NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
386740 | 1m02 | 5494 | cing | 4-filtered-FRED | STAR | entry | full | 90 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1m02 # This FRED archive file contains, for PDB entry <1m02>: # # - 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_1m02 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1m02 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 1613.88 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 $HIS_PRO_LEU_LYS_GLN_TYR_TRP_TRP_ARG_PRO_SER_ILE A . 1 1 stop_ save_ save_HIS_PRO_LEU_LYS_GLN_TYR_TRP_TRP_ARG_PRO_SER_ILE _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "HIS PRO LEU LYS GLN TYR TRP TRP ARG PRO SER ILE" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code HPLKQYWWRPSI _Entity.Number_of_monomers 12 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 HIS . 1 1 2 PRO . 1 1 3 LEU . 1 1 4 LYS . 1 1 5 GLN . 1 1 6 TYR . 1 1 7 TRP . 1 1 8 TRP . 1 1 9 ARG . 1 1 10 PRO . 1 1 11 SER . 1 1 12 ILE . 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 HIS 1 1 1 1 PRO 2 2 1 1 LEU 3 3 1 1 LYS 4 4 1 1 GLN 5 5 1 1 TYR 6 6 1 1 TRP 7 7 1 1 TRP 8 8 1 1 ARG 9 9 1 1 PRO 10 10 1 1 SER 11 11 1 1 ILE 12 12 1 1 stop_ 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 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 HIS H1 . 1 . HT1 1 1 1 1 2 1 1 1 HIS QB . 1 . HB# 1 1 2 1 1 1 1 2 PRO HA . 2 . HA 1 1 2 1 2 1 1 3 LEU H . 3 . HN 1 1 3 1 1 1 1 2 PRO HA . 2 . HA 1 1 3 1 2 1 1 4 LYS H . 4 . HN 1 1 4 1 1 1 1 2 PRO QB . 2 . HB# 1 1 4 1 2 1 1 3 LEU H . 3 . HN 1 1 5 1 1 1 1 2 PRO QB . 2 . HB# 1 1 5 1 2 1 1 4 LYS H . 4 . HN 1 1 6 1 1 1 1 2 PRO QD . 2 . HD# 1 1 6 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 7 1 1 1 1 2 PRO QG . 2 . HG# 1 1 7 1 2 1 1 3 LEU H . 3 . HN 1 1 8 1 1 1 1 2 PRO QG . 2 . HG# 1 1 8 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 9 1 1 1 1 3 LEU H . 3 . HN 1 1 9 1 2 1 1 3 LEU HA . 3 . HA 1 1 10 1 1 1 1 3 LEU H . 3 . HN 1 1 10 1 2 1 1 3 LEU QB . 3 . HB# 1 1 11 1 1 1 1 3 LEU H . 3 . HN 1 1 11 1 2 1 1 3 LEU QD . 3 . HD## 1 1 12 1 1 1 1 3 LEU H . 3 . HN 1 1 12 1 2 1 1 3 LEU HG . 3 . HG 1 1 13 1 1 1 1 3 LEU H . 3 . HN 1 1 13 1 2 1 1 4 LYS H . 4 . HN 1 1 14 1 1 1 1 3 LEU HA . 3 . HA 1 1 14 1 2 1 1 3 LEU QD . 3 . HD## 1 1 15 1 1 1 1 3 LEU HA . 3 . HA 1 1 15 1 2 1 1 3 LEU HG . 3 . HG 1 1 16 1 1 1 1 3 LEU HA . 3 . HA 1 1 16 1 2 1 1 4 LYS H . 4 . HN 1 1 17 1 1 1 1 3 LEU HA . 3 . HA 1 1 17 1 2 1 1 6 TYR QD . 6 . HD# 1 1 18 1 1 1 1 3 LEU QB . 3 . HB# 1 1 18 1 2 1 1 3 LEU QD . 3 . HD## 1 1 19 1 1 1 1 3 LEU QD . 3 . HD## 1 1 19 1 2 1 1 4 LYS H . 4 . HN 1 1 20 1 1 1 1 3 LEU QD . 3 . HD## 1 1 20 1 2 1 1 5 GLN H . 5 . HN 1 1 21 1 1 1 1 3 LEU QD . 3 . HD## 1 1 21 1 2 1 1 6 TYR QD . 6 . HD# 1 1 22 1 1 1 1 3 LEU QD . 3 . HD## 1 1 22 1 2 1 1 6 TYR QE . 6 . HE# 1 1 23 1 1 1 1 4 LYS H . 4 . HN 1 1 23 1 2 1 1 4 LYS HA . 4 . HA 1 1 24 1 1 1 1 4 LYS H . 4 . HN 1 1 24 1 2 1 1 4 LYS QB . 4 . HB# 1 1 25 1 1 1 1 4 LYS H . 4 . HN 1 1 25 1 2 1 1 4 LYS QG . 4 . HG# 1 1 26 1 1 1 1 4 LYS HA . 4 . HA 1 1 26 1 2 1 1 4 LYS QB . 4 . HB# 1 1 27 1 1 1 1 4 LYS HA . 4 . HA 1 1 27 1 2 1 1 4 LYS QG . 4 . HG# 1 1 28 1 1 1 1 4 LYS HA . 4 . HA 1 1 28 1 2 1 1 5 GLN H . 5 . HN 1 1 29 1 1 1 1 4 LYS QE . 4 . HE# 1 1 29 1 2 1 1 4 LYS QG . 4 . HG# 1 1 30 1 1 1 1 4 LYS QG . 4 . HG# 1 1 30 1 2 1 1 5 GLN H . 5 . HN 1 1 31 1 1 1 1 5 GLN H . 5 . HN 1 1 31 1 2 1 1 5 GLN QB . 5 . HB# 1 1 32 1 1 1 1 5 GLN H . 5 . HN 1 1 32 1 2 1 1 5 GLN QG . 5 . HG# 1 1 33 1 1 1 1 5 GLN HA . 5 . HA 1 1 33 1 2 1 1 5 GLN QB . 5 . HB# 1 1 34 1 1 1 1 5 GLN HA . 5 . HA 1 1 34 1 2 1 1 5 GLN QG . 5 . HG# 1 1 35 1 1 1 1 5 GLN HA . 5 . HA 1 1 35 1 2 1 1 6 TYR H . 6 . HN 1 1 36 1 1 1 1 5 GLN QB . 5 . HB# 1 1 36 1 2 1 1 5 GLN QE . 5 . HE## 1 1 37 1 1 1 1 5 GLN QB . 5 . HB# 1 1 37 1 2 1 1 6 TYR QD . 6 . HD# 1 1 38 1 1 1 1 5 GLN QB . 5 . HB# 1 1 38 1 2 1 1 7 TRP H . 7 . HN 1 1 39 1 1 1 1 6 TYR H . 6 . HN 1 1 39 1 2 1 1 6 TYR HA . 6 . HA 1 1 40 1 1 1 1 6 TYR H . 6 . HN 1 1 40 1 2 1 1 6 TYR QB . 6 . HB# 1 1 41 1 1 1 1 6 TYR H . 6 . HN 1 1 41 1 2 1 1 6 TYR QD . 6 . HD# 1 1 42 1 1 1 1 6 TYR H . 6 . HN 1 1 42 1 2 1 1 7 TRP H . 7 . HN 1 1 43 1 1 1 1 6 TYR HA . 6 . HA 1 1 43 1 2 1 1 6 TYR QD . 6 . HD# 1 1 44 1 1 1 1 6 TYR HA . 6 . HA 1 1 44 1 2 1 1 7 TRP H . 7 . HN 1 1 45 1 1 1 1 6 TYR QB . 6 . HB# 1 1 45 1 2 1 1 6 TYR QD . 6 . HD# 1 1 46 1 1 1 1 6 TYR QB . 6 . HB# 1 1 46 1 2 1 1 7 TRP H . 7 . HN 1 1 47 1 1 1 1 6 TYR QD . 6 . HD# 1 1 47 1 2 1 1 7 TRP H . 7 . HN 1 1 48 1 1 1 1 7 TRP H . 7 . HN 1 1 48 1 2 1 1 7 TRP HA . 7 . HA 1 1 49 1 1 1 1 7 TRP H . 7 . HN 1 1 49 1 2 1 1 7 TRP QB . 7 . HB# 1 1 50 1 1 1 1 7 TRP H . 7 . HN 1 1 50 1 2 1 1 7 TRP HD1 . 7 . HD1 1 1 51 1 1 1 1 7 TRP H . 7 . HN 1 1 51 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 52 1 1 1 1 7 TRP H . 7 . HN 1 1 52 1 2 1 1 8 TRP H . 8 . HN 1 1 53 1 1 1 1 7 TRP HA . 7 . HA 1 1 53 1 2 1 1 7 TRP QB . 7 . HB# 1 1 54 1 1 1 1 7 TRP HA . 7 . HA 1 1 54 1 2 1 1 7 TRP HD1 . 7 . HD1 1 1 55 1 1 1 1 7 TRP HA . 7 . HA 1 1 55 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 56 1 1 1 1 7 TRP HA . 7 . HA 1 1 56 1 2 1 1 8 TRP H . 8 . HN 1 1 57 1 1 1 1 7 TRP QB . 7 . HB# 1 1 57 1 2 1 1 7 TRP HD1 . 7 . HD1 1 1 58 1 1 1 1 7 TRP QB . 7 . HB# 1 1 58 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 59 1 1 1 1 7 TRP QB . 7 . HB# 1 1 59 1 2 1 1 8 TRP H . 8 . HN 1 1 60 1 1 1 1 7 TRP HE3 . 7 . HE3 1 1 60 1 2 1 1 11 SER HA . 11 . HA 1 1 61 1 1 1 1 8 TRP H . 8 . HN 1 1 61 1 2 1 1 8 TRP HA . 8 . HA 1 1 62 1 1 1 1 8 TRP H . 8 . HN 1 1 62 1 2 1 1 8 TRP QB . 8 . HB# 1 1 63 1 1 1 1 8 TRP H . 8 . HN 1 1 63 1 2 1 1 10 PRO QG . 10 . HG# 1 1 64 1 1 1 1 8 TRP HA . 8 . HA 1 1 64 1 2 1 1 8 TRP HE3 . 8 . HE3 1 1 65 1 1 1 1 8 TRP HA . 8 . HA 1 1 65 1 2 1 1 9 ARG H . 9 . HN 1 1 66 1 1 1 1 8 TRP QB . 8 . HB# 1 1 66 1 2 1 1 8 TRP HD1 . 8 . HD1 1 1 67 1 1 1 1 8 TRP QB . 8 . HB# 1 1 67 1 2 1 1 8 TRP HE3 . 8 . HE3 1 1 68 1 1 1 1 9 ARG H . 9 . HN 1 1 68 1 2 1 1 9 ARG QB . 9 . HB# 1 1 69 1 1 1 1 9 ARG H . 9 . HN 1 1 69 1 2 1 1 9 ARG QG . 9 . HG# 1 1 70 1 1 1 1 9 ARG HA . 9 . HA 1 1 70 1 2 1 1 9 ARG QD . 9 . HD# 1 1 71 1 1 1 1 9 ARG HA . 9 . HA 1 1 71 1 2 1 1 9 ARG QG . 9 . HG# 1 1 72 1 1 1 1 9 ARG HA . 9 . HA 1 1 72 1 2 1 1 10 PRO QD . 10 . HD# 1 1 73 1 1 1 1 9 ARG QB . 9 . HB# 1 1 73 1 2 1 1 9 ARG HE . 9 . HE 1 1 74 1 1 1 1 9 ARG QB . 9 . HB# 1 1 74 1 2 1 1 10 PRO QD . 10 . HD# 1 1 75 1 1 1 1 9 ARG QD . 9 . HD# 1 1 75 1 2 1 1 9 ARG QH . 9 . HH## 1 1 76 1 1 1 1 9 ARG HE . 9 . HE 1 1 76 1 2 1 1 9 ARG QG . 9 . HG# 1 1 77 1 1 1 1 9 ARG QG . 9 . HG# 1 1 77 1 2 1 1 9 ARG QH . 9 . HH## 1 1 78 1 1 1 1 9 ARG QG . 9 . HG# 1 1 78 1 2 1 1 10 PRO QD . 10 . HD# 1 1 79 1 1 1 1 10 PRO HA . 10 . HA 1 1 79 1 2 1 1 10 PRO QG . 10 . HG# 1 1 80 1 1 1 1 10 PRO HA . 10 . HA 1 1 80 1 2 1 1 11 SER H . 11 . HN 1 1 81 1 1 1 1 10 PRO QB . 10 . HB# 1 1 81 1 2 1 1 10 PRO QD . 10 . HD# 1 1 82 1 1 1 1 10 PRO QB . 10 . HB# 1 1 82 1 2 1 1 11 SER H . 11 . HN 1 1 83 1 1 1 1 10 PRO HD2 . 10 . HD2 1 1 83 1 2 1 1 11 SER H . 11 . HN 1 1 84 1 1 1 1 10 PRO QG . 10 . HG# 1 1 84 1 2 1 1 11 SER H . 11 . HN 1 1 85 1 1 1 1 11 SER H . 11 . HN 1 1 85 1 2 1 1 11 SER HA . 11 . HA 1 1 86 1 1 1 1 11 SER H . 11 . HN 1 1 86 1 2 1 1 11 SER QB . 11 . HB# 1 1 87 1 1 1 1 11 SER H . 11 . HN 1 1 87 1 2 1 1 12 ILE H . 12 . HN 1 1 88 1 1 1 1 11 SER HA . 11 . HA 1 1 88 1 2 1 1 12 ILE H . 12 . HN 1 1 89 1 1 1 1 11 SER QB . 11 . HB# 1 1 89 1 2 1 1 12 ILE H . 12 . HN 1 1 90 1 1 1 1 12 ILE H . 12 . HN 1 1 90 1 2 1 1 12 ILE HA . 12 . HA 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.62 1.8 5.0 1 1 2 1 . . . . . 2.42 1.8 3.4 1 1 3 1 . . . . . 4.29 1.8 5.0 1 1 4 1 . . . . . 3.51 1.8 5.0 1 1 5 1 . . . . . 2.65 1.8 4.4 1 1 6 1 . . . . . 3.29 1.8 5.0 1 1 7 1 . . . . . 3.44 1.8 5.0 1 1 8 1 . . . . . 3.77 1.8 5.0 1 1 9 1 . . . . . 2.73 1.8 3.4 1 1 10 1 . . . . . 2.73 1.8 3.4 1 1 11 1 . . . . . 3.26 1.8 5.0 1 1 12 1 . . . . . 2.87 1.8 5.0 1 1 13 1 . . . . . 3.3 1.8 3.4 1 1 14 1 . . . . . 2.53 1.8 3.4 1 1 15 1 . . . . . 2.62 1.8 3.72 1 1 16 1 . . . . . 2.36 1.8 3.4 1 1 17 1 . . . . . 3.02 1.8 5.0 1 1 18 1 . . . . . 2.51 1.8 3.4 1 1 19 1 . . . . . 3.87 1.8 5.0 1 1 20 1 . . . . . 4.12 1.8 5.0 1 1 21 1 . . . . . 3.77 1.8 5.0 1 1 22 1 . . . . . 4.01 1.8 5.0 1 1 23 1 . . . . . 2.46 1.8 3.4 1 1 24 1 . . . . . 1.96 1.8 3.4 1 1 25 1 . . . . . 2.86 1.8 4.4 1 1 26 1 . . . . . 2.6 1.8 3.4 1 1 27 1 . . . . . 3.11 1.8 5.0 1 1 28 1 . . . . . 2.7 1.8 3.4 1 1 29 1 . . . . . 2.71 1.8 3.4 1 1 30 1 . . . . . 3.81 1.8 5.0 1 1 31 1 . . . . . 2.61 1.8 3.4 1 1 32 1 . . . . . 3.03 1.8 5.0 1 1 33 1 . . . . . 2.61 1.8 3.4 1 1 34 1 . . . . . 3.69 1.8 5.0 1 1 35 1 . . . . . 2.62 1.8 3.4 1 1 36 1 . . . . . 3.8 1.8 5.0 1 1 37 1 . . . . . 3.22 1.8 5.0 1 1 38 1 . . . . . 4.17 1.8 5.0 1 1 39 1 . . . . . 2.49 1.8 3.4 1 1 40 1 . . . . . 3.51 1.8 5.0 1 1 41 1 . . . . . 3.71 1.8 5.0 1 1 42 1 . . . . . 3.14 1.8 3.4 1 1 43 1 . . . . . 2.65 1.8 3.4 1 1 44 1 . . . . . 2.61 1.8 3.4 1 1 45 1 . . . . . 2.66 1.8 3.4 1 1 46 1 . . . . . 3.75 1.8 5.0 1 1 47 1 . . . . . 2.88 1.8 5.0 1 1 48 1 . . . . . 2.75 1.8 3.4 1 1 49 1 . . . . . 2.32 1.8 3.4 1 1 50 1 . . . . . 2.96 1.8 5.0 1 1 51 1 . . . . . 4.27 1.8 5.0 1 1 52 1 . . . . . 3.56 1.8 5.0 1 1 53 1 . . . . . 2.37 1.8 3.4 1 1 54 1 . . . . . 3.07 1.8 5.0 1 1 55 1 . . . . . 2.81 1.8 5.0 1 1 56 1 . . . . . 2.87 1.8 5.0 1 1 57 1 . . . . . 2.64 1.8 3.4 1 1 58 1 . . . . . 2.75 1.8 3.4 1 1 59 1 . . . . . 2.88 1.8 5.0 1 1 60 1 . . . . . 3.24 1.8 5.0 1 1 61 1 . . . . . 2.87 1.8 5.0 1 1 62 1 . . . . . 3.3 1.8 3.4 1 1 63 1 . . . . . 4.03 1.8 5.0 1 1 64 1 . . . . . 3.42 1.8 5.0 1 1 65 1 . . . . . 2.59 1.8 3.4 1 1 66 1 . . . . . 2.86 1.8 5.0 1 1 67 1 . . . . . 3.44 1.8 5.0 1 1 68 1 . . . . . 3.06 1.8 5.0 1 1 69 1 . . . . . 2.56 1.8 3.4 1 1 70 1 . . . . . 3.25 1.8 5.0 1 1 71 1 . . . . . 2.53 1.8 3.4 1 1 72 1 . . . . . 3.08 1.8 5.0 1 1 73 1 . . . . . 3.34 1.8 5.0 1 1 74 1 . . . . . 5.0 1.8 5.0 1 1 75 1 . . . . . 2.55 1.8 3.9 1 1 76 1 . . . . . 2.56 1.8 3.4 1 1 77 1 . . . . . 3.2 1.8 5.0 1 1 78 1 . . . . . 4.02 1.8 5.0 1 1 79 1 . . . . . 3.71 1.8 5.0 1 1 80 1 . . . . . 2.24 1.8 3.4 1 1 81 1 . . . . . 2.56 1.8 3.4 1 1 82 1 . . . . . 3.36 1.8 5.0 1 1 83 1 . . . . . 4.06 1.8 5.0 1 1 84 1 . . . . . 3.41 1.8 5.0 1 1 85 1 . . . . . 2.61 1.8 3.4 1 1 86 1 . . . . . 2.9 1.8 5.0 1 1 87 1 . . . . . 3.25 1.8 5.0 1 1 88 1 . . . . . 2.57 1.8 3.4 1 1 89 1 . . . . . 3.98 1.8 5.0 1 1 90 1 . . . . . 2.76 1.8 3.4 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 HIS C C -5.086 5.380 2.030 1.00 . A A . 1 HIS C 1 1 1 2 1 1 1 HIS CA C -4.515 6.767 2.312 1.00 . A A . 1 HIS CA 1 1 1 3 1 1 1 HIS CB C -3.126 6.647 2.943 1.00 . A A . 1 HIS CB 1 1 1 4 1 1 1 HIS CD2 C -2.039 8.524 4.366 1.00 . A A . 1 HIS CD2 1 1 1 5 1 1 1 HIS CE1 C -1.618 9.945 2.751 1.00 . A A . 1 HIS CE1 1 1 1 6 1 1 1 HIS CG C -2.472 7.967 3.209 1.00 . A A . 1 HIS CG 1 1 1 7 1 1 1 HIS H1 H -5.515 6.961 4.100 1.00 . A A . 1 HIS H1 1 1 1 8 1 1 1 HIS H2 H -6.301 7.688 2.758 1.00 . A A . 1 HIS H2 1 1 1 9 1 1 1 HIS H3 H -4.919 8.431 3.452 1.00 . A A . 1 HIS H3 1 1 1 10 1 1 1 HIS HA H -4.438 7.313 1.384 1.00 . A A . 1 HIS HA 1 1 1 11 1 1 1 HIS HB2 H -3.209 6.123 3.883 1.00 . A A . 1 HIS HB2 1 1 1 12 1 1 1 HIS HB3 H -2.485 6.085 2.279 1.00 . A A . 1 HIS HB3 1 1 1 13 1 1 1 HIS HD1 H -2.389 8.771 1.263 1.00 . A A . 1 HIS HD1 1 1 1 14 1 1 1 HIS HD2 H -2.098 8.084 5.350 1.00 . A A . 1 HIS HD2 1 1 1 15 1 1 1 HIS HE1 H -1.288 10.823 2.213 1.00 . A A . 1 HIS HE1 1 1 1 16 1 1 1 HIS HE2 H -1.028 10.338 4.671 1.00 . A A . 1 HIS HE2 1 1 1 17 1 1 1 HIS N N -5.391 7.531 3.239 1.00 . A A . 1 HIS N 1 1 1 18 1 1 1 HIS ND1 N -2.194 8.883 2.218 1.00 . A A . 1 HIS ND1 1 1 1 19 1 1 1 HIS NE2 N -1.512 9.753 4.053 1.00 . A A . 1 HIS NE2 1 1 1 20 1 1 1 HIS O O -5.750 4.788 2.881 1.00 . A A . 1 HIS O 1 1 1 21 1 1 2 PRO C C -4.957 2.441 1.453 1.00 . A A . 2 PRO C 1 1 1 22 1 1 2 PRO CA C -5.325 3.515 0.436 1.00 . A A . 2 PRO CA 1 1 1 23 1 1 2 PRO CB C -4.624 3.250 -0.898 1.00 . A A . 2 PRO CB 1 1 1 24 1 1 2 PRO CD C -4.049 5.477 -0.249 1.00 . A A . 2 PRO CD 1 1 1 25 1 1 2 PRO CG C -4.321 4.602 -1.442 1.00 . A A . 2 PRO CG 1 1 1 26 1 1 2 PRO HA H -6.395 3.518 0.290 1.00 . A A . 2 PRO HA 1 1 1 27 1 1 2 PRO HB2 H -3.722 2.681 -0.727 1.00 . A A . 2 PRO HB2 1 1 1 28 1 1 2 PRO HB3 H -5.285 2.701 -1.552 1.00 . A A . 2 PRO HB3 1 1 1 29 1 1 2 PRO HD2 H -2.995 5.474 -0.012 1.00 . A A . 2 PRO HD2 1 1 1 30 1 1 2 PRO HD3 H -4.394 6.483 -0.433 1.00 . A A . 2 PRO HD3 1 1 1 31 1 1 2 PRO HG2 H -3.449 4.555 -2.079 1.00 . A A . 2 PRO HG2 1 1 1 32 1 1 2 PRO HG3 H -5.171 4.976 -1.995 1.00 . A A . 2 PRO HG3 1 1 1 33 1 1 2 PRO N N -4.833 4.840 0.825 1.00 . A A . 2 PRO N 1 1 1 34 1 1 2 PRO O O -3.801 2.329 1.863 1.00 . A A . 2 PRO O 1 1 1 35 1 1 3 LEU C C -6.336 -0.736 2.362 1.00 . A A . 3 LEU C 1 1 1 36 1 1 3 LEU CA C -5.726 0.585 2.828 1.00 . A A . 3 LEU CA 1 1 1 37 1 1 3 LEU CB C -6.286 0.992 4.195 1.00 . A A . 3 LEU CB 1 1 1 38 1 1 3 LEU CD1 C -8.620 0.107 3.818 1.00 . A A . 3 LEU CD1 1 1 1 39 1 1 3 LEU CD2 C -8.192 1.788 5.618 1.00 . A A . 3 LEU CD2 1 1 1 40 1 1 3 LEU CG C -7.785 1.310 4.232 1.00 . A A . 3 LEU CG 1 1 1 41 1 1 3 LEU H H -6.846 1.789 1.496 1.00 . A A . 3 LEU H 1 1 1 42 1 1 3 LEU HA H -4.660 0.452 2.923 1.00 . A A . 3 LEU HA 1 1 1 43 1 1 3 LEU HB2 H -6.096 0.186 4.890 1.00 . A A . 3 LEU HB2 1 1 1 44 1 1 3 LEU HB3 H -5.750 1.866 4.533 1.00 . A A . 3 LEU HB3 1 1 1 45 1 1 3 LEU HD11 H -8.175 -0.793 4.215 1.00 . A A . 3 LEU HD11 1 1 1 46 1 1 3 LEU HD12 H -8.655 0.048 2.740 1.00 . A A . 3 LEU HD12 1 1 1 47 1 1 3 LEU HD13 H -9.622 0.214 4.205 1.00 . A A . 3 LEU HD13 1 1 1 48 1 1 3 LEU HD21 H -9.159 2.266 5.565 1.00 . A A . 3 LEU HD21 1 1 1 49 1 1 3 LEU HD22 H -7.461 2.495 5.984 1.00 . A A . 3 LEU HD22 1 1 1 50 1 1 3 LEU HD23 H -8.244 0.944 6.290 1.00 . A A . 3 LEU HD23 1 1 1 51 1 1 3 LEU HG H -7.986 2.107 3.534 1.00 . A A . 3 LEU HG 1 1 1 52 1 1 3 LEU N N -5.946 1.651 1.858 1.00 . A A . 3 LEU N 1 1 1 53 1 1 3 LEU O O -6.461 -1.679 3.144 1.00 . A A . 3 LEU O 1 1 1 54 1 1 4 LYS C C -6.399 -2.646 -0.520 1.00 . A A . 4 LYS C 1 1 1 55 1 1 4 LYS CA C -7.310 -2.010 0.530 1.00 . A A . 4 LYS CA 1 1 1 56 1 1 4 LYS CB C -8.672 -1.689 -0.090 1.00 . A A . 4 LYS CB 1 1 1 57 1 1 4 LYS CD C -10.713 -2.523 -1.294 1.00 . A A . 4 LYS CD 1 1 1 58 1 1 4 LYS CE C -11.410 -3.730 -1.901 1.00 . A A . 4 LYS CE 1 1 1 59 1 1 4 LYS CG C -9.368 -2.898 -0.696 1.00 . A A . 4 LYS CG 1 1 1 60 1 1 4 LYS H H -6.591 -0.019 0.511 1.00 . A A . 4 LYS H 1 1 1 61 1 1 4 LYS HA H -7.449 -2.712 1.336 1.00 . A A . 4 LYS HA 1 1 1 62 1 1 4 LYS HB2 H -9.314 -1.280 0.676 1.00 . A A . 4 LYS HB2 1 1 1 63 1 1 4 LYS HB3 H -8.537 -0.952 -0.866 1.00 . A A . 4 LYS HB3 1 1 1 64 1 1 4 LYS HD2 H -11.340 -2.112 -0.517 1.00 . A A . 4 LYS HD2 1 1 1 65 1 1 4 LYS HD3 H -10.560 -1.783 -2.065 1.00 . A A . 4 LYS HD3 1 1 1 66 1 1 4 LYS HE2 H -10.780 -4.141 -2.676 1.00 . A A . 4 LYS HE2 1 1 1 67 1 1 4 LYS HE3 H -11.558 -4.471 -1.128 1.00 . A A . 4 LYS HE3 1 1 1 68 1 1 4 LYS HG2 H -8.741 -3.309 -1.473 1.00 . A A . 4 LYS HG2 1 1 1 69 1 1 4 LYS HG3 H -9.520 -3.639 0.075 1.00 . A A . 4 LYS HG3 1 1 1 70 1 1 4 LYS HZ1 H -13.481 -3.488 -1.780 1.00 . A A . 4 LYS HZ1 1 1 1 71 1 1 4 LYS HZ2 H -12.938 -3.988 -3.301 1.00 . A A . 4 LYS HZ2 1 1 1 72 1 1 4 LYS HZ3 H -12.721 -2.384 -2.812 1.00 . A A . 4 LYS HZ3 1 1 1 73 1 1 4 LYS N N -6.714 -0.800 1.088 1.00 . A A . 4 LYS N 1 1 1 74 1 1 4 LYS NZ N -12.730 -3.372 -2.490 1.00 . A A . 4 LYS NZ 1 1 1 75 1 1 4 LYS O O -6.570 -3.811 -0.875 1.00 . A A . 4 LYS O 1 1 1 76 1 1 5 GLN C C -3.392 -3.200 -1.381 1.00 . A A . 5 GLN C 1 1 1 77 1 1 5 GLN CA C -4.501 -2.371 -2.019 1.00 . A A . 5 GLN CA 1 1 1 78 1 1 5 GLN CB C -3.897 -1.203 -2.802 1.00 . A A . 5 GLN CB 1 1 1 79 1 1 5 GLN CD C -2.329 -0.459 -4.637 1.00 . A A . 5 GLN CD 1 1 1 80 1 1 5 GLN CG C -2.912 -1.633 -3.877 1.00 . A A . 5 GLN CG 1 1 1 81 1 1 5 GLN H H -5.346 -0.956 -0.692 1.00 . A A . 5 GLN H 1 1 1 82 1 1 5 GLN HA H -5.055 -2.998 -2.697 1.00 . A A . 5 GLN HA 1 1 1 83 1 1 5 GLN HB2 H -4.696 -0.651 -3.277 1.00 . A A . 5 GLN HB2 1 1 1 84 1 1 5 GLN HB3 H -3.382 -0.551 -2.113 1.00 . A A . 5 GLN HB3 1 1 1 85 1 1 5 GLN HE21 H -0.494 -0.967 -4.064 1.00 . A A . 5 GLN HE21 1 1 1 86 1 1 5 GLN HE22 H -0.605 0.435 -5.065 1.00 . A A . 5 GLN HE22 1 1 1 87 1 1 5 GLN HG2 H -2.105 -2.177 -3.411 1.00 . A A . 5 GLN HG2 1 1 1 88 1 1 5 GLN HG3 H -3.422 -2.279 -4.577 1.00 . A A . 5 GLN HG3 1 1 1 89 1 1 5 GLN N N -5.433 -1.876 -1.011 1.00 . A A . 5 GLN N 1 1 1 90 1 1 5 GLN NE2 N -1.009 -0.316 -4.584 1.00 . A A . 5 GLN NE2 1 1 1 91 1 1 5 GLN O O -2.792 -4.056 -2.032 1.00 . A A . 5 GLN O 1 1 1 92 1 1 5 GLN OE1 O -3.054 0.312 -5.266 1.00 . A A . 5 GLN OE1 1 1 1 93 1 1 6 TYR C C -0.729 -3.496 -0.060 1.00 . A A . 6 TYR C 1 1 1 94 1 1 6 TYR CA C -2.087 -3.663 0.620 1.00 . A A . 6 TYR CA 1 1 1 95 1 1 6 TYR CB C -2.438 -5.152 0.718 1.00 . A A . 6 TYR CB 1 1 1 96 1 1 6 TYR CD1 C -4.527 -4.423 1.968 1.00 . A A . 6 TYR CD1 1 1 1 97 1 1 6 TYR CD2 C -4.182 -6.752 1.596 1.00 . A A . 6 TYR CD2 1 1 1 98 1 1 6 TYR CE1 C -5.711 -4.701 2.627 1.00 . A A . 6 TYR CE1 1 1 1 99 1 1 6 TYR CE2 C -5.365 -7.037 2.253 1.00 . A A . 6 TYR CE2 1 1 1 100 1 1 6 TYR CG C -3.742 -5.444 1.440 1.00 . A A . 6 TYR CG 1 1 1 101 1 1 6 TYR CZ C -6.125 -6.008 2.765 1.00 . A A . 6 TYR CZ 1 1 1 102 1 1 6 TYR H H -3.638 -2.247 0.353 1.00 . A A . 6 TYR H 1 1 1 103 1 1 6 TYR HA H -2.030 -3.249 1.615 1.00 . A A . 6 TYR HA 1 1 1 104 1 1 6 TYR HB2 H -2.519 -5.558 -0.278 1.00 . A A . 6 TYR HB2 1 1 1 105 1 1 6 TYR HB3 H -1.647 -5.663 1.244 1.00 . A A . 6 TYR HB3 1 1 1 106 1 1 6 TYR HD1 H -4.203 -3.400 1.860 1.00 . A A . 6 TYR HD1 1 1 1 107 1 1 6 TYR HD2 H -3.586 -7.558 1.193 1.00 . A A . 6 TYR HD2 1 1 1 108 1 1 6 TYR HE1 H -6.307 -3.894 3.028 1.00 . A A . 6 TYR HE1 1 1 1 109 1 1 6 TYR HE2 H -5.688 -8.061 2.363 1.00 . A A . 6 TYR HE2 1 1 1 110 1 1 6 TYR HH H -7.245 -5.979 4.327 1.00 . A A . 6 TYR HH 1 1 1 111 1 1 6 TYR N N -3.125 -2.941 -0.109 1.00 . A A . 6 TYR N 1 1 1 112 1 1 6 TYR O O -0.348 -4.300 -0.910 1.00 . A A . 6 TYR O 1 1 1 113 1 1 6 TYR OH O -7.302 -6.287 3.420 1.00 . A A . 6 TYR OH 1 1 1 114 1 1 7 TRP C C 2.378 -3.039 0.408 1.00 . A A . 7 TRP C 1 1 1 115 1 1 7 TRP CA C 1.307 -2.177 -0.253 1.00 . A A . 7 TRP CA 1 1 1 116 1 1 7 TRP CB C 1.659 -0.696 -0.098 1.00 . A A . 7 TRP CB 1 1 1 117 1 1 7 TRP CD1 C 2.513 -0.719 2.317 1.00 . A A . 7 TRP CD1 1 1 1 118 1 1 7 TRP CD2 C 0.898 0.781 1.928 1.00 . A A . 7 TRP CD2 1 1 1 119 1 1 7 TRP CE2 C 1.276 0.870 3.281 1.00 . A A . 7 TRP CE2 1 1 1 120 1 1 7 TRP CE3 C -0.104 1.632 1.451 1.00 . A A . 7 TRP CE3 1 1 1 121 1 1 7 TRP CG C 1.702 -0.242 1.329 1.00 . A A . 7 TRP CG 1 1 1 122 1 1 7 TRP CH2 C -0.290 2.595 3.667 1.00 . A A . 7 TRP CH2 1 1 1 123 1 1 7 TRP CZ2 C 0.687 1.775 4.161 1.00 . A A . 7 TRP CZ2 1 1 1 124 1 1 7 TRP CZ3 C -0.688 2.529 2.326 1.00 . A A . 7 TRP CZ3 1 1 1 125 1 1 7 TRP H H -0.364 -1.842 1.003 1.00 . A A . 7 TRP H 1 1 1 126 1 1 7 TRP HA H 1.265 -2.419 -1.304 1.00 . A A . 7 TRP HA 1 1 1 127 1 1 7 TRP HB2 H 2.630 -0.517 -0.534 1.00 . A A . 7 TRP HB2 1 1 1 128 1 1 7 TRP HB3 H 0.921 -0.102 -0.616 1.00 . A A . 7 TRP HB3 1 1 1 129 1 1 7 TRP HD1 H 3.240 -1.505 2.181 1.00 . A A . 7 TRP HD1 1 1 1 130 1 1 7 TRP HE1 H 2.718 -0.219 4.348 1.00 . A A . 7 TRP HE1 1 1 1 131 1 1 7 TRP HE3 H -0.423 1.596 0.420 1.00 . A A . 7 TRP HE3 1 1 1 132 1 1 7 TRP HH2 H -0.775 3.311 4.315 1.00 . A A . 7 TRP HH2 1 1 1 133 1 1 7 TRP HZ2 H 0.982 1.838 5.198 1.00 . A A . 7 TRP HZ2 1 1 1 134 1 1 7 TRP HZ3 H -1.463 3.193 1.975 1.00 . A A . 7 TRP HZ3 1 1 1 135 1 1 7 TRP N N -0.007 -2.448 0.321 1.00 . A A . 7 TRP N 1 1 1 136 1 1 7 TRP NE1 N 2.263 -0.056 3.495 1.00 . A A . 7 TRP NE1 1 1 1 137 1 1 7 TRP O O 2.118 -3.717 1.402 1.00 . A A . 7 TRP O 1 1 1 138 1 1 8 TRP C C 5.938 -2.893 0.504 1.00 . A A . 8 TRP C 1 1 1 139 1 1 8 TRP CA C 4.695 -3.783 0.384 1.00 . A A . 8 TRP CA 1 1 1 140 1 1 8 TRP CB C 4.966 -4.990 -0.523 1.00 . A A . 8 TRP CB 1 1 1 141 1 1 8 TRP CD1 C 6.525 -7.009 -0.720 1.00 . A A . 8 TRP CD1 1 1 1 142 1 1 8 TRP CD2 C 6.818 -5.843 1.174 1.00 . A A . 8 TRP CD2 1 1 1 143 1 1 8 TRP CE2 C 7.731 -6.920 1.155 1.00 . A A . 8 TRP CE2 1 1 1 144 1 1 8 TRP CE3 C 6.825 -4.986 2.284 1.00 . A A . 8 TRP CE3 1 1 1 145 1 1 8 TRP CG C 6.076 -5.900 -0.061 1.00 . A A . 8 TRP CG 1 1 1 146 1 1 8 TRP CH2 C 8.605 -6.306 3.261 1.00 . A A . 8 TRP CH2 1 1 1 147 1 1 8 TRP CZ2 C 8.627 -7.159 2.193 1.00 . A A . 8 TRP CZ2 1 1 1 148 1 1 8 TRP CZ3 C 7.713 -5.230 3.314 1.00 . A A . 8 TRP CZ3 1 1 1 149 1 1 8 TRP H H 3.729 -2.445 -0.941 1.00 . A A . 8 TRP H 1 1 1 150 1 1 8 TRP HA H 4.421 -4.130 1.365 1.00 . A A . 8 TRP HA 1 1 1 151 1 1 8 TRP HB2 H 4.067 -5.583 -0.585 1.00 . A A . 8 TRP HB2 1 1 1 152 1 1 8 TRP HB3 H 5.217 -4.635 -1.512 1.00 . A A . 8 TRP HB3 1 1 1 153 1 1 8 TRP HD1 H 6.154 -7.335 -1.680 1.00 . A A . 8 TRP HD1 1 1 1 154 1 1 8 TRP HE1 H 8.033 -8.403 -0.293 1.00 . A A . 8 TRP HE1 1 1 1 155 1 1 8 TRP HE3 H 6.144 -4.155 2.352 1.00 . A A . 8 TRP HE3 1 1 1 156 1 1 8 TRP HH2 H 9.282 -6.458 4.089 1.00 . A A . 8 TRP HH2 1 1 1 157 1 1 8 TRP HZ2 H 9.323 -7.985 2.169 1.00 . A A . 8 TRP HZ2 1 1 1 158 1 1 8 TRP HZ3 H 7.727 -4.579 4.175 1.00 . A A . 8 TRP HZ3 1 1 1 159 1 1 8 TRP N N 3.584 -3.006 -0.150 1.00 . A A . 8 TRP N 1 1 1 160 1 1 8 TRP NE1 N 7.537 -7.607 -0.012 1.00 . A A . 8 TRP NE1 1 1 1 161 1 1 8 TRP O O 6.067 -2.127 1.458 1.00 . A A . 8 TRP O 1 1 1 162 1 1 9 ARG C C 7.752 -0.701 -0.586 1.00 . A A . 9 ARG C 1 1 1 163 1 1 9 ARG CA C 8.065 -2.192 -0.448 1.00 . A A . 9 ARG CA 1 1 1 164 1 1 9 ARG CB C 9.010 -2.639 -1.566 1.00 . A A . 9 ARG CB 1 1 1 165 1 1 9 ARG CD C 10.168 -4.360 -0.147 1.00 . A A . 9 ARG CD 1 1 1 166 1 1 9 ARG CG C 9.438 -4.093 -1.454 1.00 . A A . 9 ARG CG 1 1 1 167 1 1 9 ARG CZ C 11.241 -6.244 1.022 1.00 . A A . 9 ARG CZ 1 1 1 168 1 1 9 ARG H H 6.696 -3.614 -1.198 1.00 . A A . 9 ARG H 1 1 1 169 1 1 9 ARG HA H 8.551 -2.354 0.502 1.00 . A A . 9 ARG HA 1 1 1 170 1 1 9 ARG HB2 H 8.517 -2.504 -2.515 1.00 . A A . 9 ARG HB2 1 1 1 171 1 1 9 ARG HB3 H 9.896 -2.022 -1.540 1.00 . A A . 9 ARG HB3 1 1 1 172 1 1 9 ARG HD2 H 11.042 -3.727 -0.103 1.00 . A A . 9 ARG HD2 1 1 1 173 1 1 9 ARG HD3 H 9.509 -4.118 0.674 1.00 . A A . 9 ARG HD3 1 1 1 174 1 1 9 ARG HE H 10.362 -6.358 -0.766 1.00 . A A . 9 ARG HE 1 1 1 175 1 1 9 ARG HG2 H 8.561 -4.721 -1.499 1.00 . A A . 9 ARG HG2 1 1 1 176 1 1 9 ARG HG3 H 10.095 -4.329 -2.278 1.00 . A A . 9 ARG HG3 1 1 1 177 1 1 9 ARG HH11 H 11.308 -4.488 2.024 1.00 . A A . 9 ARG HH11 1 1 1 178 1 1 9 ARG HH12 H 12.054 -5.830 2.826 1.00 . A A . 9 ARG HH12 1 1 1 179 1 1 9 ARG HH21 H 11.342 -8.124 0.287 1.00 . A A . 9 ARG HH21 1 1 1 180 1 1 9 ARG HH22 H 12.074 -7.894 1.840 1.00 . A A . 9 ARG HH22 1 1 1 181 1 1 9 ARG N N 6.847 -2.992 -0.461 1.00 . A A . 9 ARG N 1 1 1 182 1 1 9 ARG NE N 10.585 -5.755 -0.027 1.00 . A A . 9 ARG NE 1 1 1 183 1 1 9 ARG NH1 N 11.561 -5.456 2.041 1.00 . A A . 9 ARG NH1 1 1 1 184 1 1 9 ARG NH2 N 11.581 -7.526 1.052 1.00 . A A . 9 ARG NH2 1 1 1 185 1 1 9 ARG O O 8.225 0.111 0.208 1.00 . A A . 9 ARG O 1 1 1 186 1 1 10 PRO C C 5.613 1.609 -0.766 1.00 . A A . 10 PRO C 1 1 1 187 1 1 10 PRO CA C 6.591 1.092 -1.816 1.00 . A A . 10 PRO CA 1 1 1 188 1 1 10 PRO CB C 5.936 1.081 -3.197 1.00 . A A . 10 PRO CB 1 1 1 189 1 1 10 PRO CD C 6.331 -1.201 -2.604 1.00 . A A . 10 PRO CD 1 1 1 190 1 1 10 PRO CG C 5.384 -0.293 -3.340 1.00 . A A . 10 PRO CG 1 1 1 191 1 1 10 PRO HA H 7.466 1.725 -1.833 1.00 . A A . 10 PRO HA 1 1 1 192 1 1 10 PRO HB2 H 5.157 1.828 -3.235 1.00 . A A . 10 PRO HB2 1 1 1 193 1 1 10 PRO HB3 H 6.679 1.287 -3.952 1.00 . A A . 10 PRO HB3 1 1 1 194 1 1 10 PRO HD2 H 5.787 -2.004 -2.130 1.00 . A A . 10 PRO HD2 1 1 1 195 1 1 10 PRO HD3 H 7.075 -1.594 -3.281 1.00 . A A . 10 PRO HD3 1 1 1 196 1 1 10 PRO HG2 H 4.399 -0.340 -2.898 1.00 . A A . 10 PRO HG2 1 1 1 197 1 1 10 PRO HG3 H 5.340 -0.564 -4.384 1.00 . A A . 10 PRO HG3 1 1 1 198 1 1 10 PRO N N 6.949 -0.313 -1.597 1.00 . A A . 10 PRO N 1 1 1 199 1 1 10 PRO O O 4.400 1.610 -0.980 1.00 . A A . 10 PRO O 1 1 1 200 1 1 11 SER C C 5.710 4.005 1.789 1.00 . A A . 11 SER C 1 1 1 201 1 1 11 SER CA C 5.321 2.569 1.452 1.00 . A A . 11 SER CA 1 1 1 202 1 1 11 SER CB C 5.459 1.687 2.695 1.00 . A A . 11 SER CB 1 1 1 203 1 1 11 SER H H 7.121 2.022 0.480 1.00 . A A . 11 SER H 1 1 1 204 1 1 11 SER HA H 4.293 2.554 1.123 1.00 . A A . 11 SER HA 1 1 1 205 1 1 11 SER HB2 H 6.491 1.674 3.013 1.00 . A A . 11 SER HB2 1 1 1 206 1 1 11 SER HB3 H 4.843 2.086 3.487 1.00 . A A . 11 SER HB3 1 1 1 207 1 1 11 SER HG H 5.563 -0.252 2.961 1.00 . A A . 11 SER HG 1 1 1 208 1 1 11 SER N N 6.147 2.048 0.369 1.00 . A A . 11 SER N 1 1 1 209 1 1 11 SER O O 6.856 4.283 2.138 1.00 . A A . 11 SER O 1 1 1 210 1 1 11 SER OG O 5.049 0.357 2.425 1.00 . A A . 11 SER OG 1 1 1 211 1 1 12 ILE C C 4.317 6.724 3.287 1.00 . A A . 12 ILE C 1 1 1 212 1 1 12 ILE CA C 4.985 6.321 1.975 1.00 . A A . 12 ILE CA 1 1 1 213 1 1 12 ILE CB C 4.465 7.227 0.839 1.00 . A A . 12 ILE CB 1 1 1 214 1 1 12 ILE CD1 C 6.669 7.059 -0.424 1.00 . A A . 12 ILE CD1 1 1 1 215 1 1 12 ILE CG1 C 5.167 6.882 -0.476 1.00 . A A . 12 ILE CG1 1 1 1 216 1 1 12 ILE CG2 C 4.674 8.695 1.183 1.00 . A A . 12 ILE CG2 1 1 1 217 1 1 12 ILE H H 3.851 4.630 1.399 1.00 . A A . 12 ILE H 1 1 1 218 1 1 12 ILE HA H 6.053 6.466 2.066 1.00 . A A . 12 ILE HA 1 1 1 219 1 1 12 ILE HB H 3.405 7.055 0.729 1.00 . A A . 12 ILE HB 1 1 1 220 1 1 12 ILE HD11 H 7.124 6.163 -0.028 1.00 . A A . 12 ILE HD11 1 1 1 221 1 1 12 ILE HD12 H 6.911 7.896 0.214 1.00 . A A . 12 ILE HD12 1 1 1 222 1 1 12 ILE HD13 H 7.045 7.245 -1.419 1.00 . A A . 12 ILE HD13 1 1 1 223 1 1 12 ILE HG12 H 4.964 5.852 -0.727 1.00 . A A . 12 ILE HG12 1 1 1 224 1 1 12 ILE HG13 H 4.784 7.521 -1.258 1.00 . A A . 12 ILE HG13 1 1 1 225 1 1 12 ILE HG21 H 5.689 8.845 1.520 1.00 . A A . 12 ILE HG21 1 1 1 226 1 1 12 ILE HG22 H 3.989 8.982 1.967 1.00 . A A . 12 ILE HG22 1 1 1 227 1 1 12 ILE HG23 H 4.494 9.300 0.308 1.00 . A A . 12 ILE HG23 1 1 1 228 1 1 12 ILE N N 4.745 4.914 1.682 1.00 . A A . 12 ILE N 1 1 1 229 1 1 12 ILE O O 4.752 7.732 3.886 1.00 . A A . 12 ILE O 1 1 1 230 1 1 12 ILE OXT O 3.366 6.031 3.705 1.00 . A A . 12 ILE OXT 1 1 2 231 1 1 1 HIS C C -4.394 4.793 -1.436 1.00 . A A . 1 HIS C 1 1 2 232 1 1 1 HIS CA C -3.450 5.944 -1.781 1.00 . A A . 1 HIS CA 1 1 2 233 1 1 1 HIS CB C -3.504 7.015 -0.686 1.00 . A A . 1 HIS CB 1 1 2 234 1 1 1 HIS CD2 C -2.804 9.484 -1.068 1.00 . A A . 1 HIS CD2 1 1 2 235 1 1 1 HIS CE1 C -0.636 9.185 -1.212 1.00 . A A . 1 HIS CE1 1 1 2 236 1 1 1 HIS CG C -2.565 8.160 -0.915 1.00 . A A . 1 HIS CG 1 1 2 237 1 1 1 HIS H1 H -4.852 6.612 -3.132 1.00 . A A . 1 HIS H1 1 1 2 238 1 1 1 HIS H2 H -3.426 5.972 -3.838 1.00 . A A . 1 HIS H2 1 1 2 239 1 1 1 HIS H3 H -3.401 7.522 -3.106 1.00 . A A . 1 HIS H3 1 1 2 240 1 1 1 HIS HA H -2.443 5.563 -1.854 1.00 . A A . 1 HIS HA 1 1 2 241 1 1 1 HIS HB2 H -4.505 7.415 -0.633 1.00 . A A . 1 HIS HB2 1 1 2 242 1 1 1 HIS HB3 H -3.252 6.563 0.262 1.00 . A A . 1 HIS HB3 1 1 2 243 1 1 1 HIS HD1 H -0.712 7.157 -0.941 1.00 . A A . 1 HIS HD1 1 1 2 244 1 1 1 HIS HD2 H -3.771 9.969 -1.049 1.00 . A A . 1 HIS HD2 1 1 2 245 1 1 1 HIS HE1 H 0.421 9.370 -1.325 1.00 . A A . 1 HIS HE1 1 1 2 246 1 1 1 HIS HE2 H -1.456 11.042 -1.478 1.00 . A A . 1 HIS HE2 1 1 2 247 1 1 1 HIS N N -3.815 6.570 -3.081 1.00 . A A . 1 HIS N 1 1 2 248 1 1 1 HIS ND1 N -1.198 8.005 -1.012 1.00 . A A . 1 HIS ND1 1 1 2 249 1 1 1 HIS NE2 N -1.589 10.098 -1.251 1.00 . A A . 1 HIS NE2 1 1 2 250 1 1 1 HIS O O -5.188 4.888 -0.499 1.00 . A A . 1 HIS O 1 1 2 251 1 1 2 PRO C C -4.808 1.775 -0.675 1.00 . A A . 2 PRO C 1 1 2 252 1 1 2 PRO CA C -5.174 2.512 -1.959 1.00 . A A . 2 PRO CA 1 1 2 253 1 1 2 PRO CB C -4.905 1.628 -3.178 1.00 . A A . 2 PRO CB 1 1 2 254 1 1 2 PRO CD C -3.405 3.480 -3.330 1.00 . A A . 2 PRO CD 1 1 2 255 1 1 2 PRO CG C -3.539 2.013 -3.628 1.00 . A A . 2 PRO CG 1 1 2 256 1 1 2 PRO HA H -6.219 2.783 -1.930 1.00 . A A . 2 PRO HA 1 1 2 257 1 1 2 PRO HB2 H -4.949 0.588 -2.888 1.00 . A A . 2 PRO HB2 1 1 2 258 1 1 2 PRO HB3 H -5.642 1.827 -3.941 1.00 . A A . 2 PRO HB3 1 1 2 259 1 1 2 PRO HD2 H -2.387 3.719 -3.053 1.00 . A A . 2 PRO HD2 1 1 2 260 1 1 2 PRO HD3 H -3.713 4.068 -4.181 1.00 . A A . 2 PRO HD3 1 1 2 261 1 1 2 PRO HG2 H -2.798 1.449 -3.079 1.00 . A A . 2 PRO HG2 1 1 2 262 1 1 2 PRO HG3 H -3.437 1.835 -4.688 1.00 . A A . 2 PRO HG3 1 1 2 263 1 1 2 PRO N N -4.321 3.683 -2.191 1.00 . A A . 2 PRO N 1 1 2 264 1 1 2 PRO O O -3.878 0.968 -0.655 1.00 . A A . 2 PRO O 1 1 2 265 1 1 3 LEU C C -5.766 -0.035 1.690 1.00 . A A . 3 LEU C 1 1 2 266 1 1 3 LEU CA C -5.298 1.420 1.683 1.00 . A A . 3 LEU CA 1 1 2 267 1 1 3 LEU CB C -5.976 2.215 2.805 1.00 . A A . 3 LEU CB 1 1 2 268 1 1 3 LEU CD1 C -8.196 1.020 2.700 1.00 . A A . 3 LEU CD1 1 1 2 269 1 1 3 LEU CD2 C -8.028 3.257 3.804 1.00 . A A . 3 LEU CD2 1 1 2 270 1 1 3 LEU CG C -7.496 2.371 2.687 1.00 . A A . 3 LEU CG 1 1 2 271 1 1 3 LEU H H -6.273 2.708 0.316 1.00 . A A . 3 LEU H 1 1 2 272 1 1 3 LEU HA H -4.234 1.434 1.849 1.00 . A A . 3 LEU HA 1 1 2 273 1 1 3 LEU HB2 H -5.760 1.724 3.743 1.00 . A A . 3 LEU HB2 1 1 2 274 1 1 3 LEU HB3 H -5.539 3.202 2.829 1.00 . A A . 3 LEU HB3 1 1 2 275 1 1 3 LEU HD11 H -8.286 0.652 1.689 1.00 . A A . 3 LEU HD11 1 1 2 276 1 1 3 LEU HD12 H -9.180 1.128 3.131 1.00 . A A . 3 LEU HD12 1 1 2 277 1 1 3 LEU HD13 H -7.620 0.321 3.289 1.00 . A A . 3 LEU HD13 1 1 2 278 1 1 3 LEU HD21 H -9.087 3.087 3.923 1.00 . A A . 3 LEU HD21 1 1 2 279 1 1 3 LEU HD22 H -7.854 4.293 3.554 1.00 . A A . 3 LEU HD22 1 1 2 280 1 1 3 LEU HD23 H -7.518 3.018 4.726 1.00 . A A . 3 LEU HD23 1 1 2 281 1 1 3 LEU HG H -7.720 2.850 1.747 1.00 . A A . 3 LEU HG 1 1 2 282 1 1 3 LEU N N -5.545 2.057 0.395 1.00 . A A . 3 LEU N 1 1 2 283 1 1 3 LEU O O -5.455 -0.790 2.611 1.00 . A A . 3 LEU O 1 1 2 284 1 1 4 LYS C C -6.120 -2.651 -0.318 1.00 . A A . 4 LYS C 1 1 2 285 1 1 4 LYS CA C -7.024 -1.787 0.558 1.00 . A A . 4 LYS CA 1 1 2 286 1 1 4 LYS CB C -8.445 -1.778 -0.008 1.00 . A A . 4 LYS CB 1 1 2 287 1 1 4 LYS CD C -10.464 -3.095 -0.716 1.00 . A A . 4 LYS CD 1 1 2 288 1 1 4 LYS CE C -11.076 -4.480 -0.859 1.00 . A A . 4 LYS CE 1 1 2 289 1 1 4 LYS CG C -9.056 -3.164 -0.150 1.00 . A A . 4 LYS CG 1 1 2 290 1 1 4 LYS H H -6.734 0.220 -0.043 1.00 . A A . 4 LYS H 1 1 2 291 1 1 4 LYS HA H -7.046 -2.206 1.550 1.00 . A A . 4 LYS HA 1 1 2 292 1 1 4 LYS HB2 H -9.077 -1.196 0.647 1.00 . A A . 4 LYS HB2 1 1 2 293 1 1 4 LYS HB3 H -8.429 -1.315 -0.984 1.00 . A A . 4 LYS HB3 1 1 2 294 1 1 4 LYS HD2 H -11.081 -2.507 -0.053 1.00 . A A . 4 LYS HD2 1 1 2 295 1 1 4 LYS HD3 H -10.429 -2.626 -1.688 1.00 . A A . 4 LYS HD3 1 1 2 296 1 1 4 LYS HE2 H -10.455 -5.067 -1.520 1.00 . A A . 4 LYS HE2 1 1 2 297 1 1 4 LYS HE3 H -11.106 -4.948 0.115 1.00 . A A . 4 LYS HE3 1 1 2 298 1 1 4 LYS HG2 H -8.440 -3.752 -0.813 1.00 . A A . 4 LYS HG2 1 1 2 299 1 1 4 LYS HG3 H -9.090 -3.632 0.823 1.00 . A A . 4 LYS HG3 1 1 2 300 1 1 4 LYS HZ1 H -12.787 -5.383 -1.645 1.00 . A A . 4 LYS HZ1 1 1 2 301 1 1 4 LYS HZ2 H -12.471 -3.847 -2.277 1.00 . A A . 4 LYS HZ2 1 1 2 302 1 1 4 LYS HZ3 H -13.104 -4.003 -0.717 1.00 . A A . 4 LYS HZ3 1 1 2 303 1 1 4 LYS N N -6.516 -0.424 0.662 1.00 . A A . 4 LYS N 1 1 2 304 1 1 4 LYS NZ N -12.456 -4.424 -1.414 1.00 . A A . 4 LYS NZ 1 1 2 305 1 1 4 LYS O O -6.165 -3.879 -0.250 1.00 . A A . 4 LYS O 1 1 2 306 1 1 5 GLN C C -3.312 -3.447 -1.237 1.00 . A A . 5 GLN C 1 1 2 307 1 1 5 GLN CA C -4.391 -2.714 -2.029 1.00 . A A . 5 GLN CA 1 1 2 308 1 1 5 GLN CB C -3.745 -1.742 -3.017 1.00 . A A . 5 GLN CB 1 1 2 309 1 1 5 GLN CD C -2.152 -1.425 -4.951 1.00 . A A . 5 GLN CD 1 1 2 310 1 1 5 GLN CG C -2.779 -2.408 -3.983 1.00 . A A . 5 GLN CG 1 1 2 311 1 1 5 GLN H H -5.313 -1.025 -1.149 1.00 . A A . 5 GLN H 1 1 2 312 1 1 5 GLN HA H -4.968 -3.440 -2.577 1.00 . A A . 5 GLN HA 1 1 2 313 1 1 5 GLN HB2 H -4.524 -1.262 -3.593 1.00 . A A . 5 GLN HB2 1 1 2 314 1 1 5 GLN HB3 H -3.205 -0.989 -2.463 1.00 . A A . 5 GLN HB3 1 1 2 315 1 1 5 GLN HE21 H -0.337 -1.882 -4.279 1.00 . A A . 5 GLN HE21 1 1 2 316 1 1 5 GLN HE22 H -0.396 -0.695 -5.533 1.00 . A A . 5 GLN HE22 1 1 2 317 1 1 5 GLN HG2 H -1.992 -2.881 -3.414 1.00 . A A . 5 GLN HG2 1 1 2 318 1 1 5 GLN HG3 H -3.313 -3.157 -4.548 1.00 . A A . 5 GLN HG3 1 1 2 319 1 1 5 GLN N N -5.303 -2.003 -1.139 1.00 . A A . 5 GLN N 1 1 2 320 1 1 5 GLN NE2 N -0.828 -1.324 -4.918 1.00 . A A . 5 GLN NE2 1 1 2 321 1 1 5 GLN O O -2.720 -4.411 -1.722 1.00 . A A . 5 GLN O 1 1 2 322 1 1 5 GLN OE1 O -2.848 -0.764 -5.721 1.00 . A A . 5 GLN OE1 1 1 2 323 1 1 6 TYR C C -0.672 -3.536 0.178 1.00 . A A . 6 TYR C 1 1 2 324 1 1 6 TYR CA C -2.048 -3.593 0.837 1.00 . A A . 6 TYR CA 1 1 2 325 1 1 6 TYR CB C -2.419 -5.048 1.146 1.00 . A A . 6 TYR CB 1 1 2 326 1 1 6 TYR CD1 C -4.532 -4.124 2.213 1.00 . A A . 6 TYR CD1 1 1 2 327 1 1 6 TYR CD2 C -4.205 -6.486 2.202 1.00 . A A . 6 TYR CD2 1 1 2 328 1 1 6 TYR CE1 C -5.736 -4.290 2.871 1.00 . A A . 6 TYR CE1 1 1 2 329 1 1 6 TYR CE2 C -5.408 -6.659 2.860 1.00 . A A . 6 TYR CE2 1 1 2 330 1 1 6 TYR CG C -3.745 -5.218 1.866 1.00 . A A . 6 TYR CG 1 1 2 331 1 1 6 TYR CZ C -6.169 -5.559 3.192 1.00 . A A . 6 TYR CZ 1 1 2 332 1 1 6 TYR H H -3.561 -2.211 0.310 1.00 . A A . 6 TYR H 1 1 2 333 1 1 6 TYR HA H -2.015 -3.036 1.760 1.00 . A A . 6 TYR HA 1 1 2 334 1 1 6 TYR HB2 H -2.477 -5.598 0.219 1.00 . A A . 6 TYR HB2 1 1 2 335 1 1 6 TYR HB3 H -1.648 -5.481 1.765 1.00 . A A . 6 TYR HB3 1 1 2 336 1 1 6 TYR HD1 H -4.192 -3.130 1.962 1.00 . A A . 6 TYR HD1 1 1 2 337 1 1 6 TYR HD2 H -3.608 -7.347 1.942 1.00 . A A . 6 TYR HD2 1 1 2 338 1 1 6 TYR HE1 H -6.333 -3.428 3.131 1.00 . A A . 6 TYR HE1 1 1 2 339 1 1 6 TYR HE2 H -5.747 -7.653 3.113 1.00 . A A . 6 TYR HE2 1 1 2 340 1 1 6 TYR HH H -7.272 -6.407 4.519 1.00 . A A . 6 TYR HH 1 1 2 341 1 1 6 TYR N N -3.058 -2.982 -0.020 1.00 . A A . 6 TYR N 1 1 2 342 1 1 6 TYR O O -0.164 -4.544 -0.312 1.00 . A A . 6 TYR O 1 1 2 343 1 1 6 TYR OH O -7.368 -5.727 3.848 1.00 . A A . 6 TYR OH 1 1 2 344 1 1 7 TRP C C 2.286 -3.027 0.265 1.00 . A A . 7 TRP C 1 1 2 345 1 1 7 TRP CA C 1.241 -2.159 -0.429 1.00 . A A . 7 TRP CA 1 1 2 346 1 1 7 TRP CB C 1.652 -0.688 -0.353 1.00 . A A . 7 TRP CB 1 1 2 347 1 1 7 TRP CD1 C 2.531 -0.623 2.053 1.00 . A A . 7 TRP CD1 1 1 2 348 1 1 7 TRP CD2 C 0.972 0.919 1.601 1.00 . A A . 7 TRP CD2 1 1 2 349 1 1 7 TRP CE2 C 1.367 1.061 2.945 1.00 . A A . 7 TRP CE2 1 1 2 350 1 1 7 TRP CE3 C -0.001 1.783 1.091 1.00 . A A . 7 TRP CE3 1 1 2 351 1 1 7 TRP CG C 1.729 -0.164 1.048 1.00 . A A . 7 TRP CG 1 1 2 352 1 1 7 TRP CH2 C -0.126 2.864 3.256 1.00 . A A . 7 TRP CH2 1 1 2 353 1 1 7 TRP CZ2 C 0.824 2.032 3.782 1.00 . A A . 7 TRP CZ2 1 1 2 354 1 1 7 TRP CZ3 C -0.539 2.746 1.923 1.00 . A A . 7 TRP CZ3 1 1 2 355 1 1 7 TRP H H -0.531 -1.582 0.575 1.00 . A A . 7 TRP H 1 1 2 356 1 1 7 TRP HA H 1.178 -2.453 -1.466 1.00 . A A . 7 TRP HA 1 1 2 357 1 1 7 TRP HB2 H 2.625 -0.569 -0.807 1.00 . A A . 7 TRP HB2 1 1 2 358 1 1 7 TRP HB3 H 0.932 -0.092 -0.895 1.00 . A A . 7 TRP HB3 1 1 2 359 1 1 7 TRP HD1 H 3.225 -1.444 1.949 1.00 . A A . 7 TRP HD1 1 1 2 360 1 1 7 TRP HE1 H 2.777 -0.030 4.052 1.00 . A A . 7 TRP HE1 1 1 2 361 1 1 7 TRP HE3 H -0.331 1.708 0.065 1.00 . A A . 7 TRP HE3 1 1 2 362 1 1 7 TRP HH2 H -0.574 3.630 3.870 1.00 . A A . 7 TRP HH2 1 1 2 363 1 1 7 TRP HZ2 H 1.132 2.135 4.812 1.00 . A A . 7 TRP HZ2 1 1 2 364 1 1 7 TRP HZ3 H -1.292 3.422 1.546 1.00 . A A . 7 TRP HZ3 1 1 2 365 1 1 7 TRP N N -0.075 -2.349 0.170 1.00 . A A . 7 TRP N 1 1 2 366 1 1 7 TRP NE1 N 2.319 0.108 3.197 1.00 . A A . 7 TRP NE1 1 1 2 367 1 1 7 TRP O O 1.987 -3.720 1.236 1.00 . A A . 7 TRP O 1 1 2 368 1 1 8 TRP C C 5.874 -2.900 0.386 1.00 . A A . 8 TRP C 1 1 2 369 1 1 8 TRP CA C 4.606 -3.758 0.330 1.00 . A A . 8 TRP CA 1 1 2 370 1 1 8 TRP CB C 4.835 -5.023 -0.508 1.00 . A A . 8 TRP CB 1 1 2 371 1 1 8 TRP CD1 C 6.332 -7.095 -0.600 1.00 . A A . 8 TRP CD1 1 1 2 372 1 1 8 TRP CD2 C 6.669 -5.838 1.226 1.00 . A A . 8 TRP CD2 1 1 2 373 1 1 8 TRP CE2 C 7.549 -6.940 1.263 1.00 . A A . 8 TRP CE2 1 1 2 374 1 1 8 TRP CE3 C 6.705 -4.923 2.287 1.00 . A A . 8 TRP CE3 1 1 2 375 1 1 8 TRP CG C 5.920 -5.938 -0.002 1.00 . A A . 8 TRP CG 1 1 2 376 1 1 8 TRP CH2 C 8.452 -6.240 3.329 1.00 . A A . 8 TRP CH2 1 1 2 377 1 1 8 TRP CZ2 C 8.444 -7.149 2.309 1.00 . A A . 8 TRP CZ2 1 1 2 378 1 1 8 TRP CZ3 C 7.591 -5.137 3.326 1.00 . A A . 8 TRP CZ3 1 1 2 379 1 1 8 TRP H H 3.690 -2.407 -1.016 1.00 . A A . 8 TRP H 1 1 2 380 1 1 8 TRP HA H 4.332 -4.041 1.330 1.00 . A A . 8 TRP HA 1 1 2 381 1 1 8 TRP HB2 H 3.918 -5.591 -0.532 1.00 . A A . 8 TRP HB2 1 1 2 382 1 1 8 TRP HB3 H 5.089 -4.733 -1.517 1.00 . A A . 8 TRP HB3 1 1 2 383 1 1 8 TRP HD1 H 5.946 -7.463 -1.539 1.00 . A A . 8 TRP HD1 1 1 2 384 1 1 8 TRP HE1 H 7.801 -8.508 -0.104 1.00 . A A . 8 TRP HE1 1 1 2 385 1 1 8 TRP HE3 H 6.049 -4.070 2.313 1.00 . A A . 8 TRP HE3 1 1 2 386 1 1 8 TRP HH2 H 9.127 -6.367 4.162 1.00 . A A . 8 TRP HH2 1 1 2 387 1 1 8 TRP HZ2 H 9.115 -7.996 2.327 1.00 . A A . 8 TRP HZ2 1 1 2 388 1 1 8 TRP HZ3 H 7.628 -4.442 4.152 1.00 . A A . 8 TRP HZ3 1 1 2 389 1 1 8 TRP N N 3.514 -2.980 -0.241 1.00 . A A . 8 TRP N 1 1 2 390 1 1 8 TRP NE1 N 7.329 -7.683 0.135 1.00 . A A . 8 TRP NE1 1 1 2 391 1 1 8 TRP O O 6.070 -2.134 1.329 1.00 . A A . 8 TRP O 1 1 2 392 1 1 9 ARG C C 7.682 -0.749 -0.638 1.00 . A A . 9 ARG C 1 1 2 393 1 1 9 ARG CA C 7.963 -2.253 -0.679 1.00 . A A . 9 ARG CA 1 1 2 394 1 1 9 ARG CB C 8.760 -2.606 -1.937 1.00 . A A . 9 ARG CB 1 1 2 395 1 1 9 ARG CD C 10.019 -4.482 -0.837 1.00 . A A . 9 ARG CD 1 1 2 396 1 1 9 ARG CG C 9.153 -4.071 -2.017 1.00 . A A . 9 ARG CG 1 1 2 397 1 1 9 ARG CZ C 11.159 -6.496 0.009 1.00 . A A . 9 ARG CZ 1 1 2 398 1 1 9 ARG H H 6.520 -3.642 -1.349 1.00 . A A . 9 ARG H 1 1 2 399 1 1 9 ARG HA H 8.550 -2.515 0.189 1.00 . A A . 9 ARG HA 1 1 2 400 1 1 9 ARG HB2 H 8.166 -2.367 -2.806 1.00 . A A . 9 ARG HB2 1 1 2 401 1 1 9 ARG HB3 H 9.663 -2.013 -1.956 1.00 . A A . 9 ARG HB3 1 1 2 402 1 1 9 ARG HD2 H 10.912 -3.875 -0.834 1.00 . A A . 9 ARG HD2 1 1 2 403 1 1 9 ARG HD3 H 9.466 -4.312 0.075 1.00 . A A . 9 ARG HD3 1 1 2 404 1 1 9 ARG HE H 10.080 -6.412 -1.667 1.00 . A A . 9 ARG HE 1 1 2 405 1 1 9 ARG HG2 H 8.257 -4.675 -2.020 1.00 . A A . 9 ARG HG2 1 1 2 406 1 1 9 ARG HG3 H 9.703 -4.237 -2.932 1.00 . A A . 9 ARG HG3 1 1 2 407 1 1 9 ARG HH11 H 11.390 -4.852 1.166 1.00 . A A . 9 ARG HH11 1 1 2 408 1 1 9 ARG HH12 H 12.183 -6.281 1.739 1.00 . A A . 9 ARG HH12 1 1 2 409 1 1 9 ARG HH21 H 11.121 -8.293 -0.916 1.00 . A A . 9 ARG HH21 1 1 2 410 1 1 9 ARG HH22 H 12.031 -8.235 0.557 1.00 . A A . 9 ARG HH22 1 1 2 411 1 1 9 ARG N N 6.727 -3.023 -0.625 1.00 . A A . 9 ARG N 1 1 2 412 1 1 9 ARG NE N 10.402 -5.890 -0.903 1.00 . A A . 9 ARG NE 1 1 2 413 1 1 9 ARG NH1 N 11.615 -5.821 1.057 1.00 . A A . 9 ARG NH1 1 1 2 414 1 1 9 ARG NH2 N 11.462 -7.779 -0.127 1.00 . A A . 9 ARG NH2 1 1 2 415 1 1 9 ARG O O 8.297 -0.021 0.142 1.00 . A A . 9 ARG O 1 1 2 416 1 1 10 PRO C C 5.494 1.578 -0.363 1.00 . A A . 10 PRO C 1 1 2 417 1 1 10 PRO CA C 6.407 1.169 -1.515 1.00 . A A . 10 PRO CA 1 1 2 418 1 1 10 PRO CB C 5.683 1.312 -2.851 1.00 . A A . 10 PRO CB 1 1 2 419 1 1 10 PRO CD C 5.956 -1.036 -2.450 1.00 . A A . 10 PRO CD 1 1 2 420 1 1 10 PRO CG C 5.037 -0.012 -3.067 1.00 . A A . 10 PRO CG 1 1 2 421 1 1 10 PRO HA H 7.291 1.790 -1.512 1.00 . A A . 10 PRO HA 1 1 2 422 1 1 10 PRO HB2 H 4.951 2.104 -2.785 1.00 . A A . 10 PRO HB2 1 1 2 423 1 1 10 PRO HB3 H 6.396 1.535 -3.630 1.00 . A A . 10 PRO HB3 1 1 2 424 1 1 10 PRO HD2 H 5.379 -1.802 -1.953 1.00 . A A . 10 PRO HD2 1 1 2 425 1 1 10 PRO HD3 H 6.591 -1.471 -3.204 1.00 . A A . 