NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
393875 | 1qxq | 5938 | cing | 4-filtered-FRED | STAR | entry | full | 106 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1qxq # This FRED archive file contains, for PDB entry <1qxq>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1qxq _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1qxq _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 1885.35 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 $INDOLICIDIN_DERIVATIVE A . 1 1 stop_ save_ save_INDOLICIDIN_DERIVATIVE _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "INDOLICIDIN DERIVATIVE" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code ILKKWPWWPWRRKX _Entity.Number_of_monomers 14 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 ILE . 1 1 2 LEU . 1 1 3 LYS . 1 1 4 LYS . 1 1 5 TRP . 1 1 6 PRO . 1 1 7 TRP . 1 1 8 TRP . 1 1 9 PRO . 1 1 10 TRP . 1 1 11 ARG . 1 1 12 ARG . 1 1 13 LYS . 1 1 14 NH2 $NH2 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID ILE 1 1 1 1 LEU 2 2 1 1 LYS 3 3 1 1 LYS 4 4 1 1 TRP 5 5 1 1 PRO 6 6 1 1 TRP 7 7 1 1 TRP 8 8 1 1 PRO 9 9 1 1 TRP 10 10 1 1 ARG 11 11 1 1 ARG 12 12 1 1 LYS 13 13 1 1 NH2 14 14 1 1 stop_ save_ save_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NH2 _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 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 ILE HA . 1 . HA 1 1 1 1 2 1 1 2 LEU H . 2 . HN 1 1 2 1 1 1 1 1 ILE HB . 1 . HB 1 1 2 1 2 1 1 2 LEU H . 2 . HN 1 1 3 1 1 1 1 1 ILE QG . 1 . HG* 1 1 3 1 1 1 1 1 ILE MG . 1 . HG* 1 1 3 1 2 1 1 2 LEU H . 2 . HN 1 1 4 1 1 1 1 2 LEU H . 2 . HN 1 1 4 1 2 1 1 2 LEU HA . 2 . HA 1 1 5 1 1 1 1 2 LEU H . 2 . HN 1 1 5 1 2 1 1 3 LYS H . 3 . HN 1 1 6 1 1 1 1 2 LEU HA . 2 . HA 1 1 6 1 2 1 1 3 LYS H . 3 . HN 1 1 7 1 1 1 1 2 LEU MD1 . 2 . HD1* 1 1 7 1 2 1 1 3 LYS H . 3 . HN 1 1 8 1 1 1 1 3 LYS H . 3 . HN 1 1 8 1 2 1 1 3 LYS HA . 3 . HA 1 1 9 1 1 1 1 3 LYS H . 3 . HN 1 1 9 1 2 1 1 3 LYS HG2 . 3 . HG2 1 1 10 1 1 1 1 3 LYS H . 3 . HN 1 1 10 1 2 1 1 3 LYS HG3 . 3 . HG1 1 1 11 1 1 1 1 3 LYS H . 3 . HN 1 1 11 1 2 1 1 4 LYS H . 4 . HN 1 1 12 1 1 1 1 3 LYS HA . 3 . HA 1 1 12 1 2 1 1 4 LYS H . 4 . HN 1 1 13 1 1 1 1 4 LYS H . 4 . HN 1 1 13 1 2 1 1 4 LYS HA . 4 . HA 1 1 14 1 1 1 1 4 LYS H . 4 . HN 1 1 14 1 2 1 1 4 LYS HB2 . 4 . HB2 1 1 15 1 1 1 1 4 LYS H . 4 . HN 1 1 15 1 2 1 1 4 LYS HB3 . 4 . HB1 1 1 16 1 1 1 1 4 LYS H . 4 . HN 1 1 16 1 2 1 1 4 LYS QG . 4 . HG* 1 1 17 1 1 1 1 4 LYS H . 4 . HN 1 1 17 1 2 1 1 5 TRP H . 5 . HN 1 1 18 1 1 1 1 4 LYS HA . 4 . HA 1 1 18 1 2 1 1 5 TRP H . 5 . HN 1 1 19 1 1 1 1 4 LYS HA . 4 . HA 1 1 19 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 20 1 1 1 1 4 LYS HB2 . 4 . HB2 1 1 20 1 2 1 1 5 TRP H . 5 . HN 1 1 21 1 1 1 1 4 LYS HB3 . 4 . HB1 1 1 21 1 2 1 1 5 TRP H . 5 . HN 1 1 22 1 1 1 1 4 LYS QG . 4 . HG* 1 1 22 1 2 1 1 5 TRP H . 5 . HN 1 1 23 1 1 1 1 5 TRP H . 5 . HN 1 1 23 1 2 1 1 5 TRP HA . 5 . HA 1 1 24 1 1 1 1 5 TRP H . 5 . HN 1 1 24 1 2 1 1 5 TRP QB . 5 . HB* 1 1 25 1 1 1 1 5 TRP H . 5 . HN 1 1 25 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 26 1 1 1 1 5 TRP H . 5 . HN 1 1 26 1 2 1 1 5 TRP HE3 . 5 . HE3 1 1 27 1 1 1 1 5 TRP H . 5 . HN 1 1 27 1 2 1 1 6 PRO HD2 . 6 . HD2 1 1 28 1 1 1 1 5 TRP H . 5 . HN 1 1 28 1 2 1 1 6 PRO HD3 . 6 . HD1 1 1 29 1 1 1 1 5 TRP HA . 5 . HA 1 1 29 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 30 1 1 1 1 5 TRP HA . 5 . HA 1 1 30 1 2 1 1 5 TRP HE3 . 5 . HE3 1 1 31 1 1 1 1 5 TRP HA . 5 . HA 1 1 31 1 2 1 1 6 PRO HD2 . 6 . HD2 1 1 32 1 1 1 1 5 TRP HA . 5 . HA 1 1 32 1 2 1 1 6 PRO HD3 . 6 . HD1 1 1 33 1 1 1 1 5 TRP QB . 5 . HB* 1 1 33 1 2 1 1 5 TRP HD1 . 5 . HD1 1 1 34 1 1 1 1 5 TRP QB . 5 . HB* 1 1 34 1 2 1 1 5 TRP HE3 . 5 . HE3 1 1 35 1 1 1 1 5 TRP QB . 5 . HB* 1 1 35 1 2 1 1 7 TRP H . 7 . HN 1 1 36 1 1 1 1 5 TRP HD1 . 5 . HD1 1 1 36 1 2 1 1 6 PRO HD3 . 6 . HD1 1 1 37 1 1 1 1 5 TRP HE3 . 5 . HE3 1 1 37 1 2 1 1 6 PRO HD2 . 6 . HD2 1 1 38 1 1 1 1 5 TRP HE3 . 5 . HE3 1 1 38 1 2 1 1 6 PRO HD3 . 6 . HD1 1 1 39 1 1 1 1 6 PRO HA . 6 . HA 1 1 39 1 2 1 1 7 TRP H . 7 . HN 1 1 40 1 1 1 1 6 PRO HB2 . 6 . HB2 1 1 40 1 2 1 1 7 TRP H . 7 . HN 1 1 41 1 1 1 1 6 PRO HB3 . 6 . HB1 1 1 41 1 2 1 1 7 TRP H . 7 . HN 1 1 42 1 1 1 1 6 PRO HD2 . 6 . HD2 1 1 42 1 2 1 1 7 TRP H . 7 . HN 1 1 43 1 1 1 1 6 PRO HG2 . 6 . HG2 1 1 43 1 2 1 1 7 TRP H . 7 . HN 1 1 44 1 1 1 1 6 PRO HG2 . 6 . HG2 1 1 44 1 2 1 1 7 TRP HD1 . 7 . HD1 1 1 45 1 1 1 1 7 TRP H . 7 . HN 1 1 45 1 2 1 1 7 TRP HA . 7 . HA 1 1 46 1 1 1 1 7 TRP H . 7 . HN 1 1 46 1 2 1 1 7 TRP QB . 7 . HB* 1 1 47 1 1 1 1 7 TRP H . 7 . HN 1 1 47 1 2 1 1 7 TRP HD1 . 7 . HD1 1 1 48 1 1 1 1 7 TRP H . 7 . HN 1 1 48 1 2 1 1 8 TRP H . 8 . HN 1 1 49 1 1 1 1 7 TRP HA . 7 . HA 1 1 49 1 2 1 1 7 TRP HD1 . 7 . HD1 1 1 50 1 1 1 1 7 TRP HA . 7 . HA 1 1 50 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 51 1 1 1 1 7 TRP HA . 7 . HA 1 1 51 1 2 1 1 8 TRP H . 8 . HN 1 1 52 1 1 1 1 7 TRP QB . 7 . HB* 1 1 52 1 2 1 1 7 TRP HD1 . 7 . HD1 1 1 53 1 1 1 1 7 TRP QB . 7 . HB* 1 1 53 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 54 1 1 1 1 7 TRP QB . 7 . HB* 1 1 54 1 2 1 1 8 TRP H . 8 . HN 1 1 55 1 1 1 1 7 TRP HE3 . 7 . HE3 1 1 55 1 2 1 1 9 PRO HD2 . 9 . HD2 1 1 56 1 1 1 1 7 TRP HE3 . 7 . HE3 1 1 56 1 2 1 1 9 PRO HD3 . 9 . HD1 1 1 57 1 1 1 1 8 TRP H . 8 . HN 1 1 57 1 2 1 1 8 TRP HA . 8 . HA 1 1 58 1 1 1 1 8 TRP H . 8 . HN 1 1 58 1 2 1 1 8 TRP QB . 8 . HB* 1 1 59 1 1 1 1 8 TRP H . 8 . HN 1 1 59 1 2 1 1 9 PRO HD3 . 9 . HD1 1 1 60 1 1 1 1 8 TRP HA . 8 . HA 1 1 60 1 2 1 1 8 TRP HD1 . 8 . HD1 1 1 61 1 1 1 1 8 TRP HA . 8 . HA 1 1 61 1 2 1 1 8 TRP HE3 . 8 . HE3 1 1 62 1 1 1 1 8 TRP HA . 8 . HA 1 1 62 1 2 1 1 9 PRO HD2 . 9 . HD2 1 1 63 1 1 1 1 8 TRP HA . 8 . HA 1 1 63 1 2 1 1 9 PRO HD3 . 9 . HD1 1 1 64 1 1 1 1 8 TRP QB . 8 . HB* 1 1 64 1 2 1 1 8 TRP HD1 . 8 . HD1 1 1 65 1 1 1 1 8 TRP QB . 8 . HB* 1 1 65 1 2 1 1 8 TRP HE3 . 8 . HE3 1 1 66 1 1 1 1 8 TRP HD1 . 8 . HD1 1 1 66 1 2 1 1 9 PRO HD2 . 9 . HD2 1 1 67 1 1 1 1 8 TRP HD1 . 8 . HD1 1 1 67 1 2 1 1 9 PRO HD3 . 9 . HD1 1 1 68 1 1 1 1 8 TRP HD1 . 8 . HD1 1 1 68 1 2 1 1 10 TRP H . 10 . HN 1 1 69 1 1 1 1 8 TRP HD1 . 8 . HD1 1 1 69 1 2 1 1 11 ARG HA . 11 . HA 1 1 70 1 1 1 1 8 TRP HD1 . 8 . HD1 1 1 70 1 2 1 1 11 ARG HB2 . 11 . HB2 1 1 71 1 1 1 1 8 TRP HD1 . 8 . HD1 1 1 71 1 2 1 1 11 ARG HB3 . 11 . HB1 1 1 72 1 1 1 1 8 TRP HD1 . 8 . HD1 1 1 72 1 2 1 1 11 ARG QG . 11 . HG* 1 1 73 1 1 1 1 8 TRP HE3 . 8 . HE3 1 1 73 1 2 1 1 9 PRO HD2 . 9 . HD2 1 1 74 1 1 1 1 8 TRP HE3 . 8 . HE3 1 1 74 1 2 1 1 9 PRO HD3 . 9 . HD1 1 1 75 1 1 1 1 9 PRO HA . 9 . HA 1 1 75 1 2 1 1 10 TRP H . 10 . HN 1 1 76 1 1 1 1 9 PRO HB2 . 9 . HB2 1 1 76 1 2 1 1 10 TRP H . 10 . HN 1 1 77 1 1 1 1 9 PRO HB3 . 9 . HB1 1 1 77 1 2 1 1 10 TRP H . 10 . HN 1 1 78 1 1 1 1 9 PRO HD2 . 9 . HD2 1 1 78 1 2 1 1 10 TRP H . 10 . HN 1 1 79 1 1 1 1 9 PRO HD2 . 9 . HD2 1 1 79 1 2 1 1 10 TRP HE3 . 10 . HE3 1 1 80 1 1 1 1 9 PRO HD2 . 9 . HD2 1 1 80 1 2 1 1 10 TRP HZ3 . 10 . HZ3 1 1 81 1 1 1 1 9 PRO HG2 . 9 . HG2 1 1 81 1 2 1 1 10 TRP H . 10 . HN 1 1 82 1 1 1 1 9 PRO HG2 . 9 . HG2 1 1 82 1 2 1 1 10 TRP HE3 . 10 . HE3 1 1 83 1 1 1 1 10 TRP H . 10 . HN 1 1 83 1 2 1 1 10 TRP HA . 10 . HA 1 1 84 1 1 1 1 10 TRP H . 10 . HN 1 1 84 1 2 1 1 10 TRP HB2 . 10 . HB2 1 1 85 1 1 1 1 10 TRP H . 10 . HN 1 1 85 1 2 1 1 10 TRP HB3 . 10 . HB1 1 1 86 1 1 1 1 10 TRP H . 10 . HN 1 1 86 1 2 1 1 10 TRP HE3 . 10 . HE3 1 1 87 1 1 1 1 10 TRP H . 10 . HN 1 1 87 1 2 1 1 11 ARG H . 11 . HN 1 1 88 1 1 1 1 10 TRP HA . 10 . HA 1 1 88 1 2 1 1 10 TRP HD1 . 10 . HD1 1 1 89 1 1 1 1 10 TRP HA . 10 . HA 1 1 89 1 2 1 1 10 TRP HE3 . 10 . HE3 1 1 90 1 1 1 1 10 TRP HA . 10 . HA 1 1 90 1 2 1 1 11 ARG H . 11 . HN 1 1 91 1 1 1 1 10 TRP HB2 . 10 . HB2 1 1 91 1 2 1 1 10 TRP HD1 . 10 . HD1 1 1 92 1 1 1 1 10 TRP HB2 . 10 . HB2 1 1 92 1 2 1 1 10 TRP HE3 . 10 . HE3 1 1 93 1 1 1 1 10 TRP HB2 . 10 . HB2 1 1 93 1 2 1 1 11 ARG H . 11 . HN 1 1 94 1 1 1 1 10 TRP HB3 . 10 . HB1 1 1 94 1 2 1 1 10 TRP HD1 . 10 . HD1 1 1 95 1 1 1 1 10 TRP HB3 . 10 . HB1 1 1 95 1 2 1 1 10 TRP HE3 . 10 . HE3 1 1 96 1 1 1 1 10 TRP HB3 . 10 . HB1 1 1 96 1 2 1 1 11 ARG H . 11 . HN 1 1 97 1 1 1 1 10 TRP HD1 . 10 . HD1 1 1 97 1 2 1 1 11 ARG H . 11 . HN 1 1 98 1 1 1 1 10 TRP HD1 . 10 . HD1 1 1 98 1 2 1 1 11 ARG HA . 11 . HA 1 1 99 1 1 1 1 10 TRP HD1 . 10 . HD1 1 1 99 1 2 1 1 11 ARG QG . 11 . HG* 1 1 100 1 1 1 1 11 ARG H . 11 . HN 1 1 100 1 2 1 1 11 ARG HA . 11 . HA 1 1 101 1 1 1 1 11 ARG H . 11 . HN 1 1 101 1 2 1 1 11 ARG HB2 . 11 . HB2 1 1 102 1 1 1 1 11 ARG H . 11 . HN 1 1 102 1 2 1 1 11 ARG HB3 . 11 . HB1 1 1 103 1 1 1 1 11 ARG H . 11 . HN 1 1 103 1 2 1 1 11 ARG QG . 11 . HG* 1 1 104 1 1 1 1 11 ARG H . 11 . HN 1 1 104 1 2 1 1 12 ARG H . 12 . HN 1 1 105 1 1 1 1 11 ARG HA . 11 . HA 1 1 105 1 2 1 1 12 ARG H . 12 . HN 1 1 106 1 1 1 1 12 ARG HA . 12 . HA 1 1 106 1 2 1 1 13 LYS H . 13 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.5 2.0 2.9 1 1 2 1 . . . . . 3.2 2.6 3.8 1 1 3 1 . . . . . 4.2 2.7 5.7 1 1 4 1 . . . . . 2.8 2.3 3.3 1 1 5 1 . . . . . 3.0 2.4 3.5 1 1 6 1 . . . . . 1.8 1.4 2.2 1 1 7 1 . . . . . 5.0 2.5 7.5 1 1 8 1 . . . . . 2.4 1.8 2.9 1 1 9 1 . . . . . 2.7 2.2 3.2 1 1 10 1 . . . . . 2.7 2.2 3.2 1 1 11 1 . . . . . 2.4 1.9 2.9 1 1 12 1 . . . . . 2.1 1.7 2.6 1 1 13 1 . . . . . 2.5 1.9 3.0 1 1 14 1 . . . . . 2.6 1.8 3.4 1 1 15 1 . . . . . 2.6 1.8 3.4 1 1 16 1 . . . . . 3.2 2.2 4.2 1 1 17 1 . . . . . 2.7 2.1 3.2 1 1 18 1 . . . . . 1.9 1.4 2.4 1 1 19 1 . . . . . 3.6 2.5 4.7 1 1 20 1 . . . . . 3.2 2.0 4.4 1 1 21 1 . . . . . 3.2 2.0 4.4 1 1 22 1 . . . . . 4.0 2.6 5.5 1 1 23 1 . . . . . 2.6 2.1 3.1 1 1 24 1 . . . . . 2.5 1.6 3.5 1 1 25 1 . . . . . 3.1 2.1 4.1 1 1 26 1 . . . . . 3.7 2.5 4.9 1 1 27 1 . . . . . 3.3 2.6 4.0 1 1 28 1 . . . . . 3.3 2.6 4.0 1 1 29 1 . . . . . 3.1 2.0 4.2 1 1 30 1 . . . . . 2.7 1.8 3.6 1 1 31 1 . . . . . 2.4 1.8 2.9 1 1 32 1 . . . . . 2.4 1.8 2.9 1 1 33 1 . . . . . 2.8 1.9 3.8 1 1 34 1 . . . . . 2.5 1.6 3.5 1 1 35 1 . . . . . 3.3 2.2 4.4 1 1 36 1 . . . . . 4.6 2.6 6.6 1 1 37 1 . . . . . 3.2 2.1 4.3 1 1 38 1 . . . . . 3.2 2.1 4.3 1 1 39 1 . . . . . 2.3 1.9 2.8 1 1 40 1 . . . . . 3.4 2.3 4.5 1 1 41 1 . . . . . 3.4 2.3 4.5 1 1 42 1 . . . . . 3.6 2.2 5.0 1 1 43 1 . . . . . 3.8 2.4 5.3 1 1 44 1 . . . . . 4.0 2.5 5.5 1 1 45 1 . . . . . 2.5 2.0 3.0 1 1 46 1 . . . . . 2.8 1.9 3.8 1 1 47 1 . . . . . 3.1 2.1 4.1 1 1 48 1 . . . . . 2.5 2.0 3.1 1 1 49 1 . . . . . 3.0 2.1 4.0 1 1 50 1 . . . . . 2.8 1.9 3.8 1 1 51 1 . . . . . 2.1 1.6 2.6 1 1 52 1 . . . . . 2.8 1.9 3.8 1 1 53 1 . . . . . 2.5 1.6 3.5 1 1 54 1 . . . . . 3.0 1.8 4.2 1 1 55 1 . . . . . 4.2 2.8 5.6 1 1 56 1 . . . . . 4.0 2.5 5.5 1 1 57 1 . . . . . 2.5 2.0 2.9 1 1 58 1 . . . . . 2.6 1.7 3.6 1 1 59 1 . . . . . 4.4 2.8 6.0 1 1 60 1 . . . . . 3.6 2.5 4.7 1 1 61 1 . . . . . 2.8 1.9 3.8 1 1 62 1 . . . . . 2.2 1.8 2.7 1 1 63 1 . . . . . 2.2 1.8 2.7 1 1 64 1 . . . . . 2.8 1.9 3.8 1 1 65 1 . . . . . 2.7 1.8 3.6 1 1 66 1 . . . . . 4.2 2.7 5.6 1 1 67 1 . . . . . 4.2 2.7 5.6 1 1 68 1 . . . . . 3.2 2.2 4.2 1 1 69 1 . . . . . 3.6 2.5 4.7 1 1 70 1 . . . . . 4.2 2.7 5.7 1 1 71 1 . . . . . 4.2 2.7 5.7 1 1 72 1 . . . . . 3.4 2.3 4.5 1 1 73 1 . . . . . 3.2 2.2 4.2 1 1 74 1 . . . . . 3.2 2.2 4.2 1 1 75 1 . . . . . 2.4 1.9 2.9 1 1 76 1 . . . . . 3.5 2.4 4.6 1 1 77 1 . . . . . 3.5 2.4 4.6 1 1 78 1 . . . . . 3.8 2.4 5.3 1 1 79 1 . . . . . 3.6 2.2 5.0 1 1 80 1 . . . . . 3.8 2.3 5.3 1 1 81 1 . . . . . 4.5 2.8 6.2 1 1 82 1 . . . . . 4.2 2.6 5.7 1 1 83 1 . . . . . 2.5 2.0 2.9 1 1 84 1 . . . . . 2.5 2.0 3.0 1 1 85 1 . . . . . 2.5 2.0 3.0 1 1 86 1 . . . . . 3.0 2.0 4.0 1 1 87 1 . . . . . 2.6 2.1 3.1 1 1 88 1 . . . . . 3.0 2.1 4.0 1 1 89 1 . . . . . 3.1 2.1 4.1 1 1 90 1 . . . . . 2.6 1.8 3.5 1 1 91 1 . . . . . 3.0 2.0 4.0 1 1 92 1 . . . . . 2.8 1.9 3.8 1 1 93 1 . . . . . 2.9 2.1 3.7 1 1 94 1 . . . . . 3.0 2.0 4.0 1 1 95 1 . . . . . 2.8 1.9 3.8 1 1 96 1 . . . . . 2.9 2.1 3.7 1 1 97 1 . . . . . 3.6 2.5 4.7 1 1 98 1 . . . . . 3.9 2.7 5.1 1 1 99 1 . . . . . 3.5 2.4 4.5 1 1 100 1 . . . . . 2.5 2.0 3.0 1 1 101 1 . . . . . 2.6 1.8 3.4 1 1 102 1 . . . . . 2.6 1.8 3.4 1 1 103 1 . . . . . 3.0 2.0 4.0 1 1 104 1 . . . . . 2.7 2.2 3.2 1 1 105 1 . . . . . 2.1 1.7 2.5 1 1 106 1 . . . . . 2.2 1.8 2.7 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 ILE C C -10.410 4.297 -2.827 1.00 . A A . 1 ILE C 1 1 1 2 1 1 1 ILE CA C -11.677 4.920 -3.420 1.00 . A A . 1 ILE CA 1 1 1 3 1 1 1 ILE CB C -11.371 6.295 -4.014 1.00 . A A . 1 ILE CB 1 1 1 4 1 1 1 ILE CD1 C -10.657 8.626 -3.461 1.00 . A A . 1 ILE CD1 1 1 1 5 1 1 1 ILE CG1 C -11.163 7.305 -2.880 1.00 . A A . 1 ILE CG1 1 1 1 6 1 1 1 ILE CG2 C -12.541 6.747 -4.889 1.00 . A A . 1 ILE CG2 1 1 1 7 1 1 1 ILE H1 H -12.185 5.429 -1.465 1.00 . A A . 1 ILE H1 1 1 1 8 1 1 1 ILE H2 H -13.247 4.318 -2.189 1.00 . A A . 1 ILE H2 1 1 1 9 1 1 1 ILE H3 H -13.301 5.960 -2.627 1.00 . A A . 1 ILE H3 1 1 1 10 1 1 1 ILE HA H -12.095 4.277 -4.178 1.00 . A A . 1 ILE HA 1 1 1 11 1 1 1 ILE HB H -10.475 6.236 -4.614 1.00 . A A . 1 ILE HB 1 1 1 12 1 1 1 ILE HD11 H -9.893 9.033 -2.814 1.00 . A A . 1 ILE HD11 1 1 1 13 1 1 1 ILE HD12 H -11.478 9.326 -3.533 1.00 . A A . 1 ILE HD12 1 1 1 14 1 1 1 ILE HD13 H -10.242 8.454 -4.443 1.00 . A A . 1 ILE HD13 1 1 1 15 1 1 1 ILE HG12 H -12.101 7.470 -2.370 1.00 . A A . 1 ILE HG12 1 1 1 16 1 1 1 ILE HG13 H -10.436 6.918 -2.183 1.00 . A A . 1 ILE HG13 1 1 1 17 1 1 1 ILE HG21 H -13.433 6.828 -4.284 1.00 . A A . 1 ILE HG21 1 1 1 18 1 1 1 ILE HG22 H -12.704 6.024 -5.674 1.00 . A A . 1 ILE HG22 1 1 1 19 1 1 1 ILE HG23 H -12.315 7.709 -5.326 1.00 . A A . 1 ILE HG23 1 1 1 20 1 1 1 ILE N N -12.678 5.176 -2.344 1.00 . A A . 1 ILE N 1 1 1 21 1 1 1 ILE O O -10.098 4.486 -1.669 1.00 . A A . 1 ILE O 1 1 1 22 1 1 2 LEU C C -8.773 1.832 -2.081 1.00 . A A . 2 LEU C 1 1 1 23 1 1 2 LEU CA C -8.431 2.921 -3.098 1.00 . A A . 2 LEU CA 1 1 1 24 1 1 2 LEU CB C -7.648 4.053 -2.431 1.00 . A A . 2 LEU CB 1 1 1 25 1 1 2 LEU CD1 C -5.523 5.250 -2.979 1.00 . A A . 2 LEU CD1 1 1 1 26 1 1 2 LEU CD2 C -5.477 3.228 -1.514 1.00 . A A . 2 LEU CD2 1 1 1 27 1 1 2 LEU CG C -6.155 3.881 -2.719 1.00 . A A . 2 LEU CG 1 1 1 28 1 1 2 LEU H H -9.947 3.417 -4.546 1.00 . A A . 2 LEU H 1 1 1 29 1 1 2 LEU HA H -7.857 2.504 -3.909 1.00 . A A . 2 LEU HA 1 1 1 30 1 1 2 LEU HB2 H -7.984 5.002 -2.824 1.00 . A A . 2 LEU HB2 1 1 1 31 1 1 2 LEU HB3 H -7.811 4.026 -1.365 1.00 . A A . 2 LEU HB3 1 1 1 32 1 1 2 LEU HD11 H -6.259 5.910 -3.416 1.00 . A A . 2 LEU HD11 1 1 1 33 1 1 2 LEU HD12 H -4.691 5.139 -3.657 1.00 . A A . 2 LEU HD12 1 1 1 34 1 1 2 LEU HD13 H -5.174 5.668 -2.046 1.00 . A A . 2 LEU HD13 1 1 1 35 1 1 2 LEU HD21 H -5.667 3.818 -0.630 1.00 . A A . 2 LEU HD21 1 1 1 36 1 1 2 LEU HD22 H -4.412 3.172 -1.687 1.00 . A A . 2 LEU HD22 1 1 1 37 1 1 2 LEU HD23 H -5.872 2.233 -1.375 1.00 . A A . 2 LEU HD23 1 1 1 38 1 1 2 LEU HG H -6.028 3.255 -3.591 1.00 . A A . 2 LEU HG 1 1 1 39 1 1 2 LEU N N -9.677 3.556 -3.614 1.00 . A A . 2 LEU N 1 1 1 40 1 1 2 LEU O O -9.060 2.105 -0.932 1.00 . A A . 2 LEU O 1 1 1 41 1 1 3 LYS C C -8.745 -1.864 -2.216 1.00 . A A . 3 LYS C 1 1 1 42 1 1 3 LYS CA C -9.068 -0.516 -1.564 1.00 . A A . 3 LYS CA 1 1 1 43 1 1 3 LYS CB C -10.570 -0.393 -1.300 1.00 . A A . 3 LYS CB 1 1 1 44 1 1 3 LYS CD C -12.799 -0.452 -2.427 1.00 . A A . 3 LYS CD 1 1 1 45 1 1 3 LYS CE C -13.480 0.805 -1.883 1.00 . A A . 3 LYS CE 1 1 1 46 1 1 3 LYS CG C -11.307 -0.180 -2.624 1.00 . A A . 3 LYS CG 1 1 1 47 1 1 3 LYS H H -8.511 0.407 -3.431 1.00 . A A . 3 LYS H 1 1 1 48 1 1 3 LYS HA H -8.521 -0.403 -0.642 1.00 . A A . 3 LYS HA 1 1 1 49 1 1 3 LYS HB2 H -10.927 -1.296 -0.830 1.00 . A A . 3 LYS HB2 1 1 1 50 1 1 3 LYS HB3 H -10.752 0.449 -0.649 1.00 . A A . 3 LYS HB3 1 1 1 51 1 1 3 LYS HD2 H -13.243 -0.722 -3.376 1.00 . A A . 3 LYS HD2 1 1 1 52 1 1 3 LYS HD3 H -12.928 -1.264 -1.726 1.00 . A A . 3 LYS HD3 1 1 1 53 1 1 3 LYS HE2 H -12.889 1.681 -2.110 1.00 . A A . 3 LYS HE2 1 1 1 54 1 1 3 LYS HE3 H -14.474 0.902 -2.292 1.00 . A A . 3 LYS HE3 1 1 1 55 1 1 3 LYS HG2 H -11.165 0.839 -2.954 1.00 . A A . 3 LYS HG2 1 1 1 56 1 1 3 LYS HG3 H -10.913 -0.857 -3.369 1.00 . A A . 3 LYS HG3 1 1 1 57 1 1 3 LYS HZ1 H -13.501 1.510 0.075 1.00 . A A . 3 LYS HZ1 1 1 1 58 1 1 3 LYS HZ2 H -12.760 -0.008 -0.106 1.00 . A A . 3 LYS HZ2 1 1 1 59 1 1 3 LYS HZ3 H -14.452 0.129 -0.171 1.00 . A A . 3 LYS HZ3 1 1 1 60 1 1 3 LYS N N -8.745 0.599 -2.500 1.00 . A A . 3 LYS N 1 1 1 61 1 1 3 LYS NZ N -13.554 0.594 -0.409 1.00 . A A . 3 LYS NZ 1 1 1 62 1 1 3 LYS O O -9.625 -2.630 -2.552 1.00 . A A . 3 LYS O 1 1 1 63 1 1 4 LYS C C -5.961 -4.090 -2.243 1.00 . A A . 4 LYS C 1 1 1 64 1 1 4 LYS CA C -7.102 -3.452 -3.025 1.00 . A A . 4 LYS CA 1 1 1 65 1 1 4 LYS CB C -6.650 -3.087 -4.434 1.00 . A A . 4 LYS CB 1 1 1 66 1 1 4 LYS CD C -7.091 -3.531 -6.852 1.00 . A A . 4 LYS CD 1 1 1 67 1 1 4 LYS CE C -7.662 -4.689 -7.673 1.00 . A A . 4 LYS CE 1 1 1 68 1 1 4 LYS CG C -7.697 -3.553 -5.447 1.00 . A A . 4 LYS CG 1 1 1 69 1 1 4 LYS H H -6.791 -1.526 -2.118 1.00 . A A . 4 LYS H 1 1 1 70 1 1 4 LYS HA H -7.948 -4.118 -3.064 1.00 . A A . 4 LYS HA 1 1 1 71 1 1 4 LYS HB2 H -6.535 -2.018 -4.497 1.00 . A A . 4 LYS HB2 1 1 1 72 1 1 4 LYS HB3 H -5.707 -3.564 -4.644 1.00 . A A . 4 LYS HB3 1 1 1 73 1 1 4 LYS HD2 H -7.333 -2.594 -7.333 1.00 . A A . 4 LYS HD2 1 1 1 74 1 1 4 LYS HD3 H -6.019 -3.636 -6.784 1.00 . A A . 4 LYS HD3 1 1 1 75 1 1 4 LYS HE2 H -8.312 -5.300 -7.059 1.00 . A A . 4 LYS HE2 1 1 1 76 1 1 4 LYS HE3 H -8.198 -4.315 -8.531 1.00 . A A . 4 LYS HE3 1 1 1 77 1 1 4 LYS HG2 H -8.010 -4.558 -5.205 1.00 . A A . 4 LYS HG2 1 1 1 78 1 1 4 LYS HG3 H -8.550 -2.891 -5.415 1.00 . A A . 4 LYS HG3 1 1 1 79 1 1 4 LYS HZ1 H -6.755 -6.142 -8.856 1.00 . A A . 4 LYS HZ1 1 1 1 80 1 1 4 LYS HZ2 H -6.085 -5.995 -7.301 1.00 . A A . 4 LYS HZ2 1 1 1 81 1 1 4 LYS HZ3 H -5.752 -4.824 -8.486 1.00 . A A . 4 LYS HZ3 1 1 1 82 1 1 4 LYS N N -7.485 -2.157 -2.397 1.00 . A A . 4 LYS N 1 1 1 83 1 1 4 LYS NZ N -6.473 -5.472 -8.113 1.00 . A A . 4 LYS NZ 1 1 1 84 1 1 4 LYS O O -4.846 -4.200 -2.712 1.00 . A A . 4 LYS O 1 1 1 85 1 1 5 TRP C C -3.964 -4.240 -0.122 1.00 . A A . 5 TRP C 1 1 1 86 1 1 5 TRP CA C -5.196 -5.145 -0.205 1.00 . A A . 5 TRP CA 1 1 1 87 1 1 5 TRP CB C -4.852 -6.452 -0.917 1.00 . A A . 5 TRP CB 1 1 1 88 1 1 5 TRP CD1 C -6.660 -8.208 -1.110 1.00 . A A . 5 TRP CD1 1 1 1 89 1 1 5 TRP CD2 C -5.745 -8.128 0.943 1.00 . A A . 5 TRP CD2 1 1 1 90 1 1 5 TRP CE2 C -6.731 -9.141 0.978 1.00 . A A . 5 TRP CE2 1 1 1 91 1 1 5 TRP CE3 C -5.015 -7.871 2.116 1.00 . A A . 5 TRP CE3 1 1 1 92 1 1 5 TRP CG C -5.721 -7.550 -0.393 1.00 . A A . 5 TRP CG 1 1 1 93 1 1 5 TRP CH2 C -6.246 -9.609 3.295 1.00 . A A . 5 TRP CH2 1 1 1 94 1 1 5 TRP CZ2 C -6.981 -9.876 2.137 1.00 . A A . 5 TRP CZ2 1 1 1 95 1 1 5 TRP CZ3 C -5.265 -8.607 3.285 1.00 . A A . 5 TRP CZ3 1 1 1 96 1 1 5 TRP H H -7.154 -4.400 -0.712 1.00 . A A . 5 TRP H 1 1 1 97 1 1 5 TRP HA H -5.580 -5.351 0.781 1.00 . A A . 5 TRP HA 1 1 1 98 1 1 5 TRP HB2 H -5.016 -6.338 -1.978 1.00 . A A . 5 TRP HB2 1 1 1 99 1 1 5 TRP HB3 H -3.816 -6.698 -0.737 1.00 . A A . 5 TRP HB3 1 1 1 100 1 1 5 TRP HD1 H -6.902 -8.026 -2.146 1.00 . A A . 5 TRP HD1 1 1 1 101 1 1 5 TRP HE1 H -7.976 -9.764 -0.573 1.00 . A A . 5 TRP HE1 1 1 1 102 1 1 5 TRP HE3 H -4.257 -7.101 2.117 1.00 . A A . 5 TRP HE3 1 1 1 103 1 1 5 TRP HH2 H -6.436 -10.172 4.198 1.00 . A A . 5 TRP HH2 1 1 1 104 1 1 5 TRP HZ2 H -7.740 -10.647 2.140 1.00 . A A . 5 TRP HZ2 1 1 1 105 1 1 5 TRP HZ3 H -4.698 -8.402 4.182 1.00 . A A . 5 TRP HZ3 1 1 1 106 1 1 5 TRP N N -6.245 -4.508 -1.051 1.00 . A A . 5 TRP N 1 1 1 107 1 1 5 TRP NE1 N -7.261 -9.153 -0.297 1.00 . A A . 5 TRP NE1 1 1 1 108 1 1 5 TRP O O -3.162 -4.200 -1.033 1.00 . A A . 5 TRP O 1 1 1 109 1 1 6 PRO C C -1.438 -3.420 1.471 1.00 . A A . 6 PRO C 1 1 1 110 1 1 6 PRO CA C -2.712 -2.625 1.185 1.00 . A A . 6 PRO CA 1 1 1 111 1 1 6 PRO CB C -3.128 -1.803 2.399 1.00 . A A . 6 PRO CB 1 1 1 112 1 1 6 PRO CD C -4.785 -3.541 2.112 1.00 . A A . 6 PRO CD 1 1 1 113 1 1 6 PRO CG C -4.108 -2.663 3.134 1.00 . A A . 6 PRO CG 1 1 1 114 1 1 6 PRO HA H -2.578 -1.982 0.331 1.00 . A A . 6 PRO HA 1 1 1 115 1 1 6 PRO HB2 H -2.269 -1.592 3.020 1.00 . A A . 6 PRO HB2 1 1 1 116 1 1 6 PRO HB3 H -3.602 -0.889 2.085 1.00 . A A . 6 PRO HB3 1 1 1 117 1 1 6 PRO HD2 H -4.915 -4.542 2.501 1.00 . A A . 6 PRO HD2 1 1 1 118 1 1 6 PRO HD3 H -5.734 -3.119 1.817 1.00 . A A . 6 PRO HD3 1 1 1 119 1 1 6 PRO HG2 H -3.589 -3.272 3.862 1.00 . A A . 6 PRO HG2 1 1 1 120 1 1 6 PRO HG3 H -4.845 -2.046 3.626 1.00 . A A . 6 PRO HG3 1 1 1 121 1 1 6 PRO N N -3.858 -3.542 0.975 1.00 . A A . 6 PRO N 1 1 1 122 1 1 6 PRO O O -1.048 -3.602 2.608 1.00 . A A . 6 PRO O 1 1 1 123 1 1 7 TRP C C 1.631 -3.992 -0.063 1.00 . A A . 7 TRP C 1 1 1 124 1 1 7 TRP CA C 0.466 -4.673 0.651 1.00 . A A . 7 TRP CA 1 1 1 125 1 1 7 TRP CB C 0.188 -6.039 0.036 1.00 . A A . 7 TRP CB 1 1 1 126 1 1 7 TRP CD1 C -0.956 -7.550 1.707 1.00 . A A . 7 TRP CD1 1 1 1 127 1 1 7 TRP CD2 C 1.282 -7.776 1.728 1.00 . A A . 7 TRP CD2 1 1 1 128 1 1 7 TRP CE2 C 0.774 -8.670 2.700 1.00 . A A . 7 TRP CE2 1 1 1 129 1 1 7 TRP CE3 C 2.674 -7.721 1.540 1.00 . A A . 7 TRP CE3 1 1 1 130 1 1 7 TRP CG C 0.162 -7.077 1.112 1.00 . A A . 7 TRP CG 1 1 1 131 1 1 7 TRP CH2 C 3.001 -9.414 3.259 1.00 . A A . 7 TRP CH2 1 1 1 132 1 1 7 TRP CZ2 C 1.619 -9.480 3.459 1.00 . A A . 7 TRP CZ2 1 1 1 133 1 1 7 TRP CZ3 C 3.527 -8.536 2.302 1.00 . A A . 7 TRP CZ3 1 1 1 134 1 1 7 TRP H H -1.121 -3.728 -0.459 1.00 . A A . 7 TRP H 1 1 1 135 1 1 7 TRP HA H 0.679 -4.774 1.703 1.00 . A A . 7 TRP HA 1 1 1 136 1 1 7 TRP HB2 H -0.766 -6.016 -0.467 1.00 . A A . 7 TRP HB2 1 1 1 137 1 1 7 TRP HB3 H 0.965 -6.276 -0.675 1.00 . A A . 7 TRP HB3 1 1 1 138 1 1 7 TRP HD1 H -1.967 -7.241 1.483 1.00 . A A . 7 TRP HD1 1 1 1 139 1 1 7 TRP HE1 H -1.216 -8.991 3.221 1.00 . A A . 7 TRP HE1 1 1 1 140 1 1 7 TRP HE3 H 3.091 -7.048 0.805 1.00 . A A . 7 TRP HE3 1 1 1 141 1 1 7 TRP HH2 H 3.662 -10.037 3.842 1.00 . A A . 7 TRP HH2 1 1 1 142 1 1 7 TRP HZ2 H 1.209 -10.155 4.195 1.00 . A A . 7 TRP HZ2 1 1 1 143 1 1 7 TRP HZ3 H 4.596 -8.485 2.149 1.00 . A A . 7 TRP HZ3 1 1 1 144 1 1 7 TRP N N -0.786 -3.890 0.447 1.00 . A A . 7 TRP N 1 1 1 145 1 1 7 TRP NE1 N -0.594 -8.495 2.650 1.00 . A A . 7 TRP NE1 1 1 1 146 1 1 7 TRP O O 2.313 -4.584 -0.876 1.00 . A A . 7 TRP O 1 1 1 147 1 1 8 TRP C C 4.055 -1.677 0.621 1.00 . A A . 8 TRP C 1 1 1 148 1 1 8 TRP CA C 2.972 -2.010 -0.408 1.00 . A A . 8 TRP CA 1 1 1 149 1 1 8 TRP CB C 2.335 -0.731 -0.952 1.00 . A A . 8 TRP CB 1 1 1 150 1 1 8 TRP CD1 C 3.945 0.908 -2.001 1.00 . A A . 8 TRP CD1 1 1 1 151 1 1 8 TRP CD2 C 3.323 -0.722 -3.421 1.00 . A A . 8 TRP CD2 1 1 1 152 1 1 8 TRP CE2 C 4.214 0.117 -4.131 1.00 . A A . 8 TRP CE2 1 1 1 153 1 1 8 TRP CE3 C 2.782 -1.834 -4.092 1.00 . A A . 8 TRP CE3 1 1 1 154 1 1 8 TRP CG C 3.168 -0.198 -2.071 1.00 . A A . 8 TRP CG 1 1 1 155 1 1 8 TRP CH2 C 4.008 -1.248 -6.111 1.00 . A A . 8 TRP CH2 1 1 1 156 1 1 8 TRP CZ2 C 4.555 -0.138 -5.461 1.00 . A A . 8 TRP CZ2 1 1 1 157 1 1 8 TRP CZ3 C 3.124 -2.093 -5.429 1.00 . A A . 8 TRP CZ3 1 1 1 158 1 1 8 TRP H H 1.291 -2.306 0.896 1.00 . A A . 8 TRP H 1 1 1 159 1 1 8 TRP HA H 3.383 -2.588 -1.217 1.00 . A A . 8 TRP HA 1 1 1 160 1 1 8 TRP HB2 H 1.342 -0.949 -1.314 1.00 . A A . 8 TRP HB2 1 1 1 161 1 1 8 TRP HB3 H 2.277 0.004 -0.164 1.00 . A A . 8 TRP HB3 1 1 1 162 1 1 8 TRP HD1 H 4.061 1.539 -1.134 1.00 . A A . 8 TRP HD1 1 1 1 163 1 1 8 TRP HE1 H 5.180 1.827 -3.437 1.00 . A A . 8 TRP HE1 1 1 1 164 1 1 8 TRP HE3 H 2.100 -2.493 -3.574 1.00 . A A . 8 TRP HE3 1 1 1 165 1 1 8 TRP HH2 H 4.268 -1.452 -7.140 1.00 . A A . 8 TRP HH2 1 1 1 166 1 1 8 TRP HZ2 H 5.238 0.517 -5.980 1.00 . A A . 8 TRP HZ2 1 1 1 167 1 1 8 TRP HZ3 H 2.703 -2.951 -5.934 1.00 . A A . 8 TRP HZ3 1 1 1 168 1 1 8 TRP N N 1.857 -2.751 0.240 1.00 . A A . 8 TRP N 1 1 1 169 1 1 8 TRP NE1 N 4.564 1.096 -3.223 1.00 . A A . 8 TRP NE1 1 1 1 170 1 1 8 TRP O O 3.849 -0.865 1.500 1.00 . A A . 8 TRP O 1 1 1 171 1 1 9 PRO C C 7.170 -0.931 0.938 1.00 . A A . 9 PRO C 1 1 1 172 1 1 9 PRO CA C 6.312 -2.108 1.401 1.00 . A A . 9 PRO CA 1 1 1 173 1 1 9 PRO CB C 7.089 -3.414 1.305 1.00 . A A . 9 PRO CB 1 1 1 174 1 1 9 PRO CD C 5.499 -3.317 -0.548 1.00 . A A . 9 PRO CD 1 1 1 175 1 1 9 PRO CG C 6.753 -3.993 -0.041 1.00 . A A . 9 PRO CG 1 1 1 176 1 1 9 PRO HA H 5.961 -1.956 2.405 1.00 . A A . 9 PRO HA 1 1 1 177 1 1 9 PRO HB2 H 8.150 -3.222 1.379 1.00 . A A . 9 PRO HB2 1 1 1 178 1 1 9 PRO HB3 H 6.776 -4.089 2.084 1.00 . A A . 9 PRO HB3 1 1 1 179 1 1 9 PRO HD2 H 5.689 -2.835 -1.498 1.00 . A A . 9 PRO HD2 1 1 1 180 1 1 9 PRO HD3 H 4.693 -4.029 -0.640 1.00 . A A . 9 PRO HD3 1 1 1 181 1 1 9 PRO HG2 H 7.568 -3.814 -0.727 1.00 . A A . 9 PRO HG2 1 1 1 182 1 1 9 PRO HG3 H 6.580 -5.054 0.052 1.00 . A A . 9 PRO HG3 1 1 1 183 1 1 9 PRO N N 5.180 -2.326 0.477 1.00 . A A . 9 PRO N 1 1 1 184 1 1 9 PRO O O 8.370 -0.907 1.132 1.00 . A A . 9 PRO O 1 1 1 185 1 1 10 TRP C C 6.987 2.454 0.680 1.00 . A A . 10 TRP C 1 1 1 186 1 1 10 TRP CA C 7.330 1.219 -0.154 1.00 . A A . 10 TRP CA 1 1 1 187 1 1 10 TRP CB C 6.878 1.401 -1.599 1.00 . A A . 10 TRP CB 1 1 1 188 1 1 10 TRP CD1 C 8.969 2.483 -2.532 1.00 . A A . 10 TRP CD1 1 1 1 189 1 1 10 TRP CD2 C 8.512 0.493 -3.466 1.00 . A A . 10 TRP CD2 1 1 1 190 1 1 10 TRP CE2 C 9.692 0.964 -4.083 1.00 . A A . 10 TRP CE2 1 1 1 191 1 1 10 TRP CE3 C 7.996 -0.744 -3.866 1.00 . A A . 10 TRP CE3 1 1 1 192 1 1 10 TRP CG C 8.073 1.470 -2.489 1.00 . A A . 10 TRP CG 1 1 1 193 1 1 10 TRP CH2 C 9.815 -1.013 -5.461 1.00 . A A . 10 TRP CH2 1 1 1 194 1 1 10 TRP CZ2 C 10.341 0.223 -5.071 1.00 . A A . 10 TRP CZ2 1 1 1 195 1 1 10 TRP CZ3 C 8.643 -1.496 -4.859 1.00 . A A . 10 TRP CZ3 1 1 1 196 1 1 10 TRP H H 5.603 -0.003 0.181 1.00 . A A . 10 TRP H 1 1 1 197 1 1 10 TRP HA H 8.382 1.018 -0.120 1.00 . A A . 10 TRP HA 1 1 1 198 1 1 10 TRP HB2 H 6.265 0.563 -1.890 1.00 . A A . 10 TRP HB2 1 1 1 199 1 1 10 TRP HB3 H 6.309 2.307 -1.690 1.00 . A A . 10 TRP HB3 1 1 1 200 1 1 10 TRP HD1 H 8.938 3.377 -1.928 1.00 . A A . 10 TRP HD1 1 1 1 201 1 1 10 TRP HE1 H 10.698 2.750 -3.708 1.00 . A A . 10 TRP HE1 1 1 1 202 1 1 10 TRP HE3 H 7.093 -1.116 -3.401 1.00 . A A . 10 TRP HE3 1 1 1 203 1 1 10 TRP HH2 H 10.310 -1.594 -6.226 1.00 . A A . 10 TRP HH2 1 1 1 204 1 1 10 TRP HZ2 H 11.243 0.600 -5.531 1.00 . A A . 10 TRP HZ2 1 1 1 205 1 1 10 TRP HZ3 H 8.236 -2.451 -5.162 1.00 . A A . 10 TRP HZ3 1 1 1 206 1 1 10 TRP N N 6.563 0.041 0.327 1.00 . A A . 10 TRP N 1 1 1 207 1 1 10 TRP NE1 N 9.933 2.183 -3.479 1.00 . A A . 10 TRP NE1 1 1 1 208 1 1 10 TRP O O 7.816 2.989 1.390 1.00 . A A . 10 TRP O 1 1 1 209 1 1 11 ARG C C 4.121 3.778 2.212 1.00 . A A . 11 ARG C 1 1 1 210 1 1 11 ARG CA C 5.358 4.101 1.376 1.00 . A A . 11 ARG CA 1 1 1 211 1 1 11 ARG CB C 5.038 5.181 0.336 1.00 . A A . 11 ARG CB 1 1 1 212 1 1 11 ARG CD C 3.548 5.563 -1.636 1.00 . A A . 11 ARG CD 1 1 1 213 1 1 11 ARG CG C 4.456 4.551 -0.935 1.00 . A A . 11 ARG CG 1 1 1 214 1 1 11 ARG CZ C 1.170 5.217 -1.938 1.00 . A A . 11 ARG CZ 1 1 1 215 1 1 11 ARG H H 5.124 2.464 0.025 1.00 . A A . 11 ARG H 1 1 1 216 1 1 11 ARG HA H 6.161 4.426 2.011 1.00 . A A . 11 ARG HA 1 1 1 217 1 1 11 ARG HB2 H 4.316 5.860 0.751 1.00 . A A . 11 ARG HB2 1 1 1 218 1 1 11 ARG HB3 H 5.940 5.720 0.088 1.00 . A A . 11 ARG HB3 1 1 1 219 1 1 11 ARG HD2 H 3.225 6.324 -0.937 1.00 . A A . 11 ARG HD2 1 1 1 220 1 1 11 ARG HD3 H 4.058 6.012 -2.474 1.00 . A A . 11 ARG HD3 1 1 1 221 1 1 11 ARG HE H 2.527 3.908 -2.561 1.00 . A A . 11 ARG HE 1 1 1 222 1 1 11 ARG HG2 H 5.262 4.269 -1.599 1.00 . A A . 11 ARG HG2 1 1 1 223 1 1 11 ARG HG3 H 3.881 3.675 -0.675 1.00 . A A . 11 ARG HG3 1 1 1 224 1 1 11 ARG HH11 H 1.211 4.990 0.052 1.00 . A A . 11 ARG HH11 1 1 1 225 1 1 11 ARG HH12 H -0.262 5.626 -0.600 1.00 . A A . 11 ARG HH12 1 1 1 226 1 1 11 ARG HH21 H 0.845 5.548 -3.885 1.00 . A A . 11 ARG HH21 1 1 1 227 1 1 11 ARG HH22 H -0.469 5.943 -2.829 1.00 . A A . 11 ARG HH22 1 1 1 228 1 1 11 ARG N N 5.769 2.907 0.599 1.00 . A A . 11 ARG N 1 1 1 229 1 1 11 ARG NE N 2.383 4.768 -2.114 1.00 . A A . 11 ARG NE 1 1 1 230 1 1 11 ARG NH1 N 0.667 5.282 -0.735 1.00 . A A . 11 ARG NH1 1 1 1 231 1 1 11 ARG NH2 N 0.460 5.599 -2.964 1.00 . A A . 11 ARG NH2 1 1 1 232 1 1 11 ARG O O 3.061 4.343 2.022 1.00 . A A . 11 ARG O 1 1 1 233 1 1 12 ARG C C 2.715 3.668 4.908 1.00 . A A . 12 ARG C 1 1 1 234 1 1 12 ARG CA C 3.091 2.500 3.992 1.00 . A A . 12 ARG CA 1 1 1 235 1 1 12 ARG CB C 3.572 1.305 4.814 1.00 . A A . 12 ARG CB 1 1 1 236 1 1 12 ARG CD C 2.722 -0.747 5.961 1.00 . A A . 12 ARG CD 1 1 1 237 1 1 12 ARG CG C 2.513 0.201 4.778 1.00 . A A . 12 ARG CG 1 1 1 238 1 1 12 ARG CZ C 1.071 -2.479 5.592 1.00 . A A . 12 ARG CZ 1 1 1 239 1 1 12 ARG H H 5.120 2.434 3.263 1.00 . A A . 12 ARG H 1 1 1 240 1 1 12 ARG HA H 2.249 2.214 3.382 1.00 . A A . 12 ARG HA 1 1 1 241 1 1 12 ARG HB2 H 4.496 0.932 4.400 1.00 . A A . 12 ARG HB2 1 1 1 242 1 1 12 ARG HB3 H 3.731 1.613 5.837 1.00 . A A . 12 ARG HB3 1 1 1 243 1 1 12 ARG HD2 H 3.764 -0.758 6.253 1.00 . A A . 12 ARG HD2 1 1 1 244 1 1 12 ARG HD3 H 2.100 -0.456 6.792 1.00 . A A . 12 ARG HD3 1 1 1 245 1 1 12 ARG HE H 2.962 -2.671 5.025 1.00 . A A . 12 ARG HE 1 1 1 246 1 1 12 ARG HG2 H 1.529 0.643 4.840 1.00 . A A . 12 ARG HG2 1 1 1 247 1 1 12 ARG HG3 H 2.601 -0.353 3.856 1.00 . A A . 12 ARG HG3 1 1 1 248 1 1 12 ARG HH11 H 0.890 -1.779 7.460 1.00 . A A . 12 ARG HH11 1 1 1 249 1 1 12 ARG HH12 H -0.516 -2.554 6.813 1.00 . A A . 12 ARG HH12 1 1 1 250 1 1 12 ARG HH21 H 0.959 -3.270 3.757 1.00 . A A . 12 ARG HH21 1 1 1 251 1 1 12 ARG HH22 H -0.477 -3.398 4.715 1.00 . A A . 12 ARG HH22 1 1 1 252 1 1 12 ARG N N 4.253 2.872 3.134 1.00 . A A . 12 ARG N 1 1 1 253 1 1 12 ARG NE N 2.307 -2.086 5.457 1.00 . A A . 12 ARG NE 1 1 1 254 1 1 12 ARG NH1 N 0.432 -2.254 6.709 1.00 . A A . 12 ARG NH1 1 1 1 255 1 1 12 ARG NH2 N 0.471 -3.098 4.613 1.00 . A A . 12 ARG NH2 1 1 1 256 1 1 12 ARG O O 3.165 3.755 6.034 1.00 . A A . 12 ARG O 1 1 1 257 1 1 13 LYS C C 2.712 6.317 5.987 1.00 . A A . 13 LYS C 1 1 1 258 1 1 13 LYS CA C 1.489 5.723 5.284 1.00 . A A . 13 LYS CA 1 1 1 259 1 1 13 LYS CB C 0.509 5.146 6.305 1.00 . A A . 13 LYS CB 1 1 1 260 1 1 13 LYS CD C -1.875 4.522 5.884 1.00 . A A . 13 LYS CD 1 1 1 261 1 1 13 LYS CE C -2.306 4.042 7.273 1.00 . A A . 13 LYS CE 1 1 1 262 1 1 13 LYS CG C -0.895 5.689 6.029 1.00 . A A . 13 LYS CG 1 1 1 263 1 1 13 LYS H H 1.540 4.475 3.526 1.00 . A A . 13 LYS H 1 1 1 264 1 1 13 LYS HA H 0.997 6.474 4.684 1.00 . A A . 13 LYS HA 1 1 1 265 1 1 13 LYS HB2 H 0.501 4.069 6.227 1.00 . A A . 13 LYS HB2 1 1 1 266 1 1 13 LYS HB3 H 0.814 5.433 7.298 1.00 . A A . 13 LYS HB3 1 1 1 267 1 1 13 LYS HD2 H -2.743 4.847 5.330 1.00 . A A . 13 LYS HD2 1 1 1 268 1 1 13 LYS HD3 H -1.393 3.711 5.359 1.00 . A A . 13 LYS HD3 1 1 1 269 1 1 13 LYS HE2 H -1.864 4.666 8.039 1.00 . A A . 13 LYS HE2 1 1 1 270 1 1 13 LYS HE3 H -3.381 4.045 7.356 1.00 . A A . 13 LYS HE3 1 1 1 271 1 1 13 LYS HG2 H -1.205 6.320 6.849 1.00 . A A . 13 LYS HG2 1 1 1 272 1 1 13 LYS HG3 H -0.886 6.264 5.116 1.00 . A A . 13 LYS HG3 1 1 1 273 1 1 13 LYS HZ1 H -2.310 2.140 8.116 1.00 . A A . 