NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
409528 | 1znt | 6656 | cing | 4-filtered-FRED | STAR | entry | full | 163 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1znt # This FRED archive file contains, for PDB entry <1znt>: # # - 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_1znt _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1znt _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3428.94 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 $AMARANTHUS_CAUDATUS_ANTIMICROBIAL_PEPTIDE_2 A . 1 1 2 . 2 $SUGAR__3_MER_ B . 1 1 stop_ loop_ _PDBX_nonpoly_scheme.Entity_assembly_ID _PDBX_nonpoly_scheme.Entity_ID _PDBX_nonpoly_scheme.Mon_ID _PDBX_nonpoly_scheme.Comp_index_ID _PDBX_nonpoly_scheme.Comp_ID _PDBX_nonpoly_scheme.Entry_ID _PDBX_nonpoly_scheme.Assembly_ID 2 2 NAG 1 NAG 1 1 stop_ save_ save_AMARANTHUS_CAUDATUS_ANTIMICROBIAL_PEPTIDE_2 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "AMARANTHUS CAUDATUS ANTIMICROBIAL PEPTIDE 2" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code VGECVRGRCPSGMCCSQXGXCGKGPKYCGRX _Entity.Number_of_monomers 31 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 VAL . 1 1 2 GLY . 1 1 3 GLU . 1 1 4 CYS . 1 1 5 VAL . 1 1 6 ARG . 1 1 7 GLY . 1 1 8 ARG . 1 1 9 CYS . 1 1 10 PRO . 1 1 11 SER . 1 1 12 GLY . 1 1 13 MET . 1 1 14 CYS . 1 1 15 CYS . 1 1 16 SER . 1 1 17 GLN . 1 1 18 . $. 1 1 19 GLY . 1 1 20 . $. 1 1 21 CYS . 1 1 22 GLY . 1 1 23 LYS . 1 1 24 GLY . 1 1 25 PRO . 1 1 26 LYS . 1 1 27 TYR . 1 1 28 CYS . 1 1 29 GLY . 1 1 30 ARG . 1 1 31 NH2 $NH2 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 VAL 1 1 1 1 GLY 2 2 1 1 GLU 3 3 1 1 CYS 4 4 1 1 VAL 5 5 1 1 ARG 6 6 1 1 GLY 7 7 1 1 ARG 8 8 1 1 CYS 9 9 1 1 PRO 10 10 1 1 SER 11 11 1 1 GLY 12 12 1 1 MET 13 13 1 1 CYS 14 14 1 1 CYS 15 15 1 1 SER 16 16 1 1 GLN 17 17 1 1 . 18 18 1 1 GLY 19 19 1 1 . 20 20 1 1 CYS 21 21 1 1 GLY 22 22 1 1 LYS 23 23 1 1 GLY 24 24 1 1 PRO 25 25 1 1 LYS 26 26 1 1 TYR 27 27 1 1 CYS 28 28 1 1 GLY 29 29 1 1 ARG 30 30 1 1 NH2 31 31 1 1 stop_ save_ save_SUGAR__3_MER_ _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "SUGAR 3 MER " _Entity.Type non-polymer loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 NAG $NAG 1 2 stop_ save_ save_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NH2 _Chem_comp.Type non-polymer save_ save_. _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID . _Chem_comp.Type non-polymer save_ save_NAG _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NAG _Chem_comp.Type non-polymer save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 VAL HA . 1 VAL HA 1 1 1 1 2 1 1 2 GLY H . 2 GLY HN 1 1 2 1 1 1 1 1 VAL HA . 1 VAL HA 1 1 2 1 2 1 1 3 GLU H . 3 GLU HN 1 1 3 1 1 1 1 1 VAL HB . 1 VAL HB 1 1 3 1 2 1 1 2 GLY H . 2 GLY HN 1 1 4 1 1 1 1 1 VAL QG . 1 VAL QQG 1 1 4 1 2 1 1 2 GLY H . 2 GLY HN 1 1 5 1 1 1 1 1 VAL MG1 . 1 VAL QG1 1 1 5 1 2 1 1 2 GLY H . 2 GLY HN 1 1 6 1 1 1 1 1 VAL MG2 . 1 VAL QG2 1 1 6 1 2 1 1 2 GLY H . 2 GLY HN 1 1 7 1 1 1 1 2 GLY H . 2 GLY HN 1 1 7 1 2 1 1 3 GLU H . 3 GLU HN 1 1 8 1 1 1 1 3 GLU H . 3 GLU HN 1 1 8 1 2 1 1 3 GLU QB . 3 GLU QB 1 1 9 1 1 1 1 3 GLU H . 3 GLU HN 1 1 9 1 2 1 1 4 CYS H . 4 CYS HN 1 1 10 1 1 1 1 3 GLU HA . 3 GLU HA 1 1 10 1 2 1 1 4 CYS H . 4 CYS HN 1 1 11 1 1 1 1 3 GLU QB . 3 GLU QB 1 1 11 1 2 1 1 4 CYS H . 4 CYS HN 1 1 12 1 1 1 1 3 GLU QG . 3 GLU QG 1 1 12 1 2 1 1 4 CYS H . 4 CYS HN 1 1 13 1 1 1 1 4 CYS CB . 4 CYS CB 1 1 13 1 2 1 1 15 CYS SG . 15 CYS SG 1 1 14 1 1 1 1 4 CYS H . 4 CYS HN 1 1 14 1 2 1 1 4 CYS HB2 . 4 CYS HB2 1 1 15 1 1 1 1 4 CYS H . 4 CYS HN 1 1 15 1 2 1 1 19 GLY QA . 19 GLY QA 1 1 16 1 1 1 1 4 CYS H . 4 CYS HN 1 1 16 1 2 1 1 21 CYS H . 21 CYS HN 1 1 17 1 1 1 1 4 CYS HA . 4 CYS HA 1 1 17 1 2 1 1 5 VAL H . 5 VAL HN 1 1 18 1 1 1 1 4 CYS HA . 4 CYS HA 1 1 18 1 2 1 1 5 VAL QG . 5 VAL QQG 1 1 19 1 1 1 1 4 CYS HB2 . 4 CYS HB2 1 1 19 1 2 1 1 5 VAL H . 5 VAL HN 1 1 20 1 1 1 1 4 CYS HB2 . 4 CYS HB2 1 1 20 1 2 1 1 7 GLY H . 7 GLY HN 1 1 21 1 1 1 1 4 CYS HB2 . 4 CYS HB2 1 1 21 1 2 1 1 7 GLY QA . 7 GLY QA 1 1 22 1 1 1 1 4 CYS HB2 . 4 CYS HB2 1 1 22 1 2 1 1 8 ARG H . 8 ARG HN 1 1 23 1 1 1 1 4 CYS HB3 . 4 CYS HB3 1 1 23 1 2 1 1 5 VAL H . 5 VAL HN 1 1 24 1 1 1 1 4 CYS HB3 . 4 CYS HB3 1 1 24 1 2 1 1 7 GLY H . 7 GLY HN 1 1 25 1 1 1 1 4 CYS HB3 . 4 CYS HB3 1 1 25 1 2 1 1 7 GLY QA . 7 GLY QA 1 1 26 1 1 1 1 4 CYS HB3 . 4 CYS HB3 1 1 26 1 2 1 1 8 ARG H . 8 ARG HN 1 1 27 1 1 1 1 4 CYS SG . 4 CYS SG 1 1 27 1 2 1 1 15 CYS CB . 15 CYS CB 1 1 28 1 1 1 1 4 CYS SG . 4 CYS SG 1 1 28 1 2 1 1 15 CYS SG . 15 CYS SG 1 1 29 1 1 1 1 5 VAL H . 5 VAL HN 1 1 29 1 2 1 1 5 VAL HB . 5 VAL HB 1 1 30 1 1 1 1 5 VAL H . 5 VAL HN 1 1 30 1 2 1 1 6 ARG H . 6 ARG HN 1 1 31 1 1 1 1 5 VAL H . 5 VAL HN 1 1 31 1 2 1 1 8 ARG H . 8 ARG HN 1 1 32 1 1 1 1 5 VAL HA . 5 VAL HA 1 1 32 1 2 1 1 6 ARG H . 6 ARG HN 1 1 33 1 1 1 1 6 ARG H . 6 ARG HN 1 1 33 1 2 1 1 6 ARG QG . 6 ARG QG 1 1 34 1 1 1 1 6 ARG H . 6 ARG HN 1 1 34 1 2 1 1 7 GLY H . 7 GLY HN 1 1 35 1 1 1 1 6 ARG HA . 6 ARG HA 1 1 35 1 2 1 1 7 GLY H . 7 GLY HN 1 1 36 1 1 1 1 7 GLY H . 7 GLY HN 1 1 36 1 2 1 1 8 ARG H . 8 ARG HN 1 1 37 1 1 1 1 8 ARG H . 8 ARG HN 1 1 37 1 2 1 1 8 ARG HB2 . 8 ARG HB2 1 1 38 1 1 1 1 8 ARG H . 8 ARG HN 1 1 38 1 2 1 1 8 ARG HB3 . 8 ARG HB3 1 1 39 1 1 1 1 8 ARG H . 8 ARG HN 1 1 39 1 2 1 1 8 ARG QD . 8 ARG QD 1 1 40 1 1 1 1 8 ARG H . 8 ARG HN 1 1 40 1 2 1 1 8 ARG HG2 . 8 ARG HG2 1 1 41 1 1 1 1 8 ARG H . 8 ARG HN 1 1 41 1 2 1 1 8 ARG HG3 . 8 ARG HG3 1 1 42 1 1 1 1 8 ARG H . 8 ARG HN 1 1 42 1 2 1 1 9 CYS H . 9 CYS HN 1 1 43 1 1 1 1 8 ARG HA . 8 ARG HA 1 1 43 1 2 1 1 9 CYS H . 9 CYS HN 1 1 44 1 1 1 1 8 ARG HB3 . 8 ARG HB3 1 1 44 1 2 1 1 9 CYS H . 9 CYS HN 1 1 45 1 1 1 1 8 ARG QD . 8 ARG QD 1 1 45 1 2 1 1 9 CYS H . 9 CYS HN 1 1 46 1 1 1 1 8 ARG HG2 . 8 ARG HG2 1 1 46 1 2 1 1 9 CYS H . 9 CYS HN 1 1 47 1 1 1 1 8 ARG HG3 . 8 ARG HG3 1 1 47 1 2 1 1 9 CYS H . 9 CYS HN 1 1 48 1 1 1 1 9 CYS CB . 9 CYS CB 1 1 48 1 2 1 1 21 CYS SG . 21 CYS SG 1 1 49 1 1 1 1 9 CYS H . 9 CYS HN 1 1 49 1 2 1 1 9 CYS HB2 . 9 CYS HB2 1 1 50 1 1 1 1 9 CYS H . 9 CYS HN 1 1 50 1 2 1 1 9 CYS HB3 . 9 CYS HB3 1 1 51 1 1 1 1 9 CYS HA . 9 CYS HA 1 1 51 1 2 1 1 10 PRO QD . 10 PRO QD 1 1 52 1 1 1 1 9 CYS QB . 9 CYS QB 1 1 52 1 2 1 1 10 PRO QD . 10 PRO QD 1 1 53 1 1 1 1 9 CYS QB . 9 CYS QB 1 1 53 1 2 1 1 13 MET H . 13 MET HN 1 1 54 1 1 1 1 9 CYS QB . 9 CYS QB 1 1 54 1 2 1 1 13 MET HA . 13 MET HA 1 1 55 1 1 1 1 9 CYS QB . 9 CYS QB 1 1 55 1 2 1 1 13 MET HB2 . 13 MET HB2 1 1 56 1 1 1 1 9 CYS QB . 9 CYS QB 1 1 56 1 2 1 1 13 MET QG . 13 MET QG 1 1 57 1 1 1 1 9 CYS HB2 . 9 CYS HB2 1 1 57 1 2 1 1 10 PRO HD2 . 10 PRO HD2 1 1 58 1 1 1 1 9 CYS HB2 . 9 CYS HB2 1 1 58 1 2 1 1 10 PRO HD3 . 10 PRO HD3 1 1 59 1 1 1 1 9 CYS HB3 . 9 CYS HB3 1 1 59 1 2 1 1 10 PRO HD2 . 10 PRO HD2 1 1 60 1 1 1 1 9 CYS HB3 . 9 CYS HB3 1 1 60 1 2 1 1 10 PRO HD3 . 10 PRO HD3 1 1 61 1 1 1 1 9 CYS SG . 9 CYS SG 1 1 61 1 2 1 1 21 CYS CB . 21 CYS CB 1 1 62 1 1 1 1 9 CYS SG . 9 CYS SG 1 1 62 1 2 1 1 21 CYS SG . 21 CYS SG 1 1 63 1 1 1 1 10 PRO HA . 10 PRO HA 1 1 63 1 2 1 1 11 SER H . 11 SER HN 1 1 64 1 1 1 1 10 PRO HB2 . 10 PRO HB2 1 1 64 1 2 1 1 11 SER H . 11 SER HN 1 1 65 1 1 1 1 10 PRO HB3 . 10 PRO HB3 1 1 65 1 2 1 1 11 SER H . 11 SER HN 1 1 66 1 1 1 1 11 SER H . 11 SER HN 1 1 66 1 2 1 1 11 SER QB . 11 SER QB 1 1 67 1 1 1 1 11 SER H . 11 SER HN 1 1 67 1 2 1 1 12 GLY H . 12 GLY HN 1 1 68 1 1 1 1 11 SER HA . 11 SER HA 1 1 68 1 2 1 1 12 GLY H . 12 GLY HN 1 1 69 1 1 1 1 11 SER HA . 11 SER HA 1 1 69 1 2 1 1 13 MET H . 13 MET HN 1 1 70 1 1 1 1 11 SER QB . 11 SER QB 1 1 70 1 2 1 1 12 GLY H . 12 GLY HN 1 1 71 1 1 1 1 12 GLY H . 12 GLY HN 1 1 71 1 2 1 1 13 MET H . 13 MET HN 1 1 72 1 1 1 1 13 MET H . 13 MET HN 1 1 72 1 2 1 1 13 MET HB2 . 13 MET HB2 1 1 73 1 1 1 1 13 MET H . 13 MET HN 1 1 73 1 2 1 1 13 MET QG . 13 MET QG 1 1 74 1 1 1 1 13 MET HA . 13 MET HA 1 1 74 1 2 1 1 14 CYS H . 14 CYS HN 1 1 75 1 1 1 1 13 MET HB2 . 13 MET HB2 1 1 75 1 2 1 1 14 CYS H . 14 CYS HN 1 1 76 1 1 1 1 13 MET HB2 . 13 MET HB2 1 1 76 1 2 1 1 22 GLY H . 22 GLY HN 1 1 77 1 1 1 1 13 MET HB3 . 13 MET HB3 1 1 77 1 2 1 1 14 CYS H . 14 CYS HN 1 1 78 1 1 1 1 13 MET HB3 . 13 MET HB3 1 1 78 1 2 1 1 21 CYS HA . 21 CYS HA 1 1 79 1 1 1 1 14 CYS CB . 14 CYS CB 1 1 79 1 2 1 1 28 CYS SG . 28 CYS SG 1 1 80 1 1 1 1 14 CYS H . 14 CYS HN 1 1 80 1 2 1 1 14 CYS HB2 . 14 CYS HB2 1 1 81 1 1 1 1 14 CYS H . 14 CYS HN 1 1 81 1 2 1 1 21 CYS HA . 21 CYS HA 1 1 82 1 1 1 1 14 CYS H . 14 CYS HN 1 1 82 1 2 1 1 21 CYS QB . 21 CYS QB 1 1 83 1 1 1 1 14 CYS H . 14 CYS HN 1 1 83 1 2 1 1 22 GLY H . 22 GLY HN 1 1 84 1 1 1 1 14 CYS H . 14 CYS HN 1 1 84 1 2 1 1 23 LYS HA . 23 LYS HA 1 1 85 1 1 1 1 14 CYS H . 14 CYS HN 1 1 85 1 2 1 1 27 TYR QB . 27 TYR HB3 1 1 86 1 1 1 1 14 CYS HA . 14 CYS HA 1 1 86 1 2 1 1 15 CYS H . 15 CYS HN 1 1 87 1 1 1 1 14 CYS HB2 . 14 CYS HB2 1 1 87 1 2 1 1 15 CYS H . 15 CYS HN 1 1 88 1 1 1 1 14 CYS HB2 . 14 CYS HB2 1 1 88 1 2 1 1 22 GLY H . 22 GLY HN 1 1 89 1 1 1 1 14 CYS HB2 . 14 CYS HB2 1 1 89 1 2 1 1 27 TYR QB . 27 TYR HB2 1 1 90 1 1 1 1 14 CYS HB2 . 14 CYS HB2 1 1 90 1 2 1 1 28 CYS H . 28 CYS HN 1 1 91 1 1 1 1 14 CYS HB2 . 14 CYS HB2 1 1 91 1 2 1 1 28 CYS HA . 28 CYS HA 1 1 92 1 1 1 1 14 CYS HB3 . 14 CYS HB3 1 1 92 1 2 1 1 15 CYS H . 15 CYS HN 1 1 93 1 1 1 1 14 CYS HB3 . 14 CYS HB3 1 1 93 1 2 1 1 27 TYR QB . 27 TYR HB3 1 1 94 1 1 1 1 14 CYS SG . 14 CYS SG 1 1 94 1 2 1 1 28 CYS CB . 28 CYS CB 1 1 95 1 1 1 1 14 CYS SG . 14 CYS SG 1 1 95 1 2 1 1 28 CYS SG . 28 CYS SG 1 1 96 1 1 1 1 15 CYS H . 15 CYS HN 1 1 96 1 2 1 1 15 CYS HB2 . 15 CYS HB2 1 1 97 1 1 1 1 15 CYS H . 15 CYS HN 1 1 97 1 2 1 1 15 CYS HB3 . 15 CYS HB3 1 1 98 1 1 1 1 15 CYS H . 15 CYS HN 1 1 98 1 2 1 1 16 SER H . 16 SER HN 1 1 99 1 1 1 1 15 CYS HA . 15 CYS HA 1 1 99 1 2 1 1 16 SER H . 16 SER HN 1 1 100 1 1 1 1 15 CYS HA . 15 CYS HA 1 1 100 1 2 1 1 21 CYS HA . 21 CYS HA 1 1 101 1 1 1 1 15 CYS HB2 . 15 CYS HB2 1 1 101 1 2 1 1 16 SER H . 16 SER HN 1 1 102 1 1 1 1 15 CYS HB3 . 15 CYS HB3 1 1 102 1 2 1 1 16 SER H . 16 SER HN 1 1 103 1 1 1 1 16 SER H . 16 SER HN 1 1 103 1 2 1 1 16 SER QB . 16 SER QB 1 1 104 1 1 1 1 16 SER H . 16 SER HN 1 1 104 1 2 1 1 17 GLN H . 17 GLN HN 1 1 105 1 1 1 1 16 SER H . 16 SER HN 1 1 105 1 2 1 1 17 GLN HA . 17 GLN HA 1 1 106 1 1 1 1 16 SER H . 16 SER HN 1 1 106 1 2 1 1 21 CYS HA . 21 CYS HA 1 1 107 1 1 1 1 16 SER H . 16 SER HN 1 1 107 1 2 1 1 27 TYR QD . 27 TYR QD 1 1 108 1 1 1 1 16 SER HA . 16 SER HA 1 1 108 1 2 1 1 17 GLN H . 17 GLN HN 1 1 109 1 1 1 1 16 SER HA . 16 SER HA 1 1 109 1 2 1 1 27 TYR HA . 27 TYR HA 1 1 110 1 1 1 1 16 SER HA . 16 SER HA 1 1 110 1 2 1 1 27 TYR QB . 27 TYR HB3 1 1 111 1 1 1 1 16 SER HA . 16 SER HA 1 1 111 1 2 1 1 27 TYR QD . 27 TYR QD 1 1 112 1 1 1 1 16 SER QB . 16 SER QB 1 1 112 1 2 1 1 17 GLN H . 17 GLN HN 1 1 113 1 1 1 1 16 SER QB . 16 SER QB 1 1 113 1 2 1 1 27 TYR H . 27 TYR HN 1 1 114 1 1 1 1 16 SER QB . 16 SER QB 1 1 114 1 2 1 1 27 TYR HA . 27 TYR HA 1 1 115 1 1 1 1 16 SER QB . 16 SER QB 1 1 115 1 2 1 1 27 TYR QB . 27 TYR HB3 1 1 116 1 1 1 1 16 SER QB . 16 SER QB 1 1 116 1 2 1 1 27 TYR QD . 27 TYR QD 1 1 117 1 1 1 1 16 SER QB . 16 SER QB 1 1 117 1 2 1 1 27 TYR QE . 27 TYR QE 1 1 118 1 1 1 1 17 GLN H . 17 GLN HN 1 1 118 1 2 1 1 17 GLN HB2 . 17 GLN HB2 1 1 119 1 1 1 1 17 GLN H . 17 GLN HN 1 1 119 1 2 1 1 17 GLN HB3 . 17 GLN HB3 1 1 120 1 1 1 1 17 GLN H . 17 GLN HN 1 1 120 1 2 1 1 17 GLN QG . 17 GLN QG 1 1 121 1 1 1 1 17 GLN HA . 17 GLN HA 1 1 121 1 2 1 1 17 GLN QG . 17 GLN QG 1 1 122 1 1 1 1 17 GLN HA . 17 GLN HA 1 1 122 1 2 1 1 19 GLY H . 19 GLY HN 1 1 123 1 1 1 1 21 CYS HA . 21 CYS HA 1 1 123 1 2 1 1 22 GLY H . 22 GLY HN 1 1 124 1 1 1 1 21 CYS HA . 21 CYS HA 1 1 124 1 2 1 1 27 TYR QD . 27 TYR QD 1 1 125 1 1 1 1 21 CYS QB . 21 CYS QB 1 1 125 1 2 1 1 22 GLY H . 22 GLY HN 1 1 126 1 1 1 1 22 GLY H . 22 GLY HN 1 1 126 1 2 1 1 27 TYR QB . 27 TYR HB2 1 1 127 1 1 1 1 22 GLY H . 22 GLY HN 1 1 127 1 2 1 1 27 TYR QD . 27 TYR QD 1 1 128 1 1 1 1 22 GLY QA . 22 GLY QA 1 1 128 1 2 1 1 23 LYS H . 23 LYS HN 1 1 129 1 1 1 1 22 GLY QA . 22 GLY QA 1 1 129 1 2 1 1 27 TYR QD . 27 TYR QD 1 1 130 1 1 1 1 22 GLY HA2 . 22 GLY HA1 1 1 130 1 2 1 1 23 LYS H . 23 LYS HN 1 1 131 1 1 1 1 22 GLY HA3 . 22 GLY HA2 1 1 131 1 2 1 1 23 LYS H . 23 LYS HN 1 1 132 1 1 1 1 23 LYS H . 23 LYS HN 1 1 132 1 2 1 1 23 LYS QB . 23 LYS QB 1 1 133 1 1 1 1 23 LYS H . 23 LYS HN 1 1 133 1 2 1 1 23 LYS HG2 . 23 LYS HG2 1 1 134 1 1 1 1 23 LYS H . 23 LYS HN 1 1 134 1 2 1 1 23 LYS HG3 . 23 LYS HG3 1 1 135 1 1 1 1 23 LYS H . 23 LYS HN 1 1 135 1 2 1 1 24 GLY QA . 24 GLY QA 1 1 136 1 1 1 1 23 LYS HA . 23 LYS HA 1 1 136 1 2 1 1 23 LYS QG . 23 LYS QG 1 1 137 1 1 1 1 23 LYS HA . 23 LYS HA 1 1 137 1 2 1 1 24 GLY H . 24 GLY HN 1 1 138 1 1 1 1 24 GLY QA . 24 GLY QA 1 1 138 1 2 1 1 26 LYS H . 26 LYS HN 1 1 139 1 1 1 1 26 LYS H . 26 LYS HN 1 1 139 1 2 1 1 26 LYS HB2 . 26 LYS HB2 1 1 140 1 1 1 1 26 LYS H . 26 LYS HN 1 1 140 1 2 1 1 26 LYS HB3 . 26 LYS HB3 1 1 141 1 1 1 1 26 LYS H . 26 LYS HN 1 1 141 1 2 1 1 26 LYS QD . 26 LYS QD 1 1 142 1 1 1 1 26 LYS H . 26 LYS HN 1 1 142 1 2 1 1 26 LYS QG . 26 LYS QG 1 1 143 1 1 1 1 26 LYS H . 26 LYS HN 1 1 143 1 2 1 1 27 TYR H . 27 TYR HN 1 1 144 1 1 1 1 26 LYS HA . 26 LYS HA 1 1 144 1 2 1 1 26 LYS QG . 26 LYS QG 1 1 145 1 1 1 1 26 LYS HA . 26 LYS HA 1 1 145 1 2 1 1 28 CYS H . 28 CYS HN 1 1 146 1 1 1 1 26 LYS HB2 . 26 LYS HB2 1 1 146 1 2 1 1 27 TYR H . 27 TYR HN 1 1 147 1 1 1 1 26 LYS HB2 . 26 LYS HB2 1 1 147 1 2 1 1 27 TYR QD . 27 TYR QD 1 1 148 1 1 1 1 26 LYS HB2 . 26 LYS HB2 1 1 148 1 2 1 1 27 TYR QE . 27 TYR QE 1 1 149 1 1 1 1 26 LYS HB3 . 26 LYS HB3 1 1 149 1 2 1 1 26 LYS QD . 26 LYS QD 1 1 150 1 1 1 1 26 LYS HB3 . 26 LYS HB3 1 1 150 1 2 1 1 27 TYR H . 27 TYR HN 1 1 151 1 1 1 1 26 LYS HB3 . 26 LYS HB3 1 1 151 1 2 1 1 27 TYR QD . 27 TYR QD 1 1 152 1 1 1 1 27 TYR H . 27 TYR HN 1 1 152 1 2 1 1 27 TYR QB . 27 TYR HB2 1 1 153 1 1 1 1 27 TYR H . 27 TYR HN 1 1 153 1 2 1 1 28 CYS H . 28 CYS HN 1 1 154 1 1 1 1 27 TYR QB . 27 TYR HB2 1 1 154 1 2 1 1 28 CYS H . 28 CYS HN 1 1 155 1 1 1 1 27 TYR QB . 27 TYR HB2 1 1 155 1 2 1 1 28 CYS HA . 28 CYS HA 1 1 156 1 1 1 1 28 CYS H . 28 CYS HN 1 1 156 1 2 1 1 28 CYS HB2 . 28 CYS HB2 1 1 157 1 1 1 1 28 CYS H . 28 CYS HN 1 1 157 1 2 1 1 28 CYS QB . 28 CYS QB 1 1 158 1 1 1 1 28 CYS H . 28 CYS HN 1 1 158 1 2 1 1 28 CYS HB3 . 28 CYS HB3 1 1 159 1 1 1 1 28 CYS H . 28 CYS HN 1 1 159 1 2 1 1 29 GLY H . 29 GLY HN 1 1 160 1 1 1 1 28 CYS H . 28 CYS HN 1 1 160 1 2 1 1 30 ARG HA . 30 ARG HA 1 1 161 1 1 1 1 28 CYS HB2 . 28 CYS HB2 1 1 161 1 2 1 1 29 GLY H . 29 GLY HN 1 1 162 1 1 1 1 28 CYS HB3 . 28 CYS HB3 1 1 162 1 2 1 1 29 GLY H . 29 GLY HN 1 1 163 1 1 1 1 29 GLY H . 29 GLY HN 1 1 163 1 2 1 1 30 ARG HA . 30 ARG HA 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 2.5 1 1 2 1 . . . . . . . 5.0 1 1 3 1 . . . . . . . 5.5 1 1 4 1 . . . . . . . 6.59 1 1 5 1 . . . . . . . 7.7 1 1 6 1 . . . . . . . 7.7 1 1 7 1 . . . . . . . 3.5 1 1 8 1 . . . . . . . 3.15 1 1 9 1 . . . . . . . 5.0 1 1 10 1 . . . . . . . 3.0 1 1 11 1 . . . . . . . 4.18 1 1 12 1 . . . . . . . 6.18 1 1 13 1 . . . . . . . 3.1 1 1 14 1 . . . . . . . 3.5 1 1 15 1 . . . . . . . 6.18 1 1 16 1 . . . . . . . 5.0 1 1 17 1 . . . . . . . 2.5 1 1 18 1 . . . . . . . 8.96 1 1 19 1 . . . . . . . 3.5 1 1 20 1 . . . . . . . 3.5 1 1 21 1 . . . . . . . 6.08 1 1 22 1 . . . . . . . 5.0 1 1 23 1 . . . . . . . 3.5 1 1 24 1 . . . . . . . 5.0 1 1 25 1 . . . . . . . 6.08 1 1 26 1 . . . . . . . 5.0 1 1 27 1 . . . . . . . 3.1 1 1 28 1 . . . . . . . 2.1 1 1 29 1 . . . . . . . 2.5 1 1 30 1 . . . . . . . 5.0 1 1 31 1 . . . . . . . 3.0 1 1 32 1 . . . . . . . 2.5 1 1 33 1 . . . . . . . 4.08 1 1 34 1 . . . . . . . 2.5 1 1 35 1 . . . . . . . 2.5 1 1 36 1 . . . . . . . 3.0 1 1 37 1 . . . . . . . 2.5 1 1 38 1 . . . . . . . 3.0 1 1 39 1 . . . . . . . 6.08 1 1 40 1 . . . . . . . 5.0 1 1 41 1 . . . . . . . 5.0 1 1 42 1 . . . . . . . 5.0 1 1 43 1 . . . . . . . 2.5 1 1 44 1 . . . . . . . 3.0 1 1 45 1 . . . . . . . 6.08 1 1 46 1 . . . . . . . 5.5 1 1 47 1 . . . . . . . 5.5 1 1 48 1 . . . . . . . 3.1 1 1 49 1 . . . . . . . 3.0 1 1 50 1 . . . . . . . 3.5 1 1 51 1 . . . . . . . 3.39 1 1 52 1 . . . . . . . 4.48 1 1 53 1 . . . . . . . 6.08 1 1 54 1 . . . . . . . 6.08 1 1 55 1 . . . . . . . 3.08 1 1 56 1 . . . . . . . 5.0 1 1 57 1 . . . . . . . 5.0 1 1 58 1 . . . . . . . 5.5 1 1 59 1 . . . . . . . 5.5 1 1 60 1 . . . . . . . 5.0 1 1 61 1 . . . . . . . 3.1 1 1 62 1 . . . . . . . 2.1 1 1 63 1 . . . . . . . 2.5 1 1 64 1 . . . . . . . 3.0 1 1 65 1 . . . . . . . 3.5 1 1 66 1 . . . . . . . 3.04 1 1 67 1 . . . . . . . 5.5 1 1 68 1 . . . . . . . 2.5 1 1 69 1 . . . . . . . 5.0 1 1 70 1 . . . . . . . 4.08 1 1 71 1 . . . . . . . 5.0 1 1 72 1 . . . . . . . 2.5 1 1 73 1 . . . . . . . 4.08 1 1 74 1 . . . . . . . 2.5 1 1 75 1 . . . . . . . 3.5 1 1 76 1 . . . . . . . 5.0 1 1 77 1 . . . . . . . 3.0 1 1 78 1 . . . . . . . 5.5 1 1 79 1 . . . . . . . 3.1 1 1 80 1 . . . . . . . 3.5 1 1 81 1 . . . . . . . 5.5 1 1 82 1 . . . . . . . 6.08 1 1 83 1 . . . . . . . 3.0 1 1 84 1 . . . . . . . 5.0 1 1 85 1 . . . . . . . 5.5 1 1 86 1 . . . . . . . 2.5 1 1 87 1 . . . . . . . 4.5 1 1 88 1 . . . . . . . 5.5 1 1 89 1 . . . . . . . 5.0 1 1 90 1 . . . . . . . 5.5 1 1 91 1 . . . . . . . 3.0 1 1 92 1 . . . . . . . 3.5 1 1 93 1 . . . . . . . 4.5 1 1 94 1 . . . . . . . 3.1 1 1 95 1 . . . . . . . 2.1 1 1 96 1 . . . . . . . 3.0 1 1 97 1 . . . . . . . 3.5 1 1 98 1 . . . . . . . 5.5 1 1 99 1 . . . . . . . 2.5 1 1 100 1 . . . . . . . 3.5 1 1 101 1 . . . . . . . 5.0 1 1 102 1 . . . . . . . 5.5 1 1 103 1 . . . . . . . 3.24 1 1 104 1 . . . . . . . 5.0 1 1 105 1 . . . . . . . 5.0 1 1 106 1 . . . . . . . 4.5 1 1 107 1 . . . . . . . 7.0 1 1 108 1 . . . . . . . 3.0 1 1 109 1 . . . . . . . 5.5 1 1 110 1 . . . . . . . 5.5 1 1 111 1 . . . . . . . 7.7 1 1 112 1 . . . . . . . 3.08 1 1 113 1 . . . . . . . 6.08 1 1 114 1 . . . . . . . 4.08 1 1 115 1 . . . . . . . 6.08 1 1 116 1 . . . . . . . 5.28 1 1 117 1 . . . . . . . 8.28 1 1 118 1 . . . . . . . 3.5 1 1 119 1 . . . . . . . 3.5 1 1 120 1 . . . . . . . 4.08 1 1 121 1 . . . . . . . 3.51 1 1 122 1 . . . . . . . 5.0 1 1 123 1 . . . . . . . 2.5 1 1 124 1 . . . . . . . 7.7 1 1 125 1 . . . . . . . 4.08 1 1 126 1 . . . . . . . 3.5 1 1 127 1 . . . . . . . 7.7 1 1 128 1 . . . . . . . 2.61 1 1 129 1 . . . . . . . 8.28 1 1 130 1 . . . . . . . 3.5 1 1 131 1 . . . . . . . 3.0 1 1 132 1 . . . . . . . 3.24 1 1 133 1 . . . . . . . 5.0 1 1 134 1 . . . . . . . 5.0 1 1 135 1 . . . . . . . 6.08 1 1 136 1 . . . . . . . 3.5 1 1 137 1 . . . . . . . 3.0 1 1 138 1 . . . . . . . 6.08 1 1 139 1 . . . . . . . 2.5 1 1 140 1 . . . . . . . 3.0 1 1 141 1 . . . . . . . 6.08 1 1 142 1 . . . . . . . 4.08 1 1 143 1 . . . . . . . 3.5 1 1 144 1 . . . . . . . 3.5 1 1 145 1 . . . . . . . 5.0 1 1 146 1 . . . . . . . 5.5 1 1 147 1 . . . . . . . 5.7 1 1 148 1 . . . . . . . 7.7 1 1 149 1 . . . . . . . 3.52 1 1 150 1 . . . . . . . 5.5 1 1 151 1 . . . . . . . 7.7 1 1 152 1 . . . . . . . 3.0 1 1 153 1 . . . . . . . 2.5 1 1 154 1 . . . . . . . 2.4 1 1 155 1 . . . . . . . 5.0 1 1 156 1 . . . . . . . 3.0 1 1 157 1 . . . . . . . 2.61 1 1 158 1 . . . . . . . 2.5 1 1 159 1 . . . . . . . 3.5 1 1 160 1 . . . . . . . 5.0 1 1 161 1 . . . . . . . 5.5 1 1 162 1 . . . . . . . 5.0 1 1 163 1 . . . . . . . 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 1 VAL C C 6.007 3.612 7.711 1.00 . A A . 1 VAL C 1 1 1 2 1 1 1 VAL CA C 7.272 4.202 8.310 1.00 . A A . 1 VAL CA 1 1 1 3 1 1 1 VAL CB C 7.327 4.017 9.832 1.00 . A A . 1 VAL CB 1 1 1 4 1 1 1 VAL CG1 C 6.182 4.706 10.580 1.00 . A A . 1 VAL CG1 1 1 1 5 1 1 1 VAL CG2 C 7.356 2.533 10.201 1.00 . A A . 1 VAL CG2 1 1 1 6 1 1 1 VAL H1 H 8.087 6.092 8.441 1.00 . A A . 1 VAL H1 1 1 1 7 1 1 1 VAL H2 H 6.466 6.064 8.040 1.00 . A A . 1 VAL H2 1 1 1 8 1 1 1 VAL H3 H 7.628 5.657 6.931 1.00 . A A . 1 VAL H3 1 1 1 9 1 1 1 VAL HA H 8.126 3.676 7.884 1.00 . A A . 1 VAL HA 1 1 1 10 1 1 1 VAL HB H 8.263 4.459 10.175 1.00 . A A . 1 VAL HB 1 1 1 11 1 1 1 VAL HG11 H 6.157 5.773 10.363 1.00 . A A . 1 VAL HG11 1 1 1 12 1 1 1 VAL HG12 H 5.222 4.263 10.316 1.00 . A A . 1 VAL HG12 1 1 1 13 1 1 1 VAL HG13 H 6.333 4.580 11.653 1.00 . A A . 1 VAL HG13 1 1 1 14 1 1 1 VAL HG21 H 8.157 2.031 9.659 1.00 . A A . 1 VAL HG21 1 1 1 15 1 1 1 VAL HG22 H 7.540 2.429 11.270 1.00 . A A . 1 VAL HG22 1 1 1 16 1 1 1 VAL HG23 H 6.405 2.054 9.966 1.00 . A A . 1 VAL HG23 1 1 1 17 1 1 1 VAL N N 7.367 5.620 7.916 1.00 . A A . 1 VAL N 1 1 1 18 1 1 1 VAL O O 4.978 4.280 7.726 1.00 . A A . 1 VAL O 1 1 1 19 1 1 2 GLY C C 5.019 2.045 4.926 1.00 . A A . 2 GLY C 1 1 1 20 1 1 2 GLY CA C 4.989 1.768 6.431 1.00 . A A . 2 GLY CA 1 1 1 21 1 1 2 GLY H H 7.055 2.125 6.928 1.00 . A A . 2 GLY H 1 1 1 22 1 1 2 GLY HA2 H 5.045 0.689 6.579 1.00 . A A . 2 GLY HA2 1 1 1 23 1 1 2 GLY HA3 H 4.034 2.118 6.826 1.00 . A A . 2 GLY HA3 1 1 1 24 1 1 2 GLY N N 6.095 2.411 7.142 1.00 . A A . 2 GLY N 1 1 1 25 1 1 2 GLY O O 3.992 1.969 4.260 1.00 . A A . 2 GLY O 1 1 1 26 1 1 3 GLU C C 6.725 1.648 2.114 1.00 . A A . 3 GLU C 1 1 1 27 1 1 3 GLU CA C 6.380 2.842 3.011 1.00 . A A . 3 GLU CA 1 1 1 28 1 1 3 GLU CB C 7.444 3.954 2.939 1.00 . A A . 3 GLU CB 1 1 1 29 1 1 3 GLU CD C 8.572 3.905 5.219 1.00 . A A . 3 GLU CD 1 1 1 30 1 1 3 GLU CG C 8.756 3.720 3.708 1.00 . A A . 3 GLU CG 1 1 1 31 1 1 3 GLU H H 7.002 2.383 4.984 1.00 . A A . 3 GLU H 1 1 1 32 1 1 3 GLU HA H 5.453 3.276 2.641 1.00 . A A . 3 GLU HA 1 1 1 33 1 1 3 GLU HB2 H 7.679 4.084 1.976 1.00 . A A . 3 GLU HB2 1 1 1 34 1 1 3 GLU HB3 H 7.030 4.791 3.298 1.00 . A A . 3 GLU HB3 1 1 1 35 1 1 3 GLU HG2 H 9.072 2.788 3.532 1.00 . A A . 3 GLU HG2 1 1 1 36 1 1 3 GLU HG3 H 9.442 4.372 3.383 1.00 . A A . 3 GLU HG3 1 1 1 37 1 1 3 GLU N N 6.178 2.423 4.390 1.00 . A A . 3 GLU N 1 1 1 38 1 1 3 GLU O O 7.589 0.837 2.430 1.00 . A A . 3 GLU O 1 1 1 39 1 1 3 GLU OE1 O 8.535 5.066 5.688 1.00 . A A . 3 GLU OE1 1 1 1 40 1 1 3 GLU OE2 O 8.327 2.888 5.912 1.00 . A A . 3 GLU OE2 1 1 1 41 1 1 4 CYS C C 7.627 0.618 -0.700 1.00 . A A . 4 CYS C 1 1 1 42 1 1 4 CYS CA C 6.303 0.433 0.045 1.00 . A A . 4 CYS CA 1 1 1 43 1 1 4 CYS CB C 5.196 0.367 -1.016 1.00 . A A . 4 CYS CB 1 1 1 44 1 1 4 CYS H H 5.354 2.225 0.733 1.00 . A A . 4 CYS H 1 1 1 45 1 1 4 CYS HA H 6.331 -0.503 0.601 1.00 . A A . 4 CYS HA 1 1 1 46 1 1 4 CYS HB2 H 5.355 1.117 -1.658 1.00 . A A . 4 CYS HB2 1 1 1 47 1 1 4 CYS HB3 H 5.294 -0.506 -1.493 1.00 . A A . 4 CYS HB3 1 1 1 48 1 1 4 CYS N N 6.053 1.532 0.968 1.00 . A A . 4 CYS N 1 1 1 49 1 1 4 CYS O O 8.066 1.748 -0.954 1.00 . A A . 4 CYS O 1 1 1 50 1 1 4 CYS SG S 3.482 0.487 -0.468 1.00 . A A . 4 CYS SG 1 1 1 51 1 1 5 VAL C C 8.533 -0.055 -3.647 1.00 . A A . 5 VAL C 1 1 1 52 1 1 5 VAL CA C 9.170 -0.459 -2.311 1.00 . A A . 5 VAL CA 1 1 1 53 1 1 5 VAL CB C 9.871 -1.828 -2.377 1.00 . A A . 5 VAL CB 1 1 1 54 1 1 5 VAL CG1 C 11.117 -1.778 -3.269 1.00 . A A . 5 VAL CG1 1 1 1 55 1 1 5 VAL CG2 C 10.340 -2.266 -0.985 1.00 . A A . 5 VAL CG2 1 1 1 56 1 1 5 VAL H H 7.698 -1.363 -1.053 1.00 . A A . 5 VAL H 1 1 1 57 1 1 5 VAL HA H 9.917 0.292 -2.054 1.00 . A A . 5 VAL HA 1 1 1 58 1 1 5 VAL HB H 9.168 -2.575 -2.744 1.00 . A A . 5 VAL HB 1 1 1 59 1 1 5 VAL HG11 H 11.821 -1.039 -2.887 1.00 . A A . 5 VAL HG11 1 1 1 60 1 1 5 VAL HG12 H 11.599 -2.755 -3.277 1.00 . A A . 5 VAL HG12 1 1 1 61 1 1 5 VAL HG13 H 10.856 -1.524 -4.296 1.00 . A A . 5 VAL HG13 1 1 1 62 1 1 5 VAL HG21 H 10.975 -1.498 -0.545 1.00 . A A . 5 VAL HG21 1 1 1 63 1 1 5 VAL HG22 H 9.491 -2.449 -0.328 1.00 . A A . 5 VAL HG22 1 1 1 64 1 1 5 VAL HG23 H 10.909 -3.193 -1.064 1.00 . A A . 5 VAL HG23 1 1 1 65 1 1 5 VAL N N 8.136 -0.473 -1.273 1.00 . A A . 5 VAL N 1 1 1 66 1 1 5 VAL O O 8.520 -0.810 -4.611 1.00 . A A . 5 VAL O 1 1 1 67 1 1 6 ARG C C 6.159 0.792 -5.417 1.00 . A A . 6 ARG C 1 1 1 68 1 1 6 ARG CA C 7.152 1.743 -4.754 1.00 . A A . 6 ARG CA 1 1 1 69 1 1 6 ARG CB C 8.111 2.409 -5.753 1.00 . A A . 6 ARG CB 1 1 1 70 1 1 6 ARG CD C 8.284 4.580 -4.372 1.00 . A A . 6 ARG CD 1 1 1 71 1 1 6 ARG CG C 9.035 3.462 -5.115 1.00 . A A . 6 ARG CG 1 1 1 72 1 1 6 ARG CZ C 7.061 4.706 -2.180 1.00 . A A . 6 ARG CZ 1 1 1 73 1 1 6 ARG H H 7.874 1.588 -2.757 1.00 . A A . 6 ARG H 1 1 1 74 1 1 6 ARG HA H 6.515 2.512 -4.327 1.00 . A A . 6 ARG HA 1 1 1 75 1 1 6 ARG HB2 H 8.680 1.698 -6.166 1.00 . A A . 6 ARG HB2 1 1 1 76 1 1 6 ARG HB3 H 7.567 2.855 -6.463 1.00 . A A . 6 ARG HB3 1 1 1 77 1 1 6 ARG HD2 H 8.838 5.412 -4.397 1.00 . A A . 6 ARG HD2 1 1 1 78 1 1 6 ARG HD3 H 7.413 4.745 -4.834 1.00 . A A . 6 ARG HD3 1 1 1 79 1 1 6 ARG HE H 8.657 3.591 -2.517 1.00 . A A . 6 ARG HE 1 1 1 80 1 1 6 ARG HG2 H 9.637 3.000 -4.464 1.00 . A A . 6 ARG HG2 1 1 1 81 1 1 6 ARG HG3 H 9.585 3.879 -5.839 1.00 . A A . 6 ARG HG3 1 1 1 82 1 1 6 ARG HH11 H 6.294 6.015 -3.501 1.00 . A A . 6 ARG HH11 1 1 1 83 1 1 6 ARG HH12 H 5.515 5.973 -1.955 1.00 . A A . 6 ARG HH12 1 1 1 84 1 1 6 ARG HH21 H 7.552 3.483 -0.671 1.00 . A A . 6 ARG HH21 1 1 1 85 1 1 6 ARG HH22 H 6.222 4.549 -0.368 1.00 . A A . 6 ARG HH22 1 1 1 86 1 1 6 ARG N N 7.897 1.125 -3.652 1.00 . A A . 6 ARG N 1 1 1 87 1 1 6 ARG NE N 8.017 4.230 -2.966 1.00 . A A . 6 ARG NE 1 1 1 88 1 1 6 ARG NH1 N 6.223 5.639 -2.577 1.00 . A A . 6 ARG NH1 1 1 1 89 1 1 6 ARG NH2 N 6.935 4.207 -0.979 1.00 . A A . 6 ARG NH2 1 1 1 90 1 1 6 ARG O O 5.890 0.864 -6.610 1.00 . A A . 6 ARG O 1 1 1 91 1 1 7 GLY C C 4.191 -2.117 -4.045 1.00 . A A . 7 GLY C 1 1 1 92 1 1 7 GLY CA C 4.460 -0.930 -4.974 1.00 . A A . 7 GLY CA 1 1 1 93 1 1 7 GLY H H 5.855 0.074 -3.624 1.00 . A A . 7 GLY H 1 1 1 94 1 1 7 GLY HA2 H 3.550 -0.333 -5.031 1.00 . A A . 7 GLY HA2 1 1 1 95 1 1 7 GLY HA3 H 4.656 -1.328 -5.971 1.00 . A A . 7 GLY HA3 1 1 1 96 1 1 7 GLY N N 5.571 -0.060 -4.582 1.00 . A A . 7 GLY N 1 1 1 97 1 1 7 GLY O O 3.060 -2.590 -3.986 1.00 . A A . 7 GLY O 1 1 1 98 1 1 8 ARG C C 5.649 -3.513 -1.004 1.00 . A A . 8 ARG C 1 1 1 99 1 1 8 ARG CA C 5.005 -3.727 -2.372 1.00 . A A . 8 ARG CA 1 1 1 100 1 1 8 ARG CB C 5.534 -5.007 -3.048 1.00 . A A . 8 ARG CB 1 1 1 101 1 1 8 ARG CD C 4.295 -7.241 -2.923 1.00 . A A . 8 ARG CD 1 1 1 102 1 1 8 ARG CG C 4.404 -5.878 -3.624 1.00 . A A . 8 ARG CG 1 1 1 103 1 1 8 ARG CZ C 2.883 -7.005 -0.859 1.00 . A A . 8 ARG CZ 1 1 1 104 1 1 8 ARG H H 6.124 -2.236 -3.425 1.00 . A A . 8 ARG H 1 1 1 105 1 1 8 ARG HA H 3.939 -3.843 -2.171 1.00 . A A . 8 ARG HA 1 1 1 106 1 1 8 ARG HB2 H 6.149 -4.746 -3.792 1.00 . A A . 8 ARG HB2 1 1 1 107 1 1 8 ARG HB3 H 6.038 -5.543 -2.371 1.00 . A A . 8 ARG HB3 1 1 1 108 1 1 8 ARG HD2 H 3.541 -7.751 -3.337 1.00 . A A . 8 ARG HD2 1 1 1 109 1 1 8 ARG HD3 H 5.151 -7.739 -3.063 1.00 . A A . 8 ARG HD3 1 1 1 110 1 1 8 ARG HE H 4.833 -7.278 -0.838 1.00 . A A . 8 ARG HE 1 1 1 111 1 1 8 ARG HG2 H 3.537 -5.391 -3.515 1.00 . A A . 8 ARG HG2 1 1 1 112 1 1 8 ARG HG3 H 4.581 -6.031 -4.596 1.00 . A A . 8 ARG HG3 1 1 1 113 1 1 8 ARG HH11 H 1.753 -6.688 -2.486 1.00 . A A . 8 ARG HH11 1 1 1 114 1 1 8 ARG HH12 H 0.906 -6.684 -0.976 1.00 . A A . 8 ARG HH12 1 1 1 115 1 1 8 ARG HH21 H 3.646 -7.231 0.979 1.00 . A A . 8 ARG HH21 1 1 1 116 1 1 8 ARG HH22 H 1.934 -6.978 0.905 1.00 . A A . 8 ARG HH22 1 1 1 117 1 1 8 ARG N N 5.189 -2.594 -3.288 1.00 . A A . 8 ARG N 1 1 1 118 1 1 8 ARG NE N 4.048 -7.136 -1.473 1.00 . A A . 8 ARG NE 1 1 1 119 1 1 8 ARG NH1 N 1.759 -6.774 -1.490 1.00 . A A . 8 ARG NH1 1 1 1 120 1 1 8 ARG NH2 N 2.816 -7.077 0.443 1.00 . A A . 8 ARG NH2 1 1 1 121 1 1 8 ARG O O 6.452 -2.608 -0.805 1.00 . A A . 8 ARG O 1 1 1 122 1 1 9 CYS C C 5.779 -5.987 1.669 1.00 . A A . 9 CYS C 1 1 1 123 1 1 9 CYS CA C 5.691 -4.493 1.308 1.00 . A A . 9 CYS CA 1 1 1 124 1 1 9 CYS CB C 4.640 -3.764 2.154 1.00 . A A . 9 CYS CB 1 1 1 125 1 1 9 CYS H H 4.649 -5.126 -0.384 1.00 . A A . 9 CYS H 1 1 1 126 1 1 9 CYS HA H 6.671 -4.033 1.443 1.00 . A A . 9 CYS HA 1 1 1 127 1 1 9 CYS HB2 H 3.783 -3.741 1.639 1.00 . A A . 9 CYS HB2 1 1 1 128 1 1 9 CYS HB3 H 4.507 -4.279 3.001 1.00 . A A . 9 CYS HB3 1 1 1 129 1 1 9 CYS N N 5.271 -4.394 -0.083 1.00 . A A . 9 CYS N 1 1 1 130 1 1 9 CYS O O 5.488 -6.823 0.804 1.00 . A A . 9 CYS O 1 1 1 131 1 1 9 CYS SG S 5.085 -2.069 2.587 1.00 . A A . 9 CYS SG 1 1 1 132 1 1 10 PRO C C 4.983 -8.597 3.125 1.00 . A A . 10 PRO C 1 1 1 133 1 1 10 PRO CA C 6.232 -7.735 3.358 1.00 . A A . 10 PRO CA 1 1 1 134 1 1 10 PRO CB C 6.612 -7.661 4.840 1.00 . A A . 10 PRO CB 1 1 1 135 1 1 10 PRO CD C 6.636 -5.456 3.949 1.00 . A A . 10 PRO CD 1 1 1 136 1 1 10 PRO CG C 7.399 -6.354 4.920 1.00 . A A . 10 PRO CG 1 1 1 137 1 1 10 PRO HA H 7.058 -8.202 2.820 1.00 . A A . 10 PRO HA 1 1 1 138 1 1 10 PRO HB2 H 5.798 -7.628 5.420 1.00 . A A . 10 PRO HB2 1 1 1 139 1 1 10 PRO HB3 H 7.179 -8.440 5.106 1.00 . A A . 10 PRO HB3 1 1 1 140 1 1 10 PRO HD2 H 5.876 -5.002 4.415 1.00 . A A . 10 PRO HD2 1 1 1 141 1 1 10 PRO HD3 H 7.246 -4.768 3.556 1.00 . A A . 10 PRO HD3 1 1 1 142 1 1 10 PRO HG2 H 7.385 -5.979 5.847 1.00 . A A . 10 PRO HG2 1 1 1 143 1 1 10 PRO HG3 H 8.346 -6.483 4.626 1.00 . A A . 10 PRO HG3 1 1 1 144 1 1 10 PRO N N 6.138 -6.347 2.912 1.00 . A A . 10 PRO N 1 1 1 145 1 1 10 PRO O O 3.946 -8.158 2.611 1.00 . A A . 10 PRO O 1 1 1 146 1 1 11 SER C C 2.810 -10.759 3.889 1.00 . A A . 11 SER C 1 1 1 147 1 1 11 SER CA C 4.132 -10.912 3.144 1.00 . A A . 11 SER CA 1 1 1 148 1 1 11 SER CB C 4.720 -12.286 3.428 1.00 . A A . 11 SER CB 1 1 1 149 1 1 11 SER H H 5.946 -10.174 3.951 1.00 . A A . 11 SER H 1 1 1 150 1 1 11 SER HA H 3.924 -10.861 2.074 1.00 . A A . 11 SER HA 1 1 1 151 1 1 11 SER HB2 H 4.055 -12.992 3.185 1.00 . A A . 11 SER HB2 1 1 1 152 1 1 11 SER HB3 H 5.553 -12.412 2.890 1.00 . A A . 11 SER HB3 1 1 1 153 1 1 11 SER HG H 4.191 -12.224 5.277 1.00 . A A . 11 SER HG 1 1 1 154 1 1 11 SER N N 5.103 -9.876 3.480 1.00 . A A . 11 SER N 1 1 1 155 1 1 11 SER O O 2.564 -11.435 4.887 1.00 . A A . 11 SER O 1 1 1 156 1 1 11 SER OG O 5.026 -12.376 4.802 1.00 . A A . 11 SER OG 1 1 1 157 1 1 12 GLY C C -0.075 -8.413 3.486 1.00 . A A . 12 GLY C 1 1 1 158 1 1 12 GLY CA C 0.555 -9.779 3.755 1.00 . A A . 12 GLY CA 1 1 1 159 1 1 12 GLY H H 2.351 -9.357 2.595 1.00 . A A . 12 GLY H 1 1 1 160 1 1 12 GLY HA2 H -0.026 -10.533 3.224 1.00 . A A . 12 GLY HA2 1 1 1 161 1 1 12 GLY HA3 H 0.468 -9.981 4.824 1.00 . A A . 12 GLY HA3 1 1 1 162 1 1 12 GLY N N 1.956 -9.895 3.356 1.00 . A A . 12 GLY N 1 1 1 163 1 1 12 GLY O O -1.303 -8.313 3.427 1.00 . A A . 12 GLY O 1 1 1 164 1 1 13 MET C C -0.217 -5.740 1.664 1.00 . A A . 13 MET C 1 1 1 165 1 1 13 MET CA C 0.181 -6.013 3.119 1.00 . A A . 13 MET CA 1 1 1 166 1 1 13 MET CB C 1.200 -4.957 3.568 1.00 . A A . 13 MET CB 1 1 1 167 1 1 13 MET CE C 3.256 -5.997 7.085 1.00 . A A . 13 MET CE 1 1 1 168 1 1 13 MET CG C 1.652 -5.089 5.026 1.00 . A A . 13 MET CG 1 1 1 169 1 1 13 MET H H 1.728 -7.479 3.372 1.00 . A A . 13 MET H 1 1 1 170 1 1 13 MET HA H -0.712 -5.905 3.738 1.00 . A A . 13 MET HA 1 1 1 171 1 1 13 MET HB2 H 2.007 -5.034 2.983 1.00 . A A . 13 MET HB2 1 1 1 172 1 1 13 MET HB3 H 0.787 -4.054 3.450 1.00 . A A . 13 MET HB3 1 1 1 173 1 1 13 MET HE1 H 3.522 -4.957 7.270 1.00 . A A . 13 MET HE1 1 1 1 174 1 1 13 MET HE2 H 2.338 -6.240 7.621 1.00 . A A . 13 MET HE2 1 1 1 175 1 1 13 MET HE3 H 4.061 -6.643 7.437 1.00 . A A . 13 MET HE3 1 1 1 176 1 1 13 MET HG2 H 1.948 -4.187 5.341 1.00 . A A . 13 MET HG2 1 1 1 177 1 1 13 MET HG3 H 0.867 -5.390 5.567 1.00 . A A . 13 MET HG3 1 1 1 178 1 1 13 MET N N 0.726 -7.358 3.298 1.00 . A A . 13 MET N 1 1 1 179 1 1 13 MET O O 0.220 -6.430 0.738 1.00 . A A . 13 MET O 1 1 1 180 1 1 13 MET SD S 3.009 -6.256 5.309 1.00 . A A . 13 MET SD 1 1 1 181 1 1 14 CYS C C -0.760 -2.642 0.158 1.00 . A A . 14 CYS C 1 1 1 182 1 1 14 CYS CA C -1.283 -4.086 0.160 1.00 . A A . 14 CYS CA 1 1 1 183 1 1 14 CYS CB C -2.798 -4.153 -0.036 1.00 . A A . 14 CYS CB 1 1 1 184 1 1 14 CYS H H -1.295 -4.138 2.266 1.00 . A A . 14 CYS H 1 1 1 185 1 1 14 CYS HA H -0.791 -4.642 -0.638 1.00 . A A . 14 CYS HA 1 1 1 186 1 1 14 CYS HB2 H -3.214 -3.418 0.499 1.00 . A A . 14 CYS HB2 1 1 1 187 1 1 14 CYS HB3 H -2.993 -4.011 -1.006 1.00 . A A . 14 CYS HB3 1 1 1 188 1 1 14 CYS N N -0.975 -4.669 1.460 1.00 . A A . 14 CYS N 1 1 1 189 1 1 14 CYS O O -0.468 -2.114 1.232 1.00 . A A . 14 CYS O 1 1 1 190 1 1 14 CYS SG S -3.561 -5.726 0.471 1.00 . A A . 14 CYS SG 1 1 1 191 1 1 15 CYS C C -0.777 0.378 -1.722 1.00 . A A . 15 CYS C 1 1 1 192 1 1 15 CYS CA C 0.111 -0.748 -1.159 1.00 . A A . 15 CYS CA 1 1 1 193 1 1 15 CYS CB C 1.327 -0.992 -2.061 1.00 . A A . 15 CYS CB 1 1 1 194 1 1 15 CYS H H -1.000 -2.432 -1.847 1.00 . A A . 15 CYS H 1 1 1 195 1 1 15 CYS HA H 0.478 -0.427 -0.185 1.00 . A A . 15 CYS HA 1 1 1 196 1 1 15 CYS HB2 H 1.848 -1.757 -1.683 1.00 . A A . 15 CYS HB2 1 1 1 197 1 1 15 CYS HB3 H 0.996 -1.232 -2.974 1.00 . A A . 15 CYS HB3 1 1 1 198 1 1 15 CYS N N -0.610 -2.015 -1.015 1.00 . A A . 15 CYS N 1 1 1 199 1 1 15 CYS O O -1.693 0.129 -2.500 1.00 . A A . 15 CYS O 1 1 1 200 1 1 15 CYS SG S 2.438 0.428 -2.216 1.00 . A A . 15 CYS SG 1 1 1 201 1 1 16 SER C C -0.789 3.758 -2.612 1.00 . A A . 16 SER C 1 1 1 202 1 1 16 SER CA C -1.330 2.795 -1.559 1.00 . A A . 16 SER CA 1 1 1 203 1 1 16 SER CB C -1.474 3.563 -0.247 1.00 . A A . 16 SER CB 1 1 1 204 1 1 16 SER H H 0.295 1.748 -0.703 1.00 . A A . 16 SER H 1 1 1 205 1 1 16 SER HA H -2.320 2.462 -1.873 1.00 . A A . 16 SER HA 1 1 1 206 1 1 16 SER HB2 H -2.281 4.152 -0.297 1.00 . A A . 16 SER HB2 1 1 1 207 1 1 16 SER HB3 H -1.581 2.913 0.505 1.00 . A A . 16 SER HB3 1 1 1 208 1 1 16 SER HG H -0.518 4.830 0.820 1.00 . A A . 16 SER HG 1 1 1 209 1 1 16 SER N N -0.485 1.625 -1.338 1.00 . A A . 16 SER N 1 1 1 210 1 1 16 SER O O 0.273 3.571 -3.201 1.00 . A A . 16 SER O 1 1 1 211 1 1 16 SER OG O -0.325 4.364 -0.012 1.00 . A A . 16 SER OG 1 1 1 212 1 1 17 GLN C C -0.170 6.802 -3.576 1.00 . A A . 17 GLN C 1 1 1 213 1 1 17 GLN CA C -1.305 5.811 -3.883 1.00 . A A . 17 GLN CA 1 1 1 214 1 1 17 GLN CB C -2.634 6.529 -4.176 1.00 . A A . 17 GLN CB 1 1 1 215 1 1 17 GLN CD C -4.295 4.895 -3.103 1.00 . A A . 17 GLN CD 1 1 1 216 1 1 17 GLN CG C -3.841 5.586 -4.390 1.00 . A A . 17 GLN CG 1 1 1 217 1 1 17 GLN H H -2.301 5.022 -2.193 1.00 . A A . 17 GLN H 1 1 1 218 1 1 17 GLN HA H -1.012 5.253 -4.772 1.00 . A A . 17 GLN HA 1 1 1 219 1 1 17 GLN HB2 H -2.841 7.130 -3.404 1.00 . A A . 17 GLN HB2 1 1 1 220 1 1 17 GLN HB3 H -2.516 7.078 -5.004 1.00 . A A . 17 GLN HB3 1 1 1 221 1 1 17 GLN HE21 H -4.815 3.148 -4.014 1.00 . A A . 17 GLN HE21 1 1 1 222 1 1 17 GLN HE22 H -4.834 3.189 -2.246 1.00 . A A . 17 GLN HE22 1 1 1 223 1 1 17 GLN HG2 H -4.604 6.122 -4.750 1.00 . A A . 17 GLN HG2 1 1 1 224 1 1 17 GLN HG3 H -3.583 4.884 -5.054 1.00 . A A . 17 GLN HG3 1 1 1 225 1 1 17 GLN N N -1.509 4.863 -2.799 1.00 . A A . 17 GLN N 1 1 1 226 1 1 17 GLN NE2 N -4.737 3.655 -3.148 1.00 . A A . 17 GLN NE2 1 1 1 227 1 1 17 GLN O O 0.325 7.467 -4.478 1.00 . A A . 17 GLN O 1 1 1 228 1 1 17 GLN OE1 O -4.130 5.428 -2.011 1.00 . A A . 17 GLN OE1 1 1 1 229 1 1 18 . C C 2.687 6.356 -1.851 1.00 . A A . 18 PFF C 1 1 1 230 1 1 18 . CA C 1.600 7.445 -1.967 1.00 . A A . 18 PFF CA 1 1 1 231 1 1 18 . CB C 1.459 8.237 -0.652 1.00 . A A . 18 PFF CB 1 1 1 232 1 1 18 . CD1 C 0.248 10.140 -1.840 1.00 . A A . 18 PFF CD1 1 1 1 233 1 1 18 . CD2 C 1.664 10.652 0.072 1.00 . A A . 18 PFF CD2 1 1 1 234 1 1 18 . CE1 C 0.026 11.513 -2.041 1.00 . A A . 18 PFF CE1 1 1 1 235 1 1 18 . CE2 C 1.435 12.024 -0.127 1.00 . A A . 18 PFF CE2 1 1 1 236 1 1 18 . CG C 1.075 9.703 -0.788 1.00 . A A . 18 PFF CG 1 1 1 237 1 1 18 . CZ C 0.613 12.456 -1.180 1.00 . A A . 18 PFF CZ 1 1 1 238 1 1 18 . F F 0.402 13.784 -1.377 1.00 . A A . 18 PFF F 1 1 1 239 1 1 18 . H H -0.169 6.295 -1.622 1.00 . A A . 18 PFF H 1 1 1 240 1 1 18 . HA H 1.927 8.131 -2.750 1.00 . A A . 18 PFF HA 1 1 1 241 1 1 18 . HB2 H 0.745 7.741 0.006 1.00 . A A . 18 PFF HB2 1 1 1 242 1 1 18 . HB3 H 2.429 8.229 -0.157 1.00 . A A . 18 PFF HB3 1 1 1 243 1 1 18 . HD1 H -0.201 9.434 -2.521 1.00 . A A . 18 PFF HD1 1 1 1 244 1 1 18 . HD2 H 2.294 10.329 0.887 1.00 . A A . 18 PFF HD2 1 1 1 245 1 1 18 . HE1 H -0.589 11.840 -2.866 1.00 . A A . 18 PFF HE1 1 1 1 246 1 1 18 . HE2 H 1.890 12.748 0.535 1.00 . A A . 18 PFF HE2 1 1 1 247 1 1 18 . N N 0.303 6.850 -2.324 1.00 . A A . 18 PFF N 1 1 1 248 1 1 18 . O O 3.855 6.632 -1.559 1.00 . A A . 18 PFF O 1 1 1 249 1 1 19 GLY C C 3.449 3.830 -0.273 1.00 . A A . 19 GLY C 1 1 1 250 1 1 19 GLY CA C 3.192 3.971 -1.767 1.00 . A A . 19 GLY CA 1 1 1 251 1 1 19 GLY H H 1.405 4.868 -2.436 1.00 . A A . 19 GLY H 1 1 1 252 1 1 19 GLY HA2 H 2.717 3.064 -2.128 1.00 . A A . 19 GLY HA2 1 1 1 253 1 1 19 GLY HA3 H 4.140 4.088 -2.276 1.00 . A A . 19 GLY HA3 1 1 1 254 1 1 19 GLY N N 2.324 5.090 -2.065 1.00 . A A . 19 GLY N 1 1 1 255 1 1 19 GLY O O 4.598 3.732 0.152 1.00 . A A . 19 GLY O 1 1 1 256 1 1 20 . C C 1.623 1.955 1.907 1.00 . A A . 20 PFF C 1 1 1 257 1 1 20 . CA C 2.446 3.239 1.876 1.00 . A A . 20 PFF CA 1 1 1 258 1 1 20 . CB C 1.909 4.271 2.857 1.00 . A A . 20 PFF CB 1 1 1 259 1 1 20 . CD1 C 3.030 6.450 2.242 1.00 . A A . 20 PFF CD1 1 1 1 260 1 1 20 . CD2 C 3.756 5.284 4.250 1.00 . A A . 20 PFF CD2 1 1 1 261 1 1 20 . CE1 C 4.024 7.422 2.448 1.00 . A A . 20 PFF CE1 1 1 1 262 1 1 20 . CE2 C 4.754 6.251 4.454 1.00 . A A . 20 PFF CE2 1 1 1 263 1 1 20 . CG C 2.890 5.383 3.146 1.00 . A A . 20 PFF CG 1 1 1 264 1 1 20 . CZ C 4.886 7.322 3.554 1.00 . A A . 20 PFF CZ 1 1 1 265 1 1 20 . F F 5.837 8.272 3.763 1.00 . A A . 20 PFF F 1 1 1 266 1 1 20 . H H 1.466 3.907 0.136 1.00 . A A . 20 PFF H 1 1 1 267 1 1 20 . HA H 3.466 2.985 2.145 1.00 . A A . 20 PFF HA 1 1 1 268 1 1 20 . HB2 H 0.981 4.681 2.466 1.00 . A A . 20 PFF HB2 1 1 1 269 1 1 20 . HB3 H 1.686 3.761 3.785 1.00 . A A . 20 PFF HB3 1 1 1 270 1 1 20 . HD1 H 2.386 6.505 1.377 1.00 . A A . 20 PFF HD1 1 1 1 271 1 1 20 . HD2 H 3.645 4.476 4.959 1.00 . A A . 20 PFF HD2 1 1 1 272 1 1 20 . HE1 H 4.134 8.241 1.752 1.00 . A A . 20 PFF HE1 1 1 1 273 1 1 20 . HE2 H 5.418 6.171 5.301 1.00 . A A . 20 PFF HE2 1 1 1 274 1 1 20 . N N 2.394 3.796 0.532 1.00 . A A . 20 PFF N 1 1 1 275 1 1 20 . O O 0.847 1.716 0.986 1.00 . A A . 20 PFF O 1 1 1 276 1 1 21 CYS C C 0.390 -0.563 4.167 1.00 . A A . 21 CYS C 1 1 1 277 1 1 21 CYS CA C 1.147 -0.203 2.894 1.00 . A A . 21 CYS CA 1 1 1 278 1 1 21 CYS CB C 2.207 -1.247 2.544 1.00 . A A . 21 CYS CB 1 1 1 279 1 1 21 CYS H H 2.433 1.329 3.665 1.00 . A A . 21 CYS H 1 1 1 280 1 1 21 CYS HA H 0.408 -0.210 2.101 1.00 . A A . 21 CYS HA 1 1 1 281 1 1 21 CYS HB2 H 1.746 -2.128 2.437 1.00 . A A . 21 CYS HB2 1 1 1 282 1 1 21 CYS HB3 H 2.624 -0.981 1.675 1.00 . A A . 21 CYS HB3 1 1 1 283 1 1 21 CYS N N 1.770 1.111 2.925 1.00 . A A . 21 CYS N 1 1 1 284 1 1 21 CYS O O 0.655 -0.048 5.250 1.00 . A A . 21 CYS O 1 1 1 285 1 1 21 CYS SG S 3.535 -1.461 3.753 1.00 . A A . 21 CYS SG 1 1 1 286 1 1 22 GLY C C -2.530 -2.816 4.540 1.00 . A A . 22 GLY C 1 1 1 287 1 1 22 GLY CA C -1.447 -1.897 5.091 1.00 . A A . 22 GLY CA 1 1 1 288 1 1 22 GLY H H -0.780 -1.806 3.072 1.00 . A A . 22 GLY H 1 1 1 289 1 1 22 GLY HA2 H -0.870 -2.430 5.845 1.00 . A A . 22 GLY HA2 1 1 1 290 1 1 22 GLY HA3 H -1.911 -1.019 5.544 1.00 . A A . 22 GLY HA3 1 1 1 291 1 1 22 GLY N N -0.569 -1.474 4.014 1.00 . A A . 22 GLY N 1 1 1 292 1 1 22 GLY O O -2.417 -3.303 3.414 1.00 . A A . 22 GLY O 1 1 1 293 1 1 23 LYS C C -6.063 -3.107 5.154 1.00 . A A . 23 LYS C 1 1 1 294 1 1 23 LYS CA C -4.744 -3.844 4.899 1.00 . A A . 23 LYS CA 1 1 1 295 1 1 23 LYS CB C -4.665 -5.245 5.529 1.00 . A A . 23 LYS CB 1 1 1 296 1 1 23 LYS CD C -4.723 -7.715 5.005 1.00 . A A . 23 LYS CD 1 1 1 297 1 1 23 LYS CE C -4.927 -8.780 3.921 1.00 . A A . 23 LYS CE 1 1 1 298 1 1 23 LYS CG C -5.022 -6.306 4.479 1.00 . A A . 23 LYS CG 1 1 1 299 1 1 23 LYS H H -3.570 -2.670 6.261 1.00 . A A . 23 LYS H 1 1 1 300 1 1 23 LYS HA H -4.691 -3.962 3.817 1.00 . A A . 23 LYS HA 1 1 1 301 1 1 23 LYS HB2 H -3.736 -5.407 5.863 1.00 . A A . 23 LYS HB2 1 1 1 302 1 1 23 LYS HB3 H -5.309 -5.303 6.292 1.00 . A A . 23 LYS HB3 1 1 1 303 1 1 23 LYS HD2 H -3.774 -7.749 5.318 1.00 . A A . 23 LYS HD2 1 1 1 304 1 1 23 LYS HD3 H -5.335 -7.911 5.771 1.00 . A A . 23 LYS HD3 1 1 1 305 1 1 23 LYS HE2 H -4.809 -9.685 4.330 1.00 . A A . 23 LYS HE2 1 1 1 306 1 1 23 LYS HE3 H -5.855 -8.697 3.557 1.00 . A A . 23 LYS HE3 1 1 1 307 1 1 23 LYS HG2 H -5.996 -6.237 4.261 1.00 . A A . 23 LYS HG2 1 1 1 308 1 1 23 LYS HG3 H -4.483 -6.144 3.653 1.00 . A A . 23 LYS HG3 1 1 1 309 1 1 23 LYS HZ1 H -3.005 -8.617 3.164 1.00 . A A . 23 LYS HZ1 1 1 1 310 1 1 23 LYS HZ2 H -4.043 -9.391 2.149 1.00 . A A . 23 LYS HZ2 1 1 1 311 1 1 23 LYS HZ3 H -4.109 -7.757 2.318 1.00 . A A . 23 LYS HZ3 1 1 1 312 1 1 23 LYS N N -3.583 -3.052 5.324 1.00 . A A . 23 LYS N 1 1 1 313 1 1 23 LYS NZ N -3.959 -8.628 2.807 1.00 . A A . 23 LYS NZ 1 1 1 314 1 1 23 LYS O O -7.086 -3.713 5.466 1.00 . A A . 23 LYS O 1 1 1 315 1 1 24 GLY C C -7.484 -0.204 3.811 1.00 . A A . 24 GLY C 1 1 1 316 1 1 24 GLY CA C -7.150 -0.874 5.152 1.00 . A A . 24 GLY CA 1 1 1 317 1 1 24 GLY H H -5.132 -1.392 4.728 1.00 . A A . 24 GLY H 1 1 1 318 1 1 24 GLY HA2 H -8.022 -1.428 5.497 1.00 . A A . 24 GLY HA2 1 1 1 319 1 1 24 GLY HA3 H -6.922 -0.098 5.884 1.00 . A A . 24 GLY HA3 1 1 1 320 1 1 24 GLY N N -6.007 -1.776 5.044 1.00 . A A . 24 GLY N 1 1 1 321 1 1 24 GLY O O -6.719 -0.322 2.848 1.00 . A A . 24 GLY O 1 1 1 322 1 1 25 PRO C C -8.294 1.475 1.434 1.00 . A A . 25 PRO C 1 1 1 323 1 1 25 PRO CA C -9.248 1.054 2.553 1.00 . A A . 25 PRO CA 1 1 1 324 1 1 25 PRO CB C -10.164 2.173 3.052 1.00 . A A . 25 PRO CB 1 1 1 325 1 1 25 PRO CD C -9.434 0.849 4.915 1.00 . A A . 25 PRO CD 1 1 1 326 1 1 25 PRO CG C -10.662 1.583 4.371 1.00 . A A . 25 PRO CG 1 1 1 327 1 1 25 PRO HA H -9.887 0.272 2.146 1.00 . A A . 25 PRO HA 1 1 1 328 1 1 25 PRO HB2 H -9.658 3.023 3.199 1.00 . A A . 25 PRO HB2 1 1 1 329 1 1 25 PRO HB3 H -10.918 2.339 2.417 1.00 . A A . 25 PRO HB3 1 1 1 330 1 1 25 PRO HD2 H -8.925 1.440 5.541 1.00 . A A . 25 PRO HD2 1 1 1 331 1 1 25 PRO HD3 H -9.711 0.016 5.394 1.00 . A A . 25 PRO HD3 1 1 1 332 1 1 25 PRO HG2 H -10.955 2.305 4.998 1.00 . A A . 25 PRO HG2 1 1 1 333 1 1 25 PRO HG3 H -11.419 0.948 4.216 1.00 . A A . 25 PRO HG3 1 1 1 334 1 1 25 PRO N N -8.618 0.518 3.756 1.00 . A A . 25 PRO N 1 1 1 335 1 1 25 PRO O O -8.193 0.775 0.430 1.00 . A A . 25 PRO O 1 1 1 336 1 1 26 LYS C C -5.403 2.225 0.337 1.00 . A A . 26 LYS C 1 1 1 337 1 1 26 LYS CA C -6.676 3.060 0.520 1.00 . A A . 26 LYS CA 1 1 1 338 1 1 26 LYS CB C -6.336 4.534 0.759 1.00 . A A . 26 LYS CB 1 1 1 339 1 1 26 LYS CD C -7.118 6.865 0.215 1.00 . A A . 26 LYS CD 1 1 1 340 1 1 26 LYS CE C -6.886 6.908 -1.300 1.00 . A A . 26 LYS CE 1 1 1 341 1 1 26 LYS CG C -7.557 5.454 0.626 1.00 . A A . 26 LYS CG 1 1 1 342 1 1 26 LYS H H -7.649 3.137 2.420 1.00 . A A . 26 LYS H 1 1 1 343 1 1 26 LYS HA H -7.207 2.989 -0.430 1.00 . A A . 26 LYS HA 1 1 1 344 1 1 26 LYS HB2 H -5.962 4.630 1.682 1.00 . A A . 26 LYS HB2 1 1 1 345 1 1 26 LYS HB3 H -5.649 4.816 0.089 1.00 . A A . 26 LYS HB3 1 1 1 346 1 1 26 LYS HD2 H -7.832 7.521 0.461 1.00 . A A . 26 LYS HD2 1 1 1 347 1 1 26 LYS HD3 H -6.270 7.101 0.689 1.00 . A A . 26 LYS HD3 1 1 1 348 1 1 26 LYS HE2 H -6.340 6.113 -1.565 1.00 . A A . 26 LYS HE2 1 1 1 349 1 1 26 LYS HE3 H -7.772 6.873 -1.762 1.00 . A A . 26 LYS HE3 1 1 1 350 1 1 26 LYS HG2 H -8.174 5.085 -0.069 1.00 . A A . 26 LYS HG2 1 1 1 351 1 1 26 LYS HG3 H -8.033 5.499 1.504 1.00 . A A . 26 LYS HG3 1 1 1 352 1 1 26 LYS HZ1 H -6.350 8.339 -2.707 1.00 . A A . 26 LYS HZ1 1 1 1 353 1 1 26 LYS HZ2 H -6.500 8.966 -1.234 1.00 . A A . 26 LYS HZ2 1 1 1 354 1 1 26 LYS HZ3 H -5.178 8.077 -1.548 1.00 . A A . 26 LYS HZ3 1 1 1 355 1 1 26 LYS N N -7.560 2.581 1.583 1.00 . A A . 26 LYS N 1 1 1 356 1 1 26 LYS NZ N -6.177 8.134 -1.723 1.00 . A A . 26 LYS NZ 1 1 1 357 1 1 26 LYS O O -4.677 2.470 -0.625 1.00 . A A . 26 LYS O 1 1 1 358 1 1 27 TYR C C -4.410 -0.898 0.203 1.00 . A A . 27 TYR C 1 1 1 359 1 1 27 TYR CA C -4.014 0.321 1.029 1.00 . A A . 27 TYR CA 1 1 1 360 1 1 27 TYR CB C -3.480 -0.157 2.383 1.00 . A A . 27 TYR CB 1 1 1 361 1 1 27 TYR CD1 C -1.819 1.618 3.071 1.00 . A A . 27 TYR CD1 1 1 1 362 1 1 27 TYR CD2 C -3.769 1.259 4.476 1.00 . A A . 27 TYR CD2 1 1 1 363 1 1 27 TYR CE1 C -1.343 2.585 3.976 1.00 . A A . 27 TYR CE1 1 1 1 364 1 1 27 TYR CE2 C -3.282 2.218 5.386 1.00 . A A . 27 TYR CE2 1 1 1 365 1 1 27 TYR CG C -3.022 0.939 3.326 1.00 . A A . 27 TYR CG 1 1 1 366 1 1 27 TYR CZ C -2.070 2.882 5.139 1.00 . A A . 27 TYR CZ 1 1 1 367 1 1 27 TYR H H -5.814 1.019 1.923 1.00 . A A . 27 TYR H 1 1 1 368 1 1 27 TYR HA H -3.204 0.830 0.501 1.00 . A A . 27 TYR HA 1 1 1 369 1 1 27 TYR HB2 H -4.208 -0.671 2.838 1.00 . A A . 27 TYR HB2 1 1 1 370 1 1 27 TYR HB3 H -2.702 -0.761 2.212 1.00 . A A . 27 TYR HB3 1 1 1 371 1 1 27 TYR HD1 H -1.261 1.388 2.176 1.00 . A A . 27 TYR HD1 1 1 1 372 1 1 27 TYR HD2 H -4.723 0.789 4.653 1.00 . A A . 27 TYR HD2 1 1 1 373 1 1 27 TYR HE1 H -0.436 3.123 3.770 1.00 . A A . 27 TYR HE1 1 1 1 374 1 1 27 TYR HE2 H -3.840 2.477 6.273 1.00 . A A . 27 TYR HE2 1 1 1 375 1 1 27 TYR HH H -0.861 4.351 5.734 1.00 . A A . 27 TYR HH 1 1 1 376 1 1 27 TYR N N -5.139 1.237 1.199 1.00 . A A . 27 TYR N 1 1 1 377 1 1 27 TYR O O -3.655 -1.300 -0.675 1.00 . A A . 27 TYR O 1 1 1 378 1 1 27 TYR OH O -1.691 3.902 5.960 1.00 . A A . 27 TYR OH 1 1 1 379 1 1 28 CYS C C -7.302 -2.682 -0.917 1.00 . A A . 28 CYS C 1 1 1 380 1 1 28 CYS CA C -5.936 -2.746 -0.214 1.00 . A A . 28 CYS CA 1 1 1 381 1 1 28 CYS CB C -5.900 -3.873 0.812 1.00 . A A . 28 CYS CB 1 1 1 382 1 1 28 CYS H H -6.076 -1.286 1.338 1.00 . A A . 28 CYS H 1 1 1 383 1 1 28 CYS HA H -5.204 -2.974 -0.989 1.00 . A A . 28 CYS HA 1 1 1 384 1 1 28 CYS HB2 H -5.192 -3.667 1.487 1.00 . A A . 28 CYS HB2 1 1 1 385 1 1 28 CYS HB3 H -6.790 -3.920 1.265 1.00 . A A . 28 CYS HB3 1 1 1 386 1 1 28 CYS N N -5.561 -1.522 0.488 1.00 . A A . 28 CYS N 1 1 1 387 1 1 28 CYS O O -7.787 -3.699 -1.411 1.00 . A A . 28 CYS O 1 1 1 388 1 1 28 CYS SG S -5.542 -5.485 0.072 1.00 . A A . 28 CYS SG 1 1 1 389 1 1 29 GLY C C -10.348 -1.831 -0.205 1.00 . A A . 29 GLY C 1 1 1 390 1 1 29 GLY CA C -9.377 -1.406 -1.315 1.00 . A A . 29 GLY CA 1 1 1 391 1 1 29 GLY H H -7.560 -0.699 -0.490 1.00 . A A . 29 GLY H 1 1 1 392 1 1 29 GLY HA2 H -9.587 -0.367 -1.569 1.00 . A A . 29 GLY HA2 1 1 1 393 1 1 29 GLY HA3 H -9.564 -2.017 -2.197 1.00 . A A . 29 GLY HA3 1 1 1 394 1 1 29 GLY N N -7.974 -1.525 -0.914 1.00 . A A . 29 GLY N 1 1 1 395 1 1 29 GLY O O -11.542 -1.977 -0.461 1.00 . A A . 29 GLY O 1 1 1 396 1 1 30 ARG C C -9.343 -2.979 3.197 1.00 . A A . 30 ARG C 1 1 1 397 1 1 30 ARG CA C -10.457 -2.597 2.226 1.00 . A A . 30 ARG CA 1 1 1 398 1 1 30 ARG CB C -11.459 -3.753 2.004 1.00 . A A . 30 ARG CB 1 1 1 399 1 1 30 ARG CD C -10.145 -5.093 0.206 1.00 . A A . 30 ARG CD 1 1 1 400 1 1 30 ARG CG C -10.866 -5.104 1.558 1.00 . A A . 30 ARG CG 1 1 1 401 1 1 30 ARG CZ C -10.814 -4.764 -2.173 1.00 . A A . 30 ARG CZ 1 1 1 402 1 1 30 ARG H H -8.819 -1.980 1.088 1.00 . A A . 30 ARG H 1 1 1 403 1 1 30 ARG HA H -10.982 -1.753 2.666 1.00 . A A . 30 ARG HA 1 1 1 404 1 1 30 ARG HB2 H -11.944 -3.904 2.866 1.00 . A A . 30 ARG HB2 1 1 1 405 1 1 30 ARG HB3 H -12.109 -3.461 1.302 1.00 . A A . 30 ARG HB3 1 1 1 406 1 1 30 ARG HD2 H -9.338 -4.506 0.275 1.00 . A A . 30 ARG HD2 1 1 1 407 1 1 30 ARG HD3 H -9.861 -6.026 -0.016 1.00 . A A . 30 ARG HD3 1 1 1 408 1 1 30 ARG HE H -11.687 -3.875 -0.634 1.00 . A A . 30 ARG HE 1 1 1 409 1 1 30 ARG HG2 H -10.211 -5.398 2.254 1.00 . A A . 30 ARG HG2 1 1 1 410 1 1 30 ARG HG3 H -11.614 -5.766 1.503 1.00 . A A . 30 ARG HG3 1 1 1 411 1 1 30 ARG HH11 H -8.908 -5.372 -2.011 1.00 . A A . 30 ARG HH11 1 1 1 412 1 1 30 ARG HH12 H -9.537 -5.306 -3.623 1.00 . A A . 30 ARG HH12 1 1 1 413 1 1 30 ARG HH21 H -12.644 -4.124 -2.694 1.00 . A A . 30 ARG HH21 1 1 1 414 1 1 30 ARG HH22 H -11.622 -4.609 -4.005 1.00 . A A . 30 ARG HH22 1 1 1 415 1 1 30 ARG N N -9.818 -2.120 0.992 1.00 . A A . 30 ARG N 1 1 1 416 1 1 30 ARG NE N -11.007 -4.589 -0.876 1.00 . A A . 30 ARG NE 1 1 1 417 1 1 30 ARG NH1 N -9.662 -5.180 -2.639 1.00 . A A . 30 ARG NH1 1 1 1 418 1 1 30 ARG NH2 N -11.769 -4.476 -3.025 1.00 . A A . 30 ARG NH2 1 1 1 419 1 1 30 ARG O O -8.179 -2.845 2.841 1.00 . A A . 30 ARG O 1 1 1 420 1 1 31 NH2 HN1 H -10.615 -3.534 4.695 1.00 . A A . 31 NH2 HN1 1 1 1 421 1 1 31 NH2 HN2 H -8.880 -3.671 5.009 1.00 . A A . 31 NH2 HN2 1 1 1 422 1 1 31 NH2 N N -9.657 -3.427 4.402 1.00 . A A . 31 NH2 N 1 1 1 423 2 2 1 NAG C1 C -6.607 13.349 -3.222 1.00 . B A . 32 NAG C1 1 1 1 424 2 2 1 NAG C2 C -6.636 11.917 -2.705 1.00 . B A . 32 NAG C2 1 1 1 425 2 2 1 NAG C3 C -6.027 11.910 -1.295 1.00 . B A . 32 NAG C3 1 1 1 426 2 2 1 NAG C4 C -4.607 12.489 -1.330 1.00 . B A . 32 NAG C4 1 1 1 427 2 2 1 NAG C5 C -4.704 13.902 -1.916 1.00 . B A . 32 NAG C5 1 1 1 428 2 2 1 NAG C6 C -3.319 14.574 -1.980 1.00 . B A . 32 NAG C6 1 1 1 429 2 2 1 NAG C7 C -8.330 10.195 -3.256 1.00 . B A . 32 NAG C7 1 1 1 430 2 2 1 NAG C8 C -9.794 9.901 -3.357 1.00 . B A . 32 NAG C8 1 1 1 431 2 2 1 NAG H1 H -7.275 13.992 -2.646 1.00 . B A . 32 NAG H1 1 1 1 432 2 2 1 NAG H2 H -5.974 11.343 -3.359 1.00 . B A . 32 NAG H2 1 1 1 433 2 2 1 NAG H3 H -6.648 12.499 -0.618 1.00 . B A . 32 NAG H3 1 1 1 434 2 2 1 NAG H4 H -3.988 11.871 -1.983 1.00 . B A . 32 NAG H4 1 1 1 435 2 2 1 NAG H5 H -5.339 14.517 -1.276 1.00 . B A . 32 NAG H5 1 1 1 436 2 2 1 NAG H61 H -2.998 14.840 -0.972 1.00 . B A . 32 NAG H61 1 1 1 437 2 2 1 NAG H62 H -3.388 15.488 -2.571 1.00 . B A . 32 NAG H62 1 1 1 438 2 2 1 NAG H81 H -9.901 8.913 -3.799 1.00 . B A . 32 NAG H81 1 1 1 439 2 2 1 NAG H82 H -10.239 9.918 -2.365 1.00 . B A . 32 NAG H82 1 1 1 440 2 2 1 NAG H83 H -10.258 10.642 -4.005 1.00 . B A . 32 NAG H83 1 1 1 441 2 2 1 NAG HN2 H -8.788 11.966 -2.501 1.00 . B A . 32 NAG HN2 1 1 1 442 2 2 1 NAG HO1 H -6.255 13.866 -4.974 1.00 . B A . 32 NAG HO1 1 1 1 443 2 2 1 NAG HO3 H -5.209 10.609 -0.167 1.00 . B A . 32 NAG HO3 1 1 1 444 2 2 1 NAG HO4 H 2.619 8.361 6.946 1.00 . B A . 32 NAG HO4 1 1 1 445 2 2 1 NAG HO6 H -1.513 14.225 -2.632 1.00 . B A . 32 NAG HO6 1 1 1 446 2 2 1 NAG N2 N -8.010 11.373 -2.739 1.00 . B A . 32 NAG N2 1 1 1 447 2 2 1 NAG O1 O -6.959 13.373 -4.545 1.00 . B A . 32 NAG O1 1 1 1 448 2 2 1 NAG O3 O -5.946 10.588 -0.805 1.00 . B A . 32 NAG O3 1 1 1 449 2 2 1 NAG O4 O -4.054 12.537 0.011 1.00 . B A . 32 NAG O4 1 1 1 450 2 2 1 NAG O5 O -5.284 13.850 -3.210 1.00 . B A . 32 NAG O5 1 1 1 451 2 2 1 NAG O6 O -2.331 13.727 -2.540 1.00 . B A . 32 NAG O6 1 1 1 452 2 2 1 NAG O7 O -7.502 9.359 -3.600 1.00 . B A . 32 NAG O7 1 1 2 453 1 1 1 VAL C C 6.769 4.437 7.031 1.00 . A A . 1 VAL C 1 1 2 454 1 1 1 VAL CA C 8.108 5.070 7.365 1.00 . A A . 1 VAL CA 1 1 2 455 1 1 1 VAL CB C 8.241 5.257 8.881 1.00 . A A . 1 VAL CB 1 1 2 456 1 1 1 VAL CG1 C 8.196 3.903 9.595 1.00 . A A . 1 VAL CG1 1 1 2 457 1 1 1 VAL CG2 C 9.575 5.928 9.223 1.00 . A A . 1 VAL CG2 1 1 2 458 1 1 1 VAL H1 H 9.089 6.818 6.880 1.00 . A A . 1 VAL H1 1 1 2 459 1 1 1 VAL H2 H 7.431 6.930 6.804 1.00 . A A . 1 VAL H2 1 1 2 460 1 1 1 VAL H3 H 8.300 6.151 5.633 1.00 . A A . 1 VAL H3 1 1 2 461 1 1 1 VAL HA H 8.898 4.397 7.030 1.00 . A A . 1 VAL HA 1 1 2 462 1 1 1 VAL HB H 7.430 5.885 9.253 1.00 . A A . 1 VAL HB 1 1 2 463 1 1 1 VAL HG11 H 8.977 3.248 9.208 1.00 . A A . 1 VAL HG11 1 1 2 464 1 1 1 VAL HG12 H 8.353 4.046 10.665 1.00 . A A . 1 VAL HG12 1 1 2 465 1 1 1 VAL HG13 H 7.226 3.424 9.462 1.00 . A A . 1 VAL HG13 1 1 2 466 1 1 1 VAL HG21 H 9.600 6.960 8.875 1.00 . A A . 1 VAL HG21 1 1 2 467 1 1 1 VAL HG22 H 9.704 5.943 10.306 1.00 . A A . 1 VAL HG22 1 1 2 468 1 1 1 VAL HG23 H 10.401 5.370 8.781 1.00 . A A . 1 VAL HG23 1 1 2 469 1 1 1 VAL N N 8.235 6.345 6.631 1.00 . A A . 1 VAL N 1 1 2 470 1 1 1 VAL O O 5.746 5.084 7.219 1.00 . A A . 1 VAL O 1 1 2 471 1 1 2 GLY C C 5.430 2.642 4.480 1.00 . A A . 2 GLY C 1 1 2 472 1 1 2 GLY CA C 5.596 2.518 6.000 1.00 . A A . 2 GLY CA 1 1 2 473 1 1 2 GLY H H 7.707 2.920 6.170 1.00 . A A . 2 GLY H 1 1 2 474 1 1 2 GLY HA2 H 5.671 1.459 6.246 1.00 . A A . 2 GLY HA2 1 1 2 475 1 1 2 GLY HA3 H 4.700 2.917 6.476 1.00 . A A . 2 GLY HA3 1 1 2 476 1 1 2 GLY N N 6.786 3.214 6.502 1.00 . A A . 2 GLY N 1 1 2 477 1 1 2 GLY O O 4.356 2.375 3.948 1.00 . A A . 2 GLY O 1 1 2 478 1 1 3 GLU C C 6.685 1.958 1.613 1.00 . A A . 3 GLU C 1 1 2 479 1 1 3 GLU CA C 6.503 3.294 2.343 1.00 . A A . 3 GLU CA 1 1 2 480 1 1 3 GLU CB C 7.586 4.321 1.960 1.00 . A A . 3 GLU CB 1 1 2 481 1 1 3 GLU CD C 9.038 4.567 4.036 1.00 . A A . 3 GLU CD 1 1 2 482 1 1 3 GLU CG C 8.980 4.103 2.576 1.00 . A A . 3 GLU CG 1 1 2 483 1 1 3 GLU H H 7.350 3.190 4.284 1.00 . A A . 3 GLU H 1 1 2 484 1 1 3 GLU HA H 5.552 3.712 2.031 1.00 . A A . 3 GLU HA 1 1 2 485 1 1 3 GLU HB2 H 7.686 4.302 0.965 1.00 . A A . 3 GLU HB2 1 1 2 486 1 1 3 GLU HB3 H 7.264 5.224 2.246 1.00 . A A . 3 GLU HB3 1 1 2 487 1 1 3 GLU HG2 H 9.202 3.129 2.537 1.00 . A A . 3 GLU HG2 1 1 2 488 1 1 3 GLU HG3 H 9.652 4.620 2.046 1.00 . A A . 3 GLU HG3 1 1 2 489 1 1 3 GLU N N 6.471 3.099 3.786 1.00 . A A . 3 GLU N 1 1 2 490 1 1 3 GLU O O 7.316 1.035 2.125 1.00 . A A . 3 GLU O 1 1 2 491 1 1 3 GLU OE1 O 9.172 5.786 4.284 1.00 . A A . 3 GLU OE1 1 1 2 492 1 1 3 GLU OE2 O 8.803 3.730 4.942 1.00 . A A . 3 GLU OE2 1 1 2 493 1 1 4 CYS C C 7.466 0.304 -1.000 1.00 . A A . 4 CYS C 1 1 2 494 1 1 4 CYS CA C 6.137 0.545 -0.277 1.00 . A A . 4 CYS CA 1 1 2 495 1 1 4 CYS CB C 4.998 0.445 -1.295 1.00 . A A . 4 CYS CB 1 1 2 496 1 1 4 CYS H H 5.620 2.615 0.014 1.00 . A A . 4 CYS H 1 1 2 497 1 1 4 CYS HA H 5.992 -0.241 0.467 1.00 . A A . 4 CYS HA 1 1 2 498 1 1 4 CYS HB2 H 5.289 0.927 -2.122 1.00 . A A . 4 CYS HB2 1 1 2 499 1 1 4 CYS HB3 H 4.863 -0.524 -1.503 1.00 . A A . 4 CYS HB3 1 1 2 500 1 1 4 CYS N N 6.126 1.829 0.409 1.00 . A A . 4 CYS N 1 1 2 501 1 1 4 CYS O O 8.002 1.165 -1.698 1.00 . A A . 4 CYS O 1 1 2 502 1 1 4 CYS SG S 3.395 1.126 -0.800 1.00 . A A . 4 CYS SG 1 1 2 503 1 1 5 VAL C C 8.542 -1.540 -3.224 1.00 . A A . 5 VAL C 1 1 2 504 1 1 5 VAL CA C 9.016 -1.457 -1.778 1.00 . A A . 5 VAL CA 1 1 2 505 1 1 5 VAL CB C 9.487 -2.819 -1.242 1.00 . A A . 5 VAL CB 1 1 2 506 1 1 5 VAL CG1 C 10.711 -3.321 -2.015 1.00 . A A . 5 VAL CG1 1 1 2 507 1 1 5 VAL CG2 C 9.881 -2.708 0.234 1.00 . A A . 5 VAL CG2 1 1 2 508 1 1 5 VAL H H 7.295 -1.608 -0.524 1.00 . A A . 5 VAL H 1 1 2 509 1 1 5 VAL HA H 9.851 -0.758 -1.721 1.00 . A A . 5 VAL HA 1 1 2 510 1 1 5 VAL HB H 8.681 -3.550 -1.321 1.00 . A A . 5 VAL HB 1 1 2 511 1 1 5 VAL HG11 H 11.519 -2.592 -1.948 1.00 . A A . 5 VAL HG11 1 1 2 512 1 1 5 VAL HG12 H 11.048 -4.266 -1.589 1.00 . A A . 5 VAL HG12 1 1 2 513 1 1 5 VAL HG13 H 10.463 -3.489 -3.062 1.00 . A A . 5 VAL HG13 1 1 2 514 1 1 5 VAL HG21 H 10.656 -1.951 0.357 1.00 . A A . 5 VAL HG21 1 1 2 515 1 1 5 VAL HG22 H 9.018 -2.436 0.842 1.00 . A A . 5 VAL HG22 1 1 2 516 1 1 5 VAL HG23 H 10.260 -3.667 0.587 1.00 . A A . 5 VAL HG23 1 1 2 517 1 1 5 VAL N N 7.906 -0.947 -0.982 1.00 . A A . 5 VAL N 1 1 2 518 1 1 5 VAL O O 8.098 -2.587 -3.690 1.00 . A A . 5 VAL O 1 1 2 519 1 1 6 ARG C C 6.725 -0.847 -5.579 1.00 . A A . 6 ARG C 1 1 2 520 1 1 6 ARG CA C 8.098 -0.224 -5.294 1.00 . A A . 6 ARG CA 1 1 2 521 1 1 6 ARG CB C 9.247 -0.711 -6.199 1.00 . A A . 6 ARG CB 1 1 2 522 1 1 6 ARG CD C 9.323 -0.561 -8.749 1.00 . A A . 6 ARG CD 1 1 2 523 1 1 6 ARG CG C 9.452 0.196 -7.423 1.00 . A A . 6 ARG CG 1 1 2 524 1 1 6 ARG CZ C 7.036 -0.964 -9.705 1.00 . A A . 6 ARG CZ 1 1 2 525 1 1 6 ARG H H 8.695 0.456 -3.359 1.00 . A A . 6 ARG H 1 1 2 526 1 1 6 ARG HA H 7.949 0.844 -5.429 1.00 . A A . 6 ARG HA 1 1 2 527 1 1 6 ARG HB2 H 10.092 -0.726 -5.665 1.00 . A A . 6 ARG HB2 1 1 2 528 1 1 6 ARG HB3 H 9.036 -1.636 -6.516 1.00 . A A . 6 ARG HB3 1 1 2 529 1 1 6 ARG HD2 H 9.439 0.077 -9.510 1.00 . A A . 6 ARG HD2 1 1 2 530 1 1 6 ARG HD3 H 10.026 -1.271 -8.798 1.00 . A A . 6 ARG HD3 1 1 2 531 1 1 6 ARG HE H 7.650 -1.582 -7.965 1.00 . A A . 6 ARG HE 1 1 2 532 1 1 6 ARG HG2 H 8.765 0.922 -7.401 1.00 . A A . 6 ARG HG2 1 1 2 533 1 1 6 ARG HG3 H 10.366 0.599 -7.373 1.00 . A A . 6 ARG HG3 1 1 2 534 1 1 6 ARG HH11 H 8.221 -0.364 -11.212 1.00 . A A . 6 ARG HH11 1 1 2 535 1 1 6 ARG HH12 H 6.525 -0.385 -11.559 1.00 . A A . 6 ARG HH12 1 1 2 536 1 1 6 ARG HH21 H 5.614 -1.489 -8.391 1.00 . A A . 6 ARG HH21 1 1 2 537 1 1 6 ARG HH22 H 5.047 -1.022 -9.960 1.00 . A A . 6 ARG HH22 1 1 2 538 1 1 6 ARG N N 8.510 -0.385 -3.899 1.00 . A A . 6 ARG N 1 1 2 539 1 1 6 ARG NE N 7.996 -1.180 -8.827 1.00 . A A . 6 ARG NE 1 1 2 540 1 1 6 ARG NH1 N 7.280 -0.537 -10.922 1.00 . A A . 6 ARG NH1 1 1 2 541 1 1 6 ARG NH2 N 5.802 -1.175 -9.322 1.00 . A A . 6 ARG NH2 1 1 2 542 1 1 6 ARG O O 6.434 -1.343 -6.669 1.00 . A A . 6 ARG O 1 1 2 543 1 1 7 GLY C C 4.324 -2.573 -3.649 1.00 . A A . 7 GLY C 1 1 2 544 1 1 7 GLY CA C 4.520 -1.344 -4.546 1.00 . A A . 7 GLY CA 1 1 2 545 1 1 7 GLY H H 6.246 -0.281 -3.767 1.00 . A A . 7 GLY H 1 1 2 546 1 1 7 GLY HA2 H 3.835 -0.568 -4.207 1.00 . A A . 7 GLY HA2 1 1 2 547 1 1 7 GLY HA3 H 4.227 -1.620 -5.559 1.00 . A A . 7 GLY HA3 1 1 2 548 1 1 7 GLY N N 5.879 -0.800 -4.554 1.00 . A A . 7 GLY N 1 1 2 549 1 1 7 GLY O O 3.196 -3.067 -3.536 1.00 . A A . 7 GLY O 1 1 2 550 1 1 8 ARG C C 5.649 -3.834 -0.653 1.00 . A A . 8 ARG C 1 1 2 551 1 1 8 ARG CA C 5.290 -4.225 -2.083 1.00 . A A . 8 ARG CA 1 1 2 552 1 1 8 ARG CB C 6.144 -5.373 -2.640 1.00 . A A . 8 ARG CB 1 1 2 553 1 1 8 ARG CD C 4.304 -6.737 -3.852 1.00 . A A . 8 ARG CD 1 1 2 554 1 1 8 ARG CG C 5.628 -5.960 -3.969 1.00 . A A . 8 ARG CG 1 1 2 555 1 1 8 ARG CZ C 2.282 -5.941 -2.621 1.00 . A A . 8 ARG CZ 1 1 2 556 1 1 8 ARG H H 6.318 -2.755 -3.188 1.00 . A A . 8 ARG H 1 1 2 557 1 1 8 ARG HA H 4.267 -4.548 -1.987 1.00 . A A . 8 ARG HA 1 1 2 558 1 1 8 ARG HB2 H 7.071 -5.030 -2.788 1.00 . A A . 8 ARG HB2 1 1 2 559 1 1 8 ARG HB3 H 6.164 -6.106 -1.961 1.00 . A A . 8 ARG HB3 1 1 2 560 1 1 8 ARG HD2 H 4.145 -7.235 -4.704 1.00 . A A . 8 ARG HD2 1 1 2 561 1 1 8 ARG HD3 H 4.376 -7.386 -3.094 1.00 . A A . 8 ARG HD3 1 1 2 562 1 1 8 ARG HE H 3.214 -4.908 -4.002 1.00 . A A . 8 ARG HE 1 1 2 563 1 1 8 ARG HG2 H 5.492 -5.206 -4.611 1.00 . A A . 8 ARG HG2 1 1 2 564 1 1 8 ARG HG3 H 6.324 -6.582 -4.327 1.00 . A A . 8 ARG HG3 1 1 2 565 1 1 8 ARG HH11 H 2.534 -7.886 -2.202 1.00 . A A . 8 ARG HH11 1 1 2 566 1 1 8 ARG HH12 H 1.362 -7.058 -1.232 1.00 . A A . 8 ARG HH12 1 1 2 567 1 1 8 ARG HH21 H 1.874 -3.981 -2.629 1.00 . A A . 8 ARG HH21 1 1 2 568 1 1 8 ARG HH22 H 1.006 -4.922 -1.463 1.00 . A A . 8 ARG HH22 1 1 2 569 1 1 8 ARG N N 5.378 -3.095 -3.006 1.00 . A A . 8 ARG N 1 1 2 570 1 1 8 ARG NE N 3.162 -5.842 -3.605 1.00 . A A . 8 ARG NE 1 1 2 571 1 1 8 ARG NH1 N 2.040 -7.049 -1.967 1.00 . A A . 8 ARG NH1 1 1 2 572 1 1 8 ARG NH2 N 1.673 -4.864 -2.205 1.00 . A A . 8 ARG NH2 1 1 2 573 1 1 8 ARG O O 5.924 -2.676 -0.374 1.00 . A A . 8 ARG O 1 1 2 574 1 1 9 CYS C C 5.641 -6.087 2.269 1.00 . A A . 9 CYS C 1 1 2 575 1 1 9 CYS CA C 5.746 -4.664 1.696 1.00 . A A . 9 CYS CA 1 1 2 576 1 1 9 CYS CB C 4.675 -3.719 2.256 1.00 . A A . 9 CYS CB 1 1 2 577 1 1 9 CYS H H 5.268 -5.723 -0.009 1.00 . A A . 9 CYS H 1 1 2 578 1 1 9 CYS HA H 6.741 -4.268 1.908 1.00 . A A . 9 CYS HA 1 1 2 579 1 1 9 CYS HB2 H 3.980 -3.579 1.551 1.00 . A A . 9 CYS HB2 1 1 2 580 1 1 9 CYS HB3 H 4.258 -4.154 3.054 1.00 . A A . 9 CYS HB3 1 1 2 581 1 1 9 CYS N N 5.553 -4.793 0.262 1.00 . A A . 9 CYS N 1 1 2 582 1 1 9 CYS O O 5.384 -7.008 1.488 1.00 . A A . 9 CYS O 1 1 2 583 1 1 9 CYS SG S 5.310 -2.098 2.759 1.00 . A A . 9 CYS SG 1 1 2 584 1 1 10 PRO C C 4.412 -8.310 4.069 1.00 . A A . 10 PRO C 1 1 2 585 1 1 10 PRO CA C 5.788 -7.632 4.171 1.00 . A A . 10 PRO CA 1 1 2 586 1 1 10 PRO CB C 6.273 -7.461 5.617 1.00 . A A . 10 PRO CB 1 1 2 587 1 1 10 PRO CD C 6.254 -5.318 4.568 1.00 . A A . 10 PRO CD 1 1 2 588 1 1 10 PRO CG C 6.017 -5.986 5.919 1.00 . A A . 10 PRO CG 1 1 2 589 1 1 10 PRO HA H 6.497 -8.276 3.649 1.00 . A A . 10 PRO HA 1 1 2 590 1 1 10 PRO HB2 H 5.752 -8.047 6.238 1.00 . A A . 10 PRO HB2 1 1 2 591 1 1 10 PRO HB3 H 7.247 -7.676 5.693 1.00 . A A . 10 PRO HB3 1 1 2 592 1 1 10 PRO HD2 H 5.706 -4.486 4.488 1.00 . A A . 10 PRO HD2 1 1 2 593 1 1 10 PRO HD3 H 7.222 -5.093 4.453 1.00 . A A . 10 PRO HD3 1 1 2 594 1 1 10 PRO HG2 H 5.079 -5.840 6.233 1.00 . A A . 10 PRO HG2 1 1 2 595 1 1 10 PRO HG3 H 6.656 -5.643 6.607 1.00 . A A . 10 PRO HG3 1 1 2 596 1 1 10 PRO N N 5.838 -6.300 3.579 1.00 . A A . 10 PRO N 1 1 2 597 1 1 10 PRO O O 3.444 -7.758 3.543 1.00 . A A . 10 PRO O 1 1 2 598 1 1 11 SER C C 1.957 -10.106 3.959 1.00 . A A . 11 SER C 1 1 2 599 1 1 11 SER CA C 3.287 -10.535 4.570 1.00 . A A . 11 SER CA 1 1 2 600 1 1 11 SER CB C 3.092 -11.010 5.993 1.00 . A A . 11 SER CB 1 1 2 601 1 1 11 SER H H 5.174 -9.870 5.087 1.00 . A A . 11 SER H 1 1 2 602 1 1 11 SER HA H 3.635 -11.397 4.001 1.00 . A A . 11 SER HA 1 1 2 603 1 1 11 SER HB2 H 2.735 -10.263 6.554 1.00 . A A . 11 SER HB2 1 1 2 604 1 1 11 SER HB3 H 2.450 -11.777 6.010 1.00 . A A . 11 SER HB3 1 1 2 605 1 1 11 SER HG H 4.231 -11.799 7.369 1.00 . A A . 11 SER HG 1 1 2 606 1 1 11 SER N N 4.367 -9.550 4.569 1.00 . A A . 11 SER N 1 1 2 607 1 1 11 SER O O 0.950 -9.915 4.641 1.00 . A A . 11 SER O 1 1 2 608 1 1 11 SER OG O 4.349 -11.425 6.490 1.00 . A A . 11 SER OG 1 1 2 609 1 1 12 GLY C C 0.117 -8.387 2.165 1.00 . A A . 12 GLY C 1 1 2 610 1 1 12 GLY CA C 0.762 -9.734 1.837 1.00 . A A . 12 GLY CA 1 1 2 611 1 1 12 GLY H H 2.836 -10.200 2.194 1.00 . A A . 12 GLY H 1 1 2 612 1 1 12 GLY HA2 H 1.032 -9.734 0.782 1.00 . A A . 12 GLY HA2 1 1 2 613 1 1 12 GLY HA3 H 0.023 -10.519 1.998 1.00 . A A . 12 GLY HA3 1 1 2 614 1 1 12 GLY N N 1.949 -10.024 2.633 1.00 . A A . 12 GLY N 1 1 2 615 1 1 12 GLY O O -1.108 -8.311 2.259 1.00 . A A . 12 GLY O 1 1 2 616 1 1 13 MET C C 0.066 -5.425 1.043 1.00 . A A . 13 MET C 1 1 2 617 1 1 13 MET CA C 0.329 -5.981 2.449 1.00 . A A . 13 MET CA 1 1 2 618 1 1 13 MET CB C 1.256 -5.038 3.217 1.00 . A A . 13 MET CB 1 1 2 619 1 1 13 MET CE C 2.310 -5.097 7.266 1.00 . A A . 13 MET CE 1 1 2 620 1 1 13 MET CG C 1.374 -5.432 4.689 1.00 . A A . 13 MET CG 1 1 2 621 1 1 13 MET H H 1.902 -7.464 2.519 1.00 . A A . 13 MET H 1 1 2 622 1 1 13 MET HA H -0.628 -6.011 2.973 1.00 . A A . 13 MET HA 1 1 2 623 1 1 13 MET HB2 H 2.165 -5.067 2.800 1.00 . A A . 13 MET HB2 1 1 2 624 1 1 13 MET HB3 H 0.892 -4.108 3.159 1.00 . A A . 13 MET HB3 1 1 2 625 1 1 13 MET HE1 H 1.273 -5.079 7.600 1.00 . A A . 13 MET HE1 1 1 2 626 1 1 13 MET HE2 H 2.656 -6.128 7.207 1.00 . A A . 13 MET HE2 1 1 2 627 1 1 13 MET HE3 H 2.927 -4.548 7.978 1.00 . A A . 13 MET HE3 1 1 2 628 1 1 13 MET HG2 H 0.460 -5.422 5.096 1.00 . A A . 13 MET HG2 1 1 2 629 1 1 13 MET HG3 H 1.753 -6.356 4.742 1.00 . A A . 13 MET HG3 1 1 2 630 1 1 13 MET N N 0.897 -7.331 2.403 1.00 . A A . 13 MET N 1 1 2 631 1 1 13 MET O O 0.560 -5.936 0.031 1.00 . A A . 13 MET O 1 1 2 632 1 1 13 MET SD S 2.439 -4.318 5.637 1.00 . A A . 13 MET SD 1 1 2 633 1 1 14 CYS C C -0.538 -2.179 -0.162 1.00 . A A . 14 CYS C 1 1 2 634 1 1 14 CYS CA C -1.079 -3.617 -0.224 1.00 . A A . 14 CYS CA 1 1 2 635 1 1 14 CYS CB C -2.605 -3.670 -0.327 1.00 . A A . 14 CYS CB 1 1 2 636 1 1 14 CYS H H -1.016 -3.929 1.858 1.00 . A A . 14 CYS H 1 1 2 637 1 1 14 CYS HA H -0.667 -4.100 -1.106 1.00 . A A . 14 CYS HA 1 1 2 638 1 1 14 CYS HB2 H -2.979 -2.946 0.253 1.00 . A A . 14 CYS HB2 1 1 2 639 1 1 14 CYS HB3 H -2.856 -3.498 -1.280 1.00 . A A . 14 CYS HB3 1 1 2 640 1 1 14 CYS N N -0.683 -4.328 0.987 1.00 . A A . 14 CYS N 1 1 2 641 1 1 14 CYS O O -0.042 -1.766 0.883 1.00 . A A . 14 CYS O 1 1 2 642 1 1 14 CYS SG S -3.369 -5.246 0.180 1.00 . A A . 14 CYS SG 1 1 2 643 1 1 15 CYS C C -0.913 0.975 -1.860 1.00 . A A . 15 CYS C 1 1 2 644 1 1 15 CYS CA C 0.063 -0.123 -1.404 1.00 . A A . 15 CYS CA 1 1 2 645 1 1 15 CYS CB C 1.217 -0.273 -2.400 1.00 . A A . 15 CYS CB 1 1 2 646 1 1 15 CYS H H -1.131 -1.773 -2.047 1.00 . A A . 15 CYS H 1 1 2 647 1 1 15 CYS HA H 0.482 0.175 -0.444 1.00 . A A . 15 CYS HA 1 1 2 648 1 1 15 CYS HB2 H 1.774 -1.055 -2.120 1.00 . A A . 15 CYS HB2 1 1 2 649 1 1 15 CYS HB3 H 0.830 -0.446 -3.305 1.00 . A A . 15 CYS HB3 1 1 2 650 1 1 15 CYS N N -0.597 -1.428 -1.268 1.00 . A A . 15 CYS N 1 1 2 651 1 1 15 CYS O O -1.733 0.735 -2.749 1.00 . A A . 15 CYS O 1 1 2 652 1 1 15 CYS SG S 2.293 1.180 -2.511 1.00 . A A . 15 CYS SG 1 1 2 653 1 1 16 SER C C -1.578 4.187 -2.511 1.00 . A A . 16 SER C 1 1 2 654 1 1 16 SER CA C -1.769 3.265 -1.315 1.00 . A A . 16 SER CA 1 1 2 655 1 1 16 SER CB C -1.656 4.113 -0.039 1.00 . A A . 16 SER CB 1 1 2 656 1 1 16 SER H H -0.016 2.319 -0.642 1.00 . A A . 16 SER H 1 1 2 657 1 1 16 SER HA H -2.774 2.842 -1.365 1.00 . A A . 16 SER HA 1 1 2 658 1 1 16 SER HB2 H -2.505 4.627 0.083 1.00 . A A . 16 SER HB2 1 1 2 659 1 1 16 SER HB3 H -1.519 3.504 0.742 1.00 . A A . 16 SER HB3 1 1 2 660 1 1 16 SER HG H -0.630 5.574 0.704 1.00 . A A . 16 SER HG 1 1 2 661 1 1 16 SER N N -0.804 2.168 -1.260 1.00 . A A . 16 SER N 1 1 2 662 1 1 16 SER O O -0.672 4.022 -3.325 1.00 . A A . 16 SER O 1 1 2 663 1 1 16 SER OG O -0.569 5.030 -0.103 1.00 . A A . 16 SER OG 1 1 2 664 1 1 17 GLN C C -1.090 7.210 -3.285 1.00 . A A . 17 GLN C 1 1 2 665 1 1 17 GLN CA C -2.281 6.282 -3.567 1.00 . A A . 17 GLN CA 1 1 2 666 1 1 17 GLN CB C -3.570 7.125 -3.633 1.00 . A A . 17 GLN CB 1 1 2 667 1 1 17 GLN CD C -5.164 5.909 -2.045 1.00 . A A . 17 GLN CD 1 1 2 668 1 1 17 GLN CG C -4.914 6.397 -3.470 1.00 . A A . 17 GLN CG 1 1 2 669 1 1 17 GLN H H -3.035 5.415 -1.799 1.00 . A A . 17 GLN H 1 1 2 670 1 1 17 GLN HA H -2.107 5.793 -4.524 1.00 . A A . 17 GLN HA 1 1 2 671 1 1 17 GLN HB2 H -3.514 7.812 -2.909 1.00 . A A . 17 GLN HB2 1 1 2 672 1 1 17 GLN HB3 H -3.583 7.579 -4.524 1.00 . A A . 17 GLN HB3 1 1 2 673 1 1 17 GLN HE21 H -6.523 4.572 -2.668 1.00 . A A . 17 GLN HE21 1 1 2 674 1 1 17 GLN HE22 H -5.859 4.352 -1.026 1.00 . A A . 17 GLN HE22 1 1 2 675 1 1 17 GLN HG2 H -5.649 7.026 -3.724 1.00 . A A . 17 GLN HG2 1 1 2 676 1 1 17 GLN HG3 H -4.924 5.607 -4.083 1.00 . A A . 17 GLN HG3 1 1 2 677 1 1 17 GLN N N -2.399 5.239 -2.563 1.00 . A A . 17 GLN N 1 1 2 678 1 1 17 GLN NE2 N -5.988 4.905 -1.870 1.00 . A A . 17 GLN NE2 1 1 2 679 1 1 17 GLN O O -0.782 8.075 -4.096 1.00 . A A . 17 GLN O 1 1 2 680 1 1 17 GLN OE1 O -4.549 6.351 -1.079 1.00 . A A . 17 GLN OE1 1 1 2 681 1 1 18 . C C 1.953 7.114 -1.467 1.00 . A A . 18 PFF C 1 1 2 682 1 1 18 . CA C 0.665 7.911 -1.688 1.00 . A A . 18 PFF CA 1 1 2 683 1 1 18 . CB C 0.222 8.667 -0.428 1.00 . A A . 18 PFF CB 1 1 2 684 1 1 18 . CD1 C -0.735 10.865 -1.225 1.00 . A A . 18 PFF CD1 1 1 2 685 1 1 18 . CD2 C -2.270 9.082 -0.594 1.00 . A A . 18 PFF CD2 1 1 2 686 1 1 18 . CE1 C -1.816 11.630 -1.696 1.00 . A A . 18 PFF CE1 1 1 2 687 1 1 18 . CE2 C -3.349 9.848 -1.068 1.00 . A A . 18 PFF CE2 1 1 2 688 1 1 18 . CG C -0.957 9.581 -0.694 1.00 . A A . 18 PFF CG 1 1 2 689 1 1 18 . CZ C -3.121 11.111 -1.640 1.00 . A A . 18 PFF CZ 1 1 2 690 1 1 18 . F F -4.161 11.828 -2.141 1.00 . A A . 18 PFF F 1 1 2 691 1 1 18 . H H -0.714 6.307 -1.498 1.00 . A A . 18 PFF H 1 1 2 692 1 1 18 . HA H 0.885 8.651 -2.458 1.00 . A A . 18 PFF HA 1 1 2 693 1 1 18 . HB2 H -0.042 7.952 0.352 1.00 . A A . 18 PFF HB2 1 1 2 694 1 1 18 . HB3 H 1.049 9.275 -0.061 1.00 . A A . 18 PFF HB3 1 1 2 695 1 1 18 . HD1 H 0.273 11.239 -1.332 1.00 . A A . 18 PFF HD1 1 1 2 696 1 1 18 . HD2 H -2.442 8.088 -0.208 1.00 . A A . 18 PFF HD2 1 1 2 697 1 1 18 . HE1 H -1.641 12.603 -2.133 1.00 . A A . 18 PFF HE1 1 1 2 698 1 1 18 . HE2 H -4.351 9.450 -1.041 1.00 . A A . 18 PFF HE2 1 1 2 699 1 1 18 . N N -0.430 7.051 -2.131 1.00 . A A . 18 PFF N 1 1 2 700 1 1 18 . O O 2.899 7.618 -0.870 1.00 . A A . 18 PFF O 1 1 2 701 1 1 19 GLY C C 3.437 4.473 -0.426 1.00 . A A . 19 GLY C 1 1 2 702 1 1 19 GLY CA C 3.204 5.046 -1.822 1.00 . A A . 19 GLY CA 1 1 2 703 1 1 19 GLY H H 1.195 5.484 -2.418 1.00 . A A . 19 GLY H 1 1 2 704 1 1 19 GLY HA2 H 3.139 4.215 -2.524 1.00 . A A . 19 GLY HA2 1 1 2 705 1 1 19 GLY HA3 H 4.071 5.650 -2.085 1.00 . A A . 19 GLY HA3 1 1 2 706 1 1 19 GLY N N 1.997 5.857 -1.927 1.00 . A A . 19 GLY N 1 1 2 707 1 1 19 GLY O O 4.550 4.042 -0.137 1.00 . A A . 19 GLY O 1 1 2 708 1 1 20 . C C 1.730 2.478 1.740 1.00 . A A . 20 PFF C 1 1 2 709 1 1 20 . CA C 2.503 3.794 1.742 1.00 . A A . 20 PFF CA 1 1 2 710 1 1 20 . CB C 1.954 4.750 2.792 1.00 . A A . 20 PFF CB 1 1 2 711 1 1 20 . CD1 C 2.713 7.137 2.418 1.00 . A A . 20 PFF CD1 1 1 2 712 1 1 20 . CD2 C 3.882 5.775 4.062 1.00 . A A . 20 PFF CD2 1 1 2 713 1 1 20 . CE1 C 3.523 8.236 2.755 1.00 . A A . 20 PFF CE1 1 1 2 714 1 1 20 . CE2 C 4.708 6.865 4.380 1.00 . A A . 20 PFF CE2 1 1 2 715 1 1 20 . CG C 2.876 5.912 3.089 1.00 . A A . 20 PFF CG 1 1 2 716 1 1 20 . CZ C 4.514 8.101 3.743 1.00 . A A . 20 PFF CZ 1 1 2 717 1 1 20 . F F 5.287 9.166 4.082 1.00 . A A . 20 PFF F 1 1 2 718 1 1 20 . H H 1.497 4.747 0.142 1.00 . A A . 20 PFF H 1 1 2 719 1 1 20 . HA H 3.535 3.570 1.985 1.00 . A A . 20 PFF HA 1 1 2 720 1 1 20 . HB2 H 0.981 5.116 2.467 1.00 . A A . 20 PFF HB2 1 1 2 721 1 1 20 . HB3 H 1.804 4.187 3.707 1.00 . A A . 20 PFF HB3 1 1 2 722 1 1 20 . HD1 H 1.969 7.238 1.643 1.00 . A A . 20 PFF HD1 1 1 2 723 1 1 20 . HD2 H 3.974 4.857 4.620 1.00 . A A . 20 PFF HD2 1 1 2 724 1 1 20 . HE1 H 3.391 9.180 2.246 1.00 . A A . 20 PFF HE1 1 1 2 725 1 1 20 . HE2 H 5.465 6.763 5.142 1.00 . A A . 20 PFF HE2 1 1 2 726 1 1 20 . N N 2.416 4.443 0.438 1.00 . A A . 20 PFF N 1 1 2 727 1 1 20 . O O 0.829 2.299 0.922 1.00 . A A . 20 PFF O 1 1 2 728 1 1 21 CYS C C 0.710 -0.210 3.813 1.00 . A A . 21 CYS C 1 1 2 729 1 1 21 CYS CA C 1.508 0.200 2.572 1.00 . A A . 21 CYS CA 1 1 2 730 1 1 21 CYS CB C 2.642 -0.788 2.274 1.00 . A A . 21 CYS CB 1 1 2 731 1 1 21 CYS H H 2.808 1.740 3.300 1.00 . A A . 21 CYS H 1 1 2 732 1 1 21 CYS HA H 0.818 0.161 1.737 1.00 . A A . 21 CYS HA 1 1 2 733 1 1 21 CYS HB2 H 2.229 -1.639 1.950 1.00 . A A . 21 CYS HB2 1 1 2 734 1 1 21 CYS HB3 H 3.208 -0.394 1.549 1.00 . A A . 21 CYS HB3 1 1 2 735 1 1 21 CYS N N 2.059 1.548 2.639 1.00 . A A . 21 CYS N 1 1 2 736 1 1 21 CYS O O 0.886 0.332 4.901 1.00 . A A . 21 CYS O 1 1 2 737 1 1 21 CYS SG S 3.727 -1.195 3.663 1.00 . A A . 21 CYS SG 1 1 2 738 1 1 22 GLY C C -2.003 -2.729 4.162 1.00 . A A . 22 GLY C 1 1 2 739 1 1 22 GLY CA C -0.956 -1.771 4.722 1.00 . A A . 22 GLY CA 1 1 2 740 1 1 22 GLY H H -0.353 -1.531 2.694 1.00 . A A . 22 GLY H 1 1 2 741 1 1 22 GLY HA2 H -0.296 -2.314 5.400 1.00 . A A . 22 GLY HA2 1 1 2 742 1 1 22 GLY HA3 H -1.455 -0.971 5.270 1.00 . A A . 22 GLY HA3 1 1 2 743 1 1 22 GLY N N -0.169 -1.197 3.641 1.00 . A A . 22 GLY N 1 1 2 744 1 1 22 GLY O O -2.059 -2.945 2.952 1.00 . A A . 22 GLY O 1 1 2 745 1 1 23 LYS C C -5.329 -3.407 4.647 1.00 . A A . 23 LYS C 1 1 2 746 1 1 23 LYS CA C -3.984 -4.134 4.601 1.00 . A A . 23 LYS CA 1 1 2 747 1 1 23 LYS CB C -4.041 -5.419 5.440 1.00 . A A . 23 LYS CB 1 1 2 748 1 1 23 LYS CD C -2.904 -7.541 6.132 1.00 . A A . 23 LYS CD 1 1 2 749 1 1 23 LYS CE C -1.667 -8.434 5.995 1.00 . A A . 23 LYS CE 1 1 2 750 1 1 23 LYS CG C -2.817 -6.316 5.215 1.00 . A A . 23 LYS CG 1 1 2 751 1 1 23 LYS H H -2.703 -3.137 6.013 1.00 . A A . 23 LYS H 1 1 2 752 1 1 23 LYS HA H -3.857 -4.397 3.557 1.00 . A A . 23 LYS HA 1 1 2 753 1 1 23 LYS HB2 H -4.083 -5.170 6.407 1.00 . A A . 23 LYS HB2 1 1 2 754 1 1 23 LYS HB3 H -4.864 -5.930 5.191 1.00 . A A . 23 LYS HB3 1 1 2 755 1 1 23 LYS HD2 H -2.978 -7.232 7.080 1.00 . A A . 23 LYS HD2 1 1 2 756 1 1 23 LYS HD3 H -3.716 -8.072 5.889 1.00 . A A . 23 LYS HD3 1 1 2 757 1 1 23 LYS HE2 H -0.851 -7.856 6.005 1.00 . A A . 23 LYS HE2 1 1 2 758 1 1 23 LYS HE3 H -1.639 -9.065 6.770 1.00 . A A . 23 LYS HE3 1 1 2 759 1 1 23 LYS HG2 H -2.794 -6.615 4.261 1.00 . A A . 23 LYS HG2 1 1 2 760 1 1 23 LYS HG3 H -1.985 -5.802 5.424 1.00 . A A . 23 LYS HG3 1 1 2 761 1 1 23 LYS HZ1 H -0.802 -9.739 4.671 1.00 . A A . 23 LYS HZ1 1 1 2 762 1 1 23 LYS HZ2 H -2.450 -9.869 4.719 1.00 . A A . 23 LYS HZ2 1 1 2 763 1 1 23 LYS HZ3 H -1.720 -8.625 3.917 1.00 . A A . 23 LYS HZ3 1 1 2 764 1 1 23 LYS N N -2.848 -3.299 5.026 1.00 . A A . 23 LYS N 1 1 2 765 1 1 23 LYS NZ N -1.677 -9.221 4.742 1.00 . A A . 23 LYS NZ 1 1 2 766 1 1 23 LYS O O -6.360 -3.985 4.327 1.00 . A A . 23 LYS O 1 1 2 767 1 1 24 GLY C C -7.140 -0.879 3.904 1.00 . A A . 24 GLY C 1 1 2 768 1 1 24 GLY CA C -6.547 -1.368 5.231 1.00 . A A . 24 GLY CA 1 1 2 769 1 1 24 GLY H H -4.418 -1.722 5.168 1.00 . A A . 24 GLY H 1 1 2 770 1 1 24 GLY HA2 H -7.274 -2.000 5.739 1.00 . A A . 24 GLY HA2 1 1 2 771 1 1 24 GLY HA3 H -6.339 -0.503 5.861 1.00 . A A . 24 GLY HA3 1 1 2 772 1 1 24 GLY N N -5.322 -2.138 5.040 1.00 . A A . 24 GLY N 1 1 2 773 1 1 24 GLY O O -6.427 -0.806 2.898 1.00 . A A . 24 GLY O 1 1 2 774 1 1 25 PRO C C -8.360 0.843 1.779 1.00 . A A . 25 PRO C 1 1 2 775 1 1 25 PRO CA C -9.157 -0.071 2.707 1.00 . A A . 25 PRO CA 1 1 2 776 1 1 25 PRO CB C -10.442 0.581 3.225 1.00 . A A . 25 PRO CB 1 1 2 777 1 1 25 PRO CD C -9.304 -0.455 5.058 1.00 . A A . 25 PRO CD 1 1 2 778 1 1 25 PRO CG C -10.708 -0.205 4.507 1.00 . A A . 25 PRO CG 1 1 2 779 1 1 25 PRO HA H -9.425 -0.971 2.154 1.00 . A A . 25 PRO HA 1 1 2 780 1 1 25 PRO HB2 H -10.303 1.552 3.418 1.00 . A A . 25 PRO HB2 1 1 2 781 1 1 25 PRO HB3 H -11.192 0.474 2.572 1.00 . A A . 25 PRO HB3 1 1 2 782 1 1 25 PRO HD2 H -9.040 0.279 5.684 1.00 . A A . 25 PRO HD2 1 1 2 783 1 1 25 PRO HD3 H -9.269 -1.332 5.538 1.00 . A A . 25 PRO HD3 1 1 2 784 1 1 25 PRO HG2 H -11.255 0.331 5.150 1.00 . A A . 25 PRO HG2 1 1 2 785 1 1 25 PRO HG3 H -11.175 -1.067 4.309 1.00 . A A . 25 PRO HG3 1 1 2 786 1 1 25 PRO N N -8.422 -0.476 3.901 1.00 . A A . 25 PRO N 1 1 2 787 1 1 25 PRO O O -8.141 0.490 0.622 1.00 . A A . 25 PRO O 1 1 2 788 1 1 26 LYS C C -5.771 2.408 0.952 1.00 . A A . 26 LYS C 1 1 2 789 1 1 26 LYS CA C -7.065 2.956 1.547 1.00 . A A . 26 LYS CA 1 1 2 790 1 1 26 LYS CB C -6.706 4.124 2.475 1.00 . A A . 26 LYS CB 1 1 2 791 1 1 26 LYS CD C -7.665 6.203 1.428 1.00 . A A . 26 LYS CD 1 1 2 792 1 1 26 LYS CE C -6.559 7.176 1.851 1.00 . A A . 26 LYS CE 1 1 2 793 1 1 26 LYS CG C -7.842 5.155 2.538 1.00 . A A . 26 LYS CG 1 1 2 794 1 1 26 LYS H H -8.079 2.177 3.260 1.00 . A A . 26 LYS H 1 1 2 795 1 1 26 LYS HA H -7.655 3.331 0.711 1.00 . A A . 26 LYS HA 1 1 2 796 1 1 26 LYS HB2 H -6.537 3.769 3.395 1.00 . A A . 