C C -7.159 16.994 4.138 1.00 . A A . 2 ASN C 1 1 13 3969 1 1 21 TYR CA C -6.066 17.126 3.083 1.00 . A A . 2 ASN CA 1 1 13 3970 1 1 21 TYR CB C -6.588 16.638 1.730 1.00 . A A . 2 ASN CB 1 1 13 3971 1 1 21 TYR CG C -6.718 15.128 1.671 1.00 . A A . 2 ASN CG 1 1 13 3972 1 1 21 TYR H H -4.947 15.677 4.148 1.00 . A A . 2 ASN H 1 1 13 3973 1 1 21 TYR HA H -5.789 18.165 2.997 1.00 . A A . 2 ASN HA 1 1 13 3974 1 1 21 TYR HB2 H -7.561 17.071 1.549 1.00 . A A . 2 ASN HB2 1 1 13 3975 1 1 21 TYR HB3 H -5.908 16.955 0.954 1.00 . A A . 2 ASN HB3 1 1 13 3976 1 1 21 TYR N N -4.875 16.376 3.465 1.00 . A A . 2 ASN N 1 1 13 3977 1 1 21 TYR O O -8.071 16.179 4.002 1.00 . A A . 2 ASN O 1 1 13 3978 1 1 22 GLY C C -8.127 16.399 6.906 1.00 . A A . 3 TYR C 1 1 13 3979 1 1 22 GLY CA C -8.050 17.781 6.263 1.00 . A A . 3 TYR CA 1 1 13 3980 1 1 22 GLY H H -6.316 18.437 5.238 1.00 . A A . 3 TYR H 1 1 13 3981 1 1 22 GLY N N -7.064 17.805 5.188 1.00 . A A . 3 TYR N 1 1 13 3982 1 1 22 GLY O O -9.021 15.610 6.601 1.00 . A A . 3 TYR O 1 1 13 3983 1 1 23 ASN C C -7.962 14.822 9.758 1.00 . A A . 4 GLY C 1 1 13 3984 1 1 23 ASN CA C -7.163 14.823 8.468 1.00 . A A . 4 GLY CA 1 1 13 3985 1 1 23 ASN H H -6.494 16.779 8.001 1.00 . A A . 4 GLY H 1 1 13 3986 1 1 23 ASN N N -7.183 16.111 7.797 1.00 . A A . 4 GLY N 1 1 13 3987 1 1 23 ASN O O -7.550 14.218 10.749 1.00 . A A . 4 GLY O 1 1 13 3988 1 1 24 GLY C C -9.311 16.259 12.097 1.00 . A A . 5 ASN C 1 1 13 3989 1 1 24 GLY CA C -9.982 15.557 10.915 1.00 . A A . 5 ASN CA 1 1 13 3990 1 1 24 GLY H H -9.394 15.937 8.926 1.00 . A A . 5 ASN H 1 1 13 3991 1 1 24 GLY N N -9.114 15.490 9.745 1.00 . A A . 5 ASN N 1 1 13 3992 1 1 24 GLY O O -9.877 16.322 13.188 1.00 . A A . 5 ASN O 1 1 13 3993 1 1 25 VAL C C -7.238 16.608 14.184 1.00 . A A . 6 GLY C 1 1 13 3994 1 1 25 VAL CA C -7.400 17.470 12.947 1.00 . A A . 6 GLY CA 1 1 13 3995 1 1 25 VAL H H -7.702 16.710 10.999 1.00 . A A . 6 GLY H 1 1 13 3996 1 1 25 VAL N N -8.109 16.785 11.882 1.00 . A A . 6 GLY N 1 1 13 3997 1 1 25 VAL O O -8.079 16.636 15.083 1.00 . A A . 6 GLY O 1 1 13 3998 1 1 26 SER C C -5.794 15.764 16.664 1.00 . A A . 7 VAL C 1 1 13 3999 1 1 26 SER CA C -5.886 14.964 15.364 1.00 . A A . 7 VAL CA 1 1 13 4000 1 1 26 SER CB C -4.590 14.144 15.142 1.00 . A A . 7 VAL CB 1 1 13 4001 1 1 26 SER H H -5.522 15.861 13.481 1.00 . A A . 7 VAL H 1 1 13 4002 1 1 26 SER HA H -6.711 14.272 15.446 1.00 . A A . 7 VAL HA 1 1 13 4003 1 1 26 SER N N -6.155 15.840 14.230 1.00 . A A . 7 VAL N 1 1 13 4004 1 1 26 SER O O -6.252 16.904 16.737 1.00 . A A . 7 VAL O 1 1 13 4005 1 1 27 CYS C C -3.650 15.580 19.547 1.00 . A A . 8 SER C 1 1 13 4006 1 1 27 CYS CA C -5.047 15.812 18.979 1.00 . A A . 8 SER CA 1 1 13 4007 1 1 27 CYS CB C -6.101 15.297 19.961 1.00 . A A . 8 SER CB 1 1 13 4008 1 1 27 CYS H H -4.854 14.253 17.561 1.00 . A A . 8 SER H 1 1 13 4009 1 1 27 CYS HA H -5.192 16.872 18.834 1.00 . A A . 8 SER HA 1 1 13 4010 1 1 27 CYS HB2 H -6.147 14.220 19.904 1.00 . A A . 8 SER HB2 1 1 13 4011 1 1 27 CYS HB3 H -5.831 15.593 20.964 1.00 . A A . 8 SER HB3 1 1 13 4012 1 1 27 CYS N N -5.200 15.159 17.684 1.00 . A A . 8 SER N 1 1 13 4013 1 1 27 CYS O O -3.082 14.497 19.404 1.00 . A A . 8 SER O 1 1 13 4014 1 1 28 SER C C -1.857 16.087 22.246 1.00 . A A . 9 CYS C 1 1 13 4015 1 1 28 SER CA C -1.774 16.516 20.784 1.00 . A A . 9 CYS CA 1 1 13 4016 1 1 28 SER CB C -1.057 17.865 20.675 1.00 . A A . 9 CYS CB 1 1 13 4017 1 1 28 SER H H -3.607 17.441 20.273 1.00 . A A . 9 CYS H 1 1 13 4018 1 1 28 SER HA H -1.214 15.775 20.234 1.00 . A A . 9 CYS HA 1 1 13 4019 1 1 28 SER HB2 H -1.785 18.633 20.457 1.00 . A A . 9 CYS HB2 1 1 13 4020 1 1 28 SER HB3 H -0.578 18.088 21.618 1.00 . A A . 9 CYS HB3 1 1 13 4021 1 1 28 SER N N -3.104 16.604 20.193 1.00 . A A . 9 CYS N 1 1 13 4022 1 1 28 SER O O -2.557 16.707 23.047 1.00 . A A . 9 CYS O 1 1 13 4023 1 1 29 LYS C C 0.190 13.813 24.272 1.00 . A A . 10 SER C 1 1 13 4024 1 1 29 LYS CA C -1.125 14.519 23.958 1.00 . A A . 10 SER CA 1 1 13 4025 1 1 29 LYS CB C -2.293 13.563 24.185 1.00 . A A . 10 SER CB 1 1 13 4026 1 1 29 LYS H H -0.592 14.574 21.909 1.00 . A A . 10 SER H 1 1 13 4027 1 1 29 LYS HA H -1.230 15.364 24.622 1.00 . A A . 10 SER HA 1 1 13 4028 1 1 29 LYS HB2 H -2.081 12.941 25.041 1.00 . A A . 10 SER HB2 1 1 13 4029 1 1 29 LYS HB3 H -3.191 14.134 24.368 1.00 . A A . 10 SER HB3 1 1 13 4030 1 1 29 LYS N N -1.133 15.025 22.590 1.00 . A A . 10 SER N 1 1 13 4031 1 1 29 LYS O O 0.474 12.739 23.740 1.00 . A A . 10 SER O 1 1 13 4032 1 1 30 THR C C 3.229 13.693 24.376 1.00 . A A . 11 LYS C 1 1 13 4033 1 1 30 THR CA C 2.265 13.862 25.553 1.00 . A A . 11 LYS CA 1 1 13 4034 1 1 30 THR CB C 2.037 12.518 26.233 1.00 . A A . 11 LYS CB 1 1 13 4035 1 1 30 THR H H 0.688 15.265 25.540 1.00 . A A . 11 LYS H 1 1 13 4036 1 1 30 THR HA H 2.709 14.538 26.266 1.00 . A A . 11 LYS HA 1 1 13 4037 1 1 30 THR N N 0.982 14.423 25.147 1.00 . A A . 11 LYS N 1 1 13 4038 1 1 30 THR O O 4.342 13.195 24.549 1.00 . A A . 11 LYS O 1 1 13 4039 1 1 31 LYS C C 3.314 15.077 20.984 1.00 . A A . 12 THR C 1 1 13 4040 1 1 31 LYS CA C 3.647 13.994 22.004 1.00 . A A . 12 THR CA 1 1 13 4041 1 1 31 LYS CB C 3.497 12.615 21.380 1.00 . A A . 12 THR CB 1 1 13 4042 1 1 31 LYS H H 1.925 14.498 23.097 1.00 . A A . 12 THR H 1 1 13 4043 1 1 31 LYS HA H 4.651 14.116 22.311 1.00 . A A . 12 THR HA 1 1 13 4044 1 1 31 LYS N N 2.809 14.106 23.185 1.00 . A A . 12 THR N 1 1 13 4045 1 1 31 LYS O O 2.448 15.921 21.221 1.00 . A A . 12 THR O 1 1 13 4046 1 1 32 CYS C C 2.391 15.839 18.177 1.00 . A A . 13 LYS C 1 1 13 4047 1 1 32 CYS CA C 3.774 16.023 18.793 1.00 . A A . 13 LYS CA 1 1 13 4048 1 1 32 CYS CB C 4.849 15.899 17.710 1.00 . A A . 13 LYS CB 1 1 13 4049 1 1 32 CYS H H 4.677 14.350 19.716 1.00 . A A . 13 LYS H 1 1 13 4050 1 1 32 CYS HA H 3.832 17.005 19.233 1.00 . A A . 13 LYS HA 1 1 13 4051 1 1 32 CYS HB2 H 4.639 16.611 16.926 1.00 . A A . 13 LYS HB2 1 1 13 4052 1 1 32 CYS HB3 H 5.810 16.129 18.146 1.00 . A A . 13 LYS HB3 1 1 13 4053 1 1 32 CYS N N 4.002 15.048 19.848 1.00 . A A . 13 LYS N 1 1 13 4054 1 1 32 CYS O O 1.645 14.940 18.566 1.00 . A A . 13 LYS O 1 1 13 4055 1 1 33 SER C C 0.875 15.892 15.215 1.00 . A A . 14 CYS C 1 1 13 4056 1 1 33 SER CA C 0.758 16.617 16.552 1.00 . A A . 14 CYS CA 1 1 13 4057 1 1 33 SER CB C 0.188 18.022 16.342 1.00 . A A . 14 CYS CB 1 1 13 4058 1 1 33 SER H H 2.690 17.387 16.949 1.00 . A A . 14 CYS H 1 1 13 4059 1 1 33 SER HA H 0.090 16.060 17.192 1.00 . A A . 14 CYS HA 1 1 13 4060 1 1 33 SER HB2 H 1.002 18.709 16.165 1.00 . A A . 14 CYS HB2 1 1 13 4061 1 1 33 SER HB3 H -0.464 18.013 15.481 1.00 . A A . 14 CYS HB3 1 1 13 4062 1 1 33 SER N N 2.053 16.691 17.217 1.00 . A A . 14 CYS N 1 1 13 4063 1 1 33 SER O O 0.461 16.408 14.176 1.00 . A A . 14 CYS O 1 1 13 4064 1 1 34 VAL C C 1.630 12.402 14.372 1.00 . A A . 15 SER C 1 1 13 4065 1 1 34 VAL CA C 1.614 13.891 14.042 1.00 . A A . 15 SER CA 1 1 13 4066 1 1 34 VAL CB C 2.909 14.281 13.329 1.00 . A A . 15 SER CB 1 1 13 4067 1 1 34 VAL H H 1.751 14.331 16.107 1.00 . A A . 15 SER H 1 1 13 4068 1 1 34 VAL HA H 0.779 14.094 13.388 1.00 . A A . 15 SER HA 1 1 13 4069 1 1 34 VAL N N 1.441 14.689 15.249 1.00 . A A . 15 SER N 1 1 13 4070 1 1 34 VAL O O 1.670 12.014 15.539 1.00 . A A . 15 SER O 1 1 13 4071 1 1 35 ASN C C 3.025 9.569 13.368 1.00 . A A . 16 VAL C 1 1 13 4072 1 1 35 ASN CA C 1.612 10.125 13.507 1.00 . A A . 16 VAL CA 1 1 13 4073 1 1 35 ASN CB C 0.696 9.434 12.478 1.00 . A A . 16 VAL CB 1 1 13 4074 1 1 35 ASN H H 1.571 11.945 12.427 1.00 . A A . 16 VAL H 1 1 13 4075 1 1 35 ASN HA H 1.242 9.902 14.496 1.00 . A A . 16 VAL HA 1 1 13 4076 1 1 35 ASN N N 1.600 11.573 13.333 1.00 . A A . 16 VAL N 1 1 13 4077 1 1 35 ASN O O 3.237 8.528 12.744 1.00 . A A . 16 VAL O 1 1 13 4078 1 1 36 TRP C C 5.834 9.810 12.410 1.00 . A A . 17 ASN C 1 1 13 4079 1 1 36 TRP CA C 5.386 9.849 13.864 1.00 . A A . 17 ASN CA 1 1 13 4080 1 1 36 TRP CB C 5.564 8.474 14.512 1.00 . A A . 17 ASN CB 1 1 13 4081 1 1 36 TRP CG C 5.778 8.563 16.009 1.00 . A A . 17 ASN CG 1 1 13 4082 1 1 36 TRP H H 3.772 11.100 14.413 1.00 . A A . 17 ASN H 1 1 13 4083 1 1 36 TRP HA H 5.986 10.573 14.397 1.00 . A A . 17 ASN HA 1 1 13 4084 1 1 36 TRP HB2 H 4.682 7.880 14.328 1.00 . A A . 17 ASN HB2 1 1 13 4085 1 1 36 TRP HB3 H 6.420 7.985 14.072 1.00 . A A . 17 ASN HB3 1 1 13 4086 1 1 36 TRP N N 3.995 10.273 13.940 1.00 . A A . 17 ASN N 1 1 13 4087 1 1 36 TRP O O 6.041 8.739 11.839 1.00 . A A . 17 ASN O 1 1 13 4088 1 1 37 GLY C C 7.864 10.884 10.230 1.00 . A A . 18 TRP C 1 1 13 4089 1 1 37 GLY CA C 6.361 11.101 10.420 1.00 . A A . 18 TRP CA 1 1 13 4090 1 1 37 GLY H H 5.768 11.802 12.317 1.00 . A A . 18 TRP H 1 1 13 4091 1 1 37 GLY N N 5.962 10.989 11.813 1.00 . A A . 18 TRP N 1 1 13 4092 1 1 37 GLY O O 8.401 11.158 9.157 1.00 . A A . 18 TRP O 1 1 13 4093 1 1 38 GLN C C 10.306 8.679 11.314 1.00 . A A . 19 GLY C 1 1 13 4094 1 1 38 GLN CA C 9.966 10.149 11.171 1.00 . A A . 19 GLY CA 1 1 13 4095 1 1 38 GLN H H 8.067 10.190 12.097 1.00 . A A . 19 GLY H 1 1 13 4096 1 1 38 GLN N N 8.538 10.392 11.266 1.00 . A A . 19 GLY N 1 1 13 4097 1 1 38 GLN O O 10.943 8.088 10.439 1.00 . A A . 19 GLY O 1 1 13 4098 1 1 39 ALA C C 9.560 5.809 11.556 1.00 . A A . 20 GLN C 1 1 13 4099 1 1 39 ALA CA C 10.134 6.671 12.672 1.00 . A A . 20 GLN CA 1 1 13 4100 1 1 39 ALA CB C 9.543 6.251 14.019 1.00 . A A . 20 GLN CB 1 1 13 4101 1 1 39 ALA H H 9.370 8.602 13.078 1.00 . A A . 20 GLN H 1 1 13 4102 1 1 39 ALA HA H 11.206 6.530 12.695 1.00 . A A . 20 GLN HA 1 1 13 4103 1 1 39 ALA HB2 H 8.730 6.918 14.266 1.00 . A A . 20 GLN HB2 1 1 13 4104 1 1 39 ALA HB3 H 9.158 5.245 13.933 1.00 . A A . 20 GLN HB3 1 1 13 4105 1 1 39 ALA N N 9.875 8.082 12.419 1.00 . A A . 20 GLN N 1 1 13 4106 1 1 39 ALA O O 10.308 5.212 10.782 1.00 . A A . 20 GLN O 1 1 13 4107 1 1 40 PHE C C 7.885 5.471 9.035 1.00 . A A . 21 ALA C 1 1 13 4108 1 1 40 PHE CA C 7.602 4.939 10.425 1.00 . A A . 21 ALA CA 1 1 13 4109 1 1 40 PHE CB C 6.114 4.768 10.659 1.00 . A A . 21 ALA CB 1 1 13 4110 1 1 40 PHE H H 7.675 6.236 12.103 1.00 . A A . 21 ALA H 1 1 13 4111 1 1 40 PHE HA H 8.057 3.984 10.483 1.00 . A A . 21 ALA HA 1 1 13 4112 1 1 40 PHE HB2 H 5.810 3.797 10.295 1.00 . A A . 21 ALA HB2 1 1 13 4113 1 1 40 PHE HB3 H 5.575 5.539 10.128 1.00 . A A . 21 ALA HB3 1 1 13 4114 1 1 40 PHE N N 8.232 5.741 11.467 1.00 . A A . 21 ALA N 1 1 13 4115 1 1 40 PHE O O 7.511 4.863 8.031 1.00 . A A . 21 ALA O 1 1 13 4116 1 1 41 GLN C C 10.084 6.293 7.152 1.00 . A A . 22 PHE C 1 1 13 4117 1 1 41 GLN CA C 8.988 7.166 7.726 1.00 . A A . 22 PHE CA 1 1 13 4118 1 1 41 GLN CB C 9.487 8.598 7.919 1.00 . A A . 22 PHE CB 1 1 13 4119 1 1 41 GLN CG C 9.647 9.355 6.632 1.00 . A A . 22 PHE CG 1 1 13 4120 1 1 41 GLN H H 8.882 6.965 9.818 1.00 . A A . 22 PHE H 1 1 13 4121 1 1 41 GLN HA H 8.137 7.157 7.065 1.00 . A A . 22 PHE HA 1 1 13 4122 1 1 41 GLN HB2 H 8.785 9.134 8.535 1.00 . A A . 22 PHE HB2 1 1 13 4123 1 1 41 GLN HB3 H 10.446 8.573 8.411 1.00 . A A . 22 PHE HB3 1 1 13 4124 1 1 41 GLN N N 8.589 6.573 8.987 1.00 . A A . 22 PHE N 1 1 13 4125 1 1 41 GLN O O 10.109 5.986 5.960 1.00 . A A . 22 PHE O 1 1 13 4126 1 1 42 GLU C C 11.484 3.549 7.491 1.00 . A A . 23 GLN C 1 1 13 4127 1 1 42 GLU CA C 12.043 4.958 7.695 1.00 . A A . 23 GLN CA 1 1 13 4128 1 1 42 GLU CB C 13.104 4.955 8.800 1.00 . A A . 23 GLN CB 1 1 13 4129 1 1 42 GLU CD C 14.656 6.796 9.566 1.00 . A A . 23 GLN CD 1 1 13 4130 1 1 42 GLU CG C 14.324 5.801 8.472 1.00 . A A . 23 GLN CG 1 1 13 4131 1 1 42 GLU H H 10.849 6.114 8.990 1.00 . A A . 23 GLN H 1 1 13 4132 1 1 42 GLU HA H 12.483 5.304 6.771 1.00 . A A . 23 GLN HA 1 1 13 4133 1 1 42 GLU HB2 H 12.658 5.338 9.711 1.00 . A A . 23 GLN HB2 1 1 13 4134 1 1 42 GLU HB3 H 13.430 3.940 8.969 1.00 . A A . 23 GLN HB3 1 1 13 4135 1 1 42 GLU HG2 H 15.172 5.147 8.332 1.00 . A A . 23 GLN HG2 1 1 13 4136 1 1 42 GLU HG3 H 14.134 6.343 7.557 1.00 . A A . 23 GLN HG3 1 1 13 4137 1 1 42 GLU N N 10.960 5.853 8.049 1.00 . A A . 23 GLN N 1 1 13 4138 1 1 42 GLU O O 12.090 2.716 6.817 1.00 . A A . 23 GLN O 1 1 13 4139 1 1 42 GLU OE1 O 14.730 8.001 9.324 1.00 . A A . 23 GLN OE1 1 1 13 4140 1 1 43 ARG C C 9.174 1.762 6.539 1.00 . A A . 24 GLU C 1 1 13 4141 1 1 43 ARG CA C 9.640 2.010 7.969 1.00 . A A . 24 GLU CA 1 1 13 4142 1 1 43 ARG CB C 8.444 1.944 8.920 1.00 . A A . 24 GLU CB 1 1 13 4143 1 1 43 ARG CD C 7.622 1.500 11.268 1.00 . A A . 24 GLU CD 1 1 13 4144 1 1 43 ARG CG C 8.828 1.632 10.358 1.00 . A A . 24 GLU CG 1 1 13 4145 1 1 43 ARG H H 9.875 4.010 8.596 1.00 . A A . 24 GLU H 1 1 13 4146 1 1 43 ARG HA H 10.345 1.250 8.247 1.00 . A A . 24 GLU HA 1 1 13 4147 1 1 43 ARG HB2 H 7.932 2.893 8.904 1.00 . A A . 24 GLU HB2 1 1 13 4148 1 1 43 ARG HB3 H 7.768 1.176 8.577 1.00 . A A . 24 GLU HB3 1 1 13 4149 1 1 43 ARG HG2 H 9.376 0.701 10.378 1.00 . A A . 24 GLU HG2 1 1 13 4150 1 1 43 ARG HG3 H 9.456 2.427 10.731 1.00 . A A . 24 GLU HG3 1 1 13 4151 1 1 43 ARG N N 10.307 3.301 8.078 1.00 . A A . 24 GLU N 1 1 13 4152 1 1 43 ARG O O 9.526 0.757 5.923 1.00 . A A . 24 GLU O 1 1 13 4153 1 1 44 TYR C C 8.985 2.503 3.645 1.00 . A A . 25 ARG C 1 1 13 4154 1 1 44 TYR CA C 7.853 2.580 4.662 1.00 . A A . 25 ARG CA 1 1 13 4155 1 1 44 TYR CB C 6.947 3.772 4.346 1.00 . A A . 25 ARG CB 1 1 13 4156 1 1 44 TYR CG C 5.526 3.610 4.859 1.00 . A A . 25 ARG CG 1 1 13 4157 1 1 44 TYR CZ C 2.640 2.421 5.315 1.00 . A A . 25 ARG CZ 1 1 13 4158 1 1 44 TYR H H 8.130 3.467 6.563 1.00 . A A . 25 ARG H 1 1 13 4159 1 1 44 TYR HA H 7.276 1.675 4.604 1.00 . A A . 25 ARG HA 1 1 13 4160 1 1 44 TYR HB2 H 7.369 4.660 4.795 1.00 . A A . 25 ARG HB2 1 1 13 4161 1 1 44 TYR HB3 H 6.906 3.905 3.275 1.00 . A A . 25 ARG HB3 1 1 13 4162 1 1 44 TYR HD2 H 5.049 2.603 3.046 1.00 . A A . 25 ARG HD2 1 1 13 4163 1 1 44 TYR N N 8.375 2.690 6.019 1.00 . A A . 25 ARG N 1 1 13 4164 1 1 44 TYR O O 8.836 1.912 2.576 1.00 . A A . 25 ARG O 1 1 13 4165 1 1 45 THR C C 11.830 1.696 2.944 1.00 . A A . 26 TYR C 1 1 13 4166 1 1 45 THR CA C 11.278 3.107 3.114 1.00 . A A . 26 TYR CA 1 1 13 4167 1 1 45 THR CB C 12.362 4.030 3.674 1.00 . A A . 26 TYR CB 1 1 13 4168 1 1 45 THR H H 10.167 3.556 4.854 1.00 . A A . 26 TYR H 1 1 13 4169 1 1 45 THR HA H 10.965 3.477 2.150 1.00 . A A . 26 TYR HA 1 1 13 4170 1 1 45 THR N N 10.114 3.104 3.989 1.00 . A A . 26 TYR N 1 1 13 4171 1 1 45 THR O O 12.087 1.248 1.827 1.00 . A A . 26 TYR O 1 1 13 4172 1 1 46 ALA C C 11.527 -1.316 3.394 1.00 . A A . 27 THR C 1 1 13 4173 1 1 46 ALA CA C 12.527 -0.362 4.042 1.00 . A A . 27 THR CA 1 1 13 4174 1 1 46 ALA CB C 12.850 -0.827 5.463 1.00 . A A . 27 THR CB 1 1 13 4175 1 1 46 ALA H H 11.781 1.412 4.922 1.00 . A A . 27 THR H 1 1 13 4176 1 1 46 ALA HA H 13.434 -0.361 3.457 1.00 . A A . 27 THR HA 1 1 13 4177 1 1 46 ALA N N 12.007 0.999 4.062 1.00 . A A . 27 THR N 1 1 13 4178 1 1 46 ALA O O 11.911 -2.242 2.679 1.00 . A A . 27 THR O 1 1 13 4179 1 1 47 GLY C C 9.090 -1.759 1.581 1.00 . A A . 28 ALA C 1 1 13 4180 1 1 47 GLY CA C 9.189 -1.923 3.095 1.00 . A A . 28 ALA CA 1 1 13 4181 1 1 47 GLY H H 9.999 -0.333 4.227 1.00 . A A . 28 ALA H 1 1 13 4182 1 1 47 GLY N N 10.243 -1.084 3.650 1.00 . A A . 28 ALA N 1 1 13 4183 1 1 47 GLY O O 8.658 -2.672 0.877 1.00 . A A . 28 ALA O 1 1 13 4184 1 1 48 ILE C C 10.652 -0.845 -1.078 1.00 . A A . 29 GLY C 1 1 13 4185 1 1 48 ILE CA C 9.430 -0.331 -0.340 1.00 . A A . 29 GLY CA 1 1 13 4186 1 1 48 ILE H H 9.821 0.100 1.696 1.00 . A A . 29 GLY H 1 1 13 4187 1 1 48 ILE N N 9.488 -0.591 1.087 1.00 . A A . 29 GLY N 1 1 13 4188 1 1 48 ILE O O 10.529 -1.542 -2.085 1.00 . A A . 29 GLY O 1 1 13 4189 1 1 49 ASN C C 13.160 -2.447 -1.285 1.00 . A A . 30 ILE C 1 1 13 4190 1 1 49 ASN CA C 13.081 -0.925 -1.200 1.00 . A A . 30 ILE CA 1 1 13 4191 1 1 49 ASN CB C 14.306 -0.393 -0.429 1.00 . A A . 30 ILE CB 1 1 13 4192 1 1 49 ASN H H 11.868 0.062 0.226 1.00 . A A . 30 ILE H 1 1 13 4193 1 1 49 ASN HA H 13.110 -0.518 -2.201 1.00 . A A . 30 ILE HA 1 1 13 4194 1 1 49 ASN N N 11.834 -0.497 -0.578 1.00 . A A . 30 ILE N 1 1 13 4195 1 1 49 ASN O O 13.739 -2.995 -2.224 1.00 . A A . 30 ILE O 1 1 13 4196 1 1 50 SER C C 12.114 -5.165 -1.601 1.00 . A A . 31 ASN C 1 1 13 4197 1 1 50 SER CA C 12.580 -4.586 -0.269 1.00 . A A . 31 ASN CA 1 1 13 4198 1 1 50 SER CB C 11.686 -5.096 0.862 1.00 . A A . 31 ASN CB 1 1 13 4199 1 1 50 SER H H 12.128 -2.634 0.418 1.00 . A A . 31 ASN H 1 1 13 4200 1 1 50 SER HA H 13.594 -4.908 -0.087 1.00 . A A . 31 ASN HA 1 1 13 4201 1 1 50 SER HB2 H 11.727 -4.399 1.687 1.00 . A A . 31 ASN HB2 1 1 13 4202 1 1 50 SER HB3 H 10.668 -5.164 0.505 1.00 . A A . 31 ASN HB3 1 1 13 4203 1 1 50 SER N N 12.575 -3.125 -0.302 1.00 . A A . 31 ASN N 1 1 13 4204 1 1 50 SER O O 12.875 -5.839 -2.296 1.00 . A A . 31 ASN O 1 1 13 4205 1 1 51 PHE C C 11.088 -4.842 -4.398 1.00 . A A . 32 SER C 1 1 13 4206 1 1 51 PHE CA C 10.302 -5.382 -3.208 1.00 . A A . 32 SER CA 1 1 13 4207 1 1 51 PHE CB C 8.832 -4.977 -3.326 1.00 . A A . 32 SER CB 1 1 13 4208 1 1 51 PHE H H 10.306 -4.346 -1.363 1.00 . A A . 32 SER H 1 1 13 4209 1 1 51 PHE HA H 10.372 -6.459 -3.204 1.00 . A A . 32 SER HA 1 1 13 4210 1 1 51 PHE HB2 H 8.667 -4.063 -2.776 1.00 . A A . 32 SER HB2 1 1 13 4211 1 1 51 PHE HB3 H 8.586 -4.823 -4.366 1.00 . A A . 32 SER HB3 1 1 13 4212 1 1 51 PHE N N 10.864 -4.892 -1.955 1.00 . A A . 32 SER N 1 1 13 4213 1 1 51 PHE O O 11.216 -5.507 -5.425 1.00 . A A . 32 SER O 1 1 13 4214 1 1 52 VAL C C 13.698 -3.737 -5.544 1.00 . A A . 33 PHE C 1 1 13 4215 1 1 52 VAL CA C 12.387 -2.994 -5.306 1.00 . A A . 33 PHE CA 1 1 13 4216 1 1 52 VAL CB C 12.671 -1.534 -4.951 1.00 . A A . 33 PHE CB 1 1 13 4217 1 1 52 VAL H H 11.475 -3.150 -3.407 1.00 . A A . 33 PHE H 1 1 13 4218 1 1 52 VAL HA H 11.799 -3.027 -6.209 1.00 . A A . 33 PHE HA 1 1 13 4219 1 1 52 VAL N N 11.612 -3.629 -4.249 1.00 . A A . 33 PHE N 1 1 13 4220 1 1 52 VAL O O 14.135 -3.897 -6.685 1.00 . A A . 33 PHE O 1 1 13 4221 1 1 53 SER C C 15.460 -6.113 -5.492 1.00 . A A . 34 VAL C 1 1 13 4222 1 1 53 SER CA C 15.584 -4.917 -4.553 1.00 . A A . 34 VAL CA 1 1 13 4223 1 1 53 SER CB C 16.066 -5.396 -3.167 1.00 . A A . 34 VAL CB 1 1 13 4224 1 1 53 SER H H 13.924 -4.035 -3.577 1.00 . A A . 34 VAL H 1 1 13 4225 1 1 53 SER HA H 16.325 -4.240 -4.956 1.00 . A A . 34 VAL HA 1 1 13 4226 1 1 53 SER N N 14.322 -4.192 -4.460 1.00 . A A . 34 VAL N 1 1 13 4227 1 1 53 SER O O 15.955 -6.076 -6.613 1.00 . A A . 34 VAL O 1 1 13 4228 1 1 54 GLY C C 14.170 -8.083 -7.217 1.00 . A A . 35 SER C 1 1 13 4229 1 1 54 GLY CA C 14.662 -8.380 -5.823 1.00 . A A . 35 SER CA 1 1 13 4230 1 1 54 GLY H H 14.471 -7.177 -4.121 1.00 . A A . 35 SER H 1 1 13 4231 1 1 54 GLY N N 14.815 -7.180 -5.027 1.00 . A A . 35 SER N 1 1 13 4232 1 1 54 GLY O O 14.817 -8.472 -8.190 1.00 . A A . 35 SER O 1 1 13 4233 1 1 55 VAL C C 13.729 -6.814 -9.587 1.00 . A A . 36 GLY C 1 1 13 4234 1 1 55 VAL CA C 12.561 -7.050 -8.653 1.00 . A A . 36 GLY CA 1 1 13 4235 1 1 55 VAL H H 12.592 -7.085 -6.527 1.00 . A A . 36 GLY H 1 1 13 4236 1 1 55 VAL N N 13.057 -7.385 -7.331 1.00 . A A . 36 GLY N 1 1 13 4237 1 1 55 VAL O O 13.764 -7.313 -10.713 1.00 . A A . 36 GLY O 1 1 13 4238 1 1 56 ALA C C 17.017 -6.824 -9.504 1.00 . A A . 37 VAL C 1 1 13 4239 1 1 56 ALA CA C 15.925 -5.785 -9.784 1.00 . A A . 37 VAL CA 1 1 13 4240 1 1 56 ALA CB C 16.455 -4.382 -9.419 1.00 . A A . 37 VAL CB 1 1 13 4241 1 1 56 ALA H H 14.625 -5.752 -8.158 1.00 . A A . 37 VAL H 1 1 13 4242 1 1 56 ALA HA H 15.697 -5.796 -10.833 1.00 . A A . 37 VAL HA 1 1 13 4243 1 1 56 ALA N N 14.709 -6.078 -9.072 1.00 . A A . 37 VAL N 1 1 13 4244 1 1 56 ALA O O 17.389 -7.610 -10.375 1.00 . A A . 37 VAL O 1 1 13 4245 1 1 57 SER C C 18.189 -9.018 -7.366 1.00 . A A . 38 ALA C 1 1 13 4246 1 1 57 SER CA C 18.635 -7.646 -7.850 1.00 . A A . 38 ALA CA 1 1 13 4247 1 1 57 SER CB C 19.439 -6.962 -6.749 1.00 . A A . 38 ALA CB 1 1 13 4248 1 1 57 SER H H 17.219 -6.115 -7.645 1.00 . A A . 38 ALA H 1 1 13 4249 1 1 57 SER HA H 19.284 -7.773 -8.691 1.00 . A A . 38 ALA HA 1 1 13 4250 1 1 57 SER HB2 H 19.246 -5.900 -6.771 1.00 . A A . 38 ALA HB2 1 1 13 4251 1 1 57 SER HB3 H 20.491 -7.141 -6.908 1.00 . A A . 38 ALA HB3 1 1 13 4252 1 1 57 SER N N 17.554 -6.774 -8.280 1.00 . A A . 38 ALA N 1 1 13 4253 1 1 57 SER O O 18.402 -10.039 -8.022 1.00 . A A . 38 ALA O 1 1 13 4254 1 1 58 GLY C C 16.091 -10.997 -6.190 1.00 . A A . 39 SER C 1 1 13 4255 1 1 58 GLY CA C 17.201 -10.221 -5.471 1.00 . A A . 39 SER CA 1 1 13 4256 1 1 58 GLY H H 17.543 -8.158 -5.696 1.00 . A A . 39 SER H 1 1 13 4257 1 1 58 GLY N N 17.632 -9.015 -6.163 1.00 . A A . 39 SER N 1 1 13 4258 1 1 58 GLY O O 15.590 -11.990 -5.663 1.00 . A A . 39 SER O 1 1 13 4259 1 1 59 ALA C C 15.206 -12.022 -9.305 1.00 . A A . 40 GLY C 1 1 13 4260 1 1 59 ALA CA C 14.664 -11.239 -8.124 1.00 . A A . 40 GLY CA 1 1 13 4261 1 1 59 ALA H H 16.131 -9.759 -7.767 1.00 . A A . 40 GLY H 1 1 13 4262 1 1 59 ALA N N 15.707 -10.554 -7.385 1.00 . A A . 40 GLY N 1 1 13 4263 1 1 59 ALA O O 14.953 -13.221 -9.431 1.00 . A A . 40 GLY O 1 1 13 4264 1 1 60 GLY C C 17.492 -11.046 -12.061 1.00 . A A . 41 ALA C 1 1 13 4265 1 1 60 GLY CA C 16.529 -11.981 -11.346 1.00 . A A . 41 ALA CA 1 1 13 4266 1 1 60 GLY H H 16.116 -10.392 -10.014 1.00 . A A . 41 ALA H 1 1 13 4267 1 1 60 GLY N N 15.951 -11.344 -10.170 1.00 . A A . 41 ALA N 1 1 13 4268 1 1 60 GLY O O 18.549 -11.463 -12.536 1.00 . A A . 41 ALA O 1 1 13 4269 1 1 61 SER C C 18.278 -9.155 -14.222 1.00 . A A . 42 GLY C 1 1 13 4270 1 1 61 SER CA C 17.948 -8.787 -12.788 1.00 . A A . 42 GLY CA 1 1 13 4271 1 1 61 SER H H 16.265 -9.518 -11.732 1.00 . A A . 42 GLY H 1 1 13 4272 1 1 61 SER N N 17.116 -9.780 -12.132 1.00 . A A . 42 GLY N 1 1 13 4273 1 1 61 SER O O 19.281 -8.697 -14.771 1.00 . A A . 42 GLY O 1 1 13 4274 1 1 62 ILE C C 16.607 -9.799 -17.139 1.00 . A A . 43 SER C 1 1 13 4275 1 1 62 ILE CA C 17.649 -10.410 -16.210 1.00 . A A . 43 SER CA 1 1 13 4276 1 1 62 ILE CB C 17.608 -11.935 -16.309 1.00 . A A . 43 SER CB 1 1 13 4277 1 1 62 ILE H H 16.655 -10.317 -14.343 1.00 . A A . 43 SER H 1 1 13 4278 1 1 62 ILE HA H 18.622 -10.066 -16.512 1.00 . A A . 43 SER HA 1 1 13 4279 1 1 62 ILE N N 17.436 -9.984 -14.831 1.00 . A A . 43 SER N 1 1 13 4280 1 1 62 ILE O O 16.879 -9.540 -18.311 1.00 . A A . 43 SER O 1 1 13 4281 1 1 63 GLY C C 13.166 -8.578 -16.480 1.00 . A A . 44 ILE C 1 1 13 4282 1 1 63 GLY CA C 14.328 -8.993 -17.379 1.00 . A A . 44 ILE CA 1 1 13 4283 1 1 63 GLY H H 15.268 -9.802 -15.668 1.00 . A A . 44 ILE H 1 1 13 4284 1 1 63 GLY N N 15.417 -9.573 -16.605 1.00 . A A . 44 ILE N 1 1 13 4285 1 1 63 GLY O O 12.003 -8.835 -16.791 1.00 . A A . 44 ILE O 1 1 13 4286 1 1 64 ARG C C 11.627 -6.357 -14.997 1.00 . A A . 45 GLY C 1 1 13 4287 1 1 64 ARG CA C 12.461 -7.493 -14.438 1.00 . A A . 45 GLY CA 1 1 13 4288 1 1 64 ARG H H 14.433 -7.756 -15.166 1.00 . A A . 45 GLY H 1 1 13 4289 1 1 64 ARG N N 13.489 -7.934 -15.364 1.00 . A A . 45 GLY N 1 1 13 4290 1 1 64 ARG O O 11.078 -6.463 -16.094 1.00 . A A . 45 GLY O 1 1 14 4291 1 1 20 ASN C C -9.290 28.005 29.344 1.00 . A A . 1 VAL C 1 1 14 4292 1 1 20 ASN CA C -8.599 28.115 30.699 1.00 . A A . 1 VAL CA 1 1 14 4293 1 1 20 ASN CB C -8.079 26.725 31.111 1.00 . A A . 1 VAL CB 1 1 14 4294 1 1 20 ASN H H -10.388 28.268 31.819 1.00 . A A . 1 VAL H 1 1 14 4295 1 1 20 ASN HA H -7.754 28.781 30.608 1.00 . A A . 1 VAL HA 1 1 14 4296 1 1 20 ASN N N -9.499 28.665 31.704 1.00 . A A . 