NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
622634 | 5wye | 36044 | cing | 4-filtered-FRED | STAR | entry | full | 147 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5wye # This FRED archive file contains, for PDB entry <5wye>: # # - 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, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. 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.PDB_coordinate_file_version . _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_5wye _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 5wye _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all free" _Assembly.Molecular_mass 1747.14 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 $Au_VG16KRKP A . 1 1 stop_ save_ save_Au_VG16KRKP _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Au VG16KRKP" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code VARGWKRKCPLFGKGG _Entity.Number_of_monomers 16 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 ALA . 1 1 3 ARG . 1 1 4 GLY . 1 1 5 TRP . 1 1 6 LYS . 1 1 7 ARG . 1 1 8 LYS . 1 1 9 CYS . 1 1 10 PRO . 1 1 11 LEU . 1 1 12 PHE . 1 1 13 GLY . 1 1 14 LYS . 1 1 15 GLY . 1 1 16 GLY . 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 ALA 2 2 1 1 ARG 3 3 1 1 GLY 4 4 1 1 TRP 5 5 1 1 LYS 6 6 1 1 ARG 7 7 1 1 LYS 8 8 1 1 CYS 9 9 1 1 PRO 10 10 1 1 LEU 11 11 1 1 PHE 12 12 1 1 GLY 13 13 1 1 LYS 14 14 1 1 GLY 15 15 1 1 GLY 16 16 1 1 stop_ 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 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 ALA H . 2 ALA H 1 1 2 1 1 1 1 1 VAL HB . 1 VAL HB 1 1 2 1 2 1 1 2 ALA H . 2 ALA H 1 1 3 1 1 1 1 1 VAL QG . 1 VAL QQG 1 1 3 1 2 1 1 5 TRP HD1 . 5 TRP HD1 1 1 4 1 1 1 1 1 VAL QG . 1 VAL QQG 1 1 4 1 2 1 1 5 TRP HE1 . 5 TRP HE1 1 1 5 1 1 1 1 1 VAL QG . 1 VAL QQG 1 1 5 1 2 1 1 5 TRP HE3 . 5 TRP HE3 1 1 6 1 1 1 1 1 VAL QG . 1 VAL QQG 1 1 6 1 2 1 1 5 TRP HZ2 . 5 TRP HZ2 1 1 7 1 1 1 1 1 VAL QG . 1 VAL QQG 1 1 7 1 2 1 1 5 TRP HZ3 . 5 TRP HZ3 1 1 8 1 1 1 1 1 VAL QG . 1 VAL QQG 1 1 8 1 2 1 1 12 PHE QE . 12 PHE QE 1 1 9 1 1 1 1 1 VAL QG . 1 VAL QQG 1 1 9 1 2 1 1 12 PHE HZ . 12 PHE HZ 1 1 10 1 1 1 1 2 ALA H . 2 ALA H 1 1 10 1 2 1 1 2 ALA MB . 2 ALA HB 1 1 11 1 1 1 1 2 ALA H . 2 ALA H 1 1 11 1 2 1 1 3 ARG H . 3 ARG H 1 1 12 1 1 1 1 2 ALA HA . 2 ALA HA 1 1 12 1 2 1 1 3 ARG H . 3 ARG H 1 1 13 1 1 1 1 2 ALA HA . 2 ALA HA 1 1 13 1 2 1 1 5 TRP HD1 . 5 TRP HD1 1 1 14 1 1 1 1 2 ALA HA . 2 ALA HA 1 1 14 1 2 1 1 5 TRP HZ2 . 5 TRP HZ2 1 1 15 1 1 1 1 2 ALA MB . 2 ALA HB 1 1 15 1 2 1 1 4 GLY H . 4 GLY H 1 1 16 1 1 1 1 2 ALA MB . 2 ALA QB 1 1 16 1 2 1 1 5 TRP HD1 . 5 TRP HD1 1 1 17 1 1 1 1 2 ALA MB . 2 ALA HB 1 1 17 1 2 1 1 5 TRP HE3 . 5 TRP HE3 1 1 18 1 1 1 1 2 ALA MB . 2 ALA QB 1 1 18 1 2 1 1 5 TRP HZ2 . 5 TRP HZ2 1 1 19 1 1 1 1 2 ALA MB . 2 ALA HB 1 1 19 1 2 1 1 12 PHE QD . 12 PHE QD 1 1 20 1 1 1 1 2 ALA MB . 2 ALA HB 1 1 20 1 2 1 1 12 PHE QE . 12 PHE QE 1 1 21 1 1 1 1 3 ARG H . 3 ARG H 1 1 21 1 2 1 1 3 ARG HB2 . 3 ARG HB2 1 1 22 1 1 1 1 3 ARG H . 3 ARG H 1 1 22 1 2 1 1 3 ARG HB3 . 3 ARG HB3 1 1 23 1 1 1 1 3 ARG H . 3 ARG H 1 1 23 1 2 1 1 3 ARG QD . 3 ARG QD 1 1 24 1 1 1 1 3 ARG H . 3 ARG H 1 1 24 1 2 1 1 3 ARG QG . 3 ARG QG 1 1 25 1 1 1 1 3 ARG H . 3 ARG H 1 1 25 1 2 1 1 4 GLY H . 4 GLY H 1 1 26 1 1 1 1 3 ARG HA . 3 ARG HA 1 1 26 1 2 1 1 4 GLY H . 4 GLY H 1 1 27 1 1 1 1 3 ARG HB3 . 3 ARG HB3 1 1 27 1 2 1 1 4 GLY H . 4 GLY H 1 1 28 1 1 1 1 3 ARG QD . 3 ARG QD 1 1 28 1 2 1 1 4 GLY H . 4 GLY H 1 1 29 1 1 1 1 3 ARG QG . 3 ARG HG 1 1 29 1 2 1 1 5 TRP H . 5 TRP H 1 1 30 1 1 1 1 4 GLY QA . 4 GLY HA 1 1 30 1 2 1 1 5 TRP H . 5 TRP H 1 1 31 1 1 1 1 4 GLY QA . 4 GLY HA 1 1 31 1 2 1 1 5 TRP HD1 . 5 TRP HD1 1 1 32 1 1 1 1 4 GLY QA . 4 GLY HA 1 1 32 1 2 1 1 5 TRP HE3 . 5 TRP HE3 1 1 33 1 1 1 1 5 TRP H . 5 TRP H 1 1 33 1 2 1 1 5 TRP QB . 5 TRP QB 1 1 34 1 1 1 1 5 TRP H . 5 TRP H 1 1 34 1 2 1 1 16 GLY QA . 16 GLY HA 1 1 35 1 1 1 1 5 TRP HA . 5 TRP HA 1 1 35 1 2 1 1 5 TRP HD1 . 5 TRP HD1 1 1 36 1 1 1 1 5 TRP HA . 5 TRP HA 1 1 36 1 2 1 1 6 LYS H . 6 LYS H 1 1 37 1 1 1 1 5 TRP QB . 5 TRP QB 1 1 37 1 2 1 1 5 TRP HE1 . 5 TRP HE1 1 1 38 1 1 1 1 5 TRP QB . 5 TRP QB 1 1 38 1 2 1 1 5 TRP HE3 . 5 TRP HE3 1 1 39 1 1 1 1 5 TRP QB . 5 TRP QB 1 1 39 1 2 1 1 6 LYS H . 6 LYS H 1 1 40 1 1 1 1 5 TRP HD1 . 5 TRP HD1 1 1 40 1 2 1 1 6 LYS HA . 6 LYS HA 1 1 41 1 1 1 1 5 TRP HE1 . 5 TRP HE1 1 1 41 1 2 1 1 11 LEU QD . 11 LEU QQD 1 1 42 1 1 1 1 5 TRP HE1 . 5 TRP HE1 1 1 42 1 2 1 1 12 PHE QE . 12 PHE QE 1 1 43 1 1 1 1 5 TRP HE3 . 5 TRP HE3 1 1 43 1 2 1 1 6 LYS HA . 6 LYS HA 1 1 44 1 1 1 1 5 TRP HE3 . 5 TRP HE3 1 1 44 1 2 1 1 9 CYS QB . 9 CYS QB 1 1 45 1 1 1 1 5 TRP HE3 . 5 TRP HE3 1 1 45 1 2 1 1 10 PRO QD . 10 PRO QD 1 1 46 1 1 1 1 5 TRP HE3 . 5 TRP HE3 1 1 46 1 2 1 1 10 PRO QG . 10 PRO QG 1 1 47 1 1 1 1 5 TRP HE3 . 5 TRP HE3 1 1 47 1 2 1 1 11 LEU QD . 11 LEU QQD 1 1 48 1 1 1 1 5 TRP HE3 . 5 TRP HE3 1 1 48 1 2 1 1 12 PHE HA . 12 PHE HA 1 1 49 1 1 1 1 5 TRP HE3 . 5 TRP HE3 1 1 49 1 2 1 1 13 GLY QA . 13 GLY HA 1 1 50 1 1 1 1 5 TRP HH2 . 5 TRP HH2 1 1 50 1 2 1 1 11 LEU H . 11 LEU H 1 1 51 1 1 1 1 5 TRP HH2 . 5 TRP HH2 1 1 51 1 2 1 1 11 LEU QD . 11 LEU QQD 1 1 52 1 1 1 1 5 TRP HH2 . 5 TRP HH2 1 1 52 1 2 1 1 12 PHE HA . 12 PHE HA 1 1 53 1 1 1 1 5 TRP HH2 . 5 TRP HH2 1 1 53 1 2 1 1 13 GLY QA . 13 GLY HA 1 1 54 1 1 1 1 5 TRP HZ2 . 5 TRP HZ2 1 1 54 1 2 1 1 11 LEU QD . 11 LEU QQD 1 1 55 1 1 1 1 5 TRP HZ2 . 5 TRP HZ2 1 1 55 1 2 1 1 11 LEU HG . 11 LEU QG 1 1 56 1 1 1 1 5 TRP HZ2 . 5 TRP HZ2 1 1 56 1 2 1 1 12 PHE QB . 12 PHE QB 1 1 57 1 1 1 1 5 TRP HZ2 . 5 TRP HZ2 1 1 57 1 2 1 1 12 PHE QE . 12 PHE QE 1 1 58 1 1 1 1 5 TRP HZ3 . 5 TRP HZ3 1 1 58 1 2 1 1 9 CYS QB . 9 CYS QB 1 1 59 1 1 1 1 5 TRP HZ3 . 5 TRP HZ3 1 1 59 1 2 1 1 10 PRO QD . 10 PRO QD 1 1 60 1 1 1 1 5 TRP HZ3 . 5 TRP HZ3 1 1 60 1 2 1 1 11 LEU QD . 11 LEU QQD 1 1 61 1 1 1 1 5 TRP HZ3 . 5 TRP HZ3 1 1 61 1 2 1 1 11 LEU HG . 11 LEU QG 1 1 62 1 1 1 1 5 TRP HZ3 . 5 TRP HZ3 1 1 62 1 2 1 1 12 PHE HA . 12 PHE HA 1 1 63 1 1 1 1 5 TRP HZ3 . 5 TRP HZ3 1 1 63 1 2 1 1 12 PHE QB . 12 PHE QB 1 1 64 1 1 1 1 5 TRP HZ3 . 5 TRP HZ3 1 1 64 1 2 1 1 12 PHE HD1 . 12 PHE HD1 1 1 65 1 1 1 1 5 TRP HZ3 . 5 TRP HZ3 1 1 65 1 2 1 1 13 GLY QA . 13 GLY HA 1 1 66 1 1 1 1 6 LYS H . 6 LYS H 1 1 66 1 2 1 1 6 LYS QB . 6 LYS QB 1 1 67 1 1 1 1 6 LYS H . 6 LYS H 1 1 67 1 2 1 1 6 LYS QD . 6 LYS QD 1 1 68 1 1 1 1 6 LYS H . 6 LYS H 1 1 68 1 2 1 1 6 LYS QG . 6 LYS QG 1 1 69 1 1 1 1 6 LYS HA . 6 LYS HA 1 1 69 1 2 1 1 7 ARG H . 7 ARG H 1 1 70 1 1 1 1 6 LYS QG . 6 LYS QG 1 1 70 1 2 1 1 8 LYS H . 8 LYS H 1 1 71 1 1 1 1 7 ARG H . 7 ARG H 1 1 71 1 2 1 1 7 ARG QB . 7 ARG QB 1 1 72 1 1 1 1 7 ARG H . 7 ARG H 1 1 72 1 2 1 1 7 ARG QD . 7 ARG QD 1 1 73 1 1 1 1 7 ARG H . 7 ARG H 1 1 73 1 2 1 1 7 ARG QG . 7 ARG QG 1 1 74 1 1 1 1 7 ARG HA . 7 ARG HA 1 1 74 1 2 1 1 8 LYS H . 8 LYS H 1 1 75 1 1 1 1 8 LYS H . 8 LYS H 1 1 75 1 2 1 1 8 LYS QB . 8 LYS QB 1 1 76 1 1 1 1 8 LYS H . 8 LYS H 1 1 76 1 2 1 1 8 LYS QE . 8 LYS QE 1 1 77 1 1 1 1 8 LYS H . 8 LYS H 1 1 77 1 2 1 1 8 LYS QG . 8 LYS QG 1 1 78 1 1 1 1 8 LYS HA . 8 LYS HA 1 1 78 1 2 1 1 9 CYS H . 9 CYS H 1 1 79 1 1 1 1 8 LYS QB . 8 LYS QB 1 1 79 1 2 1 1 9 CYS H . 9 CYS H 1 1 80 1 1 1 1 8 LYS QE . 8 LYS QE 1 1 80 1 2 1 1 9 CYS H . 9 CYS H 1 1 81 1 1 1 1 9 CYS H . 9 CYS H 1 1 81 1 2 1 1 9 CYS QB . 9 CYS QB 1 1 82 1 1 1 1 10 PRO QB . 10 PRO QB 1 1 82 1 2 1 1 11 LEU H . 11 LEU H 1 1 83 1 1 1 1 10 PRO QD . 10 PRO QD 1 1 83 1 2 1 1 11 LEU H . 11 LEU H 1 1 84 1 1 1 1 11 LEU H . 11 LEU H 1 1 84 1 2 1 1 11 LEU QB . 11 LEU QB 1 1 85 1 1 1 1 11 LEU H . 11 LEU H 1 1 85 1 2 1 1 11 LEU QD . 11 LEU QQD 1 1 86 1 1 1 1 11 LEU H . 11 LEU H 1 1 86 1 2 1 1 11 LEU HG . 11 LEU QG 1 1 87 1 1 1 1 11 LEU HA . 11 LEU HA 1 1 87 1 2 1 1 12 PHE H . 12 PHE H 1 1 88 1 1 1 1 11 LEU QB . 11 LEU QB 1 1 88 1 2 1 1 12 PHE H . 12 PHE H 1 1 89 1 1 1 1 11 LEU QB . 11 LEU QB 1 1 89 1 2 1 1 12 PHE QD . 12 PHE QD 1 1 90 1 1 1 1 11 LEU QB . 11 LEU QB 1 1 90 1 2 1 1 12 PHE QE . 12 PHE QE 1 1 91 1 1 1 1 11 LEU QB . 11 LEU QB 1 1 91 1 2 1 1 12 PHE HZ . 12 PHE HZ 1 1 92 1 1 1 1 11 LEU QB . 11 LEU QB 1 1 92 1 2 1 1 13 GLY H . 13 GLY H 1 1 93 1 1 1 1 11 LEU QD . 11 LEU QQD 1 1 93 1 2 1 1 12 PHE H . 12 PHE H 1 1 94 1 1 1 1 11 LEU QD . 11 LEU QQD 1 1 94 1 2 1 1 12 PHE QD . 12 PHE QD 1 1 95 1 1 1 1 11 LEU QD . 11 LEU QQD 1 1 95 1 2 1 1 12 PHE QE . 12 PHE QE 1 1 96 1 1 1 1 11 LEU QD . 11 LEU QQD 1 1 96 1 2 1 1 12 PHE HZ . 12 PHE HZ 1 1 97 1 1 1 1 11 LEU HG . 11 LEU QG 1 1 97 1 2 1 1 12 PHE HD1 . 12 PHE HD1 1 1 98 1 1 1 1 11 LEU HG . 11 LEU QG 1 1 98 1 2 1 1 12 PHE HZ . 12 PHE HZ 1 1 99 1 1 1 1 12 PHE H . 12 PHE H 1 1 99 1 2 1 1 12 PHE QB . 12 PHE QB 1 1 100 1 1 1 1 12 PHE H . 12 PHE H 1 1 100 1 2 1 1 13 GLY H . 13 GLY H 1 1 101 1 1 1 1 12 PHE H . 12 PHE H 1 1 101 1 2 1 1 16 GLY QA . 16 GLY HA 1 1 102 1 1 1 1 12 PHE HA . 12 PHE HA 1 1 102 1 2 1 1 12 PHE QD . 12 PHE QD 1 1 103 1 1 1 1 12 PHE HA . 12 PHE HA 1 1 103 1 2 1 1 13 GLY H . 13 GLY H 1 1 104 1 1 1 1 12 PHE QB . 12 PHE QB 1 1 104 1 2 1 1 12 PHE QE . 12 PHE QE 1 1 105 1 1 1 1 12 PHE QB . 12 PHE QB 1 1 105 1 2 1 1 13 GLY H . 13 GLY H 1 1 106 1 1 1 1 12 PHE QD . 12 PHE QD 1 1 106 1 2 1 1 16 GLY QA . 16 GLY QA 1 1 107 1 1 1 1 12 PHE QE . 12 PHE QE 1 1 107 1 2 1 1 16 GLY QA . 16 GLY QA 1 1 108 1 1 1 1 13 GLY H . 13 GLY H 1 1 108 1 2 1 1 14 LYS H . 14 LYS H 1 1 109 1 1 1 1 13 GLY QA . 13 GLY HA 1 1 109 1 2 1 1 14 LYS H . 14 LYS H 1 1 110 1 1 1 1 14 LYS H . 14 LYS H 1 1 110 1 2 1 1 14 LYS QB . 14 LYS QB 1 1 111 1 1 1 1 14 LYS H . 14 LYS H 1 1 111 1 2 1 1 14 LYS QD . 14 LYS QD 1 1 112 1 1 1 1 14 LYS H . 14 LYS H 1 1 112 1 2 1 1 14 LYS QE . 14 LYS QE 1 1 113 1 1 1 1 14 LYS H . 14 LYS H 1 1 113 1 2 1 1 14 LYS QG . 14 LYS QG 1 1 114 1 1 1 1 14 LYS H . 14 LYS H 1 1 114 1 2 1 1 15 GLY H . 15 GLY H 1 1 115 1 1 1 1 14 LYS H . 14 LYS H 1 1 115 1 2 1 1 16 GLY QA . 16 GLY QA 1 1 116 1 1 1 1 14 LYS HA . 14 LYS HA 1 1 116 1 2 1 1 15 GLY H . 15 GLY H 1 1 117 1 1 1 1 14 LYS QB . 14 LYS QB 1 1 117 1 2 1 1 15 GLY H . 15 GLY H 1 1 118 1 1 1 1 14 LYS QD . 14 LYS QD 1 1 118 1 2 1 1 15 GLY H . 15 GLY H 1 1 119 1 1 1 1 14 LYS QG . 14 LYS QG 1 1 119 1 2 1 1 15 GLY H . 15 GLY H 1 1 120 1 1 1 1 15 GLY H . 15 GLY H 1 1 120 1 2 1 1 16 GLY H . 16 GLY H 1 1 121 1 1 1 1 15 GLY QA . 15 GLY HA 1 1 121 1 2 1 1 16 GLY H . 16 GLY H 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 3.7 1 1 2 1 . . . . . . . 4.0 1 1 3 1 . . . . . . . 4.8 1 1 4 1 . . . . . . . 4.5 1 1 5 1 . . . . . . . 5.2 1 1 6 1 . . . . . . . 4.5 1 1 7 1 . . . . . . . 5.2 1 1 8 1 . . . . . . . 5.3 1 1 9 1 . . . . . . . 5.3 1 1 10 1 . . . . . . . 3.5 1 1 11 1 . . . . . . . 4.5 1 1 12 1 . . . . . . . 3.8 1 1 13 1 . . . . . . . 5.2 1 1 14 1 . . . . . . . 5.0 1 1 15 1 . . . . . . . 3.5 1 1 16 1 . . . . . . . 4.3 1 1 17 1 . . . . . . . 4.8 1 1 18 1 . . . . . . . 4.5 1 1 19 1 . . . . . . . 4.5 1 1 20 1 . . . . . . . 4.2 1 1 21 1 . . . . . . . 3.8 1 1 22 1 . . . . . . . 3.5 1 1 23 1 . . . . . . . 3.5 1 1 24 1 . . . . . . . 3.5 1 1 25 1 . . . . . . . 3.5 1 1 26 1 . . . . . . . 3.5 1 1 27 1 . . . . . . . 3.8 1 1 28 1 . . . . . . . 4.5 1 1 29 1 . . . . . . . 5.3 1 1 30 1 . . . . . . . 3.5 1 1 31 1 . . . . . . . 5.3 1 1 32 1 . . . . . . . 5.3 1 1 33 1 . . . . . . . 3.5 1 1 34 1 . . . . . . . 5.3 1 1 35 1 . . . . . . . 4.5 1 1 36 1 . . . . . . . 3.5 1 1 37 1 . . . . . . . 4.3 1 1 38 1 . . . . . . . 3.5 1 1 39 1 . . . . . . . 3.8 1 1 40 1 . . . . . . . 5.3 1 1 41 1 . . . . . . . 5.0 1 1 42 1 . . . . . . . 5.3 1 1 43 1 . . . . . . . 5.3 1 1 44 1 . . . . . . . 4.5 1 1 45 1 . . . . . . . 5.3 1 1 46 1 . . . . . . . 5.0 1 1 47 1 . . . . . . . 5.0 1 1 48 1 . . . . . . . 5.3 1 1 49 1 . . . . . . . 3.8 1 1 50 1 . . . . . . . 4.2 1 1 51 1 . . . . . . . 4.8 1 1 52 1 . . . . . . . 4.8 1 1 53 1 . . . . . . . 4.8 1 1 54 1 . . . . . . . 3.8 1 1 55 1 . . . . . . . 4.4 1 1 56 1 . . . . . . . 5.3 1 1 57 1 . . . . . . . 3.5 1 1 58 1 . . . . . . . 4.7 1 1 59 1 . . . . . . . 5.3 1 1 60 1 . . . . . . . 4.3 1 1 61 1 . . . . . . . 4.2 1 1 62 1 . . . . . . . 4.5 1 1 63 1 . . . . . . . 5.3 1 1 64 1 . . . . . . . 4.5 1 1 65 1 . . . . . . . 4.2 1 1 66 1 . . . . . . . 3.8 1 1 67 1 . . . . . . . 3.8 1 1 68 1 . . . . . . . 3.8 1 1 69 1 . . . . . . . 4.5 1 1 70 1 . . . . . . . 5.3 1 1 71 1 . . . . . . . 3.8 1 1 72 1 . . . . . . . 4.2 1 1 73 1 . . . . . . . 4.2 1 1 74 1 . . . . . . . 3.5 1 1 75 1 . . . . . . . 3.8 1 1 76 1 . . . . . . . 4.5 1 1 77 1 . . . . . . . 3.8 1 1 78 1 . . . . . . . 3.5 1 1 79 1 . . . . . . . 3.8 1 1 80 1 . . . . . . . 5.0 1 1 81 1 . . . . . . . 3.8 1 1 82 1 . . . . . . . 3.7 1 1 83 1 . . . . . . . 4.0 1 1 84 1 . . . . . . . 3.5 1 1 85 1 . . . . . . . 3.8 1 1 86 1 . . . . . . . 3.8 1 1 87 1 . . . . . . . 3.5 1 1 88 1 . . . . . . . 3.8 1 1 89 1 . . . . . . . 4.2 1 1 90 1 . . . . . . . 4.0 1 1 91 1 . . . . . . . 4.7 1 1 92 1 . . . . . . . 5.3 1 1 93 1 . . . . . . . 4.0 1 1 94 1 . . . . . . . 4.0 1 1 95 1 . . . . . . . 3.5 1 1 96 1 . . . . . . . 3.8 1 1 97 1 . . . . . . . 5.0 1 1 98 1 . . . . . . . 5.0 1 1 99 1 . . . . . . . 3.8 1 1 100 1 . . . . . . . 4.2 1 1 101 1 . . . . . . . 5.3 1 1 102 1 . . . . . . . 3.5 1 1 103 1 . . . . . . . 3.5 1 1 104 1 . . . . . . . 3.9 1 1 105 1 . . . . . . . 3.8 1 1 106 1 . . . . . . . 4.5 1 1 107 1 . . . . . . . 4.8 1 1 108 1 . . . . . . . 3.5 1 1 109 1 . . . . . . . 3.5 1 1 110 1 . . . . . . . 3.8 1 1 111 1 . . . . . . . 4.0 1 1 112 1 . . . . . . . 3.8 1 1 113 1 . . . . . . . 3.8 1 1 114 1 . . . . . . . 3.5 1 1 115 1 . . . . . . . 5.0 1 1 116 1 . . . . . . . 3.5 1 1 117 1 . . . . . . . 3.8 1 1 118 1 . . . . . . . 4.0 1 1 119 1 . . . . . . . 4.0 1 1 120 1 . . . . . . . 3.5 1 1 121 1 . . . . . . . 3.5 1 1 stop_ save_ save_DYANA/DIANA_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 PHI 1 1 1 VAL C 1 1 2 ALA N 1 1 2 ALA CA 1 1 2 ALA C -120.0 -30.0 . 2 ALA . . 2 ALA . . 2 ALA . . 2 ALA . 1 1 2 PSI 1 1 2 ALA N 1 1 2 ALA CA 1 1 2 ALA C 1 1 3 ARG N -120.0 120.0 . 2 ALA . . 2 ALA . . 2 ALA . . 2 ALA . 1 1 3 PHI 1 1 2 ALA C 1 1 3 ARG N 1 1 3 ARG CA 1 1 3 ARG C -120.0 -30.0 . 3 ARG . . 3 ARG . . 3 ARG . . 3 ARG . 1 1 4 PSI 1 1 3 ARG N 1 1 3 ARG CA 1 1 3 ARG C 1 1 4 GLY N -120.0 120.0 . 3 ARG . . 3 ARG . . 3 ARG . . 3 ARG . 1 1 5 PHI 1 1 3 ARG C 1 1 4 GLY N 1 1 4 GLY CA 1 1 4 GLY C -120.0 -30.0 . 4 GLY . . 4 GLY . . 4 GLY . . 4 GLY . 1 1 6 PSI 1 1 4 GLY N 1 1 4 GLY CA 1 1 4 GLY C 1 1 5 TRP N -120.0 120.0 . 4 GLY . . 4 GLY . . 4 GLY . . 4 GLY . 1 1 7 PHI 1 1 4 GLY C 1 1 5 TRP N 1 1 5 TRP CA 1 1 5 TRP C -120.0 -30.0 . 5 TRP . . 5 TRP . . 5 TRP . . 5 TRP . 1 1 8 PSI 1 1 5 TRP N 1 1 5 TRP CA 1 1 5 TRP C 1 1 6 LYS N -120.0 120.0 . 5 TRP . . 5 TRP . . 5 TRP . . 5 TRP . 1 1 9 PHI 1 1 5 TRP C 1 1 6 LYS N 1 1 6 LYS CA 1 1 6 LYS C -120.0 -30.0 . 6 LYS . . 6 LYS . . 6 LYS . . 6 LYS . 1 1 10 PSI 1 1 6 LYS N 1 1 6 LYS CA 1 1 6 LYS C 1 1 7 ARG N -120.0 120.0 . 6 LYS . . 6 LYS . . 6 LYS . . 6 LYS . 1 1 11 PHI 1 1 6 LYS C 1 1 7 ARG N 1 1 7 ARG CA 1 1 7 ARG C -120.0 -30.0 . 7 ARG . . 7 ARG . . 7 ARG . . 7 ARG . 1 1 12 PSI 1 1 7 ARG N 1 1 7 ARG CA 1 1 7 ARG C 1 1 8 LYS N -120.0 120.0 . 7 ARG . . 7 ARG . . 7 ARG . . 7 ARG . 1 1 13 PHI 1 1 7 ARG C 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS C -120.0 -30.0 . 8 LYS . . 8 LYS . . 8 LYS . . 8 LYS . 1 1 14 PSI 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS C 1 1 9 CYS N -120.0 120.0 . 8 LYS . . 8 LYS . . 8 LYS . . 8 LYS . 1 1 15 PHI 1 1 8 LYS C 1 1 9 CYS N 1 1 9 CYS CA 1 1 9 CYS C -120.0 -30.0 . 9 CYS . . 9 CYS . . 9 CYS . . 9 CYS . 1 1 16 PSI 1 1 9 CYS N 1 1 9 CYS CA 1 1 9 CYS C 1 1 10 PRO N -120.0 120.0 . 9 CYS . . 9 CYS . . 9 CYS . . 9 CYS . 1 1 17 PHI 1 1 10 PRO C 1 1 11 LEU N 1 1 11 LEU CA 1 1 11 LEU C -120.0 -30.0 . 11 LEU . . 11 LEU . . 11 LEU . . 11 LEU . 1 1 18 PSI 1 1 11 LEU N 1 1 11 LEU CA 1 1 11 LEU C 1 1 12 PHE N -120.0 120.0 . 11 LEU . . 11 LEU . . 11 LEU . . 11 LEU . 1 1 19 PHI 1 1 11 LEU C 1 1 12 PHE N 1 1 12 PHE CA 1 1 12 PHE C -120.0 -30.0 . 12 PHE . . 12 PHE . . 12 PHE . . 12 PHE . 1 1 20 PSI 1 1 12 PHE N 1 1 12 PHE CA 1 1 12 PHE C 1 1 13 GLY N -120.0 120.0 . 12 PHE . . 12 PHE . . 12 PHE . . 12 PHE . 1 1 21 PHI 1 1 12 PHE C 1 1 13 GLY N 1 1 13 GLY CA 1 1 13 GLY C -120.0 -30.0 . 13 GLY . . 13 GLY . . 13 GLY . . 13 GLY . 1 1 22 PSI 1 1 13 GLY N 1 1 13 GLY CA 1 1 13 GLY C 1 1 14 LYS N -120.0 120.0 . 13 GLY . . 13 GLY . . 13 GLY . . 13 GLY . 1 1 23 PHI 1 1 13 GLY C 1 1 14 LYS N 1 1 14 LYS CA 1 1 14 LYS C -120.0 -30.0 . 14 LYS . . 14 LYS . . 14 LYS . . 14 LYS . 1 1 24 PSI 1 1 14 LYS N 1 1 14 LYS CA 1 1 14 LYS C 1 1 15 GLY N -120.0 120.0 . 14 LYS . . 14 LYS . . 14 LYS . . 14 LYS . 1 1 25 PHI 1 1 14 LYS C 1 1 15 GLY N 1 1 15 GLY CA 1 1 15 GLY C -120.0 -30.0 . 15 GLY . . 15 GLY . . 15 GLY . . 15 GLY . 1 1 26 PSI 1 1 15 GLY N 1 1 15 GLY CA 1 1 15 GLY C 1 1 16 GLY N -120.0 120.0 . 15 GLY . . 15 GLY . . 15 GLY . . 15 GLY . 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 1.302 -0.647 -2.373 1.00 . A A . 1 VAL C 1 1 1 2 1 1 1 VAL CA C 2.094 -0.002 -1.242 1.00 . A A . 1 VAL CA 1 1 1 3 1 1 1 VAL CB C 3.431 -0.747 -1.076 1.00 . A A . 1 VAL CB 1 1 1 4 1 1 1 VAL CG1 C 3.194 -2.169 -0.591 1.00 . A A . 1 VAL CG1 1 1 1 5 1 1 1 VAL CG2 C 4.208 -0.744 -2.384 1.00 . A A . 1 VAL CG2 1 1 1 6 1 1 1 VAL H1 H 1.807 0.001 0.856 1.00 . A A . 1 VAL H1 1 1 1 7 1 1 1 VAL HA H 2.308 1.024 -1.504 1.00 . A A . 1 VAL HA 1 1 1 8 1 1 1 VAL HB H 4.019 -0.230 -0.331 1.00 . A A . 1 VAL HB 1 1 1 9 1 1 1 VAL HG11 H 2.682 -2.145 0.359 1.00 . A A . 1 VAL HG11 1 1 1 10 1 1 1 VAL HG12 H 2.590 -2.700 -1.313 1.00 . A A . 1 VAL HG12 1 1 1 11 1 1 1 VAL HG13 H 4.142 -2.673 -0.475 1.00 . A A . 1 VAL HG13 1 1 1 12 1 1 1 VAL HG21 H 5.258 -0.595 -2.177 1.00 . A A . 1 VAL HG21 1 1 1 13 1 1 1 VAL HG22 H 4.071 -1.690 -2.887 1.00 . A A . 1 VAL HG22 1 1 1 14 1 1 1 VAL HG23 H 3.848 0.055 -3.015 1.00 . A A . 1 VAL HG23 1 1 1 15 1 1 1 VAL N N 1.329 0.000 0.000 1.00 . A A . 1 VAL N 1 1 1 16 1 1 1 VAL O O 1.401 -0.233 -3.528 1.00 . A A . 1 VAL O 1 1 1 17 1 1 2 ALA C C -1.771 -2.345 -2.633 1.00 . A A . 2 ALA C 1 1 1 18 1 1 2 ALA CA C -0.296 -2.364 -3.021 1.00 . A A . 2 ALA CA 1 1 1 19 1 1 2 ALA CB C 0.191 -3.796 -3.183 1.00 . A A . 2 ALA CB 1 1 1 20 1 1 2 ALA H H 0.479 -1.946 -1.097 1.00 . A A . 2 ALA H 1 1 1 21 1 1 2 ALA HA H -0.177 -1.859 -3.970 1.00 . A A . 2 ALA HA 1 1 1 22 1 1 2 ALA HB1 H 1.237 -3.851 -2.921 1.00 . A A . 2 ALA HB1 1 1 1 23 1 1 2 ALA HB2 H -0.379 -4.445 -2.535 1.00 . A A . 2 ALA HB2 1 1 1 24 1 1 2 ALA HB3 H 0.059 -4.106 -4.209 1.00 . A A . 2 ALA HB3 1 1 1 25 1 1 2 ALA N N 0.515 -1.663 -2.034 1.00 . A A . 2 ALA N 1 1 1 26 1 1 2 ALA O O -2.149 -2.839 -1.571 1.00 . A A . 2 ALA O 1 1 1 27 1 1 3 ARG C C -4.604 -3.056 -2.897 1.00 . A A . 3 ARG C 1 1 1 28 1 1 3 ARG CA C -4.032 -1.686 -3.247 1.00 . A A . 3 ARG CA 1 1 1 29 1 1 3 ARG CB C -4.755 -1.116 -4.469 1.00 . A A . 3 ARG CB 1 1 1 30 1 1 3 ARG CD C -5.168 -1.484 -6.920 1.00 . A A . 3 ARG CD 1 1 1 31 1 1 3 ARG CG C -5.011 -2.144 -5.559 1.00 . A A . 3 ARG CG 1 1 1 32 1 1 3 ARG CZ C -4.106 -3.136 -8.398 1.00 . A A . 3 ARG CZ 1 1 1 33 1 1 3 ARG H H -2.237 -1.394 -4.330 1.00 . A A . 3 ARG H 1 1 1 34 1 1 3 ARG HA H -4.182 -1.021 -2.409 1.00 . A A . 3 ARG HA 1 1 1 35 1 1 3 ARG HB2 H -5.706 -0.712 -4.154 1.00 . A A . 3 ARG HB2 1 1 1 36 1 1 3 ARG HB3 H -4.156 -0.321 -4.887 1.00 . A A . 3 ARG HB3 1 1 1 37 1 1 3 ARG HD2 H -6.098 -0.935 -6.934 1.00 . A A . 3 ARG HD2 1 1 1 38 1 1 3 ARG HD3 H -4.345 -0.803 -7.072 1.00 . A A . 3 ARG HD3 1 1 1 39 1 1 3 ARG HE H -6.033 -2.625 -8.459 1.00 . A A . 3 ARG HE 1 1 1 40 1 1 3 ARG HG2 H -4.177 -2.829 -5.597 1.00 . A A . 3 ARG HG2 1 1 1 41 1 1 3 ARG HG3 H -5.915 -2.685 -5.324 1.00 . A A . 3 ARG HG3 1 1 1 42 1 1 3 ARG HH11 H -2.868 -2.281 -7.050 1.00 . A A . 3 ARG HH11 1 1 1 43 1 1 3 ARG HH12 H -2.131 -3.448 -8.098 1.00 . A A . 3 ARG HH12 1 1 1 44 1 1 3 ARG HH21 H -5.075 -4.163 -9.845 1.00 . A A . 3 ARG HH21 1 1 1 45 1 1 3 ARG HH22 H -3.387 -4.517 -9.688 1.00 . A A . 3 ARG HH22 1 1 1 46 1 1 3 ARG N N -2.599 -1.770 -3.500 1.00 . A A . 3 ARG N 1 1 1 47 1 1 3 ARG NE N -5.181 -2.463 -8.004 1.00 . A A . 3 ARG NE 1 1 1 48 1 1 3 ARG NH1 N -2.939 -2.938 -7.800 1.00 . A A . 3 ARG NH1 1 1 1 49 1 1 3 ARG NH2 N -4.197 -4.011 -9.392 1.00 . A A . 3 ARG NH2 1 1 1 50 1 1 3 ARG O O -5.569 -3.163 -2.141 1.00 . A A . 3 ARG O 1 1 1 51 1 1 4 GLY C C -3.463 -6.264 -2.393 1.00 . A A . 4 GLY C 1 1 1 52 1 1 4 GLY CA C -4.466 -5.452 -3.189 1.00 . A A . 4 GLY CA 1 1 1 53 1 1 4 GLY H H -3.237 -3.958 -4.048 1.00 . A A . 4 GLY H 1 1 1 54 1 1 4 GLY HA2 H -5.392 -5.401 -2.637 1.00 . A A . 4 GLY HA2 1 1 1 55 1 1 4 GLY HA3 H -4.647 -5.949 -4.131 1.00 . A A . 4 GLY HA3 1 1 1 56 1 1 4 GLY N N -4.002 -4.103 -3.453 1.00 . A A . 4 GLY N 1 1 1 57 1 1 4 GLY O O -2.471 -6.746 -2.940 1.00 . A A . 4 GLY O 1 1 1 58 1 1 5 TRP C C -3.577 -8.325 0.441 1.00 . A A . 5 TRP C 1 1 1 59 1 1 5 TRP CA C -2.833 -7.174 -0.226 1.00 . A A . 5 TRP CA 1 1 1 60 1 1 5 TRP CB C -2.226 -6.258 0.838 1.00 . A A . 5 TRP CB 1 1 1 61 1 1 5 TRP CD1 C -0.641 -4.263 0.561 1.00 . A A . 5 TRP CD1 1 1 1 62 1 1 5 TRP CD2 C 0.129 -6.178 -0.308 1.00 . A A . 5 TRP CD2 1 1 1 63 1 1 5 TRP CE2 C 1.087 -5.169 -0.526 1.00 . A A . 5 TRP CE2 1 1 1 64 1 1 5 TRP CE3 C 0.396 -7.471 -0.768 1.00 . A A . 5 TRP CE3 1 1 1 65 1 1 5 TRP CG C -0.968 -5.578 0.389 1.00 . A A . 5 TRP CG 1 1 1 66 1 1 5 TRP CH2 C 2.525 -6.688 -1.623 1.00 . A A . 5 TRP CH2 1 1 1 67 1 1 5 TRP CZ2 C 2.290 -5.414 -1.183 1.00 . A A . 5 TRP CZ2 1 1 1 68 1 1 5 TRP CZ3 C 1.590 -7.712 -1.421 1.00 . A A . 5 TRP CZ3 1 1 1 69 1 1 5 TRP H H -4.529 -6.008 -0.722 1.00 . A A . 5 TRP H 1 1 1 70 1 1 5 TRP HA H -2.038 -7.579 -0.835 1.00 . A A . 5 TRP HA 1 1 1 71 1 1 5 TRP HB2 H -2.943 -5.494 1.098 1.00 . A A . 5 TRP HB2 1 1 1 72 1 1 5 TRP HB3 H -1.994 -6.843 1.716 1.00 . A A . 5 TRP HB3 1 1 1 73 1 1 5 TRP HD1 H -1.270 -3.540 1.056 1.00 . A A . 5 TRP HD1 1 1 1 74 1 1 5 TRP HE1 H 1.048 -3.141 0.010 1.00 . A A . 5 TRP HE1 1 1 1 75 1 1 5 TRP HE3 H -0.312 -8.273 -0.622 1.00 . A A . 5 TRP HE3 1 1 1 76 1 1 5 TRP HH2 H 3.444 -6.922 -2.138 1.00 . A A . 5 TRP HH2 1 1 1 77 1 1 5 TRP HZ2 H 3.021 -4.636 -1.346 1.00 . A A . 5 TRP HZ2 1 1 1 78 1 1 5 TRP HZ3 H 1.813 -8.705 -1.784 1.00 . A A . 5 TRP HZ3 1 1 1 79 1 1 5 TRP N N -3.722 -6.416 -1.099 1.00 . A A . 5 TRP N 1 1 1 80 1 1 5 TRP NE1 N 0.594 -4.010 0.013 1.00 . A A . 5 TRP NE1 1 1 1 81 1 1 5 TRP O O -3.493 -9.471 -0.001 1.00 . A A . 5 TRP O 1 1 1 82 1 1 6 LYS C C -5.486 -10.160 1.311 1.00 . A A . 6 LYS C 1 1 1 83 1 1 6 LYS CA C -5.067 -9.022 2.236 1.00 . A A . 6 LYS CA 1 1 1 84 1 1 6 LYS CB C -6.304 -8.391 2.879 1.00 . A A . 6 LYS CB 1 1 1 85 1 1 6 LYS CD C -6.390 -5.888 2.693 1.00 . A A . 6 LYS CD 1 1 1 86 1 1 6 LYS CE C -7.543 -4.907 2.844 1.00 . A A . 6 LYS CE 1 1 1 87 1 1 6 LYS CG C -6.856 -7.208 2.103 1.00 . A A . 6 LYS CG 1 1 1 88 1 1 6 LYS H H -4.333 -7.082 1.812 1.00 . A A . 6 LYS H 1 1 1 89 1 1 6 LYS HA H -4.431 -9.421 3.012 1.00 . A A . 6 LYS HA 1 1 1 90 1 1 6 LYS HB2 H -7.078 -9.141 2.952 1.00 . A A . 6 LYS HB2 1 1 1 91 1 1 6 LYS HB3 H -6.046 -8.055 3.873 1.00 . A A . 6 LYS HB3 1 1 1 92 1 1 6 LYS HD2 H -5.958 -6.071 3.666 1.00 . A A . 6 LYS HD2 1 1 1 93 1 1 6 LYS HD3 H -5.644 -5.455 2.042 1.00 . A A . 6 LYS HD3 1 1 1 94 1 1 6 LYS HE2 H -8.322 -5.178 2.149 1.00 . A A . 6 LYS HE2 1 1 1 95 1 1 6 LYS HE3 H -7.923 -4.971 3.853 1.00 . A A . 6 LYS HE3 1 1 1 96 1 1 6 LYS HG2 H -6.518 -7.271 1.079 1.00 . A A . 6 LYS HG2 1 1 1 97 1 1 6 LYS HG3 H -7.936 -7.244 2.131 1.00 . A A . 6 LYS HG3 1 1 1 98 1 1 6 LYS HZ1 H -7.544 -3.167 1.688 1.00 . A A . 6 LYS HZ1 1 1 1 99 1 1 6 LYS HZ2 H -6.083 -3.457 2.488 1.00 . A A . 6 LYS HZ2 1 1 1 100 1 1 6 LYS HZ3 H -7.420 -2.884 3.352 1.00 . A A . 6 LYS HZ3 1 1 1 101 1 1 6 LYS N N -4.306 -8.014 1.508 1.00 . A A . 6 LYS N 1 1 1 102 1 1 6 LYS NZ N -7.118 -3.506 2.575 1.00 . A A . 6 LYS NZ 1 1 1 103 1 1 6 LYS O O -5.179 -11.325 1.566 1.00 . A A . 6 LYS O 1 1 1 104 1 1 7 ARG C C -5.511 -11.241 -1.648 1.00 . A A . 7 ARG C 1 1 1 105 1 1 7 ARG CA C -6.648 -10.809 -0.727 1.00 . A A . 7 ARG CA 1 1 1 106 1 1 7 ARG CB C -7.806 -10.249 -1.555 1.00 . A A . 7 ARG CB 1 1 1 107 1 1 7 ARG CD C -10.290 -9.905 -1.724 1.00 . A A . 7 ARG CD 1 1 1 108 1 1 7 ARG CG C -9.117 -10.165 -0.791 1.00 . A A . 7 ARG CG 1 1 1 109 1 1 7 ARG CZ C -12.455 -10.918 -2.299 1.00 . A A . 7 ARG CZ 1 1 1 110 1 1 7 ARG H H -6.401 -8.871 0.087 1.00 . A A . 7 ARG H 1 1 1 111 1 1 7 ARG HA H -6.996 -11.669 -0.175 1.00 . A A . 7 ARG HA 1 1 1 112 1 1 7 ARG HB2 H -7.546 -9.255 -1.890 1.00 . A A . 7 ARG HB2 1 1 1 113 1 1 7 ARG HB3 H -7.955 -10.882 -2.417 1.00 . A A . 7 ARG HB3 1 1 1 114 1 1 7 ARG HD2 H -10.711 -8.939 -1.491 1.00 . A A . 7 ARG HD2 1 1 1 115 1 1 7 ARG HD3 H -9.929 -9.904 -2.742 1.00 . A A . 7 ARG HD3 1 1 1 116 1 1 7 ARG HE H -11.184 -11.638 -0.940 1.00 . A A . 7 ARG HE 1 1 1 117 1 1 7 ARG HG2 H -9.283 -11.100 -0.275 1.00 . A A . 7 ARG HG2 1 1 1 118 1 1 7 ARG HG3 H -9.054 -9.361 -0.073 1.00 . A A . 7 ARG HG3 1 1 1 119 1 1 7 ARG HH11 H -12.004 -9.237 -3.324 1.00 . A A . 7 ARG HH11 1 1 1 120 1 1 7 ARG HH12 H -13.527 -9.961 -3.720 1.00 . A A . 7 ARG HH12 1 1 1 121 1 1 7 ARG HH21 H -13.188 -12.601 -1.452 1.00 . A A . 7 ARG HH21 1 1 1 122 1 1 7 ARG HH22 H -14.200 -11.874 -2.654 1.00 . A A . 7 ARG HH22 1 1 1 123 1 1 7 ARG N N -6.188 -9.816 0.236 1.00 . A A . 7 ARG N 1 1 1 124 1 1 7 ARG NE N -11.331 -10.921 -1.591 1.00 . A A . 7 ARG NE 1 1 1 125 1 1 7 ARG NH1 N -12.681 -9.960 -3.187 1.00 . A A . 7 ARG NH1 1 1 1 126 1 1 7 ARG NH2 N -13.355 -11.877 -2.121 1.00 . A A . 7 ARG NH2 1 1 1 127 1 1 7 ARG O O -4.966 -12.336 -1.508 1.00 . A A . 7 ARG O 1 1 1 128 1 1 8 LYS C C -2.722 -10.494 -2.879 1.00 . A A . 8 LYS C 1 1 1 129 1 1 8 LYS CA C -4.088 -10.664 -3.537 1.00 . A A . 8 LYS CA 1 1 1 130 1 1 8 LYS CB C -4.195 -9.748 -4.758 1.00 . A A . 8 LYS CB 1 1 1 131 1 1 8 LYS CD C -5.237 -10.454 -6.932 1.00 . A A . 8 LYS CD 1 1 1 132 1 1 8 LYS CE C -5.120 -11.971 -6.934 1.00 . A A . 8 LYS CE 1 1 1 133 1 1 8 LYS CG C -5.490 -9.917 -5.533 1.00 . A A . 8 LYS CG 1 1 1 134 1 1 8 LYS H H -5.632 -9.517 -2.653 1.00 . A A . 8 LYS H 1 1 1 135 1 1 8 LYS HA H -4.195 -11.690 -3.856 1.00 . A A . 8 LYS HA 1 1 1 136 1 1 8 LYS HB2 H -4.127 -8.721 -4.430 1.00 . A A . 8 LYS HB2 1 1 1 137 1 1 8 LYS HB3 H -3.371 -9.959 -5.425 1.00 . A A . 8 LYS HB3 1 1 1 138 1 1 8 LYS HD2 H -6.058 -10.168 -7.572 1.00 . A A . 8 LYS HD2 1 1 1 139 1 1 8 LYS HD3 H -4.318 -10.030 -7.310 1.00 . A A . 8 LYS HD3 1 1 1 140 1 1 8 LYS HE2 H -4.690 -12.284 -7.873 1.00 . A A . 8 LYS HE2 1 1 1 141 1 1 8 LYS HE3 H -4.470 -12.269 -6.124 1.00 . A A . 8 LYS HE3 1 1 1 142 1 1 8 LYS HG2 H -6.128 -10.609 -5.004 1.00 . A A . 8 LYS HG2 1 1 1 143 1 1 8 LYS HG3 H -5.981 -8.957 -5.609 1.00 . A A . 8 LYS HG3 1 1 1 144 1 1 8 LYS HZ1 H -6.472 -13.143 -5.857 1.00 . A A . 8 LYS HZ1 1 1 1 145 1 1 8 LYS HZ2 H -6.610 -13.305 -7.534 1.00 . A A . 8 LYS HZ2 1 1 1 146 1 1 8 LYS HZ3 H -7.201 -11.918 -6.768 1.00 . A A . 8 LYS HZ3 1 1 1 147 1 1 8 LYS N N -5.160 -10.374 -2.592 1.00 . A A . 8 LYS N 1 1 1 148 1 1 8 LYS NZ N -6.444 -12.630 -6.761 1.00 . A A . 8 LYS NZ 1 1 1 149 1 1 8 LYS O O -2.370 -9.403 -2.430 1.00 . A A . 8 LYS O 1 1 1 150 1 1 9 CYS C C 0.442 -11.904 -3.252 1.00 . A A . 9 CYS C 1 1 1 151 1 1 9 CYS CA C -0.628 -11.549 -2.225 1.00 . A A . 9 CYS CA 1 1 1 152 1 1 9 CYS CB C -0.560 -12.517 -1.043 1.00 . A A . 9 CYS CB 1 1 1 153 1 1 9 CYS H H -2.292 -12.420 -3.203 1.00 . A A . 9 CYS H 1 1 1 154 1 1 9 CYS HA H -0.449 -10.546 -1.869 1.00 . A A . 9 CYS HA 1 1 1 155 1 1 9 CYS HB2 H 0.469 -12.619 -0.730 1.00 . A A . 9 CYS HB2 1 1 1 156 1 1 9 CYS HB3 H -1.139 -12.115 -0.225 1.00 . A A . 9 CYS HB3 1 1 1 157 1 1 9 CYS HG H -0.196 -14.885 -1.915 1.00 . A A . 9 CYS HG 1 1 1 158 1 1 9 CYS N N -1.956 -11.579 -2.827 1.00 . A A . 9 CYS N 1 1 1 159 1 1 9 CYS O O 1.007 -12.998 -3.243 1.00 . A A . 9 CYS O 1 1 1 160 1 1 9 CYS SG S -1.190 -14.172 -1.407 1.00 . A A . 9 CYS SG 1 1 1 161 1 1 10 PRO C C 3.152 -11.186 -4.658 1.00 . A A . 10 PRO C 1 1 1 162 1 1 10 PRO CA C 1.732 -11.150 -5.212 1.00 . A A . 10 PRO CA 1 1 1 163 1 1 10 PRO CB C 1.539 -9.927 -6.112 1.00 . A A . 10 PRO CB 1 1 1 164 1 1 10 PRO CD C 0.094 -9.633 -4.231 1.00 . A A . 10 PRO CD 1 1 1 165 1 1 10 PRO CG C 0.948 -8.890 -5.220 1.00 . A A . 10 PRO CG 1 1 1 166 1 1 10 PRO HA H 1.545 -12.050 -5.779 1.00 . A A . 10 PRO HA 1 1 1 167 1 1 10 PRO HB2 H 2.495 -9.613 -6.506 1.00 . A A . 10 PRO HB2 1 1 1 168 1 1 10 PRO HB3 H 0.873 -10.175 -6.924 1.00 . A A . 10 PRO HB3 1 1 1 169 1 1 10 PRO HD2 H 0.118 -9.142 -3.269 1.00 . A A . 10 PRO HD2 1 1 1 170 1 1 10 PRO HD3 H -0.921 -9.710 -4.592 1.00 . A A . 10 PRO HD3 1 1 1 171 1 1 10 PRO HG2 H 1.734 -8.354 -4.710 1.00 . A A . 10 PRO HG2 1 1 1 172 1 1 10 PRO HG3 H 0.343 -8.209 -5.801 1.00 . A A . 10 PRO HG3 1 1 1 173 1 1 10 PRO N N 0.728 -10.960 -4.160 1.00 . A A . 10 PRO N 1 1 1 174 1 1 10 PRO O O 3.955 -12.040 -5.035 1.00 . A A . 10 PRO O 1 1 1 175 1 1 11 LEU C C 4.706 -10.437 -1.652 1.00 . A A . 11 LEU C 1 1 1 176 1 1 11 LEU CA C 4.780 -10.179 -3.154 1.00 . A A . 11 LEU CA 1 1 1 177 1 1 11 LEU CB C 5.406 -8.809 -3.417 1.00 . A A . 11 LEU CB 1 1 1 178 1 1 11 LEU CD1 C 5.090 -6.412 -4.081 1.00 . A A . 11 LEU CD1 1 1 1 179 1 1 11 LEU CD2 C 4.536 -8.238 -5.698 1.00 . A A . 11 LEU CD2 1 1 1 180 1 1 11 LEU CG C 4.561 -7.830 -4.232 1.00 . A A . 11 LEU CG 1 1 1 181 1 1 11 LEU H H 2.774 -9.601 -3.500 1.00 . A A . 11 LEU H 1 1 1 182 1 1 11 LEU HA H 5.396 -10.941 -3.608 1.00 . A A . 11 LEU HA 1 1 1 183 1 1 11 LEU HB2 H 5.613 -8.351 -2.462 1.00 . A A . 11 LEU HB2 1 1 1 184 1 1 11 LEU HB3 H 6.335 -8.967 -3.947 1.00 . A A . 11 LEU HB3 1 1 1 185 1 1 11 LEU HD11 H 4.482 -5.875 -3.369 1.00 . A A . 11 LEU HD11 1 1 1 186 1 1 11 LEU HD12 H 5.054 -5.910 -5.036 1.00 . A A . 11 LEU HD12 1 1 1 187 1 1 11 LEU HD13 H 6.112 -6.445 -3.730 1.00 . A A . 11 LEU HD13 1 1 1 188 1 1 11 LEU HD21 H 5.322 -7.721 -6.228 1.00 . A A . 11 LEU HD21 1 1 1 189 1 1 11 LEU HD22 H 3.580 -7.977 -6.128 1.00 . A A . 11 LEU HD22 1 1 1 190 1 1 11 LEU HD23 H 4.689 -9.304 -5.777 1.00 . A A . 11 LEU HD23 1 1 1 191 1 1 11 LEU HG H 3.545 -7.847 -3.862 1.00 . A A . 11 LEU HG 1 1 1 192 1 1 11 LEU N N 3.455 -10.254 -3.761 1.00 . A A . 11 LEU N 1 1 1 193 1 1 11 LEU O O 5.025 -11.530 -1.183 1.00 . A A . 11 LEU O 1 1 1 194 1 1 12 PHE C C 2.738 -9.250 1.001 1.00 . A A . 12 PHE C 1 1 1 195 1 1 12 PHE CA C 4.165 -9.542 0.546 1.00 . A A . 12 PHE CA 1 1 1 196 1 1 12 PHE CB C 5.139 -8.585 1.236 1.00 . A A . 12 PHE CB 1 1 1 197 1 1 12 PHE CD1 C 5.057 -6.357 0.085 1.00 . A A . 12 PHE CD1 1 1 1 198 1 1 12 PHE CD2 C 6.929 -7.776 -0.324 1.00 . A A . 12 PHE CD2 1 1 1 199 1 1 12 PHE CE1 C 5.589 -5.404 -0.763 1.00 . A A . 12 PHE CE1 1 1 1 200 1 1 12 PHE CE2 C 7.467 -6.827 -1.173 1.00 . A A . 12 PHE CE2 1 1 1 201 1 1 12 PHE CG C 5.720 -7.552 0.314 1.00 . A A . 12 PHE CG 1 1 1 202 1 1 12 PHE CZ C 6.795 -5.640 -1.394 1.00 . A A . 12 PHE CZ 1 1 1 203 1 1 12 PHE H H 4.043 -8.578 -1.335 1.00 . A A . 12 PHE H 1 1 1 204 1 1 12 PHE HA H 4.416 -10.556 0.817 1.00 . A A . 12 PHE HA 1 1 1 205 1 1 12 PHE HB2 H 4.621 -8.067 2.030 1.00 . A A . 12 PHE HB2 1 1 1 206 1 1 12 PHE HB3 H 5.955 -9.154 1.656 1.00 . A A . 12 PHE HB3 1 1 1 207 1 1 12 PHE HD1 H 4.113 -6.172 0.577 1.00 . A A . 12 PHE HD1 1 1 1 208 1 1 12 PHE HD2 H 7.455 -8.704 -0.153 1.00 . A A . 12 PHE HD2 1 1 1 209 1 1 12 PHE HE1 H 5.062 -4.478 -0.934 1.00 . A A . 12 PHE HE1 1 1 1 210 1 1 12 PHE HE2 H 8.410 -7.014 -1.665 1.00 . A A . 12 PHE HE2 1 1 1 211 1 1 12 PHE HZ H 7.214 -4.897 -2.056 1.00 . A A . 12 PHE HZ 1 1 1 212 1 1 12 PHE N N 4.282 -9.425 -0.903 1.00 . A A . 12 PHE N 1 1 1 213 1 1 12 PHE O O 2.396 -8.111 1.315 1.00 . A A . 12 PHE O 1 1 1 214 1 1 13 GLY C C 0.370 -10.170 2.959 1.00 . A A . 13 GLY C 1 1 1 215 1 1 13 GLY CA C 0.529 -10.124 1.452 1.00 . A A . 13 GLY CA 1 1 1 216 1 1 13 GLY H H 2.238 -11.175 0.773 1.00 . A A . 13 GLY H 1 1 1 217 1 1 13 GLY HA2 H 0.166 -9.174 1.091 1.00 . A A . 13 GLY HA2 1 1 1 218 1 1 13 GLY HA3 H -0.064 -10.914 1.015 1.00 . A A . 13 GLY HA3 1 1 1 219 1 1 13 GLY N N 1.909 -10.289 1.034 1.00 . A A . 13 GLY N 1 1 1 220 1 1 13 GLY O O -0.694 -9.849 3.488 1.00 . A A . 13 GLY O 1 1 1 221 1 1 14 LYS C C 1.527 -9.276 5.738 1.00 . A A . 14 LYS C 1 1 1 222 1 1 14 LYS CA C 1.404 -10.660 5.107 1.00 . A A . 14 LYS CA 1 1 1 223 1 1 14 LYS CB C 2.536 -11.561 5.604 1.00 . A A . 14 LYS CB 1 1 1 224 1 1 14 LYS CD C 3.991 -12.850 4.014 1.00 . A A . 14 LYS CD 1 1 1 225 1 1 14 LYS CE C 3.927 -13.821 2.844 1.00 . A A . 14 LYS CE 1 1 1 226 1 1 14 LYS CG C 2.692 -12.841 4.801 1.00 . A A . 14 LYS CG 1 1 1 227 1 1 14 LYS H H 2.250 -10.815 3.173 1.00 . A A . 14 LYS H 1 1 1 228 1 1 14 LYS HA H 0.458 -11.091 5.397 1.00 . A A . 14 LYS HA 1 1 1 229 1 1 14 LYS HB2 H 3.465 -11.013 5.553 1.00 . A A . 14 LYS HB2 1 1 1 230 1 1 14 LYS HB3 H 2.342 -11.828 6.633 1.00 . A A . 14 LYS HB3 1 1 1 231 1 1 14 LYS HD2 H 4.179 -11.857 3.633 1.00 . A A . 14 LYS HD2 1 1 1 232 1 1 14 LYS HD3 H 4.798 -13.145 4.670 1.00 . A A . 14 LYS HD3 1 1 1 233 1 1 14 LYS HE2 H 2.989 -14.353 2.886 1.00 . A A . 14 LYS HE2 1 1 1 234 1 1 14 LYS HE3 H 3.980 -13.258 1.923 1.00 . A A . 14 LYS HE3 1 1 1 235 1 1 14 LYS HG2 H 2.688 -13.683 5.478 1.00 . A A . 14 LYS HG2 1 1 1 236 1 1 14 LYS HG3 H 1.863 -12.926 4.113 1.00 . A A . 14 LYS HG3 1 1 1 237 1 1 14 LYS HZ1 H 5.950 -14.321 2.704 1.00 . A A . 14 LYS HZ1 1 1 1 238 1 1 14 LYS HZ2 H 4.906 -15.527 2.143 1.00 . A A . 14 LYS HZ2 1 1 1 239 1 1 14 LYS HZ3 H 5.084 -15.270 3.805 1.00 . A A . 14 LYS HZ3 1 1 1 240 1 1 14 LYS N N 1.430 -10.572 3.652 1.00 . A A . 14 LYS N 1 1 1 241 1 1 14 LYS NZ N 5.045 -14.804 2.877 1.00 . A A . 14 LYS NZ 1 1 1 242 1 1 14 LYS O O 0.716 -8.893 6.579 1.00 . A A . 14 LYS O 1 1 1 243 1 1 15 GLY C C 2.314 -6.112 4.899 1.00 . A A . 15 GLY C 1 1 1 244 1 1 15 GLY CA C 2.757 -7.198 5.859 1.00 . A A . 15 GLY CA 1 1 1 245 1 1 15 GLY H H 3.163 -8.889 4.651 1.00 . A A . 15 GLY H 1 1 1 246 1 1 15 GLY HA2 H 2.201 -7.099 6.779 1.00 . A A . 15 GLY HA2 1 1 1 247 1 1 15 GLY HA3 H 3.808 -7.069 6.070 1.00 . A A . 15 GLY HA3 1 1 1 248 1 1 15 GLY N N 2.548 -8.531 5.325 1.00 . A A . 15 GLY N 1 1 1 249 1 1 15 GLY O O 2.937 -5.054 4.817 1.00 . A A . 15 GLY O 1 1 1 250 1 1 16 GLY C C 0.547 -4.029 3.832 1.00 . A A . 16 GLY C 1 1 1 251 1 1 16 GLY CA C 0.729 -5.403 3.216 1.00 . A A . 16 GLY CA 1 1 1 252 1 1 16 GLY H H 0.778 -7.236 4.275 1.00 . A A . 16 GLY H 1 1 1 253 1 1 16 GLY HA2 H 1.422 -5.327 2.392 1.00 . A A . 16 GLY HA2 1 1 1 254 1 1 16 GLY HA3 H -0.225 -5.745 2.842 1.00 . A A . 16 GLY HA3 1 1 1 255 1 1 16 GLY N N 1.235 -6.375 4.168 1.00 . A A . 16 GLY N 1 1 1 256 1 1 16 GLY O O 0.361 -3.904 5.042 1.00 . A A . 16 GLY O 1 1 2 257 1 1 1 VAL C C 1.308 -0.851 -2.631 1.00 . A A . 1 VAL C 1 1 2 258 1 1 1 VAL CA C 2.200 -0.203 -1.578 1.00 . A A . 1 VAL CA 1 1 2 259 1 1 1 VAL CB C 3.510 -1.006 -1.466 1.00 . A A . 1 VAL CB 1 1 2 260 1 1 1 VAL CG1 C 3.239 -2.395 -0.908 1.00 . A A . 1 VAL CG1 1 1 2 261 1 1 1 VAL CG2 C 4.199 -1.092 -2.820 1.00 . A A . 1 VAL CG2 1 1 2 262 1 1 1 VAL H1 H 1.280 0.763 0.065 1.00 . A A . 1 VAL H1 1 1 2 263 1 1 1 VAL HA H 2.444 0.801 -1.894 1.00 . A A . 1 VAL HA 1 1 2 264 1 1 1 VAL HB H 4.168 -0.490 -0.783 1.00 . A A . 1 VAL HB 1 1 2 265 1 1 1 VAL HG11 H 4.171 -2.934 -0.818 1.00 . A A . 1 VAL HG11 1 1 2 266 1 1 1 VAL HG12 H 2.777 -2.308 0.065 1.00 . A A . 1 VAL HG12 1 1 2 267 1 1 1 VAL HG13 H 2.578 -2.928 -1.575 1.00 . A A . 1 VAL HG13 1 1 2 268 1 1 1 VAL HG21 H 3.832 -0.303 -3.460 1.00 . A A . 1 VAL HG21 1 1 2 269 1 1 1 VAL HG22 H 5.266 -0.982 -2.689 1.00 . A A . 1 VAL HG22 1 1 2 270 1 1 1 VAL HG23 H 3.988 -2.050 -3.271 1.00 . A A . 1 VAL HG23 1 1 2 271 1 1 1 VAL N N 1.518 -0.118 -0.292 1.00 . A A . 1 VAL N 1 1 2 272 1 1 1 VAL O O 1.343 -0.477 -3.803 1.00 . A A . 1 VAL O 1 1 2 273 1 1 2 ALA C C -1.837 -2.433 -2.623 1.00 . A A . 2 ALA C 1 1 2 274 1 1 2 ALA CA C -0.395 -2.521 -3.111 1.00 . A A . 2 ALA CA 1 1 2 275 1 1 2 ALA CB C 0.026 -3.976 -3.259 1.00 . A A . 2 ALA CB 1 1 2 276 1 1 2 ALA H H 0.527 -2.076 -1.258 1.00 . A A . 2 ALA H 1 1 2 277 1 1 2 ALA HA H -0.324 -2.051 -4.081 1.00 . A A . 2 ALA HA 1 1 2 278 1 1 2 ALA HB1 H -0.179 -4.308 -4.266 1.00 . A A . 2 ALA HB1 1 1 2 279 1 1 2 ALA HB2 H 1.083 -4.067 -3.057 1.00 . A A . 2 ALA HB2 1 1 2 280 1 1 2 ALA HB3 H -0.527 -4.584 -2.559 1.00 . A A . 2 ALA HB3 1 1 2 281 1 1 2 ALA N N 0.509 -1.823 -2.205 1.00 . A A . 2 ALA N 1 1 2 282 1 1 2 ALA O O -2.158 -2.882 -1.523 1.00 . A A . 2 ALA O 1 1 2 283 1 1 3 ARG C C -4.710 -3.043 -2.684 1.00 . A A . 3 ARG C 1 1 2 284 1 1 3 ARG CA C -4.109 -1.704 -3.100 1.00 . A A . 3 ARG CA 1 1 2 285 1 1 3 ARG CB C -4.891 -1.127 -4.282 1.00 . A A . 3 ARG CB 1 1 2 286 1 1 3 ARG CD C -3.919 -2.500 -6.149 1.00 . A A . 3 ARG CD 1 1 2 287 1 1 3 ARG CG C -5.178 -2.142 -5.376 1.00 . A A . 3 ARG CG 1 1 2 288 1 1 3 ARG CZ C -4.490 -1.768 -8.425 1.00 . A A . 3 ARG CZ 1 1 2 289 1 1 3 ARG H H -2.385 -1.514 -4.312 1.00 . A A . 3 ARG H 1 1 2 290 1 1 3 ARG HA H -4.175 -1.019 -2.268 1.00 . A A . 3 ARG HA 1 1 2 291 1 1 3 ARG HB2 H -5.834 -0.743 -3.921 1.00 . A A . 3 ARG HB2 1 1 2 292 1 1 3 ARG HB3 H -4.322 -0.317 -4.713 1.00 . A A . 3 ARG HB3 1 1 2 293 1 1 3 ARG HD2 H -3.214 -1.686 -6.059 1.00 . A A . 3 ARG HD2 1 1 2 294 1 1 3 ARG HD3 H -3.492 -3.394 -5.721 1.00 . A A . 3 ARG HD3 1 1 2 295 1 1 3 ARG HE H -4.154 -3.659 -7.886 1.00 . A A . 3 ARG HE 1 1 2 296 1 1 3 ARG HG2 H -5.578 -3.039 -4.926 1.00 . A A . 3 ARG HG2 1 1 2 297 1 1 3 ARG HG3 H -5.904 -1.726 -6.058 1.00 . A A . 3 ARG HG3 1 1 2 298 1 1 3 ARG HH11 H -4.371 -0.284 -7.060 1.00 . A A . 3 ARG HH11 1 1 2 299 1 1 3 ARG HH12 H -4.773 0.218 -8.669 1.00 . A A . 3 ARG HH12 1 1 2 300 1 1 3 ARG HH21 H -4.683 -3.010 -10.008 1.00 . A A . 3 ARG HH21 1 1 2 301 1 1 3 ARG HH22 H -4.951 -1.334 -10.345 1.00 . A A . 3 ARG HH22 1 1 2 302 1 1 3 ARG N N -2.701 -1.852 -3.449 1.00 . A A . 3 ARG N 1 1 2 303 1 1 3 ARG NE N -4.193 -2.735 -7.564 1.00 . A A . 3 ARG NE 1 1 2 304 1 1 3 ARG NH1 N -4.551 -0.508 -8.018 1.00 . A A . 3 ARG NH1 1 1 2 305 1 1 3 ARG NH2 N -4.727 -2.062 -9.697 1.00 . A A . 3 ARG NH2 1 1 2 306 1 1 3 ARG O O -5.631 -3.096 -1.870 1.00 . A A . 3 ARG O 1 1 2 307 1 1 4 GLY C C -3.664 -6.280 -2.166 1.00 . A A . 4 GLY C 1 1 2 308 1 1 4 GLY CA C -4.679 -5.449 -2.925 1.00 . A A . 4 GLY CA 1 1 2 309 1 1 4 GLY H H -3.449 -4.022 -3.892 1.00 . A A . 4 GLY H 1 1 2 310 1 1 4 GLY HA2 H -5.570 -5.350 -2.324 1.00 . A A . 4 GLY HA2 1 1 2 311 1 1 4 GLY HA3 H -4.932 -5.961 -3.843 1.00 . A A . 4 GLY HA3 1 1 2 312 1 1 4 GLY N N -4.182 -4.125 -3.249 1.00 . A A . 4 GLY N 1 1 2 313 1 1 4 GLY O O -2.729 -6.820 -2.756 1.00 . A A . 4 GLY O 1 1 2 314 1 1 5 TRP C C -3.685 -8.248 0.735 1.00 . A A . 5 TRP C 1 1 2 315 1 1 5 TRP CA C -2.937 -7.150 -0.013 1.00 . A A . 5 TRP CA 1 1 2 316 1 1 5 TRP CB C -2.228 -6.230 0.982 1.00 . A A . 5 TRP CB 1 1 2 317 1 1 5 TRP CD1 C -0.593 -4.306 0.541 1.00 . A A . 5 TRP CD1 1 1 2 318 1 1 5 TRP CD2 C 0.050 -6.275 -0.312 1.00 . A A . 5 TRP CD2 1 1 2 319 1 1 5 TRP CE2 C 1.028 -5.310 -0.622 1.00 . A A . 5 TRP CE2 1 1 2 320 1 1 5 TRP CE3 C 0.240 -7.590 -0.745 1.00 . A A . 5 TRP CE3 1 1 2 321 1 1 5 TRP CG C -0.978 -5.612 0.433 1.00 . A A . 5 TRP CG 1 1 2 322 1 1 5 TRP CH2 C 2.336 -6.916 -1.757 1.00 . A A . 5 TRP CH2 1 1 2 323 1 1 5 TRP CZ2 C 2.176 -5.621 -1.346 1.00 . A A . 5 TRP CZ2 1 1 2 324 1 1 5 TRP CZ3 C 1.380 -7.896 -1.463 1.00 . A A . 5 TRP CZ3 1 1 2 325 1 1 5 TRP H H -4.611 -5.926 -0.442 1.00 . A A . 5 TRP H 1 1 2 326 1 1 5 TRP HA H -2.199 -7.607 -0.656 1.00 . A A . 5 TRP HA 1 1 2 327 1 1 5 TRP HB2 H -2.898 -5.431 1.265 1.00 . A A . 5 TRP HB2 1 1 2 328 1 1 5 TRP HB3 H -1.962 -6.799 1.861 1.00 . A A . 5 TRP HB3 1 1 2 329 1 1 5 TRP HD1 H -1.163 -3.545 1.050 1.00 . A A . 5 TRP HD1 1 1 2 330 1 1 5 TRP HE1 H 1.096 -3.267 -0.151 1.00 . A A . 5 TRP HE1 1 1 2 331 1 1 5 TRP HE3 H -0.486 -8.360 -0.528 1.00 . A A . 5 TRP HE3 1 1 2 332 1 1 5 TRP HH2 H 3.211 -7.200 -2.321 1.00 . A A . 5 TRP HH2 1 1 2 333 1 1 5 TRP HZ2 H 2.923 -4.876 -1.580 1.00 . A A . 5 TRP HZ2 1 1 2 334 1 1 5 TRP HZ3 H 1.543 -8.907 -1.807 1.00 . A A . 5 TRP HZ3 1 1 2 335 1 1 5 TRP N N -3.847 -6.380 -0.854 1.00 . A A . 5 TRP N 1 1 2 336 1 1 5 TRP NE1 N 0.612 -4.118 -0.091 1.00 . A A . 5 TRP NE1 1 1 2 337 1 1 5 TRP O O -3.671 -9.410 0.330 1.00 . A A . 5 TRP O 1 1 2 338 1 1 6 LYS C C -5.613 -9.973 1.775 1.00 . A A . 6 LYS C 1 1 2 339 1 1 6 LYS CA C -5.095 -8.824 2.634 1.00 . A A . 6 LYS CA 1 1 2 340 1 1 6 LYS CB C -6.266 -8.123 3.326 1.00 . A A . 6 LYS CB 1 1 2 341 1 1 6 LYS CD C -6.269 -5.625 3.056 1.00 . A A . 6 LYS CD 1 1 2 342 1 1 6 LYS CE C -7.221 -4.975 4.049 1.00 . A A . 6 LYS CE 1 1 2 343 1 1 6 LYS CG C -6.818 -6.945 2.541 1.00 . A A . 6 LYS CG 1 1 2 344 1 1 6 LYS H H -4.313 -6.930 2.102 1.00 . A A . 6 LYS H 1 1 2 345 1 1 6 LYS HA H -4.431 -9.224 3.386 1.00 . A A . 6 LYS HA 1 1 2 346 1 1 6 LYS HB2 H -7.063 -8.837 3.471 1.00 . A A . 6 LYS HB2 1 1 2 347 1 1 6 LYS HB3 H -5.936 -7.763 4.290 1.00 . A A . 6 LYS HB3 1 1 2 348 1 1 6 LYS HD2 H -5.324 -5.805 3.546 1.00 . A A . 6 LYS HD2 1 1 2 349 1 1 6 LYS HD3 H -6.123 -4.956 2.220 1.00 . A A . 6 LYS HD3 1 1 2 350 1 1 6 LYS HE2 H -8.192 -5.435 3.951 1.00 . A A . 6 LYS HE2 1 1 2 351 1 1 6 LYS HE3 H -6.844 -5.140 5.048 1.00 . A A . 6 LYS HE3 1 1 2 352 1 1 6 LYS HG2 H -6.544 -7.056 1.503 1.00 . A A . 6 LYS HG2 1 1 2 353 1 1 6 LYS HG3 H -7.895 -6.937 2.632 1.00 . A A . 6 LYS HG3 1 1 2 354 1 1 6 LYS HZ1 H -6.704 -3.211 3.059 1.00 . A A . 6 LYS HZ1 1 1 2 355 1 1 6 LYS HZ2 H -7.119 -2.988 4.683 1.00 . A A . 6 LYS HZ2 1 1 2 356 1 1 6 LYS HZ3 H -8.326 -3.279 3.535 1.00 . A A . 6 LYS HZ3 1 1 2 357 1 1 6 LYS N N -4.339 -7.872 1.830 1.00 . A A . 6 LYS N 1 1 2 358 1 1 6 LYS NZ N -7.352 -3.511 3.815 1.00 . A A . 6 LYS NZ 1 1 2 359 1 1 6 LYS O O -5.345 -11.141 2.057 1.00 . A A . 6 LYS O 1 1 2 360 1 1 7 ARG C C -5.849 -11.131 -1.157 1.00 . A A . 7 ARG C 1 1 2 361 1 1 7 ARG CA C -6.908 -10.637 -0.176 1.00 . A A . 7 ARG CA 1 1 2 362 1 1 7 ARG CB C -8.101 -10.062 -0.942 1.00 . A A . 7 ARG CB 1 1 2 363 1 1 7 ARG CD C -8.667 -10.397 -3.367 1.00 . A A . 7 ARG CD 1 1 2 364 1 1 7 ARG CG C -8.676 -11.014 -1.978 1.00 . A A . 7 ARG CG 1 1 2 365 1 1 7 ARG CZ C -11.032 -10.304 -4.033 1.00 . A A . 7 ARG CZ 1 1 2 366 1 1 7 ARG H H -6.532 -8.685 0.552 1.00 . A A . 7 ARG H 1 1 2 367 1 1 7 ARG HA H -7.244 -11.470 0.423 1.00 . A A . 7 ARG HA 1 1 2 368 1 1 7 ARG HB2 H -8.882 -9.817 -0.238 1.00 . A A . 7 ARG HB2 1 1 2 369 1 1 7 ARG HB3 H -7.788 -9.161 -1.447 1.00 . A A . 7 ARG HB3 1 1 2 370 1 1 7 ARG HD2 H -7.847 -9.698 -3.431 1.00 . A A . 7 ARG HD2 1 1 2 371 1 1 7 ARG HD3 H -8.529 -11.183 -4.095 1.00 . A A . 7 ARG HD3 1 1 2 372 1 1 7 ARG HE H -9.913 -8.717 -3.576 1.00 . A A . 7 ARG HE 1 1 2 373 1 1 7 ARG HG2 H -8.081 -11.916 -1.993 1.00 . A A . 7 ARG HG2 1 1 2 374 1 1 7 ARG HG3 H -9.692 -11.255 -1.706 1.00 . A A . 7 ARG HG3 1 1 2 375 1 1 7 ARG HH11 H -10.240 -12.161 -3.968 1.00 . A A . 7 ARG HH11 1 1 2 376 1 1 7 ARG HH12 H -11.906 -12.081 -4.436 1.00 . A A . 7 ARG HH12 1 1 2 377 1 1 7 ARG HH21 H -12.107 -8.599 -4.191 1.00 . A A . 7 ARG HH21 1 1 2 378 1 1 7 ARG HH22 H -12.967 -10.054 -4.563 1.00 . A A . 7 ARG HH22 1 1 2 379 1 1 7 ARG N N -6.353 -9.633 0.725 1.00 . A A . 7 ARG N 1 1 2 380 1 1 7 ARG NE N -9.913 -9.693 -3.661 1.00 . A A . 7 ARG NE 1 1 2 381 1 1 7 ARG NH1 N -11.062 -11.623 -4.156 1.00 . A A . 7 ARG NH1 1 1 2 382 1 1 7 ARG NH2 N -12.125 -9.594 -4.283 1.00 . A A . 7 ARG NH2 1 1 2 383 1 1 7 ARG O O -5.324 -12.236 -1.018 1.00 . A A . 7 ARG O 1 1 2 384 1 1 8 LYS C C -3.135 -10.572 -2.579 1.00 . A A . 8 LYS C 1 1 2 385 1 1 8 LYS CA C -4.544 -10.655 -3.157 1.00 . A A . 8 LYS CA 1 1 2 386 1 1 8 LYS CB C -4.665 -9.729 -4.369 1.00 . A A . 8 LYS CB 1 1 2 387 1 1 8 LYS CD C -5.218 -10.508 -6.692 1.00 . A A . 8 LYS CD 1 1 2 388 1 1 8 LYS CE C -4.476 -11.834 -6.641 1.00 . A A . 8 LYS CE 1 1 2 389 1 1 8 LYS CG C -5.772 -10.127 -5.330 1.00 . A A . 8 LYS CG 1 1 2 390 1 1 8 LYS H H -5.993 -9.437 -2.209 1.00 . A A . 8 LYS H 1 1 2 391 1 1 8 LYS HA H -4.733 -11.671 -3.470 1.00 . A A . 8 LYS HA 1 1 2 392 1 1 8 LYS HB2 H -4.861 -8.725 -4.022 1.00 . A A . 8 LYS HB2 1 1 2 393 1 1 8 LYS HB3 H -3.729 -9.738 -4.908 1.00 . A A . 8 LYS HB3 1 1 2 394 1 1 8 LYS HD2 H -6.035 -10.593 -7.393 1.00 . A A . 8 LYS HD2 1 1 2 395 1 1 8 LYS HD3 H -4.537 -9.736 -7.023 1.00 . A A . 8 LYS HD3 1 1 2 396 1 1 8 LYS HE2 H -3.417 -11.643 -6.725 1.00 . A A . 8 LYS HE2 1 1 2 397 1 1 8 LYS HE3 H -4.681 -12.310 -5.693 1.00 . A A . 8 LYS HE3 1 1 2 398 1 1 8 LYS HG2 H -6.306 -10.972 -4.921 1.00 . A A . 8 LYS HG2 1 1 2 399 1 1 8 LYS HG3 H -6.451 -9.293 -5.447 1.00 . A A . 8 LYS HG3 1 1 2 400 1 1 8 LYS HZ1 H -5.792 -13.210 -7.500 1.00 . A A . 8 LYS HZ1 1 1 2 401 1 1 8 LYS HZ2 H -4.169 -13.478 -7.893 1.00 . A A . 8 LYS HZ2 1 1 2 402 1 1 8 LYS HZ3 H -5.017 -12.209 -8.623 1.00 . A A . 8 LYS HZ3 1 1 2 403 1 1 8 LYS N N -5.540 -10.305 -2.151 1.00 . A A . 8 LYS N 1 1 2 404 1 1 8 LYS NZ N -4.893 -12.746 -7.742 1.00 . A A . 8 LYS NZ 1 1 2 405 1 1 8 LYS O O -2.690 -9.505 -2.154 1.00 . A A . 8 LYS O 1 1 2 406 1 1 9 CYS C C -0.087 -12.138 -3.136 1.00 . A A . 9 CYS C 1 1 2 407 1 1 9 CYS CA C -1.079 -11.757 -2.041 1.00 . A A . 9 CYS CA 1 1 2 408 1 1 9 CYS CB C -0.994 -12.760 -0.889 1.00 . A A . 9 CYS CB 1 1 2 409 1 1 9 CYS H H -2.847 -12.521 -2.919 1.00 . A A . 9 CYS H 1 1 2 410 1 1 9 CYS HA H -0.828 -10.775 -1.671 1.00 . A A . 9 CYS HA 1 1 2 411 1 1 9 CYS HB2 H -1.047 -13.762 -1.290 1.00 . A A . 9 CYS HB2 1 1 2 412 1 1 9 CYS HB3 H -0.051 -12.633 -0.379 1.00 . A A . 9 CYS HB3 1 1 2 413 1 1 9 CYS HG H -3.473 -12.686 -0.296 1.00 . A A . 9 CYS HG 1 1 2 414 1 1 9 CYS N N -2.438 -11.703 -2.567 1.00 . A A . 9 CYS N 1 1 2 415 1 1 9 CYS O O 0.433 -13.253 -3.176 1.00 . A A . 9 CYS O 1 1 2 416 1 1 9 CYS SG S -2.313 -12.589 0.336 1.00 . A A . 9 CYS SG 1 1 2 417 1 1 10 PRO C C 2.558 -11.502 -4.696 1.00 . A A . 10 PRO C 1 1 2 418 1 1 10 PRO CA C 1.109 -11.403 -5.161 1.00 . A A . 10 PRO CA 1 1 2 419 1 1 10 PRO CB C 0.911 -10.160 -6.031 1.00 . A A . 10 PRO CB 1 1 2 420 1 1 10 PRO CD C -0.405 -9.839 -4.061 1.00 . A A . 10 PRO CD 1 1 2 421 1 1 10 PRO CG C 0.417 -9.115 -5.091 1.00 . A A . 10 PRO CG 1 1 2 422 1 1 10 PRO HA H 0.853 -12.286 -5.728 1.00 . A A . 10 PRO HA 1 1 2 423 1 1 10 PRO HB2 H 1.853 -9.876 -6.479 1.00 . A A . 10 PRO HB2 1 1 2 424 1 1 10 PRO HB3 H 0.187 -10.369 -6.805 1.00 . A A . 10 PRO HB3 1 1 2 425 1 1 10 PRO HD2 H -0.303 -9.365 -3.096 1.00 . A A . 10 PRO HD2 1 1 2 426 1 1 10 PRO HD3 H -1.442 -9.871 -4.360 1.00 . A A . 10 PRO HD3 1 1 2 427 1 1 10 PRO HG2 H 1.253 -8.618 -4.623 1.00 . A A . 10 PRO HG2 1 1 2 428 1 1 10 PRO HG3 H -0.195 -8.402 -5.624 1.00 . A A . 10 PRO HG3 1 1 2 429 1 1 10 PRO N N 0.180 -11.191 -4.048 1.00 . A A . 10 PRO N 1 1 2 430 1 1 10 PRO O O 3.289 -12.410 -5.095 1.00 . A A . 10 PRO O 1 1 2 431 1 1 11 LEU C C 4.340 -10.761 -1.819 1.00 . A A . 11 LEU C 1 1 2 432 1 1 11 LEU CA C 4.331 -10.546 -3.329 1.00 . A A . 11 LEU CA 1 1 2 433 1 1 11 LEU CB C 5.011 -9.220 -3.671 1.00 . A A . 11 LEU CB 1 1 2 434 1 1 11 LEU CD1 C 4.770 -6.821 -4.359 1.00 . A A . 11 LEU CD1 1 1 2 435 1 1 11 LEU CD2 C 4.032 -8.643 -5.906 1.00 . A A . 11 LEU CD2 1 1 2 436 1 1 11 LEU CG C 4.165 -8.214 -4.452 1.00 . A A . 11 LEU CG 1 1 2 437 1 1 11 LEU H H 2.341 -9.867 -3.567 1.00 . A A . 11 LEU H 1 1 2 438 1 1 11 LEU HA H 4.875 -11.352 -3.798 1.00 . A A . 11 LEU HA 1 1 2 439 1 1 11 LEU HB2 H 5.309 -8.753 -2.745 1.00 . A A . 11 LEU HB2 1 1 2 440 1 1 11 LEU HB3 H 5.890 -9.442 -4.260 1.00 . A A . 11 LEU HB3 1 1 2 441 1 1 11 LEU HD11 H 4.223 -6.239 -3.634 1.00 . A A . 11 LEU HD11 1 1 2 442 1 1 11 LEU HD12 H 4.715 -6.340 -5.324 1.00 . A A . 11 LEU HD12 1 1 2 443 1 1 11 LEU HD13 H 5.804 -6.898 -4.054 1.00 . A A . 