13 LYS HZ1 1 1 1 274 1 1 13 LYS HZ2 H -0.777 2.671 7.614 1.00 . A A . 13 LYS HZ2 1 1 1 275 1 1 13 LYS HZ3 H -1.921 2.162 6.466 1.00 . A A . 13 LYS HZ3 1 1 1 276 1 1 13 LYS N N 1.892 4.564 4.437 1.00 . A A . 13 LYS N 1 1 1 277 1 1 13 LYS NZ N -1.789 2.649 7.375 1.00 . A A . 13 LYS NZ 1 1 1 278 1 1 13 LYS O O 2.659 6.649 7.155 1.00 . A A . 13 LYS O 1 1 1 279 1 1 14 NH2 HN1 H 3.867 6.197 4.377 1.00 . A A . 14 NH2 HN1 1 1 1 280 1 1 14 NH2 HN2 H 4.612 6.844 5.760 1.00 . A A . 14 NH2 HN2 1 1 1 281 1 1 14 NH2 N N 3.822 6.465 5.320 1.00 . A A . 14 NH2 N 1 1 2 282 1 1 1 ILE C C -7.239 3.355 -6.913 1.00 . A A . 1 ILE C 1 1 2 283 1 1 1 ILE CA C -8.163 3.991 -7.956 1.00 . A A . 1 ILE CA 1 1 2 284 1 1 1 ILE CB C -8.314 3.073 -9.169 1.00 . A A . 1 ILE CB 1 1 2 285 1 1 1 ILE CD1 C -6.821 1.565 -10.491 1.00 . A A . 1 ILE CD1 1 1 2 286 1 1 1 ILE CG1 C -6.973 2.968 -9.900 1.00 . A A . 1 ILE CG1 1 1 2 287 1 1 1 ILE CG2 C -9.366 3.649 -10.117 1.00 . A A . 1 ILE CG2 1 1 2 288 1 1 1 ILE H1 H -7.853 6.050 -7.916 1.00 . A A . 1 ILE H1 1 1 2 289 1 1 1 ILE H2 H -7.858 5.381 -9.478 1.00 . A A . 1 ILE H2 1 1 2 290 1 1 1 ILE H3 H -6.514 5.162 -8.460 1.00 . A A . 1 ILE H3 1 1 2 291 1 1 1 ILE HA H -9.130 4.199 -7.528 1.00 . A A . 1 ILE HA 1 1 2 292 1 1 1 ILE HB H -8.625 2.091 -8.841 1.00 . A A . 1 ILE HB 1 1 2 293 1 1 1 ILE HD11 H -6.753 0.843 -9.691 1.00 . A A . 1 ILE HD11 1 1 2 294 1 1 1 ILE HD12 H -5.922 1.523 -11.090 1.00 . A A . 1 ILE HD12 1 1 2 295 1 1 1 ILE HD13 H -7.677 1.340 -11.109 1.00 . A A . 1 ILE HD13 1 1 2 296 1 1 1 ILE HG12 H -6.939 3.701 -10.694 1.00 . A A . 1 ILE HG12 1 1 2 297 1 1 1 ILE HG13 H -6.167 3.153 -9.204 1.00 . A A . 1 ILE HG13 1 1 2 298 1 1 1 ILE HG21 H -9.882 2.842 -10.617 1.00 . A A . 1 ILE HG21 1 1 2 299 1 1 1 ILE HG22 H -8.884 4.277 -10.852 1.00 . A A . 1 ILE HG22 1 1 2 300 1 1 1 ILE HG23 H -10.077 4.236 -9.553 1.00 . A A . 1 ILE HG23 1 1 2 301 1 1 1 ILE N N -7.551 5.240 -8.492 1.00 . A A . 1 ILE N 1 1 2 302 1 1 1 ILE O O -6.040 3.554 -6.929 1.00 . A A . 1 ILE O 1 1 2 303 1 1 2 LEU C C -7.807 1.108 -4.026 1.00 . A A . 2 LEU C 1 1 2 304 1 1 2 LEU CA C -6.940 1.946 -4.965 1.00 . A A . 2 LEU CA 1 1 2 305 1 1 2 LEU CB C -6.289 3.104 -4.209 1.00 . A A . 2 LEU CB 1 1 2 306 1 1 2 LEU CD1 C -4.165 2.010 -3.474 1.00 . A A . 2 LEU CD1 1 1 2 307 1 1 2 LEU CD2 C -5.284 3.686 -1.997 1.00 . A A . 2 LEU CD2 1 1 2 308 1 1 2 LEU CG C -5.515 2.559 -3.007 1.00 . A A . 2 LEU CG 1 1 2 309 1 1 2 LEU H H -8.757 2.445 -6.013 1.00 . A A . 2 LEU H 1 1 2 310 1 1 2 LEU HA H -6.183 1.331 -5.423 1.00 . A A . 2 LEU HA 1 1 2 311 1 1 2 LEU HB2 H -5.611 3.628 -4.866 1.00 . A A . 2 LEU HB2 1 1 2 312 1 1 2 LEU HB3 H -7.053 3.784 -3.862 1.00 . A A . 2 LEU HB3 1 1 2 313 1 1 2 LEU HD11 H -3.372 2.482 -2.915 1.00 . A A . 2 LEU HD11 1 1 2 314 1 1 2 LEU HD12 H -4.037 2.218 -4.526 1.00 . A A . 2 LEU HD12 1 1 2 315 1 1 2 LEU HD13 H -4.136 0.943 -3.312 1.00 . A A . 2 LEU HD13 1 1 2 316 1 1 2 LEU HD21 H -5.218 3.270 -1.003 1.00 . A A . 2 LEU HD21 1 1 2 317 1 1 2 LEU HD22 H -6.107 4.383 -2.042 1.00 . A A . 2 LEU HD22 1 1 2 318 1 1 2 LEU HD23 H -4.363 4.199 -2.236 1.00 . A A . 2 LEU HD23 1 1 2 319 1 1 2 LEU HG H -6.085 1.767 -2.541 1.00 . A A . 2 LEU HG 1 1 2 320 1 1 2 LEU N N -7.788 2.592 -6.008 1.00 . A A . 2 LEU N 1 1 2 321 1 1 2 LEU O O -8.451 1.620 -3.131 1.00 . A A . 2 LEU O 1 1 2 322 1 1 3 LYS C C -8.305 -2.530 -3.599 1.00 . A A . 3 LYS C 1 1 2 323 1 1 3 LYS CA C -8.649 -1.059 -3.346 1.00 . A A . 3 LYS CA 1 1 2 324 1 1 3 LYS CB C -10.098 -0.771 -3.740 1.00 . A A . 3 LYS CB 1 1 2 325 1 1 3 LYS CD C -11.642 -0.347 -5.658 1.00 . A A . 3 LYS CD 1 1 2 326 1 1 3 LYS CE C -12.333 -1.516 -6.364 1.00 . A A . 3 LYS CE 1 1 2 327 1 1 3 LYS CG C -10.220 -0.755 -5.264 1.00 . A A . 3 LYS CG 1 1 2 328 1 1 3 LYS H H -7.297 -0.567 -4.952 1.00 . A A . 3 LYS H 1 1 2 329 1 1 3 LYS HA H -8.491 -0.810 -2.310 1.00 . A A . 3 LYS HA 1 1 2 330 1 1 3 LYS HB2 H -10.740 -1.539 -3.333 1.00 . A A . 3 LYS HB2 1 1 2 331 1 1 3 LYS HB3 H -10.392 0.191 -3.347 1.00 . A A . 3 LYS HB3 1 1 2 332 1 1 3 LYS HD2 H -12.199 -0.082 -4.770 1.00 . A A . 3 LYS HD2 1 1 2 333 1 1 3 LYS HD3 H -11.601 0.501 -6.325 1.00 . A A . 3 LYS HD3 1 1 2 334 1 1 3 LYS HE2 H -13.290 -1.202 -6.758 1.00 . A A . 3 LYS HE2 1 1 2 335 1 1 3 LYS HE3 H -11.707 -1.901 -7.154 1.00 . A A . 3 LYS HE3 1 1 2 336 1 1 3 LYS HG2 H -9.515 -0.048 -5.674 1.00 . A A . 3 LYS HG2 1 1 2 337 1 1 3 LYS HG3 H -10.011 -1.741 -5.653 1.00 . A A . 3 LYS HG3 1 1 2 338 1 1 3 LYS HZ1 H -13.311 -2.283 -4.694 1.00 . A A . 3 LYS HZ1 1 1 2 339 1 1 3 LYS HZ2 H -11.647 -2.621 -4.740 1.00 . A A . 3 LYS HZ2 1 1 2 340 1 1 3 LYS HZ3 H -12.717 -3.468 -5.752 1.00 . A A . 3 LYS HZ3 1 1 2 341 1 1 3 LYS N N -7.826 -0.179 -4.224 1.00 . A A . 3 LYS N 1 1 2 342 1 1 3 LYS NZ N -12.516 -2.551 -5.308 1.00 . A A . 3 LYS NZ 1 1 2 343 1 1 3 LYS O O -9.134 -3.307 -4.030 1.00 . A A . 3 LYS O 1 1 2 344 1 1 4 LYS C C -5.636 -4.739 -2.530 1.00 . A A . 4 LYS C 1 1 2 345 1 1 4 LYS CA C -6.687 -4.329 -3.556 1.00 . A A . 4 LYS CA 1 1 2 346 1 1 4 LYS CB C -6.112 -4.351 -4.962 1.00 . A A . 4 LYS CB 1 1 2 347 1 1 4 LYS CD C -5.606 -6.267 -6.485 1.00 . A A . 4 LYS CD 1 1 2 348 1 1 4 LYS CE C -4.891 -5.535 -7.625 1.00 . A A . 4 LYS CE 1 1 2 349 1 1 4 LYS CG C -5.255 -5.603 -5.152 1.00 . A A . 4 LYS CG 1 1 2 350 1 1 4 LYS H H -6.436 -2.275 -2.989 1.00 . A A . 4 LYS H 1 1 2 351 1 1 4 LYS HA H -7.545 -4.979 -3.496 1.00 . A A . 4 LYS HA 1 1 2 352 1 1 4 LYS HB2 H -6.921 -4.355 -5.668 1.00 . A A . 4 LYS HB2 1 1 2 353 1 1 4 LYS HB3 H -5.504 -3.474 -5.111 1.00 . A A . 4 LYS HB3 1 1 2 354 1 1 4 LYS HD2 H -5.292 -7.299 -6.466 1.00 . A A . 4 LYS HD2 1 1 2 355 1 1 4 LYS HD3 H -6.673 -6.216 -6.642 1.00 . A A . 4 LYS HD3 1 1 2 356 1 1 4 LYS HE2 H -5.506 -5.538 -8.514 1.00 . A A . 4 LYS HE2 1 1 2 357 1 1 4 LYS HE3 H -4.653 -4.525 -7.332 1.00 . A A . 4 LYS HE3 1 1 2 358 1 1 4 LYS HG2 H -4.211 -5.325 -5.150 1.00 . A A . 4 LYS HG2 1 1 2 359 1 1 4 LYS HG3 H -5.446 -6.294 -4.346 1.00 . A A . 4 LYS HG3 1 1 2 360 1 1 4 LYS HZ1 H -3.211 -6.555 -6.937 1.00 . A A . 4 LYS HZ1 1 1 2 361 1 1 4 LYS HZ2 H -2.973 -5.735 -8.407 1.00 . A A . 4 LYS HZ2 1 1 2 362 1 1 4 LYS HZ3 H -3.862 -7.182 -8.373 1.00 . A A . 4 LYS HZ3 1 1 2 363 1 1 4 LYS N N -7.089 -2.916 -3.333 1.00 . A A . 4 LYS N 1 1 2 364 1 1 4 LYS NZ N -3.640 -6.311 -7.852 1.00 . A A . 4 LYS NZ 1 1 2 365 1 1 4 LYS O O -4.463 -4.853 -2.823 1.00 . A A . 4 LYS O 1 1 2 366 1 1 5 TRP C C -3.951 -4.373 -0.170 1.00 . A A . 5 TRP C 1 1 2 367 1 1 5 TRP CA C -5.116 -5.363 -0.252 1.00 . A A . 5 TRP CA 1 1 2 368 1 1 5 TRP CB C -4.614 -6.744 -0.667 1.00 . A A . 5 TRP CB 1 1 2 369 1 1 5 TRP CD1 C -6.305 -8.621 -0.763 1.00 . A A . 5 TRP CD1 1 1 2 370 1 1 5 TRP CD2 C -5.655 -8.148 1.336 1.00 . A A . 5 TRP CD2 1 1 2 371 1 1 5 TRP CE2 C -6.591 -9.203 1.431 1.00 . A A . 5 TRP CE2 1 1 2 372 1 1 5 TRP CE3 C -5.086 -7.656 2.523 1.00 . A A . 5 TRP CE3 1 1 2 373 1 1 5 TRP CG C -5.491 -7.795 -0.067 1.00 . A A . 5 TRP CG 1 1 2 374 1 1 5 TRP CH2 C -6.375 -9.254 3.833 1.00 . A A . 5 TRP CH2 1 1 2 375 1 1 5 TRP CZ2 C -6.950 -9.753 2.662 1.00 . A A . 5 TRP CZ2 1 1 2 376 1 1 5 TRP CZ3 C -5.444 -8.207 3.765 1.00 . A A . 5 TRP CZ3 1 1 2 377 1 1 5 TRP H H -7.014 -4.854 -1.138 1.00 . A A . 5 TRP H 1 1 2 378 1 1 5 TRP HA H -5.627 -5.425 0.695 1.00 . A A . 5 TRP HA 1 1 2 379 1 1 5 TRP HB2 H -4.637 -6.827 -1.744 1.00 . A A . 5 TRP HB2 1 1 2 380 1 1 5 TRP HB3 H -3.602 -6.878 -0.317 1.00 . A A . 5 TRP HB3 1 1 2 381 1 1 5 TRP HD1 H -6.427 -8.626 -1.836 1.00 . A A . 5 TRP HD1 1 1 2 382 1 1 5 TRP HE1 H -7.607 -10.149 -0.123 1.00 . A A . 5 TRP HE1 1 1 2 383 1 1 5 TRP HE3 H -4.368 -6.850 2.480 1.00 . A A . 5 TRP HE3 1 1 2 384 1 1 5 TRP HH2 H -6.647 -9.673 4.791 1.00 . A A . 5 TRP HH2 1 1 2 385 1 1 5 TRP HZ2 H -7.667 -10.560 2.708 1.00 . A A . 5 TRP HZ2 1 1 2 386 1 1 5 TRP HZ3 H -5.001 -7.823 4.671 1.00 . A A . 5 TRP HZ3 1 1 2 387 1 1 5 TRP N N -6.064 -4.957 -1.329 1.00 . A A . 5 TRP N 1 1 2 388 1 1 5 TRP NE1 N -6.959 -9.457 0.125 1.00 . A A . 5 TRP NE1 1 1 2 389 1 1 5 TRP O O -3.073 -4.378 -1.009 1.00 . A A . 5 TRP O 1 1 2 390 1 1 6 PRO C C -1.624 -3.230 1.517 1.00 . A A . 6 PRO C 1 1 2 391 1 1 6 PRO CA C -2.915 -2.552 1.053 1.00 . A A . 6 PRO CA 1 1 2 392 1 1 6 PRO CB C -3.477 -1.648 2.143 1.00 . A A . 6 PRO CB 1 1 2 393 1 1 6 PRO CD C -5.008 -3.500 1.896 1.00 . A A . 6 PRO CD 1 1 2 394 1 1 6 PRO CG C -4.463 -2.496 2.881 1.00 . A A . 6 PRO CG 1 1 2 395 1 1 6 PRO HA H -2.746 -1.986 0.151 1.00 . A A . 6 PRO HA 1 1 2 396 1 1 6 PRO HB2 H -2.687 -1.322 2.804 1.00 . A A . 6 PRO HB2 1 1 2 397 1 1 6 PRO HB3 H -3.976 -0.800 1.702 1.00 . A A . 6 PRO HB3 1 1 2 398 1 1 6 PRO HD2 H -5.129 -4.465 2.370 1.00 . A A . 6 PRO HD2 1 1 2 399 1 1 6 PRO HD3 H -5.943 -3.156 1.482 1.00 . A A . 6 PRO HD3 1 1 2 400 1 1 6 PRO HG2 H -3.968 -3.008 3.697 1.00 . A A . 6 PRO HG2 1 1 2 401 1 1 6 PRO HG3 H -5.267 -1.885 3.259 1.00 . A A . 6 PRO HG3 1 1 2 402 1 1 6 PRO N N -3.983 -3.559 0.849 1.00 . A A . 6 PRO N 1 1 2 403 1 1 6 PRO O O -1.329 -3.290 2.693 1.00 . A A . 6 PRO O 1 1 2 404 1 1 7 TRP C C 1.591 -3.823 0.214 1.00 . A A . 7 TRP C 1 1 2 405 1 1 7 TRP CA C 0.414 -4.424 0.982 1.00 . A A . 7 TRP CA 1 1 2 406 1 1 7 TRP CB C 0.217 -5.884 0.591 1.00 . A A . 7 TRP CB 1 1 2 407 1 1 7 TRP CD1 C -1.036 -7.130 2.395 1.00 . A A . 7 TRP CD1 1 1 2 408 1 1 7 TRP CD2 C 1.196 -7.254 2.649 1.00 . A A . 7 TRP CD2 1 1 2 409 1 1 7 TRP CE2 C 0.625 -7.988 3.715 1.00 . A A . 7 TRP CE2 1 1 2 410 1 1 7 TRP CE3 C 2.599 -7.174 2.574 1.00 . A A . 7 TRP CE3 1 1 2 411 1 1 7 TRP CG C 0.119 -6.721 1.825 1.00 . A A . 7 TRP CG 1 1 2 412 1 1 7 TRP CH2 C 2.809 -8.530 4.586 1.00 . A A . 7 TRP CH2 1 1 2 413 1 1 7 TRP CZ2 C 1.416 -8.619 4.675 1.00 . A A . 7 TRP CZ2 1 1 2 414 1 1 7 TRP CZ3 C 3.399 -7.808 3.540 1.00 . A A . 7 TRP CZ3 1 1 2 415 1 1 7 TRP H H -1.118 -3.687 -0.345 1.00 . A A . 7 TRP H 1 1 2 416 1 1 7 TRP HA H 0.578 -4.343 2.042 1.00 . A A . 7 TRP HA 1 1 2 417 1 1 7 TRP HB2 H -0.694 -5.978 0.017 1.00 . A A . 7 TRP HB2 1 1 2 418 1 1 7 TRP HB3 H 1.056 -6.211 -0.003 1.00 . A A . 7 TRP HB3 1 1 2 419 1 1 7 TRP HD1 H -2.029 -6.908 2.034 1.00 . A A . 7 TRP HD1 1 1 2 420 1 1 7 TRP HE1 H -1.397 -8.300 4.111 1.00 . A A . 7 TRP HE1 1 1 2 421 1 1 7 TRP HE3 H 3.063 -6.620 1.773 1.00 . A A . 7 TRP HE3 1 1 2 422 1 1 7 TRP HH2 H 3.430 -9.015 5.325 1.00 . A A . 7 TRP HH2 1 1 2 423 1 1 7 TRP HZ2 H 0.958 -9.175 5.479 1.00 . A A . 7 TRP HZ2 1 1 2 424 1 1 7 TRP HZ3 H 4.474 -7.740 3.474 1.00 . A A . 7 TRP HZ3 1 1 2 425 1 1 7 TRP N N -0.857 -3.745 0.598 1.00 . A A . 7 TRP N 1 1 2 426 1 1 7 TRP NE1 N -0.738 -7.883 3.517 1.00 . A A . 7 TRP NE1 1 1 2 427 1 1 7 TRP O O 2.314 -4.510 -0.478 1.00 . A A . 7 TRP O 1 1 2 428 1 1 8 TRP C C 4.041 -1.563 0.610 1.00 . A A . 8 TRP C 1 1 2 429 1 1 8 TRP CA C 2.911 -1.886 -0.372 1.00 . A A . 8 TRP CA 1 1 2 430 1 1 8 TRP CB C 2.320 -0.600 -0.949 1.00 . A A . 8 TRP CB 1 1 2 431 1 1 8 TRP CD1 C 3.973 0.916 -2.112 1.00 . A A . 8 TRP CD1 1 1 2 432 1 1 8 TRP CD2 C 3.234 -0.742 -3.441 1.00 . A A . 8 TRP CD2 1 1 2 433 1 1 8 TRP CE2 C 4.142 0.023 -4.211 1.00 . A A . 8 TRP CE2 1 1 2 434 1 1 8 TRP CE3 C 2.622 -1.854 -4.047 1.00 . A A . 8 TRP CE3 1 1 2 435 1 1 8 TRP CG C 3.145 -0.153 -2.112 1.00 . A A . 8 TRP CG 1 1 2 436 1 1 8 TRP CH2 C 3.815 -1.413 -6.124 1.00 . A A . 8 TRP CH2 1 1 2 437 1 1 8 TRP CZ2 C 4.432 -0.304 -5.537 1.00 . A A . 8 TRP CZ2 1 1 2 438 1 1 8 TRP CZ3 C 2.912 -2.187 -5.380 1.00 . A A . 8 TRP CZ3 1 1 2 439 1 1 8 TRP H H 1.188 -2.022 0.904 1.00 . A A . 8 TRP H 1 1 2 440 1 1 8 TRP HA H 3.269 -2.514 -1.167 1.00 . A A . 8 TRP HA 1 1 2 441 1 1 8 TRP HB2 H 1.306 -0.784 -1.275 1.00 . A A . 8 TRP HB2 1 1 2 442 1 1 8 TRP HB3 H 2.320 0.169 -0.190 1.00 . A A . 8 TRP HB3 1 1 2 443 1 1 8 TRP HD1 H 4.144 1.579 -1.277 1.00 . A A . 8 TRP HD1 1 1 2 444 1 1 8 TRP HE1 H 5.208 1.713 -3.621 1.00 . A A . 8 TRP HE1 1 1 2 445 1 1 8 TRP HE3 H 1.926 -2.455 -3.483 1.00 . A A . 8 TRP HE3 1 1 2 446 1 1 8 TRP HH2 H 4.034 -1.674 -7.150 1.00 . A A . 8 TRP HH2 1 1 2 447 1 1 8 TRP HZ2 H 5.128 0.294 -6.105 1.00 . A A . 8 TRP HZ2 1 1 2 448 1 1 8 TRP HZ3 H 2.437 -3.042 -5.837 1.00 . A A . 8 TRP HZ3 1 1 2 449 1 1 8 TRP N N 1.785 -2.545 0.339 1.00 . A A . 8 TRP N 1 1 2 450 1 1 8 TRP NE1 N 4.566 1.022 -3.358 1.00 . A A . 8 TRP NE1 1 1 2 451 1 1 8 TRP O O 3.890 -0.723 1.474 1.00 . A A . 8 TRP O 1 1 2 452 1 1 9 PRO C C 7.175 -0.890 0.818 1.00 . A A . 9 PRO C 1 1 2 453 1 1 9 PRO CA C 6.309 -2.044 1.325 1.00 . A A . 9 PRO CA 1 1 2 454 1 1 9 PRO CB C 7.056 -3.368 1.225 1.00 . A A . 9 PRO CB 1 1 2 455 1 1 9 PRO CD C 5.392 -3.280 -0.562 1.00 . A A . 9 PRO CD 1 1 2 456 1 1 9 PRO CG C 6.660 -3.960 -0.098 1.00 . A A . 9 PRO CG 1 1 2 457 1 1 9 PRO HA H 5.996 -1.868 2.336 1.00 . A A . 9 PRO HA 1 1 2 458 1 1 9 PRO HB2 H 8.123 -3.196 1.257 1.00 . A A . 9 PRO HB2 1 1 2 459 1 1 9 PRO HB3 H 6.756 -4.023 2.026 1.00 . A A . 9 PRO HB3 1 1 2 460 1 1 9 PRO HD2 H 5.540 -2.831 -1.535 1.00 . A A . 9 PRO HD2 1 1 2 461 1 1 9 PRO HD3 H 4.572 -3.981 -0.590 1.00 . A A . 9 PRO HD3 1 1 2 462 1 1 9 PRO HG2 H 7.447 -3.799 -0.819 1.00 . A A . 9 PRO HG2 1 1 2 463 1 1 9 PRO HG3 H 6.479 -5.019 0.017 1.00 . A A . 9 PRO HG3 1 1 2 464 1 1 9 PRO N N 5.139 -2.250 0.445 1.00 . A A . 9 PRO N 1 1 2 465 1 1 9 PRO O O 8.370 -0.852 1.034 1.00 . A A . 9 PRO O 1 1 2 466 1 1 10 TRP C C 7.031 2.465 0.425 1.00 . A A . 10 TRP C 1 1 2 467 1 1 10 TRP CA C 7.351 1.205 -0.377 1.00 . A A . 10 TRP CA 1 1 2 468 1 1 10 TRP CB C 6.883 1.353 -1.822 1.00 . A A . 10 TRP CB 1 1 2 469 1 1 10 TRP CD1 C 8.931 2.478 -2.787 1.00 . A A . 10 TRP CD1 1 1 2 470 1 1 10 TRP CD2 C 8.531 0.458 -3.679 1.00 . A A . 10 TRP CD2 1 1 2 471 1 1 10 TRP CE2 C 9.693 0.949 -4.312 1.00 . A A . 10 TRP CE2 1 1 2 472 1 1 10 TRP CE3 C 8.049 -0.802 -4.051 1.00 . A A . 10 TRP CE3 1 1 2 473 1 1 10 TRP CG C 8.069 1.439 -2.720 1.00 . A A . 10 TRP CG 1 1 2 474 1 1 10 TRP CH2 C 9.868 -1.050 -5.651 1.00 . A A . 10 TRP CH2 1 1 2 475 1 1 10 TRP CZ2 C 10.359 0.209 -5.289 1.00 . A A . 10 TRP CZ2 1 1 2 476 1 1 10 TRP CZ3 C 8.713 -1.556 -5.033 1.00 . A A . 10 TRP CZ3 1 1 2 477 1 1 10 TRP H H 5.622 -0.008 -0.012 1.00 . A A . 10 TRP H 1 1 2 478 1 1 10 TRP HA H 8.402 0.996 -0.350 1.00 . A A . 10 TRP HA 1 1 2 479 1 1 10 TRP HB2 H 6.289 0.494 -2.096 1.00 . A A . 10 TRP HB2 1 1 2 480 1 1 10 TRP HB3 H 6.290 2.243 -1.922 1.00 . A A . 10 TRP HB3 1 1 2 481 1 1 10 TRP HD1 H 8.874 3.381 -2.199 1.00 . A A . 10 TRP HD1 1 1 2 482 1 1 10 TRP HE1 H 10.646 2.775 -3.978 1.00 . A A . 10 TRP HE1 1 1 2 483 1 1 10 TRP HE3 H 7.159 -1.193 -3.574 1.00 . A A . 10 TRP HE3 1 1 2 484 1 1 10 TRP HH2 H 10.376 -1.631 -6.406 1.00 . A A . 10 TRP HH2 1 1 2 485 1 1 10 TRP HZ2 H 11.247 0.604 -5.760 1.00 . A A . 10 TRP HZ2 1 1 2 486 1 1 10 TRP HZ3 H 8.335 -2.528 -5.314 1.00 . A A . 10 TRP HZ3 1 1 2 487 1 1 10 TRP N N 6.578 0.048 0.148 1.00 . A A . 10 TRP N 1 1 2 488 1 1 10 TRP NE1 N 9.900 2.189 -3.734 1.00 . A A . 10 TRP NE1 1 1 2 489 1 1 10 TRP O O 7.910 3.202 0.826 1.00 . A A . 10 TRP O 1 1 2 490 1 1 11 ARG C C 4.596 3.511 2.676 1.00 . A A . 11 ARG C 1 1 2 491 1 1 11 ARG CA C 5.385 3.923 1.437 1.00 . A A . 11 ARG CA 1 1 2 492 1 1 11 ARG CB C 4.510 4.737 0.484 1.00 . A A . 11 ARG CB 1 1 2 493 1 1 11 ARG CD C 5.240 7.121 0.674 1.00 . A A . 11 ARG CD 1 1 2 494 1 1 11 ARG CG C 5.345 5.843 -0.163 1.00 . A A . 11 ARG CG 1 1 2 495 1 1 11 ARG CZ C 4.224 8.919 -0.590 1.00 . A A . 11 ARG CZ 1 1 2 496 1 1 11 ARG H H 5.089 2.107 0.328 1.00 . A A . 11 ARG H 1 1 2 497 1 1 11 ARG HA H 6.257 4.488 1.718 1.00 . A A . 11 ARG HA 1 1 2 498 1 1 11 ARG HB2 H 4.116 4.087 -0.283 1.00 . A A . 11 ARG HB2 1 1 2 499 1 1 11 ARG HB3 H 3.695 5.178 1.035 1.00 . A A . 11 ARG HB3 1 1 2 500 1 1 11 ARG HD2 H 5.085 6.874 1.717 1.00 . A A . 11 ARG HD2 1 1 2 501 1 1 11 ARG HD3 H 6.126 7.722 0.556 1.00 . A A . 11 ARG HD3 1 1 2 502 1 1 11 ARG HE H 3.153 7.505 0.303 1.00 . A A . 11 ARG HE 1 1 2 503 1 1 11 ARG HG2 H 6.378 5.529 -0.214 1.00 . A A . 11 ARG HG2 1 1 2 504 1 1 11 ARG HG3 H 4.977 6.035 -1.159 1.00 . A A . 11 ARG HG3 1 1 2 505 1 1 11 ARG HH11 H 4.884 7.932 -2.203 1.00 . A A . 11 ARG HH11 1 1 2 506 1 1 11 ARG HH12 H 4.797 9.654 -2.361 1.00 . A A . 11 ARG HH12 1 1 2 507 1 1 11 ARG HH21 H 3.604 10.159 0.855 1.00 . A A . 11 ARG HH21 1 1 2 508 1 1 11 ARG HH22 H 4.073 10.916 -0.632 1.00 . A A . 11 ARG HH22 1 1 2 509 1 1 11 ARG N N 5.776 2.715 0.660 1.00 . A A . 11 ARG N 1 1 2 510 1 1 11 ARG NE N 4.058 7.841 0.126 1.00 . A A . 11 ARG NE 1 1 2 511 1 1 11 ARG NH1 N 4.670 8.829 -1.813 1.00 . A A . 11 ARG NH1 1 1 2 512 1 1 11 ARG NH2 N 3.945 10.089 -0.082 1.00 . A A . 11 ARG NH2 1 1 2 513 1 1 11 ARG O O 3.447 3.865 2.848 1.00 . A A . 11 ARG O 1 1 2 514 1 1 12 ARG C C 4.796 3.284 5.926 1.00 . A A . 12 ARG C 1 1 2 515 1 1 12 ARG CA C 4.513 2.313 4.778 1.00 . A A . 12 ARG CA 1 1 2 516 1 1 12 ARG CB C 5.100 0.934 5.087 1.00 . A A . 12 ARG CB 1 1 2 517 1 1 12 ARG CD C 7.090 0.145 6.375 1.00 . A A . 12 ARG CD 1 1 2 518 1 1 12 ARG CG C 6.619 1.045 5.233 1.00 . A A . 12 ARG CG 1 1 2 519 1 1 12 ARG CZ C 8.511 -1.661 5.610 1.00 . A A . 12 ARG CZ 1 1 2 520 1 1 12 ARG H H 6.140 2.492 3.372 1.00 . A A . 12 ARG H 1 1 2 521 1 1 12 ARG HA H 3.452 2.231 4.605 1.00 . A A . 12 ARG HA 1 1 2 522 1 1 12 ARG HB2 H 4.675 0.559 6.006 1.00 . A A . 12 ARG HB2 1 1 2 523 1 1 12 ARG HB3 H 4.868 0.255 4.280 1.00 . A A . 12 ARG HB3 1 1 2 524 1 1 12 ARG HD2 H 7.213 0.721 7.282 1.00 . A A . 12 ARG HD2 1 1 2 525 1 1 12 ARG HD3 H 6.390 -0.662 6.532 1.00 . A A . 12 ARG HD3 1 1 2 526 1 1 12 ARG HE H 9.179 0.194 5.852 1.00 . A A . 12 ARG HE 1 1 2 527 1 1 12 ARG HG2 H 7.092 0.740 4.312 1.00 . A A . 12 ARG HG2 1 1 2 528 1 1 12 ARG HG3 H 6.884 2.069 5.452 1.00 . A A . 12 ARG HG3 1 1 2 529 1 1 12 ARG HH11 H 8.582 -2.279 7.513 1.00 . A A . 12 ARG HH11 1 1 2 530 1 1 12 ARG HH12 H 8.685 -3.527 6.316 1.00 . A A . 12 ARG HH12 1 1 2 531 1 1 12 ARG HH21 H 8.466 -1.338 3.635 1.00 . A A . 12 ARG HH21 1 1 2 532 1 1 12 ARG HH22 H 8.620 -2.994 4.120 1.00 . A A . 12 ARG HH22 1 1 2 533 1 1 12 ARG N N 5.214 2.761 3.541 1.00 . A A . 12 ARG N 1 1 2 534 1 1 12 ARG NE N 8.400 -0.398 5.920 1.00 . A A . 12 ARG NE 1 1 2 535 1 1 12 ARG NH1 N 8.600 -2.559 6.553 1.00 . A A . 12 ARG NH1 1 1 2 536 1 1 12 ARG NH2 N 8.534 -2.026 4.358 1.00 . A A . 12 ARG NH2 1 1 2 537 1 1 12 ARG O O 5.869 3.845 6.029 1.00 . A A . 12 ARG O 1 1 2 538 1 1 13 LYS C C 4.374 5.824 7.416 1.00 . A A . 13 LYS C 1 1 2 539 1 1 13 LYS CA C 4.055 4.420 7.935 1.00 . A A . 13 LYS CA 1 1 2 540 1 1 13 LYS CB C 5.249 3.845 8.698 1.00 . A A . 13 LYS CB 1 1 2 541 1 1 13 LYS CD C 5.893 3.250 11.039 1.00 . A A . 13 LYS CD 1 1 2 542 1 1 13 LYS CE C 4.865 2.291 11.641 1.00 . A A . 13 LYS CE 1 1 2 543 1 1 13 LYS CG C 5.179 4.282 10.163 1.00 . A A . 13 LYS CG 1 1 2 544 1 1 13 LYS H H 2.984 3.022 6.694 1.00 . A A . 13 LYS H 1 1 2 545 1 1 13 LYS HA H 3.187 4.441 8.574 1.00 . A A . 13 LYS HA 1 1 2 546 1 1 13 LYS HB2 H 5.226 2.766 8.643 1.00 . A A . 13 LYS HB2 1 1 2 547 1 1 13 LYS HB3 H 6.166 4.208 8.260 1.00 . A A . 13 LYS HB3 1 1 2 548 1 1 13 LYS HD2 H 6.597 2.695 10.437 1.00 . A A . 13 LYS HD2 1 1 2 549 1 1 13 LYS HD3 H 6.419 3.758 11.834 1.00 . A A . 13 LYS HD3 1 1 2 550 1 1 13 LYS HE2 H 4.328 2.774 12.448 1.00 . A A . 13 LYS HE2 1 1 2 551 1 1 13 LYS HE3 H 4.179 1.948 10.883 1.00 . A A . 13 LYS HE3 1 1 2 552 1 1 13 LYS HG2 H 5.658 5.244 10.274 1.00 . A A . 13 LYS HG2 1 1 2 553 1 1 13 LYS HG3 H 4.145 4.357 10.467 1.00 . A A . 13 LYS HG3 1 1 2 554 1 1 13 LYS HZ1 H 6.316 0.816 11.421 1.00 . A A . 13 LYS HZ1 1 1 2 555 1 1 13 LYS HZ2 H 5.026 0.372 12.433 1.00 . A A . 13 LYS HZ2 1 1 2 556 1 1 13 LYS HZ3 H 6.212 1.453 12.989 1.00 . A A . 13 LYS HZ3 1 1 2 557 1 1 13 LYS N N 3.841 3.485 6.794 1.00 . A A . 13 LYS N 1 1 2 558 1 1 13 LYS NZ N 5.665 1.147 12.160 1.00 . A A . 13 LYS NZ 1 1 2 559 1 1 13 LYS O O 5.351 6.428 7.811 1.00 . A A . 13 LYS O 1 1 2 560 1 1 14 NH2 HN1 H 2.790 5.890 6.218 1.00 . A A . 14 NH2 HN1 1 1 2 561 1 1 14 NH2 HN2 H 3.774 7.273 6.198 1.00 . A A . 14 NH2 HN2 1 1 2 562 1 1 14 NH2 N N 3.581 6.375 6.537 1.00 . A A . 14 NH2 N 1 1 3 563 1 1 1 ILE C C -9.651 6.030 -0.380 1.00 . A A . 1 ILE C 1 1 3 564 1 1 1 ILE CA C -10.984 6.753 -0.590 1.00 . A A . 1 ILE CA 1 1 3 565 1 1 1 ILE CB C -11.007 7.449 -1.951 1.00 . A A . 1 ILE CB 1 1 3 566 1 1 1 ILE CD1 C -9.870 9.195 -3.331 1.00 . A A . 1 ILE CD1 1 1 3 567 1 1 1 ILE CG1 C -10.089 8.672 -1.910 1.00 . A A . 1 ILE CG1 1 1 3 568 1 1 1 ILE CG2 C -12.434 7.894 -2.271 1.00 . A A . 1 ILE CG2 1 1 3 569 1 1 1 ILE H1 H -11.528 7.464 1.291 1.00 . A A . 1 ILE H1 1 1 3 570 1 1 1 ILE H2 H -11.783 8.574 0.030 1.00 . A A . 1 ILE H2 1 1 3 571 1 1 1 ILE H3 H -10.210 8.277 0.601 1.00 . A A . 1 ILE H3 1 1 3 572 1 1 1 ILE HA H -11.805 6.058 -0.517 1.00 . A A . 1 ILE HA 1 1 3 573 1 1 1 ILE HB H -10.664 6.763 -2.712 1.00 . A A . 1 ILE HB 1 1 3 574 1 1 1 ILE HD11 H -8.995 8.727 -3.757 1.00 . A A . 1 ILE HD11 1 1 3 575 1 1 1 ILE HD12 H -9.729 10.266 -3.302 1.00 . A A . 1 ILE HD12 1 1 3 576 1 1 1 ILE HD13 H -10.733 8.962 -3.937 1.00 . A A . 1 ILE HD13 1 1 3 577 1 1 1 ILE HG12 H -10.545 9.445 -1.307 1.00 . A A . 1 ILE HG12 1 1 3 578 1 1 1 ILE HG13 H -9.137 8.395 -1.481 1.00 . A A . 1 ILE HG13 1 1 3 579 1 1 1 ILE HG21 H -13.060 7.757 -1.402 1.00 . A A . 1 ILE HG21 1 1 3 580 1 1 1 ILE HG22 H -12.820 7.302 -3.089 1.00 . A A . 1 ILE HG22 1 1 3 581 1 1 1 ILE HG23 H -12.431 8.937 -2.551 1.00 . A A . 1 ILE HG23 1 1 3 582 1 1 1 ILE N N -11.137 7.850 0.408 1.00 . A A . 1 ILE N 1 1 3 583 1 1 1 ILE O O -8.592 6.618 -0.477 1.00 . A A . 1 ILE O 1 1 3 584 1 1 2 LEU C C -8.744 2.593 0.646 1.00 . A A . 2 LEU C 1 1 3 585 1 1 2 LEU CA C -8.430 3.995 0.120 1.00 . A A . 2 LEU CA 1 1 3 586 1 1 2 LEU CB C -7.651 4.800 1.162 1.00 . A A . 2 LEU CB 1 1 3 587 1 1 2 LEU CD1 C -5.503 5.990 1.623 1.00 . A A . 2 LEU CD1 1 1 3 588 1 1 2 LEU CD2 C -5.566 4.117 -0.028 1.00 . A A . 2 LEU CD2 1 1 3 589 1 1 2 LEU CG C -6.345 5.302 0.547 1.00 . A A . 2 LEU CG 1 1 3 590 1 1 2 LEU H H -10.559 4.302 -0.022 1.00 . A A . 2 LEU H 1 1 3 591 1 1 2 LEU HA H -7.866 3.934 -0.797 1.00 . A A . 2 LEU HA 1 1 3 592 1 1 2 LEU HB2 H -8.246 5.644 1.483 1.00 . A A . 2 LEU HB2 1 1 3 593 1 1 2 LEU HB3 H -7.430 4.171 2.010 1.00 . A A . 2 LEU HB3 1 1 3 594 1 1 2 LEU HD11 H -5.890 5.737 2.599 1.00 . A A . 2 LEU HD11 1 1 3 595 1 1 2 LEU HD12 H -5.546 7.060 1.485 1.00 . A A . 2 LEU HD12 1 1 3 596 1 1 2 LEU HD13 H -4.478 5.657 1.546 1.00 . A A . 2 LEU HD13 1 1 3 597 1 1 2 LEU HD21 H -5.230 4.357 -1.027 1.00 . A A . 2 LEU HD21 1 1 3 598 1 1 2 LEU HD22 H -6.206 3.247 -0.063 1.00 . A A . 2 LEU HD22 1 1 3 599 1 1 2 LEU HD23 H -4.710 3.910 0.598 1.00 . A A . 2 LEU HD23 1 1 3 600 1 1 2 LEU HG H -6.565 6.007 -0.241 1.00 . A A . 2 LEU HG 1 1 3 601 1 1 2 LEU N N -9.694 4.758 -0.095 1.00 . A A . 2 LEU N 1 1 3 602 1 1 2 LEU O O -9.069 2.410 1.801 1.00 . A A . 2 LEU O 1 1 3 603 1 1 3 LYS C C -8.651 -0.773 -0.890 1.00 . A A . 3 LYS C 1 1 3 604 1 1 3 LYS CA C -8.941 0.214 0.244 1.00 . A A . 3 LYS CA 1 1 3 605 1 1 3 LYS CB C -10.431 0.213 0.589 1.00 . A A . 3 LYS CB 1 1 3 606 1 1 3 LYS CD C -12.666 0.348 -0.522 1.00 . A A . 3 LYS CD 1 1 3 607 1 1 3 LYS CE C -13.483 1.220 0.433 1.00 . A A . 3 LYS CE 1 1 3 608 1 1 3 LYS CG C -11.221 0.846 -0.559 1.00 . A A . 3 LYS CG 1 1 3 609 1 1 3 LYS H H -8.385 1.782 -1.126 1.00 . A A . 3 LYS H 1 1 3 610 1 1 3 LYS HA H -8.361 -0.033 1.119 1.00 . A A . 3 LYS HA 1 1 3 611 1 1 3 LYS HB2 H -10.765 -0.804 0.739 1.00 . A A . 3 LYS HB2 1 1 3 612 1 1 3 LYS HB3 H -10.593 0.783 1.490 1.00 . A A . 3 LYS HB3 1 1 3 613 1 1 3 LYS HD2 H -13.092 0.401 -1.514 1.00 . A A . 3 LYS HD2 1 1 3 614 1 1 3 LYS HD3 H -12.686 -0.676 -0.177 1.00 . A A . 3 LYS HD3 1 1 3 615 1 1 3 LYS HE2 H -13.051 1.199 1.424 1.00 . A A . 3 LYS HE2 1 1 3 616 1 1 3 LYS HE3 H -13.537 2.233 0.066 1.00 . A A . 3 LYS HE3 1 1 3 617 1 1 3 LYS HG2 H -11.207 1.921 -0.454 1.00 . A A . 3 LYS HG2 1 1 3 618 1 1 3 LYS HG3 H -10.772 0.569 -1.500 1.00 . A A . 3 LYS HG3 1 1 3 619 1 1 3 LYS HZ1 H -15.559 1.357 0.525 1.00 . A A . 3 LYS HZ1 1 1 3 620 1 1 3 LYS HZ2 H -14.924 -0.039 1.254 1.00 . A A . 3 LYS HZ2 1 1 3 621 1 1 3 LYS HZ3 H -14.994 0.083 -0.440 1.00 . A A . 3 LYS HZ3 1 1 3 622 1 1 3 LYS N N -8.649 1.607 -0.198 1.00 . A A . 3 LYS N 1 1 3 623 1 1 3 LYS NZ N -14.842 0.609 0.443 1.00 . A A . 3 LYS NZ 1 1 3 624 1 1 3 LYS O O -9.550 -1.356 -1.462 1.00 . A A . 3 LYS O 1 1 3 625 1 1 4 LYS C C -5.949 -2.855 -1.856 1.00 . A A . 4 LYS C 1 1 3 626 1 1 4 LYS CA C -7.057 -1.915 -2.313 1.00 . A A . 4 LYS CA 1 1 3 627 1 1 4 LYS CB C -6.576 -1.036 -3.460 1.00 . A A . 4 LYS CB 1 1 3 628 1 1 4 LYS CD C -7.229 0.010 -5.633 1.00 . A A . 4 LYS CD 1 1 3 629 1 1 4 LYS CE C -7.741 -0.458 -6.997 1.00 . A A . 4 LYS CE 1 1 3 630 1 1 4 LYS CG C -7.639 -1.000 -4.559 1.00 . A A . 4 LYS CG 1 1 3 631 1 1 4 LYS H H -6.692 -0.488 -0.742 1.00 . A A . 4 LYS H 1 1 3 632 1 1 4 LYS HA H -7.925 -2.478 -2.609 1.00 . A A . 4 LYS HA 1 1 3 633 1 1 4 LYS HB2 H -6.403 -0.038 -3.090 1.00 . A A . 4 LYS HB2 1 1 3 634 1 1 4 LYS HB3 H -5.659 -1.435 -3.861 1.00 . A A . 4 LYS HB3 1 1 3 635 1 1 4 LYS HD2 H -7.654 0.976 -5.400 1.00 . A A . 4 LYS HD2 1 1 3 636 1 1 4 LYS HD3 H -6.152 0.088 -5.661 1.00 . A A . 4 LYS HD3 1 1 3 637 1 1 4 LYS HE2 H -7.291 0.128 -7.786 1.00 . A A . 4 LYS HE2 1 1 3 638 1 1 4 LYS HE3 H -7.530 -1.506 -7.138 1.00 . A A . 4 LYS HE3 1 1 3 639 1 1 4 LYS HG2 H -7.731 -1.980 -5.002 1.00 . A A . 4 LYS HG2 1 1 3 640 1 1 4 LYS HG3 H -8.586 -0.705 -4.135 1.00 . A A . 4 LYS HG3 1 1 3 641 1 1 4 LYS HZ1 H -9.419 0.757 -7.190 1.00 . A A . 4 LYS HZ1 1 1 3 642 1 1 4 LYS HZ2 H -9.566 -0.444 -5.996 1.00 . A A . 4 LYS HZ2 1 1 3 643 1 1 4 LYS HZ3 H -9.679 -0.859 -7.639 1.00 . A A . 4 LYS HZ3 1 1 3 644 1 1 4 LYS N N -7.403 -0.966 -1.216 1.00 . A A . 4 LYS N 1 1 3 645 1 1 4 LYS NZ N -9.213 -0.234 -6.953 1.00 . A A . 4 LYS NZ 1 1 3 646 1 1 4 LYS O O -4.842 -2.832 -2.358 1.00 . A A . 4 LYS O 1 1 3 647 1 1 5 TRP C C -3.931 -3.919 -0.069 1.00 . A A . 5 TRP C 1 1 3 648 1 1 5 TRP CA C -5.238 -4.647 -0.393 1.00 . A A . 5 TRP CA 1 1 3 649 1 1 5 TRP CB C -5.029 -5.643 -1.532 1.00 . A A . 5 TRP CB 1 1 3 650 1 1 5 TRP CD1 C -7.067 -6.874 -2.381 1.00 . A A . 5 TRP CD1 1 1 3 651 1 1 5 TRP CD2 C -6.276 -7.729 -0.457 1.00 . A A . 5 TRP CD2 1 1 3 652 1 1 5 TRP CE2 C -7.404 -8.506 -0.812 1.00 . A A . 5 TRP CE2 1 1 3 653 1 1 5 TRP CE3 C -5.589 -8.062 0.723 1.00 . A A . 5 TRP CE3 1 1 3 654 1 1 5 TRP CG C -6.084 -6.700 -1.468 1.00 . A A . 5 TRP CG 1 1 3 655 1 1 5 TRP CH2 C -7.139 -9.890 1.146 1.00 . A A . 5 TRP CH2 1 1 3 656 1 1 5 TRP CZ2 C -7.834 -9.575 -0.024 1.00 . A A . 5 TRP CZ2 1 1 3 657 1 1 5 TRP CZ3 C -6.018 -9.135 1.520 1.00 . A A . 5 TRP CZ3 1 1 3 658 1 1 5 TRP H H -7.154 -3.671 -0.535 1.00 . A A . 5 TRP H 1 1 3 659 1 1 5 TRP HA H -5.612 -5.158 0.480 1.00 . A A . 5 TRP HA 1 1 3 660 1 1 5 TRP HB2 H -5.094 -5.125 -2.476 1.00 . A A . 5 TRP HB2 1 1 3 661 1 1 5 TRP HB3 H -4.056 -6.100 -1.435 1.00 . A A . 5 TRP HB3 1 1 3 662 1 1 5 TRP HD1 H -7.216 -6.275 -3.266 1.00 . A A . 5 TRP HD1 1 1 3 663 1 1 5 TRP HE1 H -8.633 -8.281 -2.481 1.00 . A A . 5 TRP HE1 1 1 3 664 1 1 5 TRP HE3 H -4.724 -7.485 1.019 1.00 . A A . 5 TRP HE3 1 1 3 665 1 1 5 TRP HH2 H -7.465 -10.716 1.762 1.00 . A A . 5 TRP HH2 1 1 3 666 1 1 5 TRP HZ2 H -8.699 -10.153 -0.317 1.00 . A A . 5 TRP HZ2 1 1 3 667 1 1 5 TRP HZ3 H -5.483 -9.382 2.425 1.00 . A A . 5 TRP HZ3 1 1 3 668 1 1 5 TRP N N -6.253 -3.684 -0.909 1.00 . A A . 5 TRP N 1 1 3 669 1 1 5 TRP NE1 N -7.852 -7.946 -1.992 1.00 . A A . 5 TRP NE1 1 1 3 670 1 1 5 TRP O O -3.157 -3.609 -0.952 1.00 . A A . 5 TRP O 1 1 3 671 1 1 6 PRO C C -1.290 -3.902 1.540 1.00 . A A . 6 PRO C 1 1 3 672 1 1 6 PRO CA C -2.503 -2.976 1.651 1.00 . A A . 6 PRO CA 1 1 3 673 1 1 6 PRO CB C -2.803 -2.637 3.106 1.00 . A A . 6 PRO CB 1 1 3 674 1 1 6 PRO CD C -4.616 -4.021 2.313 1.00 . A A . 6 PRO CD 1 1 3 675 1 1 6 PRO CG C -3.823 -3.644 3.537 1.00 . A A . 6 PRO CG 1 1 3 676 1 1 6 PRO HA H -2.346 -2.072 1.085 1.00 . A A . 6 PRO HA 1 1 3 677 1 1 6 PRO HB2 H -1.904 -2.727 3.703 1.00 . A A . 6 PRO HB2 1 1 3 678 1 1 6 PRO HB3 H -3.209 -1.642 3.183 1.00 . A A . 6 PRO HB3 1 1 3 679 1 1 6 PRO HD2 H -4.832 -5.080 2.314 1.00 . A A . 6 PRO HD2 1 1 3 680 1 1 6 PRO HD3 H -5.526 -3.445 2.257 1.00 . A A . 6 PRO HD3 1 1 3 681 1 1 6 PRO HG2 H -3.330 -4.515 3.944 1.00 . A A . 6 PRO HG2 1 1 3 682 1 1 6 PRO HG3 H -4.479 -3.211 4.276 1.00 . A A . 6 PRO HG3 1 1 3 683 1 1 6 PRO N N -3.730 -3.674 1.196 1.00 . A A . 6 PRO N 1 1 3 684 1 1 6 PRO O O -0.888 -4.533 2.498 1.00 . A A . 6 PRO O 1 1 3 685 1 1 7 TRP C C 1.617 -4.101 -0.462 1.00 . A A . 7 TRP C 1 1 3 686 1 1 7 TRP CA C 0.477 -4.873 0.200 1.00 . A A . 7 TRP CA 1 1 3 687 1 1 7 TRP CB C 0.000 -5.995 -0.712 1.00 . A A . 7 TRP CB 1 1 3 688 1 1 7 TRP CD1 C -1.394 -7.748 0.455 1.00 . A A . 7 TRP CD1 1 1 3 689 1 1 7 TRP CD2 C 0.815 -8.144 0.627 1.00 . A A . 7 TRP CD2 1 1 3 690 1 1 7 TRP CE2 C 0.160 -9.190 1.318 1.00 . A A . 7 TRP CE2 1 1 3 691 1 1 7 TRP CE3 C 2.220 -8.155 0.583 1.00 . A A . 7 TRP CE3 1 1 3 692 1 1 7 TRP CG C -0.195 -7.241 0.089 1.00 . A A . 7 TRP CG 1 1 3 693 1 1 7 TRP CH2 C 2.270 -10.208 1.890 1.00 . A A . 7 TRP CH2 1 1 3 694 1 1 7 TRP CZ2 C 0.874 -10.212 1.944 1.00 . A A . 7 TRP CZ2 1 1 3 695 1 1 7 TRP CZ3 C 2.943 -9.183 1.212 1.00 . A A . 7 TRP CZ3 1 1 3 696 1 1 7 TRP H H -1.053 -3.469 -0.377 1.00 . A A . 7 TRP H 1 1 3 697 1 1 7 TRP HA H 0.796 -5.274 1.147 1.00 . A A . 7 TRP HA 1 1 3 698 1 1 7 TRP HB2 H -0.934 -5.709 -1.170 1.00 . A A . 7 TRP HB2 1 1 3 699 1 1 7 TRP HB3 H 0.740 -6.171 -1.479 1.00 . A A . 7 TRP HB3 1 1 3 700 1 1 7 TRP HD1 H -2.356 -7.319 0.217 1.00 . A A . 7 TRP HD1 1 1 3 701 1 1 7 TRP HE1 H -1.890 -9.466 1.569 1.00 . A A . 7 TRP HE1 1 1 3 702 1 1 7 TRP HE3 H 2.749 -7.368 0.062 1.00 . A A . 7 TRP HE3 1 1 3 703 1 1 7 TRP HH2 H 2.831 -10.996 2.372 1.00 . A A . 7 TRP HH2 1 1 3 704 1 1 7 TRP HZ2 H 0.352 -11.000 2.466 1.00 . A A . 7 TRP HZ2 1 1 3 705 1 1 7 TRP HZ3 H 4.021 -9.183 1.172 1.00 . A A . 7 TRP HZ3 1 1 3 706 1 1 7 TRP N N -0.709 -3.988 0.378 1.00 . A A . 7 TRP N 1 1 3 707 1 1 7 TRP NE1 N -1.186 -8.904 1.185 1.00 . A A . 7 TRP NE1 1 1 3 708 1 1 7 TRP O O 2.095 -4.458 -1.521 1.00 . A A . 7 TRP O 1 1 3 709 1 1 8 TRP C C 4.104 -1.759 0.680 1.00 . A A . 8 TRP C 1 1 3 710 1 1 8 TRP CA C 3.162 -2.245 -0.425 1.00 . A A . 8 TRP CA 1 1 3 711 1 1 8 TRP CB C 2.484 -1.061 -1.109 1.00 . A A . 8 TRP CB 1 1 3 712 1 1 8 TRP CD1 C 4.059 0.630 -2.126 1.00 . A A . 8 TRP CD1 1 1 3 713 1 1 8 TRP CD2 C 3.696 -1.134 -3.474 1.00 . A A . 8 TRP CD2 1 1 3 714 1 1 8 TRP CE2 C 4.584 -0.274 -4.162 1.00 . A A . 8 TRP CE2 1 1 3 715 1 1 8 TRP CE3 C 3.305 -2.327 -4.108 1.00 . A A . 8 TRP CE3 1 1 3 716 1 1 8 TRP CG C 3.375 -0.536 -2.185 1.00 . A A . 8 TRP CG 1 1 3 717 1 1 8 TRP CH2 C 4.670 -1.775 -6.049 1.00 . A A . 8 TRP CH2 1 1 3 718 1 1 8 TRP CZ2 C 5.068 -0.586 -5.433 1.00 . A A . 8 TRP CZ2 1 1 3 719 1 1 8 TRP CZ3 C 3.789 -2.644 -5.388 1.00 . A A . 8 TRP CZ3 1 1 3 720 1 1 8 TRP H H 1.652 -2.785 1.005 1.00 . A A . 8 TRP H 1 1 3 721 1 1 8 TRP HA H 3.701 -2.827 -1.150 1.00 . A A . 8 TRP HA 1 1 3 722 1 1 8 TRP HB2 H 1.547 -1.382 -1.541 1.00 . A A . 8 TRP HB2 1 1 3 723 1 1 8 TRP HB3 H 2.298 -0.283 -0.383 1.00 . A A . 