1 VAL N 1 1 14 4297 1 1 20 ASN O O -10.212 27.208 29.170 1.00 . A A . 1 VAL O 1 1 14 4298 1 1 21 TYR C C -8.320 28.784 25.986 1.00 . A A . 2 ASN C 1 1 14 4299 1 1 21 TYR CA C -9.414 28.804 27.049 1.00 . A A . 2 ASN CA 1 1 14 4300 1 1 21 TYR CB C -10.313 30.026 26.852 1.00 . A A . 2 ASN CB 1 1 14 4301 1 1 21 TYR CG C -11.540 29.713 26.018 1.00 . A A . 2 ASN CG 1 1 14 4302 1 1 21 TYR H H -8.101 29.423 28.589 1.00 . A A . 2 ASN H 1 1 14 4303 1 1 21 TYR HA H -10.012 27.910 26.950 1.00 . A A . 2 ASN HA 1 1 14 4304 1 1 21 TYR HB2 H -10.639 30.385 27.817 1.00 . A A . 2 ASN HB2 1 1 14 4305 1 1 21 TYR HB3 H -9.750 30.803 26.355 1.00 . A A . 2 ASN HB3 1 1 14 4306 1 1 21 TYR N N -8.839 28.810 28.389 1.00 . A A . 2 ASN N 1 1 14 4307 1 1 21 TYR O O -8.380 29.524 25.003 1.00 . A A . 2 ASN O 1 1 14 4308 1 1 22 GLY C C -5.448 29.131 25.141 1.00 . A A . 3 TYR C 1 1 14 4309 1 1 22 GLY CA C -6.212 27.814 25.249 1.00 . A A . 3 TYR CA 1 1 14 4310 1 1 22 GLY H H -7.329 27.368 26.991 1.00 . A A . 3 TYR H 1 1 14 4311 1 1 22 GLY N N -7.321 27.931 26.190 1.00 . A A . 3 TYR N 1 1 14 4312 1 1 22 GLY O O -5.162 29.607 24.042 1.00 . A A . 3 TYR O 1 1 14 4313 1 1 23 ASN C C -3.006 30.844 25.706 1.00 . A A . 4 GLY C 1 1 14 4314 1 1 23 ASN CA C -4.395 30.972 26.301 1.00 . A A . 4 GLY CA 1 1 14 4315 1 1 23 ASN H H -5.376 29.291 27.134 1.00 . A A . 4 GLY H 1 1 14 4316 1 1 23 ASN N N -5.122 29.715 26.289 1.00 . A A . 4 GLY N 1 1 14 4317 1 1 23 ASN O O -2.471 31.803 25.151 1.00 . A A . 4 GLY O 1 1 14 4318 1 1 24 GLY C C -1.153 28.910 23.857 1.00 . A A . 5 ASN C 1 1 14 4319 1 1 24 GLY CA C -1.086 29.407 25.292 1.00 . A A . 5 ASN CA 1 1 14 4320 1 1 24 GLY H H -2.898 28.930 26.275 1.00 . A A . 5 ASN H 1 1 14 4321 1 1 24 GLY N N -2.421 29.656 25.822 1.00 . A A . 5 ASN N 1 1 14 4322 1 1 24 GLY O O -0.766 29.610 22.921 1.00 . A A . 5 ASN O 1 1 14 4323 1 1 25 VAL C C -0.516 26.368 21.954 1.00 . A A . 6 GLY C 1 1 14 4324 1 1 25 VAL CA C -1.772 27.105 22.378 1.00 . A A . 6 GLY CA 1 1 14 4325 1 1 25 VAL H H -1.939 27.200 24.486 1.00 . A A . 6 GLY H 1 1 14 4326 1 1 25 VAL N N -1.650 27.696 23.697 1.00 . A A . 6 GLY N 1 1 14 4327 1 1 25 VAL O O 0.472 26.987 21.559 1.00 . A A . 6 GLY O 1 1 14 4328 1 1 26 SER C C 0.946 24.432 20.188 1.00 . A A . 7 VAL C 1 1 14 4329 1 1 26 SER CA C 0.588 24.220 21.654 1.00 . A A . 7 VAL CA 1 1 14 4330 1 1 26 SER CB C 0.315 22.721 21.891 1.00 . A A . 7 VAL CB 1 1 14 4331 1 1 26 SER H H -1.371 24.606 22.356 1.00 . A A . 7 VAL H 1 1 14 4332 1 1 26 SER HA H 1.429 24.513 22.266 1.00 . A A . 7 VAL HA 1 1 14 4333 1 1 26 SER N N -0.554 25.042 22.035 1.00 . A A . 7 VAL N 1 1 14 4334 1 1 26 SER O O 0.138 24.937 19.409 1.00 . A A . 7 VAL O 1 1 14 4335 1 1 27 CYS C C 3.804 23.279 18.150 1.00 . A A . 8 SER C 1 1 14 4336 1 1 27 CYS CA C 2.622 24.198 18.441 1.00 . A A . 8 SER CA 1 1 14 4337 1 1 27 CYS CB C 3.013 25.654 18.176 1.00 . A A . 8 SER CB 1 1 14 4338 1 1 27 CYS H H 2.763 23.652 20.480 1.00 . A A . 8 SER H 1 1 14 4339 1 1 27 CYS HA H 1.805 23.932 17.788 1.00 . A A . 8 SER HA 1 1 14 4340 1 1 27 CYS HB2 H 2.760 26.253 19.038 1.00 . A A . 8 SER HB2 1 1 14 4341 1 1 27 CYS HB3 H 4.078 25.713 17.998 1.00 . A A . 8 SER HB3 1 1 14 4342 1 1 27 CYS N N 2.162 24.045 19.815 1.00 . A A . 8 SER N 1 1 14 4343 1 1 27 CYS O O 4.262 22.541 19.022 1.00 . A A . 8 SER O 1 1 14 4344 1 1 28 SER C C 6.646 22.786 17.366 1.00 . A A . 9 CYS C 1 1 14 4345 1 1 28 SER CA C 5.424 22.510 16.497 1.00 . A A . 9 CYS CA 1 1 14 4346 1 1 28 SER CB C 5.771 22.764 15.024 1.00 . A A . 9 CYS CB 1 1 14 4347 1 1 28 SER H H 3.882 23.943 16.270 1.00 . A A . 9 CYS H 1 1 14 4348 1 1 28 SER HA H 5.142 21.474 16.617 1.00 . A A . 9 CYS HA 1 1 14 4349 1 1 28 SER HB2 H 6.407 23.633 14.959 1.00 . A A . 9 CYS HB2 1 1 14 4350 1 1 28 SER HB3 H 6.305 21.907 14.638 1.00 . A A . 9 CYS HB3 1 1 14 4351 1 1 28 SER N N 4.293 23.333 16.915 1.00 . A A . 9 CYS N 1 1 14 4352 1 1 28 SER O O 7.202 23.884 17.342 1.00 . A A . 9 CYS O 1 1 14 4353 1 1 29 LYS C C 8.736 20.547 19.431 1.00 . A A . 10 SER C 1 1 14 4354 1 1 29 LYS CA C 8.217 21.915 19.007 1.00 . A A . 10 SER CA 1 1 14 4355 1 1 29 LYS CB C 7.860 22.742 20.243 1.00 . A A . 10 SER CB 1 1 14 4356 1 1 29 LYS H H 6.575 20.930 18.105 1.00 . A A . 10 SER H 1 1 14 4357 1 1 29 LYS HA H 8.992 22.426 18.455 1.00 . A A . 10 SER HA 1 1 14 4358 1 1 29 LYS HB2 H 7.478 22.088 21.013 1.00 . A A . 10 SER HB2 1 1 14 4359 1 1 29 LYS HB3 H 8.746 23.244 20.604 1.00 . A A . 10 SER HB3 1 1 14 4360 1 1 29 LYS N N 7.059 21.782 18.132 1.00 . A A . 10 SER N 1 1 14 4361 1 1 29 LYS O O 8.060 19.810 20.150 1.00 . A A . 10 SER O 1 1 14 4362 1 1 30 THR C C 9.741 17.756 18.829 1.00 . A A . 11 LYS C 1 1 14 4363 1 1 30 THR CA C 10.565 18.939 19.325 1.00 . A A . 11 LYS CA 1 1 14 4364 1 1 30 THR CB C 10.734 18.850 20.831 1.00 . A A . 11 LYS CB 1 1 14 4365 1 1 30 THR H H 10.436 20.848 18.430 1.00 . A A . 11 LYS H 1 1 14 4366 1 1 30 THR HA H 11.534 18.906 18.861 1.00 . A A . 11 LYS HA 1 1 14 4367 1 1 30 THR N N 9.945 20.216 18.987 1.00 . A A . 11 LYS N 1 1 14 4368 1 1 30 THR O O 10.005 16.610 19.196 1.00 . A A . 11 LYS O 1 1 14 4369 1 1 31 LYS C C 7.315 17.366 16.102 1.00 . A A . 12 THR C 1 1 14 4370 1 1 31 LYS CA C 7.879 16.993 17.482 1.00 . A A . 12 THR CA 1 1 14 4371 1 1 31 LYS CB C 6.761 16.710 18.495 1.00 . A A . 12 THR CB 1 1 14 4372 1 1 31 LYS H H 8.574 18.956 17.765 1.00 . A A . 12 THR H 1 1 14 4373 1 1 31 LYS HA H 8.478 16.107 17.375 1.00 . A A . 12 THR HA 1 1 14 4374 1 1 31 LYS N N 8.741 18.034 18.010 1.00 . A A . 12 THR N 1 1 14 4375 1 1 31 LYS O O 6.536 16.611 15.519 1.00 . A A . 12 THR O 1 1 14 4376 1 1 32 CYS C C 5.743 18.957 14.175 1.00 . A A . 13 LYS C 1 1 14 4377 1 1 32 CYS CA C 7.260 18.960 14.258 1.00 . A A . 13 LYS CA 1 1 14 4378 1 1 32 CYS CB C 7.827 18.050 13.192 1.00 . A A . 13 LYS CB 1 1 14 4379 1 1 32 CYS H H 8.356 19.078 16.060 1.00 . A A . 13 LYS H 1 1 14 4380 1 1 32 CYS HA H 7.615 19.964 14.100 1.00 . A A . 13 LYS HA 1 1 14 4381 1 1 32 CYS HB2 H 8.629 17.480 13.629 1.00 . A A . 13 LYS HB2 1 1 14 4382 1 1 32 CYS HB3 H 7.047 17.378 12.877 1.00 . A A . 13 LYS HB3 1 1 14 4383 1 1 32 CYS N N 7.723 18.520 15.571 1.00 . A A . 13 LYS N 1 1 14 4384 1 1 32 CYS O O 5.162 18.796 13.101 1.00 . A A . 13 LYS O 1 1 14 4385 1 1 33 SER C C 3.012 18.085 14.569 1.00 . A A . 14 CYS C 1 1 14 4386 1 1 33 SER CA C 3.665 19.150 15.447 1.00 . A A . 14 CYS CA 1 1 14 4387 1 1 33 SER CB C 3.106 20.534 15.093 1.00 . A A . 14 CYS CB 1 1 14 4388 1 1 33 SER H H 5.675 19.238 16.117 1.00 . A A . 14 CYS H 1 1 14 4389 1 1 33 SER HA H 3.426 18.938 16.479 1.00 . A A . 14 CYS HA 1 1 14 4390 1 1 33 SER HB2 H 2.029 20.477 15.061 1.00 . A A . 14 CYS HB2 1 1 14 4391 1 1 33 SER HB3 H 3.398 21.237 15.858 1.00 . A A . 14 CYS HB3 1 1 14 4392 1 1 33 SER N N 5.125 19.128 15.323 1.00 . A A . 14 CYS N 1 1 14 4393 1 1 33 SER O O 1.999 18.339 13.918 1.00 . A A . 14 CYS O 1 1 14 4394 1 1 34 VAL C C 3.388 14.445 14.390 1.00 . A A . 15 SER C 1 1 14 4395 1 1 34 VAL CA C 3.071 15.795 13.753 1.00 . A A . 15 SER CA 1 1 14 4396 1 1 34 VAL CB C 3.645 15.849 12.337 1.00 . A A . 15 SER CB 1 1 14 4397 1 1 34 VAL H H 4.405 16.748 15.093 1.00 . A A . 15 SER H 1 1 14 4398 1 1 34 VAL HA H 1.999 15.911 13.701 1.00 . A A . 15 SER HA 1 1 14 4399 1 1 34 VAL N N 3.599 16.892 14.554 1.00 . A A . 15 SER N 1 1 14 4400 1 1 34 VAL O O 4.252 14.342 15.261 1.00 . A A . 15 SER O 1 1 14 4401 1 1 35 ASN C C 4.302 11.577 14.192 1.00 . A A . 16 VAL C 1 1 14 4402 1 1 35 ASN CA C 2.874 12.063 14.462 1.00 . A A . 16 VAL CA 1 1 14 4403 1 1 35 ASN CB C 1.837 11.087 13.847 1.00 . A A . 16 VAL CB 1 1 14 4404 1 1 35 ASN H H 2.005 13.562 13.250 1.00 . A A . 16 VAL H 1 1 14 4405 1 1 35 ASN HA H 2.715 12.094 15.531 1.00 . A A . 16 VAL HA 1 1 14 4406 1 1 35 ASN N N 2.678 13.412 13.945 1.00 . A A . 16 VAL N 1 1 14 4407 1 1 35 ASN O O 5.185 12.374 13.875 1.00 . A A . 16 VAL O 1 1 14 4408 1 1 36 TRP C C 6.086 9.518 12.583 1.00 . A A . 17 ASN C 1 1 14 4409 1 1 36 TRP CA C 5.836 9.686 14.076 1.00 . A A . 17 ASN CA 1 1 14 4410 1 1 36 TRP CB C 5.951 8.333 14.784 1.00 . A A . 17 ASN CB 1 1 14 4411 1 1 36 TRP CG C 6.537 8.455 16.177 1.00 . A A . 17 ASN CG 1 1 14 4412 1 1 36 TRP H H 3.785 9.687 14.561 1.00 . A A . 17 ASN H 1 1 14 4413 1 1 36 TRP HA H 6.577 10.359 14.481 1.00 . A A . 17 ASN HA 1 1 14 4414 1 1 36 TRP HB2 H 4.969 7.892 14.864 1.00 . A A . 17 ASN HB2 1 1 14 4415 1 1 36 TRP HB3 H 6.586 7.682 14.202 1.00 . A A . 17 ASN HB3 1 1 14 4416 1 1 36 TRP N N 4.521 10.270 14.312 1.00 . A A . 17 ASN N 1 1 14 4417 1 1 36 TRP O O 6.371 8.420 12.103 1.00 . A A . 17 ASN O 1 1 14 4418 1 1 37 GLY C C 7.656 10.504 10.036 1.00 . A A . 18 TRP C 1 1 14 4419 1 1 37 GLY CA C 6.173 10.616 10.408 1.00 . A A . 18 TRP CA 1 1 14 4420 1 1 37 GLY H H 5.734 11.457 12.294 1.00 . A A . 18 TRP H 1 1 14 4421 1 1 37 GLY N N 5.971 10.620 11.851 1.00 . A A . 18 TRP N 1 1 14 4422 1 1 37 GLY O O 8.009 10.592 8.861 1.00 . A A . 18 TRP O 1 1 14 4423 1 1 38 GLN C C 10.455 8.782 10.979 1.00 . A A . 19 GLY C 1 1 14 4424 1 1 38 GLN CA C 9.941 10.195 10.767 1.00 . A A . 19 GLY CA 1 1 14 4425 1 1 38 GLN H H 8.192 10.252 11.953 1.00 . A A . 19 GLY H 1 1 14 4426 1 1 38 GLN N N 8.519 10.313 11.033 1.00 . A A . 19 GLY N 1 1 14 4427 1 1 38 GLN O O 11.016 8.173 10.066 1.00 . A A . 19 GLY O 1 1 14 4428 1 1 39 ALA C C 10.140 5.902 11.519 1.00 . A A . 20 GLN C 1 1 14 4429 1 1 39 ALA CA C 10.708 6.908 12.509 1.00 . A A . 20 GLN CA 1 1 14 4430 1 1 39 ALA CB C 10.298 6.536 13.936 1.00 . A A . 20 GLN CB 1 1 14 4431 1 1 39 ALA H H 9.807 8.789 12.872 1.00 . A A . 20 GLN H 1 1 14 4432 1 1 39 ALA HA H 11.787 6.887 12.434 1.00 . A A . 20 GLN HA 1 1 14 4433 1 1 39 ALA HB2 H 9.475 7.167 14.238 1.00 . A A . 20 GLN HB2 1 1 14 4434 1 1 39 ALA HB3 H 9.973 5.506 13.950 1.00 . A A . 20 GLN HB3 1 1 14 4435 1 1 39 ALA N N 10.262 8.258 12.185 1.00 . A A . 20 GLN N 1 1 14 4436 1 1 39 ALA O O 10.885 5.300 10.745 1.00 . A A . 20 GLN O 1 1 14 4437 1 1 40 PHE C C 8.361 5.220 9.161 1.00 . A A . 21 ALA C 1 1 14 4438 1 1 40 PHE CA C 8.199 4.783 10.602 1.00 . A A . 21 ALA CA 1 1 14 4439 1 1 40 PHE CB C 6.745 4.521 10.939 1.00 . A A . 21 ALA CB 1 1 14 4440 1 1 40 PHE H H 8.262 6.226 12.156 1.00 . A A . 21 ALA H 1 1 14 4441 1 1 40 PHE HA H 8.734 3.876 10.707 1.00 . A A . 21 ALA HA 1 1 14 4442 1 1 40 PHE HB2 H 6.122 5.248 10.438 1.00 . A A . 21 ALA HB2 1 1 14 4443 1 1 40 PHE HB3 H 6.602 4.593 12.006 1.00 . A A . 21 ALA HB3 1 1 14 4444 1 1 40 PHE N N 8.820 5.720 11.529 1.00 . A A . 21 ALA N 1 1 14 4445 1 1 40 PHE O O 8.016 4.492 8.229 1.00 . A A . 21 ALA O 1 1 14 4446 1 1 41 GLN C C 10.343 6.066 7.089 1.00 . A A . 22 PHE C 1 1 14 4447 1 1 41 GLN CA C 9.227 6.909 7.671 1.00 . A A . 22 PHE CA 1 1 14 4448 1 1 41 GLN CB C 9.645 8.378 7.741 1.00 . A A . 22 PHE CB 1 1 14 4449 1 1 41 GLN CG C 9.189 9.190 6.563 1.00 . A A . 22 PHE CG 1 1 14 4450 1 1 41 GLN H H 9.226 6.868 9.775 1.00 . A A . 22 PHE H 1 1 14 4451 1 1 41 GLN HA H 8.341 6.804 7.065 1.00 . A A . 22 PHE HA 1 1 14 4452 1 1 41 GLN HB2 H 9.228 8.820 8.631 1.00 . A A . 22 PHE HB2 1 1 14 4453 1 1 41 GLN HB3 H 10.722 8.435 7.788 1.00 . A A . 22 PHE HB3 1 1 14 4454 1 1 41 GLN N N 8.942 6.382 8.992 1.00 . A A . 22 PHE N 1 1 14 4455 1 1 41 GLN O O 10.325 5.686 5.919 1.00 . A A . 22 PHE O 1 1 14 4456 1 1 42 GLU C C 11.893 3.440 7.483 1.00 . A A . 23 GLN C 1 1 14 4457 1 1 42 GLU CA C 12.401 4.879 7.604 1.00 . A A . 23 GLN CA 1 1 14 4458 1 1 42 GLU CB C 13.499 4.983 8.671 1.00 . A A . 23 GLN CB 1 1 14 4459 1 1 42 GLU CD C 14.369 2.869 9.750 1.00 . A A . 23 GLN CD 1 1 14 4460 1 1 42 GLU CG C 14.527 3.862 8.616 1.00 . A A . 23 GLN CG 1 1 14 4461 1 1 42 GLU H H 11.210 6.045 8.889 1.00 . A A . 23 GLN H 1 1 14 4462 1 1 42 GLU HA H 12.789 5.204 6.649 1.00 . A A . 23 GLN HA 1 1 14 4463 1 1 42 GLU HB2 H 14.018 5.921 8.542 1.00 . A A . 23 GLN HB2 1 1 14 4464 1 1 42 GLU HB3 H 13.036 4.972 9.650 1.00 . A A . 23 GLN HB3 1 1 14 4465 1 1 42 GLU HG2 H 14.416 3.335 7.680 1.00 . A A . 23 GLN HG2 1 1 14 4466 1 1 42 GLU HG3 H 15.515 4.295 8.669 1.00 . A A . 23 GLN HG3 1 1 14 4467 1 1 42 GLU N N 11.288 5.733 7.961 1.00 . A A . 23 GLN N 1 1 14 4468 1 1 42 GLU O O 12.479 2.614 6.783 1.00 . A A . 23 GLN O 1 1 14 4469 1 1 42 GLU OE1 O 13.862 3.207 10.820 1.00 . A A . 23 GLN OE1 1 1 14 4470 1 1 43 ARG C C 9.402 1.626 6.851 1.00 . A A . 24 GLU C 1 1 14 4471 1 1 43 ARG CA C 10.158 1.851 8.156 1.00 . A A . 24 GLU CA 1 1 14 4472 1 1 43 ARG CB C 9.201 1.703 9.340 1.00 . A A . 24 GLU CB 1 1 14 4473 1 1 43 ARG CD C 8.963 1.337 11.828 1.00 . A A . 24 GLU CD 1 1 14 4474 1 1 43 ARG CG C 9.901 1.690 10.688 1.00 . A A . 24 GLU CG 1 1 14 4475 1 1 43 ARG H H 10.366 3.871 8.701 1.00 . A A . 24 GLU H 1 1 14 4476 1 1 43 ARG HA H 10.934 1.119 8.245 1.00 . A A . 24 GLU HA 1 1 14 4477 1 1 43 ARG HB2 H 8.502 2.526 9.327 1.00 . A A . 24 GLU HB2 1 1 14 4478 1 1 43 ARG HB3 H 8.655 0.777 9.232 1.00 . A A . 24 GLU HB3 1 1 14 4479 1 1 43 ARG HG2 H 10.697 0.962 10.661 1.00 . A A . 24 GLU HG2 1 1 14 4480 1 1 43 ARG HG3 H 10.317 2.670 10.874 1.00 . A A . 24 GLU HG3 1 1 14 4481 1 1 43 ARG N N 10.781 3.165 8.171 1.00 . A A . 24 GLU N 1 1 14 4482 1 1 43 ARG O O 9.539 0.583 6.211 1.00 . A A . 24 GLU O 1 1 14 4483 1 1 44 TYR C C 8.719 2.403 4.020 1.00 . A A . 25 ARG C 1 1 14 4484 1 1 44 TYR CA C 7.815 2.532 5.238 1.00 . A A . 25 ARG CA 1 1 14 4485 1 1 44 TYR CB C 6.910 3.764 5.106 1.00 . A A . 25 ARG CB 1 1 14 4486 1 1 44 TYR CG C 7.617 5.012 4.595 1.00 . A A . 25 ARG CG 1 1 14 4487 1 1 44 TYR CZ C 7.858 7.005 1.467 1.00 . A A . 25 ARG CZ 1 1 14 4488 1 1 44 TYR H H 8.533 3.419 7.020 1.00 . A A . 25 ARG H 1 1 14 4489 1 1 44 TYR HA H 7.200 1.652 5.303 1.00 . A A . 25 ARG HA 1 1 14 4490 1 1 44 TYR HB2 H 6.106 3.532 4.428 1.00 . A A . 25 ARG HB2 1 1 14 4491 1 1 44 TYR HB3 H 6.496 3.990 6.077 1.00 . A A . 25 ARG HB3 1 1 14 4492 1 1 44 TYR HD2 H 7.494 4.351 2.575 1.00 . A A . 25 ARG HD2 1 1 14 4493 1 1 44 TYR N N 8.600 2.614 6.464 1.00 . A A . 25 ARG N 1 1 14 4494 1 1 44 TYR O O 8.377 1.742 3.040 1.00 . A A . 25 ARG O 1 1 14 4495 1 1 45 THR C C 11.360 1.598 2.781 1.00 . A A . 26 TYR C 1 1 14 4496 1 1 45 THR CA C 10.843 3.014 3.012 1.00 . A A . 26 TYR CA 1 1 14 4497 1 1 45 THR CB C 12.012 3.953 3.322 1.00 . A A . 26 TYR CB 1 1 14 4498 1 1 45 THR H H 10.074 3.549 4.909 1.00 . A A . 26 TYR H 1 1 14 4499 1 1 45 THR HA H 10.348 3.355 2.116 1.00 . A A . 26 TYR HA 1 1 14 4500 1 1 45 THR N N 9.873 3.042 4.098 1.00 . A A . 26 TYR N 1 1 14 4501 1 1 45 THR O O 11.684 1.220 1.655 1.00 . A A . 26 TYR O 1 1 14 4502 1 1 46 ALA C C 10.921 -1.429 3.000 1.00 . A A . 27 THR C 1 1 14 4503 1 1 46 ALA CA C 11.910 -0.557 3.768 1.00 . A A . 27 THR CA 1 1 14 4504 1 1 46 ALA CB C 12.132 -1.129 5.169 1.00 . A A . 27 THR CB 1 1 14 4505 1 1 46 ALA H H 11.161 1.176 4.724 1.00 . A A . 27 THR H 1 1 14 4506 1 1 46 ALA HA H 12.851 -0.549 3.239 1.00 . A A . 27 THR HA 1 1 14 4507 1 1 46 ALA N N 11.433 0.818 3.853 1.00 . A A . 27 THR N 1 1 14 4508 1 1 46 ALA O O 11.316 -2.246 2.168 1.00 . A A . 27 THR O 1 1 14 4509 1 1 47 GLY C C 8.618 -1.801 1.110 1.00 . A A . 28 ALA C 1 1 14 4510 1 1 47 GLY CA C 8.591 -2.021 2.620 1.00 . A A . 28 ALA CA 1 1 14 4511 1 1 47 GLY H H 9.382 -0.583 3.957 1.00 . A A . 28 ALA H 1 1 14 4512 1 1 47 GLY N N 9.635 -1.250 3.284 1.00 . A A . 28 ALA N 1 1 14 4513 1 1 47 GLY O O 8.495 -2.748 0.333 1.00 . A A . 28 ALA O 1 1 14 4514 1 1 48 ILE C C 10.084 -0.714 -1.389 1.00 . A A . 29 GLY C 1 1 14 4515 1 1 48 ILE CA C 8.816 -0.227 -0.714 1.00 . A A . 29 GLY CA 1 1 14 4516 1 1 48 ILE H H 8.870 0.167 1.366 1.00 . A A . 29 GLY H 1 1 14 4517 1 1 48 ILE N N 8.778 -0.547 0.701 1.00 . A A . 29 GLY N 1 1 14 4518 1 1 48 ILE O O 10.027 -1.435 -2.385 1.00 . A A . 29 GLY O 1 1 14 4519 1 1 49 ASN C C 12.652 -2.238 -1.446 1.00 . A A . 30 ILE C 1 1 14 4520 1 1 49 ASN CA C 12.516 -0.717 -1.403 1.00 . A A . 30 ILE CA 1 1 14 4521 1 1 49 ASN CB C 13.688 -0.126 -0.593 1.00 . A A . 30 ILE CB 1 1 14 4522 1 1 49 ASN H H 11.209 0.256 -0.052 1.00 . A A . 30 ILE H 1 1 14 4523 1 1 49 ASN HA H 12.575 -0.333 -2.411 1.00 . A A . 30 ILE HA 1 1 14 4524 1 1 49 ASN N N 11.230 -0.318 -0.846 1.00 . A A . 30 ILE N 1 1 14 4525 1 1 49 ASN O O 13.395 -2.780 -2.264 1.00 . A A . 30 ILE O 1 1 14 4526 1 1 50 SER C C 11.709 -4.993 -1.879 1.00 . A A . 31 ASN C 1 1 14 4527 1 1 50 SER CA C 11.974 -4.381 -0.506 1.00 . A A . 31 ASN CA 1 1 14 4528 1 1 50 SER CB C 10.946 -4.905 0.501 1.00 . A A . 31 ASN CB 1 1 14 4529 1 1 50 SER H H 11.354 -2.436 0.063 1.00 . A A . 31 ASN H 1 1 14 4530 1 1 50 SER HA H 12.961 -4.670 -0.181 1.00 . A A . 31 ASN HA 1 1 14 4531 1 1 50 SER HB2 H 11.001 -4.313 1.403 1.00 . A A . 31 ASN HB2 1 1 14 4532 1 1 50 SER HB3 H 9.957 -4.817 0.076 1.00 . A A . 31 ASN HB3 1 1 14 4533 1 1 50 SER N N 11.930 -2.923 -0.563 1.00 . A A . 31 ASN N 1 1 14 4534 1 1 50 SER O O 12.593 -5.609 -2.474 1.00 . A A . 31 ASN O 1 1 14 4535 1 1 51 PHE C C 10.997 -4.763 -4.777 1.00 . A A . 32 SER C 1 1 14 4536 1 1 51 PHE CA C 10.114 -5.347 -3.680 1.00 . A A . 32 SER CA 1 1 14 4537 1 1 51 PHE CB C 8.644 -5.045 -3.975 1.00 . A A . 32 SER CB 1 1 14 4538 1 1 51 PHE H H 9.829 -4.312 -1.855 1.00 . A A . 32 SER H 1 1 14 4539 1 1 51 PHE HA H 10.255 -6.418 -3.654 1.00 . A A . 32 SER HA 1 1 14 4540 1 1 51 PHE HB2 H 8.474 -5.099 -5.039 1.00 . A A . 32 SER HB2 1 1 14 4541 1 1 51 PHE HB3 H 8.022 -5.772 -3.474 1.00 . A A . 32 SER HB3 1 1 14 4542 1 1 51 PHE N N 10.491 -4.814 -2.376 1.00 . A A . 32 SER N 1 1 14 4543 1 1 51 PHE O O 11.288 -5.424 -5.773 1.00 . A A . 32 SER O 1 1 14 4544 1 1 52 VAL C C 13.625 -3.527 -5.667 1.00 . A A . 33 PHE C 1 1 14 4545 1 1 52 VAL CA C 12.268 -2.839 -5.555 1.00 . A A . 33 PHE CA 1 1 14 4546 1 1 52 VAL CB C 12.455 -1.371 -5.161 1.00 . A A . 33 PHE CB 1 1 14 4547 1 1 52 VAL H H 11.152 -3.043 -3.771 1.00 . A A . 33 PHE H 1 1 14 4548 1 1 52 VAL HA H 11.775 -2.883 -6.513 1.00 . A A . 33 PHE HA 1 1 14 4549 1 1 52 VAL N N 11.418 -3.517 -4.585 1.00 . A A . 33 PHE N 1 1 14 4550 1 1 52 VAL O O 14.117 -3.776 -6.767 1.00 . A A . 33 PHE O 1 1 14 4551 1 1 53 SER C C 15.487 -5.821 -5.230 1.00 . A A . 34 VAL C 1 1 14 4552 1 1 53 SER CA C 15.527 -4.487 -4.491 1.00 . A A . 34 VAL CA 1 1 14 4553 1 1 53 SER CB C 16.013 -4.716 -3.044 1.00 . A A . 34 VAL CB 1 1 14 4554 1 1 53 SER H H 13.785 -3.606 -3.674 1.00 . A A . 34 VAL H 1 1 14 4555 1 1 53 SER HA H 16.237 -3.840 -4.991 1.00 . A A . 34 VAL HA 1 1 14 4556 1 1 53 SER N N 14.226 -3.830 -4.520 1.00 . A A . 34 VAL N 1 1 14 4557 1 1 53 SER O O 16.007 -5.932 -6.333 1.00 . A A . 34 VAL O 1 1 14 4558 1 1 54 GLY C C 14.371 -8.104 -6.654 1.00 . A A . 35 SER C 1 1 14 4559 1 1 54 GLY CA C 14.822 -8.153 -5.215 1.00 . A A . 35 SER CA 1 1 14 4560 1 1 54 GLY H H 14.519 -6.710 -3.726 1.00 . A A . 35 SER H 1 1 14 4561 1 1 54 GLY N N 14.888 -6.835 -4.615 1.00 . A A . 35 SER N 1 1 14 4562 1 1 54 GLY O O 14.846 -8.890 -7.474 1.00 . A A . 35 SER O 1 1 14 4563 1 1 55 VAL C C 14.373 -7.009 -9.222 1.00 . A A . 36 GLY C 1 1 14 4564 1 1 55 VAL CA C 13.119 -7.073 -8.378 1.00 . A A . 36 GLY CA 1 1 14 4565 1 1 55 VAL H H 13.184 -6.537 -6.326 1.00 . A A . 36 GLY H 1 1 14 4566 1 1 55 VAL N N 13.510 -7.172 -6.993 1.00 . A A . 36 GLY N 1 1 14 4567 1 1 55 VAL O O 14.544 -7.758 -10.184 1.00 . A A . 36 GLY O 1 1 14 4568 1 1 56 ALA C C 17.664 -6.768 -8.816 1.00 . A A . 37 VAL C 1 1 14 4569 1 1 56 ALA CA C 16.545 -5.918 -9.440 1.00 . A A . 37 VAL CA 1 1 14 4570 1 1 56 ALA CB C 16.955 -4.434 -9.370 1.00 . A A . 37 VAL CB 1 1 14 4571 1 1 56 ALA H H 15.060 -5.585 -8.017 1.00 . A A . 37 VAL H 1 1 14 4572 1 1 56 ALA HA H 16.440 -6.185 -10.475 1.00 . A A . 37 VAL HA 1 1 14 4573 1 1 56 ALA N N 15.263 -6.115 -8.807 1.00 . A A . 37 VAL N 1 1 14 4574 1 1 56 ALA O O 18.331 -7.546 -9.498 1.00 . A A . 37 VAL O 1 1 14 4575 1 1 57 SER C C 18.684 -8.560 -6.230 1.00 . A A . 38 ALA C 1 1 14 4576 1 1 57 SER CA C 18.980 -7.171 -6.773 1.00 . A A . 38 ALA CA 1 1 14 4577 1 1 57 SER CB C 19.383 -6.274 -5.609 1.00 . A A . 38 ALA CB 1 1 14 4578 1 1 57 SER H H 17.357 -5.874 -7.052 1.00 . A A . 38 ALA H 1 1 14 4579 1 1 57 SER HA H 19.823 -7.233 -7.431 1.00 . A A . 38 ALA HA 1 1 14 4580 1 1 57 SER HB2 H 18.863 -6.592 -4.709 1.00 . A A . 38 ALA HB2 1 1 14 4581 1 1 57 SER HB3 H 19.118 -5.252 -5.835 1.00 . A A . 38 ALA HB3 1 1 14 4582 1 1 57 SER N N 17.904 -6.532 -7.520 1.00 . A A . 38 ALA N 1 1 14 4583 1 1 57 SER O O 19.253 -9.561 -6.668 1.00 . A A . 38 ALA O 1 1 14 4584 1 1 58 GLY C C 16.850 -10.859 -5.302 1.00 . A A . 39 SER C 1 1 14 4585 1 1 58 GLY CA C 17.539 -9.784 -4.459 1.00 . A A . 39 SER CA 1 1 14 4586 1 1 58 GLY H H 17.507 -7.721 -4.869 1.00 . A A . 39 SER H 1 1 14 4587 1 1 58 GLY N N 17.862 -8.574 -5.194 1.00 . A A . 39 SER N 1 1 14 4588 1 1 58 GLY O O 16.783 -12.017 -4.891 1.00 . A A . 39 SER O 1 1 14 4589 1 1 59 ALA C C 14.508 -12.107 -6.694 1.00 . A A . 40 GLY C 1 1 14 4590 1 1 59 ALA CA C 15.715 -11.467 -7.343 1.00 . A A . 40 GLY CA 1 1 14 4591 1 1 59 ALA H H 16.442 -9.563 -6.772 1.00 . A A . 40 GLY H 1 1 14 4592 1 1 59 ALA N N 16.361 -10.493 -6.480 1.00 . A A . 40 GLY N 1 1 14 4593 1 1 59 ALA O O 14.452 -13.325 -6.526 1.00 . A A . 40 GLY O 1 1 14 4594 1 1 60 GLY C C 11.236 -10.686 -5.730 1.00 . A A . 41 ALA C 1 1 14 4595 1 1 60 GLY CA C 12.325 -11.752 -5.695 1.00 . A A . 41 ALA CA 1 1 14 4596 1 1 60 GLY H H 13.659 -10.324 -6.493 1.00 . A A . 41 ALA H 1 1 14 4597 1 1 60 GLY N N 13.545 -11.278 -6.329 1.00 . A A . 41 ALA N 1 1 14 4598 1 1 60 GLY O O 10.527 -10.474 -4.746 1.00 . A A . 41 ALA O 1 1 14 4599 1 1 61 SER C C 8.997 -9.377 -7.980 1.00 . A A . 42 GLY C 1 1 14 4600 1 1 61 SER CA C 10.099 -8.983 -7.015 1.00 . A A . 42 GLY CA 1 1 14 4601 1 1 61 SER H H 11.699 -10.230 -7.623 1.00 . A A . 42 GLY H 1 1 14 4602 1 1 61 SER N N 11.106 -10.017 -6.872 1.00 . A A . 42 GLY N 1 1 14 4603 1 1 61 SER O O 7.863 -8.917 -7.858 1.00 . A A . 42 GLY O 1 1 14 4604 1 1 62 ILE C C 8.719 -12.088 -10.432 1.00 . A A . 43 SER C 1 1 14 4605 1 1 62 ILE CA C 8.366 -10.690 -9.930 1.00 . A A . 43 SER CA 1 1 14 4606 1 1 62 ILE CB C 8.307 -9.714 -11.106 1.00 . A A . 43 SER CB 1 1 14 4607 1 1 62 ILE H H 10.255 -10.564 -8.984 1.00 . A A . 43 SER H 1 1 14 4608 1 1 62 ILE HA H 7.397 -10.727 -9.455 1.00 . A A . 43 SER HA 1 1 14 4609 1 1 62 ILE N N 9.334 -10.232 -8.940 1.00 . A A . 43 SER N 1 1 14 4610 1 1 62 ILE O O 8.448 -12.433 -11.582 1.00 . A A . 43 SER O 1 1 14 4611 1 1 63 GLY C C 9.008 -15.268 -9.023 1.00 . A A . 44 ILE C 1 1 14 4612 1 1 63 GLY CA C 9.716 -14.248 -9.912 1.00 . A A . 44 ILE CA 1 1 14 4613 1 1 63 GLY H H 9.514 -12.555 -8.657 1.00 . A A . 44 ILE H 1 1 14 4614 1 1 63 GLY N N 9.325 -12.887 -9.560 1.00 . A A . 44 ILE N 1 1 14 4615 1 1 63 GLY O O 9.644 -16.131 -8.418 1.00 . A A . 44 ILE O 1 1 14 4616 1 1 64 ARG C C 5.800 -16.755 -8.912 1.00 . A A . 45 GLY C 1 1 14 4617 1 1 64 ARG CA C 6.910 -16.078 -8.132 1.00 . A A . 45 GLY CA 1 1 14 4618 1 1 64 ARG H H 7.231 -14.454 -9.452 1.00 . A A . 45 GLY H 1 1 14 4619 1 1 64 ARG N N 7.684 -15.161 -8.949 1.00 . A A . 45 GLY N 1 1 14 4620 1 1 64 ARG O O 5.538 -17.944 -8.727 1.00 . A A . 45 GLY O 1 1 15 4621 1 1 20 ASN C C 13.632 13.353 26.858 1.00 . A A . 1 VAL C 1 1 15 4622 1 1 20 ASN CA C 13.576 14.593 25.972 1.00 . A A . 1 VAL CA 1 1 15 4623 1 1 20 ASN CB C 14.817 14.622 25.059 1.00 . A A . 1 VAL CB 1 1 15 4624 1 1 20 ASN H H 14.284 16.344 26.929 1.00 . A A . 1 VAL H 1 1 15 4625 1 1 20 ASN HA H 12.696 14.538 25.347 1.00 . A A . 1 VAL HA 1 1 15 4626 1 1 20 ASN N N 13.478 15.807 26.775 1.00 . A A . 