11 LEU HD13 1 1 2 444 1 1 11 LEU HD21 H 4.830 -8.202 -6.485 1.00 . A A . 11 LEU HD21 1 1 2 445 1 1 11 LEU HD22 H 3.080 -8.312 -6.293 1.00 . A A . 11 LEU HD22 1 1 2 446 1 1 11 LEU HD23 H 4.093 -9.719 -5.970 1.00 . A A . 11 LEU HD23 1 1 2 447 1 1 11 LEU HG H 3.174 -8.175 -4.022 1.00 . A A . 11 LEU HG 1 1 2 448 1 1 11 LEU N N 2.968 -10.564 -3.849 1.00 . A A . 11 LEU N 1 1 2 449 1 1 11 LEU O O 4.625 -11.858 -1.338 1.00 . A A . 11 LEU O 1 1 2 450 1 1 12 PHE C C 2.618 -9.393 0.917 1.00 . A A . 12 PHE C 1 1 2 451 1 1 12 PHE CA C 3.994 -9.779 0.381 1.00 . A A . 12 PHE CA 1 1 2 452 1 1 12 PHE CB C 5.062 -8.862 0.981 1.00 . A A . 12 PHE CB 1 1 2 453 1 1 12 PHE CD1 C 4.955 -6.643 -0.186 1.00 . A A . 12 PHE CD1 1 1 2 454 1 1 12 PHE CD2 C 6.754 -8.115 -0.715 1.00 . A A . 12 PHE CD2 1 1 2 455 1 1 12 PHE CE1 C 5.449 -5.712 -1.081 1.00 . A A . 12 PHE CE1 1 1 2 456 1 1 12 PHE CE2 C 7.253 -7.189 -1.610 1.00 . A A . 12 PHE CE2 1 1 2 457 1 1 12 PHE CG C 5.601 -7.853 0.008 1.00 . A A . 12 PHE CG 1 1 2 458 1 1 12 PHE CZ C 6.599 -5.986 -1.794 1.00 . A A . 12 PHE CZ 1 1 2 459 1 1 12 PHE H H 3.806 -8.858 -1.516 1.00 . A A . 12 PHE H 1 1 2 460 1 1 12 PHE HA H 4.205 -10.798 0.666 1.00 . A A . 12 PHE HA 1 1 2 461 1 1 12 PHE HB2 H 4.637 -8.323 1.815 1.00 . A A . 12 PHE HB2 1 1 2 462 1 1 12 PHE HB3 H 5.888 -9.463 1.329 1.00 . A A . 12 PHE HB3 1 1 2 463 1 1 12 PHE HD1 H 4.054 -6.428 0.372 1.00 . A A . 12 PHE HD1 1 1 2 464 1 1 12 PHE HD2 H 7.267 -9.056 -0.573 1.00 . A A . 12 PHE HD2 1 1 2 465 1 1 12 PHE HE1 H 4.935 -4.773 -1.222 1.00 . A A . 12 PHE HE1 1 1 2 466 1 1 12 PHE HE2 H 8.152 -7.405 -2.168 1.00 . A A . 12 PHE HE2 1 1 2 467 1 1 12 PHE HZ H 6.987 -5.260 -2.493 1.00 . A A . 12 PHE HZ 1 1 2 468 1 1 12 PHE N N 4.024 -9.706 -1.075 1.00 . A A . 12 PHE N 1 1 2 469 1 1 12 PHE O O 2.368 -8.233 1.239 1.00 . A A . 12 PHE O 1 1 2 470 1 1 13 GLY C C 0.253 -10.417 2.986 1.00 . A A . 13 GLY C 1 1 2 471 1 1 13 GLY CA C 0.389 -10.122 1.505 1.00 . A A . 13 GLY CA 1 1 2 472 1 1 13 GLY H H 1.984 -11.284 0.737 1.00 . A A . 13 GLY H 1 1 2 473 1 1 13 GLY HA2 H 0.144 -9.085 1.331 1.00 . A A . 13 GLY HA2 1 1 2 474 1 1 13 GLY HA3 H -0.309 -10.742 0.961 1.00 . A A . 13 GLY HA3 1 1 2 475 1 1 13 GLY N N 1.728 -10.377 1.009 1.00 . A A . 13 GLY N 1 1 2 476 1 1 13 GLY O O -0.837 -10.314 3.550 1.00 . A A . 13 GLY O 1 1 2 477 1 1 14 LYS C C 1.290 -9.826 5.878 1.00 . A A . 14 LYS C 1 1 2 478 1 1 14 LYS CA C 1.362 -11.100 5.042 1.00 . A A . 14 LYS CA 1 1 2 479 1 1 14 LYS CB C 2.618 -11.894 5.410 1.00 . A A . 14 LYS CB 1 1 2 480 1 1 14 LYS CD C 4.629 -12.083 3.917 1.00 . A A . 14 LYS CD 1 1 2 481 1 1 14 LYS CE C 5.050 -13.427 4.490 1.00 . A A . 14 LYS CE 1 1 2 482 1 1 14 LYS CG C 3.909 -11.236 4.953 1.00 . A A . 14 LYS CG 1 1 2 483 1 1 14 LYS H H 2.200 -10.852 3.113 1.00 . A A . 14 LYS H 1 1 2 484 1 1 14 LYS HA H 0.491 -11.703 5.250 1.00 . A A . 14 LYS HA 1 1 2 485 1 1 14 LYS HB2 H 2.656 -12.007 6.483 1.00 . A A . 14 LYS HB2 1 1 2 486 1 1 14 LYS HB3 H 2.556 -12.872 4.956 1.00 . A A . 14 LYS HB3 1 1 2 487 1 1 14 LYS HD2 H 3.967 -12.252 3.080 1.00 . A A . 14 LYS HD2 1 1 2 488 1 1 14 LYS HD3 H 5.509 -11.553 3.580 1.00 . A A . 14 LYS HD3 1 1 2 489 1 1 14 LYS HE2 H 5.165 -13.328 5.558 1.00 . A A . 14 LYS HE2 1 1 2 490 1 1 14 LYS HE3 H 4.278 -14.152 4.276 1.00 . A A . 14 LYS HE3 1 1 2 491 1 1 14 LYS HG2 H 3.678 -10.275 4.520 1.00 . A A . 14 LYS HG2 1 1 2 492 1 1 14 LYS HG3 H 4.556 -11.103 5.808 1.00 . A A . 14 LYS HG3 1 1 2 493 1 1 14 LYS HZ1 H 6.631 -14.787 4.364 1.00 . A A . 14 LYS HZ1 1 1 2 494 1 1 14 LYS HZ2 H 7.077 -13.186 4.047 1.00 . A A . 14 LYS HZ2 1 1 2 495 1 1 14 LYS HZ3 H 6.223 -14.072 2.886 1.00 . A A . 14 LYS HZ3 1 1 2 496 1 1 14 LYS N N 1.361 -10.788 3.618 1.00 . A A . 14 LYS N 1 1 2 497 1 1 14 LYS NZ N 6.335 -13.901 3.906 1.00 . A A . 14 LYS NZ 1 1 2 498 1 1 14 LYS O O 0.681 -9.808 6.947 1.00 . A A . 14 LYS O 1 1 2 499 1 1 15 GLY C C 1.290 -6.378 5.286 1.00 . A A . 15 GLY C 1 1 2 500 1 1 15 GLY CA C 1.908 -7.499 6.097 1.00 . A A . 15 GLY CA 1 1 2 501 1 1 15 GLY H H 2.385 -8.836 4.526 1.00 . A A . 15 GLY H 1 1 2 502 1 1 15 GLY HA2 H 1.347 -7.618 7.012 1.00 . A A . 15 GLY HA2 1 1 2 503 1 1 15 GLY HA3 H 2.925 -7.231 6.342 1.00 . A A . 15 GLY HA3 1 1 2 504 1 1 15 GLY N N 1.915 -8.762 5.383 1.00 . A A . 15 GLY N 1 1 2 505 1 1 15 GLY O O 0.662 -5.475 5.838 1.00 . A A . 15 GLY O 1 1 2 506 1 1 16 GLY C C 1.286 -4.009 3.553 1.00 . A A . 16 GLY C 1 1 2 507 1 1 16 GLY CA C 0.919 -5.408 3.102 1.00 . A A . 16 GLY CA 1 1 2 508 1 1 16 GLY H H 1.977 -7.178 3.584 1.00 . A A . 16 GLY H 1 1 2 509 1 1 16 GLY HA2 H 1.292 -5.562 2.100 1.00 . A A . 16 GLY HA2 1 1 2 510 1 1 16 GLY HA3 H -0.157 -5.500 3.092 1.00 . A A . 16 GLY HA3 1 1 2 511 1 1 16 GLY N N 1.468 -6.434 3.969 1.00 . A A . 16 GLY N 1 1 2 512 1 1 16 GLY O O 2.382 -3.525 3.268 1.00 . A A . 16 GLY O 1 1 3 513 1 1 1 VAL C C 1.191 -0.913 -2.277 1.00 . A A . 1 VAL C 1 1 3 514 1 1 1 VAL CA C 1.848 -0.250 -1.072 1.00 . A A . 1 VAL CA 1 1 3 515 1 1 1 VAL CB C 2.387 -1.343 -0.129 1.00 . A A . 1 VAL CB 1 1 3 516 1 1 1 VAL CG1 C 3.085 -2.437 -0.924 1.00 . A A . 1 VAL CG1 1 1 3 517 1 1 1 VAL CG2 C 3.328 -0.739 0.902 1.00 . A A . 1 VAL CG2 1 1 3 518 1 1 1 VAL H1 H 0.558 0.363 0.490 1.00 . A A . 1 VAL H1 1 1 3 519 1 1 1 VAL HA H 2.682 0.347 -1.411 1.00 . A A . 1 VAL HA 1 1 3 520 1 1 1 VAL HB H 1.551 -1.785 0.392 1.00 . A A . 1 VAL HB 1 1 3 521 1 1 1 VAL HG11 H 3.629 -1.993 -1.745 1.00 . A A . 1 VAL HG11 1 1 3 522 1 1 1 VAL HG12 H 3.770 -2.968 -0.280 1.00 . A A . 1 VAL HG12 1 1 3 523 1 1 1 VAL HG13 H 2.348 -3.125 -1.311 1.00 . A A . 1 VAL HG13 1 1 3 524 1 1 1 VAL HG21 H 3.709 -1.521 1.542 1.00 . A A . 1 VAL HG21 1 1 3 525 1 1 1 VAL HG22 H 4.152 -0.253 0.398 1.00 . A A . 1 VAL HG22 1 1 3 526 1 1 1 VAL HG23 H 2.794 -0.014 1.498 1.00 . A A . 1 VAL HG23 1 1 3 527 1 1 1 VAL N N 0.914 0.632 -0.383 1.00 . A A . 1 VAL N 1 1 3 528 1 1 1 VAL O O 1.418 -0.514 -3.419 1.00 . A A . 1 VAL O 1 1 3 529 1 1 2 ALA C C -1.826 -2.649 -2.846 1.00 . A A . 2 ALA C 1 1 3 530 1 1 2 ALA CA C -0.319 -2.645 -3.078 1.00 . A A . 2 ALA CA 1 1 3 531 1 1 2 ALA CB C 0.205 -4.070 -3.181 1.00 . A A . 2 ALA CB 1 1 3 532 1 1 2 ALA H H 0.233 -2.200 -1.084 1.00 . A A . 2 ALA H 1 1 3 533 1 1 2 ALA HA H -0.109 -2.142 -4.011 1.00 . A A . 2 ALA HA 1 1 3 534 1 1 2 ALA HB1 H 0.166 -4.393 -4.212 1.00 . A A . 2 ALA HB1 1 1 3 535 1 1 2 ALA HB2 H 1.225 -4.105 -2.831 1.00 . A A . 2 ALA HB2 1 1 3 536 1 1 2 ALA HB3 H -0.407 -4.723 -2.576 1.00 . A A . 2 ALA HB3 1 1 3 537 1 1 2 ALA N N 0.374 -1.928 -2.015 1.00 . A A . 2 ALA N 1 1 3 538 1 1 2 ALA O O -2.304 -3.131 -1.820 1.00 . A A . 2 ALA O 1 1 3 539 1 1 3 ARG C C -4.601 -3.418 -3.370 1.00 . A A . 3 ARG C 1 1 3 540 1 1 3 ARG CA C -4.022 -2.047 -3.705 1.00 . A A . 3 ARG CA 1 1 3 541 1 1 3 ARG CB C -4.624 -1.532 -5.013 1.00 . A A . 3 ARG CB 1 1 3 542 1 1 3 ARG CD C -4.768 -2.000 -7.478 1.00 . A A . 3 ARG CD 1 1 3 543 1 1 3 ARG CG C -4.764 -2.603 -6.082 1.00 . A A . 3 ARG CG 1 1 3 544 1 1 3 ARG CZ C -6.297 -1.909 -9.402 1.00 . A A . 3 ARG CZ 1 1 3 545 1 1 3 ARG H H -2.129 -1.739 -4.601 1.00 . A A . 3 ARG H 1 1 3 546 1 1 3 ARG HA H -4.271 -1.360 -2.910 1.00 . A A . 3 ARG HA 1 1 3 547 1 1 3 ARG HB2 H -5.605 -1.127 -4.810 1.00 . A A . 3 ARG HB2 1 1 3 548 1 1 3 ARG HB3 H -3.993 -0.747 -5.401 1.00 . A A . 3 ARG HB3 1 1 3 549 1 1 3 ARG HD2 H -4.464 -0.966 -7.410 1.00 . A A . 3 ARG HD2 1 1 3 550 1 1 3 ARG HD3 H -4.065 -2.542 -8.092 1.00 . A A . 3 ARG HD3 1 1 3 551 1 1 3 ARG HE H -6.857 -2.232 -7.515 1.00 . A A . 3 ARG HE 1 1 3 552 1 1 3 ARG HG2 H -3.934 -3.290 -6.002 1.00 . A A . 3 ARG HG2 1 1 3 553 1 1 3 ARG HG3 H -5.691 -3.135 -5.927 1.00 . A A . 3 ARG HG3 1 1 3 554 1 1 3 ARG HH11 H -4.348 -1.627 -9.851 1.00 . A A . 3 ARG HH11 1 1 3 555 1 1 3 ARG HH12 H -5.436 -1.566 -11.198 1.00 . A A . 3 ARG HH12 1 1 3 556 1 1 3 ARG HH21 H -8.300 -2.154 -9.280 1.00 . A A . 3 ARG HH21 1 1 3 557 1 1 3 ARG HH22 H -7.684 -1.865 -10.872 1.00 . A A . 3 ARG HH22 1 1 3 558 1 1 3 ARG N N -2.569 -2.107 -3.806 1.00 . A A . 3 ARG N 1 1 3 559 1 1 3 ARG NE N -6.088 -2.065 -8.099 1.00 . A A . 3 ARG NE 1 1 3 560 1 1 3 ARG NH1 N -5.276 -1.681 -10.217 1.00 . A A . 3 ARG NH1 1 1 3 561 1 1 3 ARG NH2 N -7.528 -1.982 -9.891 1.00 . A A . 3 ARG NH2 1 1 3 562 1 1 3 ARG O O -5.646 -3.522 -2.729 1.00 . A A . 3 ARG O 1 1 3 563 1 1 4 GLY C C -3.389 -6.620 -2.725 1.00 . A A . 4 GLY C 1 1 3 564 1 1 4 GLY CA C -4.377 -5.819 -3.549 1.00 . A A . 4 GLY CA 1 1 3 565 1 1 4 GLY H H -3.088 -4.325 -4.317 1.00 . A A . 4 GLY H 1 1 3 566 1 1 4 GLY HA2 H -5.316 -5.770 -3.019 1.00 . A A . 4 GLY HA2 1 1 3 567 1 1 4 GLY HA3 H -4.533 -6.323 -4.492 1.00 . A A . 4 GLY HA3 1 1 3 568 1 1 4 GLY N N -3.915 -4.468 -3.810 1.00 . A A . 4 GLY N 1 1 3 569 1 1 4 GLY O O -2.356 -7.057 -3.233 1.00 . A A . 4 GLY O 1 1 3 570 1 1 5 TRP C C -3.578 -8.748 0.060 1.00 . A A . 5 TRP C 1 1 3 571 1 1 5 TRP CA C -2.835 -7.566 -0.552 1.00 . A A . 5 TRP CA 1 1 3 572 1 1 5 TRP CB C -2.299 -6.656 0.554 1.00 . A A . 5 TRP CB 1 1 3 573 1 1 5 TRP CD1 C -0.717 -4.646 0.397 1.00 . A A . 5 TRP CD1 1 1 3 574 1 1 5 TRP CD2 C 0.113 -6.539 -0.464 1.00 . A A . 5 TRP CD2 1 1 3 575 1 1 5 TRP CE2 C 1.073 -5.520 -0.612 1.00 . A A . 5 TRP CE2 1 1 3 576 1 1 5 TRP CE3 C 0.414 -7.821 -0.931 1.00 . A A . 5 TRP CE3 1 1 3 577 1 1 5 TRP CG C -1.024 -5.959 0.185 1.00 . A A . 5 TRP CG 1 1 3 578 1 1 5 TRP CH2 C 2.579 -7.009 -1.658 1.00 . A A . 5 TRP CH2 1 1 3 579 1 1 5 TRP CZ2 C 2.311 -5.744 -1.209 1.00 . A A . 5 TRP CZ2 1 1 3 580 1 1 5 TRP CZ3 C 1.643 -8.043 -1.524 1.00 . A A . 5 TRP CZ3 1 1 3 581 1 1 5 TRP H H -4.542 -6.440 -1.102 1.00 . A A . 5 TRP H 1 1 3 582 1 1 5 TRP HA H -2.004 -7.939 -1.133 1.00 . A A . 5 TRP HA 1 1 3 583 1 1 5 TRP HB2 H -3.037 -5.902 0.781 1.00 . A A . 5 TRP HB2 1 1 3 584 1 1 5 TRP HB3 H -2.111 -7.249 1.438 1.00 . A A . 5 TRP HB3 1 1 3 585 1 1 5 TRP HD1 H -1.378 -3.935 0.870 1.00 . A A . 5 TRP HD1 1 1 3 586 1 1 5 TRP HE1 H 0.989 -3.502 -0.044 1.00 . A A . 5 TRP HE1 1 1 3 587 1 1 5 TRP HE3 H -0.294 -8.631 -0.836 1.00 . A A . 5 TRP HE3 1 1 3 588 1 1 5 TRP HH2 H 3.526 -7.227 -2.127 1.00 . A A . 5 TRP HH2 1 1 3 589 1 1 5 TRP HZ2 H 3.043 -4.958 -1.320 1.00 . A A . 5 TRP HZ2 1 1 3 590 1 1 5 TRP HZ3 H 1.893 -9.027 -1.891 1.00 . A A . 5 TRP HZ3 1 1 3 591 1 1 5 TRP N N -3.704 -6.813 -1.449 1.00 . A A . 5 TRP N 1 1 3 592 1 1 5 TRP NE1 N 0.543 -4.374 -0.080 1.00 . A A . 5 TRP NE1 1 1 3 593 1 1 5 TRP O O -3.439 -9.884 -0.394 1.00 . A A . 5 TRP O 1 1 3 594 1 1 6 LYS C C -5.471 -10.651 0.807 1.00 . A A . 6 LYS C 1 1 3 595 1 1 6 LYS CA C -5.133 -9.516 1.768 1.00 . A A . 6 LYS CA 1 1 3 596 1 1 6 LYS CB C -6.420 -8.931 2.355 1.00 . A A . 6 LYS CB 1 1 3 597 1 1 6 LYS CD C -6.570 -6.428 2.202 1.00 . A A . 6 LYS CD 1 1 3 598 1 1 6 LYS CE C -6.468 -5.322 1.164 1.00 . A A . 6 LYS CE 1 1 3 599 1 1 6 LYS CG C -6.966 -7.751 1.569 1.00 . A A . 6 LYS CG 1 1 3 600 1 1 6 LYS H H -4.436 -7.549 1.410 1.00 . A A . 6 LYS H 1 1 3 601 1 1 6 LYS HA H -4.527 -9.907 2.570 1.00 . A A . 6 LYS HA 1 1 3 602 1 1 6 LYS HB2 H -7.175 -9.703 2.377 1.00 . A A . 6 LYS HB2 1 1 3 603 1 1 6 LYS HB3 H -6.223 -8.603 3.366 1.00 . A A . 6 LYS HB3 1 1 3 604 1 1 6 LYS HD2 H -7.315 -6.151 2.934 1.00 . A A . 6 LYS HD2 1 1 3 605 1 1 6 LYS HD3 H -5.612 -6.544 2.688 1.00 . A A . 6 LYS HD3 1 1 3 606 1 1 6 LYS HE2 H -5.736 -5.607 0.424 1.00 . A A . 6 LYS HE2 1 1 3 607 1 1 6 LYS HE3 H -7.430 -5.201 0.689 1.00 . A A . 6 LYS HE3 1 1 3 608 1 1 6 LYS HG2 H -6.575 -7.788 0.564 1.00 . A A . 6 LYS HG2 1 1 3 609 1 1 6 LYS HG3 H -8.045 -7.818 1.541 1.00 . A A . 6 LYS HG3 1 1 3 610 1 1 6 LYS HZ1 H -5.051 -3.849 1.597 1.00 . A A . 6 LYS HZ1 1 1 3 611 1 1 6 LYS HZ2 H -6.225 -4.046 2.799 1.00 . A A . 6 LYS HZ2 1 1 3 612 1 1 6 LYS HZ3 H -6.614 -3.247 1.360 1.00 . A A . 6 LYS HZ3 1 1 3 613 1 1 6 LYS N N -4.367 -8.475 1.093 1.00 . A A . 6 LYS N 1 1 3 614 1 1 6 LYS NZ N -6.061 -4.025 1.773 1.00 . A A . 6 LYS NZ 1 1 3 615 1 1 6 LYS O O -5.138 -11.809 1.059 1.00 . A A . 6 LYS O 1 1 3 616 1 1 7 ARG C C -5.329 -11.665 -2.181 1.00 . A A . 7 ARG C 1 1 3 617 1 1 7 ARG CA C -6.515 -11.304 -1.292 1.00 . A A . 7 ARG CA 1 1 3 618 1 1 7 ARG CB C -7.667 -10.778 -2.150 1.00 . A A . 7 ARG CB 1 1 3 619 1 1 7 ARG CD C -9.447 -9.745 -0.706 1.00 . A A . 7 ARG CD 1 1 3 620 1 1 7 ARG CG C -9.035 -10.966 -1.514 1.00 . A A . 7 ARG CG 1 1 3 621 1 1 7 ARG CZ C -11.484 -8.424 -0.321 1.00 . A A . 7 ARG CZ 1 1 3 622 1 1 7 ARG H H -6.370 -9.372 -0.439 1.00 . A A . 7 ARG H 1 1 3 623 1 1 7 ARG HA H -6.842 -12.191 -0.770 1.00 . A A . 7 ARG HA 1 1 3 624 1 1 7 ARG HB2 H -7.518 -9.722 -2.324 1.00 . A A . 7 ARG HB2 1 1 3 625 1 1 7 ARG HB3 H -7.660 -11.295 -3.097 1.00 . A A . 7 ARG HB3 1 1 3 626 1 1 7 ARG HD2 H -9.425 -9.999 0.343 1.00 . A A . 7 ARG HD2 1 1 3 627 1 1 7 ARG HD3 H -8.742 -8.949 -0.898 1.00 . A A . 7 ARG HD3 1 1 3 628 1 1 7 ARG HE H -11.189 -9.636 -1.877 1.00 . A A . 7 ARG HE 1 1 3 629 1 1 7 ARG HG2 H -9.764 -11.131 -2.293 1.00 . A A . 7 ARG HG2 1 1 3 630 1 1 7 ARG HG3 H -9.002 -11.825 -0.860 1.00 . A A . 7 ARG HG3 1 1 3 631 1 1 7 ARG HH11 H -10.051 -8.208 1.087 1.00 . A A . 7 ARG HH11 1 1 3 632 1 1 7 ARG HH12 H -11.493 -7.282 1.347 1.00 . A A . 7 ARG HH12 1 1 3 633 1 1 7 ARG HH21 H -13.092 -8.423 -1.546 1.00 . A A . 7 ARG HH21 1 1 3 634 1 1 7 ARG HH22 H -13.222 -7.406 -0.151 1.00 . A A . 7 ARG HH22 1 1 3 635 1 1 7 ARG N N -6.133 -10.312 -0.294 1.00 . A A . 7 ARG N 1 1 3 636 1 1 7 ARG NE N -10.788 -9.285 -1.055 1.00 . A A . 7 ARG NE 1 1 3 637 1 1 7 ARG NH1 N -10.967 -7.931 0.797 1.00 . A A . 7 ARG NH1 1 1 3 638 1 1 7 ARG NH2 N -12.699 -8.054 -0.704 1.00 . A A . 7 ARG NH2 1 1 3 639 1 1 7 ARG O O -4.733 -12.733 -2.037 1.00 . A A . 7 ARG O 1 1 3 640 1 1 8 LYS C C -2.542 -10.855 -3.287 1.00 . A A . 8 LYS C 1 1 3 641 1 1 8 LYS CA C -3.876 -10.990 -4.015 1.00 . A A . 8 LYS CA 1 1 3 642 1 1 8 LYS CB C -3.937 -9.998 -5.178 1.00 . A A . 8 LYS CB 1 1 3 643 1 1 8 LYS CD C -5.355 -10.334 -7.224 1.00 . A A . 8 LYS CD 1 1 3 644 1 1 8 LYS CE C -6.528 -11.012 -6.533 1.00 . A A . 8 LYS CE 1 1 3 645 1 1 8 LYS CG C -4.039 -10.663 -6.540 1.00 . A A . 8 LYS CG 1 1 3 646 1 1 8 LYS H H -5.504 -9.935 -3.168 1.00 . A A . 8 LYS H 1 1 3 647 1 1 8 LYS HA H -3.960 -11.994 -4.403 1.00 . A A . 8 LYS HA 1 1 3 648 1 1 8 LYS HB2 H -4.799 -9.360 -5.047 1.00 . A A . 8 LYS HB2 1 1 3 649 1 1 8 LYS HB3 H -3.044 -9.390 -5.164 1.00 . A A . 8 LYS HB3 1 1 3 650 1 1 8 LYS HD2 H -5.507 -9.265 -7.199 1.00 . A A . 8 LYS HD2 1 1 3 651 1 1 8 LYS HD3 H -5.311 -10.669 -8.251 1.00 . A A . 8 LYS HD3 1 1 3 652 1 1 8 LYS HE2 H -6.615 -12.021 -6.906 1.00 . A A . 8 LYS HE2 1 1 3 653 1 1 8 LYS HE3 H -6.337 -11.036 -5.470 1.00 . A A . 8 LYS HE3 1 1 3 654 1 1 8 LYS HG2 H -3.226 -10.318 -7.161 1.00 . A A . 8 LYS HG2 1 1 3 655 1 1 8 LYS HG3 H -3.968 -11.734 -6.413 1.00 . A A . 8 LYS HG3 1 1 3 656 1 1 8 LYS HZ1 H -7.638 -9.267 -6.830 1.00 . A A . 8 LYS HZ1 1 1 3 657 1 1 8 LYS HZ2 H -8.479 -10.482 -6.007 1.00 . A A . 8 LYS HZ2 1 1 3 658 1 1 8 LYS HZ3 H -8.230 -10.608 -7.676 1.00 . A A . 8 LYS HZ3 1 1 3 659 1 1 8 LYS N N -4.991 -10.768 -3.102 1.00 . A A . 8 LYS N 1 1 3 660 1 1 8 LYS NZ N -7.808 -10.292 -6.779 1.00 . A A . 8 LYS NZ 1 1 3 661 1 1 8 LYS O O -2.177 -9.768 -2.837 1.00 . A A . 8 LYS O 1 1 3 662 1 1 9 CYS C C 0.600 -12.260 -3.493 1.00 . A A . 9 CYS C 1 1 3 663 1 1 9 CYS CA C -0.524 -11.968 -2.505 1.00 . A A . 9 CYS CA 1 1 3 664 1 1 9 CYS CB C -0.514 -13.006 -1.381 1.00 . A A . 9 CYS CB 1 1 3 665 1 1 9 CYS H H -2.163 -12.799 -3.556 1.00 . A A . 9 CYS H 1 1 3 666 1 1 9 CYS HA H -0.369 -10.988 -2.080 1.00 . A A . 9 CYS HA 1 1 3 667 1 1 9 CYS HB2 H -0.469 -13.994 -1.814 1.00 . A A . 9 CYS HB2 1 1 3 668 1 1 9 CYS HB3 H 0.360 -12.850 -0.766 1.00 . A A . 9 CYS HB3 1 1 3 669 1 1 9 CYS HG H -1.542 -12.865 0.948 1.00 . A A . 9 CYS HG 1 1 3 670 1 1 9 CYS N N -1.819 -11.964 -3.177 1.00 . A A . 9 CYS N 1 1 3 671 1 1 9 CYS O O 1.177 -13.347 -3.512 1.00 . A A . 9 CYS O 1 1 3 672 1 1 9 CYS SG S -1.965 -12.943 -0.305 1.00 . A A . 9 CYS SG 1 1 3 673 1 1 10 PRO C C 3.368 -11.443 -4.720 1.00 . A A . 10 PRO C 1 1 3 674 1 1 10 PRO CA C 1.977 -11.392 -5.343 1.00 . A A . 10 PRO CA 1 1 3 675 1 1 10 PRO CB C 1.816 -10.125 -6.187 1.00 . A A . 10 PRO CB 1 1 3 676 1 1 10 PRO CD C 0.274 -9.943 -4.369 1.00 . A A . 10 PRO CD 1 1 3 677 1 1 10 PRO CG C 1.169 -9.142 -5.274 1.00 . A A . 10 PRO CG 1 1 3 678 1 1 10 PRO HA H 1.830 -12.263 -5.965 1.00 . A A . 10 PRO HA 1 1 3 679 1 1 10 PRO HB2 H 2.787 -9.782 -6.515 1.00 . A A . 10 PRO HB2 1 1 3 680 1 1 10 PRO HB3 H 1.194 -10.336 -7.044 1.00 . A A . 10 PRO HB3 1 1 3 681 1 1 10 PRO HD2 H 0.244 -9.504 -3.383 1.00 . A A . 10 PRO HD2 1 1 3 682 1 1 10 PRO HD3 H -0.720 -10.011 -4.784 1.00 . A A . 10 PRO HD3 1 1 3 683 1 1 10 PRO HG2 H 1.921 -8.626 -4.697 1.00 . A A . 10 PRO HG2 1 1 3 684 1 1 10 PRO HG3 H 0.585 -8.437 -5.848 1.00 . A A . 10 PRO HG3 1 1 3 685 1 1 10 PRO N N 0.920 -11.266 -4.335 1.00 . A A . 10 PRO N 1 1 3 686 1 1 10 PRO O O 4.187 -12.292 -5.075 1.00 . A A . 10 PRO O 1 1 3 687 1 1 11 LEU C C 4.772 -10.744 -1.625 1.00 . A A . 11 LEU C 1 1 3 688 1 1 11 LEU CA C 4.922 -10.472 -3.118 1.00 . A A . 11 LEU CA 1 1 3 689 1 1 11 LEU CB C 5.572 -9.105 -3.336 1.00 . A A . 11 LEU CB 1 1 3 690 1 1 11 LEU CD1 C 5.288 -6.692 -3.954 1.00 . A A . 11 LEU CD1 1 1 3 691 1 1 11 LEU CD2 C 4.820 -8.477 -5.643 1.00 . A A . 11 LEU CD2 1 1 3 692 1 1 11 LEU CG C 4.768 -8.105 -4.169 1.00 . A A . 11 LEU CG 1 1 3 693 1 1 11 LEU H H 2.937 -9.881 -3.551 1.00 . A A . 11 LEU H 1 1 3 694 1 1 11 LEU HA H 5.555 -11.235 -3.548 1.00 . A A . 11 LEU HA 1 1 3 695 1 1 11 LEU HB2 H 5.745 -8.663 -2.367 1.00 . A A . 11 LEU HB2 1 1 3 696 1 1 11 LEU HB3 H 6.519 -9.264 -3.832 1.00 . A A . 11 LEU HB3 1 1 3 697 1 1 11 LEU HD11 H 4.631 -6.166 -3.278 1.00 . A A . 11 LEU HD11 1 1 3 698 1 1 11 LEU HD12 H 5.321 -6.174 -4.901 1.00 . A A . 11 LEU HD12 1 1 3 699 1 1 11 LEU HD13 H 6.281 -6.734 -3.533 1.00 . A A . 11 LEU HD13 1 1 3 700 1 1 11 LEU HD21 H 4.939 -9.546 -5.741 1.00 . A A . 11 LEU HD21 1 1 3 701 1 1 11 LEU HD22 H 5.656 -7.977 -6.111 1.00 . A A . 11 LEU HD22 1 1 3 702 1 1 11 LEU HD23 H 3.902 -8.171 -6.124 1.00 . A A . 11 LEU HD23 1 1 3 703 1 1 11 LEU HG H 3.734 -8.132 -3.852 1.00 . A A . 11 LEU HG 1 1 3 704 1 1 11 LEU N N 3.629 -10.531 -3.791 1.00 . A A . 11 LEU N 1 1 3 705 1 1 11 LEU O O 5.053 -11.846 -1.152 1.00 . A A . 11 LEU O 1 1 3 706 1 1 12 PHE C C 2.691 -9.556 0.942 1.00 . A A . 12 PHE C 1 1 3 707 1 1 12 PHE CA C 4.134 -9.864 0.553 1.00 . A A . 12 PHE CA 1 1 3 708 1 1 12 PHE CB C 5.086 -8.929 1.301 1.00 . A A . 12 PHE CB 1 1 3 709 1 1 12 PHE CD1 C 4.989 -6.667 0.219 1.00 . A A . 12 PHE CD1 1 1 3 710 1 1 12 PHE CD2 C 6.910 -8.026 -0.167 1.00 . A A . 12 PHE CD2 1 1 3 711 1 1 12 PHE CE1 C 5.526 -5.675 -0.579 1.00 . A A . 12 PHE CE1 1 1 3 712 1 1 12 PHE CE2 C 7.453 -7.037 -0.965 1.00 . A A . 12 PHE CE2 1 1 3 713 1 1 12 PHE CG C 5.674 -7.852 0.434 1.00 . A A . 12 PHE CG 1 1 3 714 1 1 12 PHE CZ C 6.760 -5.860 -1.172 1.00 . A A . 12 PHE CZ 1 1 3 715 1 1 12 PHE H H 4.116 -8.880 -1.321 1.00 . A A . 12 PHE H 1 1 3 716 1 1 12 PHE HA H 4.358 -10.884 0.825 1.00 . A A . 12 PHE HA 1 1 3 717 1 1 12 PHE HB2 H 4.550 -8.450 2.107 1.00 . A A . 12 PHE HB2 1 1 3 718 1 1 12 PHE HB3 H 5.900 -9.508 1.710 1.00 . A A . 12 PHE HB3 1 1 3 719 1 1 12 PHE HD1 H 4.023 -6.522 0.682 1.00 . A A . 12 PHE HD1 1 1 3 720 1 1 12 PHE HD2 H 7.453 -8.946 -0.007 1.00 . A A . 12 PHE HD2 1 1 3 721 1 1 12 PHE HE1 H 4.981 -4.756 -0.739 1.00 . A A . 12 PHE HE1 1 1 3 722 1 1 12 PHE HE2 H 8.417 -7.184 -1.428 1.00 . A A . 12 PHE HE2 1 1 3 723 1 1 12 PHE HZ H 7.182 -5.085 -1.795 1.00 . A A . 12 PHE HZ 1 1 3 724 1 1 12 PHE N N 4.324 -9.734 -0.887 1.00 . A A . 12 PHE N 1 1 3 725 1 1 12 PHE O O 2.352 -8.417 1.259 1.00 . A A . 12 PHE O 1 1 3 726 1 1 13 GLY C C 0.161 -10.763 2.708 1.00 . A A . 13 GLY C 1 1 3 727 1 1 13 GLY CA C 0.448 -10.400 1.264 1.00 . A A . 13 GLY CA 1 1 3 728 1 1 13 GLY H H 2.172 -11.468 0.653 1.00 . A A . 13 GLY H 1 1 3 729 1 1 13 GLY HA2 H 0.179 -9.367 1.103 1.00 . A A . 13 GLY HA2 1 1 3 730 1 1 13 GLY HA3 H -0.156 -11.024 0.621 1.00 . A A . 13 GLY HA3 1 1 3 731 1 1 13 GLY N N 1.845 -10.581 0.914 1.00 . A A . 13 GLY N 1 1 3 732 1 1 13 GLY O O -0.984 -10.699 3.156 1.00 . A A . 13 GLY O 1 1 3 733 1 1 14 LYS C C 0.710 -10.308 5.695 1.00 . A A . 14 LYS C 1 1 3 734 1 1 14 LYS CA C 1.058 -11.522 4.840 1.00 . A A . 14 LYS CA 1 1 3 735 1 1 14 LYS CB C 2.347 -12.167 5.352 1.00 . A A . 14 LYS CB 1 1 3 736 1 1 14 LYS CD C 4.734 -12.134 4.569 1.00 . A A . 14 LYS CD 1 1 3 737 1 1 14 LYS CE C 6.022 -11.326 4.520 1.00 . A A . 14 LYS CE 1 1 3 738 1 1 14 LYS CG C 3.584 -11.314 5.130 1.00 . A A . 14 LYS CG 1 1 3 739 1 1 14 LYS H H 2.091 -11.177 3.024 1.00 . A A . 14 LYS H 1 1 3 740 1 1 14 LYS HA H 0.254 -12.239 4.910 1.00 . A A . 14 LYS HA 1 1 3 741 1 1 14 LYS HB2 H 2.248 -12.351 6.411 1.00 . A A . 14 LYS HB2 1 1 3 742 1 1 14 LYS HB3 H 2.490 -13.110 4.843 1.00 . A A . 14 LYS HB3 1 1 3 743 1 1 14 LYS HD2 H 4.889 -12.998 5.197 1.00 . A A . 14 LYS HD2 1 1 3 744 1 1 14 LYS HD3 H 4.481 -12.454 3.568 1.00 . A A . 14 LYS HD3 1 1 3 745 1 1 14 LYS HE2 H 6.206 -11.029 3.499 1.00 . A A . 14 LYS HE2 1 1 3 746 1 1 14 LYS HE3 H 5.904 -10.447 5.135 1.00 . A A . 14 LYS HE3 1 1 3 747 1 1 14 LYS HG2 H 3.346 -10.524 4.433 1.00 . A A . 14 LYS HG2 1 1 3 748 1 1 14 LYS HG3 H 3.888 -10.884 6.074 1.00 . A A . 14 LYS HG3 1 1 3 749 1 1 14 LYS HZ1 H 7.022 -13.127 4.866 1.00 . A A . 14 LYS HZ1 1 1 3 750 1 1 14 LYS HZ2 H 7.329 -11.938 6.029 1.00 . A A . 14 LYS HZ2 1 1 3 751 1 1 14 LYS HZ3 H 8.049 -11.832 4.502 1.00 . A A . 14 LYS HZ3 1 1 3 752 1 1 14 LYS N N 1.202 -11.147 3.438 1.00 . A A . 14 LYS N 1 1 3 753 1 1 14 LYS NZ N 7.188 -12.110 5.014 1.00 . A A . 14 LYS NZ 1 1 3 754 1 1 14 LYS O O -0.108 -10.395 6.610 1.00 . A A . 14 LYS O 1 1 3 755 1 1 15 GLY C C 0.547 -6.841 5.264 1.00 . A A . 15 GLY C 1 1 3 756 1 1 15 GLY CA C 1.078 -7.959 6.139 1.00 . A A . 15 GLY CA 1 1 3 757 1 1 15 GLY H H 1.978 -9.165 4.649 1.00 . A A . 15 GLY H 1 1 3 758 1 1 15 GLY HA2 H 0.354 -8.173 6.911 1.00 . A A . 15 GLY HA2 1 1 3 759 1 1 15 GLY HA3 H 1.998 -7.633 6.601 1.00 . A A . 15 GLY HA3 1 1 3 760 1 1 15 GLY N N 1.336 -9.175 5.389 1.00 . A A . 15 GLY N 1 1 3 761 1 1 15 GLY O O -0.225 -5.999 5.721 1.00 . A A . 15 GLY O 1 1 3 762 1 1 16 GLY C C 0.709 -4.404 3.637 1.00 . A A . 16 GLY C 1 1 3 763 1 1 16 GLY CA C 0.517 -5.801 3.081 1.00 . A A . 16 GLY CA 1 1 3 764 1 1 16 GLY H H 1.580 -7.527 3.692 1.00 . A A . 16 GLY H 1 1 3 765 1 1 16 GLY HA2 H 1.074 -5.890 2.160 1.00 . A A . 16 GLY HA2 1 1 3 766 1 1 16 GLY HA3 H -0.532 -5.952 2.872 1.00 . A A . 16 GLY HA3 1 1 3 767 1 1 16 GLY N N 0.964 -6.830 4.001 1.00 . A A . 16 GLY N 1 1 3 768 1 1 16 GLY O O -0.135 -3.530 3.441 1.00 . A A . 16 GLY O 1 1 4 769 1 1 1 VAL C C 1.898 -1.307 -2.871 1.00 . A A . 1 VAL C 1 1 4 770 1 1 1 VAL CA C 2.824 -0.717 -1.814 1.00 . A A . 1 VAL CA 1 1 4 771 1 1 1 VAL CB C 4.056 -1.629 -1.660 1.00 . A A . 1 VAL CB 1 1 4 772 1 1 1 VAL CG1 C 3.656 -2.972 -1.069 1.00 . A A . 1 VAL CG1 1 1 4 773 1 1 1 VAL CG2 C 4.753 -1.813 -3.000 1.00 . A A . 1 VAL CG2 1 1 4 774 1 1 1 VAL H1 H 1.890 0.359 -0.250 1.00 . A A . 1 VAL H1 1 1 4 775 1 1 1 VAL HA H 3.161 0.255 -2.146 1.00 . A A . 1 VAL HA 1 1 4 776 1 1 1 VAL HB H 4.748 -1.153 -0.981 1.00 . A A . 1 VAL HB 1 1 4 777 1 1 1 VAL HG11 H 4.541 -3.568 -0.899 1.00 . A A . 1 VAL HG11 1 1 4 778 1 1 1 VAL HG12 H 3.141 -2.814 -0.132 1.00 . A A . 1 VAL HG12 1 1 4 779 1 1 1 VAL HG13 H 3.003 -3.488 -1.757 1.00 . A A . 1 VAL HG13 1 1 4 780 1 1 1 VAL HG21 H 4.459 -1.019 -3.670 1.00 . A A . 1 VAL HG21 1 1 4 781 1 1 1 VAL HG22 H 5.823 -1.785 -2.856 1.00 . A A . 1 VAL HG22 1 1 4 782 1 1 1 VAL HG23 H 4.472 -2.765 -3.424 1.00 . A A . 1 VAL HG23 1 1 4 783 1 1 1 VAL N N 2.129 -0.544 -0.544 1.00 . A A . 1 VAL N 1 1 4 784 1 1 1 VAL O O 1.953 -0.928 -4.041 1.00 . A A . 1 VAL O 1 1 4 785 1 1 2 ALA C C -1.329 -2.719 -2.870 1.00 . A A . 2 ALA C 1 1 4 786 1 1 2 ALA CA C 0.106 -2.879 -3.362 1.00 . A A . 2 ALA CA 1 1 4 787 1 1 2 ALA CB C 0.450 -4.352 -3.524 1.00 . A A . 2 ALA CB 1 1 4 788 1 1 2 ALA H H 1.051 -2.498 -1.507 1.00 . A A . 2 ALA H 1 1 4 789 1 1 2 ALA HA H 0.200 -2.404 -4.328 1.00 . A A . 2 ALA HA 1 1 4 790 1 1 2 ALA HB1 H 1.495 -4.504 -3.299 1.00 . A A . 2 ALA HB1 1 1 4 791 1 1 2 ALA HB2 H -0.153 -4.939 -2.848 1.00 . A A . 2 ALA HB2 1 1 4 792 1 1 2 ALA HB3 H 0.252 -4.657 -4.541 1.00 . A A . 2 ALA HB3 1 1 4 793 1 1 2 ALA N N 1.047 -2.238 -2.452 1.00 . A A . 2 ALA N 1 1 4 794 1 1 2 ALA O O -1.671 -3.159 -1.773 1.00 . A A . 2 ALA O 1 1 4 795 1 1 3 ARG C C -4.239 -3.182 -2.962 1.00 . A A . 3 ARG C 1 1 4 796 1 1 3 ARG CA C -3.560 -1.868 -3.336 1.00 . A A . 3 ARG CA 1 1 4 797 1 1 3 ARG CB C -4.305 -1.211 -4.500 1.00 . A A . 3 ARG CB 1 1 4 798 1 1 3 ARG CD C -4.865 -1.522 -6.930 1.00 . A A . 3 ARG CD 1 1 4 799 1 1 3 ARG CG C -4.752 -2.193 -5.570 1.00 . A A . 3 ARG CG 1 1 4 800 1 1 3 ARG CZ C -6.478 -0.152 -8.181 1.00 . A A . 3 ARG CZ 1 1 4 801 1 1 3 ARG H H -1.831 -1.759 -4.551 1.00 . A A . 3 ARG H 1 1 4 802 1 1 3 ARG HA H -3.588 -1.207 -2.484 1.00 . A A . 3 ARG HA 1 1 4 803 1 1 3 ARG HB2 H -5.181 -0.710 -4.114 1.00 . A A . 3 ARG HB2 1 1 4 804 1 1 3 ARG HB3 H -3.656 -0.481 -4.960 1.00 . A A . 3 ARG HB3 1 1 4 805 1 1 3 ARG HD2 H -4.098 -0.767 -7.009 1.00 . A A . 3 ARG HD2 1 1 4 806 1 1 3 ARG HD3 H -4.717 -2.267 -7.697 1.00 . A A . 3 ARG HD3 1 1 4 807 1 1 3 ARG HE H -6.848 -1.034 -6.431 1.00 . A A . 3 ARG HE 1 1 4 808 1 1 3 ARG HG2 H -4.030 -2.994 -5.635 1.00 . A A . 3 ARG HG2 1 1 4 809 1 1 3 ARG HG3 H -5.715 -2.597 -5.295 1.00 . A A . 3 ARG HG3 1 1 4 810 1 1 3 ARG HH11 H -4.670 -0.350 -9.059 1.00 . A A . 3 ARG HH11 1 1 4 811 1 1 3 ARG HH12 H -5.816 0.613 -9.930 1.00 . A A . 3 ARG HH12 1 1 4 812 1 1 3 ARG HH21 H -8.366 0.232 -7.569 1.00 . A A . 3 ARG HH21 1 1 4 813 1 1 3 ARG HH22 H -7.918 0.944 -9.081 1.00 . A A . 3 ARG HH22 1 1 4 814 1 1 3 ARG N N -2.163 -2.087 -3.689 1.00 . A A . 3 ARG N 1 1 4 815 1 1 3 ARG NE N -6.170 -0.895 -7.124 1.00 . A A . 3 ARG NE 1 1 4 816 1 1 3 ARG NH1 N -5.581 0.055 -9.135 1.00 . A A . 3 ARG NH1 1 1 4 817 1 1 3 ARG NH2 N -7.687 0.386 -8.286 1.00 . A A . 3 ARG NH2 1 1 4 818 1 1 3 ARG O O -5.167 -3.206 -2.155 1.00 . A A . 3 ARG O 1 1 4 819 1 1 4 GLY C C -3.398 -6.469 -2.488 1.00 . A A . 4 GLY C 1 1 4 820 1 1 4 GLY CA C -4.341 -5.578 -3.271 1.00 . A A . 4 GLY CA 1 1 4 821 1 1 4 GLY H H -3.026 -4.197 -4.190 1.00 . A A . 4 GLY H 1 1 4 822 1 1 4 GLY HA2 H -5.249 -5.444 -2.701 1.00 . A A . 4 GLY HA2 1 1 4 823 1 1 4 GLY HA3 H -4.583 -6.064 -4.205 1.00 . A A . 4 GLY HA3 1 1 4 824 1 1 4 GLY N N -3.768 -4.276 -3.555 1.00 . A A . 4 GLY N 1 1 4 825 1 1 4 GLY O O -2.472 -7.053 -3.053 1.00 . A A . 4 GLY O 1 1 4 826 1 1 5 TRP C C -3.626 -8.443 0.410 1.00 . A A . 5 TRP C 1 1 4 827 1 1 5 TRP CA C -2.791 -7.399 -0.323 1.00 . A A . 5 TRP CA 1 1 4 828 1 1 5 TRP CB C -2.046 -6.524 0.687 1.00 . A A . 5 TRP CB 1 1 4 829 1 1 5 TRP CD1 C -0.304 -4.690 0.270 1.00 . A A . 5 TRP CD1 1 1 4 830 1 1 5 TRP CD2 C 0.248 -6.692 -0.569 1.00 . A A . 5 TRP CD2 1 1 4 831 1 1 5 TRP CE2 C 1.281 -5.781 -0.864 1.00 . A A . 5 TRP CE2 1 1 4 832 1 1 5 TRP CE3 C 0.376 -8.016 -0.997 1.00 . A A . 5 TRP CE3 1 1 4 833 1 1 5 TRP CG C -0.756 -5.974 0.157 1.00 . A A . 5 TRP CG 1 1 4 834 1 1 5 TRP CH2 C 2.522 -7.456 -1.975 1.00 . A A . 5 TRP CH2 1 1 4 835 1 1 5 TRP CZ2 C 2.423 -6.153 -1.568 1.00 . A A . 5 TRP CZ2 1 1 4 836 1 1 5 TRP CZ3 C 1.510 -8.384 -1.695 1.00 . A A . 5 TRP CZ3 1 1 4 837 1 1 5 TRP H H -4.383 -6.084 -0.792 1.00 . A A . 5 TRP H 1 1 4 838 1 1 5 TRP HA H -2.071 -7.904 -0.948 1.00 . A A . 5 TRP HA 1 1 4 839 1 1 5 TRP HB2 H -2.674 -5.691 0.965 1.00 . A A . 5 TRP HB2 1 1 4 840 1 1 5 TRP HB3 H -1.823 -7.112 1.566 1.00 . A A . 5 TRP HB3 1 1 4 841 1 1 5 TRP HD1 H -0.842 -3.898 0.768 1.00 . A A . 5 TRP HD1 1 1 4 842 1 1 5 TRP HE1 H 1.448 -3.743 -0.396 1.00 . A A . 5 TRP HE1 1 1 4 843 1 1 5 TRP HE3 H -0.393 -8.746 -0.791 1.00 . A A . 5 TRP HE3 1 1 4 844 1 1 5 TRP HH2 H 3.389 -7.787 -2.524 1.00 . A A . 5 TRP HH2 1 1 4 845 1 1 5 TRP HZ2 H 3.211 -5.449 -1.791 1.00 . A A . 5 TRP HZ2 1 1 4 846 1 1 5 TRP HZ3 H 1.626 -9.403 -2.034 1.00 . A A . 5 TRP HZ3 1 1 4 847 1 1 5 TRP N N -3.630 -6.573 -1.185 1.00 . A A . 5 TRP N 1 1 4 848 1 1 5 TRP NE1 N 0.919 -4.567 -0.343 1.00 . A A . 5 TRP NE1 1 1 4 849 1 1 5 TRP O O -3.697 -9.600 -0.006 1.00 . A A . 5 TRP O 1 1 4 850 1 1 6 LYS C C -5.722 -10.000 1.413 1.00 . A A . 6 LYS C 1 1 4 851 1 1 6 LYS CA C -5.088 -8.929 2.295 1.00 . A A . 6 LYS CA 1 1 4 852 1 1 6 LYS CB C -6.180 -8.140 3.022 1.00 . A A . 6 LYS CB 1 1 4 853 1 1 6 LYS CD C -7.789 -6.212 2.985 1.00 . A A . 6 LYS CD 1 1 4 854 1 1 6 LYS CE C -9.116 -6.897 2.698 1.00 . A A . 6 LYS CE 1 1 4 855 1 1 6 LYS CG C -6.639 -6.903 2.271 1.00 . A A . 6 LYS CG 1 1 4 856 1 1 6 LYS H H -4.161 -7.095 1.786 1.00 . A A . 6 LYS H 1 1 4 857 1 1 6 LYS HA H -4.455 -9.409 3.025 1.00 . A A . 6 LYS HA 1 1 4 858 1 1 6 LYS HB2 H -7.034 -8.784 3.171 1.00 . A A . 6 LYS HB2 1 1 4 859 1 1 6 LYS HB3 H -5.801 -7.831 3.986 1.00 . A A . 6 LYS HB3 1 1 4 860 1 1 6 LYS HD2 H -7.607 -6.236 4.049 1.00 . A A . 6 LYS HD2 1 1 4 861 1 1 6 LYS HD3 H -7.843 -5.185 2.651 1.00 . A A . 6 LYS HD3 1 1 4 862 1 1 6 LYS HE2 H -8.960 -7.654 1.945 1.00 . A A . 6 LYS HE2 1 1 4 863 1 1 6 LYS HE3 H -9.470 -7.361 3.607 1.00 . A A . 6 LYS HE3 1 1 4 864 1 1 6 LYS HG2 H -5.812 -6.213 2.191 1.00 . A A . 6 LYS HG2 1 1 4 865 1 1 6 LYS HG3 H -6.965 -7.194 1.282 1.00 . A A . 6 LYS HG3 1 1 4 866 1 1 6 LYS HZ1 H -10.058 -5.809 1.184 1.00 . A A . 6 LYS HZ1 1 1 4 867 1 1 6 LYS HZ2 H -10.015 -5.012 2.675 1.00 . A A . 6 LYS HZ2 1 1 4 868 1 1 6 LYS HZ3 H -11.096 -6.289 2.430 1.00 . A A . 6 LYS HZ3 1 1 4 869 1 1 6 LYS N N -4.257 -8.029 1.504 1.00 . A A . 6 LYS N 1 1 4 870 1 1 6 LYS NZ N -10.143 -5.934 2.213 1.00 . A A . 6 LYS NZ 1 1 4 871 1 1 6 LYS O O -5.623 -11.193 1.701 1.00 . A A . 6 LYS O 1 1 4 872 1 1 7 ARG C C -5.995 -11.173 -1.483 1.00 . A A . 7 ARG C 1 1 4 873 1 1 7 ARG CA C -7.022 -10.489 -0.586 1.00 . A A . 7 ARG CA 1 1 4 874 1 1 7 ARG CB C -8.050 -9.747 -1.442 1.00 . A A . 7 ARG CB 1 1 4 875 1 1 7 ARG CD C -9.322 -11.859 -1.928 1.00 . A A . 7 ARG CD 1 1 4 876 1 1 7 ARG CG C -8.683 -10.612 -2.519 1.00 . A A . 7 ARG CG 1 1 4 877 1 1 7 ARG CZ C -11.729 -11.362 -1.979 1.00 . A A . 7 ARG CZ 1 1 4 878 1 1 7 ARG H H -6.417 -8.603 0.162 1.00 . A A . 7 ARG H 1 1 4 879 1 1 7 ARG HA H -7.530 -11.241 -0.001 1.00 . A A . 7 ARG HA 1 1 4 880 1 1 7 ARG HB2 H -8.836 -9.376 -0.801 1.00 . A A . 7 ARG HB2 1 1 4 881 1 1 7 ARG HB3 H -7.564 -8.910 -1.922 1.00 . A A . 7 ARG HB3 1 1 4 882 1 1 7 ARG HD2 H -8.725 -12.716 -2.199 1.00 . A A . 7 ARG HD2 1 1 4 883 1 1 7 ARG HD3 H -9.343 -11.761 -0.853 1.00 . A A . 7 ARG HD3 1 1 4 884 1 1 7 ARG HE H -10.827 -12.745 -3.098 1.00 . A A . 7 ARG HE 1 1 4 885 1 1 7 ARG HG2 H -9.444 -10.038 -3.028 1.00 . A A . 7 ARG HG2 1 1 4 886 1 1 7 ARG HG3 H -7.921 -10.908 -3.224 1.00 . A A . 7 ARG HG3 1 1 4 887 1 1 7 ARG HH11 H -10.657 -10.243 -0.683 1.00 . A A . 7 ARG HH11 1 1 4 888 1 1 7 ARG HH12 H -12.356 -9.902 -0.729 1.00 . A A . 7 ARG HH12 1 1 4 889 1 1 7 ARG HH21 H -13.064 -12.307 -3.167 1.00 . A A . 7 ARG HH21 1 1 4 890 1 1 7 ARG HH22 H -13.724 -11.078 -2.141 1.00 . A A . 7 ARG HH22 1 1 4 891 1 1 7 ARG N N -6.372 -9.566 0.338 1.00 . A A . 7 ARG N 1 1 4 892 1 1 7 ARG NE N -10.685 -12.058 -2.414 1.00 . A A . 7 ARG NE 1 1 4 893 1 1 7 ARG NH1 N -11.568 -10.426 -1.054 1.00 . A A . 7 ARG NH1 1 1 4 894 1 1 7 ARG NH2 N -12.939 -11.602 -2.469 1.00 . A A . 7 ARG NH2 1 1 4 895 1 1 7 ARG O O -5.629 -12.327 -1.259 1.00 . A A . 7 ARG O 1 1 4 896 1 1 8 LYS C C -3.136 -10.844 -2.874 1.00 . A A . 8 LYS C 1 1 4 897 1 1 8 LYS CA C -4.548 -10.989 -3.432 1.00 . A A . 8 LYS CA 1 1 4 898 1 1 8 LYS CB C -4.651 -10.274 -4.782 1.00 . A A . 8 LYS CB 1 1 4 899 1 1 8 LYS CD C -4.276 -8.082 -5.950 1.00 . A A . 8 LYS CD 1 1 4 900 1 1 8 LYS CE C -2.760 -7.993 -6.039 1.00 . A A . 8 LYS CE 1 1 4 901 1 1 8 LYS CG C -4.719 -8.761 -4.665 1.00 . A A . 8 LYS CG 1 1 4 902 1 1 8 LYS H H -5.864 -9.538 -2.627 1.00 . A A . 8 LYS H 1 1 4 903 1 1 8 LYS HA H -4.761 -12.038 -3.573 1.00 . A A . 8 LYS HA 1 1 4 904 1 1 8 LYS HB2 H -3.787 -10.529 -5.377 1.00 . A A . 8 LYS HB2 1 1 4 905 1 1 8 LYS HB3 H -5.541 -10.615 -5.290 1.00 . A A . 8 LYS HB3 1 1 4 906 1 1 8 LYS HD2 H -4.642 -8.650 -6.792 1.00 . A A . 8 LYS HD2 1 1 4 907 1 1 8 LYS HD3 H -4.689 -7.083 -5.980 1.00 . A A . 8 LYS HD3 1 1 4 908 1 1 8 LYS HE2 H -2.419 -7.212 -5.377 1.00 . A A . 8 LYS HE2 1 1 4 909 1 1 8 LYS HE3 H -2.339 -8.938 -5.729 1.00 . A A . 8 LYS HE3 1 1 4 910 1 1 8 LYS HG2 H -5.737 -8.471 -4.450 1.00 . A A . 8 LYS HG2 1 1 4 911 1 1 8 LYS HG3 H -4.074 -8.442 -3.858 1.00 . A A . 8 LYS HG3 1 1 4 912 1 1 8 LYS HZ1 H -2.926 -6.978 -7.857 1.00 . A A . 8 LYS HZ1 1 1 4 913 1 1 8 LYS HZ2 H -2.325 -8.552 -8.004 1.00 . A A . 8 LYS HZ2 1 1 4 914 1 1 8 LYS HZ3 H -1.331 -7.320 -7.406 1.00 . A A . 8 LYS HZ3 1 1 4 915 1 1 8 LYS N N -5.534 -10.453 -2.501 1.00 . A A . 8 LYS N 1 1 4 916 1 1 8 LYS NZ N -2.303 -7.690 -7.423 1.00 . A A . 8 LYS NZ 1 1 4 917 1 1 8 LYS O O -2.679 -9.734 -2.598 1.00 . A A . 8 LYS O 1 1 4 918 1 1 9 CYS C C -0.105 -12.490 -3.228 1.00 . A A . 9 CYS C 1 1 4 919 1 1 9 CYS CA C -1.090 -11.968 -2.188 1.00 . A A . 9 CYS CA 1 1 4 920 1 1 9 CYS CB C -1.009 -12.818 -0.919 1.00 . A A . 9 CYS CB 1 1 4 921 1 1 9 CYS H H -2.869 -12.824 -2.951 1.00 . A A . 9 CYS H 1 1 4 922 1 1 9 CYS HA H -0.831 -10.949 -1.945 1.00 . A A . 9 CYS HA 1 1 4 923 1 1 9 CYS HB2 H 0.029 -12.954 -0.651 1.00 . A A . 9 CYS HB2 1 1 4 924 1 1 9 CYS HB3 H -1.516 -12.303 -0.117 1.00 . A A . 9 CYS HB3 1 1 4 925 1 1 9 CYS HG H -1.159 -15.264 -0.213 1.00 . A A . 9 CYS HG 1 1 4 926 1 1 9 CYS N N -2.451 -11.970 -2.712 1.00 . A A . 9 CYS N 1 1 4 927 1 1 9 CYS O O 0.348 -13.634 -3.172 1.00 . A A . 9 CYS O 1 1 4 928 1 1 9 CYS SG S -1.752 -14.458 -1.081 1.00 . A A . 9 CYS SG 1 1 4 929 1 1 10 PRO C C 2.600 -12.136 -4.774 1.00 . A A . 10 PRO C 1 1 4 930 1 1 10 PRO CA C 1.169 -11.988 -5.277 1.00 . A A . 10 PRO CA 1 1 4 931 1 1 10 PRO CB C 1.061 -10.807 -6.244 1.00 . A A . 10 PRO CB 1 1 4 932 1 1 10 PRO CD C -0.266 -10.256 -4.334 1.00 . A A . 10 PRO CD 1 1 4 933 1 1 10 PRO CG C 0.616 -9.664 -5.398 1.00 . A A . 10 PRO CG 1 1 4 934 1 1 10 PRO HA H 0.869 -12.896 -5.781 1.00 . A A . 10 PRO HA 1 1 4 935 1 1 10 PRO HB2 H 2.026 -10.615 -6.692 1.00 . A A . 10 PRO HB2 1 1 4 936 1 1 10 PRO HB3 H 0.339 -11.032 -7.015 1.00 . A A . 10 PRO HB3 1 1 4 937 1 1 10 PRO HD2 H -0.152 -9.715 -3.406 1.00 . A A . 10 PRO HD2 1 1 4 938 1 1 10 PRO HD3 H -1.298 -10.250 -4.652 1.00 . A A . 10 PRO HD3 1 1 4 939 1 1 10 PRO HG2 H 1.472 -9.182 -4.951 1.00 . A A . 10 PRO HG2 1 1 4 940 1 1 10 PRO HG3 H 0.057 -8.960 -5.998 1.00 . A A . 10 PRO HG3 1 1 4 941 1 1 10 PRO N N 0.235 -11.635 -4.204 1.00 . A A . 10 PRO N 1 1 4 942 1 1 10 PRO O O 3.298 -13.088 -5.127 1.00 . A A . 10 PRO O 1 1 4 943 1 1 11 LEU C C 4.348 -11.381 -1.880 1.00 . A A . 11 LEU C 1 1 4 944 1 1 11 LEU CA C 4.383 -11.216 -3.396 1.00 . A A . 11 LEU CA 1 1 4 945 1 1 11 LEU CB C 5.131 -9.933 -3.764 1.00 . A A . 11 LEU CB 1 1 4 946 1 1 11 LEU CD1 C 5.015 -7.547 -4.525 1.00 . A A . 11 LEU CD1 1 1 4 947 1 1 11 LEU CD2 C 4.212 -9.377 -6.029 1.00 . A A . 11 LEU CD2 1 1 4 948 1 1 11 LEU CG C 4.345 -8.911 -4.587 1.00 . A A . 11 LEU CG 1 1 4 949 1 1 11 LEU H H 2.432 -10.457 -3.704 1.00 . A A . 11 LEU H 1 1 4 950 1 1 11 LEU HA H 4.901 -12.060 -3.826 1.00 . A A . 11 LEU HA 1 1 4 951 1 1 11 LEU HB2 H 5.436 -9.454 -2.846 1.00 . A A . 11 LEU HB2 1 1 4 952 1 1 11 LEU HB3 H 6.007 -10.213 -4.331 1.00 . A A . 11 LEU HB3 1 1 4 953 1 1 11 LEU HD11 H 5.028 -7.108 -5.510 1.00 . A A . 11 LEU HD11 1 1 4 954 1 1 11 LEU HD12 H 6.028 -7.660 -4.167 1.00 . A A . 11 LEU HD12 1 1 4 955 1 1 11 LEU HD13 H 4.465 -6.906 -3.851 1.00 . A A . 11 LEU HD13 1 1 4 956 1 1 11 LEU HD21 H 4.282 -10.454 -6.067 1.00 . A A . 11 LEU HD21 1 1 4 957 1 1 11 LEU HD22 H 5.005 -8.944 -6.622 1.00 . A A . 11 LEU HD22 1 1 4 958 1 1 11 LEU HD23 H 3.256 -9.064 -6.422 1.00 . A A . 11 LEU HD23 1 1 4 959 1 1 11 LEU HG H 3.351 -8.813 -4.173 1.00 . A A . 11 LEU HG 1 1 4 960 1 1 11 LEU N N 3.033 -11.190 -3.948 1.00 . A A . 11 LEU N 1 1 4 961 1 1 11 LEU O O 4.563 -12.476 -1.359 1.00 . A A . 11 LEU O 1 1 4 962 1 1 12 PHE C C 2.648 -9.829 0.771 1.00 . A A . 12 PHE C 1 1 4 963 1 1 12 PHE CA C 4.010 -10.310 0.279 1.00 . A A . 12 PHE CA 1 1 4 964 1 1 12 PHE CB C 5.117 -9.438 0.874 1.00 . A A . 12 PHE CB 1 1 4 965 1 1 12 PHE CD1 C 5.128 -7.237 -0.330 1.00 . A A . 12 PHE CD1 1 1 4 966 1 1 12 PHE CD2 C 6.860 -8.802 -0.815 1.00 . A A . 12 PHE CD2 1 1 4 967 1 1 12 PHE CE1 C 5.675 -6.346 -1.235 1.00 . A A . 12 PHE CE1 1 1 4 968 1 1 12 PHE CE2 C 7.411 -7.916 -1.721 1.00 . A A . 12 PHE CE2 1 1 4 969 1 1 12 PHE CG C 5.714 -8.473 -0.110 1.00 . A A . 12 PHE CG 1 1 4 970 1 1 12 PHE CZ C 6.818 -6.687 -1.932 1.00 . A A . 12 PHE CZ 1 1 4 971 1 1 12 PHE H H 3.913 -9.443 -1.650 1.00 . A A . 12 PHE H 1 1 4 972 1 1 12 PHE HA H 4.155 -11.330 0.600 1.00 . A A . 12 PHE HA 1 1 4 973 1 1 12 PHE HB2 H 4.713 -8.866 1.696 1.00 . A A . 12 PHE HB2 1 1 4 974 1 1 12 PHE HB3 H 5.909 -10.074 1.240 1.00 . A A . 12 PHE HB3 1 1 4 975 1 1 12 PHE HD1 H 4.233 -6.969 0.215 1.00 . A A . 12 PHE HD1 1 1 4 976 1 1 12 PHE HD2 H 7.325 -9.763 -0.652 1.00 . A A . 12 PHE HD2 1 1 4 977 1 1 12 PHE HE1 H 5.208 -5.386 -1.397 1.00 . A A . 12 PHE HE1 1 1 4 978 1 1 12 PHE HE2 H 8.305 -8.184 -2.265 1.00 . A A . 12 PHE HE2 1 1 4 979 1 1 12 PHE HZ H 7.247 -5.992 -2.638 1.00 . A A . 12 PHE HZ 1 1 4 980 1 1 12 PHE N N 4.074 -10.287 -1.177 1.00 . A A . 12 PHE N 1 1 4 981 1 1 12 PHE O O 2.450 -8.640 1.019 1.00 . A A . 12 PHE O 1 1 4 982 1 1 13 GLY C C 0.195 -10.666 2.853 1.00 . A A . 13 GLY C 1 1 4 983 1 1 13 GLY CA C 0.380 -10.415 1.370 1.00 . A A . 13 GLY CA 1 1 4 984 1 1 13 GLY H H 1.926 -11.695 0.696 1.00 . A A . 13 GLY H 1 1 4 985 1 1 13 GLY HA2 H 0.202 -9.369 1.167 1.00 . A A . 13 GLY HA2 1 1 4 986 1 1 13 GLY HA3 H -0.343 -11.004 0.824 1.00 . A A . 13 GLY HA3 1 1 4 987 1 1 13 GLY N N 1.711 -10.762 0.909 1.00 . A A . 13 GLY N 1 1 4 988 1 1 13 GLY O O -0.877 -10.416 3.404 1.00 . A A . 13 GLY O 1 1 4 989 1 1 14 LYS C C 0.997 -10.168 5.736 1.00 . A A . 14 LYS C 1 1 4 990 1 1 14 LYS CA C 1.193 -11.449 4.931 1.00 . A A . 14 LYS CA 1 1 4 991 1 1 14 LYS CB C 2.477 -12.153 5.376 1.00 . A A . 14 LYS CB 1 1 4 992 1 1 14 LYS CD C 4.236 -10.585 6.246 1.00 . A A . 14 LYS CD 1 1 4 993 1 1 14 LYS CE C 4.843 -9.256 5.824 1.00 . A A . 14 LYS CE 1 1 4 994 1 1 14 LYS CG C 3.740 -11.377 5.048 1.00 . A A . 14 LYS CG 1 1 4 995 1 1 14 LYS H H 2.070 -11.341 3.008 1.00 . A A . 14 LYS H 1 1 4 996 1 1 14 LYS HA H 0.353 -12.104 5.109 1.00 . A A . 14 LYS HA 1 1 4 997 1 1 14 LYS HB2 H 2.439 -12.302 6.445 1.00 . A A . 14 LYS HB2 1 1 4 998 1 1 14 LYS HB3 H 2.533 -13.115 4.888 1.00 . A A . 14 LYS HB3 1 1 4 999 1 1 14 LYS HD2 H 3.406 -10.394 6.910 1.00 . A A . 14 LYS HD2 1 1 4 1000 1 1 14 LYS HD3 H 4.987 -11.165 6.764 1.00 . A A . 14 LYS HD3 1 1 4 1001 1 1 14 LYS HE2 H 4.270 -8.859 4.999 1.00 . A A . 14 LYS HE2 1 1 4 1002 1 1 14 LYS HE3 H 4.793 -8.571 6.658 1.00 . A A . 14 LYS HE3 1 1 4 1003 1 1 14 LYS HG2 H 4.510 -12.071 4.746 1.00 . A A . 14 LYS HG2 1 1 4 1004 1 1 14 LYS HG3 H 3.532 -10.693 4.237 1.00 . A A . 14 LYS HG3 1 1 4 1005 1 1 14 LYS HZ1 H 6.535 -8.614 4.782 1.00 . A A . 14 LYS HZ1 1 1 4 1006 1 1 14 LYS HZ2 H 6.391 -10.296 4.884 1.00 . A A . 14 LYS HZ2 1 1 4 1007 1 1 14 LYS HZ3 H 6.885 -9.406 6.235 1.00 . A A . 14 LYS HZ3 1 1 4 1008 1 1 14 LYS N N 1.243 -11.163 3.502 1.00 . A A . 14 LYS N 1 1 4 1009 1 1 14 LYS NZ N 6.263 -9.403 5.402 1.00 . A A . 14 LYS NZ 1 1 4 1010 1 1 14 LYS O O 0.212 -10.133 6.683 1.00 . A A . 14 LYS O 1 1 4 1011 1 1 15 GLY C C 1.146 -6.726 5.137 1.00 . A A . 15 GLY C 1 1 4 1012 1 1 15 GLY CA C 1.603 -7.849 6.047 1.00 . A A . 15 GLY CA 1 1 4 1013 1 1 15 GLY H H 2.324 -9.204 4.589 1.00 . A A . 15 GLY H 1 1 4 1014 1 1 15 GLY HA2 H 0.895 -7.954 6.855 1.00 . A A . 15 GLY HA2 1 1 4 1015 1 1 15 GLY HA3 H 2.568 -7.592 6.459 1.00 . A A . 15 GLY HA3 1 1 4 1016 1 1 15 GLY N N 1.714 -9.117 5.351 1.00 . A A . 15 GLY N 1 1 4 1017 1 1 15 GLY O O 0.516 -5.770 5.587 1.00 . A A . 15 GLY O 1 1 4 1018 1 1 16 GLY C C 1.475 -4.427 3.343 1.00 . A A . 16 GLY C 1 1 4 1019 1 1 16 GLY CA C 1.078 -5.819 2.896 1.00 . A A . 16 GLY CA 1 1 4 1020 1 1 16 GLY H H 1.971 -7.625 3.549 1.00 . A A . 16 GLY H 1 1 4 1021 1 1 16 GLY HA2 H 1.549 -6.031 1.948 1.00 . A A . 16 GLY HA2 1 1 4 1022 1 1 16 GLY HA3 H 0.006 -5.851 2.769 1.00 . A A . 16 GLY HA3 1 1 4 1023 1 1 16 GLY N N 1.466 -6.841 3.851 1.00 . A A . 16 GLY N 1 1 4 1024 1 1 16 GLY O O 2.660 -4.094 3.381 1.00 . A A . 16 GLY O 1 1 5 1025 1 1 1 VAL C C 1.368 -0.851 -2.671 1.00 . A A . 1 VAL C 1 1 5 1026 1 1 1 VAL CA C 2.121 -0.188 -1.524 1.00 . A A . 1 VAL CA 1 1 5 1027 1 1 1 VAL CB C 3.504 -0.849 -1.381 1.00 . A A . 1 VAL CB 1 1 5 1028 1 1 1 VAL CG1 C 4.319 -0.155 -0.300 1.00 . A A . 1 VAL CG1 1 1 5 1029 1 1 1 VAL CG2 C 3.356 -2.333 -1.079 1.00 . A A . 1 VAL CG2 1 1 5 1030 1 1 1 VAL H1 H 1.724 -0.789 0.466 1.00 . A A . 1 VAL H1 1 1 5 1031 1 1 1 VAL HA H 2.267 0.857 -1.758 1.00 . A A . 1 VAL HA 1 1 5 1032 1 1 1 VAL HB H 4.029 -0.745 -2.319 1.00 . A A . 1 VAL HB 1 1 5 1033 1 1 1 VAL HG11 H 5.335 -0.024 -0.644 1.00 . A A . 1 VAL HG11 1 1 5 1034 1 1 1 VAL HG12 H 3.883 0.809 -0.084 1.00 . A A . 1 VAL HG12 1 1 5 1035 1 1 1 VAL HG13 H 4.318 -0.760 0.595 1.00 . A A . 1 VAL HG13 1 1 5 1036 1 1 1 VAL HG21 H 2.959 -2.458 -0.083 1.00 . A A . 1 VAL HG21 1 1 5 1037 1 1 1 VAL HG22 H 2.682 -2.781 -1.794 1.00 . A A . 1 VAL HG22 1 1 5 1038 1 1 1 VAL HG23 H 4.322 -2.812 -1.145 1.00 . A A . 1 VAL HG23 1 1 5 1039 1 1 1 VAL N N 1.362 -0.269 -0.281 1.00 . A A . 1 VAL N 1 1 5 1040 1 1 1 VAL O O 1.539 -0.484 -3.833 1.00 . A A . 1 VAL O 1 1 5 1041 1 1 2 ALA C C -1.737 -2.488 -3.017 1.00 . A A . 2 ALA C 1 1 5 1042 1 1 2 ALA CA C -0.247 -2.544 -3.340 1.00 . A A . 2 ALA CA 1 1 5 1043 1 1 2 ALA CB C 0.219 -3.989 -3.441 1.00 . A A . 2 ALA CB 1 1 5 1044 1 1 2 ALA H H 0.441 -2.078 -1.394 1.00 . A A . 2 ALA H 1 1 5 1045 1 1 2 ALA HA H -0.078 -2.069 -4.295 1.00 . A A . 2 ALA HA 1 1 5 1046 1 1 2 ALA HB1 H 1.269 -4.046 -3.193 1.00 . A A . 2 ALA HB1 1 1 5 1047 1 1 2 ALA HB2 H -0.348 -4.599 -2.754 1.00 . A A . 2 ALA HB2 1 1 5 1048 1 1 2 ALA HB3 H 0.067 -4.346 -4.449 1.00 . A A . 2 ALA HB3 1 1 5 1049 1 1 2 ALA N N 0.534 -1.831 -2.337 1.00 . A A . 2 ALA N 1 1 5 1050 1 1 2 ALA O O -2.167 -2.925 -1.950 1.00 . A A . 2 ALA O 1 1 5 1051 1 1 3 ARG C C -4.557 -3.162 -3.307 1.00 . A A . 3 ARG C 1 1 5 1052 1 1 3 ARG CA C -3.960 -1.832 -3.759 1.00 . A A . 3 ARG CA 1 1 5 1053 1 1 3 ARG CB C -4.629 -1.375 -5.056 1.00 . A A . 3 ARG CB 1 1 5 1054 1 1 3 ARG CD C -3.420 -2.820 -6.720 1.00 . A A . 3 ARG CD 1 1 5 1055 1 1 3 ARG CG C -4.763 -2.478 -6.094 1.00 . A A . 3 ARG CG 1 1 5 1056 1 1 3 ARG CZ C -3.055 -1.086 -8.423 1.00 . A A . 3 ARG CZ 1 1 5 1057 1 1 3 ARG H H -2.116 -1.617 -4.776 1.00 . A A . 3 ARG H 1 1 5 1058 1 1 3 ARG HA H -4.137 -1.093 -2.993 1.00 . A A . 3 ARG HA 1 1 5 1059 1 1 3 ARG HB2 H -5.617 -1.005 -4.827 1.00 . A A . 3 ARG HB2 1 1 5 1060 1 1 3 ARG HB3 H -4.044 -0.576 -5.486 1.00 . A A . 3 ARG HB3 1 1 5 1061 1 1 3 ARG HD2 H -2.791 -3.269 -5.967 1.00 . A A . 3 ARG HD2 1 1 5 1062 1 1 3 ARG HD3 H -3.581 -3.525 -7.521 1.00 . A A . 3 ARG HD3 1 1 5 1063 1 1 3 ARG HE H -2.035 -1.239 -6.716 1.00 . A A . 3 ARG HE 1 1 5 1064 1 1 3 ARG HG2 H -5.161 -3.362 -5.617 1.00 . A A . 3 ARG HG2 1 1 5 1065 1 1 3 ARG HG3 H -5.439 -2.149 -6.869 1.00 . A A . 3 ARG HG3 1 1 5 1066 1 1 3 ARG HH11 H -4.513 -2.413 -8.861 1.00 . A A . 3 ARG HH11 1 1 5 1067 1 1 3 ARG HH12 H -4.245 -1.185 -10.054 1.00 . A A . 3 ARG HH12 1 1 5 1068 1 1 3 ARG HH21 H -1.673 0.383 -8.278 1.00 . A A . 3 ARG HH21 1 1 5 1069 1 1 3 ARG HH22 H -2.629 0.404 -9.722 1.00 . A A . 3 ARG HH22 1 1 5 1070 1 1 3 ARG N N -2.518 -1.947 -3.946 1.00 . A A . 3 ARG N 1 1 5 1071 1 1 3 ARG NE N -2.749 -1.639 -7.255 1.00 . A A . 3 ARG NE 1 1 5 1072 1 1 3 ARG NH1 N -4.016 -1.604 -9.175 1.00 . A A . 3 ARG NH1 1 1 5 1073 1 1 3 ARG NH2 N -2.398 -0.011 -8.842 1.00 . A A . 3 ARG NH2 1 1 5 1074 1 1 3 ARG O O -5.557 -3.194 -2.592 1.00 . A A . 3 ARG O 1 1 5 1075 1 1 4 GLY C C -3.408 -6.359 -2.549 1.00 . A A . 4 GLY C 1 1 5 1076 1 1 4 GLY CA C -4.420 -5.576 -3.361 1.00 . A A . 4 GLY CA 1 1 5 1077 1 1 4 GLY H H -3.142 -4.173 -4.299 1.00 . A A . 4 GLY H 1 1 5 1078 1 1 4 GLY HA2 H -5.324 -5.465 -2.780 1.00 . A A . 4 GLY HA2 1 1 5 1079 1 1 4 GLY HA3 H -4.648 -6.129 -4.260 1.00 . A A . 4 GLY HA3 1 1 5 1080 1 1 4 GLY N N -3.936 -4.259 -3.731 1.00 . A A . 4 GLY N 1 1 5 1081 1 1 4 GLY O O -2.427 -6.868 -3.091 1.00 . A A . 4 GLY O 1 1 5 1082 1 1 5 TRP C C -3.480 -8.302 0.367 1.00 . A A . 5 TRP C 1 1 5 1083 1 1 5 TRP CA C -2.743 -7.179 -0.356 1.00 . A A . 5 TRP CA 1 1 5 1084 1 1 5 TRP CB C -2.119 -6.224 0.661 1.00 . A A . 5 TRP CB 1 1 5 1085 1 1 5 TRP CD1 C -0.504 -4.267 0.296 1.00 . A A . 5 TRP CD1 1 1 5 1086 1 1 5 TRP CD2 C 0.225 -6.225 -0.511 1.00 . A A . 5 TRP CD2 1 1 5 1087 1 1 5 TRP CE2 C 1.197 -5.240 -0.775 1.00 . A A . 5 TRP CE2 1 1 5 1088 1 1 5 TRP CE3 C 0.466 -7.537 -0.926 1.00 . A A . 5 TRP CE3 1 1 5 1089 1 1 5 TRP CG C -0.855 -5.581 0.175 1.00 . A A . 5 TRP CG 1 1 5 1090 1 1 5 TRP CH2 C 2.597 -6.822 -1.831 1.00 . A A . 5 TRP CH2 1 1 5 1091 1 1 5 TRP CZ2 C 2.388 -5.528 -1.435 1.00 . A A . 5 TRP CZ2 1 1 5 1092 1 1 5 TRP CZ3 C 1.648 -7.822 -1.582 1.00 . A A . 5 TRP CZ3 1 1 5 1093 1 1 5 TRP H H -4.443 -6.026 -0.871 1.00 . A A . 5 TRP H 1 1 5 1094 1 1 5 TRP HA H -1.959 -7.610 -0.961 1.00 . A A . 5 TRP HA 1 1 5 1095 1 1 5 TRP HB2 H -2.825 -5.439 0.890 1.00 . A A . 5 TRP HB2 1 1 5 1096 1 1 5 TRP HB3 H -1.889 -6.771 1.564 1.00 . A A . 5 TRP HB3 1 1 5 1097 1 1 5 TRP HD1 H -1.117 -3.516 0.770 1.00 . A A . 5 TRP HD1 1 1 5 1098 1 1 5 TRP HE1 H 1.196 -3.194 -0.312 1.00 . A A . 5 TRP HE1 1 1 5 1099 1 1 5 TRP HE3 H -0.254 -8.322 -0.743 1.00 . A A . 5 TRP HE3 1 1 5 1100 1 1 5 TRP HH2 H 3.507 -7.089 -2.346 1.00 . A A . 5 TRP HH2 1 1 5 1101 1 1 5 TRP HZ2 H 3.130 -4.769 -1.634 1.00 . A A . 5 TRP HZ2 1 1 5 1102 1 1 5 TRP HZ3 H 1.852 -8.830 -1.911 1.00 . A A . 5 TRP HZ3 1 1 5 1103 1 1 5 TRP N N -3.644 -6.454 -1.245 1.00 . A A . 5 TRP N 1 1 5 1104 1 1 5 TRP NE1 N 0.728 -4.054 -0.273 1.00 . A A . 5 TRP NE1 1 1 5 1105 1 1 5 TRP O O -3.390 -9.467 -0.020 1.00 . A A . 5 TRP O 1 1 5 1106 1 1 6 LYS C C -5.408 -10.086 1.320 1.00 . A A . 6 LYS C 1 1 5 1107 1 1 6 LYS CA C -4.961 -8.920 2.196 1.00 . A A . 6 LYS CA 1 1 5 1108 1 1 6 LYS CB C -6.180 -8.258 2.842 1.00 . A A . 6 LYS CB 1 1 5 1109 1 1 6 LYS CD C -7.980 -6.517 2.638 1.00 . A A . 6 LYS CD 1 1 5 1110 1 1 6 LYS CE C -9.399 -7.001 2.380 1.00 . A A . 6 LYS CE 1 1 5 1111 1 1 6 LYS CG C -6.959 -7.362 1.894 1.00 . A A . 6 LYS CG 1 1 5 1112 1 1 6 LYS H H -4.240 -6.999 1.679 1.00 . A A . 6 LYS H 1 1 5 1113 1 1 6 LYS HA H -4.314 -9.297 2.973 1.00 . A A . 6 LYS HA 1 1 5 1114 1 1 6 LYS HB2 H -6.845 -9.028 3.204 1.00 . A A . 6 LYS HB2 1 1 5 1115 1 1 6 LYS HB3 H -5.849 -7.659 3.678 1.00 . A A . 6 LYS HB3 1 1 5 1116 1 1 6 LYS HD2 H -7.779 -6.575 3.697 1.00 . A A . 6 LYS HD2 1 1 5 1117 1 1 6 LYS HD3 H -7.893 -5.491 2.309 1.00 . A A . 6 LYS HD3 1 1 5 1118 1 1 6 LYS HE2 H -9.918 -6.257 1.796 1.00 . A A . 6 LYS HE2 1 1 5 1119 1 1 6 LYS HE3 H -9.354 -7.927 1.825 1.00 . A A . 6 LYS HE3 1 1 5 1120 1 1 6 LYS HG2 H -6.270 -6.707 1.383 1.00 . A A . 6 LYS HG2 1 1 5 1121 1 1 6 LYS HG3 H -7.474 -7.980 1.172 1.00 . A A . 6 LYS HG3 1 1 5 1122 1 1 6 LYS HZ1 H -10.383 -8.239 3.744 1.00 . A A . 6 LYS HZ1 1 1 5 1123 1 1 6 LYS HZ2 H -11.026 -6.677 3.648 1.00 . A A . 6 LYS HZ2 1 1 5 1124 1 1 6 LYS HZ3 H -9.566 -6.942 4.461 1.00 . A A . 6 LYS HZ3 1 1 5 1125 1 1 6 LYS N N -4.208 -7.944 1.419 1.00 . A A . 