8 TRP HB3 1 1 3 724 1 1 8 TRP HD1 H 4.046 1.322 -1.299 1.00 . A A . 8 TRP HD1 1 1 3 725 1 1 8 TRP HE1 H 5.352 1.551 -3.510 1.00 . A A . 8 TRP HE1 1 1 3 726 1 1 8 TRP HE3 H 2.628 -3.003 -3.607 1.00 . A A . 8 TRP HE3 1 1 3 727 1 1 8 TRP HH2 H 5.037 -2.025 -7.032 1.00 . A A . 8 TRP HH2 1 1 3 728 1 1 8 TRP HZ2 H 5.744 0.088 -5.938 1.00 . A A . 8 TRP HZ2 1 1 3 729 1 1 8 TRP HZ3 H 3.483 -3.563 -5.865 1.00 . A A . 8 TRP HZ3 1 1 3 730 1 1 8 TRP N N 2.053 -3.047 0.156 1.00 . A A . 8 TRP N 1 1 3 731 1 1 8 TRP NE1 N 4.776 0.788 -3.298 1.00 . A A . 8 TRP NE1 1 1 3 732 1 1 8 TRP O O 3.759 -0.890 1.456 1.00 . A A . 8 TRP O 1 1 3 733 1 1 9 PRO C C 7.131 -0.804 1.228 1.00 . A A . 9 PRO C 1 1 3 734 1 1 9 PRO CA C 6.287 -1.981 1.718 1.00 . A A . 9 PRO CA 1 1 3 735 1 1 9 PRO CB C 7.128 -3.244 1.829 1.00 . A A . 9 PRO CB 1 1 3 736 1 1 9 PRO CD C 5.749 -3.394 -0.186 1.00 . A A . 9 PRO CD 1 1 3 737 1 1 9 PRO CG C 6.963 -3.962 0.517 1.00 . A A . 9 PRO CG 1 1 3 738 1 1 9 PRO HA H 5.824 -1.755 2.662 1.00 . A A . 9 PRO HA 1 1 3 739 1 1 9 PRO HB2 H 8.167 -2.987 1.989 1.00 . A A . 9 PRO HB2 1 1 3 740 1 1 9 PRO HB3 H 6.766 -3.863 2.632 1.00 . A A . 9 PRO HB3 1 1 3 741 1 1 9 PRO HD2 H 6.030 -2.980 -1.143 1.00 . A A . 9 PRO HD2 1 1 3 742 1 1 9 PRO HD3 H 4.990 -4.151 -0.308 1.00 . A A . 9 PRO HD3 1 1 3 743 1 1 9 PRO HG2 H 7.843 -3.814 -0.092 1.00 . A A . 9 PRO HG2 1 1 3 744 1 1 9 PRO HG3 H 6.817 -5.017 0.695 1.00 . A A . 9 PRO HG3 1 1 3 745 1 1 9 PRO N N 5.271 -2.344 0.709 1.00 . A A . 9 PRO N 1 1 3 746 1 1 9 PRO O O 8.299 -0.689 1.540 1.00 . A A . 9 PRO O 1 1 3 747 1 1 10 TRP C C 6.831 2.516 0.633 1.00 . A A . 10 TRP C 1 1 3 748 1 1 10 TRP CA C 7.295 1.235 -0.058 1.00 . A A . 10 TRP CA 1 1 3 749 1 1 10 TRP CB C 6.955 1.275 -1.545 1.00 . A A . 10 TRP CB 1 1 3 750 1 1 10 TRP CD1 C 9.057 2.403 -2.395 1.00 . A A . 10 TRP CD1 1 1 3 751 1 1 10 TRP CD2 C 8.778 0.326 -3.202 1.00 . A A . 10 TRP CD2 1 1 3 752 1 1 10 TRP CE2 C 9.979 0.815 -3.762 1.00 . A A . 10 TRP CE2 1 1 3 753 1 1 10 TRP CE3 C 8.359 -0.965 -3.542 1.00 . A A . 10 TRP CE3 1 1 3 754 1 1 10 TRP CG C 8.213 1.346 -2.343 1.00 . A A . 10 TRP CG 1 1 3 755 1 1 10 TRP CH2 C 10.312 -1.248 -4.968 1.00 . A A . 10 TRP CH2 1 1 3 756 1 1 10 TRP CZ2 C 10.743 0.042 -4.637 1.00 . A A . 10 TRP CZ2 1 1 3 757 1 1 10 TRP CZ3 C 9.122 -1.751 -4.422 1.00 . A A . 10 TRP CZ3 1 1 3 758 1 1 10 TRP H H 5.608 -0.053 0.225 1.00 . A A . 10 TRP H 1 1 3 759 1 1 10 TRP HA H 8.349 1.093 0.074 1.00 . A A . 10 TRP HA 1 1 3 760 1 1 10 TRP HB2 H 6.413 0.382 -1.811 1.00 . A A . 10 TRP HB2 1 1 3 761 1 1 10 TRP HB3 H 6.346 2.137 -1.754 1.00 . A A . 10 TRP HB3 1 1 3 762 1 1 10 TRP HD1 H 8.931 3.336 -1.866 1.00 . A A . 10 TRP HD1 1 1 3 763 1 1 10 TRP HE1 H 10.860 2.681 -3.454 1.00 . A A . 10 TRP HE1 1 1 3 764 1 1 10 TRP HE3 H 7.443 -1.352 -3.121 1.00 . A A . 10 TRP HE3 1 1 3 765 1 1 10 TRP HH2 H 10.896 -1.856 -5.644 1.00 . A A . 10 TRP HH2 1 1 3 766 1 1 10 TRP HZ2 H 11.658 0.434 -5.054 1.00 . A A . 10 TRP HZ2 1 1 3 767 1 1 10 TRP HZ3 H 8.792 -2.746 -4.678 1.00 . A A . 10 TRP HZ3 1 1 3 768 1 1 10 TRP N N 6.543 0.065 0.463 1.00 . A A . 10 TRP N 1 1 3 769 1 1 10 TRP NE1 N 10.108 2.088 -3.240 1.00 . A A . 10 TRP NE1 1 1 3 770 1 1 10 TRP O O 7.580 3.167 1.334 1.00 . A A . 10 TRP O 1 1 3 771 1 1 11 ARG C C 3.792 3.794 1.852 1.00 . A A . 11 ARG C 1 1 3 772 1 1 11 ARG CA C 5.066 4.113 1.072 1.00 . A A . 11 ARG CA 1 1 3 773 1 1 11 ARG CB C 4.762 5.071 -0.084 1.00 . A A . 11 ARG CB 1 1 3 774 1 1 11 ARG CD C 3.378 5.177 -2.165 1.00 . A A . 11 ARG CD 1 1 3 775 1 1 11 ARG CG C 4.300 4.293 -1.323 1.00 . A A . 11 ARG CG 1 1 3 776 1 1 11 ARG CZ C 4.058 6.525 -4.058 1.00 . A A . 11 ARG CZ 1 1 3 777 1 1 11 ARG H H 5.016 2.346 -0.127 1.00 . A A . 11 ARG H 1 1 3 778 1 1 11 ARG HA H 5.804 4.542 1.724 1.00 . A A . 11 ARG HA 1 1 3 779 1 1 11 ARG HB2 H 3.980 5.742 0.218 1.00 . A A . 11 ARG HB2 1 1 3 780 1 1 11 ARG HB3 H 5.649 5.636 -0.326 1.00 . A A . 11 ARG HB3 1 1 3 781 1 1 11 ARG HD2 H 2.862 4.579 -2.905 1.00 . A A . 11 ARG HD2 1 1 3 782 1 1 11 ARG HD3 H 2.671 5.692 -1.536 1.00 . A A . 11 ARG HD3 1 1 3 783 1 1 11 ARG HE H 5.046 6.528 -2.335 1.00 . A A . 11 ARG HE 1 1 3 784 1 1 11 ARG HG2 H 5.162 4.008 -1.911 1.00 . A A . 11 ARG HG2 1 1 3 785 1 1 11 ARG HG3 H 3.765 3.408 -1.015 1.00 . A A . 11 ARG HG3 1 1 3 786 1 1 11 ARG HH11 H 4.749 4.822 -4.852 1.00 . A A . 11 ARG HH11 1 1 3 787 1 1 11 ARG HH12 H 4.180 6.001 -5.987 1.00 . A A . 11 ARG HH12 1 1 3 788 1 1 11 ARG HH21 H 3.316 8.314 -3.552 1.00 . A A . 11 ARG HH21 1 1 3 789 1 1 11 ARG HH22 H 3.368 7.978 -5.250 1.00 . A A . 11 ARG HH22 1 1 3 790 1 1 11 ARG N N 5.597 2.880 0.439 1.00 . A A . 11 ARG N 1 1 3 791 1 1 11 ARG NE N 4.282 6.158 -2.826 1.00 . A A . 11 ARG NE 1 1 3 792 1 1 11 ARG NH1 N 4.352 5.720 -5.042 1.00 . A A . 11 ARG NH1 1 1 3 793 1 1 11 ARG NH2 N 3.540 7.696 -4.306 1.00 . A A . 11 ARG NH2 1 1 3 794 1 1 11 ARG O O 2.720 4.271 1.539 1.00 . A A . 11 ARG O 1 1 3 795 1 1 12 ARG C C 2.709 3.409 4.995 1.00 . A A . 12 ARG C 1 1 3 796 1 1 12 ARG CA C 2.707 2.628 3.677 1.00 . A A . 12 ARG CA 1 1 3 797 1 1 12 ARG CB C 2.840 1.129 3.940 1.00 . A A . 12 ARG CB 1 1 3 798 1 1 12 ARG CD C 4.181 -0.506 5.273 1.00 . A A . 12 ARG CD 1 1 3 799 1 1 12 ARG CG C 4.220 0.831 4.530 1.00 . A A . 12 ARG CG 1 1 3 800 1 1 12 ARG CZ C 6.021 -1.080 6.738 1.00 . A A . 12 ARG CZ 1 1 3 801 1 1 12 ARG H H 4.785 2.618 3.094 1.00 . A A . 12 ARG H 1 1 3 802 1 1 12 ARG HA H 1.805 2.829 3.122 1.00 . A A . 12 ARG HA 1 1 3 803 1 1 12 ARG HB2 H 2.075 0.817 4.637 1.00 . A A . 12 ARG HB2 1 1 3 804 1 1 12 ARG HB3 H 2.724 0.589 3.011 1.00 . A A . 12 ARG HB3 1 1 3 805 1 1 12 ARG HD2 H 3.164 -0.754 5.545 1.00 . A A . 12 ARG HD2 1 1 3 806 1 1 12 ARG HD3 H 4.610 -1.286 4.665 1.00 . A A . 12 ARG HD3 1 1 3 807 1 1 12 ARG HE H 4.798 0.439 7.107 1.00 . A A . 12 ARG HE 1 1 3 808 1 1 12 ARG HG2 H 4.948 0.780 3.733 1.00 . A A . 12 ARG HG2 1 1 3 809 1 1 12 ARG HG3 H 4.494 1.616 5.219 1.00 . A A . 12 ARG HG3 1 1 3 810 1 1 12 ARG HH11 H 6.758 -0.972 4.880 1.00 . A A . 12 ARG HH11 1 1 3 811 1 1 12 ARG HH12 H 7.651 -1.965 5.984 1.00 . A A . 12 ARG HH12 1 1 3 812 1 1 12 ARG HH21 H 5.520 -1.373 8.655 1.00 . A A . 12 ARG HH21 1 1 3 813 1 1 12 ARG HH22 H 6.951 -2.192 8.119 1.00 . A A . 12 ARG HH22 1 1 3 814 1 1 12 ARG N N 3.907 2.987 2.866 1.00 . A A . 12 ARG N 1 1 3 815 1 1 12 ARG NE N 5.010 -0.292 6.491 1.00 . A A . 12 ARG NE 1 1 3 816 1 1 12 ARG NH1 N 6.876 -1.362 5.794 1.00 . A A . 12 ARG NH1 1 1 3 817 1 1 12 ARG NH2 N 6.176 -1.588 7.930 1.00 . A A . 12 ARG NH2 1 1 3 818 1 1 12 ARG O O 2.906 2.852 6.055 1.00 . A A . 12 ARG O 1 1 3 819 1 1 13 LYS C C 1.794 6.854 5.932 1.00 . A A . 13 LYS C 1 1 3 820 1 1 13 LYS CA C 2.480 5.508 6.183 1.00 . A A . 13 LYS CA 1 1 3 821 1 1 13 LYS CB C 3.953 5.714 6.535 1.00 . A A . 13 LYS CB 1 1 3 822 1 1 13 LYS CD C 5.113 6.546 8.586 1.00 . A A . 13 LYS CD 1 1 3 823 1 1 13 LYS CE C 6.537 5.985 8.618 1.00 . A A . 13 LYS CE 1 1 3 824 1 1 13 LYS CG C 4.158 5.487 8.033 1.00 . A A . 13 LYS CG 1 1 3 825 1 1 13 LYS H H 2.334 5.124 4.068 1.00 . A A . 13 LYS H 1 1 3 826 1 1 13 LYS HA H 1.982 4.974 6.977 1.00 . A A . 13 LYS HA 1 1 3 827 1 1 13 LYS HB2 H 4.557 5.012 5.977 1.00 . A A . 13 LYS HB2 1 1 3 828 1 1 13 LYS HB3 H 4.247 6.722 6.282 1.00 . A A . 13 LYS HB3 1 1 3 829 1 1 13 LYS HD2 H 5.084 7.421 7.953 1.00 . A A . 13 LYS HD2 1 1 3 830 1 1 13 LYS HD3 H 4.813 6.814 9.587 1.00 . A A . 13 LYS HD3 1 1 3 831 1 1 13 LYS HE2 H 6.775 5.624 9.609 1.00 . A A . 13 LYS HE2 1 1 3 832 1 1 13 LYS HE3 H 6.646 5.194 7.892 1.00 . A A . 13 LYS HE3 1 1 3 833 1 1 13 LYS HG2 H 3.206 5.557 8.541 1.00 . A A . 13 LYS HG2 1 1 3 834 1 1 13 LYS HG3 H 4.580 4.506 8.195 1.00 . A A . 13 LYS HG3 1 1 3 835 1 1 13 LYS HZ1 H 6.965 7.685 7.497 1.00 . A A . 13 LYS HZ1 1 1 3 836 1 1 13 LYS HZ2 H 8.335 6.780 7.933 1.00 . A A . 13 LYS HZ2 1 1 3 837 1 1 13 LYS HZ3 H 7.546 7.744 9.089 1.00 . A A . 13 LYS HZ3 1 1 3 838 1 1 13 LYS N N 2.490 4.694 4.934 1.00 . A A . 13 LYS N 1 1 3 839 1 1 13 LYS NZ N 7.411 7.135 8.257 1.00 . A A . 13 LYS NZ 1 1 3 840 1 1 13 LYS O O 2.373 7.899 6.154 1.00 . A A . 13 LYS O 1 1 3 841 1 1 14 NH2 HN1 H 0.104 6.030 5.291 1.00 . A A . 14 NH2 HN1 1 1 3 842 1 1 14 NH2 HN2 H 0.124 7.728 5.307 1.00 . A A . 14 NH2 HN2 1 1 3 843 1 1 14 NH2 N N 0.573 6.873 5.472 1.00 . A A . 14 NH2 N 1 1 4 844 1 1 1 ILE C C -6.649 -1.993 -8.029 1.00 . A A . 1 ILE C 1 1 4 845 1 1 1 ILE CA C -5.389 -2.684 -8.560 1.00 . A A . 1 ILE CA 1 1 4 846 1 1 1 ILE CB C -5.000 -2.115 -9.924 1.00 . A A . 1 ILE CB 1 1 4 847 1 1 1 ILE CD1 C -6.016 -1.523 -12.129 1.00 . A A . 1 ILE CD1 1 1 4 848 1 1 1 ILE CG1 C -6.056 -2.509 -10.959 1.00 . A A . 1 ILE CG1 1 1 4 849 1 1 1 ILE CG2 C -3.641 -2.679 -10.344 1.00 . A A . 1 ILE CG2 1 1 4 850 1 1 1 ILE H1 H -6.642 -4.249 -9.129 1.00 . A A . 1 ILE H1 1 1 4 851 1 1 1 ILE H2 H -5.518 -4.665 -7.926 1.00 . A A . 1 ILE H2 1 1 4 852 1 1 1 ILE H3 H -5.013 -4.484 -9.537 1.00 . A A . 1 ILE H3 1 1 4 853 1 1 1 ILE HA H -4.573 -2.567 -7.865 1.00 . A A . 1 ILE HA 1 1 4 854 1 1 1 ILE HB H -4.939 -1.039 -9.860 1.00 . A A . 1 ILE HB 1 1 4 855 1 1 1 ILE HD11 H -5.700 -0.554 -11.773 1.00 . A A . 1 ILE HD11 1 1 4 856 1 1 1 ILE HD12 H -7.001 -1.444 -12.567 1.00 . A A . 1 ILE HD12 1 1 4 857 1 1 1 ILE HD13 H -5.318 -1.878 -12.873 1.00 . A A . 1 ILE HD13 1 1 4 858 1 1 1 ILE HG12 H -5.852 -3.507 -11.320 1.00 . A A . 1 ILE HG12 1 1 4 859 1 1 1 ILE HG13 H -7.034 -2.484 -10.504 1.00 . A A . 1 ILE HG13 1 1 4 860 1 1 1 ILE HG21 H -3.164 -1.994 -11.028 1.00 . A A . 1 ILE HG21 1 1 4 861 1 1 1 ILE HG22 H -3.782 -3.634 -10.828 1.00 . A A . 1 ILE HG22 1 1 4 862 1 1 1 ILE HG23 H -3.019 -2.807 -9.470 1.00 . A A . 1 ILE HG23 1 1 4 863 1 1 1 ILE N N -5.662 -4.130 -8.807 1.00 . A A . 1 ILE N 1 1 4 864 1 1 1 ILE O O -7.757 -2.415 -8.291 1.00 . A A . 1 ILE O 1 1 4 865 1 1 2 LEU C C -8.405 -1.103 -5.730 1.00 . A A . 2 LEU C 1 1 4 866 1 1 2 LEU CA C -7.672 -0.215 -6.736 1.00 . A A . 2 LEU CA 1 1 4 867 1 1 2 LEU CB C -8.561 0.076 -7.947 1.00 . A A . 2 LEU CB 1 1 4 868 1 1 2 LEU CD1 C -8.735 1.906 -9.638 1.00 . A A . 2 LEU CD1 1 1 4 869 1 1 2 LEU CD2 C -9.952 2.094 -7.465 1.00 . A A . 2 LEU CD2 1 1 4 870 1 1 2 LEU CG C -8.677 1.588 -8.143 1.00 . A A . 2 LEU CG 1 1 4 871 1 1 2 LEU H H -5.584 -0.608 -7.084 1.00 . A A . 2 LEU H 1 1 4 872 1 1 2 LEU HA H -7.371 0.707 -6.269 1.00 . A A . 2 LEU HA 1 1 4 873 1 1 2 LEU HB2 H -8.125 -0.370 -8.830 1.00 . A A . 2 LEU HB2 1 1 4 874 1 1 2 LEU HB3 H -9.544 -0.340 -7.780 1.00 . A A . 2 LEU HB3 1 1 4 875 1 1 2 LEU HD11 H -9.335 2.791 -9.794 1.00 . A A . 2 LEU HD11 1 1 4 876 1 1 2 LEU HD12 H -9.175 1.074 -10.166 1.00 . A A . 2 LEU HD12 1 1 4 877 1 1 2 LEU HD13 H -7.736 2.080 -10.008 1.00 . A A . 2 LEU HD13 1 1 4 878 1 1 2 LEU HD21 H -9.792 2.159 -6.398 1.00 . A A . 2 LEU HD21 1 1 4 879 1 1 2 LEU HD22 H -10.762 1.408 -7.665 1.00 . A A . 2 LEU HD22 1 1 4 880 1 1 2 LEU HD23 H -10.203 3.070 -7.851 1.00 . A A . 2 LEU HD23 1 1 4 881 1 1 2 LEU HG H -7.817 2.074 -7.706 1.00 . A A . 2 LEU HG 1 1 4 882 1 1 2 LEU N N -6.486 -0.933 -7.284 1.00 . A A . 2 LEU N 1 1 4 883 1 1 2 LEU O O -9.164 -1.979 -6.093 1.00 . A A . 2 LEU O 1 1 4 884 1 1 3 LYS C C -8.427 -3.169 -3.560 1.00 . A A . 3 LYS C 1 1 4 885 1 1 3 LYS CA C -8.853 -1.706 -3.426 1.00 . A A . 3 LYS CA 1 1 4 886 1 1 3 LYS CB C -10.349 -1.552 -3.700 1.00 . A A . 3 LYS CB 1 1 4 887 1 1 3 LYS CD C -12.163 0.164 -3.614 1.00 . A A . 3 LYS CD 1 1 4 888 1 1 3 LYS CE C -12.349 1.562 -3.017 1.00 . A A . 3 LYS CE 1 1 4 889 1 1 3 LYS CG C -10.681 -0.073 -3.909 1.00 . A A . 3 LYS CG 1 1 4 890 1 1 3 LYS H H -7.559 -0.167 -4.203 1.00 . A A . 3 LYS H 1 1 4 891 1 1 3 LYS HA H -8.617 -1.335 -2.441 1.00 . A A . 3 LYS HA 1 1 4 892 1 1 3 LYS HB2 H -10.613 -2.111 -4.586 1.00 . A A . 3 LYS HB2 1 1 4 893 1 1 3 LYS HB3 H -10.910 -1.928 -2.857 1.00 . A A . 3 LYS HB3 1 1 4 894 1 1 3 LYS HD2 H -12.729 0.086 -4.532 1.00 . A A . 3 LYS HD2 1 1 4 895 1 1 3 LYS HD3 H -12.514 -0.574 -2.911 1.00 . A A . 3 LYS HD3 1 1 4 896 1 1 3 LYS HE2 H -11.536 2.207 -3.318 1.00 . A A . 3 LYS HE2 1 1 4 897 1 1 3 LYS HE3 H -13.296 1.978 -3.322 1.00 . A A . 3 LYS HE3 1 1 4 898 1 1 3 LYS HG2 H -10.081 0.528 -3.242 1.00 . A A . 3 LYS HG2 1 1 4 899 1 1 3 LYS HG3 H -10.471 0.202 -4.931 1.00 . A A . 3 LYS HG3 1 1 4 900 1 1 3 LYS HZ1 H -12.252 2.273 -1.063 1.00 . A A . 3 LYS HZ1 1 1 4 901 1 1 3 LYS HZ2 H -11.522 0.755 -1.286 1.00 . A A . 3 LYS HZ2 1 1 4 902 1 1 3 LYS HZ3 H -13.215 0.887 -1.249 1.00 . A A . 3 LYS HZ3 1 1 4 903 1 1 3 LYS N N -8.178 -0.879 -4.467 1.00 . A A . 3 LYS N 1 1 4 904 1 1 3 LYS NZ N -12.334 1.354 -1.543 1.00 . A A . 3 LYS NZ 1 1 4 905 1 1 3 LYS O O -9.236 -4.043 -3.797 1.00 . A A . 3 LYS O 1 1 4 906 1 1 4 LYS C C -5.636 -5.124 -2.452 1.00 . A A . 4 LYS C 1 1 4 907 1 1 4 LYS CA C -6.674 -4.840 -3.529 1.00 . A A . 4 LYS CA 1 1 4 908 1 1 4 LYS CB C -6.045 -4.920 -4.914 1.00 . A A . 4 LYS CB 1 1 4 909 1 1 4 LYS CD C -6.147 -7.014 -6.275 1.00 . A A . 4 LYS CD 1 1 4 910 1 1 4 LYS CE C -6.762 -8.260 -5.636 1.00 . A A . 4 LYS CE 1 1 4 911 1 1 4 LYS CG C -6.925 -5.774 -5.830 1.00 . A A . 4 LYS CG 1 1 4 912 1 1 4 LYS H H -6.527 -2.714 -3.222 1.00 . A A . 4 LYS H 1 1 4 913 1 1 4 LYS HA H -7.496 -5.533 -3.450 1.00 . A A . 4 LYS HA 1 1 4 914 1 1 4 LYS HB2 H -5.959 -3.926 -5.316 1.00 . A A . 4 LYS HB2 1 1 4 915 1 1 4 LYS HB3 H -5.067 -5.364 -4.837 1.00 . A A . 4 LYS HB3 1 1 4 916 1 1 4 LYS HD2 H -6.193 -7.100 -7.352 1.00 . A A . 4 LYS HD2 1 1 4 917 1 1 4 LYS HD3 H -5.118 -6.924 -5.965 1.00 . A A . 4 LYS HD3 1 1 4 918 1 1 4 LYS HE2 H -5.991 -8.983 -5.405 1.00 . A A . 4 LYS HE2 1 1 4 919 1 1 4 LYS HE3 H -7.311 -7.995 -4.745 1.00 . A A . 4 LYS HE3 1 1 4 920 1 1 4 LYS HG2 H -7.812 -6.078 -5.296 1.00 . A A . 4 LYS HG2 1 1 4 921 1 1 4 LYS HG3 H -7.206 -5.197 -6.697 1.00 . A A . 4 LYS HG3 1 1 4 922 1 1 4 LYS HZ1 H -8.598 -8.293 -6.618 1.00 . A A . 4 LYS HZ1 1 1 4 923 1 1 4 LYS HZ2 H -7.852 -9.815 -6.489 1.00 . A A . 4 LYS HZ2 1 1 4 924 1 1 4 LYS HZ3 H -7.276 -8.676 -7.610 1.00 . A A . 4 LYS HZ3 1 1 4 925 1 1 4 LYS N N -7.160 -3.437 -3.411 1.00 . A A . 4 LYS N 1 1 4 926 1 1 4 LYS NZ N -7.692 -8.801 -6.666 1.00 . A A . 4 LYS NZ 1 1 4 927 1 1 4 LYS O O -4.463 -5.291 -2.720 1.00 . A A . 4 LYS O 1 1 4 928 1 1 5 TRP C C -3.963 -4.463 -0.142 1.00 . A A . 5 TRP C 1 1 4 929 1 1 5 TRP CA C -5.131 -5.451 -0.108 1.00 . A A . 5 TRP CA 1 1 4 930 1 1 5 TRP CB C -4.634 -6.874 -0.348 1.00 . A A . 5 TRP CB 1 1 4 931 1 1 5 TRP CD1 C -6.367 -8.714 -0.347 1.00 . A A . 5 TRP CD1 1 1 4 932 1 1 5 TRP CD2 C -5.798 -8.059 1.727 1.00 . A A . 5 TRP CD2 1 1 4 933 1 1 5 TRP CE2 C -6.765 -9.079 1.875 1.00 . A A . 5 TRP CE2 1 1 4 934 1 1 5 TRP CE3 C -5.271 -7.470 2.890 1.00 . A A . 5 TRP CE3 1 1 4 935 1 1 5 TRP CG C -5.563 -7.844 0.306 1.00 . A A . 5 TRP CG 1 1 4 936 1 1 5 TRP CH2 C -6.660 -8.908 4.280 1.00 . A A . 5 TRP CH2 1 1 4 937 1 1 5 TRP CZ2 C -7.194 -9.504 3.135 1.00 . A A . 5 TRP CZ2 1 1 4 938 1 1 5 TRP CZ3 C -5.700 -7.894 4.159 1.00 . A A . 5 TRP CZ3 1 1 4 939 1 1 5 TRP H H -7.020 -5.039 -1.059 1.00 . A A . 5 TRP H 1 1 4 940 1 1 5 TRP HA H -5.649 -5.395 0.837 1.00 . A A . 5 TRP HA 1 1 4 941 1 1 5 TRP HB2 H -4.600 -7.068 -1.409 1.00 . A A . 5 TRP HB2 1 1 4 942 1 1 5 TRP HB3 H -3.646 -6.984 0.070 1.00 . A A . 5 TRP HB3 1 1 4 943 1 1 5 TRP HD1 H -6.440 -8.818 -1.420 1.00 . A A . 5 TRP HD1 1 1 4 944 1 1 5 TRP HE1 H -7.736 -10.146 0.371 1.00 . A A . 5 TRP HE1 1 1 4 945 1 1 5 TRP HE3 H -4.530 -6.688 2.806 1.00 . A A . 5 TRP HE3 1 1 4 946 1 1 5 TRP HH2 H -6.985 -9.230 5.258 1.00 . A A . 5 TRP HH2 1 1 4 947 1 1 5 TRP HZ2 H -7.934 -10.286 3.223 1.00 . A A . 5 TRP HZ2 1 1 4 948 1 1 5 TRP HZ3 H -5.288 -7.435 5.045 1.00 . A A . 5 TRP HZ3 1 1 4 949 1 1 5 TRP N N -6.070 -5.178 -1.233 1.00 . A A . 5 TRP N 1 1 4 950 1 1 5 TRP NE1 N -7.081 -9.447 0.583 1.00 . A A . 5 TRP NE1 1 1 4 951 1 1 5 TRP O O -3.086 -4.568 -0.973 1.00 . A A . 5 TRP O 1 1 4 952 1 1 6 PRO C C -1.635 -3.135 1.401 1.00 . A A . 6 PRO C 1 1 4 953 1 1 6 PRO CA C -2.923 -2.513 0.859 1.00 . A A . 6 PRO CA 1 1 4 954 1 1 6 PRO CB C -3.484 -1.485 1.833 1.00 . A A . 6 PRO CB 1 1 4 955 1 1 6 PRO CD C -5.019 -3.349 1.807 1.00 . A A . 6 PRO CD 1 1 4 956 1 1 6 PRO CG C -4.473 -2.238 2.666 1.00 . A A . 6 PRO CG 1 1 4 957 1 1 6 PRO HA H -2.753 -2.057 -0.102 1.00 . A A . 6 PRO HA 1 1 4 958 1 1 6 PRO HB2 H -2.694 -1.084 2.453 1.00 . A A . 6 PRO HB2 1 1 4 959 1 1 6 PRO HB3 H -3.980 -0.693 1.296 1.00 . A A . 6 PRO HB3 1 1 4 960 1 1 6 PRO HD2 H -5.143 -4.252 2.390 1.00 . A A . 6 PRO HD2 1 1 4 961 1 1 6 PRO HD3 H -5.953 -3.056 1.354 1.00 . A A . 6 PRO HD3 1 1 4 962 1 1 6 PRO HG2 H -3.982 -2.649 3.538 1.00 . A A . 6 PRO HG2 1 1 4 963 1 1 6 PRO HG3 H -5.276 -1.583 2.968 1.00 . A A . 6 PRO HG3 1 1 4 964 1 1 6 PRO N N -3.994 -3.535 0.775 1.00 . A A . 6 PRO N 1 1 4 965 1 1 6 PRO O O -1.343 -3.059 2.578 1.00 . A A . 6 PRO O 1 1 4 966 1 1 7 TRP C C 1.596 -3.775 0.262 1.00 . A A . 7 TRP C 1 1 4 967 1 1 7 TRP CA C 0.409 -4.375 1.011 1.00 . A A . 7 TRP CA 1 1 4 968 1 1 7 TRP CB C 0.262 -5.856 0.680 1.00 . A A . 7 TRP CB 1 1 4 969 1 1 7 TRP CD1 C -0.875 -6.958 2.650 1.00 . A A . 7 TRP CD1 1 1 4 970 1 1 7 TRP CD2 C 1.357 -7.243 2.670 1.00 . A A . 7 TRP CD2 1 1 4 971 1 1 7 TRP CE2 C 0.852 -7.903 3.816 1.00 . A A . 7 TRP CE2 1 1 4 972 1 1 7 TRP CE3 C 2.745 -7.270 2.446 1.00 . A A . 7 TRP CE3 1 1 4 973 1 1 7 TRP CG C 0.238 -6.651 1.947 1.00 . A A . 7 TRP CG 1 1 4 974 1 1 7 TRP CH2 C 3.073 -8.586 4.469 1.00 . A A . 7 TRP CH2 1 1 4 975 1 1 7 TRP CZ2 C 1.696 -8.568 4.708 1.00 . A A . 7 TRP CZ2 1 1 4 976 1 1 7 TRP CZ3 C 3.597 -7.938 3.342 1.00 . A A . 7 TRP CZ3 1 1 4 977 1 1 7 TRP H H -1.119 -3.795 -0.395 1.00 . A A . 7 TRP H 1 1 4 978 1 1 7 TRP HA H 0.530 -4.241 2.072 1.00 . A A . 7 TRP HA 1 1 4 979 1 1 7 TRP HB2 H -0.658 -6.012 0.139 1.00 . A A . 7 TRP HB2 1 1 4 980 1 1 7 TRP HB3 H 1.097 -6.171 0.073 1.00 . A A . 7 TRP HB3 1 1 4 981 1 1 7 TRP HD1 H -1.883 -6.671 2.388 1.00 . A A . 7 TRP HD1 1 1 4 982 1 1 7 TRP HE1 H -1.132 -8.052 4.433 1.00 . A A . 7 TRP HE1 1 1 4 983 1 1 7 TRP HE3 H 3.159 -6.775 1.581 1.00 . A A . 7 TRP HE3 1 1 4 984 1 1 7 TRP HH2 H 3.733 -9.096 5.155 1.00 . A A . 7 TRP HH2 1 1 4 985 1 1 7 TRP HZ2 H 1.288 -9.064 5.574 1.00 . A A . 7 TRP HZ2 1 1 4 986 1 1 7 TRP HZ3 H 4.661 -7.953 3.160 1.00 . A A . 7 TRP HZ3 1 1 4 987 1 1 7 TRP N N -0.862 -3.748 0.549 1.00 . A A . 7 TRP N 1 1 4 988 1 1 7 TRP NE1 N -0.512 -7.703 3.759 1.00 . A A . 7 TRP NE1 1 1 4 989 1 1 7 TRP O O 2.380 -4.473 -0.352 1.00 . A A . 7 TRP O 1 1 4 990 1 1 8 TRP C C 3.996 -1.533 0.594 1.00 . A A . 8 TRP C 1 1 4 991 1 1 8 TRP CA C 2.859 -1.818 -0.391 1.00 . A A . 8 TRP CA 1 1 4 992 1 1 8 TRP CB C 2.275 -0.515 -0.932 1.00 . A A . 8 TRP CB 1 1 4 993 1 1 8 TRP CD1 C 3.938 1.022 -2.060 1.00 . A A . 8 TRP CD1 1 1 4 994 1 1 8 TRP CD2 C 3.182 -0.593 -3.433 1.00 . A A . 8 TRP CD2 1 1 4 995 1 1 8 TRP CE2 C 4.093 0.187 -4.184 1.00 . A A . 8 TRP CE2 1 1 4 996 1 1 8 TRP CE3 C 2.559 -1.681 -4.069 1.00 . A A . 8 TRP CE3 1 1 4 997 1 1 8 TRP CG C 3.101 -0.040 -2.087 1.00 . A A . 8 TRP CG 1 1 4 998 1 1 8 TRP CH2 C 3.750 -1.190 -6.137 1.00 . A A . 8 TRP CH2 1 1 4 999 1 1 8 TRP CZ2 C 4.377 -0.103 -5.519 1.00 . A A . 8 TRP CZ2 1 1 4 1000 1 1 8 TRP CZ3 C 2.843 -1.977 -5.412 1.00 . A A . 8 TRP CZ3 1 1 4 1001 1 1 8 TRP H H 1.082 -1.956 0.812 1.00 . A A . 8 TRP H 1 1 4 1002 1 1 8 TRP HA H 3.207 -2.432 -1.204 1.00 . A A . 8 TRP HA 1 1 4 1003 1 1 8 TRP HB2 H 1.260 -0.682 -1.261 1.00 . A A . 8 TRP HB2 1 1 4 1004 1 1 8 TRP HB3 H 2.283 0.235 -0.155 1.00 . A A . 8 TRP HB3 1 1 4 1005 1 1 8 TRP HD1 H 4.117 1.659 -1.205 1.00 . A A . 8 TRP HD1 1 1 4 1006 1 1 8 TRP HE1 H 5.174 1.852 -3.549 1.00 . A A . 8 TRP HE1 1 1 4 1007 1 1 8 TRP HE3 H 1.859 -2.294 -3.521 1.00 . A A . 8 TRP HE3 1 1 4 1008 1 1 8 TRP HH2 H 3.964 -1.423 -7.169 1.00 . A A . 8 TRP HH2 1 1 4 1009 1 1 8 TRP HZ2 H 5.076 0.506 -6.072 1.00 . A A . 8 TRP HZ2 1 1 4 1010 1 1 8 TRP HZ3 H 2.359 -2.815 -5.892 1.00 . A A . 8 TRP HZ3 1 1 4 1011 1 1 8 TRP N N 1.728 -2.486 0.311 1.00 . A A . 8 TRP N 1 1 4 1012 1 1 8 TRP NE1 N 4.526 1.158 -3.303 1.00 . A A . 8 TRP NE1 1 1 4 1013 1 1 8 TRP O O 3.862 -0.704 1.471 1.00 . A A . 8 TRP O 1 1 4 1014 1 1 9 PRO C C 7.149 -0.928 0.789 1.00 . A A . 9 PRO C 1 1 4 1015 1 1 9 PRO CA C 6.258 -2.065 1.292 1.00 . A A . 9 PRO CA 1 1 4 1016 1 1 9 PRO CB C 6.971 -3.404 1.178 1.00 . A A . 9 PRO CB 1 1 4 1017 1 1 9 PRO CD C 5.312 -3.250 -0.612 1.00 . A A . 9 PRO CD 1 1 4 1018 1 1 9 PRO CG C 6.559 -3.974 -0.150 1.00 . A A . 9 PRO CG 1 1 4 1019 1 1 9 PRO HA H 5.953 -1.888 2.307 1.00 . A A . 9 PRO HA 1 1 4 1020 1 1 9 PRO HB2 H 8.042 -3.260 1.210 1.00 . A A . 9 PRO HB2 1 1 4 1021 1 1 9 PRO HB3 H 6.659 -4.060 1.972 1.00 . A A . 9 PRO HB3 1 1 4 1022 1 1 9 PRO HD2 H 5.483 -2.786 -1.574 1.00 . A A . 9 PRO HD2 1 1 4 1023 1 1 9 PRO HD3 H 4.475 -3.926 -0.660 1.00 . A A . 9 PRO HD3 1 1 4 1024 1 1 9 PRO HG2 H 7.353 -3.833 -0.870 1.00 . A A . 9 PRO HG2 1 1 4 1025 1 1 9 PRO HG3 H 6.345 -5.027 -0.045 1.00 . A A . 9 PRO HG3 1 1 4 1026 1 1 9 PRO N N 5.082 -2.236 0.414 1.00 . A A . 9 PRO N 1 1 4 1027 1 1 9 PRO O O 8.352 -0.939 0.966 1.00 . A A . 9 PRO O 1 1 4 1028 1 1 10 TRP C C 7.090 2.446 0.459 1.00 . A A . 10 TRP C 1 1 4 1029 1 1 10 TRP CA C 7.359 1.187 -0.364 1.00 . A A . 10 TRP CA 1 1 4 1030 1 1 10 TRP CB C 6.862 1.369 -1.795 1.00 . A A . 10 TRP CB 1 1 4 1031 1 1 10 TRP CD1 C 8.928 2.423 -2.800 1.00 . A A . 10 TRP CD1 1 1 4 1032 1 1 10 TRP CD2 C 8.414 0.439 -3.716 1.00 . A A . 10 TRP CD2 1 1 4 1033 1 1 10 TRP CE2 C 9.577 0.894 -4.375 1.00 . A A . 10 TRP CE2 1 1 4 1034 1 1 10 TRP CE3 C 7.868 -0.792 -4.095 1.00 . A A . 10 TRP CE3 1 1 4 1035 1 1 10 TRP CG C 8.023 1.421 -2.725 1.00 . A A . 10 TRP CG 1 1 4 1036 1 1 10 TRP CH2 C 9.623 -1.084 -5.755 1.00 . A A . 10 TRP CH2 1 1 4 1037 1 1 10 TRP CZ2 C 10.180 0.145 -5.386 1.00 . A A . 10 TRP CZ2 1 1 4 1038 1 1 10 TRP CZ3 C 8.468 -1.553 -5.111 1.00 . A A . 10 TRP CZ3 1 1 4 1039 1 1 10 TRP H H 5.602 0.026 0.029 1.00 . A A . 10 TRP H 1 1 4 1040 1 1 10 TRP HA H 8.405 0.949 -0.365 1.00 . A A . 10 TRP HA 1 1 4 1041 1 1 10 TRP HB2 H 6.228 0.535 -2.060 1.00 . A A . 10 TRP HB2 1 1 4 1042 1 1 10 TRP HB3 H 6.298 2.281 -1.869 1.00 . A A . 10 TRP HB3 1 1 4 1043 1 1 10 TRP HD1 H 8.927 3.317 -2.194 1.00 . A A . 10 TRP HD1 1 1 4 1044 1 1 10 TRP HE1 H 10.617 2.671 -4.038 1.00 . A A . 10 TRP HE1 1 1 4 1045 1 1 10 TRP HE3 H 6.977 -1.152 -3.598 1.00 . A A . 10 TRP HE3 1 1 4 1046 1 1 10 TRP HH2 H 10.083 -1.673 -6.537 1.00 . A A . 10 TRP HH2 1 1 4 1047 1 1 10 TRP HZ2 H 11.069 0.511 -5.878 1.00 . A A . 10 TRP HZ2 1 1 4 1048 1 1 10 TRP HZ3 H 8.040 -2.501 -5.397 1.00 . A A . 10 TRP HZ3 1 1 4 1049 1 1 10 TRP N N 6.566 0.045 0.160 1.00 . A A . 10 TRP N 1 1 4 1050 1 1 10 TRP NE1 N 9.853 2.111 -3.781 1.00 . A A . 10 TRP NE1 1 1 4 1051 1 1 10 TRP O O 7.996 3.150 0.858 1.00 . A A . 10 TRP O 1 1 4 1052 1 1 11 ARG C C 4.711 3.545 2.747 1.00 . A A . 11 ARG C 1 1 4 1053 1 1 11 ARG CA C 5.501 3.943 1.504 1.00 . A A . 11 ARG CA 1 1 4 1054 1 1 11 ARG CB C 4.641 4.791 0.567 1.00 . A A . 11 ARG CB 1 1 4 1055 1 1 11 ARG CD C 5.625 7.069 0.859 1.00 . A A . 11 ARG CD 1 1 4 1056 1 1 11 ARG CG C 5.507 5.870 -0.084 1.00 . A A . 11 ARG CG 1 1 4 1057 1 1 11 ARG CZ C 4.231 9.018 1.216 1.00 . A A . 11 ARG CZ 1 1 4 1058 1 1 11 ARG H H 5.136 2.151 0.378 1.00 . A A . 11 ARG H 1 1 4 1059 1 1 11 ARG HA H 6.392 4.478 1.783 1.00 . A A . 11 ARG HA 1 1 4 1060 1 1 11 ARG HB2 H 4.215 4.160 -0.198 1.00 . A A . 11 ARG HB2 1 1 4 1061 1 1 11 ARG HB3 H 3.850 5.257 1.132 1.00 . A A . 11 ARG HB3 1 1 4 1062 1 1 11 ARG HD2 H 5.571 6.743 1.888 1.00 . A A . 11 ARG HD2 1 1 4 1063 1 1 11 ARG HD3 H 6.545 7.602 0.678 1.00 . A A . 11 ARG HD3 1 1 4 1064 1 1 11 ARG HE H 3.866 7.691 -0.216 1.00 . A A . 11 ARG HE 1 1 4 1065 1 1 11 ARG HG2 H 6.490 5.469 -0.283 1.00 . A A . 11 ARG HG2 1 1 4 1066 1 1 11 ARG HG3 H 5.052 6.185 -1.010 1.00 . A A . 11 ARG HG3 1 1 4 1067 1 1 11 ARG HH11 H 5.053 8.302 2.895 1.00 . A A . 11 ARG HH11 1 1 4 1068 1 1 11 ARG HH12 H 4.423 9.912 2.997 1.00 . A A . 11 ARG HH12 1 1 4 1069 1 1 11 ARG HH21 H 3.357 9.984 -0.302 1.00 . A A . 11 ARG HH21 1 1 4 1070 1 1 11 ARG HH22 H 3.461 10.865 1.186 1.00 . A A . 11 ARG HH22 1 1 4 1071 1 1 11 ARG N N 5.846 2.733 0.712 1.00 . A A . 11 ARG N 1 1 4 1072 1 1 11 ARG NE N 4.460 7.935 0.524 1.00 . A A . 11 ARG NE 1 1 4 1073 1 1 11 ARG NH1 N 4.597 9.082 2.466 1.00 . A A . 11 ARG NH1 1 1 4 1074 1 1 11 ARG NH2 N 3.636 10.036 0.656 1.00 . A A . 11 ARG NH2 1 1 4 1075 1 1 11 ARG O O 3.573 3.931 2.930 1.00 . A A . 11 ARG O 1 1 4 1076 1 1 12 ARG C C 5.131 3.121 6.050 1.00 . A A . 12 ARG C 1 1 4 1077 1 1 12 ARG CA C 4.610 2.336 4.843 1.00 . A A . 12 ARG CA 1 1 4 1078 1 1 12 ARG CB C 4.942 0.851 4.984 1.00 . A A . 12 ARG CB 1 1 4 1079 1 1 12 ARG CD C 3.694 -1.178 5.739 1.00 . A A . 12 ARG CD 1 1 4 1080 1 1 12 ARG CG C 3.670 0.022 4.791 1.00 . A A . 12 ARG CG 1 1 4 1081 1 1 12 ARG CZ C 4.823 -3.248 5.191 1.00 . A A . 12 ARG CZ 1 1 4 1082 1 1 12 ARG H H 6.229 2.478 3.424 1.00 . A A . 12 ARG H 1 1 4 1083 1 1 12 ARG HA H 3.544 2.468 4.738 1.00 . A A . 12 ARG HA 1 1 4 1084 1 1 12 ARG HB2 H 5.671 0.572 4.237 1.00 . A A . 12 ARG HB2 1 1 4 1085 1 1 12 ARG HB3 H 5.345 0.664 5.967 1.00 . A A . 12 ARG HB3 1 1 4 1086 1 1 12 ARG HD2 H 3.776 -0.843 6.765 1.00 . A A . 12 ARG HD2 1 1 4 1087 1 1 12 ARG HD3 H 2.807 -1.779 5.608 1.00 . A A . 12 ARG HD3 1 1 4 1088 1 1 12 ARG HE H 5.754 -1.495 5.202 1.00 . A A . 12 ARG HE 1 1 4 1089 1 1 12 ARG HG2 H 2.806 0.635 5.005 1.00 . A A . 12 ARG HG2 1 1 4 1090 1 1 12 ARG HG3 H 3.620 -0.328 3.771 1.00 . A A . 12 ARG HG3 1 1 4 1091 1 1 12 ARG HH11 H 3.304 -3.155 3.889 1.00 . A A . 12 ARG HH11 1 1 4 1092 1 1 12 ARG HH12 H 3.869 -4.747 4.267 1.00 . A A . 12 ARG HH12 1 1 4 1093 1 1 12 ARG HH21 H 6.323 -3.644 6.455 1.00 . A A . 12 ARG HH21 1 1 4 1094 1 1 12 ARG HH22 H 5.579 -5.024 5.720 1.00 . A A . 12 ARG HH22 1 1 4 1095 1 1 12 ARG N N 5.312 2.772 3.601 1.00 . A A . 12 ARG N 1 1 4 1096 1 1 12 ARG NE N 4.901 -1.956 5.345 1.00 . A A . 12 ARG NE 1 1 4 1097 1 1 12 ARG NH1 N 3.930 -3.756 4.386 1.00 . A A . 12 ARG NH1 1 1 4 1098 1 1 12 ARG NH2 N 5.638 -4.033 5.839 1.00 . A A . 12 ARG NH2 1 1 4 1099 1 1 12 ARG O O 6.321 3.230 6.261 1.00 . A A . 12 ARG O 1 1 4 1100 1 1 13 LYS C C 5.917 5.283 7.719 1.00 . A A . 13 LYS C 1 1 4 1101 1 1 13 LYS CA C 4.672 4.452 8.036 1.00 . A A . 13 LYS CA 1 1 4 1102 1 1 13 LYS CB C 4.974 3.404 9.111 1.00 . A A . 13 LYS CB 1 1 4 1103 1 1 13 LYS CD C 6.745 1.869 9.980 1.00 . A A . 13 LYS CD 1 1 4 1104 1 1 13 LYS CE C 7.799 2.681 10.737 1.00 . A A . 13 LYS CE 1 1 4 1105 1 1 13 LYS CG C 6.267 2.664 8.762 1.00 . A A . 13 LYS CG 1 1 4 1106 1 1 13 LYS H H 3.288 3.564 6.641 1.00 . A A . 13 LYS H 1 1 4 1107 1 1 13 LYS HA H 3.870 5.093 8.369 1.00 . A A . 13 LYS HA 1 1 4 1108 1 1 13 LYS HB2 H 5.088 3.894 10.068 1.00 . A A . 13 LYS HB2 1 1 4 1109 1 1 13 LYS HB3 H 4.161 2.698 9.164 1.00 . A A . 13 LYS HB3 1 1 4 1110 1 1 13 LYS HD2 H 5.907 1.670 10.630 1.00 . A A . 13 LYS HD2 1 1 4 1111 1 1 13 LYS HD3 H 7.177 0.935 9.653 1.00 . A A . 13 LYS HD3 1 1 4 1112 1 1 13 LYS HE2 H 8.491 3.136 10.043 1.00 . A A . 13 LYS HE2 1 1 4 1113 1 1 13 LYS HE3 H 7.327 3.432 11.349 1.00 . A A . 13 LYS HE3 1 1 4 1114 1 1 13 LYS HG2 H 6.083 1.987 7.940 1.00 . A A . 13 LYS HG2 1 1 4 1115 1 1 13 LYS HG3 H 7.027 3.375 8.479 1.00 . A A . 13 LYS HG3 1 1 4 1116 1 1 13 LYS HZ1 H 8.413 0.741 11.179 1.00 . A A . 13 LYS HZ1 1 1 4 1117 1 1 13 LYS HZ2 H 8.073 1.690 12.547 1.00 . A A . 13 LYS HZ2 1 1 4 1118 1 1 13 LYS HZ3 H 9.506 1.940 11.670 1.00 . A A . 13 LYS HZ3 1 1 4 1119 1 1 13 LYS N N 4.242 3.670 6.838 1.00 . A A . 13 LYS N 1 1 4 1120 1 1 13 LYS NZ N 8.501 1.687 11.598 1.00 . A A . 13 LYS NZ 1 1 4 1121 1 1 13 LYS O O 6.715 5.568 8.591 1.00 . A A . 13 LYS O 1 1 4 1122 1 1 14 NH2 HN1 H 5.480 5.456 5.791 1.00 . A A . 14 NH2 HN1 1 1 4 1123 1 1 14 NH2 HN2 H 6.916 6.216 6.280 1.00 . A A . 14 NH2 HN2 1 1 4 1124 1 1 14 NH2 N N 6.121 5.685 6.495 1.00 . A A . 14 NH2 N 1 1 5 1125 1 1 1 ILE C C -8.848 -4.186 2.349 1.00 . A A . 1 ILE C 1 1 5 1126 1 1 1 ILE CA C -9.429 -5.492 1.806 1.00 . A A . 1 ILE CA 1 1 5 1127 1 1 1 ILE CB C -10.420 -6.093 2.804 1.00 . A A . 1 ILE CB 1 1 5 1128 1 1 1 ILE CD1 C -11.676 -8.226 3.148 1.00 . A A . 1 ILE CD1 1 1 5 1129 1 1 1 ILE CG1 C -11.240 -7.185 2.114 1.00 . A A . 1 ILE CG1 1 1 5 1130 1 1 1 ILE CG2 C -11.358 -4.999 3.317 1.00 . A A . 1 ILE CG2 1 1 5 1131 1 1 1 ILE H1 H -7.650 -6.386 2.417 1.00 . A A . 1 ILE H1 1 1 5 1132 1 1 1 ILE H2 H -7.897 -6.410 0.736 1.00 . A A . 1 ILE H2 1 1 5 1133 1 1 1 ILE H3 H -8.769 -7.467 1.742 1.00 . A A . 1 ILE H3 1 1 5 1134 1 1 1 ILE HA H -9.919 -5.324 0.860 1.00 . A A . 1 ILE HA 1 1 5 1135 1 1 1 ILE HB H -9.876 -6.519 3.636 1.00 . A A . 1 ILE HB 1 1 5 1136 1 1 1 ILE HD11 H -11.365 -9.208 2.823 1.00 . A A . 1 ILE HD11 1 1 5 1137 1 1 1 ILE HD12 H -12.751 -8.205 3.247 1.00 . A A . 1 ILE HD12 1 1 5 1138 1 1 1 ILE HD13 H -11.220 -8.000 4.100 1.00 . A A . 1 ILE HD13 1 1 5 1139 1 1 1 ILE HG12 H -12.113 -6.744 1.655 1.00 . A A . 1 ILE HG12 1 1 5 1140 1 1 1 ILE HG13 H -10.637 -7.663 1.357 1.00 . A A . 1 ILE HG13 1 1 5 1141 1 1 1 ILE HG21 H -11.893 -4.564 2.486 1.00 . A A . 1 ILE HG21 1 1 5 1142 1 1 1 ILE HG22 H -10.782 -4.234 3.815 1.00 . A A . 1 ILE HG22 1 1 5 1143 1 1 1 ILE HG23 H -12.063 -5.428 4.014 1.00 . A A . 1 ILE HG23 1 1 5 1144 1 1 1 ILE N N -8.356 -6.516 1.664 1.00 . A A . 1 ILE N 1 1 5 1145 1 1 1 ILE O O -7.725 -4.139 2.810 1.00 . A A . 1 ILE O 1 1 5 1146 1 1 2 LEU C C -7.967 -1.299 1.921 1.00 . A A . 2 LEU C 1 1 5 1147 1 1 2 LEU CA C -9.095 -1.817 2.812 1.00 . A A . 2 LEU CA 1 1 5 1148 1 1 2 LEU CB C -8.577 -2.115 4.221 1.00 . A A . 2 LEU CB 1 1 5 1149 1 1 2 LEU CD1 C -10.141 -0.645 5.503 1.00 . A A . 2 LEU CD1 1 1 5 1150 1 1 2 LEU CD2 C -7.814 -1.016 6.330 1.00 . A A . 2 LEU CD2 1 1 5 1151 1 1 2 LEU CG C -8.685 -0.855 5.083 1.00 . A A . 2 LEU CG 1 1 5 1152 1 1 2 LEU H H -10.507 -3.181 1.923 1.00 . A A . 2 LEU H 1 1 5 1153 1 1 2 LEU HA H -9.895 -1.095 2.858 1.00 . A A . 2 LEU HA 1 1 5 1154 1 1 2 LEU HB2 H -9.169 -2.905 4.662 1.00 . A A . 2 LEU HB2 1 1 5 1155 1 1 2 LEU HB3 H -7.545 -2.423 4.167 1.00 . A A . 2 LEU HB3 1 1 5 1156 1 1 2 LEU HD11 H -10.791 -0.850 4.665 1.00 . A A . 2 LEU HD11 1 1 5 1157 1 1 2 LEU HD12 H -10.279 0.376 5.825 1.00 . A A . 2 LEU HD12 1 1 5 1158 1 1 2 LEU HD13 H -10.381 -1.316 6.315 1.00 . A A . 2 LEU HD13 1 1 5 1159 1 1 2 LEU HD21 H -8.278 -1.721 7.003 1.00 . A A . 2 LEU HD21 1 1 5 1160 1 1 2 LEU HD22 H -7.712 -0.061 6.823 1.00 . A A . 2 LEU HD22 1 1 5 1161 1 1 2 LEU HD23 H -6.839 -1.381 6.042 1.00 . A A . 2 LEU HD23 1 1 5 1162 1 1 2 LEU HG H -8.349 0.000 4.513 1.00 . A A . 2 LEU HG 1 1 5 1163 1 1 2 LEU N N -9.604 -3.122 2.298 1.00 . A A . 2 LEU N 1 1 5 1164 1 1 2 LEU O O -6.834 -1.726 2.020 1.00 . A A . 2 LEU O 1 1 5 1165 1 1 3 LYS C C -6.710 -0.897 -0.805 1.00 . A A . 3 LYS C 1 1 5 1166 1 1 3 LYS CA C -7.228 0.183 0.146 1.00 . A A . 3 LYS CA 1 1 5 1167 1 1 3 LYS CB C -6.109 0.664 1.073 1.00 . A A . 3 LYS CB 1 1 5 1168 1 1 3 LYS CD C -5.606 2.126 3.036 1.00 . A A . 3 LYS CD 1 1 5 1169 1 1 3 LYS CE C -6.191 3.347 3.752 1.00 . A A . 