1 VAL N 1 1 15 4627 1 1 20 ASN O O 14.605 13.136 27.579 1.00 . A A . 1 VAL O 1 1 15 4628 1 1 21 TYR C C 11.463 10.365 27.024 1.00 . A A . 2 ASN C 1 1 15 4629 1 1 21 TYR CA C 12.510 11.320 27.590 1.00 . A A . 2 ASN CA 1 1 15 4630 1 1 21 TYR CB C 12.183 11.654 29.048 1.00 . A A . 2 ASN CB 1 1 15 4631 1 1 21 TYR CG C 13.425 11.737 29.914 1.00 . A A . 2 ASN CG 1 1 15 4632 1 1 21 TYR H H 11.837 12.767 26.201 1.00 . A A . 2 ASN H 1 1 15 4633 1 1 21 TYR HA H 13.476 10.841 27.548 1.00 . A A . 2 ASN HA 1 1 15 4634 1 1 21 TYR HB2 H 11.676 12.606 29.088 1.00 . A A . 2 ASN HB2 1 1 15 4635 1 1 21 TYR HB3 H 11.536 10.888 29.451 1.00 . A A . 2 ASN HB3 1 1 15 4636 1 1 21 TYR N N 12.581 12.540 26.795 1.00 . A A . 2 ASN N 1 1 15 4637 1 1 21 TYR O O 10.413 10.148 27.630 1.00 . A A . 2 ASN O 1 1 15 4638 1 1 22 GLY C C 9.502 9.535 24.917 1.00 . A A . 3 TYR C 1 1 15 4639 1 1 22 GLY CA C 10.841 8.866 25.210 1.00 . A A . 3 TYR CA 1 1 15 4640 1 1 22 GLY H H 12.609 10.010 25.425 1.00 . A A . 3 TYR H 1 1 15 4641 1 1 22 GLY N N 11.757 9.798 25.859 1.00 . A A . 3 TYR N 1 1 15 4642 1 1 22 GLY O O 8.443 8.930 25.089 1.00 . A A . 3 TYR O 1 1 15 4643 1 1 23 ASN C C 8.337 12.065 22.749 1.00 . A A . 4 GLY C 1 1 15 4644 1 1 23 ASN CA C 8.340 11.516 24.163 1.00 . A A . 4 GLY CA 1 1 15 4645 1 1 23 ASN H H 10.427 11.217 24.354 1.00 . A A . 4 GLY H 1 1 15 4646 1 1 23 ASN N N 9.555 10.786 24.472 1.00 . A A . 4 GLY N 1 1 15 4647 1 1 23 ASN O O 8.131 11.324 21.788 1.00 . A A . 4 GLY O 1 1 15 4648 1 1 24 GLY C C 7.259 13.952 20.607 1.00 . A A . 5 ASN C 1 1 15 4649 1 1 24 GLY CA C 8.610 14.021 21.319 1.00 . A A . 5 ASN CA 1 1 15 4650 1 1 24 GLY H H 8.745 13.902 23.421 1.00 . A A . 5 ASN H 1 1 15 4651 1 1 24 GLY N N 8.577 13.369 22.622 1.00 . A A . 5 ASN N 1 1 15 4652 1 1 24 GLY O O 7.143 14.343 19.445 1.00 . A A . 5 ASN O 1 1 15 4653 1 1 25 VAL C C 3.845 13.054 21.736 1.00 . A A . 6 GLY C 1 1 15 4654 1 1 25 VAL CA C 4.922 13.348 20.709 1.00 . A A . 6 GLY CA 1 1 15 4655 1 1 25 VAL H H 6.388 13.159 22.218 1.00 . A A . 6 GLY H 1 1 15 4656 1 1 25 VAL N N 6.242 13.455 21.301 1.00 . A A . 6 GLY N 1 1 15 4657 1 1 25 VAL O O 3.199 12.008 21.681 1.00 . A A . 6 GLY O 1 1 15 4658 1 1 26 SER C C 2.600 12.412 24.275 1.00 . A A . 7 VAL C 1 1 15 4659 1 1 26 SER CA C 2.650 13.841 23.727 1.00 . A A . 7 VAL CA 1 1 15 4660 1 1 26 SER CB C 1.251 14.283 23.225 1.00 . A A . 7 VAL CB 1 1 15 4661 1 1 26 SER H H 4.203 14.795 22.652 1.00 . A A . 7 VAL H 1 1 15 4662 1 1 26 SER HA H 2.934 14.501 24.534 1.00 . A A . 7 VAL HA 1 1 15 4663 1 1 26 SER N N 3.655 13.984 22.672 1.00 . A A . 7 VAL N 1 1 15 4664 1 1 26 SER O O 3.540 11.636 24.097 1.00 . A A . 7 VAL O 1 1 15 4665 1 1 27 CYS C C -0.143 10.347 25.521 1.00 . A A . 8 SER C 1 1 15 4666 1 1 27 CYS CA C 1.328 10.747 25.511 1.00 . A A . 8 SER CA 1 1 15 4667 1 1 27 CYS CB C 1.890 10.705 26.933 1.00 . A A . 8 SER CB 1 1 15 4668 1 1 27 CYS H H 0.792 12.740 25.043 1.00 . A A . 8 SER H 1 1 15 4669 1 1 27 CYS HA H 1.876 10.048 24.897 1.00 . A A . 8 SER HA 1 1 15 4670 1 1 27 CYS HB2 H 1.516 11.549 27.492 1.00 . A A . 8 SER HB2 1 1 15 4671 1 1 27 CYS HB3 H 1.580 9.789 27.413 1.00 . A A . 8 SER HB3 1 1 15 4672 1 1 27 CYS N N 1.502 12.077 24.938 1.00 . A A . 8 SER N 1 1 15 4673 1 1 27 CYS O O -1.011 11.144 25.877 1.00 . A A . 8 SER O 1 1 15 4674 1 1 28 SER C C -2.391 8.574 26.487 1.00 . A A . 9 CYS C 1 1 15 4675 1 1 28 SER CA C -1.784 8.602 25.089 1.00 . A A . 9 CYS CA 1 1 15 4676 1 1 28 SER CB C -1.817 7.198 24.484 1.00 . A A . 9 CYS CB 1 1 15 4677 1 1 28 SER H H 0.318 8.519 24.853 1.00 . A A . 9 CYS H 1 1 15 4678 1 1 28 SER HA H -2.367 9.266 24.468 1.00 . A A . 9 CYS HA 1 1 15 4679 1 1 28 SER HB2 H -1.341 6.509 25.166 1.00 . A A . 9 CYS HB2 1 1 15 4680 1 1 28 SER HB3 H -2.845 6.901 24.338 1.00 . A A . 9 CYS HB3 1 1 15 4681 1 1 28 SER N N -0.416 9.108 25.126 1.00 . A A . 9 CYS N 1 1 15 4682 1 1 28 SER O O -1.936 7.831 27.357 1.00 . A A . 9 CYS O 1 1 15 4683 1 1 29 LYS C C -5.405 10.214 27.902 1.00 . A A . 10 SER C 1 1 15 4684 1 1 29 LYS CA C -4.091 9.445 27.994 1.00 . A A . 10 SER CA 1 1 15 4685 1 1 29 LYS CB C -3.185 10.095 29.036 1.00 . A A . 10 SER CB 1 1 15 4686 1 1 29 LYS H H -3.743 9.952 25.965 1.00 . A A . 10 SER H 1 1 15 4687 1 1 29 LYS HA H -4.305 8.432 28.301 1.00 . A A . 10 SER HA 1 1 15 4688 1 1 29 LYS HB2 H -3.760 10.308 29.924 1.00 . A A . 10 SER HB2 1 1 15 4689 1 1 29 LYS HB3 H -2.379 9.419 29.282 1.00 . A A . 10 SER HB3 1 1 15 4690 1 1 29 LYS N N -3.423 9.385 26.698 1.00 . A A . 10 SER N 1 1 15 4691 1 1 29 LYS O O -5.414 11.429 27.703 1.00 . A A . 10 SER O 1 1 15 4692 1 1 30 THR C C -8.111 10.787 26.666 1.00 . A A . 11 LYS C 1 1 15 4693 1 1 30 THR CA C -7.841 10.092 28.000 1.00 . A A . 11 LYS CA 1 1 15 4694 1 1 30 THR CB C -7.998 11.085 29.143 1.00 . A A . 11 LYS CB 1 1 15 4695 1 1 30 THR H H -6.431 8.535 28.222 1.00 . A A . 11 LYS H 1 1 15 4696 1 1 30 THR HA H -8.561 9.304 28.125 1.00 . A A . 11 LYS HA 1 1 15 4697 1 1 30 THR N N -6.511 9.493 28.055 1.00 . A A . 11 LYS N 1 1 15 4698 1 1 30 THR O O -9.168 11.390 26.478 1.00 . A A . 11 LYS O 1 1 15 4699 1 1 31 LYS C C -6.482 10.562 23.404 1.00 . A A . 12 THR C 1 1 15 4700 1 1 31 LYS CA C -7.300 11.325 24.444 1.00 . A A . 12 THR CA 1 1 15 4701 1 1 31 LYS CB C -6.874 12.796 24.538 1.00 . A A . 12 THR CB 1 1 15 4702 1 1 31 LYS H H -6.346 10.214 25.943 1.00 . A A . 12 THR H 1 1 15 4703 1 1 31 LYS HA H -8.338 11.278 24.170 1.00 . A A . 12 THR HA 1 1 15 4704 1 1 31 LYS N N -7.159 10.704 25.746 1.00 . A A . 12 THR N 1 1 15 4705 1 1 31 LYS O O -5.641 9.733 23.754 1.00 . A A . 12 THR O 1 1 15 4706 1 1 32 CYS C C -4.491 10.325 21.249 1.00 . A A . 13 LYS C 1 1 15 4707 1 1 32 CYS CA C -5.999 10.187 21.049 1.00 . A A . 13 LYS CA 1 1 15 4708 1 1 32 CYS CB C -6.403 10.778 19.697 1.00 . A A . 13 LYS CB 1 1 15 4709 1 1 32 CYS H H -7.404 11.519 21.908 1.00 . A A . 13 LYS H 1 1 15 4710 1 1 32 CYS HA H -6.258 9.140 21.067 1.00 . A A . 13 LYS HA 1 1 15 4711 1 1 32 CYS HB2 H -6.677 11.814 19.837 1.00 . A A . 13 LYS HB2 1 1 15 4712 1 1 32 CYS HB3 H -5.558 10.726 19.027 1.00 . A A . 13 LYS HB3 1 1 15 4713 1 1 32 CYS N N -6.725 10.848 22.128 1.00 . A A . 13 LYS N 1 1 15 4714 1 1 32 CYS O O -4.036 10.865 22.258 1.00 . A A . 13 LYS O 1 1 15 4715 1 1 33 SER C C -1.798 10.748 19.171 1.00 . A A . 14 CYS C 1 1 15 4716 1 1 33 SER CA C -2.292 9.902 20.338 1.00 . A A . 14 CYS CA 1 1 15 4717 1 1 33 SER CB C -1.703 8.487 20.309 1.00 . A A . 14 CYS CB 1 1 15 4718 1 1 33 SER H H -4.117 9.423 19.500 1.00 . A A . 14 CYS H 1 1 15 4719 1 1 33 SER HA H -2.014 10.384 21.267 1.00 . A A . 14 CYS HA 1 1 15 4720 1 1 33 SER HB2 H -1.850 8.062 19.327 1.00 . A A . 14 CYS HB2 1 1 15 4721 1 1 33 SER HB3 H -0.644 8.541 20.518 1.00 . A A . 14 CYS HB3 1 1 15 4722 1 1 33 SER N N -3.719 9.839 20.284 1.00 . A A . 14 CYS N 1 1 15 4723 1 1 33 SER O O -2.356 11.804 18.873 1.00 . A A . 14 CYS O 1 1 15 4724 1 1 34 VAL C C 0.237 9.983 16.297 1.00 . A A . 15 SER C 1 1 15 4725 1 1 34 VAL CA C -0.173 10.971 17.383 1.00 . A A . 15 SER CA 1 1 15 4726 1 1 34 VAL CB C 1.040 11.791 17.830 1.00 . A A . 15 SER CB 1 1 15 4727 1 1 34 VAL H H -0.393 9.428 18.809 1.00 . A A . 15 SER H 1 1 15 4728 1 1 34 VAL HA H -0.920 11.640 16.982 1.00 . A A . 15 SER HA 1 1 15 4729 1 1 34 VAL N N -0.760 10.276 18.523 1.00 . A A . 15 SER N 1 1 15 4730 1 1 34 VAL O O 0.299 8.776 16.532 1.00 . A A . 15 SER O 1 1 15 4731 1 1 35 ASN C C 2.432 9.474 13.954 1.00 . A A . 16 VAL C 1 1 15 4732 1 1 35 ASN CA C 0.919 9.664 13.982 1.00 . A A . 16 VAL CA 1 1 15 4733 1 1 35 ASN CB C 0.463 10.264 12.639 1.00 . A A . 16 VAL CB 1 1 15 4734 1 1 35 ASN H H 0.448 11.470 14.978 1.00 . A A . 16 VAL H 1 1 15 4735 1 1 35 ASN HA H 0.447 8.699 14.100 1.00 . A A . 16 VAL HA 1 1 15 4736 1 1 35 ASN N N 0.515 10.501 15.106 1.00 . A A . 16 VAL N 1 1 15 4737 1 1 35 ASN O O 3.184 10.315 14.446 1.00 . A A . 16 VAL O 1 1 15 4738 1 1 36 TRP C C 4.847 8.496 11.921 1.00 . A A . 17 ASN C 1 1 15 4739 1 1 36 TRP CA C 4.295 8.061 13.275 1.00 . A A . 17 ASN CA 1 1 15 4740 1 1 36 TRP CB C 4.537 6.565 13.485 1.00 . A A . 17 ASN CB 1 1 15 4741 1 1 36 TRP CG C 4.044 6.085 14.837 1.00 . A A . 17 ASN CG 1 1 15 4742 1 1 36 TRP H H 2.224 7.732 12.997 1.00 . A A . 17 ASN H 1 1 15 4743 1 1 36 TRP HA H 4.805 8.612 14.052 1.00 . A A . 17 ASN HA 1 1 15 4744 1 1 36 TRP HB2 H 4.018 6.011 12.717 1.00 . A A . 17 ASN HB2 1 1 15 4745 1 1 36 TRP HB3 H 5.596 6.364 13.416 1.00 . A A . 17 ASN HB3 1 1 15 4746 1 1 36 TRP N N 2.872 8.362 13.372 1.00 . A A . 17 ASN N 1 1 15 4747 1 1 36 TRP O O 5.391 7.687 11.169 1.00 . A A . 17 ASN O 1 1 15 4748 1 1 37 GLY C C 6.695 10.266 10.249 1.00 . A A . 18 TRP C 1 1 15 4749 1 1 37 GLY CA C 5.172 10.330 10.352 1.00 . A A . 18 TRP CA 1 1 15 4750 1 1 37 GLY H H 4.251 10.373 12.256 1.00 . A A . 18 TRP H 1 1 15 4751 1 1 37 GLY N N 4.697 9.781 11.617 1.00 . A A . 18 TRP N 1 1 15 4752 1 1 37 GLY O O 7.257 10.457 9.170 1.00 . A A . 18 TRP O 1 1 15 4753 1 1 38 GLN C C 9.302 8.484 11.462 1.00 . A A . 19 GLY C 1 1 15 4754 1 1 38 GLN CA C 8.811 9.915 11.368 1.00 . A A . 19 GLY CA 1 1 15 4755 1 1 38 GLN H H 6.868 9.856 12.203 1.00 . A A . 19 GLY H 1 1 15 4756 1 1 38 GLN N N 7.361 9.999 11.370 1.00 . A A . 19 GLY N 1 1 15 4757 1 1 38 GLN O O 9.997 7.993 10.568 1.00 . A A . 19 GLY O 1 1 15 4758 1 1 39 ALA C C 8.918 5.562 11.566 1.00 . A A . 20 GLN C 1 1 15 4759 1 1 39 ALA CA C 9.340 6.422 12.748 1.00 . A A . 20 GLN CA 1 1 15 4760 1 1 39 ALA CB C 8.737 5.871 14.041 1.00 . A A . 20 GLN CB 1 1 15 4761 1 1 39 ALA H H 8.378 8.248 13.220 1.00 . A A . 20 GLN H 1 1 15 4762 1 1 39 ALA HA H 10.419 6.397 12.822 1.00 . A A . 20 GLN HA 1 1 15 4763 1 1 39 ALA HB2 H 8.569 6.691 14.725 1.00 . A A . 20 GLN HB2 1 1 15 4764 1 1 39 ALA HB3 H 7.790 5.404 13.813 1.00 . A A . 20 GLN HB3 1 1 15 4765 1 1 39 ALA N N 8.936 7.807 12.545 1.00 . A A . 20 GLN N 1 1 15 4766 1 1 39 ALA O O 9.766 5.018 10.858 1.00 . A A . 20 GLN O 1 1 15 4767 1 1 40 PHE C C 7.530 5.235 8.884 1.00 . A A . 21 ALA C 1 1 15 4768 1 1 40 PHE CA C 7.125 4.647 10.221 1.00 . A A . 21 ALA CA 1 1 15 4769 1 1 40 PHE CB C 5.629 4.413 10.292 1.00 . A A . 21 ALA CB 1 1 15 4770 1 1 40 PHE H H 6.970 5.903 11.924 1.00 . A A . 21 ALA H 1 1 15 4771 1 1 40 PHE HA H 7.611 3.712 10.301 1.00 . A A . 21 ALA HA 1 1 15 4772 1 1 40 PHE HB2 H 5.308 4.443 11.322 1.00 . A A . 21 ALA HB2 1 1 15 4773 1 1 40 PHE HB3 H 5.404 3.443 9.870 1.00 . A A . 21 ALA HB3 1 1 15 4774 1 1 40 PHE N N 7.609 5.444 11.339 1.00 . A A . 21 ALA N 1 1 15 4775 1 1 40 PHE O O 7.322 4.634 7.831 1.00 . A A . 21 ALA O 1 1 15 4776 1 1 41 GLN C C 9.847 6.241 7.275 1.00 . A A . 22 PHE C 1 1 15 4777 1 1 41 GLN CA C 8.659 7.044 7.760 1.00 . A A . 22 PHE CA 1 1 15 4778 1 1 41 GLN CB C 9.070 8.486 8.063 1.00 . A A . 22 PHE CB 1 1 15 4779 1 1 41 GLN CG C 8.629 9.471 7.018 1.00 . A A . 22 PHE CG 1 1 15 4780 1 1 41 GLN H H 8.316 6.768 9.817 1.00 . A A . 22 PHE H 1 1 15 4781 1 1 41 GLN HA H 7.884 7.032 7.010 1.00 . A A . 22 PHE HA 1 1 15 4782 1 1 41 GLN HB2 H 8.636 8.785 9.005 1.00 . A A . 22 PHE HB2 1 1 15 4783 1 1 41 GLN HB3 H 10.146 8.538 8.137 1.00 . A A . 22 PHE HB3 1 1 15 4784 1 1 41 GLN N N 8.154 6.384 8.948 1.00 . A A . 22 PHE N 1 1 15 4785 1 1 41 GLN O O 10.014 5.986 6.082 1.00 . A A . 22 PHE O 1 1 15 4786 1 1 42 GLU C C 11.330 3.542 7.679 1.00 . A A . 23 GLN C 1 1 15 4787 1 1 42 GLU CA C 11.797 4.968 7.980 1.00 . A A . 23 GLN CA 1 1 15 4788 1 1 42 GLU CB C 12.738 4.982 9.191 1.00 . A A . 23 GLN CB 1 1 15 4789 1 1 42 GLU CD C 15.142 4.398 9.706 1.00 . A A . 23 GLN CD 1 1 15 4790 1 1 42 GLU CG C 13.819 3.913 9.148 1.00 . A A . 23 GLN CG 1 1 15 4791 1 1 42 GLU H H 10.418 6.019 9.177 1.00 . A A . 23 GLN H 1 1 15 4792 1 1 42 GLU HA H 12.313 5.365 7.118 1.00 . A A . 23 GLN HA 1 1 15 4793 1 1 42 GLU HB2 H 13.221 5.947 9.243 1.00 . A A . 23 GLN HB2 1 1 15 4794 1 1 42 GLU HB3 H 12.152 4.838 10.091 1.00 . A A . 23 GLN HB3 1 1 15 4795 1 1 42 GLU HG2 H 13.491 3.064 9.729 1.00 . A A . 23 GLN HG2 1 1 15 4796 1 1 42 GLU HG3 H 13.967 3.610 8.121 1.00 . A A . 23 GLN HG3 1 1 15 4797 1 1 42 GLU N N 10.642 5.801 8.245 1.00 . A A . 23 GLN N 1 1 15 4798 1 1 42 GLU O O 12.038 2.763 7.041 1.00 . A A . 23 GLN O 1 1 15 4799 1 1 42 GLU OE1 O 15.861 5.159 9.059 1.00 . A A . 23 GLN OE1 1 1 15 4800 1 1 43 ARG C C 9.202 1.687 6.454 1.00 . A A . 24 GLU C 1 1 15 4801 1 1 43 ARG CA C 9.531 1.902 7.928 1.00 . A A . 24 GLU CA 1 1 15 4802 1 1 43 ARG CB C 8.264 1.737 8.768 1.00 . A A . 24 GLU CB 1 1 15 4803 1 1 43 ARG CD C 7.274 1.214 11.032 1.00 . A A . 24 GLU CD 1 1 15 4804 1 1 43 ARG CG C 8.541 1.451 10.235 1.00 . A A . 24 GLU CG 1 1 15 4805 1 1 43 ARG H H 9.604 3.886 8.638 1.00 . A A . 24 GLU H 1 1 15 4806 1 1 43 ARG HA H 10.249 1.167 8.238 1.00 . A A . 24 GLU HA 1 1 15 4807 1 1 43 ARG HB2 H 7.683 2.643 8.703 1.00 . A A . 24 GLU HB2 1 1 15 4808 1 1 43 ARG HB3 H 7.684 0.918 8.368 1.00 . A A . 24 GLU HB3 1 1 15 4809 1 1 43 ARG HG2 H 9.162 0.570 10.307 1.00 . A A . 24 GLU HG2 1 1 15 4810 1 1 43 ARG HG3 H 9.065 2.295 10.661 1.00 . A A . 24 GLU HG3 1 1 15 4811 1 1 43 ARG N N 10.118 3.218 8.142 1.00 . A A . 24 GLU N 1 1 15 4812 1 1 43 ARG O O 9.679 0.740 5.831 1.00 . A A . 24 GLU O 1 1 15 4813 1 1 44 TYR C C 9.185 2.534 3.585 1.00 . A A . 25 ARG C 1 1 15 4814 1 1 44 TYR CA C 7.974 2.490 4.508 1.00 . A A . 25 ARG CA 1 1 15 4815 1 1 44 TYR CB C 7.014 3.629 4.163 1.00 . A A . 25 ARG CB 1 1 15 4816 1 1 44 TYR CG C 5.566 3.335 4.523 1.00 . A A . 25 ARG CG 1 1 15 4817 1 1 44 TYR CZ C 2.389 3.585 4.519 1.00 . A A . 25 ARG CZ 1 1 15 4818 1 1 44 TYR H H 8.029 3.307 6.460 1.00 . A A . 25 ARG H 1 1 15 4819 1 1 44 TYR HA H 7.469 1.551 4.369 1.00 . A A . 25 ARG HA 1 1 15 4820 1 1 44 TYR HB2 H 7.320 4.518 4.696 1.00 . A A . 25 ARG HB2 1 1 15 4821 1 1 44 TYR HB3 H 7.067 3.820 3.101 1.00 . A A . 25 ARG HB3 1 1 15 4822 1 1 44 TYR HD2 H 5.139 5.414 4.347 1.00 . A A . 25 ARG HD2 1 1 15 4823 1 1 44 TYR N N 8.377 2.576 5.907 1.00 . A A . 25 ARG N 1 1 15 4824 1 1 44 TYR O O 9.160 1.982 2.484 1.00 . A A . 25 ARG O 1 1 15 4825 1 1 45 THR C C 12.134 1.949 3.095 1.00 . A A . 26 TYR C 1 1 15 4826 1 1 45 THR CA C 11.464 3.309 3.260 1.00 . A A . 26 TYR CA 1 1 15 4827 1 1 45 THR CB C 12.428 4.295 3.924 1.00 . A A . 26 TYR CB 1 1 15 4828 1 1 45 THR H H 10.195 3.607 4.924 1.00 . A A . 26 TYR H 1 1 15 4829 1 1 45 THR HA H 11.196 3.685 2.285 1.00 . A A . 26 TYR HA 1 1 15 4830 1 1 45 THR N N 10.241 3.191 4.041 1.00 . A A . 26 TYR N 1 1 15 4831 1 1 45 THR O O 12.613 1.608 2.014 1.00 . A A . 26 TYR O 1 1 15 4832 1 1 46 ALA C C 11.945 -1.111 3.303 1.00 . A A . 27 THR C 1 1 15 4833 1 1 46 ALA CA C 12.771 -0.148 4.152 1.00 . A A . 27 THR CA 1 1 15 4834 1 1 46 ALA CB C 12.910 -0.694 5.574 1.00 . A A . 27 THR CB 1 1 15 4835 1 1 46 ALA H H 11.761 1.503 5.008 1.00 . A A . 27 THR H 1 1 15 4836 1 1 46 ALA HA H 13.753 -0.054 3.713 1.00 . A A . 27 THR HA 1 1 15 4837 1 1 46 ALA N N 12.162 1.176 4.176 1.00 . A A . 27 THR N 1 1 15 4838 1 1 46 ALA O O 12.491 -1.895 2.528 1.00 . A A . 27 THR O 1 1 15 4839 1 1 47 GLY C C 9.809 -1.619 1.210 1.00 . A A . 28 ALA C 1 1 15 4840 1 1 47 GLY CA C 9.726 -1.908 2.705 1.00 . A A . 28 ALA CA 1 1 15 4841 1 1 47 GLY H H 10.250 -0.398 4.090 1.00 . A A . 28 ALA H 1 1 15 4842 1 1 47 GLY N N 10.626 -1.044 3.456 1.00 . A A . 28 ALA N 1 1 15 4843 1 1 47 GLY O O 9.621 -2.511 0.383 1.00 . A A . 28 ALA O 1 1 15 4844 1 1 48 ILE C C 11.409 -0.576 -1.205 1.00 . A A . 29 GLY C 1 1 15 4845 1 1 48 ILE CA C 10.192 0.020 -0.525 1.00 . A A . 29 GLY CA 1 1 15 4846 1 1 48 ILE H H 10.229 0.304 1.573 1.00 . A A . 29 GLY H 1 1 15 4847 1 1 48 ILE N N 10.090 -0.365 0.870 1.00 . A A . 29 GLY N 1 1 15 4848 1 1 48 ILE O O 11.295 -1.202 -2.259 1.00 . A A . 29 GLY O 1 1 15 4849 1 1 49 ASN C C 13.773 -2.425 -1.268 1.00 . A A . 30 ILE C 1 1 15 4850 1 1 49 ASN CA C 13.820 -0.905 -1.155 1.00 . A A . 30 ILE CA 1 1 15 4851 1 1 49 ASN CB C 15.035 -0.498 -0.298 1.00 . A A . 30 ILE CB 1 1 15 4852 1 1 49 ASN H H 12.604 0.125 0.237 1.00 . A A . 30 ILE H 1 1 15 4853 1 1 49 ASN HA H 13.946 -0.486 -2.143 1.00 . A A . 30 ILE HA 1 1 15 4854 1 1 49 ASN N N 12.577 -0.382 -0.601 1.00 . A A . 30 ILE N 1 1 15 4855 1 1 49 ASN O O 14.259 -2.999 -2.242 1.00 . A A . 30 ILE O 1 1 15 4856 1 1 50 SER C C 12.442 -5.034 -1.550 1.00 . A A . 31 ASN C 1 1 15 4857 1 1 50 SER CA C 13.072 -4.526 -0.255 1.00 . A A . 31 ASN CA 1 1 15 4858 1 1 50 SER CB C 12.240 -4.985 0.944 1.00 . A A . 31 ASN CB 1 1 15 4859 1 1 50 SER H H 12.814 -2.557 0.481 1.00 . A A . 31 ASN H 1 1 15 4860 1 1 50 SER HA H 14.067 -4.936 -0.170 1.00 . A A . 31 ASN HA 1 1 15 4861 1 1 50 SER HB2 H 12.273 -4.224 1.710 1.00 . A A . 31 ASN HB2 1 1 15 4862 1 1 50 SER HB3 H 11.216 -5.130 0.631 1.00 . A A . 31 ASN HB3 1 1 15 4863 1 1 50 SER N N 13.183 -3.071 -0.267 1.00 . A A . 31 ASN N 1 1 15 4864 1 1 50 SER O O 13.078 -5.755 -2.319 1.00 . A A . 31 ASN O 1 1 15 4865 1 1 51 PHE C C 11.203 -4.550 -4.235 1.00 . A A . 32 SER C 1 1 15 4866 1 1 51 PHE CA C 10.484 -5.057 -2.990 1.00 . A A . 32 SER CA 1 1 15 4867 1 1 51 PHE CB C 9.047 -4.533 -2.966 1.00 . A A . 32 SER CB 1 1 15 4868 1 1 51 PHE H H 10.741 -4.069 -1.138 1.00 . A A . 32 SER H 1 1 15 4869 1 1 51 PHE HA H 10.465 -6.137 -3.013 1.00 . A A . 32 SER HA 1 1 15 4870 1 1 51 PHE HB2 H 9.051 -3.470 -3.155 1.00 . A A . 32 SER HB2 1 1 15 4871 1 1 51 PHE HB3 H 8.471 -5.033 -3.731 1.00 . A A . 32 SER HB3 1 1 15 4872 1 1 51 PHE N N 11.194 -4.647 -1.785 1.00 . A A . 32 SER N 1 1 15 4873 1 1 51 PHE O O 11.168 -5.186 -5.289 1.00 . A A . 32 SER O 1 1 15 4874 1 1 52 VAL C C 13.783 -3.674 -5.600 1.00 . A A . 33 PHE C 1 1 15 4875 1 1 52 VAL CA C 12.589 -2.803 -5.212 1.00 . A A . 33 PHE CA 1 1 15 4876 1 1 52 VAL CB C 13.044 -1.386 -4.831 1.00 . A A . 33 PHE CB 1 1 15 4877 1 1 52 VAL H H 11.848 -2.942 -3.239 1.00 . A A . 33 PHE H 1 1 15 4878 1 1 52 VAL HA H 11.916 -2.741 -6.053 1.00 . A A . 33 PHE HA 1 1 15 4879 1 1 52 VAL N N 11.857 -3.401 -4.104 1.00 . A A . 33 PHE N 1 1 15 4880 1 1 52 VAL O O 13.998 -3.964 -6.779 1.00 . A A . 33 PHE O 1 1 15 4881 1 1 53 SER C C 15.354 -6.174 -5.627 1.00 . A A . 34 VAL C 1 1 15 4882 1 1 53 SER CA C 15.728 -4.924 -4.841 1.00 . A A . 34 VAL CA 1 1 15 4883 1 1 53 SER CB C 16.411 -5.332 -3.520 1.00 . A A . 34 VAL CB 1 1 15 4884 1 1 53 SER H H 14.336 -3.827 -3.683 1.00 . A A . 34 VAL H 1 1 15 4885 1 1 53 SER HA H 16.432 -4.347 -5.424 1.00 . A A . 34 VAL HA 1 1 15 4886 1 1 53 SER N N 14.557 -4.089 -4.601 1.00 . A A . 34 VAL N 1 1 15 4887 1 1 53 SER O O 15.694 -6.294 -6.799 1.00 . A A . 34 VAL O 1 1 15 4888 1 1 54 GLY C C 13.639 -8.116 -6.967 1.00 . A A . 35 SER C 1 1 15 4889 1 1 54 GLY CA C 14.282 -8.349 -5.624 1.00 . A A . 35 SER CA 1 1 15 4890 1 1 54 GLY H H 14.452 -6.987 -4.042 1.00 . A A . 35 SER H 1 1 15 4891 1 1 54 GLY N N 14.669 -7.111 -4.980 1.00 . A A . 35 SER N 1 1 15 4892 1 1 54 GLY O O 14.096 -8.665 -7.969 1.00 . A A . 35 SER O 1 1 15 4893 1 1 55 VAL C C 13.022 -7.010 -9.378 1.00 . A A . 36 GLY C 1 1 15 4894 1 1 55 VAL CA C 11.974 -7.018 -8.285 1.00 . A A . 36 GLY CA 1 1 15 4895 1 1 55 VAL H H 12.294 -6.871 -6.189 1.00 . A A . 36 GLY H 1 1 15 4896 1 1 55 VAL N N 12.606 -7.296 -7.010 1.00 . A A . 36 GLY N 1 1 15 4897 1 1 55 VAL O O 12.850 -7.612 -10.438 1.00 . A A . 36 GLY O 1 1 15 4898 1 1 56 ALA C C 16.273 -7.398 -9.710 1.00 . A A . 37 VAL C 1 1 15 4899 1 1 56 ALA CA C 15.265 -6.269 -9.961 1.00 . A A . 37 VAL CA 1 1 15 4900 1 1 56 ALA CB C 15.983 -4.911 -9.825 1.00 . A A . 37 VAL CB 1 1 15 4901 1 1 56 ALA H H 14.210 -5.929 -8.196 1.00 . A A . 37 VAL H 1 1 15 4902 1 1 56 ALA HA H 14.894 -6.353 -10.965 1.00 . A A . 37 VAL HA 1 1 15 4903 1 1 56 ALA N N 14.135 -6.348 -9.072 1.00 . A A . 37 VAL N 1 1 15 4904 1 1 56 ALA O O 16.446 -8.296 -10.535 1.00 . A A . 37 VAL O 1 1 15 4905 1 1 57 SER C C 17.489 -9.513 -7.517 1.00 . A A . 38 ALA C 1 1 15 4906 1 1 57 SER CA C 18.003 -8.249 -8.188 1.00 . A A . 38 ALA CA 1 1 15 4907 1 1 57 SER CB C 19.011 -7.567 -7.269 1.00 . A A . 38 ALA CB 1 1 15 4908 1 1 57 SER H H 16.788 -6.554 -7.972 1.00 . A A . 38 ALA H 1 1 15 4909 1 1 57 SER HA H 18.520 -8.522 -9.085 1.00 . A A . 38 ALA HA 1 1 15 4910 1 1 57 SER HB2 H 20.009 -7.890 -7.525 1.00 . A A . 38 ALA HB2 1 1 15 4911 1 1 57 SER HB3 H 18.798 -7.831 -6.236 1.00 . A A . 38 ALA HB3 1 1 15 4912 1 1 57 SER N N 16.968 -7.301 -8.572 1.00 . A A . 38 ALA N 1 1 15 4913 1 1 57 SER O O 17.506 -10.605 -8.088 1.00 . A A . 38 ALA O 1 1 15 4914 1 1 58 GLY C C 15.373 -11.125 -5.902 1.00 . A A . 39 SER C 1 1 15 4915 1 1 58 GLY CA C 16.644 -10.426 -5.404 1.00 . A A . 39 SER CA 1 1 15 4916 1 1 58 GLY H H 17.162 -8.444 -5.876 1.00 . A A . 39 SER H 1 1 15 4917 1 1 58 GLY N N 17.100 -9.342 -6.261 1.00 . A A . 39 SER N 1 1 15 4918 1 1 58 GLY O O 14.836 -11.996 -5.217 1.00 . A A . 39 SER O 1 1 15 4919 1 1 59 ALA C C 13.697 -11.402 -9.141 1.00 . A A . 40 GLY C 1 1 15 4920 1 1 59 ALA CA C 13.696 -11.368 -7.625 1.00 . A A . 40 GLY CA 1 1 15 4921 1 1 59 ALA H H 15.350 -10.054 -7.596 1.00 . A A . 40 GLY H 1 1 15 4922 1 1 59 ALA N N 14.893 -10.751 -7.085 1.00 . A A . 40 GLY N 1 1 15 4923 1 1 59 ALA O O 12.737 -10.972 -9.780 1.00 . A A . 40 GLY O 1 1 15 4924 1 1 60 GLY C C 13.783 -12.840 -11.773 1.00 . A A . 41 ALA C 1 1 15 4925 1 1 60 GLY CA C 14.904 -12.003 -11.167 1.00 . A A . 41 ALA CA 1 1 15 4926 1 1 60 GLY H H 15.511 -12.240 -9.154 1.00 . A A . 41 ALA H 1 1 15 4927 1 1 60 GLY N N 14.779 -11.914 -9.717 1.00 . A A . 41 ALA N 1 1 15 4928 1 1 60 GLY O O 13.478 -12.721 -12.960 1.00 . A A . 41 ALA O 1 1 15 4929 1 1 61 SER C C 12.078 -15.890 -10.765 1.00 . A A . 42 GLY C 1 1 15 4930 1 1 61 SER CA C 12.088 -14.527 -11.427 1.00 . A A . 42 GLY CA 1 1 15 4931 1 1 61 SER H H 13.454 -13.735 -10.017 1.00 . A A . 42 GLY H 1 1 15 4932 1 1 61 SER N N 13.170 -13.685 -10.952 1.00 . A A . 42 GLY N 1 1 15 4933 1 1 61 SER O O 12.047 -16.917 -11.443 1.00 . A A . 42 GLY O 1 1 15 4934 1 1 62 ILE C C 10.720 -17.411 -8.071 1.00 . A A . 43 SER C 1 1 15 4935 1 1 62 ILE CA C 12.093 -17.150 -8.682 1.00 . A A . 43 SER CA 1 1 15 4936 1 1 62 ILE CB C 13.154 -17.113 -7.581 1.00 . A A . 43 SER CB 1 1 15 4937 1 1 62 ILE H H 12.125 -15.050 -8.951 1.00 . A A . 43 SER H 1 1 15 4938 1 1 62 ILE HA H 12.325 -17.949 -9.366 1.00 . A A . 43 SER HA 1 1 15 4939 1 1 62 ILE N N 12.102 -15.902 -9.437 1.00 . A A . 43 SER N 1 1 15 4940 1 1 62 ILE O O 10.389 -18.546 -7.727 1.00 . A A . 43 SER O 1 1 15 4941 1 1 63 GLY C C 7.625 -15.484 -8.024 1.00 . A A . 44 ILE C 1 1 15 4942 1 1 63 GLY CA C 8.589 -16.471 -7.366 1.00 . A A . 44 ILE CA 1 1 15 4943 1 1 63 GLY H H 10.245 -15.477 -8.228 1.00 . A A . 44 ILE H 1 1 15 4944 1 1 63 GLY N N 9.925 -16.355 -7.936 1.00 . A A . 44 ILE N 1 1 15 4945 1 1 63 GLY O O 7.247 -14.476 -7.427 1.00 . A A . 44 ILE O 1 1 15 4946 1 1 64 ARG C C 5.059 -15.633 -10.415 1.00 . A A . 45 GLY C 1 1 15 4947 1 1 64 ARG CA C 6.320 -14.915 -9.977 1.00 . A A . 45 GLY CA 1 1 15 4948 1 1 64 ARG H H 7.569 -16.600 -9.684 1.00 . A A . 45 GLY H 1 1 15 4949 1 1 64 ARG N N 7.234 -15.783 -9.259 1.00 . A A . 45 GLY N 1 1 15 4950 1 1 64 ARG O O 3.956 -15.098 -10.292 1.00 . A A . 45 GLY O 1 1 16 4951 1 1 20 ASN C C 0.411 15.973 19.105 1.00 . A A . 1 VAL C 1 1 16 4952 1 1 20 ASN CA C 0.387 15.235 20.441 1.00 . A A . 1 VAL CA 1 1 16 4953 1 1 20 ASN CB C -1.034 14.692 20.693 1.00 . A A . 1 VAL CB 1 1 16 4954 1 1 20 ASN H H 0.683 17.070 21.452 1.00 . A A . 1 VAL H 1 1 16 4955 1 1 20 ASN HA H 1.067 14.397 20.390 1.00 . A A . 