26 LYS HB2 1 1 2 797 1 1 26 LYS HB3 H -5.880 4.570 2.132 1.00 . A A . 26 LYS HB3 1 1 2 798 1 1 26 LYS HD2 H -7.408 5.750 0.574 1.00 . A A . 26 LYS HD2 1 1 2 799 1 1 26 LYS HD3 H -8.521 6.702 1.296 1.00 . A A . 26 LYS HD3 1 1 2 800 1 1 26 LYS HE2 H -6.943 7.827 2.506 1.00 . A A . 26 LYS HE2 1 1 2 801 1 1 26 LYS HE3 H -5.828 6.653 2.290 1.00 . A A . 26 LYS HE3 1 1 2 802 1 1 26 LYS HG2 H -8.719 4.689 2.416 1.00 . A A . 26 LYS HG2 1 1 2 803 1 1 26 LYS HG3 H -7.827 5.610 3.428 1.00 . A A . 26 LYS HG3 1 1 2 804 1 1 26 LYS HZ1 H -6.670 8.518 0.251 1.00 . A A . 26 LYS HZ1 1 1 2 805 1 1 26 LYS HZ2 H -5.314 8.592 1.126 1.00 . A A . 26 LYS HZ2 1 1 2 806 1 1 26 LYS HZ3 H -5.496 7.333 0.060 1.00 . A A . 26 LYS HZ3 1 1 2 807 1 1 26 LYS N N -7.861 1.975 2.295 1.00 . A A . 26 LYS N 1 1 2 808 1 1 26 LYS NZ N -5.979 7.935 0.723 1.00 . A A . 26 LYS NZ 1 1 2 809 1 1 26 LYS O O -5.260 3.010 0.009 1.00 . A A . 26 LYS O 1 1 2 810 1 1 27 TYR C C -4.303 -0.431 0.035 1.00 . A A . 27 TYR C 1 1 2 811 1 1 27 TYR CA C -4.013 0.688 1.022 1.00 . A A . 27 TYR CA 1 1 2 812 1 1 27 TYR CB C -3.267 0.095 2.217 1.00 . A A . 27 TYR CB 1 1 2 813 1 1 27 TYR CD1 C -1.725 1.867 3.117 1.00 . A A . 27 TYR CD1 1 1 2 814 1 1 27 TYR CD2 C -3.726 1.339 4.388 1.00 . A A . 27 TYR CD2 1 1 2 815 1 1 27 TYR CE1 C -1.326 2.781 4.109 1.00 . A A . 27 TYR CE1 1 1 2 816 1 1 27 TYR CE2 C -3.367 2.312 5.343 1.00 . A A . 27 TYR CE2 1 1 2 817 1 1 27 TYR CG C -2.894 1.111 3.276 1.00 . A A . 27 TYR CG 1 1 2 818 1 1 27 TYR CZ C -2.160 3.017 5.211 1.00 . A A . 27 TYR CZ 1 1 2 819 1 1 27 TYR H H -5.769 0.826 2.213 1.00 . A A . 27 TYR H 1 1 2 820 1 1 27 TYR HA H -3.377 1.427 0.533 1.00 . A A . 27 TYR HA 1 1 2 821 1 1 27 TYR HB2 H -3.850 -0.599 2.639 1.00 . A A . 27 TYR HB2 1 1 2 822 1 1 27 TYR HB3 H -2.427 -0.333 1.883 1.00 . A A . 27 TYR HB3 1 1 2 823 1 1 27 TYR HD1 H -1.143 1.744 2.221 1.00 . A A . 27 TYR HD1 1 1 2 824 1 1 27 TYR HD2 H -4.648 0.790 4.495 1.00 . A A . 27 TYR HD2 1 1 2 825 1 1 27 TYR HE1 H -0.397 3.322 4.015 1.00 . A A . 27 TYR HE1 1 1 2 826 1 1 27 TYR HE2 H -4.000 2.521 6.192 1.00 . A A . 27 TYR HE2 1 1 2 827 1 1 27 TYR HH H -0.917 4.246 6.040 1.00 . A A . 27 TYR HH 1 1 2 828 1 1 27 TYR N N -5.251 1.303 1.485 1.00 . A A . 27 TYR N 1 1 2 829 1 1 27 TYR O O -3.564 -0.630 -0.925 1.00 . A A . 27 TYR O 1 1 2 830 1 1 27 TYR OH O -1.858 4.014 6.086 1.00 . A A . 27 TYR OH 1 1 2 831 1 1 28 CYS C C -6.788 -2.245 -1.477 1.00 . A A . 28 CYS C 1 1 2 832 1 1 28 CYS CA C -5.637 -2.388 -0.477 1.00 . A A . 28 CYS CA 1 1 2 833 1 1 28 CYS CB C -5.827 -3.536 0.503 1.00 . A A . 28 CYS CB 1 1 2 834 1 1 28 CYS H H -5.824 -1.085 1.191 1.00 . A A . 28 CYS H 1 1 2 835 1 1 28 CYS HA H -4.765 -2.619 -1.079 1.00 . A A . 28 CYS HA 1 1 2 836 1 1 28 CYS HB2 H -5.254 -3.382 1.308 1.00 . A A . 28 CYS HB2 1 1 2 837 1 1 28 CYS HB3 H -6.787 -3.579 0.780 1.00 . A A . 28 CYS HB3 1 1 2 838 1 1 28 CYS N N -5.365 -1.194 0.293 1.00 . A A . 28 CYS N 1 1 2 839 1 1 28 CYS O O -6.602 -2.580 -2.650 1.00 . A A . 28 CYS O 1 1 2 840 1 1 28 CYS SG S -5.358 -5.097 -0.275 1.00 . A A . 28 CYS SG 1 1 2 841 1 1 29 GLY C C -8.807 -0.180 -2.811 1.00 . A A . 29 GLY C 1 1 2 842 1 1 29 GLY CA C -9.045 -1.455 -2.003 1.00 . A A . 29 GLY CA 1 1 2 843 1 1 29 GLY H H -7.983 -1.277 -0.147 1.00 . A A . 29 GLY H 1 1 2 844 1 1 29 GLY HA2 H -9.144 -2.293 -2.693 1.00 . A A . 29 GLY HA2 1 1 2 845 1 1 29 GLY HA3 H -9.974 -1.348 -1.445 1.00 . A A . 29 GLY HA3 1 1 2 846 1 1 29 GLY N N -7.937 -1.693 -1.073 1.00 . A A . 29 GLY N 1 1 2 847 1 1 29 GLY O O -9.012 -0.153 -4.019 1.00 . A A . 29 GLY O 1 1 2 848 1 1 30 ARG C C -8.191 2.927 -3.659 1.00 . A A . 30 ARG C 1 1 2 849 1 1 30 ARG CA C -7.578 2.042 -2.565 1.00 . A A . 30 ARG CA 1 1 2 850 1 1 30 ARG CB C -6.129 1.642 -2.883 1.00 . A A . 30 ARG CB 1 1 2 851 1 1 30 ARG CD C -4.606 0.415 -4.418 1.00 . A A . 30 ARG CD 1 1 2 852 1 1 30 ARG CG C -5.916 1.192 -4.331 1.00 . A A . 30 ARG CG 1 1 2 853 1 1 30 ARG CZ C -3.826 -1.865 -3.847 1.00 . A A . 30 ARG CZ 1 1 2 854 1 1 30 ARG H H -8.280 0.684 -1.121 1.00 . A A . 30 ARG H 1 1 2 855 1 1 30 ARG HA H -7.522 2.684 -1.687 1.00 . A A . 30 ARG HA 1 1 2 856 1 1 30 ARG HB2 H -5.539 2.430 -2.708 1.00 . A A . 30 ARG HB2 1 1 2 857 1 1 30 ARG HB3 H -5.870 0.889 -2.278 1.00 . A A . 30 ARG HB3 1 1 2 858 1 1 30 ARG HD2 H -4.331 0.343 -5.377 1.00 . A A . 30 ARG HD2 1 1 2 859 1 1 30 ARG HD3 H -3.901 0.903 -3.904 1.00 . A A . 30 ARG HD3 1 1 2 860 1 1 30 ARG HE H -5.694 -1.264 -3.622 1.00 . A A . 30 ARG HE 1 1 2 861 1 1 30 ARG HG2 H -6.674 0.605 -4.615 1.00 . A A . 30 ARG HG2 1 1 2 862 1 1 30 ARG HG3 H -5.872 1.993 -4.928 1.00 . A A . 30 ARG HG3 1 1 2 863 1 1 30 ARG HH11 H -2.289 -0.603 -4.119 1.00 . A A . 30 ARG HH11 1 1 2 864 1 1 30 ARG HH12 H -1.866 -2.277 -3.984 1.00 . A A . 30 ARG HH12 1 1 2 865 1 1 30 ARG HH21 H -5.144 -3.359 -3.600 1.00 . A A . 30 ARG HH21 1 1 2 866 1 1 30 ARG HH22 H -3.481 -3.836 -3.690 1.00 . A A . 30 ARG HH22 1 1 2 867 1 1 30 ARG N N -8.311 0.851 -2.118 1.00 . A A . 30 ARG N 1 1 2 868 1 1 30 ARG NE N -4.762 -0.936 -3.858 1.00 . A A . 30 ARG NE 1 1 2 869 1 1 30 ARG NH1 N -2.560 -1.557 -3.995 1.00 . A A . 30 ARG NH1 1 1 2 870 1 1 30 ARG NH2 N -4.178 -3.119 -3.701 1.00 . A A . 30 ARG NH2 1 1 2 871 1 1 30 ARG O O -7.690 4.028 -3.854 1.00 . A A . 30 ARG O 1 1 2 872 1 1 31 NH2 HN1 H -9.627 3.140 -5.047 1.00 . A A . 31 NH2 HN1 1 1 2 873 1 1 31 NH2 HN2 H -9.577 1.574 -4.245 1.00 . A A . 31 NH2 HN2 1 1 2 874 1 1 31 NH2 N N -9.249 2.525 -4.345 1.00 . A A . 31 NH2 N 1 1 2 875 2 2 1 NAG C1 C -6.957 14.589 0.171 1.00 . B A . 32 NAG C1 1 1 2 876 2 2 1 NAG C2 C -6.611 13.111 0.091 1.00 . B A . 32 NAG C2 1 1 2 877 2 2 1 NAG C3 C -5.464 12.829 1.087 1.00 . B A . 32 NAG C3 1 1 2 878 2 2 1 NAG C4 C -4.274 13.810 0.919 1.00 . B A . 32 NAG C4 1 1 2 879 2 2 1 NAG C5 C -4.847 15.233 0.974 1.00 . B A . 32 NAG C5 1 1 2 880 2 2 1 NAG C6 C -3.765 16.320 0.820 1.00 . B A . 32 NAG C6 1 1 2 881 2 2 1 NAG C7 C -8.035 11.004 0.147 1.00 . B A . 32 NAG C7 1 1 2 882 2 2 1 NAG C8 C -9.444 10.531 0.318 1.00 . B A . 32 NAG C8 1 1 2 883 2 2 1 NAG H1 H -7.425 14.840 1.126 1.00 . B A . 32 NAG H1 1 1 2 884 2 2 1 NAG H2 H -6.241 12.956 -0.924 1.00 . B A . 32 NAG H2 1 1 2 885 2 2 1 NAG H3 H -5.850 12.893 2.104 1.00 . B A . 32 NAG H3 1 1 2 886 2 2 1 NAG H4 H -3.828 13.650 -0.062 1.00 . B A . 32 NAG H4 1 1 2 887 2 2 1 NAG H5 H -5.338 15.394 1.936 1.00 . B A . 32 NAG H5 1 1 2 888 2 2 1 NAG H61 H -4.240 17.231 0.457 1.00 . B A . 32 NAG H61 1 1 2 889 2 2 1 NAG H62 H -3.009 16.012 0.098 1.00 . B A . 32 NAG H62 1 1 2 890 2 2 1 NAG H81 H -10.078 11.058 -0.391 1.00 . B A . 32 NAG H81 1 1 2 891 2 2 1 NAG H82 H -9.477 9.464 0.111 1.00 . B A . 32 NAG H82 1 1 2 892 2 2 1 NAG H83 H -9.765 10.723 1.339 1.00 . B A . 32 NAG H83 1 1 2 893 2 2 1 NAG HN2 H -8.684 12.815 0.521 1.00 . B A . 32 NAG HN2 1 1 2 894 2 2 1 NAG HO1 H -7.457 15.739 -1.203 1.00 . B A . 32 NAG HO1 1 1 2 895 2 2 1 NAG HO3 H -5.703 11.108 0.228 1.00 . B A . 32 NAG HO3 1 1 2 896 2 2 1 NAG HO4 H 2.718 7.310 7.891 1.00 . B A . 32 NAG HO4 1 1 2 897 2 2 1 NAG HO6 H -2.397 16.062 2.208 1.00 . B A . 32 NAG HO6 1 1 2 898 2 2 1 NAG N2 N -7.834 12.303 0.336 1.00 . B A . 32 NAG N2 1 1 2 899 2 2 1 NAG O1 O -7.803 14.913 -0.856 1.00 . B A . 32 NAG O1 1 1 2 900 2 2 1 NAG O3 O -5.052 11.502 0.827 1.00 . B A . 32 NAG O3 1 1 2 901 2 2 1 NAG O4 O -3.213 13.690 1.911 1.00 . B A . 32 NAG O4 1 1 2 902 2 2 1 NAG O5 O -5.807 15.373 -0.059 1.00 . B A . 32 NAG O5 1 1 2 903 2 2 1 NAG O6 O -3.161 16.647 2.059 1.00 . B A . 32 NAG O6 1 1 2 904 2 2 1 NAG O7 O -7.140 10.205 -0.127 1.00 . B A . 32 NAG O7 1 1 3 905 1 1 1 VAL C C 7.644 4.203 6.573 1.00 . A A . 1 VAL C 1 1 3 906 1 1 1 VAL CA C 8.958 4.963 6.483 1.00 . A A . 1 VAL CA 1 1 3 907 1 1 1 VAL CB C 9.739 4.958 7.805 1.00 . A A . 1 VAL CB 1 1 3 908 1 1 1 VAL CG1 C 9.091 5.763 8.936 1.00 . A A . 1 VAL CG1 1 1 3 909 1 1 1 VAL CG2 C 10.002 3.527 8.278 1.00 . A A . 1 VAL CG2 1 1 3 910 1 1 1 VAL H1 H 7.979 6.770 6.537 1.00 . A A . 1 VAL H1 1 1 3 911 1 1 1 VAL H2 H 8.397 6.281 5.016 1.00 . A A . 1 VAL H2 1 1 3 912 1 1 1 VAL H3 H 9.550 6.878 5.998 1.00 . A A . 1 VAL H3 1 1 3 913 1 1 1 VAL HA H 9.580 4.453 5.748 1.00 . A A . 1 VAL HA 1 1 3 914 1 1 1 VAL HB H 10.707 5.417 7.597 1.00 . A A . 1 VAL HB 1 1 3 915 1 1 1 VAL HG11 H 8.923 6.798 8.640 1.00 . A A . 1 VAL HG11 1 1 3 916 1 1 1 VAL HG12 H 8.144 5.316 9.240 1.00 . A A . 1 VAL HG12 1 1 3 917 1 1 1 VAL HG13 H 9.757 5.761 9.798 1.00 . A A . 1 VAL HG13 1 1 3 918 1 1 1 VAL HG21 H 9.074 3.044 8.586 1.00 . A A . 1 VAL HG21 1 1 3 919 1 1 1 VAL HG22 H 10.463 2.948 7.477 1.00 . A A . 1 VAL HG22 1 1 3 920 1 1 1 VAL HG23 H 10.681 3.546 9.131 1.00 . A A . 1 VAL HG23 1 1 3 921 1 1 1 VAL N N 8.704 6.330 5.987 1.00 . A A . 1 VAL N 1 1 3 922 1 1 1 VAL O O 6.754 4.608 7.309 1.00 . A A . 1 VAL O 1 1 3 923 1 1 2 GLY C C 5.725 2.521 4.115 1.00 . A A . 2 GLY C 1 1 3 924 1 1 2 GLY CA C 6.252 2.422 5.555 1.00 . A A . 2 GLY CA 1 1 3 925 1 1 2 GLY H H 8.276 3.040 5.103 1.00 . A A . 2 GLY H 1 1 3 926 1 1 2 GLY HA2 H 6.411 1.369 5.783 1.00 . A A . 2 GLY HA2 1 1 3 927 1 1 2 GLY HA3 H 5.479 2.798 6.225 1.00 . A A . 2 GLY HA3 1 1 3 928 1 1 2 GLY N N 7.508 3.150 5.770 1.00 . A A . 2 GLY N 1 1 3 929 1 1 2 GLY O O 4.562 2.226 3.861 1.00 . A A . 2 GLY O 1 1 3 930 1 1 3 GLU C C 6.794 1.885 0.986 1.00 . A A . 3 GLU C 1 1 3 931 1 1 3 GLU CA C 6.280 3.103 1.758 1.00 . A A . 3 GLU CA 1 1 3 932 1 1 3 GLU CB C 6.903 4.418 1.252 1.00 . A A . 3 GLU CB 1 1 3 933 1 1 3 GLU CD C 8.724 4.920 2.988 1.00 . A A . 3 GLU CD 1 1 3 934 1 1 3 GLU CG C 8.410 4.612 1.516 1.00 . A A . 3 GLU CG 1 1 3 935 1 1 3 GLU H H 7.533 3.106 3.430 1.00 . A A . 3 GLU H 1 1 3 936 1 1 3 GLU HA H 5.207 3.162 1.607 1.00 . A A . 3 GLU HA 1 1 3 937 1 1 3 GLU HB2 H 6.760 4.461 0.263 1.00 . A A . 3 GLU HB2 1 1 3 938 1 1 3 GLU HB3 H 6.418 5.173 1.693 1.00 . A A . 3 GLU HB3 1 1 3 939 1 1 3 GLU HG2 H 8.890 3.774 1.256 1.00 . A A . 3 GLU HG2 1 1 3 940 1 1 3 GLU HG3 H 8.737 5.372 0.954 1.00 . A A . 3 GLU HG3 1 1 3 941 1 1 3 GLU N N 6.564 2.953 3.175 1.00 . A A . 3 GLU N 1 1 3 942 1 1 3 GLU O O 7.804 1.285 1.351 1.00 . A A . 3 GLU O 1 1 3 943 1 1 3 GLU OE1 O 8.650 6.099 3.400 1.00 . A A . 3 GLU OE1 1 1 3 944 1 1 3 GLU OE2 O 8.951 3.957 3.763 1.00 . A A . 3 GLU OE2 1 1 3 945 1 1 4 CYS C C 7.794 0.173 -1.347 1.00 . A A . 4 CYS C 1 1 3 946 1 1 4 CYS CA C 6.407 0.207 -0.709 1.00 . A A . 4 CYS CA 1 1 3 947 1 1 4 CYS CB C 5.344 -0.168 -1.745 1.00 . A A . 4 CYS CB 1 1 3 948 1 1 4 CYS H H 5.248 1.972 -0.334 1.00 . A A . 4 CYS H 1 1 3 949 1 1 4 CYS HA H 6.398 -0.560 0.065 1.00 . A A . 4 CYS HA 1 1 3 950 1 1 4 CYS HB2 H 5.209 0.617 -2.350 1.00 . A A . 4 CYS HB2 1 1 3 951 1 1 4 CYS HB3 H 5.687 -0.943 -2.275 1.00 . A A . 4 CYS HB3 1 1 3 952 1 1 4 CYS N N 6.100 1.482 -0.081 1.00 . A A . 4 CYS N 1 1 3 953 1 1 4 CYS O O 8.349 1.171 -1.819 1.00 . A A . 4 CYS O 1 1 3 954 1 1 4 CYS SG S 3.736 -0.627 -1.053 1.00 . A A . 4 CYS SG 1 1 3 955 1 1 5 VAL C C 9.479 -1.507 -3.537 1.00 . A A . 5 VAL C 1 1 3 956 1 1 5 VAL CA C 9.597 -1.434 -2.018 1.00 . A A . 5 VAL CA 1 1 3 957 1 1 5 VAL CB C 10.053 -2.767 -1.398 1.00 . A A . 5 VAL CB 1 1 3 958 1 1 5 VAL CG1 C 11.507 -3.081 -1.763 1.00 . A A . 5 VAL CG1 1 1 3 959 1 1 5 VAL CG2 C 9.974 -2.713 0.133 1.00 . A A . 5 VAL CG2 1 1 3 960 1 1 5 VAL H H 7.672 -1.789 -1.171 1.00 . A A . 5 VAL H 1 1 3 961 1 1 5 VAL HA H 10.332 -0.670 -1.764 1.00 . A A . 5 VAL HA 1 1 3 962 1 1 5 VAL HB H 9.397 -3.569 -1.738 1.00 . A A . 5 VAL HB 1 1 3 963 1 1 5 VAL HG11 H 12.163 -2.292 -1.397 1.00 . A A . 5 VAL HG11 1 1 3 964 1 1 5 VAL HG12 H 11.800 -4.024 -1.300 1.00 . A A . 5 VAL HG12 1 1 3 965 1 1 5 VAL HG13 H 11.632 -3.179 -2.839 1.00 . A A . 5 VAL HG13 1 1 3 966 1 1 5 VAL HG21 H 8.940 -2.621 0.466 1.00 . A A . 5 VAL HG21 1 1 3 967 1 1 5 VAL HG22 H 10.382 -3.632 0.555 1.00 . A A . 5 VAL HG22 1 1 3 968 1 1 5 VAL HG23 H 10.547 -1.864 0.509 1.00 . A A . 5 VAL HG23 1 1 3 969 1 1 5 VAL N N 8.298 -1.050 -1.471 1.00 . A A . 5 VAL N 1 1 3 970 1 1 5 VAL O O 9.609 -2.562 -4.156 1.00 . A A . 5 VAL O 1 1 3 971 1 1 6 ARG C C 7.622 -1.188 -5.866 1.00 . A A . 6 ARG C 1 1 3 972 1 1 6 ARG CA C 8.785 -0.245 -5.558 1.00 . A A . 6 ARG CA 1 1 3 973 1 1 6 ARG CB C 10.015 -0.467 -6.459 1.00 . A A . 6 ARG CB 1 1 3 974 1 1 6 ARG CD C 11.123 1.822 -5.904 1.00 . A A . 6 ARG CD 1 1 3 975 1 1 6 ARG CG C 11.283 0.294 -6.030 1.00 . A A . 6 ARG CG 1 1 3 976 1 1 6 ARG CZ C 10.496 2.375 -3.569 1.00 . A A . 6 ARG CZ 1 1 3 977 1 1 6 ARG H H 8.896 0.398 -3.515 1.00 . A A . 6 ARG H 1 1 3 978 1 1 6 ARG HA H 8.418 0.763 -5.745 1.00 . A A . 6 ARG HA 1 1 3 979 1 1 6 ARG HB2 H 10.226 -1.445 -6.460 1.00 . A A . 6 ARG HB2 1 1 3 980 1 1 6 ARG HB3 H 9.777 -0.175 -7.386 1.00 . A A . 6 ARG HB3 1 1 3 981 1 1 6 ARG HD2 H 11.761 2.270 -6.531 1.00 . A A . 6 ARG HD2 1 1 3 982 1 1 6 ARG HD3 H 10.186 2.073 -6.146 1.00 . A A . 6 ARG HD3 1 1 3 983 1 1 6 ARG HE H 12.365 2.248 -4.233 1.00 . A A . 6 ARG HE 1 1 3 984 1 1 6 ARG HG2 H 11.570 -0.061 -5.140 1.00 . A A . 6 ARG HG2 1 1 3 985 1 1 6 ARG HG3 H 11.996 0.113 -6.707 1.00 . A A . 6 ARG HG3 1 1 3 986 1 1 6 ARG HH11 H 8.943 2.776 -4.774 1.00 . A A . 6 ARG HH11 1 1 3 987 1 1 6 ARG HH12 H 8.579 2.712 -3.082 1.00 . A A . 6 ARG HH12 1 1 3 988 1 1 6 ARG HH21 H 11.729 1.876 -2.067 1.00 . A A . 6 ARG HH21 1 1 3 989 1 1 6 ARG HH22 H 10.095 2.222 -1.609 1.00 . A A . 6 ARG HH22 1 1 3 990 1 1 6 ARG N N 9.121 -0.370 -4.138 1.00 . A A . 6 ARG N 1 1 3 991 1 1 6 ARG NE N 11.403 2.274 -4.528 1.00 . A A . 6 ARG NE 1 1 3 992 1 1 6 ARG NH1 N 9.240 2.642 -3.829 1.00 . A A . 6 ARG NH1 1 1 3 993 1 1 6 ARG NH2 N 10.797 2.139 -2.316 1.00 . A A . 6 ARG NH2 1 1 3 994 1 1 6 ARG O O 7.736 -2.146 -6.625 1.00 . A A . 6 ARG O 1 1 3 995 1 1 7 GLY C C 4.978 -2.908 -4.677 1.00 . A A . 7 GLY C 1 1 3 996 1 1 7 GLY CA C 5.225 -1.601 -5.438 1.00 . A A . 7 GLY CA 1 1 3 997 1 1 7 GLY H H 6.556 -0.180 -4.518 1.00 . A A . 7 GLY H 1 1 3 998 1 1 7 GLY HA2 H 4.420 -0.912 -5.182 1.00 . A A . 7 GLY HA2 1 1 3 999 1 1 7 GLY HA3 H 5.142 -1.817 -6.504 1.00 . A A . 7 GLY HA3 1 1 3 1000 1 1 7 GLY N N 6.508 -0.944 -5.177 1.00 . A A . 7 GLY N 1 1 3 1001 1 1 7 GLY O O 3.908 -3.490 -4.825 1.00 . A A . 7 GLY O 1 1 3 1002 1 1 8 ARG C C 5.925 -4.135 -1.535 1.00 . A A . 8 ARG C 1 1 3 1003 1 1 8 ARG CA C 5.754 -4.553 -2.999 1.00 . A A . 8 ARG CA 1 1 3 1004 1 1 8 ARG CB C 6.804 -5.606 -3.377 1.00 . A A . 8 ARG CB 1 1 3 1005 1 1 8 ARG CD C 6.625 -5.620 -5.976 1.00 . A A . 8 ARG CD 1 1 3 1006 1 1 8 ARG CG C 6.492 -6.401 -4.658 1.00 . A A . 8 ARG CG 1 1 3 1007 1 1 8 ARG CZ C 9.112 -5.357 -6.127 1.00 . A A . 8 ARG CZ 1 1 3 1008 1 1 8 ARG H H 6.814 -2.912 -3.791 1.00 . A A . 8 ARG H 1 1 3 1009 1 1 8 ARG HA H 4.752 -4.970 -3.116 1.00 . A A . 8 ARG HA 1 1 3 1010 1 1 8 ARG HB2 H 7.679 -5.140 -3.506 1.00 . A A . 8 ARG HB2 1 1 3 1011 1 1 8 ARG HB3 H 6.880 -6.255 -2.620 1.00 . A A . 8 ARG HB3 1 1 3 1012 1 1 8 ARG HD2 H 6.588 -6.268 -6.737 1.00 . A A . 8 ARG HD2 1 1 3 1013 1 1 8 ARG HD3 H 5.861 -4.978 -6.046 1.00 . A A . 8 ARG HD3 1 1 3 1014 1 1 8 ARG HE H 7.823 -3.852 -6.138 1.00 . A A . 8 ARG HE 1 1 3 1015 1 1 8 ARG HG2 H 7.119 -7.179 -4.697 1.00 . A A . 8 ARG HG2 1 1 3 1016 1 1 8 ARG HG3 H 5.551 -6.734 -4.592 1.00 . A A . 8 ARG HG3 1 1 3 1017 1 1 8 ARG HH11 H 8.561 -7.239 -6.562 1.00 . A A . 8 ARG HH11 1 1 3 1018 1 1 8 ARG HH12 H 10.268 -6.969 -6.441 1.00 . A A . 8 ARG HH12 1 1 3 1019 1 1 8 ARG HH21 H 10.000 -3.612 -5.690 1.00 . A A . 8 ARG HH21 1 1 3 1020 1 1 8 ARG HH22 H 11.068 -4.949 -5.956 1.00 . A A . 8 ARG HH22 1 1 3 1021 1 1 8 ARG N N 5.931 -3.390 -3.870 1.00 . A A . 8 ARG N 1 1 3 1022 1 1 8 ARG NE N 7.886 -4.863 -6.062 1.00 . A A . 8 ARG NE 1 1 3 1023 1 1 8 ARG NH1 N 9.331 -6.622 -6.398 1.00 . A A . 8 ARG NH1 1 1 3 1024 1 1 8 ARG NH2 N 10.141 -4.578 -5.907 1.00 . A A . 8 ARG NH2 1 1 3 1025 1 1 8 ARG O O 6.492 -3.081 -1.266 1.00 . A A . 8 ARG O 1 1 3 1026 1 1 9 CYS C C 5.507 -6.097 1.573 1.00 . A A . 9 CYS C 1 1 3 1027 1 1 9 CYS CA C 5.743 -4.763 0.844 1.00 . A A . 9 CYS CA 1 1 3 1028 1 1 9 CYS CB C 4.851 -3.615 1.348 1.00 . A A . 9 CYS CB 1 1 3 1029 1 1 9 CYS H H 5.026 -5.822 -0.829 1.00 . A A . 9 CYS H 1 1 3 1030 1 1 9 CYS HA H 6.788 -4.480 0.976 1.00 . A A . 9 CYS HA 1 1 3 1031 1 1 9 CYS HB2 H 4.412 -3.191 0.556 1.00 . A A . 9 CYS HB2 1 1 3 1032 1 1 9 CYS HB3 H 4.152 -4.004 1.948 1.00 . A A . 9 CYS HB3 1 1 3 1033 1 1 9 CYS N N 5.498 -4.964 -0.584 1.00 . A A . 9 CYS N 1 1 3 1034 1 1 9 CYS O O 5.003 -7.032 0.949 1.00 . A A . 9 CYS O 1 1 3 1035 1 1 9 CYS SG S 5.731 -2.319 2.270 1.00 . A A . 9 CYS SG 1 1 3 1036 1 1 10 PRO C C 4.426 -7.766 4.129 1.00 . A A . 10 PRO C 1 1 3 1037 1 1 10 PRO CA C 5.826 -7.501 3.567 1.00 . A A . 10 PRO CA 1 1 3 1038 1 1 10 PRO CB C 6.883 -7.368 4.668 1.00 . A A . 10 PRO CB 1 1 3 1039 1 1 10 PRO CD C 6.489 -5.212 3.692 1.00 . A A . 10 PRO CD 1 1 3 1040 1 1 10 PRO CG C 6.803 -5.887 5.029 1.00 . A A . 10 PRO CG 1 1 3 1041 1 1 10 PRO HA H 6.093 -8.329 2.910 1.00 . A A . 10 PRO HA 1 1 3 1042 1 1 10 PRO HB2 H 6.659 -7.944 5.454 1.00 . A A . 10 PRO HB2 1 1 3 1043 1 1 10 PRO HB3 H 7.792 -7.608 4.327 1.00 . A A . 10 PRO HB3 1 1 3 1044 1 1 10 PRO HD2 H 5.851 -4.454 3.828 1.00 . A A . 10 PRO HD2 1 1 3 1045 1 1 10 PRO HD3 H 7.329 -4.870 3.271 1.00 . A A . 10 PRO HD3 1 1 3 1046 1 1 10 PRO HG2 H 6.075 -5.720 5.694 1.00 . A A . 10 PRO HG2 1 1 3 1047 1 1 10 PRO HG3 H 7.673 -5.561 5.398 1.00 . A A . 10 PRO HG3 1 1 3 1048 1 1 10 PRO N N 5.886 -6.233 2.854 1.00 . A A . 10 PRO N 1 1 3 1049 1 1 10 PRO O O 3.495 -6.987 3.935 1.00 . A A . 10 PRO O 1 1 3 1050 1 1 11 SER C C 1.763 -9.200 4.745 1.00 . A A . 11 SER C 1 1 3 1051 1 1 11 SER CA C 3.054 -9.277 5.560 1.00 . A A . 11 SER CA 1 1 3 1052 1 1 11 SER CB C 2.960 -8.430 6.823 1.00 . A A . 11 SER CB 1 1 3 1053 1 1 11 SER H H 5.091 -9.474 4.944 1.00 . A A . 11 SER H 1 1 3 1054 1 1 11 SER HA H 3.159 -10.324 5.821 1.00 . A A . 11 SER HA 1 1 3 1055 1 1 11 SER HB2 H 3.806 -8.525 7.348 1.00 . A A . 11 SER HB2 1 1 3 1056 1 1 11 SER HB3 H 2.831 -7.472 6.569 1.00 . A A . 11 SER HB3 1 1 3 1057 1 1 11 SER HG H 1.089 -8.862 7.043 1.00 . A A . 11 SER HG 1 1 3 1058 1 1 11 SER N N 4.271 -8.898 4.825 1.00 . A A . 11 SER N 1 1 3 1059 1 1 11 SER O O 0.672 -8.942 5.268 1.00 . A A . 11 SER O 1 1 3 1060 1 1 11 SER OG O 1.871 -8.852 7.615 1.00 . A A . 11 SER OG 1 1 3 1061 1 1 12 GLY C C 0.189 -7.891 2.514 1.00 . A A . 12 GLY C 1 1 3 1062 1 1 12 GLY CA C 0.904 -9.240 2.419 1.00 . A A . 12 GLY CA 1 1 3 1063 1 1 12 GLY H H 2.873 -9.655 3.211 1.00 . A A . 12 GLY H 1 1 3 1064 1 1 12 GLY HA2 H 1.370 -9.307 1.436 1.00 . A A . 12 GLY HA2 1 1 3 1065 1 1 12 GLY HA3 H 0.164 -10.035 2.504 1.00 . A A . 12 GLY HA3 1 1 3 1066 1 1 12 GLY N N 1.924 -9.413 3.446 1.00 . A A . 12 GLY N 1 1 3 1067 1 1 12 GLY O O -1.033 -7.844 2.379 1.00 . A A . 12 GLY O 1 1 3 1068 1 1 13 MET C C 0.181 -4.965 1.389 1.00 . A A . 13 MET C 1 1 3 1069 1 1 13 MET CA C 0.301 -5.479 2.828 1.00 . A A . 13 MET CA 1 1 3 1070 1 1 13 MET CB C 1.131 -4.510 3.675 1.00 . A A . 13 MET CB 1 1 3 1071 1 1 13 MET CE C 0.286 -5.426 7.685 1.00 . A A . 13 MET CE 1 1 3 1072 1 1 13 MET CG C 1.237 -4.937 5.143 1.00 . A A . 13 MET CG 1 1 3 1073 1 1 13 MET H H 1.896 -6.902 3.035 1.00 . A A . 13 MET H 1 1 3 1074 1 1 13 MET HA H -0.704 -5.529 3.246 1.00 . A A . 13 MET HA 1 1 3 1075 1 1 13 MET HB2 H 2.053 -4.460 3.290 1.00 . A A . 13 MET HB2 1 1 3 1076 1 1 13 MET HB3 H 0.704 -3.607 3.636 1.00 . A A . 13 MET HB3 1 1 3 1077 1 1 13 MET HE1 H 0.863 -6.351 7.665 1.00 . A A . 13 MET HE1 1 1 3 1078 1 1 13 MET HE2 H 0.925 -4.609 8.023 1.00 . A A . 13 MET HE2 1 1 3 1079 1 1 13 MET HE3 H -0.550 -5.537 8.374 1.00 . A A . 13 MET HE3 1 1 3 1080 1 1 13 MET HG2 H 1.679 -5.833 5.173 1.00 . A A . 13 MET HG2 1 1 3 1081 1 1 13 MET HG3 H 1.807 -4.267 5.620 1.00 . A A . 13 MET HG3 1 1 3 1082 1 1 13 MET N N 0.900 -6.812 2.849 1.00 . A A . 13 MET N 1 1 3 1083 1 1 13 MET O O 0.810 -5.482 0.469 1.00 . A A . 13 MET O 1 1 3 1084 1 1 13 MET SD S -0.340 -5.060 6.025 1.00 . A A . 13 MET SD 1 1 3 1085 1 1 14 CYS C C -0.423 -1.868 -0.124 1.00 . A A . 14 CYS C 1 1 3 1086 1 1 14 CYS CA C -0.908 -3.321 -0.090 1.00 . A A . 14 CYS CA 1 1 3 1087 1 1 14 CYS CB C -2.424 -3.343 -0.307 1.00 . A A . 14 CYS CB 1 1 3 1088 1 1 14 CYS H H -1.080 -3.515 2.009 1.00 . A A . 14 CYS H 1 1 3 1089 1 1 14 CYS HA H -0.420 -3.888 -0.885 1.00 . A A . 14 CYS HA 1 1 3 1090 1 1 14 CYS HB2 H -2.819 -2.617 0.256 1.00 . A A . 14 CYS HB2 1 1 3 1091 1 1 14 CYS HB3 H -2.593 -3.145 -1.273 1.00 . A A . 14 CYS HB3 1 1 3 1092 1 1 14 CYS N N -0.617 -3.917 1.204 1.00 . A A . 14 CYS N 1 1 3 1093 1 1 14 CYS O O -0.370 -1.217 0.921 1.00 . A A . 14 CYS O 1 1 3 1094 1 1 14 CYS SG S -3.297 -4.884 0.096 1.00 . A A . 14 CYS SG 1 1 3 1095 1 1 15 CYS C C -0.755 0.996 -1.754 1.00 . A A . 15 CYS C 1 1 3 1096 1 1 15 CYS CA C 0.385 -0.005 -1.534 1.00 . A A . 15 CYS CA 1 1 3 1097 1 1 15 CYS CB C 1.312 -0.029 -2.755 1.00 . A A . 15 CYS CB 1 1 3 1098 1 1 15 CYS H H -0.171 -1.949 -2.133 1.00 . A A . 15 CYS H 1 1 3 1099 1 1 15 CYS HA H 0.968 0.298 -0.666 1.00 . A A . 15 CYS HA 1 1 3 1100 1 1 15 CYS HB2 H 0.762 -0.234 -3.564 1.00 . A A . 15 CYS HB2 1 1 3 1101 1 1 15 CYS HB3 H 1.727 0.876 -2.854 1.00 . A A . 15 CYS HB3 1 1 3 1102 1 1 15 CYS N N -0.126 -1.354 -1.322 1.00 . A A . 15 CYS N 1 1 3 1103 1 1 15 CYS O O -1.579 0.808 -2.651 1.00 . A A . 15 CYS O 1 1 3 1104 1 1 15 CYS SG S 2.639 -1.256 -2.641 1.00 . A A . 15 CYS SG 1 1 3 1105 1 1 16 SER C C -1.640 4.131 -2.047 1.00 . A A . 16 SER C 1 1 3 1106 1 1 16 SER CA C -1.847 3.077 -0.967 1.00 . A A . 16 SER CA 1 1 3 1107 1 1 16 SER CB C -1.854 3.787 0.382 1.00 . A A . 16 SER CB 1 1 3 1108 1 1 16 SER H H -0.100 2.134 -0.223 1.00 . A A . 16 SER H 1 1 3 1109 1 1 16 SER HA H -2.810 2.590 -1.117 1.00 . A A . 16 SER HA 1 1 3 1110 1 1 16 SER HB2 H -2.725 4.264 0.499 1.00 . A A . 16 SER HB2 1 1 3 1111 1 1 16 SER HB3 H -1.742 3.111 1.111 1.00 . A A . 16 SER HB3 1 1 3 1112 1 1 16 SER HG H -0.870 5.105 1.345 1.00 . A A . 16 SER HG 1 1 3 1113 1 1 16 SER N N -0.798 2.062 -0.954 1.00 . A A . 16 SER N 1 1 3 1114 1 1 16 SER O O -0.665 4.109 -2.796 1.00 . A A . 16 SER O 1 1 3 1115 1 1 16 SER OG O -0.796 4.725 0.449 1.00 . A A . 16 SER OG 1 1 3 1116 1 1 17 GLN C C -1.215 7.268 -2.367 1.00 . A A . 17 GLN C 1 1 3 1117 1 1 17 GLN CA C -2.305 6.320 -2.895 1.00 . A A . 17 GLN CA 1 1 3 1118 1 1 17 GLN CB C -3.641 7.020 -3.135 1.00 . A A . 17 GLN CB 1 1 3 1119 1 1 17 GLN CD C -5.523 8.332 -2.106 1.00 . A A . 17 GLN CD 1 1 3 1120 1 1 17 GLN CG C -4.179 7.660 -1.859 1.00 . A A . 17 GLN CG 1 1 3 1121 1 1 17 GLN H H -3.297 5.146 -1.440 1.00 . A A . 17 GLN H 1 1 3 1122 1 1 17 GLN HA H -1.959 5.972 -3.856 1.00 . A A . 17 GLN HA 1 1 3 1123 1 1 17 GLN HB2 H -3.514 7.732 -3.826 1.00 . A A . 17 GLN HB2 1 1 3 1124 1 1 17 GLN HB3 H -4.304 6.348 -3.465 1.00 . A A . 17 GLN HB3 1 1 3 1125 1 1 17 GLN HE21 H -4.690 9.897 -3.097 1.00 . A A . 17 GLN HE21 1 1 3 1126 1 1 17 GLN HE22 H -6.449 9.869 -2.937 1.00 . A A . 17 GLN HE22 1 1 3 1127 1 1 17 GLN HG2 H -4.291 6.952 -1.161 1.00 . A A . 17 GLN HG2 1 1 3 1128 1 1 17 GLN HG3 H -3.526 8.345 -1.537 1.00 . A A . 17 GLN HG3 1 1 3 1129 1 1 17 GLN N N -2.510 5.143 -2.068 1.00 . A A . 17 GLN N 1 1 3 1130 1 1 17 GLN NE2 N -5.541 9.473 -2.767 1.00 . A A . 17 GLN NE2 1 1 3 1131 1 1 17 GLN O O -0.889 8.244 -3.032 1.00 . A A . 17 GLN O 1 1 3 1132 1 1 17 GLN OE1 O -6.570 7.831 -1.722 1.00 . A A . 17 GLN OE1 1 1 3 1133 1 1 18 . C C 1.819 6.555 -1.086 1.00 . A A . 18 PFF C 1 1 3 1134 1 1 18 . CA C 0.670 7.538 -0.793 1.00 . A A . 18 PFF CA 1 1 3 1135 1 1 18 . CB C 0.613 7.956 0.695 1.00 . A A . 18 PFF CB 1 1 3 1136 1 1 18 . CD1 C 1.046 10.189 1.816 1.00 . A A . 18 PFF CD1 1 1 3 1137 1 1 18 . CD2 C -0.637 10.076 0.064 1.00 . A A . 18 PFF CD2 1 1 3 1138 1 1 18 . CE1 C 0.927 11.591 1.838 1.00 . A A . 18 PFF CE1 1 1 3 1139 1 1 18 . CE2 C -0.740 11.477 0.071 1.00 . A A . 18 PFF CE2 1 1 3 1140 1 1 18 . CG C 0.278 9.425 0.915 1.00 . A A . 18 PFF CG 1 1 3 1141 1 1 18 . CZ C 0.040 12.236 0.959 1.00 . A A . 18 PFF CZ 1 1 3 1142 1 1 18 . F F -0.060 13.591 0.957 1.00 . A A . 18 PFF F 1 1 3 1143 1 1 18 . H H -0.945 6.167 -0.679 1.00 . A A . 18 PFF H 1 1 3 1144 1 1 18 . HA H 0.888 8.428 -1.385 1.00 . A A . 18 PFF HA 1 1 3 1145 1 1 18 . HB2 H -0.074 7.321 1.259 1.00 . A A . 18 PFF HB2 1 1 3 1146 1 1 18 . HB3 H 1.595 7.800 1.137 1.00 . A A . 18 PFF HB3 1 1 3 1147 1 1 18 . HD1 H 1.744 9.703 2.482 1.00 . A A . 18 PFF HD1 1 1 3 1148 1 1 18 . HD2 H -1.228 9.513 -0.640 1.00 . A A . 18 PFF HD2 1 1 3 1149 1 1 18 . HE1 H 1.517 12.173 2.532 1.00 . A A . 18 PFF HE1 1 1 3 1150 1 1 18 . HE2 H -1.413 11.974 -0.612 1.00 . A A . 18 PFF HE2 1 1 3 1151 1 1 18 . N N -0.618 6.971 -1.207 1.00 . A A . 18 PFF N 1 1 3 1152 1 1 18 . O O 2.947 6.770 -0.650 1.00 . A A . 18 PFF O 1 1 3 1153 1 1 19 GLY C C 2.759 3.627 -0.616 1.00 . A A . 19 GLY C 1 1 3 1154 1 1 19 GLY CA C 2.511 4.359 -1.934 1.00 . A A . 19 GLY CA 1 1 3 1155 1 1 19 GLY H H 0.623 5.293 -2.175 1.00 . A A . 19 GLY H 1 1 3 1156 1 1 19 GLY HA2 H 2.137 3.642 -2.665 1.00 . A A . 19 GLY HA2 1 1 3 1157 1 1 19 GLY HA3 H 3.461 4.759 -2.290 1.00 . A A . 19 GLY HA3 1 1 3 1158 1 1 19 GLY N N 1.549 5.445 -1.788 1.00 . A A . 19 GLY N 1 1 3 1159 1 1 19 GLY O O 3.751 2.917 -0.487 1.00 . A A . 19 GLY O 1 1 3 1160 1 1 20 . C C 1.570 1.967 1.986 1.00 . A A . 20 PFF C 1 1 3 1161 1 1 20 . CA C 2.137 3.367 1.745 1.00 . A A . 20 PFF CA 1 1 3 1162 1 1 20 . CB C 1.575 4.411 2.719 1.00 . A A . 20 PFF CB 1 1 3 1163 1 1 20 . CD1 C 2.967 4.669 4.804 1.00 . A A . 20 PFF CD1 1 1 3 1164 1 1 20 . CD2 C 3.459 6.083 2.891 1.00 . A A . 20 PFF CD2 1 1 3 1165 1 1 20 . CE1 C 4.039 5.247 5.509 1.00 . A A . 20 PFF CE1 1 1 3 1166 1 1 20 . CE2 C 4.520 6.672 3.597 1.00 . A A . 20 PFF CE2 1 1 3 1167 1 1 20 . CG C 2.655 5.110 3.509 1.00 . A A . 20 PFF CG 1 1 3 1168 1 1 20 . CZ C 4.801 6.266 4.912 1.00 . A A . 20 PFF CZ 1 1 3 1169 1 1 20 . F F 5.790 6.883 5.610 1.00 . A A . 20 PFF F 1 1 3 1170 1 1 20 . H H 1.018 4.311 0.193 1.00 . A A . 20 PFF H 1 1 3 1171 1 1 20 . HA H 3.210 3.307 1.906 1.00 . A A . 20 PFF HA 1 1 3 1172 1 1 20 . HB2 H 1.030 5.184 2.181 1.00 . A A . 20 PFF HB2 1 1 3 1173 1 1 20 . HB3 H 0.876 3.938 3.402 1.00 . A A . 20 PFF HB3 1 1 3 1174 1 1 20 . HD1 H 2.353 3.909 5.258 1.00 . A A . 20 PFF HD1 1 1 3 1175 1 1 20 . HD2 H 3.285 6.358 1.861 1.00 . A A . 20 PFF HD2 1 1 3 1176 1 1 20 . HE1 H 4.251 4.938 6.522 1.00 . A A . 20 PFF HE1 1 1 3 1177 1 1 20 . HE2 H 5.131 7.427 3.124 1.00 . A A . 20 PFF HE2 1 1 3 1178 1 1 20 . N N 1.889 3.820 0.380 1.00 . A A . 20 PFF N 1 1 3 1179 1 1 20 . O O 0.596 1.581 1.346 1.00 . A A . 20 PFF O 1 1 3 1180 1 1 21 CYS C C 0.889 -0.522 4.142 1.00 . A A . 21 CYS C 1 1 3 1181 1 1 21 CYS CA C 1.917 -0.223 3.052 1.00 . A A . 21 CYS CA 1 1 3 1182 1 1 21 CYS CB C 3.231 -0.938 3.383 1.00 . A A . 21 CYS CB 1 1 3 1183 1 1 21 CYS H H 2.975 1.593 3.387 1.00 . A A . 21 CYS H 1 1 3 1184 1 1 21 CYS HA H 1.558 -0.623 2.106 1.00 . A A . 21 CYS HA 1 1 3 1185 1 1 21 CYS HB2 H 3.565 -0.595 4.261 1.00 . A A . 21 CYS HB2 1 1 3 1186 1 1 21 CYS HB3 H 3.048 -1.918 3.455 1.00 . A A . 21 CYS HB3 1 1 3 1187 1 1 21 CYS N N 2.173 1.206 2.899 1.00 . A A . 21 CYS N 1 1 3 1188 1 1 21 CYS O O 1.181 -0.342 5.322 1.00 . A A . 21 CYS O 1 1 3 1189 1 1 21 CYS SG S 4.521 -0.688 2.146 1.00 . A A . 21 CYS SG 1 1 3 1190 1 1 22 GLY C C -2.240 -2.525 4.232 1.00 . A A . 22 GLY C 1 1 3 1191 1 1 22 GLY CA C -1.175 -1.601 4.808 1.00 . A A . 22 GLY CA 1 1 3 1192 1 1 22 GLY H H -0.541 -1.139 2.801 1.00 . A A . 22 GLY H 1 1 3 1193 1 1 22 GLY HA2 H -0.588 -2.165 5.532 1.00 . A A . 22 GLY HA2 1 1 3 1194 1 1 22 GLY HA3 H -1.660 -0.782 5.337 1.00 . A A . 22 GLY HA3 1 1 3 1195 1 1 22 GLY N N -0.283 -1.057 3.787 1.00 . A A . 22 GLY N 1 1 3 1196 1 1 22 GLY O O -2.311 -2.734 3.022 1.00 . A A . 22 GLY O 1 1 3 1197 1 1 23 LYS C C -5.506 -2.956 4.792 1.00 . A A . 23 LYS C 1 1 3 1198 1 1 23 LYS CA C -4.268 -3.851 4.706 1.00 . A A . 23 LYS CA 1 1 3 1199 1 1 23 LYS CB C -4.390 -5.091 5.607 1.00 . A A . 23 LYS CB 1 1 3 1200 1 1 23 LYS CD C -3.466 -7.382 6.074 1.00 . A A . 23 LYS CD 1 1 3 1201 1 1 23 LYS CE C -3.190 -8.763 5.468 1.00 . A A . 23 LYS CE 1 1 3 1202 1 1 23 LYS CG C -3.647 -6.294 5.009 1.00 . A A . 23 LYS CG 1 1 3 1203 1 1 23 LYS H H -2.974 -2.845 6.074 1.00 . A A . 23 LYS H 1 1 3 1204 1 1 23 LYS HA H -4.173 -4.171 3.667 1.00 . A A . 23 LYS HA 1 1 3 1205 1 1 23 LYS HB2 H -4.000 -4.881 6.504 1.00 . A A . 23 LYS HB2 1 1 3 1206 1 1 23 LYS HB3 H -5.357 -5.324 5.710 1.00 . A A . 23 LYS HB3 1 1 3 1207 1 1 23 LYS HD2 H -2.696 -7.130 6.661 1.00 . A A . 23 LYS HD2 1 1 3 1208 1 1 23 LYS HD3 H -4.300 -7.434 6.623 1.00 . A A . 23 LYS HD3 1 1 3 1209 1 1 23 LYS HE2 H -3.119 -9.429 6.211 1.00 . A A . 23 LYS HE2 1 1 3 1210 1 1 23 LYS HE3 H -3.955 -9.008 4.872 1.00 . A A . 23 LYS HE3 1 1 3 1211 1 1 23 LYS HG2 H -4.176 -6.663 4.245 1.00 . A A . 23 LYS HG2 1 1 3 1212 1 1 23 LYS HG3 H -2.749 -5.999 4.681 1.00 . A A . 23 LYS HG3 1 1 3 1213 1 1 23 LYS HZ1 H -1.963 -8.164 3.885 1.00 . A A . 23 LYS HZ1 1 1 3 1214 1 1 23 LYS HZ2 H -1.111 -8.592 5.225 1.00 . A A . 23 LYS HZ2 1 1 3 1215 1 1 23 LYS HZ3 H -1.796 -9.728 4.290 1.00 . A A . 23 LYS HZ3 1 1 3 1216 1 1 23 LYS N N -3.081 -3.087 5.099 1.00 . A A . 23 LYS N 1 1 3 1217 1 1 23 LYS NZ N -1.942 -8.807 4.675 1.00 . A A . 23 LYS NZ 1 1 3 1218 1 1 23 LYS O O -5.451 -1.848 5.317 1.00 . A A . 23 LYS O 1 1 3 1219 1 1 24 GLY C C -8.005 -1.576 3.335 1.00 . A A . 24 GLY C 1 1 3 1220 1 1 24 GLY CA C -7.898 -2.711 4.361 1.00 . A A . 24 GLY CA 1 1 3 1221 1 1 24 GLY H H -6.622 -4.358 3.866 1.00 . A A . 24 GLY H 1 1 3 1222 1 1 24 GLY HA2 H -8.714 -3.412 4.187 1.00 . A A . 24 GLY HA2 1 1 3 1223 1 1 24 GLY HA3 H -8.011 -2.289 5.361 1.00 . A A . 24 GLY HA3 1 1 3 1224 1 1 24 GLY N N -6.639 -3.446 4.293 1.00 . A A . 24 GLY N 1 1 3 1225 1 1 24 GLY O O -7.106 -1.372 2.511 1.00 . A A . 24 GLY O 1 1 3 1226 1 1 25 PRO C C -8.485 1.019 1.806 1.00 . A A . 25 PRO C 1 1 3 1227 1 1 25 PRO CA C -9.568 0.075 2.326 1.00 . A A . 25 PRO CA 1 1 3 1228 1 1 25 PRO CB C -10.789 0.800 2.902 1.00 . A A . 25 PRO CB 1 1 3 1229 1 1 25 PRO CD C -10.191 -0.998 4.357 1.00 . A A . 25 PRO CD 1 1 3 1230 1 1 25 PRO CG C -11.412 -0.285 3.778 1.00 . A A . 25 PRO CG 1 1 3 1231 1 1 25 PRO HA H -9.907 -0.526 1.480 1.00 . A A . 25 PRO HA 1 1 3 1232 1 1 25 PRO HB2 H -10.518 1.595 3.445 1.00 . A A . 25 PRO HB2 1 1 3 1233 1 1 25 PRO HB3 H -11.416 1.088 2.178 1.00 . A A . 25 PRO HB3 1 1 3 1234 1 1 25 PRO HD2 H -9.919 -0.575 5.221 1.00 . A A . 25 PRO HD2 1 1 3 1235 1 1 25 PRO HD3 H -10.392 -1.966 4.508 1.00 . A A . 25 PRO HD3 1 1 3 1236 1 1 25 PRO HG2 H -11.972 0.116 4.503 1.00 . A A . 25 PRO HG2 1 1 3 1237 1 1 25 PRO HG3 H -11.969 -0.911 3.233 1.00 . A A . 25 PRO HG3 1 1 3 1238 1 1 25 PRO N N -9.135 -0.849 3.365 1.00 . A A . 25 PRO N 1 1 3 1239 1 1 25 PRO O O -8.020 0.836 0.683 1.00 . A A . 25 PRO O 1 1 3 1240 1 1 26 LYS C C -5.868 2.658 1.546 1.00 . A A . 26 LYS C 1 1 3 1241 1 1 26 LYS CA C -7.227 3.117 2.074 1.00 . A A . 26 LYS CA 1 1 3 1242 1 1 26 LYS CB C -7.001 4.151 3.182 1.00 . A A . 26 LYS CB 1 1 3 1243 1 1 26 LYS CD C -8.170 6.368 2.818 1.00 . A A . 26 LYS CD 1 1 3 1244 1 1 26 LYS CE C -8.099 6.227 1.295 1.00 . A A . 26 LYS CE 1 1 3 1245 1 1 26 LYS CG C -8.247 4.993 3.500 1.00 . A A . 26 LYS CG 1 1 3 1246 1 1 26 LYS H H -8.450 2.121 3.511 1.00 . A A . 26 LYS H 1 1 3 1247 1 1 26 LYS HA H -7.743 3.583 1.238 1.00 . A A . 26 LYS HA 1 1 3 1248 1 1 26 LYS HB2 H -6.725 3.668 4.013 1.00 . A A . 26 LYS HB2 1 1 3 1249 1 1 26 LYS HB3 H -6.268 4.767 2.895 1.00 . A A . 26 LYS HB3 1 1 3 1250 1 1 26 LYS HD2 H -8.983 6.898 3.059 1.00 . A A . 26 LYS HD2 1 1 3 1251 1 1 26 LYS HD3 H -7.353 6.846 3.140 1.00 . A A . 26 LYS HD3 1 1 3 1252 1 1 26 LYS HE2 H -7.445 5.505 1.069 1.00 . A A . 26 LYS HE2 1 1 3 1253 1 1 26 LYS HE3 H -9.004 5.976 0.953 1.00 . A A . 26 LYS HE3 1 1 3 1254 1 1 26 LYS HG2 H -9.060 4.511 3.173 1.00 . A A . 26 LYS HG2 1 1 3 1255 1 1 26 LYS HG3 H -8.311 5.122 4.490 1.00 . A A . 26 LYS HG3 1 1 3 1256 1 1 26 LYS HZ1 H -6.734 7.739 0.923 1.00 . A A . 26 LYS HZ1 1 1 3 1257 1 1 26 LYS HZ2 H -7.621 7.362 -0.374 1.00 . A A . 26 LYS HZ2 1 1 3 1258 1 1 26 LYS HZ3 H -8.291 8.263 0.827 1.00 . A A . 26 LYS HZ3 1 1 3 1259 1 1 26 LYS N N -8.069 2.029 2.581 1.00 . A A . 26 LYS N 1 1 3 1260 1 1 26 LYS NZ N -7.673 7.477 0.638 1.00 . A A . 26 LYS NZ 1 1 3 1261 1 1 26 LYS O O -5.301 3.318 0.678 1.00 . A A . 26 LYS O 1 1 3 1262 1 1 27 TYR C C -4.313 0.096 0.347 1.00 . A A . 27 TYR C 1 1 3 1263 1 1 27 TYR CA C -4.094 0.989 1.560 1.00 . A A . 27 TYR CA 1 1 3 1264 1 1 27 TYR CB C -3.429 0.184 2.672 1.00 . A A . 27 TYR CB 1 1 3 1265 1 1 27 TYR CD1 C -1.803 1.747 3.798 1.00 . A A . 27 TYR CD1 1 1 3 1266 1 1 27 TYR CD2 C -3.723 0.991 5.077 1.00 . A A . 27 TYR CD2 1 1 3 1267 1 1 27 TYR CE1 C -1.300 2.409 4.933 1.00 . A A . 27 TYR CE1 1 1 3 1268 1 1 27 TYR CE2 C -3.250 1.708 6.196 1.00 . A A . 27 TYR CE2 1 1 3 1269 1 1 27 TYR CG C -2.995 1.008 3.872 1.00 . A A . 27 TYR CG 1 1 3 1270 1 1 27 TYR CZ C -2.045 2.428 6.117 1.00 . A A . 27 TYR CZ 1 1 3 1271 1 1 27 TYR H H -5.872 1.038 2.748 1.00 . A A . 27 TYR H 1 1 3 1272 1 1 27 TYR HA H -3.425 1.794 1.266 1.00 . A A . 27 TYR HA 1 1 3 1273 1 1 27 TYR HB2 H -4.078 -0.509 2.987 1.00 . A A . 27 TYR HB2 1 1 3 1274 1 1 27 TYR HB3 H -2.620 -0.265 2.292 1.00 . A A . 27 TYR HB3 1 1 3 1275 1 1 27 TYR HD1 H -1.268 1.778 2.867 1.00 . A A . 27 TYR HD1 1 1 3 1276 1 1 27 TYR HD2 H -4.637 0.419 5.152 1.00 . A A . 27 TYR HD2 1 1 3 1277 1 1 27 TYR HE1 H -0.358 2.930 4.899 1.00 . A A . 27 TYR HE1 1 1 3 1278 1 1 27 TYR HE2 H -3.806 1.724 7.120 1.00 . A A . 27 TYR HE2 1 1 3 1279 1 1 27 TYR HH H -0.866 3.753 6.944 1.00 . A A . 27 TYR HH 1 1 3 1280 1 1 27 TYR N N -5.352 1.538 2.042 1.00 . A A . 27 TYR N 1 1 3 1281 1 1 27 TYR O O -3.579 0.175 -0.637 1.00 . A A . 27 TYR O 1 1 3 1282 1 1 27 TYR OH O -1.675 3.254 7.134 1.00 . A A . 27 TYR OH 1 1 3 1283 1 1 28 CYS C C -6.392 -1.558 -1.689 1.00 . A A . 28 CYS C 1 1 3 1284 1 1 28 CYS CA C -5.423 -1.859 -0.542 1.00 . A A . 28 CYS CA 1 1 3 1285 1 1 28 CYS CB C -5.763 -3.127 0.234 1.00 . A A . 28 CYS CB 1 1 3 1286 1 1 28 CYS H H -5.895 -0.819 1.250 1.00 . A A . 28 CYS H 1 1 3 1287 1 1 28 CYS HA H -4.453 -2.010 -1.005 1.00 . A A . 28 CYS HA 1 1 3 1288 1 1 28 CYS HB2 H -5.324 -3.084 1.132 1.00 . A A . 28 CYS HB2 1 1 3 1289 1 1 28 CYS HB3 H -6.755 -3.179 0.350 1.00 . A A . 28 CYS HB3 1 1 3 1290 1 1 28 CYS N N -5.317 -0.778 0.414 1.00 . A A . 28 CYS N 1 1 3 1291 1 1 28 CYS O O -6.084 -1.879 -2.839 1.00 . A A . 28 CYS O 1 1 3 1292 1 1 28 CYS SG S -5.196 -4.616 -0.623 1.00 . A A . 28 CYS SG 1 1 3 1293 1 1 29 GLY C C -8.305 1.104 -2.769 1.00 . A A . 29 GLY C 1 1 3 1294 1 1 29 GLY CA C -8.433 -0.390 -2.447 1.00 . A A . 29 GLY CA 1 1 3 1295 1 1 29 GLY H H -7.650 -0.554 -0.459 1.00 . A A . 29 GLY H 1 1 3 1296 1 1 29 GLY HA2 H -8.297 -0.956 -3.369 1.00 . A A . 29 GLY HA2 1 1 3 1297 1 1 29 GLY HA3 H -9.450 -0.571 -2.096 1.00 . A A . 29 GLY HA3 1 1 3 1298 1 1 29 GLY N N -7.492 -0.846 -1.420 1.00 . A A . 29 GLY N 1 1 3 1299 1 1 29 GLY O O -8.618 1.519 -3.882 1.00 . A A . 29 GLY O 1 1 3 1300 1 1 30 ARG C C -8.850 4.184 -1.930 1.00 . A A . 30 ARG C 1 1 3 1301 1 1 30 ARG CA C -7.569 3.356 -1.876 1.00 . A A . 30 ARG CA 1 1 3 1302 1 1 30 ARG CB C -6.629 3.725 -3.032 1.00 . A A . 30 ARG CB 1 1 3 1303 1 1 30 ARG CD C -4.469 2.893 -4.090 1.00 . A A . 30 ARG CD 1 1 3 1304 1 1 30 ARG CG C -5.254 3.101 -2.787 1.00 . A A . 30 ARG CG 1 1 3 1305 1 1 30 ARG CZ C -4.374 0.431 -3.990 1.00 . A A . 30 ARG CZ 1 1 3 1306 1 1 30 ARG H H -7.629 1.454 -0.929 1.00 . A A . 30 ARG H 1 1 3 1307 1 1 30 ARG HA H -7.067 3.631 -0.949 1.00 . A A . 30 ARG HA 1 1 3 1308 1 1 30 ARG HB2 H -7.005 3.378 -3.891 1.00 . A A . 30 ARG HB2 1 1 3 1309 1 1 30 ARG HB3 H -6.539 4.720 -3.085 1.00 . A A . 30 ARG HB3 1 1 3 1310 1 1 30 ARG HD2 H -5.102 2.897 -4.864 1.00 . A A . 30 ARG HD2 1 1 3 1311 1 1 30 ARG HD3 H -3.803 3.631 -4.199 1.00 . A A . 30 ARG HD3 1 1 3 1312 1 1 30 ARG HE H -2.803 1.586 -3.719 1.00 . A A . 30 ARG HE 1 1 3 1313 1 1 30 ARG HG2 H -4.729 3.705 -2.188 1.00 . A A . 30 ARG HG2 1 1 3 1314 1 1 30 ARG HG3 H -5.378 2.214 -2.341 1.00 . A A . 30 ARG HG3 1 1 3 1315 1 1 30 ARG HH11 H -6.133 1.016 -4.761 1.00 . A A . 30 ARG HH11 1 1 3 1316 1 1 30 ARG HH12 H -6.024 -0.660 -4.335 1.00 . A A . 30 ARG HH12 1 1 3 1317 1 1 30 ARG HH21 H -2.857 -0.469 -3.046 1.00 . A A . 30 ARG HH21 1 1 3 1318 1 1 30 ARG HH22 H -4.226 -1.472 -3.390 1.00 . A A . 30 ARG HH22 1 1 3 1319 1 1 30 ARG N N -7.814 1.906 -1.816 1.00 . A A . 30 ARG N 1 1 3 1320 1 1 30 ARG NE N -3.767 1.606 -4.041 1.00 . A A . 30 ARG NE 1 1 3 1321 1 1 30 ARG NH1 N -5.608 0.248 -4.394 1.00 . A A . 30 ARG NH1 1 1 3 1322 1 1 30 ARG NH2 N -3.772 -0.582 -3.432 1.00 . A A . 30 ARG NH2 1 1 3 1323 1 1 30 ARG O O -9.021 5.089 -1.122 1.00 . A A . 30 ARG O 1 1 3 1324 1 1 31 NH2 HN1 H -10.605 4.407 -2.899 1.00 . A A . 31 NH2 HN1 1 1 3 1325 1 1 31 NH2 HN2 H -9.557 3.111 -3.489 1.00 . A A . 31 NH2 HN2 1 1 3 1326 1 1 31 NH2 N N -9.752 3.874 -2.851 1.00 . A A . 31 NH2 N 1 1 3 1327 2 2 1 NAG C1 C -7.488 14.192 0.146 1.00 . B A . 32 NAG C1 1 1 3 1328 2 2 1 NAG C2 C -7.399 12.693 -0.076 1.00 . B A . 32 NAG C2 1 1 3 1329 2 2 1 NAG C3 C -6.421 12.120 0.969 1.00 . B A . 32 NAG C3 1 1 3 1330 2 2 1 NAG C4 C -5.114 12.937 1.117 1.00 . B A . 32 NAG C4 1 1 3 1331 2 2 1 NAG C5 C -5.346 14.454 1.060 1.00 . B A . 32 NAG C5 1 1 3 1332 2 2 1 NAG C6 C -4.025 15.228 0.844 1.00 . B A . 32 NAG C6 1 1 3 1333 2 2 1 NAG C7 C -9.270 10.958 0.278 1.00 . B A . 32 NAG C7 1 1 3 1334 2 2 1 NAG C8 C -10.761 10.835 0.207 1.00 . B A . 32 NAG C8 1 1 3 1335 2 2 1 NAG H1 H -7.931 14.432 1.114 1.00 . B A . 32 NAG H1 1 1 3 1336 2 2 1 NAG H2 H -6.954 12.554 -1.062 1.00 . B A . 32 NAG H2 1 1 3 1337 2 2 1 NAG H3 H -6.926 12.075 1.934 1.00 . B A . 32 NAG H3 1 1 3 1338 2 2 1 NAG H4 H -4.450 12.681 0.289 1.00 . B A . 32 NAG H4 1 1 3 1339 2 2 1 NAG H5 H -5.796 14.791 1.995 1.00 . B A . 32 NAG H5 1 1 3 1340 2 2 1 NAG H61 H -4.257 16.289 0.757 1.00 . B A . 32 NAG H61 1 1 3 1341 2 2 1 NAG H62 H -3.568 14.902 -0.091 1.00 . B A . 32 NAG H62 1 1 3 1342 2 2 1 NAG H81 H -11.207 11.534 0.911 1.00 . B A . 32 NAG H81 1 1 3 1343 2 2 1 NAG H82 H -11.092 11.045 -0.806 1.00 . B A . 32 NAG H82 1 1 3 1344 2 2 1 NAG H83 H -11.031 9.818 0.480 1.00 . B A . 32 NAG H83 1 1 3 1345 2 2 1 NAG HN2 H -9.493 12.811 -0.332 1.00 . B A . 32 NAG HN2 1 1 3 1346 2 2 1 NAG HO1 H -7.760 15.527 -1.125 1.00 . B A . 32 NAG HO1 1 1 3 1347 2 2 1 NAG HO3 H -6.933 10.377 0.380 1.00 . B A . 32 NAG HO3 1 1 3 1348 2 2 1 NAG HO4 H 2.599 7.649 7.850 1.00 . B A . 32 NAG HO4 1 1 3 1349 2 2 1 NAG HO6 H -2.342 15.696 1.678 1.00 . B A . 32 NAG HO6 1 1 3 1350 2 2 1 NAG N2 N -8.783 12.151 -0.045 1.00 . B A . 32 NAG N2 1 1 3 1351 2 2 1 NAG O1 O -8.245 14.742 -0.857 1.00 . B A . 32 NAG O1 1 1 3 1352 2 2 1 NAG O3 O -6.086 10.815 0.535 1.00 . B A . 32 NAG O3 1 1 3 1353 2 2 1 NAG O4 O -4.480 12.679 2.392 1.00 . B A . 32 NAG O4 1 1 3 1354 2 2 1 NAG O5 O -6.216 14.776 -0.009 1.00 . B A . 32 NAG O5 1 1 3 1355 2 2 1 NAG O6 O -3.065 15.093 1.884 1.00 . B A . 32 NAG O6 1 1 3 1356 2 2 1 NAG O7 O -8.588 9.990 0.597 1.00 . B A . 32 NAG O7 1 1 4 1357 1 1 1 VAL C C 8.508 4.180 5.801 1.00 . A A . 1 VAL C 1 1 4 1358 1 1 1 VAL CA C 10.017 4.105 5.974 1.00 . A A . 1 VAL CA 1 1 4 1359 1 1 1 VAL CB C 10.380 3.943 7.456 1.00 . A A . 1 VAL CB 1 1 4 1360 1 1 1 VAL CG1 C 11.875 3.662 7.603 1.00 . A A . 1 VAL CG1 1 1 4 1361 1 1 1 VAL CG2 C 10.016 5.173 8.293 1.00 . A A . 1 VAL CG2 1 1 4 1362 1 1 1 VAL H1 H 11.633 5.338 5.545 1.00 . A A . 1 VAL H1 1 1 4 1363 1 1 1 VAL H2 H 10.188 6.140 5.726 1.00 . A A . 1 VAL H2 1 1 4 1364 1 1 1 VAL H3 H 10.510 5.305 4.364 1.00 . A A . 1 VAL H3 1 1 4 1365 1 1 1 VAL HA H 10.372 3.224 5.440 1.00 . A A . 1 VAL HA 1 1 4 1366 1 1 1 VAL HB H 9.839 3.082 7.850 1.00 . A A . 1 VAL HB 1 1 4 1367 1 1 1 VAL HG11 H 12.159 2.808 6.986 1.00 . A A . 1 VAL HG11 1 1 4 1368 1 1 1 VAL HG12 H 12.475 4.527 7.322 1.00 . A A . 1 VAL HG12 1 1 4 1369 1 1 1 VAL HG13 H 12.092 3.419 8.644 1.00 . A A . 1 VAL HG13 1 1 4 1370 1 1 1 VAL HG21 H 10.239 4.965 9.341 1.00 . A A . 1 VAL HG21 1 1 4 1371 1 1 1 VAL HG22 H 10.593 6.047 7.990 1.00 . A A . 1 VAL HG22 1 1 4 1372 1 1 1 VAL HG23 H 8.952 5.397 8.212 1.00 . A A . 1 VAL HG23 1 1 4 1373 1 1 1 VAL N N 10.640 5.309 5.372 1.00 . A A . 1 VAL N 1 1 4 1374 1 1 1 VAL O O 8.013 5.249 5.462 1.00 . A A . 1 VAL O 1 1 4 1375 1 1 2 GLY C C 5.868 3.114 4.303 1.00 . A A . 2 GLY C 1 1 4 1376 1 1 2 GLY CA C 6.310 3.027 5.771 1.00 . A A . 2 GLY CA 1 1 4 1377 1 1 2 GLY H H 8.230 2.210 6.205 1.00 . A A . 2 GLY H 1 1 4 1378 1 1 2 GLY HA2 H 5.926 2.094 6.183 1.00 . A A . 2 GLY HA2 1 1 4 1379 1 1 2 GLY HA3 H 5.848 3.852 6.314 1.00 . A A . 2 GLY HA3 1 1 4 1380 1 1 2 GLY N N 7.770 3.075 5.964 1.00 . A A . 2 GLY N 1 1 4 1381 1 1 2 GLY O O 4.877 2.498 3.910 1.00 . A A . 2 GLY O 1 1 4 1382 1 1 3 GLU C C 6.652 2.397 1.483 1.00 . A A . 3 GLU C 1 1 4 1383 1 1 3 GLU CA C 6.627 3.830 2.041 1.00 . A A . 3 GLU CA 1 1 4 1384 1 1 3 GLU CB C 7.865 4.597 1.553 1.00 . A A . 3 GLU CB 1 1 4 1385 1 1 3 GLU CD C 10.391 4.762 1.754 1.00 . A A . 3 GLU CD 1 1 4 1386 1 1 3 GLU CG C 9.162 3.884 1.968 1.00 . A A . 3 GLU CG 1 1 4 1387 1 1 3 GLU H H 7.257 4.509 3.949 1.00 . A A . 3 GLU H 1 1 4 1388 1 1 3 GLU HA H 5.740 4.344 1.684 1.00 . A A . 3 GLU HA 1 1 4 1389 1 1 3 GLU HB2 H 7.835 4.664 0.556 1.00 . A A . 3 GLU HB2 1 1 4 1390 1 1 3 GLU HB3 H 7.857 5.515 1.949 1.00 . A A . 3 GLU HB3 1 1 4 1391 1 1 3 GLU HG2 H 9.102 3.643 2.937 1.00 . A A . 3 GLU HG2 1 1 4 1392 1 1 3 GLU HG3 H 9.261 3.052 1.423 1.00 . A A . 3 GLU HG3 1 1 4 1393 1 1 3 GLU N N 6.614 3.872 3.499 1.00 . A A . 3 GLU N 1 1 4 1394 1 1 3 GLU O O 7.174 1.479 2.114 1.00 . A A . 3 GLU O 1 1 4 1395 1 1 3 GLU OE1 O 10.846 4.832 0.585 1.00 . A A . 3 GLU OE1 1 1 4 1396 1 1 3 GLU OE2 O 10.873 5.309 2.772 1.00 . A A . 3 GLU OE2 1 1 4 1397 1 1 4 CYS C C 7.471 0.462 -0.926 1.00 . A A . 4 CYS C 1 1 4 1398 1 1 4 CYS CA C 6.124 0.866 -0.326 1.00 . A A . 4 CYS CA 1 1 4 1399 1 1 4 CYS CB C 5.026 0.778 -1.392 1.00 . A A . 4 CYS CB 1 1 4 1400 1 1 4 CYS H H 5.673 2.972 -0.193 1.00 . A A . 4 CYS H 1 1 4 1401 1 1 4 CYS HA H 5.906 0.155 0.463 1.00 . A A . 4 CYS HA 1 1 4 1402 1 1 4 CYS HB2 H 5.342 1.269 -2.204 1.00 . A A . 4 CYS HB2 1 1 4 1403 1 1 4 CYS HB3 H 4.889 -0.187 -1.617 1.00 . A A . 4 CYS HB3 1 1 4 1404 1 1 4 CYS N N 6.150 2.200 0.264 1.00 . A A . 4 CYS N 1 1 4 1405 1 1 4 CYS O O 8.247 1.292 -1.404 1.00 . A A . 4 CYS O 1 1 4 1406 1 1 4 CYS SG S 3.428 1.473 -0.903 1.00 . A A . 4 CYS SG 1 1 4 1407 1 1 5 VAL C C 8.590 -1.410 -3.227 1.00 . A A . 5 VAL C 1 1 4 1408 1 1 5 VAL CA C 8.871 -1.407 -1.729 1.00 . A A . 5 VAL CA 1 1 4 1409 1 1 5 VAL CB C 9.196 -2.806 -1.180 1.00 . A A . 5 VAL CB 1 1 4 1410 1 1 5 VAL CG1 C 10.543 -3.305 -1.713 1.00 . A A . 5 VAL CG1 1 1 4 1411 1 1 5 VAL CG2 C 9.292 -2.784 0.348 1.00 . A A . 5 VAL CG2 1 1 4 1412 1 1 5 VAL H H 6.961 -1.500 -0.836 1.00 . A A . 5 VAL H 1 1 4 1413 1 1 5 VAL HA H 9.733 -0.765 -1.542 1.00 . A A . 5 VAL HA 1 1 4 1414 1 1 5 VAL HB H 8.411 -3.506 -1.460 1.00 . A A . 5 VAL HB 1 1 4 1415 1 1 5 VAL HG11 H 10.759 -4.288 -1.295 1.00 . A A . 5 VAL HG11 1 1 4 1416 1 1 5 VAL HG12 H 10.523 -3.395 -2.798 1.00 . A A . 5 VAL HG12 1 1 4 1417 1 1 5 VAL HG13 H 11.339 -2.616 -1.426 1.00 . A A . 5 VAL HG13 1 1 4 1418 1 1 5 VAL HG21 H 10.032 -2.047 0.664 1.00 . A A . 5 VAL HG21 1 1 4 1419 1 1 5 VAL HG22 H 8.328 -2.531 0.790 1.00 . A A . 5 VAL HG22 1 1 4 1420 1 1 5 VAL HG23 H 9.588 -3.767 0.713 1.00 . A A . 5 VAL HG23 1 1 4 1421 1 1 5 VAL N N 7.699 -0.844 -1.064 1.00 . A A . 5 VAL N 1 1 4 1422 1 1 5 VAL O O 8.432 -2.457 -3.847 1.00 . A A . 5 VAL O 1 1 4 1423 1 1 6 ARG C C 7.370 -0.774 -5.945 1.00 . A A . 6 ARG C 1 1 4 1424 1 1 6 ARG CA C 8.306 0.168 -5.186 1.00 . A A . 6 ARG CA 1 1 4 1425 1 1 6 ARG CB C 9.721 0.312 -5.781 1.00 . A A . 6 ARG CB 1 1 4 1426 1 1 6 ARG CD C 10.356 1.904 -3.851 1.00 . A A . 6 ARG CD 1 1 4 1427 1 1 6 ARG CG C 10.435 1.615 -5.358 1.00 . A A . 6 ARG CG 1 1 4 1428 1 1 6 ARG CZ C 11.074 3.606 -2.215 1.00 . A A . 6 ARG CZ 1 1 4 1429 1 1 6 ARG H H 8.308 0.545 -3.089 1.00 . A A . 6 ARG H 1 1 4 1430 1 1 6 ARG HA H 7.811 1.134 -5.255 1.00 . A A . 6 ARG HA 1 1 4 1431 1 1 6 ARG HB2 H 10.273 -0.465 -5.477 1.00 . A A . 6 ARG HB2 1 1 4 1432 1 1 6 ARG HB3 H 9.648 0.300 -6.778 1.00 . A A . 6 ARG HB3 1 1 4 1433 1 1 6 ARG HD2 H 9.402 2.091 -3.616 1.00 . A A . 6 ARG HD2 1 1 4 1434 1 1 6 ARG HD3 H 10.668 1.092 -3.358 1.00 . A A . 6 ARG HD3 1 1 4 1435 1 1 6 ARG HE H 11.864 3.420 -4.050 1.00 . A A . 6 ARG HE 1 1 4 1436 1 1 6 ARG HG2 H 11.399 1.544 -5.615 1.00 . A A . 6 ARG HG2 1 1 4 1437 1 1 6 ARG HG3 H 10.014 2.378 -5.848 1.00 . A A . 6 ARG HG3 1 1 4 1438 1 1 6 ARG HH11 H 9.581 2.452 -1.544 1.00 . A A . 6 ARG HH11 1 1 4 1439 1 1 6 ARG HH12 H 10.161 3.648 -0.433 1.00 . A A . 6 ARG HH12 1 1 4 1440 1 1 6 ARG HH21 H 12.532 4.966 -2.435 1.00 . A A . 6 ARG HH21 1 1 4 1441 1 1 6 ARG HH22 H 11.722 4.979 -0.904 1.00 . A A . 6 ARG HH22 1 1 4 1442 1 1 6 ARG N N 8.405 -0.197 -3.767 1.00 . A A . 6 ARG N 1 1 4 1443 1 1 6 ARG NE N 11.173 3.050 -3.419 1.00 . A A . 6 ARG NE 1 1 4 1444 1 1 6 ARG NH1 N 10.204 3.204 -1.328 1.00 . A A . 6 ARG NH1 1 1 4 1445 1 1 6 ARG NH2 N 11.836 4.595 -1.820 1.00 . A A . 6 ARG NH2 1 1 4 1446 1 1 6 ARG O O 7.581 -1.118 -7.102 1.00 . A A . 6 ARG O 1 1 4 1447 1 1 7 GLY C C 4.875 -3.164 -4.713 1.00 . A A . 7 GLY C 1 1 4 1448 1 1 7 GLY CA C 5.250 -2.049 -5.696 1.00 . A A . 7 GLY CA 1 1 4 1449 1 1 7 GLY H H 6.291 -0.741 -4.312 1.00 . A A . 7 GLY H 1 1 4 1450 1 1 7 GLY HA2 H 4.356 -1.459 -5.896 1.00 . A A . 7 GLY HA2 1 1 4 1451 1 1 7 GLY HA3 H 5.554 -2.521 -6.631 1.00 . A A . 7 GLY HA3 1 1 4 1452 1 1 7 GLY N N 6.312 -1.155 -5.233 1.00 . A A . 7 GLY N 1 1 4 1453 1 1 7 GLY O O 3.808 -3.758 -4.866 1.00 . A A . 7 GLY O 1 1 4 1454 1 1 8 ARG C C 5.615 -4.048 -1.285 1.00 . A A . 8 ARG C 1 1 4 1455 1 1 8 ARG CA C 5.369 -4.506 -2.715 1.00 . A A . 8 ARG CA 1 1 4 1456 1 1 8 ARG CB C 6.174 -5.770 -3.067 1.00 . A A . 8 ARG CB 1 1 4 1457 1 1 8 ARG CD C 3.976 -7.080 -3.515 1.00 . A A . 8 ARG CD 1 1 4 1458 1 1 8 ARG CG C 5.412 -6.757 -3.963 1.00 . A A . 8 ARG CG 1 1 4 1459 1 1 8 ARG CZ C 2.771 -7.099 -1.326 1.00 . A A . 8 ARG CZ 1 1 4 1460 1 1 8 ARG H H 6.592 -2.997 -3.584 1.00 . A A . 8 ARG H 1 1 4 1461 1 1 8 ARG HA H 4.305 -4.722 -2.751 1.00 . A A . 8 ARG HA 1 1 4 1462 1 1 8 ARG HB2 H 7.008 -5.491 -3.543 1.00 . A A . 8 ARG HB2 1 1 4 1463 1 1 8 ARG HB3 H 6.416 -6.237 -2.217 1.00 . A A . 8 ARG HB3 1 1 4 1464 1 1 8 ARG HD2 H 3.392 -6.301 -3.743 1.00 . A A . 8 ARG HD2 1 1 4 1465 1 1 8 ARG HD3 H 3.664 -7.888 -4.015 1.00 . A A . 8 ARG HD3 1 1 4 1466 1 1 8 ARG HE H 4.594 -7.853 -1.605 1.00 . A A . 8 ARG HE 1 1 4 1467 1 1 8 ARG HG2 H 5.368 -6.368 -4.883 1.00 . A A . 8 ARG HG2 1 1 4 1468 1 1 8 ARG HG3 H 5.928 -7.613 -3.987 1.00 . A A . 8 ARG HG3 1 1 4 1469 1 1 8 ARG HH11 H 1.641 -6.344 -2.803 1.00 . A A . 8 ARG HH11 1 1 4 1470 1 1 8 ARG HH12 H 0.892 -6.398 -1.242 1.00 . A A . 8 ARG HH12 1 1 4 1471 1 1 8 ARG HH21 H 3.552 -7.716 0.414 1.00 . A A . 8 ARG HH21 1 1 4 1472 1 1 8 ARG HH22 H 1.921 -7.137 0.489 1.00 . A A . 8 ARG HH22 1 1 4 1473 1 1 8 ARG N N 5.687 -3.455 -3.686 1.00 . A A . 8 ARG N 1 1 4 1474 1 1 8 ARG NE N 3.848 -7.350 -2.065 1.00 . A A . 8 ARG NE 1 1 4 1475 1 1 8 ARG NH1 N 1.682 -6.572 -1.830 1.00 . A A . 8 ARG NH1 1 1 4 1476 1 1 8 ARG NH2 N 2.746 -7.336 -0.040 1.00 . A A . 8 ARG NH2 1 1 4 1477 1 1 8 ARG O O 5.937 -2.895 -1.044 1.00 . A A . 8 ARG O 1 1 4 1478 1 1 9 CYS C C 5.524 -6.268 1.676 1.00 . A A . 9 CYS C 1 1 4 1479 1 1 9 CYS CA C 5.672 -4.858 1.076 1.00 . A A . 9 CYS CA 1 1 4 1480 1 1 9 CYS CB C 4.673 -3.860 1.653 1.00 . A A . 9 CYS CB 1 1 4 1481 1 1 9 CYS H H 5.066 -5.868 -0.617 1.00 . A A . 9 CYS H 1 1 4 1482 1 1 9 CYS HA H 6.692 -4.507 1.240 1.00 . A A . 9 CYS HA 1 1 4 1483 1 1 9 CYS HB2 H 3.912 -3.766 1.011 1.00 . A A . 9 CYS HB2 1 1 4 1484 1 1 9 CYS HB3 H 4.333 -4.219 2.522 1.00 . A A . 9 CYS HB3 1 1 4 1485 1 1 9 CYS N N 5.416 -4.967 -0.344 1.00 . A A . 9 CYS N 1 1 4 1486 1 1 9 CYS O O 5.235 -7.201 0.918 1.00 . A A . 9 CYS O 1 1 4 1487 1 1 9 CYS SG S 5.378 -2.226 1.946 1.00 . A A . 9 CYS SG 1 1 4 1488 1 1 10 PRO C C 4.265 -8.462 3.552 1.00 . A A . 10 PRO C 1 1 4 1489 1 1 10 PRO CA C 5.605 -7.719 3.687 1.00 . A A . 10 PRO CA 1 1 4 1490 1 1 10 PRO CB C 5.922 -7.408 5.155 1.00 . A A . 10 PRO CB 1 1 4 1491 1 1 10 PRO CD C 6.237 -5.424 3.898 1.00 . A A . 10 PRO CD 1 1 4 1492 1 1 10 PRO CG C 6.849 -6.201 5.060 1.00 . A A . 10 PRO CG 1 1 4 1493 1 1 10 PRO HA H 6.386 -8.375 3.300 1.00 . A A . 10 PRO HA 1 1 4 1494 1 1 10 PRO HB2 H 5.090 -7.183 5.662 1.00 . A A . 10 PRO HB2 1 1 4 1495 1 1 10 PRO HB3 H 6.382 -8.180 5.594 1.00 . A A . 10 PRO HB3 1 1 4 1496 1 1 10 PRO HD2 H 5.504 -4.827 4.224 1.00 . A A . 10 PRO HD2 1 1 4 1497 1 1 10 PRO HD3 H 6.935 -4.875 3.438 1.00 . A A . 10 PRO HD3 1 1 4 1498 1 1 10 PRO HG2 H 6.835 -5.664 5.904 1.00 . A A . 10 PRO HG2 1 1 4 1499 1 1 10 PRO HG3 H 7.788 -6.479 4.857 1.00 . A A . 10 PRO HG3 1 1 4 1500 1 1 10 PRO N N 5.707 -6.436 2.995 1.00 . A A . 10 PRO N 1 1 4 1501 1 1 10 PRO O O 3.346 -8.049 2.838 1.00 . A A . 10 PRO O 1 1 4 1502 1 1 11 SER C C 1.690 -9.984 4.208 1.00 . A A . 11 SER C 1 1 4 1503 1 1 11 SER CA C 3.098 -10.548 4.396 1.00 . A A . 11 SER CA 1 1 4 1504 1 1 11 SER CB C 3.222 -11.218 5.760 1.00 . A A . 11 SER CB 1 1 4 1505 1 1 11 SER H H 5.000 -9.853 4.819 1.00 . A A . 11 SER H 1 1 4 1506 1 1 11 SER HA H 3.257 -11.323 3.645 1.00 . A A . 11 SER HA 1 1 4 1507 1 1 11 SER HB2 H 2.906 -10.594 6.475 1.00 . A A . 11 SER HB2 1 1 4 1508 1 1 11 SER HB3 H 2.673 -12.054 5.779 1.00 . A A . 11 SER HB3 1 1 4 1509 1 1 11 SER HG H 4.671 -12.038 6.783 1.00 . A A . 11 SER HG 1 1 4 1510 1 1 11 SER N N 4.190 -9.585 4.271 1.00 . A A . 11 SER N 1 1 4 1511 1 1 11 SER O O 1.057 -9.486 5.142 1.00 . A A . 11 SER O 1 1 4 1512 1 1 11 SER OG O 4.586 -11.534 5.966 1.00 . A A . 11 SER OG 1 1 4 1513 1 1 12 GLY C C -0.410 -8.164 2.927 1.00 . A A . 12 GLY C 1 1 4 1514 1 1 12 GLY CA C -0.174 -9.648 2.647 1.00 . A A . 12 GLY CA 1 1 4 1515 1 1 12 GLY H H 1.752 -10.513 2.270 1.00 . A A . 12 GLY H 1 1 4 1516 1 1 12 GLY HA2 H -0.358 -9.828 1.588 1.00 . A A . 12 GLY HA2 1 1 4 1517 1 1 12 GLY HA3 H -0.895 -10.228 3.221 1.00 . A A . 12 GLY HA3 1 1 4 1518 1 1 12 GLY N N 1.177 -10.089 2.983 1.00 . A A . 12 GLY N 1 1 4 1519 1 1 12 GLY O O -1.522 -7.780 3.285 1.00 . A A . 12 GLY O 1 1 4 1520 1 1 13 MET C C 0.146 -5.373 1.500 1.00 . A A . 13 MET C 1 1 4 1521 1 1 13 MET CA C 0.455 -5.878 2.910 1.00 . A A . 13 MET CA 1 1 4 1522 1 1 13 MET CB C 1.736 -5.207 3.410 1.00 . A A . 13 MET CB 1 1 4 1523 1 1 13 MET CE C 1.708 -3.444 6.325 1.00 . A A . 13 MET CE 1 1 4 1524 1 1 13 MET CG C 2.171 -5.700 4.794 1.00 . A A . 13 MET CG 1 1 4 1525 1 1 13 MET H H 1.563 -7.707 2.738 1.00 . A A . 13 MET H 1 1 4 1526 1 1 13 MET HA H -0.370 -5.607 3.571 1.00 . A A . 13 MET HA 1 1 4 1527 1 1 13 MET HB2 H 2.470 -5.398 2.759 1.00 . A A . 13 MET HB2 1 1 4 1528 1 1 13 MET HB3 H 1.581 -4.220 3.458 1.00 . A A . 13 MET HB3 1 1 4 1529 1 1 13 MET HE1 H 2.775 -3.447 6.544 1.00 . A A . 13 MET HE1 1 1 4 1530 1 1 13 MET HE2 H 1.529 -2.895 5.402 1.00 . A A . 13 MET HE2 1 1 4 1531 1 1 13 MET HE3 H 1.179 -2.956 7.144 1.00 . A A . 13 MET HE3 1 1 4 1532 1 1 13 MET HG2 H 2.170 -6.700 4.783 1.00 . A A . 13 MET HG2 1 1 4 1533 1 1 13 MET HG3 H 3.099 -5.369 4.965 1.00 . A A . 13 MET HG3 1 1 4 1534 1 1 13 MET N N 0.630 -7.328 2.880 1.00 . A A . 13 MET N 1 1 4 1535 1 1 13 MET O O 0.419 -6.062 0.512 1.00 . A A . 13 MET O 1 1 4 1536 1 1 13 MET SD S 1.116 -5.149 6.155 1.00 . A A . 13 MET SD 1 1 4 1537 1 1 14 CYS C C -0.306 -2.035 0.150 1.00 . A A . 14 CYS C 1 1 4 1538 1 1 14 CYS CA C -0.704 -3.520 0.130 1.00 . A A . 14 CYS CA 1 1 4 1539 1 1 14 CYS CB C -2.211 -3.670 -0.097 1.00 . A A . 14 CYS CB 1 1 4 1540 1 1 14 CYS H H -0.540 -3.628 2.251 1.00 . A A . 14 CYS H 1 1 4 1541 1 1 14 CYS HA H -0.170 -4.012 -0.684 1.00 . A A . 14 CYS HA 1 1 4 1542 1 1 14 CYS HB2 H -2.662 -2.931 0.404 1.00 . A A . 14 CYS HB2 1 1 4 1543 1 1 14 CYS HB3 H -2.377 -3.559 -1.077 1.00 . A A . 14 CYS HB3 1 1 4 1544 1 1 14 CYS N N -0.355 -4.147 1.397 1.00 . A A . 14 CYS N 1 1 4 1545 1 1 14 CYS O O -0.066 -1.490 1.226 1.00 . A A . 14 CYS O 1 1 4 1546 1 1 14 CYS SG S -2.998 -5.230 0.413 1.00 . A A . 14 CYS SG 1 1 4 1547 1 1 15 CYS C C -0.791 0.981 -1.591 1.00 . A A . 15 CYS C 1 1 4 1548 1 1 15 CYS CA C 0.294 -0.043 -1.211 1.00 . A A . 15 CYS CA 1 1 4 1549 1 1 15 CYS CB C 1.343 -0.133 -2.324 1.00 . A A . 15 CYS CB 1 1 4 1550 1 1 15 CYS H H -0.545 -1.885 -1.852 1.00 . A A . 15 CYS H 1 1 4 1551 1 1 15 CYS HA H 0.783 0.283 -0.293 1.00 . A A . 15 CYS HA 1 1 4 1552 1 1 15 CYS HB2 H 1.984 -0.865 -2.092 1.00 . A A . 15 CYS HB2 1 1 4 1553 1 1 15 CYS HB3 H 0.875 -0.357 -3.179 1.00 . A A . 15 CYS HB3 1 1 4 1554 1 1 15 CYS N N -0.250 -1.392 -1.024 1.00 . A A . 15 CYS N 1 1 4 1555 1 1 15 CYS O O -1.613 0.700 -2.467 1.00 . A A . 15 CYS O 1 1 4 1556 1 1 15 CYS SG S 2.286 1.387 -2.577 1.00 . A A . 15 CYS SG 1 1 4 1557 1 1 16 SER C C -1.554 4.155 -2.274 1.00 . A A . 16 SER C 1 1 4 1558 1 1 16 SER CA C -1.832 3.190 -1.126 1.00 . A A . 16 SER CA 1 1 4 1559 1 1 16 SER CB C -1.937 4.025 0.155 1.00 . A A . 16 SER CB 1 1 4 1560 1 1 16 SER H H -0.036 2.385 -0.327 1.00 . A A . 16 SER H 1 1 4 1561 1 1 16 SER HA H -2.789 2.699 -1.303 1.00 . A A . 16 SER HA 1 1 4 1562 1 1 16 SER HB2 H -2.801 4.528 0.149 1.00 . A A . 16 SER HB2 1 1 4 1563 1 1 16 SER HB3 H -1.911 3.415 0.947 1.00 . A A . 16 SER HB3 1 1 4 1564 1 1 16 SER HG H -0.924 5.363 1.122 1.00 . A A . 16 SER HG 1 1 4 1565 1 1 16 SER N N -0.793 2.167 -0.966 1.00 . A A . 16 SER N 1 1 4 1566 1 1 16 SER O O -0.443 4.215 -2.803 1.00 . A A . 16 SER O 1 1 4 1567 1 1 16 SER OG O -0.861 4.949 0.243 1.00 . A A . 16 SER OG 1 1 4 1568 1 1 17 GLN C C -1.218 7.091 -3.051 1.00 . A A . 17 GLN C 1 1 4 1569 1 1 17 GLN CA C -2.297 6.116 -3.524 1.00 . A A . 17 GLN CA 1 1 4 1570 1 1 17 GLN CB C -3.573 6.942 -3.749 1.00 . A A . 17 GLN CB 1 1 4 1571 1 1 17 GLN CD C -5.675 5.845 -2.862 1.00 . A A . 17 GLN CD 1 1 4 1572 1 1 17 GLN CG C -4.838 6.158 -4.097 1.00 . A A . 17 GLN CG 1 1 4 1573 1 1 17 GLN H H -3.421 4.997 -2.105 1.00 . A A . 17 GLN H 1 1 4 1574 1 1 17 GLN HA H -1.959 5.674 -4.460 1.00 . A A . 17 GLN HA 1 1 4 1575 1 1 17 GLN HB2 H -3.755 7.456 -2.910 1.00 . A A . 17 GLN HB2 1 1 4 1576 1 1 17 GLN HB3 H -3.394 7.579 -4.499 1.00 . A A . 17 GLN HB3 1 1 4 1577 1 1 17 GLN HE21 H -7.405 6.469 -3.731 1.00 . A A . 17 GLN HE21 1 1 4 1578 1 1 17 GLN HE22 H -7.532 5.692 -2.154 1.00 . A A . 17 GLN HE22 1 1 4 1579 1 1 17 GLN HG2 H -5.389 6.700 -4.731 1.00 . A A . 17 GLN HG2 1 1 4 1580 1 1 17 GLN HG3 H -4.575 5.298 -4.534 1.00 . A A . 17 GLN HG3 1 1 4 1581 1 1 17 GLN N N -2.524 5.026 -2.582 1.00 . A A . 17 GLN N 1 1 4 1582 1 1 17 GLN NE2 N -6.974 6.067 -2.919 1.00 . A A . 17 GLN NE2 1 1 4 1583 1 1 17 GLN O O -0.735 7.902 -3.833 1.00 . A A . 17 GLN O 1 1 4 1584 1 1 17 GLN OE1 O -5.171 5.371 -1.854 1.00 . A A . 17 GLN OE1 1 1 4 1585 1 1 18 . C C 1.515 7.226 -1.114 1.00 . A A . 18 PFF C 1 1 4 1586 1 1 18 . CA C 0.148 7.915 -1.188 1.00 . A A . 18 PFF CA 1 1 4 1587 1 1 18 . CB C -0.380 8.384 0.173 1.00 . A A . 18 PFF CB 1 1 4 1588 1 1 18 . CD1 C -2.098 10.095 -0.545 1.00 . A A . 18 PFF CD1 1 1 4 1589 1 1 18 . CD2 C -2.878 8.014 0.440 1.00 . A A . 18 PFF CD2 1 1 4 1590 1 1 18 . CE1 C -3.428 10.469 -0.805 1.00 . A A . 18 PFF CE1 1 1 4 1591 1 1 18 . CE2 C -4.207 8.379 0.163 1.00 . A A . 18 PFF CE2 1 1 4 1592 1 1 18 . CG C -1.818 8.872 0.089 1.00 . A A . 18 PFF CG 1 1 4 1593 1 1 18 . CZ C -4.483 9.612 -0.450 1.00 . A A . 18 PFF CZ 1 1 4 1594 1 1 18 . F F -5.772 9.981 -0.676 1.00 . A A . 18 PFF F 1 1 4 1595 1 1 18 . H H -1.215 6.299 -1.171 1.00 . A A . 18 PFF H 1 1 4 1596 1 1 18 . HA H 0.264 8.797 -1.820 1.00 . A A . 18 PFF HA 1 1 4 1597 1 1 18 . HB2 H -0.320 7.563 0.887 1.00 . A A . 18 PFF HB2 1 1 4 1598 1 1 18 . HB3 H 0.253 9.194 0.539 1.00 . A A . 18 PFF HB3 1 1 4 1599 1 1 18 . HD1 H -1.284 10.724 -0.877 1.00 . A A . 18 PFF HD1 1 1 4 1600 1 1 18 . HD2 H -2.675 7.041 0.858 1.00 . A A . 18 PFF HD2 1 1 4 1601 1 1 18 . HE1 H -3.637 11.408 -1.297 1.00 . A A . 18 PFF HE1 1 1 4 1602 1 1 18 . HE2 H -5.010 7.692 0.378 1.00 . A A . 18 PFF HE2 1 1 4 1603 1 1 18 . N N -0.842 7.027 -1.773 1.00 . A A . 18 PFF N 1 1 4 1604 1 1 18 . O O 2.455 7.778 -0.551 1.00 . A A . 18 PFF O 1 1 4 1605 1 1 19 GLY C C 3.299 4.692 -0.370 1.00 . A A . 19 GLY C 1 1 4 1606 1 1 19 GLY CA C 2.912 5.310 -1.710 1.00 . A A . 19 GLY CA 1 1 4 1607 1 1 19 GLY H H 0.834 5.569 -2.114 1.00 . A A . 19 GLY H 1 1 4 1608 1 1 19 GLY HA2 H 2.857 4.513 -2.451 1.00 . A A . 19 GLY HA2 1 1 4 1609 1 1 19 GLY HA3 H 3.701 6.002 -2.009 1.00 . A A . 19 GLY HA3 1 1 4 1610 1 1 19 GLY N N 1.637 6.013 -1.672 1.00 . A A . 19 GLY N 1 1 4 1611 1 1 19 GLY O O 4.458 4.327 -0.199 1.00 . A A . 19 GLY O 1 1 4 1612 1 1 20 . C C 1.929 2.528 1.915 1.00 . A A . 20 PFF C 1 1 4 1613 1 1 20 . CA C 2.577 3.912 1.860 1.00 . A A . 20 PFF CA 1 1 4 1614 1 1 20 . CB C 1.984 4.800 2.953 1.00 . A A . 20 PFF CB 1 1 4 1615 1 1 20 . CD1 C 2.738 7.208 2.713 1.00 . A A . 20 PFF CD1 1 1 4 1616 1 1 20 . CD2 C 3.867 5.769 4.317 1.00 . A A . 20 PFF CD2 1 1 4 1617 1 1 20 . CE1 C 3.581 8.272 3.076 1.00 . A A . 20 PFF CE1 1 1 4 1618 1 1 20 . CE2 C 4.734 6.822 4.657 1.00 . A A . 20 PFF CE2 1 1 4 1619 1 1 20 . CG C 2.872 5.959 3.342 1.00 . A A . 20 PFF CG 1 1 4 1620 1 1 20 . CZ C 4.579 8.079 4.048 1.00 . A A . 20 PFF CZ 1 1 4 1621 1 1 20 . F F 5.392 9.109 4.404 1.00 . A A . 20 PFF F 1 1 4 1622 1 1 20 . H H 1.400 4.811 0.345 1.00 . A A . 20 PFF H 1 1 4 1623 1 1 20 . HA H 3.643 3.790 2.046 1.00 . A A . 20 PFF HA 1 1 4 1624 1 1 20 . HB2 H 1.010 5.167 2.631 1.00 . A A . 20 PFF HB2 1 1 4 1625 1 1 20 . HB3 H 1.826 4.195 3.842 1.00 . A A . 20 PFF HB3 1 1 4 1626 1 1 20 . HD1 H 1.996 7.350 1.943 1.00 . A A . 20 PFF HD1 1 1 4 1627 1 1 20 . HD2 H 3.926 4.831 4.845 1.00 . A A . 20 PFF HD2 1 1 4 1628 1 1 20 . HE1 H 3.471 9.235 2.598 1.00 . A A . 20 PFF HE1 1 1 4 1629 1 1 20 . HE2 H 5.500 6.675 5.405 1.00 . A A . 20 PFF HE2 1 1 4 1630 1 1 20 . N N 2.354 4.555 0.568 1.00 . A A . 20 PFF N 1 1 4 1631 1 1 20 . O O 0.968 2.261 1.188 1.00 . A A . 20 PFF O 1 1 4 1632 1 1 21 CYS C C 0.967 0.115 4.136 1.00 . A A . 21 CYS C 1 1 4 1633 1 1 21 CYS CA C 1.892 0.307 2.937 1.00 . A A . 21 CYS CA 1 1 4 1634 1 1 21 CYS CB C 3.046 -0.685 3.048 1.00 . A A . 21 CYS CB 1 1 4 1635 1 1 21 CYS H H 3.229 1.933 3.357 1.00 . A A . 21 CYS H 1 1 4 1636 1 1 21 CYS HA H 1.334 0.068 2.039 1.00 . A A . 21 CYS HA 1 1 4 1637 1 1 21 CYS HB2 H 3.728 -0.314 3.678 1.00 . A A . 21 CYS HB2 1 1 4 1638 1 1 21 CYS HB3 H 2.693 -1.548 3.409 1.00 . A A . 21 CYS HB3 1 1 4 1639 1 1 21 CYS N N 2.417 1.660 2.805 1.00 . A A . 21 CYS N 1 1 4 1640 1 1 21 CYS O O 1.161 0.714 5.190 1.00 . A A . 21 CYS O 1 1 4 1641 1 1 21 CYS SG S 3.836 -1.002 1.468 1.00 . A A . 21 CYS SG 1 1 4 1642 1 1 22 GLY C C -1.754 -2.364 4.669 1.00 . A A . 22 GLY C 1 1 4 1643 1 1 22 GLY CA C -0.859 -1.206 5.094 1.00 . A A . 22 GLY CA 1 1 4 1644 1 1 22 GLY H H -0.176 -1.206 3.077 1.00 . A A . 22 GLY H 1 1 4 1645 1 1 22 GLY HA2 H -0.253 -1.521 5.943 1.00 . A A . 22 GLY HA2 1 1 4 1646 1 1 22 GLY HA3 H -1.469 -0.362 5.408 1.00 . A A . 22 GLY HA3 1 1 4 1647 1 1 22 GLY N N 0.010 -0.804 3.998 1.00 . A A . 22 GLY N 1 1 4 1648 1 1 22 GLY O O -1.475 -3.039 3.676 1.00 . A A . 22 GLY O 1 1 4 1649 1 1 23 LYS C C -5.225 -2.715 5.030 1.00 . A A . 23 LYS C 1 1 4 1650 1 1 23 LYS CA C -3.916 -3.504 5.058 1.00 . A A . 23 LYS CA 1 1 4 1651 1 1 23 LYS CB C -3.976 -4.660 6.072 1.00 . A A . 23 LYS CB 1 1 4 1652 1 1 23 LYS CD C -2.757 -6.626 7.088 1.00 . A A . 23 LYS CD 1 1 4 1653 1 1 23 LYS CE C -1.444 -7.417 7.131 1.00 . A A . 23 LYS CE 1 1 4 1654 1 1 23 LYS CG C -2.696 -5.506 6.041 1.00 . A A . 23 LYS CG 1 1 4 1655 1 1 23 LYS H H -3.022 -1.937 6.170 1.00 . A A . 23 LYS H 1 1 4 1656 1 1 23 LYS HA H -3.743 -3.910 4.060 1.00 . A A . 23 LYS HA 1 1 4 1657 1 1 23 LYS HB2 H -4.092 -4.281 6.990 1.00 . A A . 23 LYS HB2 1 1 4 1658 1 1 23 LYS HB3 H -4.757 -5.245 5.851 1.00 . A A . 23 LYS HB3 1 1 4 1659 1 1 23 LYS HD2 H -2.924 -6.223 7.988 1.00 . A A . 23 LYS HD2 1 1 4 1660 1 1 23 LYS HD3 H -3.505 -7.248 6.857 1.00 . A A . 23 LYS HD3 1 1 4 1661 1 1 23 LYS HE2 H -0.680 -6.773 7.166 1.00 . A A . 23 LYS HE2 1 1 4 1662 1 1 23 LYS HE3 H -1.438 -7.988 7.952 1.00 . A A . 23 LYS HE3 1 1 4 1663 1 1 23 LYS HG2 H -2.593 -5.912 5.133 1.00 . A A . 23 LYS HG2 1 1 4 1664 1 1 23 LYS HG3 H -1.910 -4.919 6.235 1.00 . A A . 23 LYS HG3 1 1 4 1665 1 1 23 LYS HZ1 H -1.945 -9.047 5.961 1.00 . A A . 23 LYS HZ1 1 1 4 1666 1 1 23 LYS HZ2 H -1.438 -7.765 5.084 1.00 . A A . 23 LYS HZ2 1 1 4 1667 1 1 23 LYS HZ3 H -0.342 -8.679 5.895 1.00 . A A . 23 LYS HZ3 1 1 4 1668 1 1 23 LYS N N -2.834 -2.587 5.418 1.00 . A A . 23 LYS N 1 1 4 1669 1 1 23 LYS NZ N -1.282 -8.286 5.944 1.00 . A A . 23 LYS NZ 1 1 4 1670 1 1 23 LYS O O -5.255 -1.558 5.442 1.00 . A A . 23 LYS O 1 1 4 1671 1 1 24 GLY C C -7.686 -1.599 3.378 1.00 . A A . 24 GLY C 1 1 4 1672 1 1 24 GLY CA C -7.601 -2.642 4.503 1.00 . A A . 24 GLY CA 1 1 4 1673 1 1 24 GLY H H -6.235 -4.275 4.233 1.00 . A A . 24 GLY H 1 1 4 1674 1 1 24 GLY HA2 H -8.384 -3.385 4.344 1.00 . A A . 24 GLY HA2 1 1 4 1675 1 1 24 GLY HA3 H -7.785 -2.146 5.457 1.00 . A A . 24 GLY HA3 1 1 4 1676 1 1 24 GLY N N -6.311 -3.325 4.562 1.00 . A A . 24 GLY N 1 1 4 1677 1 1 24 GLY O O -6.780 -1.495 2.547 1.00 . A A . 24 GLY O 1 1 4 1678 1 1 25 PRO C C -8.127 0.798 1.526 1.00 . A A . 25 PRO C 1 1 4 1679 1 1 25 PRO CA C -9.225 -0.024 2.207 1.00 . A A . 25 PRO CA 1 1 4 1680 1 1 25 PRO CB C -10.395 0.813 2.736 1.00 . A A . 25 PRO CB 1 1 4 1681 1 1 25 PRO CD C -9.853 -0.878 4.337 1.00 . A A . 25 PRO CD 1 1 4 1682 1 1 25 PRO CG C -11.051 -0.161 3.712 1.00 . A A . 25 PRO CG 1 1 4 1683 1 1 25 PRO HA H -9.626 -0.700 1.450 1.00 . A A . 25 PRO HA 1 1 4 1684 1 1 25 PRO HB2 H -10.073 1.636 3.203 1.00 . A A . 25 PRO HB2 1 1 4 1685 1 1 25 PRO HB3 H -11.022 1.070 2.000 1.00 . A A . 25 PRO HB3 1 1 4 1686 1 1 25 PRO HD2 H -9.556 -0.402 5.164 1.00 . A A . 25 PRO HD2 1 1 4 1687 1 1 25 PRO HD3 H -10.092 -1.822 4.563 1.00 . A A . 25 PRO HD3 1 1 4 1688 1 1 25 PRO HG2 H -11.580 0.327 4.406 1.00 . A A . 25 PRO HG2 1 1 4 1689 1 1 25 PRO HG3 H -11.645 -0.806 3.232 1.00 . A A . 25 PRO HG3 1 1 4 1690 1 1 25 PRO N N -8.801 -0.850 3.332 1.00 . A A . 25 PRO N 1 1 4 1691 1 1 25 PRO O O -7.657 0.398 0.464 1.00 . A A . 25 PRO O 1 1 4 1692 1 1 26 LYS C C -5.477 2.360 0.999 1.00 . A A . 26 LYS C 1 1 4 1693 1 1 26 LYS CA C -6.858 2.902 1.376 1.00 . A A . 26 LYS CA 1 1 4 1694 1 1 26 LYS CB C -6.720 4.185 2.203 1.00 . A A . 26 LYS CB 1 1 4 1695 1 1 26 LYS CD C -7.956 6.225 3.091 1.00 . A A . 26 LYS CD 1 1 4 1696 1 1 26 LYS CE C -7.255 7.291 2.242 1.00 . A A . 26 LYS CE 1 1 4 1697 1 1 26 LYS CG C -8.076 4.887 2.355 1.00 . A A . 26 LYS CG 1 1 4 1698 1 1 26 LYS H H -8.083 2.216 2.981 1.00 . A A . 26 LYS H 1 1 4 1699 1 1 26 LYS HA H -7.346 3.165 0.438 1.00 . A A . 26 LYS HA 1 1 4 1700 1 1 26 LYS HB2 H -6.368 3.954 3.110 1.00 . A A . 26 LYS HB2 1 1 4 1701 1 1 26 LYS HB3 H -6.081 4.803 1.744 1.00 . A A . 26 LYS HB3 1 1 4 1702 1 1 26 LYS HD2 H -8.873 6.549 3.322 1.00 . A A . 26 LYS HD2 1 1 4 1703 1 1 26 LYS HD3 H -7.431 6.085 3.930 1.00 . A A . 26 LYS HD3 1 1 4 1704 1 1 26 LYS HE2 H -6.309 7.012 2.076 1.00 . A A . 26 LYS HE2 1 1 4 1705 1 1 26 LYS HE3 H -7.733 7.385 1.369 1.00 . A A . 26 LYS HE3 1 1 4 1706 1 1 26 LYS HG2 H -8.456 5.053 1.445 1.00 . A A . 26 LYS HG2 1 1 4 1707 1 1 26 LYS HG3 H -8.691 4.290 2.870 1.00 . A A . 26 LYS HG3 1 1 4 1708 1 1 26 LYS HZ1 H -6.738 8.563 3.815 1.00 . A A . 26 LYS HZ1 1 1 4 1709 1 1 26 LYS HZ2 H -6.878 9.367 2.415 1.00 . A A . 26 LYS HZ2 1 1 4 1710 1 1 26 LYS HZ3 H -8.216 8.905 3.125 1.00 . A A . 26 LYS HZ3 1 1 4 1711 1 1 26 LYS N N -7.704 1.937 2.089 1.00 . A A . 26 LYS N 1 1 4 1712 1 1 26 LYS NZ N -7.265 8.590 2.947 1.00 . A A . 26 LYS NZ 1 1 4 1713 1 1 26 LYS O O -4.851 2.871 0.079 1.00 . A A . 26 LYS O 1 1 4 1714 1 1 27 TYR C C -3.968 -0.423 0.246 1.00 . A A . 27 TYR C 1 1 4 1715 1 1 27 TYR CA C -3.756 0.660 1.291 1.00 . A A . 27 TYR CA 1 1 4 1716 1 1 27 TYR CB C -3.125 0.037 2.528 1.00 . A A . 27 TYR CB 1 1 4 1717 1 1 27 TYR CD1 C -1.613 1.851 3.409 1.00 . A A . 27 TYR CD1 1 1 4 1718 1 1 27 TYR CD2 C -3.551 1.219 4.737 1.00 . A A . 27 TYR CD2 1 1 4 1719 1 1 27 TYR CE1 C -1.183 2.707 4.438 1.00 . A A . 27 TYR CE1 1 1 4 1720 1 1 27 TYR CE2 C -3.143 2.112 5.746 1.00 . A A . 27 TYR CE2 1 1 4 1721 1 1 27 TYR CG C -2.761 1.060 3.583 1.00 . A A . 27 TYR CG 1 1 4 1722 1 1 27 TYR CZ C -1.948 2.835 5.608 1.00 . A A . 27 TYR CZ 1 1 4 1723 1 1 27 TYR H H -5.575 0.907 2.396 1.00 . A A . 27 TYR H 1 1 4 1724 1 1 27 TYR HA H -3.063 1.392 0.878 1.00 . A A . 27 TYR HA 1 1 4 1725 1 1 27 TYR HB2 H -3.774 -0.613 2.924 1.00 . A A . 27 TYR HB2 1 1 4 1726 1 1 27 TYR HB3 H -2.294 -0.447 2.253 1.00 . A A . 27 TYR HB3 1 1 4 1727 1 1 27 TYR HD1 H -1.037 1.760 2.501 1.00 . A A . 27 TYR HD1 1 1 4 1728 1 1 27 TYR HD2 H -4.455 0.643 4.863 1.00 . A A . 27 TYR HD2 1 1 4 1729 1 1 27 TYR HE1 H -0.263 3.263 4.339 1.00 . A A . 27 TYR HE1 1 1 4 1730 1 1 27 TYR HE2 H -3.728 2.239 6.644 1.00 . A A . 27 TYR HE2 1 1 4 1731 1 1 27 TYR HH H -0.684 4.049 6.433 1.00 . A A . 27 TYR HH 1 1 4 1732 1 1 27 TYR N N -5.011 1.303 1.660 1.00 . A A . 27 TYR N 1 1 4 1733 1 1 27 TYR O O -3.167 -0.573 -0.672 1.00 . A A . 27 TYR O 1 1 4 1734 1 1 27 TYR OH O -1.597 3.745 6.555 1.00 . A A . 27 TYR OH 1 1 4 1735 1 1 28 CYS C C -6.174 -2.193 -1.595 1.00 . A A . 28 CYS C 1 1 4 1736 1 1 28 CYS CA C -5.191 -2.391 -0.440 1.00 . A A . 28 CYS CA 1 1 4 1737 1 1 28 CYS CB C -5.525 -3.562 0.472 1.00 . A A . 28 CYS CB 1 1 4 1738 1 1 28 CYS H H -5.599 -1.135 1.223 1.00 . A A . 28 CYS H 1 1 4 1739 1 1 28 CYS HA H -4.249 -2.619 -0.920 1.00 . A A . 28 CYS HA 1 1 4 1740 1 1 28 CYS HB2 H -5.087 -3.422 1.360 1.00 . A A . 28 CYS HB2 1 1 4 1741 1 1 28 CYS HB3 H -6.516 -3.611 0.593 1.00 . A A . 28 CYS HB3 1 1 4 1742 1 1 28 CYS N N -5.025 -1.217 0.389 1.00 . A A . 28 CYS N 1 1 4 1743 1 1 28 CYS O O -5.824 -2.512 -2.734 1.00 . A A . 28 CYS O 1 1 4 1744 1 1 28 CYS SG S -4.937 -5.117 -0.241 1.00 . A A . 28 CYS SG 1 1 4 1745 1 1 29 GLY C C -8.226 0.175 -2.890 1.00 . A A . 29 GLY C 1 1 4 1746 1 1 29 GLY CA C -8.318 -1.268 -2.380 1.00 . A A . 29 GLY CA 1 1 4 1747 1 1 29 GLY H H -7.495 -1.227 -0.405 1.00 . A A . 29 GLY H 1 1 4 1748 1 1 29 GLY HA2 H -8.198 -1.940 -3.230 1.00 . A A . 29 GLY HA2 1 1 4 1749 1 1 29 GLY HA3 H -9.318 -1.417 -1.976 1.00 . A A . 29 GLY HA3 1 1 4 1750 1 1 29 GLY N N -7.335 -1.585 -1.344 1.00 . A A . 29 GLY N 1 1 4 1751 1 1 29 GLY O O -8.766 0.474 -3.952 1.00 . A A . 29 GLY O 1 1 4 1752 1 1 30 ARG C C -8.562 3.337 -2.422 1.00 . A A . 30 ARG C 1 1 4 1753 1 1 30 ARG CA C -7.295 2.483 -2.455 1.00 . A A . 30 ARG CA 1 1 4 1754 1 1 30 ARG CB C -6.514 2.631 -3.772 1.00 . A A . 30 ARG CB 1 1 4 1755 1 1 30 ARG CD C -4.253 1.925 -4.736 1.00 . A A . 30 ARG CD 1 1 4 1756 1 1 30 ARG CG C -5.043 2.320 -3.481 1.00 . A A . 30 ARG CG 1 1 4 1757 1 1 30 ARG CZ C -3.994 -0.442 -4.168 1.00 . A A . 30 ARG CZ 1 1 4 1758 1 1 30 ARG H H -7.226 0.727 -1.251 1.00 . A A . 30 ARG H 1 1 4 1759 1 1 30 ARG HA H -6.662 2.885 -1.663 1.00 . A A . 30 ARG HA 1 1 4 1760 1 1 30 ARG HB2 H -6.869 1.990 -4.452 1.00 . A A . 30 ARG HB2 1 1 4 1761 1 1 30 ARG HB3 H -6.602 3.566 -4.117 1.00 . A A . 30 ARG HB3 1 1 4 1762 1 1 30 ARG HD2 H -4.888 1.727 -5.483 1.00 . A A . 30 ARG HD2 1 1 4 1763 1 1 30 ARG HD3 H -3.649 2.676 -5.002 1.00 . A A . 30 ARG HD3 1 1 4 1764 1 1 30 ARG HE H -2.564 0.879 -3.969 1.00 . A A . 30 ARG HE 1 1 4 1765 1 1 30 ARG HG2 H -4.619 3.132 -3.080 1.00 . A A . 30 ARG HG2 1 1 4 1766 1 1 30 ARG HG3 H -5.001 1.565 -2.827 1.00 . A A . 30 ARG HG3 1 1 4 1767 1 1 30 ARG HH11 H -5.592 -0.258 -5.369 1.00 . A A . 30 ARG HH11 1 1 4 1768 1 1 30 ARG HH12 H -5.491 -1.742 -4.481 1.00 . A A . 30 ARG HH12 1 1 4 1769 1 1 30 ARG HH21 H -2.672 -0.890 -2.734 1.00 . A A . 30 ARG HH21 1 1 4 1770 1 1 30 ARG HH22 H -3.888 -2.086 -3.032 1.00 . A A . 30 ARG HH22 1 1 4 1771 1 1 30 ARG N N -7.539 1.062 -2.156 1.00 . A A . 30 ARG N 1 1 4 1772 1 1 30 ARG NE N -3.453 0.732 -4.443 1.00 . A A . 30 ARG NE 1 1 4 1773 1 1 30 ARG NH1 N -5.114 -0.846 -4.716 1.00 . A A . 30 ARG NH1 1 1 4 1774 1 1 30 ARG NH2 N -3.478 -1.198 -3.239 1.00 . A A . 30 ARG NH2 1 1 4 1775 1 1 30 ARG O O -8.612 4.319 -1.684 1.00 . A A . 30 ARG O 1 1 4 1776 1 1 31 NH2 HN1 H -9.498 2.156 -3.764 1.00 . A A . 31 NH2 HN1 1 1 4 1777 1 1 31 NH2 HN2 H -10.422 3.542 -3.174 1.00 . A A . 31 NH2 HN2 1 1 4 1778 1 1 31 NH2 N N -9.581 2.989 -3.194 1.00 . A A . 31 NH2 N 1 1 4 1779 2 2 1 NAG C1 C -8.216 13.859 0.999 1.00 . B A . 32 NAG C1 1 1 4 1780 2 2 1 NAG C2 C -8.155 12.508 1.714 1.00 . B A . 32 NAG C2 1 1 4 1781 2 2 1 NAG C3 C -6.885 12.440 2.580 1.00 . B A . 32 NAG C3 1 1 4 1782 2 2 1 NAG C4 C -5.650 12.898 1.802 1.00 . B A . 32 NAG C4 1 1 4 1783 2 2 1 NAG C5 C -5.918 14.298 1.262 1.00 . B A . 32 NAG C5 1 1 4 1784 2 2 1 NAG C6 C -4.652 14.865 0.588 1.00 . B A . 32 NAG C6 1 1 4 1785 2 2 1 NAG C7 C -9.921 11.135 2.837 1.00 . B A . 32 NAG C7 1 1 4 1786 2 2 1 NAG C8 C -11.219 11.210 3.582 1.00 . B A . 32 NAG C8 1 1 4 1787 2 2 1 NAG H1 H -8.496 14.652 1.697 1.00 . B A . 32 NAG H1 1 1 4 1788 2 2 1 NAG H2 H -8.067 11.745 0.939 1.00 . B A . 32 NAG H2 1 1 4 1789 2 2 1 NAG H3 H -7.010 13.066 3.464 1.00 . B A . 32 NAG H3 1 1 4 1790 2 2 1 NAG H4 H -5.505 12.237 0.947 1.00 . B A . 32 NAG H4 1 1 4 1791 2 2 1 NAG H5 H -6.190 14.972 2.075 1.00 . B A . 32 NAG H5 1 1 4 1792 2 2 1 NAG H61 H -3.965 15.206 1.364 1.00 . B A . 32 NAG H61 1 1 4 1793 2 2 1 NAG H62 H -4.919 15.725 -0.029 1.00 . B A . 32 NAG H62 1 1 4 1794 2 2 1 NAG H81 H -11.057 11.720 4.528 1.00 . B A . 32 NAG H81 1 1 4 1795 2 2 1 NAG H82 H -11.949 11.740 2.974 1.00 . B A . 32 NAG H82 1 1 4 1796 2 2 1 NAG H83 H -11.559 10.194 3.762 1.00 . B A . 32 NAG H83 1 1 4 1797 2 2 1 NAG HN2 H -9.936 13.103 2.774 1.00 . B A . 32 NAG HN2 1 1 4 1798 2 2 1 NAG HO1 H -8.745 14.312 -0.730 1.00 . B A . 32 NAG HO1 1 1 4 1799 2 2 1 NAG HO3 H -5.869 11.163 3.564 1.00 . B A . 32 NAG HO3 1 1 4 1800 2 2 1 NAG HO4 H 2.878 7.393 8.042 1.00 . B A . 32 NAG HO4 1 1 4 1801 2 2 1 NAG HO6 H -4.459 13.790 -1.017 1.00 . B A . 32 NAG HO6 1 1 4 1802 2 2 1 NAG N2 N -9.381 12.303 2.517 1.00 . B A . 32 NAG N2 1 1 4 1803 2 2 1 NAG O1 O -9.132 13.799 -0.015 1.00 . B A . 32 NAG O1 1 1 4 1804 2 2 1 NAG O3 O -6.644 11.107 2.977 1.00 . B A . 32 NAG O3 1 1 4 1805 2 2 1 NAG O4 O -4.472 12.930 2.638 1.00 . B A . 32 NAG O4 1 1 4 1806 2 2 1 NAG O5 O -6.998 14.194 0.351 1.00 . B A . 32 NAG O5 1 1 4 1807 2 2 1 NAG O6 O -3.957 13.910 -0.203 1.00 . B A . 32 NAG O6 1 1 4 1808 2 2 1 NAG O7 O -9.424 10.046 2.576 1.00 . B A . 32 NAG O7 1 1 5 1809 1 1 1 VAL C C 4.864 0.954 6.263 1.00 . A A . 1 VAL C 1 1 5 1810 1 1 1 VAL CA C 5.030 -0.507 5.890 1.00 . A A . 1 VAL CA 1 1 5 1811 1 1 1 VAL CB C 5.295 -1.371 7.128 1.00 . A A . 1 VAL CB 1 1 5 1812 1 1 1 VAL CG1 C 5.079 -2.841 6.763 1.00 . A A . 1 VAL CG1 1 1 5 1813 1 1 1 VAL CG2 C 6.703 -1.208 7.708 1.00 . A A . 1 VAL CG2 1 1 5 1814 1 1 1 VAL H1 H 6.911 -0.053 5.092 1.00 . A A . 1 VAL H1 1 1 5 1815 1 1 1 VAL H2 H 5.783 -0.245 3.989 1.00 . A A . 1 VAL H2 1 1 5 1816 1 1 1 VAL H3 H 6.384 -1.586 4.733 1.00 . A A . 1 VAL H3 1 1 5 1817 1 1 1 VAL HA H 4.091 -0.840 5.455 1.00 . A A . 1 VAL HA 1 1 5 1818 1 1 1 VAL HB H 4.564 -1.107 7.894 1.00 . A A . 1 VAL HB 1 1 5 1819 1 1 1 VAL HG11 H 4.084 -2.977 6.338 1.00 . A A . 1 VAL HG11 1 1 5 1820 1 1 1 VAL HG12 H 5.827 -3.188 6.050 1.00 . A A . 1 VAL HG12 1 1 5 1821 1 1 1 VAL HG13 H 5.154 -3.449 7.665 1.00 . A A . 1 VAL HG13 1 1 5 1822 1 1 1 VAL HG21 H 7.469 -1.518 6.997 1.00 . A A . 1 VAL HG21 1 1 5 1823 1 1 1 VAL HG22 H 6.880 -0.170 7.995 1.00 . A A . 1 VAL HG22 1 1 5 1824 1 1 1 VAL HG23 H 6.793 -1.825 8.602 1.00 . A A . 1 VAL HG23 1 1 5 1825 1 1 1 VAL N N 6.095 -0.632 4.871 1.00 . A A . 1 VAL N 1 1 5 1826 1 1 1 VAL O O 5.858 1.628 6.500 1.00 . A A . 1 VAL O 1 1 5 1827 1 1 2 GLY C C 3.823 3.515 4.893 1.00 . A A . 2 GLY C 1 1 5 1828 1 1 2 GLY CA C 3.444 2.939 6.253 1.00 . A A . 2 GLY CA 1 1 5 1829 1 1 2 GLY H H 2.838 0.944 5.931 1.00 . A A . 2 GLY H 1 1 5 1830 1 1 2 GLY HA2 H 2.395 3.161 6.449 1.00 . A A . 2 GLY HA2 1 1 5 1831 1 1 2 GLY HA3 H 4.061 3.396 7.027 1.00 . A A . 2 GLY HA3 1 1 5 1832 1 1 2 GLY N N 3.643 1.492 6.221 1.00 . A A . 2 GLY N 1 1 5 1833 1 1 2 GLY O O 2.957 3.933 4.135 1.00 . A A . 2 GLY O 1 1 5 1834 1 1 3 GLU C C 5.371 2.162 2.417 1.00 . A A . 3 GLU C 1 1 5 1835 1 1 3 GLU CA C 5.572 3.496 3.151 1.00 . A A . 3 GLU CA 1 1 5 1836 1 1 3 GLU CB C 7.046 3.947 3.144 1.00 . A A . 3 GLU CB 1 1 5 1837 1 1 3 GLU CD C 8.503 1.854 3.600 1.00 . A A . 3 GLU CD 1 1 5 1838 1 1 3 GLU CG C 8.033 3.229 4.089 1.00 . A A . 3 GLU CG 1 1 5 1839 1 1 3 GLU H H 5.706 2.962 5.214 1.00 . A A . 3 GLU H 1 1 5 1840 1 1 3 GLU HA H 4.994 4.252 2.620 1.00 . A A . 3 GLU HA 1 1 5 1841 1 1 3 GLU HB2 H 7.388 3.828 2.212 1.00 . A A . 3 GLU HB2 1 1 5 1842 1 1 3 GLU HB3 H 7.060 4.918 3.383 1.00 . A A . 3 GLU HB3 1 1 5 1843 1 1 3 GLU HG2 H 8.838 3.812 4.200 1.00 . A A . 3 GLU HG2 1 1 5 1844 1 1 3 GLU HG3 H 7.584 3.108 4.974 1.00 . A A . 3 GLU HG3 1 1 5 1845 1 1 3 GLU N N 5.101 3.409 4.533 1.00 . A A . 3 GLU N 1 1 5 1846 1 1 3 GLU O O 5.190 1.127 3.056 1.00 . A A . 3 GLU O 1 1 5 1847 1 1 3 GLU OE1 O 9.401 1.834 2.721 1.00 . A A . 3 GLU OE1 1 1 5 1848 1 1 3 GLU OE2 O 7.986 0.832 4.103 1.00 . A A . 3 GLU OE2 1 1 5 1849 1 1 4 CYS C C 7.009 0.662 -0.047 1.00 . A A . 4 CYS C 1 1 5 1850 1 1 4 CYS CA C 5.550 0.909 0.321 1.00 . A A . 4 CYS CA 1 1 5 1851 1 1 4 CYS CB C 4.723 0.926 -0.966 1.00 . A A . 4 CYS CB 1 1 5 1852 1 1 4 CYS H H 5.410 3.039 0.580 1.00 . A A . 4 CYS H 1 1 5 1853 1 1 4 CYS HA H 5.203 0.071 0.926 1.00 . A A . 4 CYS HA 1 1 5 1854 1 1 4 CYS HB2 H 5.133 1.596 -1.585 1.00 . A A . 4 CYS HB2 1 1 5 1855 1 1 4 CYS HB3 H 4.776 0.016 -1.377 1.00 . A A . 4 CYS HB3 1 1 5 1856 1 1 4 CYS N N 5.419 2.153 1.080 1.00 . A A . 