3 LYS CE 1 1 5 1170 1 1 3 LYS CG C -6.715 1.406 2.266 1.00 . A A . 3 LYS CG 1 1 5 1171 1 1 3 LYS H H -9.196 -0.052 0.996 1.00 . A A . 3 LYS H 1 1 5 1172 1 1 3 LYS HA H -7.624 1.014 -0.413 1.00 . A A . 3 LYS HA 1 1 5 1173 1 1 3 LYS HB2 H -5.543 -0.185 1.426 1.00 . A A . 3 LYS HB2 1 1 5 1174 1 1 3 LYS HB3 H -5.456 1.332 0.532 1.00 . A A . 3 LYS HB3 1 1 5 1175 1 1 3 LYS HD2 H -5.177 1.452 3.764 1.00 . A A . 3 LYS HD2 1 1 5 1176 1 1 3 LYS HD3 H -4.840 2.448 2.348 1.00 . A A . 3 LYS HD3 1 1 5 1177 1 1 3 LYS HE2 H -7.175 3.118 4.139 1.00 . A A . 3 LYS HE2 1 1 5 1178 1 1 3 LYS HE3 H -5.537 3.665 4.548 1.00 . A A . 3 LYS HE3 1 1 5 1179 1 1 3 LYS HG2 H -7.437 2.127 1.914 1.00 . A A . 3 LYS HG2 1 1 5 1180 1 1 3 LYS HG3 H -7.203 0.699 2.920 1.00 . A A . 3 LYS HG3 1 1 5 1181 1 1 3 LYS HZ1 H -5.345 4.856 2.595 1.00 . A A . 3 LYS HZ1 1 1 5 1182 1 1 3 LYS HZ2 H -6.977 5.115 2.988 1.00 . A A . 3 LYS HZ2 1 1 5 1183 1 1 3 LYS HZ3 H -6.557 3.975 1.802 1.00 . A A . 3 LYS HZ3 1 1 5 1184 1 1 3 LYS N N -8.274 -0.379 1.052 1.00 . A A . 3 LYS N 1 1 5 1185 1 1 3 LYS NZ N -6.273 4.403 2.705 1.00 . A A . 3 LYS NZ 1 1 5 1186 1 1 3 LYS O O -5.538 -1.214 -0.813 1.00 . A A . 3 LYS O 1 1 5 1187 1 1 4 LYS C C -6.031 -3.324 -2.058 1.00 . A A . 4 LYS C 1 1 5 1188 1 1 4 LYS CA C -7.186 -2.487 -2.593 1.00 . A A . 4 LYS CA 1 1 5 1189 1 1 4 LYS CB C -6.785 -1.718 -3.846 1.00 . A A . 4 LYS CB 1 1 5 1190 1 1 4 LYS CD C -7.599 -0.015 -5.489 1.00 . A A . 4 LYS CD 1 1 5 1191 1 1 4 LYS CE C -6.186 0.508 -5.752 1.00 . A A . 4 LYS CE 1 1 5 1192 1 1 4 LYS CG C -7.701 -0.504 -4.042 1.00 . A A . 4 LYS CG 1 1 5 1193 1 1 4 LYS H H -8.501 -1.152 -1.602 1.00 . A A . 4 LYS H 1 1 5 1194 1 1 4 LYS HA H -8.027 -3.124 -2.808 1.00 . A A . 4 LYS HA 1 1 5 1195 1 1 4 LYS HB2 H -5.765 -1.386 -3.751 1.00 . A A . 4 LYS HB2 1 1 5 1196 1 1 4 LYS HB3 H -6.880 -2.366 -4.690 1.00 . A A . 4 LYS HB3 1 1 5 1197 1 1 4 LYS HD2 H -7.811 -0.834 -6.161 1.00 . A A . 4 LYS HD2 1 1 5 1198 1 1 4 LYS HD3 H -8.311 0.779 -5.652 1.00 . A A . 4 LYS HD3 1 1 5 1199 1 1 4 LYS HE2 H -5.997 1.393 -5.158 1.00 . A A . 4 LYS HE2 1 1 5 1200 1 1 4 LYS HE3 H -5.455 -0.254 -5.537 1.00 . A A . 4 LYS HE3 1 1 5 1201 1 1 4 LYS HG2 H -8.722 -0.786 -3.827 1.00 . A A . 4 LYS HG2 1 1 5 1202 1 1 4 LYS HG3 H -7.399 0.288 -3.376 1.00 . A A . 4 LYS HG3 1 1 5 1203 1 1 4 LYS HZ1 H -5.180 0.944 -7.522 1.00 . A A . 4 LYS HZ1 1 1 5 1204 1 1 4 LYS HZ2 H -6.677 1.731 -7.363 1.00 . A A . 4 LYS HZ2 1 1 5 1205 1 1 4 LYS HZ3 H -6.619 0.076 -7.741 1.00 . A A . 4 LYS HZ3 1 1 5 1206 1 1 4 LYS N N -7.581 -1.443 -1.618 1.00 . A A . 4 LYS N 1 1 5 1207 1 1 4 LYS NZ N -6.164 0.840 -7.204 1.00 . A A . 4 LYS NZ 1 1 5 1208 1 1 4 LYS O O -4.934 -3.312 -2.580 1.00 . A A . 4 LYS O 1 1 5 1209 1 1 5 TRP C C -3.968 -4.078 -0.137 1.00 . A A . 5 TRP C 1 1 5 1210 1 1 5 TRP CA C -5.223 -4.908 -0.417 1.00 . A A . 5 TRP CA 1 1 5 1211 1 1 5 TRP CB C -4.932 -5.973 -1.472 1.00 . A A . 5 TRP CB 1 1 5 1212 1 1 5 TRP CD1 C -6.789 -7.583 -2.063 1.00 . A A . 5 TRP CD1 1 1 5 1213 1 1 5 TRP CD2 C -5.792 -8.086 -0.112 1.00 . A A . 5 TRP CD2 1 1 5 1214 1 1 5 TRP CE2 C -6.800 -9.058 -0.314 1.00 . A A . 5 TRP CE2 1 1 5 1215 1 1 5 TRP CE3 C -5.011 -8.175 1.052 1.00 . A A . 5 TRP CE3 1 1 5 1216 1 1 5 TRP CG C -5.807 -7.162 -1.235 1.00 . A A . 5 TRP CG 1 1 5 1217 1 1 5 TRP CH2 C -6.238 -10.156 1.759 1.00 . A A . 5 TRP CH2 1 1 5 1218 1 1 5 TRP CZ2 C -7.025 -10.082 0.607 1.00 . A A . 5 TRP CZ2 1 1 5 1219 1 1 5 TRP CZ3 C -5.233 -9.204 1.983 1.00 . A A . 5 TRP CZ3 1 1 5 1220 1 1 5 TRP H H -7.185 -4.033 -0.626 1.00 . A A . 5 TRP H 1 1 5 1221 1 1 5 TRP HA H -5.577 -5.373 0.490 1.00 . A A . 5 TRP HA 1 1 5 1222 1 1 5 TRP HB2 H -5.130 -5.569 -2.453 1.00 . A A . 5 TRP HB2 1 1 5 1223 1 1 5 TRP HB3 H -3.896 -6.270 -1.407 1.00 . A A . 5 TRP HB3 1 1 5 1224 1 1 5 TRP HD1 H -7.067 -7.116 -2.998 1.00 . A A . 5 TRP HD1 1 1 5 1225 1 1 5 TRP HE1 H -8.121 -9.210 -1.921 1.00 . A A . 5 TRP HE1 1 1 5 1226 1 1 5 TRP HE3 H -4.234 -7.447 1.233 1.00 . A A . 5 TRP HE3 1 1 5 1227 1 1 5 TRP HH2 H -6.404 -10.944 2.478 1.00 . A A . 5 TRP HH2 1 1 5 1228 1 1 5 TRP HZ2 H -7.801 -10.812 0.429 1.00 . A A . 5 TRP HZ2 1 1 5 1229 1 1 5 TRP HZ3 H -4.626 -9.262 2.873 1.00 . A A . 5 TRP HZ3 1 1 5 1230 1 1 5 TRP N N -6.286 -4.052 -1.015 1.00 . A A . 5 TRP N 1 1 5 1231 1 1 5 TRP NE1 N -7.381 -8.708 -1.519 1.00 . A A . 5 TRP NE1 1 1 5 1232 1 1 5 TRP O O -3.184 -3.816 -1.028 1.00 . A A . 5 TRP O 1 1 5 1233 1 1 6 PRO C C -1.391 -3.748 1.563 1.00 . A A . 6 PRO C 1 1 5 1234 1 1 6 PRO CA C -2.649 -2.880 1.509 1.00 . A A . 6 PRO CA 1 1 5 1235 1 1 6 PRO CB C -3.026 -2.381 2.898 1.00 . A A . 6 PRO CB 1 1 5 1236 1 1 6 PRO CD C -4.723 -3.966 2.222 1.00 . A A . 6 PRO CD 1 1 5 1237 1 1 6 PRO CG C -4.015 -3.377 3.416 1.00 . A A . 6 PRO CG 1 1 5 1238 1 1 6 PRO HA H -2.509 -2.045 0.841 1.00 . A A . 6 PRO HA 1 1 5 1239 1 1 6 PRO HB2 H -2.151 -2.350 3.534 1.00 . A A . 6 PRO HB2 1 1 5 1240 1 1 6 PRO HB3 H -3.480 -1.406 2.833 1.00 . A A . 6 PRO HB3 1 1 5 1241 1 1 6 PRO HD2 H -4.857 -5.031 2.352 1.00 . A A . 6 PRO HD2 1 1 5 1242 1 1 6 PRO HD3 H -5.672 -3.479 2.065 1.00 . A A . 6 PRO HD3 1 1 5 1243 1 1 6 PRO HG2 H -3.501 -4.154 3.964 1.00 . A A . 6 PRO HG2 1 1 5 1244 1 1 6 PRO HG3 H -4.731 -2.884 4.056 1.00 . A A . 6 PRO HG3 1 1 5 1245 1 1 6 PRO N N -3.820 -3.690 1.100 1.00 . A A . 6 PRO N 1 1 5 1246 1 1 6 PRO O O -0.993 -4.219 2.610 1.00 . A A . 6 PRO O 1 1 5 1247 1 1 7 TRP C C 1.603 -4.059 -0.278 1.00 . A A . 7 TRP C 1 1 5 1248 1 1 7 TRP CA C 0.470 -4.803 0.424 1.00 . A A . 7 TRP CA 1 1 5 1249 1 1 7 TRP CB C 0.087 -6.053 -0.359 1.00 . A A . 7 TRP CB 1 1 5 1250 1 1 7 TRP CD1 C -1.225 -7.694 1.046 1.00 . A A . 7 TRP CD1 1 1 5 1251 1 1 7 TRP CD2 C 0.996 -8.027 1.174 1.00 . A A . 7 TRP CD2 1 1 5 1252 1 1 7 TRP CE2 C 0.391 -9.003 2.000 1.00 . A A . 7 TRP CE2 1 1 5 1253 1 1 7 TRP CE3 C 2.400 -8.018 1.077 1.00 . A A . 7 TRP CE3 1 1 5 1254 1 1 7 TRP CG C -0.052 -7.208 0.580 1.00 . A A . 7 TRP CG 1 1 5 1255 1 1 7 TRP CH2 C 2.544 -9.914 2.598 1.00 . A A . 7 TRP CH2 1 1 5 1256 1 1 7 TRP CZ2 C 1.151 -9.938 2.706 1.00 . A A . 7 TRP CZ2 1 1 5 1257 1 1 7 TRP CZ3 C 3.167 -8.957 1.787 1.00 . A A . 7 TRP CZ3 1 1 5 1258 1 1 7 TRP H H -1.106 -3.573 -0.390 1.00 . A A . 7 TRP H 1 1 5 1259 1 1 7 TRP HA H 0.757 -5.068 1.428 1.00 . A A . 7 TRP HA 1 1 5 1260 1 1 7 TRP HB2 H -0.850 -5.884 -0.867 1.00 . A A . 7 TRP HB2 1 1 5 1261 1 1 7 TRP HB3 H 0.856 -6.268 -1.085 1.00 . A A . 7 TRP HB3 1 1 5 1262 1 1 7 TRP HD1 H -2.205 -7.312 0.801 1.00 . A A . 7 TRP HD1 1 1 5 1263 1 1 7 TRP HE1 H -1.642 -9.286 2.359 1.00 . A A . 7 TRP HE1 1 1 5 1264 1 1 7 TRP HE3 H 2.890 -7.284 0.455 1.00 . A A . 7 TRP HE3 1 1 5 1265 1 1 7 TRP HH2 H 3.140 -10.634 3.141 1.00 . A A . 7 TRP HH2 1 1 5 1266 1 1 7 TRP HZ2 H 0.666 -10.673 3.330 1.00 . A A . 7 TRP HZ2 1 1 5 1267 1 1 7 TRP HZ3 H 4.244 -8.942 1.705 1.00 . A A . 7 TRP HZ3 1 1 5 1268 1 1 7 TRP N N -0.765 -3.963 0.442 1.00 . A A . 7 TRP N 1 1 5 1269 1 1 7 TRP NE1 N -0.963 -8.758 1.890 1.00 . A A . 7 TRP NE1 1 1 5 1270 1 1 7 TRP O O 2.161 -4.524 -1.252 1.00 . A A . 7 TRP O 1 1 5 1271 1 1 8 TRP C C 4.051 -1.682 0.663 1.00 . A A . 8 TRP C 1 1 5 1272 1 1 8 TRP CA C 3.045 -2.121 -0.405 1.00 . A A . 8 TRP CA 1 1 5 1273 1 1 8 TRP CB C 2.362 -0.908 -1.032 1.00 . A A . 8 TRP CB 1 1 5 1274 1 1 8 TRP CD1 C 3.944 0.815 -1.981 1.00 . A A . 8 TRP CD1 1 1 5 1275 1 1 8 TRP CD2 C 3.532 -0.865 -3.419 1.00 . A A . 8 TRP CD2 1 1 5 1276 1 1 8 TRP CE2 C 4.421 0.020 -4.073 1.00 . A A . 8 TRP CE2 1 1 5 1277 1 1 8 TRP CE3 C 3.113 -2.016 -4.111 1.00 . A A . 8 TRP CE3 1 1 5 1278 1 1 8 TRP CG C 3.243 -0.335 -2.092 1.00 . A A . 8 TRP CG 1 1 5 1279 1 1 8 TRP CH2 C 4.452 -1.375 -6.041 1.00 . A A . 8 TRP CH2 1 1 5 1280 1 1 8 TRP CZ2 C 4.878 -0.227 -5.369 1.00 . A A . 8 TRP CZ2 1 1 5 1281 1 1 8 TRP CZ3 C 3.570 -2.268 -5.414 1.00 . A A . 8 TRP CZ3 1 1 5 1282 1 1 8 TRP H H 1.484 -2.564 0.999 1.00 . A A . 8 TRP H 1 1 5 1283 1 1 8 TRP HA H 3.534 -2.702 -1.167 1.00 . A A . 8 TRP HA 1 1 5 1284 1 1 8 TRP HB2 H 1.421 -1.209 -1.468 1.00 . A A . 8 TRP HB2 1 1 5 1285 1 1 8 TRP HB3 H 2.183 -0.161 -0.270 1.00 . A A . 8 TRP HB3 1 1 5 1286 1 1 8 TRP HD1 H 3.954 1.462 -1.117 1.00 . A A . 8 TRP HD1 1 1 5 1287 1 1 8 TRP HE1 H 5.226 1.796 -3.336 1.00 . A A . 8 TRP HE1 1 1 5 1288 1 1 8 TRP HE3 H 2.437 -2.709 -3.635 1.00 . A A . 8 TRP HE3 1 1 5 1289 1 1 8 TRP HH2 H 4.801 -1.574 -7.044 1.00 . A A . 8 TRP HH2 1 1 5 1290 1 1 8 TRP HZ2 H 5.557 0.464 -5.847 1.00 . A A . 8 TRP HZ2 1 1 5 1291 1 1 8 TRP HZ3 H 3.242 -3.154 -5.935 1.00 . A A . 8 TRP HZ3 1 1 5 1292 1 1 8 TRP N N 1.947 -2.908 0.217 1.00 . A A . 8 TRP N 1 1 5 1293 1 1 8 TRP NE1 N 4.642 1.029 -3.157 1.00 . A A . 8 TRP NE1 1 1 5 1294 1 1 8 TRP O O 3.765 -0.822 1.471 1.00 . A A . 8 TRP O 1 1 5 1295 1 1 9 PRO C C 7.137 -0.842 1.100 1.00 . A A . 9 PRO C 1 1 5 1296 1 1 9 PRO CA C 6.266 -1.993 1.604 1.00 . A A . 9 PRO CA 1 1 5 1297 1 1 9 PRO CB C 7.061 -3.290 1.664 1.00 . A A . 9 PRO CB 1 1 5 1298 1 1 9 PRO CD C 5.609 -3.345 -0.305 1.00 . A A . 9 PRO CD 1 1 5 1299 1 1 9 PRO CG C 6.816 -3.982 0.351 1.00 . A A . 9 PRO CG 1 1 5 1300 1 1 9 PRO HA H 5.849 -1.765 2.568 1.00 . A A . 9 PRO HA 1 1 5 1301 1 1 9 PRO HB2 H 8.114 -3.076 1.787 1.00 . A A . 9 PRO HB2 1 1 5 1302 1 1 9 PRO HB3 H 6.705 -3.904 2.475 1.00 . A A . 9 PRO HB3 1 1 5 1303 1 1 9 PRO HD2 H 5.884 -2.914 -1.258 1.00 . A A . 9 PRO HD2 1 1 5 1304 1 1 9 PRO HD3 H 4.816 -4.066 -0.429 1.00 . A A . 9 PRO HD3 1 1 5 1305 1 1 9 PRO HG2 H 7.681 -3.870 -0.285 1.00 . A A . 9 PRO HG2 1 1 5 1306 1 1 9 PRO HG3 H 6.622 -5.030 0.522 1.00 . A A . 9 PRO HG3 1 1 5 1307 1 1 9 PRO N N 5.199 -2.302 0.631 1.00 . A A . 9 PRO N 1 1 5 1308 1 1 9 PRO O O 8.321 -0.783 1.361 1.00 . A A . 9 PRO O 1 1 5 1309 1 1 10 TRP C C 6.962 2.499 0.602 1.00 . A A . 10 TRP C 1 1 5 1310 1 1 10 TRP CA C 7.333 1.219 -0.147 1.00 . A A . 10 TRP CA 1 1 5 1311 1 1 10 TRP CB C 6.925 1.315 -1.613 1.00 . A A . 10 TRP CB 1 1 5 1312 1 1 10 TRP CD1 C 9.025 2.383 -2.540 1.00 . A A . 10 TRP CD1 1 1 5 1313 1 1 10 TRP CD2 C 8.630 0.339 -3.378 1.00 . A A . 10 TRP CD2 1 1 5 1314 1 1 10 TRP CE2 C 9.821 0.796 -3.984 1.00 . A A . 10 TRP CE2 1 1 5 1315 1 1 10 TRP CE3 C 8.148 -0.927 -3.726 1.00 . A A . 10 TRP CE3 1 1 5 1316 1 1 10 TRP CG C 8.146 1.358 -2.469 1.00 . A A . 10 TRP CG 1 1 5 1317 1 1 10 TRP CH2 C 10.020 -1.250 -5.250 1.00 . A A . 10 TRP CH2 1 1 5 1318 1 1 10 TRP CZ2 C 10.513 0.015 -4.911 1.00 . A A . 10 TRP CZ2 1 1 5 1319 1 1 10 TRP CZ3 C 8.837 -1.721 -4.659 1.00 . A A . 10 TRP CZ3 1 1 5 1320 1 1 10 TRP H H 5.603 -0.005 0.185 1.00 . A A . 10 TRP H 1 1 5 1321 1 1 10 TRP HA H 8.384 1.026 -0.068 1.00 . A A . 10 TRP HA 1 1 5 1322 1 1 10 TRP HB2 H 6.334 0.450 -1.877 1.00 . A A . 10 TRP HB2 1 1 5 1323 1 1 10 TRP HB3 H 6.343 2.204 -1.771 1.00 . A A . 10 TRP HB3 1 1 5 1324 1 1 10 TRP HD1 H 8.960 3.308 -1.987 1.00 . A A . 10 TRP HD1 1 1 5 1325 1 1 10 TRP HE1 H 10.785 2.619 -3.678 1.00 . A A . 10 TRP HE1 1 1 5 1326 1 1 10 TRP HE3 H 7.236 -1.292 -3.271 1.00 . A A . 10 TRP HE3 1 1 5 1327 1 1 10 TRP HH2 H 10.547 -1.861 -5.966 1.00 . A A . 10 TRP HH2 1 1 5 1328 1 1 10 TRP HZ2 H 11.422 0.384 -5.363 1.00 . A A . 10 TRP HZ2 1 1 5 1329 1 1 10 TRP HZ3 H 8.457 -2.697 -4.921 1.00 . A A . 10 TRP HZ3 1 1 5 1330 1 1 10 TRP N N 6.554 0.069 0.382 1.00 . A A . 10 TRP N 1 1 5 1331 1 1 10 TRP NE1 N 10.023 2.050 -3.441 1.00 . A A . 10 TRP NE1 1 1 5 1332 1 1 10 TRP O O 7.779 3.104 1.267 1.00 . A A . 10 TRP O 1 1 5 1333 1 1 11 ARG C C 4.081 3.842 2.071 1.00 . A A . 11 ARG C 1 1 5 1334 1 1 11 ARG CA C 5.291 4.147 1.194 1.00 . A A . 11 ARG CA 1 1 5 1335 1 1 11 ARG CB C 4.919 5.143 0.086 1.00 . A A . 11 ARG CB 1 1 5 1336 1 1 11 ARG CD C 3.493 5.338 -1.961 1.00 . A A . 11 ARG CD 1 1 5 1337 1 1 11 ARG CG C 4.401 4.406 -1.155 1.00 . A A . 11 ARG CG 1 1 5 1338 1 1 11 ARG CZ C 3.373 5.651 -4.359 1.00 . A A . 11 ARG CZ 1 1 5 1339 1 1 11 ARG H H 5.096 2.411 -0.041 1.00 . A A . 11 ARG H 1 1 5 1340 1 1 11 ARG HA H 6.093 4.542 1.791 1.00 . A A . 11 ARG HA 1 1 5 1341 1 1 11 ARG HB2 H 4.147 5.794 0.451 1.00 . A A . 11 ARG HB2 1 1 5 1342 1 1 11 ARG HB3 H 5.787 5.726 -0.179 1.00 . A A . 11 ARG HB3 1 1 5 1343 1 1 11 ARG HD2 H 2.493 4.928 -2.021 1.00 . A A . 11 ARG HD2 1 1 5 1344 1 1 11 ARG HD3 H 3.472 6.321 -1.517 1.00 . A A . 11 ARG HD3 1 1 5 1345 1 1 11 ARG HE H 5.076 5.258 -3.418 1.00 . A A . 11 ARG HE 1 1 5 1346 1 1 11 ARG HG2 H 5.237 4.100 -1.768 1.00 . A A . 11 ARG HG2 1 1 5 1347 1 1 11 ARG HG3 H 3.839 3.536 -0.851 1.00 . A A . 11 ARG HG3 1 1 5 1348 1 1 11 ARG HH11 H 2.380 3.915 -4.260 1.00 . A A . 11 ARG HH11 1 1 5 1349 1 1 11 ARG HH12 H 1.923 4.966 -5.558 1.00 . A A . 11 ARG HH12 1 1 5 1350 1 1 11 ARG HH21 H 4.192 7.445 -4.701 1.00 . A A . 11 ARG HH21 1 1 5 1351 1 1 11 ARG HH22 H 2.948 6.966 -5.808 1.00 . A A . 11 ARG HH22 1 1 5 1352 1 1 11 ARG N N 5.733 2.912 0.496 1.00 . A A . 11 ARG N 1 1 5 1353 1 1 11 ARG NE N 4.113 5.402 -3.313 1.00 . A A . 11 ARG NE 1 1 5 1354 1 1 11 ARG NH1 N 2.490 4.775 -4.756 1.00 . A A . 11 ARG NH1 1 1 5 1355 1 1 11 ARG NH2 N 3.516 6.774 -5.007 1.00 . A A . 11 ARG NH2 1 1 5 1356 1 1 11 ARG O O 2.999 4.359 1.866 1.00 . A A . 11 ARG O 1 1 5 1357 1 1 12 ARG C C 3.255 3.404 5.282 1.00 . A A . 12 ARG C 1 1 5 1358 1 1 12 ARG CA C 3.125 2.653 3.954 1.00 . A A . 12 ARG CA 1 1 5 1359 1 1 12 ARG CB C 3.248 1.145 4.175 1.00 . A A . 12 ARG CB 1 1 5 1360 1 1 12 ARG CD C 1.144 0.523 5.372 1.00 . A A . 12 ARG CD 1 1 5 1361 1 1 12 ARG CG C 1.872 0.494 4.027 1.00 . A A . 12 ARG CG 1 1 5 1362 1 1 12 ARG CZ C 0.322 -1.224 6.834 1.00 . A A . 12 ARG CZ 1 1 5 1363 1 1 12 ARG H H 5.142 2.605 3.191 1.00 . A A . 12 ARG H 1 1 5 1364 1 1 12 ARG HA H 2.183 2.881 3.481 1.00 . A A . 12 ARG HA 1 1 5 1365 1 1 12 ARG HB2 H 3.926 0.729 3.444 1.00 . A A . 12 ARG HB2 1 1 5 1366 1 1 12 ARG HB3 H 3.629 0.957 5.167 1.00 . A A . 12 ARG HB3 1 1 5 1367 1 1 12 ARG HD2 H 1.772 0.975 6.128 1.00 . A A . 12 ARG HD2 1 1 5 1368 1 1 12 ARG HD3 H 0.213 1.061 5.285 1.00 . A A . 12 ARG HD3 1 1 5 1369 1 1 12 ARG HE H 1.125 -1.606 5.059 1.00 . A A . 12 ARG HE 1 1 5 1370 1 1 12 ARG HG2 H 1.295 1.036 3.292 1.00 . A A . 12 ARG HG2 1 1 5 1371 1 1 12 ARG HG3 H 1.992 -0.531 3.708 1.00 . A A . 12 ARG HG3 1 1 5 1372 1 1 12 ARG HH11 H -1.410 -0.316 6.414 1.00 . A A . 12 ARG HH11 1 1 5 1373 1 1 12 ARG HH12 H -1.328 -1.092 7.959 1.00 . A A . 12 ARG HH12 1 1 5 1374 1 1 12 ARG HH21 H 1.925 -2.207 7.520 1.00 . A A . 12 ARG HH21 1 1 5 1375 1 1 12 ARG HH22 H 0.561 -2.163 8.586 1.00 . A A . 12 ARG HH22 1 1 5 1376 1 1 12 ARG N N 4.258 3.004 3.050 1.00 . A A . 12 ARG N 1 1 5 1377 1 1 12 ARG NE N 0.880 -0.905 5.699 1.00 . A A . 12 ARG NE 1 1 5 1378 1 1 12 ARG NH1 N -0.901 -0.848 7.089 1.00 . A A . 12 ARG NH1 1 1 5 1379 1 1 12 ARG NH2 N 0.988 -1.918 7.716 1.00 . A A . 12 ARG NH2 1 1 5 1380 1 1 12 ARG O O 4.342 3.665 5.756 1.00 . A A . 12 ARG O 1 1 5 1381 1 1 13 LYS C C 1.662 3.616 8.312 1.00 . A A . 13 LYS C 1 1 5 1382 1 1 13 LYS CA C 2.212 4.490 7.181 1.00 . A A . 13 LYS CA 1 1 5 1383 1 1 13 LYS CB C 1.330 5.723 6.979 1.00 . A A . 13 LYS CB 1 1 5 1384 1 1 13 LYS CD C 3.028 7.079 5.747 1.00 . A A . 13 LYS CD 1 1 5 1385 1 1 13 LYS CE C 4.504 7.249 6.111 1.00 . A A . 13 LYS CE 1 1 5 1386 1 1 13 LYS CG C 2.195 6.983 7.027 1.00 . A A . 13 LYS CG 1 1 5 1387 1 1 13 LYS H H 1.283 3.537 5.487 1.00 . A A . 13 LYS H 1 1 5 1388 1 1 13 LYS HA H 3.225 4.793 7.397 1.00 . A A . 13 LYS HA 1 1 5 1389 1 1 13 LYS HB2 H 0.836 5.657 6.020 1.00 . A A . 13 LYS HB2 1 1 5 1390 1 1 13 LYS HB3 H 0.588 5.767 7.764 1.00 . A A . 13 LYS HB3 1 1 5 1391 1 1 13 LYS HD2 H 2.900 6.177 5.167 1.00 . A A . 13 LYS HD2 1 1 5 1392 1 1 13 LYS HD3 H 2.703 7.930 5.168 1.00 . A A . 13 LYS HD3 1 1 5 1393 1 1 13 LYS HE2 H 4.634 7.194 7.185 1.00 . A A . 13 LYS HE2 1 1 5 1394 1 1 13 LYS HE3 H 5.102 6.497 5.620 1.00 . A A . 13 LYS HE3 1 1 5 1395 1 1 13 LYS HG2 H 1.558 7.853 7.108 1.00 . A A . 13 LYS HG2 1 1 5 1396 1 1 13 LYS HG3 H 2.853 6.937 7.882 1.00 . A A . 13 LYS HG3 1 1 5 1397 1 1 13 LYS HZ1 H 4.145 9.287 5.897 1.00 . A A . 13 LYS HZ1 1 1 5 1398 1 1 13 LYS HZ2 H 4.934 8.579 4.571 1.00 . A A . 13 LYS HZ2 1 1 5 1399 1 1 13 LYS HZ3 H 5.789 8.883 6.007 1.00 . A A . 13 LYS HZ3 1 1 5 1400 1 1 13 LYS N N 2.153 3.756 5.885 1.00 . A A . 13 LYS N 1 1 5 1401 1 1 13 LYS NZ N 4.871 8.601 5.608 1.00 . A A . 13 LYS NZ 1 1 5 1402 1 1 13 LYS O O 0.750 4.004 9.014 1.00 . A A . 13 LYS O 1 1 5 1403 1 1 14 NH2 HN1 H 2.918 2.121 7.952 1.00 . A A . 14 NH2 HN1 1 1 5 1404 1 1 14 NH2 HN2 H 1.840 1.867 9.238 1.00 . A A . 14 NH2 HN2 1 1 5 1405 1 1 14 NH2 N N 2.184 2.437 8.519 1.00 . A A . 14 NH2 N 1 1 6 1406 1 1 1 ILE C C -9.429 5.464 -2.468 1.00 . A A . 1 ILE C 1 1 6 1407 1 1 1 ILE CA C -10.674 6.162 -3.023 1.00 . A A . 1 ILE CA 1 1 6 1408 1 1 1 ILE CB C -10.948 5.710 -4.458 1.00 . A A . 1 ILE CB 1 1 6 1409 1 1 1 ILE CD1 C -12.631 5.768 -6.304 1.00 . A A . 1 ILE CD1 1 1 6 1410 1 1 1 ILE CG1 C -12.208 6.404 -4.979 1.00 . A A . 1 ILE CG1 1 1 6 1411 1 1 1 ILE CG2 C -11.153 4.194 -4.485 1.00 . A A . 1 ILE CG2 1 1 6 1412 1 1 1 ILE H1 H -11.343 8.134 -3.003 1.00 . A A . 1 ILE H1 1 1 6 1413 1 1 1 ILE H2 H -10.036 7.857 -4.053 1.00 . A A . 1 ILE H2 1 1 6 1414 1 1 1 ILE H3 H -9.782 7.929 -2.374 1.00 . A A . 1 ILE H3 1 1 6 1415 1 1 1 ILE HA H -11.531 5.956 -2.403 1.00 . A A . 1 ILE HA 1 1 6 1416 1 1 1 ILE HB H -10.106 5.969 -5.083 1.00 . A A . 1 ILE HB 1 1 6 1417 1 1 1 ILE HD11 H -11.863 5.088 -6.638 1.00 . A A . 1 ILE HD11 1 1 6 1418 1 1 1 ILE HD12 H -12.776 6.541 -7.044 1.00 . A A . 1 ILE HD12 1 1 6 1419 1 1 1 ILE HD13 H -13.556 5.226 -6.163 1.00 . A A . 1 ILE HD13 1 1 6 1420 1 1 1 ILE HG12 H -13.003 6.297 -4.256 1.00 . A A . 1 ILE HG12 1 1 6 1421 1 1 1 ILE HG13 H -12.002 7.453 -5.135 1.00 . A A . 1 ILE HG13 1 1 6 1422 1 1 1 ILE HG21 H -12.018 3.938 -3.891 1.00 . A A . 1 ILE HG21 1 1 6 1423 1 1 1 ILE HG22 H -10.281 3.705 -4.081 1.00 . A A . 1 ILE HG22 1 1 6 1424 1 1 1 ILE HG23 H -11.309 3.870 -5.504 1.00 . A A . 1 ILE HG23 1 1 6 1425 1 1 1 ILE N N -10.441 7.632 -3.121 1.00 . A A . 1 ILE N 1 1 6 1426 1 1 1 ILE O O -8.344 6.010 -2.474 1.00 . A A . 1 ILE O 1 1 6 1427 1 1 2 LEU C C -8.863 2.230 -0.761 1.00 . A A . 2 LEU C 1 1 6 1428 1 1 2 LEU CA C -8.405 3.527 -1.431 1.00 . A A . 2 LEU CA 1 1 6 1429 1 1 2 LEU CB C -7.791 4.477 -0.403 1.00 . A A . 2 LEU CB 1 1 6 1430 1 1 2 LEU CD1 C -6.203 6.298 -1.040 1.00 . A A . 2 LEU CD1 1 1 6 1431 1 1 2 LEU CD2 C -5.406 4.369 0.328 1.00 . A A . 2 LEU CD2 1 1 6 1432 1 1 2 LEU CG C -6.348 4.795 -0.800 1.00 . A A . 2 LEU CG 1 1 6 1433 1 1 2 LEU H H -10.463 3.836 -1.992 1.00 . A A . 2 LEU H 1 1 6 1434 1 1 2 LEU HA H -7.691 3.313 -2.211 1.00 . A A . 2 LEU HA 1 1 6 1435 1 1 2 LEU HB2 H -8.366 5.391 -0.370 1.00 . A A . 2 LEU HB2 1 1 6 1436 1 1 2 LEU HB3 H -7.800 4.009 0.570 1.00 . A A . 2 LEU HB3 1 1 6 1437 1 1 2 LEU HD11 H -5.949 6.474 -2.075 1.00 . A A . 2 LEU HD11 1 1 6 1438 1 1 2 LEU HD12 H -5.424 6.691 -0.407 1.00 . A A . 2 LEU HD12 1 1 6 1439 1 1 2 LEU HD13 H -7.137 6.791 -0.811 1.00 . A A . 2 LEU HD13 1 1 6 1440 1 1 2 LEU HD21 H -4.825 3.516 0.008 1.00 . A A . 2 LEU HD21 1 1 6 1441 1 1 2 LEU HD22 H -5.983 4.103 1.201 1.00 . A A . 2 LEU HD22 1 1 6 1442 1 1 2 LEU HD23 H -4.742 5.185 0.570 1.00 . A A . 2 LEU HD23 1 1 6 1443 1 1 2 LEU HG H -6.097 4.260 -1.703 1.00 . A A . 2 LEU HG 1 1 6 1444 1 1 2 LEU N N -9.578 4.261 -1.987 1.00 . A A . 2 LEU N 1 1 6 1445 1 1 2 LEU O O -9.391 2.236 0.333 1.00 . A A . 2 LEU O 1 1 6 1446 1 1 3 LYS C C -8.716 -1.333 -1.762 1.00 . A A . 3 LYS C 1 1 6 1447 1 1 3 LYS CA C -9.083 -0.182 -0.821 1.00 . A A . 3 LYS CA 1 1 6 1448 1 1 3 LYS CB C -10.601 -0.077 -0.670 1.00 . A A . 3 LYS CB 1 1 6 1449 1 1 3 LYS CD C -12.699 0.093 -2.017 1.00 . A A . 3 LYS CD 1 1 6 1450 1 1 3 LYS CE C -13.168 0.037 -3.472 1.00 . A A . 3 LYS CE 1 1 6 1451 1 1 3 LYS CG C -11.211 0.444 -1.973 1.00 . A A . 3 LYS CG 1 1 6 1452 1 1 3 LYS H H -8.235 1.143 -2.294 1.00 . A A . 3 LYS H 1 1 6 1453 1 1 3 LYS HA H -8.626 -0.322 0.145 1.00 . A A . 3 LYS HA 1 1 6 1454 1 1 3 LYS HB2 H -11.009 -1.052 -0.445 1.00 . A A . 3 LYS HB2 1 1 6 1455 1 1 3 LYS HB3 H -10.837 0.605 0.133 1.00 . A A . 3 LYS HB3 1 1 6 1456 1 1 3 LYS HD2 H -12.856 -0.869 -1.549 1.00 . A A . 3 LYS HD2 1 1 6 1457 1 1 3 LYS HD3 H -13.263 0.846 -1.488 1.00 . A A . 3 LYS HD3 1 1 6 1458 1 1 3 LYS HE2 H -13.349 1.036 -3.845 1.00 . A A . 3 LYS HE2 1 1 6 1459 1 1 3 LYS HE3 H -12.439 -0.469 -4.085 1.00 . A A . 3 LYS HE3 1 1 6 1460 1 1 3 LYS HG2 H -11.090 1.516 -2.022 1.00 . A A . 3 LYS HG2 1 1 6 1461 1 1 3 LYS HG3 H -10.710 -0.015 -2.812 1.00 . A A . 3 LYS HG3 1 1 6 1462 1 1 3 LYS HZ1 H -14.772 -0.905 -4.408 1.00 . A A . 3 LYS HZ1 1 1 6 1463 1 1 3 LYS HZ2 H -15.156 -0.214 -2.904 1.00 . A A . 3 LYS HZ2 1 1 6 1464 1 1 3 LYS HZ3 H -14.267 -1.660 -2.976 1.00 . A A . 3 LYS HZ3 1 1 6 1465 1 1 3 LYS N N -8.663 1.120 -1.414 1.00 . A A . 3 LYS N 1 1 6 1466 1 1 3 LYS NZ N -14.437 -0.744 -3.437 1.00 . A A . 3 LYS NZ 1 1 6 1467 1 1 3 LYS O O -9.572 -2.001 -2.307 1.00 . A A . 3 LYS O 1 1 6 1468 1 1 4 LYS C C -5.901 -3.474 -2.204 1.00 . A A . 4 LYS C 1 1 6 1469 1 1 4 LYS CA C -7.020 -2.673 -2.857 1.00 . A A . 4 LYS CA 1 1 6 1470 1 1 4 LYS CB C -6.521 -1.977 -4.115 1.00 . A A . 4 LYS CB 1 1 6 1471 1 1 4 LYS CD C -6.845 -2.716 -6.482 1.00 . A A . 4 LYS CD 1 1 6 1472 1 1 4 LYS CE C -6.812 -4.243 -6.397 1.00 . A A . 4 LYS CE 1 1 6 1473 1 1 4 LYS CG C -7.542 -2.152 -5.241 1.00 . A A . 4 LYS CG 1 1 6 1474 1 1 4 LYS H H -6.773 -1.019 -1.506 1.00 . A A . 4 LYS H 1 1 6 1475 1 1 4 LYS HA H -7.854 -3.316 -3.089 1.00 . A A . 4 LYS HA 1 1 6 1476 1 1 4 LYS HB2 H -6.387 -0.929 -3.907 1.00 . A A . 4 LYS HB2 1 1 6 1477 1 1 4 LYS HB3 H -5.578 -2.408 -4.415 1.00 . A A . 4 LYS HB3 1 1 6 1478 1 1 4 LYS HD2 H -7.387 -2.415 -7.367 1.00 . A A . 4 LYS HD2 1 1 6 1479 1 1 4 LYS HD3 H -5.836 -2.337 -6.530 1.00 . A A . 4 LYS HD3 1 1 6 1480 1 1 4 LYS HE2 H -6.051 -4.563 -5.698 1.00 . A A . 4 LYS HE2 1 1 6 1481 1 1 4 LYS HE3 H -7.776 -4.626 -6.105 1.00 . A A . 4 LYS HE3 1 1 6 1482 1 1 4 LYS HG2 H -8.317 -2.833 -4.921 1.00 . A A . 4 LYS HG2 1 1 6 1483 1 1 4 LYS HG3 H -7.980 -1.194 -5.482 1.00 . A A . 4 LYS HG3 1 1 6 1484 1 1 4 LYS HZ1 H -5.449 -4.678 -7.909 1.00 . A A . 4 LYS HZ1 1 1 6 1485 1 1 4 LYS HZ2 H -6.931 -4.062 -8.467 1.00 . A A . 4 LYS HZ2 1 1 6 1486 1 1 4 LYS HZ3 H -6.827 -5.666 -7.916 1.00 . A A . 4 LYS HZ3 1 1 6 1487 1 1 4 LYS N N -7.447 -1.570 -1.955 1.00 . A A . 4 LYS N 1 1 6 1488 1 1 4 LYS NZ N -6.479 -4.697 -7.777 1.00 . A A . 4 LYS NZ 1 1 6 1489 1 1 4 LYS O O -4.766 -3.461 -2.638 1.00 . A A . 4 LYS O 1 1 6 1490 1 1 5 TRP C C -3.957 -4.130 -0.157 1.00 . A A . 5 TRP C 1 1 6 1491 1 1 5 TRP CA C -5.197 -4.981 -0.447 1.00 . A A . 5 TRP CA 1 1 6 1492 1 1 5 TRP CB C -4.854 -6.115 -1.411 1.00 . A A . 5 TRP CB 1 1 6 1493 1 1 5 TRP CD1 C -6.712 -7.695 -2.078 1.00 . A A . 5 TRP CD1 1 1 6 1494 1 1 5 TRP CD2 C -5.912 -8.118 -0.019 1.00 . A A . 5 TRP CD2 1 1 6 1495 1 1 5 TRP CE2 C -6.934 -9.065 -0.260 1.00 . A A . 5 TRP CE2 1 1 6 1496 1 1 5 TRP CE3 C -5.239 -8.165 1.214 1.00 . A A . 5 TRP CE3 1 1 6 1497 1 1 5 TRP CG C -5.790 -7.259 -1.189 1.00 . A A . 5 TRP CG 1 1 6 1498 1 1 5 TRP CH2 C -6.600 -10.059 1.913 1.00 . A A . 5 TRP CH2 1 1 6 1499 1 1 5 TRP CZ2 C -7.278 -10.026 0.692 1.00 . A A . 5 TRP CZ2 1 1 6 1500 1 1 5 TRP CZ3 C -5.582 -9.130 2.175 1.00 . A A . 5 TRP CZ3 1 1 6 1501 1 1 5 TRP H H -7.146 -4.148 -0.841 1.00 . A A . 5 TRP H 1 1 6 1502 1 1 5 TRP HA H -5.602 -5.383 0.467 1.00 . A A . 5 TRP HA 1 1 6 1503 1 1 5 TRP HB2 H -4.947 -5.765 -2.427 1.00 . A A . 5 TRP HB2 1 1 6 1504 1 1 5 TRP HB3 H -3.840 -6.442 -1.233 1.00 . A A . 5 TRP HB3 1 1 6 1505 1 1 5 TRP HD1 H -6.888 -7.274 -3.057 1.00 . A A . 5 TRP HD1 1 1 6 1506 1 1 5 TRP HE1 H -8.112 -9.266 -1.968 1.00 . A A . 5 TRP HE1 1 1 6 1507 1 1 5 TRP HE3 H -4.455 -7.453 1.423 1.00 . A A . 5 TRP HE3 1 1 6 1508 1 1 5 TRP HH2 H -6.859 -10.800 2.656 1.00 . A A . 5 TRP HH2 1 1 6 1509 1 1 5 TRP HZ2 H -8.061 -10.740 0.486 1.00 . A A . 5 TRP HZ2 1 1 6 1510 1 1 5 TRP HZ3 H -5.059 -9.158 3.119 1.00 . A A . 5 TRP HZ3 1 1 6 1511 1 1 5 TRP N N -6.223 -4.166 -1.158 1.00 . A A . 5 TRP N 1 1 6 1512 1 1 5 TRP NE1 N -7.391 -8.767 -1.527 1.00 . A A . 5 TRP NE1 1 1 6 1513 1 1 5 TRP O O -3.135 -3.914 -1.026 1.00 . A A . 5 TRP O 1 1 6 1514 1 1 6 PRO C C -1.454 -3.683 1.609 1.00 . A A . 6 PRO C 1 1 6 1515 1 1 6 PRO CA C -2.719 -2.834 1.478 1.00 . A A . 6 PRO CA 1 1 6 1516 1 1 6 PRO CB C -3.150 -2.282 2.832 1.00 . A A . 6 PRO CB 1 1 6 1517 1 1 6 PRO CD C -4.820 -3.892 2.156 1.00 . A A . 6 PRO CD 1 1 6 1518 1 1 6 PRO CG C -4.150 -3.266 3.352 1.00 . A A . 6 PRO CG 1 1 6 1519 1 1 6 PRO HA H -2.565 -2.024 0.782 1.00 . A A . 6 PRO HA 1 1 6 1520 1 1 6 PRO HB2 H -2.300 -2.216 3.497 1.00 . A A . 6 PRO HB2 1 1 6 1521 1 1 6 PRO HB3 H -3.611 -1.316 2.711 1.00 . A A . 6 PRO HB3 1 1 6 1522 1 1 6 PRO HD2 H -4.977 -4.949 2.320 1.00 . A A . 6 PRO HD2 1 1 6 1523 1 1 6 PRO HD3 H -5.754 -3.396 1.942 1.00 . A A . 6 PRO HD3 1 1 6 1524 1 1 6 PRO HG2 H -3.647 -4.025 3.937 1.00 . A A . 6 PRO HG2 1 1 6 1525 1 1 6 PRO HG3 H -4.885 -2.760 3.957 1.00 . A A . 6 PRO HG3 1 1 6 1526 1 1 6 PRO N N -3.869 -3.672 1.061 1.00 . A A . 6 PRO N 1 1 6 1527 1 1 6 PRO O O -1.087 -4.107 2.687 1.00 . A A . 6 PRO O 1 1 6 1528 1 1 7 TRP C C 1.594 -4.029 -0.150 1.00 . A A . 7 TRP C 1 1 6 1529 1 1 7 TRP CA C 0.459 -4.751 0.572 1.00 . A A . 7 TRP CA 1 1 6 1530 1 1 7 TRP CB C 0.111 -6.047 -0.149 1.00 . A A . 7 TRP CB 1 1 6 1531 1 1 7 TRP CD1 C -1.005 -7.596 1.508 1.00 . A A . 7 TRP CD1 1 1 6 1532 1 1 7 TRP CD2 C 1.187 -8.036 1.254 1.00 . A A . 7 TRP CD2 1 1 6 1533 1 1 7 TRP CE2 C 0.692 -8.965 2.199 1.00 . A A . 7 TRP CE2 1 1 6 1534 1 1 7 TRP CE3 C 2.551 -8.097 0.914 1.00 . A A . 7 TRP CE3 1 1 6 1535 1 1 7 TRP CG C 0.089 -7.176 0.831 1.00 . A A . 7 TRP CG 1 1 6 1536 1 1 7 TRP CH2 C 2.874 -9.970 2.438 1.00 . A A . 7 TRP CH2 1 1 6 1537 1 1 7 TRP CZ2 C 1.521 -9.922 2.785 1.00 . A A . 7 TRP CZ2 1 1 6 1538 1 1 7 TRP CZ3 C 3.388 -9.059 1.504 1.00 . A A . 7 TRP CZ3 1 1 6 1539 1 1 7 TRP H H -1.103 -3.576 -0.337 1.00 . A A . 7 TRP H 1 1 6 1540 1 1 7 TRP HA H 0.732 -4.955 1.595 1.00 . A A . 7 TRP HA 1 1 6 1541 1 1 7 TRP HB2 H -0.859 -5.950 -0.610 1.00 . A A . 7 TRP HB2 1 1 6 1542 1 1 7 TRP HB3 H 0.853 -6.243 -0.908 1.00 . A A . 7 TRP HB3 1 1 6 1543 1 1 7 TRP HD1 H -1.995 -7.171 1.428 1.00 . A A . 7 TRP HD1 1 1 6 1544 1 1 7 TRP HE1 H -1.256 -9.144 2.915 1.00 . A A . 7 TRP HE1 1 1 6 1545 1 1 7 TRP HE3 H 2.957 -7.399 0.197 1.00 . A A . 7 TRP HE3 1 1 6 1546 1 1 7 TRP HH2 H 3.523 -10.708 2.886 1.00 . A A . 7 TRP HH2 1 1 6 1547 1 1 7 TRP HZ2 H 1.120 -10.623 3.504 1.00 . A A . 7 TRP HZ2 1 1 6 1548 1 1 7 TRP HZ3 H 4.433 -9.097 1.235 1.00 . A A . 7 TRP HZ3 1 1 6 1549 1 1 7 TRP N N -0.787 -3.930 0.519 1.00 . A A . 7 TRP N 1 1 6 1550 1 1 7 TRP NE1 N -0.648 -8.657 2.319 1.00 . A A . 7 TRP NE1 1 1 6 1551 1 1 7 TRP O O 2.174 -4.538 -1.089 1.00 . A A . 7 TRP O 1 1 6 1552 1 1 8 TRP C C 4.068 -1.688 0.667 1.00 . A A . 8 TRP C 1 1 6 1553 1 1 8 TRP CA C 3.006 -2.078 -0.366 1.00 . A A . 8 TRP CA 1 1 6 1554 1 1 8 TRP CB C 2.329 -0.833 -0.938 1.00 . A A . 8 TRP CB 1 1 6 1555 1 1 8 TRP CD1 C 3.900 0.855 -1.968 1.00 . A A . 8 TRP CD1 1 1 6 1556 1 1 8 TRP CD2 C 3.361 -0.805 -3.389 1.00 . A A . 8 TRP CD2 1 1 6 1557 1 1 8 TRP CE2 C 4.234 0.060 -4.088 1.00 . A A . 8 TRP CE2 1 1 6 1558 1 1 8 TRP CE3 C 2.871 -1.939 -4.062 1.00 . A A . 8 TRP CE3 1 1 6 1559 1 1 8 TRP CG C 3.164 -0.277 -2.045 1.00 . A A . 8 TRP CG 1 1 6 1560 1 1 8 TRP CH2 C 4.113 -1.320 -6.064 1.00 . A A . 8 TRP CH2 1 1 6 1561 1 1 8 TRP CZ2 C 4.608 -0.189 -5.409 1.00 . A A . 8 TRP CZ2 1 1 6 1562 1 1 8 TRP CZ3 C 3.247 -2.193 -5.391 1.00 . A A . 8 TRP CZ3 1 1 6 1563 1 1 8 TRP H H 1.428 -2.466 1.038 1.00 . A A . 8 TRP H 1 1 6 1564 1 1 8 TRP HA H 3.444 -2.654 -1.160 1.00 . A A . 8 TRP HA 1 1 6 1565 1 1 8 TRP HB2 H 1.353 -1.097 -1.318 1.00 . A A . 8 TRP HB2 1 1 6 1566 1 1 8 TRP HB3 H 2.225 -0.091 -0.159 1.00 . A A . 8 TRP HB3 1 1 6 1567 1 1 8 TRP HD1 H 3.979 1.495 -1.102 1.00 . A A . 8 TRP HD1 1 1 6 1568 1 1 8 TRP HE1 H 5.128 1.809 -3.389 1.00 . A A . 8 TRP HE1 1 1 6 1569 1 1 8 TRP HE3 H 2.204 -2.618 -3.553 1.00 . A A . 8 TRP HE3 1 1 6 1570 1 1 8 TRP HH2 H 4.397 -1.522 -7.085 1.00 . A A . 8 TRP HH2 1 1 6 1571 1 1 8 TRP HZ2 H 5.276 0.487 -5.923 1.00 . A A . 8 TRP HZ2 1 1 6 1572 1 1 8 TRP HZ3 H 2.865 -3.068 -5.898 1.00 . A A . 8 TRP HZ3 1 1 6 1573 1 1 8 TRP N N 1.911 -2.847 0.283 1.00 . A A . 8 TRP N 1 1 6 1574 1 1 8 TRP NE1 N 4.534 1.057 -3.180 1.00 . A A . 8 TRP NE1 1 1 6 1575 1 1 8 TRP O O 3.830 -0.853 1.517 1.00 . A A . 8 TRP O 1 1 6 1576 1 1 9 PRO C C 7.171 -0.878 0.986 1.00 . A A . 9 PRO C 1 1 6 1577 1 1 9 PRO CA C 6.321 -2.047 1.487 1.00 . A A . 9 PRO CA 1 1 6 1578 1 1 9 PRO CB C 7.115 -3.345 1.456 1.00 . A A . 9 PRO CB 1 1 6 1579 1 1 9 PRO CD C 5.560 -3.332 -0.430 1.00 . A A . 9 PRO CD 1 1 6 1580 1 1 9 PRO CG C 6.805 -3.983 0.130 1.00 . A A . 9 PRO CG 1 1 6 1581 1 1 9 PRO HA H 5.956 -1.856 2.480 1.00 . A A . 9 PRO HA 1 1 6 1582 1 1 9 PRO HB2 H 8.174 -3.136 1.536 1.00 . A A . 9 PRO HB2 1 1 6 1583 1 1 9 PRO HB3 H 6.800 -3.991 2.258 1.00 . A A . 9 PRO HB3 1 1 6 1584 1 1 9 PRO HD2 H 5.774 -2.874 -1.387 1.00 . A A . 9 PRO HD2 1 1 6 1585 1 1 9 PRO HD3 H 4.763 -4.051 -0.526 1.00 . A A . 9 PRO HD3 1 1 6 1586 1 1 9 PRO HG2 H 7.633 -3.835 -0.548 1.00 . A A . 9 PRO HG2 1 1 6 1587 1 1 9 PRO HG3 H 6.630 -5.040 0.267 1.00 . A A . 9 PRO HG3 1 1 6 1588 1 1 9 PRO N N 5.206 -2.315 0.558 1.00 . A A . 9 PRO N 1 1 6 1589 1 1 9 PRO O O 8.367 -0.832 1.191 1.00 . A A . 9 PRO O 1 1 6 1590 1 1 10 TRP C C 6.974 2.483 0.609 1.00 . A A . 10 TRP C 1 1 6 1591 1 1 10 TRP CA C 7.315 1.227 -0.191 1.00 . A A . 10 TRP CA 1 1 6 1592 1 1 10 TRP CB C 6.850 1.369 -1.638 1.00 . A A . 10 TRP CB 1 1 6 1593 1 1 10 TRP CD1 C 8.926 2.442 -2.615 1.00 . A A . 10 TRP CD1 1 1 6 1594 1 1 10 TRP CD2 C 8.471 0.429 -3.498 1.00 . A A . 10 TRP CD2 1 1 6 1595 1 1 10 TRP CE2 C 9.642 0.892 -4.138 1.00 . A A . 10 TRP CE2 1 1 6 1596 1 1 10 TRP CE3 C 7.959 -0.820 -3.867 1.00 . A A . 10 TRP CE3 1 1 6 1597 1 1 10 TRP CG C 8.036 1.424 -2.540 1.00 . A A . 10 TRP CG 1 1 6 1598 1 1 10 TRP CH2 C 9.764 -1.114 -5.473 1.00 . A A . 10 TRP CH2 1 1 6 1599 1 1 10 TRP CZ2 C 10.286 0.133 -5.116 1.00 . A A . 10 TRP CZ2 1 1 6 1600 1 1 10 TRP CZ3 C 8.601 -1.590 -4.849 1.00 . A A . 10 TRP CZ3 1 1 6 1601 1 1 10 TRP H H 5.599 -0.004 0.177 1.00 . A A . 10 TRP H 1 1 6 1602 1 1 10 TRP HA H 8.369 1.032 -0.162 1.00 . A A . 10 TRP HA 1 1 6 1603 1 1 10 TRP HB2 H 6.240 0.517 -1.901 1.00 . A A . 10 TRP HB2 1 1 6 1604 1 1 10 TRP HB3 H 6.271 2.266 -1.747 1.00 . A A . 10 TRP HB3 1 1 6 1605 1 1 10 TRP HD1 H 8.893 3.349 -2.030 1.00 . A A . 10 TRP HD1 1 1 6 1606 1 1 10 TRP HE1 H 10.640 2.694 -3.814 1.00 . A A . 10 TRP HE1 1 1 6 1607 1 1 10 TRP HE3 H 7.063 -1.187 -3.385 1.00 . A A . 10 TRP HE3 1 1 6 1608 1 1 10 TRP HH2 H 10.254 -1.710 -6.229 1.00 . A A . 10 TRP HH2 1 1 6 1609 1 1 10 TRP HZ2 H 11.181 0.505 -5.592 1.00 . A A . 10 TRP HZ2 1 1 6 1610 1 1 10 TRP HZ3 H 8.197 -2.554 -5.125 1.00 . A A . 10 TRP HZ3 1 1 6 1611 1 1 10 TRP N N 6.559 0.061 0.330 1.00 . A A . 10 TRP N 1 1 6 1612 1 1 10 TRP NE1 N 9.882 2.126 -3.565 1.00 . A A . 10 TRP NE1 1 1 6 1613 1 1 10 TRP O O 7.806 3.044 1.295 1.00 . A A . 