NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
531619 | 2l99 | 17441 | cing | 4-filtered-FRED | STAR | entry | full | 57 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2l99 # This FRED archive file contains, for PDB entry <2l99>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2l99 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2l99 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2666.51 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 $LAK160_P10 A . 1 1 stop_ save_ save_LAK160_P10 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "LAK160 P10" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code KKLKLALAKPALLWKALALKLKKA _Entity.Number_of_monomers 24 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 LYS . 1 1 2 LYS . 1 1 3 LEU . 1 1 4 LYS . 1 1 5 LEU . 1 1 6 ALA . 1 1 7 LEU . 1 1 8 ALA . 1 1 9 LYS . 1 1 10 PRO . 1 1 11 ALA . 1 1 12 LEU . 1 1 13 LEU . 1 1 14 TRP . 1 1 15 LYS . 1 1 16 ALA . 1 1 17 LEU . 1 1 18 ALA . 1 1 19 LEU . 1 1 20 LYS . 1 1 21 LEU . 1 1 22 LYS . 1 1 23 LYS . 1 1 24 ALA . 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 LYS 1 1 1 1 LYS 2 2 1 1 LEU 3 3 1 1 LYS 4 4 1 1 LEU 5 5 1 1 ALA 6 6 1 1 LEU 7 7 1 1 ALA 8 8 1 1 LYS 9 9 1 1 PRO 10 10 1 1 ALA 11 11 1 1 LEU 12 12 1 1 LEU 13 13 1 1 TRP 14 14 1 1 LYS 15 15 1 1 ALA 16 16 1 1 LEU 17 17 1 1 ALA 18 18 1 1 LEU 19 19 1 1 LYS 20 20 1 1 LEU 21 21 1 1 LYS 22 22 1 1 LYS 23 23 1 1 ALA 24 24 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 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 LYS H1 . 1 . HT# 1 1 1 1 2 1 1 1 LYS HA . 1 . HA 1 1 2 1 1 1 1 1 LYS H1 . 1 . HT# 1 1 2 1 2 1 1 3 LEU H . 3 . HN 1 1 3 1 1 1 1 3 LEU H . 3 . HN 1 1 3 1 2 1 1 3 LEU HA . 3 . HA 1 1 4 1 1 1 1 3 LEU H . 3 . HN 1 1 4 1 2 1 1 4 LYS H . 4 . HN 1 1 5 1 1 1 1 3 LEU HA . 3 . HA 1 1 5 1 2 1 1 4 LYS H . 4 . HN 1 1 6 1 1 1 1 4 LYS H . 4 . HN 1 1 6 1 2 1 1 4 LYS HA . 4 . HA 1 1 7 1 1 1 1 4 LYS H . 4 . HN 1 1 7 1 2 1 1 5 LEU H . 5 . HN 1 1 8 1 1 1 1 5 LEU H . 5 . HN 1 1 8 1 2 1 1 5 LEU HA . 5 . HA 1 1 9 1 1 1 1 5 LEU H . 5 . HN 1 1 9 1 2 1 1 6 ALA H . 6 . HN 1 1 10 1 1 1 1 5 LEU HA . 5 . HA 1 1 10 1 2 1 1 6 ALA H . 6 . HN 1 1 11 1 1 1 1 6 ALA H . 6 . HN 1 1 11 1 2 1 1 6 ALA HA . 6 . HA 1 1 12 1 1 1 1 6 ALA H . 6 . HN 1 1 12 1 2 1 1 7 LEU H . 7 . HN 1 1 13 1 1 1 1 6 ALA HA . 6 . HA 1 1 13 1 2 1 1 9 LYS H . 9 . HN 1 1 14 1 1 1 1 7 LEU H . 7 . HN 1 1 14 1 2 1 1 7 LEU HA . 7 . HA 1 1 15 1 1 1 1 7 LEU H . 7 . HN 1 1 15 1 2 1 1 10 PRO HD2 . 10 . HD2 1 1 16 1 1 1 1 8 ALA H . 8 . HN 1 1 16 1 2 1 1 8 ALA HA . 8 . HA 1 1 17 1 1 1 1 8 ALA H . 8 . HN 1 1 17 1 2 1 1 10 PRO HD2 . 10 . HD2 1 1 18 1 1 1 1 8 ALA H . 8 . HN 1 1 18 1 2 1 1 11 ALA H . 11 . HN 1 1 19 1 1 1 1 9 LYS H . 9 . HN 1 1 19 1 2 1 1 9 LYS HA . 9 . HA 1 1 20 1 1 1 1 9 LYS H . 9 . HN 1 1 20 1 2 1 1 10 PRO HD2 . 10 . HD2 1 1 21 1 1 1 1 10 PRO HA . 10 . HA 1 1 21 1 2 1 1 11 ALA H . 11 . HN 1 1 22 1 1 1 1 10 PRO HA . 10 . HA 1 1 22 1 2 1 1 12 LEU H . 12 . HN 1 1 23 1 1 1 1 10 PRO HD2 . 10 . HD2 1 1 23 1 2 1 1 11 ALA H . 11 . HN 1 1 24 1 1 1 1 10 PRO HD2 . 10 . HD2 1 1 24 1 2 1 1 12 LEU H . 12 . HN 1 1 25 1 1 1 1 10 PRO HD2 . 10 . HD2 1 1 25 1 2 1 1 13 LEU H . 13 . HN 1 1 26 1 1 1 1 11 ALA H . 11 . HN 1 1 26 1 2 1 1 11 ALA HA . 11 . HA 1 1 27 1 1 1 1 11 ALA H . 11 . HN 1 1 27 1 2 1 1 12 LEU H . 12 . HN 1 1 28 1 1 1 1 11 ALA H . 11 . HN 1 1 28 1 2 1 1 14 TRP HA . 14 . HA 1 1 29 1 1 1 1 12 LEU H . 12 . HN 1 1 29 1 2 1 1 12 LEU HA . 12 . HA 1 1 30 1 1 1 1 12 LEU HA . 12 . HA 1 1 30 1 2 1 1 13 LEU H . 13 . HN 1 1 31 1 1 1 1 13 LEU H . 13 . HN 1 1 31 1 2 1 1 14 TRP H . 14 . HN 1 1 32 1 1 1 1 14 TRP H . 14 . HN 1 1 32 1 2 1 1 15 LYS H . 15 . HN 1 1 33 1 1 1 1 14 TRP H . 14 . HN 1 1 33 1 2 1 1 15 LYS HA . 15 . HA 1 1 34 1 1 1 1 14 TRP HA . 14 . HA 1 1 34 1 2 1 1 15 LYS H . 15 . HN 1 1 35 1 1 1 1 14 TRP HA . 14 . HA 1 1 35 1 2 1 1 17 LEU H . 17 . HN 1 1 36 1 1 1 1 15 LYS H . 15 . HN 1 1 36 1 2 1 1 15 LYS HA . 15 . HA 1 1 37 1 1 1 1 15 LYS H . 15 . HN 1 1 37 1 2 1 1 16 ALA H . 16 . HN 1 1 38 1 1 1 1 15 LYS HA . 15 . HA 1 1 38 1 2 1 1 16 ALA H . 16 . HN 1 1 39 1 1 1 1 16 ALA H . 16 . HN 1 1 39 1 2 1 1 16 ALA HA . 16 . HA 1 1 40 1 1 1 1 16 ALA H . 16 . HN 1 1 40 1 2 1 1 17 LEU H . 17 . HN 1 1 41 1 1 1 1 16 ALA H . 16 . HN 1 1 41 1 2 1 1 18 ALA H . 18 . HN 1 1 42 1 1 1 1 16 ALA HA . 16 . HA 1 1 42 1 2 1 1 17 LEU H . 17 . HN 1 1 43 1 1 1 1 17 LEU H . 17 . HN 1 1 43 1 2 1 1 17 LEU HA . 17 . HA 1 1 44 1 1 1 1 17 LEU H . 17 . HN 1 1 44 1 2 1 1 18 ALA H . 18 . HN 1 1 45 1 1 1 1 17 LEU H . 17 . HN 1 1 45 1 2 1 1 18 ALA HA . 18 . HA 1 1 46 1 1 1 1 17 LEU HA . 17 . HA 1 1 46 1 2 1 1 18 ALA H . 18 . HN 1 1 47 1 1 1 1 17 LEU HA . 17 . HA 1 1 47 1 2 1 1 20 LYS H . 20 . HN 1 1 48 1 1 1 1 18 ALA H . 18 . HN 1 1 48 1 2 1 1 18 ALA HA . 18 . HA 1 1 49 1 1 1 1 18 ALA H . 18 . HN 1 1 49 1 2 1 1 19 LEU H . 19 . HN 1 1 50 1 1 1 1 18 ALA HA . 18 . HA 1 1 50 1 2 1 1 19 LEU H . 19 . HN 1 1 51 1 1 1 1 19 LEU H . 19 . HN 1 1 51 1 2 1 1 19 LEU HA . 19 . HA 1 1 52 1 1 1 1 19 LEU H . 19 . HN 1 1 52 1 2 1 1 20 LYS H . 20 . HN 1 1 53 1 1 1 1 19 LEU HA . 19 . HA 1 1 53 1 2 1 1 22 LYS H . 22 . HN 1 1 54 1 1 1 1 20 LYS H . 20 . HN 1 1 54 1 2 1 1 20 LYS HA . 20 . HA 1 1 55 1 1 1 1 22 LYS H . 22 . HN 1 1 55 1 2 1 1 22 LYS HA . 22 . HA 1 1 56 1 1 1 1 23 LYS H . 23 . HN 1 1 56 1 2 1 1 23 LYS HA . 23 . HA 1 1 57 1 1 1 1 24 ALA H . 24 . HN 1 1 57 1 2 1 1 24 ALA HA . 24 . 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 . . . . . 3.096 1.898 4.294 1 1 2 1 . . . . . 3.844 1.997 5.691 1 1 3 1 . . . . . 2.605 1.757 3.453 1 1 4 1 . . . . . 3.498 1.968 5.028 1 1 5 1 . . . . . 2.605 1.757 3.453 1 1 6 1 . . . . . 2.678 1.782 3.574 1 1 7 1 . . . . . 3.072 1.892 4.252 1 1 8 1 . . . . . 2.59 1.752 3.428 1 1 9 1 . . . . . 2.951 1.862 4.04 1 1 10 1 . . . . . 2.442 1.696 3.188 1 1 11 1 . . . . . 2.489 1.715 3.263 1 1 12 1 . . . . . 2.065 1.532 2.598 1 1 13 1 . . . . . 2.884 1.844 3.924 1 1 14 1 . . . . . 2.666 1.777 3.555 1 1 15 1 . . . . . 3.448 1.962 4.934 1 1 16 1 . . . . . 2.333 1.653 3.013 1 1 17 1 . . . . . 2.907 1.851 3.963 1 1 18 1 . . . . . 2.897 1.848 3.946 1 1 19 1 . . . . . 2.846 1.834 3.858 1 1 20 1 . . . . . 2.857 1.836 3.878 1 1 21 1 . . . . . 2.662 1.776 3.548 1 1 22 1 . . . . . 4.614 1.952 7.276 1 1 23 1 . . . . . 2.773 1.812 3.734 1 1 24 1 . . . . . 3.202 1.92 4.484 1 1 25 1 . . . . . 5.496 1.721 9.271 1 1 26 1 . . . . . 2.73 1.798 3.662 1 1 27 1 . . . . . 2.346 1.658 3.034 1 1 28 1 . . . . . 4.341 1.986 6.696 1 1 29 1 . . . . . 2.42 1.688 3.152 1 1 30 1 . . . . . 2.361 1.664 3.058 1 1 31 1 . . . . . 2.832 1.829 3.835 1 1 32 1 . . . . . 2.55 1.737 3.363 1 1 33 1 . . . . . 3.352 1.948 4.756 1 1 34 1 . . . . . 3.467 1.964 4.97 1 1 35 1 . . . . . 3.704 1.989 5.419 1 1 36 1 . . . . . 2.607 1.758 3.456 1 1 37 1 . . . . . 2.571 1.744 3.398 1 1 38 1 . . . . . 3.057 1.889 4.225 1 1 39 1 . . . . . 2.339 1.655 3.023 1 1 40 1 . . . . . 2.749 1.804 3.694 1 1 41 1 . . . . . 3.806 1.995 5.617 1 1 42 1 . . . . . 2.982 1.871 4.093 1 1 43 1 . . . . . 2.766 1.81 3.722 1 1 44 1 . . . . . 2.69 1.785 3.595 1 1 45 1 . . . . . 3.332 1.945 4.719 1 1 46 1 . . . . . 3.018 1.88 4.156 1 1 47 1 . . . . . 3.004 1.876 4.132 1 1 48 1 . . . . . 2.945 1.861 4.029 1 1 49 1 . . . . . 2.926 1.856 3.996 1 1 50 1 . . . . . 3.117 1.902 4.332 1 1 51 1 . . . . . 2.758 1.807 3.709 1 1 52 1 . . . . . 2.969 1.867 4.071 1 1 53 1 . . . . . 2.891 1.846 3.936 1 1 54 1 . . . . . 2.295 1.636 2.954 1 1 55 1 . . . . . 2.598 1.754 3.442 1 1 56 1 . . . . . 2.2 1.595 2.805 1 1 57 1 . . . . . 2.511 1.723 3.299 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 LYS C C 12.603 18.749 -10.378 1.00 . A X . 1 LYS C 1 1 1 2 1 1 1 LYS CA C 13.058 19.646 -11.520 1.00 . A X . 1 LYS CA 1 1 1 3 1 1 1 LYS CB C 12.963 18.885 -12.846 1.00 . A X . 1 LYS CB 1 1 1 4 1 1 1 LYS CD C 12.446 20.930 -14.227 1.00 . A X . 1 LYS CD 1 1 1 5 1 1 1 LYS CE C 12.790 21.710 -15.486 1.00 . A X . 1 LYS CE 1 1 1 6 1 1 1 LYS CG C 13.343 19.714 -14.067 1.00 . A X . 1 LYS CG 1 1 1 7 1 1 1 LYS H1 H 14.507 20.568 -10.343 1.00 . A X . 1 LYS H1 1 1 1 8 1 1 1 LYS H2 H 14.729 20.795 -12.006 1.00 . A X . 1 LYS H2 1 1 1 9 1 1 1 LYS H3 H 15.104 19.300 -11.299 1.00 . A X . 1 LYS H3 1 1 1 10 1 1 1 LYS HA H 12.412 20.513 -11.558 1.00 . A X . 1 LYS HA 1 1 1 11 1 1 1 LYS HB2 H 13.622 18.029 -12.802 1.00 . A X . 1 LYS HB2 1 1 1 12 1 1 1 LYS HB3 H 11.949 18.538 -12.974 1.00 . A X . 1 LYS HB3 1 1 1 13 1 1 1 LYS HD2 H 11.418 20.605 -14.285 1.00 . A X . 1 LYS HD2 1 1 1 14 1 1 1 LYS HD3 H 12.576 21.574 -13.369 1.00 . A X . 1 LYS HD3 1 1 1 15 1 1 1 LYS HE2 H 13.840 21.963 -15.463 1.00 . A X . 1 LYS HE2 1 1 1 16 1 1 1 LYS HE3 H 12.591 21.085 -16.344 1.00 . A X . 1 LYS HE3 1 1 1 17 1 1 1 LYS HG2 H 14.364 20.049 -13.957 1.00 . A X . 1 LYS HG2 1 1 1 18 1 1 1 LYS HG3 H 13.261 19.099 -14.952 1.00 . A X . 1 LYS HG3 1 1 1 19 1 1 1 LYS HZ1 H 12.175 23.419 -16.519 1.00 . A X . 1 LYS HZ1 1 1 1 20 1 1 1 LYS HZ2 H 12.257 23.620 -14.837 1.00 . A X . 1 LYS HZ2 1 1 1 21 1 1 1 LYS HZ3 H 10.977 22.748 -15.524 1.00 . A X . 1 LYS HZ3 1 1 1 22 1 1 1 LYS N N 14.443 20.107 -11.279 1.00 . A X . 1 LYS N 1 1 1 23 1 1 1 LYS NZ N 11.996 22.959 -15.600 1.00 . A X . 1 LYS NZ 1 1 1 24 1 1 1 LYS O O 12.816 17.535 -10.400 1.00 . A X . 1 LYS O 1 1 1 25 1 1 2 LYS C C 10.045 18.329 -8.293 1.00 . A X . 2 LYS C 1 1 1 26 1 1 2 LYS CA C 11.542 18.608 -8.206 1.00 . A X . 2 LYS CA 1 1 1 27 1 1 2 LYS CB C 11.903 19.354 -6.915 1.00 . A X . 2 LYS CB 1 1 1 28 1 1 2 LYS CD C 11.907 21.506 -5.614 1.00 . A X . 2 LYS CD 1 1 1 29 1 1 2 LYS CE C 11.113 22.763 -5.295 1.00 . A X . 2 LYS CE 1 1 1 30 1 1 2 LYS CG C 11.325 20.760 -6.808 1.00 . A X . 2 LYS CG 1 1 1 31 1 1 2 LYS H H 11.848 20.324 -9.401 1.00 . A X . 2 LYS H 1 1 1 32 1 1 2 LYS HA H 12.060 17.663 -8.212 1.00 . A X . 2 LYS HA 1 1 1 33 1 1 2 LYS HB2 H 11.545 18.780 -6.074 1.00 . A X . 2 LYS HB2 1 1 1 34 1 1 2 LYS HB3 H 12.979 19.427 -6.853 1.00 . A X . 2 LYS HB3 1 1 1 35 1 1 2 LYS HD2 H 11.891 20.855 -4.753 1.00 . A X . 2 LYS HD2 1 1 1 36 1 1 2 LYS HD3 H 12.927 21.782 -5.839 1.00 . A X . 2 LYS HD3 1 1 1 37 1 1 2 LYS HE2 H 11.677 23.364 -4.597 1.00 . A X . 2 LYS HE2 1 1 1 38 1 1 2 LYS HE3 H 10.963 23.319 -6.209 1.00 . A X . 2 LYS HE3 1 1 1 39 1 1 2 LYS HG2 H 11.559 21.306 -7.709 1.00 . A X . 2 LYS HG2 1 1 1 40 1 1 2 LYS HG3 H 10.252 20.695 -6.692 1.00 . A X . 2 LYS HG3 1 1 1 41 1 1 2 LYS HZ1 H 9.363 21.626 -5.183 1.00 . A X . 2 LYS HZ1 1 1 1 42 1 1 2 LYS HZ2 H 9.143 23.260 -4.795 1.00 . A X . 2 LYS HZ2 1 1 1 43 1 1 2 LYS HZ3 H 9.891 22.216 -3.686 1.00 . A X . 2 LYS HZ3 1 1 1 44 1 1 2 LYS N N 11.997 19.352 -9.367 1.00 . A X . 2 LYS N 1 1 1 45 1 1 2 LYS NZ N 9.786 22.443 -4.699 1.00 . A X . 2 LYS NZ 1 1 1 46 1 1 2 LYS O O 9.214 19.242 -8.281 1.00 . A X . 2 LYS O 1 1 1 47 1 1 3 LEU C C 7.672 16.500 -7.169 1.00 . A X . 3 LEU C 1 1 1 48 1 1 3 LEU CA C 8.332 16.621 -8.538 1.00 . A X . 3 LEU CA 1 1 1 49 1 1 3 LEU CB C 8.240 15.287 -9.299 1.00 . A X . 3 LEU CB 1 1 1 50 1 1 3 LEU CD1 C 9.988 15.599 -11.099 1.00 . A X . 3 LEU CD1 1 1 1 51 1 1 3 LEU CD2 C 8.043 14.076 -11.485 1.00 . A X . 3 LEU CD2 1 1 1 52 1 1 3 LEU CG C 8.514 15.355 -10.809 1.00 . A X . 3 LEU CG 1 1 1 53 1 1 3 LEU H H 10.422 16.375 -8.389 1.00 . A X . 3 LEU H 1 1 1 54 1 1 3 LEU HA H 7.811 17.380 -9.104 1.00 . A X . 3 LEU HA 1 1 1 55 1 1 3 LEU HB2 H 8.948 14.598 -8.860 1.00 . A X . 3 LEU HB2 1 1 1 56 1 1 3 LEU HB3 H 7.247 14.890 -9.158 1.00 . A X . 3 LEU HB3 1 1 1 57 1 1 3 LEU HD11 H 10.296 16.530 -10.642 1.00 . A X . 3 LEU HD11 1 1 1 58 1 1 3 LEU HD12 H 10.137 15.655 -12.168 1.00 . A X . 3 LEU HD12 1 1 1 59 1 1 3 LEU HD13 H 10.574 14.786 -10.694 1.00 . A X . 3 LEU HD13 1 1 1 60 1 1 3 LEU HD21 H 8.272 14.120 -12.538 1.00 . A X . 3 LEU HD21 1 1 1 61 1 1 3 LEU HD22 H 6.974 13.971 -11.353 1.00 . A X . 3 LEU HD22 1 1 1 62 1 1 3 LEU HD23 H 8.545 13.228 -11.042 1.00 . A X . 3 LEU HD23 1 1 1 63 1 1 3 LEU HG H 7.955 16.178 -11.231 1.00 . A X . 3 LEU HG 1 1 1 64 1 1 3 LEU N N 9.714 17.050 -8.403 1.00 . A X . 3 LEU N 1 1 1 65 1 1 3 LEU O O 7.608 15.420 -6.583 1.00 . A X . 3 LEU O 1 1 1 66 1 1 4 LYS C C 5.228 16.909 -5.293 1.00 . A X . 4 LYS C 1 1 1 67 1 1 4 LYS CA C 6.548 17.678 -5.350 1.00 . A X . 4 LYS CA 1 1 1 68 1 1 4 LYS CB C 6.330 19.134 -4.939 1.00 . A X . 4 LYS CB 1 1 1 69 1 1 4 LYS CD C 5.576 21.439 -5.586 1.00 . A X . 4 LYS CD 1 1 1 70 1 1 4 LYS CE C 5.110 22.334 -6.726 1.00 . A X . 4 LYS CE 1 1 1 71 1 1 4 LYS CG C 5.702 19.992 -6.026 1.00 . A X . 4 LYS CG 1 1 1 72 1 1 4 LYS H H 7.239 18.444 -7.202 1.00 . A X . 4 LYS H 1 1 1 73 1 1 4 LYS HA H 7.235 17.225 -4.652 1.00 . A X . 4 LYS HA 1 1 1 74 1 1 4 LYS HB2 H 5.682 19.155 -4.075 1.00 . A X . 4 LYS HB2 1 1 1 75 1 1 4 LYS HB3 H 7.284 19.564 -4.675 1.00 . A X . 4 LYS HB3 1 1 1 76 1 1 4 LYS HD2 H 4.859 21.497 -4.782 1.00 . A X . 4 LYS HD2 1 1 1 77 1 1 4 LYS HD3 H 6.539 21.785 -5.238 1.00 . A X . 4 LYS HD3 1 1 1 78 1 1 4 LYS HE2 H 5.082 23.355 -6.375 1.00 . A X . 4 LYS HE2 1 1 1 79 1 1 4 LYS HE3 H 5.817 22.254 -7.539 1.00 . A X . 4 LYS HE3 1 1 1 80 1 1 4 LYS HG2 H 6.322 19.947 -6.911 1.00 . A X . 4 LYS HG2 1 1 1 81 1 1 4 LYS HG3 H 4.720 19.605 -6.254 1.00 . A X . 4 LYS HG3 1 1 1 82 1 1 4 LYS HZ1 H 3.067 21.998 -6.444 1.00 . A X . 4 LYS HZ1 1 1 1 83 1 1 4 LYS HZ2 H 3.775 20.991 -7.614 1.00 . A X . 4 LYS HZ2 1 1 1 84 1 1 4 LYS HZ3 H 3.459 22.617 -7.974 1.00 . A X . 4 LYS HZ3 1 1 1 85 1 1 4 LYS N N 7.172 17.621 -6.671 1.00 . A X . 4 LYS N 1 1 1 86 1 1 4 LYS NZ N 3.759 21.956 -7.221 1.00 . A X . 4 LYS NZ 1 1 1 87 1 1 4 LYS O O 4.670 16.705 -4.216 1.00 . A X . 4 LYS O 1 1 1 88 1 1 5 LEU C C 3.743 14.250 -6.064 1.00 . A X . 5 LEU C 1 1 1 89 1 1 5 LEU CA C 3.500 15.695 -6.493 1.00 . A X . 5 LEU CA 1 1 1 90 1 1 5 LEU CB C 2.855 15.734 -7.887 1.00 . A X . 5 LEU CB 1 1 1 91 1 1 5 LEU CD1 C 2.758 14.763 -10.200 1.00 . A X . 5 LEU CD1 1 1 1 92 1 1 5 LEU CD2 C 4.749 16.088 -9.510 1.00 . A X . 5 LEU CD2 1 1 1 93 1 1 5 LEU CG C 3.672 15.124 -9.037 1.00 . A X . 5 LEU CG 1 1 1 94 1 1 5 LEU H H 5.211 16.674 -7.277 1.00 . A X . 5 LEU H 1 1 1 95 1 1 5 LEU HA H 2.819 16.142 -5.785 1.00 . A X . 5 LEU HA 1 1 1 96 1 1 5 LEU HB2 H 1.915 15.206 -7.832 1.00 . A X . 5 LEU HB2 1 1 1 97 1 1 5 LEU HB3 H 2.651 16.765 -8.132 1.00 . A X . 5 LEU HB3 1 1 1 98 1 1 5 LEU HD11 H 2.232 15.646 -10.533 1.00 . A X . 5 LEU HD11 1 1 1 99 1 1 5 LEU HD12 H 2.045 14.019 -9.879 1.00 . A X . 5 LEU HD12 1 1 1 100 1 1 5 LEU HD13 H 3.348 14.370 -11.014 1.00 . A X . 5 LEU HD13 1 1 1 101 1 1 5 LEU HD21 H 4.291 17.006 -9.843 1.00 . A X . 5 LEU HD21 1 1 1 102 1 1 5 LEU HD22 H 5.296 15.642 -10.328 1.00 . A X . 5 LEU HD22 1 1 1 103 1 1 5 LEU HD23 H 5.427 16.297 -8.696 1.00 . A X . 5 LEU HD23 1 1 1 104 1 1 5 LEU HG H 4.151 14.220 -8.692 1.00 . A X . 5 LEU HG 1 1 1 105 1 1 5 LEU N N 4.736 16.470 -6.445 1.00 . A X . 5 LEU N 1 1 1 106 1 1 5 LEU O O 2.816 13.438 -6.013 1.00 . A X . 5 LEU O 1 1 1 107 1 1 6 ALA C C 4.812 12.343 -3.884 1.00 . A X . 6 ALA C 1 1 1 108 1 1 6 ALA CA C 5.365 12.610 -5.280 1.00 . A X . 6 ALA CA 1 1 1 109 1 1 6 ALA CB C 6.878 12.457 -5.290 1.00 . A X . 6 ALA CB 1 1 1 110 1 1 6 ALA H H 5.684 14.636 -5.802 1.00 . A X . 6 ALA H 1 1 1 111 1 1 6 ALA HA H 4.945 11.891 -5.969 1.00 . A X . 6 ALA HA 1 1 1 112 1 1 6 ALA HB1 H 7.249 12.617 -6.292 1.00 . A X . 6 ALA HB1 1 1 1 113 1 1 6 ALA HB2 H 7.141 11.464 -4.962 1.00 . A X . 6 ALA HB2 1 1 1 114 1 1 6 ALA HB3 H 7.316 13.186 -4.624 1.00 . A X . 6 ALA HB3 1 1 1 115 1 1 6 ALA N N 4.993 13.944 -5.735 1.00 . A X . 6 ALA N 1 1 1 116 1 1 6 ALA O O 4.684 11.196 -3.459 1.00 . A X . 6 ALA O 1 1 1 117 1 1 7 LEU C C 2.377 13.419 -1.906 1.00 . A X . 7 LEU C 1 1 1 118 1 1 7 LEU CA C 3.894 13.283 -1.845 1.00 . A X . 7 LEU CA 1 1 1 119 1 1 7 LEU CB C 4.484 14.341 -0.907 1.00 . A X . 7 LEU CB 1 1 1 120 1 1 7 LEU CD1 C 6.477 15.375 0.207 1.00 . A X . 7 LEU CD1 1 1 1 121 1 1 7 LEU CD2 C 6.373 12.898 -0.106 1.00 . A X . 7 LEU CD2 1 1 1 122 1 1 7 LEU CG C 5.997 14.250 -0.697 1.00 . A X . 7 LEU CG 1 1 1 123 1 1 7 LEU H H 4.614 14.303 -3.552 1.00 . A X . 7 LEU H 1 1 1 124 1 1 7 LEU HA H 4.140 12.302 -1.468 1.00 . A X . 7 LEU HA 1 1 1 125 1 1 7 LEU HB2 H 4.255 15.317 -1.312 1.00 . A X . 7 LEU HB2 1 1 1 126 1 1 7 LEU HB3 H 4.003 14.247 0.055 1.00 . A X . 7 LEU HB3 1 1 1 127 1 1 7 LEU HD11 H 6.239 16.327 -0.244 1.00 . A X . 7 LEU HD11 1 1 1 128 1 1 7 LEU HD12 H 7.546 15.298 0.342 1.00 . A X . 7 LEU HD12 1 1 1 129 1 1 7 LEU HD13 H 5.987 15.299 1.167 1.00 . A X . 7 LEU HD13 1 1 1 130 1 1 7 LEU HD21 H 7.446 12.843 0.013 1.00 . A X . 7 LEU HD21 1 1 1 131 1 1 7 LEU HD22 H 6.043 12.111 -0.765 1.00 . A X . 