4 CYS N 1 1 5 1857 1 1 4 CYS O O 7.761 1.579 -0.390 1.00 . A A . 4 CYS O 1 1 5 1858 1 1 4 CYS SG S 2.981 1.345 -0.774 1.00 . A A . 4 CYS SG 1 1 5 1859 1 1 5 VAL C C 8.932 -1.001 -1.886 1.00 . A A . 5 VAL C 1 1 5 1860 1 1 5 VAL CA C 8.719 -1.099 -0.386 1.00 . A A . 5 VAL CA 1 1 5 1861 1 1 5 VAL CB C 8.908 -2.528 0.149 1.00 . A A . 5 VAL CB 1 1 5 1862 1 1 5 VAL CG1 C 10.349 -3.003 -0.051 1.00 . A A . 5 VAL CG1 1 1 5 1863 1 1 5 VAL CG2 C 8.611 -2.572 1.652 1.00 . A A . 5 VAL CG2 1 1 5 1864 1 1 5 VAL H H 6.624 -1.288 -0.119 1.00 . A A . 5 VAL H 1 1 5 1865 1 1 5 VAL HA H 9.442 -0.458 0.115 1.00 . A A . 5 VAL HA 1 1 5 1866 1 1 5 VAL HB H 8.223 -3.211 -0.355 1.00 . A A . 5 VAL HB 1 1 5 1867 1 1 5 VAL HG11 H 10.595 -3.053 -1.112 1.00 . A A . 5 VAL HG11 1 1 5 1868 1 1 5 VAL HG12 H 11.040 -2.325 0.449 1.00 . A A . 5 VAL HG12 1 1 5 1869 1 1 5 VAL HG13 H 10.465 -4.001 0.371 1.00 . A A . 5 VAL HG13 1 1 5 1870 1 1 5 VAL HG21 H 8.795 -3.576 2.035 1.00 . A A . 5 VAL HG21 1 1 5 1871 1 1 5 VAL HG22 H 9.253 -1.865 2.178 1.00 . A A . 5 VAL HG22 1 1 5 1872 1 1 5 VAL HG23 H 7.572 -2.311 1.845 1.00 . A A . 5 VAL HG23 1 1 5 1873 1 1 5 VAL N N 7.378 -0.613 -0.102 1.00 . A A . 5 VAL N 1 1 5 1874 1 1 5 VAL O O 8.795 -1.979 -2.616 1.00 . A A . 5 VAL O 1 1 5 1875 1 1 6 ARG C C 8.415 0.015 -4.691 1.00 . A A . 6 ARG C 1 1 5 1876 1 1 6 ARG CA C 9.454 0.601 -3.731 1.00 . A A . 6 ARG CA 1 1 5 1877 1 1 6 ARG CB C 10.906 0.216 -4.067 1.00 . A A . 6 ARG CB 1 1 5 1878 1 1 6 ARG CD C 12.029 1.042 -1.849 1.00 . A A . 6 ARG CD 1 1 5 1879 1 1 6 ARG CG C 11.973 1.095 -3.387 1.00 . A A . 6 ARG CG 1 1 5 1880 1 1 6 ARG CZ C 10.768 2.084 0.050 1.00 . A A . 6 ARG CZ 1 1 5 1881 1 1 6 ARG H H 8.991 0.971 -1.666 1.00 . A A . 6 ARG H 1 1 5 1882 1 1 6 ARG HA H 9.343 1.678 -3.835 1.00 . A A . 6 ARG HA 1 1 5 1883 1 1 6 ARG HB2 H 11.052 -0.731 -3.780 1.00 . A A . 6 ARG HB2 1 1 5 1884 1 1 6 ARG HB3 H 11.027 0.288 -5.057 1.00 . A A . 6 ARG HB3 1 1 5 1885 1 1 6 ARG HD2 H 11.744 0.132 -1.549 1.00 . A A . 6 ARG HD2 1 1 5 1886 1 1 6 ARG HD3 H 12.970 1.211 -1.556 1.00 . A A . 6 ARG HD3 1 1 5 1887 1 1 6 ARG HE H 10.831 2.818 -1.780 1.00 . A A . 6 ARG HE 1 1 5 1888 1 1 6 ARG HG2 H 12.867 0.810 -3.733 1.00 . A A . 6 ARG HG2 1 1 5 1889 1 1 6 ARG HG3 H 11.799 2.043 -3.652 1.00 . A A . 6 ARG HG3 1 1 5 1890 1 1 6 ARG HH11 H 11.895 0.572 0.729 1.00 . A A . 6 ARG HH11 1 1 5 1891 1 1 6 ARG HH12 H 10.896 1.349 1.911 1.00 . A A . 6 ARG HH12 1 1 5 1892 1 1 6 ARG HH21 H 9.413 3.527 -0.240 1.00 . A A . 6 ARG HH21 1 1 5 1893 1 1 6 ARG HH22 H 9.552 2.944 1.386 1.00 . A A . 6 ARG HH22 1 1 5 1894 1 1 6 ARG N N 9.156 0.234 -2.344 1.00 . A A . 6 ARG N 1 1 5 1895 1 1 6 ARG NE N 11.150 2.045 -1.219 1.00 . A A . 6 ARG NE 1 1 5 1896 1 1 6 ARG NH1 N 11.222 1.271 0.969 1.00 . A A . 6 ARG NH1 1 1 5 1897 1 1 6 ARG NH2 N 9.839 2.916 0.428 1.00 . A A . 6 ARG NH2 1 1 5 1898 1 1 6 ARG O O 8.717 -0.424 -5.793 1.00 . A A . 6 ARG O 1 1 5 1899 1 1 7 GLY C C 5.381 -1.744 -4.318 1.00 . A A . 7 GLY C 1 1 5 1900 1 1 7 GLY CA C 5.987 -0.468 -4.915 1.00 . A A . 7 GLY CA 1 1 5 1901 1 1 7 GLY H H 7.083 0.480 -3.319 1.00 . A A . 7 GLY H 1 1 5 1902 1 1 7 GLY HA2 H 5.219 0.305 -4.900 1.00 . A A . 7 GLY HA2 1 1 5 1903 1 1 7 GLY HA3 H 6.234 -0.673 -5.957 1.00 . A A . 7 GLY HA3 1 1 5 1904 1 1 7 GLY N N 7.171 0.027 -4.214 1.00 . A A . 7 GLY N 1 1 5 1905 1 1 7 GLY O O 4.246 -2.074 -4.652 1.00 . A A . 7 GLY O 1 1 5 1906 1 1 8 ARG C C 5.298 -3.413 -1.302 1.00 . A A . 8 ARG C 1 1 5 1907 1 1 8 ARG CA C 5.557 -3.667 -2.781 1.00 . A A . 8 ARG CA 1 1 5 1908 1 1 8 ARG CB C 6.544 -4.829 -3.002 1.00 . A A . 8 ARG CB 1 1 5 1909 1 1 8 ARG CD C 6.631 -7.361 -2.803 1.00 . A A . 8 ARG CD 1 1 5 1910 1 1 8 ARG CG C 5.819 -6.157 -3.295 1.00 . A A . 8 ARG CG 1 1 5 1911 1 1 8 ARG CZ C 5.469 -9.510 -2.209 1.00 . A A . 8 ARG CZ 1 1 5 1912 1 1 8 ARG H H 7.007 -2.144 -3.132 1.00 . A A . 8 ARG H 1 1 5 1913 1 1 8 ARG HA H 4.596 -3.936 -3.221 1.00 . A A . 8 ARG HA 1 1 5 1914 1 1 8 ARG HB2 H 7.135 -4.607 -3.777 1.00 . A A . 8 ARG HB2 1 1 5 1915 1 1 8 ARG HB3 H 7.101 -4.940 -2.179 1.00 . A A . 8 ARG HB3 1 1 5 1916 1 1 8 ARG HD2 H 7.520 -7.360 -3.260 1.00 . A A . 8 ARG HD2 1 1 5 1917 1 1 8 ARG HD3 H 6.764 -7.280 -1.815 1.00 . A A . 8 ARG HD3 1 1 5 1918 1 1 8 ARG HE H 5.922 -8.922 -4.056 1.00 . A A . 8 ARG HE 1 1 5 1919 1 1 8 ARG HG2 H 4.933 -6.152 -2.832 1.00 . A A . 8 ARG HG2 1 1 5 1920 1 1 8 ARG HG3 H 5.680 -6.240 -4.282 1.00 . A A . 8 ARG HG3 1 1 5 1921 1 1 8 ARG HH11 H 5.667 -8.378 -0.567 1.00 . A A . 8 ARG HH11 1 1 5 1922 1 1 8 ARG HH12 H 5.006 -9.959 -0.312 1.00 . A A . 8 ARG HH12 1 1 5 1923 1 1 8 ARG HH21 H 5.094 -10.963 -3.541 1.00 . A A . 8 ARG HH21 1 1 5 1924 1 1 8 ARG HH22 H 4.700 -11.337 -1.896 1.00 . A A . 8 ARG HH22 1 1 5 1925 1 1 8 ARG N N 6.079 -2.452 -3.417 1.00 . A A . 8 ARG N 1 1 5 1926 1 1 8 ARG NE N 5.946 -8.637 -3.091 1.00 . A A . 8 ARG NE 1 1 5 1927 1 1 8 ARG NH1 N 5.373 -9.263 -0.929 1.00 . A A . 8 ARG NH1 1 1 5 1928 1 1 8 ARG NH2 N 5.055 -10.697 -2.578 1.00 . A A . 8 ARG NH2 1 1 5 1929 1 1 8 ARG O O 5.390 -2.293 -0.814 1.00 . A A . 8 ARG O 1 1 5 1930 1 1 9 CYS C C 5.139 -6.036 1.231 1.00 . A A . 9 CYS C 1 1 5 1931 1 1 9 CYS CA C 5.095 -4.544 0.872 1.00 . A A . 9 CYS CA 1 1 5 1932 1 1 9 CYS CB C 3.937 -3.749 1.473 1.00 . A A . 9 CYS CB 1 1 5 1933 1 1 9 CYS H H 4.827 -5.346 -1.039 1.00 . A A . 9 CYS H 1 1 5 1934 1 1 9 CYS HA H 6.040 -4.097 1.182 1.00 . A A . 9 CYS HA 1 1 5 1935 1 1 9 CYS HB2 H 3.399 -3.350 0.731 1.00 . A A . 9 CYS HB2 1 1 5 1936 1 1 9 CYS HB3 H 3.362 -4.369 2.007 1.00 . A A . 9 CYS HB3 1 1 5 1937 1 1 9 CYS N N 4.995 -4.471 -0.573 1.00 . A A . 9 CYS N 1 1 5 1938 1 1 9 CYS O O 5.154 -6.851 0.300 1.00 . A A . 9 CYS O 1 1 5 1939 1 1 9 CYS SG S 4.524 -2.418 2.553 1.00 . A A . 9 CYS SG 1 1 5 1940 1 1 10 PRO C C 3.981 -8.579 2.370 1.00 . A A . 10 PRO C 1 1 5 1941 1 1 10 PRO CA C 5.262 -7.874 2.816 1.00 . A A . 10 PRO CA 1 1 5 1942 1 1 10 PRO CB C 5.495 -7.977 4.322 1.00 . A A . 10 PRO CB 1 1 5 1943 1 1 10 PRO CD C 5.266 -5.656 3.719 1.00 . A A . 10 PRO CD 1 1 5 1944 1 1 10 PRO CG C 4.992 -6.638 4.859 1.00 . A A . 10 PRO CG 1 1 5 1945 1 1 10 PRO HA H 6.108 -8.326 2.295 1.00 . A A . 10 PRO HA 1 1 5 1946 1 1 10 PRO HB2 H 4.974 -8.736 4.712 1.00 . A A . 10 PRO HB2 1 1 5 1947 1 1 10 PRO HB3 H 6.466 -8.100 4.525 1.00 . A A . 10 PRO HB3 1 1 5 1948 1 1 10 PRO HD2 H 4.569 -4.939 3.699 1.00 . A A . 10 PRO HD2 1 1 5 1949 1 1 10 PRO HD3 H 6.169 -5.240 3.824 1.00 . A A . 10 PRO HD3 1 1 5 1950 1 1 10 PRO HG2 H 4.014 -6.682 5.063 1.00 . A A . 10 PRO HG2 1 1 5 1951 1 1 10 PRO HG3 H 5.493 -6.375 5.683 1.00 . A A . 10 PRO HG3 1 1 5 1952 1 1 10 PRO N N 5.211 -6.452 2.507 1.00 . A A . 10 PRO N 1 1 5 1953 1 1 10 PRO O O 2.902 -7.983 2.328 1.00 . A A . 10 PRO O 1 1 5 1954 1 1 11 SER C C 1.878 -10.903 2.278 1.00 . A A . 11 SER C 1 1 5 1955 1 1 11 SER CA C 3.070 -10.647 1.360 1.00 . A A . 11 SER CA 1 1 5 1956 1 1 11 SER CB C 3.626 -11.972 0.856 1.00 . A A . 11 SER CB 1 1 5 1957 1 1 11 SER H H 5.020 -10.290 2.174 1.00 . A A . 11 SER H 1 1 5 1958 1 1 11 SER HA H 2.711 -10.090 0.495 1.00 . A A . 11 SER HA 1 1 5 1959 1 1 11 SER HB2 H 3.960 -12.505 1.633 1.00 . A A . 11 SER HB2 1 1 5 1960 1 1 11 SER HB3 H 2.899 -12.478 0.391 1.00 . A A . 11 SER HB3 1 1 5 1961 1 1 11 SER HG H 5.243 -12.551 -0.021 1.00 . A A . 11 SER HG 1 1 5 1962 1 1 11 SER N N 4.117 -9.862 2.021 1.00 . A A . 11 SER N 1 1 5 1963 1 1 11 SER O O 1.720 -11.980 2.842 1.00 . A A . 11 SER O 1 1 5 1964 1 1 11 SER OG O 4.696 -11.751 -0.053 1.00 . A A . 11 SER OG 1 1 5 1965 1 1 12 GLY C C -0.532 -8.398 3.646 1.00 . A A . 12 GLY C 1 1 5 1966 1 1 12 GLY CA C -0.096 -9.828 3.313 1.00 . A A . 12 GLY CA 1 1 5 1967 1 1 12 GLY H H 1.351 -9.047 1.913 1.00 . A A . 12 GLY H 1 1 5 1968 1 1 12 GLY HA2 H -0.934 -10.347 2.848 1.00 . A A . 12 GLY HA2 1 1 5 1969 1 1 12 GLY HA3 H 0.152 -10.337 4.245 1.00 . A A . 12 GLY HA3 1 1 5 1970 1 1 12 GLY N N 1.049 -9.877 2.412 1.00 . A A . 12 GLY N 1 1 5 1971 1 1 12 GLY O O -1.710 -8.189 3.941 1.00 . A A . 12 GLY O 1 1 5 1972 1 1 13 MET C C -0.310 -5.577 2.072 1.00 . A A . 13 MET C 1 1 5 1973 1 1 13 MET CA C -0.008 -5.996 3.515 1.00 . A A . 13 MET CA 1 1 5 1974 1 1 13 MET CB C 1.137 -5.143 4.078 1.00 . A A . 13 MET CB 1 1 5 1975 1 1 13 MET CE C 0.830 -5.260 8.259 1.00 . A A . 13 MET CE 1 1 5 1976 1 1 13 MET CG C 1.400 -5.402 5.563 1.00 . A A . 13 MET CG 1 1 5 1977 1 1 13 MET H H 1.320 -7.637 3.271 1.00 . A A . 13 MET H 1 1 5 1978 1 1 13 MET HA H -0.904 -5.827 4.113 1.00 . A A . 13 MET HA 1 1 5 1979 1 1 13 MET HB2 H 1.970 -5.350 3.566 1.00 . A A . 13 MET HB2 1 1 5 1980 1 1 13 MET HB3 H 0.904 -4.178 3.959 1.00 . A A . 13 MET HB3 1 1 5 1981 1 1 13 MET HE1 H 0.176 -4.936 9.068 1.00 . A A . 13 MET HE1 1 1 5 1982 1 1 13 MET HE2 H 0.920 -6.346 8.282 1.00 . A A . 13 MET HE2 1 1 5 1983 1 1 13 MET HE3 H 1.816 -4.813 8.391 1.00 . A A . 13 MET HE3 1 1 5 1984 1 1 13 MET HG2 H 1.453 -6.391 5.704 1.00 . A A . 13 MET HG2 1 1 5 1985 1 1 13 MET HG3 H 2.275 -4.983 5.804 1.00 . A A . 13 MET HG3 1 1 5 1986 1 1 13 MET N N 0.367 -7.410 3.548 1.00 . A A . 13 MET N 1 1 5 1987 1 1 13 MET O O -0.068 -6.335 1.134 1.00 . A A . 13 MET O 1 1 5 1988 1 1 13 MET SD S 0.132 -4.740 6.670 1.00 . A A . 13 MET SD 1 1 5 1989 1 1 14 CYS C C -0.571 -2.391 0.426 1.00 . A A . 14 CYS C 1 1 5 1990 1 1 14 CYS CA C -1.139 -3.813 0.569 1.00 . A A . 14 CYS CA 1 1 5 1991 1 1 14 CYS CB C -2.663 -3.819 0.386 1.00 . A A . 14 CYS CB 1 1 5 1992 1 1 14 CYS H H -0.999 -3.759 2.680 1.00 . A A . 14 CYS H 1 1 5 1993 1 1 14 CYS HA H -0.692 -4.440 -0.204 1.00 . A A . 14 CYS HA 1 1 5 1994 1 1 14 CYS HB2 H -3.024 -2.999 0.830 1.00 . A A . 14 CYS HB2 1 1 5 1995 1 1 14 CYS HB3 H -2.850 -3.778 -0.595 1.00 . A A . 14 CYS HB3 1 1 5 1996 1 1 14 CYS N N -0.814 -4.357 1.883 1.00 . A A . 14 CYS N 1 1 5 1997 1 1 14 CYS O O -0.162 -1.778 1.414 1.00 . A A . 14 CYS O 1 1 5 1998 1 1 14 CYS SG S -3.564 -5.252 1.059 1.00 . A A . 14 CYS SG 1 1 5 1999 1 1 15 CYS C C -1.002 0.361 -1.811 1.00 . A A . 15 CYS C 1 1 5 2000 1 1 15 CYS CA C 0.021 -0.549 -1.118 1.00 . A A . 15 CYS CA 1 1 5 2001 1 1 15 CYS CB C 1.236 -0.777 -2.029 1.00 . A A . 15 CYS CB 1 1 5 2002 1 1 15 CYS H H -0.931 -2.390 -1.568 1.00 . A A . 15 CYS H 1 1 5 2003 1 1 15 CYS HA H 0.357 -0.054 -0.207 1.00 . A A . 15 CYS HA 1 1 5 2004 1 1 15 CYS HB2 H 1.880 -1.372 -1.548 1.00 . A A . 15 CYS HB2 1 1 5 2005 1 1 15 CYS HB3 H 0.921 -1.231 -2.863 1.00 . A A . 15 CYS HB3 1 1 5 2006 1 1 15 CYS N N -0.553 -1.856 -0.800 1.00 . A A . 15 CYS N 1 1 5 2007 1 1 15 CYS O O -1.708 -0.075 -2.727 1.00 . A A . 15 CYS O 1 1 5 2008 1 1 15 CYS SG S 2.112 0.736 -2.505 1.00 . A A . 15 CYS SG 1 1 5 2009 1 1 16 SER C C -0.924 3.316 -3.198 1.00 . A A . 16 SER C 1 1 5 2010 1 1 16 SER CA C -1.810 2.656 -2.145 1.00 . A A . 16 SER CA 1 1 5 2011 1 1 16 SER CB C -2.376 3.710 -1.187 1.00 . A A . 16 SER CB 1 1 5 2012 1 1 16 SER H H -0.420 1.961 -0.705 1.00 . A A . 16 SER H 1 1 5 2013 1 1 16 SER HA H -2.660 2.194 -2.636 1.00 . A A . 16 SER HA 1 1 5 2014 1 1 16 SER HB2 H -3.074 4.242 -1.667 1.00 . A A . 16 SER HB2 1 1 5 2015 1 1 16 SER HB3 H -2.790 3.246 -0.404 1.00 . A A . 16 SER HB3 1 1 5 2016 1 1 16 SER HG H -1.669 4.960 0.130 1.00 . A A . 16 SER HG 1 1 5 2017 1 1 16 SER N N -1.058 1.637 -1.424 1.00 . A A . 16 SER N 1 1 5 2018 1 1 16 SER O O 0.285 3.470 -3.026 1.00 . A A . 16 SER O 1 1 5 2019 1 1 16 SER OG O -1.370 4.589 -0.720 1.00 . A A . 16 SER OG 1 1 5 2020 1 1 17 GLN C C -0.231 5.876 -4.862 1.00 . A A . 17 GLN C 1 1 5 2021 1 1 17 GLN CA C -0.843 4.543 -5.328 1.00 . A A . 17 GLN CA 1 1 5 2022 1 1 17 GLN CB C -1.745 4.695 -6.555 1.00 . A A . 17 GLN CB 1 1 5 2023 1 1 17 GLN CD C -4.167 4.158 -6.080 1.00 . A A . 17 GLN CD 1 1 5 2024 1 1 17 GLN CG C -3.113 5.258 -6.179 1.00 . A A . 17 GLN CG 1 1 5 2025 1 1 17 GLN H H -2.528 3.636 -4.392 1.00 . A A . 17 GLN H 1 1 5 2026 1 1 17 GLN HA H -0.013 3.942 -5.660 1.00 . A A . 17 GLN HA 1 1 5 2027 1 1 17 GLN HB2 H -1.306 5.315 -7.205 1.00 . A A . 17 GLN HB2 1 1 5 2028 1 1 17 GLN HB3 H -1.869 3.798 -6.980 1.00 . A A . 17 GLN HB3 1 1 5 2029 1 1 17 GLN HE21 H -5.259 4.918 -7.613 1.00 . A A . 17 GLN HE21 1 1 5 2030 1 1 17 GLN HE22 H -5.849 3.439 -6.870 1.00 . A A . 17 GLN HE22 1 1 5 2031 1 1 17 GLN HG2 H -3.042 5.719 -5.295 1.00 . A A . 17 GLN HG2 1 1 5 2032 1 1 17 GLN HG3 H -3.396 5.916 -6.877 1.00 . A A . 17 GLN HG3 1 1 5 2033 1 1 17 GLN N N -1.538 3.805 -4.275 1.00 . A A . 17 GLN N 1 1 5 2034 1 1 17 GLN NE2 N -5.184 4.189 -6.922 1.00 . A A . 17 GLN NE2 1 1 5 2035 1 1 17 GLN O O 0.426 6.557 -5.640 1.00 . A A . 17 GLN O 1 1 5 2036 1 1 17 GLN OE1 O -4.075 3.251 -5.256 1.00 . A A . 17 GLN OE1 1 1 5 2037 1 1 18 . C C 1.739 6.862 -2.436 1.00 . A A . 18 PFF C 1 1 5 2038 1 1 18 . CA C 0.361 7.313 -2.950 1.00 . A A . 18 PFF CA 1 1 5 2039 1 1 18 . CB C -0.497 7.861 -1.808 1.00 . A A . 18 PFF CB 1 1 5 2040 1 1 18 . CD1 C -1.962 9.433 -3.144 1.00 . A A . 18 PFF CD1 1 1 5 2041 1 1 18 . CD2 C -3.001 7.544 -2.015 1.00 . A A . 18 PFF CD2 1 1 5 2042 1 1 18 . CE1 C -3.180 9.718 -3.786 1.00 . A A . 18 PFF CE1 1 1 5 2043 1 1 18 . CE2 C -4.220 7.832 -2.652 1.00 . A A . 18 PFF CE2 1 1 5 2044 1 1 18 . CG C -1.861 8.329 -2.279 1.00 . A A . 18 PFF CG 1 1 5 2045 1 1 18 . CZ C -4.303 8.903 -3.559 1.00 . A A . 18 PFF CZ 1 1 5 2046 1 1 18 . F F -5.467 9.150 -4.215 1.00 . A A . 18 PFF F 1 1 5 2047 1 1 18 . H H -0.924 5.635 -2.972 1.00 . A A . 18 PFF H 1 1 5 2048 1 1 18 . HA H 0.527 8.112 -3.674 1.00 . A A . 18 PFF HA 1 1 5 2049 1 1 18 . HB2 H -0.637 7.055 -1.091 1.00 . A A . 18 PFF HB2 1 1 5 2050 1 1 18 . HB3 H 0.037 8.669 -1.303 1.00 . A A . 18 PFF HB3 1 1 5 2051 1 1 18 . HD1 H -1.084 10.023 -3.371 1.00 . A A . 18 PFF HD1 1 1 5 2052 1 1 18 . HD2 H -2.937 6.703 -1.340 1.00 . A A . 18 PFF HD2 1 1 5 2053 1 1 18 . HE1 H -3.247 10.546 -4.477 1.00 . A A . 18 PFF HE1 1 1 5 2054 1 1 18 . HE2 H -5.091 7.225 -2.456 1.00 . A A . 18 PFF HE2 1 1 5 2055 1 1 18 . N N -0.382 6.228 -3.582 1.00 . A A . 18 PFF N 1 1 5 2056 1 1 18 . O O 2.484 7.674 -1.896 1.00 . A A . 18 PFF O 1 1 5 2057 1 1 19 GLY C C 3.345 4.624 -0.654 1.00 . A A . 19 GLY C 1 1 5 2058 1 1 19 GLY CA C 3.371 5.052 -2.120 1.00 . A A . 19 GLY CA 1 1 5 2059 1 1 19 GLY H H 1.420 4.921 -2.978 1.00 . A A . 19 GLY H 1 1 5 2060 1 1 19 GLY HA2 H 3.636 4.184 -2.723 1.00 . A A . 19 GLY HA2 1 1 5 2061 1 1 19 GLY HA3 H 4.148 5.808 -2.245 1.00 . A A . 19 GLY HA3 1 1 5 2062 1 1 19 GLY N N 2.088 5.577 -2.581 1.00 . A A . 19 GLY N 1 1 5 2063 1 1 19 GLY O O 4.403 4.421 -0.055 1.00 . A A . 19 GLY O 1 1 5 2064 1 1 20 . C C 1.296 2.818 1.539 1.00 . A A . 20 PFF C 1 1 5 2065 1 1 20 . CA C 1.969 4.184 1.343 1.00 . A A . 20 PFF CA 1 1 5 2066 1 1 20 . CB C 1.110 5.309 1.915 1.00 . A A . 20 PFF CB 1 1 5 2067 1 1 20 . CD1 C 2.992 6.975 2.201 1.00 . A A . 20 PFF CD1 1 1 5 2068 1 1 20 . CD2 C 0.886 7.763 1.285 1.00 . A A . 20 PFF CD2 1 1 5 2069 1 1 20 . CE1 C 3.477 8.293 2.227 1.00 . A A . 20 PFF CE1 1 1 5 2070 1 1 20 . CE2 C 1.374 9.080 1.296 1.00 . A A . 20 PFF CE2 1 1 5 2071 1 1 20 . CG C 1.684 6.707 1.765 1.00 . A A . 20 PFF CG 1 1 5 2072 1 1 20 . CZ C 2.658 9.347 1.796 1.00 . A A . 20 PFF CZ 1 1 5 2073 1 1 20 . F F 3.127 10.623 1.815 1.00 . A A . 20 PFF F 1 1 5 2074 1 1 20 . H H 1.308 4.609 -0.603 1.00 . A A . 20 PFF H 1 1 5 2075 1 1 20 . HA H 2.935 4.168 1.836 1.00 . A A . 20 PFF HA 1 1 5 2076 1 1 20 . HB2 H 0.141 5.270 1.422 1.00 . A A . 20 PFF HB2 1 1 5 2077 1 1 20 . HB3 H 0.959 5.114 2.967 1.00 . A A . 20 PFF HB3 1 1 5 2078 1 1 20 . HD1 H 3.623 6.168 2.524 1.00 . A A . 20 PFF HD1 1 1 5 2079 1 1 20 . HD2 H -0.128 7.578 0.966 1.00 . A A . 20 PFF HD2 1 1 5 2080 1 1 20 . HE1 H 4.479 8.495 2.577 1.00 . A A . 20 PFF HE1 1 1 5 2081 1 1 20 . HE2 H 0.765 9.889 0.922 1.00 . A A . 20 PFF HE2 1 1 5 2082 1 1 20 . N N 2.152 4.486 -0.066 1.00 . A A . 20 PFF N 1 1 5 2083 1 1 20 . O O 0.444 2.435 0.741 1.00 . A A . 20 PFF O 1 1 5 2084 1 1 21 CYS C C 0.735 0.249 4.077 1.00 . A A . 21 CYS C 1 1 5 2085 1 1 21 CYS CA C 1.231 0.651 2.686 1.00 . A A . 21 CYS CA 1 1 5 2086 1 1 21 CYS CB C 2.370 -0.271 2.215 1.00 . A A . 21 CYS CB 1 1 5 2087 1 1 21 CYS H H 2.261 2.462 3.279 1.00 . A A . 21 CYS H 1 1 5 2088 1 1 21 CYS HA H 0.389 0.493 2.015 1.00 . A A . 21 CYS HA 1 1 5 2089 1 1 21 CYS HB2 H 2.089 -0.683 1.348 1.00 . A A . 21 CYS HB2 1 1 5 2090 1 1 21 CYS HB3 H 3.179 0.297 2.067 1.00 . A A . 21 CYS HB3 1 1 5 2091 1 1 21 CYS N N 1.654 2.054 2.576 1.00 . A A . 21 CYS N 1 1 5 2092 1 1 21 CYS O O 1.199 0.750 5.103 1.00 . A A . 21 CYS O 1 1 5 2093 1 1 21 CYS SG S 2.840 -1.621 3.343 1.00 . A A . 21 CYS SG 1 1 5 2094 1 1 22 GLY C C -1.849 -2.334 4.770 1.00 . A A . 22 GLY C 1 1 5 2095 1 1 22 GLY CA C -0.787 -1.345 5.247 1.00 . A A . 22 GLY CA 1 1 5 2096 1 1 22 GLY H H -0.410 -1.147 3.173 1.00 . A A . 22 GLY H 1 1 5 2097 1 1 22 GLY HA2 H -0.044 -1.870 5.846 1.00 . A A . 22 GLY HA2 1 1 5 2098 1 1 22 GLY HA3 H -1.260 -0.569 5.850 1.00 . A A . 22 GLY HA3 1 1 5 2099 1 1 22 GLY N N -0.154 -0.747 4.079 1.00 . A A . 22 GLY N 1 1 5 2100 1 1 22 GLY O O -2.008 -2.525 3.566 1.00 . A A . 22 GLY O 1 1 5 2101 1 1 23 LYS C C -5.061 -3.247 5.273 1.00 . A A . 23 LYS C 1 1 5 2102 1 1 23 LYS CA C -3.674 -3.891 5.286 1.00 . A A . 23 LYS CA 1 1 5 2103 1 1 23 LYS CB C -3.618 -5.162 6.151 1.00 . A A . 23 LYS CB 1 1 5 2104 1 1 23 LYS CD C -4.052 -7.649 6.208 1.00 . A A . 23 LYS CD 1 1 5 2105 1 1 23 LYS CE C -4.741 -8.835 5.524 1.00 . A A . 23 LYS CE 1 1 5 2106 1 1 23 LYS CG C -4.368 -6.329 5.496 1.00 . A A . 23 LYS CG 1 1 5 2107 1 1 23 LYS H H -2.349 -2.863 6.655 1.00 . A A . 23 LYS H 1 1 5 2108 1 1 23 LYS HA H -3.509 -4.175 4.254 1.00 . A A . 23 LYS HA 1 1 5 2109 1 1 23 LYS HB2 H -2.662 -5.424 6.280 1.00 . A A . 23 LYS HB2 1 1 5 2110 1 1 23 LYS HB3 H -4.034 -4.968 7.039 1.00 . A A . 23 LYS HB3 1 1 5 2111 1 1 23 LYS HD2 H -3.063 -7.796 6.195 1.00 . A A . 23 LYS HD2 1 1 5 2112 1 1 23 LYS HD3 H -4.369 -7.591 7.155 1.00 . A A . 23 LYS HD3 1 1 5 2113 1 1 23 LYS HE2 H -4.507 -9.674 6.015 1.00 . A A . 23 LYS HE2 1 1 5 2114 1 1 23 LYS HE3 H -5.731 -8.697 5.553 1.00 . A A . 23 LYS HE3 1 1 5 2115 1 1 23 LYS HG2 H -5.352 -6.156 5.548 1.00 . A A . 23 LYS HG2 1 1 5 2116 1 1 23 LYS HG3 H -4.091 -6.399 4.538 1.00 . A A . 23 LYS HG3 1 1 5 2117 1 1 23 LYS HZ1 H -3.298 -8.918 4.056 1.00 . A A . 23 LYS HZ1 1 1 5 2118 1 1 23 LYS HZ2 H -4.629 -9.842 3.713 1.00 . A A . 23 LYS HZ2 1 1 5 2119 1 1 23 LYS HZ3 H -4.671 -8.200 3.560 1.00 . A A . 23 LYS HZ3 1 1 5 2120 1 1 23 LYS N N -2.590 -2.973 5.679 1.00 . A A . 23 LYS N 1 1 5 2121 1 1 23 LYS NZ N -4.315 -8.969 4.111 1.00 . A A . 23 LYS NZ 1 1 5 2122 1 1 23 LYS O O -6.046 -3.874 4.901 1.00 . A A . 23 LYS O 1 1 5 2123 1 1 24 GLY C C -7.052 -0.957 4.421 1.00 . A A . 24 GLY C 1 1 5 2124 1 1 24 GLY CA C -6.409 -1.269 5.779 1.00 . A A . 24 GLY CA 1 1 5 2125 1 1 24 GLY H H -4.263 -1.530 5.851 1.00 . A A . 24 GLY H 1 1 5 2126 1 1 24 GLY HA2 H -7.082 -1.890 6.367 1.00 . A A . 24 GLY HA2 1 1 5 2127 1 1 24 GLY HA3 H -6.251 -0.332 6.313 1.00 . A A . 24 GLY HA3 1 1 5 2128 1 1 24 GLY N N -5.138 -1.977 5.654 1.00 . A A . 24 GLY N 1 1 5 2129 1 1 24 GLY O O -6.353 -0.862 3.404 1.00 . A A . 24 GLY O 1 1 5 2130 1 1 25 PRO C C -8.466 0.507 2.218 1.00 . A A . 25 PRO C 1 1 5 2131 1 1 25 PRO CA C -9.139 -0.472 3.178 1.00 . A A . 25 PRO CA 1 1 5 2132 1 1 25 PRO CB C -10.505 0.030 3.652 1.00 . A A . 25 PRO CB 1 1 5 2133 1 1 25 PRO CD C -9.265 -0.744 5.546 1.00 . A A . 25 PRO CD 1 1 5 2134 1 1 25 PRO CG C -10.683 -0.711 4.975 1.00 . A A . 25 PRO CG 1 1 5 2135 1 1 25 PRO HA H -9.274 -1.424 2.662 1.00 . A A . 25 PRO HA 1 1 5 2136 1 1 25 PRO HB2 H -10.499 1.020 3.790 1.00 . A A . 25 PRO HB2 1 1 5 2137 1 1 25 PRO HB3 H -11.225 -0.212 3.002 1.00 . A A . 25 PRO HB3 1 1 5 2138 1 1 25 PRO HD2 H -9.106 0.053 6.129 1.00 . A A . 25 PRO HD2 1 1 5 2139 1 1 25 PRO HD3 H -9.123 -1.579 6.077 1.00 . A A . 25 PRO HD3 1 1 5 2140 1 1 25 PRO HG2 H -11.304 -0.216 5.583 1.00 . A A . 25 PRO HG2 1 1 5 2141 1 1 25 PRO HG3 H -11.031 -1.636 4.824 1.00 . A A . 25 PRO HG3 1 1 5 2142 1 1 25 PRO N N -8.374 -0.717 4.395 1.00 . A A . 25 PRO N 1 1 5 2143 1 1 25 PRO O O -8.280 0.193 1.045 1.00 . A A . 25 PRO O 1 1 5 2144 1 1 26 LYS C C -6.021 2.296 1.338 1.00 . A A . 26 LYS C 1 1 5 2145 1 1 26 LYS CA C -7.414 2.677 1.845 1.00 . A A . 26 LYS CA 1 1 5 2146 1 1 26 LYS CB C -7.406 4.029 2.556 1.00 . A A . 26 LYS CB 1 1 5 2147 1 1 26 LYS CD C -8.928 6.002 3.082 1.00 . A A . 26 LYS CD 1 1 5 2148 1 1 26 LYS CE C -9.452 6.693 1.816 1.00 . A A . 26 LYS CE 1 1 5 2149 1 1 26 LYS CG C -8.828 4.477 2.925 1.00 . A A . 26 LYS CG 1 1 5 2150 1 1 26 LYS H H -8.189 1.901 3.675 1.00 . A A . 26 LYS H 1 1 5 2151 1 1 26 LYS HA H -8.030 2.773 0.957 1.00 . A A . 26 LYS HA 1 1 5 2152 1 1 26 LYS HB2 H -6.862 3.954 3.391 1.00 . A A . 26 LYS HB2 1 1 5 2153 1 1 26 LYS HB3 H -6.997 4.712 1.951 1.00 . A A . 26 LYS HB3 1 1 5 2154 1 1 26 LYS HD2 H -9.549 6.206 3.838 1.00 . A A . 26 LYS HD2 1 1 5 2155 1 1 26 LYS HD3 H -8.019 6.363 3.290 1.00 . A A . 26 LYS HD3 1 1 5 2156 1 1 26 LYS HE2 H -10.363 6.336 1.612 1.00 . A A . 26 LYS HE2 1 1 5 2157 1 1 26 LYS HE3 H -9.510 7.676 1.990 1.00 . A A . 26 LYS HE3 1 1 5 2158 1 1 26 LYS HG2 H -9.456 4.185 2.204 1.00 . A A . 26 LYS HG2 1 1 5 2159 1 1 26 LYS HG3 H -9.088 4.046 3.789 1.00 . A A . 26 LYS HG3 1 1 5 2160 1 1 26 LYS HZ1 H -8.915 7.013 -0.154 1.00 . A A . 26 LYS HZ1 1 1 5 2161 1 1 26 LYS HZ2 H -7.639 6.809 0.817 1.00 . A A . 26 LYS HZ2 1 1 5 2162 1 1 26 LYS HZ3 H -8.586 5.498 0.349 1.00 . A A . 26 LYS HZ3 1 1 5 2163 1 1 26 LYS N N -8.029 1.672 2.706 1.00 . A A . 26 LYS N 1 1 5 2164 1 1 26 LYS NZ N -8.584 6.473 0.638 1.00 . A A . 26 LYS NZ 1 1 5 2165 1 1 26 LYS O O -5.574 2.857 0.341 1.00 . A A . 26 LYS O 1 1 5 2166 1 1 27 TYR C C -4.364 -0.341 0.442 1.00 . A A . 27 TYR C 1 1 5 2167 1 1 27 TYR CA C -4.103 0.778 1.438 1.00 . A A . 27 TYR CA 1 1 5 2168 1 1 27 TYR CB C -3.290 0.199 2.590 1.00 . A A . 27 TYR CB 1 1 5 2169 1 1 27 TYR CD1 C -1.849 2.156 3.261 1.00 . A A . 27 TYR CD1 1 1 5 2170 1 1 27 TYR CD2 C -3.437 1.273 4.880 1.00 . A A . 27 TYR CD2 1 1 5 2171 1 1 27 TYR CE1 C -1.385 3.077 4.218 1.00 . A A . 27 TYR CE1 1 1 5 2172 1 1 27 TYR CE2 C -3.003 2.225 5.820 1.00 . A A . 27 TYR CE2 1 1 5 2173 1 1 27 TYR CG C -2.842 1.223 3.607 1.00 . A A . 27 TYR CG 1 1 5 2174 1 1 27 TYR CZ C -1.978 3.124 5.488 1.00 . A A . 27 TYR CZ 1 1 5 2175 1 1 27 TYR H H -5.804 0.831 2.724 1.00 . A A . 27 TYR H 1 1 5 2176 1 1 27 TYR HA H -3.523 1.558 0.943 1.00 . A A . 27 TYR HA 1 1 5 2177 1 1 27 TYR HB2 H -3.851 -0.483 3.058 1.00 . A A . 27 TYR HB2 1 1 5 2178 1 1 27 TYR HB3 H -2.477 -0.242 2.210 1.00 . A A . 27 TYR HB3 1 1 5 2179 1 1 27 TYR HD1 H -1.473 2.185 2.250 1.00 . A A . 27 TYR HD1 1 1 5 2180 1 1 27 TYR HD2 H -4.251 0.608 5.121 1.00 . A A . 27 TYR HD2 1 1 5 2181 1 1 27 TYR HE1 H -0.607 3.782 3.968 1.00 . A A . 27 TYR HE1 1 1 5 2182 1 1 27 TYR HE2 H -3.458 2.298 6.796 1.00 . A A . 27 TYR HE2 1 1 5 2183 1 1 27 TYR HH H -0.967 4.696 5.998 1.00 . A A . 27 TYR HH 1 1 5 2184 1 1 27 TYR N N -5.359 1.318 1.955 1.00 . A A . 27 TYR N 1 1 5 2185 1 1 27 TYR O O -3.634 -0.503 -0.534 1.00 . A A . 27 TYR O 1 1 5 2186 1 1 27 TYR OH O -1.648 4.112 6.359 1.00 . A A . 27 TYR OH 1 1 5 2187 1 1 28 CYS C C -6.721 -2.156 -1.129 1.00 . A A . 28 CYS C 1 1 5 2188 1 1 28 CYS CA C -5.653 -2.348 -0.043 1.00 . A A . 28 CYS CA 1 1 5 2189 1 1 28 CYS CB C -5.976 -3.446 0.966 1.00 . A A . 28 CYS CB 1 1 5 2190 1 1 28 CYS H H -5.849 -1.041 1.618 1.00 . A A . 28 CYS H 1 1 5 2191 1 1 28 CYS HA H -4.742 -2.636 -0.560 1.00 . A A . 28 CYS HA 1 1 5 2192 1 1 28 CYS HB2 H -5.491 -3.255 1.819 1.00 . A A . 28 CYS HB2 1 1 5 2193 1 1 28 CYS HB3 H -6.961 -3.450 1.136 1.00 . A A . 28 CYS HB3 1 1 5 2194 1 1 28 CYS N N -5.395 -1.142 0.713 1.00 . A A . 28 CYS N 1 1 5 2195 1 1 28 CYS O O -6.430 -2.342 -2.311 1.00 . A A . 28 CYS O 1 1 5 2196 1 1 28 CYS SG S -5.479 -5.072 0.360 1.00 . A A . 28 CYS SG 1 1 5 2197 1 1 29 GLY C C -9.098 0.044 -2.161 1.00 . A A . 29 GLY C 1 1 5 2198 1 1 29 GLY CA C -9.006 -1.425 -1.725 1.00 . A A . 29 GLY CA 1 1 5 2199 1 1 29 GLY H H -8.065 -1.415 0.189 1.00 . A A . 29 GLY H 1 1 5 2200 1 1 29 GLY HA2 H -8.885 -2.040 -2.618 1.00 . A A . 29 GLY HA2 1 1 5 2201 1 1 29 GLY HA3 H -9.956 -1.696 -1.264 1.00 . A A . 29 GLY HA3 1 1 5 2202 1 1 29 GLY N N -7.925 -1.701 -0.775 1.00 . A A . 29 GLY N 1 1 5 2203 1 1 29 GLY O O -9.931 0.375 -2.998 1.00 . A A . 29 GLY O 1 1 5 2204 1 1 30 ARG C C -9.416 3.139 -1.281 1.00 . A A . 30 ARG C 1 1 5 2205 1 1 30 ARG CA C -8.209 2.382 -1.840 1.00 . A A . 30 ARG CA 1 1 5 2206 1 1 30 ARG CB C -8.042 2.729 -3.330 1.00 . A A . 30 ARG CB 1 1 5 2207 1 1 30 ARG CD C -6.768 0.895 -4.634 1.00 . A A . 30 ARG CD 1 1 5 2208 1 1 30 ARG CG C -6.718 2.273 -3.954 1.00 . A A . 30 ARG CG 1 1 5 2209 1 1 30 ARG CZ C -4.682 -0.180 -3.764 1.00 . A A . 30 ARG CZ 1 1 5 2210 1 1 30 ARG H H -7.787 0.583 -0.766 1.00 . A A . 30 ARG H 1 1 5 2211 1 1 30 ARG HA H -7.337 2.773 -1.316 1.00 . A A . 30 ARG HA 1 1 5 2212 1 1 30 ARG HB2 H -8.789 2.296 -3.835 1.00 . A A . 30 ARG HB2 1 1 5 2213 1 1 30 ARG HB3 H -8.105 3.722 -3.427 1.00 . A A . 30 ARG HB3 1 1 5 2214 1 1 30 ARG HD2 H -7.722 0.599 -4.684 1.00 . A A . 30 ARG HD2 1 1 5 2215 1 1 30 ARG HD3 H -6.397 0.983 -5.559 1.00 . A A . 30 ARG HD3 1 1 5 2216 1 1 30 ARG HE H -6.491 -0.923 -3.516 1.00 . A A . 30 ARG HE 1 1 5 2217 1 1 30 ARG HG2 H -6.448 2.949 -4.640 1.00 . A A . 30 ARG HG2 1 1 5 2218 1 1 30 ARG HG3 H -6.029 2.238 -3.230 1.00 . A A . 30 ARG HG3 1 1 5 2219 1 1 30 ARG HH11 H -4.198 1.533 -4.687 1.00 . A A . 30 ARG HH11 1 1 5 2220 1 1 30 ARG HH12 H -2.868 0.626 -4.047 1.00 . A A . 30 ARG HH12 1 1 5 2221 1 1 30 ARG HH21 H -4.735 -1.897 -2.741 1.00 . A A . 30 ARG HH21 1 1 5 2222 1 1 30 ARG HH22 H -3.159 -1.223 -2.996 1.00 . A A . 30 ARG HH22 1 1 5 2223 1 1 30 ARG N N -8.273 0.931 -1.588 1.00 . A A . 30 ARG N 1 1 5 2224 1 1 30 ARG NE N -5.997 -0.132 -3.917 1.00 . A A . 30 ARG NE 1 1 5 2225 1 1 30 ARG NH1 N -3.851 0.731 -4.200 1.00 . A A . 30 ARG NH1 1 1 5 2226 1 1 30 ARG NH2 N -4.151 -1.177 -3.117 1.00 . A A . 30 ARG NH2 1 1 5 2227 1 1 30 ARG O O -9.243 4.128 -0.570 1.00 . A A . 30 ARG O 1 1 5 2228 1 1 31 NH2 HN1 H -10.706 1.880 -2.187 1.00 . A A . 31 NH2 HN1 1 1 5 2229 1 1 31 NH2 HN2 H -11.436 3.167 -1.221 1.00 . A A . 31 NH2 HN2 1 1 5 2230 1 1 31 NH2 N N -10.626 2.688 -1.579 1.00 . A A . 31 NH2 N 1 1 5 2231 2 2 1 NAG C1 C -8.771 12.213 -3.211 1.00 . B A . 32 NAG C1 1 1 5 2232 2 2 1 NAG C2 C -8.396 10.808 -2.757 1.00 . B A . 32 NAG C2 1 1 5 2233 2 2 1 NAG C3 C -7.376 10.907 -1.593 1.00 . B A . 32 NAG C3 1 1 5 2234 2 2 1 NAG C4 C -6.228 11.898 -1.926 1.00 . B A . 32 NAG C4 1 1 5 2235 2 2 1 NAG C5 C -6.859 13.228 -2.356 1.00 . B A . 32 NAG C5 1 1 5 2236 2 2 1 NAG C6 C -5.826 14.331 -2.658 1.00 . B A . 32 NAG C6 1 1 5 2237 2 2 1 NAG C7 C -9.919 8.925 -1.902 1.00 . B A . 32 NAG C7 1 1 5 2238 2 2 1 NAG C8 C -11.359 8.519 -1.872 1.00 . B A . 32 NAG C8 1 1 5 2239 2 2 1 NAG H1 H -9.395 12.714 -2.468 1.00 . B A . 32 NAG H1 1 1 5 2240 2 2 1 NAG H2 H -7.888 10.345 -3.605 1.00 . B A . 32 NAG H2 1 1 5 2241 2 2 1 NAG H3 H -7.891 11.230 -0.688 1.00 . B A . 32 NAG H3 1 1 5 2242 2 2 1 NAG H4 H -5.667 11.510 -2.776 1.00 . B A . 32 NAG H4 1 1 5 2243 2 2 1 NAG H5 H -7.509 13.601 -1.561 1.00 . B A . 32 NAG H5 1 1 5 2244 2 2 1 NAG H61 H -6.256 15.022 -3.382 1.00 . B A . 32 NAG H61 1 1 5 2245 2 2 1 NAG H62 H -4.918 13.903 -3.085 1.00 . B A . 32 NAG H62 1 1 5 2246 2 2 1 NAG H81 H -11.914 9.225 -1.260 1.00 . B A . 32 NAG H81 1 1 5 2247 2 2 1 NAG H82 H -11.747 8.505 -2.888 1.00 . B A . 32 NAG H82 1 1 5 2248 2 2 1 NAG H83 H -11.427 7.522 -1.444 1.00 . B A . 32 NAG H83 1 1 5 2249 2 2 1 NAG HN2 H -10.495 10.536 -2.842 1.00 . B A . 32 NAG HN2 1 1 5 2250 2 2 1 NAG HO1 H -9.102 12.846 -4.928 1.00 . B A . 32 NAG HO1 1 1 5 2251 2 2 1 NAG HO3 H -7.549 8.981 -1.595 1.00 . B A . 32 NAG HO3 1 1 5 2252 2 2 1 NAG HO4 H 1.681 8.996 6.392 1.00 . B A . 32 NAG HO4 1 1 5 2253 2 2 1 NAG HO6 H -4.695 14.767 -1.115 1.00 . B A . 32 NAG HO6 1 1 5 2254 2 2 1 NAG N2 N -9.668 10.102 -2.457 1.00 . B A . 32 NAG N2 1 1 5 2255 2 2 1 NAG O1 O -9.457 12.131 -4.394 1.00 . B A . 32 NAG O1 1 1 5 2256 2 2 1 NAG O3 O -6.840 9.609 -1.395 1.00 . B A . 32 NAG O3 1 1 5 2257 2 2 1 NAG O4 O -5.289 12.164 -0.849 1.00 . B A . 32 NAG O4 1 1 5 2258 2 2 1 NAG O5 O -7.631 12.979 -3.515 1.00 . B A . 32 NAG O5 1 1 5 2259 2 2 1 NAG O6 O -5.523 15.097 -1.506 1.00 . B A . 32 NAG O6 1 1 5 2260 2 2 1 NAG O7 O -9.061 8.190 -1.426 1.00 . B A . 32 NAG O7 1 1 6 2261 1 1 1 VAL C C 3.958 3.245 7.220 1.00 . A A . 1 VAL C 1 1 6 2262 1 1 1 VAL CA C 4.533 3.991 8.411 1.00 . A A . 1 VAL CA 1 1 6 2263 1 1 1 VAL CB C 3.641 3.820 9.648 1.00 . A A . 1 VAL CB 1 1 6 2264 1 1 1 VAL CG1 C 4.373 4.351 10.881 1.00 . A A . 1 VAL CG1 1 1 6 2265 1 1 1 VAL CG2 C 2.288 4.530 9.535 1.00 . A A . 1 VAL CG2 1 1 6 2266 1 1 1 VAL H1 H 5.080 5.950 8.815 1.00 . A A . 1 VAL H1 1 1 6 2267 1 1 1 VAL H2 H 3.858 5.797 7.691 1.00 . A A . 1 VAL H2 1 1 6 2268 1 1 1 VAL H3 H 5.394 5.435 7.272 1.00 . A A . 1 VAL H3 1 1 6 2269 1 1 1 VAL HA H 5.506 3.557 8.631 1.00 . A A . 1 VAL HA 1 1 6 2270 1 1 1 VAL HB H 3.466 2.754 9.797 1.00 . A A . 1 VAL HB 1 1 6 2271 1 1 1 VAL HG11 H 3.793 4.109 11.773 1.00 . A A . 1 VAL HG11 1 1 6 2272 1 1 1 VAL HG12 H 5.351 3.878 10.969 1.00 . A A . 1 VAL HG12 1 1 6 2273 1 1 1 VAL HG13 H 4.496 5.433 10.835 1.00 . A A . 1 VAL HG13 1 1 6 2274 1 1 1 VAL HG21 H 2.408 5.606 9.417 1.00 . A A . 1 VAL HG21 1 1 6 2275 1 1 1 VAL HG22 H 1.713 4.135 8.697 1.00 . A A . 1 VAL HG22 1 1 6 2276 1 1 1 VAL HG23 H 1.716 4.347 10.446 1.00 . A A . 1 VAL HG23 1 1 6 2277 1 1 1 VAL N N 4.728 5.407 8.043 1.00 . A A . 1 VAL N 1 1 6 2278 1 1 1 VAL O O 3.064 3.766 6.562 1.00 . A A . 1 VAL O 1 1 6 2279 1 1 2 GLY C C 4.653 1.714 4.420 1.00 . A A . 2 GLY C 1 1 6 2280 1 1 2 GLY CA C 4.013 1.296 5.749 1.00 . A A . 2 GLY CA 1 1 6 2281 1 1 2 GLY H H 5.239 1.681 7.454 1.00 . A A . 2 GLY H 1 1 6 2282 1 1 2 GLY HA2 H 4.233 0.240 5.907 1.00 . A A . 2 GLY HA2 1 1 6 2283 1 1 2 GLY HA3 H 2.930 1.397 5.652 1.00 . A A . 2 GLY HA3 1 1 6 2284 1 1 2 GLY N N 4.479 2.058 6.907 1.00 . A A . 2 GLY N 1 1 6 2285 1 1 2 GLY O O 4.216 1.239 3.379 1.00 . A A . 2 GLY O 1 1 6 2286 1 1 3 GLU C C 6.879 1.787 2.379 1.00 . A A . 3 GLU C 1 1 6 2287 1 1 3 GLU CA C 6.443 2.984 3.244 1.00 . A A . 3 GLU CA 1 1 6 2288 1 1 3 GLU CB C 7.642 3.835 3.697 1.00 . A A . 3 GLU CB 1 1 6 2289 1 1 3 GLU CD C 6.261 5.451 5.181 1.00 . A A . 3 GLU CD 1 1 6 2290 1 1 3 GLU CG C 7.267 5.290 4.032 1.00 . A A . 3 GLU CG 1 1 6 2291 1 1 3 GLU H H 5.891 3.076 5.293 1.00 . A A . 3 GLU H 1 1 6 2292 1 1 3 GLU HA H 5.834 3.605 2.599 1.00 . A A . 3 GLU HA 1 1 6 2293 1 1 3 GLU HB2 H 8.039 3.414 4.513 1.00 . A A . 3 GLU HB2 1 1 6 2294 1 1 3 GLU HB3 H 8.320 3.844 2.962 1.00 . A A . 3 GLU HB3 1 1 6 2295 1 1 3 GLU HG2 H 8.104 5.777 4.282 1.00 . A A . 3 GLU HG2 1 1 6 2296 1 1 3 GLU HG3 H 6.871 5.705 3.213 1.00 . A A . 3 GLU HG3 1 1 6 2297 1 1 3 GLU N N 5.657 2.596 4.420 1.00 . A A . 3 GLU N 1 1 6 2298 1 1 3 GLU O O 7.857 1.106 2.675 1.00 . A A . 3 GLU O 1 1 6 2299 1 1 3 GLU OE1 O 6.227 4.579 6.082 1.00 . A A . 3 GLU OE1 1 1 6 2300 1 1 3 GLU OE2 O 5.483 6.440 5.205 1.00 . A A . 3 GLU OE2 1 1 6 2301 1 1 4 CYS C C 7.713 0.574 -0.385 1.00 . A A . 4 CYS C 1 1 6 2302 1 1 4 CYS CA C 6.408 0.408 0.396 1.00 . A A . 4 CYS CA 1 1 6 2303 1 1 4 CYS CB C 5.264 0.276 -0.625 1.00 . A A . 4 CYS CB 1 1 6 2304 1 1 4 CYS H H 5.344 2.119 1.102 1.00 . A A . 4 CYS H 1 1 6 2305 1 1 4 CYS HA H 6.466 -0.503 0.992 1.00 . A A . 4 CYS HA 1 1 6 2306 1 1 4 CYS HB2 H 5.272 1.094 -1.200 1.00 . A A . 4 CYS HB2 1 1 6 2307 1 1 4 CYS HB3 H 5.448 -0.530 -1.188 1.00 . A A . 4 CYS HB3 1 1 6 2308 1 1 4 CYS N N 6.153 1.537 1.284 1.00 . A A . 4 CYS N 1 1 6 2309 1 1 4 CYS O O 8.163 1.695 -0.653 1.00 . A A . 4 CYS O 1 1 6 2310 1 1 4 CYS SG S 3.601 0.101 0.063 1.00 . A A . 4 CYS SG 1 1 6 2311 1 1 5 VAL C C 8.832 -0.098 -3.310 1.00 . A A . 5 VAL C 1 1 6 2312 1 1 5 VAL CA C 9.317 -0.527 -1.919 1.00 . A A . 5 VAL CA 1 1 6 2313 1 1 5 VAL CB C 10.068 -1.871 -1.870 1.00 . A A . 5 VAL CB 1 1 6 2314 1 1 5 VAL CG1 C 9.324 -3.075 -2.457 1.00 . A A . 5 VAL CG1 1 1 6 2315 1 1 5 VAL CG2 C 11.454 -1.762 -2.511 1.00 . A A . 5 VAL CG2 1 1 6 2316 1 1 5 VAL H H 7.744 -1.405 -0.733 1.00 . A A . 5 VAL H 1 1 6 2317 1 1 5 VAL HA H 10.026 0.236 -1.596 1.00 . A A . 5 VAL HA 1 1 6 2318 1 1 5 VAL HB H 10.214 -2.087 -0.811 1.00 . A A . 5 VAL HB 1 1 6 2319 1 1 5 VAL HG11 H 9.300 -3.037 -3.545 1.00 . A A . 5 VAL HG11 1 1 6 2320 1 1 5 VAL HG12 H 9.843 -3.988 -2.162 1.00 . A A . 5 VAL HG12 1 1 6 2321 1 1 5 VAL HG13 H 8.312 -3.112 -2.072 1.00 . A A . 5 VAL HG13 1 1 6 2322 1 1 5 VAL HG21 H 11.368 -1.567 -3.579 1.00 . A A . 5 VAL HG21 1 1 6 2323 1 1 5 VAL HG22 H 12.019 -0.957 -2.042 1.00 . A A . 5 VAL HG22 1 1 6 2324 1 1 5 VAL HG23 H 11.994 -2.699 -2.368 1.00 . A A . 5 VAL HG23 1 1 6 2325 1 1 5 VAL N N 8.209 -0.527 -0.953 1.00 . A A . 5 VAL N 1 1 6 2326 1 1 5 VAL O O 9.036 -0.766 -4.316 1.00 . A A . 5 VAL O 1 1 6 2327 1 1 6 ARG C C 6.483 0.655 -5.193 1.00 . A A . 6 ARG C 1 1 6 2328 1 1 6 ARG CA C 7.446 1.621 -4.505 1.00 . A A . 6 ARG CA 1 1 6 2329 1 1 6 ARG CB C 8.480 2.235 -5.460 1.00 . A A . 6 ARG CB 1 1 6 2330 1 1 6 ARG CD C 8.738 4.408 -4.098 1.00 . A A . 6 ARG CD 1 1 6 2331 1 1 6 ARG CG C 9.443 3.225 -4.781 1.00 . A A . 6 ARG CG 1 1 6 2332 1 1 6 ARG CZ C 7.246 4.573 -2.086 1.00 . A A . 6 ARG CZ 1 1 6 2333 1 1 6 ARG H H 7.990 1.476 -2.446 1.00 . A A . 6 ARG H 1 1 6 2334 1 1 6 ARG HA H 6.796 2.411 -4.141 1.00 . A A . 6 ARG HA 1 1 6 2335 1 1 6 ARG HB2 H 9.020 1.494 -5.859 1.00 . A A . 6 ARG HB2 1 1 6 2336 1 1 6 ARG HB3 H 7.991 2.719 -6.185 1.00 . A A . 6 ARG HB3 1 1 6 2337 1 1 6 ARG HD2 H 9.371 5.182 -4.063 1.00 . A A . 6 ARG HD2 1 1 6 2338 1 1 6 ARG HD3 H 7.935 4.658 -4.638 1.00 . A A . 6 ARG HD3 1 1 6 2339 1 1 6 ARG HE H 8.877 3.454 -2.190 1.00 . A A . 6 ARG HE 1 1 6 2340 1 1 6 ARG HG2 H 9.968 2.729 -4.089 1.00 . A A . 6 ARG HG2 1 1 6 2341 1 1 6 ARG HG3 H 10.064 3.587 -5.476 1.00 . A A . 6 ARG HG3 1 1 6 2342 1 1 6 ARG HH11 H 6.680 5.845 -3.535 1.00 . A A . 6 ARG HH11 1 1 6 2343 1 1 6 ARG HH12 H 5.685 5.838 -2.117 1.00 . A A . 6 ARG HH12 1 1 6 2344 1 1 6 ARG HH21 H 7.515 3.373 -0.503 1.00 . A A . 6 ARG HH21 1 1 6 2345 1 1 6 ARG HH22 H 6.156 4.443 -0.409 1.00 . A A . 6 ARG HH22 1 1 6 2346 1 1 6 ARG N N 8.106 1.024 -3.340 1.00 . A A . 6 ARG N 1 1 6 2347 1 1 6 ARG NE N 8.304 4.089 -2.725 1.00 . A A . 6 ARG NE 1 1 6 2348 1 1 6 ARG NH1 N 6.476 5.492 -2.622 1.00 . A A . 6 ARG NH1 1 1 6 2349 1 1 6 ARG NH2 N 6.949 4.092 -0.907 1.00 . A A . 6 ARG NH2 1 1 6 2350 1 1 6 ARG O O 6.264 0.708 -6.397 1.00 . A A . 6 ARG O 1 1 6 2351 1 1 7 GLY C C 4.521 -2.288 -3.910 1.00 . A A . 7 GLY C 1 1 6 2352 1 1 7 GLY CA C 4.762 -1.059 -4.791 1.00 . A A . 7 GLY CA 1 1 6 2353 1 1 7 GLY H H 6.087 -0.030 -3.403 1.00 . A A . 7 GLY H 1 1 6 2354 1 1 7 GLY HA2 H 3.842 -0.474 -4.813 1.00 . A A . 7 GLY HA2 1 1 6 2355 1 1 7 GLY HA3 H 4.953 -1.412 -5.805 1.00 . A A . 7 GLY HA3 1 1 6 2356 1 1 7 GLY N N 5.862 -0.190 -4.372 1.00 . A A . 7 GLY N 1 1 6 2357 1 1 7 GLY O O 3.407 -2.823 -3.910 1.00 . A A . 7 GLY O 1 1 6 2358 1 1 8 ARG C C 5.823 -3.658 -0.820 1.00 . A A . 8 ARG C 1 1 6 2359 1 1 8 ARG CA C 5.379 -3.917 -2.260 1.00 . A A . 8 ARG CA 1 1 6 2360 1 1 8 ARG CB C 6.108 -5.112 -2.906 1.00 . A A . 8 ARG CB 1 1 6 2361 1 1 8 ARG CD C 4.218 -6.540 -3.951 1.00 . A A . 8 ARG CD 1 1 6 2362 1 1 8 ARG CG C 5.324 -6.439 -2.886 1.00 . A A . 8 ARG CG 1 1 6 2363 1 1 8 ARG CZ C 2.255 -5.519 -2.792 1.00 . A A . 8 ARG CZ 1 1 6 2364 1 1 8 ARG H H 6.442 -2.358 -3.264 1.00 . A A . 8 ARG H 1 1 6 2365 1 1 8 ARG HA H 4.327 -4.149 -2.164 1.00 . A A . 8 ARG HA 1 1 6 2366 1 1 8 ARG HB2 H 6.301 -4.880 -3.859 1.00 . A A . 8 ARG HB2 1 1 6 2367 1 1 8 ARG HB3 H 6.968 -5.252 -2.416 1.00 . A A . 8 ARG HB3 1 1 6 2368 1 1 8 ARG HD2 H 4.628 -6.405 -4.853 1.00 . A A . 8 ARG HD2 1 1 6 2369 1 1 8 ARG HD3 H 3.808 -7.451 -3.903 1.00 . A A . 8 ARG HD3 1 1 6 2370 1 1 8 ARG HE H 3.290 -4.635 -4.208 1.00 . A A . 8 ARG HE 1 1 6 2371 1 1 8 ARG HG2 H 5.971 -7.187 -3.035 1.00 . A A . 8 ARG HG2 1 1 6 2372 1 1 8 ARG HG3 H 4.901 -6.539 -1.985 1.00 . A A . 8 ARG HG3 1 1 6 2373 1 1 8 ARG HH11 H 2.361 -7.463 -2.303 1.00 . A A . 8 ARG HH11 1 1 6 2374 1 1 8 ARG HH12 H 1.232 -6.523 -1.386 1.00 . A A . 8 ARG HH12 1 1 6 2375 1 1 8 ARG HH21 H 2.011 -3.536 -2.924 1.00 . A A . 8 ARG HH21 1 1 6 2376 1 1 8 ARG HH22 H 1.041 -4.332 -1.731 1.00 . A A . 8 ARG HH22 1 1 6 2377 1 1 8 ARG N N 5.518 -2.747 -3.140 1.00 . A A . 8 ARG N 1 1 6 2378 1 1 8 ARG NE N 3.162 -5.536 -3.757 1.00 . A A . 8 ARG NE 1 1 6 2379 1 1 8 ARG NH1 N 1.923 -6.586 -2.106 1.00 . A A . 8 ARG NH1 1 1 6 2380 1 1 8 ARG NH2 N 1.728 -4.373 -2.456 1.00 . A A . 8 ARG NH2 1 1 6 2381 1 1 8 ARG O O 6.430 -2.632 -0.518 1.00 . A A . 8 ARG O 1 1 6 2382 1 1 9 CYS C C 5.742 -5.944 2.069 1.00 . A A . 9 CYS C 1 1 6 2383 1 1 9 CYS CA C 5.632 -4.522 1.505 1.00 . A A . 9 CYS CA 1 1 6 2384 1 1 9 CYS CB C 4.376 -3.843 2.065 1.00 . A A . 9 CYS CB 1 1 6 2385 1 1 9 CYS H H 5.077 -5.459 -0.270 1.00 . A A . 9 CYS H 1 1 6 2386 1 1 9 CYS HA H 6.525 -3.957 1.775 1.00 . A A . 9 CYS HA 1 1 6 2387 1 1 9 CYS HB2 H 3.667 -3.866 1.360 1.00 . A A . 9 CYS HB2 1 1 6 2388 1 1 9 CYS HB3 H 4.070 -4.361 2.864 1.00 . A A . 9 CYS HB3 1 1 6 2389 1 1 9 CYS N N 5.493 -4.602 0.059 1.00 . A A . 9 CYS N 1 1 6 2390 1 1 9 CYS O O 5.521 -6.903 1.327 1.00 . A A . 9 CYS O 1 1 6 2391 1 1 9 CYS SG S 4.620 -2.127 2.565 1.00 . A A . 9 CYS SG 1 1 6 2392 1 1 10 PRO C C 4.479 -7.922 4.023 1.00 . A A . 10 PRO C 1 1 6 2393 1 1 10 PRO CA C 5.911 -7.373 4.060 1.00 . A A . 10 PRO CA 1 1 6 2394 1 1 10 PRO CB C 6.399 -7.114 5.490 1.00 . A A . 10 PRO CB 1 1 6 2395 1 1 10 PRO CD C 6.379 -5.043 4.315 1.00 . A A . 10 PRO CD 1 1 6 2396 1 1 10 PRO CG C 6.104 -5.630 5.697 1.00 . A A . 10 PRO CG 1 1 6 2397 1 1 10 PRO HA H 6.567 -8.101 3.583 1.00 . A A . 10 PRO HA 1 1 6 2398 1 1 10 PRO HB2 H 5.895 -7.675 6.147 1.00 . A A . 10 PRO HB2 1 1 6 2399 1 1 10 PRO HB3 H 7.378 -7.300 5.574 1.00 . A A . 10 PRO HB3 1 1 6 2400 1 1 10 PRO HD2 H 5.819 -4.229 4.162 1.00 . A A . 10 PRO HD2 1 1 6 2401 1 1 10 PRO HD3 H 7.346 -4.805 4.221 1.00 . A A . 10 PRO HD3 1 1 6 2402 1 1 10 PRO HG2 H 5.152 -5.485 5.968 1.00 . A A . 10 PRO HG2 1 1 6 2403 1 1 10 PRO HG3 H 6.711 -5.233 6.385 1.00 . A A . 10 PRO HG3 1 1 6 2404 1 1 10 PRO N N 6.019 -6.093 3.376 1.00 . A A . 10 PRO N 1 1 6 2405 1 1 10 PRO O O 3.529 -7.246 3.617 1.00 . A A . 10 PRO O 1 1 6 2406 1 1 11 SER C C 2.151 -9.714 3.324 1.00 . A A . 11 SER C 1 1 6 2407 1 1 11 SER CA C 3.109 -9.971 4.483 1.00 . A A . 11 SER CA 1 1 6 2408 1 1 11 SER CB C 2.470 -9.730 5.831 1.00 . A A . 11 SER CB 1 1 6 2409 1 1 11 SER H H 5.086 -9.565 4.999 1.00 . A A . 11 SER H 1 1 6 2410 1 1 11 SER HA H 3.387 -11.018 4.405 1.00 . A A . 11 SER HA 1 1 6 2411 1 1 11 SER HB2 H 2.344 -8.748 5.975 1.00 . A A . 11 SER HB2 1 1 6 2412 1 1 11 SER HB3 H 1.583 -10.190 5.872 1.00 . A A . 11 SER HB3 1 1 6 2413 1 1 11 SER HG H 2.901 -10.159 7.686 1.00 . A A . 11 SER HG 1 1 6 2414 1 1 11 SER N N 4.340 -9.183 4.446 1.00 . A A . 11 SER N 1 1 6 2415 1 1 11 SER O O 0.938 -9.641 3.487 1.00 . A A . 11 SER O 1 1 6 2416 1 1 11 SER OG O 3.326 -10.253 6.828 1.00 . A A . 11 SER OG 1 1 6 2417 1 1 12 GLY C C 1.226 -8.031 0.813 1.00 . A A . 12 GLY C 1 1 6 2418 1 1 12 GLY CA C 2.094 -9.292 0.870 1.00 . A A . 12 GLY CA 1 1 6 2419 1 1 12 GLY H H 3.749 -9.630 2.204 1.00 . A A . 12 GLY H 1 1 6 2420 1 1 12 GLY HA2 H 2.856 -9.209 0.097 1.00 . A A . 12 GLY HA2 1 1 6 2421 1 1 12 GLY HA3 H 1.457 -10.142 0.625 1.00 . A A . 12 GLY HA3 1 1 6 2422 1 1 12 GLY N N 2.747 -9.551 2.149 1.00 . A A . 12 GLY N 1 1 6 2423 1 1 12 GLY O O 0.507 -7.868 -0.171 1.00 . A A . 12 GLY O 1 1 6 2424 1 1 13 MET C C -0.115 -5.279 0.824 1.00 . A A . 13 MET C 1 1 6 2425 1 1 13 MET CA C 0.204 -6.150 2.044 1.00 . A A . 13 MET CA 1 1 6 2426 1 1 13 MET CB C 0.578 -5.251 3.228 1.00 . A A . 13 MET CB 1 1 6 2427 1 1 13 MET CE C -0.693 -7.588 6.436 1.00 . A A . 13 MET CE 1 1 6 2428 1 1 13 MET CG C 0.561 -6.024 4.547 1.00 . A A . 13 MET CG 1 1 6 2429 1 1 13 MET H H 1.972 -7.271 2.540 1.00 . A A . 13 MET H 1 1 6 2430 1 1 13 MET HA H -0.709 -6.689 2.298 1.00 . A A . 13 MET HA 1 1 6 2431 1 1 13 MET HB2 H 1.496 -4.883 3.079 1.00 . A A . 13 MET HB2 1 1 6 2432 1 1 13 MET HB3 H -0.078 -4.498 3.284 1.00 . A A . 13 MET HB3 1 1 6 2433 1 1 13 MET HE1 H -0.182 -8.451 6.008 1.00 . A A . 13 MET HE1 1 1 6 2434 1 1 13 MET HE2 H -0.042 -7.101 7.162 1.00 . A A . 13 MET HE2 1 1 6 2435 1 1 13 MET HE3 H -1.605 -7.922 6.931 1.00 . A A . 13 MET HE3 1 1 6 2436 1 1 13 MET HG2 H 1.068 -6.877 4.422 1.00 . A A . 13 MET HG2 1 1 6 2437 1 1 13 MET HG3 H 1.010 -5.469 5.247 1.00 . A A . 13 MET HG3 1 1 6 2438 1 1 13 MET N N 1.263 -7.146 1.820 1.00 . A A . 13 MET N 1 1 6 2439 1 1 13 MET O O 0.676 -5.152 -0.114 1.00 . A A . 13 MET O 1 1 6 2440 1 1 13 MET SD S -1.112 -6.425 5.114 1.00 . A A . 13 MET SD 1 1 6 2441 1 1 14 CYS C C -1.011 -2.379 -0.040 1.00 . A A . 14 CYS C 1 1 6 2442 1 1 14 CYS CA C -1.651 -3.742 -0.261 1.00 . A A . 14 CYS CA 1 1 6 2443 1 1 14 CYS CB C -3.166 -3.540 -0.335 1.00 . A A . 14 CYS CB 1 1 6 2444 1 1 14 CYS H H -1.775 -4.554 1.719 1.00 . A A . 14 CYS H 1 1 6 2445 1 1 14 CYS HA H -1.307 -4.171 -1.204 1.00 . A A . 14 CYS HA 1 1 6 2446 1 1 14 CYS HB2 H -3.410 -2.885 0.380 1.00 . A A . 14 CYS HB2 1 1 6 2447 1 1 14 CYS HB3 H -3.366 -3.145 -1.232 1.00 . A A . 14 CYS HB3 1 1 6 2448 1 1 14 CYS N N -1.269 -4.612 0.847 1.00 . A A . 14 CYS N 1 1 6 2449 1 1 14 CYS O O -0.991 -1.924 1.102 1.00 . A A . 14 CYS O 1 1 6 2450 1 1 14 CYS SG S -4.249 -4.974 -0.133 1.00 . A A . 14 CYS SG 1 1 6 2451 1 1 15 CYS C C -1.124 0.594 -1.672 1.00 . A A . 15 CYS C 1 1 6 2452 1 1 15 CYS CA C -0.076 -0.349 -1.070 1.00 . A A . 15 CYS CA 1 1 6 2453 1 1 15 CYS CB C 1.226 -0.272 -1.878 1.00 . A A . 15 CYS CB 1 1 6 2454 1 1 15 CYS H H -0.641 -2.126 -2.027 1.00 . A A . 15 CYS H 1 1 6 2455 1 1 15 CYS HA H 0.132 -0.060 -0.046 1.00 . A A . 15 CYS HA 1 1 6 2456 1 1 15 CYS HB2 H 1.043 -0.631 -2.793 1.00 . A A . 15 CYS HB2 1 1 6 2457 1 1 15 CYS HB3 H 1.492 0.690 -1.944 1.00 . A A . 15 CYS HB3 1 1 6 2458 1 1 15 CYS N N -0.563 -1.718 -1.110 1.00 . A A . 15 CYS N 1 1 6 2459 1 1 15 CYS O O -1.616 0.330 -2.773 1.00 . A A . 15 CYS O 1 1 6 2460 1 1 15 CYS SG S 2.628 -1.196 -1.183 1.00 . A A . 15 CYS SG 1 1 6 2461 1 1 16 SER C C -0.876 3.381 -2.706 1.00 . A A . 16 SER C 1 1 6 2462 1 1 16 SER CA C -1.936 2.889 -1.721 1.00 . A A . 16 SER CA 1 1 6 2463 1 1 16 SER CB C -2.308 4.003 -0.731 1.00 . A A . 16 SER CB 1 1 6 2464 1 1 16 SER H H -0.935 1.907 -0.137 1.00 . A A . 16 SER H 1 1 6 2465 1 1 16 SER HA H -2.828 2.591 -2.272 1.00 . A A . 16 SER HA 1 1 6 2466 1 1 16 SER HB2 H -2.682 4.780 -1.237 1.00 . A A . 16 SER HB2 1 1 6 2467 1 1 16 SER HB3 H -2.996 3.658 -0.093 1.00 . A A . 16 SER HB3 1 1 6 2468 1 1 16 SER HG H -1.455 4.808 0.848 1.00 . A A . 16 SER HG 1 1 6 2469 1 1 16 SER N N -1.398 1.728 -1.020 1.00 . A A . 16 SER N 1 1 6 2470 1 1 16 SER O O 0.314 3.110 -2.543 1.00 . A A . 16 SER O 1 1 6 2471 1 1 16 SER OG O -1.173 4.427 -0.004 1.00 . A A . 16 SER OG 1 1 6 2472 1 1 17 GLN C C 0.618 5.442 -4.670 1.00 . A A . 17 GLN C 1 1 6 2473 1 1 17 GLN CA C -0.412 4.330 -4.907 1.00 . A A . 17 GLN CA 1 1 6 2474 1 1 17 GLN CB C -1.282 4.527 -6.157 1.00 . A A . 17 GLN CB 1 1 6 2475 1 1 17 GLN CD C -2.181 2.182 -5.653 1.00 . A A . 17 GLN CD 1 1 6 2476 1 1 17 GLN CG C -1.747 3.174 -6.732 1.00 . A A . 17 GLN CG 1 1 6 2477 1 1 17 GLN H H -2.281 4.205 -3.888 1.00 . A A . 17 GLN H 1 1 6 2478 1 1 17 GLN HA H 0.188 3.435 -5.073 1.00 . A A . 17 GLN HA 1 1 6 2479 1 1 17 GLN HB2 H -2.085 5.071 -5.913 1.00 . A A . 17 GLN HB2 1 1 6 2480 1 1 17 GLN HB3 H -0.750 5.011 -6.852 1.00 . A A . 17 GLN HB3 1 1 6 2481 1 1 17 GLN HE21 H -0.553 0.991 -5.904 1.00 . A A . 17 GLN HE21 1 1 6 2482 1 1 17 GLN HE22 H -1.596 0.649 -4.520 1.00 . A A . 17 GLN HE22 1 1 6 2483 1 1 17 GLN HG2 H -2.521 3.337 -7.344 1.00 . A A . 17 GLN HG2 1 1 6 2484 1 1 17 GLN HG3 H -0.992 2.771 -7.249 1.00 . A A . 17 GLN HG3 1 1 6 2485 1 1 17 GLN N N -1.286 4.095 -3.753 1.00 . A A . 17 GLN N 1 1 6 2486 1 1 17 GLN NE2 N -1.393 1.161 -5.378 1.00 . A A . 17 GLN NE2 1 1 6 2487 1 1 17 GLN O O 1.542 5.610 -5.458 1.00 . A A . 17 GLN O 1 1 6 2488 1 1 17 GLN OE1 O -3.193 2.356 -4.981 1.00 . A A . 17 GLN OE1 1 1 6 2489 1 1 18 . C C 2.827 5.918 -2.478 1.00 . A A . 18 PFF C 1 1 6 2490 1 1 18 . CA C 1.684 6.849 -2.945 1.00 . A A . 18 PFF CA 1 1 6 2491 1 1 18 . CB C 1.151 7.648 -1.751 1.00 . A A . 18 PFF CB 1 1 6 2492 1 1 18 . CD1 C -0.235 9.415 -2.914 1.00 . A A . 18 PFF CD1 1 1 6 2493 1 1 18 . CD2 C -1.356 7.811 -1.468 1.00 . A A . 18 PFF CD2 1 1 6 2494 1 1 18 . CE1 C -1.484 9.880 -3.363 1.00 . A A . 18 PFF CE1 1 1 6 2495 1 1 18 . CE2 C -2.604 8.274 -1.920 1.00 . A A . 18 PFF CE2 1 1 6 2496 1 1 18 . CG C -0.167 8.365 -1.982 1.00 . A A . 18 PFF CG 1 1 6 2497 1 1 18 . CZ C -2.668 9.294 -2.883 1.00 . A A . 18 PFF CZ 1 1 6 2498 1 1 18 . F F -3.870 9.679 -3.386 1.00 . A A . 18 PFF F 1 1 6 2499 1 1 18 . H H -0.245 5.942 -2.923 1.00 . A A . 18 PFF H 1 1 6 2500 1 1 18 . HA H 2.075 7.538 -3.695 1.00 . A A . 18 PFF HA 1 1 6 2501 1 1 18 . HB2 H 0.982 6.917 -0.969 1.00 . A A . 18 PFF HB2 1 1 6 2502 1 1 18 . HB3 H 1.914 8.353 -1.419 1.00 . A A . 18 PFF HB3 1 1 6 2503 1 1 18 . HD1 H 0.672 9.823 -3.337 1.00 . A A . 18 PFF HD1 1 1 6 2504 1 1 18 . HD2 H -1.316 7.001 -0.754 1.00 . A A . 18 PFF HD2 1 1 6 2505 1 1 18 . HE1 H -1.534 10.676 -4.091 1.00 . A A . 18 PFF HE1 1 1 6 2506 1 1 18 . HE2 H -3.516 7.841 -1.537 1.00 . A A . 18 PFF HE2 1 1 6 2507 1 1 18 . N N 0.560 6.099 -3.510 1.00 . A A . 18 PFF N 1 1 6 2508 1 1 18 . O O 3.936 6.357 -2.163 1.00 . A A . 18 PFF O 1 1 6 2509 1 1 19 GLY C C 3.521 3.450 -0.461 1.00 . A A . 19 GLY C 1 1 6 2510 1 1 19 GLY CA C 3.496 3.585 -1.976 1.00 . A A . 19 GLY CA 1 1 6 2511 1 1 19 GLY H H 1.639 4.296 -2.676 1.00 . A A . 19 GLY H 1 1 6 2512 1 1 19 GLY HA2 H 3.197 2.625 -2.400 1.00 . A A . 19 GLY HA2 1 1 6 2513 1 1 19 GLY HA3 H 4.494 3.814 -2.323 1.00 . A A . 19 GLY HA3 1 1 6 2514 1 1 19 GLY N N 2.567 4.609 -2.423 1.00 . A A . 19 GLY N 1 1 6 2515 1 1 19 GLY O O 4.594 3.472 0.137 1.00 . A A . 19 GLY O 1 1 6 2516 1 1 20 . C C 1.249 1.916 1.839 1.00 . A A . 20 PFF C 1 1 6 2517 1 1 20 . CA C 2.213 3.079 1.591 1.00 . A A . 20 PFF CA 1 1 6 2518 1 1 20 . CB C 1.631 4.348 2.195 1.00 . A A . 20 PFF CB 1 1 6 2519 1 1 20 . CD1 C 3.754 5.710 2.092 1.00 . A A . 20 PFF CD1 1 1 6 2520 1 1 20 . CD2 C 1.668 6.764 1.442 1.00 . A A . 20 PFF CD2 1 1 6 2521 1 1 20 . CE1 C 4.436 6.915 1.865 1.00 . A A . 20 PFF CE1 1 1 6 2522 1 1 20 . CE2 C 2.341 7.983 1.279 1.00 . A A . 20 PFF CE2 1 1 6 2523 1 1 20 . CG C 2.372 5.626 1.871 1.00 . A A . 20 PFF CG 1 1 6 2524 1 1 20 . CZ C 3.715 8.068 1.531 1.00 . A A . 20 PFF CZ 1 1 6 2525 1 1 20 . F F 4.375 9.223 1.255 1.00 . A A . 20 PFF F 1 1 6 2526 1 1 20 . H H 1.498 3.402 -0.362 1.00 . A A . 20 PFF H 1 1 6 2527 1 1 20 . HA H 3.178 2.865 2.041 1.00 . A A . 20 PFF HA 1 1 6 2528 1 1 20 . HB2 H 0.596 4.449 1.875 1.00 . A A . 20 PFF HB2 1 1 6 2529 1 1 20 . HB3 H 1.642 4.199 3.262 1.00 . A A . 20 PFF HB3 1 1 6 2530 1 1 20 . HD1 H 4.277 4.858 2.474 1.00 . A A . 20 PFF HD1 1 1 6 2531 1 1 20 . HD2 H 0.604 6.711 1.261 1.00 . A A . 20 PFF HD2 1 1 6 2532 1 1 20 . HE1 H 5.502 6.986 1.999 1.00 . A A . 20 PFF HE1 1 1 6 2533 1 1 20 . HE2 H 1.820 8.857 0.930 1.00 . A A . 20 PFF HE2 1 1 6 2534 1 1 20 . N N 2.355 3.313 0.162 1.00 . A A . 20 PFF N 1 1 6 2535 1 1 20 . O O 0.206 1.886 1.195 1.00 . A A . 20 PFF O 1 1 6 2536 1 1 21 CYS C C 0.049 -0.545 4.114 1.00 . A A . 21 CYS C 1 1 6 2537 1 1 21 CYS CA C 0.769 -0.272 2.800 1.00 . A A . 21 CYS CA 1 1 6 2538 1 1 21 CYS CB C 1.662 -1.479 2.498 1.00 . A A . 21 CYS CB 1 1 6 2539 1 1 21 CYS H H 2.456 0.992 3.183 1.00 . A A . 21 CYS H 1 1 6 2540 1 1 21 CYS HA H -0.008 -0.210 2.053 1.00 . A A . 21 CYS HA 1 1 6 2541 1 1 21 CYS HB2 H 1.085 -2.295 2.472 1.00 . A A . 21 CYS HB2 1 1 6 2542 1 1 21 CYS HB3 H 2.084 -1.339 1.602 1.00 . A A . 21 CYS HB3 1 1 6 2543 1 1 21 CYS N N 1.556 0.959 2.720 1.00 . A A . 21 CYS N 1 1 6 2544 1 1 21 CYS O O 0.390 -0.009 5.166 1.00 . A A . 21 CYS O 1 1 6 2545 1 1 21 CYS SG S 2.981 -1.757 3.707 1.00 . A A . 21 CYS SG 1 1 6 2546 1 1 22 GLY C C -2.808 -2.802 4.941 1.00 . A A . 22 GLY C 1 1 6 2547 1 1 22 GLY CA C -1.484 -2.099 5.231 1.00 . A A . 22 GLY CA 1 1 6 2548 1 1 22 GLY H H -1.140 -1.866 3.124 1.00 . A A . 22 GLY H 1 1 6 2549 1 1 22 GLY HA2 H -0.783 -2.825 5.644 1.00 . A A . 22 GLY HA2 1 1 6 2550 1 1 22 GLY HA3 H -1.660 -1.325 5.978 1.00 . A A . 22 GLY HA3 1 1 6 2551 1 1 22 GLY N N -0.890 -1.497 4.044 1.00 . A A . 22 GLY N 1 1 6 2552 1 1 22 GLY O O -3.435 -2.596 3.901 1.00 . A A . 22 GLY O 1 1 6 2553 1 1 23 LYS C C -5.757 -3.507 5.986 1.00 . A A . 23 LYS C 1 1 6 2554 1 1 23 LYS CA C -4.517 -4.386 5.773 1.00 . A A . 23 LYS CA 1 1 6 2555 1 1 23 LYS CB C -4.471 -5.558 6.767 1.00 . A A . 23 LYS CB 1 1 6 2556 1 1 23 LYS CD C -5.870 -7.506 7.647 1.00 . A A . 23 LYS CD 1 1 6 2557 1 1 23 LYS CE C -6.402 -6.728 8.862 1.00 . A A . 23 LYS CE 1 1 6 2558 1 1 23 LYS CG C -5.536 -6.618 6.441 1.00 . A A . 23 LYS CG 1 1 6 2559 1 1 23 LYS H H -2.711 -3.737 6.721 1.00 . A A . 23 LYS H 1 1 6 2560 1 1 23 LYS HA H -4.572 -4.796 4.763 1.00 . A A . 23 LYS HA 1 1 6 2561 1 1 23 LYS HB2 H -3.567 -5.983 6.726 1.00 . A A . 23 LYS HB2 1 1 6 2562 1 1 23 LYS HB3 H -4.634 -5.208 7.689 1.00 . A A . 23 LYS HB3 1 1 6 2563 1 1 23 LYS HD2 H -6.565 -8.168 7.368 1.00 . A A . 23 LYS HD2 1 1 6 2564 1 1 23 LYS HD3 H -5.039 -7.990 7.922 1.00 . A A . 23 LYS HD3 1 1 6 2565 1 1 23 LYS HE2 H -6.727 -7.382 9.545 1.00 . A A . 23 LYS HE2 1 1 6 2566 1 1 23 LYS HE3 H -5.655 -6.186 9.248 1.00 . A A . 23 LYS HE3 1 1 6 2567 1 1 23 LYS HG2 H -6.370 -6.153 6.144 1.00 . A A . 23 LYS HG2 1 1 6 2568 1 1 23 LYS HG3 H -5.195 -7.198 5.701 1.00 . A A . 23 LYS HG3 1 1 6 2569 1 1 23 LYS HZ1 H -7.190 -5.091 7.872 1.00 . A A . 23 LYS HZ1 1 1 6 2570 1 1 23 LYS HZ2 H -8.264 -6.325 8.056 1.00 . A A . 23 LYS HZ2 1 1 6 2571 1 1 23 LYS HZ3 H -7.878 -5.358 9.334 1.00 . A A . 23 LYS HZ3 1 1 6 2572 1 1 23 LYS N N -3.277 -3.612 5.894 1.00 . A A . 23 LYS N 1 1 6 2573 1 1 23 LYS NZ N -7.517 -5.817 8.508 1.00 . A A . 23 LYS NZ 1 1 6 2574 1 1 23 LYS O O -6.575 -3.798 6.862 1.00 . A A . 23 LYS O 1 1 6 2575 1 1 24 GLY C C -7.476 -0.854 4.057 1.00 . A A . 24 GLY C 1 1 6 2576 1 1 24 GLY CA C -7.030 -1.509 5.366 1.00 . A A . 24 GLY CA 1 1 6 2577 1 1 24 GLY H H -5.201 -2.265 4.491 1.00 . A A . 24 GLY H 1 1 6 2578 1 1 24 GLY HA2 H -7.879 -2.050 5.785 1.00 . A A . 24 GLY HA2 1 1 6 2579 1 1 24 GLY HA3 H -6.747 -0.723 6.066 1.00 . A A . 24 GLY HA3 1 1 6 2580 1 1 24 GLY N N -5.903 -2.430 5.210 1.00 . A A . 24 GLY N 1 1 6 2581 1 1 24 GLY O O -6.691 -0.714 3.114 1.00 . A A . 24 GLY O 1 1 6 2582 1 1 25 PRO C C -8.596 1.302 2.209 1.00 . A A . 25 PRO C 1 1 6 2583 1 1 25 PRO CA C -9.351 0.104 2.776 1.00 . A A . 25 PRO CA 1 1 6 2584 1 1 25 PRO CB C -10.801 0.436 3.146 1.00 . A A . 25 PRO CB 1 1 6 2585 1 1 25 PRO CD C -9.675 -0.345 5.104 1.00 . A A . 25 PRO CD 1 1 6 2586 1 1 25 PRO CG C -10.763 0.633 4.663 1.00 . A A . 25 PRO CG 1 1 6 2587 1 1 25 PRO HA H -9.351 -0.685 2.023 1.00 . A A . 25 PRO HA 1 1 6 2588 1 1 25 PRO HB2 H -11.102 1.272 2.687 1.00 . A A . 25 PRO HB2 1 1 6 2589 1 1 25 PRO HB3 H -11.411 -0.317 2.901 1.00 . A A . 25 PRO HB3 1 1 6 2590 1 1 25 PRO HD2 H -9.225 -0.018 5.935 1.00 . A A . 25 PRO HD2 1 1 6 2591 1 1 25 PRO HD3 H -10.064 -1.251 5.270 1.00 . A A . 25 PRO HD3 1 1 6 2592 1 1 25 PRO HG2 H -10.518 1.574 4.898 1.00 . A A . 25 PRO HG2 1 1 6 2593 1 1 25 PRO HG3 H -11.643 0.403 5.078 1.00 . A A . 25 PRO HG3 1 1 6 2594 1 1 25 PRO N N -8.734 -0.390 3.999 1.00 . A A . 25 PRO N 1 1 6 2595 1 1 25 PRO O O -8.294 1.321 1.016 1.00 . A A . 25 PRO O 1 1 6 2596 1 1 26 LYS C C -6.042 3.064 2.042 1.00 . A A . 26 LYS C 1 1 6 2597 1 1 26 LYS CA C -7.400 3.413 2.634 1.00 . A A . 26 LYS CA 1 1 6 2598 1 1 26 LYS CB C -7.196 4.373 3.810 1.00 . A A . 26 LYS CB 1 1 6 2599 1 1 26 LYS CD C -8.609 6.296 2.847 1.00 . A A . 26 LYS CD 1 1 6 2600 1 1 26 LYS CE C -7.368 7.139 2.511 1.00 . A A . 26 LYS CE 1 1 6 2601 1 1 26 LYS CG C -8.391 5.310 4.009 1.00 . A A . 26 LYS CG 1 1 6 2602 1 1 26 LYS H H -8.447 2.178 4.030 1.00 . A A . 26 LYS H 1 1 6 2603 1 1 26 LYS HA H -7.943 3.916 1.837 1.00 . A A . 26 LYS HA 1 1 6 2604 1 1 26 LYS HB2 H -7.066 3.837 4.644 1.00 . A A . 26 LYS HB2 1 1 6 2605 1 1 26 LYS HB3 H -6.380 4.925 3.637 1.00 . A A . 26 LYS HB3 1 1 6 2606 1 1 26 LYS HD2 H -8.865 5.774 2.034 1.00 . A A . 26 LYS HD2 1 1 6 2607 1 1 26 LYS HD3 H -9.354 6.916 3.094 1.00 . A A . 26 LYS HD3 1 1 6 2608 1 1 26 LYS HE2 H -7.670 8.058 2.257 1.00 . A A . 26 LYS HE2 1 1 6 2609 1 1 26 LYS HE3 H -6.791 7.190 3.326 1.00 . A A . 26 LYS HE3 1 1 6 2610 1 1 26 LYS HG2 H -9.215 4.753 4.108 1.00 . A A . 26 LYS HG2 1 1 6 2611 1 1 26 LYS HG3 H -8.242 5.837 4.846 1.00 . A A . 26 LYS HG3 1 1 6 2612 1 1 26 LYS HZ1 H -6.179 5.661 1.585 1.00 . A A . 26 LYS HZ1 1 1 6 2613 1 1 26 LYS HZ2 H -7.117 6.545 0.547 1.00 . A A . 26 LYS HZ2 1 1 6 2614 1 1 26 LYS HZ3 H -5.775 7.219 1.227 1.00 . A A . 26 LYS HZ3 1 1 6 2615 1 1 26 LYS N N -8.189 2.254 3.057 1.00 . A A . 26 LYS N 1 1 6 2616 1 1 26 LYS NZ N -6.558 6.587 1.397 1.00 . A A . 26 LYS NZ 1 1 6 2617 1 1 26 LYS O O -5.466 3.952 1.412 1.00 . A A . 26 LYS O 1 1 6 2618 1 1 27 TYR C C -4.794 0.502 0.304 1.00 . A A . 27 TYR C 1 1 6 2619 1 1 27 TYR CA C -4.385 1.321 1.524 1.00 . A A . 27 TYR CA 1 1 6 2620 1 1 27 TYR CB C -3.556 0.467 2.490 1.00 . A A . 27 TYR CB 1 1 6 2621 1 1 27 TYR CD1 C -1.974 2.238 3.321 1.00 . A A . 27 TYR CD1 1 1 6 2622 1 1 27 TYR CD2 C -3.182 0.920 4.967 1.00 . A A . 27 TYR CD2 1 1 6 2623 1 1 27 TYR CE1 C -1.188 2.798 4.341 1.00 . A A . 27 TYR CE1 1 1 6 2624 1 1 27 TYR CE2 C -2.469 1.568 5.996 1.00 . A A . 27 TYR CE2 1 1 6 2625 1 1 27 TYR CG C -2.916 1.242 3.622 1.00 . A A . 27 TYR CG 1 1 6 2626 1 1 27 TYR CZ C -1.459 2.491 5.681 1.00 . A A . 27 TYR CZ 1 1 6 2627 1 1 27 TYR H H -6.110 1.158 2.741 1.00 . A A . 27 TYR H 1 1 6 2628 1 1 27 TYR HA H -3.771 2.146 1.177 1.00 . A A . 27 TYR HA 1 1 6 2629 1 1 27 TYR HB2 H -4.156 -0.227 2.887 1.00 . A A . 27 TYR HB2 1 1 6 2630 1 1 27 TYR HB3 H -2.830 0.021 1.967 1.00 . A A . 27 TYR HB3 1 1 6 2631 1 1 27 TYR HD1 H -1.858 2.577 2.305 1.00 . A A . 27 TYR HD1 1 1 6 2632 1 1 27 TYR HD2 H -3.916 0.166 5.207 1.00 . A A . 27 TYR HD2 1 1 6 2633 1 1 27 TYR HE1 H -0.411 3.504 4.100 1.00 . A A . 27 TYR HE1 1 1 6 2634 1 1 27 TYR HE2 H -2.662 1.350 7.035 1.00 . A A . 27 TYR HE2 1 1 6 2635 1 1 27 TYR HH H -0.168 3.792 6.300 1.00 . A A . 27 TYR HH 1 1 6 2636 1 1 27 TYR N N -5.567 1.827 2.206 1.00 . A A . 27 TYR N 1 1 6 2637 1 1 27 TYR O O -4.368 0.784 -0.812 1.00 . A A . 27 TYR O 1 1 6 2638 1 1 27 TYR OH O -0.821 3.178 6.666 1.00 . A A . 27 TYR OH 1 1 6 2639 1 1 28 CYS C C -6.903 -0.992 -1.569 1.00 . A A . 28 CYS C 1 1 6 2640 1 1 28 CYS CA C -5.887 -1.499 -0.536 1.00 . A A . 28 CYS CA 1 1 6 2641 1 1 28 CYS CB C -6.328 -2.789 0.161 1.00 . A A . 28 CYS CB 1 1 6 2642 1 1 28 CYS H H -6.012 -0.688 1.427 1.00 . A A . 28 CYS H 1 1 6 2643 1 1 28 CYS HA H -4.957 -1.688 -1.067 1.00 . A A . 28 CYS HA 1 1 6 2644 1 1 28 CYS HB2 H -5.819 -2.877 1.017 1.00 . A A . 28 CYS HB2 1 1 6 2645 1 1 28 CYS HB3 H -7.306 -2.724 0.359 1.00 . A A . 28 CYS HB3 1 1 6 2646 1 1 28 CYS N N -5.632 -0.516 0.501 1.00 . A A . 28 CYS N 1 1 6 2647 1 1 28 CYS O O -6.681 -1.112 -2.778 1.00 . A A . 28 CYS O 1 1 6 2648 1 1 28 CYS SG S -6.042 -4.277 -0.832 1.00 . A A . 28 CYS SG 1 1 6 2649 1 1 29 GLY C C -8.658 1.755 -2.264 1.00 . A A . 29 GLY C 1 1 6 2650 1 1 29 GLY CA C -8.994 0.297 -1.935 1.00 . A A . 29 GLY CA 1 1 6 2651 1 1 29 GLY H H -8.032 -0.172 -0.101 1.00 . A A . 29 GLY H 1 1 6 2652 1 1 29 GLY HA2 H -9.123 -0.262 -2.862 1.00 . A A . 29 GLY HA2 1 1 6 2653 1 1 29 GLY HA3 H -9.944 0.283 -1.402 1.00 . A A . 29 GLY HA3 1 1 6 2654 1 1 29 GLY N N -7.976 -0.344 -1.100 1.00 . A A . 29 GLY N 1 1 6 2655 1 1 29 GLY O O -9.105 2.262 -3.291 1.00 . A A . 29 GLY O 1 1 6 2656 1 1 30 ARG C C -8.340 4.886 -1.441 1.00 . A A . 30 ARG C 1 1 6 2657 1 1 30 ARG CA C -7.298 3.769 -1.476 1.00 . A A . 30 ARG CA 1 1 6 2658 1 1 30 ARG CB C -6.168 3.984 -2.505 1.00 . A A . 30 ARG CB 1 1 6 2659 1 1 30 ARG CD C -6.845 3.635 -5.019 1.00 . A A . 30 ARG CD 1 1 6 2660 1 1 30 ARG CG C -6.486 4.605 -3.885 1.00 . A A . 30 ARG CG 1 1 6 2661 1 1 30 ARG CZ C -6.103 1.268 -4.703 1.00 . A A . 30 ARG CZ 1 1 6 2662 1 1 30 ARG H H -7.618 1.868 -0.594 1.00 . A A . 30 ARG H 1 1 6 2663 1 1 30 ARG HA H -6.797 3.875 -0.518 1.00 . A A . 30 ARG HA 1 1 6 2664 1 1 30 ARG HB2 H -5.491 4.578 -2.070 1.00 . A A . 30 ARG HB2 1 1 6 2665 1 1 30 ARG HB3 H -5.762 3.087 -2.679 1.00 . A A . 30 ARG HB3 1 1 6 2666 1 1 30 ARG HD2 H -7.764 3.273 -4.861 1.00 . A A . 30 ARG HD2 1 1 6 2667 1 1 30 ARG HD3 H -6.826 4.128 -5.889 1.00 . A A . 30 ARG HD3 1 1 6 2668 1 1 30 ARG HE H -4.910 2.745 -5.190 1.00 . A A . 30 ARG HE 1 1 6 2669 1 1 30 ARG HG2 H -7.259 5.228 -3.765 1.00 . A A . 30 ARG HG2 1 1 6 2670 1 1 30 ARG HG3 H -5.682 5.124 -4.175 1.00 . A A . 30 ARG HG3 1 1 6 2671 1 1 30 ARG HH11 H -8.102 1.298 -4.815 1.00 . A A . 30 ARG HH11 1 1 6 2672 1 1 30 ARG HH12 H -7.402 -0.206 -4.315 1.00 . A A . 30 ARG HH12 1 1 6 2673 1 1 30 ARG HH21 H -4.166 0.893 -4.354 1.00 . A A . 30 ARG HH21 1 1 6 2674 1 1 30 ARG HH22 H -5.249 -0.426 -4.060 1.00 . A A . 30 ARG HH22 1 1 6 2675 1 1 30 ARG N N -7.818 2.392 -1.441 1.00 . A A . 30 ARG N 1 1 6 2676 1 1 30 ARG NE N -5.892 2.518 -5.078 1.00 . A A . 30 ARG NE 1 1 6 2677 1 1 30 ARG NH1 N -7.295 0.746 -4.603 1.00 . A A . 30 ARG NH1 1 1 6 2678 1 1 30 ARG NH2 N -5.094 0.520 -4.344 1.00 . A A . 30 ARG NH2 1 1 6 2679 1 1 30 ARG O O -8.157 5.833 -0.683 1.00 . A A . 30 ARG O 1 1 6 2680 1 1 31 NH2 HN1 H -9.545 3.976 -2.789 1.00 . A A . 31 NH2 HN1 1 1 6 2681 1 1 31 NH2 HN2 H -10.120 5.514 -2.142 1.00 . A A . 31 NH2 HN2 1 1 6 2682 1 1 31 NH2 N N -9.430 4.781 -2.186 1.00 . A A . 31 NH2 N 1 1 6 2683 2 2 1 NAG C1 C -6.102 12.896 -2.771 1.00 . B A . 32 NAG C1 1 1 6 2684 2 2 1 NAG C2 C -6.318 11.679 -1.875 1.00 . B A . 32 NAG C2 1 1 6 2685 2 2 1 NAG C3 C -5.317 11.647 -0.699 1.00 . B A . 32 NAG C3 1 1 6 2686 2 2 1 NAG C4 C -4.044 12.461 -1.001 1.00 . B A . 32 NAG C4 1 1 6 2687 2 2 1 NAG C5 C -4.487 13.906 -1.282 1.00 . B A . 32 NAG C5 1 1 6 2688 2 2 1 NAG C6 C -3.375 14.700 -1.993 1.00 . B A . 32 NAG C6 1 1 6 2689 2 2 1 NAG C7 C -8.258 10.538 -0.799 1.00 . B A . 32 NAG C7 1 1 6 2690 2 2 1 NAG C8 C -9.706 10.654 -0.436 1.00 . B A . 32 NAG C8 1 1 6 2691 2 2 1 NAG H1 H -7.020 13.130 -3.312 1.00 . B A . 32 NAG H1 1 1 6 2692 2 2 1 NAG H2 H -6.100 10.832 -2.531 1.00 . B A . 32 NAG H2 1 1 6 2693 2 2 1 NAG H3 H -5.786 12.060 0.194 1.00 . B A . 32 NAG H3 1 1 6 2694 2 2 1 NAG H4 H -3.573 12.020 -1.877 1.00 . B A . 32 NAG H4 1 1 6 2695 2 2 1 NAG H5 H -4.671 14.399 -0.326 1.00 . B A . 32 NAG H5 1 1 6 2696 2 2 1 NAG H61 H -2.534 14.850 -1.316 1.00 . B A . 32 NAG H61 1 1 6 2697 2 2 1 NAG H62 H -3.765 15.678 -2.279 1.00 . B A . 32 NAG H62 1 1 6 2698 2 2 1 NAG H81 H -10.285 10.820 -1.341 1.00 . B A . 32 NAG H81 1 1 6 2699 2 2 1 NAG H82 H -10.007 9.719 0.030 1.00 . B A . 32 NAG H82 1 1 6 2700 2 2 1 NAG H83 H -9.835 11.477 0.264 1.00 . B A . 32 NAG H83 1 1 6 2701 2 2 1 NAG HN2 H -8.328 12.384 -1.519 1.00 . B A . 32 NAG HN2 1 1 6 2702 2 2 1 NAG HO1 H -4.476 13.392 -3.669 1.00 . B A . 32 NAG HO1 1 1 6 2703 2 2 1 NAG HO3 H -5.927 9.827 -0.560 1.00 . B A . 32 NAG HO3 1 1 6 2704 2 2 1 NAG HO4 H 3.993 6.491 5.781 1.00 . B A . 32 NAG HO4 1 1 6 2705 2 2 1 NAG HO6 H -2.171 13.458 -2.870 1.00 . B A . 32 NAG HO6 1 1 6 2706 2 2 1 NAG N2 N -7.715 11.593 -1.393 1.00 . B A . 32 NAG N2 1 1 6 2707 2 2 1 NAG O1 O -5.111 12.659 -3.700 1.00 . B A . 32 NAG O1 1 1 6 2708 2 2 1 NAG O3 O -5.064 10.268 -0.493 1.00 . B A . 32 NAG O3 1 1 6 2709 2 2 1 NAG O4 O -3.059 12.552 0.063 1.00 . B A . 32 NAG O4 1 1 6 2710 2 2 1 NAG O5 O -5.708 14.017 -2.002 1.00 . B A . 32 NAG O5 1 1 6 2711 2 2 1 NAG O6 O -2.906 14.035 -3.155 1.00 . B A . 32 NAG O6 1 1 6 2712 2 2 1 NAG O7 O -7.622 9.525 -0.531 1.00 . B A . 32 NAG O7 1 1 7 2713 1 1 1 VAL C C 5.996 5.617 6.933 1.00 . A A . 1 VAL C 1 1 7 2714 1 1 1 VAL CA C 7.087 6.498 7.547 1.00 . A A . 1 VAL CA 1 1 7 2715 1 1 1 VAL CB C 6.496 7.633 8.399 1.00 . A A . 1 VAL CB 1 1 7 2716 1 1 1 VAL CG1 C 7.582 8.190 9.321 1.00 . A A . 1 VAL CG1 1 1 7 2717 1 1 1 VAL CG2 C 5.932 8.790 7.567 1.00 . A A . 1 VAL CG2 1 1 7 2718 1 1 1 VAL H1 H 8.437 6.241 5.994 1.00 . A A . 1 VAL H1 1 1 7 2719 1 1 1 VAL H2 H 8.791 7.544 6.961 1.00 . A A . 1 VAL H2 1 1 7 2720 1 1 1 VAL H3 H 7.588 7.561 5.819 1.00 . A A . 1 VAL H3 1 1 7 2721 1 1 1 VAL HA H 7.634 5.845 8.226 1.00 . A A . 1 VAL HA 1 1 7 2722 1 1 1 VAL HB H 5.707 7.230 9.036 1.00 . A A . 1 VAL HB 1 1 7 2723 1 1 1 VAL HG11 H 7.135 8.920 9.998 1.00 . A A . 1 VAL HG11 1 1 7 2724 1 1 1 VAL HG12 H 8.014 7.387 9.919 1.00 . A A . 1 VAL HG12 1 1 7 2725 1 1 1 VAL HG13 H 8.370 8.686 8.754 1.00 . A A . 1 VAL HG13 1 1 7 2726 1 1 1 VAL HG21 H 5.162 8.437 6.885 1.00 . A A . 1 VAL HG21 1 1 7 2727 1 1 1 VAL HG22 H 5.478 9.522 8.238 1.00 . A A . 1 VAL HG22 1 1 7 2728 1 1 1 VAL HG23 H 6.714 9.292 6.996 1.00 . A A . 1 VAL HG23 1 1 7 2729 1 1 1 VAL N N 8.047 7.006 6.544 1.00 . A A . 1 VAL N 1 1 7 2730 1 1 1 VAL O O 4.813 5.942 7.004 1.00 . A A . 1 VAL O 1 1 7 2731 1 1 2 GLY C C 5.490 3.070 4.485 1.00 . A A . 2 GLY C 1 1 7 2732 1 1 2 GLY CA C 5.484 3.379 5.987 1.00 . A A . 2 GLY CA 1 1 7 2733 1 1 2 GLY H H 7.381 4.353 6.188 1.00 . A A . 2 GLY H 1 1 7 2734 1 1 2 GLY HA2 H 5.766 2.467 6.514 1.00 . A A . 2 GLY HA2 1 1 7 2735 1 1 2 GLY HA3 H 4.460 3.622 6.273 1.00 . A A . 2 GLY HA3 1 1 7 2736 1 1 2 GLY N N 6.394 4.460 6.391 1.00 . A A . 2 GLY N 1 1 7 2737 1 1 2 GLY O O 4.555 2.451 3.989 1.00 . A A . 2 GLY O 1 1 7 2738 1 1 3 GLU C C 6.653 2.186 1.684 1.00 . A A . 3 GLU C 1 1 7 2739 1 1 3 GLU CA C 6.537 3.592 2.296 1.00 . A A . 3 GLU CA 1 1 7 2740 1 1 3 GLU CB C 7.720 4.466 1.851 1.00 . A A . 3 GLU CB 1 1 7 2741 1 1 3 GLU CD C 7.833 6.284 3.709 1.00 . A A . 3 GLU CD 1 1 7 2742 1 1 3 GLU CG C 7.588 5.951 2.228 1.00 . A A . 3 GLU CG 1 1 7 2743 1 1 3 GLU H H 7.234 4.069 4.227 1.00 . A A . 3 GLU H 1 1 7 2744 1 1 3 GLU HA H 5.633 4.060 1.923 1.00 . A A . 3 GLU HA 1 1 7 2745 1 1 3 GLU HB2 H 8.551 4.108 2.276 1.00 . A A . 3 GLU HB2 1 1 7 2746 1 1 3 GLU HB3 H 7.800 4.402 0.856 1.00 . A A . 3 GLU HB3 1 1 7 2747 1 1 3 GLU HG2 H 8.249 6.467 1.683 1.00 . A A . 3 GLU HG2 1 1 7 2748 1 1 3 GLU HG3 H 6.661 6.246 1.995 1.00 . A A . 3 GLU HG3 1 1 7 2749 1 1 3 GLU N N 6.484 3.573 3.753 1.00 . A A . 3 GLU N 1 1 7 2750 1 1 3 GLU O O 7.155 1.256 2.312 1.00 . A A . 3 GLU O 1 1 7 2751 1 1 3 GLU OE1 O 8.195 5.397 4.528 1.00 . A A . 3 GLU OE1 1 1 7 2752 1 1 3 GLU OE2 O 7.622 7.451 4.105 1.00 . A A . 3 GLU OE2 1 1 7 2753 1 1 4 CYS C C 7.557 0.385 -0.883 1.00 . A A . 4 CYS C 1 1 7 2754 1 1 4 CYS CA C 6.219 0.716 -0.216 1.00 . A A . 4 CYS CA 1 1 7 2755 1 1 4 CYS CB C 5.103 0.631 -1.268 1.00 . A A . 4 CYS CB 1 1 7 2756 1 1 4 CYS H H 5.780 2.813 -0.034 1.00 . A A . 4 CYS H 1 1 7 2757 1 1 4 CYS HA H 6.037 -0.043 0.541 1.00 . A A . 4 CYS HA 1 1 7 2758 1 1 4 CYS HB2 H 5.398 1.157 -2.066 1.00 . A A . 4 CYS HB2 1 1 7 2759 1 1 4 CYS HB3 H 4.998 -0.331 -1.522 1.00 . A A . 4 CYS HB3 1 1 7 2760 1 1 4 CYS N N 6.217 2.023 0.432 1.00 . A A . 4 CYS N 1 1 7 2761 1 1 4 CYS O O 8.251 1.238 -1.436 1.00 . A A . 4 CYS O 1 1 7 2762 1 1 4 CYS SG S 3.474 1.249 -0.774 1.00 . A A . 4 CYS SG 1 1 7 2763 1 1 5 VAL C C 8.596 -1.384 -3.217 1.00 . A A . 5 VAL C 1 1 7 2764 1 1 5 VAL CA C 8.958 -1.465 -1.740 1.00 . A A . 5 VAL CA 1 1 7 2765 1 1 5 VAL CB C 9.257 -2.906 -1.293 1.00 . A A . 5 VAL CB 1 1 7 2766 1 1 5 VAL CG1 C 10.512 -3.443 -1.985 1.00 . A A . 5 VAL CG1 1 1 7 2767 1 1 5 VAL CG2 C 9.496 -2.965 0.219 1.00 . A A . 5 VAL CG2 1 1 7 2768 1 1 5 VAL H H 7.132 -1.558 -0.663 1.00 . A A . 5 VAL H 1 1 7 2769 1 1 5 VAL HA H 9.847 -0.859 -1.561 1.00 . A A . 5 VAL HA 1 1 7 2770 1 1 5 VAL HB H 8.410 -3.553 -1.525 1.00 . A A . 5 VAL HB 1 1 7 2771 1 1 5 VAL HG11 H 10.722 -4.452 -1.629 1.00 . A A . 5 VAL HG11 1 1 7 2772 1 1 5 VAL HG12 H 10.368 -3.485 -3.064 1.00 . A A . 5 VAL HG12 1 1 7 2773 1 1 5 VAL HG13 H 11.365 -2.803 -1.760 1.00 . A A . 5 VAL HG13 1 1 7 2774 1 1 5 VAL HG21 H 8.594 -2.683 0.762 1.00 . A A . 5 VAL HG21 1 1 7 2775 1 1 5 VAL HG22 H 9.768 -3.980 0.509 1.00 . A A . 5 VAL HG22 1 1 7 2776 1 1 5 VAL HG23 H 10.304 -2.287 0.494 1.00 . A A . 5 VAL HG23 1 1 7 2777 1 1 5 VAL N N 7.839 -0.912 -0.988 1.00 . A A . 5 VAL N 1 1 7 2778 1 1 5 VAL O O 8.132 -2.353 -3.814 1.00 . A A . 5 VAL O 1 1 7 2779 1 1 6 ARG C C 6.991 -0.356 -5.587 1.00 . A A . 6 ARG C 1 1 7 2780 1 1 6 ARG CA C 8.365 0.161 -5.166 1.00 . A A . 6 ARG CA 1 1 7 2781 1 1 6 ARG CB C 9.523 -0.296 -6.079 1.00 . A A . 6 ARG CB 1 1 7 2782 1 1 6 ARG CD C 9.055 0.817 -8.360 1.00 . A A . 6 ARG CD 1 1 7 2783 1 1 6 ARG CG C 9.923 0.780 -7.097 1.00 . A A . 6 ARG CG 1 1 7 2784 1 1 6 ARG CZ C 8.694 -1.262 -9.739 1.00 . A A . 6 ARG CZ 1 1 7 2785 1 1 6 ARG H H 8.866 0.592 -3.118 1.00 . A A . 6 ARG H 1 1 7 2786 1 1 6 ARG HA H 8.271 1.243 -5.205 1.00 . A A . 6 ARG HA 1 1 7 2787 1 1 6 ARG HB2 H 10.316 -0.510 -5.509 1.00 . A A . 6 ARG HB2 1 1 7 2788 1 1 6 ARG HB3 H 9.237 -1.116 -6.574 1.00 . A A . 6 ARG HB3 1 1 7 2789 1 1 6 ARG HD2 H 8.098 0.693 -8.099 1.00 . A A . 6 ARG HD2 1 1 7 2790 1 1 6 ARG HD3 H 9.167 1.706 -8.804 1.00 . A A . 6 ARG HD3 1 1 7 2791 1 1 6 ARG HE H 10.329 -0.134 -9.754 1.00 . A A . 6 ARG HE 1 1 7 2792 1 1 6 ARG HG2 H 9.860 1.672 -6.649 1.00 . A A . 6 ARG HG2 1 1 7 2793 1 1 6 ARG HG3 H 10.869 0.611 -7.374 1.00 . A A . 6 ARG HG3 1 1 7 2794 1 1 6 ARG HH11 H 7.177 -1.028 -8.444 1.00 . A A . 6 ARG HH11 1 1 7 2795 1 1 6 ARG HH12 H 7.014 -2.347 -9.556 1.00 . A A . 6 ARG HH12 1 1 7 2796 1 1 6 ARG HH21 H 9.996 -1.806 -11.170 1.00 . A A . 6 ARG HH21 1 1 7 2797 1 1 6 ARG HH22 H 8.565 -2.775 -11.056 1.00 . A A . 6 ARG HH22 1 1 7 2798 1 1 6 ARG N N 8.685 -0.169 -3.771 1.00 . A A . 6 ARG N 1 1 7 2799 1 1 6 ARG NE N 9.431 -0.244 -9.315 1.00 . A A . 6 ARG NE 1 1 7 2800 1 1 6 ARG NH1 N 7.537 -1.570 -9.204 1.00 . A A . 6 ARG NH1 1 1 7 2801 1 1 6 ARG NH2 N 9.119 -2.007 -10.734 1.00 . A A . 6 ARG NH2 1 1 7 2802 1 1 6 ARG O O 6.764 -0.725 -6.736 1.00 . A A . 6 ARG O 1 1 7 2803 1 1 7 GLY C C 4.350 -2.110 -4.025 1.00 . A A . 7 GLY C 1 1 7 2804 1 1 7 GLY CA C 4.696 -0.815 -4.769 1.00 . A A . 7 GLY CA 1 1 7 2805 1 1 7 GLY H H 6.412 0.050 -3.762 1.00 . A A . 7 GLY H 1 1 7 2806 1 1 7 GLY HA2 H 4.031 -0.032 -4.407 1.00 . A A . 7 GLY HA2 1 1 7 2807 1 1 7 GLY HA3 H 4.470 -0.970 -5.825 1.00 . A A . 7 GLY HA3 1 1 7 2808 1 1 7 GLY N N 6.079 -0.365 -4.619 1.00 . A A . 7 GLY N 1 1 7 2809 1 1 7 GLY O O 3.175 -2.474 -3.975 1.00 . A A . 7 GLY O 1 1 7 2810 1 1 8 ARG C C 5.432 -3.831 -1.175 1.00 . A A . 8 ARG C 1 1 7 2811 1 1 8 ARG CA C 5.064 -4.024 -2.641 1.00 . A A . 8 ARG CA 1 1 7 2812 1 1 8 ARG CB C 5.822 -5.201 -3.276 1.00 . A A . 8 ARG CB 1 1 7 2813 1 1 8 ARG CD C 3.608 -6.309 -4.000 1.00 . A A . 8 ARG CD 1 1 7 2814 1 1 8 ARG CG C 5.032 -5.888 -4.400 1.00 . A A . 8 ARG CG 1 1 7 2815 1 1 8 ARG CZ C 2.564 -6.805 -1.783 1.00 . A A . 8 ARG CZ 1 1 7 2816 1 1 8 ARG H H 6.292 -2.508 -3.486 1.00 . A A . 8 ARG H 1 1 7 2817 1 1 8 ARG HA H 3.997 -4.234 -2.632 1.00 . A A . 8 ARG HA 1 1 7 2818 1 1 8 ARG HB2 H 6.682 -4.859 -3.654 1.00 . A A . 8 ARG HB2 1 1 7 2819 1 1 8 ARG HB3 H 6.016 -5.876 -2.564 1.00 . A A . 8 ARG HB3 1 1 7 2820 1 1 8 ARG HD2 H 3.023 -5.498 -4.000 1.00 . A A . 8 ARG HD2 1 1 7 2821 1 1 8 ARG HD3 H 3.268 -6.966 -4.673 1.00 . A A . 8 ARG HD3 1 1 7 2822 1 1 8 ARG HE H 4.310 -7.541 -2.397 1.00 . A A . 8 ARG HE 1 1 7 2823 1 1 8 ARG HG2 H 4.967 -5.254 -5.171 1.00 . A A . 8 ARG HG2 1 1 7 2824 1 1 8 ARG HG3 H 5.534 -6.706 -4.682 1.00 . A A . 8 ARG HG3 1 1 7 2825 1 1 8 ARG HH11 H 1.296 -5.816 -2.983 1.00 . A A . 8 ARG HH11 1 1 7 2826 1 1 8 ARG HH12 H 0.720 -6.127 -1.379 1.00 . A A . 8 ARG HH12 1 1 7 2827 1 1 8 ARG HH21 H 3.526 -7.691 -0.262 1.00 . A A . 8 ARG HH21 1 1 7 2828 1 1 8 ARG HH22 H 1.922 -7.138 0.088 1.00 . A A . 8 ARG HH22 1 1 7 2829 1 1 8 ARG N N 5.322 -2.813 -3.424 1.00 . A A . 8 ARG N 1 1 7 2830 1 1 8 ARG NE N 3.551 -6.933 -2.661 1.00 . A A . 8 ARG NE 1 1 7 2831 1 1 8 ARG NH1 N 1.438 -6.202 -2.071 1.00 . A A . 8 ARG NH1 1 1 7 2832 1 1 8 ARG NH2 N 2.680 -7.246 -0.556 1.00 . A A . 8 ARG NH2 1 1 7 2833 1 1 8 ARG O O 5.879 -2.765 -0.775 1.00 . A A . 8 ARG O 1 1 7 2834 1 1 9 CYS C C 5.469 -6.386 1.503 1.00 . A A . 9 CYS C 1 1 7 2835 1 1 9 CYS CA C 5.535 -4.922 1.043 1.00 . A A . 9 CYS CA 1 1 7 2836 1 1 9 CYS CB C 4.529 -4.042 1.788 1.00 . A A . 9 CYS CB 1 1 7 2837 1 1 9 CYS H H 4.798 -5.701 -0.743 1.00 . A A . 9 CYS H 1 1 7 2838 1 1 9 CYS HA H 6.548 -4.548 1.206 1.00 . A A . 9 CYS HA 1 1 7 2839 1 1 9 CYS HB2 H 3.765 -3.844 1.174 1.00 . A A . 9 CYS HB2 1 1 7 2840 1 1 9 CYS HB3 H 4.195 -4.546 2.584 1.00 . A A . 9 CYS HB3 1 1 7 2841 1 1 9 CYS N N 5.213 -4.867 -0.370 1.00 . A A . 9 CYS N 1 1 7 2842 1 1 9 CYS O O 5.026 -7.241 0.727 1.00 . A A . 9 CYS O 1 1 7 2843 1 1 9 CYS SG S 5.232 -2.475 2.354 1.00 . A A . 9 CYS SG 1 1 7 2844 1 1 10 PRO C C 4.432 -8.478 3.680 1.00 . A A . 10 PRO C 1 1 7 2845 1 1 10 PRO CA C 5.850 -8.031 3.302 1.00 . A A . 10 PRO CA 1 1 7 2846 1 1 10 PRO CB C 6.798 -7.972 4.509 1.00 . A A . 10 PRO CB 1 1 7 2847 1 1 10 PRO CD C 6.518 -5.760 3.671 1.00 . A A . 10 PRO CD 1 1 7 2848 1 1 10 PRO CG C 6.665 -6.527 4.983 1.00 . A A . 10 PRO CG 1 1 7 2849 1 1 10 PRO HA H 6.243 -8.750 2.584 1.00 . A A . 10 PRO HA 1 1 7 2850 1 1 10 PRO HB2 H 6.511 -8.612 5.222 1.00 . A A . 10 PRO HB2 1 1 7 2851 1 1 10 PRO HB3 H 7.739 -8.175 4.237 1.00 . A A . 10 PRO HB3 1 1 7 2852 1 1 10 PRO HD2 H 5.945 -4.951 3.803 1.00 . A A . 10 PRO HD2 1 1 7 2853 1 1 10 PRO HD3 H 7.415 -5.482 3.328 1.00 . A A . 10 PRO HD3 1 1 7 2854 1 1 10 PRO HG2 H 5.858 -6.410 5.562 1.00 . A A . 10 PRO HG2 1 1 7 2855 1 1 10 PRO HG3 H 7.480 -6.234 5.483 1.00 . A A . 10 PRO HG3 1 1 7 2856 1 1 10 PRO N N 5.884 -6.685 2.743 1.00 . A A . 10 PRO N 1 1 7 2857 1 1 10 PRO O O 3.441 -7.781 3.445 1.00 . A A . 10 PRO O 1 1 7 2858 1 1 11 SER C C 1.854 -9.967 4.478 1.00 . A A . 11 SER C 1 1 7 2859 1 1 11 SER CA C 3.250 -10.274 5.002 1.00 . A A . 11 SER CA 1 1 7 2860 1 1 11 SER CB C 3.411 -9.862 6.449 1.00 . A A . 11 SER CB 1 1 7 2861 1 1 11 SER H H 5.251 -10.076 4.529 1.00 . A A . 11 SER H 1 1 7 2862 1 1 11 SER HA H 3.358 -11.355 4.935 1.00 . A A . 11 SER HA 1 1 7 2863 1 1 11 SER HB2 H 3.381 -8.865 6.523 1.00 . A A . 11 SER HB2 1 1 7 2864 1 1 11 SER HB3 H 2.676 -10.260 6.998 1.00 . A A . 11 SER HB3 1 1 7 2865 1 1 11 SER HG H 4.744 -10.153 7.844 1.00 . A A . 11 SER HG 1 1 7 2866 1 1 11 SER N N 4.364 -9.678 4.267 1.00 . A A . 11 SER N 1 1 7 2867 1 1 11 SER O O 0.913 -9.693 5.224 1.00 . A A . 11 SER O 1 1 7 2868 1 1 11 SER OG O 4.661 -10.339 6.904 1.00 . A A . 11 SER OG 1 1 7 2869 1 1 12 GLY C C -0.119 -8.424 2.733 1.00 . A A . 12 GLY C 1 1 7 2870 1 1 12 GLY CA C 0.495 -9.793 2.432 1.00 . A A . 12 GLY CA 1 1 7 2871 1 1 12 GLY H H 2.593 -10.265 2.693 1.00 . A A . 12 GLY H 1 1 7 2872 1 1 12 GLY HA2 H 0.688 -9.853 1.362 1.00 . A A . 12 GLY HA2 1 1 7 2873 1 1 12 GLY HA3 H -0.232 -10.563 2.691 1.00 . A A . 12 GLY HA3 1 1 7 2874 1 1 12 GLY N N 1.732 -10.034 3.161 1.00 . A A . 12 GLY N 1 1 7 2875 1 1 12 GLY O O -1.331 -8.332 2.929 1.00 . A A . 12 GLY O 1 1 7 2876 1 1 13 MET C C -0.045 -5.496 1.410 1.00 . A A . 13 MET C 1 1 7 2877 1 1 13 MET CA C 0.144 -6.006 2.843 1.00 . A A . 13 MET CA 1 1 7 2878 1 1 13 MET CB C 1.057 -5.071 3.640 1.00 . A A . 13 MET CB 1 1 7 2879 1 1 13 MET CE C 3.401 -3.929 5.577 1.00 . A A . 13 MET CE 1 1 7 2880 1 1 13 MET CG C 1.200 -5.556 5.083 1.00 . A A . 13 MET CG 1 1 7 2881 1 1 13 MET H H 1.697 -7.504 2.861 1.00 . A A . 13 MET H 1 1 7 2882 1 1 13 MET HA H -0.836 -6.002 3.320 1.00 . A A . 13 MET HA 1 1 7 2883 1 1 13 MET HB2 H 1.960 -5.049 3.210 1.00 . A A . 13 MET HB2 1 1 7 2884 1 1 13 MET HB3 H 0.665 -4.151 3.640 1.00 . A A . 13 MET HB3 1 1 7 2885 1 1 13 MET HE1 H 3.308 -3.501 4.581 1.00 . A A . 13 MET HE1 1 1 7 2886 1 1 13 MET HE2 H 3.909 -3.214 6.226 1.00 . A A . 13 MET HE2 1 1 7 2887 1 1 13 MET HE3 H 3.982 -4.849 5.528 1.00 . A A . 13 MET HE3 1 1 7 2888 1 1 13 MET HG2 H 0.310 -5.893 5.389 1.00 . A A . 13 MET HG2 1 1 7 2889 1 1 13 MET HG3 H 1.863 -6.305 5.097 1.00 . A A . 13 MET HG3 1 1 7 2890 1 1 13 MET N N 0.688 -7.367 2.846 1.00 . A A . 13 MET N 1 1 7 2891 1 1 13 MET O O 0.450 -6.099 0.451 1.00 . A A . 13 MET O 1 1 7 2892 1 1 13 MET SD S 1.756 -4.285 6.248 1.00 . A A . 13 MET SD 1 1 7 2893 1 1 14 CYS C C -0.447 -2.287 0.001 1.00 . A A . 14 CYS C 1 1 7 2894 1 1 14 CYS CA C -0.983 -3.727 -0.029 1.00 . A A . 14 CYS CA 1 1 7 2895 1 1 14 CYS CB C -2.490 -3.754 -0.303 1.00 . A A . 14 CYS CB 1 1 7 2896 1 1 14 CYS H H -1.104 -3.894 2.075 1.00 . A A . 14 CYS H 1 1 7 2897 1 1 14 CYS HA H -0.474 -4.269 -0.825 1.00 . A A . 14 CYS HA 1 1 7 2898 1 1 14 CYS HB2 H -2.915 -3.039 0.252 1.00 . A A . 14 CYS HB2 1 1 7 2899 1 1 14 CYS HB3 H -2.629 -3.551 -1.272 1.00 . A A . 14 CYS HB3 1 1 7 2900 1 1 14 CYS N N -0.734 -4.367 1.256 1.00 . A A . 14 CYS N 1 1 7 2901 1 1 14 CYS O O -0.193 -1.751 1.081 1.00 . A A . 14 CYS O 1 1 7 2902 1 1 14 CYS SG S -3.335 -5.324 0.066 1.00 . A A . 14 CYS SG 1 1 7 2903 1 1 15 CYS C C -0.744 0.716 -1.685 1.00 . A A . 15 CYS C 1 1 7 2904 1 1 15 CYS CA C 0.307 -0.331 -1.293 1.00 . A A . 15 CYS CA 1 1 7 2905 1 1 15 CYS CB C 1.438 -0.380 -2.323 1.00 . A A . 15 CYS CB 1 1 7 2906 1 1 15 CYS H H -0.564 -2.128 -2.020 1.00 . A A . 15 CYS H 1 1 7 2907 1 1 15 CYS HA H 0.741 -0.037 -0.337 1.00 . A A . 15 CYS HA 1 1 7 2908 1 1 15 CYS HB2 H 2.078 -1.100 -2.055 1.00 . A A . 15 CYS HB2 1 1 7 2909 1 1 15 CYS HB3 H 1.043 -0.600 -3.215 1.00 . A A . 15 CYS HB3 1 1 7 2910 1 1 15 CYS N N -0.280 -1.665 -1.170 1.00 . A A . 15 CYS N 1 1 7 2911 1 1 15 CYS O O -1.554 0.497 -2.589 1.00 . A A . 15 CYS O 1 1 7 2912 1 1 15 CYS SG S 2.356 1.173 -2.473 1.00 . A A . 15 CYS SG 1 1 7 2913 1 1 16 SER C C -1.425 3.668 -2.551 1.00 . A A . 