10 PRO HD3 1 1 2 426 1 1 10 PRO HG2 H 4.073 -0.033 -2.582 1.00 . A A . 10 PRO HG2 1 1 2 427 1 1 10 PRO HG3 H 4.929 -0.198 -4.126 1.00 . A A . 10 PRO HG3 1 1 2 428 1 1 10 PRO N N 6.749 -0.255 -1.476 1.00 . A A . 10 PRO N 1 1 2 429 1 1 10 PRO O O 4.289 1.756 -0.546 1.00 . A A . 10 PRO O 1 1 2 430 1 1 11 SER C C 5.203 3.629 2.108 1.00 . A A . 11 SER C 1 1 2 431 1 1 11 SER CA C 5.312 2.111 2.005 1.00 . A A . 11 SER CA 1 1 2 432 1 1 11 SER CB C 5.965 1.547 3.267 1.00 . A A . 11 SER CB 1 1 2 433 1 1 11 SER H H 7.038 1.567 0.907 1.00 . A A . 11 SER H 1 1 2 434 1 1 11 SER HA H 4.318 1.697 1.908 1.00 . A A . 11 SER HA 1 1 2 435 1 1 11 SER HB2 H 6.970 1.934 3.353 1.00 . A A . 11 SER HB2 1 1 2 436 1 1 11 SER HB3 H 5.390 1.844 4.131 1.00 . A A . 11 SER HB3 1 1 2 437 1 1 11 SER HG H 6.830 -0.168 3.648 1.00 . A A . 11 SER HG 1 1 2 438 1 1 11 SER N N 6.075 1.724 0.823 1.00 . A A . 11 SER N 1 1 2 439 1 1 11 SER O O 6.208 4.324 2.259 1.00 . A A . 11 SER O 1 1 2 440 1 1 11 SER OG O 6.025 0.132 3.222 1.00 . A A . 11 SER OG 1 1 2 441 1 1 12 ILE C C 2.679 5.885 3.165 1.00 . A A . 12 ILE C 1 1 2 442 1 1 12 ILE CA C 3.737 5.571 2.111 1.00 . A A . 12 ILE CA 1 1 2 443 1 1 12 ILE CB C 3.287 6.145 0.751 1.00 . A A . 12 ILE CB 1 1 2 444 1 1 12 ILE CD1 C 5.695 6.537 0.021 1.00 . A A . 12 ILE CD1 1 1 2 445 1 1 12 ILE CG1 C 4.363 5.899 -0.309 1.00 . A A . 12 ILE CG1 1 1 2 446 1 1 12 ILE CG2 C 2.984 7.635 0.867 1.00 . A A . 12 ILE CG2 1 1 2 447 1 1 12 ILE H H 3.216 3.531 1.906 1.00 . A A . 12 ILE H 1 1 2 448 1 1 12 ILE HA H 4.664 6.049 2.392 1.00 . A A . 12 ILE HA 1 1 2 449 1 1 12 ILE HB H 2.380 5.642 0.455 1.00 . A A . 12 ILE HB 1 1 2 450 1 1 12 ILE HD11 H 5.570 7.608 0.102 1.00 . A A . 12 ILE HD11 1 1 2 451 1 1 12 ILE HD12 H 6.404 6.316 -0.762 1.00 . A A . 12 ILE HD12 1 1 2 452 1 1 12 ILE HD13 H 6.059 6.145 0.959 1.00 . A A . 12 ILE HD13 1 1 2 453 1 1 12 ILE HG12 H 4.522 4.835 -0.411 1.00 . A A . 12 ILE HG12 1 1 2 454 1 1 12 ILE HG13 H 4.027 6.301 -1.254 1.00 . A A . 12 ILE HG13 1 1 2 455 1 1 12 ILE HG21 H 3.532 8.176 0.109 1.00 . A A . 12 ILE HG21 1 1 2 456 1 1 12 ILE HG22 H 3.279 7.989 1.844 1.00 . A A . 12 ILE HG22 1 1 2 457 1 1 12 ILE HG23 H 1.925 7.799 0.729 1.00 . A A . 12 ILE HG23 1 1 2 458 1 1 12 ILE N N 3.977 4.136 2.026 1.00 . A A . 12 ILE N 1 1 2 459 1 1 12 ILE O O 3.057 6.337 4.267 1.00 . A A . 12 ILE O 1 1 2 460 1 1 12 ILE OXT O 1.480 5.677 2.880 1.00 . A A . 12 ILE OXT 1 1 3 461 1 1 1 HIS C C -4.843 3.311 4.338 1.00 . A A . 1 HIS C 1 1 3 462 1 1 1 HIS CA C -4.551 4.170 5.567 1.00 . A A . 1 HIS CA 1 1 3 463 1 1 1 HIS CB C -5.440 3.740 6.735 1.00 . A A . 1 HIS CB 1 1 3 464 1 1 1 HIS CD2 C -5.996 5.287 8.742 1.00 . A A . 1 HIS CD2 1 1 3 465 1 1 1 HIS CE1 C -4.031 5.268 9.716 1.00 . A A . 1 HIS CE1 1 1 3 466 1 1 1 HIS CG C -5.180 4.503 7.998 1.00 . A A . 1 HIS CG 1 1 3 467 1 1 1 HIS H1 H -5.776 5.704 4.955 1.00 . A A . 1 HIS H1 1 1 3 468 1 1 1 HIS H2 H -4.119 5.910 4.558 1.00 . A A . 1 HIS H2 1 1 3 469 1 1 1 HIS H3 H -4.651 6.132 6.175 1.00 . A A . 1 HIS H3 1 1 3 470 1 1 1 HIS HA H -3.515 4.045 5.845 1.00 . A A . 1 HIS HA 1 1 3 471 1 1 1 HIS HB2 H -6.475 3.889 6.465 1.00 . A A . 1 HIS HB2 1 1 3 472 1 1 1 HIS HB3 H -5.274 2.692 6.939 1.00 . A A . 1 HIS HB3 1 1 3 473 1 1 1 HIS HD1 H -3.154 4.036 8.337 1.00 . A A . 1 HIS HD1 1 1 3 474 1 1 1 HIS HD2 H -7.035 5.508 8.540 1.00 . A A . 1 HIS HD2 1 1 3 475 1 1 1 HIS HE1 H -3.226 5.459 10.408 1.00 . A A . 1 HIS HE1 1 1 3 476 1 1 1 HIS HE2 H -5.561 6.402 10.468 1.00 . A A . 1 HIS HE2 1 1 3 477 1 1 1 HIS N N -4.796 5.609 5.288 1.00 . A A . 1 HIS N 1 1 3 478 1 1 1 HIS ND1 N -3.958 4.512 8.633 1.00 . A A . 1 HIS ND1 1 1 3 479 1 1 1 HIS NE2 N -5.257 5.749 9.803 1.00 . A A . 1 HIS NE2 1 1 3 480 1 1 1 HIS O O -5.878 2.647 4.267 1.00 . A A . 1 HIS O 1 1 3 481 1 1 2 PRO C C -3.979 1.031 2.370 1.00 . A A . 2 PRO C 1 1 3 482 1 1 2 PRO CA C -4.098 2.532 2.122 1.00 . A A . 2 PRO CA 1 1 3 483 1 1 2 PRO CB C -2.955 3.020 1.230 1.00 . A A . 2 PRO CB 1 1 3 484 1 1 2 PRO CD C -2.671 4.077 3.354 1.00 . A A . 2 PRO CD 1 1 3 485 1 1 2 PRO CG C -1.920 3.516 2.178 1.00 . A A . 2 PRO CG 1 1 3 486 1 1 2 PRO HA H -5.045 2.741 1.645 1.00 . A A . 2 PRO HA 1 1 3 487 1 1 2 PRO HB2 H -2.584 2.199 0.633 1.00 . A A . 2 PRO HB2 1 1 3 488 1 1 2 PRO HB3 H -3.309 3.810 0.585 1.00 . A A . 2 PRO HB3 1 1 3 489 1 1 2 PRO HD2 H -2.120 3.908 4.268 1.00 . A A . 2 PRO HD2 1 1 3 490 1 1 2 PRO HD3 H -2.858 5.132 3.213 1.00 . A A . 2 PRO HD3 1 1 3 491 1 1 2 PRO HG2 H -1.287 2.698 2.493 1.00 . A A . 2 PRO HG2 1 1 3 492 1 1 2 PRO HG3 H -1.329 4.287 1.708 1.00 . A A . 2 PRO HG3 1 1 3 493 1 1 2 PRO N N -3.933 3.314 3.350 1.00 . A A . 2 PRO N 1 1 3 494 1 1 2 PRO O O -2.977 0.410 2.015 1.00 . A A . 2 PRO O 1 1 3 495 1 1 3 LEU C C -5.928 -1.741 2.318 1.00 . A A . 3 LEU C 1 1 3 496 1 1 3 LEU CA C -5.020 -0.974 3.279 1.00 . A A . 3 LEU CA 1 1 3 497 1 1 3 LEU CB C -5.447 -1.207 4.733 1.00 . A A . 3 LEU CB 1 1 3 498 1 1 3 LEU CD1 C -7.925 -1.325 4.283 1.00 . A A . 3 LEU CD1 1 1 3 499 1 1 3 LEU CD2 C -7.091 -0.882 6.597 1.00 . A A . 3 LEU CD2 1 1 3 500 1 1 3 LEU CG C -6.831 -0.672 5.113 1.00 . A A . 3 LEU CG 1 1 3 501 1 1 3 LEU H H -5.779 1.002 3.240 1.00 . A A . 3 LEU H 1 1 3 502 1 1 3 LEU HA H -4.014 -1.335 3.156 1.00 . A A . 3 LEU HA 1 1 3 503 1 1 3 LEU HB2 H -5.433 -2.270 4.921 1.00 . A A . 3 LEU HB2 1 1 3 504 1 1 3 LEU HB3 H -4.717 -0.737 5.376 1.00 . A A . 3 LEU HB3 1 1 3 505 1 1 3 LEU HD11 H -8.004 -0.822 3.330 1.00 . A A . 3 LEU HD11 1 1 3 506 1 1 3 LEU HD12 H -8.867 -1.252 4.807 1.00 . A A . 3 LEU HD12 1 1 3 507 1 1 3 LEU HD13 H -7.684 -2.365 4.121 1.00 . A A . 3 LEU HD13 1 1 3 508 1 1 3 LEU HD21 H -6.616 -0.094 7.161 1.00 . A A . 3 LEU HD21 1 1 3 509 1 1 3 LEU HD22 H -6.687 -1.836 6.902 1.00 . A A . 3 LEU HD22 1 1 3 510 1 1 3 LEU HD23 H -8.154 -0.867 6.783 1.00 . A A . 3 LEU HD23 1 1 3 511 1 1 3 LEU HG H -6.857 0.388 4.919 1.00 . A A . 3 LEU HG 1 1 3 512 1 1 3 LEU N N -5.009 0.455 2.982 1.00 . A A . 3 LEU N 1 1 3 513 1 1 3 LEU O O -6.223 -2.916 2.537 1.00 . A A . 3 LEU O 1 1 3 514 1 1 4 LYS C C -6.427 -2.283 -0.894 1.00 . A A . 4 LYS C 1 1 3 515 1 1 4 LYS CA C -7.236 -1.704 0.263 1.00 . A A . 4 LYS CA 1 1 3 516 1 1 4 LYS CB C -8.254 -0.692 -0.265 1.00 . A A . 4 LYS CB 1 1 3 517 1 1 4 LYS CD C -10.192 -0.222 -1.794 1.00 . A A . 4 LYS CD 1 1 3 518 1 1 4 LYS CE C -11.142 -0.796 -2.832 1.00 . A A . 4 LYS CE 1 1 3 519 1 1 4 LYS CG C -9.205 -1.267 -1.304 1.00 . A A . 4 LYS CG 1 1 3 520 1 1 4 LYS H H -6.098 -0.143 1.125 1.00 . A A . 4 LYS H 1 1 3 521 1 1 4 LYS HA H -7.763 -2.507 0.753 1.00 . A A . 4 LYS HA 1 1 3 522 1 1 4 LYS HB2 H -8.842 -0.323 0.563 1.00 . A A . 4 LYS HB2 1 1 3 523 1 1 4 LYS HB3 H -7.723 0.135 -0.714 1.00 . A A . 4 LYS HB3 1 1 3 524 1 1 4 LYS HD2 H -10.767 0.138 -0.954 1.00 . A A . 4 LYS HD2 1 1 3 525 1 1 4 LYS HD3 H -9.644 0.599 -2.235 1.00 . A A . 4 LYS HD3 1 1 3 526 1 1 4 LYS HE2 H -10.564 -1.158 -3.669 1.00 . A A . 4 LYS HE2 1 1 3 527 1 1 4 LYS HE3 H -11.685 -1.617 -2.388 1.00 . A A . 4 LYS HE3 1 1 3 528 1 1 4 LYS HG2 H -8.630 -1.627 -2.143 1.00 . A A . 4 LYS HG2 1 1 3 529 1 1 4 LYS HG3 H -9.752 -2.088 -0.861 1.00 . A A . 4 LYS HG3 1 1 3 530 1 1 4 LYS HZ1 H -11.773 0.644 -4.206 1.00 . A A . 4 LYS HZ1 1 1 3 531 1 1 4 LYS HZ2 H -12.229 0.973 -2.611 1.00 . A A . 4 LYS HZ2 1 1 3 532 1 1 4 LYS HZ3 H -13.039 -0.223 -3.491 1.00 . A A . 4 LYS HZ3 1 1 3 533 1 1 4 LYS N N -6.366 -1.076 1.252 1.00 . A A . 4 LYS N 1 1 3 534 1 1 4 LYS NZ N -12.114 0.222 -3.319 1.00 . A A . 4 LYS NZ 1 1 3 535 1 1 4 LYS O O -6.913 -3.136 -1.637 1.00 . A A . 4 LYS O 1 1 3 536 1 1 5 GLN C C -3.210 -3.190 -1.557 1.00 . A A . 5 GLN C 1 1 3 537 1 1 5 GLN CA C -4.316 -2.288 -2.106 1.00 . A A . 5 GLN CA 1 1 3 538 1 1 5 GLN CB C -3.699 -1.100 -2.848 1.00 . A A . 5 GLN CB 1 1 3 539 1 1 5 GLN CD C -2.172 -0.306 -4.697 1.00 . A A . 5 GLN CD 1 1 3 540 1 1 5 GLN CG C -2.768 -1.503 -3.980 1.00 . A A . 5 GLN CG 1 1 3 541 1 1 5 GLN H H -4.861 -1.138 -0.416 1.00 . A A . 5 GLN H 1 1 3 542 1 1 5 GLN HA H -4.916 -2.858 -2.799 1.00 . A A . 5 GLN HA 1 1 3 543 1 1 5 GLN HB2 H -4.494 -0.496 -3.261 1.00 . A A . 5 GLN HB2 1 1 3 544 1 1 5 GLN HB3 H -3.137 -0.503 -2.144 1.00 . A A . 5 GLN HB3 1 1 3 545 1 1 5 GLN HE21 H -0.336 -0.903 -4.220 1.00 . A A . 5 GLN HE21 1 1 3 546 1 1 5 GLN HE22 H -0.435 0.554 -5.141 1.00 . A A . 5 GLN HE22 1 1 3 547 1 1 5 GLN HG2 H -1.963 -2.096 -3.574 1.00 . A A . 5 GLN HG2 1 1 3 548 1 1 5 GLN HG3 H -3.324 -2.092 -4.695 1.00 . A A . 5 GLN HG3 1 1 3 549 1 1 5 GLN N N -5.192 -1.816 -1.040 1.00 . A A . 5 GLN N 1 1 3 550 1 1 5 GLN NE2 N -0.848 -0.208 -4.685 1.00 . A A . 5 GLN NE2 1 1 3 551 1 1 5 GLN O O -2.514 -3.863 -2.317 1.00 . A A . 5 GLN O 1 1 3 552 1 1 5 GLN OE1 O -2.894 0.519 -5.257 1.00 . A A . 5 GLN OE1 1 1 3 553 1 1 6 TYR C C -0.634 -3.569 -0.005 1.00 . A A . 6 TYR C 1 1 3 554 1 1 6 TYR CA C -2.031 -4.020 0.408 1.00 . A A . 6 TYR CA 1 1 3 555 1 1 6 TYR CB C -2.229 -5.499 0.057 1.00 . A A . 6 TYR CB 1 1 3 556 1 1 6 TYR CD1 C -4.512 -5.297 1.153 1.00 . A A . 6 TYR CD1 1 1 3 557 1 1 6 TYR CD2 C -3.880 -7.402 0.227 1.00 . A A . 6 TYR CD2 1 1 3 558 1 1 6 TYR CE1 C -5.726 -5.830 1.542 1.00 . A A . 6 TYR CE1 1 1 3 559 1 1 6 TYR CE2 C -5.092 -7.940 0.614 1.00 . A A . 6 TYR CE2 1 1 3 560 1 1 6 TYR CG C -3.566 -6.074 0.487 1.00 . A A . 6 TYR CG 1 1 3 561 1 1 6 TYR CZ C -6.011 -7.150 1.271 1.00 . A A . 6 TYR CZ 1 1 3 562 1 1 6 TYR H H -3.635 -2.644 0.322 1.00 . A A . 6 TYR H 1 1 3 563 1 1 6 TYR HA H -2.133 -3.898 1.476 1.00 . A A . 6 TYR HA 1 1 3 564 1 1 6 TYR HB2 H -2.150 -5.619 -1.013 1.00 . A A . 6 TYR HB2 1 1 3 565 1 1 6 TYR HB3 H -1.451 -6.078 0.533 1.00 . A A . 6 TYR HB3 1 1 3 566 1 1 6 TYR HD1 H -4.288 -4.263 1.366 1.00 . A A . 6 TYR HD1 1 1 3 567 1 1 6 TYR HD2 H -3.159 -8.020 -0.288 1.00 . A A . 6 TYR HD2 1 1 3 568 1 1 6 TYR HE1 H -6.446 -5.211 2.057 1.00 . A A . 6 TYR HE1 1 1 3 569 1 1 6 TYR HE2 H -5.315 -8.976 0.402 1.00 . A A . 6 TYR HE2 1 1 3 570 1 1 6 TYR HH H -7.110 -8.160 2.484 1.00 . A A . 6 TYR HH 1 1 3 571 1 1 6 TYR N N -3.053 -3.200 -0.234 1.00 . A A . 6 TYR N 1 1 3 572 1 1 6 TYR O O -0.068 -4.074 -0.974 1.00 . A A . 6 TYR O 1 1 3 573 1 1 6 TYR OH O -7.219 -7.684 1.657 1.00 . A A . 6 TYR OH 1 1 3 574 1 1 7 TRP C C 2.310 -3.161 0.658 1.00 . A A . 7 TRP C 1 1 3 575 1 1 7 TRP CA C 1.246 -2.089 0.450 1.00 . A A . 7 TRP CA 1 1 3 576 1 1 7 TRP CB C 1.543 -0.882 1.341 1.00 . A A . 7 TRP CB 1 1 3 577 1 1 7 TRP CD1 C 2.280 -2.104 3.469 1.00 . A A . 7 TRP CD1 1 1 3 578 1 1 7 TRP CD2 C 0.637 -0.616 3.786 1.00 . A A . 7 TRP CD2 1 1 3 579 1 1 7 TRP CE2 C 0.946 -1.213 5.022 1.00 . A A . 7 TRP CE2 1 1 3 580 1 1 7 TRP CE3 C -0.368 0.354 3.739 1.00 . A A . 7 TRP CE3 1 1 3 581 1 1 7 TRP CG C 1.502 -1.199 2.805 1.00 . A A . 7 TRP CG 1 1 3 582 1 1 7 TRP CH2 C -0.693 0.081 6.125 1.00 . A A . 7 TRP CH2 1 1 3 583 1 1 7 TRP CZ2 C 0.286 -0.871 6.200 1.00 . A A . 7 TRP CZ2 1 1 3 584 1 1 7 TRP CZ3 C -1.023 0.691 4.909 1.00 . A A . 7 TRP CZ3 1 1 3 585 1 1 7 TRP H H -0.587 -2.250 1.497 1.00 . A A . 7 TRP H 1 1 3 586 1 1 7 TRP HA H 1.263 -1.777 -0.583 1.00 . A A . 7 TRP HA 1 1 3 587 1 1 7 TRP HB2 H 2.527 -0.505 1.109 1.00 . A A . 7 TRP HB2 1 1 3 588 1 1 7 TRP HB3 H 0.812 -0.110 1.146 1.00 . A A . 7 TRP HB3 1 1 3 589 1 1 7 TRP HD1 H 3.039 -2.713 3.001 1.00 . A A . 7 TRP HD1 1 1 3 590 1 1 7 TRP HE1 H 2.371 -2.682 5.486 1.00 . A A . 7 TRP HE1 1 1 3 591 1 1 7 TRP HE3 H -0.637 0.836 2.811 1.00 . A A . 7 TRP HE3 1 1 3 592 1 1 7 TRP HH2 H -1.231 0.375 7.014 1.00 . A A . 7 TRP HH2 1 1 3 593 1 1 7 TRP HZ2 H 0.529 -1.333 7.146 1.00 . A A . 7 TRP HZ2 1 1 3 594 1 1 7 TRP HZ3 H -1.803 1.439 4.892 1.00 . A A . 7 TRP HZ3 1 1 3 595 1 1 7 TRP N N -0.085 -2.613 0.738 1.00 . A A . 7 TRP N 1 1 3 596 1 1 7 TRP NE1 N 1.952 -2.117 4.803 1.00 . A A . 7 TRP NE1 1 1 3 597 1 1 7 TRP O O 1.994 -4.313 0.961 1.00 . A A . 7 TRP O 1 1 3 598 1 1 8 TRP C C 6.007 -2.946 0.520 1.00 . A A . 8 TRP C 1 1 3 599 1 1 8 TRP CA C 4.682 -3.702 0.669 1.00 . A A . 8 TRP CA 1 1 3 600 1 1 8 TRP CB C 4.577 -4.836 -0.360 1.00 . A A . 8 TRP CB 1 1 3 601 1 1 8 TRP CD1 C 5.787 -6.967 -1.089 1.00 . A A . 8 TRP CD1 1 1 3 602 1 1 8 TRP CD2 C 6.670 -6.030 0.748 1.00 . A A . 8 TRP CD2 1 1 3 603 1 1 8 TRP CE2 C 7.414 -7.184 0.423 1.00 . A A . 8 TRP CE2 1 1 3 604 1 1 8 TRP CE3 C 7.046 -5.293 1.878 1.00 . A A . 8 TRP CE3 1 1 3 605 1 1 8 TRP CG C 5.648 -5.890 -0.262 1.00 . A A . 8 TRP CG 1 1 3 606 1 1 8 TRP CH2 C 8.839 -6.872 2.278 1.00 . A A . 8 TRP CH2 1 1 3 607 1 1 8 TRP CZ2 C 8.500 -7.611 1.181 1.00 . A A . 8 TRP CZ2 1 1 3 608 1 1 8 TRP CZ3 C 8.122 -5.725 2.631 1.00 . A A . 8 TRP CZ3 1 1 3 609 1 1 8 TRP H H 3.758 -1.843 0.257 1.00 . A A . 8 TRP H 1 1 3 610 1 1 8 TRP HA H 4.626 -4.115 1.659 1.00 . A A . 8 TRP HA 1 1 3 611 1 1 8 TRP HB2 H 3.625 -5.330 -0.231 1.00 . A A . 8 TRP HB2 1 1 3 612 1 1 8 TRP HB3 H 4.615 -4.413 -1.352 1.00 . A A . 8 TRP HB3 1 1 3 613 1 1 8 TRP HD1 H 5.159 -7.158 -1.946 1.00 . A A . 8 TRP HD1 1 1 3 614 1 1 8 TRP HE1 H 7.176 -8.538 -1.159 1.00 . A A . 8 TRP HE1 1 1 3 615 1 1 8 TRP HE3 H 6.506 -4.410 2.176 1.00 . A A . 8 TRP HE3 1 1 3 616 1 1 8 TRP HH2 H 9.672 -7.171 2.897 1.00 . A A . 8 TRP HH2 1 1 3 617 1 1 8 TRP HZ2 H 9.065 -8.495 0.921 1.00 . A A . 8 TRP HZ2 1 1 3 618 1 1 8 TRP HZ3 H 8.423 -5.168 3.507 1.00 . A A . 8 TRP HZ3 1 1 3 619 1 1 8 TRP N N 3.571 -2.775 0.497 1.00 . A A . 8 TRP N 1 1 3 620 1 1 8 TRP NE1 N 6.862 -7.728 -0.705 1.00 . A A . 8 TRP NE1 1 1 3 621 1 1 8 TRP O O 6.494 -2.344 1.478 1.00 . A A . 8 TRP O 1 1 3 622 1 1 9 ARG C C 7.639 -0.762 -0.991 1.00 . A A . 9 ARG C 1 1 3 623 1 1 9 ARG CA C 7.839 -2.278 -0.934 1.00 . A A . 9 ARG CA 1 1 3 624 1 1 9 ARG CB C 8.467 -2.775 -2.240 1.00 . A A . 9 ARG CB 1 1 3 625 1 1 9 ARG CD C 9.768 -4.616 -1.131 1.00 . A A . 9 ARG CD 1 1 3 626 1 1 9 ARG CG C 8.785 -4.262 -2.236 1.00 . A A . 9 ARG CG 1 1 3 627 1 1 9 ARG CZ C 10.921 -6.607 -0.248 1.00 . A A . 9 ARG CZ 1 1 3 628 1 1 9 ARG H H 6.147 -3.455 -1.402 1.00 . A A . 9 ARG H 1 1 3 629 1 1 9 ARG HA H 8.509 -2.505 -0.119 1.00 . A A . 9 ARG HA 1 1 3 630 1 1 9 ARG HB2 H 7.787 -2.578 -3.053 1.00 . A A . 9 ARG HB2 1 1 3 631 1 1 9 ARG HB3 H 9.385 -2.234 -2.412 1.00 . A A . 9 ARG HB3 1 1 3 632 1 1 9 ARG HD2 H 10.678 -4.057 -1.284 1.00 . A A . 9 ARG HD2 1 1 3 633 1 1 9 ARG HD3 H 9.334 -4.344 -0.181 1.00 . A A . 9 ARG HD3 1 1 3 634 1 1 9 ARG HE H 9.652 -6.610 -1.790 1.00 . A A . 9 ARG HE 1 1 3 635 1 1 9 ARG HG2 H 7.870 -4.815 -2.082 1.00 . A A . 9 ARG HG2 1 1 3 636 1 1 9 ARG HG3 H 9.216 -4.531 -3.189 1.00 . A A . 9 ARG HG3 1 1 3 637 1 1 9 ARG HH11 H 11.354 -4.887 0.724 1.00 . A A . 9 ARG HH11 1 1 3 638 1 1 9 ARG HH12 H 12.152 -6.301 1.326 1.00 . A A . 9 ARG HH12 1 1 3 639 1 1 9 ARG HH21 H 10.700 -8.471 -0.998 1.00 . A A . 9 ARG HH21 1 1 3 640 1 1 9 ARG HH22 H 11.782 -8.335 0.348 1.00 . A A . 9 ARG HH22 1 1 3 641 1 1 9 ARG N N 6.581 -2.969 -0.677 1.00 . A A . 9 ARG N 1 1 3 642 1 1 9 ARG NE N 10.084 -6.042 -1.117 1.00 . A A . 9 ARG NE 1 1 3 643 1 1 9 ARG NH1 N 11.525 -5.871 0.676 1.00 . A A . 9 ARG NH1 1 1 3 644 1 1 9 ARG NH2 N 11.153 -7.912 -0.304 1.00 . A A . 9 ARG NH2 1 1 3 645 1 1 9 ARG O O 8.368 -0.014 -0.340 1.00 . A A . 9 ARG O 1 1 3 646 1 1 10 PRO C C 5.664 1.724 -0.675 1.00 . A A . 10 PRO C 1 1 3 647 1 1 10 PRO CA C 6.383 1.155 -1.894 1.00 . A A . 10 PRO CA 1 1 3 648 1 1 10 PRO CB C 5.488 1.237 -3.130 1.00 . A A . 10 PRO CB 1 1 3 649 1 1 10 PRO CD C 5.724 -1.085 -2.595 1.00 . A A . 10 PRO CD 1 1 3 650 1 1 10 PRO CG C 4.768 -0.066 -3.156 1.00 . A A . 10 PRO CG 1 1 3 651 1 1 10 PRO HA H 7.289 1.713 -2.066 1.00 . A A . 10 PRO HA 1 1 3 652 1 1 10 PRO HB2 H 4.803 2.067 -3.027 1.00 . A A . 10 PRO HB2 1 1 3 653 1 1 10 PRO HB3 H 6.096 1.371 -4.012 1.00 . A A . 10 PRO HB3 1 1 3 654 1 1 10 PRO HD2 H 5.191 -1.802 -1.987 1.00 . A A . 10 PRO HD2 1 1 3 655 1 1 10 PRO HD3 H 6.251 -1.584 -3.394 1.00 . A A . 10 PRO HD3 1 1 3 656 1 1 10 PRO HG2 H 3.881 -0.007 -2.544 1.00 . A A . 10 PRO HG2 1 1 3 657 1 1 10 PRO HG3 H 4.506 -0.319 -4.173 1.00 . A A . 10 PRO HG3 1 1 3 658 1 1 10 PRO N N 6.651 -0.281 -1.772 1.00 . A A . 10 PRO N 1 1 3 659 1 1 10 PRO O O 5.579 2.940 -0.504 1.00 . A A . 10 PRO O 1 1 3 660 1 1 11 SER C C 3.193 2.064 1.023 1.00 . A A . 11 SER C 1 1 3 661 1 1 11 SER CA C 4.437 1.255 1.375 1.00 . A A . 11 SER CA 1 1 3 662 1 1 11 SER CB C 5.357 2.080 2.278 1.00 . A A . 11 SER CB 1 1 3 663 1 1 11 SER H H 5.247 -0.116 -0.018 1.00 . A A . 11 SER H 1 1 3 664 1 1 11 SER HA H 4.133 0.365 1.905 1.00 . A A . 11 SER HA 1 1 3 665 1 1 11 SER HB2 H 5.689 2.958 1.743 1.00 . A A . 11 SER HB2 1 1 3 666 1 1 11 SER HB3 H 4.815 2.381 3.162 1.00 . A A . 11 SER HB3 1 1 3 667 1 1 11 SER HG H 7.290 1.782 2.387 1.00 . A A . 11 SER HG 1 1 3 668 1 1 11 SER N N 5.147 0.839 0.171 1.00 . A A . 11 SER N 1 1 3 669 1 1 11 SER O O 2.785 2.952 1.771 1.00 . A A . 11 SER O 1 1 3 670 1 1 11 SER OG O 6.493 1.329 2.672 1.00 . A A . 11 SER OG 1 1 3 671 1 1 12 ILE C C 0.330 1.460 -1.032 1.00 . A A . 12 ILE C 1 1 3 672 1 1 12 ILE CA C 1.396 2.451 -0.574 1.00 . A A . 12 ILE CA 1 1 3 673 1 1 12 ILE CB C 1.716 3.426 -1.726 1.00 . A A . 12 ILE CB 1 1 3 674 1 1 12 ILE CD1 C 2.263 5.307 -0.101 1.00 . A A . 12 ILE CD1 1 1 3 675 1 1 12 ILE CG1 C 2.736 4.470 -1.269 1.00 . A A . 12 ILE CG1 1 1 3 676 1 1 12 ILE CG2 C 0.447 4.108 -2.221 1.00 . A A . 12 ILE CG2 1 1 3 677 1 1 12 ILE H H 2.966 1.035 -0.677 1.00 . A A . 12 ILE H 1 1 3 678 1 1 12 ILE HA H 1.010 3.021 0.259 1.00 . A A . 12 ILE HA 1 1 3 679 1 1 12 ILE HB H 2.133 2.859 -2.543 1.00 . A A . 12 ILE HB 1 1 3 680 1 1 12 ILE HD11 H 1.195 5.197 0.012 1.00 . A A . 12 ILE HD11 1 1 3 681 1 1 12 ILE HD12 H 2.502 6.345 -0.281 1.00 . A A . 12 ILE HD12 1 1 3 682 1 1 12 ILE HD13 H 2.755 4.976 0.802 1.00 . A A . 12 ILE HD13 1 1 3 683 1 1 12 ILE HG12 H 3.645 3.969 -0.971 1.00 . A A . 12 ILE HG12 1 1 3 684 1 1 12 ILE HG13 H 2.952 5.137 -2.091 1.00 . A A . 12 ILE HG13 1 1 3 685 1 1 12 ILE HG21 H -0.283 4.130 -1.425 1.00 . A A . 12 ILE HG21 1 1 3 686 1 1 12 ILE HG22 H 0.047 3.558 -3.060 1.00 . A A . 12 ILE HG22 1 1 3 687 1 1 12 ILE HG23 H 0.675 5.117 -2.528 1.00 . A A . 12 ILE HG23 1 1 3 688 1 1 12 ILE N N 2.594 1.753 -0.123 1.00 . A A . 12 ILE N 1 1 3 689 1 1 12 ILE O O -0.847 1.865 -1.137 1.00 . A A . 12 ILE O 1 1 3 690 1 1 12 ILE OXT O 0.681 0.288 -1.283 1.00 . A A . 12 ILE OXT 1 1 4 691 1 1 1 HIS C C -6.137 4.305 3.162 1.00 . A A . 1 HIS C 1 1 4 692 1 1 1 HIS CA C -5.450 5.566 3.680 1.00 . A A . 1 HIS CA 1 1 4 693 1 1 1 HIS CB C -5.586 5.655 5.201 1.00 . A A . 1 HIS CB 1 1 4 694 1 1 1 HIS CD2 C -5.377 7.879 6.520 1.00 . A A . 1 HIS CD2 1 1 4 695 1 1 1 HIS CE1 C -3.217 8.182 6.299 1.00 . A A . 1 HIS CE1 1 1 4 696 1 1 1 HIS CG C -4.893 6.842 5.796 1.00 . A A . 1 HIS CG 1 1 4 697 1 1 1 HIS H1 H -7.064 6.776 3.280 1.00 . A A . 1 HIS H1 1 1 4 698 1 1 1 HIS H2 H -5.863 6.758 2.055 1.00 . A A . 1 HIS H2 1 1 4 699 1 1 1 HIS H3 H -5.586 7.612 3.518 1.00 . A A . 1 HIS H3 1 1 4 700 1 1 1 HIS HA H -4.403 5.529 3.418 1.00 . A A . 1 HIS HA 1 1 4 701 1 1 1 HIS HB2 H -6.632 5.717 5.459 1.00 . A A . 1 HIS HB2 1 1 4 702 1 1 1 HIS HB3 H -5.163 4.765 5.646 1.00 . A A . 1 HIS HB3 1 1 4 703 1 1 1 HIS HD1 H -2.903 6.483 5.201 1.00 . A A . 1 HIS HD1 1 1 4 704 1 1 1 HIS HD2 H -6.408 8.034 6.809 1.00 . A A . 1 HIS HD2 1 1 4 705 1 1 1 HIS HE1 H -2.226 8.604 6.370 1.00 . A A . 1 HIS HE1 1 1 4 706 1 1 1 HIS HE2 H -4.348 9.479 7.408 1.00 . A A . 1 HIS HE2 1 1 4 707 1 1 1 HIS N N -6.044 6.788 3.079 1.00 . A A . 1 HIS N 1 1 4 708 1 1 1 HIS ND1 N -3.538 7.062 5.675 1.00 . A A . 1 HIS ND1 1 1 4 709 1 1 1 HIS NE2 N -4.315 8.697 6.819 1.00 . A A . 1 HIS NE2 1 1 4 710 1 1 1 HIS O O -6.959 3.705 3.856 1.00 . A A . 1 HIS O 1 1 4 711 1 1 2 PRO C C -5.900 1.402 1.970 1.00 . A A . 2 PRO C 1 1 4 712 1 1 2 PRO CA C -6.399 2.688 1.319 1.00 . A A . 2 PRO CA 1 1 4 713 1 1 2 PRO CB C -5.935 2.766 -0.136 1.00 . A A . 2 PRO CB 1 1 4 714 1 1 2 PRO CD C -4.837 4.540 1.032 1.00 . A A . 2 PRO CD 1 1 4 715 1 1 2 PRO CG C -4.670 3.549 -0.088 1.00 . A A . 2 PRO CG 1 1 4 716 1 1 2 PRO HA H -7.478 2.716 1.359 1.00 . A A . 2 PRO HA 1 1 4 717 1 1 2 PRO HB2 H -5.769 1.769 -0.518 1.00 . A A . 2 PRO HB2 1 1 4 718 1 1 2 PRO HB3 H -6.685 3.265 -0.731 1.00 . A A . 2 PRO HB3 1 1 4 719 1 1 2 PRO HD2 H -3.896 4.703 1.536 1.00 . A A . 2 PRO HD2 1 1 4 720 1 1 2 PRO HD3 H -5.231 5.472 0.655 1.00 . A A . 2 PRO HD3 1 1 4 721 1 1 2 PRO HG2 H -3.837 2.892 0.116 1.00 . A A . 2 PRO HG2 1 1 4 722 1 1 2 PRO HG3 H -4.521 4.065 -1.024 1.00 . A A . 2 PRO HG3 1 1 4 723 1 1 2 PRO N N -5.809 3.884 1.929 1.00 . A A . 2 PRO N 1 1 4 724 1 1 2 PRO O O -4.717 1.075 1.894 1.00 . A A . 2 PRO O 1 1 4 725 1 1 3 LEU C C -6.713 -1.781 2.364 1.00 . A A . 3 LEU C 1 1 4 726 1 1 3 LEU CA C -6.466 -0.577 3.271 1.00 . A A . 3 LEU CA 1 1 4 727 1 1 3 LEU CB C -7.248 -0.712 4.583 1.00 . A A . 3 LEU CB 1 1 4 728 1 1 3 LEU CD1 C -9.271 -1.846 3.588 1.00 . A A . 3 LEU CD1 1 1 4 729 1 1 3 LEU CD2 C -9.424 -0.742 5.827 1.00 . A A . 3 LEU CD2 1 1 4 730 1 1 3 LEU CG C -8.774 -0.696 4.452 1.00 . A A . 3 LEU CG 1 1 4 731 1 1 3 LEU H H -7.741 0.988 2.631 1.00 . A A . 3 LEU H 1 1 4 732 1 1 3 LEU HA H -5.415 -0.536 3.502 1.00 . A A . 3 LEU HA 1 1 4 733 1 1 3 LEU HB2 H -6.960 -1.641 5.050 1.00 . A A . 3 LEU HB2 1 1 4 734 1 1 3 LEU HB3 H -6.958 0.101 5.232 1.00 . A A . 3 LEU HB3 1 1 4 735 1 1 3 LEU HD11 H -9.177 -1.581 2.546 1.00 . A A . 3 LEU HD11 1 1 4 736 1 1 3 LEU HD12 H -10.308 -2.046 3.816 1.00 . A A . 3 LEU HD12 1 1 4 737 1 1 3 LEU HD13 H -8.683 -2.729 3.790 1.00 . A A . 3 LEU HD13 1 1 4 738 1 1 3 LEU HD21 H -9.030 -1.578 6.384 1.00 . A A . 3 LEU HD21 1 1 4 739 1 1 3 LEU HD22 H -10.493 -0.856 5.715 1.00 . A A . 3 LEU HD22 1 1 4 740 1 1 3 LEU HD23 H -9.214 0.176 6.356 1.00 . A A . 3 LEU HD23 1 1 4 741 1 1 3 LEU HG H -9.071 0.225 3.975 1.00 . A A . 3 LEU HG 1 1 4 742 1 1 3 LEU N N -6.813 0.675 2.607 1.00 . A A . 3 LEU N 1 1 4 743 1 1 3 LEU O O -6.701 -2.924 2.822 1.00 . A A . 3 LEU O 1 1 4 744 1 1 4 LYS C C -6.028 -2.727 -0.874 1.00 . A A . 4 LYS C 1 1 4 745 1 1 4 LYS CA C -7.183 -2.593 0.116 1.00 . A A . 4 LYS CA 1 1 4 746 1 1 4 LYS CB C -8.489 -2.334 -0.637 1.00 . A A . 4 LYS CB 1 1 4 747 1 1 4 LYS CD C -10.129 -3.099 -2.380 1.00 . A A . 4 LYS CD 1 1 4 748 1 1 4 LYS CE C -10.465 -4.172 -3.405 1.00 . A A . 4 LYS CE 1 1 4 749 1 1 4 LYS CG C -8.825 -3.405 -1.662 1.00 . A A . 4 LYS CG 1 1 4 750 1 1 4 LYS H H -6.932 -0.595 0.767 1.00 . A A . 4 LYS H 1 1 4 751 1 1 4 LYS HA H -7.274 -3.515 0.666 1.00 . A A . 4 LYS HA 1 1 4 752 1 1 4 LYS HB2 H -9.298 -2.282 0.076 1.00 . A A . 4 LYS HB2 1 1 4 753 1 1 4 LYS HB3 H -8.413 -1.387 -1.151 1.00 . A A . 4 LYS HB3 1 1 4 754 1 1 4 LYS HD2 H -10.926 -3.049 -1.654 1.00 . A A . 4 LYS HD2 1 1 4 755 1 1 4 LYS HD3 H -10.037 -2.149 -2.884 1.00 . A A . 4 LYS HD3 1 1 4 756 1 1 4 LYS HE2 H -9.665 -4.222 -4.128 1.00 . A A . 4 LYS HE2 1 1 4 757 1 1 4 LYS HE3 H -10.552 -5.121 -2.898 1.00 . A A . 4 LYS HE3 1 1 4 758 1 1 4 LYS HG2 H -8.028 -3.456 -2.389 1.00 . A A . 4 LYS HG2 1 1 4 759 1 1 4 LYS HG3 H -8.916 -4.356 -1.157 1.00 . A A . 4 LYS HG3 1 1 4 760 1 1 4 LYS HZ1 H -12.228 -4.770 -4.351 1.00 . A A . 4 LYS HZ1 1 1 4 761 1 1 4 LYS HZ2 H -11.551 -3.360 -4.994 1.00 . A A . 4 LYS HZ2 1 1 4 762 1 1 4 LYS HZ3 H -12.363 -3.307 -3.512 1.00 . A A . 4 LYS HZ3 1 1 4 763 1 1 4 LYS N N -6.935 -1.524 1.078 1.00 . A A . 4 LYS N 1 1 4 764 1 1 4 LYS NZ N -11.741 -3.881 -4.115 1.00 . A A . 4 LYS NZ 1 1 4 765 1 1 4 LYS O O -5.889 -3.751 -1.542 1.00 . A A . 4 LYS O 1 1 4 766 1 1 5 GLN C C -3.004 -2.692 -1.420 1.00 . A A . 5 GLN C 1 1 4 767 1 1 5 GLN CA C -4.064 -1.696 -1.876 1.00 . A A . 5 GLN CA 1 1 4 768 1 1 5 GLN CB C -3.458 -0.295 -1.981 1.00 . A A . 5 GLN CB 1 1 4 769 1 1 5 GLN CD C -1.679 1.181 -3.000 1.00 . A A . 5 GLN CD 1 1 4 770 1 1 5 GLN CG C -2.261 -0.216 -2.915 1.00 . A A . 5 GLN CG 1 1 4 771 1 1 5 GLN H H -5.364 -0.900 -0.409 1.00 . A A . 5 GLN H 1 1 4 772 1 1 5 GLN HA H -4.422 -1.996 -2.846 1.00 . A A . 5 GLN HA 1 1 4 773 1 1 5 GLN HB2 H -4.214 0.386 -2.341 1.00 . A A . 5 GLN HB2 1 1 4 774 1 1 5 GLN HB3 H -3.141 0.021 -0.997 1.00 . A A . 5 GLN HB3 1 1 4 775 1 1 5 GLN HE21 H 0.070 0.521 -2.324 1.00 . A A . 5 GLN HE21 1 1 4 776 1 1 5 GLN HE22 H -0.010 2.212 -2.673 1.00 . A A . 5 GLN HE22 1 1 4 777 1 1 5 GLN HG2 H -1.494 -0.887 -2.554 1.00 . A A . 5 GLN HG2 1 1 4 778 1 1 5 GLN HG3 H -2.571 -0.523 -3.903 1.00 . A A . 5 GLN HG3 1 1 4 779 1 1 5 GLN N N -5.203 -1.689 -0.966 1.00 . A A . 5 GLN N 1 1 4 780 1 1 5 GLN NE2 N -0.411 1.318 -2.628 1.00 . A A . 5 GLN NE2 1 1 4 781 1 1 5 GLN O O -2.247 -3.225 -2.230 1.00 . A A . 5 GLN O 1 1 4 782 1 1 5 GLN OE1 O -2.361 2.127 -3.396 1.00 . A A . 5 GLN OE1 1 1 4 783 1 1 6 TYR C C -0.564 -3.459 0.102 1.00 . A A . 6 TYR C 1 1 4 784 1 1 6 TYR CA C -1.992 -3.868 0.456 1.00 . A A . 6 TYR CA 1 1 4 785 1 1 6 TYR CB C -2.266 -5.292 -0.039 1.00 . A A . 6 TYR CB 1 1 4 786 1 1 6 TYR CD1 C -4.550 -5.074 1.053 1.00 . A A . 6 TYR CD1 1 1 4 787 1 1 6 TYR CD2 C -4.019 -7.109 -0.072 1.00 . A A . 6 TYR CD2 1 1 4 788 1 1 6 TYR CE1 C -5.797 -5.577 1.379 1.00 . A A . 6 TYR CE1 1 1 4 789 1 1 6 TYR CE2 C -5.264 -7.616 0.251 1.00 . A A . 6 TYR CE2 1 1 4 790 1 1 6 TYR CG C -3.639 -5.831 0.321 1.00 . A A . 6 TYR CG 1 1 4 791 1 1 6 TYR CZ C -6.148 -6.846 0.975 1.00 . A A . 6 TYR CZ 1 1 4 792 1 1 6 TYR H H -3.589 -2.477 0.473 1.00 . A A . 6 TYR H 1 1 4 793 1 1 6 TYR HA H -2.104 -3.842 1.529 1.00 . A A . 6 TYR HA 1 1 4 794 1 1 6 TYR HB2 H -2.181 -5.311 -1.115 1.00 . A A . 6 TYR HB2 1 1 4 795 1 1 6 TYR HB3 H -1.528 -5.957 0.383 1.00 . A A . 6 TYR HB3 1 1 4 796 1 1 6 TYR HD1 H -4.275 -4.081 1.369 1.00 . A A . 6 TYR HD1 1 1 4 797 1 1 6 TYR HD2 H -3.326 -7.712 -0.640 1.00 . A A . 6 TYR HD2 1 1 4 798 1 1 6 TYR HE1 H -6.489 -4.972 1.945 1.00 . A A . 6 TYR HE1 1 1 4 799 1 1 6 TYR HE2 H -5.539 -8.612 -0.064 1.00 . A A . 6 TYR HE2 1 1 4 800 1 1 6 TYR HH H -7.918 -7.429 0.501 1.00 . A A . 6 TYR HH 1 1 4 801 1 1 6 TYR N N -2.958 -2.935 -0.117 1.00 . A A . 6 TYR N 1 1 4 802 1 1 6 TYR O O 0.147 -4.186 -0.593 1.00 . A A . 6 TYR O 1 1 4 803 1 1 6 TYR OH O -7.388 -7.348 1.298 1.00 . A A . 6 TYR OH 1 1 4 804 1 1 7 TRP C C 2.250 -2.731 0.879 1.00 . A A . 7 TRP C 1 1 4 805 1 1 7 TRP CA C 1.192 -1.789 0.314 1.00 . A A . 7 TRP CA 1 1 4 806 1 1 7 TRP CB C 1.368 -0.391 0.909 1.00 . A A . 7 TRP CB 1 1 4 807 1 1 7 TRP CD1 C 1.887 -1.030 3.335 1.00 . A A . 7 TRP CD1 1 1 4 808 1 1 7 TRP CD2 C 0.198 0.422 3.107 1.00 . A A . 7 TRP CD2 1 1 4 809 1 1 7 TRP CE2 C 0.379 0.156 4.478 1.00 . A A . 7 TRP CE2 1 1 4 810 1 1 7 TRP CE3 C -0.808 1.311 2.721 1.00 . A A . 7 TRP CE3 1 1 4 811 1 1 7 TRP CG C 1.172 -0.347 2.394 1.00 . A A . 7 TRP CG 1 1 4 812 1 1 7 TRP CH2 C -1.388 1.612 5.054 1.00 . A A . 7 TRP CH2 1 1 4 813 1 1 7 TRP CZ2 C -0.410 0.746 5.462 1.00 . A A . 7 TRP CZ2 1 1 4 814 1 1 7 TRP CZ3 C -1.591 1.896 3.699 1.00 . A A . 7 TRP CZ3 1 1 4 815 1 1 7 TRP H H -0.762 -1.755 1.128 1.00 . A A . 7 TRP H 1 1 4 816 1 1 7 TRP HA H 1.315 -1.731 -0.758 1.00 . A A . 7 TRP HA 1 1 4 817 1 1 7 TRP HB2 H 2.364 -0.037 0.694 1.00 . A A . 7 TRP HB2 1 1 4 818 1 1 7 TRP HB3 H 0.649 0.278 0.457 1.00 . A A . 7 TRP HB3 1 1 4 819 1 1 7 TRP HD1 H 2.701 -1.704 3.111 1.00 . A A . 7 TRP HD1 1 1 4 820 1 1 7 TRP HE1 H 1.764 -1.100 5.431 1.00 . A A . 7 TRP HE1 1 1 4 821 1 1 7 TRP HE3 H -0.980 1.542 1.681 1.00 . A A . 7 TRP HE3 1 1 4 822 1 1 7 TRP HH2 H -2.024 2.092 5.784 1.00 . A A . 7 TRP HH2 1 1 4 823 1 1 7 TRP HZ2 H -0.266 0.538 6.511 1.00 . A A . 7 TRP HZ2 1 1 4 824 1 1 7 TRP HZ3 H -2.375 2.585 3.419 1.00 . A A . 7 TRP HZ3 1 1 4 825 1 1 7 TRP N N -0.150 -2.291 0.582 1.00 . A A . 7 TRP N 1 1 4 826 1 1 7 TRP NE1 N 1.415 -0.734 4.591 1.00 . A A . 7 TRP NE1 1 1 4 827 1 1 7 TRP O O 1.994 -3.473 1.826 1.00 . A A . 7 TRP O 1 1 4 828 1 1 8 TRP C C 5.876 -2.833 0.471 1.00 . A A . 8 TRP C 1 1 4 829 1 1 8 TRP CA C 4.541 -3.541 0.732 1.00 . A A . 8 TRP CA 1 1 4 830 1 1 8 TRP CB C 4.482 -4.890 0.003 1.00 . A A . 8 TRP CB 1 1 4 831 1 1 8 TRP CD1 C 5.725 -7.120 -0.139 1.00 . A A . 8 TRP CD1 1 1 4 832 1 1 8 TRP CD2 C 6.527 -5.760 1.453 1.00 . A A . 8 TRP CD2 1 1 4 833 1 1 8 TRP CE2 C 7.287 -6.948 1.445 1.00 . A A . 8 TRP CE2 1 1 4 834 1 1 8 TRP CE3 C 6.855 -4.767 2.387 1.00 . A A . 8 TRP CE3 1 1 4 835 1 1 8 TRP CG C 5.550 -5.878 0.398 1.00 . A A . 8 TRP CG 1 1 4 836 1 1 8 TRP CH2 C 8.632 -6.182 3.227 1.00 . A A . 8 TRP CH2 1 1 4 837 1 1 8 TRP CZ2 C 8.341 -7.169 2.327 1.00 . A A . 8 TRP CZ2 1 1 4 838 1 1 8 TRP CZ3 C 7.899 -4.992 3.264 1.00 . A A . 8 TRP CZ3 1 1 4 839 1 1 8 TRP H H 3.583 -2.079 -0.459 1.00 . A A . 8 TRP H 1 1 4 840 1 1 8 TRP HA H 4.436 -3.704 1.789 1.00 . A A . 8 TRP HA 1 1 4 841 1 1 8 TRP HB2 H 3.526 -5.349 0.205 1.00 . A A . 8 TRP HB2 1 1 4 842 1 1 8 TRP HB3 H 4.565 -4.717 -1.059 1.00 . A A . 8 TRP HB3 1 1 4 843 1 1 8 TRP HD1 H 5.132 -7.519 -0.949 1.00 . A A . 8 TRP HD1 1 1 4 844 1 1 8 TRP HE1 H 7.118 -8.646 0.228 1.00 . A A . 8 TRP HE1 1 1 4 845 1 1 8 TRP HE3 H 6.303 -3.845 2.441 1.00 . A A . 8 TRP HE3 1 1 4 846 1 1 8 TRP HH2 H 9.439 -6.315 3.932 1.00 . A A . 8 TRP HH2 1 1 4 847 1 1 8 TRP HZ2 H 8.917 -8.082 2.311 1.00 . A A . 8 TRP HZ2 1 1 4 848 1 1 8 TRP HZ3 H 8.161 -4.238 3.991 1.00 . A A . 8 TRP HZ3 1 1 4 849 1 1 8 TRP N N 3.441 -2.693 0.290 1.00 . A A . 8 TRP N 1 1 4 850 1 1 8 TRP NE1 N 6.784 -7.755 0.461 1.00 . A A . 8 TRP NE1 1 1 4 851 1 1 8 TRP O O 6.306 -2.000 1.268 1.00 . A A . 8 TRP O 1 1 4 852 1 1 9 ARG C C 7.681 -1.024 -1.072 1.00 . A A . 9 ARG C 1 1 4 853 1 1 9 ARG CA C 7.801 -2.547 -0.991 1.00 . A A . 9 ARG CA 1 1 4 854 1 1 9 ARG CB C 8.320 -3.106 -2.319 1.00 . A A . 9 ARG CB 1 1 4 855 1 1 9 ARG CD C 9.563 -5.007 -1.245 1.00 . A A . 9 ARG CD 1 1 4 856 1 1 9 ARG CG C 8.544 -4.609 -2.300 1.00 . A A . 9 ARG CG 1 1 4 857 1 1 9 ARG CZ C 10.632 -7.055 -0.385 1.00 . A A . 9 ARG CZ 1 1 4 858 1 1 9 ARG H H 6.136 -3.826 -1.241 1.00 . A A . 9 ARG H 1 1 4 859 1 1 9 ARG HA H 8.506 -2.795 -0.211 1.00 . A A . 9 ARG HA 1 1 4 860 1 1 9 ARG HB2 H 7.607 -2.882 -3.096 1.00 . A A . 9 ARG HB2 1 1 4 861 1 1 9 ARG HB3 H 9.258 -2.627 -2.554 1.00 . A A . 9 ARG HB3 1 1 4 862 1 1 9 ARG HD2 H 10.498 -4.512 -1.461 1.00 . A A . 9 ARG HD2 1 1 4 863 1 1 9 ARG HD3 H 9.204 -4.690 -0.277 1.00 . A A . 9 ARG HD3 1 1 4 864 1 1 9 ARG HE H 9.281 -6.999 -1.854 1.00 . A A . 9 ARG HE 1 1 4 865 1 1 9 ARG HG2 H 7.608 -5.100 -2.084 1.00 . A A . 9 ARG HG2 1 1 4 866 1 1 9 ARG HG3 H 8.902 -4.922 -3.270 1.00 . A A . 9 ARG HG3 1 1 4 867 1 1 9 ARG HH11 H 11.231 -5.352 0.526 1.00 . A A . 9 ARG HH11 1 1 4 868 1 1 9 ARG HH12 H 11.966 -6.805 1.112 1.00 . A A . 9 ARG HH12 1 1 4 869 1 1 9 ARG HH21 H 10.248 -8.913 -1.085 1.00 . A A . 9 ARG HH21 1 1 4 870 1 1 9 ARG HH22 H 11.410 -8.827 0.198 1.00 . A A . 9 ARG HH22 1 1 4 871 1 1 9 ARG N N 6.523 -3.161 -0.642 1.00 . A A . 9 ARG N 1 1 4 872 1 1 9 ARG NE N 9.788 -6.451 -1.218 1.00 . A A . 9 ARG NE 1 1 4 873 1 1 9 ARG NH1 N 11.334 -6.345 0.489 1.00 . A A . 9 ARG NH1 1 1 4 874 1 1 9 ARG NH2 N 10.775 -8.373 -0.427 1.00 . A A . 9 ARG NH2 1 1 4 875 1 1 9 ARG O O 8.505 -0.304 -0.509 1.00 . A A . 9 ARG O 1 1 4 876 1 1 10 PRO C C 5.707 1.522 -0.708 1.00 . A A . 10 PRO C 1 1 4 877 1 1 10 PRO CA C 6.442 0.932 -1.907 1.00 . A A . 10 PRO CA 1 1 4 878 1 1 10 PRO CB C 5.586 1.026 -3.167 1.00 . A A . 10 PRO CB 1 1 4 879 1 1 10 PRO CD C 5.606 -1.277 -2.477 1.00 . A A . 10 PRO CD 1 1 4 880 1 1 10 PRO CG C 4.770 -0.220 -3.157 1.00 . A A . 10 PRO CG 1 1 4 881 1 1 10 PRO HA H 7.373 1.459 -2.056 1.00 . A A . 10 PRO HA 1 1 4 882 1 1 10 PRO HB2 H 4.963 1.908 -3.120 1.00 . A A . 10 PRO HB2 1 1 4 883 1 1 10 PRO HB3 H 6.224 1.073 -4.037 1.00 . A A . 10 PRO HB3 1 1 4 884 1 1 10 PRO HD2 H 5.005 -1.835 -1.777 1.00 . A A . 10 PRO HD2 1 1 4 885 1 1 10 PRO HD3 H 6.043 -1.937 -3.209 1.00 . A A . 10 PRO HD3 1 1 4 886 1 1 10 PRO HG2 H 3.857 -0.055 -2.605 1.00 . A A . 10 PRO HG2 1 1 4 887 1 1 10 PRO HG3 H 4.545 -0.517 -4.170 1.00 . A A . 10 PRO HG3 1 1 4 888 1 1 10 PRO N N 6.651 -0.507 -1.770 1.00 . A A . 10 PRO N 1 1 4 889 1 1 10 PRO O O 5.612 0.893 0.346 1.00 . A A . 10 PRO O 1 1 4 890 1 1 11 SER C C 3.656 4.583 -0.351 1.00 . A A . 11 SER C 1 1 4 891 1 1 11 SER CA C 4.459 3.406 0.195 1.00 . A A . 11 SER CA 1 1 4 892 1 1 11 SER CB C 5.430 3.892 1.273 1.00 . A A . 11 SER CB 1 1 4 893 1 1 11 SER H H 5.294 3.182 -1.737 1.00 . A A . 11 SER H 1 1 4 894 1 1 11 SER HA H 3.777 2.692 0.632 1.00 . A A . 11 SER HA 1 1 4 895 1 1 11 SER HB2 H 6.134 4.584 0.835 1.00 . A A . 11 SER HB2 1 1 4 896 1 1 11 SER HB3 H 4.876 4.389 2.055 1.00 . A A . 11 SER HB3 1 1 4 897 1 1 11 SER HG H 5.891 2.702 2.758 1.00 . A A . 11 SER HG 1 1 4 898 1 1 11 SER N N 5.187 2.732 -0.875 1.00 . A A . 11 SER N 1 1 4 899 1 1 11 SER O O 4.212 5.639 -0.653 1.00 . A A . 11 SER O 1 1 4 900 1 1 11 SER OG O 6.147 2.809 1.839 1.00 . A A . 11 SER OG 1 1 4 901 1 1 12 ILE C C 1.852 5.827 -2.408 1.00 . A A . 12 ILE C 1 1 4 902 1 1 12 ILE CA C 1.469 5.439 -0.983 1.00 . A A . 12 ILE CA 1 1 4 903 1 1 12 ILE CB C 1.512 6.693 -0.083 1.00 . A A . 12 ILE CB 1 1 4 904 1 1 12 ILE CD1 C -0.339 5.792 1.414 1.00 . A A . 12 ILE CD1 1 1 4 905 1 1 12 ILE CG1 C 1.070 6.340 1.337 1.00 . A A . 12 ILE CG1 1 1 4 906 1 1 12 ILE CG2 C 0.632 7.796 -0.655 1.00 . A A . 12 ILE CG2 1 1 4 907 1 1 12 ILE H H 1.963 3.529 -0.216 1.00 . A A . 12 ILE H 1 1 4 908 1 1 12 ILE HA H 0.459 5.056 -0.983 1.00 . A A . 12 ILE HA 1 1 4 909 1 1 12 ILE HB H 2.529 7.055 -0.057 1.00 . A A . 12 ILE HB 1 1 4 910 1 1 12 ILE HD11 H -0.685 5.829 2.436 1.00 . A A . 12 ILE HD11 1 1 4 911 1 1 12 ILE HD12 H -0.344 4.768 1.068 1.00 . A A . 12 ILE HD12 1 1 4 912 1 1 12 ILE HD13 H -0.990 6.385 0.789 1.00 . A A . 12 ILE HD13 1 1 4 913 1 1 12 ILE HG12 H 1.738 5.594 1.741 1.00 . A A . 12 ILE HG12 1 1 4 914 1 1 12 ILE HG13 H 1.114 7.228 1.952 1.00 . A A . 12 ILE HG13 1 1 4 915 1 1 12 ILE HG21 H -0.350 7.398 -0.868 1.00 . A A . 12 ILE HG21 1 1 4 916 1 1 12 ILE HG22 H 1.072 8.172 -1.567 1.00 . A A . 12 ILE HG22 1 1 4 917 1 1 12 ILE HG23 H 0.548 8.599 0.062 1.00 . A A . 12 ILE HG23 1 1 4 918 1 1 12 ILE N N 2.347 4.393 -0.474 1.00 . A A . 12 ILE N 1 1 4 919 1 1 12 ILE O O 1.114 5.450 -3.342 1.00 . A A . 12 ILE O 1 1 4 920 1 1 12 ILE OXT O 2.887 6.505 -2.578 1.00 . A A . 12 ILE OXT 1 1 5 921 1 1 1 HIS C C -5.744 3.021 5.412 1.00 . A A . 1 HIS C 1 1 5 922 1 1 1 HIS CA C -5.108 4.093 6.295 1.00 . A A . 1 HIS CA 1 1 5 923 1 1 1 HIS CB C -4.395 3.442 7.482 1.00 . A A . 1 HIS CB 1 1 5 924 1 1 1 HIS CD2 C -3.872 4.698 9.691 1.00 . A A . 1 HIS CD2 1 1 5 925 1 1 1 HIS CE1 C -2.283 6.011 8.945 1.00 . A A . 1 HIS CE1 1 1 5 926 1 1 1 HIS CG C -3.703 4.424 8.375 1.00 . A A . 1 HIS CG 1 1 5 927 1 1 1 HIS H1 H -6.702 5.364 6.012 1.00 . A A . 1 HIS H1 1 1 5 928 1 1 1 HIS H2 H -5.632 5.828 7.270 1.00 . A A . 1 HIS H2 1 1 5 929 1 1 1 HIS H3 H -6.719 4.520 7.504 1.00 . A A . 1 HIS H3 1 1 5 930 1 1 1 HIS HA H -4.392 4.652 5.714 1.00 . A A . 1 HIS HA 1 1 5 931 1 1 1 HIS HB2 H -5.118 2.905 8.078 1.00 . A A . 1 HIS HB2 1 1 5 932 1 1 1 HIS HB3 H -3.655 2.749 7.111 1.00 . A A . 1 HIS HB3 1 1 5 933 1 1 1 HIS HD1 H -2.346 5.306 7.025 1.00 . A A . 1 HIS HD1 1 1 5 934 1 1 1 HIS HD2 H -4.579 4.226 10.359 1.00 . A A . 1 HIS HD2 1 1 5 935 1 1 1 HIS HE1 H -1.506 6.760 8.896 1.00 . A A . 1 HIS HE1 1 1 5 936 1 1 1 HIS HE2 H -2.800 6.015 10.925 1.00 . A A . 1 HIS HE2 1 1 5 937 1 1 1 HIS N N -6.133 5.037 6.817 1.00 . A A . 1 HIS N 1 1 5 938 1 1 1 HIS ND1 N -2.700 5.264 7.937 1.00 . A A . 1 HIS ND1 1 1 5 939 1 1 1 HIS NE2 N -2.978 5.688 10.019 1.00 . A A . 1 HIS NE2 1 1 5 940 1 1 1 HIS O O -6.200 1.991 5.906 1.00 . A A . 1 HIS O 1 1 5 941 1 1 2 PRO C C -5.550 1.012 3.037 1.00 . A A . 2 PRO C 1 1 5 942 1 1 2 PRO CA C -6.366 2.295 3.140 1.00 . A A . 2 PRO CA 1 1 5 943 1 1 2 PRO CB C -6.348 3.052 1.809 1.00 . A A . 2 PRO CB 1 1 5 944 1 1 2 PRO CD C -5.262 4.453 3.410 1.00 . A A . 2 PRO CD 1 1 5 945 1 1 2 PRO CG C -5.263 4.060 1.960 1.00 . A A . 2 PRO CG 1 1 5 946 1 1 2 PRO HA H -7.386 2.051 3.404 1.00 . A A . 2 PRO HA 1 1 5 947 1 1 2 PRO HB2 H -6.137 2.362 1.004 1.00 . A A . 2 PRO HB2 1 1 5 948 1 1 2 PRO HB3 H -7.304 3.522 1.645 1.00 . A A . 2 PRO HB3 1 1 5 949 1 1 2 PRO HD2 H -4.257 4.677 3.740 1.00 . A A . 2 PRO HD2 1 1 5 950 1 1 2 PRO HD3 H -5.911 5.300 3.574 1.00 . A A . 2 PRO HD3 1 1 5 951 1 1 2 PRO HG2 H -4.313 3.623 1.688 1.00 . A A . 2 PRO HG2 1 1 5 952 1 1 2 PRO HG3 H -5.472 4.920 1.340 1.00 . A A . 2 PRO HG3 1 1 5 953 1 1 2 PRO N N -5.782 3.250 4.088 1.00 . A A . 2 PRO N 1 1 5 954 1 1 2 PRO O O -4.418 1.022 2.553 1.00 . A A . 2 PRO O 1 1 5 955 1 1 3 LEU C C -6.000 -2.267 2.330 1.00 . A A . 3 LEU C 1 1 5 956 1 1 3 LEU CA C -5.461 -1.384 3.455 1.00 . A A . 3 LEU CA 1 1 5 957 1 1 3 LEU CB C -5.590 -2.087 4.812 1.00 . A A . 3 LEU CB 1 1 5 958 1 1 3 LEU CD1 C -7.777 -3.250 4.323 1.00 . A A . 3 LEU CD1 1 1 5 959 1 1 3 LEU CD2 C -7.008 -2.960 6.685 1.00 . A A . 3 LEU CD2 1 1 5 960 1 1 3 LEU CG C -7.021 -2.352 5.291 1.00 . A A . 3 LEU CG 1 1 5 961 1 1 3 LEU H H -7.037 -0.034 3.868 1.00 . A A . 3 LEU H 1 1 5 962 1 1 3 LEU HA H -4.416 -1.197 3.266 1.00 . A A . 3 LEU HA 1 1 5 963 1 1 3 LEU HB2 H -5.075 -3.034 4.751 1.00 . A A . 3 LEU HB2 1 1 5 964 1 1 3 LEU HB3 H -5.096 -1.478 5.553 1.00 . A A . 3 LEU HB3 1 1 5 965 1 1 3 LEU HD11 H -8.614 -3.703 4.833 1.00 . A A . 3 LEU HD11 1 1 5 966 1 1 3 LEU HD12 H -7.117 -4.023 3.958 1.00 . A A . 3 LEU HD12 1 1 5 967 1 1 3 LEU HD13 H -8.138 -2.662 3.493 1.00 . A A . 3 LEU HD13 1 1 5 968 1 1 3 LEU HD21 H -6.492 -2.296 7.363 1.00 . A A . 3 LEU HD21 1 1 5 969 1 1 3 LEU HD22 H -6.499 -3.912 6.658 1.00 . A A . 3 LEU HD22 1 1 5 970 1 1 3 LEU HD23 H -8.023 -3.104 7.025 1.00 . A A . 3 LEU HD23 1 1 5 971 1 1 3 LEU HG H -7.546 -1.411 5.345 1.00 . A A . 3 LEU HG 1 1 5 972 1 1 3 LEU N N -6.132 -0.091 3.494 1.00 . A A . 3 LEU N 1 1 5 973 1 1 3 LEU O O -5.767 -3.476 2.314 1.00 . A A . 3 LEU O 1 1 5 974 1 1 4 LYS C C -6.291 -2.494 -0.888 1.00 . A A . 4 LYS C 1 1 5 975 1 1 4 LYS CA C -7.286 -2.396 0.266 1.00 . A A . 4 LYS CA 1 1 5 976 1 1 4 LYS CB C -8.575 -1.726 -0.213 1.00 . A A . 4 LYS CB 1 1 5 977 1 1 4 LYS CD C -10.506 -1.727 -1.822 1.00 . A A . 4 LYS CD 1 1 5 978 1 1 4 LYS CE C -11.162 -2.436 -2.995 1.00 . A A . 4 LYS CE 1 1 5 979 1 1 4 LYS CG C -9.232 -2.435 -1.386 1.00 . A A . 4 LYS CG 1 1 5 980 1 1 4 LYS H H -6.872 -0.693 1.452 1.00 . A A . 4 LYS H 1 1 5 981 1 1 4 LYS HA H -7.515 -3.391 0.608 1.00 . A A . 4 LYS HA 1 1 5 982 1 1 4 LYS HB2 H -9.279 -1.701 0.605 1.00 . A A . 4 LYS HB2 1 1 5 983 1 1 4 LYS HB3 H -8.350 -0.713 -0.513 1.00 . A A . 4 LYS HB3 1 1 5 984 1 1 4 LYS HD2 H -11.197 -1.708 -0.994 1.00 . A A . 4 LYS HD2 1 1 5 985 1 1 4 LYS HD3 H -10.262 -0.717 -2.114 1.00 . A A . 4 LYS HD3 1 1 5 986 1 1 4 LYS HE2 H -10.468 -2.456 -3.822 1.00 . A A . 4 LYS HE2 1 1 5 987 1 1 4 LYS HE3 H -11.401 -3.448 -2.701 1.00 . A A . 4 LYS HE3 1 1 5 988 1 1 4 LYS HG2 H -8.541 -2.453 -2.216 1.00 . A A . 4 LYS HG2 1 1 5 989 1 1 4 LYS HG3 H -9.474 -3.446 -1.093 1.00 . A A . 4 LYS HG3 1 1 5 990 1 1 4 LYS HZ1 H -13.117 -2.452 -3.734 1.00 . A A . 4 LYS HZ1 1 1 5 991 1 1 4 LYS HZ2 H -12.209 -1.112 -4.225 1.00 . A A . 4 LYS HZ2 1 1 5 992 1 1 4 LYS HZ3 H -12.805 -1.194 -2.645 1.00 . A A . 4 LYS HZ3 1 1 5 993 1 1 4 LYS N N -6.719 -1.658 1.390 1.00 . A A . 4 LYS N 1 1 5 994 1 1 4 LYS NZ N -12.410 -1.750 -3.430 1.00 . A A . 4 LYS NZ 1 1 5 995 1 1 4 LYS O O -6.431 -3.340 -1.770 1.00 . A A . 4 LYS O 1 1 5 996 1 1 5 GLN C C -3.165 -2.621 -1.628 1.00 . A A . 5 GLN C 1 1 5 997 1 1 5 GLN CA C -4.271 -1.611 -1.922 1.00 . A A . 5 GLN CA 1 1 5 998 1 1 5 GLN CB C -3.674 -0.211 -2.068 1.00 . A A . 5 GLN CB 1 1 5 999 1 1 5 GLN CD C -2.029 1.285 -3.269 1.00 . A A . 5 GLN CD 1 1 5 1000 1 1 5 GLN CG C -2.605 -0.112 -3.145 1.00 . A A . 