1 VAL HA 1 1 16 4956 1 1 20 ASN N N 0.823 16.103 21.527 1.00 . A A . 1 VAL N 1 1 16 4957 1 1 20 ASN O O -0.051 17.109 19.004 1.00 . A A . 1 VAL O 1 1 16 4958 1 1 21 TYR C C 0.751 14.872 15.676 1.00 . A A . 2 ASN C 1 1 16 4959 1 1 21 TYR CA C 1.038 15.913 16.754 1.00 . A A . 2 ASN CA 1 1 16 4960 1 1 21 TYR CB C 2.423 16.528 16.536 1.00 . A A . 2 ASN CB 1 1 16 4961 1 1 21 TYR CG C 2.465 17.999 16.903 1.00 . A A . 2 ASN CG 1 1 16 4962 1 1 21 TYR H H 1.305 14.416 18.226 1.00 . A A . 2 ASN H 1 1 16 4963 1 1 21 TYR HA H 0.294 16.693 16.693 1.00 . A A . 2 ASN HA 1 1 16 4964 1 1 21 TYR HB2 H 3.144 16.003 17.145 1.00 . A A . 2 ASN HB2 1 1 16 4965 1 1 21 TYR HB3 H 2.696 16.427 15.496 1.00 . A A . 2 ASN HB3 1 1 16 4966 1 1 21 TYR N N 0.954 15.319 18.083 1.00 . A A . 2 ASN N 1 1 16 4967 1 1 21 TYR O O 1.416 14.835 14.640 1.00 . A A . 2 ASN O 1 1 16 4968 1 1 22 GLY C C 0.580 12.266 14.407 1.00 . A A . 3 TYR C 1 1 16 4969 1 1 22 GLY CA C -0.640 12.978 14.989 1.00 . A A . 3 TYR CA 1 1 16 4970 1 1 22 GLY H H -0.737 14.113 16.775 1.00 . A A . 3 TYR H 1 1 16 4971 1 1 22 GLY N N -0.249 14.028 15.929 1.00 . A A . 3 TYR N 1 1 16 4972 1 1 22 GLY O O 0.606 11.922 13.225 1.00 . A A . 3 TYR O 1 1 16 4973 1 1 23 ASN C C 3.552 10.723 15.940 1.00 . A A . 4 GLY C 1 1 16 4974 1 1 23 ASN CA C 2.792 11.378 14.801 1.00 . A A . 4 GLY CA 1 1 16 4975 1 1 23 ASN H H 1.506 12.345 16.177 1.00 . A A . 4 GLY H 1 1 16 4976 1 1 23 ASN N N 1.585 12.048 15.247 1.00 . A A . 4 GLY N 1 1 16 4977 1 1 23 ASN O O 4.756 10.488 15.834 1.00 . A A . 4 GLY O 1 1 16 4978 1 1 24 GLY C C 2.816 8.465 18.524 1.00 . A A . 5 ASN C 1 1 16 4979 1 1 24 GLY CA C 3.474 9.803 18.193 1.00 . A A . 5 ASN CA 1 1 16 4980 1 1 24 GLY H H 1.896 10.645 17.058 1.00 . A A . 5 ASN H 1 1 16 4981 1 1 24 GLY N N 2.851 10.431 17.032 1.00 . A A . 5 ASN N 1 1 16 4982 1 1 24 GLY O O 3.400 7.634 19.220 1.00 . A A . 5 ASN O 1 1 16 4983 1 1 25 VAL C C -0.051 7.131 19.468 1.00 . A A . 6 GLY C 1 1 16 4984 1 1 25 VAL CA C 0.892 7.022 18.285 1.00 . A A . 6 GLY CA 1 1 16 4985 1 1 25 VAL H H 1.183 8.955 17.479 1.00 . A A . 6 GLY H 1 1 16 4986 1 1 25 VAL N N 1.601 8.260 18.025 1.00 . A A . 6 GLY N 1 1 16 4987 1 1 25 VAL O O 0.318 6.804 20.596 1.00 . A A . 6 GLY O 1 1 16 4988 1 1 26 SER C C -2.841 6.389 20.668 1.00 . A A . 7 VAL C 1 1 16 4989 1 1 26 SER CA C -2.268 7.746 20.259 1.00 . A A . 7 VAL CA 1 1 16 4990 1 1 26 SER CB C -3.404 8.700 19.813 1.00 . A A . 7 VAL CB 1 1 16 4991 1 1 26 SER H H -1.502 7.838 18.289 1.00 . A A . 7 VAL H 1 1 16 4992 1 1 26 SER HA H -1.779 8.184 21.117 1.00 . A A . 7 VAL HA 1 1 16 4993 1 1 26 SER N N -1.269 7.593 19.209 1.00 . A A . 7 VAL N 1 1 16 4994 1 1 26 SER O O -2.244 5.346 20.401 1.00 . A A . 7 VAL O 1 1 16 4995 1 1 27 CYS C C -5.852 4.858 20.883 1.00 . A A . 8 SER C 1 1 16 4996 1 1 27 CYS CA C -4.650 5.187 21.763 1.00 . A A . 8 SER CA 1 1 16 4997 1 1 27 CYS CB C -5.093 5.323 23.221 1.00 . A A . 8 SER CB 1 1 16 4998 1 1 27 CYS H H -4.421 7.273 21.498 1.00 . A A . 8 SER H 1 1 16 4999 1 1 27 CYS HA H -3.934 4.382 21.688 1.00 . A A . 8 SER HA 1 1 16 5000 1 1 27 CYS HB2 H -4.536 6.120 23.691 1.00 . A A . 8 SER HB2 1 1 16 5001 1 1 27 CYS HB3 H -6.148 5.553 23.256 1.00 . A A . 8 SER HB3 1 1 16 5002 1 1 27 CYS N N -3.997 6.411 21.316 1.00 . A A . 8 SER N 1 1 16 5003 1 1 27 CYS O O -6.560 5.754 20.422 1.00 . A A . 8 SER O 1 1 16 5004 1 1 28 SER C C -8.335 2.603 20.691 1.00 . A A . 9 CYS C 1 1 16 5005 1 1 28 SER CA C -7.191 3.120 19.826 1.00 . A A . 9 CYS CA 1 1 16 5006 1 1 28 SER CB C -6.735 2.023 18.860 1.00 . A A . 9 CYS CB 1 1 16 5007 1 1 28 SER H H -5.474 2.902 21.047 1.00 . A A . 9 CYS H 1 1 16 5008 1 1 28 SER HA H -7.542 3.967 19.256 1.00 . A A . 9 CYS HA 1 1 16 5009 1 1 28 SER HB2 H -6.673 1.088 19.394 1.00 . A A . 9 CYS HB2 1 1 16 5010 1 1 28 SER HB3 H -7.461 1.930 18.066 1.00 . A A . 9 CYS HB3 1 1 16 5011 1 1 28 SER N N -6.075 3.567 20.652 1.00 . A A . 9 CYS N 1 1 16 5012 1 1 28 SER O O -8.195 1.594 21.383 1.00 . A A . 9 CYS O 1 1 16 5013 1 1 29 LYS C C -11.924 3.359 20.755 1.00 . A A . 10 SER C 1 1 16 5014 1 1 29 LYS CA C -10.635 2.903 21.428 1.00 . A A . 10 SER CA 1 1 16 5015 1 1 29 LYS CB C -10.555 3.482 22.840 1.00 . A A . 10 SER CB 1 1 16 5016 1 1 29 LYS H H -9.518 4.092 20.076 1.00 . A A . 10 SER H 1 1 16 5017 1 1 29 LYS HA H -10.640 1.825 21.492 1.00 . A A . 10 SER HA 1 1 16 5018 1 1 29 LYS HB2 H -10.877 4.512 22.823 1.00 . A A . 10 SER HB2 1 1 16 5019 1 1 29 LYS HB3 H -11.201 2.913 23.493 1.00 . A A . 10 SER HB3 1 1 16 5020 1 1 29 LYS N N -9.467 3.298 20.648 1.00 . A A . 10 SER N 1 1 16 5021 1 1 29 LYS O O -12.209 4.555 20.677 1.00 . A A . 10 SER O 1 1 16 5022 1 1 30 THR C C -13.796 3.534 18.361 1.00 . A A . 11 LYS C 1 1 16 5023 1 1 30 THR CA C -13.973 2.679 19.617 1.00 . A A . 11 LYS CA 1 1 16 5024 1 1 30 THR CB C -14.904 3.381 20.595 1.00 . A A . 11 LYS CB 1 1 16 5025 1 1 30 THR H H -12.424 1.466 20.385 1.00 . A A . 11 LYS H 1 1 16 5026 1 1 30 THR HA H -14.416 1.737 19.333 1.00 . A A . 11 LYS HA 1 1 16 5027 1 1 30 THR N N -12.704 2.395 20.278 1.00 . A A . 11 LYS N 1 1 16 5028 1 1 30 THR O O -14.778 3.913 17.722 1.00 . A A . 11 LYS O 1 1 16 5029 1 1 31 LYS C C -10.910 4.298 16.238 1.00 . A A . 12 THR C 1 1 16 5030 1 1 31 LYS CA C -12.272 4.642 16.831 1.00 . A A . 12 THR CA 1 1 16 5031 1 1 31 LYS CB C -12.341 6.120 17.177 1.00 . A A . 12 THR CB 1 1 16 5032 1 1 31 LYS H H -11.808 3.511 18.542 1.00 . A A . 12 THR H 1 1 16 5033 1 1 31 LYS HA H -13.018 4.430 16.114 1.00 . A A . 12 THR HA 1 1 16 5034 1 1 31 LYS N N -12.552 3.837 18.007 1.00 . A A . 12 THR N 1 1 16 5035 1 1 31 LYS O O -10.273 3.325 16.640 1.00 . A A . 12 THR O 1 1 16 5036 1 1 32 CYS C C -8.036 5.132 15.615 1.00 . A A . 13 LYS C 1 1 16 5037 1 1 32 CYS CA C -9.181 4.891 14.633 1.00 . A A . 13 LYS CA 1 1 16 5038 1 1 32 CYS CB C -9.038 5.814 13.418 1.00 . A A . 13 LYS CB 1 1 16 5039 1 1 32 CYS H H -11.019 5.866 15.004 1.00 . A A . 13 LYS H 1 1 16 5040 1 1 32 CYS HA H -9.146 3.867 14.302 1.00 . A A . 13 LYS HA 1 1 16 5041 1 1 32 CYS HB2 H -9.921 6.431 13.345 1.00 . A A . 13 LYS HB2 1 1 16 5042 1 1 32 CYS HB3 H -8.178 6.450 13.560 1.00 . A A . 13 LYS HB3 1 1 16 5043 1 1 32 CYS N N -10.467 5.107 15.280 1.00 . A A . 13 LYS N 1 1 16 5044 1 1 32 CYS O O -8.247 5.188 16.827 1.00 . A A . 13 LYS O 1 1 16 5045 1 1 33 SER C C -4.978 6.773 15.378 1.00 . A A . 14 CYS C 1 1 16 5046 1 1 33 SER CA C -5.657 5.504 15.880 1.00 . A A . 14 CYS CA 1 1 16 5047 1 1 33 SER CB C -4.726 4.287 15.810 1.00 . A A . 14 CYS CB 1 1 16 5048 1 1 33 SER H H -6.703 5.222 14.122 1.00 . A A . 14 CYS H 1 1 16 5049 1 1 33 SER HA H -5.974 5.655 16.902 1.00 . A A . 14 CYS HA 1 1 16 5050 1 1 33 SER HB2 H -4.293 4.229 14.822 1.00 . A A . 14 CYS HB2 1 1 16 5051 1 1 33 SER HB3 H -3.936 4.407 16.537 1.00 . A A . 14 CYS HB3 1 1 16 5052 1 1 33 SER N N -6.825 5.272 15.086 1.00 . A A . 14 CYS N 1 1 16 5053 1 1 33 SER O O -5.634 7.779 15.109 1.00 . A A . 14 CYS O 1 1 16 5054 1 1 34 VAL C C -1.907 7.420 13.704 1.00 . A A . 15 SER C 1 1 16 5055 1 1 34 VAL CA C -2.884 7.849 14.793 1.00 . A A . 15 SER CA 1 1 16 5056 1 1 34 VAL CB C -2.121 8.481 15.959 1.00 . A A . 15 SER CB 1 1 16 5057 1 1 34 VAL H H -3.234 5.880 15.475 1.00 . A A . 15 SER H 1 1 16 5058 1 1 34 VAL HA H -3.565 8.580 14.382 1.00 . A A . 15 SER HA 1 1 16 5059 1 1 34 VAL N N -3.673 6.715 15.259 1.00 . A A . 15 SER N 1 1 16 5060 1 1 34 VAL O O -1.561 6.243 13.596 1.00 . A A . 15 SER O 1 1 16 5061 1 1 35 ASN C C 0.911 8.262 12.274 1.00 . A A . 16 VAL C 1 1 16 5062 1 1 35 ASN CA C -0.533 8.100 11.814 1.00 . A A . 16 VAL CA 1 1 16 5063 1 1 35 ASN CB C -0.780 9.021 10.605 1.00 . A A . 16 VAL CB 1 1 16 5064 1 1 35 ASN H H -1.782 9.299 13.031 1.00 . A A . 16 VAL H 1 1 16 5065 1 1 35 ASN HA H -0.688 7.078 11.498 1.00 . A A . 16 VAL HA 1 1 16 5066 1 1 35 ASN N N -1.468 8.381 12.897 1.00 . A A . 16 VAL N 1 1 16 5067 1 1 35 ASN O O 1.186 8.937 13.267 1.00 . A A . 16 VAL O 1 1 16 5068 1 1 36 TRP C C 4.057 8.170 10.660 1.00 . A A . 17 ASN C 1 1 16 5069 1 1 36 TRP CA C 3.250 7.714 11.871 1.00 . A A . 17 ASN CA 1 1 16 5070 1 1 36 TRP CB C 3.755 6.353 12.354 1.00 . A A . 17 ASN CB 1 1 16 5071 1 1 36 TRP CG C 3.145 5.950 13.683 1.00 . A A . 17 ASN CG 1 1 16 5072 1 1 36 TRP H H 1.549 7.120 10.763 1.00 . A A . 17 ASN H 1 1 16 5073 1 1 36 TRP HA H 3.371 8.437 12.663 1.00 . A A . 17 ASN HA 1 1 16 5074 1 1 36 TRP HB2 H 3.502 5.601 11.622 1.00 . A A . 17 ASN HB2 1 1 16 5075 1 1 36 TRP HB3 H 4.828 6.393 12.468 1.00 . A A . 17 ASN HB3 1 1 16 5076 1 1 36 TRP N N 1.831 7.640 11.543 1.00 . A A . 17 ASN N 1 1 16 5077 1 1 36 TRP O O 4.777 7.382 10.046 1.00 . A A . 17 ASN O 1 1 16 5078 1 1 37 GLY C C 6.149 10.031 9.405 1.00 . A A . 18 TRP C 1 1 16 5079 1 1 37 GLY CA C 4.637 10.012 9.178 1.00 . A A . 18 TRP CA 1 1 16 5080 1 1 37 GLY H H 3.335 10.023 10.844 1.00 . A A . 18 TRP H 1 1 16 5081 1 1 37 GLY N N 3.928 9.448 10.318 1.00 . A A . 18 TRP N 1 1 16 5082 1 1 37 GLY O O 6.917 10.255 8.472 1.00 . A A . 18 TRP O 1 1 16 5083 1 1 38 GLN C C 8.515 8.383 11.192 1.00 . A A . 19 GLY C 1 1 16 5084 1 1 38 GLN CA C 7.990 9.785 10.955 1.00 . A A . 19 GLY CA 1 1 16 5085 1 1 38 GLN H H 5.918 9.620 11.353 1.00 . A A . 19 GLY H 1 1 16 5086 1 1 38 GLN N N 6.571 9.793 10.645 1.00 . A A . 19 GLY N 1 1 16 5087 1 1 38 GLN O O 9.400 7.907 10.475 1.00 . A A . 19 GLY O 1 1 16 5088 1 1 39 ALA C C 8.251 5.457 11.291 1.00 . A A . 20 GLN C 1 1 16 5089 1 1 39 ALA CA C 8.375 6.352 12.515 1.00 . A A . 20 GLN CA 1 1 16 5090 1 1 39 ALA CB C 7.536 5.792 13.665 1.00 . A A . 20 GLN CB 1 1 16 5091 1 1 39 ALA H H 7.257 8.136 12.727 1.00 . A A . 20 GLN H 1 1 16 5092 1 1 39 ALA HA H 9.414 6.380 12.815 1.00 . A A . 20 GLN HA 1 1 16 5093 1 1 39 ALA HB2 H 6.503 6.064 13.508 1.00 . A A . 20 GLN HB2 1 1 16 5094 1 1 39 ALA HB3 H 7.619 4.714 13.666 1.00 . A A . 20 GLN HB3 1 1 16 5095 1 1 39 ALA N N 7.962 7.711 12.195 1.00 . A A . 20 GLN N 1 1 16 5096 1 1 39 ALA O O 9.252 4.943 10.791 1.00 . A A . 20 GLN O 1 1 16 5097 1 1 40 PHE C C 7.478 5.038 8.387 1.00 . A A . 21 ALA C 1 1 16 5098 1 1 40 PHE CA C 6.826 4.446 9.618 1.00 . A A . 21 ALA CA 1 1 16 5099 1 1 40 PHE CB C 5.361 4.141 9.374 1.00 . A A . 21 ALA CB 1 1 16 5100 1 1 40 PHE H H 6.258 5.715 11.220 1.00 . A A . 21 ALA H 1 1 16 5101 1 1 40 PHE HA H 7.325 3.537 9.819 1.00 . A A . 21 ALA HA 1 1 16 5102 1 1 40 PHE HB2 H 4.936 4.898 8.733 1.00 . A A . 21 ALA HB2 1 1 16 5103 1 1 40 PHE HB3 H 4.834 4.125 10.316 1.00 . A A . 21 ALA HB3 1 1 16 5104 1 1 40 PHE N N 7.027 5.277 10.796 1.00 . A A . 21 ALA N 1 1 16 5105 1 1 40 PHE O O 7.542 4.408 7.332 1.00 . A A . 21 ALA O 1 1 16 5106 1 1 41 GLN C C 9.998 6.128 7.243 1.00 . A A . 22 PHE C 1 1 16 5107 1 1 41 GLN CA C 8.718 6.900 7.482 1.00 . A A . 22 PHE CA 1 1 16 5108 1 1 41 GLN CB C 9.028 8.352 7.854 1.00 . A A . 22 PHE CB 1 1 16 5109 1 1 41 GLN CG C 8.871 9.312 6.709 1.00 . A A . 22 PHE CG 1 1 16 5110 1 1 41 GLN H H 7.950 6.633 9.426 1.00 . A A . 22 PHE H 1 1 16 5111 1 1 41 GLN HA H 8.106 6.869 6.595 1.00 . A A . 22 PHE HA 1 1 16 5112 1 1 41 GLN HB2 H 8.362 8.663 8.643 1.00 . A A . 22 PHE HB2 1 1 16 5113 1 1 41 GLN HB3 H 10.047 8.415 8.204 1.00 . A A . 22 PHE HB3 1 1 16 5114 1 1 41 GLN N N 8.005 6.227 8.552 1.00 . A A . 22 PHE N 1 1 16 5115 1 1 41 GLN O O 10.394 5.866 6.109 1.00 . A A . 22 PHE O 1 1 16 5116 1 1 42 GLU C C 11.456 3.487 7.938 1.00 . A A . 23 GLN C 1 1 16 5117 1 1 42 GLU CA C 11.814 4.922 8.323 1.00 . A A . 23 GLN CA 1 1 16 5118 1 1 42 GLU CB C 12.496 4.951 9.695 1.00 . A A . 23 GLN CB 1 1 16 5119 1 1 42 GLU CD C 14.452 5.764 11.072 1.00 . A A . 23 GLN CD 1 1 16 5120 1 1 42 GLU CG C 13.719 5.852 9.747 1.00 . A A . 23 GLN CG 1 1 16 5121 1 1 42 GLU H H 10.205 5.946 9.223 1.00 . A A . 23 GLN H 1 1 16 5122 1 1 42 GLU HA H 12.479 5.337 7.581 1.00 . A A . 23 GLN HA 1 1 16 5123 1 1 42 GLU HB2 H 11.783 5.305 10.432 1.00 . A A . 23 GLN HB2 1 1 16 5124 1 1 42 GLU HB3 H 12.801 3.949 9.955 1.00 . A A . 23 GLN HB3 1 1 16 5125 1 1 42 GLU HG2 H 14.397 5.563 8.959 1.00 . A A . 23 GLN HG2 1 1 16 5126 1 1 42 GLU HG3 H 13.405 6.874 9.592 1.00 . A A . 23 GLN HG3 1 1 16 5127 1 1 42 GLU N N 10.607 5.723 8.353 1.00 . A A . 23 GLN N 1 1 16 5128 1 1 42 GLU O O 12.291 2.738 7.429 1.00 . A A . 23 GLN O 1 1 16 5129 1 1 42 GLU OE1 O 15.307 4.901 11.265 1.00 . A A . 23 GLN OE1 1 1 16 5130 1 1 43 ARG C C 9.503 1.616 6.364 1.00 . A A . 24 GLU C 1 1 16 5131 1 1 43 ARG CA C 9.694 1.789 7.868 1.00 . A A . 24 GLU CA 1 1 16 5132 1 1 43 ARG CB C 8.369 1.534 8.588 1.00 . A A . 24 GLU CB 1 1 16 5133 1 1 43 ARG CD C 9.161 0.105 10.516 1.00 . A A . 24 GLU CD 1 1 16 5134 1 1 43 ARG CG C 8.512 1.410 10.097 1.00 . A A . 24 GLU CG 1 1 16 5135 1 1 43 ARG H H 9.583 3.765 8.586 1.00 . A A . 24 GLU H 1 1 16 5136 1 1 43 ARG HA H 10.416 1.077 8.213 1.00 . A A . 24 GLU HA 1 1 16 5137 1 1 43 ARG HB2 H 7.695 2.349 8.376 1.00 . A A . 24 GLU HB2 1 1 16 5138 1 1 43 ARG HB3 H 7.940 0.616 8.214 1.00 . A A . 24 GLU HB3 1 1 16 5139 1 1 43 ARG HG2 H 9.120 2.227 10.456 1.00 . A A . 24 GLU HG2 1 1 16 5140 1 1 43 ARG HG3 H 7.532 1.468 10.545 1.00 . A A . 24 GLU HG3 1 1 16 5141 1 1 43 ARG N N 10.195 3.119 8.183 1.00 . A A . 24 GLU N 1 1 16 5142 1 1 43 ARG O O 10.142 0.770 5.739 1.00 . A A . 24 GLU O 1 1 16 5143 1 1 44 TYR C C 9.606 2.499 3.539 1.00 . A A . 25 ARG C 1 1 16 5144 1 1 44 TYR CA C 8.330 2.362 4.362 1.00 . A A . 25 ARG CA 1 1 16 5145 1 1 44 TYR CB C 7.337 3.457 3.969 1.00 . A A . 25 ARG CB 1 1 16 5146 1 1 44 TYR CG C 5.920 3.195 4.454 1.00 . A A . 25 ARG CG 1 1 16 5147 1 1 44 TYR CZ C 2.531 4.276 3.356 1.00 . A A . 25 ARG CZ 1 1 16 5148 1 1 44 TYR H H 8.135 3.075 6.345 1.00 . A A . 25 ARG H 1 1 16 5149 1 1 44 TYR HA H 7.891 1.401 4.156 1.00 . A A . 25 ARG HA 1 1 16 5150 1 1 44 TYR HB2 H 7.670 4.396 4.387 1.00 . A A . 25 ARG HB2 1 1 16 5151 1 1 44 TYR HB3 H 7.316 3.540 2.892 1.00 . A A . 25 ARG HB3 1 1 16 5152 1 1 44 TYR HD2 H 5.077 5.149 4.385 1.00 . A A . 25 ARG HD2 1 1 16 5153 1 1 44 TYR N N 8.614 2.423 5.792 1.00 . A A . 25 ARG N 1 1 16 5154 1 1 44 TYR O O 9.699 1.980 2.427 1.00 . A A . 25 ARG O 1 1 16 5155 1 1 45 THR C C 12.582 2.067 3.236 1.00 . A A . 26 TYR C 1 1 16 5156 1 1 45 THR CA C 11.859 3.397 3.420 1.00 . A A . 26 TYR CA 1 1 16 5157 1 1 45 THR CB C 12.737 4.368 4.212 1.00 . A A . 26 TYR CB 1 1 16 5158 1 1 45 THR H H 10.448 3.579 4.985 1.00 . A A . 26 TYR H 1 1 16 5159 1 1 45 THR HA H 11.653 3.820 2.450 1.00 . A A . 26 TYR HA 1 1 16 5160 1 1 45 THR N N 10.585 3.195 4.097 1.00 . A A . 26 TYR N 1 1 16 5161 1 1 45 THR O O 13.105 1.776 2.161 1.00 . A A . 26 TYR O 1 1 16 5162 1 1 46 ALA C C 12.385 -1.053 3.515 1.00 . A A . 27 THR C 1 1 16 5163 1 1 46 ALA CA C 13.253 -0.039 4.253 1.00 . A A . 27 THR CA 1 1 16 5164 1 1 46 ALA CB C 13.541 -0.530 5.674 1.00 . A A . 27 THR CB 1 1 16 5165 1 1 46 ALA H H 12.162 1.552 5.121 1.00 . A A . 27 THR H 1 1 16 5166 1 1 46 ALA HA H 14.187 0.073 3.722 1.00 . A A . 27 THR HA 1 1 16 5167 1 1 46 ALA N N 12.601 1.264 4.294 1.00 . A A . 27 THR N 1 1 16 5168 1 1 46 ALA O O 12.878 -1.826 2.693 1.00 . A A . 27 THR O 1 1 16 5169 1 1 47 GLY C C 10.014 -1.656 1.691 1.00 . A A . 28 ALA C 1 1 16 5170 1 1 47 GLY CA C 10.153 -1.959 3.179 1.00 . A A . 28 ALA CA 1 1 16 5171 1 1 47 GLY H H 10.758 -0.404 4.475 1.00 . A A . 28 ALA H 1 1 16 5172 1 1 47 GLY N N 11.090 -1.043 3.813 1.00 . A A . 28 ALA N 1 1 16 5173 1 1 47 GLY O O 9.778 -2.554 0.883 1.00 . A A . 28 ALA O 1 1 16 5174 1 1 48 ILE C C 11.197 -0.502 -0.901 1.00 . A A . 29 GLY C 1 1 16 5175 1 1 48 ILE CA C 10.052 0.017 -0.054 1.00 . A A . 29 GLY CA 1 1 16 5176 1 1 48 ILE H H 10.350 0.289 2.024 1.00 . A A . 29 GLY H 1 1 16 5177 1 1 48 ILE N N 10.163 -0.384 1.336 1.00 . A A . 29 GLY N 1 1 16 5178 1 1 48 ILE O O 10.976 -1.143 -1.928 1.00 . A A . 29 GLY O 1 1 16 5179 1 1 49 ASN C C 13.633 -2.191 -1.320 1.00 . A A . 30 ILE C 1 1 16 5180 1 1 49 ASN CA C 13.606 -0.671 -1.195 1.00 . A A . 30 ILE CA 1 1 16 5181 1 1 49 ASN CB C 14.901 -0.192 -0.506 1.00 . A A . 30 ILE CB 1 1 16 5182 1 1 49 ASN H H 12.534 0.288 0.358 1.00 . A A . 30 ILE H 1 1 16 5183 1 1 49 ASN HA H 13.569 -0.239 -2.185 1.00 . A A . 30 ILE HA 1 1 16 5184 1 1 49 ASN N N 12.422 -0.226 -0.468 1.00 . A A . 30 ILE N 1 1 16 5185 1 1 49 ASN O O 14.168 -2.733 -2.287 1.00 . A A . 30 ILE O 1 1 16 5186 1 1 50 SER C C 12.372 -4.851 -1.629 1.00 . A A . 31 ASN C 1 1 16 5187 1 1 50 SER CA C 13.010 -4.333 -0.345 1.00 . A A . 31 ASN CA 1 1 16 5188 1 1 50 SER CB C 12.232 -4.848 0.868 1.00 . A A . 31 ASN CB 1 1 16 5189 1 1 50 SER H H 12.641 -2.387 0.405 1.00 . A A . 31 ASN H 1 1 16 5190 1 1 50 SER HA H 14.026 -4.694 -0.291 1.00 . A A . 31 ASN HA 1 1 16 5191 1 1 50 SER HB2 H 11.359 -4.231 1.016 1.00 . A A . 31 ASN HB2 1 1 16 5192 1 1 50 SER HB3 H 11.923 -5.865 0.684 1.00 . A A . 31 ASN HB3 1 1 16 5193 1 1 50 SER N N 13.053 -2.874 -0.339 1.00 . A A . 31 ASN N 1 1 16 5194 1 1 50 SER O O 12.982 -5.620 -2.371 1.00 . A A . 31 ASN O 1 1 16 5195 1 1 51 PHE C C 11.175 -4.394 -4.340 1.00 . A A . 32 SER C 1 1 16 5196 1 1 51 PHE CA C 10.426 -4.835 -3.087 1.00 . A A . 32 SER CA 1 1 16 5197 1 1 51 PHE CB C 9.012 -4.250 -3.093 1.00 . A A . 32 SER CB 1 1 16 5198 1 1 51 PHE H H 10.708 -3.803 -1.262 1.00 . A A . 32 SER H 1 1 16 5199 1 1 51 PHE HA H 10.362 -5.912 -3.079 1.00 . A A . 32 SER HA 1 1 16 5200 1 1 51 PHE HB2 H 9.037 -3.249 -2.688 1.00 . A A . 32 SER HB2 1 1 16 5201 1 1 51 PHE HB3 H 8.641 -4.219 -4.107 1.00 . A A . 32 SER HB3 1 1 16 5202 1 1 51 PHE N N 11.142 -4.419 -1.890 1.00 . A A . 32 SER N 1 1 16 5203 1 1 51 PHE O O 11.144 -5.073 -5.367 1.00 . A A . 32 SER O 1 1 16 5204 1 1 52 VAL C C 13.773 -3.641 -5.722 1.00 . A A . 33 PHE C 1 1 16 5205 1 1 52 VAL CA C 12.612 -2.718 -5.366 1.00 . A A . 33 PHE CA 1 1 16 5206 1 1 52 VAL CB C 13.136 -1.320 -5.029 1.00 . A A . 33 PHE CB 1 1 16 5207 1 1 52 VAL H H 11.836 -2.760 -3.400 1.00 . A A . 33 PHE H 1 1 16 5208 1 1 52 VAL HA H 11.947 -2.650 -6.213 1.00 . A A . 33 PHE HA 1 1 16 5209 1 1 52 VAL N N 11.850 -3.253 -4.245 1.00 . A A . 33 PHE N 1 1 16 5210 1 1 52 VAL O O 13.982 -3.972 -6.890 1.00 . A A . 33 PHE O 1 1 16 5211 1 1 53 SER C C 15.252 -6.198 -5.663 1.00 . A A . 34 VAL C 1 1 16 5212 1 1 53 SER CA C 15.666 -4.938 -4.913 1.00 . A A . 34 VAL CA 1 1 16 5213 1 1 53 SER CB C 16.327 -5.332 -3.576 1.00 . A A . 34 VAL CB 1 1 16 5214 1 1 53 SER H H 14.310 -3.757 -3.798 1.00 . A A . 34 VAL H 1 1 16 5215 1 1 53 SER HA H 16.396 -4.406 -5.510 1.00 . A A . 34 VAL HA 1 1 16 5216 1 1 53 SER N N 14.526 -4.054 -4.706 1.00 . A A . 34 VAL N 1 1 16 5217 1 1 53 SER O O 15.570 -6.355 -6.838 1.00 . A A . 34 VAL O 1 1 16 5218 1 1 54 GLY C C 13.468 -8.130 -6.928 1.00 . A A . 35 SER C 1 1 16 5219 1 1 54 GLY CA C 14.127 -8.345 -5.590 1.00 . A A . 35 SER CA 1 1 16 5220 1 1 54 GLY H H 14.354 -6.951 -4.046 1.00 . A A . 35 SER H 1 1 16 5221 1 1 54 GLY N N 14.554 -7.102 -4.982 1.00 . A A . 35 SER N 1 1 16 5222 1 1 54 GLY O O 13.894 -8.716 -7.923 1.00 . A A . 35 SER O 1 1 16 5223 1 1 55 VAL C C 12.836 -7.069 -9.356 1.00 . A A . 36 GLY C 1 1 16 5224 1 1 55 VAL CA C 11.808 -7.024 -8.247 1.00 . A A . 36 GLY CA 1 1 16 5225 1 1 55 VAL H H 12.166 -6.834 -6.159 1.00 . A A . 36 GLY H 1 1 16 5226 1 1 55 VAL N N 12.455 -7.286 -6.975 1.00 . A A . 36 GLY N 1 1 16 5227 1 1 55 VAL O O 12.630 -7.687 -10.400 1.00 . A A . 36 GLY O 1 1 16 5228 1 1 56 ALA C C 16.067 -7.559 -9.730 1.00 . A A . 37 VAL C 1 1 16 5229 1 1 56 ALA CA C 15.091 -6.406 -9.990 1.00 . A A . 37 VAL CA 1 1 16 5230 1 1 56 ALA CB C 15.850 -5.066 -9.891 1.00 . A A . 37 VAL CB 1 1 16 5231 1 1 56 ALA H H 14.075 -6.000 -8.215 1.00 . A A . 37 VAL H 1 1 16 5232 1 1 56 ALA HA H 14.701 -6.498 -10.985 1.00 . A A . 37 VAL HA 1 1 16 5233 1 1 56 ALA N N 13.973 -6.434 -9.081 1.00 . A A . 37 VAL N 1 1 16 5234 1 1 56 ALA O O 16.193 -8.482 -10.535 1.00 . A A . 37 VAL O 1 1 16 5235 1 1 57 SER C C 17.263 -9.656 -7.506 1.00 . A A . 38 ALA C 1 1 16 5236 1 1 57 SER CA C 17.802 -8.426 -8.224 1.00 . A A . 38 ALA CA 1 1 16 5237 1 1 57 SER CB C 18.851 -7.752 -7.345 1.00 . A A . 38 ALA CB 1 1 16 5238 1 1 57 SER H H 16.646 -6.688 -8.025 1.00 . A A . 38 ALA H 1 1 16 5239 1 1 57 SER HA H 18.289 -8.738 -9.124 1.00 . A A . 38 ALA HA 1 1 16 5240 1 1 57 SER HB2 H 19.833 -8.105 -7.623 1.00 . A A . 38 ALA HB2 1 1 16 5241 1 1 57 SER HB3 H 18.662 -7.993 -6.302 1.00 . A A . 38 ALA HB3 1 1 16 5242 1 1 57 SER N N 16.789 -7.455 -8.609 1.00 . A A . 38 ALA N 1 1 16 5243 1 1 57 SER O O 17.235 -10.762 -8.047 1.00 . A A . 38 ALA O 1 1 16 5244 1 1 58 GLY C C 15.138 -11.161 -5.797 1.00 . A A . 39 SER C 1 1 16 5245 1 1 58 GLY CA C 16.439 -10.483 -5.351 1.00 . A A . 39 SER CA 1 1 16 5246 1 1 58 GLY H H 17.007 -8.531 -5.889 1.00 . A A . 39 SER H 1 1 16 5247 1 1 58 GLY N N 16.908 -9.438 -6.248 1.00 . A A . 39 SER N 1 1 16 5248 1 1 58 GLY O O 14.608 -12.013 -5.083 1.00 . A A . 39 SER O 1 1 16 5249 1 1 59 ALA C C 13.619 -12.268 -8.670 1.00 . A A . 40 GLY C 1 1 16 5250 1 1 59 ALA CA C 13.394 -11.391 -7.455 1.00 . A A . 40 GLY CA 1 1 16 5251 1 1 59 ALA H H 15.075 -10.108 -7.503 1.00 . A A . 40 GLY H 1 1 16 5252 1 1 59 ALA N N 14.624 -10.790 -6.967 1.00 . A A . 40 GLY N 1 1 16 5253 1 1 59 ALA O O 12.721 -12.443 -9.493 1.00 . A A . 40 GLY O 1 1 16 5254 1 1 60 GLY C C 14.510 -15.053 -9.771 1.00 . A A . 41 ALA C 1 1 16 5255 1 1 60 GLY CA C 15.166 -13.682 -9.902 1.00 . A A . 41 ALA CA 1 1 16 5256 1 1 60 GLY H H 15.494 -12.642 -8.096 1.00 . A A . 41 ALA H 1 1 16 5257 1 1 60 GLY N N 14.822 -12.820 -8.782 1.00 . A A . 41 ALA N 1 1 16 5258 1 1 60 GLY O O 14.338 -15.767 -10.759 1.00 . A A . 41 ALA O 1 1 16 5259 1 1 61 SER C C 14.513 -17.843 -8.311 1.00 . A A . 42 GLY C 1 1 16 5260 1 1 61 SER CA C 13.516 -16.700 -8.308 1.00 . A A . 42 GLY CA 1 1 16 5261 1 1 61 SER H H 14.311 -14.806 -7.798 1.00 . A A . 42 GLY H 1 1 16 5262 1 1 61 SER N N 14.148 -15.415 -8.546 1.00 . A A . 42 GLY N 1 1 16 5263 1 1 61 SER O O 14.661 -18.544 -9.312 1.00 . A A . 42 GLY O 1 1 16 5264 1 1 62 ILE C C 15.531 -20.425 -6.684 1.00 . A A . 43 SER C 1 1 16 5265 1 1 62 ILE CA C 16.185 -19.097 -7.062 1.00 . A A . 43 SER CA 1 1 16 5266 1 1 62 ILE CB C 17.239 -18.721 -6.018 1.00 . A A . 43 SER CB 1 1 16 5267 1 1 62 ILE H H 15.033 -17.438 -6.423 1.00 . A A . 43 SER H 1 1 16 5268 1 1 62 ILE HA H 16.670 -19.210 -8.020 1.00 . A A . 43 SER HA 1 1 16 5269 1 1 62 ILE N N 15.196 -18.031 -7.186 1.00 . A A . 43 SER N 1 1 16 5270 1 1 62 ILE O O 16.212 -21.444 -6.563 1.00 . A A . 43 SER O 1 1 16 5271 1 1 63 GLY C C 14.189 -22.420 -5.054 1.00 . A A . 44 ILE C 1 1 16 5272 1 1 63 GLY CA C 13.462 -21.614 -6.131 1.00 . A A . 44 ILE CA 1 1 16 5273 1 1 63 GLY H H 13.722 -19.568 -6.606 1.00 . A A . 44 ILE H 1 1 16 5274 1 1 63 GLY N N 14.209 -20.410 -6.496 1.00 . A A . 44 ILE N 1 1 16 5275 1 1 63 GLY O O 14.310 -23.642 -5.149 1.00 . A A . 44 ILE O 1 1 16 5276 1 1 64 ARG C C 14.470 -23.273 -2.119 1.00 . A A . 45 GLY C 1 1 16 5277 1 1 64 ARG CA C 15.378 -22.389 -2.949 1.00 . A A . 45 GLY CA 1 1 16 5278 1 1 64 ARG H H 14.545 -20.754 -4.005 1.00 . A A . 45 GLY H 1 1 16 5279 1 1 64 ARG N N 14.671 -21.725 -4.029 1.00 . A A . 45 GLY N 1 1 16 5280 1 1 64 ARG O O 14.104 -24.369 -2.542 1.00 . A A . 45 GLY O 1 1 17 5281 1 1 20 ASN C C 11.562 27.807 19.476 1.00 . A A . 1 VAL C 1 1 17 5282 1 1 20 ASN CA C 11.618 28.098 20.971 1.00 . A A . 1 VAL CA 1 1 17 5283 1 1 20 ASN CB C 10.559 29.162 21.313 1.00 . A A . 1 VAL CB 1 1 17 5284 1 1 20 ASN H H 13.073 29.422 21.750 1.00 . A A . 1 VAL H 1 1 17 5285 1 1 20 ASN HA H 11.378 27.194 21.513 1.00 . A A . 