7 LEU HD22 1 1 1 132 1 1 7 LEU HD23 H 5.897 12.782 0.856 1.00 . A X . 7 LEU HD23 1 1 1 133 1 1 7 LEU HG H 6.496 14.350 -1.651 1.00 . A X . 7 LEU HG 1 1 1 134 1 1 7 LEU N N 4.471 13.409 -3.175 1.00 . A X . 7 LEU N 1 1 1 135 1 1 7 LEU O O 1.712 13.506 -0.877 1.00 . A X . 7 LEU O 1 1 1 136 1 1 8 ALA C C -0.261 12.268 -3.716 1.00 . A X . 8 ALA C 1 1 1 137 1 1 8 ALA CA C 0.397 13.585 -3.307 1.00 . A X . 8 ALA CA 1 1 1 138 1 1 8 ALA CB C 0.116 14.662 -4.345 1.00 . A X . 8 ALA CB 1 1 1 139 1 1 8 ALA H H 2.412 13.337 -3.905 1.00 . A X . 8 ALA H 1 1 1 140 1 1 8 ALA HA H -0.026 13.906 -2.367 1.00 . A X . 8 ALA HA 1 1 1 141 1 1 8 ALA HB1 H 0.509 14.347 -5.302 1.00 . A X . 8 ALA HB1 1 1 1 142 1 1 8 ALA HB2 H 0.592 15.583 -4.047 1.00 . A X . 8 ALA HB2 1 1 1 143 1 1 8 ALA HB3 H -0.951 14.817 -4.424 1.00 . A X . 8 ALA HB3 1 1 1 144 1 1 8 ALA N N 1.833 13.430 -3.118 1.00 . A X . 8 ALA N 1 1 1 145 1 1 8 ALA O O -1.239 11.837 -3.107 1.00 . A X . 8 ALA O 1 1 1 146 1 1 9 LYS C C 0.328 9.137 -4.670 1.00 . A X . 9 LYS C 1 1 1 147 1 1 9 LYS CA C -0.322 10.394 -5.266 1.00 . A X . 9 LYS CA 1 1 1 148 1 1 9 LYS CB C -0.271 10.363 -6.798 1.00 . A X . 9 LYS CB 1 1 1 149 1 1 9 LYS CD C -2.670 11.033 -7.105 1.00 . A X . 9 LYS CD 1 1 1 150 1 1 9 LYS CE C -3.641 11.997 -7.767 1.00 . A X . 9 LYS CE 1 1 1 151 1 1 9 LYS CG C -1.223 11.352 -7.453 1.00 . A X . 9 LYS CG 1 1 1 152 1 1 9 LYS H H 1.079 11.986 -5.177 1.00 . A X . 9 LYS H 1 1 1 153 1 1 9 LYS HA H -1.361 10.402 -4.965 1.00 . A X . 9 LYS HA 1 1 1 154 1 1 9 LYS HB2 H 0.733 10.594 -7.119 1.00 . A X . 9 LYS HB2 1 1 1 155 1 1 9 LYS HB3 H -0.529 9.369 -7.138 1.00 . A X . 9 LYS HB3 1 1 1 156 1 1 9 LYS HD2 H -2.897 10.032 -7.438 1.00 . A X . 9 LYS HD2 1 1 1 157 1 1 9 LYS HD3 H -2.793 11.092 -6.035 1.00 . A X . 9 LYS HD3 1 1 1 158 1 1 9 LYS HE2 H -3.481 11.969 -8.835 1.00 . A X . 9 LYS HE2 1 1 1 159 1 1 9 LYS HE3 H -4.650 11.679 -7.547 1.00 . A X . 9 LYS HE3 1 1 1 160 1 1 9 LYS HG2 H -0.992 12.345 -7.104 1.00 . A X . 9 LYS HG2 1 1 1 161 1 1 9 LYS HG3 H -1.098 11.302 -8.524 1.00 . A X . 9 LYS HG3 1 1 1 162 1 1 9 LYS HZ1 H -2.530 13.762 -7.588 1.00 . A X . 9 LYS HZ1 1 1 1 163 1 1 9 LYS HZ2 H -3.516 13.428 -6.246 1.00 . A X . 9 LYS HZ2 1 1 1 164 1 1 9 LYS HZ3 H -4.208 14.006 -7.684 1.00 . A X . 9 LYS HZ3 1 1 1 165 1 1 9 LYS N N 0.274 11.627 -4.750 1.00 . A X . 9 LYS N 1 1 1 166 1 1 9 LYS NZ N -3.461 13.394 -7.288 1.00 . A X . 9 LYS NZ 1 1 1 167 1 1 9 LYS O O -0.376 8.302 -4.105 1.00 . A X . 9 LYS O 1 1 1 168 1 1 10 PRO C C 2.185 7.672 -2.705 1.00 . A X . 10 PRO C 1 1 1 169 1 1 10 PRO CA C 2.347 7.781 -4.221 1.00 . A X . 10 PRO CA 1 1 1 170 1 1 10 PRO CB C 3.819 7.993 -4.594 1.00 . A X . 10 PRO CB 1 1 1 171 1 1 10 PRO CD C 2.618 9.865 -5.444 1.00 . A X . 10 PRO CD 1 1 1 172 1 1 10 PRO CG C 3.791 8.971 -5.718 1.00 . A X . 10 PRO CG 1 1 1 173 1 1 10 PRO HA H 1.985 6.872 -4.681 1.00 . A X . 10 PRO HA 1 1 1 174 1 1 10 PRO HB2 H 4.356 8.384 -3.744 1.00 . A X . 10 PRO HB2 1 1 1 175 1 1 10 PRO HB3 H 4.253 7.053 -4.901 1.00 . A X . 10 PRO HB3 1 1 1 176 1 1 10 PRO HD2 H 2.901 10.675 -4.789 1.00 . A X . 10 PRO HD2 1 1 1 177 1 1 10 PRO HD3 H 2.205 10.247 -6.367 1.00 . A X . 10 PRO HD3 1 1 1 178 1 1 10 PRO HG2 H 4.705 9.545 -5.731 1.00 . A X . 10 PRO HG2 1 1 1 179 1 1 10 PRO HG3 H 3.656 8.453 -6.657 1.00 . A X . 10 PRO HG3 1 1 1 180 1 1 10 PRO N N 1.666 8.963 -4.775 1.00 . A X . 10 PRO N 1 1 1 181 1 1 10 PRO O O 2.157 6.575 -2.151 1.00 . A X . 10 PRO O 1 1 1 182 1 1 11 ALA C C 0.410 8.532 -0.238 1.00 . A X . 11 ALA C 1 1 1 183 1 1 11 ALA CA C 1.858 8.855 -0.600 1.00 . A X . 11 ALA CA 1 1 1 184 1 1 11 ALA CB C 2.257 10.216 -0.045 1.00 . A X . 11 ALA CB 1 1 1 185 1 1 11 ALA H H 2.087 9.656 -2.543 1.00 . A X . 11 ALA H 1 1 1 186 1 1 11 ALA HA H 2.501 8.111 -0.160 1.00 . A X . 11 ALA HA 1 1 1 187 1 1 11 ALA HB1 H 3.292 10.414 -0.286 1.00 . A X . 11 ALA HB1 1 1 1 188 1 1 11 ALA HB2 H 2.132 10.219 1.030 1.00 . A X . 11 ALA HB2 1 1 1 189 1 1 11 ALA HB3 H 1.634 10.980 -0.481 1.00 . A X . 11 ALA HB3 1 1 1 190 1 1 11 ALA N N 2.052 8.818 -2.045 1.00 . A X . 11 ALA N 1 1 1 191 1 1 11 ALA O O 0.059 8.429 0.939 1.00 . A X . 11 ALA O 1 1 1 192 1 1 12 LEU C C -2.085 6.644 -1.674 1.00 . A X . 12 LEU C 1 1 1 193 1 1 12 LEU CA C -1.821 8.015 -1.060 1.00 . A X . 12 LEU CA 1 1 1 194 1 1 12 LEU CB C -2.738 9.078 -1.677 1.00 . A X . 12 LEU CB 1 1 1 195 1 1 12 LEU CD1 C -4.448 9.109 0.164 1.00 . A X . 12 LEU CD1 1 1 1 196 1 1 12 LEU CD2 C -5.045 9.952 -2.116 1.00 . A X . 12 LEU CD2 1 1 1 197 1 1 12 LEU CG C -4.224 8.943 -1.333 1.00 . A X . 12 LEU CG 1 1 1 198 1 1 12 LEU H H -0.093 8.523 -2.175 1.00 . A X . 12 LEU H 1 1 1 199 1 1 12 LEU HA H -2.002 7.960 0.000 1.00 . A X . 12 LEU HA 1 1 1 200 1 1 12 LEU HB2 H -2.398 10.048 -1.346 1.00 . A X . 12 LEU HB2 1 1 1 201 1 1 12 LEU HB3 H -2.638 9.029 -2.750 1.00 . A X . 12 LEU HB3 1 1 1 202 1 1 12 LEU HD11 H -3.910 8.340 0.696 1.00 . A X . 12 LEU HD11 1 1 1 203 1 1 12 LEU HD12 H -5.502 9.026 0.382 1.00 . A X . 12 LEU HD12 1 1 1 204 1 1 12 LEU HD13 H -4.091 10.080 0.479 1.00 . A X . 12 LEU HD13 1 1 1 205 1 1 12 LEU HD21 H -6.088 9.848 -1.856 1.00 . A X . 12 LEU HD21 1 1 1 206 1 1 12 LEU HD22 H -4.919 9.774 -3.174 1.00 . A X . 12 LEU HD22 1 1 1 207 1 1 12 LEU HD23 H -4.712 10.952 -1.877 1.00 . A X . 12 LEU HD23 1 1 1 208 1 1 12 LEU HG H -4.558 7.955 -1.609 1.00 . A X . 12 LEU HG 1 1 1 209 1 1 12 LEU N N -0.425 8.381 -1.259 1.00 . A X . 12 LEU N 1 1 1 210 1 1 12 LEU O O -3.217 6.154 -1.710 1.00 . A X . 12 LEU O 1 1 1 211 1 1 13 LEU C C 0.125 3.899 -2.265 1.00 . A X . 13 LEU C 1 1 1 212 1 1 13 LEU CA C -1.063 4.716 -2.751 1.00 . A X . 13 LEU CA 1 1 1 213 1 1 13 LEU CB C -1.047 4.834 -4.281 1.00 . A X . 13 LEU CB 1 1 1 214 1 1 13 LEU CD1 C -2.422 2.788 -4.772 1.00 . A X . 13 LEU CD1 1 1 1 215 1 1 13 LEU CD2 C -0.924 3.744 -6.536 1.00 . A X . 13 LEU CD2 1 1 1 216 1 1 13 LEU CG C -1.109 3.506 -5.044 1.00 . A X . 13 LEU CG 1 1 1 217 1 1 13 LEU H H -0.145 6.478 -2.054 1.00 . A X . 13 LEU H 1 1 1 218 1 1 13 LEU HA H -1.977 4.231 -2.437 1.00 . A X . 13 LEU HA 1 1 1 219 1 1 13 LEU HB2 H -1.893 5.437 -4.581 1.00 . A X . 13 LEU HB2 1 1 1 220 1 1 13 LEU HB3 H -0.143 5.346 -4.570 1.00 . A X . 13 LEU HB3 1 1 1 221 1 1 13 LEU HD11 H -2.445 1.858 -5.324 1.00 . A X . 13 LEU HD11 1 1 1 222 1 1 13 LEU HD12 H -3.247 3.410 -5.084 1.00 . A X . 13 LEU HD12 1 1 1 223 1 1 13 LEU HD13 H -2.507 2.583 -3.715 1.00 . A X . 13 LEU HD13 1 1 1 224 1 1 13 LEU HD21 H 0.036 4.209 -6.710 1.00 . A X . 13 LEU HD21 1 1 1 225 1 1 13 LEU HD22 H -1.709 4.392 -6.901 1.00 . A X . 13 LEU HD22 1 1 1 226 1 1 13 LEU HD23 H -0.964 2.799 -7.056 1.00 . A X . 13 LEU HD23 1 1 1 227 1 1 13 LEU HG H -0.304 2.869 -4.705 1.00 . A X . 13 LEU HG 1 1 1 228 1 1 13 LEU N N -1.014 6.031 -2.139 1.00 . A X . 13 LEU N 1 1 1 229 1 1 13 LEU O O 1.162 3.831 -2.925 1.00 . A X . 13 LEU O 1 1 1 230 1 1 14 TRP C C 1.371 1.274 -1.111 1.00 . A X . 14 TRP C 1 1 1 231 1 1 14 TRP CA C 1.072 2.602 -0.451 1.00 . A X . 14 TRP CA 1 1 1 232 1 1 14 TRP CB C 0.761 2.409 1.032 1.00 . A X . 14 TRP CB 1 1 1 233 1 1 14 TRP CD1 C 1.341 4.573 2.289 1.00 . A X . 14 TRP CD1 1 1 1 234 1 1 14 TRP CD2 C -0.847 4.269 1.930 1.00 . A X . 14 TRP CD2 1 1 1 235 1 1 14 TRP CE2 C -0.667 5.484 2.618 1.00 . A X . 14 TRP CE2 1 1 1 236 1 1 14 TRP CE3 C -2.144 3.874 1.590 1.00 . A X . 14 TRP CE3 1 1 1 237 1 1 14 TRP CG C 0.449 3.699 1.729 1.00 . A X . 14 TRP CG 1 1 1 238 1 1 14 TRP CH2 C -2.987 5.890 2.635 1.00 . A X . 14 TRP CH2 1 1 1 239 1 1 14 TRP CZ2 C -1.730 6.300 2.978 1.00 . A X . 14 TRP CZ2 1 1 1 240 1 1 14 TRP CZ3 C -3.201 4.688 1.951 1.00 . A X . 14 TRP CZ3 1 1 1 241 1 1 14 TRP H H -0.926 3.217 -0.709 1.00 . A X . 14 TRP H 1 1 1 242 1 1 14 TRP HA H 1.938 3.239 -0.545 1.00 . A X . 14 TRP HA 1 1 1 243 1 1 14 TRP HB2 H -0.096 1.759 1.132 1.00 . A X . 14 TRP HB2 1 1 1 244 1 1 14 TRP HB3 H 1.612 1.958 1.522 1.00 . A X . 14 TRP HB3 1 1 1 245 1 1 14 TRP HD1 H 2.412 4.427 2.302 1.00 . A X . 14 TRP HD1 1 1 1 246 1 1 14 TRP HE1 H 1.095 6.412 3.286 1.00 . A X . 14 TRP HE1 1 1 1 247 1 1 14 TRP HE3 H -2.329 2.951 1.062 1.00 . A X . 14 TRP HE3 1 1 1 248 1 1 14 TRP HH2 H -3.842 6.494 2.895 1.00 . A X . 14 TRP HH2 1 1 1 249 1 1 14 TRP HZ2 H -1.583 7.228 3.507 1.00 . A X . 14 TRP HZ2 1 1 1 250 1 1 14 TRP HZ3 H -4.209 4.401 1.698 1.00 . A X . 14 TRP HZ3 1 1 1 251 1 1 14 TRP N N -0.036 3.262 -1.115 1.00 . A X . 14 TRP N 1 1 1 252 1 1 14 TRP NE1 N 0.675 5.645 2.826 1.00 . A X . 14 TRP NE1 1 1 1 253 1 1 14 TRP O O 2.379 0.636 -0.812 1.00 . A X . 14 TRP O 1 1 1 254 1 1 15 LYS C C 1.993 -0.294 -3.573 1.00 . A X . 15 LYS C 1 1 1 255 1 1 15 LYS CA C 0.699 -0.362 -2.769 1.00 . A X . 15 LYS CA 1 1 1 256 1 1 15 LYS CB C -0.481 -0.635 -3.703 1.00 . A X . 15 LYS CB 1 1 1 257 1 1 15 LYS CD C -1.683 -2.065 -2.023 1.00 . A X . 15 LYS CD 1 1 1 258 1 1 15 LYS CE C -3.039 -2.461 -1.467 1.00 . A X . 15 LYS CE 1 1 1 259 1 1 15 LYS CG C -1.792 -0.888 -2.980 1.00 . A X . 15 LYS CG 1 1 1 260 1 1 15 LYS H H -0.287 1.418 -2.211 1.00 . A X . 15 LYS H 1 1 1 261 1 1 15 LYS HA H 0.773 -1.160 -2.051 1.00 . A X . 15 LYS HA 1 1 1 262 1 1 15 LYS HB2 H -0.613 0.216 -4.355 1.00 . A X . 15 LYS HB2 1 1 1 263 1 1 15 LYS HB3 H -0.254 -1.503 -4.304 1.00 . A X . 15 LYS HB3 1 1 1 264 1 1 15 LYS HD2 H -1.262 -2.907 -2.550 1.00 . A X . 15 LYS HD2 1 1 1 265 1 1 15 LYS HD3 H -1.034 -1.789 -1.204 1.00 . A X . 15 LYS HD3 1 1 1 266 1 1 15 LYS HE2 H -3.659 -2.808 -2.279 1.00 . A X . 15 LYS HE2 1 1 1 267 1 1 15 LYS HE3 H -2.900 -3.262 -0.756 1.00 . A X . 15 LYS HE3 1 1 1 268 1 1 15 LYS HG2 H -2.059 -0.006 -2.420 1.00 . A X . 15 LYS HG2 1 1 1 269 1 1 15 LYS HG3 H -2.561 -1.100 -3.710 1.00 . A X . 15 LYS HG3 1 1 1 270 1 1 15 LYS HZ1 H -3.909 -0.558 -1.469 1.00 . A X . 15 LYS HZ1 1 1 1 271 1 1 15 LYS HZ2 H -3.126 -0.953 -0.018 1.00 . A X . 15 LYS HZ2 1 1 1 272 1 1 15 LYS HZ3 H -4.630 -1.648 -0.389 1.00 . A X . 15 LYS HZ3 1 1 1 273 1 1 15 LYS N N 0.504 0.871 -2.030 1.00 . A X . 15 LYS N 1 1 1 274 1 1 15 LYS NZ N -3.722 -1.328 -0.789 1.00 . A X . 15 LYS NZ 1 1 1 275 1 1 15 LYS O O 2.771 -1.248 -3.604 1.00 . A X . 15 LYS O 1 1 1 276 1 1 16 ALA C C 4.508 1.772 -4.172 1.00 . A X . 16 ALA C 1 1 1 277 1 1 16 ALA CA C 3.434 1.057 -4.986 1.00 . A X . 16 ALA CA 1 1 1 278 1 1 16 ALA CB C 3.107 1.845 -6.247 1.00 . A X . 16 ALA CB 1 1 1 279 1 1 16 ALA H H 1.583 1.585 -4.115 1.00 . A X . 16 ALA H 1 1 1 280 1 1 16 ALA HA H 3.808 0.085 -5.284 1.00 . A X . 16 ALA HA 1 1 1 281 1 1 16 ALA HB1 H 2.364 1.313 -6.823 1.00 . A X . 16 ALA HB1 1 1 1 282 1 1 16 ALA HB2 H 4.004 1.967 -6.839 1.00 . A X . 16 ALA HB2 1 1 1 283 1 1 16 ALA HB3 H 2.722 2.817 -5.973 1.00 . A X . 16 ALA HB3 1 1 1 284 1 1 16 ALA N N 2.232 0.854 -4.193 1.00 . A X . 16 ALA N 1 1 1 285 1 1 16 ALA O O 5.569 2.102 -4.690 1.00 . A X . 16 ALA O 1 1 1 286 1 1 17 LEU C C 5.848 1.734 -1.088 1.00 . A X . 17 LEU C 1 1 1 287 1 1 17 LEU CA C 5.153 2.708 -2.028 1.00 . A X . 17 LEU CA 1 1 1 288 1 1 17 LEU CB C 4.413 3.784 -1.226 1.00 . A X . 17 LEU CB 1 1 1 289 1 1 17 LEU CD1 C 6.291 5.450 -1.192 1.00 . A X . 17 LEU CD1 1 1 1 290 1 1 17 LEU CD2 C 4.454 5.599 0.503 1.00 . A X . 17 LEU CD2 1 1 1 291 1 1 17 LEU CG C 5.304 4.662 -0.342 1.00 . A X . 17 LEU CG 1 1 1 292 1 1 17 LEU H H 3.388 1.657 -2.523 1.00 . A X . 17 LEU H 1 1 1 293 1 1 17 LEU HA H 5.896 3.183 -2.653 1.00 . A X . 17 LEU HA 1 1 1 294 1 1 17 LEU HB2 H 3.888 4.423 -1.922 1.00 . A X . 17 LEU HB2 1 1 1 295 1 1 17 LEU HB3 H 3.688 3.296 -0.595 1.00 . A X . 17 LEU HB3 1 1 1 296 1 1 17 LEU HD11 H 6.915 6.055 -0.551 1.00 . A X . 17 LEU HD11 1 1 1 297 1 1 17 LEU HD12 H 5.752 6.089 -1.876 1.00 . A X . 17 LEU HD12 1 1 1 298 1 1 17 LEU HD13 H 6.908 4.765 -1.753 1.00 . A X . 17 LEU HD13 1 1 1 299 1 1 17 LEU HD21 H 5.097 6.207 1.123 1.00 . A X . 17 LEU HD21 1 1 1 300 1 1 17 LEU HD22 H 3.793 5.019 1.131 1.00 . A X . 17 LEU HD22 1 1 1 301 1 1 17 LEU HD23 H 3.870 6.238 -0.141 1.00 . A X . 17 LEU HD23 1 1 1 302 1 1 17 LEU HG H 5.871 4.029 0.326 1.00 . A X . 17 LEU HG 1 1 1 303 1 1 17 LEU N N 4.229 1.994 -2.895 1.00 . A X . 17 LEU N 1 1 1 304 1 1 17 LEU O O 7.068 1.764 -0.942 1.00 . A X . 17 LEU O 1 1 1 305 1 1 18 ALA C C 6.483 -1.134 -0.297 1.00 . A X . 18 ALA C 1 1 1 306 1 1 18 ALA CA C 5.608 -0.135 0.447 1.00 . A X . 18 ALA CA 1 1 1 307 1 1 18 ALA CB C 4.484 -0.848 1.187 1.00 . A X . 18 ALA CB 1 1 1 308 1 1 18 ALA H H 4.096 0.865 -0.646 1.00 . A X . 18 ALA H 1 1 1 309 1 1 18 ALA HA H 6.210 0.389 1.172 1.00 . A X . 18 ALA HA 1 1 1 310 1 1 18 ALA HB1 H 3.866 -0.122 1.694 1.00 . A X . 18 ALA HB1 1 1 1 311 1 1 18 ALA HB2 H 4.907 -1.530 1.911 1.00 . A X . 18 ALA HB2 1 1 1 312 1 1 18 ALA HB3 H 3.885 -1.401 0.480 1.00 . A X . 18 ALA HB3 1 1 1 313 1 1 18 ALA N N 5.067 0.851 -0.475 1.00 . A X . 18 ALA N 1 1 1 314 1 1 18 ALA O O 7.565 -1.500 0.166 1.00 . A X . 18 ALA O 1 1 1 315 1 1 19 LEU C C 7.954 -1.741 -2.964 1.00 . A X . 19 LEU C 1 1 1 316 1 1 19 LEU CA C 6.775 -2.464 -2.317 1.00 . A X . 19 LEU CA 1 1 1 317 1 1 19 LEU CB C 5.878 -3.095 -3.394 1.00 . A X . 19 LEU CB 1 1 1 318 1 1 19 LEU CD1 C 3.952 -3.779 -1.911 1.00 . A X . 19 LEU CD1 1 1 1 319 1 1 19 LEU CD2 C 4.287 -4.896 -4.119 1.00 . A X . 19 LEU CD2 1 1 1 320 1 1 19 LEU CG C 4.980 -4.252 -2.927 1.00 . A X . 19 LEU CG 1 1 1 321 1 1 19 LEU H H 5.139 -1.235 -1.774 1.00 . A X . 19 LEU H 1 1 1 322 1 1 19 LEU HA H 7.162 -3.248 -1.681 1.00 . A X . 19 LEU HA 1 1 1 323 1 1 19 LEU HB2 H 5.242 -2.321 -3.797 1.00 . A X . 19 LEU HB2 1 1 1 324 1 1 19 LEU HB3 H 6.514 -3.461 -4.187 1.00 . A X . 19 LEU HB3 1 1 1 325 1 1 19 LEU HD11 H 3.337 -3.010 -2.356 1.00 . A X . 19 LEU HD11 1 1 1 326 1 1 19 LEU HD12 H 4.459 -3.380 -1.044 1.00 . A X . 19 LEU HD12 1 1 1 327 1 1 19 LEU HD13 H 3.331 -4.610 -1.614 1.00 . A X . 19 LEU HD13 1 1 1 328 1 1 19 LEU HD21 H 3.699 -4.153 -4.634 1.00 . A X . 19 LEU HD21 1 1 1 329 1 1 19 LEU HD22 H 3.642 -5.690 -3.774 1.00 . A X . 19 LEU HD22 1 1 1 330 1 1 19 LEU HD23 H 5.027 -5.301 -4.792 1.00 . A X . 19 LEU HD23 1 1 1 331 1 1 19 LEU HG H 5.593 -5.004 -2.453 1.00 . A X . 19 LEU HG 1 1 1 332 1 1 19 LEU N N 6.019 -1.547 -1.472 1.00 . A X . 19 LEU N 1 1 1 333 1 1 19 LEU O O 8.884 -2.370 -3.465 1.00 . A X . 19 LEU O 1 1 1 334 1 1 20 LYS C C 10.108 0.450 -2.369 1.00 . A X . 20 LYS C 1 1 1 335 1 1 20 LYS CA C 9.024 0.388 -3.434 1.00 . A X . 20 LYS CA 1 1 1 336 1 1 20 LYS CB C 8.553 1.797 -3.800 1.00 . A X . 20 LYS CB 1 1 1 337 1 1 20 LYS CD C 9.053 3.963 -4.983 1.00 . A X . 20 LYS CD 1 1 1 338 1 1 20 LYS CE C 7.875 3.766 -5.928 1.00 . A X . 20 LYS CE 1 1 1 339 1 1 20 LYS CG C 9.613 2.634 -4.498 1.00 . A X . 20 LYS CG 1 1 1 340 1 1 20 LYS H H 7.124 0.035 -2.579 1.00 . A X . 20 LYS H 1 1 1 341 1 1 20 LYS HA H 9.423 -0.094 -4.313 1.00 . A X . 20 LYS HA 1 1 1 342 1 1 20 LYS HB2 H 7.699 1.718 -4.455 1.00 . A X . 20 LYS HB2 1 1 1 343 1 1 20 LYS HB3 H 8.255 2.310 -2.898 1.00 . A X . 20 LYS HB3 1 1 1 344 1 1 20 LYS HD2 H 8.724 4.535 -4.129 1.00 . A X . 20 LYS HD2 1 1 1 345 1 1 20 LYS HD3 H 9.831 4.502 -5.501 1.00 . A X . 20 LYS HD3 1 1 1 346 1 1 20 LYS HE2 H 7.073 3.288 -5.382 1.00 . A X . 20 LYS HE2 1 1 1 347 1 1 20 LYS HE3 H 7.544 4.734 -6.272 1.00 . A X . 20 LYS HE3 1 1 1 348 1 1 20 LYS HG2 H 10.418 2.830 -3.804 1.00 . A X . 20 LYS HG2 1 1 1 349 1 1 20 LYS HG3 H 9.992 2.082 -5.344 1.00 . A X . 20 LYS HG3 1 1 1 350 1 1 20 LYS HZ1 H 8.576 1.993 -6.797 1.00 . A X . 20 LYS HZ1 1 1 1 351 1 1 20 LYS HZ2 H 8.955 3.388 -7.683 1.00 . A X . 20 LYS HZ2 1 1 1 352 1 1 20 LYS HZ3 H 7.373 2.780 -7.699 1.00 . A X . 20 LYS HZ3 1 1 1 353 1 1 20 LYS N N 7.914 -0.414 -2.942 1.00 . A X . 20 LYS N 1 1 1 354 1 1 20 LYS NZ N 8.220 2.924 -7.106 1.00 . A X . 20 LYS NZ 1 1 1 355 1 1 20 LYS O O 11.302 0.472 -2.676 1.00 . A X . 20 LYS O 1 1 1 356 1 1 21 LEU C C 11.234 -0.979 0.064 1.00 . A X . 21 LEU C 1 1 1 357 1 1 21 LEU CA C 10.588 0.403 0.020 1.00 . A X . 21 LEU CA 1 1 1 358 1 1 21 LEU CB C 9.834 0.682 1.322 1.00 . A X . 21 LEU CB 1 1 1 359 1 1 21 LEU CD1 C 8.306 2.160 2.654 1.00 . A X . 21 LEU CD1 1 1 1 360 1 1 21 LEU CD2 C 10.199 3.159 1.369 1.00 . A X . 21 LEU CD2 1 1 1 361 1 1 21 LEU CG C 9.157 2.053 1.399 1.00 . A X . 21 LEU CG 1 1 1 362 1 1 21 LEU H H 8.711 0.550 -0.940 1.00 . A X . 21 LEU H 1 1 1 363 1 1 21 LEU HA H 11.355 1.149 -0.119 1.00 . A X . 21 LEU HA 1 1 1 364 1 1 21 LEU HB2 H 9.077 -0.079 1.443 1.00 . A X . 21 LEU HB2 1 1 1 365 1 1 21 LEU HB3 H 10.532 0.603 2.142 1.00 . A X . 21 LEU HB3 1 1 1 366 1 1 21 LEU HD11 H 7.846 3.136 2.694 1.00 . A X . 21 LEU HD11 1 1 1 367 1 1 21 LEU HD12 H 8.930 2.021 3.524 1.00 . A X . 21 LEU HD12 1 1 1 368 1 1 21 LEU HD13 H 7.539 1.401 2.638 1.00 . A X . 21 LEU HD13 1 1 1 369 1 1 21 LEU HD21 H 10.774 3.087 0.458 1.00 . A X . 