5 GLN CG 1 1 5 1001 1 1 5 GLN H H -5.229 -0.971 -0.147 1.00 . A A . 5 GLN H 1 1 5 1002 1 1 5 GLN HA H -4.751 -1.885 -2.848 1.00 . A A . 5 GLN HA 1 1 5 1003 1 1 5 GLN HB2 H -4.466 0.483 -2.313 1.00 . A A . 5 GLN HB2 1 1 5 1004 1 1 5 GLN HB3 H -3.233 0.080 -1.125 1.00 . A A . 5 GLN HB3 1 1 5 1005 1 1 5 GLN HE21 H -0.212 0.600 -2.844 1.00 . A A . 5 GLN HE21 1 1 5 1006 1 1 5 GLN HE22 H -0.324 2.299 -3.136 1.00 . A A . 5 GLN HE22 1 1 5 1007 1 1 5 GLN HG2 H -1.804 -0.795 -2.902 1.00 . A A . 5 GLN HG2 1 1 5 1008 1 1 5 GLN HG3 H -3.041 -0.392 -4.093 1.00 . A A . 5 GLN HG3 1 1 5 1009 1 1 5 GLN N N -5.287 -1.623 -0.876 1.00 . A A . 5 GLN N 1 1 5 1010 1 1 5 GLN NE2 N -0.724 1.407 -3.062 1.00 . A A . 5 GLN NE2 1 1 5 1011 1 1 5 GLN O O -2.445 -3.048 -2.531 1.00 . A A . 5 GLN O 1 1 5 1012 1 1 5 GLN OE1 O -2.749 2.243 -3.550 1.00 . A A . 5 GLN OE1 1 1 5 1013 1 1 6 TYR C C -0.617 -3.429 -0.260 1.00 . A A . 6 TYR C 1 1 5 1014 1 1 6 TYR CA C -2.014 -3.957 0.049 1.00 . A A . 6 TYR CA 1 1 5 1015 1 1 6 TYR CB C -2.231 -5.301 -0.653 1.00 . A A . 6 TYR CB 1 1 5 1016 1 1 6 TYR CD1 C -4.500 -5.359 0.488 1.00 . A A . 6 TYR CD1 1 1 5 1017 1 1 6 TYR CD2 C -3.898 -7.176 -0.936 1.00 . A A . 6 TYR CD2 1 1 5 1018 1 1 6 TYR CE1 C -5.714 -5.964 0.750 1.00 . A A . 6 TYR CE1 1 1 5 1019 1 1 6 TYR CE2 C -5.113 -7.784 -0.678 1.00 . A A . 6 TYR CE2 1 1 5 1020 1 1 6 TYR CG C -3.569 -5.955 -0.361 1.00 . A A . 6 TYR CG 1 1 5 1021 1 1 6 TYR CZ C -6.017 -7.173 0.164 1.00 . A A . 6 TYR CZ 1 1 5 1022 1 1 6 TYR H H -3.636 -2.623 0.313 1.00 . A A . 6 TYR H 1 1 5 1023 1 1 6 TYR HA H -2.104 -4.099 1.116 1.00 . A A . 6 TYR HA 1 1 5 1024 1 1 6 TYR HB2 H -2.165 -5.152 -1.721 1.00 . A A . 6 TYR HB2 1 1 5 1025 1 1 6 TYR HB3 H -1.454 -5.986 -0.344 1.00 . A A . 6 TYR HB3 1 1 5 1026 1 1 6 TYR HD1 H -4.263 -4.412 0.947 1.00 . A A . 6 TYR HD1 1 1 5 1027 1 1 6 TYR HD2 H -3.190 -7.651 -1.597 1.00 . A A . 6 TYR HD2 1 1 5 1028 1 1 6 TYR HE1 H -6.423 -5.484 1.411 1.00 . A A . 6 TYR HE1 1 1 5 1029 1 1 6 TYR HE2 H -5.349 -8.733 -1.136 1.00 . A A . 6 TYR HE2 1 1 5 1030 1 1 6 TYR HH H -7.095 -8.721 0.537 1.00 . A A . 6 TYR HH 1 1 5 1031 1 1 6 TYR N N -3.034 -2.998 -0.361 1.00 . A A . 6 TYR N 1 1 5 1032 1 1 6 TYR O O -0.042 -3.740 -1.302 1.00 . A A . 6 TYR O 1 1 5 1033 1 1 6 TYR OH O -7.226 -7.777 0.424 1.00 . A A . 6 TYR OH 1 1 5 1034 1 1 7 TRP C C 2.334 -3.063 0.876 1.00 . A A . 7 TRP C 1 1 5 1035 1 1 7 TRP CA C 1.255 -2.061 0.477 1.00 . A A . 7 TRP CA 1 1 5 1036 1 1 7 TRP CB C 1.403 -0.783 1.304 1.00 . A A . 7 TRP CB 1 1 5 1037 1 1 7 TRP CD1 C 1.941 -1.821 3.585 1.00 . A A . 7 TRP CD1 1 1 5 1038 1 1 7 TRP CD2 C 0.225 -0.384 3.609 1.00 . A A . 7 TRP CD2 1 1 5 1039 1 1 7 TRP CE2 C 0.413 -0.880 4.913 1.00 . A A . 7 TRP CE2 1 1 5 1040 1 1 7 TRP CE3 C -0.799 0.538 3.380 1.00 . A A . 7 TRP CE3 1 1 5 1041 1 1 7 TRP CG C 1.211 -1.001 2.774 1.00 . A A . 7 TRP CG 1 1 5 1042 1 1 7 TRP CH2 C -1.381 0.421 5.730 1.00 . A A . 7 TRP CH2 1 1 5 1043 1 1 7 TRP CZ2 C -0.386 -0.483 5.982 1.00 . A A . 7 TRP CZ2 1 1 5 1044 1 1 7 TRP CZ3 C -1.592 0.931 4.442 1.00 . A A . 7 TRP CZ3 1 1 5 1045 1 1 7 TRP H H -0.582 -2.419 1.465 1.00 . A A . 7 TRP H 1 1 5 1046 1 1 7 TRP HA H 1.375 -1.818 -0.568 1.00 . A A . 7 TRP HA 1 1 5 1047 1 1 7 TRP HB2 H 2.392 -0.377 1.154 1.00 . A A . 7 TRP HB2 1 1 5 1048 1 1 7 TRP HB3 H 0.669 -0.062 0.974 1.00 . A A . 7 TRP HB3 1 1 5 1049 1 1 7 TRP HD1 H 2.768 -2.430 3.248 1.00 . A A . 7 TRP HD1 1 1 5 1050 1 1 7 TRP HE1 H 1.823 -2.254 5.637 1.00 . A A . 7 TRP HE1 1 1 5 1051 1 1 7 TRP HE3 H -0.975 0.943 2.394 1.00 . A A . 7 TRP HE3 1 1 5 1052 1 1 7 TRP HH2 H -2.025 0.756 6.529 1.00 . A A . 7 TRP HH2 1 1 5 1053 1 1 7 TRP HZ2 H -0.237 -0.867 6.981 1.00 . A A . 7 TRP HZ2 1 1 5 1054 1 1 7 TRP HZ3 H -2.388 1.643 4.284 1.00 . A A . 7 TRP HZ3 1 1 5 1055 1 1 7 TRP N N -0.075 -2.630 0.654 1.00 . A A . 7 TRP N 1 1 5 1056 1 1 7 TRP NE1 N 1.466 -1.756 4.873 1.00 . A A . 7 TRP NE1 1 1 5 1057 1 1 7 TRP O O 2.035 -4.149 1.371 1.00 . A A . 7 TRP O 1 1 5 1058 1 1 8 TRP C C 6.031 -2.819 0.699 1.00 . A A . 8 TRP C 1 1 5 1059 1 1 8 TRP CA C 4.717 -3.550 0.994 1.00 . A A . 8 TRP CA 1 1 5 1060 1 1 8 TRP CB C 4.626 -4.858 0.195 1.00 . A A . 8 TRP CB 1 1 5 1061 1 1 8 TRP CD1 C 5.869 -7.068 -0.135 1.00 . A A . 8 TRP CD1 1 1 5 1062 1 1 8 TRP CD2 C 6.744 -5.794 1.489 1.00 . A A . 8 TRP CD2 1 1 5 1063 1 1 8 TRP CE2 C 7.507 -6.976 1.376 1.00 . A A . 8 TRP CE2 1 1 5 1064 1 1 8 TRP CE3 C 7.113 -4.855 2.462 1.00 . A A . 8 TRP CE3 1 1 5 1065 1 1 8 TRP CG C 5.715 -5.858 0.479 1.00 . A A . 8 TRP CG 1 1 5 1066 1 1 8 TRP CH2 C 8.935 -6.303 3.131 1.00 . A A . 8 TRP CH2 1 1 5 1067 1 1 8 TRP CZ2 C 8.604 -7.238 2.192 1.00 . A A . 8 TRP CZ2 1 1 5 1068 1 1 8 TRP CZ3 C 8.200 -5.123 3.272 1.00 . A A . 8 TRP CZ3 1 1 5 1069 1 1 8 TRP H H 3.765 -1.808 0.260 1.00 . A A . 8 TRP H 1 1 5 1070 1 1 8 TRP HA H 4.669 -3.772 2.044 1.00 . A A . 8 TRP HA 1 1 5 1071 1 1 8 TRP HB2 H 3.684 -5.334 0.420 1.00 . A A . 8 TRP HB2 1 1 5 1072 1 1 8 TRP HB3 H 4.653 -4.627 -0.859 1.00 . A A . 8 TRP HB3 1 1 5 1073 1 1 8 TRP HD1 H 5.239 -7.425 -0.937 1.00 . A A . 8 TRP HD1 1 1 5 1074 1 1 8 TRP HE1 H 7.286 -8.602 0.074 1.00 . A A . 8 TRP HE1 1 1 5 1075 1 1 8 TRP HE3 H 6.559 -3.942 2.596 1.00 . A A . 8 TRP HE3 1 1 5 1076 1 1 8 TRP HH2 H 9.777 -6.470 3.788 1.00 . A A . 8 TRP HH2 1 1 5 1077 1 1 8 TRP HZ2 H 9.184 -8.144 2.095 1.00 . A A . 8 TRP HZ2 1 1 5 1078 1 1 8 TRP HZ3 H 8.494 -4.409 4.028 1.00 . A A . 8 TRP HZ3 1 1 5 1079 1 1 8 TRP N N 3.591 -2.687 0.657 1.00 . A A . 8 TRP N 1 1 5 1080 1 1 8 TRP NE1 N 6.959 -7.727 0.373 1.00 . A A . 8 TRP NE1 1 1 5 1081 1 1 8 TRP O O 6.528 -2.063 1.533 1.00 . A A . 8 TRP O 1 1 5 1082 1 1 9 ARG C C 7.646 -0.898 -1.097 1.00 . A A . 9 ARG C 1 1 5 1083 1 1 9 ARG CA C 7.833 -2.401 -0.880 1.00 . A A . 9 ARG CA 1 1 5 1084 1 1 9 ARG CB C 8.389 -3.050 -2.149 1.00 . A A . 9 ARG CB 1 1 5 1085 1 1 9 ARG CD C 9.711 -4.787 -0.903 1.00 . A A . 9 ARG CD 1 1 5 1086 1 1 9 ARG CG C 8.684 -4.533 -1.994 1.00 . A A . 9 ARG CG 1 1 5 1087 1 1 9 ARG CZ C 10.868 -6.696 0.142 1.00 . A A . 9 ARG CZ 1 1 5 1088 1 1 9 ARG H H 6.144 -3.648 -1.110 1.00 . A A . 9 ARG H 1 1 5 1089 1 1 9 ARG HA H 8.542 -2.546 -0.078 1.00 . A A . 9 ARG HA 1 1 5 1090 1 1 9 ARG HB2 H 7.671 -2.930 -2.946 1.00 . A A . 9 ARG HB2 1 1 5 1091 1 1 9 ARG HB3 H 9.306 -2.550 -2.425 1.00 . A A . 9 ARG HB3 1 1 5 1092 1 1 9 ARG HD2 H 10.624 -4.268 -1.159 1.00 . A A . 9 ARG HD2 1 1 5 1093 1 1 9 ARG HD3 H 9.329 -4.401 0.029 1.00 . A A . 9 ARG HD3 1 1 5 1094 1 1 9 ARG HE H 9.530 -6.836 -1.331 1.00 . A A . 9 ARG HE 1 1 5 1095 1 1 9 ARG HG2 H 7.769 -5.048 -1.740 1.00 . A A . 9 ARG HG2 1 1 5 1096 1 1 9 ARG HG3 H 9.065 -4.914 -2.931 1.00 . A A . 9 ARG HG3 1 1 5 1097 1 1 9 ARG HH11 H 11.377 -4.892 0.902 1.00 . A A . 9 ARG HH11 1 1 5 1098 1 1 9 ARG HH12 H 12.175 -6.250 1.619 1.00 . A A . 9 ARG HH12 1 1 5 1099 1 1 9 ARG HH21 H 10.579 -8.624 -0.390 1.00 . A A . 9 ARG HH21 1 1 5 1100 1 1 9 ARG HH22 H 11.723 -8.370 0.885 1.00 . A A . 9 ARG HH22 1 1 5 1101 1 1 9 ARG N N 6.585 -3.042 -0.486 1.00 . A A . 9 ARG N 1 1 5 1102 1 1 9 ARG NE N 10.002 -6.209 -0.745 1.00 . A A . 9 ARG NE 1 1 5 1103 1 1 9 ARG NH1 N 11.527 -5.878 0.954 1.00 . A A . 9 ARG NH1 1 1 5 1104 1 1 9 ARG NH2 N 11.073 -8.003 0.219 1.00 . A A . 9 ARG NH2 1 1 5 1105 1 1 9 ARG O O 8.410 -0.093 -0.566 1.00 . A A . 9 ARG O 1 1 5 1106 1 1 10 PRO C C 5.791 1.658 -0.951 1.00 . A A . 10 PRO C 1 1 5 1107 1 1 10 PRO CA C 6.371 0.927 -2.155 1.00 . A A . 10 PRO CA 1 1 5 1108 1 1 10 PRO CB C 5.359 0.890 -3.300 1.00 . A A . 10 PRO CB 1 1 5 1109 1 1 10 PRO CD C 5.658 -1.369 -2.570 1.00 . A A . 10 PRO CD 1 1 5 1110 1 1 10 PRO CG C 4.647 -0.406 -3.132 1.00 . A A . 10 PRO CG 1 1 5 1111 1 1 10 PRO HA H 7.264 1.431 -2.477 1.00 . A A . 10 PRO HA 1 1 5 1112 1 1 10 PRO HB2 H 4.683 1.728 -3.213 1.00 . A A . 10 PRO HB2 1 1 5 1113 1 1 10 PRO HB3 H 5.879 0.935 -4.245 1.00 . A A . 10 PRO HB3 1 1 5 1114 1 1 10 PRO HD2 H 5.185 -2.043 -1.874 1.00 . A A . 10 PRO HD2 1 1 5 1115 1 1 10 PRO HD3 H 6.134 -1.920 -3.367 1.00 . A A . 10 PRO HD3 1 1 5 1116 1 1 10 PRO HG2 H 3.823 -0.285 -2.444 1.00 . A A . 10 PRO HG2 1 1 5 1117 1 1 10 PRO HG3 H 4.290 -0.755 -4.089 1.00 . A A . 10 PRO HG3 1 1 5 1118 1 1 10 PRO N N 6.629 -0.491 -1.884 1.00 . A A . 10 PRO N 1 1 5 1119 1 1 10 PRO O O 5.911 2.878 -0.835 1.00 . A A . 10 PRO O 1 1 5 1120 1 1 11 SER C C 3.652 2.652 0.801 1.00 . A A . 11 SER C 1 1 5 1121 1 1 11 SER CA C 4.563 1.476 1.145 1.00 . A A . 11 SER CA 1 1 5 1122 1 1 11 SER CB C 5.653 1.929 2.118 1.00 . A A . 11 SER CB 1 1 5 1123 1 1 11 SER H H 5.107 -0.060 -0.210 1.00 . A A . 11 SER H 1 1 5 1124 1 1 11 SER HA H 3.971 0.705 1.617 1.00 . A A . 11 SER HA 1 1 5 1125 1 1 11 SER HB2 H 6.269 2.677 1.642 1.00 . A A . 11 SER HB2 1 1 5 1126 1 1 11 SER HB3 H 5.193 2.350 2.999 1.00 . A A . 11 SER HB3 1 1 5 1127 1 1 11 SER HG H 6.707 0.931 3.434 1.00 . A A . 11 SER HG 1 1 5 1128 1 1 11 SER N N 5.164 0.905 -0.057 1.00 . A A . 11 SER N 1 1 5 1129 1 1 11 SER O O 3.478 3.570 1.604 1.00 . A A . 11 SER O 1 1 5 1130 1 1 11 SER OG O 6.475 0.842 2.506 1.00 . A A . 11 SER OG 1 1 5 1131 1 1 12 ILE C C 0.729 3.343 -0.523 1.00 . A A . 12 ILE C 1 1 5 1132 1 1 12 ILE CA C 2.183 3.681 -0.843 1.00 . A A . 12 ILE CA 1 1 5 1133 1 1 12 ILE CB C 2.328 3.931 -2.358 1.00 . A A . 12 ILE CB 1 1 5 1134 1 1 12 ILE CD1 C 4.217 5.597 -1.994 1.00 . A A . 12 ILE CD1 1 1 5 1135 1 1 12 ILE CG1 C 3.764 4.334 -2.695 1.00 . A A . 12 ILE CG1 1 1 5 1136 1 1 12 ILE CG2 C 1.354 5.006 -2.821 1.00 . A A . 12 ILE CG2 1 1 5 1137 1 1 12 ILE H H 3.251 1.861 -0.991 1.00 . A A . 12 ILE H 1 1 5 1138 1 1 12 ILE HA H 2.456 4.587 -0.321 1.00 . A A . 12 ILE HA 1 1 5 1139 1 1 12 ILE HB H 2.088 3.015 -2.877 1.00 . A A . 12 ILE HB 1 1 5 1140 1 1 12 ILE HD11 H 4.805 6.195 -2.674 1.00 . A A . 12 ILE HD11 1 1 5 1141 1 1 12 ILE HD12 H 4.817 5.335 -1.134 1.00 . A A . 12 ILE HD12 1 1 5 1142 1 1 12 ILE HD13 H 3.353 6.160 -1.673 1.00 . A A . 12 ILE HD13 1 1 5 1143 1 1 12 ILE HG12 H 4.433 3.537 -2.405 1.00 . A A . 12 ILE HG12 1 1 5 1144 1 1 12 ILE HG13 H 3.846 4.497 -3.760 1.00 . A A . 12 ILE HG13 1 1 5 1145 1 1 12 ILE HG21 H 0.404 4.552 -3.064 1.00 . A A . 12 ILE HG21 1 1 5 1146 1 1 12 ILE HG22 H 1.750 5.500 -3.696 1.00 . A A . 12 ILE HG22 1 1 5 1147 1 1 12 ILE HG23 H 1.214 5.730 -2.032 1.00 . A A . 12 ILE HG23 1 1 5 1148 1 1 12 ILE N N 3.074 2.618 -0.395 1.00 . A A . 12 ILE N 1 1 5 1149 1 1 12 ILE O O -0.043 4.278 -0.224 1.00 . A A . 12 ILE O 1 1 5 1150 1 1 12 ILE OXT O 0.377 2.146 -0.574 1.00 . A A . 12 ILE OXT 1 1 6 1151 1 1 1 HIS C C -4.909 5.027 3.386 1.00 . A A . 1 HIS C 1 1 6 1152 1 1 1 HIS CA C -4.024 6.240 3.660 1.00 . A A . 1 HIS CA 1 1 6 1153 1 1 1 HIS CB C -3.619 6.275 5.135 1.00 . A A . 1 HIS CB 1 1 6 1154 1 1 1 HIS CD2 C -2.860 8.436 6.351 1.00 . A A . 1 HIS CD2 1 1 6 1155 1 1 1 HIS CE1 C -0.899 8.668 5.397 1.00 . A A . 1 HIS CE1 1 1 6 1156 1 1 1 HIS CG C -2.707 7.411 5.479 1.00 . A A . 1 HIS CG 1 1 6 1157 1 1 1 HIS H1 H -4.022 8.267 3.308 1.00 . A A . 1 HIS H1 1 1 6 1158 1 1 1 HIS H2 H -5.436 7.676 4.079 1.00 . A A . 1 HIS H2 1 1 6 1159 1 1 1 HIS H3 H -5.184 7.387 2.407 1.00 . A A . 1 HIS H3 1 1 6 1160 1 1 1 HIS HA H -3.135 6.174 3.050 1.00 . A A . 1 HIS HA 1 1 6 1161 1 1 1 HIS HB2 H -4.506 6.366 5.742 1.00 . A A . 1 HIS HB2 1 1 6 1162 1 1 1 HIS HB3 H -3.112 5.353 5.383 1.00 . A A . 1 HIS HB3 1 1 6 1163 1 1 1 HIS HD1 H -1.067 7.003 4.221 1.00 . A A . 1 HIS HD1 1 1 6 1164 1 1 1 HIS HD2 H -3.716 8.619 6.983 1.00 . A A . 1 HIS HD2 1 1 6 1165 1 1 1 HIS HE1 H 0.075 9.050 5.128 1.00 . A A . 1 HIS HE1 1 1 6 1166 1 1 1 HIS HE2 H -1.512 9.964 6.859 1.00 . A A . 1 HIS HE2 1 1 6 1167 1 1 1 HIS N N -4.730 7.507 3.333 1.00 . A A . 1 HIS N 1 1 6 1168 1 1 1 HIS ND1 N -1.469 7.585 4.898 1.00 . A A . 1 HIS ND1 1 1 6 1169 1 1 1 HIS NE2 N -1.721 9.203 6.280 1.00 . A A . 1 HIS NE2 1 1 6 1170 1 1 1 HIS O O -5.645 4.575 4.262 1.00 . A A . 1 HIS O 1 1 6 1171 1 1 2 PRO C C -5.210 2.048 2.492 1.00 . A A . 2 PRO C 1 1 6 1172 1 1 2 PRO CA C -5.652 3.317 1.771 1.00 . A A . 2 PRO CA 1 1 6 1173 1 1 2 PRO CB C -5.400 3.192 0.266 1.00 . A A . 2 PRO CB 1 1 6 1174 1 1 2 PRO CD C -3.999 4.960 1.051 1.00 . A A . 2 PRO CD 1 1 6 1175 1 1 2 PRO CG C -4.081 3.847 0.045 1.00 . A A . 2 PRO CG 1 1 6 1176 1 1 2 PRO HA H -6.703 3.483 1.951 1.00 . A A . 2 PRO HA 1 1 6 1177 1 1 2 PRO HB2 H -5.377 2.148 -0.012 1.00 . A A . 2 PRO HB2 1 1 6 1178 1 1 2 PRO HB3 H -6.186 3.696 -0.276 1.00 . A A . 2 PRO HB3 1 1 6 1179 1 1 2 PRO HD2 H -2.979 5.097 1.380 1.00 . A A . 2 PRO HD2 1 1 6 1180 1 1 2 PRO HD3 H -4.388 5.876 0.634 1.00 . A A . 2 PRO HD3 1 1 6 1181 1 1 2 PRO HG2 H -3.286 3.134 0.207 1.00 . A A . 2 PRO HG2 1 1 6 1182 1 1 2 PRO HG3 H -4.031 4.244 -0.958 1.00 . A A . 2 PRO HG3 1 1 6 1183 1 1 2 PRO N N -4.850 4.483 2.157 1.00 . A A . 2 PRO N 1 1 6 1184 1 1 2 PRO O O -4.103 1.978 3.027 1.00 . A A . 2 PRO O 1 1 6 1185 1 1 3 LEU C C -6.309 -1.412 2.357 1.00 . A A . 3 LEU C 1 1 6 1186 1 1 3 LEU CA C -5.782 -0.222 3.158 1.00 . A A . 3 LEU CA 1 1 6 1187 1 1 3 LEU CB C -6.353 -0.227 4.582 1.00 . A A . 3 LEU CB 1 1 6 1188 1 1 3 LEU CD1 C -8.633 -1.127 3.974 1.00 . A A . 3 LEU CD1 1 1 6 1189 1 1 3 LEU CD2 C -8.286 0.046 6.155 1.00 . A A . 3 LEU CD2 1 1 6 1190 1 1 3 LEU CG C -7.867 -0.026 4.694 1.00 . A A . 3 LEU CG 1 1 6 1191 1 1 3 LEU H H -6.949 1.161 2.059 1.00 . A A . 3 LEU H 1 1 6 1192 1 1 3 LEU HA H -4.709 -0.304 3.221 1.00 . A A . 3 LEU HA 1 1 6 1193 1 1 3 LEU HB2 H -6.104 -1.172 5.040 1.00 . A A . 3 LEU HB2 1 1 6 1194 1 1 3 LEU HB3 H -5.867 0.560 5.140 1.00 . A A . 3 LEU HB3 1 1 6 1195 1 1 3 LEU HD11 H -8.654 -0.917 2.915 1.00 . A A . 3 LEU HD11 1 1 6 1196 1 1 3 LEU HD12 H -9.643 -1.170 4.352 1.00 . A A . 3 LEU HD12 1 1 6 1197 1 1 3 LEU HD13 H -8.144 -2.074 4.144 1.00 . A A . 3 LEU HD13 1 1 6 1198 1 1 3 LEU HD21 H -9.283 -0.353 6.264 1.00 . A A . 3 LEU HD21 1 1 6 1199 1 1 3 LEU HD22 H -8.271 1.074 6.484 1.00 . A A . 3 LEU HD22 1 1 6 1200 1 1 3 LEU HD23 H -7.600 -0.533 6.755 1.00 . A A . 3 LEU HD23 1 1 6 1201 1 1 3 LEU HG H -8.125 0.913 4.229 1.00 . A A . 3 LEU HG 1 1 6 1202 1 1 3 LEU N N -6.082 1.045 2.502 1.00 . A A . 3 LEU N 1 1 6 1203 1 1 3 LEU O O -6.405 -2.524 2.874 1.00 . A A . 3 LEU O 1 1 6 1204 1 1 4 LYS C C -6.141 -2.606 -0.850 1.00 . A A . 4 LYS C 1 1 6 1205 1 1 4 LYS CA C -7.156 -2.231 0.226 1.00 . A A . 4 LYS CA 1 1 6 1206 1 1 4 LYS CB C -8.469 -1.791 -0.427 1.00 . A A . 4 LYS CB 1 1 6 1207 1 1 4 LYS CD C -10.373 -2.354 -1.968 1.00 . A A . 4 LYS CD 1 1 6 1208 1 1 4 LYS CE C -10.976 -3.402 -2.889 1.00 . A A . 4 LYS CE 1 1 6 1209 1 1 4 LYS CG C -9.074 -2.840 -1.347 1.00 . A A . 4 LYS CG 1 1 6 1210 1 1 4 LYS H H -6.543 -0.269 0.730 1.00 . A A . 4 LYS H 1 1 6 1211 1 1 4 LYS HA H -7.345 -3.096 0.840 1.00 . A A . 4 LYS HA 1 1 6 1212 1 1 4 LYS HB2 H -9.187 -1.569 0.349 1.00 . A A . 4 LYS HB2 1 1 6 1213 1 1 4 LYS HB3 H -8.288 -0.897 -1.005 1.00 . A A . 4 LYS HB3 1 1 6 1214 1 1 4 LYS HD2 H -11.077 -2.134 -1.180 1.00 . A A . 4 LYS HD2 1 1 6 1215 1 1 4 LYS HD3 H -10.175 -1.458 -2.538 1.00 . A A . 4 LYS HD3 1 1 6 1216 1 1 4 LYS HE2 H -10.270 -3.623 -3.674 1.00 . A A . 4 LYS HE2 1 1 6 1217 1 1 4 LYS HE3 H -11.168 -4.297 -2.316 1.00 . A A . 4 LYS HE3 1 1 6 1218 1 1 4 LYS HG2 H -8.370 -3.060 -2.136 1.00 . A A . 4 LYS HG2 1 1 6 1219 1 1 4 LYS HG3 H -9.270 -3.736 -0.777 1.00 . A A . 4 LYS HG3 1 1 6 1220 1 1 4 LYS HZ1 H -12.070 -2.547 -4.450 1.00 . A A . 4 LYS HZ1 1 1 6 1221 1 1 4 LYS HZ2 H -12.682 -2.197 -2.913 1.00 . A A . 4 LYS HZ2 1 1 6 1222 1 1 4 LYS HZ3 H -12.918 -3.730 -3.586 1.00 . A A . 4 LYS HZ3 1 1 6 1223 1 1 4 LYS N N -6.644 -1.174 1.091 1.00 . A A . 4 LYS N 1 1 6 1224 1 1 4 LYS NZ N -12.251 -2.937 -3.502 1.00 . A A . 4 LYS NZ 1 1 6 1225 1 1 4 LYS O O -6.230 -3.675 -1.455 1.00 . A A . 4 LYS O 1 1 6 1226 1 1 5 GLN C C -3.077 -2.925 -1.560 1.00 . A A . 5 GLN C 1 1 6 1227 1 1 5 GLN CA C -4.143 -1.967 -2.087 1.00 . A A . 5 GLN CA 1 1 6 1228 1 1 5 GLN CB C -3.496 -0.648 -2.513 1.00 . A A . 5 GLN CB 1 1 6 1229 1 1 5 GLN CD C -1.783 0.507 -3.966 1.00 . A A . 5 GLN CD 1 1 6 1230 1 1 5 GLN CG C -2.408 -0.813 -3.561 1.00 . A A . 5 GLN CG 1 1 6 1231 1 1 5 GLN H H -5.154 -0.891 -0.571 1.00 . A A . 5 GLN H 1 1 6 1232 1 1 5 GLN HA H -4.618 -2.417 -2.943 1.00 . A A . 5 GLN HA 1 1 6 1233 1 1 5 GLN HB2 H -4.260 0.000 -2.918 1.00 . A A . 5 GLN HB2 1 1 6 1234 1 1 5 GLN HB3 H -3.061 -0.177 -1.644 1.00 . A A . 5 GLN HB3 1 1 6 1235 1 1 5 GLN HE21 H 0.003 -0.123 -3.358 1.00 . A A . 5 GLN HE21 1 1 6 1236 1 1 5 GLN HE22 H -0.047 1.476 -4.010 1.00 . A A . 5 GLN HE22 1 1 6 1237 1 1 5 GLN HG2 H -1.634 -1.452 -3.161 1.00 . A A . 5 GLN HG2 1 1 6 1238 1 1 5 GLN HG3 H -2.838 -1.277 -4.438 1.00 . A A . 5 GLN HG3 1 1 6 1239 1 1 5 GLN N N -5.175 -1.724 -1.083 1.00 . A A . 5 GLN N 1 1 6 1240 1 1 5 GLN NE2 N -0.478 0.632 -3.757 1.00 . A A . 5 GLN NE2 1 1 6 1241 1 1 5 GLN O O -2.334 -3.526 -2.336 1.00 . A A . 5 GLN O 1 1 6 1242 1 1 5 GLN OE1 O -2.465 1.404 -4.463 1.00 . A A . 5 GLN OE1 1 1 6 1243 1 1 6 TYR C C -0.605 -3.493 0.065 1.00 . A A . 6 TYR C 1 1 6 1244 1 1 6 TYR CA C -2.026 -3.945 0.385 1.00 . A A . 6 TYR CA 1 1 6 1245 1 1 6 TYR CB C -2.233 -5.388 -0.087 1.00 . A A . 6 TYR CB 1 1 6 1246 1 1 6 TYR CD1 C -4.559 -5.224 0.925 1.00 . A A . 6 TYR CD1 1 1 6 1247 1 1 6 TYR CD2 C -3.922 -7.266 -0.131 1.00 . A A . 6 TYR CD2 1 1 6 1248 1 1 6 TYR CE1 C -5.798 -5.760 1.221 1.00 . A A . 6 TYR CE1 1 1 6 1249 1 1 6 TYR CE2 C -5.160 -7.806 0.163 1.00 . A A . 6 TYR CE2 1 1 6 1250 1 1 6 TYR CG C -3.598 -5.966 0.242 1.00 . A A . 6 TYR CG 1 1 6 1251 1 1 6 TYR CZ C -6.093 -7.050 0.838 1.00 . A A . 6 TYR CZ 1 1 6 1252 1 1 6 TYR H H -3.622 -2.556 0.327 1.00 . A A . 6 TYR H 1 1 6 1253 1 1 6 TYR HA H -2.174 -3.899 1.453 1.00 . A A . 6 TYR HA 1 1 6 1254 1 1 6 TYR HB2 H -2.111 -5.428 -1.158 1.00 . A A . 6 TYR HB2 1 1 6 1255 1 1 6 TYR HB3 H -1.487 -6.018 0.377 1.00 . A A . 6 TYR HB3 1 1 6 1256 1 1 6 TYR HD1 H -4.328 -4.213 1.224 1.00 . A A . 6 TYR HD1 1 1 6 1257 1 1 6 TYR HD2 H -3.190 -7.856 -0.660 1.00 . A A . 6 TYR HD2 1 1 6 1258 1 1 6 TYR HE1 H -6.530 -5.167 1.749 1.00 . A A . 6 TYR HE1 1 1 6 1259 1 1 6 TYR HE2 H -5.390 -8.819 -0.136 1.00 . A A . 6 TYR HE2 1 1 6 1260 1 1 6 TYR HH H -7.630 -8.115 0.391 1.00 . A A . 6 TYR HH 1 1 6 1261 1 1 6 TYR N N -3.004 -3.062 -0.240 1.00 . A A . 6 TYR N 1 1 6 1262 1 1 6 TYR O O 0.046 -4.040 -0.825 1.00 . A A . 6 TYR O 1 1 6 1263 1 1 6 TYR OH O -7.325 -7.586 1.132 1.00 . A A . 6 TYR OH 1 1 6 1264 1 1 7 TRP C C 2.267 -3.038 0.842 1.00 . A A . 7 TRP C 1 1 6 1265 1 1 7 TRP CA C 1.213 -1.964 0.591 1.00 . A A . 7 TRP CA 1 1 6 1266 1 1 7 TRP CB C 1.462 -0.768 1.509 1.00 . A A . 7 TRP CB 1 1 6 1267 1 1 7 TRP CD1 C 2.077 -2.013 3.663 1.00 . A A . 7 TRP CD1 1 1 6 1268 1 1 7 TRP CD2 C 0.426 -0.520 3.903 1.00 . A A . 7 TRP CD2 1 1 6 1269 1 1 7 TRP CE2 C 0.663 -1.130 5.149 1.00 . A A . 7 TRP CE2 1 1 6 1270 1 1 7 TRP CE3 C -0.571 0.455 3.810 1.00 . A A . 7 TRP CE3 1 1 6 1271 1 1 7 TRP CG C 1.340 -1.099 2.966 1.00 . A A . 7 TRP CG 1 1 6 1272 1 1 7 TRP CH2 C -1.027 0.162 6.172 1.00 . A A . 7 TRP CH2 1 1 6 1273 1 1 7 TRP CZ2 C -0.058 -0.796 6.292 1.00 . A A . 7 TRP CZ2 1 1 6 1274 1 1 7 TRP CZ3 C -1.287 0.786 4.946 1.00 . A A . 7 TRP CZ3 1 1 6 1275 1 1 7 TRP H H -0.697 -2.095 1.491 1.00 . A A . 7 TRP H 1 1 6 1276 1 1 7 TRP HA H 1.287 -1.638 -0.436 1.00 . A A . 7 TRP HA 1 1 6 1277 1 1 7 TRP HB2 H 2.459 -0.390 1.337 1.00 . A A . 7 TRP HB2 1 1 6 1278 1 1 7 TRP HB3 H 0.745 0.008 1.282 1.00 . A A . 7 TRP HB3 1 1 6 1279 1 1 7 TRP HD1 H 2.857 -2.622 3.232 1.00 . A A . 7 TRP HD1 1 1 6 1280 1 1 7 TRP HE1 H 2.054 -2.612 5.676 1.00 . A A . 7 TRP HE1 1 1 6 1281 1 1 7 TRP HE3 H -0.785 0.947 2.873 1.00 . A A . 7 TRP HE3 1 1 6 1282 1 1 7 TRP HH2 H -1.612 0.451 7.033 1.00 . A A . 7 TRP HH2 1 1 6 1283 1 1 7 TRP HZ2 H 0.130 -1.267 7.246 1.00 . A A . 7 TRP HZ2 1 1 6 1284 1 1 7 TRP HZ3 H -2.061 1.538 4.892 1.00 . A A . 7 TRP HZ3 1 1 6 1285 1 1 7 TRP N N -0.130 -2.490 0.796 1.00 . A A . 7 TRP N 1 1 6 1286 1 1 7 TRP NE1 N 1.676 -2.038 4.977 1.00 . A A . 7 TRP NE1 1 1 6 1287 1 1 7 TRP O O 1.946 -4.152 1.255 1.00 . A A . 7 TRP O 1 1 6 1288 1 1 8 TRP C C 5.957 -2.922 0.488 1.00 . A A . 8 TRP C 1 1 6 1289 1 1 8 TRP CA C 4.629 -3.625 0.788 1.00 . A A . 8 TRP CA 1 1 6 1290 1 1 8 TRP CB C 4.441 -4.852 -0.116 1.00 . A A . 8 TRP CB 1 1 6 1291 1 1 8 TRP CD1 C 5.569 -7.070 -0.705 1.00 . A A . 8 TRP CD1 1 1 6 1292 1 1 8 TRP CD2 C 6.580 -5.980 0.974 1.00 . A A . 8 TRP CD2 1 1 6 1293 1 1 8 TRP CE2 C 7.286 -7.174 0.717 1.00 . A A . 8 TRP CE2 1 1 6 1294 1 1 8 TRP CE3 C 7.039 -5.146 2.003 1.00 . A A . 8 TRP CE3 1 1 6 1295 1 1 8 TRP CG C 5.501 -5.915 0.020 1.00 . A A . 8 TRP CG 1 1 6 1296 1 1 8 TRP CH2 C 8.830 -6.717 2.442 1.00 . A A . 8 TRP CH2 1 1 6 1297 1 1 8 TRP CZ2 C 8.412 -7.551 1.444 1.00 . A A . 8 TRP CZ2 1 1 6 1298 1 1 8 TRP CZ3 C 8.155 -5.527 2.726 1.00 . A A . 8 TRP CZ3 1 1 6 1299 1 1 8 TRP H H 3.717 -1.790 0.262 1.00 . A A . 8 TRP H 1 1 6 1300 1 1 8 TRP HA H 4.624 -3.938 1.816 1.00 . A A . 8 TRP HA 1 1 6 1301 1 1 8 TRP HB2 H 3.493 -5.310 0.119 1.00 . A A . 8 TRP HB2 1 1 6 1302 1 1 8 TRP HB3 H 4.424 -4.528 -1.145 1.00 . A A . 8 TRP HB3 1 1 6 1303 1 1 8 TRP HD1 H 4.884 -7.329 -1.498 1.00 . A A . 8 TRP HD1 1 1 6 1304 1 1 8 TRP HE1 H 6.928 -8.669 -0.708 1.00 . A A . 8 TRP HE1 1 1 6 1305 1 1 8 TRP HE3 H 6.533 -4.228 2.247 1.00 . A A . 8 TRP HE3 1 1 6 1306 1 1 8 TRP HH2 H 9.697 -6.973 3.034 1.00 . A A . 8 TRP HH2 1 1 6 1307 1 1 8 TRP HZ2 H 8.945 -8.467 1.237 1.00 . A A . 8 TRP HZ2 1 1 6 1308 1 1 8 TRP HZ3 H 8.518 -4.895 3.523 1.00 . A A . 8 TRP HZ3 1 1 6 1309 1 1 8 TRP N N 3.526 -2.693 0.589 1.00 . A A . 8 TRP N 1 1 6 1310 1 1 8 TRP NE1 N 6.655 -7.813 -0.316 1.00 . A A . 8 TRP NE1 1 1 6 1311 1 1 8 TRP O O 6.528 -2.263 1.358 1.00 . A A . 8 TRP O 1 1 6 1312 1 1 9 ARG C C 7.583 -0.912 -1.162 1.00 . A A . 9 ARG C 1 1 6 1313 1 1 9 ARG CA C 7.697 -2.438 -1.142 1.00 . A A . 9 ARG CA 1 1 6 1314 1 1 9 ARG CB C 8.129 -2.951 -2.518 1.00 . A A . 9 ARG CB 1 1 6 1315 1 1 9 ARG CD C 9.432 -4.888 -1.589 1.00 . A A . 9 ARG CD 1 1 6 1316 1 1 9 ARG CG C 8.349 -4.453 -2.564 1.00 . A A . 9 ARG CG 1 1 6 1317 1 1 9 ARG CZ C 10.547 -6.964 -0.868 1.00 . A A . 9 ARG CZ 1 1 6 1318 1 1 9 ARG H H 5.945 -3.593 -1.389 1.00 . A A . 9 ARG H 1 1 6 1319 1 1 9 ARG HA H 8.446 -2.716 -0.417 1.00 . A A . 9 ARG HA 1 1 6 1320 1 1 9 ARG HB2 H 7.368 -2.698 -3.240 1.00 . A A . 9 ARG HB2 1 1 6 1321 1 1 9 ARG HB3 H 9.053 -2.465 -2.796 1.00 . A A . 9 ARG HB3 1 1 6 1322 1 1 9 ARG HD2 H 10.353 -4.387 -1.847 1.00 . A A . 9 ARG HD2 1 1 6 1323 1 1 9 ARG HD3 H 9.134 -4.603 -0.591 1.00 . A A . 9 ARG HD3 1 1 6 1324 1 1 9 ARG HE H 9.106 -6.859 -2.245 1.00 . A A . 9 ARG HE 1 1 6 1325 1 1 9 ARG HG2 H 7.427 -4.952 -2.307 1.00 . A A . 9 ARG HG2 1 1 6 1326 1 1 9 ARG HG3 H 8.645 -4.733 -3.565 1.00 . A A . 9 ARG HG3 1 1 6 1327 1 1 9 ARG HH11 H 11.210 -5.291 0.057 1.00 . A A . 9 ARG HH11 1 1 6 1328 1 1 9 ARG HH12 H 11.976 -6.764 0.549 1.00 . A A . 9 ARG HH12 1 1 6 1329 1 1 9 ARG HH21 H 10.112 -8.798 -1.599 1.00 . A A . 9 ARG HH21 1 1 6 1330 1 1 9 ARG HH22 H 11.354 -8.755 -0.391 1.00 . A A . 9 ARG HH22 1 1 6 1331 1 1 9 ARG N N 6.442 -3.061 -0.740 1.00 . A A . 9 ARG N 1 1 6 1332 1 1 9 ARG NE N 9.653 -6.332 -1.625 1.00 . A A . 9 ARG NE 1 1 6 1333 1 1 9 ARG NH1 N 11.306 -6.284 -0.017 1.00 . A A . 9 ARG NH1 1 1 6 1334 1 1 9 ARG NH2 N 10.682 -8.280 -0.960 1.00 . A A . 9 ARG NH2 1 1 6 1335 1 1 9 ARG O O 8.421 -0.219 -0.586 1.00 . A A . 9 ARG O 1 1 6 1336 1 1 10 PRO C C 5.904 1.696 -0.586 1.00 . A A . 10 PRO C 1 1 6 1337 1 1 10 PRO CA C 6.358 1.091 -1.908 1.00 . A A . 10 PRO CA 1 1 6 1338 1 1 10 PRO CB C 5.270 1.248 -2.971 1.00 . A A . 10 PRO CB 1 1 6 1339 1 1 10 PRO CD C 5.494 -1.097 -2.555 1.00 . A A . 10 PRO CD 1 1 6 1340 1 1 10 PRO CG C 4.500 -0.024 -2.913 1.00 . A A . 10 PRO CG 1 1 6 1341 1 1 10 PRO HA H 7.254 1.587 -2.233 1.00 . A A . 10 PRO HA 1 1 6 1342 1 1 10 PRO HB2 H 4.648 2.099 -2.732 1.00 . A A . 10 PRO HB2 1 1 6 1343 1 1 10 PRO HB3 H 5.726 1.389 -3.940 1.00 . A A . 10 PRO HB3 1 1 6 1344 1 1 10 PRO HD2 H 5.032 -1.838 -1.923 1.00 . A A . 10 PRO HD2 1 1 6 1345 1 1 10 PRO HD3 H 5.889 -1.554 -3.449 1.00 . A A . 10 PRO HD3 1 1 6 1346 1 1 10 PRO HG2 H 3.735 0.044 -2.154 1.00 . A A . 10 PRO HG2 1 1 6 1347 1 1 10 PRO HG3 H 4.058 -0.230 -3.876 1.00 . A A . 10 PRO HG3 1 1 6 1348 1 1 10 PRO N N 6.550 -0.361 -1.828 1.00 . A A . 10 PRO N 1 1 6 1349 1 1 10 PRO O O 6.145 2.872 -0.312 1.00 . A A . 10 PRO O 1 1 6 1350 1 1 11 SER C C 3.952 2.618 1.405 1.00 . A A . 11 SER C 1 1 6 1351 1 1 11 SER CA C 4.756 1.326 1.531 1.00 . A A . 11 SER CA 1 1 6 1352 1 1 11 SER CB C 5.925 1.532 2.495 1.00 . A A . 11 SER CB 1 1 6 1353 1 1 11 SER H H 5.094 -0.041 -0.052 1.00 . A A . 11 SER H 1 1 6 1354 1 1 11 SER HA H 4.112 0.553 1.921 1.00 . A A . 11 SER HA 1 1 6 1355 1 1 11 SER HB2 H 6.592 2.281 2.096 1.00 . A A . 11 SER HB2 1 1 6 1356 1 1 11 SER HB3 H 5.545 1.862 3.452 1.00 . A A . 11 SER HB3 1 1 6 1357 1 1 11 SER HG H 6.171 -0.244 3.285 1.00 . A A . 11 SER HG 1 1 6 1358 1 1 11 SER N N 5.249 0.882 0.228 1.00 . A A . 11 SER N 1 1 6 1359 1 1 11 SER O O 4.517 3.712 1.373 1.00 . A A . 11 SER O 1 1 6 1360 1 1 11 SER OG O 6.651 0.329 2.683 1.00 . A A . 11 SER OG 1 1 6 1361 1 1 12 ILE C C 1.812 4.503 2.470 1.00 . A A . 12 ILE C 1 1 6 1362 1 1 12 ILE CA C 1.752 3.639 1.214 1.00 . A A . 12 ILE CA 1 1 6 1363 1 1 12 ILE CB C 0.292 3.207 0.962 1.00 . A A . 12 ILE CB 1 1 6 1364 1 1 12 ILE CD1 C 0.650 3.150 -1.557 1.00 . A A . 12 ILE CD1 1 1 6 1365 1 1 12 ILE CG1 C 0.196 2.392 -0.329 1.00 . A A . 12 ILE CG1 1 1 6 1366 1 1 12 ILE CG2 C -0.625 4.422 0.892 1.00 . A A . 12 ILE CG2 1 1 6 1367 1 1 12 ILE H H 2.241 1.587 1.366 1.00 . A A . 12 ILE H 1 1 6 1368 1 1 12 ILE HA H 2.084 4.225 0.370 1.00 . A A . 12 ILE HA 1 1 6 1369 1 1 12 ILE HB H -0.027 2.593 1.791 1.00 . A A . 12 ILE HB 1 1 6 1370 1 1 12 ILE HD11 H 1.533 2.679 -1.965 1.00 . A A . 12 ILE HD11 1 1 6 1371 1 1 12 ILE HD12 H 0.880 4.170 -1.286 1.00 . A A . 12 ILE HD12 1 1 6 1372 1 1 12 ILE HD13 H -0.136 3.142 -2.297 1.00 . A A . 12 ILE HD13 1 1 6 1373 1 1 12 ILE HG12 H 0.813 1.511 -0.237 1.00 . A A . 12 ILE HG12 1 1 6 1374 1 1 12 ILE HG13 H -0.830 2.093 -0.483 1.00 . A A . 12 ILE HG13 1 1 6 1375 1 1 12 ILE HG21 H -0.054 5.286 0.584 1.00 . A A . 12 ILE HG21 1 1 6 1376 1 1 12 ILE HG22 H -1.057 4.603 1.864 1.00 . A A . 12 ILE HG22 1 1 6 1377 1 1 12 ILE HG23 H -1.412 4.238 0.175 1.00 . A A . 12 ILE HG23 1 1 6 1378 1 1 12 ILE N N 2.632 2.484 1.335 1.00 . A A . 12 ILE N 1 1 6 1379 1 1 12 ILE O O 1.648 5.736 2.349 1.00 . A A . 12 ILE O 1 1 6 1380 1 1 12 ILE OXT O 2.023 3.941 3.565 1.00 . A A . 12 ILE OXT 1 1 7 1381 1 1 1 HIS C C -5.358 4.418 -0.780 1.00 . A A . 1 HIS C 1 1 7 1382 1 1 1 HIS CA C -5.438 5.934 -0.624 1.00 . A A . 1 HIS CA 1 1 7 1383 1 1 1 HIS CB C -5.384 6.315 0.856 1.00 . A A . 1 HIS CB 1 1 7 1384 1 1 1 HIS CD2 C -6.287 8.565 1.779 1.00 . A A . 1 HIS CD2 1 1 7 1385 1 1 1 HIS CE1 C -4.735 9.888 0.974 1.00 . A A . 1 HIS CE1 1 1 7 1386 1 1 1 HIS CG C -5.410 7.794 1.095 1.00 . A A . 1 HIS CG 1 1 7 1387 1 1 1 HIS H1 H -6.731 7.488 -1.007 1.00 . A A . 1 HIS H1 1 1 7 1388 1 1 1 HIS H2 H -7.491 5.971 -0.750 1.00 . A A . 1 HIS H2 1 1 7 1389 1 1 1 HIS H3 H -6.677 6.287 -2.228 1.00 . A A . 1 HIS H3 1 1 7 1390 1 1 1 HIS HA H -4.603 6.386 -1.139 1.00 . A A . 1 HIS HA 1 1 7 1391 1 1 1 HIS HB2 H -6.233 5.883 1.364 1.00 . A A . 1 HIS HB2 1 1 7 1392 1 1 1 HIS HB3 H -4.475 5.924 1.289 1.00 . A A . 1 HIS HB3 1 1 7 1393 1 1 1 HIS HD1 H -3.675 8.395 0.060 1.00 . A A . 1 HIS HD1 1 1 7 1394 1 1 1 HIS HD2 H -7.172 8.224 2.299 1.00 . A A . 1 HIS HD2 1 1 7 1395 1 1 1 HIS HE1 H -4.159 10.769 0.733 1.00 . A A . 1 HIS HE1 1 1 7 1396 1 1 1 HIS HE2 H -6.223 10.627 2.171 1.00 . A A . 1 HIS HE2 1 1 7 1397 1 1 1 HIS N N -6.698 6.468 -1.205 1.00 . A A . 1 HIS N 1 1 7 1398 1 1 1 HIS ND1 N -4.450 8.653 0.602 1.00 . A A . 1 HIS ND1 1 1 7 1399 1 1 1 HIS NE2 N -5.845 9.862 1.689 1.00 . A A . 1 HIS NE2 1 1 7 1400 1 1 1 HIS O O -6.380 3.730 -0.773 1.00 . A A . 1 HIS O 1 1 7 1401 1 1 2 PRO C C -3.963 1.687 0.245 1.00 . A A . 2 PRO C 1 1 7 1402 1 1 2 PRO CA C -3.928 2.435 -1.085 1.00 . A A . 2 PRO CA 1 1 7 1403 1 1 2 PRO CB C -2.533 2.364 -1.700 1.00 . A A . 2 PRO CB 1 1 7 1404 1 1 2 PRO CD C -2.863 4.621 -0.949 1.00 . A A . 2 PRO CD 1 1 7 1405 1 1 2 PRO CG C -1.820 3.547 -1.141 1.00 . A A . 2 PRO CG 1 1 7 1406 1 1 2 PRO HA H -4.647 2.001 -1.764 1.00 . A A . 2 PRO HA 1 1 7 1407 1 1 2 PRO HB2 H -2.055 1.439 -1.411 1.00 . A A . 2 PRO HB2 1 1 7 1408 1 1 2 PRO HB3 H -2.605 2.420 -2.776 1.00 . A A . 2 PRO HB3 1 1 7 1409 1 1 2 PRO HD2 H -2.703 5.137 -0.014 1.00 . A A . 2 PRO HD2 1 1 7 1410 1 1 2 PRO HD3 H -2.842 5.318 -1.773 1.00 . A A . 2 PRO HD3 1 1 7 1411 1 1 2 PRO HG2 H -1.371 3.290 -0.193 1.00 . A A . 2 PRO HG2 1 1 7 1412 1 1 2 PRO HG3 H -1.064 3.883 -1.836 1.00 . A A . 2 PRO HG3 1 1 7 1413 1 1 2 PRO N N -4.137 3.874 -0.926 1.00 . A A . 2 PRO N 1 1 7 1414 1 1 2 PRO O O -3.034 0.951 0.579 1.00 . A A . 2 PRO O 1 1 7 1415 1 1 3 LEU C C -5.848 -0.160 2.140 1.00 . A A . 3 LEU C 1 1 7 1416 1 1 3 LEU CA C -5.196 1.213 2.288 1.00 . A A . 3 LEU CA 1 1 7 1417 1 1 3 LEU CB C -6.001 2.100 3.246 1.00 . A A . 3 LEU CB 1 1 7 1418 1 1 3 LEU CD1 C -8.278 1.232 2.588 1.00 . A A . 3 LEU CD1 1 1 7 1419 1 1 3 LEU CD2 C -8.065 3.424 3.771 1.00 . A A . 3 LEU CD2 1 1 7 1420 1 1 3 LEU CG C -7.414 2.470 2.781 1.00 . A A . 3 LEU CG 1 1 7 1421 1 1 3 LEU H H -5.751 2.470 0.679 1.00 . A A . 3 LEU H 1 1 7 1422 1 1 3 LEU HA H -4.209 1.077 2.698 1.00 . A A . 3 LEU HA 1 1 7 1423 1 1 3 LEU HB2 H -6.083 1.585 4.192 1.00 . A A . 3 LEU HB2 1 1 7 1424 1 1 3 LEU HB3 H -5.450 3.015 3.402 1.00 . A A . 3 LEU HB3 1 1 7 1425 1 1 3 LEU HD11 H -8.173 0.875 1.573 1.00 . A A . 3 LEU HD11 1 1 7 1426 1 1 3 LEU HD12 H -9.311 1.481 2.775 1.00 . A A . 3 LEU HD12 1 1 7 1427 1 1 3 LEU HD13 H -7.963 0.461 3.275 1.00 . A A . 3 LEU HD13 1 1 7 1428 1 1 3 LEU HD21 H -7.358 4.194 4.047 1.00 . A A . 3 LEU HD21 1 1 7 1429 1 1 3 LEU HD22 H -8.366 2.879 4.653 1.00 . A A . 3 LEU HD22 1 1 7 1430 1 1 3 LEU HD23 H -8.932 3.879 3.315 1.00 . A A . 3 LEU HD23 1 1 7 1431 1 1 3 LEU HG H -7.343 2.974 1.830 1.00 . A A . 3 LEU HG 1 1 7 1432 1 1 3 LEU N N -5.042 1.875 0.998 1.00 . A A . 3 LEU N 1 1 7 1433 1 1 3 LEU O O -5.878 -0.947 3.085 1.00 . A A . 3 LEU O 1 1 7 1434 1 1 4 LYS C C -6.222 -2.550 -0.317 1.00 . A A . 4 LYS C 1 1 7 1435 1 1 4 LYS CA C -7.023 -1.720 0.683 1.00 . A A . 4 LYS CA 1 1 7 1436 1 1 4 LYS CB C -8.441 -1.489 0.156 1.00 . A A . 4 LYS CB 1 1 7 1437 1 1 4 LYS CD C -10.596 -2.482 -0.666 1.00 . A A . 4 LYS CD 1 1 7 1438 1 1 4 LYS CE C -11.355 -3.764 -0.969 1.00 . A A . 4 LYS CE 1 1 7 1439 1 1 4 LYS CG C -9.197 -2.772 -0.148 1.00 . A A . 4 LYS CG 1 1 7 1440 1 1 4 LYS H H -6.321 0.224 0.232 1.00 . A A . 4 LYS H 1 1 7 1441 1 1 4 LYS HA H -7.079 -2.260 1.613 1.00 . A A . 4 LYS HA 1 1 7 1442 1 1 4 LYS HB2 H -9.000 -0.934 0.895 1.00 . A A . 4 LYS HB2 1 1 7 1443 1 1 4 LYS HB3 H -8.384 -0.906 -0.751 1.00 . A A . 4 LYS HB3 1 1 7 1444 1 1 4 LYS HD2 H -11.138 -1.925 0.084 1.00 . A A . 4 LYS HD2 1 1 7 1445 1 1 4 LYS HD3 H -10.521 -1.896 -1.569 1.00 . A A . 4 LYS HD3 1 1 7 1446 1 1 4 LYS HE2 H -10.810 -4.321 -1.716 1.00 . A A . 4 LYS HE2 1 1 7 1447 1 1 4 LYS HE3 H -11.426 -4.349 -0.065 1.00 . A A . 4 LYS HE3 1 1 7 1448 1 1 4 LYS HG2 H -8.654 -3.329 -0.897 1.00 . A A . 4 LYS HG2 1 1 7 1449 1 1 4 LYS HG3 H -9.271 -3.357 0.757 1.00 . A A . 4 LYS HG3 1 1 7 1450 1 1 4 LYS HZ1 H -12.987 -4.188 -2.204 1.00 . A A . 4 LYS HZ1 1 1 7 1451 1 1 4 LYS HZ2 H -12.771 -2.539 -1.897 1.00 . A A . 4 LYS HZ2 1 1 7 1452 1 1 4 LYS HZ3 H -13.415 -3.544 -0.699 1.00 . A A . 4 LYS HZ3 1 1 7 1453 1 1 4 LYS N N -6.372 -0.442 0.948 1.00 . A A . 4 LYS N 1 1 7 1454 1 1 4 LYS NZ N -12.728 -3.489 -1.478 1.00 . A A . 4 LYS NZ 1 1 7 1455 1 1 4 LYS O O -6.396 -3.764 -0.411 1.00 . A A . 4 LYS O 1 1 7 1456 1 1 5 GLN C C -3.418 -3.391 -1.381 1.00 . A A . 5 GLN C 1 1 7 1457 1 1 5 GLN CA C -4.513 -2.564 -2.052 1.00 . A A . 5 GLN CA 1 1 7 1458 1 1 5 GLN CB C -3.886 -1.543 -3.004 1.00 . A A . 5 GLN CB 1 1 7 1459 1 1 5 GLN CD C -2.394 -1.134 -5.000 1.00 . A A . 5 GLN CD 1 1 7 1460 1 1 5 GLN CG C -3.003 -2.167 -4.072 1.00 . A A . 5 GLN CG 1 1 7 1461 1 1 5 GLN H H -5.247 -0.922 -0.940 1.00 . A A . 5 GLN H 1 1 7 1462 1 1 5 GLN HA H -5.149 -3.226 -2.617 1.00 . A A . 5 GLN HA 1 1 7 1463 1 1 5 GLN HB2 H -4.676 -0.995 -3.496 1.00 . A A . 5 GLN HB2 1 1 7 1464 1 1 5 GLN HB3 H -3.286 -0.854 -2.429 1.00 . A A . 5 GLN HB3 1 1 7 1465 1 1 5 GLN HE21 H -0.564 -1.701 -4.469 1.00 . A A . 5 GLN HE21 1 1 7 1466 1 1 5 GLN HE22 H -0.647 -0.421 -5.626 1.00 . A A . 5 GLN HE22 1 1 7 1467 1 1 5 GLN HG2 H -2.204 -2.709 -3.589 1.00 . A A . 5 GLN HG2 1 1 7 1468 1 1 5 GLN HG3 H -3.598 -2.851 -4.659 1.00 . A A . 5 GLN HG3 1 1 7 1469 1 1 5 GLN N N -5.341 -1.887 -1.061 1.00 . A A . 5 GLN N 1 1 7 1470 1 1 5 GLN NE2 N -1.067 -1.079 -5.036 1.00 . A A . 5 GLN NE2 1 1 7 1471 1 1 5 GLN O O -2.864 -4.309 -1.985 1.00 . A A . 5 GLN O 1 1 7 1472 1 1 5 GLN OE1 O -3.107 -0.393 -5.676 1.00 . A A . 5 GLN OE1 1 1 7 1473 1 1 6 TYR C C -0.721 -3.625 -0.054 1.00 . A A . 6 TYR C 1 1 7 1474 1 1 6 TYR CA C -2.082 -3.771 0.618 1.00 . A A . 6 TYR CA 1 1 7 1475 1 1 6 TYR CB C -2.446 -5.254 0.747 1.00 . A A . 6 TYR CB 1 1 7 1476 1 1 6 TYR CD1 C -4.539 -4.480 1.962 1.00 . A A . 6 TYR CD1 1 1 7 1477 1 1 6 TYR CD2 C -4.208 -6.821 1.650 1.00 . A A . 6 TYR CD2 1 1 7 1478 1 1 6 TYR CE1 C -5.729 -4.732 2.617 1.00 . A A . 6 TYR CE1 1 1 7 1479 1 1 6 TYR CE2 C -5.398 -7.079 2.303 1.00 . A A . 6 TYR CE2 1 1 7 1480 1 1 6 TYR CG C -3.757 -5.519 1.466 1.00 . A A . 6 TYR CG 1 1 7 1481 1 1 6 TYR CZ C -6.155 -6.032 2.784 1.00 . A A . 6 TYR CZ 1 1 7 1482 1 1 6 TYR H H -3.587 -2.318 0.295 1.00 . A A . 6 TYR H 1 1 7 1483 1 1 6 TYR HA H -2.032 -3.334 1.605 1.00 . A A . 6 TYR HA 1 1 7 1484 1 1 6 TYR HB2 H -2.522 -5.682 -0.240 1.00 . A A . 6 TYR HB2 1 1 7 1485 1 1 6 TYR HB3 H -1.662 -5.760 1.291 1.00 . A A . 6 TYR HB3 1 1 7 1486 1 1 6 TYR HD1 H -4.206 -3.461 1.832 1.00 . A A . 6 TYR HD1 1 1 7 1487 1 1 6 TYR HD2 H -3.615 -7.640 1.271 1.00 . A A . 6 TYR HD2 1 1 7 1488 1 1 6 TYR HE1 H -6.322 -3.911 2.994 1.00 . A A . 6 TYR HE1 1 1 7 1489 1 1 6 TYR HE2 H -5.731 -8.098 2.435 1.00 . A A . 6 TYR HE2 1 1 7 1490 1 1 6 TYR HH H -7.208 -6.983 4.082 1.00 . A A . 6 TYR HH 1 1 7 1491 1 1 6 TYR N N -3.112 -3.058 -0.132 1.00 . A A . 6 TYR N 1 1 7 1492 1 1 6 TYR O O -0.294 -4.498 -0.808 1.00 . A A . 6 TYR O 1 1 7 1493 1 1 6 TYR OH O -7.340 -6.287 3.435 1.00 . A A . 6 TYR OH 1 1 7 1494 1 1 7 TRP C C 2.310 -3.217 0.210 1.00 . A A . 7 TRP C 1 1 7 1495 1 1 7 TRP CA C 1.268 -2.255 -0.352 1.00 . A A . 7 TRP CA 1 1 7 1496 1 1 7 TRP CB C 1.692 -0.811 -0.078 1.00 . A A . 7 TRP CB 1 1 7 1497 1 1 7 TRP CD1 C 2.590 -1.081 2.306 1.00 . A A . 7 TRP CD1 1 1 7 1498 1 1 7 TRP CD2 C 1.038 0.517 2.084 1.00 . A A . 7 TRP CD2 1 1 7 1499 1 1 7 TRP CE2 C 1.445 0.472 3.431 1.00 . A A . 7 TRP CE2 1 1 7 1500 1 1 7 TRP CE3 C 0.067 1.448 1.706 1.00 . A A . 7 TRP CE3 1 1 7 1501 1 1 7 TRP CG C 1.783 -0.485 1.381 1.00 . A A . 7 TRP CG 1 1 7 1502 1 1 7 TRP CH2 C -0.033 2.223 4.000 1.00 . A A . 7 TRP CH2 1 1 7 1503 1 1 7 TRP CZ2 C 0.916 1.321 4.399 1.00 . A A . 7 TRP CZ2 1 1 7 1504 1 1 7 TRP CZ3 C -0.459 2.291 2.668 1.00 . A A . 7 TRP CZ3 1 1 7 1505 1 1 7 TRP H H -0.438 -1.856 0.834 1.00 . A A . 7 TRP H 1 1 7 1506 1 1 7 TRP HA H 1.197 -2.404 -1.419 1.00 . A A . 7 TRP HA 1 1 7 1507 1 1 7 TRP HB2 H 2.662 -0.637 -0.520 1.00 . A A . 7 TRP HB2 1 1 7 1508 1 1 7 TRP HB3 H 0.972 -0.141 -0.527 1.00 . A A . 7 TRP HB3 1 1 7 1509 1 1 7 TRP HD1 H 3.279 -1.884 2.086 1.00 . A A . 7 TRP HD1 1 1 7 1510 1 1 7 TRP HE1 H 2.857 -0.769 4.366 1.00 . A A . 7 TRP HE1 1 1 7 1511 1 1 7 TRP HE3 H -0.273 1.516 0.682 1.00 . A A . 7 TRP HE3 1 1 7 1512 1 1 7 TRP HH2 H -0.471 2.900 4.718 1.00 . A A . 7 TRP HH2 1 1 7 1513 1 1 7 TRP HZ2 H 1.234 1.281 5.430 1.00 . A A . 7 TRP HZ2 1 1 7 1514 1 1 7 TRP HZ3 H -1.210 3.017 2.394 1.00 . A A . 7 TRP HZ3 1 1 7 1515 1 1 7 TRP N N -0.045 -2.515 0.226 1.00 . A A . 7 TRP N 1 1 7 1516 1 1 7 TRP NE1 N 2.394 -0.513 3.541 1.00 . A A . 7 TRP NE1 1 1 7 1517 1 1 7 TRP O O 1.983 -4.122 0.979 1.00 . A A . 7 TRP O 1 1 7 1518 1 1 8 TRP C C 5.897 -3.007 0.547 1.00 . A A . 8 TRP C 1 1 7 1519 1 1 8 TRP CA C 4.654 -3.865 0.290 1.00 . A A . 8 TRP CA 1 1 7 1520 1 1 8 TRP CB C 4.942 -4.955 -0.750 1.00 . A A . 8 TRP CB 1 1 7 1521 1 1 8 TRP CD1 C 6.482 -6.958 -1.146 1.00 . A A . 8 TRP CD1 1 1 7 1522 1 1 8 TRP CD2 C 6.713 -6.051 0.891 1.00 . A A . 8 TRP CD2 1 1 7 1523 1 1 8 TRP CE2 C 7.610 -7.131 0.771 1.00 . A A . 8 TRP CE2 1 1 7 1524 1 1 8 TRP CE3 C 6.683 -5.342 2.101 1.00 . A A . 8 TRP CE3 1 1 7 1525 1 1 8 TRP CG C 6.021 -5.934 -0.369 1.00 . A A . 8 TRP CG 1 1 7 1526 1 1 8 TRP CH2 C 8.404 -6.809 2.971 1.00 . A A . 8 TRP CH2 1 1 7 1527 1 1 8 TRP CZ2 C 8.460 -7.518 1.804 1.00 . A A . 8 TRP CZ2 1 1 7 1528 1 1 8 TRP CZ3 C 7.525 -5.732 3.125 1.00 . A A . 8 TRP CZ3 1 1 7 1529 1 1 8 TRP H H 3.764 -2.278 -0.791 1.00 . A A . 8 TRP H 1 1 7 1530 1 1 8 TRP HA H 4.350 -4.325 1.212 1.00 . A A . 8 TRP HA 1 1 7 1531 1 1 8 TRP HB2 H 4.038 -5.521 -0.917 1.00 . A A . 8 TRP HB2 1 1 7 1532 1 1 8 TRP HB3 H 5.232 -4.485 -1.678 1.00 . A A . 8 TRP HB3 1 1 7 1533 1 1 8 TRP HD1 H 6.146 -7.152 -2.154 1.00 . A A . 8 TRP HD1 1 1 7 1534 1 1 8 TRP HE1 H 7.953 -8.424 -0.844 1.00 . A A . 8 TRP HE1 1 1 7 1535 1 1 8 TRP HE3 H 6.011 -4.515 2.248 1.00 . A A . 8 TRP HE3 1 1 7 1536 1 1 8 TRP HH2 H 9.042 -7.078 3.798 1.00 . A A . 8 TRP HH2 1 1 7 1537 1 1 8 TRP HZ2 H 9.145 -8.347 1.700 1.00 . A A . 8 TRP HZ2 1 1 7 1538 1 1 8 TRP HZ3 H 7.511 -5.198 4.063 1.00 . A A . 8 TRP HZ3 1 1 7 1539 1 1 8 TRP N N 3.565 -3.016 -0.177 1.00 . A A . 8 TRP N 1 1 7 1540 1 1 8 TRP NE1 N 7.456 -7.659 -0.482 1.00 . A A . 8 TRP NE1 1 1 7 1541 1 1 8 TRP O O 6.061 -2.451 1.633 1.00 . A A . 8 TRP O 1 1 7 1542 1 1 9 ARG C C 7.678 -0.601 -0.479 1.00 . A A . 9 ARG C 1 1 7 1543 1 1 9 ARG CA C 7.975 -2.095 -0.331 1.00 . A A . 9 ARG CA 1 1 7 1544 1 1 9 ARG CB C 9.011 -2.529 -1.372 1.00 . A A . 9 ARG CB 1 1 7 1545 1 1 9 ARG CD C 10.066 -4.257 0.114 1.00 . A A . 9 ARG CD 1 1 7 1546 1 1 9 ARG CG C 9.437 -3.982 -1.242 1.00 . A A . 9 ARG CG 1 1 7 1547 1 1 9 ARG CZ C 11.064 -6.143 1.345 1.00 . A A . 9 ARG CZ 1 1 7 1548 1 1 9 ARG H H 6.573 -3.350 -1.295 1.00 . A A . 9 ARG H 1 1 7 1549 1 1 9 ARG HA H 8.381 -2.269 0.654 1.00 . A A . 9 ARG HA 1 1 7 1550 1 1 9 ARG HB2 H 8.596 -2.387 -2.358 1.00 . A A . 9 ARG HB2 1 1 7 1551 1 1 9 ARG HB3 H 9.889 -1.909 -1.269 1.00 . A A . 9 ARG HB3 1 1 7 1552 1 1 9 ARG HD2 H 10.928 -3.618 0.233 1.00 . A A . 9 ARG HD2 1 1 7 1553 1 1 9 ARG HD3 H 9.343 -4.029 0.884 1.00 . A A . 9 ARG HD3 1 1 7 1554 1 1 9 ARG HE H 10.326 -6.247 -0.506 1.00 . A A . 9 ARG HE 1 1 7 1555 1 1 9 ARG HG2 H 8.570 -4.614 -1.361 1.00 . A A . 9 ARG HG2 1 1 7 1556 1 1 9 ARG HG3 H 10.157 -4.207 -2.016 1.00 . A A . 9 ARG HG3 1 1 7 1557 1 1 9 ARG HH11 H 11.033 -4.396 2.367 1.00 . A A . 9 ARG HH11 1 1 7 1558 1 1 9 ARG HH12 H 11.730 -5.739 3.210 1.00 . A A . 9 ARG HH12 1 1 7 1559 1 1 9 ARG HH21 H 11.240 -8.013 0.602 1.00 . A A . 9 ARG HH21 1 1 7 1560 1 1 9 ARG HH22 H 11.848 -7.792 2.210 1.00 . A A . 9 ARG HH22 1 1 7 1561 1 1 9 ARG N N 6.760 -2.894 -0.454 1.00 . A A . 9 ARG N 1 1 7 1562 1 1 9 ARG NE N 10.484 -5.648 0.253 1.00 . A A . 9 ARG NE 1 1 7 1563 1 1 9 ARG NH1 N 11.294 -5.362 2.393 1.00 . A A . 9 ARG NH1 1 1 7 1564 1 1 9 ARG NH2 N 11.412 -7.421 1.390 1.00 . A A . 9 ARG NH2 1 1 7 1565 1 1 9 ARG O O 8.165 0.210 0.309 1.00 . A A . 9 ARG O 1 1 7 1566 1 1 10 PRO C C 5.359 1.649 -0.853 1.00 . A A . 10 PRO C 1 1 7 1567 1 1 10 PRO CA C 6.531 1.191 -1.717 1.00 . A A . 10 PRO CA 1 1 7 1568 1 1 10 PRO CB C 6.150 1.204 -3.194 1.00 . A A . 