1 VAL HA 1 1 17 5286 1 1 20 ASN N N 12.952 28.525 21.374 1.00 . A A . 1 VAL N 1 1 17 5287 1 1 20 ASN O O 12.357 28.338 18.699 1.00 . A A . 1 VAL O 1 1 17 5288 1 1 21 TYR C C 9.015 26.201 17.376 1.00 . A A . 2 ASN C 1 1 17 5289 1 1 21 TYR CA C 10.458 26.597 17.674 1.00 . A A . 2 ASN CA 1 1 17 5290 1 1 21 TYR CB C 11.401 25.448 17.312 1.00 . A A . 2 ASN CB 1 1 17 5291 1 1 21 TYR CG C 11.441 25.181 15.820 1.00 . A A . 2 ASN CG 1 1 17 5292 1 1 21 TYR H H 10.014 26.570 19.744 1.00 . A A . 2 ASN H 1 1 17 5293 1 1 21 TYR HA H 10.712 27.462 17.078 1.00 . A A . 2 ASN HA 1 1 17 5294 1 1 21 TYR HB2 H 12.400 25.693 17.641 1.00 . A A . 2 ASN HB2 1 1 17 5295 1 1 21 TYR HB3 H 11.071 24.549 17.812 1.00 . A A . 2 ASN HB3 1 1 17 5296 1 1 21 TYR N N 10.618 26.960 19.078 1.00 . A A . 2 ASN N 1 1 17 5297 1 1 21 TYR O O 8.761 25.253 16.633 1.00 . A A . 2 ASN O 1 1 17 5298 1 1 22 GLY C C 6.299 25.256 18.239 1.00 . A A . 3 TYR C 1 1 17 5299 1 1 22 GLY CA C 6.655 26.661 17.760 1.00 . A A . 3 TYR CA 1 1 17 5300 1 1 22 GLY H H 8.339 27.678 18.544 1.00 . A A . 3 TYR H 1 1 17 5301 1 1 22 GLY N N 8.074 26.935 17.962 1.00 . A A . 3 TYR N 1 1 17 5302 1 1 22 GLY O O 6.142 24.337 17.435 1.00 . A A . 3 TYR O 1 1 17 5303 1 1 23 ASN C C 5.214 23.918 21.495 1.00 . A A . 4 GLY C 1 1 17 5304 1 1 23 ASN CA C 5.836 23.806 20.117 1.00 . A A . 4 GLY CA 1 1 17 5305 1 1 23 ASN H H 6.309 25.869 20.144 1.00 . A A . 4 GLY H 1 1 17 5306 1 1 23 ASN N N 6.172 25.100 19.553 1.00 . A A . 4 GLY N 1 1 17 5307 1 1 23 ASN O O 5.483 23.100 22.373 1.00 . A A . 4 GLY O 1 1 17 5308 1 1 24 GLY C C 2.350 24.474 23.004 1.00 . A A . 5 ASN C 1 1 17 5309 1 1 24 GLY CA C 3.717 25.154 22.965 1.00 . A A . 5 ASN CA 1 1 17 5310 1 1 24 GLY H H 4.205 25.555 20.944 1.00 . A A . 5 ASN H 1 1 17 5311 1 1 24 GLY N N 4.379 24.936 21.683 1.00 . A A . 5 ASN N 1 1 17 5312 1 1 24 GLY O O 1.781 24.266 24.075 1.00 . A A . 5 ASN O 1 1 17 5313 1 1 25 VAL C C 0.639 21.972 21.680 1.00 . A A . 6 GLY C 1 1 17 5314 1 1 25 VAL CA C 0.530 23.483 21.760 1.00 . A A . 6 GLY CA 1 1 17 5315 1 1 25 VAL H H 2.321 24.322 21.008 1.00 . A A . 6 GLY H 1 1 17 5316 1 1 25 VAL N N 1.825 24.132 21.830 1.00 . A A . 6 GLY N 1 1 17 5317 1 1 25 VAL O O -0.226 21.309 21.107 1.00 . A A . 6 GLY O 1 1 17 5318 1 1 26 SER C C 1.004 19.287 23.246 1.00 . A A . 7 VAL C 1 1 17 5319 1 1 26 SER CA C 1.927 19.986 22.246 1.00 . A A . 7 VAL CA 1 1 17 5320 1 1 26 SER CB C 3.409 19.648 22.545 1.00 . A A . 7 VAL CB 1 1 17 5321 1 1 26 SER H H 2.362 22.007 22.695 1.00 . A A . 7 VAL H 1 1 17 5322 1 1 26 SER HA H 1.694 19.623 21.255 1.00 . A A . 7 VAL HA 1 1 17 5323 1 1 26 SER N N 1.707 21.427 22.254 1.00 . A A . 7 VAL N 1 1 17 5324 1 1 26 SER O O -0.009 19.846 23.665 1.00 . A A . 7 VAL O 1 1 17 5325 1 1 27 CYS C C -0.873 17.172 24.126 1.00 . A A . 8 SER C 1 1 17 5326 1 1 27 CYS CA C 0.581 17.290 24.575 1.00 . A A . 8 SER CA 1 1 17 5327 1 1 27 CYS CB C 0.655 17.934 25.956 1.00 . A A . 8 SER CB 1 1 17 5328 1 1 27 CYS H H 2.185 17.684 23.260 1.00 . A A . 8 SER H 1 1 17 5329 1 1 27 CYS HA H 1.010 16.302 24.627 1.00 . A A . 8 SER HA 1 1 17 5330 1 1 27 CYS HB2 H 1.622 18.399 26.078 1.00 . A A . 8 SER HB2 1 1 17 5331 1 1 27 CYS HB3 H -0.118 18.683 26.044 1.00 . A A . 8 SER HB3 1 1 17 5332 1 1 27 CYS N N 1.367 18.068 23.624 1.00 . A A . 8 SER N 1 1 17 5333 1 1 27 CYS O O -1.281 17.782 23.138 1.00 . A A . 8 SER O 1 1 17 5334 1 1 28 SER C C -3.949 17.091 25.368 1.00 . A A . 9 CYS C 1 1 17 5335 1 1 28 SER CA C -3.056 16.176 24.536 1.00 . A A . 9 CYS CA 1 1 17 5336 1 1 28 SER CB C -3.450 14.717 24.773 1.00 . A A . 9 CYS CB 1 1 17 5337 1 1 28 SER H H -1.265 15.917 25.632 1.00 . A A . 9 CYS H 1 1 17 5338 1 1 28 SER HA H -3.194 16.411 23.491 1.00 . A A . 9 CYS HA 1 1 17 5339 1 1 28 SER HB2 H -3.505 14.536 25.836 1.00 . A A . 9 CYS HB2 1 1 17 5340 1 1 28 SER HB3 H -4.419 14.537 24.331 1.00 . A A . 9 CYS HB3 1 1 17 5341 1 1 28 SER N N -1.649 16.379 24.858 1.00 . A A . 9 CYS N 1 1 17 5342 1 1 28 SER O O -3.901 17.073 26.597 1.00 . A A . 9 CYS O 1 1 17 5343 1 1 29 LYS C C -6.637 19.451 24.370 1.00 . A A . 10 SER C 1 1 17 5344 1 1 29 LYS CA C -5.680 18.804 25.362 1.00 . A A . 10 SER CA 1 1 17 5345 1 1 29 LYS CB C -4.904 19.884 26.110 1.00 . A A . 10 SER CB 1 1 17 5346 1 1 29 LYS H H -4.762 17.851 23.706 1.00 . A A . 10 SER H 1 1 17 5347 1 1 29 LYS HA H -6.255 18.230 26.074 1.00 . A A . 10 SER HA 1 1 17 5348 1 1 29 LYS HB2 H -5.564 20.712 26.318 1.00 . A A . 10 SER HB2 1 1 17 5349 1 1 29 LYS HB3 H -4.532 19.478 27.039 1.00 . A A . 10 SER HB3 1 1 17 5350 1 1 29 LYS N N -4.768 17.886 24.686 1.00 . A A . 10 SER N 1 1 17 5351 1 1 29 LYS O O -6.239 20.287 23.559 1.00 . A A . 10 SER O 1 1 17 5352 1 1 30 THR C C -8.617 19.352 22.086 1.00 . A A . 11 LYS C 1 1 17 5353 1 1 30 THR CA C -8.936 19.589 23.563 1.00 . A A . 11 LYS CA 1 1 17 5354 1 1 30 THR CB C -9.105 21.081 23.823 1.00 . A A . 11 LYS CB 1 1 17 5355 1 1 30 THR H H -8.150 18.396 25.119 1.00 . A A . 11 LYS H 1 1 17 5356 1 1 30 THR HA H -9.859 19.090 23.798 1.00 . A A . 11 LYS HA 1 1 17 5357 1 1 30 THR N N -7.903 19.056 24.446 1.00 . A A . 11 LYS N 1 1 17 5358 1 1 30 THR O O -9.358 19.794 21.208 1.00 . A A . 11 LYS O 1 1 17 5359 1 1 31 LYS C C -6.304 17.076 20.407 1.00 . A A . 12 THR C 1 1 17 5360 1 1 31 LYS CA C -7.113 18.371 20.456 1.00 . A A . 12 THR CA 1 1 17 5361 1 1 31 LYS CB C -6.316 19.561 19.906 1.00 . A A . 12 THR CB 1 1 17 5362 1 1 31 LYS H H -6.971 18.329 22.546 1.00 . A A . 12 THR H 1 1 17 5363 1 1 31 LYS HA H -8.003 18.245 19.869 1.00 . A A . 12 THR HA 1 1 17 5364 1 1 31 LYS N N -7.520 18.658 21.816 1.00 . A A . 12 THR N 1 1 17 5365 1 1 31 LYS O O -5.874 16.565 21.441 1.00 . A A . 12 THR O 1 1 17 5366 1 1 32 CYS C C -3.967 15.426 19.709 1.00 . A A . 13 LYS C 1 1 17 5367 1 1 32 CYS CA C -5.332 15.317 19.031 1.00 . A A . 13 LYS CA 1 1 17 5368 1 1 32 CYS CB C -5.155 15.006 17.544 1.00 . A A . 13 LYS CB 1 1 17 5369 1 1 32 CYS H H -6.459 17.000 18.413 1.00 . A A . 13 LYS H 1 1 17 5370 1 1 32 CYS HA H -5.887 14.516 19.495 1.00 . A A . 13 LYS HA 1 1 17 5371 1 1 32 CYS HB2 H -4.761 15.882 17.049 1.00 . A A . 13 LYS HB2 1 1 17 5372 1 1 32 CYS HB3 H -4.448 14.197 17.439 1.00 . A A . 13 LYS HB3 1 1 17 5373 1 1 32 CYS N N -6.095 16.549 19.203 1.00 . A A . 13 LYS N 1 1 17 5374 1 1 32 CYS O O -3.660 16.431 20.350 1.00 . A A . 13 LYS O 1 1 17 5375 1 1 33 SER C C -0.815 14.270 19.015 1.00 . A A . 14 CYS C 1 1 17 5376 1 1 33 SER CA C -1.840 14.356 20.139 1.00 . A A . 14 CYS CA 1 1 17 5377 1 1 33 SER CB C -1.725 13.172 21.107 1.00 . A A . 14 CYS CB 1 1 17 5378 1 1 33 SER H H -3.426 13.615 19.044 1.00 . A A . 14 CYS H 1 1 17 5379 1 1 33 SER HA H -1.691 15.278 20.683 1.00 . A A . 14 CYS HA 1 1 17 5380 1 1 33 SER HB2 H -1.680 12.255 20.540 1.00 . A A . 14 CYS HB2 1 1 17 5381 1 1 33 SER HB3 H -0.819 13.277 21.686 1.00 . A A . 14 CYS HB3 1 1 17 5382 1 1 33 SER N N -3.149 14.390 19.562 1.00 . A A . 14 CYS N 1 1 17 5383 1 1 33 SER O O -0.921 14.964 18.004 1.00 . A A . 14 CYS O 1 1 17 5384 1 1 34 VAL C C 1.489 11.737 17.999 1.00 . A A . 15 SER C 1 1 17 5385 1 1 34 VAL CA C 1.223 13.223 18.219 1.00 . A A . 15 SER CA 1 1 17 5386 1 1 34 VAL CB C 2.506 13.921 18.673 1.00 . A A . 15 SER CB 1 1 17 5387 1 1 34 VAL H H 0.163 12.897 20.016 1.00 . A A . 15 SER H 1 1 17 5388 1 1 34 VAL HA H 0.895 13.660 17.287 1.00 . A A . 15 SER HA 1 1 17 5389 1 1 34 VAL N N 0.164 13.420 19.202 1.00 . A A . 15 SER N 1 1 17 5390 1 1 34 VAL O O 1.465 10.946 18.941 1.00 . A A . 15 SER O 1 1 17 5391 1 1 35 ASN C C 3.501 9.742 16.186 1.00 . A A . 16 VAL C 1 1 17 5392 1 1 35 ASN CA C 2.011 9.975 16.405 1.00 . A A . 16 VAL CA 1 1 17 5393 1 1 35 ASN CB C 1.244 9.549 15.138 1.00 . A A . 16 VAL CB 1 1 17 5394 1 1 35 ASN H H 1.745 12.042 16.039 1.00 . A A . 16 VAL H 1 1 17 5395 1 1 35 ASN HA H 1.676 9.357 17.227 1.00 . A A . 16 VAL HA 1 1 17 5396 1 1 35 ASN N N 1.740 11.365 16.748 1.00 . A A . 16 VAL N 1 1 17 5397 1 1 35 ASN O O 4.254 10.680 15.922 1.00 . A A . 16 VAL O 1 1 17 5398 1 1 36 TRP C C 5.581 7.656 14.684 1.00 . A A . 17 ASN C 1 1 17 5399 1 1 36 TRP CA C 5.324 8.129 16.112 1.00 . A A . 17 ASN CA 1 1 17 5400 1 1 36 TRP CB C 5.729 7.038 17.106 1.00 . A A . 17 ASN CB 1 1 17 5401 1 1 36 TRP CG C 7.218 7.043 17.393 1.00 . A A . 17 ASN CG 1 1 17 5402 1 1 36 TRP H H 3.274 7.782 16.510 1.00 . A A . 17 ASN H 1 1 17 5403 1 1 36 TRP HA H 5.917 9.012 16.298 1.00 . A A . 17 ASN HA 1 1 17 5404 1 1 36 TRP HB2 H 5.202 7.193 18.035 1.00 . A A . 17 ASN HB2 1 1 17 5405 1 1 36 TRP HB3 H 5.461 6.074 16.701 1.00 . A A . 17 ASN HB3 1 1 17 5406 1 1 36 TRP N N 3.922 8.485 16.298 1.00 . A A . 17 ASN N 1 1 17 5407 1 1 36 TRP O O 6.301 6.683 14.460 1.00 . A A . 17 ASN O 1 1 17 5408 1 1 37 GLY C C 6.602 8.150 11.871 1.00 . A A . 18 TRP C 1 1 17 5409 1 1 37 GLY CA C 5.147 8.007 12.314 1.00 . A A . 18 TRP CA 1 1 17 5410 1 1 37 GLY H H 4.424 9.117 13.962 1.00 . A A . 18 TRP H 1 1 17 5411 1 1 37 GLY N N 4.985 8.352 13.721 1.00 . A A . 18 TRP N 1 1 17 5412 1 1 37 GLY O O 6.998 7.610 10.839 1.00 . A A . 18 TRP O 1 1 17 5413 1 1 38 GLN C C 9.540 7.766 12.171 1.00 . A A . 19 GLY C 1 1 17 5414 1 1 38 GLN CA C 8.796 9.076 12.328 1.00 . A A . 19 GLY CA 1 1 17 5415 1 1 38 GLN H H 7.023 9.279 13.466 1.00 . A A . 19 GLY H 1 1 17 5416 1 1 38 GLN N N 7.393 8.877 12.656 1.00 . A A . 19 GLY N 1 1 17 5417 1 1 38 GLN O O 10.122 7.488 11.117 1.00 . A A . 19 GLY O 1 1 17 5418 1 1 39 ALA C C 9.676 4.873 11.956 1.00 . A A . 20 GLN C 1 1 17 5419 1 1 39 ALA CA C 10.173 5.652 13.163 1.00 . A A . 20 GLN CA 1 1 17 5420 1 1 39 ALA CB C 9.911 4.862 14.448 1.00 . A A . 20 GLN CB 1 1 17 5421 1 1 39 ALA H H 9.021 7.205 14.020 1.00 . A A . 20 GLN H 1 1 17 5422 1 1 39 ALA HA H 11.235 5.822 13.056 1.00 . A A . 20 GLN HA 1 1 17 5423 1 1 39 ALA HB2 H 8.850 4.860 14.645 1.00 . A A . 20 GLN HB2 1 1 17 5424 1 1 39 ALA HB3 H 10.246 3.845 14.306 1.00 . A A . 20 GLN HB3 1 1 17 5425 1 1 39 ALA N N 9.509 6.943 13.212 1.00 . A A . 20 GLN N 1 1 17 5426 1 1 39 ALA O O 10.463 4.460 11.104 1.00 . A A . 20 GLN O 1 1 17 5427 1 1 40 PHE C C 7.958 4.719 9.443 1.00 . A A . 21 ALA C 1 1 17 5428 1 1 40 PHE CA C 7.773 3.979 10.752 1.00 . A A . 21 ALA CA 1 1 17 5429 1 1 40 PHE CB C 6.316 3.651 10.992 1.00 . A A . 21 ALA CB 1 1 17 5430 1 1 40 PHE H H 7.777 5.052 12.576 1.00 . A A . 21 ALA H 1 1 17 5431 1 1 40 PHE HA H 8.308 3.074 10.670 1.00 . A A . 21 ALA HA 1 1 17 5432 1 1 40 PHE HB2 H 6.214 3.141 11.936 1.00 . A A . 21 ALA HB2 1 1 17 5433 1 1 40 PHE HB3 H 5.963 3.011 10.195 1.00 . A A . 21 ALA HB3 1 1 17 5434 1 1 40 PHE N N 8.359 4.689 11.876 1.00 . A A . 21 ALA N 1 1 17 5435 1 1 40 PHE O O 7.694 4.187 8.365 1.00 . A A . 21 ALA O 1 1 17 5436 1 1 41 GLN C C 9.892 6.084 7.654 1.00 . A A . 22 PHE C 1 1 17 5437 1 1 41 GLN CA C 8.731 6.734 8.374 1.00 . A A . 22 PHE CA 1 1 17 5438 1 1 41 GLN CB C 9.072 8.179 8.751 1.00 . A A . 22 PHE CB 1 1 17 5439 1 1 41 GLN CG C 8.520 9.196 7.794 1.00 . A A . 22 PHE CG 1 1 17 5440 1 1 41 GLN H H 8.669 6.254 10.428 1.00 . A A . 22 PHE H 1 1 17 5441 1 1 41 GLN HA H 7.860 6.715 7.737 1.00 . A A . 22 PHE HA 1 1 17 5442 1 1 41 GLN HB2 H 8.672 8.394 9.729 1.00 . A A . 22 PHE HB2 1 1 17 5443 1 1 41 GLN HB3 H 10.146 8.294 8.775 1.00 . A A . 22 PHE HB3 1 1 17 5444 1 1 41 GLN N N 8.453 5.926 9.548 1.00 . A A . 22 PHE N 1 1 17 5445 1 1 41 GLN O O 9.887 5.923 6.435 1.00 . A A . 22 PHE O 1 1 17 5446 1 1 42 GLU C C 11.583 3.548 7.505 1.00 . A A . 23 GLN C 1 1 17 5447 1 1 42 GLU CA C 12.018 4.950 7.933 1.00 . A A . 23 GLN CA 1 1 17 5448 1 1 42 GLU CB C 13.115 4.867 8.997 1.00 . A A . 23 GLN CB 1 1 17 5449 1 1 42 GLU CD C 14.145 7.112 9.521 1.00 . A A . 23 GLN CD 1 1 17 5450 1 1 42 GLU CG C 14.277 5.814 8.749 1.00 . A A . 23 GLN CG 1 1 17 5451 1 1 42 GLU H H 10.776 5.787 9.424 1.00 . A A . 23 GLN H 1 1 17 5452 1 1 42 GLU HA H 12.388 5.488 7.071 1.00 . A A . 23 GLN HA 1 1 17 5453 1 1 42 GLU HB2 H 12.684 5.105 9.961 1.00 . A A . 23 GLN HB2 1 1 17 5454 1 1 42 GLU HB3 H 13.501 3.858 9.024 1.00 . A A . 23 GLN HB3 1 1 17 5455 1 1 42 GLU HG2 H 15.193 5.327 9.047 1.00 . A A . 23 GLN HG2 1 1 17 5456 1 1 42 GLU HG3 H 14.320 6.042 7.694 1.00 . A A . 23 GLN HG3 1 1 17 5457 1 1 42 GLU N N 10.863 5.657 8.451 1.00 . A A . 23 GLN N 1 1 17 5458 1 1 42 GLU O O 12.198 2.928 6.637 1.00 . A A . 23 GLN O 1 1 17 5459 1 1 42 GLU OE1 O 13.830 8.158 8.951 1.00 . A A . 23 GLN OE1 1 1 17 5460 1 1 43 ARG C C 9.315 1.741 6.433 1.00 . A A . 24 GLU C 1 1 17 5461 1 1 43 ARG CA C 9.948 1.754 7.820 1.00 . A A . 24 GLU CA 1 1 17 5462 1 1 43 ARG CB C 8.906 1.353 8.865 1.00 . A A . 24 GLU CB 1 1 17 5463 1 1 43 ARG CD C 8.487 0.378 11.157 1.00 . A A . 24 GLU CD 1 1 17 5464 1 1 43 ARG CG C 9.507 0.979 10.210 1.00 . A A . 24 GLU CG 1 1 17 5465 1 1 43 ARG H H 10.055 3.617 8.798 1.00 . A A . 24 GLU H 1 1 17 5466 1 1 43 ARG HA H 10.750 1.047 7.847 1.00 . A A . 24 GLU HA 1 1 17 5467 1 1 43 ARG HB2 H 8.225 2.176 9.014 1.00 . A A . 24 GLU HB2 1 1 17 5468 1 1 43 ARG HB3 H 8.352 0.504 8.495 1.00 . A A . 24 GLU HB3 1 1 17 5469 1 1 43 ARG HG2 H 10.294 0.258 10.050 1.00 . A A . 24 GLU HG2 1 1 17 5470 1 1 43 ARG HG3 H 9.921 1.867 10.665 1.00 . A A . 24 GLU HG3 1 1 17 5471 1 1 43 ARG N N 10.499 3.067 8.123 1.00 . A A . 24 GLU N 1 1 17 5472 1 1 43 ARG O O 9.441 0.769 5.689 1.00 . A A . 24 GLU O 1 1 17 5473 1 1 44 TYR C C 8.988 2.997 3.671 1.00 . A A . 25 ARG C 1 1 17 5474 1 1 44 TYR CA C 7.971 2.954 4.803 1.00 . A A . 25 ARG CA 1 1 17 5475 1 1 44 TYR CB C 7.083 4.203 4.778 1.00 . A A . 25 ARG CB 1 1 17 5476 1 1 44 TYR CG C 7.843 5.520 4.688 1.00 . A A . 25 ARG CG 1 1 17 5477 1 1 44 TYR CZ C 7.572 6.531 1.115 1.00 . A A . 25 ARG CZ 1 1 17 5478 1 1 44 TYR H H 8.566 3.571 6.735 1.00 . A A . 25 ARG H 1 1 17 5479 1 1 44 TYR HA H 7.353 2.084 4.673 1.00 . A A . 25 ARG HA 1 1 17 5480 1 1 44 TYR HB2 H 6.422 4.138 3.929 1.00 . A A . 25 ARG HB2 1 1 17 5481 1 1 44 TYR HB3 H 6.493 4.220 5.681 1.00 . A A . 25 ARG HB3 1 1 17 5482 1 1 44 TYR HD2 H 6.268 6.167 3.407 1.00 . A A . 25 ARG HD2 1 1 17 5483 1 1 44 TYR N N 8.631 2.832 6.096 1.00 . A A . 25 ARG N 1 1 17 5484 1 1 44 TYR O O 8.744 2.495 2.574 1.00 . A A . 25 ARG O 1 1 17 5485 1 1 45 THR C C 11.802 2.359 2.659 1.00 . A A . 26 TYR C 1 1 17 5486 1 1 45 THR CA C 11.199 3.724 2.975 1.00 . A A . 26 TYR CA 1 1 17 5487 1 1 45 THR CB C 12.286 4.667 3.492 1.00 . A A . 26 TYR CB 1 1 17 5488 1 1 45 THR H H 10.249 3.977 4.847 1.00 . A A . 26 TYR H 1 1 17 5489 1 1 45 THR HA H 10.776 4.135 2.073 1.00 . A A . 26 TYR HA 1 1 17 5490 1 1 45 THR N N 10.128 3.602 3.954 1.00 . A A . 26 TYR N 1 1 17 5491 1 1 45 THR O O 12.246 2.109 1.540 1.00 . A A . 26 TYR O 1 1 17 5492 1 1 46 ALA C C 11.397 -0.741 2.692 1.00 . A A . 27 THR C 1 1 17 5493 1 1 46 ALA CA C 12.359 0.139 3.483 1.00 . A A . 27 THR CA 1 1 17 5494 1 1 46 ALA CB C 12.648 -0.496 4.844 1.00 . A A . 27 THR CB 1 1 17 5495 1 1 46 ALA H H 11.440 1.738 4.524 1.00 . A A . 27 THR H 1 1 17 5496 1 1 46 ALA HA H 13.283 0.226 2.932 1.00 . A A . 27 THR HA 1 1 17 5497 1 1 46 ALA N N 11.811 1.479 3.655 1.00 . A A . 27 THR N 1 1 17 5498 1 1 46 ALA O O 11.818 -1.559 1.874 1.00 . A A . 27 THR O 1 1 17 5499 1 1 47 GLY C C 9.168 -1.142 0.741 1.00 . A A . 28 ALA C 1 1 17 5500 1 1 47 GLY CA C 9.081 -1.343 2.250 1.00 . A A . 28 ALA CA 1 1 17 5501 1 1 47 GLY H H 9.829 0.103 3.602 1.00 . A A . 28 ALA H 1 1 17 5502 1 1 47 GLY N N 10.103 -0.566 2.940 1.00 . A A . 28 ALA N 1 1 17 5503 1 1 47 GLY O O 9.054 -2.094 -0.031 1.00 . A A . 28 ALA O 1 1 17 5504 1 1 48 ILE C C 10.715 -0.191 -1.723 1.00 . A A . 29 GLY C 1 1 17 5505 1 1 48 ILE CA C 9.474 0.408 -1.090 1.00 . A A . 29 GLY CA 1 1 17 5506 1 1 48 ILE H H 9.457 0.825 0.987 1.00 . A A . 29 GLY H 1 1 17 5507 1 1 48 ILE N N 9.373 0.105 0.326 1.00 . A A . 29 GLY N 1 1 17 5508 1 1 48 ILE O O 10.631 -0.872 -2.745 1.00 . A A . 29 GLY O 1 1 17 5509 1 1 49 ASN C C 13.155 -1.981 -1.594 1.00 . A A . 30 ILE C 1 1 17 5510 1 1 49 ASN CA C 13.133 -0.455 -1.627 1.00 . A A . 30 ILE CA 1 1 17 5511 1 1 49 ASN CB C 14.330 0.086 -0.819 1.00 . A A . 30 ILE CB 1 1 17 5512 1 1 49 ASN H H 11.871 0.612 -0.304 1.00 . A A . 30 ILE H 1 1 17 5513 1 1 49 ASN HA H 13.236 -0.126 -2.649 1.00 . A A . 30 ILE HA 1 1 17 5514 1 1 49 ASN N N 11.869 0.063 -1.116 1.00 . A A . 30 ILE N 1 1 17 5515 1 1 49 ASN O O 13.831 -2.617 -2.402 1.00 . A A . 30 ILE O 1 1 17 5516 1 1 50 SER C C 11.951 -4.673 -1.840 1.00 . A A . 31 ASN C 1 1 17 5517 1 1 50 SER CA C 12.348 -4.015 -0.521 1.00 . A A . 31 ASN CA 1 1 17 5518 1 1 50 SER CB C 11.355 -4.402 0.578 1.00 . A A . 31 ASN CB 1 1 17 5519 1 1 50 SER H H 11.894 -2.003 -0.042 1.00 . A A . 31 ASN H 1 1 17 5520 1 1 50 SER HA H 13.332 -4.363 -0.243 1.00 . A A . 31 ASN HA 1 1 17 5521 1 1 50 SER HB2 H 11.042 -3.511 1.101 1.00 . A A . 31 ASN HB2 1 1 17 5522 1 1 50 SER HB3 H 10.493 -4.872 0.128 1.00 . A A . 31 ASN HB3 1 1 17 5523 1 1 50 SER N N 12.411 -2.563 -0.657 1.00 . A A . 31 ASN N 1 1 17 5524 1 1 50 SER O O 12.717 -5.447 -2.414 1.00 . A A . 31 ASN O 1 1 17 5525 1 1 51 PHE C C 11.166 -4.550 -4.728 1.00 . A A . 32 SER C 1 1 17 5526 1 1 51 PHE CA C 10.252 -4.921 -3.564 1.00 . A A . 32 SER CA 1 1 17 5527 1 1 51 PHE CB C 8.831 -4.425 -3.840 1.00 . A A . 32 SER CB 1 1 17 5528 1 1 51 PHE H H 10.185 -3.736 -1.811 1.00 . A A . 32 SER H 1 1 17 5529 1 1 51 PHE HA H 10.236 -5.996 -3.463 1.00 . A A . 32 SER HA 1 1 17 5530 1 1 51 PHE HB2 H 8.848 -3.358 -4.000 1.00 . A A . 32 SER HB2 1 1 17 5531 1 1 51 PHE HB3 H 8.445 -4.915 -4.722 1.00 . A A . 32 SER HB3 1 1 17 5532 1 1 51 PHE N N 10.750 -4.360 -2.314 1.00 . A A . 32 SER N 1 1 17 5533 1 1 51 PHE O O 11.351 -5.334 -5.659 1.00 . A A . 32 SER O 1 1 17 5534 1 1 52 VAL C C 13.883 -3.737 -5.798 1.00 . A A . 33 PHE C 1 1 17 5535 1 1 52 VAL CA C 12.627 -2.874 -5.718 1.00 . A A . 33 PHE CA 1 1 17 5536 1 1 52 VAL CB C 13.012 -1.416 -5.465 1.00 . A A . 33 PHE CB 1 1 17 5537 1 1 52 VAL H H 11.546 -2.770 -3.903 1.00 . A A . 33 PHE H 1 1 17 5538 1 1 52 VAL HA H 12.098 -2.940 -6.656 1.00 . A A . 33 PHE HA 1 1 17 5539 1 1 52 VAL N N 11.733 -3.350 -4.669 1.00 . A A . 33 PHE N 1 1 17 5540 1 1 52 VAL O O 14.262 -4.201 -6.875 1.00 . A A . 33 PHE O 1 1 17 5541 1 1 53 SER C C 15.517 -6.131 -5.206 1.00 . A A . 34 VAL C 1 1 17 5542 1 1 53 SER CA C 15.742 -4.752 -4.598 1.00 . A A . 34 VAL CA 1 1 17 5543 1 1 53 SER CB C 16.254 -4.906 -3.151 1.00 . A A . 34 VAL CB 1 1 17 5544 1 1 53 SER H H 14.177 -3.551 -3.829 1.00 . A A . 34 VAL H 1 1 17 5545 1 1 53 SER HA H 16.502 -4.243 -5.176 1.00 . A A . 34 VAL HA 1 1 17 5546 1 1 53 SER N N 14.526 -3.948 -4.653 1.00 . A A . 34 VAL N 1 1 17 5547 1 1 53 SER O O 15.984 -6.408 -6.304 1.00 . A A . 34 VAL O 1 1 17 5548 1 1 54 GLY C C 14.062 -8.377 -6.374 1.00 . A A . 35 SER C 1 1 17 5549 1 1 54 GLY CA C 14.569 -8.350 -4.955 1.00 . A A . 35 SER CA 1 1 17 5550 1 1 54 GLY H H 14.497 -6.750 -3.604 1.00 . A A . 35 SER H 1 1 17 5551 1 1 54 GLY N N 14.817 -7.002 -4.483 1.00 . A A . 35 SER N 1 1 17 5552 1 1 54 GLY O O 14.659 -9.035 -7.225 1.00 . A A . 35 SER O 1 1 17 5553 1 1 55 VAL C C 13.640 -7.714 -8.982 1.00 . A A . 36 GLY C 1 1 17 5554 1 1 55 VAL CA C 12.483 -7.634 -8.009 1.00 . A A . 36 GLY CA 1 1 17 5555 1 1 55 VAL H H 12.561 -7.141 -5.942 1.00 . A A . 36 GLY H 1 1 17 5556 1 1 55 VAL N N 12.989 -7.659 -6.649 1.00 . A A . 36 GLY N 1 1 17 5557 1 1 55 VAL O O 13.622 -8.484 -9.942 1.00 . A A . 36 GLY O 1 1 17 5558 1 1 56 ALA C C 16.929 -7.895 -8.929 1.00 . A A . 37 VAL C 1 1 17 5559 1 1 56 ALA CA C 15.887 -6.901 -9.456 1.00 . A A . 37 VAL CA 1 1 17 5560 1 1 56 ALA CB C 16.500 -5.486 -9.469 1.00 . A A . 37 VAL CB 1 1 17 5561 1 1 56 ALA H H 14.627 -6.376 -7.880 1.00 . A A . 37 VAL H 1 1 17 5562 1 1 56 ALA HA H 15.632 -7.166 -10.464 1.00 . A A . 37 VAL HA 1 1 17 5563 1 1 56 ALA N N 14.673 -6.929 -8.680 1.00 . A A . 37 VAL N 1 1 17 5564 1 1 56 ALA O O 17.246 -8.893 -9.578 1.00 . A A . 37 VAL O 1 1 17 5565 1 1 57 SER C C 18.036 -9.540 -6.310 1.00 . A A . 38 ALA C 1 1 17 5566 1 1 57 SER CA C 18.535 -8.357 -7.128 1.00 . A A . 38 ALA CA 1 1 17 5567 1 1 57 SER CB C 19.388 -7.461 -6.237 1.00 . A A . 38 ALA CB 1 1 17 5568 1 1 57 SER H H 17.198 -6.753 -7.310 1.00 . A A . 38 ALA H 1 1 17 5569 1 1 57 SER HA H 19.164 -8.723 -7.912 1.00 . A A . 38 ALA HA 1 1 17 5570 1 1 57 SER HB2 H 20.426 -7.741 -6.332 1.00 . A A . 38 ALA HB2 1 1 17 5571 1 1 57 SER HB3 H 19.075 -7.572 -5.202 1.00 . A A . 38 ALA HB3 1 1 17 5572 1 1 57 SER N N 17.489 -7.568 -7.760 1.00 . A A . 38 ALA N 1 1 17 5573 1 1 57 SER O O 18.196 -10.702 -6.686 1.00 . A A . 38 ALA O 1 1 17 5574 1 1 58 GLY C C 15.875 -11.061 -4.667 1.00 . A A . 39 SER C 1 1 17 5575 1 1 58 GLY CA C 17.025 -10.178 -4.170 1.00 . A A . 39 SER CA 1 1 17 5576 1 1 58 GLY H H 17.451 -8.257 -4.910 1.00 . A A . 39 SER H 1 1 17 5577 1 1 58 GLY N N 17.496 -9.207 -5.146 1.00 . A A . 39 SER N 1 1 17 5578 1 1 58 GLY O O 15.353 -11.882 -3.913 1.00 . A A . 39 SER O 1 1 17 5579 1 1 59 ALA C C 14.914 -12.955 -7.163 1.00 . A A . 40 GLY C 1 1 17 5580 1 1 59 ALA CA C 14.404 -11.706 -6.471 1.00 . A A . 40 GLY CA 1 1 17 5581 1 1 59 ALA H H 15.923 -10.238 -6.496 1.00 . A A . 40 GLY H 1 1 17 5582 1 1 59 ALA N N 15.482 -10.901 -5.929 1.00 . A A . 40 GLY N 1 1 17 5583 1 1 59 ALA O O 14.810 -14.058 -6.624 1.00 . A A . 40 GLY O 1 1 17 5584 1 1 60 GLY C C 17.426 -14.220 -8.705 1.00 . A A . 41 ALA C 1 1 17 5585 1 1 60 GLY CA C 15.996 -13.898 -9.124 1.00 . A A . 41 ALA CA 1 1 17 5586 1 1 60 GLY H H 15.519 -11.884 -8.733 1.00 . A A . 41 ALA H 1 1 17 5587 1 1 60 GLY N N 15.467 -12.782 -8.358 1.00 . A A . 41 ALA N 1 1 17 5588 1 1 60 GLY O O 18.377 -13.948 -9.440 1.00 . A A . 41 ALA O 1 1 17 5589 1 1 61 SER C C 19.309 -16.551 -7.404 1.00 . A A . 42 GLY C 1 1 17 5590 1 1 61 SER CA C 18.892 -15.146 -7.019 1.00 . A A . 42 GLY CA 1 1 17 5591 1 1 61 SER H H 16.781 -14.990 -6.974 1.00 . A A . 42 GLY H 1 1 17 5592 1 1 61 SER N N 17.574 -14.798 -7.517 1.00 . A A . 42 GLY N 1 1 17 5593 1 1 61 SER O O 19.683 -17.351 -6.547 1.00 . A A . 42 GLY O 1 1 17 5594 1 1 62 ILE C C 20.959 -18.121 -9.915 1.00 . A A . 43 SER C 1 1 17 5595 1 1 62 ILE CA C 19.619 -18.171 -9.193 1.00 . A A . 43 SER CA 1 1 17 5596 1 1 62 ILE CB C 18.534 -18.718 -10.126 1.00 . A A . 43 SER CB 1 1 17 5597 1 1 62 ILE H H 18.937 -16.172 -9.332 1.00 . A A . 43 SER H 1 1 17 5598 1 1 62 ILE HA H 19.711 -18.827 -8.349 1.00 . A A . 43 SER HA 1 1 17 5599 1 1 62 ILE N N 19.243 -16.853 -8.696 1.00 . A A . 43 SER N 1 1 17 5600 1 1 62 ILE O O 22.000 -18.447 -9.343 1.00 . A A . 43 SER O 1 1 17 5601 1 1 63 GLY C C 21.885 -16.745 -13.217 1.00 . A A . 44 ILE C 1 1 17 5602 1 1 63 GLY CA C 22.128 -17.611 -11.983 1.00 . A A . 44 ILE CA 1 1 17 5603 1 1 63 GLY H H 20.063 -17.468 -11.562 1.00 . A A . 44 ILE H 1 1 17 5604 1 1 63 GLY N N 20.923 -17.710 -11.171 1.00 . A A . 44 ILE N 1 1 17 5605 1 1 63 GLY O O 21.487 -17.236 -14.274 1.00 . A A . 44 ILE O 1 1 17 5606 1 1 64 ARG C C 20.471 -14.141 -14.356 1.00 . A A . 45 GLY C 1 1 17 5607 1 1 64 ARG CA C 21.926 -14.527 -14.178 1.00 . A A . 45 GLY CA 1 1 17 5608 1 1 64 ARG H H 22.437 -15.109 -12.208 1.00 . A A . 45 GLY H 1 1 17 5609 1 1 64 ARG N N 22.124 -15.446 -13.073 1.00 . A A . 45 GLY N 1 1 17 5610 1 1 64 ARG O O 20.021 -13.127 -13.824 1.00 . A A . 45 GLY O 1 1 18 5611 1 1 20 ASN C C 7.605 -4.334 18.818 1.00 . A A . 1 VAL C 1 1 18 5612 1 1 20 ASN CA C 6.849 -5.629 18.545 1.00 . A A . 1 VAL CA 1 1 18 5613 1 1 20 ASN CB C 6.118 -6.065 19.830 1.00 . A A . 1 VAL CB 1 1 18 5614 1 1 20 ASN H H 8.100 -7.330 18.701 1.00 . A A . 