16 SER C 1 1 7 2914 1 1 16 SER CA C -1.611 3.002 -1.192 1.00 . A A . 16 SER CA 1 1 7 2915 1 1 16 SER CB C -1.341 4.019 -0.072 1.00 . A A . 16 SER CB 1 1 7 2916 1 1 16 SER H H 0.048 1.991 -0.360 1.00 . A A . 16 SER H 1 1 7 2917 1 1 16 SER HA H -2.643 2.661 -1.115 1.00 . A A . 16 SER HA 1 1 7 2918 1 1 16 SER HB2 H -1.537 3.581 0.805 1.00 . A A . 16 SER HB2 1 1 7 2919 1 1 16 SER HB3 H -0.376 4.279 -0.108 1.00 . A A . 16 SER HB3 1 1 7 2920 1 1 16 SER HG H -2.088 5.624 0.706 1.00 . A A . 16 SER HG 1 1 7 2921 1 1 16 SER N N -0.712 1.867 -1.015 1.00 . A A . 16 SER N 1 1 7 2922 1 1 16 SER O O -0.646 3.245 -3.399 1.00 . A A . 16 SER O 1 1 7 2923 1 1 16 SER OG O -2.124 5.196 -0.168 1.00 . A A . 16 SER OG 1 1 7 2924 1 1 17 GLN C C -0.966 6.795 -3.350 1.00 . A A . 17 GLN C 1 1 7 2925 1 1 17 GLN CA C -1.959 5.715 -3.792 1.00 . A A . 17 GLN CA 1 1 7 2926 1 1 17 GLN CB C -3.315 6.341 -4.141 1.00 . A A . 17 GLN CB 1 1 7 2927 1 1 17 GLN CD C -5.095 4.744 -3.277 1.00 . A A . 17 GLN CD 1 1 7 2928 1 1 17 GLN CG C -4.400 5.317 -4.510 1.00 . A A . 17 GLN CG 1 1 7 2929 1 1 17 GLN H H -2.689 5.052 -1.919 1.00 . A A . 17 GLN H 1 1 7 2930 1 1 17 GLN HA H -1.546 5.201 -4.659 1.00 . A A . 17 GLN HA 1 1 7 2931 1 1 17 GLN HB2 H -3.633 6.864 -3.350 1.00 . A A . 17 GLN HB2 1 1 7 2932 1 1 17 GLN HB3 H -3.186 6.956 -4.919 1.00 . A A . 17 GLN HB3 1 1 7 2933 1 1 17 GLN HE21 H -4.021 3.017 -3.314 1.00 . A A . 17 GLN HE21 1 1 7 2934 1 1 17 GLN HE22 H -5.093 3.255 -1.935 1.00 . A A . 17 GLN HE22 1 1 7 2935 1 1 17 GLN HG2 H -5.084 5.766 -5.086 1.00 . A A . 17 GLN HG2 1 1 7 2936 1 1 17 GLN HG3 H -3.976 4.567 -5.018 1.00 . A A . 17 GLN HG3 1 1 7 2937 1 1 17 GLN N N -2.156 4.757 -2.730 1.00 . A A . 17 GLN N 1 1 7 2938 1 1 17 GLN NE2 N -4.726 3.555 -2.837 1.00 . A A . 17 GLN NE2 1 1 7 2939 1 1 17 GLN O O -0.363 7.458 -4.185 1.00 . A A . 17 GLN O 1 1 7 2940 1 1 17 GLN OE1 O -5.984 5.362 -2.702 1.00 . A A . 17 GLN OE1 1 1 7 2941 1 1 18 . C C 1.615 7.247 -1.263 1.00 . A A . 18 PFF C 1 1 7 2942 1 1 18 . CA C 0.230 7.877 -1.483 1.00 . A A . 18 PFF CA 1 1 7 2943 1 1 18 . CB C -0.336 8.467 -0.185 1.00 . A A . 18 PFF CB 1 1 7 2944 1 1 18 . CD1 C -1.549 10.546 -0.953 1.00 . A A . 18 PFF CD1 1 1 7 2945 1 1 18 . CD2 C -2.864 8.678 -0.114 1.00 . A A . 18 PFF CD2 1 1 7 2946 1 1 18 . CE1 C -2.731 11.262 -1.212 1.00 . A A . 18 PFF CE1 1 1 7 2947 1 1 18 . CE2 C -4.045 9.405 -0.352 1.00 . A A . 18 PFF CE2 1 1 7 2948 1 1 18 . CG C -1.612 9.257 -0.393 1.00 . A A . 18 PFF CG 1 1 7 2949 1 1 18 . CZ C -3.977 10.702 -0.888 1.00 . A A . 18 PFF CZ 1 1 7 2950 1 1 18 . F F -5.120 11.398 -1.128 1.00 . A A . 18 PFF F 1 1 7 2951 1 1 18 . H H -1.290 6.378 -1.386 1.00 . A A . 18 PFF H 1 1 7 2952 1 1 18 . HA H 0.368 8.700 -2.186 1.00 . A A . 18 PFF HA 1 1 7 2953 1 1 18 . HB2 H -0.519 7.664 0.528 1.00 . A A . 18 PFF HB2 1 1 7 2954 1 1 18 . HB3 H 0.404 9.140 0.248 1.00 . A A . 18 PFF HB3 1 1 7 2955 1 1 18 . HD1 H -0.593 10.992 -1.188 1.00 . A A . 18 PFF HD1 1 1 7 2956 1 1 18 . HD2 H -2.924 7.686 0.308 1.00 . A A . 18 PFF HD2 1 1 7 2957 1 1 18 . HE1 H -2.678 12.255 -1.637 1.00 . A A . 18 PFF HE1 1 1 7 2958 1 1 18 . HE2 H -5.006 8.969 -0.121 1.00 . A A . 18 PFF HE2 1 1 7 2959 1 1 18 . N N -0.741 6.932 -2.037 1.00 . A A . 18 PFF N 1 1 7 2960 1 1 18 . O O 2.503 7.890 -0.717 1.00 . A A . 18 PFF O 1 1 7 2961 1 1 19 GLY C C 3.444 4.583 -0.339 1.00 . A A . 19 GLY C 1 1 7 2962 1 1 19 GLY CA C 3.125 5.342 -1.628 1.00 . A A . 19 GLY CA 1 1 7 2963 1 1 19 GLY H H 1.066 5.528 -2.170 1.00 . A A . 19 GLY H 1 1 7 2964 1 1 19 GLY HA2 H 3.192 4.633 -2.454 1.00 . A A . 19 GLY HA2 1 1 7 2965 1 1 19 GLY HA3 H 3.903 6.092 -1.775 1.00 . A A . 19 GLY HA3 1 1 7 2966 1 1 19 GLY N N 1.812 5.985 -1.668 1.00 . A A . 19 GLY N 1 1 7 2967 1 1 19 GLY O O 4.579 4.146 -0.175 1.00 . A A . 19 GLY O 1 1 7 2968 1 1 20 . C C 1.880 2.374 1.895 1.00 . A A . 20 PFF C 1 1 7 2969 1 1 20 . CA C 2.648 3.703 1.841 1.00 . A A . 20 PFF CA 1 1 7 2970 1 1 20 . CB C 2.140 4.620 2.949 1.00 . A A . 20 PFF CB 1 1 7 2971 1 1 20 . CD1 C 2.223 7.056 2.289 1.00 . A A . 20 PFF CD1 1 1 7 2972 1 1 20 . CD2 C 3.933 6.205 3.789 1.00 . A A . 20 PFF CD2 1 1 7 2973 1 1 20 . CE1 C 2.718 8.359 2.455 1.00 . A A . 20 PFF CE1 1 1 7 2974 1 1 20 . CE2 C 4.426 7.508 3.960 1.00 . A A . 20 PFF CE2 1 1 7 2975 1 1 20 . CG C 2.794 5.985 2.995 1.00 . A A . 20 PFF CG 1 1 7 2976 1 1 20 . CZ C 3.810 8.587 3.307 1.00 . A A . 20 PFF CZ 1 1 7 2977 1 1 20 . F F 4.288 9.849 3.471 1.00 . A A . 20 PFF F 1 1 7 2978 1 1 20 . H H 1.584 4.834 0.415 1.00 . A A . 20 PFF H 1 1 7 2979 1 1 20 . HA H 3.697 3.489 2.006 1.00 . A A . 20 PFF HA 1 1 7 2980 1 1 20 . HB2 H 1.065 4.751 2.816 1.00 . A A . 20 PFF HB2 1 1 7 2981 1 1 20 . HB3 H 2.292 4.121 3.898 1.00 . A A . 20 PFF HB3 1 1 7 2982 1 1 20 . HD1 H 1.413 6.869 1.608 1.00 . A A . 20 PFF HD1 1 1 7 2983 1 1 20 . HD2 H 4.371 5.397 4.344 1.00 . A A . 20 PFF HD2 1 1 7 2984 1 1 20 . HE1 H 2.284 9.181 1.904 1.00 . A A . 20 PFF HE1 1 1 7 2985 1 1 20 . HE2 H 5.261 7.691 4.617 1.00 . A A . 20 PFF HE2 1 1 7 2986 1 1 20 . N N 2.477 4.407 0.570 1.00 . A A . 20 PFF N 1 1 7 2987 1 1 20 . O O 0.911 2.196 1.156 1.00 . A A . 20 PFF O 1 1 7 2988 1 1 21 CYS C C 0.655 -0.050 3.991 1.00 . A A . 21 CYS C 1 1 7 2989 1 1 21 CYS CA C 1.662 0.124 2.854 1.00 . A A . 21 CYS CA 1 1 7 2990 1 1 21 CYS CB C 2.758 -0.921 3.060 1.00 . A A . 21 CYS CB 1 1 7 2991 1 1 21 CYS H H 3.061 1.669 3.375 1.00 . A A . 21 CYS H 1 1 7 2992 1 1 21 CYS HA H 1.162 -0.085 1.913 1.00 . A A . 21 CYS HA 1 1 7 2993 1 1 21 CYS HB2 H 3.284 -0.664 3.871 1.00 . A A . 21 CYS HB2 1 1 7 2994 1 1 21 CYS HB3 H 2.319 -1.806 3.214 1.00 . A A . 21 CYS HB3 1 1 7 2995 1 1 21 CYS N N 2.263 1.455 2.784 1.00 . A A . 21 CYS N 1 1 7 2996 1 1 21 CYS O O 0.773 0.575 5.042 1.00 . A A . 21 CYS O 1 1 7 2997 1 1 21 CYS SG S 3.902 -1.096 1.684 1.00 . A A . 21 CYS SG 1 1 7 2998 1 1 22 GLY C C -2.078 -2.557 4.424 1.00 . A A . 22 GLY C 1 1 7 2999 1 1 22 GLY CA C -1.111 -1.481 4.911 1.00 . A A . 22 GLY CA 1 1 7 3000 1 1 22 GLY H H -0.405 -1.411 2.898 1.00 . A A . 22 GLY H 1 1 7 3001 1 1 22 GLY HA2 H -0.477 -1.901 5.694 1.00 . A A . 22 GLY HA2 1 1 7 3002 1 1 22 GLY HA3 H -1.677 -0.646 5.326 1.00 . A A . 22 GLY HA3 1 1 7 3003 1 1 22 GLY N N -0.270 -0.998 3.822 1.00 . A A . 22 GLY N 1 1 7 3004 1 1 22 GLY O O -2.059 -2.928 3.251 1.00 . A A . 22 GLY O 1 1 7 3005 1 1 23 LYS C C -5.409 -3.275 4.903 1.00 . A A . 23 LYS C 1 1 7 3006 1 1 23 LYS CA C -4.043 -3.963 4.954 1.00 . A A . 23 LYS CA 1 1 7 3007 1 1 23 LYS CB C -4.080 -5.159 5.916 1.00 . A A . 23 LYS CB 1 1 7 3008 1 1 23 LYS CD C -2.904 -7.191 6.798 1.00 . A A . 23 LYS CD 1 1 7 3009 1 1 23 LYS CE C -1.666 -8.088 6.713 1.00 . A A . 23 LYS CE 1 1 7 3010 1 1 23 LYS CG C -2.837 -6.045 5.783 1.00 . A A . 23 LYS CG 1 1 7 3011 1 1 23 LYS H H -2.843 -2.768 6.280 1.00 . A A . 23 LYS H 1 1 7 3012 1 1 23 LYS HA H -3.884 -4.324 3.944 1.00 . A A . 23 LYS HA 1 1 7 3013 1 1 23 LYS HB2 H -4.133 -4.817 6.854 1.00 . A A . 23 LYS HB2 1 1 7 3014 1 1 23 LYS HB3 H -4.891 -5.709 5.715 1.00 . A A . 23 LYS HB3 1 1 7 3015 1 1 23 LYS HD2 H -2.964 -6.806 7.719 1.00 . A A . 23 LYS HD2 1 1 7 3016 1 1 23 LYS HD3 H -3.718 -7.742 6.613 1.00 . A A . 23 LYS HD3 1 1 7 3017 1 1 23 LYS HE2 H -0.853 -7.509 6.656 1.00 . A A . 23 LYS HE2 1 1 7 3018 1 1 23 LYS HE3 H -1.619 -8.650 7.539 1.00 . A A . 23 LYS HE3 1 1 7 3019 1 1 23 LYS HG2 H -2.797 -6.423 4.858 1.00 . A A . 23 LYS HG2 1 1 7 3020 1 1 23 LYS HG3 H -2.019 -5.497 5.955 1.00 . A A . 23 LYS HG3 1 1 7 3021 1 1 23 LYS HZ1 H -0.816 -9.488 5.470 1.00 . A A . 23 LYS HZ1 1 1 7 3022 1 1 23 LYS HZ2 H -2.456 -9.643 5.590 1.00 . A A . 23 LYS HZ2 1 1 7 3023 1 1 23 LYS HZ3 H -1.787 -8.460 4.662 1.00 . A A . 23 LYS HZ3 1 1 7 3024 1 1 23 LYS N N -2.943 -3.054 5.315 1.00 . A A . 23 LYS N 1 1 7 3025 1 1 23 LYS NZ N -1.697 -8.981 5.532 1.00 . A A . 23 LYS NZ 1 1 7 3026 1 1 23 LYS O O -6.421 -3.913 4.644 1.00 . A A . 23 LYS O 1 1 7 3027 1 1 24 GLY C C -7.186 -0.843 3.783 1.00 . A A . 24 GLY C 1 1 7 3028 1 1 24 GLY CA C -6.678 -1.196 5.183 1.00 . A A . 24 GLY CA 1 1 7 3029 1 1 24 GLY H H -4.545 -1.521 5.240 1.00 . A A . 24 GLY H 1 1 7 3030 1 1 24 GLY HA2 H -7.443 -1.780 5.698 1.00 . A A . 24 GLY HA2 1 1 7 3031 1 1 24 GLY HA3 H -6.513 -0.275 5.741 1.00 . A A . 24 GLY HA3 1 1 7 3032 1 1 24 GLY N N -5.439 -1.967 5.144 1.00 . A A . 24 GLY N 1 1 7 3033 1 1 24 GLY O O -6.435 -0.903 2.803 1.00 . A A . 24 GLY O 1 1 7 3034 1 1 25 PRO C C -8.330 0.722 1.483 1.00 . A A . 25 PRO C 1 1 7 3035 1 1 25 PRO CA C -9.127 -0.194 2.408 1.00 . A A . 25 PRO CA 1 1 7 3036 1 1 25 PRO CB C -10.517 0.353 2.757 1.00 . A A . 25 PRO CB 1 1 7 3037 1 1 25 PRO CD C -9.335 -0.101 4.787 1.00 . A A . 25 PRO CD 1 1 7 3038 1 1 25 PRO CG C -10.385 0.840 4.202 1.00 . A A . 25 PRO CG 1 1 7 3039 1 1 25 PRO HA H -9.247 -1.153 1.903 1.00 . A A . 25 PRO HA 1 1 7 3040 1 1 25 PRO HB2 H -10.762 1.109 2.150 1.00 . A A . 25 PRO HB2 1 1 7 3041 1 1 25 PRO HB3 H -11.208 -0.367 2.688 1.00 . A A . 25 PRO HB3 1 1 7 3042 1 1 25 PRO HD2 H -8.832 0.349 5.525 1.00 . A A . 25 PRO HD2 1 1 7 3043 1 1 25 PRO HD3 H -9.764 -0.934 5.135 1.00 . A A . 25 PRO HD3 1 1 7 3044 1 1 25 PRO HG2 H -10.074 1.790 4.234 1.00 . A A . 25 PRO HG2 1 1 7 3045 1 1 25 PRO HG3 H -11.254 0.757 4.690 1.00 . A A . 25 PRO HG3 1 1 7 3046 1 1 25 PRO N N -8.450 -0.408 3.679 1.00 . A A . 25 PRO N 1 1 7 3047 1 1 25 PRO O O -8.032 0.335 0.357 1.00 . A A . 25 PRO O 1 1 7 3048 1 1 26 LYS C C -5.734 2.255 0.744 1.00 . A A . 26 LYS C 1 1 7 3049 1 1 26 LYS CA C -7.093 2.818 1.157 1.00 . A A . 26 LYS CA 1 1 7 3050 1 1 26 LYS CB C -6.903 4.134 1.919 1.00 . A A . 26 LYS CB 1 1 7 3051 1 1 26 LYS CD C -8.840 5.262 0.654 1.00 . A A . 26 LYS CD 1 1 7 3052 1 1 26 LYS CE C -7.800 5.736 -0.367 1.00 . A A . 26 LYS CE 1 1 7 3053 1 1 26 LYS CG C -8.192 4.966 2.017 1.00 . A A . 26 LYS CG 1 1 7 3054 1 1 26 LYS H H -8.153 2.170 2.896 1.00 . A A . 26 LYS H 1 1 7 3055 1 1 26 LYS HA H -7.614 3.014 0.225 1.00 . A A . 26 LYS HA 1 1 7 3056 1 1 26 LYS HB2 H -6.589 3.923 2.845 1.00 . A A . 26 LYS HB2 1 1 7 3057 1 1 26 LYS HB3 H -6.209 4.677 1.447 1.00 . A A . 26 LYS HB3 1 1 7 3058 1 1 26 LYS HD2 H -9.275 4.429 0.313 1.00 . A A . 26 LYS HD2 1 1 7 3059 1 1 26 LYS HD3 H -9.531 5.976 0.770 1.00 . A A . 26 LYS HD3 1 1 7 3060 1 1 26 LYS HE2 H -7.405 6.596 -0.045 1.00 . A A . 26 LYS HE2 1 1 7 3061 1 1 26 LYS HE3 H -7.081 5.044 -0.437 1.00 . A A . 26 LYS HE3 1 1 7 3062 1 1 26 LYS HG2 H -8.850 4.464 2.577 1.00 . A A . 26 LYS HG2 1 1 7 3063 1 1 26 LYS HG3 H -7.973 5.836 2.458 1.00 . A A . 26 LYS HG3 1 1 7 3064 1 1 26 LYS HZ1 H -8.939 5.158 -2.007 1.00 . A A . 26 LYS HZ1 1 1 7 3065 1 1 26 LYS HZ2 H -8.945 6.790 -1.747 1.00 . A A . 26 LYS HZ2 1 1 7 3066 1 1 26 LYS HZ3 H -7.606 6.023 -2.373 1.00 . A A . 26 LYS HZ3 1 1 7 3067 1 1 26 LYS N N -7.899 1.897 1.958 1.00 . A A . 26 LYS N 1 1 7 3068 1 1 26 LYS NZ N -8.379 5.954 -1.711 1.00 . A A . 26 LYS NZ 1 1 7 3069 1 1 26 LYS O O -5.192 2.704 -0.264 1.00 . A A . 26 LYS O 1 1 7 3070 1 1 27 TYR C C -4.139 -0.465 0.089 1.00 . A A . 27 TYR C 1 1 7 3071 1 1 27 TYR CA C -3.934 0.643 1.104 1.00 . A A . 27 TYR CA 1 1 7 3072 1 1 27 TYR CB C -3.285 0.038 2.340 1.00 . A A . 27 TYR CB 1 1 7 3073 1 1 27 TYR CD1 C -1.774 1.844 3.223 1.00 . A A . 27 TYR CD1 1 1 7 3074 1 1 27 TYR CD2 C -3.735 1.244 4.528 1.00 . A A . 27 TYR CD2 1 1 7 3075 1 1 27 TYR CE1 C -1.350 2.707 4.247 1.00 . A A . 27 TYR CE1 1 1 7 3076 1 1 27 TYR CE2 C -3.338 2.150 5.531 1.00 . A A . 27 TYR CE2 1 1 7 3077 1 1 27 TYR CG C -2.925 1.059 3.394 1.00 . A A . 27 TYR CG 1 1 7 3078 1 1 27 TYR CZ C -2.130 2.853 5.404 1.00 . A A . 27 TYR CZ 1 1 7 3079 1 1 27 TYR H H -5.746 0.847 2.208 1.00 . A A . 27 TYR H 1 1 7 3080 1 1 27 TYR HA H -3.257 1.383 0.677 1.00 . A A . 27 TYR HA 1 1 7 3081 1 1 27 TYR HB2 H -3.922 -0.620 2.742 1.00 . A A . 27 TYR HB2 1 1 7 3082 1 1 27 TYR HB3 H -2.450 -0.435 2.059 1.00 . A A . 27 TYR HB3 1 1 7 3083 1 1 27 TYR HD1 H -1.201 1.750 2.315 1.00 . A A . 27 TYR HD1 1 1 7 3084 1 1 27 TYR HD2 H -4.667 0.712 4.618 1.00 . A A . 27 TYR HD2 1 1 7 3085 1 1 27 TYR HE1 H -0.421 3.253 4.156 1.00 . A A . 27 TYR HE1 1 1 7 3086 1 1 27 TYR HE2 H -3.943 2.313 6.410 1.00 . A A . 27 TYR HE2 1 1 7 3087 1 1 27 TYR HH H -0.849 4.025 6.244 1.00 . A A . 27 TYR HH 1 1 7 3088 1 1 27 TYR N N -5.202 1.268 1.465 1.00 . A A . 27 TYR N 1 1 7 3089 1 1 27 TYR O O -3.300 -0.667 -0.783 1.00 . A A . 27 TYR O 1 1 7 3090 1 1 27 TYR OH O -1.778 3.767 6.347 1.00 . A A . 27 TYR OH 1 1 7 3091 1 1 28 CYS C C -6.596 -2.070 -1.702 1.00 . A A . 28 CYS C 1 1 7 3092 1 1 28 CYS CA C -5.506 -2.338 -0.646 1.00 . A A . 28 CYS CA 1 1 7 3093 1 1 28 CYS CB C -5.757 -3.544 0.254 1.00 . A A . 28 CYS CB 1 1 7 3094 1 1 28 CYS H H -5.776 -1.114 1.076 1.00 . A A . 28 CYS H 1 1 7 3095 1 1 28 CYS HA H -4.606 -2.560 -1.215 1.00 . A A . 28 CYS HA 1 1 7 3096 1 1 28 CYS HB2 H -5.228 -3.440 1.096 1.00 . A A . 28 CYS HB2 1 1 7 3097 1 1 28 CYS HB3 H -6.731 -3.590 0.475 1.00 . A A . 28 CYS HB3 1 1 7 3098 1 1 28 CYS N N -5.241 -1.204 0.215 1.00 . A A . 28 CYS N 1 1 7 3099 1 1 28 CYS O O -6.259 -1.798 -2.859 1.00 . A A . 28 CYS O 1 1 7 3100 1 1 28 CYS SG S -5.264 -5.075 -0.569 1.00 . A A . 28 CYS SG 1 1 7 3101 1 1 29 GLY C C -9.249 -0.658 -2.875 1.00 . A A . 29 GLY C 1 1 7 3102 1 1 29 GLY CA C -8.995 -2.052 -2.288 1.00 . A A . 29 GLY CA 1 1 7 3103 1 1 29 GLY H H -8.095 -2.248 -0.354 1.00 . A A . 29 GLY H 1 1 7 3104 1 1 29 GLY HA2 H -8.799 -2.734 -3.116 1.00 . A A . 29 GLY HA2 1 1 7 3105 1 1 29 GLY HA3 H -9.909 -2.380 -1.794 1.00 . A A . 29 GLY HA3 1 1 7 3106 1 1 29 GLY N N -7.881 -2.123 -1.332 1.00 . A A . 29 GLY N 1 1 7 3107 1 1 29 GLY O O -9.947 -0.542 -3.877 1.00 . A A . 29 GLY O 1 1 7 3108 1 1 30 ARG C C -9.746 2.610 -3.044 1.00 . A A . 30 ARG C 1 1 7 3109 1 1 30 ARG CA C -8.515 1.793 -2.641 1.00 . A A . 30 ARG CA 1 1 7 3110 1 1 30 ARG CB C -7.343 1.968 -3.613 1.00 . A A . 30 ARG CB 1 1 7 3111 1 1 30 ARG CD C -6.092 1.097 -5.609 1.00 . A A . 30 ARG CD 1 1 7 3112 1 1 30 ARG CG C -7.481 1.331 -5.006 1.00 . A A . 30 ARG CG 1 1 7 3113 1 1 30 ARG CZ C -4.187 0.205 -4.245 1.00 . A A . 30 ARG CZ 1 1 7 3114 1 1 30 ARG H H -8.201 0.124 -1.398 1.00 . A A . 30 ARG H 1 1 7 3115 1 1 30 ARG HA H -8.188 2.283 -1.728 1.00 . A A . 30 ARG HA 1 1 7 3116 1 1 30 ARG HB2 H -7.206 2.950 -3.744 1.00 . A A . 30 ARG HB2 1 1 7 3117 1 1 30 ARG HB3 H -6.533 1.572 -3.181 1.00 . A A . 30 ARG HB3 1 1 7 3118 1 1 30 ARG HD2 H -6.190 0.782 -6.553 1.00 . A A . 30 ARG HD2 1 1 7 3119 1 1 30 ARG HD3 H -5.576 1.954 -5.595 1.00 . A A . 30 ARG HD3 1 1 7 3120 1 1 30 ARG HE H -5.913 -0.701 -4.466 1.00 . A A . 30 ARG HE 1 1 7 3121 1 1 30 ARG HG2 H -7.959 0.457 -4.925 1.00 . A A . 30 ARG HG2 1 1 7 3122 1 1 30 ARG HG3 H -8.002 1.943 -5.601 1.00 . A A . 30 ARG HG3 1 1 7 3123 1 1 30 ARG HH11 H -3.573 1.878 -5.173 1.00 . A A . 30 ARG HH11 1 1 7 3124 1 1 30 ARG HH12 H -2.462 1.211 -4.024 1.00 . A A . 30 ARG HH12 1 1 7 3125 1 1 30 ARG HH21 H -4.484 -1.406 -3.102 1.00 . A A . 30 ARG HH21 1 1 7 3126 1 1 30 ARG HH22 H -2.968 -0.599 -2.882 1.00 . A A . 30 ARG HH22 1 1 7 3127 1 1 30 ARG N N -8.661 0.377 -2.266 1.00 . A A . 30 ARG N 1 1 7 3128 1 1 30 ARG NE N -5.369 0.079 -4.827 1.00 . A A . 30 ARG NE 1 1 7 3129 1 1 30 ARG NH1 N -3.340 1.175 -4.501 1.00 . A A . 30 ARG NH1 1 1 7 3130 1 1 30 ARG NH2 N -3.854 -0.667 -3.340 1.00 . A A . 30 ARG NH2 1 1 7 3131 1 1 30 ARG O O -9.735 3.817 -2.809 1.00 . A A . 30 ARG O 1 1 7 3132 1 1 31 NH2 HN1 H -11.610 2.589 -3.800 1.00 . A A . 31 NH2 HN1 1 1 7 3133 1 1 31 NH2 HN2 H -10.788 1.034 -3.775 1.00 . A A . 31 NH2 HN2 1 1 7 3134 1 1 31 NH2 N N -10.810 2.024 -3.569 1.00 . A A . 31 NH2 N 1 1 7 3135 2 2 1 NAG C1 C -6.351 15.908 1.205 1.00 . B A . 32 NAG C1 1 1 7 3136 2 2 1 NAG C2 C -6.565 14.406 1.292 1.00 . B A . 32 NAG C2 1 1 7 3137 2 2 1 NAG C3 C -5.395 13.779 2.064 1.00 . B A . 32 NAG C3 1 1 7 3138 2 2 1 NAG C4 C -4.024 14.157 1.472 1.00 . B A . 32 NAG C4 1 1 7 3139 2 2 1 NAG C5 C -3.988 15.681 1.279 1.00 . B A . 32 NAG C5 1 1 7 3140 2 2 1 NAG C6 C -2.700 16.121 0.552 1.00 . B A . 32 NAG C6 1 1 7 3141 2 2 1 NAG C7 C -8.256 14.314 3.121 1.00 . B A . 32 NAG C7 1 1 7 3142 2 2 1 NAG C8 C -9.620 13.820 3.498 1.00 . B A . 32 NAG C8 1 1 7 3143 2 2 1 NAG H1 H -6.386 16.395 2.181 1.00 . B A . 32 NAG H1 1 1 7 3144 2 2 1 NAG H2 H -6.507 14.023 0.273 1.00 . B A . 32 NAG H2 1 1 7 3145 2 2 1 NAG H3 H -5.404 14.087 3.108 1.00 . B A . 32 NAG H3 1 1 7 3146 2 2 1 NAG H4 H -3.914 13.675 0.501 1.00 . B A . 32 NAG H4 1 1 7 3147 2 2 1 NAG H5 H -3.993 16.161 2.260 1.00 . B A . 32 NAG H5 1 1 7 3148 2 2 1 NAG H61 H -1.840 15.973 1.205 1.00 . B A . 32 NAG H61 1 1 7 3149 2 2 1 NAG H62 H -2.775 17.185 0.326 1.00 . B A . 32 NAG H62 1 1 7 3150 2 2 1 NAG H81 H -9.666 12.748 3.328 1.00 . B A . 32 NAG H81 1 1 7 3151 2 2 1 NAG H82 H -9.761 14.036 4.555 1.00 . B A . 32 NAG H82 1 1 7 3152 2 2 1 NAG H83 H -10.362 14.349 2.906 1.00 . B A . 32 NAG H83 1 1 7 3153 2 2 1 NAG HN2 H -8.553 13.577 1.304 1.00 . B A . 32 NAG HN2 1 1 7 3154 2 2 1 NAG HO1 H -6.747 16.971 -0.267 1.00 . B A . 32 NAG HO1 1 1 7 3155 2 2 1 NAG HO3 H -4.906 12.010 2.564 1.00 . B A . 32 NAG HO3 1 1 7 3156 2 2 1 NAG HO4 H 3.167 6.493 7.283 1.00 . B A . 32 NAG HO4 1 1 7 3157 2 2 1 NAG HO6 H -1.955 14.618 -0.458 1.00 . B A . 32 NAG HO6 1 1 7 3158 2 2 1 NAG N2 N -7.882 14.064 1.873 1.00 . B A . 32 NAG N2 1 1 7 3159 2 2 1 NAG O1 O -7.274 16.467 0.358 1.00 . B A . 32 NAG O1 1 1 7 3160 2 2 1 NAG O3 O -5.581 12.384 1.989 1.00 . B A . 32 NAG O3 1 1 7 3161 2 2 1 NAG O4 O -2.916 13.801 2.346 1.00 . B A . 32 NAG O4 1 1 7 3162 2 2 1 NAG O5 O -5.117 16.149 0.558 1.00 . B A . 32 NAG O5 1 1 7 3163 2 2 1 NAG O6 O -2.467 15.419 -0.660 1.00 . B A . 32 NAG O6 1 1 7 3164 2 2 1 NAG O7 O -7.564 14.905 3.934 1.00 . B A . 32 NAG O7 1 1 8 3165 1 1 1 VAL C C 4.505 6.075 6.505 1.00 . A A . 1 VAL C 1 1 8 3166 1 1 1 VAL CA C 5.370 7.324 6.412 1.00 . A A . 1 VAL CA 1 1 8 3167 1 1 1 VAL CB C 5.529 8.051 7.756 1.00 . A A . 1 VAL CB 1 1 8 3168 1 1 1 VAL CG1 C 4.213 8.556 8.348 1.00 . A A . 1 VAL CG1 1 1 8 3169 1 1 1 VAL CG2 C 6.235 7.163 8.781 1.00 . A A . 1 VAL CG2 1 1 8 3170 1 1 1 VAL H1 H 5.334 9.086 5.334 1.00 . A A . 1 VAL H1 1 1 8 3171 1 1 1 VAL H2 H 3.849 8.345 5.456 1.00 . A A . 1 VAL H2 1 1 8 3172 1 1 1 VAL H3 H 5.037 7.729 4.456 1.00 . A A . 1 VAL H3 1 1 8 3173 1 1 1 VAL HA H 6.363 7.001 6.098 1.00 . A A . 1 VAL HA 1 1 8 3174 1 1 1 VAL HB H 6.169 8.916 7.580 1.00 . A A . 1 VAL HB 1 1 8 3175 1 1 1 VAL HG11 H 3.516 7.736 8.517 1.00 . A A . 1 VAL HG11 1 1 8 3176 1 1 1 VAL HG12 H 4.416 9.035 9.307 1.00 . A A . 1 VAL HG12 1 1 8 3177 1 1 1 VAL HG13 H 3.758 9.301 7.696 1.00 . A A . 1 VAL HG13 1 1 8 3178 1 1 1 VAL HG21 H 7.161 6.767 8.364 1.00 . A A . 1 VAL HG21 1 1 8 3179 1 1 1 VAL HG22 H 6.484 7.760 9.660 1.00 . A A . 1 VAL HG22 1 1 8 3180 1 1 1 VAL HG23 H 5.592 6.342 9.100 1.00 . A A . 1 VAL HG23 1 1 8 3181 1 1 1 VAL N N 4.849 8.202 5.342 1.00 . A A . 1 VAL N 1 1 8 3182 1 1 1 VAL O O 3.305 6.141 6.231 1.00 . A A . 1 VAL O 1 1 8 3183 1 1 2 GLY C C 4.558 3.420 5.017 1.00 . A A . 2 GLY C 1 1 8 3184 1 1 2 GLY CA C 4.476 3.646 6.522 1.00 . A A . 2 GLY CA 1 1 8 3185 1 1 2 GLY H H 6.082 4.932 7.076 1.00 . A A . 2 GLY H 1 1 8 3186 1 1 2 GLY HA2 H 4.992 2.838 7.040 1.00 . A A . 2 GLY HA2 1 1 8 3187 1 1 2 GLY HA3 H 3.427 3.652 6.825 1.00 . A A . 2 GLY HA3 1 1 8 3188 1 1 2 GLY N N 5.105 4.927 6.824 1.00 . A A . 2 GLY N 1 1 8 3189 1 1 2 GLY O O 3.577 3.573 4.298 1.00 . A A . 2 GLY O 1 1 8 3190 1 1 3 GLU C C 5.864 1.616 2.586 1.00 . A A . 3 GLU C 1 1 8 3191 1 1 3 GLU CA C 6.022 3.053 3.088 1.00 . A A . 3 GLU CA 1 1 8 3192 1 1 3 GLU CB C 7.450 3.548 2.808 1.00 . A A . 3 GLU CB 1 1 8 3193 1 1 3 GLU CD C 6.709 5.962 2.851 1.00 . A A . 3 GLU CD 1 1 8 3194 1 1 3 GLU CG C 7.723 4.948 3.373 1.00 . A A . 3 GLU CG 1 1 8 3195 1 1 3 GLU H H 6.528 2.964 5.151 1.00 . A A . 3 GLU H 1 1 8 3196 1 1 3 GLU HA H 5.328 3.689 2.543 1.00 . A A . 3 GLU HA 1 1 8 3197 1 1 3 GLU HB2 H 8.096 2.906 3.222 1.00 . A A . 3 GLU HB2 1 1 8 3198 1 1 3 GLU HB3 H 7.590 3.571 1.818 1.00 . A A . 3 GLU HB3 1 1 8 3199 1 1 3 GLU HG2 H 7.666 4.914 4.371 1.00 . A A . 3 GLU HG2 1 1 8 3200 1 1 3 GLU HG3 H 8.641 5.236 3.101 1.00 . A A . 3 GLU HG3 1 1 8 3201 1 1 3 GLU N N 5.760 3.138 4.521 1.00 . A A . 3 GLU N 1 1 8 3202 1 1 3 GLU O O 6.149 0.666 3.313 1.00 . A A . 3 GLU O 1 1 8 3203 1 1 3 GLU OE1 O 6.478 5.965 1.614 1.00 . A A . 3 GLU OE1 1 1 8 3204 1 1 3 GLU OE2 O 6.128 6.697 3.689 1.00 . A A . 3 GLU OE2 1 1 8 3205 1 1 4 CYS C C 7.349 0.466 0.118 1.00 . A A . 4 CYS C 1 1 8 3206 1 1 4 CYS CA C 5.914 0.244 0.598 1.00 . A A . 4 CYS CA 1 1 8 3207 1 1 4 CYS CB C 4.967 -0.010 -0.586 1.00 . A A . 4 CYS CB 1 1 8 3208 1 1 4 CYS H H 5.248 2.254 0.757 1.00 . A A . 4 CYS H 1 1 8 3209 1 1 4 CYS HA H 5.907 -0.630 1.252 1.00 . A A . 4 CYS HA 1 1 8 3210 1 1 4 CYS HB2 H 4.819 0.857 -1.061 1.00 . A A . 4 CYS HB2 1 1 8 3211 1 1 4 CYS HB3 H 5.407 -0.659 -1.206 1.00 . A A . 4 CYS HB3 1 1 8 3212 1 1 4 CYS N N 5.491 1.440 1.318 1.00 . A A . 4 CYS N 1 1 8 3213 1 1 4 CYS O O 7.874 1.578 0.179 1.00 . A A . 4 CYS O 1 1 8 3214 1 1 4 CYS SG S 3.356 -0.680 -0.112 1.00 . A A . 4 CYS SG 1 1 8 3215 1 1 5 VAL C C 8.788 0.326 -2.675 1.00 . A A . 5 VAL C 1 1 8 3216 1 1 5 VAL CA C 9.166 -0.347 -1.346 1.00 . A A . 5 VAL CA 1 1 8 3217 1 1 5 VAL CB C 9.871 -1.702 -1.536 1.00 . A A . 5 VAL CB 1 1 8 3218 1 1 5 VAL CG1 C 11.271 -1.537 -2.139 1.00 . A A . 5 VAL CG1 1 1 8 3219 1 1 5 VAL CG2 C 10.057 -2.414 -0.190 1.00 . A A . 5 VAL CG2 1 1 8 3220 1 1 5 VAL H H 7.477 -1.416 -0.564 1.00 . A A . 5 VAL H 1 1 8 3221 1 1 5 VAL HA H 9.844 0.323 -0.819 1.00 . A A . 5 VAL HA 1 1 8 3222 1 1 5 VAL HB H 9.249 -2.339 -2.167 1.00 . A A . 5 VAL HB 1 1 8 3223 1 1 5 VAL HG11 H 11.884 -0.909 -1.492 1.00 . A A . 5 VAL HG11 1 1 8 3224 1 1 5 VAL HG12 H 11.745 -2.515 -2.235 1.00 . A A . 5 VAL HG12 1 1 8 3225 1 1 5 VAL HG13 H 11.226 -1.088 -3.130 1.00 . A A . 5 VAL HG13 1 1 8 3226 1 1 5 VAL HG21 H 10.632 -3.328 -0.335 1.00 . A A . 5 VAL HG21 1 1 8 3227 1 1 5 VAL HG22 H 10.590 -1.764 0.503 1.00 . A A . 5 VAL HG22 1 1 8 3228 1 1 5 VAL HG23 H 9.095 -2.688 0.243 1.00 . A A . 5 VAL HG23 1 1 8 3229 1 1 5 VAL N N 7.953 -0.523 -0.537 1.00 . A A . 5 VAL N 1 1 8 3230 1 1 5 VAL O O 9.055 -0.186 -3.755 1.00 . A A . 5 VAL O 1 1 8 3231 1 1 6 ARG C C 6.665 1.244 -4.656 1.00 . A A . 6 ARG C 1 1 8 3232 1 1 6 ARG CA C 7.252 2.151 -3.571 1.00 . A A . 6 ARG CA 1 1 8 3233 1 1 6 ARG CB C 8.046 3.386 -4.040 1.00 . A A . 6 ARG CB 1 1 8 3234 1 1 6 ARG CD C 7.800 4.658 -1.784 1.00 . A A . 6 ARG CD 1 1 8 3235 1 1 6 ARG CG C 7.542 4.645 -3.308 1.00 . A A . 6 ARG CG 1 1 8 3236 1 1 6 ARG CZ C 6.044 6.455 -1.355 1.00 . A A . 6 ARG CZ 1 1 8 3237 1 1 6 ARG H H 7.854 1.690 -1.610 1.00 . A A . 6 ARG H 1 1 8 3238 1 1 6 ARG HA H 6.357 2.517 -3.072 1.00 . A A . 6 ARG HA 1 1 8 3239 1 1 6 ARG HB2 H 9.016 3.252 -3.839 1.00 . A A . 6 ARG HB2 1 1 8 3240 1 1 6 ARG HB3 H 7.923 3.504 -5.025 1.00 . A A . 6 ARG HB3 1 1 8 3241 1 1 6 ARG HD2 H 7.544 3.761 -1.423 1.00 . A A . 6 ARG HD2 1 1 8 3242 1 1 6 ARG HD3 H 8.778 4.808 -1.641 1.00 . A A . 6 ARG HD3 1 1 8 3243 1 1 6 ARG HE H 7.088 5.610 0.023 1.00 . A A . 6 ARG HE 1 1 8 3244 1 1 6 ARG HG2 H 7.999 5.440 -3.707 1.00 . A A . 6 ARG HG2 1 1 8 3245 1 1 6 ARG HG3 H 6.556 4.717 -3.457 1.00 . A A . 6 ARG HG3 1 1 8 3246 1 1 6 ARG HH11 H 6.413 6.644 -3.317 1.00 . A A . 6 ARG HH11 1 1 8 3247 1 1 6 ARG HH12 H 5.003 7.466 -2.740 1.00 . A A . 6 ARG HH12 1 1 8 3248 1 1 6 ARG HH21 H 5.298 6.490 0.498 1.00 . A A . 6 ARG HH21 1 1 8 3249 1 1 6 ARG HH22 H 4.404 7.381 -0.688 1.00 . A A . 6 ARG HH22 1 1 8 3250 1 1 6 ARG N N 8.015 1.416 -2.561 1.00 . A A . 6 ARG N 1 1 8 3251 1 1 6 ARG NE N 7.065 5.688 -1.003 1.00 . A A . 6 ARG NE 1 1 8 3252 1 1 6 ARG NH1 N 5.801 6.889 -2.566 1.00 . A A . 6 ARG NH1 1 1 8 3253 1 1 6 ARG NH2 N 5.182 6.802 -0.445 1.00 . A A . 6 ARG NH2 1 1 8 3254 1 1 6 ARG O O 6.553 1.601 -5.822 1.00 . A A . 6 ARG O 1 1 8 3255 1 1 7 GLY C C 5.122 -2.208 -4.304 1.00 . A A . 7 GLY C 1 1 8 3256 1 1 7 GLY CA C 5.552 -0.926 -5.028 1.00 . A A . 7 GLY CA 1 1 8 3257 1 1 7 GLY H H 6.377 -0.034 -3.201 1.00 . A A . 7 GLY H 1 1 8 3258 1 1 7 GLY HA2 H 4.662 -0.476 -5.471 1.00 . A A . 7 GLY HA2 1 1 8 3259 1 1 7 GLY HA3 H 6.221 -1.208 -5.842 1.00 . A A . 7 GLY HA3 1 1 8 3260 1 1 7 GLY N N 6.221 0.076 -4.194 1.00 . A A . 7 GLY N 1 1 8 3261 1 1 7 GLY O O 4.056 -2.742 -4.601 1.00 . A A . 7 GLY O 1 1 8 3262 1 1 8 ARG C C 5.767 -3.738 -1.069 1.00 . A A . 8 ARG C 1 1 8 3263 1 1 8 ARG CA C 5.546 -3.907 -2.570 1.00 . A A . 8 ARG CA 1 1 8 3264 1 1 8 ARG CB C 6.332 -5.120 -3.103 1.00 . A A . 8 ARG CB 1 1 8 3265 1 1 8 ARG CD C 4.484 -6.902 -2.827 1.00 . A A . 8 ARG CD 1 1 8 3266 1 1 8 ARG CG C 5.456 -6.185 -3.781 1.00 . A A . 8 ARG CG 1 1 8 3267 1 1 8 ARG CZ C 2.282 -6.320 -1.757 1.00 . A A . 8 ARG CZ 1 1 8 3268 1 1 8 ARG H H 6.819 -2.298 -3.191 1.00 . A A . 8 ARG H 1 1 8 3269 1 1 8 ARG HA H 4.481 -4.081 -2.699 1.00 . A A . 8 ARG HA 1 1 8 3270 1 1 8 ARG HB2 H 7.001 -4.792 -3.770 1.00 . A A . 8 ARG HB2 1 1 8 3271 1 1 8 ARG HB3 H 6.809 -5.548 -2.335 1.00 . A A . 8 ARG HB3 1 1 8 3272 1 1 8 ARG HD2 H 4.307 -7.822 -3.178 1.00 . A A . 8 ARG HD2 1 1 8 3273 1 1 8 ARG HD3 H 4.906 -6.965 -1.923 1.00 . A A . 8 ARG HD3 1 1 8 3274 1 1 8 ARG HE H 2.929 -5.634 -3.504 1.00 . A A . 8 ARG HE 1 1 8 3275 1 1 8 ARG HG2 H 4.920 -5.740 -4.499 1.00 . A A . 8 ARG HG2 1 1 8 3276 1 1 8 ARG HG3 H 6.057 -6.871 -4.190 1.00 . A A . 8 ARG HG3 1 1 8 3277 1 1 8 ARG HH11 H 3.384 -7.336 -0.423 1.00 . A A . 8 ARG HH11 1 1 8 3278 1 1 8 ARG HH12 H 1.752 -7.003 0.054 1.00 . A A . 8 ARG HH12 1 1 8 3279 1 1 8 ARG HH21 H 0.868 -5.311 -2.758 1.00 . A A . 8 ARG HH21 1 1 8 3280 1 1 8 ARG HH22 H 0.398 -5.911 -1.203 1.00 . A A . 8 ARG HH22 1 1 8 3281 1 1 8 ARG N N 5.908 -2.708 -3.340 1.00 . A A . 8 ARG N 1 1 8 3282 1 1 8 ARG NE N 3.203 -6.184 -2.705 1.00 . A A . 8 ARG NE 1 1 8 3283 1 1 8 ARG NH1 N 2.489 -6.935 -0.619 1.00 . A A . 8 ARG NH1 1 1 8 3284 1 1 8 ARG NH2 N 1.089 -5.807 -1.919 1.00 . A A . 8 ARG NH2 1 1 8 3285 1 1 8 ARG O O 6.412 -2.796 -0.626 1.00 . A A . 8 ARG O 1 1 8 3286 1 1 9 CYS C C 5.118 -6.221 1.562 1.00 . A A . 9 CYS C 1 1 8 3287 1 1 9 CYS CA C 5.334 -4.744 1.159 1.00 . A A . 9 CYS CA 1 1 8 3288 1 1 9 CYS CB C 4.271 -3.785 1.710 1.00 . A A . 9 CYS CB 1 1 8 3289 1 1 9 CYS H H 4.745 -5.436 -0.730 1.00 . A A . 9 CYS H 1 1 8 3290 1 1 9 CYS HA H 6.327 -4.416 1.470 1.00 . A A . 9 CYS HA 1 1 8 3291 1 1 9 CYS HB2 H 4.142 -3.058 1.035 1.00 . A A . 9 CYS HB2 1 1 8 3292 1 1 9 CYS HB3 H 3.421 -4.302 1.810 1.00 . A A . 9 CYS HB3 1 1 8 3293 1 1 9 CYS N N 5.241 -4.679 -0.293 1.00 . A A . 9 CYS N 1 1 8 3294 1 1 9 CYS O O 4.823 -7.025 0.672 1.00 . A A . 9 CYS O 1 1 8 3295 1 1 9 CYS SG S 4.619 -2.996 3.301 1.00 . A A . 9 CYS SG 1 1 8 3296 1 1 10 PRO C C 3.832 -8.710 3.059 1.00 . A A . 10 PRO C 1 1 8 3297 1 1 10 PRO CA C 5.194 -8.021 3.244 1.00 . A A . 10 PRO CA 1 1 8 3298 1 1 10 PRO CB C 5.622 -8.045 4.717 1.00 . A A . 10 PRO CB 1 1 8 3299 1 1 10 PRO CD C 5.814 -5.826 3.925 1.00 . A A . 10 PRO CD 1 1 8 3300 1 1 10 PRO CG C 6.528 -6.823 4.832 1.00 . A A . 10 PRO CG 1 1 8 3301 1 1 10 PRO HA H 5.933 -8.574 2.662 1.00 . A A . 10 PRO HA 1 1 8 3302 1 1 10 PRO HB2 H 4.830 -7.963 5.322 1.00 . A A . 10 PRO HB2 1 1 8 3303 1 1 10 PRO HB3 H 6.122 -8.884 4.932 1.00 . A A . 10 PRO HB3 1 1 8 3304 1 1 10 PRO HD2 H 5.082 -5.362 4.423 1.00 . A A . 10 PRO HD2 1 1 8 3305 1 1 10 PRO HD3 H 6.460 -5.148 3.573 1.00 . A A . 10 PRO HD3 1 1 8 3306 1 1 10 PRO HG2 H 6.575 -6.491 5.774 1.00 . A A . 10 PRO HG2 1 1 8 3307 1 1 10 PRO HG3 H 7.451 -7.021 4.502 1.00 . A A . 10 PRO HG3 1 1 8 3308 1 1 10 PRO N N 5.266 -6.619 2.837 1.00 . A A . 10 PRO N 1 1 8 3309 1 1 10 PRO O O 2.842 -8.116 2.628 1.00 . A A . 10 PRO O 1 1 8 3310 1 1 11 SER C C 1.318 -10.305 3.642 1.00 . A A . 11 SER C 1 1 8 3311 1 1 11 SER CA C 2.695 -10.935 3.433 1.00 . A A . 11 SER CA 1 1 8 3312 1 1 11 SER CB C 2.973 -11.962 4.530 1.00 . A A . 11 SER CB 1 1 8 3313 1 1 11 SER H H 4.666 -10.415 3.774 1.00 . A A . 11 SER H 1 1 8 3314 1 1 11 SER HA H 2.696 -11.464 2.480 1.00 . A A . 11 SER HA 1 1 8 3315 1 1 11 SER HB2 H 2.804 -11.555 5.427 1.00 . A A . 11 SER HB2 1 1 8 3316 1 1 11 SER HB3 H 2.380 -12.758 4.408 1.00 . A A . 11 SER HB3 1 1 8 3317 1 1 11 SER HG H 4.503 -13.049 5.067 1.00 . A A . 11 SER HG 1 1 8 3318 1 1 11 SER N N 3.812 -9.995 3.425 1.00 . A A . 11 SER N 1 1 8 3319 1 1 11 SER O O 0.948 -9.953 4.758 1.00 . A A . 11 SER O 1 1 8 3320 1 1 11 SER OG O 4.332 -12.353 4.427 1.00 . A A . 11 SER OG 1 1 8 3321 1 1 12 GLY C C -0.974 -8.180 2.836 1.00 . A A . 12 GLY C 1 1 8 3322 1 1 12 GLY CA C -0.834 -9.691 2.632 1.00 . A A . 12 GLY CA 1 1 8 3323 1 1 12 GLY H H 0.920 -10.447 1.670 1.00 . A A . 12 GLY H 1 1 8 3324 1 1 12 GLY HA2 H -1.348 -9.954 1.708 1.00 . A A . 12 GLY HA2 1 1 8 3325 1 1 12 GLY HA3 H -1.345 -10.190 3.456 1.00 . A A . 12 GLY HA3 1 1 8 3326 1 1 12 GLY N N 0.545 -10.170 2.564 1.00 . A A . 12 GLY N 1 1 8 3327 1 1 12 GLY O O -2.097 -7.670 2.826 1.00 . A A . 12 GLY O 1 1 8 3328 1 1 13 MET C C -0.099 -5.441 1.604 1.00 . A A . 13 MET C 1 1 8 3329 1 1 13 MET CA C 0.052 -5.983 3.025 1.00 . A A . 13 MET CA 1 1 8 3330 1 1 13 MET CB C 1.302 -5.397 3.683 1.00 . A A . 13 MET CB 1 1 8 3331 1 1 13 MET CE C 0.880 -6.473 7.704 1.00 . A A . 13 MET CE 1 1 8 3332 1 1 13 MET CG C 1.550 -5.958 5.083 1.00 . A A . 13 MET CG 1 1 8 3333 1 1 13 MET H H 1.046 -7.872 2.964 1.00 . A A . 13 MET H 1 1 8 3334 1 1 13 MET HA H -0.820 -5.678 3.604 1.00 . A A . 13 MET HA 1 1 8 3335 1 1 13 MET HB2 H 2.094 -5.607 3.109 1.00 . A A . 13 MET HB2 1 1 8 3336 1 1 13 MET HB3 H 1.193 -4.405 3.751 1.00 . A A . 13 MET HB3 1 1 8 3337 1 1 13 MET HE1 H 0.971 -7.532 7.460 1.00 . A A . 13 MET HE1 1 1 8 3338 1 1 13 MET HE2 H 1.858 -6.076 7.975 1.00 . A A . 13 MET HE2 1 1 8 3339 1 1 13 MET HE3 H 0.196 -6.352 8.544 1.00 . A A . 13 MET HE3 1 1 8 3340 1 1 13 MET HG2 H 1.632 -6.952 5.014 1.00 . A A . 13 MET HG2 1 1 8 3341 1 1 13 MET HG3 H 2.407 -5.576 5.428 1.00 . A A . 13 MET HG3 1 1 8 3342 1 1 13 MET N N 0.126 -7.438 2.991 1.00 . A A . 13 MET N 1 1 8 3343 1 1 13 MET O O 0.219 -6.119 0.621 1.00 . A A . 13 MET O 1 1 8 3344 1 1 13 MET SD S 0.238 -5.575 6.268 1.00 . A A . 13 MET SD 1 1 8 3345 1 1 14 CYS C C -0.442 -2.140 0.189 1.00 . A A . 14 CYS C 1 1 8 3346 1 1 14 CYS CA C -0.930 -3.591 0.223 1.00 . A A . 14 CYS CA 1 1 8 3347 1 1 14 CYS CB C -2.451 -3.688 0.036 1.00 . A A . 14 CYS CB 1 1 8 3348 1 1 14 CYS H H -0.762 -3.672 2.336 1.00 . A A . 14 CYS H 1 1 8 3349 1 1 14 CYS HA H -0.447 -4.123 -0.593 1.00 . A A . 14 CYS HA 1 1 8 3350 1 1 14 CYS HB2 H -2.868 -2.912 0.508 1.00 . A A . 14 CYS HB2 1 1 8 3351 1 1 14 CYS HB3 H -2.644 -3.626 -0.943 1.00 . A A . 14 CYS HB3 1 1 8 3352 1 1 14 CYS N N -0.567 -4.203 1.492 1.00 . A A . 14 CYS N 1 1 8 3353 1 1 14 CYS O O -0.093 -1.580 1.228 1.00 . A A . 14 CYS O 1 1 8 3354 1 1 14 CYS SG S -3.231 -5.210 0.665 1.00 . A A . 14 CYS SG 1 1 8 3355 1 1 15 CYS C C -0.892 0.750 -1.741 1.00 . A A . 15 CYS C 1 1 8 3356 1 1 15 CYS CA C 0.164 -0.229 -1.232 1.00 . A A . 15 CYS CA 1 1 8 3357 1 1 15 CYS CB C 1.272 -0.386 -2.275 1.00 . A A . 15 CYS CB 1 1 8 3358 1 1 15 CYS H H -0.738 -2.013 -1.830 1.00 . A A . 15 CYS H 1 1 8 3359 1 1 15 CYS HA H 0.598 0.142 -0.311 1.00 . A A . 15 CYS HA 1 1 8 3360 1 1 15 CYS HB2 H 0.860 -0.725 -3.121 1.00 . A A . 15 CYS HB2 1 1 8 3361 1 1 15 CYS HB3 H 1.678 0.513 -2.438 1.00 . A A . 15 CYS HB3 1 1 8 3362 1 1 15 CYS N N -0.421 -1.537 -1.001 1.00 . A A . 15 CYS N 1 1 8 3363 1 1 15 CYS O O -1.502 0.493 -2.777 1.00 . A A . 15 CYS O 1 1 8 3364 1 1 15 CYS SG S 2.595 -1.525 -1.794 1.00 . A A . 15 CYS SG 1 1 8 3365 1 1 16 SER C C -1.149 3.557 -2.866 1.00 . A A . 16 SER C 1 1 8 3366 1 1 16 SER CA C -1.905 2.939 -1.689 1.00 . A A . 16 SER CA 1 1 8 3367 1 1 16 SER CB C -2.337 4.002 -0.671 1.00 . A A . 16 SER CB 1 1 8 3368 1 1 16 SER H H -0.455 2.130 -0.316 1.00 . A A . 16 SER H 1 1 8 3369 1 1 16 SER HA H -2.808 2.470 -2.079 1.00 . A A . 16 SER HA 1 1 8 3370 1 1 16 SER HB2 H -2.931 4.661 -1.133 1.00 . A A . 16 SER HB2 1 1 8 3371 1 1 16 SER HB3 H -2.846 3.551 0.063 1.00 . A A . 16 SER HB3 1 1 8 3372 1 1 16 SER HG H -1.575 5.093 0.729 1.00 . A A . 16 SER HG 1 1 8 3373 1 1 16 SER N N -1.086 1.894 -1.077 1.00 . A A . 16 SER N 1 1 8 3374 1 1 16 SER O O 0.078 3.499 -2.931 1.00 . A A . 16 SER O 1 1 8 3375 1 1 16 SER OG O -1.252 4.699 -0.101 1.00 . A A . 16 SER OG 1 1 8 3376 1 1 17 GLN C C -0.222 5.861 -4.761 1.00 . A A . 17 GLN C 1 1 8 3377 1 1 17 GLN CA C -1.250 4.745 -5.016 1.00 . A A . 17 GLN CA 1 1 8 3378 1 1 17 GLN CB C -2.354 5.181 -5.980 1.00 . A A . 17 GLN CB 1 1 8 3379 1 1 17 GLN CD C -4.373 6.688 -6.100 1.00 . A A . 17 GLN CD 1 1 8 3380 1 1 17 GLN CG C -3.001 6.470 -5.484 1.00 . A A . 17 GLN CG 1 1 8 3381 1 1 17 GLN H H -2.863 4.222 -3.729 1.00 . A A . 17 GLN H 1 1 8 3382 1 1 17 GLN HA H -0.715 3.941 -5.507 1.00 . A A . 17 GLN HA 1 1 8 3383 1 1 17 GLN HB2 H -1.960 5.336 -6.886 1.00 . A A . 17 GLN HB2 1 1 8 3384 1 1 17 GLN HB3 H -3.048 4.463 -6.036 1.00 . A A . 17 GLN HB3 1 1 8 3385 1 1 17 GLN HE21 H -3.634 7.500 -7.811 1.00 . A A . 17 GLN HE21 1 1 8 3386 1 1 17 GLN HE22 H -5.384 7.351 -7.671 1.00 . A A . 17 GLN HE22 1 1 8 3387 1 1 17 GLN HG2 H -3.097 6.422 -4.490 1.00 . A A . 17 GLN HG2 1 1 8 3388 1 1 17 GLN HG3 H -2.412 7.241 -5.726 1.00 . A A . 17 GLN HG3 1 1 8 3389 1 1 17 GLN N N -1.859 4.204 -3.797 1.00 . A A . 17 GLN N 1 1 8 3390 1 1 17 GLN NE2 N -4.457 7.229 -7.298 1.00 . A A . 17 GLN NE2 1 1 8 3391 1 1 17 GLN O O 0.486 6.275 -5.670 1.00 . A A . 17 GLN O 1 1 8 3392 1 1 17 GLN OE1 O -5.386 6.365 -5.488 1.00 . A A . 17 GLN OE1 1 1 8 3393 1 1 18 . C C 2.201 6.529 -2.596 1.00 . A A . 18 PFF C 1 1 8 3394 1 1 18 . CA C 0.918 7.249 -3.059 1.00 . A A . 18 PFF CA 1 1 8 3395 1 1 18 . CB C 0.300 8.104 -1.948 1.00 . A A . 18 PFF CB 1 1 8 3396 1 1 18 . CD1 C -2.154 8.405 -2.500 1.00 . A A . 18 PFF CD1 1 1 8 3397 1 1 18 . CD2 C -0.572 10.144 -3.126 1.00 . A A . 18 PFF CD2 1 1 8 3398 1 1 18 . CE1 C -3.127 9.003 -3.319 1.00 . A A . 18 PFF CE1 1 1 8 3399 1 1 18 . CE2 C -1.548 10.742 -3.942 1.00 . A A . 18 PFF CE2 1 1 8 3400 1 1 18 . CG C -0.858 8.951 -2.436 1.00 . A A . 18 PFF CG 1 1 8 3401 1 1 18 . CZ C -2.825 10.168 -4.044 1.00 . A A . 18 PFF CZ 1 1 8 3402 1 1 18 . F F -3.750 10.698 -4.886 1.00 . A A . 18 PFF F 1 1 8 3403 1 1 18 . H H -0.718 5.926 -2.816 1.00 . A A . 18 PFF H 1 1 8 3404 1 1 18 . HA H 1.197 7.909 -3.883 1.00 . A A . 18 PFF HA 1 1 8 3405 1 1 18 . HB2 H -0.060 7.440 -1.168 1.00 . A A . 18 PFF HB2 1 1 8 3406 1 1 18 . HB3 H 1.072 8.754 -1.537 1.00 . A A . 18 PFF HB3 1 1 8 3407 1 1 18 . HD1 H -2.376 7.475 -1.998 1.00 . A A . 18 PFF HD1 1 1 8 3408 1 1 18 . HD2 H 0.425 10.560 -3.099 1.00 . A A . 18 PFF HD2 1 1 8 3409 1 1 18 . HE1 H -4.099 8.553 -3.431 1.00 . A A . 18 PFF HE1 1 1 8 3410 1 1 18 . HE2 H -1.317 11.640 -4.495 1.00 . A A . 18 PFF HE2 1 1 8 3411 1 1 18 . N N -0.106 6.316 -3.514 1.00 . A A . 18 PFF N 1 1 8 3412 1 1 18 . O O 3.157 7.180 -2.163 1.00 . A A . 18 PFF O 1 1 8 3413 1 1 19 GLY C C 3.483 3.939 -0.895 1.00 . A A . 19 GLY C 1 1 8 3414 1 1 19 GLY CA C 3.386 4.343 -2.368 1.00 . A A . 19 GLY CA 1 1 8 3415 1 1 19 GLY H H 1.406 4.713 -3.017 1.00 . A A . 19 GLY H 1 1 8 3416 1 1 19 GLY HA2 H 3.310 3.429 -2.957 1.00 . A A . 19 GLY HA2 1 1 8 3417 1 1 19 GLY HA3 H 4.306 4.843 -2.656 1.00 . A A . 19 GLY HA3 1 1 8 3418 1 1 19 GLY N N 2.236 5.192 -2.681 1.00 . A A . 19 GLY N 1 1 8 3419 1 1 19 GLY O O 4.487 3.364 -0.477 1.00 . A A . 19 GLY O 1 1 8 3420 1 1 20 . C C 1.820 2.527 1.559 1.00 . A A . 20 PFF C 1 1 8 3421 1 1 20 . CA C 2.418 3.920 1.317 1.00 . A A . 20 PFF CA 1 1 8 3422 1 1 20 . CB C 1.594 5.004 2.006 1.00 . A A . 20 PFF CB 1 1 8 3423 1 1 20 . CD1 C 3.374 6.783 2.153 1.00 . A A . 20 PFF CD1 1 1 8 3424 1 1 20 . CD2 C 1.218 7.394 1.221 1.00 . A A . 20 PFF CD2 1 1 8 3425 1 1 20 . CE1 C 3.823 8.105 1.989 1.00 . A A . 20 PFF CE1 1 1 8 3426 1 1 20 . CE2 C 1.654 8.723 1.086 1.00 . A A . 20 PFF CE2 1 1 8 3427 1 1 20 . CG C 2.076 6.421 1.763 1.00 . A A . 20 PFF CG 1 1 8 3428 1 1 20 . CZ C 2.963 9.075 1.452 1.00 . A A . 20 PFF CZ 1 1 8 3429 1 1 20 . F F 3.399 10.350 1.277 1.00 . A A . 20 PFF F 1 1 8 3430 1 1 20 . H H 1.616 4.632 -0.501 1.00 . A A . 20 PFF H 1 1 8 3431 1 1 20 . HA H 3.428 3.939 1.719 1.00 . A A . 20 PFF HA 1 1 8 3432 1 1 20 . HB2 H 0.559 4.912 1.681 1.00 . A A . 20 PFF HB2 1 1 8 3433 1 1 20 . HB3 H 1.636 4.816 3.071 1.00 . A A . 20 PFF HB3 1 1 8 3434 1 1 20 . HD1 H 4.020 6.031 2.571 1.00 . A A . 20 PFF HD1 1 1 8 3435 1 1 20 . HD2 H 0.203 7.135 0.963 1.00 . A A . 20 PFF HD2 1 1 8 3436 1 1 20 . HE1 H 4.840 8.370 2.238 1.00 . A A . 20 PFF HE1 1 1 8 3437 1 1 20 . HE2 H 0.988 9.478 0.696 1.00 . A A . 20 PFF HE2 1 1 8 3438 1 1 20 . N N 2.454 4.236 -0.102 1.00 . A A . 20 PFF N 1 1 8 3439 1 1 20 . O O 0.982 2.082 0.778 1.00 . A A . 20 PFF O 1 1 8 3440 1 1 21 CYS C C 0.877 0.289 4.055 1.00 . A A . 21 CYS C 1 1 8 3441 1 1 21 CYS CA C 1.869 0.457 2.904 1.00 . A A . 21 CYS CA 1 1 8 3442 1 1 21 CYS CB C 3.146 -0.311 3.266 1.00 . A A . 21 CYS CB 1 1 8 3443 1 1 21 CYS H H 2.797 2.333 3.314 1.00 . A A . 21 CYS H 1 1 8 3444 1 1 21 CYS HA H 1.445 0.014 2.007 1.00 . A A . 21 CYS HA 1 1 8 3445 1 1 21 CYS HB2 H 3.755 -0.294 2.473 1.00 . A A . 21 CYS HB2 1 1 8 3446 1 1 21 CYS HB3 H 3.584 0.157 4.033 1.00 . A A . 21 CYS HB3 1 1 8 3447 1 1 21 CYS N N 2.214 1.852 2.640 1.00 . A A . 21 CYS N 1 1 8 3448 1 1 21 CYS O O 0.991 0.955 5.082 1.00 . A A . 21 CYS O 1 1 8 3449 1 1 21 CYS SG S 2.879 -2.041 3.737 1.00 . A A . 21 CYS SG 1 1 8 3450 1 1 22 GLY C C -1.639 -2.395 4.705 1.00 . A A . 22 GLY C 1 1 8 3451 1 1 22 GLY CA C -0.708 -1.249 5.092 1.00 . A A . 22 GLY CA 1 1 8 3452 1 1 22 GLY H H -0.117 -1.161 3.034 1.00 . A A . 22 GLY H 1 1 8 3453 1 1 22 GLY HA2 H 0.030 -1.626 5.801 1.00 . A A . 22 GLY HA2 1 1 8 3454 1 1 22 GLY HA3 H -1.285 -0.465 5.578 1.00 . A A . 22 GLY HA3 1 1 8 3455 1 1 22 GLY N N -0.013 -0.698 3.937 1.00 . A A . 22 GLY N 1 1 8 3456 1 1 22 GLY O O -1.762 -2.743 3.532 1.00 . A A . 22 GLY O 1 1 8 3457 1 1 23 LYS C C -4.629 -3.579 4.949 1.00 . A A . 23 LYS C 1 1 8 3458 1 1 23 LYS CA C -3.274 -4.074 5.445 1.00 . A A . 23 LYS CA 1 1 8 3459 1 1 23 LYS CB C -3.432 -4.912 6.727 1.00 . A A . 23 LYS CB 1 1 8 3460 1 1 23 LYS CD C -3.646 -7.250 5.697 1.00 . A A . 23 LYS CD 1 1 8 3461 1 1 23 LYS CE C -4.589 -7.758 4.599 1.00 . A A . 23 LYS CE 1 1 8 3462 1 1 23 LYS CG C -4.305 -6.167 6.564 1.00 . A A . 23 LYS CG 1 1 8 3463 1 1 23 LYS H H -2.089 -2.735 6.645 1.00 . A A . 23 LYS H 1 1 8 3464 1 1 23 LYS HA H -2.882 -4.679 4.648 1.00 . A A . 23 LYS HA 1 1 8 3465 1 1 23 LYS HB2 H -2.522 -5.201 7.025 1.00 . A A . 23 LYS HB2 1 1 8 3466 1 1 23 LYS HB3 H -3.846 -4.333 7.430 1.00 . A A . 23 LYS HB3 1 1 8 3467 1 1 23 LYS HD2 H -2.828 -6.867 5.268 1.00 . A A . 23 LYS HD2 1 1 8 3468 1 1 23 LYS HD3 H -3.387 -8.019 6.282 1.00 . A A . 23 LYS HD3 1 1 8 3469 1 1 23 LYS HE2 H -4.286 -8.665 4.307 1.00 . A A . 23 LYS HE2 1 1 8 3470 1 1 23 LYS HE3 H -5.515 -7.819 4.971 1.00 . A A . 23 LYS HE3 1 1 8 3471 1 1 23 LYS HG2 H -4.484 -6.550 7.470 1.00 . A A . 23 LYS HG2 1 1 8 3472 1 1 23 LYS HG3 H -5.169 -5.900 6.138 1.00 . A A . 23 LYS HG3 1 1 8 3473 1 1 23 LYS HZ1 H -5.232 -7.196 2.713 1.00 . A A . 23 LYS HZ1 1 1 8 3474 1 1 23 LYS HZ2 H -4.887 -5.914 3.686 1.00 . A A . 23 LYS HZ2 1 1 8 3475 1 1 23 LYS HZ3 H -3.664 -6.837 3.025 1.00 . A A . 23 LYS HZ3 1 1 8 3476 1 1 23 LYS N N -2.310 -2.994 5.694 1.00 . A A . 23 LYS N 1 1 8 3477 1 1 23 LYS NZ N -4.602 -6.856 3.425 1.00 . A A . 23 LYS NZ 1 1 8 3478 1 1 23 LYS O O -5.329 -4.293 4.233 1.00 . A A . 23 LYS O 1 1 8 3479 1 1 24 GLY C C -6.848 -1.258 4.102 1.00 . A A . 24 GLY C 1 1 8 3480 1 1 24 GLY CA C -6.335 -1.845 5.419 1.00 . A A . 24 GLY CA 1 1 8 3481 1 1 24 GLY H H -4.230 -1.938 5.889 1.00 . A A . 24 GLY H 1 1 8 3482 1 1 24 GLY HA2 H -7.007 -2.651 5.719 1.00 . A A . 24 GLY HA2 1 1 8 3483 1 1 24 GLY HA3 H -6.378 -1.066 6.179 1.00 . A A . 24 GLY HA3 1 1 8 3484 1 1 24 GLY N N -4.971 -2.370 5.372 1.00 . A A . 24 GLY N 1 1 8 3485 1 1 24 GLY O O -6.086 -1.026 3.158 1.00 . A A . 24 GLY O 1 1 8 3486 1 1 25 PRO C C -8.234 0.552 2.071 1.00 . A A . 25 PRO C 1 1 8 3487 1 1 25 PRO CA C -8.858 -0.630 2.807 1.00 . A A . 25 PRO CA 1 1 8 3488 1 1 25 PRO CB C -10.317 -0.381 3.206 1.00 . A A . 25 PRO CB 1 1 8 3489 1 1 25 PRO CD C -9.080 -0.988 5.158 1.00 . A A . 25 PRO CD 1 1 8 3490 1 1 25 PRO CG C -10.258 -0.125 4.713 1.00 . A A . 25 PRO CG 1 1 8 3491 1 1 25 PRO HA H -8.825 -1.491 2.138 1.00 . A A . 25 PRO HA 1 1 8 3492 1 1 25 PRO HB2 H -10.685 0.415 2.726 1.00 . A A . 25 PRO HB2 1 1 8 3493 1 1 25 PRO HB3 H -10.881 -1.182 3.005 1.00 . A A . 25 PRO HB3 1 1 8 3494 1 1 25 PRO HD2 H -8.652 -0.604 5.976 1.00 . A A . 25 PRO HD2 1 1 8 3495 1 1 25 PRO HD3 H -9.380 -1.923 5.346 1.00 . A A . 25 PRO HD3 1 1 8 3496 1 1 25 PRO HG2 H -10.090 0.841 4.908 1.00 . A A . 25 PRO HG2 1 1 8 3497 1 1 25 PRO HG3 H -11.105 -0.413 5.160 1.00 . A A . 25 PRO HG3 1 1 8 3498 1 1 25 PRO N N -8.156 -0.963 4.039 1.00 . A A . 25 PRO N 1 1 8 3499 1 1 25 PRO O O -7.995 0.452 0.870 1.00 . A A . 25 PRO O 1 1 8 3500 1 1 26 LYS C C -5.912 2.439 1.411 1.00 . A A . 26 LYS C 1 1 8 3501 1 1 26 LYS CA C -7.227 2.787 2.118 1.00 . A A . 26 LYS CA 1 1 8 3502 1 1 26 LYS CB C -6.987 3.886 3.157 1.00 . A A . 26 LYS CB 1 1 8 3503 1 1 26 LYS CD C -9.178 5.209 2.739 1.00 . A A . 26 LYS CD 1 1 8 3504 1 1 26 LYS CE C -8.602 6.487 2.106 1.00 . A A . 26 LYS CE 1 1 8 3505 1 1 26 LYS CG C -8.260 4.504 3.749 1.00 . A A . 26 LYS CG 1 1 8 3506 1 1 26 LYS H H -8.057 1.679 3.751 1.00 . A A . 26 LYS H 1 1 8 3507 1 1 26 LYS HA H -7.892 3.162 1.344 1.00 . A A . 26 LYS HA 1 1 8 3508 1 1 26 LYS HB2 H -6.455 3.493 3.907 1.00 . A A . 26 LYS HB2 1 1 8 3509 1 1 26 LYS HB3 H -6.461 4.616 2.721 1.00 . A A . 26 LYS HB3 1 1 8 3510 1 1 26 LYS HD2 H -9.380 4.564 2.002 1.00 . A A . 26 LYS HD2 1 1 8 3511 1 1 26 LYS HD3 H -10.026 5.453 3.210 1.00 . A A . 26 LYS HD3 1 1 8 3512 1 1 26 LYS HE2 H -9.362 7.047 1.775 1.00 . A A . 26 LYS HE2 1 1 8 3513 1 1 26 LYS HE3 H -8.099 6.989 2.809 1.00 . A A . 26 LYS HE3 1 1 8 3514 1 1 26 LYS HG2 H -8.784 3.773 4.185 1.00 . A A . 26 LYS HG2 1 1 8 3515 1 1 26 LYS HG3 H -7.986 5.175 4.438 1.00 . A A . 26 LYS HG3 1 1 8 3516 1 1 26 LYS HZ1 H -8.014 5.435 0.420 1.00 . A A . 26 LYS HZ1 1 1 8 3517 1 1 26 LYS HZ2 H -7.698 7.013 0.328 1.00 . A A . 26 LYS HZ2 1 1 8 3518 1 1 26 LYS HZ3 H -6.716 6.095 1.258 1.00 . A A . 26 LYS HZ3 1 1 8 3519 1 1 26 LYS N N -7.869 1.638 2.761 1.00 . A A . 26 LYS N 1 1 8 3520 1 1 26 LYS NZ N -7.685 6.224 0.971 1.00 . A A . 26 LYS NZ 1 1 8 3521 1 1 26 LYS O O -5.517 3.158 0.490 1.00 . A A . 26 LYS O 1 1 8 3522 1 1 27 TYR C C -4.486 -0.228 0.065 1.00 . A A . 27 TYR C 1 1 8 3523 1 1 27 TYR CA C -4.091 0.819 1.100 1.00 . A A . 27 TYR CA 1 1 8 3524 1 1 27 TYR CB C -3.127 0.204 2.118 1.00 . A A . 27 TYR CB 1 1 8 3525 1 1 27 TYR CD1 C -1.609 2.105 2.782 1.00 . A A . 27 TYR CD1 1 1 8 3526 1 1 27 TYR CD2 C -3.082 1.160 4.471 1.00 . A A . 27 TYR CD2 1 1 8 3527 1 1 27 TYR CE1 C -1.032 2.942 3.754 1.00 . A A . 27 TYR CE1 1 1 8 3528 1 1 27 TYR CE2 C -2.514 2.015 5.437 1.00 . A A . 27 TYR CE2 1 1 8 3529 1 1 27 TYR CG C -2.604 1.183 3.147 1.00 . A A . 27 TYR CG 1 1 8 3530 1 1 27 TYR CZ C -1.483 2.900 5.079 1.00 . A A . 27 TYR CZ 1 1 8 3531 1 1 27 TYR H H -5.665 0.757 2.524 1.00 . A A . 27 TYR H 1 1 8 3532 1 1 27 TYR HA H -3.575 1.620 0.578 1.00 . A A . 27 TYR HA 1 1 8 3533 1 1 27 TYR HB2 H -3.606 -0.531 2.599 1.00 . A A . 27 TYR HB2 1 1 8 3534 1 1 27 TYR HB3 H -2.347 -0.175 1.621 1.00 . A A . 27 TYR HB3 1 1 8 3535 1 1 27 TYR HD1 H -1.275 2.152 1.758 1.00 . A A . 27 TYR HD1 1 1 8 3536 1 1 27 TYR HD2 H -3.873 0.477 4.745 1.00 . A A . 27 TYR HD2 1 1 8 3537 1 1 27 TYR HE1 H -0.248 3.629 3.490 1.00 . A A . 27 TYR HE1 1 1 8 3538 1 1 27 TYR HE2 H -2.865 2.018 6.457 1.00 . A A . 27 TYR HE2 1 1 8 3539 1 1 27 TYR HH H -0.323 4.374 5.634 1.00 . A A . 27 TYR HH 1 1 8 3540 1 1 27 TYR N N -5.265 1.334 1.792 1.00 . A A . 27 TYR N 1 1 8 3541 1 1 27 TYR O O -4.002 -0.199 -1.059 1.00 . A A . 27 TYR O 1 1 8 3542 1 1 27 TYR OH O -1.070 3.850 5.964 1.00 . A A . 27 TYR OH 1 1 8 3543 1 1 28 CYS C C -6.744 -2.356 -1.271 1.00 . A A . 28 CYS C 1 1 8 3544 1 1 28 CYS CA C -5.554 -2.392 -0.300 1.00 . A A . 28 CYS CA 1 1 8 3545 1 1 28 CYS CB C -5.697 -3.508 0.733 1.00 . A A . 28 CYS CB 1 1 8 3546 1 1 28 CYS H H -5.688 -1.133 1.405 1.00 . A A . 28 CYS H 1 1 8 3547 1 1 28 CYS HA H -4.667 -2.586 -0.901 1.00 . A A . 28 CYS HA 1 1 8 3548 1 1 28 CYS HB2 H -5.132 -3.286 1.527 1.00 . A A . 28 CYS HB2 1 1 8 3549 1 1 28 CYS HB3 H -6.655 -3.568 1.012 1.00 . A A . 28 CYS HB3 1 1 8 3550 1 1 28 CYS N N -5.354 -1.162 0.449 1.00 . A A . 28 CYS N 1 1 8 3551 1 1 28 CYS O O -6.731 -3.047 -2.284 1.00 . A A . 28 CYS O 1 1 8 3552 1 1 28 CYS SG S -5.179 -5.110 0.078 1.00 . A A . 28 CYS SG 1 1 8 3553 1 1 29 GLY C C -9.019 0.245 -2.239 1.00 . A A . 29 GLY C 1 1 8 3554 1 1 29 GLY CA C -8.878 -1.242 -1.888 1.00 . A A . 29 GLY CA 1 1 8 3555 1 1 29 GLY H H -7.701 -1.014 -0.119 1.00 . A A . 29 GLY H 1 1 8 3556 1 1 29 GLY HA2 H -8.766 -1.799 -2.820 1.00 . A A . 29 GLY HA2 1 1 8 3557 1 1 29 GLY HA3 H -9.799 -1.569 -1.409 1.00 . A A . 29 GLY HA3 1 1 8 3558 1 1 29 GLY N N -7.748 -1.520 -0.995 1.00 . A A . 29 GLY N 1 1 8 3559 1 1 29 GLY O O -9.931 0.619 -2.973 1.00 . A A . 29 GLY O 1 1 8 3560 1 1 30 ARG C C -9.186 3.343 -1.295 1.00 . A A . 30 ARG C 1 1 8 3561 1 1 30 ARG CA C -8.031 2.549 -1.896 1.00 . A A . 30 ARG CA 1 1 8 3562 1 1 30 ARG CB C -7.832 2.892 -3.382 1.00 . A A . 30 ARG CB 1 1 8 3563 1 1 30 ARG CD C -5.292 3.113 -3.251 1.00 . A A . 30 ARG CD 1 1 8 3564 1 1 30 ARG CG C -6.478 2.400 -3.912 1.00 . A A . 30 ARG CG 1 1 8 3565 1 1 30 ARG CZ C -5.600 5.503 -2.489 1.00 . A A . 30 ARG CZ 1 1 8 3566 1 1 30 ARG H H -7.578 0.711 -0.949 1.00 . A A . 30 ARG H 1 1 8 3567 1 1 30 ARG HA H -7.154 2.873 -1.343 1.00 . A A . 30 ARG HA 1 1 8 3568 1 1 30 ARG HB2 H -8.562 2.461 -3.913 1.00 . A A . 30 ARG HB2 1 1 8 3569 1 1 30 ARG HB3 H -7.880 3.885 -3.493 1.00 . A A . 30 ARG HB3 1 1 8 3570 1 1 30 ARG HD2 H -5.280 2.893 -2.276 1.00 . A A . 30 ARG HD2 1 1 8 3571 1 1 30 ARG HD3 H -4.443 2.797 -3.674 1.00 . A A . 30 ARG HD3 1 1 8 3572 1 1 30 ARG HE H -5.481 4.934 -4.363 1.00 . A A . 30 ARG HE 1 1 8 3573 1 1 30 ARG HG2 H -6.402 1.419 -3.734 1.00 . A A . 30 ARG HG2 1 1 8 3574 1 1 30 ARG HG3 H -6.441 2.564 -4.898 1.00 . A A . 30 ARG HG3 1 1 8 3575 1 1 30 ARG HH11 H -5.293 4.352 -0.873 1.00 . A A . 30 ARG HH11 1 1 8 3576 1 1 30 ARG HH12 H -5.680 6.008 -0.547 1.00 . A A . 30 ARG HH12 1 1 8 3577 1 1 30 ARG HH21 H -5.932 6.926 -3.861 1.00 . A A . 30 ARG HH21 1 1 8 3578 1 1 30 ARG HH22 H -6.034 7.439 -2.210 1.00 . A A . 30 ARG HH22 1 1 8 3579 1 1 30 ARG N N -8.141 1.100 -1.697 1.00 . A A . 30 ARG N 1 1 8 3580 1 1 30 ARG NE N -5.398 4.574 -3.415 1.00 . A A . 30 ARG NE 1 1 8 3581 1 1 30 ARG NH1 N -5.518 5.269 -1.201 1.00 . A A . 30 ARG NH1 1 1 8 3582 1 1 30 ARG NH2 N -5.877 6.718 -2.884 1.00 . A A . 30 ARG NH2 1 1 8 3583 1 1 30 ARG O O -8.939 4.281 -0.539 1.00 . A A . 30 ARG O 1 1 8 3584 1 1 31 NH2 HN1 H -10.560 2.193 -2.221 1.00 . A A . 31 NH2 HN1 1 1 8 3585 1 1 31 NH2 HN2 H -11.201 3.489 -1.206 1.00 . A A . 31 NH2 HN2 1 1 8 3586 1 1 31 NH2 N N -10.424 2.982 -1.597 1.00 . A A . 31 NH2 N 1 1 8 3587 2 2 1 NAG C1 C -8.367 11.448 -3.149 1.00 . B A . 32 NAG C1 1 1 8 3588 2 2 1 NAG C2 C -7.593 10.149 -3.012 1.00 . B A . 32 NAG C2 1 1 8 3589 2 2 1 NAG C3 C -6.688 10.283 -1.777 1.00 . B A . 32 NAG C3 1 1 8 3590 2 2 1 NAG C4 C -5.786 11.538 -1.853 1.00 . B A . 32 NAG C4 1 1 8 3591 2 2 1 NAG C5 C -6.651 12.762 -2.182 1.00 . B A . 32 NAG C5 1 1 8 3592 2 2 1 NAG C6 C -5.794 14.021 -2.430 1.00 . B A . 32 NAG C6 1 1 8 3593 2 2 1 NAG C7 C -8.717 7.991 -2.185 1.00 . B A . 32 NAG C7 1 1 8 3594 2 2 1 NAG C8 C -9.896 7.122 -2.494 1.00 . B A . 32 NAG C8 1 1 8 3595 2 2 1 NAG H1 H -9.041 11.609 -2.305 1.00 . B A . 32 NAG H1 1 1 8 3596 2 2 1 NAG H2 H -6.941 10.076 -3.884 1.00 . B A . 32 NAG H2 1 1 8 3597 2 2 1 NAG H3 H -7.299 10.328 -0.875 1.00 . B A . 32 NAG H3 1 1 8 3598 2 2 1 NAG H4 H -5.079 11.390 -2.669 1.00 . B A . 32 NAG H4 1 1 8 3599 2 2 1 NAG H5 H -7.301 12.968 -1.328 1.00 . B A . 32 NAG H5 1 1 8 3600 2 2 1 NAG H61 H -5.278 14.304 -1.512 1.00 . B A . 32 NAG H61 1 1 8 3601 2 2 1 NAG H62 H -6.454 14.840 -2.717 1.00 . B A . 32 NAG H62 1 1 8 3602 2 2 1 NAG H81 H -10.800 7.727 -2.462 1.00 . B A . 32 NAG H81 1 1 8 3603 2 2 1 NAG H82 H -9.764 6.680 -3.479 1.00 . B A . 32 NAG H82 1 1 8 3604 2 2 1 NAG H83 H -9.952 6.341 -1.741 1.00 . B A . 32 NAG H83 1 1 8 3605 2 2 1 NAG HN2 H -9.270 9.083 -3.724 1.00 . B A . 32 NAG HN2 1 1 8 3606 2 2 1 NAG HO1 H -8.856 12.243 -4.756 1.00 . B A . 32 NAG HO1 1 1 8 3607 2 2 1 NAG HO3 H -5.482 9.172 -0.857 1.00 . B A . 32 NAG HO3 1 1 8 3608 2 2 1 NAG HO4 H 2.236 7.539 6.478 1.00 . B A . 32 NAG HO4 1 1 8 3609 2 2 1 NAG HO6 H -4.075 13.350 -3.085 1.00 . B A . 32 NAG HO6 1 1 8 3610 2 2 1 NAG N2 N -8.556 9.020 -3.010 1.00 . B A . 32 NAG N2 1 1 8 3611 2 2 1 NAG O1 O -9.078 11.416 -4.321 1.00 . B A . 32 NAG O1 1 1 8 3612 2 2 1 NAG O3 O -5.861 9.142 -1.742 1.00 . B A . 32 NAG O3 1 1 8 3613 2 2 1 NAG O4 O -5.046 11.819 -0.629 1.00 . B A . 32 NAG O4 1 1 8 3614 2 2 1 NAG O5 O -7.473 12.525 -3.314 1.00 . B A . 32 NAG O5 1 1 8 3615 2 2 1 NAG O6 O -4.824 13.848 -3.450 1.00 . B A . 32 NAG O6 1 1 8 3616 2 2 1 NAG O7 O -7.989 7.709 -1.237 1.00 . B A . 32 NAG O7 1 1 9 3617 1 1 1 VAL C C 10.291 3.541 3.261 1.00 . A A . 1 VAL C 1 1 9 3618 1 1 1 VAL CA C 10.879 2.991 1.976 1.00 . A A . 1 VAL CA 1 1 9 3619 1 1 1 VAL CB C 11.794 1.782 2.203 1.00 . A A . 1 VAL CB 1 1 9 3620 1 1 1 VAL CG1 C 13.001 2.093 3.093 1.00 . A A . 1 VAL CG1 1 1 9 3621 1 1 1 VAL CG2 C 11.007 0.611 2.790 1.00 . A A . 1 VAL CG2 1 1 9 3622 1 1 1 VAL H1 H 10.851 4.814 1.113 1.00 . A A . 1 VAL H1 1 1 9 3623 1 1 1 VAL H2 H 11.885 3.805 0.366 1.00 . A A . 1 VAL H2 1 1 9 3624 1 1 1 VAL H3 H 12.290 4.484 1.853 1.00 . A A . 1 VAL H3 1 1 9 3625 1 1 1 VAL HA H 10.043 2.666 1.354 1.00 . A A . 1 VAL HA 1 1 9 3626 1 1 1 VAL HB H 12.167 1.472 1.226 1.00 . A A . 1 VAL HB 1 1 9 3627 1 1 1 VAL HG11 H 12.679 2.391 4.092 1.00 . A A . 1 VAL HG11 1 1 9 3628 1 1 1 VAL HG12 H 13.616 1.198 3.183 1.00 . A A . 1 VAL HG12 1 1 9 3629 1 1 1 VAL HG13 H 13.613 2.885 2.661 1.00 . A A . 1 VAL HG13 1 1 9 3630 1 1 1 VAL HG21 H 10.697 0.824 3.813 1.00 . A A . 1 VAL HG21 1 1 9 3631 1 1 1 VAL HG22 H 10.126 0.411 2.179 1.00 . A A . 1 VAL HG22 1 1 9 3632 1 1 1 VAL HG23 H 11.637 -0.279 2.800 1.00 . A A . 1 VAL HG23 1 1 9 3633 1 1 1 VAL N N 11.557 4.096 1.275 1.00 . A A . 1 VAL N 1 1 9 3634 1 1 1 VAL O O 10.901 4.409 3.877 1.00 . A A . 1 VAL O 1 1 9 3635 1 1 2 GLY C C 6.874 4.069 3.575 1.00 . A A . 2 GLY C 1 1 9 3636 1 1 2 GLY CA C 8.129 3.856 4.419 1.00 . A A . 2 GLY CA 1 1 9 3637 1 1 2 GLY H H 8.657 2.430 2.961 1.00 . A A . 2 GLY H 1 1 9 3638 1 1 2 GLY HA2 H 7.874 3.279 5.307 1.00 . A A . 2 GLY HA2 1 1 9 3639 1 1 2 GLY HA3 H 8.538 4.823 4.710 1.00 . A A . 2 GLY HA3 1 1 9 3640 1 1 2 GLY N N 9.076 3.111 3.590 1.00 . A A . 2 GLY N 1 1 9 3641 1 1 2 GLY O O 5.775 3.678 3.958 1.00 . A A . 2 GLY O 1 1 9 3642 1 1 3 GLU C C 6.743 2.564 0.916 1.00 . A A . 3 GLU C 1 1 9 3643 1 1 3 GLU CA C 6.311 4.012 1.212 1.00 . A A . 3 GLU CA 1 1 9 3644 1 1 3 GLU CB C 6.477 4.958 0.005 1.00 . A A . 3 GLU CB 1 1 9 3645 1 1 3 GLU CD C 9.057 4.761 -0.309 1.00 . A A . 3 GLU CD 1 1 9 3646 1 1 3 GLU CG C 7.665 4.725 -0.949 1.00 . A A . 3 GLU CG 1 1 9 3647 1 1 3 GLU H H 8.012 4.850 2.079 1.00 . A A . 3 GLU H 1 1 9 3648 1 1 3 GLU HA H 5.260 4.001 1.486 1.00 . A A . 3 GLU HA 1 1 9 3649 1 1 3 GLU HB2 H 5.642 4.891 -0.541 1.00 . A A . 3 GLU HB2 1 1 9 3650 1 1 3 GLU HB3 H 6.566 5.886 0.367 1.00 . A A . 3 GLU HB3 1 1 9 3651 1 1 3 GLU HG2 H 7.546 3.827 -1.372 1.00 . A A . 3 GLU HG2 1 1 9 3652 1 1 3 GLU HG3 H 7.634 5.433 -1.654 1.00 . A A . 3 GLU HG3 1 1 9 3653 1 1 3 GLU N N 7.076 4.527 2.338 1.00 . A A . 3 GLU N 1 1 9 3654 1 1 3 GLU O O 7.771 2.096 1.418 1.00 . A A . 3 GLU O 1 1 9 3655 1 1 3 GLU OE1 O 9.191 5.071 0.896 1.00 . A A . 3 GLU OE1 1 1 9 3656 1 1 3 GLU OE2 O 10.064 4.490 -1.015 1.00 . A A . 3 GLU OE2 1 1 9 3657 1 1 4 CYS C C 7.765 0.447 -0.953 1.00 . A A . 4 CYS C 1 1 9 3658 1 1 4 CYS CA C 6.365 0.493 -0.326 1.00 . A A . 4 CYS CA 1 1 9 3659 1 1 4 CYS CB C 5.348 -0.042 -1.341 1.00 . A A . 4 CYS CB 1 1 9 3660 1 1 4 CYS H H 5.091 2.221 -0.207 1.00 . A A . 4 CYS H 1 1 9 3661 1 1 4 CYS HA H 6.371 -0.162 0.545 1.00 . A A . 4 CYS HA 1 1 9 3662 1 1 4 CYS HB2 H 5.103 0.708 -1.955 1.00 . A A . 4 CYS HB2 1 1 9 3663 1 1 4 CYS HB3 H 5.790 -0.771 -1.864 1.00 . A A . 4 CYS HB3 1 1 9 3664 1 1 4 CYS N N 5.979 1.837 0.098 1.00 . A A . 4 CYS N 1 1 9 3665 1 1 4 CYS O O 8.334 1.440 -1.406 1.00 . A A . 4 CYS O 1 1 9 3666 1 1 4 CYS SG S 3.820 -0.709 -0.642 1.00 . A A . 4 CYS SG 1 1 9 3667 1 1 5 VAL C C 9.321 -1.003 -3.325 1.00 . A A . 5 VAL C 1 1 9 3668 1 1 5 VAL CA C 9.538 -1.053 -1.811 1.00 . A A . 5 VAL CA 1 1 9 3669 1 1 5 VAL CB C 10.099 -2.404 -1.330 1.00 . A A . 5 VAL CB 1 1 9 3670 1 1 5 VAL CG1 C 11.543 -2.618 -1.800 1.00 . A A . 5 VAL CG1 1 1 9 3671 1 1 5 VAL CG2 C 10.126 -2.469 0.203 1.00 . A A . 5 VAL CG2 1 1 9 3672 1 1 5 VAL H H 7.692 -1.544 -0.858 1.00 . A A . 5 VAL H 1 1 9 3673 1 1 5 VAL HA H 10.254 -0.272 -1.557 1.00 . A A . 5 VAL HA 1 1 9 3674 1 1 5 VAL HB H 9.453 -3.206 -1.687 1.00 . A A . 5 VAL HB 1 1 9 3675 1 1 5 VAL HG11 H 12.181 -1.818 -1.427 1.00 . A A . 5 VAL HG11 1 1 9 3676 1 1 5 VAL HG12 H 11.912 -3.570 -1.421 1.00 . A A . 5 VAL HG12 1 1 9 3677 1 1 5 VAL HG13 H 11.605 -2.644 -2.887 1.00 . A A . 5 VAL HG13 1 1 9 3678 1 1 5 VAL HG21 H 10.599 -3.398 0.522 1.00 . A A . 5 VAL HG21 1 1 9 3679 1 1 5 VAL HG22 H 10.692 -1.626 0.600 1.00 . A A . 5 VAL HG22 1 1 9 3680 1 1 5 VAL HG23 H 9.116 -2.450 0.611 1.00 . A A . 5 VAL HG23 1 1 9 3681 1 1 5 VAL N N 8.276 -0.765 -1.134 1.00 . A A . 5 VAL N 1 1 9 3682 1 1 5 VAL O O 9.565 -1.966 -4.042 1.00 . A A . 5 VAL O 1 1 9 3683 1 1 6 ARG C C 7.783 -0.656 -5.934 1.00 . A A . 6 ARG C 1 1 9 3684 1 1 6 ARG CA C 8.500 0.470 -5.190 1.00 . A A . 6 ARG CA 1 1 9 3685 1 1 6 ARG CB C 9.781 0.985 -5.869 1.00 . A A . 6 ARG CB 1 1 9 3686 1 1 6 ARG CD C 11.067 2.264 -4.017 1.00 . A A . 6 ARG CD 1 1 9 3687 1 1 6 ARG CG C 10.205 2.349 -5.290 1.00 . A A . 6 ARG CG 1 1 9 3688 1 1 6 ARG CZ C 11.684 4.658 -3.578 1.00 . A A . 6 ARG CZ 1 1 9 3689 1 1 6 ARG H H 8.519 0.802 -3.088 1.00 . A A . 6 ARG H 1 1 9 3690 1 1 6 ARG HA H 7.771 1.279 -5.192 1.00 . A A . 6 ARG HA 1 1 9 3691 1 1 6 ARG HB2 H 10.517 0.324 -5.721 1.00 . A A . 6 ARG HB2 1 1 9 3692 1 1 6 ARG HB3 H 9.613 1.084 -6.850 1.00 . A A . 6 ARG HB3 1 1 9 3693 1 1 6 ARG HD2 H 10.705 1.541 -3.429 1.00 . A A . 6 ARG HD2 1 1 9 3694 1 1 6 ARG HD3 H 12.007 2.043 -4.277 1.00 . A A . 6 ARG HD3 1 1 9 3695 1 1 6 ARG HE H 10.522 3.603 -2.397 1.00 . A A . 6 ARG HE 1 1 9 3696 1 1 6 ARG HG2 H 10.729 2.836 -5.989 1.00 . A A . 6 ARG HG2 1 1 9 3697 1 1 6 ARG HG3 H 9.377 2.866 -5.072 1.00 . A A . 6 ARG HG3 1 1 9 3698 1 1 6 ARG HH11 H 12.554 4.003 -5.267 1.00 . A A . 6 ARG HH11 1 1 9 3699 1 1 6 ARG HH12 H 12.885 5.650 -4.847 1.00 . A A . 6 ARG HH12 1 1 9 3700 1 1 6 ARG HH21 H 10.977 5.598 -1.955 1.00 . A A . 6 ARG HH21 1 1 9 3701 1 1 6 ARG HH22 H 11.998 6.546 -2.984 1.00 . A A . 6 ARG HH22 1 1 9 3702 1 1 6 ARG N N 8.769 0.124 -3.793 1.00 . A A . 6 ARG N 1 1 9 3703 1 1 6 ARG NE N 11.065 3.531 -3.269 1.00 . A A . 6 ARG NE 1 1 9 3704 1 1 6 ARG NH1 N 12.434 4.780 -4.649 1.00 . A A . 6 ARG NH1 1 1 9 3705 1 1 6 ARG NH2 N 11.542 5.681 -2.776 1.00 . A A . 6 ARG NH2 1 1 9 3706 1 1 6 ARG O O 7.986 -0.889 -7.119 1.00 . A A . 6 ARG O 1 1 9 3707 1 1 7 GLY C C 5.430 -3.291 -4.637 1.00 . A A . 7 GLY C 1 1 9 3708 1 1 7 GLY CA C 5.997 -2.345 -5.699 1.00 . A A . 7 GLY CA 1 1 9 3709 1 1 7 GLY H H 6.822 -0.937 -4.251 1.00 . A A . 7 GLY H 1 1 9 3710 1 1 7 GLY HA2 H 5.160 -1.865 -6.207 1.00 . A A . 7 GLY HA2 1 1 9 3711 1 1 7 GLY HA3 H 6.531 -2.949 -6.434 1.00 . A A . 7 GLY HA3 1 1 9 3712 1 1 7 GLY N N 6.896 -1.309 -5.188 1.00 . A A . 7 GLY N 1 1 9 3713 1 1 7 GLY O O 4.356 -3.852 -4.843 1.00 . A A . 7 GLY O 1 1 9 3714 1 1 8 ARG C C 5.775 -3.773 -1.031 1.00 . A A . 8 ARG C 1 1 9 3715 1 1 8 ARG CA C 5.601 -4.348 -2.429 1.00 . A A . 8 ARG CA 1 1 9 3716 1 1 8 ARG CB C 6.351 -5.690 -2.512 1.00 . A A . 8 ARG CB 1 1 9 3717 1 1 8 ARG CD C 4.186 -6.977 -3.074 1.00 . A A . 8 ARG CD 1 1 9 3718 1 1 8 ARG CG C 5.670 -6.747 -3.391 1.00 . A A . 8 ARG CG 1 1 9 3719 1 1 8 ARG CZ C 2.687 -7.016 -1.096 1.00 . A A . 8 ARG CZ 1 1 9 3720 1 1 8 ARG H H 7.020 -3.075 -3.373 1.00 . A A . 8 ARG H 1 1 9 3721 1 1 8 ARG HA H 4.532 -4.501 -2.561 1.00 . A A . 8 ARG HA 1 1 9 3722 1 1 8 ARG HB2 H 7.263 -5.515 -2.884 1.00 . A A . 8 ARG HB2 1 1 9 3723 1 1 8 ARG HB3 H 6.433 -6.060 -1.586 1.00 . A A . 8 ARG HB3 1 1 9 3724 1 1 8 ARG HD2 H 3.665 -6.201 -3.428 1.00 . A A . 8 ARG HD2 1 1 9 3725 1 1 8 ARG HD3 H 3.892 -7.815 -3.535 1.00 . A A . 8 ARG HD3 1 1 9 3726 1 1 8 ARG HE H 4.640 -7.311 -0.968 1.00 . A A . 8 ARG HE 1 1 9 3727 1 1 8 ARG HG2 H 5.744 -6.455 -4.345 1.00 . A A . 8 ARG HG2 1 1 9 3728 1 1 8 ARG HG3 H 6.154 -7.614 -3.269 1.00 . A A . 8 ARG HG3 1 1 9 3729 1 1 8 ARG HH11 H 1.707 -6.561 -2.787 1.00 . A A . 8 ARG HH11 1 1 9 3730 1 1 8 ARG HH12 H 0.730 -6.659 -1.361 1.00 . A A . 8 ARG HH12 1 1 9 3731 1 1 8 ARG HH21 H 3.274 -7.369 0.785 1.00 . A A . 8 ARG HH21 1 1 9 3732 1 1 8 ARG HH22 H 1.577 -7.095 0.569 1.00 . A A . 8 ARG HH22 1 1 9 3733 1 1 8 ARG N N 6.096 -3.467 -3.488 1.00 . A A . 8 ARG N 1 1 9 3734 1 1 8 ARG NE N 3.895 -7.113 -1.631 1.00 . A A . 8 ARG NE 1 1 9 3735 1 1 8 ARG NH1 N 1.624 -6.722 -1.804 1.00 . A A . 8 ARG NH1 1 1 9 3736 1 1 8 ARG NH2 N 2.498 -7.172 0.186 1.00 . A A . 8 ARG NH2 1 1 9 3737 1 1 8 ARG O O 6.588 -2.889 -0.794 1.00 . A A . 8 ARG O 1 1 9 3738 1 1 9 CYS C C 5.257 -5.846 1.805 1.00 . A A . 9 CYS C 1 1 9 3739 1 1 9 CYS CA C 5.357 -4.384 1.330 1.00 . A A . 9 CYS CA 1 1 9 3740 1 1 9 CYS CB C 4.379 -3.436 2.040 1.00 . A A . 9 CYS CB 1 1 9 3741 1 1 9 CYS H H 4.453 -5.125 -0.396 1.00 . A A . 9 CYS H 1 1 9 3742 1 1 9 CYS HA H 6.380 -4.040 1.494 1.00 . A A . 9 CYS HA 1 1 9 3743 1 1 9 CYS HB2 H 3.651 -3.197 1.398 1.00 . A A . 9 CYS HB2 1 1 9 3744 1 1 9 CYS HB3 H 3.988 -3.917 2.824 1.00 . A A . 9 CYS HB3 1 1 9 3745 1 1 9 CYS N N 5.061 -4.383 -0.092 1.00 . A A . 9 CYS N 1 1 9 3746 1 1 9 CYS O O 4.999 -6.725 0.971 1.00 . A A . 9 CYS O 1 1 9 3747 1 1 9 CYS SG S 5.142 -1.905 2.633 1.00 . A A . 9 CYS SG 1 1 9 3748 1 1 10 PRO C C 4.144 -8.285 3.432 1.00 . A A . 10 PRO C 1 1 9 3749 1 1 10 PRO CA C 5.419 -7.466 3.683 1.00 . A A . 10 PRO CA 1 1 9 3750 1 1 10 PRO CB C 5.665 -7.259 5.182 1.00 . A A . 10 PRO CB 1 1 9 3751 1 1 10 PRO CD C 5.940 -5.171 4.095 1.00 . A A . 10 PRO CD 1 1 9 3752 1 1 10 PRO CG C 6.547 -6.015 5.211 1.00 . A A . 10 PRO CG 1 1 9 3753 1 1 10 PRO HA H 6.258 -8.032 3.277 1.00 . A A . 10 PRO HA 1 1 9 3754 1 1 10 PRO HB2 H 4.806 -7.103 5.670 1.00 . A A . 10 PRO HB2 1 1 9 3755 1 1 10 PRO HB3 H 6.137 -8.045 5.581 1.00 . A A . 10 PRO HB3 1 1 9 3756 1 1 10 PRO HD2 H 5.184 -4.619 4.447 1.00 . A A . 10 PRO HD2 1 1 9 3757 1 1 10 PRO HD3 H 6.633 -4.571 3.694 1.00 . A A . 10 PRO HD3 1 1 9 3758 1 1 10 PRO HG2 H 6.488 -5.548 6.093 1.00 . A A . 10 PRO HG2 1 1 9 3759 1 1 10 PRO HG3 H 7.501 -6.242 5.017 1.00 . A A . 10 PRO HG3 1 1 9 3760 1 1 10 PRO N N 5.457 -6.123 3.104 1.00 . A A . 10 PRO N 1 1 9 3761 1 1 10 PRO O O 3.227 -7.882 2.708 1.00 . A A . 10 PRO O 1 1 9 3762 1 1 11 SER C C 1.666 -10.039 3.816 1.00 . A A . 11 SER C 1 1 9 3763 1 1 11 SER CA C 3.104 -10.516 4.026 1.00 . A A . 11 SER CA 1 1 9 3764 1 1 11 SER CB C 3.216 -11.307 5.325 1.00 . A A . 11 SER CB 1 1 9 3765 1 1 11 SER H H 4.924 -9.725 4.615 1.00 . A A . 11 SER H 1 1 9 3766 1 1 11 SER HA H 3.357 -11.197 3.215 1.00 . A A . 11 SER HA 1 1 9 3767 1 1 11 SER HB2 H 2.815 -10.784 6.077 1.00 . A A . 11 SER HB2 1 1 9 3768 1 1 11 SER HB3 H 2.738 -12.180 5.233 1.00 . A A . 11 SER HB3 1 1 9 3769 1 1 11 SER HG H 4.677 -12.118 6.337 1.00 . A A . 11 SER HG 1 1 9 3770 1 1 11 SER N N 4.120 -9.467 4.053 1.00 . A A . 11 SER N 1 1 9 3771 1 1 11 SER O O 0.950 -9.689 4.758 1.00 . A A . 11 SER O 1 1 9 3772 1 1 11 SER OG O 4.591 -11.535 5.577 1.00 . A A . 11 SER OG 1 1 9 3773 1 1 12 GLY C C -0.518 -8.258 2.577 1.00 . A A . 12 GLY C 1 1 9 3774 1 1 12 GLY CA C -0.144 -9.692 2.202 1.00 . A A . 12 GLY CA 1 1 9 3775 1 1 12 GLY H H 1.863 -10.356 1.843 1.00 . A A . 12 GLY H 1 1 9 3776 1 1 12 GLY HA2 H -0.274 -9.806 1.126 1.00 . A A . 12 GLY HA2 1 1 9 3777 1 1 12 GLY HA3 H -0.837 -10.373 2.699 1.00 . A A . 12 GLY HA3 1 1 9 3778 1 1 12 GLY N N 1.223 -10.051 2.560 1.00 . A A . 12 GLY N 1 1 9 3779 1 1 12 GLY O O -1.677 -7.995 2.887 1.00 . A A . 12 GLY O 1 1 9 3780 1 1 13 MET C C -0.230 -5.423 1.272 1.00 . A A . 13 MET C 1 1 9 3781 1 1 13 MET CA C 0.134 -5.905 2.683 1.00 . A A . 13 MET CA 1 1 9 3782 1 1 13 MET CB C 1.355 -5.123 3.183 1.00 . A A . 13 MET CB 1 1 9 3783 1 1 13 MET CE C 1.709 -5.846 7.296 1.00 . A A . 13 MET CE 1 1 9 3784 1 1 13 MET CG C 1.849 -5.570 4.562 1.00 . A A . 13 MET CG 1 1 9 3785 1 1 13 MET H H 1.416 -7.633 2.585 1.00 . A A . 13 MET H 1 1 9 3786 1 1 13 MET HA H -0.712 -5.717 3.347 1.00 . A A . 13 MET HA 1 1 9 3787 1 1 13 MET HB2 H 2.099 -5.245 2.526 1.00 . A A . 13 MET HB2 1 1 9 3788 1 1 13 MET HB3 H 1.111 -4.155 3.234 1.00 . A A . 13 MET HB3 1 1 9 3789 1 1 13 MET HE1 H 2.636 -5.274 7.350 1.00 . A A . 13 MET HE1 1 1 9 3790 1 1 13 MET HE2 H 1.160 -5.725 8.230 1.00 . A A . 13 MET HE2 1 1 9 3791 1 1 13 MET HE3 H 1.943 -6.901 7.147 1.00 . A A . 13 MET HE3 1 1 9 3792 1 1 13 MET HG2 H 2.017 -6.555 4.528 1.00 . A A . 13 MET HG2 1 1 9 3793 1 1 13 MET HG3 H 2.705 -5.092 4.756 1.00 . A A . 13 MET HG3 1 1 9 3794 1 1 13 MET N N 0.444 -7.336 2.652 1.00 . A A . 13 MET N 1 1 9 3795 1 1 13 MET O O 0.026 -6.128 0.291 1.00 . A A . 13 MET O 1 1 9 3796 1 1 13 MET SD S 0.702 -5.242 5.918 1.00 . A A . 13 MET SD 1 1 9 3797 1 1 14 CYS C C -0.274 -2.049 0.038 1.00 . A A . 14 CYS C 1 1 9 3798 1 1 14 CYS CA C -0.789 -3.484 -0.126 1.00 . A A . 14 CYS CA 1 1 9 3799 1 1 14 CYS CB C -2.243 -3.443 -0.590 1.00 . A A . 14 CYS CB 1 1 9 3800 1 1 14 CYS H H -0.942 -3.659 1.984 1.00 . A A . 14 CYS H 1 1 9 3801 1 1 14 CYS HA H -0.184 -3.987 -0.881 1.00 . A A . 14 CYS HA 1 1 9 3802 1 1 14 CYS HB2 H -2.763 -2.958 0.113 1.00 . A A . 14 CYS HB2 1 1 9 3803 1 1 14 CYS HB3 H -2.266 -2.920 -1.442 1.00 . A A . 14 CYS HB3 1 1 9 3804 1 1 14 CYS N N -0.708 -4.189 1.148 1.00 . A A . 14 CYS N 1 1 9 3805 1 1 14 CYS O O -0.087 -1.587 1.163 1.00 . A A . 14 CYS O 1 1 9 3806 1 1 14 CYS SG S -3.100 -5.012 -0.903 1.00 . A A . 14 CYS SG 1 1 9 3807 1 1 15 CYS C C -0.878 0.956 -1.417 1.00 . A A . 15 CYS C 1 1 9 3808 1 1 15 CYS CA C 0.334 0.058 -1.118 1.00 . A A . 15 CYS CA 1 1 9 3809 1 1 15 CYS CB C 1.380 0.187 -2.233 1.00 . A A . 15 CYS CB 1 1 9 3810 1 1 15 CYS H H -0.258 -1.758 -1.975 1.00 . A A . 15 CYS H 1 1 9 3811 1 1 15 CYS HA H 0.785 0.346 -0.170 1.00 . A A . 15 CYS HA 1 1 9 3812 1 1 15 CYS HB2 H 0.900 0.165 -3.110 1.00 . A A . 15 CYS HB2 1 1 9 3813 1 1 15 CYS HB3 H 1.839 1.069 -2.125 1.00 . A A . 15 CYS HB3 1 1 9 3814 1 1 15 CYS N N -0.085 -1.337 -1.077 1.00 . A A . 15 CYS N 1 1 9 3815 1 1 15 CYS O O -1.792 0.532 -2.125 1.00 . A A . 15 CYS O 1 1 9 3816 1 1 15 CYS SG S 2.655 -1.110 -2.258 1.00 . A A . 15 CYS SG 1 1 9 3817 1 1 16 SER C C -1.635 4.071 -2.359 1.00 . A A . 16 SER C 1 1 9 3818 1 1 16 SER CA C -1.975 3.147 -1.198 1.00 . A A . 16 SER CA 1 1 9 3819 1 1 16 SER CB C -2.301 3.979 0.046 1.00 . A A . 16 SER CB 1 1 9 3820 1 1 16 SER H H -0.108 2.526 -0.376 1.00 . A A . 16 SER H 1 1 9 3821 1 1 16 SER HA H -2.869 2.602 -1.457 1.00 . A A . 16 SER HA 1 1 9 3822 1 1 16 SER HB2 H -3.207 4.388 -0.061 1.00 . A A . 16 SER HB2 1 1 9 3823 1 1 16 SER HB3 H -2.297 3.383 0.849 1.00 . A A . 16 SER HB3 1 1 9 3824 1 1 16 SER HG H -1.410 5.300 1.152 1.00 . A A . 16 SER HG 1 1 9 3825 1 1 16 SER N N -0.897 2.197 -0.924 1.00 . A A . 16 SER N 1 1 9 3826 1 1 16 SER O O -0.494 4.123 -2.820 1.00 . A A . 16 SER O 1 1 9 3827 1 1 16 SER OG O -1.348 5.006 0.226 1.00 . A A . 16 SER OG 1 1 9 3828 1 1 17 GLN C C -1.267 7.000 -3.118 1.00 . A A . 17 GLN C 1 1 9 3829 1 1 17 GLN CA C -2.330 6.026 -3.656 1.00 . A A . 17 GLN CA 1 1 9 3830 1 1 17 GLN CB C -3.631 6.792 -3.941 1.00 . A A . 17 GLN CB 1 1 9 3831 1 1 17 GLN CD C -5.637 5.283 -3.552 1.00 . A A . 17 GLN CD 1 1 9 3832 1 1 17 GLN CG C -4.729 5.936 -4.587 1.00 . A A . 17 GLN CG 1 1 9 3833 1 1 17 GLN H H -3.551 4.748 -2.457 1.00 . A A . 17 GLN H 1 1 9 3834 1 1 17 GLN HA H -1.945 5.625 -4.594 1.00 . A A . 17 GLN HA 1 1 9 3835 1 1 17 GLN HB2 H -3.980 7.151 -3.076 1.00 . A A . 17 GLN HB2 1 1 9 3836 1 1 17 GLN HB3 H -3.421 7.551 -4.557 1.00 . A A . 17 GLN HB3 1 1 9 3837 1 1 17 GLN HE21 H -7.102 6.674 -3.772 1.00 . A A . 17 GLN HE21 1 1 9 3838 1 1 17 GLN HE22 H -7.387 5.368 -2.623 1.00 . A A . 17 GLN HE22 1 1 9 3839 1 1 17 GLN HG2 H -5.284 6.519 -5.180 1.00 . A A . 17 GLN HG2 1 1 9 3840 1 1 17 GLN HG3 H -4.297 5.219 -5.134 1.00 . A A . 17 GLN HG3 1 1 9 3841 1 1 17 GLN N N -2.597 4.904 -2.763 1.00 . A A . 17 GLN N 1 1 9 3842 1 1 17 GLN NE2 N -6.805 5.839 -3.294 1.00 . A A . 17 GLN NE2 1 1 9 3843 1 1 17 GLN O O -0.803 7.860 -3.859 1.00 . A A . 17 GLN O 1 1 9 3844 1 1 17 GLN OE1 O -5.314 4.256 -2.968 1.00 . A A . 17 GLN OE1 1 1 9 3845 1 1 18 . C C 1.518 6.831 -1.118 1.00 . A A . 18 PFF C 1 1 9 3846 1 1 18 . CA C 0.227 7.650 -1.256 1.00 . A A . 18 PFF CA 1 1 9 3847 1 1 18 . CB C -0.265 8.161 0.101 1.00 . A A . 18 PFF CB 1 1 9 3848 1 1 18 . CD1 C -1.748 9.996 -0.808 1.00 . A A . 18 PFF CD1 1 1 9 3849 1 1 18 . CD2 C -2.765 8.192 0.463 1.00 . A A . 18 PFF CD2 1 1 9 3850 1 1 18 . CE1 C -3.026 10.449 -1.185 1.00 . A A . 18 PFF CE1 1 1 9 3851 1 1 18 . CE2 C -4.039 8.645 0.086 1.00 . A A . 18 PFF CE2 1 1 9 3852 1 1 18 . CG C -1.612 8.855 0.006 1.00 . A A . 18 PFF CG 1 1 9 3853 1 1 18 . CZ C -4.172 9.770 -0.740 1.00 . A A . 18 PFF CZ 1 1 9 3854 1 1 18 . F F -5.412 10.187 -1.116 1.00 . A A . 18 PFF F 1 1 9 3855 1 1 18 . H H -1.256 6.145 -1.261 1.00 . A A . 18 PFF H 1 1 9 3856 1 1 18 . HA H 0.451 8.511 -1.887 1.00 . A A . 18 PFF HA 1 1 9 3857 1 1 18 . HB2 H -0.374 7.294 0.750 1.00 . A A . 18 PFF HB2 1 1 9 3858 1 1 18 . HB3 H 0.487 8.815 0.547 1.00 . A A . 18 PFF HB3 1 1 9 3859 1 1 18 . HD1 H -0.871 10.501 -1.185 1.00 . A A . 18 PFF HD1 1 1 9 3860 1 1 18 . HD2 H -2.676 7.292 1.051 1.00 . A A . 18 PFF HD2 1 1 9 3861 1 1 18 . HE1 H -3.125 11.312 -1.827 1.00 . A A . 18 PFF HE1 1 1 9 3862 1 1 18 . HE2 H -4.914 8.101 0.395 1.00 . A A . 18 PFF HE2 1 1 9 3863 1 1 18 . N N -0.847 6.864 -1.856 1.00 . A A . 18 PFF N 1 1 9 3864 1 1 18 . O O 2.420 7.215 -0.376 1.00 . A A . 18 PFF O 1 1 9 3865 1 1 19 GLY C C 2.988 4.060 -0.374 1.00 . A A . 19 GLY C 1 1 9 3866 1 1 19 GLY CA C 2.786 4.786 -1.705 1.00 . A A . 19 GLY CA 1 1 9 3867 1 1 19 GLY H H 0.799 5.317 -2.266 1.00 . A A . 19 GLY H 1 1 9 3868 1 1 19 GLY HA2 H 2.688 4.032 -2.483 1.00 . A A . 19 GLY HA2 1 1 9 3869 1 1 19 GLY HA3 H 3.675 5.381 -1.915 1.00 . A A . 19 GLY HA3 1 1 9 3870 1 1 19 GLY N N 1.605 5.651 -1.742 1.00 . A A . 19 GLY N 1 1 9 3871 1 1 19 GLY O O 3.467 2.929 -0.359 1.00 . A A . 19 GLY O 1 1 9 3872 1 1 20 . C C 1.694 2.743 2.003 1.00 . A A . 20 PFF C 1 1 9 3873 1 1 20 . CA C 2.464 4.071 2.057 1.00 . A A . 20 PFF CA 1 1 9 3874 1 1 20 . CB C 1.718 5.070 2.949 1.00 . A A . 20 PFF CB 1 1 9 3875 1 1 20 . CD1 C 3.718 6.507 3.503 1.00 . A A . 20 PFF CD1 1 1 9 3876 1 1 20 . CD2 C 1.639 7.618 2.937 1.00 . A A . 20 PFF CD2 1 1 9 3877 1 1 20 . CE1 C 4.286 7.739 3.863 1.00 . A A . 20 PFF CE1 1 1 9 3878 1 1 20 . CE2 C 2.215 8.857 3.258 1.00 . A A . 20 PFF CE2 1 1 9 3879 1 1 20 . CG C 2.376 6.430 3.100 1.00 . A A . 20 PFF CG 1 1 9 3880 1 1 20 . CZ C 3.518 8.910 3.778 1.00 . A A . 20 PFF CZ 1 1 9 3881 1 1 20 . F F 4.070 10.109 4.102 1.00 . A A . 20 PFF F 1 1 9 3882 1 1 20 . H H 2.388 5.671 0.645 1.00 . A A . 20 PFF H 1 1 9 3883 1 1 20 . HA H 3.449 3.866 2.474 1.00 . A A . 20 PFF HA 1 1 9 3884 1 1 20 . HB2 H 0.715 5.199 2.544 1.00 . A A . 20 PFF HB2 1 1 9 3885 1 1 20 . HB3 H 1.633 4.634 3.941 1.00 . A A . 20 PFF HB3 1 1 9 3886 1 1 20 . HD1 H 4.308 5.613 3.546 1.00 . A A . 20 PFF HD1 1 1 9 3887 1 1 20 . HD2 H 0.609 7.588 2.622 1.00 . A A . 20 PFF HD2 1 1 9 3888 1 1 20 . HE1 H 5.311 7.786 4.200 1.00 . A A . 20 PFF HE1 1 1 9 3889 1 1 20 . HE2 H 1.660 9.770 3.107 1.00 . A A . 20 PFF HE2 1 1 9 3890 1 1 20 . N N 2.611 4.688 0.741 1.00 . A A . 20 PFF N 1 1 9 3891 1 1 20 . O O 0.909 2.516 1.085 1.00 . A A . 20 PFF O 1 1 9 3892 1 1 21 CYS C C 0.692 -0.049 4.118 1.00 . A A . 21 CYS C 1 1 9 3893 1 1 21 CYS CA C 1.387 0.489 2.865 1.00 . A A . 21 CYS CA 1 1 9 3894 1 1 21 CYS CB C 2.559 -0.390 2.423 1.00 . A A . 21 CYS CB 1 1 9 3895 1 1 21 CYS H H 2.476 2.084 3.774 1.00 . A A . 21 CYS H 1 1 9 3896 1 1 21 CYS HA H 0.645 0.460 2.072 1.00 . A A . 21 CYS HA 1 1 9 3897 1 1 21 CYS HB2 H 2.177 -1.182 1.947 1.00 . A A . 21 CYS HB2 1 1 9 3898 1 1 21 CYS HB3 H 3.114 0.147 1.787 1.00 . A A . 21 CYS HB3 1 1 9 3899 1 1 21 CYS N N 1.880 1.859 2.990 1.00 . A A . 21 CYS N 1 1 9 3900 1 1 21 CYS O O 0.884 0.462 5.219 1.00 . A A . 21 CYS O 1 1 9 3901 1 1 21 CYS SG S 3.662 -1.012 3.713 1.00 . A A . 21 CYS SG 1 1 9 3902 1 1 22 GLY C C -1.998 -2.610 4.460 1.00 . A A . 22 GLY C 1 1 9 3903 1 1 22 GLY CA C -0.923 -1.675 5.014 1.00 . A A . 22 GLY CA 1 1 9 3904 1 1 22 GLY H H -0.294 -1.418 2.989 1.00 . A A . 22 GLY H 1 1 9 3905 1 1 22 GLY HA2 H -0.268 -2.239 5.678 1.00 . A A . 22 GLY HA2 1 1 9 3906 1 1 22 GLY HA3 H -1.403 -0.877 5.581 1.00 . A A . 22 GLY HA3 1 1 9 3907 1 1 22 GLY N N -0.128 -1.089 3.940 1.00 . A A . 22 GLY N 1 1 9 3908 1 1 22 GLY O O -1.994 -2.920 3.267 1.00 . A A . 22 GLY O 1 1 9 3909 1 1 23 LYS C C -5.405 -3.199 4.869 1.00 . A A . 23 LYS C 1 1 9 3910 1 1 23 LYS CA C -4.057 -3.917 4.922 1.00 . A A . 23 LYS CA 1 1 9 3911 1 1 23 LYS CB C -4.154 -5.138 5.850 1.00 . A A . 23 LYS CB 1 1 9 3912 1 1 23 LYS CD C -2.983 -7.190 6.742 1.00 . A A . 23 LYS CD 1 1 9 3913 1 1 23 LYS CE C -1.680 -7.996 6.718 1.00 . A A . 23 LYS CE 1 1 9 3914 1 1 23 LYS CG C -2.901 -6.013 5.765 1.00 . A A . 23 LYS CG 1 1 9 3915 1 1 23 LYS H H -2.804 -2.834 6.296 1.00 . A A . 23 LYS H 1 1 9 3916 1 1 23 LYS HA H -3.893 -4.255 3.907 1.00 . A A . 23 LYS HA 1 1 9 3917 1 1 23 LYS HB2 H -4.265 -4.821 6.792 1.00 . A A . 23 LYS HB2 1 1 9 3918 1 1 23 LYS HB3 H -4.949 -5.684 5.586 1.00 . A A . 23 LYS HB3 1 1 9 3919 1 1 23 LYS HD2 H -3.137 -6.841 7.666 1.00 . A A . 23 LYS HD2 1 1 9 3920 1 1 23 LYS HD3 H -3.743 -7.784 6.479 1.00 . A A . 23 LYS HD3 1 1 9 3921 1 1 23 LYS HE2 H -0.907 -7.363 6.758 1.00 . A A . 23 LYS HE2 1 1 9 3922 1 1 23 LYS HE3 H -1.658 -8.600 7.515 1.00 . A A . 23 LYS HE3 1 1 9 3923 1 1 23 LYS HG2 H -2.813 -6.367 4.834 1.00 . A A . 23 LYS HG2 1 1 9 3924 1 1 23 LYS HG3 H -2.100 -5.458 5.989 1.00 . A A . 23 LYS HG3 1 1 9 3925 1 1 23 LYS HZ1 H -2.231 -9.574 5.499 1.00 . A A . 23 LYS HZ1 1 1 9 3926 1 1 23 LYS HZ2 H -1.743 -8.255 4.661 1.00 . A A . 23 LYS HZ2 1 1 9 3927 1 1 23 LYS HZ3 H -0.625 -9.202 5.402 1.00 . A A . 23 LYS HZ3 1 1 9 3928 1 1 23 LYS N N -2.922 -3.062 5.318 1.00 . A A . 23 LYS N 1 1 9 3929 1 1 23 LYS NZ N -1.564 -8.816 5.492 1.00 . A A . 23 LYS NZ 1 1 9 3930 1 1 23 LYS O O -6.403 -3.782 4.464 1.00 . A A . 23 LYS O 1 1 9 3931 1 1 24 GLY C C -7.176 -0.715 3.964 1.00 . A A . 24 GLY C 1 1 9 3932 1 1 24 GLY CA C -6.671 -1.155 5.344 1.00 . A A . 24 GLY CA 1 1 9 3933 1 1 24 GLY H H -4.538 -1.530 5.469 1.00 . A A . 24 GLY H 1 1 9 3934 1 1 24 GLY HA2 H -7.432 -1.772 5.823 1.00 . A A . 24 GLY HA2 1 1 9 3935 1 1 24 GLY HA3 H -6.505 -0.269 5.957 1.00 . A A . 24 GLY HA3 1 1 9 3936 1 1 24 GLY N N -5.433 -1.932 5.263 1.00 . A A . 24 GLY N 1 1 9 3937 1 1 24 GLY O O -6.404 -0.712 3.003 1.00 . A A . 24 GLY O 1 1 9 3938 1 1 25 PRO C C -8.285 0.770 1.576 1.00 . A A . 25 PRO C 1 1 9 3939 1 1 25 PRO CA C -9.127 0.005 2.600 1.00 . A A . 25 PRO CA 1 1 9 3940 1 1 25 PRO CB C -10.404 0.748 2.998 1.00 . A A . 25 PRO CB 1 1 9 3941 1 1 25 PRO CD C -9.377 -0.145 4.968 1.00 . A A . 25 PRO CD 1 1 9 3942 1 1 25 PRO CG C -10.748 0.093 4.335 1.00 . A A . 25 PRO CG 1 1 9 3943 1 1 25 PRO HA H -9.412 -0.947 2.151 1.00 . A A . 25 PRO HA 1 1 9 3944 1 1 25 PRO HB2 H -10.236 1.728 3.106 1.00 . A A . 25 PRO HB2 1 1 9 3945 1 1 25 PRO HB3 H -11.131 0.606 2.326 1.00 . A A . 25 PRO HB3 1 1 9 3946 1 1 25 PRO HD2 H -9.120 0.632 5.543 1.00 . A A . 25 PRO HD2 1 1 9 3947 1 1 25 PRO HD3 H -9.389 -0.979 5.520 1.00 . A A . 25 PRO HD3 1 1 9 3948 1 1 25 PRO HG2 H -11.303 0.702 4.901 1.00 . A A . 25 PRO HG2 1 1 9 3949 1 1 25 PRO HG3 H -11.234 -0.770 4.197 1.00 . A A . 25 PRO HG3 1 1 9 3950 1 1 25 PRO N N -8.445 -0.285 3.859 1.00 . A A . 25 PRO N 1 1 9 3951 1 1 25 PRO O O -8.007 0.245 0.503 1.00 . A A . 25 PRO O 1 1 9 3952 1 1 26 LYS C C -5.683 2.189 0.608 1.00 . A A . 26 LYS C 1 1 9 3953 1 1 26 LYS CA C -7.036 2.803 0.982 1.00 . A A . 26 LYS CA 1 1 9 3954 1 1 26 LYS CB C -6.867 4.210 1.571 1.00 . A A . 26 LYS CB 1 1 9 3955 1 1 26 LYS CD C -8.122 6.335 2.257 1.00 . A A . 26 LYS CD 1 1 9 3956 1 1 26 LYS CE C -7.314 7.315 1.400 1.00 . A A . 26 LYS CE 1 1 9 3957 1 1 26 LYS CG C -8.217 4.941 1.625 1.00 . A A . 26 LYS CG 1 1 9 3958 1 1 26 LYS H H -8.051 2.363 2.810 1.00 . A A . 26 LYS H 1 1 9 3959 1 1 26 LYS HA H -7.587 2.887 0.044 1.00 . A A . 26 LYS HA 1 1 9 3960 1 1 26 LYS HB2 H -6.497 4.136 2.497 1.00 . A A . 26 LYS HB2 1 1 9 3961 1 1 26 LYS HB3 H -6.234 4.732 0.999 1.00 . A A . 26 LYS HB3 1 1 9 3962 1 1 26 LYS HD2 H -9.047 6.698 2.373 1.00 . A A . 26 LYS HD2 1 1 9 3963 1 1 26 LYS HD3 H -7.681 6.252 3.151 1.00 . A A . 26 LYS HD3 1 1 9 3964 1 1 26 LYS HE2 H -6.365 7.005 1.351 1.00 . A A . 26 LYS HE2 1 1 9 3965 1 1 26 LYS HE3 H -7.703 7.346 0.479 1.00 . A A . 26 LYS HE3 1 1 9 3966 1 1 26 LYS HG2 H -8.564 5.038 0.692 1.00 . A A . 26 LYS HG2 1 1 9 3967 1 1 26 LYS HG3 H -8.855 4.391 2.163 1.00 . A A . 26 LYS HG3 1 1 9 3968 1 1 26 LYS HZ1 H -6.960 8.692 2.927 1.00 . A A . 26 LYS HZ1 1 1 9 3969 1 1 26 LYS HZ2 H -6.843 9.389 1.482 1.00 . A A . 26 LYS HZ2 1 1 9 3970 1 1 26 LYS HZ3 H -8.302 9.039 2.021 1.00 . A A . 