21 LEU HD21 1 1 1 370 1 1 21 LEU HD22 H 10.857 3.057 2.219 1.00 . A X . 21 LEU HD22 1 1 1 371 1 1 21 LEU HD23 H 9.707 4.120 1.408 1.00 . A X . 21 LEU HD23 1 1 1 372 1 1 21 LEU HG H 8.507 2.176 0.543 1.00 . A X . 21 LEU HG 1 1 1 373 1 1 21 LEU N N 9.675 0.475 -1.112 1.00 . A X . 21 LEU N 1 1 1 374 1 1 21 LEU O O 12.354 -1.146 0.551 1.00 . A X . 21 LEU O 1 1 1 375 1 1 22 LYS C C 11.887 -3.338 -1.916 1.00 . A X . 22 LYS C 1 1 1 376 1 1 22 LYS CA C 11.049 -3.307 -0.637 1.00 . A X . 22 LYS CA 1 1 1 377 1 1 22 LYS CB C 9.908 -4.333 -0.699 1.00 . A X . 22 LYS CB 1 1 1 378 1 1 22 LYS CD C 11.270 -6.184 0.341 1.00 . A X . 22 LYS CD 1 1 1 379 1 1 22 LYS CE C 10.520 -6.181 1.664 1.00 . A X . 22 LYS CE 1 1 1 380 1 1 22 LYS CG C 10.372 -5.783 -0.816 1.00 . A X . 22 LYS CG 1 1 1 381 1 1 22 LYS H H 9.585 -1.785 -0.721 1.00 . A X . 22 LYS H 1 1 1 382 1 1 22 LYS HA H 11.687 -3.529 0.207 1.00 . A X . 22 LYS HA 1 1 1 383 1 1 22 LYS HB2 H 9.312 -4.244 0.198 1.00 . A X . 22 LYS HB2 1 1 1 384 1 1 22 LYS HB3 H 9.287 -4.108 -1.553 1.00 . A X . 22 LYS HB3 1 1 1 385 1 1 22 LYS HD2 H 11.649 -7.177 0.158 1.00 . A X . 22 LYS HD2 1 1 1 386 1 1 22 LYS HD3 H 12.094 -5.487 0.401 1.00 . A X . 22 LYS HD3 1 1 1 387 1 1 22 LYS HE2 H 10.048 -5.219 1.795 1.00 . A X . 22 LYS HE2 1 1 1 388 1 1 22 LYS HE3 H 9.764 -6.952 1.638 1.00 . A X . 22 LYS HE3 1 1 1 389 1 1 22 LYS HG2 H 9.506 -6.426 -0.823 1.00 . A X . 22 LYS HG2 1 1 1 390 1 1 22 LYS HG3 H 10.918 -5.900 -1.741 1.00 . A X . 22 LYS HG3 1 1 1 391 1 1 22 LYS HZ1 H 12.111 -5.649 2.909 1.00 . A X . 22 LYS HZ1 1 1 1 392 1 1 22 LYS HZ2 H 11.964 -7.319 2.661 1.00 . A X . 22 LYS HZ2 1 1 1 393 1 1 22 LYS HZ3 H 10.882 -6.520 3.696 1.00 . A X . 22 LYS HZ3 1 1 1 394 1 1 22 LYS N N 10.511 -1.966 -0.454 1.00 . A X . 22 LYS N 1 1 1 395 1 1 22 LYS NZ N 11.431 -6.434 2.810 1.00 . A X . 22 LYS NZ 1 1 1 396 1 1 22 LYS O O 11.540 -3.989 -2.901 1.00 . A X . 22 LYS O 1 1 1 397 1 1 23 LYS C C 14.912 -3.504 -3.111 1.00 . A X . 23 LYS C 1 1 1 398 1 1 23 LYS CA C 13.828 -2.426 -3.051 1.00 . A X . 23 LYS CA 1 1 1 399 1 1 23 LYS CB C 14.432 -1.019 -3.019 1.00 . A X . 23 LYS CB 1 1 1 400 1 1 23 LYS CD C 15.962 0.696 -3.997 1.00 . A X . 23 LYS CD 1 1 1 401 1 1 23 LYS CE C 17.317 0.855 -4.664 1.00 . A X . 23 LYS CE 1 1 1 402 1 1 23 LYS CG C 15.429 -0.719 -4.128 1.00 . A X . 23 LYS CG 1 1 1 403 1 1 23 LYS H H 13.238 -2.169 -1.047 1.00 . A X . 23 LYS H 1 1 1 404 1 1 23 LYS HA H 13.200 -2.518 -3.921 1.00 . A X . 23 LYS HA 1 1 1 405 1 1 23 LYS HB2 H 13.631 -0.299 -3.088 1.00 . A X . 23 LYS HB2 1 1 1 406 1 1 23 LYS HB3 H 14.937 -0.885 -2.072 1.00 . A X . 23 LYS HB3 1 1 1 407 1 1 23 LYS HD2 H 15.265 1.379 -4.459 1.00 . A X . 23 LYS HD2 1 1 1 408 1 1 23 LYS HD3 H 16.059 0.937 -2.948 1.00 . A X . 23 LYS HD3 1 1 1 409 1 1 23 LYS HE2 H 17.218 0.624 -5.714 1.00 . A X . 23 LYS HE2 1 1 1 410 1 1 23 LYS HE3 H 17.643 1.878 -4.550 1.00 . A X . 23 LYS HE3 1 1 1 411 1 1 23 LYS HG2 H 16.252 -1.416 -4.061 1.00 . A X . 23 LYS HG2 1 1 1 412 1 1 23 LYS HG3 H 14.937 -0.826 -5.084 1.00 . A X . 23 LYS HG3 1 1 1 413 1 1 23 LYS HZ1 H 18.199 -1.023 -4.407 1.00 . A X . 23 LYS HZ1 1 1 1 414 1 1 23 LYS HZ2 H 18.248 -0.048 -3.020 1.00 . A X . 23 LYS HZ2 1 1 1 415 1 1 23 LYS HZ3 H 19.297 0.267 -4.320 1.00 . A X . 23 LYS HZ3 1 1 1 416 1 1 23 LYS N N 12.985 -2.604 -1.886 1.00 . A X . 23 LYS N 1 1 1 417 1 1 23 LYS NZ N 18.335 -0.048 -4.061 1.00 . A X . 23 LYS NZ 1 1 1 418 1 1 23 LYS O O 14.692 -4.575 -3.677 1.00 . A X . 23 LYS O 1 1 1 419 1 1 24 ALA C C 18.335 -3.535 -1.684 1.00 . A X . 24 ALA C 1 1 1 420 1 1 24 ALA CA C 17.193 -4.144 -2.486 1.00 . A X . 24 ALA CA 1 1 1 421 1 1 24 ALA CB C 17.654 -4.462 -3.908 1.00 . A X . 24 ALA CB 1 1 1 422 1 1 24 ALA H H 16.131 -2.389 -1.988 1.00 . A X . 24 ALA H 1 1 1 423 1 1 24 ALA HA H 16.883 -5.065 -2.013 1.00 . A X . 24 ALA HA 1 1 1 424 1 1 24 ALA HB1 H 18.022 -3.562 -4.379 1.00 . A X . 24 ALA HB1 1 1 1 425 1 1 24 ALA HB2 H 16.823 -4.851 -4.478 1.00 . A X . 24 ALA HB2 1 1 1 426 1 1 24 ALA HB3 H 18.444 -5.197 -3.874 1.00 . A X . 24 ALA HB3 1 1 1 427 1 1 24 ALA N N 16.054 -3.230 -2.486 1.00 . A X . 24 ALA N 1 1 1 428 1 1 24 ALA O O 19.465 -3.442 -2.209 1.00 . A X . 24 ALA O 1 1 1 429 1 1 24 ALA OXT O 18.075 -3.084 -0.548 1.00 . A X . 24 ALA OXT 1 1 2 430 1 1 1 LYS C C -12.446 4.479 4.069 1.00 . A X . 1 LYS C 1 1 2 431 1 1 1 LYS CA C -12.908 5.623 4.965 1.00 . A X . 1 LYS CA 1 1 2 432 1 1 1 LYS CB C -11.824 5.963 5.997 1.00 . A X . 1 LYS CB 1 1 2 433 1 1 1 LYS CD C -11.830 8.454 5.667 1.00 . A X . 1 LYS CD 1 1 2 434 1 1 1 LYS CE C -11.872 9.814 6.348 1.00 . A X . 1 LYS CE 1 1 2 435 1 1 1 LYS CG C -12.004 7.318 6.663 1.00 . A X . 1 LYS CG 1 1 2 436 1 1 1 LYS H1 H -14.077 4.448 6.234 1.00 . A X . 1 LYS H1 1 1 2 437 1 1 1 LYS H2 H -14.924 5.099 4.918 1.00 . A X . 1 LYS H2 1 1 2 438 1 1 1 LYS H3 H -14.497 6.091 6.228 1.00 . A X . 1 LYS H3 1 1 2 439 1 1 1 LYS HA H -13.078 6.489 4.341 1.00 . A X . 1 LYS HA 1 1 2 440 1 1 1 LYS HB2 H -11.831 5.207 6.766 1.00 . A X . 1 LYS HB2 1 1 2 441 1 1 1 LYS HB3 H -10.860 5.954 5.508 1.00 . A X . 1 LYS HB3 1 1 2 442 1 1 1 LYS HD2 H -10.879 8.340 5.171 1.00 . A X . 1 LYS HD2 1 1 2 443 1 1 1 LYS HD3 H -12.625 8.401 4.938 1.00 . A X . 1 LYS HD3 1 1 2 444 1 1 1 LYS HE2 H -11.117 9.836 7.118 1.00 . A X . 1 LYS HE2 1 1 2 445 1 1 1 LYS HE3 H -11.658 10.575 5.613 1.00 . A X . 1 LYS HE3 1 1 2 446 1 1 1 LYS HG2 H -12.999 7.374 7.083 1.00 . A X . 1 LYS HG2 1 1 2 447 1 1 1 LYS HG3 H -11.273 7.426 7.450 1.00 . A X . 1 LYS HG3 1 1 2 448 1 1 1 LYS HZ1 H -13.204 11.069 7.355 1.00 . A X . 1 LYS HZ1 1 1 2 449 1 1 1 LYS HZ2 H -13.382 9.433 7.747 1.00 . A X . 1 LYS HZ2 1 1 2 450 1 1 1 LYS HZ3 H -13.957 10.012 6.259 1.00 . A X . 1 LYS HZ3 1 1 2 451 1 1 1 LYS N N -14.188 5.293 5.633 1.00 . A X . 1 LYS N 1 1 2 452 1 1 1 LYS NZ N -13.195 10.098 6.968 1.00 . A X . 1 LYS NZ 1 1 2 453 1 1 1 LYS O O -12.705 4.488 2.864 1.00 . A X . 1 LYS O 1 1 2 454 1 1 2 LYS C C -10.431 2.772 2.713 1.00 . A X . 2 LYS C 1 1 2 455 1 1 2 LYS CA C -11.240 2.345 3.936 1.00 . A X . 2 LYS CA 1 1 2 456 1 1 2 LYS CB C -12.364 1.390 3.530 1.00 . A X . 2 LYS CB 1 1 2 457 1 1 2 LYS CD C -11.795 -0.315 5.273 1.00 . A X . 2 LYS CD 1 1 2 458 1 1 2 LYS CE C -12.295 -1.131 6.451 1.00 . A X . 2 LYS CE 1 1 2 459 1 1 2 LYS CG C -12.893 0.557 4.685 1.00 . A X . 2 LYS CG 1 1 2 460 1 1 2 LYS H H -11.628 3.542 5.642 1.00 . A X . 2 LYS H 1 1 2 461 1 1 2 LYS HA H -10.577 1.822 4.608 1.00 . A X . 2 LYS HA 1 1 2 462 1 1 2 LYS HB2 H -13.183 1.965 3.125 1.00 . A X . 2 LYS HB2 1 1 2 463 1 1 2 LYS HB3 H -11.995 0.718 2.769 1.00 . A X . 2 LYS HB3 1 1 2 464 1 1 2 LYS HD2 H -11.435 -0.987 4.507 1.00 . A X . 2 LYS HD2 1 1 2 465 1 1 2 LYS HD3 H -10.984 0.321 5.602 1.00 . A X . 2 LYS HD3 1 1 2 466 1 1 2 LYS HE2 H -12.684 -0.458 7.200 1.00 . A X . 2 LYS HE2 1 1 2 467 1 1 2 LYS HE3 H -13.087 -1.785 6.111 1.00 . A X . 2 LYS HE3 1 1 2 468 1 1 2 LYS HG2 H -13.269 1.218 5.451 1.00 . A X . 2 LYS HG2 1 1 2 469 1 1 2 LYS HG3 H -13.691 -0.077 4.326 1.00 . A X . 2 LYS HG3 1 1 2 470 1 1 2 LYS HZ1 H -10.850 -2.645 6.356 1.00 . A X . 2 LYS HZ1 1 1 2 471 1 1 2 LYS HZ2 H -11.571 -2.472 7.882 1.00 . A X . 2 LYS HZ2 1 1 2 472 1 1 2 LYS HZ3 H -10.426 -1.345 7.356 1.00 . A X . 2 LYS HZ3 1 1 2 473 1 1 2 LYS N N -11.771 3.495 4.670 1.00 . A X . 2 LYS N 1 1 2 474 1 1 2 LYS NZ N -11.212 -1.953 7.053 1.00 . A X . 2 LYS NZ 1 1 2 475 1 1 2 LYS O O -10.889 2.646 1.574 1.00 . A X . 2 LYS O 1 1 2 476 1 1 3 LEU C C -8.834 4.855 1.093 1.00 . A X . 3 LEU C 1 1 2 477 1 1 3 LEU CA C -8.295 3.680 1.909 1.00 . A X . 3 LEU CA 1 1 2 478 1 1 3 LEU CB C -7.958 2.498 0.982 1.00 . A X . 3 LEU CB 1 1 2 479 1 1 3 LEU CD1 C -7.528 0.689 2.689 1.00 . A X . 3 LEU CD1 1 1 2 480 1 1 3 LEU CD2 C -6.502 0.542 0.418 1.00 . A X . 3 LEU CD2 1 1 2 481 1 1 3 LEU CG C -6.947 1.481 1.527 1.00 . A X . 3 LEU CG 1 1 2 482 1 1 3 LEU H H -8.954 3.401 3.907 1.00 . A X . 3 LEU H 1 1 2 483 1 1 3 LEU HA H -7.384 4.002 2.393 1.00 . A X . 3 LEU HA 1 1 2 484 1 1 3 LEU HB2 H -8.874 1.970 0.763 1.00 . A X . 3 LEU HB2 1 1 2 485 1 1 3 LEU HB3 H -7.567 2.895 0.057 1.00 . A X . 3 LEU HB3 1 1 2 486 1 1 3 LEU HD11 H -8.384 0.129 2.347 1.00 . A X . 3 LEU HD11 1 1 2 487 1 1 3 LEU HD12 H -7.832 1.367 3.472 1.00 . A X . 3 LEU HD12 1 1 2 488 1 1 3 LEU HD13 H -6.781 0.008 3.070 1.00 . A X . 3 LEU HD13 1 1 2 489 1 1 3 LEU HD21 H -5.814 -0.186 0.819 1.00 . A X . 3 LEU HD21 1 1 2 490 1 1 3 LEU HD22 H -6.013 1.108 -0.362 1.00 . A X . 3 LEU HD22 1 1 2 491 1 1 3 LEU HD23 H -7.364 0.036 0.010 1.00 . A X . 3 LEU HD23 1 1 2 492 1 1 3 LEU HG H -6.075 2.009 1.886 1.00 . A X . 3 LEU HG 1 1 2 493 1 1 3 LEU N N -9.227 3.282 2.968 1.00 . A X . 3 LEU N 1 1 2 494 1 1 3 LEU O O -8.571 4.968 -0.103 1.00 . A X . 3 LEU O 1 1 2 495 1 1 4 LYS C C -8.979 8.014 1.124 1.00 . A X . 4 LYS C 1 1 2 496 1 1 4 LYS CA C -10.068 6.947 1.108 1.00 . A X . 4 LYS CA 1 1 2 497 1 1 4 LYS CB C -11.331 7.457 1.815 1.00 . A X . 4 LYS CB 1 1 2 498 1 1 4 LYS CD C -12.184 8.823 -0.144 1.00 . A X . 4 LYS CD 1 1 2 499 1 1 4 LYS CE C -13.374 7.921 -0.434 1.00 . A X . 4 LYS CE 1 1 2 500 1 1 4 LYS CG C -11.813 8.823 1.332 1.00 . A X . 4 LYS CG 1 1 2 501 1 1 4 LYS H H -9.790 5.570 2.691 1.00 . A X . 4 LYS H 1 1 2 502 1 1 4 LYS HA H -10.307 6.707 0.082 1.00 . A X . 4 LYS HA 1 1 2 503 1 1 4 LYS HB2 H -12.127 6.744 1.658 1.00 . A X . 4 LYS HB2 1 1 2 504 1 1 4 LYS HB3 H -11.130 7.526 2.874 1.00 . A X . 4 LYS HB3 1 1 2 505 1 1 4 LYS HD2 H -12.431 9.831 -0.443 1.00 . A X . 4 LYS HD2 1 1 2 506 1 1 4 LYS HD3 H -11.336 8.477 -0.716 1.00 . A X . 4 LYS HD3 1 1 2 507 1 1 4 LYS HE2 H -13.101 6.901 -0.202 1.00 . A X . 4 LYS HE2 1 1 2 508 1 1 4 LYS HE3 H -14.201 8.223 0.190 1.00 . A X . 4 LYS HE3 1 1 2 509 1 1 4 LYS HG2 H -12.682 9.106 1.907 1.00 . A X . 4 LYS HG2 1 1 2 510 1 1 4 LYS HG3 H -11.025 9.543 1.494 1.00 . A X . 4 LYS HG3 1 1 2 511 1 1 4 LYS HZ1 H -12.962 7.834 -2.482 1.00 . A X . 4 LYS HZ1 1 1 2 512 1 1 4 LYS HZ2 H -14.175 8.947 -2.070 1.00 . A X . 4 LYS HZ2 1 1 2 513 1 1 4 LYS HZ3 H -14.513 7.284 -2.066 1.00 . A X . 4 LYS HZ3 1 1 2 514 1 1 4 LYS N N -9.575 5.735 1.750 1.00 . A X . 4 LYS N 1 1 2 515 1 1 4 LYS NZ N -13.786 8.001 -1.862 1.00 . A X . 4 LYS NZ 1 1 2 516 1 1 4 LYS O O -8.618 8.569 0.088 1.00 . A X . 4 LYS O 1 1 2 517 1 1 5 LEU C C -6.072 8.545 2.794 1.00 . A X . 5 LEU C 1 1 2 518 1 1 5 LEU CA C -7.375 9.253 2.456 1.00 . A X . 5 LEU CA 1 1 2 519 1 1 5 LEU CB C -7.728 10.274 3.538 1.00 . A X . 5 LEU CB 1 1 2 520 1 1 5 LEU CD1 C -9.244 12.089 4.389 1.00 . A X . 5 LEU CD1 1 1 2 521 1 1 5 LEU CD2 C -8.892 11.822 1.932 1.00 . A X . 5 LEU CD2 1 1 2 522 1 1 5 LEU CG C -8.997 11.095 3.265 1.00 . A X . 5 LEU CG 1 1 2 523 1 1 5 LEU H H -8.768 7.792 3.100 1.00 . A X . 5 LEU H 1 1 2 524 1 1 5 LEU HA H -7.255 9.764 1.512 1.00 . A X . 5 LEU HA 1 1 2 525 1 1 5 LEU HB2 H -7.859 9.746 4.472 1.00 . A X . 5 LEU HB2 1 1 2 526 1 1 5 LEU HB3 H -6.899 10.958 3.642 1.00 . A X . 5 LEU HB3 1 1 2 527 1 1 5 LEU HD11 H -9.338 11.561 5.327 1.00 . A X . 5 LEU HD11 1 1 2 528 1 1 5 LEU HD12 H -10.155 12.636 4.191 1.00 . A X . 5 LEU HD12 1 1 2 529 1 1 5 LEU HD13 H -8.416 12.780 4.445 1.00 . A X . 5 LEU HD13 1 1 2 530 1 1 5 LEU HD21 H -8.742 11.106 1.138 1.00 . A X . 5 LEU HD21 1 1 2 531 1 1 5 LEU HD22 H -8.057 12.507 1.961 1.00 . A X . 5 LEU HD22 1 1 2 532 1 1 5 LEU HD23 H -9.802 12.375 1.750 1.00 . A X . 5 LEU HD23 1 1 2 533 1 1 5 LEU HG H -9.847 10.429 3.218 1.00 . A X . 5 LEU HG 1 1 2 534 1 1 5 LEU N N -8.442 8.277 2.305 1.00 . A X . 5 LEU N 1 1 2 535 1 1 5 LEU O O -5.047 9.173 3.061 1.00 . A X . 5 LEU O 1 1 2 536 1 1 6 ALA C C -3.923 6.607 1.897 1.00 . A X . 6 ALA C 1 1 2 537 1 1 6 ALA CA C -4.941 6.414 3.012 1.00 . A X . 6 ALA CA 1 1 2 538 1 1 6 ALA CB C -5.318 4.950 3.136 1.00 . A X . 6 ALA CB 1 1 2 539 1 1 6 ALA H H -6.980 6.782 2.602 1.00 . A X . 6 ALA H 1 1 2 540 1 1 6 ALA HA H -4.504 6.732 3.947 1.00 . A X . 6 ALA HA 1 1 2 541 1 1 6 ALA HB1 H -4.432 4.368 3.336 1.00 . A X . 6 ALA HB1 1 1 2 542 1 1 6 ALA HB2 H -5.770 4.616 2.213 1.00 . A X . 6 ALA HB2 1 1 2 543 1 1 6 ALA HB3 H -6.021 4.827 3.946 1.00 . A X . 6 ALA HB3 1 1 2 544 1 1 6 ALA N N -6.123 7.224 2.772 1.00 . A X . 6 ALA N 1 1 2 545 1 1 6 ALA O O -2.718 6.588 2.134 1.00 . A X . 6 ALA O 1 1 2 546 1 1 7 LEU C C -3.107 8.466 -0.602 1.00 . A X . 7 LEU C 1 1 2 547 1 1 7 LEU CA C -3.565 7.012 -0.483 1.00 . A X . 7 LEU CA 1 1 2 548 1 1 7 LEU CB C -4.295 6.580 -1.764 1.00 . A X . 7 LEU CB 1 1 2 549 1 1 7 LEU CD1 C -5.362 4.431 -0.970 1.00 . A X . 7 LEU CD1 1 1 2 550 1 1 7 LEU CD2 C -4.912 4.776 -3.399 1.00 . A X . 7 LEU CD2 1 1 2 551 1 1 7 LEU CG C -4.426 5.064 -1.987 1.00 . A X . 7 LEU CG 1 1 2 552 1 1 7 LEU H H -5.393 6.865 0.573 1.00 . A X . 7 LEU H 1 1 2 553 1 1 7 LEU HA H -2.695 6.388 -0.351 1.00 . A X . 7 LEU HA 1 1 2 554 1 1 7 LEU HB2 H -5.289 7.004 -1.744 1.00 . A X . 7 LEU HB2 1 1 2 555 1 1 7 LEU HB3 H -3.764 6.998 -2.607 1.00 . A X . 7 LEU HB3 1 1 2 556 1 1 7 LEU HD11 H -5.431 3.370 -1.157 1.00 . A X . 7 LEU HD11 1 1 2 557 1 1 7 LEU HD12 H -6.343 4.877 -1.057 1.00 . A X . 7 LEU HD12 1 1 2 558 1 1 7 LEU HD13 H -4.978 4.598 0.025 1.00 . A X . 7 LEU HD13 1 1 2 559 1 1 7 LEU HD21 H -5.002 3.708 -3.539 1.00 . A X . 7 LEU HD21 1 1 2 560 1 1 7 LEU HD22 H -4.204 5.174 -4.112 1.00 . A X . 7 LEU HD22 1 1 2 561 1 1 7 LEU HD23 H -5.874 5.242 -3.549 1.00 . A X . 7 LEU HD23 1 1 2 562 1 1 7 LEU HG H -3.454 4.606 -1.869 1.00 . A X . 7 LEU HG 1 1 2 563 1 1 7 LEU N N -4.422 6.827 0.686 1.00 . A X . 7 LEU N 1 1 2 564 1 1 7 LEU O O -2.648 8.902 -1.654 1.00 . A X . 7 LEU O 1 1 2 565 1 1 8 ALA C C -1.532 10.742 1.349 1.00 . A X . 8 ALA C 1 1 2 566 1 1 8 ALA CA C -2.796 10.600 0.517 1.00 . A X . 8 ALA CA 1 1 2 567 1 1 8 ALA CB C -3.901 11.491 1.061 1.00 . A X . 8 ALA CB 1 1 2 568 1 1 8 ALA H H -3.593 8.811 1.299 1.00 . A X . 8 ALA H 1 1 2 569 1 1 8 ALA HA H -2.584 10.902 -0.501 1.00 . A X . 8 ALA HA 1 1 2 570 1 1 8 ALA HB1 H -4.787 11.375 0.456 1.00 . A X . 8 ALA HB1 1 1 2 571 1 1 8 ALA HB2 H -3.578 12.521 1.036 1.00 . A X . 8 ALA HB2 1 1 2 572 1 1 8 ALA HB3 H -4.121 11.209 2.080 1.00 . A X . 8 ALA HB3 1 1 2 573 1 1 8 ALA N N -3.222 9.210 0.489 1.00 . A X . 8 ALA N 1 1 2 574 1 1 8 ALA O O -0.876 11.782 1.339 1.00 . A X . 8 ALA O 1 1 2 575 1 1 9 LYS C C 1.220 9.294 1.969 1.00 . A X . 9 LYS C 1 1 2 576 1 1 9 LYS CA C 0.028 9.652 2.862 1.00 . A X . 9 LYS CA 1 1 2 577 1 1 9 LYS CB C -0.100 8.670 4.032 1.00 . A X . 9 LYS CB 1 1 2 578 1 1 9 LYS CD C -1.407 7.965 6.068 1.00 . A X . 9 LYS CD 1 1 2 579 1 1 9 LYS CE C -2.522 8.342 7.033 1.00 . A X . 9 LYS CE 1 1 2 580 1 1 9 LYS CG C -1.225 9.021 4.991 1.00 . A X . 9 LYS CG 1 1 2 581 1 1 9 LYS H H -1.790 8.903 2.084 1.00 . A X . 9 LYS H 1 1 2 582 1 1 9 LYS HA H 0.184 10.648 3.255 1.00 . A X . 9 LYS HA 1 1 2 583 1 1 9 LYS HB2 H -0.288 7.680 3.636 1.00 . A X . 9 LYS HB2 1 1 2 584 1 1 9 LYS HB3 H 0.828 8.657 4.582 1.00 . A X . 9 LYS HB3 1 1 2 585 1 1 9 LYS HD2 H -1.653 7.025 5.598 1.00 . A X . 9 LYS HD2 1 1 2 586 1 1 9 LYS HD3 H -0.483 7.862 6.620 1.00 . A X . 9 LYS HD3 1 1 2 587 1 1 9 LYS HE2 H -2.633 7.554 7.761 1.00 . A X . 9 LYS HE2 1 1 2 588 1 1 9 LYS HE3 H -2.250 9.259 7.536 1.00 . A X . 9 LYS HE3 1 1 2 589 1 1 9 LYS HG2 H -0.998 9.964 5.465 1.00 . A X . 9 LYS HG2 1 1 2 590 1 1 9 LYS HG3 H -2.146 9.113 4.431 1.00 . A X . 9 LYS HG3 1 1 2 591 1 1 9 LYS HZ1 H -4.042 7.713 5.746 1.00 . A X . 9 LYS HZ1 1 1 2 592 1 1 9 LYS HZ2 H -3.779 9.389 5.730 1.00 . A X . 9 LYS HZ2 1 1 2 593 1 1 9 LYS HZ3 H -4.589 8.670 7.031 1.00 . A X . 9 LYS HZ3 1 1 2 594 1 1 9 LYS N N -1.199 9.684 2.078 1.00 . A X . 9 LYS N 1 1 2 595 1 1 9 LYS NZ N -3.821 8.542 6.336 1.00 . A X . 9 LYS NZ 1 1 2 596 1 1 9 LYS O O 2.197 10.039 1.922 1.00 . A X . 9 LYS O 1 1 2 597 1 1 10 PRO C C 1.909 8.503 -1.098 1.00 . A X . 10 PRO C 1 1 2 598 1 1 10 PRO CA C 2.187 7.835 0.247 1.00 . A X . 10 PRO CA 1 1 2 599 1 1 10 PRO CB C 2.075 6.319 0.124 1.00 . A X . 10 PRO CB 1 1 2 600 1 1 10 PRO CD C 0.146 7.088 1.324 1.00 . A X . 10 PRO CD 1 1 2 601 1 1 10 PRO CG C 0.639 6.027 0.374 1.00 . A X . 10 PRO CG 1 1 2 602 1 1 10 PRO HA H 3.175 8.105 0.591 1.00 . A X . 10 PRO HA 1 1 2 603 1 1 10 PRO HB2 H 2.373 6.013 -0.868 1.00 . A X . 10 PRO HB2 1 1 2 604 1 1 10 PRO HB3 H 2.707 5.847 0.860 1.00 . A X . 10 PRO HB3 1 1 2 605 1 1 10 PRO HD2 H -0.822 7.453 1.008 1.00 . A X . 10 PRO HD2 1 1 2 606 1 1 10 PRO HD3 H 0.093 6.696 2.327 1.00 . A X . 10 PRO HD3 1 1 2 607 1 1 10 PRO HG2 H 0.090 6.075 -0.555 1.00 . A X . 10 PRO HG2 1 1 2 608 1 1 10 PRO HG3 H 0.537 5.051 0.821 1.00 . A X . 10 PRO HG3 1 1 2 609 1 1 10 PRO N N 1.165 8.161 1.233 1.00 . A X . 