6 LYS N 1 1 5 1126 1 1 6 LYS NZ N -10.146 -7.231 3.647 1.00 . A A . 6 LYS NZ 1 1 5 1127 1 1 6 LYS O O -5.175 -11.249 1.651 1.00 . A A . 6 LYS O 1 1 5 1128 1 1 7 ARG C C -5.413 -11.234 -1.665 1.00 . A A . 7 ARG C 1 1 5 1129 1 1 7 ARG CA C -6.528 -10.787 -0.724 1.00 . A A . 7 ARG CA 1 1 5 1130 1 1 7 ARG CB C -7.712 -10.258 -1.534 1.00 . A A . 7 ARG CB 1 1 5 1131 1 1 7 ARG CD C -10.112 -9.511 -1.504 1.00 . A A . 7 ARG CD 1 1 5 1132 1 1 7 ARG CG C -9.033 -10.304 -0.783 1.00 . A A . 7 ARG CG 1 1 5 1133 1 1 7 ARG CZ C -12.561 -9.493 -1.716 1.00 . A A . 7 ARG CZ 1 1 5 1134 1 1 7 ARG H H -6.205 -8.822 -0.009 1.00 . A A . 7 ARG H 1 1 5 1135 1 1 7 ARG HA H -6.853 -11.636 -0.141 1.00 . A A . 7 ARG HA 1 1 5 1136 1 1 7 ARG HB2 H -7.516 -9.231 -1.808 1.00 . A A . 7 ARG HB2 1 1 5 1137 1 1 7 ARG HB3 H -7.812 -10.849 -2.432 1.00 . A A . 7 ARG HB3 1 1 5 1138 1 1 7 ARG HD2 H -10.026 -8.472 -1.221 1.00 . A A . 7 ARG HD2 1 1 5 1139 1 1 7 ARG HD3 H -9.960 -9.608 -2.569 1.00 . A A . 7 ARG HD3 1 1 5 1140 1 1 7 ARG HE H -11.531 -10.700 -0.508 1.00 . A A . 7 ARG HE 1 1 5 1141 1 1 7 ARG HG2 H -9.353 -11.333 -0.700 1.00 . A A . 7 ARG HG2 1 1 5 1142 1 1 7 ARG HG3 H -8.891 -9.889 0.203 1.00 . A A . 7 ARG HG3 1 1 5 1143 1 1 7 ARG HH11 H -11.597 -8.158 -2.885 1.00 . A A . 7 ARG HH11 1 1 5 1144 1 1 7 ARG HH12 H -13.324 -8.155 -3.025 1.00 . A A . 7 ARG HH12 1 1 5 1145 1 1 7 ARG HH21 H -13.805 -10.707 -0.683 1.00 . A A . 7 ARG HH21 1 1 5 1146 1 1 7 ARG HH22 H -14.579 -9.605 -1.772 1.00 . A A . 7 ARG HH22 1 1 5 1147 1 1 7 ARG N N -6.049 -9.767 0.200 1.00 . A A . 7 ARG N 1 1 5 1148 1 1 7 ARG NE N -11.453 -9.983 -1.171 1.00 . A A . 7 ARG NE 1 1 5 1149 1 1 7 ARG NH1 N -12.488 -8.522 -2.616 1.00 . A A . 7 ARG NH1 1 1 5 1150 1 1 7 ARG NH2 N -13.746 -9.975 -1.361 1.00 . A A . 7 ARG NH2 1 1 5 1151 1 1 7 ARG O O -4.846 -12.315 -1.505 1.00 . A A . 7 ARG O 1 1 5 1152 1 1 8 LYS C C -2.675 -10.532 -2.994 1.00 . A A . 8 LYS C 1 1 5 1153 1 1 8 LYS CA C -4.057 -10.702 -3.616 1.00 . A A . 8 LYS CA 1 1 5 1154 1 1 8 LYS CB C -4.190 -9.799 -4.844 1.00 . A A . 8 LYS CB 1 1 5 1155 1 1 8 LYS CD C -5.522 -11.166 -6.477 1.00 . A A . 8 LYS CD 1 1 5 1156 1 1 8 LYS CE C -6.335 -12.303 -5.878 1.00 . A A . 8 LYS CE 1 1 5 1157 1 1 8 LYS CG C -5.516 -9.947 -5.569 1.00 . A A . 8 LYS CG 1 1 5 1158 1 1 8 LYS H H -5.592 -9.548 -2.724 1.00 . A A . 8 LYS H 1 1 5 1159 1 1 8 LYS HA H -4.178 -11.730 -3.921 1.00 . A A . 8 LYS HA 1 1 5 1160 1 1 8 LYS HB2 H -4.087 -8.770 -4.532 1.00 . A A . 8 LYS HB2 1 1 5 1161 1 1 8 LYS HB3 H -3.396 -10.036 -5.538 1.00 . A A . 8 LYS HB3 1 1 5 1162 1 1 8 LYS HD2 H -5.953 -10.893 -7.428 1.00 . A A . 8 LYS HD2 1 1 5 1163 1 1 8 LYS HD3 H -4.505 -11.500 -6.623 1.00 . A A . 8 LYS HD3 1 1 5 1164 1 1 8 LYS HE2 H -5.949 -13.239 -6.251 1.00 . A A . 8 LYS HE2 1 1 5 1165 1 1 8 LYS HE3 H -6.233 -12.274 -4.803 1.00 . A A . 8 LYS HE3 1 1 5 1166 1 1 8 LYS HG2 H -6.305 -10.052 -4.839 1.00 . A A . 8 LYS HG2 1 1 5 1167 1 1 8 LYS HG3 H -5.691 -9.064 -6.166 1.00 . A A . 8 LYS HG3 1 1 5 1168 1 1 8 LYS HZ1 H -7.996 -12.828 -7.030 1.00 . A A . 8 LYS HZ1 1 1 5 1169 1 1 8 LYS HZ2 H -8.011 -11.222 -6.501 1.00 . A A . 8 LYS HZ2 1 1 5 1170 1 1 8 LYS HZ3 H -8.366 -12.473 -5.418 1.00 . A A . 8 LYS HZ3 1 1 5 1171 1 1 8 LYS N N -5.104 -10.395 -2.648 1.00 . A A . 8 LYS N 1 1 5 1172 1 1 8 LYS NZ N -7.778 -12.199 -6.231 1.00 . A A . 8 LYS NZ 1 1 5 1173 1 1 8 LYS O O -2.277 -9.423 -2.635 1.00 . A A . 8 LYS O 1 1 5 1174 1 1 9 CYS C C 0.437 -12.015 -3.324 1.00 . A A . 9 CYS C 1 1 5 1175 1 1 9 CYS CA C -0.609 -11.610 -2.291 1.00 . A A . 9 CYS CA 1 1 5 1176 1 1 9 CYS CB C -0.535 -12.542 -1.080 1.00 . A A . 9 CYS CB 1 1 5 1177 1 1 9 CYS H H -2.320 -12.491 -3.173 1.00 . A A . 9 CYS H 1 1 5 1178 1 1 9 CYS HA H -0.408 -10.600 -1.970 1.00 . A A . 9 CYS HA 1 1 5 1179 1 1 9 CYS HB2 H 0.496 -12.644 -0.777 1.00 . A A . 9 CYS HB2 1 1 5 1180 1 1 9 CYS HB3 H -1.102 -12.110 -0.269 1.00 . A A . 9 CYS HB3 1 1 5 1181 1 1 9 CYS HG H -1.264 -14.374 -2.696 1.00 . A A . 9 CYS HG 1 1 5 1182 1 1 9 CYS N N -1.948 -11.637 -2.869 1.00 . A A . 9 CYS N 1 1 5 1183 1 1 9 CYS O O 0.986 -13.117 -3.289 1.00 . A A . 9 CYS O 1 1 5 1184 1 1 9 CYS SG S -1.184 -14.202 -1.386 1.00 . A A . 9 CYS SG 1 1 5 1185 1 1 10 PRO C C 3.132 -11.384 -4.800 1.00 . A A . 10 PRO C 1 1 5 1186 1 1 10 PRO CA C 1.702 -11.345 -5.330 1.00 . A A . 10 PRO CA 1 1 5 1187 1 1 10 PRO CB C 1.512 -10.149 -6.266 1.00 . A A . 10 PRO CB 1 1 5 1188 1 1 10 PRO CD C 0.105 -9.771 -4.370 1.00 . A A . 10 PRO CD 1 1 5 1189 1 1 10 PRO CG C 0.952 -9.074 -5.398 1.00 . A A . 10 PRO CG 1 1 5 1190 1 1 10 PRO HA H 1.493 -12.260 -5.864 1.00 . A A . 10 PRO HA 1 1 5 1191 1 1 10 PRO HB2 H 2.465 -9.862 -6.686 1.00 . A A . 10 PRO HB2 1 1 5 1192 1 1 10 PRO HB3 H 0.827 -10.412 -7.058 1.00 . A A . 10 PRO HB3 1 1 5 1193 1 1 10 PRO HD2 H 0.153 -9.250 -3.426 1.00 . A A . 10 PRO HD2 1 1 5 1194 1 1 10 PRO HD3 H -0.917 -9.845 -4.711 1.00 . A A . 10 PRO HD3 1 1 5 1195 1 1 10 PRO HG2 H 1.755 -8.534 -4.919 1.00 . A A . 10 PRO HG2 1 1 5 1196 1 1 10 PRO HG3 H 0.347 -8.403 -5.990 1.00 . A A . 10 PRO HG3 1 1 5 1197 1 1 10 PRO N N 0.721 -11.105 -4.268 1.00 . A A . 10 PRO N 1 1 5 1198 1 1 10 PRO O O 3.937 -12.218 -5.217 1.00 . A A . 10 PRO O 1 1 5 1199 1 1 11 LEU C C 4.715 -10.616 -1.780 1.00 . A A . 11 LEU C 1 1 5 1200 1 1 11 LEU CA C 4.774 -10.410 -3.290 1.00 . A A . 11 LEU CA 1 1 5 1201 1 1 11 LEU CB C 5.424 -9.062 -3.607 1.00 . A A . 11 LEU CB 1 1 5 1202 1 1 11 LEU CD1 C 5.139 -6.677 -4.324 1.00 . A A . 11 LEU CD1 1 1 5 1203 1 1 11 LEU CD2 C 4.522 -8.531 -5.885 1.00 . A A . 11 LEU CD2 1 1 5 1204 1 1 11 LEU CG C 4.581 -8.087 -4.430 1.00 . A A . 11 LEU CG 1 1 5 1205 1 1 11 LEU H H 2.758 -9.841 -3.586 1.00 . A A . 11 LEU H 1 1 5 1206 1 1 11 LEU HA H 5.369 -11.199 -3.726 1.00 . A A . 11 LEU HA 1 1 5 1207 1 1 11 LEU HB2 H 5.663 -8.582 -2.670 1.00 . A A . 11 LEU HB2 1 1 5 1208 1 1 11 LEU HB3 H 6.336 -9.256 -4.154 1.00 . A A . 11 LEU HB3 1 1 5 1209 1 1 11 LEU HD11 H 5.101 -6.201 -5.291 1.00 . A A . 11 LEU HD11 1 1 5 1210 1 1 11 LEU HD12 H 6.164 -6.720 -3.983 1.00 . A A . 11 LEU HD12 1 1 5 1211 1 1 11 LEU HD13 H 4.550 -6.109 -3.619 1.00 . A A . 11 LEU HD13 1 1 5 1212 1 1 11 LEU HD21 H 3.572 -8.241 -6.310 1.00 . A A . 11 LEU HD21 1 1 5 1213 1 1 11 LEU HD22 H 4.628 -9.605 -5.938 1.00 . A A . 11 LEU HD22 1 1 5 1214 1 1 11 LEU HD23 H 5.322 -8.062 -6.437 1.00 . A A . 11 LEU HD23 1 1 5 1215 1 1 11 LEU HG H 3.572 -8.077 -4.041 1.00 . A A . 11 LEU HG 1 1 5 1216 1 1 11 LEU N N 3.441 -10.479 -3.878 1.00 . A A . 11 LEU N 1 1 5 1217 1 1 11 LEU O O 5.016 -11.700 -1.279 1.00 . A A . 11 LEU O 1 1 5 1218 1 1 12 PHE C C 2.809 -9.294 0.857 1.00 . A A . 12 PHE C 1 1 5 1219 1 1 12 PHE CA C 4.221 -9.637 0.393 1.00 . A A . 12 PHE CA 1 1 5 1220 1 1 12 PHE CB C 5.228 -8.684 1.040 1.00 . A A . 12 PHE CB 1 1 5 1221 1 1 12 PHE CD1 C 5.143 -6.485 -0.166 1.00 . A A . 12 PHE CD1 1 1 5 1222 1 1 12 PHE CD2 C 6.999 -7.927 -0.569 1.00 . A A . 12 PHE CD2 1 1 5 1223 1 1 12 PHE CE1 C 5.668 -5.558 -1.046 1.00 . A A . 12 PHE CE1 1 1 5 1224 1 1 12 PHE CE2 C 7.529 -7.003 -1.450 1.00 . A A . 12 PHE CE2 1 1 5 1225 1 1 12 PHE CG C 5.802 -7.679 0.082 1.00 . A A . 12 PHE CG 1 1 5 1226 1 1 12 PHE CZ C 6.862 -5.818 -1.689 1.00 . A A . 12 PHE CZ 1 1 5 1227 1 1 12 PHE H H 4.095 -8.734 -1.518 1.00 . A A . 12 PHE H 1 1 5 1228 1 1 12 PHE HA H 4.450 -10.648 0.694 1.00 . A A . 12 PHE HA 1 1 5 1229 1 1 12 PHE HB2 H 4.741 -8.143 1.836 1.00 . A A . 12 PHE HB2 1 1 5 1230 1 1 12 PHE HB3 H 6.046 -9.259 1.448 1.00 . A A . 12 PHE HB3 1 1 5 1231 1 1 12 PHE HD1 H 4.208 -6.281 0.337 1.00 . A A . 12 PHE HD1 1 1 5 1232 1 1 12 PHE HD2 H 7.521 -8.855 -0.384 1.00 . A A . 12 PHE HD2 1 1 5 1233 1 1 12 PHE HE1 H 5.144 -4.632 -1.231 1.00 . A A . 12 PHE HE1 1 1 5 1234 1 1 12 PHE HE2 H 8.463 -7.209 -1.952 1.00 . A A . 12 PHE HE2 1 1 5 1235 1 1 12 PHE HZ H 7.275 -5.094 -2.377 1.00 . A A . 12 PHE HZ 1 1 5 1236 1 1 12 PHE N N 4.322 -9.571 -1.060 1.00 . A A . 12 PHE N 1 1 5 1237 1 1 12 PHE O O 2.508 -8.141 1.165 1.00 . A A . 12 PHE O 1 1 5 1238 1 1 13 GLY C C 0.376 -10.365 2.806 1.00 . A A . 13 GLY C 1 1 5 1239 1 1 13 GLY CA C 0.574 -10.088 1.329 1.00 . A A . 13 GLY CA 1 1 5 1240 1 1 13 GLY H H 2.241 -11.202 0.646 1.00 . A A . 13 GLY H 1 1 5 1241 1 1 13 GLY HA2 H 0.302 -9.063 1.126 1.00 . A A . 13 GLY HA2 1 1 5 1242 1 1 13 GLY HA3 H -0.073 -10.741 0.762 1.00 . A A . 13 GLY HA3 1 1 5 1243 1 1 13 GLY N N 1.945 -10.303 0.903 1.00 . A A . 13 GLY N 1 1 5 1244 1 1 13 GLY O O -0.734 -10.245 3.325 1.00 . A A . 13 GLY O 1 1 5 1245 1 1 14 LYS C C 1.257 -9.754 5.729 1.00 . A A . 14 LYS C 1 1 5 1246 1 1 14 LYS CA C 1.395 -11.035 4.913 1.00 . A A . 14 LYS CA 1 1 5 1247 1 1 14 LYS CB C 2.649 -11.797 5.349 1.00 . A A . 14 LYS CB 1 1 5 1248 1 1 14 LYS CD C 4.732 -11.982 3.958 1.00 . A A . 14 LYS CD 1 1 5 1249 1 1 14 LYS CE C 5.147 -13.303 4.586 1.00 . A A . 14 LYS CE 1 1 5 1250 1 1 14 LYS CG C 3.945 -11.123 4.934 1.00 . A A . 14 LYS CG 1 1 5 1251 1 1 14 LYS H H 2.312 -10.817 3.017 1.00 . A A . 14 LYS H 1 1 5 1252 1 1 14 LYS HA H 0.529 -11.654 5.088 1.00 . A A . 14 LYS HA 1 1 5 1253 1 1 14 LYS HB2 H 2.643 -11.889 6.425 1.00 . A A . 14 LYS HB2 1 1 5 1254 1 1 14 LYS HB3 H 2.625 -12.785 4.911 1.00 . A A . 14 LYS HB3 1 1 5 1255 1 1 14 LYS HD2 H 4.118 -12.185 3.093 1.00 . A A . 14 LYS HD2 1 1 5 1256 1 1 14 LYS HD3 H 5.619 -11.444 3.653 1.00 . A A . 14 LYS HD3 1 1 5 1257 1 1 14 LYS HE2 H 5.104 -13.206 5.660 1.00 . A A . 14 LYS HE2 1 1 5 1258 1 1 14 LYS HE3 H 4.457 -14.071 4.267 1.00 . A A . 14 LYS HE3 1 1 5 1259 1 1 14 LYS HG2 H 3.715 -10.180 4.462 1.00 . A A . 14 LYS HG2 1 1 5 1260 1 1 14 LYS HG3 H 4.548 -10.951 5.814 1.00 . A A . 14 LYS HG3 1 1 5 1261 1 1 14 LYS HZ1 H 6.833 -14.527 4.739 1.00 . A A . 14 LYS HZ1 1 1 5 1262 1 1 14 LYS HZ2 H 7.187 -12.915 4.370 1.00 . A A . 14 LYS HZ2 1 1 5 1263 1 1 14 LYS HZ3 H 6.554 -13.935 3.178 1.00 . A A . 14 LYS HZ3 1 1 5 1264 1 1 14 LYS N N 1.454 -10.739 3.486 1.00 . A A . 14 LYS N 1 1 5 1265 1 1 14 LYS NZ N 6.527 -13.697 4.190 1.00 . A A . 14 LYS NZ 1 1 5 1266 1 1 14 LYS O O 0.591 -9.734 6.763 1.00 . A A . 14 LYS O 1 1 5 1267 1 1 15 GLY C C 1.233 -6.312 5.096 1.00 . A A . 15 GLY C 1 1 5 1268 1 1 15 GLY CA C 1.824 -7.414 5.953 1.00 . A A . 15 GLY CA 1 1 5 1269 1 1 15 GLY H H 2.407 -8.759 4.426 1.00 . A A . 15 GLY H 1 1 5 1270 1 1 15 GLY HA2 H 1.217 -7.533 6.838 1.00 . A A . 15 GLY HA2 1 1 5 1271 1 1 15 GLY HA3 H 2.822 -7.126 6.250 1.00 . A A . 15 GLY HA3 1 1 5 1272 1 1 15 GLY N N 1.890 -8.684 5.255 1.00 . A A . 15 GLY N 1 1 5 1273 1 1 15 GLY O O 0.581 -5.401 5.606 1.00 . A A . 15 GLY O 1 1 5 1274 1 1 16 GLY C C 1.281 -3.978 3.321 1.00 . A A . 16 GLY C 1 1 5 1275 1 1 16 GLY CA C 0.942 -5.388 2.881 1.00 . A A . 16 GLY CA 1 1 5 1276 1 1 16 GLY H H 1.988 -7.142 3.439 1.00 . A A . 16 GLY H 1 1 5 1277 1 1 16 GLY HA2 H 1.356 -5.557 1.898 1.00 . A A . 16 GLY HA2 1 1 5 1278 1 1 16 GLY HA3 H -0.133 -5.488 2.829 1.00 . A A . 16 GLY HA3 1 1 5 1279 1 1 16 GLY N N 1.462 -6.393 3.789 1.00 . A A . 16 GLY N 1 1 5 1280 1 1 16 GLY O O 2.439 -3.564 3.260 1.00 . A A . 16 GLY O 1 1 6 1281 1 1 1 VAL C C 2.104 -0.685 -2.522 1.00 . A A . 1 VAL C 1 1 6 1282 1 1 1 VAL CA C 2.959 -0.111 -1.399 1.00 . A A . 1 VAL CA 1 1 6 1283 1 1 1 VAL CB C 3.416 -1.258 -0.478 1.00 . A A . 1 VAL CB 1 1 6 1284 1 1 1 VAL CG1 C 3.865 -2.456 -1.300 1.00 . A A . 1 VAL CG1 1 1 6 1285 1 1 1 VAL CG2 C 4.528 -0.788 0.447 1.00 . A A . 1 VAL CG2 1 1 6 1286 1 1 1 VAL H1 H 1.629 0.637 0.068 1.00 . A A . 1 VAL H1 1 1 6 1287 1 1 1 VAL HA H 3.838 0.350 -1.827 1.00 . A A . 1 VAL HA 1 1 6 1288 1 1 1 VAL HB H 2.575 -1.562 0.129 1.00 . A A . 1 VAL HB 1 1 6 1289 1 1 1 VAL HG11 H 4.525 -3.072 -0.707 1.00 . A A . 1 VAL HG11 1 1 6 1290 1 1 1 VAL HG12 H 3.002 -3.034 -1.597 1.00 . A A . 1 VAL HG12 1 1 6 1291 1 1 1 VAL HG13 H 4.389 -2.113 -2.180 1.00 . A A . 1 VAL HG13 1 1 6 1292 1 1 1 VAL HG21 H 4.853 -1.611 1.066 1.00 . A A . 1 VAL HG21 1 1 6 1293 1 1 1 VAL HG22 H 5.360 -0.431 -0.142 1.00 . A A . 1 VAL HG22 1 1 6 1294 1 1 1 VAL HG23 H 4.162 0.011 1.074 1.00 . A A . 1 VAL HG23 1 1 6 1295 1 1 1 VAL N N 2.233 0.910 -0.654 1.00 . A A . 1 VAL N 1 1 6 1296 1 1 1 VAL O O 2.283 -0.342 -3.690 1.00 . A A . 1 VAL O 1 1 6 1297 1 1 2 ALA C C -1.177 -1.955 -2.774 1.00 . A A . 2 ALA C 1 1 6 1298 1 1 2 ALA CA C 0.286 -2.182 -3.138 1.00 . A A . 2 ALA CA 1 1 6 1299 1 1 2 ALA CB C 0.581 -3.671 -3.246 1.00 . A A . 2 ALA CB 1 1 6 1300 1 1 2 ALA H H 1.078 -1.795 -1.213 1.00 . A A . 2 ALA H 1 1 6 1301 1 1 2 ALA HA H 0.482 -1.731 -4.100 1.00 . A A . 2 ALA HA 1 1 6 1302 1 1 2 ALA HB1 H -0.063 -4.214 -2.570 1.00 . A A . 2 ALA HB1 1 1 6 1303 1 1 2 ALA HB2 H 0.400 -4.001 -4.258 1.00 . A A . 2 ALA HB2 1 1 6 1304 1 1 2 ALA HB3 H 1.612 -3.854 -2.986 1.00 . A A . 2 ALA HB3 1 1 6 1305 1 1 2 ALA N N 1.172 -1.562 -2.160 1.00 . A A . 2 ALA N 1 1 6 1306 1 1 2 ALA O O -1.626 -2.343 -1.695 1.00 . A A . 2 ALA O 1 1 6 1307 1 1 3 ARG C C -4.072 -2.307 -3.030 1.00 . A A . 3 ARG C 1 1 6 1308 1 1 3 ARG CA C -3.329 -1.044 -3.454 1.00 . A A . 3 ARG CA 1 1 6 1309 1 1 3 ARG CB C -3.965 -0.465 -4.719 1.00 . A A . 3 ARG CB 1 1 6 1310 1 1 3 ARG CD C -4.475 -0.927 -7.136 1.00 . A A . 3 ARG CD 1 1 6 1311 1 1 3 ARG CG C -4.359 -1.519 -5.740 1.00 . A A . 3 ARG CG 1 1 6 1312 1 1 3 ARG CZ C -5.812 -2.546 -8.414 1.00 . A A . 3 ARG CZ 1 1 6 1313 1 1 3 ARG H H -1.501 -1.039 -4.521 1.00 . A A . 3 ARG H 1 1 6 1314 1 1 3 ARG HA H -3.399 -0.315 -2.660 1.00 . A A . 3 ARG HA 1 1 6 1315 1 1 3 ARG HB2 H -4.852 0.086 -4.442 1.00 . A A . 3 ARG HB2 1 1 6 1316 1 1 3 ARG HB3 H -3.263 0.211 -5.183 1.00 . A A . 3 ARG HB3 1 1 6 1317 1 1 3 ARG HD2 H -5.326 -0.263 -7.161 1.00 . A A . 3 ARG HD2 1 1 6 1318 1 1 3 ARG HD3 H -3.576 -0.370 -7.351 1.00 . A A . 3 ARG HD3 1 1 6 1319 1 1 3 ARG HE H -3.860 -2.226 -8.670 1.00 . A A . 3 ARG HE 1 1 6 1320 1 1 3 ARG HG2 H -3.607 -2.295 -5.751 1.00 . A A . 3 ARG HG2 1 1 6 1321 1 1 3 ARG HG3 H -5.311 -1.943 -5.457 1.00 . A A . 3 ARG HG3 1 1 6 1322 1 1 3 ARG HH11 H -6.841 -1.504 -7.023 1.00 . A A . 3 ARG HH11 1 1 6 1323 1 1 3 ARG HH12 H -7.772 -2.648 -7.932 1.00 . A A . 3 ARG HH12 1 1 6 1324 1 1 3 ARG HH21 H -5.075 -3.736 -9.873 1.00 . A A . 3 ARG HH21 1 1 6 1325 1 1 3 ARG HH22 H -6.767 -3.918 -9.552 1.00 . A A . 3 ARG HH22 1 1 6 1326 1 1 3 ARG N N -1.916 -1.324 -3.680 1.00 . A A . 3 ARG N 1 1 6 1327 1 1 3 ARG NE N -4.650 -1.959 -8.155 1.00 . A A . 3 ARG NE 1 1 6 1328 1 1 3 ARG NH1 N -6.898 -2.205 -7.734 1.00 . A A . 3 ARG NH1 1 1 6 1329 1 1 3 ARG NH2 N -5.891 -3.476 -9.357 1.00 . A A . 3 ARG NH2 1 1 6 1330 1 1 3 ARG O O -5.058 -2.242 -2.296 1.00 . A A . 3 ARG O 1 1 6 1331 1 1 4 GLY C C -3.295 -5.645 -2.401 1.00 . A A . 4 GLY C 1 1 6 1332 1 1 4 GLY CA C -4.224 -4.717 -3.157 1.00 . A A . 4 GLY CA 1 1 6 1333 1 1 4 GLY H H -2.804 -3.446 -4.079 1.00 . A A . 4 GLY H 1 1 6 1334 1 1 4 GLY HA2 H -5.093 -4.519 -2.547 1.00 . A A . 4 GLY HA2 1 1 6 1335 1 1 4 GLY HA3 H -4.540 -5.205 -4.067 1.00 . A A . 4 GLY HA3 1 1 6 1336 1 1 4 GLY N N -3.593 -3.455 -3.498 1.00 . A A . 4 GLY N 1 1 6 1337 1 1 4 GLY O O -2.390 -6.240 -2.986 1.00 . A A . 4 GLY O 1 1 6 1338 1 1 5 TRP C C -3.540 -7.678 0.449 1.00 . A A . 5 TRP C 1 1 6 1339 1 1 5 TRP CA C -2.690 -6.629 -0.260 1.00 . A A . 5 TRP CA 1 1 6 1340 1 1 5 TRP CB C -1.925 -5.794 0.769 1.00 . A A . 5 TRP CB 1 1 6 1341 1 1 5 TRP CD1 C -0.084 -4.047 0.416 1.00 . A A . 5 TRP CD1 1 1 6 1342 1 1 5 TRP CD2 C 0.374 -6.057 -0.460 1.00 . A A . 5 TRP CD2 1 1 6 1343 1 1 5 TRP CE2 C 1.457 -5.196 -0.721 1.00 . A A . 5 TRP CE2 1 1 6 1344 1 1 5 TRP CE3 C 0.437 -7.377 -0.915 1.00 . A A . 5 TRP CE3 1 1 6 1345 1 1 5 TRP CG C -0.601 -5.302 0.269 1.00 . A A . 5 TRP CG 1 1 6 1346 1 1 5 TRP CH2 C 2.623 -6.910 -1.852 1.00 . A A . 5 TRP CH2 1 1 6 1347 1 1 5 TRP CZ2 C 2.588 -5.613 -1.418 1.00 . A A . 5 TRP CZ2 1 1 6 1348 1 1 5 TRP CZ3 C 1.560 -7.789 -1.607 1.00 . A A . 5 TRP CZ3 1 1 6 1349 1 1 5 TRP H H -4.253 -5.267 -0.688 1.00 . A A . 5 TRP H 1 1 6 1350 1 1 5 TRP HA H -1.980 -7.131 -0.901 1.00 . A A . 5 TRP HA 1 1 6 1351 1 1 5 TRP HB2 H -2.520 -4.934 1.038 1.00 . A A . 5 TRP HB2 1 1 6 1352 1 1 5 TRP HB3 H -1.749 -6.395 1.649 1.00 . A A . 5 TRP HB3 1 1 6 1353 1 1 5 TRP HD1 H -0.586 -3.239 0.925 1.00 . A A . 5 TRP HD1 1 1 6 1354 1 1 5 TRP HE1 H 1.726 -3.180 -0.205 1.00 . A A . 5 TRP HE1 1 1 6 1355 1 1 5 TRP HE3 H -0.372 -8.069 -0.736 1.00 . A A . 5 TRP HE3 1 1 6 1356 1 1 5 TRP HH2 H 3.480 -7.275 -2.397 1.00 . A A . 5 TRP HH2 1 1 6 1357 1 1 5 TRP HZ2 H 3.416 -4.948 -1.615 1.00 . A A . 5 TRP HZ2 1 1 6 1358 1 1 5 TRP HZ3 H 1.627 -8.805 -1.967 1.00 . A A . 5 TRP HZ3 1 1 6 1359 1 1 5 TRP N N -3.516 -5.768 -1.097 1.00 . A A . 5 TRP N 1 1 6 1360 1 1 5 TRP NE1 N 1.154 -3.976 -0.177 1.00 . A A . 5 TRP NE1 1 1 6 1361 1 1 5 TRP O O -3.611 -8.829 0.018 1.00 . A A . 5 TRP O 1 1 6 1362 1 1 6 LYS C C -5.643 -9.246 1.407 1.00 . A A . 6 LYS C 1 1 6 1363 1 1 6 LYS CA C -5.032 -8.177 2.307 1.00 . A A . 6 LYS CA 1 1 6 1364 1 1 6 LYS CB C -6.141 -7.393 3.012 1.00 . A A . 6 LYS CB 1 1 6 1365 1 1 6 LYS CD C -7.714 -5.435 2.976 1.00 . A A . 6 LYS CD 1 1 6 1366 1 1 6 LYS CE C -9.089 -5.988 2.632 1.00 . A A . 6 LYS CE 1 1 6 1367 1 1 6 LYS CG C -6.614 -6.176 2.235 1.00 . A A . 6 LYS CG 1 1 6 1368 1 1 6 LYS H H -4.088 -6.342 1.832 1.00 . A A . 6 LYS H 1 1 6 1369 1 1 6 LYS HA H -4.415 -8.658 3.050 1.00 . A A . 6 LYS HA 1 1 6 1370 1 1 6 LYS HB2 H -6.986 -8.048 3.165 1.00 . A A . 6 LYS HB2 1 1 6 1371 1 1 6 LYS HB3 H -5.775 -7.061 3.973 1.00 . A A . 6 LYS HB3 1 1 6 1372 1 1 6 LYS HD2 H -7.554 -5.538 4.039 1.00 . A A . 6 LYS HD2 1 1 6 1373 1 1 6 LYS HD3 H -7.678 -4.389 2.705 1.00 . A A . 6 LYS HD3 1 1 6 1374 1 1 6 LYS HE2 H -8.971 -6.978 2.218 1.00 . A A . 6 LYS HE2 1 1 6 1375 1 1 6 LYS HE3 H -9.677 -6.043 3.536 1.00 . A A . 6 LYS HE3 1 1 6 1376 1 1 6 LYS HG2 H -5.780 -5.507 2.089 1.00 . A A . 6 LYS HG2 1 1 6 1377 1 1 6 LYS HG3 H -6.993 -6.498 1.275 1.00 . A A . 6 LYS HG3 1 1 6 1378 1 1 6 LYS HZ1 H -9.171 -4.369 1.314 1.00 . A A . 6 LYS HZ1 1 1 6 1379 1 1 6 LYS HZ2 H -10.642 -4.706 2.078 1.00 . A A . 6 LYS HZ2 1 1 6 1380 1 1 6 LYS HZ3 H -10.094 -5.699 0.823 1.00 . A A . 6 LYS HZ3 1 1 6 1381 1 1 6 LYS N N -4.184 -7.273 1.538 1.00 . A A . 6 LYS N 1 1 6 1382 1 1 6 LYS NZ N -9.799 -5.131 1.643 1.00 . A A . 6 LYS NZ 1 1 6 1383 1 1 6 LYS O O -5.545 -10.440 1.691 1.00 . A A . 6 LYS O 1 1 6 1384 1 1 7 ARG C C -5.872 -10.292 -1.598 1.00 . A A . 7 ARG C 1 1 6 1385 1 1 7 ARG CA C -6.900 -9.730 -0.620 1.00 . A A . 7 ARG CA 1 1 6 1386 1 1 7 ARG CB C -8.018 -9.024 -1.389 1.00 . A A . 7 ARG CB 1 1 6 1387 1 1 7 ARG CD C -9.450 -11.067 -1.690 1.00 . A A . 7 ARG CD 1 1 6 1388 1 1 7 ARG CG C -8.732 -9.921 -2.386 1.00 . A A . 7 ARG CG 1 1 6 1389 1 1 7 ARG CZ C -9.369 -13.524 -1.703 1.00 . A A . 7 ARG CZ 1 1 6 1390 1 1 7 ARG H H -6.318 -7.846 0.149 1.00 . A A . 7 ARG H 1 1 6 1391 1 1 7 ARG HA H -7.324 -10.546 -0.054 1.00 . A A . 7 ARG HA 1 1 6 1392 1 1 7 ARG HB2 H -8.748 -8.655 -0.682 1.00 . A A . 7 ARG HB2 1 1 6 1393 1 1 7 ARG HB3 H -7.596 -8.189 -1.927 1.00 . A A . 7 ARG HB3 1 1 6 1394 1 1 7 ARG HD2 H -9.151 -11.085 -0.652 1.00 . A A . 7 ARG HD2 1 1 6 1395 1 1 7 ARG HD3 H -10.515 -10.899 -1.754 1.00 . A A . 7 ARG HD3 1 1 6 1396 1 1 7 ARG HE H -8.730 -12.355 -3.187 1.00 . A A . 7 ARG HE 1 1 6 1397 1 1 7 ARG HG2 H -9.458 -9.334 -2.929 1.00 . A A . 7 ARG HG2 1 1 6 1398 1 1 7 ARG HG3 H -8.007 -10.327 -3.074 1.00 . A A . 7 ARG HG3 1 1 6 1399 1 1 7 ARG HH11 H -10.155 -12.709 -0.030 1.00 . A A . 7 ARG HH11 1 1 6 1400 1 1 7 ARG HH12 H -10.092 -14.440 -0.053 1.00 . A A . 7 ARG HH12 1 1 6 1401 1 1 7 ARG HH21 H -8.642 -14.634 -3.229 1.00 . A A . 7 ARG HH21 1 1 6 1402 1 1 7 ARG HH22 H -9.231 -15.534 -1.872 1.00 . A A . 7 ARG HH22 1 1 6 1403 1 1 7 ARG N N -6.273 -8.810 0.321 1.00 . A A . 7 ARG N 1 1 6 1404 1 1 7 ARG NE N -9.135 -12.358 -2.295 1.00 . A A . 7 ARG NE 1 1 6 1405 1 1 7 ARG NH1 N -9.917 -13.561 -0.496 1.00 . A A . 7 ARG NH1 1 1 6 1406 1 1 7 ARG NH2 N -9.055 -14.657 -2.319 1.00 . A A . 7 ARG NH2 1 1 6 1407 1 1 7 ARG O O -5.468 -11.450 -1.494 1.00 . A A . 7 ARG O 1 1 6 1408 1 1 8 LYS C C -3.065 -9.884 -2.953 1.00 . A A . 8 LYS C 1 1 6 1409 1 1 8 LYS CA C -4.471 -9.874 -3.545 1.00 . A A . 8 LYS CA 1 1 6 1410 1 1 8 LYS CB C -4.520 -8.939 -4.755 1.00 . A A . 8 LYS CB 1 1 6 1411 1 1 8 LYS CD C -5.476 -10.063 -6.787 1.00 . A A . 8 LYS CD 1 1 6 1412 1 1 8 LYS CE C -5.611 -11.521 -6.377 1.00 . A A . 8 LYS CE 1 1 6 1413 1 1 8 LYS CG C -5.753 -9.129 -5.621 1.00 . A A . 8 LYS CG 1 1 6 1414 1 1 8 LYS H H -5.811 -8.551 -2.579 1.00 . A A . 8 LYS H 1 1 6 1415 1 1 8 LYS HA H -4.722 -10.875 -3.863 1.00 . A A . 8 LYS HA 1 1 6 1416 1 1 8 LYS HB2 H -4.504 -7.917 -4.405 1.00 . A A . 8 LYS HB2 1 1 6 1417 1 1 8 LYS HB3 H -3.646 -9.115 -5.366 1.00 . A A . 8 LYS HB3 1 1 6 1418 1 1 8 LYS HD2 H -6.183 -9.856 -7.578 1.00 . A A . 8 LYS HD2 1 1 6 1419 1 1 8 LYS HD3 H -4.471 -9.889 -7.146 1.00 . A A . 8 LYS HD3 1 1 6 1420 1 1 8 LYS HE2 H -4.818 -11.761 -5.685 1.00 . A A . 8 LYS HE2 1 1 6 1421 1 1 8 LYS HE3 H -6.566 -11.658 -5.893 1.00 . A A . 8 LYS HE3 1 1 6 1422 1 1 8 LYS HG2 H -6.544 -9.548 -5.018 1.00 . A A . 8 LYS HG2 1 1 6 1423 1 1 8 LYS HG3 H -6.062 -8.167 -6.007 1.00 . A A . 8 LYS HG3 1 1 6 1424 1 1 8 LYS HZ1 H -4.634 -12.278 -8.061 1.00 . A A . 8 LYS HZ1 1 1 6 1425 1 1 8 LYS HZ2 H -6.320 -12.264 -8.196 1.00 . A A . 8 LYS HZ2 1 1 6 1426 1 1 8 LYS HZ3 H -5.558 -13.427 -7.232 1.00 . A A . 8 LYS HZ3 1 1 6 1427 1 1 8 LYS N N -5.452 -9.463 -2.548 1.00 . A A . 8 LYS N 1 1 6 1428 1 1 8 LYS NZ N -5.525 -12.437 -7.548 1.00 . A A . 8 LYS NZ 1 1 6 1429 1 1 8 LYS O O -2.522 -8.836 -2.602 1.00 . A A . 8 LYS O 1 1 6 1430 1 1 9 CYS C C -0.173 -11.745 -3.353 1.00 . A A . 9 CYS C 1 1 6 1431 1 1 9 CYS CA C -1.139 -11.219 -2.296 1.00 . A A . 9 CYS CA 1 1 6 1432 1 1 9 CYS CB C -1.157 -12.160 -1.091 1.00 . A A . 9 CYS CB 1 1 6 1433 1 1 9 CYS H H -2.966 -11.872 -3.142 1.00 . A A . 9 CYS H 1 1 6 1434 1 1 9 CYS HA H -0.805 -10.244 -1.976 1.00 . A A . 9 CYS HA 1 1 6 1435 1 1 9 CYS HB2 H -0.141 -12.388 -0.806 1.00 . A A . 9 CYS HB2 1 1 6 1436 1 1 9 CYS HB3 H -1.653 -11.668 -0.268 1.00 . A A . 9 CYS HB3 1 1 6 1437 1 1 9 CYS HG H -3.208 -13.654 -0.838 1.00 . A A . 9 CYS HG 1 1 6 1438 1 1 9 CYS N N -2.482 -11.073 -2.845 1.00 . A A . 9 CYS N 1 1 6 1439 1 1 9 CYS O O 0.237 -12.906 -3.332 1.00 . A A . 9 CYS O 1 1 6 1440 1 1 9 CYS SG S -2.007 -13.727 -1.392 1.00 . A A . 9 CYS SG 1 1 6 1441 1 1 10 PRO C C 2.544 -11.444 -4.890 1.00 . A A . 10 PRO C 1 1 6 1442 1 1 10 PRO CA C 1.119 -11.228 -5.387 1.00 . A A . 10 PRO CA 1 1 6 1443 1 1 10 PRO CB C 1.056 -10.014 -6.317 1.00 . A A . 10 PRO CB 1 1 6 1444 1 1 10 PRO CD C -0.251 -9.473 -4.389 1.00 . A A . 10 PRO CD 1 1 6 1445 1 1 10 PRO CG C 0.652 -8.882 -5.436 1.00 . A A . 10 PRO CG 1 1 6 1446 1 1 10 PRO HA H 0.786 -12.108 -5.918 1.00 . A A . 10 PRO HA 1 1 6 1447 1 1 10 PRO HB2 H 2.027 -9.845 -6.759 1.00 . A A . 10 PRO HB2 1 1 6 1448 1 1 10 PRO HB3 H 0.326 -10.188 -7.094 1.00 . A A . 10 PRO HB3 1 1 6 1449 1 1 10 PRO HD2 H -0.118 -8.966 -3.445 1.00 . A A . 10 PRO HD2 1 1 6 1450 1 1 10 PRO HD3 H -1.282 -9.419 -4.707 1.00 . A A . 10 PRO HD3 1 1 6 1451 1 1 10 PRO HG2 H 1.526 -8.446 -4.975 1.00 . A A . 10 PRO HG2 1 1 6 1452 1 1 10 PRO HG3 H 0.121 -8.139 -6.013 1.00 . A A . 10 PRO HG3 1 1 6 1453 1 1 10 PRO N N 0.198 -10.873 -4.302 1.00 . A A . 10 PRO N 1 1 6 1454 1 1 10 PRO O O 3.236 -12.360 -5.336 1.00 . A A . 10 PRO O 1 1 6 1455 1 1 11 LEU C C 4.269 -10.922 -1.897 1.00 . A A . 11 LEU C 1 1 6 1456 1 1 11 LEU CA C 4.322 -10.696 -3.404 1.00 . A A . 11 LEU CA 1 1 6 1457 1 1 11 LEU CB C 5.119 -9.428 -3.714 1.00 . A A . 11 LEU CB 1 1 6 1458 1 1 11 LEU CD1 C 5.106 -7.018 -4.404 1.00 . A A . 11 LEU CD1 1 1 6 1459 1 1 11 LEU CD2 C 4.250 -8.769 -5.972 1.00 . A A . 11 LEU CD2 1 1 6 1460 1 1 11 LEU CG C 4.384 -8.352 -4.514 1.00 . A A . 11 LEU CG 1 1 6 1461 1 1 11 LEU H H 2.381 -9.888 -3.646 1.00 . A A . 11 LEU H 1 1 6 1462 1 1 11 LEU HA H 4.811 -11.541 -3.866 1.00 . A A . 11 LEU HA 1 1 6 1463 1 1 11 LEU HB2 H 5.423 -8.991 -2.775 1.00 . A A . 11 LEU HB2 1 1 6 1464 1 1 11 LEU HB3 H 5.996 -9.718 -4.275 1.00 . A A . 11 LEU HB3 1 1 6 1465 1 1 11 LEU HD11 H 4.600 -6.393 -3.684 1.00 . A A . 11 LEU HD11 1 1 6 1466 1 1 11 LEU HD12 H 5.108 -6.529 -5.367 1.00 . A A . 11 LEU HD12 1 1 6 1467 1 1 11 LEU HD13 H 6.124 -7.186 -4.084 1.00 . A A . 11 LEU HD13 1 1 6 1468 1 1 11 LEU HD21 H 3.330 -8.374 -6.375 1.00 . A A . 11 LEU HD21 1 1 6 1469 1 1 11 LEU HD22 H 4.239 -9.847 -6.037 1.00 . A A . 11 LEU HD22 1 1 6 1470 1 1 11 LEU HD23 H 5.086 -8.382 -6.535 1.00 . A A . 11 LEU HD23 1 1 6 1471 1 1 11 LEU HG H 3.389 -8.227 -4.109 1.00 . A A . 11 LEU HG 1 1 6 1472 1 1 11 LEU N N 2.978 -10.597 -3.963 1.00 . A A . 11 LEU N 1 1 6 1473 1 1 11 LEU O O 4.451 -12.043 -1.420 1.00 . A A . 11 LEU O 1 1 6 1474 1 1 12 PHE C C 2.585 -9.437 0.803 1.00 . A A . 12 PHE C 1 1 6 1475 1 1 12 PHE CA C 3.939 -9.933 0.302 1.00 . A A . 12 PHE CA 1 1 6 1476 1 1 12 PHE CB C 5.063 -9.114 0.941 1.00 . A A . 12 PHE CB 1 1 6 1477 1 1 12 PHE CD1 C 5.240 -6.903 -0.231 1.00 . A A . 12 PHE CD1 1 1 6 1478 1 1 12 PHE CD2 C 6.878 -8.570 -0.703 1.00 . A A . 12 PHE CD2 1 1 6 1479 1 1 12 PHE CE1 C 5.862 -6.037 -1.111 1.00 . A A . 12 PHE CE1 1 1 6 1480 1 1 12 PHE CE2 C 7.504 -7.709 -1.585 1.00 . A A . 12 PHE CE2 1 1 6 1481 1 1 12 PHE CG C 5.741 -8.177 -0.017 1.00 . A A . 12 PHE CG 1 1 6 1482 1 1 12 PHE CZ C 6.995 -6.441 -1.790 1.00 . A A . 12 PHE CZ 1 1 6 1483 1 1 12 PHE H H 3.880 -8.985 -1.590 1.00 . A A . 12 PHE H 1 1 6 1484 1 1 12 PHE HA H 4.056 -10.968 0.582 1.00 . A A . 12 PHE HA 1 1 6 1485 1 1 12 PHE HB2 H 4.655 -8.525 1.749 1.00 . A A . 12 PHE HB2 1 1 6 1486 1 1 12 PHE HB3 H 5.810 -9.787 1.334 1.00 . A A . 12 PHE HB3 1 1 6 1487 1 1 12 PHE HD1 H 4.353 -6.586 0.300 1.00 . A A . 12 PHE HD1 1 1 6 1488 1 1 12 PHE HD2 H 7.277 -9.561 -0.545 1.00 . A A . 12 PHE HD2 1 1 6 1489 1 1 12 PHE HE1 H 5.460 -5.047 -1.269 1.00 . A A . 12 PHE HE1 1 1 6 1490 1 1 12 PHE HE2 H 8.390 -8.027 -2.114 1.00 . A A . 12 PHE HE2 1 1 6 1491 1 1 12 PHE HZ H 7.482 -5.767 -2.478 1.00 . A A . 12 PHE HZ 1 1 6 1492 1 1 12 PHE N N 4.017 -9.851 -1.152 1.00 . A A . 12 PHE N 1 1 6 1493 1 1 12 PHE O O 2.417 -8.256 1.104 1.00 . A A . 12 PHE O 1 1 6 1494 1 1 13 GLY C C 0.193 -9.975 2.865 1.00 . A A . 13 GLY C 1 1 6 1495 1 1 13 GLY CA C 0.296 -9.987 1.352 1.00 . A A . 13 GLY CA 1 1 6 1496 1 1 13 GLY H H 1.814 -11.277 0.635 1.00 . A A . 13 GLY H 1 1 6 1497 1 1 13 GLY HA2 H 0.051 -9.004 0.977 1.00 . A A . 13 GLY HA2 1 1 6 1498 1 1 13 GLY HA3 H -0.417 -10.698 0.961 1.00 . A A . 13 GLY HA3 1 1 6 1499 1 1 13 GLY N N 1.622 -10.350 0.889 1.00 . A A . 13 GLY N 1 1 6 1500 1 1 13 GLY O O -0.774 -9.459 3.425 1.00 . A A . 13 GLY O 1 1 6 1501 1 1 14 LYS C C 1.557 -9.237 5.576 1.00 . A A . 14 LYS C 1 1 6 1502 1 1 14 LYS CA C 1.212 -10.600 4.985 1.00 . A A . 14 LYS CA 1 1 6 1503 1 1 14 LYS CB C 2.223 -11.645 5.464 1.00 . A A . 14 LYS CB 1 1 6 1504 1 1 14 LYS CD C 3.412 -13.162 3.853 1.00 . A A . 14 LYS CD 1 1 6 1505 1 1 14 LYS CE C 4.622 -13.460 4.726 1.00 . A A . 14 LYS CE 1 1 6 1506 1 1 14 LYS CG C 2.161 -12.950 4.689 1.00 . A A . 14 LYS CG 1 1 6 1507 1 1 14 LYS H H 1.937 -10.940 3.025 1.00 . A A . 14 LYS H 1 1 6 1508 1 1 14 LYS HA H 0.226 -10.885 5.320 1.00 . A A . 14 LYS HA 1 1 6 1509 1 1 14 LYS HB2 H 3.218 -11.238 5.364 1.00 . A A . 14 LYS HB2 1 1 6 1510 1 1 14 LYS HB3 H 2.033 -11.860 6.506 1.00 . A A . 14 LYS HB3 1 1 6 1511 1 1 14 LYS HD2 H 3.252 -13.994 3.184 1.00 . A A . 14 LYS HD2 1 1 6 1512 1 1 14 LYS HD3 H 3.606 -12.267 3.278 1.00 . A A . 14 LYS HD3 1 1 6 1513 1 1 14 LYS HE2 H 5.517 -13.265 4.157 1.00 . A A . 14 LYS HE2 1 1 6 1514 1 1 14 LYS HE3 H 4.595 -12.812 5.589 1.00 . A A . 14 LYS HE3 1 1 6 1515 1 1 14 LYS HG2 H 2.065 -13.769 5.387 1.00 . A A . 14 LYS HG2 1 1 6 1516 1 1 14 LYS HG3 H 1.301 -12.929 4.034 1.00 . A A . 14 LYS HG3 1 1 6 1517 1 1 14 LYS HZ1 H 4.374 -15.509 4.402 1.00 . A A . 14 LYS HZ1 1 1 6 1518 1 1 14 LYS HZ2 H 3.963 -15.008 5.964 1.00 . A A . 14 LYS HZ2 1 1 6 1519 1 1 14 LYS HZ3 H 5.590 -15.134 5.518 1.00 . A A . 14 LYS HZ3 1 1 6 1520 1 1 14 LYS N N 1.193 -10.546 3.528 1.00 . A A . 14 LYS N 1 1 6 1521 1 1 14 LYS NZ N 4.638 -14.877 5.185 1.00 . A A . 14 LYS NZ 1 1 6 1522 1 1 14 LYS O O 0.828 -8.711 6.416 1.00 . A A . 14 LYS O 1 1 6 1523 1 1 15 GLY C C 2.740 -6.245 4.671 1.00 . A A . 15 GLY C 1 1 6 1524 1 1 15 GLY CA C 3.093 -7.370 5.623 1.00 . A A . 15 GLY CA 1 1 6 1525 1 1 15 GLY H H 3.215 -9.134 4.458 1.00 . A A . 15 GLY H 1 1 6 1526 1 1 15 GLY HA2 H 2.615 -7.187 6.574 1.00 . A A . 15 GLY HA2 1 1 6 1527 1 1 15 GLY HA3 H 4.164 -7.382 5.767 1.00 . A A . 15 GLY HA3 1 1 6 1528 1 1 15 GLY N N 2.673 -8.668 5.129 1.00 . A A . 15 GLY N 1 1 6 1529 1 1 15 GLY O O 3.471 -5.261 4.564 1.00 . A A . 15 GLY O 1 1 6 1530 1 1 16 GLY C C 1.170 -3.986 3.650 1.00 . A A . 16 GLY C 1 1 6 1531 1 1 16 GLY CA C 1.189 -5.372 3.035 1.00 . A A . 16 GLY CA 1 1 6 1532 1 1 16 GLY H H 1.073 -7.197 4.102 1.00 . A A . 16 GLY H 1 1 6 1533 1 1 16 GLY HA2 H 1.862 -5.371 2.191 1.00 . A A . 16 GLY HA2 1 1 6 1534 1 1 16 GLY HA3 H 0.194 -5.612 2.689 1.00 . A A . 16 GLY HA3 1 1 6 1535 1 1 16 GLY N N 1.616 -6.391 3.976 1.00 . A A . 16 GLY N 1 1 6 1536 1 1 16 GLY O O 0.618 -3.787 4.732 1.00 . A A . 16 GLY O 1 1 7 1537 1 1 1 VAL C C 1.437 -0.854 -2.294 1.00 . A A . 1 VAL C 1 1 7 1538 1 1 1 VAL CA C 2.109 -0.243 -1.069 1.00 . A A . 1 VAL CA 1 1 7 1539 1 1 1 VAL CB C 3.497 -0.886 -0.886 1.00 . A A . 1 VAL CB 1 1 7 1540 1 1 1 VAL CG1 C 4.233 -0.243 0.280 1.00 . A A . 1 VAL CG1 1 1 7 1541 1 1 1 VAL CG2 C 3.366 -2.387 -0.682 1.00 . A A . 1 VAL CG2 1 1 7 1542 1 1 1 VAL H1 H 0.309 -0.385 0.035 1.00 . A A . 1 VAL H1 1 1 7 1543 1 1 1 VAL HA H 2.245 0.816 -1.235 1.00 . A A . 1 VAL HA 1 1 7 1544 1 1 1 VAL HB H 4.072 -0.714 -1.784 1.00 . A A . 1 VAL HB 1 1 7 1545 1 1 1 VAL HG11 H 5.273 -0.112 0.021 1.00 . A A . 1 VAL HG11 1 1 7 1546 1 1 1 VAL HG12 H 3.791 0.718 0.500 1.00 . A A . 1 VAL HG12 1 1 7 1547 1 1 1 VAL HG13 H 4.157 -0.881 1.149 1.00 . A A . 1 VAL HG13 1 1 7 1548 1 1 1 VAL HG21 H 2.714 -2.797 -1.439 1.00 . A A . 1 VAL HG21 1 1 7 1549 1 1 1 VAL HG22 H 4.340 -2.848 -0.758 1.00 . A A . 1 VAL HG22 1 1 7 1550 1 1 1 VAL HG23 H 2.951 -2.583 0.296 1.00 . A A . 1 VAL HG23 1 1 7 1551 1 1 1 VAL N N 1.285 -0.411 0.122 1.00 . A A . 1 VAL N 1 1 7 1552 1 1 1 VAL O O 1.693 -0.442 -3.425 1.00 . A A . 1 VAL O 1 1 7 1553 1 1 2 ALA C C -1.646 -2.439 -2.930 1.00 . A A . 2 ALA C 1 1 7 1554 1 1 2 ALA CA C -0.137 -2.504 -3.143 1.00 . A A . 2 ALA CA 1 1 7 1555 1 1 2 ALA CB C 0.319 -3.950 -3.263 1.00 . A A . 2 ALA CB 1 1 7 1556 1 1 2 ALA H H 0.413 -2.121 -1.136 1.00 . A A . 2 ALA H 1 1 7 1557 1 1 2 ALA HA H 0.108 -1.997 -4.065 1.00 . A A . 2 ALA HA 1 1 7 1558 1 1 2 ALA HB1 H -0.281 -4.571 -2.614 1.00 . A A . 2 ALA HB1 1 1 7 1559 1 1 2 ALA HB2 H 0.204 -4.280 -4.285 1.00 . A A . 2 ALA HB2 1 1 7 1560 1 1 2 ALA HB3 H 1.357 -4.025 -2.975 1.00 . A A . 2 ALA HB3 1 1 7 1561 1 1 2 ALA N N 0.575 -1.838 -2.059 1.00 . A A . 2 ALA N 1 1 7 1562 1 1 2 ALA O O -2.159 -2.898 -1.909 1.00 . A A . 2 ALA O 1 1 7 1563 1 1 3 ARG C C -4.440 -3.062 -3.404 1.00 . A A . 3 ARG C 1 1 7 1564 1 1 3 ARG CA C -3.801 -1.739 -3.817 1.00 . A A . 3 ARG CA 1 1 7 1565 1 1 3 ARG CB C -4.372 -1.283 -5.161 1.00 . A A . 3 ARG CB 1 1 7 1566 1 1 3 ARG CD C -4.468 -1.884 -7.599 1.00 . A A . 3 ARG CD 1 1 7 1567 1 1 3 ARG CG C -4.522 -2.408 -6.173 1.00 . A A . 3 ARG CG 1 1 7 1568 1 1 3 ARG CZ C -5.786 -0.416 -9.066 1.00 . A A . 3 ARG CZ 1 1 7 1569 1 1 3 ARG H H -1.886 -1.519 -4.689 1.00 . A A . 3 ARG H 1 1 7 1570 1 1 3 ARG HA H -4.028 -0.994 -3.069 1.00 . A A . 3 ARG HA 1 1 7 1571 1 1 3 ARG HB2 H -5.346 -0.846 -4.996 1.00 . A A . 3 ARG HB2 1 1 7 1572 1 1 3 ARG HB3 H -3.717 -0.535 -5.581 1.00 . A A . 3 ARG HB3 1 1 7 1573 1 1 3 ARG HD2 H -3.605 -1.243 -7.701 1.00 . A A . 3 ARG HD2 1 1 7 1574 1 1 3 ARG HD3 H -4.374 -2.723 -8.273 1.00 . A A . 3 ARG HD3 1 1 7 1575 1 1 3 ARG HE H -6.418 -1.150 -7.322 1.00 . A A . 3 ARG HE 1 1 7 1576 1 1 3 ARG HG2 H -3.719 -3.116 -6.031 1.00 . A A . 3 ARG HG2 1 1 7 1577 1 1 3 ARG HG3 H -5.470 -2.899 -6.014 1.00 . A A . 3 ARG HG3 1 1 7 1578 1 1 3 ARG HH11 H -3.939 -0.865 -9.750 1.00 . A A . 3 ARG HH11 1 1 7 1579 1 1 3 ARG HH12 H -4.879 0.169 -10.774 1.00 . A A . 3 ARG HH12 1 1 7 1580 1 1 3 ARG HH21 H -7.665 0.212 -8.662 1.00 . A A . 3 ARG HH21 1 1 7 1581 1 1 3 ARG HH22 H -6.997 0.782 -10.154 1.00 . A A . 3 ARG HH22 1 1 7 1582 1 1 3 ARG N N -2.351 -1.866 -3.900 1.00 . A A . 3 ARG N 1 1 7 1583 1 1 3 ARG NE N -5.666 -1.127 -7.950 1.00 . A A . 3 ARG NE 1 1 7 1584 1 1 3 ARG NH1 N -4.786 -0.366 -9.935 1.00 . A A . 3 ARG NH1 1 1 7 1585 1 1 3 ARG NH2 N -6.908 0.247 -9.314 1.00 . A A . 3 ARG NH2 1 1 7 1586 1 1 3 ARG O O -5.480 -3.082 -2.747 1.00 . A A . 3 ARG O 1 1 7 1587 1 1 4 GLY C C -3.356 -6.292 -2.628 1.00 . A A . 4 GLY C 1 1 7 1588 1 1 4 GLY CA C -4.330 -5.477 -3.455 1.00 . A A . 4 GLY CA 1 1 7 1589 1 1 4 GLY H H -2.983 -4.088 -4.315 1.00 . A A . 4 GLY H 1 1 7 1590 1 1 4 GLY HA2 H -5.246 -5.355 -2.898 1.00 . A A . 4 GLY HA2 1 1 7 1591 1 1 4 GLY HA3 H -4.544 -6.013 -4.368 1.00 . A A . 4 GLY HA3 1 1 7 1592 1 1 4 GLY N N -3.809 -4.165 -3.794 1.00 . A A . 4 GLY N 1 1 7 1593 1 1 4 GLY O O -2.352 -6.783 -3.144 1.00 . A A . 4 GLY O 1 1 7 1594 1 1 5 TRP C C -3.562 -8.340 0.208 1.00 . A A . 5 TRP C 1 1 7 1595 1 1 5 TRP CA C -2.792 -7.194 -0.439 1.00 . A A . 5 TRP CA 1 1 7 1596 1 1 5 TRP CB C -2.213 -6.278 0.640 1.00 . A A . 5 TRP CB 1 1 7 1597 1 1 5 TRP CD1 C -0.564 -4.328 0.429 1.00 . A A . 5 TRP CD1 1 1 7 1598 1 1 5 TRP CD2 C 0.184 -6.263 -0.416 1.00 . A A . 5 TRP CD2 1 1 7 1599 1 1 5 TRP CE2 C 1.178 -5.280 -0.595 1.00 . A A . 5 TRP CE2 1 1 7 1600 1 1 5 TRP CE3 C 0.432 -7.561 -0.869 1.00 . A A . 5 TRP CE3 1 1 7 1601 1 1 5 TRP CG C -0.921 -5.633 0.241 1.00 . A A . 5 TRP CG 1 1 7 1602 1 1 5 TRP CH2 C 2.613 -6.837 -1.641 1.00 . A A . 5 TRP CH2 1 1 7 1603 1 1 5 TRP CZ2 C 2.397 -5.557 -1.207 1.00 . A A . 5 TRP CZ2 1 1 7 1604 1 1 5 TRP CZ3 C 1.643 -7.835 -1.478 1.00 . A A . 5 TRP CZ3 1 1 7 1605 1 1 5 TRP H H -4.466 -6.019 -0.988 1.00 . A A . 5 TRP H 1 1 7 1606 1 1 5 TRP HA H -1.982 -7.605 -1.023 1.00 . A A . 5 TRP HA 1 1 7 1607 1 1 5 TRP HB2 H -2.924 -5.495 0.857 1.00 . A A . 5 TRP HB2 1 1 7 1608 1 1 5 TRP HB3 H -2.035 -6.856 1.535 1.00 . A A . 5 TRP HB3 1 1 7 1609 1 1 5 TRP HD1 H -1.191 -3.588 0.901 1.00 . A A . 5 TRP HD1 1 1 7 1610 1 1 5 TRP HE1 H 1.175 -3.253 -0.055 1.00 . A A . 5 TRP HE1 1 1 7 1611 1 1 5 TRP HE3 H -0.303 -8.343 -0.752 1.00 . A A . 5 TRP HE3 1 1 7 1612 1 1 5 TRP HH2 H 3.544 -7.096 -2.122 1.00 . A A . 5 TRP HH2 1 1 7 1613 1 1 5 TRP HZ2 H 3.155 -4.800 -1.341 1.00 . A A . 5 TRP HZ2 1 1 7 1614 1 1 5 TRP HZ3 H 1.852 -8.832 -1.834 1.00 . A A . 5 TRP HZ3 1 1 7 1615 1 1 5 TRP N N -3.651 -6.434 -1.341 1.00 . A A . 5 TRP N 1 1 7 1616 1 1 5 TRP NE1 N 0.697 -4.109 -0.072 1.00 . A A . 5 TRP NE1 1 1 7 1617 1 1 5 TRP O O -3.467 -9.489 -0.226 1.00 . A A . 5 TRP O 1 1 7 1618 1 1 6 LYS C C -5.499 -10.168 1.025 1.00 . A A . 6 LYS C 1 1 7 1619 1 1 6 LYS CA C -5.111 -9.025 1.957 1.00 . A A . 6 LYS CA 1 1 7 1620 1 1 6 LYS CB C -6.369 -8.388 2.551 1.00 . A A . 6 LYS CB 1 1 7 1621 1 1 6 LYS CD C -6.442 -5.885 2.351 1.00 . A A . 6 LYS CD 1 1 7 1622 1 1 6 LYS CE C -6.172 -4.847 1.273 1.00 . A A . 6 LYS CE 1 1 7 1623 1 1 6 LYS CG C -6.890 -7.207 1.751 1.00 . A A . 6 LYS CG 1 1 7 1624 1 1 6 LYS H H -4.358 -7.089 1.549 1.00 . A A . 6 LYS H 1 1 7 1625 1 1 6 LYS HA H -4.504 -9.419 2.758 1.00 . A A . 6 LYS HA 1 1 7 1626 1 1 6 LYS HB2 H -7.148 -9.135 2.599 1.00 . A A . 6 LYS HB2 1 1 7 1627 1 1 6 LYS HB3 H -6.147 -8.047 3.552 1.00 . A A . 6 LYS HB3 1 1 7 1628 1 1 6 LYS HD2 H -7.218 -5.515 3.005 1.00 . A A . 6 LYS HD2 1 1 7 1629 1 1 6 LYS HD3 H -5.536 -6.046 2.918 1.00 . A A . 6 LYS HD3 1 1 7 1630 1 1 6 LYS HE2 H -5.133 -4.559 1.321 1.00 . A A . 6 LYS HE2 1 1 7 1631 1 1 6 LYS HE3 H -6.380 -5.286 0.309 1.00 . A A . 6 LYS HE3 1 1 7 1632 1 1 6 LYS HG2 H -6.517 -7.276 0.740 1.00 . A A . 6 LYS HG2 1 1 7 1633 1 1 6 LYS HG3 H -7.971 -7.240 1.740 1.00 . A A . 6 LYS HG3 1 1 7 1634 1 1 6 LYS HZ1 H -7.533 -3.428 0.565 1.00 . A A . 6 LYS HZ1 1 1 7 1635 1 1 6 LYS HZ2 H -6.426 -2.815 1.688 1.00 . A A . 6 LYS HZ2 1 1 7 1636 1 1 6 LYS HZ3 H -7.709 -3.786 2.210 1.00 . A A . 6 LYS HZ3 1 1 7 1637 1 1 6 LYS N N -4.324 -8.022 1.249 1.00 . A A . 6 LYS N 1 1 7 1638 1 1 6 LYS NZ N -7.019 -3.634 1.447 1.00 . A A . 6 LYS NZ 1 1 7 1639 1 1 6 LYS O O -5.195 -11.331 1.294 1.00 . A A . 6 LYS O 1 1 7 1640 1 1 7 ARG C C -5.441 -11.239 -1.949 1.00 . A A . 7 ARG C 1 1 7 1641 1 1 7 ARG CA C -6.599 -10.830 -1.043 1.00 . A A . 7 ARG CA 1 1 7 1642 1 1 7 ARG CB C -7.754 -10.289 -1.887 1.00 . A A . 7 ARG CB 1 1 7 1643 1 1 7 ARG CD C -9.514 -11.896 -1.089 1.00 . A A . 7 ARG CD 1 1 7 1644 1 1 7 ARG CG C -9.114 -10.435 -1.223 1.00 . A A . 7 ARG CG 1 1 7 1645 1 1 7 ARG CZ C -11.940 -11.719 -0.734 1.00 . A A . 7 ARG CZ 1 1 7 1646 1 1 7 ARG H H -6.383 -8.888 -0.231 1.00 . A A . 7 ARG H 1 1 7 1647 1 1 7 ARG HA H -6.938 -11.698 -0.498 1.00 . A A . 7 ARG HA 1 1 7 1648 1 1 7 ARG HB2 H -7.584 -9.240 -2.080 1.00 . A A . 7 ARG HB2 1 1 7 1649 1 1 7 ARG HB3 H -7.777 -10.821 -2.826 1.00 . A A . 7 ARG HB3 1 1 7 1650 1 1 7 ARG HD2 H -8.879 -12.490 -1.729 1.00 . A A . 7 ARG HD2 1 1 7 1651 1 1 7 ARG HD3 H -9.376 -12.201 -0.062 1.00 . A A . 7 ARG HD3 1 1 7 1652 1 1 7 ARG HE H -11.079 -12.589 -2.309 1.00 . A A . 7 ARG HE 1 1 7 1653 1 1 7 ARG HG2 H -9.073 -9.993 -0.238 1.00 . A A . 7 ARG HG2 1 1 7 1654 1 1 7 ARG HG3 H -9.852 -9.922 -1.820 1.00 . A A . 7 ARG HG3 1 1 7 1655 1 1 7 ARG HH11 H -10.806 -10.897 0.721 1.00 . A A . 7 ARG HH11 1 1 7 1656 1 1 7 ARG HH12 H -12.518 -10.779 0.959 1.00 . A A . 7 ARG HH12 1 1 7 1657 1 1 7 ARG HH21 H -13.335 -12.440 -2.007 1.00 . A A . 7 ARG HH21 1 1 7 1658 1 1 7 ARG HH22 H -13.956 -11.658 -0.593 1.00 . A A . 7 ARG HH22 1 1 7 1659 1 1 7 ARG N N -6.170 -9.831 -0.071 1.00 . A A . 7 ARG N 1 1 7 1660 1 1 7 ARG NE N -10.907 -12.119 -1.467 1.00 . A A . 7 ARG NE 1 1 7 1661 1 1 7 ARG NH1 N -11.738 -11.080 0.410 1.00 . A A . 7 ARG NH1 1 1 7 1662 1 1 7 ARG NH2 N -13.179 -11.959 -1.145 1.00 . A A . 7 ARG NH2 1 1 7 1663 1 1 7 ARG O O -4.876 -12.324 -1.802 1.00 . A A . 7 ARG O 1 1 7 1664 1 1 8 LYS C C -2.650 -10.477 -3.129 1.00 . A A . 8 LYS C 1 1 7 1665 1 1 8 LYS CA C -4.002 -10.633 -3.817 1.00 . A A . 8 LYS CA 1 1 7 1666 1 1 8 LYS CB C -4.087 -9.690 -5.019 1.00 . A A . 8 LYS CB 1 1 7 1667 1 1 8 LYS CD C -5.850 -10.228 -6.725 1.00 . A A . 8 LYS CD 1 1 7 1668 1 1 8 LYS CE C -6.696 -11.405 -6.264 1.00 . A A . 8 LYS CE 1 1 7 1669 1 1 8 LYS CG C -4.394 -10.399 -6.327 1.00 . A A . 8 LYS CG 1 1 7 1670 1 1 8 LYS H H -5.581 -9.517 -2.954 1.00 . A A . 8 LYS H 1 1 7 1671 1 1 8 LYS HA H -4.103 -11.651 -4.160 1.00 . A A . 8 LYS HA 1 1 7 1672 1 1 8 LYS HB2 H -4.864 -8.962 -4.837 1.00 . A A . 8 LYS HB2 1 1 7 1673 1 1 8 LYS HB3 H -3.142 -9.177 -5.125 1.00 . A A . 8 LYS HB3 1 1 7 1674 1 1 8 LYS HD2 H -6.234 -9.325 -6.274 1.00 . A A . 8 LYS HD2 1 1 7 1675 1 1 8 LYS HD3 H -5.914 -10.150 -7.801 1.00 . A A . 8 LYS HD3 1 1 7 1676 1 1 8 LYS HE2 H -6.040 -12.201 -5.948 1.00 . A A . 8 LYS HE2 1 1 7 1677 1 1 8 LYS HE3 H -7.305 -11.088 -5.430 1.00 . A A . 8 LYS HE3 1 1 7 1678 1 1 8 LYS HG2 H -3.769 -9.986 -7.105 1.00 . A A . 8 LYS HG2 1 1 7 1679 1 1 8 LYS HG3 H -4.183 -11.452 -6.213 1.00 . A A . 8 LYS HG3 1 1 7 1680 1 1 8 LYS HZ1 H -8.546 -11.535 -7.224 1.00 . A A . 8 LYS HZ1 1 1 7 1681 1 1 8 LYS HZ2 H -7.622 -12.947 -7.325 1.00 . A A . 8 LYS HZ2 1 1 7 1682 1 1 8 LYS HZ3 H -7.222 -11.606 -8.275 1.00 . A A . 8 LYS HZ3 1 1 7 1683 1 1 8 LYS N N -5.093 -10.365 -2.886 1.00 . A A . 8 LYS N 1 1 7 1684 1 1 8 LYS NZ N -7.584 -11.909 -7.348 1.00 . A A . 8 LYS NZ 1 1 7 1685 1 1 8 LYS O O -2.279 -9.380 -2.709 1.00 . A A . 8 LYS O 1 1 7 1686 1 1 9 CYS C C 0.486 -11.951 -3.375 1.00 . A A . 9 CYS C 1 1 7 1687 1 1 9 CYS CA C -0.605 -11.565 -2.382 1.00 . A A . 9 CYS CA 1 1 7 1688 1 1 9 CYS CB C -0.584 -12.519 -1.186 1.00 . A A . 9 CYS CB 1 1 7 1689 1 1 9 CYS H H -2.267 -12.424 -3.372 1.00 . A A . 9 CYS H 1 1 7 1690 1 1 9 CYS HA H -0.418 -10.561 -2.033 1.00 . A A . 9 CYS HA 1 1 7 1691 1 1 9 CYS HB2 H 0.434 -12.633 -0.844 1.00 . A A . 9 CYS HB2 1 1 7 1692 1 1 9 CYS HB3 H -1.180 -12.099 -0.390 1.00 . A A . 9 CYS HB3 1 1 7 1693 1 1 9 CYS HG H -0.509 -14.682 -2.535 1.00 . A A . 9 CYS HG 1 1 7 1694 1 1 9 CYS N N -1.917 -11.580 -3.018 1.00 . A A . 9 CYS N 1 1 7 1695 1 1 9 CYS O O 1.024 -13.058 -3.344 1.00 . A A . 9 CYS O 1 1 7 1696 1 1 9 CYS SG S -1.228 -14.169 -1.548 1.00 . A A . 9 CYS SG 1 1 7 1697 1 1 10 PRO C C 3.250 -11.305 -4.708 1.00 . A A . 10 PRO C 1 1 7 1698 1 1 10 PRO CA C 1.847 -11.240 -5.302 1.00 . A A . 10 PRO CA 1 1 7 1699 1 1 10 PRO CB C 1.709 -10.018 -6.214 1.00 . A A . 10 PRO CB 1 1 7 1700 1 1 10 PRO CD C 0.218 -9.678 -4.376 1.00 . A A . 10 PRO CD 1 1 7 1701 1 1 10 PRO CG C 1.118 -8.962 -5.345 1.00 . A A . 10 PRO CG 1 1 7 1702 1 1 10 PRO HA H 1.656 -12.138 -5.870 1.00 . A A . 10 PRO HA 1 1 7 1703 1 1 10 PRO HB2 H 2.683 -9.728 -6.582 1.00 . A A . 10 PRO HB2 1 1 7 1704 1 1 10 PRO HB3 H 1.060 -10.255 -7.044 1.00 . A A . 10 PRO HB3 1 1 7 1705 1 1 10 PRO HD2 H 0.226 -9.183 -3.417 1.00 . A A . 10 PRO HD2 1 1 7 1706 1 1 10 PRO HD3 H -0.788 -9.734 -4.766 1.00 . A A . 10 PRO HD3 1 1 7 1707 1 1 10 PRO HG2 H 1.901 -8.441 -4.815 1.00 . A A . 10 PRO HG2 1 1 7 1708 1 1 10 PRO HG3 H 0.545 -8.271 -5.946 1.00 . A A . 10 PRO HG3 1 1 7 1709 1 1 10 PRO N N 0.819 -11.019 -4.281 1.00 . A A . 10 PRO N 1 1 7 1710 1 1 10 PRO O O 4.069 -12.131 -5.112 1.00 . A A . 10 PRO O 1 1 7 1711 1 1 11 LEU C C 4.695 -10.640 -1.596 1.00 . A A . 11 LEU C 1 1 7 1712 1 1 11 LEU CA C 4.826 -10.388 -3.095 1.00 . A A . 11 LEU CA 1 1 7 1713 1 1 11 LEU CB C 5.497 -9.035 -3.339 1.00 . A A . 11 LEU CB 1 1 7 1714 1 1 11 LEU CD1 C 5.264 -6.632 -4.011 1.00 . A A . 11 LEU CD1 1 1 7 1715 1 1 11 LEU CD2 C 4.718 -8.443 -5.647 1.00 . A A . 11 LEU CD2 1 1 7 1716 1 1 11 LEU CG C 4.704 -8.035 -4.181 1.00 . A A . 11 LEU CG 1 1 7 1717 1 1 11 LEU H H 2.828 -9.796 -3.466 1.00 . A A . 11 LEU H 1 1 7 1718 1 1 11 LEU HA H 5.436 -11.167 -3.527 1.00 . A A . 11 LEU HA 1 1 7 1719 1 1 11 LEU HB2 H 5.685 -8.582 -2.378 1.00 . A A . 11 LEU HB2 1 1 7 1720 1 1 11 LEU HB3 H 6.437 -9.219 -3.840 1.00 . A A . 11 LEU HB3 1 1 7 1721 1 1 11 LEU HD11 H 6.271 -6.690 -3.626 1.00 . A A . 11 LEU HD11 1 1 7 1722 1 1 11 LEU HD12 H 4.646 -6.078 -3.320 1.00 . A A . 11 LEU HD12 1 1 7 1723 1 1 11 LEU HD13 H 5.273 -6.129 -4.968 1.00 . A A . 11 LEU HD13 1 1 7 1724 1 1 11 LEU HD21 H 4.819 -9.516 -5.721 1.00 . A A . 11 LEU HD21 1 1 7 1725 1 1 11 LEU HD22 H 5.550 -7.968 -6.145 1.00 . A A . 11 LEU HD22 1 1 7 1726 1 1 11 LEU HD23 H 3.794 -8.136 -6.115 1.00 . A A . 11 LEU HD23 1 1 7 1727 1 1 11 LEU HG H 3.676 -8.026 -3.845 1.00 . A A . 11 LEU HG 1 1 7 1728 1 1 11 LEU N N 3.521 -10.430 -3.746 1.00 . A A . 11 LEU N 1 1 7 1729 1 1 11 LEU O O 4.968 -11.740 -1.115 1.00 . A A . 11 LEU O 1 1 7 1730 1 1 12 PHE C C 2.672 -9.392 0.988 1.00 . A A . 12 PHE C 1 1 7 1731 1 1 12 PHE CA C 4.104 -9.726 0.581 1.00 . A A . 12 PHE CA 1 1 7 1732 1 1 12 PHE CB C 5.082 -8.796 1.303 1.00 . A A . 12 PHE CB 1 1 7 1733 1 1 12 PHE CD1 C 5.090 -6.568 0.149 1.00 . A A . 12 PHE CD1 1 1 7 1734 1 1 12 PHE CD2 C 6.942 -8.029 -0.197 1.00 . A A . 12 PHE CD2 1 1 7 1735 1 1 12 PHE CE1 C 5.672 -5.628 -0.681 1.00 . A A . 12 PHE CE1 1 1 7 1736 1 1 12 PHE CE2 C 7.529 -7.093 -1.027 1.00 . A A . 12 PHE CE2 1 1 7 1737 1 1 12 PHE CG C 5.717 -7.777 0.400 1.00 . A A . 12 PHE CG 1 1 7 1738 1 1 12 PHE CZ C 6.893 -5.892 -1.270 1.00 . A A . 12 PHE CZ 1 1 7 1739 1 1 12 PHE H H 4.071 -8.763 -1.305 1.00 . A A . 12 PHE H 1 1 7 1740 1 1 12 PHE HA H 4.317 -10.746 0.861 1.00 . A A . 12 PHE HA 1 1 7 1741 1 1 12 PHE HB2 H 4.554 -8.266 2.081 1.00 . A A . 12 PHE HB2 1 1 7 1742 1 1 12 PHE HB3 H 5.869 -9.387 1.745 1.00 . A A . 12 PHE HB3 1 1 7 1743 1 1 12 PHE HD1 H 4.134 -6.361 0.609 1.00 . A A . 12 PHE HD1 1 1 7 1744 1 1 12 PHE HD2 H 7.440 -8.969 -0.008 1.00 . A A . 12 PHE HD2 1 1 7 1745 1 1 12 PHE HE1 H 5.171 -4.690 -0.869 1.00 . A A . 12 PHE HE1 1 1 7 1746 1 1 12 PHE HE2 H 8.484 -7.302 -1.486 1.00 . A A . 12 PHE HE2 1 1 7 1747 1 1 12 PHE HZ H 7.350 -5.159 -1.918 1.00 . A A . 12 PHE HZ 1 1 7 1748 1 1 12 PHE N N 4.273 -9.615 -0.863 1.00 . A A . 12 PHE N 1 1 7 1749 1 1 12 PHE O O 2.351 -8.242 1.284 1.00 . A A . 12 PHE O 1 1 7 1750 1 1 13 GLY C C 0.220 -10.218 2.873 1.00 . A A . 13 GLY C 1 1 7 1751 1 1 13 GLY CA C 0.427 -10.203 1.371 1.00 . A A . 13 GLY CA 1 1 7 1752 1 1 13 GLY H H 2.127 -11.304 0.755 1.00 . A A . 13 GLY H 1 1 7 1753 1 1 13 GLY HA2 H 0.098 -9.251 0.982 1.00 . A A . 13 GLY HA2 1 1 7 1754 1 1 13 GLY HA3 H -0.172 -10.987 0.930 1.00 . A A . 13 GLY HA3 1 1 7 1755 1 1 13 GLY N N 1.814 -10.408 1.000 1.00 . A A . 13 GLY N 1 1 7 1756 1 1 13 GLY O O -0.837 -9.823 3.366 1.00 . A A . 13 GLY O 1 1 7 1757 1 1 14 LYS C C 1.309 -9.354 5.674 1.00 . A A . 14 LYS C 1 1 7 1758 1 1 14 LYS CA C 1.157 -10.741 5.058 1.00 . A A . 14 LYS CA 1 1 7 1759 1 1 14 LYS CB C 2.240 -11.675 5.603 1.00 . A A . 14 LYS CB 1 1 7 1760 1 1 14 LYS CD C 3.694 -13.034 4.071 1.00 . A A . 14 LYS CD 1 1 7 1761 1 1 14 LYS CE C 4.871 -13.191 5.022 1.00 . A A . 14 LYS CE 1 1 7 1762 1 1 14 LYS CG C 2.375 -12.971 4.823 1.00 . A A . 14 LYS CG 1 1 7 1763 1 1 14 LYS H H 2.049 -10.976 3.152 1.00 . A A . 14 LYS H 1 1 7 1764 1 1 14 LYS HA H 0.188 -11.135 5.323 1.00 . A A . 14 LYS HA 1 1 7 1765 1 1 14 LYS HB2 H 3.190 -11.160 5.574 1.00 . A A . 14 LYS HB2 1 1 7 1766 1 1 14 LYS HB3 H 2.005 -11.919 6.629 1.00 . A A . 14 LYS HB3 1 1 7 1767 1 1 14 LYS HD2 H 3.675 -13.879 3.398 1.00 . A A . 14 LYS HD2 1 1 7 1768 1 1 14 LYS HD3 H 3.820 -12.123 3.504 1.00 . A A . 14 LYS HD3 1 1 7 1769 1 1 14 LYS HE2 H 5.619 -12.453 4.773 1.00 . A A . 14 LYS HE2 1 1 7 1770 1 1 14 LYS HE3 H 4.525 -13.026 6.032 1.00 . A A . 14 LYS HE3 1 1 7 1771 1 1 14 LYS HG2 H 2.325 -13.802 5.511 1.00 . A A . 14 LYS HG2 1 1 7 1772 1 1 14 LYS HG3 H 1.563 -13.039 4.113 1.00 . A A . 14 LYS HG3 1 1 7 1773 1 1 14 LYS HZ1 H 5.629 -14.806 3.937 1.00 . A A . 14 LYS HZ1 1 1 7 1774 1 1 14 LYS HZ2 H 4.851 -15.250 5.372 1.00 . A A . 14 LYS HZ2 1 1 7 1775 1 1 14 LYS HZ3 H 6.395 -14.561 5.425 1.00 . A A . 14 LYS HZ3 1 1 7 1776 1 1 14 LYS N N 1.231 -10.676 3.603 1.00 . A A . 14 LYS N 1 1 7 1777 1 1 14 LYS NZ N 5.480 -14.547 4.933 1.00 . A A . 14 LYS NZ 1 1 7 1778 1 1 14 LYS O O 0.478 -8.924 6.471 1.00 . A A . 14 LYS O 1 1 7 1779 1 1 15 GLY C C 2.202 -6.238 4.851 1.00 . A A . 15 GLY C 1 1 7 1780 1 1 15 GLY CA C 2.618 -7.326 5.821 1.00 . A A . 15 GLY CA 1 1 7 1781 1 1 15 GLY H H 3.008 -9.052 4.657 1.00 . A A . 15 GLY H 1 1 7 1782 1 1 15 GLY HA2 H 2.064 -7.207 6.740 1.00 . A A . 15 GLY HA2 1 1 7 1783 1 1 15 GLY HA3 H 3.672 -7.220 6.032 1.00 . A A . 15 GLY HA3 1 1 7 1784 1 1 15 GLY N N 2.378 -8.658 5.297 1.00 . A A . 15 GLY N 1 1 7 1785 1 1 15 GLY O O 2.822 -5.177 4.794 1.00 . A A . 15 GLY O 1 1 7 1786 1 1 16 GLY C C 0.459 -4.158 3.738 1.00 . A A . 16 GLY C 1 1 7 1787 1 1 16 GLY CA C 0.669 -5.527 3.122 1.00 . A A . 16 GLY CA 1 1 7 1788 1 1 16 GLY H H 0.692 -7.365 4.174 1.00 . A A . 16 GLY H 1 1 7 1789 1 1 16 GLY HA2 H 1.389 -5.444 2.322 1.00 . A A . 16 GLY HA2 1 1 7 1790 1 1 16 GLY HA3 H -0.270 -5.873 2.714 1.00 . A A . 16 GLY HA3 1 1 7 1791 1 1 16 GLY N N 1.148 -6.502 4.085 1.00 . A A . 16 GLY N 1 1 7 1792 1 1 16 GLY O O 0.106 -4.046 4.912 1.00 . A A . 16 GLY O 1 1 8 1793 1 1 1 VAL C C 1.819 -0.671 -2.620 1.00 . A A . 1 VAL C 1 1 8 1794 1 1 1 VAL CA C 2.717 -0.081 -1.538 1.00 . A A . 1 VAL CA 1 1 8 1795 1 1 1 VAL CB C 3.224 -1.218 -0.631 1.00 . A A . 1 VAL CB 1 1 8 1796 1 1 1 VAL CG1 C 3.658 -2.414 -1.466 1.00 . A A . 1 VAL CG1 1 1 8 1797 1 1 1 VAL CG2 C 4.365 -0.729 0.248 1.00 . A A . 