1 VAL H 1 1 18 5615 1 1 20 ASN HA H 6.109 -5.449 17.779 1.00 . A A . 1 VAL HA 1 1 18 5616 1 1 20 ASN N N 7.749 -6.671 18.065 1.00 . A A . 1 VAL N 1 1 18 5617 1 1 20 ASN O O 8.821 -4.342 19.014 1.00 . A A . 1 VAL O 1 1 18 5618 1 1 21 TYR C C 6.687 -1.140 20.121 1.00 . A A . 2 ASN C 1 1 18 5619 1 1 21 TYR CA C 7.483 -1.917 19.076 1.00 . A A . 2 ASN CA 1 1 18 5620 1 1 21 TYR CB C 7.565 -1.117 17.774 1.00 . A A . 2 ASN CB 1 1 18 5621 1 1 21 TYR CG C 8.770 -1.498 16.937 1.00 . A A . 2 ASN CG 1 1 18 5622 1 1 21 TYR H H 5.914 -3.279 18.664 1.00 . A A . 2 ASN H 1 1 18 5623 1 1 21 TYR HA H 8.482 -2.081 19.451 1.00 . A A . 2 ASN HA 1 1 18 5624 1 1 21 TYR HB2 H 6.674 -1.297 17.192 1.00 . A A . 2 ASN HB2 1 1 18 5625 1 1 21 TYR HB3 H 7.631 -0.065 18.010 1.00 . A A . 2 ASN HB3 1 1 18 5626 1 1 21 TYR N N 6.879 -3.222 18.828 1.00 . A A . 2 ASN N 1 1 18 5627 1 1 21 TYR O O 6.334 0.021 19.911 1.00 . A A . 2 ASN O 1 1 18 5628 1 1 22 GLY C C 4.260 -0.763 21.858 1.00 . A A . 3 TYR C 1 1 18 5629 1 1 22 GLY CA C 5.656 -1.159 22.326 1.00 . A A . 3 TYR CA 1 1 18 5630 1 1 22 GLY H H 6.718 -2.712 21.356 1.00 . A A . 3 TYR H 1 1 18 5631 1 1 22 GLY N N 6.409 -1.788 21.247 1.00 . A A . 3 TYR N 1 1 18 5632 1 1 22 GLY O O 4.005 0.399 21.543 1.00 . A A . 3 TYR O 1 1 18 5633 1 1 23 ASN C C 1.138 -2.721 21.379 1.00 . A A . 4 GLY C 1 1 18 5634 1 1 23 ASN CA C 1.998 -1.473 21.383 1.00 . A A . 4 GLY CA 1 1 18 5635 1 1 23 ASN H H 3.617 -2.646 22.077 1.00 . A A . 4 GLY H 1 1 18 5636 1 1 23 ASN N N 3.358 -1.739 21.814 1.00 . A A . 4 GLY N 1 1 18 5637 1 1 23 ASN O O 0.335 -2.927 20.468 1.00 . A A . 4 GLY O 1 1 18 5638 1 1 24 GLY C C -0.944 -4.500 22.729 1.00 . A A . 5 ASN C 1 1 18 5639 1 1 24 GLY CA C 0.537 -4.792 22.509 1.00 . A A . 5 ASN CA 1 1 18 5640 1 1 24 GLY H H 1.960 -3.337 23.093 1.00 . A A . 5 ASN H 1 1 18 5641 1 1 24 GLY N N 1.305 -3.557 22.399 1.00 . A A . 5 ASN N 1 1 18 5642 1 1 24 GLY O O -1.797 -5.352 22.478 1.00 . A A . 5 ASN O 1 1 18 5643 1 1 25 VAL C C -2.738 -1.608 24.204 1.00 . A A . 6 GLY C 1 1 18 5644 1 1 25 VAL CA C -2.622 -2.915 23.444 1.00 . A A . 6 GLY CA 1 1 18 5645 1 1 25 VAL H H -0.523 -2.657 23.380 1.00 . A A . 6 GLY H 1 1 18 5646 1 1 25 VAL N N -1.244 -3.295 23.199 1.00 . A A . 6 GLY N 1 1 18 5647 1 1 25 VAL O O -3.147 -1.591 25.365 1.00 . A A . 6 GLY O 1 1 18 5648 1 1 26 SER C C -3.888 1.245 24.377 1.00 . A A . 7 VAL C 1 1 18 5649 1 1 26 SER CA C -2.441 0.808 24.169 1.00 . A A . 7 VAL CA 1 1 18 5650 1 1 26 SER CB C -1.714 1.871 23.322 1.00 . A A . 7 VAL CB 1 1 18 5651 1 1 26 SER H H -2.059 -0.587 22.624 1.00 . A A . 7 VAL H 1 1 18 5652 1 1 26 SER HA H -1.953 0.748 25.131 1.00 . A A . 7 VAL HA 1 1 18 5653 1 1 26 SER N N -2.376 -0.510 23.548 1.00 . A A . 7 VAL N 1 1 18 5654 1 1 26 SER O O -4.805 0.701 23.760 1.00 . A A . 7 VAL O 1 1 18 5655 1 1 27 CYS C C -5.654 4.083 24.857 1.00 . A A . 8 SER C 1 1 18 5656 1 1 27 CYS CA C -5.423 2.736 25.536 1.00 . A A . 8 SER CA 1 1 18 5657 1 1 27 CYS CB C -5.623 2.873 27.047 1.00 . A A . 8 SER CB 1 1 18 5658 1 1 27 CYS H H -3.317 2.621 25.709 1.00 . A A . 8 SER H 1 1 18 5659 1 1 27 CYS HA H -6.138 2.025 25.151 1.00 . A A . 8 SER HA 1 1 18 5660 1 1 27 CYS HB2 H -6.680 2.936 27.264 1.00 . A A . 8 SER HB2 1 1 18 5661 1 1 27 CYS HB3 H -5.206 2.009 27.543 1.00 . A A . 8 SER HB3 1 1 18 5662 1 1 27 CYS N N -4.087 2.228 25.249 1.00 . A A . 8 SER N 1 1 18 5663 1 1 27 CYS O O -4.844 5.001 24.985 1.00 . A A . 8 SER O 1 1 18 5664 1 1 28 SER C C -8.323 6.091 24.066 1.00 . A A . 9 CYS C 1 1 18 5665 1 1 28 SER CA C -7.105 5.425 23.434 1.00 . A A . 9 CYS CA 1 1 18 5666 1 1 28 SER CB C -7.380 5.140 21.954 1.00 . A A . 9 CYS CB 1 1 18 5667 1 1 28 SER H H -7.370 3.424 24.071 1.00 . A A . 9 CYS H 1 1 18 5668 1 1 28 SER HA H -6.261 6.095 23.512 1.00 . A A . 9 CYS HA 1 1 18 5669 1 1 28 SER HB2 H -8.380 4.747 21.852 1.00 . A A . 9 CYS HB2 1 1 18 5670 1 1 28 SER HB3 H -7.302 6.063 21.399 1.00 . A A . 9 CYS HB3 1 1 18 5671 1 1 28 SER N N -6.764 4.192 24.134 1.00 . A A . 9 CYS N 1 1 18 5672 1 1 28 SER O O -9.425 5.542 24.039 1.00 . A A . 9 CYS O 1 1 18 5673 1 1 29 LYS C C -8.788 9.446 25.575 1.00 . A A . 10 SER C 1 1 18 5674 1 1 29 LYS CA C -9.207 8.014 25.264 1.00 . A A . 10 SER CA 1 1 18 5675 1 1 29 LYS CB C -9.650 7.314 26.548 1.00 . A A . 10 SER CB 1 1 18 5676 1 1 29 LYS H H -7.221 7.664 24.619 1.00 . A A . 10 SER H 1 1 18 5677 1 1 29 LYS HA H -10.037 8.038 24.573 1.00 . A A . 10 SER HA 1 1 18 5678 1 1 29 LYS HB2 H -10.304 7.969 27.103 1.00 . A A . 10 SER HB2 1 1 18 5679 1 1 29 LYS HB3 H -10.178 6.406 26.296 1.00 . A A . 10 SER HB3 1 1 18 5680 1 1 29 LYS N N -8.121 7.277 24.630 1.00 . A A . 10 SER N 1 1 18 5681 1 1 29 LYS O O -7.934 9.684 26.429 1.00 . A A . 10 SER O 1 1 18 5682 1 1 30 THR C C -7.654 12.154 24.779 1.00 . A A . 11 LYS C 1 1 18 5683 1 1 30 THR CA C -9.114 11.813 25.079 1.00 . A A . 11 LYS CA 1 1 18 5684 1 1 30 THR CB C -9.449 12.198 26.510 1.00 . A A . 11 LYS CB 1 1 18 5685 1 1 30 THR H H -10.083 10.141 24.227 1.00 . A A . 11 LYS H 1 1 18 5686 1 1 30 THR HA H -9.745 12.377 24.411 1.00 . A A . 11 LYS HA 1 1 18 5687 1 1 30 THR N N -9.405 10.397 24.880 1.00 . A A . 11 LYS N 1 1 18 5688 1 1 30 THR O O -7.222 13.285 24.995 1.00 . A A . 11 LYS O 1 1 18 5689 1 1 31 LYS C C -5.036 10.484 22.834 1.00 . A A . 12 THR C 1 1 18 5690 1 1 31 LYS CA C -5.498 11.399 23.964 1.00 . A A . 12 THR CA 1 1 18 5691 1 1 31 LYS CB C -4.637 11.194 25.199 1.00 . A A . 12 THR CB 1 1 18 5692 1 1 31 LYS H H -7.287 10.304 24.130 1.00 . A A . 12 THR H 1 1 18 5693 1 1 31 LYS HA H -5.397 12.402 23.648 1.00 . A A . 12 THR HA 1 1 18 5694 1 1 31 LYS N N -6.898 11.181 24.285 1.00 . A A . 12 THR N 1 1 18 5695 1 1 31 LYS O O -3.867 10.104 22.772 1.00 . A A . 12 THR O 1 1 18 5696 1 1 32 CYS C C -4.908 8.010 21.271 1.00 . A A . 13 LYS C 1 1 18 5697 1 1 32 CYS CA C -5.640 9.270 20.810 1.00 . A A . 13 LYS CA 1 1 18 5698 1 1 32 CYS CB C -4.791 10.035 19.794 1.00 . A A . 13 LYS CB 1 1 18 5699 1 1 32 CYS H H -6.871 10.475 22.039 1.00 . A A . 13 LYS H 1 1 18 5700 1 1 32 CYS HA H -6.566 8.978 20.341 1.00 . A A . 13 LYS HA 1 1 18 5701 1 1 32 CYS HB2 H -4.898 11.093 19.984 1.00 . A A . 13 LYS HB2 1 1 18 5702 1 1 32 CYS HB3 H -3.756 9.757 19.922 1.00 . A A . 13 LYS HB3 1 1 18 5703 1 1 32 CYS N N -5.958 10.137 21.940 1.00 . A A . 13 LYS N 1 1 18 5704 1 1 32 CYS O O -4.954 7.650 22.448 1.00 . A A . 13 LYS O 1 1 18 5705 1 1 33 SER C C -2.006 6.478 20.543 1.00 . A A . 14 CYS C 1 1 18 5706 1 1 33 SER CA C -3.493 6.158 20.618 1.00 . A A . 14 CYS CA 1 1 18 5707 1 1 33 SER CB C -3.891 5.053 19.632 1.00 . A A . 14 CYS CB 1 1 18 5708 1 1 33 SER H H -4.218 7.676 19.425 1.00 . A A . 14 CYS H 1 1 18 5709 1 1 33 SER HA H -3.735 5.843 21.623 1.00 . A A . 14 CYS HA 1 1 18 5710 1 1 33 SER HB2 H -3.494 5.289 18.657 1.00 . A A . 14 CYS HB2 1 1 18 5711 1 1 33 SER HB3 H -3.474 4.114 19.968 1.00 . A A . 14 CYS HB3 1 1 18 5712 1 1 33 SER N N -4.232 7.350 20.340 1.00 . A A . 14 CYS N 1 1 18 5713 1 1 33 SER O O -1.550 7.498 21.060 1.00 . A A . 14 CYS O 1 1 18 5714 1 1 34 VAL C C 0.600 5.550 18.307 1.00 . A A . 15 SER C 1 1 18 5715 1 1 34 VAL CA C 0.174 5.770 19.754 1.00 . A A . 15 SER CA 1 1 18 5716 1 1 34 VAL CB C 0.918 4.798 20.671 1.00 . A A . 15 SER CB 1 1 18 5717 1 1 34 VAL H H -1.708 4.836 19.513 1.00 . A A . 15 SER H 1 1 18 5718 1 1 34 VAL HA H 0.422 6.781 20.041 1.00 . A A . 15 SER HA 1 1 18 5719 1 1 34 VAL N N -1.267 5.603 19.906 1.00 . A A . 15 SER N 1 1 18 5720 1 1 34 VAL O O 0.797 4.415 17.872 1.00 . A A . 15 SER O 1 1 18 5721 1 1 35 ASN C C 2.629 6.899 16.013 1.00 . A A . 16 VAL C 1 1 18 5722 1 1 35 ASN CA C 1.148 6.574 16.168 1.00 . A A . 16 VAL CA 1 1 18 5723 1 1 35 ASN CB C 0.327 7.541 15.294 1.00 . A A . 16 VAL CB 1 1 18 5724 1 1 35 ASN H H 0.572 7.520 17.970 1.00 . A A . 16 VAL H 1 1 18 5725 1 1 35 ASN HA H 0.971 5.567 15.819 1.00 . A A . 16 VAL HA 1 1 18 5726 1 1 35 ASN N N 0.742 6.645 17.566 1.00 . A A . 16 VAL N 1 1 18 5727 1 1 35 ASN O O 3.232 7.526 16.883 1.00 . A A . 16 VAL O 1 1 18 5728 1 1 36 TRP C C 4.823 7.269 13.224 1.00 . A A . 17 ASN C 1 1 18 5729 1 1 36 TRP CA C 4.625 6.714 14.631 1.00 . A A . 17 ASN CA 1 1 18 5730 1 1 36 TRP CB C 5.429 5.424 14.802 1.00 . A A . 17 ASN CB 1 1 18 5731 1 1 36 TRP CG C 5.558 5.011 16.256 1.00 . A A . 17 ASN CG 1 1 18 5732 1 1 36 TRP H H 2.680 5.973 14.240 1.00 . A A . 17 ASN H 1 1 18 5733 1 1 36 TRP HA H 4.975 7.443 15.345 1.00 . A A . 17 ASN HA 1 1 18 5734 1 1 36 TRP HB2 H 4.939 4.627 14.263 1.00 . A A . 17 ASN HB2 1 1 18 5735 1 1 36 TRP HB3 H 6.421 5.569 14.399 1.00 . A A . 17 ASN HB3 1 1 18 5736 1 1 36 TRP N N 3.212 6.468 14.899 1.00 . A A . 17 ASN N 1 1 18 5737 1 1 36 TRP O O 5.293 6.567 12.329 1.00 . A A . 17 ASN O 1 1 18 5738 1 1 37 GLY C C 6.061 9.459 11.400 1.00 . A A . 18 TRP C 1 1 18 5739 1 1 37 GLY CA C 4.596 9.185 11.740 1.00 . A A . 18 TRP CA 1 1 18 5740 1 1 37 GLY H H 4.089 9.042 13.785 1.00 . A A . 18 TRP H 1 1 18 5741 1 1 37 GLY N N 4.460 8.534 13.036 1.00 . A A . 18 TRP N 1 1 18 5742 1 1 37 GLY O O 6.380 9.856 10.280 1.00 . A A . 18 TRP O 1 1 18 5743 1 1 38 GLN C C 9.146 8.174 12.064 1.00 . A A . 19 GLY C 1 1 18 5744 1 1 38 GLN CA C 8.366 9.472 12.141 1.00 . A A . 19 GLY CA 1 1 18 5745 1 1 38 GLN H H 6.645 8.929 13.244 1.00 . A A . 19 GLY H 1 1 18 5746 1 1 38 GLN N N 6.950 9.245 12.370 1.00 . A A . 19 GLY N 1 1 18 5747 1 1 38 GLN O O 9.783 7.877 11.050 1.00 . A A . 19 GLY O 1 1 18 5748 1 1 39 ALA C C 9.374 5.244 12.000 1.00 . A A . 20 GLN C 1 1 18 5749 1 1 39 ALA CA C 9.787 6.112 13.179 1.00 . A A . 20 GLN CA 1 1 18 5750 1 1 39 ALA CB C 9.500 5.387 14.495 1.00 . A A . 20 GLN CB 1 1 18 5751 1 1 39 ALA H H 8.560 7.674 13.911 1.00 . A A . 20 GLN H 1 1 18 5752 1 1 39 ALA HA H 10.849 6.309 13.105 1.00 . A A . 20 GLN HA 1 1 18 5753 1 1 39 ALA HB2 H 9.234 6.118 15.243 1.00 . A A . 20 GLN HB2 1 1 18 5754 1 1 39 ALA HB3 H 8.666 4.716 14.348 1.00 . A A . 20 GLN HB3 1 1 18 5755 1 1 39 ALA N N 9.089 7.390 13.135 1.00 . A A . 20 GLN N 1 1 18 5756 1 1 39 ALA O O 10.192 4.941 11.131 1.00 . A A . 20 GLN O 1 1 18 5757 1 1 40 PHE C C 7.667 4.771 9.534 1.00 . A A . 21 ALA C 1 1 18 5758 1 1 40 PHE CA C 7.617 4.031 10.856 1.00 . A A . 21 ALA CA 1 1 18 5759 1 1 40 PHE CB C 6.234 3.474 11.127 1.00 . A A . 21 ALA CB 1 1 18 5760 1 1 40 PHE H H 7.483 5.126 12.667 1.00 . A A . 21 ALA H 1 1 18 5761 1 1 40 PHE HA H 8.294 3.221 10.779 1.00 . A A . 21 ALA HA 1 1 18 5762 1 1 40 PHE HB2 H 5.490 4.147 10.729 1.00 . A A . 21 ALA HB2 1 1 18 5763 1 1 40 PHE HB3 H 6.091 3.364 12.191 1.00 . A A . 21 ALA HB3 1 1 18 5764 1 1 40 PHE N N 8.101 4.851 11.958 1.00 . A A . 21 ALA N 1 1 18 5765 1 1 40 PHE O O 7.401 4.206 8.474 1.00 . A A . 21 ALA O 1 1 18 5766 1 1 41 GLN C C 9.433 6.323 7.683 1.00 . A A . 22 PHE C 1 1 18 5767 1 1 41 GLN CA C 8.218 6.840 8.423 1.00 . A A . 22 PHE CA 1 1 18 5768 1 1 41 GLN CB C 8.398 8.314 8.790 1.00 . A A . 22 PHE CB 1 1 18 5769 1 1 41 GLN CG C 7.722 9.257 7.837 1.00 . A A . 22 PHE CG 1 1 18 5770 1 1 41 GLN H H 8.294 6.375 10.472 1.00 . A A . 22 PHE H 1 1 18 5771 1 1 41 GLN HA H 7.342 6.718 7.807 1.00 . A A . 22 PHE HA 1 1 18 5772 1 1 41 GLN HB2 H 7.990 8.483 9.774 1.00 . A A . 22 PHE HB2 1 1 18 5773 1 1 41 GLN HB3 H 9.453 8.548 8.798 1.00 . A A . 22 PHE HB3 1 1 18 5774 1 1 41 GLN N N 8.061 6.019 9.607 1.00 . A A . 22 PHE N 1 1 18 5775 1 1 41 GLN O O 9.435 6.178 6.460 1.00 . A A . 22 PHE O 1 1 18 5776 1 1 42 GLU C C 11.443 3.970 7.574 1.00 . A A . 23 GLN C 1 1 18 5777 1 1 42 GLU CA C 11.682 5.433 7.949 1.00 . A A . 23 GLN CA 1 1 18 5778 1 1 42 GLU CB C 12.793 5.539 8.998 1.00 . A A . 23 GLN CB 1 1 18 5779 1 1 42 GLU CD C 13.243 7.963 8.444 1.00 . A A . 23 GLN CD 1 1 18 5780 1 1 42 GLU CG C 13.842 6.589 8.670 1.00 . A A . 23 GLN CG 1 1 18 5781 1 1 42 GLU H H 10.359 6.112 9.442 1.00 . A A . 23 GLN H 1 1 18 5782 1 1 42 GLU HA H 11.965 5.987 7.066 1.00 . A A . 23 GLN HA 1 1 18 5783 1 1 42 GLU HB2 H 12.349 5.791 9.954 1.00 . A A . 23 GLN HB2 1 1 18 5784 1 1 42 GLU HB3 H 13.287 4.582 9.083 1.00 . A A . 23 GLN HB3 1 1 18 5785 1 1 42 GLU HG2 H 14.542 6.649 9.489 1.00 . A A . 23 GLN HG2 1 1 18 5786 1 1 42 GLU HG3 H 14.364 6.288 7.773 1.00 . A A . 23 GLN HG3 1 1 18 5787 1 1 42 GLU N N 10.454 5.998 8.470 1.00 . A A . 23 GLN N 1 1 18 5788 1 1 42 GLU O O 12.150 3.404 6.739 1.00 . A A . 23 GLN O 1 1 18 5789 1 1 42 GLU OE1 O 12.704 8.577 9.365 1.00 . A A . 23 GLN OE1 1 1 18 5790 1 1 43 ARG C C 9.562 1.803 6.519 1.00 . A A . 24 GLU C 1 1 18 5791 1 1 43 ARG CA C 10.069 1.979 7.946 1.00 . A A . 24 GLU CA 1 1 18 5792 1 1 43 ARG CB C 8.998 1.512 8.936 1.00 . A A . 24 GLU CB 1 1 18 5793 1 1 43 ARG CD C 10.014 -0.302 10.372 1.00 . A A . 24 GLU CD 1 1 18 5794 1 1 43 ARG CG C 9.553 1.141 10.301 1.00 . A A . 24 GLU CG 1 1 18 5795 1 1 43 ARG H H 9.902 3.878 8.852 1.00 . A A . 24 GLU H 1 1 18 5796 1 1 43 ARG HA H 10.950 1.380 8.081 1.00 . A A . 24 GLU HA 1 1 18 5797 1 1 43 ARG HB2 H 8.276 2.302 9.066 1.00 . A A . 24 GLU HB2 1 1 18 5798 1 1 43 ARG HB3 H 8.501 0.646 8.526 1.00 . A A . 24 GLU HB3 1 1 18 5799 1 1 43 ARG HG2 H 10.393 1.782 10.522 1.00 . A A . 24 GLU HG2 1 1 18 5800 1 1 43 ARG HG3 H 8.781 1.294 11.041 1.00 . A A . 24 GLU HG3 1 1 18 5801 1 1 43 ARG N N 10.427 3.368 8.202 1.00 . A A . 24 GLU N 1 1 18 5802 1 1 43 ARG O O 9.977 0.886 5.811 1.00 . A A . 24 GLU O 1 1 18 5803 1 1 44 TYR C C 9.185 2.738 3.705 1.00 . A A . 25 ARG C 1 1 18 5804 1 1 44 TYR CA C 8.095 2.634 4.762 1.00 . A A . 25 ARG CA 1 1 18 5805 1 1 44 TYR CB C 7.070 3.753 4.569 1.00 . A A . 25 ARG CB 1 1 18 5806 1 1 44 TYR CG C 5.676 3.394 5.061 1.00 . A A . 25 ARG CG 1 1 18 5807 1 1 44 TYR CZ C 2.472 2.216 3.558 1.00 . A A . 25 ARG CZ 1 1 18 5808 1 1 44 TYR H H 8.370 3.397 6.717 1.00 . A A . 25 ARG H 1 1 18 5809 1 1 44 TYR HA H 7.600 1.684 4.654 1.00 . A A . 25 ARG HA 1 1 18 5810 1 1 44 TYR HB2 H 7.403 4.628 5.107 1.00 . A A . 25 ARG HB2 1 1 18 5811 1 1 44 TYR HB3 H 7.006 3.990 3.518 1.00 . A A . 25 ARG HB3 1 1 18 5812 1 1 44 TYR HD2 H 4.812 3.446 3.116 1.00 . A A . 25 ARG HD2 1 1 18 5813 1 1 44 TYR N N 8.661 2.689 6.105 1.00 . A A . 25 ARG N 1 1 18 5814 1 1 44 TYR O O 9.048 2.213 2.600 1.00 . A A . 25 ARG O 1 1 18 5815 1 1 45 THR C C 12.029 2.237 2.821 1.00 . A A . 26 TYR C 1 1 18 5816 1 1 45 THR CA C 11.392 3.585 3.142 1.00 . A A . 26 TYR CA 1 1 18 5817 1 1 45 THR CB C 12.434 4.529 3.748 1.00 . A A . 26 TYR CB 1 1 18 5818 1 1 45 THR H H 10.318 3.803 4.949 1.00 . A A . 26 TYR H 1 1 18 5819 1 1 45 THR HA H 11.012 4.017 2.229 1.00 . A A . 26 TYR HA 1 1 18 5820 1 1 45 THR N N 10.270 3.414 4.055 1.00 . A A . 26 TYR N 1 1 18 5821 1 1 45 THR O O 12.389 1.963 1.677 1.00 . A A . 26 TYR O 1 1 18 5822 1 1 46 ALA C C 11.801 -0.838 2.897 1.00 . A A . 27 THR C 1 1 18 5823 1 1 46 ALA CA C 12.744 0.073 3.676 1.00 . A A . 27 THR CA 1 1 18 5824 1 1 46 ALA CB C 13.058 -0.541 5.042 1.00 . A A . 27 THR CB 1 1 18 5825 1 1 46 ALA H H 11.847 1.674 4.731 1.00 . A A . 27 THR H 1 1 18 5826 1 1 46 ALA HA H 13.663 0.185 3.120 1.00 . A A . 27 THR HA 1 1 18 5827 1 1 46 ALA N N 12.158 1.397 3.843 1.00 . A A . 27 THR N 1 1 18 5828 1 1 46 ALA O O 12.240 -1.663 2.096 1.00 . A A . 27 THR O 1 1 18 5829 1 1 47 GLY C C 9.543 -1.260 0.950 1.00 . A A . 28 ALA C 1 1 18 5830 1 1 47 GLY CA C 9.496 -1.483 2.457 1.00 . A A . 28 ALA CA 1 1 18 5831 1 1 47 GLY H H 10.218 -0.002 3.786 1.00 . A A . 28 ALA H 1 1 18 5832 1 1 47 GLY N N 10.504 -0.678 3.137 1.00 . A A . 28 ALA N 1 1 18 5833 1 1 47 GLY O O 9.400 -2.202 0.169 1.00 . A A . 28 ALA O 1 1 18 5834 1 1 48 ILE C C 11.010 -0.320 -1.546 1.00 . A A . 29 GLY C 1 1 18 5835 1 1 48 ILE CA C 9.813 0.313 -0.865 1.00 . A A . 29 GLY CA 1 1 18 5836 1 1 48 ILE H H 9.857 0.699 1.216 1.00 . A A . 29 GLY H 1 1 18 5837 1 1 48 ILE N N 9.748 -0.011 0.548 1.00 . A A . 29 GLY N 1 1 18 5838 1 1 48 ILE O O 10.875 -0.956 -2.592 1.00 . A A . 29 GLY O 1 1 18 5839 1 1 49 ASN C C 13.345 -2.232 -1.541 1.00 . A A . 30 ILE C 1 1 18 5840 1 1 49 ASN CA C 13.411 -0.707 -1.502 1.00 . A A . 30 ILE CA 1 1 18 5841 1 1 49 ASN CB C 14.645 -0.272 -0.687 1.00 . A A . 30 ILE CB 1 1 18 5842 1 1 49 ASN H H 12.229 0.368 -0.118 1.00 . A A . 30 ILE H 1 1 18 5843 1 1 49 ASN HA H 13.522 -0.336 -2.510 1.00 . A A . 30 ILE HA 1 1 18 5844 1 1 49 ASN N N 12.186 -0.147 -0.949 1.00 . A A . 30 ILE N 1 1 18 5845 1 1 49 ASN O O 13.951 -2.867 -2.404 1.00 . A A . 30 ILE O 1 1 18 5846 1 1 50 SER C C 11.978 -4.828 -1.865 1.00 . A A . 31 ASN C 1 1 18 5847 1 1 50 SER CA C 12.454 -4.264 -0.530 1.00 . A A . 31 ASN CA 1 1 18 5848 1 1 50 SER CB C 11.471 -4.642 0.582 1.00 . A A . 31 ASN CB 1 1 18 5849 1 1 50 SER H H 12.142 -2.253 0.056 1.00 . A A . 31 ASN H 1 1 18 5850 1 1 50 SER HA H 13.422 -4.684 -0.301 1.00 . A A . 31 ASN HA 1 1 18 5851 1 1 50 SER HB2 H 10.887 -3.775 0.848 1.00 . A A . 31 ASN HB2 1 1 18 5852 1 1 50 SER HB3 H 10.811 -5.419 0.223 1.00 . A A . 31 ASN HB3 1 1 18 5853 1 1 50 SER N N 12.603 -2.813 -0.602 1.00 . A A . 31 ASN N 1 1 18 5854 1 1 50 SER O O 12.702 -5.570 -2.529 1.00 . A A . 31 ASN O 1 1 18 5855 1 1 51 PHE C C 11.099 -4.541 -4.682 1.00 . A A . 32 SER C 1 1 18 5856 1 1 51 PHE CA C 10.196 -4.933 -3.518 1.00 . A A . 32 SER CA 1 1 18 5857 1 1 51 PHE CB C 8.795 -4.354 -3.722 1.00 . A A . 32 SER CB 1 1 18 5858 1 1 51 PHE H H 10.232 -3.869 -1.687 1.00 . A A . 32 SER H 1 1 18 5859 1 1 51 PHE HA H 10.130 -6.010 -3.474 1.00 . A A . 32 SER HA 1 1 18 5860 1 1 51 PHE HB2 H 8.876 -3.330 -4.055 1.00 . A A . 32 SER HB2 1 1 18 5861 1 1 51 PHE HB3 H 8.274 -4.935 -4.469 1.00 . A A . 32 SER HB3 1 1 18 5862 1 1 51 PHE N N 10.760 -4.467 -2.257 1.00 . A A . 32 SER N 1 1 18 5863 1 1 51 PHE O O 11.181 -5.248 -5.686 1.00 . A A . 32 SER O 1 1 18 5864 1 1 52 VAL C C 13.869 -3.867 -5.731 1.00 . A A . 33 PHE C 1 1 18 5865 1 1 52 VAL CA C 12.685 -2.915 -5.561 1.00 . A A . 33 PHE CA 1 1 18 5866 1 1 52 VAL CB C 13.167 -1.502 -5.194 1.00 . A A . 33 PHE CB 1 1 18 5867 1 1 52 VAL H H 11.673 -2.894 -3.708 1.00 . A A . 33 PHE H 1 1 18 5868 1 1 52 VAL HA H 12.138 -2.870 -6.489 1.00 . A A . 33 PHE HA 1 1 18 5869 1 1 52 VAL N N 11.779 -3.409 -4.534 1.00 . A A . 33 PHE N 1 1 18 5870 1 1 52 VAL O O 14.221 -4.245 -6.849 1.00 . A A . 33 PHE O 1 1 18 5871 1 1 53 SER C C 15.277 -6.439 -5.390 1.00 . A A . 34 VAL C 1 1 18 5872 1 1 53 SER CA C 15.618 -5.159 -4.639 1.00 . A A . 34 VAL CA 1 1 18 5873 1 1 53 SER CB C 16.092 -5.516 -3.216 1.00 . A A . 34 VAL CB 1 1 18 5874 1 1 53 SER H H 14.149 -3.920 -3.750 1.00 . A A . 34 VAL H 1 1 18 5875 1 1 53 SER HA H 16.427 -4.661 -5.154 1.00 . A A . 34 VAL HA 1 1 18 5876 1 1 53 SER N N 14.477 -4.252 -4.613 1.00 . A A . 34 VAL N 1 1 18 5877 1 1 53 SER O O 15.794 -6.681 -6.474 1.00 . A A . 34 VAL O 1 1 18 5878 1 1 54 GLY C C 13.656 -8.369 -6.863 1.00 . A A . 35 SER C 1 1 18 5879 1 1 54 GLY CA C 14.039 -8.526 -5.414 1.00 . A A . 35 SER CA 1 1 18 5880 1 1 54 GLY H H 14.060 -7.046 -3.930 1.00 . A A . 35 SER H 1 1 18 5881 1 1 54 GLY N N 14.418 -7.266 -4.804 1.00 . A A . 35 SER N 1 1 18 5882 1 1 54 GLY O O 14.159 -9.104 -7.713 1.00 . A A . 35 SER O 1 1 18 5883 1 1 55 VAL C C 13.671 -7.386 -9.418 1.00 . A A . 36 GLY C 1 1 18 5884 1 1 55 VAL CA C 12.442 -7.208 -8.553 1.00 . A A . 36 GLY CA 1 1 18 5885 1 1 55 VAL H H 12.450 -6.838 -6.461 1.00 . A A . 36 GLY H 1 1 18 5886 1 1 55 VAL N N 12.804 -7.411 -7.166 1.00 . A A . 36 GLY N 1 1 18 5887 1 1 55 VAL O O 13.652 -8.093 -10.425 1.00 . A A . 36 GLY O 1 1 18 5888 1 1 56 ALA C C 16.911 -7.972 -9.084 1.00 . A A . 37 VAL C 1 1 18 5889 1 1 56 ALA CA C 16.035 -6.838 -9.632 1.00 . A A . 37 VAL CA 1 1 18 5890 1 1 56 ALA CB C 16.804 -5.507 -9.505 1.00 . A A . 37 VAL CB 1 1 18 5891 1 1 56 ALA H H 14.697 -6.243 -8.147 1.00 . A A . 37 VAL H 1 1 18 5892 1 1 56 ALA HA H 15.850 -7.017 -10.674 1.00 . A A . 37 VAL HA 1 1 18 5893 1 1 56 ALA N N 14.755 -6.756 -8.973 1.00 . A A . 37 VAL N 1 1 18 5894 1 1 56 ALA O O 17.235 -8.928 -9.789 1.00 . A A . 37 VAL O 1 1 18 5895 1 1 57 SER C C 17.547 -9.948 -6.532 1.00 . A A . 38 ALA C 1 1 18 5896 1 1 57 SER CA C 18.228 -8.741 -7.156 1.00 . A A . 38 ALA CA 1 1 18 5897 1 1 57 SER CB C 19.022 -8.004 -6.081 1.00 . A A . 38 ALA CB 1 1 18 5898 1 1 57 SER H H 17.057 -7.013 -7.334 1.00 . A A . 38 ALA H 1 1 18 5899 1 1 57 SER HA H 18.927 -9.083 -7.891 1.00 . A A . 38 ALA HA 1 1 18 5900 1 1 57 SER HB2 H 18.571 -8.184 -5.109 1.00 . A A . 38 ALA HB2 1 1 18 5901 1 1 57 SER HB3 H 19.014 -6.946 -6.291 1.00 . A A . 38 ALA HB3 1 1 18 5902 1 1 57 SER N N 17.336 -7.807 -7.826 1.00 . A A . 38 ALA N 1 1 18 5903 1 1 57 SER O O 17.668 -11.078 -7.007 1.00 . A A . 38 ALA O 1 1 18 5904 1 1 58 GLY C C 15.102 -11.431 -5.321 1.00 . A A . 39 SER C 1 1 18 5905 1 1 58 GLY CA C 16.242 -10.700 -4.604 1.00 . A A . 39 SER CA 1 1 18 5906 1 1 58 GLY H H 16.891 -8.759 -5.082 1.00 . A A . 39 SER H 1 1 18 5907 1 1 58 GLY N N 16.895 -9.683 -5.411 1.00 . A A . 39 SER N 1 1 18 5908 1 1 58 GLY O O 14.415 -12.254 -4.715 1.00 . A A . 39 SER O 1 1 18 5909 1 1 59 ALA C C 14.232 -13.205 -7.782 1.00 . A A . 40 GLY C 1 1 18 5910 1 1 59 ALA CA C 13.850 -11.801 -7.355 1.00 . A A . 40 GLY CA 1 1 18 5911 1 1 59 ALA H H 15.474 -10.485 -7.050 1.00 . A A . 40 GLY H 1 1 18 5912 1 1 59 ALA N N 14.905 -11.143 -6.606 1.00 . A A . 40 GLY N 1 1 18 5913 1 1 59 ALA O O 13.600 -14.179 -7.375 1.00 . A A . 40 GLY O 1 1 18 5914 1 1 60 GLY C C 14.618 -15.367 -9.788 1.00 . A A . 41 ALA C 1 1 18 5915 1 1 60 GLY CA C 15.738 -14.603 -9.089 1.00 . A A . 41 ALA CA 1 1 18 5916 1 1 60 GLY H H 15.735 -12.496 -8.895 1.00 . A A . 41 ALA H 1 1 18 5917 1 1 60 GLY N N 15.271 -13.309 -8.606 1.00 . A A . 41 ALA N 1 1 18 5918 1 1 60 GLY O O 14.550 -16.593 -9.716 1.00 . A A . 41 ALA O 1 1 18 5919 1 1 61 SER C C 12.718 -15.067 -12.670 1.00 . A A . 42 GLY C 1 1 18 5920 1 1 61 SER CA C 12.634 -15.252 -11.167 1.00 . A A . 42 GLY CA 1 1 18 5921 1 1 61 SER H H 13.847 -13.657 -10.484 1.00 . A A . 42 GLY H 1 1 18 5922 1 1 61 SER N N 13.741 -14.631 -10.464 1.00 . A A . 42 GLY N 1 1 18 5923 1 1 61 SER O O 12.134 -15.840 -13.430 1.00 . A A . 42 GLY O 1 1 18 5924 1 1 62 ILE C C 15.031 -13.350 -14.844 1.00 . A A . 43 SER C 1 1 18 5925 1 1 62 ILE CA C 13.598 -13.759 -14.524 1.00 . A A . 43 SER CA 1 1 18 5926 1 1 62 ILE CB C 12.632 -12.654 -14.955 1.00 . A A . 43 SER CB 1 1 18 5927 1 1 62 ILE H H 13.886 -13.457 -12.451 1.00 . A A . 43 SER H 1 1 18 5928 1 1 62 ILE HA H 13.363 -14.662 -15.068 1.00 . A A . 43 SER HA 1 1 18 5929 1 1 62 ILE N N 13.444 -14.040 -13.102 1.00 . A A . 43 SER N 1 1 18 5930 1 1 62 ILE O O 15.268 -12.505 -15.708 1.00 . A A . 43 SER O 1 1 18 5931 1 1 63 GLY C C 17.968 -14.476 -15.492 1.00 . A A . 44 ILE C 1 1 18 5932 1 1 63 GLY CA C 17.389 -13.658 -14.341 1.00 . A A . 44 ILE CA 1 1 18 5933 1 1 63 GLY H H 15.737 -14.613 -13.467 1.00 . A A . 44 ILE H 1 1 18 5934 1 1 63 GLY N N 15.984 -13.953 -14.141 1.00 . A A . 44 ILE N 1 1 18 5935 1 1 63 GLY O O 18.992 -15.144 -15.341 1.00 . A A . 44 ILE O 1 1 18 5936 1 1 64 ARG C C 16.884 -16.340 -18.133 1.00 . A A . 45 GLY C 1 1 18 5937 1 1 64 ARG CA C 17.772 -15.156 -17.803 1.00 . A A . 45 GLY CA 1 1 18 5938 1 1 64 ARG H H 16.498 -13.870 -16.706 1.00 . A A . 45 GLY H 1 1 18 5939 1 1 64 ARG N N 17.308 -14.419 -16.643 1.00 . A A . 45 GLY N 1 1 18 5940 1 1 64 ARG O O 17.343 -17.329 -18.703 1.00 . A A . 45 GLY O 1 1 19 5941 1 1 20 ASN C C 17.323 -0.424 18.409 1.00 . A A . 1 VAL C 1 1 19 5942 1 1 20 ASN CA C 18.398 0.642 18.596 1.00 . A A . 1 VAL CA 1 1 19 5943 1 1 20 ASN CB C 18.010 1.905 17.799 1.00 . A A . 