10 TRP O 1 1 6 1614 1 1 11 ARG C C 4.098 3.847 2.107 1.00 . A A . 11 ARG C 1 1 6 1615 1 1 11 ARG CA C 5.343 4.144 1.272 1.00 . A A . 11 ARG CA 1 1 6 1616 1 1 11 ARG CB C 5.037 5.204 0.206 1.00 . A A . 11 ARG CB 1 1 6 1617 1 1 11 ARG CD C 3.805 5.590 -1.937 1.00 . A A . 11 ARG CD 1 1 6 1618 1 1 11 ARG CG C 4.533 4.548 -1.085 1.00 . A A . 11 ARG CG 1 1 6 1619 1 1 11 ARG CZ C 5.278 6.865 -3.374 1.00 . A A . 11 ARG CZ 1 1 6 1620 1 1 11 ARG H H 5.104 2.464 -0.029 1.00 . A A . 11 ARG H 1 1 6 1621 1 1 11 ARG HA H 6.144 4.477 1.907 1.00 . A A . 11 ARG HA 1 1 6 1622 1 1 11 ARG HB2 H 4.278 5.864 0.581 1.00 . A A . 11 ARG HB2 1 1 6 1623 1 1 11 ARG HB3 H 5.933 5.768 -0.005 1.00 . A A . 11 ARG HB3 1 1 6 1624 1 1 11 ARG HD2 H 3.489 5.153 -2.874 1.00 . A A . 11 ARG HD2 1 1 6 1625 1 1 11 ARG HD3 H 2.958 5.989 -1.402 1.00 . A A . 11 ARG HD3 1 1 6 1626 1 1 11 ARG HE H 5.119 7.219 -1.426 1.00 . A A . 11 ARG HE 1 1 6 1627 1 1 11 ARG HG2 H 5.373 4.152 -1.639 1.00 . A A . 11 ARG HG2 1 1 6 1628 1 1 11 ARG HG3 H 3.852 3.746 -0.841 1.00 . A A . 11 ARG HG3 1 1 6 1629 1 1 11 ARG HH11 H 3.795 8.097 -3.912 1.00 . A A . 11 ARG HH11 1 1 6 1630 1 1 11 ARG HH12 H 5.001 7.804 -5.120 1.00 . A A . 11 ARG HH12 1 1 6 1631 1 1 11 ARG HH21 H 6.872 5.680 -3.115 1.00 . A A . 11 ARG HH21 1 1 6 1632 1 1 11 ARG HH22 H 6.743 6.436 -4.670 1.00 . A A . 11 ARG HH22 1 1 6 1633 1 1 11 ARG N N 5.753 2.927 0.526 1.00 . A A . 11 ARG N 1 1 6 1634 1 1 11 ARG NE N 4.810 6.663 -2.173 1.00 . A A . 11 ARG NE 1 1 6 1635 1 1 11 ARG NH1 N 4.641 7.650 -4.200 1.00 . A A . 11 ARG NH1 1 1 6 1636 1 1 11 ARG NH2 N 6.384 6.282 -3.749 1.00 . A A . 11 ARG NH2 1 1 6 1637 1 1 11 ARG O O 3.041 4.405 1.890 1.00 . A A . 11 ARG O 1 1 6 1638 1 1 12 ARG C C 3.520 2.209 5.312 1.00 . A A . 12 ARG C 1 1 6 1639 1 1 12 ARG CA C 3.050 2.626 3.915 1.00 . A A . 12 ARG CA 1 1 6 1640 1 1 12 ARG CB C 2.370 1.453 3.207 1.00 . A A . 12 ARG CB 1 1 6 1641 1 1 12 ARG CD C 0.059 0.560 2.887 1.00 . A A . 12 ARG CD 1 1 6 1642 1 1 12 ARG CG C 1.047 1.132 3.905 1.00 . A A . 12 ARG CG 1 1 6 1643 1 1 12 ARG CZ C -1.546 1.977 1.755 1.00 . A A . 12 ARG CZ 1 1 6 1644 1 1 12 ARG H H 5.085 2.534 3.208 1.00 . A A . 12 ARG H 1 1 6 1645 1 1 12 ARG HA H 2.371 3.460 3.978 1.00 . A A . 12 ARG HA 1 1 6 1646 1 1 12 ARG HB2 H 2.180 1.717 2.176 1.00 . A A . 12 ARG HB2 1 1 6 1647 1 1 12 ARG HB3 H 3.014 0.588 3.245 1.00 . A A . 12 ARG HB3 1 1 6 1648 1 1 12 ARG HD2 H 0.515 0.513 1.907 1.00 . A A . 12 ARG HD2 1 1 6 1649 1 1 12 ARG HD3 H -0.276 -0.418 3.195 1.00 . A A . 12 ARG HD3 1 1 6 1650 1 1 12 ARG HE H -1.492 1.794 3.731 1.00 . A A . 12 ARG HE 1 1 6 1651 1 1 12 ARG HG2 H 1.220 0.408 4.688 1.00 . A A . 12 ARG HG2 1 1 6 1652 1 1 12 ARG HG3 H 0.638 2.034 4.333 1.00 . A A . 12 ARG HG3 1 1 6 1653 1 1 12 ARG HH11 H 0.203 2.779 1.196 1.00 . A A . 12 ARG HH11 1 1 6 1654 1 1 12 ARG HH12 H -1.108 2.988 0.083 1.00 . A A . 12 ARG HH12 1 1 6 1655 1 1 12 ARG HH21 H -3.400 1.284 2.050 1.00 . A A . 12 ARG HH21 1 1 6 1656 1 1 12 ARG HH22 H -3.147 2.141 0.566 1.00 . A A . 12 ARG HH22 1 1 6 1657 1 1 12 ARG N N 4.220 2.968 3.058 1.00 . A A . 12 ARG N 1 1 6 1658 1 1 12 ARG NE N -1.085 1.513 2.884 1.00 . A A . 12 ARG NE 1 1 6 1659 1 1 12 ARG NH1 N -0.756 2.632 0.948 1.00 . A A . 12 ARG NH1 1 1 6 1660 1 1 12 ARG NH2 N -2.795 1.786 1.432 1.00 . A A . 12 ARG NH2 1 1 6 1661 1 1 12 ARG O O 3.640 1.039 5.614 1.00 . A A . 12 ARG O 1 1 6 1662 1 1 13 LYS C C 3.067 2.828 8.515 1.00 . A A . 13 LYS C 1 1 6 1663 1 1 13 LYS CA C 4.249 2.817 7.542 1.00 . A A . 13 LYS CA 1 1 6 1664 1 1 13 LYS CB C 5.255 3.911 7.908 1.00 . A A . 13 LYS CB 1 1 6 1665 1 1 13 LYS CD C 7.535 3.090 7.302 1.00 . A A . 13 LYS CD 1 1 6 1666 1 1 13 LYS CE C 7.828 1.600 7.110 1.00 . A A . 13 LYS CE 1 1 6 1667 1 1 13 LYS CG C 6.534 3.270 8.446 1.00 . A A . 13 LYS CG 1 1 6 1668 1 1 13 LYS H H 3.685 4.098 5.903 1.00 . A A . 13 LYS H 1 1 6 1669 1 1 13 LYS HA H 4.734 1.854 7.549 1.00 . A A . 13 LYS HA 1 1 6 1670 1 1 13 LYS HB2 H 5.484 4.494 7.028 1.00 . A A . 13 LYS HB2 1 1 6 1671 1 1 13 LYS HB3 H 4.829 4.552 8.664 1.00 . A A . 13 LYS HB3 1 1 6 1672 1 1 13 LYS HD2 H 7.119 3.496 6.393 1.00 . A A . 13 LYS HD2 1 1 6 1673 1 1 13 LYS HD3 H 8.453 3.607 7.542 1.00 . A A . 13 LYS HD3 1 1 6 1674 1 1 13 LYS HE2 H 8.254 1.182 8.011 1.00 . A A . 13 LYS HE2 1 1 6 1675 1 1 13 LYS HE3 H 6.927 1.071 6.837 1.00 . A A . 13 LYS HE3 1 1 6 1676 1 1 13 LYS HG2 H 6.964 3.909 9.204 1.00 . A A . 13 LYS HG2 1 1 6 1677 1 1 13 LYS HG3 H 6.302 2.307 8.873 1.00 . A A . 13 LYS HG3 1 1 6 1678 1 1 13 LYS HZ1 H 8.725 0.631 5.501 1.00 . A A . 13 LYS HZ1 1 1 6 1679 1 1 13 LYS HZ2 H 9.774 1.645 6.372 1.00 . A A . 13 LYS HZ2 1 1 6 1680 1 1 13 LYS HZ3 H 8.618 2.314 5.322 1.00 . A A . 13 LYS HZ3 1 1 6 1681 1 1 13 LYS N N 3.789 3.160 6.166 1.00 . A A . 13 LYS N 1 1 6 1682 1 1 13 LYS NZ N 8.810 1.543 5.992 1.00 . A A . 13 LYS NZ 1 1 6 1683 1 1 13 LYS O O 3.141 3.408 9.580 1.00 . A A . 13 LYS O 1 1 6 1684 1 1 14 NH2 HN1 H 1.905 1.740 7.329 1.00 . A A . 14 NH2 HN1 1 1 6 1685 1 1 14 NH2 HN2 H 1.204 2.207 8.802 1.00 . A A . 14 NH2 HN2 1 1 6 1686 1 1 14 NH2 N N 1.967 2.206 8.188 1.00 . A A . 14 NH2 N 1 1 7 1687 1 1 1 ILE C C -10.420 -3.416 1.604 1.00 . A A . 1 ILE C 1 1 7 1688 1 1 1 ILE CA C -10.741 -4.910 1.701 1.00 . A A . 1 ILE CA 1 1 7 1689 1 1 1 ILE CB C -11.757 -5.311 0.633 1.00 . A A . 1 ILE CB 1 1 7 1690 1 1 1 ILE CD1 C -11.114 -7.724 0.677 1.00 . A A . 1 ILE CD1 1 1 7 1691 1 1 1 ILE CG1 C -12.254 -6.732 0.910 1.00 . A A . 1 ILE CG1 1 1 7 1692 1 1 1 ILE CG2 C -11.098 -5.262 -0.746 1.00 . A A . 1 ILE CG2 1 1 7 1693 1 1 1 ILE H1 H -11.302 -6.221 3.222 1.00 . A A . 1 ILE H1 1 1 7 1694 1 1 1 ILE H2 H -12.418 -4.971 2.936 1.00 . A A . 1 ILE H2 1 1 7 1695 1 1 1 ILE H3 H -10.966 -4.646 3.756 1.00 . A A . 1 ILE H3 1 1 7 1696 1 1 1 ILE HA H -9.843 -5.496 1.594 1.00 . A A . 1 ILE HA 1 1 7 1697 1 1 1 ILE HB H -12.593 -4.625 0.657 1.00 . A A . 1 ILE HB 1 1 7 1698 1 1 1 ILE HD11 H -10.171 -7.252 0.911 1.00 . A A . 1 ILE HD11 1 1 7 1699 1 1 1 ILE HD12 H -11.114 -8.037 -0.356 1.00 . A A . 1 ILE HD12 1 1 7 1700 1 1 1 ILE HD13 H -11.252 -8.587 1.313 1.00 . A A . 1 ILE HD13 1 1 7 1701 1 1 1 ILE HG12 H -12.590 -6.802 1.934 1.00 . A A . 1 ILE HG12 1 1 7 1702 1 1 1 ILE HG13 H -13.072 -6.964 0.245 1.00 . A A . 1 ILE HG13 1 1 7 1703 1 1 1 ILE HG21 H -10.033 -5.410 -0.640 1.00 . A A . 1 ILE HG21 1 1 7 1704 1 1 1 ILE HG22 H -11.284 -4.300 -1.200 1.00 . A A . 1 ILE HG22 1 1 7 1705 1 1 1 ILE HG23 H -11.509 -6.041 -1.369 1.00 . A A . 1 ILE HG23 1 1 7 1706 1 1 1 ILE N N -11.408 -5.210 3.002 1.00 . A A . 1 ILE N 1 1 7 1707 1 1 1 ILE O O -10.995 -2.601 2.298 1.00 . A A . 1 ILE O 1 1 7 1708 1 1 2 LEU C C -7.976 -1.451 -0.364 1.00 . A A . 2 LEU C 1 1 7 1709 1 1 2 LEU CA C -9.149 -1.610 0.605 1.00 . A A . 2 LEU CA 1 1 7 1710 1 1 2 LEU CB C -8.754 -1.155 2.010 1.00 . A A . 2 LEU CB 1 1 7 1711 1 1 2 LEU CD1 C -9.785 0.163 3.866 1.00 . A A . 2 LEU CD1 1 1 7 1712 1 1 2 LEU CD2 C -8.659 1.341 1.973 1.00 . A A . 2 LEU CD2 1 1 7 1713 1 1 2 LEU CG C -9.508 0.128 2.362 1.00 . A A . 2 LEU CG 1 1 7 1714 1 1 2 LEU H H -9.054 -3.723 0.196 1.00 . A A . 2 LEU H 1 1 7 1715 1 1 2 LEU HA H -9.999 -1.044 0.258 1.00 . A A . 2 LEU HA 1 1 7 1716 1 1 2 LEU HB2 H -9.003 -1.927 2.723 1.00 . A A . 2 LEU HB2 1 1 7 1717 1 1 2 LEU HB3 H -7.691 -0.965 2.041 1.00 . A A . 2 LEU HB3 1 1 7 1718 1 1 2 LEU HD11 H -9.445 1.104 4.273 1.00 . A A . 2 LEU HD11 1 1 7 1719 1 1 2 LEU HD12 H -9.259 -0.649 4.348 1.00 . A A . 2 LEU HD12 1 1 7 1720 1 1 2 LEU HD13 H -10.846 0.059 4.039 1.00 . A A . 2 LEU HD13 1 1 7 1721 1 1 2 LEU HD21 H -8.796 2.126 2.703 1.00 . A A . 2 LEU HD21 1 1 7 1722 1 1 2 LEU HD22 H -8.963 1.698 1.001 1.00 . A A . 2 LEU HD22 1 1 7 1723 1 1 2 LEU HD23 H -7.617 1.057 1.942 1.00 . A A . 2 LEU HD23 1 1 7 1724 1 1 2 LEU HG H -10.444 0.155 1.823 1.00 . A A . 2 LEU HG 1 1 7 1725 1 1 2 LEU N N -9.505 -3.051 0.747 1.00 . A A . 2 LEU N 1 1 7 1726 1 1 2 LEU O O -6.837 -1.700 -0.023 1.00 . A A . 2 LEU O 1 1 7 1727 1 1 3 LYS C C -6.469 -2.196 -2.846 1.00 . A A . 3 LYS C 1 1 7 1728 1 1 3 LYS CA C -7.161 -0.861 -2.570 1.00 . A A . 3 LYS CA 1 1 7 1729 1 1 3 LYS CB C -6.185 0.128 -1.930 1.00 . A A . 3 LYS CB 1 1 7 1730 1 1 3 LYS CD C -6.072 2.575 -1.442 1.00 . A A . 3 LYS CD 1 1 7 1731 1 1 3 LYS CE C -5.831 3.096 -0.024 1.00 . A A . 3 LYS CE 1 1 7 1732 1 1 3 LYS CG C -6.958 1.331 -1.385 1.00 . A A . 3 LYS CG 1 1 7 1733 1 1 3 LYS H H -9.180 -0.849 -1.817 1.00 . A A . 3 LYS H 1 1 7 1734 1 1 3 LYS HA H -7.556 -0.448 -3.485 1.00 . A A . 3 LYS HA 1 1 7 1735 1 1 3 LYS HB2 H -5.658 -0.358 -1.122 1.00 . A A . 3 LYS HB2 1 1 7 1736 1 1 3 LYS HB3 H -5.476 0.465 -2.671 1.00 . A A . 3 LYS HB3 1 1 7 1737 1 1 3 LYS HD2 H -5.125 2.323 -1.898 1.00 . A A . 3 LYS HD2 1 1 7 1738 1 1 3 LYS HD3 H -6.560 3.341 -2.026 1.00 . A A . 3 LYS HD3 1 1 7 1739 1 1 3 LYS HE2 H -5.496 4.124 -0.054 1.00 . A A . 3 LYS HE2 1 1 7 1740 1 1 3 LYS HE3 H -6.729 3.009 0.568 1.00 . A A . 3 LYS HE3 1 1 7 1741 1 1 3 LYS HG2 H -7.843 1.490 -1.985 1.00 . A A . 3 LYS HG2 1 1 7 1742 1 1 3 LYS HG3 H -7.245 1.142 -0.362 1.00 . A A . 3 LYS HG3 1 1 7 1743 1 1 3 LYS HZ1 H -5.048 1.220 0.429 1.00 . A A . 3 LYS HZ1 1 1 7 1744 1 1 3 LYS HZ2 H -4.628 2.434 1.542 1.00 . A A . 3 LYS HZ2 1 1 7 1745 1 1 3 LYS HZ3 H -3.878 2.378 0.018 1.00 . A A . 3 LYS HZ3 1 1 7 1746 1 1 3 LYS N N -8.252 -1.039 -1.569 1.00 . A A . 3 LYS N 1 1 7 1747 1 1 3 LYS NZ N -4.766 2.215 0.534 1.00 . A A . 3 LYS NZ 1 1 7 1748 1 1 3 LYS O O -5.281 -2.345 -2.645 1.00 . A A . 3 LYS O 1 1 7 1749 1 1 4 LYS C C -5.577 -4.866 -2.581 1.00 . A A . 4 LYS C 1 1 7 1750 1 1 4 LYS CA C -6.621 -4.494 -3.621 1.00 . A A . 4 LYS CA 1 1 7 1751 1 1 4 LYS CB C -5.998 -4.323 -4.990 1.00 . A A . 4 LYS CB 1 1 7 1752 1 1 4 LYS CD C -4.358 -5.804 -6.157 1.00 . A A . 4 LYS CD 1 1 7 1753 1 1 4 LYS CE C -4.007 -4.545 -6.956 1.00 . A A . 4 LYS CE 1 1 7 1754 1 1 4 LYS CG C -5.791 -5.692 -5.632 1.00 . A A . 4 LYS CG 1 1 7 1755 1 1 4 LYS H H -8.158 -3.013 -3.477 1.00 . A A . 4 LYS H 1 1 7 1756 1 1 4 LYS HA H -7.393 -5.246 -3.656 1.00 . A A . 4 LYS HA 1 1 7 1757 1 1 4 LYS HB2 H -6.660 -3.734 -5.599 1.00 . A A . 4 LYS HB2 1 1 7 1758 1 1 4 LYS HB3 H -5.053 -3.820 -4.894 1.00 . A A . 4 LYS HB3 1 1 7 1759 1 1 4 LYS HD2 H -3.676 -5.905 -5.326 1.00 . A A . 4 LYS HD2 1 1 7 1760 1 1 4 LYS HD3 H -4.276 -6.669 -6.799 1.00 . A A . 4 LYS HD3 1 1 7 1761 1 1 4 LYS HE2 H -4.895 -3.956 -7.138 1.00 . A A . 4 LYS HE2 1 1 7 1762 1 1 4 LYS HE3 H -3.267 -3.960 -6.432 1.00 . A A . 4 LYS HE3 1 1 7 1763 1 1 4 LYS HG2 H -5.966 -6.461 -4.894 1.00 . A A . 4 LYS HG2 1 1 7 1764 1 1 4 LYS HG3 H -6.485 -5.814 -6.449 1.00 . A A . 4 LYS HG3 1 1 7 1765 1 1 4 LYS HZ1 H -4.192 -5.079 -8.960 1.00 . A A . 4 LYS HZ1 1 1 7 1766 1 1 4 LYS HZ2 H -3.059 -6.006 -8.098 1.00 . A A . 4 LYS HZ2 1 1 7 1767 1 1 4 LYS HZ3 H -2.684 -4.415 -8.558 1.00 . A A . 4 LYS HZ3 1 1 7 1768 1 1 4 LYS N N -7.211 -3.164 -3.316 1.00 . A A . 4 LYS N 1 1 7 1769 1 1 4 LYS NZ N -3.443 -5.050 -8.240 1.00 . A A . 4 LYS NZ 1 1 7 1770 1 1 4 LYS O O -4.395 -4.940 -2.853 1.00 . A A . 4 LYS O 1 1 7 1771 1 1 5 TRP C C -3.948 -4.456 -0.196 1.00 . A A . 5 TRP C 1 1 7 1772 1 1 5 TRP CA C -5.086 -5.476 -0.293 1.00 . A A . 5 TRP CA 1 1 7 1773 1 1 5 TRP CB C -4.543 -6.847 -0.689 1.00 . A A . 5 TRP CB 1 1 7 1774 1 1 5 TRP CD1 C -6.229 -8.716 -0.930 1.00 . A A . 5 TRP CD1 1 1 7 1775 1 1 5 TRP CD2 C -5.690 -8.307 1.216 1.00 . A A . 5 TRP CD2 1 1 7 1776 1 1 5 TRP CE2 C -6.631 -9.363 1.229 1.00 . A A . 5 TRP CE2 1 1 7 1777 1 1 5 TRP CE3 C -5.185 -7.852 2.447 1.00 . A A . 5 TRP CE3 1 1 7 1778 1 1 5 TRP CG C -5.452 -7.914 -0.167 1.00 . A A . 5 TRP CG 1 1 7 1779 1 1 5 TRP CH2 C -6.544 -9.486 3.637 1.00 . A A . 5 TRP CH2 1 1 7 1780 1 1 5 TRP CZ2 C -7.055 -9.949 2.421 1.00 . A A . 5 TRP CZ2 1 1 7 1781 1 1 5 TRP CZ3 C -5.611 -8.440 3.650 1.00 . A A . 5 TRP CZ3 1 1 7 1782 1 1 5 TRP H H -6.982 -5.030 -1.223 1.00 . A A . 5 TRP H 1 1 7 1783 1 1 5 TRP HA H -5.614 -5.545 0.645 1.00 . A A . 5 TRP HA 1 1 7 1784 1 1 5 TRP HB2 H -4.491 -6.915 -1.765 1.00 . A A . 5 TRP HB2 1 1 7 1785 1 1 5 TRP HB3 H -3.557 -6.977 -0.270 1.00 . A A . 5 TRP HB3 1 1 7 1786 1 1 5 TRP HD1 H -6.292 -8.690 -2.007 1.00 . A A . 5 TRP HD1 1 1 7 1787 1 1 5 TRP HE1 H -7.562 -10.261 -0.405 1.00 . A A . 5 TRP HE1 1 1 7 1788 1 1 5 TRP HE3 H -4.466 -7.047 2.467 1.00 . A A . 5 TRP HE3 1 1 7 1789 1 1 5 TRP HH2 H -6.867 -9.934 4.565 1.00 . A A . 5 TRP HH2 1 1 7 1790 1 1 5 TRP HZ2 H -7.774 -10.755 2.404 1.00 . A A . 5 TRP HZ2 1 1 7 1791 1 1 5 TRP HZ3 H -5.216 -8.084 4.590 1.00 . A A . 5 TRP HZ3 1 1 7 1792 1 1 5 TRP N N -6.021 -5.101 -1.392 1.00 . A A . 5 TRP N 1 1 7 1793 1 1 5 TRP NE1 N -6.929 -9.577 -0.103 1.00 . A A . 5 TRP NE1 1 1 7 1794 1 1 5 TRP O O -3.050 -4.447 -1.014 1.00 . A A . 5 TRP O 1 1 7 1795 1 1 6 PRO C C -1.693 -3.223 1.527 1.00 . A A . 6 PRO C 1 1 7 1796 1 1 6 PRO CA C -2.991 -2.589 1.022 1.00 . A A . 6 PRO CA 1 1 7 1797 1 1 6 PRO CB C -3.605 -1.683 2.083 1.00 . A A . 6 PRO CB 1 1 7 1798 1 1 6 PRO CD C -5.079 -3.581 1.831 1.00 . A A . 6 PRO CD 1 1 7 1799 1 1 6 PRO CG C -4.586 -2.546 2.811 1.00 . A A . 6 PRO CG 1 1 7 1800 1 1 6 PRO HA H -2.818 -2.031 0.116 1.00 . A A . 6 PRO HA 1 1 7 1801 1 1 6 PRO HB2 H -2.839 -1.325 2.759 1.00 . A A . 6 PRO HB2 1 1 7 1802 1 1 6 PRO HB3 H -4.114 -0.855 1.618 1.00 . A A . 6 PRO HB3 1 1 7 1803 1 1 6 PRO HD2 H -5.183 -4.541 2.317 1.00 . A A . 6 PRO HD2 1 1 7 1804 1 1 6 PRO HD3 H -6.013 -3.272 1.391 1.00 . A A . 6 PRO HD3 1 1 7 1805 1 1 6 PRO HG2 H -4.100 -3.028 3.649 1.00 . A A . 6 PRO HG2 1 1 7 1806 1 1 6 PRO HG3 H -5.417 -1.952 3.159 1.00 . A A . 6 PRO HG3 1 1 7 1807 1 1 6 PRO N N -4.027 -3.627 0.809 1.00 . A A . 6 PRO N 1 1 7 1808 1 1 6 PRO O O -1.422 -3.251 2.710 1.00 . A A . 6 PRO O 1 1 7 1809 1 1 7 TRP C C 1.560 -3.754 0.285 1.00 . A A . 7 TRP C 1 1 7 1810 1 1 7 TRP CA C 0.391 -4.363 1.054 1.00 . A A . 7 TRP CA 1 1 7 1811 1 1 7 TRP CB C 0.237 -5.838 0.705 1.00 . A A . 7 TRP CB 1 1 7 1812 1 1 7 TRP CD1 C -1.013 -7.056 2.531 1.00 . A A . 7 TRP CD1 1 1 7 1813 1 1 7 TRP CD2 C 1.219 -7.133 2.811 1.00 . A A . 7 TRP CD2 1 1 7 1814 1 1 7 TRP CE2 C 0.649 -7.847 3.891 1.00 . A A . 7 TRP CE2 1 1 7 1815 1 1 7 TRP CE3 C 2.620 -7.030 2.748 1.00 . A A . 7 TRP CE3 1 1 7 1816 1 1 7 TRP CG C 0.142 -6.641 1.961 1.00 . A A . 7 TRP CG 1 1 7 1817 1 1 7 TRP CH2 C 2.832 -8.325 4.800 1.00 . A A . 7 TRP CH2 1 1 7 1818 1 1 7 TRP CZ2 C 1.441 -8.437 4.876 1.00 . A A . 7 TRP CZ2 1 1 7 1819 1 1 7 TRP CZ3 C 3.421 -7.623 3.739 1.00 . A A . 7 TRP CZ3 1 1 7 1820 1 1 7 TRP H H -1.133 -3.693 -0.314 1.00 . A A . 7 TRP H 1 1 7 1821 1 1 7 TRP HA H 0.538 -4.246 2.116 1.00 . A A . 7 TRP HA 1 1 7 1822 1 1 7 TRP HB2 H -0.658 -5.974 0.119 1.00 . A A . 7 TRP HB2 1 1 7 1823 1 1 7 TRP HB3 H 1.096 -6.160 0.135 1.00 . A A . 7 TRP HB3 1 1 7 1824 1 1 7 TRP HD1 H -2.005 -6.860 2.154 1.00 . A A . 7 TRP HD1 1 1 7 1825 1 1 7 TRP HE1 H -1.372 -8.182 4.275 1.00 . A A . 7 TRP HE1 1 1 7 1826 1 1 7 TRP HE3 H 3.082 -6.491 1.935 1.00 . A A . 7 TRP HE3 1 1 7 1827 1 1 7 TRP HH2 H 3.453 -8.778 5.558 1.00 . A A . 7 TRP HH2 1 1 7 1828 1 1 7 TRP HZ2 H 0.983 -8.977 5.692 1.00 . A A . 7 TRP HZ2 1 1 7 1829 1 1 7 TRP HZ3 H 4.496 -7.537 3.682 1.00 . A A . 7 TRP HZ3 1 1 7 1830 1 1 7 TRP N N -0.892 -3.728 0.634 1.00 . A A . 7 TRP N 1 1 7 1831 1 1 7 TRP NE1 N -0.714 -7.771 3.677 1.00 . A A . 7 TRP NE1 1 1 7 1832 1 1 7 TRP O O 2.308 -4.441 -0.384 1.00 . A A . 7 TRP O 1 1 7 1833 1 1 8 TRP C C 3.988 -1.505 0.625 1.00 . A A . 8 TRP C 1 1 7 1834 1 1 8 TRP CA C 2.838 -1.798 -0.342 1.00 . A A . 8 TRP CA 1 1 7 1835 1 1 8 TRP CB C 2.243 -0.497 -0.876 1.00 . A A . 8 TRP CB 1 1 7 1836 1 1 8 TRP CD1 C 3.879 1.040 -2.033 1.00 . A A . 8 TRP CD1 1 1 7 1837 1 1 8 TRP CD2 C 3.107 -0.579 -3.390 1.00 . A A . 8 TRP CD2 1 1 7 1838 1 1 8 TRP CE2 C 4.001 0.201 -4.159 1.00 . A A . 8 TRP CE2 1 1 7 1839 1 1 8 TRP CE3 C 2.479 -1.673 -4.012 1.00 . A A . 8 TRP CE3 1 1 7 1840 1 1 8 TRP CG C 3.046 -0.024 -2.044 1.00 . A A . 8 TRP CG 1 1 7 1841 1 1 8 TRP CH2 C 3.631 -1.182 -6.101 1.00 . A A . 8 TRP CH2 1 1 7 1842 1 1 8 TRP CZ2 C 4.264 -0.091 -5.498 1.00 . A A . 8 TRP CZ2 1 1 7 1843 1 1 8 TRP CZ3 C 2.740 -1.971 -5.358 1.00 . A A . 8 TRP CZ3 1 1 7 1844 1 1 8 TRP H H 1.106 -1.946 0.923 1.00 . A A . 8 TRP H 1 1 7 1845 1 1 8 TRP HA H 3.177 -2.411 -1.157 1.00 . A A . 8 TRP HA 1 1 7 1846 1 1 8 TRP HB2 H 1.222 -0.669 -1.185 1.00 . A A . 8 TRP HB2 1 1 7 1847 1 1 8 TRP HB3 H 2.262 0.254 -0.099 1.00 . A A . 8 TRP HB3 1 1 7 1848 1 1 8 TRP HD1 H 4.071 1.680 -1.184 1.00 . A A . 8 TRP HD1 1 1 7 1849 1 1 8 TRP HE1 H 5.086 1.873 -3.546 1.00 . A A . 8 TRP HE1 1 1 7 1850 1 1 8 TRP HE3 H 1.791 -2.287 -3.449 1.00 . A A . 8 TRP HE3 1 1 7 1851 1 1 8 TRP HH2 H 3.829 -1.416 -7.137 1.00 . A A . 8 TRP HH2 1 1 7 1852 1 1 8 TRP HZ2 H 4.950 0.521 -6.064 1.00 . A A . 8 TRP HZ2 1 1 7 1853 1 1 8 TRP HZ3 H 2.253 -2.814 -5.827 1.00 . A A . 8 TRP HZ3 1 1 7 1854 1 1 8 TRP N N 1.721 -2.470 0.378 1.00 . A A . 8 TRP N 1 1 7 1855 1 1 8 TRP NE1 N 4.446 1.177 -3.288 1.00 . A A . 8 TRP NE1 1 1 7 1856 1 1 8 TRP O O 3.868 -0.666 1.497 1.00 . A A . 8 TRP O 1 1 7 1857 1 1 9 PRO C C 7.145 -0.905 0.766 1.00 . A A . 9 PRO C 1 1 7 1858 1 1 9 PRO CA C 6.258 -2.034 1.295 1.00 . A A . 9 PRO CA 1 1 7 1859 1 1 9 PRO CB C 6.966 -3.377 1.189 1.00 . A A . 9 PRO CB 1 1 7 1860 1 1 9 PRO CD C 5.286 -3.238 -0.581 1.00 . A A . 9 PRO CD 1 1 7 1861 1 1 9 PRO CG C 6.531 -3.964 -0.125 1.00 . A A . 9 PRO CG 1 1 7 1862 1 1 9 PRO HA H 5.968 -1.843 2.313 1.00 . A A . 9 PRO HA 1 1 7 1863 1 1 9 PRO HB2 H 8.038 -3.236 1.202 1.00 . A A . 9 PRO HB2 1 1 7 1864 1 1 9 PRO HB3 H 6.664 -4.021 1.998 1.00 . A A . 9 PRO HB3 1 1 7 1865 1 1 9 PRO HD2 H 5.447 -2.785 -1.549 1.00 . A A . 9 PRO HD2 1 1 7 1866 1 1 9 PRO HD3 H 4.442 -3.911 -0.613 1.00 . A A . 9 PRO HD3 1 1 7 1867 1 1 9 PRO HG2 H 7.317 -3.840 -0.856 1.00 . A A . 9 PRO HG2 1 1 7 1868 1 1 9 PRO HG3 H 6.312 -5.014 0.000 1.00 . A A . 9 PRO HG3 1 1 7 1869 1 1 9 PRO N N 5.070 -2.211 0.437 1.00 . A A . 9 PRO N 1 1 7 1870 1 1 9 PRO O O 8.346 -0.904 0.949 1.00 . A A . 9 PRO O 1 1 7 1871 1 1 10 TRP C C 7.108 2.444 0.386 1.00 . A A . 10 TRP C 1 1 7 1872 1 1 10 TRP CA C 7.346 1.181 -0.442 1.00 . A A . 10 TRP CA 1 1 7 1873 1 1 10 TRP CB C 6.814 1.362 -1.859 1.00 . A A . 10 TRP CB 1 1 7 1874 1 1 10 TRP CD1 C 8.858 2.423 -2.902 1.00 . A A . 10 TRP CD1 1 1 7 1875 1 1 10 TRP CD2 C 8.320 0.450 -3.825 1.00 . A A . 10 TRP CD2 1 1 7 1876 1 1 10 TRP CE2 C 9.467 0.910 -4.507 1.00 . A A . 10 TRP CE2 1 1 7 1877 1 1 10 TRP CE3 C 7.764 -0.776 -4.203 1.00 . A A . 10 TRP CE3 1 1 7 1878 1 1 10 TRP CG C 7.954 1.422 -2.816 1.00 . A A . 10 TRP CG 1 1 7 1879 1 1 10 TRP CH2 C 9.482 -1.055 -5.908 1.00 . A A . 10 TRP CH2 1 1 7 1880 1 1 10 TRP CZ2 C 10.047 0.171 -5.538 1.00 . A A . 10 TRP CZ2 1 1 7 1881 1 1 10 TRP CZ3 C 8.340 -1.528 -5.241 1.00 . A A . 10 TRP CZ3 1 1 7 1882 1 1 10 TRP H H 5.595 0.017 -0.025 1.00 . A A . 10 TRP H 1 1 7 1883 1 1 10 TRP HA H 8.388 0.934 -0.468 1.00 . A A . 10 TRP HA 1 1 7 1884 1 1 10 TRP HB2 H 6.179 0.526 -2.112 1.00 . A A . 10 TRP HB2 1 1 7 1885 1 1 10 TRP HB3 H 6.244 2.273 -1.919 1.00 . A A . 10 TRP HB3 1 1 7 1886 1 1 10 TRP HD1 H 8.873 3.311 -2.288 1.00 . A A . 10 TRP HD1 1 1 7 1887 1 1 10 TRP HE1 H 10.518 2.682 -4.177 1.00 . A A . 10 TRP HE1 1 1 7 1888 1 1 10 TRP HE3 H 6.885 -1.141 -3.689 1.00 . A A . 10 TRP HE3 1 1 7 1889 1 1 10 TRP HH2 H 9.922 -1.635 -6.704 1.00 . A A . 10 TRP HH2 1 1 7 1890 1 1 10 TRP HZ2 H 10.926 0.541 -6.047 1.00 . A A . 10 TRP HZ2 1 1 7 1891 1 1 10 TRP HZ3 H 7.904 -2.474 -5.527 1.00 . A A . 10 TRP HZ3 1 1 7 1892 1 1 10 TRP N N 6.558 0.048 0.110 1.00 . A A . 10 TRP N 1 1 7 1893 1 1 10 TRP NE1 N 9.761 2.121 -3.908 1.00 . A A . 10 TRP NE1 1 1 7 1894 1 1 10 TRP O O 8.031 3.150 0.745 1.00 . A A . 10 TRP O 1 1 7 1895 1 1 11 ARG C C 4.810 3.551 2.757 1.00 . A A . 11 ARG C 1 1 7 1896 1 1 11 ARG CA C 5.562 3.945 1.488 1.00 . A A . 11 ARG CA 1 1 7 1897 1 1 11 ARG CB C 4.680 4.799 0.580 1.00 . A A . 11 ARG CB 1 1 7 1898 1 1 11 ARG CD C 5.793 7.015 0.890 1.00 . A A . 11 ARG CD 1 1 7 1899 1 1 11 ARG CG C 5.530 5.875 -0.097 1.00 . A A . 11 ARG CG 1 1 7 1900 1 1 11 ARG CZ C 7.482 8.694 0.455 1.00 . A A . 11 ARG CZ 1 1 7 1901 1 1 11 ARG H H 5.154 2.149 0.386 1.00 . A A . 11 ARG H 1 1 7 1902 1 1 11 ARG HA H 6.465 4.476 1.738 1.00 . A A . 11 ARG HA 1 1 7 1903 1 1 11 ARG HB2 H 4.227 4.171 -0.175 1.00 . A A . 11 ARG HB2 1 1 7 1904 1 1 11 ARG HB3 H 3.908 5.268 1.166 1.00 . A A . 11 ARG HB3 1 1 7 1905 1 1 11 ARG HD2 H 4.866 7.339 1.343 1.00 . A A . 11 ARG HD2 1 1 7 1906 1 1 11 ARG HD3 H 6.494 6.703 1.648 1.00 . A A . 11 ARG HD3 1 1 7 1907 1 1 11 ARG HE H 5.945 8.384 -0.765 1.00 . A A . 11 ARG HE 1 1 7 1908 1 1 11 ARG HG2 H 6.470 5.445 -0.411 1.00 . A A . 11 ARG HG2 1 1 7 1909 1 1 11 ARG HG3 H 5.005 6.260 -0.958 1.00 . A A . 11 ARG HG3 1 1 7 1910 1 1 11 ARG HH11 H 8.530 6.994 0.573 1.00 . A A . 11 ARG HH11 1 1 7 1911 1 1 11 ARG HH12 H 9.395 8.435 0.986 1.00 . A A . 11 ARG HH12 1 1 7 1912 1 1 11 ARG HH21 H 6.691 10.533 0.426 1.00 . A A . 11 ARG HH21 1 1 7 1913 1 1 11 ARG HH22 H 8.353 10.441 0.903 1.00 . A A . 11 ARG HH22 1 1 7 1914 1 1 11 ARG N N 5.875 2.731 0.687 1.00 . A A . 11 ARG N 1 1 7 1915 1 1 11 ARG NE N 6.382 8.107 0.068 1.00 . A A . 11 ARG NE 1 1 7 1916 1 1 11 ARG NH1 N 8.552 7.986 0.690 1.00 . A A . 11 ARG NH1 1 1 7 1917 1 1 11 ARG NH2 N 7.511 9.991 0.607 1.00 . A A . 11 ARG NH2 1 1 7 1918 1 1 11 ARG O O 3.677 3.939 2.971 1.00 . A A . 11 ARG O 1 1 7 1919 1 1 12 ARG C C 4.415 3.570 5.713 1.00 . A A . 12 ARG C 1 1 7 1920 1 1 12 ARG CA C 4.772 2.351 4.859 1.00 . A A . 12 ARG CA 1 1 7 1921 1 1 12 ARG CB C 5.807 1.480 5.574 1.00 . A A . 12 ARG CB 1 1 7 1922 1 1 12 ARG CD C 6.122 -0.247 7.352 1.00 . A A . 12 ARG CD 1 1 7 1923 1 1 12 ARG CG C 5.146 0.772 6.757 1.00 . A A . 12 ARG CG 1 1 7 1924 1 1 12 ARG CZ C 6.309 -1.256 9.545 1.00 . A A . 12 ARG CZ 1 1 7 1925 1 1 12 ARG H H 6.347 2.487 3.392 1.00 . A A . 12 ARG H 1 1 7 1926 1 1 12 ARG HA H 3.889 1.770 4.643 1.00 . A A . 12 ARG HA 1 1 7 1927 1 1 12 ARG HB2 H 6.196 0.746 4.883 1.00 . A A . 12 ARG HB2 1 1 7 1928 1 1 12 ARG HB3 H 6.614 2.102 5.933 1.00 . A A . 12 ARG HB3 1 1 7 1929 1 1 12 ARG HD2 H 6.038 -1.193 6.833 1.00 . A A . 12 ARG HD2 1 1 7 1930 1 1 12 ARG HD3 H 7.134 0.125 7.298 1.00 . A A . 12 ARG HD3 1 1 7 1931 1 1 12 ARG HE H 4.980 0.158 9.130 1.00 . A A . 12 ARG HE 1 1 7 1932 1 1 12 ARG HG2 H 4.882 1.498 7.511 1.00 . A A . 12 ARG HG2 1 1 7 1933 1 1 12 ARG HG3 H 4.258 0.260 6.421 1.00 . A A . 12 ARG HG3 1 1 7 1934 1 1 12 ARG HH11 H 8.029 -1.200 8.522 1.00 . A A . 12 ARG HH11 1 1 7 1935 1 1 12 ARG HH12 H 8.007 -2.259 9.891 1.00 . A A . 12 ARG HH12 1 1 7 1936 1 1 12 ARG HH21 H 4.732 -1.514 10.750 1.00 . A A . 12 ARG HH21 1 1 7 1937 1 1 12 ARG HH22 H 6.140 -2.438 11.153 1.00 . A A . 12 ARG HH22 1 1 7 1938 1 1 12 ARG N N 5.436 2.783 3.597 1.00 . A A . 12 ARG N 1 1 7 1939 1 1 12 ARG NE N 5.707 -0.393 8.774 1.00 . A A . 12 ARG NE 1 1 7 1940 1 1 12 ARG NH1 N 7.545 -1.598 9.300 1.00 . A A . 12 ARG NH1 1 1 7 1941 1 1 12 ARG NH2 N 5.678 -1.777 10.562 1.00 . A A . 12 ARG NH2 1 1 7 1942 1 1 12 ARG O O 5.212 4.471 5.891 1.00 . A A . 12 ARG O 1 1 7 1943 1 1 13 LYS C C 1.588 4.406 7.924 1.00 . A A . 13 LYS C 1 1 7 1944 1 1 13 LYS CA C 2.816 4.769 7.085 1.00 . A A . 13 LYS CA 1 1 7 1945 1 1 13 LYS CB C 2.478 5.880 6.092 1.00 . A A . 13 LYS CB 1 1 7 1946 1 1 13 LYS CD C 2.908 8.300 6.548 1.00 . A A . 13 LYS CD 1 1 7 1947 1 1 13 LYS CE C 3.834 9.057 7.503 1.00 . A A . 13 LYS CE 1 1 7 1948 1 1 13 LYS CG C 3.552 6.967 6.158 1.00 . A A . 13 LYS CG 1 1 7 1949 1 1 13 LYS H H 2.595 2.871 6.087 1.00 . A A . 13 LYS H 1 1 7 1950 1 1 13 LYS HA H 3.630 5.076 7.722 1.00 . A A . 13 LYS HA 1 1 7 1951 1 1 13 LYS HB2 H 2.439 5.471 5.093 1.00 . A A . 13 LYS HB2 1 1 7 1952 1 1 13 LYS HB3 H 1.519 6.308 6.344 1.00 . A A . 13 LYS HB3 1 1 7 1953 1 1 13 LYS HD2 H 2.742 8.893 5.660 1.00 . A A . 13 LYS HD2 1 1 7 1954 1 1 13 LYS HD3 H 1.963 8.114 7.038 1.00 . A A . 13 LYS HD3 1 1 7 1955 1 1 13 LYS HE2 H 3.476 8.968 8.520 1.00 . A A . 13 LYS HE2 1 1 7 1956 1 1 13 LYS HE3 H 4.844 8.684 7.424 1.00 . A A . 13 LYS HE3 1 1 7 1957 1 1 13 LYS HG2 H 4.294 6.695 6.896 1.00 . A A . 13 LYS HG2 1 1 7 1958 1 1 13 LYS HG3 H 4.023 7.068 5.193 1.00 . A A . 13 LYS HG3 1 1 7 1959 1 1 13 LYS HZ1 H 2.784 10.759 6.930 1.00 . A A . 13 LYS HZ1 1 1 7 1960 1 1 13 LYS HZ2 H 4.280 10.569 6.146 1.00 . A A . 13 LYS HZ2 1 1 7 1961 1 1 13 LYS HZ3 H 4.224 11.084 7.764 1.00 . A A . 13 LYS HZ3 1 1 7 1962 1 1 13 LYS N N 3.222 3.607 6.242 1.00 . A A . 13 LYS N 1 1 7 1963 1 1 13 LYS NZ N 3.775 10.474 7.052 1.00 . A A . 13 LYS NZ 1 1 7 1964 1 1 13 LYS O O 0.473 4.745 7.578 1.00 . A A . 13 LYS O 1 1 7 1965 1 1 14 NH2 HN1 H 2.644 3.449 9.306 1.00 . A A . 14 NH2 HN1 1 1 7 1966 1 1 14 NH2 HN2 H 0.967 3.484 9.570 1.00 . A A . 14 NH2 HN2 1 1 7 1967 1 1 14 NH2 N N 1.746 3.723 9.025 1.00 . A A . 14 NH2 N 1 1 8 1968 1 1 1 ILE C C -12.242 2.426 -2.827 1.00 . A A . 1 ILE C 1 1 8 1969 1 1 1 ILE CA C -13.504 2.746 -3.632 1.00 . A A . 1 ILE CA 1 1 8 1970 1 1 1 ILE CB C -13.816 4.241 -3.568 1.00 . A A . 1 ILE CB 1 1 8 1971 1 1 1 ILE CD1 C -13.498 5.931 -1.755 1.00 . A A . 1 ILE CD1 1 1 8 1972 1 1 1 ILE CG1 C -14.193 4.622 -2.134 1.00 . A A . 1 ILE CG1 1 1 8 1973 1 1 1 ILE CG2 C -14.985 4.557 -4.502 1.00 . A A . 1 ILE CG2 1 1 8 1974 1 1 1 ILE H1 H -14.507 1.907 -2.009 1.00 . A A . 1 ILE H1 1 1 8 1975 1 1 1 ILE H2 H -14.861 1.171 -3.499 1.00 . A A . 1 ILE H2 1 1 8 1976 1 1 1 ILE H3 H -15.522 2.689 -3.119 1.00 . A A . 1 ILE H3 1 1 8 1977 1 1 1 ILE HA H -13.386 2.438 -4.658 1.00 . A A . 1 ILE HA 1 1 8 1978 1 1 1 ILE HB H -12.947 4.804 -3.877 1.00 . A A . 1 ILE HB 1 1 8 1979 1 1 1 ILE HD11 H -12.901 6.277 -2.586 1.00 . A A . 1 ILE HD11 1 1 8 1980 1 1 1 ILE HD12 H -12.860 5.764 -0.900 1.00 . A A . 1 ILE HD12 1 1 8 1981 1 1 1 ILE HD13 H -14.240 6.676 -1.511 1.00 . A A . 1 ILE HD13 1 1 8 1982 1 1 1 ILE HG12 H -15.263 4.748 -2.065 1.00 . A A . 1 ILE HG12 1 1 8 1983 1 1 1 ILE HG13 H -13.877 3.840 -1.460 1.00 . A A . 1 ILE HG13 1 1 8 1984 1 1 1 ILE HG21 H -14.684 5.313 -5.212 1.00 . A A . 1 ILE HG21 1 1 8 1985 1 1 1 ILE HG22 H -15.821 4.921 -3.923 1.00 . A A . 1 ILE HG22 1 1 8 1986 1 1 1 ILE HG23 H -15.276 3.662 -5.031 1.00 . A A . 1 ILE HG23 1 1 8 1987 1 1 1 ILE N N -14.688 2.078 -3.018 1.00 . A A . 1 ILE N 1 1 8 1988 1 1 1 ILE O O -12.247 2.444 -1.613 1.00 . A A . 1 ILE O 1 1 8 1989 1 1 2 LEU C C -10.063 0.501 -1.992 1.00 . A A . 2 LEU C 1 1 8 1990 1 1 2 LEU CA C -9.901 1.807 -2.769 1.00 . A A . 2 LEU CA 1 1 8 1991 1 1 2 LEU CB C -9.678 2.979 -1.812 1.00 . A A . 2 LEU CB 1 1 8 1992 1 1 2 LEU CD1 C -7.994 4.171 -3.220 1.00 . A A . 2 LEU CD1 1 1 8 1993 1 1 2 LEU CD2 C -7.918 4.383 -0.732 1.00 . A A . 2 LEU CD2 1 1 8 1994 1 1 2 LEU CG C -8.222 3.438 -1.897 1.00 . A A . 2 LEU CG 1 1 8 1995 1 1 2 LEU H H -11.177 2.118 -4.474 1.00 . A A . 2 LEU H 1 1 8 1996 1 1 2 LEU HA H -9.075 1.731 -3.459 1.00 . A A . 2 LEU HA 1 1 8 1997 1 1 2 LEU HB2 H -10.331 3.795 -2.086 1.00 . A A . 2 LEU HB2 1 1 8 1998 1 1 2 LEU HB3 H -9.898 2.666 -0.803 1.00 . A A . 2 LEU HB3 1 1 8 1999 1 1 2 LEU HD11 H -8.403 3.586 -4.031 1.00 . A A . 2 LEU HD11 1 1 8 2000 1 1 2 LEU HD12 H -6.934 4.310 -3.377 1.00 . A A . 2 LEU HD12 1 1 8 2001 1 1 2 LEU HD13 H -8.482 5.134 -3.187 1.00 . A A . 2 LEU HD13 1 1 8 2002 1 1 2 LEU HD21 H -7.385 3.845 0.038 1.00 . A A . 2 LEU HD21 1 1 8 2003 1 1 2 LEU HD22 H -8.843 4.766 -0.329 1.00 . A A . 2 LEU HD22 1 1 8 2004 1 1 2 LEU HD23 H -7.310 5.204 -1.084 1.00 . A A . 2 LEU HD23 1 1 8 2005 1 1 2 LEU HG H -7.571 2.578 -1.845 1.00 . A A . 2 LEU HG 1 1 8 2006 1 1 2 LEU N N -11.161 2.129 -3.496 1.00 . A A . 2 LEU N 1 1 8 2007 1 1 2 LEU O O -10.629 0.468 -0.918 1.00 . A A . 2 LEU O 1 1 8 2008 1 1 3 LYS C C -8.919 -2.966 -2.596 1.00 . A A . 3 LYS C 1 1 8 2009 1 1 3 LYS CA C -9.694 -1.886 -1.835 1.00 . A A . 3 LYS CA 1 1 8 2010 1 1 3 LYS CB C -11.191 -2.198 -1.839 1.00 . A A . 3 LYS CB 1 1 8 2011 1 1 3 LYS CD C -13.043 -2.760 -3.419 1.00 . A A . 3 LYS CD 1 1 8 2012 1 1 3 LYS CE C -14.248 -1.890 -3.056 1.00 . A A . 3 LYS CE 1 1 8 2013 1 1 3 LYS CG C -11.757 -1.953 -3.240 1.00 . A A . 3 LYS CG 1 1 8 2014 1 1 3 LYS H H -9.118 -0.521 -3.402 1.00 . A A . 3 LYS H 1 1 8 2015 1 1 3 LYS HA H -9.335 -1.811 -0.820 1.00 . A A . 3 LYS HA 1 1 8 2016 1 1 3 LYS HB2 H -11.345 -3.230 -1.563 1.00 . A A . 3 LYS HB2 1 1 8 2017 1 1 3 LYS HB3 H -11.693 -1.556 -1.132 1.00 . A A . 3 LYS HB3 1 1 8 2018 1 1 3 LYS HD2 H -13.125 -3.081 -4.448 1.00 . A A . 3 LYS HD2 1 1 8 2019 1 1 3 LYS HD3 H -13.019 -3.624 -2.774 1.00 . A A . 3 LYS HD3 1 1 8 2020 1 1 3 LYS HE2 H -13.923 -0.896 -2.779 1.00 . A A . 3 LYS HE2 1 1 8 2021 1 1 3 LYS HE3 H -14.941 -1.844 -3.881 1.00 . A A . 3 LYS HE3 1 1 8 2022 1 1 3 LYS HG2 H -11.971 -0.900 -3.361 1.00 . A A . 3 LYS HG2 1 1 8 2023 1 1 3 LYS HG3 H -11.034 -2.260 -3.978 1.00 . A A . 3 LYS HG3 1 1 8 2024 1 1 3 LYS HZ1 H -14.152 -2.809 -1.191 1.00 . A A . 3 LYS HZ1 1 1 8 2025 1 1 3 LYS HZ2 H -15.344 -3.448 -2.220 1.00 . A A . 3 LYS HZ2 1 1 8 2026 1 1 3 LYS HZ3 H -15.587 -1.946 -1.464 1.00 . A A . 3 LYS HZ3 1 1 8 2027 1 1 3 LYS N N -9.570 -0.576 -2.533 1.00 . A A . 3 LYS N 1 1 8 2028 1 1 3 LYS NZ N -14.881 -2.575 -1.896 1.00 . A A . 3 LYS NZ 1 1 8 2029 1 1 3 LYS O O -9.494 -3.891 -3.136 1.00 . A A . 3 LYS O 1 1 8 2030 1 1 4 LYS C C -5.674 -4.357 -2.479 1.00 . A A . 4 LYS C 1 1 8 2031 1 1 4 LYS CA C -6.811 -3.872 -3.368 1.00 . A A . 4 LYS CA 1 1 8 2032 1 1 4 LYS CB C -6.269 -3.141 -4.590 1.00 . A A . 4 LYS CB 1 1 8 2033 1 1 4 LYS CD C -6.592 -4.867 -6.368 1.00 . A A . 4 LYS CD 1 1 8 2034 1 1 4 LYS CE C -7.515 -5.331 -7.498 1.00 . A A . 4 LYS CE 1 1 8 2035 1 1 4 LYS CG C -7.085 -3.524 -5.826 1.00 . A A . 4 LYS CG 1 1 8 2036 1 1 4 LYS H H -7.175 -2.105 -2.202 1.00 . A A . 4 LYS H 1 1 8 2037 1 1 4 LYS HA H -7.430 -4.702 -3.669 1.00 . A A . 4 LYS HA 1 1 8 2038 1 1 4 LYS HB2 H -6.341 -2.079 -4.424 1.00 . A A . 4 LYS HB2 1 1 8 2039 1 1 4 LYS HB3 H -5.237 -3.412 -4.740 1.00 . A A . 4 LYS HB3 1 1 8 2040 1 1 4 LYS HD2 H -5.586 -4.756 -6.747 1.00 . A A . 4 LYS HD2 1 1 8 2041 1 1 4 LYS HD3 H -6.600 -5.600 -5.576 1.00 . A A . 4 LYS HD3 1 1 8 2042 1 1 4 LYS HE2 H -8.444 -4.777 -7.473 1.00 . A A . 4 LYS HE2 1 1 8 2043 1 1 4 LYS HE3 H -7.029 -5.214 -8.453 1.00 . A A . 4 LYS HE3 1 1 8 2044 1 1 4 LYS HG2 H -8.128 -3.604 -5.558 1.00 . A A . 4 LYS HG2 1 1 8 2045 1 1 4 LYS HG3 H -6.964 -2.767 -6.585 1.00 . A A . 4 LYS HG3 1 1 8 2046 1 1 4 LYS HZ1 H -8.469 -6.869 -6.469 1.00 . A A . 4 LYS HZ1 1 1 8 2047 1 1 4 LYS HZ2 H -6.872 -7.227 -6.927 1.00 . A A . 4 LYS HZ2 1 1 8 2048 1 1 4 LYS HZ3 H -8.115 -7.235 -8.087 1.00 . A A . 4 LYS HZ3 1 1 8 2049 1 1 4 LYS N N -7.621 -2.856 -2.644 1.00 . A A . 4 LYS N 1 1 8 2050 1 1 4 LYS NZ N -7.761 -6.774 -7.224 1.00 . A A . 4 LYS NZ 1 1 8 2051 1 1 4 LYS O O -4.510 -4.131 -2.748 1.00 . A A . 4 LYS O 1 1 8 2052 1 1 5 TRP C C -3.881 -4.484 -0.275 1.00 . A A . 5 TRP C 1 1 8 2053 1 1 5 TRP CA C -4.972 -5.536 -0.483 1.00 . A A . 5 TRP CA 1 1 8 2054 1 1 5 TRP CB C -4.400 -6.776 -1.169 1.00 . A A . 5 TRP CB 1 1 8 2055 1 1 5 TRP CD1 C -5.854 -8.786 -1.655 1.00 . A A . 