10 PRO N 1 1 2 610 1 1 10 PRO O O 2.740 8.448 -2.005 1.00 . A X . 10 PRO O 1 1 2 611 1 1 11 ALA C C -0.042 8.923 -3.591 1.00 . A X . 11 ALA C 1 1 2 612 1 1 11 ALA CA C 0.277 9.842 -2.412 1.00 . A X . 11 ALA CA 1 1 2 613 1 1 11 ALA CB C 1.315 10.886 -2.804 1.00 . A X . 11 ALA CB 1 1 2 614 1 1 11 ALA H H 0.071 9.006 -0.474 1.00 . A X . 11 ALA H 1 1 2 615 1 1 11 ALA HA H -0.628 10.368 -2.147 1.00 . A X . 11 ALA HA 1 1 2 616 1 1 11 ALA HB1 H 0.930 11.490 -3.612 1.00 . A X . 11 ALA HB1 1 1 2 617 1 1 11 ALA HB2 H 2.220 10.390 -3.124 1.00 . A X . 11 ALA HB2 1 1 2 618 1 1 11 ALA HB3 H 1.531 11.515 -1.954 1.00 . A X . 11 ALA HB3 1 1 2 619 1 1 11 ALA N N 0.705 9.091 -1.220 1.00 . A X . 11 ALA N 1 1 2 620 1 1 11 ALA O O -0.867 9.254 -4.444 1.00 . A X . 11 ALA O 1 1 2 621 1 1 12 LEU C C -0.658 5.785 -4.319 1.00 . A X . 12 LEU C 1 1 2 622 1 1 12 LEU CA C 0.408 6.810 -4.701 1.00 . A X . 12 LEU CA 1 1 2 623 1 1 12 LEU CB C 1.729 6.114 -5.030 1.00 . A X . 12 LEU CB 1 1 2 624 1 1 12 LEU CD1 C 4.118 6.254 -5.778 1.00 . A X . 12 LEU CD1 1 1 2 625 1 1 12 LEU CD2 C 2.403 7.728 -6.823 1.00 . A X . 12 LEU CD2 1 1 2 626 1 1 12 LEU CG C 2.838 7.037 -5.542 1.00 . A X . 12 LEU CG 1 1 2 627 1 1 12 LEU H H 1.258 7.577 -2.923 1.00 . A X . 12 LEU H 1 1 2 628 1 1 12 LEU HA H 0.070 7.351 -5.571 1.00 . A X . 12 LEU HA 1 1 2 629 1 1 12 LEU HB2 H 2.082 5.620 -4.137 1.00 . A X . 12 LEU HB2 1 1 2 630 1 1 12 LEU HB3 H 1.538 5.367 -5.785 1.00 . A X . 12 LEU HB3 1 1 2 631 1 1 12 LEU HD11 H 3.938 5.492 -6.523 1.00 . A X . 12 LEU HD11 1 1 2 632 1 1 12 LEU HD12 H 4.431 5.788 -4.856 1.00 . A X . 12 LEU HD12 1 1 2 633 1 1 12 LEU HD13 H 4.891 6.923 -6.127 1.00 . A X . 12 LEU HD13 1 1 2 634 1 1 12 LEU HD21 H 2.201 6.983 -7.580 1.00 . A X . 12 LEU HD21 1 1 2 635 1 1 12 LEU HD22 H 3.189 8.384 -7.164 1.00 . A X . 12 LEU HD22 1 1 2 636 1 1 12 LEU HD23 H 1.507 8.303 -6.637 1.00 . A X . 12 LEU HD23 1 1 2 637 1 1 12 LEU HG H 3.042 7.798 -4.800 1.00 . A X . 12 LEU HG 1 1 2 638 1 1 12 LEU N N 0.610 7.774 -3.630 1.00 . A X . 12 LEU N 1 1 2 639 1 1 12 LEU O O -1.510 6.056 -3.477 1.00 . A X . 12 LEU O 1 1 2 640 1 1 13 LEU C C -1.443 2.871 -3.353 1.00 . A X . 13 LEU C 1 1 2 641 1 1 13 LEU CA C -1.600 3.563 -4.710 1.00 . A X . 13 LEU CA 1 1 2 642 1 1 13 LEU CB C -1.553 2.520 -5.840 1.00 . A X . 13 LEU CB 1 1 2 643 1 1 13 LEU CD1 C -3.592 3.424 -6.997 1.00 . A X . 13 LEU CD1 1 1 2 644 1 1 13 LEU CD2 C -1.319 4.038 -7.844 1.00 . A X . 13 LEU CD2 1 1 2 645 1 1 13 LEU CG C -2.158 2.954 -7.182 1.00 . A X . 13 LEU CG 1 1 2 646 1 1 13 LEU H H 0.156 4.420 -5.532 1.00 . A X . 13 LEU H 1 1 2 647 1 1 13 LEU HA H -2.565 4.046 -4.732 1.00 . A X . 13 LEU HA 1 1 2 648 1 1 13 LEU HB2 H -0.520 2.255 -6.010 1.00 . A X . 13 LEU HB2 1 1 2 649 1 1 13 LEU HB3 H -2.080 1.638 -5.505 1.00 . A X . 13 LEU HB3 1 1 2 650 1 1 13 LEU HD11 H -4.002 3.713 -7.955 1.00 . A X . 13 LEU HD11 1 1 2 651 1 1 13 LEU HD12 H -3.610 4.270 -6.328 1.00 . A X . 13 LEU HD12 1 1 2 652 1 1 13 LEU HD13 H -4.182 2.622 -6.581 1.00 . A X . 13 LEU HD13 1 1 2 653 1 1 13 LEU HD21 H -1.774 4.321 -8.781 1.00 . A X . 13 LEU HD21 1 1 2 654 1 1 13 LEU HD22 H -0.325 3.660 -8.026 1.00 . A X . 13 LEU HD22 1 1 2 655 1 1 13 LEU HD23 H -1.265 4.898 -7.195 1.00 . A X . 13 LEU HD23 1 1 2 656 1 1 13 LEU HG H -2.178 2.100 -7.844 1.00 . A X . 13 LEU HG 1 1 2 657 1 1 13 LEU N N -0.588 4.600 -4.921 1.00 . A X . 13 LEU N 1 1 2 658 1 1 13 LEU O O -2.028 1.808 -3.130 1.00 . A X . 13 LEU O 1 1 2 659 1 1 14 TRP C C 0.502 1.881 -1.009 1.00 . A X . 14 TRP C 1 1 2 660 1 1 14 TRP CA C -0.465 3.039 -1.093 1.00 . A X . 14 TRP CA 1 1 2 661 1 1 14 TRP CB C -1.824 2.687 -0.469 1.00 . A X . 14 TRP CB 1 1 2 662 1 1 14 TRP CD1 C -1.634 3.227 2.028 1.00 . A X . 14 TRP CD1 1 1 2 663 1 1 14 TRP CD2 C -1.804 1.041 1.570 1.00 . A X . 14 TRP CD2 1 1 2 664 1 1 14 TRP CE2 C -1.707 1.200 2.966 1.00 . A X . 14 TRP CE2 1 1 2 665 1 1 14 TRP CE3 C -1.925 -0.251 1.047 1.00 . A X . 14 TRP CE3 1 1 2 666 1 1 14 TRP CG C -1.752 2.350 0.989 1.00 . A X . 14 TRP CG 1 1 2 667 1 1 14 TRP CH2 C -1.840 -1.135 3.303 1.00 . A X . 14 TRP CH2 1 1 2 668 1 1 14 TRP CZ2 C -1.722 0.117 3.843 1.00 . A X . 14 TRP CZ2 1 1 2 669 1 1 14 TRP CZ3 C -1.943 -1.325 1.919 1.00 . A X . 14 TRP CZ3 1 1 2 670 1 1 14 TRP H H -0.023 4.151 -2.807 1.00 . A X . 14 TRP H 1 1 2 671 1 1 14 TRP HA H -0.040 3.874 -0.553 1.00 . A X . 14 TRP HA 1 1 2 672 1 1 14 TRP HB2 H -2.492 3.527 -0.584 1.00 . A X . 14 TRP HB2 1 1 2 673 1 1 14 TRP HB3 H -2.237 1.835 -0.989 1.00 . A X . 14 TRP HB3 1 1 2 674 1 1 14 TRP HD1 H -1.573 4.299 1.914 1.00 . A X . 14 TRP HD1 1 1 2 675 1 1 14 TRP HE1 H -1.520 2.955 4.111 1.00 . A X . 14 TRP HE1 1 1 2 676 1 1 14 TRP HE3 H -2.001 -0.418 -0.018 1.00 . A X . 14 TRP HE3 1 1 2 677 1 1 14 TRP HH2 H -1.859 -2.000 3.944 1.00 . A X . 14 TRP HH2 1 1 2 678 1 1 14 TRP HZ2 H -1.647 0.247 4.913 1.00 . A X . 14 TRP HZ2 1 1 2 679 1 1 14 TRP HZ3 H -2.032 -2.330 1.535 1.00 . A X . 14 TRP HZ3 1 1 2 680 1 1 14 TRP N N -0.606 3.450 -2.484 1.00 . A X . 14 TRP N 1 1 2 681 1 1 14 TRP NE1 N -1.605 2.543 3.220 1.00 . A X . 14 TRP NE1 1 1 2 682 1 1 14 TRP O O 1.475 1.921 -0.262 1.00 . A X . 14 TRP O 1 1 2 683 1 1 15 LYS C C 2.274 -0.060 -2.840 1.00 . A X . 15 LYS C 1 1 2 684 1 1 15 LYS CA C 1.132 -0.275 -1.859 1.00 . A X . 15 LYS CA 1 1 2 685 1 1 15 LYS CB C 0.343 -1.541 -2.212 1.00 . A X . 15 LYS CB 1 1 2 686 1 1 15 LYS CD C -1.258 -2.672 -3.785 1.00 . A X . 15 LYS CD 1 1 2 687 1 1 15 LYS CE C -2.154 -2.496 -4.998 1.00 . A X . 15 LYS CE 1 1 2 688 1 1 15 LYS CG C -0.459 -1.414 -3.498 1.00 . A X . 15 LYS CG 1 1 2 689 1 1 15 LYS H H -0.534 0.901 -2.403 1.00 . A X . 15 LYS H 1 1 2 690 1 1 15 LYS HA H 1.540 -0.371 -0.877 1.00 . A X . 15 LYS HA 1 1 2 691 1 1 15 LYS HB2 H 1.035 -2.362 -2.323 1.00 . A X . 15 LYS HB2 1 1 2 692 1 1 15 LYS HB3 H -0.341 -1.763 -1.405 1.00 . A X . 15 LYS HB3 1 1 2 693 1 1 15 LYS HD2 H -0.574 -3.488 -3.970 1.00 . A X . 15 LYS HD2 1 1 2 694 1 1 15 LYS HD3 H -1.870 -2.900 -2.926 1.00 . A X . 15 LYS HD3 1 1 2 695 1 1 15 LYS HE2 H -2.767 -3.379 -5.108 1.00 . A X . 15 LYS HE2 1 1 2 696 1 1 15 LYS HE3 H -2.790 -1.639 -4.834 1.00 . A X . 15 LYS HE3 1 1 2 697 1 1 15 LYS HG2 H -1.141 -0.582 -3.405 1.00 . A X . 15 LYS HG2 1 1 2 698 1 1 15 LYS HG3 H 0.220 -1.234 -4.317 1.00 . A X . 15 LYS HG3 1 1 2 699 1 1 15 LYS HZ1 H -2.036 -2.081 -7.040 1.00 . A X . 15 LYS HZ1 1 1 2 700 1 1 15 LYS HZ2 H -0.837 -3.149 -6.488 1.00 . A X . 15 LYS HZ2 1 1 2 701 1 1 15 LYS HZ3 H -0.717 -1.491 -6.150 1.00 . A X . 15 LYS HZ3 1 1 2 702 1 1 15 LYS N N 0.261 0.873 -1.823 1.00 . A X . 15 LYS N 1 1 2 703 1 1 15 LYS NZ N -1.381 -2.289 -6.254 1.00 . A X . 15 LYS NZ 1 1 2 704 1 1 15 LYS O O 3.215 -0.852 -2.905 1.00 . A X . 15 LYS O 1 1 2 705 1 1 16 ALA C C 4.522 1.778 -3.856 1.00 . A X . 16 ALA C 1 1 2 706 1 1 16 ALA CA C 3.231 1.375 -4.557 1.00 . A X . 16 ALA CA 1 1 2 707 1 1 16 ALA CB C 2.750 2.497 -5.459 1.00 . A X . 16 ALA CB 1 1 2 708 1 1 16 ALA H H 1.416 1.613 -3.496 1.00 . A X . 16 ALA H 1 1 2 709 1 1 16 ALA HA H 3.418 0.506 -5.169 1.00 . A X . 16 ALA HA 1 1 2 710 1 1 16 ALA HB1 H 2.585 3.388 -4.871 1.00 . A X . 16 ALA HB1 1 1 2 711 1 1 16 ALA HB2 H 1.826 2.205 -5.937 1.00 . A X . 16 ALA HB2 1 1 2 712 1 1 16 ALA HB3 H 3.496 2.699 -6.214 1.00 . A X . 16 ALA HB3 1 1 2 713 1 1 16 ALA N N 2.195 1.030 -3.590 1.00 . A X . 16 ALA N 1 1 2 714 1 1 16 ALA O O 5.610 1.673 -4.415 1.00 . A X . 16 ALA O 1 1 2 715 1 1 17 LEU C C 6.048 1.540 -0.953 1.00 . A X . 17 LEU C 1 1 2 716 1 1 17 LEU CA C 5.536 2.674 -1.842 1.00 . A X . 17 LEU CA 1 1 2 717 1 1 17 LEU CB C 5.138 3.892 -1.000 1.00 . A X . 17 LEU CB 1 1 2 718 1 1 17 LEU CD1 C 7.282 5.145 -1.367 1.00 . A X . 17 LEU CD1 1 1 2 719 1 1 17 LEU CD2 C 5.762 5.795 0.505 1.00 . A X . 17 LEU CD2 1 1 2 720 1 1 17 LEU CG C 6.292 4.639 -0.329 1.00 . A X . 17 LEU CG 1 1 2 721 1 1 17 LEU H H 3.501 2.253 -2.211 1.00 . A X . 17 LEU H 1 1 2 722 1 1 17 LEU HA H 6.315 2.959 -2.533 1.00 . A X . 17 LEU HA 1 1 2 723 1 1 17 LEU HB2 H 4.611 4.586 -1.640 1.00 . A X . 17 LEU HB2 1 1 2 724 1 1 17 LEU HB3 H 4.460 3.560 -0.228 1.00 . A X . 17 LEU HB3 1 1 2 725 1 1 17 LEU HD11 H 6.778 5.813 -2.050 1.00 . A X . 17 LEU HD11 1 1 2 726 1 1 17 LEU HD12 H 7.689 4.308 -1.916 1.00 . A X . 17 LEU HD12 1 1 2 727 1 1 17 LEU HD13 H 8.082 5.674 -0.873 1.00 . A X . 17 LEU HD13 1 1 2 728 1 1 17 LEU HD21 H 5.118 5.413 1.284 1.00 . A X . 17 LEU HD21 1 1 2 729 1 1 17 LEU HD22 H 5.200 6.469 -0.126 1.00 . A X . 17 LEU HD22 1 1 2 730 1 1 17 LEU HD23 H 6.589 6.328 0.951 1.00 . A X . 17 LEU HD23 1 1 2 731 1 1 17 LEU HG H 6.815 3.962 0.329 1.00 . A X . 17 LEU HG 1 1 2 732 1 1 17 LEU N N 4.391 2.226 -2.617 1.00 . A X . 17 LEU N 1 1 2 733 1 1 17 LEU O O 7.155 1.599 -0.418 1.00 . A X . 17 LEU O 1 1 2 734 1 1 18 ALA C C 6.657 -1.504 -0.619 1.00 . A X . 18 ALA C 1 1 2 735 1 1 18 ALA CA C 5.575 -0.642 0.021 1.00 . A X . 18 ALA CA 1 1 2 736 1 1 18 ALA CB C 4.332 -1.472 0.300 1.00 . A X . 18 ALA CB 1 1 2 737 1 1 18 ALA H H 4.397 0.486 -1.321 1.00 . A X . 18 ALA H 1 1 2 738 1 1 18 ALA HA H 5.943 -0.259 0.962 1.00 . A X . 18 ALA HA 1 1 2 739 1 1 18 ALA HB1 H 4.581 -2.281 0.971 1.00 . A X . 18 ALA HB1 1 1 2 740 1 1 18 ALA HB2 H 3.954 -1.877 -0.628 1.00 . A X . 18 ALA HB2 1 1 2 741 1 1 18 ALA HB3 H 3.576 -0.848 0.754 1.00 . A X . 18 ALA HB3 1 1 2 742 1 1 18 ALA N N 5.241 0.494 -0.827 1.00 . A X . 18 ALA N 1 1 2 743 1 1 18 ALA O O 7.683 -1.798 -0.002 1.00 . A X . 18 ALA O 1 1 2 744 1 1 19 LEU C C 8.600 -1.958 -3.074 1.00 . A X . 19 LEU C 1 1 2 745 1 1 19 LEU CA C 7.379 -2.738 -2.593 1.00 . A X . 19 LEU CA 1 1 2 746 1 1 19 LEU CB C 6.679 -3.449 -3.764 1.00 . A X . 19 LEU CB 1 1 2 747 1 1 19 LEU CD1 C 6.448 -1.537 -5.409 1.00 . A X . 19 LEU CD1 1 1 2 748 1 1 19 LEU CD2 C 4.892 -3.487 -5.517 1.00 . A X . 19 LEU CD2 1 1 2 749 1 1 19 LEU CG C 5.713 -2.596 -4.598 1.00 . A X . 19 LEU CG 1 1 2 750 1 1 19 LEU H H 5.627 -1.575 -2.330 1.00 . A X . 19 LEU H 1 1 2 751 1 1 19 LEU HA H 7.720 -3.490 -1.894 1.00 . A X . 19 LEU HA 1 1 2 752 1 1 19 LEU HB2 H 7.441 -3.835 -4.426 1.00 . A X . 19 LEU HB2 1 1 2 753 1 1 19 LEU HB3 H 6.123 -4.285 -3.365 1.00 . A X . 19 LEU HB3 1 1 2 754 1 1 19 LEU HD11 H 7.146 -2.017 -6.079 1.00 . A X . 19 LEU HD11 1 1 2 755 1 1 19 LEU HD12 H 6.985 -0.880 -4.740 1.00 . A X . 19 LEU HD12 1 1 2 756 1 1 19 LEU HD13 H 5.736 -0.962 -5.982 1.00 . A X . 19 LEU HD13 1 1 2 757 1 1 19 LEU HD21 H 5.556 -4.049 -6.157 1.00 . A X . 19 LEU HD21 1 1 2 758 1 1 19 LEU HD22 H 4.240 -2.875 -6.121 1.00 . A X . 19 LEU HD22 1 1 2 759 1 1 19 LEU HD23 H 4.300 -4.168 -4.923 1.00 . A X . 19 LEU HD23 1 1 2 760 1 1 19 LEU HG H 5.029 -2.088 -3.933 1.00 . A X . 19 LEU HG 1 1 2 761 1 1 19 LEU N N 6.440 -1.881 -1.874 1.00 . A X . 19 LEU N 1 1 2 762 1 1 19 LEU O O 9.411 -2.467 -3.846 1.00 . A X . 19 LEU O 1 1 2 763 1 1 20 LYS C C 11.029 -0.207 -2.004 1.00 . A X . 20 LYS C 1 1 2 764 1 1 20 LYS CA C 9.877 0.095 -2.959 1.00 . A X . 20 LYS CA 1 1 2 765 1 1 20 LYS CB C 9.505 1.575 -2.905 1.00 . A X . 20 LYS CB 1 1 2 766 1 1 20 LYS CD C 10.016 3.913 -3.632 1.00 . A X . 20 LYS CD 1 1 2 767 1 1 20 LYS CE C 10.930 4.795 -4.464 1.00 . A X . 20 LYS CE 1 1 2 768 1 1 20 LYS CG C 10.523 2.486 -3.568 1.00 . A X . 20 LYS CG 1 1 2 769 1 1 20 LYS H H 8.037 -0.355 -2.025 1.00 . A X . 20 LYS H 1 1 2 770 1 1 20 LYS HA H 10.177 -0.161 -3.963 1.00 . A X . 20 LYS HA 1 1 2 771 1 1 20 LYS HB2 H 8.554 1.714 -3.397 1.00 . A X . 20 LYS HB2 1 1 2 772 1 1 20 LYS HB3 H 9.411 1.871 -1.871 1.00 . A X . 20 LYS HB3 1 1 2 773 1 1 20 LYS HD2 H 9.030 3.914 -4.073 1.00 . A X . 20 LYS HD2 1 1 2 774 1 1 20 LYS HD3 H 9.963 4.311 -2.629 1.00 . A X . 20 LYS HD3 1 1 2 775 1 1 20 LYS HE2 H 11.897 4.840 -3.986 1.00 . A X . 20 LYS HE2 1 1 2 776 1 1 20 LYS HE3 H 11.034 4.360 -5.448 1.00 . A X . 20 LYS HE3 1 1 2 777 1 1 20 LYS HG2 H 11.438 2.466 -2.996 1.00 . A X . 20 LYS HG2 1 1 2 778 1 1 20 LYS HG3 H 10.714 2.135 -4.572 1.00 . A X . 20 LYS HG3 1 1 2 779 1 1 20 LYS HZ1 H 10.465 6.678 -3.688 1.00 . A X . 20 LYS HZ1 1 1 2 780 1 1 20 LYS HZ2 H 9.390 6.137 -4.881 1.00 . A X . 20 LYS HZ2 1 1 2 781 1 1 20 LYS HZ3 H 10.926 6.701 -5.321 1.00 . A X . 20 LYS HZ3 1 1 2 782 1 1 20 LYS N N 8.729 -0.722 -2.613 1.00 . A X . 20 LYS N 1 1 2 783 1 1 20 LYS NZ N 10.391 6.173 -4.596 1.00 . A X . 20 LYS NZ 1 1 2 784 1 1 20 LYS O O 12.190 -0.257 -2.406 1.00 . A X . 20 LYS O 1 1 2 785 1 1 21 LEU C C 11.812 -2.349 0.265 1.00 . A X . 21 LEU C 1 1 2 786 1 1 21 LEU CA C 11.686 -0.833 0.254 1.00 . A X . 21 LEU CA 1 1 2 787 1 1 21 LEU CB C 11.313 -0.328 1.651 1.00 . A X . 21 LEU CB 1 1 2 788 1 1 21 LEU CD1 C 10.994 1.565 3.254 1.00 . A X . 21 LEU CD1 1 1 2 789 1 1 21 LEU CD2 C 12.895 1.613 1.638 1.00 . A X . 21 LEU CD2 1 1 2 790 1 1 21 LEU CG C 11.454 1.179 1.859 1.00 . A X . 21 LEU CG 1 1 2 791 1 1 21 LEU H H 9.765 -0.298 -0.455 1.00 . A X . 21 LEU H 1 1 2 792 1 1 21 LEU HA H 12.636 -0.406 -0.031 1.00 . A X . 21 LEU HA 1 1 2 793 1 1 21 LEU HB2 H 10.288 -0.603 1.845 1.00 . A X . 21 LEU HB2 1 1 2 794 1 1 21 LEU HB3 H 11.944 -0.828 2.371 1.00 . A X . 21 LEU HB3 1 1 2 795 1 1 21 LEU HD11 H 9.960 1.280 3.384 1.00 . A X . 21 LEU HD11 1 1 2 796 1 1 21 LEU HD12 H 11.092 2.632 3.383 1.00 . A X . 21 LEU HD12 1 1 2 797 1 1 21 LEU HD13 H 11.601 1.056 3.988 1.00 . A X . 21 LEU HD13 1 1 2 798 1 1 21 LEU HD21 H 13.540 1.081 2.323 1.00 . A X . 21 LEU HD21 1 1 2 799 1 1 21 LEU HD22 H 12.981 2.675 1.815 1.00 . A X . 21 LEU HD22 1 1 2 800 1 1 21 LEU HD23 H 13.188 1.392 0.622 1.00 . A X . 21 LEU HD23 1 1 2 801 1 1 21 LEU HG H 10.832 1.698 1.142 1.00 . A X . 21 LEU HG 1 1 2 802 1 1 21 LEU N N 10.696 -0.421 -0.734 1.00 . A X . 21 LEU N 1 1 2 803 1 1 21 LEU O O 12.818 -2.904 0.707 1.00 . A X . 21 LEU O 1 1 2 804 1 1 22 LYS C C 11.694 -4.912 -1.445 1.00 . A X . 22 LYS C 1 1 2 805 1 1 22 LYS CA C 10.766 -4.458 -0.326 1.00 . A X . 22 LYS CA 1 1 2 806 1 1 22 LYS CB C 9.341 -4.958 -0.580 1.00 . A X . 22 LYS CB 1 1 2 807 1 1 22 LYS CD C 9.614 -7.152 0.624 1.00 . A X . 22 LYS CD 1 1 2 808 1 1 22 LYS CE C 9.353 -8.647 0.560 1.00 . A X . 22 LYS CE 1 1 2 809 1 1 22 LYS CG C 9.218 -6.470 -0.676 1.00 . A X . 22 LYS CG 1 1 2 810 1 1 22 LYS H H 10.000 -2.507 -0.551 1.00 . A X . 22 LYS H 1 1 2 811 1 1 22 LYS HA H 11.123 -4.860 0.610 1.00 . A X . 22 LYS HA 1 1 2 812 1 1 22 LYS HB2 H 8.706 -4.622 0.228 1.00 . A X . 22 LYS HB2 1 1 2 813 1 1 22 LYS HB3 H 8.985 -4.532 -1.506 1.00 . A X . 22 LYS HB3 1 1 2 814 1 1 22 LYS HD2 H 10.666 -6.986 0.804 1.00 . A X . 22 LYS HD2 1 1 2 815 1 1 22 LYS HD3 H 9.036 -6.729 1.433 1.00 . A X . 22 LYS HD3 1 1 2 816 1 1 22 LYS HE2 H 8.301 -8.808 0.383 1.00 . A X . 22 LYS HE2 1 1 2 817 1 1 22 LYS HE3 H 9.924 -9.061 -0.258 1.00 . A X . 22 LYS HE3 1 1 2 818 1 1 22 LYS HG2 H 8.196 -6.723 -0.904 1.00 . A X . 22 LYS HG2 1 1 2 819 1 1 22 LYS HG3 H 9.864 -6.822 -1.468 1.00 . A X . 22 LYS HG3 1 1 2 820 1 1 22 LYS HZ1 H 9.348 -8.838 2.645 1.00 . A X . 22 LYS HZ1 1 1 2 821 1 1 22 LYS HZ2 H 10.779 -9.376 1.905 1.00 . A X . 22 LYS HZ2 1 1 2 822 1 1 22 LYS HZ3 H 9.373 -10.316 1.814 1.00 . A X . 22 LYS HZ3 1 1 2 823 1 1 22 LYS N N 10.776 -3.010 -0.231 1.00 . A X . 22 LYS N 1 1 2 824 1 1 22 LYS NZ N 9.741 -9.340 1.817 1.00 . A X . 22 LYS NZ 1 1 2 825 1 1 22 LYS O O 11.551 -4.485 -2.591 1.00 . A X . 22 LYS O 1 1 2 826 1 1 23 LYS C C 13.104 -7.626 -2.597 1.00 . A X . 23 LYS C 1 1 2 827 1 1 23 LYS CA C 13.588 -6.278 -2.081 1.00 . A X . 23 LYS CA 1 1 2 828 1 1 23 LYS CB C 14.986 -6.414 -1.472 1.00 . A X . 23 LYS CB 1 1 2 829 1 1 23 LYS CD C 16.984 -5.260 -0.468 1.00 . A X . 23 LYS CD 1 1 2 830 1 1 23 LYS CE C 17.619 -3.915 -0.153 1.00 . A X . 23 LYS CE 1 1 2 831 1 1 23 LYS CG C 15.576 -5.091 -1.011 1.00 . A X . 23 LYS CG 1 1 2 832 1 1 23 LYS H H 12.745 -6.019 -0.167 1.00 . A X . 23 LYS H 1 1 2 833 1 1 23 LYS HA H 13.629 -5.585 -2.903 1.00 . A X . 23 LYS HA 1 1 2 834 1 1 23 LYS HB2 H 14.932 -7.078 -0.622 1.00 . A X . 23 LYS HB2 1 1 2 835 1 1 23 LYS HB3 H 15.646 -6.841 -2.210 1.00 . A X . 23 LYS HB3 1 1 2 836 1 1 23 LYS HD2 H 16.942 -5.850 0.436 1.00 . A X . 23 LYS HD2 1 1 2 837 1 1 23 LYS HD3 H 17.586 -5.770 -1.204 1.00 . A X . 23 LYS HD3 1 1 2 838 1 1 23 LYS HE2 H 17.602 -3.306 -1.046 1.00 . A X . 23 LYS HE2 1 1 2 839 1 1 23 LYS HE3 H 17.041 -3.430 0.621 1.00 . A X . 23 LYS HE3 1 1 2 840 1 1 23 LYS HG2 H 15.603 -4.411 -1.846 1.00 . A X . 23 LYS HG2 1 1 2 841 1 1 23 LYS HG3 H 14.949 -4.683 -0.233 1.00 . A X . 23 LYS HG3 1 1 2 842 1 1 23 LYS HZ1 H 19.055 -4.411 1.286 1.00 . A X . 23 LYS HZ1 1 1 2 843 1 1 23 LYS HZ2 H 19.506 -3.126 0.274 1.00 . A X . 23 LYS HZ2 1 1 2 844 1 1 23 LYS HZ3 H 19.546 -4.716 -0.308 1.00 . A X . 23 LYS HZ3 1 1 2 845 1 1 23 LYS N N 12.656 -5.748 -1.104 1.00 . A X . 