10 PRO CB 1 1 7 1569 1 1 10 PRO CD C 6.240 -1.095 -2.485 1.00 . A A . 10 PRO CD 1 1 7 1570 1 1 10 PRO CG C 5.565 -0.145 -3.443 1.00 . A A . 10 PRO CG 1 1 7 1571 1 1 10 PRO HA H 7.377 1.841 -1.552 1.00 . A A . 10 PRO HA 1 1 7 1572 1 1 10 PRO HB2 H 5.432 1.988 -3.379 1.00 . A A . 10 PRO HB2 1 1 7 1573 1 1 10 PRO HB3 H 7.032 1.367 -3.795 1.00 . A A . 10 PRO HB3 1 1 7 1574 1 1 10 PRO HD2 H 5.508 -1.735 -2.017 1.00 . A A . 10 PRO HD2 1 1 7 1575 1 1 10 PRO HD3 H 6.981 -1.686 -3.003 1.00 . A A . 10 PRO HD3 1 1 7 1576 1 1 10 PRO HG2 H 4.502 -0.121 -3.257 1.00 . A A . 10 PRO HG2 1 1 7 1577 1 1 10 PRO HG3 H 5.760 -0.443 -4.463 1.00 . A A . 10 PRO HG3 1 1 7 1578 1 1 10 PRO N N 6.875 -0.210 -1.487 1.00 . A A . 10 PRO N 1 1 7 1579 1 1 10 PRO O O 4.996 0.986 0.119 1.00 . A A . 10 PRO O 1 1 7 1580 1 1 11 SER C C 4.046 3.688 0.953 1.00 . A A . 11 SER C 1 1 7 1581 1 1 11 SER CA C 3.641 3.334 -0.474 1.00 . A A . 11 SER CA 1 1 7 1582 1 1 11 SER CB C 2.481 2.338 -0.455 1.00 . A A . 11 SER CB 1 1 7 1583 1 1 11 SER H H 5.109 3.267 -1.997 1.00 . A A . 11 SER H 1 1 7 1584 1 1 11 SER HA H 3.323 4.235 -0.978 1.00 . A A . 11 SER HA 1 1 7 1585 1 1 11 SER HB2 H 2.801 1.424 0.021 1.00 . A A . 11 SER HB2 1 1 7 1586 1 1 11 SER HB3 H 1.656 2.761 0.098 1.00 . A A . 11 SER HB3 1 1 7 1587 1 1 11 SER HG H 1.914 2.854 -2.258 1.00 . A A . 11 SER HG 1 1 7 1588 1 1 11 SER N N 4.772 2.785 -1.214 1.00 . A A . 11 SER N 1 1 7 1589 1 1 11 SER O O 3.912 2.875 1.867 1.00 . A A . 11 SER O 1 1 7 1590 1 1 11 SER OG O 2.044 2.038 -1.769 1.00 . A A . 11 SER OG 1 1 7 1591 1 1 12 ILE C C 6.123 4.531 2.980 1.00 . A A . 12 ILE C 1 1 7 1592 1 1 12 ILE CA C 4.962 5.373 2.453 1.00 . A A . 12 ILE CA 1 1 7 1593 1 1 12 ILE CB C 3.797 5.326 3.464 1.00 . A A . 12 ILE CB 1 1 7 1594 1 1 12 ILE CD1 C 3.033 7.668 2.824 1.00 . A A . 12 ILE CD1 1 1 7 1595 1 1 12 ILE CG1 C 2.647 6.214 2.986 1.00 . A A . 12 ILE CG1 1 1 7 1596 1 1 12 ILE CG2 C 4.266 5.763 4.845 1.00 . A A . 12 ILE CG2 1 1 7 1597 1 1 12 ILE H H 4.621 5.512 0.369 1.00 . A A . 12 ILE H 1 1 7 1598 1 1 12 ILE HA H 5.289 6.398 2.356 1.00 . A A . 12 ILE HA 1 1 7 1599 1 1 12 ILE HB H 3.450 4.306 3.534 1.00 . A A . 12 ILE HB 1 1 7 1600 1 1 12 ILE HD11 H 2.369 8.285 3.411 1.00 . A A . 12 ILE HD11 1 1 7 1601 1 1 12 ILE HD12 H 2.956 7.947 1.783 1.00 . A A . 12 ILE HD12 1 1 7 1602 1 1 12 ILE HD13 H 4.049 7.811 3.160 1.00 . A A . 12 ILE HD13 1 1 7 1603 1 1 12 ILE HG12 H 2.297 5.856 2.029 1.00 . A A . 12 ILE HG12 1 1 7 1604 1 1 12 ILE HG13 H 1.839 6.162 3.702 1.00 . A A . 12 ILE HG13 1 1 7 1605 1 1 12 ILE HG21 H 3.467 6.288 5.347 1.00 . A A . 12 ILE HG21 1 1 7 1606 1 1 12 ILE HG22 H 5.119 6.417 4.746 1.00 . A A . 12 ILE HG22 1 1 7 1607 1 1 12 ILE HG23 H 4.544 4.893 5.423 1.00 . A A . 12 ILE HG23 1 1 7 1608 1 1 12 ILE N N 4.540 4.909 1.136 1.00 . A A . 12 ILE N 1 1 7 1609 1 1 12 ILE O O 6.877 5.037 3.836 1.00 . A A . 12 ILE O 1 1 7 1610 1 1 12 ILE OXT O 6.264 3.374 2.532 1.00 . A A . 12 ILE OXT 1 1 8 1611 1 1 1 HIS C C -5.613 5.454 1.526 1.00 . A A . 1 HIS C 1 1 8 1612 1 1 1 HIS CA C -5.335 6.790 2.211 1.00 . A A . 1 HIS CA 1 1 8 1613 1 1 1 HIS CB C -6.227 6.947 3.443 1.00 . A A . 1 HIS CB 1 1 8 1614 1 1 1 HIS CD2 C -6.816 9.247 4.489 1.00 . A A . 1 HIS CD2 1 1 8 1615 1 1 1 HIS CE1 C -4.858 9.714 5.358 1.00 . A A . 1 HIS CE1 1 1 8 1616 1 1 1 HIS CG C -5.986 8.216 4.200 1.00 . A A . 1 HIS CG 1 1 8 1617 1 1 1 HIS H1 H -6.623 8.071 1.245 1.00 . A A . 1 HIS H1 1 1 8 1618 1 1 1 HIS H2 H -5.207 7.676 0.358 1.00 . A A . 1 HIS H2 1 1 8 1619 1 1 1 HIS H3 H -5.118 8.766 1.681 1.00 . A A . 1 HIS H3 1 1 8 1620 1 1 1 HIS HA H -4.299 6.821 2.515 1.00 . A A . 1 HIS HA 1 1 8 1621 1 1 1 HIS HB2 H -7.262 6.937 3.134 1.00 . A A . 1 HIS HB2 1 1 8 1622 1 1 1 HIS HB3 H -6.050 6.120 4.115 1.00 . A A . 1 HIS HB3 1 1 8 1623 1 1 1 HIS HD1 H -3.957 7.991 4.721 1.00 . A A . 1 HIS HD1 1 1 8 1624 1 1 1 HIS HD2 H -7.856 9.332 4.206 1.00 . A A . 1 HIS HD2 1 1 8 1625 1 1 1 HIS HE1 H -4.059 10.221 5.879 1.00 . A A . 1 HIS HE1 1 1 8 1626 1 1 1 HIS HE2 H -6.401 11.055 5.472 1.00 . A A . 1 HIS HE2 1 1 8 1627 1 1 1 HIS N N -5.594 7.928 1.291 1.00 . A A . 1 HIS N 1 1 8 1628 1 1 1 HIS ND1 N -4.767 8.540 4.758 1.00 . A A . 1 HIS ND1 1 1 8 1629 1 1 1 HIS NE2 N -6.090 10.164 5.208 1.00 . A A . 1 HIS NE2 1 1 8 1630 1 1 1 HIS O O -6.640 4.822 1.772 1.00 . A A . 1 HIS O 1 1 8 1631 1 1 2 PRO C C -4.580 2.529 0.816 1.00 . A A . 2 PRO C 1 1 8 1632 1 1 2 PRO CA C -4.851 3.739 -0.072 1.00 . A A . 2 PRO CA 1 1 8 1633 1 1 2 PRO CB C -3.801 3.839 -1.178 1.00 . A A . 2 PRO CB 1 1 8 1634 1 1 2 PRO CD C -3.442 5.695 0.293 1.00 . A A . 2 PRO CD 1 1 8 1635 1 1 2 PRO CG C -2.740 4.714 -0.610 1.00 . A A . 2 PRO CG 1 1 8 1636 1 1 2 PRO HA H -5.834 3.650 -0.510 1.00 . A A . 2 PRO HA 1 1 8 1637 1 1 2 PRO HB2 H -3.423 2.853 -1.409 1.00 . A A . 2 PRO HB2 1 1 8 1638 1 1 2 PRO HB3 H -4.244 4.276 -2.060 1.00 . A A . 2 PRO HB3 1 1 8 1639 1 1 2 PRO HD2 H -2.846 5.889 1.173 1.00 . A A . 2 PRO HD2 1 1 8 1640 1 1 2 PRO HD3 H -3.645 6.615 -0.235 1.00 . A A . 2 PRO HD3 1 1 8 1641 1 1 2 PRO HG2 H -2.038 4.120 -0.044 1.00 . A A . 2 PRO HG2 1 1 8 1642 1 1 2 PRO HG3 H -2.232 5.238 -1.406 1.00 . A A . 2 PRO HG3 1 1 8 1643 1 1 2 PRO N N -4.697 5.005 0.649 1.00 . A A . 2 PRO N 1 1 8 1644 1 1 2 PRO O O -3.496 1.945 0.775 1.00 . A A . 2 PRO O 1 1 8 1645 1 1 3 LEU C C -6.016 -0.258 1.896 1.00 . A A . 3 LEU C 1 1 8 1646 1 1 3 LEU CA C -5.441 1.014 2.517 1.00 . A A . 3 LEU CA 1 1 8 1647 1 1 3 LEU CB C -6.110 1.319 3.862 1.00 . A A . 3 LEU CB 1 1 8 1648 1 1 3 LEU CD1 C -8.409 0.494 3.232 1.00 . A A . 3 LEU CD1 1 1 8 1649 1 1 3 LEU CD2 C -8.118 2.025 5.187 1.00 . A A . 3 LEU CD2 1 1 8 1650 1 1 3 LEU CG C -7.605 1.650 3.805 1.00 . A A . 3 LEU CG 1 1 8 1651 1 1 3 LEU H H -6.412 2.660 1.606 1.00 . A A . 3 LEU H 1 1 8 1652 1 1 3 LEU HA H -4.388 0.861 2.687 1.00 . A A . 3 LEU HA 1 1 8 1653 1 1 3 LEU HB2 H -5.980 0.460 4.504 1.00 . A A . 3 LEU HB2 1 1 8 1654 1 1 3 LEU HB3 H -5.597 2.157 4.311 1.00 . A A . 3 LEU HB3 1 1 8 1655 1 1 3 LEU HD11 H -8.484 0.602 2.160 1.00 . A A . 3 LEU HD11 1 1 8 1656 1 1 3 LEU HD12 H -9.399 0.495 3.663 1.00 . A A . 3 LEU HD12 1 1 8 1657 1 1 3 LEU HD13 H -7.917 -0.439 3.466 1.00 . A A . 3 LEU HD13 1 1 8 1658 1 1 3 LEU HD21 H -9.180 2.214 5.137 1.00 . A A . 3 LEU HD21 1 1 8 1659 1 1 3 LEU HD22 H -7.610 2.914 5.530 1.00 . A A . 3 LEU HD22 1 1 8 1660 1 1 3 LEU HD23 H -7.928 1.213 5.874 1.00 . A A . 3 LEU HD23 1 1 8 1661 1 1 3 LEU HG H -7.743 2.501 3.157 1.00 . A A . 3 LEU HG 1 1 8 1662 1 1 3 LEU N N -5.572 2.156 1.618 1.00 . A A . 3 LEU N 1 1 8 1663 1 1 3 LEU O O -5.800 -1.358 2.406 1.00 . A A . 3 LEU O 1 1 8 1664 1 1 4 LYS C C -6.472 -1.700 -1.054 1.00 . A A . 4 LYS C 1 1 8 1665 1 1 4 LYS CA C -7.346 -1.248 0.112 1.00 . A A . 4 LYS CA 1 1 8 1666 1 1 4 LYS CB C -8.747 -0.889 -0.392 1.00 . A A . 4 LYS CB 1 1 8 1667 1 1 4 LYS CD C -10.828 -1.618 -1.596 1.00 . A A . 4 LYS CD 1 1 8 1668 1 1 4 LYS CE C -11.526 -2.757 -2.322 1.00 . A A . 4 LYS CE 1 1 8 1669 1 1 4 LYS CG C -9.444 -2.028 -1.118 1.00 . A A . 4 LYS CG 1 1 8 1670 1 1 4 LYS H H -6.886 0.793 0.432 1.00 . A A . 4 LYS H 1 1 8 1671 1 1 4 LYS HA H -7.425 -2.056 0.823 1.00 . A A . 4 LYS HA 1 1 8 1672 1 1 4 LYS HB2 H -9.357 -0.600 0.451 1.00 . A A . 4 LYS HB2 1 1 8 1673 1 1 4 LYS HB3 H -8.668 -0.052 -1.071 1.00 . A A . 4 LYS HB3 1 1 8 1674 1 1 4 LYS HD2 H -11.424 -1.331 -0.742 1.00 . A A . 4 LYS HD2 1 1 8 1675 1 1 4 LYS HD3 H -10.732 -0.779 -2.269 1.00 . A A . 4 LYS HD3 1 1 8 1676 1 1 4 LYS HE2 H -10.928 -3.045 -3.173 1.00 . A A . 4 LYS HE2 1 1 8 1677 1 1 4 LYS HE3 H -11.617 -3.595 -1.646 1.00 . A A . 4 LYS HE3 1 1 8 1678 1 1 4 LYS HG2 H -8.850 -2.315 -1.971 1.00 . A A . 4 LYS HG2 1 1 8 1679 1 1 4 LYS HG3 H -9.540 -2.866 -0.443 1.00 . A A . 4 LYS HG3 1 1 8 1680 1 1 4 LYS HZ1 H -13.153 -2.939 -3.619 1.00 . A A . 4 LYS HZ1 1 1 8 1681 1 1 4 LYS HZ2 H -12.892 -1.363 -3.067 1.00 . A A . 4 LYS HZ2 1 1 8 1682 1 1 4 LYS HZ3 H -13.582 -2.513 -2.038 1.00 . A A . 4 LYS HZ3 1 1 8 1683 1 1 4 LYS N N -6.747 -0.107 0.795 1.00 . A A . 4 LYS N 1 1 8 1684 1 1 4 LYS NZ N -12.882 -2.365 -2.795 1.00 . A A . 4 LYS NZ 1 1 8 1685 1 1 4 LYS O O -6.762 -1.400 -2.212 1.00 . A A . 4 LYS O 1 1 8 1686 1 1 5 GLN C C -3.341 -3.717 -1.133 1.00 . A A . 5 GLN C 1 1 8 1687 1 1 5 GLN CA C -4.482 -2.921 -1.757 1.00 . A A . 5 GLN CA 1 1 8 1688 1 1 5 GLN CB C -3.916 -1.759 -2.579 1.00 . A A . 5 GLN CB 1 1 8 1689 1 1 5 GLN CD C -2.402 -1.027 -4.464 1.00 . A A . 5 GLN CD 1 1 8 1690 1 1 5 GLN CG C -2.946 -2.196 -3.666 1.00 . A A . 5 GLN CG 1 1 8 1691 1 1 5 GLN H H -5.230 -2.631 0.204 1.00 . A A . 5 GLN H 1 1 8 1692 1 1 5 GLN HA H -5.037 -3.572 -2.409 1.00 . A A . 5 GLN HA 1 1 8 1693 1 1 5 GLN HB2 H -4.734 -1.232 -3.048 1.00 . A A . 5 GLN HB2 1 1 8 1694 1 1 5 GLN HB3 H -3.398 -1.083 -1.915 1.00 . A A . 5 GLN HB3 1 1 8 1695 1 1 5 GLN HE21 H -0.546 -1.491 -3.921 1.00 . A A . 5 GLN HE21 1 1 8 1696 1 1 5 GLN HE22 H -0.705 -0.112 -4.950 1.00 . A A . 5 GLN HE22 1 1 8 1697 1 1 5 GLN HG2 H -2.119 -2.714 -3.206 1.00 . A A . 5 GLN HG2 1 1 8 1698 1 1 5 GLN HG3 H -3.460 -2.865 -4.340 1.00 . A A . 5 GLN HG3 1 1 8 1699 1 1 5 GLN N N -5.403 -2.424 -0.737 1.00 . A A . 5 GLN N 1 1 8 1700 1 1 5 GLN NE2 N -1.084 -0.860 -4.443 1.00 . A A . 5 GLN NE2 1 1 8 1701 1 1 5 GLN O O -2.789 -4.622 -1.758 1.00 . A A . 5 GLN O 1 1 8 1702 1 1 5 GLN OE1 O -3.156 -0.284 -5.092 1.00 . A A . 5 GLN OE1 1 1 8 1703 1 1 6 TYR C C -0.566 -3.765 0.157 1.00 . A A . 6 TYR C 1 1 8 1704 1 1 6 TYR CA C -1.913 -4.042 0.817 1.00 . A A . 6 TYR CA 1 1 8 1705 1 1 6 TYR CB C -2.164 -5.554 0.880 1.00 . A A . 6 TYR CB 1 1 8 1706 1 1 6 TYR CD1 C -4.305 -4.994 2.128 1.00 . A A . 6 TYR CD1 1 1 8 1707 1 1 6 TYR CD2 C -3.801 -7.287 1.712 1.00 . A A . 6 TYR CD2 1 1 8 1708 1 1 6 TYR CE1 C -5.471 -5.364 2.771 1.00 . A A . 6 TYR CE1 1 1 8 1709 1 1 6 TYR CE2 C -4.966 -7.663 2.354 1.00 . A A . 6 TYR CE2 1 1 8 1710 1 1 6 TYR CG C -3.448 -5.949 1.586 1.00 . A A . 6 TYR CG 1 1 8 1711 1 1 6 TYR CZ C -5.797 -6.698 2.880 1.00 . A A . 6 TYR CZ 1 1 8 1712 1 1 6 TYR H H -3.469 -2.637 0.536 1.00 . A A . 6 TYR H 1 1 8 1713 1 1 6 TYR HA H -1.892 -3.649 1.822 1.00 . A A . 6 TYR HA 1 1 8 1714 1 1 6 TYR HB2 H -2.208 -5.945 -0.124 1.00 . A A . 6 TYR HB2 1 1 8 1715 1 1 6 TYR HB3 H -1.342 -6.022 1.403 1.00 . A A . 6 TYR HB3 1 1 8 1716 1 1 6 TYR HD1 H -4.049 -3.949 2.043 1.00 . A A . 6 TYR HD1 1 1 8 1717 1 1 6 TYR HD2 H -3.148 -8.042 1.298 1.00 . A A . 6 TYR HD2 1 1 8 1718 1 1 6 TYR HE1 H -6.122 -4.607 3.185 1.00 . A A . 6 TYR HE1 1 1 8 1719 1 1 6 TYR HE2 H -5.220 -8.709 2.440 1.00 . A A . 6 TYR HE2 1 1 8 1720 1 1 6 TYR HH H -7.714 -6.742 3.028 1.00 . A A . 6 TYR HH 1 1 8 1721 1 1 6 TYR N N -2.991 -3.369 0.099 1.00 . A A . 6 TYR N 1 1 8 1722 1 1 6 TYR O O -0.073 -4.568 -0.634 1.00 . A A . 6 TYR O 1 1 8 1723 1 1 6 TYR OH O -6.957 -7.069 3.521 1.00 . A A . 6 TYR OH 1 1 8 1724 1 1 7 TRP C C 2.405 -3.206 0.350 1.00 . A A . 7 TRP C 1 1 8 1725 1 1 7 TRP CA C 1.311 -2.230 -0.069 1.00 . A A . 7 TRP CA 1 1 8 1726 1 1 7 TRP CB C 1.676 -0.814 0.383 1.00 . A A . 7 TRP CB 1 1 8 1727 1 1 7 TRP CD1 C 2.627 -1.350 2.701 1.00 . A A . 7 TRP CD1 1 1 8 1728 1 1 7 TRP CD2 C 1.005 0.194 2.707 1.00 . A A . 7 TRP CD2 1 1 8 1729 1 1 7 TRP CE2 C 1.439 -0.008 4.032 1.00 . A A . 7 TRP CE2 1 1 8 1730 1 1 7 TRP CE3 C -0.011 1.123 2.467 1.00 . A A . 7 TRP CE3 1 1 8 1731 1 1 7 TRP CG C 1.779 -0.675 1.871 1.00 . A A . 7 TRP CG 1 1 8 1732 1 1 7 TRP CH2 C -0.100 1.588 4.843 1.00 . A A . 7 TRP CH2 1 1 8 1733 1 1 7 TRP CZ2 C 0.892 0.685 5.108 1.00 . A A . 7 TRP CZ2 1 1 8 1734 1 1 7 TRP CZ3 C -0.553 1.810 3.536 1.00 . A A . 7 TRP CZ3 1 1 8 1735 1 1 7 TRP H H -0.424 -2.022 1.125 1.00 . A A . 7 TRP H 1 1 8 1736 1 1 7 TRP HA H 1.224 -2.244 -1.144 1.00 . A A . 7 TRP HA 1 1 8 1737 1 1 7 TRP HB2 H 2.629 -0.542 -0.044 1.00 . A A . 7 TRP HB2 1 1 8 1738 1 1 7 TRP HB3 H 0.919 -0.126 0.033 1.00 . A A . 7 TRP HB3 1 1 8 1739 1 1 7 TRP HD1 H 3.345 -2.085 2.369 1.00 . A A . 7 TRP HD1 1 1 8 1740 1 1 7 TRP HE1 H 2.917 -1.294 4.781 1.00 . A A . 7 TRP HE1 1 1 8 1741 1 1 7 TRP HE3 H -0.374 1.308 1.466 1.00 . A A . 7 TRP HE3 1 1 8 1742 1 1 7 TRP HH2 H -0.554 2.147 5.648 1.00 . A A . 7 TRP HH2 1 1 8 1743 1 1 7 TRP HZ2 H 1.230 0.527 6.122 1.00 . A A . 7 TRP HZ2 1 1 8 1744 1 1 7 TRP HZ3 H -1.340 2.531 3.369 1.00 . A A . 7 TRP HZ3 1 1 8 1745 1 1 7 TRP N N 0.021 -2.619 0.490 1.00 . A A . 7 TRP N 1 1 8 1746 1 1 7 TRP NE1 N 2.430 -0.955 4.002 1.00 . A A . 7 TRP NE1 1 1 8 1747 1 1 7 TRP O O 2.167 -4.121 1.137 1.00 . A A . 7 TRP O 1 1 8 1748 1 1 8 TRP C C 5.998 -3.005 0.307 1.00 . A A . 8 TRP C 1 1 8 1749 1 1 8 TRP CA C 4.740 -3.862 0.136 1.00 . A A . 8 TRP CA 1 1 8 1750 1 1 8 TRP CB C 4.929 -4.904 -0.975 1.00 . A A . 8 TRP CB 1 1 8 1751 1 1 8 TRP CD1 C 6.437 -6.868 -1.613 1.00 . A A . 8 TRP CD1 1 1 8 1752 1 1 8 TRP CD2 C 6.876 -6.038 0.424 1.00 . A A . 8 TRP CD2 1 1 8 1753 1 1 8 TRP CE2 C 7.767 -7.100 0.163 1.00 . A A . 8 TRP CE2 1 1 8 1754 1 1 8 TRP CE3 C 6.969 -5.380 1.658 1.00 . A A . 8 TRP CE3 1 1 8 1755 1 1 8 TRP CG C 6.052 -5.881 -0.750 1.00 . A A . 8 TRP CG 1 1 8 1756 1 1 8 TRP CH2 C 8.790 -6.853 2.277 1.00 . A A . 8 TRP CH2 1 1 8 1757 1 1 8 TRP CZ2 C 8.727 -7.515 1.083 1.00 . A A . 8 TRP CZ2 1 1 8 1758 1 1 8 TRP CZ3 C 7.921 -5.798 2.569 1.00 . A A . 8 TRP CZ3 1 1 8 1759 1 1 8 TRP H H 3.733 -2.255 -0.802 1.00 . A A . 8 TRP H 1 1 8 1760 1 1 8 TRP HA H 4.532 -4.364 1.062 1.00 . A A . 8 TRP HA 1 1 8 1761 1 1 8 TRP HB2 H 4.018 -5.473 -1.072 1.00 . A A . 8 TRP HB2 1 1 8 1762 1 1 8 TRP HB3 H 5.117 -4.390 -1.907 1.00 . A A . 8 TRP HB3 1 1 8 1763 1 1 8 TRP HD1 H 5.997 -7.027 -2.586 1.00 . A A . 8 TRP HD1 1 1 8 1764 1 1 8 TRP HE1 H 7.947 -8.322 -1.530 1.00 . A A . 8 TRP HE1 1 1 8 1765 1 1 8 TRP HE3 H 6.308 -4.569 1.911 1.00 . A A . 8 TRP HE3 1 1 8 1766 1 1 8 TRP HH2 H 9.516 -7.146 3.020 1.00 . A A . 8 TRP HH2 1 1 8 1767 1 1 8 TRP HZ2 H 9.405 -8.328 0.873 1.00 . A A . 8 TRP HZ2 1 1 8 1768 1 1 8 TRP HZ3 H 8.003 -5.301 3.525 1.00 . A A . 8 TRP HZ3 1 1 8 1769 1 1 8 TRP N N 3.606 -3.002 -0.182 1.00 . A A . 8 TRP N 1 1 8 1770 1 1 8 TRP NE1 N 7.484 -7.580 -1.087 1.00 . A A . 8 TRP NE1 1 1 8 1771 1 1 8 TRP O O 6.242 -2.459 1.384 1.00 . A A . 8 TRP O 1 1 8 1772 1 1 9 ARG C C 7.695 -0.589 -0.646 1.00 . A A . 9 ARG C 1 1 8 1773 1 1 9 ARG CA C 8.010 -2.085 -0.705 1.00 . A A . 9 ARG CA 1 1 8 1774 1 1 9 ARG CB C 8.897 -2.389 -1.915 1.00 . A A . 9 ARG CB 1 1 8 1775 1 1 9 ARG CD C 10.128 -4.260 -0.777 1.00 . A A . 9 ARG CD 1 1 8 1776 1 1 9 ARG CG C 9.331 -3.842 -2.003 1.00 . A A . 9 ARG CG 1 1 8 1777 1 1 9 ARG CZ C 11.264 -6.265 0.097 1.00 . A A . 9 ARG CZ 1 1 8 1778 1 1 9 ARG H H 6.546 -3.330 -1.583 1.00 . A A . 9 ARG H 1 1 8 1779 1 1 9 ARG HA H 8.543 -2.358 0.194 1.00 . A A . 9 ARG HA 1 1 8 1780 1 1 9 ARG HB2 H 8.357 -2.143 -2.816 1.00 . A A . 9 ARG HB2 1 1 8 1781 1 1 9 ARG HB3 H 9.784 -1.775 -1.859 1.00 . A A . 9 ARG HB3 1 1 8 1782 1 1 9 ARG HD2 H 11.002 -3.631 -0.701 1.00 . A A . 9 ARG HD2 1 1 8 1783 1 1 9 ARG HD3 H 9.511 -4.127 0.099 1.00 . A A . 9 ARG HD3 1 1 8 1784 1 1 9 ARG HE H 10.297 -6.166 -1.648 1.00 . A A . 9 ARG HE 1 1 8 1785 1 1 9 ARG HG2 H 8.453 -4.466 -2.079 1.00 . A A . 9 ARG HG2 1 1 8 1786 1 1 9 ARG HG3 H 9.945 -3.972 -2.882 1.00 . A A . 9 ARG HG3 1 1 8 1787 1 1 9 ARG HH11 H 11.363 -4.650 1.310 1.00 . A A . 9 ARG HH11 1 1 8 1788 1 1 9 ARG HH12 H 12.157 -6.071 1.900 1.00 . A A . 9 ARG HH12 1 1 8 1789 1 1 9 ARG HH21 H 11.343 -8.036 -0.873 1.00 . A A . 9 ARG HH21 1 1 8 1790 1 1 9 ARG HH22 H 12.147 -7.993 0.661 1.00 . A A . 9 ARG HH22 1 1 8 1791 1 1 9 ARG N N 6.790 -2.882 -0.753 1.00 . A A . 9 ARG N 1 1 8 1792 1 1 9 ARG NE N 10.553 -5.656 -0.850 1.00 . A A . 9 ARG NE 1 1 8 1793 1 1 9 ARG NH1 N 11.623 -5.608 1.192 1.00 . A A . 9 ARG NH1 1 1 8 1794 1 1 9 ARG NH2 N 11.612 -7.536 -0.050 1.00 . A A . 9 ARG NH2 1 1 8 1795 1 1 9 ARG O O 8.239 0.129 0.192 1.00 . A A . 9 ARG O 1 1 8 1796 1 1 10 PRO C C 5.455 1.691 -0.457 1.00 . A A . 10 PRO C 1 1 8 1797 1 1 10 PRO CA C 6.444 1.327 -1.560 1.00 . A A . 10 PRO CA 1 1 8 1798 1 1 10 PRO CB C 5.797 1.492 -2.933 1.00 . A A . 10 PRO CB 1 1 8 1799 1 1 10 PRO CD C 6.103 -0.860 -2.579 1.00 . A A . 10 PRO CD 1 1 8 1800 1 1 10 PRO CG C 5.199 0.159 -3.225 1.00 . A A . 10 PRO CG 1 1 8 1801 1 1 10 PRO HA H 7.314 1.964 -1.489 1.00 . A A . 10 PRO HA 1 1 8 1802 1 1 10 PRO HB2 H 5.044 2.265 -2.890 1.00 . A A . 10 PRO HB2 1 1 8 1803 1 1 10 PRO HB3 H 6.550 1.753 -3.661 1.00 . A A . 10 PRO HB3 1 1 8 1804 1 1 10 PRO HD2 H 5.518 -1.655 -2.143 1.00 . A A . 10 PRO HD2 1 1 8 1805 1 1 10 PRO HD3 H 6.797 -1.255 -3.305 1.00 . A A . 10 PRO HD3 1 1 8 1806 1 1 10 PRO HG2 H 4.208 0.102 -2.799 1.00 . A A . 10 PRO HG2 1 1 8 1807 1 1 10 PRO HG3 H 5.160 0.001 -4.292 1.00 . A A . 10 PRO HG3 1 1 8 1808 1 1 10 PRO N N 6.811 -0.090 -1.534 1.00 . A A . 10 PRO N 1 1 8 1809 1 1 10 PRO O O 4.242 1.609 -0.646 1.00 . A A . 10 PRO O 1 1 8 1810 1 1 11 SER C C 4.240 3.645 1.468 1.00 . A A . 11 SER C 1 1 8 1811 1 1 11 SER CA C 5.146 2.471 1.827 1.00 . A A . 11 SER CA 1 1 8 1812 1 1 11 SER CB C 6.017 2.835 3.032 1.00 . A A . 11 SER CB 1 1 8 1813 1 1 11 SER H H 6.957 2.140 0.783 1.00 . A A . 11 SER H 1 1 8 1814 1 1 11 SER HA H 4.531 1.621 2.082 1.00 . A A . 11 SER HA 1 1 8 1815 1 1 11 SER HB2 H 6.656 3.666 2.773 1.00 . A A . 11 SER HB2 1 1 8 1816 1 1 11 SER HB3 H 5.382 3.114 3.860 1.00 . A A . 11 SER HB3 1 1 8 1817 1 1 11 SER HG H 7.143 1.883 4.321 1.00 . A A . 11 SER HG 1 1 8 1818 1 1 11 SER N N 5.983 2.095 0.694 1.00 . A A . 11 SER N 1 1 8 1819 1 1 11 SER O O 4.586 4.803 1.698 1.00 . A A . 11 SER O 1 1 8 1820 1 1 11 SER OG O 6.827 1.741 3.424 1.00 . A A . 11 SER OG 1 1 8 1821 1 1 12 ILE C C 0.759 4.114 1.153 1.00 . A A . 12 ILE C 1 1 8 1822 1 1 12 ILE CA C 2.120 4.364 0.510 1.00 . A A . 12 ILE CA 1 1 8 1823 1 1 12 ILE CB C 1.959 4.422 -1.024 1.00 . A A . 12 ILE CB 1 1 8 1824 1 1 12 ILE CD1 C 3.894 6.060 -1.253 1.00 . A A . 12 ILE CD1 1 1 8 1825 1 1 12 ILE CG1 C 3.301 4.737 -1.687 1.00 . A A . 12 ILE CG1 1 1 8 1826 1 1 12 ILE CG2 C 0.915 5.462 -1.416 1.00 . A A . 12 ILE CG2 1 1 8 1827 1 1 12 ILE H H 2.858 2.394 0.743 1.00 . A A . 12 ILE H 1 1 8 1828 1 1 12 ILE HA H 2.499 5.317 0.849 1.00 . A A . 12 ILE HA 1 1 8 1829 1 1 12 ILE HB H 1.615 3.458 -1.364 1.00 . A A . 12 ILE HB 1 1 8 1830 1 1 12 ILE HD11 H 4.047 6.687 -2.120 1.00 . A A . 12 ILE HD11 1 1 8 1831 1 1 12 ILE HD12 H 4.840 5.887 -0.763 1.00 . A A . 12 ILE HD12 1 1 8 1832 1 1 12 ILE HD13 H 3.218 6.550 -0.569 1.00 . A A . 12 ILE HD13 1 1 8 1833 1 1 12 ILE HG12 H 4.008 3.960 -1.437 1.00 . A A . 12 ILE HG12 1 1 8 1834 1 1 12 ILE HG13 H 3.168 4.766 -2.758 1.00 . A A . 12 ILE HG13 1 1 8 1835 1 1 12 ILE HG21 H 0.006 4.963 -1.721 1.00 . A A . 12 ILE HG21 1 1 8 1836 1 1 12 ILE HG22 H 1.289 6.059 -2.234 1.00 . A A . 12 ILE HG22 1 1 8 1837 1 1 12 ILE HG23 H 0.708 6.101 -0.570 1.00 . A A . 12 ILE HG23 1 1 8 1838 1 1 12 ILE N N 3.078 3.336 0.902 1.00 . A A . 12 ILE N 1 1 8 1839 1 1 12 ILE O O -0.031 3.335 0.579 1.00 . A A . 12 ILE O 1 1 8 1840 1 1 12 ILE OXT O 0.495 4.698 2.225 1.00 . A A . 12 ILE OXT 1 1 9 1841 1 1 1 HIS C C -2.008 2.174 4.684 1.00 . A A . 1 HIS C 1 1 9 1842 1 1 1 HIS CA C -0.973 2.702 5.675 1.00 . A A . 1 HIS CA 1 1 9 1843 1 1 1 HIS CB C -1.362 2.313 7.103 1.00 . A A . 1 HIS CB 1 1 9 1844 1 1 1 HIS CD2 C -0.511 3.578 9.202 1.00 . A A . 1 HIS CD2 1 1 9 1845 1 1 1 HIS CE1 C 1.574 2.898 9.162 1.00 . A A . 1 HIS CE1 1 1 9 1846 1 1 1 HIS CG C -0.371 2.756 8.134 1.00 . A A . 1 HIS CG 1 1 9 1847 1 1 1 HIS H1 H -1.704 4.584 6.065 1.00 . A A . 1 HIS H1 1 1 9 1848 1 1 1 HIS H2 H -0.830 4.447 4.595 1.00 . A A . 1 HIS H2 1 1 9 1849 1 1 1 HIS H3 H 0.005 4.463 6.094 1.00 . A A . 1 HIS H3 1 1 9 1850 1 1 1 HIS HA H -0.009 2.277 5.440 1.00 . A A . 1 HIS HA 1 1 9 1851 1 1 1 HIS HB2 H -2.314 2.761 7.343 1.00 . A A . 1 HIS HB2 1 1 9 1852 1 1 1 HIS HB3 H -1.449 1.238 7.163 1.00 . A A . 1 HIS HB3 1 1 9 1853 1 1 1 HIS HD1 H 1.361 1.745 7.485 1.00 . A A . 1 HIS HD1 1 1 9 1854 1 1 1 HIS HD2 H -1.416 4.084 9.507 1.00 . A A . 1 HIS HD2 1 1 9 1855 1 1 1 HIS HE1 H 2.614 2.759 9.415 1.00 . A A . 1 HIS HE1 1 1 9 1856 1 1 1 HIS HE2 H 0.892 4.101 10.674 1.00 . A A . 1 HIS HE2 1 1 9 1857 1 1 1 HIS N N -0.866 4.182 5.601 1.00 . A A . 1 HIS N 1 1 9 1858 1 1 1 HIS ND1 N 0.946 2.348 8.137 1.00 . A A . 1 HIS ND1 1 1 9 1859 1 1 1 HIS NE2 N 0.711 3.648 9.823 1.00 . A A . 1 HIS NE2 1 1 9 1860 1 1 1 HIS O O -3.023 2.824 4.431 1.00 . A A . 1 HIS O 1 1 9 1861 1 1 2 PRO C C -4.103 0.243 3.698 1.00 . A A . 2 PRO C 1 1 9 1862 1 1 2 PRO CA C -2.688 0.374 3.143 1.00 . A A . 2 PRO CA 1 1 9 1863 1 1 2 PRO CB C -2.089 -1.011 2.889 1.00 . A A . 2 PRO CB 1 1 9 1864 1 1 2 PRO CD C -0.584 0.137 4.353 1.00 . A A . 2 PRO CD 1 1 9 1865 1 1 2 PRO CG C -0.650 -0.884 3.252 1.00 . A A . 2 PRO CG 1 1 9 1866 1 1 2 PRO HA H -2.718 0.932 2.218 1.00 . A A . 2 PRO HA 1 1 9 1867 1 1 2 PRO HB2 H -2.589 -1.742 3.509 1.00 . A A . 2 PRO HB2 1 1 9 1868 1 1 2 PRO HB3 H -2.211 -1.272 1.848 1.00 . A A . 2 PRO HB3 1 1 9 1869 1 1 2 PRO HD2 H -0.646 -0.344 5.318 1.00 . A A . 2 PRO HD2 1 1 9 1870 1 1 2 PRO HD3 H 0.324 0.716 4.274 1.00 . A A . 2 PRO HD3 1 1 9 1871 1 1 2 PRO HG2 H -0.274 -1.834 3.600 1.00 . A A . 2 PRO HG2 1 1 9 1872 1 1 2 PRO HG3 H -0.085 -0.548 2.395 1.00 . A A . 2 PRO HG3 1 1 9 1873 1 1 2 PRO N N -1.767 0.982 4.108 1.00 . A A . 2 PRO N 1 1 9 1874 1 1 2 PRO O O -4.291 -0.020 4.885 1.00 . A A . 2 PRO O 1 1 9 1875 1 1 3 LEU C C -7.308 -0.518 2.265 1.00 . A A . 3 LEU C 1 1 9 1876 1 1 3 LEU CA C -6.490 0.328 3.241 1.00 . A A . 3 LEU CA 1 1 9 1877 1 1 3 LEU CB C -7.100 1.728 3.383 1.00 . A A . 3 LEU CB 1 1 9 1878 1 1 3 LEU CD1 C -7.864 1.940 0.990 1.00 . A A . 3 LEU CD1 1 1 9 1879 1 1 3 LEU CD2 C -7.623 3.980 2.414 1.00 . A A . 3 LEU CD2 1 1 9 1880 1 1 3 LEU CG C -7.078 2.592 2.118 1.00 . A A . 3 LEU CG 1 1 9 1881 1 1 3 LEU H H -4.881 0.636 1.899 1.00 . A A . 3 LEU H 1 1 9 1882 1 1 3 LEU HA H -6.510 -0.151 4.205 1.00 . A A . 3 LEU HA 1 1 9 1883 1 1 3 LEU HB2 H -8.125 1.618 3.699 1.00 . A A . 3 LEU HB2 1 1 9 1884 1 1 3 LEU HB3 H -6.559 2.253 4.156 1.00 . A A . 3 LEU HB3 1 1 9 1885 1 1 3 LEU HD11 H -8.186 2.698 0.291 1.00 . A A . 3 LEU HD11 1 1 9 1886 1 1 3 LEU HD12 H -8.729 1.437 1.398 1.00 . A A . 3 LEU HD12 1 1 9 1887 1 1 3 LEU HD13 H -7.237 1.223 0.482 1.00 . A A . 3 LEU HD13 1 1 9 1888 1 1 3 LEU HD21 H -7.351 4.653 1.614 1.00 . A A . 3 LEU HD21 1 1 9 1889 1 1 3 LEU HD22 H -7.205 4.340 3.344 1.00 . A A . 3 LEU HD22 1 1 9 1890 1 1 3 LEU HD23 H -8.699 3.937 2.497 1.00 . A A . 3 LEU HD23 1 1 9 1891 1 1 3 LEU HG H -6.057 2.698 1.789 1.00 . A A . 3 LEU HG 1 1 9 1892 1 1 3 LEU N N -5.094 0.428 2.833 1.00 . A A . 3 LEU N 1 1 9 1893 1 1 3 LEU O O -8.529 -0.613 2.393 1.00 . A A . 3 LEU O 1 1 9 1894 1 1 4 LYS C C -6.329 -2.532 -0.715 1.00 . A A . 4 LYS C 1 1 9 1895 1 1 4 LYS CA C -7.313 -1.973 0.306 1.00 . A A . 4 LYS CA 1 1 9 1896 1 1 4 LYS CB C -8.408 -1.177 -0.412 1.00 . A A . 4 LYS CB 1 1 9 1897 1 1 4 LYS CD C -10.232 -1.146 -2.139 1.00 . A A . 4 LYS CD 1 1 9 1898 1 1 4 LYS CE C -10.985 -1.949 -3.188 1.00 . A A . 4 LYS CE 1 1 9 1899 1 1 4 LYS CG C -9.160 -1.982 -1.459 1.00 . A A . 4 LYS CG 1 1 9 1900 1 1 4 LYS H H -5.664 -1.030 1.242 1.00 . A A . 4 LYS H 1 1 9 1901 1 1 4 LYS HA H -7.762 -2.792 0.829 1.00 . A A . 4 LYS HA 1 1 9 1902 1 1 4 LYS HB2 H -9.121 -0.827 0.318 1.00 . A A . 4 LYS HB2 1 1 9 1903 1 1 4 LYS HB3 H -7.957 -0.326 -0.899 1.00 . A A . 4 LYS HB3 1 1 9 1904 1 1 4 LYS HD2 H -10.932 -0.801 -1.393 1.00 . A A . 4 LYS HD2 1 1 9 1905 1 1 4 LYS HD3 H -9.763 -0.297 -2.615 1.00 . A A . 4 LYS HD3 1 1 9 1906 1 1 4 LYS HE2 H -10.282 -2.296 -3.931 1.00 . A A . 4 LYS HE2 1 1 9 1907 1 1 4 LYS HE3 H -11.448 -2.798 -2.708 1.00 . A A . 4 LYS HE3 1 1 9 1908 1 1 4 LYS HG2 H -8.460 -2.328 -2.206 1.00 . A A . 4 LYS HG2 1 1 9 1909 1 1 4 LYS HG3 H -9.627 -2.831 -0.981 1.00 . A A . 4 LYS HG3 1 1 9 1910 1 1 4 LYS HZ1 H -12.346 -1.605 -4.734 1.00 . A A . 4 LYS HZ1 1 1 9 1911 1 1 4 LYS HZ2 H -11.666 -0.196 -4.095 1.00 . A A . 4 LYS HZ2 1 1 9 1912 1 1 4 LYS HZ3 H -12.858 -1.026 -3.230 1.00 . A A . 4 LYS HZ3 1 1 9 1913 1 1 4 LYS N N -6.635 -1.136 1.293 1.00 . A A . 4 LYS N 1 1 9 1914 1 1 4 LYS NZ N -12.037 -1.138 -3.858 1.00 . A A . 4 LYS NZ 1 1 9 1915 1 1 4 LYS O O -6.512 -3.633 -1.234 1.00 . A A . 4 LYS O 1 1 9 1916 1 1 5 GLN C C -3.228 -3.063 -1.314 1.00 . A A . 5 GLN C 1 1 9 1917 1 1 5 GLN CA C -4.277 -2.168 -1.963 1.00 . A A . 5 GLN CA 1 1 9 1918 1 1 5 GLN CB C -3.608 -0.938 -2.581 1.00 . A A . 5 GLN CB 1 1 9 1919 1 1 5 GLN CD C -1.887 -0.042 -4.199 1.00 . A A . 5 GLN CD 1 1 9 1920 1 1 5 GLN CG C -2.533 -1.277 -3.601 1.00 . A A . 5 GLN CG 1 1 9 1921 1 1 5 GLN H H -5.214 -0.898 -0.553 1.00 . A A . 5 GLN H 1 1 9 1922 1 1 5 GLN HA H -4.768 -2.726 -2.739 1.00 . A A . 5 GLN HA 1 1 9 1923 1 1 5 GLN HB2 H -4.362 -0.341 -3.070 1.00 . A A . 5 GLN HB2 1 1 9 1924 1 1 5 GLN HB3 H -3.155 -0.355 -1.793 1.00 . A A . 5 GLN HB3 1 1 9 1925 1 1 5 GLN HE21 H -0.108 -0.613 -3.518 1.00 . A A . 5 GLN HE21 1 1 9 1926 1 1 5 GLN HE22 H -0.134 0.876 -4.396 1.00 . A A . 5 GLN HE22 1 1 9 1927 1 1 5 GLN HG2 H -1.768 -1.865 -3.117 1.00 . A A . 5 GLN HG2 1 1 9 1928 1 1 5 GLN HG3 H -2.979 -1.854 -4.398 1.00 . A A . 5 GLN HG3 1 1 9 1929 1 1 5 GLN N N -5.293 -1.762 -0.999 1.00 . A A . 5 GLN N 1 1 9 1930 1 1 5 GLN NE2 N -0.577 0.086 -4.019 1.00 . A A . 5 GLN NE2 1 1 9 1931 1 1 5 GLN O O -2.659 -3.942 -1.961 1.00 . A A . 5 GLN O 1 1 9 1932 1 1 5 GLN OE1 O -2.556 0.787 -4.815 1.00 . A A . 5 GLN OE1 1 1 9 1933 1 1 6 TYR C C -0.632 -3.568 0.028 1.00 . A A . 6 TYR C 1 1 9 1934 1 1 6 TYR CA C -1.998 -3.617 0.710 1.00 . A A . 6 TYR CA 1 1 9 1935 1 1 6 TYR CB C -2.466 -5.071 0.837 1.00 . A A . 6 TYR CB 1 1 9 1936 1 1 6 TYR CD1 C -4.489 -4.156 2.075 1.00 . A A . 6 TYR CD1 1 1 9 1937 1 1 6 TYR CD2 C -4.330 -6.513 1.745 1.00 . A A . 6 TYR CD2 1 1 9 1938 1 1 6 TYR CE1 C -5.689 -4.328 2.738 1.00 . A A . 6 TYR CE1 1 1 9 1939 1 1 6 TYR CE2 C -5.530 -6.690 2.407 1.00 . A A . 6 TYR CE2 1 1 9 1940 1 1 6 TYR CG C -3.787 -5.245 1.565 1.00 . A A . 6 TYR CG 1 1 9 1941 1 1 6 TYR CZ C -6.205 -5.595 2.901 1.00 . A A . 6 TYR CZ 1 1 9 1942 1 1 6 TYR H H -3.468 -2.118 0.421 1.00 . A A . 6 TYR H 1 1 9 1943 1 1 6 TYR HA H -1.909 -3.189 1.697 1.00 . A A . 6 TYR HA 1 1 9 1944 1 1 6 TYR HB2 H -2.578 -5.490 -0.151 1.00 . A A . 6 TYR HB2 1 1 9 1945 1 1 6 TYR HB3 H -1.715 -5.632 1.374 1.00 . A A . 6 TYR HB3 1 1 9 1946 1 1 6 TYR HD1 H -4.085 -3.164 1.949 1.00 . A A . 6 TYR HD1 1 1 9 1947 1 1 6 TYR HD2 H -3.799 -7.370 1.356 1.00 . A A . 6 TYR HD2 1 1 9 1948 1 1 6 TYR HE1 H -6.218 -3.469 3.125 1.00 . A A . 6 TYR HE1 1 1 9 1949 1 1 6 TYR HE2 H -5.933 -7.684 2.536 1.00 . A A . 6 TYR HE2 1 1 9 1950 1 1 6 TYR HH H -7.373 -5.301 4.399 1.00 . A A . 6 TYR HH 1 1 9 1951 1 1 6 TYR N N -2.979 -2.832 -0.034 1.00 . A A . 6 TYR N 1 1 9 1952 1 1 6 TYR O O -0.212 -4.534 -0.610 1.00 . A A . 6 TYR O 1 1 9 1953 1 1 6 TYR OH O -7.400 -5.769 3.561 1.00 . A A . 6 TYR OH 1 1 9 1954 1 1 7 TRP C C 2.460 -2.866 0.434 1.00 . A A . 7 TRP C 1 1 9 1955 1 1 7 TRP CA C 1.369 -2.268 -0.448 1.00 . A A . 7 TRP CA 1 1 9 1956 1 1 7 TRP CB C 1.657 -0.786 -0.696 1.00 . A A . 7 TRP CB 1 1 9 1957 1 1 7 TRP CD1 C 2.465 -0.112 1.640 1.00 . A A . 7 TRP CD1 1 1 9 1958 1 1 7 TRP CD2 C 0.798 1.154 0.844 1.00 . A A . 7 TRP CD2 1 1 9 1959 1 1 7 TRP CE2 C 1.148 1.625 2.124 1.00 . A A . 7 TRP CE2 1 1 9 1960 1 1 7 TRP CE3 C -0.228 1.798 0.147 1.00 . A A . 7 TRP CE3 1 1 9 1961 1 1 7 TRP CG C 1.652 0.041 0.553 1.00 . A A . 7 TRP CG 1 1 9 1962 1 1 7 TRP CH2 C -0.493 3.320 2.013 1.00 . A A . 7 TRP CH2 1 1 9 1963 1 1 7 TRP CZ2 C 0.507 2.709 2.719 1.00 . A A . 7 TRP CZ2 1 1 9 1964 1 1 7 TRP CZ3 C -0.862 2.874 0.739 1.00 . A A . 7 TRP CZ3 1 1 9 1965 1 1 7 TRP H H -0.333 -1.700 0.678 1.00 . A A . 7 TRP H 1 1 9 1966 1 1 7 TRP HA H 1.364 -2.787 -1.395 1.00 . A A . 7 TRP HA 1 1 9 1967 1 1 7 TRP HB2 H 2.628 -0.687 -1.157 1.00 . A A . 7 TRP HB2 1 1 9 1968 1 1 7 TRP HB3 H 0.905 -0.388 -1.362 1.00 . A A . 7 TRP HB3 1 1 9 1969 1 1 7 TRP HD1 H 3.224 -0.874 1.729 1.00 . A A . 7 TRP HD1 1 1 9 1970 1 1 7 TRP HE1 H 2.612 0.932 3.457 1.00 . A A . 7 TRP HE1 1 1 9 1971 1 1 7 TRP HE3 H -0.527 1.467 -0.836 1.00 . A A . 7 TRP HE3 1 1 9 1972 1 1 7 TRP HH2 H -1.017 4.164 2.437 1.00 . A A . 7 TRP HH2 1 1 9 1973 1 1 7 TRP HZ2 H 0.781 3.066 3.701 1.00 . A A . 7 TRP HZ2 1 1 9 1974 1 1 7 TRP HZ3 H -1.658 3.383 0.214 1.00 . A A . 7 TRP HZ3 1 1 9 1975 1 1 7 TRP N N 0.054 -2.437 0.162 1.00 . A A . 7 TRP N 1 1 9 1976 1 1 7 TRP NE1 N 2.167 0.836 2.589 1.00 . A A . 7 TRP NE1 1 1 9 1977 1 1 7 TRP O O 2.293 -2.991 1.647 1.00 . A A . 7 TRP O 1 1 9 1978 1 1 8 TRP C C 5.873 -2.832 0.550 1.00 . A A . 8 TRP C 1 1 9 1979 1 1 8 TRP CA C 4.698 -3.817 0.542 1.00 . A A . 8 TRP CA 1 1 9 1980 1 1 8 TRP CB C 5.100 -5.148 -0.105 1.00 . A A . 8 TRP CB 1 1 9 1981 1 1 8 TRP CD1 C 6.790 -7.049 0.165 1.00 . A A . 8 TRP CD1 1 1 9 1982 1 1 8 TRP CD2 C 6.887 -5.537 1.818 1.00 . A A . 8 TRP CD2 1 1 9 1983 1 1 8 TRP CE2 C 7.863 -6.528 2.051 1.00 . A A . 8 TRP CE2 1 1 9 1984 1 1 8 TRP CE3 C 6.766 -4.492 2.745 1.00 . A A . 8 TRP CE3 1 1 9 1985 1 1 8 TRP CG C 6.231 -5.873 0.578 1.00 . A A . 8 TRP CG 1 1 9 1986 1 1 8 TRP CH2 C 8.557 -5.474 4.046 1.00 . A A . 8 TRP CH2 1 1 9 1987 1 1 8 TRP CZ2 C 8.704 -6.505 3.161 1.00 . A A . 8 TRP CZ2 1 1 9 1988 1 1 8 TRP CZ3 C 7.599 -4.476 3.848 1.00 . A A . 8 TRP CZ3 1 1 9 1989 1 1 8 TRP H H 3.650 -3.107 -1.154 1.00 . A A . 8 TRP H 1 1 9 1990 1 1 8 TRP HA H 4.386 -3.994 1.556 1.00 . A A . 8 TRP HA 1 1 9 1991 1 1 8 TRP HB2 H 4.246 -5.806 -0.099 1.00 . A A . 8 TRP HB2 1 1 9 1992 1 1 8 TRP HB3 H 5.391 -4.966 -1.128 1.00 . A A . 8 TRP HB3 1 1 9 1993 1 1 8 TRP HD1 H 6.503 -7.574 -0.735 1.00 . A A . 8 TRP HD1 1 1 9 1994 1 1 8 TRP HE1 H 8.351 -8.227 0.925 1.00 . A A . 8 TRP HE1 1 1 9 1995 1 1 8 TRP HE3 H 6.031 -3.714 2.620 1.00 . A A . 8 TRP HE3 1 1 9 1996 1 1 8 TRP HH2 H 9.187 -5.421 4.923 1.00 . A A . 8 TRP HH2 1 1 9 1997 1 1 8 TRP HZ2 H 9.449 -7.268 3.328 1.00 . A A . 8 TRP HZ2 1 1 9 1998 1 1 8 TRP HZ3 H 7.516 -3.678 4.572 1.00 . A A . 8 TRP HZ3 1 1 9 1999 1 1 8 TRP N N 3.578 -3.233 -0.185 1.00 . A A . 8 TRP N 1 1 9 2000 1 1 8 TRP NE1 N 7.789 -7.430 1.024 1.00 . A A . 8 TRP NE1 1 1 9 2001 1 1 8 TRP O O 5.918 -1.919 1.374 1.00 . A A . 8 TRP O 1 1 9 2002 1 1 9 ARG C C 7.559 -0.685 -0.689 1.00 . A A . 9 ARG C 1 1 9 2003 1 1 9 ARG CA C 7.978 -2.137 -0.454 1.00 . A A . 9 ARG CA 1 1 9 2004 1 1 9 ARG CB C 8.918 -2.600 -1.571 1.00 . A A . 9 ARG CB 1 1 9 2005 1 1 9 ARG CD C 10.233 -4.136 -0.079 1.00 . A A . 9 ARG CD 1 1 9 2006 1 1 9 ARG CG C 9.448 -4.011 -1.373 1.00 . A A . 9 ARG CG 1 1 9 2007 1 1 9 ARG CZ C 11.468 -5.860 1.177 1.00 . A A . 9 ARG CZ 1 1 9 2008 1 1 9 ARG H H 6.730 -3.753 -0.999 1.00 . A A . 9 ARG H 1 1 9 2009 1 1 9 ARG HA H 8.502 -2.195 0.488 1.00 . A A . 9 ARG HA 1 1 9 2010 1 1 9 ARG HB2 H 8.390 -2.566 -2.510 1.00 . A A . 9 ARG HB2 1 1 9 2011 1 1 9 ARG HB3 H 9.761 -1.927 -1.617 1.00 . A A . 9 ARG HB3 1 1 9 2012 1 1 9 ARG HD2 H 11.064 -3.447 -0.108 1.00 . A A . 9 ARG HD2 1 1 9 2013 1 1 9 ARG HD3 H 9.584 -3.882 0.747 1.00 . A A . 9 ARG HD3 1 1 9 2014 1 1 9 ARG HE H 10.545 -6.156 -0.568 1.00 . A A . 9 ARG HE 1 1 9 2015 1 1 9 ARG HG2 H 8.615 -4.698 -1.345 1.00 . A A . 9 ARG HG2 1 1 9 2016 1 1 9 ARG HG3 H 10.094 -4.261 -2.203 1.00 . A A . 9 ARG HG3 1 1 9 2017 1 1 9 ARG HH11 H 11.445 -4.039 2.055 1.00 . A A . 9 ARG HH11 1 1 9 2018 1 1 9 ARG HH12 H 12.305 -5.269 2.919 1.00 . A A . 9 ARG HH12 1 1 9 2019 1 1 9 ARG HH21 H 11.674 -7.776 0.567 1.00 . A A . 9 ARG HH21 1 1 9 2020 1 1 9 ARG HH22 H 12.436 -7.391 2.074 1.00 . A A . 9 ARG HH22 1 1 9 2021 1 1 9 ARG N N 6.817 -3.015 -0.367 1.00 . A A . 9 ARG N 1 1 9 2022 1 1 9 ARG NE N 10.748 -5.489 0.121 1.00 . A A . 9 ARG NE 1 1 9 2023 1 1 9 ARG NH1 N 11.763 -4.984 2.128 1.00 . A A . 9 ARG NH1 1 1 9 2024 1 1 9 ARG NH2 N 11.894 -7.112 1.282 1.00 . A A . 9 ARG NH2 1 1 9 2025 1 1 9 ARG O O 8.086 0.227 -0.051 1.00 . A A . 9 ARG O 1 1 9 2026 1 1 10 PRO C C 5.591 1.624 -0.668 1.00 . A A . 10 PRO C 1 1 9 2027 1 1 10 PRO CA C 6.129 0.916 -1.907 1.00 . A A . 10 PRO CA 1 1 9 2028 1 1 10 PRO CB C 5.004 0.695 -2.923 1.00 . A A . 10 PRO CB 1 1 9 2029 1 1 10 PRO CD C 5.908 -1.457 -2.422 1.00 . A A . 10 PRO CD 1 1 9 2030 1 1 10 PRO CG C 5.278 -0.643 -3.516 1.00 . A A . 10 PRO CG 1 1 9 2031 1 1 10 PRO HA H 6.908 1.516 -2.352 1.00 . A A . 10 PRO HA 1 1 9 2032 1 1 10 PRO HB2 H 4.049 0.714 -2.418 1.00 . A A . 10 PRO HB2 1 1 9 2033 1 1 10 PRO HB3 H 5.035 1.471 -3.673 1.00 . A A . 10 PRO HB3 1 1 9 2034 1 1 10 PRO HD2 H 5.150 -1.964 -1.844 1.00 . A A . 10 PRO HD2 1 1 9 2035 1 1 10 PRO HD3 H 6.607 -2.166 -2.835 1.00 . A A . 10 PRO HD3 1 1 9 2036 1 1 10 PRO HG2 H 4.353 -1.100 -3.838 1.00 . A A . 10 PRO HG2 1 1 9 2037 1 1 10 PRO HG3 H 5.959 -0.544 -4.348 1.00 . A A . 10 PRO HG3 1 1 9 2038 1 1 10 PRO N N 6.602 -0.441 -1.607 1.00 . A A . 10 PRO N 1 1 9 2039 1 1 10 PRO O O 5.835 1.197 0.460 1.00 . A A . 10 PRO O 1 1 9 2040 1 1 11 SER C C 3.189 4.417 -0.296 1.00 . A A . 11 SER C 1 1 9 2041 1 1 11 SER CA C 4.282 3.480 0.210 1.00 . A A . 11 SER CA 1 1 9 2042 1 1 11 SER CB C 5.372 4.287 0.920 1.00 . A A . 11 SER CB 1 1 9 2043 1 1 11 SER H H 4.698 3.002 -1.810 1.00 . A A . 11 SER H 1 1 9 2044 1 1 11 SER HA H 3.848 2.784 0.911 1.00 . A A . 11 SER HA 1 1 9 2045 1 1 11 SER HB2 H 5.831 4.965 0.217 1.00 . A A . 11 SER HB2 1 1 9 2046 1 1 11 SER HB3 H 4.929 4.850 1.728 1.00 . A A . 11 SER HB3 1 1 9 2047 1 1 11 SER HG H 5.959 2.742 1.972 1.00 . A A . 11 SER HG 1 1 9 2048 1 1 11 SER N N 4.857 2.711 -0.888 1.00 . A A . 11 SER N 1 1 9 2049 1 1 11 SER O O 2.975 5.494 0.260 1.00 . A A . 11 SER O 1 1 9 2050 1 1 11 SER OG O 6.372 3.435 1.452 1.00 . A A . 11 SER OG 1 1 9 2051 1 1 12 ILE C C 0.255 3.916 -2.348 1.00 . A A . 12 ILE C 1 1 9 2052 1 1 12 ILE CA C 1.428 4.798 -1.933 1.00 . A A . 12 ILE CA 1 1 9 2053 1 1 12 ILE CB C 1.925 5.596 -3.158 1.00 . A A . 12 ILE CB 1 1 9 2054 1 1 12 ILE CD1 C 2.664 7.548 -1.701 1.00 . A A . 12 ILE CD1 1 1 9 2055 1 1 12 ILE CG1 C 3.062 6.536 -2.752 1.00 . A A . 12 ILE CG1 1 1 9 2056 1 1 12 ILE CG2 C 0.784 6.384 -3.785 1.00 . A A . 12 ILE CG2 1 1 9 2057 1 1 12 ILE H H 2.717 3.129 -1.751 1.00 . A A . 12 ILE H 1 1 9 2058 1 1 12 ILE HA H 1.092 5.500 -1.183 1.00 . A A . 12 ILE HA 1 1 9 2059 1 1 12 ILE HB H 2.293 4.894 -3.891 1.00 . A A . 12 ILE HB 1 1 9 2060 1 1 12 ILE HD11 H 1.630 7.397 -1.428 1.00 . A A . 12 ILE HD11 1 1 9 2061 1 1 12 ILE HD12 H 2.791 8.546 -2.095 1.00 . A A . 12 ILE HD12 1 1 9 2062 1 1 12 ILE HD13 H 3.289 7.424 -0.828 1.00 . A A . 12 ILE HD13 1 1 9 2063 1 1 12 ILE HG12 H 3.880 5.951 -2.357 1.00 . A A . 12 ILE HG12 1 1 9 2064 1 1 12 ILE HG13 H 3.401 7.077 -3.624 1.00 . A A . 12 ILE HG13 1 1 9 2065 1 1 12 ILE HG21 H 0.248 6.918 -3.015 1.00 . A A . 12 ILE HG21 1 1 9 2066 1 1 12 ILE HG22 H 0.110 5.705 -4.287 1.00 . A A . 12 ILE HG22 1 1 9 2067 1 1 12 ILE HG23 H 1.183 7.088 -4.501 1.00 . A A . 12 ILE HG23 1 1 9 2068 1 1 12 ILE N N 2.500 3.998 -1.352 1.00 . A A . 12 ILE N 1 1 9 2069 1 1 12 ILE O O 0.460 3.017 -3.190 1.00 . A A . 12 ILE O 1 1 9 2070 1 1 12 ILE OXT O -0.859 4.131 -1.827 1.00 . A A . 12 ILE OXT 1 1 10 2071 1 1 1 HIS C C -5.045 5.053 1.612 1.00 . A A . 1 HIS C 1 1 10 2072 1 1 1 HIS CA C -4.755 6.349 2.375 1.00 . A A . 1 HIS CA 1 1 10 2073 1 1 1 HIS CB C -4.872 7.555 1.439 1.00 . A A . 1 HIS CB 1 1 10 2074 1 1 1 HIS CD2 C -3.764 9.848 1.933 1.00 . A A . 1 HIS CD2 1 1 10 2075 1 1 1 HIS CE1 C -5.074 10.490 3.570 1.00 . A A . 1 HIS CE1 1 1 10 2076 1 1 1 HIS CG C -4.679 8.869 2.130 1.00 . A A . 1 HIS CG 1 1 10 2077 1 1 1 HIS H1 H -3.106 5.351 3.104 1.00 . A A . 1 HIS H1 1 1 10 2078 1 1 1 HIS H2 H -3.465 6.822 3.908 1.00 . A A . 1 HIS H2 1 1 10 2079 1 1 1 HIS H3 H -2.754 6.848 2.347 1.00 . A A . 1 HIS H3 1 1 10 2080 1 1 1 HIS HA H -5.481 6.451 3.168 1.00 . A A . 1 HIS HA 1 1 10 2081 1 1 1 HIS HB2 H -4.126 7.477 0.664 1.00 . A A . 1 HIS HB2 1 1 10 2082 1 1 1 HIS HB3 H -5.854 7.557 0.987 1.00 . A A . 1 HIS HB3 1 1 10 2083 1 1 1 HIS HD1 H -6.244 8.811 3.541 1.00 . A A . 1 HIS HD1 1 1 10 2084 1 1 1 HIS HD2 H -2.971 9.847 1.199 1.00 . A A . 1 HIS HD2 1 1 10 2085 1 1 1 HIS HE1 H -5.515 11.072 4.366 1.00 . A A . 1 HIS HE1 1 1 10 2086 1 1 1 HIS HE2 H -3.579 11.711 2.885 1.00 . A A . 1 HIS HE2 1 1 10 2087 1 1 1 HIS N N -3.398 6.342 2.987 1.00 . A A . 1 HIS N 1 1 10 2088 1 1 1 HIS ND1 N -5.483 9.302 3.163 1.00 . A A . 1 HIS ND1 1 1 10 2089 1 1 1 HIS NE2 N -4.031 10.843 2.841 1.00 . A A . 1 HIS NE2 1 1 10 2090 1 1 1 HIS O O -6.109 4.458 1.783 1.00 . A A . 1 HIS O 1 1 10 2091 1 1 2 PRO C C -4.026 2.109 0.814 1.00 . A A . 2 PRO C 1 1 10 2092 1 1 2 PRO CA C -4.297 3.361 -0.012 1.00 . A A . 2 PRO CA 1 1 10 2093 1 1 2 PRO CB C -3.270 3.498 -1.132 1.00 . A A . 2 PRO CB 1 1 10 2094 1 1 2 PRO CD C -2.800 5.218 0.477 1.00 . A A . 2 PRO CD 1 1 10 2095 1 1 2 PRO CG C -2.163 4.291 -0.528 1.00 . A A . 2 PRO CG 1 1 10 2096 1 1 2 PRO HA H -5.290 3.306 -0.435 1.00 . A A . 2 PRO HA 1 1 10 2097 1 1 2 PRO HB2 H -2.933 2.518 -1.439 1.00 . A A . 2 PRO HB2 1 1 10 2098 1 1 2 PRO HB3 H -3.711 4.014 -1.971 1.00 . A A . 2 PRO HB3 1 1 10 2099 1 1 2 PRO HD2 H -2.197 5.270 1.369 1.00 . A A . 2 PRO HD2 1 1 10 2100 1 1 2 PRO HD3 H -2.928 6.201 0.050 1.00 . A A . 2 PRO HD3 1 1 10 2101 1 1 2 PRO HG2 H -1.465 3.631 -0.036 1.00 . A A . 2 PRO HG2 1 1 10 2102 1 1 2 PRO HG3 H -1.661 4.862 -1.296 1.00 . A A . 2 PRO HG3 1 1 10 2103 1 1 2 PRO N N -4.108 4.589 0.760 1.00 . A A . 2 PRO N 1 1 10 2104 1 1 2 PRO O O -2.944 1.527 0.743 1.00 . A A . 2 PRO O 1 1 10 2105 1 1 3 LEU C C -5.803 -0.616 1.970 1.00 . A A . 3 LEU C 1 1 10 2106 1 1 3 LEU CA C -4.888 0.514 2.440 1.00 . A A . 3 LEU CA 1 1 10 2107 1 1 3 LEU CB C -5.173 0.874 3.904 1.00 . A A . 3 LEU CB 1 1 10 2108 1 1 3 LEU CD1 C -7.666 0.487 3.814 1.00 . A A . 3 LEU CD1 1 1 10 2109 1 1 3 LEU CD2 C -6.675 1.862 5.651 1.00 . A A . 3 LEU CD2 1 1 10 2110 1 1 3 LEU CG C -6.560 1.461 4.189 1.00 . A A . 3 LEU CG 1 1 10 2111 1 1 3 LEU H H -5.858 2.203 1.612 1.00 . A A . 3 LEU H 1 1 10 2112 1 1 3 LEU HA H -3.868 0.177 2.366 1.00 . A A . 3 LEU HA 1 1 10 2113 1 1 3 LEU HB2 H -5.058 -0.020 4.498 1.00 . A A . 3 LEU HB2 1 1 10 2114 1 1 3 LEU HB3 H -4.433 1.593 4.222 1.00 . A A . 3 LEU HB3 1 1 10 2115 1 1 3 LEU HD11 H -8.572 0.752 4.340 1.00 . A A . 3 LEU HD11 1 1 10 2116 1 1 3 LEU HD12 H -7.373 -0.515 4.087 1.00 . A A . 3 LEU HD12 1 1 10 2117 1 1 3 LEU HD13 H -7.843 0.534 2.749 1.00 . A A . 3 LEU HD13 1 1 10 2118 1 1 3 LEU HD21 H -5.733 2.267 5.990 1.00 . A A . 3 LEU HD21 1 1 10 2119 1 1 3 LEU HD22 H -6.928 0.994 6.243 1.00 . A A . 3 LEU HD22 1 1 10 2120 1 1 3 LEU HD23 H -7.448 2.609 5.761 1.00 . A A . 3 LEU HD23 1 1 10 2121 1 1 3 LEU HG H -6.687 2.350 3.590 1.00 . A A . 3 LEU HG 1 1 10 2122 1 1 3 LEU N N -5.018 1.697 1.599 1.00 . A A . 3 LEU N 1 1 10 2123 1 1 3 LEU O O -6.040 -1.577 2.701 1.00 . A A . 3 LEU O 1 1 10 2124 1 1 4 LYS C C -6.424 -2.503 -0.682 1.00 . A A . 4 LYS C 1 1 10 2125 1 1 4 LYS CA C -7.198 -1.513 0.186 1.00 . A A . 4 LYS CA 1 1 10 2126 1 1 4 LYS CB C -8.307 -0.853 -0.635 1.00 . A A . 4 LYS CB 1 1 10 2127 1 1 4 LYS CD C -10.357 -1.136 -2.060 1.00 . A A . 4 LYS CD 1 1 10 2128 1 1 4 LYS CE C -11.328 -2.126 -2.681 1.00 . A A . 4 LYS CE 1 1 10 2129 1 1 4 LYS CG C -9.278 -1.844 -1.256 1.00 . A A . 4 LYS CG 1 1 10 2130 1 1 4 LYS H H -6.087 0.288 0.207 1.00 . A A . 4 LYS H 1 1 10 2131 1 1 4 LYS HA H -7.644 -2.049 1.008 1.00 . A A . 4 LYS HA 1 1 10 2132 1 1 4 LYS HB2 H -8.866 -0.187 0.006 1.00 . A A . 4 LYS HB2 1 1 10 2133 1 1 4 LYS HB3 H -7.856 -0.278 -1.430 1.00 . A A . 4 LYS HB3 1 1 10 2134 1 1 4 LYS HD2 H -10.904 -0.473 -1.406 1.00 . A A . 