1 VAL CG2 1 1 8 1798 1 1 1 VAL H1 H 1.487 1.616 -1.242 1.00 . A A . 1 VAL H1 1 1 8 1799 1 1 1 VAL HA H 3.571 0.385 -2.007 1.00 . A A . 1 VAL HA 1 1 8 1800 1 1 1 VAL HB H 2.412 -1.530 0.010 1.00 . A A . 1 VAL HB 1 1 8 1801 1 1 1 VAL HG11 H 4.140 -2.067 -2.368 1.00 . A A . 1 VAL HG11 1 1 8 1802 1 1 1 VAL HG12 H 4.348 -3.019 -0.897 1.00 . A A . 1 VAL HG12 1 1 8 1803 1 1 1 VAL HG13 H 2.791 -3.004 -1.726 1.00 . A A . 1 VAL HG13 1 1 8 1804 1 1 1 VAL HG21 H 4.718 -1.543 0.864 1.00 . A A . 1 VAL HG21 1 1 8 1805 1 1 1 VAL HG22 H 5.173 -0.373 -0.375 1.00 . A A . 1 VAL HG22 1 1 8 1806 1 1 1 VAL HG23 H 4.016 0.075 0.878 1.00 . A A . 1 VAL HG23 1 1 8 1807 1 1 1 VAL N N 2.013 0.937 -0.768 1.00 . A A . 1 VAL N 1 1 8 1808 1 1 1 VAL O O 1.938 -0.326 -3.795 1.00 . A A . 1 VAL O 1 1 8 1809 1 1 2 ALA C C -1.448 -2.001 -2.714 1.00 . A A . 2 ALA C 1 1 8 1810 1 1 2 ALA CA C 0.000 -2.198 -3.149 1.00 . A A . 2 ALA CA 1 1 8 1811 1 1 2 ALA CB C 0.317 -3.681 -3.275 1.00 . A A . 2 ALA CB 1 1 8 1812 1 1 2 ALA H H 0.874 -1.796 -1.264 1.00 . A A . 2 ALA H 1 1 8 1813 1 1 2 ALA HA H 0.140 -1.741 -4.118 1.00 . A A . 2 ALA HA 1 1 8 1814 1 1 2 ALA HB1 H -0.290 -4.239 -2.577 1.00 . A A . 2 ALA HB1 1 1 8 1815 1 1 2 ALA HB2 H 0.104 -4.010 -4.281 1.00 . A A . 2 ALA HB2 1 1 8 1816 1 1 2 ALA HB3 H 1.362 -3.845 -3.056 1.00 . A A . 2 ALA HB3 1 1 8 1817 1 1 2 ALA N N 0.920 -1.562 -2.214 1.00 . A A . 2 ALA N 1 1 8 1818 1 1 2 ALA O O -1.838 -2.404 -1.618 1.00 . A A . 2 ALA O 1 1 8 1819 1 1 3 ARG C C -4.347 -2.404 -2.837 1.00 . A A . 3 ARG C 1 1 8 1820 1 1 3 ARG CA C -3.646 -1.124 -3.282 1.00 . A A . 3 ARG CA 1 1 8 1821 1 1 3 ARG CB C -4.352 -0.544 -4.509 1.00 . A A . 3 ARG CB 1 1 8 1822 1 1 3 ARG CD C -3.407 -2.021 -6.310 1.00 . A A . 3 ARG CD 1 1 8 1823 1 1 3 ARG CG C -4.665 -1.579 -5.578 1.00 . A A . 3 ARG CG 1 1 8 1824 1 1 3 ARG CZ C -2.827 -3.639 -8.068 1.00 . A A . 3 ARG CZ 1 1 8 1825 1 1 3 ARG H H -1.873 -1.079 -4.436 1.00 . A A . 3 ARG H 1 1 8 1826 1 1 3 ARG HA H -3.691 -0.405 -2.478 1.00 . A A . 3 ARG HA 1 1 8 1827 1 1 3 ARG HB2 H -5.281 -0.091 -4.195 1.00 . A A . 3 ARG HB2 1 1 8 1828 1 1 3 ARG HB3 H -3.721 0.215 -4.947 1.00 . A A . 3 ARG HB3 1 1 8 1829 1 1 3 ARG HD2 H -2.869 -1.143 -6.635 1.00 . A A . 3 ARG HD2 1 1 8 1830 1 1 3 ARG HD3 H -2.791 -2.589 -5.629 1.00 . A A . 3 ARG HD3 1 1 8 1831 1 1 3 ARG HE H -4.626 -2.810 -7.830 1.00 . A A . 3 ARG HE 1 1 8 1832 1 1 3 ARG HG2 H -5.117 -2.441 -5.110 1.00 . A A . 3 ARG HG2 1 1 8 1833 1 1 3 ARG HG3 H -5.354 -1.150 -6.290 1.00 . A A . 3 ARG HG3 1 1 8 1834 1 1 3 ARG HH11 H -1.316 -3.168 -6.813 1.00 . A A . 3 ARG HH11 1 1 8 1835 1 1 3 ARG HH12 H -0.920 -4.308 -8.057 1.00 . A A . 3 ARG HH12 1 1 8 1836 1 1 3 ARG HH21 H -4.117 -4.309 -9.472 1.00 . A A . 3 ARG HH21 1 1 8 1837 1 1 3 ARG HH22 H -2.514 -4.955 -9.569 1.00 . A A . 3 ARG HH22 1 1 8 1838 1 1 3 ARG N N -2.241 -1.377 -3.579 1.00 . A A . 3 ARG N 1 1 8 1839 1 1 3 ARG NE N -3.714 -2.847 -7.474 1.00 . A A . 3 ARG NE 1 1 8 1840 1 1 3 ARG NH1 N -1.586 -3.710 -7.609 1.00 . A A . 3 ARG NH1 1 1 8 1841 1 1 3 ARG NH2 N -3.182 -4.360 -9.123 1.00 . A A . 3 ARG NH2 1 1 8 1842 1 1 3 ARG O O -5.295 -2.365 -2.054 1.00 . A A . 3 ARG O 1 1 8 1843 1 1 4 GLY C C -3.493 -5.724 -2.262 1.00 . A A . 4 GLY C 1 1 8 1844 1 1 4 GLY CA C -4.465 -4.815 -2.986 1.00 . A A . 4 GLY CA 1 1 8 1845 1 1 4 GLY H H -3.114 -3.510 -3.962 1.00 . A A . 4 GLY H 1 1 8 1846 1 1 4 GLY HA2 H -5.319 -4.638 -2.349 1.00 . A A . 4 GLY HA2 1 1 8 1847 1 1 4 GLY HA3 H -4.798 -5.309 -3.888 1.00 . A A . 4 GLY HA3 1 1 8 1848 1 1 4 GLY N N -3.872 -3.539 -3.342 1.00 . A A . 4 GLY N 1 1 8 1849 1 1 4 GLY O O -2.603 -6.310 -2.879 1.00 . A A . 4 GLY O 1 1 8 1850 1 1 5 TRP C C -3.594 -7.741 0.609 1.00 . A A . 5 TRP C 1 1 8 1851 1 1 5 TRP CA C -2.788 -6.685 -0.140 1.00 . A A . 5 TRP CA 1 1 8 1852 1 1 5 TRP CB C -1.996 -5.831 0.852 1.00 . A A . 5 TRP CB 1 1 8 1853 1 1 5 TRP CD1 C -0.200 -4.057 0.415 1.00 . A A . 5 TRP CD1 1 1 8 1854 1 1 5 TRP CD2 C 0.254 -6.064 -0.470 1.00 . A A . 5 TRP CD2 1 1 8 1855 1 1 5 TRP CE2 C 1.312 -5.187 -0.780 1.00 . A A . 5 TRP CE2 1 1 8 1856 1 1 5 TRP CE3 C 0.320 -7.385 -0.921 1.00 . A A . 5 TRP CE3 1 1 8 1857 1 1 5 TRP CG C -0.702 -5.321 0.295 1.00 . A A . 5 TRP CG 1 1 8 1858 1 1 5 TRP CH2 C 2.458 -6.888 -1.950 1.00 . A A . 5 TRP CH2 1 1 8 1859 1 1 5 TRP CZ2 C 2.419 -5.589 -1.521 1.00 . A A . 5 TRP CZ2 1 1 8 1860 1 1 5 TRP CZ3 C 1.420 -7.783 -1.657 1.00 . A A . 5 TRP CZ3 1 1 8 1861 1 1 5 TRP H H -4.388 -5.349 -0.514 1.00 . A A . 5 TRP H 1 1 8 1862 1 1 5 TRP HA H -2.098 -7.181 -0.806 1.00 . A A . 5 TRP HA 1 1 8 1863 1 1 5 TRP HB2 H -2.593 -4.980 1.141 1.00 . A A . 5 TRP HB2 1 1 8 1864 1 1 5 TRP HB3 H -1.773 -6.424 1.727 1.00 . A A . 5 TRP HB3 1 1 8 1865 1 1 5 TRP HD1 H -0.694 -3.254 0.940 1.00 . A A . 5 TRP HD1 1 1 8 1866 1 1 5 TRP HE1 H 1.568 -3.164 -0.285 1.00 . A A . 5 TRP HE1 1 1 8 1867 1 1 5 TRP HE3 H -0.469 -8.089 -0.705 1.00 . A A . 5 TRP HE3 1 1 8 1868 1 1 5 TRP HH2 H 3.298 -7.243 -2.528 1.00 . A A . 5 TRP HH2 1 1 8 1869 1 1 5 TRP HZ2 H 3.228 -4.912 -1.755 1.00 . A A . 5 TRP HZ2 1 1 8 1870 1 1 5 TRP HZ3 H 1.489 -8.800 -2.014 1.00 . A A . 5 TRP HZ3 1 1 8 1871 1 1 5 TRP N N -3.660 -5.842 -0.950 1.00 . A A . 5 TRP N 1 1 8 1872 1 1 5 TRP NE1 N 1.011 -3.969 -0.230 1.00 . A A . 5 TRP NE1 1 1 8 1873 1 1 5 TRP O O -3.666 -8.896 0.188 1.00 . A A . 5 TRP O 1 1 8 1874 1 1 6 LYS C C -5.624 -9.340 1.662 1.00 . A A . 6 LYS C 1 1 8 1875 1 1 6 LYS CA C -5.003 -8.249 2.528 1.00 . A A . 6 LYS CA 1 1 8 1876 1 1 6 LYS CB C -6.102 -7.478 3.262 1.00 . A A . 6 LYS CB 1 1 8 1877 1 1 6 LYS CD C -7.734 -5.568 3.238 1.00 . A A . 6 LYS CD 1 1 8 1878 1 1 6 LYS CE C -9.043 -6.290 2.956 1.00 . A A . 6 LYS CE 1 1 8 1879 1 1 6 LYS CG C -6.567 -6.233 2.527 1.00 . A A . 6 LYS CG 1 1 8 1880 1 1 6 LYS H H -4.106 -6.404 2.005 1.00 . A A . 6 LYS H 1 1 8 1881 1 1 6 LYS HA H -4.351 -8.710 3.255 1.00 . A A . 6 LYS HA 1 1 8 1882 1 1 6 LYS HB2 H -6.953 -8.130 3.398 1.00 . A A . 6 LYS HB2 1 1 8 1883 1 1 6 LYS HB3 H -5.730 -7.180 4.232 1.00 . A A . 6 LYS HB3 1 1 8 1884 1 1 6 LYS HD2 H -7.551 -5.582 4.302 1.00 . A A . 6 LYS HD2 1 1 8 1885 1 1 6 LYS HD3 H -7.816 -4.546 2.898 1.00 . A A . 6 LYS HD3 1 1 8 1886 1 1 6 LYS HE2 H -9.082 -6.539 1.907 1.00 . A A . 6 LYS HE2 1 1 8 1887 1 1 6 LYS HE3 H -9.073 -7.196 3.543 1.00 . A A . 6 LYS HE3 1 1 8 1888 1 1 6 LYS HG2 H -5.748 -5.532 2.470 1.00 . A A . 6 LYS HG2 1 1 8 1889 1 1 6 LYS HG3 H -6.876 -6.510 1.529 1.00 . A A . 6 LYS HG3 1 1 8 1890 1 1 6 LYS HZ1 H -9.937 -4.456 3.406 1.00 . A A . 6 LYS HZ1 1 1 8 1891 1 1 6 LYS HZ2 H -10.646 -5.775 4.193 1.00 . A A . 6 LYS HZ2 1 1 8 1892 1 1 6 LYS HZ3 H -10.939 -5.515 2.547 1.00 . A A . 6 LYS HZ3 1 1 8 1893 1 1 6 LYS N N -4.200 -7.338 1.721 1.00 . A A . 6 LYS N 1 1 8 1894 1 1 6 LYS NZ N -10.224 -5.450 3.299 1.00 . A A . 6 LYS NZ 1 1 8 1895 1 1 6 LYS O O -5.471 -10.529 1.942 1.00 . A A . 6 LYS O 1 1 8 1896 1 1 7 ARG C C -5.970 -10.410 -1.318 1.00 . A A . 7 ARG C 1 1 8 1897 1 1 7 ARG CA C -6.967 -9.871 -0.297 1.00 . A A . 7 ARG CA 1 1 8 1898 1 1 7 ARG CB C -8.138 -9.201 -1.016 1.00 . A A . 7 ARG CB 1 1 8 1899 1 1 7 ARG CD C -9.487 -11.309 -1.244 1.00 . A A . 7 ARG CD 1 1 8 1900 1 1 7 ARG CG C -8.874 -10.124 -1.973 1.00 . A A . 7 ARG CG 1 1 8 1901 1 1 7 ARG CZ C -9.552 -13.088 -2.940 1.00 . A A . 7 ARG CZ 1 1 8 1902 1 1 7 ARG H H -6.409 -7.967 0.440 1.00 . A A . 7 ARG H 1 1 8 1903 1 1 7 ARG HA H -7.341 -10.695 0.293 1.00 . A A . 7 ARG HA 1 1 8 1904 1 1 7 ARG HB2 H -8.844 -8.847 -0.279 1.00 . A A . 7 ARG HB2 1 1 8 1905 1 1 7 ARG HB3 H -7.765 -8.358 -1.579 1.00 . A A . 7 ARG HB3 1 1 8 1906 1 1 7 ARG HD2 H -9.187 -11.271 -0.207 1.00 . A A . 7 ARG HD2 1 1 8 1907 1 1 7 ARG HD3 H -10.562 -11.238 -1.310 1.00 . A A . 7 ARG HD3 1 1 8 1908 1 1 7 ARG HE H -8.371 -13.089 -1.333 1.00 . A A . 7 ARG HE 1 1 8 1909 1 1 7 ARG HG2 H -9.662 -9.569 -2.461 1.00 . A A . 7 ARG HG2 1 1 8 1910 1 1 7 ARG HG3 H -8.177 -10.489 -2.713 1.00 . A A . 7 ARG HG3 1 1 8 1911 1 1 7 ARG HH11 H -10.817 -11.548 -3.273 1.00 . A A . 7 ARG HH11 1 1 8 1912 1 1 7 ARG HH12 H -10.853 -12.808 -4.461 1.00 . A A . 7 ARG HH12 1 1 8 1913 1 1 7 ARG HH21 H -8.409 -14.754 -2.891 1.00 . A A . 7 ARG HH21 1 1 8 1914 1 1 7 ARG HH22 H -9.484 -14.632 -4.242 1.00 . A A . 7 ARG HH22 1 1 8 1915 1 1 7 ARG N N -6.323 -8.928 0.610 1.00 . A A . 7 ARG N 1 1 8 1916 1 1 7 ARG NE N -9.059 -12.584 -1.814 1.00 . A A . 7 ARG NE 1 1 8 1917 1 1 7 ARG NH1 N -10.484 -12.427 -3.613 1.00 . A A . 7 ARG NH1 1 1 8 1918 1 1 7 ARG NH2 N -9.112 -14.254 -3.395 1.00 . A A . 7 ARG NH2 1 1 8 1919 1 1 7 ARG O O -5.528 -11.556 -1.226 1.00 . A A . 7 ARG O 1 1 8 1920 1 1 8 LYS C C -3.244 -9.957 -2.798 1.00 . A A . 8 LYS C 1 1 8 1921 1 1 8 LYS CA C -4.674 -9.968 -3.331 1.00 . A A . 8 LYS CA 1 1 8 1922 1 1 8 LYS CB C -4.788 -9.027 -4.533 1.00 . A A . 8 LYS CB 1 1 8 1923 1 1 8 LYS CD C -6.073 -10.027 -6.445 1.00 . A A . 8 LYS CD 1 1 8 1924 1 1 8 LYS CE C -7.101 -11.143 -6.342 1.00 . A A . 8 LYS CE 1 1 8 1925 1 1 8 LYS CG C -6.130 -9.104 -5.240 1.00 . A A . 8 LYS CG 1 1 8 1926 1 1 8 LYS H H -6.005 -8.675 -2.311 1.00 . A A . 8 LYS H 1 1 8 1927 1 1 8 LYS HA H -4.921 -10.970 -3.644 1.00 . A A . 8 LYS HA 1 1 8 1928 1 1 8 LYS HB2 H -4.639 -8.012 -4.196 1.00 . A A . 8 LYS HB2 1 1 8 1929 1 1 8 LYS HB3 H -4.015 -9.278 -5.245 1.00 . A A . 8 LYS HB3 1 1 8 1930 1 1 8 LYS HD2 H -6.272 -9.452 -7.338 1.00 . A A . 8 LYS HD2 1 1 8 1931 1 1 8 LYS HD3 H -5.086 -10.463 -6.508 1.00 . A A . 8 LYS HD3 1 1 8 1932 1 1 8 LYS HE2 H -6.747 -11.876 -5.633 1.00 . A A . 8 LYS HE2 1 1 8 1933 1 1 8 LYS HE3 H -8.033 -10.725 -5.992 1.00 . A A . 8 LYS HE3 1 1 8 1934 1 1 8 LYS HG2 H -6.870 -9.478 -4.548 1.00 . A A . 8 LYS HG2 1 1 8 1935 1 1 8 LYS HG3 H -6.410 -8.113 -5.569 1.00 . A A . 8 LYS HG3 1 1 8 1936 1 1 8 LYS HZ1 H -7.151 -11.141 -8.430 1.00 . A A . 8 LYS HZ1 1 1 8 1937 1 1 8 LYS HZ2 H -8.313 -12.142 -7.719 1.00 . A A . 8 LYS HZ2 1 1 8 1938 1 1 8 LYS HZ3 H -6.692 -12.624 -7.757 1.00 . A A . 8 LYS HZ3 1 1 8 1939 1 1 8 LYS N N -5.619 -9.577 -2.292 1.00 . A A . 8 LYS N 1 1 8 1940 1 1 8 LYS NZ N -7.330 -11.810 -7.654 1.00 . A A . 8 LYS NZ 1 1 8 1941 1 1 8 LYS O O -2.703 -8.902 -2.467 1.00 . A A . 8 LYS O 1 1 8 1942 1 1 9 CYS C C -0.345 -11.777 -3.323 1.00 . A A . 9 CYS C 1 1 8 1943 1 1 9 CYS CA C -1.272 -11.263 -2.226 1.00 . A A . 9 CYS CA 1 1 8 1944 1 1 9 CYS CB C -1.227 -12.204 -1.021 1.00 . A A . 9 CYS CB 1 1 8 1945 1 1 9 CYS H H -3.123 -11.943 -2.996 1.00 . A A . 9 CYS H 1 1 8 1946 1 1 9 CYS HA H -0.939 -10.283 -1.919 1.00 . A A . 9 CYS HA 1 1 8 1947 1 1 9 CYS HB2 H -0.196 -12.422 -0.783 1.00 . A A . 9 CYS HB2 1 1 8 1948 1 1 9 CYS HB3 H -1.689 -11.717 -0.176 1.00 . A A . 9 CYS HB3 1 1 8 1949 1 1 9 CYS HG H -3.378 -13.546 -1.291 1.00 . A A . 9 CYS HG 1 1 8 1950 1 1 9 CYS N N -2.639 -11.137 -2.718 1.00 . A A . 9 CYS N 1 1 8 1951 1 1 9 CYS O O 0.079 -12.933 -3.321 1.00 . A A . 9 CYS O 1 1 8 1952 1 1 9 CYS SG S -2.074 -13.780 -1.282 1.00 . A A . 9 CYS SG 1 1 8 1953 1 1 10 PRO C C 2.304 -11.442 -4.967 1.00 . A A . 10 PRO C 1 1 8 1954 1 1 10 PRO CA C 0.858 -11.240 -5.405 1.00 . A A . 10 PRO CA 1 1 8 1955 1 1 10 PRO CB C 0.743 -10.025 -6.329 1.00 . A A . 10 PRO CB 1 1 8 1956 1 1 10 PRO CD C -0.490 -9.504 -4.349 1.00 . A A . 10 PRO CD 1 1 8 1957 1 1 10 PRO CG C 0.363 -8.900 -5.430 1.00 . A A . 10 PRO CG 1 1 8 1958 1 1 10 PRO HA H 0.514 -12.123 -5.924 1.00 . A A . 10 PRO HA 1 1 8 1959 1 1 10 PRO HB2 H 1.694 -9.844 -6.810 1.00 . A A . 10 PRO HB2 1 1 8 1960 1 1 10 PRO HB3 H -0.015 -10.207 -7.076 1.00 . A A . 10 PRO HB3 1 1 8 1961 1 1 10 PRO HD2 H -0.324 -8.997 -3.410 1.00 . A A . 10 PRO HD2 1 1 8 1962 1 1 10 PRO HD3 H -1.534 -9.461 -4.624 1.00 . A A . 10 PRO HD3 1 1 8 1963 1 1 10 PRO HG2 H 1.249 -8.455 -5.004 1.00 . A A . 10 PRO HG2 1 1 8 1964 1 1 10 PRO HG3 H -0.200 -8.163 -5.983 1.00 . A A . 10 PRO HG3 1 1 8 1965 1 1 10 PRO N N -0.022 -10.898 -4.284 1.00 . A A . 10 PRO N 1 1 8 1966 1 1 10 PRO O O 2.985 -12.354 -5.438 1.00 . A A . 10 PRO O 1 1 8 1967 1 1 11 LEU C C 4.148 -10.885 -2.051 1.00 . A A . 11 LEU C 1 1 8 1968 1 1 11 LEU CA C 4.135 -10.670 -3.561 1.00 . A A . 11 LEU CA 1 1 8 1969 1 1 11 LEU CB C 4.909 -9.398 -3.913 1.00 . A A . 11 LEU CB 1 1 8 1970 1 1 11 LEU CD1 C 4.843 -6.988 -4.598 1.00 . A A . 11 LEU CD1 1 1 8 1971 1 1 11 LEU CD2 C 3.929 -8.744 -6.126 1.00 . A A . 11 LEU CD2 1 1 8 1972 1 1 11 LEU CG C 4.128 -8.328 -4.676 1.00 . A A . 11 LEU CG 1 1 8 1973 1 1 11 LEU H H 2.179 -9.880 -3.725 1.00 . A A . 11 LEU H 1 1 8 1974 1 1 11 LEU HA H 4.611 -11.515 -4.036 1.00 . A A . 11 LEU HA 1 1 8 1975 1 1 11 LEU HB2 H 5.259 -8.958 -2.992 1.00 . A A . 11 LEU HB2 1 1 8 1976 1 1 11 LEU HB3 H 5.757 -9.685 -4.518 1.00 . A A . 11 LEU HB3 1 1 8 1977 1 1 11 LEU HD11 H 4.802 -6.502 -5.561 1.00 . A A . 11 LEU HD11 1 1 8 1978 1 1 11 LEU HD12 H 5.874 -7.146 -4.318 1.00 . A A . 11 LEU HD12 1 1 8 1979 1 1 11 LEU HD13 H 4.361 -6.365 -3.859 1.00 . A A . 11 LEU HD13 1 1 8 1980 1 1 11 LEU HD21 H 3.924 -9.822 -6.193 1.00 . A A . 11 LEU HD21 1 1 8 1981 1 1 11 LEU HD22 H 4.735 -8.351 -6.728 1.00 . A A . 11 LEU HD22 1 1 8 1982 1 1 11 LEU HD23 H 2.988 -8.356 -6.486 1.00 . A A . 11 LEU HD23 1 1 8 1983 1 1 11 LEU HG H 3.152 -8.212 -4.224 1.00 . A A . 11 LEU HG 1 1 8 1984 1 1 11 LEU N N 2.768 -10.586 -4.063 1.00 . A A . 11 LEU N 1 1 8 1985 1 1 11 LEU O O 4.355 -12.000 -1.573 1.00 . A A . 11 LEU O 1 1 8 1986 1 1 12 PHE C C 2.574 -9.383 0.707 1.00 . A A . 12 PHE C 1 1 8 1987 1 1 12 PHE CA C 3.906 -9.879 0.153 1.00 . A A . 12 PHE CA 1 1 8 1988 1 1 12 PHE CB C 5.054 -9.053 0.737 1.00 . A A . 12 PHE CB 1 1 8 1989 1 1 12 PHE CD1 C 5.134 -6.838 -0.439 1.00 . A A . 12 PHE CD1 1 1 8 1990 1 1 12 PHE CD2 C 6.784 -8.471 -0.984 1.00 . A A . 12 PHE CD2 1 1 8 1991 1 1 12 PHE CE1 C 5.699 -5.960 -1.345 1.00 . A A . 12 PHE CE1 1 1 8 1992 1 1 12 PHE CE2 C 7.353 -7.597 -1.891 1.00 . A A . 12 PHE CE2 1 1 8 1993 1 1 12 PHE CG C 5.670 -8.102 -0.248 1.00 . A A . 12 PHE CG 1 1 8 1994 1 1 12 PHE CZ C 6.809 -6.340 -2.072 1.00 . A A . 12 PHE CZ 1 1 8 1995 1 1 12 PHE H H 3.763 -8.947 -1.743 1.00 . A A . 12 PHE H 1 1 8 1996 1 1 12 PHE HA H 4.037 -10.912 0.435 1.00 . A A . 12 PHE HA 1 1 8 1997 1 1 12 PHE HB2 H 4.684 -8.474 1.570 1.00 . A A . 12 PHE HB2 1 1 8 1998 1 1 12 PHE HB3 H 5.828 -9.721 1.084 1.00 . A A . 12 PHE HB3 1 1 8 1999 1 1 12 PHE HD1 H 4.265 -6.540 0.130 1.00 . A A . 12 PHE HD1 1 1 8 2000 1 1 12 PHE HD2 H 7.211 -9.454 -0.844 1.00 . A A . 12 PHE HD2 1 1 8 2001 1 1 12 PHE HE1 H 5.271 -4.978 -1.484 1.00 . A A . 12 PHE HE1 1 1 8 2002 1 1 12 PHE HE2 H 8.222 -7.897 -2.459 1.00 . A A . 12 PHE HE2 1 1 8 2003 1 1 12 PHE HZ H 7.252 -5.656 -2.780 1.00 . A A . 12 PHE HZ 1 1 8 2004 1 1 12 PHE N N 3.922 -9.809 -1.304 1.00 . A A . 12 PHE N 1 1 8 2005 1 1 12 PHE O O 2.422 -8.204 1.024 1.00 . A A . 12 PHE O 1 1 8 2006 1 1 13 GLY C C 0.171 -10.193 2.821 1.00 . A A . 13 GLY C 1 1 8 2007 1 1 13 GLY CA C 0.303 -9.928 1.335 1.00 . A A . 13 GLY CA 1 1 8 2008 1 1 13 GLY H H 1.789 -11.218 0.552 1.00 . A A . 13 GLY H 1 1 8 2009 1 1 13 GLY HA2 H 0.136 -8.878 1.150 1.00 . A A . 13 GLY HA2 1 1 8 2010 1 1 13 GLY HA3 H -0.449 -10.500 0.811 1.00 . A A . 13 GLY HA3 1 1 8 2011 1 1 13 GLY N N 1.611 -10.292 0.820 1.00 . A A . 13 GLY N 1 1 8 2012 1 1 13 GLY O O -0.859 -9.893 3.424 1.00 . A A . 13 GLY O 1 1 8 2013 1 1 14 LYS C C 1.115 -9.789 5.671 1.00 . A A . 14 LYS C 1 1 8 2014 1 1 14 LYS CA C 1.215 -11.065 4.841 1.00 . A A . 14 LYS CA 1 1 8 2015 1 1 14 LYS CB C 2.481 -11.836 5.220 1.00 . A A . 14 LYS CB 1 1 8 2016 1 1 14 LYS CD C 4.976 -12.020 4.990 1.00 . A A . 14 LYS CD 1 1 8 2017 1 1 14 LYS CE C 5.072 -12.996 3.827 1.00 . A A . 14 LYS CE 1 1 8 2018 1 1 14 LYS CG C 3.766 -11.111 4.855 1.00 . A A . 14 LYS CG 1 1 8 2019 1 1 14 LYS H H 2.011 -10.974 2.881 1.00 . A A . 14 LYS H 1 1 8 2020 1 1 14 LYS HA H 0.353 -11.682 5.046 1.00 . A A . 14 LYS HA 1 1 8 2021 1 1 14 LYS HB2 H 2.479 -12.006 6.286 1.00 . A A . 14 LYS HB2 1 1 8 2022 1 1 14 LYS HB3 H 2.474 -12.789 4.711 1.00 . A A . 14 LYS HB3 1 1 8 2023 1 1 14 LYS HD2 H 5.870 -11.415 5.012 1.00 . A A . 14 LYS HD2 1 1 8 2024 1 1 14 LYS HD3 H 4.895 -12.579 5.911 1.00 . A A . 14 LYS HD3 1 1 8 2025 1 1 14 LYS HE2 H 4.110 -13.463 3.685 1.00 . A A . 14 LYS HE2 1 1 8 2026 1 1 14 LYS HE3 H 5.340 -12.448 2.935 1.00 . A A . 14 LYS HE3 1 1 8 2027 1 1 14 LYS HG2 H 3.698 -10.769 3.833 1.00 . A A . 14 LYS HG2 1 1 8 2028 1 1 14 LYS HG3 H 3.889 -10.263 5.514 1.00 . A A . 14 LYS HG3 1 1 8 2029 1 1 14 LYS HZ1 H 5.629 -14.937 4.360 1.00 . A A . 14 LYS HZ1 1 1 8 2030 1 1 14 LYS HZ2 H 6.743 -13.753 4.826 1.00 . A A . 14 LYS HZ2 1 1 8 2031 1 1 14 LYS HZ3 H 6.641 -14.227 3.205 1.00 . A A . 14 LYS HZ3 1 1 8 2032 1 1 14 LYS N N 1.217 -10.758 3.415 1.00 . A A . 14 LYS N 1 1 8 2033 1 1 14 LYS NZ N 6.093 -14.052 4.071 1.00 . A A . 14 LYS NZ 1 1 8 2034 1 1 14 LYS O O 0.376 -9.733 6.653 1.00 . A A . 14 LYS O 1 1 8 2035 1 1 15 GLY C C 1.399 -6.349 5.114 1.00 . A A . 15 GLY C 1 1 8 2036 1 1 15 GLY CA C 1.844 -7.506 5.987 1.00 . A A . 15 GLY CA 1 1 8 2037 1 1 15 GLY H H 2.434 -8.869 4.479 1.00 . A A . 15 GLY H 1 1 8 2038 1 1 15 GLY HA2 H 1.168 -7.591 6.825 1.00 . A A . 15 GLY HA2 1 1 8 2039 1 1 15 GLY HA3 H 2.837 -7.300 6.358 1.00 . A A . 15 GLY HA3 1 1 8 2040 1 1 15 GLY N N 1.864 -8.767 5.269 1.00 . A A . 15 GLY N 1 1 8 2041 1 1 15 GLY O O 0.847 -5.367 5.607 1.00 . A A . 15 GLY O 1 1 8 2042 1 1 16 GLY C C 1.755 -4.048 3.327 1.00 . A A . 16 GLY C 1 1 8 2043 1 1 16 GLY CA C 1.258 -5.411 2.890 1.00 . A A . 16 GLY CA 1 1 8 2044 1 1 16 GLY H H 2.087 -7.270 3.475 1.00 . A A . 16 GLY H 1 1 8 2045 1 1 16 GLY HA2 H 1.665 -5.636 1.915 1.00 . A A . 16 GLY HA2 1 1 8 2046 1 1 16 GLY HA3 H 0.181 -5.384 2.821 1.00 . A A . 16 GLY HA3 1 1 8 2047 1 1 16 GLY N N 1.643 -6.464 3.812 1.00 . A A . 16 GLY N 1 1 8 2048 1 1 16 GLY O O 2.960 -3.829 3.451 1.00 . A A . 16 GLY O 1 1 9 2049 1 1 1 VAL C C 0.720 -1.156 -2.845 1.00 . A A . 1 VAL C 1 1 9 2050 1 1 1 VAL CA C 1.537 -0.446 -1.771 1.00 . A A . 1 VAL CA 1 1 9 2051 1 1 1 VAL CB C 2.893 -1.161 -1.616 1.00 . A A . 1 VAL CB 1 1 9 2052 1 1 1 VAL CG1 C 2.697 -2.560 -1.052 1.00 . A A . 1 VAL CG1 1 1 9 2053 1 1 1 VAL CG2 C 3.623 -1.213 -2.950 1.00 . A A . 1 VAL CG2 1 1 9 2054 1 1 1 VAL H1 H 0.404 0.446 -0.222 1.00 . A A . 1 VAL H1 1 1 9 2055 1 1 1 VAL HA H 1.725 0.570 -2.088 1.00 . A A . 1 VAL HA 1 1 9 2056 1 1 1 VAL HB H 3.497 -0.598 -0.920 1.00 . A A . 1 VAL HB 1 1 9 2057 1 1 1 VAL HG11 H 2.095 -3.142 -1.734 1.00 . A A . 1 VAL HG11 1 1 9 2058 1 1 1 VAL HG12 H 3.658 -3.035 -0.922 1.00 . A A . 1 VAL HG12 1 1 9 2059 1 1 1 VAL HG13 H 2.196 -2.496 -0.097 1.00 . A A . 1 VAL HG13 1 1 9 2060 1 1 1 VAL HG21 H 3.487 -2.187 -3.396 1.00 . A A . 1 VAL HG21 1 1 9 2061 1 1 1 VAL HG22 H 3.224 -0.456 -3.609 1.00 . A A . 1 VAL HG22 1 1 9 2062 1 1 1 VAL HG23 H 4.676 -1.033 -2.791 1.00 . A A . 1 VAL HG23 1 1 9 2063 1 1 1 VAL N N 0.814 -0.398 -0.506 1.00 . A A . 1 VAL N 1 1 9 2064 1 1 1 VAL O O 0.762 -0.786 -4.018 1.00 . A A . 1 VAL O 1 1 9 2065 1 1 2 ALA C C -2.310 -2.948 -2.914 1.00 . A A . 2 ALA C 1 1 9 2066 1 1 2 ALA CA C -0.852 -2.940 -3.361 1.00 . A A . 2 ALA CA 1 1 9 2067 1 1 2 ALA CB C -0.330 -4.363 -3.491 1.00 . A A . 2 ALA CB 1 1 9 2068 1 1 2 ALA H H -0.014 -2.426 -1.487 1.00 . A A . 2 ALA H 1 1 9 2069 1 1 2 ALA HA H -0.787 -2.469 -4.332 1.00 . A A . 2 ALA HA 1 1 9 2070 1 1 2 ALA HB1 H -0.487 -4.712 -4.501 1.00 . A A . 2 ALA HB1 1 1 9 2071 1 1 2 ALA HB2 H 0.725 -4.381 -3.262 1.00 . A A . 2 ALA HB2 1 1 9 2072 1 1 2 ALA HB3 H -0.859 -5.004 -2.801 1.00 . A A . 2 ALA HB3 1 1 9 2073 1 1 2 ALA N N -0.023 -2.179 -2.435 1.00 . A A . 2 ALA N 1 1 9 2074 1 1 2 ALA O O -2.630 -3.412 -1.819 1.00 . A A . 2 ALA O 1 1 9 2075 1 1 3 ARG C C -5.133 -3.752 -3.048 1.00 . A A . 3 ARG C 1 1 9 2076 1 1 3 ARG CA C -4.613 -2.376 -3.456 1.00 . A A . 3 ARG CA 1 1 9 2077 1 1 3 ARG CB C -5.399 -1.859 -4.662 1.00 . A A . 3 ARG CB 1 1 9 2078 1 1 3 ARG CD C -4.276 -3.144 -6.507 1.00 . A A . 3 ARG CD 1 1 9 2079 1 1 3 ARG CG C -5.578 -2.893 -5.762 1.00 . A A . 3 ARG CG 1 1 9 2080 1 1 3 ARG CZ C -4.106 -1.242 -8.056 1.00 . A A . 3 ARG CZ 1 1 9 2081 1 1 3 ARG H H -2.873 -2.076 -4.623 1.00 . A A . 3 ARG H 1 1 9 2082 1 1 3 ARG HA H -4.747 -1.694 -2.630 1.00 . A A . 3 ARG HA 1 1 9 2083 1 1 3 ARG HB2 H -6.378 -1.546 -4.331 1.00 . A A . 3 ARG HB2 1 1 9 2084 1 1 3 ARG HB3 H -4.879 -1.009 -5.078 1.00 . A A . 3 ARG HB3 1 1 9 2085 1 1 3 ARG HD2 H -3.583 -3.634 -5.840 1.00 . A A . 3 ARG HD2 1 1 9 2086 1 1 3 ARG HD3 H -4.479 -3.786 -7.351 1.00 . A A . 3 ARG HD3 1 1 9 2087 1 1 3 ARG HE H -2.909 -1.547 -6.490 1.00 . A A . 3 ARG HE 1 1 9 2088 1 1 3 ARG HG2 H -5.911 -3.821 -5.320 1.00 . A A . 3 ARG HG2 1 1 9 2089 1 1 3 ARG HG3 H -6.320 -2.537 -6.460 1.00 . A A . 3 ARG HG3 1 1 9 2090 1 1 3 ARG HH11 H -5.594 -2.545 -8.469 1.00 . A A . 3 ARG HH11 1 1 9 2091 1 1 3 ARG HH12 H -5.463 -1.200 -9.554 1.00 . A A . 3 ARG HH12 1 1 9 2092 1 1 3 ARG HH21 H -2.727 0.228 -7.911 1.00 . A A . 3 ARG HH21 1 1 9 2093 1 1 3 ARG HH22 H -3.831 0.376 -9.236 1.00 . A A . 3 ARG HH22 1 1 9 2094 1 1 3 ARG N N -3.189 -2.430 -3.766 1.00 . A A . 3 ARG N 1 1 9 2095 1 1 3 ARG NE N -3.674 -1.903 -6.989 1.00 . A A . 3 ARG NE 1 1 9 2096 1 1 3 ARG NH1 N -5.139 -1.700 -8.750 1.00 . A A . 3 ARG NH1 1 1 9 2097 1 1 3 ARG NH2 N -3.505 -0.120 -8.432 1.00 . A A . 3 ARG NH2 1 1 9 2098 1 1 3 ARG O O -6.073 -3.863 -2.262 1.00 . A A . 3 ARG O 1 1 9 2099 1 1 4 GLY C C -3.878 -6.908 -2.482 1.00 . A A . 4 GLY C 1 1 9 2100 1 1 4 GLY CA C -4.928 -6.151 -3.269 1.00 . A A . 4 GLY CA 1 1 9 2101 1 1 4 GLY H H -3.770 -4.648 -4.209 1.00 . A A . 4 GLY H 1 1 9 2102 1 1 4 GLY HA2 H -5.838 -6.110 -2.689 1.00 . A A . 4 GLY HA2 1 1 9 2103 1 1 4 GLY HA3 H -5.124 -6.682 -4.190 1.00 . A A . 4 GLY HA3 1 1 9 2104 1 1 4 GLY N N -4.514 -4.797 -3.588 1.00 . A A . 4 GLY N 1 1 9 2105 1 1 4 GLY O O -2.888 -7.377 -3.045 1.00 . A A . 4 GLY O 1 1 9 2106 1 1 5 TRP C C -3.844 -8.879 0.421 1.00 . A A . 5 TRP C 1 1 9 2107 1 1 5 TRP CA C -3.154 -7.733 -0.310 1.00 . A A . 5 TRP CA 1 1 9 2108 1 1 5 TRP CB C -2.535 -6.765 0.700 1.00 . A A . 5 TRP CB 1 1 9 2109 1 1 5 TRP CD1 C -1.029 -4.733 0.290 1.00 . A A . 5 TRP CD1 1 1 9 2110 1 1 5 TRP CD2 C -0.223 -6.656 -0.527 1.00 . A A . 5 TRP CD2 1 1 9 2111 1 1 5 TRP CE2 C 0.693 -5.626 -0.817 1.00 . A A . 5 TRP CE2 1 1 9 2112 1 1 5 TRP CE3 C 0.073 -7.957 -0.942 1.00 . A A . 5 TRP CE3 1 1 9 2113 1 1 5 TRP CG C -1.317 -6.064 0.182 1.00 . A A . 5 TRP CG 1 1 9 2114 1 1 5 TRP CH2 C 2.145 -7.141 -1.900 1.00 . A A . 5 TRP CH2 1 1 9 2115 1 1 5 TRP CZ2 C 1.881 -5.858 -1.505 1.00 . A A . 5 TRP CZ2 1 1 9 2116 1 1 5 TRP CZ3 C 1.253 -8.186 -1.625 1.00 . A A . 5 TRP CZ3 1 1 9 2117 1 1 5 TRP H H -4.899 -6.633 -0.786 1.00 . A A . 5 TRP H 1 1 9 2118 1 1 5 TRP HA H -2.370 -8.139 -0.932 1.00 . A A . 5 TRP HA 1 1 9 2119 1 1 5 TRP HB2 H -3.265 -6.015 0.964 1.00 . A A . 5 TRP HB2 1 1 9 2120 1 1 5 TRP HB3 H -2.253 -7.315 1.587 1.00 . A A . 5 TRP HB3 1 1 9 2121 1 1 5 TRP HD1 H -1.667 -4.010 0.775 1.00 . A A . 5 TRP HD1 1 1 9 2122 1 1 5 TRP HE1 H 0.601 -3.580 -0.363 1.00 . A A . 5 TRP HE1 1 1 9 2123 1 1 5 TRP HE3 H -0.602 -8.776 -0.740 1.00 . A A . 5 TRP HE3 1 1 9 2124 1 1 5 TRP HH2 H 3.054 -7.366 -2.436 1.00 . A A . 5 TRP HH2 1 1 9 2125 1 1 5 TRP HZ2 H 2.579 -5.064 -1.724 1.00 . A A . 5 TRP HZ2 1 1 9 2126 1 1 5 TRP HZ3 H 1.498 -9.185 -1.954 1.00 . A A . 5 TRP HZ3 1 1 9 2127 1 1 5 TRP N N -4.092 -7.028 -1.177 1.00 . A A . 5 TRP N 1 1 9 2128 1 1 5 TRP NE1 N 0.177 -4.463 -0.310 1.00 . A A . 5 TRP NE1 1 1 9 2129 1 1 5 TRP O O -3.757 -10.035 0.007 1.00 . A A . 5 TRP O 1 1 9 2130 1 1 6 LYS C C -5.691 -10.716 1.423 1.00 . A A . 6 LYS C 1 1 9 2131 1 1 6 LYS CA C -5.237 -9.553 2.300 1.00 . A A . 6 LYS CA 1 1 9 2132 1 1 6 LYS CB C -6.445 -8.924 2.997 1.00 . A A . 6 LYS CB 1 1 9 2133 1 1 6 LYS CD C -6.587 -6.427 2.756 1.00 . A A . 6 LYS CD 1 1 9 2134 1 1 6 LYS CE C -7.716 -5.408 2.782 1.00 . A A . 6 LYS CE 1 1 9 2135 1 1 6 LYS CG C -7.060 -7.769 2.224 1.00 . A A . 6 LYS CG 1 1 9 2136 1 1 6 LYS H H -4.562 -7.612 1.792 1.00 . A A . 6 LYS H 1 1 9 2137 1 1 6 LYS HA H -4.555 -9.928 3.049 1.00 . A A . 6 LYS HA 1 1 9 2138 1 1 6 LYS HB2 H -7.202 -9.682 3.134 1.00 . A A . 6 LYS HB2 1 1 9 2139 1 1 6 LYS HB3 H -6.137 -8.557 3.965 1.00 . A A . 6 LYS HB3 1 1 9 2140 1 1 6 LYS HD2 H -6.214 -6.559 3.761 1.00 . A A . 6 LYS HD2 1 1 9 2141 1 1 6 LYS HD3 H -5.794 -6.057 2.122 1.00 . A A . 6 LYS HD3 1 1 9 2142 1 1 6 LYS HE2 H -8.657 -5.935 2.824 1.00 . A A . 6 LYS HE2 1 1 9 2143 1 1 6 LYS HE3 H -7.608 -4.793 3.663 1.00 . A A . 6 LYS HE3 1 1 9 2144 1 1 6 LYS HG2 H -6.777 -7.852 1.185 1.00 . A A . 6 LYS HG2 1 1 9 2145 1 1 6 LYS HG3 H -8.136 -7.822 2.311 1.00 . A A . 6 LYS HG3 1 1 9 2146 1 1 6 LYS HZ1 H -7.325 -3.597 1.819 1.00 . A A . 6 LYS HZ1 1 1 9 2147 1 1 6 LYS HZ2 H -8.667 -4.423 1.205 1.00 . A A . 6 LYS HZ2 1 1 9 2148 1 1 6 LYS HZ3 H -7.105 -4.956 0.836 1.00 . A A . 6 LYS HZ3 1 1 9 2149 1 1 6 LYS N N -4.530 -8.552 1.511 1.00 . A A . 6 LYS N 1 1 9 2150 1 1 6 LYS NZ N -7.702 -4.535 1.576 1.00 . A A . 6 LYS NZ 1 1 9 2151 1 1 6 LYS O O -5.371 -11.873 1.696 1.00 . A A . 6 LYS O 1 1 9 2152 1 1 7 ARG C C -5.805 -11.961 -1.420 1.00 . A A . 7 ARG C 1 1 9 2153 1 1 7 ARG CA C -6.933 -11.418 -0.548 1.00 . A A . 7 ARG CA 1 1 9 2154 1 1 7 ARG CB C -8.043 -10.843 -1.430 1.00 . A A . 7 ARG CB 1 1 9 2155 1 1 7 ARG CD C -10.209 -9.643 -0.999 1.00 . A A . 7 ARG CD 1 1 9 2156 1 1 7 ARG CG C -9.425 -10.932 -0.805 1.00 . A A . 7 ARG CG 1 1 9 2157 1 1 7 ARG CZ C -10.916 -8.169 -2.835 1.00 . A A . 7 ARG CZ 1 1 9 2158 1 1 7 ARG H H -6.657 -9.459 0.204 1.00 . A A . 7 ARG H 1 1 9 2159 1 1 7 ARG HA H -7.337 -12.227 0.042 1.00 . A A . 7 ARG HA 1 1 9 2160 1 1 7 ARG HB2 H -7.828 -9.803 -1.627 1.00 . A A . 7 ARG HB2 1 1 9 2161 1 1 7 ARG HB3 H -8.059 -11.382 -2.365 1.00 . A A . 7 ARG HB3 1 1 9 2162 1 1 7 ARG HD2 H -11.213 -9.789 -0.629 1.00 . A A . 7 ARG HD2 1 1 9 2163 1 1 7 ARG HD3 H -9.728 -8.857 -0.436 1.00 . A A . 7 ARG HD3 1 1 9 2164 1 1 7 ARG HE H -9.817 -9.818 -3.057 1.00 . A A . 7 ARG HE 1 1 9 2165 1 1 7 ARG HG2 H -9.968 -11.743 -1.267 1.00 . A A . 7 ARG HG2 1 1 9 2166 1 1 7 ARG HG3 H -9.320 -11.124 0.253 1.00 . A A . 7 ARG HG3 1 1 9 2167 1 1 7 ARG HH11 H -11.535 -7.597 -0.999 1.00 . A A . 7 ARG HH11 1 1 9 2168 1 1 7 ARG HH12 H -12.026 -6.566 -2.302 1.00 . A A . 7 ARG HH12 1 1 9 2169 1 1 7 ARG HH21 H -10.458 -8.469 -4.781 1.00 . A A . 7 ARG HH21 1 1 9 2170 1 1 7 ARG HH22 H -11.414 -7.064 -4.452 1.00 . A A . 7 ARG HH22 1 1 9 2171 1 1 7 ARG N N -6.436 -10.400 0.369 1.00 . A A . 7 ARG N 1 1 9 2172 1 1 7 ARG NE N -10.274 -9.249 -2.404 1.00 . A A . 7 ARG NE 1 1 9 2173 1 1 7 ARG NH1 N -11.545 -7.380 -1.975 1.00 . A A . 7 ARG NH1 1 1 9 2174 1 1 7 ARG NH2 N -10.930 -7.876 -4.129 1.00 . A A . 7 ARG NH2 1 1 9 2175 1 1 7 ARG O O -5.271 -13.040 -1.163 1.00 . A A . 7 ARG O 1 1 9 2176 1 1 8 LYS C C -3.014 -11.285 -2.780 1.00 . A A . 8 LYS C 1 1 9 2177 1 1 8 LYS CA C -4.384 -11.611 -3.365 1.00 . A A . 8 LYS CA 1 1 9 2178 1 1 8 LYS CB C -4.551 -10.914 -4.718 1.00 . A A . 8 LYS CB 1 1 9 2179 1 1 8 LYS CD C -4.190 -8.677 -5.802 1.00 . A A . 8 LYS CD 1 1 9 2180 1 1 8 LYS CE C -2.674 -8.586 -5.719 1.00 . A A . 8 LYS CE 1 1 9 2181 1 1 8 LYS CG C -4.770 -9.415 -4.607 1.00 . A A . 8 LYS CG 1 1 9 2182 1 1 8 LYS H H -5.912 -10.356 -2.608 1.00 . A A . 8 LYS H 1 1 9 2183 1 1 8 LYS HA H -4.457 -12.678 -3.509 1.00 . A A . 8 LYS HA 1 1 9 2184 1 1 8 LYS HB2 H -3.663 -11.084 -5.309 1.00 . A A . 8 LYS HB2 1 1 9 2185 1 1 8 LYS HB3 H -5.401 -11.344 -5.228 1.00 . A A . 8 LYS HB3 1 1 9 2186 1 1 8 LYS HD2 H -4.458 -9.204 -6.705 1.00 . A A . 8 LYS HD2 1 1 9 2187 1 1 8 LYS HD3 H -4.600 -7.677 -5.830 1.00 . A A . 8 LYS HD3 1 1 9 2188 1 1 8 LYS HE2 H -2.365 -8.846 -4.718 1.00 . A A . 8 LYS HE2 1 1 9 2189 1 1 8 LYS HE3 H -2.246 -9.286 -6.421 1.00 . A A . 8 LYS HE3 1 1 9 2190 1 1 8 LYS HG2 H -5.830 -9.218 -4.556 1.00 . A A . 8 LYS HG2 1 1 9 2191 1 1 8 LYS HG3 H -4.291 -9.056 -3.706 1.00 . A A . 8 LYS HG3 1 1 9 2192 1 1 8 LYS HZ1 H -1.438 -7.266 -6.763 1.00 . A A . 8 LYS HZ1 1 1 9 2193 1 1 8 LYS HZ2 H -1.789 -6.771 -5.184 1.00 . A A . 8 LYS HZ2 1 1 9 2194 1 1 8 LYS HZ3 H -2.962 -6.631 -6.395 1.00 . A A . 8 LYS HZ3 1 1 9 2195 1 1 8 LYS N N -5.448 -11.207 -2.454 1.00 . A A . 8 LYS N 1 1 9 2196 1 1 8 LYS NZ N -2.181 -7.218 -6.037 1.00 . A A . 8 LYS NZ 1 1 9 2197 1 1 8 LYS O O -2.712 -10.128 -2.487 1.00 . A A . 8 LYS O 1 1 9 2198 1 1 9 CYS C C 0.214 -12.530 -3.082 1.00 . A A . 9 CYS C 1 1 9 2199 1 1 9 CYS CA C -0.849 -12.135 -2.062 1.00 . A A . 9 CYS CA 1 1 9 2200 1 1 9 CYS CB C -0.685 -12.966 -0.789 1.00 . A A . 9 CYS CB 1 1 9 2201 1 1 9 CYS H H -2.486 -13.212 -2.865 1.00 . A A . 9 CYS H 1 1 9 2202 1 1 9 CYS HA H -0.727 -11.091 -1.819 1.00 . A A . 9 CYS HA 1 1 9 2203 1 1 9 CYS HB2 H 0.356 -12.966 -0.500 1.00 . A A . 9 CYS HB2 1 1 9 2204 1 1 9 CYS HB3 H -1.270 -12.519 0.001 1.00 . A A . 9 CYS HB3 1 1 9 2205 1 1 9 CYS HG H -0.463 -15.423 -0.145 1.00 . A A . 9 CYS HG 1 1 9 2206 1 1 9 CYS N N -2.188 -12.313 -2.613 1.00 . A A . 9 CYS N 1 1 9 2207 1 1 9 CYS O O 0.819 -13.600 -3.003 1.00 . A A . 9 CYS O 1 1 9 2208 1 1 9 CYS SG S -1.208 -14.688 -0.957 1.00 . A A . 9 CYS SG 1 1 9 2209 1 1 10 PRO C C 2.870 -11.827 -4.595 1.00 . A A . 10 PRO C 1 1 9 2210 1 1 10 PRO CA C 1.439 -11.882 -5.120 1.00 . A A . 10 PRO CA 1 1 9 2211 1 1 10 PRO CB C 1.185 -10.738 -6.105 1.00 . A A . 10 PRO CB 1 1 9 2212 1 1 10 PRO CD C -0.234 -10.352 -4.221 1.00 . A A . 10 PRO CD 1 1 9 2213 1 1 10 PRO CG C 0.574 -9.658 -5.281 1.00 . A A . 10 PRO CG 1 1 9 2214 1 1 10 PRO HA H 1.275 -12.828 -5.614 1.00 . A A . 10 PRO HA 1 1 9 2215 1 1 10 PRO HB2 H 2.122 -10.422 -6.541 1.00 . A A . 10 PRO HB2 1 1 9 2216 1 1 10 PRO HB3 H 0.514 -11.070 -6.882 1.00 . A A . 10 PRO HB3 1 1 9 2217 1 1 10 PRO HD2 H -0.210 -9.790 -3.299 1.00 . A A . 10 PRO HD2 1 1 9 2218 1 1 10 PRO HD3 H -1.252 -10.492 -4.553 1.00 . A A . 10 PRO HD3 1 1 9 2219 1 1 10 PRO HG2 H 1.349 -9.058 -4.829 1.00 . A A . 10 PRO HG2 1 1 9 2220 1 1 10 PRO HG3 H -0.066 -9.044 -5.898 1.00 . A A . 10 PRO HG3 1 1 9 2221 1 1 10 PRO N N 0.449 -11.648 -4.065 1.00 . A A . 10 PRO N 1 1 9 2222 1 1 10 PRO O O 3.689 -12.693 -4.903 1.00 . A A . 10 PRO O 1 1 9 2223 1 1 11 LEU C C 4.465 -10.786 -1.716 1.00 . A A . 11 LEU C 1 1 9 2224 1 1 11 LEU CA C 4.497 -10.634 -3.233 1.00 . A A . 11 LEU CA 1 1 9 2225 1 1 11 LEU CB C 5.063 -9.263 -3.608 1.00 . A A . 11 LEU CB 1 1 9 2226 1 1 11 LEU CD1 C 4.641 -6.936 -4.437 1.00 . A A . 11 LEU CD1 1 1 9 2227 1 1 11 LEU CD2 C 4.127 -8.895 -5.904 1.00 . A A . 11 LEU CD2 1 1 9 2228 1 1 11 LEU CG C 4.164 -8.379 -4.473 1.00 . A A . 11 LEU CG 1 1 9 2229 1 1 11 LEU H H 2.470 -10.144 -3.592 1.00 . A A . 11 LEU H 1 1 9 2230 1 1 11 LEU HA H 5.133 -11.403 -3.647 1.00 . A A . 11 LEU HA 1 1 9 2231 1 1 11 LEU HB2 H 5.269 -8.730 -2.693 1.00 . A A . 11 LEU HB2 1 1 9 2232 1 1 11 LEU HB3 H 5.987 -9.424 -4.145 1.00 . A A . 11 LEU HB3 1 1 9 2233 1 1 11 LEU HD11 H 4.025 -6.370 -3.753 1.00 . A A . 11 LEU HD11 1 1 9 2234 1 1 11 LEU HD12 H 4.568 -6.508 -5.426 1.00 . A A . 11 LEU HD12 1 1 9 2235 1 1 11 LEU HD13 H 5.669 -6.904 -4.107 1.00 . A A . 11 LEU HD13 1 1 9 2236 1 1 11 LEU HD21 H 4.868 -8.375 -6.493 1.00 . A A . 11 LEU HD21 1 1 9 2237 1 1 11 LEU HD22 H 3.147 -8.721 -6.324 1.00 . A A . 11 LEU HD22 1 1 9 2238 1 1 11 LEU HD23 H 4.339 -9.954 -5.911 1.00 . A A . 11 LEU HD23 1 1 9 2239 1 1 11 LEU HG H 3.157 -8.408 -4.080 1.00 . A A . 11 LEU HG 1 1 9 2240 1 1 11 LEU N N 3.164 -10.803 -3.802 1.00 . A A . 11 LEU N 1 1 9 2241 1 1 11 LEU O O 4.832 -11.832 -1.178 1.00 . A A . 11 LEU O 1 1 9 2242 1 1 12 PHE C C 2.515 -9.477 0.894 1.00 . A A . 12 PHE C 1 1 9 2243 1 1 12 PHE CA C 3.941 -9.755 0.426 1.00 . A A . 12 PHE CA 1 1 9 2244 1 1 12 PHE CB C 4.896 -8.720 1.023 1.00 . A A . 12 PHE CB 1 1 9 2245 1 1 12 PHE CD1 C 4.713 -6.577 -0.269 1.00 . A A . 12 PHE CD1 1 1 9 2246 1 1 12 PHE CD2 C 6.614 -7.966 -0.643 1.00 . A A . 12 PHE CD2 1 1 9 2247 1 1 12 PHE CE1 C 5.190 -5.668 -1.193 1.00 . A A . 12 PHE CE1 1 1 9 2248 1 1 12 PHE CE2 C 7.097 -7.060 -1.568 1.00 . A A . 12 PHE CE2 1 1 9 2249 1 1 12 PHE CG C 5.418 -7.735 0.017 1.00 . A A . 12 PHE CG 1 1 9 2250 1 1 12 PHE CZ C 6.383 -5.910 -1.845 1.00 . A A . 12 PHE CZ 1 1 9 2251 1 1 12 PHE H H 3.744 -8.932 -1.515 1.00 . A A . 12 PHE H 1 1 9 2252 1 1 12 PHE HA H 4.232 -10.738 0.761 1.00 . A A . 12 PHE HA 1 1 9 2253 1 1 12 PHE HB2 H 4.381 -8.166 1.793 1.00 . A A . 12 PHE HB2 1 1 9 2254 1 1 12 PHE HB3 H 5.742 -9.231 1.459 1.00 . A A . 12 PHE HB3 1 1 9 2255 1 1 12 PHE HD1 H 3.778 -6.387 0.241 1.00 . A A . 12 PHE HD1 1 1 9 2256 1 1 12 PHE HD2 H 7.173 -8.865 -0.429 1.00 . A A . 12 PHE HD2 1 1 9 2257 1 1 12 PHE HE1 H 4.629 -4.770 -1.407 1.00 . A A . 12 PHE HE1 1 1 9 2258 1 1 12 PHE HE2 H 8.030 -7.252 -2.077 1.00 . A A . 12 PHE HE2 1 1 9 2259 1 1 12 PHE HZ H 6.759 -5.201 -2.567 1.00 . A A . 12 PHE HZ 1 1 9 2260 1 1 12 PHE N N 4.022 -9.738 -1.030 1.00 . A A . 12 PHE N 1 1 9 2261 1 1 12 PHE O O 2.137 -8.329 1.121 1.00 . A A . 12 PHE O 1 1 9 2262 1 1 13 GLY C C 0.221 -10.408 2.985 1.00 . A A . 13 GLY C 1 1 9 2263 1 1 13 GLY CA C 0.353 -10.390 1.475 1.00 . A A . 13 GLY CA 1 1 9 2264 1 1 13 GLY H H 2.083 -11.431 0.840 1.00 . A A . 13 GLY H 1 1 9 2265 1 1 13 GLY HA2 H -0.033 -9.453 1.102 1.00 . A A . 13 GLY HA2 1 1 9 2266 1 1 13 GLY HA3 H -0.234 -11.198 1.065 1.00 . A A . 13 GLY HA3 1 1 9 2267 1 1 13 GLY N N 1.728 -10.539 1.036 1.00 . A A . 13 GLY N 1 1 9 2268 1 1 13 GLY O O -0.842 -10.107 3.527 1.00 . A A . 13 GLY O 1 1 9 2269 1 1 14 LYS C C 1.485 -9.428 5.723 1.00 . A A . 14 LYS C 1 1 9 2270 1 1 14 LYS CA C 1.308 -10.820 5.124 1.00 . A A . 14 LYS CA 1 1 9 2271 1 1 14 LYS CB C 2.423 -11.744 5.617 1.00 . A A . 14 LYS CB 1 1 9 2272 1 1 14 LYS CD C 4.615 -12.564 4.703 1.00 . A A . 14 LYS CD 1 1 9 2273 1 1 14 LYS CE C 6.049 -12.188 4.367 1.00 . A A . 14 LYS CE 1 1 9 2274 1 1 14 LYS CG C 3.804 -11.349 5.122 1.00 . A A . 14 LYS CG 1 1 9 2275 1 1 14 LYS H H 2.124 -10.991 3.179 1.00 . A A . 14 LYS H 1 1 9 2276 1 1 14 LYS HA H 0.356 -11.217 5.443 1.00 . A A . 14 LYS HA 1 1 9 2277 1 1 14 LYS HB2 H 2.434 -11.732 6.697 1.00 . A A . 14 LYS HB2 1 1 9 2278 1 1 14 LYS HB3 H 2.217 -12.750 5.279 1.00 . A A . 14 LYS HB3 1 1 9 2279 1 1 14 LYS HD2 H 4.622 -13.278 5.513 1.00 . A A . 14 LYS HD2 1 1 9 2280 1 1 14 LYS HD3 H 4.155 -13.010 3.832 1.00 . A A . 14 LYS HD3 1 1 9 2281 1 1 14 LYS HE2 H 6.060 -11.676 3.417 1.00 . A A . 14 LYS HE2 1 1 9 2282 1 1 14 LYS HE3 H 6.424 -11.528 5.135 1.00 . A A . 14 LYS HE3 1 1 9 2283 1 1 14 LYS HG2 H 3.697 -10.691 4.272 1.00 . A A . 14 LYS HG2 1 1 9 2284 1 1 14 LYS HG3 H 4.327 -10.834 5.915 1.00 . A A . 14 LYS HG3 1 1 9 2285 1 1 14 LYS HZ1 H 7.909 -13.125 4.529 1.00 . A A . 14 LYS HZ1 1 1 9 2286 1 1 14 LYS HZ2 H 6.921 -13.770 3.317 1.00 . A A . 14 LYS HZ2 1 1 9 2287 1 1 14 LYS HZ3 H 6.602 -14.118 4.942 1.00 . A A . 14 LYS HZ3 1 1 9 2288 1 1 14 LYS N N 1.305 -10.762 3.667 1.00 . A A . 14 LYS N 1 1 9 2289 1 1 14 LYS NZ N 6.932 -13.384 4.283 1.00 . A A . 14 LYS NZ 1 1 9 2290 1 1 14 LYS O O 0.844 -9.082 6.714 1.00 . A A . 14 LYS O 1 1 9 2291 1 1 15 GLY C C 2.093 -6.225 4.647 1.00 . A A . 15 GLY C 1 1 9 2292 1 1 15 GLY CA C 2.604 -7.288 5.599 1.00 . A A . 15 GLY CA 1 1 9 2293 1 1 15 GLY H H 2.842 -8.963 4.326 1.00 . A A . 15 GLY H 1 1 9 2294 1 1 15 GLY HA2 H 2.113 -7.167 6.554 1.00 . A A . 15 GLY HA2 1 1 9 2295 1 1 15 GLY HA3 H 3.667 -7.153 5.733 1.00 . A A . 15 GLY HA3 1 1 9 2296 1 1 15 GLY N N 2.359 -8.633 5.113 1.00 . A A . 15 GLY N 1 1 9 2297 1 1 15 GLY O O 2.639 -5.124 4.583 1.00 . A A . 15 GLY O 1 1 9 2298 1 1 16 GLY C C 0.221 -4.252 3.577 1.00 . A A . 16 GLY C 1 1 9 2299 1 1 16 GLY CA C 0.477 -5.611 2.956 1.00 . A A . 16 GLY CA 1 1 9 2300 1 1 16 GLY H H 0.648 -7.448 3.995 1.00 . A A . 16 GLY H 1 1 9 2301 1 1 16 GLY HA2 H 1.160 -5.494 2.129 1.00 . A A . 16 GLY HA2 1 1 9 2302 1 1 16 GLY HA3 H -0.457 -6.006 2.585 1.00 . A A . 16 GLY HA3 1 1 9 2303 1 1 16 GLY N N 1.042 -6.555 3.902 1.00 . A A . 16 GLY N 1 1 9 2304 1 1 16 GLY O O 0.948 -3.295 3.314 1.00 . A A . 16 GLY O 1 1 10 2305 1 1 1 VAL C C 1.544 -0.812 -2.235 1.00 . A A . 1 VAL C 1 1 10 2306 1 1 1 VAL CA C 2.368 -0.270 -1.073 1.00 . A A . 1 VAL CA 1 1 10 2307 1 1 1 VAL CB C 3.673 -1.081 -0.960 1.00 . A A . 1 VAL CB 1 1 10 2308 1 1 1 VAL CG1 C 3.375 -2.517 -0.557 1.00 . A A . 1 VAL CG1 1 1 10 2309 1 1 1 VAL CG2 C 4.443 -1.035 -2.271 1.00 . A A . 1 VAL CG2 1 1 10 2310 1 1 1 VAL H1 H 0.894 0.346 0.315 1.00 . A A . 1 VAL H1 1 1 10 2311 1 1 1 VAL HA H 2.625 0.759 -1.276 1.00 . A A . 1 VAL HA 1 1 10 2312 1 1 1 VAL HB H 4.285 -0.634 -0.191 1.00 . A A . 1 VAL HB 1 1 10 2313 1 1 1 VAL HG11 H 4.301 -3.069 -0.484 1.00 . A A . 1 VAL HG11 1 1 10 2314 1 1 1 VAL HG12 H 2.872 -2.527 0.399 1.00 . A A . 1 VAL HG12 1 1 10 2315 1 1 1 VAL HG13 H 2.742 -2.976 -1.302 1.00 . A A . 1 VAL HG13 1 1 10 2316 1 1 1 VAL HG21 H 5.499 -0.949 -2.064 1.00 . A A . 1 VAL HG21 1 1 10 2317 1 1 1 VAL HG22 H 4.259 -1.942 -2.829 1.00 . A A . 1 VAL HG22 1 1 10 2318 1 1 1 VAL HG23 H 4.118 -0.184 -2.850 1.00 . A A . 1 VAL HG23 1 1 10 2319 1 1 1 VAL N N 1.610 -0.308 0.172 1.00 . A A . 1 VAL N 1 1 10 2320 1 1 1 VAL O O 1.660 -0.339 -3.365 1.00 . A A . 1 VAL O 1 1 10 2321 1 1 2 ALA C C -1.606 -2.346 -2.575 1.00 . A A . 2 ALA C 1 1 10 2322 1 1 2 ALA CA C -0.134 -2.413 -2.971 1.00 . A A . 2 ALA CA 1 1 10 2323 1 1 2 ALA CB C 0.284 -3.855 -3.215 1.00 . A A . 2 ALA CB 1 1 10 2324 1 1 2 ALA H H 0.664 -2.142 -1.030 1.00 . A A . 2 ALA H 1 1 10 2325 1 1 2 ALA HA H 0.006 -1.863 -3.890 1.00 . A A . 2 ALA HA 1 1 10 2326 1 1 2 ALA HB1 H 1.328 -3.974 -2.965 1.00 . A A . 2 ALA HB1 1 1 10 2327 1 1 2 ALA HB2 H -0.311 -4.512 -2.598 1.00 . A A . 2 ALA HB2 1 1 10 2328 1 1 2 ALA HB3 H 0.132 -4.102 -4.255 1.00 . A A . 2 ALA HB3 1 1 10 2329 1 1 2 ALA N N 0.711 -1.808 -1.950 1.00 . A A . 2 ALA N 1 1 10 2330 1 1 2 ALA O O -2.005 -2.882 -1.541 1.00 . A A . 2 ALA O 1 1 10 2331 1 1 3 ARG C C -4.470 -2.907 -2.865 1.00 . A A . 3 ARG C 1 1 10 2332 1 1 3 ARG CA C -3.834 -1.548 -3.139 1.00 . A A . 3 ARG CA 1 1 10 2333 1 1 3 ARG CB C -4.532 -0.876 -4.323 1.00 . A A . 3 ARG CB 1 1 10 2334 1 1 3 ARG CD C -3.447 -2.120 -6.219 1.00 . A A . 3 ARG CD 1 1 10 2335 1 1 3 ARG CG C -4.753 -1.804 -5.506 1.00 . A A . 3 ARG CG 1 1 10 2336 1 1 3 ARG CZ C -2.689 -2.701 -8.484 1.00 . A A . 3 ARG CZ 1 1 10 2337 1 1 3 ARG H H -2.030 -1.280 -4.213 1.00 . A A . 3 ARG H 1 1 10 2338 1 1 3 ARG HA H -3.951 -0.926 -2.264 1.00 . A A . 3 ARG HA 1 1 10 2339 1 1 3 ARG HB2 H -5.494 -0.508 -3.998 1.00 . A A . 3 ARG HB2 1 1 10 2340 1 1 3 ARG HB3 H -3.930 -0.043 -4.655 1.00 . A A . 3 ARG HB3 1 1 10 2341 1 1 3 ARG HD2 H -2.742 -1.327 -6.018 1.00 . A A . 3 ARG HD2 1 1 10 2342 1 1 3 ARG HD3 H -3.059 -3.051 -5.834 1.00 . A A . 3 ARG HD3 1 1 10 2343 1 1 3 ARG HE H -4.488 -1.964 -8.038 1.00 . A A . 3 ARG HE 1 1 10 2344 1 1 3 ARG HG2 H -5.189 -2.727 -5.152 1.00 . A A . 3 ARG HG2 1 1 10 2345 1 1 3 ARG HG3 H -5.428 -1.329 -6.203 1.00 . A A . 3 ARG HG3 1 1 10 2346 1 1 3 ARG HH11 H -1.331 -3.024 -7.024 1.00 . A A . 3 ARG HH11 1 1 10 2347 1 1 3 ARG HH12 H -0.809 -3.429 -8.626 1.00 . A A . 3 ARG HH12 1 1 10 2348 1 1 3 ARG HH21 H -3.813 -2.494 -10.151 1.00 . A A . 3 ARG HH21 1 1 10 2349 1 1 3 ARG HH22 H -2.222 -3.127 -10.404 1.00 . A A . 3 ARG HH22 1 1 10 2350 1 1 3 ARG N N -2.407 -1.686 -3.404 1.00 . A A . 3 ARG N 1 1 10 2351 1 1 3 ARG NE N -3.626 -2.240 -7.663 1.00 . A A . 3 ARG NE 1 1 10 2352 1 1 3 ARG NH1 N -1.513 -3.082 -8.006 1.00 . A A . 3 ARG NH1 1 1 10 2353 1 1 3 ARG NH2 N -2.928 -2.781 -9.787 1.00 . A A . 3 ARG NH2 1 1 10 2354 1 1 3 ARG O O -5.444 -3.010 -2.120 1.00 . A A . 3 ARG O 1 1 10 2355 1 1 4 GLY C C -3.472 -6.191 -2.542 1.00 . A A . 4 GLY C 1 1 10 2356 1 1 4 GLY CA C -4.439 -5.289 -3.284 1.00 . A A . 4 GLY CA 1 1 10 2357 1 1 4 GLY H H -3.138 -3.808 -4.057 1.00 . A A . 4 GLY H 1 1 10 2358 1 1 4 GLY HA2 H -5.359 -5.226 -2.722 1.00 . A A . 4 GLY HA2 1 1 10 2359 1 1 4 GLY HA3 H -4.648 -5.722 -4.251 1.00 . A A . 4 GLY HA3 1 1 10 2360 1 1 4 GLY N N -3.913 -3.949 -3.474 1.00 . A A . 4 GLY N 1 1 10 2361 1 1 4 GLY O O -2.507 -6.688 -3.123 1.00 . A A . 4 GLY O 1 1 10 2362 1 1 5 TRP C C -3.669 -8.402 0.170 1.00 . A A . 5 TRP C 1 1 10 2363 1 1 5 TRP CA C -2.874 -7.250 -0.435 1.00 . A A . 5 TRP CA 1 1 10 2364 1 1 5 TRP CB C -2.221 -6.426 0.675 1.00 . A A . 5 TRP CB 1 1 10 2365 1 1 5 TRP CD1 C -0.546 -4.494 0.501 1.00 . A A . 5 TRP CD1 1 1 10 2366 1 1 5 TRP CD2 C 0.130 -6.390 -0.480 1.00 . A A . 5 TRP CD2 1 1 10 2367 1 1 5 TRP CE2 C 1.133 -5.415 -0.647 1.00 . A A . 5 TRP CE2 1 1 10 2368 1 1 5 TRP CE3 C 0.336 -7.665 -1.014 1.00 . A A . 5 TRP CE3 1 1 10 2369 1 1 5 TRP CG C -0.935 -5.780 0.257 1.00 . A A . 5 TRP CG 1 1 10 2370 1 1 5 TRP CH2 C 2.495 -6.933 -1.838 1.00 . A A . 5 TRP CH2 1 1 10 2371 1 1 5 TRP CZ2 C 2.320 -5.677 -1.325 1.00 . A A . 5 TRP CZ2 1 1 10 2372 1 1 5 TRP CZ3 C 1.514 -7.923 -1.688 1.00 . A A . 5 TRP CZ3 1 1 10 2373 1 1 5 TRP H H -4.516 -5.979 -0.851 1.00 . A A . 5 TRP H 1 1 10 2374 1 1 5 TRP HA H -2.102 -7.656 -1.072 1.00 . A A . 5 TRP HA 1 1 10 2375 1 1 5 TRP HB2 H -2.901 -5.646 0.984 1.00 . A A . 5 TRP HB2 1 1 10 2376 1 1 5 TRP HB3 H -2.013 -7.071 1.517 1.00 . A A . 5 TRP HB3 1 1 10 2377 1 1 5 TRP HD1 H -1.140 -3.772 1.040 1.00 . A A . 5 TRP HD1 1 1 10 2378 1 1 5 TRP HE1 H 1.190 -3.421 0.004 1.00 . A A . 5 TRP HE1 1 1 10 2379 1 1 5 TRP HE3 H -0.408 -8.441 -0.909 1.00 . A A . 5 TRP HE3 1 1 10 2380 1 1 5 TRP HH2 H 3.400 -7.180 -2.372 1.00 . A A . 5 TRP HH2 1 1 10 2381 1 1 5 TRP HZ2 H 3.086 -4.925 -1.449 1.00 . A A . 5 TRP HZ2 1 1 10 2382 1 1 5 TRP HZ3 H 1.690 -8.903 -2.108 1.00 . A A . 5 TRP HZ3 1 1 10 2383 1 1 5 TRP N N -3.731 -6.403 -1.257 1.00 . A A . 5 TRP N 1 1 10 2384 1 1 5 TRP NE1 N 0.696 -4.267 -0.040 1.00 . A A . 5 TRP NE1 1 1 10 2385 1 1 5 TRP O O -3.637 -9.525 -0.334 1.00 . A A . 5 TRP O 1 1 10 2386 1 1 6 LYS C C -5.658 -10.195 0.944 1.00 . A A . 6 LYS C 1 1 10 2387 1 1 6 LYS CA C -5.187 -9.130 1.929 1.00 . A A . 6 LYS CA 1 1 10 2388 1 1 6 LYS CB C -6.394 -8.481 2.610 1.00 . A A . 6 LYS CB 1 1 10 2389 1 1 6 LYS CD C -8.280 -6.873 2.200 1.00 . A A . 6 LYS CD 1 1 10 2390 1 1 6 LYS CE C -8.630 -6.809 3.679 1.00 . A A . 6 LYS CE 1 1 10 2391 1 1 6 LYS CG C -6.802 -7.155 1.990 1.00 . A A . 6 LYS CG 1 1 10 2392 1 1 6 LYS H H -4.368 -7.204 1.610 1.00 . A A . 6 LYS H 1 1 10 2393 1 1 6 LYS HA H -4.570 -9.599 2.680 1.00 . A A . 6 LYS HA 1 1 10 2394 1 1 6 LYS HB2 H -7.234 -9.157 2.548 1.00 . A A . 6 LYS HB2 1 1 10 2395 1 1 6 LYS HB3 H -6.156 -8.310 3.650 1.00 . A A . 6 LYS HB3 1 1 10 2396 1 1 6 LYS HD2 H -8.526 -5.926 1.743 1.00 . A A . 6 LYS HD2 1 1 10 2397 1 1 6 LYS HD3 H -8.858 -7.660 1.736 1.00 . A A . 6 LYS HD3 1 1 10 2398 1 1 6 LYS HE2 H -8.882 -7.801 4.019 1.00 . A A . 6 LYS HE2 1 1 10 2399 1 1 6 LYS HE3 H -7.770 -6.449 4.224 1.00 . A A . 6 LYS HE3 1 1 10 2400 1 1 6 LYS HG2 H -6.227 -6.363 2.445 1.00 . A A . 6 LYS HG2 1 1 10 2401 1 1 6 LYS HG3 H -6.598 -7.186 0.929 1.00 . A A . 6 LYS HG3 1 1 10 2402 1 1 6 LYS HZ1 H -9.548 -5.237 4.703 1.00 . A A . 6 LYS HZ1 1 1 10 2403 1 1 6 LYS HZ2 H -10.617 -6.454 4.217 1.00 . A A . 6 LYS HZ2 1 1 10 2404 1 1 6 LYS HZ3 H -10.009 -5.359 3.080 1.00 . A A . 6 LYS HZ3 1 1 10 2405 1 1 6 LYS N N -4.382 -8.118 1.255 1.00 . A A . 6 LYS N 1 1 10 2406 1 1 6 LYS NZ N -9.782 -5.901 3.938 1.00 . A A . 6 LYS NZ 1 1 10 2407 1 1 6 LYS O O -5.379 -11.382 1.119 1.00 . A A . 6 LYS O 1 1 10 2408 1 1 7 ARG C C -5.769 -11.109 -2.058 1.00 . A A . 7 ARG C 1 1 10 2409 1 1 7 ARG CA C -6.880 -10.681 -1.104 1.00 . A A . 7 ARG CA 1 1 10 2410 1 1 7 ARG CB C -8.018 -10.027 -1.890 1.00 . A A . 7 ARG CB 1 1 10 2411 1 1 7 ARG CD C -10.185 -9.071 -1.051 1.00 . A A . 7 ARG CD 1 1 10 2412 1 1 7 ARG CG C -9.399 -10.340 -1.338 1.00 . A A . 7 ARG CG 1 1 10 2413 1 1 7 ARG CZ C -12.307 -9.901 -0.130 1.00 . A A . 7 ARG CZ 1 1 10 2414 1 1 7 ARG H H -6.561 -8.806 -0.176 1.00 . A A . 7 ARG H 1 1 10 2415 1 1 7 ARG HA H -7.261 -11.556 -0.598 1.00 . A A . 7 ARG HA 1 1 10 2416 1 1 7 ARG HB2 H -7.882 -8.955 -1.873 1.00 . A A . 7 ARG HB2 1 1 10 2417 1 1 7 ARG HB3 H -7.976 -10.370 -2.913 1.00 . A A . 7 ARG HB3 1 1 10 2418 1 1 7 ARG HD2 H -9.494 -8.291 -0.767 1.00 . A A . 7 ARG HD2 1 1 10 2419 1 1 7 ARG HD3 H -10.709 -8.777 -1.949 1.00 . A A . 7 ARG HD3 1 1 10 2420 1 1 7 ARG HE H -10.936 -8.887 0.904 1.00 . A A . 7 ARG HE 1 1 10 2421 1 1 7 ARG HG2 H -9.940 -10.930 -2.062 1.00 . A A . 7 ARG HG2 1 1 10 2422 1 1 7 ARG HG3 H -9.291 -10.902 -0.422 1.00 . A A . 7 ARG HG3 1 1 10 2423 1 1 7 ARG HH11 H -12.007 -10.319 -2.083 1.00 . A A . 7 ARG HH11 1 1 10 2424 1 1 7 ARG HH12 H -13.499 -10.900 -1.421 1.00 . A A . 7 ARG HH12 1 1 10 2425 1 1 7 ARG HH21 H -12.897 -9.646 1.787 1.00 . A A . 7 ARG HH21 1 1 10 2426 1 1 7 ARG HH22 H -14.005 -10.515 0.780 1.00 . A A . 7 ARG HH22 1 1 10 2427 1 1 7 ARG N N -6.371 -9.764 -0.091 1.00 . A A . 7 ARG N 1 1 10 2428 1 1 7 ARG NE N -11.155 -9.259 0.024 1.00 . A A . 7 ARG NE 1 1 10 2429 1 1 7 ARG NH1 N -12.632 -10.415 -1.308 1.00 . A A . 7 ARG NH1 1 1 10 2430 1 1 7 ARG NH2 N -13.138 -10.032 0.897 1.00 . A A . 7 ARG NH2 1 1 10 2431 1 1 7 ARG O O -5.268 -12.231 -1.981 1.00 . A A . 7 ARG O 1 1 10 2432 1 1 8 LYS C C -2.960 -10.424 -3.269 1.00 . A A . 8 LYS C 1 1 10 2433 1 1 8 LYS CA C -4.335 -10.490 -3.925 1.00 . A A . 8 LYS CA 1 1 10 2434 1 1 8 LYS CB C -4.405 -9.498 -5.088 1.00 . A A . 8 LYS CB 1 1 10 2435 1 1 8 LYS CD C -5.052 -10.732 -7.178 1.00 . A A . 8 LYS CD 1 1 10 2436 1 1 8 LYS CE C -6.057 -11.847 -7.426 1.00 . A A . 8 LYS CE 1 1 10 2437 1 1 8 LYS CG C -5.519 -9.796 -6.076 1.00 . A A . 8 LYS CG 1 1 10 2438 1 1 8 LYS H H -5.825 -9.330 -2.967 1.00 . A A . 8 LYS H 1 1 10 2439 1 1 8 LYS HA H -4.493 -11.488 -4.305 1.00 . A A . 8 LYS HA 1 1 10 2440 1 1 8 LYS HB2 H -4.560 -8.506 -4.690 1.00 . A A . 8 LYS HB2 1 1 10 2441 1 1 8 LYS HB3 H -3.465 -9.519 -5.621 1.00 . A A . 8 LYS HB3 1 1 10 2442 1 1 8 LYS HD2 H -4.926 -10.167 -8.090 1.00 . A A . 8 LYS HD2 1 1 10 2443 1 1 8 LYS HD3 H -4.106 -11.169 -6.890 1.00 . A A . 8 LYS HD3 1 1 10 2444 1 1 8 LYS HE2 H -5.925 -12.607 -6.671 1.00 . A A . 8 LYS HE2 1 1 10 2445 1 1 8 LYS HE3 H -7.053 -11.437 -7.354 1.00 . A A . 8 LYS HE3 1 1 10 2446 1 1 8 LYS HG2 H -6.341 -10.259 -5.550 1.00 . A A . 8 LYS HG2 1 1 10 2447 1 1 8 LYS HG3 H -5.851 -8.868 -6.521 1.00 . A A . 8 LYS HG3 1 1 10 2448 1 1 8 LYS HZ1 H -6.345 -13.394 -8.799 1.00 . A A . 8 LYS HZ1 1 1 10 2449 1 1 8 LYS HZ2 H -4.870 -12.585 -8.978 1.00 . A A . 8 LYS HZ2 1 1 10 2450 1 1 8 LYS HZ3 H -6.303 -11.854 -9.500 1.00 . A A . 8 LYS HZ3 1 1 10 2451 1 1 8 LYS N N -5.387 -10.208 -2.956 1.00 . A A . 8 LYS N 1 1 10 2452 1 1 8 LYS NZ N -5.881 -12.463 -8.770 1.00 . A A . 8 LYS NZ 1 1 10 2453 1 1 8 LYS O O -2.562 -9.385 -2.740 1.00 . A A . 8 LYS O 1 1 10 2454 1 1 9 CYS C C 0.141 -11.943 -3.774 1.00 . A A . 9 CYS C 1 1 10 2455 1 1 9 CYS CA C -0.905 -11.607 -2.717 1.00 . A A . 9 CYS CA 1 1 10 2456 1 1 9 CYS CB C -0.873 -12.652 -1.600 1.00 . A A . 9 CYS CB 1 1 10 2457 1 1 9 CYS H H -2.608 -12.335 -3.743 1.00 . A A . 9 CYS H 1 1 10 2458 1 1 9 CYS HA H -0.679 -10.638 -2.299 1.00 . A A . 9 CYS HA 1 1 10 2459 1 1 9 CYS HB2 H 0.152 -12.822 -1.306 1.00 . A A . 9 CYS HB2 1 1 10 2460 1 1 9 CYS HB3 H -1.426 -12.277 -0.752 1.00 . A A . 9 CYS HB3 1 1 10 2461 1 1 9 CYS HG H -1.375 -15.093 -1.064 1.00 . A A . 9 CYS HG 1 1 10 2462 1 1 9 CYS N N -2.237 -11.539 -3.308 1.00 . A A . 9 CYS N 1 1 10 2463 1 1 9 CYS O O 0.654 -13.060 -3.843 1.00 . A A . 9 CYS O 1 1 10 2464 1 1 9 CYS SG S -1.584 -14.248 -2.062 1.00 . A A . 9 CYS SG 1 1 10 2465 1 1 10 PRO C C 2.875 -11.260 -5.152 1.00 . A A . 10 PRO C 1 1 10 2466 1 1 10 PRO CA C 1.455 -11.121 -5.690 1.00 . A A . 10 PRO CA 1 1 10 2467 1 1 10 PRO CB C 1.316 -9.832 -6.505 1.00 . A A . 10 PRO CB 1 1 10 2468 1 1 10 PRO CD C -0.104 -9.597 -4.596 1.00 . A A . 