23 LYS N 1 1 2 846 1 1 23 LYS NZ N 19.026 -4.051 0.309 1.00 . A X . 23 LYS NZ 1 1 2 847 1 1 23 LYS O O 12.958 -8.578 -1.830 1.00 . A X . 23 LYS O 1 1 2 848 1 1 24 ALA C C 13.568 -9.797 -4.897 1.00 . A X . 24 ALA C 1 1 2 849 1 1 24 ALA CA C 12.379 -8.927 -4.515 1.00 . A X . 24 ALA CA 1 1 2 850 1 1 24 ALA CB C 11.519 -8.626 -5.733 1.00 . A X . 24 ALA CB 1 1 2 851 1 1 24 ALA H H 12.947 -6.892 -4.448 1.00 . A X . 24 ALA H 1 1 2 852 1 1 24 ALA HA H 11.771 -9.461 -3.795 1.00 . A X . 24 ALA HA 1 1 2 853 1 1 24 ALA HB1 H 11.141 -9.551 -6.142 1.00 . A X . 24 ALA HB1 1 1 2 854 1 1 24 ALA HB2 H 12.116 -8.120 -6.478 1.00 . A X . 24 ALA HB2 1 1 2 855 1 1 24 ALA HB3 H 10.694 -7.994 -5.444 1.00 . A X . 24 ALA HB3 1 1 2 856 1 1 24 ALA N N 12.833 -7.693 -3.893 1.00 . A X . 24 ALA N 1 1 2 857 1 1 24 ALA O O 14.177 -9.546 -5.960 1.00 . A X . 24 ALA O 1 1 2 858 1 1 24 ALA OXT O 13.900 -10.717 -4.127 1.00 . A X . 24 ALA OXT 1 1 3 859 1 1 1 LYS C C -10.759 -5.874 1.447 1.00 . A X . 1 LYS C 1 1 3 860 1 1 1 LYS CA C -12.271 -5.669 1.537 1.00 . A X . 1 LYS CA 1 1 3 861 1 1 1 LYS CB C -12.704 -5.609 3.008 1.00 . A X . 1 LYS CB 1 1 3 862 1 1 1 LYS CD C -12.889 -4.291 5.135 1.00 . A X . 1 LYS CD 1 1 3 863 1 1 1 LYS CE C -13.194 -2.910 5.690 1.00 . A X . 1 LYS CE 1 1 3 864 1 1 1 LYS CG C -12.565 -4.239 3.648 1.00 . A X . 1 LYS CG 1 1 3 865 1 1 1 LYS H1 H -12.696 -7.697 1.324 1.00 . A X . 1 LYS H1 1 1 3 866 1 1 1 LYS H2 H -12.697 -6.840 -0.138 1.00 . A X . 1 LYS H2 1 1 3 867 1 1 1 LYS H3 H -13.996 -6.676 0.940 1.00 . A X . 1 LYS H3 1 1 3 868 1 1 1 LYS HA H -12.540 -4.748 1.040 1.00 . A X . 1 LYS HA 1 1 3 869 1 1 1 LYS HB2 H -13.739 -5.908 3.076 1.00 . A X . 1 LYS HB2 1 1 3 870 1 1 1 LYS HB3 H -12.104 -6.306 3.574 1.00 . A X . 1 LYS HB3 1 1 3 871 1 1 1 LYS HD2 H -13.751 -4.923 5.284 1.00 . A X . 1 LYS HD2 1 1 3 872 1 1 1 LYS HD3 H -12.042 -4.704 5.664 1.00 . A X . 1 LYS HD3 1 1 3 873 1 1 1 LYS HE2 H -13.211 -2.962 6.769 1.00 . A X . 1 LYS HE2 1 1 3 874 1 1 1 LYS HE3 H -12.418 -2.229 5.375 1.00 . A X . 1 LYS HE3 1 1 3 875 1 1 1 LYS HG2 H -11.551 -3.894 3.521 1.00 . A X . 1 LYS HG2 1 1 3 876 1 1 1 LYS HG3 H -13.246 -3.554 3.163 1.00 . A X . 1 LYS HG3 1 1 3 877 1 1 1 LYS HZ1 H -14.541 -2.412 4.165 1.00 . A X . 1 LYS HZ1 1 1 3 878 1 1 1 LYS HZ2 H -14.660 -1.425 5.540 1.00 . A X . 1 LYS HZ2 1 1 3 879 1 1 1 LYS HZ3 H -15.279 -3.001 5.574 1.00 . A X . 1 LYS HZ3 1 1 3 880 1 1 1 LYS N N -12.962 -6.795 0.869 1.00 . A X . 1 LYS N 1 1 3 881 1 1 1 LYS NZ N -14.507 -2.402 5.209 1.00 . A X . 1 LYS NZ 1 1 3 882 1 1 1 LYS O O -10.071 -5.953 2.464 1.00 . A X . 1 LYS O 1 1 3 883 1 1 2 LYS C C -7.999 -5.288 -0.625 1.00 . A X . 2 LYS C 1 1 3 884 1 1 2 LYS CA C -8.853 -6.370 0.031 1.00 . A X . 2 LYS CA 1 1 3 885 1 1 2 LYS CB C -8.802 -7.644 -0.814 1.00 . A X . 2 LYS CB 1 1 3 886 1 1 2 LYS CD C -9.358 -10.090 -1.006 1.00 . A X . 2 LYS CD 1 1 3 887 1 1 2 LYS CE C -10.006 -9.966 -2.376 1.00 . A X . 2 LYS CE 1 1 3 888 1 1 2 LYS CG C -9.523 -8.825 -0.182 1.00 . A X . 2 LYS CG 1 1 3 889 1 1 2 LYS H H -10.795 -5.735 -0.554 1.00 . A X . 2 LYS H 1 1 3 890 1 1 2 LYS HA H -8.437 -6.589 1.002 1.00 . A X . 2 LYS HA 1 1 3 891 1 1 2 LYS HB2 H -9.257 -7.443 -1.772 1.00 . A X . 2 LYS HB2 1 1 3 892 1 1 2 LYS HB3 H -7.769 -7.920 -0.965 1.00 . A X . 2 LYS HB3 1 1 3 893 1 1 2 LYS HD2 H -8.305 -10.285 -1.136 1.00 . A X . 2 LYS HD2 1 1 3 894 1 1 2 LYS HD3 H -9.814 -10.914 -0.475 1.00 . A X . 2 LYS HD3 1 1 3 895 1 1 2 LYS HE2 H -11.063 -9.787 -2.247 1.00 . A X . 2 LYS HE2 1 1 3 896 1 1 2 LYS HE3 H -9.561 -9.132 -2.900 1.00 . A X . 2 LYS HE3 1 1 3 897 1 1 2 LYS HG2 H -9.117 -8.998 0.804 1.00 . A X . 2 LYS HG2 1 1 3 898 1 1 2 LYS HG3 H -10.575 -8.593 -0.104 1.00 . A X . 2 LYS HG3 1 1 3 899 1 1 2 LYS HZ1 H -10.248 -11.080 -4.125 1.00 . A X . 2 LYS HZ1 1 1 3 900 1 1 2 LYS HZ2 H -10.264 -12.013 -2.705 1.00 . A X . 2 LYS HZ2 1 1 3 901 1 1 2 LYS HZ3 H -8.802 -11.397 -3.299 1.00 . A X . 2 LYS HZ3 1 1 3 902 1 1 2 LYS N N -10.238 -5.958 0.229 1.00 . A X . 2 LYS N 1 1 3 903 1 1 2 LYS NZ N -9.819 -11.198 -3.181 1.00 . A X . 2 LYS NZ 1 1 3 904 1 1 2 LYS O O -8.182 -4.962 -1.799 1.00 . A X . 2 LYS O 1 1 3 905 1 1 3 LEU C C -6.401 -2.548 -0.913 1.00 . A X . 3 LEU C 1 1 3 906 1 1 3 LEU CA C -5.975 -3.894 -0.316 1.00 . A X . 3 LEU CA 1 1 3 907 1 1 3 LEU CB C -5.145 -4.676 -1.339 1.00 . A X . 3 LEU CB 1 1 3 908 1 1 3 LEU CD1 C -3.817 -6.712 -1.952 1.00 . A X . 3 LEU CD1 1 1 3 909 1 1 3 LEU CD2 C -3.679 -5.797 0.368 1.00 . A X . 3 LEU CD2 1 1 3 910 1 1 3 LEU CG C -4.579 -6.009 -0.840 1.00 . A X . 3 LEU CG 1 1 3 911 1 1 3 LEU H H -7.165 -4.867 1.137 1.00 . A X . 3 LEU H 1 1 3 912 1 1 3 LEU HA H -5.344 -3.691 0.535 1.00 . A X . 3 LEU HA 1 1 3 913 1 1 3 LEU HB2 H -5.768 -4.874 -2.200 1.00 . A X . 3 LEU HB2 1 1 3 914 1 1 3 LEU HB3 H -4.319 -4.054 -1.651 1.00 . A X . 3 LEU HB3 1 1 3 915 1 1 3 LEU HD11 H -4.471 -6.856 -2.798 1.00 . A X . 3 LEU HD11 1 1 3 916 1 1 3 LEU HD12 H -3.469 -7.671 -1.599 1.00 . A X . 3 LEU HD12 1 1 3 917 1 1 3 LEU HD13 H -2.972 -6.108 -2.248 1.00 . A X . 3 LEU HD13 1 1 3 918 1 1 3 LEU HD21 H -3.311 -6.752 0.713 1.00 . A X . 3 LEU HD21 1 1 3 919 1 1 3 LEU HD22 H -4.239 -5.319 1.158 1.00 . A X . 3 LEU HD22 1 1 3 920 1 1 3 LEU HD23 H -2.845 -5.171 0.088 1.00 . A X . 3 LEU HD23 1 1 3 921 1 1 3 LEU HG H -5.397 -6.647 -0.540 1.00 . A X . 3 LEU HG 1 1 3 922 1 1 3 LEU N N -7.090 -4.720 0.172 1.00 . A X . 3 LEU N 1 1 3 923 1 1 3 LEU O O -5.553 -1.689 -1.156 1.00 . A X . 3 LEU O 1 1 3 924 1 1 4 LYS C C -7.978 0.069 -0.753 1.00 . A X . 4 LYS C 1 1 3 925 1 1 4 LYS CA C -8.168 -1.089 -1.722 1.00 . A X . 4 LYS CA 1 1 3 926 1 1 4 LYS CB C -9.643 -1.170 -2.110 1.00 . A X . 4 LYS CB 1 1 3 927 1 1 4 LYS CD C -11.365 -1.905 -3.754 1.00 . A X . 4 LYS CD 1 1 3 928 1 1 4 LYS CE C -11.699 -2.806 -4.928 1.00 . A X . 4 LYS CE 1 1 3 929 1 1 4 LYS CG C -9.927 -2.070 -3.295 1.00 . A X . 4 LYS CG 1 1 3 930 1 1 4 LYS H H -8.333 -3.067 -0.958 1.00 . A X . 4 LYS H 1 1 3 931 1 1 4 LYS HA H -7.585 -0.895 -2.610 1.00 . A X . 4 LYS HA 1 1 3 932 1 1 4 LYS HB2 H -10.206 -1.538 -1.264 1.00 . A X . 4 LYS HB2 1 1 3 933 1 1 4 LYS HB3 H -9.989 -0.176 -2.351 1.00 . A X . 4 LYS HB3 1 1 3 934 1 1 4 LYS HD2 H -12.021 -2.150 -2.933 1.00 . A X . 4 LYS HD2 1 1 3 935 1 1 4 LYS HD3 H -11.524 -0.876 -4.045 1.00 . A X . 4 LYS HD3 1 1 3 936 1 1 4 LYS HE2 H -11.018 -2.591 -5.740 1.00 . A X . 4 LYS HE2 1 1 3 937 1 1 4 LYS HE3 H -11.580 -3.835 -4.621 1.00 . A X . 4 LYS HE3 1 1 3 938 1 1 4 LYS HG2 H -9.261 -1.810 -4.106 1.00 . A X . 4 LYS HG2 1 1 3 939 1 1 4 LYS HG3 H -9.765 -3.097 -3.003 1.00 . A X . 4 LYS HG3 1 1 3 940 1 1 4 LYS HZ1 H -13.358 -3.341 -6.076 1.00 . A X . 4 LYS HZ1 1 1 3 941 1 1 4 LYS HZ2 H -13.184 -1.668 -5.865 1.00 . A X . 4 LYS HZ2 1 1 3 942 1 1 4 LYS HZ3 H -13.754 -2.629 -4.588 1.00 . A X . 4 LYS HZ3 1 1 3 943 1 1 4 LYS N N -7.693 -2.349 -1.148 1.00 . A X . 4 LYS N 1 1 3 944 1 1 4 LYS NZ N -13.094 -2.598 -5.396 1.00 . A X . 4 LYS NZ 1 1 3 945 1 1 4 LYS O O -7.804 1.217 -1.164 1.00 . A X . 4 LYS O 1 1 3 946 1 1 5 LEU C C -6.462 1.274 1.715 1.00 . A X . 5 LEU C 1 1 3 947 1 1 5 LEU CA C -7.902 0.781 1.569 1.00 . A X . 5 LEU CA 1 1 3 948 1 1 5 LEU CB C -8.429 0.220 2.896 1.00 . A X . 5 LEU CB 1 1 3 949 1 1 5 LEU CD1 C -9.647 2.313 3.566 1.00 . A X . 5 LEU CD1 1 1 3 950 1 1 5 LEU CD2 C -9.146 0.555 5.276 1.00 . A X . 5 LEU CD2 1 1 3 951 1 1 5 LEU CG C -8.655 1.246 4.011 1.00 . A X . 5 LEU CG 1 1 3 952 1 1 5 LEU H H -8.074 -1.178 0.798 1.00 . A X . 5 LEU H 1 1 3 953 1 1 5 LEU HA H -8.520 1.609 1.267 1.00 . A X . 5 LEU HA 1 1 3 954 1 1 5 LEU HB2 H -9.368 -0.277 2.701 1.00 . A X . 5 LEU HB2 1 1 3 955 1 1 5 LEU HB3 H -7.723 -0.513 3.253 1.00 . A X . 5 LEU HB3 1 1 3 956 1 1 5 LEU HD11 H -9.806 3.013 4.372 1.00 . A X . 5 LEU HD11 1 1 3 957 1 1 5 LEU HD12 H -10.585 1.845 3.305 1.00 . A X . 5 LEU HD12 1 1 3 958 1 1 5 LEU HD13 H -9.252 2.836 2.707 1.00 . A X . 5 LEU HD13 1 1 3 959 1 1 5 LEU HD21 H -9.336 1.294 6.042 1.00 . A X . 5 LEU HD21 1 1 3 960 1 1 5 LEU HD22 H -8.392 -0.136 5.625 1.00 . A X . 5 LEU HD22 1 1 3 961 1 1 5 LEU HD23 H -10.055 0.015 5.063 1.00 . A X . 5 LEU HD23 1 1 3 962 1 1 5 LEU HG H -7.719 1.735 4.239 1.00 . A X . 5 LEU HG 1 1 3 963 1 1 5 LEU N N -7.995 -0.240 0.535 1.00 . A X . 5 LEU N 1 1 3 964 1 1 5 LEU O O -6.179 2.192 2.479 1.00 . A X . 5 LEU O 1 1 3 965 1 1 6 ALA C C -3.940 2.426 0.339 1.00 . A X . 6 ALA C 1 1 3 966 1 1 6 ALA CA C -4.153 1.061 0.986 1.00 . A X . 6 ALA CA 1 1 3 967 1 1 6 ALA CB C -3.297 0.011 0.297 1.00 . A X . 6 ALA CB 1 1 3 968 1 1 6 ALA H H -5.852 -0.018 0.326 1.00 . A X . 6 ALA H 1 1 3 969 1 1 6 ALA HA H -3.853 1.114 2.022 1.00 . A X . 6 ALA HA 1 1 3 970 1 1 6 ALA HB1 H -2.254 0.277 0.392 1.00 . A X . 6 ALA HB1 1 1 3 971 1 1 6 ALA HB2 H -3.561 -0.039 -0.749 1.00 . A X . 6 ALA HB2 1 1 3 972 1 1 6 ALA HB3 H -3.467 -0.951 0.757 1.00 . A X . 6 ALA HB3 1 1 3 973 1 1 6 ALA N N -5.561 0.683 0.945 1.00 . A X . 6 ALA N 1 1 3 974 1 1 6 ALA O O -2.902 3.058 0.518 1.00 . A X . 6 ALA O 1 1 3 975 1 1 7 LEU C C -5.745 5.200 -0.393 1.00 . A X . 7 LEU C 1 1 3 976 1 1 7 LEU CA C -4.845 4.175 -1.074 1.00 . A X . 7 LEU CA 1 1 3 977 1 1 7 LEU CB C -5.229 4.058 -2.559 1.00 . A X . 7 LEU CB 1 1 3 978 1 1 7 LEU CD1 C -4.194 1.840 -3.191 1.00 . A X . 7 LEU CD1 1 1 3 979 1 1 7 LEU CD2 C -4.553 3.595 -4.930 1.00 . A X . 7 LEU CD2 1 1 3 980 1 1 7 LEU CG C -4.222 3.337 -3.468 1.00 . A X . 7 LEU CG 1 1 3 981 1 1 7 LEU H H -5.744 2.338 -0.520 1.00 . A X . 7 LEU H 1 1 3 982 1 1 7 LEU HA H -3.822 4.513 -1.004 1.00 . A X . 7 LEU HA 1 1 3 983 1 1 7 LEU HB2 H -6.169 3.529 -2.619 1.00 . A X . 7 LEU HB2 1 1 3 984 1 1 7 LEU HB3 H -5.376 5.055 -2.946 1.00 . A X . 7 LEU HB3 1 1 3 985 1 1 7 LEU HD11 H -5.165 1.416 -3.405 1.00 . A X . 7 LEU HD11 1 1 3 986 1 1 7 LEU HD12 H -3.948 1.669 -2.153 1.00 . A X . 7 LEU HD12 1 1 3 987 1 1 7 LEU HD13 H -3.451 1.372 -3.820 1.00 . A X . 7 LEU HD13 1 1 3 988 1 1 7 LEU HD21 H -5.544 3.225 -5.145 1.00 . A X . 7 LEU HD21 1 1 3 989 1 1 7 LEU HD22 H -3.836 3.085 -5.559 1.00 . A X . 7 LEU HD22 1 1 3 990 1 1 7 LEU HD23 H -4.514 4.656 -5.127 1.00 . A X . 7 LEU HD23 1 1 3 991 1 1 7 LEU HG H -3.234 3.731 -3.278 1.00 . A X . 7 LEU HG 1 1 3 992 1 1 7 LEU N N -4.932 2.883 -0.409 1.00 . A X . 7 LEU N 1 1 3 993 1 1 7 LEU O O -5.998 6.272 -0.942 1.00 . A X . 7 LEU O 1 1 3 994 1 1 8 ALA C C -7.080 5.617 3.012 1.00 . A X . 8 ALA C 1 1 3 995 1 1 8 ALA CA C -7.173 5.736 1.493 1.00 . A X . 8 ALA CA 1 1 3 996 1 1 8 ALA CB C -8.582 5.396 1.031 1.00 . A X . 8 ALA CB 1 1 3 997 1 1 8 ALA H H -5.882 4.072 1.254 1.00 . A X . 8 ALA H 1 1 3 998 1 1 8 ALA HA H -6.968 6.760 1.210 1.00 . A X . 8 ALA HA 1 1 3 999 1 1 8 ALA HB1 H -8.837 4.399 1.356 1.00 . A X . 8 ALA HB1 1 1 3 1000 1 1 8 ALA HB2 H -8.629 5.446 -0.047 1.00 . A X . 8 ALA HB2 1 1 3 1001 1 1 8 ALA HB3 H -9.279 6.104 1.455 1.00 . A X . 8 ALA HB3 1 1 3 1002 1 1 8 ALA N N -6.205 4.883 0.812 1.00 . A X . 8 ALA N 1 1 3 1003 1 1 8 ALA O O -7.910 6.171 3.730 1.00 . A X . 8 ALA O 1 1 3 1004 1 1 9 LYS C C -4.490 5.199 5.350 1.00 . A X . 9 LYS C 1 1 3 1005 1 1 9 LYS CA C -5.898 4.761 4.944 1.00 . A X . 9 LYS CA 1 1 3 1006 1 1 9 LYS CB C -6.181 3.333 5.425 1.00 . A X . 9 LYS CB 1 1 3 1007 1 1 9 LYS CD C -6.465 1.775 7.386 1.00 . A X . 9 LYS CD 1 1 3 1008 1 1 9 LYS CE C -5.315 0.849 7.015 1.00 . A X . 9 LYS CE 1 1 3 1009 1 1 9 LYS CG C -6.206 3.205 6.939 1.00 . A X . 9 LYS CG 1 1 3 1010 1 1 9 LYS H H -5.479 4.428 2.898 1.00 . A X . 9 LYS H 1 1 3 1011 1 1 9 LYS HA H -6.605 5.427 5.419 1.00 . A X . 9 LYS HA 1 1 3 1012 1 1 9 LYS HB2 H -7.140 3.019 5.042 1.00 . A X . 9 LYS HB2 1 1 3 1013 1 1 9 LYS HB3 H -5.415 2.675 5.043 1.00 . A X . 9 LYS HB3 1 1 3 1014 1 1 9 LYS HD2 H -6.591 1.762 8.458 1.00 . A X . 9 LYS HD2 1 1 3 1015 1 1 9 LYS HD3 H -7.369 1.420 6.913 1.00 . A X . 9 LYS HD3 1 1 3 1016 1 1 9 LYS HE2 H -5.238 0.800 5.940 1.00 . A X . 9 LYS HE2 1 1 3 1017 1 1 9 LYS HE3 H -4.400 1.254 7.421 1.00 . A X . 9 LYS HE3 1 1 3 1018 1 1 9 LYS HG2 H -5.251 3.526 7.331 1.00 . A X . 9 LYS HG2 1 1 3 1019 1 1 9 LYS HG3 H -6.987 3.839 7.329 1.00 . A X . 9 LYS HG3 1 1 3 1020 1 1 9 LYS HZ1 H -5.710 -0.487 8.571 1.00 . A X . 9 LYS HZ1 1 1 3 1021 1 1 9 LYS HZ2 H -4.648 -1.091 7.396 1.00 . A X . 9 LYS HZ2 1 1 3 1022 1 1 9 LYS HZ3 H -6.310 -0.993 7.064 1.00 . A X . 9 LYS HZ3 1 1 3 1023 1 1 9 LYS N N -6.088 4.888 3.505 1.00 . A X . 9 LYS N 1 1 3 1024 1 1 9 LYS NZ N -5.511 -0.524 7.548 1.00 . A X . 9 LYS NZ 1 1 3 1025 1 1 9 LYS O O -4.344 6.065 6.212 1.00 . A X . 9 LYS O 1 1 3 1026 1 1 10 PRO C C -1.800 6.444 4.472 1.00 . A X . 10 PRO C 1 1 3 1027 1 1 10 PRO CA C -2.055 5.057 5.041 1.00 . A X . 10 PRO CA 1 1 3 1028 1 1 10 PRO CB C -1.171 4.013 4.344 1.00 . A X . 10 PRO CB 1 1 3 1029 1 1 10 PRO CD C -3.428 3.530 3.771 1.00 . A X . 10 PRO CD 1 1 3 1030 1 1 10 PRO CG C -2.090 2.894 3.994 1.00 . A X . 10 PRO CG 1 1 3 1031 1 1 10 PRO HA H -1.856 5.060 6.104 1.00 . A X . 10 PRO HA 1 1 3 1032 1 1 10 PRO HB2 H -0.727 4.449 3.463 1.00 . A X . 10 PRO HB2 1 1 3 1033 1 1 10 PRO HB3 H -0.395 3.686 5.020 1.00 . A X . 10 PRO HB3 1 1 3 1034 1 1 10 PRO HD2 H -3.502 3.914 2.762 1.00 . A X . 10 PRO HD2 1 1 3 1035 1 1 10 PRO HD3 H -4.225 2.829 3.976 1.00 . A X . 10 PRO HD3 1 1 3 1036 1 1 10 PRO HG2 H -1.748 2.405 3.093 1.00 . A X . 10 PRO HG2 1 1 3 1037 1 1 10 PRO HG3 H -2.139 2.189 4.810 1.00 . A X . 10 PRO HG3 1 1 3 1038 1 1 10 PRO N N -3.421 4.625 4.751 1.00 . A X . 10 PRO N 1 1 3 1039 1 1 10 PRO O O -1.295 7.326 5.167 1.00 . A X . 10 PRO O 1 1 3 1040 1 1 11 ALA C C -2.632 7.833 1.124 1.00 . A X . 11 ALA C 1 1 3 1041 1 1 11 ALA CA C -2.052 7.910 2.531 1.00 . A X . 11 ALA CA 1 1 3 1042 1 1 11 ALA CB C -0.596 8.362 2.473 1.00 . A X . 11 ALA CB 1 1 3 1043 1 1 11 ALA H H -2.587 5.876 2.722 1.00 . A X . 11 ALA H 1 1 3 1044 1 1 11 ALA HA H -2.608 8.643 3.097 1.00 . A X . 11 ALA HA 1 1 3 1045 1 1 11 ALA HB1 H -0.198 8.427 3.475 1.00 . A X . 11 ALA HB1 1 1 3 1046 1 1 11 ALA HB2 H -0.539 9.330 1.998 1.00 . A X . 11 ALA HB2 1 1 3 1047 1 1 11 ALA HB3 H -0.020 7.648 1.903 1.00 . A X . 11 ALA HB3 1 1 3 1048 1 1 11 ALA N N -2.184 6.627 3.208 1.00 . A X . 11 ALA N 1 1 3 1049 1 1 11 ALA O O -3.783 8.198 0.894 1.00 . A X . 11 ALA O 1 1 3 1050 1 1 12 LEU C C -1.160 6.487 -1.994 1.00 . A X . 12 LEU C 1 1 3 1051 1 1 12 LEU CA C -2.222 7.240 -1.207 1.00 . A X . 12 LEU CA 1 1 3 1052 1 1 12 LEU CB C -2.395 8.650 -1.784 1.00 . A X . 12 LEU CB 1 1 3 1053 1 1 12 LEU CD1 C -4.255 8.071 -3.364 1.00 . A X . 12 LEU CD1 1 1 3 1054 1 1 12 LEU CD2 C -2.915 10.144 -3.721 1.00 . A X . 12 LEU CD2 1 1 3 1055 1 1 12 LEU CG C -2.881 8.708 -3.233 1.00 . A X . 12 LEU CG 1 1 3 1056 1 1 12 LEU H H -0.970 6.942 0.469 1.00 . A X . 12 LEU H 1 1 3 1057 1 1 12 LEU HA H -3.158 6.708 -1.278 1.00 . A X . 12 LEU HA 1 1 3 1058 1 1 12 LEU HB2 H -3.106 9.180 -1.166 1.00 . A X . 12 LEU HB2 1 1 3 1059 1 1 12 LEU HB3 H -1.445 9.160 -1.726 1.00 . A X . 12 LEU HB3 1 1 3 1060 1 1 12 LEU HD11 H -4.963 8.610 -2.751 1.00 . A X . 12 LEU HD11 1 1 3 1061 1 1 12 LEU HD12 H -4.208 7.042 -3.039 1.00 . A X . 12 LEU HD12 1 1 3 1062 1 1 12 LEU HD13 H -4.571 8.109 -4.396 1.00 . A X . 12 LEU HD13 1 1 3 1063 1 1 12 LEU HD21 H -3.598 10.716 -3.110 1.00 . A X . 12 LEU HD21 1 1 3 1064 1 1 12 LEU HD22 H -3.244 10.167 -4.749 1.00 . A X . 12 LEU HD22 1 1 3 1065 1 1 12 LEU HD23 H -1.926 10.571 -3.651 1.00 . A X . 12 LEU HD23 1 1 3 1066 1 1 12 LEU HG H -2.195 8.157 -3.859 1.00 . A X . 12 LEU HG 1 1 3 1067 1 1 12 LEU N N -1.840 7.306 0.198 1.00 . A X . 12 LEU N 1 1 3 1068 1 1 12 LEU O O 0.033 6.729 -1.805 1.00 . A X . 12 LEU O 1 1 3 1069 1 1 13 LEU C C 0.363 4.071 -2.807 1.00 . A X . 13 LEU C 1 1 3 1070 1 1 13 LEU CA C -0.686 4.764 -3.674 1.00 . A X . 13 LEU CA 1 1 3 1071 1 1 13 LEU CB C -0.003 5.640 -4.730 1.00 . A X . 13 LEU CB 1 1 3 1072 1 1 13 LEU CD1 C -0.183 7.226 -6.657 1.00 . A X . 13 LEU CD1 1 1 3 1073 1 1 13 LEU CD2 C -1.635 5.200 -6.578 1.00 . A X . 13 LEU CD2 1 1 3 1074 1 1 13 LEU CG C -0.944 6.274 -5.753 1.00 . A X . 13 LEU CG 1 1 3 1075 1 1 13 LEU H H -2.564 5.431 -2.954 1.00 . A X . 13 LEU H 1 1 3 1076 1 1 13 LEU HA H -1.272 4.008 -4.175 1.00 . A X . 13 LEU HA 1 1 3 1077 1 1 13 LEU HB2 H 0.527 6.433 -4.221 1.00 . A X . 13 LEU HB2 1 1 3 1078 1 1 13 LEU HB3 H 0.715 5.033 -5.261 1.00 . A X . 13 LEU HB3 1 1 3 1079 1 1 13 LEU HD11 H -0.863 7.665 -7.372 1.00 . A X . 13 LEU HD11 1 1 3 1080 1 1 13 LEU HD12 H 0.591 6.685 -7.180 1.00 . A X . 13 LEU HD12 1 1 3 1081 1 1 13 LEU HD13 H 0.265 8.007 -6.061 1.00 . A X . 13 LEU HD13 1 1 3 1082 1 1 13 LEU HD21 H -0.891 4.588 -7.066 1.00 . A X . 13 LEU HD21 1 1 3 1083 1 1 13 LEU HD22 H -2.261 5.668 -7.323 1.00 . A X . 