5 TRP CD1 1 1 8 2056 1 1 5 TRP CD2 C -5.466 -8.501 0.540 1.00 . A A . 5 TRP CD2 1 1 8 2057 1 1 5 TRP CE2 C -6.286 -9.648 0.421 1.00 . A A . 5 TRP CE2 1 1 8 2058 1 1 5 TRP CE3 C -5.073 -8.097 1.826 1.00 . A A . 5 TRP CE3 1 1 8 2059 1 1 5 TRP CG C -5.208 -7.972 -0.788 1.00 . A A . 5 TRP CG 1 1 8 2060 1 1 5 TRP CH2 C -6.298 -9.955 2.815 1.00 . A A . 5 TRP CH2 1 1 8 2061 1 1 5 TRP CZ2 C -6.698 -10.371 1.541 1.00 . A A . 5 TRP CZ2 1 1 8 2062 1 1 5 TRP CZ3 C -5.486 -8.820 2.956 1.00 . A A . 5 TRP CZ3 1 1 8 2063 1 1 5 TRP H H -6.962 -5.179 -1.242 1.00 . A A . 5 TRP H 1 1 8 2064 1 1 5 TRP HA H -5.418 -5.809 0.459 1.00 . A A . 5 TRP HA 1 1 8 2065 1 1 5 TRP HB2 H -4.431 -6.645 -2.239 1.00 . A A . 5 TRP HB2 1 1 8 2066 1 1 5 TRP HB3 H -3.376 -6.920 -0.853 1.00 . A A . 5 TRP HB3 1 1 8 2067 1 1 5 TRP HD1 H -5.869 -8.676 -2.730 1.00 . A A . 5 TRP HD1 1 1 8 2068 1 1 5 TRP HE1 H -7.034 -10.501 -1.327 1.00 . A A . 5 TRP HE1 1 1 8 2069 1 1 5 TRP HE3 H -4.448 -7.223 1.941 1.00 . A A . 5 TRP HE3 1 1 8 2070 1 1 5 TRP HH2 H -6.613 -10.508 3.687 1.00 . A A . 5 TRP HH2 1 1 8 2071 1 1 5 TRP HZ2 H -7.323 -11.244 1.425 1.00 . A A . 5 TRP HZ2 1 1 8 2072 1 1 5 TRP HZ3 H -5.178 -8.501 3.941 1.00 . A A . 5 TRP HZ3 1 1 8 2073 1 1 5 TRP N N -6.014 -5.022 -1.420 1.00 . A A . 5 TRP N 1 1 8 2074 1 1 5 TRP NE1 N -6.495 -9.782 -0.939 1.00 . A A . 5 TRP NE1 1 1 8 2075 1 1 5 TRP O O -2.944 -4.399 -1.044 1.00 . A A . 5 TRP O 1 1 8 2076 1 1 6 PRO C C -1.758 -3.263 1.612 1.00 . A A . 6 PRO C 1 1 8 2077 1 1 6 PRO CA C -3.059 -2.652 1.088 1.00 . A A . 6 PRO CA 1 1 8 2078 1 1 6 PRO CB C -3.754 -1.837 2.172 1.00 . A A . 6 PRO CB 1 1 8 2079 1 1 6 PRO CD C -5.142 -3.763 1.735 1.00 . A A . 6 PRO CD 1 1 8 2080 1 1 6 PRO CG C -4.729 -2.781 2.801 1.00 . A A . 6 PRO CG 1 1 8 2081 1 1 6 PRO HA H -2.870 -2.035 0.226 1.00 . A A . 6 PRO HA 1 1 8 2082 1 1 6 PRO HB2 H -3.034 -1.493 2.902 1.00 . A A . 6 PRO HB2 1 1 8 2083 1 1 6 PRO HB3 H -4.276 -1.003 1.734 1.00 . A A . 6 PRO HB3 1 1 8 2084 1 1 6 PRO HD2 H -5.240 -4.755 2.154 1.00 . A A . 6 PRO HD2 1 1 8 2085 1 1 6 PRO HD3 H -6.063 -3.453 1.268 1.00 . A A . 6 PRO HD3 1 1 8 2086 1 1 6 PRO HG2 H -4.259 -3.301 3.625 1.00 . A A . 6 PRO HG2 1 1 8 2087 1 1 6 PRO HG3 H -5.594 -2.239 3.151 1.00 . A A . 6 PRO HG3 1 1 8 2088 1 1 6 PRO N N -4.041 -3.715 0.766 1.00 . A A . 6 PRO N 1 1 8 2089 1 1 6 PRO O O -1.522 -3.328 2.802 1.00 . A A . 6 PRO O 1 1 8 2090 1 1 7 TRP C C 1.537 -3.714 0.375 1.00 . A A . 7 TRP C 1 1 8 2091 1 1 7 TRP CA C 0.377 -4.318 1.163 1.00 . A A . 7 TRP CA 1 1 8 2092 1 1 7 TRP CB C 0.241 -5.802 0.850 1.00 . A A . 7 TRP CB 1 1 8 2093 1 1 7 TRP CD1 C -0.945 -6.910 2.783 1.00 . A A . 7 TRP CD1 1 1 8 2094 1 1 7 TRP CD2 C 1.291 -7.115 2.909 1.00 . A A . 7 TRP CD2 1 1 8 2095 1 1 7 TRP CE2 C 0.758 -7.774 4.042 1.00 . A A . 7 TRP CE2 1 1 8 2096 1 1 7 TRP CE3 C 2.688 -7.096 2.748 1.00 . A A . 7 TRP CE3 1 1 8 2097 1 1 7 TRP CG C 0.188 -6.576 2.126 1.00 . A A . 7 TRP CG 1 1 8 2098 1 1 7 TRP CH2 C 2.968 -8.365 4.807 1.00 . A A . 7 TRP CH2 1 1 8 2099 1 1 7 TRP CZ2 C 1.582 -8.393 4.983 1.00 . A A . 7 TRP CZ2 1 1 8 2100 1 1 7 TRP CZ3 C 3.521 -7.718 3.693 1.00 . A A . 7 TRP CZ3 1 1 8 2101 1 1 7 TRP H H -1.127 -3.646 -0.225 1.00 . A A . 7 TRP H 1 1 8 2102 1 1 7 TRP HA H 0.525 -4.173 2.220 1.00 . A A . 7 TRP HA 1 1 8 2103 1 1 7 TRP HB2 H -0.666 -5.966 0.289 1.00 . A A . 7 TRP HB2 1 1 8 2104 1 1 7 TRP HB3 H 1.090 -6.124 0.268 1.00 . A A . 7 TRP HB3 1 1 8 2105 1 1 7 TRP HD1 H -1.949 -6.662 2.469 1.00 . A A . 7 TRP HD1 1 1 8 2106 1 1 7 TRP HE1 H -1.247 -7.982 4.571 1.00 . A A . 7 TRP HE1 1 1 8 2107 1 1 7 TRP HE3 H 3.124 -6.600 1.892 1.00 . A A . 7 TRP HE3 1 1 8 2108 1 1 7 TRP HH2 H 3.614 -8.842 5.530 1.00 . A A . 7 TRP HH2 1 1 8 2109 1 1 7 TRP HZ2 H 1.152 -8.891 5.839 1.00 . A A . 7 TRP HZ2 1 1 8 2110 1 1 7 TRP HZ3 H 4.593 -7.697 3.560 1.00 . A A . 7 TRP HZ3 1 1 8 2111 1 1 7 TRP N N -0.912 -3.711 0.728 1.00 . A A . 7 TRP N 1 1 8 2112 1 1 7 TRP NE1 N -0.609 -7.622 3.920 1.00 . A A . 7 TRP NE1 1 1 8 2113 1 1 7 TRP O O 2.289 -4.409 -0.281 1.00 . A A . 7 TRP O 1 1 8 2114 1 1 8 TRP C C 3.964 -1.479 0.640 1.00 . A A . 8 TRP C 1 1 8 2115 1 1 8 TRP CA C 2.792 -1.763 -0.302 1.00 . A A . 8 TRP CA 1 1 8 2116 1 1 8 TRP CB C 2.194 -0.458 -0.824 1.00 . A A . 8 TRP CB 1 1 8 2117 1 1 8 TRP CD1 C 3.820 1.064 -2.015 1.00 . A A . 8 TRP CD1 1 1 8 2118 1 1 8 TRP CD2 C 3.006 -0.547 -3.355 1.00 . A A . 8 TRP CD2 1 1 8 2119 1 1 8 TRP CE2 C 3.891 0.226 -4.143 1.00 . A A . 8 TRP CE2 1 1 8 2120 1 1 8 TRP CE3 C 2.354 -1.635 -3.965 1.00 . A A . 8 TRP CE3 1 1 8 2121 1 1 8 TRP CG C 2.976 0.009 -2.009 1.00 . A A . 8 TRP CG 1 1 8 2122 1 1 8 TRP CH2 C 3.469 -1.152 -6.076 1.00 . A A . 8 TRP CH2 1 1 8 2123 1 1 8 TRP CZ2 C 4.122 -0.067 -5.486 1.00 . A A . 8 TRP CZ2 1 1 8 2124 1 1 8 TRP CZ3 C 2.586 -1.935 -5.317 1.00 . A A . 8 TRP CZ3 1 1 8 2125 1 1 8 TRP H H 1.066 -1.897 0.973 1.00 . A A . 8 TRP H 1 1 8 2126 1 1 8 TRP HA H 3.109 -2.377 -1.127 1.00 . A A . 8 TRP HA 1 1 8 2127 1 1 8 TRP HB2 H 1.167 -0.623 -1.113 1.00 . A A . 8 TRP HB2 1 1 8 2128 1 1 8 TRP HB3 H 2.234 0.293 -0.049 1.00 . A A . 8 TRP HB3 1 1 8 2129 1 1 8 TRP HD1 H 4.035 1.700 -1.169 1.00 . A A . 8 TRP HD1 1 1 8 2130 1 1 8 TRP HE1 H 5.002 1.887 -3.552 1.00 . A A . 8 TRP HE1 1 1 8 2131 1 1 8 TRP HE3 H 1.674 -2.244 -3.388 1.00 . A A . 8 TRP HE3 1 1 8 2132 1 1 8 TRP HH2 H 3.641 -1.389 -7.115 1.00 . A A . 8 TRP HH2 1 1 8 2133 1 1 8 TRP HZ2 H 4.803 0.537 -6.067 1.00 . A A . 8 TRP HZ2 1 1 8 2134 1 1 8 TRP HZ3 H 2.081 -2.773 -5.775 1.00 . A A . 8 TRP HZ3 1 1 8 2135 1 1 8 TRP N N 1.685 -2.428 0.438 1.00 . A A . 8 TRP N 1 1 8 2136 1 1 8 TRP NE1 N 4.362 1.196 -3.281 1.00 . A A . 8 TRP NE1 1 1 8 2137 1 1 8 TRP O O 3.870 -0.637 1.511 1.00 . A A . 8 TRP O 1 1 8 2138 1 1 9 PRO C C 7.128 -0.908 0.718 1.00 . A A . 9 PRO C 1 1 8 2139 1 1 9 PRO CA C 6.243 -2.029 1.265 1.00 . A A . 9 PRO CA 1 1 8 2140 1 1 9 PRO CB C 6.937 -3.378 1.141 1.00 . A A . 9 PRO CB 1 1 8 2141 1 1 9 PRO CD C 5.217 -3.225 -0.590 1.00 . A A . 9 PRO CD 1 1 8 2142 1 1 9 PRO CG C 6.470 -3.960 -0.164 1.00 . A A . 9 PRO CG 1 1 8 2143 1 1 9 PRO HA H 5.975 -1.837 2.286 1.00 . A A . 9 PRO HA 1 1 8 2144 1 1 9 PRO HB2 H 8.011 -3.245 1.132 1.00 . A A . 9 PRO HB2 1 1 8 2145 1 1 9 PRO HB3 H 6.646 -4.021 1.955 1.00 . A A . 9 PRO HB3 1 1 8 2146 1 1 9 PRO HD2 H 5.358 -2.776 -1.562 1.00 . A A . 9 PRO HD2 1 1 8 2147 1 1 9 PRO HD3 H 4.369 -3.892 -0.600 1.00 . A A . 9 PRO HD3 1 1 8 2148 1 1 9 PRO HG2 H 7.240 -3.838 -0.913 1.00 . A A . 9 PRO HG2 1 1 8 2149 1 1 9 PRO HG3 H 6.247 -5.008 -0.036 1.00 . A A . 9 PRO HG3 1 1 8 2150 1 1 9 PRO N N 5.035 -2.195 0.430 1.00 . A A . 9 PRO N 1 1 8 2151 1 1 9 PRO O O 8.331 -0.910 0.888 1.00 . A A . 9 PRO O 1 1 8 2152 1 1 10 TRP C C 7.123 2.435 0.332 1.00 . A A . 10 TRP C 1 1 8 2153 1 1 10 TRP CA C 7.327 1.170 -0.501 1.00 . A A . 10 TRP CA 1 1 8 2154 1 1 10 TRP CB C 6.770 1.362 -1.909 1.00 . A A . 10 TRP CB 1 1 8 2155 1 1 10 TRP CD1 C 8.805 2.409 -2.980 1.00 . A A . 10 TRP CD1 1 1 8 2156 1 1 10 TRP CD2 C 8.238 0.442 -3.901 1.00 . A A . 10 TRP CD2 1 1 8 2157 1 1 10 TRP CE2 C 9.379 0.898 -4.599 1.00 . A A . 10 TRP CE2 1 1 8 2158 1 1 10 TRP CE3 C 7.667 -0.778 -4.274 1.00 . A A . 10 TRP CE3 1 1 8 2159 1 1 10 TRP CG C 7.895 1.416 -2.884 1.00 . A A . 10 TRP CG 1 1 8 2160 1 1 10 TRP CH2 C 9.356 -1.064 -6.005 1.00 . A A . 10 TRP CH2 1 1 8 2161 1 1 10 TRP CZ2 C 9.937 0.155 -5.641 1.00 . A A . 10 TRP CZ2 1 1 8 2162 1 1 10 TRP CZ3 C 8.222 -1.531 -5.323 1.00 . A A . 10 TRP CZ3 1 1 8 2163 1 1 10 TRP H H 5.574 0.019 -0.059 1.00 . A A . 10 TRP H 1 1 8 2164 1 1 10 TRP HA H 8.367 0.911 -0.548 1.00 . A A . 10 TRP HA 1 1 8 2165 1 1 10 TRP HB2 H 6.125 0.532 -2.152 1.00 . A A . 10 TRP HB2 1 1 8 2166 1 1 10 TRP HB3 H 6.208 2.278 -1.957 1.00 . A A . 10 TRP HB3 1 1 8 2167 1 1 10 TRP HD1 H 8.835 3.295 -2.363 1.00 . A A . 10 TRP HD1 1 1 8 2168 1 1 10 TRP HE1 H 10.447 2.660 -4.279 1.00 . A A . 10 TRP HE1 1 1 8 2169 1 1 10 TRP HE3 H 6.794 -1.138 -3.749 1.00 . A A . 10 TRP HE3 1 1 8 2170 1 1 10 TRP HH2 H 9.780 -1.646 -6.810 1.00 . A A . 10 TRP HH2 1 1 8 2171 1 1 10 TRP HZ2 H 10.810 0.520 -6.163 1.00 . A A . 10 TRP HZ2 1 1 8 2172 1 1 10 TRP HZ3 H 7.775 -2.473 -5.605 1.00 . A A . 10 TRP HZ3 1 1 8 2173 1 1 10 TRP N N 6.538 0.045 0.064 1.00 . A A . 10 TRP N 1 1 8 2174 1 1 10 TRP NE1 N 9.690 2.104 -4.001 1.00 . A A . 10 TRP NE1 1 1 8 2175 1 1 10 TRP O O 8.060 3.137 0.659 1.00 . A A . 10 TRP O 1 1 8 2176 1 1 11 ARG C C 4.932 3.555 2.792 1.00 . A A . 11 ARG C 1 1 8 2177 1 1 11 ARG CA C 5.625 3.944 1.490 1.00 . A A . 11 ARG CA 1 1 8 2178 1 1 11 ARG CB C 4.701 4.796 0.620 1.00 . A A . 11 ARG CB 1 1 8 2179 1 1 11 ARG CD C 5.703 7.073 0.863 1.00 . A A . 11 ARG CD 1 1 8 2180 1 1 11 ARG CG C 5.518 5.883 -0.081 1.00 . A A . 11 ARG CG 1 1 8 2181 1 1 11 ARG CZ C 7.820 7.804 -0.057 1.00 . A A . 11 ARG CZ 1 1 8 2182 1 1 11 ARG H H 5.169 2.147 0.403 1.00 . A A . 11 ARG H 1 1 8 2183 1 1 11 ARG HA H 6.537 4.474 1.695 1.00 . A A . 11 ARG HA 1 1 8 2184 1 1 11 ARG HB2 H 4.225 4.170 -0.119 1.00 . A A . 11 ARG HB2 1 1 8 2185 1 1 11 ARG HB3 H 3.950 5.257 1.240 1.00 . A A . 11 ARG HB3 1 1 8 2186 1 1 11 ARG HD2 H 4.744 7.512 1.102 1.00 . A A . 11 ARG HD2 1 1 8 2187 1 1 11 ARG HD3 H 6.213 6.764 1.762 1.00 . A A . 11 ARG HD3 1 1 8 2188 1 1 11 ARG HE H 6.144 8.845 -0.277 1.00 . A A . 11 ARG HE 1 1 8 2189 1 1 11 ARG HG2 H 6.484 5.485 -0.354 1.00 . A A . 11 ARG HG2 1 1 8 2190 1 1 11 ARG HG3 H 4.997 6.207 -0.969 1.00 . A A . 11 ARG HG3 1 1 8 2191 1 1 11 ARG HH11 H 8.342 8.599 1.706 1.00 . A A . 11 ARG HH11 1 1 8 2192 1 1 11 ARG HH12 H 9.645 7.976 0.749 1.00 . A A . 11 ARG HH12 1 1 8 2193 1 1 11 ARG HH21 H 7.596 6.955 -1.855 1.00 . A A . 11 ARG HH21 1 1 8 2194 1 1 11 ARG HH22 H 9.223 7.046 -1.267 1.00 . A A . 11 ARG HH22 1 1 8 2195 1 1 11 ARG N N 5.904 2.728 0.678 1.00 . A A . 11 ARG N 1 1 8 2196 1 1 11 ARG NE N 6.545 8.037 0.103 1.00 . A A . 11 ARG NE 1 1 8 2197 1 1 11 ARG NH1 N 8.668 8.154 0.873 1.00 . A A . 11 ARG NH1 1 1 8 2198 1 1 11 ARG NH2 N 8.246 7.223 -1.144 1.00 . A A . 11 ARG NH2 1 1 8 2199 1 1 11 ARG O O 3.813 3.947 3.061 1.00 . A A . 11 ARG O 1 1 8 2200 1 1 12 ARG C C 5.490 3.251 6.035 1.00 . A A . 12 ARG C 1 1 8 2201 1 1 12 ARG CA C 4.990 2.358 4.896 1.00 . A A . 12 ARG CA 1 1 8 2202 1 1 12 ARG CB C 5.461 0.916 5.097 1.00 . A A . 12 ARG CB 1 1 8 2203 1 1 12 ARG CD C 4.695 -0.801 6.741 1.00 . A A . 12 ARG CD 1 1 8 2204 1 1 12 ARG CG C 4.281 0.052 5.540 1.00 . A A . 12 ARG CG 1 1 8 2205 1 1 12 ARG CZ C 2.832 -1.266 8.219 1.00 . A A . 12 ARG CZ 1 1 8 2206 1 1 12 ARG H H 6.494 2.486 3.355 1.00 . A A . 12 ARG H 1 1 8 2207 1 1 12 ARG HA H 3.914 2.387 4.838 1.00 . A A . 12 ARG HA 1 1 8 2208 1 1 12 ARG HB2 H 5.862 0.536 4.169 1.00 . A A . 12 ARG HB2 1 1 8 2209 1 1 12 ARG HB3 H 6.229 0.892 5.857 1.00 . A A . 12 ARG HB3 1 1 8 2210 1 1 12 ARG HD2 H 4.600 -1.853 6.505 1.00 . A A . 12 ARG HD2 1 1 8 2211 1 1 12 ARG HD3 H 5.706 -0.570 7.036 1.00 . A A . 12 ARG HD3 1 1 8 2212 1 1 12 ARG HE H 3.809 0.462 8.245 1.00 . A A . 12 ARG HE 1 1 8 2213 1 1 12 ARG HG2 H 3.452 0.687 5.817 1.00 . A A . 12 ARG HG2 1 1 8 2214 1 1 12 ARG HG3 H 3.983 -0.596 4.729 1.00 . A A . 12 ARG HG3 1 1 8 2215 1 1 12 ARG HH11 H 4.011 -2.872 8.017 1.00 . A A . 12 ARG HH11 1 1 8 2216 1 1 12 ARG HH12 H 2.403 -3.189 8.575 1.00 . A A . 12 ARG HH12 1 1 8 2217 1 1 12 ARG HH21 H 1.441 0.142 8.512 1.00 . A A . 12 ARG HH21 1 1 8 2218 1 1 12 ARG HH22 H 0.947 -1.482 8.856 1.00 . A A . 12 ARG HH22 1 1 8 2219 1 1 12 ARG N N 5.594 2.784 3.602 1.00 . A A . 12 ARG N 1 1 8 2220 1 1 12 ARG NE N 3.748 -0.421 7.826 1.00 . A A . 12 ARG NE 1 1 8 2221 1 1 12 ARG NH1 N 3.103 -2.542 8.275 1.00 . A A . 12 ARG NH1 1 1 8 2222 1 1 12 ARG NH2 N 1.649 -0.835 8.555 1.00 . A A . 12 ARG NH2 1 1 8 2223 1 1 12 ARG O O 6.184 4.223 5.816 1.00 . A A . 12 ARG O 1 1 8 2224 1 1 13 LYS C C 6.279 2.872 9.451 1.00 . A A . 13 LYS C 1 1 8 2225 1 1 13 LYS CA C 5.595 3.757 8.404 1.00 . A A . 13 LYS CA 1 1 8 2226 1 1 13 LYS CB C 4.317 4.381 8.966 1.00 . A A . 13 LYS CB 1 1 8 2227 1 1 13 LYS CD C 2.396 4.617 7.384 1.00 . A A . 13 LYS CD 1 1 8 2228 1 1 13 LYS CE C 1.260 4.845 8.385 1.00 . A A . 13 LYS CE 1 1 8 2229 1 1 13 LYS CG C 3.675 5.278 7.904 1.00 . A A . 13 LYS CG 1 1 8 2230 1 1 13 LYS H H 4.580 2.140 7.407 1.00 . A A . 13 LYS H 1 1 8 2231 1 1 13 LYS HA H 6.267 4.531 8.069 1.00 . A A . 13 LYS HA 1 1 8 2232 1 1 13 LYS HB2 H 3.625 3.599 9.242 1.00 . A A . 13 LYS HB2 1 1 8 2233 1 1 13 LYS HB3 H 4.556 4.973 9.835 1.00 . A A . 13 LYS HB3 1 1 8 2234 1 1 13 LYS HD2 H 2.129 5.050 6.432 1.00 . A A . 13 LYS HD2 1 1 8 2235 1 1 13 LYS HD3 H 2.560 3.558 7.266 1.00 . A A . 13 LYS HD3 1 1 8 2236 1 1 13 LYS HE2 H 1.147 3.982 9.027 1.00 . A A . 13 LYS HE2 1 1 8 2237 1 1 13 LYS HE3 H 1.448 5.731 8.974 1.00 . A A . 13 LYS HE3 1 1 8 2238 1 1 13 LYS HG2 H 3.435 6.236 8.340 1.00 . A A . 13 LYS HG2 1 1 8 2239 1 1 13 LYS HG3 H 4.365 5.416 7.084 1.00 . A A . 13 LYS HG3 1 1 8 2240 1 1 13 LYS HZ1 H 0.024 4.321 6.796 1.00 . A A . 13 LYS HZ1 1 1 8 2241 1 1 13 LYS HZ2 H 0.062 5.987 7.123 1.00 . A A . 13 LYS HZ2 1 1 8 2242 1 1 13 LYS HZ3 H -0.805 4.939 8.141 1.00 . A A . 13 LYS HZ3 1 1 8 2243 1 1 13 LYS N N 5.141 2.928 7.250 1.00 . A A . 13 LYS N 1 1 8 2244 1 1 13 LYS NZ N 0.043 5.037 7.547 1.00 . A A . 13 LYS NZ 1 1 8 2245 1 1 13 LYS O O 7.262 2.217 9.166 1.00 . A A . 13 LYS O 1 1 8 2246 1 1 14 NH2 HN1 H 5.007 3.344 10.901 1.00 . A A . 14 NH2 HN1 1 1 8 2247 1 1 14 NH2 HN2 H 6.232 2.256 11.339 1.00 . A A . 14 NH2 HN2 1 1 8 2248 1 1 14 NH2 N N 5.798 2.820 10.664 1.00 . A A . 14 NH2 N 1 1 9 2249 1 1 1 ILE C C -9.024 6.322 -0.618 1.00 . A A . 1 ILE C 1 1 9 2250 1 1 1 ILE CA C -10.310 7.105 -0.894 1.00 . A A . 1 ILE CA 1 1 9 2251 1 1 1 ILE CB C -10.787 6.863 -2.326 1.00 . A A . 1 ILE CB 1 1 9 2252 1 1 1 ILE CD1 C -9.779 6.776 -4.611 1.00 . A A . 1 ILE CD1 1 1 9 2253 1 1 1 ILE CG1 C -9.842 7.565 -3.302 1.00 . A A . 1 ILE CG1 1 1 9 2254 1 1 1 ILE CG2 C -12.201 7.421 -2.496 1.00 . A A . 1 ILE CG2 1 1 9 2255 1 1 1 ILE H1 H -10.227 8.904 0.151 1.00 . A A . 1 ILE H1 1 1 9 2256 1 1 1 ILE H2 H -10.683 9.069 -1.476 1.00 . A A . 1 ILE H2 1 1 9 2257 1 1 1 ILE H3 H -9.062 8.762 -1.074 1.00 . A A . 1 ILE H3 1 1 9 2258 1 1 1 ILE HA H -11.083 6.820 -0.196 1.00 . A A . 1 ILE HA 1 1 9 2259 1 1 1 ILE HB H -10.794 5.801 -2.529 1.00 . A A . 1 ILE HB 1 1 9 2260 1 1 1 ILE HD11 H -10.394 7.260 -5.354 1.00 . A A . 1 ILE HD11 1 1 9 2261 1 1 1 ILE HD12 H -10.141 5.771 -4.443 1.00 . A A . 1 ILE HD12 1 1 9 2262 1 1 1 ILE HD13 H -8.757 6.734 -4.958 1.00 . A A . 1 ILE HD13 1 1 9 2263 1 1 1 ILE HG12 H -10.205 8.563 -3.502 1.00 . A A . 1 ILE HG12 1 1 9 2264 1 1 1 ILE HG13 H -8.853 7.621 -2.870 1.00 . A A . 1 ILE HG13 1 1 9 2265 1 1 1 ILE HG21 H -12.847 6.651 -2.892 1.00 . A A . 1 ILE HG21 1 1 9 2266 1 1 1 ILE HG22 H -12.178 8.257 -3.180 1.00 . A A . 1 ILE HG22 1 1 9 2267 1 1 1 ILE HG23 H -12.577 7.749 -1.539 1.00 . A A . 1 ILE HG23 1 1 9 2268 1 1 1 ILE N N -10.051 8.571 -0.817 1.00 . A A . 1 ILE N 1 1 9 2269 1 1 1 ILE O O -7.932 6.825 -0.793 1.00 . A A . 1 ILE O 1 1 9 2270 1 1 2 LEU C C -8.328 2.931 0.694 1.00 . A A . 2 LEU C 1 1 9 2271 1 1 2 LEU CA C -7.929 4.282 0.096 1.00 . A A . 2 LEU CA 1 1 9 2272 1 1 2 LEU CB C -7.124 5.102 1.107 1.00 . A A . 2 LEU CB 1 1 9 2273 1 1 2 LEU CD1 C -7.480 5.355 3.567 1.00 . A A . 2 LEU CD1 1 1 9 2274 1 1 2 LEU CD2 C -8.208 7.164 2.007 1.00 . A A . 2 LEU CD2 1 1 9 2275 1 1 2 LEU CG C -8.062 5.650 2.183 1.00 . A A . 2 LEU CG 1 1 9 2276 1 1 2 LEU H H -10.035 4.709 -0.057 1.00 . A A . 2 LEU H 1 1 9 2277 1 1 2 LEU HA H -7.354 4.135 -0.804 1.00 . A A . 2 LEU HA 1 1 9 2278 1 1 2 LEU HB2 H -6.377 4.471 1.567 1.00 . A A . 2 LEU HB2 1 1 9 2279 1 1 2 LEU HB3 H -6.641 5.922 0.600 1.00 . A A . 2 LEU HB3 1 1 9 2280 1 1 2 LEU HD11 H -7.679 4.326 3.829 1.00 . A A . 2 LEU HD11 1 1 9 2281 1 1 2 LEU HD12 H -7.937 6.007 4.296 1.00 . A A . 2 LEU HD12 1 1 9 2282 1 1 2 LEU HD13 H -6.414 5.522 3.552 1.00 . A A . 2 LEU HD13 1 1 9 2283 1 1 2 LEU HD21 H -8.224 7.640 2.975 1.00 . A A . 2 LEU HD21 1 1 9 2284 1 1 2 LEU HD22 H -9.127 7.378 1.483 1.00 . A A . 2 LEU HD22 1 1 9 2285 1 1 2 LEU HD23 H -7.372 7.541 1.435 1.00 . A A . 2 LEU HD23 1 1 9 2286 1 1 2 LEU HG H -9.030 5.181 2.092 1.00 . A A . 2 LEU HG 1 1 9 2287 1 1 2 LEU N N -9.145 5.096 -0.190 1.00 . A A . 2 LEU N 1 1 9 2288 1 1 2 LEU O O -8.661 2.829 1.859 1.00 . A A . 2 LEU O 1 1 9 2289 1 1 3 LYS C C -8.513 -0.505 -0.680 1.00 . A A . 3 LYS C 1 1 9 2290 1 1 3 LYS CA C -8.671 0.549 0.420 1.00 . A A . 3 LYS CA 1 1 9 2291 1 1 3 LYS CB C -10.137 0.679 0.835 1.00 . A A . 3 LYS CB 1 1 9 2292 1 1 3 LYS CD C -12.371 0.923 -0.257 1.00 . A A . 3 LYS CD 1 1 9 2293 1 1 3 LYS CE C -13.204 1.803 -1.191 1.00 . A A . 3 LYS CE 1 1 9 2294 1 1 3 LYS CG C -10.917 1.399 -0.266 1.00 . A A . 3 LYS CG 1 1 9 2295 1 1 3 LYS H H -8.022 2.006 -1.031 1.00 . A A . 3 LYS H 1 1 9 2296 1 1 3 LYS HA H -8.067 0.293 1.278 1.00 . A A . 3 LYS HA 1 1 9 2297 1 1 3 LYS HB2 H -10.555 -0.306 0.989 1.00 . A A . 3 LYS HB2 1 1 9 2298 1 1 3 LYS HB3 H -10.203 1.246 1.750 1.00 . A A . 3 LYS HB3 1 1 9 2299 1 1 3 LYS HD2 H -12.415 -0.102 -0.592 1.00 . A A . 3 LYS HD2 1 1 9 2300 1 1 3 LYS HD3 H -12.766 0.992 0.746 1.00 . A A . 3 LYS HD3 1 1 9 2301 1 1 3 LYS HE2 H -14.047 2.223 -0.658 1.00 . A A . 3 LYS HE2 1 1 9 2302 1 1 3 LYS HE3 H -12.595 2.589 -1.612 1.00 . A A . 3 LYS HE3 1 1 9 2303 1 1 3 LYS HG2 H -10.885 2.465 -0.091 1.00 . A A . 3 LYS HG2 1 1 9 2304 1 1 3 LYS HG3 H -10.476 1.178 -1.226 1.00 . A A . 3 LYS HG3 1 1 9 2305 1 1 3 LYS HZ1 H -13.755 1.415 -3.160 1.00 . A A . 3 LYS HZ1 1 1 9 2306 1 1 3 LYS HZ2 H -14.597 0.492 -2.009 1.00 . A A . 3 LYS HZ2 1 1 9 2307 1 1 3 LYS HZ3 H -12.985 0.115 -2.388 1.00 . A A . 3 LYS HZ3 1 1 9 2308 1 1 3 LYS N N -8.294 1.897 -0.097 1.00 . A A . 3 LYS N 1 1 9 2309 1 1 3 LYS NZ N -13.671 0.888 -2.268 1.00 . A A . 3 LYS NZ 1 1 9 2310 1 1 3 LYS O O -9.483 -1.030 -1.192 1.00 . A A . 3 LYS O 1 1 9 2311 1 1 4 LYS C C -5.990 -2.809 -1.687 1.00 . A A . 4 LYS C 1 1 9 2312 1 1 4 LYS CA C -7.083 -1.838 -2.111 1.00 . A A . 4 LYS CA 1 1 9 2313 1 1 4 LYS CB C -6.649 -1.043 -3.336 1.00 . A A . 4 LYS CB 1 1 9 2314 1 1 4 LYS CD C -7.230 -0.536 -5.713 1.00 . A A . 4 LYS CD 1 1 9 2315 1 1 4 LYS CE C -7.322 -1.652 -6.755 1.00 . A A . 4 LYS CE 1 1 9 2316 1 1 4 LYS CG C -7.772 -1.040 -4.374 1.00 . A A . 4 LYS CG 1 1 9 2317 1 1 4 LYS H H -6.533 -0.385 -0.621 1.00 . A A . 4 LYS H 1 1 9 2318 1 1 4 LYS HA H -7.997 -2.372 -2.315 1.00 . A A . 4 LYS HA 1 1 9 2319 1 1 4 LYS HB2 H -6.429 -0.032 -3.037 1.00 . A A . 4 LYS HB2 1 1 9 2320 1 1 4 LYS HB3 H -5.766 -1.493 -3.763 1.00 . A A . 4 LYS HB3 1 1 9 2321 1 1 4 LYS HD2 H -7.813 0.314 -6.040 1.00 . A A . 4 LYS HD2 1 1 9 2322 1 1 4 LYS HD3 H -6.198 -0.240 -5.595 1.00 . A A . 4 LYS HD3 1 1 9 2323 1 1 4 LYS HE2 H -8.003 -2.423 -6.419 1.00 . A A . 4 LYS HE2 1 1 9 2324 1 1 4 LYS HE3 H -7.642 -1.254 -7.706 1.00 . A A . 4 LYS HE3 1 1 9 2325 1 1 4 LYS HG2 H -8.155 -2.044 -4.494 1.00 . A A . 4 LYS HG2 1 1 9 2326 1 1 4 LYS HG3 H -8.567 -0.390 -4.043 1.00 . A A . 4 LYS HG3 1 1 9 2327 1 1 4 LYS HZ1 H -5.664 -2.633 -5.969 1.00 . A A . 4 LYS HZ1 1 1 9 2328 1 1 4 LYS HZ2 H -5.281 -1.410 -7.084 1.00 . A A . 4 LYS HZ2 1 1 9 2329 1 1 4 LYS HZ3 H -5.900 -2.897 -7.626 1.00 . A A . 4 LYS HZ3 1 1 9 2330 1 1 4 LYS N N -7.302 -0.818 -1.046 1.00 . A A . 4 LYS N 1 1 9 2331 1 1 4 LYS NZ N -5.938 -2.189 -6.867 1.00 . A A . 4 LYS NZ 1 1 9 2332 1 1 4 LYS O O -4.919 -2.856 -2.260 1.00 . A A . 4 LYS O 1 1 9 2333 1 1 5 TRP C C -3.906 -3.880 0.034 1.00 . A A . 5 TRP C 1 1 9 2334 1 1 5 TRP CA C -5.257 -4.568 -0.192 1.00 . A A . 5 TRP CA 1 1 9 2335 1 1 5 TRP CB C -5.149 -5.611 -1.302 1.00 . A A . 5 TRP CB 1 1 9 2336 1 1 5 TRP CD1 C -7.257 -6.849 -1.946 1.00 . A A . 5 TRP CD1 1 1 9 2337 1 1 5 TRP CD2 C -6.340 -7.627 -0.045 1.00 . A A . 5 TRP CD2 1 1 9 2338 1 1 5 TRP CE2 C -7.500 -8.403 -0.283 1.00 . A A . 5 TRP CE2 1 1 9 2339 1 1 5 TRP CE3 C -5.572 -7.915 1.096 1.00 . A A . 5 TRP CE3 1 1 9 2340 1 1 5 TRP CG C -6.209 -6.648 -1.116 1.00 . A A . 5 TRP CG 1 1 9 2341 1 1 5 TRP CH2 C -7.110 -9.699 1.713 1.00 . A A . 5 TRP CH2 1 1 9 2342 1 1 5 TRP CZ2 C -7.884 -9.427 0.582 1.00 . A A . 5 TRP CZ2 1 1 9 2343 1 1 5 TRP CZ3 C -5.956 -8.945 1.970 1.00 . A A . 5 TRP CZ3 1 1 9 2344 1 1 5 TRP H H -7.136 -3.513 -0.253 1.00 . A A . 5 TRP H 1 1 9 2345 1 1 5 TRP HA H -5.600 -5.033 0.720 1.00 . A A . 5 TRP HA 1 1 9 2346 1 1 5 TRP HB2 H -5.280 -5.130 -2.260 1.00 . A A . 5 TRP HB2 1 1 9 2347 1 1 5 TRP HB3 H -4.176 -6.077 -1.263 1.00 . A A . 5 TRP HB3 1 1 9 2348 1 1 5 TRP HD1 H -7.461 -6.288 -2.846 1.00 . A A . 5 TRP HD1 1 1 9 2349 1 1 5 TRP HE1 H -8.842 -8.234 -1.868 1.00 . A A . 5 TRP HE1 1 1 9 2350 1 1 5 TRP HE3 H -4.682 -7.339 1.301 1.00 . A A . 5 TRP HE3 1 1 9 2351 1 1 5 TRP HH2 H -7.400 -10.491 2.388 1.00 . A A . 5 TRP HH2 1 1 9 2352 1 1 5 TRP HZ2 H -8.773 -10.005 0.378 1.00 . A A . 5 TRP HZ2 1 1 9 2353 1 1 5 TRP HZ3 H -5.360 -9.158 2.845 1.00 . A A . 5 TRP HZ3 1 1 9 2354 1 1 5 TRP N N -6.262 -3.582 -0.684 1.00 . A A . 5 TRP N 1 1 9 2355 1 1 5 TRP NE1 N -8.025 -7.889 -1.453 1.00 . A A . 5 TRP NE1 1 1 9 2356 1 1 5 TRP O O -3.188 -3.601 -0.905 1.00 . A A . 5 TRP O 1 1 9 2357 1 1 6 PRO C C -1.155 -3.926 1.416 1.00 . A A . 6 PRO C 1 1 9 2358 1 1 6 PRO CA C -2.329 -2.971 1.635 1.00 . A A . 6 PRO CA 1 1 9 2359 1 1 6 PRO CB C -2.498 -2.639 3.114 1.00 . A A . 6 PRO CB 1 1 9 2360 1 1 6 PRO CD C -4.418 -3.944 2.461 1.00 . A A . 6 PRO CD 1 1 9 2361 1 1 6 PRO CG C -3.508 -3.620 3.618 1.00 . A A . 6 PRO CG 1 1 9 2362 1 1 6 PRO HA H -2.197 -2.066 1.066 1.00 . A A . 6 PRO HA 1 1 9 2363 1 1 6 PRO HB2 H -1.558 -2.761 3.635 1.00 . A A . 6 PRO HB2 1 1 9 2364 1 1 6 PRO HB3 H -2.868 -1.634 3.231 1.00 . A A . 6 PRO HB3 1 1 9 2365 1 1 6 PRO HD2 H -4.688 -4.991 2.475 1.00 . A A . 6 PRO HD2 1 1 9 2366 1 1 6 PRO HD3 H -5.299 -3.322 2.482 1.00 . A A . 6 PRO HD3 1 1 9 2367 1 1 6 PRO HG2 H -3.011 -4.516 3.963 1.00 . A A . 6 PRO HG2 1 1 9 2368 1 1 6 PRO HG3 H -4.083 -3.182 4.419 1.00 . A A . 6 PRO HG3 1 1 9 2369 1 1 6 PRO N N -3.607 -3.634 1.279 1.00 . A A . 6 PRO N 1 1 9 2370 1 1 6 PRO O O -0.689 -4.576 2.330 1.00 . A A . 6 PRO O 1 1 9 2371 1 1 7 TRP C C 1.626 -4.135 -0.688 1.00 . A A . 7 TRP C 1 1 9 2372 1 1 7 TRP CA C 0.469 -4.923 -0.081 1.00 . A A . 7 TRP CA 1 1 9 2373 1 1 7 TRP CB C -0.070 -5.935 -1.085 1.00 . A A . 7 TRP CB 1 1 9 2374 1 1 7 TRP CD1 C -1.450 -7.797 -0.077 1.00 . A A . 7 TRP CD1 1 1 9 2375 1 1 7 TRP CD2 C 0.758 -8.213 0.012 1.00 . A A . 7 TRP CD2 1 1 9 2376 1 1 7 TRP CE2 C 0.113 -9.324 0.602 1.00 . A A . 7 TRP CE2 1 1 9 2377 1 1 7 TRP CE3 C 2.163 -8.224 -0.061 1.00 . A A . 7 TRP CE3 1 1 9 2378 1 1 7 TRP CG C -0.257 -7.258 -0.413 1.00 . A A . 7 TRP CG 1 1 9 2379 1 1 7 TRP CH2 C 2.228 -10.403 1.025 1.00 . A A . 7 TRP CH2 1 1 9 2380 1 1 7 TRP CZ2 C 0.833 -10.408 1.104 1.00 . A A . 7 TRP CZ2 1 1 9 2381 1 1 7 TRP CZ3 C 2.892 -9.313 0.444 1.00 . A A . 7 TRP CZ3 1 1 9 2382 1 1 7 TRP H H -1.069 -3.478 -0.511 1.00 . A A . 7 TRP H 1 1 9 2383 1 1 7 TRP HA H 0.787 -5.424 0.819 1.00 . A A . 7 TRP HA 1 1 9 2384 1 1 7 TRP HB2 H -1.018 -5.587 -1.467 1.00 . A A . 7 TRP HB2 1 1 9 2385 1 1 7 TRP HB3 H 0.630 -6.039 -1.897 1.00 . A A . 7 TRP HB3 1 1 9 2386 1 1 7 TRP HD1 H -2.416 -7.344 -0.251 1.00 . A A . 7 TRP HD1 1 1 9 2387 1 1 7 TRP HE1 H -1.935 -9.620 0.862 1.00 . A A . 7 TRP HE1 1 1 9 2388 1 1 7 TRP HE3 H 2.684 -7.389 -0.507 1.00 . A A . 7 TRP HE3 1 1 9 2389 1 1 7 TRP HH2 H 2.795 -11.237 1.412 1.00 . A A . 7 TRP HH2 1 1 9 2390 1 1 7 TRP HZ2 H 0.317 -11.245 1.551 1.00 . A A . 7 TRP HZ2 1 1 9 2391 1 1 7 TRP HZ3 H 3.970 -9.311 0.384 1.00 . A A . 7 TRP HZ3 1 1 9 2392 1 1 7 TRP N N -0.675 -4.012 0.207 1.00 . A A . 7 TRP N 1 1 9 2393 1 1 7 TRP NE1 N -1.233 -9.023 0.525 1.00 . A A . 7 TRP NE1 1 1 9 2394 1 1 7 TRP O O 2.106 -4.435 -1.763 1.00 . A A . 7 TRP O 1 1 9 2395 1 1 8 TRP C C 4.059 -1.790 0.639 1.00 . A A . 8 TRP C 1 1 9 2396 1 1 8 TRP CA C 3.208 -2.313 -0.520 1.00 . A A . 8 TRP CA 1 1 9 2397 1 1 8 TRP CB C 2.550 -1.155 -1.270 1.00 . A A . 8 TRP CB 1 1 9 2398 1 1 8 TRP CD1 C 4.160 0.603 -2.101 1.00 . A A . 8 TRP CD1 1 1 9 2399 1 1 8 TRP CD2 C 3.990 -1.146 -3.504 1.00 . A A . 8 TRP CD2 1 1 9 2400 1 1 8 TRP CE2 C 4.913 -0.246 -4.088 1.00 . A A . 8 TRP CE2 1 1 9 2401 1 1 8 TRP CE3 C 3.702 -2.339 -4.192 1.00 . A A . 8 TRP CE3 1 1 9 2402 1 1 8 TRP CG C 3.525 -0.582 -2.245 1.00 . A A . 8 TRP CG 1 1 9 2403 1 1 8 TRP CH2 C 5.230 -1.709 -5.980 1.00 . A A . 8 TRP CH2 1 1 9 2404 1 1 8 TRP CZ2 C 5.528 -0.519 -5.311 1.00 . A A . 8 TRP CZ2 1 1 9 2405 1 1 8 TRP CZ3 C 4.319 -2.617 -5.422 1.00 . A A . 8 TRP CZ3 1 1 9 2406 1 1 8 TRP H H 1.674 -2.917 0.860 1.00 . A A . 8 TRP H 1 1 9 2407 1 1 8 TRP HA H 3.807 -2.895 -1.197 1.00 . A A . 8 TRP HA 1 1 9 2408 1 1 8 TRP HB2 H 1.680 -1.516 -1.799 1.00 . A A . 8 TRP HB2 1 1 9 2409 1 1 8 TRP HB3 H 2.253 -0.392 -0.566 1.00 . A A . 8 TRP HB3 1 1 9 2410 1 1 8 TRP HD1 H 4.042 1.279 -1.268 1.00 . A A . 8 TRP HD1 1 1 9 2411 1 1 8 TRP HE1 H 5.552 1.591 -3.336 1.00 . A A . 8 TRP HE1 1 1 9 2412 1 1 8 TRP HE3 H 3.003 -3.045 -3.768 1.00 . A A . 8 TRP HE3 1 1 9 2413 1 1 8 TRP HH2 H 5.702 -1.929 -6.926 1.00 . A A . 8 TRP HH2 1 1 9 2414 1 1 8 TRP HZ2 H 6.229 0.185 -5.737 1.00 . A A . 8 TRP HZ2 1 1 9 2415 1 1 8 TRP HZ3 H 4.092 -3.537 -5.940 1.00 . A A . 8 TRP HZ3 1 1 9 2416 1 1 8 TRP N N 2.078 -3.131 0.000 1.00 . A A . 8 TRP N 1 1 9 2417 1 1 8 TRP NE1 N 4.982 0.806 -3.195 1.00 . A A . 8 TRP NE1 1 1 9 2418 1 1 8 TRP O O 3.645 -0.912 1.370 1.00 . A A . 8 TRP O 1 1 9 2419 1 1 9 PRO C C 7.035 -0.803 1.397 1.00 . A A . 9 PRO C 1 1 9 2420 1 1 9 PRO CA C 6.155 -1.969 1.847 1.00 . A A . 9 PRO CA 1 1 9 2421 1 1 9 PRO CB C 6.985 -3.227 2.056 1.00 . A A . 9 PRO CB 1 1 9 2422 1 1 9 PRO CD C 5.782 -3.420 -0.065 1.00 . A A . 9 PRO CD 1 1 9 2423 1 1 9 PRO CG C 6.926 -3.978 0.754 1.00 . A A . 9 PRO CG 1 1 9 2424 1 1 9 PRO HA H 5.619 -1.719 2.745 1.00 . A A . 9 PRO HA 1 1 9 2425 1 1 9 PRO HB2 H 8.008 -2.962 2.292 1.00 . A A . 9 PRO HB2 1 1 9 2426 1 1 9 PRO HB3 H 6.561 -3.825 2.844 1.00 . A A . 9 PRO HB3 1 1 9 2427 1 1 9 PRO HD2 H 6.151 -3.015 -0.998 1.00 . A A . 9 PRO HD2 1 1 9 2428 1 1 9 PRO HD3 H 5.038 -4.178 -0.249 1.00 . A A . 9 PRO HD3 1 1 9 2429 1 1 9 PRO HG2 H 7.856 -3.852 0.219 1.00 . A A . 9 PRO HG2 1 1 9 2430 1 1 9 PRO HG3 H 6.755 -5.026 0.946 1.00 . A A . 9 PRO HG3 1 1 9 2431 1 1 9 PRO N N 5.224 -2.361 0.770 1.00 . A A . 9 PRO N 1 1 9 2432 1 1 9 PRO O O 8.180 -0.688 1.786 1.00 . A A . 9 PRO O 1 1 9 2433 1 1 10 TRP C C 6.794 2.511 0.735 1.00 . A A . 10 TRP C 1 1 9 2434 1 1 10 TRP CA C 7.298 1.216 0.096 1.00 . A A . 10 TRP CA 1 1 9 2435 1 1 10 TRP CB C 7.067 1.234 -1.412 1.00 . A A . 10 TRP CB 1 1 9 2436 1 1 10 TRP CD1 C 9.236 2.324 -2.129 1.00 . A A . 10 TRP CD1 1 1 9 2437 1 1 10 TRP CD2 C 8.995 0.237 -2.915 1.00 . A A . 10 TRP CD2 1 1 9 2438 1 1 10 TRP CE2 C 10.239 0.703 -3.396 1.00 . A A . 10 TRP CE2 1 1 9 2439 1 1 10 TRP CE3 C 8.588 -1.057 -3.261 1.00 . A A . 10 TRP CE3 1 1 9 2440 1 1 10 TRP CG C 8.380 1.278 -2.118 1.00 . A A . 10 TRP CG 1 1 9 2441 1 1 10 TRP CH2 C 10.638 -1.385 -4.537 1.00 . A A . 10 TRP CH2 1 1 9 2442 1 1 10 TRP CZ2 C 11.056 -0.094 -4.198 1.00 . A A . 10 TRP CZ2 1 1 9 2443 1 1 10 TRP CZ3 C 9.405 -1.867 -4.068 1.00 . A A . 10 TRP CZ3 1 1 9 2444 1 1 10 TRP H H 5.585 -0.061 0.282 1.00 . A A . 10 TRP H 1 1 9 2445 1 1 10 TRP HA H 8.339 1.070 0.304 1.00 . A A . 10 TRP HA 1 1 9 2446 1 1 10 TRP HB2 H 6.535 0.339 -1.701 1.00 . A A . 10 TRP HB2 1 1 9 2447 1 1 10 TRP HB3 H 6.485 2.095 -1.679 1.00 . A A . 10 TRP HB3 1 1 9 2448 1 1 10 TRP HD1 H 9.082 3.268 -1.627 1.00 . A A . 10 TRP HD1 1 1 9 2449 1 1 10 TRP HE1 H 11.113 2.566 -3.059 1.00 . A A . 10 TRP HE1 1 1 9 2450 1 1 10 TRP HE3 H 7.640 -1.429 -2.901 1.00 . A A . 10 TRP HE3 1 1 9 2451 1 1 10 TRP HH2 H 11.262 -2.011 -5.156 1.00 . A A . 10 TRP HH2 1 1 9 2452 1 1 10 TRP HZ2 H 12.002 0.283 -4.555 1.00 . A A . 10 TRP HZ2 1 1 9 2453 1 1 10 TRP HZ3 H 9.084 -2.865 -4.330 1.00 . A A . 10 TRP HZ3 1 1 9 2454 1 1 10 TRP N N 6.506 0.058 0.580 1.00 . A A . 10 TRP N 1 1 9 2455 1 1 10 TRP NE1 N 10.342 1.985 -2.889 1.00 . A A . 10 TRP NE1 1 1 9 2456 1 1 10 TRP O O 7.488 3.152 1.499 1.00 . A A . 10 TRP O 1 1 9 2457 1 1 11 ARG C C 3.695 3.839 1.694 1.00 . A A . 11 ARG C 1 1 9 2458 1 1 11 ARG CA C 5.026 4.140 1.006 1.00 . A A . 11 ARG CA 1 1 9 2459 1 1 11 ARG CB C 4.815 5.094 -0.177 1.00 . A A . 11 ARG CB 1 1 9 2460 1 1 11 ARG CD C 3.722 5.202 -2.426 1.00 . A A . 11 ARG CD 1 1 9 2461 1 1 11 ARG CG C 4.507 4.311 -1.458 1.00 . A A . 11 ARG CG 1 1 9 2462 1 1 11 ARG CZ C 3.460 4.208 -4.618 1.00 . A A . 11 ARG CZ 1 1 9 2463 1 1 11 ARG H H 5.052 2.365 -0.186 1.00 . A A . 11 ARG H 1 1 9 2464 1 1 11 ARG HA H 5.718 4.569 1.708 1.00 . A A . 11 ARG HA 1 1 9 2465 1 1 11 ARG HB2 H 3.988 5.744 0.043 1.00 . A A . 11 ARG HB2 1 1 9 2466 1 1 11 ARG HB3 H 5.707 5.685 -0.326 1.00 . A A . 11 ARG HB3 1 1 9 2467 1 1 11 ARG HD2 H 2.664 4.995 -2.351 1.00 . A A . 11 ARG HD2 1 1 9 2468 1 1 11 ARG HD3 H 3.920 6.244 -2.222 1.00 . A A . 11 ARG HD3 1 1 9 2469 1 1 11 ARG HE H 5.146 5.083 -4.038 1.00 . A A . 11 ARG HE 1 1 9 2470 1 1 11 ARG HG2 H 5.430 4.002 -1.923 1.00 . A A . 11 ARG HG2 1 1 9 2471 1 1 11 ARG HG3 H 3.915 3.441 -1.217 1.00 . A A . 11 ARG HG3 1 1 9 2472 1 1 11 ARG HH11 H 2.979 2.761 -3.321 1.00 . A A . 11 ARG HH11 1 1 9 2473 1 1 11 ARG HH12 H 2.262 2.627 -4.891 1.00 . A A . 11 ARG HH12 1 1 9 2474 1 1 11 ARG HH21 H 3.761 5.505 -6.112 1.00 . A A . 11 ARG HH21 1 1 9 2475 1 1 11 ARG HH22 H 2.705 4.179 -6.471 1.00 . A A . 11 ARG HH22 1 1 9 2476 1 1 11 ARG N N 5.589 2.895 0.427 1.00 . A A . 11 ARG N 1 1 9 2477 1 1 11 ARG NE N 4.232 4.842 -3.778 1.00 . A A . 11 ARG NE 1 1 9 2478 1 1 11 ARG NH1 N 2.853 3.114 -4.247 1.00 . A A . 11 ARG NH1 1 1 9 2479 1 1 11 ARG NH2 N 3.296 4.668 -5.828 1.00 . A A . 11 ARG NH2 1 1 9 2480 1 1 11 ARG O O 2.655 4.328 1.306 1.00 . A A . 11 ARG O 1 1 9 2481 1 1 12 ARG C C 2.133 3.779 4.454 1.00 . A A . 12 ARG C 1 1 9 2482 1 1 12 ARG CA C 2.475 2.685 3.439 1.00 . A A . 12 ARG CA 1 1 9 2483 1 1 12 ARG CB C 2.781 1.368 4.153 1.00 . A A . 12 ARG CB 1 1 9 2484 1 1 12 ARG CD C 1.726 -0.191 5.798 1.00 . A A . 12 ARG CD 1 1 9 2485 1 1 12 ARG CG C 1.471 0.704 4.584 1.00 . A A . 12 ARG CG 1 1 9 2486 1 1 12 ARG CZ C 1.033 -2.487 6.133 1.00 . A A . 12 ARG CZ 1 1 9 2487 1 1 12 ARG H H 4.587 2.652 3.002 1.00 . A A . 12 ARG H 1 1 9 2488 1 1 12 ARG HA H 1.663 2.547 2.743 1.00 . A A . 12 ARG HA 1 1 9 2489 1 1 12 ARG HB2 H 3.314 0.710 3.481 1.00 . A A . 12 ARG HB2 1 1 9 2490 1 1 12 ARG HB3 H 3.387 1.563 5.024 1.00 . A A . 12 ARG HB3 1 1 9 2491 1 1 12 ARG HD2 H 2.749 -0.084 6.133 1.00 . A A . 12 ARG HD2 1 1 9 2492 1 1 12 ARG HD3 H 1.040 0.049 6.594 1.00 . A A . 12 ARG HD3 1 1 9 2493 1 1 12 ARG HE H 1.652 -1.805 4.373 1.00 . A A . 12 ARG HE 1 1 9 2494 1 1 12 ARG HG2 H 0.750 1.468 4.842 1.00 . A A . 12 ARG HG2 1 1 9 2495 1 1 12 ARG HG3 H 1.086 0.107 3.772 1.00 . A A . 12 ARG HG3 1 1 9 2496 1 1 12 ARG HH11 H -0.474 -1.357 6.809 1.00 . A A . 12 ARG HH11 1 1 9 2497 1 1 12 ARG HH12 H -0.355 -2.940 7.503 1.00 . A A . 12 ARG HH12 1 1 9 2498 1 1 12 ARG HH21 H 2.436 -3.831 5.647 1.00 . A A . 12 ARG HH21 1 1 9 2499 1 1 12 ARG HH22 H 1.292 -4.340 6.845 1.00 . A A . 