26 LYS HZ3 1 1 9 3971 1 1 26 LYS N N -7.816 1.978 1.908 1.00 . A A . 26 LYS N 1 1 9 3972 1 1 26 LYS NZ N -7.354 8.671 1.992 1.00 . A A . 26 LYS NZ 1 1 9 3973 1 1 26 LYS O O -5.101 2.582 -0.402 1.00 . A A . 26 LYS O 1 1 9 3974 1 1 27 TYR C C -4.417 -0.739 0.080 1.00 . A A . 27 TYR C 1 1 9 3975 1 1 27 TYR CA C -4.013 0.444 0.957 1.00 . A A . 27 TYR CA 1 1 9 3976 1 1 27 TYR CB C -3.244 -0.064 2.183 1.00 . A A . 27 TYR CB 1 1 9 3977 1 1 27 TYR CD1 C -1.778 1.777 3.123 1.00 . A A . 27 TYR CD1 1 1 9 3978 1 1 27 TYR CD2 C -3.697 1.027 4.414 1.00 . A A . 27 TYR CD2 1 1 9 3979 1 1 27 TYR CE1 C -1.341 2.542 4.222 1.00 . A A . 27 TYR CE1 1 1 9 3980 1 1 27 TYR CE2 C -3.264 1.798 5.507 1.00 . A A . 27 TYR CE2 1 1 9 3981 1 1 27 TYR CG C -2.921 0.968 3.243 1.00 . A A . 27 TYR CG 1 1 9 3982 1 1 27 TYR CZ C -2.072 2.531 5.420 1.00 . A A . 27 TYR CZ 1 1 9 3983 1 1 27 TYR H H -5.750 0.833 2.121 1.00 . A A . 27 TYR H 1 1 9 3984 1 1 27 TYR HA H -3.343 1.081 0.379 1.00 . A A . 27 TYR HA 1 1 9 3985 1 1 27 TYR HB2 H -3.793 -0.781 2.612 1.00 . A A . 27 TYR HB2 1 1 9 3986 1 1 27 TYR HB3 H -2.380 -0.452 1.862 1.00 . A A . 27 TYR HB3 1 1 9 3987 1 1 27 TYR HD1 H -1.221 1.783 2.199 1.00 . A A . 27 TYR HD1 1 1 9 3988 1 1 27 TYR HD2 H -4.622 0.481 4.470 1.00 . A A . 27 TYR HD2 1 1 9 3989 1 1 27 TYR HE1 H -0.442 3.137 4.154 1.00 . A A . 27 TYR HE1 1 1 9 3990 1 1 27 TYR HE2 H -3.835 1.845 6.422 1.00 . A A . 27 TYR HE2 1 1 9 3991 1 1 27 TYR HH H -0.829 3.712 6.330 1.00 . A A . 27 TYR HH 1 1 9 3992 1 1 27 TYR N N -5.194 1.198 1.356 1.00 . A A . 27 TYR N 1 1 9 3993 1 1 27 TYR O O -3.879 -0.912 -1.009 1.00 . A A . 27 TYR O 1 1 9 3994 1 1 27 TYR OH O -1.712 3.334 6.456 1.00 . A A . 27 TYR OH 1 1 9 3995 1 1 28 CYS C C -6.885 -3.271 -0.440 1.00 . A A . 28 CYS C 1 1 9 3996 1 1 28 CYS CA C -5.479 -2.940 0.077 1.00 . A A . 28 CYS CA 1 1 9 3997 1 1 28 CYS CB C -5.003 -3.839 1.223 1.00 . A A . 28 CYS CB 1 1 9 3998 1 1 28 CYS H H -5.710 -1.396 1.493 1.00 . A A . 28 CYS H 1 1 9 3999 1 1 28 CYS HA H -4.823 -3.070 -0.779 1.00 . A A . 28 CYS HA 1 1 9 4000 1 1 28 CYS HB2 H -4.373 -3.298 1.780 1.00 . A A . 28 CYS HB2 1 1 9 4001 1 1 28 CYS HB3 H -5.809 -4.077 1.765 1.00 . A A . 28 CYS HB3 1 1 9 4002 1 1 28 CYS N N -5.330 -1.581 0.570 1.00 . A A . 28 CYS N 1 1 9 4003 1 1 28 CYS O O -7.057 -4.251 -1.161 1.00 . A A . 28 CYS O 1 1 9 4004 1 1 28 CYS SG S -4.155 -5.393 0.812 1.00 . A A . 28 CYS SG 1 1 9 4005 1 1 29 GLY C C -8.751 -1.813 -2.441 1.00 . A A . 29 GLY C 1 1 9 4006 1 1 29 GLY CA C -9.086 -2.379 -1.061 1.00 . A A . 29 GLY CA 1 1 9 4007 1 1 29 GLY H H -7.664 -1.529 0.258 1.00 . A A . 29 GLY H 1 1 9 4008 1 1 29 GLY HA2 H -9.485 -3.388 -1.165 1.00 . A A . 29 GLY HA2 1 1 9 4009 1 1 29 GLY HA3 H -9.836 -1.741 -0.593 1.00 . A A . 29 GLY HA3 1 1 9 4010 1 1 29 GLY N N -7.870 -2.387 -0.244 1.00 . A A . 29 GLY N 1 1 9 4011 1 1 29 GLY O O -9.215 -0.740 -2.815 1.00 . A A . 29 GLY O 1 1 9 4012 1 1 30 ARG C C -7.538 -1.128 -5.247 1.00 . A A . 30 ARG C 1 1 9 4013 1 1 30 ARG CA C -6.886 -1.818 -4.040 1.00 . A A . 30 ARG CA 1 1 9 4014 1 1 30 ARG CB C -5.790 -2.833 -4.417 1.00 . A A . 30 ARG CB 1 1 9 4015 1 1 30 ARG CD C -3.869 -1.121 -4.445 1.00 . A A . 30 ARG CD 1 1 9 4016 1 1 30 ARG CG C -4.560 -2.289 -5.163 1.00 . A A . 30 ARG CG 1 1 9 4017 1 1 30 ARG CZ C -4.932 1.063 -3.810 1.00 . A A . 30 ARG CZ 1 1 9 4018 1 1 30 ARG H H -7.556 -3.379 -2.742 1.00 . A A . 30 ARG H 1 1 9 4019 1 1 30 ARG HA H -6.430 -1.031 -3.444 1.00 . A A . 30 ARG HA 1 1 9 4020 1 1 30 ARG HB2 H -5.466 -3.256 -3.570 1.00 . A A . 30 ARG HB2 1 1 9 4021 1 1 30 ARG HB3 H -6.211 -3.529 -4.998 1.00 . A A . 30 ARG HB3 1 1 9 4022 1 1 30 ARG HD2 H -3.829 -1.310 -3.464 1.00 . A A . 30 ARG HD2 1 1 9 4023 1 1 30 ARG HD3 H -2.941 -1.012 -4.802 1.00 . A A . 30 ARG HD3 1 1 9 4024 1 1 30 ARG HE H -5.239 0.117 -5.482 1.00 . A A . 30 ARG HE 1 1 9 4025 1 1 30 ARG HG2 H -3.899 -3.032 -5.265 1.00 . A A . 30 ARG HG2 1 1 9 4026 1 1 30 ARG HG3 H -4.852 -1.976 -6.067 1.00 . A A . 30 ARG HG3 1 1 9 4027 1 1 30 ARG HH11 H -3.622 0.577 -2.378 1.00 . A A . 30 ARG HH11 1 1 9 4028 1 1 30 ARG HH12 H -4.624 1.950 -2.043 1.00 . A A . 30 ARG HH12 1 1 9 4029 1 1 30 ARG HH21 H -6.415 1.751 -4.964 1.00 . A A . 30 ARG HH21 1 1 9 4030 1 1 30 ARG HH22 H -6.172 2.597 -3.472 1.00 . A A . 30 ARG HH22 1 1 9 4031 1 1 30 ARG N N -7.836 -2.488 -3.147 1.00 . A A . 30 ARG N 1 1 9 4032 1 1 30 ARG NE N -4.627 0.112 -4.673 1.00 . A A . 30 ARG NE 1 1 9 4033 1 1 30 ARG NH1 N -4.347 1.208 -2.654 1.00 . A A . 30 ARG NH1 1 1 9 4034 1 1 30 ARG NH2 N -5.916 1.866 -4.105 1.00 . A A . 30 ARG NH2 1 1 9 4035 1 1 30 ARG O O -7.058 -0.083 -5.693 1.00 . A A . 30 ARG O 1 1 9 4036 1 1 31 NH2 HN1 H -9.035 -2.483 -5.327 1.00 . A A . 31 NH2 HN1 1 1 9 4037 1 1 31 NH2 HN2 H -9.094 -1.190 -6.519 1.00 . A A . 31 NH2 HN2 1 1 9 4038 1 1 31 NH2 N N -8.643 -1.659 -5.751 1.00 . A A . 31 NH2 N 1 1 9 4039 2 2 1 NAG C1 C -7.729 14.161 0.580 1.00 . B A . 32 NAG C1 1 1 9 4040 2 2 1 NAG C2 C -7.766 12.746 1.138 1.00 . B A . 32 NAG C2 1 1 9 4041 2 2 1 NAG C3 C -6.504 12.490 1.979 1.00 . B A . 32 NAG C3 1 1 9 4042 2 2 1 NAG C4 C -5.186 12.962 1.330 1.00 . B A . 32 NAG C4 1 1 9 4043 2 2 1 NAG C5 C -5.385 14.362 0.737 1.00 . B A . 32 NAG C5 1 1 9 4044 2 2 1 NAG C6 C -4.145 14.831 -0.053 1.00 . B A . 32 NAG C6 1 1 9 4045 2 2 1 NAG C7 C -9.706 11.432 2.017 1.00 . B A . 32 NAG C7 1 1 9 4046 2 2 1 NAG C8 C -11.000 11.543 2.760 1.00 . B A . 32 NAG C8 1 1 9 4047 2 2 1 NAG H1 H -7.877 14.903 1.368 1.00 . B A . 32 NAG H1 1 1 9 4048 2 2 1 NAG H2 H -7.731 12.070 0.280 1.00 . B A . 32 NAG H2 1 1 9 4049 2 2 1 NAG H3 H -6.621 13.001 2.937 1.00 . B A . 32 NAG H3 1 1 9 4050 2 2 1 NAG H4 H -4.942 12.285 0.512 1.00 . B A . 32 NAG H4 1 1 9 4051 2 2 1 NAG H5 H -5.543 15.073 1.550 1.00 . B A . 32 NAG H5 1 1 9 4052 2 2 1 NAG H61 H -3.331 15.042 0.639 1.00 . B A . 32 NAG H61 1 1 9 4053 2 2 1 NAG H62 H -4.395 15.757 -0.574 1.00 . B A . 32 NAG H62 1 1 9 4054 2 2 1 NAG H81 H -11.469 10.561 2.754 1.00 . B A . 32 NAG H81 1 1 9 4055 2 2 1 NAG H82 H -10.805 11.856 3.783 1.00 . B A . 32 NAG H82 1 1 9 4056 2 2 1 NAG H83 H -11.642 12.257 2.249 1.00 . B A . 32 NAG H83 1 1 9 4057 2 2 1 NAG HN2 H -9.458 13.358 2.326 1.00 . B A . 32 NAG HN2 1 1 9 4058 2 2 1 NAG HO1 H -8.220 14.643 -1.146 1.00 . B A . 32 NAG HO1 1 1 9 4059 2 2 1 NAG HO3 H -5.801 10.996 2.930 1.00 . B A . 32 NAG HO3 1 1 9 4060 2 2 1 NAG HO4 H 2.597 7.141 8.073 1.00 . B A . 32 NAG HO4 1 1 9 4061 2 2 1 NAG HO6 H -2.995 13.349 -0.590 1.00 . B A . 32 NAG HO6 1 1 9 4062 2 2 1 NAG N2 N -9.006 12.553 1.921 1.00 . B A . 32 NAG N2 1 1 9 4063 2 2 1 NAG O1 O -8.693 14.305 -0.382 1.00 . B A . 32 NAG O1 1 1 9 4064 2 2 1 NAG O3 O -6.434 11.095 2.201 1.00 . B A . 32 NAG O3 1 1 9 4065 2 2 1 NAG O4 O -4.084 13.025 2.281 1.00 . B A . 32 NAG O4 1 1 9 4066 2 2 1 NAG O5 O -6.521 14.388 -0.108 1.00 . B A . 32 NAG O5 1 1 9 4067 2 2 1 NAG O6 O -3.693 13.883 -1.005 1.00 . B A . 32 NAG O6 1 1 9 4068 2 2 1 NAG O7 O -9.347 10.351 1.563 1.00 . B A . 32 NAG O7 1 1 10 4069 1 1 1 VAL C C 6.626 5.175 6.878 1.00 . A A . 1 VAL C 1 1 10 4070 1 1 1 VAL CA C 7.804 6.033 7.300 1.00 . A A . 1 VAL CA 1 1 10 4071 1 1 1 VAL CB C 8.033 5.932 8.813 1.00 . A A . 1 VAL CB 1 1 10 4072 1 1 1 VAL CG1 C 8.387 4.497 9.219 1.00 . A A . 1 VAL CG1 1 1 10 4073 1 1 1 VAL CG2 C 9.190 6.840 9.239 1.00 . A A . 1 VAL CG2 1 1 10 4074 1 1 1 VAL H1 H 8.248 8.056 7.197 1.00 . A A . 1 VAL H1 1 1 10 4075 1 1 1 VAL H2 H 6.617 7.703 7.175 1.00 . A A . 1 VAL H2 1 1 10 4076 1 1 1 VAL H3 H 7.545 7.457 5.852 1.00 . A A . 1 VAL H3 1 1 10 4077 1 1 1 VAL HA H 8.692 5.674 6.779 1.00 . A A . 1 VAL HA 1 1 10 4078 1 1 1 VAL HB H 7.133 6.241 9.345 1.00 . A A . 1 VAL HB 1 1 10 4079 1 1 1 VAL HG11 H 8.624 4.467 10.283 1.00 . A A . 1 VAL HG11 1 1 10 4080 1 1 1 VAL HG12 H 7.545 3.826 9.048 1.00 . A A . 1 VAL HG12 1 1 10 4081 1 1 1 VAL HG13 H 9.253 4.148 8.656 1.00 . A A . 1 VAL HG13 1 1 10 4082 1 1 1 VAL HG21 H 9.415 6.671 10.293 1.00 . A A . 1 VAL HG21 1 1 10 4083 1 1 1 VAL HG22 H 10.083 6.614 8.654 1.00 . A A . 1 VAL HG22 1 1 10 4084 1 1 1 VAL HG23 H 8.934 7.892 9.125 1.00 . A A . 1 VAL HG23 1 1 10 4085 1 1 1 VAL N N 7.538 7.421 6.868 1.00 . A A . 1 VAL N 1 1 10 4086 1 1 1 VAL O O 5.497 5.645 6.975 1.00 . A A . 1 VAL O 1 1 10 4087 1 1 2 GLY C C 5.756 3.142 4.308 1.00 . A A . 2 GLY C 1 1 10 4088 1 1 2 GLY CA C 5.842 3.082 5.836 1.00 . A A . 2 GLY CA 1 1 10 4089 1 1 2 GLY H H 7.841 3.674 6.290 1.00 . A A . 2 GLY H 1 1 10 4090 1 1 2 GLY HA2 H 6.057 2.052 6.121 1.00 . A A . 2 GLY HA2 1 1 10 4091 1 1 2 GLY HA3 H 4.867 3.349 6.245 1.00 . A A . 2 GLY HA3 1 1 10 4092 1 1 2 GLY N N 6.876 3.956 6.392 1.00 . A A . 2 GLY N 1 1 10 4093 1 1 2 GLY O O 4.887 2.505 3.721 1.00 . A A . 2 GLY O 1 1 10 4094 1 1 3 GLU C C 7.052 2.699 1.558 1.00 . A A . 3 GLU C 1 1 10 4095 1 1 3 GLU CA C 6.721 4.048 2.209 1.00 . A A . 3 GLU CA 1 1 10 4096 1 1 3 GLU CB C 7.800 5.081 1.841 1.00 . A A . 3 GLU CB 1 1 10 4097 1 1 3 GLU CD C 7.748 6.780 3.793 1.00 . A A . 3 GLU CD 1 1 10 4098 1 1 3 GLU CG C 7.494 6.516 2.301 1.00 . A A . 3 GLU CG 1 1 10 4099 1 1 3 GLU H H 7.299 4.464 4.199 1.00 . A A . 3 GLU H 1 1 10 4100 1 1 3 GLU HA H 5.763 4.401 1.832 1.00 . A A . 3 GLU HA 1 1 10 4101 1 1 3 GLU HB2 H 8.661 4.796 2.261 1.00 . A A . 3 GLU HB2 1 1 10 4102 1 1 3 GLU HB3 H 7.900 5.087 0.846 1.00 . A A . 3 GLU HB3 1 1 10 4103 1 1 3 GLU HG2 H 8.068 7.141 1.772 1.00 . A A . 3 GLU HG2 1 1 10 4104 1 1 3 GLU HG3 H 6.531 6.705 2.111 1.00 . A A . 3 GLU HG3 1 1 10 4105 1 1 3 GLU N N 6.629 3.916 3.658 1.00 . A A . 3 GLU N 1 1 10 4106 1 1 3 GLU O O 8.075 2.089 1.858 1.00 . A A . 3 GLU O 1 1 10 4107 1 1 3 GLU OE1 O 8.151 5.860 4.545 1.00 . A A . 3 GLU OE1 1 1 10 4108 1 1 3 GLU OE2 O 7.488 7.907 4.266 1.00 . A A . 3 GLU OE2 1 1 10 4109 1 1 4 CYS C C 7.466 0.707 -0.906 1.00 . A A . 4 CYS C 1 1 10 4110 1 1 4 CYS CA C 6.362 0.860 0.133 1.00 . A A . 4 CYS CA 1 1 10 4111 1 1 4 CYS CB C 5.039 0.409 -0.483 1.00 . A A . 4 CYS CB 1 1 10 4112 1 1 4 CYS H H 5.360 2.725 0.423 1.00 . A A . 4 CYS H 1 1 10 4113 1 1 4 CYS HA H 6.608 0.197 0.963 1.00 . A A . 4 CYS HA 1 1 10 4114 1 1 4 CYS HB2 H 5.116 -0.565 -0.697 1.00 . A A . 4 CYS HB2 1 1 10 4115 1 1 4 CYS HB3 H 4.320 0.546 0.199 1.00 . A A . 4 CYS HB3 1 1 10 4116 1 1 4 CYS N N 6.202 2.208 0.655 1.00 . A A . 4 CYS N 1 1 10 4117 1 1 4 CYS O O 7.873 1.652 -1.595 1.00 . A A . 4 CYS O 1 1 10 4118 1 1 4 CYS SG S 4.544 1.273 -1.995 1.00 . A A . 4 CYS SG 1 1 10 4119 1 1 5 VAL C C 7.742 -1.011 -3.553 1.00 . A A . 5 VAL C 1 1 10 4120 1 1 5 VAL CA C 8.625 -0.971 -2.306 1.00 . A A . 5 VAL CA 1 1 10 4121 1 1 5 VAL CB C 9.300 -2.319 -2.004 1.00 . A A . 5 VAL CB 1 1 10 4122 1 1 5 VAL CG1 C 10.339 -2.675 -3.073 1.00 . A A . 5 VAL CG1 1 1 10 4123 1 1 5 VAL CG2 C 10.032 -2.272 -0.659 1.00 . A A . 5 VAL CG2 1 1 10 4124 1 1 5 VAL H H 7.288 -1.274 -0.672 1.00 . A A . 5 VAL H 1 1 10 4125 1 1 5 VAL HA H 9.407 -0.228 -2.467 1.00 . A A . 5 VAL HA 1 1 10 4126 1 1 5 VAL HB H 8.541 -3.097 -1.944 1.00 . A A . 5 VAL HB 1 1 10 4127 1 1 5 VAL HG11 H 10.811 -3.625 -2.819 1.00 . A A . 5 VAL HG11 1 1 10 4128 1 1 5 VAL HG12 H 9.874 -2.781 -4.051 1.00 . A A . 5 VAL HG12 1 1 10 4129 1 1 5 VAL HG13 H 11.104 -1.902 -3.122 1.00 . A A . 5 VAL HG13 1 1 10 4130 1 1 5 VAL HG21 H 10.747 -1.449 -0.652 1.00 . A A . 5 VAL HG21 1 1 10 4131 1 1 5 VAL HG22 H 9.326 -2.139 0.160 1.00 . A A . 5 VAL HG22 1 1 10 4132 1 1 5 VAL HG23 H 10.566 -3.208 -0.497 1.00 . A A . 5 VAL HG23 1 1 10 4133 1 1 5 VAL N N 7.793 -0.553 -1.181 1.00 . A A . 5 VAL N 1 1 10 4134 1 1 5 VAL O O 7.494 -2.065 -4.128 1.00 . A A . 5 VAL O 1 1 10 4135 1 1 6 ARG C C 5.319 -0.588 -5.403 1.00 . A A . 6 ARG C 1 1 10 4136 1 1 6 ARG CA C 6.332 0.492 -5.036 1.00 . A A . 6 ARG CA 1 1 10 4137 1 1 6 ARG CB C 7.243 0.913 -6.196 1.00 . A A . 6 ARG CB 1 1 10 4138 1 1 6 ARG CD C 7.582 3.304 -5.269 1.00 . A A . 6 ARG CD 1 1 10 4139 1 1 6 ARG CG C 8.241 2.022 -5.807 1.00 . A A . 6 ARG CG 1 1 10 4140 1 1 6 ARG CZ C 6.633 4.121 -3.099 1.00 . A A . 6 ARG CZ 1 1 10 4141 1 1 6 ARG H H 7.247 0.857 -3.161 1.00 . A A . 6 ARG H 1 1 10 4142 1 1 6 ARG HA H 5.717 1.347 -4.765 1.00 . A A . 6 ARG HA 1 1 10 4143 1 1 6 ARG HB2 H 7.759 0.113 -6.502 1.00 . A A . 6 ARG HB2 1 1 10 4144 1 1 6 ARG HB3 H 6.671 1.248 -6.945 1.00 . A A . 6 ARG HB3 1 1 10 4145 1 1 6 ARG HD2 H 8.161 4.083 -5.510 1.00 . A A . 6 ARG HD2 1 1 10 4146 1 1 6 ARG HD3 H 6.687 3.406 -5.702 1.00 . A A . 6 ARG HD3 1 1 10 4147 1 1 6 ARG HE H 7.954 2.668 -3.233 1.00 . A A . 6 ARG HE 1 1 10 4148 1 1 6 ARG HG2 H 8.850 1.662 -5.100 1.00 . A A . 6 ARG HG2 1 1 10 4149 1 1 6 ARG HG3 H 8.776 2.261 -6.618 1.00 . A A . 6 ARG HG3 1 1 10 4150 1 1 6 ARG HH11 H 5.925 5.170 -4.659 1.00 . A A . 6 ARG HH11 1 1 10 4151 1 1 6 ARG HH12 H 5.349 5.666 -3.103 1.00 . A A . 6 ARG HH12 1 1 10 4152 1 1 6 ARG HH21 H 7.130 3.294 -1.343 1.00 . A A . 6 ARG HH21 1 1 10 4153 1 1 6 ARG HH22 H 6.020 4.621 -1.258 1.00 . A A . 6 ARG HH22 1 1 10 4154 1 1 6 ARG N N 7.150 0.149 -3.867 1.00 . A A . 6 ARG N 1 1 10 4155 1 1 6 ARG NE N 7.395 3.294 -3.803 1.00 . A A . 6 ARG NE 1 1 10 4156 1 1 6 ARG NH1 N 5.912 5.060 -3.665 1.00 . A A . 6 ARG NH1 1 1 10 4157 1 1 6 ARG NH2 N 6.591 4.003 -1.798 1.00 . A A . 6 ARG NH2 1 1 10 4158 1 1 6 ARG O O 5.023 -0.839 -6.564 1.00 . A A . 6 ARG O 1 1 10 4159 1 1 7 GLY C C 4.181 -3.447 -3.409 1.00 . A A . 7 GLY C 1 1 10 4160 1 1 7 GLY CA C 3.853 -2.322 -4.397 1.00 . A A . 7 GLY CA 1 1 10 4161 1 1 7 GLY H H 5.149 -0.833 -3.479 1.00 . A A . 7 GLY H 1 1 10 4162 1 1 7 GLY HA2 H 2.850 -1.955 -4.178 1.00 . A A . 7 GLY HA2 1 1 10 4163 1 1 7 GLY HA3 H 3.842 -2.751 -5.400 1.00 . A A . 7 GLY HA3 1 1 10 4164 1 1 7 GLY N N 4.793 -1.204 -4.350 1.00 . A A . 7 GLY N 1 1 10 4165 1 1 7 GLY O O 3.353 -4.339 -3.191 1.00 . A A . 7 GLY O 1 1 10 4166 1 1 8 ARG C C 6.155 -3.906 -0.441 1.00 . A A . 8 ARG C 1 1 10 4167 1 1 8 ARG CA C 5.719 -4.447 -1.795 1.00 . A A . 8 ARG CA 1 1 10 4168 1 1 8 ARG CB C 6.718 -5.427 -2.420 1.00 . A A . 8 ARG CB 1 1 10 4169 1 1 8 ARG CD C 5.570 -7.749 -2.267 1.00 . A A . 8 ARG CD 1 1 10 4170 1 1 8 ARG CG C 5.973 -6.556 -3.150 1.00 . A A . 8 ARG CG 1 1 10 4171 1 1 8 ARG CZ C 3.675 -7.107 -0.738 1.00 . A A . 8 ARG CZ 1 1 10 4172 1 1 8 ARG H H 6.093 -2.782 -3.065 1.00 . A A . 8 ARG H 1 1 10 4173 1 1 8 ARG HA H 4.818 -4.991 -1.555 1.00 . A A . 8 ARG HA 1 1 10 4174 1 1 8 ARG HB2 H 7.296 -4.937 -3.073 1.00 . A A . 8 ARG HB2 1 1 10 4175 1 1 8 ARG HB3 H 7.289 -5.821 -1.699 1.00 . A A . 8 ARG HB3 1 1 10 4176 1 1 8 ARG HD2 H 4.921 -8.308 -2.783 1.00 . A A . 8 ARG HD2 1 1 10 4177 1 1 8 ARG HD3 H 6.394 -8.283 -2.078 1.00 . A A . 8 ARG HD3 1 1 10 4178 1 1 8 ARG HE H 5.438 -7.682 -0.125 1.00 . A A . 8 ARG HE 1 1 10 4179 1 1 8 ARG HG2 H 5.141 -6.171 -3.549 1.00 . A A . 8 ARG HG2 1 1 10 4180 1 1 8 ARG HG3 H 6.566 -6.897 -3.880 1.00 . A A . 8 ARG HG3 1 1 10 4181 1 1 8 ARG HH11 H 3.197 -6.368 -2.545 1.00 . A A . 8 ARG HH11 1 1 10 4182 1 1 8 ARG HH12 H 1.917 -6.372 -1.378 1.00 . A A . 8 ARG HH12 1 1 10 4183 1 1 8 ARG HH21 H 3.782 -7.634 1.194 1.00 . A A . 8 ARG HH21 1 1 10 4184 1 1 8 ARG HH22 H 2.238 -7.058 0.661 1.00 . A A . 8 ARG HH22 1 1 10 4185 1 1 8 ARG N N 5.363 -3.428 -2.776 1.00 . A A . 8 ARG N 1 1 10 4186 1 1 8 ARG NE N 4.945 -7.408 -0.973 1.00 . A A . 8 ARG NE 1 1 10 4187 1 1 8 ARG NH1 N 2.865 -6.573 -1.624 1.00 . A A . 8 ARG NH1 1 1 10 4188 1 1 8 ARG NH2 N 3.194 -7.280 0.467 1.00 . A A . 8 ARG NH2 1 1 10 4189 1 1 8 ARG O O 6.366 -2.714 -0.246 1.00 . A A . 8 ARG O 1 1 10 4190 1 1 9 CYS C C 5.850 -6.157 2.461 1.00 . A A . 9 CYS C 1 1 10 4191 1 1 9 CYS CA C 6.164 -4.737 1.945 1.00 . A A . 9 CYS CA 1 1 10 4192 1 1 9 CYS CB C 5.102 -3.718 2.372 1.00 . A A . 9 CYS CB 1 1 10 4193 1 1 9 CYS H H 5.950 -5.774 0.191 1.00 . A A . 9 CYS H 1 1 10 4194 1 1 9 CYS HA H 7.150 -4.430 2.294 1.00 . A A . 9 CYS HA 1 1 10 4195 1 1 9 CYS HB2 H 4.645 -3.376 1.551 1.00 . A A . 9 CYS HB2 1 1 10 4196 1 1 9 CYS HB3 H 4.436 -4.182 2.956 1.00 . A A . 9 CYS HB3 1 1 10 4197 1 1 9 CYS N N 6.170 -4.843 0.498 1.00 . A A . 9 CYS N 1 1 10 4198 1 1 9 CYS O O 5.673 -7.063 1.634 1.00 . A A . 9 CYS O 1 1 10 4199 1 1 9 CYS SG S 5.773 -2.304 3.283 1.00 . A A . 9 CYS SG 1 1 10 4200 1 1 10 PRO C C 4.327 -8.475 3.925 1.00 . A A . 10 PRO C 1 1 10 4201 1 1 10 PRO CA C 5.554 -7.674 4.396 1.00 . A A . 10 PRO CA 1 1 10 4202 1 1 10 PRO CB C 5.502 -7.405 5.903 1.00 . A A . 10 PRO CB 1 1 10 4203 1 1 10 PRO CD C 6.079 -5.377 4.804 1.00 . A A . 10 PRO CD 1 1 10 4204 1 1 10 PRO CG C 6.389 -6.174 6.066 1.00 . A A . 10 PRO CG 1 1 10 4205 1 1 10 PRO HA H 6.440 -8.274 4.188 1.00 . A A . 10 PRO HA 1 1 10 4206 1 1 10 PRO HB2 H 4.567 -7.215 6.202 1.00 . A A . 10 PRO HB2 1 1 10 4207 1 1 10 PRO HB3 H 5.866 -8.181 6.419 1.00 . A A . 10 PRO HB3 1 1 10 4208 1 1 10 PRO HD2 H 5.298 -4.772 4.957 1.00 . A A . 10 PRO HD2 1 1 10 4209 1 1 10 PRO HD3 H 6.873 -4.835 4.530 1.00 . A A . 10 PRO HD3 1 1 10 4210 1 1 10 PRO HG2 H 6.145 -5.659 6.888 1.00 . A A . 10 PRO HG2 1 1 10 4211 1 1 10 PRO HG3 H 7.356 -6.427 6.105 1.00 . A A . 10 PRO HG3 1 1 10 4212 1 1 10 PRO N N 5.763 -6.366 3.783 1.00 . A A . 10 PRO N 1 1 10 4213 1 1 10 PRO O O 3.548 -8.064 3.056 1.00 . A A . 10 PRO O 1 1 10 4214 1 1 11 SER C C 1.843 -10.180 3.809 1.00 . A A . 11 SER C 1 1 10 4215 1 1 11 SER CA C 3.181 -10.695 4.331 1.00 . A A . 11 SER CA 1 1 10 4216 1 1 11 SER CB C 2.942 -11.426 5.654 1.00 . A A . 11 SER CB 1 1 10 4217 1 1 11 SER H H 4.858 -9.845 5.273 1.00 . A A . 11 SER H 1 1 10 4218 1 1 11 SER HA H 3.572 -11.421 3.618 1.00 . A A . 11 SER HA 1 1 10 4219 1 1 11 SER HB2 H 2.249 -12.135 5.524 1.00 . A A . 11 SER HB2 1 1 10 4220 1 1 11 SER HB3 H 3.795 -11.846 5.963 1.00 . A A . 11 SER HB3 1 1 10 4221 1 1 11 SER HG H 1.735 -10.032 6.232 1.00 . A A . 11 SER HG 1 1 10 4222 1 1 11 SER N N 4.195 -9.658 4.536 1.00 . A A . 11 SER N 1 1 10 4223 1 1 11 SER O O 1.017 -9.698 4.584 1.00 . A A . 11 SER O 1 1 10 4224 1 1 11 SER OG O 2.494 -10.499 6.620 1.00 . A A . 11 SER OG 1 1 10 4225 1 1 12 GLY C C -0.115 -8.549 1.947 1.00 . A A . 12 GLY C 1 1 10 4226 1 1 12 GLY CA C 0.324 -10.015 1.888 1.00 . A A . 12 GLY CA 1 1 10 4227 1 1 12 GLY H H 2.353 -10.690 1.930 1.00 . A A . 12 GLY H 1 1 10 4228 1 1 12 GLY HA2 H 0.355 -10.313 0.840 1.00 . A A . 12 GLY HA2 1 1 10 4229 1 1 12 GLY HA3 H -0.440 -10.612 2.386 1.00 . A A . 12 GLY HA3 1 1 10 4230 1 1 12 GLY N N 1.618 -10.300 2.500 1.00 . A A . 12 GLY N 1 1 10 4231 1 1 12 GLY O O -1.255 -8.257 1.582 1.00 . A A . 12 GLY O 1 1 10 4232 1 1 13 MET C C 0.260 -5.601 1.036 1.00 . A A . 13 MET C 1 1 10 4233 1 1 13 MET CA C 0.354 -6.208 2.440 1.00 . A A . 13 MET CA 1 1 10 4234 1 1 13 MET CB C 1.347 -5.414 3.293 1.00 . A A . 13 MET CB 1 1 10 4235 1 1 13 MET CE C 2.112 -5.765 7.388 1.00 . A A . 13 MET CE 1 1 10 4236 1 1 13 MET CG C 1.374 -5.919 4.735 1.00 . A A . 13 MET CG 1 1 10 4237 1 1 13 MET H H 1.659 -7.899 2.728 1.00 . A A . 13 MET H 1 1 10 4238 1 1 13 MET HA H -0.631 -6.128 2.902 1.00 . A A . 13 MET HA 1 1 10 4239 1 1 13 MET HB2 H 2.261 -5.507 2.899 1.00 . A A . 13 MET HB2 1 1 10 4240 1 1 13 MET HB3 H 1.079 -4.450 3.291 1.00 . A A . 13 MET HB3 1 1 10 4241 1 1 13 MET HE1 H 2.718 -5.311 8.173 1.00 . A A . 13 MET HE1 1 1 10 4242 1 1 13 MET HE2 H 1.057 -5.662 7.644 1.00 . A A . 13 MET HE2 1 1 10 4243 1 1 13 MET HE3 H 2.361 -6.823 7.304 1.00 . A A . 13 MET HE3 1 1 10 4244 1 1 13 MET HG2 H 0.443 -5.895 5.098 1.00 . A A . 13 MET HG2 1 1 10 4245 1 1 13 MET HG3 H 1.708 -6.862 4.736 1.00 . A A . 13 MET HG3 1 1 10 4246 1 1 13 MET N N 0.740 -7.619 2.394 1.00 . A A . 13 MET N 1 1 10 4247 1 1 13 MET O O 0.770 -6.166 0.064 1.00 . A A . 13 MET O 1 1 10 4248 1 1 13 MET SD S 2.438 -4.930 5.813 1.00 . A A . 13 MET SD 1 1 10 4249 1 1 14 CYS C C -0.008 -2.258 -0.124 1.00 . A A . 14 CYS C 1 1 10 4250 1 1 14 CYS CA C -0.565 -3.678 -0.283 1.00 . A A . 14 CYS CA 1 1 10 4251 1 1 14 CYS CB C -2.073 -3.649 -0.546 1.00 . A A . 14 CYS CB 1 1 10 4252 1 1 14 CYS H H -0.675 -3.973 1.793 1.00 . A A . 14 CYS H 1 1 10 4253 1 1 14 CYS HA H -0.061 -4.154 -1.125 1.00 . A A . 14 CYS HA 1 1 10 4254 1 1 14 CYS HB2 H -2.480 -2.984 0.081 1.00 . A A . 14 CYS HB2 1 1 10 4255 1 1 14 CYS HB3 H -2.213 -3.348 -1.489 1.00 . A A . 14 CYS HB3 1 1 10 4256 1 1 14 CYS N N -0.342 -4.422 0.946 1.00 . A A . 14 CYS N 1 1 10 4257 1 1 14 CYS O O 0.419 -1.883 0.970 1.00 . A A . 14 CYS O 1 1 10 4258 1 1 14 CYS SG S -2.954 -5.230 -0.330 1.00 . A A . 14 CYS SG 1 1 10 4259 1 1 15 CYS C C -0.557 0.932 -1.664 1.00 . A A . 15 CYS C 1 1 10 4260 1 1 15 CYS CA C 0.466 -0.084 -1.146 1.00 . A A . 15 CYS CA 1 1 10 4261 1 1 15 CYS CB C 1.772 0.012 -1.928 1.00 . A A . 15 CYS CB 1 1 10 4262 1 1 15 CYS H H -0.387 -1.801 -2.069 1.00 . A A . 15 CYS H 1 1 10 4263 1 1 15 CYS HA H 0.687 0.169 -0.114 1.00 . A A . 15 CYS HA 1 1 10 4264 1 1 15 CYS HB2 H 2.392 -0.707 -1.614 1.00 . A A . 15 CYS HB2 1 1 10 4265 1 1 15 CYS HB3 H 1.578 -0.116 -2.901 1.00 . A A . 15 CYS HB3 1 1 10 4266 1 1 15 CYS N N -0.020 -1.459 -1.195 1.00 . A A . 15 CYS N 1 1 10 4267 1 1 15 CYS O O -1.169 0.723 -2.710 1.00 . A A . 15 CYS O 1 1 10 4268 1 1 15 CYS SG S 2.571 1.616 -1.697 1.00 . A A . 15 CYS SG 1 1 10 4269 1 1 16 SER C C -1.218 3.916 -2.473 1.00 . A A . 16 SER C 1 1 10 4270 1 1 16 SER CA C -1.668 3.101 -1.268 1.00 . A A . 16 SER CA 1 1 10 4271 1 1 16 SER CB C -1.809 4.047 -0.071 1.00 . A A . 16 SER CB 1 1 10 4272 1 1 16 SER H H -0.079 2.215 -0.171 1.00 . A A . 16 SER H 1 1 10 4273 1 1 16 SER HA H -2.638 2.652 -1.486 1.00 . A A . 16 SER HA 1 1 10 4274 1 1 16 SER HB2 H -2.522 4.720 -0.269 1.00 . A A . 16 SER HB2 1 1 10 4275 1 1 16 SER HB3 H -2.067 3.515 0.736 1.00 . A A . 16 SER HB3 1 1 10 4276 1 1 16 SER HG H -0.735 5.223 1.021 1.00 . A A . 16 SER HG 1 1 10 4277 1 1 16 SER N N -0.717 2.046 -0.942 1.00 . A A . 16 SER N 1 1 10 4278 1 1 16 SER O O -0.038 3.949 -2.820 1.00 . A A . 16 SER O 1 1 10 4279 1 1 16 SER OG O -0.592 4.727 0.193 1.00 . A A . 16 SER OG 1 1 10 4280 1 1 17 GLN C C -0.904 6.795 -3.550 1.00 . A A . 17 GLN C 1 1 10 4281 1 1 17 GLN CA C -1.763 5.644 -4.095 1.00 . A A . 17 GLN CA 1 1 10 4282 1 1 17 GLN CB C -3.020 6.191 -4.788 1.00 . A A . 17 GLN CB 1 1 10 4283 1 1 17 GLN CD C -4.848 4.428 -4.427 1.00 . A A . 17 GLN CD 1 1 10 4284 1 1 17 GLN CG C -3.914 5.112 -5.421 1.00 . A A . 17 GLN CG 1 1 10 4285 1 1 17 GLN H H -3.105 4.665 -2.771 1.00 . A A . 17 GLN H 1 1 10 4286 1 1 17 GLN HA H -1.157 5.109 -4.825 1.00 . A A . 17 GLN HA 1 1 10 4287 1 1 17 GLN HB2 H -3.561 6.687 -4.109 1.00 . A A . 17 GLN HB2 1 1 10 4288 1 1 17 GLN HB3 H -2.731 6.821 -5.509 1.00 . A A . 17 GLN HB3 1 1 10 4289 1 1 17 GLN HE21 H -5.651 3.222 -5.842 1.00 . A A . 17 GLN HE21 1 1 10 4290 1 1 17 GLN HE22 H -6.255 3.021 -4.193 1.00 . A A . 17 GLN HE22 1 1 10 4291 1 1 17 GLN HG2 H -4.470 5.541 -6.133 1.00 . A A . 17 GLN HG2 1 1 10 4292 1 1 17 GLN HG3 H -3.325 4.416 -5.832 1.00 . A A . 17 GLN HG3 1 1 10 4293 1 1 17 GLN N N -2.132 4.698 -3.051 1.00 . A A . 17 GLN N 1 1 10 4294 1 1 17 GLN NE2 N -5.653 3.480 -4.869 1.00 . A A . 17 GLN NE2 1 1 10 4295 1 1 17 GLN O O -0.275 7.512 -4.321 1.00 . A A . 17 GLN O 1 1 10 4296 1 1 17 GLN OE1 O -4.868 4.737 -3.241 1.00 . A A . 17 GLN OE1 1 1 10 4297 1 1 18 . C C 1.499 7.165 -1.351 1.00 . A A . 18 PFF C 1 1 10 4298 1 1 18 . CA C 0.135 7.837 -1.574 1.00 . A A . 18 PFF CA 1 1 10 4299 1 1 18 . CB C -0.464 8.327 -0.252 1.00 . A A . 18 PFF CB 1 1 10 4300 1 1 18 . CD1 C -2.006 10.122 -1.145 1.00 . A A . 18 PFF CD1 1 1 10 4301 1 1 18 . CD2 C -2.965 8.307 0.166 1.00 . A A . 18 PFF CD2 1 1 10 4302 1 1 18 . CE1 C -3.290 10.662 -1.338 1.00 . A A . 18 PFF CE1 1 1 10 4303 1 1 18 . CE2 C -4.247 8.857 -0.015 1.00 . A A . 18 PFF CE2 1 1 10 4304 1 1 18 . CG C -1.842 8.940 -0.400 1.00 . A A . 18 PFF CG 1 1 10 4305 1 1 18 . CZ C -4.411 10.026 -0.777 1.00 . A A . 18 PFF CZ 1 1 10 4306 1 1 18 . F F -5.650 10.561 -0.938 1.00 . A A . 18 PFF F 1 1 10 4307 1 1 18 . H H -1.351 6.322 -1.631 1.00 . A A . 18 PFF H 1 1 10 4308 1 1 18 . HA H 0.302 8.705 -2.213 1.00 . A A . 18 PFF HA 1 1 10 4309 1 1 18 . HB2 H -0.522 7.489 0.441 1.00 . A A . 18 PFF HB2 1 1 10 4310 1 1 18 . HB3 H 0.206 9.072 0.177 1.00 . A A . 18 PFF HB3 1 1 10 4311 1 1 18 . HD1 H -1.144 10.609 -1.580 1.00 . A A . 18 PFF HD1 1 1 10 4312 1 1 18 . HD2 H -2.843 7.406 0.749 1.00 . A A . 18 PFF HD2 1 1 10 4313 1 1 18 . HE1 H -3.415 11.566 -1.916 1.00 . A A . 18 PFF HE1 1 1 10 4314 1 1 18 . HE2 H -5.106 8.387 0.439 1.00 . A A . 18 PFF HE2 1 1 10 4315 1 1 18 . N N -0.816 6.939 -2.223 1.00 . A A . 18 PFF N 1 1 10 4316 1 1 18 . O O 2.435 7.807 -0.884 1.00 . A A . 18 PFF O 1 1 10 4317 1 1 19 GLY C C 3.267 4.526 -0.348 1.00 . A A . 19 GLY C 1 1 10 4318 1 1 19 GLY CA C 2.927 5.203 -1.671 1.00 . A A . 19 GLY CA 1 1 10 4319 1 1 19 GLY H H 0.850 5.366 -2.070 1.00 . A A . 19 GLY H 1 1 10 4320 1 1 19 GLY HA2 H 2.935 4.446 -2.455 1.00 . A A . 19 GLY HA2 1 1 10 4321 1 1 19 GLY HA3 H 3.710 5.927 -1.887 1.00 . A A . 19 GLY HA3 1 1 10 4322 1 1 19 GLY N N 1.640 5.880 -1.693 1.00 . A A . 19 GLY N 1 1 10 4323 1 1 19 GLY O O 4.438 4.195 -0.154 1.00 . A A . 19 GLY O 1 1 10 4324 1 1 20 . C C 1.936 2.306 1.973 1.00 . A A . 20 PFF C 1 1 10 4325 1 1 20 . CA C 2.541 3.711 1.861 1.00 . A A . 20 PFF CA 1 1 10 4326 1 1 20 . CB C 1.927 4.620 2.921 1.00 . A A . 20 PFF CB 1 1 10 4327 1 1 20 . CD1 C 2.196 7.070 2.355 1.00 . A A . 20 PFF CD1 1 1 10 4328 1 1 20 . CD2 C 3.698 6.074 3.990 1.00 . A A . 20 PFF CD2 1 1 10 4329 1 1 20 . CE1 C 2.774 8.329 2.588 1.00 . A A . 20 PFF CE1 1 1 10 4330 1 1 20 . CE2 C 4.285 7.331 4.212 1.00 . A A . 20 PFF CE2 1 1 10 4331 1 1 20 . CG C 2.632 5.948 3.082 1.00 . A A . 20 PFF CG 1 1 10 4332 1 1 20 . CZ C 3.812 8.462 3.526 1.00 . A A . 20 PFF CZ 1 1 10 4333 1 1 20 . F F 4.366 9.681 3.759 1.00 . A A . 20 PFF F 1 1 10 4334 1 1 20 . H H 1.338 4.554 0.326 1.00 . A A . 20 PFF H 1 1 10 4335 1 1 20 . HA H 3.610 3.638 2.044 1.00 . A A . 20 PFF HA 1 1 10 4336 1 1 20 . HB2 H 0.880 4.793 2.677 1.00 . A A . 20 PFF HB2 1 1 10 4337 1 1 20 . HB3 H 1.955 4.097 3.870 1.00 . A A . 20 PFF HB3 1 1 10 4338 1 1 20 . HD1 H 1.403 6.970 1.632 1.00 . A A . 20 PFF HD1 1 1 10 4339 1 1 20 . HD2 H 4.022 5.225 4.572 1.00 . A A . 20 PFF HD2 1 1 10 4340 1 1 20 . HE1 H 2.421 9.194 2.047 1.00 . A A . 20 PFF HE1 1 1 10 4341 1 1 20 . HE2 H 5.073 7.437 4.942 1.00 . A A . 20 PFF HE2 1 1 10 4342 1 1 20 . N N 2.301 4.316 0.551 1.00 . A A . 20 PFF N 1 1 10 4343 1 1 20 . O O 0.982 1.983 1.268 1.00 . A A . 20 PFF O 1 1 10 4344 1 1 21 CYS C C 0.837 -0.100 3.967 1.00 . A A . 21 CYS C 1 1 10 4345 1 1 21 CYS CA C 2.027 0.086 3.023 1.00 . A A . 21 CYS CA 1 1 10 4346 1 1 21 CYS CB C 3.178 -0.758 3.579 1.00 . A A . 21 CYS CB 1 1 10 4347 1 1 21 CYS H H 3.265 1.792 3.408 1.00 . A A . 21 CYS H 1 1 10 4348 1 1 21 CYS HA H 1.767 -0.298 2.040 1.00 . A A . 21 CYS HA 1 1 10 4349 1 1 21 CYS HB2 H 3.406 -0.411 4.489 1.00 . A A . 21 CYS HB2 1 1 10 4350 1 1 21 CYS HB3 H 2.862 -1.704 3.652 1.00 . A A . 21 CYS HB3 1 1 10 4351 1 1 21 CYS N N 2.458 1.475 2.880 1.00 . A A . 21 CYS N 1 1 10 4352 1 1 21 CYS O O 0.778 0.508 5.032 1.00 . A A . 21 CYS O 1 1 10 4353 1 1 21 CYS SG S 4.677 -0.745 2.584 1.00 . A A . 21 CYS SG 1 1 10 4354 1 1 22 GLY C C -1.895 -2.613 3.870 1.00 . A A . 22 GLY C 1 1 10 4355 1 1 22 GLY CA C -0.973 -1.641 4.596 1.00 . A A . 22 GLY CA 1 1 10 4356 1 1 22 GLY H H -0.044 -1.438 2.699 1.00 . A A . 22 GLY H 1 1 10 4357 1 1 22 GLY HA2 H -0.424 -2.179 5.369 1.00 . A A . 22 GLY HA2 1 1 10 4358 1 1 22 GLY HA3 H -1.567 -0.854 5.062 1.00 . A A . 22 GLY HA3 1 1 10 4359 1 1 22 GLY N N -0.035 -1.058 3.647 1.00 . A A . 22 GLY N 1 1 10 4360 1 1 22 GLY O O -1.750 -2.819 2.667 1.00 . A A . 22 GLY O 1 1 10 4361 1 1 23 LYS C C -5.325 -3.323 4.069 1.00 . A A . 23 LYS C 1 1 10 4362 1 1 23 LYS CA C -3.943 -3.962 3.904 1.00 . A A . 23 LYS CA 1 1 10 4363 1 1 23 LYS CB C -3.886 -5.434 4.340 1.00 . A A . 23 LYS CB 1 1 10 4364 1 1 23 LYS CD C -4.125 -7.817 3.515 1.00 . A A . 23 LYS CD 1 1 10 4365 1 1 23 LYS CE C -4.627 -8.720 2.381 1.00 . A A . 23 LYS CE 1 1 10 4366 1 1 23 LYS CG C -4.454 -6.346 3.244 1.00 . A A . 23 LYS CG 1 1 10 4367 1 1 23 LYS H H -2.875 -3.090 5.572 1.00 . A A . 23 LYS H 1 1 10 4368 1 1 23 LYS HA H -3.764 -3.927 2.833 1.00 . A A . 23 LYS HA 1 1 10 4369 1 1 23 LYS HB2 H -2.935 -5.687 4.518 1.00 . A A . 23 LYS HB2 1 1 10 4370 1 1 23 LYS HB3 H -4.424 -5.550 5.175 1.00 . A A . 23 LYS HB3 1 1 10 4371 1 1 23 LYS HD2 H -3.134 -7.919 3.597 1.00 . A A . 23 LYS HD2 1 1 10 4372 1 1 23 LYS HD3 H -4.561 -8.096 4.370 1.00 . A A . 23 LYS HD3 1 1 10 4373 1 1 23 LYS HE2 H -4.444 -9.673 2.622 1.00 . A A . 23 LYS HE2 1 1 10 4374 1 1 23 LYS HE3 H -5.612 -8.586 2.274 1.00 . A A . 23 LYS HE3 1 1 10 4375 1 1 23 LYS HG2 H -5.447 -6.236 3.211 1.00 . A A . 23 LYS HG2 1 1 10 4376 1 1 23 LYS HG3 H -4.060 -6.081 2.364 1.00 . A A . 23 LYS HG3 1 1 10 4377 1 1 23 LYS HZ1 H -4.206 -7.488 0.773 1.00 . A A . 23 LYS HZ1 1 1 10 4378 1 1 23 LYS HZ2 H -2.949 -8.437 1.212 1.00 . A A . 23 LYS HZ2 1 1 10 4379 1 1 23 LYS HZ3 H -4.216 -9.086 0.384 1.00 . A A . 23 LYS HZ3 1 1 10 4380 1 1 23 LYS N N -2.870 -3.202 4.567 1.00 . A A . 23 LYS N 1 1 10 4381 1 1 23 LYS NZ N -3.959 -8.414 1.093 1.00 . A A . 23 LYS NZ 1 1 10 4382 1 1 23 LYS O O -6.332 -3.883 3.656 1.00 . A A . 23 LYS O 1 1 10 4383 1 1 24 GLY C C -7.183 -0.669 3.734 1.00 . A A . 24 GLY C 1 1 10 4384 1 1 24 GLY CA C -6.586 -1.394 4.947 1.00 . A A . 24 GLY CA 1 1 10 4385 1 1 24 GLY H H -4.471 -1.719 4.884 1.00 . A A . 24 GLY H 1 1 10 4386 1 1 24 GLY HA2 H -7.329 -2.094 5.331 1.00 . A A . 24 GLY HA2 1 1 10 4387 1 1 24 GLY HA3 H -6.372 -0.661 5.725 1.00 . A A . 24 GLY HA3 1 1 10 4388 1 1 24 GLY N N -5.359 -2.126 4.651 1.00 . A A . 24 GLY N 1 1 10 4389 1 1 24 GLY O O -6.591 -0.642 2.648 1.00 . A A . 24 GLY O 1 1 10 4390 1 1 25 PRO C C -8.718 1.619 2.051 1.00 . A A . 25 PRO C 1 1 10 4391 1 1 25 PRO CA C -9.253 0.467 2.907 1.00 . A A . 25 PRO CA 1 1 10 4392 1 1 25 PRO CB C -10.539 0.862 3.640 1.00 . A A . 25 PRO CB 1 1 10 4393 1 1 25 PRO CD C -8.960 0.124 5.254 1.00 . A A . 25 PRO CD 1 1 10 4394 1 1 25 PRO CG C -10.074 1.147 5.066 1.00 . A A . 25 PRO CG 1 1 10 4395 1 1 25 PRO HA H -9.485 -0.355 2.229 1.00 . A A . 25 PRO HA 1 1 10 4396 1 1 25 PRO HB2 H -10.947 1.677 3.229 1.00 . A A . 25 PRO HB2 1 1 10 4397 1 1 25 PRO HB3 H -11.202 0.113 3.625 1.00 . A A . 25 PRO HB3 1 1 10 4398 1 1 25 PRO HD2 H -8.290 0.455 5.918 1.00 . A A . 25 PRO HD2 1 1 10 4399 1 1 25 PRO HD3 H -9.336 -0.749 5.566 1.00 . A A . 25 PRO HD3 1 1 10 4400 1 1 25 PRO HG2 H -9.727 2.081 5.154 1.00 . A A . 25 PRO HG2 1 1 10 4401 1 1 25 PRO HG3 H -10.813 1.002 5.724 1.00 . A A . 25 PRO HG3 1 1 10 4402 1 1 25 PRO N N -8.346 -0.026 3.945 1.00 . A A . 25 PRO N 1 1 10 4403 1 1 25 PRO O O -9.379 2.009 1.086 1.00 . A A . 25 PRO O 1 1 10 4404 1 1 26 LYS C C -5.449 2.443 0.960 1.00 . A A . 26 LYS C 1 1 10 4405 1 1 26 LYS CA C -6.796 3.003 1.408 1.00 . A A . 26 LYS CA 1 1 10 4406 1 1 26 LYS CB C -6.598 4.395 2.016 1.00 . A A . 26 LYS CB 1 1 10 4407 1 1 26 LYS CD C -7.635 6.017 0.304 1.00 . A A . 26 LYS CD 1 1 10 4408 1 1 26 LYS CE C -7.919 5.080 -0.878 1.00 . A A . 26 LYS CE 1 1 10 4409 1 1 26 LYS CG C -7.753 5.351 1.689 1.00 . A A . 26 LYS CG 1 1 10 4410 1 1 26 LYS H H -7.072 1.899 3.206 1.00 . A A . 26 LYS H 1 1 10 4411 1 1 26 LYS HA H -7.391 3.085 0.507 1.00 . A A . 26 LYS HA 1 1 10 4412 1 1 26 LYS HB2 H -6.529 4.304 3.009 1.00 . A A . 26 LYS HB2 1 1 10 4413 1 1 26 LYS HB3 H -5.749 4.783 1.657 1.00 . A A . 26 LYS HB3 1 1 10 4414 1 1 26 LYS HD2 H -8.286 6.775 0.265 1.00 . A A . 26 LYS HD2 1 1 10 4415 1 1 26 LYS HD3 H -6.705 6.371 0.206 1.00 . A A . 26 LYS HD3 1 1 10 4416 1 1 26 LYS HE2 H -8.537 4.358 -0.568 1.00 . A A . 26 LYS HE2 1 1 10 4417 1 1 26 LYS HE3 H -8.360 5.609 -1.603 1.00 . A A . 26 LYS HE3 1 1 10 4418 1 1 26 LYS HG2 H -8.608 4.834 1.718 1.00 . A A . 26 LYS HG2 1 1 10 4419 1 1 26 LYS HG3 H -7.774 6.070 2.384 1.00 . A A . 26 LYS HG3 1 1 10 4420 1 1 26 LYS HZ1 H -6.926 3.646 -2.019 1.00 . A A . 26 LYS HZ1 1 1 10 4421 1 1 26 LYS HZ2 H -6.155 5.067 -2.035 1.00 . A A . 26 LYS HZ2 1 1 10 4422 1 1 26 LYS HZ3 H -6.048 4.119 -0.726 1.00 . A A . 26 LYS HZ3 1 1 10 4423 1 1 26 LYS N N -7.521 2.145 2.340 1.00 . A A . 26 LYS N 1 1 10 4424 1 1 26 LYS NZ N -6.696 4.446 -1.435 1.00 . A A . 26 LYS NZ 1 1 10 4425 1 1 26 LYS O O -4.859 3.041 0.063 1.00 . A A . 26 LYS O 1 1 10 4426 1 1 27 TYR C C -3.879 -0.287 0.057 1.00 . A A . 27 TYR C 1 1 10 4427 1 1 27 TYR CA C -3.700 0.758 1.134 1.00 . A A . 27 TYR CA 1 1 10 4428 1 1 27 TYR CB C -3.012 0.120 2.331 1.00 . A A . 27 TYR CB 1 1 10 4429 1 1 27 TYR CD1 C -1.687 2.030 3.302 1.00 . A A . 27 TYR CD1 1 1 10 4430 1 1 27 TYR CD2 C -3.525 1.125 4.607 1.00 . A A . 27 TYR CD2 1 1 10 4431 1 1 27 TYR CE1 C -1.336 2.873 4.371 1.00 . A A . 27 TYR CE1 1 1 10 4432 1 1 27 TYR CE2 C -3.209 2.010 5.655 1.00 . A A . 27 TYR CE2 1 1 10 4433 1 1 27 TYR CG C -2.729 1.101 3.448 1.00 . A A . 27 TYR CG 1 1 10 4434 1 1 27 TYR CZ C -2.099 2.862 5.546 1.00 . A A . 27 TYR CZ 1 1 10 4435 1 1 27 TYR H H -5.574 0.808 2.155 1.00 . A A . 27 TYR H 1 1 10 4436 1 1 27 TYR HA H -3.046 1.532 0.736 1.00 . A A . 27 TYR HA 1 1 10 4437 1 1 27 TYR HB2 H -3.601 -0.605 2.687 1.00 . A A . 27 TYR HB2 1 1 10 4438 1 1 27 TYR HB3 H -2.145 -0.274 2.026 1.00 . A A . 27 TYR HB3 1 1 10 4439 1 1 27 TYR HD1 H -1.155 2.091 2.368 1.00 . A A . 27 TYR HD1 1 1 10 4440 1 1 27 TYR HD2 H -4.386 0.482 4.690 1.00 . A A . 27 TYR HD2 1 1 10 4441 1 1 27 TYR HE1 H -0.487 3.536 4.291 1.00 . A A . 27 TYR HE1 1 1 10 4442 1 1 27 TYR HE2 H -3.801 2.048 6.556 1.00 . A A . 27 TYR HE2 1 1 10 4443 1 1 27 TYR HH H -1.001 4.215 6.385 1.00 . A A . 27 TYR HH 1 1 10 4444 1 1 27 TYR N N -4.983 1.331 1.521 1.00 . A A . 27 TYR N 1 1 10 4445 1 1 27 TYR O O -3.198 -0.252 -0.960 1.00 . A A . 27 TYR O 1 1 10 4446 1 1 27 TYR OH O -1.845 3.764 6.529 1.00 . A A . 27 TYR OH 1 1 10 4447 1 1 28 CYS C C -5.899 -1.715 -1.916 1.00 . A A . 28 CYS C 1 1 10 4448 1 1 28 CYS CA C -5.011 -2.232 -0.782 1.00 . A A . 28 CYS CA 1 1 10 4449 1 1 28 CYS CB C -5.456 -3.514 -0.097 1.00 . A A . 28 CYS CB 1 1 10 4450 1 1 28 CYS H H -5.392 -1.241 1.062 1.00 . A A . 28 CYS H 1 1 10 4451 1 1 28 CYS HA H -4.058 -2.437 -1.254 1.00 . A A . 28 CYS HA 1 1 10 4452 1 1 28 CYS HB2 H -5.082 -3.540 0.830 1.00 . A A . 28 CYS HB2 1 1 10 4453 1 1 28 CYS HB3 H -6.455 -3.536 -0.054 1.00 . A A . 28 CYS HB3 1 1 10 4454 1 1 28 CYS N N -4.819 -1.214 0.228 1.00 . A A . 28 CYS N 1 1 10 4455 1 1 28 CYS O O -7.020 -2.173 -2.133 1.00 . A A . 28 CYS O 1 1 10 4456 1 1 28 CYS SG S -4.867 -4.955 -1.019 1.00 . A A . 28 CYS SG 1 1 10 4457 1 1 29 GLY C C -7.235 0.900 -3.008 1.00 . A A . 29 GLY C 1 1 10 4458 1 1 29 GLY CA C -6.087 0.099 -3.619 1.00 . A A . 29 GLY CA 1 1 10 4459 1 1 29 GLY H H -4.475 -0.367 -2.287 1.00 . A A . 29 GLY H 1 1 10 4460 1 1 29 GLY HA2 H -5.383 0.787 -4.085 1.00 . A A . 29 GLY HA2 1 1 10 4461 1 1 29 GLY HA3 H -6.484 -0.569 -4.385 1.00 . A A . 29 GLY HA3 1 1 10 4462 1 1 29 GLY N N -5.393 -0.681 -2.597 1.00 . A A . 29 GLY N 1 1 10 4463 1 1 29 GLY O O -7.166 2.131 -2.911 1.00 . A A . 29 GLY O 1 1 10 4464 1 1 30 ARG C C -9.947 -0.406 -0.783 1.00 . A A . 30 ARG C 1 1 10 4465 1 1 30 ARG CA C -9.385 0.651 -1.751 1.00 . A A . 30 ARG CA 1 1 10 4466 1 1 30 ARG CB C -10.473 1.233 -2.679 1.00 . A A . 30 ARG CB 1 1 10 4467 1 1 30 ARG CD C -11.661 3.267 -1.651 1.00 . A A . 30 ARG CD 1 1 10 4468 1 1 30 ARG CG C -10.550 2.767 -2.586 1.00 . A A . 30 ARG CG 1 1 10 4469 1 1 30 ARG CZ C -12.772 2.330 0.358 1.00 . A A . 30 ARG CZ 1 1 10 4470 1 1 30 ARG H H -8.149 -0.830 -2.702 1.00 . A A . 30 ARG H 1 1 10 4471 1 1 30 ARG HA H -9.003 1.448 -1.119 1.00 . A A . 30 ARG HA 1 1 10 4472 1 1 30 ARG HB2 H -10.263 0.977 -3.623 1.00 . A A . 30 ARG HB2 1 1 10 4473 1 1 30 ARG HB3 H -11.359 0.849 -2.418 1.00 . A A . 30 ARG HB3 1 1 10 4474 1 1 30 ARG HD2 H -11.518 4.242 -1.479 1.00 . A A . 30 ARG HD2 1 1 10 4475 1 1 30 ARG HD3 H -12.543 3.134 -2.104 1.00 . A A . 30 ARG HD3 1 1 10 4476 1 1 30 ARG HE H -10.850 2.073 -0.036 1.00 . A A . 30 ARG HE 1 1 10 4477 1 1 30 ARG HG2 H -9.673 3.108 -2.247 1.00 . A A . 30 ARG HG2 1 1 10 4478 1 1 30 ARG HG3 H -10.719 3.132 -3.502 1.00 . A A . 30 ARG HG3 1 1 10 4479 1 1 30 ARG HH11 H -13.856 3.841 -0.399 1.00 . A A . 30 ARG HH11 1 1 10 4480 1 1 30 ARG HH12 H -14.652 2.877 0.800 1.00 . A A . 30 ARG HH12 1 1 10 4481 1 1 30 ARG HH21 H -11.992 0.723 1.270 1.00 . A A . 30 ARG HH21 1 1 10 4482 1 1 30 ARG HH22 H -13.610 1.134 1.732 1.00 . A A . 30 ARG HH22 1 1 10 4483 1 1 30 ARG N N -8.259 0.170 -2.555 1.00 . A A . 30 ARG N 1 1 10 4484 1 1 30 ARG NE N -11.685 2.561 -0.361 1.00 . A A . 30 ARG NE 1 1 10 4485 1 1 30 ARG NH1 N -13.845 3.075 0.244 1.00 . A A . 30 ARG NH1 1 1 10 4486 1 1 30 ARG NH2 N -12.793 1.316 1.185 1.00 . A A . 30 ARG NH2 1 1 10 4487 1 1 30 ARG O O -10.865 -0.114 -0.022 1.00 . A A . 30 ARG O 1 1 10 4488 1 1 31 NH2 HN1 H -8.627 -1.885 -1.320 1.00 . A A . 31 NH2 HN1 1 1 10 4489 1 1 31 NH2 HN2 H -9.816 -2.284 -0.100 1.00 . A A . 31 NH2 HN2 1 1 10 4490 1 1 31 NH2 N N -9.414 -1.623 -0.745 1.00 . A A . 31 NH2 N 1 1 10 4491 2 2 1 NAG C1 C -7.373 15.135 0.726 1.00 . B A . 32 NAG C1 1 1 10 4492 2 2 1 NAG C2 C -7.466 13.787 1.440 1.00 . B A . 32 NAG C2 1 1 10 4493 2 2 1 NAG C3 C -6.144 13.556 2.182 1.00 . B A . 32 NAG C3 1 1 10 4494 2 2 1 NAG C4 C -4.922 13.657 1.263 1.00 . B A . 32 NAG C4 1 1 10 4495 2 2 1 NAG C5 C -4.979 15.041 0.608 1.00 . B A . 32 NAG C5 1 1 10 4496 2 2 1 NAG C6 C -3.830 15.241 -0.404 1.00 . B A . 32 NAG C6 1 1 10 4497 2 2 1 NAG C7 C -9.867 13.607 2.104 1.00 . B A . 32 NAG C7 1 1 10 4498 2 2 1 NAG C8 C -10.801 13.333 3.241 1.00 . B A . 32 NAG C8 1 1 10 4499 2 2 1 NAG H1 H -7.366 15.955 1.447 1.00 . B A . 32 NAG H1 1 1 10 4500 2 2 1 NAG H2 H -7.557 13.008 0.679 1.00 . B A . 32 NAG H2 1 1 10 4501 2 2 1 NAG H3 H -6.047 14.290 2.982 1.00 . B A . 32 NAG H3 1 1 10 4502 2 2 1 NAG H4 H -4.987 12.903 0.477 1.00 . B A . 32 NAG H4 1 1 10 4503 2 2 1 NAG H5 H -4.916 15.822 1.367 1.00 . B A . 32 NAG H5 1 1 10 4504 2 2 1 NAG H61 H -4.027 16.139 -0.991 1.00 . B A . 32 NAG H61 1 1 10 4505 2 2 1 NAG H62 H -3.797 14.387 -1.082 1.00 . B A . 32 NAG H62 1 1 10 4506 2 2 1 NAG H81 H -10.558 12.365 3.671 1.00 . B A . 32 NAG H81 1 1 10 4507 2 2 1 NAG H82 H -10.710 14.125 3.980 1.00 . B A . 32 NAG H82 1 1 10 4508 2 2 1 NAG H83 H -11.810 13.318 2.836 1.00 . B A . 32 NAG H83 1 1 10 4509 2 2 1 NAG HN2 H -8.353 13.512 3.369 1.00 . B A . 32 NAG HN2 1 1 10 4510 2 2 1 NAG HO1 H -9.180 14.815 0.156 1.00 . B A . 32 NAG HO1 1 1 10 4511 2 2 1 NAG HO3 H -5.339 12.109 3.144 1.00 . B A . 32 NAG HO3 1 1 10 4512 2 2 1 NAG HO4 H 2.532 7.446 8.063 1.00 . B A . 32 NAG HO4 1 1 10 4513 2 2 1 NAG HO6 H -2.486 16.305 0.527 1.00 . B A . 32 NAG HO6 1 1 10 4514 2 2 1 NAG N2 N -8.583 13.715 2.409 1.00 . B A . 32 NAG N2 1 1 10 4515 2 2 1 NAG O1 O -8.412 15.304 -0.165 1.00 . B A . 32 NAG O1 1 1 10 4516 2 2 1 NAG O3 O -6.212 12.275 2.761 1.00 . B A . 32 NAG O3 1 1 10 4517 2 2 1 NAG O4 O -3.692 13.528 2.021 1.00 . B A . 32 NAG O4 1 1 10 4518 2 2 1 NAG O5 O -6.206 15.160 -0.085 1.00 . B A . 32 NAG O5 1 1 10 4519 2 2 1 NAG O6 O -2.551 15.403 0.195 1.00 . B A . 32 NAG O6 1 1 10 4520 2 2 1 NAG O7 O -10.281 13.745 0.963 1.00 . B A . 32 NAG O7 1 1 11 4521 1 1 1 VAL C C 7.948 5.121 6.537 1.00 . A A . 1 VAL C 1 1 11 4522 1 1 1 VAL CA C 9.363 5.663 6.433 1.00 . A A . 1 VAL CA 1 1 11 4523 1 1 1 VAL CB C 9.955 5.879 7.831 1.00 . A A . 1 VAL CB 1 1 11 4524 1 1 1 VAL CG1 C 10.010 4.557 8.603 1.00 . A A . 1 VAL CG1 1 1 11 4525 1 1 1 VAL CG2 C 11.383 6.423 7.725 1.00 . A A . 1 VAL CG2 1 1 11 4526 1 1 1 VAL H1 H 10.270 7.309 5.578 1.00 . A A . 1 VAL H1 1 1 11 4527 1 1 1 VAL H2 H 8.683 7.561 6.006 1.00 . A A . 1 VAL H2 1 1 11 4528 1 1 1 VAL H3 H 9.086 6.680 4.671 1.00 . A A . 1 VAL H3 1 1 11 4529 1 1 1 VAL HA H 9.973 4.923 5.914 1.00 . A A . 1 VAL HA 1 1 11 4530 1 1 1 VAL HB H 9.350 6.595 8.389 1.00 . A A . 1 VAL HB 1 1 11 4531 1 1 1 VAL HG11 H 10.494 4.715 9.567 1.00 . A A . 1 VAL HG11 1 1 11 4532 1 1 1 VAL HG12 H 9.006 4.175 8.791 1.00 . A A . 1 VAL HG12 1 1 11 4533 1 1 1 VAL HG13 H 10.579 3.815 8.040 1.00 . A A . 1 VAL HG13 1 1 11 4534 1 1 1 VAL HG21 H 11.828 6.464 8.720 1.00 . A A . 1 VAL HG21 1 1 11 4535 1 1 1 VAL HG22 H 11.990 5.766 7.100 1.00 . A A . 1 VAL HG22 1 1 11 4536 1 1 1 VAL HG23 H 11.394 7.433 7.317 1.00 . A A . 1 VAL HG23 1 1 11 4537 1 1 1 VAL N N 9.349 6.902 5.629 1.00 . A A . 1 VAL N 1 1 11 4538 1 1 1 VAL O O 7.089 5.801 7.085 1.00 . A A . 1 VAL O 1 1 11 4539 1 1 2 GLY C C 5.861 3.308 4.397 1.00 . A A . 2 GLY C 1 1 11 4540 1 1 2 GLY CA C 6.381 3.330 5.841 1.00 . A A . 2 GLY CA 1 1 11 4541 1 1 2 GLY H H 8.475 3.592 5.391 1.00 . A A . 2 GLY H 1 1 11 4542 1 1 2 GLY HA2 H 6.424 2.302 6.198 1.00 . A A . 2 GLY HA2 1 1 11 4543 1 1 2 GLY HA3 H 5.658 3.870 6.453 1.00 . A A . 2 GLY HA3 1 1 11 4544 1 1 2 GLY N N 7.710 3.937 5.975 1.00 . A A . 2 GLY N 1 1 11 4545 1 1 2 GLY O O 4.726 2.909 4.153 1.00 . A A . 2 GLY O 1 1 11 4546 1 1 3 GLU C C 6.646 2.280 1.456 1.00 . A A . 3 GLU C 1 1 11 4547 1 1 3 GLU CA C 6.430 3.694 2.003 1.00 . A A . 3 GLU CA 1 1 11 4548 1 1 3 GLU CB C 7.291 4.744 1.275 1.00 . A A . 3 GLU CB 1 1 11 4549 1 1 3 GLU CD C 9.200 5.242 2.908 1.00 . A A . 3 GLU CD 1 1 11 4550 1 1 3 GLU CG C 8.808 4.688 1.532 1.00 . A A . 3 GLU CG 1 1 11 4551 1 1 3 GLU H H 7.631 3.950 3.715 1.00 . A A . 3 GLU H 1 1 11 4552 1 1 3 GLU HA H 5.397 3.949 1.809 1.00 . A A . 3 GLU HA 1 1 11 4553 1 1 3 GLU HB2 H 7.145 4.628 0.293 1.00 . A A . 3 GLU HB2 1 1 11 4554 1 1 3 GLU HB3 H 6.969 5.648 1.556 1.00 . A A . 3 GLU HB3 1 1 11 4555 1 1 3 GLU HG2 H 9.106 3.735 1.475 1.00 . A A . 3 GLU HG2 1 1 11 4556 1 1 3 GLU HG3 H 9.271 5.226 0.828 1.00 . A A . 3 GLU HG3 1 1 11 4557 1 1 3 GLU N N 6.680 3.742 3.438 1.00 . A A . 3 GLU N 1 1 11 4558 1 1 3 GLU O O 7.454 1.514 1.976 1.00 . A A . 3 GLU O 1 1 11 4559 1 1 3 GLU OE1 O 9.374 6.472 3.054 1.00 . A A . 3 GLU OE1 1 1 11 4560 1 1 3 GLU OE2 O 9.213 4.466 3.894 1.00 . A A . 3 GLU OE2 1 1 11 4561 1 1 4 CYS C C 7.248 0.334 -0.979 1.00 . A A . 4 CYS C 1 1 11 4562 1 1 4 CYS CA C 6.009 0.556 -0.113 1.00 . A A . 4 CYS CA 1 1 11 4563 1 1 4 CYS CB C 4.749 0.206 -0.900 1.00 . A A . 4 CYS CB 1 1 11 4564 1 1 4 CYS H H 5.217 2.533 0.015 1.00 . A A . 4 CYS H 1 1 11 4565 1 1 4 CYS HA H 6.073 -0.134 0.731 1.00 . A A . 4 CYS HA 1 1 11 4566 1 1 4 CYS HB2 H 4.830 -0.745 -1.198 1.00 . A A . 4 CYS HB2 1 1 11 4567 1 1 4 CYS HB3 H 3.968 0.297 -0.282 1.00 . A A . 4 CYS HB3 1 1 11 4568 1 1 4 CYS N N 5.909 1.905 0.411 1.00 . A A . 4 CYS N 1 1 11 4569 1 1 4 CYS O O 7.792 1.227 -1.628 1.00 . A A . 4 CYS O 1 1 11 4570 1 1 4 CYS SG S 4.415 1.213 -2.360 1.00 . A A . 4 CYS SG 1 1 11 4571 1 1 5 VAL C C 8.222 -1.469 -3.364 1.00 . A A . 5 VAL C 1 1 11 4572 1 1 5 VAL CA C 8.711 -1.422 -1.922 1.00 . A A . 5 VAL CA 1 1 11 4573 1 1 5 VAL CB C 9.195 -2.792 -1.419 1.00 . A A . 5 VAL CB 1 1 11 4574 1 1 5 VAL CG1 C 10.443 -3.252 -2.179 1.00 . A A . 5 VAL CG1 1 1 11 4575 1 1 5 VAL CG2 C 9.560 -2.724 0.067 1.00 . A A . 5 VAL CG2 1 1 11 4576 1 1 5 VAL H H 7.008 -1.610 -0.647 1.00 . A A . 5 VAL H 1 1 11 4577 1 1 5 VAL HA H 9.544 -0.722 -1.861 1.00 . A A . 5 VAL HA 1 1 11 4578 1 1 5 VAL HB H 8.398 -3.530 -1.534 1.00 . A A . 5 VAL HB 1 1 11 4579 1 1 5 VAL HG11 H 10.786 -4.203 -1.774 1.00 . A A . 5 VAL HG11 1 1 11 4580 1 1 5 VAL HG12 H 10.223 -3.392 -3.236 1.00 . A A . 5 VAL HG12 1 1 11 4581 1 1 5 VAL HG13 H 11.238 -2.514 -2.071 1.00 . A A . 5 VAL HG13 1 1 11 4582 1 1 5 VAL HG21 H 8.681 -2.504 0.672 1.00 . A A . 5 VAL HG21 1 1 11 4583 1 1 5 VAL HG22 H 9.965 -3.683 0.393 1.00 . A A . 5 VAL HG22 1 1 11 4584 1 1 5 VAL HG23 H 10.308 -1.949 0.231 1.00 . A A . 5 VAL HG23 1 1 11 4585 1 1 5 VAL N N 7.616 -0.935 -1.094 1.00 . A A . 5 VAL N 1 1 11 4586 1 1 5 VAL O O 7.910 -2.536 -3.891 1.00 . A A . 5 VAL O 1 1 11 4587 1 1 6 ARG C C 6.500 -0.952 -5.823 1.00 . A A . 6 ARG C 1 1 11 4588 1 1 6 ARG CA C 7.627 -0.031 -5.349 1.00 . A A . 6 ARG CA 1 1 11 4589 1 1 6 ARG CB C 8.847 0.104 -6.288 1.00 . A A . 6 ARG CB 1 1 11 4590 1 1 6 ARG CD C 9.845 -2.338 -6.467 1.00 . A A . 6 ARG CD 1 1 11 4591 1 1 6 ARG CG C 10.054 -0.852 -6.137 1.00 . A A . 6 ARG CG 1 1 11 4592 1 1 6 ARG CZ C 8.821 -2.252 -8.748 1.00 . A A . 6 ARG CZ 1 1 11 4593 1 1 6 ARG H H 8.061 0.509 -3.323 1.00 . A A . 6 ARG H 1 1 11 4594 1 1 6 ARG HA H 7.145 0.947 -5.344 1.00 . A A . 6 ARG HA 1 1 11 4595 1 1 6 ARG HB2 H 8.506 -0.008 -7.221 1.00 . A A . 6 ARG HB2 1 1 11 4596 1 1 6 ARG HB3 H 9.199 1.033 -6.171 1.00 . A A . 6 ARG HB3 1 1 11 4597 1 1 6 ARG HD2 H 10.699 -2.712 -6.828 1.00 . A A . 6 ARG HD2 1 1 11 4598 1 1 6 ARG HD3 H 9.596 -2.823 -5.629 1.00 . A A . 6 ARG HD3 1 1 11 4599 1 1 6 ARG HE H 7.847 -2.555 -7.085 1.00 . A A . 6 ARG HE 1 1 11 4600 1 1 6 ARG HG2 H 10.778 -0.513 -6.738 1.00 . A A . 6 ARG HG2 1 1 11 4601 1 1 6 ARG HG3 H 10.358 -0.799 -5.186 1.00 . A A . 6 ARG HG3 1 1 11 4602 1 1 6 ARG HH11 H 10.799 -2.495 -8.989 1.00 . A A . 6 ARG HH11 1 1 11 4603 1 1 6 ARG HH12 H 9.923 -2.045 -10.413 1.00 . A A . 6 ARG HH12 1 1 11 4604 1 1 6 ARG HH21 H 6.850 -1.880 -8.801 1.00 . A A . 6 ARG HH21 1 1 11 4605 1 1 6 ARG HH22 H 7.686 -1.695 -10.306 1.00 . A A . 6 ARG HH22 1 1 11 4606 1 1 6 ARG N N 8.044 -0.282 -3.960 1.00 . A A . 6 ARG N 1 1 11 4607 1 1 6 ARG NE N 8.787 -2.535 -7.459 1.00 . A A . 6 ARG NE 1 1 11 4608 1 1 6 ARG NH1 N 9.936 -2.265 -9.438 1.00 . A A . 6 ARG NH1 1 1 11 4609 1 1 6 ARG NH2 N 7.697 -1.916 -9.331 1.00 . A A . 6 ARG NH2 1 1 11 4610 1 1 6 ARG O O 6.450 -1.396 -6.973 1.00 . A A . 6 ARG O 1 1 11 4611 1 1 7 GLY C C 4.263 -3.155 -3.925 1.00 . A A . 7 GLY C 1 1 11 4612 1 1 7 GLY CA C 4.478 -2.161 -5.071 1.00 . A A . 7 GLY CA 1 1 11 4613 1 1 7 GLY H H 5.773 -0.766 -4.009 1.00 . A A . 7 GLY H 1 1 11 4614 1 1 7 GLY HA2 H 3.563 -1.589 -5.213 1.00 . A A . 7 GLY HA2 1 1 11 4615 1 1 7 GLY HA3 H 4.632 -2.747 -5.978 1.00 . A A . 7 GLY HA3 1 1 11 4616 1 1 7 GLY N N 5.606 -1.247 -4.885 1.00 . A A . 7 GLY N 1 1 11 4617 1 1 7 GLY O O 3.159 -3.681 -3.787 1.00 . A A . 7 GLY O 1 1 11 4618 1 1 8 ARG C C 5.500 -3.995 -0.666 1.00 . A A . 8 ARG C 1 1 11 4619 1 1 8 ARG CA C 5.196 -4.487 -2.076 1.00 . A A . 8 ARG CA 1 1 11 4620 1 1 8 ARG CB C 6.103 -5.659 -2.500 1.00 . A A . 8 ARG CB 1 1 11 4621 1 1 8 ARG CD C 4.932 -7.949 -2.403 1.00 . A A . 8 ARG CD 1 1 11 4622 1 1 8 ARG CG C 5.299 -6.725 -3.260 1.00 . A A . 8 ARG CG 1 1 11 4623 1 1 8 ARG CZ C 3.072 -7.264 -0.853 1.00 . A A . 8 ARG CZ 1 1 11 4624 1 1 8 ARG H H 6.190 -3.005 -3.263 1.00 . A A . 8 ARG H 1 1 11 4625 1 1 8 ARG HA H 4.168 -4.846 -2.024 1.00 . A A . 8 ARG HA 1 1 11 4626 1 1 8 ARG HB2 H 6.830 -5.313 -3.093 1.00 . A A . 8 ARG HB2 1 1 11 4627 1 1 8 ARG HB3 H 6.506 -6.073 -1.684 1.00 . A A . 8 ARG HB3 1 1 11 4628 1 1 8 ARG HD2 H 4.285 -8.509 -2.921 1.00 . A A . 8 ARG HD2 1 1 11 4629 1 1 8 ARG HD3 H 5.767 -8.473 -2.235 1.00 . A A . 8 ARG HD3 1 1 11 4630 1 1 8 ARG HE H 4.848 -7.841 -0.254 1.00 . A A . 8 ARG HE 1 1 11 4631 1 1 8 ARG HG2 H 4.453 -6.306 -3.591 1.00 . A A . 8 ARG HG2 1 1 11 4632 1 1 8 ARG HG3 H 5.844 -7.036 -4.038 1.00 . A A . 8 ARG HG3 1 1 11 4633 1 1 8 ARG HH11 H 2.539 -6.795 -2.729 1.00 . A A . 8 ARG HH11 1 1 11 4634 1 1 8 ARG HH12 H 1.309 -6.586 -1.528 1.00 . A A . 8 ARG HH12 1 1 11 4635 1 1 8 ARG HH21 H 3.232 -7.534 1.124 1.00 . A A . 8 ARG HH21 1 1 11 4636 1 1 8 ARG HH22 H 1.687 -6.985 0.565 1.00 . A A . 8 ARG HH22 1 1 11 4637 1 1 8 ARG N N 5.281 -3.432 -3.096 1.00 . A A . 8 ARG N 1 1 11 4638 1 1 8 ARG NE N 4.321 -7.630 -1.099 1.00 . A A . 8 ARG NE 1 1 11 4639 1 1 8 ARG NH1 N 2.241 -6.849 -1.776 1.00 . A A . 8 ARG NH1 1 1 11 4640 1 1 8 ARG NH2 N 2.629 -7.261 0.374 1.00 . A A . 8 ARG NH2 1 1 11 4641 1 1 8 ARG O O 5.792 -2.831 -0.432 1.00 . A A . 8 ARG O 1 1 11 4642 1 1 9 CYS C C 5.277 -6.183 2.289 1.00 . A A . 9 CYS C 1 1 11 4643 1 1 9 CYS CA C 5.557 -4.778 1.716 1.00 . A A . 9 CYS CA 1 1 11 4644 1 1 9 CYS CB C 4.607 -3.696 2.244 1.00 . A A . 9 CYS CB 1 1 11 4645 1 1 9 CYS H H 5.055 -5.821 0.013 1.00 . A A . 9 CYS H 1 1 11 4646 1 1 9 CYS HA H 6.591 -4.504 1.928 1.00 . A A . 9 CYS HA 1 1 11 4647 1 1 9 CYS HB2 H 4.023 -3.397 1.489 1.00 . A A . 9 CYS HB2 1 1 11 4648 1 1 9 CYS HB3 H 4.042 -4.100 2.963 1.00 . A A . 9 CYS HB3 1 1 11 4649 1 1 9 CYS N N 5.369 -4.908 0.285 1.00 . A A . 9 CYS N 1 1 11 4650 1 1 9 CYS O O 5.069 -7.112 1.493 1.00 . A A . 9 CYS O 1 1 11 4651 1 1 9 CYS SG S 5.437 -2.238 2.929 1.00 . A A . 9 CYS SG 1 1 11 4652 1 1 10 PRO C C 3.698 -8.381 3.817 1.00 . A A . 10 PRO C 1 1 11 4653 1 1 10 PRO CA C 4.984 -7.656 4.254 1.00 . A A . 10 PRO CA 1 1 11 4654 1 1 10 PRO CB C 4.982 -7.356 5.757 1.00 . A A . 10 PRO CB 1 1 11 4655 1 1 10 PRO CD C 5.694 -5.398 4.609 1.00 . A A . 10 PRO CD 1 1 11 4656 1 1 10 PRO CG C 5.982 -6.208 5.871 1.00 . A A . 10 PRO CG 1 1 11 4657 1 1 10 PRO HA H 5.825 -8.315 4.041 1.00 . A A . 10 PRO HA 1 1 11 4658 1 1 10 PRO HB2 H 4.074 -7.075 6.067 1.00 . A A . 10 PRO HB2 1 1 11 4659 1 1 10 PRO HB3 H 5.284 -8.151 6.284 1.00 . A A . 10 PRO HB3 1 1 11 4660 1 1 10 PRO HD2 H 4.973 -4.727 4.781 1.00 . A A . 10 PRO HD2 1 1 11 4661 1 1 10 PRO HD3 H 6.520 -4.928 4.299 1.00 . A A . 10 PRO HD3 1 1 11 4662 1 1 10 PRO HG2 H 5.818 -5.665 6.695 1.00 . A A . 10 PRO HG2 1 1 11 4663 1 1 10 PRO HG3 H 6.923 -6.547 5.877 1.00 . A A . 10 PRO HG3 1 1 11 4664 1 1 10 PRO N N 5.258 -6.370 3.617 1.00 . A A . 10 PRO N 1 1 11 4665 1 1 10 PRO O O 2.930 -7.926 2.961 1.00 . A A . 10 PRO O 1 1 11 4666 1 1 11 SER C C 1.024 -9.768 3.994 1.00 . A A . 11 SER C 1 1 11 4667 1 1 11 SER CA C 2.362 -10.469 4.234 1.00 . A A . 11 SER CA 1 1 11 4668 1 1 11 SER CB C 2.236 -11.351 5.479 1.00 . A A . 11 SER CB 1 1 11 4669 1 1 11 SER H H 4.134 -9.798 5.163 1.00 . A A . 11 SER H 1 1 11 4670 1 1 11 SER HA H 2.580 -11.112 3.381 1.00 . A A . 11 SER HA 1 1 11 4671 1 1 11 SER HB2 H 1.454 -11.966 5.378 1.00 . A A . 11 SER HB2 1 1 11 4672 1 1 11 SER HB3 H 3.071 -11.889 5.597 1.00 . A A . 11 SER HB3 1 1 11 4673 1 1 11 SER HG H 1.313 -9.916 6.392 1.00 . A A . 11 SER HG 1 1 11 4674 1 1 11 SER N N 3.484 -9.548 4.432 1.00 . A A . 11 SER N 1 1 11 4675 1 1 11 SER O O 0.433 -9.237 4.934 1.00 . A A . 11 SER O 1 1 11 4676 1 1 11 SER OG O 2.044 -10.519 6.604 1.00 . A A . 11 SER OG 1 1 11 4677 1 1 12 GLY C C -0.915 -7.761 2.371 1.00 . A A . 12 GLY C 1 1 11 4678 1 1 12 GLY CA C -0.803 -9.285 2.434 1.00 . A A . 12 GLY CA 1 1 11 4679 1 1 12 GLY H H 1.080 -10.213 2.022 1.00 . A A . 12 GLY H 1 1 11 4680 1 1 12 GLY HA2 H -1.110 -9.685 1.468 1.00 . A A . 12 GLY HA2 1 1 11 4681 1 1 12 GLY HA3 H -1.506 -9.644 3.186 1.00 . A A . 12 GLY HA3 1 1 11 4682 1 1 12 GLY N N 0.533 -9.782 2.753 1.00 . A A . 12 GLY N 1 1 11 4683 1 1 12 GLY O O -2.027 -7.245 2.247 1.00 . A A . 12 GLY O 1 1 11 4684 1 1 13 MET C C 0.069 -5.106 0.888 1.00 . A A . 13 MET C 1 1 11 4685 1 1 13 MET CA C 0.163 -5.565 2.352 1.00 . A A . 13 MET CA 1 1 11 4686 1 1 13 MET CB C 1.434 -4.980 2.977 1.00 . A A . 13 MET CB 1 1 11 4687 1 1 13 MET CE C 1.171 -5.644 7.108 1.00 . A A . 13 MET CE 1 1 11 4688 1 1 13 MET CG C 1.690 -5.441 4.417 1.00 . A A . 13 MET CG 1 1 11 4689 1 1 13 MET H H 1.084 -7.485 2.653 1.00 . A A . 13 MET H 1 1 11 4690 1 1 13 MET HA H -0.702 -5.184 2.895 1.00 . A A . 13 MET HA 1 1 11 4691 1 1 13 MET HB2 H 2.215 -5.254 2.416 1.00 . A A . 13 MET HB2 1 1 11 4692 1 1 13 MET HB3 H 1.355 -3.983 2.975 1.00 . A A . 13 MET HB3 1 1 11 4693 1 1 13 MET HE1 H 0.596 -5.341 7.984 1.00 . A A . 13 MET HE1 1 1 11 4694 1 1 13 MET HE2 H 1.037 -6.713 6.942 1.00 . A A . 13 MET HE2 1 1 11 4695 1 1 13 MET HE3 H 2.225 -5.431 7.279 1.00 . A A . 13 MET HE3 1 1 11 4696 1 1 13 MET HG2 H 1.586 -6.435 4.447 1.00 . A A . 13 MET HG2 1 1 11 4697 1 1 13 MET HG3 H 2.629 -5.196 4.658 1.00 . A A . 13 MET HG3 1 1 11 4698 1 1 13 MET N N 0.197 -7.024 2.461 1.00 . A A . 13 MET N 1 1 11 4699 1 1 13 MET O O 0.387 -5.867 -0.033 1.00 . A A . 13 MET O 1 1 11 4700 1 1 13 MET SD S 0.591 -4.728 5.658 1.00 . A A . 13 MET SD 1 1 11 4701 1 1 14 CYS C C 0.339 -1.705 -0.366 1.00 . A A . 14 CYS C 1 1 11 4702 1 1 14 CYS CA C -0.140 -3.144 -0.607 1.00 . A A . 14 CYS CA 1 1 11 4703 1 1 14 CYS CB C -1.501 -3.105 -1.314 1.00 . A A . 14 CYS CB 1 1 11 4704 1 1 14 CYS H H -0.505 -3.270 1.486 1.00 . A A . 14 CYS H 1 1 11 4705 1 1 14 CYS HA H 0.585 -3.648 -1.248 1.00 . A A . 14 CYS HA 1 1 11 4706 1 1 14 CYS HB2 H -2.125 -2.604 -0.714 1.00 . A A . 14 CYS HB2 1 1 11 4707 1 1 14 CYS HB3 H -1.372 -2.593 -2.163 1.00 . A A . 14 CYS HB3 1 1 11 4708 1 1 14 CYS N N -0.256 -3.833 0.676 1.00 . A A . 14 CYS N 1 1 11 4709 1 1 14 CYS O O 0.415 -1.268 0.782 1.00 . A A . 14 CYS O 1 1 11 4710 1 1 14 CYS SG S -2.332 -4.660 -1.757 1.00 . A A . 14 CYS SG 1 1 11 4711 1 1 15 CYS C C -0.587 1.204 -1.259 1.00 . A A . 15 CYS C 1 1 11 4712 1 1 15 CYS CA C 0.769 0.496 -1.386 1.00 . A A . 15 CYS CA 1 1 11 4713 1 1 15 CYS CB C 1.381 0.975 -2.706 1.00 . A A . 15 CYS CB 1 1 11 4714 1 1 15 CYS H H 0.571 -1.374 -2.355 1.00 . A A . 15 CYS H 1 1 11 4715 1 1 15 CYS HA H 1.417 0.777 -0.555 1.00 . A A . 15 CYS HA 1 1 11 4716 1 1 15 CYS HB2 H 0.695 0.833 -3.420 1.00 . A A . 15 CYS HB2 1 1 11 4717 1 1 15 CYS HB3 H 1.566 1.953 -2.610 1.00 . A A . 15 CYS HB3 1 1 11 4718 1 1 15 CYS N N 0.604 -0.954 -1.440 1.00 . A A . 15 CYS N 1 1 11 4719 1 1 15 CYS O O -1.610 0.697 -1.721 1.00 . A A . 15 CYS O 1 1 11 4720 1 1 15 CYS SG S 2.911 0.192 -3.268 1.00 . A A . 15 CYS SG 1 1 11 4721 1 1 16 SER C C -1.319 4.216 -2.280 1.00 . A A . 16 SER C 1 1 11 4722 1 1 16 SER CA C -1.663 3.381 -1.053 1.00 . A A . 16 SER CA 1 1 11 4723 1 1 16 SER CB C -1.945 4.287 0.142 1.00 . A A . 16 SER CB 1 1 11 4724 1 1 16 SER H H 0.259 2.817 -0.358 1.00 . A A . 16 SER H 1 1 11 4725 1 1 16 SER HA H -2.575 2.840 -1.238 1.00 . A A . 16 SER HA 1 1 11 4726 1 1 16 SER HB2 H -2.848 4.702 0.032 1.00 . A A . 16 SER HB2 1 1 11 4727 1 1 16 SER HB3 H -1.929 3.739 0.978 1.00 . A A . 16 SER HB3 1 1 11 4728 1 1 16 SER HG H -1.015 5.620 1.163 1.00 . A A . 16 SER HG 1 1 11 4729 1 1 16 SER N N -0.590 2.442 -0.772 1.00 . A A . 16 SER N 1 1 11 4730 1 1 16 SER O O -0.154 4.356 -2.656 1.00 . A A . 16 SER O 1 1 11 4731 1 1 16 SER OG O -0.979 5.307 0.242 1.00 . A A . 16 SER OG 1 1 11 4732 1 1 17 GLN C C -1.324 7.182 -3.149 1.00 . A A . 17 GLN C 1 1 11 4733 1 1 17 GLN CA C -2.127 6.008 -3.750 1.00 . A A . 17 GLN CA 1 1 11 4734 1 1 17 GLN CB C -3.481 6.436 -4.324 1.00 . A A . 17 GLN CB 1 1 11 4735 1 1 17 GLN CD C -5.424 5.661 -2.850 1.00 . A A . 17 GLN CD 1 1 11 4736 1 1 17 GLN CG C -4.462 6.795 -3.210 1.00 . A A . 17 GLN CG 1 1 11 4737 1 1 17 GLN H H -3.272 4.670 -2.561 1.00 . A A . 17 GLN H 1 1 11 4738 1 1 17 GLN HA H -1.552 5.652 -4.590 1.00 . A A . 17 GLN HA 1 1 11 4739 1 1 17 GLN HB2 H -3.349 7.234 -4.912 1.00 . A A . 17 GLN HB2 1 1 11 4740 1 1 17 GLN HB3 H -3.860 5.683 -4.863 1.00 . A A . 17 GLN HB3 1 1 11 4741 1 1 17 GLN HE21 H -6.999 6.922 -2.642 1.00 . A A . 17 GLN HE21 1 1 11 4742 1 1 17 GLN HE22 H -7.296 5.200 -2.389 1.00 . A A . 17 GLN HE22 1 1 11 4743 1 1 17 GLN HG2 H -3.938 7.036 -2.393 1.00 . A A . 17 GLN HG2 1 1 11 4744 1 1 17 GLN HG3 H -5.001 7.584 -3.506 1.00 . A A . 17 GLN HG3 1 1 11 4745 1 1 17 GLN N N -2.323 4.897 -2.826 1.00 . A A . 17 GLN N 1 1 11 4746 1 1 17 GLN NE2 N -6.677 5.969 -2.577 1.00 . A A . 17 GLN NE2 1 1 11 4747 1 1 17 GLN O O -1.047 8.148 -3.850 1.00 . A A . 17 GLN O 1 1 11 4748 1 1 17 GLN OE1 O -5.065 4.487 -2.814 1.00 . A A . 17 GLN OE1 1 1 11 4749 1 1 18 . C C 1.344 7.345 -0.893 1.00 . A A . 18 PFF C 1 1 11 4750 1 1 18 . CA C 0.005 8.030 -1.228 1.00 . A A . 18 PFF CA 1 1 11 4751 1 1 18 . CB C -0.671 8.616 0.022 1.00 . A A . 18 PFF CB 1 1 11 4752 1 1 18 . CD1 C -3.097 8.060 0.462 1.00 . A A . 18 PFF CD1 1 1 11 4753 1 1 18 . CD2 C -2.585 9.876 -1.070 1.00 . A A . 18 PFF CD2 1 1 11 4754 1 1 18 . CE1 C -4.464 8.206 0.181 1.00 . A A . 18 PFF CE1 1 1 11 4755 1 1 18 . CE2 C -3.956 10.026 -1.348 1.00 . A A . 18 PFF CE2 1 1 11 4756 1 1 18 . CG C -2.152 8.897 -0.157 1.00 . A A . 18 PFF CG 1 1 11 4757 1 1 18 . CZ C -4.898 9.195 -0.718 1.00 . A A . 18 PFF CZ 1 1 11 4758 1 1 18 . F F -6.210 9.254 -1.063 1.00 . A A . 18 PFF F 1 1 11 4759 1 1 18 . H H -1.181 6.304 -1.306 1.00 . A A . 18 PFF H 1 1 11 4760 1 1 18 . HA H 0.220 8.854 -1.910 1.00 . A A . 18 PFF HA 1 1 11 4761 1 1 18 . HB2 H -0.547 7.919 0.851 1.00 . A A . 18 PFF HB2 1 1 11 4762 1 1 18 . HB3 H -0.164 9.543 0.292 1.00 . A A . 18 PFF HB3 1 1 11 4763 1 1 18 . HD1 H -2.774 7.281 1.132 1.00 . A A . 18 PFF HD1 1 1 11 4764 1 1 18 . HD2 H -1.864 10.499 -1.577 1.00 . A A . 18 PFF HD2 1 1 11 4765 1 1 18 . HE1 H -5.173 7.535 0.631 1.00 . A A . 18 PFF HE1 1 1 11 4766 1 1 18 . HE2 H -4.285 10.774 -2.057 1.00 . A A . 18 PFF HE2 1 1 11 4767 1 1 18 . N N -0.914 7.099 -1.877 1.00 . A A . 18 PFF N 1 1 11 4768 1 1 18 . O O 2.079 7.799 -0.018 1.00 . A A . 18 PFF O 1 1 11 4769 1 1 19 GLY C C 3.228 4.777 -0.143 1.00 . A A . 19 GLY C 1 1 11 4770 1 1 19 GLY CA C 2.973 5.556 -1.434 1.00 . A A . 19 GLY CA 1 1 11 4771 1 1 19 GLY H H 0.961 5.765 -2.114 1.00 . A A . 19 GLY H 1 1 11 4772 1 1 19 GLY HA2 H 3.066 4.856 -2.262 1.00 . A A . 19 GLY HA2 1 1 11 4773 1 1 19 GLY HA3 H 3.754 6.310 -1.537 1.00 . A A . 19 GLY HA3 1 1 11 4774 1 1 19 GLY N N 1.660 6.204 -1.518 1.00 . A A . 19 GLY N 1 1 11 4775 1 1 19 GLY O O 3.915 3.757 -0.166 1.00 . A A . 19 GLY O 1 1 11 4776 1 1 20 . C C 2.067 3.025 1.999 1.00 . A A . 20 PFF C 1 1 11 4777 1 1 20 . CA C 2.628 4.436 2.217 1.00 . A A . 20 PFF CA 1 1 11 4778 1 1 20 . CB C 1.804 5.198 3.250 1.00 . A A . 20 PFF CB 1 1 11 4779 1 1 20 . CD1 C 2.432 7.653 3.349 1.00 . A A . 20 PFF CD1 1 1 11 4780 1 1 20 . CD2 C 3.505 6.089 4.878 1.00 . A A . 20 PFF CD2 1 1 11 4781 1 1 20 . CE1 C 3.189 8.704 3.897 1.00 . A A . 20 PFF CE1 1 1 11 4782 1 1 20 . CE2 C 4.263 7.140 5.423 1.00 . A A . 20 PFF CE2 1 1 11 4783 1 1 20 . CG C 2.568 6.349 3.860 1.00 . A A . 20 PFF CG 1 1 11 4784 1 1 20 . CZ C 4.100 8.448 4.937 1.00 . A A . 20 PFF CZ 1 1 11 4785 1 1 20 . F F 4.821 9.467 5.476 1.00 . A A . 20 PFF F 1 1 11 4786 1 1 20 . H H 2.210 6.121 0.942 1.00 . A A . 20 PFF H 1 1 11 4787 1 1 20 . HA H 3.635 4.342 2.604 1.00 . A A . 20 PFF HA 1 1 11 4788 1 1 20 . HB2 H 0.880 5.550 2.789 1.00 . A A . 20 PFF HB2 1 1 11 4789 1 1 20 . HB3 H 1.543 4.518 4.056 1.00 . A A . 20 PFF HB3 1 1 11 4790 1 1 20 . HD1 H 1.775 7.845 2.516 1.00 . A A . 20 PFF HD1 1 1 11 4791 1 1 20 . HD2 H 3.626 5.086 5.260 1.00 . A A . 20 PFF HD2 1 1 11 4792 1 1 20 . HE1 H 3.083 9.705 3.507 1.00 . A A . 20 PFF HE1 1 1 11 4793 1 1 20 . HE2 H 4.958 6.946 6.226 1.00 . A A . 20 PFF HE2 1 1 11 4794 1 1 20 . N N 2.660 5.214 0.979 1.00 . A A . 20 PFF N 1 1 11 4795 1 1 20 . O O 1.210 2.833 1.140 1.00 . A A . 20 PFF O 1 1 11 4796 1 1 21 CYS C C 1.169 0.195 3.790 1.00 . A A . 21 CYS C 1 1 11 4797 1 1 21 CYS CA C 2.024 0.661 2.610 1.00 . A A . 21 CYS CA 1 1 11 4798 1 1 21 CYS CB C 3.213 -0.271 2.340 1.00 . A A . 21 CYS CB 1 1 11 4799 1 1 21 CYS H H 3.206 2.228 3.483 1.00 . A A . 21 CYS H 1 1 11 4800 1 1 21 CYS HA H 1.388 0.625 1.730 1.00 . A A . 21 CYS HA 1 1 11 4801 1 1 21 CYS HB2 H 2.908 -0.964 1.686 1.00 . A A . 21 CYS HB2 1 1 11 4802 1 1 21 CYS HB3 H 3.939 0.280 1.928 1.00 . A A . 21 CYS HB3 1 1 11 4803 1 1 21 CYS N N 2.504 2.031 2.775 1.00 . A A . 21 CYS N 1 1 11 4804 1 1 21 CYS O O 1.262 0.733 4.892 1.00 . A A . 21 CYS O 1 1 11 4805 1 1 21 CYS SG S 3.930 -1.141 3.758 1.00 . A A . 21 CYS SG 1 1 11 4806 1 1 22 GLY C C -1.422 -2.477 4.145 1.00 . A A . 22 GLY C 1 1 11 4807 1 1 22 GLY CA C -0.474 -1.390 4.643 1.00 . A A . 22 GLY CA 1 1 11 4808 1 1 22 GLY H H 0.220 -1.177 2.623 1.00 . A A . 22 GLY H 1 1 11 4809 1 1 22 GLY HA2 H 0.185 -1.814 5.401 1.00 . A A . 22 GLY HA2 1 1 11 4810 1 1 22 GLY HA3 H -1.061 -0.594 5.102 1.00 . A A . 22 GLY HA3 1 1 11 4811 1 1 22 GLY N N 0.338 -0.826 3.572 1.00 . A A . 22 GLY N 1 1 11 4812 1 1 22 GLY O O -1.468 -2.778 2.951 1.00 . A A . 22 GLY O 1 1 11 4813 1 1 23 LYS C C -4.531 -3.727 4.478 1.00 . A A . 23 LYS C 1 1 11 4814 1 1 23 LYS CA C -3.105 -4.183 4.772 1.00 . A A . 23 LYS CA 1 1 11 4815 1 1 23 LYS CB C -3.060 -5.200 5.934 1.00 . A A . 23 LYS CB 1 1 11 4816 1 1 23 LYS CD C -4.687 -7.119 5.322 1.00 . A A . 23 LYS CD 1 1 11 4817 1 1 23 LYS CE C -4.938 -7.812 3.976 1.00 . A A . 23 LYS CE 1 1 11 4818 1 1 23 LYS CG C -3.230 -6.669 5.516 1.00 . A A . 23 LYS CG 1 1 11 4819 1 1 23 LYS H H -2.002 -2.840 6.037 1.00 . A A . 23 LYS H 1 1 11 4820 1 1 23 LYS HA H -2.761 -4.646 3.863 1.00 . A A . 23 LYS HA 1 1 11 4821 1 1 23 LYS HB2 H -2.176 -5.108 6.393 1.00 . A A . 23 LYS HB2 1 1 11 4822 1 1 23 LYS HB3 H -3.794 -4.973 6.574 1.00 . A A . 23 LYS HB3 1 1 11 4823 1 1 23 LYS HD2 H -4.922 -7.757 6.055 1.00 . A A . 23 LYS HD2 1 1 11 4824 1 1 23 LYS HD3 H -5.277 -6.314 5.379 1.00 . A A . 23 LYS HD3 1 1 11 4825 1 1 23 LYS HE2 H -4.333 -8.605 3.905 1.00 . A A . 23 LYS HE2 1 1 11 4826 1 1 23 LYS HE3 H -5.891 -8.115 3.943 1.00 . A A . 23 LYS HE3 1 1 11 4827 1 1 23 LYS HG2 H -2.745 -6.805 4.652 1.00 . A A . 23 LYS HG2 1 1 11 4828 1 1 23 LYS HG3 H -2.819 -7.243 6.224 1.00 . A A . 23 LYS HG3 1 1 11 4829 1 1 23 LYS HZ1 H -5.070 -7.291 1.974 1.00 . A A . 23 LYS HZ1 1 1 11 4830 1 1 23 LYS HZ2 H -5.089 -5.998 3.009 1.00 . A A . 23 LYS HZ2 1 1 11 4831 1 1 23 LYS HZ3 H -3.680 -6.808 2.681 1.00 . A A . 23 LYS HZ3 1 1 11 4832 1 1 23 LYS N N -2.182 -3.077 5.071 1.00 . A A . 23 LYS N 1 1 11 4833 1 1 23 LYS NZ N -4.683 -6.914 2.827 1.00 . A A . 23 LYS NZ 1 1 11 4834 1 1 23 LYS O O -5.293 -4.445 3.832 1.00 . A A . 23 LYS O 1 1 11 4835 1 1 24 GLY C C -6.729 -1.387 3.704 1.00 . A A . 24 GLY C 1 1 11 4836 1 1 24 GLY CA C -6.224 -2.005 5.012 1.00 . A A . 24 GLY CA 1 1 11 4837 1 1 24 GLY H H -4.090 -2.047 5.357 1.00 . A A . 24 GLY H 1 1 11 4838 1 1 24 GLY HA2 H -6.890 -2.822 5.289 1.00 . A A . 24 GLY HA2 1 1 11 4839 1 1 24 GLY HA3 H -6.269 -1.247 5.793 1.00 . A A . 24 GLY HA3 1 1 11 4840 1 1 24 GLY N N -4.861 -2.530 4.938 1.00 . A A . 24 GLY N 1 1 11 4841 1 1 24 GLY O O -5.958 -1.201 2.760 1.00 . A A . 24 GLY O 1 1 11 4842 1 1 25 PRO C C -7.958 0.264 1.494 1.00 . A A . 25 PRO C 1 1 11 4843 1 1 25 PRO CA C -8.750 -0.621 2.457 1.00 . A A . 25 PRO CA 1 1 11 4844 1 1 25 PRO CB C -10.039 0.027 2.968 1.00 . A A . 25 PRO CB 1 1 11 4845 1 1 25 PRO CD C -8.941 -1.084 4.785 1.00 . A A . 25 PRO CD 1 1 11 4846 1 1 25 PRO CG C -10.333 -0.812 4.211 1.00 . A A . 25 PRO CG 1 1 11 4847 1 1 25 PRO HA H -9.026 -1.528 1.920 1.00 . A A . 25 PRO HA 1 1 11 4848 1 1 25 PRO HB2 H -9.896 0.989 3.202 1.00 . A A . 25 PRO HB2 1 1 11 4849 1 1 25 PRO HB3 H -10.776 -0.047 2.296 1.00 . A A . 25 PRO HB3 1 1 11 4850 1 1 25 PRO HD2 H -8.701 -0.386 5.459 1.00 . A A . 25 PRO HD2 1 1 11 4851 1 1 25 PRO HD3 H -8.912 -1.987 5.214 1.00 . A A . 25 PRO HD3 1 1 11 4852 1 1 25 PRO HG2 H -10.896 -0.303 4.862 1.00 . A A . 25 PRO HG2 1 1 11 4853 1 1 25 PRO HG3 H -10.793 -1.666 3.967 1.00 . A A . 25 PRO HG3 1 1 11 4854 1 1 25 PRO N N -8.026 -1.032 3.655 1.00 . A A . 25 PRO N 1 1 11 4855 1 1 25 PRO O O -7.605 -0.193 0.406 1.00 . A A . 25 PRO O 1 1 11 4856 1 1 26 LYS C C -5.529 2.054 0.602 1.00 . A A . 26 LYS C 1 1 11 4857 1 1 26 LYS CA C -6.938 2.471 1.034 1.00 . A A . 26 LYS CA 1 1 11 4858 1 1 26 LYS CB C -6.905 3.837 1.728 1.00 . A A . 26 LYS CB 1 1 11 4859 1 1 26 LYS CD C -8.331 5.809 2.522 1.00 . A A . 26 LYS CD 1 1 11 4860 1 1 26 LYS CE C -7.791 6.826 1.511 1.00 . A A . 26 LYS CE 1 1 11 4861 1 1 26 LYS CG C -8.324 4.386 1.951 1.00 . A A . 26 LYS CG 1 1 11 4862 1 1 26 LYS H H -7.899 1.799 2.813 1.00 . A A . 26 LYS H 1 1 11 4863 1 1 26 LYS HA H -7.508 2.571 0.110 1.00 . A A . 26 LYS HA 1 1 11 4864 1 1 26 LYS HB2 H -6.450 3.741 2.613 1.00 . A A . 26 LYS HB2 1 1 11 4865 1 1 26 LYS HB3 H -6.393 4.480 1.158 1.00 . A A . 26 LYS HB3 1 1 11 4866 1 1 26 LYS HD2 H -9.269 6.057 2.762 1.00 . A A . 26 LYS HD2 1 1 11 4867 1 1 26 LYS HD3 H -7.759 5.832 3.342 1.00 . A A . 26 LYS HD3 1 1 11 4868 1 1 26 LYS HE2 H -6.842 6.598 1.294 1.00 . A A . 26 LYS HE2 1 1 11 4869 1 1 26 LYS HE3 H -8.344 6.784 0.679 1.00 . A A . 26 LYS HE3 1 1 11 4870 1 1 26 LYS HG2 H -8.805 4.392 1.074 1.00 . A A . 26 LYS HG2 1 1 11 4871 1 1 26 LYS HG3 H -8.802 3.784 2.590 1.00 . A A . 26 LYS HG3 1 1 11 4872 1 1 26 LYS HZ1 H -7.397 8.899 1.467 1.00 . A A . 26 LYS HZ1 1 1 11 4873 1 1 26 LYS HZ2 H -8.800 8.546 2.140 1.00 . A A . 26 LYS HZ2 1 1 11 4874 1 1 26 LYS HZ3 H -7.371 8.277 2.952 1.00 . A A . 26 LYS HZ3 1 1 11 4875 1 1 26 LYS N N -7.618 1.497 1.894 1.00 . A A . 26 LYS N 1 1 11 4876 1 1 26 LYS NZ N -7.845 8.199 2.058 1.00 . A A . 26 LYS NZ 1 1 11 4877 1 1 26 LYS O O -4.963 2.686 -0.291 1.00 . A A . 26 LYS O 1 1 11 4878 1 1 27 TYR C C -4.190 -0.800 -0.287 1.00 . A A . 27 TYR C 1 1 11 4879 1 1 27 TYR CA C -3.781 0.350 0.642 1.00 . A A . 27 TYR CA 1 1 11 4880 1 1 27 TYR CB C -2.884 -0.151 1.784 1.00 . A A . 27 TYR CB 1 1 11 4881 1 1 27 TYR CD1 C -1.560 1.746 2.821 1.00 . A A . 27 TYR CD1 1 1 11 4882 1 1 27 TYR CD2 C -3.384 0.764 4.091 1.00 . A A . 27 TYR CD2 1 1 11 4883 1 1 27 TYR CE1 C -1.208 2.533 3.935 1.00 . A A . 27 TYR CE1 1 1 11 4884 1 1 27 TYR CE2 C -3.041 1.562 5.198 1.00 . A A . 27 TYR CE2 1 1 11 4885 1 1 27 TYR CG C -2.626 0.835 2.908 1.00 . A A . 27 TYR CG 1 1 11 4886 1 1 27 TYR CZ C -1.941 2.430 5.128 1.00 . A A . 27 TYR CZ 1 1 11 4887 1 1 27 TYR H H -5.500 0.472 1.880 1.00 . A A . 27 TYR H 1 1 11 4888 1 1 27 TYR HA H -3.209 1.077 0.069 1.00 . A A . 27 TYR HA 1 1 11 4889 1 1 27 TYR HB2 H -3.317 -0.960 2.181 1.00 . A A . 27 TYR HB2 1 1 11 4890 1 1 27 TYR HB3 H -2.000 -0.404 1.390 1.00 . A A . 27 TYR HB3 1 1 11 4891 1 1 27 TYR HD1 H -0.994 1.821 1.906 1.00 . A A . 27 TYR HD1 1 1 11 4892 1 1 27 TYR HD2 H -4.225 0.091 4.150 1.00 . A A . 27 TYR HD2 1 1 11 4893 1 1 27 TYR HE1 H -0.369 3.208 3.880 1.00 . A A . 27 TYR HE1 1 1 11 4894 1 1 27 TYR HE2 H -3.608 1.521 6.116 1.00 . A A . 27 TYR HE2 1 1 11 4895 1 1 27 TYR HH H -0.865 3.771 6.103 1.00 . A A . 27 TYR HH 1 1 11 4896 1 1 27 TYR N N -4.979 0.980 1.174 1.00 . A A . 27 TYR N 1 1 11 4897 1 1 27 TYR O O -3.880 -0.807 -1.479 1.00 . A A . 27 TYR O 1 1 11 4898 1 1 27 TYR OH O -1.682 3.251 6.183 1.00 . A A . 27 TYR OH 1 1 11 4899 1 1 28 CYS C C -6.353 -3.700 -0.410 1.00 . A A . 28 CYS C 1 1 11 4900 1 1 28 CYS CA C -4.931 -3.133 -0.268 1.00 . A A . 28 CYS CA 1 1 11 4901 1 1 28 CYS CB C -4.051 -3.958 0.669 1.00 . A A . 28 CYS CB 1 1 11 4902 1 1 28 CYS H H -5.139 -1.696 1.252 1.00 . A A . 28 CYS H 1 1 11 4903 1 1 28 CYS HA H -4.492 -3.132 -1.265 1.00 . A A . 28 CYS HA 1 1 11 4904 1 1 28 CYS HB2 H -3.363 -3.342 1.052 1.00 . A A . 28 CYS HB2 1 1 11 4905 1 1 28 CYS HB3 H -4.636 -4.303 1.403 1.00 . A A . 28 CYS HB3 1 1 11 4906 1 1 28 CYS N N -4.890 -1.787 0.273 1.00 . A A . 28 CYS N 1 1 11 4907 1 1 28 CYS O O -6.515 -4.807 -0.909 1.00 . A A . 28 CYS O 1 1 11 4908 1 1 28 CYS SG S -3.176 -5.376 -0.036 1.00 . A A . 28 CYS SG 1 1 11 4909 1 1 29 GLY C C -8.844 -2.279 -1.926 1.00 . A A . 29 GLY C 1 1 11 4910 1 1 29 GLY CA C -8.720 -3.103 -0.637 1.00 . A A . 29 GLY CA 1 1 11 4911 1 1 29 GLY H H -7.190 -2.040 0.400 1.00 . A A . 29 GLY H 1 1 11 4912 1 1 29 GLY HA2 H -8.900 -4.152 -0.874 1.00 . A A . 29 GLY HA2 1 1 11 4913 1 1 29 GLY HA3 H -9.484 -2.770 0.065 1.00 . A A . 29 GLY HA3 1 1 11 4914 1 1 29 GLY N N -7.387 -2.932 -0.042 1.00 . A A . 29 GLY N 1 1 11 4915 1 1 29 GLY O O -9.678 -2.555 -2.783 1.00 . A A . 29 GLY O 1 1 11 4916 1 1 30 ARG C C -8.596 0.383 -3.868 1.00 . A A . 30 ARG C 1 1 11 4917 1 1 30 ARG CA C -7.564 -0.575 -3.286 1.00 . A A . 30 ARG CA 1 1 11 4918 1 1 30 ARG CB C -7.049 -1.576 -4.336 1.00 . A A . 30 ARG CB 1 1 11 4919 1 1 30 ARG CD C -4.876 -0.574 -5.324 1.00 . A A . 30 ARG CD 1 1 11 4920 1 1 30 ARG CG C -6.357 -0.910 -5.539 1.00 . A A . 30 ARG CG 1 1 11 4921 1 1 30 ARG CZ C -4.712 1.282 -3.629 1.00 . A A . 30 ARG CZ 1 1 11 4922 1 1 30 ARG H H -7.498 -0.997 -1.217 1.00 . A A . 30 ARG H 1 1 11 4923 1 1 30 ARG HA H -6.744 0.055 -2.975 1.00 . A A . 30 ARG HA 1 1 11 4924 1 1 30 ARG HB2 H -6.393 -2.188 -3.894 1.00 . A A . 30 ARG HB2 1 1 11 4925 1 1 30 ARG HB3 H -7.826 -2.107 -4.673 1.00 . A A . 30 ARG HB3 1 1 11 4926 1 1 30 ARG HD2 H -4.349 -1.419 -5.412 1.00 . A A . 30 ARG HD2 1 1 11 4927 1 1 30 ARG HD3 H -4.596 0.069 -6.037 1.00 . A A . 30 ARG HD3 1 1 11 4928 1 1 30 ARG HE H -4.104 -0.552 -3.315 1.00 . A A . 30 ARG HE 1 1 11 4929 1 1 30 ARG HG2 H -6.425 -1.531 -6.320 1.00 . A A . 30 ARG HG2 1 1 11 4930 1 1 30 ARG HG3 H -6.842 -0.060 -5.745 1.00 . A A . 30 ARG HG3 1 1 11 4931 1 1 30 ARG HH11 H -6.161 1.848 -4.896 1.00 . A A . 30 ARG HH11 1 1 11 4932 1 1 30 ARG HH12 H -5.612 3.068 -3.796 1.00 . A A . 30 ARG HH12 1 1 11 4933 1 1 30 ARG HH21 H -3.441 1.043 -2.106 1.00 . A A . 30 ARG HH21 1 1 11 4934 1 1 30 ARG HH22 H -4.133 2.623 -2.266 1.00 . A A . 30 ARG HH22 1 1 11 4935 1 1 30 ARG N N -7.971 -1.276 -2.069 1.00 . A A . 30 ARG N 1 1 11 4936 1 1 30 ARG NE N -4.563 0.026 -4.017 1.00 . A A . 30 ARG NE 1 1 11 4937 1 1 30 ARG NH1 N -5.562 2.133 -4.148 1.00 . A A . 30 ARG NH1 1 1 11 4938 1 1 30 ARG NH2 N -4.044 1.680 -2.587 1.00 . A A . 30 ARG NH2 1 1 11 4939 1 1 30 ARG O O -8.200 1.446 -4.342 1.00 . A A . 30 ARG O 1 1 11 4940 1 1 31 NH2 HN1 H -10.126 -0.871 -3.470 1.00 . A A . 31 NH2 HN1 1 1 11 4941 1 1 31 NH2 HN2 H -10.564 0.675 -4.207 1.00 . A A . 31 NH2 HN2 1 1 11 4942 1 1 31 NH2 N N -9.877 0.046 -3.824 1.00 . A A . 31 NH2 N 1 1 11 4943 2 2 1 NAG C1 C -7.876 12.889 -0.735 1.00 . B A . 32 NAG C1 1 1 11 4944 2 2 1 NAG C2 C -8.141 11.842 0.341 1.00 . B A . 32 NAG C2 1 1 11 4945 2 2 1 NAG C3 C -7.074 11.901 1.450 1.00 . B A . 32 NAG C3 1 1 11 4946 2 2 1 NAG C4 C -5.785 12.616 1.020 1.00 . B A . 32 NAG C4 1 1 11 4947 2 2 1 NAG C5 C -6.187 14.033 0.574 1.00 . B A . 32 NAG C5 1 1 11 4948 2 2 1 NAG C6 C -5.082 14.697 -0.267 1.00 . B A . 32 NAG C6 1 1 11 4949 2 2 1 NAG C7 C -10.218 10.999 1.428 1.00 . B A . 32 NAG C7 1 1 11 4950 2 2 1 NAG C8 C -11.581 11.379 1.919 1.00 . B A . 32 NAG C8 1 1 11 4951 2 2 1 NAG H1 H -8.790 13.085 -1.299 1.00 . B A . 32 NAG H1 1 1 11 4952 2 2 1 NAG H2 H -8.048 10.883 -0.169 1.00 . B A . 32 NAG H2 1 1 11 4953 2 2 1 NAG H3 H -7.476 12.422 2.320 1.00 . B A . 32 NAG H3 1 1 11 4954 2 2 1 NAG H4 H -5.350 12.063 0.191 1.00 . B A . 32 NAG H4 1 1 11 4955 2 2 1 NAG H5 H -6.330 14.646 1.464 1.00 . B A . 32 NAG H5 1 1 11 4956 2 2 1 NAG H61 H -4.214 14.902 0.359 1.00 . B A . 32 NAG H61 1 1 11 4957 2 2 1 NAG H62 H -5.455 15.646 -0.656 1.00 . B A . 32 NAG H62 1 1 11 4958 2 2 1 NAG H81 H -11.480 12.104 2.722 1.00 . B A . 32 NAG H81 1 1 11 4959 2 2 1 NAG H82 H -12.157 11.790 1.094 1.00 . B A . 32 NAG H82 1 1 11 4960 2 2 1 NAG H83 H -12.063 10.478 2.292 1.00 . B A . 32 NAG H83 1 1 11 4961 2 2 1 NAG HN2 H -9.936 12.896 0.907 1.00 . B A . 32 NAG HN2 1 1 11 4962 2 2 1 NAG HO1 H -6.270 13.190 -1.738 1.00 . B A . 32 NAG HO1 1 1 11 4963 2 2 1 NAG HO3 H -6.232 10.644 2.595 1.00 . B A . 32 NAG HO3 1 1 11 4964 2 2 1 NAG HO4 H 1.970 7.628 8.464 1.00 . B A . 32 NAG HO4 1 1 11 4965 2 2 1 NAG HO6 H -3.921 13.352 -1.047 1.00 . B A . 32 NAG HO6 1 1 11 4966 2 2 1 NAG N2 N -9.499 11.986 0.907 1.00 . B A . 32 NAG N2 1 1 11 4967 2 2 1 NAG O1 O -6.907 12.466 -1.618 1.00 . B A . 32 NAG O1 1 1 11 4968 2 2 1 NAG O3 O -6.796 10.565 1.809 1.00 . B A . 32 NAG O3 1 1 11 4969 2 2 1 NAG O4 O -4.787 12.739 2.073 1.00 . B A . 32 NAG O4 1 1 11 4970 2 2 1 NAG O5 O -7.419 14.091 -0.137 1.00 . B A . 32 NAG O5 1 1 11 4971 2 2 1 NAG O6 O -4.681 13.881 -1.357 1.00 . B A . 32 NAG O6 1 1 11 4972 2 2 1 NAG O7 O -9.822 9.843 1.527 1.00 . B A . 32 NAG O7 1 1 12 4973 1 1 1 VAL C C 9.151 8.990 3.246 1.00 . A A . 1 VAL C 1 1 12 4974 1 1 1 VAL CA C 8.683 10.333 2.702 1.00 . A A . 1 VAL CA 1 1 12 4975 1 1 1 VAL CB C 8.618 11.408 3.798 1.00 . A A . 1 VAL CB 1 1 12 4976 1 1 1 VAL CG1 C 8.570 12.791 3.145 1.00 . A A . 1 VAL CG1 1 1 12 4977 1 1 1 VAL CG2 C 7.403 11.273 4.722 1.00 . A A . 1 VAL CG2 1 1 12 4978 1 1 1 VAL H1 H 7.619 9.914 1.007 1.00 . A A . 1 VAL H1 1 1 12 4979 1 1 1 VAL H2 H 6.857 11.033 1.975 1.00 . A A . 1 VAL H2 1 1 12 4980 1 1 1 VAL H3 H 6.871 9.389 2.303 1.00 . A A . 1 VAL H3 1 1 12 4981 1 1 1 VAL HA H 9.444 10.644 1.988 1.00 . A A . 1 VAL HA 1 1 12 4982 1 1 1 VAL HB H 9.529 11.368 4.395 1.00 . A A . 1 VAL HB 1 1 12 4983 1 1 1 VAL HG11 H 9.430 12.920 2.488 1.00 . A A . 1 VAL HG11 1 1 12 4984 1 1 1 VAL HG12 H 7.654 12.933 2.571 1.00 . A A . 1 VAL HG12 1 1 12 4985 1 1 1 VAL HG13 H 8.613 13.555 3.923 1.00 . A A . 1 VAL HG13 1 1 12 4986 1 1 1 VAL HG21 H 6.476 11.492 4.194 1.00 . A A . 1 VAL HG21 1 1 12 4987 1 1 1 VAL HG22 H 7.352 10.269 5.148 1.00 . A A . 1 VAL HG22 1 1 12 4988 1 1 1 VAL HG23 H 7.504 11.984 5.542 1.00 . A A . 1 VAL HG23 1 1 12 4989 1 1 1 VAL N N 7.409 10.190 1.966 1.00 . A A . 1 VAL N 1 1 12 4990 1 1 1 VAL O O 9.350 8.833 4.445 1.00 . A A . 1 VAL O 1 1 12 4991 1 1 2 GLY C C 9.170 5.621 1.747 1.00 . A A . 2 GLY C 1 1 12 4992 1 1 2 GLY CA C 9.667 6.646 2.760 1.00 . A A . 2 GLY CA 1 1 12 4993 1 1 2 GLY H H 9.057 8.191 1.388 1.00 . A A . 2 GLY H 1 1 12 4994 1 1 2 GLY HA2 H 10.748 6.552 2.857 1.00 . A A . 2 GLY HA2 1 1 12 4995 1 1 2 GLY HA3 H 9.200 6.419 3.720 1.00 . A A . 2 GLY HA3 1 1 12 4996 1 1 2 GLY N N 9.324 8.010 2.361 1.00 . A A . 2 GLY N 1 1 12 4997 1 1 2 GLY O O 9.966 5.065 0.998 1.00 . A A . 2 GLY O 1 1 12 4998 1 1 3 GLU C C 7.327 3.203 0.594 1.00 . A A . 3 GLU C 1 1 12 4999 1 1 3 GLU CA C 7.050 4.718 0.717 1.00 . A A . 3 GLU CA 1 1 12 5000 1 1 3 GLU CB C 7.159 5.449 -0.629 1.00 . A A . 3 GLU CB 1 1 12 5001 1 1 3 GLU CD C 6.996 7.787 0.359 1.00 . A A . 3 GLU CD 1 1 12 5002 1 1 3 GLU CG C 6.426 6.799 -0.658 1.00 . A A . 3 GLU CG 1 1 12 5003 1 1 3 GLU H H 7.328 6.241 2.094 1.00 . A A . 3 GLU H 1 1 12 5004 1 1 3 GLU HA H 6.017 4.803 1.049 1.00 . A A . 3 GLU HA 1 1 12 5005 1 1 3 GLU HB2 H 8.127 5.611 -0.823 1.00 . A A . 3 GLU HB2 1 1 12 5006 1 1 3 GLU HB3 H 6.769 4.863 -1.339 1.00 . A A . 3 GLU HB3 1 1 12 5007 1 1 3 GLU HG2 H 6.513 7.193 -1.573 1.00 . A A . 3 GLU HG2 1 1 12 5008 1 1 3 GLU HG3 H 5.460 6.645 -0.451 1.00 . A A . 3 GLU HG3 1 1 12 5009 1 1 3 GLU N N 7.846 5.459 1.695 1.00 . A A . 3 GLU N 1 1 12 5010 1 1 3 GLU O O 8.341 2.679 1.051 1.00 . A A . 3 GLU O 1 1 12 5011 1 1 3 GLU OE1 O 6.554 7.791 1.532 1.00 . A A . 3 GLU OE1 1 1 12 5012 1 1 3 GLU OE2 O 7.962 8.532 0.066 1.00 . A A . 3 GLU OE2 1 1 12 5013 1 1 4 CYS C C 7.702 0.426 -0.733 1.00 . A A . 