13 LEU HD22 1 1 3 1084 1 1 13 LEU HD23 H -2.243 4.584 -5.932 1.00 . A X . 13 LEU HD23 1 1 3 1085 1 1 13 LEU HG H -1.705 6.840 -5.234 1.00 . A X . 13 LEU HG 1 1 3 1086 1 1 13 LEU N N -1.598 5.567 -2.856 1.00 . A X . 13 LEU N 1 1 3 1087 1 1 13 LEU O O 1.511 3.901 -3.213 1.00 . A X . 13 LEU O 1 1 3 1088 1 1 14 TRP C C 1.192 1.641 -1.070 1.00 . A X . 14 TRP C 1 1 3 1089 1 1 14 TRP CA C 0.865 3.062 -0.655 1.00 . A X . 14 TRP CA 1 1 3 1090 1 1 14 TRP CB C 0.247 3.088 0.745 1.00 . A X . 14 TRP CB 1 1 3 1091 1 1 14 TRP CD1 C 2.014 3.881 2.412 1.00 . A X . 14 TRP CD1 1 1 3 1092 1 1 14 TRP CD2 C 1.565 1.694 2.533 1.00 . A X . 14 TRP CD2 1 1 3 1093 1 1 14 TRP CE2 C 2.545 2.006 3.493 1.00 . A X . 14 TRP CE2 1 1 3 1094 1 1 14 TRP CE3 C 1.124 0.371 2.426 1.00 . A X . 14 TRP CE3 1 1 3 1095 1 1 14 TRP CG C 1.240 2.910 1.851 1.00 . A X . 14 TRP CG 1 1 3 1096 1 1 14 TRP CH2 C 2.640 -0.241 4.216 1.00 . A X . 14 TRP CH2 1 1 3 1097 1 1 14 TRP CZ2 C 3.091 1.045 4.341 1.00 . A X . 14 TRP CZ2 1 1 3 1098 1 1 14 TRP CZ3 C 1.665 -0.581 3.269 1.00 . A X . 14 TRP CZ3 1 1 3 1099 1 1 14 TRP H H -1.003 3.694 -1.400 1.00 . A X . 14 TRP H 1 1 3 1100 1 1 14 TRP HA H 1.771 3.650 -0.659 1.00 . A X . 14 TRP HA 1 1 3 1101 1 1 14 TRP HB2 H -0.244 4.038 0.891 1.00 . A X . 14 TRP HB2 1 1 3 1102 1 1 14 TRP HB3 H -0.483 2.296 0.821 1.00 . A X . 14 TRP HB3 1 1 3 1103 1 1 14 TRP HD1 H 2.000 4.917 2.110 1.00 . A X . 14 TRP HD1 1 1 3 1104 1 1 14 TRP HE1 H 3.445 3.850 3.952 1.00 . A X . 14 TRP HE1 1 1 3 1105 1 1 14 TRP HE3 H 0.372 0.089 1.704 1.00 . A X . 14 TRP HE3 1 1 3 1106 1 1 14 TRP HH2 H 3.035 -1.018 4.855 1.00 . A X . 14 TRP HH2 1 1 3 1107 1 1 14 TRP HZ2 H 3.841 1.292 5.078 1.00 . A X . 14 TRP HZ2 1 1 3 1108 1 1 14 TRP HZ3 H 1.334 -1.608 3.201 1.00 . A X . 14 TRP HZ3 1 1 3 1109 1 1 14 TRP N N -0.054 3.641 -1.621 1.00 . A X . 14 TRP N 1 1 3 1110 1 1 14 TRP NE1 N 2.801 3.347 3.398 1.00 . A X . 14 TRP NE1 1 1 3 1111 1 1 14 TRP O O 2.210 1.080 -0.674 1.00 . A X . 14 TRP O 1 1 3 1112 1 1 15 LYS C C 1.818 -0.296 -3.255 1.00 . A X . 15 LYS C 1 1 3 1113 1 1 15 LYS CA C 0.532 -0.257 -2.431 1.00 . A X . 15 LYS CA 1 1 3 1114 1 1 15 LYS CB C -0.671 -0.677 -3.285 1.00 . A X . 15 LYS CB 1 1 3 1115 1 1 15 LYS CD C -1.778 -2.437 -4.704 1.00 . A X . 15 LYS CD 1 1 3 1116 1 1 15 LYS CE C -3.060 -2.464 -3.884 1.00 . A X . 15 LYS CE 1 1 3 1117 1 1 15 LYS CG C -0.563 -2.080 -3.859 1.00 . A X . 15 LYS CG 1 1 3 1118 1 1 15 LYS H H -0.475 1.573 -2.160 1.00 . A X . 15 LYS H 1 1 3 1119 1 1 15 LYS HA H 0.625 -0.928 -1.596 1.00 . A X . 15 LYS HA 1 1 3 1120 1 1 15 LYS HB2 H -1.561 -0.632 -2.677 1.00 . A X . 15 LYS HB2 1 1 3 1121 1 1 15 LYS HB3 H -0.774 0.016 -4.108 1.00 . A X . 15 LYS HB3 1 1 3 1122 1 1 15 LYS HD2 H -1.884 -1.705 -5.492 1.00 . A X . 15 LYS HD2 1 1 3 1123 1 1 15 LYS HD3 H -1.621 -3.412 -5.140 1.00 . A X . 15 LYS HD3 1 1 3 1124 1 1 15 LYS HE2 H -2.970 -3.225 -3.123 1.00 . A X . 15 LYS HE2 1 1 3 1125 1 1 15 LYS HE3 H -3.193 -1.501 -3.414 1.00 . A X . 15 LYS HE3 1 1 3 1126 1 1 15 LYS HG2 H 0.322 -2.138 -4.477 1.00 . A X . 15 LYS HG2 1 1 3 1127 1 1 15 LYS HG3 H -0.481 -2.785 -3.044 1.00 . A X . 15 LYS HG3 1 1 3 1128 1 1 15 LYS HZ1 H -4.142 -3.685 -5.194 1.00 . A X . 15 LYS HZ1 1 1 3 1129 1 1 15 LYS HZ2 H -4.370 -2.025 -5.456 1.00 . A X . 15 LYS HZ2 1 1 3 1130 1 1 15 LYS HZ3 H -5.112 -2.787 -4.136 1.00 . A X . 15 LYS HZ3 1 1 3 1131 1 1 15 LYS N N 0.325 1.077 -1.901 1.00 . A X . 15 LYS N 1 1 3 1132 1 1 15 LYS NZ N -4.252 -2.760 -4.724 1.00 . A X . 15 LYS NZ 1 1 3 1133 1 1 15 LYS O O 2.566 -1.271 -3.224 1.00 . A X . 15 LYS O 1 1 3 1134 1 1 16 ALA C C 4.446 1.448 -3.990 1.00 . A X . 16 ALA C 1 1 3 1135 1 1 16 ALA CA C 3.271 0.901 -4.793 1.00 . A X . 16 ALA CA 1 1 3 1136 1 1 16 ALA CB C 2.995 1.789 -5.995 1.00 . A X . 16 ALA CB 1 1 3 1137 1 1 16 ALA H H 1.463 1.555 -3.923 1.00 . A X . 16 ALA H 1 1 3 1138 1 1 16 ALA HA H 3.520 -0.087 -5.150 1.00 . A X . 16 ALA HA 1 1 3 1139 1 1 16 ALA HB1 H 2.136 1.413 -6.532 1.00 . A X . 16 ALA HB1 1 1 3 1140 1 1 16 ALA HB2 H 3.856 1.789 -6.647 1.00 . A X . 16 ALA HB2 1 1 3 1141 1 1 16 ALA HB3 H 2.798 2.796 -5.660 1.00 . A X . 16 ALA HB3 1 1 3 1142 1 1 16 ALA N N 2.082 0.796 -3.964 1.00 . A X . 16 ALA N 1 1 3 1143 1 1 16 ALA O O 5.592 1.417 -4.439 1.00 . A X . 16 ALA O 1 1 3 1144 1 1 17 LEU C C 5.756 1.441 -1.035 1.00 . A X . 17 LEU C 1 1 3 1145 1 1 17 LEU CA C 5.178 2.518 -1.938 1.00 . A X . 17 LEU CA 1 1 3 1146 1 1 17 LEU CB C 4.592 3.660 -1.101 1.00 . A X . 17 LEU CB 1 1 3 1147 1 1 17 LEU CD1 C 6.669 5.071 -1.048 1.00 . A X . 17 LEU CD1 1 1 3 1148 1 1 17 LEU CD2 C 4.875 5.418 0.659 1.00 . A X . 17 LEU CD2 1 1 3 1149 1 1 17 LEU CG C 5.593 4.397 -0.209 1.00 . A X . 17 LEU CG 1 1 3 1150 1 1 17 LEU H H 3.237 1.888 -2.465 1.00 . A X . 17 LEU H 1 1 3 1151 1 1 17 LEU HA H 5.962 2.906 -2.571 1.00 . A X . 17 LEU HA 1 1 3 1152 1 1 17 LEU HB2 H 4.146 4.377 -1.776 1.00 . A X . 17 LEU HB2 1 1 3 1153 1 1 17 LEU HB3 H 3.813 3.255 -0.471 1.00 . A X . 17 LEU HB3 1 1 3 1154 1 1 17 LEU HD11 H 6.206 5.762 -1.737 1.00 . A X . 17 LEU HD11 1 1 3 1155 1 1 17 LEU HD12 H 7.218 4.323 -1.600 1.00 . A X . 17 LEU HD12 1 1 3 1156 1 1 17 LEU HD13 H 7.344 5.609 -0.399 1.00 . A X . 17 LEU HD13 1 1 3 1157 1 1 17 LEU HD21 H 4.202 4.909 1.333 1.00 . A X . 17 LEU HD21 1 1 3 1158 1 1 17 LEU HD22 H 4.313 6.091 0.029 1.00 . A X . 17 LEU HD22 1 1 3 1159 1 1 17 LEU HD23 H 5.600 5.980 1.229 1.00 . A X . 17 LEU HD23 1 1 3 1160 1 1 17 LEU HG H 6.076 3.683 0.443 1.00 . A X . 17 LEU HG 1 1 3 1161 1 1 17 LEU N N 4.157 1.938 -2.792 1.00 . A X . 17 LEU N 1 1 3 1162 1 1 17 LEU O O 6.939 1.463 -0.698 1.00 . A X . 17 LEU O 1 1 3 1163 1 1 18 ALA C C 6.448 -1.422 -0.526 1.00 . A X . 18 ALA C 1 1 3 1164 1 1 18 ALA CA C 5.326 -0.642 0.153 1.00 . A X . 18 ALA CA 1 1 3 1165 1 1 18 ALA CB C 4.142 -1.557 0.444 1.00 . A X . 18 ALA CB 1 1 3 1166 1 1 18 ALA H H 3.970 0.543 -0.957 1.00 . A X . 18 ALA H 1 1 3 1167 1 1 18 ALA HA H 5.686 -0.246 1.088 1.00 . A X . 18 ALA HA 1 1 3 1168 1 1 18 ALA HB1 H 4.459 -2.363 1.090 1.00 . A X . 18 ALA HB1 1 1 3 1169 1 1 18 ALA HB2 H 3.766 -1.965 -0.481 1.00 . A X . 18 ALA HB2 1 1 3 1170 1 1 18 ALA HB3 H 3.361 -0.992 0.932 1.00 . A X . 18 ALA HB3 1 1 3 1171 1 1 18 ALA N N 4.910 0.482 -0.672 1.00 . A X . 18 ALA N 1 1 3 1172 1 1 18 ALA O O 7.325 -1.971 0.136 1.00 . A X . 18 ALA O 1 1 3 1173 1 1 19 LEU C C 8.801 -1.454 -2.497 1.00 . A X . 19 LEU C 1 1 3 1174 1 1 19 LEU CA C 7.440 -2.130 -2.645 1.00 . A X . 19 LEU CA 1 1 3 1175 1 1 19 LEU CB C 7.035 -2.159 -4.120 1.00 . A X . 19 LEU CB 1 1 3 1176 1 1 19 LEU CD1 C 5.388 -2.780 -5.899 1.00 . A X . 19 LEU CD1 1 1 3 1177 1 1 19 LEU CD2 C 5.783 -4.331 -3.986 1.00 . A X . 19 LEU CD2 1 1 3 1178 1 1 19 LEU CG C 5.715 -2.874 -4.419 1.00 . A X . 19 LEU CG 1 1 3 1179 1 1 19 LEU H H 5.687 -0.986 -2.323 1.00 . A X . 19 LEU H 1 1 3 1180 1 1 19 LEU HA H 7.511 -3.143 -2.282 1.00 . A X . 19 LEU HA 1 1 3 1181 1 1 19 LEU HB2 H 6.956 -1.139 -4.468 1.00 . A X . 19 LEU HB2 1 1 3 1182 1 1 19 LEU HB3 H 7.818 -2.650 -4.676 1.00 . A X . 19 LEU HB3 1 1 3 1183 1 1 19 LEU HD11 H 5.319 -1.742 -6.189 1.00 . A X . 19 LEU HD11 1 1 3 1184 1 1 19 LEU HD12 H 4.445 -3.271 -6.090 1.00 . A X . 19 LEU HD12 1 1 3 1185 1 1 19 LEU HD13 H 6.168 -3.263 -6.470 1.00 . A X . 19 LEU HD13 1 1 3 1186 1 1 19 LEU HD21 H 5.988 -4.385 -2.927 1.00 . A X . 19 LEU HD21 1 1 3 1187 1 1 19 LEU HD22 H 6.571 -4.830 -4.531 1.00 . A X . 19 LEU HD22 1 1 3 1188 1 1 19 LEU HD23 H 4.840 -4.814 -4.196 1.00 . A X . 19 LEU HD23 1 1 3 1189 1 1 19 LEU HG H 4.919 -2.394 -3.868 1.00 . A X . 19 LEU HG 1 1 3 1190 1 1 19 LEU N N 6.420 -1.443 -1.857 1.00 . A X . 19 LEU N 1 1 3 1191 1 1 19 LEU O O 9.842 -2.078 -2.694 1.00 . A X . 19 LEU O 1 1 3 1192 1 1 20 LYS C C 10.571 0.366 -0.560 1.00 . A X . 20 LYS C 1 1 3 1193 1 1 20 LYS CA C 10.013 0.586 -1.961 1.00 . A X . 20 LYS CA 1 1 3 1194 1 1 20 LYS CB C 9.757 2.075 -2.202 1.00 . A X . 20 LYS CB 1 1 3 1195 1 1 20 LYS CD C 10.448 2.134 -4.619 1.00 . A X . 20 LYS CD 1 1 3 1196 1 1 20 LYS CE C 10.009 2.410 -6.051 1.00 . A X . 20 LYS CE 1 1 3 1197 1 1 20 LYS CG C 9.326 2.396 -3.623 1.00 . A X . 20 LYS CG 1 1 3 1198 1 1 20 LYS H H 7.921 0.266 -1.992 1.00 . A X . 20 LYS H 1 1 3 1199 1 1 20 LYS HA H 10.732 0.230 -2.683 1.00 . A X . 20 LYS HA 1 1 3 1200 1 1 20 LYS HB2 H 8.979 2.408 -1.530 1.00 . A X . 20 LYS HB2 1 1 3 1201 1 1 20 LYS HB3 H 10.662 2.624 -1.990 1.00 . A X . 20 LYS HB3 1 1 3 1202 1 1 20 LYS HD2 H 11.285 2.775 -4.381 1.00 . A X . 20 LYS HD2 1 1 3 1203 1 1 20 LYS HD3 H 10.751 1.100 -4.539 1.00 . A X . 20 LYS HD3 1 1 3 1204 1 1 20 LYS HE2 H 10.864 2.309 -6.700 1.00 . A X . 20 LYS HE2 1 1 3 1205 1 1 20 LYS HE3 H 9.257 1.685 -6.330 1.00 . A X . 20 LYS HE3 1 1 3 1206 1 1 20 LYS HG2 H 8.481 1.775 -3.878 1.00 . A X . 20 LYS HG2 1 1 3 1207 1 1 20 LYS HG3 H 9.043 3.437 -3.677 1.00 . A X . 20 LYS HG3 1 1 3 1208 1 1 20 LYS HZ1 H 10.004 4.466 -5.652 1.00 . A X . 20 LYS HZ1 1 1 3 1209 1 1 20 LYS HZ2 H 8.457 3.801 -5.884 1.00 . A X . 20 LYS HZ2 1 1 3 1210 1 1 20 LYS HZ3 H 9.474 4.063 -7.213 1.00 . A X . 20 LYS HZ3 1 1 3 1211 1 1 20 LYS N N 8.784 -0.176 -2.144 1.00 . A X . 20 LYS N 1 1 3 1212 1 1 20 LYS NZ N 9.447 3.778 -6.211 1.00 . A X . 20 LYS NZ 1 1 3 1213 1 1 20 LYS O O 11.768 0.528 -0.323 1.00 . A X . 20 LYS O 1 1 3 1214 1 1 21 LEU C C 10.526 -1.765 1.861 1.00 . A X . 21 LEU C 1 1 3 1215 1 1 21 LEU CA C 10.093 -0.308 1.731 1.00 . A X . 21 LEU CA 1 1 3 1216 1 1 21 LEU CB C 8.952 -0.010 2.711 1.00 . A X . 21 LEU CB 1 1 3 1217 1 1 21 LEU CD1 C 8.449 2.362 1.999 1.00 . A X . 21 LEU CD1 1 1 3 1218 1 1 21 LEU CD2 C 7.796 1.576 4.280 1.00 . A X . 21 LEU CD2 1 1 3 1219 1 1 21 LEU CG C 8.823 1.453 3.161 1.00 . A X . 21 LEU CG 1 1 3 1220 1 1 21 LEU H H 8.746 -0.088 0.116 1.00 . A X . 21 LEU H 1 1 3 1221 1 1 21 LEU HA H 10.934 0.326 1.971 1.00 . A X . 21 LEU HA 1 1 3 1222 1 1 21 LEU HB2 H 8.023 -0.302 2.244 1.00 . A X . 21 LEU HB2 1 1 3 1223 1 1 21 LEU HB3 H 9.098 -0.620 3.590 1.00 . A X . 21 LEU HB3 1 1 3 1224 1 1 21 LEU HD11 H 8.432 3.389 2.335 1.00 . A X . 21 LEU HD11 1 1 3 1225 1 1 21 LEU HD12 H 7.471 2.090 1.630 1.00 . A X . 21 LEU HD12 1 1 3 1226 1 1 21 LEU HD13 H 9.176 2.254 1.208 1.00 . A X . 21 LEU HD13 1 1 3 1227 1 1 21 LEU HD21 H 7.740 2.605 4.604 1.00 . A X . 21 LEU HD21 1 1 3 1228 1 1 21 LEU HD22 H 8.090 0.952 5.112 1.00 . A X . 21 LEU HD22 1 1 3 1229 1 1 21 LEU HD23 H 6.829 1.262 3.917 1.00 . A X . 21 LEU HD23 1 1 3 1230 1 1 21 LEU HG H 9.776 1.786 3.547 1.00 . A X . 21 LEU HG 1 1 3 1231 1 1 21 LEU N N 9.693 -0.012 0.362 1.00 . A X . 21 LEU N 1 1 3 1232 1 1 21 LEU O O 11.068 -2.175 2.888 1.00 . A X . 21 LEU O 1 1 3 1233 1 1 22 LYS C C 12.194 -4.049 0.494 1.00 . A X . 22 LYS C 1 1 3 1234 1 1 22 LYS CA C 10.703 -3.939 0.785 1.00 . A X . 22 LYS CA 1 1 3 1235 1 1 22 LYS CB C 9.903 -4.719 -0.256 1.00 . A X . 22 LYS CB 1 1 3 1236 1 1 22 LYS CD C 7.700 -5.743 -0.895 1.00 . A X . 22 LYS CD 1 1 3 1237 1 1 22 LYS CE C 6.335 -6.157 -0.370 1.00 . A X . 22 LYS CE 1 1 3 1238 1 1 22 LYS CG C 8.449 -4.911 0.129 1.00 . A X . 22 LYS CG 1 1 3 1239 1 1 22 LYS H H 9.819 -2.166 0.039 1.00 . A X . 22 LYS H 1 1 3 1240 1 1 22 LYS HA H 10.510 -4.359 1.761 1.00 . A X . 22 LYS HA 1 1 3 1241 1 1 22 LYS HB2 H 9.939 -4.186 -1.194 1.00 . A X . 22 LYS HB2 1 1 3 1242 1 1 22 LYS HB3 H 10.353 -5.692 -0.385 1.00 . A X . 22 LYS HB3 1 1 3 1243 1 1 22 LYS HD2 H 7.570 -5.161 -1.795 1.00 . A X . 22 LYS HD2 1 1 3 1244 1 1 22 LYS HD3 H 8.277 -6.630 -1.115 1.00 . A X . 22 LYS HD3 1 1 3 1245 1 1 22 LYS HE2 H 5.751 -5.269 -0.175 1.00 . A X . 22 LYS HE2 1 1 3 1246 1 1 22 LYS HE3 H 5.839 -6.757 -1.118 1.00 . A X . 22 LYS HE3 1 1 3 1247 1 1 22 LYS HG2 H 8.407 -5.414 1.083 1.00 . A X . 22 LYS HG2 1 1 3 1248 1 1 22 LYS HG3 H 7.977 -3.942 0.209 1.00 . A X . 22 LYS HG3 1 1 3 1249 1 1 22 LYS HZ1 H 5.527 -7.338 1.161 1.00 . A X . 22 LYS HZ1 1 1 3 1250 1 1 22 LYS HZ2 H 6.806 -6.345 1.662 1.00 . A X . 22 LYS HZ2 1 1 3 1251 1 1 22 LYS HZ3 H 7.123 -7.738 0.749 1.00 . A X . 22 LYS HZ3 1 1 3 1252 1 1 22 LYS N N 10.287 -2.542 0.814 1.00 . A X . 22 LYS N 1 1 3 1253 1 1 22 LYS NZ N 6.453 -6.948 0.886 1.00 . A X . 22 LYS NZ 1 1 3 1254 1 1 22 LYS O O 12.605 -4.524 -0.567 1.00 . A X . 22 LYS O 1 1 3 1255 1 1 23 LYS C C 15.000 -4.892 1.939 1.00 . A X . 23 LYS C 1 1 3 1256 1 1 23 LYS CA C 14.439 -3.623 1.312 1.00 . A X . 23 LYS CA 1 1 3 1257 1 1 23 LYS CB C 15.042 -2.382 1.974 1.00 . A X . 23 LYS CB 1 1 3 1258 1 1 23 LYS CD C 14.958 0.125 2.214 1.00 . A X . 23 LYS CD 1 1 3 1259 1 1 23 LYS CE C 14.092 1.355 1.992 1.00 . A X . 23 LYS CE 1 1 3 1260 1 1 23 LYS CG C 14.328 -1.099 1.579 1.00 . A X . 23 LYS CG 1 1 3 1261 1 1 23 LYS H H 12.599 -3.228 2.260 1.00 . A X . 23 LYS H 1 1 3 1262 1 1 23 LYS HA H 14.675 -3.614 0.262 1.00 . A X . 23 LYS HA 1 1 3 1263 1 1 23 LYS HB2 H 14.981 -2.492 3.047 1.00 . A X . 23 LYS HB2 1 1 3 1264 1 1 23 LYS HB3 H 16.078 -2.297 1.685 1.00 . A X . 23 LYS HB3 1 1 3 1265 1 1 23 LYS HD2 H 15.066 -0.044 3.275 1.00 . A X . 23 LYS HD2 1 1 3 1266 1 1 23 LYS HD3 H 15.928 0.292 1.770 1.00 . A X . 23 LYS HD3 1 1 3 1267 1 1 23 LYS HE2 H 13.858 1.430 0.940 1.00 . A X . 23 LYS HE2 1 1 3 1268 1 1 23 LYS HE3 H 13.176 1.239 2.554 1.00 . A X . 23 LYS HE3 1 1 3 1269 1 1 23 LYS HG2 H 14.370 -0.991 0.505 1.00 . A X . 23 LYS HG2 1 1 3 1270 1 1 23 LYS HG3 H 13.296 -1.164 1.893 1.00 . A X . 23 LYS HG3 1 1 3 1271 1 1 23 LYS HZ1 H 15.595 2.785 1.814 1.00 . A X . 23 LYS HZ1 1 1 3 1272 1 1 23 LYS HZ2 H 15.096 2.514 3.412 1.00 . A X . 23 LYS HZ2 1 1 3 1273 1 1 23 LYS HZ3 H 14.112 3.409 2.352 1.00 . A X . 23 LYS HZ3 1 1 3 1274 1 1 23 LYS N N 12.995 -3.600 1.444 1.00 . A X . 23 LYS N 1 1 3 1275 1 1 23 LYS NZ N 14.770 2.602 2.424 1.00 . A X . 23 LYS NZ 1 1 3 1276 1 1 23 LYS O O 16.185 -5.198 1.807 1.00 . A X . 23 LYS O 1 1 3 1277 1 1 24 ALA C C 13.246 -7.750 3.400 1.00 . A X . 24 ALA C 1 1 3 1278 1 1 24 ALA CA C 14.491 -6.887 3.237 1.00 . A X . 24 ALA CA 1 1 3 1279 1 1 24 ALA CB C 15.165 -6.651 4.584 1.00 . A X . 24 ALA CB 1 1 3 1280 1 1 24 ALA H H 13.206 -5.313 2.691 1.00 . A X . 24 ALA H 1 1 3 1281 1 1 24 ALA HA H 15.191 -7.394 2.588 1.00 . A X . 24 ALA HA 1 1 3 1282 1 1 24 ALA HB1 H 14.467 -6.176 5.259 1.00 . A X . 24 ALA HB1 1 1 3 1283 1 1 24 ALA HB2 H 16.026 -6.013 4.449 1.00 . A X . 24 ALA HB2 1 1 3 1284 1 1 24 ALA HB3 H 15.480 -7.596 4.998 1.00 . A X . 24 ALA HB3 1 1 3 1285 1 1 24 ALA N N 14.129 -5.625 2.617 1.00 . A X . 24 ALA N 1 1 3 1286 1 1 24 ALA O O 12.960 -8.190 4.530 1.00 . A X . 24 ALA O 1 1 3 1287 1 1 24 ALA OXT O 12.533 -7.948 2.402 1.00 . A X . 24 ALA OXT 1 1 4 1288 1 1 1 LYS C C 0.278 16.955 12.842 1.00 . A X . 1 LYS C 1 1 4 1289 1 1 1 LYS CA C -1.103 16.874 13.484 1.00 . A X . 1 LYS CA 1 1 4 1290 1 1 1 LYS CB C -0.995 17.140 14.989 1.00 . A X . 1 LYS CB 1 1 4 1291 1 1 1 LYS CD C -2.176 17.423 17.194 1.00 . A X . 1 LYS CD 1 1 4 1292 1 1 1 LYS CE C -1.642 18.814 17.499 1.00 . A X . 1 LYS CE 1 1 4 1293 1 1 1 LYS CG C -2.339 17.192 15.700 1.00 . A X . 1 LYS CG 1 1 4 1294 1 1 1 LYS H1 H -2.661 15.498 13.652 1.00 . A X . 1 LYS H1 1 1 4 1295 1 1 1 LYS H2 H -1.117 14.797 13.661 1.00 . A X . 1 LYS H2 1 1 4 1296 1 1 1 LYS H3 H -1.778 15.371 12.212 1.00 . A X . 1 LYS H3 1 1 4 1297 1 1 1 LYS HA H -1.740 17.624 13.037 1.00 . A X . 1 LYS HA 1 1 4 1298 1 1 1 LYS HB2 H -0.405 16.355 15.439 1.00 . A X . 1 LYS HB2 1 1 4 1299 1 1 1 LYS HB3 H -0.494 18.085 15.143 1.00 . A X . 1 LYS HB3 1 1 4 1300 1 1 1 LYS HD2 H -3.138 17.308 17.673 1.00 . A X . 1 LYS HD2 1 1 4 1301 1 1 1 LYS HD3 H -1.488 16.690 17.586 1.00 . A X . 1 LYS HD3 1 1 4 1302 1 1 1 LYS HE2 H -1.448 18.887 18.558 1.00 . A X . 1 LYS HE2 1 1 4 1303 1 1 1 LYS HE3 H -0.722 18.958 16.954 1.00 . A X . 1 LYS HE3 1 1 4 1304 1 1 1 LYS HG2 H -2.925 17.997 15.284 1.00 . A X . 1 LYS HG2 1 1 4 1305 1 1 1 LYS HG3 H -2.852 16.256 15.546 1.00 . A X . 1 LYS HG3 1 1 4 1306 1 1 1 LYS HZ1 H -2.307 20.794 17.501 1.00 . A X . 1 LYS HZ1 1 1 4 1307 1 1 1 LYS HZ2 H -3.559 19.650 17.474 1.00 . A X . 1 LYS HZ2 1 1 4 1308 1 1 1 LYS HZ3 H -2.655 19.957 16.070 1.00 . A X . 1 LYS HZ3 1 1 4 1309 1 1 1 LYS N N -1.706 15.546 13.235 1.00 . A X . 1 LYS N 1 1 4 1310 1 1 1 LYS NZ N -2.606 19.876 17.110 1.00 . A X . 1 LYS NZ 1 1 4 1311 1 1 1 LYS O O 1.290 17.009 13.539 1.00 . A X . 1 LYS O 1 1 4 1312 1 1 2 LYS C C 2.513 15.899 11.166 1.00 . A X . 2 LYS C 1 1 4 1313 1 1 2 LYS CA C 1.551 17.007 10.740 1.00 . A X . 2 LYS CA 1 1 4 1314 1 1 2 LYS CB C 2.231 18.371 10.901 1.00 . A X . 2 LYS CB 1 1 4 1315 1 1 2 LYS CD C 1.274 19.390 8.808 1.00 . A X . 2 LYS CD 1 1 4 1316 1 1 2 LYS CE C 0.708 20.656 8.185 1.00 . A X . 2 LYS CE 1 1 4 1317 1 1 2 LYS CG C 1.447 19.534 10.312 1.00 . A X . 