10 PRO CD 1 1 10 2469 1 1 10 PRO CG C 0.780 -8.831 -5.541 1.00 . A A . 10 PRO CG 1 1 10 2470 1 1 10 PRO HA H 1.223 -11.971 -6.315 1.00 . A A . 10 PRO HA 1 1 10 2471 1 1 10 PRO HB2 H 2.284 -9.538 -6.885 1.00 . A A . 10 PRO HB2 1 1 10 2472 1 1 10 PRO HB3 H 0.634 -9.993 -7.326 1.00 . A A . 10 PRO HB3 1 1 10 2473 1 1 10 PRO HD2 H -0.051 -9.174 -3.604 1.00 . A A . 10 PRO HD2 1 1 10 2474 1 1 10 PRO HD3 H -1.123 -9.602 -4.953 1.00 . A A . 10 PRO HD3 1 1 10 2475 1 1 10 PRO HG2 H 1.593 -8.368 -5.002 1.00 . A A . 10 PRO HG2 1 1 10 2476 1 1 10 PRO HG3 H 0.205 -8.084 -6.069 1.00 . A A . 10 PRO HG3 1 1 10 2477 1 1 10 PRO N N 0.467 -10.954 -4.620 1.00 . A A . 10 PRO N 1 1 10 2478 1 1 10 PRO O O 3.630 -12.132 -5.584 1.00 . A A . 10 PRO O 1 1 10 2479 1 1 11 LEU C C 4.485 -10.775 -2.126 1.00 . A A . 11 LEU C 1 1 10 2480 1 1 11 LEU CA C 4.562 -10.425 -3.609 1.00 . A A . 11 LEU CA 1 1 10 2481 1 1 11 LEU CB C 5.252 -9.072 -3.790 1.00 . A A . 11 LEU CB 1 1 10 2482 1 1 11 LEU CD1 C 5.051 -6.626 -4.301 1.00 . A A . 11 LEU CD1 1 1 10 2483 1 1 11 LEU CD2 C 4.397 -8.319 -6.023 1.00 . A A . 11 LEU CD2 1 1 10 2484 1 1 11 LEU CG C 4.451 -8.004 -4.535 1.00 . A A . 11 LEU CG 1 1 10 2485 1 1 11 LEU H H 2.586 -9.726 -3.904 1.00 . A A . 11 LEU H 1 1 10 2486 1 1 11 LEU HA H 5.138 -11.185 -4.117 1.00 . A A . 11 LEU HA 1 1 10 2487 1 1 11 LEU HB2 H 5.485 -8.686 -2.810 1.00 . A A . 11 LEU HB2 1 1 10 2488 1 1 11 LEU HB3 H 6.169 -9.240 -4.336 1.00 . A A . 11 LEU HB3 1 1 10 2489 1 1 11 LEU HD11 H 4.483 -6.110 -3.542 1.00 . A A . 11 LEU HD11 1 1 10 2490 1 1 11 LEU HD12 H 5.021 -6.060 -5.221 1.00 . A A . 11 LEU HD12 1 1 10 2491 1 1 11 LEU HD13 H 6.076 -6.731 -3.977 1.00 . A A . 11 LEU HD13 1 1 10 2492 1 1 11 LEU HD21 H 4.494 -9.385 -6.169 1.00 . A A . 11 LEU HD21 1 1 10 2493 1 1 11 LEU HD22 H 5.206 -7.812 -6.528 1.00 . A A . 11 LEU HD22 1 1 10 2494 1 1 11 LEU HD23 H 3.453 -7.984 -6.428 1.00 . A A . 11 LEU HD23 1 1 10 2495 1 1 11 LEU HG H 3.437 -7.995 -4.157 1.00 . A A . 11 LEU HG 1 1 10 2496 1 1 11 LEU N N 3.232 -10.398 -4.207 1.00 . A A . 11 LEU N 1 1 10 2497 1 1 11 LEU O O 4.757 -11.909 -1.731 1.00 . A A . 11 LEU O 1 1 10 2498 1 1 12 PHE C C 2.586 -9.678 0.613 1.00 . A A . 12 PHE C 1 1 10 2499 1 1 12 PHE CA C 3.997 -10.000 0.129 1.00 . A A . 12 PHE CA 1 1 10 2500 1 1 12 PHE CB C 5.014 -9.131 0.871 1.00 . A A . 12 PHE CB 1 1 10 2501 1 1 12 PHE CD1 C 5.057 -6.842 -0.157 1.00 . A A . 12 PHE CD1 1 1 10 2502 1 1 12 PHE CD2 C 6.847 -8.337 -0.648 1.00 . A A . 12 PHE CD2 1 1 10 2503 1 1 12 PHE CE1 C 5.641 -5.875 -0.953 1.00 . A A . 12 PHE CE1 1 1 10 2504 1 1 12 PHE CE2 C 7.437 -7.374 -1.445 1.00 . A A . 12 PHE CE2 1 1 10 2505 1 1 12 PHE CG C 5.652 -8.082 0.005 1.00 . A A . 12 PHE CG 1 1 10 2506 1 1 12 PHE CZ C 6.832 -6.142 -1.598 1.00 . A A . 12 PHE CZ 1 1 10 2507 1 1 12 PHE H H 3.908 -8.912 -1.686 1.00 . A A . 12 PHE H 1 1 10 2508 1 1 12 PHE HA H 4.207 -11.038 0.332 1.00 . A A . 12 PHE HA 1 1 10 2509 1 1 12 PHE HB2 H 4.519 -8.629 1.689 1.00 . A A . 12 PHE HB2 1 1 10 2510 1 1 12 PHE HB3 H 5.798 -9.761 1.262 1.00 . A A . 12 PHE HB3 1 1 10 2511 1 1 12 PHE HD1 H 4.124 -6.632 0.348 1.00 . A A . 12 PHE HD1 1 1 10 2512 1 1 12 PHE HD2 H 7.321 -9.301 -0.530 1.00 . A A . 12 PHE HD2 1 1 10 2513 1 1 12 PHE HE1 H 5.166 -4.912 -1.070 1.00 . A A . 12 PHE HE1 1 1 10 2514 1 1 12 PHE HE2 H 8.368 -7.586 -1.949 1.00 . A A . 12 PHE HE2 1 1 10 2515 1 1 12 PHE HZ H 7.291 -5.387 -2.220 1.00 . A A . 12 PHE HZ 1 1 10 2516 1 1 12 PHE N N 4.111 -9.795 -1.311 1.00 . A A . 12 PHE N 1 1 10 2517 1 1 12 PHE O O 2.300 -8.554 1.022 1.00 . A A . 12 PHE O 1 1 10 2518 1 1 13 GLY C C 0.172 -10.671 2.494 1.00 . A A . 13 GLY C 1 1 10 2519 1 1 13 GLY CA C 0.338 -10.479 1.000 1.00 . A A . 13 GLY CA 1 1 10 2520 1 1 13 GLY H H 1.993 -11.551 0.228 1.00 . A A . 13 GLY H 1 1 10 2521 1 1 13 GLY HA2 H 0.029 -9.478 0.739 1.00 . A A . 13 GLY HA2 1 1 10 2522 1 1 13 GLY HA3 H -0.296 -11.186 0.485 1.00 . A A . 13 GLY HA3 1 1 10 2523 1 1 13 GLY N N 1.708 -10.675 0.564 1.00 . A A . 13 GLY N 1 1 10 2524 1 1 13 GLY O O -0.904 -10.433 3.043 1.00 . A A . 13 GLY O 1 1 10 2525 1 1 14 LYS C C 1.482 -10.035 5.355 1.00 . A A . 14 LYS C 1 1 10 2526 1 1 14 LYS CA C 1.209 -11.329 4.596 1.00 . A A . 14 LYS CA 1 1 10 2527 1 1 14 LYS CB C 2.239 -12.391 4.989 1.00 . A A . 14 LYS CB 1 1 10 2528 1 1 14 LYS CD C 4.398 -11.396 5.802 1.00 . A A . 14 LYS CD 1 1 10 2529 1 1 14 LYS CE C 5.530 -10.491 5.340 1.00 . A A . 14 LYS CE 1 1 10 2530 1 1 14 LYS CG C 3.666 -12.018 4.625 1.00 . A A . 14 LYS CG 1 1 10 2531 1 1 14 LYS H H 2.070 -11.276 2.663 1.00 . A A . 14 LYS H 1 1 10 2532 1 1 14 LYS HA H 0.223 -11.684 4.855 1.00 . A A . 14 LYS HA 1 1 10 2533 1 1 14 LYS HB2 H 2.191 -12.544 6.057 1.00 . A A . 14 LYS HB2 1 1 10 2534 1 1 14 LYS HB3 H 1.993 -13.317 4.490 1.00 . A A . 14 LYS HB3 1 1 10 2535 1 1 14 LYS HD2 H 3.699 -10.811 6.381 1.00 . A A . 14 LYS HD2 1 1 10 2536 1 1 14 LYS HD3 H 4.807 -12.184 6.417 1.00 . A A . 14 LYS HD3 1 1 10 2537 1 1 14 LYS HE2 H 6.348 -11.106 4.999 1.00 . A A . 14 LYS HE2 1 1 10 2538 1 1 14 LYS HE3 H 5.174 -9.881 4.523 1.00 . A A . 14 LYS HE3 1 1 10 2539 1 1 14 LYS HG2 H 4.193 -12.908 4.316 1.00 . A A . 14 LYS HG2 1 1 10 2540 1 1 14 LYS HG3 H 3.645 -11.308 3.809 1.00 . A A . 14 LYS HG3 1 1 10 2541 1 1 14 LYS HZ1 H 5.207 -9.255 6.992 1.00 . A A . 14 LYS HZ1 1 1 10 2542 1 1 14 LYS HZ2 H 6.521 -8.789 6.035 1.00 . A A . 14 LYS HZ2 1 1 10 2543 1 1 14 LYS HZ3 H 6.656 -10.127 7.061 1.00 . A A . 14 LYS HZ3 1 1 10 2544 1 1 14 LYS N N 1.240 -11.104 3.156 1.00 . A A . 14 LYS N 1 1 10 2545 1 1 14 LYS NZ N 6.013 -9.604 6.433 1.00 . A A . 14 LYS NZ 1 1 10 2546 1 1 14 LYS O O 0.854 -9.759 6.376 1.00 . A A . 14 LYS O 1 1 10 2547 1 1 15 GLY C C 2.370 -6.784 4.653 1.00 . A A . 15 GLY C 1 1 10 2548 1 1 15 GLY CA C 2.760 -7.986 5.490 1.00 . A A . 15 GLY CA 1 1 10 2549 1 1 15 GLY H H 2.889 -9.515 4.030 1.00 . A A . 15 GLY H 1 1 10 2550 1 1 15 GLY HA2 H 2.249 -7.932 6.440 1.00 . A A . 15 GLY HA2 1 1 10 2551 1 1 15 GLY HA3 H 3.825 -7.959 5.663 1.00 . A A . 15 GLY HA3 1 1 10 2552 1 1 15 GLY N N 2.422 -9.243 4.847 1.00 . A A . 15 GLY N 1 1 10 2553 1 1 15 GLY O O 3.045 -5.756 4.678 1.00 . A A . 15 GLY O 1 1 10 2554 1 1 16 GLY C C 0.724 -4.510 3.822 1.00 . A A . 16 GLY C 1 1 10 2555 1 1 16 GLY CA C 0.818 -5.822 3.068 1.00 . A A . 16 GLY CA 1 1 10 2556 1 1 16 GLY H H 0.777 -7.757 3.927 1.00 . A A . 16 GLY H 1 1 10 2557 1 1 16 GLY HA2 H 1.504 -5.703 2.243 1.00 . A A . 16 GLY HA2 1 1 10 2558 1 1 16 GLY HA3 H -0.159 -6.069 2.677 1.00 . A A . 16 GLY HA3 1 1 10 2559 1 1 16 GLY N N 1.276 -6.913 3.907 1.00 . A A . 16 GLY N 1 1 10 2560 1 1 16 GLY O O -0.344 -4.144 4.313 1.00 . A A . 16 GLY O 1 1 11 2561 1 1 1 VAL C C 1.438 -0.560 -2.651 1.00 . A A . 1 VAL C 1 1 11 2562 1 1 1 VAL CA C 2.290 0.080 -1.561 1.00 . A A . 1 VAL CA 1 1 11 2563 1 1 1 VAL CB C 3.641 -0.656 -1.482 1.00 . A A . 1 VAL CB 1 1 11 2564 1 1 1 VAL CG1 C 3.444 -2.083 -0.996 1.00 . A A . 1 VAL CG1 1 1 11 2565 1 1 1 VAL CG2 C 4.337 -0.636 -2.834 1.00 . A A . 1 VAL CG2 1 1 11 2566 1 1 1 VAL H1 H 0.638 0.244 -0.248 1.00 . A A . 1 VAL H1 1 1 11 2567 1 1 1 VAL HA H 2.480 1.110 -1.824 1.00 . A A . 1 VAL HA 1 1 11 2568 1 1 1 VAL HB H 4.268 -0.140 -0.770 1.00 . A A . 1 VAL HB 1 1 11 2569 1 1 1 VAL HG11 H 4.400 -2.585 -0.957 1.00 . A A . 1 VAL HG11 1 1 11 2570 1 1 1 VAL HG12 H 3.003 -2.071 -0.010 1.00 . A A . 1 VAL HG12 1 1 11 2571 1 1 1 VAL HG13 H 2.791 -2.609 -1.677 1.00 . A A . 1 VAL HG13 1 1 11 2572 1 1 1 VAL HG21 H 5.398 -0.491 -2.690 1.00 . A A . 1 VAL HG21 1 1 11 2573 1 1 1 VAL HG22 H 4.168 -1.575 -3.341 1.00 . A A . 1 VAL HG22 1 1 11 2574 1 1 1 VAL HG23 H 3.941 0.171 -3.432 1.00 . A A . 1 VAL HG23 1 1 11 2575 1 1 1 VAL N N 1.600 0.062 -0.276 1.00 . A A . 1 VAL N 1 1 11 2576 1 1 1 VAL O O 1.473 -0.140 -3.807 1.00 . A A . 1 VAL O 1 1 11 2577 1 1 2 ALA C C -1.642 -2.261 -2.751 1.00 . A A . 2 ALA C 1 1 11 2578 1 1 2 ALA CA C -0.191 -2.277 -3.219 1.00 . A A . 2 ALA CA 1 1 11 2579 1 1 2 ALA CB C 0.288 -3.708 -3.415 1.00 . A A . 2 ALA CB 1 1 11 2580 1 1 2 ALA H H 0.689 -1.869 -1.338 1.00 . A A . 2 ALA H 1 1 11 2581 1 1 2 ALA HA H -0.124 -1.767 -4.170 1.00 . A A . 2 ALA HA 1 1 11 2582 1 1 2 ALA HB1 H 0.098 -4.013 -4.434 1.00 . A A . 2 ALA HB1 1 1 11 2583 1 1 2 ALA HB2 H 1.347 -3.764 -3.213 1.00 . A A . 2 ALA HB2 1 1 11 2584 1 1 2 ALA HB3 H -0.243 -4.360 -2.739 1.00 . A A . 2 ALA HB3 1 1 11 2585 1 1 2 ALA N N 0.673 -1.580 -2.274 1.00 . A A . 2 ALA N 1 1 11 2586 1 1 2 ALA O O -1.961 -2.759 -1.671 1.00 . A A . 2 ALA O 1 1 11 2587 1 1 3 ARG C C -4.483 -2.977 -2.858 1.00 . A A . 3 ARG C 1 1 11 2588 1 1 3 ARG CA C -3.934 -1.605 -3.238 1.00 . A A . 3 ARG CA 1 1 11 2589 1 1 3 ARG CB C -4.724 -1.037 -4.418 1.00 . A A . 3 ARG CB 1 1 11 2590 1 1 3 ARG CD C -3.661 -2.321 -6.299 1.00 . A A . 3 ARG CD 1 1 11 2591 1 1 3 ARG CG C -4.948 -2.038 -5.540 1.00 . A A . 3 ARG CG 1 1 11 2592 1 1 3 ARG CZ C -4.448 -3.650 -8.212 1.00 . A A . 3 ARG CZ 1 1 11 2593 1 1 3 ARG H H -2.202 -1.307 -4.417 1.00 . A A . 3 ARG H 1 1 11 2594 1 1 3 ARG HA H -4.040 -0.941 -2.393 1.00 . A A . 3 ARG HA 1 1 11 2595 1 1 3 ARG HB2 H -5.689 -0.704 -4.064 1.00 . A A . 3 ARG HB2 1 1 11 2596 1 1 3 ARG HB3 H -4.187 -0.191 -4.822 1.00 . A A . 3 ARG HB3 1 1 11 2597 1 1 3 ARG HD2 H -2.998 -1.477 -6.184 1.00 . A A . 3 ARG HD2 1 1 11 2598 1 1 3 ARG HD3 H -3.199 -3.202 -5.881 1.00 . A A . 3 ARG HD3 1 1 11 2599 1 1 3 ARG HE H -3.646 -1.829 -8.343 1.00 . A A . 3 ARG HE 1 1 11 2600 1 1 3 ARG HG2 H -5.314 -2.962 -5.117 1.00 . A A . 3 ARG HG2 1 1 11 2601 1 1 3 ARG HG3 H -5.680 -1.638 -6.225 1.00 . A A . 3 ARG HG3 1 1 11 2602 1 1 3 ARG HH11 H -4.668 -4.539 -6.411 1.00 . A A . 3 ARG HH11 1 1 11 2603 1 1 3 ARG HH12 H -5.219 -5.465 -7.767 1.00 . A A . 3 ARG HH12 1 1 11 2604 1 1 3 ARG HH21 H -4.368 -3.039 -10.137 1.00 . A A . 3 ARG HH21 1 1 11 2605 1 1 3 ARG HH22 H -5.047 -4.611 -9.886 1.00 . A A . 3 ARG HH22 1 1 11 2606 1 1 3 ARG N N -2.517 -1.687 -3.570 1.00 . A A . 3 ARG N 1 1 11 2607 1 1 3 ARG NE N -3.903 -2.542 -7.723 1.00 . A A . 3 ARG NE 1 1 11 2608 1 1 3 ARG NH1 N -4.807 -4.632 -7.396 1.00 . A A . 3 ARG NH1 1 1 11 2609 1 1 3 ARG NH2 N -4.637 -3.777 -9.519 1.00 . A A . 3 ARG NH2 1 1 11 2610 1 1 3 ARG O O -5.408 -3.086 -2.054 1.00 . A A . 3 ARG O 1 1 11 2611 1 1 4 GLY C C -3.299 -6.188 -2.430 1.00 . A A . 4 GLY C 1 1 11 2612 1 1 4 GLY CA C -4.352 -5.373 -3.154 1.00 . A A . 4 GLY CA 1 1 11 2613 1 1 4 GLY H H -3.174 -3.875 -4.077 1.00 . A A . 4 GLY H 1 1 11 2614 1 1 4 GLY HA2 H -5.240 -5.325 -2.541 1.00 . A A . 4 GLY HA2 1 1 11 2615 1 1 4 GLY HA3 H -4.595 -5.867 -4.084 1.00 . A A . 4 GLY HA3 1 1 11 2616 1 1 4 GLY N N -3.907 -4.023 -3.443 1.00 . A A . 4 GLY N 1 1 11 2617 1 1 4 GLY O O -2.343 -6.664 -3.042 1.00 . A A . 4 GLY O 1 1 11 2618 1 1 5 TRP C C -3.225 -8.270 0.389 1.00 . A A . 5 TRP C 1 1 11 2619 1 1 5 TRP CA C -2.529 -7.109 -0.314 1.00 . A A . 5 TRP CA 1 1 11 2620 1 1 5 TRP CB C -1.860 -6.200 0.719 1.00 . A A . 5 TRP CB 1 1 11 2621 1 1 5 TRP CD1 C -0.299 -4.198 0.364 1.00 . A A . 5 TRP CD1 1 1 11 2622 1 1 5 TRP CD2 C 0.418 -6.103 -0.572 1.00 . A A . 5 TRP CD2 1 1 11 2623 1 1 5 TRP CE2 C 1.359 -5.089 -0.838 1.00 . A A . 5 TRP CE2 1 1 11 2624 1 1 5 TRP CE3 C 0.658 -7.389 -1.061 1.00 . A A . 5 TRP CE3 1 1 11 2625 1 1 5 TRP CG C -0.634 -5.512 0.199 1.00 . A A . 5 TRP CG 1 1 11 2626 1 1 5 TRP CH2 C 2.727 -6.593 -2.040 1.00 . A A . 5 TRP CH2 1 1 11 2627 1 1 5 TRP CZ2 C 2.518 -5.324 -1.573 1.00 . A A . 5 TRP CZ2 1 1 11 2628 1 1 5 TRP CZ3 C 1.809 -7.621 -1.790 1.00 . A A . 5 TRP CZ3 1 1 11 2629 1 1 5 TRP H H -4.256 -5.944 -0.691 1.00 . A A . 5 TRP H 1 1 11 2630 1 1 5 TRP HA H -1.772 -7.506 -0.974 1.00 . A A . 5 TRP HA 1 1 11 2631 1 1 5 TRP HB2 H -2.563 -5.440 1.028 1.00 . A A . 5 TRP HB2 1 1 11 2632 1 1 5 TRP HB3 H -1.574 -6.791 1.576 1.00 . A A . 5 TRP HB3 1 1 11 2633 1 1 5 TRP HD1 H -0.898 -3.482 0.905 1.00 . A A . 5 TRP HD1 1 1 11 2634 1 1 5 TRP HE1 H 1.349 -3.067 -0.279 1.00 . A A . 5 TRP HE1 1 1 11 2635 1 1 5 TRP HE3 H -0.038 -8.195 -0.879 1.00 . A A . 5 TRP HE3 1 1 11 2636 1 1 5 TRP HH2 H 3.612 -6.819 -2.614 1.00 . A A . 5 TRP HH2 1 1 11 2637 1 1 5 TRP HZ2 H 3.236 -4.542 -1.773 1.00 . A A . 5 TRP HZ2 1 1 11 2638 1 1 5 TRP HZ3 H 2.011 -8.609 -2.177 1.00 . A A . 5 TRP HZ3 1 1 11 2639 1 1 5 TRP N N -3.473 -6.348 -1.123 1.00 . A A . 5 TRP N 1 1 11 2640 1 1 5 TRP NE1 N 0.898 -3.937 -0.257 1.00 . A A . 5 TRP NE1 1 1 11 2641 1 1 5 TRP O O -3.157 -9.413 -0.063 1.00 . A A . 5 TRP O 1 1 11 2642 1 1 6 LYS C C -5.096 -10.109 1.350 1.00 . A A . 6 LYS C 1 1 11 2643 1 1 6 LYS CA C -4.607 -8.987 2.260 1.00 . A A . 6 LYS CA 1 1 11 2644 1 1 6 LYS CB C -5.791 -8.363 3.001 1.00 . A A . 6 LYS CB 1 1 11 2645 1 1 6 LYS CD C -7.563 -6.583 3.042 1.00 . A A . 6 LYS CD 1 1 11 2646 1 1 6 LYS CE C -8.891 -7.324 2.998 1.00 . A A . 6 LYS CE 1 1 11 2647 1 1 6 LYS CG C -6.506 -7.284 2.206 1.00 . A A . 6 LYS CG 1 1 11 2648 1 1 6 LYS H H -3.913 -7.039 1.806 1.00 . A A . 6 LYS H 1 1 11 2649 1 1 6 LYS HA H -3.919 -9.401 2.982 1.00 . A A . 6 LYS HA 1 1 11 2650 1 1 6 LYS HB2 H -6.504 -9.140 3.235 1.00 . A A . 6 LYS HB2 1 1 11 2651 1 1 6 LYS HB3 H -5.434 -7.925 3.922 1.00 . A A . 6 LYS HB3 1 1 11 2652 1 1 6 LYS HD2 H -7.225 -6.534 4.067 1.00 . A A . 6 LYS HD2 1 1 11 2653 1 1 6 LYS HD3 H -7.706 -5.582 2.660 1.00 . A A . 6 LYS HD3 1 1 11 2654 1 1 6 LYS HE2 H -9.180 -7.456 1.967 1.00 . A A . 6 LYS HE2 1 1 11 2655 1 1 6 LYS HE3 H -8.764 -8.290 3.463 1.00 . A A . 6 LYS HE3 1 1 11 2656 1 1 6 LYS HG2 H -5.782 -6.555 1.875 1.00 . A A . 6 LYS HG2 1 1 11 2657 1 1 6 LYS HG3 H -6.981 -7.738 1.347 1.00 . A A . 6 LYS HG3 1 1 11 2658 1 1 6 LYS HZ1 H -10.861 -7.105 3.655 1.00 . A A . 6 LYS HZ1 1 1 11 2659 1 1 6 LYS HZ2 H -10.098 -5.643 3.280 1.00 . A A . 6 LYS HZ2 1 1 11 2660 1 1 6 LYS HZ3 H -9.710 -6.455 4.712 1.00 . A A . 6 LYS HZ3 1 1 11 2661 1 1 6 LYS N N -3.896 -7.969 1.496 1.00 . A A . 6 LYS N 1 1 11 2662 1 1 6 LYS NZ N -9.965 -6.579 3.711 1.00 . A A . 6 LYS NZ 1 1 11 2663 1 1 6 LYS O O -4.861 -11.287 1.618 1.00 . A A . 6 LYS O 1 1 11 2664 1 1 7 ARG C C -5.230 -11.106 -1.693 1.00 . A A . 7 ARG C 1 1 11 2665 1 1 7 ARG CA C -6.299 -10.709 -0.679 1.00 . A A . 7 ARG CA 1 1 11 2666 1 1 7 ARG CB C -7.520 -10.141 -1.405 1.00 . A A . 7 ARG CB 1 1 11 2667 1 1 7 ARG CD C -10.018 -9.867 -1.354 1.00 . A A . 7 ARG CD 1 1 11 2668 1 1 7 ARG CG C -8.753 -10.024 -0.525 1.00 . A A . 7 ARG CG 1 1 11 2669 1 1 7 ARG CZ C -12.330 -10.701 -1.312 1.00 . A A . 7 ARG CZ 1 1 11 2670 1 1 7 ARG H H -5.932 -8.780 0.111 1.00 . A A . 7 ARG H 1 1 11 2671 1 1 7 ARG HA H -6.597 -11.586 -0.125 1.00 . A A . 7 ARG HA 1 1 11 2672 1 1 7 ARG HB2 H -7.277 -9.157 -1.779 1.00 . A A . 7 ARG HB2 1 1 11 2673 1 1 7 ARG HB3 H -7.759 -10.784 -2.239 1.00 . A A . 7 ARG HB3 1 1 11 2674 1 1 7 ARG HD2 H -10.393 -8.862 -1.227 1.00 . A A . 7 ARG HD2 1 1 11 2675 1 1 7 ARG HD3 H -9.773 -10.031 -2.393 1.00 . A A . 7 ARG HD3 1 1 11 2676 1 1 7 ARG HE H -10.788 -11.571 -0.395 1.00 . A A . 7 ARG HE 1 1 11 2677 1 1 7 ARG HG2 H -8.840 -10.917 0.077 1.00 . A A . 7 ARG HG2 1 1 11 2678 1 1 7 ARG HG3 H -8.645 -9.163 0.118 1.00 . A A . 7 ARG HG3 1 1 11 2679 1 1 7 ARG HH11 H -12.057 -9.005 -2.376 1.00 . A A . 7 ARG HH11 1 1 11 2680 1 1 7 ARG HH12 H -13.682 -9.604 -2.339 1.00 . A A . 7 ARG HH12 1 1 11 2681 1 1 7 ARG HH21 H -12.924 -12.370 -0.338 1.00 . A A . 7 ARG HH21 1 1 11 2682 1 1 7 ARG HH22 H -14.174 -11.517 -1.178 1.00 . A A . 7 ARG HH22 1 1 11 2683 1 1 7 ARG N N -5.777 -9.734 0.271 1.00 . A A . 7 ARG N 1 1 11 2684 1 1 7 ARG NE N -11.055 -10.814 -0.956 1.00 . A A . 7 ARG NE 1 1 11 2685 1 1 7 ARG NH1 N -12.722 -9.686 -2.071 1.00 . A A . 7 ARG NH1 1 1 11 2686 1 1 7 ARG NH2 N -13.215 -11.603 -0.910 1.00 . A A . 7 ARG NH2 1 1 11 2687 1 1 7 ARG O O -4.681 -12.206 -1.633 1.00 . A A . 7 ARG O 1 1 11 2688 1 1 8 LYS C C -2.529 -10.355 -3.074 1.00 . A A . 8 LYS C 1 1 11 2689 1 1 8 LYS CA C -3.938 -10.459 -3.651 1.00 . A A . 8 LYS CA 1 1 11 2690 1 1 8 LYS CB C -4.100 -9.470 -4.808 1.00 . A A . 8 LYS CB 1 1 11 2691 1 1 8 LYS CD C -5.357 -9.536 -6.982 1.00 . A A . 8 LYS CD 1 1 11 2692 1 1 8 LYS CE C -4.825 -10.867 -7.491 1.00 . A A . 8 LYS CE 1 1 11 2693 1 1 8 LYS CG C -5.468 -9.524 -5.467 1.00 . A A . 8 LYS CG 1 1 11 2694 1 1 8 LYS H H -5.413 -9.345 -2.620 1.00 . A A . 8 LYS H 1 1 11 2695 1 1 8 LYS HA H -4.089 -11.461 -4.022 1.00 . A A . 8 LYS HA 1 1 11 2696 1 1 8 LYS HB2 H -3.942 -8.469 -4.435 1.00 . A A . 8 LYS HB2 1 1 11 2697 1 1 8 LYS HB3 H -3.354 -9.688 -5.559 1.00 . A A . 8 LYS HB3 1 1 11 2698 1 1 8 LYS HD2 H -6.335 -9.366 -7.407 1.00 . A A . 8 LYS HD2 1 1 11 2699 1 1 8 LYS HD3 H -4.685 -8.748 -7.292 1.00 . A A . 8 LYS HD3 1 1 11 2700 1 1 8 LYS HE2 H -3.962 -11.143 -6.905 1.00 . A A . 8 LYS HE2 1 1 11 2701 1 1 8 LYS HE3 H -5.594 -11.616 -7.373 1.00 . A A . 8 LYS HE3 1 1 11 2702 1 1 8 LYS HG2 H -5.977 -10.421 -5.146 1.00 . A A . 8 LYS HG2 1 1 11 2703 1 1 8 LYS HG3 H -6.037 -8.657 -5.163 1.00 . A A . 8 LYS HG3 1 1 11 2704 1 1 8 LYS HZ1 H -5.254 -10.526 -9.507 1.00 . A A . 8 LYS HZ1 1 1 11 2705 1 1 8 LYS HZ2 H -4.085 -11.721 -9.248 1.00 . A A . 8 LYS HZ2 1 1 11 2706 1 1 8 LYS HZ3 H -3.682 -10.089 -9.057 1.00 . A A . 8 LYS HZ3 1 1 11 2707 1 1 8 LYS N N -4.941 -10.204 -2.624 1.00 . A A . 8 LYS N 1 1 11 2708 1 1 8 LYS NZ N -4.434 -10.796 -8.926 1.00 . A A . 8 LYS NZ 1 1 11 2709 1 1 8 LYS O O -2.104 -9.285 -2.639 1.00 . A A . 8 LYS O 1 1 11 2710 1 1 9 CYS C C 0.553 -11.791 -3.665 1.00 . A A . 9 CYS C 1 1 11 2711 1 1 9 CYS CA C -0.450 -11.507 -2.552 1.00 . A A . 9 CYS CA 1 1 11 2712 1 1 9 CYS CB C -0.329 -12.568 -1.457 1.00 . A A . 9 CYS CB 1 1 11 2713 1 1 9 CYS H H -2.205 -12.295 -3.435 1.00 . A A . 9 CYS H 1 1 11 2714 1 1 9 CYS HA H -0.234 -10.538 -2.128 1.00 . A A . 9 CYS HA 1 1 11 2715 1 1 9 CYS HB2 H -0.345 -13.548 -1.912 1.00 . A A . 9 CYS HB2 1 1 11 2716 1 1 9 CYS HB3 H 0.609 -12.435 -0.939 1.00 . A A . 9 CYS HB3 1 1 11 2717 1 1 9 CYS HG H -1.857 -13.748 0.208 1.00 . A A . 9 CYS HG 1 1 11 2718 1 1 9 CYS N N -1.811 -11.473 -3.075 1.00 . A A . 9 CYS N 1 1 11 2719 1 1 9 CYS O O 1.118 -12.880 -3.762 1.00 . A A . 9 CYS O 1 1 11 2720 1 1 9 CYS SG S -1.653 -12.514 -0.226 1.00 . A A . 9 CYS SG 1 1 11 2721 1 1 10 PRO C C 3.168 -10.971 -5.190 1.00 . A A . 10 PRO C 1 1 11 2722 1 1 10 PRO CA C 1.715 -10.906 -5.650 1.00 . A A . 10 PRO CA 1 1 11 2723 1 1 10 PRO CB C 1.465 -9.629 -6.455 1.00 . A A . 10 PRO CB 1 1 11 2724 1 1 10 PRO CD C 0.142 -9.462 -4.471 1.00 . A A . 10 PRO CD 1 1 11 2725 1 1 10 PRO CG C 0.932 -8.654 -5.463 1.00 . A A . 10 PRO CG 1 1 11 2726 1 1 10 PRO HA H 1.494 -11.769 -6.262 1.00 . A A . 10 PRO HA 1 1 11 2727 1 1 10 PRO HB2 H 2.395 -9.285 -6.887 1.00 . A A . 10 PRO HB2 1 1 11 2728 1 1 10 PRO HB3 H 0.749 -9.827 -7.238 1.00 . A A . 10 PRO HB3 1 1 11 2729 1 1 10 PRO HD2 H 0.227 -9.035 -3.483 1.00 . A A . 10 PRO HD2 1 1 11 2730 1 1 10 PRO HD3 H -0.894 -9.521 -4.771 1.00 . A A . 10 PRO HD3 1 1 11 2731 1 1 10 PRO HG2 H 1.748 -8.148 -4.969 1.00 . A A . 10 PRO HG2 1 1 11 2732 1 1 10 PRO HG3 H 0.291 -7.940 -5.958 1.00 . A A . 10 PRO HG3 1 1 11 2733 1 1 10 PRO N N 0.780 -10.788 -4.527 1.00 . A A . 10 PRO N 1 1 11 2734 1 1 10 PRO O O 3.944 -11.801 -5.666 1.00 . A A . 10 PRO O 1 1 11 2735 1 1 11 LEU C C 4.905 -10.332 -2.240 1.00 . A A . 11 LEU C 1 1 11 2736 1 1 11 LEU CA C 4.890 -10.048 -3.739 1.00 . A A . 11 LEU CA 1 1 11 2737 1 1 11 LEU CB C 5.523 -8.684 -4.017 1.00 . A A . 11 LEU CB 1 1 11 2738 1 1 11 LEU CD1 C 5.191 -6.269 -4.603 1.00 . A A . 11 LEU CD1 1 1 11 2739 1 1 11 LEU CD2 C 4.564 -8.049 -6.245 1.00 . A A . 11 LEU CD2 1 1 11 2740 1 1 11 LEU CG C 4.649 -7.680 -4.771 1.00 . A A . 11 LEU CG 1 1 11 2741 1 1 11 LEU H H 2.867 -9.455 -3.923 1.00 . A A . 11 LEU H 1 1 11 2742 1 1 11 LEU HA H 5.464 -10.812 -4.243 1.00 . A A . 11 LEU HA 1 1 11 2743 1 1 11 LEU HB2 H 5.790 -8.243 -3.069 1.00 . A A . 11 LEU HB2 1 1 11 2744 1 1 11 LEU HB3 H 6.418 -8.848 -4.601 1.00 . A A . 11 LEU HB3 1 1 11 2745 1 1 11 LEU HD11 H 4.616 -5.750 -3.852 1.00 . A A . 11 LEU HD11 1 1 11 2746 1 1 11 LEU HD12 H 5.118 -5.742 -5.542 1.00 . A A . 11 LEU HD12 1 1 11 2747 1 1 11 LEU HD13 H 6.226 -6.315 -4.297 1.00 . A A . 11 LEU HD13 1 1 11 2748 1 1 11 LEU HD21 H 3.620 -7.710 -6.646 1.00 . A A . 11 LEU HD21 1 1 11 2749 1 1 11 LEU HD22 H 4.635 -9.122 -6.352 1.00 . A A . 11 LEU HD22 1 1 11 2750 1 1 11 LEU HD23 H 5.373 -7.578 -6.781 1.00 . A A . 11 LEU HD23 1 1 11 2751 1 1 11 LEU HG H 3.649 -7.704 -4.360 1.00 . A A . 11 LEU HG 1 1 11 2752 1 1 11 LEU N N 3.530 -10.091 -4.263 1.00 . A A . 11 LEU N 1 1 11 2753 1 1 11 LEU O O 5.236 -11.437 -1.810 1.00 . A A . 11 LEU O 1 1 11 2754 1 1 12 PHE C C 3.120 -9.169 0.549 1.00 . A A . 12 PHE C 1 1 11 2755 1 1 12 PHE CA C 4.513 -9.468 0.002 1.00 . A A . 12 PHE CA 1 1 11 2756 1 1 12 PHE CB C 5.538 -8.534 0.647 1.00 . A A . 12 PHE CB 1 1 11 2757 1 1 12 PHE CD1 C 5.319 -6.272 -0.416 1.00 . A A . 12 PHE CD1 1 1 11 2758 1 1 12 PHE CD2 C 7.198 -7.620 -0.998 1.00 . A A . 12 PHE CD2 1 1 11 2759 1 1 12 PHE CE1 C 5.768 -5.275 -1.262 1.00 . A A . 12 PHE CE1 1 1 11 2760 1 1 12 PHE CE2 C 7.652 -6.627 -1.845 1.00 . A A . 12 PHE CE2 1 1 11 2761 1 1 12 PHE CG C 6.028 -7.454 -0.274 1.00 . A A . 12 PHE CG 1 1 11 2762 1 1 12 PHE CZ C 6.935 -5.454 -1.979 1.00 . A A . 12 PHE CZ 1 1 11 2763 1 1 12 PHE H H 4.290 -8.470 -1.852 1.00 . A A . 12 PHE H 1 1 11 2764 1 1 12 PHE HA H 4.769 -10.489 0.240 1.00 . A A . 12 PHE HA 1 1 11 2765 1 1 12 PHE HB2 H 5.091 -8.059 1.507 1.00 . A A . 12 PHE HB2 1 1 11 2766 1 1 12 PHE HB3 H 6.392 -9.113 0.965 1.00 . A A . 12 PHE HB3 1 1 11 2767 1 1 12 PHE HD1 H 4.405 -6.131 0.144 1.00 . A A . 12 PHE HD1 1 1 11 2768 1 1 12 PHE HD2 H 7.759 -8.537 -0.895 1.00 . A A . 12 PHE HD2 1 1 11 2769 1 1 12 PHE HE1 H 5.205 -4.359 -1.364 1.00 . A A . 12 PHE HE1 1 1 11 2770 1 1 12 PHE HE2 H 8.564 -6.769 -2.405 1.00 . A A . 12 PHE HE2 1 1 11 2771 1 1 12 PHE HZ H 7.287 -4.676 -2.640 1.00 . A A . 12 PHE HZ 1 1 11 2772 1 1 12 PHE N N 4.543 -9.327 -1.449 1.00 . A A . 12 PHE N 1 1 11 2773 1 1 12 PHE O O 2.798 -8.025 0.864 1.00 . A A . 12 PHE O 1 1 11 2774 1 1 13 GLY C C 0.899 -10.016 2.682 1.00 . A A . 13 GLY C 1 1 11 2775 1 1 13 GLY CA C 0.950 -10.037 1.167 1.00 . A A . 13 GLY CA 1 1 11 2776 1 1 13 GLY H H 2.610 -11.099 0.392 1.00 . A A . 13 GLY H 1 1 11 2777 1 1 13 GLY HA2 H 0.550 -9.107 0.791 1.00 . A A . 13 GLY HA2 1 1 11 2778 1 1 13 GLY HA3 H 0.336 -10.851 0.810 1.00 . A A . 13 GLY HA3 1 1 11 2779 1 1 13 GLY N N 2.298 -10.208 0.659 1.00 . A A . 13 GLY N 1 1 11 2780 1 1 13 GLY O O -0.015 -9.440 3.272 1.00 . A A . 13 GLY O 1 1 11 2781 1 1 14 LYS C C 1.786 -9.307 5.372 1.00 . A A . 14 LYS C 1 1 11 2782 1 1 14 LYS CA C 1.949 -10.699 4.769 1.00 . A A . 14 LYS CA 1 1 11 2783 1 1 14 LYS CB C 3.278 -11.308 5.219 1.00 . A A . 14 LYS CB 1 1 11 2784 1 1 14 LYS CD C 2.161 -13.142 6.523 1.00 . A A . 14 LYS CD 1 1 11 2785 1 1 14 LYS CE C 1.137 -14.133 5.990 1.00 . A A . 14 LYS CE 1 1 11 2786 1 1 14 LYS CG C 3.207 -12.804 5.473 1.00 . A A . 14 LYS CG 1 1 11 2787 1 1 14 LYS H H 2.584 -11.087 2.788 1.00 . A A . 14 LYS H 1 1 11 2788 1 1 14 LYS HA H 1.140 -11.324 5.116 1.00 . A A . 14 LYS HA 1 1 11 2789 1 1 14 LYS HB2 H 4.020 -11.129 4.455 1.00 . A A . 14 LYS HB2 1 1 11 2790 1 1 14 LYS HB3 H 3.592 -10.824 6.133 1.00 . A A . 14 LYS HB3 1 1 11 2791 1 1 14 LYS HD2 H 2.652 -13.576 7.381 1.00 . A A . 14 LYS HD2 1 1 11 2792 1 1 14 LYS HD3 H 1.652 -12.235 6.816 1.00 . A A . 14 LYS HD3 1 1 11 2793 1 1 14 LYS HE2 H 0.194 -13.957 6.485 1.00 . A A . 14 LYS HE2 1 1 11 2794 1 1 14 LYS HE3 H 1.022 -13.976 4.928 1.00 . A A . 14 LYS HE3 1 1 11 2795 1 1 14 LYS HG2 H 2.951 -13.305 4.551 1.00 . A A . 14 LYS HG2 1 1 11 2796 1 1 14 LYS HG3 H 4.172 -13.148 5.816 1.00 . A A . 14 LYS HG3 1 1 11 2797 1 1 14 LYS HZ1 H 0.763 -16.085 6.633 1.00 . A A . 14 LYS HZ1 1 1 11 2798 1 1 14 LYS HZ2 H 2.354 -15.572 6.892 1.00 . A A . 14 LYS HZ2 1 1 11 2799 1 1 14 LYS HZ3 H 1.843 -15.987 5.334 1.00 . A A . 14 LYS HZ3 1 1 11 2800 1 1 14 LYS N N 1.883 -10.646 3.314 1.00 . A A . 14 LYS N 1 1 11 2801 1 1 14 LYS NZ N 1.554 -15.543 6.229 1.00 . A A . 14 LYS NZ 1 1 11 2802 1 1 14 LYS O O 0.690 -8.918 5.773 1.00 . A A . 14 LYS O 1 1 11 2803 1 1 15 GLY C C 2.520 -6.170 4.937 1.00 . A A . 15 GLY C 1 1 11 2804 1 1 15 GLY CA C 2.841 -7.219 5.983 1.00 . A A . 15 GLY CA 1 1 11 2805 1 1 15 GLY H H 3.731 -8.922 5.095 1.00 . A A . 15 GLY H 1 1 11 2806 1 1 15 GLY HA2 H 2.088 -7.184 6.756 1.00 . A A . 15 GLY HA2 1 1 11 2807 1 1 15 GLY HA3 H 3.802 -6.991 6.421 1.00 . A A . 15 GLY HA3 1 1 11 2808 1 1 15 GLY N N 2.884 -8.560 5.430 1.00 . A A . 15 GLY N 1 1 11 2809 1 1 15 GLY O O 3.142 -5.110 4.900 1.00 . A A . 15 GLY O 1 1 11 2810 1 1 16 GLY C C 0.901 -4.140 3.580 1.00 . A A . 16 GLY C 1 1 11 2811 1 1 16 GLY CA C 1.161 -5.533 3.042 1.00 . A A . 16 GLY CA 1 1 11 2812 1 1 16 GLY H H 1.084 -7.329 4.160 1.00 . A A . 16 GLY H 1 1 11 2813 1 1 16 GLY HA2 H 1.952 -5.482 2.308 1.00 . A A . 16 GLY HA2 1 1 11 2814 1 1 16 GLY HA3 H 0.263 -5.894 2.563 1.00 . A A . 16 GLY HA3 1 1 11 2815 1 1 16 GLY N N 1.545 -6.467 4.083 1.00 . A A . 16 GLY N 1 1 11 2816 1 1 16 GLY O O 0.045 -3.951 4.444 1.00 . A A . 16 GLY O 1 1 12 2817 1 1 1 VAL C C 1.232 -0.829 -2.412 1.00 . A A . 1 VAL C 1 1 12 2818 1 1 1 VAL CA C 1.973 -0.200 -1.237 1.00 . A A . 1 VAL CA 1 1 12 2819 1 1 1 VAL CB C 3.378 -0.825 -1.137 1.00 . A A . 1 VAL CB 1 1 12 2820 1 1 1 VAL CG1 C 4.177 -0.166 -0.023 1.00 . A A . 1 VAL CG1 1 1 12 2821 1 1 1 VAL CG2 C 3.278 -2.327 -0.916 1.00 . A A . 1 VAL CG2 1 1 12 2822 1 1 1 VAL H1 H 0.272 -0.150 0.021 1.00 . A A . 1 VAL H1 1 1 12 2823 1 1 1 VAL HA H 2.085 0.859 -1.420 1.00 . A A . 1 VAL HA 1 1 12 2824 1 1 1 VAL HB H 3.894 -0.653 -2.070 1.00 . A A . 1 VAL HB 1 1 12 2825 1 1 1 VAL HG11 H 4.212 -0.824 0.833 1.00 . A A . 1 VAL HG11 1 1 12 2826 1 1 1 VAL HG12 H 5.182 0.031 -0.369 1.00 . A A . 1 VAL HG12 1 1 12 2827 1 1 1 VAL HG13 H 3.704 0.764 0.257 1.00 . A A . 1 VAL HG13 1 1 12 2828 1 1 1 VAL HG21 H 2.909 -2.519 0.081 1.00 . A A . 1 VAL HG21 1 1 12 2829 1 1 1 VAL HG22 H 2.598 -2.753 -1.639 1.00 . A A . 1 VAL HG22 1 1 12 2830 1 1 1 VAL HG23 H 4.254 -2.774 -1.032 1.00 . A A . 1 VAL HG23 1 1 12 2831 1 1 1 VAL N N 1.228 -0.367 0.004 1.00 . A A . 1 VAL N 1 1 12 2832 1 1 1 VAL O O 1.397 -0.412 -3.558 1.00 . A A . 1 VAL O 1 1 12 2833 1 1 2 ALA C C -1.844 -2.504 -2.826 1.00 . A A . 2 ALA C 1 1 12 2834 1 1 2 ALA CA C -0.354 -2.520 -3.150 1.00 . A A . 2 ALA CA 1 1 12 2835 1 1 2 ALA CB C 0.137 -3.951 -3.312 1.00 . A A . 2 ALA CB 1 1 12 2836 1 1 2 ALA H H 0.326 -2.122 -1.186 1.00 . A A . 2 ALA H 1 1 12 2837 1 1 2 ALA HA H -0.193 -2.003 -4.085 1.00 . A A . 2 ALA HA 1 1 12 2838 1 1 2 ALA HB1 H 1.191 -3.998 -3.079 1.00 . A A . 2 ALA HB1 1 1 12 2839 1 1 2 ALA HB2 H -0.409 -4.597 -2.640 1.00 . A A . 2 ALA HB2 1 1 12 2840 1 1 2 ALA HB3 H -0.021 -4.273 -4.330 1.00 . A A . 2 ALA HB3 1 1 12 2841 1 1 2 ALA N N 0.415 -1.835 -2.119 1.00 . A A . 2 ALA N 1 1 12 2842 1 1 2 ALA O O -2.266 -2.990 -1.777 1.00 . A A . 2 ALA O 1 1 12 2843 1 1 3 ARG C C -4.646 -3.207 -3.105 1.00 . A A . 3 ARG C 1 1 12 2844 1 1 3 ARG CA C -4.079 -1.860 -3.542 1.00 . A A . 3 ARG CA 1 1 12 2845 1 1 3 ARG CB C -4.760 -1.402 -4.833 1.00 . A A . 3 ARG CB 1 1 12 2846 1 1 3 ARG CD C -3.538 -2.834 -6.498 1.00 . A A . 3 ARG CD 1 1 12 2847 1 1 3 ARG CG C -4.885 -2.499 -5.878 1.00 . A A . 3 ARG CG 1 1 12 2848 1 1 3 ARG CZ C -2.591 -3.175 -8.741 1.00 . A A . 3 ARG CZ 1 1 12 2849 1 1 3 ARG H H -2.240 -1.571 -4.550 1.00 . A A . 3 ARG H 1 1 12 2850 1 1 3 ARG HA H -4.270 -1.133 -2.767 1.00 . A A . 3 ARG HA 1 1 12 2851 1 1 3 ARG HB2 H -5.752 -1.046 -4.597 1.00 . A A . 3 ARG HB2 1 1 12 2852 1 1 3 ARG HB3 H -4.188 -0.592 -5.260 1.00 . A A . 3 ARG HB3 1 1 12 2853 1 1 3 ARG HD2 H -2.864 -2.008 -6.330 1.00 . A A . 3 ARG HD2 1 1 12 2854 1 1 3 ARG HD3 H -3.148 -3.720 -6.021 1.00 . A A . 3 ARG HD3 1 1 12 2855 1 1 3 ARG HE H -4.540 -3.166 -8.316 1.00 . A A . 3 ARG HE 1 1 12 2856 1 1 3 ARG HG2 H -5.284 -3.387 -5.408 1.00 . A A . 3 ARG HG2 1 1 12 2857 1 1 3 ARG HG3 H -5.558 -2.168 -6.655 1.00 . A A . 3 ARG HG3 1 1 12 2858 1 1 3 ARG HH11 H -1.228 -2.892 -7.277 1.00 . A A . 3 ARG HH11 1 1 12 2859 1 1 3 ARG HH12 H -0.574 -3.134 -8.863 1.00 . A A . 3 ARG HH12 1 1 12 2860 1 1 3 ARG HH21 H -3.690 -3.486 -10.409 1.00 . A A . 3 ARG HH21 1 1 12 2861 1 1 3 ARG HH22 H -1.975 -3.471 -10.644 1.00 . A A . 3 ARG HH22 1 1 12 2862 1 1 3 ARG N N -2.636 -1.941 -3.733 1.00 . A A . 3 ARG N 1 1 12 2863 1 1 3 ARG NE N -3.642 -3.075 -7.935 1.00 . A A . 3 ARG NE 1 1 12 2864 1 1 3 ARG NH1 N -1.364 -3.057 -8.254 1.00 . A A . 3 ARG NH1 1 1 12 2865 1 1 3 ARG NH2 N -2.766 -3.396 -10.038 1.00 . A A . 3 ARG NH2 1 1 12 2866 1 1 3 ARG O O -5.629 -3.268 -2.368 1.00 . A A . 3 ARG O 1 1 12 2867 1 1 4 GLY C C -3.430 -6.404 -2.447 1.00 . A A . 4 GLY C 1 1 12 2868 1 1 4 GLY CA C -4.476 -5.617 -3.212 1.00 . A A . 4 GLY CA 1 1 12 2869 1 1 4 GLY H H -3.240 -4.176 -4.150 1.00 . A A . 4 GLY H 1 1 12 2870 1 1 4 GLY HA2 H -5.363 -5.531 -2.603 1.00 . A A . 4 GLY HA2 1 1 12 2871 1 1 4 GLY HA3 H -4.722 -6.152 -4.117 1.00 . A A . 4 GLY HA3 1 1 12 2872 1 1 4 GLY N N -4.019 -4.285 -3.565 1.00 . A A . 4 GLY N 1 1 12 2873 1 1 4 GLY O O -2.438 -6.851 -3.022 1.00 . A A . 4 GLY O 1 1 12 2874 1 1 5 TRP C C -3.417 -8.476 0.388 1.00 . A A . 5 TRP C 1 1 12 2875 1 1 5 TRP CA C -2.719 -7.311 -0.304 1.00 . A A . 5 TRP CA 1 1 12 2876 1 1 5 TRP CB C -2.098 -6.380 0.739 1.00 . A A . 5 TRP CB 1 1 12 2877 1 1 5 TRP CD1 C -0.523 -4.383 0.425 1.00 . A A . 5 TRP CD1 1 1 12 2878 1 1 5 TRP CD2 C 0.227 -6.296 -0.467 1.00 . A A . 5 TRP CD2 1 1 12 2879 1 1 5 TRP CE2 C 1.178 -5.285 -0.707 1.00 . A A . 5 TRP CE2 1 1 12 2880 1 1 5 TRP CE3 C 0.484 -7.587 -0.935 1.00 . A A . 5 TRP CE3 1 1 12 2881 1 1 5 TRP CG C -0.853 -5.698 0.259 1.00 . A A . 5 TRP CG 1 1 12 2882 1 1 5 TRP CH2 C 2.589 -6.800 -1.843 1.00 . A A . 5 TRP CH2 1 1 12 2883 1 1 5 TRP CZ2 C 2.363 -5.527 -1.395 1.00 . A A . 5 TRP CZ2 1 1 12 2884 1 1 5 TRP CZ3 C 1.661 -7.825 -1.618 1.00 . A A . 5 TRP CZ3 1 1 12 2885 1 1 5 TRP H H -4.462 -6.192 -0.748 1.00 . A A . 5 TRP H 1 1 12 2886 1 1 5 TRP HA H -1.936 -7.700 -0.938 1.00 . A A . 5 TRP HA 1 1 12 2887 1 1 5 TRP HB2 H -2.815 -5.618 1.004 1.00 . A A . 5 TRP HB2 1 1 12 2888 1 1 5 TRP HB3 H -1.846 -6.955 1.618 1.00 . A A . 5 TRP HB3 1 1 12 2889 1 1 5 TRP HD1 H -1.141 -3.661 0.936 1.00 . A A . 5 TRP HD1 1 1 12 2890 1 1 5 TRP HE1 H 1.149 -3.258 -0.167 1.00 . A A . 5 TRP HE1 1 1 12 2891 1 1 5 TRP HE3 H -0.219 -8.390 -0.772 1.00 . A A . 5 TRP HE3 1 1 12 2892 1 1 5 TRP HH2 H 3.495 -7.032 -2.381 1.00 . A A . 5 TRP HH2 1 1 12 2893 1 1 5 TRP HZ2 H 3.089 -4.747 -1.576 1.00 . A A . 5 TRP HZ2 1 1 12 2894 1 1 5 TRP HZ3 H 1.877 -8.817 -1.988 1.00 . A A . 5 TRP HZ3 1 1 12 2895 1 1 5 TRP N N -3.652 -6.573 -1.149 1.00 . A A . 5 TRP N 1 1 12 2896 1 1 5 TRP NE1 N 0.697 -4.127 -0.154 1.00 . A A . 5 TRP NE1 1 1 12 2897 1 1 5 TRP O O -3.287 -9.627 -0.029 1.00 . A A . 5 TRP O 1 1 12 2898 1 1 6 LYS C C -5.225 -10.381 1.305 1.00 . A A . 6 LYS C 1 1 12 2899 1 1 6 LYS CA C -4.879 -9.193 2.198 1.00 . A A . 6 LYS CA 1 1 12 2900 1 1 6 LYS CB C -6.158 -8.606 2.801 1.00 . A A . 6 LYS CB 1 1 12 2901 1 1 6 LYS CD C -8.078 -7.019 2.483 1.00 . A A . 6 LYS CD 1 1 12 2902 1 1 6 LYS CE C -9.068 -8.042 1.947 1.00 . A A . 6 LYS CE 1 1 12 2903 1 1 6 LYS CG C -6.652 -7.362 2.085 1.00 . A A . 6 LYS CG 1 1 12 2904 1 1 6 LYS H H -4.224 -7.235 1.732 1.00 . A A . 6 LYS H 1 1 12 2905 1 1 6 LYS HA H -4.238 -9.533 2.996 1.00 . A A . 6 LYS HA 1 1 12 2906 1 1 6 LYS HB2 H -6.936 -9.353 2.760 1.00 . A A . 6 LYS HB2 1 1 12 2907 1 1 6 LYS HB3 H -5.969 -8.351 3.834 1.00 . A A . 6 LYS HB3 1 1 12 2908 1 1 6 LYS HD2 H -8.147 -6.998 3.560 1.00 . A A . 6 LYS HD2 1 1 12 2909 1 1 6 LYS HD3 H -8.329 -6.045 2.085 1.00 . A A . 6 LYS HD3 1 1 12 2910 1 1 6 LYS HE2 H -8.654 -8.492 1.058 1.00 . A A . 6 LYS HE2 1 1 12 2911 1 1 6 LYS HE3 H -9.220 -8.803 2.698 1.00 . A A . 6 LYS HE3 1 1 12 2912 1 1 6 LYS HG2 H -6.010 -6.532 2.339 1.00 . A A . 6 LYS HG2 1 1 12 2913 1 1 6 LYS HG3 H -6.617 -7.533 1.018 1.00 . A A . 6 LYS HG3 1 1 12 2914 1 1 6 LYS HZ1 H -10.622 -6.697 2.318 1.00 . A A . 6 LYS HZ1 1 1 12 2915 1 1 6 LYS HZ2 H -11.126 -8.147 1.606 1.00 . A A . 6 LYS HZ2 1 1 12 2916 1 1 6 LYS HZ3 H -10.336 -6.977 0.674 1.00 . A A . 6 LYS HZ3 1 1 12 2917 1 1 6 LYS N N -4.159 -8.171 1.448 1.00 . A A . 6 LYS N 1 1 12 2918 1 1 6 LYS NZ N -10.380 -7.422 1.613 1.00 . A A . 6 LYS NZ 1 1 12 2919 1 1 6 LYS O O -4.590 -11.433 1.383 1.00 . A A . 6 LYS O 1 1 12 2920 1 1 7 ARG C C -5.637 -11.475 -1.560 1.00 . A A . 7 ARG C 1 1 12 2921 1 1 7 ARG CA C -6.662 -11.263 -0.450 1.00 . A A . 7 ARG CA 1 1 12 2922 1 1 7 ARG CB C -8.024 -10.922 -1.056 1.00 . A A . 7 ARG CB 1 1 12 2923 1 1 7 ARG CD C -9.421 -8.902 -1.590 1.00 . A A . 7 ARG CD 1 1 12 2924 1 1 7 ARG CG C -8.063 -9.568 -1.745 1.00 . A A . 7 ARG CG 1 1 12 2925 1 1 7 ARG CZ C -11.647 -8.984 -2.631 1.00 . A A . 7 ARG CZ 1 1 12 2926 1 1 7 ARG H H -6.701 -9.344 0.443 1.00 . A A . 7 ARG H 1 1 12 2927 1 1 7 ARG HA H -6.750 -12.175 0.122 1.00 . A A . 7 ARG HA 1 1 12 2928 1 1 7 ARG HB2 H -8.281 -11.678 -1.784 1.00 . A A . 7 ARG HB2 1 1 12 2929 1 1 7 ARG HB3 H -8.765 -10.924 -0.271 1.00 . A A . 7 ARG HB3 1 1 12 2930 1 1 7 ARG HD2 H -9.809 -9.131 -0.609 1.00 . A A . 7 ARG HD2 1 1 12 2931 1 1 7 ARG HD3 H -9.297 -7.834 -1.688 1.00 . A A . 7 ARG HD3 1 1 12 2932 1 1 7 ARG HE H -10.049 -9.988 -3.277 1.00 . A A . 7 ARG HE 1 1 12 2933 1 1 7 ARG HG2 H -7.310 -8.930 -1.307 1.00 . A A . 7 ARG HG2 1 1 12 2934 1 1 7 ARG HG3 H -7.855 -9.703 -2.796 1.00 . A A . 7 ARG HG3 1 1 12 2935 1 1 7 ARG HH11 H -11.510 -7.788 -1.008 1.00 . A A . 7 ARG HH11 1 1 12 2936 1 1 7 ARG HH12 H -13.074 -7.855 -1.751 1.00 . A A . 7 ARG HH12 1 1 12 2937 1 1 7 ARG HH21 H -12.103 -10.084 -4.264 1.00 . A A . 7 ARG HH21 1 1 12 2938 1 1 7 ARG HH22 H -13.410 -9.161 -3.603 1.00 . A A . 7 ARG HH22 1 1 12 2939 1 1 7 ARG N N -6.233 -10.205 0.458 1.00 . A A . 7 ARG N 1 1 12 2940 1 1 7 ARG NE N -10.375 -9.364 -2.595 1.00 . A A . 7 ARG NE 1 1 12 2941 1 1 7 ARG NH1 N -12.116 -8.140 -1.722 1.00 . A A . 7 ARG NH1 1 1 12 2942 1 1 7 ARG NH2 N -12.453 -9.448 -3.577 1.00 . A A . 7 ARG NH2 1 1 12 2943 1 1 7 ARG O O -5.237 -12.604 -1.843 1.00 . A A . 7 ARG O 1 1 12 2944 1 1 8 LYS C C -2.816 -10.378 -2.716 1.00 . A A . 8 LYS C 1 1 12 2945 1 1 8 LYS CA C -4.238 -10.446 -3.266 1.00 . A A . 8 LYS CA 1 1 12 2946 1 1 8 LYS CB C -4.467 -9.304 -4.259 1.00 . A A . 8 LYS CB 1 1 12 2947 1 1 8 LYS CD C -6.624 -9.545 -5.523 1.00 . A A . 8 LYS CD 1 1 12 2948 1 1 8 LYS CE C -7.369 -10.859 -5.700 1.00 . A A . 8 LYS CE 1 1 12 2949 1 1 8 LYS CG C -5.119 -9.749 -5.557 1.00 . A A . 8 LYS CG 1 1 12 2950 1 1 8 LYS H H -5.572 -9.509 -1.916 1.00 . A A . 8 LYS H 1 1 12 2951 1 1 8 LYS HA H -4.369 -11.388 -3.776 1.00 . A A . 8 LYS HA 1 1 12 2952 1 1 8 LYS HB2 H -5.102 -8.563 -3.796 1.00 . A A . 8 LYS HB2 1 1 12 2953 1 1 8 LYS HB3 H -3.515 -8.852 -4.495 1.00 . A A . 8 LYS HB3 1 1 12 2954 1 1 8 LYS HD2 H -6.900 -9.113 -4.572 1.00 . A A . 8 LYS HD2 1 1 12 2955 1 1 8 LYS HD3 H -6.905 -8.872 -6.321 1.00 . A A . 8 LYS HD3 1 1 12 2956 1 1 8 LYS HE2 H -7.019 -11.338 -6.601 1.00 . A A . 8 LYS HE2 1 1 12 2957 1 1 8 LYS HE3 H -7.160 -11.493 -4.851 1.00 . A A . 8 LYS HE3 1 1 12 2958 1 1 8 LYS HG2 H -4.707 -9.174 -6.372 1.00 . A A . 8 LYS HG2 1 1 12 2959 1 1 8 LYS HG3 H -4.911 -10.798 -5.712 1.00 . A A . 8 LYS HG3 1 1 12 2960 1 1 8 LYS HZ1 H -9.104 -10.434 -6.783 1.00 . A A . 8 LYS HZ1 1 1 12 2961 1 1 8 LYS HZ2 H -9.134 -9.864 -5.191 1.00 . A A . 8 LYS HZ2 1 1 12 2962 1 1 8 LYS HZ3 H -9.343 -11.513 -5.502 1.00 . A A . 8 LYS HZ3 1 1 12 2963 1 1 8 LYS N N -5.216 -10.381 -2.187 1.00 . A A . 8 LYS N 1 1 12 2964 1 1 8 LYS NZ N -8.841 -10.653 -5.801 1.00 . A A . 8 LYS NZ 1 1 12 2965 1 1 8 LYS O O -2.331 -9.305 -2.356 1.00 . A A . 8 LYS O 1 1 12 2966 1 1 9 CYS C C 0.184 -11.975 -3.265 1.00 . A A . 9 CYS C 1 1 12 2967 1 1 9 CYS CA C -0.788 -11.598 -2.151 1.00 . A A . 9 CYS CA 1 1 12 2968 1 1 9 CYS CB C -0.695 -12.614 -1.012 1.00 . A A . 9 CYS CB 1 1 12 2969 1 1 9 CYS H H -2.595 -12.350 -2.958 1.00 . A A . 9 CYS H 1 1 12 2970 1 1 9 CYS HA H -0.524 -10.622 -1.775 1.00 . A A . 9 CYS HA 1 1 12 2971 1 1 9 CYS HB2 H 0.344 -12.770 -0.762 1.00 . A A . 9 CYS HB2 1 1 12 2972 1 1 9 CYS HB3 H -1.210 -12.221 -0.147 1.00 . A A . 9 CYS HB3 1 1 12 2973 1 1 9 CYS HG H -0.567 -15.160 -0.994 1.00 . A A . 9 CYS HG 1 1 12 2974 1 1 9 CYS N N -2.154 -11.528 -2.656 1.00 . A A . 9 CYS N 1 1 12 2975 1 1 9 CYS O O 0.708 -13.088 -3.315 1.00 . A A . 9 CYS O 1 1 12 2976 1 1 9 CYS SG S -1.414 -14.226 -1.399 1.00 . A A . 9 CYS SG 1 1 12 2977 1 1 10 PRO C C 2.798 -11.329 -4.873 1.00 . A A . 10 PRO C 1 1 12 2978 1 1 10 PRO CA C 1.341 -11.235 -5.311 1.00 . A A . 10 PRO CA 1 1 12 2979 1 1 10 PRO CB C 1.122 -9.992 -6.177 1.00 . A A . 10 PRO CB 1 1 12 2980 1 1 10 PRO CD C -0.158 -9.677 -4.183 1.00 . A A . 10 PRO CD 1 1 12 2981 1 1 10 PRO CG C 0.642 -8.949 -5.228 1.00 . A A . 10 PRO CG 1 1 12 2982 1 1 10 PRO HA H 1.078 -12.119 -5.874 1.00 . A A . 10 PRO HA 1 1 12 2983 1 1 10 PRO HB2 H 2.055 -9.705 -6.642 1.00 . A A . 10 PRO HB2 1 1 12 2984 1 1 10 PRO HB3 H 0.385 -10.204 -6.937 1.00 . A A . 10 PRO HB3 1 1 12 2985 1 1 10 PRO HD2 H -0.041 -9.203 -3.220 1.00 . A A . 10 PRO HD2 1 1 12 2986 1 1 10 PRO HD3 H -1.201 -9.713 -4.463 1.00 . A A . 10 PRO HD3 1 1 12 2987 1 1 10 PRO HG2 H 1.484 -8.449 -4.774 1.00 . A A . 10 PRO HG2 1 1 12 2988 1 1 10 PRO HG3 H 0.018 -8.238 -5.749 1.00 . A A . 10 PRO HG3 1 1 12 2989 1 1 10 PRO N N 0.431 -11.026 -4.181 1.00 . A A . 10 PRO N 1 1 12 2990 1 1 10 PRO O O 3.525 -12.234 -5.286 1.00 . A A . 10 PRO O 1 1 12 2991 1 1 11 LEU C C 4.632 -10.611 -2.032 1.00 . A A . 11 LEU C 1 1 12 2992 1 1 11 LEU CA C 4.592 -10.367 -3.538 1.00 . A A . 11 LEU CA 1 1 12 2993 1 1 11 LEU CB C 5.252 -9.027 -3.867 1.00 . A A . 11 LEU CB 1 1 12 2994 1 1 11 LEU CD1 C 4.972 -6.611 -4.473 1.00 . A A . 11 LEU CD1 1 1 12 2995 1 1 11 LEU CD2 C 4.184 -8.391 -6.044 1.00 . A A . 11 LEU CD2 1 1 12 2996 1 1 11 LEU CG C 4.371 -8.003 -4.584 1.00 . A A . 11 LEU CG 1 1 12 2997 1 1 11 LEU H H 2.596 -9.695 -3.739 1.00 . A A . 11 LEU H 1 1 12 2998 1 1 11 LEU HA H 5.136 -11.158 -4.032 1.00 . A A . 11 LEU HA 1 1 12 2999 1 1 11 LEU HB2 H 5.584 -8.585 -2.939 1.00 . A A . 11 LEU HB2 1 1 12 3000 1 1 11 LEU HB3 H 6.109 -9.226 -4.495 1.00 . A A . 11 LEU HB3 1 1 12 3001 1 1 11 LEU HD11 H 6.005 -6.688 -4.167 1.00 . A A . 11 LEU HD11 1 1 12 3002 1 1 11 LEU HD12 H 4.422 -6.039 -3.741 1.00 . A A . 11 LEU HD12 1 1 12 3003 1 1 11 LEU HD13 H 4.915 -6.117 -5.432 1.00 . A A . 11 LEU HD13 1 1 12 3004 1 1 11 LEU HD21 H 4.287 -9.461 -6.148 1.00 . A A . 11 LEU HD21 1 1 12 3005 1 1 11 LEU HD22 H 4.933 -7.897 -6.646 1.00 . A A . 11 LEU HD22 1 1 12 3006 1 1 11 LEU HD23 H 3.201 -8.090 -6.373 1.00 . A A . 11 LEU HD23 1 1 12 3007 1 1 11 LEU HG H 3.397 -7.984 -4.115 1.00 . A A . 11 LEU HG 1 1 12 3008 1 1 11 LEU N N 3.220 -10.390 -4.033 1.00 . A A . 11 LEU N 1 1 12 3009 1 1 11 LEU O O 4.934 -11.715 -1.579 1.00 . A A . 11 LEU O 1 1 12 3010 1 1 12 PHE C C 2.954 -9.307 0.762 1.00 . A A . 12 PHE C 1 1 12 3011 1 1 12 PHE CA C 4.321 -9.674 0.193 1.00 . A A . 12 PHE CA 1 1 12 3012 1 1 12 PHE CB C 5.396 -8.763 0.789 1.00 . A A . 12 PHE CB 1 1 12 3013 1 1 12 PHE CD1 C 5.186 -6.510 -0.295 1.00 . A A . 12 PHE CD1 1 1 12 3014 1 1 12 PHE CD2 C 7.022 -7.900 -0.916 1.00 . A A . 12 PHE CD2 1 1 12 3015 1 1 12 PHE CE1 C 5.627 -5.532 -1.167 1.00 . A A . 12 PHE CE1 1 1 12 3016 1 1 12 PHE CE2 C 7.467 -6.926 -1.790 1.00 . A A . 12 PHE CE2 1 1 12 3017 1 1 12 PHE CG C 5.878 -7.703 -0.160 1.00 . A A . 12 PHE CG 1 1 12 3018 1 1 12 PHE CZ C 6.768 -5.741 -1.916 1.00 . A A . 12 PHE CZ 1 1 12 3019 1 1 12 PHE H H 4.090 -8.718 -1.683 1.00 . A A . 12 PHE H 1 1 12 3020 1 1 12 PHE HA H 4.544 -10.697 0.453 1.00 . A A . 12 PHE HA 1 1 12 3021 1 1 12 PHE HB2 H 4.995 -8.269 1.662 1.00 . A A . 12 PHE HB2 1 1 12 3022 1 1 12 PHE HB3 H 6.246 -9.362 1.078 1.00 . A A . 12 PHE HB3 1 1 12 3023 1 1 12 PHE HD1 H 4.292 -6.346 0.290 1.00 . A A . 12 PHE HD1 1 1 12 3024 1 1 12 PHE HD2 H 7.568 -8.826 -0.820 1.00 . A A . 12 PHE HD2 1 1 12 3025 1 1 12 PHE HE1 H 5.078 -4.607 -1.264 1.00 . A A . 12 PHE HE1 1 1 12 3026 1 1 12 PHE HE2 H 8.360 -7.091 -2.374 1.00 . A A . 12 PHE HE2 1 1 12 3027 1 1 12 PHE HZ H 7.115 -4.978 -2.598 1.00 . A A . 12 PHE HZ 1 1 12 3028 1 1 12 PHE N N 4.322 -9.573 -1.262 1.00 . A A . 12 PHE N 1 1 12 3029 1 1 12 PHE O O 2.702 -8.153 1.105 1.00 . A A . 12 PHE O 1 1 12 3030 1 1 13 GLY C C 0.656 -10.319 2.878 1.00 . A A . 13 GLY C 1 1 12 3031 1 1 13 GLY CA C 0.743 -10.061 1.386 1.00 . A A . 13 GLY CA 1 1 12 3032 1 1 13 GLY H H 2.331 -11.200 0.570 1.00 . A A . 13 GLY H 1 1 12 3033 1 1 13 GLY HA2 H 0.469 -9.035 1.192 1.00 . A A . 13 GLY HA2 1 1 12 3034 1 1 13 GLY HA3 H 0.046 -10.712 0.879 1.00 . A A . 13 GLY HA3 1 1 12 3035 1 1 13 GLY N N 2.074 -10.299 0.859 1.00 . A A . 13 GLY N 1 1 12 3036 1 1 13 GLY O O -0.372 -10.054 3.502 1.00 . A A . 13 GLY O 1 1 12 3037 1 1 14 LYS C C 1.444 -9.894 5.700 1.00 . A A . 14 LYS C 1 1 12 3038 1 1 14 LYS CA C 1.778 -11.134 4.878 1.00 . A A . 14 LYS CA 1 1 12 3039 1 1 14 LYS CB C 3.160 -11.662 5.270 1.00 . A A . 14 LYS CB 1 1 12 3040 1 1 14 LYS CD C 5.651 -11.423 5.057 1.00 . A A . 14 LYS CD 1 1 12 3041 1 1 14 LYS CE C 5.922 -12.509 4.027 1.00 . A A . 14 LYS CE 1 1 12 3042 1 1 14 LYS CG C 4.302 -10.763 4.829 1.00 . A A . 14 LYS CG 1 1 12 3043 1 1 14 LYS H H 2.524 -11.029 2.900 1.00 . A A . 14 LYS H 1 1 12 3044 1 1 14 LYS HA H 1.040 -11.895 5.082 1.00 . A A . 14 LYS HA 1 1 12 3045 1 1 14 LYS HB2 H 3.202 -11.763 6.344 1.00 . A A . 14 LYS HB2 1 1 12 3046 1 1 14 LYS HB3 H 3.301 -12.635 4.820 1.00 . A A . 14 LYS HB3 1 1 12 3047 1 1 14 LYS HD2 H 6.426 -10.674 4.985 1.00 . A A . 14 LYS HD2 1 1 12 3048 1 1 14 LYS HD3 H 5.665 -11.863 6.044 1.00 . A A . 14 LYS HD3 1 1 12 3049 1 1 14 LYS HE2 H 5.302 -12.329 3.162 1.00 . A A . 14 LYS HE2 1 1 12 3050 1 1 14 LYS HE3 H 6.962 -12.464 3.741 1.00 . A A . 14 LYS HE3 1 1 12 3051 1 1 14 LYS HG2 H 4.192 -10.546 3.777 1.00 . A A . 14 LYS HG2 1 1 12 3052 1 1 14 LYS HG3 H 4.262 -9.842 5.394 1.00 . A A . 14 LYS HG3 1 1 12 3053 1 1 14 LYS HZ1 H 5.277 -13.797 5.540 1.00 . A A . 14 LYS HZ1 1 1 12 3054 1 1 14 LYS HZ2 H 6.485 -14.451 4.553 1.00 . A A . 14 LYS HZ2 1 1 12 3055 1 1 14 LYS HZ3 H 4.898 -14.330 3.979 1.00 . A A . 14 LYS HZ3 1 1 12 3056 1 1 14 LYS N N 1.736 -10.839 3.451 1.00 . A A . 14 LYS N 1 1 12 3057 1 1 14 LYS NZ N 5.624 -13.867 4.562 1.00 . A A . 14 LYS NZ 1 1 12 3058 1 1 14 LYS O O 0.646 -9.952 6.634 1.00 . A A . 14 LYS O 1 1 12 3059 1 1 15 GLY C C 1.261 -6.443 5.160 1.00 . A A . 15 GLY C 1 1 12 3060 1 1 15 GLY CA C 1.814 -7.531 6.059 1.00 . A A . 15 GLY CA 1 1 12 3061 1 1 15 GLY H H 2.687 -8.783 4.591 1.00 . A A . 15 GLY H 1 1 12 3062 1 1 15 GLY HA2 H 1.108 -7.721 6.854 1.00 . A A . 15 GLY HA2 1 1 12 3063 1 1 15 GLY HA3 H 2.743 -7.187 6.490 1.00 . A A . 15 GLY HA3 1 1 12 3064 1 1 15 GLY N N 2.060 -8.770 5.344 1.00 . A A . 15 GLY N 1 1 12 3065 1 1 15 GLY O O 0.637 -5.494 5.633 1.00 . A A . 15 GLY O 1 1 12 3066 1 1 16 GLY C C 1.386 -4.179 3.302 1.00 . A A . 16 GLY C 1 1 12 3067 1 1 16 GLY CA C 1.006 -5.593 2.910 1.00 . A A . 16 GLY CA 1 1 12 3068 1 1 16 GLY H H 1.995 -7.358 3.537 1.00 . A A . 16 GLY H 1 1 12 3069 1 1 16 GLY HA2 H 1.421 -5.809 1.937 1.00 . A A . 16 GLY HA2 1 1 12 3070 1 1 16 GLY HA3 H -0.070 -5.662 2.856 1.00 . A A . 16 GLY HA3 1 1 12 3071 1 1 16 GLY N N 1.491 -6.580 3.857 1.00 . A A . 16 GLY N 1 1 12 3072 1 1 16 GLY O O 0.579 -3.450 3.880 1.00 . A A . 16 GLY O 1 1 13 3073 1 1 1 VAL C C 1.023 -1.114 -2.006 1.00 . A A . 1 VAL C 1 1 13 3074 1 1 1 VAL CA C 2.037 -0.724 -0.937 1.00 . A A . 1 VAL CA 1 1 13 3075 1 1 1 VAL CB C 3.438 -1.186 -1.380 1.00 . A A . 1 VAL CB 1 1 13 3076 1 1 1 VAL CG1 C 4.463 -0.089 -1.140 1.00 . A A . 1 VAL CG1 1 1 13 3077 1 1 1 VAL CG2 C 3.831 -2.464 -0.655 1.00 . A A . 1 VAL CG2 1 1 13 3078 1 1 1 VAL H1 H 2.128 -0.958 1.165 1.00 . A A . 1 VAL H1 1 1 13 3079 1 1 1 VAL HA H 2.049 0.352 -0.841 1.00 . A A . 1 VAL HA 1 1 13 3080 1 1 1 VAL HB H 3.407 -1.393 -2.440 1.00 . A A . 1 VAL HB 1 1 13 3081 1 1 1 VAL HG11 H 5.302 -0.494 -0.592 1.00 . A A . 1 VAL HG11 1 1 13 3082 1 1 1 VAL HG12 H 4.805 0.300 -2.088 1.00 . A A . 1 VAL HG12 1 1 13 3083 1 1 1 VAL HG13 H 4.011 0.707 -0.566 1.00 . A A . 1 VAL HG13 1 1 13 3084 1 1 1 VAL HG21 H 2.979 -3.124 -0.602 1.00 . A A . 1 VAL HG21 1 1 13 3085 1 1 1 VAL HG22 H 4.631 -2.952 -1.193 1.00 . A A . 1 VAL HG22 1 1 13 3086 1 1 1 VAL HG23 H 4.164 -2.224 0.344 1.00 . A A . 1 VAL HG23 1 1 13 3087 1 1 1 VAL N N 1.678 -1.288 0.359 1.00 . A A . 1 VAL N 1 1 13 3088 1 1 1 VAL O O 0.160 -0.319 -2.376 1.00 . A A . 1 VAL O 1 1 13 3089 1 1 2 ALA C C -1.231 -2.666 -3.098 1.00 . A A . 2 ALA C 1 1 13 3090 1 1 2 ALA CA C 0.224 -2.840 -3.523 1.00 . A A . 2 ALA CA 1 1 13 3091 1 1 2 ALA CB C 0.516 -4.303 -3.824 1.00 . A A . 2 ALA CB 1 1 13 3092 1 1 2 ALA H H 1.842 -2.931 -2.162 1.00 . A A . 2 ALA H 1 1 13 3093 1 1 2 ALA HA H 0.395 -2.272 -4.426 1.00 . A A . 2 ALA HA 1 1 13 3094 1 1 2 ALA HB1 H 0.177 -4.539 -4.822 1.00 . A A . 2 ALA HB1 1 1 13 3095 1 1 2 ALA HB2 H 1.578 -4.480 -3.752 1.00 . A A . 2 ALA HB2 1 1 13 3096 1 1 2 ALA HB3 H -0.002 -4.927 -3.111 1.00 . A A . 2 ALA HB3 1 1 13 3097 1 1 2 ALA N N 1.133 -2.343 -2.498 1.00 . A A . 2 ALA N 1 1 13 3098 1 1 2 ALA O O -1.646 -3.167 -2.054 1.00 . A A . 2 ALA O 1 1 13 3099 1 1 3 ARG C C -4.097 -2.994 -3.174 1.00 . A A . 3 ARG C 1 1 13 3100 1 1 3 ARG CA C -3.406 -1.710 -3.622 1.00 . A A . 3 ARG CA 1 1 13 3101 1 1 3 ARG CB C -4.114 -1.140 -4.853 1.00 . A A . 3 ARG CB 1 1 13 3102 1 1 3 ARG CD C -3.151 -2.635 -6.628 1.00 . A A . 3 ARG CD 1 1 13 3103 1 1 3 ARG CG C -4.417 -2.181 -5.918 1.00 . A A . 3 ARG CG 1 1 13 3104 1 1 3 ARG CZ C -3.446 -1.808 -8.925 1.00 . A A . 3 ARG CZ 1 1 13 3105 1 1 3 ARG H H -1.610 -1.578 -4.733 1.00 . A A . 3 ARG H 1 1 13 3106 1 1 3 ARG HA H -3.460 -0.988 -2.821 1.00 . A A . 3 ARG HA 1 1 13 3107 1 1 3 ARG HB2 H -5.048 -0.694 -4.542 1.00 . A A . 3 ARG HB2 1 1 13 3108 1 1 3 ARG HB3 H -3.489 -0.378 -5.292 1.00 . A A . 3 ARG HB3 1 1 13 3109 1 1 3 ARG HD2 H -2.383 -1.891 -6.478 1.00 . A A . 3 ARG HD2 1 1 13 3110 1 1 3 ARG HD3 H -2.831 -3.573 -6.201 1.00 . A A . 3 ARG HD3 1 1 13 3111 1 1 3 ARG HE H -3.446 -3.731 -8.397 1.00 . A A . 3 ARG HE 1 1 13 3112 1 1 3 ARG HG2 H -4.880 -3.038 -5.451 1.00 . A A . 3 ARG HG2 1 1 13 3113 1 1 3 ARG HG3 H -5.093 -1.755 -6.643 1.00 . A A . 3 ARG HG3 1 1 13 3114 1 1 3 ARG HH11 H -3.190 -0.370 -7.529 1.00 . A A . 3 ARG HH11 1 1 13 3115 1 1 3 ARG HH12 H -3.399 0.200 -9.152 1.00 . A A . 3 ARG HH12 1 1 13 3116 1 1 3 ARG HH21 H -3.722 -2.994 -10.538 1.00 . A A . 3 ARG HH21 1 1 13 3117 1 1 3 ARG HH22 H -3.703 -1.294 -10.863 1.00 . A A . 3 ARG HH22 1 1 13 3118 1 1 3 ARG N N -1.999 -1.952 -3.915 1.00 . A A . 3 ARG N 1 1 13 3119 1 1 3 ARG NE N -3.362 -2.815 -8.062 1.00 . A A . 3 ARG NE 1 1 13 3120 1 1 3 ARG NH1 N -3.337 -0.556 -8.501 1.00 . A A . 3 ARG NH1 1 1 13 3121 1 1 3 ARG NH2 N -3.640 -2.052 -10.215 1.00 . A A . 3 ARG NH2 1 1 13 3122 1 1 3 ARG O O -5.023 -2.963 -2.364 1.00 . A A . 3 ARG O 1 1 13 3123 1 1 4 GLY C C -3.311 -6.235 -2.475 1.00 . A A . 4 GLY C 1 1 13 3124 1 1 4 GLY CA C -4.226 -5.402 -3.350 1.00 . A A . 4 GLY CA 1 1 13 3125 1 1 4 GLY H H -2.899 -4.088 -4.348 1.00 . A A . 4 GLY H 1 1 13 3126 1 1 4 GLY HA2 H -5.151 -5.228 -2.822 1.00 . A A . 4 GLY HA2 1 1 13 3127 1 1 4 GLY HA3 H -4.438 -5.953 -4.255 1.00 . A A . 4 GLY HA3 1 1 13 3128 1 1 4 GLY N N -3.640 -4.123 -3.707 1.00 . A A . 4 GLY N 1 1 13 3129 1 1 4 GLY O O -2.367 -6.855 -2.965 1.00 . A A . 4 GLY O 1 1 13 3130 1 1 5 TRP C C -3.637 -8.022 0.525 1.00 . A A . 5 TRP C 1 1 13 3131 1 1 5 TRP CA C -2.782 -7.010 -0.230 1.00 . A A . 