4 LYS HD2 1 1 10 2135 1 1 4 LYS HD3 H -9.888 -0.562 -2.847 1.00 . A A . 4 LYS HD3 1 1 10 2136 1 1 4 LYS HE2 H -10.779 -2.789 -3.332 1.00 . A A . 4 LYS HE2 1 1 10 2137 1 1 4 LYS HE3 H -11.791 -2.700 -1.892 1.00 . A A . 4 LYS HE3 1 1 10 2138 1 1 4 LYS HG2 H -8.732 -2.506 -1.911 1.00 . A A . 4 LYS HG2 1 1 10 2139 1 1 4 LYS HG3 H -9.745 -2.416 -0.469 1.00 . A A . 4 LYS HG3 1 1 10 2140 1 1 4 LYS HZ1 H -13.097 -2.134 -3.793 1.00 . A A . 4 LYS HZ1 1 1 10 2141 1 1 4 LYS HZ2 H -11.973 -0.977 -4.302 1.00 . A A . 4 LYS HZ2 1 1 10 2142 1 1 4 LYS HZ3 H -12.863 -0.723 -2.887 1.00 . A A . 4 LYS HZ3 1 1 10 2143 1 1 4 LYS N N -6.312 -0.497 0.747 1.00 . A A . 4 LYS N 1 1 10 2144 1 1 4 LYS NZ N -12.389 -1.443 -3.470 1.00 . A A . 4 LYS NZ 1 1 10 2145 1 1 4 LYS O O -6.910 -3.595 -0.975 1.00 . A A . 4 LYS O 1 1 10 2146 1 1 5 GLN C C -3.261 -3.611 -1.115 1.00 . A A . 5 GLN C 1 1 10 2147 1 1 5 GLN CA C -4.386 -2.969 -1.928 1.00 . A A . 5 GLN CA 1 1 10 2148 1 1 5 GLN CB C -3.798 -2.163 -3.088 1.00 . A A . 5 GLN CB 1 1 10 2149 1 1 5 GLN CD C -2.342 -2.160 -5.153 1.00 . A A . 5 GLN CD 1 1 10 2150 1 1 5 GLN CG C -2.912 -2.982 -4.013 1.00 . A A . 5 GLN CG 1 1 10 2151 1 1 5 GLN H H -4.887 -1.233 -0.828 1.00 . A A . 5 GLN H 1 1 10 2152 1 1 5 GLN HA H -5.013 -3.752 -2.329 1.00 . A A . 5 GLN HA 1 1 10 2153 1 1 5 GLN HB2 H -4.608 -1.752 -3.672 1.00 . A A . 5 GLN HB2 1 1 10 2154 1 1 5 GLN HB3 H -3.209 -1.353 -2.685 1.00 . A A . 5 GLN HB3 1 1 10 2155 1 1 5 GLN HE21 H -0.490 -2.560 -4.550 1.00 . A A . 5 GLN HE21 1 1 10 2156 1 1 5 GLN HE22 H -0.624 -1.562 -5.954 1.00 . A A . 5 GLN HE22 1 1 10 2157 1 1 5 GLN HG2 H -2.092 -3.388 -3.438 1.00 . A A . 5 GLN HG2 1 1 10 2158 1 1 5 GLN HG3 H -3.496 -3.791 -4.427 1.00 . A A . 5 GLN HG3 1 1 10 2159 1 1 5 GLN N N -5.221 -2.115 -1.092 1.00 . A A . 5 GLN N 1 1 10 2160 1 1 5 GLN NE2 N -1.018 -2.086 -5.226 1.00 . A A . 5 GLN NE2 1 1 10 2161 1 1 5 GLN O O -2.628 -4.566 -1.567 1.00 . A A . 5 GLN O 1 1 10 2162 1 1 5 GLN OE1 O -3.084 -1.599 -5.959 1.00 . A A . 5 GLN OE1 1 1 10 2163 1 1 6 TYR C C -0.595 -3.458 0.287 1.00 . A A . 6 TYR C 1 1 10 2164 1 1 6 TYR CA C -1.963 -3.608 0.945 1.00 . A A . 6 TYR CA 1 1 10 2165 1 1 6 TYR CB C -2.226 -5.082 1.272 1.00 . A A . 6 TYR CB 1 1 10 2166 1 1 6 TYR CD1 C -4.405 -4.307 2.322 1.00 . A A . 6 TYR CD1 1 1 10 2167 1 1 6 TYR CD2 C -3.902 -6.638 2.344 1.00 . A A . 6 TYR CD2 1 1 10 2168 1 1 6 TYR CE1 C -5.596 -4.555 2.979 1.00 . A A . 6 TYR CE1 1 1 10 2169 1 1 6 TYR CE2 C -5.090 -6.892 3.001 1.00 . A A . 6 TYR CE2 1 1 10 2170 1 1 6 TYR CG C -3.537 -5.344 1.992 1.00 . A A . 6 TYR CG 1 1 10 2171 1 1 6 TYR CZ C -5.934 -5.848 3.316 1.00 . A A . 6 TYR CZ 1 1 10 2172 1 1 6 TYR H H -3.547 -2.320 0.388 1.00 . A A . 6 TYR H 1 1 10 2173 1 1 6 TYR HA H -1.973 -3.038 1.862 1.00 . A A . 6 TYR HA 1 1 10 2174 1 1 6 TYR HB2 H -2.239 -5.648 0.353 1.00 . A A . 6 TYR HB2 1 1 10 2175 1 1 6 TYR HB3 H -1.426 -5.449 1.899 1.00 . A A . 6 TYR HB3 1 1 10 2176 1 1 6 TYR HD1 H -4.141 -3.294 2.058 1.00 . A A . 6 TYR HD1 1 1 10 2177 1 1 6 TYR HD2 H -3.240 -7.454 2.097 1.00 . A A . 6 TYR HD2 1 1 10 2178 1 1 6 TYR HE1 H -6.257 -3.738 3.226 1.00 . A A . 6 TYR HE1 1 1 10 2179 1 1 6 TYR HE2 H -5.354 -7.905 3.266 1.00 . A A . 6 TYR HE2 1 1 10 2180 1 1 6 TYR HH H -6.944 -6.608 4.765 1.00 . A A . 6 TYR HH 1 1 10 2181 1 1 6 TYR N N -3.014 -3.082 0.080 1.00 . A A . 6 TYR N 1 1 10 2182 1 1 6 TYR O O -0.072 -4.402 -0.304 1.00 . A A . 6 TYR O 1 1 10 2183 1 1 6 TYR OH O -7.117 -6.098 3.970 1.00 . A A . 6 TYR OH 1 1 10 2184 1 1 7 TRP C C 2.350 -2.916 0.382 1.00 . A A . 7 TRP C 1 1 10 2185 1 1 7 TRP CA C 1.286 -1.989 -0.193 1.00 . A A . 7 TRP CA 1 1 10 2186 1 1 7 TRP CB C 1.681 -0.531 0.049 1.00 . A A . 7 TRP CB 1 1 10 2187 1 1 7 TRP CD1 C 2.589 -0.736 2.436 1.00 . A A . 7 TRP CD1 1 1 10 2188 1 1 7 TRP CD2 C 1.009 0.832 2.184 1.00 . A A . 7 TRP CD2 1 1 10 2189 1 1 7 TRP CE2 C 1.420 0.821 3.531 1.00 . A A . 7 TRP CE2 1 1 10 2190 1 1 7 TRP CE3 C 0.022 1.739 1.788 1.00 . A A . 7 TRP CE3 1 1 10 2191 1 1 7 TRP CG C 1.769 -0.172 1.500 1.00 . A A . 7 TRP CG 1 1 10 2192 1 1 7 TRP CH2 C -0.087 2.559 4.066 1.00 . A A . 7 TRP CH2 1 1 10 2193 1 1 7 TRP CZ2 C 0.877 1.682 4.482 1.00 . A A . 7 TRP CZ2 1 1 10 2194 1 1 7 TRP CZ3 C -0.516 2.592 2.734 1.00 . A A . 7 TRP CZ3 1 1 10 2195 1 1 7 TRP H H -0.489 -1.550 0.875 1.00 . A A . 7 TRP H 1 1 10 2196 1 1 7 TRP HA H 1.213 -2.160 -1.257 1.00 . A A . 7 TRP HA 1 1 10 2197 1 1 7 TRP HB2 H 2.646 -0.348 -0.398 1.00 . A A . 7 TRP HB2 1 1 10 2198 1 1 7 TRP HB3 H 0.947 0.115 -0.411 1.00 . A A . 7 TRP HB3 1 1 10 2199 1 1 7 TRP HD1 H 3.290 -1.530 2.230 1.00 . A A . 7 TRP HD1 1 1 10 2200 1 1 7 TRP HE1 H 2.854 -0.375 4.488 1.00 . A A . 7 TRP HE1 1 1 10 2201 1 1 7 TRP HE3 H -0.321 1.779 0.766 1.00 . A A . 7 TRP HE3 1 1 10 2202 1 1 7 TRP HH2 H -0.535 3.244 4.771 1.00 . A A . 7 TRP HH2 1 1 10 2203 1 1 7 TRP HZ2 H 1.198 1.669 5.513 1.00 . A A . 7 TRP HZ2 1 1 10 2204 1 1 7 TRP HZ3 H -1.280 3.299 2.446 1.00 . A A . 7 TRP HZ3 1 1 10 2205 1 1 7 TRP N N -0.022 -2.264 0.393 1.00 . A A . 7 TRP N 1 1 10 2206 1 1 7 TRP NE1 N 2.384 -0.144 3.659 1.00 . A A . 7 TRP NE1 1 1 10 2207 1 1 7 TRP O O 2.149 -3.535 1.428 1.00 . A A . 7 TRP O 1 1 10 2208 1 1 8 TRP C C 5.858 -3.016 0.261 1.00 . A A . 8 TRP C 1 1 10 2209 1 1 8 TRP CA C 4.582 -3.854 0.135 1.00 . A A . 8 TRP CA 1 1 10 2210 1 1 8 TRP CB C 4.778 -5.008 -0.858 1.00 . A A . 8 TRP CB 1 1 10 2211 1 1 8 TRP CD1 C 6.253 -7.061 -1.243 1.00 . A A . 8 TRP CD1 1 1 10 2212 1 1 8 TRP CD2 C 6.651 -6.039 0.713 1.00 . A A . 8 TRP CD2 1 1 10 2213 1 1 8 TRP CE2 C 7.522 -7.141 0.590 1.00 . A A . 8 TRP CE2 1 1 10 2214 1 1 8 TRP CE3 C 6.722 -5.260 1.877 1.00 . A A . 8 TRP CE3 1 1 10 2215 1 1 8 TRP CG C 5.868 -5.984 -0.497 1.00 . A A . 8 TRP CG 1 1 10 2216 1 1 8 TRP CH2 C 8.485 -6.703 2.701 1.00 . A A . 8 TRP CH2 1 1 10 2217 1 1 8 TRP CZ2 C 8.442 -7.481 1.579 1.00 . A A . 8 TRP CZ2 1 1 10 2218 1 1 8 TRP CZ3 C 7.634 -5.604 2.857 1.00 . A A . 8 TRP CZ3 1 1 10 2219 1 1 8 TRP H H 3.581 -2.487 -1.132 1.00 . A A . 8 TRP H 1 1 10 2220 1 1 8 TRP HA H 4.332 -4.255 1.100 1.00 . A A . 8 TRP HA 1 1 10 2221 1 1 8 TRP HB2 H 3.856 -5.564 -0.926 1.00 . A A . 8 TRP HB2 1 1 10 2222 1 1 8 TRP HB3 H 5.007 -4.598 -1.830 1.00 . A A . 8 TRP HB3 1 1 10 2223 1 1 8 TRP HD1 H 5.841 -7.308 -2.210 1.00 . A A . 8 TRP HD1 1 1 10 2224 1 1 8 TRP HE1 H 7.724 -8.532 -0.964 1.00 . A A . 8 TRP HE1 1 1 10 2225 1 1 8 TRP HE3 H 6.074 -4.413 2.024 1.00 . A A . 8 TRP HE3 1 1 10 2226 1 1 8 TRP HH2 H 9.180 -6.934 3.495 1.00 . A A . 8 TRP HH2 1 1 10 2227 1 1 8 TRP HZ2 H 9.106 -8.327 1.474 1.00 . A A . 8 TRP HZ2 1 1 10 2228 1 1 8 TRP HZ3 H 7.699 -5.016 3.760 1.00 . A A . 8 TRP HZ3 1 1 10 2229 1 1 8 TRP N N 3.482 -3.006 -0.306 1.00 . A A . 8 TRP N 1 1 10 2230 1 1 8 TRP NE1 N 7.266 -7.739 -0.613 1.00 . A A . 8 TRP NE1 1 1 10 2231 1 1 8 TRP O O 6.083 -2.369 1.284 1.00 . A A . 8 TRP O 1 1 10 2232 1 1 9 ARG C C 7.646 -0.753 -0.655 1.00 . A A . 9 ARG C 1 1 10 2233 1 1 9 ARG CA C 7.923 -2.253 -0.774 1.00 . A A . 9 ARG CA 1 1 10 2234 1 1 9 ARG CB C 8.738 -2.541 -2.037 1.00 . A A . 9 ARG CB 1 1 10 2235 1 1 9 ARG CD C 9.973 -4.479 -1.020 1.00 . A A . 9 ARG CD 1 1 10 2236 1 1 9 ARG CG C 9.126 -4.002 -2.190 1.00 . A A . 9 ARG CG 1 1 10 2237 1 1 9 ARG CZ C 11.093 -6.540 -0.266 1.00 . A A . 9 ARG CZ 1 1 10 2238 1 1 9 ARG H H 6.452 -3.544 -1.568 1.00 . A A . 9 ARG H 1 1 10 2239 1 1 9 ARG HA H 8.496 -2.565 0.088 1.00 . A A . 9 ARG HA 1 1 10 2240 1 1 9 ARG HB2 H 8.158 -2.254 -2.900 1.00 . A A . 9 ARG HB2 1 1 10 2241 1 1 9 ARG HB3 H 9.642 -1.952 -2.010 1.00 . A A . 9 ARG HB3 1 1 10 2242 1 1 9 ARG HD2 H 10.867 -3.877 -0.972 1.00 . A A . 9 ARG HD2 1 1 10 2243 1 1 9 ARG HD3 H 9.407 -4.355 -0.109 1.00 . A A . 9 ARG HD3 1 1 10 2244 1 1 9 ARG HE H 10.039 -6.362 -1.952 1.00 . A A . 9 ARG HE 1 1 10 2245 1 1 9 ARG HG2 H 8.228 -4.600 -2.239 1.00 . A A . 9 ARG HG2 1 1 10 2246 1 1 9 ARG HG3 H 9.689 -4.122 -3.103 1.00 . A A . 9 ARG HG3 1 1 10 2247 1 1 9 ARG HH11 H 11.313 -4.962 0.979 1.00 . A A . 9 ARG HH11 1 1 10 2248 1 1 9 ARG HH12 H 12.091 -6.424 1.487 1.00 . A A . 9 ARG HH12 1 1 10 2249 1 1 9 ARG HH21 H 11.062 -8.285 -1.286 1.00 . A A . 9 ARG HH21 1 1 10 2250 1 1 9 ARG HH22 H 11.949 -8.310 0.201 1.00 . A A . 9 ARG HH22 1 1 10 2251 1 1 9 ARG N N 6.683 -3.019 -0.779 1.00 . A A . 9 ARG N 1 1 10 2252 1 1 9 ARG NE N 10.352 -5.883 -1.157 1.00 . A A . 9 ARG NE 1 1 10 2253 1 1 9 ARG NH1 N 11.536 -5.924 0.822 1.00 . A A . 9 ARG NH1 1 1 10 2254 1 1 9 ARG NH2 N 11.392 -7.816 -0.467 1.00 . A A . 9 ARG NH2 1 1 10 2255 1 1 9 ARG O O 8.249 -0.073 0.176 1.00 . A A . 9 ARG O 1 1 10 2256 1 1 10 PRO C C 5.480 1.570 -0.282 1.00 . A A . 10 PRO C 1 1 10 2257 1 1 10 PRO CA C 6.397 1.218 -1.449 1.00 . A A . 10 PRO CA 1 1 10 2258 1 1 10 PRO CB C 5.679 1.435 -2.778 1.00 . A A . 10 PRO CB 1 1 10 2259 1 1 10 PRO CD C 5.957 -0.930 -2.514 1.00 . A A . 10 PRO CD 1 1 10 2260 1 1 10 PRO CG C 5.038 0.124 -3.074 1.00 . A A . 10 PRO CG 1 1 10 2261 1 1 10 PRO HA H 7.284 1.833 -1.409 1.00 . A A . 10 PRO HA 1 1 10 2262 1 1 10 PRO HB2 H 4.946 2.221 -2.671 1.00 . A A . 10 PRO HB2 1 1 10 2263 1 1 10 PRO HB3 H 6.396 1.704 -3.541 1.00 . A A . 10 PRO HB3 1 1 10 2264 1 1 10 PRO HD2 H 5.381 -1.730 -2.074 1.00 . A A . 10 PRO HD2 1 1 10 2265 1 1 10 PRO HD3 H 6.604 -1.312 -3.288 1.00 . A A . 10 PRO HD3 1 1 10 2266 1 1 10 PRO HG2 H 4.071 0.073 -2.594 1.00 . A A . 10 PRO HG2 1 1 10 2267 1 1 10 PRO HG3 H 4.933 0.000 -4.142 1.00 . A A . 10 PRO HG3 1 1 10 2268 1 1 10 PRO N N 6.732 -0.208 -1.484 1.00 . A A . 10 PRO N 1 1 10 2269 1 1 10 PRO O O 4.256 1.553 -0.415 1.00 . A A . 10 PRO O 1 1 10 2270 1 1 11 SER C C 4.769 3.667 1.951 1.00 . A A . 11 SER C 1 1 10 2271 1 1 11 SER CA C 5.317 2.246 2.051 1.00 . A A . 11 SER CA 1 1 10 2272 1 1 11 SER CB C 6.189 2.110 3.300 1.00 . A A . 11 SER CB 1 1 10 2273 1 1 11 SER H H 7.059 1.884 0.902 1.00 . A A . 11 SER H 1 1 10 2274 1 1 11 SER HA H 4.488 1.560 2.127 1.00 . A A . 11 SER HA 1 1 10 2275 1 1 11 SER HB2 H 7.040 2.769 3.215 1.00 . A A . 11 SER HB2 1 1 10 2276 1 1 11 SER HB3 H 5.611 2.379 4.171 1.00 . A A . 11 SER HB3 1 1 10 2277 1 1 11 SER HG H 6.618 0.533 4.381 1.00 . A A . 11 SER HG 1 1 10 2278 1 1 11 SER N N 6.081 1.889 0.859 1.00 . A A . 11 SER N 1 1 10 2279 1 1 11 SER O O 3.835 4.033 2.665 1.00 . A A . 11 SER O 1 1 10 2280 1 1 11 SER OG O 6.657 0.781 3.454 1.00 . A A . 11 SER OG 1 1 10 2281 1 1 12 ILE C C 5.137 6.661 2.146 1.00 . A A . 12 ILE C 1 1 10 2282 1 1 12 ILE CA C 4.921 5.845 0.875 1.00 . A A . 12 ILE CA 1 1 10 2283 1 1 12 ILE CB C 3.433 5.915 0.469 1.00 . A A . 12 ILE CB 1 1 10 2284 1 1 12 ILE CD1 C 4.005 5.700 -2.002 1.00 . A A . 12 ILE CD1 1 1 10 2285 1 1 12 ILE CG1 C 3.204 5.156 -0.839 1.00 . A A . 12 ILE CG1 1 1 10 2286 1 1 12 ILE CG2 C 2.983 7.363 0.328 1.00 . A A . 12 ILE CG2 1 1 10 2287 1 1 12 ILE H H 6.093 4.119 0.523 1.00 . A A . 12 ILE H 1 1 10 2288 1 1 12 ILE HA H 5.512 6.273 0.077 1.00 . A A . 12 ILE HA 1 1 10 2289 1 1 12 ILE HB H 2.847 5.456 1.251 1.00 . A A . 12 ILE HB 1 1 10 2290 1 1 12 ILE HD11 H 3.838 6.763 -2.088 1.00 . A A . 12 ILE HD11 1 1 10 2291 1 1 12 ILE HD12 H 3.694 5.212 -2.913 1.00 . A A . 12 ILE HD12 1 1 10 2292 1 1 12 ILE HD13 H 5.055 5.514 -1.834 1.00 . A A . 12 ILE HD13 1 1 10 2293 1 1 12 ILE HG12 H 3.483 4.122 -0.702 1.00 . A A . 12 ILE HG12 1 1 10 2294 1 1 12 ILE HG13 H 2.158 5.211 -1.101 1.00 . A A . 12 ILE HG13 1 1 10 2295 1 1 12 ILE HG21 H 2.227 7.432 -0.441 1.00 . A A . 12 ILE HG21 1 1 10 2296 1 1 12 ILE HG22 H 3.827 7.979 0.057 1.00 . A A . 12 ILE HG22 1 1 10 2297 1 1 12 ILE HG23 H 2.574 7.706 1.266 1.00 . A A . 12 ILE HG23 1 1 10 2298 1 1 12 ILE N N 5.354 4.465 1.063 1.00 . A A . 12 ILE N 1 1 10 2299 1 1 12 ILE O O 5.061 7.905 2.070 1.00 . A A . 12 ILE O 1 1 10 2300 1 1 12 ILE OXT O 5.379 6.049 3.207 1.00 . A A . 12 ILE OXT 1 1 11 2301 1 1 1 HIS C C -5.594 4.261 3.145 1.00 . A A . 1 HIS C 1 1 11 2302 1 1 1 HIS CA C -4.997 5.455 3.894 1.00 . A A . 1 HIS CA 1 1 11 2303 1 1 1 HIS CB C -5.505 6.769 3.295 1.00 . A A . 1 HIS CB 1 1 11 2304 1 1 1 HIS CD2 C -4.282 9.037 3.602 1.00 . A A . 1 HIS CD2 1 1 11 2305 1 1 1 HIS CE1 C -4.742 9.364 5.721 1.00 . A A . 1 HIS CE1 1 1 11 2306 1 1 1 HIS CG C -5.023 7.985 4.025 1.00 . A A . 1 HIS CG 1 1 11 2307 1 1 1 HIS H1 H -3.206 6.078 3.084 1.00 . A A . 1 HIS H1 1 1 11 2308 1 1 1 HIS H2 H -3.200 4.468 3.678 1.00 . A A . 1 HIS H2 1 1 11 2309 1 1 1 HIS H3 H -3.164 5.788 4.772 1.00 . A A . 1 HIS H3 1 1 11 2310 1 1 1 HIS HA H -5.304 5.400 4.929 1.00 . A A . 1 HIS HA 1 1 11 2311 1 1 1 HIS HB2 H -5.173 6.845 2.273 1.00 . A A . 1 HIS HB2 1 1 11 2312 1 1 1 HIS HB3 H -6.585 6.774 3.319 1.00 . A A . 1 HIS HB3 1 1 11 2313 1 1 1 HIS HD1 H -5.814 7.636 5.947 1.00 . A A . 1 HIS HD1 1 1 11 2314 1 1 1 HIS HD2 H -3.890 9.186 2.606 1.00 . A A . 1 HIS HD2 1 1 11 2315 1 1 1 HIS HE1 H -4.788 9.803 6.707 1.00 . A A . 1 HIS HE1 1 1 11 2316 1 1 1 HIS HE2 H -3.560 10.682 4.689 1.00 . A A . 1 HIS HE2 1 1 11 2317 1 1 1 HIS N N -3.508 5.447 3.853 1.00 . A A . 1 HIS N 1 1 11 2318 1 1 1 HIS ND1 N -5.294 8.220 5.357 1.00 . A A . 1 HIS ND1 1 1 11 2319 1 1 1 HIS NE2 N -4.121 9.878 4.675 1.00 . A A . 1 HIS NE2 1 1 11 2320 1 1 1 HIS O O -6.479 3.581 3.665 1.00 . A A . 1 HIS O 1 1 11 2321 1 1 2 PRO C C -5.036 1.530 1.538 1.00 . A A . 2 PRO C 1 1 11 2322 1 1 2 PRO CA C -5.641 2.865 1.117 1.00 . A A . 2 PRO CA 1 1 11 2323 1 1 2 PRO CB C -5.208 3.226 -0.301 1.00 . A A . 2 PRO CB 1 1 11 2324 1 1 2 PRO CD C -4.075 4.730 1.190 1.00 . A A . 2 PRO CD 1 1 11 2325 1 1 2 PRO CG C -3.946 3.995 -0.122 1.00 . A A . 2 PRO CG 1 1 11 2326 1 1 2 PRO HA H -6.718 2.805 1.165 1.00 . A A . 2 PRO HA 1 1 11 2327 1 1 2 PRO HB2 H -5.046 2.324 -0.872 1.00 . A A . 2 PRO HB2 1 1 11 2328 1 1 2 PRO HB3 H -5.972 3.826 -0.773 1.00 . A A . 2 PRO HB3 1 1 11 2329 1 1 2 PRO HD2 H -3.141 4.695 1.728 1.00 . A A . 2 PRO HD2 1 1 11 2330 1 1 2 PRO HD3 H -4.374 5.751 1.017 1.00 . A A . 2 PRO HD3 1 1 11 2331 1 1 2 PRO HG2 H -3.106 3.317 -0.088 1.00 . A A . 2 PRO HG2 1 1 11 2332 1 1 2 PRO HG3 H -3.827 4.699 -0.933 1.00 . A A . 2 PRO HG3 1 1 11 2333 1 1 2 PRO N N -5.128 3.984 1.910 1.00 . A A . 2 PRO N 1 1 11 2334 1 1 2 PRO O O -4.075 1.054 0.933 1.00 . A A . 2 PRO O 1 1 11 2335 1 1 3 LEU C C -5.631 -1.516 2.232 1.00 . A A . 3 LEU C 1 1 11 2336 1 1 3 LEU CA C -5.122 -0.351 3.080 1.00 . A A . 3 LEU CA 1 1 11 2337 1 1 3 LEU CB C -5.524 -0.529 4.549 1.00 . A A . 3 LEU CB 1 1 11 2338 1 1 3 LEU CD1 C -7.760 -1.604 4.099 1.00 . A A . 3 LEU CD1 1 1 11 2339 1 1 3 LEU CD2 C -7.285 -0.586 6.333 1.00 . A A . 3 LEU CD2 1 1 11 2340 1 1 3 LEU CG C -7.028 -0.493 4.837 1.00 . A A . 3 LEU CG 1 1 11 2341 1 1 3 LEU H H -6.368 1.360 3.019 1.00 . A A . 3 LEU H 1 1 11 2342 1 1 3 LEU HA H -4.047 -0.332 3.021 1.00 . A A . 3 LEU HA 1 1 11 2343 1 1 3 LEU HB2 H -5.139 -1.479 4.889 1.00 . A A . 3 LEU HB2 1 1 11 2344 1 1 3 LEU HB3 H -5.054 0.255 5.124 1.00 . A A . 3 LEU HB3 1 1 11 2345 1 1 3 LEU HD11 H -7.108 -2.459 3.997 1.00 . A A . 3 LEU HD11 1 1 11 2346 1 1 3 LEU HD12 H -8.054 -1.255 3.121 1.00 . A A . 3 LEU HD12 1 1 11 2347 1 1 3 LEU HD13 H -8.640 -1.888 4.658 1.00 . A A . 3 LEU HD13 1 1 11 2348 1 1 3 LEU HD21 H -6.685 -1.381 6.752 1.00 . A A . 3 LEU HD21 1 1 11 2349 1 1 3 LEU HD22 H -8.330 -0.793 6.507 1.00 . A A . 3 LEU HD22 1 1 11 2350 1 1 3 LEU HD23 H -7.020 0.350 6.802 1.00 . A A . 3 LEU HD23 1 1 11 2351 1 1 3 LEU HG H -7.423 0.449 4.489 1.00 . A A . 3 LEU HG 1 1 11 2352 1 1 3 LEU N N -5.606 0.931 2.578 1.00 . A A . 3 LEU N 1 1 11 2353 1 1 3 LEU O O -5.186 -2.652 2.398 1.00 . A A . 3 LEU O 1 1 11 2354 1 1 4 LYS C C -6.175 -2.594 -0.690 1.00 . A A . 4 LYS C 1 1 11 2355 1 1 4 LYS CA C -7.124 -2.264 0.460 1.00 . A A . 4 LYS CA 1 1 11 2356 1 1 4 LYS CB C -8.478 -1.816 -0.092 1.00 . A A . 4 LYS CB 1 1 11 2357 1 1 4 LYS CD C -10.472 -2.345 -1.528 1.00 . A A . 4 LYS CD 1 1 11 2358 1 1 4 LYS CE C -11.125 -3.369 -2.443 1.00 . A A . 4 LYS CE 1 1 11 2359 1 1 4 LYS CG C -9.132 -2.838 -1.008 1.00 . A A . 4 LYS CG 1 1 11 2360 1 1 4 LYS H H -6.882 -0.311 1.237 1.00 . A A . 4 LYS H 1 1 11 2361 1 1 4 LYS HA H -7.265 -3.151 1.055 1.00 . A A . 4 LYS HA 1 1 11 2362 1 1 4 LYS HB2 H -9.146 -1.625 0.735 1.00 . A A . 4 LYS HB2 1 1 11 2363 1 1 4 LYS HB3 H -8.341 -0.900 -0.650 1.00 . A A . 4 LYS HB3 1 1 11 2364 1 1 4 LYS HD2 H -11.126 -2.158 -0.690 1.00 . A A . 4 LYS HD2 1 1 11 2365 1 1 4 LYS HD3 H -10.318 -1.429 -2.079 1.00 . A A . 4 LYS HD3 1 1 11 2366 1 1 4 LYS HE2 H -10.468 -3.557 -3.278 1.00 . A A . 4 LYS HE2 1 1 11 2367 1 1 4 LYS HE3 H -11.274 -4.284 -1.889 1.00 . A A . 4 LYS HE3 1 1 11 2368 1 1 4 LYS HG2 H -8.478 -3.026 -1.846 1.00 . A A . 4 LYS HG2 1 1 11 2369 1 1 4 LYS HG3 H -9.285 -3.755 -0.456 1.00 . A A . 4 LYS HG3 1 1 11 2370 1 1 4 LYS HZ1 H -12.463 -1.855 -2.973 1.00 . A A . 4 LYS HZ1 1 1 11 2371 1 1 4 LYS HZ2 H -13.208 -3.241 -2.350 1.00 . A A . 4 LYS HZ2 1 1 11 2372 1 1 4 LYS HZ3 H -12.592 -3.248 -3.925 1.00 . A A . 4 LYS HZ3 1 1 11 2373 1 1 4 LYS N N -6.564 -1.232 1.326 1.00 . A A . 4 LYS N 1 1 11 2374 1 1 4 LYS NZ N -12.439 -2.895 -2.960 1.00 . A A . 4 LYS NZ 1 1 11 2375 1 1 4 LYS O O -6.291 -3.645 -1.320 1.00 . A A . 4 LYS O 1 1 11 2376 1 1 5 GLN C C -3.188 -2.883 -1.624 1.00 . A A . 5 GLN C 1 1 11 2377 1 1 5 GLN CA C -4.272 -1.890 -2.035 1.00 . A A . 5 GLN CA 1 1 11 2378 1 1 5 GLN CB C -3.636 -0.556 -2.431 1.00 . A A . 5 GLN CB 1 1 11 2379 1 1 5 GLN CD C -1.999 0.658 -3.924 1.00 . A A . 5 GLN CD 1 1 11 2380 1 1 5 GLN CG C -2.615 -0.677 -3.551 1.00 . A A . 5 GLN CG 1 1 11 2381 1 1 5 GLN H H -5.195 -0.873 -0.424 1.00 . A A . 5 GLN H 1 1 11 2382 1 1 5 GLN HA H -4.803 -2.290 -2.884 1.00 . A A . 5 GLN HA 1 1 11 2383 1 1 5 GLN HB2 H -4.415 0.119 -2.754 1.00 . A A . 5 GLN HB2 1 1 11 2384 1 1 5 GLN HB3 H -3.143 -0.136 -1.567 1.00 . A A . 5 GLN HB3 1 1 11 2385 1 1 5 GLN HE21 H -0.188 -0.020 -3.461 1.00 . A A . 5 GLN HE21 1 1 11 2386 1 1 5 GLN HE22 H -0.257 1.611 -4.024 1.00 . A A . 5 GLN HE22 1 1 11 2387 1 1 5 GLN HG2 H -1.827 -1.342 -3.232 1.00 . A A . 5 GLN HG2 1 1 11 2388 1 1 5 GLN HG3 H -3.102 -1.088 -4.422 1.00 . A A . 5 GLN HG3 1 1 11 2389 1 1 5 GLN N N -5.239 -1.691 -0.960 1.00 . A A . 5 GLN N 1 1 11 2390 1 1 5 GLN NE2 N -0.682 0.760 -3.789 1.00 . A A . 5 GLN NE2 1 1 11 2391 1 1 5 GLN O O -2.505 -3.457 -2.474 1.00 . A A . 5 GLN O 1 1 11 2392 1 1 5 GLN OE1 O -2.699 1.586 -4.330 1.00 . A A . 5 GLN OE1 1 1 11 2393 1 1 6 TYR C C -0.627 -3.557 -0.182 1.00 . A A . 6 TYR C 1 1 11 2394 1 1 6 TYR CA C -2.033 -4.008 0.201 1.00 . A A . 6 TYR CA 1 1 11 2395 1 1 6 TYR CB C -2.290 -5.423 -0.327 1.00 . A A . 6 TYR CB 1 1 11 2396 1 1 6 TYR CD1 C -4.547 -5.282 0.831 1.00 . A A . 6 TYR CD1 1 1 11 2397 1 1 6 TYR CD2 C -4.006 -7.276 -0.359 1.00 . A A . 6 TYR CD2 1 1 11 2398 1 1 6 TYR CE1 C -5.774 -5.817 1.175 1.00 . A A . 6 TYR CE1 1 1 11 2399 1 1 6 TYR CE2 C -5.230 -7.817 -0.018 1.00 . A A . 6 TYR CE2 1 1 11 2400 1 1 6 TYR CG C -3.641 -6.002 0.056 1.00 . A A . 6 TYR CG 1 1 11 2401 1 1 6 TYR CZ C -6.110 -7.085 0.749 1.00 . A A . 6 TYR CZ 1 1 11 2402 1 1 6 TYR H H -3.608 -2.597 0.309 1.00 . A A . 6 TYR H 1 1 11 2403 1 1 6 TYR HA H -2.116 -4.013 1.277 1.00 . A A . 6 TYR HA 1 1 11 2404 1 1 6 TYR HB2 H -2.232 -5.411 -1.404 1.00 . A A . 6 TYR HB2 1 1 11 2405 1 1 6 TYR HB3 H -1.527 -6.084 0.059 1.00 . A A . 6 TYR HB3 1 1 11 2406 1 1 6 TYR HD1 H -4.283 -4.291 1.164 1.00 . A A . 6 TYR HD1 1 1 11 2407 1 1 6 TYR HD2 H -3.315 -7.850 -0.961 1.00 . A A . 6 TYR HD2 1 1 11 2408 1 1 6 TYR HE1 H -6.463 -5.244 1.777 1.00 . A A . 6 TYR HE1 1 1 11 2409 1 1 6 TYR HE2 H -5.494 -8.810 -0.351 1.00 . A A . 6 TYR HE2 1 1 11 2410 1 1 6 TYR HH H -7.443 -7.580 2.043 1.00 . A A . 6 TYR HH 1 1 11 2411 1 1 6 TYR N N -3.035 -3.083 -0.319 1.00 . A A . 6 TYR N 1 1 11 2412 1 1 6 TYR O O 0.013 -4.151 -1.050 1.00 . A A . 6 TYR O 1 1 11 2413 1 1 6 TYR OH O -7.331 -7.620 1.091 1.00 . A A . 6 TYR OH 1 1 11 2414 1 1 7 TRP C C 2.258 -2.882 0.792 1.00 . A A . 7 TRP C 1 1 11 2415 1 1 7 TRP CA C 1.182 -1.975 0.203 1.00 . A A . 7 TRP CA 1 1 11 2416 1 1 7 TRP CB C 1.321 -0.563 0.775 1.00 . A A . 7 TRP CB 1 1 11 2417 1 1 7 TRP CD1 C 1.842 -1.147 3.215 1.00 . A A . 7 TRP CD1 1 1 11 2418 1 1 7 TRP CD2 C 0.118 0.257 2.953 1.00 . A A . 7 TRP CD2 1 1 11 2419 1 1 7 TRP CE2 C 0.298 0.019 4.329 1.00 . A A . 7 TRP CE2 1 1 11 2420 1 1 7 TRP CE3 C -0.909 1.114 2.547 1.00 . A A . 7 TRP CE3 1 1 11 2421 1 1 7 TRP CG C 1.116 -0.498 2.258 1.00 . A A . 7 TRP CG 1 1 11 2422 1 1 7 TRP CH2 C -1.509 1.439 4.872 1.00 . A A . 7 TRP CH2 1 1 11 2423 1 1 7 TRP CZ2 C -0.511 0.606 5.299 1.00 . A A . 7 TRP CZ2 1 1 11 2424 1 1 7 TRP CZ3 C -1.712 1.695 3.510 1.00 . A A . 7 TRP CZ3 1 1 11 2425 1 1 7 TRP H H -0.705 -2.073 1.156 1.00 . A A . 7 TRP H 1 1 11 2426 1 1 7 TRP HA H 1.311 -1.934 -0.867 1.00 . A A . 7 TRP HA 1 1 11 2427 1 1 7 TRP HB2 H 2.311 -0.190 0.559 1.00 . A A . 7 TRP HB2 1 1 11 2428 1 1 7 TRP HB3 H 0.589 0.080 0.308 1.00 . A A . 7 TRP HB3 1 1 11 2429 1 1 7 TRP HD1 H 2.674 -1.803 3.006 1.00 . A A . 7 TRP HD1 1 1 11 2430 1 1 7 TRP HE1 H 1.710 -1.183 5.311 1.00 . A A . 7 TRP HE1 1 1 11 2431 1 1 7 TRP HE3 H -1.081 1.322 1.501 1.00 . A A . 7 TRP HE3 1 1 11 2432 1 1 7 TRP HH2 H -2.161 1.915 5.589 1.00 . A A . 7 TRP HH2 1 1 11 2433 1 1 7 TRP HZ2 H -0.368 0.419 6.352 1.00 . A A . 7 TRP HZ2 1 1 11 2434 1 1 7 TRP HZ3 H -2.512 2.358 3.214 1.00 . A A . 7 TRP HZ3 1 1 11 2435 1 1 7 TRP N N -0.150 -2.504 0.475 1.00 . A A . 7 TRP N 1 1 11 2436 1 1 7 TRP NE1 N 1.357 -0.841 4.463 1.00 . A A . 7 TRP NE1 1 1 11 2437 1 1 7 TRP O O 1.969 -3.747 1.619 1.00 . A A . 7 TRP O 1 1 11 2438 1 1 8 TRP C C 5.931 -2.731 0.597 1.00 . A A . 8 TRP C 1 1 11 2439 1 1 8 TRP CA C 4.616 -3.479 0.844 1.00 . A A . 8 TRP CA 1 1 11 2440 1 1 8 TRP CB C 4.619 -4.844 0.145 1.00 . A A . 8 TRP CB 1 1 11 2441 1 1 8 TRP CD1 C 5.939 -7.034 0.077 1.00 . A A . 8 TRP CD1 1 1 11 2442 1 1 8 TRP CD2 C 6.661 -5.610 1.654 1.00 . A A . 8 TRP CD2 1 1 11 2443 1 1 8 TRP CE2 C 7.459 -6.772 1.689 1.00 . A A . 8 TRP CE2 1 1 11 2444 1 1 8 TRP CE3 C 6.934 -4.588 2.572 1.00 . A A . 8 TRP CE3 1 1 11 2445 1 1 8 TRP CG C 5.710 -5.785 0.583 1.00 . A A . 8 TRP CG 1 1 11 2446 1 1 8 TRP CH2 C 8.741 -5.923 3.481 1.00 . A A . 8 TRP CH2 1 1 11 2447 1 1 8 TRP CZ2 C 8.502 -6.937 2.598 1.00 . A A . 8 TRP CZ2 1 1 11 2448 1 1 8 TRP CZ3 C 7.967 -4.758 3.475 1.00 . A A . 8 TRP CZ3 1 1 11 2449 1 1 8 TRP H H 3.665 -1.974 -0.300 1.00 . A A . 8 TRP H 1 1 11 2450 1 1 8 TRP HA H 4.492 -3.623 1.903 1.00 . A A . 8 TRP HA 1 1 11 2451 1 1 8 TRP HB2 H 3.674 -5.330 0.337 1.00 . A A . 8 TRP HB2 1 1 11 2452 1 1 8 TRP HB3 H 4.719 -4.690 -0.920 1.00 . A A . 8 TRP HB3 1 1 11 2453 1 1 8 TRP HD1 H 5.378 -7.470 -0.735 1.00 . A A . 8 TRP HD1 1 1 11 2454 1 1 8 TRP HE1 H 7.374 -8.501 0.508 1.00 . A A . 8 TRP HE1 1 1 11 2455 1 1 8 TRP HE3 H 6.350 -3.684 2.595 1.00 . A A . 8 TRP HE3 1 1 11 2456 1 1 8 TRP HH2 H 9.537 -6.011 4.205 1.00 . A A . 8 TRP HH2 1 1 11 2457 1 1 8 TRP HZ2 H 9.109 -7.831 2.615 1.00 . A A . 8 TRP HZ2 1 1 11 2458 1 1 8 TRP HZ3 H 8.188 -3.978 4.190 1.00 . A A . 8 TRP HZ3 1 1 11 2459 1 1 8 TRP N N 3.498 -2.679 0.360 1.00 . A A . 8 TRP N 1 1 11 2460 1 1 8 TRP NE1 N 7.005 -7.617 0.713 1.00 . A A . 8 TRP NE1 1 1 11 2461 1 1 8 TRP O O 6.307 -1.855 1.377 1.00 . A A . 8 TRP O 1 1 11 2462 1 1 9 ARG C C 7.716 -0.917 -0.980 1.00 . A A . 9 ARG C 1 1 11 2463 1 1 9 ARG CA C 7.891 -2.428 -0.813 1.00 . A A . 9 ARG CA 1 1 11 2464 1 1 9 ARG CB C 8.485 -3.033 -2.088 1.00 . A A . 9 ARG CB 1 1 11 2465 1 1 9 ARG CD C 9.758 -4.821 -0.865 1.00 . A A . 9 ARG CD 1 1 11 2466 1 1 9 ARG CG C 8.768 -4.522 -1.979 1.00 . A A . 9 ARG CG 1 1 11 2467 1 1 9 ARG CZ C 10.870 -6.774 0.147 1.00 . A A . 9 ARG CZ 1 1 11 2468 1 1 9 ARG H H 6.283 -3.774 -1.067 1.00 . A A . 9 ARG H 1 1 11 2469 1 1 9 ARG HA H 8.572 -2.606 0.005 1.00 . A A . 9 ARG HA 1 1 11 2470 1 1 9 ARG HB2 H 7.796 -2.879 -2.903 1.00 . A A . 9 ARG HB2 1 1 11 2471 1 1 9 ARG HB3 H 9.414 -2.529 -2.312 1.00 . A A . 9 ARG HB3 1 1 11 2472 1 1 9 ARG HD2 H 10.681 -4.300 -1.071 1.00 . A A . 9 ARG HD2 1 1 11 2473 1 1 9 ARG HD3 H 9.346 -4.469 0.070 1.00 . A A . 9 ARG HD3 1 1 11 2474 1 1 9 ARG HE H 9.580 -6.853 -1.375 1.00 . A A . 9 ARG HE 1 1 11 2475 1 1 9 ARG HG2 H 7.844 -5.040 -1.773 1.00 . A A . 9 ARG HG2 1 1 11 2476 1 1 9 ARG HG3 H 9.178 -4.871 -2.916 1.00 . A A . 9 ARG HG3 1 1 11 2477 1 1 9 ARG HH11 H 11.364 -5.001 0.985 1.00 . A A . 9 ARG HH11 1 1 11 2478 1 1 9 ARG HH12 H 12.131 -6.390 1.679 1.00 . A A . 9 ARG HH12 1 1 11 2479 1 1 9 ARG HH21 H 10.589 -8.680 -0.463 1.00 . A A . 9 ARG HH21 1 1 11 2480 1 1 9 ARG HH22 H 11.692 -8.478 0.856 1.00 . A A . 9 ARG HH22 1 1 11 2481 1 1 9 ARG N N 6.626 -3.074 -0.482 1.00 . A A . 9 ARG N 1 1 11 2482 1 1 9 ARG NE N 10.037 -6.251 -0.751 1.00 . A A . 9 ARG NE 1 1 11 2483 1 1 9 ARG NH1 N 11.507 -5.990 1.007 1.00 . A A . 9 ARG NH1 1 1 11 2484 1 1 9 ARG NH2 N 11.066 -8.085 0.183 1.00 . A A . 9 ARG NH2 1 1 11 2485 1 1 9 ARG O O 8.501 -0.136 -0.443 1.00 . A A . 9 ARG O 1 1 11 2486 1 1 10 PRO C C 5.602 1.562 -0.823 1.00 . A A . 10 PRO C 1 1 11 2487 1 1 10 PRO CA C 6.425 0.941 -1.947 1.00 . A A . 10 PRO CA 1 1 11 2488 1 1 10 PRO CB C 5.634 0.935 -3.251 1.00 . A A . 10 PRO CB 1 1 11 2489 1 1 10 PRO CD C 5.684 -1.322 -2.411 1.00 . A A . 10 PRO CD 1 1 11 2490 1 1 10 PRO CG C 4.863 -0.341 -3.213 1.00 . A A . 10 PRO CG 1 1 11 2491 1 1 10 PRO HA H 7.341 1.499 -2.077 1.00 . A A . 10 PRO HA 1 1 11 2492 1 1 10 PRO HB2 H 4.980 1.793 -3.285 1.00 . A A . 10 PRO HB2 1 1 11 2493 1 1 10 PRO HB3 H 6.314 0.958 -4.089 1.00 . A A . 10 PRO HB3 1 1 11 2494 1 1 10 PRO HD2 H 5.061 -1.832 -1.693 1.00 . A A . 10 PRO HD2 1 1 11 2495 1 1 10 PRO HD3 H 6.164 -2.032 -3.065 1.00 . A A . 10 PRO HD3 1 1 11 2496 1 1 10 PRO HG2 H 3.909 -0.175 -2.734 1.00 . A A . 10 PRO HG2 1 1 11 2497 1 1 10 PRO HG3 H 4.717 -0.710 -4.217 1.00 . A A . 10 PRO HG3 1 1 11 2498 1 1 10 PRO N N 6.684 -0.478 -1.725 1.00 . A A . 10 PRO N 1 1 11 2499 1 1 10 PRO O O 5.437 0.965 0.241 1.00 . A A . 10 PRO O 1 1 11 2500 1 1 11 SER C C 3.532 4.632 -0.716 1.00 . A A . 11 SER C 1 1 11 2501 1 1 11 SER CA C 4.280 3.466 -0.077 1.00 . A A . 11 SER CA 1 1 11 2502 1 1 11 SER CB C 5.163 3.978 1.063 1.00 . A A . 11 SER CB 1 1 11 2503 1 1 11 SER H H 5.256 3.183 -1.934 1.00 . A A . 11 SER H 1 1 11 2504 1 1 11 SER HA H 3.561 2.767 0.322 1.00 . A A . 11 SER HA 1 1 11 2505 1 1 11 SER HB2 H 5.904 4.655 0.666 1.00 . A A . 11 SER HB2 1 1 11 2506 1 1 11 SER HB3 H 4.550 4.498 1.784 1.00 . A A . 11 SER HB3 1 1 11 2507 1 1 11 SER HG H 5.209 2.189 1.861 1.00 . A A . 11 SER HG 1 1 11 2508 1 1 11 SER N N 5.088 2.762 -1.067 1.00 . A A . 11 SER N 1 1 11 2509 1 1 11 SER O O 3.292 5.654 -0.074 1.00 . A A . 11 SER O 1 1 11 2510 1 1 11 SER OG O 5.827 2.910 1.715 1.00 . A A . 11 SER OG 1 1 11 2511 1 1 12 ILE C C 3.279 6.786 -2.802 1.00 . A A . 12 ILE C 1 1 11 2512 1 1 12 ILE CA C 2.446 5.510 -2.709 1.00 . A A . 12 ILE CA 1 1 11 2513 1 1 12 ILE CB C 1.095 5.831 -2.033 1.00 . A A . 12 ILE CB 1 1 11 2514 1 1 12 ILE CD1 C -0.098 4.012 -3.353 1.00 . A A . 12 ILE CD1 1 1 11 2515 1 1 12 ILE CG1 C 0.216 4.581 -1.987 1.00 . A A . 12 ILE CG1 1 1 11 2516 1 1 12 ILE CG2 C 0.380 6.956 -2.770 1.00 . A A . 12 ILE CG2 1 1 11 2517 1 1 12 ILE H H 3.386 3.633 -2.443 1.00 . A A . 12 ILE H 1 1 11 2518 1 1 12 ILE HA H 2.249 5.146 -3.707 1.00 . A A . 12 ILE HA 1 1 11 2519 1 1 12 ILE HB H 1.292 6.162 -1.025 1.00 . A A . 12 ILE HB 1 1 11 2520 1 1 12 ILE HD11 H -1.034 3.473 -3.312 1.00 . A A . 12 ILE HD11 1 1 11 2521 1 1 12 ILE HD12 H 0.692 3.339 -3.653 1.00 . A A . 12 ILE HD12 1 1 11 2522 1 1 12 ILE HD13 H -0.177 4.816 -4.069 1.00 . A A . 12 ILE HD13 1 1 11 2523 1 1 12 ILE HG12 H 0.721 3.815 -1.417 1.00 . A A . 12 ILE HG12 1 1 11 2524 1 1 12 ILE HG13 H -0.720 4.824 -1.504 1.00 . A A . 12 ILE HG13 1 1 11 2525 1 1 12 ILE HG21 H 0.672 7.906 -2.348 1.00 . A A . 12 ILE HG21 1 1 11 2526 1 1 12 ILE HG22 H -0.688 6.830 -2.669 1.00 . A A . 12 ILE HG22 1 1 11 2527 1 1 12 ILE HG23 H 0.647 6.928 -3.816 1.00 . A A . 12 ILE HG23 1 1 11 2528 1 1 12 ILE N N 3.166 4.471 -1.984 1.00 . A A . 12 ILE N 1 1 11 2529 1 1 12 ILE O O 2.899 7.684 -3.583 1.00 . A A . 12 ILE O 1 1 11 2530 1 1 12 ILE OXT O 4.304 6.875 -2.093 1.00 . A A . 12 ILE OXT 1 1 12 2531 1 1 1 HIS C C -4.127 4.902 1.168 1.00 . A A . 1 HIS C 1 1 12 2532 1 1 1 HIS CA C -3.452 6.218 1.542 1.00 . A A . 1 HIS CA 1 1 12 2533 1 1 1 HIS CB C -3.854 6.635 2.959 1.00 . A A . 1 HIS CB 1 1 12 2534 1 1 1 HIS CD2 C -3.722 9.080 3.815 1.00 . A A . 1 HIS CD2 1 1 12 2535 1 1 1 HIS CE1 C -1.542 9.252 3.956 1.00 . A A . 1 HIS CE1 1 1 12 2536 1 1 1 HIS CG C -3.194 7.896 3.422 1.00 . A A . 1 HIS CG 1 1 12 2537 1 1 1 HIS H1 H -4.805 7.597 0.836 1.00 . A A . 1 HIS H1 1 1 12 2538 1 1 1 HIS H2 H -3.777 6.924 -0.362 1.00 . A A . 1 HIS H2 1 1 12 2539 1 1 1 HIS H3 H -3.166 8.091 0.738 1.00 . A A . 1 HIS H3 1 1 12 2540 1 1 1 HIS HA H -2.380 6.090 1.500 1.00 . A A . 1 HIS HA 1 1 12 2541 1 1 1 HIS HB2 H -4.922 6.787 2.992 1.00 . A A . 1 HIS HB2 1 1 12 2542 1 1 1 HIS HB3 H -3.586 5.846 3.647 1.00 . A A . 1 HIS HB3 1 1 12 2543 1 1 1 HIS HD1 H -1.162 7.349 3.308 1.00 . A A . 1 HIS HD1 1 1 12 2544 1 1 1 HIS HD2 H -4.773 9.329 3.861 1.00 . A A . 1 HIS HD2 1 1 12 2545 1 1 1 HIS HE1 H -0.551 9.647 4.130 1.00 . A A . 1 HIS HE1 1 1 12 2546 1 1 1 HIS HE2 H -2.754 10.796 4.541 1.00 . A A . 1 HIS HE2 1 1 12 2547 1 1 1 HIS N N -3.835 7.306 0.603 1.00 . A A . 1 HIS N 1 1 12 2548 1 1 1 HIS ND1 N -1.825 8.037 3.522 1.00 . A A . 1 HIS ND1 1 1 12 2549 1 1 1 HIS NE2 N -2.674 9.905 4.140 1.00 . A A . 1 HIS NE2 1 1 12 2550 1 1 1 HIS O O -5.219 4.597 1.649 1.00 . A A . 1 HIS O 1 1 12 2551 1 1 2 PRO C C -4.428 1.925 1.040 1.00 . A A . 2 PRO C 1 1 12 2552 1 1 2 PRO CA C -4.028 2.811 -0.135 1.00 . A A . 2 PRO CA 1 1 12 2553 1 1 2 PRO CB C -2.870 2.180 -0.913 1.00 . A A . 2 PRO CB 1 1 12 2554 1 1 2 PRO CD C -2.177 4.388 -0.318 1.00 . A A . 2 PRO CD 1 1 12 2555 1 1 2 PRO CG C -2.057 3.334 -1.385 1.00 . A A . 2 PRO CG 1 1 12 2556 1 1 2 PRO HA H -4.877 2.942 -0.791 1.00 . A A . 2 PRO HA 1 1 12 2557 1 1 2 PRO HB2 H -2.303 1.536 -0.257 1.00 . A A . 2 PRO HB2 1 1 12 2558 1 1 2 PRO HB3 H -3.259 1.607 -1.741 1.00 . A A . 2 PRO HB3 1 1 12 2559 1 1 2 PRO HD2 H -1.378 4.288 0.402 1.00 . A A . 2 PRO HD2 1 1 12 2560 1 1 2 PRO HD3 H -2.168 5.374 -0.759 1.00 . A A . 2 PRO HD3 1 1 12 2561 1 1 2 PRO HG2 H -1.026 3.034 -1.501 1.00 . A A . 2 PRO HG2 1 1 12 2562 1 1 2 PRO HG3 H -2.451 3.702 -2.320 1.00 . A A . 2 PRO HG3 1 1 12 2563 1 1 2 PRO N N -3.483 4.100 0.302 1.00 . A A . 2 PRO N 1 1 12 2564 1 1 2 PRO O O -3.622 1.659 1.932 1.00 . A A . 2 PRO O 1 1 12 2565 1 1 3 LEU C C -6.759 -0.694 1.553 1.00 . A A . 3 LEU C 1 1 12 2566 1 1 3 LEU CA C -6.184 0.613 2.101 1.00 . A A . 3 LEU CA 1 1 12 2567 1 1 3 LEU CB C -7.235 1.364 2.924 1.00 . A A . 3 LEU CB 1 1 12 2568 1 1 3 LEU CD1 C -9.216 0.698 1.514 1.00 . A A . 3 LEU CD1 1 1 12 2569 1 1 3 LEU CD2 C -9.376 2.663 3.054 1.00 . A A . 3 LEU CD2 1 1 12 2570 1 1 3 LEU CG C -8.459 1.857 2.146 1.00 . A A . 3 LEU CG 1 1 12 2571 1 1 3 LEU H H -6.272 1.716 0.295 1.00 . A A . 3 LEU H 1 1 12 2572 1 1 3 LEU HA H -5.354 0.374 2.744 1.00 . A A . 3 LEU HA 1 1 12 2573 1 1 3 LEU HB2 H -7.579 0.708 3.711 1.00 . A A . 3 LEU HB2 1 1 12 2574 1 1 3 LEU HB3 H -6.760 2.220 3.378 1.00 . A A . 3 LEU HB3 1 1 12 2575 1 1 3 LEU HD11 H -8.765 0.449 0.566 1.00 . A A . 3 LEU HD11 1 1 12 2576 1 1 3 LEU HD12 H -10.246 0.983 1.359 1.00 . A A . 3 LEU HD12 1 1 12 2577 1 1 3 LEU HD13 H -9.174 -0.159 2.170 1.00 . A A . 3 LEU HD13 1 1 12 2578 1 1 3 LEU HD21 H -9.117 3.709 2.990 1.00 . A A . 3 LEU HD21 1 1 12 2579 1 1 3 LEU HD22 H -9.262 2.325 4.073 1.00 . A A . 3 LEU HD22 1 1 12 2580 1 1 3 LEU HD23 H -10.402 2.526 2.743 1.00 . A A . 3 LEU HD23 1 1 12 2581 1 1 3 LEU HG H -8.124 2.505 1.351 1.00 . A A . 3 LEU HG 1 1 12 2582 1 1 3 LEU N N -5.677 1.469 1.034 1.00 . A A . 3 LEU N 1 1 12 2583 1 1 3 LEU O O -7.260 -1.524 2.312 1.00 . A A . 3 LEU O 1 1 12 2584 1 1 4 LYS C C -6.077 -2.927 -0.985 1.00 . A A . 4 LYS C 1 1 12 2585 1 1 4 LYS CA C -7.206 -2.081 -0.399 1.00 . A A . 4 LYS CA 1 1 12 2586 1 1 4 LYS CB C -8.209 -1.715 -1.494 1.00 . A A . 4 LYS CB 1 1 12 2587 1 1 4 LYS CD C -9.789 -2.500 -3.284 1.00 . A A . 4 LYS CD 1 1 12 2588 1 1 4 LYS CE C -10.381 -3.704 -3.998 1.00 . A A . 4 LYS CE 1 1 12 2589 1 1 4 LYS CG C -8.801 -2.920 -2.208 1.00 . A A . 4 LYS CG 1 1 12 2590 1 1 4 LYS H H -6.280 -0.180 -0.323 1.00 . A A . 4 LYS H 1 1 12 2591 1 1 4 LYS HA H -7.711 -2.659 0.359 1.00 . A A . 4 LYS HA 1 1 12 2592 1 1 4 LYS HB2 H -9.019 -1.153 -1.052 1.00 . A A . 4 LYS HB2 1 1 12 2593 1 1 4 LYS HB3 H -7.714 -1.097 -2.228 1.00 . A A . 4 LYS HB3 1 1 12 2594 1 1 4 LYS HD2 H -10.588 -1.938 -2.825 1.00 . A A . 4 LYS HD2 1 1 12 2595 1 1 4 LYS HD3 H -9.277 -1.879 -4.005 1.00 . A A . 4 LYS HD3 1 1 12 2596 1 1 4 LYS HE2 H -9.579 -4.266 -4.454 1.00 . A A . 4 LYS HE2 1 1 12 2597 1 1 4 LYS HE3 H -10.887 -4.323 -3.273 1.00 . A A . 4 LYS HE3 1 1 12 2598 1 1 4 LYS HG2 H -8.001 -3.483 -2.667 1.00 . A A . 4 LYS HG2 1 1 12 2599 1 1 4 LYS HG3 H -9.311 -3.540 -1.484 1.00 . A A . 4 LYS HG3 1 1 12 2600 1 1 4 LYS HZ1 H -11.096 -2.367 -5.436 1.00 . A A . 4 LYS HZ1 1 1 12 2601 1 1 4 LYS HZ2 H -12.310 -3.252 -4.659 1.00 . A A . 4 LYS HZ2 1 1 12 2602 1 1 4 LYS HZ3 H -11.342 -3.993 -5.830 1.00 . A A . 4 LYS HZ3 1 1 12 2603 1 1 4 LYS N N -6.688 -0.873 0.236 1.00 . A A . 4 LYS N 1 1 12 2604 1 1 4 LYS NZ N -11.350 -3.301 -5.054 1.00 . A A . 4 LYS NZ 1 1 12 2605 1 1 4 LYS O O -6.255 -4.114 -1.255 1.00 . A A . 4 LYS O 1 1 12 2606 1 1 5 GLN C C -2.803 -3.446 -0.633 1.00 . A A . 5 GLN C 1 1 12 2607 1 1 5 GLN CA C -3.763 -3.007 -1.736 1.00 . A A . 5 GLN CA 1 1 12 2608 1 1 5 GLN CB C -3.034 -2.109 -2.738 1.00 . A A . 5 GLN CB 1 1 12 2609 1 1 5 GLN CD C -1.109 -1.852 -4.354 1.00 . A A . 5 GLN CD 1 1 12 2610 1 1 5 GLN CG C -1.813 -2.762 -3.366 1.00 . A A . 5 GLN CG 1 1 12 2611 1 1 5 GLN H H -4.835 -1.362 -0.947 1.00 . A A . 5 GLN H 1 1 12 2612 1 1 5 GLN HA H -4.124 -3.883 -2.249 1.00 . A A . 5 GLN HA 1 1 12 2613 1 1 5 GLN HB2 H -3.719 -1.840 -3.528 1.00 . A A . 5 GLN HB2 1 1 12 2614 1 1 5 GLN HB3 H -2.713 -1.210 -2.231 1.00 . A A . 5 GLN HB3 1 1 12 2615 1 1 5 GLN HE21 H 0.559 -1.930 -3.275 1.00 . A A . 5 GLN HE21 1 1 12 2616 1 1 5 GLN HE22 H 0.635 -0.965 -4.706 1.00 . A A . 5 GLN HE22 1 1 12 2617 1 1 5 GLN HG2 H -1.117 -3.024 -2.583 1.00 . A A . 5 GLN HG2 1 1 12 2618 1 1 5 GLN HG3 H -2.126 -3.657 -3.884 1.00 . A A . 5 GLN HG3 1 1 12 2619 1 1 5 GLN N N -4.918 -2.308 -1.180 1.00 . A A . 5 GLN N 1 1 12 2620 1 1 5 GLN NE2 N 0.157 -1.552 -4.084 1.00 . A A . 5 GLN NE2 1 1 12 2621 1 1 5 GLN O O -1.985 -4.344 -0.832 1.00 . A A . 5 GLN O 1 1 12 2622 1 1 5 GLN OE1 O -1.697 -1.422 -5.347 1.00 . A A . 5 GLN OE1 1 1 12 2623 1 1 6 TYR C C -0.579 -2.863 1.339 1.00 . A A . 6 TYR C 1 1 12 2624 1 1 6 TYR CA C -2.049 -3.133 1.662 1.00 . A A . 6 TYR CA 1 1 12 2625 1 1 6 TYR CB C -2.231 -4.599 2.066 1.00 . A A . 6 TYR CB 1 1 12 2626 1 1 6 TYR CD1 C -4.667 -4.023 2.496 1.00 . A A . 6 TYR CD1 1 1 12 2627 1 1 6 TYR CD2 C -3.949 -6.266 2.870 1.00 . A A . 6 TYR CD2 1 1 12 2628 1 1 6 TYR CE1 C -5.950 -4.367 2.880 1.00 . A A . 6 TYR CE1 1 1 12 2629 1 1 6 TYR CE2 C -5.229 -6.616 3.255 1.00 . A A . 6 TYR CE2 1 1 12 2630 1 1 6 TYR CG C -3.643 -4.967 2.484 1.00 . A A . 6 TYR CG 1 1 12 2631 1 1 6 TYR CZ C -6.225 -5.664 3.257 1.00 . A A . 6 TYR CZ 1 1 12 2632 1 1 6 TYR H H -3.577 -2.101 0.625 1.00 . A A . 6 TYR H 1 1 12 2633 1 1 6 TYR HA H -2.342 -2.504 2.488 1.00 . A A . 6 TYR HA 1 1 12 2634 1 1 6 TYR HB2 H -1.963 -5.228 1.230 1.00 . A A . 6 TYR HB2 1 1 12 2635 1 1 6 TYR HB3 H -1.573 -4.818 2.895 1.00 . A A . 6 TYR HB3 1 1 12 2636 1 1 6 TYR HD1 H -4.451 -3.008 2.201 1.00 . A A . 6 TYR HD1 1 1 12 2637 1 1 6 TYR HD2 H -3.167 -7.011 2.867 1.00 . A A . 6 TYR HD2 1 1 12 2638 1 1 6 TYR HE1 H -6.730 -3.621 2.882 1.00 . A A . 6 TYR HE1 1 1 12 2639 1 1 6 TYR HE2 H -5.444 -7.632 3.551 1.00 . A A . 6 TYR HE2 1 1 12 2640 1 1 6 TYR HH H -8.107 -5.853 2.911 1.00 . A A . 6 TYR HH 1 1 12 2641 1 1 6 TYR N N -2.907 -2.807 0.528 1.00 . A A . 6 TYR N 1 1 12 2642 1 1 6 TYR O O 0.311 -3.372 2.017 1.00 . A A . 6 TYR O 1 1 12 2643 1 1 6 TYR OH O -7.502 -6.009 3.640 1.00 . A A . 6 TYR OH 1 1 12 2644 1 1 7 TRP C C 1.948 -2.927 -0.097 1.00 . A A . 7 TRP C 1 1 12 2645 1 1 7 TRP CA C 1.019 -1.711 -0.128 1.00 . A A . 7 TRP CA 1 1 12 2646 1 1 7 TRP CB C 1.582 -0.587 0.750 1.00 . A A . 7 TRP CB 1 1 12 2647 1 1 7 TRP CD1 C 2.411 -1.955 2.754 1.00 . A A . 7 TRP CD1 1 1 12 2648 1 1 7 TRP CD2 C 1.022 -0.283 3.292 1.00 . A A . 7 TRP CD2 1 1 12 2649 1 1 7 TRP CE2 C 1.401 -0.949 4.473 1.00 . A A . 7 TRP CE2 1 1 12 2650 1 1 7 TRP CE3 C 0.150 0.807 3.382 1.00 . A A . 7 TRP CE3 1 1 12 2651 1 1 7 TRP CG C 1.679 -0.941 2.203 1.00 . A A . 7 TRP CG 1 1 12 2652 1 1 7 TRP CH2 C 0.086 0.507 5.786 1.00 . A A . 7 TRP CH2 1 1 12 2653 1 1 7 TRP CZ2 C 0.937 -0.562 5.728 1.00 . A A . 7 TRP CZ2 1 1 12 2654 1 1 7 TRP CZ3 C -0.310 1.189 4.628 1.00 . A A . 7 TRP CZ3 1 1 12 2655 1 1 7 TRP H H -1.097 -1.689 -0.197 1.00 . A A . 7 TRP H 1 1 12 2656 1 1 7 TRP HA H 0.956 -1.356 -1.146 1.00 . A A . 7 TRP HA 1 1 12 2657 1 1 7 TRP HB2 H 2.571 -0.330 0.404 1.00 . A A . 7 TRP HB2 1 1 12 2658 1 1 7 TRP HB3 H 0.942 0.279 0.661 1.00 . A A . 7 TRP HB3 1 1 12 2659 1 1 7 TRP HD1 H 3.024 -2.640 2.187 1.00 . A A . 7 TRP HD1 1 1 12 2660 1 1 7 TRP HE1 H 2.672 -2.598 4.736 1.00 . A A . 7 TRP HE1 1 1 12 2661 1 1 7 TRP HE3 H -0.165 1.345 2.501 1.00 . A A . 7 TRP HE3 1 1 12 2662 1 1 7 TRP HH2 H -0.299 0.841 6.738 1.00 . A A . 7 TRP HH2 1 1 12 2663 1 1 7 TRP HZ2 H 1.232 -1.076 6.629 1.00 . A A . 7 TRP HZ2 1 1 12 2664 1 1 7 TRP HZ3 H -0.984 2.028 4.718 1.00 . A A . 7 TRP HZ3 1 1 12 2665 1 1 7 TRP N N -0.338 -2.060 0.299 1.00 . A A . 7 TRP N 1 1 12 2666 1 1 7 TRP NE1 N 2.249 -1.966 4.118 1.00 . A A . 7 TRP NE1 1 1 12 2667 1 1 7 TRP O O 1.494 -4.065 0.020 1.00 . A A . 7 TRP O 1 1 12 2668 1 1 8 TRP C C 5.645 -3.156 -0.096 1.00 . A A . 8 TRP C 1 1 12 2669 1 1 8 TRP CA C 4.236 -3.752 -0.193 1.00 . A A . 8 TRP CA 1 1 12 2670 1 1 8 TRP CB C 4.087 -4.612 -1.456 1.00 . A A . 8 TRP CB 1 1 12 2671 1 1 8 TRP CD1 C 5.113 -6.664 -2.585 1.00 . A A . 8 TRP CD1 1 1 12 2672 1 1 8 TRP CD2 C 5.957 -6.259 -0.546 1.00 . A A . 8 TRP CD2 1 1 12 2673 1 1 8 TRP CE2 C 6.596 -7.395 -1.086 1.00 . A A . 8 TRP CE2 1 1 12 2674 1 1 8 TRP CE3 C 6.329 -5.834 0.737 1.00 . A A . 8 TRP CE3 1 1 12 2675 1 1 8 TRP CG C 5.030 -5.784 -1.544 1.00 . A A . 8 TRP CG 1 1 12 2676 1 1 8 TRP CH2 C 7.913 -7.664 0.855 1.00 . A A . 8 TRP CH2 1 1 12 2677 1 1 8 TRP CZ2 C 7.576 -8.103 -0.394 1.00 . A A . 8 TRP CZ2 1 1 12 2678 1 1 8 TRP CZ3 C 7.299 -6.542 1.421 1.00 . A A . 8 TRP CZ3 1 1 12 2679 1 1 8 TRP H H 3.554 -1.753 -0.303 1.00 . A A . 8 TRP H 1 1 12 2680 1 1 8 TRP HA H 4.056 -4.363 0.675 1.00 . A A . 8 TRP HA 1 1 12 2681 1 1 8 TRP HB2 H 3.082 -5.003 -1.489 1.00 . A A . 8 TRP HB2 1 1 12 2682 1 1 8 TRP HB3 H 4.246 -3.990 -2.324 1.00 . A A . 8 TRP HB3 1 1 12 2683 1 1 8 TRP HD1 H 4.530 -6.590 -3.490 1.00 . A A . 8 TRP HD1 1 1 12 2684 1 1 8 TRP HE1 H 6.329 -8.337 -2.938 1.00 . A A . 8 TRP HE1 1 1 12 2685 1 1 8 TRP HE3 H 5.867 -4.978 1.199 1.00 . A A . 8 TRP HE3 1 1 12 2686 1 1 8 TRP HH2 H 8.665 -8.185 1.428 1.00 . A A . 8 TRP HH2 1 1 12 2687 1 1 8 TRP HZ2 H 8.060 -8.970 -0.818 1.00 . A A . 8 TRP HZ2 1 1 12 2688 1 1 8 TRP HZ3 H 7.594 -6.228 2.411 1.00 . A A . 8 TRP HZ3 1 1 12 2689 1 1 8 TRP N N 3.250 -2.679 -0.207 1.00 . A A . 8 TRP N 1 1 12 2690 1 1 8 TRP NE1 N 6.070 -7.614 -2.331 1.00 . A A . 8 TRP NE1 1 1 12 2691 1 1 8 TRP O O 6.091 -2.786 0.991 1.00 . A A . 8 TRP O 1 1 12 2692 1 1 9 ARG C C 7.679 -1.016 -0.880 1.00 . A A . 9 ARG C 1 1 12 2693 1 1 9 ARG CA C 7.689 -2.502 -1.242 1.00 . A A . 9 ARG CA 1 1 12 2694 1 1 9 ARG CB C 8.336 -2.703 -2.616 1.00 . A A . 