1 VAL CB 1 1 19 5944 1 1 20 ASN H H 20.021 0.322 17.278 1.00 . A A . 1 VAL H 1 1 19 5945 1 1 20 ASN HA H 18.453 0.905 19.643 1.00 . A A . 1 VAL HA 1 1 19 5946 1 1 20 ASN N N 19.706 0.144 18.188 1.00 . A A . 1 VAL N 1 1 19 5947 1 1 20 ASN O O 17.510 -1.383 17.660 1.00 . A A . 1 VAL O 1 1 19 5948 1 1 21 TYR C C 13.769 -0.477 18.761 1.00 . A A . 2 ASN C 1 1 19 5949 1 1 21 TYR CA C 15.093 -1.200 19.001 1.00 . A A . 2 ASN CA 1 1 19 5950 1 1 21 TYR CB C 15.009 -2.041 20.277 1.00 . A A . 2 ASN CB 1 1 19 5951 1 1 21 TYR CG C 15.853 -3.297 20.198 1.00 . A A . 2 ASN CG 1 1 19 5952 1 1 21 TYR H H 16.104 0.532 19.675 1.00 . A A . 2 ASN H 1 1 19 5953 1 1 21 TYR HA H 15.288 -1.854 18.163 1.00 . A A . 2 ASN HA 1 1 19 5954 1 1 21 TYR HB2 H 15.353 -1.450 21.113 1.00 . A A . 2 ASN HB2 1 1 19 5955 1 1 21 TYR HB3 H 13.981 -2.328 20.444 1.00 . A A . 2 ASN HB3 1 1 19 5956 1 1 21 TYR N N 16.196 -0.251 19.094 1.00 . A A . 2 ASN N 1 1 19 5957 1 1 21 TYR O O 12.805 -0.665 19.503 1.00 . A A . 2 ASN O 1 1 19 5958 1 1 22 GLY C C 11.870 1.712 18.599 1.00 . A A . 3 TYR C 1 1 19 5959 1 1 22 GLY CA C 12.535 1.109 17.363 1.00 . A A . 3 TYR CA 1 1 19 5960 1 1 22 GLY H H 14.539 0.451 17.166 1.00 . A A . 3 TYR H 1 1 19 5961 1 1 22 GLY N N 13.735 0.349 17.717 1.00 . A A . 3 TYR N 1 1 19 5962 1 1 22 GLY O O 10.889 1.174 19.114 1.00 . A A . 3 TYR O 1 1 19 5963 1 1 23 ASN C C 12.559 4.793 20.558 1.00 . A A . 4 GLY C 1 1 19 5964 1 1 23 ASN CA C 11.857 3.487 20.239 1.00 . A A . 4 GLY CA 1 1 19 5965 1 1 23 ASN H H 13.192 3.214 18.617 1.00 . A A . 4 GLY H 1 1 19 5966 1 1 23 ASN N N 12.410 2.831 19.069 1.00 . A A . 4 GLY N 1 1 19 5967 1 1 23 ASN O O 13.415 4.845 21.441 1.00 . A A . 4 GLY O 1 1 19 5968 1 1 24 GLY C C 12.607 7.628 21.491 1.00 . A A . 5 ASN C 1 1 19 5969 1 1 24 GLY CA C 12.799 7.162 20.050 1.00 . A A . 5 ASN CA 1 1 19 5970 1 1 24 GLY H H 11.509 5.746 19.147 1.00 . A A . 5 ASN H 1 1 19 5971 1 1 24 GLY N N 12.197 5.850 19.837 1.00 . A A . 5 ASN N 1 1 19 5972 1 1 24 GLY O O 13.362 8.462 21.990 1.00 . A A . 5 ASN O 1 1 19 5973 1 1 25 VAL C C 10.692 8.819 23.658 1.00 . A A . 6 GLY C 1 1 19 5974 1 1 25 VAL CA C 11.325 7.446 23.531 1.00 . A A . 6 GLY CA 1 1 19 5975 1 1 25 VAL H H 11.031 6.420 21.704 1.00 . A A . 6 GLY H 1 1 19 5976 1 1 25 VAL N N 11.596 7.080 22.153 1.00 . A A . 6 GLY N 1 1 19 5977 1 1 25 VAL O O 11.380 9.804 23.925 1.00 . A A . 6 GLY O 1 1 19 5978 1 1 26 SER C C 8.296 10.449 25.022 1.00 . A A . 7 VAL C 1 1 19 5979 1 1 26 SER CA C 8.652 10.145 23.571 1.00 . A A . 7 VAL CA 1 1 19 5980 1 1 26 SER CB C 7.360 10.125 22.730 1.00 . A A . 7 VAL CB 1 1 19 5981 1 1 26 SER H H 8.883 8.062 23.264 1.00 . A A . 7 VAL H 1 1 19 5982 1 1 26 SER HA H 9.293 10.929 23.195 1.00 . A A . 7 VAL HA 1 1 19 5983 1 1 26 SER N N 9.378 8.883 23.470 1.00 . A A . 7 VAL N 1 1 19 5984 1 1 26 SER O O 8.316 9.560 25.874 1.00 . A A . 7 VAL O 1 1 19 5985 1 1 27 CYS C C 6.497 13.155 26.640 1.00 . A A . 8 SER C 1 1 19 5986 1 1 27 CYS CA C 7.614 12.117 26.653 1.00 . A A . 8 SER CA 1 1 19 5987 1 1 27 CYS CB C 8.838 12.681 27.377 1.00 . A A . 8 SER CB 1 1 19 5988 1 1 27 CYS H H 7.975 12.374 24.582 1.00 . A A . 8 SER H 1 1 19 5989 1 1 27 CYS HA H 7.267 11.242 27.182 1.00 . A A . 8 SER HA 1 1 19 5990 1 1 27 CYS HB2 H 9.147 13.597 26.899 1.00 . A A . 8 SER HB2 1 1 19 5991 1 1 27 CYS HB3 H 8.582 12.881 28.408 1.00 . A A . 8 SER HB3 1 1 19 5992 1 1 27 CYS N N 7.971 11.707 25.300 1.00 . A A . 8 SER N 1 1 19 5993 1 1 27 CYS O O 6.680 14.274 26.159 1.00 . A A . 8 SER O 1 1 19 5994 1 1 28 SER C C 4.056 14.273 28.632 1.00 . A A . 9 CYS C 1 1 19 5995 1 1 28 SER CA C 4.192 13.672 27.237 1.00 . A A . 9 CYS CA 1 1 19 5996 1 1 28 SER CB C 2.906 12.923 26.868 1.00 . A A . 9 CYS CB 1 1 19 5997 1 1 28 SER H H 5.263 11.874 27.546 1.00 . A A . 9 CYS H 1 1 19 5998 1 1 28 SER HA H 4.353 14.469 26.527 1.00 . A A . 9 CYS HA 1 1 19 5999 1 1 28 SER HB2 H 2.498 12.468 27.758 1.00 . A A . 9 CYS HB2 1 1 19 6000 1 1 28 SER HB3 H 2.191 13.629 26.471 1.00 . A A . 9 CYS HB3 1 1 19 6001 1 1 28 SER N N 5.342 12.777 27.177 1.00 . A A . 9 CYS N 1 1 19 6002 1 1 28 SER O O 3.830 13.555 29.607 1.00 . A A . 9 CYS O 1 1 19 6003 1 1 29 LYS C C 3.397 17.628 29.857 1.00 . A A . 10 SER C 1 1 19 6004 1 1 29 LYS CA C 4.093 16.280 30.009 1.00 . A A . 10 SER CA 1 1 19 6005 1 1 29 LYS CB C 5.480 16.478 30.622 1.00 . A A . 10 SER CB 1 1 19 6006 1 1 29 LYS H H 4.379 16.111 27.913 1.00 . A A . 10 SER H 1 1 19 6007 1 1 29 LYS HA H 3.505 15.659 30.668 1.00 . A A . 10 SER HA 1 1 19 6008 1 1 29 LYS HB2 H 5.977 17.296 30.123 1.00 . A A . 10 SER HB2 1 1 19 6009 1 1 29 LYS HB3 H 5.374 16.705 31.672 1.00 . A A . 10 SER HB3 1 1 19 6010 1 1 29 LYS N N 4.199 15.591 28.724 1.00 . A A . 10 SER N 1 1 19 6011 1 1 29 LYS O O 3.929 18.548 29.235 1.00 . A A . 10 SER O 1 1 19 6012 1 1 30 THR C C 1.107 19.386 28.945 1.00 . A A . 11 LYS C 1 1 19 6013 1 1 30 THR CA C 1.426 18.971 30.380 1.00 . A A . 11 LYS CA 1 1 19 6014 1 1 30 THR CB C 2.189 20.083 31.084 1.00 . A A . 11 LYS CB 1 1 19 6015 1 1 30 THR H H 1.843 16.973 30.924 1.00 . A A . 11 LYS H 1 1 19 6016 1 1 30 THR HA H 0.501 18.801 30.901 1.00 . A A . 11 LYS HA 1 1 19 6017 1 1 30 THR N N 2.204 17.738 30.437 1.00 . A A . 11 LYS N 1 1 19 6018 1 1 30 THR O O 0.529 20.448 28.713 1.00 . A A . 11 LYS O 1 1 19 6019 1 1 31 LYS C C 1.129 17.525 25.805 1.00 . A A . 12 THR C 1 1 19 6020 1 1 31 LYS CA C 1.248 18.832 26.588 1.00 . A A . 12 THR CA 1 1 19 6021 1 1 31 LYS CB C 2.379 19.720 26.052 1.00 . A A . 12 THR CB 1 1 19 6022 1 1 31 LYS H H 1.939 17.728 28.228 1.00 . A A . 12 THR H 1 1 19 6023 1 1 31 LYS HA H 0.318 19.364 26.513 1.00 . A A . 12 THR HA 1 1 19 6024 1 1 31 LYS N N 1.488 18.552 27.988 1.00 . A A . 12 THR N 1 1 19 6025 1 1 31 LYS O O 1.438 16.454 26.328 1.00 . A A . 12 THR O 1 1 19 6026 1 1 32 CYS C C 1.855 15.656 23.636 1.00 . A A . 13 LYS C 1 1 19 6027 1 1 32 CYS CA C 0.541 16.432 23.713 1.00 . A A . 13 LYS CA 1 1 19 6028 1 1 32 CYS CB C 0.085 16.832 22.308 1.00 . A A . 13 LYS CB 1 1 19 6029 1 1 32 CYS H H 0.456 18.494 24.189 1.00 . A A . 13 LYS H 1 1 19 6030 1 1 32 CYS HA H -0.211 15.798 24.160 1.00 . A A . 13 LYS HA 1 1 19 6031 1 1 32 CYS HB2 H -0.106 15.937 21.735 1.00 . A A . 13 LYS HB2 1 1 19 6032 1 1 32 CYS HB3 H -0.831 17.400 22.388 1.00 . A A . 13 LYS HB3 1 1 19 6033 1 1 32 CYS N N 0.687 17.614 24.555 1.00 . A A . 13 LYS N 1 1 19 6034 1 1 32 CYS O O 2.801 15.946 24.370 1.00 . A A . 13 LYS O 1 1 19 6035 1 1 33 SER C C 3.667 14.171 21.189 1.00 . A A . 14 CYS C 1 1 19 6036 1 1 33 SER CA C 3.084 13.874 22.564 1.00 . A A . 14 CYS CA 1 1 19 6037 1 1 33 SER CB C 2.730 12.390 22.728 1.00 . A A . 14 CYS CB 1 1 19 6038 1 1 33 SER H H 1.150 14.481 22.176 1.00 . A A . 14 CYS H 1 1 19 6039 1 1 33 SER HA H 3.804 14.155 23.322 1.00 . A A . 14 CYS HA 1 1 19 6040 1 1 33 SER HB2 H 2.165 12.064 21.868 1.00 . A A . 14 CYS HB2 1 1 19 6041 1 1 33 SER HB3 H 3.643 11.816 22.793 1.00 . A A . 14 CYS HB3 1 1 19 6042 1 1 33 SER N N 1.915 14.676 22.745 1.00 . A A . 14 CYS N 1 1 19 6043 1 1 33 SER O O 3.760 15.326 20.774 1.00 . A A . 14 CYS O 1 1 19 6044 1 1 34 VAL C C 4.291 12.041 18.303 1.00 . A A . 15 SER C 1 1 19 6045 1 1 34 VAL CA C 4.632 13.254 19.164 1.00 . A A . 15 SER CA 1 1 19 6046 1 1 34 VAL CB C 6.151 13.416 19.258 1.00 . A A . 15 SER CB 1 1 19 6047 1 1 34 VAL H H 3.928 12.250 20.887 1.00 . A A . 15 SER H 1 1 19 6048 1 1 34 VAL HA H 4.213 14.135 18.704 1.00 . A A . 15 SER HA 1 1 19 6049 1 1 34 VAL N N 4.054 13.127 20.496 1.00 . A A . 15 SER N 1 1 19 6050 1 1 34 VAL O O 4.512 10.899 18.706 1.00 . A A . 15 SER O 1 1 19 6051 1 1 35 ASN C C 4.630 10.598 15.570 1.00 . A A . 16 VAL C 1 1 19 6052 1 1 35 ASN CA C 3.389 11.229 16.193 1.00 . A A . 16 VAL CA 1 1 19 6053 1 1 35 ASN CB C 2.469 11.746 15.070 1.00 . A A . 16 VAL CB 1 1 19 6054 1 1 35 ASN H H 3.608 13.230 16.847 1.00 . A A . 16 VAL H 1 1 19 6055 1 1 35 ASN HA H 2.855 10.475 16.752 1.00 . A A . 16 VAL HA 1 1 19 6056 1 1 35 ASN N N 3.756 12.299 17.113 1.00 . A A . 16 VAL N 1 1 19 6057 1 1 35 ASN O O 5.705 11.200 15.560 1.00 . A A . 16 VAL O 1 1 19 6058 1 1 36 TRP C C 5.623 8.923 12.924 1.00 . A A . 17 ASN C 1 1 19 6059 1 1 36 TRP CA C 5.589 8.675 14.430 1.00 . A A . 17 ASN CA 1 1 19 6060 1 1 36 TRP CB C 5.483 7.175 14.711 1.00 . A A . 17 ASN CB 1 1 19 6061 1 1 36 TRP CG C 5.571 6.857 16.191 1.00 . A A . 17 ASN CG 1 1 19 6062 1 1 36 TRP H H 3.597 8.954 15.091 1.00 . A A . 17 ASN H 1 1 19 6063 1 1 36 TRP HA H 6.504 9.049 14.864 1.00 . A A . 17 ASN HA 1 1 19 6064 1 1 36 TRP HB2 H 4.536 6.811 14.340 1.00 . A A . 17 ASN HB2 1 1 19 6065 1 1 36 TRP HB3 H 6.285 6.662 14.202 1.00 . A A . 17 ASN HB3 1 1 19 6066 1 1 36 TRP N N 4.477 9.384 15.053 1.00 . A A . 17 ASN N 1 1 19 6067 1 1 36 TRP O O 5.842 8.002 12.138 1.00 . A A . 17 ASN O 1 1 19 6068 1 1 37 GLY C C 6.823 10.460 10.532 1.00 . A A . 18 TRP C 1 1 19 6069 1 1 37 GLY CA C 5.413 10.542 11.118 1.00 . A A . 18 TRP CA 1 1 19 6070 1 1 37 GLY H H 5.238 10.865 13.198 1.00 . A A . 18 TRP H 1 1 19 6071 1 1 37 GLY N N 5.405 10.174 12.528 1.00 . A A . 18 TRP N 1 1 19 6072 1 1 37 GLY O O 7.001 10.514 9.315 1.00 . A A . 18 TRP O 1 1 19 6073 1 1 38 GLN C C 9.763 8.836 11.109 1.00 . A A . 19 GLY C 1 1 19 6074 1 1 38 GLN CA C 9.197 10.233 10.946 1.00 . A A . 19 GLY CA 1 1 19 6075 1 1 38 GLN H H 7.624 10.282 12.360 1.00 . A A . 19 GLY H 1 1 19 6076 1 1 38 GLN N N 7.822 10.324 11.402 1.00 . A A . 19 GLY N 1 1 19 6077 1 1 38 GLN O O 10.313 8.263 10.167 1.00 . A A . 19 GLY O 1 1 19 6078 1 1 39 ALA C C 9.539 5.952 11.576 1.00 . A A . 20 GLN C 1 1 19 6079 1 1 39 ALA CA C 10.113 6.938 12.582 1.00 . A A . 20 GLN CA 1 1 19 6080 1 1 39 ALA CB C 9.753 6.514 14.008 1.00 . A A . 20 GLN CB 1 1 19 6081 1 1 39 ALA H H 9.166 8.780 13.019 1.00 . A A . 20 GLN H 1 1 19 6082 1 1 39 ALA HA H 11.189 6.952 12.476 1.00 . A A . 20 GLN HA 1 1 19 6083 1 1 39 ALA HB2 H 9.474 7.392 14.572 1.00 . A A . 20 GLN HB2 1 1 19 6084 1 1 39 ALA HB3 H 8.909 5.839 13.969 1.00 . A A . 20 GLN HB3 1 1 19 6085 1 1 39 ALA N N 9.619 8.280 12.308 1.00 . A A . 20 GLN N 1 1 19 6086 1 1 39 ALA O O 10.276 5.365 10.784 1.00 . A A . 20 GLN O 1 1 19 6087 1 1 40 PHE C C 7.716 5.333 9.219 1.00 . A A . 21 ALA C 1 1 19 6088 1 1 40 PHE CA C 7.578 4.866 10.654 1.00 . A A . 21 ALA CA 1 1 19 6089 1 1 40 PHE CB C 6.129 4.609 11.013 1.00 . A A . 21 ALA CB 1 1 19 6090 1 1 40 PHE H H 7.671 6.275 12.236 1.00 . A A . 21 ALA H 1 1 19 6091 1 1 40 PHE HA H 8.108 3.952 10.731 1.00 . A A . 21 ALA HA 1 1 19 6092 1 1 40 PHE HB2 H 5.860 3.610 10.696 1.00 . A A . 21 ALA HB2 1 1 19 6093 1 1 40 PHE HB3 H 5.500 5.330 10.512 1.00 . A A . 21 ALA HB3 1 1 19 6094 1 1 40 PHE N N 8.218 5.777 11.594 1.00 . A A . 21 ALA N 1 1 19 6095 1 1 40 PHE O O 7.324 4.641 8.280 1.00 . A A . 21 ALA O 1 1 19 6096 1 1 41 GLN C C 9.687 6.206 7.126 1.00 . A A . 22 PHE C 1 1 19 6097 1 1 41 GLN CA C 8.576 7.032 7.740 1.00 . A A . 22 PHE CA 1 1 19 6098 1 1 41 GLN CB C 8.980 8.505 7.816 1.00 . A A . 22 PHE CB 1 1 19 6099 1 1 41 GLN CG C 8.681 9.274 6.561 1.00 . A A . 22 PHE CG 1 1 19 6100 1 1 41 GLN H H 8.637 6.948 9.843 1.00 . A A . 22 PHE H 1 1 19 6101 1 1 41 GLN HA H 7.680 6.925 7.151 1.00 . A A . 22 PHE HA 1 1 19 6102 1 1 41 GLN HB2 H 8.449 8.976 8.629 1.00 . A A . 22 PHE HB2 1 1 19 6103 1 1 41 GLN HB3 H 10.042 8.572 8.001 1.00 . A A . 22 PHE HB3 1 1 19 6104 1 1 41 GLN N N 8.321 6.485 9.058 1.00 . A A . 22 PHE N 1 1 19 6105 1 1 41 GLN O O 9.648 5.842 5.950 1.00 . A A . 22 PHE O 1 1 19 6106 1 1 42 GLU C C 11.287 3.593 7.443 1.00 . A A . 23 GLN C 1 1 19 6107 1 1 42 GLU CA C 11.771 5.036 7.576 1.00 . A A . 23 GLN CA 1 1 19 6108 1 1 42 GLU CB C 12.893 5.129 8.615 1.00 . A A . 23 GLN CB 1 1 19 6109 1 1 42 GLU CD C 13.788 7.252 7.579 1.00 . A A . 23 GLN CD 1 1 19 6110 1 1 42 GLU CG C 14.121 5.876 8.122 1.00 . A A . 23 GLN CG 1 1 19 6111 1 1 42 GLU H H 10.595 6.175 8.906 1.00 . A A . 23 GLN H 1 1 19 6112 1 1 42 GLU HA H 12.134 5.383 6.620 1.00 . A A . 23 GLN HA 1 1 19 6113 1 1 42 GLU HB2 H 12.515 5.640 9.493 1.00 . A A . 23 GLN HB2 1 1 19 6114 1 1 42 GLU HB3 H 13.194 4.130 8.896 1.00 . A A . 23 GLN HB3 1 1 19 6115 1 1 42 GLU HG2 H 14.812 5.988 8.943 1.00 . A A . 23 GLN HG2 1 1 19 6116 1 1 42 GLU HG3 H 14.587 5.298 7.337 1.00 . A A . 23 GLN HG3 1 1 19 6117 1 1 42 GLU N N 10.656 5.874 7.972 1.00 . A A . 23 GLN N 1 1 19 6118 1 1 42 GLU O O 11.864 2.795 6.704 1.00 . A A . 23 GLN O 1 1 19 6119 1 1 42 GLU OE1 O 12.877 7.921 8.067 1.00 . A A . 23 GLN OE1 1 1 19 6120 1 1 43 ARG C C 9.119 1.615 6.727 1.00 . A A . 24 GLU C 1 1 19 6121 1 1 43 ARG CA C 9.616 1.943 8.129 1.00 . A A . 24 GLU CA 1 1 19 6122 1 1 43 ARG CB C 8.458 1.844 9.123 1.00 . A A . 24 GLU CB 1 1 19 6123 1 1 43 ARG CD C 8.515 -0.023 10.824 1.00 . A A . 24 GLU CD 1 1 19 6124 1 1 43 ARG CG C 8.888 1.413 10.516 1.00 . A A . 24 GLU CG 1 1 19 6125 1 1 43 ARG H H 9.788 3.962 8.724 1.00 . A A . 24 GLU H 1 1 19 6126 1 1 43 ARG HA H 10.375 1.238 8.409 1.00 . A A . 24 GLU HA 1 1 19 6127 1 1 43 ARG HB2 H 7.980 2.807 9.200 1.00 . A A . 24 GLU HB2 1 1 19 6128 1 1 43 ARG HB3 H 7.741 1.126 8.754 1.00 . A A . 24 GLU HB3 1 1 19 6129 1 1 43 ARG HG2 H 9.960 1.515 10.596 1.00 . A A . 24 GLU HG2 1 1 19 6130 1 1 43 ARG HG3 H 8.412 2.057 11.242 1.00 . A A . 24 GLU HG3 1 1 19 6131 1 1 43 ARG N N 10.205 3.276 8.162 1.00 . A A . 24 GLU N 1 1 19 6132 1 1 43 ARG O O 9.461 0.577 6.160 1.00 . A A . 24 GLU O 1 1 19 6133 1 1 44 TYR C C 8.871 2.359 3.790 1.00 . A A . 25 ARG C 1 1 19 6134 1 1 44 TYR CA C 7.764 2.333 4.836 1.00 . A A . 25 ARG CA 1 1 19 6135 1 1 44 TYR CB C 6.730 3.419 4.534 1.00 . A A . 25 ARG CB 1 1 19 6136 1 1 44 TYR CG C 5.382 3.178 5.198 1.00 . A A . 25 ARG CG 1 1 19 6137 1 1 44 TYR CZ C 2.500 4.532 3.274 1.00 . A A . 25 ARG CZ 1 1 19 6138 1 1 44 TYR H H 8.078 3.321 6.677 1.00 . A A . 25 ARG H 1 1 19 6139 1 1 44 TYR HA H 7.283 1.372 4.806 1.00 . A A . 25 ARG HA 1 1 19 6140 1 1 44 TYR HB2 H 7.111 4.370 4.880 1.00 . A A . 25 ARG HB2 1 1 19 6141 1 1 44 TYR HB3 H 6.579 3.470 3.466 1.00 . A A . 25 ARG HB3 1 1 19 6142 1 1 44 TYR HD2 H 4.660 2.611 3.276 1.00 . A A . 25 ARG HD2 1 1 19 6143 1 1 44 TYR N N 8.312 2.515 6.173 1.00 . A A . 25 ARG N 1 1 19 6144 1 1 44 TYR O O 8.763 1.729 2.739 1.00 . A A . 25 ARG O 1 1 19 6145 1 1 45 THR C C 11.763 1.850 3.035 1.00 . A A . 26 TYR C 1 1 19 6146 1 1 45 THR CA C 11.069 3.199 3.186 1.00 . A A . 26 TYR CA 1 1 19 6147 1 1 45 THR CB C 12.060 4.246 3.698 1.00 . A A . 26 TYR CB 1 1 19 6148 1 1 45 THR H H 9.958 3.563 4.946 1.00 . A A . 26 TYR H 1 1 19 6149 1 1 45 THR HA H 10.693 3.508 2.223 1.00 . A A . 26 TYR HA 1 1 19 6150 1 1 45 THR N N 9.935 3.090 4.092 1.00 . A A . 26 TYR N 1 1 19 6151 1 1 45 THR O O 12.105 1.436 1.927 1.00 . A A . 26 TYR O 1 1 19 6152 1 1 46 ALA C C 11.796 -1.141 3.350 1.00 . A A . 27 THR C 1 1 19 6153 1 1 46 ALA CA C 12.613 -0.137 4.153 1.00 . A A . 27 THR CA 1 1 19 6154 1 1 46 ALA CB C 12.801 -0.640 5.586 1.00 . A A . 27 THR CB 1 1 19 6155 1 1 46 ALA H H 11.667 1.551 5.009 1.00 . A A . 27 THR H 1 1 19 6156 1 1 46 ALA HA H 13.582 -0.024 3.691 1.00 . A A . 27 THR HA 1 1 19 6157 1 1 46 ALA N N 11.965 1.169 4.158 1.00 . A A . 27 THR N 1 1 19 6158 1 1 46 ALA O O 12.347 -1.946 2.598 1.00 . A A . 27 THR O 1 1 19 6159 1 1 47 GLY C C 9.647 -1.744 1.295 1.00 . A A . 28 ALA C 1 1 19 6160 1 1 47 GLY CA C 9.583 -1.988 2.798 1.00 . A A . 28 ALA CA 1 1 19 6161 1 1 47 GLY H H 10.096 -0.423 4.122 1.00 . A A . 28 ALA H 1 1 19 6162 1 1 47 GLY N N 10.478 -1.087 3.510 1.00 . A A . 28 ALA N 1 1 19 6163 1 1 47 GLY O O 9.482 -2.666 0.497 1.00 . A A . 28 ALA O 1 1 19 6164 1 1 48 ILE C C 11.205 -0.723 -1.156 1.00 . A A . 29 GLY C 1 1 19 6165 1 1 48 ILE CA C 9.972 -0.147 -0.491 1.00 . A A . 29 GLY CA 1 1 19 6166 1 1 48 ILE H H 10.013 0.200 1.596 1.00 . A A . 29 GLY H 1 1 19 6167 1 1 48 ILE N N 9.889 -0.493 0.915 1.00 . A A . 29 GLY N 1 1 19 6168 1 1 48 ILE O O 11.119 -1.315 -2.232 1.00 . A A . 29 GLY O 1 1 19 6169 1 1 49 ASN C C 13.561 -2.579 -1.205 1.00 . A A . 30 ILE C 1 1 19 6170 1 1 49 ASN CA C 13.612 -1.063 -1.051 1.00 . A A . 30 ILE CA 1 1 19 6171 1 1 49 ASN CB C 14.805 -0.683 -0.152 1.00 . A A . 30 ILE CB 1 1 19 6172 1 1 49 ASN H H 12.361 -0.073 0.340 1.00 . A A . 30 ILE H 1 1 19 6173 1 1 49 ASN HA H 13.763 -0.617 -2.023 1.00 . A A . 30 ILE HA 1 1 19 6174 1 1 49 ASN N N 12.357 -0.552 -0.514 1.00 . A A . 30 ILE N 1 1 19 6175 1 1 49 ASN O O 14.173 -3.142 -2.112 1.00 . A A . 30 ILE O 1 1 19 6176 1 1 50 SER C C 12.184 -5.145 -1.715 1.00 . A A . 31 ASN C 1 1 19 6177 1 1 50 SER CA C 12.686 -4.686 -0.350 1.00 . A A . 31 ASN CA 1 1 19 6178 1 1 50 SER CB C 11.729 -5.156 0.749 1.00 . A A . 31 ASN CB 1 1 19 6179 1 1 50 SER H H 12.358 -2.727 0.383 1.00 . A A . 31 ASN H 1 1 19 6180 1 1 50 SER HA H 13.661 -5.115 -0.175 1.00 . A A . 31 ASN HA 1 1 19 6181 1 1 50 SER HB2 H 11.258 -4.295 1.200 1.00 . A A . 31 ASN HB2 1 1 19 6182 1 1 50 SER HB3 H 10.970 -5.788 0.313 1.00 . A A . 31 ASN HB3 1 1 19 6183 1 1 50 SER N N 12.823 -3.233 -0.313 1.00 . A A . 31 ASN N 1 1 19 6184 1 1 50 SER O O 12.896 -5.825 -2.453 1.00 . A A . 31 ASN O 1 1 19 6185 1 1 51 PHE C C 11.201 -4.569 -4.476 1.00 . A A . 32 SER C 1 1 19 6186 1 1 51 PHE CA C 10.365 -5.125 -3.329 1.00 . A A . 32 SER CA 1 1 19 6187 1 1 51 PHE CB C 8.931 -4.601 -3.422 1.00 . A A . 32 SER CB 1 1 19 6188 1 1 51 PHE H H 10.439 -4.213 -1.421 1.00 . A A . 32 SER H 1 1 19 6189 1 1 51 PHE HA H 10.353 -6.202 -3.395 1.00 . A A . 32 SER HA 1 1 19 6190 1 1 51 PHE HB2 H 8.517 -4.511 -2.429 1.00 . A A . 32 SER HB2 1 1 19 6191 1 1 51 PHE HB3 H 8.935 -3.632 -3.900 1.00 . A A . 32 SER HB3 1 1 19 6192 1 1 51 PHE N N 10.956 -4.760 -2.047 1.00 . A A . 32 SER N 1 1 19 6193 1 1 51 PHE O O 11.286 -5.170 -5.547 1.00 . A A . 32 SER O 1 1 19 6194 1 1 52 VAL C C 13.848 -3.676 -5.590 1.00 . A A . 33 PHE C 1 1 19 6195 1 1 52 VAL CA C 12.664 -2.778 -5.239 1.00 . A A . 33 PHE CA 1 1 19 6196 1 1 52 VAL CB C 13.146 -1.415 -4.718 1.00 . A A . 33 PHE CB 1 1 19 6197 1 1 52 VAL H H 11.721 -2.993 -3.360 1.00 . A A . 33 PHE H 1 1 19 6198 1 1 52 VAL HA H 12.066 -2.626 -6.124 1.00 . A A . 33 PHE HA 1 1 19 6199 1 1 52 VAL N N 11.824 -3.419 -4.236 1.00 . A A . 33 PHE N 1 1 19 6200 1 1 52 VAL O O 14.183 -3.851 -6.762 1.00 . A A . 33 PHE O 1 1 19 6201 1 1 53 SER C C 15.231 -6.332 -5.611 1.00 . A A . 34 VAL C 1 1 19 6202 1 1 53 SER CA C 15.618 -5.127 -4.760 1.00 . A A . 34 VAL CA 1 1 19 6203 1 1 53 SER CB C 16.192 -5.603 -3.409 1.00 . A A . 34 VAL CB 1 1 19 6204 1 1 53 SER H H 14.159 -4.067 -3.654 1.00 . A A . 34 VAL H 1 1 19 6205 1 1 53 SER HA H 16.386 -4.568 -5.281 1.00 . A A . 34 VAL HA 1 1 19 6206 1 1 53 SER N N 14.475 -4.244 -4.565 1.00 . A A . 34 VAL N 1 1 19 6207 1 1 53 SER O O 15.580 -6.402 -6.782 1.00 . A A . 34 VAL O 1 1 19 6208 1 1 54 GLY C C 13.520 -8.194 -7.074 1.00 . A A . 35 SER C 1 1 19 6209 1 1 54 GLY CA C 14.120 -8.489 -5.719 1.00 . A A . 35 SER CA 1 1 19 6210 1 1 54 GLY H H 14.300 -7.205 -4.080 1.00 . A A . 35 SER H 1 1 19 6211 1 1 54 GLY N N 14.522 -7.287 -5.018 1.00 . A A . 35 SER N 1 1 19 6212 1 1 54 GLY O O 13.636 -9.009 -7.990 1.00 . A A . 35 SER O 1 1 19 6213 1 1 55 VAL C C 13.589 -6.751 -9.533 1.00 . A A . 36 GLY C 1 1 19 6214 1 1 55 VAL CA C 12.436 -6.698 -8.553 1.00 . A A . 36 GLY CA 1 1 19 6215 1 1 55 VAL H H 12.913 -6.377 -6.513 1.00 . A A . 36 GLY H 1 1 19 6216 1 1 55 VAL N N 12.944 -7.025 -7.245 1.00 . A A . 36 GLY N 1 1 19 6217 1 1 55 VAL O O 13.525 -7.408 -10.572 1.00 . A A . 36 GLY O 1 1 19 6218 1 1 56 ALA C C 16.891 -7.103 -9.523 1.00 . A A . 37 VAL C 1 1 19 6219 1 1 56 ALA CA C 15.886 -6.010 -9.920 1.00 . A A . 37 VAL CA 1 1 19 6220 1 1 56 ALA CB C 16.565 -4.636 -9.749 1.00 . A A . 37 VAL CB 1 1 19 6221 1 1 56 ALA H H 14.637 -5.595 -8.300 1.00 . A A . 37 VAL H 1 1 19 6222 1 1 56 ALA HA H 15.627 -6.129 -10.956 1.00 . A A . 37 VAL HA 1 1 19 6223 1 1 56 ALA N N 14.662 -6.065 -9.152 1.00 . A A . 37 VAL N 1 1 19 6224 1 1 56 ALA O O 17.381 -7.852 -10.367 1.00 . A A . 37 VAL O 1 1 19 6225 1 1 57 SER C C 17.722 -9.432 -7.361 1.00 . A A . 38 ALA C 1 1 19 6226 1 1 57 SER CA C 18.235 -8.042 -7.690 1.00 . A A . 38 ALA CA 1 1 19 6227 1 1 57 SER CB C 18.850 -7.436 -6.434 1.00 . A A . 38 ALA CB 1 1 19 6228 1 1 57 SER H H 16.832 -6.483 -7.619 1.00 . A A . 38 ALA H 1 1 19 6229 1 1 57 SER HA H 19.016 -8.126 -8.420 1.00 . A A . 38 ALA HA 1 1 19 6230 1 1 57 SER HB2 H 18.384 -7.873 -5.554 1.00 . A A . 38 ALA HB2 1 1 19 6231 1 1 57 SER HB3 H 18.688 -6.369 -6.433 1.00 . A A . 38 ALA HB3 1 1 19 6232 1 1 57 SER N N 17.239 -7.126 -8.230 1.00 . A A . 38 ALA N 1 1 19 6233 1 1 57 SER O O 18.046 -10.415 -8.027 1.00 . A A . 38 ALA O 1 1 19 6234 1 1 58 GLY C C 15.502 -11.472 -6.675 1.00 . A A . 39 SER C 1 1 19 6235 1 1 58 GLY CA C 16.467 -10.739 -5.730 1.00 . A A . 39 SER CA 1 1 19 6236 1 1 58 GLY H H 16.814 -8.666 -5.768 1.00 . A A . 39 SER H 1 1 19 6237 1 1 58 GLY N N 16.980 -9.493 -6.267 1.00 . A A . 39 SER N 1 1 19 6238 1 1 58 GLY O O 14.991 -12.540 -6.334 1.00 . A A . 39 SER O 1 1 19 6239 1 1 59 ALA C C 13.064 -11.984 -8.254 1.00 . A A . 40 GLY C 1 1 19 6240 1 1 59 ALA CA C 14.395 -11.555 -8.839 1.00 . A A . 40 GLY CA 1 1 19 6241 1 1 59 ALA H H 15.711 -10.077 -8.096 1.00 . A A . 40 GLY H 1 1 19 6242 1 1 59 ALA N N 15.273 -10.917 -7.866 1.00 . A A . 40 GLY N 1 1 19 6243 1 1 59 ALA O O 12.439 -12.928 -8.735 1.00 . A A . 40 GLY O 1 1 19 6244 1 1 60 GLY C C 11.206 -13.075 -6.293 1.00 . A A . 41 ALA C 1 1 19 6245 1 1 60 GLY CA C 11.368 -11.579 -6.551 1.00 . A A . 41 ALA CA 1 1 19 6246 1 1 60 GLY H H 13.185 -10.546 -6.892 1.00 . A A . 41 ALA H 1 1 19 6247 1 1 60 GLY N N 12.635 -11.283 -7.217 1.00 . A A . 41 ALA N 1 1 19 6248 1 1 60 GLY O O 10.098 -13.609 -6.355 1.00 . A A . 41 ALA O 1 1 19 6249 1 1 61 SER C C 12.918 -15.980 -6.859 1.00 . A A . 42 GLY C 1 1 19 6250 1 1 61 SER CA C 12.274 -15.174 -5.748 1.00 . A A . 42 GLY CA 1 1 19 6251 1 1 61 SER H H 13.172 -13.270 -5.974 1.00 . A A . 42 GLY H 1 1 19 6252 1 1 61 SER N N 12.316 -13.747 -6.008 1.00 . A A . 42 GLY N 1 1 19 6253 1 1 61 SER O O 12.362 -16.101 -7.950 1.00 . A A . 42 GLY O 1 1 19 6254 1 1 62 ILE C C 14.291 -18.752 -7.619 1.00 . A A . 43 SER C 1 1 19 6255 1 1 62 ILE CA C 14.818 -17.323 -7.568 1.00 . A A . 43 SER CA 1 1 19 6256 1 1 62 ILE CB C 16.315 -17.329 -7.251 1.00 . A A . 43 SER CB 1 1 19 6257 1 1 62 ILE H H 14.489 -16.394 -5.695 1.00 . A A . 43 SER H 1 1 19 6258 1 1 62 ILE HA H 14.666 -16.868 -8.530 1.00 . A A . 43 SER HA 1 1 19 6259 1 1 62 ILE N N 14.096 -16.529 -6.583 1.00 . A A . 43 SER N 1 1 19 6260 1 1 62 ILE O O 14.348 -19.411 -8.657 1.00 . A A . 43 SER O 1 1 19 6261 1 1 63 GLY C C 12.373 -20.748 -5.161 1.00 . A A . 44 ILE C 1 1 19 6262 1 1 63 GLY CA C 13.250 -20.577 -6.400 1.00 . A A . 44 ILE CA 1 1 19 6263 1 1 63 GLY H H 13.772 -18.652 -5.700 1.00 . A A . 44 ILE H 1 1 19 6264 1 1 63 GLY N N 13.784 -19.225 -6.490 1.00 . A A . 44 ILE N 1 1 19 6265 1 1 63 GLY O O 12.743 -21.441 -4.214 1.00 . A A . 44 ILE O 1 1 19 6266 1 1 64 ARG C C 9.357 -19.024 -3.950 1.00 . A A . 45 GLY C 1 1 19 6267 1 1 64 ARG CA C 10.295 -20.211 -4.051 1.00 . A A . 45 GLY CA 1 1 19 6268 1 1 64 ARG H H 10.959 -19.574 -5.958 1.00 . A A . 45 GLY H 1 1 19 6269 1 1 64 ARG N N 11.205 -20.112 -5.176 1.00 . A A . 45 GLY N 1 1 19 6270 1 1 64 ARG O O 8.859 -18.530 -4.961 1.00 . A A . 45 GLY O 1 1 20 6271 1 1 20 ASN C C -8.424 26.194 12.912 1.00 . A A . 1 VAL C 1 1 20 6272 1 1 20 ASN CA C -9.256 24.954 13.221 1.00 . A A . 1 VAL CA 1 1 20 6273 1 1 20 ASN CB C -10.394 24.846 12.190 1.00 . A A . 