2 LYS CG 1 1 4 1318 1 1 2 LYS H H -0.552 16.941 11.018 1.00 . A X . 2 LYS H 1 1 4 1319 1 1 2 LYS HA H 1.302 16.863 9.699 1.00 . A X . 2 LYS HA 1 1 4 1320 1 1 2 LYS HB2 H 2.375 18.563 11.954 1.00 . A X . 2 LYS HB2 1 1 4 1321 1 1 2 LYS HB3 H 3.196 18.337 10.418 1.00 . A X . 2 LYS HB3 1 1 4 1322 1 1 2 LYS HD2 H 2.236 19.184 8.363 1.00 . A X . 2 LYS HD2 1 1 4 1323 1 1 2 LYS HD3 H 0.601 18.570 8.609 1.00 . A X . 2 LYS HD3 1 1 4 1324 1 1 2 LYS HE2 H 1.399 21.467 8.360 1.00 . A X . 2 LYS HE2 1 1 4 1325 1 1 2 LYS HE3 H 0.602 20.501 7.121 1.00 . A X . 2 LYS HE3 1 1 4 1326 1 1 2 LYS HG2 H 0.471 19.564 10.774 1.00 . A X . 2 LYS HG2 1 1 4 1327 1 1 2 LYS HG3 H 1.973 20.453 10.521 1.00 . A X . 2 LYS HG3 1 1 4 1328 1 1 2 LYS HZ1 H -0.553 21.105 9.792 1.00 . A X . 2 LYS HZ1 1 1 4 1329 1 1 2 LYS HZ2 H -1.328 20.299 8.514 1.00 . A X . 2 LYS HZ2 1 1 4 1330 1 1 2 LYS HZ3 H -0.928 21.941 8.366 1.00 . A X . 2 LYS HZ3 1 1 4 1331 1 1 2 LYS N N 0.302 16.959 11.507 1.00 . A X . 2 LYS N 1 1 4 1332 1 1 2 LYS NZ N -0.615 21.024 8.753 1.00 . A X . 2 LYS NZ 1 1 4 1333 1 1 2 LYS O O 3.713 16.130 11.310 1.00 . A X . 2 LYS O 1 1 4 1334 1 1 3 LEU C C 3.608 12.947 10.717 1.00 . A X . 3 LEU C 1 1 4 1335 1 1 3 LEU CA C 2.797 13.584 11.846 1.00 . A X . 3 LEU CA 1 1 4 1336 1 1 3 LEU CB C 1.911 12.540 12.527 1.00 . A X . 3 LEU CB 1 1 4 1337 1 1 3 LEU CD1 C 3.447 12.134 14.459 1.00 . A X . 3 LEU CD1 1 1 4 1338 1 1 3 LEU CD2 C 1.677 10.465 13.904 1.00 . A X . 3 LEU CD2 1 1 4 1339 1 1 3 LEU CG C 2.655 11.480 13.341 1.00 . A X . 3 LEU CG 1 1 4 1340 1 1 3 LEU H H 1.039 14.540 11.141 1.00 . A X . 3 LEU H 1 1 4 1341 1 1 3 LEU HA H 3.484 13.986 12.575 1.00 . A X . 3 LEU HA 1 1 4 1342 1 1 3 LEU HB2 H 1.227 13.053 13.186 1.00 . A X . 3 LEU HB2 1 1 4 1343 1 1 3 LEU HB3 H 1.336 12.037 11.763 1.00 . A X . 3 LEU HB3 1 1 4 1344 1 1 3 LEU HD11 H 2.777 12.703 15.086 1.00 . A X . 3 LEU HD11 1 1 4 1345 1 1 3 LEU HD12 H 4.190 12.794 14.035 1.00 . A X . 3 LEU HD12 1 1 4 1346 1 1 3 LEU HD13 H 3.935 11.374 15.050 1.00 . A X . 3 LEU HD13 1 1 4 1347 1 1 3 LEU HD21 H 0.986 10.963 14.568 1.00 . A X . 3 LEU HD21 1 1 4 1348 1 1 3 LEU HD22 H 2.217 9.706 14.448 1.00 . A X . 3 LEU HD22 1 1 4 1349 1 1 3 LEU HD23 H 1.128 10.005 13.094 1.00 . A X . 3 LEU HD23 1 1 4 1350 1 1 3 LEU HG H 3.350 10.956 12.697 1.00 . A X . 3 LEU HG 1 1 4 1351 1 1 3 LEU N N 1.989 14.691 11.348 1.00 . A X . 3 LEU N 1 1 4 1352 1 1 3 LEU O O 3.271 11.865 10.222 1.00 . A X . 3 LEU O 1 1 4 1353 1 1 4 LYS C C 4.927 13.105 7.920 1.00 . A X . 4 LYS C 1 1 4 1354 1 1 4 LYS CA C 5.603 13.201 9.283 1.00 . A X . 4 LYS CA 1 1 4 1355 1 1 4 LYS CB C 6.252 11.853 9.629 1.00 . A X . 4 LYS CB 1 1 4 1356 1 1 4 LYS CD C 8.157 10.871 10.957 1.00 . A X . 4 LYS CD 1 1 4 1357 1 1 4 LYS CE C 7.775 9.481 10.470 1.00 . A X . 4 LYS CE 1 1 4 1358 1 1 4 LYS CG C 6.971 11.830 10.970 1.00 . A X . 4 LYS CG 1 1 4 1359 1 1 4 LYS H H 4.829 14.523 10.742 1.00 . A X . 4 LYS H 1 1 4 1360 1 1 4 LYS HA H 6.382 13.945 9.216 1.00 . A X . 4 LYS HA 1 1 4 1361 1 1 4 LYS HB2 H 5.484 11.092 9.646 1.00 . A X . 4 LYS HB2 1 1 4 1362 1 1 4 LYS HB3 H 6.968 11.606 8.859 1.00 . A X . 4 LYS HB3 1 1 4 1363 1 1 4 LYS HD2 H 8.917 11.270 10.303 1.00 . A X . 4 LYS HD2 1 1 4 1364 1 1 4 LYS HD3 H 8.550 10.795 11.960 1.00 . A X . 4 LYS HD3 1 1 4 1365 1 1 4 LYS HE2 H 7.323 9.569 9.493 1.00 . A X . 4 LYS HE2 1 1 4 1366 1 1 4 LYS HE3 H 8.674 8.884 10.395 1.00 . A X . 4 LYS HE3 1 1 4 1367 1 1 4 LYS HG2 H 7.330 12.823 11.191 1.00 . A X . 4 LYS HG2 1 1 4 1368 1 1 4 LYS HG3 H 6.275 11.518 11.735 1.00 . A X . 4 LYS HG3 1 1 4 1369 1 1 4 LYS HZ1 H 6.562 7.866 10.993 1.00 . A X . 4 LYS HZ1 1 1 4 1370 1 1 4 LYS HZ2 H 5.947 9.365 11.477 1.00 . A X . 4 LYS HZ2 1 1 4 1371 1 1 4 LYS HZ3 H 7.243 8.670 12.322 1.00 . A X . 4 LYS HZ3 1 1 4 1372 1 1 4 LYS N N 4.670 13.648 10.320 1.00 . A X . 4 LYS N 1 1 4 1373 1 1 4 LYS NZ N 6.820 8.800 11.380 1.00 . A X . 4 LYS NZ 1 1 4 1374 1 1 4 LYS O O 5.323 12.289 7.090 1.00 . A X . 4 LYS O 1 1 4 1375 1 1 5 LEU C C 2.430 12.653 6.210 1.00 . A X . 5 LEU C 1 1 4 1376 1 1 5 LEU CA C 3.174 13.971 6.439 1.00 . A X . 5 LEU CA 1 1 4 1377 1 1 5 LEU CB C 4.108 14.270 5.257 1.00 . A X . 5 LEU CB 1 1 4 1378 1 1 5 LEU CD1 C 2.384 15.395 3.810 1.00 . A X . 5 LEU CD1 1 1 4 1379 1 1 5 LEU CD2 C 4.477 14.486 2.786 1.00 . A X . 5 LEU CD2 1 1 4 1380 1 1 5 LEU CG C 3.435 14.298 3.878 1.00 . A X . 5 LEU CG 1 1 4 1381 1 1 5 LEU H H 3.666 14.571 8.410 1.00 . A X . 5 LEU H 1 1 4 1382 1 1 5 LEU HA H 2.445 14.765 6.511 1.00 . A X . 5 LEU HA 1 1 4 1383 1 1 5 LEU HB2 H 4.569 15.233 5.426 1.00 . A X . 5 LEU HB2 1 1 4 1384 1 1 5 LEU HB3 H 4.883 13.520 5.239 1.00 . A X . 5 LEU HB3 1 1 4 1385 1 1 5 LEU HD11 H 2.855 16.357 3.950 1.00 . A X . 5 LEU HD11 1 1 4 1386 1 1 5 LEU HD12 H 1.650 15.237 4.587 1.00 . A X . 5 LEU HD12 1 1 4 1387 1 1 5 LEU HD13 H 1.897 15.369 2.846 1.00 . A X . 5 LEU HD13 1 1 4 1388 1 1 5 LEU HD21 H 4.995 15.421 2.939 1.00 . A X . 5 LEU HD21 1 1 4 1389 1 1 5 LEU HD22 H 3.991 14.497 1.822 1.00 . A X . 5 LEU HD22 1 1 4 1390 1 1 5 LEU HD23 H 5.186 13.672 2.822 1.00 . A X . 5 LEU HD23 1 1 4 1391 1 1 5 LEU HG H 2.940 13.352 3.708 1.00 . A X . 5 LEU HG 1 1 4 1392 1 1 5 LEU N N 3.919 13.947 7.700 1.00 . A X . 5 LEU N 1 1 4 1393 1 1 5 LEU O O 2.982 11.690 5.677 1.00 . A X . 5 LEU O 1 1 4 1394 1 1 6 ALA C C -0.879 11.737 5.619 1.00 . A X . 6 ALA C 1 1 4 1395 1 1 6 ALA CA C 0.348 11.431 6.463 1.00 . A X . 6 ALA CA 1 1 4 1396 1 1 6 ALA CB C -0.057 10.901 7.829 1.00 . A X . 6 ALA CB 1 1 4 1397 1 1 6 ALA H H 0.768 13.433 7.005 1.00 . A X . 6 ALA H 1 1 4 1398 1 1 6 ALA HA H 0.937 10.675 5.963 1.00 . A X . 6 ALA HA 1 1 4 1399 1 1 6 ALA HB1 H 0.828 10.718 8.422 1.00 . A X . 6 ALA HB1 1 1 4 1400 1 1 6 ALA HB2 H -0.608 9.979 7.711 1.00 . A X . 6 ALA HB2 1 1 4 1401 1 1 6 ALA HB3 H -0.679 11.631 8.327 1.00 . A X . 6 ALA HB3 1 1 4 1402 1 1 6 ALA N N 1.168 12.623 6.608 1.00 . A X . 6 ALA N 1 1 4 1403 1 1 6 ALA O O -1.928 11.112 5.768 1.00 . A X . 6 ALA O 1 1 4 1404 1 1 7 LEU C C -1.703 12.543 2.486 1.00 . A X . 7 LEU C 1 1 4 1405 1 1 7 LEU CA C -1.838 13.131 3.885 1.00 . A X . 7 LEU CA 1 1 4 1406 1 1 7 LEU CB C -1.889 14.658 3.809 1.00 . A X . 7 LEU CB 1 1 4 1407 1 1 7 LEU CD1 C -4.384 14.825 3.724 1.00 . A X . 7 LEU CD1 1 1 4 1408 1 1 7 LEU CD2 C -2.973 16.740 2.949 1.00 . A X . 7 LEU CD2 1 1 4 1409 1 1 7 LEU CG C -3.084 15.228 3.047 1.00 . A X . 7 LEU CG 1 1 4 1410 1 1 7 LEU H H 0.137 13.136 4.628 1.00 . A X . 7 LEU H 1 1 4 1411 1 1 7 LEU HA H -2.753 12.770 4.330 1.00 . A X . 7 LEU HA 1 1 4 1412 1 1 7 LEU HB2 H -1.915 15.045 4.817 1.00 . A X . 7 LEU HB2 1 1 4 1413 1 1 7 LEU HB3 H -0.986 15.005 3.331 1.00 . A X . 7 LEU HB3 1 1 4 1414 1 1 7 LEU HD11 H -4.453 13.747 3.764 1.00 . A X . 7 LEU HD11 1 1 4 1415 1 1 7 LEU HD12 H -5.219 15.218 3.165 1.00 . A X . 7 LEU HD12 1 1 4 1416 1 1 7 LEU HD13 H -4.405 15.224 4.727 1.00 . A X . 7 LEU HD13 1 1 4 1417 1 1 7 LEU HD21 H -3.010 17.167 3.940 1.00 . A X . 7 LEU HD21 1 1 4 1418 1 1 7 LEU HD22 H -3.792 17.126 2.359 1.00 . A X . 7 LEU HD22 1 1 4 1419 1 1 7 LEU HD23 H -2.036 17.004 2.480 1.00 . A X . 7 LEU HD23 1 1 4 1420 1 1 7 LEU HG H -3.089 14.824 2.045 1.00 . A X . 7 LEU HG 1 1 4 1421 1 1 7 LEU N N -0.737 12.703 4.726 1.00 . A X . 7 LEU N 1 1 4 1422 1 1 7 LEU O O -0.799 12.910 1.735 1.00 . A X . 7 LEU O 1 1 4 1423 1 1 8 ALA C C -1.469 10.030 0.610 1.00 . A X . 8 ALA C 1 1 4 1424 1 1 8 ALA CA C -2.654 10.958 0.855 1.00 . A X . 8 ALA CA 1 1 4 1425 1 1 8 ALA CB C -2.765 11.997 -0.254 1.00 . A X . 8 ALA CB 1 1 4 1426 1 1 8 ALA H H -3.208 11.282 2.871 1.00 . A X . 8 ALA H 1 1 4 1427 1 1 8 ALA HA H -3.556 10.365 0.835 1.00 . A X . 8 ALA HA 1 1 4 1428 1 1 8 ALA HB1 H -1.873 12.606 -0.267 1.00 . A X . 8 ALA HB1 1 1 4 1429 1 1 8 ALA HB2 H -3.627 12.622 -0.078 1.00 . A X . 8 ALA HB2 1 1 4 1430 1 1 8 ALA HB3 H -2.871 11.495 -1.205 1.00 . A X . 8 ALA HB3 1 1 4 1431 1 1 8 ALA N N -2.583 11.591 2.173 1.00 . A X . 8 ALA N 1 1 4 1432 1 1 8 ALA O O -1.379 9.392 -0.436 1.00 . A X . 8 ALA O 1 1 4 1433 1 1 9 LYS C C 0.208 7.612 1.769 1.00 . A X . 9 LYS C 1 1 4 1434 1 1 9 LYS CA C 0.587 9.071 1.482 1.00 . A X . 9 LYS CA 1 1 4 1435 1 1 9 LYS CB C 1.700 9.526 2.437 1.00 . A X . 9 LYS CB 1 1 4 1436 1 1 9 LYS CD C 3.907 8.897 3.458 1.00 . A X . 9 LYS CD 1 1 4 1437 1 1 9 LYS CE C 5.258 8.237 3.223 1.00 . A X . 9 LYS CE 1 1 4 1438 1 1 9 LYS CG C 3.003 8.770 2.245 1.00 . A X . 9 LYS CG 1 1 4 1439 1 1 9 LYS H H -0.699 10.476 2.394 1.00 . A X . 9 LYS H 1 1 4 1440 1 1 9 LYS HA H 0.952 9.135 0.467 1.00 . A X . 9 LYS HA 1 1 4 1441 1 1 9 LYS HB2 H 1.892 10.578 2.280 1.00 . A X . 9 LYS HB2 1 1 4 1442 1 1 9 LYS HB3 H 1.372 9.376 3.455 1.00 . A X . 9 LYS HB3 1 1 4 1443 1 1 9 LYS HD2 H 4.062 9.944 3.670 1.00 . A X . 9 LYS HD2 1 1 4 1444 1 1 9 LYS HD3 H 3.425 8.424 4.301 1.00 . A X . 9 LYS HD3 1 1 4 1445 1 1 9 LYS HE2 H 5.100 7.286 2.733 1.00 . A X . 9 LYS HE2 1 1 4 1446 1 1 9 LYS HE3 H 5.852 8.874 2.585 1.00 . A X . 9 LYS HE3 1 1 4 1447 1 1 9 LYS HG2 H 2.781 7.727 2.084 1.00 . A X . 9 LYS HG2 1 1 4 1448 1 1 9 LYS HG3 H 3.516 9.171 1.381 1.00 . A X . 9 LYS HG3 1 1 4 1449 1 1 9 LYS HZ1 H 5.596 7.178 4.993 1.00 . A X . 9 LYS HZ1 1 1 4 1450 1 1 9 LYS HZ2 H 5.894 8.841 5.121 1.00 . A X . 9 LYS HZ2 1 1 4 1451 1 1 9 LYS HZ3 H 7.001 7.845 4.314 1.00 . A X . 9 LYS HZ3 1 1 4 1452 1 1 9 LYS N N -0.575 9.940 1.585 1.00 . A X . 9 LYS N 1 1 4 1453 1 1 9 LYS NZ N 5.989 8.008 4.497 1.00 . A X . 9 LYS NZ 1 1 4 1454 1 1 9 LYS O O 0.461 6.741 0.944 1.00 . A X . 9 LYS O 1 1 4 1455 1 1 10 PRO C C -2.067 5.490 2.584 1.00 . A X . 10 PRO C 1 1 4 1456 1 1 10 PRO CA C -0.784 5.936 3.283 1.00 . A X . 10 PRO CA 1 1 4 1457 1 1 10 PRO CB C -1.001 5.977 4.807 1.00 . A X . 10 PRO CB 1 1 4 1458 1 1 10 PRO CD C -0.750 8.236 4.024 1.00 . A X . 10 PRO CD 1 1 4 1459 1 1 10 PRO CG C -0.649 7.366 5.241 1.00 . A X . 10 PRO CG 1 1 4 1460 1 1 10 PRO HA H 0.007 5.238 3.052 1.00 . A X . 10 PRO HA 1 1 4 1461 1 1 10 PRO HB2 H -2.033 5.747 5.029 1.00 . A X . 10 PRO HB2 1 1 4 1462 1 1 10 PRO HB3 H -0.360 5.248 5.279 1.00 . A X . 10 PRO HB3 1 1 4 1463 1 1 10 PRO HD2 H -1.756 8.614 3.908 1.00 . A X . 10 PRO HD2 1 1 4 1464 1 1 10 PRO HD3 H -0.043 9.049 4.079 1.00 . A X . 10 PRO HD3 1 1 4 1465 1 1 10 PRO HG2 H -1.344 7.701 5.997 1.00 . A X . 10 PRO HG2 1 1 4 1466 1 1 10 PRO HG3 H 0.359 7.383 5.628 1.00 . A X . 10 PRO HG3 1 1 4 1467 1 1 10 PRO N N -0.403 7.308 2.939 1.00 . A X . 10 PRO N 1 1 4 1468 1 1 10 PRO O O -2.279 4.299 2.354 1.00 . A X . 10 PRO O 1 1 4 1469 1 1 11 ALA C C -4.125 5.925 0.151 1.00 . A X . 11 ALA C 1 1 4 1470 1 1 11 ALA CA C -4.213 6.149 1.656 1.00 . A X . 11 ALA CA 1 1 4 1471 1 1 11 ALA CB C -5.203 7.262 1.965 1.00 . A X . 11 ALA CB 1 1 4 1472 1 1 11 ALA H H -2.661 7.386 2.396 1.00 . A X . 11 ALA H 1 1 4 1473 1 1 11 ALA HA H -4.581 5.244 2.117 1.00 . A X . 11 ALA HA 1 1 4 1474 1 1 11 ALA HB1 H -5.239 7.428 3.031 1.00 . A X . 11 ALA HB1 1 1 4 1475 1 1 11 ALA HB2 H -6.182 6.977 1.611 1.00 . A X . 11 ALA HB2 1 1 4 1476 1 1 11 ALA HB3 H -4.892 8.169 1.469 1.00 . A X . 11 ALA HB3 1 1 4 1477 1 1 11 ALA N N -2.913 6.452 2.242 1.00 . A X . 11 ALA N 1 1 4 1478 1 1 11 ALA O O -5.042 5.372 -0.454 1.00 . A X . 11 ALA O 1 1 4 1479 1 1 12 LEU C C -1.490 5.688 -2.249 1.00 . A X . 12 LEU C 1 1 4 1480 1 1 12 LEU CA C -2.859 6.242 -1.894 1.00 . A X . 12 LEU CA 1 1 4 1481 1 1 12 LEU CB C -3.043 7.609 -2.556 1.00 . A X . 12 LEU CB 1 1 4 1482 1 1 12 LEU CD1 C -4.471 9.604 -3.052 1.00 . A X . 12 LEU CD1 1 1 4 1483 1 1 12 LEU CD2 C -5.453 7.311 -3.193 1.00 . A X . 12 LEU CD2 1 1 4 1484 1 1 12 LEU CG C -4.450 8.201 -2.469 1.00 . A X . 12 LEU CG 1 1 4 1485 1 1 12 LEU H H -2.292 6.720 0.088 1.00 . A X . 12 LEU H 1 1 4 1486 1 1 12 LEU HA H -3.618 5.569 -2.265 1.00 . A X . 12 LEU HA 1 1 4 1487 1 1 12 LEU HB2 H -2.353 8.303 -2.094 1.00 . A X . 12 LEU HB2 1 1 4 1488 1 1 12 LEU HB3 H -2.782 7.514 -3.598 1.00 . A X . 12 LEU HB3 1 1 4 1489 1 1 12 LEU HD11 H -5.469 10.010 -2.980 1.00 . A X . 12 LEU HD11 1 1 4 1490 1 1 12 LEU HD12 H -4.172 9.566 -4.089 1.00 . A X . 12 LEU HD12 1 1 4 1491 1 1 12 LEU HD13 H -3.786 10.233 -2.502 1.00 . A X . 12 LEU HD13 1 1 4 1492 1 1 12 LEU HD21 H -5.476 6.337 -2.726 1.00 . A X . 12 LEU HD21 1 1 4 1493 1 1 12 LEU HD22 H -5.159 7.207 -4.228 1.00 . A X . 12 LEU HD22 1 1 4 1494 1 1 12 LEU HD23 H -6.435 7.758 -3.141 1.00 . A X . 12 LEU HD23 1 1 4 1495 1 1 12 LEU HG H -4.745 8.265 -1.431 1.00 . A X . 12 LEU HG 1 1 4 1496 1 1 12 LEU N N -3.020 6.347 -0.450 1.00 . A X . 12 LEU N 1 1 4 1497 1 1 12 LEU O O -0.477 6.146 -1.727 1.00 . A X . 12 LEU O 1 1 4 1498 1 1 13 LEU C C 0.566 3.465 -2.514 1.00 . A X . 13 LEU C 1 1 4 1499 1 1 13 LEU CA C -0.234 4.109 -3.641 1.00 . A X . 13 LEU CA 1 1 4 1500 1 1 13 LEU CB C 0.633 5.153 -4.371 1.00 . A X . 13 LEU CB 1 1 4 1501 1 1 13 LEU CD1 C -1.113 6.429 -5.685 1.00 . A X . 13 LEU CD1 1 1 4 1502 1 1 13 LEU CD2 C 1.250 6.330 -6.495 1.00 . A X . 13 LEU CD2 1 1 4 1503 1 1 13 LEU CG C 0.148 5.579 -5.764 1.00 . A X . 13 LEU CG 1 1 4 1504 1 1 13 LEU H H -2.331 4.357 -3.478 1.00 . A X . 13 LEU H 1 1 4 1505 1 1 13 LEU HA H -0.507 3.336 -4.347 1.00 . A X . 13 LEU HA 1 1 4 1506 1 1 13 LEU HB2 H 0.687 6.036 -3.751 1.00 . A X . 13 LEU HB2 1 1 4 1507 1 1 13 LEU HB3 H 1.629 4.750 -4.473 1.00 . A X . 13 LEU HB3 1 1 4 1508 1 1 13 LEU HD11 H -1.880 5.887 -5.151 1.00 . A X . 13 LEU HD11 1 1 4 1509 1 1 13 LEU HD12 H -1.459 6.651 -6.683 1.00 . A X . 13 LEU HD12 1 1 4 1510 1 1 13 LEU HD13 H -0.895 7.350 -5.165 1.00 . A X . 13 LEU HD13 1 1 4 1511 1 1 13 LEU HD21 H 1.487 7.235 -5.955 1.00 . A X . 13 LEU HD21 1 1 4 1512 1 1 13 LEU HD22 H 0.917 6.582 -7.491 1.00 . A X . 13 LEU HD22 1 1 4 1513 1 1 13 LEU HD23 H 2.130 5.708 -6.556 1.00 . A X . 13 LEU HD23 1 1 4 1514 1 1 13 LEU HG H -0.086 4.695 -6.339 1.00 . A X . 13 LEU HG 1 1 4 1515 1 1 13 LEU N N -1.476 4.701 -3.142 1.00 . A X . 13 LEU N 1 1 4 1516 1 1 13 LEU O O 1.797 3.528 -2.492 1.00 . A X . 13 LEU O 1 1 4 1517 1 1 14 TRP C C 1.142 0.871 -0.937 1.00 . A X . 14 TRP C 1 1 4 1518 1 1 14 TRP CA C 0.520 2.173 -0.471 1.00 . A X . 14 TRP CA 1 1 4 1519 1 1 14 TRP CB C -0.468 1.939 0.683 1.00 . A X . 14 TRP CB 1 1 4 1520 1 1 14 TRP CD1 C -1.703 -0.306 0.709 1.00 . A X . 14 TRP CD1 1 1 4 1521 1 1 14 TRP CD2 C -2.777 1.314 -0.400 1.00 . A X . 14 TRP CD2 1 1 4 1522 1 1 14 TRP CE2 C -3.549 0.139 -0.461 1.00 . A X . 14 TRP CE2 1 1 4 1523 1 1 14 TRP CE3 C -3.257 2.469 -1.029 1.00 . A X . 14 TRP CE3 1 1 4 1524 1 1 14 TRP CG C -1.595 1.006 0.350 1.00 . A X . 14 TRP CG 1 1 4 1525 1 1 14 TRP CH2 C -5.216 1.233 -1.730 1.00 . A X . 14 TRP CH2 1 1 4 1526 1 1 14 TRP CZ2 C -4.771 0.088 -1.126 1.00 . A X . 14 TRP CZ2 1 1 4 1527 1 1 14 TRP CZ3 C -4.470 2.416 -1.685 1.00 . A X . 14 TRP CZ3 1 1 4 1528 1 1 14 TRP H H -1.096 2.698 -1.711 1.00 . A X . 14 TRP H 1 1 4 1529 1 1 14 TRP HA H 1.306 2.836 -0.135 1.00 . A X . 14 TRP HA 1 1 4 1530 1 1 14 TRP HB2 H 0.067 1.520 1.522 1.00 . A X . 14 TRP HB2 1 1 4 1531 1 1 14 TRP HB3 H -0.893 2.889 0.978 1.00 . A X . 14 TRP HB3 1 1 4 1532 1 1 14 TRP HD1 H -0.965 -0.837 1.287 1.00 . A X . 14 TRP HD1 1 1 4 1533 1 1 14 TRP HE1 H -3.178 -1.763 0.342 1.00 . A X . 14 TRP HE1 1 1 4 1534 1 1 14 TRP HE3 H -2.696 3.393 -1.007 1.00 . A X . 14 TRP HE3 1 1 4 1535 1 1 14 TRP HH2 H -6.161 1.239 -2.256 1.00 . A X . 14 TRP HH2 1 1 4 1536 1 1 14 TRP HZ2 H -5.360 -0.815 -1.169 1.00 . A X . 14 TRP HZ2 1 1 4 1537 1 1 14 TRP HZ3 H -4.857 3.299 -2.175 1.00 . A X . 14 TRP HZ3 1 1 4 1538 1 1 14 TRP N N -0.132 2.801 -1.601 1.00 . A X . 14 TRP N 1 1 4 1539 1 1 14 TRP NE1 N -2.872 -0.834 0.219 1.00 . A X . 14 TRP NE1 1 1 4 1540 1 1 14 TRP O O 2.099 0.371 -0.349 1.00 . A X . 14 TRP O 1 1 4 1541 1 1 15 LYS C C 2.175 -0.377 -3.753 1.00 . A X . 15 LYS C 1 1 4 1542 1 1 15 LYS CA C 1.193 -0.817 -2.670 1.00 . A X . 15 LYS CA 1 1 4 1543 1 1 15 LYS CB C 0.112 -1.733 -3.256 1.00 . A X . 15 LYS CB 1 1 4 1544 1 1 15 LYS CD C 0.056 -3.225 -1.224 1.00 . A X . 15 LYS CD 1 1 4 1545 1 1 15 LYS CE C -0.821 -3.908 -0.184 1.00 . A X . 15 LYS CE 1 1 4 1546 1 1 15 LYS CG C -0.767 -2.397 -2.204 1.00 . A X . 15 LYS CG 1 1 4 1547 1 1 15 LYS H H -0.203 0.746 -2.418 1.00 . A X . 15 LYS H 1 1 4 1548 1 1 15 LYS HA H 1.733 -1.355 -1.912 1.00 . A X . 15 LYS HA 1 1 4 1549 1 1 15 LYS HB2 H -0.523 -1.150 -3.906 1.00 . A X . 15 LYS HB2 1 1 4 1550 1 1 15 LYS HB3 H 0.590 -2.509 -3.838 1.00 . A X . 15 LYS HB3 1 1 4 1551 1 1 15 LYS HD2 H 0.599 -3.980 -1.773 1.00 . A X . 15 LYS HD2 1 1 4 1552 1 1 15 LYS HD3 H 0.757 -2.575 -0.720 1.00 . A X . 15 LYS HD3 1 1 4 1553 1 1 15 LYS HE2 H -0.185 -4.391 0.542 1.00 . A X . 15 LYS HE2 1 1 4 1554 1 1 15 LYS HE3 H -1.423 -3.157 0.311 1.00 . A X . 