4 CYS C 1 1 12 5014 1 1 4 CYS CA C 6.377 1.025 -0.232 1.00 . A A . 4 CYS CA 1 1 12 5015 1 1 4 CYS CB C 5.285 0.682 -1.261 1.00 . A A . 4 CYS CB 1 1 12 5016 1 1 4 CYS H H 5.594 3.009 -0.383 1.00 . A A . 4 CYS H 1 1 12 5017 1 1 4 CYS HA H 6.132 0.550 0.718 1.00 . A A . 4 CYS HA 1 1 12 5018 1 1 4 CYS HB2 H 5.537 1.112 -2.128 1.00 . A A . 4 CYS HB2 1 1 12 5019 1 1 4 CYS HB3 H 5.273 -0.312 -1.372 1.00 . A A . 4 CYS HB3 1 1 12 5020 1 1 4 CYS N N 6.401 2.485 -0.056 1.00 . A A . 4 CYS N 1 1 12 5021 1 1 4 CYS O O 8.594 1.123 -1.222 1.00 . A A . 4 CYS O 1 1 12 5022 1 1 4 CYS SG S 3.607 1.211 -0.852 1.00 . A A . 4 CYS SG 1 1 12 5023 1 1 5 VAL C C 8.464 -1.497 -3.070 1.00 . A A . 5 VAL C 1 1 12 5024 1 1 5 VAL CA C 8.827 -1.586 -1.586 1.00 . A A . 5 VAL CA 1 1 12 5025 1 1 5 VAL CB C 9.011 -3.033 -1.097 1.00 . A A . 5 VAL CB 1 1 12 5026 1 1 5 VAL CG1 C 10.233 -3.688 -1.747 1.00 . A A . 5 VAL CG1 1 1 12 5027 1 1 5 VAL CG2 C 9.228 -3.069 0.418 1.00 . A A . 5 VAL CG2 1 1 12 5028 1 1 5 VAL H H 6.979 -1.468 -0.555 1.00 . A A . 5 VAL H 1 1 12 5029 1 1 5 VAL HA H 9.775 -1.068 -1.435 1.00 . A A . 5 VAL HA 1 1 12 5030 1 1 5 VAL HB H 8.120 -3.613 -1.326 1.00 . A A . 5 VAL HB 1 1 12 5031 1 1 5 VAL HG11 H 10.352 -4.701 -1.363 1.00 . A A . 5 VAL HG11 1 1 12 5032 1 1 5 VAL HG12 H 10.115 -3.749 -2.829 1.00 . A A . 5 VAL HG12 1 1 12 5033 1 1 5 VAL HG13 H 11.132 -3.116 -1.518 1.00 . A A . 5 VAL HG13 1 1 12 5034 1 1 5 VAL HG21 H 8.352 -2.690 0.943 1.00 . A A . 5 VAL HG21 1 1 12 5035 1 1 5 VAL HG22 H 9.404 -4.095 0.741 1.00 . A A . 5 VAL HG22 1 1 12 5036 1 1 5 VAL HG23 H 10.092 -2.459 0.684 1.00 . A A . 5 VAL HG23 1 1 12 5037 1 1 5 VAL N N 7.779 -0.904 -0.825 1.00 . A A . 5 VAL N 1 1 12 5038 1 1 5 VAL O O 8.138 -2.488 -3.715 1.00 . A A . 5 VAL O 1 1 12 5039 1 1 6 ARG C C 6.965 -0.535 -5.571 1.00 . A A . 6 ARG C 1 1 12 5040 1 1 6 ARG CA C 8.151 0.187 -4.934 1.00 . A A . 6 ARG CA 1 1 12 5041 1 1 6 ARG CB C 9.461 0.114 -5.731 1.00 . A A . 6 ARG CB 1 1 12 5042 1 1 6 ARG CD C 10.504 2.194 -4.537 1.00 . A A . 6 ARG CD 1 1 12 5043 1 1 6 ARG CG C 10.668 0.728 -4.990 1.00 . A A . 6 ARG CG 1 1 12 5044 1 1 6 ARG CZ C 10.398 3.388 -2.315 1.00 . A A . 6 ARG CZ 1 1 12 5045 1 1 6 ARG H H 8.441 0.472 -2.873 1.00 . A A . 6 ARG H 1 1 12 5046 1 1 6 ARG HA H 7.844 1.230 -4.896 1.00 . A A . 6 ARG HA 1 1 12 5047 1 1 6 ARG HB2 H 9.662 -0.847 -5.922 1.00 . A A . 6 ARG HB2 1 1 12 5048 1 1 6 ARG HB3 H 9.335 0.606 -6.592 1.00 . A A . 6 ARG HB3 1 1 12 5049 1 1 6 ARG HD2 H 11.356 2.681 -4.727 1.00 . A A . 6 ARG HD2 1 1 12 5050 1 1 6 ARG HD3 H 9.760 2.606 -5.062 1.00 . A A . 6 ARG HD3 1 1 12 5051 1 1 6 ARG HE H 9.816 1.561 -2.571 1.00 . A A . 6 ARG HE 1 1 12 5052 1 1 6 ARG HG2 H 10.843 0.173 -4.176 1.00 . A A . 6 ARG HG2 1 1 12 5053 1 1 6 ARG HG3 H 11.458 0.683 -5.601 1.00 . A A . 6 ARG HG3 1 1 12 5054 1 1 6 ARG HH11 H 11.174 4.586 -3.727 1.00 . A A . 6 ARG HH11 1 1 12 5055 1 1 6 ARG HH12 H 11.053 5.278 -2.143 1.00 . A A . 6 ARG HH12 1 1 12 5056 1 1 6 ARG HH21 H 9.673 2.487 -0.678 1.00 . A A . 6 ARG HH21 1 1 12 5057 1 1 6 ARG HH22 H 10.222 4.115 -0.455 1.00 . A A . 6 ARG HH22 1 1 12 5058 1 1 6 ARG N N 8.392 -0.254 -3.563 1.00 . A A . 6 ARG N 1 1 12 5059 1 1 6 ARG NE N 10.195 2.335 -3.096 1.00 . A A . 6 ARG NE 1 1 12 5060 1 1 6 ARG NH1 N 10.916 4.506 -2.764 1.00 . A A . 6 ARG NH1 1 1 12 5061 1 1 6 ARG NH2 N 10.072 3.325 -1.050 1.00 . A A . 6 ARG NH2 1 1 12 5062 1 1 6 ARG O O 6.958 -0.869 -6.749 1.00 . A A . 6 ARG O 1 1 12 5063 1 1 7 GLY C C 4.403 -2.619 -4.100 1.00 . A A . 7 GLY C 1 1 12 5064 1 1 7 GLY CA C 4.705 -1.438 -5.028 1.00 . A A . 7 GLY CA 1 1 12 5065 1 1 7 GLY H H 6.124 -0.361 -3.808 1.00 . A A . 7 GLY H 1 1 12 5066 1 1 7 GLY HA2 H 3.884 -0.725 -4.951 1.00 . A A . 7 GLY HA2 1 1 12 5067 1 1 7 GLY HA3 H 4.729 -1.811 -6.052 1.00 . A A . 7 GLY HA3 1 1 12 5068 1 1 7 GLY N N 5.961 -0.752 -4.723 1.00 . A A . 7 GLY N 1 1 12 5069 1 1 7 GLY O O 3.267 -3.089 -4.068 1.00 . A A . 7 GLY O 1 1 12 5070 1 1 8 ARG C C 5.428 -3.837 -0.955 1.00 . A A . 8 ARG C 1 1 12 5071 1 1 8 ARG CA C 5.198 -4.235 -2.409 1.00 . A A . 8 ARG CA 1 1 12 5072 1 1 8 ARG CB C 6.152 -5.364 -2.845 1.00 . A A . 8 ARG CB 1 1 12 5073 1 1 8 ARG CD C 4.192 -6.794 -3.688 1.00 . A A . 8 ARG CD 1 1 12 5074 1 1 8 ARG CG C 5.592 -6.236 -3.977 1.00 . A A . 8 ARG CG 1 1 12 5075 1 1 8 ARG CZ C 2.970 -7.118 -1.535 1.00 . A A . 8 ARG CZ 1 1 12 5076 1 1 8 ARG H H 6.316 -2.710 -3.367 1.00 . A A . 8 ARG H 1 1 12 5077 1 1 8 ARG HA H 4.168 -4.580 -2.455 1.00 . A A . 8 ARG HA 1 1 12 5078 1 1 8 ARG HB2 H 7.008 -4.952 -3.157 1.00 . A A . 8 ARG HB2 1 1 12 5079 1 1 8 ARG HB3 H 6.332 -5.949 -2.054 1.00 . A A . 8 ARG HB3 1 1 12 5080 1 1 8 ARG HD2 H 3.520 -6.071 -3.850 1.00 . A A . 8 ARG HD2 1 1 12 5081 1 1 8 ARG HD3 H 4.018 -7.558 -4.309 1.00 . A A . 8 ARG HD3 1 1 12 5082 1 1 8 ARG HE H 4.818 -7.774 -1.887 1.00 . A A . 8 ARG HE 1 1 12 5083 1 1 8 ARG HG2 H 5.546 -5.683 -4.809 1.00 . A A . 8 ARG HG2 1 1 12 5084 1 1 8 ARG HG3 H 6.215 -7.005 -4.121 1.00 . A A . 8 ARG HG3 1 1 12 5085 1 1 8 ARG HH11 H 1.782 -6.374 -2.972 1.00 . A A . 8 ARG HH11 1 1 12 5086 1 1 8 ARG HH12 H 1.055 -6.533 -1.408 1.00 . A A . 8 ARG HH12 1 1 12 5087 1 1 8 ARG HH21 H 3.828 -7.738 0.170 1.00 . A A . 8 ARG HH21 1 1 12 5088 1 1 8 ARG HH22 H 2.165 -7.272 0.297 1.00 . A A . 8 ARG HH22 1 1 12 5089 1 1 8 ARG N N 5.378 -3.101 -3.315 1.00 . A A . 8 ARG N 1 1 12 5090 1 1 8 ARG NE N 4.045 -7.273 -2.297 1.00 . A A . 8 ARG NE 1 1 12 5091 1 1 8 ARG NH1 N 1.847 -6.637 -2.009 1.00 . A A . 8 ARG NH1 1 1 12 5092 1 1 8 ARG NH2 N 2.989 -7.398 -0.255 1.00 . A A . 8 ARG NH2 1 1 12 5093 1 1 8 ARG O O 5.719 -2.687 -0.647 1.00 . A A . 8 ARG O 1 1 12 5094 1 1 9 CYS C C 5.592 -6.193 1.894 1.00 . A A . 9 CYS C 1 1 12 5095 1 1 9 CYS CA C 5.669 -4.762 1.337 1.00 . A A . 9 CYS CA 1 1 12 5096 1 1 9 CYS CB C 4.734 -3.794 2.060 1.00 . A A . 9 CYS CB 1 1 12 5097 1 1 9 CYS H H 4.979 -5.718 -0.366 1.00 . A A . 9 CYS H 1 1 12 5098 1 1 9 CYS HA H 6.698 -4.413 1.421 1.00 . A A . 9 CYS HA 1 1 12 5099 1 1 9 CYS HB2 H 4.000 -3.533 1.433 1.00 . A A . 9 CYS HB2 1 1 12 5100 1 1 9 CYS HB3 H 4.344 -4.262 2.853 1.00 . A A . 9 CYS HB3 1 1 12 5101 1 1 9 CYS N N 5.295 -4.813 -0.062 1.00 . A A . 9 CYS N 1 1 12 5102 1 1 9 CYS O O 5.282 -7.109 1.122 1.00 . A A . 9 CYS O 1 1 12 5103 1 1 9 CYS SG S 5.564 -2.290 2.631 1.00 . A A . 9 CYS SG 1 1 12 5104 1 1 10 PRO C C 4.491 -8.434 3.782 1.00 . A A . 10 PRO C 1 1 12 5105 1 1 10 PRO CA C 5.834 -7.694 3.854 1.00 . A A . 10 PRO CA 1 1 12 5106 1 1 10 PRO CB C 6.236 -7.418 5.307 1.00 . A A . 10 PRO CB 1 1 12 5107 1 1 10 PRO CD C 6.434 -5.395 4.089 1.00 . A A . 10 PRO CD 1 1 12 5108 1 1 10 PRO CG C 7.130 -6.187 5.191 1.00 . A A . 10 PRO CG 1 1 12 5109 1 1 10 PRO HA H 6.594 -8.329 3.398 1.00 . A A . 10 PRO HA 1 1 12 5110 1 1 10 PRO HB2 H 5.433 -7.226 5.871 1.00 . A A . 10 PRO HB2 1 1 12 5111 1 1 10 PRO HB3 H 6.739 -8.191 5.693 1.00 . A A . 10 PRO HB3 1 1 12 5112 1 1 10 PRO HD2 H 5.708 -4.824 4.473 1.00 . A A . 10 PRO HD2 1 1 12 5113 1 1 10 PRO HD3 H 7.091 -4.818 3.605 1.00 . A A . 10 PRO HD3 1 1 12 5114 1 1 10 PRO HG2 H 7.154 -5.673 6.048 1.00 . A A . 10 PRO HG2 1 1 12 5115 1 1 10 PRO HG3 H 8.061 -6.438 4.926 1.00 . A A . 10 PRO HG3 1 1 12 5116 1 1 10 PRO N N 5.875 -6.394 3.191 1.00 . A A . 10 PRO N 1 1 12 5117 1 1 10 PRO O O 3.507 -7.964 3.205 1.00 . A A . 10 PRO O 1 1 12 5118 1 1 11 SER C C 2.015 -10.130 4.156 1.00 . A A . 11 SER C 1 1 12 5119 1 1 11 SER CA C 3.414 -10.601 4.540 1.00 . A A . 11 SER CA 1 1 12 5120 1 1 11 SER CB C 3.426 -11.105 5.975 1.00 . A A . 11 SER CB 1 1 12 5121 1 1 11 SER H H 5.318 -9.887 4.913 1.00 . A A . 11 SER H 1 1 12 5122 1 1 11 SER HA H 3.665 -11.451 3.907 1.00 . A A . 11 SER HA 1 1 12 5123 1 1 11 SER HB2 H 3.102 -10.387 6.591 1.00 . A A . 11 SER HB2 1 1 12 5124 1 1 11 SER HB3 H 2.836 -11.908 6.059 1.00 . A A . 11 SER HB3 1 1 12 5125 1 1 11 SER HG H 4.774 -11.835 7.183 1.00 . A A . 11 SER HG 1 1 12 5126 1 1 11 SER N N 4.486 -9.618 4.402 1.00 . A A . 11 SER N 1 1 12 5127 1 1 11 SER O O 1.246 -9.651 4.984 1.00 . A A . 11 SER O 1 1 12 5128 1 1 11 SER OG O 4.759 -11.452 6.300 1.00 . A A . 11 SER OG 1 1 12 5129 1 1 12 GLY C C -0.119 -8.601 2.363 1.00 . A A . 12 GLY C 1 1 12 5130 1 1 12 GLY CA C 0.339 -10.062 2.353 1.00 . A A . 12 GLY CA 1 1 12 5131 1 1 12 GLY H H 2.382 -10.707 2.281 1.00 . A A . 12 GLY H 1 1 12 5132 1 1 12 GLY HA2 H 0.294 -10.421 1.325 1.00 . A A . 12 GLY HA2 1 1 12 5133 1 1 12 GLY HA3 H -0.375 -10.640 2.940 1.00 . A A . 12 GLY HA3 1 1 12 5134 1 1 12 GLY N N 1.680 -10.302 2.878 1.00 . A A . 12 GLY N 1 1 12 5135 1 1 12 GLY O O -1.281 -8.346 2.051 1.00 . A A . 12 GLY O 1 1 12 5136 1 1 13 MET C C 0.169 -5.665 1.323 1.00 . A A . 13 MET C 1 1 12 5137 1 1 13 MET CA C 0.320 -6.228 2.737 1.00 . A A . 13 MET CA 1 1 12 5138 1 1 13 MET CB C 1.315 -5.393 3.551 1.00 . A A . 13 MET CB 1 1 12 5139 1 1 13 MET CE C 0.272 -6.545 7.431 1.00 . A A . 13 MET CE 1 1 12 5140 1 1 13 MET CG C 1.377 -5.867 5.004 1.00 . A A . 13 MET CG 1 1 12 5141 1 1 13 MET H H 1.686 -7.875 2.981 1.00 . A A . 13 MET H 1 1 12 5142 1 1 13 MET HA H -0.658 -6.160 3.216 1.00 . A A . 13 MET HA 1 1 12 5143 1 1 13 MET HB2 H 2.223 -5.478 3.141 1.00 . A A . 13 MET HB2 1 1 12 5144 1 1 13 MET HB3 H 1.028 -4.435 3.533 1.00 . A A . 13 MET HB3 1 1 12 5145 1 1 13 MET HE1 H 1.117 -6.036 7.893 1.00 . A A . 13 MET HE1 1 1 12 5146 1 1 13 MET HE2 H -0.573 -6.542 8.119 1.00 . A A . 13 MET HE2 1 1 12 5147 1 1 13 MET HE3 H 0.549 -7.575 7.202 1.00 . A A . 13 MET HE3 1 1 12 5148 1 1 13 MET HG2 H 1.636 -6.833 5.009 1.00 . A A . 13 MET HG2 1 1 12 5149 1 1 13 MET HG3 H 2.075 -5.332 5.480 1.00 . A A . 13 MET HG3 1 1 12 5150 1 1 13 MET N N 0.735 -7.632 2.713 1.00 . A A . 13 MET N 1 1 12 5151 1 1 13 MET O O 0.604 -6.279 0.345 1.00 . A A . 13 MET O 1 1 12 5152 1 1 13 MET SD S -0.189 -5.691 5.901 1.00 . A A . 13 MET SD 1 1 12 5153 1 1 14 CYS C C -0.163 -2.412 -0.067 1.00 . A A . 14 CYS C 1 1 12 5154 1 1 14 CYS CA C -0.752 -3.832 -0.054 1.00 . A A . 14 CYS CA 1 1 12 5155 1 1 14 CYS CB C -2.279 -3.802 -0.192 1.00 . A A . 14 CYS CB 1 1 12 5156 1 1 14 CYS H H -0.745 -4.000 2.048 1.00 . A A . 14 CYS H 1 1 12 5157 1 1 14 CYS HA H -0.329 -4.395 -0.887 1.00 . A A . 14 CYS HA 1 1 12 5158 1 1 14 CYS HB2 H -2.610 -2.983 0.277 1.00 . A A . 14 CYS HB2 1 1 12 5159 1 1 14 CYS HB3 H -2.495 -3.739 -1.166 1.00 . A A . 14 CYS HB3 1 1 12 5160 1 1 14 CYS N N -0.430 -4.482 1.210 1.00 . A A . 14 CYS N 1 1 12 5161 1 1 14 CYS O O 0.226 -1.912 0.985 1.00 . A A . 14 CYS O 1 1 12 5162 1 1 14 CYS SG S -3.185 -5.234 0.485 1.00 . A A . 14 CYS SG 1 1 12 5163 1 1 15 CYS C C -0.558 0.613 -1.809 1.00 . A A . 15 CYS C 1 1 12 5164 1 1 15 CYS CA C 0.493 -0.423 -1.379 1.00 . A A . 15 CYS CA 1 1 12 5165 1 1 15 CYS CB C 1.631 -0.517 -2.401 1.00 . A A . 15 CYS CB 1 1 12 5166 1 1 15 CYS H H -0.508 -2.172 -2.055 1.00 . A A . 15 CYS H 1 1 12 5167 1 1 15 CYS HA H 0.919 -0.101 -0.429 1.00 . A A . 15 CYS HA 1 1 12 5168 1 1 15 CYS HB2 H 2.260 -1.237 -2.106 1.00 . A A . 15 CYS HB2 1 1 12 5169 1 1 15 CYS HB3 H 1.238 -0.760 -3.288 1.00 . A A . 15 CYS HB3 1 1 12 5170 1 1 15 CYS N N -0.110 -1.752 -1.229 1.00 . A A . 15 CYS N 1 1 12 5171 1 1 15 CYS O O -1.321 0.362 -2.740 1.00 . A A . 15 CYS O 1 1 12 5172 1 1 15 CYS SG S 2.574 1.018 -2.597 1.00 . A A . 15 CYS SG 1 1 12 5173 1 1 16 SER C C -1.382 3.715 -2.453 1.00 . A A . 16 SER C 1 1 12 5174 1 1 16 SER CA C -1.647 2.777 -1.289 1.00 . A A . 16 SER CA 1 1 12 5175 1 1 16 SER CB C -1.745 3.628 -0.011 1.00 . A A . 16 SER CB 1 1 12 5176 1 1 16 SER H H 0.127 1.970 -0.468 1.00 . A A . 16 SER H 1 1 12 5177 1 1 16 SER HA H -2.600 2.279 -1.462 1.00 . A A . 16 SER HA 1 1 12 5178 1 1 16 SER HB2 H -2.566 4.196 -0.070 1.00 . A A . 16 SER HB2 1 1 12 5179 1 1 16 SER HB3 H -1.820 3.013 0.774 1.00 . A A . 16 SER HB3 1 1 12 5180 1 1 16 SER HG H -0.728 4.832 1.089 1.00 . A A . 16 SER HG 1 1 12 5181 1 1 16 SER N N -0.607 1.766 -1.133 1.00 . A A . 16 SER N 1 1 12 5182 1 1 16 SER O O -0.240 3.944 -2.847 1.00 . A A . 16 SER O 1 1 12 5183 1 1 16 SER OG O -0.628 4.474 0.187 1.00 . A A . 16 SER OG 1 1 12 5184 1 1 17 GLN C C -1.601 6.748 -3.119 1.00 . A A . 17 GLN C 1 1 12 5185 1 1 17 GLN CA C -2.248 5.536 -3.811 1.00 . A A . 17 GLN CA 1 1 12 5186 1 1 17 GLN CB C -3.590 5.900 -4.456 1.00 . A A . 17 GLN CB 1 1 12 5187 1 1 17 GLN CD C -5.063 3.796 -4.352 1.00 . A A . 17 GLN CD 1 1 12 5188 1 1 17 GLN CG C -4.213 4.719 -5.221 1.00 . A A . 17 GLN CG 1 1 12 5189 1 1 17 GLN H H -3.375 4.206 -2.597 1.00 . A A . 17 GLN H 1 1 12 5190 1 1 17 GLN HA H -1.565 5.228 -4.603 1.00 . A A . 17 GLN HA 1 1 12 5191 1 1 17 GLN HB2 H -4.224 6.187 -3.738 1.00 . A A . 17 GLN HB2 1 1 12 5192 1 1 17 GLN HB3 H -3.445 6.655 -5.095 1.00 . A A . 17 GLN HB3 1 1 12 5193 1 1 17 GLN HE21 H -5.616 2.657 -5.933 1.00 . A A . 17 GLN HE21 1 1 12 5194 1 1 17 GLN HE22 H -6.344 2.238 -4.388 1.00 . A A . 17 GLN HE22 1 1 12 5195 1 1 17 GLN HG2 H -4.792 5.086 -5.949 1.00 . A A . 17 GLN HG2 1 1 12 5196 1 1 17 GLN HG3 H -3.473 4.179 -5.623 1.00 . A A . 17 GLN HG3 1 1 12 5197 1 1 17 GLN N N -2.429 4.410 -2.907 1.00 . A A . 17 GLN N 1 1 12 5198 1 1 17 GLN NE2 N -5.719 2.819 -4.946 1.00 . A A . 17 GLN NE2 1 1 12 5199 1 1 17 GLN O O -1.311 7.741 -3.777 1.00 . A A . 17 GLN O 1 1 12 5200 1 1 17 GLN OE1 O -5.217 3.984 -3.146 1.00 . A A . 17 GLN OE1 1 1 12 5201 1 1 18 . C C 0.990 7.129 -1.032 1.00 . A A . 18 PFF C 1 1 12 5202 1 1 18 . CA C -0.470 7.611 -1.103 1.00 . A A . 18 PFF CA 1 1 12 5203 1 1 18 . CB C -1.052 7.846 0.297 1.00 . A A . 18 PFF CB 1 1 12 5204 1 1 18 . CD1 C -2.664 9.703 -0.293 1.00 . A A . 18 PFF CD1 1 1 12 5205 1 1 18 . CD2 C -3.533 7.714 0.803 1.00 . A A . 18 PFF CD2 1 1 12 5206 1 1 18 . CE1 C -3.954 10.263 -0.300 1.00 . A A . 18 PFF CE1 1 1 12 5207 1 1 18 . CE2 C -4.816 8.290 0.829 1.00 . A A . 18 PFF CE2 1 1 12 5208 1 1 18 . CG C -2.443 8.445 0.292 1.00 . A A . 18 PFF CG 1 1 12 5209 1 1 18 . CZ C -5.017 9.584 0.315 1.00 . A A . 18 PFF CZ 1 1 12 5210 1 1 18 . F F -6.259 10.138 0.340 1.00 . A A . 18 PFF F 1 1 12 5211 1 1 18 . H H -1.568 5.823 -1.307 1.00 . A A . 18 PFF H 1 1 12 5212 1 1 18 . HA H -0.465 8.563 -1.635 1.00 . A A . 18 PFF HA 1 1 12 5213 1 1 18 . HB2 H -1.091 6.896 0.830 1.00 . A A . 18 PFF HB2 1 1 12 5214 1 1 18 . HB3 H -0.394 8.519 0.848 1.00 . A A . 18 PFF HB3 1 1 12 5215 1 1 18 . HD1 H -1.844 10.246 -0.739 1.00 . A A . 18 PFF HD1 1 1 12 5216 1 1 18 . HD2 H -3.385 6.708 1.165 1.00 . A A . 18 PFF HD2 1 1 12 5217 1 1 18 . HE1 H -4.114 11.236 -0.744 1.00 . A A . 18 PFF HE1 1 1 12 5218 1 1 18 . HE2 H -5.650 7.738 1.236 1.00 . A A . 18 PFF HE2 1 1 12 5219 1 1 18 . N N -1.322 6.662 -1.811 1.00 . A A . 18 PFF N 1 1 12 5220 1 1 18 . O O 1.843 7.846 -0.518 1.00 . A A . 18 PFF O 1 1 12 5221 1 1 19 GLY C C 3.133 4.654 -0.401 1.00 . A A . 19 GLY C 1 1 12 5222 1 1 19 GLY CA C 2.658 5.416 -1.637 1.00 . A A . 19 GLY CA 1 1 12 5223 1 1 19 GLY H H 0.561 5.353 -1.945 1.00 . A A . 19 GLY H 1 1 12 5224 1 1 19 GLY HA2 H 2.718 4.740 -2.490 1.00 . A A . 19 GLY HA2 1 1 12 5225 1 1 19 GLY HA3 H 3.348 6.242 -1.814 1.00 . A A . 19 GLY HA3 1 1 12 5226 1 1 19 GLY N N 1.296 5.931 -1.547 1.00 . A A . 19 GLY N 1 1 12 5227 1 1 19 GLY O O 4.283 4.227 -0.377 1.00 . A A . 19 GLY O 1 1 12 5228 1 1 20 . C C 2.001 2.320 1.789 1.00 . A A . 20 PFF C 1 1 12 5229 1 1 20 . CA C 2.650 3.699 1.819 1.00 . A A . 20 PFF CA 1 1 12 5230 1 1 20 . CB C 2.198 4.494 3.042 1.00 . A A . 20 PFF CB 1 1 12 5231 1 1 20 . CD1 C 2.461 6.959 2.515 1.00 . A A . 20 PFF CD1 1 1 12 5232 1 1 20 . CD2 C 4.123 5.881 3.927 1.00 . A A . 20 PFF CD2 1 1 12 5233 1 1 20 . CE1 C 3.138 8.182 2.646 1.00 . A A . 20 PFF CE1 1 1 12 5234 1 1 20 . CE2 C 4.805 7.104 4.053 1.00 . A A . 20 PFF CE2 1 1 12 5235 1 1 20 . CG C 2.926 5.816 3.189 1.00 . A A . 20 PFF CG 1 1 12 5236 1 1 20 . CZ C 4.306 8.257 3.423 1.00 . A A . 20 PFF CZ 1 1 12 5237 1 1 20 . F F 4.935 9.451 3.584 1.00 . A A . 20 PFF F 1 1 12 5238 1 1 20 . H H 1.310 4.671 0.500 1.00 . A A . 20 PFF H 1 1 12 5239 1 1 20 . HA H 3.730 3.556 1.878 1.00 . A A . 20 PFF HA 1 1 12 5240 1 1 20 . HB2 H 1.115 4.641 3.024 1.00 . A A . 20 PFF HB2 1 1 12 5241 1 1 20 . HB3 H 2.412 3.889 3.911 1.00 . A A . 20 PFF HB3 1 1 12 5242 1 1 20 . HD1 H 1.594 6.895 1.880 1.00 . A A . 20 PFF HD1 1 1 12 5243 1 1 20 . HD2 H 4.515 4.997 4.409 1.00 . A A . 20 PFF HD2 1 1 12 5244 1 1 20 . HE1 H 2.773 9.058 2.129 1.00 . A A . 20 PFF HE1 1 1 12 5245 1 1 20 . HE2 H 5.718 7.159 4.629 1.00 . A A . 20 PFF HE2 1 1 12 5246 1 1 20 . N N 2.292 4.447 0.616 1.00 . A A . 20 PFF N 1 1 12 5247 1 1 20 . O O 1.152 2.069 0.939 1.00 . A A . 20 PFF O 1 1 12 5248 1 1 21 CYS C C 1.046 -0.368 3.886 1.00 . A A . 21 CYS C 1 1 12 5249 1 1 21 CYS CA C 1.822 0.051 2.634 1.00 . A A . 21 CYS CA 1 1 12 5250 1 1 21 CYS CB C 2.946 -0.922 2.291 1.00 . A A . 21 CYS CB 1 1 12 5251 1 1 21 CYS H H 3.040 1.640 3.405 1.00 . A A . 21 CYS H 1 1 12 5252 1 1 21 CYS HA H 1.115 0.003 1.814 1.00 . A A . 21 CYS HA 1 1 12 5253 1 1 21 CYS HB2 H 2.527 -1.780 1.992 1.00 . A A . 21 CYS HB2 1 1 12 5254 1 1 21 CYS HB3 H 3.472 -0.528 1.538 1.00 . A A . 21 CYS HB3 1 1 12 5255 1 1 21 CYS N N 2.360 1.409 2.695 1.00 . A A . 21 CYS N 1 1 12 5256 1 1 21 CYS O O 1.329 0.086 4.992 1.00 . A A . 21 CYS O 1 1 12 5257 1 1 21 CYS SG S 4.098 -1.306 3.628 1.00 . A A . 21 CYS SG 1 1 12 5258 1 1 22 GLY C C -1.961 -2.543 4.114 1.00 . A A . 22 GLY C 1 1 12 5259 1 1 22 GLY CA C -0.862 -1.688 4.739 1.00 . A A . 22 GLY CA 1 1 12 5260 1 1 22 GLY H H -0.186 -1.517 2.741 1.00 . A A . 22 GLY H 1 1 12 5261 1 1 22 GLY HA2 H -0.312 -2.282 5.469 1.00 . A A . 22 GLY HA2 1 1 12 5262 1 1 22 GLY HA3 H -1.310 -0.825 5.235 1.00 . A A . 22 GLY HA3 1 1 12 5263 1 1 22 GLY N N 0.045 -1.232 3.694 1.00 . A A . 22 GLY N 1 1 12 5264 1 1 22 GLY O O -1.884 -2.870 2.930 1.00 . A A . 22 GLY O 1 1 12 5265 1 1 23 LYS C C -5.470 -3.028 4.426 1.00 . A A . 23 LYS C 1 1 12 5266 1 1 23 LYS CA C -4.108 -3.728 4.388 1.00 . A A . 23 LYS CA 1 1 12 5267 1 1 23 LYS CB C -4.095 -5.082 5.116 1.00 . A A . 23 LYS CB 1 1 12 5268 1 1 23 LYS CD C -4.820 -7.519 4.930 1.00 . A A . 23 LYS CD 1 1 12 5269 1 1 23 LYS CE C -3.618 -8.046 4.136 1.00 . A A . 23 LYS CE 1 1 12 5270 1 1 23 LYS CG C -5.159 -6.061 4.596 1.00 . A A . 23 LYS CG 1 1 12 5271 1 1 23 LYS H H -2.936 -2.693 5.874 1.00 . A A . 23 LYS H 1 1 12 5272 1 1 23 LYS HA H -3.945 -3.908 3.332 1.00 . A A . 23 LYS HA 1 1 12 5273 1 1 23 LYS HB2 H -3.194 -5.499 4.995 1.00 . A A . 23 LYS HB2 1 1 12 5274 1 1 23 LYS HB3 H -4.260 -4.921 6.089 1.00 . A A . 23 LYS HB3 1 1 12 5275 1 1 23 LYS HD2 H -4.611 -7.583 5.906 1.00 . A A . 23 LYS HD2 1 1 12 5276 1 1 23 LYS HD3 H -5.615 -8.088 4.721 1.00 . A A . 23 LYS HD3 1 1 12 5277 1 1 23 LYS HE2 H -2.830 -7.457 4.315 1.00 . A A . 23 LYS HE2 1 1 12 5278 1 1 23 LYS HE3 H -3.414 -8.977 4.440 1.00 . A A . 23 LYS HE3 1 1 12 5279 1 1 23 LYS HG2 H -6.038 -5.832 5.013 1.00 . A A . 23 LYS HG2 1 1 12 5280 1 1 23 LYS HG3 H -5.226 -5.966 3.603 1.00 . A A . 23 LYS HG3 1 1 12 5281 1 1 23 LYS HZ1 H -4.120 -7.144 2.343 1.00 . A A . 23 LYS HZ1 1 1 12 5282 1 1 23 LYS HZ2 H -3.025 -8.345 2.195 1.00 . A A . 23 LYS HZ2 1 1 12 5283 1 1 23 LYS HZ3 H -4.616 -8.715 2.448 1.00 . A A . 23 LYS HZ3 1 1 12 5284 1 1 23 LYS N N -2.987 -2.916 4.889 1.00 . A A . 23 LYS N 1 1 12 5285 1 1 23 LYS NZ N -3.877 -8.066 2.678 1.00 . A A . 23 LYS NZ 1 1 12 5286 1 1 23 LYS O O -6.469 -3.583 3.983 1.00 . A A . 23 LYS O 1 1 12 5287 1 1 24 GLY C C -7.291 -0.553 3.656 1.00 . A A . 24 GLY C 1 1 12 5288 1 1 24 GLY CA C -6.765 -1.042 5.012 1.00 . A A . 24 GLY CA 1 1 12 5289 1 1 24 GLY H H -4.625 -1.361 5.098 1.00 . A A . 24 GLY H 1 1 12 5290 1 1 24 GLY HA2 H -7.507 -1.694 5.472 1.00 . A A . 24 GLY HA2 1 1 12 5291 1 1 24 GLY HA3 H -6.612 -0.179 5.659 1.00 . A A . 24 GLY HA3 1 1 12 5292 1 1 24 GLY N N -5.511 -1.786 4.894 1.00 . A A . 24 GLY N 1 1 12 5293 1 1 24 GLY O O -6.541 -0.521 2.677 1.00 . A A . 24 GLY O 1 1 12 5294 1 1 25 PRO C C -8.401 1.497 1.642 1.00 . A A . 25 PRO C 1 1 12 5295 1 1 25 PRO CA C -9.186 0.400 2.366 1.00 . A A . 25 PRO CA 1 1 12 5296 1 1 25 PRO CB C -10.562 0.915 2.804 1.00 . A A . 25 PRO CB 1 1 12 5297 1 1 25 PRO CD C -9.518 -0.127 4.678 1.00 . A A . 25 PRO CD 1 1 12 5298 1 1 25 PRO CG C -10.883 0.044 4.014 1.00 . A A . 25 PRO CG 1 1 12 5299 1 1 25 PRO HA H -9.323 -0.442 1.688 1.00 . A A . 25 PRO HA 1 1 12 5300 1 1 25 PRO HB2 H -10.520 1.881 3.058 1.00 . A A . 25 PRO HB2 1 1 12 5301 1 1 25 PRO HB3 H -11.240 0.789 2.080 1.00 . A A . 25 PRO HB3 1 1 12 5302 1 1 25 PRO HD2 H -9.348 0.617 5.324 1.00 . A A . 25 PRO HD2 1 1 12 5303 1 1 25 PRO HD3 H -9.470 -1.003 5.158 1.00 . A A . 25 PRO HD3 1 1 12 5304 1 1 25 PRO HG2 H -11.527 0.502 4.627 1.00 . A A . 25 PRO HG2 1 1 12 5305 1 1 25 PRO HG3 H -11.260 -0.839 3.733 1.00 . A A . 25 PRO HG3 1 1 12 5306 1 1 25 PRO N N -8.552 -0.088 3.591 1.00 . A A . 25 PRO N 1 1 12 5307 1 1 25 PRO O O -8.419 1.582 0.413 1.00 . A A . 25 PRO O 1 1 12 5308 1 1 26 LYS C C -5.476 2.805 1.238 1.00 . A A . 26 LYS C 1 1 12 5309 1 1 26 LYS CA C -6.797 3.351 1.789 1.00 . A A . 26 LYS CA 1 1 12 5310 1 1 26 LYS CB C -6.556 4.475 2.800 1.00 . A A . 26 LYS CB 1 1 12 5311 1 1 26 LYS CD C -7.452 6.559 3.876 1.00 . A A . 26 LYS CD 1 1 12 5312 1 1 26 LYS CE C -8.493 7.670 3.716 1.00 . A A . 26 LYS CE 1 1 12 5313 1 1 26 LYS CG C -7.784 5.378 2.957 1.00 . A A . 26 LYS CG 1 1 12 5314 1 1 26 LYS H H -7.703 2.261 3.386 1.00 . A A . 26 LYS H 1 1 12 5315 1 1 26 LYS HA H -7.309 3.785 0.934 1.00 . A A . 26 LYS HA 1 1 12 5316 1 1 26 LYS HB2 H -6.338 4.069 3.688 1.00 . A A . 26 LYS HB2 1 1 12 5317 1 1 26 LYS HB3 H -5.785 5.030 2.488 1.00 . A A . 26 LYS HB3 1 1 12 5318 1 1 26 LYS HD2 H -7.448 6.246 4.826 1.00 . A A . 26 LYS HD2 1 1 12 5319 1 1 26 LYS HD3 H -6.549 6.917 3.639 1.00 . A A . 26 LYS HD3 1 1 12 5320 1 1 26 LYS HE2 H -8.530 7.948 2.756 1.00 . A A . 26 LYS HE2 1 1 12 5321 1 1 26 LYS HE3 H -9.388 7.323 3.998 1.00 . A A . 26 LYS HE3 1 1 12 5322 1 1 26 LYS HG2 H -8.058 5.724 2.059 1.00 . A A . 26 LYS HG2 1 1 12 5323 1 1 26 LYS HG3 H -8.535 4.850 3.354 1.00 . A A . 26 LYS HG3 1 1 12 5324 1 1 26 LYS HZ1 H -7.166 9.086 4.411 1.00 . A A . 26 LYS HZ1 1 1 12 5325 1 1 26 LYS HZ2 H -8.683 9.663 4.271 1.00 . A A . 26 LYS HZ2 1 1 12 5326 1 1 26 LYS HZ3 H -8.287 8.660 5.529 1.00 . A A . 26 LYS HZ3 1 1 12 5327 1 1 26 LYS N N -7.656 2.328 2.380 1.00 . A A . 26 LYS N 1 1 12 5328 1 1 26 LYS NZ N -8.144 8.843 4.547 1.00 . A A . 26 LYS NZ 1 1 12 5329 1 1 26 LYS O O -4.804 3.511 0.495 1.00 . A A . 26 LYS O 1 1 12 5330 1 1 27 TYR C C -4.261 -0.160 -0.038 1.00 . A A . 27 TYR C 1 1 12 5331 1 1 27 TYR CA C -3.931 0.908 0.992 1.00 . A A . 27 TYR CA 1 1 12 5332 1 1 27 TYR CB C -3.105 0.272 2.114 1.00 . A A . 27 TYR CB 1 1 12 5333 1 1 27 TYR CD1 C -3.430 1.685 4.200 1.00 . A A . 27 TYR CD1 1 1 12 5334 1 1 27 TYR CD2 C -1.255 1.661 3.132 1.00 . A A . 27 TYR CD2 1 1 12 5335 1 1 27 TYR CE1 C -2.880 2.386 5.288 1.00 . A A . 27 TYR CE1 1 1 12 5336 1 1 27 TYR CE2 C -0.717 2.402 4.203 1.00 . A A . 27 TYR CE2 1 1 12 5337 1 1 27 TYR CG C -2.594 1.240 3.163 1.00 . A A . 27 TYR CG 1 1 12 5338 1 1 27 TYR CZ C -1.527 2.733 5.296 1.00 . A A . 27 TYR CZ 1 1 12 5339 1 1 27 TYR H H -5.755 0.991 2.091 1.00 . A A . 27 TYR H 1 1 12 5340 1 1 27 TYR HA H -3.313 1.641 0.490 1.00 . A A . 27 TYR HA 1 1 12 5341 1 1 27 TYR HB2 H -3.677 -0.408 2.572 1.00 . A A . 27 TYR HB2 1 1 12 5342 1 1 27 TYR HB3 H -2.316 -0.181 1.699 1.00 . A A . 27 TYR HB3 1 1 12 5343 1 1 27 TYR HD1 H -4.494 1.553 4.125 1.00 . A A . 27 TYR HD1 1 1 12 5344 1 1 27 TYR HD2 H -0.645 1.387 2.290 1.00 . A A . 27 TYR HD2 1 1 12 5345 1 1 27 TYR HE1 H -3.486 2.765 6.089 1.00 . A A . 27 TYR HE1 1 1 12 5346 1 1 27 TYR HE2 H 0.324 2.681 4.215 1.00 . A A . 27 TYR HE2 1 1 12 5347 1 1 27 TYR HH H -0.210 3.924 6.112 1.00 . A A . 27 TYR HH 1 1 12 5348 1 1 27 TYR N N -5.133 1.548 1.520 1.00 . A A . 27 TYR N 1 1 12 5349 1 1 27 TYR O O -3.693 -0.177 -1.123 1.00 . A A . 27 TYR O 1 1 12 5350 1 1 27 TYR OH O -1.063 3.510 6.309 1.00 . A A . 27 TYR OH 1 1 12 5351 1 1 28 CYS C C -6.156 -2.178 -1.697 1.00 . A A . 28 CYS C 1 1 12 5352 1 1 28 CYS CA C -5.263 -2.321 -0.463 1.00 . A A . 28 CYS CA 1 1 12 5353 1 1 28 CYS CB C -5.646 -3.445 0.490 1.00 . A A . 28 CYS CB 1 1 12 5354 1 1 28 CYS H H -5.654 -1.011 1.166 1.00 . A A . 28 CYS H 1 1 12 5355 1 1 28 CYS HA H -4.281 -2.553 -0.858 1.00 . A A . 28 CYS HA 1 1 12 5356 1 1 28 CYS HB2 H -5.205 -3.288 1.374 1.00 . A A . 28 CYS HB2 1 1 12 5357 1 1 28 CYS HB3 H -6.639 -3.448 0.608 1.00 . A A . 28 CYS HB3 1 1 12 5358 1 1 28 CYS N N -5.157 -1.086 0.288 1.00 . A A . 28 CYS N 1 1 12 5359 1 1 28 CYS O O -7.240 -2.753 -1.797 1.00 . A A . 28 CYS O 1 1 12 5360 1 1 28 CYS SG S -5.122 -5.054 -0.154 1.00 . A A . 28 CYS SG 1 1 12 5361 1 1 29 GLY C C -7.583 -0.119 -3.543 1.00 . A A . 29 GLY C 1 1 12 5362 1 1 29 GLY CA C -6.382 -0.998 -3.866 1.00 . A A . 29 GLY CA 1 1 12 5363 1 1 29 GLY H H -4.831 -0.861 -2.376 1.00 . A A . 29 GLY H 1 1 12 5364 1 1 29 GLY HA2 H -5.706 -0.448 -4.521 1.00 . A A . 29 GLY HA2 1 1 12 5365 1 1 29 GLY HA3 H -6.719 -1.900 -4.378 1.00 . A A . 29 GLY HA3 1 1 12 5366 1 1 29 GLY N N -5.684 -1.355 -2.632 1.00 . A A . 29 GLY N 1 1 12 5367 1 1 29 GLY O O -7.539 1.093 -3.759 1.00 . A A . 29 GLY O 1 1 12 5368 1 1 30 ARG C C -10.233 -0.853 -1.006 1.00 . A A . 30 ARG C 1 1 12 5369 1 1 30 ARG CA C -9.621 -0.023 -2.147 1.00 . A A . 30 ARG CA 1 1 12 5370 1 1 30 ARG CB C -10.684 0.606 -3.069 1.00 . A A . 30 ARG CB 1 1 12 5371 1 1 30 ARG CD C -10.550 3.142 -2.577 1.00 . A A . 30 ARG CD 1 1 12 5372 1 1 30 ARG CG C -11.382 1.852 -2.486 1.00 . A A . 30 ARG CG 1 1 12 5373 1 1 30 ARG CZ C -8.144 3.513 -2.057 1.00 . A A . 30 ARG CZ 1 1 12 5374 1 1 30 ARG H H -8.465 -1.724 -2.787 1.00 . A A . 30 ARG H 1 1 12 5375 1 1 30 ARG HA H -9.092 0.773 -1.652 1.00 . A A . 30 ARG HA 1 1 12 5376 1 1 30 ARG HB2 H -10.238 0.870 -3.924 1.00 . A A . 30 ARG HB2 1 1 12 5377 1 1 30 ARG HB3 H -11.383 -0.084 -3.256 1.00 . A A . 30 ARG HB3 1 1 12 5378 1 1 30 ARG HD2 H -10.256 3.267 -3.525 1.00 . A A . 30 ARG HD2 1 1 12 5379 1 1 30 ARG HD3 H -11.123 3.913 -2.300 1.00 . A A . 30 ARG HD3 1 1 12 5380 1 1 30 ARG HE H -9.386 2.547 -0.867 1.00 . A A . 30 ARG HE 1 1 12 5381 1 1 30 ARG HG2 H -12.237 1.995 -2.985 1.00 . A A . 30 ARG HG2 1 1 12 5382 1 1 30 ARG HG3 H -11.583 1.676 -1.522 1.00 . A A . 30 ARG HG3 1 1 12 5383 1 1 30 ARG HH11 H -8.695 4.786 -3.503 1.00 . A A . 30 ARG HH11 1 1 12 5384 1 1 30 ARG HH12 H -6.990 4.663 -3.224 1.00 . A A . 30 ARG HH12 1 1 12 5385 1 1 30 ARG HH21 H -7.217 2.359 -0.708 1.00 . A A . 30 ARG HH21 1 1 12 5386 1 1 30 ARG HH22 H -6.183 3.336 -1.696 1.00 . A A . 30 ARG HH22 1 1 12 5387 1 1 30 ARG N N -8.604 -0.728 -2.931 1.00 . A A . 30 ARG N 1 1 12 5388 1 1 30 ARG NE N -9.357 3.108 -1.714 1.00 . A A . 30 ARG NE 1 1 12 5389 1 1 30 ARG NH1 N -7.926 4.389 -3.002 1.00 . A A . 30 ARG NH1 1 1 12 5390 1 1 30 ARG NH2 N -7.100 3.032 -1.439 1.00 . A A . 30 ARG NH2 1 1 12 5391 1 1 30 ARG O O -11.134 -0.389 -0.323 1.00 . A A . 30 ARG O 1 1 12 5392 1 1 31 NH2 HN1 H -8.952 -2.444 -1.223 1.00 . A A . 31 NH2 HN1 1 1 12 5393 1 1 31 NH2 HN2 H -10.196 -2.576 0.004 1.00 . A A . 31 NH2 HN2 1 1 12 5394 1 1 31 NH2 N N -9.756 -2.063 -0.742 1.00 . A A . 31 NH2 N 1 1 12 5395 2 2 1 NAG C1 C -7.577 15.157 1.986 1.00 . B A . 32 NAG C1 1 1 12 5396 2 2 1 NAG C2 C -7.671 13.689 2.380 1.00 . B A . 32 NAG C2 1 1 12 5397 2 2 1 NAG C3 C -6.314 13.234 2.962 1.00 . B A . 32 NAG C3 1 1 12 5398 2 2 1 NAG C4 C -5.105 13.686 2.107 1.00 . B A . 32 NAG C4 1 1 12 5399 2 2 1 NAG C5 C -5.251 15.177 1.776 1.00 . B A . 32 NAG C5 1 1 12 5400 2 2 1 NAG C6 C -4.090 15.654 0.880 1.00 . B A . 32 NAG C6 1 1 12 5401 2 2 1 NAG C7 C -9.359 12.434 3.826 1.00 . B A . 32 NAG C7 1 1 12 5402 2 2 1 NAG C8 C -10.618 12.638 4.607 1.00 . B A . 32 NAG C8 1 1 12 5403 2 2 1 NAG H1 H -7.520 15.799 2.867 1.00 . B A . 32 NAG H1 1 1 12 5404 2 2 1 NAG H2 H -7.839 13.141 1.449 1.00 . B A . 32 NAG H2 1 1 12 5405 2 2 1 NAG H3 H -6.210 13.632 3.972 1.00 . B A . 32 NAG H3 1 1 12 5406 2 2 1 NAG H4 H -5.125 13.142 1.161 1.00 . B A . 32 NAG H4 1 1 12 5407 2 2 1 NAG H5 H -5.225 15.762 2.697 1.00 . B A . 32 NAG H5 1 1 12 5408 2 2 1 NAG H61 H -4.298 16.666 0.531 1.00 . B A . 32 NAG H61 1 1 12 5409 2 2 1 NAG H62 H -4.003 14.997 0.013 1.00 . B A . 32 NAG H62 1 1 12 5410 2 2 1 NAG H81 H -10.407 13.279 5.459 1.00 . B A . 32 NAG H81 1 1 12 5411 2 2 1 NAG H82 H -11.370 13.088 3.963 1.00 . B A . 32 NAG H82 1 1 12 5412 2 2 1 NAG H83 H -10.969 11.669 4.954 1.00 . B A . 32 NAG H83 1 1 12 5413 2 2 1 NAG HN2 H -9.384 14.355 3.462 1.00 . B A . 32 NAG HN2 1 1 12 5414 2 2 1 NAG HO1 H -8.328 16.005 0.509 1.00 . B A . 32 NAG HO1 1 1 12 5415 2 2 1 NAG HO3 H -7.281 11.577 3.128 1.00 . B A . 32 NAG HO3 1 1 12 5416 2 2 1 NAG HO4 H 3.102 7.567 7.736 1.00 . B A . 32 NAG HO4 1 1 12 5417 2 2 1 NAG HO6 H -2.785 14.850 2.077 1.00 . B A . 32 NAG HO6 1 1 12 5418 2 2 1 NAG N2 N -8.820 13.531 3.308 1.00 . B A . 32 NAG N2 1 1 12 5419 2 2 1 NAG O1 O -8.678 15.497 1.246 1.00 . B A . 32 NAG O1 1 1 12 5420 2 2 1 NAG O3 O -6.353 11.821 3.008 1.00 . B A . 32 NAG O3 1 1 12 5421 2 2 1 NAG O4 O -3.812 13.516 2.754 1.00 . B A . 32 NAG O4 1 1 12 5422 2 2 1 NAG O5 O -6.487 15.385 1.122 1.00 . B A . 32 NAG O5 1 1 12 5423 2 2 1 NAG O6 O -2.855 15.679 1.577 1.00 . B A . 32 NAG O6 1 1 12 5424 2 2 1 NAG O7 O -8.874 11.312 3.709 1.00 . B A . 32 NAG O7 1 1 13 5425 1 1 1 VAL C C 6.067 5.118 7.495 1.00 . A A . 1 VAL C 1 1 13 5426 1 1 1 VAL CA C 7.263 6.023 7.719 1.00 . A A . 1 VAL CA 1 1 13 5427 1 1 1 VAL CB C 7.782 5.905 9.157 1.00 . A A . 1 VAL CB 1 1 13 5428 1 1 1 VAL CG1 C 9.162 6.559 9.256 1.00 . A A . 1 VAL CG1 1 1 13 5429 1 1 1 VAL CG2 C 6.858 6.547 10.197 1.00 . A A . 1 VAL CG2 1 1 13 5430 1 1 1 VAL H1 H 7.617 8.052 7.625 1.00 . A A . 1 VAL H1 1 1 13 5431 1 1 1 VAL H2 H 6.005 7.636 7.753 1.00 . A A . 1 VAL H2 1 1 13 5432 1 1 1 VAL H3 H 6.827 7.428 6.328 1.00 . A A . 1 VAL H3 1 1 13 5433 1 1 1 VAL HA H 8.059 5.689 7.050 1.00 . A A . 1 VAL HA 1 1 13 5434 1 1 1 VAL HB H 7.896 4.848 9.395 1.00 . A A . 1 VAL HB 1 1 13 5435 1 1 1 VAL HG11 H 9.580 6.364 10.244 1.00 . A A . 1 VAL HG11 1 1 13 5436 1 1 1 VAL HG12 H 9.829 6.128 8.508 1.00 . A A . 1 VAL HG12 1 1 13 5437 1 1 1 VAL HG13 H 9.103 7.637 9.111 1.00 . A A . 1 VAL HG13 1 1 13 5438 1 1 1 VAL HG21 H 5.870 6.088 10.169 1.00 . A A . 1 VAL HG21 1 1 13 5439 1 1 1 VAL HG22 H 7.278 6.383 11.190 1.00 . A A . 1 VAL HG22 1 1 13 5440 1 1 1 VAL HG23 H 6.764 7.621 10.039 1.00 . A A . 1 VAL HG23 1 1 13 5441 1 1 1 VAL N N 6.899 7.402 7.346 1.00 . A A . 1 VAL N 1 1 13 5442 1 1 1 VAL O O 4.957 5.506 7.842 1.00 . A A . 1 VAL O 1 1 13 5443 1 1 2 GLY C C 5.161 2.776 4.973 1.00 . A A . 2 GLY C 1 1 13 5444 1 1 2 GLY CA C 5.246 3.002 6.488 1.00 . A A . 2 GLY CA 1 1 13 5445 1 1 2 GLY H H 7.220 3.892 6.462 1.00 . A A . 2 GLY H 1 1 13 5446 1 1 2 GLY HA2 H 5.450 2.042 6.961 1.00 . A A . 2 GLY HA2 1 1 13 5447 1 1 2 GLY HA3 H 4.273 3.349 6.834 1.00 . A A . 2 GLY HA3 1 1 13 5448 1 1 2 GLY N N 6.290 3.958 6.881 1.00 . A A . 2 GLY N 1 1 13 5449 1 1 2 GLY O O 4.100 2.425 4.460 1.00 . A A . 2 GLY O 1 1 13 5450 1 1 3 GLU C C 6.382 1.731 2.144 1.00 . A A . 3 GLU C 1 1 13 5451 1 1 3 GLU CA C 6.294 3.122 2.793 1.00 . A A . 3 GLU CA 1 1 13 5452 1 1 3 GLU CB C 7.520 3.968 2.401 1.00 . A A . 3 GLU CB 1 1 13 5453 1 1 3 GLU CD C 7.666 5.610 4.422 1.00 . A A . 3 GLU CD 1 1 13 5454 1 1 3 GLU CG C 7.480 5.424 2.905 1.00 . A A . 3 GLU CG 1 1 13 5455 1 1 3 GLU H H 7.093 3.354 4.707 1.00 . A A . 3 GLU H 1 1 13 5456 1 1 3 GLU HA H 5.401 3.624 2.429 1.00 . A A . 3 GLU HA 1 1 13 5457 1 1 3 GLU HB2 H 8.336 3.529 2.778 1.00 . A A . 3 GLU HB2 1 1 13 5458 1 1 3 GLU HB3 H 7.582 3.985 1.403 1.00 . A A . 3 GLU HB3 1 1 13 5459 1 1 3 GLU HG2 H 8.208 5.930 2.442 1.00 . A A . 3 GLU HG2 1 1 13 5460 1 1 3 GLU HG3 H 6.593 5.812 2.654 1.00 . A A . 3 GLU HG3 1 1 13 5461 1 1 3 GLU N N 6.240 3.049 4.242 1.00 . A A . 3 GLU N 1 1 13 5462 1 1 3 GLU O O 6.673 0.735 2.805 1.00 . A A . 3 GLU O 1 1 13 5463 1 1 3 GLU OE1 O 8.091 4.657 5.125 1.00 . A A . 3 GLU OE1 1 1 13 5464 1 1 3 GLU OE2 O 7.321 6.703 4.925 1.00 . A A . 3 GLU OE2 1 1 13 5465 1 1 4 CYS C C 7.596 0.533 -0.876 1.00 . A A . 4 CYS C 1 1 13 5466 1 1 4 CYS CA C 6.387 0.441 0.057 1.00 . A A . 4 CYS CA 1 1 13 5467 1 1 4 CYS CB C 5.141 0.122 -0.770 1.00 . A A . 4 CYS CB 1 1 13 5468 1 1 4 CYS H H 5.861 2.500 0.352 1.00 . A A . 4 CYS H 1 1 13 5469 1 1 4 CYS HA H 6.555 -0.396 0.736 1.00 . A A . 4 CYS HA 1 1 13 5470 1 1 4 CYS HB2 H 4.936 0.916 -1.343 1.00 . A A . 4 CYS HB2 1 1 13 5471 1 1 4 CYS HB3 H 5.347 -0.665 -1.352 1.00 . A A . 4 CYS HB3 1 1 13 5472 1 1 4 CYS N N 6.181 1.661 0.827 1.00 . A A . 4 CYS N 1 1 13 5473 1 1 4 CYS O O 7.981 1.589 -1.378 1.00 . A A . 4 CYS O 1 1 13 5474 1 1 4 CYS SG S 3.666 -0.267 0.199 1.00 . A A . 4 CYS SG 1 1 13 5475 1 1 5 VAL C C 8.705 -0.651 -3.562 1.00 . A A . 5 VAL C 1 1 13 5476 1 1 5 VAL CA C 9.232 -0.832 -2.146 1.00 . A A . 5 VAL CA 1 1 13 5477 1 1 5 VAL CB C 9.875 -2.214 -1.935 1.00 . A A . 5 VAL CB 1 1 13 5478 1 1 5 VAL CG1 C 11.119 -2.383 -2.814 1.00 . A A . 5 VAL CG1 1 1 13 5479 1 1 5 VAL CG2 C 10.315 -2.384 -0.478 1.00 . A A . 5 VAL CG2 1 1 13 5480 1 1 5 VAL H H 7.618 -1.453 -0.907 1.00 . A A . 5 VAL H 1 1 13 5481 1 1 5 VAL HA H 9.990 -0.071 -1.958 1.00 . A A . 5 VAL HA 1 1 13 5482 1 1 5 VAL HB H 9.155 -3.000 -2.167 1.00 . A A . 5 VAL HB 1 1 13 5483 1 1 5 VAL HG11 H 11.838 -1.590 -2.602 1.00 . A A . 5 VAL HG11 1 1 13 5484 1 1 5 VAL HG12 H 11.584 -3.347 -2.606 1.00 . A A . 5 VAL HG12 1 1 13 5485 1 1 5 VAL HG13 H 10.853 -2.356 -3.869 1.00 . A A . 5 VAL HG13 1 1 13 5486 1 1 5 VAL HG21 H 10.823 -3.340 -0.356 1.00 . A A . 5 VAL HG21 1 1 13 5487 1 1 5 VAL HG22 H 10.995 -1.580 -0.197 1.00 . A A . 5 VAL HG22 1 1 13 5488 1 1 5 VAL HG23 H 9.451 -2.370 0.186 1.00 . A A . 5 VAL HG23 1 1 13 5489 1 1 5 VAL N N 8.121 -0.636 -1.224 1.00 . A A . 5 VAL N 1 1 13 5490 1 1 5 VAL O O 8.428 -1.619 -4.270 1.00 . A A . 5 VAL O 1 1 13 5491 1 1 6 ARG C C 6.778 0.248 -5.731 1.00 . A A . 6 ARG C 1 1 13 5492 1 1 6 ARG CA C 7.992 1.043 -5.260 1.00 . A A . 6 ARG CA 1 1 13 5493 1 1 6 ARG CB C 9.137 1.163 -6.293 1.00 . A A . 6 ARG CB 1 1 13 5494 1 1 6 ARG CD C 9.563 -1.262 -7.137 1.00 . A A . 6 ARG CD 1 1 13 5495 1 1 6 ARG CG C 10.115 -0.018 -6.426 1.00 . A A . 6 ARG CG 1 1 13 5496 1 1 6 ARG CZ C 8.941 -0.944 -9.564 1.00 . A A . 6 ARG CZ 1 1 13 5497 1 1 6 ARG H H 8.513 1.292 -3.184 1.00 . A A . 6 ARG H 1 1 13 5498 1 1 6 ARG HA H 7.585 2.043 -5.120 1.00 . A A . 6 ARG HA 1 1 13 5499 1 1 6 ARG HB2 H 8.716 1.303 -7.189 1.00 . A A . 6 ARG HB2 1 1 13 5500 1 1 6 ARG HB3 H 9.676 1.969 -6.048 1.00 . A A . 6 ARG HB3 1 1 13 5501 1 1 6 ARG HD2 H 10.010 -2.074 -6.762 1.00 . A A . 6 ARG HD2 1 1 13 5502 1 1 6 ARG HD3 H 8.578 -1.317 -6.974 1.00 . A A . 6 ARG HD3 1 1 13 5503 1 1 6 ARG HE H 10.736 -1.452 -8.884 1.00 . A A . 6 ARG HE 1 1 13 5504 1 1 6 ARG HG2 H 10.913 0.300 -6.938 1.00 . A A . 6 ARG HG2 1 1 13 5505 1 1 6 ARG HG3 H 10.396 -0.290 -5.505 1.00 . A A . 6 ARG HG3 1 1 13 5506 1 1 6 ARG HH11 H 7.366 -0.528 -8.393 1.00 . A A . 6 ARG HH11 1 1 13 5507 1 1 6 ARG HH12 H 7.084 -0.404 -10.097 1.00 . A A . 6 ARG HH12 1 1 13 5508 1 1 6 ARG HH21 H 10.265 -1.275 -11.039 1.00 . A A . 6 ARG HH21 1 1 13 5509 1 1 6 ARG HH22 H 8.677 -0.814 -11.552 1.00 . A A . 6 ARG HH22 1 1 13 5510 1 1 6 ARG N N 8.485 0.613 -3.943 1.00 . A A . 6 ARG N 1 1 13 5511 1 1 6 ARG NE N 9.804 -1.214 -8.592 1.00 . A A . 6 ARG NE 1 1 13 5512 1 1 6 ARG NH1 N 7.699 -0.598 -9.333 1.00 . A A . 6 ARG NH1 1 1 13 5513 1 1 6 ARG NH2 N 9.325 -1.017 -10.818 1.00 . A A . 6 ARG NH2 1 1 13 5514 1 1 6 ARG O O 6.595 0.001 -6.919 1.00 . A A . 6 ARG O 1 1 13 5515 1 1 7 GLY C C 4.363 -2.029 -4.176 1.00 . A A . 7 GLY C 1 1 13 5516 1 1 7 GLY CA C 4.655 -0.776 -5.006 1.00 . A A . 7 GLY CA 1 1 13 5517 1 1 7 GLY H H 6.210 0.214 -3.853 1.00 . A A . 7 GLY H 1 1 13 5518 1 1 7 GLY HA2 H 3.865 -0.055 -4.801 1.00 . A A . 7 GLY HA2 1 1 13 5519 1 1 7 GLY HA3 H 4.574 -1.059 -6.056 1.00 . A A . 7 GLY HA3 1 1 13 5520 1 1 7 GLY N N 5.946 -0.131 -4.764 1.00 . A A . 7 GLY N 1 1 13 5521 1 1 7 GLY O O 3.207 -2.449 -4.153 1.00 . A A . 7 GLY O 1 1 13 5522 1 1 8 ARG C C 5.560 -3.512 -1.149 1.00 . A A . 8 ARG C 1 1 13 5523 1 1 8 ARG CA C 5.035 -3.739 -2.556 1.00 . A A . 8 ARG CA 1 1 13 5524 1 1 8 ARG CB C 5.606 -5.056 -3.103 1.00 . A A . 8 ARG CB 1 1 13 5525 1 1 8 ARG CD C 3.274 -6.237 -3.042 1.00 . A A . 8 ARG CD 1 1 13 5526 1 1 8 ARG CG C 4.572 -5.939 -3.815 1.00 . A A . 8 ARG CG 1 1 13 5527 1 1 8 ARG CZ C 2.494 -7.185 -0.878 1.00 . A A . 8 ARG CZ 1 1 13 5528 1 1 8 ARG H H 6.299 -2.311 -3.533 1.00 . A A . 8 ARG H 1 1 13 5529 1 1 8 ARG HA H 3.957 -3.829 -2.457 1.00 . A A . 8 ARG HA 1 1 13 5530 1 1 8 ARG HB2 H 6.333 -4.837 -3.754 1.00 . A A . 8 ARG HB2 1 1 13 5531 1 1 8 ARG HB3 H 5.988 -5.574 -2.338 1.00 . A A . 8 ARG HB3 1 1 13 5532 1 1 8 ARG HD2 H 2.744 -5.391 -2.986 1.00 . A A . 8 ARG HD2 1 1 13 5533 1 1 8 ARG HD3 H 2.757 -6.921 -3.556 1.00 . A A . 8 ARG HD3 1 1 13 5534 1 1 8 ARG HE H 4.400 -6.807 -1.258 1.00 . A A . 8 ARG HE 1 1 13 5535 1 1 8 ARG HG2 H 4.319 -5.483 -4.668 1.00 . A A . 8 ARG HG2 1 1 13 5536 1 1 8 ARG HG3 H 5.010 -6.814 -4.021 1.00 . A A . 8 ARG HG3 1 1 13 5537 1 1 8 ARG HH11 H 1.002 -6.851 -2.176 1.00 . A A . 8 ARG HH11 1 1 13 5538 1 1 8 ARG HH12 H 0.530 -7.521 -0.650 1.00 . A A . 8 ARG HH12 1 1 13 5539 1 1 8 ARG HH21 H 3.704 -7.596 0.664 1.00 . A A . 8 ARG HH21 1 1 13 5540 1 1 8 ARG HH22 H 2.025 -7.933 0.920 1.00 . A A . 8 ARG HH22 1 1 13 5541 1 1 8 ARG N N 5.336 -2.625 -3.465 1.00 . A A . 8 ARG N 1 1 13 5542 1 1 8 ARG NE N 3.471 -6.747 -1.667 1.00 . A A . 8 ARG NE 1 1 13 5543 1 1 8 ARG NH1 N 1.244 -7.186 -1.265 1.00 . A A . 8 ARG NH1 1 1 13 5544 1 1 8 ARG NH2 N 2.762 -7.604 0.330 1.00 . A A . 8 ARG NH2 1 1 13 5545 1 1 8 ARG O O 6.539 -2.815 -0.929 1.00 . A A . 8 ARG O 1 1 13 5546 1 1 9 CYS C C 5.587 -5.803 1.430 1.00 . A A . 9 CYS C 1 1 13 5547 1 1 9 CYS CA C 5.329 -4.308 1.183 1.00 . A A . 9 CYS CA 1 1 13 5548 1 1 9 CYS CB C 4.152 -3.761 1.998 1.00 . A A . 9 CYS CB 1 1 13 5549 1 1 9 CYS H H 4.135 -4.744 -0.494 1.00 . A A . 9 CYS H 1 1 13 5550 1 1 9 CYS HA H 6.231 -3.724 1.377 1.00 . A A . 9 CYS HA 1 1 13 5551 1 1 9 CYS HB2 H 3.843 -2.926 1.543 1.00 . A A . 9 CYS HB2 1 1 13 5552 1 1 9 CYS HB3 H 3.426 -4.448 1.963 1.00 . A A . 9 CYS HB3 1 1 13 5553 1 1 9 CYS N N 4.917 -4.180 -0.204 1.00 . A A . 9 CYS N 1 1 13 5554 1 1 9 CYS O O 5.206 -6.617 0.576 1.00 . A A . 9 CYS O 1 1 13 5555 1 1 9 CYS SG S 4.408 -3.352 3.735 1.00 . A A . 9 CYS SG 1 1 13 5556 1 1 10 PRO C C 4.747 -8.093 3.309 1.00 . A A . 10 PRO C 1 1 13 5557 1 1 10 PRO CA C 6.165 -7.623 2.950 1.00 . A A . 10 PRO CA 1 1 13 5558 1 1 10 PRO CB C 7.109 -7.720 4.157 1.00 . A A . 10 PRO CB 1 1 13 5559 1 1 10 PRO CD C 7.012 -5.446 3.454 1.00 . A A . 10 PRO CD 1 1 13 5560 1 1 10 PRO CG C 7.983 -6.468 4.040 1.00 . A A . 10 PRO CG 1 1 13 5561 1 1 10 PRO HA H 6.557 -8.230 2.133 1.00 . A A . 10 PRO HA 1 1 13 5562 1 1 10 PRO HB2 H 6.593 -7.715 5.014 1.00 . A A . 10 PRO HB2 1 1 13 5563 1 1 10 PRO HB3 H 7.666 -8.549 4.107 1.00 . A A . 10 PRO HB3 1 1 13 5564 1 1 10 PRO HD2 H 6.461 -5.027 4.175 1.00 . A A . 10 PRO HD2 1 1 13 5565 1 1 10 PRO HD3 H 7.505 -4.734 2.954 1.00 . A A . 10 PRO HD3 1 1 13 5566 1 1 10 PRO HG2 H 8.319 -6.176 4.936 1.00 . A A . 10 PRO HG2 1 1 13 5567 1 1 10 PRO HG3 H 8.758 -6.624 3.427 1.00 . A A . 10 PRO HG3 1 1 13 5568 1 1 10 PRO N N 6.180 -6.222 2.556 1.00 . A A . 10 PRO N 1 1 13 5569 1 1 10 PRO O O 3.820 -7.290 3.395 1.00 . A A . 10 PRO O 1 1 13 5570 1 1 11 SER C C 2.074 -9.739 3.445 1.00 . A A . 11 SER C 1 1 13 5571 1 1 11 SER CA C 3.400 -9.983 4.185 1.00 . A A . 11 SER CA 1 1 13 5572 1 1 11 SER CB C 3.319 -9.507 5.639 1.00 . A A . 11 SER CB 1 1 13 5573 1 1 11 SER H H 5.413 -9.977 3.497 1.00 . A A . 11 SER H 1 1 13 5574 1 1 11 SER HA H 3.531 -11.065 4.217 1.00 . A A . 11 SER HA 1 1 13 5575 1 1 11 SER HB2 H 4.221 -9.586 6.064 1.00 . A A . 11 SER HB2 1 1 13 5576 1 1 11 SER HB3 H 3.023 -8.552 5.659 1.00 . A A . 11 SER HB3 1 1 13 5577 1 1 11 SER HG H 2.491 -10.115 7.298 1.00 . A A . 11 SER HG 1 1 13 5578 1 1 11 SER N N 4.595 -9.395 3.573 1.00 . A A . 11 SER N 1 1 13 5579 1 1 11 SER O O 2.006 -9.201 2.336 1.00 . A A . 11 SER O 1 1 13 5580 1 1 11 SER OG O 2.392 -10.299 6.357 1.00 . A A . 11 SER OG 1 1 13 5581 1 1 12 GLY C C -0.894 -8.531 3.664 1.00 . A A . 12 GLY C 1 1 13 5582 1 1 12 GLY CA C -0.398 -9.979 3.618 1.00 . A A . 12 GLY CA 1 1 13 5583 1 1 12 GLY H H 1.157 -10.527 5.011 1.00 . A A . 12 GLY H 1 1 13 5584 1 1 12 GLY HA2 H -0.474 -10.335 2.590 1.00 . A A . 12 GLY HA2 1 1 13 5585 1 1 12 GLY HA3 H -1.058 -10.586 4.237 1.00 . A A . 12 GLY HA3 1 1 13 5586 1 1 12 GLY N N 0.980 -10.143 4.086 1.00 . A A . 12 GLY N 1 1 13 5587 1 1 12 GLY O O -2.018 -8.283 4.088 1.00 . A A . 12 GLY O 1 1 13 5588 1 1 13 MET C C -0.647 -5.743 1.714 1.00 . A A . 13 MET C 1 1 13 5589 1 1 13 MET CA C -0.394 -6.156 3.168 1.00 . A A . 13 MET CA 1 1 13 5590 1 1 13 MET CB C 0.771 -5.333 3.732 1.00 . A A . 13 MET CB 1 1 13 5591 1 1 13 MET CE C 0.674 -5.624 7.914 1.00 . A A . 13 MET CE 1 1 13 5592 1 1 13 MET CG C 1.100 -5.661 5.190 1.00 . A A . 13 MET CG 1 1 13 5593 1 1 13 MET H H 0.831 -7.874 2.872 1.00 . A A . 13 MET H 1 1 13 5594 1 1 13 MET HA H -1.293 -5.946 3.747 1.00 . A A . 13 MET HA 1 1 13 5595 1 1 13 MET HB2 H 1.583 -5.512 3.176 1.00 . A A . 13 MET HB2 1 1 13 5596 1 1 13 MET HB3 H 0.532 -4.364 3.672 1.00 . A A . 13 MET HB3 1 1 13 5597 1 1 13 MET HE1 H 0.879 -6.695 7.905 1.00 . A A . 13 MET HE1 1 1 13 5598 1 1 13 MET HE2 H 1.611 -5.074 7.998 1.00 . A A . 13 MET HE2 1 1 13 5599 1 1 13 MET HE3 H 0.037 -5.385 8.766 1.00 . A A . 13 MET HE3 1 1 13 5600 1 1 13 MET HG2 H 1.224 -6.650 5.267 1.00 . A A . 13 MET HG2 1 1 13 5601 1 1 13 MET HG3 H 1.954 -5.198 5.429 1.00 . A A . 13 MET HG3 1 1 13 5602 1 1 13 MET N N -0.060 -7.575 3.250 1.00 . A A . 13 MET N 1 1 13 5603 1 1 13 MET O O -0.361 -6.501 0.785 1.00 . A A . 13 MET O 1 1 13 5604 1 1 13 MET SD S -0.168 -5.156 6.380 1.00 . A A . 13 MET SD 1 1 13 5605 1 1 14 CYS C C -0.627 -2.489 0.244 1.00 . A A . 14 CYS C 1 1 13 5606 1 1 14 CYS CA C -1.275 -3.883 0.208 1.00 . A A . 14 CYS CA 1 1 13 5607 1 1 14 CYS CB C -2.770 -3.785 -0.125 1.00 . A A . 14 CYS CB 1 1 13 5608 1 1 14 CYS H H -1.348 -3.927 2.310 1.00 . A A . 14 CYS H 1 1 13 5609 1 1 14 CYS HA H -0.778 -4.478 -0.558 1.00 . A A . 14 CYS HA 1 1 13 5610 1 1 14 CYS HB2 H -3.143 -3.004 0.376 1.00 . A A . 14 CYS HB2 1 1 13 5611 1 1 14 CYS HB3 H -2.853 -3.622 -1.108 1.00 . A A . 14 CYS HB3 1 1 13 5612 1 1 14 CYS N N -1.123 -4.514 1.512 1.00 . A A . 14 CYS N 1 1 13 5613 1 1 14 CYS O O -0.266 -2.008 1.320 1.00 . A A . 14 CYS O 1 1 13 5614 1 1 14 CYS SG S -3.783 -5.241 0.283 1.00 . A A . 14 CYS SG 1 1 13 5615 1 1 15 CYS C C -0.674 0.509 -1.708 1.00 . A A . 15 CYS C 1 1 13 5616 1 1 15 CYS CA C 0.197 -0.551 -1.029 1.00 . A A . 15 CYS CA 1 1 13 5617 1 1 15 CYS CB C 1.472 -0.781 -1.834 1.00 . A A . 15 CYS CB 1 1 13 5618 1 1 15 CYS H H -0.771 -2.264 -1.777 1.00 . A A . 15 CYS H 1 1 13 5619 1 1 15 CYS HA H 0.470 -0.192 -0.041 1.00 . A A . 15 CYS HA 1 1 13 5620 1 1 15 CYS HB2 H 1.242 -1.300 -2.657 1.00 . A A . 15 CYS HB2 1 1 13 5621 1 1 15 CYS HB3 H 1.850 0.107 -2.095 1.00 . A A . 15 CYS HB3 1 1 13 5622 1 1 15 CYS N N -0.481 -1.837 -0.913 1.00 . A A . 15 CYS N 1 1 13 5623 1 1 15 CYS O O -1.434 0.198 -2.632 1.00 . A A . 15 CYS O 1 1 13 5624 1 1 15 CYS SG S 2.724 -1.692 -0.908 1.00 . A A . 15 CYS SG 1 1 13 5625 1 1 16 SER C C -0.555 3.659 -2.912 1.00 . A A . 16 SER C 1 1 13 5626 1 1 16 SER CA C -1.306 2.897 -1.820 1.00 . A A . 16 SER CA 1 1 13 5627 1 1 16 SER CB C -1.630 3.864 -0.676 1.00 . A A . 16 SER CB 1 1 13 5628 1 1 16 SER H H 0.124 1.968 -0.542 1.00 . A A . 16 SER H 1 1 13 5629 1 1 16 SER HA H -2.249 2.533 -2.223 1.00 . A A . 16 SER HA 1 1 13 5630 1 1 16 SER HB2 H -2.315 4.521 -0.990 1.00 . A A . 16 SER HB2 1 1 13 5631 1 1 16 SER HB3 H -1.996 3.343 0.095 1.00 . A A . 16 SER HB3 1 1 13 5632 1 1 16 SER HG H -0.752 5.087 0.529 1.00 . A A . 16 SER HG 1 1 13 5633 1 1 16 SER N N -0.535 1.772 -1.293 1.00 . A A . 16 SER N 1 1 13 5634 1 1 16 SER O O 0.674 3.657 -2.957 1.00 . A A . 16 SER O 1 1 13 5635 1 1 16 SER OG O -0.476 4.570 -0.249 1.00 . A A . 16 SER OG 1 1 13 5636 1 1 17 GLN C C 0.075 6.493 -3.972 1.00 . A A . 17 GLN C 1 1 13 5637 1 1 17 GLN CA C -0.672 5.358 -4.685 1.00 . A A . 17 GLN CA 1 1 13 5638 1 1 17 GLN CB C -1.751 5.947 -5.607 1.00 . A A . 17 GLN CB 1 1 13 5639 1 1 17 GLN CD C -2.796 3.724 -6.316 1.00 . A A . 17 GLN CD 1 1 13 5640 1 1 17 GLN CG C -2.137 5.020 -6.767 1.00 . A A . 17 GLN CG 1 1 13 5641 1 1 17 GLN H H -2.284 4.294 -3.801 1.00 . A A . 17 GLN H 1 1 13 5642 1 1 17 GLN HA H 0.066 4.826 -5.288 1.00 . A A . 17 GLN HA 1 1 13 5643 1 1 17 GLN HB2 H -2.569 6.128 -5.061 1.00 . A A . 17 GLN HB2 1 1 13 5644 1 1 17 GLN HB3 H -1.407 6.805 -5.989 1.00 . A A . 17 GLN HB3 1 1 13 5645 1 1 17 GLN HE21 H -2.234 2.741 -7.995 1.00 . A A . 17 GLN HE21 1 1 13 5646 1 1 17 GLN HE22 H -3.126 1.810 -6.805 1.00 . A A . 17 GLN HE22 1 1 13 5647 1 1 17 GLN HG2 H -2.774 5.508 -7.363 1.00 . A A . 17 GLN HG2 1 1 13 5648 1 1 17 GLN HG3 H -1.309 4.792 -7.279 1.00 . A A . 17 GLN HG3 1 1 13 5649 1 1 17 GLN N N -1.278 4.415 -3.745 1.00 . A A . 17 GLN N 1 1 13 5650 1 1 17 GLN NE2 N -2.708 2.672 -7.109 1.00 . A A . 17 GLN NE2 1 1 13 5651 1 1 17 GLN O O 0.887 7.173 -4.589 1.00 . A A . 17 GLN O 1 1 13 5652 1 1 17 GLN OE1 O -3.375 3.631 -5.239 1.00 . A A . 17 GLN OE1 1 1 13 5653 1 1 18 . C C 1.969 6.942 -1.396 1.00 . A A . 18 PFF C 1 1 13 5654 1 1 18 . CA C 0.652 7.586 -1.852 1.00 . A A . 18 PFF CA 1 1 13 5655 1 1 18 . CB C -0.198 8.060 -0.665 1.00 . A A . 18 PFF CB 1 1 13 5656 1 1 18 . CD1 C -1.715 9.702 -1.838 1.00 . A A . 18 PFF CD1 1 1 13 5657 1 1 18 . CD2 C -2.685 7.665 -0.926 1.00 . A A . 18 PFF CD2 1 1 13 5658 1 1 18 . CE1 C -2.950 10.024 -2.428 1.00 . A A . 18 PFF CE1 1 1 13 5659 1 1 18 . CE2 C -3.929 8.002 -1.493 1.00 . A A . 18 PFF CE2 1 1 13 5660 1 1 18 . CG C -1.578 8.521 -1.088 1.00 . A A . 18 PFF CG 1 1 13 5661 1 1 18 . CZ C -4.062 9.184 -2.241 1.00 . A A . 18 PFF CZ 1 1 13 5662 1 1 18 . F F -5.261 9.507 -2.791 1.00 . A A . 18 PFF F 1 1 13 5663 1 1 18 . H H -0.806 6.076 -2.194 1.00 . A A . 18 PFF H 1 1 13 5664 1 1 18 . HA H 0.908 8.460 -2.453 1.00 . A A . 18 PFF HA 1 1 13 5665 1 1 18 . HB2 H -0.297 7.247 0.052 1.00 . A A . 18 PFF HB2 1 1 13 5666 1 1 18 . HB3 H 0.316 8.885 -0.168 1.00 . A A . 18 PFF HB3 1 1 13 5667 1 1 18 . HD1 H -0.857 10.336 -2.010 1.00 . A A . 18 PFF HD1 1 1 13 5668 1 1 18 . HD2 H -2.589 6.754 -0.357 1.00 . A A . 18 PFF HD2 1 1 13 5669 1 1 18 . HE1 H -3.039 10.912 -3.034 1.00 . A A . 18 PFF HE1 1 1 13 5670 1 1 18 . HE2 H -4.780 7.353 -1.353 1.00 . A A . 18 PFF HE2 1 1 13 5671 1 1 18 . N N -0.141 6.669 -2.666 1.00 . A A . 18 PFF N 1 1 13 5672 1 1 18 . O O 2.782 7.597 -0.750 1.00 . A A . 18 PFF O 1 1 13 5673 1 1 19 GLY C C 3.451 4.202 -0.148 1.00 . A A . 19 GLY C 1 1 13 5674 1 1 19 GLY CA C 3.439 4.964 -1.468 1.00 . A A . 19 GLY CA 1 1 13 5675 1 1 19 GLY H H 1.480 5.150 -2.241 1.00 . A A . 19 GLY H 1 1 13 5676 1 1 19 GLY HA2 H 3.617 4.250 -2.272 1.00 . A A . 19 GLY HA2 1 1 13 5677 1 1 19 GLY HA3 H 4.266 5.675 -1.457 1.00 . A A . 19 GLY HA3 1 1 13 5678 1 1 19 GLY N N 2.192 5.665 -1.731 1.00 . A A . 19 GLY N 1 1 13 5679 1 1 19 GLY O O 4.508 3.701 0.225 1.00 . A A . 19 GLY O 1 1 13 5680 1 1 20 . C C 1.663 2.148 1.974 1.00 . A A . 20 PFF C 1 1 13 5681 1 1 20 . CA C 2.311 3.535 1.917 1.00 . A A . 20 PFF CA 1 1 13 5682 1 1 20 . CB C 1.599 4.513 2.848 1.00 . A A . 20 PFF CB 1 1 13 5683 1 1 20 . CD1 C 2.319 6.890 2.341 1.00 . A A . 20 PFF CD1 1 1 13 5684 1 1 20 . CD2 C 3.292 5.746 4.255 1.00 . A A . 20 PFF CD2 1 1 13 5685 1 1 20 . CE1 C 3.123 8.013 2.604 1.00 . A A . 20 PFF CE1 1 1 13 5686 1 1 20 . CE2 C 4.095 6.869 4.518 1.00 . A A . 20 PFF CE2 1 1 13 5687 1 1 20 . CG C 2.406 5.752 3.163 1.00 . A A . 20 PFF CG 1 1 13 5688 1 1 20 . CZ C 4.019 7.999 3.687 1.00 . A A . 20 PFF CZ 1 1 13 5689 1 1 20 . F F 4.755 9.104 3.977 1.00 . A A . 20 PFF F 1 1 13 5690 1 1 20 . H H 1.440 4.428 0.195 1.00 . A A . 20 PFF H 1 1 13 5691 1 1 20 . HA H 3.329 3.422 2.279 1.00 . A A . 20 PFF HA 1 1 13 5692 1 1 20 . HB2 H 0.634 4.788 2.424 1.00 . A A . 20 PFF HB2 1 1 13 5693 1 1 20 . HB3 H 1.420 3.999 3.784 1.00 . A A . 20 PFF HB3 1 1 13 5694 1 1 20 . HD1 H 1.646 6.896 1.497 1.00 . A A . 20 PFF HD1 1 1 13 5695 1 1 20 . HD2 H 3.339 4.892 4.912 1.00 . A A . 20 PFF HD2 1 1 13 5696 1 1 20 . HE1 H 3.065 8.878 1.961 1.00 . A A . 20 PFF HE1 1 1 13 5697 1 1 20 . HE2 H 4.760 6.865 5.366 1.00 . A A . 20 PFF HE2 1 1 13 5698 1 1 20 . N N 2.326 4.103 0.571 1.00 . A A . 20 PFF N 1 1 13 5699 1 1 20 . O O 0.895 1.772 1.088 1.00 . A A . 20 PFF O 1 1 13 5700 1 1 21 CYS C C 0.504 -0.203 4.267 1.00 . A A . 21 CYS C 1 1 13 5701 1 1 21 CYS CA C 1.599 0.002 3.218 1.00 . A A . 21 CYS CA 1 1 13 5702 1 1 21 CYS CB C 2.863 -0.741 3.666 1.00 . A A . 21 CYS CB 1 1 13 5703 1 1 21 CYS H H 2.594 1.807 3.725 1.00 . A A . 21 CYS H 1 1 13 5704 1 1 21 CYS HA H 1.268 -0.415 2.268 1.00 . A A . 21 CYS HA 1 1 13 5705 1 1 21 CYS HB2 H 3.506 -0.737 2.901 1.00 . A A . 21 CYS HB2 1 1 13 5706 1 1 21 CYS HB3 H 3.256 -0.237 4.435 1.00 . A A . 21 CYS HB3 1 1 13 5707 1 1 21 CYS N N 1.959 1.404 3.041 1.00 . A A . 21 CYS N 1 1 13 5708 1 1 21 CYS O O 0.525 0.412 5.330 1.00 . A A . 21 CYS O 1 1 13 5709 1 1 21 CYS SG S 2.637 -2.460 4.189 1.00 . A A . 21 CYS SG 1 1 13 5710 1 1 22 GLY C C -2.238 -2.742 4.492 1.00 . A A . 22 GLY C 1 1 13 5711 1 1 22 GLY CA C -1.257 -1.713 5.050 1.00 . A A . 22 GLY CA 1 1 13 5712 1 1 22 GLY H H -0.433 -1.554 3.078 1.00 . A A . 22 GLY H 1 1 13 5713 1 1 22 GLY HA2 H -0.632 -2.189 5.806 1.00 . A A . 22 GLY HA2 1 1 13 5714 1 1 22 GLY HA3 H -1.821 -0.908 5.520 1.00 . A A . 22 GLY HA3 1 1 13 5715 1 1 22 GLY N N -0.400 -1.151 4.012 1.00 . A A . 22 GLY N 1 1 13 5716 1 1 22 GLY O O -2.438 -2.835 3.282 1.00 . A A . 22 GLY O 1 1 13 5717 1 1 23 LYS C C -5.327 -3.814 5.341 1.00 . A A . 23 LYS C 1 1 13 5718 1 1 23 LYS CA C -3.972 -4.428 4.990 1.00 . A A . 23 LYS CA 1 1 13 5719 1 1 23 LYS CB C -3.767 -5.790 5.666 1.00 . A A . 23 LYS CB 1 1 13 5720 1 1 23 LYS CD C -4.874 -8.064 5.975 1.00 . A A . 23 LYS CD 1 1 13 5721 1 1 23 LYS CE C -5.434 -7.708 7.360 1.00 . A A . 23 LYS CE 1 1 13 5722 1 1 23 LYS CG C -4.707 -6.846 5.059 1.00 . A A . 23 LYS CG 1 1 13 5723 1 1 23 LYS H H -2.637 -3.431 6.344 1.00 . A A . 23 LYS H 1 1 13 5724 1 1 23 LYS HA H -3.952 -4.590 3.911 1.00 . A A . 23 LYS HA 1 1 13 5725 1 1 23 LYS HB2 H -2.819 -6.081 5.536 1.00 . A A . 23 LYS HB2 1 1 13 5726 1 1 23 LYS HB3 H -3.959 -5.703 6.644 1.00 . A A . 23 LYS HB3 1 1 13 5727 1 1 23 LYS HD2 H -5.500 -8.708 5.536 1.00 . A A . 23 LYS HD2 1 1 13 5728 1 1 23 LYS HD3 H -3.980 -8.496 6.095 1.00 . A A . 23 LYS HD3 1 1 13 5729 1 1 23 LYS HE2 H -5.675 -8.554 7.836 1.00 . A A . 23 LYS HE2 1 1 13 5730 1 1 23 LYS HE3 H -4.728 -7.224 7.877 1.00 . A A . 23 LYS HE3 1 1 13 5731 1 1 23 LYS HG2 H -5.604 -6.431 4.908 1.00 . A A . 23 LYS HG2 1 1 13 5732 1 1 23 LYS HG3 H -4.329 -7.150 4.185 1.00 . A A . 23 LYS HG3 1 1 13 5733 1 1 23 LYS HZ1 H -6.410 -5.949 6.856 1.00 . A A . 23 LYS HZ1 1 1 13 5734 1 1 23 LYS HZ2 H -7.354 -7.287 6.719 1.00 . A A . 23 LYS HZ2 1 1 13 5735 1 1 23 LYS HZ3 H -7.010 -6.664 8.203 1.00 . A A . 23 LYS HZ3 1 1 13 5736 1 1 23 LYS N N -2.896 -3.506 5.369 1.00 . A A . 23 LYS N 1 1 13 5737 1 1 23 LYS NZ N -6.640 -6.847 7.281 1.00 . A A . 23 LYS NZ 1 1 13 5738 1 1 23 LYS O O -6.082 -4.372 6.140 1.00 . A A . 23 LYS O 1 1 13 5739 1 1 24 GLY C C -7.309 -1.140 3.758 1.00 . A A . 24 GLY C 1 1 13 5740 1 1 24 GLY CA C -6.884 -1.954 4.979 1.00 . A A . 24 GLY CA 1 1 13 5741 1 1 24 GLY H H -4.975 -2.280 4.078 1.00 . A A . 24 GLY H 1 1 13 5742 1 1 24 GLY HA2 H -7.661 -2.685 5.203 1.00 . A A . 24 GLY HA2 1 1 13 5743 1 1 24 GLY HA3 H -6.775 -1.283 5.832 1.00 . A A . 24 GLY HA3 1 1 13 5744 1 1 24 GLY N N -5.625 -2.657 4.753 1.00 . A A . 24 GLY N 1 1 13 5745 1 1 24 GLY O O -6.505 -0.932 2.843 1.00 . A A . 24 GLY O 1 1 13 5746 1 1 25 PRO C C -8.343 0.868 1.774 1.00 . A A . 25 PRO C 1 1 13 5747 1 1 25 PRO CA C -9.225 -0.078 2.584 1.00 . A A . 25 PRO CA 1 1 13 5748 1 1 25 PRO CB C -10.482 0.601 3.132 1.00 . A A . 25 PRO CB 1 1 13 5749 1 1 25 PRO CD C -9.508 -0.752 4.851 1.00 . A A . 25 PRO CD 1 1 13 5750 1 1 25 PRO CG C -10.864 -0.329 4.283 1.00 . A A . 25 PRO CG 1 1 13 5751 1 1 25 PRO HA H -9.535 -0.893 1.928 1.00 . A A . 25 PRO HA 1 1 13 5752 1 1 25 PRO HB2 H -10.283 1.524 3.461 1.00 . A A . 25 PRO HB2 1 1 13 5753 1 1 25 PRO HB3 H -11.204 0.641 2.442 1.00 . A A . 25 PRO HB3 1 1 13 5754 1 1 25 PRO HD2 H -9.234 -0.138 5.591 1.00 . A A . 25 PRO HD2 1 1 13 5755 1 1 25 PRO HD3 H -9.552 -1.690 5.195 1.00 . A A . 25 PRO HD3 1 1 13 5756 1 1 25 PRO HG2 H -11.406 0.154 4.970 1.00 . A A . 25 PRO HG2 1 1 13 5757 1 1 25 PRO HG3 H -11.376 -1.121 3.950 1.00 . A A . 25 PRO HG3 1 1 13 5758 1 1 25 PRO N N -8.566 -0.662 3.744 1.00 . A A . 25 PRO N 1 1 13 5759 1 1 25 PRO O O -8.080 0.607 0.602 1.00 . A A . 25 PRO O 1 1 13 5760 1 1 26 LYS C C -5.694 2.479 1.175 1.00 . A A . 26 LYS C 1 1 13 5761 1 1 26 LYS CA C -7.076 2.945 1.639 1.00 . A A . 26 LYS CA 1 1 13 5762 1 1 26 LYS CB C -7.003 4.231 2.460 1.00 . A A . 26 LYS CB 1 1 13 5763 1 1 26 LYS CD C -8.434 6.213 3.179 1.00 . A A . 26 LYS CD 1 1 13 5764 1 1 26 LYS CE C -9.016 7.044 2.028 1.00 . A A . 26 LYS CE 1 1 13 5765 1 1 26 LYS CG C -8.407 4.714 2.857 1.00 . A A . 26 LYS CG 1 1 13 5766 1 1 26 LYS H H -8.036 2.119 3.351 1.00 . A A . 26 LYS H 1 1 13 5767 1 1 26 LYS HA H -7.627 3.168 0.731 1.00 . A A . 26 LYS HA 1 1 13 5768 1 1 26 LYS HB2 H -6.470 4.060 3.289 1.00 . A A . 26 LYS HB2 1 1 13 5769 1 1 26 LYS HB3 H -6.555 4.941 1.916 1.00 . A A . 26 LYS HB3 1 1 13 5770 1 1 26 LYS HD2 H -8.994 6.357 3.995 1.00 . A A . 26 LYS HD2 1 1 13 5771 1 1 26 LYS HD3 H -7.499 6.521 3.357 1.00 . A A . 26 LYS HD3 1 1 13 5772 1 1 26 LYS HE2 H -9.937 6.710 1.828 1.00 . A A . 26 LYS HE2 1 1 13 5773 1 1 26 LYS HE3 H -9.063 8.000 2.317 1.00 . A A . 26 LYS HE3 1 1 13 5774 1 1 26 LYS HG2 H -9.035 4.536 2.099 1.00 . A A . 26 LYS HG2 1 1 13 5775 1 1 26 LYS HG3 H -8.706 4.206 3.665 1.00 . A A . 26 LYS HG3 1 1 13 5776 1 1 26 LYS HZ1 H -8.569 7.642 0.121 1.00 . A A . 26 LYS HZ1 1 1 13 5777 1 1 26 LYS HZ2 H -7.245 7.230 0.988 1.00 . A A . 26 LYS HZ2 1 1 13 5778 1 1 26 LYS HZ3 H -8.256 6.044 0.364 1.00 . A A . 26 LYS HZ3 1 1 13 5779 1 1 26 LYS N N -7.827 1.938 2.381 1.00 . A A . 26 LYS N 1 1 13 5780 1 1 26 LYS NZ N -8.208 6.965 0.792 1.00 . A A . 26 LYS NZ 1 1 13 5781 1 1 26 LYS O O -5.109 3.107 0.297 1.00 . A A . 26 LYS O 1 1 13 5782 1 1 27 TYR C C -4.199 -0.281 0.152 1.00 . A A . 27 TYR C 1 1 13 5783 1 1 27 TYR CA C -3.949 0.757 1.234 1.00 . A A . 27 TYR CA 1 1 13 5784 1 1 27 TYR CB C -3.270 0.064 2.409 1.00 . A A . 27 TYR CB 1 1 13 5785 1 1 27 TYR CD1 C -1.796 1.867 3.356 1.00 . A A . 27 TYR CD1 1 1 13 5786 1 1 27 TYR CD2 C -3.751 1.180 4.634 1.00 . A A . 27 TYR CD2 1 1 13 5787 1 1 27 TYR CE1 C -1.502 2.837 4.328 1.00 . A A . 27 TYR CE1 1 1 13 5788 1 1 27 TYR CE2 C -3.495 2.205 5.565 1.00 . A A . 27 TYR CE2 1 1 13 5789 1 1 27 TYR CG C -2.906 1.022 3.519 1.00 . A A . 27 TYR CG 1 1 13 5790 1 1 27 TYR CZ C -2.372 3.032 5.410 1.00 . A A . 27 TYR CZ 1 1 13 5791 1 1 27 TYR H H -5.756 0.836 2.362 1.00 . A A . 27 TYR H 1 1 13 5792 1 1 27 TYR HA H -3.280 1.520 0.833 1.00 . A A . 27 TYR HA 1 1 13 5793 1 1 27 TYR HB2 H -3.892 -0.628 2.775 1.00 . A A . 27 TYR HB2 1 1 13 5794 1 1 27 TYR HB3 H -2.435 -0.378 2.081 1.00 . A A . 27 TYR HB3 1 1 13 5795 1 1 27 TYR HD1 H -1.194 1.789 2.464 1.00 . A A . 27 TYR HD1 1 1 13 5796 1 1 27 TYR HD2 H -4.614 0.542 4.756 1.00 . A A . 27 TYR HD2 1 1 13 5797 1 1 27 TYR HE1 H -0.646 3.481 4.221 1.00 . A A . 27 TYR HE1 1 1 13 5798 1 1 27 TYR HE2 H -4.150 2.373 6.406 1.00 . A A . 27 TYR HE2 1 1 13 5799 1 1 27 TYR HH H -1.307 4.471 6.132 1.00 . A A . 27 TYR HH 1 1 13 5800 1 1 27 TYR N N -5.199 1.354 1.693 1.00 . A A . 27 TYR N 1 1 13 5801 1 1 27 TYR O O -3.393 -0.451 -0.759 1.00 . A A . 27 TYR O 1 1 13 5802 1 1 27 TYR OH O -2.203 4.111 6.218 1.00 . A A . 27 TYR OH 1 1 13 5803 1 1 28 CYS C C -6.635 -1.743 -1.705 1.00 . A A . 28 CYS C 1 1 13 5804 1 1 28 CYS CA C -5.622 -2.106 -0.608 1.00 . A A . 28 CYS CA 1 1 13 5805 1 1 28 CYS CB C -6.060 -3.269 0.273 1.00 . A A . 28 CYS CB 1 1 13 5806 1 1 28 CYS H H -5.825 -0.923 1.144 1.00 . A A . 28 CYS H 1 1 13 5807 1 1 28 CYS HA H -4.712 -2.410 -1.122 1.00 . A A . 28 CYS HA 1 1 13 5808 1 1 28 CYS HB2 H -5.601 -3.199 1.159 1.00 . A A . 28 CYS HB2 1 1 13 5809 1 1 28 CYS HB3 H -7.050 -3.223 0.406 1.00 . A A . 28 CYS HB3 1 1 13 5810 1 1 28 CYS N N -5.314 -0.998 0.270 1.00 . A A . 28 CYS N 1 1 13 5811 1 1 28 CYS O O -6.330 -1.899 -2.887 1.00 . A A . 28 CYS O 1 1 13 5812 1 1 28 CYS SG S -5.639 -4.854 -0.485 1.00 . A A . 28 CYS SG 1 1 13 5813 1 1 29 GLY C C -8.776 0.766 -2.622 1.00 . A A . 29 GLY C 1 1 13 5814 1 1 29 GLY CA C -8.811 -0.735 -2.308 1.00 . A A . 29 GLY CA 1 1 13 5815 1 1 29 GLY H H -7.929 -0.933 -0.376 1.00 . A A . 29 GLY H 1 1 13 5816 1 1 29 GLY HA2 H -8.706 -1.282 -3.246 1.00 . A A . 29 GLY HA2 1 1 13 5817 1 1 29 GLY HA3 H -9.794 -0.968 -1.900 1.00 . A A . 29 GLY HA3 1 1 13 5818 1 1 29 GLY N N -7.789 -1.173 -1.352 1.00 . A A . 29 GLY N 1 1 13 5819 1 1 29 GLY O O -9.541 1.225 -3.464 1.00 . A A . 29 GLY O 1 1 13 5820 1 1 30 ARG C C -8.905 3.804 -1.516 1.00 . A A . 30 ARG C 1 1 13 5821 1 1 30 ARG CA C -7.730 2.996 -2.071 1.00 . A A . 30 ARG CA 1 1 13 5822 1 1 30 ARG CB C -7.451 3.435 -3.520 1.00 . A A . 30 ARG CB 1 1 13 5823 1 1 30 ARG CD C -6.255 1.574 -4.870 1.00 . A A . 30 ARG CD 1 1 13 5824 1 1 30 ARG CG C -6.139 2.908 -4.110 1.00 . A A . 30 ARG CG 1 1 13 5825 1 1 30 ARG CZ C -4.347 0.284 -3.885 1.00 . A A . 30 ARG CZ 1 1 13 5826 1 1 30 ARG H H -7.497 1.090 -1.135 1.00 . A A . 30 ARG H 1 1 13 5827 1 1 30 ARG HA H -6.861 3.270 -1.472 1.00 . A A . 30 ARG HA 1 1 13 5828 1 1 30 ARG HB2 H -8.203 3.110 -4.094 1.00 . A A . 30 ARG HB2 1 1 13 5829 1 1 30 ARG HB3 H -7.423 4.434 -3.542 1.00 . A A . 30 ARG HB3 1 1 13 5830 1 1 30 ARG HD2 H -7.225 1.370 -5.001 1.00 . A A . 30 ARG HD2 1 1 13 5831 1 1 30 ARG HD3 H -5.813 1.680 -5.761 1.00 . A A . 30 ARG HD3 1 1 13 5832 1 1 30 ARG HE H -6.209 -0.366 -3.933 1.00 . A A . 30 ARG HE 1 1 13 5833 1 1 30 ARG HG2 H -5.786 3.596 -4.744 1.00 . A A . 30 ARG HG2 1 1 13 5834 1 1 30 ARG HG3 H -5.490 2.782 -3.359 1.00 . A A . 30 ARG HG3 1 1 13 5835 1 1 30 ARG HH11 H -3.703 2.067 -4.525 1.00 . A A . 30 ARG HH11 1 1 13 5836 1 1 30 ARG HH12 H -2.487 1.022 -3.870 1.00 . A A . 30 ARG HH12 1 1 13 5837 1 1 30 ARG HH21 H -4.564 -1.543 -3.103 1.00 . A A . 30 ARG HH21 1 1 13 5838 1 1 30 ARG HH22 H -2.950 -0.915 -3.106 1.00 . A A . 30 ARG HH22 1 1 13 5839 1 1 30 ARG N N -7.918 1.539 -1.943 1.00 . A A . 30 ARG N 1 1 13 5840 1 1 30 ARG NE N -5.631 0.434 -4.174 1.00 . A A . 30 ARG NE 1 1 13 5841 1 1 30 ARG NH1 N -3.442 1.195 -4.111 1.00 . A A . 30 ARG NH1 1 1 13 5842 1 1 30 ARG NH2 N -3.921 -0.809 -3.321 1.00 . A A . 30 ARG NH2 1 1 13 5843 1 1 30 ARG O O -8.704 4.711 -0.709 1.00 . A A . 30 ARG O 1 1 13 5844 1 1 31 NH2 HN1 H -10.231 2.741 -2.603 1.00 . A A . 31 NH2 HN1 1 1 13 5845 1 1 31 NH2 HN2 H -10.915 4.005 -1.575 1.00 . A A . 31 NH2 HN2 1 1 13 5846 1 1 31 NH2 N N -10.125 3.486 -1.923 1.00 . A A . 31 NH2 N 1 1 13 5847 2 2 1 NAG C1 C -8.426 12.934 -1.772 1.00 . B A . 32 NAG C1 1 1 13 5848 2 2 1 NAG C2 C -8.319 11.715 -0.863 1.00 . B A . 32 NAG C2 1 1 13 5849 2 2 1 NAG C3 C -7.272 12.023 0.214 1.00 . B A . 32 NAG C3 1 1 13 5850 2 2 1 NAG C4 C -5.925 12.386 -0.437 1.00 . B A . 32 NAG C4 1 1 13 5851 2 2 1 NAG C5 C -6.188 13.600 -1.336 1.00 . B A . 32 NAG C5 1 1 13 5852 2 2 1 NAG C6 C -4.914 14.041 -2.074 1.00 . B A . 32 NAG C6 1 1 13 5853 2 2 1 NAG C7 C -10.052 10.125 -0.077 1.00 . B A . 32 NAG C7 1 1 13 5854 2 2 1 NAG C8 C -11.437 9.999 0.477 1.00 . B A . 32 NAG C8 1 1 13 5855 2 2 1 NAG H1 H -8.854 13.786 -1.239 1.00 . B A . 32 NAG H1 1 1 13 5856 2 2 1 NAG H2 H -7.942 10.892 -1.474 1.00 . B A . 32 NAG H2 1 1 13 5857 2 2 1 NAG H3 H -7.613 12.855 0.831 1.00 . B A . 32 NAG H3 1 1 13 5858 2 2 1 NAG H4 H -5.605 11.557 -1.067 1.00 . B A . 32 NAG H4 1 1 13 5859 2 2 1 NAG H5 H -6.543 14.437 -0.733 1.00 . B A . 32 NAG H5 1 1 13 5860 2 2 1 NAG H61 H -4.139 14.326 -1.363 1.00 . B A . 32 NAG H61 1 1 13 5861 2 2 1 NAG H62 H -5.144 14.904 -2.701 1.00 . B A . 32 NAG H62 1 1 13 5862 2 2 1 NAG H81 H -11.466 10.455 1.463 1.00 . B A . 32 NAG H81 1 1 13 5863 2 2 1 NAG H82 H -12.133 10.491 -0.198 1.00 . B A . 32 NAG H82 1 1 13 5864 2 2 1 NAG H83 H -11.679 8.941 0.545 1.00 . B A . 32 NAG H83 1 1 13 5865 2 2 1 NAG HN2 H -10.293 12.092 -0.069 1.00 . B A . 32 NAG HN2 1 1 13 5866 2 2 1 NAG HO1 H -8.780 13.097 -3.596 1.00 . B A . 32 NAG HO1 1 1 13 5867 2 2 1 NAG HO3 H -6.381 11.169 1.628 1.00 . B A . 32 NAG HO3 1 1 13 5868 2 2 1 NAG HO4 H 1.848 8.237 7.406 1.00 . B A . 32 NAG HO4 1 1 13 5869 2 2 1 NAG HO6 H -5.149 12.747 -3.487 1.00 . B A . 32 NAG HO6 1 1 13 5870 2 2 1 NAG N2 N -9.629 11.366 -0.277 1.00 . B A . 32 NAG N2 1 1 13 5871 2 2 1 NAG O1 O -9.195 12.633 -2.866 1.00 . B A . 32 NAG O1 1 1 13 5872 2 2 1 NAG O3 O -7.108 10.893 1.044 1.00 . B A . 32 NAG O3 1 1 13 5873 2 2 1 NAG O4 O -4.896 12.714 0.539 1.00 . B A . 32 NAG O4 1 1 13 5874 2 2 1 NAG O5 O -7.162 13.268 -2.317 1.00 . B A . 32 NAG O5 1 1 13 5875 2 2 1 NAG O6 O -4.429 12.997 -2.897 1.00 . B A . 32 NAG O6 1 1 13 5876 2 2 1 NAG O7 O -9.386 9.120 -0.307 1.00 . B A . 32 NAG O7 1 1 14 5877 1 1 1 VAL C C 10.058 7.573 2.743 1.00 . A A . 1 VAL C 1 1 14 5878 1 1 1 VAL CA C 10.245 8.864 1.969 1.00 . A A . 1 VAL CA 1 1 14 5879 1 1 1 VAL CB C 10.432 10.079 2.889 1.00 . A A . 1 VAL CB 1 1 14 5880 1 1 1 VAL CG1 C 9.223 10.371 3.783 1.00 . A A . 1 VAL CG1 1 1 14 5881 1 1 1 VAL CG2 C 11.680 9.912 3.757 1.00 . A A . 1 VAL CG2 1 1 14 5882 1 1 1 VAL H1 H 9.145 9.896 0.553 1.00 . A A . 1 VAL H1 1 1 14 5883 1 1 1 VAL H2 H 8.236 8.936 1.569 1.00 . A A . 1 VAL H2 1 1 14 5884 1 1 1 VAL H3 H 9.152 8.252 0.381 1.00 . A A . 1 VAL H3 1 1 14 5885 1 1 1 VAL HA H 11.145 8.755 1.365 1.00 . A A . 1 VAL HA 1 1 14 5886 1 1 1 VAL HB H 10.588 10.946 2.248 1.00 . A A . 1 VAL HB 1 1 14 5887 1 1 1 VAL HG11 H 8.322 10.530 3.191 1.00 . A A . 1 VAL HG11 1 1 14 5888 1 1 1 VAL HG12 H 9.053 9.555 4.486 1.00 . A A . 1 VAL HG12 1 1 14 5889 1 1 1 VAL HG13 H 9.417 11.278 4.356 1.00 . A A . 1 VAL HG13 1 1 14 5890 1 1 1 VAL HG21 H 12.547 9.701 3.131 1.00 . A A . 1 VAL HG21 1 1 14 5891 1 1 1 VAL HG22 H 11.865 10.838 4.304 1.00 . A A . 1 VAL HG22 1 1 14 5892 1 1 1 VAL HG23 H 11.548 9.106 4.479 1.00 . A A . 1 VAL HG23 1 1 14 5893 1 1 1 VAL N N 9.100 9.020 1.051 1.00 . A A . 1 VAL N 1 1 14 5894 1 1 1 VAL O O 8.958 7.317 3.227 1.00 . A A . 1 VAL O 1 1 14 5895 1 1 2 GLY C C 10.175 4.505 2.260 1.00 . A A . 2 GLY C 1 1 14 5896 1 1 2 GLY CA C 10.949 5.347 3.270 1.00 . A A . 2 GLY CA 1 1 14 5897 1 1 2 GLY H H 11.892 6.921 2.226 1.00 . A A . 2 GLY H 1 1 14 5898 1 1 2 GLY HA2 H 11.938 4.911 3.403 1.00 . A A . 2 GLY HA2 1 1 14 5899 1 1 2 GLY HA3 H 10.425 5.336 4.226 1.00 . A A . 2 GLY HA3 1 1 14 5900 1 1 2 GLY N N 11.078 6.715 2.780 1.00 . A A . 2 GLY N 1 1 14 5901 1 1 2 GLY O O 10.783 3.715 1.553 1.00 . A A . 2 GLY O 1 1 14 5902 1 1 3 GLU C C 7.854 2.723 0.955 1.00 . A A . 3 GLU C 1 1 14 5903 1 1 3 GLU CA C 7.816 4.234 1.295 1.00 . A A . 3 GLU CA 1 1 14 5904 1 1 3 GLU CB C 7.657 5.149 0.057 1.00 . A A . 3 GLU CB 1 1 14 5905 1 1 3 GLU CD C 10.057 5.772 -0.618 1.00 . A A . 3 GLU CD 1 1 14 5906 1 1 3 GLU CG C 8.735 5.121 -1.031 1.00 . A A . 3 GLU CG 1 1 14 5907 1 1 3 GLU H H 8.610 5.570 2.751 1.00 . A A . 3 GLU H 1 1 14 5908 1 1 3 GLU HA H 6.883 4.348 1.855 1.00 . A A . 3 GLU HA 1 1 14 5909 1 1 3 GLU HB2 H 6.793 4.902 -0.381 1.00 . A A . 3 GLU HB2 1 1 14 5910 1 1 3 GLU HB3 H 7.604 6.089 0.393 1.00 . A A . 3 GLU HB3 1 1 14 5911 1 1 3 GLU HG2 H 8.916 4.167 -1.269 1.00 . A A . 3 GLU HG2 1 1 14 5912 1 1 3 GLU HG3 H 8.384 5.604 -1.833 1.00 . A A . 3 GLU HG3 1 1 14 5913 1 1 3 GLU N N 8.867 4.772 2.178 1.00 . A A . 3 GLU N 1 1 14 5914 1 1 3 GLU O O 8.795 1.997 1.259 1.00 . A A . 3 GLU O 1 1 14 5915 1 1 3 GLU OE1 O 10.007 6.916 -0.106 1.00 . A A . 3 GLU OE1 1 1 14 5916 1 1 3 GLU OE2 O 11.110 5.125 -0.842 1.00 . A A . 3 GLU OE2 1 1 14 5917 1 1 4 CYS C C 7.791 0.125 -0.663 1.00 . A A . 4 CYS C 1 1 14 5918 1 1 4 CYS CA C 6.561 0.830 -0.062 1.00 . A A . 4 CYS CA 1 1 14 5919 1 1 4 CYS CB C 5.433 0.808 -1.108 1.00 . A A . 4 CYS CB 1 1 14 5920 1 1 4 CYS H H 5.987 2.860 0.252 1.00 . A A . 4 CYS H 1 1 14 5921 1 1 4 CYS HA H 6.243 0.263 0.812 1.00 . A A . 4 CYS HA 1 1 14 5922 1 1 4 CYS HB2 H 5.706 1.403 -1.864 1.00 . A A . 4 CYS HB2 1 1 14 5923 1 1 4 CYS HB3 H 5.342 -0.131 -1.439 1.00 . A A . 4 CYS HB3 1 1 14 5924 1 1 4 CYS N N 6.777 2.227 0.334 1.00 . A A . 4 CYS N 1 1 14 5925 1 1 4 CYS O O 8.777 0.741 -1.068 1.00 . A A . 4 CYS O 1 1 14 5926 1 1 4 CYS SG S 3.807 1.351 -0.539 1.00 . A A . 4 CYS SG 1 1 14 5927 1 1 5 VAL C C 8.292 -1.547 -3.249 1.00 . A A . 5 VAL C 1 1 14 5928 1 1 5 VAL CA C 8.637 -1.887 -1.795 1.00 . A A . 5 VAL CA 1 1 14 5929 1 1 5 VAL CB C 8.629 -3.396 -1.497 1.00 . A A . 5 VAL CB 1 1 14 5930 1 1 5 VAL CG1 C 9.704 -4.137 -2.297 1.00 . A A . 5 VAL CG1 1 1 14 5931 1 1 5 VAL CG2 C 8.928 -3.644 -0.014 1.00 . A A . 5 VAL CG2 1 1 14 5932 1 1 5 VAL H H 6.818 -1.649 -0.716 1.00 . A A . 5 VAL H 1 1 14 5933 1 1 5 VAL HA H 9.646 -1.528 -1.593 1.00 . A A . 5 VAL HA 1 1 14 5934 1 1 5 VAL HB H 7.649 -3.812 -1.720 1.00 . A A . 5 VAL HB 1 1 14 5935 1 1 5 VAL HG11 H 9.519 -4.070 -3.368 1.00 . A A . 5 VAL HG11 1 1 14 5936 1 1 5 VAL HG12 H 10.688 -3.721 -2.079 1.00 . A A . 5 VAL HG12 1 1 14 5937 1 1 5 VAL HG13 H 9.700 -5.192 -2.021 1.00 . A A . 5 VAL HG13 1 1 14 5938 1 1 5 VAL HG21 H 9.909 -3.243 0.239 1.00 . A A . 5 VAL HG21 1 1 14 5939 1 1 5 VAL HG22 H 8.180 -3.170 0.620 1.00 . A A . 5 VAL HG22 1 1 14 5940 1 1 5 VAL HG23 H 8.921 -4.716 0.187 1.00 . A A . 5 VAL HG23 1 1 14 5941 1 1 5 VAL N N 7.690 -1.177 -0.930 1.00 . A A . 5 VAL N 1 1 14 5942 1 1 5 VAL O O 7.820 -2.389 -4.017 1.00 . A A . 5 VAL O 1 1 14 5943 1 1 6 ARG C C 6.893 -0.056 -5.497 1.00 . A A . 6 ARG C 1 1 14 5944 1 1 6 ARG CA C 8.190 0.423 -4.850 1.00 . A A . 6 ARG CA 1 1 14 5945 1 1 6 ARG CB C 9.456 0.341 -5.714 1.00 . A A . 6 ARG CB 1 1 14 5946 1 1 6 ARG CD C 11.386 0.743 -3.968 1.00 . A A . 6 ARG CD 1 1 14 5947 1 1 6 ARG CG C 10.591 1.250 -5.189 1.00 . A A . 6 ARG CG 1 1 14 5948 1 1 6 ARG CZ C 11.171 2.345 -2.015 1.00 . A A . 6 ARG CZ 1 1 14 5949 1 1 6 ARG H H 8.614 0.366 -2.802 1.00 . A A . 6 ARG H 1 1 14 5950 1 1 6 ARG HA H 8.017 1.479 -4.645 1.00 . A A . 6 ARG HA 1 1 14 5951 1 1 6 ARG HB2 H 9.780 -0.605 -5.719 1.00 . A A . 6 ARG HB2 1 1 14 5952 1 1 6 ARG HB3 H 9.227 0.621 -6.646 1.00 . A A . 6 ARG HB3 1 1 14 5953 1 1 6 ARG HD2 H 11.352 -0.256 -3.966 1.00 . A A . 6 ARG HD2 1 1 14 5954 1 1 6 ARG HD3 H 12.335 1.044 -4.066 1.00 . A A . 6 ARG HD3 1 1 14 5955 1 1 6 ARG HE H 10.318 0.623 -2.080 1.00 . A A . 6 ARG HE 1 1 14 5956 1 1 6 ARG HG2 H 11.241 1.384 -5.937 1.00 . A A . 6 ARG HG2 1 1 14 5957 1 1 6 ARG HG3 H 10.183 2.128 -4.940 1.00 . A A . 6 ARG HG3 1 1 14 5958 1 1 6 ARG HH11 H 12.185 3.254 -3.485 1.00 . A A . 6 ARG HH11 1 1 14 5959 1 1 6 ARG HH12 H 12.043 4.149 -2.008 1.00 . A A . 6 ARG HH12 1 1 14 5960 1 1 6 ARG HH21 H 10.204 1.808 -0.345 1.00 . A A . 6 ARG HH21 1 1 14 5961 1 1 6 ARG HH22 H 10.966 3.363 -0.302 1.00 . A A . 6 ARG HH22 1 1 14 5962 1 1 6 ARG N N 8.423 -0.251 -3.574 1.00 . A A . 6 ARG N 1 1 14 5963 1 1 6 ARG NE N 10.881 1.225 -2.665 1.00 . A A . 6 ARG NE 1 1 14 5964 1 1 6 ARG NH1 N 11.853 3.326 -2.544 1.00 . A A . 6 ARG NH1 1 1 14 5965 1 1 6 ARG NH2 N 10.747 2.519 -0.792 1.00 . A A . 6 ARG NH2 1 1 14 5966 1 1 6 ARG O O 6.823 -0.362 -6.690 1.00 . A A . 6 ARG O 1 1 14 5967 1 1 7 GLY C C 4.089 -1.950 -4.356 1.00 . A A . 7 GLY C 1 1 14 5968 1 1 7 GLY CA C 4.515 -0.594 -4.940 1.00 . A A . 7 GLY CA 1 1 14 5969 1 1 7 GLY H H 6.129 0.088 -3.690 1.00 . A A . 7 GLY H 1 1 14 5970 1 1 7 GLY HA2 H 3.834 0.160 -4.548 1.00 . A A . 7 GLY HA2 1 1 14 5971 1 1 7 GLY HA3 H 4.364 -0.619 -6.018 1.00 . A A . 7 GLY HA3 1 1 14 5972 1 1 7 GLY N N 5.885 -0.184 -4.633 1.00 . A A . 7 GLY N 1 1 14 5973 1 1 7 GLY O O 2.921 -2.306 -4.472 1.00 . A A . 7 GLY O 1 1 14 5974 1 1 8 ARG C C 4.856 -3.572 -1.442 1.00 . A A . 8 ARG C 1 1 14 5975 1 1 8 ARG CA C 4.648 -3.895 -2.922 1.00 . A A . 8 ARG CA 1 1 14 5976 1 1 8 ARG CB C 5.539 -5.073 -3.356 1.00 . A A . 8 ARG CB 1 1 14 5977 1 1 8 ARG CD C 5.698 -5.532 -5.881 1.00 . A A . 8 ARG CD 1 1 14 5978 1 1 8 ARG CG C 5.007 -5.873 -4.555 1.00 . A A . 8 ARG CG 1 1 14 5979 1 1 8 ARG CZ C 5.817 -3.251 -6.880 1.00 . A A . 8 ARG CZ 1 1 14 5980 1 1 8 ARG H H 5.948 -2.382 -3.619 1.00 . A A . 8 ARG H 1 1 14 5981 1 1 8 ARG HA H 3.597 -4.165 -3.037 1.00 . A A . 8 ARG HA 1 1 14 5982 1 1 8 ARG HB2 H 6.439 -4.710 -3.598 1.00 . A A . 8 ARG HB2 1 1 14 5983 1 1 8 ARG HB3 H 5.629 -5.698 -2.580 1.00 . A A . 8 ARG HB3 1 1 14 5984 1 1 8 ARG HD2 H 6.671 -5.381 -5.706 1.00 . A A . 8 ARG HD2 1 1 14 5985 1 1 8 ARG HD3 H 5.587 -6.303 -6.508 1.00 . A A . 8 ARG HD3 1 1 14 5986 1 1 8 ARG HE H 4.165 -4.356 -6.764 1.00 . A A . 8 ARG HE 1 1 14 5987 1 1 8 ARG HG2 H 5.143 -6.846 -4.370 1.00 . A A . 8 ARG HG2 1 1 14 5988 1 1 8 ARG HG3 H 4.030 -5.685 -4.651 1.00 . A A . 8 ARG HG3 1 1 14 5989 1 1 8 ARG HH11 H 7.491 -3.631 -5.845 1.00 . A A . 8 ARG HH11 1 1 14 5990 1 1 8 ARG HH12 H 7.502 -2.171 -6.776 1.00 . A A . 8 ARG HH12 1 1 14 5991 1 1 8 ARG HH21 H 4.325 -2.454 -7.959 1.00 . A A . 8 ARG HH21 1 1 14 5992 1 1 8 ARG HH22 H 5.792 -1.534 -7.917 1.00 . A A . 8 ARG HH22 1 1 14 5993 1 1 8 ARG N N 4.990 -2.706 -3.714 1.00 . A A . 8 ARG N 1 1 14 5994 1 1 8 ARG NE N 5.139 -4.326 -6.511 1.00 . A A . 8 ARG NE 1 1 14 5995 1 1 8 ARG NH1 N 7.032 -2.998 -6.468 1.00 . A A . 8 ARG NH1 1 1 14 5996 1 1 8 ARG NH2 N 5.268 -2.341 -7.646 1.00 . A A . 8 ARG NH2 1 1 14 5997 1 1 8 ARG O O 5.342 -2.496 -1.116 1.00 . A A . 8 ARG O 1 1 14 5998 1 1 9 CYS C C 5.156 -5.946 1.307 1.00 . A A . 9 CYS C 1 1 14 5999 1 1 9 CYS CA C 5.071 -4.497 0.814 1.00 . A A . 9 CYS CA 1 1 14 6000 1 1 9 CYS CB C 4.165 -3.629 1.688 1.00 . A A . 9 CYS CB 1 1 14 6001 1 1 9 CYS H H 4.100 -5.361 -0.820 1.00 . A A . 9 CYS H 1 1 14 6002 1 1 9 CYS HA H 6.080 -4.085 0.822 1.00 . A A . 9 CYS HA 1 1 14 6003 1 1 9 CYS HB2 H 3.288 -3.514 1.222 1.00 . A A . 9 CYS HB2 1 1 14 6004 1 1 9 CYS HB3 H 4.021 -4.096 2.560 1.00 . A A . 9 CYS HB3 1 1 14 6005 1 1 9 CYS N N 4.557 -4.504 -0.545 1.00 . A A . 9 CYS N 1 1 14 6006 1 1 9 CYS O O 4.616 -6.830 0.643 1.00 . A A . 9 CYS O 1 1 14 6007 1 1 9 CYS SG S 4.865 -1.987 2.019 1.00 . A A . 9 CYS SG 1 1 14 6008 1 1 10 PRO C C 4.600 -7.927 3.696 1.00 . A A . 10 PRO C 1 1 14 6009 1 1 10 PRO CA C 5.913 -7.543 3.009 1.00 . A A . 10 PRO CA 1 1 14 6010 1 1 10 PRO CB C 7.071 -7.475 4.007 1.00 . A A . 10 PRO CB 1 1 14 6011 1 1 10 PRO CD C 6.617 -5.261 3.210 1.00 . A A . 10 PRO CD 1 1 14 6012 1 1 10 PRO CG C 7.039 -6.017 4.469 1.00 . A A . 10 PRO CG 1 1 14 6013 1 1 10 PRO HA H 6.136 -8.276 2.234 1.00 . A A . 10 PRO HA 1 1 14 6014 1 1 10 PRO HB2 H 6.922 -8.099 4.774 1.00 . A A . 10 PRO HB2 1 1 14 6015 1 1 10 PRO HB3 H 7.941 -7.693 3.564 1.00 . A A . 10 PRO HB3 1 1 14 6016 1 1 10 PRO HD2 H 6.063 -4.464 3.450 1.00 . A A . 10 PRO HD2 1 1 14 6017 1 1 10 PRO HD3 H 7.421 -4.965 2.694 1.00 . A A . 10 PRO HD3 1 1 14 6018 1 1 10 PRO HG2 H 6.374 -5.888 5.204 1.00 . A A . 10 PRO HG2 1 1 14 6019 1 1 10 PRO HG3 H 7.942 -5.720 4.780 1.00 . A A . 10 PRO HG3 1 1 14 6020 1 1 10 PRO N N 5.835 -6.209 2.434 1.00 . A A . 10 PRO N 1 1 14 6021 1 1 10 PRO O O 3.750 -7.078 3.961 1.00 . A A . 10 PRO O 1 1 14 6022 1 1 11 SER C C 2.006 -9.500 3.698 1.00 . A A . 11 SER C 1 1 14 6023 1 1 11 SER CA C 3.226 -9.782 4.578 1.00 . A A . 11 SER CA 1 1 14 6024 1 1 11 SER CB C 3.052 -9.284 6.009 1.00 . A A . 11 SER CB 1 1 14 6025 1 1 11 SER H H 5.241 -9.831 3.893 1.00 . A A . 11 SER H 1 1 14 6026 1 1 11 SER HA H 3.313 -10.865 4.629 1.00 . A A . 11 SER HA 1 1 14 6027 1 1 11 SER HB2 H 3.902 -9.427 6.516 1.00 . A A . 11 SER HB2 1 1 14 6028 1 1 11 SER HB3 H 2.831 -8.309 5.996 1.00 . A A . 11 SER HB3 1 1 14 6029 1 1 11 SER HG H 2.054 -9.837 7.590 1.00 . A A . 11 SER HG 1 1 14 6030 1 1 11 SER N N 4.460 -9.215 4.032 1.00 . A A . 11 SER N 1 1 14 6031 1 1 11 SER O O 2.109 -9.052 2.560 1.00 . A A . 11 SER O 1 1 14 6032 1 1 11 SER OG O 2.003 -9.995 6.642 1.00 . A A . 11 SER OG 1 1 14 6033 1 1 12 GLY C C -0.809 -8.069 3.284 1.00 . A A . 12 GLY C 1 1 14 6034 1 1 12 GLY CA C -0.463 -9.544 3.550 1.00 . A A . 12 GLY CA 1 1 14 6035 1 1 12 GLY H H 0.865 -10.121 5.180 1.00 . A A . 12 GLY H 1 1 14 6036 1 1 12 GLY HA2 H -0.449 -10.062 2.591 1.00 . A A . 12 GLY HA2 1 1 14 6037 1 1 12 GLY HA3 H -1.260 -9.975 4.155 1.00 . A A . 12 GLY HA3 1 1 14 6038 1 1 12 GLY N N 0.818 -9.768 4.228 1.00 . A A . 12 GLY N 1 1 14 6039 1 1 12 GLY O O -1.991 -7.728 3.209 1.00 . A A . 12 GLY O 1 1 14 6040 1 1 13 MET C C -0.202 -5.346 1.585 1.00 . A A . 13 MET C 1 1 14 6041 1 1 13 MET CA C -0.061 -5.742 3.054 1.00 . A A . 13 MET CA 1 1 14 6042 1 1 13 MET CB C 1.098 -4.965 3.686 1.00 . A A . 13 MET CB 1 1 14 6043 1 1 13 MET CE C 0.804 -5.733 7.802 1.00 . A A . 13 MET CE 1 1 14 6044 1 1 13 MET CG C 1.382 -5.383 5.132 1.00 . A A . 13 MET CG 1 1 14 6045 1 1 13 MET H H 1.123 -7.517 3.052 1.00 . A A . 13 MET H 1 1 14 6046 1 1 13 MET HA H -0.982 -5.476 3.572 1.00 . A A . 13 MET HA 1 1 14 6047 1 1 13 MET HB2 H 1.922 -5.123 3.141 1.00 . A A . 13 MET HB2 1 1 14 6048 1 1 13 MET HB3 H 0.872 -3.991 3.675 1.00 . A A . 13 MET HB3 1 1 14 6049 1 1 13 MET HE1 H 1.688 -5.130 8.016 1.00 . A A . 13 MET HE1 1 1 14 6050 1 1 13 MET HE2 H 0.105 -5.656 8.634 1.00 . A A . 13 MET HE2 1 1 14 6051 1 1 13 MET HE3 H 1.099 -6.775 7.671 1.00 . A A . 13 MET HE3 1 1 14 6052 1 1 13 MET HG2 H 1.614 -6.356 5.133 1.00 . A A . 13 MET HG2 1 1 14 6053 1 1 13 MET HG3 H 2.164 -4.853 5.460 1.00 . A A . 13 MET HG3 1 1 14 6054 1 1 13 MET N N 0.176 -7.174 3.189 1.00 . A A . 13 MET N 1 1 14 6055 1 1 13 MET O O 0.208 -6.067 0.681 1.00 . A A . 