5 TRP CA 1 1 13 3132 1 1 5 TRP CB C -2.093 -6.068 0.759 1.00 . A A . 5 TRP CB 1 1 13 3133 1 1 5 TRP CD1 C -0.498 -4.123 0.269 1.00 . A A . 5 TRP CD1 1 1 13 3134 1 1 5 TRP CD2 C 0.218 -6.110 -0.474 1.00 . A A . 5 TRP CD2 1 1 13 3135 1 1 5 TRP CE2 C 1.178 -5.134 -0.805 1.00 . A A . 5 TRP CE2 1 1 13 3136 1 1 5 TRP CE3 C 0.455 -7.438 -0.840 1.00 . A A . 5 TRP CE3 1 1 13 3137 1 1 5 TRP CG C -0.846 -5.442 0.213 1.00 . A A . 5 TRP CG 1 1 13 3138 1 1 5 TRP CH2 C 2.558 -6.753 -1.831 1.00 . A A . 5 TRP CH2 1 1 13 3139 1 1 5 TRP CZ2 C 2.353 -5.445 -1.485 1.00 . A A . 5 TRP CZ2 1 1 13 3140 1 1 5 TRP CZ3 C 1.621 -7.745 -1.515 1.00 . A A . 5 TRP CZ3 1 1 13 3141 1 1 5 TRP H H -4.355 -5.734 -0.845 1.00 . A A . 5 TRP H 1 1 13 3142 1 1 5 TRP HA H -2.028 -7.542 -0.791 1.00 . A A . 5 TRP HA 1 1 13 3143 1 1 5 TRP HB2 H -2.775 -5.275 1.025 1.00 . A A . 5 TRP HB2 1 1 13 3144 1 1 5 TRP HB3 H -1.827 -6.623 1.647 1.00 . A A . 5 TRP HB3 1 1 13 3145 1 1 5 TRP HD1 H -1.102 -3.354 0.727 1.00 . A A . 5 TRP HD1 1 1 13 3146 1 1 5 TRP HE1 H 1.180 -3.070 -0.429 1.00 . A A . 5 TRP HE1 1 1 13 3147 1 1 5 TRP HE3 H -0.256 -8.217 -0.606 1.00 . A A . 5 TRP HE3 1 1 13 3148 1 1 5 TRP HH2 H 3.455 -7.039 -2.359 1.00 . A A . 5 TRP HH2 1 1 13 3149 1 1 5 TRP HZ2 H 3.086 -4.692 -1.735 1.00 . A A . 5 TRP HZ2 1 1 13 3150 1 1 5 TRP HZ3 H 1.820 -8.766 -1.806 1.00 . A A . 5 TRP HZ3 1 1 13 3151 1 1 5 TRP N N -3.589 -6.249 -1.176 1.00 . A A . 5 TRP N 1 1 13 3152 1 1 5 TRP NE1 N 0.717 -3.930 -0.342 1.00 . A A . 5 TRP NE1 1 1 13 3153 1 1 5 TRP O O -3.654 -9.207 0.192 1.00 . A A . 5 TRP O 1 1 13 3154 1 1 6 LYS C C -5.743 -9.570 1.511 1.00 . A A . 6 LYS C 1 1 13 3155 1 1 6 LYS CA C -5.208 -8.410 2.344 1.00 . A A . 6 LYS CA 1 1 13 3156 1 1 6 LYS CB C -6.373 -7.605 2.925 1.00 . A A . 6 LYS CB 1 1 13 3157 1 1 6 LYS CD C -8.028 -5.747 2.581 1.00 . A A . 6 LYS CD 1 1 13 3158 1 1 6 LYS CE C -9.236 -6.486 3.136 1.00 . A A . 6 LYS CE 1 1 13 3159 1 1 6 LYS CG C -7.052 -6.700 1.911 1.00 . A A . 6 LYS CG 1 1 13 3160 1 1 6 LYS H H -4.293 -6.593 1.759 1.00 . A A . 6 LYS H 1 1 13 3161 1 1 6 LYS HA H -4.616 -8.807 3.154 1.00 . A A . 6 LYS HA 1 1 13 3162 1 1 6 LYS HB2 H -7.110 -8.292 3.314 1.00 . A A . 6 LYS HB2 1 1 13 3163 1 1 6 LYS HB3 H -6.003 -6.992 3.733 1.00 . A A . 6 LYS HB3 1 1 13 3164 1 1 6 LYS HD2 H -7.525 -5.242 3.392 1.00 . A A . 6 LYS HD2 1 1 13 3165 1 1 6 LYS HD3 H -8.363 -5.020 1.855 1.00 . A A . 6 LYS HD3 1 1 13 3166 1 1 6 LYS HE2 H -9.248 -7.486 2.730 1.00 . A A . 6 LYS HE2 1 1 13 3167 1 1 6 LYS HE3 H -9.149 -6.535 4.211 1.00 . A A . 6 LYS HE3 1 1 13 3168 1 1 6 LYS HG2 H -6.299 -6.123 1.396 1.00 . A A . 6 LYS HG2 1 1 13 3169 1 1 6 LYS HG3 H -7.590 -7.311 1.200 1.00 . A A . 6 LYS HG3 1 1 13 3170 1 1 6 LYS HZ1 H -10.335 -5.053 2.087 1.00 . A A . 6 LYS HZ1 1 1 13 3171 1 1 6 LYS HZ2 H -10.938 -5.381 3.632 1.00 . A A . 6 LYS HZ2 1 1 13 3172 1 1 6 LYS HZ3 H -11.182 -6.488 2.377 1.00 . A A . 6 LYS HZ3 1 1 13 3173 1 1 6 LYS N N -4.348 -7.547 1.542 1.00 . A A . 6 LYS N 1 1 13 3174 1 1 6 LYS NZ N -10.512 -5.805 2.783 1.00 . A A . 6 LYS NZ 1 1 13 3175 1 1 6 LYS O O -5.643 -10.731 1.909 1.00 . A A . 6 LYS O 1 1 13 3176 1 1 7 ARG C C -5.788 -10.797 -1.485 1.00 . A A . 7 ARG C 1 1 13 3177 1 1 7 ARG CA C -6.860 -10.265 -0.537 1.00 . A A . 7 ARG CA 1 1 13 3178 1 1 7 ARG CB C -8.028 -9.691 -1.341 1.00 . A A . 7 ARG CB 1 1 13 3179 1 1 7 ARG CD C -10.049 -10.871 -0.425 1.00 . A A . 7 ARG CD 1 1 13 3180 1 1 7 ARG CG C -9.309 -9.547 -0.536 1.00 . A A . 7 ARG CG 1 1 13 3181 1 1 7 ARG CZ C -11.895 -12.029 -1.563 1.00 . A A . 7 ARG CZ 1 1 13 3182 1 1 7 ARG H H -6.359 -8.306 0.089 1.00 . A A . 7 ARG H 1 1 13 3183 1 1 7 ARG HA H -7.220 -11.080 0.073 1.00 . A A . 7 ARG HA 1 1 13 3184 1 1 7 ARG HB2 H -7.750 -8.715 -1.711 1.00 . A A . 7 ARG HB2 1 1 13 3185 1 1 7 ARG HB3 H -8.226 -10.342 -2.179 1.00 . A A . 7 ARG HB3 1 1 13 3186 1 1 7 ARG HD2 H -9.377 -11.668 -0.708 1.00 . A A . 7 ARG HD2 1 1 13 3187 1 1 7 ARG HD3 H -10.359 -11.009 0.600 1.00 . A A . 7 ARG HD3 1 1 13 3188 1 1 7 ARG HE H -11.532 -10.071 -1.681 1.00 . A A . 7 ARG HE 1 1 13 3189 1 1 7 ARG HG2 H -9.062 -9.201 0.457 1.00 . A A . 7 ARG HG2 1 1 13 3190 1 1 7 ARG HG3 H -9.949 -8.827 -1.022 1.00 . A A . 7 ARG HG3 1 1 13 3191 1 1 7 ARG HH11 H -10.705 -13.219 -0.446 1.00 . A A . 7 ARG HH11 1 1 13 3192 1 1 7 ARG HH12 H -12.010 -14.023 -1.254 1.00 . A A . 7 ARG HH12 1 1 13 3193 1 1 7 ARG HH21 H -13.255 -11.117 -2.749 1.00 . A A . 7 ARG HH21 1 1 13 3194 1 1 7 ARG HH22 H -13.459 -12.826 -2.564 1.00 . A A . 7 ARG HH22 1 1 13 3195 1 1 7 ARG N N -6.309 -9.249 0.352 1.00 . A A . 7 ARG N 1 1 13 3196 1 1 7 ARG NE N -11.226 -10.914 -1.288 1.00 . A A . 7 ARG NE 1 1 13 3197 1 1 7 ARG NH1 N -11.504 -13.185 -1.046 1.00 . A A . 7 ARG NH1 1 1 13 3198 1 1 7 ARG NH2 N -12.957 -11.987 -2.357 1.00 . A A . 7 ARG NH2 1 1 13 3199 1 1 7 ARG O O -5.393 -11.960 -1.403 1.00 . A A . 7 ARG O 1 1 13 3200 1 1 8 LYS C C -2.914 -10.314 -2.700 1.00 . A A . 8 LYS C 1 1 13 3201 1 1 8 LYS CA C -4.295 -10.317 -3.347 1.00 . A A . 8 LYS CA 1 1 13 3202 1 1 8 LYS CB C -4.311 -9.364 -4.544 1.00 . A A . 8 LYS CB 1 1 13 3203 1 1 8 LYS CD C -6.333 -10.468 -5.547 1.00 . A A . 8 LYS CD 1 1 13 3204 1 1 8 LYS CE C -5.528 -11.159 -6.637 1.00 . A A . 8 LYS CE 1 1 13 3205 1 1 8 LYS CG C -5.695 -9.152 -5.133 1.00 . A A . 8 LYS CG 1 1 13 3206 1 1 8 LYS H H -5.675 -9.022 -2.398 1.00 . A A . 8 LYS H 1 1 13 3207 1 1 8 LYS HA H -4.517 -11.317 -3.690 1.00 . A A . 8 LYS HA 1 1 13 3208 1 1 8 LYS HB2 H -3.925 -8.405 -4.231 1.00 . A A . 8 LYS HB2 1 1 13 3209 1 1 8 LYS HB3 H -3.671 -9.765 -5.317 1.00 . A A . 8 LYS HB3 1 1 13 3210 1 1 8 LYS HD2 H -6.386 -11.118 -4.686 1.00 . A A . 8 LYS HD2 1 1 13 3211 1 1 8 LYS HD3 H -7.330 -10.274 -5.916 1.00 . A A . 8 LYS HD3 1 1 13 3212 1 1 8 LYS HE2 H -4.538 -11.365 -6.259 1.00 . A A . 8 LYS HE2 1 1 13 3213 1 1 8 LYS HE3 H -6.017 -12.088 -6.892 1.00 . A A . 8 LYS HE3 1 1 13 3214 1 1 8 LYS HG2 H -6.323 -8.677 -4.394 1.00 . A A . 8 LYS HG2 1 1 13 3215 1 1 8 LYS HG3 H -5.612 -8.514 -6.002 1.00 . A A . 8 LYS HG3 1 1 13 3216 1 1 8 LYS HZ1 H -5.648 -10.882 -8.703 1.00 . A A . 8 LYS HZ1 1 1 13 3217 1 1 8 LYS HZ2 H -4.445 -9.957 -7.957 1.00 . A A . 8 LYS HZ2 1 1 13 3218 1 1 8 LYS HZ3 H -6.070 -9.513 -7.803 1.00 . A A . 8 LYS HZ3 1 1 13 3219 1 1 8 LYS N N -5.321 -9.937 -2.383 1.00 . A A . 8 LYS N 1 1 13 3220 1 1 8 LYS NZ N -5.415 -10.319 -7.861 1.00 . A A . 8 LYS NZ 1 1 13 3221 1 1 8 LYS O O -2.461 -9.291 -2.186 1.00 . A A . 8 LYS O 1 1 13 3222 1 1 9 CYS C C 0.099 -12.015 -3.201 1.00 . A A . 9 CYS C 1 1 13 3223 1 1 9 CYS CA C -0.919 -11.594 -2.146 1.00 . A A . 9 CYS CA 1 1 13 3224 1 1 9 CYS CB C -0.936 -12.610 -1.003 1.00 . A A . 9 CYS CB 1 1 13 3225 1 1 9 CYS H H -2.663 -12.245 -3.153 1.00 . A A . 9 CYS H 1 1 13 3226 1 1 9 CYS HA H -0.634 -10.629 -1.755 1.00 . A A . 9 CYS HA 1 1 13 3227 1 1 9 CYS HB2 H 0.079 -12.816 -0.699 1.00 . A A . 9 CYS HB2 1 1 13 3228 1 1 9 CYS HB3 H -1.477 -12.191 -0.168 1.00 . A A . 9 CYS HB3 1 1 13 3229 1 1 9 CYS HG H -1.332 -14.510 -2.656 1.00 . A A . 9 CYS HG 1 1 13 3230 1 1 9 CYS N N -2.249 -11.464 -2.729 1.00 . A A . 9 CYS N 1 1 13 3231 1 1 9 CYS O O 0.609 -13.135 -3.195 1.00 . A A . 9 CYS O 1 1 13 3232 1 1 9 CYS SG S -1.712 -14.186 -1.430 1.00 . A A . 9 CYS SG 1 1 13 3233 1 1 10 PRO C C 2.793 -11.450 -4.703 1.00 . A A . 10 PRO C 1 1 13 3234 1 1 10 PRO CA C 1.359 -11.351 -5.212 1.00 . A A . 10 PRO CA 1 1 13 3235 1 1 10 PRO CB C 1.198 -10.131 -6.123 1.00 . A A . 10 PRO CB 1 1 13 3236 1 1 10 PRO CD C -0.168 -9.741 -4.200 1.00 . A A . 10 PRO CD 1 1 13 3237 1 1 10 PRO CG C 0.689 -9.054 -5.227 1.00 . A A . 10 PRO CG 1 1 13 3238 1 1 10 PRO HA H 1.110 -12.247 -5.761 1.00 . A A . 10 PRO HA 1 1 13 3239 1 1 10 PRO HB2 H 2.156 -9.870 -6.551 1.00 . A A . 10 PRO HB2 1 1 13 3240 1 1 10 PRO HB3 H 0.494 -10.355 -6.910 1.00 . A A . 10 PRO HB3 1 1 13 3241 1 1 10 PRO HD2 H -0.089 -9.240 -3.247 1.00 . A A . 10 PRO HD2 1 1 13 3242 1 1 10 PRO HD3 H -1.197 -9.772 -4.528 1.00 . A A . 10 PRO HD3 1 1 13 3243 1 1 10 PRO HG2 H 1.517 -8.552 -4.750 1.00 . A A . 10 PRO HG2 1 1 13 3244 1 1 10 PRO HG3 H 0.100 -8.351 -5.797 1.00 . A A . 10 PRO HG3 1 1 13 3245 1 1 10 PRO N N 0.401 -11.097 -4.132 1.00 . A A . 10 PRO N 1 1 13 3246 1 1 10 PRO O O 3.514 -12.395 -5.028 1.00 . A A . 10 PRO O 1 1 13 3247 1 1 11 LEU C C 4.524 -10.668 -1.841 1.00 . A A . 11 LEU C 1 1 13 3248 1 1 11 LEU CA C 4.551 -10.448 -3.350 1.00 . A A . 11 LEU CA 1 1 13 3249 1 1 11 LEU CB C 5.234 -9.117 -3.671 1.00 . A A . 11 LEU CB 1 1 13 3250 1 1 11 LEU CD1 C 5.026 -6.727 -4.399 1.00 . A A . 11 LEU CD1 1 1 13 3251 1 1 11 LEU CD2 C 4.269 -8.564 -5.918 1.00 . A A . 11 LEU CD2 1 1 13 3252 1 1 11 LEU CG C 4.403 -8.113 -4.471 1.00 . A A . 11 LEU CG 1 1 13 3253 1 1 11 LEU H H 2.583 -9.745 -3.682 1.00 . A A . 11 LEU H 1 1 13 3254 1 1 11 LEU HA H 5.111 -11.250 -3.808 1.00 . A A . 11 LEU HA 1 1 13 3255 1 1 11 LEU HB2 H 5.505 -8.651 -2.736 1.00 . A A . 11 LEU HB2 1 1 13 3256 1 1 11 LEU HB3 H 6.129 -9.333 -4.237 1.00 . A A . 11 LEU HB3 1 1 13 3257 1 1 11 LEU HD11 H 4.485 -6.127 -3.683 1.00 . A A . 11 LEU HD11 1 1 13 3258 1 1 11 LEU HD12 H 4.979 -6.260 -5.371 1.00 . A A . 11 LEU HD12 1 1 13 3259 1 1 11 LEU HD13 H 6.058 -6.813 -4.091 1.00 . A A . 11 LEU HD13 1 1 13 3260 1 1 11 LEU HD21 H 4.350 -9.640 -5.968 1.00 . A A . 11 LEU HD21 1 1 13 3261 1 1 11 LEU HD22 H 5.056 -8.117 -6.509 1.00 . A A . 11 LEU HD22 1 1 13 3262 1 1 11 LEU HD23 H 3.309 -8.257 -6.304 1.00 . A A . 11 LEU HD23 1 1 13 3263 1 1 11 LEU HG H 3.411 -8.055 -4.045 1.00 . A A . 11 LEU HG 1 1 13 3264 1 1 11 LEU N N 3.202 -10.471 -3.905 1.00 . A A . 11 LEU N 1 1 13 3265 1 1 11 LEU O O 4.798 -11.766 -1.358 1.00 . A A . 11 LEU O 1 1 13 3266 1 1 12 PHE C C 2.731 -9.322 0.856 1.00 . A A . 12 PHE C 1 1 13 3267 1 1 12 PHE CA C 4.123 -9.694 0.353 1.00 . A A . 12 PHE CA 1 1 13 3268 1 1 12 PHE CB C 5.168 -8.770 0.982 1.00 . A A . 12 PHE CB 1 1 13 3269 1 1 12 PHE CD1 C 5.216 -6.612 -0.298 1.00 . A A . 12 PHE CD1 1 1 13 3270 1 1 12 PHE CD2 C 6.996 -8.164 -0.628 1.00 . A A . 12 PHE CD2 1 1 13 3271 1 1 12 PHE CE1 C 5.800 -5.744 -1.201 1.00 . A A . 12 PHE CE1 1 1 13 3272 1 1 12 PHE CE2 C 7.585 -7.301 -1.531 1.00 . A A . 12 PHE CE2 1 1 13 3273 1 1 12 PHE CG C 5.806 -7.830 -0.001 1.00 . A A . 12 PHE CG 1 1 13 3274 1 1 12 PHE CZ C 6.986 -6.090 -1.819 1.00 . A A . 12 PHE CZ 1 1 13 3275 1 1 12 PHE H H 3.980 -8.766 -1.545 1.00 . A A . 12 PHE H 1 1 13 3276 1 1 12 PHE HA H 4.336 -10.712 0.640 1.00 . A A . 12 PHE HA 1 1 13 3277 1 1 12 PHE HB2 H 4.698 -8.176 1.751 1.00 . A A . 12 PHE HB2 1 1 13 3278 1 1 12 PHE HB3 H 5.949 -9.371 1.424 1.00 . A A . 12 PHE HB3 1 1 13 3279 1 1 12 PHE HD1 H 4.287 -6.341 0.186 1.00 . A A . 12 PHE HD1 1 1 13 3280 1 1 12 PHE HD2 H 7.465 -9.111 -0.404 1.00 . A A . 12 PHE HD2 1 1 13 3281 1 1 12 PHE HE1 H 5.329 -4.799 -1.424 1.00 . A A . 12 PHE HE1 1 1 13 3282 1 1 12 PHE HE2 H 8.512 -7.573 -2.014 1.00 . A A . 12 PHE HE2 1 1 13 3283 1 1 12 PHE HZ H 7.444 -5.413 -2.525 1.00 . A A . 12 PHE HZ 1 1 13 3284 1 1 12 PHE N N 4.188 -9.616 -1.102 1.00 . A A . 12 PHE N 1 1 13 3285 1 1 12 PHE O O 2.473 -8.171 1.208 1.00 . A A . 12 PHE O 1 1 13 3286 1 1 13 GLY C C 0.321 -10.310 2.832 1.00 . A A . 13 GLY C 1 1 13 3287 1 1 13 GLY CA C 0.482 -10.062 1.346 1.00 . A A . 13 GLY CA 1 1 13 3288 1 1 13 GLY H H 2.099 -11.203 0.593 1.00 . A A . 13 GLY H 1 1 13 3289 1 1 13 GLY HA2 H 0.219 -9.036 1.132 1.00 . A A . 13 GLY HA2 1 1 13 3290 1 1 13 GLY HA3 H -0.191 -10.714 0.809 1.00 . A A . 13 GLY HA3 1 1 13 3291 1 1 13 GLY N N 1.837 -10.305 0.886 1.00 . A A . 13 GLY N 1 1 13 3292 1 1 13 GLY O O -0.796 -10.326 3.350 1.00 . A A . 13 GLY O 1 1 13 3293 1 1 14 LYS C C 1.123 -9.473 5.730 1.00 . A A . 14 LYS C 1 1 13 3294 1 1 14 LYS CA C 1.419 -10.756 4.959 1.00 . A A . 14 LYS CA 1 1 13 3295 1 1 14 LYS CB C 2.758 -11.340 5.415 1.00 . A A . 14 LYS CB 1 1 13 3296 1 1 14 LYS CD C 4.680 -12.647 4.462 1.00 . A A . 14 LYS CD 1 1 13 3297 1 1 14 LYS CE C 5.061 -13.560 3.307 1.00 . A A . 14 LYS CE 1 1 13 3298 1 1 14 LYS CG C 3.173 -12.582 4.647 1.00 . A A . 14 LYS CG 1 1 13 3299 1 1 14 LYS H H 2.300 -10.482 3.054 1.00 . A A . 14 LYS H 1 1 13 3300 1 1 14 LYS HA H 0.637 -11.472 5.160 1.00 . A A . 14 LYS HA 1 1 13 3301 1 1 14 LYS HB2 H 3.526 -10.590 5.288 1.00 . A A . 14 LYS HB2 1 1 13 3302 1 1 14 LYS HB3 H 2.687 -11.596 6.462 1.00 . A A . 14 LYS HB3 1 1 13 3303 1 1 14 LYS HD2 H 5.052 -11.654 4.258 1.00 . A A . 14 LYS HD2 1 1 13 3304 1 1 14 LYS HD3 H 5.129 -13.023 5.370 1.00 . A A . 14 LYS HD3 1 1 13 3305 1 1 14 LYS HE2 H 4.173 -14.057 2.950 1.00 . A A . 14 LYS HE2 1 1 13 3306 1 1 14 LYS HE3 H 5.480 -12.958 2.513 1.00 . A A . 14 LYS HE3 1 1 13 3307 1 1 14 LYS HG2 H 2.851 -13.457 5.192 1.00 . A A . 14 LYS HG2 1 1 13 3308 1 1 14 LYS HG3 H 2.700 -12.568 3.675 1.00 . A A . 14 LYS HG3 1 1 13 3309 1 1 14 LYS HZ1 H 7.017 -14.281 3.445 1.00 . A A . 14 LYS HZ1 1 1 13 3310 1 1 14 LYS HZ2 H 5.852 -15.492 3.252 1.00 . A A . 14 LYS HZ2 1 1 13 3311 1 1 14 LYS HZ3 H 6.030 -14.722 4.747 1.00 . A A . 14 LYS HZ3 1 1 13 3312 1 1 14 LYS N N 1.439 -10.506 3.522 1.00 . A A . 14 LYS N 1 1 13 3313 1 1 14 LYS NZ N 6.060 -14.586 3.717 1.00 . A A . 14 LYS NZ 1 1 13 3314 1 1 14 LYS O O 0.298 -9.463 6.642 1.00 . A A . 14 LYS O 1 1 13 3315 1 1 15 GLY C C 1.114 -6.040 5.071 1.00 . A A . 15 GLY C 1 1 13 3316 1 1 15 GLY CA C 1.594 -7.120 6.021 1.00 . A A . 15 GLY CA 1 1 13 3317 1 1 15 GLY H H 2.446 -8.460 4.620 1.00 . A A . 15 GLY H 1 1 13 3318 1 1 15 GLY HA2 H 0.861 -7.250 6.803 1.00 . A A . 15 GLY HA2 1 1 13 3319 1 1 15 GLY HA3 H 2.527 -6.803 6.464 1.00 . A A . 15 GLY HA3 1 1 13 3320 1 1 15 GLY N N 1.800 -8.393 5.355 1.00 . A A . 15 GLY N 1 1 13 3321 1 1 15 GLY O O 0.399 -5.123 5.474 1.00 . A A . 15 GLY O 1 1 13 3322 1 1 16 GLY C C 1.397 -3.745 3.259 1.00 . A A . 16 GLY C 1 1 13 3323 1 1 16 GLY CA C 1.105 -5.165 2.817 1.00 . A A . 16 GLY CA 1 1 13 3324 1 1 16 GLY H H 2.078 -6.900 3.542 1.00 . A A . 16 GLY H 1 1 13 3325 1 1 16 GLY HA2 H 1.633 -5.360 1.896 1.00 . A A . 16 GLY HA2 1 1 13 3326 1 1 16 GLY HA3 H 0.044 -5.264 2.640 1.00 . A A . 16 GLY HA3 1 1 13 3327 1 1 16 GLY N N 1.508 -6.148 3.806 1.00 . A A . 16 GLY N 1 1 13 3328 1 1 16 GLY O O 0.499 -2.904 3.300 1.00 . A A . 16 GLY O 1 1 14 3329 1 1 1 VAL C C 1.494 -0.752 -2.317 1.00 . A A . 1 VAL C 1 1 14 3330 1 1 1 VAL CA C 2.230 -0.157 -1.122 1.00 . A A . 1 VAL CA 1 1 14 3331 1 1 1 VAL CB C 3.642 -0.768 -1.047 1.00 . A A . 1 VAL CB 1 1 14 3332 1 1 1 VAL CG1 C 4.435 -0.142 0.090 1.00 . A A . 1 VAL CG1 1 1 14 3333 1 1 1 VAL CG2 C 3.561 -2.278 -0.884 1.00 . A A . 1 VAL CG2 1 1 14 3334 1 1 1 VAL H1 H 1.947 -0.783 0.879 1.00 . A A . 1 VAL H1 1 1 14 3335 1 1 1 VAL HA H 2.329 0.909 -1.267 1.00 . A A . 1 VAL HA 1 1 14 3336 1 1 1 VAL HB H 4.154 -0.554 -1.974 1.00 . A A . 1 VAL HB 1 1 14 3337 1 1 1 VAL HG11 H 5.453 0.025 -0.230 1.00 . A A . 1 VAL HG11 1 1 14 3338 1 1 1 VAL HG12 H 3.984 0.799 0.369 1.00 . A A . 1 VAL HG12 1 1 14 3339 1 1 1 VAL HG13 H 4.431 -0.809 0.940 1.00 . A A . 1 VAL HG13 1 1 14 3340 1 1 1 VAL HG21 H 3.214 -2.513 0.111 1.00 . A A . 1 VAL HG21 1 1 14 3341 1 1 1 VAL HG22 H 2.870 -2.682 -1.610 1.00 . A A . 1 VAL HG22 1 1 14 3342 1 1 1 VAL HG23 H 4.538 -2.710 -1.037 1.00 . A A . 1 VAL HG23 1 1 14 3343 1 1 1 VAL N N 1.489 -0.377 0.114 1.00 . A A . 1 VAL N 1 1 14 3344 1 1 1 VAL O O 1.666 -0.305 -3.451 1.00 . A A . 1 VAL O 1 1 14 3345 1 1 2 ALA C C -1.586 -2.399 -2.796 1.00 . A A . 2 ALA C 1 1 14 3346 1 1 2 ALA CA C -0.094 -2.418 -3.109 1.00 . A A . 2 ALA CA 1 1 14 3347 1 1 2 ALA CB C 0.389 -3.848 -3.300 1.00 . A A . 2 ALA CB 1 1 14 3348 1 1 2 ALA H H 0.576 -2.074 -1.131 1.00 . A A . 2 ALA H 1 1 14 3349 1 1 2 ALA HA H 0.078 -1.879 -4.030 1.00 . A A . 2 ALA HA 1 1 14 3350 1 1 2 ALA HB1 H 0.217 -4.151 -4.323 1.00 . A A . 2 ALA HB1 1 1 14 3351 1 1 2 ALA HB2 H 1.445 -3.903 -3.081 1.00 . A A . 2 ALA HB2 1 1 14 3352 1 1 2 ALA HB3 H -0.153 -4.502 -2.634 1.00 . A A . 2 ALA HB3 1 1 14 3353 1 1 2 ALA N N 0.671 -1.762 -2.055 1.00 . A A . 2 ALA N 1 1 14 3354 1 1 2 ALA O O -2.019 -2.898 -1.757 1.00 . A A . 2 ALA O 1 1 14 3355 1 1 3 ARG C C -4.386 -3.078 -3.082 1.00 . A A . 3 ARG C 1 1 14 3356 1 1 3 ARG CA C -3.812 -1.733 -3.519 1.00 . A A . 3 ARG CA 1 1 14 3357 1 1 3 ARG CB C -4.484 -1.277 -4.816 1.00 . A A . 3 ARG CB 1 1 14 3358 1 1 3 ARG CD C -4.697 -1.832 -7.258 1.00 . A A . 3 ARG CD 1 1 14 3359 1 1 3 ARG CG C -4.641 -2.387 -5.843 1.00 . A A . 3 ARG CG 1 1 14 3360 1 1 3 ARG CZ C -6.989 -2.404 -7.937 1.00 . A A . 3 ARG CZ 1 1 14 3361 1 1 3 ARG H H -1.965 -1.438 -4.508 1.00 . A A . 3 ARG H 1 1 14 3362 1 1 3 ARG HA H -4.008 -1.004 -2.748 1.00 . A A . 3 ARG HA 1 1 14 3363 1 1 3 ARG HB2 H -5.466 -0.892 -4.583 1.00 . A A . 3 ARG HB2 1 1 14 3364 1 1 3 ARG HB3 H -3.892 -0.489 -5.256 1.00 . A A . 3 ARG HB3 1 1 14 3365 1 1 3 ARG HD2 H -4.965 -0.787 -7.210 1.00 . A A . 3 ARG HD2 1 1 14 3366 1 1 3 ARG HD3 H -3.721 -1.932 -7.709 1.00 . A A . 3 ARG HD3 1 1 14 3367 1 1 3 ARG HE H -5.335 -3.133 -8.780 1.00 . A A . 3 ARG HE 1 1 14 3368 1 1 3 ARG HG2 H -3.798 -3.058 -5.765 1.00 . A A . 3 ARG HG2 1 1 14 3369 1 1 3 ARG HG3 H -5.554 -2.926 -5.641 1.00 . A A . 3 ARG HG3 1 1 14 3370 1 1 3 ARG HH11 H -6.858 -1.092 -6.406 1.00 . A A . 3 ARG HH11 1 1 14 3371 1 1 3 ARG HH12 H -8.469 -1.504 -6.895 1.00 . A A . 3 ARG HH12 1 1 14 3372 1 1 3 ARG HH21 H -7.451 -3.683 -9.432 1.00 . A A . 3 ARG HH21 1 1 14 3373 1 1 3 ARG HH22 H -8.805 -2.979 -8.615 1.00 . A A . 3 ARG HH22 1 1 14 3374 1 1 3 ARG N N -2.368 -1.819 -3.700 1.00 . A A . 3 ARG N 1 1 14 3375 1 1 3 ARG NE N -5.676 -2.535 -8.083 1.00 . A A . 3 ARG NE 1 1 14 3376 1 1 3 ARG NH1 N -7.479 -1.601 -7.002 1.00 . A A . 3 ARG NH1 1 1 14 3377 1 1 3 ARG NH2 N -7.816 -3.077 -8.726 1.00 . A A . 3 ARG NH2 1 1 14 3378 1 1 3 ARG O O -5.365 -3.134 -2.339 1.00 . A A . 3 ARG O 1 1 14 3379 1 1 4 GLY C C -3.177 -6.296 -2.467 1.00 . A A . 4 GLY C 1 1 14 3380 1 1 4 GLY CA C -4.233 -5.488 -3.197 1.00 . A A . 4 GLY CA 1 1 14 3381 1 1 4 GLY H H -2.993 -4.053 -4.139 1.00 . A A . 4 GLY H 1 1 14 3382 1 1 4 GLY HA2 H -5.103 -5.398 -2.564 1.00 . A A . 4 GLY HA2 1 1 14 3383 1 1 4 GLY HA3 H -4.509 -6.012 -4.100 1.00 . A A . 4 GLY HA3 1 1 14 3384 1 1 4 GLY N N -3.769 -4.159 -3.549 1.00 . A A . 4 GLY N 1 1 14 3385 1 1 4 GLY O O -2.191 -6.725 -3.066 1.00 . A A . 4 GLY O 1 1 14 3386 1 1 5 TRP C C -3.128 -8.448 0.307 1.00 . A A . 5 TRP C 1 1 14 3387 1 1 5 TRP CA C -2.440 -7.262 -0.360 1.00 . A A . 5 TRP CA 1 1 14 3388 1 1 5 TRP CB C -1.808 -6.360 0.702 1.00 . A A . 5 TRP CB 1 1 14 3389 1 1 5 TRP CD1 C -0.230 -4.359 0.429 1.00 . A A . 5 TRP CD1 1 1 14 3390 1 1 5 TRP CD2 C 0.506 -6.249 -0.521 1.00 . A A . 5 TRP CD2 1 1 14 3391 1 1 5 TRP CE2 C 1.458 -5.234 -0.742 1.00 . A A . 5 TRP CE2 1 1 14 3392 1 1 5 TRP CE3 C 0.756 -7.527 -1.027 1.00 . A A . 5 TRP CE3 1 1 14 3393 1 1 5 TRP CG C -0.565 -5.668 0.230 1.00 . A A . 5 TRP CG 1 1 14 3394 1 1 5 TRP CH2 C 2.855 -6.721 -1.932 1.00 . A A . 5 TRP CH2 1 1 14 3395 1 1 5 TRP CZ2 C 2.637 -5.460 -1.448 1.00 . A A . 5 TRP CZ2 1 1 14 3396 1 1 5 TRP CZ3 C 1.926 -7.750 -1.727 1.00 . A A . 5 TRP CZ3 1 1 14 3397 1 1 5 TRP H H -4.189 -6.134 -0.751 1.00 . A A . 5 TRP H 1 1 14 3398 1 1 5 TRP HA H -1.664 -7.632 -1.013 1.00 . A A . 5 TRP HA 1 1 14 3399 1 1 5 TRP HB2 H -2.520 -5.604 0.994 1.00 . A A . 5 TRP HB2 1 1 14 3400 1 1 5 TRP HB3 H -1.550 -6.959 1.564 1.00 . A A . 5 TRP HB3 1 1 14 3401 1 1 5 TRP HD1 H -0.842 -3.650 0.966 1.00 . A A . 5 TRP HD1 1 1 14 3402 1 1 5 TRP HE1 H 1.439 -3.222 -0.147 1.00 . A A . 5 TRP HE1 1 1 14 3403 1 1 5 TRP HE3 H 0.052 -8.333 -0.880 1.00 . A A . 5 TRP HE3 1 1 14 3404 1 1 5 TRP HH2 H 3.755 -6.940 -2.485 1.00 . A A . 5 TRP HH2 1 1 14 3405 1 1 5 TRP HZ2 H 3.363 -4.678 -1.613 1.00 . A A . 5 TRP HZ2 1 1 14 3406 1 1 5 TRP HZ3 H 2.136 -8.732 -2.126 1.00 . A A . 5 TRP HZ3 1 1 14 3407 1 1 5 TRP N N -3.383 -6.502 -1.172 1.00 . A A . 5 TRP N 1 1 14 3408 1 1 5 TRP NE1 N 0.985 -4.091 -0.154 1.00 . A A . 5 TRP NE1 1 1 14 3409 1 1 5 TRP O O -3.001 -9.586 -0.144 1.00 . A A . 5 TRP O 1 1 14 3410 1 1 6 LYS C C -4.919 -10.383 1.191 1.00 . A A . 6 LYS C 1 1 14 3411 1 1 6 LYS CA C -4.568 -9.219 2.112 1.00 . A A . 6 LYS CA 1 1 14 3412 1 1 6 LYS CB C -5.841 -8.653 2.744 1.00 . A A . 6 LYS CB 1 1 14 3413 1 1 6 LYS CD C -7.745 -7.028 2.533 1.00 . A A . 6 LYS CD 1 1 14 3414 1 1 6 LYS CE C -8.798 -7.536 1.559 1.00 . A A . 6 LYS CE 1 1 14 3415 1 1 6 LYS CG C -6.342 -7.385 2.073 1.00 . A A . 6 LYS CG 1 1 14 3416 1 1 6 LYS H H -3.921 -7.247 1.695 1.00 . A A . 6 LYS H 1 1 14 3417 1 1 6 LYS HA H -3.917 -9.579 2.895 1.00 . A A . 6 LYS HA 1 1 14 3418 1 1 6 LYS HB2 H -6.620 -9.398 2.686 1.00 . A A . 6 LYS HB2 1 1 14 3419 1 1 6 LYS HB3 H -5.645 -8.431 3.783 1.00 . A A . 6 LYS HB3 1 1 14 3420 1 1 6 LYS HD2 H -7.922 -7.473 3.501 1.00 . A A . 6 LYS HD2 1 1 14 3421 1 1 6 LYS HD3 H -7.827 -5.952 2.609 1.00 . A A . 6 LYS HD3 1 1 14 3422 1 1 6 LYS HE2 H -8.351 -8.289 0.928 1.00 . A A . 6 LYS HE2 1 1 14 3423 1 1 6 LYS HE3 H -9.609 -7.973 2.122 1.00 . A A . 6 LYS HE3 1 1 14 3424 1 1 6 LYS HG2 H -5.676 -6.571 2.318 1.00 . A A . 6 LYS HG2 1 1 14 3425 1 1 6 LYS HG3 H -6.351 -7.536 1.003 1.00 . A A . 6 LYS HG3 1 1 14 3426 1 1 6 LYS HZ1 H -9.194 -6.673 -0.301 1.00 . A A . 6 LYS HZ1 1 1 14 3427 1 1 6 LYS HZ2 H -8.845 -5.550 0.914 1.00 . A A . 6 LYS HZ2 1 1 14 3428 1 1 6 LYS HZ3 H -10.352 -6.317 0.880 1.00 . A A . 6 LYS HZ3 1 1 14 3429 1 1 6 LYS N N -3.858 -8.175 1.384 1.00 . A A . 6 LYS N 1 1 14 3430 1 1 6 LYS NZ N -9.335 -6.442 0.703 1.00 . A A . 6 LYS NZ 1 1 14 3431 1 1 6 LYS O O -4.282 -11.435 1.234 1.00 . A A . 6 LYS O 1 1 14 3432 1 1 7 ARG C C -5.361 -11.392 -1.705 1.00 . A A . 7 ARG C 1 1 14 3433 1 1 7 ARG CA C -6.371 -11.219 -0.574 1.00 . A A . 7 ARG CA 1 1 14 3434 1 1 7 ARG CB C -7.744 -10.869 -1.152 1.00 . A A . 7 ARG CB 1 1 14 3435 1 1 7 ARG CD C -9.162 -8.851 -1.631 1.00 . A A . 7 ARG CD 1 1 14 3436 1 1 7 ARG CG C -7.798 -9.499 -1.807 1.00 . A A . 7 ARG CG 1 1 14 3437 1 1 7 ARG CZ C -11.479 -9.243 -2.353 1.00 . A A . 7 ARG CZ 1 1 14 3438 1 1 7 ARG H H -6.405 -9.325 0.370 1.00 . A A . 7 ARG H 1 1 14 3439 1 1 7 ARG HA H -6.445 -12.148 -0.029 1.00 . A A . 7 ARG HA 1 1 14 3440 1 1 7 ARG HB2 H -8.009 -11.609 -1.893 1.00 . A A . 7 ARG HB2 1 1 14 3441 1 1 7 ARG HB3 H -8.472 -10.893 -0.355 1.00 . A A . 7 ARG HB3 1 1 14 3442 1 1 7 ARG HD2 H -9.462 -8.949 -0.598 1.00 . A A . 7 ARG HD2 1 1 14 3443 1 1 7 ARG HD3 H -9.084 -7.804 -1.885 1.00 . A A . 7 ARG HD3 1 1 14 3444 1 1 7 ARG HE H -9.871 -10.087 -3.176 1.00 . A A . 7 ARG HE 1 1 14 3445 1 1 7 ARG HG2 H -7.049 -8.865 -1.356 1.00 . A A . 7 ARG HG2 1 1 14 3446 1 1 7 ARG HG3 H -7.594 -9.607 -2.862 1.00 . A A . 7 ARG HG3 1 1 14 3447 1 1 7 ARG HH11 H -11.276 -7.957 -0.807 1.00 . A A . 7 ARG HH11 1 1 14 3448 1 1 7 ARG HH12 H -12.904 -8.242 -1.326 1.00 . A A . 7 ARG HH12 1 1 14 3449 1 1 7 ARG HH21 H -12.010 -10.471 -3.868 1.00 . A A . 7 ARG HH21 1 1 14 3450 1 1 7 ARG HH22 H -13.321 -9.673 -3.067 1.00 . A A . 7 ARG HH22 1 1 14 3451 1 1 7 ARG N N -5.936 -10.186 0.357 1.00 . A A . 7 ARG N 1 1 14 3452 1 1 7 ARG NE N -10.177 -9.471 -2.479 1.00 . A A . 7 ARG NE 1 1 14 3453 1 1 7 ARG NH1 N -11.923 -8.413 -1.418 1.00 . A A . 7 ARG NH1 1 1 14 3454 1 1 7 ARG NH2 N -12.341 -9.845 -3.163 1.00 . A A . 7 ARG NH2 1 1 14 3455 1 1 7 ARG O O -4.960 -12.510 -2.029 1.00 . A A . 7 ARG O 1 1 14 3456 1 1 8 LYS C C -2.561 -10.256 -2.865 1.00 . A A . 8 LYS C 1 1 14 3457 1 1 8 LYS CA C -3.990 -10.304 -3.397 1.00 . A A . 8 LYS CA 1 1 14 3458 1 1 8 LYS CB C -4.232 -9.127 -4.345 1.00 . A A . 8 LYS CB 1 1 14 3459 1 1 8 LYS CD C -4.917 -10.510 -6.327 1.00 . A A . 8 LYS CD 1 1 14 3460 1 1 8 LYS CE C -5.930 -11.644 -6.306 1.00 . A A . 8 LYS CE 1 1 14 3461 1 1 8 LYS CG C -5.313 -9.391 -5.379 1.00 . A A . 8 LYS CG 1 1 14 3462 1 1 8 LYS H H -5.310 -9.415 -2.001 1.00 . A A . 8 LYS H 1 1 14 3463 1 1 8 LYS HA H -4.129 -11.227 -3.940 1.00 . A A . 8 LYS HA 1 1 14 3464 1 1 8 LYS HB2 H -4.522 -8.265 -3.763 1.00 . A A . 8 LYS HB2 1 1 14 3465 1 1 8 LYS HB3 H -3.312 -8.906 -4.867 1.00 . A A . 8 LYS HB3 1 1 14 3466 1 1 8 LYS HD2 H -4.857 -10.115 -7.331 1.00 . A A . 8 LYS HD2 1 1 14 3467 1 1 8 LYS HD3 H -3.951 -10.896 -6.032 1.00 . A A . 8 LYS HD3 1 1 14 3468 1 1 8 LYS HE2 H -5.951 -12.072 -5.315 1.00 . A A . 8 LYS HE2 1 1 14 3469 1 1 8 LYS HE3 H -6.904 -11.243 -6.545 1.00 . A A . 8 LYS HE3 1 1 14 3470 1 1 8 LYS HG2 H -6.224 -9.670 -4.871 1.00 . A A . 8 LYS HG2 1 1 14 3471 1 1 8 LYS HG3 H -5.480 -8.489 -5.950 1.00 . A A . 8 LYS HG3 1 1 14 3472 1 1 8 LYS HZ1 H -5.095 -13.491 -6.810 1.00 . A A . 8 LYS HZ1 1 1 14 3473 1 1 8 LYS HZ2 H -4.973 -12.327 -8.032 1.00 . A A . 8 LYS HZ2 1 1 14 3474 1 1 8 LYS HZ3 H -6.457 -13.081 -7.728 1.00 . A A . 8 LYS HZ3 1 1 14 3475 1 1 8 LYS N N -4.954 -10.277 -2.303 1.00 . A A . 8 LYS N 1 1 14 3476 1 1 8 LYS NZ N -5.590 -12.710 -7.288 1.00 . A A . 8 LYS NZ 1 1 14 3477 1 1 8 LYS O O -2.070 -9.198 -2.472 1.00 . A A . 8 LYS O 1 1 14 3478 1 1 9 CYS C C 0.430 -11.835 -3.513 1.00 . A A . 9 CYS C 1 1 14 3479 1 1 9 CYS CA C -0.527 -11.498 -2.373 1.00 . A A . 9 CYS CA 1 1 14 3480 1 1 9 CYS CB C -0.419 -12.554 -1.272 1.00 . A A . 9 CYS CB 1 1 14 3481 1 1 9 CYS H H -2.345 -12.218 -3.182 1.00 . A A . 9 CYS H 1 1 14 3482 1 1 9 CYS HA H -0.256 -10.536 -1.965 1.00 . A A . 9 CYS HA 1 1 14 3483 1 1 9 CYS HB2 H 0.623 -12.719 -1.043 1.00 . A A . 9 CYS HB2 1 1 14 3484 1 1 9 CYS HB3 H -0.922 -12.192 -0.387 1.00 . A A . 9 CYS HB3 1 1 14 3485 1 1 9 CYS HG H -0.362 -15.102 -1.223 1.00 . A A . 9 CYS HG 1 1 14 3486 1 1 9 CYS N N -1.900 -11.408 -2.857 1.00 . A A . 9 CYS N 1 1 14 3487 1 1 9 CYS O O 0.952 -12.945 -3.610 1.00 . A A . 9 CYS O 1 1 14 3488 1 1 9 CYS SG S -1.146 -14.151 -1.708 1.00 . A A . 9 CYS SG 1 1 14 3489 1 1 10 PRO C C 3.022 -11.133 -5.132 1.00 . A A . 10 PRO C 1 1 14 3490 1 1 10 PRO CA C 1.559 -11.023 -5.547 1.00 . A A . 10 PRO CA 1 1 14 3491 1 1 10 PRO CB C 1.329 -9.750 -6.365 1.00 . A A . 10 PRO CB 1 1 14 3492 1 1 10 PRO CD C 0.077 -9.505 -4.343 1.00 . A A . 10 PRO CD 1 1 14 3493 1 1 10 PRO CG C 0.863 -8.741 -5.372 1.00 . A A . 10 PRO CG 1 1 14 3494 1 1 10 PRO HA H 1.287 -11.886 -6.137 1.00 . A A . 10 PRO HA 1 1 14 3495 1 1 10 PRO HB2 H 2.256 -9.447 -6.832 1.00 . A A . 10 PRO HB2 1 1 14 3496 1 1 10 PRO HB3 H 0.581 -9.933 -7.122 1.00 . A A . 10 PRO HB3 1 1 14 3497 1 1 10 PRO HD2 H 0.208 -9.066 -3.365 1.00 . A A . 10 PRO HD2 1 1 14 3498 1 1 10 PRO HD3 H -0.969 -9.531 -4.610 1.00 . A A . 10 PRO HD3 1 1 14 3499 1 1 10 PRO HG2 H 1.712 -8.258 -4.913 1.00 . A A . 10 PRO HG2 1 1 14 3500 1 1 10 PRO HG3 H 0.233 -8.012 -5.859 1.00 . A A . 10 PRO HG3 1 1 14 3501 1 1 10 PRO N N 0.665 -10.854 -4.397 1.00 . A A . 10 PRO N 1 1 14 3502 1 1 10 PRO O O 3.744 -12.019 -5.594 1.00 . A A . 10 PRO O 1 1 14 3503 1 1 11 LEU C C 4.892 -10.527 -2.288 1.00 . A A . 11 LEU C 1 1 14 3504 1 1 11 LEU CA C 4.833 -10.227 -3.782 1.00 . A A . 11 LEU CA 1 1 14 3505 1 1 11 LEU CB C 5.489 -8.875 -4.068 1.00 . A A . 11 LEU CB 1 1 14 3506 1 1 11 LEU CD1 C 5.203 -6.438 -4.582 1.00 . A A . 11 LEU CD1 1 1 14 3507 1 1 11 LEU CD2 C 4.397 -8.160 -6.208 1.00 . A A . 11 LEU CD2 1 1 14 3508 1 1 11 LEU CG C 4.600 -7.826 -4.737 1.00 . A A . 11 LEU CG 1 1 14 3509 1 1 11 LEU H H 2.833 -9.550 -3.928 1.00 . A A . 11 LEU H 1 1 14 3510 1 1 11 LEU HA H 5.370 -10.998 -4.314 1.00 . A A . 11 LEU HA 1 1 14 3511 1 1 11 LEU HB2 H 5.830 -8.468 -3.129 1.00 . A A . 11 LEU HB2 1 1 14 3512 1 1 11 LEU HB3 H 6.338 -9.050 -4.712 1.00 . A A . 11 LEU HB3 1 1 14 3513 1 1 11 LEU HD11 H 5.139 -5.911 -5.522 1.00 . A A . 11 LEU HD11 1 1 14 3514 1 1 11 LEU HD12 H 6.238 -6.526 -4.289 1.00 . A A . 11 LEU HD12 1 1 14 3515 1 1 11 LEU HD13 H 4.659 -5.893 -3.825 1.00 . A A . 11 LEU HD13 1 1 14 3516 1 1 11 LEU HD21 H 4.497 -9.225 -6.352 1.00 . A A . 11 LEU HD21 1 1 14 3517 1 1 11 LEU HD22 H 5.139 -7.645 -6.800 1.00 . A A . 11 LEU HD22 1 1 14 3518 1 1 11 LEU HD23 H 3.410 -7.846 -6.515 1.00 . A A . 11 LEU HD23 1 1 14 3519 1 1 11 LEU HG H 3.631 -7.824 -4.257 1.00 . A A . 11 LEU HG 1 1 14 3520 1 1 11 LEU N N 3.454 -10.230 -4.259 1.00 . A A . 11 LEU N 1 1 14 3521 1 1 11 LEU O O 5.202 -11.647 -1.881 1.00 . A A . 11 LEU O 1 1 14 3522 1 1 12 PHE C C 3.248 -9.336 0.576 1.00 . A A . 12 PHE C 1 1 14 3523 1 1 12 PHE CA C 4.608 -9.677 -0.024 1.00 . A A . 12 PHE CA 1 1 14 3524 1 1 12 PHE CB C 5.689 -8.787 0.593 1.00 . A A . 12 PHE CB 1 1 14 3525 1 1 12 PHE CD1 C 5.458 -6.494 -0.398 1.00 . A A . 12 PHE CD1 1 1 14 3526 1 1 12 PHE CD2 C 7.288 -7.852 -1.100 1.00 . A A . 12 PHE CD2 1 1 14 3527 1 1 12 PHE CE1 C 5.884 -5.481 -1.237 1.00 . A A . 12 PHE CE1 1 1 14 3528 1 1 12 PHE CE2 C 7.719 -6.843 -1.940 1.00 . A A . 12 PHE CE2 1 1 14 3529 1 1 12 PHE CG C 6.155 -7.689 -0.320 1.00 . A A . 12 PHE CG 1 1 14 3530 1 1 12 PHE CZ C 7.016 -5.656 -2.009 1.00 . A A . 12 PHE CZ 1 1 14 3531 1 1 12 PHE H H 4.351 -8.651 -1.858 1.00 . A A . 12 PHE H 1 1 14 3532 1 1 12 PHE HA H 4.836 -10.709 0.194 1.00 . A A . 12 PHE HA 1 1 14 3533 1 1 12 PHE HB2 H 5.299 -8.330 1.490 1.00 . A A . 12 PHE HB2 1 1 14 3534 1 1 12 PHE HB3 H 6.544 -9.395 0.846 1.00 . A A . 12 PHE HB3 1 1 14 3535 1 1 12 PHE HD1 H 4.573 -6.355 0.206 1.00 . A A . 12 PHE HD1 1 1 14 3536 1 1 12 PHE HD2 H 7.839 -8.780 -1.047 1.00 . A A . 12 PHE HD2 1 1 14 3537 1 1 12 PHE HE1 H 5.332 -4.554 -1.289 1.00 . A A . 12 PHE HE1 1 1 14 3538 1 1 12 PHE HE2 H 8.604 -6.983 -2.543 1.00 . A A . 12 PHE HE2 1 1 14 3539 1 1 12 PHE HZ H 7.351 -4.866 -2.665 1.00 . A A . 12 PHE HZ 1 1 14 3540 1 1 12 PHE N N 4.591 -9.521 -1.474 1.00 . A A . 12 PHE N 1 1 14 3541 1 1 12 PHE O O 2.985 -8.188 0.934 1.00 . A A . 12 PHE O 1 1 14 3542 1 1 13 GLY C C 1.051 -10.205 2.754 1.00 . A A . 13 GLY C 1 1 14 3543 1 1 13 GLY CA C 1.062 -10.129 1.240 1.00 . A A . 13 GLY CA 1 1 14 3544 1 1 13 GLY H H 2.649 -11.236 0.382 1.00 . A A . 13 GLY H 1 1 14 3545 1 1 13 GLY HA2 H 0.709 -9.154 0.937 1.00 . A A . 13 GLY HA2 1 1 14 3546 1 1 13 GLY HA3 H 0.394 -10.881 0.848 1.00 . A A . 13 GLY HA3 1 1 14 3547 1 1 13 GLY N N 2.385 -10.342 0.683 1.00 . A A . 13 GLY N 1 1 14 3548 1 1 13 GLY O O 0.043 -9.898 3.391 1.00 . A A . 13 GLY O 1 1 14 3549 1 1 14 LYS C C 1.765 -9.482 5.472 1.00 . A A . 14 LYS C 1 1 14 3550 1 1 14 LYS CA C 2.290 -10.736 4.781 1.00 . A A . 14 LYS CA 1 1 14 3551 1 1 14 LYS CB C 3.748 -10.977 5.178 1.00 . A A . 14 LYS CB 1 1 14 3552 1 1 14 LYS CD C 3.231 -13.123 6.377 1.00 . A A . 14 LYS CD 1 1 14 3553 1 1 14 LYS CE C 2.524 -14.344 5.808 1.00 . A A . 14 LYS CE 1 1 14 3554 1 1 14 LYS CG C 4.101 -12.446 5.331 1.00 . A A . 14 LYS CG 1 1 14 3555 1 1 14 LYS H H 2.944 -10.849 2.770 1.00 . A A . 14 LYS H 1 1 14 3556 1 1 14 LYS HA H 1.696 -11.581 5.094 1.00 . A A . 14 LYS HA 1 1 14 3557 1 1 14 LYS HB2 H 4.390 -10.551 4.421 1.00 . A A . 14 LYS HB2 1 1 14 3558 1 1 14 LYS HB3 H 3.939 -10.482 6.119 1.00 . A A . 14 LYS HB3 1 1 14 3559 1 1 14 LYS HD2 H 3.851 -13.433 7.204 1.00 . A A . 14 LYS HD2 1 1 14 3560 1 1 14 LYS HD3 H 2.489 -12.418 6.725 1.00 . A A . 14 LYS HD3 1 1 14 3561 1 1 14 LYS HE2 H 2.178 -14.113 4.813 1.00 . A A . 14 LYS HE2 1 1 14 3562 1 1 14 LYS HE3 H 3.229 -15.162 5.763 1.00 . A A . 14 LYS HE3 1 1 14 3563 1 1 14 LYS HG2 H 3.958 -12.943 4.383 1.00 . A A . 14 LYS HG2 1 1 14 3564 1 1 14 LYS HG3 H 5.137 -12.529 5.630 1.00 . A A . 14 LYS HG3 1 1 14 3565 1 1 14 LYS HZ1 H 1.472 -14.386 7.612 1.00 . A A . 14 LYS HZ1 1 1 14 3566 1 1 14 LYS HZ2 H 1.295 -15.788 6.683 1.00 . A A . 14 LYS HZ2 1 1 14 3567 1 1 14 LYS HZ3 H 0.481 -14.373 6.241 1.00 . A A . 14 LYS HZ3 1 1 14 3568 1 1 14 LYS N N 2.173 -10.618 3.332 1.00 . A A . 14 LYS N 1 1 14 3569 1 1 14 LYS NZ N 1.361 -14.751 6.644 1.00 . A A . 14 LYS NZ 1 1 14 3570 1 1 14 LYS O O 0.618 -9.439 5.915 1.00 . A A . 14 LYS O 1 1 14 3571 1 1 15 GLY C C 1.534 -6.266 5.237 1.00 . A A . 15 GLY C 1 1 14 3572 1 1 15 GLY CA C 2.215 -7.219 6.198 1.00 . A A . 15 GLY CA 1 1 14 3573 1 1 15 GLY H H 3.516 -8.552 5.190 1.00 . A A . 15 GLY H 1 1 14 3574 1 1 15 GLY HA2 H 1.536 -7.444 7.007 1.00 . A A . 15 GLY HA2 1 1 14 3575 1 1 15 GLY HA3 H 3.093 -6.738 6.603 1.00 . A A . 15 GLY HA3 1 1 14 3576 1 1 15 GLY N N 2.613 -8.461 5.561 1.00 . A A . 15 GLY N 1 1 14 3577 1 1 15 GLY O O 0.740 -5.421 5.647 1.00 . A A . 15 GLY O 1 1 14 3578 1 1 16 GLY C C 1.376 -4.067 3.303 1.00 . A A . 16 GLY C 1 1 14 3579 1 1 16 GLY CA C 1.252 -5.535 2.949 1.00 . A A . 16 GLY CA 1 1 14 3580 1 1 16 GLY H H 2.487 -7.091 3.682 1.00 . A A . 16 GLY H 1 1 14 3581 1 1 16 GLY HA2 H 1.742 -5.710 2.003 1.00 . A A . 16 GLY HA2 1 1 14 3582 1 1 16 GLY HA3 H 0.205 -5.783 2.852 1.00 . A A . 16 GLY HA3 1 1 14 3583 1 1 16 GLY N N 1.847 -6.400 3.951 1.00 . A A . 16 GLY N 1 1 14 3584 1 1 16 GLY O O 1.857 -3.266 2.500 1.00 . A A . 16 GLY O 1 1 15 3585 1 1 1 VAL C C 1.661 -0.801 -2.235 1.00 . A A . 1 VAL C 1 1 15 3586 1 1 1 VAL CA C 2.435 -0.229 -1.053 1.00 . A A . 1 VAL CA 1 1 15 3587 1 1 1 VAL CB C 2.979 -1.390 -0.199 1.00 . A A . 1 VAL CB 1 1 15 3588 1 1 1 VAL CG1 C 3.549 -2.485 -1.088 1.00 . A A . 1 VAL CG1 1 1 15 3589 1 1 1 VAL CG2 C 4.029 -0.885 0.779 1.00 . A A . 1 VAL CG2 1 1 15 3590 1 1 1 VAL H1 H 0.766 0.327 0.124 1.00 . A A . 1 VAL H1 1 1 15 3591 1 1 1 VAL HA H 3.275 0.340 -1.426 1.00 . A A . 1 VAL HA 1 1 15 3592 1 1 1 VAL HB H 2.160 -1.807 0.368 1.00 . A A . 1 VAL HB 1 1 15 3593 1 1 1 VAL HG11 H 4.061 -2.037 -1.926 1.00 . A A . 1 VAL HG11 1 1 15 3594 1 1 1 VAL HG12 H 4.243 -3.085 -0.519 1.00 . A A . 1 VAL HG12 1 1 15 3595 1 1 1 VAL HG13 H 2.745 -3.109 -1.450 1.00 . A A . 1 VAL HG13 1 1 15 3596 1 1 1 VAL HG21 H 3.577 -0.176 1.457 1.00 . A A . 1 VAL HG21 1 1 15 3597 1 1 1 VAL HG22 H 4.427 -1.717 1.342 1.00 . A A . 1 VAL HG22 1 1 15 3598 1 1 1 VAL HG23 H 4.827 -0.404 0.234 1.00 . A A . 1 VAL HG23 1 1 15 3599 1 1 1 VAL N N 1.600 0.667 -0.261 1.00 . A A . 1 VAL N 1 1 15 3600 1 1 1 VAL O O 1.836 -0.367 -3.373 1.00 . A A . 1 VAL O 1 1 15 3601 1 1 2 ALA C C -1.487 -2.332 -2.662 1.00 . A A . 2 ALA C 1 1 15 3602 1 1 2 ALA CA C -0.001 -2.407 -2.996 1.00 . A A . 2 ALA CA 1 1 15 3603 1 1 2 ALA CB C 0.426 -3.854 -3.190 1.00 . A A . 2 ALA CB 1 1 15 3604 1 1 2 ALA H H 0.707 -2.079 -1.029 1.00 . A A . 2 ALA H 1 1 15 3605 1 1 2 ALA HA H 0.176 -1.878 -3.922 1.00 . A A . 2 ALA HA 1 1 15 3606 1 1 2 ALA HB1 H -0.174 -4.493 -2.559 1.00 . A A . 2 ALA HB1 1 1 15 3607 1 1 2 ALA HB2 H 0.288 -4.135 -4.223 1.00 . A A . 2 ALA HB2 1 1 15 3608 1 1 2 ALA HB3 H 1.467 -3.960 -2.923 1.00 . A A . 2 ALA HB3 1 1 15 3609 1 1 2 ALA N N 0.803 -1.776 -1.956 1.00 . A A . 2 ALA N 1 1 15 3610 1 1 2 ALA O O -1.925 -2.826 -1.623 1.00 . A A . 2 ALA O 1 1 15 3611 1 1 3 ARG C C -4.332 -2.918 -3.020 1.00 . A A . 3 ARG C 1 1 15 3612 1 1 3 ARG CA C -3.695 -1.571 -3.347 1.00 . A A . 3 ARG CA 1 1 15 3613 1 1 3 ARG CB C -4.351 -0.973 -4.593 1.00 . A A . 3 ARG CB 1 1 15 3614 1 1 3 ARG CD C -4.749 -1.324 -7.049 1.00 . A A . 3 ARG CD 1 1 15 3615 1 1 3 ARG CG C -4.617 -1.991 -5.689 1.00 . A A . 3 ARG CG 1 1 15 3616 1 1 3 ARG CZ C -5.104 -2.048 -9.372 1.00 . A A . 3 ARG CZ 1 1 15 3617 1 1 3 ARG H H -1.851 -1.338 -4.359 1.00 . A A . 3 ARG H 1 1 15 3618 1 1 3 ARG HA H -3.849 -0.902 -2.513 1.00 . A A . 3 ARG HA 1 1 15 3619 1 1 3 ARG HB2 H -5.293 -0.527 -4.310 1.00 . A A . 3 ARG HB2 1 1 15 3620 1 1 3 ARG HB3 H -3.704 -0.207 -4.992 1.00 . A A . 3 ARG HB3 1 1 15 3621 1 1 3 ARG HD2 H -5.437 -0.496 -6.963 1.00 . A A . 3 ARG HD2 1 1 15 3622 1 1 3 ARG HD3 H -3.780 -0.957 -7.350 1.00 . A A . 3 ARG HD3 1 1 15 3623 1 1 3 ARG HE H -5.705 -3.056 -7.759 1.00 . A A . 3 ARG HE 1 1 15 3624 1 1 3 ARG HG2 H -3.797 -2.693 -5.723 1.00 . A A . 3 ARG HG2 1 1 15 3625 1 1 3 ARG HG3 H -5.533 -2.517 -5.464 1.00 . A A . 3 ARG HG3 1 1 15 3626 1 1 3 ARG HH11 H -4.123 -0.293 -9.168 1.00 . A A . 3 ARG HH11 1 1 15 3627 1 1 3 ARG HH12 H -4.379 -0.815 -10.800 1.00 . A A . 3 ARG HH12 1 1 15 3628 1 1 3 ARG HH21 H -6.048 -3.754 -9.904 1.00 . A A . 3 ARG HH21 1 1 15 3629 1 1 3 ARG HH22 H -5.475 -2.783 -11.218 1.00 . A A . 3 ARG HH22 1 1 15 3630 1 1 3 ARG N N -2.258 -1.711 -3.549 1.00 . A A . 3 ARG N 1 1 15 3631 1 1 3 ARG NE N -5.245 -2.248 -8.066 1.00 . A A . 3 ARG NE 1 1 15 3632 1 1 3 ARG NH1 N -4.485 -0.963 -9.816 1.00 . A A . 3 ARG NH1 1 1 15 3633 1 1 3 ARG NH2 N -5.582 -2.934 -10.235 1.00 . A A . 3 ARG NH2 1 1 15 3634 1 1 3 ARG O O -5.340 -2.986 -2.317 1.00 . A A . 3 ARG O 1 1 15 3635 1 1 4 GLY C C -3.266 -6.210 -2.570 1.00 . A A . 4 GLY C 1 1 15 3636 1 1 4 GLY CA C -4.261 -5.320 -3.289 1.00 . A A . 4 GLY CA 1 1 15 3637 1 1 4 GLY H H -2.936 -3.875 -4.089 1.00 . A A . 4 GLY H 1 1 15 3638 1 1 4 GLY HA2 H -5.154 -5.238 -2.688 1.00 . A A . 4 GLY HA2 1 1 15 3639 1 1 4 GLY HA3 H -4.516 -5.776 -4.235 1.00 . A A . 4 GLY HA3 1 1 15 3640 1 1 4 GLY N N -3.737 -3.989 -3.536 1.00 . A A . 4 GLY N 1 1 15 3641 1 1 4 GLY O O -2.300 -6.683 -3.169 1.00 . A A . 4 GLY O 1 1 15 3642 1 1 5 TRP C C -3.383 -8.440 0.138 1.00 . A A . 5 TRP C 1 1 15 3643 1 1 5 TRP CA C -2.617 -7.277 -0.482 1.00 . A A . 5 TRP CA 1 1 15 3644 1 1 5 TRP CB C -1.950 -6.446 0.616 1.00 . A A . 5 TRP CB 1 1 15 3645 1 1 5 TRP CD1 C -0.268 -4.523 0.418 1.00 . A A . 5 TRP CD1 1 1 15 3646 1 1 5 TRP CD2 C 0.388 -6.425 -0.566 1.00 . A A . 5 TRP CD2 1 1 15 3647 1 1 5 TRP CE2 C 1.393 -5.456 -0.746 1.00 . A A . 5 TRP CE2 1 1 15 3648 1 1 5 TRP CE3 C 0.580 -7.703 -1.099 1.00 . A A . 5 TRP CE3 1 1 15 3649 1 1 5 TRP CG C -0.666 -5.808 0.182 1.00 . A A . 5 TRP CG 1 1 15 3650 1 1 5 TRP CH2 C 2.733 -6.984 -1.949 1.00 . A A . 5 TRP CH2 1 1 15 3651 1 1 5 TRP CZ2 C 2.571 -5.725 -1.438 1.00 . A A . 5 TRP CZ2 1 1 15 3652 1 1 5 TRP CZ3 C 1.750 -7.969 -1.785 1.00 . A A . 5 TRP CZ3 1 1 15 3653 1 1 5 TRP H H -4.288 -6.033 -0.861 1.00 . A A . 5 TRP H 1 1 15 3654 1 1 5 TRP HA H -1.853 -7.671 -1.136 1.00 . A A . 5 TRP HA 1 1 15 3655 1 1 5 TRP HB2 H -2.625 -5.662 0.925 1.00 . A A . 5 TRP HB2 1 1 15 3656 1 1 5 TRP HB3 H -1.737 -7.086 1.461 1.00 . A A . 5 TRP HB3 1 1 15 3657 1 1 5 TRP HD1 H -0.852 -3.796 0.962 1.00 . A A . 5 TRP HD1 1 1 15 3658 1 1 5 TRP HE1 H 1.467 -3.460 -0.103 1.00 . A A . 5 TRP HE1 1 1 15 3659 1 1 5 TRP HE3 H -0.166 -8.474 -0.983 1.00 . A A . 5 TRP HE3 1 1 15 3660 1 1 5 TRP HH2 H 3.631 -7.237 -2.492 1.00 . A A . 5 TRP HH2 1 1 15 3661 1 1 5 TRP HZ2 H 3.339 -4.978 -1.572 1.00 . A A . 5 TRP HZ2 1 1 15 3662 1 1 5 TRP HZ3 H 1.916 -8.950 -2.204 1.00 . A A . 5 TRP HZ3 1 1 15 3663 1 1 5 TRP N N -3.501 -6.438 -1.283 1.00 . A A . 5 TRP N 1 1 15 3664 1 1 5 TRP NE1 N 0.969 -4.304 -0.138 1.00 . A A . 5 TRP NE1 1 1 15 3665 1 1 5 TRP O O -3.332 -9.565 -0.359 1.00 . A A . 5 TRP O 1 1 15 3666 1 1 6 LYS C C -5.390 -10.229 0.927 1.00 . A A . 6 LYS C 1 1 15 3667 1 1 6 LYS CA C -4.873 -9.186 1.912 1.00 . A A . 6 LYS CA 1 1 15 3668 1 1 6 LYS CB C -6.047 -8.547 2.658 1.00 . A A . 6 LYS CB 1 1 15 3669 1 1 6 LYS CD C -7.799 -6.747 2.700 1.00 . A A . 6 LYS CD 1 1 15 3670 1 1 6 LYS CE C -9.158 -7.425 2.628 1.00 . A A . 6 LYS CE 1 1 15 3671 1 1 6 LYS CG C -6.767 -7.477 1.856 1.00 . A A . 6 LYS CG 1 1 15 3672 1 1 6 LYS H H -4.096 -7.246 1.574 1.00 . A A . 6 LYS H 1 1 15 3673 1 1 6 LYS HA H -4.226 -9.672 2.626 1.00 . A A . 6 LYS HA 1 1 15 3674 1 1 6 LYS HB2 H -6.760 -9.318 2.911 1.00 . A A . 6 LYS HB2 1 1 15 3675 1 1 6 LYS HB3 H -5.678 -8.097 3.569 1.00 . A A . 6 LYS HB3 1 1 15 3676 1 1 6 LYS HD2 H -7.468 -6.737 3.728 1.00 . A A . 6 LYS HD2 1 1 15 3677 1 1 6 LYS HD3 H -7.892 -5.732 2.340 1.00 . A A . 6 LYS HD3 1 1 15 3678 1 1 6 LYS HE2 H -9.505 -7.400 1.606 1.00 . A A . 6 LYS HE2 1 1 15 3679 1 1 6 LYS HE3 H -9.052 -8.451 2.947 1.00 . A A . 6 LYS HE3 1 1 15 3680 1 1 6 LYS HG2 H -6.043 -6.762 1.495 1.00 . A A . 6 LYS HG2 1 1 15 3681 1 1 6 LYS HG3 H -7.266 -7.943 1.018 1.00 . A A . 6 LYS HG3 1 1 15 3682 1 1 6 LYS HZ1 H -10.983 -6.454 2.931 1.00 . A A . 6 LYS HZ1 1 1 15 3683 1 1 6 LYS HZ2 H -9.741 -5.908 3.941 1.00 . A A . 6 LYS HZ2 1 1 15 3684 1 1 6 LYS HZ3 H -10.483 -7.398 4.243 1.00 . A A . 6 LYS HZ3 1 1 15 3685 1 1 6 LYS N N -4.094 -8.163 1.225 1.00 . A A . 6 LYS N 1 1 15 3686 1 1 6 LYS NZ N -10.162 -6.749 3.497 1.00 . A A . 6 LYS NZ 1 1 15 3687 1 1 6 LYS O O -5.226 -11.431 1.138 1.00 . A A . 6 LYS O 1 1 15 3688 1 1 7 ARG C C -5.466 -11.084 -2.147 1.00 . A A . 7 ARG C 1 1 15 3689 1 1 7 ARG CA C -6.554 -10.655 -1.167 1.00 . A A . 7 ARG CA 1 1 15 3690 1 1 7 ARG CB C -7.694 -9.971 -1.923 1.00 . A A . 7 ARG CB 1 1 15 3691 1 1 7 ARG CD C -10.136 -9.380 -2.013 1.00 . A A . 7 ARG CD 1 1 15 3692 1 1 7 ARG CG C -9.032 -10.047 -1.206 1.00 . A A . 7 ARG CG 1 1 15 3693 1 1 7 ARG CZ C -11.982 -9.307 -0.392 1.00 . A A . 7 ARG CZ 1 1 15 3694 1 1 7 ARG H H -6.113 -8.793 -0.262 1.00 . A A . 7 ARG H 1 1 15 3695 1 1 7 ARG HA H -6.939 -11.532 -0.669 1.00 . A A . 7 ARG HA 1 1 15 3696 1 1 7 ARG HB2 H -7.445 -8.929 -2.063 1.00 . A A . 7 ARG HB2 1 1 15 3697 1 1 7 ARG HB3 H -7.801 -10.440 -2.890 1.00 . A A . 7 ARG HB3 1 1 15 3698 1 1 7 ARG HD2 H -9.688 -8.668 -2.690 1.00 . A A . 7 ARG HD2 1 1 15 3699 1 1 7 ARG HD3 H -10.656 -10.138 -2.580 1.00 . A A . 7 ARG HD3 1 1 15 3700 1 1 7 ARG HE H -11.073 -7.705 -1.157 1.00 . A A . 7 ARG HE 1 1 15 3701 1 1 7 ARG HG2 H -9.290 -11.085 -1.054 1.00 . A A . 7 ARG HG2 1 1 15 3702 1 1 7 ARG HG3 H -8.947 -9.552 -0.251 1.00 . A A . 7 ARG HG3 1 1 15 3703 1 1 7 ARG HH11 H -11.403 -11.164 -0.936 1.00 . A A . 7 ARG HH11 1 1 15 3704 1 1 7 ARG HH12 H -12.704 -11.097 0.206 1.00 . A A . 7 ARG HH12 1 1 15 3705 1 1 7 ARG HH21 H -12.785 -7.605 0.347 1.00 . A A . 7 ARG HH21 1 1 15 3706 1 1 7 ARG HH22 H -13.490 -9.073 0.935 1.00 . A A . 7 ARG HH22 1 1 15 3707 1 1 7 ARG N N -6.013 -9.762 -0.150 1.00 . A A . 7 ARG N 1 1 15 3708 1 1 7 ARG NE N -11.094 -8.684 -1.158 1.00 . A A . 7 ARG NE 1 1 15 3709 1 1 7 ARG NH1 N -12.034 -10.631 -0.373 1.00 . A A . 7 ARG NH1 1 1 15 3710 1 1 7 ARG NH2 N -12.821 -8.603 0.358 1.00 . A A . 7 ARG NH2 1 1 15 3711 1 1 7 ARG O O -4.980 -12.215 -2.097 1.00 . A A . 7 ARG O 1 1 15 3712 1 1 8 LYS C C -2.667 -10.402 -3.402 1.00 . A A . 8 LYS C 1 1 15 3713 1 1 8 LYS CA C -4.056 -10.458 -4.030 1.00 . A A . 8 LYS CA 1 1 15 3714 1 1 8 LYS CB C -4.145 -9.460 -5.187 1.00 . A A . 8 LYS CB 1 1 15 3715 1 1 8 LYS CD C -5.444 -10.426 -7.108 1.00 . A A . 8 LYS CD 1 1 15 3716 1 1 8 LYS CE C -5.933 -11.818 -6.737 1.00 . A A . 8 LYS CE 1 1 15 3717 1 1 8 LYS CG C -5.478 -9.487 -5.913 1.00 . A A . 8 LYS CG 1 1 15 3718 1 1 8 LYS H H -5.511 -9.291 -3.029 1.00 . A A . 8 LYS H 1 1 15 3719 1 1 8 LYS HA H -4.226 -11.453 -4.411 1.00 . A A . 8 LYS HA 1 1 15 3720 1 1 8 LYS HB2 H -3.990 -8.463 -4.800 1.00 . A A . 8 LYS HB2 1 1 15 3721 1 1 8 LYS HB3 H -3.365 -9.684 -5.901 1.00 . A A . 8 LYS HB3 1 1 15 3722 1 1 8 LYS HD2 H -6.079 -10.029 -7.886 1.00 . A A . 8 LYS HD2 1 1 15 3723 1 1 8 LYS HD3 H -4.428 -10.495 -7.470 1.00 . A A . 8 LYS HD3 1 1 15 3724 1 1 8 LYS HE2 H -5.258 -12.240 -6.009 1.00 . A A . 8 LYS HE2 1 1 15 3725 1 1 8 LYS HE3 H -6.920 -11.735 -6.308 1.00 . A A . 8 LYS HE3 1 1 15 3726 1 1 8 LYS HG2 H -6.244 -9.822 -5.229 1.00 . A A . 8 LYS HG2 1 1 15 3727 1 1 8 LYS HG3 H -5.711 -8.490 -6.258 1.00 . A A . 8 LYS HG3 1 1 15 3728 1 1 8 LYS HZ1 H -5.322 -13.504 -7.808 1.00 . A A . 8 LYS HZ1 1 1 15 3729 1 1 8 LYS HZ2 H -5.748 -12.191 -8.784 1.00 . A A . 8 LYS HZ2 1 1 15 3730 1 1 8 LYS HZ3 H -6.952 -13.107 -8.027 1.00 . A A . 8 LYS HZ3 1 1 15 3731 1 1 8 LYS N N -5.087 -10.175 -3.039 1.00 . A A . 8 LYS N 1 1 15 3732 1 1 8 LYS NZ N -5.993 -12.718 -7.922 1.00 . A A . 8 LYS NZ 1 1 15 3733 1 1 8 LYS O O -2.223 -9.347 -2.947 1.00 . A A . 8 LYS O 1 1 15 3734 1 1 9 CYS C C 0.384 -11.956 -3.884 1.00 . A A . 9 CYS C 1 1 15 3735 1 1 9 CYS CA C -0.646 -11.622 -2.810 1.00 . A A . 9 CYS CA 1 1 15 3736 1 1 9 CYS CB C -0.605 -12.674 -1.701 1.00 . A A . 9 CYS CB 1 1 15 3737 1 1 9 CYS H H -2.393 -12.349 -3.760 1.00 . A A . 9 CYS H 1 1 15 3738 1 1 9 CYS HA H -0.409 -10.657 -2.388 1.00 . A A . 9 CYS HA 1 1 15 3739 1 1 9 CYS HB2 H 0.422 -12.837 -1.408 1.00 . A A . 9 CYS HB2 1 1 15 3740 1 1 9 CYS HB3 H -1.162 -12.312 -0.850 1.00 . A A . 9 CYS HB3 1 1 15 3741 1 1 9 CYS HG H -2.576 -14.287 -1.822 1.00 . A A . 9 CYS HG 1 1 15 3742 1 1 9 CYS N N -1.986 -11.542 -3.382 1.00 . A A . 9 CYS N 1 1 15 3743 1 1 9 CYS O O 0.900 -13.072 -3.959 1.00 . A A . 9 CYS O 1 1 15 3744 1 1 9 CYS SG S -1.300 -14.274 -2.176 1.00 . A A . 9 CYS SG 1 1 15 3745 1 1 10 PRO C C 3.091 -11.266 -5.309 1.00 . A A . 10 PRO C 1 1 15 3746 1 1 10 PRO CA C 1.662 -11.133 -5.823 1.00 . A A . 10 PRO CA 1 1 15 3747 1 1 10 PRO CB C 1.504 -9.847 -6.639 1.00 . A A . 10 PRO CB 1 1 15 3748 1 1 10 PRO CD C 0.116 -9.613 -4.707 1.00 . A A . 10 PRO CD 1 1 15 3749 1 1 10 PRO CG C 0.981 -8.845 -5.668 1.00 . A A . 10 PRO CG 1 1 15 3750 1 1 10 PRO HA H 1.423 -11.985 -6.443 1.00 . A A . 10 PRO HA 1 1 15 3751 1 1 10 PRO HB2 H 2.465 -9.550 -7.035 1.00 . A A . 10 PRO HB2 1 1 15 3752 1 1 10 PRO HB3 H 0.810 -10.013 -7.448 1.00 . A A . 10 PRO HB3 1 1 15 3753 1 1 10 PRO HD2 H 0.183 -9.187 -3.717 1.00 . A A . 10 PRO HD2 1 1 15 3754 1 1 10 PRO HD3 H -0.909 -9.622 -5.047 1.00 . A A . 10 PRO HD3 1 1 15 3755 1 1 10 PRO HG2 H 1.801 -8.378 -5.144 1.00 . A A . 10 PRO HG2 1 1 15 3756 1 1 10 PRO HG3 H 0.394 -8.103 -6.189 1.00 . A A . 10 PRO HG3 1 1 15 3757 1 1 10 PRO N N 0.692 -10.968 -4.737 1.00 . A A . 10 PRO N 1 1 15 3758 1 1 10 PRO O O 3.867 -12.085 -5.804 1.00 . A A . 10 PRO O 1 1 15 3759 1 1 11 LEU C C 4.711 -10.829 -2.245 1.00 . A A . 11 LEU C 1 1 15 3760 1 1 11 LEU CA C 4.771 -10.484 -3.730 1.00 . A A . 11 LEU CA 1 1 15 3761 1 1 11 LEU CB C 5.461 -9.132 -3.923 1.00 . A A . 11 LEU CB 1 1 15 3762 1 1 11 LEU CD1 C 5.259 -6.689 -4.445 1.00 . A A . 11 LEU CD1 1 1 15 3763 1 1 11 LEU CD2 C 4.583 -8.390 -6.151 1.00 . A A . 11 LEU CD2 1 1 15 3764 1 1 11 LEU CG C 4.653 -8.067 -4.665 1.00 . A A . 11 LEU CG 1 1 15 3765 1 1 11 LEU H H 2.773 -9.825 -3.960 1.00 . A A . 11 LEU H 1 1 15 3766 1 1 11 LEU HA H 5.340 -11.246 -4.242 1.00 . A A . 11 LEU HA 1 1 15 3767 1 1 11 LEU HB2 H 5.703 -8.742 -2.946 1.00 . A A . 11 LEU HB2 1 1 15 3768 1 1 11 LEU HB3 H 6.373 -9.304 -4.477 1.00 . A A . 11 LEU HB3 1 1 15 3769 1 1 11 LEU HD11 H 6.290 -6.793 -4.144 1.00 . A A . 11 LEU HD11 1 1 15 3770 1 1 11 LEU HD12 H 4.708 -6.173 -3.673 1.00 . A A . 11 LEU HD12 1 1 15 3771 1 1 11 LEU HD13 H 5.206 -6.122 -5.364 1.00 . A A . 11 LEU HD13 1 1 15 3772 1 1 11 LEU HD21 H 4.638 -9.459 -6.289 1.00 . A A . 11 LEU HD21 1 1 15 3773 1 1 11 LEU HD22 H 5.410 -7.917 -6.661 1.00 . A A . 11 LEU HD22 1 1 15 3774 1 1 11 LEU HD23 H 3.652 -8.022 -6.555 1.00 . A A . 11 LEU HD23 1 1 15 3775 1 1 11 LEU HG H 3.644 -8.053 -4.277 1.00 . A A . 11 LEU HG 1 1 15 3776 1 1 11 LEU N N 3.434 -10.456 -4.313 1.00 . A A . 11 LEU N 1 1 15 3777 1 1 11 LEU O O 4.991 -11.961 -1.849 1.00 . A A . 11 LEU O 1 1 15 3778 1 1 12 PHE C C 2.838 -9.727 0.511 1.00 . A A . 12 PHE C 1 1 15 3779 1 1 12 PHE CA C 4.244 -10.048 0.012 1.00 . A A . 12 PHE CA 1 1 15 3780 1 1 12 PHE CB C 5.267 -9.175 0.741 1.00 . A A . 12 PHE CB 1 1 15 3781 1 1 12 PHE CD1 C 5.323 -6.898 -0.313 1.00 . A A . 12 PHE CD1 1 1 15 3782 1 1 12 PHE CD2 C 7.099 -8.415 -0.797 1.00 . A A . 12 PHE CD2 1 1 15 3783 1 1 12 PHE CE1 C 5.912 -5.945 -1.123 1.00 . A A . 12 PHE CE1 1 1 15 3784 1 1 12 PHE CE2 C 7.692 -7.465 -1.607 1.00 . A A . 12 PHE CE2 1 1 15 3785 1 1 12 PHE CG C 5.909 -8.142 -0.140 1.00 . A A . 12 PHE CG 1 1 15 3786 1 1 12 PHE CZ C 7.097 -6.230 -1.772 1.00 . A A . 12 PHE CZ 1 1 15 3787 1 1 12 PHE H H 4.131 -8.967 -1.805 1.00 . A A . 12 PHE H 1 1 15 3788 1 1 12 PHE HA H 4.457 -11.086 0.217 1.00 . A A . 12 PHE HA 1 1 15 3789 1 1 12 PHE HB2 H 4.777 -8.659 1.553 1.00 . A A . 12 PHE HB2 1 1 15 3790 1 1 12 PHE HB3 H 6.048 -9.805 1.139 1.00 . A A . 12 PHE HB3 1 1 15 3791 1 1 12 PHE HD1 H 4.395 -6.675 0.195 1.00 . A A . 12 PHE HD1 1 1 15 3792 1 1 12 PHE HD2 H 7.565 -9.381 -0.670 1.00 . A A . 12 PHE HD2 1 1 15 3793 1 1 12 PHE HE1 H 5.443 -4.980 -1.248 1.00 . A A . 12 PHE HE1 1 1 15 3794 1 1 12 PHE HE2 H 8.619 -7.690 -2.114 1.00 . A A . 