12 ARG HH22 1 1 9 2500 1 1 12 ARG N N 3.730 3.031 2.714 1.00 . A A . 12 ARG N 1 1 9 2501 1 1 12 ARG NE N 1.480 -1.577 5.310 1.00 . A A . 12 ARG NE 1 1 9 2502 1 1 12 ARG NH1 N -0.014 -2.242 6.873 1.00 . A A . 12 ARG NH1 1 1 9 2503 1 1 12 ARG NH2 N 1.634 -3.643 6.215 1.00 . A A . 12 ARG NH2 1 1 9 2504 1 1 12 ARG O O 2.641 3.797 5.557 1.00 . A A . 12 ARG O 1 1 9 2505 1 1 13 LYS C C -0.611 5.766 5.283 1.00 . A A . 13 LYS C 1 1 9 2506 1 1 13 LYS CA C 0.901 5.783 5.031 1.00 . A A . 13 LYS CA 1 1 9 2507 1 1 13 LYS CB C 1.325 7.072 4.326 1.00 . A A . 13 LYS CB 1 1 9 2508 1 1 13 LYS CD C 3.528 8.210 4.010 1.00 . A A . 13 LYS CD 1 1 9 2509 1 1 13 LYS CE C 4.228 8.620 2.713 1.00 . A A . 13 LYS CE 1 1 9 2510 1 1 13 LYS CG C 2.746 6.914 3.783 1.00 . A A . 13 LYS CG 1 1 9 2511 1 1 13 LYS H H 0.877 4.661 3.194 1.00 . A A . 13 LYS H 1 1 9 2512 1 1 13 LYS HA H 1.438 5.679 5.960 1.00 . A A . 13 LYS HA 1 1 9 2513 1 1 13 LYS HB2 H 0.646 7.276 3.511 1.00 . A A . 13 LYS HB2 1 1 9 2514 1 1 13 LYS HB3 H 1.300 7.893 5.029 1.00 . A A . 13 LYS HB3 1 1 9 2515 1 1 13 LYS HD2 H 2.846 8.992 4.315 1.00 . A A . 13 LYS HD2 1 1 9 2516 1 1 13 LYS HD3 H 4.267 8.054 4.782 1.00 . A A . 13 LYS HD3 1 1 9 2517 1 1 13 LYS HE2 H 4.890 7.832 2.379 1.00 . A A . 13 LYS HE2 1 1 9 2518 1 1 13 LYS HE3 H 3.502 8.852 1.950 1.00 . A A . 13 LYS HE3 1 1 9 2519 1 1 13 LYS HG2 H 3.239 6.101 4.295 1.00 . A A . 13 LYS HG2 1 1 9 2520 1 1 13 LYS HG3 H 2.706 6.702 2.725 1.00 . A A . 13 LYS HG3 1 1 9 2521 1 1 13 LYS HZ1 H 4.476 10.399 3.765 1.00 . A A . 13 LYS HZ1 1 1 9 2522 1 1 13 LYS HZ2 H 5.160 10.412 2.209 1.00 . A A . 13 LYS HZ2 1 1 9 2523 1 1 13 LYS HZ3 H 5.922 9.564 3.469 1.00 . A A . 13 LYS HZ3 1 1 9 2524 1 1 13 LYS N N 1.275 4.692 4.089 1.00 . A A . 13 LYS N 1 1 9 2525 1 1 13 LYS NZ N 5.005 9.841 3.065 1.00 . A A . 13 LYS NZ 1 1 9 2526 1 1 13 LYS O O -1.151 4.786 5.758 1.00 . A A . 13 LYS O 1 1 9 2527 1 1 14 NH2 HN1 H -0.898 7.608 4.604 1.00 . A A . 14 NH2 HN1 1 1 9 2528 1 1 14 NH2 HN2 H -2.293 6.811 5.144 1.00 . A A . 14 NH2 HN2 1 1 9 2529 1 1 14 NH2 N N -1.326 6.817 4.986 1.00 . A A . 14 NH2 N 1 1 10 2530 1 1 1 ILE C C -9.490 -4.859 0.911 1.00 . A A . 1 ILE C 1 1 10 2531 1 1 1 ILE CA C -9.875 -6.098 0.099 1.00 . A A . 1 ILE CA 1 1 10 2532 1 1 1 ILE CB C -10.887 -6.950 0.867 1.00 . A A . 1 ILE CB 1 1 10 2533 1 1 1 ILE CD1 C -12.813 -5.460 0.308 1.00 . A A . 1 ILE CD1 1 1 10 2534 1 1 1 ILE CG1 C -11.979 -6.048 1.447 1.00 . A A . 1 ILE CG1 1 1 10 2535 1 1 1 ILE CG2 C -10.177 -7.687 2.005 1.00 . A A . 1 ILE CG2 1 1 10 2536 1 1 1 ILE H1 H -8.995 -7.892 -0.491 1.00 . A A . 1 ILE H1 1 1 10 2537 1 1 1 ILE H2 H -8.224 -7.140 0.824 1.00 . A A . 1 ILE H2 1 1 10 2538 1 1 1 ILE H3 H -8.020 -6.526 -0.747 1.00 . A A . 1 ILE H3 1 1 10 2539 1 1 1 ILE HA H -10.288 -5.808 -0.855 1.00 . A A . 1 ILE HA 1 1 10 2540 1 1 1 ILE HB H -11.332 -7.670 0.196 1.00 . A A . 1 ILE HB 1 1 10 2541 1 1 1 ILE HD11 H -12.957 -4.403 0.478 1.00 . A A . 1 ILE HD11 1 1 10 2542 1 1 1 ILE HD12 H -13.774 -5.954 0.274 1.00 . A A . 1 ILE HD12 1 1 10 2543 1 1 1 ILE HD13 H -12.299 -5.608 -0.629 1.00 . A A . 1 ILE HD13 1 1 10 2544 1 1 1 ILE HG12 H -12.615 -6.629 2.100 1.00 . A A . 1 ILE HG12 1 1 10 2545 1 1 1 ILE HG13 H -11.523 -5.247 2.008 1.00 . A A . 1 ILE HG13 1 1 10 2546 1 1 1 ILE HG21 H -9.543 -8.459 1.595 1.00 . A A . 1 ILE HG21 1 1 10 2547 1 1 1 ILE HG22 H -10.912 -8.132 2.658 1.00 . A A . 1 ILE HG22 1 1 10 2548 1 1 1 ILE HG23 H -9.575 -6.987 2.565 1.00 . A A . 1 ILE HG23 1 1 10 2549 1 1 1 ILE N N -8.689 -6.980 -0.093 1.00 . A A . 1 ILE N 1 1 10 2550 1 1 1 ILE O O -8.479 -4.838 1.587 1.00 . A A . 1 ILE O 1 1 10 2551 1 1 2 LEU C C -8.705 -1.933 1.057 1.00 . A A . 2 LEU C 1 1 10 2552 1 1 2 LEU CA C -9.966 -2.589 1.617 1.00 . A A . 2 LEU CA 1 1 10 2553 1 1 2 LEU CB C -9.737 -3.058 3.055 1.00 . A A . 2 LEU CB 1 1 10 2554 1 1 2 LEU CD1 C -11.499 -3.126 4.824 1.00 . A A . 2 LEU CD1 1 1 10 2555 1 1 2 LEU CD2 C -9.667 -1.434 4.950 1.00 . A A . 2 LEU CD2 1 1 10 2556 1 1 2 LEU CG C -10.585 -2.212 4.007 1.00 . A A . 2 LEU CG 1 1 10 2557 1 1 2 LEU H H -11.095 -3.866 0.298 1.00 . A A . 2 LEU H 1 1 10 2558 1 1 2 LEU HA H -10.795 -1.900 1.579 1.00 . A A . 2 LEU HA 1 1 10 2559 1 1 2 LEU HB2 H -10.021 -4.097 3.144 1.00 . A A . 2 LEU HB2 1 1 10 2560 1 1 2 LEU HB3 H -8.695 -2.945 3.309 1.00 . A A . 2 LEU HB3 1 1 10 2561 1 1 2 LEU HD11 H -12.381 -3.363 4.248 1.00 . A A . 2 LEU HD11 1 1 10 2562 1 1 2 LEU HD12 H -11.790 -2.622 5.735 1.00 . A A . 2 LEU HD12 1 1 10 2563 1 1 2 LEU HD13 H -10.974 -4.036 5.070 1.00 . A A . 2 LEU HD13 1 1 10 2564 1 1 2 LEU HD21 H -9.607 -1.947 5.899 1.00 . A A . 2 LEU HD21 1 1 10 2565 1 1 2 LEU HD22 H -10.064 -0.441 5.101 1.00 . A A . 2 LEU HD22 1 1 10 2566 1 1 2 LEU HD23 H -8.680 -1.365 4.516 1.00 . A A . 2 LEU HD23 1 1 10 2567 1 1 2 LEU HG H -11.187 -1.521 3.434 1.00 . A A . 2 LEU HG 1 1 10 2568 1 1 2 LEU N N -10.285 -3.828 0.849 1.00 . A A . 2 LEU N 1 1 10 2569 1 1 2 LEU O O -7.597 -2.334 1.349 1.00 . A A . 2 LEU O 1 1 10 2570 1 1 3 LYS C C -6.882 -1.203 -1.197 1.00 . A A . 3 LYS C 1 1 10 2571 1 1 3 LYS CA C -7.689 -0.231 -0.337 1.00 . A A . 3 LYS CA 1 1 10 2572 1 1 3 LYS CB C -6.864 0.238 0.862 1.00 . A A . 3 LYS CB 1 1 10 2573 1 1 3 LYS CD C -6.976 1.963 2.667 1.00 . A A . 3 LYS CD 1 1 10 2574 1 1 3 LYS CE C -6.025 1.242 3.625 1.00 . A A . 3 LYS CE 1 1 10 2575 1 1 3 LYS CG C -7.780 0.931 1.873 1.00 . A A . 3 LYS CG 1 1 10 2576 1 1 3 LYS H H -9.776 -0.619 0.030 1.00 . A A . 3 LYS H 1 1 10 2577 1 1 3 LYS HA H -8.003 0.618 -0.925 1.00 . A A . 3 LYS HA 1 1 10 2578 1 1 3 LYS HB2 H -6.390 -0.614 1.329 1.00 . A A . 3 LYS HB2 1 1 10 2579 1 1 3 LYS HB3 H -6.107 0.934 0.529 1.00 . A A . 3 LYS HB3 1 1 10 2580 1 1 3 LYS HD2 H -6.406 2.577 1.983 1.00 . A A . 3 LYS HD2 1 1 10 2581 1 1 3 LYS HD3 H -7.653 2.586 3.233 1.00 . A A . 3 LYS HD3 1 1 10 2582 1 1 3 LYS HE2 H -5.593 0.376 3.142 1.00 . A A . 3 LYS HE2 1 1 10 2583 1 1 3 LYS HE3 H -5.250 1.914 3.961 1.00 . A A . 3 LYS HE3 1 1 10 2584 1 1 3 LYS HG2 H -8.585 1.427 1.347 1.00 . A A . 3 LYS HG2 1 1 10 2585 1 1 3 LYS HG3 H -8.190 0.197 2.550 1.00 . A A . 3 LYS HG3 1 1 10 2586 1 1 3 LYS HZ1 H -7.141 1.668 5.329 1.00 . A A . 3 LYS HZ1 1 1 10 2587 1 1 3 LYS HZ2 H -6.349 0.166 5.375 1.00 . A A . 3 LYS HZ2 1 1 10 2588 1 1 3 LYS HZ3 H -7.739 0.368 4.419 1.00 . A A . 3 LYS HZ3 1 1 10 2589 1 1 3 LYS N N -8.872 -0.923 0.250 1.00 . A A . 3 LYS N 1 1 10 2590 1 1 3 LYS NZ N -6.877 0.830 4.774 1.00 . A A . 3 LYS NZ 1 1 10 2591 1 1 3 LYS O O -5.718 -1.446 -0.946 1.00 . A A . 3 LYS O 1 1 10 2592 1 1 4 LYS C C -5.717 -3.476 -2.401 1.00 . A A . 4 LYS C 1 1 10 2593 1 1 4 LYS CA C -6.814 -2.701 -3.127 1.00 . A A . 4 LYS CA 1 1 10 2594 1 1 4 LYS CB C -6.278 -1.818 -4.241 1.00 . A A . 4 LYS CB 1 1 10 2595 1 1 4 LYS CD C -4.905 0.271 -4.182 1.00 . A A . 4 LYS CD 1 1 10 2596 1 1 4 LYS CE C -3.560 0.871 -3.767 1.00 . A A . 4 LYS CE 1 1 10 2597 1 1 4 LYS CG C -4.918 -1.224 -3.860 1.00 . A A . 4 LYS CG 1 1 10 2598 1 1 4 LYS H H -8.429 -1.517 -2.395 1.00 . A A . 4 LYS H 1 1 10 2599 1 1 4 LYS HA H -7.532 -3.395 -3.528 1.00 . A A . 4 LYS HA 1 1 10 2600 1 1 4 LYS HB2 H -6.184 -2.404 -5.131 1.00 . A A . 4 LYS HB2 1 1 10 2601 1 1 4 LYS HB3 H -6.977 -1.020 -4.413 1.00 . A A . 4 LYS HB3 1 1 10 2602 1 1 4 LYS HD2 H -5.050 0.411 -5.244 1.00 . A A . 4 LYS HD2 1 1 10 2603 1 1 4 LYS HD3 H -5.698 0.764 -3.641 1.00 . A A . 4 LYS HD3 1 1 10 2604 1 1 4 LYS HE2 H -3.666 1.430 -2.846 1.00 . A A . 4 LYS HE2 1 1 10 2605 1 1 4 LYS HE3 H -2.819 0.095 -3.654 1.00 . A A . 4 LYS HE3 1 1 10 2606 1 1 4 LYS HG2 H -4.746 -1.367 -2.802 1.00 . A A . 4 LYS HG2 1 1 10 2607 1 1 4 LYS HG3 H -4.139 -1.718 -4.420 1.00 . A A . 4 LYS HG3 1 1 10 2608 1 1 4 LYS HZ1 H -3.727 2.659 -4.819 1.00 . A A . 4 LYS HZ1 1 1 10 2609 1 1 4 LYS HZ2 H -3.385 1.311 -5.794 1.00 . A A . 4 LYS HZ2 1 1 10 2610 1 1 4 LYS HZ3 H -2.166 1.995 -4.828 1.00 . A A . 4 LYS HZ3 1 1 10 2611 1 1 4 LYS N N -7.501 -1.747 -2.216 1.00 . A A . 4 LYS N 1 1 10 2612 1 1 4 LYS NZ N -3.181 1.778 -4.885 1.00 . A A . 4 LYS NZ 1 1 10 2613 1 1 4 LYS O O -4.556 -3.455 -2.756 1.00 . A A . 4 LYS O 1 1 10 2614 1 1 5 TRP C C -3.923 -4.121 -0.216 1.00 . A A . 5 TRP C 1 1 10 2615 1 1 5 TRP CA C -5.135 -4.976 -0.597 1.00 . A A . 5 TRP CA 1 1 10 2616 1 1 5 TRP CB C -4.716 -6.114 -1.528 1.00 . A A . 5 TRP CB 1 1 10 2617 1 1 5 TRP CD1 C -6.520 -7.712 -2.290 1.00 . A A . 5 TRP CD1 1 1 10 2618 1 1 5 TRP CD2 C -5.825 -8.126 -0.191 1.00 . A A . 5 TRP CD2 1 1 10 2619 1 1 5 TRP CE2 C -6.825 -9.084 -0.484 1.00 . A A . 5 TRP CE2 1 1 10 2620 1 1 5 TRP CE3 C -5.219 -8.166 1.076 1.00 . A A . 5 TRP CE3 1 1 10 2621 1 1 5 TRP CG C -5.650 -7.266 -1.353 1.00 . A A . 5 TRP CG 1 1 10 2622 1 1 5 TRP CH2 C -6.597 -10.074 1.704 1.00 . A A . 5 TRP CH2 1 1 10 2623 1 1 5 TRP CZ2 C -7.209 -10.048 0.448 1.00 . A A . 5 TRP CZ2 1 1 10 2624 1 1 5 TRP CZ3 C -5.603 -9.135 2.017 1.00 . A A . 5 TRP CZ3 1 1 10 2625 1 1 5 TRP H H -7.057 -4.161 -1.148 1.00 . A A . 5 TRP H 1 1 10 2626 1 1 5 TRP HA H -5.605 -5.377 0.287 1.00 . A A . 5 TRP HA 1 1 10 2627 1 1 5 TRP HB2 H -4.750 -5.772 -2.550 1.00 . A A . 5 TRP HB2 1 1 10 2628 1 1 5 TRP HB3 H -3.711 -6.426 -1.283 1.00 . A A . 5 TRP HB3 1 1 10 2629 1 1 5 TRP HD1 H -6.648 -7.293 -3.277 1.00 . A A . 5 TRP HD1 1 1 10 2630 1 1 5 TRP HE1 H -7.908 -9.296 -2.252 1.00 . A A . 5 TRP HE1 1 1 10 2631 1 1 5 TRP HE3 H -4.454 -7.447 1.326 1.00 . A A . 5 TRP HE3 1 1 10 2632 1 1 5 TRP HH2 H -6.888 -10.816 2.433 1.00 . A A . 5 TRP HH2 1 1 10 2633 1 1 5 TRP HZ2 H -7.974 -10.769 0.202 1.00 . A A . 5 TRP HZ2 1 1 10 2634 1 1 5 TRP HZ3 H -5.131 -9.157 2.989 1.00 . A A . 5 TRP HZ3 1 1 10 2635 1 1 5 TRP N N -6.109 -4.169 -1.386 1.00 . A A . 5 TRP N 1 1 10 2636 1 1 5 TRP NE1 N -7.217 -8.790 -1.776 1.00 . A A . 5 TRP NE1 1 1 10 2637 1 1 5 TRP O O -3.051 -3.882 -1.028 1.00 . A A . 5 TRP O 1 1 10 2638 1 1 6 PRO C C -1.530 -3.687 1.694 1.00 . A A . 6 PRO C 1 1 10 2639 1 1 6 PRO CA C -2.796 -2.848 1.517 1.00 . A A . 6 PRO CA 1 1 10 2640 1 1 6 PRO CB C -3.307 -2.339 2.859 1.00 . A A . 6 PRO CB 1 1 10 2641 1 1 6 PRO CD C -4.923 -3.937 2.045 1.00 . A A . 6 PRO CD 1 1 10 2642 1 1 6 PRO CG C -4.322 -3.348 3.296 1.00 . A A . 6 PRO CG 1 1 10 2643 1 1 6 PRO HA H -2.615 -2.019 0.852 1.00 . A A . 6 PRO HA 1 1 10 2644 1 1 6 PRO HB2 H -2.497 -2.285 3.572 1.00 . A A . 6 PRO HB2 1 1 10 2645 1 1 6 PRO HB3 H -3.772 -1.376 2.740 1.00 . A A . 6 PRO HB3 1 1 10 2646 1 1 6 PRO HD2 H -5.090 -4.999 2.171 1.00 . A A . 6 PRO HD2 1 1 10 2647 1 1 6 PRO HD3 H -5.844 -3.434 1.792 1.00 . A A . 6 PRO HD3 1 1 10 2648 1 1 6 PRO HG2 H -3.843 -4.123 3.879 1.00 . A A . 6 PRO HG2 1 1 10 2649 1 1 6 PRO HG3 H -5.093 -2.868 3.878 1.00 . A A . 6 PRO HG3 1 1 10 2650 1 1 6 PRO N N -3.911 -3.688 1.015 1.00 . A A . 6 PRO N 1 1 10 2651 1 1 6 PRO O O -1.215 -4.136 2.780 1.00 . A A . 6 PRO O 1 1 10 2652 1 1 7 TRP C C 1.582 -4.019 -0.020 1.00 . A A . 7 TRP C 1 1 10 2653 1 1 7 TRP CA C 0.448 -4.707 0.737 1.00 . A A . 7 TRP CA 1 1 10 2654 1 1 7 TRP CB C 0.110 -6.039 0.082 1.00 . A A . 7 TRP CB 1 1 10 2655 1 1 7 TRP CD1 C -1.210 -7.514 1.650 1.00 . A A . 7 TRP CD1 1 1 10 2656 1 1 7 TRP CD2 C 1.008 -7.851 1.808 1.00 . A A . 7 TRP CD2 1 1 10 2657 1 1 7 TRP CE2 C 0.396 -8.733 2.731 1.00 . A A . 7 TRP CE2 1 1 10 2658 1 1 7 TRP CE3 C 2.411 -7.863 1.710 1.00 . A A . 7 TRP CE3 1 1 10 2659 1 1 7 TRP CG C -0.035 -7.089 1.134 1.00 . A A . 7 TRP CG 1 1 10 2660 1 1 7 TRP CH2 C 2.544 -9.594 3.417 1.00 . A A . 7 TRP CH2 1 1 10 2661 1 1 7 TRP CZ2 C 1.150 -9.594 3.527 1.00 . A A . 7 TRP CZ2 1 1 10 2662 1 1 7 TRP CZ3 C 3.172 -8.730 2.511 1.00 . A A . 7 TRP CZ3 1 1 10 2663 1 1 7 TRP H H -1.077 -3.526 -0.226 1.00 . A A . 7 TRP H 1 1 10 2664 1 1 7 TRP HA H 0.719 -4.857 1.768 1.00 . A A . 7 TRP HA 1 1 10 2665 1 1 7 TRP HB2 H -0.815 -5.945 -0.465 1.00 . A A . 7 TRP HB2 1 1 10 2666 1 1 7 TRP HB3 H 0.905 -6.315 -0.596 1.00 . A A . 7 TRP HB3 1 1 10 2667 1 1 7 TRP HD1 H -2.187 -7.151 1.368 1.00 . A A . 7 TRP HD1 1 1 10 2668 1 1 7 TRP HE1 H -1.639 -8.962 3.119 1.00 . A A . 7 TRP HE1 1 1 10 2669 1 1 7 TRP HE3 H 2.906 -7.201 1.014 1.00 . A A . 7 TRP HE3 1 1 10 2670 1 1 7 TRP HH2 H 3.134 -10.259 4.030 1.00 . A A . 7 TRP HH2 1 1 10 2671 1 1 7 TRP HZ2 H 0.660 -10.260 4.224 1.00 . A A . 7 TRP HZ2 1 1 10 2672 1 1 7 TRP HZ3 H 4.249 -8.731 2.427 1.00 . A A . 7 TRP HZ3 1 1 10 2673 1 1 7 TRP N N -0.802 -3.899 0.636 1.00 . A A . 7 TRP N 1 1 10 2674 1 1 7 TRP NE1 N -0.957 -8.490 2.597 1.00 . A A . 7 TRP NE1 1 1 10 2675 1 1 7 TRP O O 2.146 -4.563 -0.949 1.00 . A A . 7 TRP O 1 1 10 2676 1 1 8 TRP C C 4.062 -1.629 0.698 1.00 . A A . 8 TRP C 1 1 10 2677 1 1 8 TRP CA C 3.015 -2.097 -0.315 1.00 . A A . 8 TRP CA 1 1 10 2678 1 1 8 TRP CB C 2.339 -0.897 -0.978 1.00 . A A . 8 TRP CB 1 1 10 2679 1 1 8 TRP CD1 C 3.910 0.693 -2.159 1.00 . A A . 8 TRP CD1 1 1 10 2680 1 1 8 TRP CD2 C 3.360 -1.083 -3.427 1.00 . A A . 8 TRP CD2 1 1 10 2681 1 1 8 TRP CE2 C 4.230 -0.282 -4.203 1.00 . A A . 8 TRP CE2 1 1 10 2682 1 1 8 TRP CE3 C 2.864 -2.270 -3.995 1.00 . A A . 8 TRP CE3 1 1 10 2683 1 1 8 TRP CG C 3.169 -0.439 -2.133 1.00 . A A . 8 TRP CG 1 1 10 2684 1 1 8 TRP CH2 C 4.096 -1.831 -6.050 1.00 . A A . 8 TRP CH2 1 1 10 2685 1 1 8 TRP CZ2 C 4.597 -0.647 -5.501 1.00 . A A . 8 TRP CZ2 1 1 10 2686 1 1 8 TRP CZ3 C 3.232 -2.640 -5.299 1.00 . A A . 8 TRP CZ3 1 1 10 2687 1 1 8 TRP H H 1.449 -2.417 1.119 1.00 . A A . 8 TRP H 1 1 10 2688 1 1 8 TRP HA H 3.466 -2.722 -1.063 1.00 . A A . 8 TRP HA 1 1 10 2689 1 1 8 TRP HB2 H 1.360 -1.184 -1.329 1.00 . A A . 8 TRP HB2 1 1 10 2690 1 1 8 TRP HB3 H 2.246 -0.094 -0.263 1.00 . A A . 8 TRP HB3 1 1 10 2691 1 1 8 TRP HD1 H 3.994 1.406 -1.353 1.00 . A A . 8 TRP HD1 1 1 10 2692 1 1 8 TRP HE1 H 5.131 1.518 -3.665 1.00 . A A . 8 TRP HE1 1 1 10 2693 1 1 8 TRP HE3 H 2.199 -2.901 -3.425 1.00 . A A . 8 TRP HE3 1 1 10 2694 1 1 8 TRP HH2 H 4.374 -2.121 -7.052 1.00 . A A . 8 TRP HH2 1 1 10 2695 1 1 8 TRP HZ2 H 5.263 -0.020 -6.074 1.00 . A A . 8 TRP HZ2 1 1 10 2696 1 1 8 TRP HZ3 H 2.845 -3.554 -5.727 1.00 . A A . 8 TRP HZ3 1 1 10 2697 1 1 8 TRP N N 1.919 -2.828 0.373 1.00 . A A . 8 TRP N 1 1 10 2698 1 1 8 TRP NE1 N 4.537 0.789 -3.389 1.00 . A A . 8 TRP NE1 1 1 10 2699 1 1 8 TRP O O 3.813 -0.735 1.483 1.00 . A A . 8 TRP O 1 1 10 2700 1 1 9 PRO C C 7.149 -0.765 0.974 1.00 . A A . 9 PRO C 1 1 10 2701 1 1 9 PRO CA C 6.314 -1.906 1.555 1.00 . A A . 9 PRO CA 1 1 10 2702 1 1 9 PRO CB C 7.122 -3.194 1.623 1.00 . A A . 9 PRO CB 1 1 10 2703 1 1 9 PRO CD C 5.576 -3.337 -0.266 1.00 . A A . 9 PRO CD 1 1 10 2704 1 1 9 PRO CG C 6.826 -3.930 0.346 1.00 . A A . 9 PRO CG 1 1 10 2705 1 1 9 PRO HA H 5.938 -1.646 2.528 1.00 . A A . 9 PRO HA 1 1 10 2706 1 1 9 PRO HB2 H 8.178 -2.968 1.692 1.00 . A A . 9 PRO HB2 1 1 10 2707 1 1 9 PRO HB3 H 6.809 -3.784 2.467 1.00 . A A . 9 PRO HB3 1 1 10 2708 1 1 9 PRO HD2 H 5.787 -2.950 -1.253 1.00 . A A . 9 PRO HD2 1 1 10 2709 1 1 9 PRO HD3 H 4.786 -4.070 -0.307 1.00 . A A . 9 PRO HD3 1 1 10 2710 1 1 9 PRO HG2 H 7.657 -3.820 -0.338 1.00 . A A . 9 PRO HG2 1 1 10 2711 1 1 9 PRO HG3 H 6.663 -4.975 0.556 1.00 . A A . 9 PRO HG3 1 1 10 2712 1 1 9 PRO N N 5.207 -2.252 0.641 1.00 . A A . 9 PRO N 1 1 10 2713 1 1 9 PRO O O 8.334 -0.656 1.220 1.00 . A A . 9 PRO O 1 1 10 2714 1 1 10 TRP C C 6.911 2.526 0.298 1.00 . A A . 10 TRP C 1 1 10 2715 1 1 10 TRP CA C 7.273 1.219 -0.408 1.00 . A A . 10 TRP CA 1 1 10 2716 1 1 10 TRP CB C 6.802 1.246 -1.858 1.00 . A A . 10 TRP CB 1 1 10 2717 1 1 10 TRP CD1 C 8.825 2.355 -2.897 1.00 . A A . 10 TRP CD1 1 1 10 2718 1 1 10 TRP CD2 C 8.459 0.281 -3.671 1.00 . A A . 10 TRP CD2 1 1 10 2719 1 1 10 TRP CE2 C 9.607 0.760 -4.340 1.00 . A A . 10 TRP CE2 1 1 10 2720 1 1 10 TRP CE3 C 8.001 -1.008 -3.969 1.00 . A A . 10 TRP CE3 1 1 10 2721 1 1 10 TRP CG C 7.982 1.304 -2.765 1.00 . A A . 10 TRP CG 1 1 10 2722 1 1 10 TRP CH2 C 9.815 -1.307 -5.566 1.00 . A A . 10 TRP CH2 1 1 10 2723 1 1 10 TRP CZ2 C 10.282 -0.020 -5.278 1.00 . A A . 10 TRP CZ2 1 1 10 2724 1 1 10 TRP CZ3 C 8.675 -1.800 -4.913 1.00 . A A . 10 TRP CZ3 1 1 10 2725 1 1 10 TRP H H 5.587 -0.033 0.021 1.00 . A A . 10 TRP H 1 1 10 2726 1 1 10 TRP HA H 8.330 1.045 -0.367 1.00 . A A . 10 TRP HA 1 1 10 2727 1 1 10 TRP HB2 H 6.236 0.350 -2.066 1.00 . A A . 10 TRP HB2 1 1 10 2728 1 1 10 TRP HB3 H 6.179 2.107 -2.022 1.00 . A A . 10 TRP HB3 1 1 10 2729 1 1 10 TRP HD1 H 8.752 3.290 -2.360 1.00 . A A . 10 TRP HD1 1 1 10 2730 1 1 10 TRP HE1 H 10.526 2.619 -4.115 1.00 . A A . 10 TRP HE1 1 1 10 2731 1 1 10 TRP HE3 H 7.124 -1.389 -3.466 1.00 . A A . 10 TRP HE3 1 1 10 2732 1 1 10 TRP HH2 H 10.330 -1.919 -6.292 1.00 . A A . 10 TRP HH2 1 1 10 2733 1 1 10 TRP HZ2 H 11.159 0.365 -5.778 1.00 . A A . 10 TRP HZ2 1 1 10 2734 1 1 10 TRP HZ3 H 8.315 -2.794 -5.137 1.00 . A A . 10 TRP HZ3 1 1 10 2735 1 1 10 TRP N N 6.535 0.081 0.203 1.00 . A A . 10 TRP N 1 1 10 2736 1 1 10 TRP NE1 N 9.792 2.033 -3.832 1.00 . A A . 10 TRP NE1 1 1 10 2737 1 1 10 TRP O O 7.765 3.318 0.642 1.00 . A A . 10 TRP O 1 1 10 2738 1 1 11 ARG C C 4.496 3.667 2.494 1.00 . A A . 11 ARG C 1 1 10 2739 1 1 11 ARG CA C 5.217 4.005 1.193 1.00 . A A . 11 ARG CA 1 1 10 2740 1 1 11 ARG CB C 4.267 4.686 0.208 1.00 . A A . 11 ARG CB 1 1 10 2741 1 1 11 ARG CD C 4.875 7.110 0.205 1.00 . A A . 11 ARG CD 1 1 10 2742 1 1 11 ARG CG C 5.015 5.786 -0.548 1.00 . A A . 11 ARG CG 1 1 10 2743 1 1 11 ARG CZ C 6.638 8.632 0.868 1.00 . A A . 11 ARG CZ 1 1 10 2744 1 1 11 ARG H H 4.982 2.100 0.226 1.00 . A A . 11 ARG H 1 1 10 2745 1 1 11 ARG HA H 6.066 4.634 1.390 1.00 . A A . 11 ARG HA 1 1 10 2746 1 1 11 ARG HB2 H 3.895 3.956 -0.495 1.00 . A A . 11 ARG HB2 1 1 10 2747 1 1 11 ARG HB3 H 3.442 5.121 0.748 1.00 . A A . 11 ARG HB3 1 1 10 2748 1 1 11 ARG HD2 H 4.558 7.893 -0.470 1.00 . A A . 11 ARG HD2 1 1 10 2749 1 1 11 ARG HD3 H 4.176 7.008 1.021 1.00 . A A . 11 ARG HD3 1 1 10 2750 1 1 11 ARG HE H 6.833 6.659 0.980 1.00 . A A . 11 ARG HE 1 1 10 2751 1 1 11 ARG HG2 H 6.061 5.522 -0.624 1.00 . A A . 11 ARG HG2 1 1 10 2752 1 1 11 ARG HG3 H 4.598 5.891 -1.538 1.00 . A A . 11 ARG HG3 1 1 10 2753 1 1 11 ARG HH11 H 4.866 9.298 1.519 1.00 . A A . 11 ARG HH11 1 1 10 2754 1 1 11 ARG HH12 H 6.116 10.492 1.398 1.00 . A A . 11 ARG HH12 1 1 10 2755 1 1 11 ARG HH21 H 8.504 8.255 0.246 1.00 . A A . 11 ARG HH21 1 1 10 2756 1 1 11 ARG HH22 H 8.175 9.901 0.677 1.00 . A A . 11 ARG HH22 1 1 10 2757 1 1 11 ARG N N 5.648 2.753 0.512 1.00 . A A . 11 ARG N 1 1 10 2758 1 1 11 ARG NE N 6.238 7.398 0.733 1.00 . A A . 11 ARG NE 1 1 10 2759 1 1 11 ARG NH1 N 5.809 9.544 1.295 1.00 . A A . 11 ARG NH1 1 1 10 2760 1 1 11 ARG NH2 N 7.868 8.954 0.574 1.00 . A A . 11 ARG NH2 1 1 10 2761 1 1 11 ARG O O 3.340 3.991 2.685 1.00 . A A . 11 ARG O 1 1 10 2762 1 1 12 ARG C C 4.335 3.894 5.549 1.00 . A A . 12 ARG C 1 1 10 2763 1 1 12 ARG CA C 4.549 2.646 4.689 1.00 . A A . 12 ARG CA 1 1 10 2764 1 1 12 ARG CB C 5.550 1.700 5.355 1.00 . A A . 12 ARG CB 1 1 10 2765 1 1 12 ARG CD C 5.800 -0.687 6.049 1.00 . A A . 12 ARG CD 1 1 10 2766 1 1 12 ARG CG C 4.813 0.472 5.892 1.00 . A A . 12 ARG CG 1 1 10 2767 1 1 12 ARG CZ C 7.235 -0.914 7.985 1.00 . A A . 12 ARG CZ 1 1 10 2768 1 1 12 ARG H H 6.108 2.772 3.201 1.00 . A A . 12 ARG H 1 1 10 2769 1 1 12 ARG HA H 3.614 2.135 4.523 1.00 . A A . 12 ARG HA 1 1 10 2770 1 1 12 ARG HB2 H 6.290 1.390 4.631 1.00 . A A . 12 ARG HB2 1 1 10 2771 1 1 12 ARG HB3 H 6.038 2.211 6.172 1.00 . A A . 12 ARG HB3 1 1 10 2772 1 1 12 ARG HD2 H 5.301 -1.549 6.471 1.00 . A A . 12 ARG HD2 1 1 10 2773 1 1 12 ARG HD3 H 6.243 -0.935 5.098 1.00 . A A . 12 ARG HD3 1 1 10 2774 1 1 12 ARG HE H 7.236 0.707 6.842 1.00 . A A . 12 ARG HE 1 1 10 2775 1 1 12 ARG HG2 H 4.375 0.707 6.853 1.00 . A A . 12 ARG HG2 1 1 10 2776 1 1 12 ARG HG3 H 4.035 0.188 5.201 1.00 . A A . 12 ARG HG3 1 1 10 2777 1 1 12 ARG HH11 H 7.188 -2.626 6.948 1.00 . A A . 12 ARG HH11 1 1 10 2778 1 1 12 ARG HH12 H 7.679 -2.767 8.602 1.00 . A A . 12 ARG HH12 1 1 10 2779 1 1 12 ARG HH21 H 7.375 0.625 9.258 1.00 . A A . 12 ARG HH21 1 1 10 2780 1 1 12 ARG HH22 H 7.784 -0.927 9.910 1.00 . A A . 12 ARG HH22 1 1 10 2781 1 1 12 ARG N N 5.177 3.016 3.389 1.00 . A A . 12 ARG N 1 1 10 2782 1 1 12 ARG NE N 6.843 -0.179 6.981 1.00 . A A . 12 ARG NE 1 1 10 2783 1 1 12 ARG NH1 N 7.378 -2.203 7.834 1.00 . A A . 12 ARG NH1 1 1 10 2784 1 1 12 ARG NH2 N 7.484 -0.363 9.140 1.00 . A A . 12 ARG NH2 1 1 10 2785 1 1 12 ARG O O 5.233 4.353 6.228 1.00 . A A . 12 ARG O 1 1 10 2786 1 1 13 LYS C C 1.385 5.986 6.332 1.00 . A A . 13 LYS C 1 1 10 2787 1 1 13 LYS CA C 2.883 5.666 6.340 1.00 . A A . 13 LYS CA 1 1 10 2788 1 1 13 LYS CB C 3.674 6.784 5.659 1.00 . A A . 13 LYS CB 1 1 10 2789 1 1 13 LYS CD C 4.705 8.821 6.676 1.00 . A A . 13 LYS CD 1 1 10 2790 1 1 13 LYS CE C 4.539 10.328 6.477 1.00 . A A . 13 LYS CE 1 1 10 2791 1 1 13 LYS CG C 3.386 8.114 6.358 1.00 . A A . 13 LYS CG 1 1 10 2792 1 1 13 LYS H H 2.444 4.062 4.968 1.00 . A A . 13 LYS H 1 1 10 2793 1 1 13 LYS HA H 3.234 5.528 7.350 1.00 . A A . 13 LYS HA 1 1 10 2794 1 1 13 LYS HB2 H 4.730 6.565 5.720 1.00 . A A . 13 LYS HB2 1 1 10 2795 1 1 13 LYS HB3 H 3.381 6.853 4.622 1.00 . A A . 13 LYS HB3 1 1 10 2796 1 1 13 LYS HD2 H 4.982 8.620 7.702 1.00 . A A . 13 LYS HD2 1 1 10 2797 1 1 13 LYS HD3 H 5.477 8.455 6.017 1.00 . A A . 13 LYS HD3 1 1 10 2798 1 1 13 LYS HE2 H 4.557 10.571 5.424 1.00 . A A . 13 LYS HE2 1 1 10 2799 1 1 13 LYS HE3 H 3.618 10.668 6.926 1.00 . A A . 13 LYS HE3 1 1 10 2800 1 1 13 LYS HG2 H 2.788 8.737 5.711 1.00 . A A . 13 LYS HG2 1 1 10 2801 1 1 13 LYS HG3 H 2.849 7.928 7.277 1.00 . A A . 13 LYS HG3 1 1 10 2802 1 1 13 LYS HZ1 H 5.424 11.855 7.581 1.00 . A A . 13 LYS HZ1 1 1 10 2803 1 1 13 LYS HZ2 H 6.478 11.083 6.494 1.00 . A A . 13 LYS HZ2 1 1 10 2804 1 1 13 LYS HZ3 H 6.022 10.309 7.937 1.00 . A A . 13 LYS HZ3 1 1 10 2805 1 1 13 LYS N N 3.154 4.447 5.523 1.00 . A A . 13 LYS N 1 1 10 2806 1 1 13 LYS NZ N 5.703 10.940 7.175 1.00 . A A . 13 LYS NZ 1 1 10 2807 1 1 13 LYS O O 0.861 6.491 5.359 1.00 . A A . 13 LYS O 1 1 10 2808 1 1 14 NH2 HN1 H 1.090 5.302 8.172 1.00 . A A . 14 NH2 HN1 1 1 10 2809 1 1 14 NH2 HN2 H -0.291 5.909 7.393 1.00 . A A . 14 NH2 HN2 1 1 10 2810 1 1 14 NH2 N N 0.669 5.710 7.387 1.00 . A A . 14 NH2 N 1 1 11 2811 1 1 1 ILE C C -9.182 5.157 -3.804 1.00 . A A . 1 ILE C 1 1 11 2812 1 1 1 ILE CA C -10.429 5.834 -4.380 1.00 . A A . 1 ILE CA 1 1 11 2813 1 1 1 ILE CB C -11.004 5.009 -5.531 1.00 . A A . 1 ILE CB 1 1 11 2814 1 1 1 ILE CD1 C -13.082 6.383 -5.343 1.00 . A A . 1 ILE CD1 1 1 11 2815 1 1 1 ILE CG1 C -12.018 5.854 -6.306 1.00 . A A . 1 ILE CG1 1 1 11 2816 1 1 1 ILE CG2 C -11.698 3.765 -4.973 1.00 . A A . 1 ILE CG2 1 1 11 2817 1 1 1 ILE H1 H -10.935 7.688 -5.183 1.00 . A A . 1 ILE H1 1 1 11 2818 1 1 1 ILE H2 H -9.550 6.987 -5.875 1.00 . A A . 1 ILE H2 1 1 11 2819 1 1 1 ILE H3 H -9.471 7.683 -4.327 1.00 . A A . 1 ILE H3 1 1 11 2820 1 1 1 ILE HA H -11.175 5.965 -3.612 1.00 . A A . 1 ILE HA 1 1 11 2821 1 1 1 ILE HB H -10.204 4.708 -6.192 1.00 . A A . 1 ILE HB 1 1 11 2822 1 1 1 ILE HD11 H -12.633 7.090 -4.661 1.00 . A A . 1 ILE HD11 1 1 11 2823 1 1 1 ILE HD12 H -13.505 5.561 -4.784 1.00 . A A . 1 ILE HD12 1 1 11 2824 1 1 1 ILE HD13 H -13.864 6.874 -5.905 1.00 . A A . 1 ILE HD13 1 1 11 2825 1 1 1 ILE HG12 H -11.510 6.685 -6.775 1.00 . A A . 1 ILE HG12 1 1 11 2826 1 1 1 ILE HG13 H -12.490 5.246 -7.062 1.00 . A A . 1 ILE HG13 1 1 11 2827 1 1 1 ILE HG21 H -12.639 3.619 -5.483 1.00 . A A . 1 ILE HG21 1 1 11 2828 1 1 1 ILE HG22 H -11.877 3.897 -3.916 1.00 . A A . 1 ILE HG22 1 1 11 2829 1 1 1 ILE HG23 H -11.068 2.901 -5.126 1.00 . A A . 1 ILE HG23 1 1 11 2830 1 1 1 ILE N N -10.069 7.147 -4.987 1.00 . A A . 1 ILE N 1 1 11 2831 1 1 1 ILE O O -8.071 5.595 -4.019 1.00 . A A . 1 ILE O 1 1 11 2832 1 1 2 LEU C C -8.653 2.210 -1.626 1.00 . A A . 2 LEU C 1 1 11 2833 1 1 2 LEU CA C -8.185 3.384 -2.486 1.00 . A A . 2 LEU CA 1 1 11 2834 1 1 2 LEU CB C -7.479 4.433 -1.627 1.00 . A A . 2 LEU CB 1 1 11 2835 1 1 2 LEU CD1 C -5.550 5.889 -2.266 1.00 . A A . 2 LEU CD1 1 1 11 2836 1 1 2 LEU CD2 C -5.187 3.914 -0.778 1.00 . A A . 2 LEU CD2 1 1 11 2837 1 1 2 LEU CG C -5.988 4.453 -1.966 1.00 . A A . 2 LEU CG 1 1 11 2838 1 1 2 LEU H H -10.265 3.750 -2.912 1.00 . A A . 2 LEU H 1 1 11 2839 1 1 2 LEU HA H -7.525 3.037 -3.265 1.00 . A A . 2 LEU HA 1 1 11 2840 1 1 2 LEU HB2 H -7.906 5.406 -1.822 1.00 . A A . 2 LEU HB2 1 1 11 2841 1 1 2 LEU HB3 H -7.603 4.188 -0.582 1.00 . A A . 2 LEU HB3 1 1 11 2842 1 1 2 LEU HD11 H -4.573 5.878 -2.725 1.00 . A A . 2 LEU HD11 1 1 11 2843 1 1 2 LEU HD12 H -5.511 6.451 -1.345 1.00 . A A . 2 LEU HD12 1 1 11 2844 1 1 2 LEU HD13 H -6.260 6.348 -2.938 1.00 . A A . 2 LEU HD13 1 1 11 2845 1 1 2 LEU HD21 H -4.314 3.391 -1.140 1.00 . A A . 2 LEU HD21 1 1 11 2846 1 1 2 LEU HD22 H -5.803 3.235 -0.208 1.00 . A A . 2 LEU HD22 1 1 11 2847 1 1 2 LEU HD23 H -4.879 4.736 -0.150 1.00 . A A . 2 LEU HD23 1 1 11 2848 1 1 2 LEU HG H -5.809 3.834 -2.835 1.00 . A A . 2 LEU HG 1 1 11 2849 1 1 2 LEU N N -9.359 4.089 -3.073 1.00 . A A . 2 LEU N 1 1 11 2850 1 1 2 LEU O O -9.088 2.378 -0.504 1.00 . A A . 2 LEU O 1 1 11 2851 1 1 3 LYS C C -8.661 -1.456 -2.131 1.00 . A A . 3 LYS C 1 1 11 2852 1 1 3 LYS CA C -9.003 -0.175 -1.368 1.00 . A A . 3 LYS CA 1 1 11 2853 1 1 3 LYS CB C -10.518 -0.022 -1.231 1.00 . A A . 3 LYS CB 1 1 11 2854 1 1 3 LYS CD C -12.661 0.198 -2.497 1.00 . A A . 3 LYS CD 1 1 11 2855 1 1 3 LYS CE C -13.171 1.631 -2.319 1.00 . A A . 3 LYS CE 1 1 11 2856 1 1 3 LYS CG C -11.136 0.208 -2.610 1.00 . A A . 3 LYS CG 1 1 11 2857 1 1 3 LYS H H -8.211 0.910 -3.055 1.00 . A A . 3 LYS H 1 1 11 2858 1 1 3 LYS HA H -8.542 -0.179 -0.394 1.00 . A A . 3 LYS HA 1 1 11 2859 1 1 3 LYS HB2 H -10.932 -0.919 -0.795 1.00 . A A . 3 LYS HB2 1 1 11 2860 1 1 3 LYS HB3 H -10.739 0.823 -0.595 1.00 . A A . 3 LYS HB3 1 1 11 2861 1 1 3 LYS HD2 H -13.087 -0.228 -3.395 1.00 . A A . 3 LYS HD2 1 1 11 2862 1 1 3 LYS HD3 H -12.955 -0.395 -1.643 1.00 . A A . 3 LYS HD3 1 1 11 2863 1 1 3 LYS HE2 H -13.521 1.780 -1.306 1.00 . A A . 3 LYS HE2 1 1 11 2864 1 1 3 LYS HE3 H -12.394 2.339 -2.558 1.00 . A A . 3 LYS HE3 1 1 11 2865 1 1 3 LYS HG2 H -10.809 1.163 -2.996 1.00 . A A . 3 LYS HG2 1 1 11 2866 1 1 3 LYS HG3 H -10.823 -0.578 -3.281 1.00 . A A . 3 LYS HG3 1 1 11 2867 1 1 3 LYS HZ1 H -15.132 1.267 -2.915 1.00 . A A . 3 LYS HZ1 1 1 11 2868 1 1 3 LYS HZ2 H -14.019 1.341 -4.197 1.00 . A A . 3 LYS HZ2 1 1 11 2869 1 1 3 LYS HZ3 H -14.523 2.766 -3.421 1.00 . A A . 3 LYS HZ3 1 1 11 2870 1 1 3 LYS N N -8.565 1.018 -2.148 1.00 . A A . 3 LYS N 1 1 11 2871 1 1 3 LYS NZ N -14.296 1.761 -3.285 1.00 . A A . 3 LYS NZ 1 1 11 2872 1 1 3 LYS O O -9.532 -2.170 -2.588 1.00 . A A . 3 LYS O 1 1 11 2873 1 1 4 LYS C C -5.898 -3.717 -2.250 1.00 . A A . 4 LYS C 1 1 11 2874 1 1 4 LYS CA C -7.003 -2.989 -3.008 1.00 . A A . 4 LYS CA 1 1 11 2875 1 1 4 LYS CB C -6.496 -2.498 -4.356 1.00 . A A . 4 LYS CB 1 1 11 2876 1 1 4 LYS CD C -6.831 -3.816 -6.452 1.00 . A A . 4 LYS CD 1 1 11 2877 1 1 4 LYS CE C -7.570 -5.156 -6.462 1.00 . A A . 4 LYS CE 1 1 11 2878 1 1 4 LYS CG C -7.497 -2.872 -5.451 1.00 . A A . 4 LYS CG 1 1 11 2879 1 1 4 LYS H H -6.711 -1.167 -1.899 1.00 . A A . 4 LYS H 1 1 11 2880 1 1 4 LYS HA H -7.853 -3.637 -3.141 1.00 . A A . 4 LYS HA 1 1 11 2881 1 1 4 LYS HB2 H -6.381 -1.428 -4.319 1.00 . A A . 4 LYS HB2 1 1 11 2882 1 1 4 LYS HB3 H -5.541 -2.955 -4.571 1.00 . A A . 4 LYS HB3 1 1 11 2883 1 1 4 LYS HD2 H -6.865 -3.377 -7.439 1.00 . A A . 4 LYS HD2 1 1 11 2884 1 1 4 LYS HD3 H -5.802 -3.978 -6.165 1.00 . A A . 4 LYS HD3 1 1 11 2885 1 1 4 LYS HE2 H -8.633 -4.997 -6.354 1.00 . A A . 4 LYS HE2 1 1 11 2886 1 1 4 LYS HE3 H -7.359 -5.696 -7.372 1.00 . A A . 4 LYS HE3 1 1 11 2887 1 1 4 LYS HG2 H -8.350 -3.364 -5.003 1.00 . A A . 4 LYS HG2 1 1 11 2888 1 1 4 LYS HG3 H -7.822 -1.979 -5.962 1.00 . A A . 4 LYS HG3 1 1 11 2889 1 1 4 LYS HZ1 H -7.271 -6.908 -5.379 1.00 . A A . 4 LYS HZ1 1 1 11 2890 1 1 4 LYS HZ2 H -7.449 -5.520 -4.416 1.00 . A A . 4 LYS HZ2 1 1 11 2891 1 1 4 LYS HZ3 H -5.998 -5.796 -5.255 1.00 . A A . 4 LYS HZ3 1 1 11 2892 1 1 4 LYS N N -7.398 -1.755 -2.274 1.00 . A A . 4 LYS N 1 1 11 2893 1 1 4 LYS NZ N -7.032 -5.901 -5.290 1.00 . A A . 4 LYS NZ 1 1 11 2894 1 1 4 LYS O O -4.769 -3.801 -2.691 1.00 . A A . 4 LYS O 1 1 11 2895 1 1 5 TRP C C -3.967 -4.119 -0.103 1.00 . A A . 5 TRP C 1 1 11 2896 1 1 5 TRP CA C -5.221 -4.975 -0.295 1.00 . A A . 5 TRP CA 1 1 11 2897 1 1 5 TRP CB C -4.896 -6.230 -1.103 1.00 . A A . 5 TRP CB 1 1 11 2898 1 1 5 TRP CD1 C -6.766 -7.882 -1.507 1.00 . A A . 5 TRP CD1 1 1 11 2899 1 1 5 TRP CD2 C -5.918 -8.024 0.570 1.00 . A A . 5 TRP CD2 1 1 11 2900 1 1 5 TRP CE2 C -6.943 -8.994 0.484 1.00 . A A . 5 TRP CE2 1 1 11 2901 1 1 5 TRP CE3 C -5.215 -7.906 1.782 1.00 . A A . 5 TRP CE3 1 1 11 2902 1 1 5 TRP CG C -5.824 -7.331 -0.707 1.00 . A A . 5 TRP CG 1 1 11 2903 1 1 5 TRP CH2 C -6.556 -9.686 2.763 1.00 . A A . 5 TRP CH2 1 1 11 2904 1 1 5 TRP CZ2 C -7.263 -9.817 1.566 1.00 . A A . 5 TRP CZ2 1 1 11 2905 1 1 5 TRP CZ3 C -5.533 -8.732 2.872 1.00 . A A . 5 TRP CZ3 1 1 11 2906 1 1 5 TRP H H -7.149 -4.151 -0.797 1.00 . A A . 5 TRP H 1 1 11 2907 1 1 5 TRP HA H -5.639 -5.251 0.660 1.00 . A A . 5 TRP HA 1 1 11 2908 1 1 5 TRP HB2 H -5.012 -6.022 -2.155 1.00 . A A . 5 TRP HB2 1 1 11 2909 1 1 5 TRP HB3 H -3.876 -6.531 -0.905 1.00 . A A . 5 TRP HB3 1 1 11 2910 1 1 5 TRP HD1 H -6.967 -7.598 -2.530 1.00 . A A . 5 TRP HD1 1 1 11 2911 1 1 5 TRP HE1 H -8.160 -9.421 -1.152 1.00 . A A . 5 TRP HE1 1 1 11 2912 1 1 5 TRP HE3 H -4.427 -7.173 1.875 1.00 . A A . 5 TRP HE3 1 1 11 2913 1 1 5 TRP HH2 H -6.796 -10.319 3.604 1.00 . A A . 5 TRP HH2 1 1 11 2914 1 1 5 TRP HZ2 H -8.051 -10.550 1.475 1.00 . A A . 5 TRP HZ2 1 1 11 2915 1 1 5 TRP HZ3 H -4.989 -8.632 3.799 1.00 . A A . 5 TRP HZ3 1 1 11 2916 1 1 5 TRP N N -6.229 -4.240 -1.112 1.00 . A A . 5 TRP N 1 1 11 2917 1 1 5 TRP NE1 N -7.432 -8.868 -0.800 1.00 . A A . 5 TRP NE1 1 1 11 2918 1 1 5 TRP O O -3.170 -3.972 -1.009 1.00 . A A . 5 TRP O 1 1 11 2919 1 1 6 PRO C C -1.401 -3.596 1.544 1.00 . A A . 6 PRO C 1 1 11 2920 1 1 6 PRO CA C -2.660 -2.736 1.401 1.00 . A A . 6 PRO CA 1 1 11 2921 1 1 6 PRO CB C -3.037 -2.095 2.733 1.00 . A A . 6 PRO CB 1 1 11 2922 1 1 6 PRO CD C -4.746 -3.723 2.219 1.00 . A A . 6 PRO CD 1 1 11 2923 1 1 6 PRO CG C -4.026 -3.032 3.348 1.00 . A A . 6 PRO CG 1 1 11 2924 1 1 6 PRO HA H -2.522 -1.976 0.650 1.00 . A A . 6 PRO HA 1 1 11 2925 1 1 6 PRO HB2 H -2.163 -1.998 3.362 1.00 . A A . 6 PRO HB2 1 1 11 2926 1 1 6 PRO HB3 H -3.491 -1.133 2.566 1.00 . A A . 6 PRO HB3 1 1 11 2927 1 1 6 PRO HD2 H -4.909 -4.765 2.456 1.00 . A A . 6 PRO HD2 1 1 11 2928 1 1 6 PRO HD3 H -5.680 -3.229 2.005 1.00 . A A . 6 PRO HD3 1 1 11 2929 1 1 6 PRO HG2 H -3.511 -3.760 3.961 1.00 . A A . 6 PRO HG2 1 1 11 2930 1 1 6 PRO HG3 H -4.734 -2.481 3.946 1.00 . A A . 6 PRO HG3 1 1 11 2931 1 1 6 PRO N N -3.832 -3.586 1.080 1.00 . A A . 6 PRO N 1 1 11 2932 1 1 6 PRO O O -1.007 -3.965 2.631 1.00 . A A . 6 PRO O 1 1 11 2933 1 1 7 TRP C C 1.614 -4.043 -0.198 1.00 . A A . 7 TRP C 1 1 11 2934 1 1 7 TRP CA C 0.463 -4.751 0.513 1.00 . A A . 7 TRP CA 1 1 11 2935 1 1 7 TRP CB C 0.105 -6.043 -0.212 1.00 . A A . 7 TRP CB 1 1 11 2936 1 1 7 TRP CD1 C -0.976 -7.573 1.484 1.00 . A A . 