1 VAL CB 1 1 20 6274 1 1 20 ASN H H -10.743 24.966 14.729 1.00 . A A . 1 VAL H 1 1 20 6275 1 1 20 ASN HA H -8.629 24.079 13.128 1.00 . A A . 1 VAL HA 1 1 20 6276 1 1 20 ASN N N -9.773 24.993 14.584 1.00 . A A . 1 VAL N 1 1 20 6277 1 1 20 ASN O O -8.928 27.317 12.946 1.00 . A A . 1 VAL O 1 1 20 6278 1 1 21 TYR C C -5.036 26.587 11.504 1.00 . A A . 2 ASN C 1 1 20 6279 1 1 21 TYR CA C -6.243 27.083 12.296 1.00 . A A . 2 ASN CA 1 1 20 6280 1 1 21 TYR CB C -5.780 27.774 13.581 1.00 . A A . 2 ASN CB 1 1 20 6281 1 1 21 TYR CG C -5.623 29.272 13.406 1.00 . A A . 2 ASN CG 1 1 20 6282 1 1 21 TYR H H -6.803 25.065 12.601 1.00 . A A . 2 ASN H 1 1 20 6283 1 1 21 TYR HA H -6.787 27.794 11.691 1.00 . A A . 2 ASN HA 1 1 20 6284 1 1 21 TYR HB2 H -6.507 27.596 14.359 1.00 . A A . 2 ASN HB2 1 1 20 6285 1 1 21 TYR HB3 H -4.828 27.363 13.881 1.00 . A A . 2 ASN HB3 1 1 20 6286 1 1 21 TYR N N -7.146 25.982 12.612 1.00 . A A . 2 ASN N 1 1 20 6287 1 1 21 TYR O O -3.913 26.572 12.006 1.00 . A A . 2 ASN O 1 1 20 6288 1 1 22 GLY C C -3.540 24.462 10.011 1.00 . A A . 3 TYR C 1 1 20 6289 1 1 22 GLY CA C -4.213 25.687 9.397 1.00 . A A . 3 TYR CA 1 1 20 6290 1 1 22 GLY H H -6.195 26.219 9.916 1.00 . A A . 3 TYR H 1 1 20 6291 1 1 22 GLY N N -5.278 26.182 10.261 1.00 . A A . 3 TYR N 1 1 20 6292 1 1 22 GLY O O -2.322 24.305 9.937 1.00 . A A . 3 TYR O 1 1 20 6293 1 1 23 ASN C C -3.825 22.464 12.746 1.00 . A A . 4 GLY C 1 1 20 6294 1 1 23 ASN CA C -3.812 22.394 11.232 1.00 . A A . 4 GLY CA 1 1 20 6295 1 1 23 ASN H H -5.309 23.770 10.642 1.00 . A A . 4 GLY H 1 1 20 6296 1 1 23 ASN N N -4.345 23.594 10.615 1.00 . A A . 4 GLY N 1 1 20 6297 1 1 23 ASN O O -4.028 21.455 13.420 1.00 . A A . 4 GLY O 1 1 20 6298 1 1 24 GLY C C -2.478 23.111 15.414 1.00 . A A . 5 ASN C 1 1 20 6299 1 1 24 GLY CA C -3.612 23.873 14.727 1.00 . A A . 5 ASN CA 1 1 20 6300 1 1 24 GLY H H -3.473 24.430 12.698 1.00 . A A . 5 ASN H 1 1 20 6301 1 1 24 GLY N N -3.616 23.665 13.284 1.00 . A A . 5 ASN N 1 1 20 6302 1 1 24 GLY O O -2.396 23.084 16.642 1.00 . A A . 5 ASN O 1 1 20 6303 1 1 25 VAL C C -0.924 20.410 15.753 1.00 . A A . 6 GLY C 1 1 20 6304 1 1 25 VAL CA C -0.496 21.748 15.181 1.00 . A A . 6 GLY CA 1 1 20 6305 1 1 25 VAL H H -1.717 22.548 13.655 1.00 . A A . 6 GLY H 1 1 20 6306 1 1 25 VAL N N -1.606 22.495 14.623 1.00 . A A . 6 GLY N 1 1 20 6307 1 1 25 VAL O O -0.657 20.114 16.917 1.00 . A A . 6 GLY O 1 1 20 6308 1 1 26 SER C C -2.644 18.299 16.752 1.00 . A A . 7 VAL C 1 1 20 6309 1 1 26 SER CA C -2.062 18.280 15.336 1.00 . A A . 7 VAL CA 1 1 20 6310 1 1 26 SER CB C -0.930 17.226 15.224 1.00 . A A . 7 VAL CB 1 1 20 6311 1 1 26 SER H H -1.764 19.902 14.011 1.00 . A A . 7 VAL H 1 1 20 6312 1 1 26 SER HA H -2.848 17.994 14.653 1.00 . A A . 7 VAL HA 1 1 20 6313 1 1 26 SER N N -1.589 19.602 14.926 1.00 . A A . 7 VAL N 1 1 20 6314 1 1 26 SER O O -2.984 19.358 17.281 1.00 . A A . 7 VAL O 1 1 20 6315 1 1 27 CYS C C -2.213 16.532 19.680 1.00 . A A . 8 SER C 1 1 20 6316 1 1 27 CYS CA C -3.290 17.000 18.706 1.00 . A A . 8 SER CA 1 1 20 6317 1 1 27 CYS CB C -4.467 16.024 18.724 1.00 . A A . 8 SER CB 1 1 20 6318 1 1 27 CYS H H -2.461 16.319 16.882 1.00 . A A . 8 SER H 1 1 20 6319 1 1 27 CYS HA H -3.638 17.975 19.014 1.00 . A A . 8 SER HA 1 1 20 6320 1 1 27 CYS HB2 H -4.094 15.014 18.802 1.00 . A A . 8 SER HB2 1 1 20 6321 1 1 27 CYS HB3 H -5.099 16.241 19.574 1.00 . A A . 8 SER HB3 1 1 20 6322 1 1 27 CYS N N -2.753 17.123 17.356 1.00 . A A . 8 SER N 1 1 20 6323 1 1 27 CYS O O -1.705 15.417 19.570 1.00 . A A . 8 SER O 1 1 20 6324 1 1 28 SER C C -1.472 16.386 22.839 1.00 . A A . 9 CYS C 1 1 20 6325 1 1 28 SER CA C -0.852 17.071 21.626 1.00 . A A . 9 CYS CA 1 1 20 6326 1 1 28 SER CB C -0.112 18.336 22.066 1.00 . A A . 9 CYS CB 1 1 20 6327 1 1 28 SER H H -2.309 18.268 20.664 1.00 . A A . 9 CYS H 1 1 20 6328 1 1 28 SER HA H -0.146 16.395 21.168 1.00 . A A . 9 CYS HA 1 1 20 6329 1 1 28 SER HB2 H -0.687 18.831 22.834 1.00 . A A . 9 CYS HB2 1 1 20 6330 1 1 28 SER HB3 H 0.851 18.056 22.471 1.00 . A A . 9 CYS HB3 1 1 20 6331 1 1 28 SER N N -1.869 17.394 20.631 1.00 . A A . 9 CYS N 1 1 20 6332 1 1 28 SER O O -2.239 16.996 23.585 1.00 . A A . 9 CYS O 1 1 20 6333 1 1 29 LYS C C -0.746 13.169 24.490 1.00 . A A . 10 SER C 1 1 20 6334 1 1 29 LYS CA C -1.661 14.339 24.147 1.00 . A A . 10 SER CA 1 1 20 6335 1 1 29 LYS CB C -3.034 13.801 23.791 1.00 . A A . 10 SER CB 1 1 20 6336 1 1 29 LYS H H -0.523 14.689 22.392 1.00 . A A . 10 SER H 1 1 20 6337 1 1 29 LYS HA H -1.744 14.990 25.004 1.00 . A A . 10 SER HA 1 1 20 6338 1 1 29 LYS HB2 H -3.023 13.490 22.758 1.00 . A A . 10 SER HB2 1 1 20 6339 1 1 29 LYS HB3 H -3.255 12.954 24.419 1.00 . A A . 10 SER HB3 1 1 20 6340 1 1 29 LYS N N -1.137 15.116 23.026 1.00 . A A . 10 SER N 1 1 20 6341 1 1 29 LYS O O -1.160 12.210 25.141 1.00 . A A . 10 SER O 1 1 20 6342 1 1 30 THR C C 2.901 12.710 24.071 1.00 . A A . 11 LYS C 1 1 20 6343 1 1 30 THR CA C 1.479 12.208 24.287 1.00 . A A . 11 LYS CA 1 1 20 6344 1 1 30 THR CB C 1.205 11.006 23.381 1.00 . A A . 11 LYS CB 1 1 20 6345 1 1 30 THR H H 0.743 14.041 23.529 1.00 . A A . 11 LYS H 1 1 20 6346 1 1 30 THR HA H 1.383 11.901 25.307 1.00 . A A . 11 LYS HA 1 1 20 6347 1 1 30 THR N N 0.493 13.257 24.041 1.00 . A A . 11 LYS N 1 1 20 6348 1 1 30 THR O O 3.840 12.244 24.718 1.00 . A A . 11 LYS O 1 1 20 6349 1 1 31 LYS C C 4.262 15.724 22.684 1.00 . A A . 12 THR C 1 1 20 6350 1 1 31 LYS CA C 4.351 14.204 22.837 1.00 . A A . 12 THR CA 1 1 20 6351 1 1 31 LYS CB C 4.883 13.519 21.574 1.00 . A A . 12 THR CB 1 1 20 6352 1 1 31 LYS H H 2.278 13.967 22.672 1.00 . A A . 12 THR H 1 1 20 6353 1 1 31 LYS HA H 5.009 13.983 23.653 1.00 . A A . 12 THR HA 1 1 20 6354 1 1 31 LYS N N 3.054 13.648 23.155 1.00 . A A . 12 THR N 1 1 20 6355 1 1 31 LYS O O 3.173 16.297 22.727 1.00 . A A . 12 THR O 1 1 20 6356 1 1 32 CYS C C 4.880 18.305 21.050 1.00 . A A . 13 LYS C 1 1 20 6357 1 1 32 CYS CA C 5.469 17.827 22.371 1.00 . A A . 13 LYS CA 1 1 20 6358 1 1 32 CYS CB C 6.907 18.287 22.456 1.00 . A A . 13 LYS CB 1 1 20 6359 1 1 32 CYS H H 6.245 15.864 22.505 1.00 . A A . 13 LYS H 1 1 20 6360 1 1 32 CYS HA H 4.909 18.261 23.176 1.00 . A A . 13 LYS HA 1 1 20 6361 1 1 32 CYS HB2 H 7.518 17.560 21.947 1.00 . A A . 13 LYS HB2 1 1 20 6362 1 1 32 CYS HB3 H 6.992 19.234 21.952 1.00 . A A . 13 LYS HB3 1 1 20 6363 1 1 32 CYS N N 5.411 16.373 22.518 1.00 . A A . 13 LYS N 1 1 20 6364 1 1 32 CYS O O 5.275 19.340 20.515 1.00 . A A . 13 LYS O 1 1 20 6365 1 1 33 SER C C 4.168 17.576 18.095 1.00 . A A . 14 CYS C 1 1 20 6366 1 1 33 SER CA C 3.263 17.868 19.288 1.00 . A A . 14 CYS CA 1 1 20 6367 1 1 33 SER CB C 2.832 19.336 19.272 1.00 . A A . 14 CYS CB 1 1 20 6368 1 1 33 SER H H 3.684 16.757 21.026 1.00 . A A . 14 CYS H 1 1 20 6369 1 1 33 SER HA H 2.383 17.244 19.218 1.00 . A A . 14 CYS HA 1 1 20 6370 1 1 33 SER HB2 H 3.684 19.947 19.025 1.00 . A A . 14 CYS HB2 1 1 20 6371 1 1 33 SER HB3 H 2.069 19.470 18.520 1.00 . A A . 14 CYS HB3 1 1 20 6372 1 1 33 SER N N 3.936 17.549 20.543 1.00 . A A . 14 CYS N 1 1 20 6373 1 1 33 SER O O 4.605 18.490 17.396 1.00 . A A . 14 CYS O 1 1 20 6374 1 1 34 VAL C C 5.110 14.405 16.443 1.00 . A A . 15 SER C 1 1 20 6375 1 1 34 VAL CA C 5.301 15.885 16.760 1.00 . A A . 15 SER CA 1 1 20 6376 1 1 34 VAL CB C 6.768 16.163 17.090 1.00 . A A . 15 SER CB 1 1 20 6377 1 1 34 VAL H H 4.070 15.612 18.461 1.00 . A A . 15 SER H 1 1 20 6378 1 1 34 VAL HA H 5.021 16.465 15.893 1.00 . A A . 15 SER HA 1 1 20 6379 1 1 34 VAL N N 4.447 16.295 17.868 1.00 . A A . 15 SER N 1 1 20 6380 1 1 34 VAL O O 5.793 13.548 17.002 1.00 . A A . 15 SER O 1 1 20 6381 1 1 35 ASN C C 5.147 12.073 14.568 1.00 . A A . 16 VAL C 1 1 20 6382 1 1 35 ASN CA C 3.901 12.737 15.147 1.00 . A A . 16 VAL CA 1 1 20 6383 1 1 35 ASN CB C 2.765 12.668 14.107 1.00 . A A . 16 VAL CB 1 1 20 6384 1 1 35 ASN H H 3.667 14.840 15.128 1.00 . A A . 16 VAL H 1 1 20 6385 1 1 35 ASN HA H 3.589 12.193 16.028 1.00 . A A . 16 VAL HA 1 1 20 6386 1 1 35 ASN N N 4.178 14.114 15.541 1.00 . A A . 16 VAL N 1 1 20 6387 1 1 35 ASN O O 6.090 12.751 14.163 1.00 . A A . 16 VAL O 1 1 20 6388 1 1 36 TRP C C 6.176 9.841 12.490 1.00 . A A . 17 ASN C 1 1 20 6389 1 1 36 TRP CA C 6.276 9.990 14.007 1.00 . A A . 17 ASN CA 1 1 20 6390 1 1 36 TRP CB C 6.348 8.612 14.668 1.00 . A A . 17 ASN CB 1 1 20 6391 1 1 36 TRP CG C 5.112 7.776 14.396 1.00 . A A . 17 ASN CG 1 1 20 6392 1 1 36 TRP H H 4.365 10.257 14.874 1.00 . A A . 17 ASN H 1 1 20 6393 1 1 36 TRP HA H 7.176 10.538 14.242 1.00 . A A . 17 ASN HA 1 1 20 6394 1 1 36 TRP HB2 H 7.208 8.082 14.288 1.00 . A A . 17 ASN HB2 1 1 20 6395 1 1 36 TRP HB3 H 6.448 8.737 15.735 1.00 . A A . 17 ASN HB3 1 1 20 6396 1 1 36 TRP N N 5.144 10.744 14.535 1.00 . A A . 17 ASN N 1 1 20 6397 1 1 36 TRP O O 6.269 8.734 11.957 1.00 . A A . 17 ASN O 1 1 20 6398 1 1 37 GLY C C 7.251 10.793 9.689 1.00 . A A . 18 TRP C 1 1 20 6399 1 1 37 GLY CA C 5.882 10.959 10.348 1.00 . A A . 18 TRP CA 1 1 20 6400 1 1 37 GLY H H 5.925 11.811 12.276 1.00 . A A . 18 TRP H 1 1 20 6401 1 1 37 GLY N N 5.990 10.963 11.800 1.00 . A A . 18 TRP N 1 1 20 6402 1 1 37 GLY O O 7.350 10.678 8.468 1.00 . A A . 18 TRP O 1 1 20 6403 1 1 38 GLN C C 10.246 9.277 10.316 1.00 . A A . 19 GLY C 1 1 20 6404 1 1 38 GLN CA C 9.649 10.624 9.972 1.00 . A A . 19 GLY CA 1 1 20 6405 1 1 38 GLN H H 8.173 10.871 11.466 1.00 . A A . 19 GLY H 1 1 20 6406 1 1 38 GLN N N 8.306 10.779 10.501 1.00 . A A . 19 GLY N 1 1 20 6407 1 1 38 GLN O O 10.732 8.560 9.438 1.00 . A A . 19 GLY O 1 1 20 6408 1 1 39 ALA C C 10.108 6.502 11.272 1.00 . A A . 20 GLN C 1 1 20 6409 1 1 39 ALA CA C 10.738 7.646 12.051 1.00 . A A . 20 GLN CA 1 1 20 6410 1 1 39 ALA CB C 10.489 7.460 13.549 1.00 . A A . 20 GLN CB 1 1 20 6411 1 1 39 ALA H H 9.797 9.531 12.249 1.00 . A A . 20 GLN H 1 1 20 6412 1 1 39 ALA HA H 11.802 7.645 11.865 1.00 . A A . 20 GLN HA 1 1 20 6413 1 1 39 ALA HB2 H 10.452 8.431 14.021 1.00 . A A . 20 GLN HB2 1 1 20 6414 1 1 39 ALA HB3 H 9.538 6.968 13.687 1.00 . A A . 20 GLN HB3 1 1 20 6415 1 1 39 ALA N N 10.203 8.923 11.598 1.00 . A A . 20 GLN N 1 1 20 6416 1 1 39 ALA O O 10.788 5.817 10.508 1.00 . A A . 20 GLN O 1 1 20 6417 1 1 40 PHE C C 8.101 5.480 9.235 1.00 . A A . 21 ALA C 1 1 20 6418 1 1 40 PHE CA C 8.112 5.241 10.732 1.00 . A A . 21 ALA CA 1 1 20 6419 1 1 40 PHE CB C 6.710 5.019 11.261 1.00 . A A . 21 ALA CB 1 1 20 6420 1 1 40 PHE H H 8.301 6.883 12.060 1.00 . A A . 21 ALA H 1 1 20 6421 1 1 40 PHE HA H 8.677 4.362 10.898 1.00 . A A . 21 ALA HA 1 1 20 6422 1 1 40 PHE HB2 H 6.040 5.741 10.820 1.00 . A A . 21 ALA HB2 1 1 20 6423 1 1 40 PHE HB3 H 6.710 5.132 12.335 1.00 . A A . 21 ALA HB3 1 1 20 6424 1 1 40 PHE N N 8.802 6.303 11.449 1.00 . A A . 21 ALA N 1 1 20 6425 1 1 40 PHE O O 7.682 4.628 8.453 1.00 . A A . 21 ALA O 1 1 20 6426 1 1 41 GLN C C 9.808 6.091 6.853 1.00 . A A . 22 PHE C 1 1 20 6427 1 1 41 GLN CA C 8.724 6.969 7.446 1.00 . A A . 22 PHE CA 1 1 20 6428 1 1 41 GLN CB C 9.066 8.450 7.267 1.00 . A A . 22 PHE CB 1 1 20 6429 1 1 41 GLN CG C 8.336 9.100 6.126 1.00 . A A . 22 PHE CG 1 1 20 6430 1 1 41 GLN H H 8.958 7.218 9.523 1.00 . A A . 22 PHE H 1 1 20 6431 1 1 41 GLN HA H 7.782 6.747 6.968 1.00 . A A . 22 PHE HA 1 1 20 6432 1 1 41 GLN HB2 H 8.810 8.983 8.171 1.00 . A A . 22 PHE HB2 1 1 20 6433 1 1 41 GLN HB3 H 10.126 8.549 7.085 1.00 . A A . 22 PHE HB3 1 1 20 6434 1 1 41 GLN N N 8.612 6.622 8.849 1.00 . A A . 22 PHE N 1 1 20 6435 1 1 41 GLN O O 9.681 5.568 5.747 1.00 . A A . 22 PHE O 1 1 20 6436 1 1 42 GLU C C 11.469 3.574 7.374 1.00 . A A . 23 GLN C 1 1 20 6437 1 1 42 GLU CA C 11.947 5.020 7.273 1.00 . A A . 23 GLN CA 1 1 20 6438 1 1 42 GLU CB C 13.152 5.251 8.191 1.00 . A A . 23 GLN CB 1 1 20 6439 1 1 42 GLU CD C 14.723 7.227 8.272 1.00 . A A . 23 GLN CD 1 1 20 6440 1 1 42 GLU CG C 14.298 5.985 7.515 1.00 . A A . 23 GLN CG 1 1 20 6441 1 1 42 GLU H H 10.862 6.306 8.539 1.00 . A A . 23 GLN H 1 1 20 6442 1 1 42 GLU HA H 12.219 5.237 6.251 1.00 . A A . 23 GLN HA 1 1 20 6443 1 1 42 GLU HB2 H 12.831 5.834 9.046 1.00 . A A . 23 GLN HB2 1 1 20 6444 1 1 42 GLU HB3 H 13.518 4.294 8.535 1.00 . A A . 23 GLN HB3 1 1 20 6445 1 1 42 GLU HG2 H 15.144 5.318 7.445 1.00 . A A . 23 GLN HG2 1 1 20 6446 1 1 42 GLU HG3 H 13.987 6.275 6.522 1.00 . A A . 23 GLN HG3 1 1 20 6447 1 1 42 GLU N N 10.852 5.889 7.651 1.00 . A A . 23 GLN N 1 1 20 6448 1 1 42 GLU O O 11.957 2.689 6.669 1.00 . A A . 23 GLN O 1 1 20 6449 1 1 42 GLU OE1 O 15.221 7.145 9.395 1.00 . A A . 23 GLN OE1 1 1 20 6450 1 1 43 ARG C C 9.137 1.606 7.213 1.00 . A A . 24 GLU C 1 1 20 6451 1 1 43 ARG CA C 9.905 2.037 8.455 1.00 . A A . 24 GLU CA 1 1 20 6452 1 1 43 ARG CB C 8.970 2.043 9.666 1.00 . A A . 24 GLU CB 1 1 20 6453 1 1 43 ARG CD C 9.967 0.648 11.522 1.00 . A A . 24 GLU CD 1 1 20 6454 1 1 43 ARG CG C 9.702 2.046 11.000 1.00 . A A . 24 GLU CG 1 1 20 6455 1 1 43 ARG H H 10.136 4.107 8.773 1.00 . A A . 24 GLU H 1 1 20 6456 1 1 43 ARG HA H 10.703 1.346 8.636 1.00 . A A . 24 GLU HA 1 1 20 6457 1 1 43 ARG HB2 H 8.345 2.921 9.621 1.00 . A A . 24 GLU HB2 1 1 20 6458 1 1 43 ARG HB3 H 8.344 1.164 9.627 1.00 . A A . 24 GLU HB3 1 1 20 6459 1 1 43 ARG HG2 H 10.646 2.554 10.875 1.00 . A A . 24 GLU HG2 1 1 20 6460 1 1 43 ARG HG3 H 9.101 2.578 11.723 1.00 . A A . 24 GLU HG3 1 1 20 6461 1 1 43 ARG N N 10.486 3.355 8.254 1.00 . A A . 24 GLU N 1 1 20 6462 1 1 43 ARG O O 9.134 0.432 6.845 1.00 . A A . 24 GLU O 1 1 20 6463 1 1 44 TYR C C 8.637 2.082 4.174 1.00 . A A . 25 ARG C 1 1 20 6464 1 1 44 TYR CA C 7.716 2.305 5.365 1.00 . A A . 25 ARG CA 1 1 20 6465 1 1 44 TYR CB C 6.737 3.456 5.092 1.00 . A A . 25 ARG CB 1 1 20 6466 1 1 44 TYR CG C 7.377 4.721 4.534 1.00 . A A . 25 ARG CG 1 1 20 6467 1 1 44 TYR CZ C 4.435 6.712 3.381 1.00 . A A . 25 ARG CZ 1 1 20 6468 1 1 44 TYR H H 8.530 3.486 6.910 1.00 . A A . 25 ARG H 1 1 20 6469 1 1 44 TYR HA H 7.159 1.405 5.536 1.00 . A A . 25 ARG HA 1 1 20 6470 1 1 44 TYR HB2 H 5.995 3.118 4.387 1.00 . A A . 25 ARG HB2 1 1 20 6471 1 1 44 TYR HB3 H 6.247 3.714 6.019 1.00 . A A . 25 ARG HB3 1 1 20 6472 1 1 44 TYR HD2 H 7.118 5.964 2.824 1.00 . A A . 25 ARG HD2 1 1 20 6473 1 1 44 TYR N N 8.488 2.571 6.568 1.00 . A A . 25 ARG N 1 1 20 6474 1 1 44 TYR O O 8.362 1.260 3.298 1.00 . A A . 25 ARG O 1 1 20 6475 1 1 45 THR C C 11.302 1.303 3.058 1.00 . A A . 26 TYR C 1 1 20 6476 1 1 45 THR CA C 10.717 2.707 3.092 1.00 . A A . 26 TYR CA 1 1 20 6477 1 1 45 THR CB C 11.832 3.740 3.281 1.00 . A A . 26 TYR CB 1 1 20 6478 1 1 45 THR H H 9.889 3.445 4.894 1.00 . A A . 26 TYR H 1 1 20 6479 1 1 45 THR HA H 10.213 2.899 2.156 1.00 . A A . 26 TYR HA 1 1 20 6480 1 1 45 THR N N 9.735 2.817 4.160 1.00 . A A . 26 TYR N 1 1 20 6481 1 1 45 THR O O 11.593 0.762 1.991 1.00 . A A . 26 TYR O 1 1 20 6482 1 1 46 ALA C C 11.152 -1.621 3.561 1.00 . A A . 27 THR C 1 1 20 6483 1 1 46 ALA CA C 12.005 -0.636 4.350 1.00 . A A . 27 THR CA 1 1 20 6484 1 1 46 ALA CB C 12.073 -1.058 5.820 1.00 . A A . 27 THR CB 1 1 20 6485 1 1 46 ALA H H 11.206 1.194 5.051 1.00 . A A . 27 THR H 1 1 20 6486 1 1 46 ALA HA H 13.003 -0.629 3.940 1.00 . A A . 27 THR HA 1 1 20 6487 1 1 46 ALA N N 11.464 0.712 4.238 1.00 . A A . 27 THR N 1 1 20 6488 1 1 46 ALA O O 11.673 -2.530 2.915 1.00 . A A . 27 THR O 1 1 20 6489 1 1 47 GLY C C 9.003 -2.073 1.396 1.00 . A A . 28 ALA C 1 1 20 6490 1 1 47 GLY CA C 8.912 -2.298 2.902 1.00 . A A . 28 ALA CA 1 1 20 6491 1 1 47 GLY H H 9.481 -0.689 4.144 1.00 . A A . 28 ALA H 1 1 20 6492 1 1 47 GLY N N 9.838 -1.431 3.615 1.00 . A A . 28 ALA N 1 1 20 6493 1 1 47 GLY O O 8.791 -2.993 0.605 1.00 . A A . 28 ALA O 1 1 20 6494 1 1 48 ILE C C 10.738 -0.984 -1.015 1.00 . A A . 29 GLY C 1 1 20 6495 1 1 48 ILE CA C 9.430 -0.513 -0.405 1.00 . A A . 29 GLY CA 1 1 20 6496 1 1 48 ILE H H 9.473 -0.148 1.682 1.00 . A A . 29 GLY H 1 1 20 6497 1 1 48 ILE N N 9.318 -0.841 1.005 1.00 . A A . 29 GLY N 1 1 20 6498 1 1 48 ILE O O 10.747 -1.576 -2.095 1.00 . A A . 29 GLY O 1 1 20 6499 1 1 49 ASN C C 13.210 -2.613 -1.124 1.00 . A A . 30 ILE C 1 1 20 6500 1 1 49 ASN CA C 13.164 -1.119 -0.808 1.00 . A A . 30 ILE CA 1 1 20 6501 1 1 49 ASN CB C 14.264 -0.780 0.223 1.00 . A A . 30 ILE CB 1 1 20 6502 1 1 49 ASN H H 11.772 -0.244 0.528 1.00 . A A . 30 ILE H 1 1 20 6503 1 1 49 ASN HA H 13.368 -0.565 -1.713 1.00 . A A . 30 ILE HA 1 1 20 6504 1 1 49 ASN N N 11.845 -0.720 -0.326 1.00 . A A . 30 ILE N 1 1 20 6505 1 1 49 ASN O O 13.806 -3.028 -2.118 1.00 . A A . 30 ILE O 1 1 20 6506 1 1 50 SER C C 12.018 -5.222 -1.849 1.00 . A A . 31 ASN C 1 1 20 6507 1 1 50 SER CA C 12.553 -4.863 -0.465 1.00 . A A . 31 ASN CA 1 1 20 6508 1 1 50 SER CB C 11.693 -5.525 0.614 1.00 . A A . 31 ASN CB 1 1 20 6509 1 1 50 SER H H 12.123 -3.028 0.502 1.00 . A A . 31 ASN H 1 1 20 6510 1 1 50 SER HA H 13.565 -5.226 -0.378 1.00 . A A . 31 ASN HA 1 1 20 6511 1 1 50 SER HB2 H 11.682 -4.897 1.492 1.00 . A A . 31 ASN HB2 1 1 20 6512 1 1 50 SER HB3 H 10.685 -5.636 0.242 1.00 . A A . 31 ASN HB3 1 1 20 6513 1 1 50 SER N N 12.580 -3.416 -0.273 1.00 . A A . 31 ASN N 1 1 20 6514 1 1 50 SER O O 12.509 -6.149 -2.493 1.00 . A A . 31 ASN O 1 1 20 6515 1 1 51 PHE C C 11.338 -4.271 -4.726 1.00 . A A . 32 SER C 1 1 20 6516 1 1 51 PHE CA C 10.408 -4.720 -3.602 1.00 . A A . 32 SER CA 1 1 20 6517 1 1 51 PHE CB C 9.070 -3.988 -3.710 1.00 . A A . 32 SER CB 1 1 20 6518 1 1 51 PHE H H 10.662 -3.759 -1.739 1.00 . A A . 32 SER H 1 1 20 6519 1 1 51 PHE HA H 10.236 -5.779 -3.693 1.00 . A A . 32 SER HA 1 1 20 6520 1 1 51 PHE HB2 H 9.104 -3.091 -3.109 1.00 . A A . 32 SER HB2 1 1 20 6521 1 1 51 PHE HB3 H 8.889 -3.723 -4.741 1.00 . A A . 32 SER HB3 1 1 20 6522 1 1 51 PHE N N 11.010 -4.482 -2.298 1.00 . A A . 32 SER N 1 1 20 6523 1 1 51 PHE O O 11.535 -4.990 -5.706 1.00 . A A . 32 SER O 1 1 20 6524 1 1 52 VAL C C 14.039 -3.426 -5.750 1.00 . A A . 33 PHE C 1 1 20 6525 1 1 52 VAL CA C 12.813 -2.531 -5.579 1.00 . A A . 33 PHE CA 1 1 20 6526 1 1 52 VAL CB C 13.222 -1.099 -5.192 1.00 . A A . 33 PHE CB 1 1 20 6527 1 1 52 VAL H H 11.707 -2.552 -3.775 1.00 . A A . 33 PHE H 1 1 20 6528 1 1 52 VAL HA H 12.279 -2.496 -6.518 1.00 . A A . 33 PHE HA 1 1 20 6529 1 1 52 VAL N N 11.905 -3.078 -4.577 1.00 . A A . 33 PHE N 1 1 20 6530 1 1 52 VAL O O 14.463 -3.706 -6.873 1.00 . A A . 33 PHE O 1 1 20 6531 1 1 53 SER C C 15.532 -5.965 -5.531 1.00 . A A . 34 VAL C 1 1 20 6532 1 1 53 SER CA C 15.781 -4.734 -4.667 1.00 . A A . 34 VAL CA 1 1 20 6533 1 1 53 SER CB C 16.202 -5.177 -3.251 1.00 . A A . 34 VAL CB 1 1 20 6534 1 1 53 SER H H 14.223 -3.618 -3.767 1.00 . A A . 34 VAL H 1 1 20 6535 1 1 53 SER HA H 16.594 -4.168 -5.102 1.00 . A A . 34 VAL HA 1 1 20 6536 1 1 53 SER N N 14.605 -3.874 -4.632 1.00 . A A . 34 VAL N 1 1 20 6537 1 1 53 SER O O 16.058 -6.065 -6.634 1.00 . A A . 34 VAL O 1 1 20 6538 1 1 54 GLY C C 14.048 -7.870 -7.171 1.00 . A A . 35 SER C 1 1 20 6539 1 1 54 GLY CA C 14.463 -8.131 -5.746 1.00 . A A . 35 SER CA 1 1 20 6540 1 1 54 GLY H H 14.381 -6.803 -4.131 1.00 . A A . 35 SER H 1 1 20 6541 1 1 54 GLY N N 14.746 -6.910 -5.023 1.00 . A A . 35 SER N 1 1 20 6542 1 1 54 GLY O O 14.654 -8.411 -8.095 1.00 . A A . 35 SER O 1 1 20 6543 1 1 55 VAL C C 13.848 -6.713 -9.629 1.00 . A A . 36 GLY C 1 1 20 6544 1 1 55 VAL CA C 12.635 -6.731 -8.724 1.00 . A A . 36 GLY CA 1 1 20 6545 1 1 55 VAL H H 12.609 -6.616 -6.602 1.00 . A A . 36 GLY H 1 1 20 6546 1 1 55 VAL N N 13.046 -7.034 -7.367 1.00 . A A . 36 GLY N 1 1 20 6547 1 1 55 VAL O O 13.849 -7.290 -10.716 1.00 . A A . 36 GLY O 1 1 20 6548 1 1 56 ALA C C 17.107 -7.130 -9.430 1.00 . A A . 37 VAL C 1 1 20 6549 1 1 56 ALA CA C 16.164 -5.986 -9.818 1.00 . A A . 37 VAL CA 1 1 20 6550 1 1 56 ALA CB C 16.857 -4.639 -9.534 1.00 . A A . 37 VAL CB 1 1 20 6551 1 1 56 ALA H H 14.834 -5.672 -8.244 1.00 . A A . 37 VAL H 1 1 20 6552 1 1 56 ALA HA H 15.962 -6.045 -10.870 1.00 . A A . 37 VAL HA 1 1 20 6553 1 1 56 ALA N N 14.901 -6.071 -9.129 1.00 . A A . 37 VAL N 1 1 20 6554 1 1 56 ALA O O 17.402 -8.015 -10.233 1.00 . A A . 37 VAL O 1 1 20 6555 1 1 57 SER C C 17.934 -9.298 -7.115 1.00 . A A . 38 ALA C 1 1 20 6556 1 1 57 SER CA C 18.563 -8.029 -7.670 1.00 . A A . 38 ALA CA 1 1 20 6557 1 1 57 SER CB C 19.418 -7.375 -6.589 1.00 . A A . 38 ALA CB 1 1 20 6558 1 1 57 SER H H 17.343 -6.323 -7.615 1.00 . A A . 38 ALA H 1 1 20 6559 1 1 57 SER HA H 19.212 -8.294 -8.478 1.00 . A A . 38 ALA HA 1 1 20 6560 1 1 57 SER HB2 H 19.043 -7.656 -5.608 1.00 . A A . 38 ALA HB2 1 1 20 6561 1 1 57 SER HB3 H 19.373 -6.302 -6.696 1.00 . A A . 38 ALA HB3 1 1 20 6562 1 1 57 SER N N 17.612 -7.061 -8.193 1.00 . A A . 38 ALA N 1 1 20 6563 1 1 57 SER O O 18.029 -10.378 -7.699 1.00 . A A . 38 ALA O 1 1 20 6564 1 1 58 GLY C C 15.558 -10.897 -5.885 1.00 . A A . 39 SER C 1 1 20 6565 1 1 58 GLY CA C 16.751 -10.237 -5.185 1.00 . A A . 39 SER CA 1 1 20 6566 1 1 58 GLY H H 17.361 -8.254 -5.526 1.00 . A A . 39 SER H 1 1 20 6567 1 1 58 GLY N N 17.352 -9.144 -5.935 1.00 . A A . 39 SER N 1 1 20 6568 1 1 58 GLY O O 14.879 -11.735 -5.293 1.00 . A A . 39 SER O 1 1 20 6569 1 1 59 ALA C C 14.481 -11.266 -9.341 1.00 . A A . 40 GLY C 1 1 20 6570 1 1 59 ALA CA C 14.187 -11.104 -7.863 1.00 . A A . 40 GLY CA 1 1 20 6571 1 1 59 ALA H H 15.864 -9.853 -7.571 1.00 . A A . 40 GLY H 1 1 20 6572 1 1 59 ALA N N 15.301 -10.525 -7.137 1.00 . A A . 40 GLY N 1 1 20 6573 1 1 59 ALA O O 13.725 -10.788 -10.187 1.00 . A A . 40 GLY O 1 1 20 6574 1 1 60 GLY C C 16.653 -13.521 -11.204 1.00 . A A . 41 ALA C 1 1 20 6575 1 1 60 GLY CA C 15.972 -12.171 -11.035 1.00 . A A . 41 ALA CA 1 1 20 6576 1 1 60 GLY H H 16.138 -12.299 -8.938 1.00 . A A . 41 ALA H 1 1 20 6577 1 1 60 GLY N N 15.582 -11.944 -9.653 1.00 . A A . 41 ALA N 1 1 20 6578 1 1 60 GLY O O 16.372 -14.259 -12.148 1.00 . A A . 41 ALA O 1 1 20 6579 1 1 61 SER C C 19.072 -15.252 -11.605 1.00 . A A . 42 GLY C 1 1 20 6580 1 1 61 SER CA C 18.264 -15.094 -10.332 1.00 . A A . 42 GLY CA 1 1 20 6581 1 1 61 SER H H 17.721 -13.199 -9.559 1.00 . A A . 42 GLY H 1 1 20 6582 1 1 61 SER N N 17.547 -13.833 -10.282 1.00 . A A . 42 GLY N 1 1 20 6583 1 1 61 SER O O 18.568 -15.757 -12.610 1.00 . A A . 42 GLY O 1 1 20 6584 1 1 62 ILE C C 22.231 -16.034 -12.548 1.00 . A A . 43 SER C 1 1 20 6585 1 1 62 ILE CA C 21.208 -14.915 -12.724 1.00 . A A . 43 SER CA 1 1 20 6586 1 1 62 ILE CB C 21.925 -13.584 -12.956 1.00 . A A . 43 SER CB 1 1 20 6587 1 1 62 ILE H H 20.670 -14.426 -10.734 1.00 . A A . 43 SER H 1 1 20 6588 1 1 62 ILE HA H 20.596 -15.138 -13.583 1.00 . A A . 43 SER HA 1 1 20 6589 1 1 62 ILE N N 20.327 -14.819 -11.564 1.00 . A A . 43 SER N 1 1 20 6590 1 1 62 ILE O O 22.812 -16.513 -13.521 1.00 . A A . 43 SER O 1 1 20 6591 1 1 63 GLY C C 22.685 -18.824 -10.714 1.00 . A A . 44 ILE C 1 1 20 6592 1 1 63 GLY CA C 23.400 -17.508 -11.004 1.00 . A A . 44 ILE CA 1 1 20 6593 1 1 63 GLY H H 21.955 -16.026 -10.569 1.00 . A A . 44 ILE H 1 1 20 6594 1 1 63 GLY N N 22.447 -16.446 -11.303 1.00 . A A . 44 ILE N 1 1 20 6595 1 1 63 GLY O O 22.824 -19.395 -9.632 1.00 . A A . 44 ILE O 1 1 20 6596 1 1 64 ARG C C 20.115 -20.451 -10.457 1.00 . A A . 45 GLY C 1 1 20 6597 1 1 64 ARG CA C 21.192 -20.545 -11.520 1.00 . A A . 45 GLY CA 1 1 20 6598 1 1 64 ARG H H 21.846 -18.804 -12.531 1.00 . A A . 45 GLY H 1 1 20 6599 1 1 64 ARG N N 21.919 -19.301 -11.689 1.00 . A A . 45 GLY N 1 1 20 6600 1 1 64 ARG O O 19.099 -19.785 -10.652 1.00 . A A . 45 GLY O 1 1 stop_ save_
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