12 PHE HE2 1 1 15 3795 1 1 12 PHE HZ H 7.559 -5.486 -2.404 1.00 . A A . 12 PHE HZ 1 1 15 3796 1 1 12 PHE N N 4.342 -9.848 -1.429 1.00 . A A . 12 PHE N 1 1 15 3797 1 1 12 PHE O O 2.557 -8.606 0.932 1.00 . A A . 12 PHE O 1 1 15 3798 1 1 13 GLY C C 0.439 -10.715 2.406 1.00 . A A . 13 GLY C 1 1 15 3799 1 1 13 GLY CA C 0.591 -10.526 0.909 1.00 . A A . 13 GLY CA 1 1 15 3800 1 1 13 GLY H H 2.237 -11.596 0.115 1.00 . A A . 13 GLY H 1 1 15 3801 1 1 13 GLY HA2 H 0.278 -9.526 0.650 1.00 . A A . 13 GLY HA2 1 1 15 3802 1 1 13 GLY HA3 H -0.048 -11.235 0.402 1.00 . A A . 13 GLY HA3 1 1 15 3803 1 1 13 GLY N N 1.957 -10.722 0.460 1.00 . A A . 13 GLY N 1 1 15 3804 1 1 13 GLY O O -0.643 -10.518 2.958 1.00 . A A . 13 GLY O 1 1 15 3805 1 1 14 LYS C C 1.826 -10.025 5.254 1.00 . A A . 14 LYS C 1 1 15 3806 1 1 14 LYS CA C 1.512 -11.317 4.506 1.00 . A A . 14 LYS CA 1 1 15 3807 1 1 14 LYS CB C 2.522 -12.400 4.891 1.00 . A A . 14 LYS CB 1 1 15 3808 1 1 14 LYS CD C 4.426 -12.272 6.525 1.00 . A A . 14 LYS CD 1 1 15 3809 1 1 14 LYS CE C 4.884 -10.824 6.612 1.00 . A A . 14 LYS CE 1 1 15 3810 1 1 14 LYS CG C 2.919 -12.370 6.357 1.00 . A A . 14 LYS CG 1 1 15 3811 1 1 14 LYS H H 2.361 -11.242 2.569 1.00 . A A . 14 LYS H 1 1 15 3812 1 1 14 LYS HA H 0.521 -11.647 4.782 1.00 . A A . 14 LYS HA 1 1 15 3813 1 1 14 LYS HB2 H 2.094 -13.368 4.675 1.00 . A A . 14 LYS HB2 1 1 15 3814 1 1 14 LYS HB3 H 3.415 -12.270 4.296 1.00 . A A . 14 LYS HB3 1 1 15 3815 1 1 14 LYS HD2 H 4.712 -12.783 7.432 1.00 . A A . 14 LYS HD2 1 1 15 3816 1 1 14 LYS HD3 H 4.905 -12.742 5.678 1.00 . A A . 14 LYS HD3 1 1 15 3817 1 1 14 LYS HE2 H 5.955 -10.806 6.739 1.00 . A A . 14 LYS HE2 1 1 15 3818 1 1 14 LYS HE3 H 4.622 -10.322 5.693 1.00 . A A . 14 LYS HE3 1 1 15 3819 1 1 14 LYS HG2 H 2.458 -11.513 6.827 1.00 . A A . 14 LYS HG2 1 1 15 3820 1 1 14 LYS HG3 H 2.570 -13.275 6.833 1.00 . A A . 14 LYS HG3 1 1 15 3821 1 1 14 LYS HZ1 H 3.284 -9.815 7.498 1.00 . A A . 14 LYS HZ1 1 1 15 3822 1 1 14 LYS HZ2 H 4.802 -9.264 7.998 1.00 . A A . 14 LYS HZ2 1 1 15 3823 1 1 14 LYS HZ3 H 4.201 -10.732 8.584 1.00 . A A . 14 LYS HZ3 1 1 15 3824 1 1 14 LYS N N 1.527 -11.100 3.065 1.00 . A A . 14 LYS N 1 1 15 3825 1 1 14 LYS NZ N 4.248 -10.109 7.753 1.00 . A A . 14 LYS NZ 1 1 15 3826 1 1 14 LYS O O 1.247 -9.748 6.303 1.00 . A A . 14 LYS O 1 1 15 3827 1 1 15 GLY C C 2.722 -6.779 4.505 1.00 . A A . 15 GLY C 1 1 15 3828 1 1 15 GLY CA C 3.120 -7.985 5.334 1.00 . A A . 15 GLY CA 1 1 15 3829 1 1 15 GLY H H 3.175 -9.511 3.868 1.00 . A A . 15 GLY H 1 1 15 3830 1 1 15 GLY HA2 H 2.639 -7.920 6.299 1.00 . A A . 15 GLY HA2 1 1 15 3831 1 1 15 GLY HA3 H 4.191 -7.971 5.476 1.00 . A A . 15 GLY HA3 1 1 15 3832 1 1 15 GLY N N 2.746 -9.238 4.706 1.00 . A A . 15 GLY N 1 1 15 3833 1 1 15 GLY O O 3.408 -5.758 4.512 1.00 . A A . 15 GLY O 1 1 15 3834 1 1 16 GLY C C 1.071 -4.492 3.715 1.00 . A A . 16 GLY C 1 1 15 3835 1 1 16 GLY CA C 1.141 -5.803 2.958 1.00 . A A . 16 GLY CA 1 1 15 3836 1 1 16 GLY H H 1.102 -7.737 3.821 1.00 . A A . 16 GLY H 1 1 15 3837 1 1 16 GLY HA2 H 1.812 -5.688 2.120 1.00 . A A . 16 GLY HA2 1 1 15 3838 1 1 16 GLY HA3 H 0.156 -6.044 2.586 1.00 . A A . 16 GLY HA3 1 1 15 3839 1 1 16 GLY N N 1.609 -6.898 3.787 1.00 . A A . 16 GLY N 1 1 15 3840 1 1 16 GLY O O 0.129 -3.718 3.543 1.00 . A A . 16 GLY O 1 1 16 3841 1 1 1 VAL C C 1.203 -0.762 -2.687 1.00 . A A . 1 VAL C 1 1 16 3842 1 1 1 VAL CA C 1.994 0.004 -1.632 1.00 . A A . 1 VAL CA 1 1 16 3843 1 1 1 VAL CB C 3.022 -0.946 -0.989 1.00 . A A . 1 VAL CB 1 1 16 3844 1 1 1 VAL CG1 C 2.487 -1.504 0.321 1.00 . A A . 1 VAL CG1 1 1 16 3845 1 1 1 VAL CG2 C 3.383 -2.069 -1.949 1.00 . A A . 1 VAL CG2 1 1 16 3846 1 1 1 VAL H1 H 1.455 1.278 -0.031 1.00 . A A . 1 VAL H1 1 1 16 3847 1 1 1 VAL HA H 2.530 0.809 -2.112 1.00 . A A . 1 VAL HA 1 1 16 3848 1 1 1 VAL HB H 3.918 -0.382 -0.775 1.00 . A A . 1 VAL HB 1 1 16 3849 1 1 1 VAL HG11 H 2.782 -0.857 1.135 1.00 . A A . 1 VAL HG11 1 1 16 3850 1 1 1 VAL HG12 H 1.409 -1.558 0.276 1.00 . A A . 1 VAL HG12 1 1 16 3851 1 1 1 VAL HG13 H 2.891 -2.492 0.483 1.00 . A A . 1 VAL HG13 1 1 16 3852 1 1 1 VAL HG21 H 3.467 -1.673 -2.950 1.00 . A A . 1 VAL HG21 1 1 16 3853 1 1 1 VAL HG22 H 4.326 -2.507 -1.654 1.00 . A A . 1 VAL HG22 1 1 16 3854 1 1 1 VAL HG23 H 2.613 -2.826 -1.924 1.00 . A A . 1 VAL HG23 1 1 16 3855 1 1 1 VAL N N 1.108 0.585 -0.631 1.00 . A A . 1 VAL N 1 1 16 3856 1 1 1 VAL O O 1.263 -0.444 -3.875 1.00 . A A . 1 VAL O 1 1 16 3857 1 1 2 ALA C C -1.805 -2.609 -2.711 1.00 . A A . 2 ALA C 1 1 16 3858 1 1 2 ALA CA C -0.345 -2.581 -3.151 1.00 . A A . 2 ALA CA 1 1 16 3859 1 1 2 ALA CB C 0.211 -3.995 -3.232 1.00 . A A . 2 ALA CB 1 1 16 3860 1 1 2 ALA H H 0.454 -1.976 -1.287 1.00 . A A . 2 ALA H 1 1 16 3861 1 1 2 ALA HA H -0.285 -2.140 -4.136 1.00 . A A . 2 ALA HA 1 1 16 3862 1 1 2 ALA HB1 H 0.177 -4.336 -4.256 1.00 . A A . 2 ALA HB1 1 1 16 3863 1 1 2 ALA HB2 H 1.234 -4.000 -2.884 1.00 . A A . 2 ALA HB2 1 1 16 3864 1 1 2 ALA HB3 H -0.383 -4.651 -2.613 1.00 . A A . 2 ALA HB3 1 1 16 3865 1 1 2 ALA N N 0.461 -1.772 -2.245 1.00 . A A . 2 ALA N 1 1 16 3866 1 1 2 ALA O O -2.119 -3.026 -1.596 1.00 . A A . 2 ALA O 1 1 16 3867 1 1 3 ARG C C -4.631 -3.533 -2.956 1.00 . A A . 3 ARG C 1 1 16 3868 1 1 3 ARG CA C -4.119 -2.136 -3.295 1.00 . A A . 3 ARG CA 1 1 16 3869 1 1 3 ARG CB C -4.900 -1.570 -4.482 1.00 . A A . 3 ARG CB 1 1 16 3870 1 1 3 ARG CD C -5.441 -1.930 -6.910 1.00 . A A . 3 ARG CD 1 1 16 3871 1 1 3 ARG CG C -5.190 -2.595 -5.565 1.00 . A A . 3 ARG CG 1 1 16 3872 1 1 3 ARG CZ C -7.343 -1.353 -8.357 1.00 . A A . 3 ARG CZ 1 1 16 3873 1 1 3 ARG H H -2.381 -1.844 -4.466 1.00 . A A . 3 ARG H 1 1 16 3874 1 1 3 ARG HA H -4.267 -1.494 -2.439 1.00 . A A . 3 ARG HA 1 1 16 3875 1 1 3 ARG HB2 H -5.842 -1.179 -4.126 1.00 . A A . 3 ARG HB2 1 1 16 3876 1 1 3 ARG HB3 H -4.330 -0.765 -4.922 1.00 . A A . 3 ARG HB3 1 1 16 3877 1 1 3 ARG HD2 H -4.999 -0.945 -6.897 1.00 . A A . 3 ARG HD2 1 1 16 3878 1 1 3 ARG HD3 H -4.974 -2.523 -7.682 1.00 . A A . 3 ARG HD3 1 1 16 3879 1 1 3 ARG HE H -7.498 -2.075 -6.504 1.00 . A A . 3 ARG HE 1 1 16 3880 1 1 3 ARG HG2 H -4.343 -3.259 -5.657 1.00 . A A . 3 ARG HG2 1 1 16 3881 1 1 3 ARG HG3 H -6.065 -3.163 -5.286 1.00 . A A . 3 ARG HG3 1 1 16 3882 1 1 3 ARG HH11 H -5.524 -1.045 -9.180 1.00 . A A . 3 ARG HH11 1 1 16 3883 1 1 3 ARG HH12 H -6.873 -0.642 -10.189 1.00 . A A . 3 ARG HH12 1 1 16 3884 1 1 3 ARG HH21 H -9.283 -1.549 -7.823 1.00 . A A . 3 ARG HH21 1 1 16 3885 1 1 3 ARG HH22 H -9.011 -0.928 -9.416 1.00 . A A . 3 ARG HH22 1 1 16 3886 1 1 3 ARG N N -2.693 -2.163 -3.594 1.00 . A A . 3 ARG N 1 1 16 3887 1 1 3 ARG NE N -6.866 -1.807 -7.203 1.00 . A A . 3 ARG NE 1 1 16 3888 1 1 3 ARG NH1 N -6.512 -0.982 -9.321 1.00 . A A . 3 ARG NH1 1 1 16 3889 1 1 3 ARG NH2 N -8.653 -1.270 -8.548 1.00 . A A . 3 ARG NH2 1 1 16 3890 1 1 3 ARG O O -5.591 -3.688 -2.203 1.00 . A A . 3 ARG O 1 1 16 3891 1 1 4 GLY C C -3.377 -6.674 -2.423 1.00 . A A . 4 GLY C 1 1 16 3892 1 1 4 GLY CA C -4.386 -5.919 -3.265 1.00 . A A . 4 GLY CA 1 1 16 3893 1 1 4 GLY H H -3.223 -4.365 -4.111 1.00 . A A . 4 GLY H 1 1 16 3894 1 1 4 GLY HA2 H -5.336 -5.914 -2.752 1.00 . A A . 4 GLY HA2 1 1 16 3895 1 1 4 GLY HA3 H -4.501 -6.429 -4.210 1.00 . A A . 4 GLY HA3 1 1 16 3896 1 1 4 GLY N N -3.982 -4.548 -3.519 1.00 . A A . 4 GLY N 1 1 16 3897 1 1 4 GLY O O -2.365 -7.153 -2.935 1.00 . A A . 4 GLY O 1 1 16 3898 1 1 5 TRP C C -3.496 -8.593 0.523 1.00 . A A . 5 TRP C 1 1 16 3899 1 1 5 TRP CA C -2.757 -7.480 -0.212 1.00 . A A . 5 TRP CA 1 1 16 3900 1 1 5 TRP CB C -2.154 -6.500 0.795 1.00 . A A . 5 TRP CB 1 1 16 3901 1 1 5 TRP CD1 C -0.622 -4.487 0.382 1.00 . A A . 5 TRP CD1 1 1 16 3902 1 1 5 TRP CD2 C 0.187 -6.432 -0.379 1.00 . A A . 5 TRP CD2 1 1 16 3903 1 1 5 TRP CE2 C 1.118 -5.414 -0.667 1.00 . A A . 5 TRP CE2 1 1 16 3904 1 1 5 TRP CE3 C 0.482 -7.743 -0.763 1.00 . A A . 5 TRP CE3 1 1 16 3905 1 1 5 TRP CG C -0.918 -5.818 0.292 1.00 . A A . 5 TRP CG 1 1 16 3906 1 1 5 TRP CH2 C 2.583 -6.962 -1.686 1.00 . A A . 5 TRP CH2 1 1 16 3907 1 1 5 TRP CZ2 C 2.320 -5.669 -1.322 1.00 . A A . 5 TRP CZ2 1 1 16 3908 1 1 5 TRP CZ3 C 1.676 -7.994 -1.413 1.00 . A A . 5 TRP CZ3 1 1 16 3909 1 1 5 TRP H H -4.473 -6.376 -0.778 1.00 . A A . 5 TRP H 1 1 16 3910 1 1 5 TRP HA H -1.961 -7.917 -0.797 1.00 . A A . 5 TRP HA 1 1 16 3911 1 1 5 TRP HB2 H -2.883 -5.739 1.028 1.00 . A A . 5 TRP HB2 1 1 16 3912 1 1 5 TRP HB3 H -1.897 -7.035 1.697 1.00 . A A . 5 TRP HB3 1 1 16 3913 1 1 5 TRP HD1 H -1.266 -3.751 0.838 1.00 . A A . 5 TRP HD1 1 1 16 3914 1 1 5 TRP HE1 H 1.032 -3.360 -0.254 1.00 . A A . 5 TRP HE1 1 1 16 3915 1 1 5 TRP HE3 H -0.204 -8.552 -0.561 1.00 . A A . 5 TRP HE3 1 1 16 3916 1 1 5 TRP HH2 H 3.503 -7.204 -2.196 1.00 . A A . 5 TRP HH2 1 1 16 3917 1 1 5 TRP HZ2 H 3.030 -4.884 -1.539 1.00 . A A . 5 TRP HZ2 1 1 16 3918 1 1 5 TRP HZ3 H 1.921 -9.001 -1.717 1.00 . A A . 5 TRP HZ3 1 1 16 3919 1 1 5 TRP N N -3.651 -6.779 -1.128 1.00 . A A . 5 TRP N 1 1 16 3920 1 1 5 TRP NE1 N 0.600 -4.238 -0.194 1.00 . A A . 5 TRP NE1 1 1 16 3921 1 1 5 TRP O O -3.378 -9.768 0.172 1.00 . A A . 5 TRP O 1 1 16 3922 1 1 6 LYS C C -5.416 -10.384 1.476 1.00 . A A . 6 LYS C 1 1 16 3923 1 1 6 LYS CA C -5.017 -9.185 2.329 1.00 . A A . 6 LYS CA 1 1 16 3924 1 1 6 LYS CB C -6.266 -8.525 2.918 1.00 . A A . 6 LYS CB 1 1 16 3925 1 1 6 LYS CD C -6.418 -6.051 2.512 1.00 . A A . 6 LYS CD 1 1 16 3926 1 1 6 LYS CE C -7.605 -5.233 2.997 1.00 . A A . 6 LYS CE 1 1 16 3927 1 1 6 LYS CG C -6.847 -7.430 2.041 1.00 . A A . 6 LYS CG 1 1 16 3928 1 1 6 LYS H H -4.311 -7.267 1.777 1.00 . A A . 6 LYS H 1 1 16 3929 1 1 6 LYS HA H -4.386 -9.526 3.136 1.00 . A A . 6 LYS HA 1 1 16 3930 1 1 6 LYS HB2 H -7.023 -9.282 3.063 1.00 . A A . 6 LYS HB2 1 1 16 3931 1 1 6 LYS HB3 H -6.013 -8.094 3.876 1.00 . A A . 6 LYS HB3 1 1 16 3932 1 1 6 LYS HD2 H -5.715 -6.160 3.325 1.00 . A A . 6 LYS HD2 1 1 16 3933 1 1 6 LYS HD3 H -5.944 -5.531 1.692 1.00 . A A . 6 LYS HD3 1 1 16 3934 1 1 6 LYS HE2 H -8.218 -5.855 3.631 1.00 . A A . 6 LYS HE2 1 1 16 3935 1 1 6 LYS HE3 H -7.237 -4.391 3.565 1.00 . A A . 6 LYS HE3 1 1 16 3936 1 1 6 LYS HG2 H -6.505 -7.575 1.027 1.00 . A A . 6 LYS HG2 1 1 16 3937 1 1 6 LYS HG3 H -7.926 -7.492 2.071 1.00 . A A . 6 LYS HG3 1 1 16 3938 1 1 6 LYS HZ1 H -7.904 -4.815 0.973 1.00 . A A . 6 LYS HZ1 1 1 16 3939 1 1 6 LYS HZ2 H -8.675 -3.731 2.017 1.00 . A A . 6 LYS HZ2 1 1 16 3940 1 1 6 LYS HZ3 H -9.309 -5.283 1.791 1.00 . A A . 6 LYS HZ3 1 1 16 3941 1 1 6 LYS N N -4.257 -8.218 1.545 1.00 . A A . 6 LYS N 1 1 16 3942 1 1 6 LYS NZ N -8.431 -4.730 1.865 1.00 . A A . 6 LYS NZ 1 1 16 3943 1 1 6 LYS O O -5.190 -11.532 1.858 1.00 . A A . 6 LYS O 1 1 16 3944 1 1 7 ARG C C -5.304 -11.582 -1.517 1.00 . A A . 7 ARG C 1 1 16 3945 1 1 7 ARG CA C -6.441 -11.167 -0.588 1.00 . A A . 7 ARG CA 1 1 16 3946 1 1 7 ARG CB C -7.644 -10.702 -1.412 1.00 . A A . 7 ARG CB 1 1 16 3947 1 1 7 ARG CD C -8.604 -8.801 -2.745 1.00 . A A . 7 ARG CD 1 1 16 3948 1 1 7 ARG CG C -7.733 -9.192 -1.562 1.00 . A A . 7 ARG CG 1 1 16 3949 1 1 7 ARG CZ C -10.540 -7.362 -3.219 1.00 . A A . 7 ARG CZ 1 1 16 3950 1 1 7 ARG H H -6.164 -9.174 0.070 1.00 . A A . 7 ARG H 1 1 16 3951 1 1 7 ARG HA H -6.732 -12.018 0.009 1.00 . A A . 7 ARG HA 1 1 16 3952 1 1 7 ARG HB2 H -7.579 -11.137 -2.399 1.00 . A A . 7 ARG HB2 1 1 16 3953 1 1 7 ARG HB3 H -8.547 -11.049 -0.934 1.00 . A A . 7 ARG HB3 1 1 16 3954 1 1 7 ARG HD2 H -7.977 -8.359 -3.506 1.00 . A A . 7 ARG HD2 1 1 16 3955 1 1 7 ARG HD3 H -9.075 -9.689 -3.138 1.00 . A A . 7 ARG HD3 1 1 16 3956 1 1 7 ARG HE H -9.662 -7.541 -1.437 1.00 . A A . 7 ARG HE 1 1 16 3957 1 1 7 ARG HG2 H -8.159 -8.775 -0.662 1.00 . A A . 7 ARG HG2 1 1 16 3958 1 1 7 ARG HG3 H -6.739 -8.796 -1.710 1.00 . A A . 7 ARG HG3 1 1 16 3959 1 1 7 ARG HH11 H -9.850 -8.407 -4.804 1.00 . A A . 7 ARG HH11 1 1 16 3960 1 1 7 ARG HH12 H -11.215 -7.389 -5.124 1.00 . A A . 7 ARG HH12 1 1 16 3961 1 1 7 ARG HH21 H -11.459 -6.197 -1.846 1.00 . A A . 7 ARG HH21 1 1 16 3962 1 1 7 ARG HH22 H -12.128 -6.131 -3.441 1.00 . A A . 7 ARG HH22 1 1 16 3963 1 1 7 ARG N N -6.011 -10.110 0.319 1.00 . A A . 7 ARG N 1 1 16 3964 1 1 7 ARG NE N -9.639 -7.841 -2.369 1.00 . A A . 7 ARG NE 1 1 16 3965 1 1 7 ARG NH1 N -10.534 -7.751 -4.486 1.00 . A A . 7 ARG NH1 1 1 16 3966 1 1 7 ARG NH2 N -11.451 -6.492 -2.801 1.00 . A A . 7 ARG NH2 1 1 16 3967 1 1 7 ARG O O -4.699 -12.640 -1.341 1.00 . A A . 7 ARG O 1 1 16 3968 1 1 8 LYS C C -2.585 -10.864 -2.815 1.00 . A A . 8 LYS C 1 1 16 3969 1 1 8 LYS CA C -3.956 -11.022 -3.465 1.00 . A A . 8 LYS CA 1 1 16 3970 1 1 8 LYS CB C -4.071 -10.088 -4.672 1.00 . A A . 8 LYS CB 1 1 16 3971 1 1 8 LYS CD C -5.877 -11.447 -5.768 1.00 . A A . 8 LYS CD 1 1 16 3972 1 1 8 LYS CE C -4.982 -11.948 -6.891 1.00 . A A . 8 LYS CE 1 1 16 3973 1 1 8 LYS CG C -5.456 -10.066 -5.294 1.00 . A A . 8 LYS CG 1 1 16 3974 1 1 8 LYS H H -5.538 -9.916 -2.596 1.00 . A A . 8 LYS H 1 1 16 3975 1 1 8 LYS HA H -4.068 -12.042 -3.797 1.00 . A A . 8 LYS HA 1 1 16 3976 1 1 8 LYS HB2 H -3.822 -9.084 -4.361 1.00 . A A . 8 LYS HB2 1 1 16 3977 1 1 8 LYS HB3 H -3.366 -10.407 -5.426 1.00 . A A . 8 LYS HB3 1 1 16 3978 1 1 8 LYS HD2 H -5.816 -12.137 -4.939 1.00 . A A . 8 LYS HD2 1 1 16 3979 1 1 8 LYS HD3 H -6.896 -11.400 -6.125 1.00 . A A . 8 LYS HD3 1 1 16 3980 1 1 8 LYS HE2 H -4.932 -11.191 -7.658 1.00 . A A . 8 LYS HE2 1 1 16 3981 1 1 8 LYS HE3 H -3.993 -12.123 -6.493 1.00 . A A . 8 LYS HE3 1 1 16 3982 1 1 8 LYS HG2 H -6.166 -9.718 -4.558 1.00 . A A . 8 LYS HG2 1 1 16 3983 1 1 8 LYS HG3 H -5.451 -9.391 -6.138 1.00 . A A . 8 LYS HG3 1 1 16 3984 1 1 8 LYS HZ1 H -5.849 -13.842 -6.740 1.00 . A A . 8 LYS HZ1 1 1 16 3985 1 1 8 LYS HZ2 H -4.735 -13.697 -8.005 1.00 . A A . 8 LYS HZ2 1 1 16 3986 1 1 8 LYS HZ3 H -6.271 -13.005 -8.149 1.00 . A A . 8 LYS HZ3 1 1 16 3987 1 1 8 LYS N N -5.020 -10.743 -2.507 1.00 . A A . 8 LYS N 1 1 16 3988 1 1 8 LYS NZ N -5.495 -13.211 -7.488 1.00 . A A . 8 LYS NZ 1 1 16 3989 1 1 8 LYS O O -2.191 -9.760 -2.435 1.00 . A A . 8 LYS O 1 1 16 3990 1 1 9 CYS C C 0.536 -12.301 -3.121 1.00 . A A . 9 CYS C 1 1 16 3991 1 1 9 CYS CA C -0.534 -11.955 -2.090 1.00 . A A . 9 CYS CA 1 1 16 3992 1 1 9 CYS CB C -0.470 -12.939 -0.921 1.00 . A A . 9 CYS CB 1 1 16 3993 1 1 9 CYS H H -2.230 -12.821 -3.015 1.00 . A A . 9 CYS H 1 1 16 3994 1 1 9 CYS HA H -0.351 -10.958 -1.721 1.00 . A A . 9 CYS HA 1 1 16 3995 1 1 9 CYS HB2 H -0.430 -13.946 -1.309 1.00 . A A . 9 CYS HB2 1 1 16 3996 1 1 9 CYS HB3 H 0.425 -12.746 -0.347 1.00 . A A . 9 CYS HB3 1 1 16 3997 1 1 9 CYS HG H -2.949 -13.285 -0.438 1.00 . A A . 9 CYS HG 1 1 16 3998 1 1 9 CYS N N -1.862 -11.971 -2.693 1.00 . A A . 9 CYS N 1 1 16 3999 1 1 9 CYS O O 1.114 -13.388 -3.110 1.00 . A A . 9 CYS O 1 1 16 4000 1 1 9 CYS SG S -1.881 -12.840 0.205 1.00 . A A . 9 CYS SG 1 1 16 4001 1 1 10 PRO C C 3.228 -11.555 -4.545 1.00 . A A . 10 PRO C 1 1 16 4002 1 1 10 PRO CA C 1.805 -11.540 -5.091 1.00 . A A . 10 PRO CA 1 1 16 4003 1 1 10 PRO CB C 1.592 -10.323 -5.995 1.00 . A A . 10 PRO CB 1 1 16 4004 1 1 10 PRO CD C 0.153 -10.039 -4.107 1.00 . A A . 10 PRO CD 1 1 16 4005 1 1 10 PRO CG C 0.993 -9.290 -5.105 1.00 . A A . 10 PRO CG 1 1 16 4006 1 1 10 PRO HA H 1.627 -12.444 -5.654 1.00 . A A . 10 PRO HA 1 1 16 4007 1 1 10 PRO HB2 H 2.542 -9.998 -6.395 1.00 . A A . 10 PRO HB2 1 1 16 4008 1 1 10 PRO HB3 H 0.924 -10.583 -6.803 1.00 . A A . 10 PRO HB3 1 1 16 4009 1 1 10 PRO HD2 H 0.176 -9.544 -3.148 1.00 . A A . 10 PRO HD2 1 1 16 4010 1 1 10 PRO HD3 H -0.863 -10.130 -4.463 1.00 . A A . 10 PRO HD3 1 1 16 4011 1 1 10 PRO HG2 H 1.774 -8.742 -4.601 1.00 . A A . 10 PRO HG2 1 1 16 4012 1 1 10 PRO HG3 H 0.376 -8.619 -5.685 1.00 . A A . 10 PRO HG3 1 1 16 4013 1 1 10 PRO N N 0.804 -11.357 -4.035 1.00 . A A . 10 PRO N 1 1 16 4014 1 1 10 PRO O O 4.030 -12.422 -4.895 1.00 . A A . 10 PRO O 1 1 16 4015 1 1 11 LEU C C 4.800 -10.692 -1.577 1.00 . A A . 11 LEU C 1 1 16 4016 1 1 11 LEU CA C 4.865 -10.494 -3.088 1.00 . A A . 11 LEU CA 1 1 16 4017 1 1 11 LEU CB C 5.491 -9.136 -3.409 1.00 . A A . 11 LEU CB 1 1 16 4018 1 1 11 LEU CD1 C 5.163 -6.762 -4.143 1.00 . A A . 11 LEU CD1 1 1 16 4019 1 1 11 LEU CD2 C 4.611 -8.638 -5.703 1.00 . A A . 11 LEU CD2 1 1 16 4020 1 1 11 LEU CG C 4.639 -8.185 -4.250 1.00 . A A . 11 LEU CG 1 1 16 4021 1 1 11 LEU H H 2.857 -9.929 -3.443 1.00 . A A . 11 LEU H 1 1 16 4022 1 1 11 LEU HA H 5.477 -11.274 -3.515 1.00 . A A . 11 LEU HA 1 1 16 4023 1 1 11 LEU HB2 H 5.710 -8.643 -2.474 1.00 . A A . 11 LEU HB2 1 1 16 4024 1 1 11 LEU HB3 H 6.413 -9.316 -3.944 1.00 . A A . 11 LEU HB3 1 1 16 4025 1 1 11 LEU HD11 H 5.118 -6.288 -5.112 1.00 . A A . 11 LEU HD11 1 1 16 4026 1 1 11 LEU HD12 H 6.186 -6.780 -3.798 1.00 . A A . 11 LEU HD12 1 1 16 4027 1 1 11 LEU HD13 H 4.556 -6.207 -3.443 1.00 . A A . 11 LEU HD13 1 1 16 4028 1 1 11 LEU HD21 H 4.735 -9.710 -5.748 1.00 . A A . 11 LEU HD21 1 1 16 4029 1 1 11 LEU HD22 H 5.415 -8.159 -6.244 1.00 . A A . 11 LEU HD22 1 1 16 4030 1 1 11 LEU HD23 H 3.665 -8.365 -6.147 1.00 . A A . 11 LEU HD23 1 1 16 4031 1 1 11 LEU HG H 3.624 -8.196 -3.877 1.00 . A A . 11 LEU HG 1 1 16 4032 1 1 11 LEU N N 3.537 -10.591 -3.684 1.00 . A A . 11 LEU N 1 1 16 4033 1 1 11 LEU O O 5.114 -11.768 -1.067 1.00 . A A . 11 LEU O 1 1 16 4034 1 1 12 PHE C C 2.855 -9.399 1.040 1.00 . A A . 12 PHE C 1 1 16 4035 1 1 12 PHE CA C 4.279 -9.708 0.587 1.00 . A A . 12 PHE CA 1 1 16 4036 1 1 12 PHE CB C 5.256 -8.723 1.233 1.00 . A A . 12 PHE CB 1 1 16 4037 1 1 12 PHE CD1 C 5.119 -6.536 0.011 1.00 . A A . 12 PHE CD1 1 1 16 4038 1 1 12 PHE CD2 C 7.017 -7.929 -0.369 1.00 . A A . 12 PHE CD2 1 1 16 4039 1 1 12 PHE CE1 C 5.624 -5.601 -0.872 1.00 . A A . 12 PHE CE1 1 1 16 4040 1 1 12 PHE CE2 C 7.527 -6.997 -1.252 1.00 . A A . 12 PHE CE2 1 1 16 4041 1 1 12 PHE CG C 5.808 -7.709 0.273 1.00 . A A . 12 PHE CG 1 1 16 4042 1 1 12 PHE CZ C 6.830 -5.832 -1.506 1.00 . A A . 12 PHE CZ 1 1 16 4043 1 1 12 PHE H H 4.151 -8.817 -1.330 1.00 . A A . 12 PHE H 1 1 16 4044 1 1 12 PHE HA H 4.533 -10.709 0.897 1.00 . A A . 12 PHE HA 1 1 16 4045 1 1 12 PHE HB2 H 4.749 -8.190 2.023 1.00 . A A . 12 PHE HB2 1 1 16 4046 1 1 12 PHE HB3 H 6.086 -9.273 1.651 1.00 . A A . 12 PHE HB3 1 1 16 4047 1 1 12 PHE HD1 H 4.175 -6.354 0.506 1.00 . A A . 12 PHE HD1 1 1 16 4048 1 1 12 PHE HD2 H 7.563 -8.840 -0.173 1.00 . A A . 12 PHE HD2 1 1 16 4049 1 1 12 PHE HE1 H 5.076 -4.691 -1.068 1.00 . A A . 12 PHE HE1 1 1 16 4050 1 1 12 PHE HE2 H 8.470 -7.180 -1.747 1.00 . A A . 12 PHE HE2 1 1 16 4051 1 1 12 PHE HZ H 7.227 -5.102 -2.195 1.00 . A A . 12 PHE HZ 1 1 16 4052 1 1 12 PHE N N 4.387 -9.648 -0.866 1.00 . A A . 12 PHE N 1 1 16 4053 1 1 12 PHE O O 2.520 -8.252 1.332 1.00 . A A . 12 PHE O 1 1 16 4054 1 1 13 GLY C C 0.444 -10.517 2.990 1.00 . A A . 13 GLY C 1 1 16 4055 1 1 13 GLY CA C 0.642 -10.252 1.511 1.00 . A A . 13 GLY CA 1 1 16 4056 1 1 13 GLY H H 2.344 -11.325 0.850 1.00 . A A . 13 GLY H 1 1 16 4057 1 1 13 GLY HA2 H 0.342 -9.238 1.294 1.00 . A A . 13 GLY HA2 1 1 16 4058 1 1 13 GLY HA3 H 0.017 -10.930 0.949 1.00 . A A . 13 GLY HA3 1 1 16 4059 1 1 13 GLY N N 2.021 -10.433 1.094 1.00 . A A . 13 GLY N 1 1 16 4060 1 1 13 GLY O O -0.678 -10.460 3.495 1.00 . A A . 13 GLY O 1 1 16 4061 1 1 14 LYS C C 1.023 -9.852 5.893 1.00 . A A . 14 LYS C 1 1 16 4062 1 1 14 LYS CA C 1.479 -11.085 5.119 1.00 . A A . 14 LYS CA 1 1 16 4063 1 1 14 LYS CB C 2.849 -11.541 5.627 1.00 . A A . 14 LYS CB 1 1 16 4064 1 1 14 LYS CD C 4.928 -12.653 4.760 1.00 . A A . 14 LYS CD 1 1 16 4065 1 1 14 LYS CE C 5.447 -13.488 3.600 1.00 . A A . 14 LYS CE 1 1 16 4066 1 1 14 LYS CG C 3.414 -12.729 4.867 1.00 . A A . 14 LYS CG 1 1 16 4067 1 1 14 LYS H H 2.403 -10.840 3.230 1.00 . A A . 14 LYS H 1 1 16 4068 1 1 14 LYS HA H 0.764 -11.878 5.276 1.00 . A A . 14 LYS HA 1 1 16 4069 1 1 14 LYS HB2 H 3.544 -10.720 5.538 1.00 . A A . 14 LYS HB2 1 1 16 4070 1 1 14 LYS HB3 H 2.760 -11.816 6.668 1.00 . A A . 14 LYS HB3 1 1 16 4071 1 1 14 LYS HD2 H 5.218 -11.624 4.606 1.00 . A A . 14 LYS HD2 1 1 16 4072 1 1 14 LYS HD3 H 5.364 -13.018 5.679 1.00 . A A . 14 LYS HD3 1 1 16 4073 1 1 14 LYS HE2 H 4.786 -14.329 3.454 1.00 . A A . 14 LYS HE2 1 1 16 4074 1 1 14 LYS HE3 H 5.454 -12.878 2.709 1.00 . A A . 14 LYS HE3 1 1 16 4075 1 1 14 LYS HG2 H 3.146 -13.637 5.386 1.00 . A A . 14 LYS HG2 1 1 16 4076 1 1 14 LYS HG3 H 2.992 -12.743 3.873 1.00 . A A . 14 LYS HG3 1 1 16 4077 1 1 14 LYS HZ1 H 6.833 -15.033 3.835 1.00 . A A . 14 LYS HZ1 1 1 16 4078 1 1 14 LYS HZ2 H 7.158 -13.672 4.784 1.00 . A A . 14 LYS HZ2 1 1 16 4079 1 1 14 LYS HZ3 H 7.475 -13.639 3.123 1.00 . A A . 14 LYS HZ3 1 1 16 4080 1 1 14 LYS N N 1.536 -10.809 3.689 1.00 . A A . 14 LYS N 1 1 16 4081 1 1 14 LYS NZ N 6.825 -13.993 3.853 1.00 . A A . 14 LYS NZ 1 1 16 4082 1 1 14 LYS O O 0.151 -9.937 6.756 1.00 . A A . 14 LYS O 1 1 16 4083 1 1 15 GLY C C 0.737 -6.420 5.294 1.00 . A A . 15 GLY C 1 1 16 4084 1 1 15 GLY CA C 1.260 -7.473 6.251 1.00 . A A . 15 GLY CA 1 1 16 4085 1 1 15 GLY H H 2.308 -8.699 4.880 1.00 . A A . 15 GLY H 1 1 16 4086 1 1 15 GLY HA2 H 0.498 -7.685 6.986 1.00 . A A . 15 GLY HA2 1 1 16 4087 1 1 15 GLY HA3 H 2.133 -7.083 6.754 1.00 . A A . 15 GLY HA3 1 1 16 4088 1 1 15 GLY N N 1.619 -8.706 5.577 1.00 . A A . 15 GLY N 1 1 16 4089 1 1 15 GLY O O -0.094 -5.592 5.664 1.00 . A A . 15 GLY O 1 1 16 4090 1 1 16 GLY C C 0.909 -4.056 3.556 1.00 . A A . 16 GLY C 1 1 16 4091 1 1 16 GLY CA C 0.794 -5.485 3.064 1.00 . A A . 16 GLY CA 1 1 16 4092 1 1 16 GLY H H 1.888 -7.134 3.819 1.00 . A A . 16 GLY H 1 1 16 4093 1 1 16 GLY HA2 H 1.400 -5.601 2.178 1.00 . A A . 16 GLY HA2 1 1 16 4094 1 1 16 GLY HA3 H -0.238 -5.684 2.812 1.00 . A A . 16 GLY HA3 1 1 16 4095 1 1 16 GLY N N 1.227 -6.450 4.058 1.00 . A A . 16 GLY N 1 1 16 4096 1 1 16 GLY O O 1.824 -3.331 3.166 1.00 . A A . 16 GLY O 1 1 17 4097 1 1 1 VAL C C 1.039 -0.121 -1.024 1.00 . A A . 1 VAL C 1 1 17 4098 1 1 1 VAL CA C 1.383 -0.091 0.460 1.00 . A A . 1 VAL CA 1 1 17 4099 1 1 1 VAL CB C 1.694 -1.523 0.933 1.00 . A A . 1 VAL CB 1 1 17 4100 1 1 1 VAL CG1 C 2.838 -2.116 0.125 1.00 . A A . 1 VAL CG1 1 1 17 4101 1 1 1 VAL CG2 C 2.018 -1.535 2.419 1.00 . A A . 1 VAL CG2 1 1 17 4102 1 1 1 VAL H1 H 0.209 1.478 1.261 1.00 . A A . 1 VAL H1 1 1 17 4103 1 1 1 VAL HA H 2.268 0.513 0.603 1.00 . A A . 1 VAL HA 1 1 17 4104 1 1 1 VAL HB H 0.816 -2.132 0.772 1.00 . A A . 1 VAL HB 1 1 17 4105 1 1 1 VAL HG11 H 3.747 -2.078 0.707 1.00 . A A . 1 VAL HG11 1 1 17 4106 1 1 1 VAL HG12 H 2.611 -3.142 -0.124 1.00 . A A . 1 VAL HG12 1 1 17 4107 1 1 1 VAL HG13 H 2.970 -1.546 -0.783 1.00 . A A . 1 VAL HG13 1 1 17 4108 1 1 1 VAL HG21 H 2.800 -0.819 2.622 1.00 . A A . 1 VAL HG21 1 1 17 4109 1 1 1 VAL HG22 H 1.135 -1.273 2.983 1.00 . A A . 1 VAL HG22 1 1 17 4110 1 1 1 VAL HG23 H 2.349 -2.522 2.708 1.00 . A A . 1 VAL HG23 1 1 17 4111 1 1 1 VAL N N 0.303 0.503 1.239 1.00 . A A . 1 VAL N 1 1 17 4112 1 1 1 VAL O O 1.579 0.654 -1.813 1.00 . A A . 1 VAL O 1 1 17 4113 1 1 2 ALA C C -1.799 -1.045 -2.917 1.00 . A A . 2 ALA C 1 1 17 4114 1 1 2 ALA CA C -0.284 -1.150 -2.789 1.00 . A A . 2 ALA CA 1 1 17 4115 1 1 2 ALA CB C 0.207 -2.469 -3.367 1.00 . A A . 2 ALA CB 1 1 17 4116 1 1 2 ALA H H -0.260 -1.610 -0.724 1.00 . A A . 2 ALA H 1 1 17 4117 1 1 2 ALA HA H 0.172 -0.347 -3.351 1.00 . A A . 2 ALA HA 1 1 17 4118 1 1 2 ALA HB1 H -0.354 -3.283 -2.932 1.00 . A A . 2 ALA HB1 1 1 17 4119 1 1 2 ALA HB2 H 0.067 -2.466 -4.438 1.00 . A A . 2 ALA HB2 1 1 17 4120 1 1 2 ALA HB3 H 1.256 -2.593 -3.141 1.00 . A A . 2 ALA HB3 1 1 17 4121 1 1 2 ALA N N 0.135 -1.020 -1.399 1.00 . A A . 2 ALA N 1 1 17 4122 1 1 2 ALA O O -2.405 -0.073 -2.464 1.00 . A A . 2 ALA O 1 1 17 4123 1 1 3 ARG C C -4.464 -3.327 -3.117 1.00 . A A . 3 ARG C 1 1 17 4124 1 1 3 ARG CA C -3.852 -2.070 -3.728 1.00 . A A . 3 ARG CA 1 1 17 4125 1 1 3 ARG CB C -4.194 -1.996 -5.217 1.00 . A A . 3 ARG CB 1 1 17 4126 1 1 3 ARG CD C -2.167 -1.565 -6.640 1.00 . A A . 3 ARG CD 1 1 17 4127 1 1 3 ARG CG C -3.135 -2.614 -6.116 1.00 . A A . 3 ARG CG 1 1 17 4128 1 1 3 ARG CZ C -0.566 -2.990 -7.844 1.00 . A A . 3 ARG CZ 1 1 17 4129 1 1 3 ARG H H -1.870 -2.797 -3.878 1.00 . A A . 3 ARG H 1 1 17 4130 1 1 3 ARG HA H -4.264 -1.205 -3.230 1.00 . A A . 3 ARG HA 1 1 17 4131 1 1 3 ARG HB2 H -5.126 -2.514 -5.388 1.00 . A A . 3 ARG HB2 1 1 17 4132 1 1 3 ARG HB3 H -4.311 -0.960 -5.496 1.00 . A A . 3 ARG HB3 1 1 17 4133 1 1 3 ARG HD2 H -2.553 -1.169 -7.568 1.00 . A A . 3 ARG HD2 1 1 17 4134 1 1 3 ARG HD3 H -2.091 -0.770 -5.914 1.00 . A A . 3 ARG HD3 1 1 17 4135 1 1 3 ARG HE H -0.111 -1.826 -6.290 1.00 . A A . 3 ARG HE 1 1 17 4136 1 1 3 ARG HG2 H -2.581 -3.349 -5.551 1.00 . A A . 3 ARG HG2 1 1 17 4137 1 1 3 ARG HG3 H -3.622 -3.093 -6.953 1.00 . A A . 3 ARG HG3 1 1 17 4138 1 1 3 ARG HH11 H -2.459 -3.060 -8.544 1.00 . A A . 3 ARG HH11 1 1 17 4139 1 1 3 ARG HH12 H -1.320 -4.059 -9.385 1.00 . A A . 3 ARG HH12 1 1 17 4140 1 1 3 ARG HH21 H 1.398 -3.138 -7.388 1.00 . A A . 3 ARG HH21 1 1 17 4141 1 1 3 ARG HH22 H 0.873 -4.103 -8.725 1.00 . A A . 3 ARG HH22 1 1 17 4142 1 1 3 ARG N N -2.407 -2.051 -3.538 1.00 . A A . 3 ARG N 1 1 17 4143 1 1 3 ARG NE N -0.837 -2.119 -6.879 1.00 . A A . 3 ARG NE 1 1 17 4144 1 1 3 ARG NH1 N -1.528 -3.404 -8.658 1.00 . A A . 3 ARG NH1 1 1 17 4145 1 1 3 ARG NH2 N 0.670 -3.448 -7.999 1.00 . A A . 3 ARG NH2 1 1 17 4146 1 1 3 ARG O O -5.143 -3.265 -2.093 1.00 . A A . 3 ARG O 1 1 17 4147 1 1 4 GLY C C -3.729 -6.520 -2.473 1.00 . A A . 4 GLY C 1 1 17 4148 1 1 4 GLY CA C -4.752 -5.724 -3.259 1.00 . A A . 4 GLY CA 1 1 17 4149 1 1 4 GLY H H -3.669 -4.458 -4.566 1.00 . A A . 4 GLY H 1 1 17 4150 1 1 4 GLY HA2 H -5.598 -5.516 -2.621 1.00 . A A . 4 GLY HA2 1 1 17 4151 1 1 4 GLY HA3 H -5.084 -6.317 -4.098 1.00 . A A . 4 GLY HA3 1 1 17 4152 1 1 4 GLY N N -4.218 -4.469 -3.753 1.00 . A A . 4 GLY N 1 1 17 4153 1 1 4 GLY O O -2.889 -7.208 -3.054 1.00 . A A . 4 GLY O 1 1 17 4154 1 1 5 TRP C C -3.600 -8.180 0.559 1.00 . A A . 5 TRP C 1 1 17 4155 1 1 5 TRP CA C -2.868 -7.142 -0.284 1.00 . A A . 5 TRP CA 1 1 17 4156 1 1 5 TRP CB C -2.126 -6.160 0.625 1.00 . A A . 5 TRP CB 1 1 17 4157 1 1 5 TRP CD1 C -0.712 -4.131 -0.044 1.00 . A A . 5 TRP CD1 1 1 17 4158 1 1 5 TRP CD2 C 0.038 -6.081 -0.850 1.00 . A A . 5 TRP CD2 1 1 17 4159 1 1 5 TRP CE2 C 0.898 -5.054 -1.287 1.00 . A A . 5 TRP CE2 1 1 17 4160 1 1 5 TRP CE3 C 0.313 -7.397 -1.232 1.00 . A A . 5 TRP CE3 1 1 17 4161 1 1 5 TRP CG C -0.984 -5.469 -0.056 1.00 . A A . 5 TRP CG 1 1 17 4162 1 1 5 TRP CH2 C 2.254 -6.601 -2.447 1.00 . A A . 5 TRP CH2 1 1 17 4163 1 1 5 TRP CZ2 C 2.009 -5.304 -2.087 1.00 . A A . 5 TRP CZ2 1 1 17 4164 1 1 5 TRP CZ3 C 1.416 -7.643 -2.027 1.00 . A A . 5 TRP CZ3 1 1 17 4165 1 1 5 TRP H H -4.490 -5.861 -0.746 1.00 . A A . 5 TRP H 1 1 17 4166 1 1 5 TRP HA H -2.151 -7.647 -0.914 1.00 . A A . 5 TRP HA 1 1 17 4167 1 1 5 TRP HB2 H -2.816 -5.405 0.968 1.00 . A A . 5 TRP HB2 1 1 17 4168 1 1 5 TRP HB3 H -1.732 -6.697 1.476 1.00 . A A . 5 TRP HB3 1 1 17 4169 1 1 5 TRP HD1 H -1.307 -3.394 0.473 1.00 . A A . 5 TRP HD1 1 1 17 4170 1 1 5 TRP HE1 H 0.817 -2.989 -0.924 1.00 . A A . 5 TRP HE1 1 1 17 4171 1 1 5 TRP HE3 H -0.321 -8.213 -0.919 1.00 . A A . 5 TRP HE3 1 1 17 4172 1 1 5 TRP HH2 H 3.104 -6.840 -3.067 1.00 . A A . 5 TRP HH2 1 1 17 4173 1 1 5 TRP HZ2 H 2.665 -4.512 -2.419 1.00 . A A . 5 TRP HZ2 1 1 17 4174 1 1 5 TRP HZ3 H 1.644 -8.654 -2.333 1.00 . A A . 5 TRP HZ3 1 1 17 4175 1 1 5 TRP N N -3.798 -6.426 -1.150 1.00 . A A . 5 TRP N 1 1 17 4176 1 1 5 TRP NE1 N 0.418 -3.874 -0.783 1.00 . A A . 5 TRP NE1 1 1 17 4177 1 1 5 TRP O O -3.582 -9.372 0.249 1.00 . A A . 5 TRP O 1 1 17 4178 1 1 6 LYS C C -5.514 -9.822 1.754 1.00 . A A . 6 LYS C 1 1 17 4179 1 1 6 LYS CA C -4.984 -8.611 2.515 1.00 . A A . 6 LYS CA 1 1 17 4180 1 1 6 LYS CB C -6.145 -7.859 3.171 1.00 . A A . 6 LYS CB 1 1 17 4181 1 1 6 LYS CD C -7.943 -6.123 2.920 1.00 . A A . 6 LYS CD 1 1 17 4182 1 1 6 LYS CE C -9.275 -6.049 2.189 1.00 . A A . 6 LYS CE 1 1 17 4183 1 1 6 LYS CG C -6.960 -7.028 2.196 1.00 . A A . 6 LYS CG 1 1 17 4184 1 1 6 LYS H H -4.222 -6.761 1.822 1.00 . A A . 6 LYS H 1 1 17 4185 1 1 6 LYS HA H -4.307 -8.951 3.283 1.00 . A A . 6 LYS HA 1 1 17 4186 1 1 6 LYS HB2 H -6.804 -8.576 3.639 1.00 . A A . 6 LYS HB2 1 1 17 4187 1 1 6 LYS HB3 H -5.748 -7.200 3.929 1.00 . A A . 6 LYS HB3 1 1 17 4188 1 1 6 LYS HD2 H -8.112 -6.511 3.913 1.00 . A A . 6 LYS HD2 1 1 17 4189 1 1 6 LYS HD3 H -7.523 -5.129 2.986 1.00 . A A . 6 LYS HD3 1 1 17 4190 1 1 6 LYS HE2 H -9.530 -7.035 1.833 1.00 . A A . 6 LYS HE2 1 1 17 4191 1 1 6 LYS HE3 H -10.031 -5.709 2.880 1.00 . A A . 6 LYS HE3 1 1 17 4192 1 1 6 LYS HG2 H -6.289 -6.417 1.610 1.00 . A A . 6 LYS HG2 1 1 17 4193 1 1 6 LYS HG3 H -7.509 -7.691 1.542 1.00 . A A . 6 LYS HG3 1 1 17 4194 1 1 6 LYS HZ1 H -8.413 -4.467 1.132 1.00 . A A . 6 LYS HZ1 1 1 17 4195 1 1 6 LYS HZ2 H -10.095 -4.554 0.983 1.00 . A A . 6 LYS HZ2 1 1 17 4196 1 1 6 LYS HZ3 H -9.115 -5.648 0.145 1.00 . A A . 6 LYS HZ3 1 1 17 4197 1 1 6 LYS N N -4.244 -7.722 1.627 1.00 . A A . 6 LYS N 1 1 17 4198 1 1 6 LYS NZ N -9.221 -5.114 1.031 1.00 . A A . 6 LYS NZ 1 1 17 4199 1 1 6 LYS O O -5.320 -10.963 2.173 1.00 . A A . 6 LYS O 1 1 17 4200 1 1 7 ARG C C -5.702 -11.163 -1.170 1.00 . A A . 7 ARG C 1 1 17 4201 1 1 7 ARG CA C -6.740 -10.636 -0.184 1.00 . A A . 7 ARG CA 1 1 17 4202 1 1 7 ARG CB C -7.972 -10.138 -0.942 1.00 . A A . 7 ARG CB 1 1 17 4203 1 1 7 ARG CD C -10.132 -8.866 -0.757 1.00 . A A . 7 ARG CD 1 1 17 4204 1 1 7 ARG CG C -9.131 -9.756 -0.036 1.00 . A A . 7 ARG CG 1 1 17 4205 1 1 7 ARG CZ C -11.913 -10.382 -1.516 1.00 . A A . 7 ARG CZ 1 1 17 4206 1 1 7 ARG H H -6.305 -8.635 0.353 1.00 . A A . 7 ARG H 1 1 17 4207 1 1 7 ARG HA H -7.034 -11.439 0.475 1.00 . A A . 7 ARG HA 1 1 17 4208 1 1 7 ARG HB2 H -7.697 -9.269 -1.523 1.00 . A A . 7 ARG HB2 1 1 17 4209 1 1 7 ARG HB3 H -8.307 -10.916 -1.611 1.00 . A A . 7 ARG HB3 1 1 17 4210 1 1 7 ARG HD2 H -10.133 -7.894 -0.288 1.00 . A A . 7 ARG HD2 1 1 17 4211 1 1 7 ARG HD3 H -9.828 -8.768 -1.789 1.00 . A A . 7 ARG HD3 1 1 17 4212 1 1 7 ARG HE H -12.103 -9.044 -0.049 1.00 . A A . 7 ARG HE 1 1 17 4213 1 1 7 ARG HG2 H -9.634 -10.655 0.288 1.00 . A A . 7 ARG HG2 1 1 17 4214 1 1 7 ARG HG3 H -8.746 -9.227 0.822 1.00 . A A . 7 ARG HG3 1 1 17 4215 1 1 7 ARG HH11 H -10.159 -10.570 -2.502 1.00 . A A . 7 ARG HH11 1 1 17 4216 1 1 7 ARG HH12 H -11.423 -11.633 -3.026 1.00 . A A . 7 ARG HH12 1 1 17 4217 1 1 7 ARG HH21 H -13.775 -10.439 -0.731 1.00 . A A . 7 ARG HH21 1 1 17 4218 1 1 7 ARG HH22 H -13.479 -11.557 -2.019 1.00 . A A . 7 ARG HH22 1 1 17 4219 1 1 7 ARG N N -6.183 -9.566 0.635 1.00 . A A . 7 ARG N 1 1 17 4220 1 1 7 ARG NE N -11.485 -9.416 -0.712 1.00 . A A . 7 ARG NE 1 1 17 4221 1 1 7 ARG NH1 N -11.098 -10.904 -2.423 1.00 . A A . 7 ARG NH1 1 1 17 4222 1 1 7 ARG NH2 N -13.158 -10.829 -1.413 1.00 . A A . 7 ARG NH2 1 1 17 4223 1 1 7 ARG O O -5.256 -12.306 -1.068 1.00 . A A . 7 ARG O 1 1 17 4224 1 1 8 LYS C C -2.919 -10.591 -2.572 1.00 . A A . 8 LYS C 1 1 17 4225 1 1 8 LYS CA C -4.334 -10.701 -3.130 1.00 . A A . 8 LYS CA 1 1 17 4226 1 1 8 LYS CB C -4.475 -9.818 -4.372 1.00 . A A . 8 LYS CB 1 1 17 4227 1 1 8 LYS CD C -5.557 -10.965 -6.327 1.00 . A A . 8 LYS CD 1 1 17 4228 1 1 8 LYS CE C -5.760 -12.424 -5.945 1.00 . A A . 8 LYS CE 1 1 17 4229 1 1 8 LYS CG C -5.767 -10.044 -5.136 1.00 . A A . 8 LYS CG 1 1 17 4230 1 1 8 LYS H H -5.711 -9.423 -2.155 1.00 . A A . 8 LYS H 1 1 17 4231 1 1 8 LYS HA H -4.520 -11.728 -3.407 1.00 . A A . 8 LYS HA 1 1 17 4232 1 1 8 LYS HB2 H -4.437 -8.782 -4.068 1.00 . A A . 8 LYS HB2 1 1 17 4233 1 1 8 LYS HB3 H -3.647 -10.019 -5.037 1.00 . A A . 8 LYS HB3 1 1 17 4234 1 1 8 LYS HD2 H -6.264 -10.706 -7.101 1.00 . A A . 8 LYS HD2 1 1 17 4235 1 1 8 LYS HD3 H -4.550 -10.835 -6.698 1.00 . A A . 8 LYS HD3 1 1 17 4236 1 1 8 LYS HE2 H -4.887 -12.767 -5.412 1.00 . A A . 8 LYS HE2 1 1 17 4237 1 1 8 LYS HE3 H -6.626 -12.497 -5.304 1.00 . A A . 8 LYS HE3 1 1 17 4238 1 1 8 LYS HG2 H -6.494 -10.490 -4.473 1.00 . A A . 8 LYS HG2 1 1 17 4239 1 1 8 LYS HG3 H -6.137 -9.092 -5.490 1.00 . A A . 8 LYS HG3 1 1 17 4240 1 1 8 LYS HZ1 H -6.857 -13.816 -7.049 1.00 . A A . 8 LYS HZ1 1 1 17 4241 1 1 8 LYS HZ2 H -5.182 -13.962 -7.235 1.00 . A A . 8 LYS HZ2 1 1 17 4242 1 1 8 LYS HZ3 H -6.011 -12.701 -8.000 1.00 . A A . 8 LYS HZ3 1 1 17 4243 1 1 8 LYS N N -5.320 -10.322 -2.126 1.00 . A A . 8 LYS N 1 1 17 4244 1 1 8 LYS NZ N -5.967 -13.286 -7.141 1.00 . A A . 8 LYS NZ 1 1 17 4245 1 1 8 LYS O O -2.501 -9.524 -2.121 1.00 . A A . 8 LYS O 1 1 17 4246 1 1 9 CYS C C 0.159 -12.126 -3.208 1.00 . A A . 9 CYS C 1 1 17 4247 1 1 9 CYS CA C -0.816 -11.725 -2.106 1.00 . A A . 9 CYS CA 1 1 17 4248 1 1 9 CYS CB C -0.701 -12.694 -0.929 1.00 . A A . 9 CYS CB 1 1 17 4249 1 1 9 CYS H H -2.574 -12.518 -2.979 1.00 . A A . 9 CYS H 1 1 17 4250 1 1 9 CYS HA H -0.569 -10.730 -1.768 1.00 . A A . 9 CYS HA 1 1 17 4251 1 1 9 CYS HB2 H -0.792 -13.706 -1.295 1.00 . A A . 9 CYS HB2 1 1 17 4252 1 1 9 CYS HB3 H 0.266 -12.572 -0.465 1.00 . A A . 9 CYS HB3 1 1 17 4253 1 1 9 CYS HG H -2.517 -13.634 0.594 1.00 . A A . 9 CYS HG 1 1 17 4254 1 1 9 CYS N N -2.186 -11.698 -2.608 1.00 . A A . 9 CYS N 1 1 17 4255 1 1 9 CYS O O 0.766 -13.197 -3.173 1.00 . A A . 9 CYS O 1 1 17 4256 1 1 9 CYS SG S -1.960 -12.458 0.348 1.00 . A A . 9 CYS SG 1 1 17 4257 1 1 10 PRO C C 2.680 -11.434 -4.939 1.00 . A A . 10 PRO C 1 1 17 4258 1 1 10 PRO CA C 1.211 -11.491 -5.343 1.00 . A A . 10 PRO CA 1 1 17 4259 1 1 10 PRO CB C 0.878 -10.352 -6.310 1.00 . A A . 10 PRO CB 1 1 17 4260 1 1 10 PRO CD C -0.381 -9.954 -4.317 1.00 . A A . 10 PRO CD 1 1 17 4261 1 1 10 PRO CG C 0.338 -9.266 -5.444 1.00 . A A . 10 PRO CG 1 1 17 4262 1 1 10 PRO HA H 1.006 -12.439 -5.818 1.00 . A A . 10 PRO HA 1 1 17 4263 1 1 10 PRO HB2 H 1.776 -10.039 -6.824 1.00 . A A . 10 PRO HB2 1 1 17 4264 1 1 10 PRO HB3 H 0.144 -10.686 -7.027 1.00 . A A . 10 PRO HB3 1 1 17 4265 1 1 10 PRO HD2 H -0.280 -9.387 -3.404 1.00 . A A . 10 PRO HD2 1 1 17 4266 1 1 10 PRO HD3 H -1.423 -10.094 -4.564 1.00 . A A . 10 PRO HD3 1 1 17 4267 1 1 10 PRO HG2 H 1.149 -8.665 -5.061 1.00 . A A . 10 PRO HG2 1 1 17 4268 1 1 10 PRO HG3 H -0.350 -8.655 -6.009 1.00 . A A . 10 PRO HG3 1 1 17 4269 1 1 10 PRO N N 0.312 -11.249 -4.211 1.00 . A A . 10 PRO N 1 1 17 4270 1 1 10 PRO O O 3.454 -12.344 -5.243 1.00 . A A . 10 PRO O 1 1 17 4271 1 1 11 LEU C C 4.532 -10.279 -2.286 1.00 . A A . 11 LEU C 1 1 17 4272 1 1 11 LEU CA C 4.437 -10.187 -3.806 1.00 . A A . 11 LEU CA 1 1 17 4273 1 1 11 LEU CB C 4.981 -8.839 -4.282 1.00 . A A . 11 LEU CB 1 1 17 4274 1 1 11 LEU CD1 C 4.516 -6.549 -5.189 1.00 . A A . 11 LEU CD1 1 1 17 4275 1 1 11 LEU CD2 C 3.875 -8.571 -6.515 1.00 . A A . 11 LEU CD2 1 1 17 4276 1 1 11 LEU CG C 4.026 -7.987 -5.118 1.00 . A A . 11 LEU CG 1 1 17 4277 1 1 11 LEU H H 2.398 -9.671 -4.041 1.00 . A A . 11 LEU H 1 1 17 4278 1 1 11 LEU HA H 5.029 -10.979 -4.240 1.00 . A A . 11 LEU HA 1 1 17 4279 1 1 11 LEU HB2 H 5.256 -8.267 -3.409 1.00 . A A . 11 LEU HB2 1 1 17 4280 1 1 11 LEU HB3 H 5.862 -9.031 -4.877 1.00 . A A . 11 LEU HB3 1 1 17 4281 1 1 11 LEU HD11 H 5.536 -6.499 -4.842 1.00 . A A . 11 LEU HD11 1 1 17 4282 1 1 11 LEU HD12 H 3.892 -5.925 -4.565 1.00 . A A . 11 LEU HD12 1 1 17 4283 1 1 11 LEU HD13 H 4.464 -6.202 -6.211 1.00 . A A . 11 LEU HD13 1 1 17 4284 1 1 11 LEU HD21 H 4.041 -9.637 -6.479 1.00 . A A . 11 LEU HD21 1 1 17 4285 1 1 11 LEU HD22 H 4.599 -8.116 -7.176 1.00 . A A . 11 LEU HD22 1 1 17 4286 1 1 11 LEU HD23 H 2.878 -8.373 -6.882 1.00 . A A . 11 LEU HD23 1 1 17 4287 1 1 11 LEU HG H 3.051 -7.984 -4.649 1.00 . A A . 11 LEU HG 1 1 17 4288 1 1 11 LEU N N 3.059 -10.362 -4.253 1.00 . A A . 11 LEU N 1 1 17 4289 1 1 11 LEU O O 4.915 -11.313 -1.739 1.00 . A A . 11 LEU O 1 1 17 4290 1 1 12 PHE C C 2.848 -8.833 0.425 1.00 . A A . 12 PHE C 1 1 17 4291 1 1 12 PHE CA C 4.225 -9.149 -0.153 1.00 . A A . 12 PHE CA 1 1 17 4292 1 1 12 PHE CB C 5.239 -8.104 0.318 1.00 . A A . 12 PHE CB 1 1 17 4293 1 1 12 PHE CD1 C 4.886 -5.963 -0.941 1.00 . A A . 12 PHE CD1 1 1 17 4294 1 1 12 PHE CD2 C 6.723 -7.351 -1.560 1.00 . A A . 12 PHE CD2 1 1 17 4295 1 1 12 PHE CE1 C 5.237 -5.054 -1.922 1.00 . A A . 12 PHE CE1 1 1 17 4296 1 1 12 PHE CE2 C 7.080 -6.446 -2.542 1.00 . A A . 12 PHE CE2 1 1 17 4297 1 1 12 PHE CG C 5.624 -7.119 -0.749 1.00 . A A . 12 PHE CG 1 1 17 4298 1 1 12 PHE CZ C 6.335 -5.296 -2.724 1.00 . A A . 12 PHE CZ 1 1 17 4299 1 1 12 PHE H H 3.883 -8.397 -2.102 1.00 . A A . 12 PHE H 1 1 17 4300 1 1 12 PHE HA H 4.534 -10.121 0.197 1.00 . A A . 12 PHE HA 1 1 17 4301 1 1 12 PHE HB2 H 4.818 -7.551 1.143 1.00 . A A . 12 PHE HB2 1 1 17 4302 1 1 12 PHE HB3 H 6.136 -8.607 0.646 1.00 . A A . 12 PHE HB3 1 1 17 4303 1 1 12 PHE HD1 H 4.026 -5.772 -0.314 1.00 . A A . 12 PHE HD1 1 1 17 4304 1 1 12 PHE HD2 H 7.306 -8.249 -1.420 1.00 . A A . 12 PHE HD2 1 1 17 4305 1 1 12 PHE HE1 H 4.653 -4.156 -2.061 1.00 . A A . 12 PHE HE1 1 1 17 4306 1 1 12 PHE HE2 H 7.938 -6.638 -3.168 1.00 . A A . 12 PHE HE2 1 1 17 4307 1 1 12 PHE HZ H 6.612 -4.588 -3.490 1.00 . A A . 12 PHE HZ 1 1 17 4308 1 1 12 PHE N N 4.180 -9.191 -1.610 1.00 . A A . 12 PHE N 1 1 17 4309 1 1 12 PHE O O 2.509 -7.672 0.651 1.00 . A A . 12 PHE O 1 1 17 4310 1 1 13 GLY C C 0.706 -9.775 2.722 1.00 . A A . 13 GLY C 1 1 17 4311 1 1 13 GLY CA C 0.727 -9.690 1.208 1.00 . A A . 13 GLY CA 1 1 17 4312 1 1 13 GLY H H 2.382 -10.780 0.460 1.00 . A A . 13 GLY H 1 1 17 4313 1 1 13 GLY HA2 H 0.358 -8.721 0.907 1.00 . A A . 13 GLY HA2 1 1 17 4314 1 1 13 GLY HA3 H 0.076 -10.453 0.808 1.00 . A A . 13 GLY HA3 1 1 17 4315 1 1 13 GLY N N 2.058 -9.876 0.660 1.00 . A A . 13 GLY N 1 1 17 4316 1 1 13 GLY O O -0.241 -9.321 3.364 1.00 . A A . 13 GLY O 1 1 17 4317 1 1 14 LYS C C 1.953 -9.141 5.419 1.00 . A A . 14 LYS C 1 1 17 4318 1 1 14 LYS CA C 1.852 -10.504 4.742 1.00 . A A . 14 LYS CA 1 1 17 4319 1 1 14 LYS CB C 3.068 -11.358 5.108 1.00 . A A . 14 LYS CB 1 1 17 4320 1 1 14 LYS CD C 4.498 -13.177 4.129 1.00 . A A . 14 LYS CD 1 1 17 4321 1 1 14 LYS CE C 4.528 -14.174 2.980 1.00 . A A . 14 LYS CE 1 1 17 4322 1 1 14 LYS CG C 3.081 -12.719 4.432 1.00 . A A . 14 LYS CG 1 1 17 4323 1 1 14 LYS H H 2.477 -10.702 2.729 1.00 . A A . 14 LYS H 1 1 17 4324 1 1 14 LYS HA H 0.958 -10.999 5.088 1.00 . A A . 14 LYS HA 1 1 17 4325 1 1 14 LYS HB2 H 3.964 -10.829 4.821 1.00 . A A . 14 LYS HB2 1 1 17 4326 1 1 14 LYS HB3 H 3.077 -11.511 6.177 1.00 . A A . 14 LYS HB3 1 1 17 4327 1 1 14 LYS HD2 H 5.096 -12.319 3.862 1.00 . A A . 14 LYS HD2 1 1 17 4328 1 1 14 LYS HD3 H 4.912 -13.645 5.011 1.00 . A A . 14 LYS HD3 1 1 17 4329 1 1 14 LYS HE2 H 3.514 -14.446 2.731 1.00 . A A . 14 LYS HE2 1 1 17 4330 1 1 14 LYS HE3 H 4.995 -13.705 2.127 1.00 . A A . 14 LYS HE3 1 1 17 4331 1 1 14 LYS HG2 H 2.613 -13.440 5.085 1.00 . A A . 14 LYS HG2 1 1 17 4332 1 1 14 LYS HG3 H 2.527 -12.656 3.506 1.00 . A A . 14 LYS HG3 1 1 17 4333 1 1 14 LYS HZ1 H 4.629 -16.181 3.547 1.00 . A A . 14 LYS HZ1 1 1 17 4334 1 1 14 LYS HZ2 H 5.882 -15.230 4.168 1.00 . A A . 14 LYS HZ2 1 1 17 4335 1 1 14 LYS HZ3 H 5.897 -15.689 2.540 1.00 . A A . 14 LYS HZ3 1 1 17 4336 1 1 14 LYS N N 1.753 -10.360 3.294 1.00 . A A . 14 LYS N 1 1 17 4337 1 1 14 LYS NZ N 5.287 -15.405 3.333 1.00 . A A . 14 LYS NZ 1 1 17 4338 1 1 14 LYS O O 1.242 -8.862 6.384 1.00 . A A . 14 LYS O 1 1 17 4339 1 1 15 GLY C C 2.495 -5.876 4.562 1.00 . A A . 15 GLY C 1 1 17 4340 1 1 15 GLY CA C 3.016 -6.970 5.473 1.00 . A A . 15 GLY CA 1 1 17 4341 1 1 15 GLY H H 3.380 -8.571 4.135 1.00 . A A . 15 GLY H 1 1 17 4342 1 1 15 GLY HA2 H 2.491 -6.921 6.415 1.00 . A A . 15 GLY HA2 1 1 17 4343 1 1 15 GLY HA3 H 4.069 -6.804 5.650 1.00 . A A . 15 GLY HA3 1 1 17 4344 1 1 15 GLY N N 2.840 -8.294 4.905 1.00 . A A . 15 GLY N 1 1 17 4345 1 1 15 GLY O O 2.901 -4.720 4.675 1.00 . A A . 15 GLY O 1 1 17 4346 1 1 16 GLY C C 0.504 -4.038 3.442 1.00 . A A . 16 GLY C 1 1 17 4347 1 1 16 GLY CA C 1.033 -5.270 2.735 1.00 . A A . 16 GLY CA 1 1 17 4348 1 1 16 GLY H H 1.307 -7.177 3.612 1.00 . A A . 16 GLY H 1 1 17 4349 1 1 16 GLY HA2 H 1.798 -4.970 2.034 1.00 . A A . 16 GLY HA2 1 1 17 4350 1 1 16 GLY HA3 H 0.223 -5.734 2.190 1.00 . A A . 16 GLY HA3 1 1 17 4351 1 1 16 GLY N N 1.594 -6.241 3.656 1.00 . A A . 16 GLY N 1 1 17 4352 1 1 16 GLY O O -0.324 -4.141 4.346 1.00 . A A . 16 GLY O 1 1 18 4353 1 1 1 VAL C C 1.526 -1.023 -3.711 1.00 . A A . 1 VAL C 1 1 18 4354 1 1 1 VAL CA C 2.366 -0.249 -2.701 1.00 . A A . 1 VAL CA 1 1 18 4355 1 1 1 VAL CB C 3.669 -1.024 -2.431 1.00 . A A . 1 VAL CB 1 1 18 4356 1 1 1 VAL CG1 C 3.401 -2.225 -1.537 1.00 . A A . 1 VAL CG1 1 1 18 4357 1 1 1 VAL CG2 C 4.311 -1.457 -3.741 1.00 . A A . 1 VAL CG2 1 1 18 4358 1 1 1 VAL H1 H 1.174 0.846 -1.337 1.00 . A A . 1 VAL H1 1 1 18 4359 1 1 1 VAL HA H 2.624 0.712 -3.122 1.00 . A A . 1 VAL HA 1 1 18 4360 1 1 1 VAL HB H 4.356 -0.367 -1.919 1.00 . A A . 1 VAL HB 1 1 18 4361 1 1 1 VAL HG11 H 2.834 -2.962 -2.085 1.00 . A A . 1 VAL HG11 1 1 18 4362 1 1 1 VAL HG12 H 4.340 -2.654 -1.219 1.00 . A A . 1 VAL HG12 1 1 18 4363 1 1 1 VAL HG13 H 2.838 -1.909 -0.670 1.00 . A A . 1 VAL HG13 1 1 18 4364 1 1 1 VAL HG21 H 3.959 -0.823 -4.541 1.00 . A A . 1 VAL HG21 1 1 18 4365 1 1 1 VAL HG22 H 5.385 -1.374 -3.661 1.00 . A A . 1 VAL HG22 1 1 18 4366 1 1 1 VAL HG23 H 4.045 -2.483 -3.951 1.00 . A A . 1 VAL HG23 1 1 18 4367 1 1 1 VAL N N 1.622 -0.015 -1.468 1.00 . A A . 1 VAL N 1 1 18 4368 1 1 1 VAL O O 1.433 -0.643 -4.877 1.00 . A A . 1 VAL O 1 1 18 4369 1 1 2 ALA C C -1.319 -3.100 -3.535 1.00 . A A . 2 ALA C 1 1 18 4370 1 1 2 ALA CA C 0.081 -2.938 -4.117 1.00 . A A . 2 ALA CA 1 1 18 4371 1 1 2 ALA CB C 0.727 -4.299 -4.329 1.00 . A A . 2 ALA CB 1 1 18 4372 1 1 2 ALA H H 1.028 -2.363 -2.314 1.00 . A A . 2 ALA H 1 1 18 4373 1 1 2 ALA HA H 0.007 -2.449 -5.077 1.00 . A A . 2 ALA HA 1 1 18 4374 1 1 2 ALA HB1 H 0.868 -4.469 -5.386 1.00 . A A . 2 ALA HB1 1 1 18 4375 1 1 2 ALA HB2 H 1.684 -4.325 -3.829 1.00 . A A . 2 ALA HB2 1 1 18 4376 1 1 2 ALA HB3 H 0.088 -5.069 -3.922 1.00 . A A . 2 ALA HB3 1 1 18 4377 1 1 2 ALA N N 0.916 -2.112 -3.254 1.00 . A A . 2 ALA N 1 1 18 4378 1 1 2 ALA O O -1.571 -4.008 -2.742 1.00 . A A . 2 ALA O 1 1 18 4379 1 1 3 ARG C C -4.016 -3.690 -3.120 1.00 . A A . 3 ARG C 1 1 18 4380 1 1 3 ARG CA C -3.601 -2.258 -3.448 1.00 . A A . 3 ARG CA 1 1 18 4381 1 1 3 ARG CB C -4.550 -1.667 -4.492 1.00 . A A . 3 ARG CB 1 1 18 4382 1 1 3 ARG CD C -5.589 0.574 -4.953 1.00 . A A . 3 ARG CD 1 1 18 4383 1 1 3 ARG CG C -5.437 -0.558 -3.950 1.00 . A A . 3 ARG CG 1 1 18 4384 1 1 3 ARG CZ C -4.634 2.530 -3.811 1.00 . A A . 3 ARG CZ 1 1 18 4385 1 1 3 ARG H H -1.965 -1.514 -4.566 1.00 . A A . 3 ARG H 1 1 18 4386 1 1 3 ARG HA H -3.655 -1.665 -2.548 1.00 . A A . 3 ARG HA 1 1 18 4387 1 1 3 ARG HB2 H -3.967 -1.265 -5.307 1.00 . A A . 3 ARG HB2 1 1 18 4388 1 1 3 ARG HB3 H -5.186 -2.454 -4.869 1.00 . A A . 3 ARG HB3 1 1 18 4389 1 1 3 ARG HD2 H -4.733 0.572 -5.611 1.00 . A A . 3 ARG HD2 1 1 18 4390 1 1 3 ARG HD3 H -6.486 0.406 -5.531 1.00 . A A . 3 ARG HD3 1 1 18 4391 1 1 3 ARG HE H -6.570 2.283 -4.221 1.00 . A A . 3 ARG HE 1 1 18 4392 1 1 3 ARG HG2 H -6.413 -0.964 -3.731 1.00 . A A . 3 ARG HG2 1 1 18 4393 1 1 3 ARG HG3 H -4.996 -0.168 -3.044 1.00 . A A . 3 ARG HG3 1 1 18 4394 1 1 3 ARG HH11 H -3.293 1.116 -4.341 1.00 . A A . 3 ARG HH11 1 1 18 4395 1 1 3 ARG HH12 H -2.632 2.500 -3.535 1.00 . A A . 3 ARG HH12 1 1 18 4396 1 1 3 ARG HH21 H -5.713 4.110 -3.159 1.00 . A A . 3 ARG HH21 1 1 18 4397 1 1 3 ARG HH22 H -4.010 4.202 -2.862 1.00 . A A . 3 ARG HH22 1 1 18 4398 1 1 3 ARG N N -2.226 -2.214 -3.933 1.00 . A A . 3 ARG N 1 1 18 4399 1 1 3 ARG NE N -5.682 1.877 -4.299 1.00 . A A . 3 ARG NE 1 1 18 4400 1 1 3 ARG NH1 N -3.420 2.005 -3.902 1.00 . A A . 3 ARG NH1 1 1 18 4401 1 1 3 ARG NH2 N -4.799 3.711 -3.230 1.00 . A A . 3 ARG NH2 1 1 18 4402 1 1 3 ARG O O -4.455 -3.980 -2.008 1.00 . A A . 3 ARG O 1 1 18 4403 1 1 4 GLY C C -3.285 -6.689 -2.959 1.00 . A A . 4 GLY C 1 1 18 4404 1 1 4 GLY CA C -4.239 -5.970 -3.892 1.00 . A A . 4 GLY CA 1 1 18 4405 1 1 4 GLY H H -3.518 -4.292 -4.963 1.00 . A A . 4 GLY H 1 1 18 4406 1 1 4 GLY HA2 H -5.234 -6.012 -3.475 1.00 . A A . 4 GLY HA2 1 1 18 4407 1 1 4 GLY HA3 H -4.238 -6.475 -4.847 1.00 . A A . 4 GLY HA3 1 1 18 4408 1 1 4 GLY N N -3.874 -4.581 -4.097 1.00 . A A . 4 GLY N 1 1 18 4409 1 1 4 GLY O O -2.335 -7.332 -3.406 1.00 . A A . 4 GLY O 1 1 18 4410 1 1 5 TRP C C -3.479 -8.254 0.138 1.00 . A A . 5 TRP C 1 1 18 4411 1 1 5 TRP CA C -2.690 -7.223 -0.660 1.00 . A A . 5 TRP CA 1 1 18 4412 1 1 5 TRP CB C -2.094 -6.177 0.283 1.00 . A A . 5 TRP CB 1 1 18 4413 1 1 5 TRP CD1 C -0.496 -4.241 -0.231 1.00 . A A . 5 TRP CD1 1 1 18 4414 1 1 5 TRP CD2 C 0.278 -6.256 -0.826 1.00 . A A . 5 TRP CD2 1 1 18 4415 1 1 5 TRP CE2 C 1.244 -5.287 -1.161 1.00 . A A . 5 TRP CE2 1 1 18 4416 1 1 5 TRP CE3 C 0.547 -7.599 -1.106 1.00 . A A . 5 TRP CE3 1 1 18 4417 1 1 5 TRP CG C -0.826 -5.566 -0.233 1.00 . A A . 5 TRP CG 1 1 18 4418 1 1 5 TRP CH2 C 2.692 -6.942 -2.024 1.00 . A A . 5 TRP CH2 1 1 18 4419 1 1 5 TRP CZ2 C 2.455 -5.620 -1.762 1.00 . A A . 5 TRP CZ2 1 1 18 4420 1 1 5 TRP CZ3 C 1.749 -7.928 -1.702 1.00 . A A . 5 TRP CZ3 1 1 18 4421 1 1 5 TRP H H -4.308 -6.053 -1.364 1.00 . A A . 5 TRP H 1 1 18 4422 1 1 5 TRP HA H -1.887 -7.724 -1.181 1.00 . A A . 5 TRP HA 1 1 18 4423 1 1 5 TRP HB2 H -2.811 -5.383 0.430 1.00 . A A . 5 TRP HB2 1 1 18 4424 1 1 5 TRP HB3 H -1.878 -6.643 1.234 1.00 . A A . 5 TRP HB3 1 1 18 4425 1 1 5 TRP HD1 H -1.130 -3.456 0.153 1.00 . A A . 5 TRP HD1 1 1 18 4426 1 1 5 TRP HE1 H 1.206 -3.206 -0.900 1.00 . A A . 5 TRP HE1 1 1 18 4427 1 1 5 TRP HE3 H -0.167 -8.373 -0.865 1.00 . A A . 5 TRP HE3 1 1 18 4428 1 1 5 TRP HH2 H 3.617 -7.245 -2.489 1.00 . A A . 5 TRP HH2 1 1 18 4429 1 1 5 TRP HZ2 H 3.193 -4.872 -2.015 1.00 . A A . 5 TRP HZ2 1 1 18 4430 1 1 5 TRP HZ3 H 1.974 -8.960 -1.927 1.00 . A A . 5 TRP HZ3 1 1 18 4431 1 1 5 TRP N N -3.536 -6.579 -1.659 1.00 . A A . 5 TRP N 1 1 18 4432 1 1 5 TRP NE1 N 0.748 -4.066 -0.789 1.00 . A A . 5 TRP NE1 1 1 18 4433 1 1 5 TRP O O -3.405 -9.453 -0.132 1.00 . A A . 5 TRP O 1 1 18 4434 1 1 6 LYS C C -5.485 -9.897 1.182 1.00 . A A . 6 LYS C 1 1 18 4435 1 1 6 LYS CA C -5.041 -8.663 1.960 1.00 . A A . 6 LYS CA 1 1 18 4436 1 1 6 LYS CB C -6.265 -7.915 2.493 1.00 . A A . 6 LYS CB 1 1 18 4437 1 1 6 LYS CD C -8.020 -6.172 2.056 1.00 . A A . 6 LYS CD 1 1 18 4438 1 1 6 LYS CE C -9.437 -6.641 1.763 1.00 . A A . 6 LYS CE 1 1 18 4439 1 1 6 LYS CG C -6.987 -7.099 1.436 1.00 . A A . 6 LYS CG 1 1 18 4440 1 1 6 LYS H H -4.254 -6.816 1.290 1.00 . A A . 6 LYS H 1 1 18 4441 1 1 6 LYS HA H -4.431 -8.978 2.793 1.00 . A A . 6 LYS HA 1 1 18 4442 1 1 6 LYS HB2 H -6.961 -8.634 2.901 1.00 . A A . 6 LYS HB2 1 1 18 4443 1 1 6 LYS HB3 H -5.949 -7.246 3.281 1.00 . A A . 6 LYS HB3 1 1 18 4444 1 1 6 LYS HD2 H -7.875 -6.149 3.126 1.00 . A A . 6 LYS HD2 1 1 18 4445 1 1 6 LYS HD3 H -7.888 -5.178 1.651 1.00 . A A . 6 LYS HD3 1 1 18 4446 1 1 6 LYS HE2 H -9.422 -7.708 1.596 1.00 . A A . 6 LYS HE2 1 1 18 4447 1 1 6 LYS HE3 H -10.059 -6.420 2.617 1.00 . A A . 6 LYS HE3 1 1 18 4448 1 1 6 LYS HG2 H -6.264 -6.504 0.897 1.00 . A A . 6 LYS HG2 1 1 18 4449 1 1 6 LYS HG3 H -7.485 -7.771 0.752 1.00 . A A . 6 LYS HG3 1 1 18 4450 1 1 6 LYS HZ1 H -10.574 -6.646 0.011 1.00 . A A . 6 LYS HZ1 1 1 18 4451 1 1 6 LYS HZ2 H -9.240 -5.607 -0.041 1.00 . A A . 6 LYS HZ2 1 1 18 4452 1 1 6 LYS HZ3 H -10.613 -5.177 0.849 1.00 . A A . 6 LYS HZ3 1 1 18 4453 1 1 6 LYS N N -4.236 -7.782 1.123 1.00 . A A . 6 LYS N 1 1 18 4454 1 1 6 LYS NZ N -10.006 -5.971 0.561 1.00 . A A . 6 LYS NZ 1 1 18 4455 1 1 6 LYS O O -5.298 -11.027 1.633 1.00 . A A . 6 LYS O 1 1 18 4456 1 1 7 ARG C C -5.394 -11.364 -1.638 1.00 . A A . 7 ARG C 1 1 18 4457 1 1 7 ARG CA C -6.543 -10.768 -0.830 1.00 . A A . 7 ARG CA 1 1 18 4458 1 1 7 ARG CB C -7.644 -10.278 -1.772 1.00 . A A . 7 ARG CB 1 1 18 4459 1 1 7 ARG CD C -10.022 -9.513 -2.049 1.00 . A A . 