7 TRP CD1 1 1 11 2937 1 1 7 TRP CD2 C 1.191 -8.066 1.132 1.00 . A A . 7 TRP CD2 1 1 11 2938 1 1 7 TRP CE2 C 0.714 -8.990 2.091 1.00 . A A . 7 TRP CE2 1 1 11 2939 1 1 7 TRP CE3 C 2.535 -8.160 0.731 1.00 . A A . 7 TRP CE3 1 1 11 2940 1 1 7 TRP CG C 0.097 -7.178 0.762 1.00 . A A . 7 TRP CG 1 1 11 2941 1 1 7 TRP CH2 C 2.878 -10.052 2.225 1.00 . A A . 7 TRP CH2 1 1 11 2942 1 1 7 TRP CZ2 C 1.544 -9.974 2.635 1.00 . A A . 7 TRP CZ2 1 1 11 2943 1 1 7 TRP CZ3 C 3.372 -9.148 1.276 1.00 . A A . 7 TRP CZ3 1 1 11 2944 1 1 7 TRP H H -1.109 -3.605 -0.417 1.00 . A A . 7 TRP H 1 1 11 2945 1 1 7 TRP HA H 0.724 -4.958 1.537 1.00 . A A . 7 TRP HA 1 1 11 2946 1 1 7 TRP HB2 H -0.872 -5.943 -0.659 1.00 . A A . 7 TRP HB2 1 1 11 2947 1 1 7 TRP HB3 H 0.836 -6.234 -0.982 1.00 . A A . 7 TRP HB3 1 1 11 2948 1 1 7 TRP HD1 H -1.957 -7.123 1.451 1.00 . A A . 7 TRP HD1 1 1 11 2949 1 1 7 TRP HE1 H -1.205 -9.124 2.892 1.00 . A A . 7 TRP HE1 1 1 11 2950 1 1 7 TRP HE3 H 2.927 -7.469 -0.001 1.00 . A A . 7 TRP HE3 1 1 11 2951 1 1 7 TRP HH2 H 3.526 -10.810 2.642 1.00 . A A . 7 TRP HH2 1 1 11 2952 1 1 7 TRP HZ2 H 1.156 -10.666 3.366 1.00 . A A . 7 TRP HZ2 1 1 11 2953 1 1 7 TRP HZ3 H 4.404 -9.211 0.961 1.00 . A A . 7 TRP HZ3 1 1 11 2954 1 1 7 TRP N N -0.771 -3.915 0.449 1.00 . A A . 7 TRP N 1 1 11 2955 1 1 7 TRP NE1 N -0.611 -8.650 2.274 1.00 . A A . 7 TRP NE1 1 1 11 2956 1 1 7 TRP O O 2.208 -4.565 -1.122 1.00 . A A . 7 TRP O 1 1 11 2957 1 1 8 TRP C C 4.082 -1.708 0.642 1.00 . A A . 8 TRP C 1 1 11 2958 1 1 8 TRP CA C 3.040 -2.103 -0.408 1.00 . A A . 8 TRP CA 1 1 11 2959 1 1 8 TRP CB C 2.383 -0.860 -1.006 1.00 . A A . 8 TRP CB 1 1 11 2960 1 1 8 TRP CD1 C 3.979 0.803 -2.036 1.00 . A A . 8 TRP CD1 1 1 11 2961 1 1 8 TRP CD2 C 3.456 -0.875 -3.440 1.00 . A A . 8 TRP CD2 1 1 11 2962 1 1 8 TRP CE2 C 4.346 -0.025 -4.137 1.00 . A A . 8 TRP CE2 1 1 11 2963 1 1 8 TRP CE3 C 2.971 -2.017 -4.103 1.00 . A A . 8 TRP CE3 1 1 11 2964 1 1 8 TRP CG C 3.239 -0.326 -2.108 1.00 . A A . 8 TRP CG 1 1 11 2965 1 1 8 TRP CH2 C 4.250 -1.435 -6.092 1.00 . A A . 8 TRP CH2 1 1 11 2966 1 1 8 TRP CZ2 C 4.741 -0.297 -5.448 1.00 . A A . 8 TRP CZ2 1 1 11 2967 1 1 8 TRP CZ3 C 3.367 -2.293 -5.423 1.00 . A A . 8 TRP CZ3 1 1 11 2968 1 1 8 TRP H H 1.435 -2.469 0.970 1.00 . A A . 8 TRP H 1 1 11 2969 1 1 8 TRP HA H 3.493 -2.690 -1.186 1.00 . A A . 8 TRP HA 1 1 11 2970 1 1 8 TRP HB2 H 1.411 -1.121 -1.400 1.00 . A A . 8 TRP HB2 1 1 11 2971 1 1 8 TRP HB3 H 2.270 -0.107 -0.240 1.00 . A A . 8 TRP HB3 1 1 11 2972 1 1 8 TRP HD1 H 4.047 1.456 -1.179 1.00 . A A . 8 TRP HD1 1 1 11 2973 1 1 8 TRP HE1 H 5.237 1.728 -3.449 1.00 . A A . 8 TRP HE1 1 1 11 2974 1 1 8 TRP HE3 H 2.291 -2.684 -3.596 1.00 . A A . 8 TRP HE3 1 1 11 2975 1 1 8 TRP HH2 H 4.552 -1.654 -7.107 1.00 . A A . 8 TRP HH2 1 1 11 2976 1 1 8 TRP HZ2 H 5.422 0.368 -5.960 1.00 . A A . 8 TRP HZ2 1 1 11 2977 1 1 8 TRP HZ3 H 2.989 -3.173 -5.923 1.00 . A A . 8 TRP HZ3 1 1 11 2978 1 1 8 TRP N N 1.930 -2.859 0.229 1.00 . A A . 8 TRP N 1 1 11 2979 1 1 8 TRP NE1 N 4.637 0.984 -3.240 1.00 . A A . 8 TRP NE1 1 1 11 2980 1 1 8 TRP O O 3.826 -0.874 1.489 1.00 . A A . 8 TRP O 1 1 11 2981 1 1 9 PRO C C 7.169 -0.875 1.029 1.00 . A A . 9 PRO C 1 1 11 2982 1 1 9 PRO CA C 6.324 -2.056 1.505 1.00 . A A . 9 PRO CA 1 1 11 2983 1 1 9 PRO CB C 7.132 -3.346 1.480 1.00 . A A . 9 PRO CB 1 1 11 2984 1 1 9 PRO CD C 5.601 -3.347 -0.427 1.00 . A A . 9 PRO CD 1 1 11 2985 1 1 9 PRO CG C 6.851 -3.978 0.145 1.00 . A A . 9 PRO CG 1 1 11 2986 1 1 9 PRO HA H 5.937 -1.877 2.492 1.00 . A A . 9 PRO HA 1 1 11 2987 1 1 9 PRO HB2 H 8.186 -3.126 1.578 1.00 . A A . 9 PRO HB2 1 1 11 2988 1 1 9 PRO HB3 H 6.810 -4.000 2.271 1.00 . A A . 9 PRO HB3 1 1 11 2989 1 1 9 PRO HD2 H 5.816 -2.888 -1.384 1.00 . A A . 9 PRO HD2 1 1 11 2990 1 1 9 PRO HD3 H 4.815 -4.077 -0.525 1.00 . A A . 9 PRO HD3 1 1 11 2991 1 1 9 PRO HG2 H 7.686 -3.808 -0.521 1.00 . A A . 9 PRO HG2 1 1 11 2992 1 1 9 PRO HG3 H 6.694 -5.038 0.270 1.00 . A A . 9 PRO HG3 1 1 11 2993 1 1 9 PRO N N 5.226 -2.331 0.555 1.00 . A A . 9 PRO N 1 1 11 2994 1 1 9 PRO O O 8.358 -0.808 1.274 1.00 . A A . 9 PRO O 1 1 11 2995 1 1 10 TRP C C 6.937 2.480 0.650 1.00 . A A . 10 TRP C 1 1 11 2996 1 1 10 TRP CA C 7.319 1.232 -0.145 1.00 . A A . 10 TRP CA 1 1 11 2997 1 1 10 TRP CB C 6.896 1.371 -1.604 1.00 . A A . 10 TRP CB 1 1 11 2998 1 1 10 TRP CD1 C 8.975 2.496 -2.512 1.00 . A A . 10 TRP CD1 1 1 11 2999 1 1 10 TRP CD2 C 8.594 0.478 -3.417 1.00 . A A . 10 TRP CD2 1 1 11 3000 1 1 10 TRP CE2 C 9.774 0.969 -4.019 1.00 . A A . 10 TRP CE2 1 1 11 3001 1 1 10 TRP CE3 C 8.123 -0.781 -3.805 1.00 . A A . 10 TRP CE3 1 1 11 3002 1 1 10 TRP CG C 8.107 1.458 -2.469 1.00 . A A . 10 TRP CG 1 1 11 3003 1 1 10 TRP CH2 C 9.982 -1.028 -5.356 1.00 . A A . 10 TRP CH2 1 1 11 3004 1 1 10 TRP CZ2 C 10.465 0.230 -4.978 1.00 . A A . 10 TRP CZ2 1 1 11 3005 1 1 10 TRP CZ3 C 8.812 -1.532 -4.771 1.00 . A A . 10 TRP CZ3 1 1 11 3006 1 1 10 TRP H H 5.612 -0.027 0.167 1.00 . A A . 10 TRP H 1 1 11 3007 1 1 10 TRP HA H 8.374 1.051 -0.086 1.00 . A A . 10 TRP HA 1 1 11 3008 1 1 10 TRP HB2 H 6.313 0.510 -1.892 1.00 . A A . 10 TRP HB2 1 1 11 3009 1 1 10 TRP HB3 H 6.302 2.259 -1.726 1.00 . A A . 10 TRP HB3 1 1 11 3010 1 1 10 TRP HD1 H 8.905 3.400 -1.925 1.00 . A A . 10 TRP HD1 1 1 11 3011 1 1 10 TRP HE1 H 10.721 2.792 -3.657 1.00 . A A . 10 TRP HE1 1 1 11 3012 1 1 10 TRP HE3 H 7.220 -1.170 -3.354 1.00 . A A . 10 TRP HE3 1 1 11 3013 1 1 10 TRP HH2 H 10.510 -1.608 -6.098 1.00 . A A . 10 TRP HH2 1 1 11 3014 1 1 10 TRP HZ2 H 11.366 0.624 -5.425 1.00 . A A . 10 TRP HZ2 1 1 11 3015 1 1 10 TRP HZ3 H 8.439 -2.503 -5.063 1.00 . A A . 10 TRP HZ3 1 1 11 3016 1 1 10 TRP N N 6.564 0.054 0.351 1.00 . A A . 10 TRP N 1 1 11 3017 1 1 10 TRP NE1 N 9.967 2.206 -3.433 1.00 . A A . 10 TRP NE1 1 1 11 3018 1 1 10 TRP O O 7.742 3.054 1.355 1.00 . A A . 10 TRP O 1 1 11 3019 1 1 11 ARG C C 4.013 3.780 2.096 1.00 . A A . 11 ARG C 1 1 11 3020 1 1 11 ARG CA C 5.260 4.107 1.277 1.00 . A A . 11 ARG CA 1 1 11 3021 1 1 11 ARG CB C 4.941 5.158 0.206 1.00 . A A . 11 ARG CB 1 1 11 3022 1 1 11 ARG CD C 3.657 5.487 -1.918 1.00 . A A . 11 ARG CD 1 1 11 3023 1 1 11 ARG CG C 4.473 4.489 -1.093 1.00 . A A . 11 ARG CG 1 1 11 3024 1 1 11 ARG CZ C 1.528 6.550 -1.468 1.00 . A A . 11 ARG CZ 1 1 11 3025 1 1 11 ARG H H 5.085 2.426 -0.033 1.00 . A A . 11 ARG H 1 1 11 3026 1 1 11 ARG HA H 6.044 4.462 1.921 1.00 . A A . 11 ARG HA 1 1 11 3027 1 1 11 ARG HB2 H 4.157 5.797 0.570 1.00 . A A . 11 ARG HB2 1 1 11 3028 1 1 11 ARG HB3 H 5.824 5.748 0.007 1.00 . A A . 11 ARG HB3 1 1 11 3029 1 1 11 ARG HD2 H 4.131 6.459 -1.905 1.00 . A A . 11 ARG HD2 1 1 11 3030 1 1 11 ARG HD3 H 3.546 5.134 -2.932 1.00 . A A . 11 ARG HD3 1 1 11 3031 1 1 11 ARG HE H 2.055 4.823 -0.641 1.00 . A A . 11 ARG HE 1 1 11 3032 1 1 11 ARG HG2 H 5.335 4.169 -1.662 1.00 . A A . 11 ARG HG2 1 1 11 3033 1 1 11 ARG HG3 H 3.861 3.632 -0.857 1.00 . A A . 11 ARG HG3 1 1 11 3034 1 1 11 ARG HH11 H 0.948 5.890 -3.268 1.00 . A A . 11 ARG HH11 1 1 11 3035 1 1 11 ARG HH12 H 0.240 7.385 -2.752 1.00 . A A . 11 ARG HH12 1 1 11 3036 1 1 11 ARG HH21 H 1.923 7.443 0.279 1.00 . A A . 11 ARG HH21 1 1 11 3037 1 1 11 ARG HH22 H 0.792 8.264 -0.745 1.00 . A A . 11 ARG HH22 1 1 11 3038 1 1 11 ARG N N 5.711 2.901 0.538 1.00 . A A . 11 ARG N 1 1 11 3039 1 1 11 ARG NE N 2.329 5.543 -1.247 1.00 . A A . 11 ARG NE 1 1 11 3040 1 1 11 ARG NH1 N 0.852 6.613 -2.583 1.00 . A A . 11 ARG NH1 1 1 11 3041 1 1 11 ARG NH2 N 1.405 7.493 -0.575 1.00 . A A . 11 ARG NH2 1 1 11 3042 1 1 11 ARG O O 2.946 4.318 1.871 1.00 . A A . 11 ARG O 1 1 11 3043 1 1 12 ARG C C 2.365 3.773 4.530 1.00 . A A . 12 ARG C 1 1 11 3044 1 1 12 ARG CA C 2.973 2.525 3.886 1.00 . A A . 12 ARG CA 1 1 11 3045 1 1 12 ARG CB C 3.536 1.590 4.957 1.00 . A A . 12 ARG CB 1 1 11 3046 1 1 12 ARG CD C 4.602 2.107 7.158 1.00 . A A . 12 ARG CD 1 1 11 3047 1 1 12 ARG CG C 4.733 2.256 5.640 1.00 . A A . 12 ARG CG 1 1 11 3048 1 1 12 ARG CZ C 6.237 2.268 8.937 1.00 . A A . 12 ARG CZ 1 1 11 3049 1 1 12 ARG H H 5.017 2.482 3.200 1.00 . A A . 12 ARG H 1 1 11 3050 1 1 12 ARG HA H 2.234 2.006 3.297 1.00 . A A . 12 ARG HA 1 1 11 3051 1 1 12 ARG HB2 H 2.771 1.382 5.691 1.00 . A A . 12 ARG HB2 1 1 11 3052 1 1 12 ARG HB3 H 3.855 0.667 4.498 1.00 . A A . 12 ARG HB3 1 1 11 3053 1 1 12 ARG HD2 H 3.816 2.748 7.530 1.00 . A A . 12 ARG HD2 1 1 11 3054 1 1 12 ARG HD3 H 4.411 1.079 7.420 1.00 . A A . 12 ARG HD3 1 1 11 3055 1 1 12 ARG HE H 6.556 3.015 7.126 1.00 . A A . 12 ARG HE 1 1 11 3056 1 1 12 ARG HG2 H 5.646 1.783 5.307 1.00 . A A . 12 ARG HG2 1 1 11 3057 1 1 12 ARG HG3 H 4.755 3.305 5.383 1.00 . A A . 12 ARG HG3 1 1 11 3058 1 1 12 ARG HH11 H 4.554 3.048 9.691 1.00 . A A . 12 ARG HH11 1 1 11 3059 1 1 12 ARG HH12 H 5.660 2.390 10.850 1.00 . A A . 12 ARG HH12 1 1 11 3060 1 1 12 ARG HH21 H 7.992 1.426 8.471 1.00 . A A . 12 ARG HH21 1 1 11 3061 1 1 12 ARG HH22 H 7.607 1.472 10.160 1.00 . A A . 12 ARG HH22 1 1 11 3062 1 1 12 ARG N N 4.145 2.898 3.043 1.00 . A A . 12 ARG N 1 1 11 3063 1 1 12 ARG NE N 5.923 2.534 7.699 1.00 . A A . 12 ARG NE 1 1 11 3064 1 1 12 ARG NH1 N 5.420 2.594 9.901 1.00 . A A . 12 ARG NH1 1 1 11 3065 1 1 12 ARG NH2 N 7.366 1.675 9.211 1.00 . A A . 12 ARG NH2 1 1 11 3066 1 1 12 ARG O O 2.939 4.844 4.493 1.00 . A A . 12 ARG O 1 1 11 3067 1 1 13 LYS C C 0.563 4.658 7.288 1.00 . A A . 13 LYS C 1 1 11 3068 1 1 13 LYS CA C 0.566 4.826 5.764 1.00 . A A . 13 LYS CA 1 1 11 3069 1 1 13 LYS CB C -0.862 4.846 5.212 1.00 . A A . 13 LYS CB 1 1 11 3070 1 1 13 LYS CD C -1.460 6.560 3.495 1.00 . A A . 13 LYS CD 1 1 11 3071 1 1 13 LYS CE C -0.358 7.616 3.382 1.00 . A A . 13 LYS CE 1 1 11 3072 1 1 13 LYS CG C -0.828 5.185 3.721 1.00 . A A . 13 LYS CG 1 1 11 3073 1 1 13 LYS H H 0.761 2.775 5.139 1.00 . A A . 13 LYS H 1 1 11 3074 1 1 13 LYS HA H 1.078 5.733 5.487 1.00 . A A . 13 LYS HA 1 1 11 3075 1 1 13 LYS HB2 H -1.315 3.875 5.352 1.00 . A A . 13 LYS HB2 1 1 11 3076 1 1 13 LYS HB3 H -1.440 5.593 5.737 1.00 . A A . 13 LYS HB3 1 1 11 3077 1 1 13 LYS HD2 H -2.040 6.543 2.584 1.00 . A A . 13 LYS HD2 1 1 11 3078 1 1 13 LYS HD3 H -2.102 6.802 4.327 1.00 . A A . 13 LYS HD3 1 1 11 3079 1 1 13 LYS HE2 H -0.770 8.605 3.538 1.00 . A A . 13 LYS HE2 1 1 11 3080 1 1 13 LYS HE3 H 0.427 7.418 4.094 1.00 . A A . 13 LYS HE3 1 1 11 3081 1 1 13 LYS HG2 H 0.197 5.198 3.378 1.00 . A A . 13 LYS HG2 1 1 11 3082 1 1 13 LYS HG3 H -1.384 4.441 3.171 1.00 . A A . 13 LYS HG3 1 1 11 3083 1 1 13 LYS HZ1 H 0.885 6.731 1.967 1.00 . A A . 13 LYS HZ1 1 1 11 3084 1 1 13 LYS HZ2 H 0.587 8.382 1.693 1.00 . A A . 13 LYS HZ2 1 1 11 3085 1 1 13 LYS HZ3 H -0.616 7.230 1.353 1.00 . A A . 13 LYS HZ3 1 1 11 3086 1 1 13 LYS N N 1.208 3.647 5.120 1.00 . A A . 13 LYS N 1 1 11 3087 1 1 13 LYS NZ N 0.163 7.480 1.994 1.00 . A A . 13 LYS NZ 1 1 11 3088 1 1 13 LYS O O 1.606 4.550 7.903 1.00 . A A . 13 LYS O 1 1 11 3089 1 1 14 NH2 HN1 H -1.415 4.717 7.443 1.00 . A A . 14 NH2 HN1 1 1 11 3090 1 1 14 NH2 HN2 H -0.580 4.524 8.905 1.00 . A A . 14 NH2 HN2 1 1 11 3091 1 1 14 NH2 N N -0.573 4.631 7.931 1.00 . A A . 14 NH2 N 1 1 12 3092 1 1 1 ILE C C -8.334 1.865 2.506 1.00 . A A . 1 ILE C 1 1 12 3093 1 1 1 ILE CA C -7.607 2.079 3.837 1.00 . A A . 1 ILE CA 1 1 12 3094 1 1 1 ILE CB C -8.602 2.063 4.997 1.00 . A A . 1 ILE CB 1 1 12 3095 1 1 1 ILE CD1 C -8.325 3.427 7.073 1.00 . A A . 1 ILE CD1 1 1 12 3096 1 1 1 ILE CG1 C -7.843 2.184 6.321 1.00 . A A . 1 ILE CG1 1 1 12 3097 1 1 1 ILE CG2 C -9.384 0.749 4.979 1.00 . A A . 1 ILE CG2 1 1 12 3098 1 1 1 ILE H1 H -6.819 3.768 2.905 1.00 . A A . 1 ILE H1 1 1 12 3099 1 1 1 ILE H2 H -6.086 3.391 4.391 1.00 . A A . 1 ILE H2 1 1 12 3100 1 1 1 ILE H3 H -7.632 4.096 4.357 1.00 . A A . 1 ILE H3 1 1 12 3101 1 1 1 ILE HA H -6.858 1.319 3.984 1.00 . A A . 1 ILE HA 1 1 12 3102 1 1 1 ILE HB H -9.287 2.892 4.895 1.00 . A A . 1 ILE HB 1 1 12 3103 1 1 1 ILE HD11 H -8.880 3.124 7.948 1.00 . A A . 1 ILE HD11 1 1 12 3104 1 1 1 ILE HD12 H -8.962 4.014 6.428 1.00 . A A . 1 ILE HD12 1 1 12 3105 1 1 1 ILE HD13 H -7.473 4.020 7.372 1.00 . A A . 1 ILE HD13 1 1 12 3106 1 1 1 ILE HG12 H -8.024 1.306 6.922 1.00 . A A . 1 ILE HG12 1 1 12 3107 1 1 1 ILE HG13 H -6.786 2.275 6.122 1.00 . A A . 1 ILE HG13 1 1 12 3108 1 1 1 ILE HG21 H -9.878 0.610 5.929 1.00 . A A . 1 ILE HG21 1 1 12 3109 1 1 1 ILE HG22 H -8.705 -0.072 4.804 1.00 . A A . 1 ILE HG22 1 1 12 3110 1 1 1 ILE HG23 H -10.122 0.781 4.191 1.00 . A A . 1 ILE HG23 1 1 12 3111 1 1 1 ILE N N -6.989 3.436 3.875 1.00 . A A . 1 ILE N 1 1 12 3112 1 1 1 ILE O O -8.524 2.787 1.738 1.00 . A A . 1 ILE O 1 1 12 3113 1 1 2 LEU C C -8.521 0.643 -0.236 1.00 . A A . 2 LEU C 1 1 12 3114 1 1 2 LEU CA C -9.452 0.385 0.948 1.00 . A A . 2 LEU CA 1 1 12 3115 1 1 2 LEU CB C -10.629 1.360 0.931 1.00 . A A . 2 LEU CB 1 1 12 3116 1 1 2 LEU CD1 C -12.791 0.266 1.540 1.00 . A A . 2 LEU CD1 1 1 12 3117 1 1 2 LEU CD2 C -12.614 1.597 -0.566 1.00 . A A . 2 LEU CD2 1 1 12 3118 1 1 2 LEU CG C -11.870 0.654 0.381 1.00 . A A . 2 LEU CG 1 1 12 3119 1 1 2 LEU H H -8.575 -0.073 2.861 1.00 . A A . 2 LEU H 1 1 12 3120 1 1 2 LEU HA H -9.811 -0.632 0.925 1.00 . A A . 2 LEU HA 1 1 12 3121 1 1 2 LEU HB2 H -10.826 1.705 1.936 1.00 . A A . 2 LEU HB2 1 1 12 3122 1 1 2 LEU HB3 H -10.389 2.204 0.300 1.00 . A A . 2 LEU HB3 1 1 12 3123 1 1 2 LEU HD11 H -12.290 0.452 2.478 1.00 . A A . 2 LEU HD11 1 1 12 3124 1 1 2 LEU HD12 H -13.040 -0.782 1.466 1.00 . A A . 2 LEU HD12 1 1 12 3125 1 1 2 LEU HD13 H -13.696 0.856 1.492 1.00 . A A . 2 LEU HD13 1 1 12 3126 1 1 2 LEU HD21 H -13.360 1.041 -1.115 1.00 . A A . 2 LEU HD21 1 1 12 3127 1 1 2 LEU HD22 H -11.913 2.039 -1.259 1.00 . A A . 2 LEU HD22 1 1 12 3128 1 1 2 LEU HD23 H -13.094 2.377 0.006 1.00 . A A . 2 LEU HD23 1 1 12 3129 1 1 2 LEU HG H -11.571 -0.235 -0.153 1.00 . A A . 2 LEU HG 1 1 12 3130 1 1 2 LEU N N -8.740 0.656 2.229 1.00 . A A . 2 LEU N 1 1 12 3131 1 1 2 LEU O O -8.330 1.765 -0.660 1.00 . A A . 2 LEU O 1 1 12 3132 1 1 3 LYS C C -6.432 -1.569 -2.350 1.00 . A A . 3 LYS C 1 1 12 3133 1 1 3 LYS CA C -7.019 -0.218 -1.930 1.00 . A A . 3 LYS CA 1 1 12 3134 1 1 3 LYS CB C -5.916 0.712 -1.423 1.00 . A A . 3 LYS CB 1 1 12 3135 1 1 3 LYS CD C -4.424 1.238 0.510 1.00 . A A . 3 LYS CD 1 1 12 3136 1 1 3 LYS CE C -3.028 0.845 0.020 1.00 . A A . 3 LYS CE 1 1 12 3137 1 1 3 LYS CG C -5.455 0.250 -0.040 1.00 . A A . 3 LYS CG 1 1 12 3138 1 1 3 LYS H H -8.114 -1.288 -0.409 1.00 . A A . 3 LYS H 1 1 12 3139 1 1 3 LYS HA H -7.538 0.242 -2.758 1.00 . A A . 3 LYS HA 1 1 12 3140 1 1 3 LYS HB2 H -5.082 0.688 -2.109 1.00 . A A . 3 LYS HB2 1 1 12 3141 1 1 3 LYS HB3 H -6.298 1.719 -1.356 1.00 . A A . 3 LYS HB3 1 1 12 3142 1 1 3 LYS HD2 H -4.660 2.234 0.167 1.00 . A A . 3 LYS HD2 1 1 12 3143 1 1 3 LYS HD3 H -4.443 1.214 1.589 1.00 . A A . 3 LYS HD3 1 1 12 3144 1 1 3 LYS HE2 H -2.359 0.717 0.859 1.00 . A A . 3 LYS HE2 1 1 12 3145 1 1 3 LYS HE3 H -3.077 -0.059 -0.567 1.00 . A A . 3 LYS HE3 1 1 12 3146 1 1 3 LYS HG2 H -6.305 0.206 0.628 1.00 . A A . 3 LYS HG2 1 1 12 3147 1 1 3 LYS HG3 H -5.007 -0.729 -0.117 1.00 . A A . 3 LYS HG3 1 1 12 3148 1 1 3 LYS HZ1 H -2.004 1.628 -1.614 1.00 . A A . 3 LYS HZ1 1 1 12 3149 1 1 3 LYS HZ2 H -2.029 2.649 -0.258 1.00 . A A . 3 LYS HZ2 1 1 12 3150 1 1 3 LYS HZ3 H -3.420 2.473 -1.217 1.00 . A A . 3 LYS HZ3 1 1 12 3151 1 1 3 LYS N N -7.942 -0.393 -0.772 1.00 . A A . 3 LYS N 1 1 12 3152 1 1 3 LYS NZ N -2.587 1.984 -0.832 1.00 . A A . 3 LYS NZ 1 1 12 3153 1 1 3 LYS O O -5.272 -1.845 -2.119 1.00 . A A . 3 LYS O 1 1 12 3154 1 1 4 LYS C C -5.706 -4.285 -2.488 1.00 . A A . 4 LYS C 1 1 12 3155 1 1 4 LYS CA C -6.754 -3.724 -3.441 1.00 . A A . 4 LYS CA 1 1 12 3156 1 1 4 LYS CB C -6.174 -3.468 -4.825 1.00 . A A . 4 LYS CB 1 1 12 3157 1 1 4 LYS CD C -7.242 -2.883 -7.010 1.00 . A A . 4 LYS CD 1 1 12 3158 1 1 4 LYS CE C -8.740 -2.849 -7.322 1.00 . A A . 4 LYS CE 1 1 12 3159 1 1 4 LYS CG C -7.010 -2.420 -5.570 1.00 . A A . 4 LYS CG 1 1 12 3160 1 1 4 LYS H H -8.140 -2.144 -3.166 1.00 . A A . 4 LYS H 1 1 12 3161 1 1 4 LYS HA H -7.585 -4.406 -3.511 1.00 . A A . 4 LYS HA 1 1 12 3162 1 1 4 LYS HB2 H -5.161 -3.117 -4.728 1.00 . A A . 4 LYS HB2 1 1 12 3163 1 1 4 LYS HB3 H -6.190 -4.384 -5.376 1.00 . A A . 4 LYS HB3 1 1 12 3164 1 1 4 LYS HD2 H -6.716 -2.227 -7.688 1.00 . A A . 4 LYS HD2 1 1 12 3165 1 1 4 LYS HD3 H -6.876 -3.891 -7.128 1.00 . A A . 4 LYS HD3 1 1 12 3166 1 1 4 LYS HE2 H -9.290 -3.413 -6.583 1.00 . A A . 4 LYS HE2 1 1 12 3167 1 1 4 LYS HE3 H -9.094 -1.829 -7.360 1.00 . A A . 4 LYS HE3 1 1 12 3168 1 1 4 LYS HG2 H -7.961 -2.298 -5.072 1.00 . A A . 4 LYS HG2 1 1 12 3169 1 1 4 LYS HG3 H -6.483 -1.479 -5.578 1.00 . A A . 4 LYS HG3 1 1 12 3170 1 1 4 LYS HZ1 H -8.550 -4.471 -8.613 1.00 . A A . 4 LYS HZ1 1 1 12 3171 1 1 4 LYS HZ2 H -8.280 -2.964 -9.349 1.00 . A A . 4 LYS HZ2 1 1 12 3172 1 1 4 LYS HZ3 H -9.862 -3.455 -8.968 1.00 . A A . 4 LYS HZ3 1 1 12 3173 1 1 4 LYS N N -7.229 -2.399 -2.980 1.00 . A A . 4 LYS N 1 1 12 3174 1 1 4 LYS NZ N -8.867 -3.482 -8.664 1.00 . A A . 4 LYS NZ 1 1 12 3175 1 1 4 LYS O O -4.551 -4.445 -2.828 1.00 . A A . 4 LYS O 1 1 12 3176 1 1 5 TRP C C -3.948 -4.224 -0.150 1.00 . A A . 5 TRP C 1 1 12 3177 1 1 5 TRP CA C -5.167 -5.139 -0.288 1.00 . A A . 5 TRP CA 1 1 12 3178 1 1 5 TRP CB C -4.754 -6.500 -0.843 1.00 . A A . 5 TRP CB 1 1 12 3179 1 1 5 TRP CD1 C -6.535 -8.274 -1.104 1.00 . A A . 5 TRP CD1 1 1 12 3180 1 1 5 TRP CD2 C -5.884 -8.007 1.031 1.00 . A A . 5 TRP CD2 1 1 12 3181 1 1 5 TRP CE2 C -6.872 -9.018 1.034 1.00 . A A . 5 TRP CE2 1 1 12 3182 1 1 5 TRP CE3 C -5.304 -7.641 2.258 1.00 . A A . 5 TRP CE3 1 1 12 3183 1 1 5 TRP CG C -5.688 -7.550 -0.338 1.00 . A A . 5 TRP CG 1 1 12 3184 1 1 5 TRP CH2 C -6.684 -9.273 3.425 1.00 . A A . 5 TRP CH2 1 1 12 3185 1 1 5 TRP CZ2 C -7.271 -9.647 2.214 1.00 . A A . 5 TRP CZ2 1 1 12 3186 1 1 5 TRP CZ3 C -5.702 -8.273 3.448 1.00 . A A . 5 TRP CZ3 1 1 12 3187 1 1 5 TRP H H -7.056 -4.438 -1.059 1.00 . A A . 5 TRP H 1 1 12 3188 1 1 5 TRP HA H -5.656 -5.261 0.665 1.00 . A A . 5 TRP HA 1 1 12 3189 1 1 5 TRP HB2 H -4.791 -6.474 -1.921 1.00 . A A . 5 TRP HB2 1 1 12 3190 1 1 5 TRP HB3 H -3.749 -6.728 -0.522 1.00 . A A . 5 TRP HB3 1 1 12 3191 1 1 5 TRP HD1 H -6.646 -8.186 -2.174 1.00 . A A . 5 TRP HD1 1 1 12 3192 1 1 5 TRP HE1 H -7.916 -9.783 -0.599 1.00 . A A . 5 TRP HE1 1 1 12 3193 1 1 5 TRP HE3 H -4.547 -6.871 2.285 1.00 . A A . 5 TRP HE3 1 1 12 3194 1 1 5 TRP HH2 H -6.987 -9.755 4.344 1.00 . A A . 5 TRP HH2 1 1 12 3195 1 1 5 TRP HZ2 H -8.027 -10.419 2.190 1.00 . A A . 5 TRP HZ2 1 1 12 3196 1 1 5 TRP HZ3 H -5.250 -7.985 4.386 1.00 . A A . 5 TRP HZ3 1 1 12 3197 1 1 5 TRP N N -6.116 -4.582 -1.293 1.00 . A A . 5 TRP N 1 1 12 3198 1 1 5 TRP NE1 N -7.239 -9.145 -0.292 1.00 . A A . 5 TRP NE1 1 1 12 3199 1 1 5 TRP O O -3.099 -4.183 -1.019 1.00 . A A . 5 TRP O 1 1 12 3200 1 1 6 PRO C C -1.507 -3.375 1.548 1.00 . A A . 6 PRO C 1 1 12 3201 1 1 6 PRO CA C -2.776 -2.591 1.210 1.00 . A A . 6 PRO CA 1 1 12 3202 1 1 6 PRO CB C -3.252 -1.782 2.411 1.00 . A A . 6 PRO CB 1 1 12 3203 1 1 6 PRO CD C -4.887 -3.519 2.034 1.00 . A A . 6 PRO CD 1 1 12 3204 1 1 6 PRO CG C -4.255 -2.656 3.096 1.00 . A A . 6 PRO CG 1 1 12 3205 1 1 6 PRO HA H -2.612 -1.940 0.368 1.00 . A A . 6 PRO HA 1 1 12 3206 1 1 6 PRO HB2 H -2.423 -1.566 3.071 1.00 . A A . 6 PRO HB2 1 1 12 3207 1 1 6 PRO HB3 H -3.722 -0.869 2.083 1.00 . A A . 6 PRO HB3 1 1 12 3208 1 1 6 PRO HD2 H -5.045 -4.522 2.406 1.00 . A A . 6 PRO HD2 1 1 12 3209 1 1 6 PRO HD3 H -5.815 -3.086 1.695 1.00 . A A . 6 PRO HD3 1 1 12 3210 1 1 6 PRO HG2 H -3.761 -3.275 3.833 1.00 . A A . 6 PRO HG2 1 1 12 3211 1 1 6 PRO HG3 H -5.011 -2.050 3.569 1.00 . A A . 6 PRO HG3 1 1 12 3212 1 1 6 PRO N N -3.902 -3.519 0.946 1.00 . A A . 6 PRO N 1 1 12 3213 1 1 6 PRO O O -1.170 -3.569 2.699 1.00 . A A . 6 PRO O 1 1 12 3214 1 1 7 TRP C C 1.619 -3.975 0.053 1.00 . A A . 7 TRP C 1 1 12 3215 1 1 7 TRP CA C 0.446 -4.602 0.805 1.00 . A A . 7 TRP CA 1 1 12 3216 1 1 7 TRP CB C 0.161 -6.002 0.274 1.00 . A A . 7 TRP CB 1 1 12 3217 1 1 7 TRP CD1 C -1.091 -7.372 1.988 1.00 . A A . 7 TRP CD1 1 1 12 3218 1 1 7 TRP CD2 C 1.138 -7.631 2.136 1.00 . A A . 7 TRP CD2 1 1 12 3219 1 1 7 TRP CE2 C 0.568 -8.444 3.143 1.00 . A A . 7 TRP CE2 1 1 12 3220 1 1 7 TRP CE3 C 2.540 -7.611 2.013 1.00 . A A . 7 TRP CE3 1 1 12 3221 1 1 7 TRP CG C 0.063 -6.960 1.417 1.00 . A A . 7 TRP CG 1 1 12 3222 1 1 7 TRP CH2 C 2.750 -9.183 3.862 1.00 . A A . 7 TRP CH2 1 1 12 3223 1 1 7 TRP CZ2 C 1.359 -9.213 3.997 1.00 . A A . 7 TRP CZ2 1 1 12 3224 1 1 7 TRP CZ3 C 3.339 -8.384 2.872 1.00 . A A . 7 TRP CZ3 1 1 12 3225 1 1 7 TRP H H -1.096 -3.659 -0.369 1.00 . A A . 7 TRP H 1 1 12 3226 1 1 7 TRP HA H 0.655 -4.640 1.861 1.00 . A A . 7 TRP HA 1 1 12 3227 1 1 7 TRP HB2 H -0.769 -5.993 -0.272 1.00 . A A . 7 TRP HB2 1 1 12 3228 1 1 7 TRP HB3 H 0.962 -6.304 -0.382 1.00 . A A . 7 TRP HB3 1 1 12 3229 1 1 7 TRP HD1 H -2.084 -7.064 1.695 1.00 . A A . 7 TRP HD1 1 1 12 3230 1 1 7 TRP HE1 H -1.452 -8.697 3.587 1.00 . A A . 7 TRP HE1 1 1 12 3231 1 1 7 TRP HE3 H 3.004 -7.000 1.254 1.00 . A A . 7 TRP HE3 1 1 12 3232 1 1 7 TRP HH2 H 3.369 -9.775 4.519 1.00 . A A . 7 TRP HH2 1 1 12 3233 1 1 7 TRP HZ2 H 0.900 -9.827 4.759 1.00 . A A . 7 TRP HZ2 1 1 12 3234 1 1 7 TRP HZ3 H 4.414 -8.362 2.770 1.00 . A A . 7 TRP HZ3 1 1 12 3235 1 1 7 TRP N N -0.802 -3.828 0.549 1.00 . A A . 7 TRP N 1 1 12 3236 1 1 7 TRP NE1 N -0.793 -8.253 3.012 1.00 . A A . 7 TRP NE1 1 1 12 3237 1 1 7 TRP O O 2.277 -4.615 -0.743 1.00 . A A . 7 TRP O 1 1 12 3238 1 1 8 TRP C C 4.078 -1.639 0.630 1.00 . A A . 8 TRP C 1 1 12 3239 1 1 8 TRP CA C 3.005 -2.042 -0.385 1.00 . A A . 8 TRP CA 1 1 12 3240 1 1 8 TRP CB C 2.383 -0.803 -1.028 1.00 . A A . 8 TRP CB 1 1 12 3241 1 1 8 TRP CD1 C 4.010 0.729 -2.209 1.00 . A A . 8 TRP CD1 1 1 12 3242 1 1 8 TRP CD2 C 3.374 -1.010 -3.487 1.00 . A A . 8 TRP CD2 1 1 12 3243 1 1 8 TRP CE2 C 4.273 -0.244 -4.264 1.00 . A A . 8 TRP CE2 1 1 12 3244 1 1 8 TRP CE3 C 2.822 -2.169 -4.061 1.00 . A A . 8 TRP CE3 1 1 12 3245 1 1 8 TRP CG C 3.223 -0.371 -2.187 1.00 . A A . 8 TRP CG 1 1 12 3246 1 1 8 TRP CH2 C 4.056 -1.769 -6.122 1.00 . A A . 8 TRP CH2 1 1 12 3247 1 1 8 TRP CZ2 C 4.614 -0.615 -5.565 1.00 . A A . 8 TRP CZ2 1 1 12 3248 1 1 8 TRP CZ3 C 3.161 -2.545 -5.371 1.00 . A A . 8 TRP CZ3 1 1 12 3249 1 1 8 TRP H H 1.333 -2.244 0.948 1.00 . A A . 8 TRP H 1 1 12 3250 1 1 8 TRP HA H 3.421 -2.681 -1.142 1.00 . A A . 8 TRP HA 1 1 12 3251 1 1 8 TRP HB2 H 1.386 -1.038 -1.373 1.00 . A A . 8 TRP HB2 1 1 12 3252 1 1 8 TRP HB3 H 2.335 -0.006 -0.302 1.00 . A A . 8 TRP HB3 1 1 12 3253 1 1 8 TRP HD1 H 4.133 1.431 -1.399 1.00 . A A . 8 TRP HD1 1 1 12 3254 1 1 8 TRP HE1 H 5.259 1.509 -3.717 1.00 . A A . 8 TRP HE1 1 1 12 3255 1 1 8 TRP HE3 H 2.133 -2.774 -3.491 1.00 . A A . 8 TRP HE3 1 1 12 3256 1 1 8 TRP HH2 H 4.314 -2.063 -7.128 1.00 . A A . 8 TRP HH2 1 1 12 3257 1 1 8 TRP HZ2 H 5.303 -0.013 -6.140 1.00 . A A . 8 TRP HZ2 1 1 12 3258 1 1 8 TRP HZ3 H 2.732 -3.437 -5.803 1.00 . A A . 8 TRP HZ3 1 1 12 3259 1 1 8 TRP N N 1.879 -2.728 0.304 1.00 . A A . 8 TRP N 1 1 12 3260 1 1 8 TRP NE1 N 4.635 0.806 -3.443 1.00 . A A . 8 TRP NE1 1 1 12 3261 1 1 8 TRP O O 3.858 -0.774 1.455 1.00 . A A . 8 TRP O 1 1 12 3262 1 1 9 PRO C C 7.174 -0.830 0.928 1.00 . A A . 9 PRO C 1 1 12 3263 1 1 9 PRO CA C 6.333 -1.996 1.450 1.00 . A A . 9 PRO CA 1 1 12 3264 1 1 9 PRO CB C 7.132 -3.292 1.436 1.00 . A A . 9 PRO CB 1 1 12 3265 1 1 9 PRO CD C 5.544 -3.337 -0.423 1.00 . A A . 9 PRO CD 1 1 12 3266 1 1 9 PRO CG C 6.813 -3.952 0.124 1.00 . A A . 9 PRO CG 1 1 12 3267 1 1 9 PRO HA H 5.972 -1.791 2.441 1.00 . A A . 9 PRO HA 1 1 12 3268 1 1 9 PRO HB2 H 8.189 -3.077 1.503 1.00 . A A . 9 PRO HB2 1 1 12 3269 1 1 9 PRO HB3 H 6.825 -3.926 2.250 1.00 . A A . 9 PRO HB3 1 1 12 3270 1 1 9 PRO HD2 H 5.722 -2.918 -1.404 1.00 . A A . 9 PRO HD2 1 1 12 3271 1 1 9 PRO HD3 H 4.753 -4.070 -0.461 1.00 . A A . 9 PRO HD3 1 1 12 3272 1 1 9 PRO HG2 H 7.627 -3.792 -0.570 1.00 . A A . 9 PRO HG2 1 1 12 3273 1 1 9 PRO HG3 H 6.665 -5.011 0.275 1.00 . A A . 9 PRO HG3 1 1 12 3274 1 1 9 PRO N N 5.209 -2.284 0.534 1.00 . A A . 9 PRO N 1 1 12 3275 1 1 9 PRO O O 8.362 -0.749 1.168 1.00 . A A . 9 PRO O 1 1 12 3276 1 1 10 TRP C C 6.917 2.507 0.410 1.00 . A A . 10 TRP C 1 1 12 3277 1 1 10 TRP CA C 7.309 1.229 -0.330 1.00 . A A . 10 TRP CA 1 1 12 3278 1 1 10 TRP CB C 6.882 1.304 -1.792 1.00 . A A . 10 TRP CB 1 1 12 3279 1 1 10 TRP CD1 C 8.929 2.443 -2.743 1.00 . A A . 10 TRP CD1 1 1 12 3280 1 1 10 TRP CD2 C 8.597 0.385 -3.573 1.00 . A A . 10 TRP CD2 1 1 12 3281 1 1 10 TRP CE2 C 9.764 0.881 -4.195 1.00 . A A . 10 TRP CE2 1 1 12 3282 1 1 10 TRP CE3 C 8.154 -0.900 -3.911 1.00 . A A . 10 TRP CE3 1 1 12 3283 1 1 10 TRP CG C 8.088 1.386 -2.661 1.00 . A A . 10 TRP CG 1 1 12 3284 1 1 10 TRP CH2 C 10.018 -1.158 -5.459 1.00 . A A . 10 TRP CH2 1 1 12 3285 1 1 10 TRP CZ2 C 10.472 0.123 -5.128 1.00 . A A . 10 TRP CZ2 1 1 12 3286 1 1 10 TRP CZ3 C 8.862 -1.670 -4.851 1.00 . A A . 10 TRP CZ3 1 1 12 3287 1 1 10 TRP H H 5.612 -0.025 0.036 1.00 . A A . 10 TRP H 1 1 12 3288 1 1 10 TRP HA H 8.367 1.062 -0.263 1.00 . A A . 10 TRP HA 1 1 12 3289 1 1 10 TRP HB2 H 6.322 0.417 -2.045 1.00 . A A . 10 TRP HB2 1 1 12 3290 1 1 10 TRP HB3 H 6.266 2.172 -1.947 1.00 . A A . 10 TRP HB3 1 1 12 3291 1 1 10 TRP HD1 H 8.835 3.365 -2.189 1.00 . A A . 10 TRP HD1 1 1 12 3292 1 1 10 TRP HE1 H 10.666 2.740 -3.902 1.00 . A A . 10 TRP HE1 1 1 12 3293 1 1 10 TRP HE3 H 7.263 -1.293 -3.443 1.00 . A A . 10 TRP HE3 1 1 12 3294 1 1 10 TRP HH2 H 10.558 -1.754 -6.179 1.00 . A A . 10 TRP HH2 1 1 12 3295 1 1 10 TRP HZ2 H 11.362 0.523 -5.592 1.00 . A A . 10 TRP HZ2 1 1 12 3296 1 1 10 TRP HZ3 H 8.513 -2.660 -5.106 1.00 . A A . 10 TRP HZ3 1 1 12 3297 1 1 10 TRP N N 6.563 0.067 0.215 1.00 . A A . 10 TRP N 1 1 12 3298 1 1 10 TRP NE1 N 9.928 2.144 -3.656 1.00 . A A . 10 TRP NE1 1 1 12 3299 1 1 10 TRP O O 7.753 3.289 0.817 1.00 . A A . 10 TRP O 1 1 12 3300 1 1 11 ARG C C 4.430 3.547 2.570 1.00 . A A . 11 ARG C 1 1 12 3301 1 1 11 ARG CA C 5.182 3.942 1.302 1.00 . A A . 11 ARG CA 1 1 12 3302 1 1 11 ARG CB C 4.253 4.651 0.318 1.00 . A A . 11 ARG CB 1 1 12 3303 1 1 11 ARG CD C 4.720 7.104 0.387 1.00 . A A . 11 ARG CD 1 1 12 3304 1 1 11 ARG CG C 5.004 5.797 -0.359 1.00 . A A . 11 ARG CG 1 1 12 3305 1 1 11 ARG CZ C 4.126 9.166 -0.733 1.00 . A A . 11 ARG CZ 1 1 12 3306 1 1 11 ARG H H 4.994 2.076 0.254 1.00 . A A . 11 ARG H 1 1 12 3307 1 1 11 ARG HA H 6.020 4.573 1.548 1.00 . A A . 11 ARG HA 1 1 12 3308 1 1 11 ARG HB2 H 3.918 3.946 -0.429 1.00 . A A . 11 ARG HB2 1 1 12 3309 1 1 11 ARG HB3 H 3.401 5.045 0.848 1.00 . A A . 11 ARG HB3 1 1 12 3310 1 1 11 ARG HD2 H 3.692 7.128 0.721 1.00 . A A . 11 ARG HD2 1 1 12 3311 1 1 11 ARG HD3 H 5.392 7.214 1.223 1.00 . A A . 11 ARG HD3 1 1 12 3312 1 1 11 ARG HE H 5.768 8.144 -1.182 1.00 . A A . 11 ARG HE 1 1 12 3313 1 1 11 ARG HG2 H 6.066 5.593 -0.339 1.00 . A A . 11 ARG HG2 1 1 12 3314 1 1 11 ARG HG3 H 4.674 5.889 -1.382 1.00 . A A . 11 ARG HG3 1 1 12 3315 1 1 11 ARG HH11 H 3.446 9.014 1.143 1.00 . A A . 11 ARG HH11 1 1 12 3316 1 1 11 ARG HH12 H 2.728 10.266 0.187 1.00 . A A . 11 ARG HH12 1 1 12 3317 1 1 11 ARG HH21 H 4.608 9.550 -2.637 1.00 . A A . 11 ARG HH21 1 1 12 3318 1 1 11 ARG HH22 H 3.387 10.570 -1.955 1.00 . A A . 11 ARG HH22 1 1 12 3319 1 1 11 ARG N N 5.646 2.721 0.589 1.00 . A A . 11 ARG N 1 1 12 3320 1 1 11 ARG NE N 4.970 8.179 -0.613 1.00 . A A . 11 ARG NE 1 1 12 3321 1 1 11 ARG NH1 N 3.376 9.509 0.278 1.00 . A A . 11 ARG NH1 1 1 12 3322 1 1 11 ARG NH2 N 4.033 9.812 -1.862 1.00 . A A . 11 ARG NH2 1 1 12 3323 1 1 11 ARG O O 3.266 3.854 2.741 1.00 . A A . 11 ARG O 1 1 12 3324 1 1 12 ARG C C 5.423 1.658 5.594 1.00 . A A . 12 ARG C 1 1 12 3325 1 1 12 ARG CA C 4.435 2.443 4.724 1.00 . A A . 12 ARG CA 1 1 12 3326 1 1 12 ARG CB C 3.276 1.546 4.287 1.00 . A A . 12 ARG CB 1 1 12 3327 1 1 12 ARG CD C 1.021 2.600 4.507 1.00 . A A . 12 ARG CD 1 1 12 3328 1 1 12 ARG CG C 2.083 1.762 5.220 1.00 . A A . 12 ARG CG 1 1 12 3329 1 1 12 ARG CZ C -0.088 4.336 5.779 1.00 . A A . 12 ARG CZ 1 1 12 3330 1 1 12 ARG H H 6.031 2.640 3.285 1.00 . A A . 12 ARG H 1 1 12 3331 1 1 12 ARG HA H 4.058 3.299 5.260 1.00 . A A . 12 ARG HA 1 1 12 3332 1 1 12 ARG HB2 H 2.992 1.794 3.275 1.00 . A A . 12 ARG HB2 1 1 12 3333 1 1 12 ARG HB3 H 3.585 0.512 4.332 1.00 . A A . 12 ARG HB3 1 1 12 3334 1 1 12 ARG HD2 H 1.481 3.445 4.014 1.00 . A A . 12 ARG HD2 1 1 12 3335 1 1 12 ARG HD3 H 0.479 1.995 3.796 1.00 . A A . 12 ARG HD3 1 1 12 3336 1 1 12 ARG HE H -0.351 2.403 6.154 1.00 . A A . 12 ARG HE 1 1 12 3337 1 1 12 ARG HG2 H 1.664 0.803 5.494 1.00 . A A . 12 ARG HG2 1 1 12 3338 1 1 12 ARG HG3 H 2.411 2.279 6.109 1.00 . A A . 12 ARG HG3 1 1 12 3339 1 1 12 ARG HH11 H -1.042 4.609 4.039 1.00 . A A . 12 ARG HH11 1 1 12 3340 1 1 12 ARG HH12 H -0.859 6.022 5.025 1.00 . A A . 12 ARG HH12 1 1 12 3341 1 1 12 ARG HH21 H 0.817 4.361 7.564 1.00 . A A . 12 ARG HH21 1 1 12 3342 1 1 12 ARG HH22 H 0.193 5.881 7.020 1.00 . A A . 12 ARG HH22 1 1 12 3343 1 1 12 ARG N N 5.094 2.869 3.457 1.00 . A A . 12 ARG N 1 1 12 3344 1 1 12 ARG NE N 0.105 3.059 5.587 1.00 . A A . 12 ARG NE 1 1 12 3345 1 1 12 ARG NH1 N -0.713 5.044 4.878 1.00 . A A . 12 ARG NH1 1 1 12 3346 1 1 12 ARG NH2 N 0.340 4.903 6.873 1.00 . A A . 12 ARG NH2 1 1 12 3347 1 1 12 ARG O O 5.374 0.447 5.668 1.00 . A A . 12 ARG O 1 1 12 3348 1 1 13 LYS C C 6.818 1.605 8.565 1.00 . A A . 13 LYS C 1 1 12 3349 1 1 13 LYS CA C 7.308 1.635 7.115 1.00 . A A . 13 LYS CA 1 1 12 3350 1 1 13 LYS CB C 8.593 2.457 6.999 1.00 . A A . 13 LYS CB 1 1 12 3351 1 1 13 LYS CD C 10.506 2.798 5.428 1.00 . A A . 13 LYS CD 1 1 12 3352 1 1 13 LYS CE C 10.791 3.850 4.354 1.00 . A A . 13 LYS CE 1 1 12 3353 1 1 13 LYS CG C 8.997 2.566 5.528 1.00 . A A . 13 LYS CG 1 1 12 3354 1 1 13 LYS H H 6.341 3.318 6.178 1.00 . A A . 13 LYS H 1 1 12 3355 1 1 13 LYS HA H 7.478 0.634 6.753 1.00 . A A . 13 LYS HA 1 1 12 3356 1 1 13 LYS HB2 H 8.424 3.446 7.403 1.00 . A A . 13 LYS HB2 1 1 12 3357 1 1 13 LYS HB3 H 9.381 1.973 7.553 1.00 . A A . 13 LYS HB3 1 1 12 3358 1 1 13 LYS HD2 H 10.880 3.143 6.381 1.00 . A A . 13 LYS HD2 1 1 12 3359 1 1 13 LYS HD3 H 10.995 1.873 5.161 1.00 . A A . 13 LYS HD3 1 1 12 3360 1 1 13 LYS HE2 H 10.212 3.645 3.464 1.00 . A A . 13 LYS HE2 1 1 12 3361 1 1 13 LYS HE3 H 10.571 4.839 4.728 1.00 . A A . 13 LYS HE3 1 1 12 3362 1 1 13 LYS HG2 H 8.737 1.651 5.015 1.00 . A A . 13 LYS HG2 1 1 12 3363 1 1 13 LYS HG3 H 8.477 3.394 5.072 1.00 . A A . 13 LYS HG3 1 1 12 3364 1 1 13 LYS HZ1 H 12.786 3.858 4.951 1.00 . A A . 13 LYS HZ1 1 1 12 3365 1 1 13 LYS HZ2 H 12.528 4.450 3.379 1.00 . A A . 13 LYS HZ2 1 1 12 3366 1 1 13 LYS HZ3 H 12.446 2.781 3.684 1.00 . A A . 13 LYS HZ3 1 1 12 3367 1 1 13 LYS N N 6.319 2.341 6.253 1.00 . A A . 13 LYS N 1 1 12 3368 1 1 13 LYS NZ N 12.249 3.725 4.071 1.00 . A A . 13 LYS NZ 1 1 12 3369 1 1 13 LYS O O 7.601 1.694 9.491 1.00 . A A . 13 LYS O 1 1 12 3370 1 1 14 NH2 HN1 H 4.908 1.410 8.060 1.00 . A A . 14 NH2 HN1 1 1 12 3371 1 1 14 NH2 HN2 H 5.216 1.462 9.729 1.00 . A A . 14 NH2 HN2 1 1 12 3372 1 1 14 NH2 N N 5.541 1.482 8.804 1.00 . A A . 14 NH2 N 1 1 stop_ save_
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