9 ARG CB 1 1 12 2695 1 1 9 ARG CD C 9.306 -4.949 -2.038 1.00 . A A . 9 ARG CD 1 1 12 2696 1 1 9 ARG CG C 8.458 -4.162 -3.025 1.00 . A A . 9 ARG CG 1 1 12 2697 1 1 9 ARG CZ C 10.121 -7.253 -1.726 1.00 . A A . 9 ARG CZ 1 1 12 2698 1 1 9 ARG H H 5.940 -3.363 -2.060 1.00 . A A . 9 ARG H 1 1 12 2699 1 1 9 ARG HA H 8.270 -3.033 -0.503 1.00 . A A . 9 ARG HA 1 1 12 2700 1 1 9 ARG HB2 H 7.745 -2.192 -3.361 1.00 . A A . 9 ARG HB2 1 1 12 2701 1 1 9 ARG HB3 H 9.326 -2.274 -2.599 1.00 . A A . 9 ARG HB3 1 1 12 2702 1 1 9 ARG HD2 H 10.290 -4.507 -1.997 1.00 . A A . 9 ARG HD2 1 1 12 2703 1 1 9 ARG HD3 H 8.846 -4.891 -1.062 1.00 . A A . 9 ARG HD3 1 1 12 2704 1 1 9 ARG HE H 8.979 -6.639 -3.243 1.00 . A A . 9 ARG HE 1 1 12 2705 1 1 9 ARG HG2 H 7.471 -4.599 -3.063 1.00 . A A . 9 ARG HG2 1 1 12 2706 1 1 9 ARG HG3 H 8.916 -4.215 -4.002 1.00 . A A . 9 ARG HG3 1 1 12 2707 1 1 9 ARG HH11 H 10.698 -5.958 -0.283 1.00 . A A . 9 ARG HH11 1 1 12 2708 1 1 9 ARG HH12 H 11.262 -7.583 -0.089 1.00 . A A . 9 ARG HH12 1 1 12 2709 1 1 9 ARG HH21 H 9.718 -8.778 -2.989 1.00 . A A . 9 ARG HH21 1 1 12 2710 1 1 9 ARG HH22 H 10.706 -9.185 -1.626 1.00 . A A . 9 ARG HH22 1 1 12 2711 1 1 9 ARG N N 6.341 -3.058 -1.224 1.00 . A A . 9 ARG N 1 1 12 2712 1 1 9 ARG NE N 9.432 -6.352 -2.422 1.00 . A A . 9 ARG NE 1 1 12 2713 1 1 9 ARG NH1 N 10.745 -6.902 -0.608 1.00 . A A . 9 ARG NH1 1 1 12 2714 1 1 9 ARG NH2 N 10.187 -8.508 -2.148 1.00 . A A . 9 ARG NH2 1 1 12 2715 1 1 9 ARG O O 8.507 -0.562 -0.091 1.00 . A A . 9 ARG O 1 1 12 2716 1 1 10 PRO C C 6.157 1.490 0.240 1.00 . A A . 10 PRO C 1 1 12 2717 1 1 10 PRO CA C 6.645 1.205 -1.176 1.00 . A A . 10 PRO CA 1 1 12 2718 1 1 10 PRO CB C 5.620 1.713 -2.205 1.00 . A A . 10 PRO CB 1 1 12 2719 1 1 10 PRO CD C 5.713 -0.667 -2.403 1.00 . A A . 10 PRO CD 1 1 12 2720 1 1 10 PRO CG C 5.428 0.590 -3.169 1.00 . A A . 10 PRO CG 1 1 12 2721 1 1 10 PRO HA H 7.592 1.702 -1.333 1.00 . A A . 10 PRO HA 1 1 12 2722 1 1 10 PRO HB2 H 4.697 1.961 -1.701 1.00 . A A . 10 PRO HB2 1 1 12 2723 1 1 10 PRO HB3 H 6.011 2.591 -2.698 1.00 . A A . 10 PRO HB3 1 1 12 2724 1 1 10 PRO HD2 H 4.827 -1.007 -1.888 1.00 . A A . 10 PRO HD2 1 1 12 2725 1 1 10 PRO HD3 H 6.091 -1.434 -3.060 1.00 . A A . 10 PRO HD3 1 1 12 2726 1 1 10 PRO HG2 H 4.409 0.586 -3.530 1.00 . A A . 10 PRO HG2 1 1 12 2727 1 1 10 PRO HG3 H 6.117 0.692 -3.994 1.00 . A A . 10 PRO HG3 1 1 12 2728 1 1 10 PRO N N 6.743 -0.232 -1.451 1.00 . A A . 10 PRO N 1 1 12 2729 1 1 10 PRO O O 6.198 0.618 1.109 1.00 . A A . 10 PRO O 1 1 12 2730 1 1 11 SER C C 4.392 4.409 1.678 1.00 . A A . 11 SER C 1 1 12 2731 1 1 11 SER CA C 5.194 3.116 1.776 1.00 . A A . 11 SER CA 1 1 12 2732 1 1 11 SER CB C 6.355 3.294 2.756 1.00 . A A . 11 SER CB 1 1 12 2733 1 1 11 SER H H 5.685 3.364 -0.268 1.00 . A A . 11 SER H 1 1 12 2734 1 1 11 SER HA H 4.546 2.331 2.138 1.00 . A A . 11 SER HA 1 1 12 2735 1 1 11 SER HB2 H 7.022 4.057 2.385 1.00 . A A . 11 SER HB2 1 1 12 2736 1 1 11 SER HB3 H 5.967 3.593 3.719 1.00 . A A . 11 SER HB3 1 1 12 2737 1 1 11 SER HG H 6.475 1.370 3.101 1.00 . A A . 11 SER HG 1 1 12 2738 1 1 11 SER N N 5.693 2.714 0.465 1.00 . A A . 11 SER N 1 1 12 2739 1 1 11 SER O O 4.378 5.215 2.610 1.00 . A A . 11 SER O 1 1 12 2740 1 1 11 SER OG O 7.083 2.088 2.911 1.00 . A A . 11 SER OG 1 1 12 2741 1 1 12 ILE C C 1.671 5.781 1.200 1.00 . A A . 12 ILE C 1 1 12 2742 1 1 12 ILE CA C 2.921 5.798 0.325 1.00 . A A . 12 ILE CA 1 1 12 2743 1 1 12 ILE CB C 2.506 5.929 -1.155 1.00 . A A . 12 ILE CB 1 1 12 2744 1 1 12 ILE CD1 C 4.640 7.191 -1.734 1.00 . A A . 12 ILE CD1 1 1 12 2745 1 1 12 ILE CG1 C 3.746 6.011 -2.048 1.00 . A A . 12 ILE CG1 1 1 12 2746 1 1 12 ILE CG2 C 1.624 7.153 -1.361 1.00 . A A . 12 ILE CG2 1 1 12 2747 1 1 12 ILE H H 3.776 3.924 -0.161 1.00 . A A . 12 ILE H 1 1 12 2748 1 1 12 ILE HA H 3.521 6.657 0.587 1.00 . A A . 12 ILE HA 1 1 12 2749 1 1 12 ILE HB H 1.935 5.054 -1.426 1.00 . A A . 12 ILE HB 1 1 12 2750 1 1 12 ILE HD11 H 5.541 6.841 -1.251 1.00 . A A . 12 ILE HD11 1 1 12 2751 1 1 12 ILE HD12 H 4.120 7.871 -1.076 1.00 . A A . 12 ILE HD12 1 1 12 2752 1 1 12 ILE HD13 H 4.897 7.702 -2.650 1.00 . A A . 12 ILE HD13 1 1 12 2753 1 1 12 ILE HG12 H 4.330 5.111 -1.926 1.00 . A A . 12 ILE HG12 1 1 12 2754 1 1 12 ILE HG13 H 3.434 6.095 -3.080 1.00 . A A . 12 ILE HG13 1 1 12 2755 1 1 12 ILE HG21 H 1.428 7.284 -2.415 1.00 . A A . 12 ILE HG21 1 1 12 2756 1 1 12 ILE HG22 H 2.127 8.029 -0.977 1.00 . A A . 12 ILE HG22 1 1 12 2757 1 1 12 ILE HG23 H 0.689 7.016 -0.835 1.00 . A A . 12 ILE HG23 1 1 12 2758 1 1 12 ILE N N 3.725 4.602 0.545 1.00 . A A . 12 ILE N 1 1 12 2759 1 1 12 ILE O O 1.537 6.681 2.056 1.00 . A A . 12 ILE O 1 1 12 2760 1 1 12 ILE OXT O 0.836 4.869 1.020 1.00 . A A . 12 ILE OXT 1 1 13 2761 1 1 1 HIS C C -5.989 4.064 2.787 1.00 . A A . 1 HIS C 1 1 13 2762 1 1 1 HIS CA C -4.951 5.096 3.226 1.00 . A A . 1 HIS CA 1 1 13 2763 1 1 1 HIS CB C -4.983 5.263 4.747 1.00 . A A . 1 HIS CB 1 1 13 2764 1 1 1 HIS CD2 C -4.101 7.377 5.964 1.00 . A A . 1 HIS CD2 1 1 13 2765 1 1 1 HIS CE1 C -1.955 7.057 5.649 1.00 . A A . 1 HIS CE1 1 1 13 2766 1 1 1 HIS CG C -3.960 6.225 5.265 1.00 . A A . 1 HIS CG 1 1 13 2767 1 1 1 HIS H1 H -5.448 6.255 1.601 1.00 . A A . 1 HIS H1 1 1 13 2768 1 1 1 HIS H2 H -4.342 6.986 2.690 1.00 . A A . 1 HIS H2 1 1 13 2769 1 1 1 HIS H3 H -6.002 6.859 3.106 1.00 . A A . 1 HIS H3 1 1 13 2770 1 1 1 HIS HA H -3.970 4.758 2.927 1.00 . A A . 1 HIS HA 1 1 13 2771 1 1 1 HIS HB2 H -5.957 5.624 5.041 1.00 . A A . 1 HIS HB2 1 1 13 2772 1 1 1 HIS HB3 H -4.805 4.304 5.211 1.00 . A A . 1 HIS HB3 1 1 13 2773 1 1 1 HIS HD1 H -2.180 5.307 4.610 1.00 . A A . 1 HIS HD1 1 1 13 2774 1 1 1 HIS HD2 H -5.033 7.822 6.284 1.00 . A A . 1 HIS HD2 1 1 13 2775 1 1 1 HIS HE1 H -0.883 7.186 5.665 1.00 . A A . 1 HIS HE1 1 1 13 2776 1 1 1 HIS HE2 H -2.626 8.645 6.753 1.00 . A A . 1 HIS HE2 1 1 13 2777 1 1 1 HIS N N -5.210 6.418 2.600 1.00 . A A . 1 HIS N 1 1 13 2778 1 1 1 HIS ND1 N -2.604 6.053 5.083 1.00 . A A . 1 HIS ND1 1 1 13 2779 1 1 1 HIS NE2 N -2.841 7.873 6.189 1.00 . A A . 1 HIS NE2 1 1 13 2780 1 1 1 HIS O O -6.894 3.719 3.546 1.00 . A A . 1 HIS O 1 1 13 2781 1 1 2 PRO C C -6.619 1.190 1.653 1.00 . A A . 2 PRO C 1 1 13 2782 1 1 2 PRO CA C -6.801 2.560 1.009 1.00 . A A . 2 PRO CA 1 1 13 2783 1 1 2 PRO CB C -6.438 2.505 -0.476 1.00 . A A . 2 PRO CB 1 1 13 2784 1 1 2 PRO CD C -4.817 3.912 0.576 1.00 . A A . 2 PRO CD 1 1 13 2785 1 1 2 PRO CG C -5.007 2.909 -0.529 1.00 . A A . 2 PRO CG 1 1 13 2786 1 1 2 PRO HA H -7.827 2.877 1.121 1.00 . A A . 2 PRO HA 1 1 13 2787 1 1 2 PRO HB2 H -6.581 1.499 -0.846 1.00 . A A . 2 PRO HB2 1 1 13 2788 1 1 2 PRO HB3 H -7.063 3.190 -1.029 1.00 . A A . 2 PRO HB3 1 1 13 2789 1 1 2 PRO HD2 H -3.836 3.809 1.015 1.00 . A A . 2 PRO HD2 1 1 13 2790 1 1 2 PRO HD3 H -4.961 4.915 0.204 1.00 . A A . 2 PRO HD3 1 1 13 2791 1 1 2 PRO HG2 H -4.375 2.049 -0.367 1.00 . A A . 2 PRO HG2 1 1 13 2792 1 1 2 PRO HG3 H -4.787 3.361 -1.485 1.00 . A A . 2 PRO HG3 1 1 13 2793 1 1 2 PRO N N -5.869 3.556 1.547 1.00 . A A . 2 PRO N 1 1 13 2794 1 1 2 PRO O O -5.495 0.713 1.815 1.00 . A A . 2 PRO O 1 1 13 2795 1 1 3 LEU C C -7.756 -1.876 1.611 1.00 . A A . 3 LEU C 1 1 13 2796 1 1 3 LEU CA C -7.688 -0.756 2.649 1.00 . A A . 3 LEU CA 1 1 13 2797 1 1 3 LEU CB C -8.826 -0.896 3.666 1.00 . A A . 3 LEU CB 1 1 13 2798 1 1 3 LEU CD1 C -10.527 -1.789 2.040 1.00 . A A . 3 LEU CD1 1 1 13 2799 1 1 3 LEU CD2 C -11.270 -0.808 4.218 1.00 . A A . 3 LEU CD2 1 1 13 2800 1 1 3 LEU CG C -10.240 -0.737 3.100 1.00 . A A . 3 LEU CG 1 1 13 2801 1 1 3 LEU H H -8.598 0.990 1.869 1.00 . A A . 3 LEU H 1 1 13 2802 1 1 3 LEU HA H -6.750 -0.832 3.173 1.00 . A A . 3 LEU HA 1 1 13 2803 1 1 3 LEU HB2 H -8.753 -1.873 4.121 1.00 . A A . 3 LEU HB2 1 1 13 2804 1 1 3 LEU HB3 H -8.686 -0.150 4.434 1.00 . A A . 3 LEU HB3 1 1 13 2805 1 1 3 LEU HD11 H -10.184 -1.435 1.079 1.00 . A A . 3 LEU HD11 1 1 13 2806 1 1 3 LEU HD12 H -11.589 -1.978 1.997 1.00 . A A . 3 LEU HD12 1 1 13 2807 1 1 3 LEU HD13 H -10.009 -2.704 2.291 1.00 . A A . 3 LEU HD13 1 1 13 2808 1 1 3 LEU HD21 H -10.802 -0.547 5.155 1.00 . A A . 3 LEU HD21 1 1 13 2809 1 1 3 LEU HD22 H -11.666 -1.811 4.279 1.00 . A A . 3 LEU HD22 1 1 13 2810 1 1 3 LEU HD23 H -12.072 -0.115 4.011 1.00 . A A . 3 LEU HD23 1 1 13 2811 1 1 3 LEU HG H -10.318 0.232 2.633 1.00 . A A . 3 LEU HG 1 1 13 2812 1 1 3 LEU N N -7.730 0.560 2.023 1.00 . A A . 3 LEU N 1 1 13 2813 1 1 3 LEU O O -7.778 -3.056 1.961 1.00 . A A . 3 LEU O 1 1 13 2814 1 1 4 LYS C C -6.458 -2.885 -1.203 1.00 . A A . 4 LYS C 1 1 13 2815 1 1 4 LYS CA C -7.857 -2.488 -0.741 1.00 . A A . 4 LYS CA 1 1 13 2816 1 1 4 LYS CB C -8.663 -1.935 -1.919 1.00 . A A . 4 LYS CB 1 1 13 2817 1 1 4 LYS CD C -9.590 -2.307 -4.225 1.00 . A A . 4 LYS CD 1 1 13 2818 1 1 4 LYS CE C -9.706 -3.276 -5.391 1.00 . A A . 4 LYS CE 1 1 13 2819 1 1 4 LYS CG C -8.780 -2.903 -3.085 1.00 . A A . 4 LYS CG 1 1 13 2820 1 1 4 LYS H H -7.775 -0.553 0.109 1.00 . A A . 4 LYS H 1 1 13 2821 1 1 4 LYS HA H -8.356 -3.365 -0.357 1.00 . A A . 4 LYS HA 1 1 13 2822 1 1 4 LYS HB2 H -9.659 -1.695 -1.577 1.00 . A A . 4 LYS HB2 1 1 13 2823 1 1 4 LYS HB3 H -8.186 -1.033 -2.273 1.00 . A A . 4 LYS HB3 1 1 13 2824 1 1 4 LYS HD2 H -10.580 -2.072 -3.866 1.00 . A A . 4 LYS HD2 1 1 13 2825 1 1 4 LYS HD3 H -9.103 -1.405 -4.565 1.00 . A A . 4 LYS HD3 1 1 13 2826 1 1 4 LYS HE2 H -8.715 -3.512 -5.747 1.00 . A A . 4 LYS HE2 1 1 13 2827 1 1 4 LYS HE3 H -10.188 -4.178 -5.045 1.00 . A A . 4 LYS HE3 1 1 13 2828 1 1 4 LYS HG2 H -7.790 -3.139 -3.445 1.00 . A A . 4 LYS HG2 1 1 13 2829 1 1 4 LYS HG3 H -9.265 -3.806 -2.743 1.00 . A A . 4 LYS HG3 1 1 13 2830 1 1 4 LYS HZ1 H -10.461 -3.334 -7.338 1.00 . A A . 4 LYS HZ1 1 1 13 2831 1 1 4 LYS HZ2 H -10.114 -1.774 -6.784 1.00 . A A . 4 LYS HZ2 1 1 13 2832 1 1 4 LYS HZ3 H -11.490 -2.581 -6.226 1.00 . A A . 4 LYS HZ3 1 1 13 2833 1 1 4 LYS N N -7.793 -1.506 0.334 1.00 . A A . 4 LYS N 1 1 13 2834 1 1 4 LYS NZ N -10.498 -2.701 -6.514 1.00 . A A . 4 LYS NZ 1 1 13 2835 1 1 4 LYS O O -6.280 -3.902 -1.874 1.00 . A A . 4 LYS O 1 1 13 2836 1 1 5 GLN C C -3.127 -1.951 -0.100 1.00 . A A . 5 GLN C 1 1 13 2837 1 1 5 GLN CA C -4.085 -2.344 -1.222 1.00 . A A . 5 GLN CA 1 1 13 2838 1 1 5 GLN CB C -3.732 -1.586 -2.504 1.00 . A A . 5 GLN CB 1 1 13 2839 1 1 5 GLN CD C -1.980 -1.050 -4.242 1.00 . A A . 5 GLN CD 1 1 13 2840 1 1 5 GLN CG C -2.303 -1.811 -2.971 1.00 . A A . 5 GLN CG 1 1 13 2841 1 1 5 GLN H H -5.666 -1.280 -0.309 1.00 . A A . 5 GLN H 1 1 13 2842 1 1 5 GLN HA H -3.991 -3.404 -1.404 1.00 . A A . 5 GLN HA 1 1 13 2843 1 1 5 GLN HB2 H -4.399 -1.903 -3.291 1.00 . A A . 5 GLN HB2 1 1 13 2844 1 1 5 GLN HB3 H -3.869 -0.528 -2.332 1.00 . A A . 5 GLN HB3 1 1 13 2845 1 1 5 GLN HE21 H -0.530 -0.060 -3.309 1.00 . A A . 5 GLN HE21 1 1 13 2846 1 1 5 GLN HE22 H -0.759 0.338 -4.974 1.00 . A A . 5 GLN HE22 1 1 13 2847 1 1 5 GLN HG2 H -1.629 -1.484 -2.195 1.00 . A A . 5 GLN HG2 1 1 13 2848 1 1 5 GLN HG3 H -2.159 -2.866 -3.154 1.00 . A A . 5 GLN HG3 1 1 13 2849 1 1 5 GLN N N -5.466 -2.075 -0.843 1.00 . A A . 5 GLN N 1 1 13 2850 1 1 5 GLN NE2 N -0.989 -0.168 -4.167 1.00 . A A . 5 GLN NE2 1 1 13 2851 1 1 5 GLN O O -2.885 -0.768 0.135 1.00 . A A . 5 GLN O 1 1 13 2852 1 1 5 GLN OE1 O -2.611 -1.254 -5.279 1.00 . A A . 5 GLN OE1 1 1 13 2853 1 1 6 TYR C C -0.210 -2.573 1.169 1.00 . A A . 6 TYR C 1 1 13 2854 1 1 6 TYR CA C -1.645 -2.713 1.679 1.00 . A A . 6 TYR CA 1 1 13 2855 1 1 6 TYR CB C -1.718 -3.848 2.705 1.00 . A A . 6 TYR CB 1 1 13 2856 1 1 6 TYR CD1 C -4.152 -3.197 3.046 1.00 . A A . 6 TYR CD1 1 1 13 2857 1 1 6 TYR CD2 C -3.278 -5.026 4.301 1.00 . A A . 6 TYR CD2 1 1 13 2858 1 1 6 TYR CE1 C -5.382 -3.364 3.654 1.00 . A A . 6 TYR CE1 1 1 13 2859 1 1 6 TYR CE2 C -4.505 -5.198 4.913 1.00 . A A . 6 TYR CE2 1 1 13 2860 1 1 6 TYR CG C -3.077 -4.026 3.358 1.00 . A A . 6 TYR CG 1 1 13 2861 1 1 6 TYR CZ C -5.553 -4.364 4.587 1.00 . A A . 6 TYR CZ 1 1 13 2862 1 1 6 TYR H H -2.812 -3.875 0.347 1.00 . A A . 6 TYR H 1 1 13 2863 1 1 6 TYR HA H -1.932 -1.790 2.160 1.00 . A A . 6 TYR HA 1 1 13 2864 1 1 6 TYR HB2 H -1.467 -4.778 2.216 1.00 . A A . 6 TYR HB2 1 1 13 2865 1 1 6 TYR HB3 H -0.999 -3.658 3.488 1.00 . A A . 6 TYR HB3 1 1 13 2866 1 1 6 TYR HD1 H -4.021 -2.413 2.316 1.00 . A A . 6 TYR HD1 1 1 13 2867 1 1 6 TYR HD2 H -2.457 -5.679 4.556 1.00 . A A . 6 TYR HD2 1 1 13 2868 1 1 6 TYR HE1 H -6.201 -2.712 3.400 1.00 . A A . 6 TYR HE1 1 1 13 2869 1 1 6 TYR HE2 H -4.639 -5.981 5.645 1.00 . A A . 6 TYR HE2 1 1 13 2870 1 1 6 TYR HH H -6.855 -3.920 5.930 1.00 . A A . 6 TYR HH 1 1 13 2871 1 1 6 TYR N N -2.581 -2.953 0.585 1.00 . A A . 6 TYR N 1 1 13 2872 1 1 6 TYR O O 0.731 -2.547 1.959 1.00 . A A . 6 TYR O 1 1 13 2873 1 1 6 TYR OH O -6.776 -4.532 5.194 1.00 . A A . 6 TYR OH 1 1 13 2874 1 1 7 TRP C C 2.288 -3.295 -0.161 1.00 . A A . 7 TRP C 1 1 13 2875 1 1 7 TRP CA C 1.265 -2.345 -0.782 1.00 . A A . 7 TRP CA 1 1 13 2876 1 1 7 TRP CB C 1.758 -0.896 -0.682 1.00 . A A . 7 TRP CB 1 1 13 2877 1 1 7 TRP CD1 C 2.743 -0.912 1.685 1.00 . A A . 7 TRP CD1 1 1 13 2878 1 1 7 TRP CD2 C 1.238 0.707 1.326 1.00 . A A . 7 TRP CD2 1 1 13 2879 1 1 7 TRP CE2 C 1.698 0.808 2.653 1.00 . A A . 7 TRP CE2 1 1 13 2880 1 1 7 TRP CE3 C 0.284 1.624 0.873 1.00 . A A . 7 TRP CE3 1 1 13 2881 1 1 7 TRP CG C 1.919 -0.400 0.724 1.00 . A A . 7 TRP CG 1 1 13 2882 1 1 7 TRP CH2 C 0.303 2.670 3.060 1.00 . A A . 7 TRP CH2 1 1 13 2883 1 1 7 TRP CZ2 C 1.237 1.787 3.529 1.00 . A A . 7 TRP CZ2 1 1 13 2884 1 1 7 TRP CZ3 C -0.173 2.595 1.745 1.00 . A A . 7 TRP CZ3 1 1 13 2885 1 1 7 TRP H H -0.843 -2.513 -0.727 1.00 . A A . 7 TRP H 1 1 13 2886 1 1 7 TRP HA H 1.154 -2.601 -1.826 1.00 . A A . 7 TRP HA 1 1 13 2887 1 1 7 TRP HB2 H 2.715 -0.814 -1.173 1.00 . A A . 7 TRP HB2 1 1 13 2888 1 1 7 TRP HB3 H 1.050 -0.251 -1.184 1.00 . A A . 7 TRP HB3 1 1 13 2889 1 1 7 TRP HD1 H 3.395 -1.761 1.537 1.00 . A A . 7 TRP HD1 1 1 13 2890 1 1 7 TRP HE1 H 3.103 -0.364 3.680 1.00 . A A . 7 TRP HE1 1 1 13 2891 1 1 7 TRP HE3 H -0.095 1.581 -0.137 1.00 . A A . 7 TRP HE3 1 1 13 2892 1 1 7 TRP HH2 H -0.083 3.444 3.705 1.00 . A A . 7 TRP HH2 1 1 13 2893 1 1 7 TRP HZ2 H 1.594 1.858 4.546 1.00 . A A . 7 TRP HZ2 1 1 13 2894 1 1 7 TRP HZ3 H -0.911 3.310 1.412 1.00 . A A . 7 TRP HZ3 1 1 13 2895 1 1 7 TRP N N -0.051 -2.485 -0.153 1.00 . A A . 7 TRP N 1 1 13 2896 1 1 7 TRP NE1 N 2.616 -0.191 2.847 1.00 . A A . 7 TRP NE1 1 1 13 2897 1 1 7 TRP O O 1.937 -4.178 0.622 1.00 . A A . 7 TRP O 1 1 13 2898 1 1 8 TRP C C 5.888 -3.104 0.207 1.00 . A A . 8 TRP C 1 1 13 2899 1 1 8 TRP CA C 4.627 -3.950 -0.001 1.00 . A A . 8 TRP CA 1 1 13 2900 1 1 8 TRP CB C 4.896 -5.108 -0.973 1.00 . A A . 8 TRP CB 1 1 13 2901 1 1 8 TRP CD1 C 6.405 -7.153 -1.248 1.00 . A A . 8 TRP CD1 1 1 13 2902 1 1 8 TRP CD2 C 6.665 -6.118 0.725 1.00 . A A . 8 TRP CD2 1 1 13 2903 1 1 8 TRP CE2 C 7.549 -7.216 0.667 1.00 . A A . 8 TRP CE2 1 1 13 2904 1 1 8 TRP CE3 C 6.654 -5.334 1.886 1.00 . A A . 8 TRP CE3 1 1 13 2905 1 1 8 TRP CG C 5.964 -6.075 -0.535 1.00 . A A . 8 TRP CG 1 1 13 2906 1 1 8 TRP CH2 C 8.366 -6.762 2.835 1.00 . A A . 8 TRP CH2 1 1 13 2907 1 1 8 TRP CZ2 C 8.403 -7.546 1.716 1.00 . A A . 8 TRP CZ2 1 1 13 2908 1 1 8 TRP CZ3 C 7.500 -5.667 2.928 1.00 . A A . 8 TRP CZ3 1 1 13 2909 1 1 8 TRP H H 3.774 -2.395 -1.151 1.00 . A A . 8 TRP H 1 1 13 2910 1 1 8 TRP HA H 4.314 -4.349 0.947 1.00 . A A . 8 TRP HA 1 1 13 2911 1 1 8 TRP HB2 H 3.984 -5.670 -1.100 1.00 . A A . 8 TRP HB2 1 1 13 2912 1 1 8 TRP HB3 H 5.187 -4.701 -1.930 1.00 . A A . 8 TRP HB3 1 1 13 2913 1 1 8 TRP HD1 H 6.059 -7.408 -2.239 1.00 . A A . 8 TRP HD1 1 1 13 2914 1 1 8 TRP HE1 H 7.863 -8.613 -0.863 1.00 . A A . 8 TRP HE1 1 1 13 2915 1 1 8 TRP HE3 H 5.993 -4.490 1.986 1.00 . A A . 8 TRP HE3 1 1 13 2916 1 1 8 TRP HH2 H 9.009 -6.985 3.674 1.00 . A A . 8 TRP HH2 1 1 13 2917 1 1 8 TRP HZ2 H 9.078 -8.387 1.662 1.00 . A A . 8 TRP HZ2 1 1 13 2918 1 1 8 TRP HZ3 H 7.501 -5.073 3.829 1.00 . A A . 8 TRP HZ3 1 1 13 2919 1 1 8 TRP N N 3.555 -3.111 -0.519 1.00 . A A . 8 TRP N 1 1 13 2920 1 1 8 TRP NE1 N 7.378 -7.822 -0.547 1.00 . A A . 8 TRP NE1 1 1 13 2921 1 1 8 TRP O O 6.031 -2.439 1.233 1.00 . A A . 8 TRP O 1 1 13 2922 1 1 9 ARG C C 7.743 -0.854 -0.611 1.00 . A A . 9 ARG C 1 1 13 2923 1 1 9 ARG CA C 8.027 -2.356 -0.676 1.00 . A A . 9 ARG CA 1 1 13 2924 1 1 9 ARG CB C 8.939 -2.668 -1.865 1.00 . A A . 9 ARG CB 1 1 13 2925 1 1 9 ARG CD C 10.091 -4.584 -0.714 1.00 . A A . 9 ARG CD 1 1 13 2926 1 1 9 ARG CG C 9.338 -4.133 -1.955 1.00 . A A . 9 ARG CG 1 1 13 2927 1 1 9 ARG CZ C 11.148 -6.627 0.168 1.00 . A A . 9 ARG CZ 1 1 13 2928 1 1 9 ARG H H 6.626 -3.667 -1.559 1.00 . A A . 9 ARG H 1 1 13 2929 1 1 9 ARG HA H 8.531 -2.649 0.233 1.00 . A A . 9 ARG HA 1 1 13 2930 1 1 9 ARG HB2 H 8.429 -2.401 -2.778 1.00 . A A . 9 ARG HB2 1 1 13 2931 1 1 9 ARG HB3 H 9.838 -2.077 -1.780 1.00 . A A . 9 ARG HB3 1 1 13 2932 1 1 9 ARG HD2 H 10.979 -3.980 -0.608 1.00 . A A . 9 ARG HD2 1 1 13 2933 1 1 9 ARG HD3 H 9.455 -4.441 0.148 1.00 . A A . 9 ARG HD3 1 1 13 2934 1 1 9 ARG HE H 10.228 -6.485 -1.597 1.00 . A A . 9 ARG HE 1 1 13 2935 1 1 9 ARG HG2 H 8.447 -4.733 -2.062 1.00 . A A . 9 ARG HG2 1 1 13 2936 1 1 9 ARG HG3 H 9.971 -4.270 -2.820 1.00 . A A . 9 ARG HG3 1 1 13 2937 1 1 9 ARG HH11 H 11.277 -5.021 1.392 1.00 . A A . 9 ARG HH11 1 1 13 2938 1 1 9 ARG HH12 H 12.010 -6.471 1.991 1.00 . A A . 9 ARG HH12 1 1 13 2939 1 1 9 ARG HH21 H 11.191 -8.394 -0.811 1.00 . A A . 9 ARG HH21 1 1 13 2940 1 1 9 ARG HH22 H 11.961 -8.387 0.740 1.00 . A A . 9 ARG HH22 1 1 13 2941 1 1 9 ARG N N 6.792 -3.125 -0.765 1.00 . A A . 9 ARG N 1 1 13 2942 1 1 9 ARG NE N 10.480 -5.989 -0.790 1.00 . A A . 9 ARG NE 1 1 13 2943 1 1 9 ARG NH1 N 11.508 -5.987 1.274 1.00 . A A . 9 ARG NH1 1 1 13 2944 1 1 9 ARG NH2 N 11.459 -7.907 0.021 1.00 . A A . 9 ARG NH2 1 1 13 2945 1 1 9 ARG O O 8.261 -0.160 0.264 1.00 . A A . 9 ARG O 1 1 13 2946 1 1 10 PRO C C 5.618 1.489 -0.434 1.00 . A A . 10 PRO C 1 1 13 2947 1 1 10 PRO CA C 6.579 1.104 -1.553 1.00 . A A . 10 PRO CA 1 1 13 2948 1 1 10 PRO CB C 5.914 1.290 -2.916 1.00 . A A . 10 PRO CB 1 1 13 2949 1 1 10 PRO CD C 6.241 -1.062 -2.621 1.00 . A A . 10 PRO CD 1 1 13 2950 1 1 10 PRO CG C 5.318 -0.038 -3.226 1.00 . A A . 10 PRO CG 1 1 13 2951 1 1 10 PRO HA H 7.465 1.719 -1.493 1.00 . A A . 10 PRO HA 1 1 13 2952 1 1 10 PRO HB2 H 5.158 2.059 -2.850 1.00 . A A . 10 PRO HB2 1 1 13 2953 1 1 10 PRO HB3 H 6.658 1.569 -3.648 1.00 . A A . 10 PRO HB3 1 1 13 2954 1 1 10 PRO HD2 H 5.673 -1.893 -2.232 1.00 . A A . 10 PRO HD2 1 1 13 2955 1 1 10 PRO HD3 H 6.955 -1.403 -3.355 1.00 . A A . 10 PRO HD3 1 1 13 2956 1 1 10 PRO HG2 H 4.336 -0.111 -2.783 1.00 . A A . 10 PRO HG2 1 1 13 2957 1 1 10 PRO HG3 H 5.259 -0.174 -4.296 1.00 . A A . 10 PRO HG3 1 1 13 2958 1 1 10 PRO N N 6.914 -0.323 -1.532 1.00 . A A . 10 PRO N 1 1 13 2959 1 1 10 PRO O O 4.402 1.494 -0.620 1.00 . A A . 10 PRO O 1 1 13 2960 1 1 11 SER C C 5.057 3.694 1.863 1.00 . A A . 11 SER C 1 1 13 2961 1 1 11 SER CA C 5.365 2.198 1.881 1.00 . A A . 11 SER CA 1 1 13 2962 1 1 11 SER CB C 6.083 1.829 3.180 1.00 . A A . 11 SER CB 1 1 13 2963 1 1 11 SER H H 7.148 1.788 0.817 1.00 . A A . 11 SER H 1 1 13 2964 1 1 11 SER HA H 4.435 1.653 1.829 1.00 . A A . 11 SER HA 1 1 13 2965 1 1 11 SER HB2 H 7.030 2.345 3.225 1.00 . A A . 11 SER HB2 1 1 13 2966 1 1 11 SER HB3 H 5.474 2.123 4.022 1.00 . A A . 11 SER HB3 1 1 13 2967 1 1 11 SER HG H 7.150 0.274 3.710 1.00 . A A . 11 SER HG 1 1 13 2968 1 1 11 SER N N 6.173 1.811 0.730 1.00 . A A . 11 SER N 1 1 13 2969 1 1 11 SER O O 4.134 4.154 2.535 1.00 . A A . 11 SER O 1 1 13 2970 1 1 11 SER OG O 6.321 0.434 3.254 1.00 . A A . 11 SER OG 1 1 13 2971 1 1 12 ILE C C 5.882 6.567 2.337 1.00 . A A . 12 ILE C 1 1 13 2972 1 1 12 ILE CA C 5.642 5.890 0.991 1.00 . A A . 12 ILE CA 1 1 13 2973 1 1 12 ILE CB C 4.221 6.233 0.494 1.00 . A A . 12 ILE CB 1 1 13 2974 1 1 12 ILE CD1 C 4.946 6.103 -1.944 1.00 . A A . 12 ILE CD1 1 1 13 2975 1 1 12 ILE CG1 C 3.980 5.617 -0.885 1.00 . A A . 12 ILE CG1 1 1 13 2976 1 1 12 ILE CG2 C 4.020 7.742 0.441 1.00 . A A . 12 ILE CG2 1 1 13 2977 1 1 12 ILE H H 6.555 4.027 0.581 1.00 . A A . 12 ILE H 1 1 13 2978 1 1 12 ILE HA H 6.355 6.271 0.274 1.00 . A A . 12 ILE HA 1 1 13 2979 1 1 12 ILE HB H 3.509 5.823 1.193 1.00 . A A . 12 ILE HB 1 1 13 2980 1 1 12 ILE HD11 H 5.505 5.265 -2.333 1.00 . A A . 12 ILE HD11 1 1 13 2981 1 1 12 ILE HD12 H 5.627 6.818 -1.507 1.00 . A A . 12 ILE HD12 1 1 13 2982 1 1 12 ILE HD13 H 4.396 6.573 -2.745 1.00 . A A . 12 ILE HD13 1 1 13 2983 1 1 12 ILE HG12 H 4.078 4.544 -0.816 1.00 . A A . 12 ILE HG12 1 1 13 2984 1 1 12 ILE HG13 H 2.979 5.862 -1.212 1.00 . A A . 12 ILE HG13 1 1 13 2985 1 1 12 ILE HG21 H 4.191 8.162 1.423 1.00 . A A . 12 ILE HG21 1 1 13 2986 1 1 12 ILE HG22 H 3.010 7.960 0.128 1.00 . A A . 12 ILE HG22 1 1 13 2987 1 1 12 ILE HG23 H 4.717 8.174 -0.262 1.00 . A A . 12 ILE HG23 1 1 13 2988 1 1 12 ILE N N 5.835 4.448 1.092 1.00 . A A . 12 ILE N 1 1 13 2989 1 1 12 ILE O O 5.697 5.899 3.376 1.00 . A A . 12 ILE O 1 1 13 2990 1 1 12 ILE OXT O 6.253 7.760 2.341 1.00 . A A . 12 ILE OXT 1 1 14 2991 1 1 1 HIS C C -4.531 3.081 5.212 1.00 . A A . 1 HIS C 1 1 14 2992 1 1 1 HIS CA C -3.694 3.957 6.142 1.00 . A A . 1 HIS CA 1 1 14 2993 1 1 1 HIS CB C -2.380 3.253 6.486 1.00 . A A . 1 HIS CB 1 1 14 2994 1 1 1 HIS CD2 C -0.973 3.813 8.593 1.00 . A A . 1 HIS CD2 1 1 14 2995 1 1 1 HIS CE1 C -0.218 5.773 7.961 1.00 . A A . 1 HIS CE1 1 1 14 2996 1 1 1 HIS CG C -1.476 4.066 7.361 1.00 . A A . 1 HIS CG 1 1 14 2997 1 1 1 HIS H1 H -4.356 3.402 8.009 1.00 . A A . 1 HIS H1 1 1 14 2998 1 1 1 HIS H2 H -5.410 4.458 7.160 1.00 . A A . 1 HIS H2 1 1 14 2999 1 1 1 HIS H3 H -3.962 5.063 7.855 1.00 . A A . 1 HIS H3 1 1 14 3000 1 1 1 HIS HA H -3.478 4.891 5.647 1.00 . A A . 1 HIS HA 1 1 14 3001 1 1 1 HIS HB2 H -2.599 2.331 7.003 1.00 . A A . 1 HIS HB2 1 1 14 3002 1 1 1 HIS HB3 H -1.848 3.031 5.573 1.00 . A A . 1 HIS HB3 1 1 14 3003 1 1 1 HIS HD1 H -1.171 5.765 6.150 1.00 . A A . 1 HIS HD1 1 1 14 3004 1 1 1 HIS HD2 H -1.151 2.930 9.189 1.00 . A A . 1 HIS HD2 1 1 14 3005 1 1 1 HIS HE1 H 0.301 6.719 7.951 1.00 . A A . 1 HIS HE1 1 1 14 3006 1 1 1 HIS HE2 H 0.230 5.026 9.815 1.00 . A A . 1 HIS HE2 1 1 14 3007 1 1 1 HIS N N -4.421 4.246 7.405 1.00 . A A . 1 HIS N 1 1 14 3008 1 1 1 HIS ND1 N -0.985 5.301 6.994 1.00 . A A . 1 HIS ND1 1 1 14 3009 1 1 1 HIS NE2 N -0.195 4.890 8.941 1.00 . A A . 1 HIS NE2 1 1 14 3010 1 1 1 HIS O O -5.422 2.360 5.661 1.00 . A A . 1 HIS O 1 1 14 3011 1 1 2 PRO C C -4.670 0.850 3.007 1.00 . A A . 2 PRO C 1 1 14 3012 1 1 2 PRO CA C -4.985 2.339 2.906 1.00 . A A . 2 PRO CA 1 1 14 3013 1 1 2 PRO CB C -4.497 2.900 1.569 1.00 . A A . 2 PRO CB 1 1 14 3014 1 1 2 PRO CD C -3.205 3.964 3.277 1.00 . A A . 2 PRO CD 1 1 14 3015 1 1 2 PRO CG C -3.146 3.455 1.863 1.00 . A A . 2 PRO CG 1 1 14 3016 1 1 2 PRO HA H -6.053 2.485 2.992 1.00 . A A . 2 PRO HA 1 1 14 3017 1 1 2 PRO HB2 H -4.448 2.105 0.839 1.00 . A A . 2 PRO HB2 1 1 14 3018 1 1 2 PRO HB3 H -5.173 3.669 1.229 1.00 . A A . 2 PRO HB3 1 1 14 3019 1 1 2 PRO HD2 H -2.256 3.818 3.771 1.00 . A A . 2 PRO HD2 1 1 14 3020 1 1 2 PRO HD3 H -3.483 5.007 3.292 1.00 . A A . 2 PRO HD3 1 1 14 3021 1 1 2 PRO HG2 H -2.402 2.676 1.776 1.00 . A A . 2 PRO HG2 1 1 14 3022 1 1 2 PRO HG3 H -2.924 4.263 1.183 1.00 . A A . 2 PRO HG3 1 1 14 3023 1 1 2 PRO N N -4.253 3.131 3.898 1.00 . A A . 2 PRO N 1 1 14 3024 1 1 2 PRO O O -3.612 0.399 2.569 1.00 . A A . 2 PRO O 1 1 14 3025 1 1 3 LEU C C -6.173 -2.127 2.677 1.00 . A A . 3 LEU C 1 1 14 3026 1 1 3 LEU CA C -5.414 -1.345 3.748 1.00 . A A . 3 LEU CA 1 1 14 3027 1 1 3 LEU CB C -5.850 -1.777 5.154 1.00 . A A . 3 LEU CB 1 1 14 3028 1 1 3 LEU CD1 C -8.280 -2.177 4.592 1.00 . A A . 3 LEU CD1 1 1 14 3029 1 1 3 LEU CD2 C -7.577 -1.861 6.971 1.00 . A A . 3 LEU CD2 1 1 14 3030 1 1 3 LEU CG C -7.306 -1.472 5.526 1.00 . A A . 3 LEU CG 1 1 14 3031 1 1 3 LEU H H -6.416 0.512 3.918 1.00 . A A . 3 LEU H 1 1 14 3032 1 1 3 LEU HA H -4.363 -1.551 3.638 1.00 . A A . 3 LEU HA 1 1 14 3033 1 1 3 LEU HB2 H -5.697 -2.842 5.241 1.00 . A A . 3 LEU HB2 1 1 14 3034 1 1 3 LEU HB3 H -5.211 -1.281 5.870 1.00 . A A . 3 LEU HB3 1 1 14 3035 1 1 3 LEU HD11 H -8.370 -1.617 3.674 1.00 . A A . 3 LEU HD11 1 1 14 3036 1 1 3 LEU HD12 H -9.247 -2.245 5.068 1.00 . A A . 3 LEU HD12 1 1 14 3037 1 1 3 LEU HD13 H -7.916 -3.170 4.375 1.00 . A A . 3 LEU HD13 1 1 14 3038 1 1 3 LEU HD21 H -7.703 -2.931 7.038 1.00 . A A . 3 LEU HD21 1 1 14 3039 1 1 3 LEU HD22 H -8.476 -1.370 7.313 1.00 . A A . 3 LEU HD22 1 1 14 3040 1 1 3 LEU HD23 H -6.745 -1.557 7.587 1.00 . A A . 3 LEU HD23 1 1 14 3041 1 1 3 LEU HG H -7.471 -0.410 5.431 1.00 . A A . 3 LEU HG 1 1 14 3042 1 1 3 LEU N N -5.593 0.093 3.588 1.00 . A A . 3 LEU N 1 1 14 3043 1 1 3 LEU O O -6.398 -3.330 2.818 1.00 . A A . 3 LEU O 1 1 14 3044 1 1 4 LYS C C -6.400 -2.289 -0.706 1.00 . A A . 4 LYS C 1 1 14 3045 1 1 4 LYS CA C -7.294 -2.079 0.516 1.00 . A A . 4 LYS CA 1 1 14 3046 1 1 4 LYS CB C -8.508 -1.232 0.131 1.00 . A A . 4 LYS CB 1 1 14 3047 1 1 4 LYS CD C -10.524 -0.939 -1.338 1.00 . A A . 4 LYS CD 1 1 14 3048 1 1 4 LYS CE C -11.353 -1.529 -2.468 1.00 . A A . 4 LYS CE 1 1 14 3049 1 1 4 LYS CG C -9.334 -1.823 -0.999 1.00 . A A . 4 LYS CG 1 1 14 3050 1 1 4 LYS H H -6.353 -0.487 1.544 1.00 . A A . 4 LYS H 1 1 14 3051 1 1 4 LYS HA H -7.634 -3.041 0.865 1.00 . A A . 4 LYS HA 1 1 14 3052 1 1 4 LYS HB2 H -9.145 -1.124 0.996 1.00 . A A . 4 LYS HB2 1 1 14 3053 1 1 4 LYS HB3 H -8.167 -0.253 -0.175 1.00 . A A . 4 LYS HB3 1 1 14 3054 1 1 4 LYS HD2 H -11.149 -0.840 -0.462 1.00 . A A . 4 LYS HD2 1 1 14 3055 1 1 4 LYS HD3 H -10.164 0.033 -1.638 1.00 . A A . 4 LYS HD3 1 1 14 3056 1 1 4 LYS HE2 H -10.727 -1.632 -3.342 1.00 . A A . 4 LYS HE2 1 1 14 3057 1 1 4 LYS HE3 H -11.709 -2.503 -2.166 1.00 . A A . 4 LYS HE3 1 1 14 3058 1 1 4 LYS HG2 H -8.711 -1.923 -1.875 1.00 . A A . 4 LYS HG2 1 1 14 3059 1 1 4 LYS HG3 H -9.695 -2.796 -0.697 1.00 . A A . 4 LYS HG3 1 1 14 3060 1 1 4 LYS HZ1 H -12.815 -0.121 -1.975 1.00 . A A . 4 LYS HZ1 1 1 14 3061 1 1 4 LYS HZ2 H -13.319 -1.258 -3.122 1.00 . A A . 4 LYS HZ2 1 1 14 3062 1 1 4 LYS HZ3 H -12.269 -0.011 -3.573 1.00 . A A . 4 LYS HZ3 1 1 14 3063 1 1 4 LYS N N -6.562 -1.442 1.605 1.00 . A A . 4 LYS N 1 1 14 3064 1 1 4 LYS NZ N -12.520 -0.669 -2.809 1.00 . A A . 4 LYS NZ 1 1 14 3065 1 1 4 LYS O O -6.730 -3.069 -1.599 1.00 . A A . 4 LYS O 1 1 14 3066 1 1 5 GLN C C -3.278 -2.767 -1.589 1.00 . A A . 5 GLN C 1 1 14 3067 1 1 5 GLN CA C -4.336 -1.699 -1.856 1.00 . A A . 5 GLN CA 1 1 14 3068 1 1 5 GLN CB C -3.663 -0.351 -2.117 1.00 . A A . 5 GLN CB 1 1 14 3069 1 1 5 GLN CD C -2.018 0.971 -3.506 1.00 . A A . 5 GLN CD 1 1 14 3070 1 1 5 GLN CG C -2.670 -0.377 -3.269 1.00 . A A . 5 GLN CG 1 1 14 3071 1 1 5 GLN H H -5.061 -0.981 -0.002 1.00 . A A . 5 GLN H 1 1 14 3072 1 1 5 GLN HA H -4.901 -1.984 -2.729 1.00 . A A . 5 GLN HA 1 1 14 3073 1 1 5 GLN HB2 H -4.424 0.380 -2.345 1.00 . A A . 5 GLN HB2 1 1 14 3074 1 1 5 GLN HB3 H -3.138 -0.045 -1.225 1.00 . A A . 5 GLN HB3 1 1 14 3075 1 1 5 GLN HE21 H -0.222 0.188 -3.165 1.00 . A A . 5 GLN HE21 1 1 14 3076 1 1 5 GLN HE22 H -0.246 1.874 -3.540 1.00 . A A . 5 GLN HE22 1 1 14 3077 1 1 5 GLN HG2 H -1.899 -1.098 -3.046 1.00 . A A . 5 GLN HG2 1 1 14 3078 1 1 5 GLN HG3 H -3.190 -0.672 -4.169 1.00 . A A . 5 GLN HG3 1 1 14 3079 1 1 5 GLN N N -5.271 -1.588 -0.740 1.00 . A A . 5 GLN N 1 1 14 3080 1 1 5 GLN NE2 N -0.695 1.016 -3.392 1.00 . A A . 5 GLN NE2 1 1 14 3081 1 1 5 GLN O O -2.643 -3.268 -2.516 1.00 . A A . 5 GLN O 1 1 14 3082 1 1 5 GLN OE1 O -2.693 1.960 -3.788 1.00 . A A . 5 GLN OE1 1 1 14 3083 1 1 6 TYR C C -0.706 -3.691 -0.365 1.00 . A A . 6 TYR C 1 1 14 3084 1 1 6 TYR CA C -2.108 -4.117 0.062 1.00 . A A . 6 TYR CA 1 1 14 3085 1 1 6 TYR CB C -2.457 -5.471 -0.564 1.00 . A A . 6 TYR CB 1 1 14 3086 1 1 6 TYR CD1 C -4.641 -5.339 0.728 1.00 . A A . 6 TYR CD1 1 1 14 3087 1 1 6 TYR CD2 C -4.253 -7.245 -0.653 1.00 . A A . 6 TYR CD2 1 1 14 3088 1 1 6 TYR CE1 C -5.870 -5.854 1.096 1.00 . A A . 6 TYR CE1 1 1 14 3089 1 1 6 TYR CE2 C -5.481 -7.764 -0.287 1.00 . A A . 6 TYR CE2 1 1 14 3090 1 1 6 TYR CG C -3.809 -6.025 -0.154 1.00 . A A . 6 TYR CG 1 1 14 3091 1 1 6 TYR CZ C -6.284 -7.064 0.586 1.00 . A A . 6 TYR CZ 1 1 14 3092 1 1 6 TYR H H -3.626 -2.676 0.376 1.00 . A A . 6 TYR H 1 1 14 3093 1 1 6 TYR HA H -2.130 -4.211 1.138 1.00 . A A . 6 TYR HA 1 1 14 3094 1 1 6 TYR HB2 H -2.458 -5.370 -1.638 1.00 . A A . 6 TYR HB2 1 1 14 3095 1 1 6 TYR HB3 H -1.705 -6.192 -0.280 1.00 . A A . 6 TYR HB3 1 1 14 3096 1 1 6 TYR HD1 H -4.316 -4.391 1.128 1.00 . A A . 6 TYR HD1 1 1 14 3097 1 1 6 TYR HD2 H -3.621 -7.791 -1.339 1.00 . A A . 6 TYR HD2 1 1 14 3098 1 1 6 TYR HE1 H -6.500 -5.306 1.781 1.00 . A A . 6 TYR HE1 1 1 14 3099 1 1 6 TYR HE2 H -5.804 -8.714 -0.687 1.00 . A A . 6 TYR HE2 1 1 14 3100 1 1 6 TYR HH H -7.419 -8.057 1.780 1.00 . A A . 6 TYR HH 1 1 14 3101 1 1 6 TYR N N -3.092 -3.111 -0.320 1.00 . A A . 6 TYR N 1 1 14 3102 1 1 6 TYR O O -0.164 -4.200 -1.347 1.00 . A A . 6 TYR O 1 1 14 3103 1 1 6 TYR OH O -7.507 -7.579 0.952 1.00 . A A . 6 TYR OH 1 1 14 3104 1 1 7 TRP C C 2.272 -3.289 0.434 1.00 . A A . 7 TRP C 1 1 14 3105 1 1 7 TRP CA C 1.210 -2.255 0.074 1.00 . A A . 7 TRP CA 1 1 14 3106 1 1 7 TRP CB C 1.473 -0.956 0.838 1.00 . A A . 7 TRP CB 1 1 14 3107 1 1 7 TRP CD1 C 2.152 -1.936 3.106 1.00 . A A . 7 TRP CD1 1 1 14 3108 1 1 7 TRP CD2 C 0.491 -0.438 3.211 1.00 . A A . 7 TRP CD2 1 1 14 3109 1 1 7 TRP CE2 C 0.766 -0.897 4.514 1.00 . A A . 7 TRP CE2 1 1 14 3110 1 1 7 TRP CE3 C -0.519 0.511 3.030 1.00 . A A . 7 TRP CE3 1 1 14 3111 1 1 7 TRP CG C 1.390 -1.115 2.324 1.00 . A A . 7 TRP CG 1 1 14 3112 1 1 7 TRP CH2 C -0.915 0.492 5.421 1.00 . A A . 7 TRP CH2 1 1 14 3113 1 1 7 TRP CZ2 C 0.068 -0.438 5.627 1.00 . A A . 7 TRP CZ2 1 1 14 3114 1 1 7 TRP CZ3 C -1.211 0.966 4.138 1.00 . A A . 7 TRP CZ3 1 1 14 3115 1 1 7 TRP H H -0.612 -2.385 1.144 1.00 . A A . 7 TRP H 1 1 14 3116 1 1 7 TRP HA H 1.259 -2.057 -0.986 1.00 . A A . 7 TRP HA 1 1 14 3117 1 1 7 TRP HB2 H 2.463 -0.597 0.595 1.00 . A A . 7 TRP HB2 1 1 14 3118 1 1 7 TRP HB3 H 0.745 -0.216 0.539 1.00 . A A . 7 TRP HB3 1 1 14 3119 1 1 7 TRP HD1 H 2.929 -2.584 2.729 1.00 . A A . 7 TRP HD1 1 1 14 3120 1 1 7 TRP HE1 H 2.184 -2.294 5.175 1.00 . A A . 7 TRP HE1 1 1 14 3121 1 1 7 TRP HE3 H -0.761 0.889 2.049 1.00 . A A . 7 TRP HE3 1 1 14 3122 1 1 7 TRP HH2 H -1.482 0.873 6.257 1.00 . A A . 7 TRP HH2 1 1 14 3123 1 1 7 TRP HZ2 H 0.285 -0.793 6.624 1.00 . A A . 7 TRP HZ2 1 1 14 3124 1 1 7 TRP HZ3 H -1.995 1.699 4.017 1.00 . A A . 7 TRP HZ3 1 1 14 3125 1 1 7 TRP N N -0.127 -2.753 0.376 1.00 . A A . 7 TRP N 1 1 14 3126 1 1 7 TRP NE1 N 1.784 -1.810 4.423 1.00 . A A . 7 TRP NE1 1 1 14 3127 1 1 7 TRP O O 1.954 -4.402 0.852 1.00 . A A . 7 TRP O 1 1 14 3128 1 1 8 TRP C C 5.904 -2.948 0.823 1.00 . A A . 8 TRP C 1 1 14 3129 1 1 8 TRP CA C 4.648 -3.797 0.585 1.00 . A A . 8 TRP CA 1 1 14 3130 1 1 8 TRP CB C 4.858 -4.787 -0.568 1.00 . A A . 8 TRP CB 1 1 14 3131 1 1 8 TRP CD1 C 6.350 -6.754 -1.233 1.00 . A A . 8 TRP CD1 1 1 14 3132 1 1 8 TRP CD2 C 6.688 -6.047 0.867 1.00 . A A . 8 TRP CD2 1 1 14 3133 1 1 8 TRP CE2 C 7.560 -7.124 0.604 1.00 . A A . 8 TRP CE2 1 1 14 3134 1 1 8 TRP CE3 C 6.724 -5.456 2.138 1.00 . A A . 8 TRP CE3 1 1 14 3135 1 1 8 TRP CG C 5.944 -5.802 -0.342 1.00 . A A . 8 TRP CG 1 1 14 3136 1 1 8 TRP CH2 C 8.453 -7.023 2.786 1.00 . A A . 8 TRP CH2 1 1 14 3137 1 1 8 TRP CZ2 C 8.447 -7.618 1.556 1.00 . A A . 8 TRP CZ2 1 1 14 3138 1 1 8 TRP CZ3 C 7.603 -5.953 3.082 1.00 . A A . 8 TRP CZ3 1 1 14 3139 1 1 8 TRP H H 3.724 -2.006 -0.060 1.00 . A A . 8 TRP H 1 1 14 3140 1 1 8 TRP HA H 4.411 -4.337 1.484 1.00 . A A . 8 TRP HA 1 1 14 3141 1 1 8 TRP HB2 H 3.938 -5.327 -0.731 1.00 . A A . 8 TRP HB2 1 1 14 3142 1 1 8 TRP HB3 H 5.100 -4.234 -1.464 1.00 . A A . 8 TRP HB3 1 1 14 3143 1 1 8 TRP HD1 H 5.966 -6.846 -2.239 1.00 . A A . 8 TRP HD1 1 1 14 3144 1 1 8 TRP HE1 H 7.809 -8.260 -1.140 1.00 . A A . 8 TRP HE1 1 1 14 3145 1 1 8 TRP HE3 H 6.076 -4.634 2.392 1.00 . A A . 8 TRP HE3 1 1 14 3146 1 1 8 TRP HH2 H 9.122 -7.378 3.556 1.00 . A A . 8 TRP HH2 1 1 14 3147 1 1 8 TRP HZ2 H 9.111 -8.443 1.344 1.00 . A A . 8 TRP HZ2 1 1 14 3148 1 1 8 TRP HZ3 H 7.638 -5.511 4.067 1.00 . A A . 8 TRP HZ3 1 1 14 3149 1 1 8 TRP N N 3.536 -2.908 0.273 1.00 . A A . 8 TRP N 1 1 14 3150 1 1 8 TRP NE1 N 7.341 -7.528 -0.685 1.00 . A A . 8 TRP NE1 1 1 14 3151 1 1 8 TRP O O 6.101 -2.416 1.916 1.00 . A A . 8 TRP O 1 1 14 3152 1 1 9 ARG C C 7.690 -0.545 -0.554 1.00 . A A . 9 ARG C 1 1 14 3153 1 1 9 ARG CA C 7.945 -1.988 -0.111 1.00 . A A . 9 ARG CA 1 1 14 3154 1 1 9 ARG CB C 9.082 -2.597 -0.938 1.00 . A A . 9 ARG CB 1 1 14 3155 1 1 9 ARG CD C 10.015 -3.952 0.950 1.00 . A A . 9 ARG CD 1 1 14 3156 1 1 9 ARG CG C 9.507 -3.982 -0.483 1.00 . A A . 9 ARG CG 1 1 14 3157 1 1 9 ARG CZ C 10.934 -5.498 2.632 1.00 . A A . 9 ARG CZ 1 1 14 3158 1 1 9 ARG H H 6.518 -3.230 -1.054 1.00 . A A . 9 ARG H 1 1 14 3159 1 1 9 ARG HA H 8.243 -1.975 0.927 1.00 . A A . 9 ARG HA 1 1 14 3160 1 1 9 ARG HB2 H 8.768 -2.665 -1.968 1.00 . A A . 9 ARG HB2 1 1 14 3161 1 1 9 ARG HB3 H 9.941 -1.945 -0.878 1.00 . A A . 9 ARG HB3 1 1 14 3162 1 1 9 ARG HD2 H 10.852 -3.273 1.006 1.00 . A A . 9 ARG HD2 1 1 14 3163 1 1 9 ARG HD3 H 9.221 -3.595 1.592 1.00 . A A . 9 ARG HD3 1 1 14 3164 1 1 9 ARG HE H 10.361 -6.019 0.791 1.00 . A A . 9 ARG HE 1 1 14 3165 1 1 9 ARG HG2 H 8.658 -4.647 -0.542 1.00 . A A . 9 ARG HG2 1 1 14 3166 1 1 9 ARG HG3 H 10.295 -4.340 -1.129 1.00 . A A . 9 ARG HG3 1 1 14 3167 1 1 9 ARG HH11 H 10.792 -3.576 3.248 1.00 . A A . 9 ARG HH11 1 1 14 3168 1 1 9 ARG HH12 H 11.432 -4.684 4.415 1.00 . A A . 9 ARG HH12 1 1 14 3169 1 1 9 ARG HH21 H 11.203 -7.478 2.327 1.00 . A A . 9 ARG HH21 1 1 14 3170 1 1 9 ARG HH22 H 11.665 -6.898 3.892 1.00 . A A . 9 ARG HH22 1 1 14 3171 1 1 9 ARG N N 6.733 -2.800 -0.207 1.00 . A A . 9 ARG N 1 1 14 3172 1 1 9 ARG NE N 10.444 -5.268 1.415 1.00 . A A . 9 ARG NE 1 1 14 3173 1 1 9 ARG NH1 N 11.064 -4.504 3.503 1.00 . A A . 9 ARG NH1 1 1 14 3174 1 1 9 ARG NH2 N 11.298 -6.725 2.979 1.00 . A A . 9 ARG NH2 1 1 14 3175 1 1 9 ARG O O 8.069 0.396 0.143 1.00 . A A . 9 ARG O 1 1 14 3176 1 1 10 PRO C C 5.459 1.567 -1.669 1.00 . A A . 10 PRO C 1 1 14 3177 1 1 10 PRO CA C 6.755 0.997 -2.233 1.00 . A A . 10 PRO CA 1 1 14 3178 1 1 10 PRO CB C 6.625 0.755 -3.733 1.00 . A A . 10 PRO CB 1 1 14 3179 1 1 10 PRO CD C 6.548 -1.388 -2.637 1.00 . A A . 10 PRO CD 1 1 14 3180 1 1 10 PRO CG C 6.054 -0.618 -3.840 1.00 . A A . 10 PRO CG 1 1 14 3181 1 1 10 PRO HA H 7.568 1.682 -2.043 1.00 . A A . 10 PRO HA 1 1 14 3182 1 1 10 PRO HB2 H 5.966 1.494 -4.164 1.00 . A A . 10 PRO HB2 1 1 14 3183 1 1 10 PRO HB3 H 7.598 0.815 -4.198 1.00 . A A . 10 PRO HB3 1 1 14 3184 1 1 10 PRO HD2 H 5.735 -1.937 -2.187 1.00 . A A . 10 PRO HD2 1 1 14 3185 1 1 10 PRO HD3 H 7.342 -2.059 -2.924 1.00 . A A . 10 PRO HD3 1 1 14 3186 1 1 10 PRO HG2 H 4.976 -0.567 -3.832 1.00 . A A . 10 PRO HG2 1 1 14 3187 1 1 10 PRO HG3 H 6.399 -1.087 -4.749 1.00 . A A . 10 PRO HG3 1 1 14 3188 1 1 10 PRO N N 7.045 -0.341 -1.721 1.00 . A A . 10 PRO N 1 1 14 3189 1 1 10 PRO O O 4.384 1.367 -2.234 1.00 . A A . 10 PRO O 1 1 14 3190 1 1 11 SER C C 3.994 4.165 -0.624 1.00 . A A . 11 SER C 1 1 14 3191 1 1 11 SER CA C 4.402 2.878 0.088 1.00 . A A . 11 SER CA 1 1 14 3192 1 1 11 SER CB C 4.694 3.163 1.562 1.00 . A A . 11 SER CB 1 1 14 3193 1 1 11 SER H H 6.451 2.403 -0.148 1.00 . A A . 11 SER H 1 1 14 3194 1 1 11 SER HA H 3.588 2.171 0.021 1.00 . A A . 11 SER HA 1 1 14 3195 1 1 11 SER HB2 H 5.527 3.845 1.637 1.00 . A A . 11 SER HB2 1 1 14 3196 1 1 11 SER HB3 H 3.822 3.608 2.020 1.00 . A A . 11 SER HB3 1 1 14 3197 1 1 11 SER HG H 5.621 1.445 1.731 1.00 . A A . 11 SER HG 1 1 14 3198 1 1 11 SER N N 5.567 2.278 -0.552 1.00 . A A . 11 SER N 1 1 14 3199 1 1 11 SER O O 4.095 5.257 -0.063 1.00 . A A . 11 SER O 1 1 14 3200 1 1 11 SER OG O 5.016 1.972 2.259 1.00 . A A . 11 SER OG 1 1 14 3201 1 1 12 ILE C C 1.611 5.120 -2.943 1.00 . A A . 12 ILE C 1 1 14 3202 1 1 12 ILE CA C 3.109 5.179 -2.654 1.00 . A A . 12 ILE CA 1 1 14 3203 1 1 12 ILE CB C 3.883 5.258 -3.986 1.00 . A A . 12 ILE CB 1 1 14 3204 1 1 12 ILE CD1 C 5.756 6.612 -2.920 1.00 . A A . 12 ILE CD1 1 1 14 3205 1 1 12 ILE CG1 C 5.384 5.382 -3.720 1.00 . A A . 12 ILE CG1 1 1 14 3206 1 1 12 ILE CG2 C 3.393 6.432 -4.825 1.00 . A A . 12 ILE CG2 1 1 14 3207 1 1 12 ILE H H 3.476 3.133 -2.256 1.00 . A A . 12 ILE H 1 1 14 3208 1 1 12 ILE HA H 3.320 6.073 -2.084 1.00 . A A . 12 ILE HA 1 1 14 3209 1 1 12 ILE HB H 3.697 4.350 -4.540 1.00 . A A . 12 ILE HB 1 1 14 3210 1 1 12 ILE HD11 H 6.175 6.311 -1.971 1.00 . A A . 12 ILE HD11 1 1 14 3211 1 1 12 ILE HD12 H 4.874 7.212 -2.750 1.00 . A A . 12 ILE HD12 1 1 14 3212 1 1 12 ILE HD13 H 6.485 7.191 -3.467 1.00 . A A . 12 ILE HD13 1 1 14 3213 1 1 12 ILE HG12 H 5.719 4.517 -3.170 1.00 . A A . 12 ILE HG12 1 1 14 3214 1 1 12 ILE HG13 H 5.909 5.429 -4.664 1.00 . A A . 12 ILE HG13 1 1 14 3215 1 1 12 ILE HG21 H 4.222 6.850 -5.377 1.00 . A A . 12 ILE HG21 1 1 14 3216 1 1 12 ILE HG22 H 2.975 7.188 -4.176 1.00 . A A . 12 ILE HG22 1 1 14 3217 1 1 12 ILE HG23 H 2.637 6.090 -5.516 1.00 . A A . 12 ILE HG23 1 1 14 3218 1 1 12 ILE N N 3.533 4.029 -1.863 1.00 . A A . 12 ILE N 1 1 14 3219 1 1 12 ILE O O 0.903 6.087 -2.593 1.00 . A A . 12 ILE O 1 1 14 3220 1 1 12 ILE OXT O 1.161 4.106 -3.517 1.00 . A A . 12 ILE OXT 1 1 15 3221 1 1 1 HIS C C -4.770 4.097 -0.665 1.00 . A A . 1 HIS C 1 1 15 3222 1 1 1 HIS CA C -4.623 5.613 -0.770 1.00 . A A . 1 HIS CA 1 1 15 3223 1 1 1 HIS CB C -5.476 6.301 0.298 1.00 . A A . 1 HIS CB 1 1 15 3224 1 1 1 HIS CD2 C -6.279 8.761 0.109 1.00 . A A . 1 HIS CD2 1 1 15 3225 1 1 1 HIS CE1 C -4.352 9.752 0.443 1.00 . A A . 1 HIS CE1 1 1 15 3226 1 1 1 HIS CG C -5.350 7.793 0.296 1.00 . A A . 1 HIS CG 1 1 15 3227 1 1 1 HIS H1 H -4.729 7.088 -2.200 1.00 . A A . 1 HIS H1 1 1 15 3228 1 1 1 HIS H2 H -6.089 6.043 -2.149 1.00 . A A . 1 HIS H2 1 1 15 3229 1 1 1 HIS H3 H -4.609 5.497 -2.825 1.00 . A A . 1 HIS H3 1 1 15 3230 1 1 1 HIS HA H -3.587 5.878 -0.623 1.00 . A A . 1 HIS HA 1 1 15 3231 1 1 1 HIS HB2 H -6.513 6.056 0.133 1.00 . A A . 1 HIS HB2 1 1 15 3232 1 1 1 HIS HB3 H -5.177 5.943 1.272 1.00 . A A . 1 HIS HB3 1 1 15 3233 1 1 1 HIS HD1 H -3.288 8.020 0.668 1.00 . A A . 1 HIS HD1 1 1 15 3234 1 1 1 HIS HD2 H -7.332 8.610 -0.081 1.00 . A A . 1 HIS HD2 1 1 15 3235 1 1 1 HIS HE1 H -3.596 10.513 0.567 1.00 . A A . 1 HIS HE1 1 1 15 3236 1 1 1 HIS HE2 H -6.032 10.843 0.015 1.00 . A A . 1 HIS HE2 1 1 15 3237 1 1 1 HIS N N -5.051 6.104 -2.107 1.00 . A A . 1 HIS N 1 1 15 3238 1 1 1 HIS ND1 N -4.154 8.448 0.501 1.00 . A A . 1 HIS ND1 1 1 15 3239 1 1 1 HIS NE2 N -5.634 9.969 0.205 1.00 . A A . 1 HIS NE2 1 1 15 3240 1 1 1 HIS O O -5.640 3.504 -1.304 1.00 . A A . 1 HIS O 1 1 15 3241 1 1 2 PRO C C -5.104 1.554 1.225 1.00 . A A . 2 PRO C 1 1 15 3242 1 1 2 PRO CA C -3.952 1.995 0.331 1.00 . A A . 2 PRO CA 1 1 15 3243 1 1 2 PRO CB C -2.612 1.700 1.003 1.00 . A A . 2 PRO CB 1 1 15 3244 1 1 2 PRO CD C -2.846 4.082 0.942 1.00 . A A . 2 PRO CD 1 1 15 3245 1 1 2 PRO CG C -2.295 2.944 1.759 1.00 . A A . 2 PRO CG 1 1 15 3246 1 1 2 PRO HA H -4.008 1.475 -0.614 1.00 . A A . 2 PRO HA 1 1 15 3247 1 1 2 PRO HB2 H -2.715 0.850 1.662 1.00 . A A . 2 PRO HB2 1 1 15 3248 1 1 2 PRO HB3 H -1.865 1.494 0.251 1.00 . A A . 2 PRO HB3 1 1 15 3249 1 1 2 PRO HD2 H -3.250 4.848 1.587 1.00 . A A . 2 PRO HD2 1 1 15 3250 1 1 2 PRO HD3 H -2.080 4.492 0.301 1.00 . A A . 2 PRO HD3 1 1 15 3251 1 1 2 PRO HG2 H -2.770 2.915 2.730 1.00 . A A . 2 PRO HG2 1 1 15 3252 1 1 2 PRO HG3 H -1.226 3.045 1.867 1.00 . A A . 