7 ARG CD 1 1 18 4460 1 1 7 ARG CG C -8.938 -9.919 -1.062 1.00 . A A . 7 ARG CG 1 1 18 4461 1 1 7 ARG CZ C -11.543 -11.443 -1.973 1.00 . A A . 7 ARG CZ 1 1 18 4462 1 1 7 ARG H H -6.193 -8.750 -0.295 1.00 . A A . 7 ARG H 1 1 18 4463 1 1 7 ARG HA H -6.948 -11.532 -0.184 1.00 . A A . 7 ARG HA 1 1 18 4464 1 1 7 ARG HB2 H -7.291 -9.401 -2.295 1.00 . A A . 7 ARG HB2 1 1 18 4465 1 1 7 ARG HB3 H -7.856 -11.055 -2.491 1.00 . A A . 7 ARG HB3 1 1 18 4466 1 1 7 ARG HD2 H -10.149 -8.442 -2.003 1.00 . A A . 7 ARG HD2 1 1 18 4467 1 1 7 ARG HD3 H -9.708 -9.796 -3.043 1.00 . A A . 7 ARG HD3 1 1 18 4468 1 1 7 ARG HE H -12.010 -9.599 -1.374 1.00 . A A . 7 ARG HE 1 1 18 4469 1 1 7 ARG HG2 H -9.281 -10.777 -0.502 1.00 . A A . 7 ARG HG2 1 1 18 4470 1 1 7 ARG HG3 H -8.752 -9.097 -0.387 1.00 . A A . 7 ARG HG3 1 1 18 4471 1 1 7 ARG HH11 H -9.704 -11.839 -2.709 1.00 . A A . 7 ARG HH11 1 1 18 4472 1 1 7 ARG HH12 H -10.786 -13.190 -2.650 1.00 . A A . 7 ARG HH12 1 1 18 4473 1 1 7 ARG HH21 H -13.445 -11.370 -1.291 1.00 . A A . 7 ARG HH21 1 1 18 4474 1 1 7 ARG HH22 H -12.914 -12.923 -1.844 1.00 . A A . 7 ARG HH22 1 1 18 4475 1 1 7 ARG N N -6.073 -9.673 0.011 1.00 . A A . 7 ARG N 1 1 18 4476 1 1 7 ARG NE N -11.300 -10.155 -1.754 1.00 . A A . 7 ARG NE 1 1 18 4477 1 1 7 ARG NH1 N -10.600 -12.221 -2.487 1.00 . A A . 7 ARG NH1 1 1 18 4478 1 1 7 ARG NH2 N -12.732 -11.954 -1.679 1.00 . A A . 7 ARG NH2 1 1 18 4479 1 1 7 ARG O O -4.903 -12.451 -1.331 1.00 . A A . 7 ARG O 1 1 18 4480 1 1 8 LYS C C -2.531 -10.887 -2.848 1.00 . A A . 8 LYS C 1 1 18 4481 1 1 8 LYS CA C -3.880 -11.103 -3.526 1.00 . A A . 8 LYS CA 1 1 18 4482 1 1 8 LYS CB C -3.912 -10.366 -4.868 1.00 . A A . 8 LYS CB 1 1 18 4483 1 1 8 LYS CD C -5.902 -11.218 -6.143 1.00 . A A . 8 LYS CD 1 1 18 4484 1 1 8 LYS CE C -6.476 -12.625 -6.079 1.00 . A A . 8 LYS CE 1 1 18 4485 1 1 8 LYS CG C -4.387 -11.229 -6.024 1.00 . A A . 8 LYS CG 1 1 18 4486 1 1 8 LYS H H -5.403 -9.788 -2.868 1.00 . A A . 8 LYS H 1 1 18 4487 1 1 8 LYS HA H -4.016 -12.159 -3.702 1.00 . A A . 8 LYS HA 1 1 18 4488 1 1 8 LYS HB2 H -4.574 -9.518 -4.783 1.00 . A A . 8 LYS HB2 1 1 18 4489 1 1 8 LYS HB3 H -2.916 -10.014 -5.095 1.00 . A A . 8 LYS HB3 1 1 18 4490 1 1 8 LYS HD2 H -6.314 -10.637 -5.331 1.00 . A A . 8 LYS HD2 1 1 18 4491 1 1 8 LYS HD3 H -6.177 -10.768 -7.086 1.00 . A A . 8 LYS HD3 1 1 18 4492 1 1 8 LYS HE2 H -6.043 -13.139 -5.234 1.00 . A A . 8 LYS HE2 1 1 18 4493 1 1 8 LYS HE3 H -7.546 -12.557 -5.950 1.00 . A A . 8 LYS HE3 1 1 18 4494 1 1 8 LYS HG2 H -3.962 -10.851 -6.942 1.00 . A A . 8 LYS HG2 1 1 18 4495 1 1 8 LYS HG3 H -4.055 -12.245 -5.864 1.00 . A A . 8 LYS HG3 1 1 18 4496 1 1 8 LYS HZ1 H -5.872 -12.758 -8.074 1.00 . A A . 8 LYS HZ1 1 1 18 4497 1 1 8 LYS HZ2 H -7.039 -13.900 -7.635 1.00 . A A . 8 LYS HZ2 1 1 18 4498 1 1 8 LYS HZ3 H -5.435 -14.096 -7.136 1.00 . A A . 8 LYS HZ3 1 1 18 4499 1 1 8 LYS N N -4.971 -10.646 -2.673 1.00 . A A . 8 LYS N 1 1 18 4500 1 1 8 LYS NZ N -6.185 -13.399 -7.318 1.00 . A A . 8 LYS NZ 1 1 18 4501 1 1 8 LYS O O -2.166 -9.758 -2.517 1.00 . A A . 8 LYS O 1 1 18 4502 1 1 9 CYS C C 0.608 -12.380 -2.954 1.00 . A A . 9 CYS C 1 1 18 4503 1 1 9 CYS CA C -0.486 -11.902 -2.006 1.00 . A A . 9 CYS CA 1 1 18 4504 1 1 9 CYS CB C -0.473 -12.742 -0.728 1.00 . A A . 9 CYS CB 1 1 18 4505 1 1 9 CYS H H -2.140 -12.845 -2.931 1.00 . A A . 9 CYS H 1 1 18 4506 1 1 9 CYS HA H -0.299 -10.871 -1.751 1.00 . A A . 9 CYS HA 1 1 18 4507 1 1 9 CYS HB2 H 0.543 -12.821 -0.368 1.00 . A A . 9 CYS HB2 1 1 18 4508 1 1 9 CYS HB3 H -1.076 -12.252 0.022 1.00 . A A . 9 CYS HB3 1 1 18 4509 1 1 9 CYS HG H -0.824 -14.813 -2.172 1.00 . A A . 9 CYS HG 1 1 18 4510 1 1 9 CYS N N -1.795 -11.974 -2.645 1.00 . A A . 9 CYS N 1 1 18 4511 1 1 9 CYS O O 1.173 -13.463 -2.795 1.00 . A A . 9 CYS O 1 1 18 4512 1 1 9 CYS SG S -1.111 -14.420 -0.940 1.00 . A A . 9 CYS SG 1 1 18 4513 1 1 10 PRO C C 3.351 -11.836 -4.375 1.00 . A A . 10 PRO C 1 1 18 4514 1 1 10 PRO CA C 1.944 -11.874 -4.962 1.00 . A A . 10 PRO CA 1 1 18 4515 1 1 10 PRO CB C 1.773 -10.774 -6.012 1.00 . A A . 10 PRO CB 1 1 18 4516 1 1 10 PRO CD C 0.284 -10.250 -4.218 1.00 . A A . 10 PRO CD 1 1 18 4517 1 1 10 PRO CG C 1.162 -9.635 -5.272 1.00 . A A . 10 PRO CG 1 1 18 4518 1 1 10 PRO HA H 1.771 -12.838 -5.417 1.00 . A A . 10 PRO HA 1 1 18 4519 1 1 10 PRO HB2 H 2.739 -10.508 -6.420 1.00 . A A . 10 PRO HB2 1 1 18 4520 1 1 10 PRO HB3 H 1.127 -11.123 -6.803 1.00 . A A . 10 PRO HB3 1 1 18 4521 1 1 10 PRO HD2 H 0.285 -9.643 -3.325 1.00 . A A . 10 PRO HD2 1 1 18 4522 1 1 10 PRO HD3 H -0.722 -10.375 -4.590 1.00 . A A . 10 PRO HD3 1 1 18 4523 1 1 10 PRO HG2 H 1.935 -9.037 -4.814 1.00 . A A . 10 PRO HG2 1 1 18 4524 1 1 10 PRO HG3 H 0.571 -9.034 -5.947 1.00 . A A . 10 PRO HG3 1 1 18 4525 1 1 10 PRO N N 0.916 -11.556 -3.967 1.00 . A A . 10 PRO N 1 1 18 4526 1 1 10 PRO O O 4.148 -12.750 -4.587 1.00 . A A . 10 PRO O 1 1 18 4527 1 1 11 LEU C C 4.854 -10.665 -1.495 1.00 . A A . 11 LEU C 1 1 18 4528 1 1 11 LEU CA C 4.961 -10.617 -3.016 1.00 . A A . 11 LEU CA 1 1 18 4529 1 1 11 LEU CB C 5.598 -9.296 -3.452 1.00 . A A . 11 LEU CB 1 1 18 4530 1 1 11 LEU CD1 C 5.307 -7.014 -4.448 1.00 . A A . 11 LEU CD1 1 1 18 4531 1 1 11 LEU CD2 C 4.776 -9.046 -5.807 1.00 . A A . 11 LEU CD2 1 1 18 4532 1 1 11 LEU CG C 4.773 -8.438 -4.412 1.00 . A A . 11 LEU CG 1 1 18 4533 1 1 11 LEU H H 2.973 -10.078 -3.501 1.00 . A A . 11 LEU H 1 1 18 4534 1 1 11 LEU HA H 5.584 -11.434 -3.347 1.00 . A A . 11 LEU HA 1 1 18 4535 1 1 11 LEU HB2 H 5.787 -8.711 -2.565 1.00 . A A . 11 LEU HB2 1 1 18 4536 1 1 11 LEU HB3 H 6.537 -9.527 -3.936 1.00 . A A . 11 LEU HB3 1 1 18 4537 1 1 11 LEU HD11 H 6.324 -7.002 -4.087 1.00 . A A . 11 LEU HD11 1 1 18 4538 1 1 11 LEU HD12 H 4.695 -6.384 -3.819 1.00 . A A . 11 LEU HD12 1 1 18 4539 1 1 11 LEU HD13 H 5.279 -6.645 -5.462 1.00 . A A . 11 LEU HD13 1 1 18 4540 1 1 11 LEU HD21 H 4.919 -10.114 -5.734 1.00 . A A . 11 LEU HD21 1 1 18 4541 1 1 11 LEU HD22 H 5.579 -8.614 -6.386 1.00 . A A . 11 LEU HD22 1 1 18 4542 1 1 11 LEU HD23 H 3.832 -8.841 -6.290 1.00 . A A . 11 LEU HD23 1 1 18 4543 1 1 11 LEU HG H 3.750 -8.402 -4.064 1.00 . A A . 11 LEU HG 1 1 18 4544 1 1 11 LEU N N 3.649 -10.774 -3.635 1.00 . A A . 11 LEU N 1 1 18 4545 1 1 11 LEU O O 5.158 -11.683 -0.873 1.00 . A A . 11 LEU O 1 1 18 4546 1 1 12 PHE C C 2.835 -9.126 0.927 1.00 . A A . 12 PHE C 1 1 18 4547 1 1 12 PHE CA C 4.271 -9.475 0.546 1.00 . A A . 12 PHE CA 1 1 18 4548 1 1 12 PHE CB C 5.230 -8.430 1.119 1.00 . A A . 12 PHE CB 1 1 18 4549 1 1 12 PHE CD1 C 5.212 -6.394 -0.349 1.00 . A A . 12 PHE CD1 1 1 18 4550 1 1 12 PHE CD2 C 7.075 -7.876 -0.490 1.00 . A A . 12 PHE CD2 1 1 18 4551 1 1 12 PHE CE1 C 5.780 -5.581 -1.311 1.00 . A A . 12 PHE CE1 1 1 18 4552 1 1 12 PHE CE2 C 7.648 -7.067 -1.452 1.00 . A A . 12 PHE CE2 1 1 18 4553 1 1 12 PHE CG C 5.851 -7.549 0.073 1.00 . A A . 12 PHE CG 1 1 18 4554 1 1 12 PHE CZ C 7.000 -5.919 -1.864 1.00 . A A . 12 PHE CZ 1 1 18 4555 1 1 12 PHE H H 4.193 -8.779 -1.452 1.00 . A A . 12 PHE H 1 1 18 4556 1 1 12 PHE HA H 4.515 -10.441 0.960 1.00 . A A . 12 PHE HA 1 1 18 4557 1 1 12 PHE HB2 H 4.692 -7.796 1.808 1.00 . A A . 12 PHE HB2 1 1 18 4558 1 1 12 PHE HB3 H 6.027 -8.933 1.646 1.00 . A A . 12 PHE HB3 1 1 18 4559 1 1 12 PHE HD1 H 4.257 -6.130 0.084 1.00 . A A . 12 PHE HD1 1 1 18 4560 1 1 12 PHE HD2 H 7.582 -8.774 -0.170 1.00 . A A . 12 PHE HD2 1 1 18 4561 1 1 12 PHE HE1 H 5.271 -4.685 -1.630 1.00 . A A . 12 PHE HE1 1 1 18 4562 1 1 12 PHE HE2 H 8.602 -7.333 -1.884 1.00 . A A . 12 PHE HE2 1 1 18 4563 1 1 12 PHE HZ H 7.446 -5.285 -2.616 1.00 . A A . 12 PHE HZ 1 1 18 4564 1 1 12 PHE N N 4.419 -9.558 -0.902 1.00 . A A . 12 PHE N 1 1 18 4565 1 1 12 PHE O O 2.489 -7.955 1.082 1.00 . A A . 12 PHE O 1 1 18 4566 1 1 13 GLY C C 0.413 -9.822 2.934 1.00 . A A . 13 GLY C 1 1 18 4567 1 1 13 GLY CA C 0.613 -9.934 1.435 1.00 . A A . 13 GLY CA 1 1 18 4568 1 1 13 GLY H H 2.333 -11.064 0.939 1.00 . A A . 13 GLY H 1 1 18 4569 1 1 13 GLY HA2 H 0.270 -9.023 0.968 1.00 . A A . 13 GLY HA2 1 1 18 4570 1 1 13 GLY HA3 H 0.024 -10.760 1.066 1.00 . A A . 13 GLY HA3 1 1 18 4571 1 1 13 GLY N N 2.002 -10.152 1.075 1.00 . A A . 13 GLY N 1 1 18 4572 1 1 13 GLY O O -0.682 -9.510 3.400 1.00 . A A . 13 GLY O 1 1 18 4573 1 1 14 LYS C C 1.545 -8.564 5.625 1.00 . A A . 14 LYS C 1 1 18 4574 1 1 14 LYS CA C 1.412 -10.006 5.146 1.00 . A A . 14 LYS CA 1 1 18 4575 1 1 14 LYS CB C 2.515 -10.865 5.768 1.00 . A A . 14 LYS CB 1 1 18 4576 1 1 14 LYS CD C 3.901 -12.888 5.223 1.00 . A A . 14 LYS CD 1 1 18 4577 1 1 14 LYS CE C 3.957 -14.093 4.296 1.00 . A A . 14 LYS CE 1 1 18 4578 1 1 14 LYS CG C 2.498 -12.310 5.300 1.00 . A A . 14 LYS CG 1 1 18 4579 1 1 14 LYS H H 2.321 -10.322 3.261 1.00 . A A . 14 LYS H 1 1 18 4580 1 1 14 LYS HA H 0.452 -10.388 5.457 1.00 . A A . 14 LYS HA 1 1 18 4581 1 1 14 LYS HB2 H 3.474 -10.438 5.514 1.00 . A A . 14 LYS HB2 1 1 18 4582 1 1 14 LYS HB3 H 2.400 -10.855 6.842 1.00 . A A . 14 LYS HB3 1 1 18 4583 1 1 14 LYS HD2 H 4.574 -12.130 4.851 1.00 . A A . 14 LYS HD2 1 1 18 4584 1 1 14 LYS HD3 H 4.210 -13.192 6.214 1.00 . A A . 14 LYS HD3 1 1 18 4585 1 1 14 LYS HE2 H 3.213 -13.972 3.524 1.00 . A A . 14 LYS HE2 1 1 18 4586 1 1 14 LYS HE3 H 4.938 -14.139 3.847 1.00 . A A . 14 LYS HE3 1 1 18 4587 1 1 14 LYS HG2 H 1.915 -12.897 5.995 1.00 . A A . 14 LYS HG2 1 1 18 4588 1 1 14 LYS HG3 H 2.045 -12.356 4.319 1.00 . A A . 14 LYS HG3 1 1 18 4589 1 1 14 LYS HZ1 H 2.759 -15.335 5.473 1.00 . A A . 14 LYS HZ1 1 1 18 4590 1 1 14 LYS HZ2 H 4.416 -15.509 5.762 1.00 . A A . 14 LYS HZ2 1 1 18 4591 1 1 14 LYS HZ3 H 3.728 -16.168 4.364 1.00 . A A . 14 LYS HZ3 1 1 18 4592 1 1 14 LYS N N 1.474 -10.078 3.691 1.00 . A A . 14 LYS N 1 1 18 4593 1 1 14 LYS NZ N 3.697 -15.366 5.024 1.00 . A A . 14 LYS NZ 1 1 18 4594 1 1 14 LYS O O 0.767 -8.102 6.458 1.00 . A A . 14 LYS O 1 1 18 4595 1 1 15 GLY C C 2.392 -5.502 4.370 1.00 . A A . 15 GLY C 1 1 18 4596 1 1 15 GLY CA C 2.753 -6.474 5.476 1.00 . A A . 15 GLY CA 1 1 18 4597 1 1 15 GLY H H 3.127 -8.277 4.431 1.00 . A A . 15 GLY H 1 1 18 4598 1 1 15 GLY HA2 H 2.150 -6.255 6.345 1.00 . A A . 15 GLY HA2 1 1 18 4599 1 1 15 GLY HA3 H 3.794 -6.341 5.730 1.00 . A A . 15 GLY HA3 1 1 18 4600 1 1 15 GLY N N 2.537 -7.857 5.091 1.00 . A A . 15 GLY N 1 1 18 4601 1 1 15 GLY O O 3.073 -4.497 4.171 1.00 . A A . 15 GLY O 1 1 18 4602 1 1 16 GLY C C 0.764 -3.489 2.992 1.00 . A A . 16 GLY C 1 1 18 4603 1 1 16 GLY CA C 0.886 -4.938 2.565 1.00 . A A . 16 GLY CA 1 1 18 4604 1 1 16 GLY H H 0.811 -6.617 3.853 1.00 . A A . 16 GLY H 1 1 18 4605 1 1 16 GLY HA2 H 1.601 -5.006 1.759 1.00 . A A . 16 GLY HA2 1 1 18 4606 1 1 16 GLY HA3 H -0.076 -5.278 2.209 1.00 . A A . 16 GLY HA3 1 1 18 4607 1 1 16 GLY N N 1.316 -5.802 3.648 1.00 . A A . 16 GLY N 1 1 18 4608 1 1 16 GLY O O -0.305 -3.047 3.413 1.00 . A A . 16 GLY O 1 1 19 4609 1 1 1 VAL C C 1.434 -1.561 -3.254 1.00 . A A . 1 VAL C 1 1 19 4610 1 1 1 VAL CA C 2.317 -1.054 -2.119 1.00 . A A . 1 VAL CA 1 1 19 4611 1 1 1 VAL CB C 3.688 -1.752 -2.199 1.00 . A A . 1 VAL CB 1 1 19 4612 1 1 1 VAL CG1 C 4.812 -0.746 -2.001 1.00 . A A . 1 VAL CG1 1 1 19 4613 1 1 1 VAL CG2 C 3.776 -2.872 -1.173 1.00 . A A . 1 VAL CG2 1 1 19 4614 1 1 1 VAL H1 H 0.756 -0.991 -0.692 1.00 . A A . 1 VAL H1 1 1 19 4615 1 1 1 VAL HA H 2.470 0.009 -2.242 1.00 . A A . 1 VAL HA 1 1 19 4616 1 1 1 VAL HB H 3.792 -2.185 -3.183 1.00 . A A . 1 VAL HB 1 1 19 4617 1 1 1 VAL HG11 H 5.663 -1.035 -2.600 1.00 . A A . 1 VAL HG11 1 1 19 4618 1 1 1 VAL HG12 H 4.475 0.235 -2.301 1.00 . A A . 1 VAL HG12 1 1 19 4619 1 1 1 VAL HG13 H 5.097 -0.726 -0.959 1.00 . A A . 1 VAL HG13 1 1 19 4620 1 1 1 VAL HG21 H 3.963 -2.450 -0.197 1.00 . A A . 1 VAL HG21 1 1 19 4621 1 1 1 VAL HG22 H 2.844 -3.419 -1.156 1.00 . A A . 1 VAL HG22 1 1 19 4622 1 1 1 VAL HG23 H 4.581 -3.540 -1.437 1.00 . A A . 1 VAL HG23 1 1 19 4623 1 1 1 VAL N N 1.685 -1.271 -0.823 1.00 . A A . 1 VAL N 1 1 19 4624 1 1 1 VAL O O 0.742 -0.784 -3.910 1.00 . A A . 1 VAL O 1 1 19 4625 1 1 2 ALA C C -0.816 -3.493 -4.162 1.00 . A A . 2 ALA C 1 1 19 4626 1 1 2 ALA CA C 0.663 -3.483 -4.532 1.00 . A A . 2 ALA CA 1 1 19 4627 1 1 2 ALA CB C 1.149 -4.898 -4.809 1.00 . A A . 2 ALA CB 1 1 19 4628 1 1 2 ALA H H 2.035 -3.439 -2.921 1.00 . A A . 2 ALA H 1 1 19 4629 1 1 2 ALA HA H 0.795 -2.900 -5.432 1.00 . A A . 2 ALA HA 1 1 19 4630 1 1 2 ALA HB1 H 1.206 -5.055 -5.876 1.00 . A A . 2 ALA HB1 1 1 19 4631 1 1 2 ALA HB2 H 2.127 -5.034 -4.372 1.00 . A A . 2 ALA HB2 1 1 19 4632 1 1 2 ALA HB3 H 0.459 -5.607 -4.376 1.00 . A A . 2 ALA HB3 1 1 19 4633 1 1 2 ALA N N 1.463 -2.871 -3.478 1.00 . A A . 2 ALA N 1 1 19 4634 1 1 2 ALA O O -1.258 -4.308 -3.352 1.00 . A A . 2 ALA O 1 1 19 4635 1 1 3 ARG C C -3.571 -3.834 -4.058 1.00 . A A . 3 ARG C 1 1 19 4636 1 1 3 ARG CA C -3.007 -2.485 -4.492 1.00 . A A . 3 ARG CA 1 1 19 4637 1 1 3 ARG CB C -3.747 -1.986 -5.733 1.00 . A A . 3 ARG CB 1 1 19 4638 1 1 3 ARG CD C -4.608 0.220 -6.577 1.00 . A A . 3 ARG CD 1 1 19 4639 1 1 3 ARG CG C -4.671 -0.810 -5.460 1.00 . A A . 3 ARG CG 1 1 19 4640 1 1 3 ARG CZ C -4.163 2.346 -5.425 1.00 . A A . 3 ARG CZ 1 1 19 4641 1 1 3 ARG H H -1.167 -1.959 -5.396 1.00 . A A . 3 ARG H 1 1 19 4642 1 1 3 ARG HA H -3.146 -1.775 -3.690 1.00 . A A . 3 ARG HA 1 1 19 4643 1 1 3 ARG HB2 H -3.022 -1.680 -6.473 1.00 . A A . 3 ARG HB2 1 1 19 4644 1 1 3 ARG HB3 H -4.339 -2.795 -6.134 1.00 . A A . 3 ARG HB3 1 1 19 4645 1 1 3 ARG HD2 H -3.600 0.251 -6.963 1.00 . A A . 3 ARG HD2 1 1 19 4646 1 1 3 ARG HD3 H -5.285 -0.079 -7.363 1.00 . A A . 3 ARG HD3 1 1 19 4647 1 1 3 ARG HE H -5.879 1.874 -6.325 1.00 . A A . 3 ARG HE 1 1 19 4648 1 1 3 ARG HG2 H -5.685 -1.173 -5.377 1.00 . A A . 3 ARG HG2 1 1 19 4649 1 1 3 ARG HG3 H -4.377 -0.342 -4.533 1.00 . A A . 3 ARG HG3 1 1 19 4650 1 1 3 ARG HH11 H -2.625 1.035 -5.415 1.00 . A A . 3 ARG HH11 1 1 19 4651 1 1 3 ARG HH12 H -2.325 2.538 -4.607 1.00 . A A . 3 ARG HH12 1 1 19 4652 1 1 3 ARG HH21 H -5.496 3.857 -5.263 1.00 . A A . 3 ARG HH21 1 1 19 4653 1 1 3 ARG HH22 H -3.958 4.142 -4.520 1.00 . A A . 3 ARG HH22 1 1 19 4654 1 1 3 ARG N N -1.577 -2.582 -4.760 1.00 . A A . 3 ARG N 1 1 19 4655 1 1 3 ARG NE N -4.978 1.554 -6.113 1.00 . A A . 3 ARG NE 1 1 19 4656 1 1 3 ARG NH1 N -2.937 1.939 -5.124 1.00 . A A . 3 ARG NH1 1 1 19 4657 1 1 3 ARG NH2 N -4.572 3.547 -5.038 1.00 . A A . 3 ARG NH2 1 1 19 4658 1 1 3 ARG O O -4.089 -3.975 -2.951 1.00 . A A . 3 ARG O 1 1 19 4659 1 1 4 GLY C C -3.201 -6.815 -3.505 1.00 . A A . 4 GLY C 1 1 19 4660 1 1 4 GLY CA C -3.972 -6.150 -4.628 1.00 . A A . 4 GLY CA 1 1 19 4661 1 1 4 GLY H H -3.044 -4.654 -5.806 1.00 . A A . 4 GLY H 1 1 19 4662 1 1 4 GLY HA2 H -5.009 -6.069 -4.341 1.00 . A A . 4 GLY HA2 1 1 19 4663 1 1 4 GLY HA3 H -3.900 -6.766 -5.513 1.00 . A A . 4 GLY HA3 1 1 19 4664 1 1 4 GLY N N -3.467 -4.825 -4.939 1.00 . A A . 4 GLY N 1 1 19 4665 1 1 4 GLY O O -2.209 -7.502 -3.747 1.00 . A A . 4 GLY O 1 1 19 4666 1 1 5 TRP C C -3.972 -8.071 -0.323 1.00 . A A . 5 TRP C 1 1 19 4667 1 1 5 TRP CA C -3.003 -7.195 -1.110 1.00 . A A . 5 TRP CA 1 1 19 4668 1 1 5 TRP CB C -2.444 -6.094 -0.208 1.00 . A A . 5 TRP CB 1 1 19 4669 1 1 5 TRP CD1 C -0.768 -4.240 -0.779 1.00 . A A . 5 TRP CD1 1 1 19 4670 1 1 5 TRP CD2 C 0.007 -6.316 -1.106 1.00 . A A . 5 TRP CD2 1 1 19 4671 1 1 5 TRP CE2 C 1.018 -5.398 -1.455 1.00 . A A . 5 TRP CE2 1 1 19 4672 1 1 5 TRP CE3 C 0.268 -7.683 -1.229 1.00 . A A . 5 TRP CE3 1 1 19 4673 1 1 5 TRP CG C -1.126 -5.554 -0.676 1.00 . A A . 5 TRP CG 1 1 19 4674 1 1 5 TRP CH2 C 2.493 -7.150 -2.029 1.00 . A A . 5 TRP CH2 1 1 19 4675 1 1 5 TRP CZ2 C 2.265 -5.806 -1.919 1.00 . A A . 5 TRP CZ2 1 1 19 4676 1 1 5 TRP CZ3 C 1.507 -8.086 -1.690 1.00 . A A . 5 TRP CZ3 1 1 19 4677 1 1 5 TRP H H -4.454 -6.053 -2.147 1.00 . A A . 5 TRP H 1 1 19 4678 1 1 5 TRP HA H -2.187 -7.808 -1.463 1.00 . A A . 5 TRP HA 1 1 19 4679 1 1 5 TRP HB2 H -3.146 -5.274 -0.173 1.00 . A A . 5 TRP HB2 1 1 19 4680 1 1 5 TRP HB3 H -2.308 -6.490 0.788 1.00 . A A . 5 TRP HB3 1 1 19 4681 1 1 5 TRP HD1 H -1.414 -3.413 -0.527 1.00 . A A . 5 TRP HD1 1 1 19 4682 1 1 5 TRP HE1 H 1.003 -3.301 -1.405 1.00 . A A . 5 TRP HE1 1 1 19 4683 1 1 5 TRP HE3 H -0.479 -8.419 -0.972 1.00 . A A . 5 TRP HE3 1 1 19 4684 1 1 5 TRP HH2 H 3.446 -7.510 -2.385 1.00 . A A . 5 TRP HH2 1 1 19 4685 1 1 5 TRP HZ2 H 3.036 -5.097 -2.184 1.00 . A A . 5 TRP HZ2 1 1 19 4686 1 1 5 TRP HZ3 H 1.727 -9.139 -1.792 1.00 . A A . 5 TRP HZ3 1 1 19 4687 1 1 5 TRP N N -3.658 -6.610 -2.275 1.00 . A A . 5 TRP N 1 1 19 4688 1 1 5 TRP NE1 N 0.519 -4.139 -1.247 1.00 . A A . 5 TRP NE1 1 1 19 4689 1 1 5 TRP O O -3.921 -9.298 -0.404 1.00 . A A . 5 TRP O 1 1 19 4690 1 1 6 LYS C C -6.147 -9.515 0.624 1.00 . A A . 6 LYS C 1 1 19 4691 1 1 6 LYS CA C -5.838 -8.153 1.238 1.00 . A A . 6 LYS CA 1 1 19 4692 1 1 6 LYS CB C -7.124 -7.334 1.362 1.00 . A A . 6 LYS CB 1 1 19 4693 1 1 6 LYS CD C -8.286 -6.609 3.468 1.00 . A A . 6 LYS CD 1 1 19 4694 1 1 6 LYS CE C -8.347 -7.078 4.914 1.00 . A A . 6 LYS CE 1 1 19 4695 1 1 6 LYS CG C -8.010 -7.763 2.520 1.00 . A A . 6 LYS CG 1 1 19 4696 1 1 6 LYS H H -4.846 -6.452 0.460 1.00 . A A . 6 LYS H 1 1 19 4697 1 1 6 LYS HA H -5.419 -8.302 2.222 1.00 . A A . 6 LYS HA 1 1 19 4698 1 1 6 LYS HB2 H -6.864 -6.295 1.502 1.00 . A A . 6 LYS HB2 1 1 19 4699 1 1 6 LYS HB3 H -7.690 -7.435 0.447 1.00 . A A . 6 LYS HB3 1 1 19 4700 1 1 6 LYS HD2 H -7.497 -5.878 3.372 1.00 . A A . 6 LYS HD2 1 1 19 4701 1 1 6 LYS HD3 H -9.232 -6.157 3.205 1.00 . A A . 6 LYS HD3 1 1 19 4702 1 1 6 LYS HE2 H -9.199 -6.620 5.392 1.00 . A A . 6 LYS HE2 1 1 19 4703 1 1 6 LYS HE3 H -8.462 -8.152 4.925 1.00 . A A . 6 LYS HE3 1 1 19 4704 1 1 6 LYS HG2 H -8.948 -8.126 2.128 1.00 . A A . 6 LYS HG2 1 1 19 4705 1 1 6 LYS HG3 H -7.515 -8.555 3.065 1.00 . A A . 6 LYS HG3 1 1 19 4706 1 1 6 LYS HZ1 H -7.364 -6.168 6.517 1.00 . A A . 6 LYS HZ1 1 1 19 4707 1 1 6 LYS HZ2 H -6.488 -6.138 5.071 1.00 . A A . 6 LYS HZ2 1 1 19 4708 1 1 6 LYS HZ3 H -6.606 -7.574 5.957 1.00 . A A . 6 LYS HZ3 1 1 19 4709 1 1 6 LYS N N -4.855 -7.433 0.437 1.00 . A A . 6 LYS N 1 1 19 4710 1 1 6 LYS NZ N -7.115 -6.714 5.667 1.00 . A A . 6 LYS NZ 1 1 19 4711 1 1 6 LYS O O -5.770 -10.552 1.170 1.00 . A A . 6 LYS O 1 1 19 4712 1 1 7 ARG C C -6.068 -11.190 -2.131 1.00 . A A . 7 ARG C 1 1 19 4713 1 1 7 ARG CA C -7.191 -10.739 -1.201 1.00 . A A . 7 ARG CA 1 1 19 4714 1 1 7 ARG CB C -8.482 -10.546 -2.000 1.00 . A A . 7 ARG CB 1 1 19 4715 1 1 7 ARG CD C -10.504 -11.217 -0.668 1.00 . A A . 7 ARG CD 1 1 19 4716 1 1 7 ARG CG C -9.520 -11.628 -1.751 1.00 . A A . 7 ARG CG 1 1 19 4717 1 1 7 ARG CZ C -12.696 -11.927 0.191 1.00 . A A . 7 ARG CZ 1 1 19 4718 1 1 7 ARG H H -7.105 -8.645 -0.900 1.00 . A A . 7 ARG H 1 1 19 4719 1 1 7 ARG HA H -7.352 -11.501 -0.454 1.00 . A A . 7 ARG HA 1 1 19 4720 1 1 7 ARG HB2 H -8.917 -9.593 -1.735 1.00 . A A . 7 ARG HB2 1 1 19 4721 1 1 7 ARG HB3 H -8.242 -10.543 -3.053 1.00 . A A . 7 ARG HB3 1 1 19 4722 1 1 7 ARG HD2 H -9.987 -11.194 0.280 1.00 . A A . 7 ARG HD2 1 1 19 4723 1 1 7 ARG HD3 H -10.880 -10.232 -0.897 1.00 . A A . 7 ARG HD3 1 1 19 4724 1 1 7 ARG HE H -11.586 -12.968 -1.099 1.00 . A A . 7 ARG HE 1 1 19 4725 1 1 7 ARG HG2 H -10.064 -11.810 -2.666 1.00 . A A . 7 ARG HG2 1 1 19 4726 1 1 7 ARG HG3 H -9.016 -12.533 -1.444 1.00 . A A . 7 ARG HG3 1 1 19 4727 1 1 7 ARG HH11 H -12.044 -10.148 0.892 1.00 . A A . 7 ARG HH11 1 1 19 4728 1 1 7 ARG HH12 H -13.587 -10.660 1.489 1.00 . A A . 7 ARG HH12 1 1 19 4729 1 1 7 ARG HH21 H -13.617 -13.653 -0.320 1.00 . A A . 7 ARG HH21 1 1 19 4730 1 1 7 ARG HH22 H -14.481 -12.654 0.800 1.00 . A A . 7 ARG HH22 1 1 19 4731 1 1 7 ARG N N -6.833 -9.504 -0.514 1.00 . A A . 7 ARG N 1 1 19 4732 1 1 7 ARG NE N -11.629 -12.144 -0.570 1.00 . A A . 7 ARG NE 1 1 19 4733 1 1 7 ARG NH1 N -12.782 -10.821 0.917 1.00 . A A . 7 ARG NH1 1 1 19 4734 1 1 7 ARG NH2 N -13.679 -12.818 0.227 1.00 . A A . 7 ARG NH2 1 1 19 4735 1 1 7 ARG O O -5.696 -12.363 -2.148 1.00 . A A . 7 ARG O 1 1 19 4736 1 1 8 LYS C C -3.115 -10.643 -3.104 1.00 . A A . 8 LYS C 1 1 19 4737 1 1 8 LYS CA C -4.451 -10.549 -3.834 1.00 . A A . 8 LYS CA 1 1 19 4738 1 1 8 LYS CB C -4.376 -9.474 -4.921 1.00 . A A . 8 LYS CB 1 1 19 4739 1 1 8 LYS CD C -4.098 -11.159 -6.763 1.00 . A A . 8 LYS CD 1 1 19 4740 1 1 8 LYS CE C -2.596 -10.937 -6.669 1.00 . A A . 8 LYS CE 1 1 19 4741 1 1 8 LYS CG C -4.872 -9.946 -6.277 1.00 . A A . 8 LYS CG 1 1 19 4742 1 1 8 LYS H H -5.872 -9.332 -2.843 1.00 . A A . 8 LYS H 1 1 19 4743 1 1 8 LYS HA H -4.664 -11.501 -4.295 1.00 . A A . 8 LYS HA 1 1 19 4744 1 1 8 LYS HB2 H -4.974 -8.628 -4.616 1.00 . A A . 8 LYS HB2 1 1 19 4745 1 1 8 LYS HB3 H -3.348 -9.159 -5.027 1.00 . A A . 8 LYS HB3 1 1 19 4746 1 1 8 LYS HD2 H -4.362 -12.012 -6.156 1.00 . A A . 8 LYS HD2 1 1 19 4747 1 1 8 LYS HD3 H -4.360 -11.354 -7.794 1.00 . A A . 8 LYS HD3 1 1 19 4748 1 1 8 LYS HE2 H -2.401 -9.875 -6.682 1.00 . A A . 8 LYS HE2 1 1 19 4749 1 1 8 LYS HE3 H -2.241 -11.356 -5.739 1.00 . A A . 8 LYS HE3 1 1 19 4750 1 1 8 LYS HG2 H -5.917 -10.207 -6.197 1.00 . A A . 8 LYS HG2 1 1 19 4751 1 1 8 LYS HG3 H -4.754 -9.144 -6.992 1.00 . A A . 8 LYS HG3 1 1 19 4752 1 1 8 LYS HZ1 H -2.417 -12.381 -8.168 1.00 . A A . 8 LYS HZ1 1 1 19 4753 1 1 8 LYS HZ2 H -0.942 -11.923 -7.478 1.00 . A A . 8 LYS HZ2 1 1 19 4754 1 1 8 LYS HZ3 H -1.723 -10.890 -8.566 1.00 . A A . 8 LYS HZ3 1 1 19 4755 1 1 8 LYS N N -5.532 -10.250 -2.902 1.00 . A A . 8 LYS N 1 1 19 4756 1 1 8 LYS NZ N -1.868 -11.577 -7.799 1.00 . A A . 8 LYS NZ 1 1 19 4757 1 1 8 LYS O O -2.634 -9.659 -2.540 1.00 . A A . 8 LYS O 1 1 19 4758 1 1 9 CYS C C -0.157 -12.405 -3.477 1.00 . A A . 9 CYS C 1 1 19 4759 1 1 9 CYS CA C -1.238 -12.053 -2.460 1.00 . A A . 9 CYS CA 1 1 19 4760 1 1 9 CYS CB C -1.362 -13.169 -1.422 1.00 . A A . 9 CYS CB 1 1 19 4761 1 1 9 CYS H H -2.953 -12.576 -3.586 1.00 . A A . 9 CYS H 1 1 19 4762 1 1 9 CYS HA H -0.961 -11.137 -1.961 1.00 . A A . 9 CYS HA 1 1 19 4763 1 1 9 CYS HB2 H -1.396 -14.121 -1.931 1.00 . A A . 9 CYS HB2 1 1 19 4764 1 1 9 CYS HB3 H -0.498 -13.145 -0.775 1.00 . A A . 9 CYS HB3 1 1 19 4765 1 1 9 CYS HG H -3.868 -13.497 -1.083 1.00 . A A . 9 CYS HG 1 1 19 4766 1 1 9 CYS N N -2.520 -11.831 -3.120 1.00 . A A . 9 CYS N 1 1 19 4767 1 1 9 CYS O O 0.314 -13.540 -3.551 1.00 . A A . 9 CYS O 1 1 19 4768 1 1 9 CYS SG S -2.836 -13.050 -0.382 1.00 . A A . 9 CYS SG 1 1 19 4769 1 1 10 PRO C C 2.661 -11.799 -4.712 1.00 . A A . 10 PRO C 1 1 19 4770 1 1 10 PRO CA C 1.274 -11.591 -5.310 1.00 . A A . 10 PRO CA 1 1 19 4771 1 1 10 PRO CB C 1.223 -10.279 -6.098 1.00 . A A . 10 PRO CB 1 1 19 4772 1 1 10 PRO CD C -0.274 -10.032 -4.250 1.00 . A A . 10 PRO CD 1 1 19 4773 1 1 10 PRO CG C 0.682 -9.280 -5.134 1.00 . A A . 10 PRO CG 1 1 19 4774 1 1 10 PRO HA H 1.039 -12.416 -5.966 1.00 . A A . 10 PRO HA 1 1 19 4775 1 1 10 PRO HB2 H 2.218 -10.014 -6.426 1.00 . A A . 10 PRO HB2 1 1 19 4776 1 1 10 PRO HB3 H 0.574 -10.393 -6.953 1.00 . A A . 10 PRO HB3 1 1 19 4777 1 1 10 PRO HD2 H -0.251 -9.635 -3.246 1.00 . A A . 10 PRO HD2 1 1 19 4778 1 1 10 PRO HD3 H -1.275 -9.988 -4.653 1.00 . A A . 10 PRO HD3 1 1 19 4779 1 1 10 PRO HG2 H 1.486 -8.862 -4.548 1.00 . A A . 10 PRO HG2 1 1 19 4780 1 1 10 PRO HG3 H 0.161 -8.499 -5.669 1.00 . A A . 10 PRO HG3 1 1 19 4781 1 1 10 PRO N N 0.245 -11.410 -4.282 1.00 . A A . 10 PRO N 1 1 19 4782 1 1 10 PRO O O 3.367 -12.743 -5.069 1.00 . A A . 10 PRO O 1 1 19 4783 1 1 11 LEU C C 4.197 -11.143 -1.641 1.00 . A A . 11 LEU C 1 1 19 4784 1 1 11 LEU CA C 4.350 -10.999 -3.151 1.00 . A A . 11 LEU CA 1 1 19 4785 1 1 11 LEU CB C 5.186 -9.761 -3.476 1.00 . A A . 11 LEU CB 1 1 19 4786 1 1 11 LEU CD1 C 5.249 -7.390 -4.287 1.00 . A A . 11 LEU CD1 1 1 19 4787 1 1 11 LEU CD2 C 4.506 -9.216 -5.826 1.00 . A A . 11 LEU CD2 1 1 19 4788 1 1 11 LEU CG C 4.527 -8.724 -4.386 1.00 . A A . 11 LEU CG 1 1 19 4789 1 1 11 LEU H H 2.440 -10.182 -3.557 1.00 . A A . 11 LEU H 1 1 19 4790 1 1 11 LEU HA H 4.853 -11.874 -3.535 1.00 . A A . 11 LEU HA 1 1 19 4791 1 1 11 LEU HB2 H 5.431 -9.274 -2.544 1.00 . A A . 11 LEU HB2 1 1 19 4792 1 1 11 LEU HB3 H 6.096 -10.093 -3.956 1.00 . A A . 11 LEU HB3 1 1 19 4793 1 1 11 LEU HD11 H 4.740 -6.757 -3.575 1.00 . A A . 11 LEU HD11 1 1 19 4794 1 1 11 LEU HD12 H 5.254 -6.911 -5.255 1.00 . A A . 11 LEU HD12 1 1 19 4795 1 1 11 LEU HD13 H 6.265 -7.554 -3.961 1.00 . A A . 11 LEU HD13 1 1 19 4796 1 1 11 LEU HD21 H 3.726 -8.703 -6.370 1.00 . A A . 11 LEU HD21 1 1 19 4797 1 1 11 LEU HD22 H 4.315 -10.279 -5.841 1.00 . A A . 11 LEU HD22 1 1 19 4798 1 1 11 LEU HD23 H 5.460 -9.014 -6.289 1.00 . A A . 11 LEU HD23 1 1 19 4799 1 1 11 LEU HG H 3.504 -8.574 -4.068 1.00 . A A . 11 LEU HG 1 1 19 4800 1 1 11 LEU N N 3.046 -10.912 -3.800 1.00 . A A . 11 LEU N 1 1 19 4801 1 1 11 LEU O O 4.340 -12.236 -1.093 1.00 . A A . 11 LEU O 1 1 19 4802 1 1 12 PHE C C 2.340 -9.538 0.857 1.00 . A A . 12 PHE C 1 1 19 4803 1 1 12 PHE CA C 3.731 -10.034 0.475 1.00 . A A . 12 PHE CA 1 1 19 4804 1 1 12 PHE CB C 4.796 -9.158 1.139 1.00 . A A . 12 PHE CB 1 1 19 4805 1 1 12 PHE CD1 C 5.052 -7.138 -0.327 1.00 . A A . 12 PHE CD1 1 1 19 4806 1 1 12 PHE CD2 C 6.835 -8.720 -0.257 1.00 . A A . 12 PHE CD2 1 1 19 4807 1 1 12 PHE CE1 C 5.767 -6.366 -1.223 1.00 . A A . 12 PHE CE1 1 1 19 4808 1 1 12 PHE CE2 C 7.555 -7.952 -1.153 1.00 . A A . 12 PHE CE2 1 1 19 4809 1 1 12 PHE CG C 5.577 -8.322 0.165 1.00 . A A . 12 PHE CG 1 1 19 4810 1 1 12 PHE CZ C 7.020 -6.774 -1.637 1.00 . A A . 12 PHE CZ 1 1 19 4811 1 1 12 PHE H H 3.804 -9.190 -1.465 1.00 . A A . 12 PHE H 1 1 19 4812 1 1 12 PHE HA H 3.846 -11.050 0.821 1.00 . A A . 12 PHE HA 1 1 19 4813 1 1 12 PHE HB2 H 4.318 -8.491 1.840 1.00 . A A . 12 PHE HB2 1 1 19 4814 1 1 12 PHE HB3 H 5.493 -9.791 1.668 1.00 . A A . 12 PHE HB3 1 1 19 4815 1 1 12 PHE HD1 H 4.071 -6.818 -0.004 1.00 . A A . 12 PHE HD1 1 1 19 4816 1 1 12 PHE HD2 H 7.254 -9.641 0.119 1.00 . A A . 12 PHE HD2 1 1 19 4817 1 1 12 PHE HE1 H 5.346 -5.445 -1.599 1.00 . A A . 12 PHE HE1 1 1 19 4818 1 1 12 PHE HE2 H 8.534 -8.273 -1.475 1.00 . A A . 12 PHE HE2 1 1 19 4819 1 1 12 PHE HZ H 7.581 -6.172 -2.336 1.00 . A A . 12 PHE HZ 1 1 19 4820 1 1 12 PHE N N 3.905 -10.032 -0.973 1.00 . A A . 12 PHE N 1 1 19 4821 1 1 12 PHE O O 2.141 -8.353 1.121 1.00 . A A . 12 PHE O 1 1 19 4822 1 1 13 GLY C C -0.224 -10.120 2.729 1.00 . A A . 13 GLY C 1 1 19 4823 1 1 13 GLY CA C 0.016 -10.094 1.233 1.00 . A A . 13 GLY CA 1 1 19 4824 1 1 13 GLY H H 1.594 -11.386 0.663 1.00 . A A . 13 GLY H 1 1 19 4825 1 1 13 GLY HA2 H -0.187 -9.100 0.863 1.00 . A A . 13 GLY HA2 1 1 19 4826 1 1 13 GLY HA3 H -0.662 -10.789 0.759 1.00 . A A . 13 GLY HA3 1 1 19 4827 1 1 13 GLY N N 1.378 -10.456 0.883 1.00 . A A . 13 GLY N 1 1 19 4828 1 1 13 GLY O O -1.359 -9.980 3.186 1.00 . A A . 13 GLY O 1 1 19 4829 1 1 14 LYS C C 0.488 -8.954 5.520 1.00 . A A . 14 LYS C 1 1 19 4830 1 1 14 LYS CA C 0.747 -10.345 4.950 1.00 . A A . 14 LYS CA 1 1 19 4831 1 1 14 LYS CB C 2.029 -10.924 5.551 1.00 . A A . 14 LYS CB 1 1 19 4832 1 1 14 LYS CD C 4.535 -10.827 5.702 1.00 . A A . 14 LYS CD 1 1 19 4833 1 1 14 LYS CE C 5.263 -11.585 4.602 1.00 . A A . 14 LYS CE 1 1 19 4834 1 1 14 LYS CG C 3.281 -10.150 5.176 1.00 . A A . 14 LYS CG 1 1 19 4835 1 1 14 LYS H H 1.724 -10.406 3.073 1.00 . A A . 14 LYS H 1 1 19 4836 1 1 14 LYS HA H -0.083 -10.986 5.207 1.00 . A A . 14 LYS HA 1 1 19 4837 1 1 14 LYS HB2 H 1.940 -10.924 6.628 1.00 . A A . 14 LYS HB2 1 1 19 4838 1 1 14 LYS HB3 H 2.145 -11.942 5.209 1.00 . A A . 14 LYS HB3 1 1 19 4839 1 1 14 LYS HD2 H 5.198 -10.076 6.105 1.00 . A A . 14 LYS HD2 1 1 19 4840 1 1 14 LYS HD3 H 4.258 -11.522 6.483 1.00 . A A . 14 LYS HD3 1 1 19 4841 1 1 14 LYS HE2 H 4.539 -12.142 4.028 1.00 . A A . 14 LYS HE2 1 1 19 4842 1 1 14 LYS HE3 H 5.759 -10.872 3.961 1.00 . A A . 14 LYS HE3 1 1 19 4843 1 1 14 LYS HG2 H 3.344 -10.085 4.100 1.00 . A A . 14 LYS HG2 1 1 19 4844 1 1 14 LYS HG3 H 3.217 -9.155 5.595 1.00 . A A . 14 LYS HG3 1 1 19 4845 1 1 14 LYS HZ1 H 6.267 -12.491 6.194 1.00 . A A . 14 LYS HZ1 1 1 19 4846 1 1 14 LYS HZ2 H 7.223 -12.272 4.816 1.00 . A A . 14 LYS HZ2 1 1 19 4847 1 1 14 LYS HZ3 H 6.060 -13.499 4.851 1.00 . A A . 14 LYS HZ3 1 1 19 4848 1 1 14 LYS N N 0.845 -10.301 3.496 1.00 . A A . 14 LYS N 1 1 19 4849 1 1 14 LYS NZ N 6.274 -12.528 5.154 1.00 . A A . 14 LYS NZ 1 1 19 4850 1 1 14 LYS O O -0.316 -8.788 6.436 1.00 . A A . 14 LYS O 1 1 19 4851 1 1 15 GLY C C 0.522 -5.662 4.343 1.00 . A A . 15 GLY C 1 1 19 4852 1 1 15 GLY CA C 1.004 -6.593 5.437 1.00 . A A . 15 GLY CA 1 1 19 4853 1 1 15 GLY H H 1.803 -8.149 4.243 1.00 . A A . 15 GLY H 1 1 19 4854 1 1 15 GLY HA2 H 0.286 -6.588 6.243 1.00 . A A . 15 GLY HA2 1 1 19 4855 1 1 15 GLY HA3 H 1.951 -6.231 5.810 1.00 . A A . 15 GLY HA3 1 1 19 4856 1 1 15 GLY N N 1.175 -7.957 4.971 1.00 . A A . 15 GLY N 1 1 19 4857 1 1 15 GLY O O -0.252 -4.741 4.598 1.00 . A A . 15 GLY O 1 1 19 4858 1 1 16 GLY C C 0.795 -3.593 2.272 1.00 . A A . 16 GLY C 1 1 19 4859 1 1 16 GLY CA C 0.583 -5.069 2.000 1.00 . A A . 16 GLY CA 1 1 19 4860 1 1 16 GLY H H 1.597 -6.652 2.974 1.00 . A A . 16 GLY H 1 1 19 4861 1 1 16 GLY HA2 H 1.159 -5.350 1.131 1.00 . A A . 16 GLY HA2 1 1 19 4862 1 1 16 GLY HA3 H -0.464 -5.238 1.794 1.00 . A A . 16 GLY HA3 1 1 19 4863 1 1 16 GLY N N 0.982 -5.903 3.118 1.00 . A A . 16 GLY N 1 1 19 4864 1 1 16 GLY O O -0.033 -2.761 1.901 1.00 . A A . 16 GLY O 1 1 20 4865 1 1 1 VAL C C 2.149 -0.792 -2.827 1.00 . A A . 1 VAL C 1 1 20 4866 1 1 1 VAL CA C 2.736 -0.063 -1.624 1.00 . A A . 1 VAL CA 1 1 20 4867 1 1 1 VAL CB C 4.038 -0.766 -1.196 1.00 . A A . 1 VAL CB 1 1 20 4868 1 1 1 VAL CG1 C 4.698 -0.016 -0.049 1.00 . A A . 1 VAL CG1 1 1 20 4869 1 1 1 VAL CG2 C 3.762 -2.211 -0.810 1.00 . A A . 1 VAL CG2 1 1 20 4870 1 1 1 VAL H1 H 0.845 0.225 -0.717 1.00 . A A . 1 VAL H1 1 1 20 4871 1 1 1 VAL HA H 2.976 0.951 -1.911 1.00 . A A . 1 VAL HA 1 1 20 4872 1 1 1 VAL HB H 4.717 -0.763 -2.037 1.00 . A A . 1 VAL HB 1 1 20 4873 1 1 1 VAL HG11 H 5.763 0.042 -0.223 1.00 . A A . 1 VAL HG11 1 1 20 4874 1 1 1 VAL HG12 H 4.287 0.981 0.013 1.00 . A A . 1 VAL HG12 1 1 20 4875 1 1 1 VAL HG13 H 4.514 -0.540 0.877 1.00 . A A . 1 VAL HG13 1 1 20 4876 1 1 1 VAL HG21 H 3.184 -2.234 0.102 1.00 . A A . 1 VAL HG21 1 1 20 4877 1 1 1 VAL HG22 H 3.206 -2.695 -1.600 1.00 . A A . 1 VAL HG22 1 1 20 4878 1 1 1 VAL HG23 H 4.697 -2.729 -0.659 1.00 . A A . 1 VAL HG23 1 1 20 4879 1 1 1 VAL N N 1.779 -0.005 -0.526 1.00 . A A . 1 VAL N 1 1 20 4880 1 1 1 VAL O O 2.524 -0.527 -3.969 1.00 . A A . 1 VAL O 1 1 20 4881 1 1 2 ALA C C -0.932 -2.350 -3.553 1.00 . A A . 2 ALA C 1 1 20 4882 1 1 2 ALA CA C 0.586 -2.477 -3.624 1.00 . A A . 2 ALA CA 1 1 20 4883 1 1 2 ALA CB C 0.999 -3.940 -3.543 1.00 . A A . 2 ALA CB 1 1 20 4884 1 1 2 ALA H H 0.970 -1.877 -1.632 1.00 . A A . 2 ALA H 1 1 20 4885 1 1 2 ALA HA H 0.926 -2.085 -4.572 1.00 . A A . 2 ALA HA 1 1 20 4886 1 1 2 ALA HB1 H 1.985 -4.010 -3.108 1.00 . A A . 2 ALA HB1 1 1 20 4887 1 1 2 ALA HB2 H 0.294 -4.479 -2.928 1.00 . A A . 2 ALA HB2 1 1 20 4888 1 1 2 ALA HB3 H 1.011 -4.365 -4.535 1.00 . A A . 2 ALA HB3 1 1 20 4889 1 1 2 ALA N N 1.227 -1.711 -2.563 1.00 . A A . 2 ALA N 1 1 20 4890 1 1 2 ALA O O -1.546 -2.687 -2.541 1.00 . A A . 2 ALA O 1 1 20 4891 1 1 3 ARG C C -3.697 -2.949 -4.225 1.00 . A A . 3 ARG C 1 1 20 4892 1 1 3 ARG CA C -2.978 -1.687 -4.693 1.00 . A A . 3 ARG CA 1 1 20 4893 1 1 3 ARG CB C -3.413 -1.337 -6.117 1.00 . A A . 3 ARG CB 1 1 20 4894 1 1 3 ARG CD C -3.340 -2.139 -8.498 1.00 . A A . 3 ARG CD 1 1 20 4895 1 1 3 ARG CG C -3.501 -2.542 -7.040 1.00 . A A . 3 ARG CG 1 1 20 4896 1 1 3 ARG CZ C -5.661 -2.200 -9.306 1.00 . A A . 3 ARG CZ 1 1 20 4897 1 1 3 ARG H H -0.988 -1.610 -5.410 1.00 . A A . 3 ARG H 1 1 20 4898 1 1 3 ARG HA H -3.241 -0.872 -4.035 1.00 . A A . 3 ARG HA 1 1 20 4899 1 1 3 ARG HB2 H -4.386 -0.869 -6.079 1.00 . A A . 3 ARG HB2 1 1 20 4900 1 1 3 ARG HB3 H -2.704 -0.640 -6.536 1.00 . A A . 3 ARG HB3 1 1 20 4901 1 1 3 ARG HD2 H -2.525 -1.434 -8.574 1.00 . A A . 3 ARG HD2 1 1 20 4902 1 1 3 ARG HD3 H -3.109 -3.021 -9.077 1.00 . A A . 3 ARG HD3 1 1 20 4903 1 1 3 ARG HE H -4.535 -0.558 -9.197 1.00 . A A . 3 ARG HE 1 1 20 4904 1 1 3 ARG HG2 H -2.718 -3.239 -6.782 1.00 . A A . 3 ARG HG2 1 1 20 4905 1 1 3 ARG HG3 H -4.464 -3.013 -6.910 1.00 . A A . 3 ARG HG3 1 1 20 4906 1 1 3 ARG HH11 H -4.914 -3.986 -8.728 1.00 . A A . 3 ARG HH11 1 1 20 4907 1 1 3 ARG HH12 H -6.549 -4.016 -9.299 1.00 . A A . 3 ARG HH12 1 1 20 4908 1 1 3 ARG HH21 H -6.687 -0.583 -9.951 1.00 . A A . 3 ARG HH21 1 1 20 4909 1 1 3 ARG HH22 H -7.557 -2.080 -9.996 1.00 . A A . 3 ARG HH22 1 1 20 4910 1 1 3 ARG N N -1.532 -1.861 -4.634 1.00 . A A . 3 ARG N 1 1 20 4911 1 1 3 ARG NE N -4.551 -1.523 -9.033 1.00 . A A . 3 ARG NE 1 1 20 4912 1 1 3 ARG NH1 N -5.712 -3.508 -9.094 1.00 . A A . 3 ARG NH1 1 1 20 4913 1 1 3 ARG NH2 N -6.722 -1.569 -9.791 1.00 . A A . 3 ARG NH2 1 1 20 4914 1 1 3 ARG O O -4.785 -2.881 -3.655 1.00 . A A . 3 ARG O 1 1 20 4915 1 1 4 GLY C C -2.826 -6.109 -3.060 1.00 . A A . 4 GLY C 1 1 20 4916 1 1 4 GLY CA C -3.675 -5.362 -4.070 1.00 . A A . 4 GLY CA 1 1 20 4917 1 1 4 GLY H H -2.213 -4.094 -4.929 1.00 . A A . 4 GLY H 1 1 20 4918 1 1 4 GLY HA2 H -4.644 -5.168 -3.636 1.00 . A A . 4 GLY HA2 1 1 20 4919 1 1 4 GLY HA3 H -3.801 -5.982 -4.945 1.00 . A A . 4 GLY HA3 1 1 20 4920 1 1 4 GLY N N -3.080 -4.101 -4.471 1.00 . A A . 4 GLY N 1 1 20 4921 1 1 4 GLY O O -1.770 -6.641 -3.401 1.00 . A A . 4 GLY O 1 1 20 4922 1 1 5 TRP C C -3.443 -7.876 -0.075 1.00 . A A . 5 TRP C 1 1 20 4923 1 1 5 TRP CA C -2.560 -6.833 -0.753 1.00 . A A . 5 TRP CA 1 1 20 4924 1 1 5 TRP CB C -2.055 -5.825 0.281 1.00 . A A . 5 TRP CB 1 1 20 4925 1 1 5 TRP CD1 C -0.339 -3.938 0.033 1.00 . A A . 5 TRP CD1 1 1 20 4926 1 1 5 TRP CD2 C 0.428 -5.962 -0.543 1.00 . A A . 5 TRP CD2 1 1 20 4927 1 1 5 TRP CE2 C 1.461 -5.022 -0.724 1.00 . A A . 5 TRP CE2 1 1 20 4928 1 1 5 TRP CE3 C 0.679 -7.305 -0.840 1.00 . A A . 5 TRP CE3 1 1 20 4929 1 1 5 TRP CG C -0.714 -5.248 -0.058 1.00 . A A . 5 TRP CG 1 1 20 4930 1 1 5 TRP CH2 C 2.941 -6.704 -1.472 1.00 . A A . 5 TRP CH2 1 1 20 4931 1 1 5 TRP CZ2 C 2.723 -5.383 -1.189 1.00 . A A . 5 TRP CZ2 1 1 20 4932 1 1 5 TRP CZ3 C 1.932 -7.661 -1.302 1.00 . A A . 5 TRP CZ3 1 1 20 4933 1 1 5 TRP H H -4.135 -5.704 -1.605 1.00 . A A . 5 TRP H 1 1 20 4934 1 1 5 TRP HA H -1.713 -7.331 -1.200 1.00 . A A . 5 TRP HA 1 1 20 4935 1 1 5 TRP HB2 H -2.760 -5.010 0.354 1.00 . A A . 5 TRP HB2 1 1 20 4936 1 1 5 TRP HB3 H -1.976 -6.314 1.241 1.00 . A A . 5 TRP HB3 1 1 20 4937 1 1 5 TRP HD1 H -0.985 -3.142 0.369 1.00 . A A . 5 TRP HD1 1 1 20 4938 1 1 5 TRP HE1 H 1.466 -2.951 -0.390 1.00 . A A . 5 TRP HE1 1 1 20 4939 1 1 5 TRP HE3 H -0.085 -8.057 -0.715 1.00 . A A . 5 TRP HE3 1 1 20 4940 1 1 5 TRP HH2 H 3.904 -7.028 -1.836 1.00 . A A . 5 TRP HH2 1 1 20 4941 1 1 5 TRP HZ2 H 3.511 -4.657 -1.325 1.00 . A A . 5 TRP HZ2 1 1 20 4942 1 1 5 TRP HZ3 H 2.144 -8.694 -1.537 1.00 . A A . 5 TRP HZ3 1 1 20 4943 1 1 5 TRP N N -3.286 -6.147 -1.815 1.00 . A A . 5 TRP N 1 1 20 4944 1 1 5 TRP NE1 N 0.968 -3.795 -0.366 1.00 . A A . 5 TRP NE1 1 1 20 4945 1 1 5 TRP O O -3.356 -9.067 -0.375 1.00 . A A . 5 TRP O 1 1 20 4946 1 1 6 LYS C C -5.548 -9.530 0.709 1.00 . A A . 6 LYS C 1 1 20 4947 1 1 6 LYS CA C -5.193 -8.314 1.559 1.00 . A A . 6 LYS CA 1 1 20 4948 1 1 6 LYS CB C -6.469 -7.570 1.961 1.00 . A A . 6 LYS CB 1 1 20 4949 1 1 6 LYS CD C -7.336 -7.527 4.318 1.00 . A A . 6 LYS CD 1 1 20 4950 1 1 6 LYS CE C -7.241 -8.458 5.517 1.00 . A A . 6 LYS CE 1 1 20 4951 1 1 6 LYS CG C -7.292 -8.298 3.009 1.00 . A A . 6 LYS CG 1 1 20 4952 1 1 6 LYS H H -4.315 -6.460 1.035 1.00 . A A . 6 LYS H 1 1 20 4953 1 1 6 LYS HA H -4.686 -8.649 2.451 1.00 . A A . 6 LYS HA 1 1 20 4954 1 1 6 LYS HB2 H -6.197 -6.602 2.355 1.00 . A A . 6 LYS HB2 1 1 20 4955 1 1 6 LYS HB3 H -7.083 -7.433 1.083 1.00 . A A . 6 LYS HB3 1 1 20 4956 1 1 6 LYS HD2 H -6.507 -6.836 4.347 1.00 . A A . 6 LYS HD2 1 1 20 4957 1 1 6 LYS HD3 H -8.266 -6.978 4.371 1.00 . A A . 6 LYS HD3 1 1 20 4958 1 1 6 LYS HE2 H -8.083 -9.133 5.500 1.00 . A A . 6 LYS HE2 1 1 20 4959 1 1 6 LYS HE3 H -6.325 -9.024 5.445 1.00 . A A . 6 LYS HE3 1 1 20 4960 1 1 6 LYS HG2 H -8.300 -8.419 2.642 1.00 . A A . 6 LYS HG2 1 1 20 4961 1 1 6 LYS HG3 H -6.853 -9.269 3.189 1.00 . A A . 6 LYS HG3 1 1 20 4962 1 1 6 LYS HZ1 H -8.197 -7.735 7.228 1.00 . A A . 6 LYS HZ1 1 1 20 4963 1 1 6 LYS HZ2 H -6.983 -6.716 6.640 1.00 . A A . 6 LYS HZ2 1 1 20 4964 1 1 6 LYS HZ3 H -6.570 -8.132 7.468 1.00 . A A . 6 LYS HZ3 1 1 20 4965 1 1 6 LYS N N -4.293 -7.421 0.839 1.00 . A A . 6 LYS N 1 1 20 4966 1 1 6 LYS NZ N -7.248 -7.708 6.803 1.00 . A A . 6 LYS NZ 1 1 20 4967 1 1 6 LYS O O -5.056 -10.632 0.950 1.00 . A A . 6 LYS O 1 1 20 4968 1 1 7 ARG C C -5.698 -10.784 -2.132 1.00 . A A . 7 ARG C 1 1 20 4969 1 1 7 ARG CA C -6.822 -10.400 -1.173 1.00 . A A . 7 ARG CA 1 1 20 4970 1 1 7 ARG CB C -8.063 -9.985 -1.966 1.00 . A A . 7 ARG CB 1 1 20 4971 1 1 7 ARG CD C -10.174 -10.923 -0.978 1.00 . A A . 7 ARG CD 1 1 20 4972 1 1 7 ARG CG C -9.275 -9.702 -1.094 1.00 . A A . 7 ARG CG 1 1 20 4973 1 1 7 ARG CZ C -12.101 -11.870 -2.176 1.00 . A A . 7 ARG CZ 1 1 20 4974 1 1 7 ARG H H -6.760 -8.419 -0.430 1.00 . A A . 7 ARG H 1 1 20 4975 1 1 7 ARG HA H -7.066 -11.256 -0.562 1.00 . A A . 7 ARG HA 1 1 20 4976 1 1 7 ARG HB2 H -7.835 -9.091 -2.528 1.00 . A A . 7 ARG HB2 1 1 20 4977 1 1 7 ARG HB3 H -8.317 -10.777 -2.654 1.00 . A A . 7 ARG HB3 1 1 20 4978 1 1 7 ARG HD2 H -9.604 -11.800 -1.245 1.00 . A A . 7 ARG HD2 1 1 20 4979 1 1 7 ARG HD3 H -10.511 -11.009 0.044 1.00 . A A . 7 ARG HD3 1 1 20 4980 1 1 7 ARG HE H -11.562 -9.950 -2.222 1.00 . A A . 7 ARG HE 1 1 20 4981 1 1 7 ARG HG2 H -8.940 -9.421 -0.107 1.00 . A A . 7 ARG HG2 1 1 20 4982 1 1 7 ARG HG3 H -9.839 -8.891 -1.530 1.00 . A A . 7 ARG HG3 1 1 20 4983 1 1 7 ARG HH11 H -11.038 -13.200 -1.089 1.00 . A A . 7 ARG HH11 1 1 20 4984 1 1 7 ARG HH12 H -12.399 -13.855 -1.938 1.00 . A A . 7 ARG HH12 1 1 20 4985 1 1 7 ARG HH21 H -13.357 -10.800 -3.345 1.00 . A A . 7 ARG HH21 1 1 20 4986 1 1 7 ARG HH22 H -13.717 -12.489 -3.222 1.00 . A A . 7 ARG HH22 1 1 20 4987 1 1 7 ARG N N -6.402 -9.321 -0.288 1.00 . A A . 7 ARG N 1 1 20 4988 1 1 7 ARG NE N -11.339 -10.831 -1.855 1.00 . A A . 7 ARG NE 1 1 20 4989 1 1 7 ARG NH1 N -11.823 -13.074 -1.695 1.00 . A A . 7 ARG NH1 1 1 20 4990 1 1 7 ARG NH2 N -13.144 -11.707 -2.980 1.00 . A A . 7 ARG NH2 1 1 20 4991 1 1 7 ARG O O -5.347 -11.958 -2.255 1.00 . A A . 7 ARG O 1 1 20 4992 1 1 8 LYS C C -2.707 -10.058 -3.042 1.00 . A A . 8 LYS C 1 1 20 4993 1 1 8 LYS CA C -4.055 -10.020 -3.756 1.00 . A A . 8 LYS CA 1 1 20 4994 1 1 8 LYS CB C -4.044 -8.928 -4.829 1.00 . A A . 8 LYS CB 1 1 20 4995 1 1 8 LYS CD C -6.190 -8.990 -6.134 1.00 . A A . 8 LYS CD 1 1 20 4996 1 1 8 LYS CE C -7.054 -10.206 -6.434 1.00 . A A . 8 LYS CE 1 1 20 4997 1 1 8 LYS CG C -4.712 -9.345 -6.128 1.00 . A A . 8 LYS CG 1 1 20 4998 1 1 8 LYS H H -5.462 -8.873 -2.668 1.00 . A A . 8 LYS H 1 1 20 4999 1 1 8 LYS HA H -4.226 -10.975 -4.229 1.00 . A A . 8 LYS HA 1 1 20 5000 1 1 8 LYS HB2 H -4.559 -8.060 -4.446 1.00 . A A . 8 LYS HB2 1 1 20 5001 1 1 8 LYS HB3 H -3.019 -8.662 -5.045 1.00 . A A . 8 LYS HB3 1 1 20 5002 1 1 8 LYS HD2 H -6.462 -8.600 -5.165 1.00 . A A . 8 LYS HD2 1 1 20 5003 1 1 8 LYS HD3 H -6.367 -8.238 -6.890 1.00 . A A . 8 LYS HD3 1 1 20 5004 1 1 8 LYS HE2 H -6.673 -10.692 -7.319 1.00 . A A . 8 LYS HE2 1 1 20 5005 1 1 8 LYS HE3 H -6.997 -10.886 -5.597 1.00 . A A . 8 LYS HE3 1 1 20 5006 1 1 8 LYS HG2 H -4.228 -8.839 -6.950 1.00 . A A . 8 LYS HG2 1 1 20 5007 1 1 8 LYS HG3 H -4.607 -10.414 -6.249 1.00 . A A . 8 LYS HG3 1 1 20 5008 1 1 8 LYS HZ1 H -9.065 -10.174 -5.873 1.00 . A A . 8 LYS HZ1 1 1 20 5009 1 1 8 LYS HZ2 H -8.822 -10.256 -7.545 1.00 . A A . 8 LYS HZ2 1 1 20 5010 1 1 8 LYS HZ3 H -8.570 -8.799 -6.724 1.00 . A A . 8 LYS HZ3 1 1 20 5011 1 1 8 LYS N N -5.139 -9.788 -2.809 1.00 . A A . 8 LYS N 1 1 20 5012 1 1 8 LYS NZ N -8.477 -9.832 -6.660 1.00 . A A . 8 LYS NZ 1 1 20 5013 1 1 8 LYS O O -2.184 -9.023 -2.628 1.00 . A A . 8 LYS O 1 1 20 5014 1 1 9 CYS C C 0.188 -11.943 -3.218 1.00 . A A . 9 CYS C 1 1 20 5015 1 1 9 CYS CA C -0.863 -11.429 -2.240 1.00 . A A . 9 CYS CA 1 1 20 5016 1 1 9 CYS CB C -0.998 -12.396 -1.063 1.00 . A A . 9 CYS CB 1 1 20 5017 1 1 9 CYS H H -2.616 -12.044 -3.255 1.00 . A A . 9 CYS H 1 1 20 5018 1 1 9 CYS HA H -0.551 -10.465 -1.869 1.00 . A A . 9 CYS HA 1 1 20 5019 1 1 9 CYS HB2 H -0.015 -12.626 -0.680 1.00 . A A . 9 CYS HB2 1 1 20 5020 1 1 9 CYS HB3 H -1.579 -11.924 -0.284 1.00 . A A . 9 CYS HB3 1 1 20 5021 1 1 9 CYS HG H -0.882 -14.912 -1.461 1.00 . A A . 9 CYS HG 1 1 20 5022 1 1 9 CYS N N -2.151 -11.257 -2.903 1.00 . A A . 9 CYS N 1 1 20 5023 1 1 9 CYS O O 0.665 -13.074 -3.117 1.00 . A A . 9 CYS O 1 1 20 5024 1 1 9 CYS SG S -1.803 -13.960 -1.481 1.00 . A A . 9 CYS SG 1 1 20 5025 1 1 10 PRO C C 2.962 -11.546 -4.626 1.00 . A A . 10 PRO C 1 1 20 5026 1 1 10 PRO CA C 1.555 -11.443 -5.206 1.00 . A A . 10 PRO CA 1 1 20 5027 1 1 10 PRO CB C 1.469 -10.281 -6.199 1.00 . A A . 10 PRO CB 1 1 20 5028 1 1 10 PRO CD C 0.030 -9.733 -4.371 1.00 . A A . 10 PRO CD 1 1 20 5029 1 1 10 PRO CG C 0.951 -9.136 -5.398 1.00 . A A . 10 PRO CG 1 1 20 5030 1 1 10 PRO HA H 1.305 -12.366 -5.708 1.00 . A A . 10 PRO HA 1 1 20 5031 1 1 10 PRO HB2 H 2.452 -10.072 -6.598 1.00 . A A . 10 PRO HB2 1 1 20 5032 1 1 10 PRO HB3 H 0.795 -10.537 -7.002 1.00 . A A . 10 PRO HB3 1 1 20 5033 1 1 10 PRO HD2 H 0.081 -9.174 -3.448 1.00 . A A . 10 PRO HD2 1 1 20 5034 1 1 10 PRO HD3 H -0.984 -9.759 -4.743 1.00 . A A . 10 PRO HD3 1 1 20 5035 1 1 10 PRO HG2 H 1.770 -8.625 -4.915 1.00 . A A . 10 PRO HG2 1 1 20 5036 1 1 10 PRO HG3 H 0.408 -8.457 -6.038 1.00 . A A . 10 PRO HG3 1 1 20 5037 1 1 10 PRO N N 0.557 -11.096 -4.190 1.00 . A A . 10 PRO N 1 1 20 5038 1 1 10 PRO O O 3.743 -12.413 -5.018 1.00 . A A . 10 PRO O 1 1 20 5039 1 1 11 LEU C C 4.469 -10.844 -1.550 1.00 . A A . 11 LEU C 1 1 20 5040 1 1 11 LEU CA C 4.591 -10.647 -3.057 1.00 . A A . 11 LEU CA 1 1 20 5041 1 1 11 LEU CB C 5.313 -9.331 -3.354 1.00 . A A . 11 LEU CB 1 1 20 5042 1 1 11 LEU CD1 C 5.203 -6.959 -4.156 1.00 . A A . 11 LEU CD1 1 1 20 5043 1 1 11 LEU CD2 C 4.512 -8.823 -5.674 1.00 . A A . 11 LEU CD2 1 1 20 5044 1 1 11 LEU CG C 4.559 -8.335 -4.234 1.00 . A A . 11 LEU CG 1 1 20 5045 1 1 11 LEU H H 2.613 -9.989 -3.422 1.00 . A A . 11 LEU H 1 1 20 5046 1 1 11 LEU HA H 5.164 -11.464 -3.470 1.00 . A A . 11 LEU HA 1 1 20 5047 1 1 11 LEU HB2 H 5.521 -8.849 -2.411 1.00 . A A . 11 LEU HB2 1 1 20 5048 1 1 11 LEU HB3 H 6.245 -9.571 -3.847 1.00 . A A . 11 LEU HB3 1 1 20 5049 1 1 11 LEU HD11 H 5.238 -6.522 -5.142 1.00 . A A . 11 LEU HD11 1 1 20 5050 1 1 11 LEU HD12 H 6.207 -7.053 -3.769 1.00 . A A . 11 LEU HD12 1 1 20 5051 1 1 11 LEU HD13 H 4.623 -6.326 -3.501 1.00 . A A . 11 LEU HD13 1 1 20 5052 1 1 11 LEU HD21 H 5.353 -8.419 -6.218 1.00 . A A . 11 LEU HD21 1 1 20 5053 1 1 11 LEU HD22 H 3.592 -8.495 -6.136 1.00 . A A . 11 LEU HD22 1 1 20 5054 1 1 11 LEU HD23 H 4.558 -9.902 -5.690 1.00 . A A . 11 LEU HD23 1 1 20 5055 1 1 11 LEU HG H 3.542 -8.247 -3.876 1.00 . A A . 11 LEU HG 1 1 20 5056 1 1 11 LEU N N 3.278 -10.656 -3.692 1.00 . A A . 11 LEU N 1 1 20 5057 1 1 11 LEU O O 4.646 -11.952 -1.042 1.00 . A A . 11 LEU O 1 1 20 5058 1 1 12 PHE C C 2.618 -9.376 1.032 1.00 . A A . 12 PHE C 1 1 20 5059 1 1 12 PHE CA C 4.016 -9.818 0.610 1.00 . A A . 12 PHE CA 1 1 20 5060 1 1 12 PHE CB C 5.067 -8.935 1.285 1.00 . A A . 12 PHE CB 1 1 20 5061 1 1 12 PHE CD1 C 6.604 -8.199 -0.557 1.00 . A A . 12 PHE CD1 1 1 20 5062 1 1 12 PHE CD2 C 5.197 -6.567 0.465 1.00 . A A . 12 PHE CD2 1 1 20 5063 1 1 12 PHE CE1 C 7.127 -7.230 -1.393 1.00 . A A . 12 PHE CE1 1 1 20 5064 1 1 12 PHE CE2 C 5.717 -5.594 -0.368 1.00 . A A . 12 PHE CE2 1 1 20 5065 1 1 12 PHE CG C 5.634 -7.880 0.379 1.00 . A A . 12 PHE CG 1 1 20 5066 1 1 12 PHE CZ C 6.684 -5.926 -1.297 1.00 . A A . 12 PHE CZ 1 1 20 5067 1 1 12 PHE H H 4.034 -8.909 -1.301 1.00 . A A . 12 PHE H 1 1 20 5068 1 1 12 PHE HA H 4.165 -10.841 0.920 1.00 . A A . 12 PHE HA 1 1 20 5069 1 1 12 PHE HB2 H 4.620 -8.439 2.133 1.00 . A A . 12 PHE HB2 1 1 20 5070 1 1 12 PHE HB3 H 5.883 -9.556 1.625 1.00 . A A . 12 PHE HB3 1 1 20 5071 1 1 12 PHE HD1 H 6.952 -9.220 -0.633 1.00 . A A . 12 PHE HD1 1 1 20 5072 1 1 12 PHE HD2 H 4.442 -6.306 1.191 1.00 . A A . 12 PHE HD2 1 1 20 5073 1 1 12 PHE HE1 H 7.883 -7.493 -2.118 1.00 . A A . 12 PHE HE1 1 1 20 5074 1 1 12 PHE HE2 H 5.368 -4.575 -0.291 1.00 . A A . 12 PHE HE2 1 1 20 5075 1 1 12 PHE HZ H 7.090 -5.167 -1.949 1.00 . A A . 12 PHE HZ 1 1 20 5076 1 1 12 PHE N N 4.163 -9.764 -0.839 1.00 . A A . 12 PHE N 1 1 20 5077 1 1 12 PHE O O 2.420 -8.245 1.475 1.00 . A A . 12 PHE O 1 1 20 5078 1 1 13 GLY C C -0.007 -10.255 2.717 1.00 . A A . 13 GLY C 1 1 20 5079 1 1 13 GLY CA C 0.282 -9.960 1.258 1.00 . A A . 13 GLY CA 1 1 20 5080 1 1 13 GLY H H 1.866 -11.162 0.530 1.00 . A A . 13 GLY H 1 1 20 5081 1 1 13 GLY HA2 H 0.103 -8.912 1.071 1.00 . A A . 13 GLY HA2 1 1 20 5082 1 1 13 GLY HA3 H -0.388 -10.545 0.645 1.00 . A A . 13 GLY HA3 1 1 20 5083 1 1 13 GLY N N 1.650 -10.276 0.889 1.00 . A A . 13 GLY N 1 1 20 5084 1 1 13 GLY O O -1.127 -10.055 3.188 1.00 . A A . 13 GLY O 1 1 20 5085 1 1 14 LYS C C 0.578 -9.799 5.668 1.00 . A A . 14 LYS C 1 1 20 5086 1 1 14 LYS CA C 0.854 -11.056 4.848 1.00 . A A . 14 LYS CA 1 1 20 5087 1 1 14 LYS CB C 2.113 -11.751 5.370 1.00 . A A . 14 LYS CB 1 1 20 5088 1 1 14 LYS CD C 4.621 -11.748 5.516 1.00 . A A . 14 LYS CD 1 1 20 5089 1 1 14 LYS CE C 4.916 -12.784 4.442 1.00 . A A . 14 LYS CE 1 1 20 5090 1 1 14 LYS CG C 3.381 -10.936 5.181 1.00 . A A . 14 LYS CG 1 1 20 5091 1 1 14 LYS H H 1.873 -10.870 3.002 1.00 . A A . 14 LYS H 1 1 20 5092 1 1 14 LYS HA H 0.014 -11.727 4.948 1.00 . A A . 14 LYS HA 1 1 20 5093 1 1 14 LYS HB2 H 1.990 -11.948 6.425 1.00 . A A . 14 LYS HB2 1 1 20 5094 1 1 14 LYS HB3 H 2.233 -12.690 4.849 1.00 . A A . 14 LYS HB3 1 1 20 5095 1 1 14 LYS HD2 H 5.466 -11.081 5.599 1.00 . A A . 14 LYS HD2 1 1 20 5096 1 1 14 LYS HD3 H 4.465 -12.254 6.458 1.00 . A A . 14 LYS HD3 1 1 20 5097 1 1 14 LYS HE2 H 4.933 -13.762 4.897 1.00 . A A . 14 LYS HE2 1 1 20 5098 1 1 14 LYS HE3 H 4.133 -12.746 3.699 1.00 . A A . 14 LYS HE3 1 1 20 5099 1 1 14 LYS HG2 H 3.442 -10.615 4.151 1.00 . A A . 14 LYS HG2 1 1 20 5100 1 1 14 LYS HG3 H 3.342 -10.072 5.828 1.00 . A A . 14 LYS HG3 1 1 20 5101 1 1 14 LYS HZ1 H 6.896 -12.118 4.455 1.00 . A A . 14 LYS HZ1 1 1 20 5102 1 1 14 LYS HZ2 H 6.104 -11.881 2.980 1.00 . A A . 14 LYS HZ2 1 1 20 5103 1 1 14 LYS HZ3 H 6.621 -13.430 3.422 1.00 . A A . 14 LYS HZ3 1 1 20 5104 1 1 14 LYS N N 1.004 -10.732 3.434 1.00 . A A . 14 LYS N 1 1 20 5105 1 1 14 LYS NZ N 6.226 -12.536 3.778 1.00 . A A . 14 LYS NZ 1 1 20 5106 1 1 14 LYS O O -0.251 -9.808 6.576 1.00 . A A . 14 LYS O 1 1 20 5107 1 1 15 GLY C C 0.642 -6.342 5.145 1.00 . A A . 15 GLY C 1 1 20 5108 1 1 15 GLY CA C 1.094 -7.468 6.053 1.00 . A A . 15 GLY CA 1 1 20 5109 1 1 15 GLY H H 1.927 -8.769 4.605 1.00 . A A . 15 GLY H 1 1 20 5110 1 1 15 GLY HA2 H 0.353 -7.614 6.825 1.00 . A A . 15 GLY HA2 1 1 20 5111 1 1 15 GLY HA3 H 2.030 -7.189 6.515 1.00 . A A . 15 GLY HA3 1 1 20 5112 1 1 15 GLY N N 1.279 -8.718 5.339 1.00 . A A . 15 GLY N 1 1 20 5113 1 1 15 GLY O O 0.006 -5.390 5.595 1.00 . A A . 15 GLY O 1 1 20 5114 1 1 16 GLY C C 0.995 -4.036 3.356 1.00 . A A . 16 GLY C 1 1 20 5115 1 1 16 GLY CA C 0.588 -5.426 2.908 1.00 . A A . 16 GLY CA 1 1 20 5116 1 1 16 GLY H H 1.479 -7.233 3.559 1.00 . A A . 16 GLY H 1 1 20 5117 1 1 16 GLY HA2 H 1.058 -5.638 1.959 1.00 . A A . 16 GLY HA2 1 1 20 5118 1 1 16 GLY HA3 H -0.484 -5.451 2.781 1.00 . A A . 16 GLY HA3 1 1 20 5119 1 1 16 GLY N N 0.971 -6.451 3.861 1.00 . A A . 16 GLY N 1 1 20 5120 1 1 16 GLY O O 2.149 -3.638 3.198 1.00 . A A . 16 GLY O 1 1 stop_ save_
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