13 MET O 1 1 14 6056 1 1 13 MET SD S 0.012 -5.133 6.288 1.00 . A A . 13 MET SD 1 1 14 6057 1 1 14 CYS C C -0.521 -2.134 0.050 1.00 . A A . 14 CYS C 1 1 14 6058 1 1 14 CYS CA C -0.963 -3.605 0.019 1.00 . A A . 14 CYS CA 1 1 14 6059 1 1 14 CYS CB C -2.448 -3.772 -0.345 1.00 . A A . 14 CYS CB 1 1 14 6060 1 1 14 CYS H H -1.073 -3.606 2.139 1.00 . A A . 14 CYS H 1 1 14 6061 1 1 14 CYS HA H -0.354 -4.147 -0.706 1.00 . A A . 14 CYS HA 1 1 14 6062 1 1 14 CYS HB2 H -2.955 -3.015 0.066 1.00 . A A . 14 CYS HB2 1 1 14 6063 1 1 14 CYS HB3 H -2.530 -3.727 -1.341 1.00 . A A . 14 CYS HB3 1 1 14 6064 1 1 14 CYS N N -0.752 -4.159 1.350 1.00 . A A . 14 CYS N 1 1 14 6065 1 1 14 CYS O O -0.541 -1.524 1.119 1.00 . A A . 14 CYS O 1 1 14 6066 1 1 14 CYS SG S -3.208 -5.334 0.217 1.00 . A A . 14 CYS SG 1 1 14 6067 1 1 15 CYS C C -0.589 0.789 -1.707 1.00 . A A . 15 CYS C 1 1 14 6068 1 1 15 CYS CA C 0.448 -0.211 -1.166 1.00 . A A . 15 CYS CA 1 1 14 6069 1 1 15 CYS CB C 1.695 -0.267 -2.066 1.00 . A A . 15 CYS CB 1 1 14 6070 1 1 15 CYS H H -0.189 -2.090 -1.947 1.00 . A A . 15 CYS H 1 1 14 6071 1 1 15 CYS HA H 0.756 0.119 -0.177 1.00 . A A . 15 CYS HA 1 1 14 6072 1 1 15 CYS HB2 H 2.306 -0.969 -1.699 1.00 . A A . 15 CYS HB2 1 1 14 6073 1 1 15 CYS HB3 H 1.398 -0.530 -2.984 1.00 . A A . 15 CYS HB3 1 1 14 6074 1 1 15 CYS N N -0.108 -1.567 -1.088 1.00 . A A . 15 CYS N 1 1 14 6075 1 1 15 CYS O O -1.563 0.385 -2.337 1.00 . A A . 15 CYS O 1 1 14 6076 1 1 15 CYS SG S 2.642 1.276 -2.208 1.00 . A A . 15 CYS SG 1 1 14 6077 1 1 16 SER C C -0.431 4.069 -3.022 1.00 . A A . 16 SER C 1 1 14 6078 1 1 16 SER CA C -1.211 3.158 -2.072 1.00 . A A . 16 SER CA 1 1 14 6079 1 1 16 SER CB C -1.814 4.008 -0.947 1.00 . A A . 16 SER CB 1 1 14 6080 1 1 16 SER H H 0.394 2.368 -0.896 1.00 . A A . 16 SER H 1 1 14 6081 1 1 16 SER HA H -2.031 2.706 -2.631 1.00 . A A . 16 SER HA 1 1 14 6082 1 1 16 SER HB2 H -2.639 4.461 -1.286 1.00 . A A . 16 SER HB2 1 1 14 6083 1 1 16 SER HB3 H -2.052 3.413 -0.180 1.00 . A A . 16 SER HB3 1 1 14 6084 1 1 16 SER HG H -1.142 5.226 0.412 1.00 . A A . 16 SER HG 1 1 14 6085 1 1 16 SER N N -0.378 2.095 -1.500 1.00 . A A . 16 SER N 1 1 14 6086 1 1 16 SER O O 0.801 4.097 -3.025 1.00 . A A . 16 SER O 1 1 14 6087 1 1 16 SER OG O -0.896 4.992 -0.502 1.00 . A A . 16 SER OG 1 1 14 6088 1 1 17 GLN C C 0.320 6.940 -3.803 1.00 . A A . 17 GLN C 1 1 14 6089 1 1 17 GLN CA C -0.581 5.977 -4.585 1.00 . A A . 17 GLN CA 1 1 14 6090 1 1 17 GLN CB C -1.712 6.792 -5.223 1.00 . A A . 17 GLN CB 1 1 14 6091 1 1 17 GLN CD C -3.572 6.897 -6.895 1.00 . A A . 17 GLN CD 1 1 14 6092 1 1 17 GLN CG C -2.445 6.036 -6.334 1.00 . A A . 17 GLN CG 1 1 14 6093 1 1 17 GLN H H -2.163 4.872 -3.698 1.00 . A A . 17 GLN H 1 1 14 6094 1 1 17 GLN HA H 0.027 5.531 -5.373 1.00 . A A . 17 GLN HA 1 1 14 6095 1 1 17 GLN HB2 H -2.373 7.031 -4.511 1.00 . A A . 17 GLN HB2 1 1 14 6096 1 1 17 GLN HB3 H -1.322 7.628 -5.610 1.00 . A A . 17 GLN HB3 1 1 14 6097 1 1 17 GLN HE21 H -2.853 6.863 -8.800 1.00 . A A . 17 GLN HE21 1 1 14 6098 1 1 17 GLN HE22 H -4.341 7.757 -8.503 1.00 . A A . 17 GLN HE22 1 1 14 6099 1 1 17 GLN HG2 H -1.800 5.817 -7.066 1.00 . A A . 17 GLN HG2 1 1 14 6100 1 1 17 GLN HG3 H -2.828 5.191 -5.962 1.00 . A A . 17 GLN HG3 1 1 14 6101 1 1 17 GLN N N -1.159 4.919 -3.756 1.00 . A A . 17 GLN N 1 1 14 6102 1 1 17 GLN NE2 N -3.579 7.185 -8.181 1.00 . A A . 17 GLN NE2 1 1 14 6103 1 1 17 GLN O O 1.069 7.697 -4.408 1.00 . A A . 17 GLN O 1 1 14 6104 1 1 17 GLN OE1 O -4.465 7.311 -6.165 1.00 . A A . 17 GLN OE1 1 1 14 6105 1 1 18 . C C 2.416 7.093 -1.235 1.00 . A A . 18 PFF C 1 1 14 6106 1 1 18 . CA C 1.110 7.780 -1.642 1.00 . A A . 18 PFF CA 1 1 14 6107 1 1 18 . CB C 0.276 8.218 -0.438 1.00 . A A . 18 PFF CB 1 1 14 6108 1 1 18 . CD1 C -0.905 10.204 -1.458 1.00 . A A . 18 PFF CD1 1 1 14 6109 1 1 18 . CD2 C -2.196 8.199 -0.979 1.00 . A A . 18 PFF CD2 1 1 14 6110 1 1 18 . CE1 C -1.995 10.732 -2.174 1.00 . A A . 18 PFF CE1 1 1 14 6111 1 1 18 . CE2 C -3.298 8.745 -1.661 1.00 . A A . 18 PFF CE2 1 1 14 6112 1 1 18 . CG C -0.993 8.925 -0.880 1.00 . A A . 18 PFF CG 1 1 14 6113 1 1 18 . CZ C -3.185 9.994 -2.293 1.00 . A A . 18 PFF CZ 1 1 14 6114 1 1 18 . F F -4.235 10.502 -2.989 1.00 . A A . 18 PFF F 1 1 14 6115 1 1 18 . H H -0.317 6.245 -1.987 1.00 . A A . 18 PFF H 1 1 14 6116 1 1 18 . HA H 1.382 8.674 -2.205 1.00 . A A . 18 PFF HA 1 1 14 6117 1 1 18 . HB2 H 0.007 7.327 0.126 1.00 . A A . 18 PFF HB2 1 1 14 6118 1 1 18 . HB3 H 0.873 8.859 0.213 1.00 . A A . 18 PFF HB3 1 1 14 6119 1 1 18 . HD1 H 0.027 10.749 -1.424 1.00 . A A . 18 PFF HD1 1 1 14 6120 1 1 18 . HD2 H -2.273 7.214 -0.545 1.00 . A A . 18 PFF HD2 1 1 14 6121 1 1 18 . HE1 H -1.911 11.698 -2.653 1.00 . A A . 18 PFF HE1 1 1 14 6122 1 1 18 . HE2 H -4.226 8.195 -1.716 1.00 . A A . 18 PFF HE2 1 1 14 6123 1 1 18 . N N 0.277 6.917 -2.468 1.00 . A A . 18 PFF N 1 1 14 6124 1 1 18 . O O 3.191 7.650 -0.462 1.00 . A A . 18 PFF O 1 1 14 6125 1 1 19 GLY C C 3.791 4.579 0.071 1.00 . A A . 19 GLY C 1 1 14 6126 1 1 19 GLY CA C 3.869 5.137 -1.349 1.00 . A A . 19 GLY CA 1 1 14 6127 1 1 19 GLY H H 1.988 5.413 -2.328 1.00 . A A . 19 GLY H 1 1 14 6128 1 1 19 GLY HA2 H 4.009 4.304 -2.037 1.00 . A A . 19 GLY HA2 1 1 14 6129 1 1 19 GLY HA3 H 4.736 5.794 -1.416 1.00 . A A . 19 GLY HA3 1 1 14 6130 1 1 19 GLY N N 2.667 5.870 -1.721 1.00 . A A . 19 GLY N 1 1 14 6131 1 1 19 GLY O O 4.790 4.119 0.611 1.00 . A A . 19 GLY O 1 1 14 6132 1 1 20 . C C 1.704 2.622 1.815 1.00 . A A . 20 PFF C 1 1 14 6133 1 1 20 . CA C 2.421 3.965 1.990 1.00 . A A . 20 PFF CA 1 1 14 6134 1 1 20 . CB C 1.566 4.925 2.814 1.00 . A A . 20 PFF CB 1 1 14 6135 1 1 20 . CD1 C 3.424 6.425 3.640 1.00 . A A . 20 PFF CD1 1 1 14 6136 1 1 20 . CD2 C 1.432 7.468 2.723 1.00 . A A . 20 PFF CD2 1 1 14 6137 1 1 20 . CE1 C 3.887 7.680 4.068 1.00 . A A . 20 PFF CE1 1 1 14 6138 1 1 20 . CE2 C 1.900 8.727 3.134 1.00 . A A . 20 PFF CE2 1 1 14 6139 1 1 20 . CG C 2.164 6.304 3.031 1.00 . A A . 20 PFF CG 1 1 14 6140 1 1 20 . CZ C 3.104 8.825 3.852 1.00 . A A . 20 PFF CZ 1 1 14 6141 1 1 20 . F F 3.557 10.041 4.252 1.00 . A A . 20 PFF F 1 1 14 6142 1 1 20 . H H 1.791 4.919 0.221 1.00 . A A . 20 PFF H 1 1 14 6143 1 1 20 . HA H 3.388 3.798 2.474 1.00 . A A . 20 PFF HA 1 1 14 6144 1 1 20 . HB2 H 0.605 5.027 2.312 1.00 . A A . 20 PFF HB2 1 1 14 6145 1 1 20 . HB3 H 1.392 4.469 3.781 1.00 . A A . 20 PFF HB3 1 1 14 6146 1 1 20 . HD1 H 4.029 5.549 3.783 1.00 . A A . 20 PFF HD1 1 1 14 6147 1 1 20 . HD2 H 0.476 7.399 2.232 1.00 . A A . 20 PFF HD2 1 1 14 6148 1 1 20 . HE1 H 4.845 7.765 4.561 1.00 . A A . 20 PFF HE1 1 1 14 6149 1 1 20 . HE2 H 1.334 9.617 2.910 1.00 . A A . 20 PFF HE2 1 1 14 6150 1 1 20 . N N 2.616 4.585 0.694 1.00 . A A . 20 PFF N 1 1 14 6151 1 1 20 . O O 1.012 2.419 0.816 1.00 . A A . 20 PFF O 1 1 14 6152 1 1 21 CYS C C 0.576 -0.064 3.996 1.00 . A A . 21 CYS C 1 1 14 6153 1 1 21 CYS CA C 1.179 0.404 2.675 1.00 . A A . 21 CYS CA 1 1 14 6154 1 1 21 CYS CB C 2.188 -0.622 2.141 1.00 . A A . 21 CYS CB 1 1 14 6155 1 1 21 CYS H H 2.365 1.905 3.609 1.00 . A A . 21 CYS H 1 1 14 6156 1 1 21 CYS HA H 0.354 0.480 1.970 1.00 . A A . 21 CYS HA 1 1 14 6157 1 1 21 CYS HB2 H 1.685 -1.457 1.919 1.00 . A A . 21 CYS HB2 1 1 14 6158 1 1 21 CYS HB3 H 2.594 -0.246 1.308 1.00 . A A . 21 CYS HB3 1 1 14 6159 1 1 21 CYS N N 1.825 1.708 2.780 1.00 . A A . 21 CYS N 1 1 14 6160 1 1 21 CYS O O 0.880 0.473 5.058 1.00 . A A . 21 CYS O 1 1 14 6161 1 1 21 CYS SG S 3.536 -1.070 3.259 1.00 . A A . 21 CYS SG 1 1 14 6162 1 1 22 GLY C C -1.944 -2.727 4.635 1.00 . A A . 22 GLY C 1 1 14 6163 1 1 22 GLY CA C -0.899 -1.706 5.072 1.00 . A A . 22 GLY CA 1 1 14 6164 1 1 22 GLY H H -0.525 -1.427 2.985 1.00 . A A . 22 GLY H 1 1 14 6165 1 1 22 GLY HA2 H -0.139 -2.204 5.675 1.00 . A A . 22 GLY HA2 1 1 14 6166 1 1 22 GLY HA3 H -1.377 -0.935 5.676 1.00 . A A . 22 GLY HA3 1 1 14 6167 1 1 22 GLY N N -0.266 -1.092 3.914 1.00 . A A . 22 GLY N 1 1 14 6168 1 1 22 GLY O O -2.135 -2.954 3.441 1.00 . A A . 22 GLY O 1 1 14 6169 1 1 23 LYS C C -4.886 -3.908 4.672 1.00 . A A . 23 LYS C 1 1 14 6170 1 1 23 LYS CA C -3.591 -4.428 5.278 1.00 . A A . 23 LYS CA 1 1 14 6171 1 1 23 LYS CB C -3.869 -5.247 6.551 1.00 . A A . 23 LYS CB 1 1 14 6172 1 1 23 LYS CD C -4.166 -7.616 5.601 1.00 . A A . 23 LYS CD 1 1 14 6173 1 1 23 LYS CE C -4.922 -8.020 4.326 1.00 . A A . 23 LYS CE 1 1 14 6174 1 1 23 LYS CG C -4.814 -6.447 6.357 1.00 . A A . 23 LYS CG 1 1 14 6175 1 1 23 LYS H H -2.351 -3.212 6.552 1.00 . A A . 23 LYS H 1 1 14 6176 1 1 23 LYS HA H -3.150 -5.053 4.525 1.00 . A A . 23 LYS HA 1 1 14 6177 1 1 23 LYS HB2 H -2.996 -5.592 6.895 1.00 . A A . 23 LYS HB2 1 1 14 6178 1 1 23 LYS HB3 H -4.278 -4.637 7.230 1.00 . A A . 23 LYS HB3 1 1 14 6179 1 1 23 LYS HD2 H -3.236 -7.351 5.346 1.00 . A A . 23 LYS HD2 1 1 14 6180 1 1 23 LYS HD3 H -4.132 -8.407 6.212 1.00 . A A . 23 LYS HD3 1 1 14 6181 1 1 23 LYS HE2 H -4.654 -8.950 4.076 1.00 . A A . 23 LYS HE2 1 1 14 6182 1 1 23 LYS HE3 H -5.904 -7.995 4.514 1.00 . A A . 23 LYS HE3 1 1 14 6183 1 1 23 LYS HG2 H -5.102 -6.773 7.258 1.00 . A A . 23 LYS HG2 1 1 14 6184 1 1 23 LYS HG3 H -5.614 -6.140 5.841 1.00 . A A . 23 LYS HG3 1 1 14 6185 1 1 23 LYS HZ1 H -4.961 -6.177 3.376 1.00 . A A . 23 LYS HZ1 1 1 14 6186 1 1 23 LYS HZ2 H -3.628 -7.105 3.018 1.00 . A A . 23 LYS HZ2 1 1 14 6187 1 1 23 LYS HZ3 H -5.083 -7.446 2.342 1.00 . A A . 23 LYS HZ3 1 1 14 6188 1 1 23 LYS N N -2.623 -3.369 5.591 1.00 . A A . 23 LYS N 1 1 14 6189 1 1 23 LYS NZ N -4.634 -7.120 3.185 1.00 . A A . 23 LYS NZ 1 1 14 6190 1 1 23 LYS O O -5.522 -4.590 3.871 1.00 . A A . 23 LYS O 1 1 14 6191 1 1 24 GLY C C -7.157 -1.704 3.773 1.00 . A A . 24 GLY C 1 1 14 6192 1 1 24 GLY CA C -6.662 -2.273 5.109 1.00 . A A . 24 GLY CA 1 1 14 6193 1 1 24 GLY H H -4.590 -2.325 5.733 1.00 . A A . 24 GLY H 1 1 14 6194 1 1 24 GLY HA2 H -7.284 -3.124 5.384 1.00 . A A . 24 GLY HA2 1 1 14 6195 1 1 24 GLY HA3 H -6.787 -1.503 5.872 1.00 . A A . 24 GLY HA3 1 1 14 6196 1 1 24 GLY N N -5.273 -2.725 5.116 1.00 . A A . 24 GLY N 1 1 14 6197 1 1 24 GLY O O -6.361 -1.332 2.904 1.00 . A A . 24 GLY O 1 1 14 6198 1 1 25 PRO C C -8.554 0.200 1.853 1.00 . A A . 25 PRO C 1 1 14 6199 1 1 25 PRO CA C -9.141 -1.091 2.415 1.00 . A A . 25 PRO CA 1 1 14 6200 1 1 25 PRO CB C -10.615 -0.912 2.785 1.00 . A A . 25 PRO CB 1 1 14 6201 1 1 25 PRO CD C -9.490 -1.955 4.611 1.00 . A A . 25 PRO CD 1 1 14 6202 1 1 25 PRO CG C -10.820 -1.973 3.862 1.00 . A A . 25 PRO CG 1 1 14 6203 1 1 25 PRO HA H -9.061 -1.870 1.655 1.00 . A A . 25 PRO HA 1 1 14 6204 1 1 25 PRO HB2 H -10.788 0.005 3.144 1.00 . A A . 25 PRO HB2 1 1 14 6205 1 1 25 PRO HB3 H -11.208 -1.079 1.997 1.00 . A A . 25 PRO HB3 1 1 14 6206 1 1 25 PRO HD2 H -9.521 -1.292 5.359 1.00 . A A . 25 PRO HD2 1 1 14 6207 1 1 25 PRO HD3 H -9.284 -2.863 4.977 1.00 . A A . 25 PRO HD3 1 1 14 6208 1 1 25 PRO HG2 H -11.578 -1.730 4.468 1.00 . A A . 25 PRO HG2 1 1 14 6209 1 1 25 PRO HG3 H -10.992 -2.870 3.455 1.00 . A A . 25 PRO HG3 1 1 14 6210 1 1 25 PRO N N -8.488 -1.565 3.629 1.00 . A A . 25 PRO N 1 1 14 6211 1 1 25 PRO O O -8.384 0.313 0.643 1.00 . A A . 25 PRO O 1 1 14 6212 1 1 26 LYS C C -6.273 2.243 1.480 1.00 . A A . 26 LYS C 1 1 14 6213 1 1 26 LYS CA C -7.575 2.412 2.241 1.00 . A A . 26 LYS CA 1 1 14 6214 1 1 26 LYS CB C -7.340 3.363 3.417 1.00 . A A . 26 LYS CB 1 1 14 6215 1 1 26 LYS CD C -8.995 5.146 2.594 1.00 . A A . 26 LYS CD 1 1 14 6216 1 1 26 LYS CE C -7.889 6.133 2.181 1.00 . A A . 26 LYS CE 1 1 14 6217 1 1 26 LYS CG C -8.590 4.187 3.731 1.00 . A A . 26 LYS CG 1 1 14 6218 1 1 26 LYS H H -8.319 1.024 3.694 1.00 . A A . 26 LYS H 1 1 14 6219 1 1 26 LYS HA H -8.260 2.851 1.524 1.00 . A A . 26 LYS HA 1 1 14 6220 1 1 26 LYS HB2 H -7.093 2.827 4.224 1.00 . A A . 26 LYS HB2 1 1 14 6221 1 1 26 LYS HB3 H -6.591 3.984 3.187 1.00 . A A . 26 LYS HB3 1 1 14 6222 1 1 26 LYS HD2 H -9.242 4.598 1.794 1.00 . A A . 26 LYS HD2 1 1 14 6223 1 1 26 LYS HD3 H -9.789 5.673 2.896 1.00 . A A . 26 LYS HD3 1 1 14 6224 1 1 26 LYS HE2 H -8.324 6.992 1.910 1.00 . A A . 26 LYS HE2 1 1 14 6225 1 1 26 LYS HE3 H -7.301 6.292 2.974 1.00 . A A . 26 LYS HE3 1 1 14 6226 1 1 26 LYS HG2 H -9.349 3.558 3.900 1.00 . A A . 26 LYS HG2 1 1 14 6227 1 1 26 LYS HG3 H -8.414 4.728 4.554 1.00 . A A . 26 LYS HG3 1 1 14 6228 1 1 26 LYS HZ1 H -6.528 4.811 1.246 1.00 . A A . 26 LYS HZ1 1 1 14 6229 1 1 26 LYS HZ2 H -7.568 5.483 0.211 1.00 . A A . 26 LYS HZ2 1 1 14 6230 1 1 26 LYS HZ3 H -6.351 6.409 0.856 1.00 . A A . 26 LYS HZ3 1 1 14 6231 1 1 26 LYS N N -8.167 1.158 2.707 1.00 . A A . 26 LYS N 1 1 14 6232 1 1 26 LYS NZ N -7.032 5.672 1.054 1.00 . A A . 26 LYS NZ 1 1 14 6233 1 1 26 LYS O O -5.922 3.162 0.741 1.00 . A A . 26 LYS O 1 1 14 6234 1 1 27 TYR C C -5.077 -0.257 -0.272 1.00 . A A . 27 TYR C 1 1 14 6235 1 1 27 TYR CA C -4.514 0.713 0.760 1.00 . A A . 27 TYR CA 1 1 14 6236 1 1 27 TYR CB C -3.390 0.055 1.572 1.00 . A A . 27 TYR CB 1 1 14 6237 1 1 27 TYR CD1 C -2.037 1.817 2.788 1.00 . A A . 27 TYR CD1 1 1 14 6238 1 1 27 TYR CD2 C -3.564 0.425 4.070 1.00 . A A . 27 TYR CD2 1 1 14 6239 1 1 27 TYR CE1 C -1.585 2.418 3.978 1.00 . A A . 27 TYR CE1 1 1 14 6240 1 1 27 TYR CE2 C -3.181 1.096 5.246 1.00 . A A . 27 TYR CE2 1 1 14 6241 1 1 27 TYR CG C -2.990 0.786 2.838 1.00 . A A . 27 TYR CG 1 1 14 6242 1 1 27 TYR CZ C -2.182 2.079 5.200 1.00 . A A . 27 TYR CZ 1 1 14 6243 1 1 27 TYR H H -5.960 0.412 2.284 1.00 . A A . 27 TYR H 1 1 14 6244 1 1 27 TYR HA H -4.110 1.583 0.239 1.00 . A A . 27 TYR HA 1 1 14 6245 1 1 27 TYR HB2 H -3.691 -0.863 1.828 1.00 . A A . 27 TYR HB2 1 1 14 6246 1 1 27 TYR HB3 H -2.583 -0.010 0.985 1.00 . A A . 27 TYR HB3 1 1 14 6247 1 1 27 TYR HD1 H -1.691 2.171 1.834 1.00 . A A . 27 TYR HD1 1 1 14 6248 1 1 27 TYR HD2 H -4.306 -0.358 4.104 1.00 . A A . 27 TYR HD2 1 1 14 6249 1 1 27 TYR HE1 H -0.811 3.171 3.953 1.00 . A A . 27 TYR HE1 1 1 14 6250 1 1 27 TYR HE2 H -3.637 0.867 6.198 1.00 . A A . 27 TYR HE2 1 1 14 6251 1 1 27 TYR HH H -1.160 3.406 6.174 1.00 . A A . 27 TYR HH 1 1 14 6252 1 1 27 TYR N N -5.600 1.108 1.638 1.00 . A A . 27 TYR N 1 1 14 6253 1 1 27 TYR O O -5.117 0.025 -1.466 1.00 . A A . 27 TYR O 1 1 14 6254 1 1 27 TYR OH O -1.872 2.770 6.327 1.00 . A A . 27 TYR OH 1 1 14 6255 1 1 28 CYS C C -6.977 -2.546 -1.512 1.00 . A A . 28 CYS C 1 1 14 6256 1 1 28 CYS CA C -5.738 -2.586 -0.607 1.00 . A A . 28 CYS CA 1 1 14 6257 1 1 28 CYS CB C -5.754 -3.770 0.356 1.00 . A A . 28 CYS CB 1 1 14 6258 1 1 28 CYS H H -5.717 -1.488 1.204 1.00 . A A . 28 CYS H 1 1 14 6259 1 1 28 CYS HA H -4.868 -2.678 -1.258 1.00 . A A . 28 CYS HA 1 1 14 6260 1 1 28 CYS HB2 H -5.176 -3.554 1.143 1.00 . A A . 28 CYS HB2 1 1 14 6261 1 1 28 CYS HB3 H -6.693 -3.922 0.664 1.00 . A A . 28 CYS HB3 1 1 14 6262 1 1 28 CYS N N -5.577 -1.396 0.204 1.00 . A A . 28 CYS N 1 1 14 6263 1 1 28 CYS O O -7.053 -3.278 -2.493 1.00 . A A . 28 CYS O 1 1 14 6264 1 1 28 CYS SG S -5.143 -5.281 -0.418 1.00 . A A . 28 CYS SG 1 1 14 6265 1 1 29 GLY C C -8.880 0.289 -2.411 1.00 . A A . 29 GLY C 1 1 14 6266 1 1 29 GLY CA C -8.970 -1.213 -2.130 1.00 . A A . 29 GLY CA 1 1 14 6267 1 1 29 GLY H H -7.799 -1.082 -0.381 1.00 . A A . 29 GLY H 1 1 14 6268 1 1 29 GLY HA2 H -8.902 -1.749 -3.078 1.00 . A A . 29 GLY HA2 1 1 14 6269 1 1 29 GLY HA3 H -9.938 -1.426 -1.677 1.00 . A A . 29 GLY HA3 1 1 14 6270 1 1 29 GLY N N -7.908 -1.636 -1.224 1.00 . A A . 29 GLY N 1 1 14 6271 1 1 29 GLY O O -9.871 0.888 -2.820 1.00 . A A . 29 GLY O 1 1 14 6272 1 1 30 ARG C C -8.251 3.362 -1.572 1.00 . A A . 30 ARG C 1 1 14 6273 1 1 30 ARG CA C -7.389 2.333 -2.332 1.00 . A A . 30 ARG CA 1 1 14 6274 1 1 30 ARG CB C -7.361 2.578 -3.852 1.00 . A A . 30 ARG CB 1 1 14 6275 1 1 30 ARG CD C -5.674 4.471 -3.739 1.00 . A A . 30 ARG CD 1 1 14 6276 1 1 30 ARG CG C -7.032 4.010 -4.273 1.00 . A A . 30 ARG CG 1 1 14 6277 1 1 30 ARG CZ C -6.066 6.911 -3.520 1.00 . A A . 30 ARG CZ 1 1 14 6278 1 1 30 ARG H H -6.946 0.325 -1.849 1.00 . A A . 30 ARG H 1 1 14 6279 1 1 30 ARG HA H -6.377 2.448 -1.937 1.00 . A A . 30 ARG HA 1 1 14 6280 1 1 30 ARG HB2 H -6.672 1.972 -4.250 1.00 . A A . 30 ARG HB2 1 1 14 6281 1 1 30 ARG HB3 H -8.262 2.347 -4.219 1.00 . A A . 30 ARG HB3 1 1 14 6282 1 1 30 ARG HD2 H -5.654 4.360 -2.745 1.00 . A A . 30 ARG HD2 1 1 14 6283 1 1 30 ARG HD3 H -4.951 3.917 -4.151 1.00 . A A . 30 ARG HD3 1 1 14 6284 1 1 30 ARG HE H -4.963 6.117 -4.927 1.00 . A A . 30 ARG HE 1 1 14 6285 1 1 30 ARG HG2 H -7.018 4.057 -5.272 1.00 . A A . 30 ARG HG2 1 1 14 6286 1 1 30 ARG HG3 H -7.741 4.620 -3.920 1.00 . A A . 30 ARG HG3 1 1 14 6287 1 1 30 ARG HH11 H -6.995 5.890 -2.064 1.00 . A A . 30 ARG HH11 1 1 14 6288 1 1 30 ARG HH12 H -7.288 7.597 -2.085 1.00 . A A . 30 ARG HH12 1 1 14 6289 1 1 30 ARG HH21 H -5.367 8.228 -4.854 1.00 . A A . 30 ARG HH21 1 1 14 6290 1 1 30 ARG HH22 H -6.392 8.883 -3.622 1.00 . A A . 30 ARG HH22 1 1 14 6291 1 1 30 ARG N N -7.724 0.916 -2.132 1.00 . A A . 30 ARG N 1 1 14 6292 1 1 30 ARG NE N -5.456 5.880 -4.074 1.00 . A A . 30 ARG NE 1 1 14 6293 1 1 30 ARG NH1 N -6.844 6.790 -2.474 1.00 . A A . 30 ARG NH1 1 1 14 6294 1 1 30 ARG NH2 N -5.931 8.100 -4.039 1.00 . A A . 30 ARG NH2 1 1 14 6295 1 1 30 ARG O O -7.788 4.474 -1.291 1.00 . A A . 30 ARG O 1 1 14 6296 1 1 31 NH2 HN1 H -9.871 2.162 -1.495 1.00 . A A . 31 NH2 HN1 1 1 14 6297 1 1 31 NH2 HN2 H -10.041 3.720 -0.704 1.00 . A A . 31 NH2 HN2 1 1 14 6298 1 1 31 NH2 N N -9.476 3.040 -1.183 1.00 . A A . 31 NH2 N 1 1 14 6299 2 2 1 NAG C1 C -7.572 13.360 -1.768 1.00 . B A . 32 NAG C1 1 1 14 6300 2 2 1 NAG C2 C -7.272 11.894 -1.501 1.00 . B A . 32 NAG C2 1 1 14 6301 2 2 1 NAG C3 C -6.403 11.739 -0.241 1.00 . B A . 32 NAG C3 1 1 14 6302 2 2 1 NAG C4 C -5.165 12.674 -0.285 1.00 . B A . 32 NAG C4 1 1 14 6303 2 2 1 NAG C5 C -5.717 14.090 -0.518 1.00 . B A . 32 NAG C5 1 1 14 6304 2 2 1 NAG C6 C -4.625 15.176 -0.491 1.00 . B A . 32 NAG C6 1 1 14 6305 2 2 1 NAG C7 C -8.704 9.926 -1.963 1.00 . B A . 32 NAG C7 1 1 14 6306 2 2 1 NAG C8 C -10.079 9.349 -1.829 1.00 . B A . 32 NAG C8 1 1 14 6307 2 2 1 NAG H1 H -8.281 13.763 -1.041 1.00 . B A . 32 NAG H1 1 1 14 6308 2 2 1 NAG H2 H -6.669 11.555 -2.346 1.00 . B A . 32 NAG H2 1 1 14 6309 2 2 1 NAG H3 H -6.995 11.972 0.645 1.00 . B A . 32 NAG H3 1 1 14 6310 2 2 1 NAG H4 H -4.537 12.408 -1.135 1.00 . B A . 32 NAG H4 1 1 14 6311 2 2 1 NAG H5 H -6.441 14.335 0.261 1.00 . B A . 32 NAG H5 1 1 14 6312 2 2 1 NAG H61 H -4.924 15.987 -1.157 1.00 . B A . 32 NAG H61 1 1 14 6313 2 2 1 NAG H62 H -3.671 14.779 -0.838 1.00 . B A . 32 NAG H62 1 1 14 6314 2 2 1 NAG H81 H -10.311 9.218 -0.775 1.00 . B A . 32 NAG H81 1 1 14 6315 2 2 1 NAG H82 H -10.789 10.029 -2.295 1.00 . B A . 32 NAG H82 1 1 14 6316 2 2 1 NAG H83 H -10.102 8.392 -2.344 1.00 . B A . 32 NAG H83 1 1 14 6317 2 2 1 NAG HN2 H -9.341 11.531 -0.992 1.00 . B A . 32 NAG HN2 1 1 14 6318 2 2 1 NAG HO1 H -7.639 14.302 -3.371 1.00 . B A . 32 NAG HO1 1 1 14 6319 2 2 1 NAG HO3 H -5.180 10.406 0.271 1.00 . B A . 32 NAG HO3 1 1 14 6320 2 2 1 NAG HO4 H 1.401 7.323 8.014 1.00 . B A . 32 NAG HO4 1 1 14 6321 2 2 1 NAG HO6 H -3.790 15.285 1.285 1.00 . B A . 32 NAG HO6 1 1 14 6322 2 2 1 NAG N2 N -8.525 11.116 -1.412 1.00 . B A . 32 NAG N2 1 1 14 6323 2 2 1 NAG O1 O -8.064 13.509 -3.037 1.00 . B A . 32 NAG O1 1 1 14 6324 2 2 1 NAG O3 O -6.021 10.375 -0.192 1.00 . B A . 32 NAG O3 1 1 14 6325 2 2 1 NAG O4 O -4.329 12.680 0.911 1.00 . B A . 32 NAG O4 1 1 14 6326 2 2 1 NAG O5 O -6.373 14.106 -1.774 1.00 . B A . 32 NAG O5 1 1 14 6327 2 2 1 NAG O6 O -4.492 15.748 0.797 1.00 . B A . 32 NAG O6 1 1 14 6328 2 2 1 NAG O7 O -7.823 9.290 -2.537 1.00 . B A . 32 NAG O7 1 1 15 6329 1 1 1 VAL C C 8.195 1.089 5.528 1.00 . A A . 1 VAL C 1 1 15 6330 1 1 1 VAL CA C 9.438 0.786 4.721 1.00 . A A . 1 VAL CA 1 1 15 6331 1 1 1 VAL CB C 9.947 -0.636 4.965 1.00 . A A . 1 VAL CB 1 1 15 6332 1 1 1 VAL CG1 C 8.870 -1.660 4.599 1.00 . A A . 1 VAL CG1 1 1 15 6333 1 1 1 VAL CG2 C 11.177 -0.895 4.090 1.00 . A A . 1 VAL CG2 1 1 15 6334 1 1 1 VAL H1 H 9.965 2.717 5.028 1.00 . A A . 1 VAL H1 1 1 15 6335 1 1 1 VAL H2 H 11.079 1.904 4.230 1.00 . A A . 1 VAL H2 1 1 15 6336 1 1 1 VAL H3 H 10.912 1.660 5.905 1.00 . A A . 1 VAL H3 1 1 15 6337 1 1 1 VAL HA H 9.171 0.883 3.667 1.00 . A A . 1 VAL HA 1 1 15 6338 1 1 1 VAL HB H 10.224 -0.760 6.013 1.00 . A A . 1 VAL HB 1 1 15 6339 1 1 1 VAL HG11 H 9.280 -2.667 4.674 1.00 . A A . 1 VAL HG11 1 1 15 6340 1 1 1 VAL HG12 H 8.023 -1.588 5.282 1.00 . A A . 1 VAL HG12 1 1 15 6341 1 1 1 VAL HG13 H 8.524 -1.491 3.579 1.00 . A A . 1 VAL HG13 1 1 15 6342 1 1 1 VAL HG21 H 12.012 -0.262 4.391 1.00 . A A . 1 VAL HG21 1 1 15 6343 1 1 1 VAL HG22 H 11.489 -1.934 4.199 1.00 . A A . 1 VAL HG22 1 1 15 6344 1 1 1 VAL HG23 H 10.938 -0.706 3.042 1.00 . A A . 1 VAL HG23 1 1 15 6345 1 1 1 VAL N N 10.449 1.818 5.022 1.00 . A A . 1 VAL N 1 1 15 6346 1 1 1 VAL O O 8.286 1.270 6.735 1.00 . A A . 1 VAL O 1 1 15 6347 1 1 2 GLY C C 5.431 2.878 4.216 1.00 . A A . 2 GLY C 1 1 15 6348 1 1 2 GLY CA C 5.879 1.927 5.320 1.00 . A A . 2 GLY CA 1 1 15 6349 1 1 2 GLY H H 7.123 1.107 3.825 1.00 . A A . 2 GLY H 1 1 15 6350 1 1 2 GLY HA2 H 5.083 1.209 5.524 1.00 . A A . 2 GLY HA2 1 1 15 6351 1 1 2 GLY HA3 H 6.100 2.499 6.221 1.00 . A A . 2 GLY HA3 1 1 15 6352 1 1 2 GLY N N 7.070 1.234 4.835 1.00 . A A . 2 GLY N 1 1 15 6353 1 1 2 GLY O O 4.289 2.821 3.761 1.00 . A A . 2 GLY O 1 1 15 6354 1 1 3 GLU C C 6.610 2.493 1.510 1.00 . A A . 3 GLU C 1 1 15 6355 1 1 3 GLU CA C 6.413 3.847 2.218 1.00 . A A . 3 GLU CA 1 1 15 6356 1 1 3 GLU CB C 7.503 4.874 1.866 1.00 . A A . 3 GLU CB 1 1 15 6357 1 1 3 GLU CD C 9.511 3.532 2.821 1.00 . A A . 3 GLU CD 1 1 15 6358 1 1 3 GLU CG C 8.924 4.326 1.646 1.00 . A A . 3 GLU CG 1 1 15 6359 1 1 3 GLU H H 7.321 3.624 4.090 1.00 . A A . 3 GLU H 1 1 15 6360 1 1 3 GLU HA H 5.456 4.271 1.924 1.00 . A A . 3 GLU HA 1 1 15 6361 1 1 3 GLU HB2 H 7.223 5.336 1.025 1.00 . A A . 3 GLU HB2 1 1 15 6362 1 1 3 GLU HB3 H 7.547 5.537 2.613 1.00 . A A . 3 GLU HB3 1 1 15 6363 1 1 3 GLU HG2 H 8.903 3.725 0.847 1.00 . A A . 3 GLU HG2 1 1 15 6364 1 1 3 GLU HG3 H 9.529 5.101 1.464 1.00 . A A . 3 GLU HG3 1 1 15 6365 1 1 3 GLU N N 6.393 3.617 3.656 1.00 . A A . 3 GLU N 1 1 15 6366 1 1 3 GLU O O 7.236 1.583 2.065 1.00 . A A . 3 GLU O 1 1 15 6367 1 1 3 GLU OE1 O 9.010 3.649 3.964 1.00 . A A . 3 GLU OE1 1 1 15 6368 1 1 3 GLU OE2 O 10.470 2.744 2.599 1.00 . A A . 3 GLU OE2 1 1 15 6369 1 1 4 CYS C C 7.386 0.460 -0.704 1.00 . A A . 4 CYS C 1 1 15 6370 1 1 4 CYS CA C 6.011 0.976 -0.274 1.00 . A A . 4 CYS CA 1 1 15 6371 1 1 4 CYS CB C 5.046 0.937 -1.461 1.00 . A A . 4 CYS CB 1 1 15 6372 1 1 4 CYS H H 5.566 3.086 -0.124 1.00 . A A . 4 CYS H 1 1 15 6373 1 1 4 CYS HA H 5.622 0.301 0.489 1.00 . A A . 4 CYS HA 1 1 15 6374 1 1 4 CYS HB2 H 5.461 1.441 -2.218 1.00 . A A . 4 CYS HB2 1 1 15 6375 1 1 4 CYS HB3 H 4.916 -0.018 -1.727 1.00 . A A . 4 CYS HB3 1 1 15 6376 1 1 4 CYS N N 6.073 2.316 0.304 1.00 . A A . 4 CYS N 1 1 15 6377 1 1 4 CYS O O 8.272 1.210 -1.131 1.00 . A A . 4 CYS O 1 1 15 6378 1 1 4 CYS SG S 3.424 1.656 -1.127 1.00 . A A . 4 CYS SG 1 1 15 6379 1 1 5 VAL C C 8.660 -1.622 -2.717 1.00 . A A . 5 VAL C 1 1 15 6380 1 1 5 VAL CA C 8.732 -1.558 -1.199 1.00 . A A . 5 VAL CA 1 1 15 6381 1 1 5 VAL CB C 8.852 -2.947 -0.548 1.00 . A A . 5 VAL CB 1 1 15 6382 1 1 5 VAL CG1 C 10.181 -3.619 -0.908 1.00 . A A . 5 VAL CG1 1 1 15 6383 1 1 5 VAL CG2 C 8.825 -2.820 0.978 1.00 . A A . 5 VAL CG2 1 1 15 6384 1 1 5 VAL H H 6.713 -1.426 -0.584 1.00 . A A . 5 VAL H 1 1 15 6385 1 1 5 VAL HA H 9.614 -0.986 -0.921 1.00 . A A . 5 VAL HA 1 1 15 6386 1 1 5 VAL HB H 8.018 -3.577 -0.856 1.00 . A A . 5 VAL HB 1 1 15 6387 1 1 5 VAL HG11 H 10.248 -3.809 -1.979 1.00 . A A . 5 VAL HG11 1 1 15 6388 1 1 5 VAL HG12 H 11.017 -2.988 -0.605 1.00 . A A . 5 VAL HG12 1 1 15 6389 1 1 5 VAL HG13 H 10.257 -4.577 -0.392 1.00 . A A . 5 VAL HG13 1 1 15 6390 1 1 5 VAL HG21 H 7.880 -2.396 1.310 1.00 . A A . 5 VAL HG21 1 1 15 6391 1 1 5 VAL HG22 H 8.941 -3.804 1.433 1.00 . A A . 5 VAL HG22 1 1 15 6392 1 1 5 VAL HG23 H 9.640 -2.176 1.310 1.00 . A A . 5 VAL HG23 1 1 15 6393 1 1 5 VAL N N 7.539 -0.860 -0.731 1.00 . A A . 5 VAL N 1 1 15 6394 1 1 5 VAL O O 8.481 -2.684 -3.305 1.00 . A A . 5 VAL O 1 1 15 6395 1 1 6 ARG C C 7.949 -1.052 -5.623 1.00 . A A . 6 ARG C 1 1 15 6396 1 1 6 ARG CA C 8.864 -0.178 -4.764 1.00 . A A . 6 ARG CA 1 1 15 6397 1 1 6 ARG CB C 10.355 -0.276 -5.122 1.00 . A A . 6 ARG CB 1 1 15 6398 1 1 6 ARG CD C 11.730 0.409 -3.001 1.00 . A A . 6 ARG CD 1 1 15 6399 1 1 6 ARG CG C 11.224 0.782 -4.409 1.00 . A A . 6 ARG CG 1 1 15 6400 1 1 6 ARG CZ C 11.398 1.354 -0.687 1.00 . A A . 6 ARG CZ 1 1 15 6401 1 1 6 ARG H H 8.516 0.359 -2.740 1.00 . A A . 6 ARG H 1 1 15 6402 1 1 6 ARG HA H 8.531 0.838 -4.966 1.00 . A A . 6 ARG HA 1 1 15 6403 1 1 6 ARG HB2 H 10.685 -1.184 -4.863 1.00 . A A . 6 ARG HB2 1 1 15 6404 1 1 6 ARG HB3 H 10.453 -0.154 -6.110 1.00 . A A . 6 ARG HB3 1 1 15 6405 1 1 6 ARG HD2 H 11.668 -0.584 -2.897 1.00 . A A . 6 ARG HD2 1 1 15 6406 1 1 6 ARG HD3 H 12.686 0.694 -2.924 1.00 . A A . 6 ARG HD3 1 1 15 6407 1 1 6 ARG HE H 9.983 1.239 -2.028 1.00 . A A . 6 ARG HE 1 1 15 6408 1 1 6 ARG HG2 H 12.023 0.958 -4.984 1.00 . A A . 6 ARG HG2 1 1 15 6409 1 1 6 ARG HG3 H 10.681 1.618 -4.327 1.00 . A A . 6 ARG HG3 1 1 15 6410 1 1 6 ARG HH11 H 13.340 0.947 -0.985 1.00 . A A . 6 ARG HH11 1 1 15 6411 1 1 6 ARG HH12 H 12.929 1.512 0.600 1.00 . A A . 6 ARG HH12 1 1 15 6412 1 1 6 ARG HH21 H 9.561 1.825 -0.041 1.00 . A A . 6 ARG HH21 1 1 15 6413 1 1 6 ARG HH22 H 10.832 1.998 1.123 1.00 . A A . 6 ARG HH22 1 1 15 6414 1 1 6 ARG N N 8.688 -0.436 -3.336 1.00 . A A . 6 ARG N 1 1 15 6415 1 1 6 ARG NE N 10.966 1.041 -1.904 1.00 . A A . 6 ARG NE 1 1 15 6416 1 1 6 ARG NH1 N 12.655 1.264 -0.329 1.00 . A A . 6 ARG NH1 1 1 15 6417 1 1 6 ARG NH2 N 10.529 1.757 0.201 1.00 . A A . 6 ARG NH2 1 1 15 6418 1 1 6 ARG O O 8.310 -1.515 -6.697 1.00 . A A . 6 ARG O 1 1 15 6419 1 1 7 GLY C C 5.053 -3.076 -4.722 1.00 . A A . 7 GLY C 1 1 15 6420 1 1 7 GLY CA C 5.680 -2.057 -5.682 1.00 . A A . 7 GLY CA 1 1 15 6421 1 1 7 GLY H H 6.609 -0.746 -4.226 1.00 . A A . 7 GLY H 1 1 15 6422 1 1 7 GLY HA2 H 4.888 -1.399 -6.039 1.00 . A A . 7 GLY HA2 1 1 15 6423 1 1 7 GLY HA3 H 6.069 -2.606 -6.540 1.00 . A A . 7 GLY HA3 1 1 15 6424 1 1 7 GLY N N 6.743 -1.244 -5.093 1.00 . A A . 7 GLY N 1 1 15 6425 1 1 7 GLY O O 3.979 -3.594 -5.018 1.00 . A A . 7 GLY O 1 1 15 6426 1 1 8 ARG C C 5.088 -3.681 -1.185 1.00 . A A . 8 ARG C 1 1 15 6427 1 1 8 ARG CA C 5.097 -4.289 -2.580 1.00 . A A . 8 ARG CA 1 1 15 6428 1 1 8 ARG CB C 5.893 -5.613 -2.614 1.00 . A A . 8 ARG CB 1 1 15 6429 1 1 8 ARG CD C 3.749 -7.030 -3.034 1.00 . A A . 8 ARG CD 1 1 15 6430 1 1 8 ARG CG C 5.212 -6.735 -3.409 1.00 . A A . 8 ARG CG 1 1 15 6431 1 1 8 ARG CZ C 2.316 -7.091 -1.000 1.00 . A A . 8 ARG CZ 1 1 15 6432 1 1 8 ARG H H 6.571 -2.946 -3.345 1.00 . A A . 8 ARG H 1 1 15 6433 1 1 8 ARG HA H 4.053 -4.479 -2.817 1.00 . A A . 8 ARG HA 1 1 15 6434 1 1 8 ARG HB2 H 6.785 -5.432 -3.028 1.00 . A A . 8 ARG HB2 1 1 15 6435 1 1 8 ARG HB3 H 6.019 -5.927 -1.673 1.00 . A A . 8 ARG HB3 1 1 15 6436 1 1 8 ARG HD2 H 3.183 -6.275 -3.365 1.00 . A A . 8 ARG HD2 1 1 15 6437 1 1 8 ARG HD3 H 3.475 -7.877 -3.490 1.00 . A A . 8 ARG HD3 1 1 15 6438 1 1 8 ARG HE H 4.268 -7.425 -0.953 1.00 . A A . 8 ARG HE 1 1 15 6439 1 1 8 ARG HG2 H 5.236 -6.483 -4.376 1.00 . A A . 8 ARG HG2 1 1 15 6440 1 1 8 ARG HG3 H 5.739 -7.573 -3.269 1.00 . A A . 8 ARG HG3 1 1 15 6441 1 1 8 ARG HH11 H 1.270 -6.640 -2.652 1.00 . A A . 8 ARG HH11 1 1 15 6442 1 1 8 ARG HH12 H 0.350 -6.738 -1.188 1.00 . A A . 8 ARG HH12 1 1 15 6443 1 1 8 ARG HH21 H 2.968 -7.445 0.862 1.00 . A A . 8 ARG HH21 1 1 15 6444 1 1 8 ARG HH22 H 1.265 -7.171 0.705 1.00 . A A . 8 ARG HH22 1 1 15 6445 1 1 8 ARG N N 5.663 -3.356 -3.561 1.00 . A A . 8 ARG N 1 1 15 6446 1 1 8 ARG NE N 3.507 -7.187 -1.582 1.00 . A A . 8 ARG NE 1 1 15 6447 1 1 8 ARG NH1 N 1.226 -6.800 -1.666 1.00 . A A . 8 ARG NH1 1 1 15 6448 1 1 8 ARG NH2 N 2.172 -7.248 0.290 1.00 . A A . 8 ARG NH2 1 1 15 6449 1 1 8 ARG O O 5.439 -2.526 -0.987 1.00 . A A . 8 ARG O 1 1 15 6450 1 1 9 CYS C C 4.987 -5.842 1.738 1.00 . A A . 9 CYS C 1 1 15 6451 1 1 9 CYS CA C 5.102 -4.416 1.173 1.00 . A A . 9 CYS CA 1 1 15 6452 1 1 9 CYS CB C 4.235 -3.377 1.878 1.00 . A A . 9 CYS CB 1 1 15 6453 1 1 9 CYS H H 4.317 -5.388 -0.469 1.00 . A A . 9 CYS H 1 1 15 6454 1 1 9 CYS HA H 6.149 -4.116 1.226 1.00 . A A . 9 CYS HA 1 1 15 6455 1 1 9 CYS HB2 H 3.476 -3.130 1.275 1.00 . A A . 9 CYS HB2 1 1 15 6456 1 1 9 CYS HB3 H 3.875 -3.778 2.720 1.00 . A A . 9 CYS HB3 1 1 15 6457 1 1 9 CYS N N 4.695 -4.492 -0.214 1.00 . A A . 9 CYS N 1 1 15 6458 1 1 9 CYS O O 4.688 -6.760 0.963 1.00 . A A . 9 CYS O 1 1 15 6459 1 1 9 CYS SG S 5.156 -1.874 2.298 1.00 . A A . 9 CYS SG 1 1 15 6460 1 1 10 PRO C C 3.875 -8.166 3.482 1.00 . A A . 10 PRO C 1 1 15 6461 1 1 10 PRO CA C 5.178 -7.368 3.673 1.00 . A A . 10 PRO CA 1 1 15 6462 1 1 10 PRO CB C 5.463 -7.102 5.154 1.00 . A A . 10 PRO CB 1 1 15 6463 1 1 10 PRO CD C 5.835 -5.086 3.945 1.00 . A A . 10 PRO CD 1 1 15 6464 1 1 10 PRO CG C 6.406 -5.903 5.102 1.00 . A A . 10 PRO CG 1 1 15 6465 1 1 10 PRO HA H 5.996 -7.964 3.269 1.00 . A A . 10 PRO HA 1 1 15 6466 1 1 10 PRO HB2 H 4.623 -6.879 5.649 1.00 . A A . 10 PRO HB2 1 1 15 6467 1 1 10 PRO HB3 H 5.904 -7.890 5.584 1.00 . A A . 10 PRO HB3 1 1 15 6468 1 1 10 PRO HD2 H 5.141 -4.448 4.278 1.00 . A A . 10 PRO HD2 1 1 15 6469 1 1 10 PRO HD3 H 6.563 -4.578 3.484 1.00 . A A . 10 PRO HD3 1 1 15 6470 1 1 10 PRO HG2 H 6.380 -5.386 5.957 1.00 . A A . 10 PRO HG2 1 1 15 6471 1 1 10 PRO HG3 H 7.345 -6.190 4.913 1.00 . A A . 10 PRO HG3 1 1 15 6472 1 1 10 PRO N N 5.240 -6.055 3.038 1.00 . A A . 10 PRO N 1 1 15 6473 1 1 10 PRO O O 2.901 -7.724 2.862 1.00 . A A . 10 PRO O 1 1 15 6474 1 1 11 SER C C 1.452 -9.774 4.321 1.00 . A A . 11 SER C 1 1 15 6475 1 1 11 SER CA C 2.824 -10.375 4.023 1.00 . A A . 11 SER CA 1 1 15 6476 1 1 11 SER CB C 3.131 -11.428 5.090 1.00 . A A . 11 SER CB 1 1 15 6477 1 1 11 SER H H 4.698 -9.617 4.603 1.00 . A A . 11 SER H 1 1 15 6478 1 1 11 SER HA H 2.800 -10.861 3.048 1.00 . A A . 11 SER HA 1 1 15 6479 1 1 11 SER HB2 H 2.378 -12.083 5.144 1.00 . A A . 11 SER HB2 1 1 15 6480 1 1 11 SER HB3 H 3.976 -11.909 4.857 1.00 . A A . 11 SER HB3 1 1 15 6481 1 1 11 SER HG H 2.513 -10.189 6.444 1.00 . A A . 11 SER HG 1 1 15 6482 1 1 11 SER N N 3.892 -9.378 4.041 1.00 . A A . 11 SER N 1 1 15 6483 1 1 11 SER O O 1.203 -9.357 5.451 1.00 . A A . 11 SER O 1 1 15 6484 1 1 11 SER OG O 3.283 -10.772 6.331 1.00 . A A . 11 SER OG 1 1 15 6485 1 1 12 GLY C C -1.010 -7.801 3.397 1.00 . A A . 12 GLY C 1 1 15 6486 1 1 12 GLY CA C -0.816 -9.312 3.524 1.00 . A A . 12 GLY CA 1 1 15 6487 1 1 12 GLY H H 0.833 -10.109 2.424 1.00 . A A . 12 GLY H 1 1 15 6488 1 1 12 GLY HA2 H -1.455 -9.795 2.784 1.00 . A A . 12 GLY HA2 1 1 15 6489 1 1 12 GLY HA3 H -1.162 -9.616 4.513 1.00 . A A . 12 GLY HA3 1 1 15 6490 1 1 12 GLY N N 0.561 -9.755 3.329 1.00 . A A . 12 GLY N 1 1 15 6491 1 1 12 GLY O O -2.130 -7.324 3.565 1.00 . A A . 12 GLY O 1 1 15 6492 1 1 13 MET C C -0.473 -5.307 1.381 1.00 . A A . 13 MET C 1 1 15 6493 1 1 13 MET CA C -0.144 -5.600 2.846 1.00 . A A . 13 MET CA 1 1 15 6494 1 1 13 MET CB C 1.099 -4.826 3.286 1.00 . A A . 13 MET CB 1 1 15 6495 1 1 13 MET CE C 2.636 -4.552 7.173 1.00 . A A . 13 MET CE 1 1 15 6496 1 1 13 MET CG C 1.383 -5.068 4.768 1.00 . A A . 13 MET CG 1 1 15 6497 1 1 13 MET H H 0.976 -7.428 3.038 1.00 . A A . 13 MET H 1 1 15 6498 1 1 13 MET HA H -0.974 -5.237 3.441 1.00 . A A . 13 MET HA 1 1 15 6499 1 1 13 MET HB2 H 1.884 -5.130 2.747 1.00 . A A . 13 MET HB2 1 1 15 6500 1 1 13 MET HB3 H 0.949 -3.849 3.135 1.00 . A A . 13 MET HB3 1 1 15 6501 1 1 13 MET HE1 H 3.353 -3.972 7.754 1.00 . A A . 13 MET HE1 1 1 15 6502 1 1 13 MET HE2 H 1.646 -4.453 7.618 1.00 . A A . 13 MET HE2 1 1 15 6503 1 1 13 MET HE3 H 2.932 -5.601 7.177 1.00 . A A . 13 MET HE3 1 1 15 6504 1 1 13 MET HG2 H 0.527 -4.964 5.274 1.00 . A A . 13 MET HG2 1 1 15 6505 1 1 13 MET HG3 H 1.722 -6.002 4.875 1.00 . A A . 13 MET HG3 1 1 15 6506 1 1 13 MET N N 0.041 -7.028 3.096 1.00 . A A . 13 MET N 1 1 15 6507 1 1 13 MET O O -0.248 -6.138 0.498 1.00 . A A . 13 MET O 1 1 15 6508 1 1 13 MET SD S 2.603 -3.934 5.471 1.00 . A A . 13 MET SD 1 1 15 6509 1 1 14 CYS C C -0.240 -2.120 -0.147 1.00 . A A . 14 CYS C 1 1 15 6510 1 1 14 CYS CA C -0.933 -3.481 -0.211 1.00 . A A . 14 CYS CA 1 1 15 6511 1 1 14 CYS CB C -2.378 -3.284 -0.675 1.00 . A A . 14 CYS CB 1 1 15 6512 1 1 14 CYS H H -1.090 -3.461 1.903 1.00 . A A . 14 CYS H 1 1 15 6513 1 1 14 CYS HA H -0.408 -4.118 -0.924 1.00 . A A . 14 CYS HA 1 1 15 6514 1 1 14 CYS HB2 H -2.800 -2.602 -0.078 1.00 . A A . 14 CYS HB2 1 1 15 6515 1 1 14 CYS HB3 H -2.352 -2.937 -1.612 1.00 . A A . 14 CYS HB3 1 1 15 6516 1 1 14 CYS N N -0.911 -4.080 1.116 1.00 . A A . 14 CYS N 1 1 15 6517 1 1 14 CYS O O -0.075 -1.565 0.940 1.00 . A A . 14 CYS O 1 1 15 6518 1 1 14 CYS SG S -3.432 -4.756 -0.661 1.00 . A A . 14 CYS SG 1 1 15 6519 1 1 15 CYS C C -0.688 0.711 -1.711 1.00 . A A . 15 CYS C 1 1 15 6520 1 1 15 CYS CA C 0.537 -0.182 -1.455 1.00 . A A . 15 CYS CA 1 1 15 6521 1 1 15 CYS CB C 1.532 -0.133 -2.623 1.00 . A A . 15 CYS CB 1 1 15 6522 1 1 15 CYS H H -0.133 -2.061 -2.158 1.00 . A A . 15 CYS H 1 1 15 6523 1 1 15 CYS HA H 1.033 0.149 -0.543 1.00 . A A . 15 CYS HA 1 1 15 6524 1 1 15 CYS HB2 H 2.225 -0.837 -2.467 1.00 . A A . 15 CYS HB2 1 1 15 6525 1 1 15 CYS HB3 H 1.031 -0.339 -3.463 1.00 . A A . 15 CYS HB3 1 1 15 6526 1 1 15 CYS N N 0.105 -1.568 -1.310 1.00 . A A . 15 CYS N 1 1 15 6527 1 1 15 CYS O O -1.750 0.195 -2.055 1.00 . A A . 15 CYS O 1 1 15 6528 1 1 15 CYS SG S 2.384 1.446 -2.856 1.00 . A A . 15 CYS SG 1 1 15 6529 1 1 16 SER C C -1.249 4.094 -2.769 1.00 . A A . 16 SER C 1 1 15 6530 1 1 16 SER CA C -1.637 2.987 -1.795 1.00 . A A . 16 SER CA 1 1 15 6531 1 1 16 SER CB C -2.040 3.642 -0.470 1.00 . A A . 16 SER CB 1 1 15 6532 1 1 16 SER H H 0.292 2.393 -1.127 1.00 . A A . 16 SER H 1 1 15 6533 1 1 16 SER HA H -2.503 2.461 -2.197 1.00 . A A . 16 SER HA 1 1 15 6534 1 1 16 SER HB2 H -2.996 3.930 -0.525 1.00 . A A . 16 SER HB2 1 1 15 6535 1 1 16 SER HB3 H -1.934 2.977 0.269 1.00 . A A . 16 SER HB3 1 1 15 6536 1 1 16 SER HG H -1.345 5.024 0.739 1.00 . A A . 16 SER HG 1 1 15 6537 1 1 16 SER N N -0.555 2.032 -1.562 1.00 . A A . 16 SER N 1 1 15 6538 1 1 16 SER O O -0.079 4.321 -3.078 1.00 . A A . 16 SER O 1 1 15 6539 1 1 16 SER OG O -1.228 4.775 -0.196 1.00 . A A . 16 SER OG 1 1 15 6540 1 1 17 GLN C C -1.204 7.168 -3.204 1.00 . A A . 17 GLN C 1 1 15 6541 1 1 17 GLN CA C -2.141 6.139 -3.863 1.00 . A A . 17 GLN CA 1 1 15 6542 1 1 17 GLN CB C -3.576 6.666 -3.969 1.00 . A A . 17 GLN CB 1 1 15 6543 1 1 17 GLN CD C -3.986 9.155 -4.209 1.00 . A A . 17 GLN CD 1 1 15 6544 1 1 17 GLN CG C -3.751 7.835 -4.934 1.00 . A A . 17 GLN CG 1 1 15 6545 1 1 17 GLN H H -3.195 4.626 -2.888 1.00 . A A . 17 GLN H 1 1 15 6546 1 1 17 GLN HA H -1.755 5.925 -4.860 1.00 . A A . 17 GLN HA 1 1 15 6547 1 1 17 GLN HB2 H -4.162 5.916 -4.277 1.00 . A A . 17 GLN HB2 1 1 15 6548 1 1 17 GLN HB3 H -3.867 6.965 -3.060 1.00 . A A . 17 GLN HB3 1 1 15 6549 1 1 17 GLN HE21 H -2.002 9.517 -4.035 1.00 . A A . 17 GLN HE21 1 1 15 6550 1 1 17 GLN HE22 H -3.115 10.756 -3.415 1.00 . A A . 17 GLN HE22 1 1 15 6551 1 1 17 GLN HG2 H -2.925 7.917 -5.492 1.00 . A A . 17 GLN HG2 1 1 15 6552 1 1 17 GLN HG3 H -4.536 7.649 -5.525 1.00 . A A . 17 GLN HG3 1 1 15 6553 1 1 17 GLN N N -2.256 4.885 -3.140 1.00 . A A . 17 GLN N 1 1 15 6554 1 1 17 GLN NE2 N -2.940 9.887 -3.887 1.00 . A A . 17 GLN NE2 1 1 15 6555 1 1 17 GLN O O -0.863 8.163 -3.840 1.00 . A A . 17 GLN O 1 1 15 6556 1 1 17 GLN OE1 O -5.114 9.520 -3.898 1.00 . A A . 17 GLN OE1 1 1 15 6557 1 1 18 . C C 1.659 7.298 -1.470 1.00 . A A . 18 PFF C 1 1 15 6558 1 1 18 . CA C 0.225 7.811 -1.306 1.00 . A A . 18 PFF CA 1 1 15 6559 1 1 18 . CB C -0.170 7.985 0.173 1.00 . A A . 18 PFF CB 1 1 15 6560 1 1 18 . CD1 C -2.673 8.323 0.158 1.00 . A A . 18 PFF CD1 1 1 15 6561 1 1 18 . CD2 C -1.193 10.251 0.038 1.00 . A A . 18 PFF CD2 1 1 15 6562 1 1 18 . CE1 C -3.724 9.101 -0.359 1.00 . A A . 18 PFF CE1 1 1 15 6563 1 1 18 . CE2 C -2.241 11.027 -0.479 1.00 . A A . 18 PFF CE2 1 1 15 6564 1 1 18 . CG C -1.386 8.880 0.282 1.00 . A A . 18 PFF CG 1 1 15 6565 1 1 18 . CZ C -3.489 10.438 -0.727 1.00 . A A . 18 PFF CZ 1 1 15 6566 1 1 18 . F F -4.412 11.122 -1.447 1.00 . A A . 18 PFF F 1 1 15 6567 1 1 18 . H H -1.064 6.119 -1.458 1.00 . A A . 18 PFF H 1 1 15 6568 1 1 18 . HA H 0.207 8.799 -1.770 1.00 . A A . 18 PFF HA 1 1 15 6569 1 1 18 . HB2 H -0.367 7.017 0.627 1.00 . A A . 18 PFF HB2 1 1 15 6570 1 1 18 . HB3 H 0.645 8.430 0.747 1.00 . A A . 18 PFF HB3 1 1 15 6571 1 1 18 . HD1 H -2.821 7.267 0.335 1.00 . A A . 18 PFF HD1 1 1 15 6572 1 1 18 . HD2 H -0.205 10.680 0.122 1.00 . A A . 18 PFF HD2 1 1 15 6573 1 1 18 . HE1 H -4.688 8.652 -0.551 1.00 . A A . 18 PFF HE1 1 1 15 6574 1 1 18 . HE2 H -2.067 12.057 -0.753 1.00 . A A . 18 PFF HE2 1 1 15 6575 1 1 18 . N N -0.762 6.951 -1.961 1.00 . A A . 18 PFF N 1 1 15 6576 1 1 18 . O O 2.589 7.938 -0.991 1.00 . A A . 18 PFF O 1 1 15 6577 1 1 19 GLY C C 3.435 4.888 -0.670 1.00 . A A . 19 GLY C 1 1 15 6578 1 1 19 GLY CA C 3.165 5.478 -2.056 1.00 . A A . 19 GLY CA 1 1 15 6579 1 1 19 GLY H H 1.082 5.644 -2.532 1.00 . A A . 19 GLY H 1 1 15 6580 1 1 19 GLY HA2 H 3.190 4.670 -2.788 1.00 . A A . 19 GLY HA2 1 1 15 6581 1 1 19 GLY HA3 H 3.957 6.190 -2.293 1.00 . A A . 19 GLY HA3 1 1 15 6582 1 1 19 GLY N N 1.864 6.142 -2.112 1.00 . A A . 19 GLY N 1 1 15 6583 1 1 19 GLY O O 4.575 4.568 -0.339 1.00 . A A . 19 GLY O 1 1 15 6584 1 1 20 . C C 1.692 2.822 1.503 1.00 . A A . 20 PFF C 1 1 15 6585 1 1 20 . CA C 2.420 4.165 1.479 1.00 . A A . 20 PFF CA 1 1 15 6586 1 1 20 . CB C 1.762 5.165 2.431 1.00 . A A . 20 PFF CB 1 1 15 6587 1 1 20 . CD1 C 3.428 5.831 4.174 1.00 . A A . 20 PFF CD1 1 1 15 6588 1 1 20 . CD2 C 3.039 7.364 2.336 1.00 . A A . 20 PFF CD2 1 1 15 6589 1 1 20 . CE1 C 4.409 6.692 4.697 1.00 . A A . 20 PFF CE1 1 1 15 6590 1 1 20 . CE2 C 3.996 8.246 2.872 1.00 . A A . 20 PFF CE2 1 1 15 6591 1 1 20 . CG C 2.731 6.170 3.007 1.00 . A A . 20 PFF CG 1 1 15 6592 1 1 20 . CZ C 4.676 7.913 4.057 1.00 . A A . 20 PFF CZ 1 1 15 6593 1 1 20 . F F 5.585 8.774 4.584 1.00 . A A . 20 PFF F 1 1 15 6594 1 1 20 . H H 1.465 4.914 -0.240 1.00 . A A . 20 PFF H 1 1 15 6595 1 1 20 . HA H 3.445 3.993 1.791 1.00 . A A . 20 PFF HA 1 1 15 6596 1 1 20 . HB2 H 0.946 5.672 1.921 1.00 . A A . 20 PFF HB2 1 1 15 6597 1 1 20 . HB3 H 1.337 4.620 3.267 1.00 . A A . 20 PFF HB3 1 1 15 6598 1 1 20 . HD1 H 3.148 4.928 4.680 1.00 . A A . 20 PFF HD1 1 1 15 6599 1 1 20 . HD2 H 2.569 7.593 1.398 1.00 . A A . 20 PFF HD2 1 1 15 6600 1 1 20 . HE1 H 4.930 6.431 5.607 1.00 . A A . 20 PFF HE1 1 1 15 6601 1 1 20 . HE2 H 4.225 9.169 2.360 1.00 . A A . 20 PFF HE2 1 1 15 6602 1 1 20 . N N 2.383 4.735 0.139 1.00 . A A . 20 PFF N 1 1 15 6603 1 1 20 . O O 0.868 2.559 0.628 1.00 . A A . 20 PFF O 1 1 15 6604 1 1 21 CYS C C 0.866 0.120 3.775 1.00 . A A . 21 CYS C 1 1 15 6605 1 1 21 CYS CA C 1.469 0.594 2.451 1.00 . A A . 21 CYS CA 1 1 15 6606 1 1 21 CYS CB C 2.607 -0.330 2.014 1.00 . A A . 21 CYS CB 1 1 15 6607 1 1 21 CYS H H 2.680 2.211 3.175 1.00 . A A . 21 CYS H 1 1 15 6608 1 1 21 CYS HA H 0.677 0.532 1.709 1.00 . A A . 21 CYS HA 1 1 15 6609 1 1 21 CYS HB2 H 2.203 -1.183 1.684 1.00 . A A . 21 CYS HB2 1 1 15 6610 1 1 21 CYS HB3 H 3.098 0.118 1.267 1.00 . A A . 21 CYS HB3 1 1 15 6611 1 1 21 CYS N N 1.977 1.962 2.482 1.00 . A A . 21 CYS N 1 1 15 6612 1 1 21 CYS O O 1.155 0.657 4.842 1.00 . A A . 21 CYS O 1 1 15 6613 1 1 21 CYS SG S 3.807 -0.743 3.303 1.00 . A A . 21 CYS SG 1 1 15 6614 1 1 22 GLY C C -1.578 -2.618 4.542 1.00 . A A . 22 GLY C 1 1 15 6615 1 1 22 GLY CA C -0.553 -1.538 4.885 1.00 . A A . 22 GLY CA 1 1 15 6616 1 1 22 GLY H H -0.176 -1.305 2.779 1.00 . A A . 22 GLY H 1 1 15 6617 1 1 22 GLY HA2 H 0.240 -1.984 5.488 1.00 . A A . 22 GLY HA2 1 1 15 6618 1 1 22 GLY HA3 H -1.039 -0.764 5.477 1.00 . A A . 22 GLY HA3 1 1 15 6619 1 1 22 GLY N N 0.045 -0.931 3.701 1.00 . A A . 22 GLY N 1 1 15 6620 1 1 22 GLY O O -1.940 -2.814 3.381 1.00 . A A . 22 GLY O 1 1 15 6621 1 1 23 LYS C C -4.396 -4.228 5.375 1.00 . A A . 23 LYS C 1 1 15 6622 1 1 23 LYS CA C -2.897 -4.531 5.409 1.00 . A A . 23 LYS CA 1 1 15 6623 1 1 23 LYS CB C -2.529 -5.597 6.451 1.00 . A A . 23 LYS CB 1 1 15 6624 1 1 23 LYS CD C -2.814 -6.107 8.935 1.00 . A A . 23 LYS CD 1 1 15 6625 1 1 23 LYS CE C -4.292 -6.281 9.313 1.00 . A A . 23 LYS CE 1 1 15 6626 1 1 23 LYS CG C -2.595 -5.025 7.867 1.00 . A A . 23 LYS CG 1 1 15 6627 1 1 23 LYS H H -1.718 -3.101 6.485 1.00 . A A . 23 LYS H 1 1 15 6628 1 1 23 LYS HA H -2.695 -4.989 4.453 1.00 . A A . 23 LYS HA 1 1 15 6629 1 1 23 LYS HB2 H -3.170 -6.361 6.377 1.00 . A A . 23 LYS HB2 1 1 15 6630 1 1 23 LYS HB3 H -1.600 -5.922 6.273 1.00 . A A . 23 LYS HB3 1 1 15 6631 1 1 23 LYS HD2 H -2.470 -6.977 8.583 1.00 . A A . 23 LYS HD2 1 1 15 6632 1 1 23 LYS HD3 H -2.302 -5.853 9.756 1.00 . A A . 23 LYS HD3 1 1 15 6633 1 1 23 LYS HE2 H -4.359 -6.978 10.027 1.00 . A A . 23 LYS HE2 1 1 15 6634 1 1 23 LYS HE3 H -4.636 -5.410 9.664 1.00 . A A . 23 LYS HE3 1 1 15 6635 1 1 23 LYS HG2 H -1.735 -4.553 8.062 1.00 . A A . 23 LYS HG2 1 1 15 6636 1 1 23 LYS HG3 H -3.351 -4.373 7.913 1.00 . A A . 23 LYS HG3 1 1 15 6637 1 1 23 LYS HZ1 H -5.136 -5.973 7.450 1.00 . A A . 23 LYS HZ1 1 1 15 6638 1 1 23 LYS HZ2 H -4.789 -7.551 7.756 1.00 . A A . 23 LYS HZ2 1 1 15 6639 1 1 23 LYS HZ3 H -6.093 -6.834 8.460 1.00 . A A . 23 LYS HZ3 1 1 15 6640 1 1 23 LYS N N -2.049 -3.342 5.561 1.00 . A A . 23 LYS N 1 1 15 6641 1 1 23 LYS NZ N -5.136 -6.696 8.167 1.00 . A A . 23 LYS NZ 1 1 15 6642 1 1 23 LYS O O -5.155 -4.804 6.156 1.00 . A A . 23 LYS O 1 1 15 6643 1 1 24 GLY C C -6.684 -2.156 3.218 1.00 . A A . 24 GLY C 1 1 15 6644 1 1 24 GLY CA C -6.283 -3.214 4.249 1.00 . A A . 24 GLY CA 1 1 15 6645 1 1 24 GLY H H -4.180 -2.932 3.828 1.00 . A A . 24 GLY H 1 1 15 6646 1 1 24 GLY HA2 H -6.672 -4.177 3.922 1.00 . A A . 24 GLY HA2 1 1 15 6647 1 1 24 GLY HA3 H -6.755 -2.958 5.199 1.00 . A A . 24 GLY HA3 1 1 15 6648 1 1 24 GLY N N -4.843 -3.367 4.460 1.00 . A A . 24 GLY N 1 1 15 6649 1 1 24 GLY O O -5.840 -1.402 2.722 1.00 . A A . 24 GLY O 1 1 15 6650 1 1 25 PRO C C -8.131 0.274 2.001 1.00 . A A . 25 PRO C 1 1 15 6651 1 1 25 PRO CA C -8.559 -1.189 1.893 1.00 . A A . 25 PRO CA 1 1 15 6652 1 1 25 PRO CB C -10.077 -1.327 2.036 1.00 . A A . 25 PRO CB 1 1 15 6653 1 1 25 PRO CD C -9.033 -2.923 3.466 1.00 . A A . 25 PRO CD 1 1 15 6654 1 1 25 PRO CG C -10.238 -2.757 2.542 1.00 . A A . 25 PRO CG 1 1 15 6655 1 1 25 PRO HA H -8.269 -1.563 0.912 1.00 . A A . 25 PRO HA 1 1 15 6656 1 1 25 PRO HB2 H -10.438 -0.668 2.696 1.00 . A A . 25 PRO HB2 1 1 15 6657 1 1 25 PRO HB3 H -10.535 -1.203 1.156 1.00 . A A . 25 PRO HB3 1 1 15 6658 1 1 25 PRO HD2 H -9.264 -2.634 4.395 1.00 . A A . 25 PRO HD2 1 1 15 6659 1 1 25 PRO HD3 H -8.732 -3.876 3.478 1.00 . A A . 25 PRO HD3 1 1 15 6660 1 1 25 PRO HG2 H -11.096 -2.867 3.044 1.00 . A A . 25 PRO HG2 1 1 15 6661 1 1 25 PRO HG3 H -10.207 -3.412 1.787 1.00 . A A . 25 PRO HG3 1 1 15 6662 1 1 25 PRO N N -7.992 -2.069 2.912 1.00 . A A . 25 PRO N 1 1 15 6663 1 1 25 PRO O O -7.990 0.943 0.975 1.00 . A A . 25 PRO O 1 1 15 6664 1 1 26 LYS C C -6.092 2.386 2.562 1.00 . A A . 26 LYS C 1 1 15 6665 1 1 26 LYS CA C -7.293 2.100 3.429 1.00 . A A . 26 LYS CA 1 1 15 6666 1 1 26 LYS CB C -6.813 2.285 4.868 1.00 . A A . 26 LYS CB 1 1 15 6667 1 1 26 LYS CD C -8.662 3.947 5.453 1.00 . A A . 26 LYS CD 1 1 15 6668 1 1 26 LYS CE C -7.684 5.112 5.220 1.00 . A A . 26 LYS CE 1 1 15 6669 1 1 26 LYS CG C -7.963 2.624 5.820 1.00 . A A . 26 LYS CG 1 1 15 6670 1 1 26 LYS H H -7.968 0.172 4.027 1.00 . A A . 26 LYS H 1 1 15 6671 1 1 26 LYS HA H -8.055 2.822 3.159 1.00 . A A . 26 LYS HA 1 1 15 6672 1 1 26 LYS HB2 H -6.380 1.437 5.175 1.00 . A A . 26 LYS HB2 1 1 15 6673 1 1 26 LYS HB3 H -6.145 3.029 4.892 1.00 . A A . 26 LYS HB3 1 1 15 6674 1 1 26 LYS HD2 H -9.190 3.805 4.616 1.00 . A A . 26 LYS HD2 1 1 15 6675 1 1 26 LYS HD3 H -9.280 4.196 6.199 1.00 . A A . 26 LYS HD3 1 1 15 6676 1 1 26 LYS HE2 H -8.068 5.935 5.639 1.00 . A A . 26 LYS HE2 1 1 15 6677 1 1 26 LYS HE3 H -6.815 4.887 5.661 1.00 . A A . 26 LYS HE3 1 1 15 6678 1 1 26 LYS HG2 H -8.636 1.885 5.785 1.00 . A A . 26 LYS HG2 1 1 15 6679 1 1 26 LYS HG3 H -7.599 2.701 6.748 1.00 . A A . 26 LYS HG3 1 1 15 6680 1 1 26 LYS HZ1 H -6.761 6.165 3.725 1.00 . A A . 26 LYS HZ1 1 1 15 6681 1 1 26 LYS HZ2 H -7.024 4.623 3.259 1.00 . A A . 26 LYS HZ2 1 1 15 6682 1 1 26 LYS HZ3 H -8.267 5.770 3.351 1.00 . A A . 26 LYS HZ3 1 1 15 6683 1 1 26 LYS N N -7.839 0.761 3.219 1.00 . A A . 26 LYS N 1 1 15 6684 1 1 26 LYS NZ N -7.421 5.397 3.784 1.00 . A A . 26 LYS NZ 1 1 15 6685 1 1 26 LYS O O -5.928 3.540 2.171 1.00 . A A . 26 LYS O 1 1 15 6686 1 1 27 TYR C C -4.560 0.741 0.113 1.00 . A A . 27 TYR C 1 1 15 6687 1 1 27 TYR CA C -4.148 1.350 1.445 1.00 . A A . 27 TYR CA 1 1 15 6688 1 1 27 TYR CB C -3.031 0.544 2.121 1.00 . A A . 27 TYR CB 1 1 15 6689 1 1 27 TYR CD1 C -1.504 2.179 3.253 1.00 . A A . 27 TYR CD1 1 1 15 6690 1 1 27 TYR CD2 C -3.043 0.930 4.651 1.00 . A A . 27 TYR CD2 1 1 15 6691 1 1 27 TYR CE1 C -0.980 2.818 4.387 1.00 . A A . 27 TYR CE1 1 1 15 6692 1 1 27 TYR CE2 C -2.576 1.638 5.779 1.00 . A A . 27 TYR CE2 1 1 15 6693 1 1 27 TYR CG C -2.503 1.207 3.379 1.00 . A A . 27 TYR CG 1 1 15 6694 1 1 27 TYR CZ C -1.541 2.579 5.645 1.00 . A A . 27 TYR CZ 1 1 15 6695 1 1 27 TYR H H -5.558 0.460 2.734 1.00 . A A . 27 TYR H 1 1 15 6696 1 1 27 TYR HA H -3.812 2.368 1.265 1.00 . A A . 27 TYR HA 1 1 15 6697 1 1 27 TYR HB2 H -3.390 -0.358 2.362 1.00 . A A . 27 TYR HB2 1 1 15 6698 1 1 27 TYR HB3 H -2.276 0.441 1.474 1.00 . A A . 27 TYR HB3 1 1 15 6699 1 1 27 TYR HD1 H -1.176 2.456 2.272 1.00 . A A . 27 TYR HD1 1 1 15 6700 1 1 27 TYR HD2 H -3.825 0.191 4.755 1.00 . A A . 27 TYR HD2 1 1 15 6701 1 1 27 TYR HE1 H -0.175 3.528 4.299 1.00 . A A . 27 TYR HE1 1 1 15 6702 1 1 27 TYR HE2 H -2.999 1.472 6.759 1.00 . A A . 27 TYR HE2 1 1 15 6703 1 1 27 TYR HH H -0.439 3.960 6.453 1.00 . A A . 27 TYR HH 1 1 15 6704 1 1 27 TYR N N -5.295 1.350 2.324 1.00 . A A . 27 TYR N 1 1 15 6705 1 1 27 TYR O O -4.470 1.392 -0.925 1.00 . A A . 27 TYR O 1 1 15 6706 1 1 27 TYR OH O -1.169 3.366 6.692 1.00 . A A . 27 TYR OH 1 1 15 6707 1 1 28 CYS C C -6.288 -0.826 -2.006 1.00 . A A . 28 CYS C 1 1 15 6708 1 1 28 CYS CA C -5.256 -1.346 -0.993 1.00 . A A . 28 CYS CA 1 1 15 6709 1 1 28 CYS CB C -5.622 -2.728 -0.448 1.00 . A A . 28 CYS CB 1 1 15 6710 1 1 28 CYS H H -5.315 -0.881 1.067 1.00 . A A . 28 CYS H 1 1 15 6711 1 1 28 CYS HA H -4.297 -1.410 -1.509 1.00 . A A . 28 CYS HA 1 1 15 6712 1 1 28 CYS HB2 H -5.161 -2.852 0.431 1.00 . A A . 28 CYS HB2 1 1 15 6713 1 1 28 CYS HB3 H -6.612 -2.761 -0.313 1.00 . A A . 28 CYS HB3 1 1 15 6714 1 1 28 CYS N N -5.095 -0.481 0.162 1.00 . A A . 28 CYS N 1 1 15 6715 1 1 28 CYS O O -6.243 -1.192 -3.175 1.00 . A A . 28 CYS O 1 1 15 6716 1 1 28 CYS SG S -5.150 -4.091 -1.536 1.00 . A A . 28 CYS SG 1 1 15 6717 1 1 29 GLY C C -7.972 2.348 -2.098 1.00 . A A . 29 GLY C 1 1 15 6718 1 1 29 GLY CA C -8.039 0.862 -2.452 1.00 . A A . 29 GLY CA 1 1 15 6719 1 1 29 GLY H H -7.211 0.293 -0.585 1.00 . A A . 29 GLY H 1 1 15 6720 1 1 29 GLY HA2 H -7.738 0.742 -3.495 1.00 . A A . 29 GLY HA2 1 1 15 6721 1 1 29 GLY HA3 H -9.069 0.524 -2.346 1.00 . A A . 29 GLY HA3 1 1 15 6722 1 1 29 GLY N N -7.177 0.075 -1.576 1.00 . A A . 29 GLY N 1 1 15 6723 1 1 29 GLY O O -8.949 3.062 -2.296 1.00 . A A . 29 GLY O 1 1 15 6724 1 1 30 ARG C C -7.848 4.589 0.004 1.00 . A A . 30 ARG C 1 1 15 6725 1 1 30 ARG CA C -6.664 4.099 -0.846 1.00 . A A . 30 ARG CA 1 1 15 6726 1 1 30 ARG CB C -6.158 5.148 -1.852 1.00 . A A . 30 ARG CB 1 1 15 6727 1 1 30 ARG CD C -7.160 7.181 -2.960 1.00 . A A . 30 ARG CD 1 1 15 6728 1 1 30 ARG CG C -7.188 5.652 -2.877 1.00 . A A . 30 ARG CG 1 1 15 6729 1 1 30 ARG CZ C -7.728 9.034 -1.369 1.00 . A A . 30 ARG CZ 1 1 15 6730 1 1 30 ARG H H -6.080 2.136 -1.439 1.00 . A A . 30 ARG H 1 1 15 6731 1 1 30 ARG HA H -5.851 3.962 -0.136 1.00 . A A . 30 ARG HA 1 1 15 6732 1 1 30 ARG HB2 H -5.832 5.938 -1.332 1.00 . A A . 30 ARG HB2 1 1 15 6733 1 1 30 ARG HB3 H -5.396 4.744 -2.358 1.00 . A A . 30 ARG HB3 1 1 15 6734 1 1 30 ARG HD2 H -6.214 7.489 -3.065 1.00 . A A . 30 ARG HD2 1 1 15 6735 1 1 30 ARG HD3 H -7.698 7.479 -3.748 1.00 . A A . 30 ARG HD3 1 1 15 6736 1 1 30 ARG HE H -8.109 7.107 -1.063 1.00 . A A . 30 ARG HE 1 1 15 6737 1 1 30 ARG HG2 H -6.972 5.270 -3.775 1.00 . A A . 30 ARG HG2 1 1 15 6738 1 1 30 ARG HG3 H -8.101 5.355 -2.599 1.00 . A A . 30 ARG HG3 1 1 15 6739 1 1 30 ARG HH11 H -6.435 9.724 -2.737 1.00 . A A . 30 ARG HH11 1 1 15 6740 1 1 30 ARG HH12 H -7.061 10.906 -1.637 1.00 . A A . 30 ARG HH12 1 1 15 6741 1 1 30 ARG HH21 H -9.022 8.723 0.130 1.00 . A A . 30 ARG HH21 1 1 15 6742 1 1 30 ARG HH22 H -8.480 10.357 -0.064 1.00 . A A . 30 ARG HH22 1 1 15 6743 1 1 30 ARG N N -6.858 2.790 -1.492 1.00 . A A . 30 ARG N 1 1 15 6744 1 1 30 ARG NE N -7.727 7.764 -1.737 1.00 . A A . 30 ARG NE 1 1 15 6745 1 1 30 ARG NH1 N -7.019 9.961 -1.961 1.00 . A A . 30 ARG NH1 1 1 15 6746 1 1 30 ARG NH2 N -8.468 9.400 -0.355 1.00 . A A . 30 ARG NH2 1 1 15 6747 1 1 30 ARG O O -8.063 5.791 0.149 1.00 . A A . 30 ARG O 1 1 15 6748 1 1 31 NH2 HN1 H -9.458 4.006 1.057 1.00 . A A . 31 NH2 HN1 1 1 15 6749 1 1 31 NH2 HN2 H -8.435 2.696 0.473 1.00 . A A . 31 NH2 HN2 1 1 15 6750 1 1 31 NH2 N N -8.633 3.684 0.579 1.00 . A A . 31 NH2 N 1 1 15 6751 2 2 1 NAG C1 C -10.137 10.802 1.999 1.00 . B A . 32 NAG C1 1 1 15 6752 2 2 1 NAG C2 C -9.324 9.919 2.935 1.00 . B A . 32 NAG C2 1 1 15 6753 2 2 1 NAG C3 C -8.240 10.777 3.597 1.00 . B A . 32 NAG C3 1 1 15 6754 2 2 1 NAG C4 C -7.337 11.375 2.496 1.00 . B A . 32 NAG C4 1 1 15 6755 2 2 1 NAG C5 C -8.270 12.284 1.679 1.00 . B A . 32 NAG C5 1 1 15 6756 2 2 1 NAG C6 C -7.528 12.985 0.528 1.00 . B A . 32 NAG C6 1 1 15 6757 2 2 1 NAG C7 C -10.162 7.915 4.135 1.00 . B A . 32 NAG C7 1 1 15 6758 2 2 1 NAG C8 C -11.120 7.422 5.176 1.00 . B A . 32 NAG C8 1 1 15 6759 2 2 1 NAG H1 H -10.763 11.500 2.558 1.00 . B A . 32 NAG H1 1 1 15 6760 2 2 1 NAG H2 H -8.809 9.181 2.321 1.00 . B A . 32 NAG H2 1 1 15 6761 2 2 1 NAG H3 H -8.686 11.570 4.198 1.00 . B A . 32 NAG H3 1 1 15 6762 2 2 1 NAG H4 H -7.013 10.564 1.842 1.00 . B A . 32 NAG H4 1 1 15 6763 2 2 1 NAG H5 H -8.717 13.046 2.319 1.00 . B A . 32 NAG H5 1 1 15 6764 2 2 1 NAG H61 H -6.882 13.761 0.937 1.00 . B A . 32 NAG H61 1 1 15 6765 2 2 1 NAG H62 H -8.255 13.462 -0.131 1.00 . B A . 32 NAG H62 1 1 15 6766 2 2 1 NAG H81 H -11.054 6.338 5.207 1.00 . B A . 32 NAG H81 1 1 15 6767 2 2 1 NAG H82 H -10.845 7.843 6.140 1.00 . B A . 32 NAG H82 1 1 15 6768 2 2 1 NAG H83 H -12.129 7.719 4.898 1.00 . B A . 32 NAG H83 1 1 15 6769 2 2 1 NAG HN2 H -10.824 9.751 4.487 1.00 . B A . 32 NAG HN2 1 1 15 6770 2 2 1 NAG HO1 H -11.313 10.585 0.547 1.00 . B A . 32 NAG HO1 1 1 15 6771 2 2 1 NAG HO3 H -6.695 10.401 4.622 1.00 . B A . 32 NAG HO3 1 1 15 6772 2 2 1 NAG HO4 H 2.675 7.952 7.483 1.00 . B A . 32 NAG HO4 1 1 15 6773 2 2 1 NAG HO6 H -5.817 12.331 -0.050 1.00 . B A . 32 NAG HO6 1 1 15 6774 2 2 1 NAG N2 N -10.180 9.225 3.920 1.00 . B A . 32 NAG N2 1 1 15 6775 2 2 1 NAG O1 O -10.899 9.998 1.185 1.00 . B A . 32 NAG O1 1 1 15 6776 2 2 1 NAG O3 O -7.519 9.917 4.447 1.00 . B A . 32 NAG O3 1 1 15 6777 2 2 1 NAG O4 O -6.157 12.089 2.990 1.00 . B A . 32 NAG O4 1 1 15 6778 2 2 1 NAG O5 O -9.294 11.492 1.092 1.00 . B A . 32 NAG O5 1 1 15 6779 2 2 1 NAG O6 O -6.746 12.075 -0.230 1.00 . B A . 32 NAG O6 1 1 15 6780 2 2 1 NAG O7 O -9.422 7.123 3.555 1.00 . B A . 32 NAG O7 1 1 16 6781 1 1 1 VAL C C 6.639 5.112 6.611 1.00 . A A . 1 VAL C 1 1 16 6782 1 1 1 VAL CA C 7.628 6.236 6.892 1.00 . A A . 1 VAL CA 1 1 16 6783 1 1 1 VAL CB C 7.860 6.392 8.399 1.00 . A A . 1 VAL CB 1 1 16 6784 1 1 1 VAL CG1 C 9.087 7.271 8.641 1.00 . A A . 1 VAL CG1 1 1 16 6785 1 1 1 VAL CG2 C 6.670 6.992 9.152 1.00 . A A . 1 VAL CG2 1 1 16 6786 1 1 1 VAL H1 H 6.211 7.679 6.415 1.00 . A A . 1 VAL H1 1 1 16 6787 1 1 1 VAL H2 H 7.366 7.388 5.237 1.00 . A A . 1 VAL H2 1 1 16 6788 1 1 1 VAL H3 H 7.753 8.266 6.554 1.00 . A A . 1 VAL H3 1 1 16 6789 1 1 1 VAL HA H 8.581 5.946 6.449 1.00 . A A . 1 VAL HA 1 1 16 6790 1 1 1 VAL HB H 8.072 5.405 8.814 1.00 . A A . 1 VAL HB 1 1 16 6791 1 1 1 VAL HG11 H 8.908 8.301 8.331 1.00 . A A . 1 VAL HG11 1 1 16 6792 1 1 1 VAL HG12 H 9.327 7.268 9.705 1.00 . A A . 1 VAL HG12 1 1 16 6793 1 1 1 VAL HG13 H 9.942 6.872 8.094 1.00 . A A . 1 VAL HG13 1 1 16 6794 1 1 1 VAL HG21 H 6.899 7.009 10.218 1.00 . A A . 1 VAL HG21 1 1 16 6795 1 1 1 VAL HG22 H 6.475 8.014 8.830 1.00 . A A . 1 VAL HG22 1 1 16 6796 1 1 1 VAL HG23 H 5.776 6.384 9.010 1.00 . A A . 1 VAL HG23 1 1 16 6797 1 1 1 VAL N N 7.195 7.490 6.238 1.00 . A A . 1 VAL N 1 1 16 6798 1 1 1 VAL O O 5.435 5.337 6.672 1.00 . A A . 1 VAL O 1 1 16 6799 1 1 2 GLY C C 6.076 2.739 4.361 1.00 . A A . 2 GLY C 1 1 16 6800 1 1 2 GLY CA C 6.306 2.778 5.875 1.00 . A A . 2 GLY CA 1 1 16 6801 1 1 2 GLY H H 8.114 3.940 5.987 1.00 . A A . 2 GLY H 1 1 16 6802 1 1 2 GLY HA2 H 6.803 1.853 6.166 1.00 . A A . 2 GLY HA2 1 1 16 6803 1 1 2 GLY HA3 H 5.337 2.820 6.372 1.00 . A A . 2 GLY HA3 1 1 16 6804 1 1 2 GLY N N 7.134 3.919 6.283 1.00 . A A . 2 GLY N 1 1 16 6805 1 1 2 GLY O O 5.064 2.216 3.896 1.00 . A A . 2 GLY O 1 1 16 6806 1 1 3 GLU C C 7.281 2.325 1.385 1.00 . A A . 3 GLU C 1 1 16 6807 1 1 3 GLU CA C 6.850 3.576 2.158 1.00 . A A . 3 GLU CA 1 1 16 6808 1 1 3 GLU CB C 7.589 4.856 1.718 1.00 . A A . 3 GLU CB 1 1 16 6809 1 1 3 GLU CD C 8.816 5.616 3.818 1.00 . A A . 3 GLU CD 1 1 16 6810 1 1 3 GLU CG C 8.954 5.156 2.361 1.00 . A A . 3 GLU CG 1 1 16 6811 1 1 3 GLU H H 7.814 3.705 4.050 1.00 . A A . 3 GLU H 1 1 16 6812 1 1 3 GLU HA H 5.803 3.738 1.923 1.00 . A A . 3 GLU HA 1 1 16 6813 1 1 3 GLU HB2 H 7.733 4.792 0.730 1.00 . A A . 3 GLU HB2 1 1 16 6814 1 1 3 GLU HB3 H 6.989 5.630 1.919 1.00 . A A . 3 GLU HB3 1 1 16 6815 1 1 3 GLU HG2 H 9.511 4.326 2.336 1.00 . A A . 3 GLU HG2 1 1 16 6816 1 1 3 GLU HG3 H 9.406 5.878 1.836 1.00 . A A . 3 GLU HG3 1 1 16 6817 1 1 3 GLU N N 6.964 3.376 3.599 1.00 . A A . 3 GLU N 1 1 16 6818 1 1 3 GLU O O 8.141 1.564 1.827 1.00 . A A . 3 GLU O 1 1 16 6819 1 1 3 GLU OE1 O 8.394 6.769 4.071 1.00 . A A . 3 GLU OE1 1 1 16 6820 1 1 3 GLU OE2 O 8.990 4.754 4.713 1.00 . A A . 3 GLU OE2 1 1 16 6821 1 1 4 CYS C C 8.030 0.529 -1.152 1.00 . A A . 4 CYS C 1 1 16 6822 1 1 4 CYS CA C 6.732 0.742 -0.368 1.00 . A A . 4 CYS CA 1 1 16 6823 1 1 4 CYS CB C 5.545 0.502 -1.306 1.00 . A A . 4 CYS CB 1 1 16 6824 1 1 4 CYS H H 5.940 2.721 -0.085 1.00 . A A . 4 CYS H 1 1 16 6825 1 1 4 CYS HA H 6.691 -0.003 0.427 1.00 . A A . 4 CYS HA 1 1 16 6826 1 1 4 CYS HB2 H 5.685 1.061 -2.123 1.00 . A A . 4 CYS HB2 1 1 16 6827 1 1 4 CYS HB3 H 5.548 -0.465 -1.559 1.00 . A A . 4 CYS HB3 1 1 16 6828 1 1 4 CYS N N 6.641 2.063 0.244 1.00 . A A . 4 CYS N 1 1 16 6829 1 1 4 CYS O O 8.554 1.414 -1.831 1.00 . A A . 4 CYS O 1 1 16 6830 1 1 4 CYS SG S 3.905 0.893 -0.647 1.00 . A A . 4 CYS SG 1 1 16 6831 1 1 5 VAL C C 8.937 -1.209 -3.512 1.00 . A A . 5 VAL C 1 1 16 6832 1 1 5 VAL CA C 9.492 -1.227 -2.096 1.00 . A A . 5 VAL CA 1 1 16 6833 1 1 5 VAL CB C 9.947 -2.635 -1.675 1.00 . A A . 5 VAL CB 1 1 16 6834 1 1 5 VAL CG1 C 11.116 -3.109 -2.543 1.00 . A A . 5 VAL CG1 1 1 16 6835 1 1 5 VAL CG2 C 10.419 -2.634 -0.217 1.00 . A A . 5 VAL CG2 1 1 16 6836 1 1 5 VAL H H 7.844 -1.416 -0.776 1.00 . A A . 5 VAL H 1 1 16 6837 1 1 5 VAL HA H 10.352 -0.559 -2.044 1.00 . A A . 5 VAL HA 1 1 16 6838 1 1 5 VAL HB H 9.122 -3.342 -1.765 1.00 . A A . 5 VAL HB 1 1 16 6839 1 1 5 VAL HG11 H 10.808 -3.196 -3.585 1.00 . A A . 5 VAL HG11 1 1 16 6840 1 1 5 VAL HG12 H 11.947 -2.408 -2.469 1.00 . A A . 5 VAL HG12 1 1 16 6841 1 1 5 VAL HG13 H 11.447 -4.090 -2.203 1.00 . A A . 5 VAL HG13 1 1 16 6842 1 1 5 VAL HG21 H 10.792 -3.622 0.050 1.00 . A A . 5 VAL HG21 1 1 16 6843 1 1 5 VAL HG22 H 11.214 -1.902 -0.082 1.00 . A A . 5 VAL HG22 1 1 16 6844 1 1 5 VAL HG23 H 9.592 -2.390 0.450 1.00 . A A . 5 VAL HG23 1 1 16 6845 1 1 5 VAL N N 8.447 -0.731 -1.212 1.00 . A A . 5 VAL N 1 1 16 6846 1 1 5 VAL O O 8.380 -2.196 -3.993 1.00 . A A . 5 VAL O 1 1 16 6847 1 1 6 ARG C C 7.190 -0.315 -5.846 1.00 . A A . 6 ARG C 1 1 16 6848 1 1 6 ARG CA C 8.585 0.230 -5.525 1.00 . A A . 6 ARG CA 1 1 16 6849 1 1 6 ARG CB C 9.691 -0.272 -6.475 1.00 . A A . 6 ARG CB 1 1 16 6850 1 1 6 ARG CD C 8.981 1.227 -8.448 1.00 . A A . 6 ARG CD 1 1 16 6851 1 1 6 ARG CG C 10.110 0.782 -7.510 1.00 . A A . 6 ARG CG 1 1 16 6852 1 1 6 ARG CZ C 8.636 -0.512 -10.232 1.00 . A A . 6 ARG CZ 1 1 16 6853 1 1 6 ARG H H 9.199 0.765 -3.534 1.00 . A A . 6 ARG H 1 1 16 6854 1 1 6 ARG HA H 8.487 1.309 -5.616 1.00 . A A . 6 ARG HA 1 1 16 6855 1 1 6 ARG HB2 H 10.492 -0.520 -5.930 1.00 . A A . 6 ARG HB2 1 1 16 6856 1 1 6 ARG HB3 H 9.354 -1.079 -6.960 1.00 . A A . 6 ARG HB3 1 1 16 6857 1 1 6 ARG HD2 H 8.300 1.734 -7.919 1.00 . A A . 6 ARG HD2 1 1 16 6858 1 1 6 ARG HD3 H 9.363 1.821 -9.157 1.00 . A A . 6 ARG HD3 1 1 16 6859 1 1 6 ARG HE H 7.597 -0.355 -8.534 1.00 . A A . 6 ARG HE 1 1 16 6860 1 1 6 ARG HG2 H 10.445 1.586 -7.020 1.00 . A A . 6 ARG HG2 1 1 16 6861 1 1 6 ARG HG3 H 10.847 0.399 -8.067 1.00 . A A . 6 ARG HG3 1 1 16 6862 1 1 6 ARG HH11 H 10.138 0.731 -10.719 1.00 . A A . 6 ARG HH11 1 1 16 6863 1 1 6 ARG HH12 H 9.821 -0.537 -11.855 1.00 . A A . 6 ARG HH12 1 1 16 6864 1 1 6 ARG HH21 H 7.223 -1.928 -10.054 1.00 . A A . 6 ARG HH21 1 1 16 6865 1 1 6 ARG HH22 H 8.196 -2.019 -11.484 1.00 . A A . 6 ARG HH22 1 1 16 6866 1 1 6 ARG N N 8.983 -0.026 -4.136 1.00 . A A . 6 ARG N 1 1 16 6867 1 1 6 ARG NE N 8.328 0.079 -9.089 1.00 . A A . 6 ARG NE 1 1 16 6868 1 1 6 ARG NH1 N 9.609 -0.071 -10.996 1.00 . A A . 6 ARG NH1 1 1 16 6869 1 1 6 ARG NH2 N 7.965 -1.570 -10.621 1.00 . A A . 6 ARG NH2 1 1 16 6870 1 1 6 ARG O O 6.898 -0.741 -6.963 1.00 . A A . 6 ARG O 1 1 16 6871 1 1 7 GLY C C 4.589 -1.923 -4.040 1.00 . A A . 7 GLY C 1 1 16 6872 1 1 7 GLY CA C 4.942 -0.705 -4.899 1.00 . A A . 7 GLY CA 1 1 16 6873 1 1 7 GLY H H 6.712 0.189 -4.015 1.00 . A A . 7 GLY H 1 1 16 6874 1 1 7 GLY HA2 H 4.304 0.121 -4.585 1.00 . A A . 7 GLY HA2 1 1 16 6875 1 1 7 GLY HA3 H 4.679 -0.944 -5.930 1.00 . A A . 7 GLY HA3 1 1 16 6876 1 1 7 GLY N N 6.336 -0.270 -4.830 1.00 . A A . 7 GLY N 1 1 16 6877 1 1 7 GLY O O 3.416 -2.293 -4.003 1.00 . A A . 7 GLY O 1 1 16 6878 1 1 8 ARG C C 5.775 -3.499 -1.027 1.00 . A A . 8 ARG C 1 1 16 6879 1 1 8 ARG CA C 5.198 -3.666 -2.427 1.00 . A A . 8 ARG CA 1 1 16 6880 1 1 8 ARG CB C 5.702 -4.985 -3.040 1.00 . A A . 8 ARG CB 1 1 16 6881 1 1 8 ARG CD C 3.303 -5.962 -3.213 1.00 . A A . 8 ARG CD 1 1 16 6882 1 1 8 ARG CG C 4.663 -5.724 -3.892 1.00 . A A . 8 ARG CG 1 1 16 6883 1 1 8 ARG CZ C 2.378 -6.560 -0.987 1.00 . A A . 8 ARG CZ 1 1 16 6884 1 1 8 ARG H H 6.520 -2.304 -3.415 1.00 . A A . 8 ARG H 1 1 16 6885 1 1 8 ARG HA H 4.120 -3.711 -2.293 1.00 . A A . 8 ARG HA 1 1 16 6886 1 1 8 ARG HB2 H 6.492 -4.780 -3.618 1.00 . A A . 8 ARG HB2 1 1 16 6887 1 1 8 ARG HB3 H 5.982 -5.590 -2.294 1.00 . A A . 8 ARG HB3 1 1 16 6888 1 1 8 ARG HD2 H 2.807 -5.094 -3.191 1.00 . A A . 8 ARG HD2 1 1 16 6889 1 1 8 ARG HD3 H 2.791 -6.625 -3.759 1.00 . A A . 8 ARG HD3 1 1 16 6890 1 1 8 ARG HE H 4.287 -6.794 -1.450 1.00 . A A . 8 ARG HE 1 1 16 6891 1 1 8 ARG HG2 H 4.505 -5.187 -4.720 1.00 . A A . 8 ARG HG2 1 1 16 6892 1 1 8 ARG HG3 H 5.044 -6.615 -4.140 1.00 . A A . 8 ARG HG3 1 1 16 6893 1 1 8 ARG HH11 H 0.939 -5.997 -2.266 1.00 . A A . 8 ARG HH11 1 1 16 6894 1 1 8 ARG HH12 H 0.409 -6.363 -0.659 1.00 . A A . 8 ARG HH12 1 1 16 6895 1 1 8 ARG HH21 H 3.477 -7.105 0.592 1.00 . A A . 8 ARG HH21 1 1 16 6896 1 1 8 ARG HH22 H 1.775 -6.959 0.877 1.00 . A A . 8 ARG HH22 1 1 16 6897 1 1 8 ARG N N 5.535 -2.555 -3.326 1.00 . A A . 8 ARG N 1 1 16 6898 1 1 8 ARG NE N 3.399 -6.476 -1.831 1.00 . A A . 8 ARG NE 1 1 16 6899 1 1 8 ARG NH1 N 1.145 -6.285 -1.331 1.00 . A A . 8 ARG NH1 1 1 16 6900 1 1 8 ARG NH2 N 2.557 -6.901 0.257 1.00 . A A . 8 ARG NH2 1 1 16 6901 1 1 8 ARG O O 6.661 -2.694 -0.785 1.00 . A A . 8 ARG O 1 1 16 6902 1 1 9 CYS C C 5.920 -6.324 1.072 1.00 . A A . 9 CYS C 1 1 16 6903 1 1 9 CYS CA C 5.998 -4.791 1.067 1.00 . A A . 9 CYS CA 1 1 16 6904 1 1 9 CYS CB C 5.293 -4.174 2.277 1.00 . A A . 9 CYS CB 1 1 16 6905 1 1 9 CYS H H 4.554 -4.959 -0.404 1.00 . A A . 9 CYS H 1 1 16 6906 1 1 9 CYS HA H 7.045 -4.484 1.044 1.00 . A A . 9 CYS HA 1 1 16 6907 1 1 9 CYS HB2 H 4.333 -4.023 2.041 1.00 . A A . 9 CYS HB2 1 1 16 6908 1 1 9 CYS HB3 H 5.352 -4.817 3.040 1.00 . A A . 9 CYS HB3 1 1 16 6909 1 1 9 CYS N N 5.303 -4.349 -0.127 1.00 . A A . 9 CYS N 1 1 16 6910 1 1 9 CYS O O 5.264 -6.886 0.182 1.00 . A A . 9 CYS O 1 1 16 6911 1 1 9 CYS SG S 6.008 -2.598 2.800 1.00 . A A . 9 CYS SG 1 1 16 6912 1 1 10 PRO C C 4.748 -8.721 2.488 1.00 . A A . 10 PRO C 1 1 16 6913 1 1 10 PRO CA C 6.244 -8.401 2.385 1.00 . A A . 10 PRO CA 1 1 16 6914 1 1 10 PRO CB C 6.976 -8.667 3.705 1.00 . A A . 10 PRO CB 1 1 16 6915 1 1 10 PRO CD C 7.503 -6.461 2.992 1.00 . A A . 10 PRO CD 1 1 16 6916 1 1 10 PRO CG C 8.140 -7.680 3.653 1.00 . A A . 10 PRO CG 1 1 16 6917 1 1 10 PRO HA H 6.675 -9.033 1.609 1.00 . A A . 10 PRO HA 1 1 16 6918 1 1 10 PRO HB2 H 6.383 -8.483 4.489 1.00 . A A . 10 PRO HB2 1 1 16 6919 1 1 10 PRO HB3 H 7.306 -9.610 3.750 1.00 . A A . 10 PRO HB3 1 1 16 6920 1 1 10 PRO HD2 H 7.062 -5.881 3.677 1.00 . A A . 10 PRO HD2 1 1 16 6921 1 1 10 PRO HD3 H 8.192 -5.930 2.498 1.00 . A A . 10 PRO HD3 1 1 16 6922 1 1 10 PRO HG2 H 8.471 -7.462 4.571 1.00 . A A . 10 PRO HG2 1 1 16 6923 1 1 10 PRO HG3 H 8.894 -8.038 3.102 1.00 . A A . 10 PRO HG3 1 1 16 6924 1 1 10 PRO N N 6.517 -7.001 2.069 1.00 . A A . 10 PRO N 1 1 16 6925 1 1 10 PRO O O 3.893 -7.856 2.294 1.00 . A A . 10 PRO O 1 1 16 6926 1 1 11 SER C C 2.113 -9.740 3.727 1.00 . A A . 11 SER C 1 1 16 6927 1 1 11 SER CA C 3.028 -10.447 2.717 1.00 . A A . 11 SER CA 1 1 16 6928 1 1 11 SER CB C 2.953 -11.964 2.892 1.00 . A A . 11 SER CB 1 1 16 6929 1 1 11 SER H H 5.169 -10.644 2.900 1.00 . A A . 11 SER H 1 1 16 6930 1 1 11 SER HA H 2.635 -10.221 1.726 1.00 . A A . 11 SER HA 1 1 16 6931 1 1 11 SER HB2 H 3.592 -12.407 2.263 1.00 . A A . 11 SER HB2 1 1 16 6932 1 1 11 SER HB3 H 3.189 -12.206 3.833 1.00 . A A . 11 SER HB3 1 1 16 6933 1 1 11 SER HG H 1.610 -13.353 2.612 1.00 . A A . 11 SER HG 1 1 16 6934 1 1 11 SER N N 4.419 -9.986 2.752 1.00 . A A . 11 SER N 1 1 16 6935 1 1 11 SER O O 2.523 -8.901 4.527 1.00 . A A . 11 SER O 1 1 16 6936 1 1 11 SER OG O 1.633 -12.389 2.608 1.00 . A A . 11 SER OG 1 1 16 6937 1 1 12 GLY C C -0.479 -7.981 4.402 1.00 . A A . 12 GLY C 1 1 16 6938 1 1 12 GLY CA C -0.214 -9.490 4.532 1.00 . A A . 12 GLY CA 1 1 16 6939 1 1 12 GLY H H 0.607 -10.837 3.057 1.00 . A A . 12 GLY H 1 1 16 6940 1 1 12 GLY HA2 H -1.150 -10.011 4.334 1.00 . A A . 12 GLY HA2 1 1 16 6941 1 1 12 GLY HA3 H 0.065 -9.690 5.567 1.00 . A A . 12 GLY HA3 1 1 16 6942 1 1 12 GLY N N 0.820 -10.045 3.659 1.00 . A A . 12 GLY N 1 1 16 6943 1 1 12 GLY O O -1.525 -7.532 4.868 1.00 . A A . 12 GLY O 1 1 16 6944 1 1 13 MET C C -0.157 -5.470 2.087 1.00 . A A . 13 MET C 1 1 16 6945 1 1 13 MET CA C 0.193 -5.760 3.552 1.00 . A A . 13 MET CA 1 1 16 6946 1 1 13 MET CB C 1.468 -4.981 3.891 1.00 . A A . 13 MET CB 1 1 16 6947 1 1 13 MET CE C 3.848 -4.949 7.329 1.00 . A A . 13 MET CE 1 1 16 6948 1 1 13 MET CG C 1.998 -5.258 5.297 1.00 . A A . 13 MET CG 1 1 16 6949 1 1 13 MET H H 1.330 -7.579 3.601 1.00 . A A . 13 MET H 1 1 16 6950 1 1 13 MET HA H -0.618 -5.391 4.182 1.00 . A A . 13 MET HA 1 1 16 6951 1 1 13 MET HB2 H 2.176 -5.232 3.231 1.00 . A A . 13 MET HB2 1 1 16 6952 1 1 13 MET HB3 H 1.271 -4.004 3.814 1.00 . A A . 13 MET HB3 1 1 16 6953 1 1 13 MET HE1 H 4.746 -4.470 7.718 1.00 . A A . 13 MET HE1 1 1 16 6954 1 1 13 MET HE2 H 3.010 -4.738 7.994 1.00 . A A . 13 MET HE2 1 1 16 6955 1 1 13 MET HE3 H 4.008 -6.026 7.274 1.00 . A A . 13 MET HE3 1 1 16 6956 1 1 13 MET HG2 H 1.288 -5.021 5.960 1.00 . A A . 13 MET HG2 1 1 16 6957 1 1 13 MET HG3 H 2.213 -6.232 5.373 1.00 . A A . 13 MET HG3 1 1 16 6958 1 1 13 MET N N 0.413 -7.189 3.796 1.00 . A A . 13 MET N 1 1 16 6959 1 1 13 MET O O 0.110 -6.281 1.195 1.00 . A A . 13 MET O 1 1 16 6960 1 1 13 MET SD S 3.489 -4.303 5.676 1.00 . A A . 13 MET SD 1 1 16 6961 1 1 14 CYS C C -0.289 -2.315 0.356 1.00 . A A . 14 CYS C 1 1 16 6962 1 1 14 CYS CA C -0.836 -3.744 0.463 1.00 . A A . 14 CYS CA 1 1 16 6963 1 1 14 CYS CB C -2.324 -3.770 0.117 1.00 . A A . 14 CYS CB 1 1 16 6964 1 1 14 CYS H H -0.882 -3.647 2.600 1.00 . A A . 14 CYS H 1 1 16 6965 1 1 14 CYS HA H -0.299 -4.367 -0.249 1.00 . A A . 14 CYS HA 1 1 16 6966 1 1 14 CYS HB2 H -2.763 -3.008 0.594 1.00 . A A . 14 CYS HB2 1 1 16 6967 1 1 14 CYS HB3 H -2.412 -3.641 -0.871 1.00 . A A . 14 CYS HB3 1 1 16 6968 1 1 14 CYS N N -0.651 -4.260 1.820 1.00 . A A . 14 CYS N 1 1 16 6969 1 1 14 CYS O O -0.203 -1.623 1.368 1.00 . A A . 14 CYS O 1 1 16 6970 1 1 14 CYS SG S -3.211 -5.291 0.561 1.00 . A A . 14 CYS SG 1 1 16 6971 1 1 15 CYS C C -0.450 0.481 -1.473 1.00 . A A . 15 CYS C 1 1 16 6972 1 1 15 CYS CA C 0.629 -0.533 -1.063 1.00 . A A . 15 CYS CA 1 1 16 6973 1 1 15 CYS CB C 1.729 -0.619 -2.124 1.00 . A A . 15 CYS CB 1 1 16 6974 1 1 15 CYS H H -0.114 -2.432 -1.668 1.00 . A A . 15 CYS H 1 1 16 6975 1 1 15 CYS HA H 1.093 -0.204 -0.137 1.00 . A A . 15 CYS HA 1 1 16 6976 1 1 15 CYS HB2 H 2.351 -1.362 -1.878 1.00 . A A . 15 CYS HB2 1 1 16 6977 1 1 15 CYS HB3 H 1.304 -0.818 -3.007 1.00 . A A . 15 CYS HB3 1 1 16 6978 1 1 15 CYS N N 0.054 -1.862 -0.854 1.00 . A A . 15 CYS N 1 1 16 6979 1 1 15 CYS O O -1.278 0.180 -2.330 1.00 . A A . 15 CYS O 1 1 16 6980 1 1 15 CYS SG S 2.690 0.907 -2.279 1.00 . A A . 15 CYS SG 1 1 16 6981 1 1 16 SER C C -1.288 3.573 -2.234 1.00 . A A . 16 SER C 1 1 16 6982 1 1 16 SER CA C -1.498 2.673 -1.028 1.00 . A A . 16 SER CA 1 1 16 6983 1 1 16 SER CB C -1.553 3.566 0.219 1.00 . A A . 16 SER CB 1 1 16 6984 1 1 16 SER H H 0.308 1.892 -0.231 1.00 . A A . 16 SER H 1 1 16 6985 1 1 16 SER HA H -2.452 2.160 -1.143 1.00 . A A . 16 SER HA 1 1 16 6986 1 1 16 SER HB2 H -2.406 4.088 0.206 1.00 . A A . 16 SER HB2 1 1 16 6987 1 1 16 SER HB3 H -1.529 2.987 1.034 1.00 . A A . 16 SER HB3 1 1 16 6988 1 1 16 SER HG H -0.525 4.959 1.110 1.00 . A A . 16 SER HG 1 1 16 6989 1 1 16 SER N N -0.443 1.676 -0.874 1.00 . A A . 16 SER N 1 1 16 6990 1 1 16 SER O O -0.180 3.720 -2.747 1.00 . A A . 16 SER O 1 1 16 6991 1 1 16 SER OG O -0.459 4.472 0.266 1.00 . A A . 16 SER OG 1 1 16 6992 1 1 17 GLN C C -1.338 6.591 -3.018 1.00 . A A . 17 GLN C 1 1 16 6993 1 1 17 GLN CA C -2.207 5.431 -3.524 1.00 . A A . 17 GLN CA 1 1 16 6994 1 1 17 GLN CB C -3.585 5.871 -4.017 1.00 . A A . 17 GLN CB 1 1 16 6995 1 1 17 GLN CD C -4.758 6.047 -1.744 1.00 . A A . 17 GLN CD 1 1 16 6996 1 1 17 GLN CG C -4.337 6.759 -3.025 1.00 . A A . 17 GLN CG 1 1 16 6997 1 1 17 GLN H H -3.234 4.161 -2.168 1.00 . A A . 17 GLN H 1 1 16 6998 1 1 17 GLN HA H -1.698 5.057 -4.394 1.00 . A A . 17 GLN HA 1 1 16 6999 1 1 17 GLN HB2 H -3.468 6.380 -4.870 1.00 . A A . 17 GLN HB2 1 1 16 7000 1 1 17 GLN HB3 H -4.135 5.054 -4.189 1.00 . A A . 17 GLN HB3 1 1 16 7001 1 1 17 GLN HE21 H -5.651 4.561 -2.769 1.00 . A A . 17 GLN HE21 1 1 16 7002 1 1 17 GLN HE22 H -5.569 4.373 -0.997 1.00 . A A . 17 GLN HE22 1 1 16 7003 1 1 17 GLN HG2 H -3.744 7.525 -2.778 1.00 . A A . 17 GLN HG2 1 1 16 7004 1 1 17 GLN HG3 H -5.159 7.106 -3.476 1.00 . A A . 17 GLN HG3 1 1 16 7005 1 1 17 GLN N N -2.332 4.327 -2.584 1.00 . A A . 17 GLN N 1 1 16 7006 1 1 17 GLN NE2 N -5.333 4.869 -1.854 1.00 . A A . 17 GLN NE2 1 1 16 7007 1 1 17 GLN O O -1.103 7.538 -3.761 1.00 . A A . 17 GLN O 1 1 16 7008 1 1 17 GLN OE1 O -4.573 6.531 -0.636 1.00 . A A . 17 GLN OE1 1 1 16 7009 1 1 18 . C C 1.567 6.769 -1.189 1.00 . A A . 18 PFF C 1 1 16 7010 1 1 18 . CA C 0.188 7.437 -1.287 1.00 . A A . 18 PFF CA 1 1 16 7011 1 1 18 . CB C -0.302 8.052 0.031 1.00 . A A . 18 PFF CB 1 1 16 7012 1 1 18 . CD1 C -0.735 10.421 -0.739 1.00 . A A . 18 PFF CD1 1 1 16 7013 1 1 18 . CD2 C -2.629 8.992 -0.214 1.00 . A A . 18 PFF CD2 1 1 16 7014 1 1 18 . CE1 C -1.609 11.380 -1.283 1.00 . A A . 18 PFF CE1 1 1 16 7015 1 1 18 . CE2 C -3.502 9.934 -0.788 1.00 . A A . 18 PFF CE2 1 1 16 7016 1 1 18 . CG C -1.243 9.207 -0.242 1.00 . A A . 18 PFF CG 1 1 16 7017 1 1 18 . CZ C -2.987 11.115 -1.349 1.00 . A A . 18 PFF CZ 1 1 16 7018 1 1 18 . F F -3.826 12.004 -1.944 1.00 . A A . 18 PFF F 1 1 16 7019 1 1 18 . H H -1.038 5.717 -1.195 1.00 . A A . 18 PFF H 1 1 16 7020 1 1 18 . HA H 0.318 8.251 -2.000 1.00 . A A . 18 PFF HA 1 1 16 7021 1 1 18 . HB2 H -0.802 7.287 0.641 1.00 . A A . 18 PFF HB2 1 1 16 7022 1 1 18 . HB3 H 0.541 8.451 0.590 1.00 . A A . 18 PFF HB3 1 1 16 7023 1 1 18 . HD1 H 0.333 10.588 -0.773 1.00 . A A . 18 PFF HD1 1 1 16 7024 1 1 18 . HD2 H -2.998 8.070 0.198 1.00 . A A . 18 PFF HD2 1 1 16 7025 1 1 18 . HE1 H -1.220 12.302 -1.689 1.00 . A A . 18 PFF HE1 1 1 16 7026 1 1 18 . HE2 H -4.563 9.742 -0.828 1.00 . A A . 18 PFF HE2 1 1 16 7027 1 1 18 . N N -0.832 6.518 -1.782 1.00 . A A . 18 PFF N 1 1 16 7028 1 1 18 . O O 2.519 7.404 -0.749 1.00 . A A . 18 PFF O 1 1 16 7029 1 1 19 GLY C C 3.414 4.188 -0.382 1.00 . A A . 19 GLY C 1 1 16 7030 1 1 19 GLY CA C 3.000 4.848 -1.693 1.00 . A A . 19 GLY CA 1 1 16 7031 1 1 19 GLY H H 0.901 5.018 -2.013 1.00 . A A . 19 GLY H 1 1 16 7032 1 1 19 GLY HA2 H 2.967 4.081 -2.464 1.00 . A A . 19 GLY HA2 1 1 16 7033 1 1 19 GLY HA3 H 3.768 5.572 -1.962 1.00 . A A . 19 GLY HA3 1 1 16 7034 1 1 19 GLY N N 1.704 5.513 -1.631 1.00 . A A . 19 GLY N 1 1 16 7035 1 1 19 GLY O O 4.600 3.919 -0.198 1.00 . A A . 19 GLY O 1 1 16 7036 1 1 20 . C C 2.169 1.925 1.970 1.00 . A A . 20 PFF C 1 1 16 7037 1 1 20 . CA C 2.783 3.313 1.820 1.00 . A A . 20 PFF CA 1 1 16 7038 1 1 20 . CB C 2.290 4.247 2.915 1.00 . A A . 20 PFF CB 1 1 16 7039 1 1 20 . CD1 C 2.399 6.684 2.228 1.00 . A A . 20 PFF CD1 1 1 16 7040 1 1 20 . CD2 C 4.263 5.725 3.454 1.00 . A A . 20 PFF CD2 1 1 16 7041 1 1 20 . CE1 C 3.016 7.945 2.277 1.00 . A A . 20 PFF CE1 1 1 16 7042 1 1 20 . CE2 C 4.910 6.969 3.443 1.00 . A A . 20 PFF CE2 1 1 16 7043 1 1 20 . CG C 2.991 5.586 2.875 1.00 . A A . 20 PFF CG 1 1 16 7044 1 1 20 . CZ C 4.269 8.088 2.891 1.00 . A A . 20 PFF CZ 1 1 16 7045 1 1 20 . F F 4.903 9.290 2.869 1.00 . A A . 20 PFF F 1 1 16 7046 1 1 20 . H H 1.506 4.170 0.358 1.00 . A A . 20 PFF H 1 1 16 7047 1 1 20 . HA H 3.856 3.195 1.929 1.00 . A A . 20 PFF HA 1 1 16 7048 1 1 20 . HB2 H 1.204 4.364 2.859 1.00 . A A . 20 PFF HB2 1 1 16 7049 1 1 20 . HB3 H 2.505 3.772 3.864 1.00 . A A . 20 PFF HB3 1 1 16 7050 1 1 20 . HD1 H 1.450 6.566 1.729 1.00 . A A . 20 PFF HD1 1 1 16 7051 1 1 20 . HD2 H 4.722 4.889 3.952 1.00 . A A . 20 PFF HD2 1 1 16 7052 1 1 20 . HE1 H 2.551 8.798 1.804 1.00 . A A . 20 PFF HE1 1 1 16 7053 1 1 20 . HE2 H 5.905 7.065 3.842 1.00 . A A . 20 PFF HE2 1 1 16 7054 1 1 20 . N N 2.475 3.927 0.534 1.00 . A A . 20 PFF N 1 1 16 7055 1 1 20 . O O 1.193 1.605 1.297 1.00 . A A . 20 PFF O 1 1 16 7056 1 1 21 CYS C C 1.257 -0.325 4.252 1.00 . A A . 21 CYS C 1 1 16 7057 1 1 21 CYS CA C 2.257 -0.259 3.093 1.00 . A A . 21 CYS CA 1 1 16 7058 1 1 21 CYS CB C 3.466 -1.141 3.404 1.00 . A A . 21 CYS CB 1 1 16 7059 1 1 21 CYS H H 3.534 1.432 3.374 1.00 . A A . 21 CYS H 1 1 16 7060 1 1 21 CYS HA H 1.786 -0.637 2.188 1.00 . A A . 21 CYS HA 1 1 16 7061 1 1 21 CYS HB2 H 3.916 -0.777 4.220 1.00 . A A . 21 CYS HB2 1 1 16 7062 1 1 21 CYS HB3 H 3.137 -2.067 3.589 1.00 . A A . 21 CYS HB3 1 1 16 7063 1 1 21 CYS N N 2.715 1.106 2.868 1.00 . A A . 21 CYS N 1 1 16 7064 1 1 21 CYS O O 1.552 0.155 5.344 1.00 . A A . 21 CYS O 1 1 16 7065 1 1 21 CYS SG S 4.691 -1.233 2.078 1.00 . A A . 21 CYS SG 1 1 16 7066 1 1 22 GLY C C -2.069 -1.943 4.733 1.00 . A A . 22 GLY C 1 1 16 7067 1 1 22 GLY CA C -0.911 -1.024 5.103 1.00 . A A . 22 GLY CA 1 1 16 7068 1 1 22 GLY H H -0.192 -1.218 3.110 1.00 . A A . 22 GLY H 1 1 16 7069 1 1 22 GLY HA2 H -0.435 -1.426 5.998 1.00 . A A . 22 GLY HA2 1 1 16 7070 1 1 22 GLY HA3 H -1.295 -0.034 5.342 1.00 . A A . 22 GLY HA3 1 1 16 7071 1 1 22 GLY N N 0.082 -0.925 4.045 1.00 . A A . 22 GLY N 1 1 16 7072 1 1 22 GLY O O -1.894 -2.917 3.996 1.00 . A A . 22 GLY O 1 1 16 7073 1 1 23 LYS C C -5.656 -1.804 4.785 1.00 . A A . 23 LYS C 1 1 16 7074 1 1 23 LYS CA C -4.418 -2.511 5.349 1.00 . A A . 23 LYS CA 1 1 16 7075 1 1 23 LYS CB C -4.683 -2.908 6.815 1.00 . A A . 23 LYS CB 1 1 16 7076 1 1 23 LYS CD C -3.473 -5.138 6.918 1.00 . A A . 23 LYS CD 1 1 16 7077 1 1 23 LYS CE C -2.528 -5.961 7.797 1.00 . A A . 23 LYS CE 1 1 16 7078 1 1 23 LYS CG C -3.556 -3.715 7.474 1.00 . A A . 23 LYS CG 1 1 16 7079 1 1 23 LYS H H -3.292 -0.773 5.818 1.00 . A A . 23 LYS H 1 1 16 7080 1 1 23 LYS HA H -4.238 -3.404 4.748 1.00 . A A . 23 LYS HA 1 1 16 7081 1 1 23 LYS HB2 H -4.818 -2.071 7.345 1.00 . A A . 23 LYS HB2 1 1 16 7082 1 1 23 LYS HB3 H -5.517 -3.458 6.843 1.00 . A A . 23 LYS HB3 1 1 16 7083 1 1 23 LYS HD2 H -4.383 -5.554 6.923 1.00 . A A . 23 LYS HD2 1 1 16 7084 1 1 23 LYS HD3 H -3.123 -5.112 5.982 1.00 . A A . 23 LYS HD3 1 1 16 7085 1 1 23 LYS HE2 H -1.598 -5.607 7.697 1.00 . A A . 23 LYS HE2 1 1 16 7086 1 1 23 LYS HE3 H -2.816 -5.879 8.751 1.00 . A A . 23 LYS HE3 1 1 16 7087 1 1 23 LYS HG2 H -2.686 -3.251 7.307 1.00 . A A . 23 LYS HG2 1 1 16 7088 1 1 23 LYS HG3 H -3.725 -3.762 8.458 1.00 . A A . 23 LYS HG3 1 1 16 7089 1 1 23 LYS HZ1 H -1.884 -7.918 7.959 1.00 . A A . 23 LYS HZ1 1 1 16 7090 1 1 23 LYS HZ2 H -3.468 -7.781 7.525 1.00 . A A . 23 LYS HZ2 1 1 16 7091 1 1 23 LYS HZ3 H -2.287 -7.473 6.428 1.00 . A A . 23 LYS HZ3 1 1 16 7092 1 1 23 LYS N N -3.235 -1.650 5.318 1.00 . A A . 23 LYS N 1 1 16 7093 1 1 23 LYS NZ N -2.545 -7.388 7.408 1.00 . A A . 23 LYS NZ 1 1 16 7094 1 1 23 LYS O O -5.635 -0.612 4.479 1.00 . A A . 23 LYS O 1 1 16 7095 1 1 24 GLY C C -8.223 -1.460 3.002 1.00 . A A . 24 GLY C 1 1 16 7096 1 1 24 GLY CA C -8.089 -2.051 4.407 1.00 . A A . 24 GLY CA 1 1 16 7097 1 1 24 GLY H H -6.666 -3.529 4.964 1.00 . A A . 