2 PRO HG3 1 1 15 3253 1 1 2 PRO N N -3.916 3.449 0.144 1.00 . A A . 2 PRO N 1 1 15 3254 1 1 2 PRO O O -5.001 1.596 2.451 1.00 . A A . 2 PRO O 1 1 15 3255 1 1 3 LEU C C -7.680 -0.789 1.098 1.00 . A A . 3 LEU C 1 1 15 3256 1 1 3 LEU CA C -7.374 0.686 1.352 1.00 . A A . 3 LEU CA 1 1 15 3257 1 1 3 LEU CB C -8.586 1.564 1.011 1.00 . A A . 3 LEU CB 1 1 15 3258 1 1 3 LEU CD1 C -9.389 0.210 -0.966 1.00 . A A . 3 LEU CD1 1 1 15 3259 1 1 3 LEU CD2 C -10.143 2.575 -0.675 1.00 . A A . 3 LEU CD2 1 1 15 3260 1 1 3 LEU CG C -9.000 1.593 -0.465 1.00 . A A . 3 LEU CG 1 1 15 3261 1 1 3 LEU H H -6.226 1.124 -0.373 1.00 . A A . 3 LEU H 1 1 15 3262 1 1 3 LEU HA H -7.151 0.807 2.398 1.00 . A A . 3 LEU HA 1 1 15 3263 1 1 3 LEU HB2 H -9.427 1.212 1.588 1.00 . A A . 3 LEU HB2 1 1 15 3264 1 1 3 LEU HB3 H -8.362 2.576 1.316 1.00 . A A . 3 LEU HB3 1 1 15 3265 1 1 3 LEU HD11 H -8.529 -0.266 -1.413 1.00 . A A . 3 LEU HD11 1 1 15 3266 1 1 3 LEU HD12 H -10.171 0.301 -1.704 1.00 . A A . 3 LEU HD12 1 1 15 3267 1 1 3 LEU HD13 H -9.742 -0.388 -0.139 1.00 . A A . 3 LEU HD13 1 1 15 3268 1 1 3 LEU HD21 H -9.742 3.568 -0.813 1.00 . A A . 3 LEU HD21 1 1 15 3269 1 1 3 LEU HD22 H -10.790 2.564 0.189 1.00 . A A . 3 LEU HD22 1 1 15 3270 1 1 3 LEU HD23 H -10.707 2.289 -1.551 1.00 . A A . 3 LEU HD23 1 1 15 3271 1 1 3 LEU HG H -8.160 1.931 -1.052 1.00 . A A . 3 LEU HG 1 1 15 3272 1 1 3 LEU N N -6.203 1.133 0.606 1.00 . A A . 3 LEU N 1 1 15 3273 1 1 3 LEU O O -8.419 -1.416 1.858 1.00 . A A . 3 LEU O 1 1 15 3274 1 1 4 LYS C C -6.057 -3.447 -0.745 1.00 . A A . 4 LYS C 1 1 15 3275 1 1 4 LYS CA C -7.345 -2.743 -0.313 1.00 . A A . 4 LYS CA 1 1 15 3276 1 1 4 LYS CB C -8.392 -2.848 -1.424 1.00 . A A . 4 LYS CB 1 1 15 3277 1 1 4 LYS CD C -9.740 -4.326 -2.945 1.00 . A A . 4 LYS CD 1 1 15 3278 1 1 4 LYS CE C -10.044 -5.755 -3.364 1.00 . A A . 4 LYS CE 1 1 15 3279 1 1 4 LYS CG C -8.696 -4.279 -1.841 1.00 . A A . 4 LYS CG 1 1 15 3280 1 1 4 LYS H H -6.542 -0.796 -0.547 1.00 . A A . 4 LYS H 1 1 15 3281 1 1 4 LYS HA H -7.725 -3.234 0.568 1.00 . A A . 4 LYS HA 1 1 15 3282 1 1 4 LYS HB2 H -9.311 -2.394 -1.081 1.00 . A A . 4 LYS HB2 1 1 15 3283 1 1 4 LYS HB3 H -8.037 -2.310 -2.290 1.00 . A A . 4 LYS HB3 1 1 15 3284 1 1 4 LYS HD2 H -10.649 -3.865 -2.587 1.00 . A A . 4 LYS HD2 1 1 15 3285 1 1 4 LYS HD3 H -9.370 -3.780 -3.801 1.00 . A A . 4 LYS HD3 1 1 15 3286 1 1 4 LYS HE2 H -9.134 -6.215 -3.717 1.00 . A A . 4 LYS HE2 1 1 15 3287 1 1 4 LYS HE3 H -10.410 -6.298 -2.504 1.00 . A A . 4 LYS HE3 1 1 15 3288 1 1 4 LYS HG2 H -7.788 -4.739 -2.201 1.00 . A A . 4 LYS HG2 1 1 15 3289 1 1 4 LYS HG3 H -9.065 -4.823 -0.985 1.00 . A A . 4 LYS HG3 1 1 15 3290 1 1 4 LYS HZ1 H -11.078 -4.916 -4.973 1.00 . A A . 4 LYS HZ1 1 1 15 3291 1 1 4 LYS HZ2 H -12.009 -5.971 -4.036 1.00 . A A . 4 LYS HZ2 1 1 15 3292 1 1 4 LYS HZ3 H -10.849 -6.588 -5.101 1.00 . A A . 4 LYS HZ3 1 1 15 3293 1 1 4 LYS N N -7.116 -1.341 0.027 1.00 . A A . 4 LYS N 1 1 15 3294 1 1 4 LYS NZ N -11.066 -5.812 -4.444 1.00 . A A . 4 LYS NZ 1 1 15 3295 1 1 4 LYS O O -6.011 -4.675 -0.812 1.00 . A A . 4 LYS O 1 1 15 3296 1 1 5 GLN C C -2.733 -3.258 -0.327 1.00 . A A . 5 GLN C 1 1 15 3297 1 1 5 GLN CA C -3.743 -3.250 -1.469 1.00 . A A . 5 GLN CA 1 1 15 3298 1 1 5 GLN CB C -3.181 -2.471 -2.661 1.00 . A A . 5 GLN CB 1 1 15 3299 1 1 5 GLN CD C -1.316 -2.224 -4.349 1.00 . A A . 5 GLN CD 1 1 15 3300 1 1 5 GLN CG C -1.852 -3.010 -3.168 1.00 . A A . 5 GLN CG 1 1 15 3301 1 1 5 GLN H H -5.101 -1.704 -0.976 1.00 . A A . 5 GLN H 1 1 15 3302 1 1 5 GLN HA H -3.928 -4.264 -1.769 1.00 . A A . 5 GLN HA 1 1 15 3303 1 1 5 GLN HB2 H -3.894 -2.513 -3.471 1.00 . A A . 5 GLN HB2 1 1 15 3304 1 1 5 GLN HB3 H -3.040 -1.441 -2.370 1.00 . A A . 5 GLN HB3 1 1 15 3305 1 1 5 GLN HE21 H 0.326 -1.761 -3.330 1.00 . A A . 5 GLN HE21 1 1 15 3306 1 1 5 GLN HE22 H 0.238 -1.134 -4.938 1.00 . A A . 5 GLN HE22 1 1 15 3307 1 1 5 GLN HG2 H -1.129 -2.961 -2.368 1.00 . A A . 5 GLN HG2 1 1 15 3308 1 1 5 GLN HG3 H -1.986 -4.038 -3.469 1.00 . A A . 5 GLN HG3 1 1 15 3309 1 1 5 GLN N N -5.015 -2.675 -1.042 1.00 . A A . 5 GLN N 1 1 15 3310 1 1 5 GLN NE2 N -0.131 -1.649 -4.189 1.00 . A A . 5 GLN NE2 1 1 15 3311 1 1 5 GLN O O -1.866 -4.129 -0.256 1.00 . A A . 5 GLN O 1 1 15 3312 1 1 5 GLN OE1 O -1.961 -2.137 -5.395 1.00 . A A . 5 GLN OE1 1 1 15 3313 1 1 6 TYR C C -0.498 -2.122 1.253 1.00 . A A . 6 TYR C 1 1 15 3314 1 1 6 TYR CA C -1.954 -2.172 1.706 1.00 . A A . 6 TYR CA 1 1 15 3315 1 1 6 TYR CB C -2.161 -3.350 2.664 1.00 . A A . 6 TYR CB 1 1 15 3316 1 1 6 TYR CD1 C -4.557 -2.540 2.913 1.00 . A A . 6 TYR CD1 1 1 15 3317 1 1 6 TYR CD2 C -3.886 -4.486 4.117 1.00 . A A . 6 TYR CD2 1 1 15 3318 1 1 6 TYR CE1 C -5.828 -2.645 3.444 1.00 . A A . 6 TYR CE1 1 1 15 3319 1 1 6 TYR CE2 C -5.155 -4.597 4.651 1.00 . A A . 6 TYR CE2 1 1 15 3320 1 1 6 TYR CG C -3.562 -3.459 3.239 1.00 . A A . 6 TYR CG 1 1 15 3321 1 1 6 TYR CZ C -6.122 -3.676 4.311 1.00 . A A . 6 TYR CZ 1 1 15 3322 1 1 6 TYR H H -3.567 -1.624 0.445 1.00 . A A . 6 TYR H 1 1 15 3323 1 1 6 TYR HA H -2.190 -1.254 2.224 1.00 . A A . 6 TYR HA 1 1 15 3324 1 1 6 TYR HB2 H -1.951 -4.269 2.138 1.00 . A A . 6 TYR HB2 1 1 15 3325 1 1 6 TYR HB3 H -1.472 -3.253 3.491 1.00 . A A . 6 TYR HB3 1 1 15 3326 1 1 6 TYR HD1 H -4.326 -1.733 2.235 1.00 . A A . 6 TYR HD1 1 1 15 3327 1 1 6 TYR HD2 H -3.127 -5.208 4.381 1.00 . A A . 6 TYR HD2 1 1 15 3328 1 1 6 TYR HE1 H -6.586 -1.923 3.178 1.00 . A A . 6 TYR HE1 1 1 15 3329 1 1 6 TYR HE2 H -5.386 -5.404 5.331 1.00 . A A . 6 TYR HE2 1 1 15 3330 1 1 6 TYR HH H -7.654 -4.705 4.850 1.00 . A A . 6 TYR HH 1 1 15 3331 1 1 6 TYR N N -2.854 -2.284 0.562 1.00 . A A . 6 TYR N 1 1 15 3332 1 1 6 TYR O O 0.390 -2.619 1.943 1.00 . A A . 6 TYR O 1 1 15 3333 1 1 6 TYR OH O -7.387 -3.783 4.842 1.00 . A A . 6 TYR OH 1 1 15 3334 1 1 7 TRP C C 1.867 -2.692 -0.351 1.00 . A A . 7 TRP C 1 1 15 3335 1 1 7 TRP CA C 1.074 -1.392 -0.486 1.00 . A A . 7 TRP CA 1 1 15 3336 1 1 7 TRP CB C 1.835 -0.237 0.177 1.00 . A A . 7 TRP CB 1 1 15 3337 1 1 7 TRP CD1 C 2.698 -1.416 2.284 1.00 . A A . 7 TRP CD1 1 1 15 3338 1 1 7 TRP CD2 C 1.558 0.469 2.685 1.00 . A A . 7 TRP CD2 1 1 15 3339 1 1 7 TRP CE2 C 1.972 -0.075 3.916 1.00 . A A . 7 TRP CE2 1 1 15 3340 1 1 7 TRP CE3 C 0.826 1.658 2.687 1.00 . A A . 7 TRP CE3 1 1 15 3341 1 1 7 TRP CG C 2.031 -0.405 1.654 1.00 . A A . 7 TRP CG 1 1 15 3342 1 1 7 TRP CH2 C 0.957 1.693 5.106 1.00 . A A . 7 TRP CH2 1 1 15 3343 1 1 7 TRP CZ2 C 1.675 0.529 5.134 1.00 . A A . 7 TRP CZ2 1 1 15 3344 1 1 7 TRP CZ3 C 0.533 2.259 3.897 1.00 . A A . 7 TRP CZ3 1 1 15 3345 1 1 7 TRP H H -1.029 -1.149 -0.410 1.00 . A A . 7 TRP H 1 1 15 3346 1 1 7 TRP HA H 0.959 -1.171 -1.537 1.00 . A A . 7 TRP HA 1 1 15 3347 1 1 7 TRP HB2 H 2.810 -0.149 -0.278 1.00 . A A . 7 TRP HB2 1 1 15 3348 1 1 7 TRP HB3 H 1.288 0.680 0.016 1.00 . A A . 7 TRP HB3 1 1 15 3349 1 1 7 TRP HD1 H 3.174 -2.241 1.775 1.00 . A A . 7 TRP HD1 1 1 15 3350 1 1 7 TRP HE1 H 3.072 -1.817 4.312 1.00 . A A . 7 TRP HE1 1 1 15 3351 1 1 7 TRP HE3 H 0.491 2.109 1.764 1.00 . A A . 7 TRP HE3 1 1 15 3352 1 1 7 TRP HH2 H 0.705 2.197 6.028 1.00 . A A . 7 TRP HH2 1 1 15 3353 1 1 7 TRP HZ2 H 1.996 0.107 6.075 1.00 . A A . 7 TRP HZ2 1 1 15 3354 1 1 7 TRP HZ3 H -0.033 3.178 3.918 1.00 . A A . 7 TRP HZ3 1 1 15 3355 1 1 7 TRP N N -0.269 -1.520 0.086 1.00 . A A . 7 TRP N 1 1 15 3356 1 1 7 TRP NE1 N 2.664 -1.226 3.645 1.00 . A A . 7 TRP NE1 1 1 15 3357 1 1 7 TRP O O 1.315 -3.736 -0.005 1.00 . A A . 7 TRP O 1 1 15 3358 1 1 8 TRP C C 5.453 -3.348 -0.183 1.00 . A A . 8 TRP C 1 1 15 3359 1 1 8 TRP CA C 4.032 -3.791 -0.542 1.00 . A A . 8 TRP CA 1 1 15 3360 1 1 8 TRP CB C 4.012 -4.554 -1.873 1.00 . A A . 8 TRP CB 1 1 15 3361 1 1 8 TRP CD1 C 5.014 -6.632 -2.977 1.00 . A A . 8 TRP CD1 1 1 15 3362 1 1 8 TRP CD2 C 5.536 -6.445 -0.805 1.00 . A A . 8 TRP CD2 1 1 15 3363 1 1 8 TRP CE2 C 6.146 -7.607 -1.321 1.00 . A A . 8 TRP CE2 1 1 15 3364 1 1 8 TRP CE3 C 5.726 -6.139 0.550 1.00 . A A . 8 TRP CE3 1 1 15 3365 1 1 8 TRP CG C 4.841 -5.811 -1.899 1.00 . A A . 8 TRP CG 1 1 15 3366 1 1 8 TRP CH2 C 7.084 -8.132 0.782 1.00 . A A . 8 TRP CH2 1 1 15 3367 1 1 8 TRP CZ2 C 6.922 -8.457 -0.536 1.00 . A A . 8 TRP CZ2 1 1 15 3368 1 1 8 TRP CZ3 C 6.492 -6.989 1.326 1.00 . A A . 8 TRP CZ3 1 1 15 3369 1 1 8 TRP H H 3.550 -1.764 -0.905 1.00 . A A . 8 TRP H 1 1 15 3370 1 1 8 TRP HA H 3.658 -4.429 0.240 1.00 . A A . 8 TRP HA 1 1 15 3371 1 1 8 TRP HB2 H 2.993 -4.835 -2.094 1.00 . A A . 8 TRP HB2 1 1 15 3372 1 1 8 TRP HB3 H 4.370 -3.903 -2.655 1.00 . A A . 8 TRP HB3 1 1 15 3373 1 1 8 TRP HD1 H 4.600 -6.441 -3.957 1.00 . A A . 8 TRP HD1 1 1 15 3374 1 1 8 TRP HE1 H 6.107 -8.401 -3.259 1.00 . A A . 8 TRP HE1 1 1 15 3375 1 1 8 TRP HE3 H 5.275 -5.269 0.996 1.00 . A A . 8 TRP HE3 1 1 15 3376 1 1 8 TRP HH2 H 7.675 -8.766 1.427 1.00 . A A . 8 TRP HH2 1 1 15 3377 1 1 8 TRP HZ2 H 7.386 -9.343 -0.941 1.00 . A A . 8 TRP HZ2 1 1 15 3378 1 1 8 TRP HZ3 H 6.644 -6.767 2.373 1.00 . A A . 8 TRP HZ3 1 1 15 3379 1 1 8 TRP N N 3.165 -2.622 -0.630 1.00 . A A . 8 TRP N 1 1 15 3380 1 1 8 TRP NE1 N 5.820 -7.692 -2.647 1.00 . A A . 8 TRP NE1 1 1 15 3381 1 1 8 TRP O O 5.768 -3.145 0.989 1.00 . A A . 8 TRP O 1 1 15 3382 1 1 9 ARG C C 7.742 -1.284 -0.561 1.00 . A A . 9 ARG C 1 1 15 3383 1 1 9 ARG CA C 7.680 -2.758 -0.966 1.00 . A A . 9 ARG CA 1 1 15 3384 1 1 9 ARG CB C 8.527 -2.997 -2.219 1.00 . A A . 9 ARG CB 1 1 15 3385 1 1 9 ARG CD C 9.190 -5.328 -1.552 1.00 . A A . 9 ARG CD 1 1 15 3386 1 1 9 ARG CG C 8.589 -4.457 -2.643 1.00 . A A . 9 ARG CG 1 1 15 3387 1 1 9 ARG CZ C 9.743 -7.698 -1.173 1.00 . A A . 9 ARG CZ 1 1 15 3388 1 1 9 ARG H H 5.999 -3.352 -2.102 1.00 . A A . 9 ARG H 1 1 15 3389 1 1 9 ARG HA H 8.078 -3.353 -0.159 1.00 . A A . 9 ARG HA 1 1 15 3390 1 1 9 ARG HB2 H 8.113 -2.427 -3.035 1.00 . A A . 9 ARG HB2 1 1 15 3391 1 1 9 ARG HB3 H 9.534 -2.658 -2.028 1.00 . A A . 9 ARG HB3 1 1 15 3392 1 1 9 ARG HD2 H 10.189 -4.977 -1.338 1.00 . A A . 9 ARG HD2 1 1 15 3393 1 1 9 ARG HD3 H 8.581 -5.242 -0.664 1.00 . A A . 9 ARG HD3 1 1 15 3394 1 1 9 ARG HE H 8.921 -6.969 -2.839 1.00 . A A . 9 ARG HE 1 1 15 3395 1 1 9 ARG HG2 H 7.589 -4.802 -2.856 1.00 . A A . 9 ARG HG2 1 1 15 3396 1 1 9 ARG HG3 H 9.196 -4.537 -3.533 1.00 . A A . 9 ARG HG3 1 1 15 3397 1 1 9 ARG HH11 H 10.194 -6.476 0.373 1.00 . A A . 9 ARG HH11 1 1 15 3398 1 1 9 ARG HH12 H 10.571 -8.148 0.616 1.00 . A A . 9 ARG HH12 1 1 15 3399 1 1 9 ARG HH21 H 9.417 -9.168 -2.522 1.00 . A A . 9 ARG HH21 1 1 15 3400 1 1 9 ARG HH22 H 10.132 -9.677 -1.028 1.00 . A A . 9 ARG HH22 1 1 15 3401 1 1 9 ARG N N 6.304 -3.186 -1.190 1.00 . A A . 9 ARG N 1 1 15 3402 1 1 9 ARG NE N 9.257 -6.732 -1.948 1.00 . A A . 9 ARG NE 1 1 15 3403 1 1 9 ARG NH1 N 10.207 -7.417 0.038 1.00 . A A . 9 ARG NH1 1 1 15 3404 1 1 9 ARG NH2 N 9.765 -8.950 -1.610 1.00 . A A . 9 ARG NH2 1 1 15 3405 1 1 9 ARG O O 8.393 -0.938 0.425 1.00 . A A . 9 ARG O 1 1 15 3406 1 1 10 PRO C C 6.154 1.387 0.165 1.00 . A A . 10 PRO C 1 1 15 3407 1 1 10 PRO CA C 7.068 1.043 -1.007 1.00 . A A . 10 PRO CA 1 1 15 3408 1 1 10 PRO CB C 6.544 1.673 -2.296 1.00 . A A . 10 PRO CB 1 1 15 3409 1 1 10 PRO CD C 6.261 -0.696 -2.512 1.00 . A A . 10 PRO CD 1 1 15 3410 1 1 10 PRO CG C 5.655 0.633 -2.883 1.00 . A A . 10 PRO CG 1 1 15 3411 1 1 10 PRO HA H 8.065 1.407 -0.804 1.00 . A A . 10 PRO HA 1 1 15 3412 1 1 10 PRO HB2 H 5.998 2.575 -2.063 1.00 . A A . 10 PRO HB2 1 1 15 3413 1 1 10 PRO HB3 H 7.370 1.902 -2.952 1.00 . A A . 10 PRO HB3 1 1 15 3414 1 1 10 PRO HD2 H 5.485 -1.410 -2.282 1.00 . A A . 10 PRO HD2 1 1 15 3415 1 1 10 PRO HD3 H 6.884 -1.060 -3.314 1.00 . A A . 10 PRO HD3 1 1 15 3416 1 1 10 PRO HG2 H 4.663 0.720 -2.468 1.00 . A A . 10 PRO HG2 1 1 15 3417 1 1 10 PRO HG3 H 5.623 0.742 -3.957 1.00 . A A . 10 PRO HG3 1 1 15 3418 1 1 10 PRO N N 7.070 -0.389 -1.312 1.00 . A A . 10 PRO N 1 1 15 3419 1 1 10 PRO O O 5.004 1.780 -0.027 1.00 . A A . 10 PRO O 1 1 15 3420 1 1 11 SER C C 6.332 2.860 3.192 1.00 . A A . 11 SER C 1 1 15 3421 1 1 11 SER CA C 5.904 1.528 2.582 1.00 . A A . 11 SER CA 1 1 15 3422 1 1 11 SER CB C 6.075 0.407 3.608 1.00 . A A . 11 SER CB 1 1 15 3423 1 1 11 SER H H 7.598 0.918 1.467 1.00 . A A . 11 SER H 1 1 15 3424 1 1 11 SER HA H 4.863 1.592 2.301 1.00 . A A . 11 SER HA 1 1 15 3425 1 1 11 SER HB2 H 7.118 0.317 3.870 1.00 . A A . 11 SER HB2 1 1 15 3426 1 1 11 SER HB3 H 5.501 0.640 4.493 1.00 . A A . 11 SER HB3 1 1 15 3427 1 1 11 SER HG H 5.418 -1.428 3.811 1.00 . A A . 11 SER HG 1 1 15 3428 1 1 11 SER N N 6.674 1.235 1.379 1.00 . A A . 11 SER N 1 1 15 3429 1 1 11 SER O O 7.521 3.172 3.254 1.00 . A A . 11 SER O 1 1 15 3430 1 1 11 SER OG O 5.627 -0.833 3.088 1.00 . A A . 11 SER OG 1 1 15 3431 1 1 12 ILE C C 6.423 4.777 5.538 1.00 . A A . 12 ILE C 1 1 15 3432 1 1 12 ILE CA C 5.628 4.938 4.245 1.00 . A A . 12 ILE CA 1 1 15 3433 1 1 12 ILE CB C 4.323 5.706 4.541 1.00 . A A . 12 ILE CB 1 1 15 3434 1 1 12 ILE CD1 C 4.298 6.736 2.213 1.00 . A A . 12 ILE CD1 1 1 15 3435 1 1 12 ILE CG1 C 3.539 5.933 3.247 1.00 . A A . 12 ILE CG1 1 1 15 3436 1 1 12 ILE CG2 C 4.621 7.035 5.222 1.00 . A A . 12 ILE CG2 1 1 15 3437 1 1 12 ILE H H 4.426 3.336 3.563 1.00 . A A . 12 ILE H 1 1 15 3438 1 1 12 ILE HA H 6.213 5.516 3.544 1.00 . A A . 12 ILE HA 1 1 15 3439 1 1 12 ILE HB H 3.726 5.110 5.214 1.00 . A A . 12 ILE HB 1 1 15 3440 1 1 12 ILE HD11 H 4.747 6.065 1.496 1.00 . A A . 12 ILE HD11 1 1 15 3441 1 1 12 ILE HD12 H 5.072 7.311 2.702 1.00 . A A . 12 ILE HD12 1 1 15 3442 1 1 12 ILE HD13 H 3.618 7.403 1.706 1.00 . A A . 12 ILE HD13 1 1 15 3443 1 1 12 ILE HG12 H 3.294 4.977 2.809 1.00 . A A . 12 ILE HG12 1 1 15 3444 1 1 12 ILE HG13 H 2.626 6.464 3.476 1.00 . A A . 12 ILE HG13 1 1 15 3445 1 1 12 ILE HG21 H 3.901 7.773 4.901 1.00 . A A . 12 ILE HG21 1 1 15 3446 1 1 12 ILE HG22 H 5.616 7.360 4.954 1.00 . A A . 12 ILE HG22 1 1 15 3447 1 1 12 ILE HG23 H 4.559 6.913 6.293 1.00 . A A . 12 ILE HG23 1 1 15 3448 1 1 12 ILE N N 5.354 3.640 3.640 1.00 . A A . 12 ILE N 1 1 15 3449 1 1 12 ILE O O 6.120 3.840 6.306 1.00 . A A . 12 ILE O 1 1 15 3450 1 1 12 ILE OXT O 7.342 5.592 5.772 1.00 . A A . 12 ILE OXT 1 1 16 3451 1 1 1 HIS C C -4.400 4.021 4.661 1.00 . A A . 1 HIS C 1 1 16 3452 1 1 1 HIS CA C -3.427 5.085 5.162 1.00 . A A . 1 HIS CA 1 1 16 3453 1 1 1 HIS CB C -2.839 4.668 6.511 1.00 . A A . 1 HIS CB 1 1 16 3454 1 1 1 HIS CD2 C -1.826 6.352 8.205 1.00 . A A . 1 HIS CD2 1 1 16 3455 1 1 1 HIS CE1 C 0.009 6.842 7.110 1.00 . A A . 1 HIS CE1 1 1 16 3456 1 1 1 HIS CG C -1.836 5.638 7.054 1.00 . A A . 1 HIS CG 1 1 16 3457 1 1 1 HIS H1 H -4.729 6.538 4.506 1.00 . A A . 1 HIS H1 1 1 16 3458 1 1 1 HIS H2 H -3.367 7.132 5.365 1.00 . A A . 1 HIS H2 1 1 16 3459 1 1 1 HIS H3 H -4.650 6.366 6.209 1.00 . A A . 1 HIS H3 1 1 16 3460 1 1 1 HIS HA H -2.627 5.198 4.446 1.00 . A A . 1 HIS HA 1 1 16 3461 1 1 1 HIS HB2 H -3.638 4.579 7.232 1.00 . A A . 1 HIS HB2 1 1 16 3462 1 1 1 HIS HB3 H -2.352 3.710 6.402 1.00 . A A . 1 HIS HB3 1 1 16 3463 1 1 1 HIS HD1 H -0.388 5.613 5.523 1.00 . A A . 1 HIS HD1 1 1 16 3464 1 1 1 HIS HD2 H -2.587 6.340 8.973 1.00 . A A . 1 HIS HD2 1 1 16 3465 1 1 1 HIS HE1 H 0.959 7.280 6.839 1.00 . A A . 1 HIS HE1 1 1 16 3466 1 1 1 HIS HE2 H -0.430 7.766 8.885 1.00 . A A . 1 HIS HE2 1 1 16 3467 1 1 1 HIS N N -4.104 6.398 5.326 1.00 . A A . 1 HIS N 1 1 16 3468 1 1 1 HIS ND1 N -0.673 5.968 6.391 1.00 . A A . 1 HIS ND1 1 1 16 3469 1 1 1 HIS NE2 N -0.669 7.092 8.214 1.00 . A A . 1 HIS NE2 1 1 16 3470 1 1 1 HIS O O -5.102 3.391 5.452 1.00 . A A . 1 HIS O 1 1 16 3471 1 1 2 PRO C C -5.277 1.460 3.446 1.00 . A A . 2 PRO C 1 1 16 3472 1 1 2 PRO CA C -5.349 2.807 2.734 1.00 . A A . 2 PRO CA 1 1 16 3473 1 1 2 PRO CB C -4.827 2.684 1.304 1.00 . A A . 2 PRO CB 1 1 16 3474 1 1 2 PRO CD C -3.653 4.509 2.316 1.00 . A A . 2 PRO CD 1 1 16 3475 1 1 2 PRO CG C -4.217 4.012 1.012 1.00 . A A . 2 PRO CG 1 1 16 3476 1 1 2 PRO HA H -6.373 3.151 2.720 1.00 . A A . 2 PRO HA 1 1 16 3477 1 1 2 PRO HB2 H -4.095 1.892 1.252 1.00 . A A . 2 PRO HB2 1 1 16 3478 1 1 2 PRO HB3 H -5.647 2.472 0.635 1.00 . A A . 2 PRO HB3 1 1 16 3479 1 1 2 PRO HD2 H -2.609 4.247 2.400 1.00 . A A . 2 PRO HD2 1 1 16 3480 1 1 2 PRO HD3 H -3.783 5.578 2.399 1.00 . A A . 2 PRO HD3 1 1 16 3481 1 1 2 PRO HG2 H -3.430 3.901 0.281 1.00 . A A . 2 PRO HG2 1 1 16 3482 1 1 2 PRO HG3 H -4.974 4.691 0.648 1.00 . A A . 2 PRO HG3 1 1 16 3483 1 1 2 PRO N N -4.456 3.803 3.334 1.00 . A A . 2 PRO N 1 1 16 3484 1 1 2 PRO O O -4.308 1.170 4.148 1.00 . A A . 2 PRO O 1 1 16 3485 1 1 3 LEU C C -6.792 -1.758 2.903 1.00 . A A . 3 LEU C 1 1 16 3486 1 1 3 LEU CA C -6.357 -0.674 3.890 1.00 . A A . 3 LEU CA 1 1 16 3487 1 1 3 LEU CB C -7.295 -0.640 5.102 1.00 . A A . 3 LEU CB 1 1 16 3488 1 1 3 LEU CD1 C -9.402 -1.213 3.839 1.00 . A A . 3 LEU CD1 1 1 16 3489 1 1 3 LEU CD2 C -9.543 -0.155 6.100 1.00 . A A . 3 LEU CD2 1 1 16 3490 1 1 3 LEU CG C -8.745 -0.242 4.808 1.00 . A A . 3 LEU CG 1 1 16 3491 1 1 3 LEU H H -7.051 0.929 2.693 1.00 . A A . 3 LEU H 1 1 16 3492 1 1 3 LEU HA H -5.363 -0.906 4.233 1.00 . A A . 3 LEU HA 1 1 16 3493 1 1 3 LEU HB2 H -7.299 -1.622 5.551 1.00 . A A . 3 LEU HB2 1 1 16 3494 1 1 3 LEU HB3 H -6.892 0.060 5.818 1.00 . A A . 3 LEU HB3 1 1 16 3495 1 1 3 LEU HD11 H -10.475 -1.162 3.951 1.00 . A A . 3 LEU HD11 1 1 16 3496 1 1 3 LEU HD12 H -9.065 -2.217 4.052 1.00 . A A . 3 LEU HD12 1 1 16 3497 1 1 3 LEU HD13 H -9.133 -0.950 2.827 1.00 . A A . 3 LEU HD13 1 1 16 3498 1 1 3 LEU HD21 H -9.125 -0.834 6.828 1.00 . A A . 3 LEU HD21 1 1 16 3499 1 1 3 LEU HD22 H -10.571 -0.423 5.905 1.00 . A A . 3 LEU HD22 1 1 16 3500 1 1 3 LEU HD23 H -9.501 0.855 6.482 1.00 . A A . 3 LEU HD23 1 1 16 3501 1 1 3 LEU HG H -8.747 0.735 4.349 1.00 . A A . 3 LEU HG 1 1 16 3502 1 1 3 LEU N N -6.307 0.641 3.262 1.00 . A A . 3 LEU N 1 1 16 3503 1 1 3 LEU O O -7.066 -2.890 3.299 1.00 . A A . 3 LEU O 1 1 16 3504 1 1 4 LYS C C -6.259 -2.419 -0.556 1.00 . A A . 4 LYS C 1 1 16 3505 1 1 4 LYS CA C -7.269 -2.358 0.592 1.00 . A A . 4 LYS CA 1 1 16 3506 1 1 4 LYS CB C -8.652 -1.988 0.052 1.00 . A A . 4 LYS CB 1 1 16 3507 1 1 4 LYS CD C -10.536 -2.523 -1.525 1.00 . A A . 4 LYS CD 1 1 16 3508 1 1 4 LYS CE C -11.043 -3.467 -2.603 1.00 . A A . 4 LYS CE 1 1 16 3509 1 1 4 LYS CG C -9.159 -2.932 -1.028 1.00 . A A . 4 LYS CG 1 1 16 3510 1 1 4 LYS H H -6.638 -0.490 1.361 1.00 . A A . 4 LYS H 1 1 16 3511 1 1 4 LYS HA H -7.326 -3.333 1.052 1.00 . A A . 4 LYS HA 1 1 16 3512 1 1 4 LYS HB2 H -9.360 -1.997 0.869 1.00 . A A . 4 LYS HB2 1 1 16 3513 1 1 4 LYS HB3 H -8.609 -0.993 -0.363 1.00 . A A . 4 LYS HB3 1 1 16 3514 1 1 4 LYS HD2 H -11.227 -2.537 -0.694 1.00 . A A . 4 LYS HD2 1 1 16 3515 1 1 4 LYS HD3 H -10.479 -1.523 -1.930 1.00 . A A . 4 LYS HD3 1 1 16 3516 1 1 4 LYS HE2 H -10.350 -3.451 -3.431 1.00 . A A . 4 LYS HE2 1 1 16 3517 1 1 4 LYS HE3 H -11.093 -4.466 -2.195 1.00 . A A . 4 LYS HE3 1 1 16 3518 1 1 4 LYS HG2 H -8.470 -2.918 -1.858 1.00 . A A . 4 LYS HG2 1 1 16 3519 1 1 4 LYS HG3 H -9.215 -3.931 -0.621 1.00 . A A . 4 LYS HG3 1 1 16 3520 1 1 4 LYS HZ1 H -12.422 -2.054 -3.284 1.00 . A A . 4 LYS HZ1 1 1 16 3521 1 1 4 LYS HZ2 H -13.113 -3.305 -2.381 1.00 . A A . 4 LYS HZ2 1 1 16 3522 1 1 4 LYS HZ3 H -12.615 -3.588 -3.973 1.00 . A A . 4 LYS HZ3 1 1 16 3523 1 1 4 LYS N N -6.861 -1.407 1.621 1.00 . A A . 4 LYS N 1 1 16 3524 1 1 4 LYS NZ N -12.392 -3.076 -3.095 1.00 . A A . 4 LYS NZ 1 1 16 3525 1 1 4 LYS O O -6.310 -3.328 -1.385 1.00 . A A . 4 LYS O 1 1 16 3526 1 1 5 GLN C C -3.321 -2.535 -1.492 1.00 . A A . 5 GLN C 1 1 16 3527 1 1 5 GLN CA C -4.338 -1.412 -1.660 1.00 . A A . 5 GLN CA 1 1 16 3528 1 1 5 GLN CB C -3.628 -0.057 -1.663 1.00 . A A . 5 GLN CB 1 1 16 3529 1 1 5 GLN CD C -1.871 1.420 -2.716 1.00 . A A . 5 GLN CD 1 1 16 3530 1 1 5 GLN CG C -2.558 0.069 -2.736 1.00 . A A . 5 GLN CG 1 1 16 3531 1 1 5 GLN H H -5.349 -0.751 0.076 1.00 . A A . 5 GLN H 1 1 16 3532 1 1 5 GLN HA H -4.842 -1.545 -2.599 1.00 . A A . 5 GLN HA 1 1 16 3533 1 1 5 GLN HB2 H -4.360 0.720 -1.823 1.00 . A A . 5 GLN HB2 1 1 16 3534 1 1 5 GLN HB3 H -3.161 0.094 -0.701 1.00 . A A . 5 GLN HB3 1 1 16 3535 1 1 5 GLN HE21 H -0.114 0.550 -2.380 1.00 . A A . 5 GLN HE21 1 1 16 3536 1 1 5 GLN HE22 H -0.090 2.274 -2.490 1.00 . A A . 5 GLN HE22 1 1 16 3537 1 1 5 GLN HG2 H -1.814 -0.697 -2.576 1.00 . A A . 5 GLN HG2 1 1 16 3538 1 1 5 GLN HG3 H -3.017 -0.072 -3.703 1.00 . A A . 5 GLN HG3 1 1 16 3539 1 1 5 GLN N N -5.346 -1.453 -0.606 1.00 . A A . 5 GLN N 1 1 16 3540 1 1 5 GLN NE2 N -0.560 1.414 -2.508 1.00 . A A . 5 GLN NE2 1 1 16 3541 1 1 5 GLN O O -2.775 -3.046 -2.471 1.00 . A A . 5 GLN O 1 1 16 3542 1 1 5 GLN OE1 O -2.512 2.457 -2.887 1.00 . A A . 5 GLN OE1 1 1 16 3543 1 1 6 TYR C C -0.758 -3.691 -0.562 1.00 . A A . 6 TYR C 1 1 16 3544 1 1 6 TYR CA C -2.123 -3.978 0.060 1.00 . A A . 6 TYR CA 1 1 16 3545 1 1 6 TYR CB C -2.648 -5.325 -0.446 1.00 . A A . 6 TYR CB 1 1 16 3546 1 1 6 TYR CD1 C -4.622 -4.979 1.117 1.00 . A A . 6 TYR CD1 1 1 16 3547 1 1 6 TYR CD2 C -4.562 -6.956 -0.215 1.00 . A A . 6 TYR CD2 1 1 16 3548 1 1 6 TYR CE1 C -5.822 -5.384 1.669 1.00 . A A . 6 TYR CE1 1 1 16 3549 1 1 6 TYR CE2 C -5.762 -7.366 0.333 1.00 . A A . 6 TYR CE2 1 1 16 3550 1 1 6 TYR CG C -3.970 -5.757 0.164 1.00 . A A . 6 TYR CG 1 1 16 3551 1 1 6 TYR CZ C -6.388 -6.576 1.273 1.00 . A A . 6 TYR CZ 1 1 16 3552 1 1 6 TYR H H -3.544 -2.464 0.485 1.00 . A A . 6 TYR H 1 1 16 3553 1 1 6 TYR HA H -2.012 -4.024 1.133 1.00 . A A . 6 TYR HA 1 1 16 3554 1 1 6 TYR HB2 H -2.785 -5.268 -1.514 1.00 . A A . 6 TYR HB2 1 1 16 3555 1 1 6 TYR HB3 H -1.917 -6.090 -0.226 1.00 . A A . 6 TYR HB3 1 1 16 3556 1 1 6 TYR HD1 H -4.178 -4.045 1.427 1.00 . A A . 6 TYR HD1 1 1 16 3557 1 1 6 TYR HD2 H -4.070 -7.572 -0.954 1.00 . A A . 6 TYR HD2 1 1 16 3558 1 1 6 TYR HE1 H -6.312 -4.766 2.406 1.00 . A A . 6 TYR HE1 1 1 16 3559 1 1 6 TYR HE2 H -6.204 -8.301 0.024 1.00 . A A . 6 TYR HE2 1 1 16 3560 1 1 6 TYR HH H -8.150 -6.219 1.953 1.00 . A A . 6 TYR HH 1 1 16 3561 1 1 6 TYR N N -3.074 -2.912 -0.247 1.00 . A A . 6 TYR N 1 1 16 3562 1 1 6 TYR O O -0.422 -4.230 -1.616 1.00 . A A . 6 TYR O 1 1 16 3563 1 1 6 TYR OH O -7.583 -6.982 1.821 1.00 . A A . 6 TYR OH 1 1 16 3564 1 1 7 TRP C C 2.433 -3.202 0.408 1.00 . A A . 7 TRP C 1 1 16 3565 1 1 7 TRP CA C 1.351 -2.489 -0.397 1.00 . A A . 7 TRP CA 1 1 16 3566 1 1 7 TRP CB C 1.558 -0.976 -0.325 1.00 . A A . 7 TRP CB 1 1 16 3567 1 1 7 TRP CD1 C 2.218 -0.757 2.140 1.00 . A A . 7 TRP CD1 1 1 16 3568 1 1 7 TRP CD2 C 0.506 0.549 1.527 1.00 . A A . 7 TRP CD2 1 1 16 3569 1 1 7 TRP CE2 C 0.767 0.763 2.894 1.00 . A A . 7 TRP CE2 1 1 16 3570 1 1 7 TRP CE3 C -0.530 1.265 0.920 1.00 . A A . 7 TRP CE3 1 1 16 3571 1 1 7 TRP CG C 1.447 -0.425 1.063 1.00 . A A . 7 TRP CG 1 1 16 3572 1 1 7 TRP CH2 C -0.978 2.346 3.042 1.00 . A A . 7 TRP CH2 1 1 16 3573 1 1 7 TRP CZ2 C 0.029 1.660 3.662 1.00 . A A . 7 TRP CZ2 1 1 16 3574 1 1 7 TRP CZ3 C -1.262 2.155 1.684 1.00 . A A . 7 TRP CZ3 1 1 16 3575 1 1 7 TRP H H -0.297 -2.445 0.933 1.00 . A A . 7 TRP H 1 1 16 3576 1 1 7 TRP HA H 1.418 -2.806 -1.426 1.00 . A A . 7 TRP HA 1 1 16 3577 1 1 7 TRP HB2 H 2.542 -0.736 -0.701 1.00 . A A . 7 TRP HB2 1 1 16 3578 1 1 7 TRP HB3 H 0.815 -0.489 -0.940 1.00 . A A . 7 TRP HB3 1 1 16 3579 1 1 7 TRP HD1 H 3.024 -1.475 2.112 1.00 . A A . 7 TRP HD1 1 1 16 3580 1 1 7 TRP HE1 H 2.216 -0.107 4.137 1.00 . A A . 7 TRP HE1 1 1 16 3581 1 1 7 TRP HE3 H -0.763 1.131 -0.126 1.00 . A A . 7 TRP HE3 1 1 16 3582 1 1 7 TRP HH2 H -1.576 3.052 3.600 1.00 . A A . 7 TRP HH2 1 1 16 3583 1 1 7 TRP HZ2 H 0.235 1.820 4.710 1.00 . A A . 7 TRP HZ2 1 1 16 3584 1 1 7 TRP HZ3 H -2.066 2.716 1.231 1.00 . A A . 7 TRP HZ3 1 1 16 3585 1 1 7 TRP N N 0.024 -2.843 0.097 1.00 . A A . 7 TRP N 1 1 16 3586 1 1 7 TRP NE1 N 1.816 -0.046 3.244 1.00 . A A . 7 TRP NE1 1 1 16 3587 1 1 7 TRP O O 2.184 -3.680 1.515 1.00 . A A . 7 TRP O 1 1 16 3588 1 1 8 TRP C C 5.796 -2.871 0.898 1.00 . A A . 8 TRP C 1 1 16 3589 1 1 8 TRP CA C 4.751 -3.929 0.518 1.00 . A A . 8 TRP CA 1 1 16 3590 1 1 8 TRP CB C 5.353 -4.993 -0.408 1.00 . A A . 8 TRP CB 1 1 16 3591 1 1 8 TRP CD1 C 7.201 -6.759 -0.445 1.00 . A A . 8 TRP CD1 1 1 16 3592 1 1 8 TRP CD2 C 6.938 -5.783 1.557 1.00 . A A . 8 TRP CD2 1 1 16 3593 1 1 8 TRP CE2 C 7.979 -6.730 1.646 1.00 . A A . 8 TRP CE2 1 1 16 3594 1 1 8 TRP CE3 C 6.595 -5.058 2.707 1.00 . A A . 8 TRP CE3 1 1 16 3595 1 1 8 TRP CG C 6.478 -5.792 0.192 1.00 . A A . 8 TRP CG 1 1 16 3596 1 1 8 TRP CH2 C 8.309 -6.252 3.933 1.00 . A A . 8 TRP CH2 1 1 16 3597 1 1 8 TRP CZ2 C 8.670 -6.971 2.829 1.00 . A A . 8 TRP CZ2 1 1 16 3598 1 1 8 TRP CZ3 C 7.282 -5.305 3.880 1.00 . A A . 8 TRP CZ3 1 1 16 3599 1 1 8 TRP H H 3.777 -2.874 -1.038 1.00 . A A . 8 TRP H 1 1 16 3600 1 1 8 TRP HA H 4.381 -4.399 1.411 1.00 . A A . 8 TRP HA 1 1 16 3601 1 1 8 TRP HB2 H 4.575 -5.688 -0.687 1.00 . A A . 8 TRP HB2 1 1 16 3602 1 1 8 TRP HB3 H 5.725 -4.512 -1.300 1.00 . A A . 8 TRP HB3 1 1 16 3603 1 1 8 TRP HD1 H 7.081 -7.021 -1.485 1.00 . A A . 8 TRP HD1 1 1 16 3604 1 1 8 TRP HE1 H 8.778 -7.996 0.179 1.00 . A A . 8 TRP HE1 1 1 16 3605 1 1 8 TRP HE3 H 5.806 -4.325 2.693 1.00 . A A . 8 TRP HE3 1 1 16 3606 1 1 8 TRP HH2 H 8.817 -6.411 4.873 1.00 . A A . 8 TRP HH2 1 1 16 3607 1 1 8 TRP HZ2 H 9.466 -7.699 2.888 1.00 . A A . 8 TRP HZ2 1 1 16 3608 1 1 8 TRP HZ3 H 7.027 -4.758 4.776 1.00 . A A . 8 TRP HZ3 1 1 16 3609 1 1 8 TRP N N 3.636 -3.272 -0.153 1.00 . A A . 8 TRP N 1 1 16 3610 1 1 8 TRP NE1 N 8.125 -7.302 0.411 1.00 . A A . 8 TRP NE1 1 1 16 3611 1 1 8 TRP O O 5.650 -2.185 1.909 1.00 . A A . 8 TRP O 1 1 16 3612 1 1 9 ARG C C 7.520 -0.384 -0.319 1.00 . A A . 9 ARG C 1 1 16 3613 1 1 9 ARG CA C 7.876 -1.731 0.318 1.00 . A A . 9 ARG CA 1 1 16 3614 1 1 9 ARG CB C 9.229 -2.215 -0.212 1.00 . A A . 9 ARG CB 1 1 16 3615 1 1 9 ARG CD C 9.935 -3.294 1.941 1.00 . A A . 9 ARG CD 1 1 16 3616 1 1 9 ARG CG C 9.737 -3.488 0.446 1.00 . A A . 9 ARG CG 1 1 16 3617 1 1 9 ARG CZ C 10.698 -4.591 3.892 1.00 . A A . 9 ARG CZ 1 1 16 3618 1 1 9 ARG H H 6.889 -3.286 -0.720 1.00 . A A . 9 ARG H 1 1 16 3619 1 1 9 ARG HA H 7.951 -1.593 1.387 1.00 . A A . 9 ARG HA 1 1 16 3620 1 1 9 ARG HB2 H 9.143 -2.397 -1.271 1.00 . A A . 9 ARG HB2 1 1 16 3621 1 1 9 ARG HB3 H 9.961 -1.437 -0.051 1.00 . A A . 9 ARG HB3 1 1 16 3622 1 1 9 ARG HD2 H 10.643 -2.494 2.097 1.00 . A A . 9 ARG HD2 1 1 16 3623 1 1 9 ARG HD3 H 8.987 -3.025 2.384 1.00 . A A . 9 ARG HD3 1 1 16 3624 1 1 9 ARG HE H 10.581 -5.291 2.026 1.00 . A A . 9 ARG HE 1 1 16 3625 1 1 9 ARG HG2 H 9.017 -4.276 0.286 1.00 . A A . 9 ARG HG2 1 1 16 3626 1 1 9 ARG HG3 H 10.681 -3.761 -0.002 1.00 . A A . 9 ARG HG3 1 1 16 3627 1 1 9 ARG HH11 H 10.177 -2.682 4.309 1.00 . A A . 9 ARG HH11 1 1 16 3628 1 1 9 ARG HH12 H 10.715 -3.618 5.663 1.00 . A A . 9 ARG HH12 1 1 16 3629 1 1 9 ARG HH21 H 11.286 -6.522 3.806 1.00 . A A . 9 ARG HH21 1 1 16 3630 1 1 9 ARG HH22 H 11.345 -5.799 5.378 1.00 . A A . 9 ARG HH22 1 1 16 3631 1 1 9 ARG N N 6.833 -2.725 0.075 1.00 . A A . 9 ARG N 1 1 16 3632 1 1 9 ARG NE N 10.435 -4.503 2.590 1.00 . A A . 9 ARG NE 1 1 16 3633 1 1 9 ARG NH1 N 10.515 -3.544 4.687 1.00 . A A . 9 ARG NH1 1 1 16 3634 1 1 9 ARG NH2 N 11.147 -5.731 4.401 1.00 . A A . 9 ARG NH2 1 1 16 3635 1 1 9 ARG O O 7.626 0.657 0.328 1.00 . A A . 9 ARG O 1 1 16 3636 1 1 10 PRO C C 5.310 1.294 -2.015 1.00 . A A . 10 PRO C 1 1 16 3637 1 1 10 PRO CA C 6.741 0.854 -2.302 1.00 . A A . 10 PRO CA 1 1 16 3638 1 1 10 PRO CB C 6.896 0.464 -3.767 1.00 . A A . 10 PRO CB 1 1 16 3639 1 1 10 PRO CD C 6.939 -1.561 -2.471 1.00 . A A . 10 PRO CD 1 1 16 3640 1 1 10 PRO CG C 6.537 -0.983 -3.805 1.00 . A A . 10 PRO CG 1 1 16 3641 1 1 10 PRO HA H 7.421 1.658 -2.066 1.00 . A A . 10 PRO HA 1 1 16 3642 1 1 10 PRO HB2 H 6.225 1.055 -4.374 1.00 . A A . 10 PRO HB2 1 1 16 3643 1 1 10 PRO HB3 H 7.915 0.625 -4.082 1.00 . A A . 10 PRO HB3 1 1 16 3644 1 1 10 PRO HD2 H 6.161 -2.210 -2.096 1.00 . A A . 10 PRO HD2 1 1 16 3645 1 1 10 PRO HD3 H 7.867 -2.102 -2.563 1.00 . A A . 10 PRO HD3 1 1 16 3646 1 1 10 PRO HG2 H 5.472 -1.090 -3.953 1.00 . A A . 10 PRO HG2 1 1 16 3647 1 1 10 PRO HG3 H 7.077 -1.471 -4.603 1.00 . A A . 10 PRO HG3 1 1 16 3648 1 1 10 PRO N N 7.099 -0.378 -1.601 1.00 . A A . 10 PRO N 1 1 16 3649 1 1 10 PRO O O 4.365 0.808 -2.635 1.00 . A A . 10 PRO O 1 1 16 3650 1 1 11 SER C C 3.368 3.773 -1.711 1.00 . A A . 11 SER C 1 1 16 3651 1 1 11 SER CA C 3.844 2.728 -0.708 1.00 . A A . 11 SER CA 1 1 16 3652 1 1 11 SER CB C 3.883 3.333 0.697 1.00 . A A . 11 SER CB 1 1 16 3653 1 1 11 SER H H 5.953 2.569 -0.619 1.00 . A A . 11 SER H 1 1 16 3654 1 1 11 SER HA H 3.154 1.899 -0.714 1.00 . A A . 11 SER HA 1 1 16 3655 1 1 11 SER HB2 H 4.593 4.146 0.717 1.00 . A A . 11 SER HB2 1 1 16 3656 1 1 11 SER HB3 H 2.902 3.706 0.952 1.00 . A A . 11 SER HB3 1 1 16 3657 1 1 11 SER HG H 3.738 1.575 1.548 1.00 . A A . 11 SER HG 1 1 16 3658 1 1 11 SER N N 5.160 2.220 -1.075 1.00 . A A . 11 SER N 1 1 16 3659 1 1 11 SER O O 4.154 4.587 -2.195 1.00 . A A . 11 SER O 1 1 16 3660 1 1 11 SER OG O 4.269 2.367 1.657 1.00 . A A . 11 SER OG 1 1 16 3661 1 1 12 ILE C C 2.088 4.501 -4.361 1.00 . A A . 12 ILE C 1 1 16 3662 1 1 12 ILE CA C 1.493 4.688 -2.967 1.00 . A A . 12 ILE CA 1 1 16 3663 1 1 12 ILE CB C 1.713 6.146 -2.511 1.00 . A A . 12 ILE CB 1 1 16 3664 1 1 12 ILE CD1 C -0.428 6.130 -1.135 1.00 . A A . 12 ILE CD1 1 1 16 3665 1 1 12 ILE CG1 C 1.066 6.376 -1.145 1.00 . A A . 12 ILE CG1 1 1 16 3666 1 1 12 ILE CG2 C 1.150 7.122 -3.536 1.00 . A A . 12 ILE CG2 1 1 16 3667 1 1 12 ILE H H 1.498 3.071 -1.603 1.00 . A A . 12 ILE H 1 1 16 3668 1 1 12 ILE HA H 0.429 4.503 -3.013 1.00 . A A . 12 ILE HA 1 1 16 3669 1 1 12 ILE HB H 2.775 6.320 -2.432 1.00 . A A . 12 ILE HB 1 1 16 3670 1 1 12 ILE HD11 H -0.843 6.396 -2.095 1.00 . A A . 12 ILE HD11 1 1 16 3671 1 1 12 ILE HD12 H -0.886 6.732 -0.364 1.00 . A A . 12 ILE HD12 1 1 16 3672 1 1 12 ILE HD13 H -0.619 5.085 -0.936 1.00 . A A . 12 ILE HD13 1 1 16 3673 1 1 12 ILE HG12 H 1.516 5.710 -0.424 1.00 . A A . 12 ILE HG12 1 1 16 3674 1 1 12 ILE HG13 H 1.236 7.399 -0.840 1.00 . A A . 12 ILE HG13 1 1 16 3675 1 1 12 ILE HG21 H 1.652 6.980 -4.481 1.00 . A A . 12 ILE HG21 1 1 16 3676 1 1 12 ILE HG22 H 1.307 8.134 -3.193 1.00 . A A . 12 ILE HG22 1 1 16 3677 1 1 12 ILE HG23 H 0.093 6.945 -3.660 1.00 . A A . 12 ILE HG23 1 1 16 3678 1 1 12 ILE N N 2.075 3.744 -2.020 1.00 . A A . 12 ILE N 1 1 16 3679 1 1 12 ILE O O 1.496 3.746 -5.160 1.00 . A A . 12 ILE O 1 1 16 3680 1 1 12 ILE OXT O 3.140 5.113 -4.641 1.00 . A A . 12 ILE OXT 1 1 17 3681 1 1 1 HIS C C -5.291 3.850 3.549 1.00 . A A . 1 HIS C 1 1 17 3682 1 1 1 HIS CA C -5.336 4.637 4.861 1.00 . A A . 1 HIS CA 1 1 17 3683 1 1 1 HIS CB C -5.480 6.136 4.580 1.00 . A A . 1 HIS CB 1 1 17 3684 1 1 1 HIS CD2 C -4.843 7.973 6.298 1.00 . A A . 1 HIS CD2 1 1 17 3685 1 1 1 HIS CE1 C -6.493 7.675 7.711 1.00 . A A . 1 HIS CE1 1 1 17 3686 1 1 1 HIS CG C -5.612 6.967 5.819 1.00 . A A . 1 HIS CG 1 1 17 3687 1 1 1 HIS H1 H -3.457 5.197 5.503 1.00 . A A . 1 HIS H1 1 1 17 3688 1 1 1 HIS H2 H -3.704 3.500 5.403 1.00 . A A . 1 HIS H2 1 1 17 3689 1 1 1 HIS H3 H -4.408 4.399 6.684 1.00 . A A . 1 HIS H3 1 1 17 3690 1 1 1 HIS HA H -6.191 4.306 5.432 1.00 . A A . 1 HIS HA 1 1 17 3691 1 1 1 HIS HB2 H -4.611 6.481 4.043 1.00 . A A . 1 HIS HB2 1 1 17 3692 1 1 1 HIS HB3 H -6.359 6.299 3.975 1.00 . A A . 1 HIS HB3 1 1 17 3693 1 1 1 HIS HD1 H -7.362 6.148 6.662 1.00 . A A . 1 HIS HD1 1 1 17 3694 1 1 1 HIS HD2 H -3.947 8.370 5.841 1.00 . A A . 1 HIS HD2 1 1 17 3695 1 1 1 HIS HE1 H -7.147 7.779 8.564 1.00 . A A . 1 HIS HE1 1 1 17 3696 1 1 1 HIS HE2 H -5.125 9.172 7.999 1.00 . A A . 1 HIS HE2 1 1 17 3697 1 1 1 HIS N N -4.116 4.413 5.687 1.00 . A A . 1 HIS N 1 1 17 3698 1 1 1 HIS ND1 N -6.636 6.804 6.728 1.00 . A A . 1 HIS ND1 1 1 17 3699 1 1 1 HIS NE2 N -5.412 8.394 7.475 1.00 . A A . 1 HIS NE2 1 1 17 3700 1 1 1 HIS O O -6.268 3.197 3.184 1.00 . A A . 1 HIS O 1 1 17 3701 1 1 2 PRO C C -3.703 1.700 1.746 1.00 . A A . 2 PRO C 1 1 17 3702 1 1 2 PRO CA C -4.027 3.178 1.545 1.00 . A A . 2 PRO CA 1 1 17 3703 1 1 2 PRO CB C -2.864 3.898 0.868 1.00 . A A . 2 PRO CB 1 1 17 3704 1 1 2 PRO CD C -2.933 4.644 3.150 1.00 . A A . 2 PRO CD 1 1 17 3705 1 1 2 PRO CG C -2.006 4.363 1.993 1.00 . A A . 2 PRO CG 1 1 17 3706 1 1 2 PRO HA H -4.916 3.272 0.940 1.00 . A A . 2 PRO HA 1 1 17 3707 1 1 2 PRO HB2 H -2.336 3.208 0.225 1.00 . A A . 2 PRO HB2 1 1 17 3708 1 1 2 PRO HB3 H -3.238 4.727 0.288 1.00 . A A . 2 PRO HB3 1 1 17 3709 1 1 2 PRO HD2 H -2.499 4.281 4.070 1.00 . A A . 2 PRO HD2 1 1 17 3710 1 1 2 PRO HD3 H -3.132 5.703 3.220 1.00 . A A . 2 PRO HD3 1 1 17 3711 1 1 2 PRO HG2 H -1.301 3.590 2.259 1.00 . A A . 2 PRO HG2 1 1 17 3712 1 1 2 PRO HG3 H -1.483 5.263 1.705 1.00 . A A . 2 PRO HG3 1 1 17 3713 1 1 2 PRO N N -4.161 3.896 2.813 1.00 . A A . 2 PRO N 1 1 17 3714 1 1 2 PRO O O -2.688 1.204 1.255 1.00 . A A . 2 PRO O 1 1 17 3715 1 1 3 LEU C C -5.399 -1.277 1.989 1.00 . A A . 3 LEU C 1 1 17 3716 1 1 3 LEU CA C -4.378 -0.419 2.736 1.00 . A A . 3 LEU CA 1 1 17 3717 1 1 3 LEU CB C -4.441 -0.686 4.245 1.00 . A A . 3 LEU CB 1 1 17 3718 1 1 3 LEU CD1 C -6.935 -1.047 4.364 1.00 . A A . 3 LEU CD1 1 1 17 3719 1 1 3 LEU CD2 C -5.643 -0.516 6.439 1.00 . A A . 3 LEU CD2 1 1 17 3720 1 1 3 LEU CG C -5.748 -0.288 4.938 1.00 . A A . 3 LEU CG 1 1 17 3721 1 1 3 LEU H H -5.361 1.454 2.835 1.00 . A A . 3 LEU H 1 1 17 3722 1 1 3 LEU HA H -3.394 -0.680 2.385 1.00 . A A . 3 LEU HA 1 1 17 3723 1 1 3 LEU HB2 H -4.283 -1.742 4.406 1.00 . A A . 3 LEU HB2 1 1 17 3724 1 1 3 LEU HB3 H -3.634 -0.146 4.716 1.00 . A A . 3 LEU HB3 1 1 17 3725 1 1 3 LEU HD11 H -6.644 -2.064 4.150 1.00 . A A . 3 LEU HD11 1 1 17 3726 1 1 3 LEU HD12 H -7.265 -0.568 3.455 1.00 . A A . 3 LEU HD12 1 1 17 3727 1 1 3 LEU HD13 H -7.742 -1.049 5.083 1.00 . A A . 3 LEU HD13 1 1 17 3728 1 1 3 LEU HD21 H -5.429 -1.558 6.631 1.00 . A A . 3 LEU HD21 1 1 17 3729 1 1 3 LEU HD22 H -6.578 -0.249 6.909 1.00 . A A . 3 LEU HD22 1 1 17 3730 1 1 3 LEU HD23 H -4.849 0.094 6.841 1.00 . A A . 3 LEU HD23 1 1 17 3731 1 1 3 LEU HG H -5.920 0.764 4.773 1.00 . A A . 3 LEU HG 1 1 17 3732 1 1 3 LEU N N -4.572 1.002 2.470 1.00 . A A . 3 LEU N 1 1 17 3733 1 1 3 LEU O O -5.542 -2.467 2.269 1.00 . A A . 3 LEU O 1 1 17 3734 1 1 4 LYS C C -6.450 -2.268 -0.805 1.00 . A A . 4 LYS C 1 1 17 3735 1 1 4 LYS CA C -7.106 -1.388 0.256 1.00 . A A . 4 LYS CA 1 1 17 3736 1 1 4 LYS CB C -8.068 -0.400 -0.406 1.00 . A A . 4 LYS CB 1 1 17 3737 1 1 4 LYS CD C -10.075 -0.044 -1.877 1.00 . A A . 4 LYS CD 1 1 17 3738 1 1 4 LYS CE C -11.155 -0.711 -2.713 1.00 . A A . 4 LYS CE 1 1 17 3739 1 1 4 LYS CG C -9.148 -1.068 -1.243 1.00 . A A . 4 LYS CG 1 1 17 3740 1 1 4 LYS H H -5.947 0.278 0.854 1.00 . A A . 4 LYS H 1 1 17 3741 1 1 4 LYS HA H -7.660 -2.018 0.932 1.00 . A A . 4 LYS HA 1 1 17 3742 1 1 4 LYS HB2 H -8.550 0.186 0.362 1.00 . A A . 4 LYS HB2 1 1 17 3743 1 1 4 LYS HB3 H -7.503 0.259 -1.048 1.00 . A A . 4 LYS HB3 1 1 17 3744 1 1 4 LYS HD2 H -10.545 0.535 -1.096 1.00 . A A . 4 LYS HD2 1 1 17 3745 1 1 4 LYS HD3 H -9.492 0.609 -2.510 1.00 . A A . 4 LYS HD3 1 1 17 3746 1 1 4 LYS HE2 H -10.681 -1.291 -3.492 1.00 . A A . 4 LYS HE2 1 1 17 3747 1 1 4 LYS HE3 H -11.732 -1.366 -2.077 1.00 . A A . 4 LYS HE3 1 1 17 3748 1 1 4 LYS HG2 H -8.678 -1.647 -2.024 1.00 . A A . 4 LYS HG2 1 1 17 3749 1 1 4 LYS HG3 H -9.728 -1.722 -0.608 1.00 . A A . 4 LYS HG3 1 1 17 3750 1 1 4 LYS HZ1 H -12.055 1.173 -2.794 1.00 . A A . 4 LYS HZ1 1 1 17 3751 1 1 4 LYS HZ2 H -13.040 -0.082 -3.358 1.00 . A A . 4 LYS HZ2 1 1 17 3752 1 1 4 LYS HZ3 H -11.765 0.486 -4.313 1.00 . A A . 4 LYS HZ3 1 1 17 3753 1 1 4 LYS N N -6.104 -0.671 1.038 1.00 . A A . 4 LYS N 1 1 17 3754 1 1 4 LYS NZ N -12.067 0.286 -3.339 1.00 . A A . 4 LYS NZ 1 1 17 3755 1 1 4 LYS O O -7.071 -3.194 -1.327 1.00 . A A . 4 LYS O 1 1 17 3756 1 1 5 GLN C C -3.316 -3.537 -1.474 1.00 . A A . 5 GLN C 1 1 17 3757 1 1 5 GLN CA C -4.452 -2.739 -2.117 1.00 . A A . 5 GLN CA 1 1 17 3758 1 1 5 GLN CB C -3.895 -1.799 -3.190 1.00 . A A . 5 GLN CB 1 1 17 3759 1 1 5 GLN CD C -2.573 -1.547 -5.328 1.00 . A A . 5 GLN CD 1 1 17 3760 1 1 5 GLN CG C -3.107 -2.506 -4.281 1.00 . A A . 5 GLN CG 1 1 17 3761 1 1 5 GLN H H -4.751 -1.226 -0.669 1.00 . A A . 5 GLN H 1 1 17 3762 1 1 5 GLN HA H -5.141 -3.430 -2.581 1.00 . A A . 5 GLN HA 1 1 17 3763 1 1 5 GLN HB2 H -4.718 -1.275 -3.655 1.00 . A A . 5 GLN HB2 1 1 17 3764 1 1 5 GLN HB3 H -3.245 -1.078 -2.717 1.00 . A A . 5 GLN HB3 1 1 17 3765 1 1 5 GLN HE21 H -0.707 -2.097 -4.917 1.00 . A A . 5 GLN HE21 1 1 17 3766 1 1 5 GLN HE22 H -0.883 -0.901 -6.151 1.00 . A A . 5 GLN HE22 1 1 17 3767 1 1 5 GLN HG2 H -2.271 -3.019 -3.830 1.00 . A A . 5 GLN HG2 1 1 17 3768 1 1 5 GLN HG3 H -3.751 -3.224 -4.766 1.00 . A A . 5 GLN HG3 1 1 17 3769 1 1 5 GLN N N -5.193 -1.975 -1.119 1.00 . A A . 5 GLN N 1 1 17 3770 1 1 5 GLN NE2 N -1.256 -1.511 -5.481 1.00 . A A . 5 GLN NE2 1 1 17 3771 1 1 5 GLN O O -2.629 -4.304 -2.147 1.00 . A A . 5 GLN O 1 1 17 3772 1 1 5 GLN OE1 O -3.338 -0.848 -5.993 1.00 . A A . 5 GLN OE1 1 1 17 3773 1 1 6 TYR C C -0.693 -3.623 0.071 1.00 . A A . 6 TYR C 1 1 17 3774 1 1 6 TYR CA C -2.071 -4.058 0.558 1.00 . A A . 6 TYR CA 1 1 17 3775 1 1 6 TYR CB C -2.227 -5.575 0.402 1.00 . A A . 6 TYR CB 1 1 17 3776 1 1 6 TYR CD1 C -4.504 -5.301 1.497 1.00 . A A . 6 TYR CD1 1 1 17 3777 1 1 6 TYR CD2 C -3.816 -7.488 0.840 1.00 . A A . 6 TYR CD2 1 1 17 3778 1 1 6 TYR CE1 C -5.695 -5.816 1.971 1.00 . A A . 6 TYR CE1 1 1 17 3779 1 1 6 TYR CE2 C -5.007 -8.008 1.311 1.00 . A A . 6 TYR CE2 1 1 17 3780 1 1 6 TYR CG C -3.541 -6.128 0.922 1.00 . A A . 6 TYR CG 1 1 17 3781 1 1 6 TYR CZ C -5.943 -7.168 1.875 1.00 . A A . 6 TYR CZ 1 1 17 3782 1 1 6 TYR H H -3.701 -2.732 0.319 1.00 . A A . 6 TYR H 1 1 17 3783 1 1 6 TYR HA H -2.165 -3.802 1.603 1.00 . A A . 6 TYR HA 1 1 17 3784 1 1 6 TYR HB2 H -2.156 -5.830 -0.644 1.00 . A A . 6 TYR HB2 1 1 17 3785 1 1 6 TYR HB3 H -1.427 -6.065 0.937 1.00 . A A . 6 TYR HB3 1 1 17 3786 1 1 6 TYR HD1 H -4.310 -4.243 1.573 1.00 . A A . 6 TYR HD1 1 1 17 3787 1 1 6 TYR HD2 H -3.082 -8.145 0.397 1.00 . A A . 6 TYR HD2 1 1 17 3788 1 1 6 TYR HE1 H -6.429 -5.158 2.412 1.00 . A A . 6 TYR HE1 1 1 17 3789 1 1 6 TYR HE2 H -5.199 -9.068 1.236 1.00 . A A . 6 TYR HE2 1 1 17 3790 1 1 6 TYR HH H -7.441 -8.367 1.748 1.00 . A A . 6 TYR HH 1 1 17 3791 1 1 6 TYR N N -3.123 -3.354 -0.167 1.00 . A A . 6 TYR N 1 1 17 3792 1 1 6 TYR O O -0.151 -4.190 -0.878 1.00 . A A . 6 TYR O 1 1 17 3793 1 1 6 TYR OH O -7.129 -7.682 2.345 1.00 . A A . 6 TYR OH 1 1 17 3794 1 1 7 TRP C C 2.268 -3.139 0.616 1.00 . A A . 7 TRP C 1 1 17 3795 1 1 7 TRP CA C 1.182 -2.097 0.364 1.00 . A A . 7 TRP CA 1 1 17 3796 1 1 7 TRP CB C 1.489 -0.823 1.152 1.00 . A A . 7 TRP CB 1 1 17 3797 1 1 7 TRP CD1 C 2.300 -1.873 3.344 1.00 . A A . 7 TRP CD1 1 1 17 3798 1 1 7 TRP CD2 C 0.648 -0.384 3.595 1.00 . A A . 7 TRP CD2 1 1 17 3799 1 1 7 TRP CE2 C 1.000 -0.882 4.864 1.00 . A A . 7 TRP CE2 1 1 17 3800 1 1 7 TRP CE3 C -0.370 0.570 3.504 1.00 . A A . 7 TRP CE3 1 1 17 3801 1 1 7 TRP CG C 1.493 -1.030 2.636 1.00 . A A . 7 TRP CG 1 1 17 3802 1 1 7 TRP CH2 C -0.625 0.474 5.912 1.00 . A A . 7 TRP CH2 1 1 17 3803 1 1 7 TRP CZ2 C 0.368 -0.459 6.031 1.00 . A A . 7 TRP CZ2 1 1 17 3804 1 1 7 TRP CZ3 C -0.997 0.988 4.664 1.00 . A A . 7 TRP CZ3 1 1 17 3805 1 1 7 TRP H H -0.615 -2.202 1.475 1.00 . A A . 7 TRP H 1 1 17 3806 1 1 7 TRP HA H 1.165 -1.862 -0.691 1.00 . A A . 7 TRP HA 1 1 17 3807 1 1 7 TRP HB2 H 2.462 -0.455 0.864 1.00 . A A . 7 TRP HB2 1 1 17 3808 1 1 7 TRP HB3 H 0.743 -0.076 0.921 1.00 . A A . 7 TRP HB3 1 1 17 3809 1 1 7 TRP HD1 H 3.053 -2.508 2.902 1.00 . A A . 7 TRP HD1 1 1 17 3810 1 1 7 TRP HE1 H 2.454 -2.297 5.396 1.00 . A A . 7 TRP HE1 1 1 17 3811 1 1 7 TRP HE3 H -0.670 0.978 2.550 1.00 . A A . 7 TRP HE3 1 1 17 3812 1 1 7 TRP HH2 H -1.142 0.830 6.791 1.00 . A A . 7 TRP HH2 1 1 17 3813 1 1 7 TRP HZ2 H 0.643 -0.845 7.001 1.00 . A A . 7 TRP HZ2 1 1 17 3814 1 1 7 TRP HZ3 H -1.786 1.723 4.612 1.00 . A A . 7 TRP HZ3 1 1 17 3815 1 1 7 TRP N N -0.132 -2.613 0.728 1.00 . A A . 7 TRP N 1 1 17 3816 1 1 7 TRP NE1 N 2.010 -1.790 4.684 1.00 . A A . 7 TRP NE1 1 1 17 3817 1 1 7 TRP O O 1.981 -4.261 1.035 1.00 . A A . 7 TRP O 1 1 17 3818 1 1 8 TRP C C 5.955 -2.878 0.389 1.00 . A A . 8 TRP C 1 1 17 3819 1 1 8 TRP CA C 4.645 -3.657 0.558 1.00 . A A . 8 TRP CA 1 1 17 3820 1 1 8 TRP CB C 4.565 -4.821 -0.438 1.00 . A A . 8 TRP CB 1 1 17 3821 1 1 8 TRP CD1 C 5.825 -6.943 -1.110 1.00 . A A . 8 TRP CD1 1 1 17 3822 1 1 8 TRP CD2 C 6.693 -5.930 0.692 1.00 . A A . 8 TRP CD2 1 1 17 3823 1 1 8 TRP CE2 C 7.465 -7.073 0.397 1.00 . A A . 8 TRP CE2 1 1 17 3824 1 1 8 TRP CE3 C 7.058 -5.149 1.799 1.00 . A A . 8 TRP CE3 1 1 17 3825 1 1 8 TRP CG C 5.662 -5.845 -0.313 1.00 . A A . 8 TRP CG 1 1 17 3826 1 1 8 TRP CH2 C 8.893 -6.669 2.231 1.00 . A A . 8 TRP CH2 1 1 17 3827 1 1 8 TRP CZ2 C 8.567 -7.450 1.160 1.00 . A A . 8 TRP CZ2 1 1 17 3828 1 1 8 TRP CZ3 C 8.150 -5.531 2.555 1.00 . A A . 8 TRP CZ3 1 1 17 3829 1 1 8 TRP H H 3.678 -1.851 0.027 1.00 . A A . 8 TRP H 1 1 17 3830 1 1 8 TRP HA H 4.596 -4.042 1.560 1.00 . A A . 8 TRP HA 1 1 17 3831 1 1 8 TRP HB2 H 3.626 -5.333 -0.293 1.00 . A A . 8 TRP HB2 1 1 17 3832 1 1 8 TRP HB3 H 4.591 -4.425 -1.442 1.00 . A A . 8 TRP HB3 1 1 17 3833 1 1 8 TRP HD1 H 5.195 -7.175 -1.956 1.00 . A A . 8 TRP HD1 1 1 17 3834 1 1 8 TRP HE1 H 7.253 -8.479 -1.143 1.00 . A A . 8 TRP HE1 1 1 17 3835 1 1 8 TRP HE3 H 6.498 -4.272 2.074 1.00 . A A . 8 TRP HE3 1 1 17 3836 1 1 8 TRP HH2 H 9.739 -6.929 2.853 1.00 . A A . 8 TRP HH2 1 1 17 3837 1 1 8 TRP HZ2 H 9.153 -8.326 0.923 1.00 . A A . 8 TRP HZ2 1 1 17 3838 1 1 8 TRP HZ3 H 8.441 -4.940 3.412 1.00 . A A . 8 TRP HZ3 1 1 17 3839 1 1 8 TRP N N 3.514 -2.758 0.359 1.00 . A A . 8 TRP N 1 1 17 3840 1 1 8 TRP NE1 N 6.920 -7.664 -0.710 1.00 . A A . 8 TRP NE1 1 1 17 3841 1 1 8 TRP O O 6.407 -2.208 1.318 1.00 . A A . 8 TRP O 1 1 17 3842 1 1 9 ARG C C 7.620 -0.744 -0.967 1.00 . A A . 9 ARG C 1 1 17 3843 1 1 9 ARG CA C 7.807 -2.259 -1.061 1.00 . A A . 9 ARG CA 1 1 17 3844 1 1 9 ARG CB C 8.351 -2.642 -2.440 1.00 . A A . 9 ARG CB 1 1 17 3845 1 1 9 ARG CD C 9.679 -4.592 -1.578 1.00 . A A . 9 ARG CD 1 1 17 3846 1 1 9 ARG CG C 8.643 -4.126 -2.588 1.00 . A A . 9 ARG CG 1 1 17 3847 1 1 9 ARG CZ C 10.841 -6.670 -0.942 1.00 . A A . 9 ARG CZ 1 1 17 3848 1 1 9 ARG H H 6.156 -3.504 -1.495 1.00 . A A . 9 ARG H 1 1 17 3849 1 1 9 ARG HA H 8.521 -2.564 -0.311 1.00 . A A . 9 ARG HA 1 1 17 3850 1 1 9 ARG HB2 H 7.627 -2.367 -3.192 1.00 . A A . 9 ARG HB2 1 1 17 3851 1 1 9 ARG HB3 H 9.265 -2.098 -2.618 1.00 . A A . 9 ARG HB3 1 1 17 3852 1 1 9 ARG HD2 H 10.591 -4.034 -1.733 1.00 . A A . 9 ARG HD2 1 1 17 3853 1 1 9 ARG HD3 H 9.305 -4.400 -0.582 1.00 . A A . 9 ARG HD3 1 1 17 3854 1 1 9 ARG HE H 9.490 -6.516 -2.403 1.00 . A A . 9 ARG HE 1 1 17 3855 1 1 9 ARG HG2 H 7.730 -4.681 -2.432 1.00 . A A . 9 ARG HG2 1 1 17 3856 1 1 9 ARG HG3 H 9.015 -4.314 -3.584 1.00 . A A . 9 ARG HG3 1 1 17 3857 1 1 9 ARG HH11 H 11.360 -5.052 0.154 1.00 . A A . 9 ARG HH11 1 1 17 3858 1 1 9 ARG HH12 H 12.162 -6.525 0.581 1.00 . A A . 9 ARG HH12 1 1 17 3859 1 1 9 ARG HH21 H 10.544 -8.456 -1.843 1.00 . A A . 9 ARG HH21 1 1 17 3860 1 1 9 ARG HH22 H 11.700 -8.457 -0.553 1.00 . A A . 9 ARG HH22 1 1 17 3861 1 1 9 ARG N N 6.559 -2.962 -0.791 1.00 . A A . 9 ARG N 1 1 17 3862 1 1 9 ARG NE N 9.970 -6.019 -1.709 1.00 . A A . 9 ARG NE 1 1 17 3863 1 1 9 ARG NH1 N 11.509 -6.030 0.009 1.00 . A A . 9 ARG NH1 1 1 17 3864 1 1 9 ARG NH2 N 11.045 -7.967 -1.128 1.00 . A A . 9 ARG NH2 1 1 17 3865 1 1 9 ARG O O 8.328 -0.075 -0.213 1.00 . A A . 9 ARG O 1 1 17 3866 1 1 10 PRO C C 6.036 1.776 -0.321 1.00 . A A . 10 PRO C 1 1 17 3867 1 1 10 PRO CA C 6.410 1.272 -1.710 1.00 . A A . 10 PRO CA 1 1 17 3868 1 1 10 PRO CB C 5.241 1.457 -2.689 1.00 . A A . 10 PRO CB 1 1 17 3869 1 1 10 PRO CD C 5.768 -0.875 -2.662 1.00 . A A . 10 PRO CD 1 1 17 3870 1 1 10 PRO CG C 4.644 0.101 -2.853 1.00 . A A . 10 PRO CG 1 1 17 3871 1 1 10 PRO HA H 7.261 1.822 -2.061 1.00 . A A . 10 PRO HA 1 1 17 3872 1 1 10 PRO HB2 H 4.530 2.155 -2.274 1.00 . A A . 10 PRO HB2 1 1 17 3873 1 1 10 PRO HB3 H 5.616 1.836 -3.629 1.00 . A A . 10 PRO HB3 1 1 17 3874 1 1 10 PRO HD2 H 5.398 -1.792 -2.233 1.00 . A A . 10 PRO HD2 1 1 17 3875 1 1 10 PRO HD3 H 6.261 -1.068 -3.602 1.00 . A A . 10 PRO HD3 1 1 17 3876 1 1 10 PRO HG2 H 3.880 -0.056 -2.105 1.00 . A A . 10 PRO HG2 1 1 17 3877 1 1 10 PRO HG3 H 4.225 0.002 -3.843 1.00 . A A . 10 PRO HG3 1 1 17 3878 1 1 10 PRO N N 6.666 -0.172 -1.729 1.00 . A A . 10 PRO N 1 1 17 3879 1 1 10 PRO O O 6.852 2.384 0.372 1.00 . A A . 10 PRO O 1 1 17 3880 1 1 11 SER C C 4.350 3.461 1.513 1.00 . A A . 11 SER C 1 1 17 3881 1 1 11 SER CA C 4.308 1.942 1.382 1.00 . A A . 11 SER CA 1 1 17 3882 1 1 11 SER CB C 5.137 1.300 2.496 1.00 . A A . 11 SER CB 1 1 17 3883 1 1 11 SER H H 4.207 1.031 -0.525 1.00 . A A . 11 SER H 1 1 17 3884 1 1 11 SER HA H 3.284 1.612 1.472 1.00 . A A . 11 SER HA 1 1 17 3885 1 1 11 SER HB2 H 6.168 1.600 2.395 1.00 . A A . 11 SER HB2 1 1 17 3886 1 1 11 SER HB3 H 4.760 1.624 3.455 1.00 . A A . 11 SER HB3 1 1 17 3887 1 1 11 SER HG H 4.147 -0.389 2.396 1.00 . A A . 11 SER HG 1 1 17 3888 1 1 11 SER N N 4.801 1.519 0.076 1.00 . A A . 11 SER N 1 1 17 3889 1 1 11 SER O O 4.916 4.152 0.666 1.00 . A A . 11 SER O 1 1 17 3890 1 1 11 SER OG O 5.066 -0.115 2.434 1.00 . A A . 11 SER OG 1 1 17 3891 1 1 12 ILE C C 2.961 6.134 1.708 1.00 . A A . 12 ILE C 1 1 17 3892 1 1 12 ILE CA C 3.715 5.411 2.823 1.00 . A A . 12 ILE CA 1 1 17 3893 1 1 12 ILE CB C 5.140 5.992 2.934 1.00 . A A . 12 ILE CB 1 1 17 3894 1 1 12 ILE CD1 C 5.232 5.519 5.433 1.00 . A A . 12 ILE CD1 1 1 17 3895 1 1 12 ILE CG1 C 5.895 5.326 4.086 1.00 . A A . 12 ILE CG1 1 1 17 3896 1 1 12 ILE CG2 C 5.092 7.501 3.133 1.00 . A A . 12 ILE CG2 1 1 17 3897 1 1 12 ILE H H 3.313 3.372 3.220 1.00 . A A . 12 ILE H 1 1 17 3898 1 1 12 ILE HA H 3.204 5.580 3.759 1.00 . A A . 12 ILE HA 1 1 17 3899 1 1 12 ILE HB H 5.661 5.792 2.010 1.00 . A A . 12 ILE HB 1 1 17 3900 1 1 12 ILE HD11 H 4.898 4.564 5.810 1.00 . A A . 12 ILE HD11 1 1 17 3901 1 1 12 ILE HD12 H 4.386 6.181 5.328 1.00 . A A . 12 ILE HD12 1 1 17 3902 1 1 12 ILE HD13 H 5.942 5.951 6.125 1.00 . A A . 12 ILE HD13 1 1 17 3903 1 1 12 ILE HG12 H 5.960 4.265 3.900 1.00 . A A . 12 ILE HG12 1 1 17 3904 1 1 12 ILE HG13 H 6.891 5.739 4.143 1.00 . A A . 12 ILE HG13 1 1 17 3905 1 1 12 ILE HG21 H 5.211 7.994 2.180 1.00 . A A . 12 ILE HG21 1 1 17 3906 1 1 12 ILE HG22 H 5.889 7.803 3.797 1.00 . A A . 12 ILE HG22 1 1 17 3907 1 1 12 ILE HG23 H 4.141 7.777 3.564 1.00 . A A . 12 ILE HG23 1 1 17 3908 1 1 12 ILE N N 3.746 3.974 2.581 1.00 . A A . 12 ILE N 1 1 17 3909 1 1 12 ILE O O 1.757 6.409 1.892 1.00 . A A . 12 ILE O 1 1 17 3910 1 1 12 ILE OXT O 3.582 6.419 0.664 1.00 . A A . 12 ILE OXT 1 1 18 3911 1 1 1 HIS C C -5.466 4.427 2.412 1.00 . A A . 1 HIS C 1 1 18 3912 1 1 1 HIS CA C -5.743 5.406 3.551 1.00 . A A . 1 HIS CA 1 1 18 3913 1 1 1 HIS CB C -5.626 4.693 4.900 1.00 . A A . 1 HIS CB 1 1 18 3914 1 1 1 HIS CD2 C -6.761 5.556 7.067 1.00 . A A . 1 HIS CD2 1 1 18 3915 1 1 1 HIS CE1 C -5.480 7.298 7.428 1.00 . A A . 1 HIS CE1 1 1 18 3916 1 1 1 HIS CG C -5.840 5.596 6.074 1.00 . A A . 1 HIS CG 1 1 18 3917 1 1 1 HIS H1 H -7.154 6.810 4.071 1.00 . A A . 1 HIS H1 1 1 18 3918 1 1 1 HIS H2 H -7.787 5.252 3.726 1.00 . A A . 1 HIS H2 1 1 18 3919 1 1 1 HIS H3 H -7.252 6.266 2.449 1.00 . A A . 1 HIS H3 1 1 18 3920 1 1 1 HIS HA H -5.023 6.210 3.509 1.00 . A A . 1 HIS HA 1 1 18 3921 1 1 1 HIS HB2 H -6.362 3.905 4.948 1.00 . A A . 1 HIS HB2 1 1 18 3922 1 1 1 HIS HB3 H -4.638 4.262 4.986 1.00 . A A . 1 HIS HB3 1 1 18 3923 1 1 1 HIS HD1 H -4.294 7.000 5.786 1.00 . A A . 1 HIS HD1 1 1 18 3924 1 1 1 HIS HD2 H -7.543 4.820 7.186 1.00 . A A . 1 HIS HD2 1 1 18 3925 1 1 1 HIS HE1 H -5.054 8.188 7.869 1.00 . A A . 1 HIS HE1 1 1 18 3926 1 1 1 HIS HE2 H -6.978 6.812 8.736 1.00 . A A . 1 HIS HE2 1 1 18 3927 1 1 1 HIS N N -7.107 5.986 3.439 1.00 . A A . 1 HIS N 1 1 18 3928 1 1 1 HIS ND1 N -5.053 6.701 6.329 1.00 . A A . 1 HIS ND1 1 1 18 3929 1 1 1 HIS NE2 N -6.514 6.625 7.893 1.00 . A A . 1 HIS NE2 1 1 18 3930 1 1 1 HIS O O -6.361 3.705 1.974 1.00 . A A . 1 HIS O 1 1 18 3931 1 1 2 PRO C C -3.602 2.063 1.293 1.00 . A A . 2 PRO C 1 1 18 3932 1 1 2 PRO CA C -3.831 3.496 0.820 1.00 . A A . 2 PRO CA 1 1 18 3933 1 1 2 PRO CB C -2.526 4.111 0.321 1.00 . A A . 2 PRO CB 1 1 18 3934 1 1 2 PRO CD C -3.085 5.219 2.373 1.00 . A A . 2 PRO CD 1 1 18 3935 1 1 2 PRO CG C -1.929 4.748 1.527 1.00 . A A . 2 PRO CG 1 1 18 3936 1 1 2 PRO HA H -4.563 3.500 0.027 1.00 . A A . 2 PRO HA 1 1 18 3937 1 1 2 PRO HB2 H -1.888 3.334 -0.076 1.00 . A A . 2 PRO HB2 1 1 18 3938 1 1 2 PRO HB3 H -2.737 4.838 -0.447 1.00 . A A . 2 PRO HB3 1 1 18 3939 1 1 2 PRO HD2 H -2.881 5.044 3.419 1.00 . A A . 2 PRO HD2 1 1 18 3940 1 1 2 PRO HD3 H -3.279 6.266 2.196 1.00 . A A . 2 PRO HD3 1 1 18 3941 1 1 2 PRO HG2 H -1.339 4.025 2.070 1.00 . A A . 2 PRO HG2 1 1 18 3942 1 1 2 PRO HG3 H -1.316 5.587 1.233 1.00 . A A . 2 PRO HG3 1 1 18 3943 1 1 2 PRO N N -4.217 4.390 1.913 1.00 . A A . 2 PRO N 1 1 18 3944 1 1 2 PRO O O -2.525 1.499 1.098 1.00 . A A . 2 PRO O 1 1 18 3945 1 1 3 LEU C C -5.467 -0.826 1.657 1.00 . A A . 3 LEU C 1 1 18 3946 1 1 3 LEU CA C -4.530 0.112 2.415 1.00 . A A . 3 LEU CA 1 1 18 3947 1 1 3 LEU CB C -4.821 0.081 3.921 1.00 . A A . 3 LEU CB 1 1 18 3948 1 1 3 LEU CD1 C -7.323 -0.197 3.725 1.00 . A A . 3 LEU CD1 1 1 18 3949 1 1 3 LEU CD2 C -6.314 0.612 5.865 1.00 . A A . 3 LEU CD2 1 1 18 3950 1 1 3 LEU CG C -6.195 0.610 4.348 1.00 . A A . 3 LEU CG 1 1 18 3951 1 1 3 LEU H H -5.454 1.979 2.040 1.00 . A A . 3 LEU H 1 1 18 3952 1 1 3 LEU HA H -3.518 -0.221 2.257 1.00 . A A . 3 LEU HA 1 1 18 3953 1 1 3 LEU HB2 H -4.735 -0.941 4.259 1.00 . A A . 3 LEU HB2 1 1 18 3954 1 1 3 LEU HB3 H -4.066 0.669 4.421 1.00 . A A . 3 LEU HB3 1 1 18 3955 1 1 3 LEU HD11 H -8.226 -0.058 4.301 1.00 . A A . 3 LEU HD11 1 1 18 3956 1 1 3 LEU HD12 H -7.058 -1.245 3.721 1.00 . A A . 3 LEU HD12 1 1 18 3957 1 1 3 LEU HD13 H -7.488 0.137 2.711 1.00 . A A . 3 LEU HD13 1 1 18 3958 1 1 3 LEU HD21 H -7.326 0.865 6.146 1.00 . A A . 3 LEU HD21 1 1 18 3959 1 1 3 LEU HD22 H -5.633 1.341 6.278 1.00 . A A . 3 LEU HD22 1 1 18 3960 1 1 3 LEU HD23 H -6.068 -0.367 6.246 1.00 . A A . 3 LEU HD23 1 1 18 3961 1 1 3 LEU HG H -6.292 1.630 4.005 1.00 . A A . 3 LEU HG 1 1 18 3962 1 1 3 LEU N N -4.621 1.480 1.915 1.00 . A A . 3 LEU N 1 1 18 3963 1 1 3 LEU O O -5.755 -1.932 2.116 1.00 . A A . 3 LEU O 1 1 18 3964 1 1 4 LYS C C -6.087 -2.315 -1.021 1.00 . A A . 4 LYS C 1 1 18 3965 1 1 4 LYS CA C -6.840 -1.185 -0.322 1.00 . A A . 4 LYS CA 1 1 18 3966 1 1 4 LYS CB C -7.546 -0.306 -1.356 1.00 . A A . 4 LYS CB 1 1 18 3967 1 1 4 LYS CD C -9.181 -0.151 -3.258 1.00 . A A . 4 LYS CD 1 1 18 3968 1 1 4 LYS CE C -10.146 -0.912 -4.151 1.00 . A A . 4 LYS CE 1 1 18 3969 1 1 4 LYS CG C -8.509 -1.070 -2.250 1.00 . A A . 4 LYS CG 1 1 18 3970 1 1 4 LYS H H -5.672 0.507 0.178 1.00 . A A . 4 LYS H 1 1 18 3971 1 1 4 LYS HA H -7.579 -1.618 0.333 1.00 . A A . 4 LYS HA 1 1 18 3972 1 1 4 LYS HB2 H -8.100 0.463 -0.840 1.00 . A A . 4 LYS HB2 1 1 18 3973 1 1 4 LYS HB3 H -6.800 0.159 -1.984 1.00 . A A . 4 LYS HB3 1 1 18 3974 1 1 4 LYS HD2 H -9.725 0.615 -2.725 1.00 . A A . 4 LYS HD2 1 1 18 3975 1 1 4 LYS HD3 H -8.420 0.308 -3.873 1.00 . A A . 4 LYS HD3 1 1 18 3976 1 1 4 LYS HE2 H -9.600 -1.677 -4.680 1.00 . A A . 4 LYS HE2 1 1 18 3977 1 1 4 LYS HE3 H -10.903 -1.371 -3.532 1.00 . A A . 4 LYS HE3 1 1 18 3978 1 1 4 LYS HG2 H -7.963 -1.833 -2.783 1.00 . A A . 4 LYS HG2 1 1 18 3979 1 1 4 LYS HG3 H -9.269 -1.531 -1.634 1.00 . A A . 4 LYS HG3 1 1 18 3980 1 1 4 LYS HZ1 H -10.173 0.155 -5.947 1.00 . A A . 4 LYS HZ1 1 1 18 3981 1 1 4 LYS HZ2 H -11.044 0.894 -4.699 1.00 . A A . 4 LYS HZ2 1 1 18 3982 1 1 4 LYS HZ3 H -11.683 -0.458 -5.491 1.00 . A A . 4 LYS HZ3 1 1 18 3983 1 1 4 LYS N N -5.939 -0.380 0.495 1.00 . A A . 4 LYS N 1 1 18 3984 1 1 4 LYS NZ N -10.808 -0.018 -5.141 1.00 . A A . 4 LYS NZ 1 1 18 3985 1 1 4 LYS O O -6.687 -3.300 -1.452 1.00 . A A . 4 LYS O 1 1 18 3986 1 1 5 GLN C C -2.937 -3.776 -0.778 1.00 . A A . 5 GLN C 1 1 18 3987 1 1 5 GLN CA C -3.933 -3.173 -1.771 1.00 . A A . 5 GLN CA 1 1 18 3988 1 1 5 GLN CB C -3.188 -2.556 -2.958 1.00 . A A . 5 GLN CB 1 1 18 3989 1 1 5 GLN CD C -1.567 -2.892 -4.867 1.00 . A A . 5 GLN CD 1 1 18 3990 1 1 5 GLN CG C -2.287 -3.533 -3.696 1.00 . A A . 5 GLN CG 1 1 18 3991 1 1 5 GLN H H -4.352 -1.360 -0.762 1.00 . A A . 5 GLN H 1 1 18 3992 1 1 5 GLN HA H -4.579 -3.958 -2.134 1.00 . A A . 5 GLN HA 1 1 18 3993 1 1 5 GLN HB2 H -3.911 -2.168 -3.660 1.00 . A A . 5 GLN HB2 1 1 18 3994 1 1 5 GLN HB3 H -2.577 -1.740 -2.598 1.00 . A A . 5 GLN HB3 1 1 18 3995 1 1 5 GLN HE21 H 0.195 -3.326 -4.055 1.00 . A A . 5 GLN HE21 1 1 18 3996 1 1 5 GLN HE22 H 0.250 -2.500 -5.572 1.00 . A A . 5 GLN HE22 1 1 18 3997 1 1 5 GLN HG2 H -1.548 -3.914 -3.008 1.00 . A A . 5 GLN HG2 1 1 18 3998 1 1 5 GLN HG3 H -2.890 -4.350 -4.066 1.00 . A A . 5 GLN HG3 1 1 18 3999 1 1 5 GLN N N -4.771 -2.166 -1.128 1.00 . A A . 5 GLN N 1 1 18 4000 1 1 5 GLN NE2 N -0.240 -2.908 -4.827 1.00 . A A . 5 GLN NE2 1 1 18 4001 1 1 5 GLN O O -2.201 -4.703 -1.112 1.00 . A A . 5 GLN O 1 1 18 4002 1 1 5 GLN OE1 O -2.198 -2.389 -5.797 1.00 . A A . 5 GLN OE1 1 1 18 4003 1 1 6 TYR C C -0.565 -3.350 1.193 1.00 . A A . 6 TYR C 1 1 18 4004 1 1 6 TYR CA C -2.018 -3.722 1.492 1.00 . A A . 6 TYR CA 1 1 18 4005 1 1 6 TYR CB C -2.142 -5.242 1.662 1.00 . A A . 6 TYR CB 1 1 18 4006 1 1 6 TYR CD1 C -4.584 -4.825 2.231 1.00 . A A . 6 TYR CD1 1 1 18 4007 1 1 6 TYR CD2 C -3.786 -7.073 2.233 1.00 . A A . 6 TYR CD2 1 1 18 4008 1 1 6 TYR CE1 C -5.844 -5.269 2.584 1.00 . A A . 6 TYR CE1 1 1 18 4009 1 1 6 TYR CE2 C -5.044 -7.522 2.585 1.00 . A A . 6 TYR CE2 1 1 18 4010 1 1 6 TYR CG C -3.531 -5.719 2.049 1.00 . A A . 6 TYR CG 1 1 18 4011 1 1 6 TYR CZ C -6.069 -6.617 2.759 1.00 . A A . 6 TYR CZ 1 1 18 4012 1 1 6 TYR H H -3.530 -2.504 0.650 1.00 . A A . 6 TYR H 1 1 18 4013 1 1 6 TYR HA H -2.310 -3.245 2.415 1.00 . A A . 6 TYR HA 1 1 18 4014 1 1 6 TYR HB2 H -1.877 -5.725 0.736 1.00 . A A . 6 TYR HB2 1 1 18 4015 1 1 6 TYR HB3 H -1.457 -5.563 2.434 1.00 . A A . 6 TYR HB3 1 1 18 4016 1 1 6 TYR HD1 H -4.407 -3.769 2.094 1.00 . A A . 6 TYR HD1 1 1 18 4017 1 1 6 TYR HD2 H -2.982 -7.781 2.095 1.00 . A A . 6 TYR HD2 1 1 18 4018 1 1 6 TYR HE1 H -6.647 -4.559 2.721 1.00 . A A . 6 TYR HE1 1 1 18 4019 1 1 6 TYR HE2 H -5.221 -8.578 2.724 1.00 . A A . 6 TYR HE2 1 1 18 4020 1 1 6 TYR HH H -7.499 -6.834 4.026 1.00 . A A . 6 TYR HH 1 1 18 4021 1 1 6 TYR N N -2.921 -3.242 0.445 1.00 . A A . 6 TYR N 1 1 18 4022 1 1 6 TYR O O 0.345 -3.796 1.888 1.00 . A A . 6 TYR O 1 1 18 4023 1 1 6 TYR OH O -7.323 -7.062 3.110 1.00 . A A . 6 TYR OH 1 1 18 4024 1 1 7 TRP C C 2.001 -3.218 -0.152 1.00 . A A . 7 TRP C 1 1 18 4025 1 1 7 TRP CA C 0.980 -2.080 -0.234 1.00 . A A . 7 TRP CA 1 1 18 4026 1 1 7 TRP CB C 1.424 -0.899 0.638 1.00 . A A . 7 TRP CB 1 1 18 4027 1 1 7 TRP CD1 C 2.289 -2.164 2.694 1.00 . A A . 7 TRP CD1 1 1 18 4028 1 1 7 TRP CD2 C 0.753 -0.601 3.153 1.00 . A A . 7 TRP CD2 1 1 18 4029 1 1 7 TRP CE2 C 1.143 -1.216 4.358 1.00 . A A . 7 TRP CE2 1 1 18 4030 1 1 7 TRP CE3 C -0.204 0.416 3.195 1.00 . A A . 7 TRP CE3 1 1 18 4031 1 1 7 TRP CG C 1.500 -1.221 2.100 1.00 . A A . 7 TRP CG 1 1 18 4032 1 1 7 TRP CH2 C -0.330 0.151 5.601 1.00 . A A . 7 TRP CH2 1 1 18 4033 1 1 7 TRP CZ2 C 0.607 -0.846 5.590 1.00 . A A . 7 TRP CZ2 1 1 18 4034 1 1 7 TRP CZ3 C -0.737 0.780 4.418 1.00 . A A . 7 TRP CZ3 1 1 18 4035 1 1 7 TRP H H -1.129 -2.201 -0.348 1.00 . A A . 7 TRP H 1 1 18 4036 1 1 7 TRP HA H 0.921 -1.748 -1.260 1.00 . A A . 7 TRP HA 1 1 18 4037 1 1 7 TRP HB2 H 2.400 -0.569 0.319 1.00 . A A . 7 TRP HB2 1 1 18 4038 1 1 7 TRP HB3 H 0.720 -0.088 0.512 1.00 . A A . 7 TRP HB3 1 1 18 4039 1 1 7 TRP HD1 H 2.974 -2.807 2.160 1.00 . A A . 7 TRP HD1 1 1 18 4040 1 1 7 TRP HE1 H 2.531 -2.751 4.695 1.00 . A A . 7 TRP HE1 1 1 18 4041 1 1 7 TRP HE3 H -0.531 0.913 2.293 1.00 . A A . 7 TRP HE3 1 1 18 4042 1 1 7 TRP HH2 H -0.773 0.467 6.534 1.00 . A A . 7 TRP HH2 1 1 18 4043 1 1 7 TRP HZ2 H 0.910 -1.322 6.511 1.00 . A A . 7 TRP HZ2 1 1 18 4044 1 1 7 TRP HZ3 H -1.479 1.564 4.469 1.00 . A A . 7 TRP HZ3 1 1 18 4045 1 1 7 TRP N N -0.358 -2.526 0.162 1.00 . A A . 7 TRP N 1 1 18 4046 1 1 7 TRP NE1 N 2.082 -2.165 4.051 1.00 . A A . 7 TRP NE1 1 1 18 4047 1 1 7 TRP O O 1.634 -4.389 -0.065 1.00 . A A . 7 TRP O 1 1 18 4048 1 1 8 TRP C C 5.696 -3.138 0.059 1.00 . A A . 8 TRP C 1 1 18 4049 1 1 8 TRP CA C 4.352 -3.853 -0.117 1.00 . A A . 8 TRP CA 1 1 18 4050 1 1 8 TRP CB C 4.347 -4.715 -1.387 1.00 . A A . 8 TRP CB 1 1 18 4051 1 1 8 TRP CD1 C 5.602 -6.670 -2.457 1.00 . A A . 8 TRP CD1 1 1 18 4052 1 1 8 TRP CD2 C 6.285 -6.215 -0.370 1.00 . A A . 8 TRP CD2 1 1 18 4053 1 1 8 TRP CE2 C 7.045 -7.291 -0.873 1.00 . A A . 8 TRP CE2 1 1 18 4054 1 1 8 TRP CE3 C 6.543 -5.770 0.934 1.00 . A A . 8 TRP CE3 1 1 18 4055 1 1 8 TRP CG C 5.385 -5.806 -1.421 1.00 . A A . 8 TRP CG 1 1 18 4056 1 1 8 TRP CH2 C 8.258 -7.469 1.144 1.00 . A A . 8 TRP CH2 1 1 18 4057 1 1 8 TRP CZ2 C 8.033 -7.925 -0.124 1.00 . A A . 8 TRP CZ2 1 1 18 4058 1 1 8 TRP CZ3 C 7.522 -6.404 1.675 1.00 . A A . 8 TRP CZ3 1 1 18 4059 1 1 8 TRP H H 3.517 -1.916 -0.262 1.00 . A A . 8 TRP H 1 1 18 4060 1 1 8 TRP HA H 4.176 -4.479 0.739 1.00 . A A . 8 TRP HA 1 1 18 4061 1 1 8 TRP HB2 H 3.381 -5.187 -1.480 1.00 . A A . 8 TRP HB2 1 1 18 4062 1 1 8 TRP HB3 H 4.506 -4.078 -2.244 1.00 . A A . 8 TRP HB3 1 1 18 4063 1 1 8 TRP HD1 H 5.070 -6.635 -3.397 1.00 . A A . 8 TRP HD1 1 1 18 4064 1 1 8 TRP HE1 H 6.967 -8.237 -2.740 1.00 . A A . 8 TRP HE1 1 1 18 4065 1 1 8 TRP HE3 H 5.986 -4.958 1.369 1.00 . A A . 8 TRP HE3 1 1 18 4066 1 1 8 TRP HH2 H 9.013 -7.934 1.761 1.00 . A A . 8 TRP HH2 1 1 18 4067 1 1 8 TRP HZ2 H 8.610 -8.747 -0.519 1.00 . A A . 8 TRP HZ2 1 1 18 4068 1 1 8 TRP HZ3 H 7.731 -6.076 2.683 1.00 . A A . 8 TRP HZ3 1 1 18 4069 1 1 8 TRP N N 3.283 -2.864 -0.187 1.00 . A A . 8 TRP N 1 1 18 4070 1 1 8 TRP NE1 N 6.615 -7.541 -2.148 1.00 . A A . 8 TRP NE1 1 1 18 4071 1 1 8 TRP O O 6.078 -2.794 1.178 1.00 . A A . 8 TRP O 1 1 18 4072 1 1 9 ARG C C 7.513 -0.731 -0.706 1.00 . A A . 9 ARG C 1 1 18 4073 1 1 9 ARG CA C 7.689 -2.225 -0.992 1.00 . A A . 9 ARG CA 1 1 18 4074 1 1 9 ARG CB C 8.455 -2.423 -2.302 1.00 . A A . 9 ARG CB 1 1 18 4075 1 1 9 ARG CD C 9.595 -4.528 -1.536 1.00 . A A . 9 ARG CD 1 1 18 4076 1 1 9 ARG CG C 8.751 -3.880 -2.621 1.00 . A A . 9 ARG CG 1 1 18 4077 1 1 9 ARG CZ C 10.612 -6.718 -1.040 1.00 . A A . 9 ARG CZ 1 1 18 4078 1 1 9 ARG H H 6.048 -3.193 -1.903 1.00 . A A . 9 ARG H 1 1 18 4079 1 1 9 ARG HA H 8.260 -2.663 -0.187 1.00 . A A . 9 ARG HA 1 1 18 4080 1 1 9 ARG HB2 H 7.874 -2.012 -3.113 1.00 . A A . 9 ARG HB2 1 1 18 4081 1 1 9 ARG HB3 H 9.395 -1.894 -2.240 1.00 . A A . 9 ARG HB3 1 1 18 4082 1 1 9 ARG HD2 H 10.526 -3.986 -1.451 1.00 . A A . 9 ARG HD2 1 1 18 4083 1 1 9 ARG HD3 H 9.061 -4.472 -0.600 1.00 . A A . 9 ARG HD3 1 1 18 4084 1 1 9 ARG HE H 9.530 -6.300 -2.665 1.00 . A A . 9 ARG HE 1 1 18 4085 1 1 9 ARG HG2 H 7.818 -4.416 -2.705 1.00 . A A . 9 ARG HG2 1 1 18 4086 1 1 9 ARG HG3 H 9.283 -3.932 -3.560 1.00 . A A . 9 ARG HG3 1 1 18 4087 1 1 9 ARG HH11 H 10.948 -5.301 0.364 1.00 . A A . 9 ARG HH11 1 1 18 4088 1 1 9 ARG HH12 H 11.656 -6.848 0.687 1.00 . A A . 9 ARG HH12 1 1 18 4089 1 1 9 ARG HH21 H 10.458 -8.336 -2.240 1.00 . A A . 9 ARG HH21 1 1 18 4090 1 1 9 ARG HH22 H 11.376 -8.572 -0.792 1.00 . A A . 9 ARG HH22 1 1 18 4091 1 1 9 ARG N N 6.401 -2.907 -1.042 1.00 . A A . 9 ARG N 1 1 18 4092 1 1 9 ARG NE N 9.889 -5.928 -1.832 1.00 . A A . 9 ARG NE 1 1 18 4093 1 1 9 ARG NH1 N 11.113 -6.250 0.097 1.00 . A A . 9 ARG NH1 1 1 18 4094 1 1 9 ARG NH2 N 10.834 -7.979 -1.385 1.00 . A A . 9 ARG NH2 1 1 18 4095 1 1 9 ARG O O 8.178 -0.184 0.174 1.00 . A A . 9 ARG O 1 1 18 4096 1 1 10 PRO C C 5.488 1.665 -0.035 1.00 . A A . 10 PRO C 1 1 18 4097 1 1 10 PRO CA C 6.374 1.386 -1.245 1.00 . A A . 10 PRO CA 1 1 18 4098 1 1 10 PRO CB C 5.662 1.793 -2.533 1.00 . A A . 10 PRO CB 1 1 18 4099 1 1 10 PRO CD C 5.769 -0.602 -2.519 1.00 . A A . 10 PRO CD 1 1 18 4100 1 1 10 PRO CG C 4.925 0.568 -2.953 1.00 . A A . 10 PRO CG 1 1 18 4101 1 1 10 PRO HA H 7.298 1.936 -1.150 1.00 . A A . 10 PRO HA 1 1 18 4102 1 1 10 PRO HB2 H 4.988 2.613 -2.333 1.00 . A A . 10 PRO HB2 1 1 18 4103 1 1 10 PRO HB3 H 6.390 2.088 -3.273 1.00 . A A . 10 PRO HB3 1 1 18 4104 1 1 10 PRO HD2 H 5.140 -1.396 -2.144 1.00 . A A . 10 PRO HD2 1 1 18 4105 1 1 10 PRO HD3 H 6.372 -0.953 -3.341 1.00 . A A . 10 PRO HD3 1 1 18 4106 1 1 10 PRO HG2 H 3.961 0.537 -2.466 1.00 . A A . 10 PRO HG2 1 1 18 4107 1 1 10 PRO HG3 H 4.804 0.564 -4.026 1.00 . A A . 10 PRO HG3 1 1 18 4108 1 1 10 PRO N N 6.615 -0.045 -1.442 1.00 . A A . 10 PRO N 1 1 18 4109 1 1 10 PRO O O 4.281 1.872 -0.170 1.00 . A A . 10 PRO O 1 1 18 4110 1 1 11 SER C C 5.042 3.409 2.528 1.00 . A A . 11 SER C 1 1 18 4111 1 1 11 SER CA C 5.360 1.924 2.382 1.00 . A A . 11 SER CA 1 1 18 4112 1 1 11 SER CB C 6.165 1.442 3.590 1.00 . A A . 11 SER CB 1 1 18 4113 1 1 11 SER H H 7.058 1.498 1.192 1.00 . A A . 11 SER H 1 1 18 4114 1 1 11 SER HA H 4.433 1.373 2.335 1.00 . A A . 11 SER HA 1 1 18 4115 1 1 11 SER HB2 H 7.107 1.968 3.625 1.00 . A A . 11 SER HB2 1 1 18 4116 1 1 11 SER HB3 H 5.608 1.640 4.494 1.00 . A A . 11 SER HB3 1 1 18 4117 1 1 11 SER HG H 5.625 -0.408 3.238 1.00 . A A . 11 SER HG 1 1 18 4118 1 1 11 SER N N 6.094 1.670 1.147 1.00 . A A . 11 SER N 1 1 18 4119 1 1 11 SER O O 5.940 4.232 2.703 1.00 . A A . 11 SER O 1 1 18 4120 1 1 11 SER OG O 6.424 0.050 3.508 1.00 . A A . 11 SER OG 1 1 18 4121 1 1 12 ILE C C 3.920 5.989 1.465 1.00 . A A . 12 ILE C 1 1 18 4122 1 1 12 ILE CA C 3.322 5.129 2.576 1.00 . A A . 12 ILE CA 1 1 18 4123 1 1 12 ILE CB C 3.713 5.722 3.946 1.00 . A A . 12 ILE CB 1 1 18 4124 1 1 12 ILE CD1 C 1.559 4.898 5.019 1.00 . A A . 12 ILE CD1 1 1 18 4125 1 1 12 ILE CG1 C 3.071 4.916 5.076 1.00 . A A . 12 ILE CG1 1 1 18 4126 1 1 12 ILE CG2 C 3.300 7.186 4.037 1.00 . A A . 12 ILE CG2 1 1 18 4127 1 1 12 ILE H H 3.088 3.043 2.312 1.00 . A A . 12 ILE H 1 1 18 4128 1 1 12 ILE HA H 2.244 5.149 2.493 1.00 . A A . 12 ILE HA 1 1 18 4129 1 1 12 ILE HB H 4.787 5.671 4.042 1.00 . A A . 12 ILE HB 1 1 18 4130 1 1 12 ILE HD11 H 1.211 5.727 4.422 1.00 . A A . 12 ILE HD11 1 1 18 4131 1 1 12 ILE HD12 H 1.160 4.983 6.019 1.00 . A A . 12 ILE HD12 1 1 18 4132 1 1 12 ILE HD13 H 1.226 3.970 4.576 1.00 . A A . 12 ILE HD13 1 1 18 4133 1 1 12 ILE HG12 H 3.417 3.895 5.023 1.00 . A A . 12 ILE HG12 1 1 18 4134 1 1 12 ILE HG13 H 3.363 5.342 6.025 1.00 . A A . 12 ILE HG13 1 1 18 4135 1 1 12 ILE HG21 H 4.110 7.811 3.690 1.00 . A A . 12 ILE HG21 1 1 18 4136 1 1 12 ILE HG22 H 3.069 7.432 5.063 1.00 . A A . 12 ILE HG22 1 1 18 4137 1 1 12 ILE HG23 H 2.427 7.351 3.422 1.00 . A A . 12 ILE HG23 1 1 18 4138 1 1 12 ILE N N 3.757 3.744 2.454 1.00 . A A . 12 ILE N 1 1 18 4139 1 1 12 ILE O O 4.836 5.502 0.770 1.00 . A A . 12 ILE O 1 1 18 4140 1 1 12 ILE OXT O 3.464 7.140 1.298 1.00 . A A . 12 ILE OXT 1 1 19 4141 1 1 1 HIS C C -6.187 4.922 0.067 1.00 . A A . 1 HIS C 1 1 19 4142 1 1 1 HIS CA C -5.234 6.111 -0.031 1.00 . A A . 1 HIS CA 1 1 19 4143 1 1 1 HIS CB C -4.721 6.492 1.360 1.00 . A A . 1 HIS CB 1 1 19 4144 1 1 1 HIS CD2 C -3.786 8.843 1.932 1.00 . A A . 1 HIS CD2 1 1 19 4145 1 1 1 HIS CE1 C -1.892 8.712 0.835 1.00 . A A . 1 HIS CE1 1 1 19 4146 1 1 1 HIS CG C -3.740 7.623 1.346 1.00 . A A . 1 HIS CG 1 1 19 4147 1 1 1 HIS H1 H -5.182 8.017 -0.804 1.00 . A A . 1 HIS H1 1 1 19 4148 1 1 1 HIS H2 H -6.615 7.632 0.059 1.00 . A A . 1 HIS H2 1 1 19 4149 1 1 1 HIS H3 H -6.358 6.990 -1.511 1.00 . A A . 1 HIS H3 1 1 19 4150 1 1 1 HIS HA H -4.396 5.842 -0.656 1.00 . A A . 1 HIS HA 1 1 19 4151 1 1 1 HIS HB2 H -5.556 6.786 1.977 1.00 . A A . 1 HIS HB2 1 1 19 4152 1 1 1 HIS HB3 H -4.235 5.635 1.804 1.00 . A A . 1 HIS HB3 1 1 19 4153 1 1 1 HIS HD1 H -2.214 6.814 0.139 1.00 . A A . 1 HIS HD1 1 1 19 4154 1 1 1 HIS HD2 H -4.586 9.228 2.549 1.00 . A A . 1 HIS HD2 1 1 19 4155 1 1 1 HIS HE1 H -0.927 8.957 0.417 1.00 . A A . 1 HIS HE1 1 1 19 4156 1 1 1 HIS HE2 H -2.424 10.436 1.803 1.00 . A A . 1 HIS HE2 1 1 19 4157 1 1 1 HIS N N -5.908 7.294 -0.625 1.00 . A A . 1 HIS N 1 1 19 4158 1 1 1 HIS ND1 N -2.541 7.573 0.665 1.00 . A A . 1 HIS ND1 1 1 19 4159 1 1 1 HIS NE2 N -2.626 9.500 1.599 1.00 . A A . 1 HIS NE2 1 1 19 4160 1 1 1 HIS O O -6.935 4.795 1.037 1.00 . A A . 1 HIS O 1 1 19 4161 1 1 2 PRO C C -6.669 1.839 0.121 1.00 . A A . 2 PRO C 1 1 19 4162 1 1 2 PRO CA C -7.044 2.848 -0.958 1.00 . A A . 2 PRO CA 1 1 19 4163 1 1 2 PRO CB C -6.816 2.255 -2.350 1.00 . A A . 2 PRO CB 1 1 19 4164 1 1 2 PRO CD C -5.315 4.101 -2.136 1.00 . A A . 2 PRO CD 1 1 19 4165 1 1 2 PRO CG C -5.466 2.739 -2.753 1.00 . A A . 2 PRO CG 1 1 19 4166 1 1 2 PRO HA H -8.083 3.122 -0.846 1.00 . A A . 2 PRO HA 1 1 19 4167 1 1 2 PRO HB2 H -6.849 1.177 -2.294 1.00 . A A . 2 PRO HB2 1 1 19 4168 1 1 2 PRO HB3 H -7.579 2.610 -3.026 1.00 . A A . 2 PRO HB3 1 1 19 4169 1 1 2 PRO HD2 H -4.285 4.279 -1.862 1.00 . A A . 2 PRO HD2 1 1 19 4170 1 1 2 PRO HD3 H -5.663 4.864 -2.815 1.00 . A A . 2 PRO HD3 1 1 19 4171 1 1 2 PRO HG2 H -4.707 2.069 -2.374 1.00 . A A . 2 PRO HG2 1 1 19 4172 1 1 2 PRO HG3 H -5.405 2.806 -3.828 1.00 . A A . 2 PRO HG3 1 1 19 4173 1 1 2 PRO N N -6.175 4.030 -0.939 1.00 . A A . 2 PRO N 1 1 19 4174 1 1 2 PRO O O -5.525 1.390 0.196 1.00 . A A . 2 PRO O 1 1 19 4175 1 1 3 LEU C C -7.296 -0.901 1.504 1.00 . A A . 3 LEU C 1 1 19 4176 1 1 3 LEU CA C -7.413 0.528 2.034 1.00 . A A . 3 LEU CA 1 1 19 4177 1 1 3 LEU CB C -8.531 0.632 3.078 1.00 . A A . 3 LEU CB 1 1 19 4178 1 1 3 LEU CD1 C -10.085 -1.034 1.998 1.00 . A A . 3 LEU CD1 1 1 19 4179 1 1 3 LEU CD2 C -10.966 0.599 3.674 1.00 . A A . 3 LEU CD2 1 1 19 4180 1 1 3 LEU CG C -9.950 0.371 2.564 1.00 . A A . 3 LEU CG 1 1 19 4181 1 1 3 LEU H H -8.531 1.878 0.847 1.00 . A A . 3 LEU H 1 1 19 4182 1 1 3 LEU HA H -6.481 0.792 2.504 1.00 . A A . 3 LEU HA 1 1 19 4183 1 1 3 LEU HB2 H -8.322 -0.078 3.865 1.00 . A A . 3 LEU HB2 1 1 19 4184 1 1 3 LEU HB3 H -8.504 1.625 3.501 1.00 . A A . 3 LEU HB3 1 1 19 4185 1 1 3 LEU HD11 H -9.829 -1.025 0.948 1.00 . A A . 3 LEU HD11 1 1 19 4186 1 1 3 LEU HD12 H -11.102 -1.374 2.116 1.00 . A A . 3 LEU HD12 1 1 19 4187 1 1 3 LEU HD13 H -9.419 -1.700 2.525 1.00 . A A . 3 LEU HD13 1 1 19 4188 1 1 3 LEU HD21 H -10.577 0.215 4.604 1.00 . A A . 3 LEU HD21 1 1 19 4189 1 1 3 LEU HD22 H -11.886 0.088 3.429 1.00 . A A . 3 LEU HD22 1 1 19 4190 1 1 3 LEU HD23 H -11.159 1.658 3.773 1.00 . A A . 3 LEU HD23 1 1 19 4191 1 1 3 LEU HG H -10.163 1.069 1.769 1.00 . A A . 3 LEU HG 1 1 19 4192 1 1 3 LEU N N -7.641 1.485 0.956 1.00 . A A . 3 LEU N 1 1 19 4193 1 1 3 LEU O O -6.914 -1.813 2.238 1.00 . A A . 3 LEU O 1 1 19 4194 1 1 4 LYS C C -6.132 -2.737 -0.842 1.00 . A A . 4 LYS C 1 1 19 4195 1 1 4 LYS CA C -7.553 -2.416 -0.386 1.00 . A A . 4 LYS CA 1 1 19 4196 1 1 4 LYS CB C -8.513 -2.499 -1.576 1.00 . A A . 4 LYS CB 1 1 19 4197 1 1 4 LYS CD C -9.467 -3.879 -3.448 1.00 . A A . 4 LYS CD 1 1 19 4198 1 1 4 LYS CE C -9.453 -5.228 -4.148 1.00 . A A . 4 LYS CE 1 1 19 4199 1 1 4 LYS CG C -8.499 -3.850 -2.276 1.00 . A A . 4 LYS CG 1 1 19 4200 1 1 4 LYS H H -7.924 -0.333 -0.310 1.00 . A A . 4 LYS H 1 1 19 4201 1 1 4 LYS HA H -7.851 -3.140 0.355 1.00 . A A . 4 LYS HA 1 1 19 4202 1 1 4 LYS HB2 H -9.518 -2.310 -1.228 1.00 . A A . 4 LYS HB2 1 1 19 4203 1 1 4 LYS HB3 H -8.242 -1.742 -2.296 1.00 . A A . 4 LYS HB3 1 1 19 4204 1 1 4 LYS HD2 H -10.464 -3.684 -3.083 1.00 . A A . 4 LYS HD2 1 1 19 4205 1 1 4 LYS HD3 H -9.184 -3.113 -4.155 1.00 . A A . 4 LYS HD3 1 1 19 4206 1 1 4 LYS HE2 H -8.453 -5.421 -4.509 1.00 . A A . 4 LYS HE2 1 1 19 4207 1 1 4 LYS HE3 H -9.731 -5.992 -3.437 1.00 . A A . 4 LYS HE3 1 1 19 4208 1 1 4 LYS HG2 H -7.502 -4.043 -2.642 1.00 . A A . 4 LYS HG2 1 1 19 4209 1 1 4 LYS HG3 H -8.781 -4.614 -1.568 1.00 . A A . 4 LYS HG3 1 1 19 4210 1 1 4 LYS HZ1 H -10.000 -5.838 -6.069 1.00 . A A . 4 LYS HZ1 1 1 19 4211 1 1 4 LYS HZ2 H -10.573 -4.304 -5.649 1.00 . A A . 4 LYS HZ2 1 1 19 4212 1 1 4 LYS HZ3 H -11.303 -5.685 -5.001 1.00 . A A . 4 LYS HZ3 1 1 19 4213 1 1 4 LYS N N -7.626 -1.094 0.229 1.00 . A A . 4 LYS N 1 1 19 4214 1 1 4 LYS NZ N -10.398 -5.266 -5.297 1.00 . A A . 4 LYS NZ 1 1 19 4215 1 1 4 LYS O O -5.796 -3.896 -1.082 1.00 . A A . 4 LYS O 1 1 19 4216 1 1 5 GLN C C -2.979 -1.939 -0.185 1.00 . A A . 5 GLN C 1 1 19 4217 1 1 5 GLN CA C -3.919 -1.885 -1.385 1.00 . A A . 5 GLN CA 1 1 19 4218 1 1 5 GLN CB C -3.504 -0.751 -2.324 1.00 . A A . 5 GLN CB 1 1 19 4219 1 1 5 GLN CD C -1.682 0.270 -3.745 1.00 . A A . 5 GLN CD 1 1 19 4220 1 1 5 GLN CG C -2.070 -0.864 -2.818 1.00 . A A . 5 GLN CG 1 1 19 4221 1 1 5 GLN H H -5.625 -0.806 -0.753 1.00 . A A . 5 GLN H 1 1 19 4222 1 1 5 GLN HA H -3.857 -2.821 -1.919 1.00 . A A . 5 GLN HA 1 1 19 4223 1 1 5 GLN HB2 H -4.159 -0.751 -3.183 1.00 . A A . 5 GLN HB2 1 1 19 4224 1 1 5 GLN HB3 H -3.608 0.189 -1.802 1.00 . A A . 5 GLN HB3 1 1 19 4225 1 1 5 GLN HE21 H -0.227 0.818 -2.505 1.00 . A A . 5 GLN HE21 1 1 19 4226 1 1 5 GLN HE22 H -0.391 1.770 -3.938 1.00 . A A . 5 GLN HE22 1 1 19 4227 1 1 5 GLN HG2 H -1.407 -0.854 -1.966 1.00 . A A . 5 GLN HG2 1 1 19 4228 1 1 5 GLN HG3 H -1.959 -1.798 -3.349 1.00 . A A . 5 GLN HG3 1 1 19 4229 1 1 5 GLN N N -5.301 -1.706 -0.957 1.00 . A A . 5 GLN N 1 1 19 4230 1 1 5 GLN NE2 N -0.664 1.030 -3.357 1.00 . A A . 5 GLN NE2 1 1 19 4231 1 1 5 GLN O O -2.521 -0.906 0.304 1.00 . A A . 5 GLN O 1 1 19 4232 1 1 5 GLN OE1 O -2.289 0.462 -4.799 1.00 . A A . 5 GLN OE1 1 1 19 4233 1 1 6 TYR C C -0.354 -3.029 1.052 1.00 . A A . 6 TYR C 1 1 19 4234 1 1 6 TYR CA C -1.805 -3.340 1.423 1.00 . A A . 6 TYR CA 1 1 19 4235 1 1 6 TYR CB C -1.910 -4.776 1.947 1.00 . A A . 6 TYR CB 1 1 19 4236 1 1 6 TYR CD1 C -4.366 -4.279 2.374 1.00 . A A . 6 TYR CD1 1 1 19 4237 1 1 6 TYR CD2 C -3.536 -6.448 2.915 1.00 . A A . 6 TYR CD2 1 1 19 4238 1 1 6 TYR CE1 C -5.625 -4.648 2.808 1.00 . A A . 6 TYR CE1 1 1 19 4239 1 1 6 TYR CE2 C -4.793 -6.823 3.350 1.00 . A A . 6 TYR CE2 1 1 19 4240 1 1 6 TYR CG C -3.298 -5.172 2.419 1.00 . A A . 6 TYR CG 1 1 19 4241 1 1 6 TYR CZ C -5.833 -5.921 3.295 1.00 . A A . 6 TYR CZ 1 1 19 4242 1 1 6 TYR H H -3.088 -3.935 -0.152 1.00 . A A . 6 TYR H 1 1 19 4243 1 1 6 TYR HA H -2.116 -2.660 2.202 1.00 . A A . 6 TYR HA 1 1 19 4244 1 1 6 TYR HB2 H -1.626 -5.458 1.160 1.00 . A A . 6 TYR HB2 1 1 19 4245 1 1 6 TYR HB3 H -1.232 -4.896 2.779 1.00 . A A . 6 TYR HB3 1 1 19 4246 1 1 6 TYR HD1 H -4.202 -3.282 1.994 1.00 . A A . 6 TYR HD1 1 1 19 4247 1 1 6 TYR HD2 H -2.720 -7.155 2.958 1.00 . A A . 6 TYR HD2 1 1 19 4248 1 1 6 TYR HE1 H -6.439 -3.942 2.764 1.00 . A A . 6 TYR HE1 1 1 19 4249 1 1 6 TYR HE2 H -4.956 -7.821 3.731 1.00 . A A . 6 TYR HE2 1 1 19 4250 1 1 6 TYR HH H -7.749 -5.925 3.138 1.00 . A A . 6 TYR HH 1 1 19 4251 1 1 6 TYR N N -2.693 -3.150 0.283 1.00 . A A . 6 TYR N 1 1 19 4252 1 1 6 TYR O O 0.502 -2.911 1.926 1.00 . A A . 6 TYR O 1 1 19 4253 1 1 6 TYR OH O -7.085 -6.292 3.727 1.00 . A A . 6 TYR OH 1 1 19 4254 1 1 7 TRP C C 2.316 -3.448 -0.057 1.00 . A A . 7 TRP C 1 1 19 4255 1 1 7 TRP CA C 1.251 -2.605 -0.758 1.00 . A A . 7 TRP CA 1 1 19 4256 1 1 7 TRP CB C 1.571 -1.113 -0.602 1.00 . A A . 7 TRP CB 1 1 19 4257 1 1 7 TRP CD1 C 2.344 -1.067 1.843 1.00 . A A . 7 TRP CD1 1 1 19 4258 1 1 7 TRP CD2 C 0.709 0.388 1.368 1.00 . A A . 7 TRP CD2 1 1 19 4259 1 1 7 TRP CE2 C 1.040 0.512 2.732 1.00 . A A . 7 TRP CE2 1 1 19 4260 1 1 7 TRP CE3 C -0.294 1.205 0.841 1.00 . A A . 7 TRP CE3 1 1 19 4261 1 1 7 TRP CG C 1.555 -0.629 0.817 1.00 . A A . 7 TRP CG 1 1 19 4262 1 1 7 TRP CH2 C -0.576 2.208 3.029 1.00 . A A . 7 TRP CH2 1 1 19 4263 1 1 7 TRP CZ2 C 0.402 1.421 3.572 1.00 . A A . 7 TRP CZ2 1 1 19 4264 1 1 7 TRP CZ3 C -0.927 2.106 1.677 1.00 . A A . 7 TRP CZ3 1 1 19 4265 1 1 7 TRP H H -0.821 -3.012 -0.893 1.00 . A A . 7 TRP H 1 1 19 4266 1 1 7 TRP HA H 1.261 -2.851 -1.809 1.00 . A A . 7 TRP HA 1 1 19 4267 1 1 7 TRP HB2 H 2.551 -0.918 -1.006 1.00 . A A . 7 TRP HB2 1 1 19 4268 1 1 7 TRP HB3 H 0.842 -0.539 -1.156 1.00 . A A . 7 TRP HB3 1 1 19 4269 1 1 7 TRP HD1 H 3.094 -1.839 1.746 1.00 . A A . 7 TRP HD1 1 1 19 4270 1 1 7 TRP HE1 H 2.469 -0.522 3.867 1.00 . A A . 7 TRP HE1 1 1 19 4271 1 1 7 TRP HE3 H -0.577 1.141 -0.199 1.00 . A A . 7 TRP HE3 1 1 19 4272 1 1 7 TRP HH2 H -1.098 2.926 3.646 1.00 . A A . 7 TRP HH2 1 1 19 4273 1 1 7 TRP HZ2 H 0.660 1.512 4.617 1.00 . A A . 7 TRP HZ2 1 1 19 4274 1 1 7 TRP HZ3 H -1.705 2.746 1.288 1.00 . A A . 7 TRP HZ3 1 1 19 4275 1 1 7 TRP N N -0.090 -2.902 -0.249 1.00 . A A . 7 TRP N 1 1 19 4276 1 1 7 TRP NE1 N 2.040 -0.386 2.996 1.00 . A A . 7 TRP NE1 1 1 19 4277 1 1 7 TRP O O 2.001 -4.375 0.689 1.00 . A A . 7 TRP O 1 1 19 4278 1 1 8 TRP C C 5.925 -2.936 0.357 1.00 . A A . 8 TRP C 1 1 19 4279 1 1 8 TRP CA C 4.693 -3.846 0.294 1.00 . A A . 8 TRP CA 1 1 19 4280 1 1 8 TRP CB C 4.987 -5.115 -0.518 1.00 . A A . 8 TRP CB 1 1 19 4281 1 1 8 TRP CD1 C 6.567 -7.125 -0.547 1.00 . A A . 8 TRP CD1 1 1 19 4282 1 1 8 TRP CD2 C 6.823 -5.825 1.261 1.00 . A A . 8 TRP CD2 1 1 19 4283 1 1 8 TRP CE2 C 7.746 -6.889 1.332 1.00 . A A . 8 TRP CE2 1 1 19 4284 1 1 8 TRP CE3 C 6.804 -4.891 2.307 1.00 . A A . 8 TRP CE3 1 1 19 4285 1 1 8 TRP CG C 6.099 -5.976 0.023 1.00 . A A . 8 TRP CG 1 1 19 4286 1 1 8 TRP CH2 C 8.584 -6.119 3.400 1.00 . A A . 8 TRP CH2 1 1 19 4287 1 1 8 TRP CZ2 C 8.630 -7.045 2.397 1.00 . A A . 8 TRP CZ2 1 1 19 4288 1 1 8 TRP CZ3 C 7.681 -5.052 3.364 1.00 . A A . 8 TRP CZ3 1 1 19 4289 1 1 8 TRP H H 3.769 -2.376 -0.913 1.00 . A A . 8 TRP H 1 1 19 4290 1 1 8 TRP HA H 4.414 -4.121 1.295 1.00 . A A . 8 TRP HA 1 1 19 4291 1 1 8 TRP HB2 H 4.094 -5.719 -0.546 1.00 . A A . 8 TRP HB2 1 1 19 4292 1 1 8 TRP HB3 H 5.246 -4.831 -1.527 1.00 . A A . 8 TRP HB3 1 1 19 4293 1 1 8 TRP HD1 H 6.213 -7.524 -1.487 1.00 . A A . 8 TRP HD1 1 1 19 4294 1 1 8 TRP HE1 H 8.084 -8.470 -0.003 1.00 . A A . 8 TRP HE1 1 1 19 4295 1 1 8 TRP HE3 H 6.114 -4.066 2.308 1.00 . A A . 8 TRP HE3 1 1 19 4296 1 1 8 TRP HH2 H 9.249 -6.204 4.247 1.00 . A A . 8 TRP HH2 1 1 19 4297 1 1 8 TRP HZ2 H 9.335 -7.862 2.440 1.00 . A A . 8 TRP HZ2 1 1 19 4298 1 1 8 TRP HZ3 H 7.675 -4.342 4.177 1.00 . A A . 8 TRP HZ3 1 1 19 4299 1 1 8 TRP N N 3.581 -3.121 -0.307 1.00 . A A . 8 TRP N 1 1 19 4300 1 1 8 TRP NE1 N 7.575 -7.660 0.214 1.00 . A A . 8 TRP NE1 1 1 19 4301 1 1 8 TRP O O 6.081 -2.159 1.299 1.00 . A A . 8 TRP O 1 1 19 4302 1 1 9 ARG C C 7.655 -0.721 -0.700 1.00 . A A . 9 ARG C 1 1 19 4303 1 1 9 ARG CA C 8.000 -2.211 -0.685 1.00 . A A . 9 ARG CA 1 1 19 4304 1 1 9 ARG CB C 8.853 -2.569 -1.906 1.00 . A A . 9 ARG CB 1 1 19 4305 1 1 9 ARG CD C 10.149 -4.359 -0.710 1.00 . A A . 9 ARG CD 1 1 19 4306 1 1 9 ARG CG C 9.306 -4.019 -1.929 1.00 . A A . 9 ARG CG 1 1 19 4307 1 1 9 ARG CZ C 11.339 -6.301 0.233 1.00 . A A . 9 ARG CZ 1 1 19 4308 1 1 9 ARG H H 6.619 -3.661 -1.367 1.00 . A A . 9 ARG H 1 1 19 4309 1 1 9 ARG HA H 8.567 -2.423 0.208 1.00 . A A . 9 ARG HA 1 1 19 4310 1 1 9 ARG HB2 H 8.285 -2.379 -2.803 1.00 . A A . 9 ARG HB2 1 1 19 4311 1 1 9 ARG HB3 H 9.733 -1.941 -1.910 1.00 . A A . 9 ARG HB3 1 1 19 4312 1 1 9 ARG HD2 H 11.017 -3.718 -0.698 1.00 . A A . 9 ARG HD2 1 1 19 4313 1 1 9 ARG HD3 H 9.560 -4.185 0.179 1.00 . A A . 9 ARG HD3 1 1 19 4314 1 1 9 ARG HE H 10.307 -6.311 -1.475 1.00 . A A . 9 ARG HE 1 1 19 4315 1 1 9 ARG HG2 H 8.436 -4.658 -1.941 1.00 . A A . 9 ARG HG2 1 1 19 4316 1 1 9 ARG HG3 H 9.893 -4.189 -2.819 1.00 . A A . 9 ARG HG3 1 1 19 4317 1 1 9 ARG HH11 H 11.485 -4.612 1.336 1.00 . A A . 9 ARG HH11 1 1 19 4318 1 1 9 ARG HH12 H 12.307 -5.993 1.980 1.00 . A A . 9 ARG HH12 1 1 19 4319 1 1 9 ARG HH21 H 11.387 -8.128 -0.630 1.00 . A A . 9 ARG HH21 1 1 19 4320 1 1 9 ARG HH22 H 12.252 -7.990 0.864 1.00 . A A . 9 ARG HH22 1 1 19 4321 1 1 9 ARG N N 6.793 -3.030 -0.643 1.00 . A A . 9 ARG N 1 1 19 4322 1 1 9 ARG NE N 10.588 -5.753 -0.721 1.00 . A A . 9 ARG NE 1 1 19 4323 1 1 9 ARG NH1 N 11.743 -5.576 1.268 1.00 . A A . 9 ARG NH1 1 1 19 4324 1 1 9 ARG NH2 N 11.687 -7.578 0.149 1.00 . A A . 9 ARG NH2 1 1 19 4325 1 1 9 ARG O O 8.239 0.061 0.051 1.00 . A A . 9 ARG O 1 1 19 4326 1 1 10 PRO C C 5.267 1.475 -0.593 1.00 . A A . 10 PRO C 1 1 19 4327 1 1 10 PRO CA C 6.292 1.098 -1.659 1.00 . A A . 10 PRO CA 1 1 19 4328 1 1 10 PRO CB C 5.663 1.190 -3.063 1.00 . A A . 10 PRO CB 1 1 19 4329 1 1 10 PRO CD C 5.947 -1.131 -2.492 1.00 . A A . 10 PRO CD 1 1 19 4330 1 1 10 PRO CG C 5.736 -0.191 -3.645 1.00 . A A . 10 PRO CG 1 1 19 4331 1 1 10 PRO HA H 7.138 1.765 -1.596 1.00 . A A . 10 PRO HA 1 1 19 4332 1 1 10 PRO HB2 H 4.640 1.523 -2.977 1.00 . A A . 10 PRO HB2 1 1 19 4333 1 1 10 PRO HB3 H 6.223 1.895 -3.659 1.00 . A A . 10 PRO HB3 1 1 19 4334 1 1 10 PRO HD2 H 5.000 -1.429 -2.070 1.00 . A A . 10 PRO HD2 1 1 19 4335 1 1 10 PRO HD3 H 6.517 -1.991 -2.800 1.00 . A A . 10 PRO HD3 1 1 19 4336 1 1 10 PRO HG2 H 4.812 -0.423 -4.151 1.00 . A A . 10 PRO HG2 1 1 19 4337 1 1 10 PRO HG3 H 6.566 -0.253 -4.334 1.00 . A A . 10 PRO HG3 1 1 19 4338 1 1 10 PRO N N 6.702 -0.300 -1.555 1.00 . A A . 10 PRO N 1 1 19 4339 1 1 10 PRO O O 4.135 0.994 -0.610 1.00 . A A . 10 PRO O 1 1 19 4340 1 1 11 SER C C 4.098 4.089 1.047 1.00 . A A . 11 SER C 1 1 19 4341 1 1 11 SER CA C 4.787 2.776 1.406 1.00 . A A . 11 SER CA 1 1 19 4342 1 1 11 SER CB C 5.569 2.936 2.711 1.00 . A A . 11 SER CB 1 1 19 4343 1 1 11 SER H H 6.588 2.686 0.295 1.00 . A A . 11 SER H 1 1 19 4344 1 1 11 SER HA H 4.033 2.018 1.541 1.00 . A A . 11 SER HA 1 1 19 4345 1 1 11 SER HB2 H 6.347 3.672 2.574 1.00 . A A . 11 SER HB2 1 1 19 4346 1 1 11 SER HB3 H 4.899 3.262 3.493 1.00 . A A . 11 SER HB3 1 1 19 4347 1 1 11 SER HG H 6.839 1.465 2.465 1.00 . A A . 11 SER HG 1 1 19 4348 1 1 11 SER N N 5.672 2.337 0.333 1.00 . A A . 11 SER N 1 1 19 4349 1 1 11 SER O O 3.037 4.410 1.584 1.00 . A A . 11 SER O 1 1 19 4350 1 1 11 SER OG O 6.165 1.711 3.103 1.00 . A A . 11 SER OG 1 1 19 4351 1 1 12 ILE C C 4.072 6.190 -1.815 1.00 . A A . 12 ILE C 1 1 19 4352 1 1 12 ILE CA C 4.151 6.119 -0.292 1.00 . A A . 12 ILE CA 1 1 19 4353 1 1 12 ILE CB C 4.994 7.302 0.231 1.00 . A A . 12 ILE CB 1 1 19 4354 1 1 12 ILE CD1 C 3.672 7.403 2.404 1.00 . A A . 12 ILE CD1 1 1 19 4355 1 1 12 ILE CG1 C 5.036 7.289 1.761 1.00 . A A . 12 ILE CG1 1 1 19 4356 1 1 12 ILE CG2 C 4.433 8.625 -0.272 1.00 . A A . 12 ILE CG2 1 1 19 4357 1 1 12 ILE H H 5.548 4.530 -0.251 1.00 . A A . 12 ILE H 1 1 19 4358 1 1 12 ILE HA H 3.154 6.205 0.115 1.00 . A A . 12 ILE HA 1 1 19 4359 1 1 12 ILE HB H 5.998 7.196 -0.151 1.00 . A A . 12 ILE HB 1 1 19 4360 1 1 12 ILE HD11 H 3.045 6.591 2.067 1.00 . A A . 12 ILE HD11 1 1 19 4361 1 1 12 ILE HD12 H 3.221 8.345 2.128 1.00 . A A . 12 ILE HD12 1 1 19 4362 1 1 12 ILE HD13 H 3.775 7.355 3.477 1.00 . A A . 12 ILE HD13 1 1 19 4363 1 1 12 ILE HG12 H 5.483 6.364 2.093 1.00 . A A . 12 ILE HG12 1 1 19 4364 1 1 12 ILE HG13 H 5.637 8.118 2.104 1.00 . A A . 12 ILE HG13 1 1 19 4365 1 1 12 ILE HG21 H 3.379 8.512 -0.484 1.00 . A A . 12 ILE HG21 1 1 19 4366 1 1 12 ILE HG22 H 4.951 8.917 -1.173 1.00 . A A . 12 ILE HG22 1 1 19 4367 1 1 12 ILE HG23 H 4.568 9.385 0.484 1.00 . A A . 12 ILE HG23 1 1 19 4368 1 1 12 ILE N N 4.706 4.842 0.139 1.00 . A A . 12 ILE N 1 1 19 4369 1 1 12 ILE O O 5.123 6.030 -2.469 1.00 . A A . 12 ILE O 1 1 19 4370 1 1 12 ILE OXT O 2.959 6.405 -2.339 1.00 . A A . 12 ILE OXT 1 1 stop_ save_
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