24 GLY H 1 1 16 7098 1 1 24 GLY HA2 H -8.802 -2.870 4.507 1.00 . A A . 24 GLY HA2 1 1 16 7099 1 1 24 GLY HA3 H -8.347 -1.277 5.132 1.00 . A A . 24 GLY HA3 1 1 16 7100 1 1 24 GLY N N -6.755 -2.559 4.712 1.00 . A A . 24 GLY N 1 1 16 7101 1 1 24 GLY O O -7.267 -1.439 2.225 1.00 . A A . 24 GLY O 1 1 16 7102 1 1 25 PRO C C -8.666 0.750 1.027 1.00 . A A . 25 PRO C 1 1 16 7103 1 1 25 PRO CA C -9.682 -0.341 1.368 1.00 . A A . 25 PRO CA 1 1 16 7104 1 1 25 PRO CB C -11.108 0.211 1.468 1.00 . A A . 25 PRO CB 1 1 16 7105 1 1 25 PRO CD C -10.625 -1.007 3.465 1.00 . A A . 25 PRO CD 1 1 16 7106 1 1 25 PRO CG C -11.766 -0.716 2.490 1.00 . A A . 25 PRO CG 1 1 16 7107 1 1 25 PRO HA H -9.651 -1.113 0.599 1.00 . A A . 25 PRO HA 1 1 16 7108 1 1 25 PRO HB2 H -11.105 1.157 1.791 1.00 . A A . 25 PRO HB2 1 1 16 7109 1 1 25 PRO HB3 H -11.575 0.161 0.585 1.00 . A A . 25 PRO HB3 1 1 16 7110 1 1 25 PRO HD2 H -10.594 -0.314 4.186 1.00 . A A . 25 PRO HD2 1 1 16 7111 1 1 25 PRO HD3 H -10.737 -1.912 3.876 1.00 . A A . 25 PRO HD3 1 1 16 7112 1 1 25 PRO HG2 H -12.527 -0.261 2.952 1.00 . A A . 25 PRO HG2 1 1 16 7113 1 1 25 PRO HG3 H -12.093 -1.556 2.057 1.00 . A A . 25 PRO HG3 1 1 16 7114 1 1 25 PRO N N -9.418 -0.959 2.659 1.00 . A A . 25 PRO N 1 1 16 7115 1 1 25 PRO O O -8.114 0.754 -0.070 1.00 . A A . 25 PRO O 1 1 16 7116 1 1 26 LYS C C -6.166 2.544 1.236 1.00 . A A . 26 LYS C 1 1 16 7117 1 1 26 LYS CA C -7.583 2.854 1.728 1.00 . A A . 26 LYS CA 1 1 16 7118 1 1 26 LYS CB C -7.604 3.758 2.977 1.00 . A A . 26 LYS CB 1 1 16 7119 1 1 26 LYS CD C -6.574 5.912 2.043 1.00 . A A . 26 LYS CD 1 1 16 7120 1 1 26 LYS CE C -6.817 7.407 1.817 1.00 . A A . 26 LYS CE 1 1 16 7121 1 1 26 LYS CG C -7.811 5.246 2.648 1.00 . A A . 26 LYS CG 1 1 16 7122 1 1 26 LYS H H -8.851 1.551 2.865 1.00 . A A . 26 LYS H 1 1 16 7123 1 1 26 LYS HA H -8.065 3.386 0.909 1.00 . A A . 26 LYS HA 1 1 16 7124 1 1 26 LYS HB2 H -8.349 3.458 3.573 1.00 . A A . 26 LYS HB2 1 1 16 7125 1 1 26 LYS HB3 H -6.732 3.657 3.456 1.00 . A A . 26 LYS HB3 1 1 16 7126 1 1 26 LYS HD2 H -5.801 5.796 2.667 1.00 . A A . 26 LYS HD2 1 1 16 7127 1 1 26 LYS HD3 H -6.364 5.478 1.167 1.00 . A A . 26 LYS HD3 1 1 16 7128 1 1 26 LYS HE2 H -7.500 7.524 1.095 1.00 . A A . 26 LYS HE2 1 1 16 7129 1 1 26 LYS HE3 H -7.154 7.817 2.665 1.00 . A A . 26 LYS HE3 1 1 16 7130 1 1 26 LYS HG2 H -8.564 5.324 1.995 1.00 . A A . 26 LYS HG2 1 1 16 7131 1 1 26 LYS HG3 H -8.049 5.727 3.492 1.00 . A A . 26 LYS HG3 1 1 16 7132 1 1 26 LYS HZ1 H -5.153 7.629 0.601 1.00 . A A . 26 LYS HZ1 1 1 16 7133 1 1 26 LYS HZ2 H -5.704 9.077 1.240 1.00 . A A . 26 LYS HZ2 1 1 16 7134 1 1 26 LYS HZ3 H -4.910 8.050 2.193 1.00 . A A . 26 LYS HZ3 1 1 16 7135 1 1 26 LYS N N -8.378 1.648 1.978 1.00 . A A . 26 LYS N 1 1 16 7136 1 1 26 LYS NZ N -5.565 8.082 1.415 1.00 . A A . 26 LYS NZ 1 1 16 7137 1 1 26 LYS O O -5.690 3.224 0.329 1.00 . A A . 26 LYS O 1 1 16 7138 1 1 27 TYR C C -4.483 -0.009 0.114 1.00 . A A . 27 TYR C 1 1 16 7139 1 1 27 TYR CA C -4.240 1.056 1.177 1.00 . A A . 27 TYR CA 1 1 16 7140 1 1 27 TYR CB C -3.272 0.490 2.226 1.00 . A A . 27 TYR CB 1 1 16 7141 1 1 27 TYR CD1 C -3.543 2.134 4.160 1.00 . A A . 27 TYR CD1 1 1 16 7142 1 1 27 TYR CD2 C -1.320 1.675 3.320 1.00 . A A . 27 TYR CD2 1 1 16 7143 1 1 27 TYR CE1 C -2.982 2.815 5.253 1.00 . A A . 27 TYR CE1 1 1 16 7144 1 1 27 TYR CE2 C -0.761 2.423 4.375 1.00 . A A . 27 TYR CE2 1 1 16 7145 1 1 27 TYR CG C -2.710 1.477 3.239 1.00 . A A . 27 TYR CG 1 1 16 7146 1 1 27 TYR CZ C -1.597 2.947 5.369 1.00 . A A . 27 TYR CZ 1 1 16 7147 1 1 27 TYR H H -5.945 0.953 2.489 1.00 . A A . 27 TYR H 1 1 16 7148 1 1 27 TYR HA H -3.743 1.894 0.692 1.00 . A A . 27 TYR HA 1 1 16 7149 1 1 27 TYR HB2 H -3.757 -0.222 2.734 1.00 . A A . 27 TYR HB2 1 1 16 7150 1 1 27 TYR HB3 H -2.500 0.084 1.738 1.00 . A A . 27 TYR HB3 1 1 16 7151 1 1 27 TYR HD1 H -4.602 2.191 3.995 1.00 . A A . 27 TYR HD1 1 1 16 7152 1 1 27 TYR HD2 H -0.682 1.199 2.594 1.00 . A A . 27 TYR HD2 1 1 16 7153 1 1 27 TYR HE1 H -3.595 3.334 5.968 1.00 . A A . 27 TYR HE1 1 1 16 7154 1 1 27 TYR HE2 H 0.310 2.541 4.458 1.00 . A A . 27 TYR HE2 1 1 16 7155 1 1 27 TYR HH H -0.168 3.924 6.240 1.00 . A A . 27 TYR HH 1 1 16 7156 1 1 27 TYR N N -5.510 1.499 1.756 1.00 . A A . 27 TYR N 1 1 16 7157 1 1 27 TYR O O -3.951 0.082 -0.982 1.00 . A A . 27 TYR O 1 1 16 7158 1 1 27 TYR OH O -1.098 3.696 6.386 1.00 . A A . 27 TYR OH 1 1 16 7159 1 1 28 CYS C C -6.308 -2.212 -1.513 1.00 . A A . 28 CYS C 1 1 16 7160 1 1 28 CYS CA C -5.294 -2.254 -0.366 1.00 . A A . 28 CYS CA 1 1 16 7161 1 1 28 CYS CB C -5.570 -3.433 0.564 1.00 . A A . 28 CYS CB 1 1 16 7162 1 1 28 CYS H H -5.721 -1.054 1.343 1.00 . A A . 28 CYS H 1 1 16 7163 1 1 28 CYS HA H -4.316 -2.391 -0.823 1.00 . A A . 28 CYS HA 1 1 16 7164 1 1 28 CYS HB2 H -5.054 -3.304 1.411 1.00 . A A . 28 CYS HB2 1 1 16 7165 1 1 28 CYS HB3 H -6.548 -3.460 0.770 1.00 . A A . 28 CYS HB3 1 1 16 7166 1 1 28 CYS N N -5.260 -1.042 0.438 1.00 . A A . 28 CYS N 1 1 16 7167 1 1 28 CYS O O -6.022 -2.699 -2.607 1.00 . A A . 28 CYS O 1 1 16 7168 1 1 28 CYS SG S -5.087 -5.008 -0.180 1.00 . A A . 28 CYS SG 1 1 16 7169 1 1 29 GLY C C -7.918 -0.198 -3.287 1.00 . A A . 29 GLY C 1 1 16 7170 1 1 29 GLY CA C -8.421 -1.329 -2.390 1.00 . A A . 29 GLY CA 1 1 16 7171 1 1 29 GLY H H -7.605 -1.103 -0.425 1.00 . A A . 29 GLY H 1 1 16 7172 1 1 29 GLY HA2 H -8.560 -2.226 -2.993 1.00 . A A . 29 GLY HA2 1 1 16 7173 1 1 29 GLY HA3 H -9.382 -1.036 -1.970 1.00 . A A . 29 GLY HA3 1 1 16 7174 1 1 29 GLY N N -7.471 -1.589 -1.306 1.00 . A A . 29 GLY N 1 1 16 7175 1 1 29 GLY O O -8.125 -0.223 -4.497 1.00 . A A . 29 GLY O 1 1 16 7176 1 1 30 ARG C C -6.964 2.825 -4.149 1.00 . A A . 30 ARG C 1 1 16 7177 1 1 30 ARG CA C -6.318 1.780 -3.235 1.00 . A A . 30 ARG CA 1 1 16 7178 1 1 30 ARG CB C -5.069 1.126 -3.852 1.00 . A A . 30 ARG CB 1 1 16 7179 1 1 30 ARG CD C -4.481 -0.592 -5.594 1.00 . A A . 30 ARG CD 1 1 16 7180 1 1 30 ARG CG C -5.158 0.758 -5.342 1.00 . A A . 30 ARG CG 1 1 16 7181 1 1 30 ARG CZ C -6.253 -2.363 -5.706 1.00 . A A . 30 ARG CZ 1 1 16 7182 1 1 30 ARG H H -7.258 0.715 -1.661 1.00 . A A . 30 ARG H 1 1 16 7183 1 1 30 ARG HA H -5.956 2.337 -2.370 1.00 . A A . 30 ARG HA 1 1 16 7184 1 1 30 ARG HB2 H -4.306 1.762 -3.741 1.00 . A A . 30 ARG HB2 1 1 16 7185 1 1 30 ARG HB3 H -4.881 0.287 -3.342 1.00 . A A . 30 ARG HB3 1 1 16 7186 1 1 30 ARG HD2 H -4.356 -0.716 -6.578 1.00 . A A . 30 ARG HD2 1 1 16 7187 1 1 30 ARG HD3 H -3.590 -0.600 -5.140 1.00 . A A . 30 ARG HD3 1 1 16 7188 1 1 30 ARG HE H -5.209 -1.941 -4.086 1.00 . A A . 30 ARG HE 1 1 16 7189 1 1 30 ARG HG2 H -6.119 0.701 -5.611 1.00 . A A . 30 ARG HG2 1 1 16 7190 1 1 30 ARG HG3 H -4.701 1.463 -5.884 1.00 . A A . 30 ARG HG3 1 1 16 7191 1 1 30 ARG HH11 H -6.077 -1.398 -7.459 1.00 . A A . 30 ARG HH11 1 1 16 7192 1 1 30 ARG HH12 H -7.291 -2.632 -7.405 1.00 . A A . 30 ARG HH12 1 1 16 7193 1 1 30 ARG HH21 H -6.685 -3.516 -4.121 1.00 . A A . 30 ARG HH21 1 1 16 7194 1 1 30 ARG HH22 H -7.630 -3.813 -5.542 1.00 . A A . 30 ARG HH22 1 1 16 7195 1 1 30 ARG N N -7.210 0.758 -2.675 1.00 . A A . 30 ARG N 1 1 16 7196 1 1 30 ARG NE N -5.299 -1.700 -5.069 1.00 . A A . 30 ARG NE 1 1 16 7197 1 1 30 ARG NH1 N -6.565 -2.111 -6.956 1.00 . A A . 30 ARG NH1 1 1 16 7198 1 1 30 ARG NH2 N -6.908 -3.305 -5.073 1.00 . A A . 30 ARG NH2 1 1 16 7199 1 1 30 ARG O O -6.484 3.952 -4.183 1.00 . A A . 30 ARG O 1 1 16 7200 1 1 31 NH2 HN1 H -8.478 3.230 -5.409 1.00 . A A . 31 NH2 HN1 1 1 16 7201 1 1 31 NH2 HN2 H -8.395 1.566 -4.829 1.00 . A A . 31 NH2 HN2 1 1 16 7202 1 1 31 NH2 N N -8.055 2.519 -4.836 1.00 . A A . 31 NH2 N 1 1 16 7203 2 2 1 NAG C1 C -7.234 13.795 2.142 1.00 . B A . 32 NAG C1 1 1 16 7204 2 2 1 NAG C2 C -7.025 12.294 2.105 1.00 . B A . 32 NAG C2 1 1 16 7205 2 2 1 NAG C3 C -5.538 12.029 2.371 1.00 . B A . 32 NAG C3 1 1 16 7206 2 2 1 NAG C4 C -4.542 12.913 1.585 1.00 . B A . 32 NAG C4 1 1 16 7207 2 2 1 NAG C5 C -5.064 14.347 1.396 1.00 . B A . 32 NAG C5 1 1 16 7208 2 2 1 NAG C6 C -4.344 15.056 0.230 1.00 . B A . 32 NAG C6 1 1 16 7209 2 2 1 NAG C7 C -7.775 10.679 3.946 1.00 . B A . 32 NAG C7 1 1 16 7210 2 2 1 NAG C8 C -8.968 10.347 4.786 1.00 . B A . 32 NAG C8 1 1 16 7211 2 2 1 NAG H1 H -7.018 14.217 3.126 1.00 . B A . 32 NAG H1 1 1 16 7212 2 2 1 NAG H2 H -7.239 11.974 1.085 1.00 . B A . 32 NAG H2 1 1 16 7213 2 2 1 NAG H3 H -5.366 12.201 3.434 1.00 . B A . 32 NAG H3 1 1 16 7214 2 2 1 NAG H4 H -4.399 12.466 0.603 1.00 . B A . 32 NAG H4 1 1 16 7215 2 2 1 NAG H5 H -4.874 14.909 2.313 1.00 . B A . 32 NAG H5 1 1 16 7216 2 2 1 NAG H61 H -4.554 16.124 0.285 1.00 . B A . 32 NAG H61 1 1 16 7217 2 2 1 NAG H62 H -4.741 14.677 -0.713 1.00 . B A . 32 NAG H62 1 1 16 7218 2 2 1 NAG H81 H -9.240 11.222 5.372 1.00 . B A . 32 NAG H81 1 1 16 7219 2 2 1 NAG H82 H -9.791 10.042 4.144 1.00 . B A . 32 NAG H82 1 1 16 7220 2 2 1 NAG H83 H -8.696 9.532 5.453 1.00 . B A . 32 NAG H83 1 1 16 7221 2 2 1 NAG HN2 H -8.893 12.048 3.071 1.00 . B A . 32 NAG HN2 1 1 16 7222 2 2 1 NAG HO1 H -8.456 14.782 1.144 1.00 . B A . 32 NAG HO1 1 1 16 7223 2 2 1 NAG HO3 H -5.379 10.241 2.918 1.00 . B A . 32 NAG HO3 1 1 16 7224 2 2 1 NAG HO4 H 3.868 5.856 7.153 1.00 . B A . 32 NAG HO4 1 1 16 7225 2 2 1 NAG HO6 H -2.574 14.976 1.099 1.00 . B A . 32 NAG HO6 1 1 16 7226 2 2 1 NAG N2 N -7.965 11.648 3.055 1.00 . B A . 32 NAG N2 1 1 16 7227 2 2 1 NAG O1 O -8.529 14.069 1.783 1.00 . B A . 32 NAG O1 1 1 16 7228 2 2 1 NAG O3 O -5.336 10.666 2.040 1.00 . B A . 32 NAG O3 1 1 16 7229 2 2 1 NAG O4 O -3.251 13.019 2.252 1.00 . B A . 32 NAG O4 1 1 16 7230 2 2 1 NAG O5 O -6.455 14.386 1.128 1.00 . B A . 32 NAG O5 1 1 16 7231 2 2 1 NAG O6 O -2.941 14.873 0.202 1.00 . B A . 32 NAG O6 1 1 16 7232 2 2 1 NAG O7 O -6.729 10.054 4.100 1.00 . B A . 32 NAG O7 1 1 17 7233 1 1 1 VAL C C 5.992 5.956 6.680 1.00 . A A . 1 VAL C 1 1 17 7234 1 1 1 VAL CA C 7.004 7.034 7.037 1.00 . A A . 1 VAL CA 1 1 17 7235 1 1 1 VAL CB C 7.366 6.960 8.524 1.00 . A A . 1 VAL CB 1 1 17 7236 1 1 1 VAL CG1 C 8.592 7.830 8.802 1.00 . A A . 1 VAL CG1 1 1 17 7237 1 1 1 VAL CG2 C 6.228 7.401 9.450 1.00 . A A . 1 VAL CG2 1 1 17 7238 1 1 1 VAL H1 H 6.548 8.419 5.620 1.00 . A A . 1 VAL H1 1 1 17 7239 1 1 1 VAL H2 H 7.093 9.094 7.006 1.00 . A A . 1 VAL H2 1 1 17 7240 1 1 1 VAL H3 H 5.546 8.481 6.942 1.00 . A A . 1 VAL H3 1 1 17 7241 1 1 1 VAL HA H 7.911 6.835 6.464 1.00 . A A . 1 VAL HA 1 1 17 7242 1 1 1 VAL HB H 7.629 5.928 8.761 1.00 . A A . 1 VAL HB 1 1 17 7243 1 1 1 VAL HG11 H 8.923 7.665 9.828 1.00 . A A . 1 VAL HG11 1 1 17 7244 1 1 1 VAL HG12 H 9.405 7.552 8.129 1.00 . A A . 1 VAL HG12 1 1 17 7245 1 1 1 VAL HG13 H 8.368 8.889 8.681 1.00 . A A . 1 VAL HG13 1 1 17 7246 1 1 1 VAL HG21 H 5.965 8.447 9.291 1.00 . A A . 1 VAL HG21 1 1 17 7247 1 1 1 VAL HG22 H 5.345 6.778 9.302 1.00 . A A . 1 VAL HG22 1 1 17 7248 1 1 1 VAL HG23 H 6.550 7.285 10.486 1.00 . A A . 1 VAL HG23 1 1 17 7249 1 1 1 VAL N N 6.503 8.365 6.638 1.00 . A A . 1 VAL N 1 1 17 7250 1 1 1 VAL O O 4.792 6.179 6.841 1.00 . A A . 1 VAL O 1 1 17 7251 1 1 2 GLY C C 5.732 3.337 4.281 1.00 . A A . 2 GLY C 1 1 17 7252 1 1 2 GLY CA C 5.697 3.636 5.789 1.00 . A A . 2 GLY CA 1 1 17 7253 1 1 2 GLY H H 7.457 4.887 5.893 1.00 . A A . 2 GLY H 1 1 17 7254 1 1 2 GLY HA2 H 6.086 2.764 6.313 1.00 . A A . 2 GLY HA2 1 1 17 7255 1 1 2 GLY HA3 H 4.656 3.767 6.085 1.00 . A A . 2 GLY HA3 1 1 17 7256 1 1 2 GLY N N 6.481 4.817 6.187 1.00 . A A . 2 GLY N 1 1 17 7257 1 1 2 GLY O O 4.903 2.579 3.780 1.00 . A A . 2 GLY O 1 1 17 7258 1 1 3 GLU C C 7.055 2.740 1.465 1.00 . A A . 3 GLU C 1 1 17 7259 1 1 3 GLU CA C 6.717 4.095 2.101 1.00 . A A . 3 GLU CA 1 1 17 7260 1 1 3 GLU CB C 7.783 5.147 1.748 1.00 . A A . 3 GLU CB 1 1 17 7261 1 1 3 GLU CD C 7.706 6.800 3.773 1.00 . A A . 3 GLU CD 1 1 17 7262 1 1 3 GLU CG C 7.495 6.570 2.263 1.00 . A A . 3 GLU CG 1 1 17 7263 1 1 3 GLU H H 7.343 4.530 4.038 1.00 . A A . 3 GLU H 1 1 17 7264 1 1 3 GLU HA H 5.760 4.441 1.719 1.00 . A A . 3 GLU HA 1 1 17 7265 1 1 3 GLU HB2 H 8.654 4.847 2.137 1.00 . A A . 3 GLU HB2 1 1 17 7266 1 1 3 GLU HB3 H 7.859 5.188 0.752 1.00 . A A . 3 GLU HB3 1 1 17 7267 1 1 3 GLU HG2 H 8.096 7.200 1.771 1.00 . A A . 3 GLU HG2 1 1 17 7268 1 1 3 GLU HG3 H 6.541 6.784 2.052 1.00 . A A . 3 GLU HG3 1 1 17 7269 1 1 3 GLU N N 6.639 3.986 3.550 1.00 . A A . 3 GLU N 1 1 17 7270 1 1 3 GLU O O 8.164 2.226 1.631 1.00 . A A . 3 GLU O 1 1 17 7271 1 1 3 GLU OE1 O 8.180 5.885 4.493 1.00 . A A . 3 GLU OE1 1 1 17 7272 1 1 3 GLU OE2 O 7.312 7.882 4.259 1.00 . A A . 3 GLU OE2 1 1 17 7273 1 1 4 CYS C C 7.393 0.403 -0.496 1.00 . A A . 4 CYS C 1 1 17 7274 1 1 4 CYS CA C 6.162 0.753 0.328 1.00 . A A . 4 CYS CA 1 1 17 7275 1 1 4 CYS CB C 4.879 0.388 -0.424 1.00 . A A . 4 CYS CB 1 1 17 7276 1 1 4 CYS H H 5.273 2.676 0.505 1.00 . A A . 4 CYS H 1 1 17 7277 1 1 4 CYS HA H 6.217 0.149 1.231 1.00 . A A . 4 CYS HA 1 1 17 7278 1 1 4 CYS HB2 H 4.885 -0.602 -0.564 1.00 . A A . 4 CYS HB2 1 1 17 7279 1 1 4 CYS HB3 H 4.108 0.637 0.161 1.00 . A A . 4 CYS HB3 1 1 17 7280 1 1 4 CYS N N 6.101 2.145 0.746 1.00 . A A . 4 CYS N 1 1 17 7281 1 1 4 CYS O O 8.161 1.262 -0.938 1.00 . A A . 4 CYS O 1 1 17 7282 1 1 4 CYS SG S 4.608 1.161 -2.034 1.00 . A A . 4 CYS SG 1 1 17 7283 1 1 5 VAL C C 8.683 -1.246 -2.939 1.00 . A A . 5 VAL C 1 1 17 7284 1 1 5 VAL CA C 8.763 -1.432 -1.424 1.00 . A A . 5 VAL CA 1 1 17 7285 1 1 5 VAL CB C 8.975 -2.897 -0.999 1.00 . A A . 5 VAL CB 1 1 17 7286 1 1 5 VAL CG1 C 10.380 -3.394 -1.358 1.00 . A A . 5 VAL CG1 1 1 17 7287 1 1 5 VAL CG2 C 8.834 -3.060 0.521 1.00 . A A . 5 VAL CG2 1 1 17 7288 1 1 5 VAL H H 6.821 -1.540 -0.546 1.00 . A A . 5 VAL H 1 1 17 7289 1 1 5 VAL HA H 9.620 -0.853 -1.084 1.00 . A A . 5 VAL HA 1 1 17 7290 1 1 5 VAL HB H 8.216 -3.516 -1.473 1.00 . A A . 5 VAL HB 1 1 17 7291 1 1 5 VAL HG11 H 10.496 -4.427 -1.029 1.00 . A A . 5 VAL HG11 1 1 17 7292 1 1 5 VAL HG12 H 10.555 -3.365 -2.430 1.00 . A A . 5 VAL HG12 1 1 17 7293 1 1 5 VAL HG13 H 11.130 -2.781 -0.858 1.00 . A A . 5 VAL HG13 1 1 17 7294 1 1 5 VAL HG21 H 9.517 -2.382 1.033 1.00 . A A . 5 VAL HG21 1 1 17 7295 1 1 5 VAL HG22 H 7.815 -2.853 0.843 1.00 . A A . 5 VAL HG22 1 1 17 7296 1 1 5 VAL HG23 H 9.072 -4.085 0.804 1.00 . A A . 5 VAL HG23 1 1 17 7297 1 1 5 VAL N N 7.567 -0.887 -0.780 1.00 . A A . 5 VAL N 1 1 17 7298 1 1 5 VAL O O 8.886 -2.171 -3.723 1.00 . A A . 5 VAL O 1 1 17 7299 1 1 6 ARG C C 7.175 -0.285 -5.480 1.00 . A A . 6 ARG C 1 1 17 7300 1 1 6 ARG CA C 8.240 0.490 -4.704 1.00 . A A . 6 ARG CA 1 1 17 7301 1 1 6 ARG CB C 9.637 0.560 -5.338 1.00 . A A . 6 ARG CB 1 1 17 7302 1 1 6 ARG CD C 11.224 1.137 -3.325 1.00 . A A . 6 ARG CD 1 1 17 7303 1 1 6 ARG CG C 10.543 1.593 -4.633 1.00 . A A . 6 ARG CG 1 1 17 7304 1 1 6 ARG CZ C 11.158 2.022 -0.953 1.00 . A A . 6 ARG CZ 1 1 17 7305 1 1 6 ARG H H 8.126 0.624 -2.596 1.00 . A A . 6 ARG H 1 1 17 7306 1 1 6 ARG HA H 7.863 1.513 -4.660 1.00 . A A . 6 ARG HA 1 1 17 7307 1 1 6 ARG HB2 H 10.066 -0.341 -5.274 1.00 . A A . 6 ARG HB2 1 1 17 7308 1 1 6 ARG HB3 H 9.542 0.817 -6.300 1.00 . A A . 6 ARG HB3 1 1 17 7309 1 1 6 ARG HD2 H 11.205 0.138 -3.294 1.00 . A A . 6 ARG HD2 1 1 17 7310 1 1 6 ARG HD3 H 12.173 1.453 -3.339 1.00 . A A . 6 ARG HD3 1 1 17 7311 1 1 6 ARG HE H 9.573 1.663 -2.018 1.00 . A A . 6 ARG HE 1 1 17 7312 1 1 6 ARG HG2 H 11.264 1.853 -5.276 1.00 . A A . 6 ARG HG2 1 1 17 7313 1 1 6 ARG HG3 H 9.982 2.393 -4.420 1.00 . A A . 6 ARG HG3 1 1 17 7314 1 1 6 ARG HH11 H 13.051 1.946 -1.623 1.00 . A A . 6 ARG HH11 1 1 17 7315 1 1 6 ARG HH12 H 12.864 2.419 0.032 1.00 . A A . 6 ARG HH12 1 1 17 7316 1 1 6 ARG HH21 H 9.433 2.188 0.064 1.00 . A A . 6 ARG HH21 1 1 17 7317 1 1 6 ARG HH22 H 10.867 2.552 0.963 1.00 . A A . 6 ARG HH22 1 1 17 7318 1 1 6 ARG N N 8.341 -0.017 -3.341 1.00 . A A . 6 ARG N 1 1 17 7319 1 1 6 ARG NE N 10.582 1.652 -2.092 1.00 . A A . 6 ARG NE 1 1 17 7320 1 1 6 ARG NH1 N 12.461 2.138 -0.839 1.00 . A A . 6 ARG NH1 1 1 17 7321 1 1 6 ARG NH2 N 10.428 2.274 0.109 1.00 . A A . 6 ARG NH2 1 1 17 7322 1 1 6 ARG O O 7.390 -0.780 -6.590 1.00 . A A . 6 ARG O 1 1 17 7323 1 1 7 GLY C C 4.421 -2.350 -4.663 1.00 . A A . 7 GLY C 1 1 17 7324 1 1 7 GLY CA C 4.801 -1.031 -5.341 1.00 . A A . 7 GLY CA 1 1 17 7325 1 1 7 GLY H H 6.002 0.001 -3.902 1.00 . A A . 7 GLY H 1 1 17 7326 1 1 7 GLY HA2 H 3.975 -0.334 -5.199 1.00 . A A . 7 GLY HA2 1 1 17 7327 1 1 7 GLY HA3 H 4.900 -1.214 -6.410 1.00 . A A . 7 GLY HA3 1 1 17 7328 1 1 7 GLY N N 6.025 -0.424 -4.819 1.00 . A A . 7 GLY N 1 1 17 7329 1 1 7 GLY O O 3.420 -2.952 -5.036 1.00 . A A . 7 GLY O 1 1 17 7330 1 1 8 ARG C C 5.216 -3.895 -1.503 1.00 . A A . 8 ARG C 1 1 17 7331 1 1 8 ARG CA C 5.027 -4.101 -3.006 1.00 . A A . 8 ARG CA 1 1 17 7332 1 1 8 ARG CB C 6.081 -5.063 -3.562 1.00 . A A . 8 ARG CB 1 1 17 7333 1 1 8 ARG CD C 6.928 -6.041 -5.774 1.00 . A A . 8 ARG CD 1 1 17 7334 1 1 8 ARG CG C 5.713 -5.548 -4.975 1.00 . A A . 8 ARG CG 1 1 17 7335 1 1 8 ARG CZ C 7.915 -3.818 -6.416 1.00 . A A . 8 ARG CZ 1 1 17 7336 1 1 8 ARG H H 6.006 -2.293 -3.374 1.00 . A A . 8 ARG H 1 1 17 7337 1 1 8 ARG HA H 4.024 -4.495 -3.179 1.00 . A A . 8 ARG HA 1 1 17 7338 1 1 8 ARG HB2 H 6.963 -4.592 -3.600 1.00 . A A . 8 ARG HB2 1 1 17 7339 1 1 8 ARG HB3 H 6.151 -5.855 -2.955 1.00 . A A . 8 ARG HB3 1 1 17 7340 1 1 8 ARG HD2 H 7.301 -6.852 -5.323 1.00 . A A . 8 ARG HD2 1 1 17 7341 1 1 8 ARG HD3 H 6.628 -6.281 -6.697 1.00 . A A . 8 ARG HD3 1 1 17 7342 1 1 8 ARG HE H 8.877 -5.243 -5.446 1.00 . A A . 8 ARG HE 1 1 17 7343 1 1 8 ARG HG2 H 5.059 -6.300 -4.894 1.00 . A A . 8 ARG HG2 1 1 17 7344 1 1 8 ARG HG3 H 5.291 -4.790 -5.472 1.00 . A A . 8 ARG HG3 1 1 17 7345 1 1 8 ARG HH11 H 6.108 -4.006 -7.270 1.00 . A A . 8 ARG HH11 1 1 17 7346 1 1 8 ARG HH12 H 6.890 -2.478 -7.505 1.00 . A A . 8 ARG HH12 1 1 17 7347 1 1 8 ARG HH21 H 9.661 -3.198 -5.661 1.00 . A A . 8 ARG HH21 1 1 17 7348 1 1 8 ARG HH22 H 8.811 -2.042 -6.632 1.00 . A A . 8 ARG HH22 1 1 17 7349 1 1 8 ARG N N 5.209 -2.823 -3.689 1.00 . A A . 8 ARG N 1 1 17 7350 1 1 8 ARG NE N 7.992 -5.024 -5.872 1.00 . A A . 8 ARG NE 1 1 17 7351 1 1 8 ARG NH1 N 6.890 -3.401 -7.119 1.00 . A A . 8 ARG NH1 1 1 17 7352 1 1 8 ARG NH2 N 8.870 -2.952 -6.221 1.00 . A A . 8 ARG NH2 1 1 17 7353 1 1 8 ARG O O 5.721 -2.851 -1.094 1.00 . A A . 8 ARG O 1 1 17 7354 1 1 9 CYS C C 5.300 -6.164 1.342 1.00 . A A . 9 CYS C 1 1 17 7355 1 1 9 CYS CA C 4.926 -4.799 0.760 1.00 . A A . 9 CYS CA 1 1 17 7356 1 1 9 CYS CB C 3.537 -4.395 1.250 1.00 . A A . 9 CYS CB 1 1 17 7357 1 1 9 CYS H H 4.434 -5.727 -1.036 1.00 . A A . 9 CYS H 1 1 17 7358 1 1 9 CYS HA H 5.664 -4.060 1.067 1.00 . A A . 9 CYS HA 1 1 17 7359 1 1 9 CYS HB2 H 2.863 -4.990 0.813 1.00 . A A . 9 CYS HB2 1 1 17 7360 1 1 9 CYS HB3 H 3.502 -4.523 2.241 1.00 . A A . 9 CYS HB3 1 1 17 7361 1 1 9 CYS N N 4.846 -4.878 -0.686 1.00 . A A . 9 CYS N 1 1 17 7362 1 1 9 CYS O O 5.105 -7.177 0.672 1.00 . A A . 9 CYS O 1 1 17 7363 1 1 9 CYS SG S 3.108 -2.678 0.881 1.00 . A A . 9 CYS SG 1 1 17 7364 1 1 10 PRO C C 4.547 -7.899 3.852 1.00 . A A . 10 PRO C 1 1 17 7365 1 1 10 PRO CA C 5.913 -7.453 3.330 1.00 . A A . 10 PRO CA 1 1 17 7366 1 1 10 PRO CB C 6.864 -7.138 4.482 1.00 . A A . 10 PRO CB 1 1 17 7367 1 1 10 PRO CD C 6.239 -5.081 3.385 1.00 . A A . 10 PRO CD 1 1 17 7368 1 1 10 PRO CG C 6.587 -5.657 4.760 1.00 . A A . 10 PRO CG 1 1 17 7369 1 1 10 PRO HA H 6.334 -8.236 2.698 1.00 . A A . 10 PRO HA 1 1 17 7370 1 1 10 PRO HB2 H 6.656 -7.699 5.283 1.00 . A A . 10 PRO HB2 1 1 17 7371 1 1 10 PRO HB3 H 7.816 -7.281 4.212 1.00 . A A . 10 PRO HB3 1 1 17 7372 1 1 10 PRO HD2 H 5.511 -4.400 3.466 1.00 . A A . 10 PRO HD2 1 1 17 7373 1 1 10 PRO HD3 H 7.045 -4.660 2.969 1.00 . A A . 10 PRO HD3 1 1 17 7374 1 1 10 PRO HG2 H 5.821 -5.552 5.394 1.00 . A A . 10 PRO HG2 1 1 17 7375 1 1 10 PRO HG3 H 7.397 -5.209 5.138 1.00 . A A . 10 PRO HG3 1 1 17 7376 1 1 10 PRO N N 5.790 -6.210 2.589 1.00 . A A . 10 PRO N 1 1 17 7377 1 1 10 PRO O O 3.620 -7.097 3.982 1.00 . A A . 10 PRO O 1 1 17 7378 1 1 11 SER C C 2.066 -9.621 3.597 1.00 . A A . 11 SER C 1 1 17 7379 1 1 11 SER CA C 3.196 -9.822 4.612 1.00 . A A . 11 SER CA 1 1 17 7380 1 1 11 SER CB C 2.817 -9.325 6.005 1.00 . A A . 11 SER CB 1 1 17 7381 1 1 11 SER H H 5.290 -9.734 4.200 1.00 . A A . 11 SER H 1 1 17 7382 1 1 11 SER HA H 3.347 -10.897 4.688 1.00 . A A . 11 SER HA 1 1 17 7383 1 1 11 SER HB2 H 3.607 -9.406 6.613 1.00 . A A . 11 SER HB2 1 1 17 7384 1 1 11 SER HB3 H 2.535 -8.367 5.950 1.00 . A A . 11 SER HB3 1 1 17 7385 1 1 11 SER HG H 1.643 -9.897 7.453 1.00 . A A . 11 SER HG 1 1 17 7386 1 1 11 SER N N 4.449 -9.182 4.212 1.00 . A A . 11 SER N 1 1 17 7387 1 1 11 SER O O 2.252 -9.123 2.490 1.00 . A A . 11 SER O 1 1 17 7388 1 1 11 SER OG O 1.749 -10.101 6.517 1.00 . A A . 11 SER OG 1 1 17 7389 1 1 12 GLY C C -0.806 -8.413 2.916 1.00 . A A . 12 GLY C 1 1 17 7390 1 1 12 GLY CA C -0.351 -9.862 3.156 1.00 . A A . 12 GLY CA 1 1 17 7391 1 1 12 GLY H H 0.812 -10.364 4.928 1.00 . A A . 12 GLY H 1 1 17 7392 1 1 12 GLY HA2 H -0.169 -10.320 2.184 1.00 . A A . 12 GLY HA2 1 1 17 7393 1 1 12 GLY HA3 H -1.169 -10.399 3.634 1.00 . A A . 12 GLY HA3 1 1 17 7394 1 1 12 GLY N N 0.853 -10.001 3.979 1.00 . A A . 12 GLY N 1 1 17 7395 1 1 12 GLY O O -1.997 -8.184 2.701 1.00 . A A . 12 GLY O 1 1 17 7396 1 1 13 MET C C -0.246 -5.519 1.445 1.00 . A A . 13 MET C 1 1 17 7397 1 1 13 MET CA C -0.268 -6.008 2.894 1.00 . A A . 13 MET CA 1 1 17 7398 1 1 13 MET CB C 0.683 -5.168 3.751 1.00 . A A . 13 MET CB 1 1 17 7399 1 1 13 MET CE C 3.058 -4.639 5.951 1.00 . A A . 13 MET CE 1 1 17 7400 1 1 13 MET CG C 0.526 -5.510 5.232 1.00 . A A . 13 MET CG 1 1 17 7401 1 1 13 MET H H 1.072 -7.679 2.967 1.00 . A A . 13 MET H 1 1 17 7402 1 1 13 MET HA H -1.281 -5.864 3.271 1.00 . A A . 13 MET HA 1 1 17 7403 1 1 13 MET HB2 H 1.625 -5.352 3.471 1.00 . A A . 13 MET HB2 1 1 17 7404 1 1 13 MET HB3 H 0.477 -4.199 3.615 1.00 . A A . 13 MET HB3 1 1 17 7405 1 1 13 MET HE1 H 3.693 -4.008 6.573 1.00 . A A . 13 MET HE1 1 1 17 7406 1 1 13 MET HE2 H 3.294 -5.687 6.142 1.00 . A A . 13 MET HE2 1 1 17 7407 1 1 13 MET HE3 H 3.245 -4.415 4.901 1.00 . A A . 13 MET HE3 1 1 17 7408 1 1 13 MET HG2 H -0.450 -5.538 5.446 1.00 . A A . 13 MET HG2 1 1 17 7409 1 1 13 MET HG3 H 0.929 -6.411 5.391 1.00 . A A . 13 MET HG3 1 1 17 7410 1 1 13 MET N N 0.089 -7.423 2.998 1.00 . A A . 13 MET N 1 1 17 7411 1 1 13 MET O O 0.226 -6.204 0.543 1.00 . A A . 13 MET O 1 1 17 7412 1 1 13 MET SD S 1.319 -4.328 6.351 1.00 . A A . 13 MET SD 1 1 17 7413 1 1 14 CYS C C -0.246 -2.282 -0.026 1.00 . A A . 14 CYS C 1 1 17 7414 1 1 14 CYS CA C -0.852 -3.691 -0.086 1.00 . A A . 14 CYS CA 1 1 17 7415 1 1 14 CYS CB C -2.337 -3.639 -0.474 1.00 . A A . 14 CYS CB 1 1 17 7416 1 1 14 CYS H H -1.086 -3.757 2.015 1.00 . A A . 14 CYS H 1 1 17 7417 1 1 14 CYS HA H -0.307 -4.284 -0.821 1.00 . A A . 14 CYS HA 1 1 17 7418 1 1 14 CYS HB2 H -2.744 -2.844 -0.024 1.00 . A A . 14 CYS HB2 1 1 17 7419 1 1 14 CYS HB3 H -2.391 -3.525 -1.466 1.00 . A A . 14 CYS HB3 1 1 17 7420 1 1 14 CYS N N -0.750 -4.306 1.228 1.00 . A A . 14 CYS N 1 1 17 7421 1 1 14 CYS O O -0.129 -1.710 1.062 1.00 . A A . 14 CYS O 1 1 17 7422 1 1 14 CYS SG S -3.326 -5.103 -0.025 1.00 . A A . 14 CYS SG 1 1 17 7423 1 1 15 CYS C C -0.444 0.666 -1.648 1.00 . A A . 15 CYS C 1 1 17 7424 1 1 15 CYS CA C 0.633 -0.339 -1.223 1.00 . A A . 15 CYS CA 1 1 17 7425 1 1 15 CYS CB C 1.865 -0.247 -2.128 1.00 . A A . 15 CYS CB 1 1 17 7426 1 1 15 CYS H H -0.047 -2.185 -2.050 1.00 . A A . 15 CYS H 1 1 17 7427 1 1 15 CYS HA H 0.970 -0.072 -0.226 1.00 . A A . 15 CYS HA 1 1 17 7428 1 1 15 CYS HB2 H 2.546 -0.912 -1.822 1.00 . A A . 15 CYS HB2 1 1 17 7429 1 1 15 CYS HB3 H 1.596 -0.453 -3.069 1.00 . A A . 15 CYS HB3 1 1 17 7430 1 1 15 CYS N N 0.106 -1.700 -1.178 1.00 . A A . 15 CYS N 1 1 17 7431 1 1 15 CYS O O -1.053 0.521 -2.711 1.00 . A A . 15 CYS O 1 1 17 7432 1 1 15 CYS SG S 2.591 1.417 -2.068 1.00 . A A . 15 CYS SG 1 1 17 7433 1 1 16 SER C C -1.023 3.619 -2.317 1.00 . A A . 16 SER C 1 1 17 7434 1 1 16 SER CA C -1.541 2.810 -1.143 1.00 . A A . 16 SER CA 1 1 17 7435 1 1 16 SER CB C -1.677 3.752 0.059 1.00 . A A . 16 SER CB 1 1 17 7436 1 1 16 SER H H -0.055 1.788 -0.020 1.00 . A A . 16 SER H 1 1 17 7437 1 1 16 SER HA H -2.522 2.411 -1.398 1.00 . A A . 16 SER HA 1 1 17 7438 1 1 16 SER HB2 H -2.479 4.334 -0.076 1.00 . A A . 16 SER HB2 1 1 17 7439 1 1 16 SER HB3 H -1.798 3.204 0.886 1.00 . A A . 16 SER HB3 1 1 17 7440 1 1 16 SER HG H -0.716 5.109 1.017 1.00 . A A . 16 SER HG 1 1 17 7441 1 1 16 SER N N -0.654 1.700 -0.831 1.00 . A A . 16 SER N 1 1 17 7442 1 1 16 SER O O 0.172 3.671 -2.599 1.00 . A A . 16 SER O 1 1 17 7443 1 1 16 SER OG O -0.536 4.577 0.220 1.00 . A A . 16 SER OG 1 1 17 7444 1 1 17 GLN C C -1.053 6.598 -3.540 1.00 . A A . 17 GLN C 1 1 17 7445 1 1 17 GLN CA C -1.540 5.234 -4.056 1.00 . A A . 17 GLN CA 1 1 17 7446 1 1 17 GLN CB C -2.691 5.268 -5.068 1.00 . A A . 17 GLN CB 1 1 17 7447 1 1 17 GLN CD C -2.749 2.696 -5.060 1.00 . A A . 17 GLN CD 1 1 17 7448 1 1 17 GLN CG C -2.720 3.971 -5.908 1.00 . A A . 17 GLN CG 1 1 17 7449 1 1 17 GLN H H -2.896 4.298 -2.712 1.00 . A A . 17 GLN H 1 1 17 7450 1 1 17 GLN HA H -0.681 4.802 -4.570 1.00 . A A . 17 GLN HA 1 1 17 7451 1 1 17 GLN HB2 H -3.557 5.360 -4.577 1.00 . A A . 17 GLN HB2 1 1 17 7452 1 1 17 GLN HB3 H -2.568 6.051 -5.678 1.00 . A A . 17 GLN HB3 1 1 17 7453 1 1 17 GLN HE21 H -0.797 2.247 -5.417 1.00 . A A . 17 GLN HE21 1 1 17 7454 1 1 17 GLN HE22 H -1.634 1.246 -4.242 1.00 . A A . 17 GLN HE22 1 1 17 7455 1 1 17 GLN HG2 H -3.536 3.986 -6.485 1.00 . A A . 17 GLN HG2 1 1 17 7456 1 1 17 GLN HG3 H -1.903 3.949 -6.485 1.00 . A A . 17 GLN HG3 1 1 17 7457 1 1 17 GLN N N -1.919 4.368 -2.952 1.00 . A A . 17 GLN N 1 1 17 7458 1 1 17 GLN NE2 N -1.647 1.979 -4.954 1.00 . A A . 17 GLN NE2 1 1 17 7459 1 1 17 GLN O O -0.694 7.463 -4.329 1.00 . A A . 17 GLN O 1 1 17 7460 1 1 17 GLN OE1 O -3.749 2.379 -4.425 1.00 . A A . 17 GLN OE1 1 1 17 7461 1 1 18 . C C 1.373 7.167 -1.386 1.00 . A A . 18 PFF C 1 1 17 7462 1 1 18 . CA C -0.044 7.734 -1.600 1.00 . A A . 18 PFF CA 1 1 17 7463 1 1 18 . CB C -0.644 8.213 -0.270 1.00 . A A . 18 PFF CB 1 1 17 7464 1 1 18 . CD1 C -3.143 7.992 0.084 1.00 . A A . 18 PFF CD1 1 1 17 7465 1 1 18 . CD2 C -2.283 9.987 -1.017 1.00 . A A . 18 PFF CD2 1 1 17 7466 1 1 18 . CE1 C -4.457 8.461 -0.091 1.00 . A A . 18 PFF CE1 1 1 17 7467 1 1 18 . CE2 C -3.598 10.449 -1.204 1.00 . A A . 18 PFF CE2 1 1 17 7468 1 1 18 . CG C -2.053 8.754 -0.379 1.00 . A A . 18 PFF CG 1 1 17 7469 1 1 18 . CZ C -4.685 9.685 -0.743 1.00 . A A . 18 PFF CZ 1 1 17 7470 1 1 18 . F F -5.956 10.131 -0.924 1.00 . A A . 18 PFF F 1 1 17 7471 1 1 18 . H H -1.275 6.019 -1.607 1.00 . A A . 18 PFF H 1 1 17 7472 1 1 18 . HA H 0.046 8.598 -2.260 1.00 . A A . 18 PFF HA 1 1 17 7473 1 1 18 . HB2 H -0.644 7.385 0.437 1.00 . A A . 18 PFF HB2 1 1 17 7474 1 1 18 . HB3 H -0.007 9.001 0.133 1.00 . A A . 18 PFF HB3 1 1 17 7475 1 1 18 . HD1 H -2.971 7.044 0.575 1.00 . A A . 18 PFF HD1 1 1 17 7476 1 1 18 . HD2 H -1.450 10.564 -1.390 1.00 . A A . 18 PFF HD2 1 1 17 7477 1 1 18 . HE1 H -5.292 7.879 0.269 1.00 . A A . 18 PFF HE1 1 1 17 7478 1 1 18 . HE2 H -3.774 11.387 -1.709 1.00 . A A . 18 PFF HE2 1 1 17 7479 1 1 18 . N N -0.935 6.750 -2.212 1.00 . A A . 18 PFF N 1 1 17 7480 1 1 18 . O O 2.273 7.914 -1.018 1.00 . A A . 18 PFF O 1 1 17 7481 1 1 19 GLY C C 3.265 4.414 -0.409 1.00 . A A . 19 GLY C 1 1 17 7482 1 1 19 GLY CA C 2.920 5.256 -1.637 1.00 . A A . 19 GLY CA 1 1 17 7483 1 1 19 GLY H H 0.826 5.269 -1.922 1.00 . A A . 19 GLY H 1 1 17 7484 1 1 19 GLY HA2 H 2.997 4.610 -2.512 1.00 . A A . 19 GLY HA2 1 1 17 7485 1 1 19 GLY HA3 H 3.679 6.031 -1.729 1.00 . A A . 19 GLY HA3 1 1 17 7486 1 1 19 GLY N N 1.592 5.865 -1.626 1.00 . A A . 19 GLY N 1 1 17 7487 1 1 19 GLY O O 4.432 4.071 -0.239 1.00 . A A . 19 GLY O 1 1 17 7488 1 1 20 . C C 2.106 2.046 1.902 1.00 . A A . 20 PFF C 1 1 17 7489 1 1 20 . CA C 2.636 3.477 1.767 1.00 . A A . 20 PFF CA 1 1 17 7490 1 1 20 . CB C 2.022 4.362 2.845 1.00 . A A . 20 PFF CB 1 1 17 7491 1 1 20 . CD1 C 1.951 6.775 2.099 1.00 . A A . 20 PFF CD1 1 1 17 7492 1 1 20 . CD2 C 3.666 6.099 3.676 1.00 . A A . 20 PFF CD2 1 1 17 7493 1 1 20 . CE1 C 2.332 8.118 2.250 1.00 . A A . 20 PFF CE1 1 1 17 7494 1 1 20 . CE2 C 4.069 7.437 3.805 1.00 . A A . 20 PFF CE2 1 1 17 7495 1 1 20 . CG C 2.569 5.773 2.865 1.00 . A A . 20 PFF CG 1 1 17 7496 1 1 20 . CZ C 3.374 8.450 3.128 1.00 . A A . 20 PFF CZ 1 1 17 7497 1 1 20 . F F 3.758 9.747 3.269 1.00 . A A . 20 PFF F 1 1 17 7498 1 1 20 . H H 1.347 4.330 0.297 1.00 . A A . 20 PFF H 1 1 17 7499 1 1 20 . HA H 3.712 3.457 1.917 1.00 . A A . 20 PFF HA 1 1 17 7500 1 1 20 . HB2 H 0.941 4.400 2.699 1.00 . A A . 20 PFF HB2 1 1 17 7501 1 1 20 . HB3 H 2.203 3.896 3.806 1.00 . A A . 20 PFF HB3 1 1 17 7502 1 1 20 . HD1 H 1.191 6.502 1.391 1.00 . A A . 20 PFF HD1 1 1 17 7503 1 1 20 . HD2 H 4.133 5.345 4.284 1.00 . A A . 20 PFF HD2 1 1 17 7504 1 1 20 . HE1 H 1.844 8.894 1.677 1.00 . A A . 20 PFF HE1 1 1 17 7505 1 1 20 . HE2 H 4.879 7.697 4.463 1.00 . A A . 20 PFF HE2 1 1 17 7506 1 1 20 . N N 2.317 4.086 0.474 1.00 . A A . 20 PFF N 1 1 17 7507 1 1 20 . O O 1.134 1.692 1.248 1.00 . A A . 20 PFF O 1 1 17 7508 1 1 21 CYS C C 1.082 -0.196 4.059 1.00 . A A . 21 CYS C 1 1 17 7509 1 1 21 CYS CA C 2.176 -0.141 2.993 1.00 . A A . 21 CYS CA 1 1 17 7510 1 1 21 CYS CB C 3.320 -1.067 3.424 1.00 . A A . 21 CYS CB 1 1 17 7511 1 1 21 CYS H H 3.478 1.558 3.310 1.00 . A A . 21 CYS H 1 1 17 7512 1 1 21 CYS HA H 1.757 -0.523 2.063 1.00 . A A . 21 CYS HA 1 1 17 7513 1 1 21 CYS HB2 H 3.888 -0.578 4.086 1.00 . A A . 21 CYS HB2 1 1 17 7514 1 1 21 CYS HB3 H 2.923 -1.876 3.858 1.00 . A A . 21 CYS HB3 1 1 17 7515 1 1 21 CYS N N 2.685 1.217 2.773 1.00 . A A . 21 CYS N 1 1 17 7516 1 1 21 CYS O O 1.227 0.396 5.125 1.00 . A A . 21 CYS O 1 1 17 7517 1 1 21 CYS SG S 4.374 -1.612 2.067 1.00 . A A . 21 CYS SG 1 1 17 7518 1 1 22 GLY C C -1.856 -2.458 4.445 1.00 . A A . 22 GLY C 1 1 17 7519 1 1 22 GLY CA C -0.858 -1.400 4.907 1.00 . A A . 22 GLY CA 1 1 17 7520 1 1 22 GLY H H -0.144 -1.362 2.891 1.00 . A A . 22 GLY H 1 1 17 7521 1 1 22 GLY HA2 H -0.267 -1.808 5.726 1.00 . A A . 22 GLY HA2 1 1 17 7522 1 1 22 GLY HA3 H -1.401 -0.529 5.272 1.00 . A A . 22 GLY HA3 1 1 17 7523 1 1 22 GLY N N 0.035 -0.995 3.829 1.00 . A A . 22 GLY N 1 1 17 7524 1 1 22 GLY O O -1.931 -2.777 3.260 1.00 . A A . 22 GLY O 1 1 17 7525 1 1 23 LYS C C -5.043 -3.416 4.765 1.00 . A A . 23 LYS C 1 1 17 7526 1 1 23 LYS CA C -3.665 -4.014 5.043 1.00 . A A . 23 LYS CA 1 1 17 7527 1 1 23 LYS CB C -3.713 -5.074 6.156 1.00 . A A . 23 LYS CB 1 1 17 7528 1 1 23 LYS CD C -4.313 -7.128 4.711 1.00 . A A . 23 LYS CD 1 1 17 7529 1 1 23 LYS CE C -4.926 -6.609 3.403 1.00 . A A . 23 LYS CE 1 1 17 7530 1 1 23 LYS CG C -4.664 -6.263 5.928 1.00 . A A . 23 LYS CG 1 1 17 7531 1 1 23 LYS H H -2.473 -2.776 6.346 1.00 . A A . 23 LYS H 1 1 17 7532 1 1 23 LYS HA H -3.366 -4.470 4.116 1.00 . A A . 23 LYS HA 1 1 17 7533 1 1 23 LYS HB2 H -2.789 -5.440 6.267 1.00 . A A . 23 LYS HB2 1 1 17 7534 1 1 23 LYS HB3 H -3.995 -4.617 7.000 1.00 . A A . 23 LYS HB3 1 1 17 7535 1 1 23 LYS HD2 H -3.318 -7.146 4.610 1.00 . A A . 23 LYS HD2 1 1 17 7536 1 1 23 LYS HD3 H -4.649 -8.056 4.873 1.00 . A A . 23 LYS HD3 1 1 17 7537 1 1 23 LYS HE2 H -5.920 -6.572 3.502 1.00 . A A . 23 LYS HE2 1 1 17 7538 1 1 23 LYS HE3 H -4.574 -5.691 3.221 1.00 . A A . 23 LYS HE3 1 1 17 7539 1 1 23 LYS HG2 H -4.640 -6.843 6.742 1.00 . A A . 23 LYS HG2 1 1 17 7540 1 1 23 LYS HG3 H -5.589 -5.904 5.801 1.00 . A A . 23 LYS HG3 1 1 17 7541 1 1 23 LYS HZ1 H -5.002 -8.403 2.379 1.00 . A A . 23 LYS HZ1 1 1 17 7542 1 1 23 LYS HZ2 H -4.898 -7.085 1.387 1.00 . A A . 23 LYS HZ2 1 1 17 7543 1 1 23 LYS HZ3 H -3.579 -7.621 2.216 1.00 . A A . 23 LYS HZ3 1 1 17 7544 1 1 23 LYS N N -2.639 -3.014 5.376 1.00 . A A . 23 LYS N 1 1 17 7545 1 1 23 LYS NZ N -4.588 -7.489 2.261 1.00 . A A . 23 LYS NZ 1 1 17 7546 1 1 23 LYS O O -5.916 -4.079 4.214 1.00 . A A . 23 LYS O 1 1 17 7547 1 1 24 GLY C C -6.969 -1.106 3.680 1.00 . A A . 24 GLY C 1 1 17 7548 1 1 24 GLY CA C -6.520 -1.488 5.092 1.00 . A A . 24 GLY CA 1 1 17 7549 1 1 24 GLY H H -4.394 -1.695 5.456 1.00 . A A . 24 GLY H 1 1 17 7550 1 1 24 GLY HA2 H -7.261 -2.157 5.530 1.00 . A A . 24 GLY HA2 1 1 17 7551 1 1 24 GLY HA3 H -6.472 -0.583 5.698 1.00 . A A . 24 GLY HA3 1 1 17 7552 1 1 24 GLY N N -5.220 -2.152 5.120 1.00 . A A . 24 GLY N 1 1 17 7553 1 1 24 GLY O O -6.149 -0.941 2.771 1.00 . A A . 24 GLY O 1 1 17 7554 1 1 25 PRO C C -8.231 0.631 1.537 1.00 . A A . 25 PRO C 1 1 17 7555 1 1 25 PRO CA C -8.858 -0.597 2.190 1.00 . A A . 25 PRO CA 1 1 17 7556 1 1 25 PRO CB C -10.364 -0.437 2.431 1.00 . A A . 25 PRO CB 1 1 17 7557 1 1 25 PRO CD C -9.296 -0.852 4.528 1.00 . A A . 25 PRO CD 1 1 17 7558 1 1 25 PRO CG C -10.465 -0.083 3.915 1.00 . A A . 25 PRO CG 1 1 17 7559 1 1 25 PRO HA H -8.694 -1.450 1.530 1.00 . A A . 25 PRO HA 1 1 17 7560 1 1 25 PRO HB2 H -10.739 0.297 1.864 1.00 . A A . 25 PRO HB2 1 1 17 7561 1 1 25 PRO HB3 H -10.848 -1.290 2.235 1.00 . A A . 25 PRO HB3 1 1 17 7562 1 1 25 PRO HD2 H -8.958 -0.385 5.345 1.00 . A A . 25 PRO HD2 1 1 17 7563 1 1 25 PRO HD3 H -9.574 -1.783 4.766 1.00 . A A . 25 PRO HD3 1 1 17 7564 1 1 25 PRO HG2 H -10.363 0.901 4.058 1.00 . A A . 25 PRO HG2 1 1 17 7565 1 1 25 PRO HG3 H -11.337 -0.387 4.299 1.00 . A A . 25 PRO HG3 1 1 17 7566 1 1 25 PRO N N -8.278 -0.872 3.495 1.00 . A A . 25 PRO N 1 1 17 7567 1 1 25 PRO O O -7.971 0.602 0.340 1.00 . A A . 25 PRO O 1 1 17 7568 1 1 26 LYS C C -5.857 2.506 1.145 1.00 . A A . 26 LYS C 1 1 17 7569 1 1 26 LYS CA C -7.179 2.854 1.828 1.00 . A A . 26 LYS CA 1 1 17 7570 1 1 26 LYS CB C -6.945 3.828 2.984 1.00 . A A . 26 LYS CB 1 1 17 7571 1 1 26 LYS CD C -8.175 5.649 4.274 1.00 . A A . 26 LYS CD 1 1 17 7572 1 1 26 LYS CE C -8.375 6.716 3.189 1.00 . A A . 26 LYS CE 1 1 17 7573 1 1 26 LYS CG C -8.260 4.244 3.660 1.00 . A A . 26 LYS CG 1 1 17 7574 1 1 26 LYS H H -8.099 1.629 3.302 1.00 . A A . 26 LYS H 1 1 17 7575 1 1 26 LYS HA H -7.790 3.361 1.088 1.00 . A A . 26 LYS HA 1 1 17 7576 1 1 26 LYS HB2 H -6.358 3.388 3.663 1.00 . A A . 26 LYS HB2 1 1 17 7577 1 1 26 LYS HB3 H -6.491 4.646 2.630 1.00 . A A . 26 LYS HB3 1 1 17 7578 1 1 26 LYS HD2 H -8.886 5.749 4.970 1.00 . A A . 26 LYS HD2 1 1 17 7579 1 1 26 LYS HD3 H -7.276 5.771 4.695 1.00 . A A . 26 LYS HD3 1 1 17 7580 1 1 26 LYS HE2 H -7.663 6.609 2.495 1.00 . A A . 26 LYS HE2 1 1 17 7581 1 1 26 LYS HE3 H -9.273 6.585 2.769 1.00 . A A . 26 LYS HE3 1 1 17 7582 1 1 26 LYS HG2 H -8.991 4.234 2.977 1.00 . A A . 26 LYS HG2 1 1 17 7583 1 1 26 LYS HG3 H -8.472 3.588 4.384 1.00 . A A . 26 LYS HG3 1 1 17 7584 1 1 26 LYS HZ1 H -8.550 8.781 3.041 1.00 . A A . 26 LYS HZ1 1 1 17 7585 1 1 26 LYS HZ2 H -8.919 8.203 4.533 1.00 . A A . 26 LYS HZ2 1 1 17 7586 1 1 26 LYS HZ3 H -7.348 8.305 4.032 1.00 . A A . 26 LYS HZ3 1 1 17 7587 1 1 26 LYS N N -7.886 1.668 2.318 1.00 . A A . 26 LYS N 1 1 17 7588 1 1 26 LYS NZ N -8.301 8.087 3.744 1.00 . A A . 26 LYS NZ 1 1 17 7589 1 1 26 LYS O O -5.476 3.164 0.173 1.00 . A A . 26 LYS O 1 1 17 7590 1 1 27 TYR C C -4.304 0.058 -0.168 1.00 . A A . 27 TYR C 1 1 17 7591 1 1 27 TYR CA C -3.967 0.950 1.013 1.00 . A A . 27 TYR CA 1 1 17 7592 1 1 27 TYR CB C -3.138 0.161 2.034 1.00 . A A . 27 TYR CB 1 1 17 7593 1 1 27 TYR CD1 C -1.551 1.683 3.254 1.00 . A A . 27 TYR CD1 1 1 17 7594 1 1 27 TYR CD2 C -3.577 0.982 4.398 1.00 . A A . 27 TYR CD2 1 1 17 7595 1 1 27 TYR CE1 C -1.149 2.401 4.392 1.00 . A A . 27 TYR CE1 1 1 17 7596 1 1 27 TYR CE2 C -3.200 1.748 5.520 1.00 . A A . 27 TYR CE2 1 1 17 7597 1 1 27 TYR CG C -2.747 0.954 3.261 1.00 . A A . 27 TYR CG 1 1 17 7598 1 1 27 TYR CZ C -1.989 2.457 5.512 1.00 . A A . 27 TYR CZ 1 1 17 7599 1 1 27 TYR H H -5.622 0.880 2.335 1.00 . A A . 27 TYR H 1 1 17 7600 1 1 27 TYR HA H -3.374 1.784 0.648 1.00 . A A . 27 TYR HA 1 1 17 7601 1 1 27 TYR HB2 H -3.674 -0.630 2.330 1.00 . A A . 27 TYR HB2 1 1 17 7602 1 1 27 TYR HB3 H -2.302 -0.152 1.584 1.00 . A A . 27 TYR HB3 1 1 17 7603 1 1 27 TYR HD1 H -0.934 1.671 2.374 1.00 . A A . 27 TYR HD1 1 1 17 7604 1 1 27 TYR HD2 H -4.512 0.447 4.392 1.00 . A A . 27 TYR HD2 1 1 17 7605 1 1 27 TYR HE1 H -0.205 2.927 4.401 1.00 . A A . 27 TYR HE1 1 1 17 7606 1 1 27 TYR HE2 H -3.838 1.820 6.388 1.00 . A A . 27 TYR HE2 1 1 17 7607 1 1 27 TYR HH H -0.802 3.667 6.425 1.00 . A A . 27 TYR HH 1 1 17 7608 1 1 27 TYR N N -5.189 1.453 1.620 1.00 . A A . 27 TYR N 1 1 17 7609 1 1 27 TYR O O -3.805 0.256 -1.272 1.00 . A A . 27 TYR O 1 1 17 7610 1 1 27 TYR OH O -1.703 3.321 6.521 1.00 . A A . 27 TYR OH 1 1 17 7611 1 1 28 CYS C C -6.282 -1.692 -2.004 1.00 . A A . 28 CYS C 1 1 17 7612 1 1 28 CYS CA C -5.323 -2.037 -0.861 1.00 . A A . 28 CYS CA 1 1 17 7613 1 1 28 CYS CB C -5.722 -3.261 -0.042 1.00 . A A . 28 CYS CB 1 1 17 7614 1 1 28 CYS H H -5.642 -0.993 0.948 1.00 . A A . 28 CYS H 1 1 17 7615 1 1 28 CYS HA H -4.358 -2.240 -1.322 1.00 . A A . 28 CYS HA 1 1 17 7616 1 1 28 CYS HB2 H -5.303 -3.195 0.864 1.00 . A A . 28 CYS HB2 1 1 17 7617 1 1 28 CYS HB3 H -6.718 -3.278 0.051 1.00 . A A . 28 CYS HB3 1 1 17 7618 1 1 28 CYS N N -5.164 -0.932 0.057 1.00 . A A . 28 CYS N 1 1 17 7619 1 1 28 CYS O O -7.363 -2.256 -2.144 1.00 . A A . 28 CYS O 1 1 17 7620 1 1 28 CYS SG S -5.181 -4.798 -0.826 1.00 . A A . 28 CYS SG 1 1 17 7621 1 1 29 GLY C C -7.871 0.422 -3.902 1.00 . A A . 29 GLY C 1 1 17 7622 1 1 29 GLY CA C -6.547 -0.328 -4.070 1.00 . A A . 29 GLY CA 1 1 17 7623 1 1 29 GLY H H -5.070 -0.202 -2.507 1.00 . A A . 29 GLY H 1 1 17 7624 1 1 29 GLY HA2 H -5.865 0.297 -4.645 1.00 . A A . 29 GLY HA2 1 1 17 7625 1 1 29 GLY HA3 H -6.743 -1.232 -4.648 1.00 . A A . 29 GLY HA3 1 1 17 7626 1 1 29 GLY N N -5.899 -0.702 -2.809 1.00 . A A . 29 GLY N 1 1 17 7627 1 1 29 GLY O O -8.222 1.236 -4.761 1.00 . A A . 29 GLY O 1 1 17 7628 1 1 30 ARG C C -11.032 0.311 -3.140 1.00 . A A . 30 ARG C 1 1 17 7629 1 1 30 ARG CA C -9.828 0.803 -2.342 1.00 . A A . 30 ARG CA 1 1 17 7630 1 1 30 ARG CB C -9.767 2.340 -2.374 1.00 . A A . 30 ARG CB 1 1 17 7631 1 1 30 ARG CD C -8.185 4.258 -1.810 1.00 . A A . 30 ARG CD 1 1 17 7632 1 1 30 ARG CG C -8.701 2.874 -1.413 1.00 . A A . 30 ARG CG 1 1 17 7633 1 1 30 ARG CZ C -6.458 3.531 -3.451 1.00 . A A . 30 ARG CZ 1 1 17 7634 1 1 30 ARG H H -8.229 -0.581 -2.219 1.00 . A A . 30 ARG H 1 1 17 7635 1 1 30 ARG HA H -9.962 0.488 -1.306 1.00 . A A . 30 ARG HA 1 1 17 7636 1 1 30 ARG HB2 H -9.547 2.638 -3.303 1.00 . A A . 30 ARG HB2 1 1 17 7637 1 1 30 ARG HB3 H -10.658 2.707 -2.108 1.00 . A A . 30 ARG HB3 1 1 17 7638 1 1 30 ARG HD2 H -8.949 4.903 -1.836 1.00 . A A . 30 ARG HD2 1 1 17 7639 1 1 30 ARG HD3 H -7.511 4.566 -1.139 1.00 . A A . 30 ARG HD3 1 1 17 7640 1 1 30 ARG HE H -8.110 4.489 -3.923 1.00 . A A . 30 ARG HE 1 1 17 7641 1 1 30 ARG HG2 H -9.097 2.932 -0.497 1.00 . A A . 30 ARG HG2 1 1 17 7642 1 1 30 ARG HG3 H -7.931 2.236 -1.404 1.00 . A A . 30 ARG HG3 1 1 17 7643 1 1 30 ARG HH11 H -5.614 3.462 -1.629 1.00 . A A . 30 ARG HH11 1 1 17 7644 1 1 30 ARG HH12 H -4.710 2.708 -2.899 1.00 . A A . 30 ARG HH12 1 1 17 7645 1 1 30 ARG HH21 H -7.021 3.304 -5.358 1.00 . A A . 30 ARG HH21 1 1 17 7646 1 1 30 ARG HH22 H -5.486 2.618 -4.944 1.00 . A A . 30 ARG HH22 1 1 17 7647 1 1 30 ARG N N -8.575 0.184 -2.790 1.00 . A A . 30 ARG N 1 1 17 7648 1 1 30 ARG NE N -7.559 4.190 -3.134 1.00 . A A . 30 ARG NE 1 1 17 7649 1 1 30 ARG NH1 N -5.519 3.208 -2.591 1.00 . A A . 30 ARG NH1 1 1 17 7650 1 1 30 ARG NH2 N -6.310 3.119 -4.680 1.00 . A A . 30 ARG NH2 1 1 17 7651 1 1 30 ARG O O -12.045 -0.061 -2.563 1.00 . A A . 30 ARG O 1 1 17 7652 1 1 31 NH2 HN1 H -11.712 -0.029 -5.004 1.00 . A A . 31 NH2 HN1 1 1 17 7653 1 1 31 NH2 HN2 H -10.078 0.641 -4.891 1.00 . A A . 31 NH2 HN2 1 1 17 7654 1 1 31 NH2 N N -10.930 0.301 -4.463 1.00 . A A . 31 NH2 N 1 1 17 7655 2 2 1 NAG C1 C -7.560 14.168 0.571 1.00 . B A . 32 NAG C1 1 1 17 7656 2 2 1 NAG C2 C -7.638 12.704 1.006 1.00 . B A . 32 NAG C2 1 1 17 7657 2 2 1 NAG C3 C -6.484 12.420 1.992 1.00 . B A . 32 NAG C3 1 1 17 7658 2 2 1 NAG C4 C -5.149 12.961 1.445 1.00 . B A . 32 NAG C4 1 1 17 7659 2 2 1 NAG C5 C -5.286 14.427 1.053 1.00 . B A . 32 NAG C5 1 1 17 7660 2 2 1 NAG C6 C -3.924 14.980 0.570 1.00 . B A . 32 NAG C6 1 1 17 7661 2 2 1 NAG C7 C -9.533 11.329 2.037 1.00 . B A . 32 NAG C7 1 1 17 7662 2 2 1 NAG C8 C -10.983 11.417 2.393 1.00 . B A . 32 NAG C8 1 1 17 7663 2 2 1 NAG H1 H -7.834 14.832 1.393 1.00 . B A . 32 NAG H1 1 1 17 7664 2 2 1 NAG H2 H -7.468 12.116 0.101 1.00 . B A . 32 NAG H2 1 1 17 7665 2 2 1 NAG H3 H -6.705 12.878 2.956 1.00 . B A . 32 NAG H3 1 1 17 7666 2 2 1 NAG H4 H -4.918 12.414 0.531 1.00 . B A . 32 NAG H4 1 1 17 7667 2 2 1 NAG H5 H -5.592 15.018 1.919 1.00 . B A . 32 NAG H5 1 1 17 7668 2 2 1 NAG H61 H -3.323 15.233 1.444 1.00 . B A . 32 NAG H61 1 1 17 7669 2 2 1 NAG H62 H -4.085 15.894 -0.001 1.00 . B A . 32 NAG H62 1 1 17 7670 2 2 1 NAG H81 H -11.110 12.154 3.183 1.00 . B A . 32 NAG H81 1 1 17 7671 2 2 1 NAG H82 H -11.554 11.698 1.511 1.00 . B A . 32 NAG H82 1 1 17 7672 2 2 1 NAG H83 H -11.311 10.441 2.743 1.00 . B A . 32 NAG H83 1 1 17 7673 2 2 1 NAG HN2 H -9.668 13.187 1.438 1.00 . B A . 32 NAG HN2 1 1 17 7674 2 2 1 NAG HO1 H -7.937 14.932 -1.086 1.00 . B A . 32 NAG HO1 1 1 17 7675 2 2 1 NAG HO3 H -7.261 10.656 1.994 1.00 . B A . 32 NAG HO3 1 1 17 7676 2 2 1 NAG HO4 H 3.100 6.427 7.230 1.00 . B A . 32 NAG HO4 1 1 17 7677 2 2 1 NAG HO6 H -3.538 14.047 -1.093 1.00 . B A . 32 NAG HO6 1 1 17 7678 2 2 1 NAG N2 N -8.994 12.444 1.555 1.00 . B A . 32 NAG N2 1 1 17 7679 2 2 1 NAG O1 O -8.420 14.370 -0.476 1.00 . B A . 32 NAG O1 1 1 17 7680 2 2 1 NAG O3 O -6.376 11.015 2.138 1.00 . B A . 32 NAG O3 1 1 17 7681 2 2 1 NAG O4 O -4.048 12.884 2.376 1.00 . B A . 32 NAG O4 1 1 17 7682 2 2 1 NAG O5 O -6.286 14.511 0.054 1.00 . B A . 32 NAG O5 1 1 17 7683 2 2 1 NAG O6 O -3.160 14.062 -0.207 1.00 . B A . 32 NAG O6 1 1 17 7684 2 2 1 NAG O7 O -8.917 10.279 2.207 1.00 . B A . 32 NAG O7 1 1 18 7685 1 1 1 VAL C C 3.715 0.130 7.642 1.00 . A A . 1 VAL C 1 1 18 7686 1 1 1 VAL CA C 3.100 1.411 8.173 1.00 . A A . 1 VAL CA 1 1 18 7687 1 1 1 VAL CB C 2.452 1.202 9.548 1.00 . A A . 1 VAL CB 1 1 18 7688 1 1 1 VAL CG1 C 2.321 2.561 10.238 1.00 . A A . 1 VAL CG1 1 1 18 7689 1 1 1 VAL CG2 C 1.060 0.560 9.493 1.00 . A A . 1 VAL CG2 1 1 18 7690 1 1 1 VAL H1 H 2.653 2.198 6.335 1.00 . A A . 1 VAL H1 1 1 18 7691 1 1 1 VAL H2 H 1.686 2.763 7.535 1.00 . A A . 1 VAL H2 1 1 18 7692 1 1 1 VAL H3 H 1.461 1.242 6.940 1.00 . A A . 1 VAL H3 1 1 18 7693 1 1 1 VAL HA H 3.911 2.131 8.291 1.00 . A A . 1 VAL HA 1 1 18 7694 1 1 1 VAL HB H 3.111 0.581 10.155 1.00 . A A . 1 VAL HB 1 1 18 7695 1 1 1 VAL HG11 H 1.629 3.212 9.704 1.00 . A A . 1 VAL HG11 1 1 18 7696 1 1 1 VAL HG12 H 1.948 2.415 11.253 1.00 . A A . 1 VAL HG12 1 1 18 7697 1 1 1 VAL HG13 H 3.297 3.044 10.296 1.00 . A A . 1 VAL HG13 1 1 18 7698 1 1 1 VAL HG21 H 0.709 0.396 10.513 1.00 . A A . 1 VAL HG21 1 1 18 7699 1 1 1 VAL HG22 H 0.340 1.200 8.985 1.00 . A A . 1 VAL HG22 1 1 18 7700 1 1 1 VAL HG23 H 1.097 -0.408 8.993 1.00 . A A . 1 VAL HG23 1 1 18 7701 1 1 1 VAL N N 2.151 1.945 7.182 1.00 . A A . 1 VAL N 1 1 18 7702 1 1 1 VAL O O 3.034 -0.881 7.527 1.00 . A A . 1 VAL O 1 1 18 7703 1 1 2 GLY C C 5.928 -0.452 5.067 1.00 . A A . 2 GLY C 1 1 18 7704 1 1 2 GLY CA C 5.686 -0.847 6.520 1.00 . A A . 2 GLY CA 1 1 18 7705 1 1 2 GLY H H 5.373 1.153 7.247 1.00 . A A . 2 GLY H 1 1 18 7706 1 1 2 GLY HA2 H 6.653 -1.017 6.987 1.00 . A A . 2 GLY HA2 1 1 18 7707 1 1 2 GLY HA3 H 5.104 -1.766 6.529 1.00 . A A . 2 GLY HA3 1 1 18 7708 1 1 2 GLY N N 4.984 0.206 7.252 1.00 . A A . 2 GLY N 1 1 18 7709 1 1 2 GLY O O 5.622 -1.211 4.154 1.00 . A A . 2 GLY O 1 1 18 7710 1 1 3 GLU C C 6.938 0.825 2.417 1.00 . A A . 3 GLU C 1 1 18 7711 1 1 3 GLU CA C 6.257 1.504 3.605 1.00 . A A . 3 GLU CA 1 1 18 7712 1 1 3 GLU CB C 6.761 2.935 3.825 1.00 . A A . 3 GLU CB 1 1 18 7713 1 1 3 GLU CD C 4.804 3.034 5.481 1.00 . A A . 3 GLU CD 1 1 18 7714 1 1 3 GLU CG C 5.674 3.801 4.475 1.00 . A A . 3 GLU CG 1 1 18 7715 1 1 3 GLU H H 6.547 1.355 5.688 1.00 . A A . 3 GLU H 1 1 18 7716 1 1 3 GLU HA H 5.198 1.552 3.348 1.00 . A A . 3 GLU HA 1 1 18 7717 1 1 3 GLU HB2 H 7.563 2.912 4.422 1.00 . A A . 3 GLU HB2 1 1 18 7718 1 1 3 GLU HB3 H 7.013 3.333 2.943 1.00 . A A . 3 GLU HB3 1 1 18 7719 1 1 3 GLU HG2 H 6.117 4.560 4.953 1.00 . A A . 3 GLU HG2 1 1 18 7720 1 1 3 GLU HG3 H 5.082 4.161 3.754 1.00 . A A . 3 GLU HG3 1 1 18 7721 1 1 3 GLU N N 6.382 0.783 4.867 1.00 . A A . 3 GLU N 1 1 18 7722 1 1 3 GLU O O 7.907 0.081 2.540 1.00 . A A . 3 GLU O 1 1 18 7723 1 1 3 GLU OE1 O 5.299 2.707 6.586 1.00 . A A . 3 GLU OE1 1 1 18 7724 1 1 3 GLU OE2 O 3.666 2.644 5.120 1.00 . A A . 3 GLU OE2 1 1 18 7725 1 1 4 CYS C C 7.778 0.422 -0.707 1.00 . A A . 4 CYS C 1 1 18 7726 1 1 4 CYS CA C 6.539 0.135 0.138 1.00 . A A . 4 CYS CA 1 1 18 7727 1 1 4 CYS CB C 5.303 0.237 -0.756 1.00 . A A . 4 CYS CB 1 1 18 7728 1 1 4 CYS H H 5.624 1.751 1.183 1.00 . A A . 4 CYS H 1 1 18 7729 1 1 4 CYS HA H 6.607 -0.879 0.538 1.00 . A A . 4 CYS HA 1 1 18 7730 1 1 4 CYS HB2 H 5.334 1.123 -1.218 1.00 . A A . 4 CYS HB2 1 1 18 7731 1 1 4 CYS HB3 H 5.358 -0.495 -1.435 1.00 . A A . 4 CYS HB3 1 1 18 7732 1 1 4 CYS N N 6.375 1.068 1.237 1.00 . A A . 4 CYS N 1 1 18 7733 1 1 4 CYS O O 8.235 1.566 -0.822 1.00 . A A . 4 CYS O 1 1 18 7734 1 1 4 CYS SG S 3.697 0.103 0.070 1.00 . A A . 4 CYS SG 1 1 18 7735 1 1 5 VAL C C 8.425 0.192 -3.805 1.00 . A A . 5 VAL C 1 1 18 7736 1 1 5 VAL CA C 9.134 -0.439 -2.601 1.00 . A A . 5 VAL CA 1 1 18 7737 1 1 5 VAL CB C 9.761 -1.806 -2.925 1.00 . A A . 5 VAL CB 1 1 18 7738 1 1 5 VAL CG1 C 10.959 -1.666 -3.873 1.00 . A A . 5 VAL CG1 1 1 18 7739 1 1 5 VAL CG2 C 10.285 -2.483 -1.653 1.00 . A A . 5 VAL CG2 1 1 18 7740 1 1 5 VAL H H 7.700 -1.463 -1.400 1.00 . A A . 5 VAL H 1 1 18 7741 1 1 5 VAL HA H 9.928 0.239 -2.293 1.00 . A A . 5 VAL HA 1 1 18 7742 1 1 5 VAL HB H 9.001 -2.455 -3.361 1.00 . A A . 5 VAL HB 1 1 18 7743 1 1 5 VAL HG11 H 11.389 -2.649 -4.065 1.00 . A A . 5 VAL HG11 1 1 18 7744 1 1 5 VAL HG12 H 10.658 -1.239 -4.829 1.00 . A A . 5 VAL HG12 1 1 18 7745 1 1 5 VAL HG13 H 11.719 -1.029 -3.422 1.00 . A A . 5 VAL HG13 1 1 18 7746 1 1 5 VAL HG21 H 9.464 -2.741 -0.984 1.00 . A A . 5 VAL HG21 1 1 18 7747 1 1 5 VAL HG22 H 10.805 -3.404 -1.914 1.00 . A A . 5 VAL HG22 1 1 18 7748 1 1 5 VAL HG23 H 10.975 -1.818 -1.134 1.00 . A A . 5 VAL HG23 1 1 18 7749 1 1 5 VAL N N 8.179 -0.573 -1.499 1.00 . A A . 5 VAL N 1 1 18 7750 1 1 5 VAL O O 8.373 -0.362 -4.896 1.00 . A A . 5 VAL O 1 1 18 7751 1 1 6 ARG C C 6.008 1.428 -5.289 1.00 . A A . 6 ARG C 1 1 18 7752 1 1 6 ARG CA C 7.072 2.195 -4.504 1.00 . A A . 6 ARG CA 1 1 18 7753 1 1 6 ARG CB C 8.068 2.957 -5.389 1.00 . A A . 6 ARG CB 1 1 18 7754 1 1 6 ARG CD C 8.587 4.752 -3.603 1.00 . A A . 6 ARG CD 1 1 18 7755 1 1 6 ARG CG C 9.146 3.710 -4.586 1.00 . A A . 6 ARG CG 1 1 18 7756 1 1 6 ARG CZ C 7.228 4.585 -1.499 1.00 . A A . 6 ARG CZ 1 1 18 7757 1 1 6 ARG H H 7.834 1.645 -2.597 1.00 . A A . 6 ARG H 1 1 18 7758 1 1 6 ARG HA H 6.499 2.917 -3.930 1.00 . A A . 6 ARG HA 1 1 18 7759 1 1 6 ARG HB2 H 8.522 2.301 -5.992 1.00 . A A . 6 ARG HB2 1 1 18 7760 1 1 6 ARG HB3 H 7.561 3.621 -5.939 1.00 . A A . 6 ARG HB3 1 1 18 7761 1 1 6 ARG HD2 H 9.285 5.451 -3.449 1.00 . A A . 6 ARG HD2 1 1 18 7762 1 1 6 ARG HD3 H 7.778 5.173 -4.012 1.00 . A A . 6 ARG HD3 1 1 18 7763 1 1 6 ARG HE H 8.747 3.395 -1.941 1.00 . A A . 6 ARG HE 1 1 18 7764 1 1 6 ARG HG2 H 9.674 3.040 -4.065 1.00 . A A . 6 ARG HG2 1 1 18 7765 1 1 6 ARG HG3 H 9.747 4.180 -5.232 1.00 . A A . 6 ARG HG3 1 1 18 7766 1 1 6 ARG HH11 H 6.673 6.145 -2.638 1.00 . A A . 6 ARG HH11 1 1 18 7767 1 1 6 ARG HH12 H 5.767 5.927 -1.178 1.00 . A A . 6 ARG HH12 1 1 18 7768 1 1 6 ARG HH21 H 7.497 3.080 -0.199 1.00 . A A . 6 ARG HH21 1 1 18 7769 1 1 6 ARG HH22 H 6.232 4.194 0.199 1.00 . A A . 6 ARG HH22 1 1 18 7770 1 1 6 ARG N N 7.795 1.346 -3.557 1.00 . A A . 6 ARG N 1 1 18 7771 1 1 6 ARG NE N 8.206 4.172 -2.297 1.00 . A A . 6 ARG NE 1 1 18 7772 1 1 6 ARG NH1 N 6.498 5.636 -1.795 1.00 . A A . 6 ARG NH1 1 1 18 7773 1 1 6 ARG NH2 N 6.965 3.899 -0.414 1.00 . A A . 6 ARG NH2 1 1 18 7774 1 1 6 ARG O O 5.725 1.714 -6.445 1.00 . A A . 6 ARG O 1 1 18 7775 1 1 7 GLY C C 3.863 -1.505 -4.249 1.00 . A A . 7 GLY C 1 1 18 7776 1 1 7 GLY CA C 4.242 -0.281 -5.086 1.00 . A A . 7 GLY CA 1 1 18 7777 1 1 7 GLY H H 5.702 0.439 -3.630 1.00 . A A . 7 GLY H 1 1 18 7778 1 1 7 GLY HA2 H 3.376 0.381 -5.128 1.00 . A A . 7 GLY HA2 1 1 18 7779 1 1 7 GLY HA3 H 4.452 -0.619 -6.102 1.00 . A A . 7 GLY HA3 1 1 18 7780 1 1 7 GLY N N 5.393 0.480 -4.589 1.00 . A A . 7 GLY N 1 1 18 7781 1 1 7 GLY O O 2.693 -1.877 -4.210 1.00 . A A . 7 GLY O 1 1 18 7782 1 1 8 ARG C C 5.279 -3.145 -1.319 1.00 . A A . 8 ARG C 1 1 18 7783 1 1 8 ARG CA C 4.522 -3.243 -2.636 1.00 . A A . 8 ARG CA 1 1 18 7784 1 1 8 ARG CB C 4.915 -4.556 -3.331 1.00 . A A . 8 ARG CB 1 1 18 7785 1 1 8 ARG CD C 2.565 -5.599 -3.091 1.00 . A A . 8 ARG CD 1 1 18 7786 1 1 8 ARG CG C 3.746 -5.271 -4.018 1.00 . A A . 8 ARG CG 1 1 18 7787 1 1 8 ARG CZ C 2.157 -6.756 -0.923 1.00 . A A . 8 ARG CZ 1 1 18 7788 1 1 8 ARG H H 5.780 -1.868 -3.669 1.00 . A A . 8 ARG H 1 1 18 7789 1 1 8 ARG HA H 3.460 -3.246 -2.398 1.00 . A A . 8 ARG HA 1 1 18 7790 1 1 8 ARG HB2 H 5.608 -4.351 -4.022 1.00 . A A . 8 ARG HB2 1 1 18 7791 1 1 8 ARG HB3 H 5.301 -5.172 -2.644 1.00 . A A . 8 ARG HB3 1 1 18 7792 1 1 8 ARG HD2 H 2.073 -4.751 -2.892 1.00 . A A . 8 ARG HD2 1 1 18 7793 1 1 8 ARG HD3 H 1.956 -6.234 -3.566 1.00 . A A . 8 ARG HD3 1 1 18 7794 1 1 8 ARG HE H 3.952 -6.225 -1.532 1.00 . A A . 8 ARG HE 1 1 18 7795 1 1 8 ARG HG2 H 3.411 -4.684 -4.755 1.00 . A A . 8 ARG HG2 1 1 18 7796 1 1 8 ARG HG3 H 4.088 -6.128 -4.403 1.00 . A A . 8 ARG HG3 1 1 18 7797 1 1 8 ARG HH11 H 0.474 -6.509 -1.986 1.00 . A A . 8 ARG HH11 1 1 18 7798 1 1 8 ARG HH12 H 0.279 -7.268 -0.441 1.00 . A A . 8 ARG HH12 1 1 18 7799 1 1 8 ARG HH21 H 3.614 -7.120 0.402 1.00 . A A . 8 ARG HH21 1 1 18 7800 1 1 8 ARG HH22 H 2.024 -7.607 0.886 1.00 . A A . 8 ARG HH22 1 1 18 7801 1 1 8 ARG N N 4.813 -2.123 -3.535 1.00 . A A . 8 ARG N 1 1 18 7802 1 1 8 ARG NE N 2.974 -6.212 -1.813 1.00 . A A . 8 ARG NE 1 1 18 7803 1 1 8 ARG NH1 N 0.869 -6.852 -1.133 1.00 . A A . 8 ARG NH1 1 1 18 7804 1 1 8 ARG NH2 N 2.636 -7.195 0.210 1.00 . A A . 8 ARG NH2 1 1 18 7805 1 1 8 ARG O O 6.414 -2.677 -1.286 1.00 . A A . 8 ARG O 1 1 18 7806 1 1 9 CYS C C 5.653 -5.590 0.846 1.00 . A A . 9 CYS C 1 1 18 7807 1 1 9 CYS CA C 5.362 -4.084 0.951 1.00 . A A . 9 CYS CA 1 1 18 7808 1 1 9 CYS CB C 4.460 -3.798 2.163 1.00 . A A . 9 CYS CB 1 1 18 7809 1 1 9 CYS H H 3.742 -4.036 -0.350 1.00 . A A . 9 CYS H 1 1 18 7810 1 1 9 CYS HA H 6.302 -3.538 1.058 1.00 . A A . 9 CYS HA 1 1 18 7811 1 1 9 CYS HB2 H 4.276 -4.678 2.601 1.00 . A A . 9 CYS HB2 1 1 18 7812 1 1 9 CYS HB3 H 4.987 -3.219 2.785 1.00 . A A . 9 CYS HB3 1 1 18 7813 1 1 9 CYS N N 4.675 -3.675 -0.259 1.00 . A A . 9 CYS N 1 1 18 7814 1 1 9 CYS O O 5.124 -6.252 -0.055 1.00 . A A . 9 CYS O 1 1 18 7815 1 1 9 CYS SG S 2.858 -2.987 1.923 1.00 . A A . 9 CYS SG 1 1 18 7816 1 1 10 PRO C C 5.141 -8.150 2.551 1.00 . A A . 10 PRO C 1 1 18 7817 1 1 10 PRO CA C 6.455 -7.619 1.956 1.00 . A A . 10 PRO CA 1 1 18 7818 1 1 10 PRO CB C 7.636 -7.852 2.903 1.00 . A A . 10 PRO CB 1 1 18 7819 1 1 10 PRO CD C 7.177 -5.501 2.820 1.00 . A A . 10 PRO CD 1 1 18 7820 1 1 10 PRO CG C 7.614 -6.603 3.785 1.00 . A A . 10 PRO CG 1 1 18 7821 1 1 10 PRO HA H 6.643 -8.110 1.000 1.00 . A A . 10 PRO HA 1 1 18 7822 1 1 10 PRO HB2 H 7.503 -8.680 3.448 1.00 . A A . 10 PRO HB2 1 1 18 7823 1 1 10 PRO HB3 H 8.496 -7.920 2.397 1.00 . A A . 10 PRO HB3 1 1 18 7824 1 1 10 PRO HD2 H 6.613 -4.825 3.294 1.00 . A A . 10 PRO HD2 1 1 18 7825 1 1 10 PRO HD3 H 7.975 -5.050 2.421 1.00 . A A . 10 PRO HD3 1 1 18 7826 1 1 10 PRO HG2 H 6.959 -6.704 4.534 1.00 . A A . 10 PRO HG2 1 1 18 7827 1 1 10 PRO HG3 H 8.522 -6.413 4.159 1.00 . A A . 10 PRO HG3 1 1 18 7828 1 1 10 PRO N N 6.404 -6.173 1.788 1.00 . A A . 10 PRO N 1 1 18 7829 1 1 10 PRO O O 4.274 -7.376 2.957 1.00 . A A . 10 PRO O 1 1 18 7830 1 1 11 SER C C 2.520 -9.857 2.962 1.00 . A A . 11 SER C 1 1 18 7831 1 1 11 SER CA C 3.965 -10.182 3.377 1.00 . A A . 11 SER CA 1 1 18 7832 1 1 11 SER CB C 4.179 -9.945 4.873 1.00 . A A . 11 SER CB 1 1 18 7833 1 1 11 SER H H 5.787 -10.032 2.293 1.00 . A A . 11 SER H 1 1 18 7834 1 1 11 SER HA H 4.091 -11.251 3.207 1.00 . A A . 11 SER HA 1 1 18 7835 1 1 11 SER HB2 H 5.144 -10.083 5.096 1.00 . A A . 11 SER HB2 1 1 18 7836 1 1 11 SER HB3 H 3.915 -9.008 5.102 1.00 . A A . 11 SER HB3 1 1 18 7837 1 1 11 SER HG H 3.676 -10.827 6.540 1.00 . A A . 11 SER HG 1 1 18 7838 1 1 11 SER N N 5.019 -9.478 2.637 1.00 . A A . 11 SER N 1 1 18 7839 1 1 11 SER O O 2.241 -9.118 2.017 1.00 . A A . 11 SER O 1 1 18 7840 1 1 11 SER OG O 3.390 -10.851 5.620 1.00 . A A . 11 SER OG 1 1 18 7841 1 1 12 GLY C C -0.462 -8.878 3.658 1.00 . A A . 12 GLY C 1 1 18 7842 1 1 12 GLY CA C 0.122 -10.288 3.486 1.00 . A A . 12 GLY CA 1 1 18 7843 1 1 12 GLY H H 1.916 -10.936 4.506 1.00 . A A . 12 GLY H 1 1 18 7844 1 1 12 GLY HA2 H -0.103 -10.619 2.473 1.00 . A A . 12 GLY HA2 1 1 18 7845 1 1 12 GLY HA3 H -0.396 -10.951 4.179 1.00 . A A . 12 GLY HA3 1 1 18 7846 1 1 12 GLY N N 1.566 -10.408 3.709 1.00 . A A . 12 GLY N 1 1 18 7847 1 1 12 GLY O O -1.677 -8.738 3.801 1.00 . A A . 12 GLY O 1 1 18 7848 1 1 13 MET C C -0.396 -5.937 2.299 1.00 . A A . 13 MET C 1 1 18 7849 1 1 13 MET CA C -0.081 -6.444 3.708 1.00 . A A . 13 MET CA 1 1 18 7850 1 1 13 MET CB C 0.990 -5.583 4.381 1.00 . A A . 13 MET CB 1 1 18 7851 1 1 13 MET CE C 0.828 -6.621 8.442 1.00 . A A . 13 MET CE 1 1 18 7852 1 1 13 MET CG C 1.346 -6.074 5.786 1.00 . A A . 13 MET CG 1 1 18 7853 1 1 13 MET H H 1.327 -7.999 3.387 1.00 . A A . 13 MET H 1 1 18 7854 1 1 13 MET HA H -0.993 -6.365 4.294 1.00 . A A . 13 MET HA 1 1 18 7855 1 1 13 MET HB2 H 1.816 -5.601 3.817 1.00 . A A . 13 MET HB2 1 1 18 7856 1 1 13 MET HB3 H 0.651 -4.644 4.447 1.00 . A A . 13 MET HB3 1 1 18 7857 1 1 13 MET HE1 H 0.122 -6.692 9.269 1.00 . A A . 13 MET HE1 1 1 18 7858 1 1 13 MET HE2 H 1.292 -7.593 8.277 1.00 . A A . 13 MET HE2 1 1 18 7859 1 1 13 MET HE3 H 1.598 -5.888 8.687 1.00 . A A . 13 MET HE3 1 1 18 7860 1 1 13 MET HG2 H 1.708 -7.003 5.710 1.00 . A A . 13 MET HG2 1 1 18 7861 1 1 13 MET HG3 H 2.051 -5.470 6.159 1.00 . A A . 13 MET HG3 1 1 18 7862 1 1 13 MET N N 0.368 -7.833 3.661 1.00 . A A . 13 MET N 1 1 18 7863 1 1 13 MET O O -0.182 -6.649 1.316 1.00 . A A . 13 MET O 1 1 18 7864 1 1 13 MET SD S -0.047 -6.102 6.944 1.00 . A A . 13 MET SD 1 1 18 7865 1 1 14 CYS C C -0.701 -2.636 0.897 1.00 . A A . 14 CYS C 1 1 18 7866 1 1 14 CYS CA C -1.235 -4.080 0.917 1.00 . A A . 14 CYS CA 1 1 18 7867 1 1 14 CYS CB C -2.753 -4.154 0.704 1.00 . A A . 14 CYS CB 1 1 18 7868 1 1 14 CYS H H -1.114 -4.167 3.022 1.00 . A A . 14 CYS H 1 1 18 7869 1 1 14 CYS HA H -0.750 -4.612 0.100 1.00 . A A . 14 CYS HA 1 1 18 7870 1 1 14 CYS HB2 H -3.153 -3.326 1.096 1.00 . A A . 14 CYS HB2 1 1 18 7871 1 1 14 CYS HB3 H -2.919 -4.170 -0.282 1.00 . A A . 14 CYS HB3 1 1 18 7872 1 1 14 CYS N N -0.904 -4.712 2.188 1.00 . A A . 14 CYS N 1 1 18 7873 1 1 14 CYS O O -0.276 -2.116 1.926 1.00 . A A . 14 CYS O 1 1 18 7874 1 1 14 CYS SG S -3.623 -5.583 1.432 1.00 . A A . 14 CYS SG 1 1 18 7875 1 1 15 CYS C C -0.780 0.332 -1.211 1.00 . A A . 15 CYS C 1 1 18 7876 1 1 15 CYS CA C 0.047 -0.744 -0.485 1.00 . A A . 15 CYS CA 1 1 18 7877 1 1 15 CYS CB C 1.274 -1.097 -1.324 1.00 . A A . 15 CYS CB 1 1 18 7878 1 1 15 CYS H H -1.204 -2.370 -1.049 1.00 . A A . 15 CYS H 1 1 18 7879 1 1 15 CYS HA H 0.383 -0.340 0.469 1.00 . A A . 15 CYS HA 1 1 18 7880 1 1 15 CYS HB2 H 1.753 -1.857 -0.885 1.00 . A A . 15 CYS HB2 1 1 18 7881 1 1 15 CYS HB3 H 0.969 -1.376 -2.235 1.00 . A A . 15 CYS HB3 1 1 18 7882 1 1 15 CYS N N -0.691 -1.986 -0.269 1.00 . A A . 15 CYS N 1 1 18 7883 1 1 15 CYS O O -1.411 0.041 -2.224 1.00 . A A . 15 CYS O 1 1 18 7884 1 1 15 CYS SG S 2.419 0.282 -1.497 1.00 . A A . 15 CYS SG 1 1 18 7885 1 1 16 SER C C -0.513 3.238 -2.582 1.00 . A A . 16 SER C 1 1 18 7886 1 1 16 SER CA C -1.385 2.703 -1.442 1.00 . A A . 16 SER CA 1 1 18 7887 1 1 16 SER CB C -1.687 3.818 -0.442 1.00 . A A . 16 SER CB 1 1 18 7888 1 1 16 SER H H -0.150 1.810 0.053 1.00 . A A . 16 SER H 1 1 18 7889 1 1 16 SER HA H -2.329 2.358 -1.866 1.00 . A A . 16 SER HA 1 1 18 7890 1 1 16 SER HB2 H -2.225 4.526 -0.899 1.00 . A A . 16 SER HB2 1 1 18 7891 1 1 16 SER HB3 H -2.213 3.438 0.319 1.00 . A A . 16 SER HB3 1 1 18 7892 1 1 16 SER HG H -0.780 4.940 0.824 1.00 . A A . 16 SER HG 1 1 18 7893 1 1 16 SER N N -0.739 1.588 -0.747 1.00 . A A . 16 SER N 1 1 18 7894 1 1 16 SER O O 0.678 2.939 -2.657 1.00 . A A . 16 SER O 1 1 18 7895 1 1 16 SER OG O -0.498 4.399 0.065 1.00 . A A . 16 SER OG 1 1 18 7896 1 1 17 GLN C C 0.803 5.607 -4.201 1.00 . A A . 17 GLN C 1 1 18 7897 1 1 17 GLN CA C -0.281 4.593 -4.596 1.00 . A A . 17 GLN CA 1 1 18 7898 1 1 17 GLN CB C -1.216 5.066 -5.710 1.00 . A A . 17 GLN CB 1 1 18 7899 1 1 17 GLN CD C -2.846 6.703 -4.600 1.00 . A A . 17 GLN CD 1 1 18 7900 1 1 17 GLN CG C -1.691 6.509 -5.574 1.00 . A A . 17 GLN CG 1 1 18 7901 1 1 17 GLN H H -2.009 4.419 -3.379 1.00 . A A . 17 GLN H 1 1 18 7902 1 1 17 GLN HA H 0.256 3.765 -5.036 1.00 . A A . 17 GLN HA 1 1 18 7903 1 1 17 GLN HB2 H -0.732 4.978 -6.581 1.00 . A A . 17 GLN HB2 1 1 18 7904 1 1 17 GLN HB3 H -2.021 4.472 -5.714 1.00 . A A . 17 GLN HB3 1 1 18 7905 1 1 17 GLN HE21 H -3.591 8.219 -5.709 1.00 . A A . 17 GLN HE21 1 1 18 7906 1 1 17 GLN HE22 H -4.501 7.810 -4.267 1.00 . A A . 17 GLN HE22 1 1 18 7907 1 1 17 GLN HG2 H -0.920 7.063 -5.259 1.00 . A A . 17 GLN HG2 1 1 18 7908 1 1 17 GLN HG3 H -1.985 6.827 -6.475 1.00 . A A . 17 GLN HG3 1 1 18 7909 1 1 17 GLN N N -1.051 4.094 -3.459 1.00 . A A . 17 GLN N 1 1 18 7910 1 1 17 GLN NE2 N -3.717 7.652 -4.887 1.00 . A A . 17 GLN NE2 1 1 18 7911 1 1 17 GLN O O 1.722 5.862 -4.969 1.00 . A A . 17 GLN O 1 1 18 7912 1 1 17 GLN OE1 O -2.986 6.015 -3.590 1.00 . A A . 17 GLN OE1 1 1 18 7913 1 1 18 . C C 2.919 5.934 -1.771 1.00 . A A . 18 PFF C 1 1 18 7914 1 1 18 . CA C 1.864 6.875 -2.379 1.00 . A A . 18 PFF CA 1 1 18 7915 1 1 18 . CB C 1.310 7.877 -1.355 1.00 . A A . 18 PFF CB 1 1 18 7916 1 1 18 . CD1 C -0.526 8.981 -2.715 1.00 . A A . 18 PFF CD1 1 1 18 7917 1 1 18 . CD2 C 1.406 10.308 -2.057 1.00 . A A . 18 PFF CD2 1 1 18 7918 1 1 18 . CE1 C -0.982 10.044 -3.513 1.00 . A A . 18 PFF CE1 1 1 18 7919 1 1 18 . CE2 C 0.922 11.387 -2.816 1.00 . A A . 18 PFF CE2 1 1 18 7920 1 1 18 . CG C 0.691 9.095 -2.015 1.00 . A A . 18 PFF CG 1 1 18 7921 1 1 18 . CZ C -0.269 11.254 -3.549 1.00 . A A . 18 PFF CZ 1 1 18 7922 1 1 18 . F F -0.738 12.299 -4.280 1.00 . A A . 18 PFF F 1 1 18 7923 1 1 18 . H H -0.032 5.880 -2.385 1.00 . A A . 18 PFF H 1 1 18 7924 1 1 18 . HA H 2.369 7.446 -3.161 1.00 . A A . 18 PFF HA 1 1 18 7925 1 1 18 . HB2 H 0.570 7.386 -0.720 1.00 . A A . 18 PFF HB2 1 1 18 7926 1 1 18 . HB3 H 2.125 8.214 -0.713 1.00 . A A . 18 PFF HB3 1 1 18 7927 1 1 18 . HD1 H -1.095 8.065 -2.671 1.00 . A A . 18 PFF HD1 1 1 18 7928 1 1 18 . HD2 H 2.351 10.399 -1.542 1.00 . A A . 18 PFF HD2 1 1 18 7929 1 1 18 . HE1 H -1.894 9.942 -4.081 1.00 . A A . 18 PFF HE1 1 1 18 7930 1 1 18 . HE2 H 1.486 12.307 -2.868 1.00 . A A . 18 PFF HE2 1 1 18 7931 1 1 18 . N N 0.752 6.127 -2.971 1.00 . A A . 18 PFF N 1 1 18 7932 1 1 18 . O O 3.947 6.370 -1.247 1.00 . A A . 18 PFF O 1 1 18 7933 1 1 19 GLY C C 3.607 3.521 0.169 1.00 . A A . 19 GLY C 1 1 18 7934 1 1 19 GLY CA C 3.635 3.635 -1.350 1.00 . A A . 19 GLY CA 1 1 18 7935 1 1 19 GLY H H 1.862 4.267 -2.305 1.00 . A A . 19 GLY H 1 1 18 7936 1 1 19 GLY HA2 H 3.388 2.673 -1.786 1.00 . A A . 19 GLY HA2 1 1 18 7937 1 1 19 GLY HA3 H 4.636 3.891 -1.669 1.00 . A A . 19 GLY HA3 1 1 18 7938 1 1 19 GLY N N 2.700 4.620 -1.853 1.00 . A A . 19 GLY N 1 1 18 7939 1 1 19 GLY O O 4.648 3.243 0.769 1.00 . A A . 19 GLY O 1 1 18 7940 1 1 20 . C C 1.567 2.175 2.416 1.00 . A A . 20 PFF C 1 1 18 7941 1 1 20 . CA C 2.267 3.517 2.219 1.00 . A A . 20 PFF CA 1 1 18 7942 1 1 20 . CB C 1.461 4.658 2.848 1.00 . A A . 20 PFF CB 1 1 18 7943 1 1 20 . CD1 C 3.159 5.846 4.289 1.00 . A A . 20 PFF CD1 1 1 18 7944 1 1 20 . CD2 C 1.360 4.655 5.400 1.00 . A A . 20 PFF CD2 1 1 18 7945 1 1 20 . CE1 C 3.664 6.257 5.534 1.00 . A A . 20 PFF CE1 1 1 18 7946 1 1 20 . CE2 C 1.860 5.073 6.648 1.00 . A A . 20 PFF CE2 1 1 18 7947 1 1 20 . CG C 1.973 5.092 4.210 1.00 . A A . 20 PFF CG 1 1 18 7948 1 1 20 . CZ C 3.009 5.878 6.716 1.00 . A A . 20 PFF CZ 1 1 18 7949 1 1 20 . F F 3.496 6.265 7.924 1.00 . A A . 20 PFF F 1 1 18 7950 1 1 20 . H H 1.625 3.949 0.228 1.00 . A A . 20 PFF H 1 1 18 7951 1 1 20 . HA H 3.239 3.468 2.705 1.00 . A A . 20 PFF HA 1 1 18 7952 1 1 20 . HB2 H 1.500 5.517 2.178 1.00 . A A . 20 PFF HB2 1 1 18 7953 1 1 20 . HB3 H 0.416 4.365 2.917 1.00 . A A . 20 PFF HB3 1 1 18 7954 1 1 20 . HD1 H 3.751 5.994 3.401 1.00 . A A . 20 PFF HD1 1 1 18 7955 1 1 20 . HD2 H 0.505 4.003 5.370 1.00 . A A . 20 PFF HD2 1 1 18 7956 1 1 20 . HE1 H 4.581 6.827 5.586 1.00 . A A . 20 PFF HE1 1 1 18 7957 1 1 20 . HE2 H 1.340 4.814 7.558 1.00 . A A . 20 PFF HE2 1 1 18 7958 1 1 20 . N N 2.451 3.765 0.791 1.00 . A A . 20 PFF N 1 1 18 7959 1 1 20 . O O 0.740 1.784 1.594 1.00 . A A . 20 PFF O 1 1 18 7960 1 1 21 CYS C C 0.324 -0.069 4.700 1.00 . A A . 21 CYS C 1 1 18 7961 1 1 21 CYS CA C 1.428 0.083 3.644 1.00 . A A . 21 CYS CA 1 1 18 7962 1 1 21 CYS CB C 2.643 -0.778 3.985 1.00 . A A . 21 CYS CB 1 1 18 7963 1 1 21 CYS H H 2.564 1.856 4.143 1.00 . A A . 21 CYS H 1 1 18 7964 1 1 21 CYS HA H 1.038 -0.273 2.692 1.00 . A A . 21 CYS HA 1 1 18 7965 1 1 21 CYS HB2 H 3.388 -0.536 3.363 1.00 . A A . 21 CYS HB2 1 1 18 7966 1 1 21 CYS HB3 H 2.917 -0.581 4.926 1.00 . A A . 21 CYS HB3 1 1 18 7967 1 1 21 CYS N N 1.881 1.462 3.493 1.00 . A A . 21 CYS N 1 1 18 7968 1 1 21 CYS O O 0.326 0.636 5.711 1.00 . A A . 21 CYS O 1 1 18 7969 1 1 21 CYS SG S 2.329 -2.548 3.839 1.00 . A A . 21 CYS SG 1 1 18 7970 1 1 22 GLY C C -2.558 -2.434 4.869 1.00 . A A . 22 GLY C 1 1 18 7971 1 1 22 GLY CA C -1.622 -1.383 5.465 1.00 . A A . 22 GLY CA 1 1 18 7972 1 1 22 GLY H H -0.607 -1.518 3.607 1.00 . A A . 22 GLY H 1 1 18 7973 1 1 22 GLY HA2 H -1.151 -1.792 6.359 1.00 . A A . 22 GLY HA2 1 1 18 7974 1 1 22 GLY HA3 H -2.199 -0.498 5.735 1.00 . A A . 22 GLY HA3 1 1 18 7975 1 1 22 GLY N N -0.594 -1.018 4.497 1.00 . A A . 22 GLY N 1 1 18 7976 1 1 22 GLY O O -2.290 -2.962 3.791 1.00 . A A . 22 GLY O 1 1 18 7977 1 1 23 LYS C C -6.091 -2.863 4.833 1.00 . A A . 23 LYS C 1 1 18 7978 1 1 23 LYS CA C -4.742 -3.570 4.963 1.00 . A A . 23 LYS CA 1 1 18 7979 1 1 23 LYS CB C -4.864 -4.904 5.714 1.00 . A A . 23 LYS CB 1 1 18 7980 1 1 23 LYS CD C -3.708 -7.135 6.143 1.00 . A A . 23 LYS CD 1 1 18 7981 1 1 23 LYS CE C -4.722 -8.003 5.385 1.00 . A A . 23 LYS CE 1 1 18 7982 1 1 23 LYS CG C -3.570 -5.715 5.577 1.00 . A A . 23 LYS CG 1 1 18 7983 1 1 23 LYS H H -3.770 -2.383 6.485 1.00 . A A . 23 LYS H 1 1 18 7984 1 1 23 LYS HA H -4.475 -3.791 3.936 1.00 . A A . 23 LYS HA 1 1 18 7985 1 1 23 LYS HB2 H -5.038 -4.722 6.682 1.00 . A A . 23 LYS HB2 1 1 18 7986 1 1 23 LYS HB3 H -5.624 -5.429 5.331 1.00 . A A . 23 LYS HB3 1 1 18 7987 1 1 23 LYS HD2 H -2.814 -7.581 6.098 1.00 . A A . 23 LYS HD2 1 1 18 7988 1 1 23 LYS HD3 H -4.000 -7.068 7.097 1.00 . A A . 23 LYS HD3 1 1 18 7989 1 1 23 LYS HE2 H -4.763 -8.904 5.818 1.00 . A A . 23 LYS HE2 1 1 18 7990 1 1 23 LYS HE3 H -5.621 -7.567 5.435 1.00 . A A . 23 LYS HE3 1 1 18 7991 1 1 23 LYS HG2 H -3.331 -5.777 4.608 1.00 . A A . 23 LYS HG2 1 1 18 7992 1 1 23 LYS HG3 H -2.841 -5.242 6.071 1.00 . A A . 23 LYS HG3 1 1 18 7993 1 1 23 LYS HZ1 H -4.375 -7.289 3.474 1.00 . A A . 23 LYS HZ1 1 1 18 7994 1 1 23 LYS HZ2 H -3.400 -8.531 3.893 1.00 . A A . 23 LYS HZ2 1 1 18 7995 1 1 23 LYS HZ3 H -4.971 -8.823 3.498 1.00 . A A . 23 LYS HZ3 1 1 18 7996 1 1 23 LYS N N -3.672 -2.740 5.545 1.00 . A A . 23 LYS N 1 1 18 7997 1 1 23 LYS NZ N -4.351 -8.173 3.960 1.00 . A A . 23 LYS NZ 1 1 18 7998 1 1 23 LYS O O -7.050 -3.444 4.339 1.00 . A A . 23 LYS O 1 1 18 7999 1 1 24 GLY C C -7.598 -0.349 3.622 1.00 . A A . 24 GLY C 1 1 18 8000 1 1 24 GLY CA C -7.330 -0.748 5.079 1.00 . A A . 24 GLY CA 1 1 18 8001 1 1 24 GLY H H -5.276 -1.199 5.529 1.00 . A A . 24 GLY H 1 1 18 8002 1 1 24 GLY HA2 H -8.200 -1.288 5.457 1.00 . A A . 24 GLY HA2 1 1 18 8003 1 1 24 GLY HA3 H -7.197 0.155 5.675 1.00 . A A . 24 GLY HA3 1 1 18 8004 1 1 24 GLY N N -6.146 -1.593 5.222 1.00 . A A . 24 GLY N 1 1 18 8005 1 1 24 GLY O O -6.773 -0.595 2.735 1.00 . A A . 24 GLY O 1 1 18 8006 1 1 25 PRO C C -8.338 1.029 0.996 1.00 . A A . 25 PRO C 1 1 18 8007 1 1 25 PRO CA C -9.311 0.465 2.031 1.00 . A A . 25 PRO CA 1 1 18 8008 1 1 25 PRO CB C -10.575 1.316 2.206 1.00 . A A . 25 PRO CB 1 1 18 8009 1 1 25 PRO CD C -9.629 0.871 4.359 1.00 . A A . 25 PRO CD 1 1 18 8010 1 1 25 PRO CG C -10.441 1.919 3.606 1.00 . A A . 25 PRO CG 1 1 18 8011 1 1 25 PRO HA H -9.611 -0.520 1.683 1.00 . A A . 25 PRO HA 1 1 18 8012 1 1 25 PRO HB2 H -10.615 2.036 1.513 1.00 . A A . 25 PRO HB2 1 1 18 8013 1 1 25 PRO HB3 H -11.395 0.747 2.143 1.00 . A A . 25 PRO HB3 1 1 18 8014 1 1 25 PRO HD2 H -9.107 1.295 5.099 1.00 . A A . 25 PRO HD2 1 1 18 8015 1 1 25 PRO HD3 H -10.228 0.164 4.735 1.00 . A A . 25 PRO HD3 1 1 18 8016 1 1 25 PRO HG2 H -9.957 2.794 3.575 1.00 . A A . 25 PRO HG2 1 1 18 8017 1 1 25 PRO HG3 H -11.338 2.049 4.028 1.00 . A A . 25 PRO HG3 1 1 18 8018 1 1 25 PRO N N -8.739 0.309 3.362 1.00 . A A . 25 PRO N 1 1 18 8019 1 1 25 PRO O O -8.122 0.390 -0.034 1.00 . A A . 25 PRO O 1 1 18 8020 1 1 26 LYS C C -5.378 2.099 0.324 1.00 . A A . 26 LYS C 1 1 18 8021 1 1 26 LYS CA C -6.738 2.800 0.368 1.00 . A A . 26 LYS CA 1 1 18 8022 1 1 26 LYS CB C -6.535 4.278 0.734 1.00 . A A . 26 LYS CB 1 1 18 8023 1 1 26 LYS CD C -7.382 5.175 -1.522 1.00 . A A . 26 LYS CD 1 1 18 8024 1 1 26 LYS CE C -5.960 5.007 -2.080 1.00 . A A . 26 LYS CE 1 1 18 8025 1 1 26 LYS CG C -7.473 5.251 0.012 1.00 . A A . 26 LYS CG 1 1 18 8026 1 1 26 LYS H H -7.935 2.641 2.144 1.00 . A A . 26 LYS H 1 1 18 8027 1 1 26 LYS HA H -7.123 2.728 -0.648 1.00 . A A . 26 LYS HA 1 1 18 8028 1 1 26 LYS HB2 H -6.680 4.378 1.718 1.00 . A A . 26 LYS HB2 1 1 18 8029 1 1 26 LYS HB3 H -5.593 4.528 0.509 1.00 . A A . 26 LYS HB3 1 1 18 8030 1 1 26 LYS HD2 H -7.929 4.395 -1.827 1.00 . A A . 26 LYS HD2 1 1 18 8031 1 1 26 LYS HD3 H -7.765 6.019 -1.898 1.00 . A A . 26 LYS HD3 1 1 18 8032 1 1 26 LYS HE2 H -5.535 4.219 -1.635 1.00 . A A . 26 LYS HE2 1 1 18 8033 1 1 26 LYS HE3 H -6.022 4.841 -3.064 1.00 . A A . 26 LYS HE3 1 1 18 8034 1 1 26 LYS HG2 H -8.413 5.043 0.283 1.00 . A A . 26 LYS HG2 1 1 18 8035 1 1 26 LYS HG3 H -7.242 6.182 0.296 1.00 . A A . 26 LYS HG3 1 1 18 8036 1 1 26 LYS HZ1 H -4.222 6.084 -2.353 1.00 . A A . 26 LYS HZ1 1 1 18 8037 1 1 26 LYS HZ2 H -5.542 7.034 -2.216 1.00 . A A . 26 LYS HZ2 1 1 18 8038 1 1 26 LYS HZ3 H -4.857 6.337 -0.878 1.00 . A A . 26 LYS HZ3 1 1 18 8039 1 1 26 LYS N N -7.709 2.177 1.275 1.00 . A A . 26 LYS N 1 1 18 8040 1 1 26 LYS NZ N -5.102 6.193 -1.856 1.00 . A A . 26 LYS NZ 1 1 18 8041 1 1 26 LYS O O -4.555 2.477 -0.506 1.00 . A A . 26 LYS O 1 1 18 8042 1 1 27 TYR C C -4.204 -0.968 0.255 1.00 . A A . 27 TYR C 1 1 18 8043 1 1 27 TYR CA C -3.919 0.291 1.064 1.00 . A A . 27 TYR CA 1 1 18 8044 1 1 27 TYR CB C -3.426 -0.106 2.455 1.00 . A A . 27 TYR CB 1 1 18 8045 1 1 27 TYR CD1 C -2.195 1.932 3.325 1.00 . A A . 27 TYR CD1 1 1 18 8046 1 1 27 TYR CD2 C -4.232 1.233 4.443 1.00 . A A . 27 TYR CD2 1 1 18 8047 1 1 27 TYR CE1 C -2.020 2.943 4.289 1.00 . A A . 27 TYR CE1 1 1 18 8048 1 1 27 TYR CE2 C -4.051 2.237 5.410 1.00 . A A . 27 TYR CE2 1 1 18 8049 1 1 27 TYR CG C -3.274 1.040 3.434 1.00 . A A . 27 TYR CG 1 1 18 8050 1 1 27 TYR CZ C -2.937 3.084 5.342 1.00 . A A . 27 TYR CZ 1 1 18 8051 1 1 27 TYR H H -5.851 0.798 1.817 1.00 . A A . 27 TYR H 1 1 18 8052 1 1 27 TYR HA H -3.130 0.852 0.561 1.00 . A A . 27 TYR HA 1 1 18 8053 1 1 27 TYR HB2 H -4.079 -0.758 2.840 1.00 . A A . 27 TYR HB2 1 1 18 8054 1 1 27 TYR HB3 H -2.534 -0.547 2.353 1.00 . A A . 27 TYR HB3 1 1 18 8055 1 1 27 TYR HD1 H -1.527 1.859 2.480 1.00 . A A . 27 TYR HD1 1 1 18 8056 1 1 27 TYR HD2 H -5.127 0.639 4.445 1.00 . A A . 27 TYR HD2 1 1 18 8057 1 1 27 TYR HE1 H -1.227 3.658 4.180 1.00 . A A . 27 TYR HE1 1 1 18 8058 1 1 27 TYR HE2 H -4.779 2.401 6.191 1.00 . A A . 27 TYR HE2 1 1 18 8059 1 1 27 TYR HH H -2.069 4.688 6.126 1.00 . A A . 27 TYR HH 1 1 18 8060 1 1 27 TYR N N -5.131 1.098 1.169 1.00 . A A . 27 TYR N 1 1 18 8061 1 1 27 TYR O O -3.405 -1.386 -0.573 1.00 . A A . 27 TYR O 1 1 18 8062 1 1 27 TYR OH O -2.865 4.140 6.198 1.00 . A A . 27 TYR OH 1 1 18 8063 1 1 28 CYS C C -6.773 -2.790 -1.167 1.00 . A A . 28 CYS C 1 1 18 8064 1 1 28 CYS CA C -5.685 -2.872 -0.088 1.00 . A A . 28 CYS CA 1 1 18 8065 1 1 28 CYS CB C -6.039 -3.811 1.060 1.00 . A A . 28 CYS CB 1 1 18 8066 1 1 28 CYS H H -5.889 -1.310 1.321 1.00 . A A . 28 CYS H 1 1 18 8067 1 1 28 CYS HA H -4.811 -3.273 -0.594 1.00 . A A . 28 CYS HA 1 1 18 8068 1 1 28 CYS HB2 H -5.574 -3.499 1.889 1.00 . A A . 28 CYS HB2 1 1 18 8069 1 1 28 CYS HB3 H -7.028 -3.789 1.204 1.00 . A A . 28 CYS HB3 1 1 18 8070 1 1 28 CYS N N -5.348 -1.597 0.511 1.00 . A A . 28 CYS N 1 1 18 8071 1 1 28 CYS O O -7.305 -3.815 -1.585 1.00 . A A . 28 CYS O 1 1 18 8072 1 1 28 CYS SG S -5.536 -5.513 0.711 1.00 . A A . 28 CYS SG 1 1 18 8073 1 1 29 GLY C C -9.536 -2.004 -2.108 1.00 . A A . 29 GLY C 1 1 18 8074 1 1 29 GLY CA C -8.213 -1.434 -2.613 1.00 . A A . 29 GLY CA 1 1 18 8075 1 1 29 GLY H H -6.839 -0.755 -1.127 1.00 . A A . 29 GLY H 1 1 18 8076 1 1 29 GLY HA2 H -8.348 -0.377 -2.842 1.00 . A A . 29 GLY HA2 1 1 18 8077 1 1 29 GLY HA3 H -7.927 -1.962 -3.525 1.00 . A A . 29 GLY HA3 1 1 18 8078 1 1 29 GLY N N -7.162 -1.588 -1.607 1.00 . A A . 29 GLY N 1 1 18 8079 1 1 29 GLY O O -10.246 -2.688 -2.848 1.00 . A A . 29 GLY O 1 1 18 8080 1 1 30 ARG C C -10.736 -3.970 0.135 1.00 . A A . 30 ARG C 1 1 18 8081 1 1 30 ARG CA C -10.894 -2.448 -0.040 1.00 . A A . 30 ARG CA 1 1 18 8082 1 1 30 ARG CB C -12.266 -1.970 -0.581 1.00 . A A . 30 ARG CB 1 1 18 8083 1 1 30 ARG CD C -13.485 -4.189 -1.293 1.00 . A A . 30 ARG CD 1 1 18 8084 1 1 30 ARG CG C -13.485 -2.902 -0.443 1.00 . A A . 30 ARG CG 1 1 18 8085 1 1 30 ARG CZ C -12.102 -5.196 -3.121 1.00 . A A . 30 ARG CZ 1 1 18 8086 1 1 30 ARG H H -9.171 -1.168 -0.342 1.00 . A A . 30 ARG H 1 1 18 8087 1 1 30 ARG HA H -10.836 -2.085 0.984 1.00 . A A . 30 ARG HA 1 1 18 8088 1 1 30 ARG HB2 H -12.490 -1.121 -0.103 1.00 . A A . 30 ARG HB2 1 1 18 8089 1 1 30 ARG HB3 H -12.148 -1.783 -1.556 1.00 . A A . 30 ARG HB3 1 1 18 8090 1 1 30 ARG HD2 H -13.307 -4.967 -0.691 1.00 . A A . 30 ARG HD2 1 1 18 8091 1 1 30 ARG HD3 H -14.387 -4.292 -1.713 1.00 . A A . 30 ARG HD3 1 1 18 8092 1 1 30 ARG HE H -11.871 -3.370 -2.457 1.00 . A A . 30 ARG HE 1 1 18 8093 1 1 30 ARG HG2 H -13.548 -3.175 0.517 1.00 . A A . 30 ARG HG2 1 1 18 8094 1 1 30 ARG HG3 H -14.297 -2.375 -0.694 1.00 . A A . 30 ARG HG3 1 1 18 8095 1 1 30 ARG HH11 H -13.571 -6.442 -2.552 1.00 . A A . 30 ARG HH11 1 1 18 8096 1 1 30 ARG HH12 H -12.461 -7.080 -3.718 1.00 . A A . 30 ARG HH12 1 1 18 8097 1 1 30 ARG HH21 H -10.523 -4.209 -3.866 1.00 . A A . 30 ARG HH21 1 1 18 8098 1 1 30 ARG HH22 H -10.743 -5.821 -4.458 1.00 . A A . 30 ARG HH22 1 1 18 8099 1 1 30 ARG N N -9.809 -1.808 -0.811 1.00 . A A . 30 ARG N 1 1 18 8100 1 1 30 ARG NE N -12.470 -4.181 -2.360 1.00 . A A . 30 ARG NE 1 1 18 8101 1 1 30 ARG NH1 N -12.764 -6.329 -3.131 1.00 . A A . 30 ARG NH1 1 1 18 8102 1 1 30 ARG NH2 N -11.039 -5.065 -3.874 1.00 . A A . 30 ARG NH2 1 1 18 8103 1 1 30 ARG O O -11.495 -4.574 0.880 1.00 . A A . 30 ARG O 1 1 18 8104 1 1 31 NH2 HN1 H -9.661 -5.603 -0.284 1.00 . A A . 31 NH2 HN1 1 1 18 8105 1 1 31 NH2 HN2 H -9.050 -4.143 -1.033 1.00 . A A . 31 NH2 HN2 1 1 18 8106 1 1 31 NH2 N N -9.742 -4.616 -0.464 1.00 . A A . 31 NH2 N 1 1 18 8107 2 2 1 NAG C1 C -6.448 12.703 -3.953 1.00 . B A . 32 NAG C1 1 1 18 8108 2 2 1 NAG C2 C -5.760 11.350 -3.891 1.00 . B A . 32 NAG C2 1 1 18 8109 2 2 1 NAG C3 C -4.962 11.263 -2.574 1.00 . B A . 32 NAG C3 1 1 18 8110 2 2 1 NAG C4 C -4.116 12.523 -2.278 1.00 . B A . 32 NAG C4 1 1 18 8111 2 2 1 NAG C5 C -4.983 13.773 -2.477 1.00 . B A . 32 NAG C5 1 1 18 8112 2 2 1 NAG C6 C -4.200 15.083 -2.266 1.00 . B A . 32 NAG C6 1 1 18 8113 2 2 1 NAG C7 C -6.803 8.998 -3.842 1.00 . B A . 32 NAG C7 1 1 18 8114 2 2 1 NAG C8 C -8.039 8.276 -4.277 1.00 . B A . 32 NAG C8 1 1 18 8115 2 2 1 NAG H1 H -7.258 12.772 -3.223 1.00 . B A . 32 NAG H1 1 1 18 8116 2 2 1 NAG H2 H -5.034 11.339 -4.707 1.00 . B A . 32 NAG H2 1 1 18 8117 2 2 1 NAG H3 H -5.645 11.074 -1.745 1.00 . B A . 32 NAG H3 1 1 18 8118 2 2 1 NAG H4 H -3.288 12.547 -2.990 1.00 . B A . 32 NAG H4 1 1 18 8119 2 2 1 NAG H5 H -5.806 13.762 -1.759 1.00 . B A . 32 NAG H5 1 1 18 8120 2 2 1 NAG H61 H -4.737 15.889 -2.765 1.00 . B A . 32 NAG H61 1 1 18 8121 2 2 1 NAG H62 H -3.204 15.009 -2.702 1.00 . B A . 32 NAG H62 1 1 18 8122 2 2 1 NAG H81 H -7.875 7.208 -4.169 1.00 . B A . 32 NAG H81 1 1 18 8123 2 2 1 NAG H82 H -8.873 8.592 -3.654 1.00 . B A . 32 NAG H82 1 1 18 8124 2 2 1 NAG H83 H -8.239 8.505 -5.323 1.00 . B A . 32 NAG H83 1 1 18 8125 2 2 1 NAG HN2 H -7.622 10.617 -4.579 1.00 . B A . 32 NAG HN2 1 1 18 8126 2 2 1 NAG HO1 H -6.719 13.789 -5.438 1.00 . B A . 32 NAG HO1 1 1 18 8127 2 2 1 NAG HO3 H -4.623 9.391 -2.730 1.00 . B A . 32 NAG HO3 1 1 18 8128 2 2 1 NAG HO4 H 1.028 8.753 7.611 1.00 . B A . 32 NAG HO4 1 1 18 8129 2 2 1 NAG HO6 H -3.314 15.038 -0.515 1.00 . B A . 32 NAG HO6 1 1 18 8130 2 2 1 NAG N2 N -6.792 10.301 -4.095 1.00 . B A . 32 NAG N2 1 1 18 8131 2 2 1 NAG O1 O -6.953 12.885 -5.213 1.00 . B A . 32 NAG O1 1 1 18 8132 2 2 1 NAG O3 O -4.078 10.181 -2.751 1.00 . B A . 32 NAG O3 1 1 18 8133 2 2 1 NAG O4 O -3.543 12.554 -0.947 1.00 . B A . 32 NAG O4 1 1 18 8134 2 2 1 NAG O5 O -5.516 13.748 -3.789 1.00 . B A . 32 NAG O5 1 1 18 8135 2 2 1 NAG O6 O -4.113 15.441 -0.899 1.00 . B A . 32 NAG O6 1 1 18 8136 2 2 1 NAG O7 O -5.884 8.369 -3.311 1.00 . B A . 32 NAG O7 1 1 stop_ save_
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