15 LYS HE3 1 1 4 1555 1 1 15 LYS HG2 H -1.295 -1.631 -1.657 1.00 . A X . 15 LYS HG2 1 1 4 1556 1 1 15 LYS HG3 H -1.477 -3.044 -2.699 1.00 . A X . 15 LYS HG3 1 1 4 1557 1 1 15 LYS HZ1 H -2.269 -5.409 -0.048 1.00 . A X . 15 LYS HZ1 1 1 4 1558 1 1 15 LYS HZ2 H -1.159 -5.639 -1.308 1.00 . A X . 15 LYS HZ2 1 1 4 1559 1 1 15 LYS HZ3 H -2.379 -4.475 -1.457 1.00 . A X . 15 LYS HZ3 1 1 4 1560 1 1 15 LYS N N 0.609 0.343 -2.033 1.00 . A X . 15 LYS N 1 1 4 1561 1 1 15 LYS NZ N -1.719 -4.926 -0.789 1.00 . A X . 15 LYS NZ 1 1 4 1562 1 1 15 LYS O O 2.529 -1.145 -4.649 1.00 . A X . 15 LYS O 1 1 4 1563 1 1 16 ALA C C 4.826 1.902 -3.870 1.00 . A X . 16 ALA C 1 1 4 1564 1 1 16 ALA CA C 3.584 1.404 -4.601 1.00 . A X . 16 ALA CA 1 1 4 1565 1 1 16 ALA CB C 2.971 2.520 -5.436 1.00 . A X . 16 ALA CB 1 1 4 1566 1 1 16 ALA H H 2.247 1.455 -2.964 1.00 . A X . 16 ALA H 1 1 4 1567 1 1 16 ALA HA H 3.872 0.605 -5.269 1.00 . A X . 16 ALA HA 1 1 4 1568 1 1 16 ALA HB1 H 2.075 2.157 -5.918 1.00 . A X . 16 ALA HB1 1 1 4 1569 1 1 16 ALA HB2 H 3.678 2.838 -6.186 1.00 . A X . 16 ALA HB2 1 1 4 1570 1 1 16 ALA HB3 H 2.723 3.354 -4.796 1.00 . A X . 16 ALA HB3 1 1 4 1571 1 1 16 ALA N N 2.607 0.872 -3.666 1.00 . A X . 16 ALA N 1 1 4 1572 1 1 16 ALA O O 5.946 1.550 -4.227 1.00 . A X . 16 ALA O 1 1 4 1573 1 1 17 LEU C C 6.239 2.358 -1.003 1.00 . A X . 17 LEU C 1 1 4 1574 1 1 17 LEU CA C 5.748 3.286 -2.104 1.00 . A X . 17 LEU CA 1 1 4 1575 1 1 17 LEU CB C 5.360 4.668 -1.545 1.00 . A X . 17 LEU CB 1 1 4 1576 1 1 17 LEU CD1 C 4.189 4.150 0.640 1.00 . A X . 17 LEU CD1 1 1 4 1577 1 1 17 LEU CD2 C 3.561 6.186 -0.665 1.00 . A X . 17 LEU CD2 1 1 4 1578 1 1 17 LEU CG C 4.043 4.745 -0.755 1.00 . A X . 17 LEU CG 1 1 4 1579 1 1 17 LEU H H 3.719 2.858 -2.503 1.00 . A X . 17 LEU H 1 1 4 1580 1 1 17 LEU HA H 6.550 3.416 -2.816 1.00 . A X . 17 LEU HA 1 1 4 1581 1 1 17 LEU HB2 H 6.156 5.001 -0.897 1.00 . A X . 17 LEU HB2 1 1 4 1582 1 1 17 LEU HB3 H 5.291 5.355 -2.376 1.00 . A X . 17 LEU HB3 1 1 4 1583 1 1 17 LEU HD11 H 3.255 4.251 1.174 1.00 . A X . 17 LEU HD11 1 1 4 1584 1 1 17 LEU HD12 H 4.968 4.673 1.175 1.00 . A X . 17 LEU HD12 1 1 4 1585 1 1 17 LEU HD13 H 4.447 3.104 0.560 1.00 . A X . 17 LEU HD13 1 1 4 1586 1 1 17 LEU HD21 H 2.655 6.226 -0.080 1.00 . A X . 17 LEU HD21 1 1 4 1587 1 1 17 LEU HD22 H 3.366 6.565 -1.658 1.00 . A X . 17 LEU HD22 1 1 4 1588 1 1 17 LEU HD23 H 4.322 6.790 -0.192 1.00 . A X . 17 LEU HD23 1 1 4 1589 1 1 17 LEU HG H 3.287 4.177 -1.281 1.00 . A X . 17 LEU HG 1 1 4 1590 1 1 17 LEU N N 4.629 2.687 -2.819 1.00 . A X . 17 LEU N 1 1 4 1591 1 1 17 LEU O O 7.247 2.624 -0.349 1.00 . A X . 17 LEU O 1 1 4 1592 1 1 18 ALA C C 6.246 -1.049 -0.488 1.00 . A X . 18 ALA C 1 1 4 1593 1 1 18 ALA CA C 5.910 0.282 0.179 1.00 . A X . 18 ALA CA 1 1 4 1594 1 1 18 ALA CB C 4.825 0.098 1.225 1.00 . A X . 18 ALA CB 1 1 4 1595 1 1 18 ALA H H 4.689 1.142 -1.311 1.00 . A X . 18 ALA H 1 1 4 1596 1 1 18 ALA HA H 6.787 0.663 0.669 1.00 . A X . 18 ALA HA 1 1 4 1597 1 1 18 ALA HB1 H 4.597 1.052 1.675 1.00 . A X . 18 ALA HB1 1 1 4 1598 1 1 18 ALA HB2 H 5.169 -0.587 1.988 1.00 . A X . 18 ALA HB2 1 1 4 1599 1 1 18 ALA HB3 H 3.936 -0.300 0.757 1.00 . A X . 18 ALA HB3 1 1 4 1600 1 1 18 ALA N N 5.513 1.271 -0.800 1.00 . A X . 18 ALA N 1 1 4 1601 1 1 18 ALA O O 7.177 -1.744 -0.081 1.00 . A X . 18 ALA O 1 1 4 1602 1 1 19 LEU C C 6.927 -2.644 -3.104 1.00 . A X . 19 LEU C 1 1 4 1603 1 1 19 LEU CA C 5.681 -2.668 -2.219 1.00 . A X . 19 LEU CA 1 1 4 1604 1 1 19 LEU CB C 4.441 -3.012 -3.050 1.00 . A X . 19 LEU CB 1 1 4 1605 1 1 19 LEU CD1 C 4.417 -5.480 -2.584 1.00 . A X . 19 LEU CD1 1 1 4 1606 1 1 19 LEU CD2 C 3.223 -4.579 -4.581 1.00 . A X . 19 LEU CD2 1 1 4 1607 1 1 19 LEU CG C 4.426 -4.414 -3.669 1.00 . A X . 19 LEU CG 1 1 4 1608 1 1 19 LEU H H 4.802 -0.778 -1.840 1.00 . A X . 19 LEU H 1 1 4 1609 1 1 19 LEU HA H 5.812 -3.429 -1.464 1.00 . A X . 19 LEU HA 1 1 4 1610 1 1 19 LEU HB2 H 3.572 -2.914 -2.417 1.00 . A X . 19 LEU HB2 1 1 4 1611 1 1 19 LEU HB3 H 4.363 -2.290 -3.850 1.00 . A X . 19 LEU HB3 1 1 4 1612 1 1 19 LEU HD11 H 3.539 -5.357 -1.967 1.00 . A X . 19 LEU HD11 1 1 4 1613 1 1 19 LEU HD12 H 5.303 -5.383 -1.974 1.00 . A X . 19 LEU HD12 1 1 4 1614 1 1 19 LEU HD13 H 4.400 -6.457 -3.042 1.00 . A X . 19 LEU HD13 1 1 4 1615 1 1 19 LEU HD21 H 3.264 -3.841 -5.370 1.00 . A X . 19 LEU HD21 1 1 4 1616 1 1 19 LEU HD22 H 2.317 -4.443 -4.009 1.00 . A X . 19 LEU HD22 1 1 4 1617 1 1 19 LEU HD23 H 3.231 -5.568 -5.013 1.00 . A X . 19 LEU HD23 1 1 4 1618 1 1 19 LEU HG H 5.319 -4.549 -4.262 1.00 . A X . 19 LEU HG 1 1 4 1619 1 1 19 LEU N N 5.496 -1.392 -1.531 1.00 . A X . 19 LEU N 1 1 4 1620 1 1 19 LEU O O 7.413 -3.683 -3.535 1.00 . A X . 19 LEU O 1 1 4 1621 1 1 20 LYS C C 9.882 -1.359 -3.172 1.00 . A X . 20 LYS C 1 1 4 1622 1 1 20 LYS CA C 8.692 -1.333 -4.122 1.00 . A X . 20 LYS CA 1 1 4 1623 1 1 20 LYS CB C 8.700 -0.060 -4.968 1.00 . A X . 20 LYS CB 1 1 4 1624 1 1 20 LYS CD C 7.758 1.159 -6.965 1.00 . A X . 20 LYS CD 1 1 4 1625 1 1 20 LYS CE C 6.794 1.075 -8.139 1.00 . A X . 20 LYS CE 1 1 4 1626 1 1 20 LYS CG C 7.717 -0.107 -6.124 1.00 . A X . 20 LYS CG 1 1 4 1627 1 1 20 LYS H H 6.978 -0.645 -3.083 1.00 . A X . 20 LYS H 1 1 4 1628 1 1 20 LYS HA H 8.761 -2.189 -4.779 1.00 . A X . 20 LYS HA 1 1 4 1629 1 1 20 LYS HB2 H 8.443 0.778 -4.337 1.00 . A X . 20 LYS HB2 1 1 4 1630 1 1 20 LYS HB3 H 9.691 0.091 -5.367 1.00 . A X . 20 LYS HB3 1 1 4 1631 1 1 20 LYS HD2 H 7.484 2.001 -6.349 1.00 . A X . 20 LYS HD2 1 1 4 1632 1 1 20 LYS HD3 H 8.760 1.296 -7.343 1.00 . A X . 20 LYS HD3 1 1 4 1633 1 1 20 LYS HE2 H 5.791 0.952 -7.757 1.00 . A X . 20 LYS HE2 1 1 4 1634 1 1 20 LYS HE3 H 6.854 1.993 -8.706 1.00 . A X . 20 LYS HE3 1 1 4 1635 1 1 20 LYS HG2 H 7.961 -0.950 -6.753 1.00 . A X . 20 LYS HG2 1 1 4 1636 1 1 20 LYS HG3 H 6.721 -0.232 -5.725 1.00 . A X . 20 LYS HG3 1 1 4 1637 1 1 20 LYS HZ1 H 8.063 0.054 -9.445 1.00 . A X . 20 LYS HZ1 1 1 4 1638 1 1 20 LYS HZ2 H 6.418 -0.127 -9.808 1.00 . A X . 20 LYS HZ2 1 1 4 1639 1 1 20 LYS HZ3 H 7.092 -0.963 -8.498 1.00 . A X . 20 LYS HZ3 1 1 4 1640 1 1 20 LYS N N 7.445 -1.454 -3.376 1.00 . A X . 20 LYS N 1 1 4 1641 1 1 20 LYS NZ N 7.113 -0.068 -9.033 1.00 . A X . 20 LYS NZ 1 1 4 1642 1 1 20 LYS O O 11.034 -1.443 -3.599 1.00 . A X . 20 LYS O 1 1 4 1643 1 1 21 LEU C C 10.721 -2.883 -0.452 1.00 . A X . 21 LEU C 1 1 4 1644 1 1 21 LEU CA C 10.610 -1.418 -0.854 1.00 . A X . 21 LEU CA 1 1 4 1645 1 1 21 LEU CB C 10.251 -0.551 0.359 1.00 . A X . 21 LEU CB 1 1 4 1646 1 1 21 LEU CD1 C 12.619 -0.030 0.989 1.00 . A X . 21 LEU CD1 1 1 4 1647 1 1 21 LEU CD2 C 10.779 0.287 2.661 1.00 . A X . 21 LEU CD2 1 1 4 1648 1 1 21 LEU CG C 11.280 -0.547 1.490 1.00 . A X . 21 LEU CG 1 1 4 1649 1 1 21 LEU H H 8.662 -1.162 -1.611 1.00 . A X . 21 LEU H 1 1 4 1650 1 1 21 LEU HA H 11.553 -1.088 -1.267 1.00 . A X . 21 LEU HA 1 1 4 1651 1 1 21 LEU HB2 H 10.119 0.466 0.018 1.00 . A X . 21 LEU HB2 1 1 4 1652 1 1 21 LEU HB3 H 9.312 -0.902 0.759 1.00 . A X . 21 LEU HB3 1 1 4 1653 1 1 21 LEU HD11 H 13.330 -0.019 1.802 1.00 . A X . 21 LEU HD11 1 1 4 1654 1 1 21 LEU HD12 H 12.498 0.972 0.603 1.00 . A X . 21 LEU HD12 1 1 4 1655 1 1 21 LEU HD13 H 12.982 -0.676 0.203 1.00 . A X . 21 LEU HD13 1 1 4 1656 1 1 21 LEU HD21 H 9.881 -0.159 3.064 1.00 . A X . 21 LEU HD21 1 1 4 1657 1 1 21 LEU HD22 H 10.562 1.290 2.324 1.00 . A X . 21 LEU HD22 1 1 4 1658 1 1 21 LEU HD23 H 11.538 0.323 3.431 1.00 . A X . 21 LEU HD23 1 1 4 1659 1 1 21 LEU HG H 11.424 -1.560 1.838 1.00 . A X . 21 LEU HG 1 1 4 1660 1 1 21 LEU N N 9.592 -1.290 -1.881 1.00 . A X . 21 LEU N 1 1 4 1661 1 1 21 LEU O O 11.815 -3.413 -0.249 1.00 . A X . 21 LEU O 1 1 4 1662 1 1 22 LYS C C 8.718 -5.612 -1.269 1.00 . A X . 22 LYS C 1 1 4 1663 1 1 22 LYS CA C 9.502 -4.968 -0.137 1.00 . A X . 22 LYS CA 1 1 4 1664 1 1 22 LYS CB C 8.843 -5.290 1.205 1.00 . A X . 22 LYS CB 1 1 4 1665 1 1 22 LYS CD C 9.048 -5.373 3.713 1.00 . A X . 22 LYS CD 1 1 4 1666 1 1 22 LYS CE C 8.814 -6.879 3.720 1.00 . A X . 22 LYS CE 1 1 4 1667 1 1 22 LYS CG C 9.685 -4.906 2.411 1.00 . A X . 22 LYS CG 1 1 4 1668 1 1 22 LYS H H 8.731 -3.023 -0.420 1.00 . A X . 22 LYS H 1 1 4 1669 1 1 22 LYS HA H 10.511 -5.356 -0.144 1.00 . A X . 22 LYS HA 1 1 4 1670 1 1 22 LYS HB2 H 7.904 -4.760 1.268 1.00 . A X . 22 LYS HB2 1 1 4 1671 1 1 22 LYS HB3 H 8.651 -6.353 1.251 1.00 . A X . 22 LYS HB3 1 1 4 1672 1 1 22 LYS HD2 H 9.704 -5.119 4.533 1.00 . A X . 22 LYS HD2 1 1 4 1673 1 1 22 LYS HD3 H 8.101 -4.870 3.839 1.00 . A X . 22 LYS HD3 1 1 4 1674 1 1 22 LYS HE2 H 8.414 -7.165 4.681 1.00 . A X . 22 LYS HE2 1 1 4 1675 1 1 22 LYS HE3 H 8.099 -7.122 2.947 1.00 . A X . 22 LYS HE3 1 1 4 1676 1 1 22 LYS HG2 H 10.659 -5.362 2.319 1.00 . A X . 22 LYS HG2 1 1 4 1677 1 1 22 LYS HG3 H 9.789 -3.831 2.439 1.00 . A X . 22 LYS HG3 1 1 4 1678 1 1 22 LYS HZ1 H 10.817 -7.321 4.127 1.00 . A X . 22 LYS HZ1 1 1 4 1679 1 1 22 LYS HZ2 H 10.388 -7.505 2.495 1.00 . A X . 22 LYS HZ2 1 1 4 1680 1 1 22 LYS HZ3 H 9.902 -8.659 3.633 1.00 . A X . 22 LYS HZ3 1 1 4 1681 1 1 22 LYS N N 9.569 -3.532 -0.351 1.00 . A X . 22 LYS N 1 1 4 1682 1 1 22 LYS NZ N 10.066 -7.643 3.475 1.00 . A X . 22 LYS NZ 1 1 4 1683 1 1 22 LYS O O 7.517 -5.851 -1.144 1.00 . A X . 22 LYS O 1 1 4 1684 1 1 23 LYS C C 8.275 -7.831 -3.360 1.00 . A X . 23 LYS C 1 1 4 1685 1 1 23 LYS CA C 8.741 -6.396 -3.565 1.00 . A X . 23 LYS CA 1 1 4 1686 1 1 23 LYS CB C 9.664 -6.319 -4.787 1.00 . A X . 23 LYS CB 1 1 4 1687 1 1 23 LYS CD C 10.631 -4.816 -6.553 1.00 . A X . 23 LYS CD 1 1 4 1688 1 1 23 LYS CE C 11.258 -3.462 -6.863 1.00 . A X . 23 LYS CE 1 1 4 1689 1 1 23 LYS CG C 10.147 -4.912 -5.112 1.00 . A X . 23 LYS CG 1 1 4 1690 1 1 23 LYS H H 10.368 -5.722 -2.393 1.00 . A X . 23 LYS H 1 1 4 1691 1 1 23 LYS HA H 7.875 -5.780 -3.748 1.00 . A X . 23 LYS HA 1 1 4 1692 1 1 23 LYS HB2 H 10.530 -6.940 -4.607 1.00 . A X . 23 LYS HB2 1 1 4 1693 1 1 23 LYS HB3 H 9.133 -6.702 -5.647 1.00 . A X . 23 LYS HB3 1 1 4 1694 1 1 23 LYS HD2 H 11.368 -5.584 -6.725 1.00 . A X . 23 LYS HD2 1 1 4 1695 1 1 23 LYS HD3 H 9.788 -4.971 -7.213 1.00 . A X . 23 LYS HD3 1 1 4 1696 1 1 23 LYS HE2 H 11.330 -3.351 -7.935 1.00 . A X . 23 LYS HE2 1 1 4 1697 1 1 23 LYS HE3 H 10.622 -2.686 -6.464 1.00 . A X . 23 LYS HE3 1 1 4 1698 1 1 23 LYS HG2 H 9.332 -4.219 -4.971 1.00 . A X . 23 LYS HG2 1 1 4 1699 1 1 23 LYS HG3 H 10.963 -4.657 -4.450 1.00 . A X . 23 LYS HG3 1 1 4 1700 1 1 23 LYS HZ1 H 12.566 -3.386 -5.230 1.00 . A X . 23 LYS HZ1 1 1 4 1701 1 1 23 LYS HZ2 H 13.035 -2.409 -6.536 1.00 . A X . 23 LYS HZ2 1 1 4 1702 1 1 23 LYS HZ3 H 13.234 -4.091 -6.622 1.00 . A X . 23 LYS HZ3 1 1 4 1703 1 1 23 LYS N N 9.399 -5.876 -2.376 1.00 . A X . 23 LYS N 1 1 4 1704 1 1 23 LYS NZ N 12.615 -3.329 -6.270 1.00 . A X . 23 LYS NZ 1 1 4 1705 1 1 23 LYS O O 8.936 -8.626 -2.683 1.00 . A X . 23 LYS O 1 1 4 1706 1 1 24 ALA C C 6.678 -10.156 -5.249 1.00 . A X . 24 ALA C 1 1 4 1707 1 1 24 ALA CA C 6.582 -9.490 -3.884 1.00 . A X . 24 ALA CA 1 1 4 1708 1 1 24 ALA CB C 5.137 -9.452 -3.403 1.00 . A X . 24 ALA CB 1 1 4 1709 1 1 24 ALA H H 6.653 -7.461 -4.453 1.00 . A X . 24 ALA H 1 1 4 1710 1 1 24 ALA HA H 7.163 -10.060 -3.171 1.00 . A X . 24 ALA HA 1 1 4 1711 1 1 24 ALA HB1 H 5.088 -8.958 -2.444 1.00 . A X . 24 ALA HB1 1 1 4 1712 1 1 24 ALA HB2 H 4.762 -10.462 -3.306 1.00 . A X . 24 ALA HB2 1 1 4 1713 1 1 24 ALA HB3 H 4.534 -8.912 -4.116 1.00 . A X . 24 ALA HB3 1 1 4 1714 1 1 24 ALA N N 7.134 -8.150 -3.948 1.00 . A X . 24 ALA N 1 1 4 1715 1 1 24 ALA O O 5.840 -9.845 -6.125 1.00 . A X . 24 ALA O 1 1 4 1716 1 1 24 ALA OXT O 7.601 -10.974 -5.450 1.00 . A X . 24 ALA OXT 1 1 5 1717 1 1 1 LYS C C 15.127 13.698 2.889 1.00 . A X . 1 LYS C 1 1 5 1718 1 1 1 LYS CA C 15.496 14.775 3.904 1.00 . A X . 1 LYS CA 1 1 5 1719 1 1 1 LYS CB C 16.879 14.514 4.518 1.00 . A X . 1 LYS CB 1 1 5 1720 1 1 1 LYS CD C 18.310 13.108 6.055 1.00 . A X . 1 LYS CD 1 1 5 1721 1 1 1 LYS CE C 19.537 13.013 5.149 1.00 . A X . 1 LYS CE 1 1 5 1722 1 1 1 LYS CG C 16.996 13.206 5.284 1.00 . A X . 1 LYS CG 1 1 5 1723 1 1 1 LYS H1 H 14.747 15.504 5.709 1.00 . A X . 1 LYS H1 1 1 5 1724 1 1 1 LYS H2 H 14.308 13.898 5.378 1.00 . A X . 1 LYS H2 1 1 5 1725 1 1 1 LYS H3 H 13.561 15.173 4.547 1.00 . A X . 1 LYS H3 1 1 5 1726 1 1 1 LYS HA H 15.512 15.731 3.396 1.00 . A X . 1 LYS HA 1 1 5 1727 1 1 1 LYS HB2 H 17.611 14.504 3.725 1.00 . A X . 1 LYS HB2 1 1 5 1728 1 1 1 LYS HB3 H 17.114 15.322 5.197 1.00 . A X . 1 LYS HB3 1 1 5 1729 1 1 1 LYS HD2 H 18.410 13.987 6.675 1.00 . A X . 1 LYS HD2 1 1 5 1730 1 1 1 LYS HD3 H 18.273 12.231 6.687 1.00 . A X . 1 LYS HD3 1 1 5 1731 1 1 1 LYS HE2 H 20.364 12.635 5.731 1.00 . A X . 1 LYS HE2 1 1 5 1732 1 1 1 LYS HE3 H 19.321 12.320 4.349 1.00 . A X . 1 LYS HE3 1 1 5 1733 1 1 1 LYS HG2 H 16.176 13.139 5.984 1.00 . A X . 1 LYS HG2 1 1 5 1734 1 1 1 LYS HG3 H 16.940 12.386 4.583 1.00 . A X . 1 LYS HG3 1 1 5 1735 1 1 1 LYS HZ1 H 19.887 15.073 5.286 1.00 . A X . 1 LYS HZ1 1 1 5 1736 1 1 1 LYS HZ2 H 19.292 14.579 3.775 1.00 . A X . 1 LYS HZ2 1 1 5 1737 1 1 1 LYS HZ3 H 20.906 14.272 4.193 1.00 . A X . 1 LYS HZ3 1 1 5 1738 1 1 1 LYS N N 14.461 14.841 4.959 1.00 . A X . 1 LYS N 1 1 5 1739 1 1 1 LYS NZ N 19.929 14.325 4.561 1.00 . A X . 1 LYS NZ 1 1 5 1740 1 1 1 LYS O O 14.774 12.581 3.270 1.00 . A X . 1 LYS O 1 1 5 1741 1 1 2 LYS C C 13.204 13.093 0.534 1.00 . A X . 2 LYS C 1 1 5 1742 1 1 2 LYS CA C 14.728 13.187 0.517 1.00 . A X . 2 LYS CA 1 1 5 1743 1 1 2 LYS CB C 15.335 11.777 0.583 1.00 . A X . 2 LYS CB 1 1 5 1744 1 1 2 LYS CD C 17.087 12.244 -1.159 1.00 . A X . 2 LYS CD 1 1 5 1745 1 1 2 LYS CE C 18.511 11.953 -1.602 1.00 . A X . 2 LYS CE 1 1 5 1746 1 1 2 LYS CG C 16.815 11.723 0.246 1.00 . A X . 2 LYS CG 1 1 5 1747 1 1 2 LYS H H 15.574 14.932 1.379 1.00 . A X . 2 LYS H 1 1 5 1748 1 1 2 LYS HA H 15.029 13.649 -0.413 1.00 . A X . 2 LYS HA 1 1 5 1749 1 1 2 LYS HB2 H 15.199 11.389 1.581 1.00 . A X . 2 LYS HB2 1 1 5 1750 1 1 2 LYS HB3 H 14.807 11.140 -0.113 1.00 . A X . 2 LYS HB3 1 1 5 1751 1 1 2 LYS HD2 H 16.404 11.768 -1.846 1.00 . A X . 2 LYS HD2 1 1 5 1752 1 1 2 LYS HD3 H 16.927 13.313 -1.175 1.00 . A X . 2 LYS HD3 1 1 5 1753 1 1 2 LYS HE2 H 18.700 12.470 -2.532 1.00 . A X . 2 LYS HE2 1 1 5 1754 1 1 2 LYS HE3 H 19.193 12.314 -0.847 1.00 . A X . 2 LYS HE3 1 1 5 1755 1 1 2 LYS HG2 H 17.358 12.331 0.956 1.00 . A X . 2 LYS HG2 1 1 5 1756 1 1 2 LYS HG3 H 17.152 10.699 0.314 1.00 . A X . 2 LYS HG3 1 1 5 1757 1 1 2 LYS HZ1 H 19.709 10.326 -2.145 1.00 . A X . 2 LYS HZ1 1 1 5 1758 1 1 2 LYS HZ2 H 18.063 10.123 -2.509 1.00 . A X . 2 LYS HZ2 1 1 5 1759 1 1 2 LYS HZ3 H 18.600 9.983 -0.908 1.00 . A X . 2 LYS HZ3 1 1 5 1760 1 1 2 LYS N N 15.201 14.049 1.606 1.00 . A X . 2 LYS N 1 1 5 1761 1 1 2 LYS NZ N 18.737 10.497 -1.803 1.00 . A X . 2 LYS NZ 1 1 5 1762 1 1 2 LYS O O 12.528 13.660 -0.322 1.00 . A X . 2 LYS O 1 1 5 1763 1 1 3 LEU C C 10.871 12.405 3.156 1.00 . A X . 3 LEU C 1 1 5 1764 1 1 3 LEU CA C 11.237 12.235 1.688 1.00 . A X . 3 LEU CA 1 1 5 1765 1 1 3 LEU CB C 10.773 10.864 1.180 1.00 . A X . 3 LEU CB 1 1 5 1766 1 1 3 LEU CD1 C 10.581 9.197 -0.681 1.00 . A X . 3 LEU CD1 1 1 5 1767 1 1 3 LEU CD2 C 10.067 11.601 -1.113 1.00 . A X . 3 LEU CD2 1 1 5 1768 1 1 3 LEU CG C 10.935 10.631 -0.326 1.00 . A X . 3 LEU CG 1 1 5 1769 1 1 3 LEU H H 13.273 11.948 2.166 1.00 . A X . 3 LEU H 1 1 5 1770 1 1 3 LEU HA H 10.752 13.010 1.114 1.00 . A X . 3 LEU HA 1 1 5 1771 1 1 3 LEU HB2 H 11.336 10.105 1.703 1.00 . A X . 3 LEU HB2 1 1 5 1772 1 1 3 LEU HB3 H 9.729 10.748 1.428 1.00 . A X . 3 LEU HB3 1 1 5 1773 1 1 3 LEU HD11 H 9.559 8.996 -0.392 1.00 . A X . 3 LEU HD11 1 1 5 1774 1 1 3 LEU HD12 H 11.242 8.521 -0.159 1.00 . A X . 3 LEU HD12 1 1 5 1775 1 1 3 LEU HD13 H 10.687 9.052 -1.747 1.00 . A X . 3 LEU HD13 1 1 5 1776 1 1 3 LEU HD21 H 10.352 12.616 -0.876 1.00 . A X . 3 LEU HD21 1 1 5 1777 1 1 3 LEU HD22 H 9.030 11.450 -0.851 1.00 . A X . 3 LEU HD22 1 1 5 1778 1 1 3 LEU HD23 H 10.200 11.428 -2.170 1.00 . A X . 3 LEU HD23 1 1 5 1779 1 1 3 LEU HG H 11.967 10.801 -0.603 1.00 . A X . 3 LEU HG 1 1 5 1780 1 1 3 LEU N N 12.674 12.382 1.519 1.00 . A X . 3 LEU N 1 1 5 1781 1 1 3 LEU O O 11.109 11.517 3.976 1.00 . A X . 3 LEU O 1 1 5 1782 1 1 4 LYS C C 8.613 13.141 5.190 1.00 . A X . 4 LYS C 1 1 5 1783 1 1 4 LYS CA C 9.919 13.849 4.857 1.00 . A X . 4 LYS CA 1 1 5 1784 1 1 4 LYS CB C 9.758 15.356 5.063 1.00 . A X . 4 LYS CB 1 1 5 1785 1 1 4 LYS CD C 8.862 17.155 6.568 1.00 . A X . 4 LYS CD 1 1 5 1786 1 1 4 LYS CE C 7.524 17.236 5.848 1.00 . A X . 4 LYS CE 1 1 5 1787 1 1 4 LYS CG C 9.437 15.751 6.495 1.00 . A X . 4 LYS CG 1 1 5 1788 1 1 4 LYS H H 10.194 14.249 2.796 1.00 . A X . 4 LYS H 1 1 5 1789 1 1 4 LYS HA H 10.692 13.483 5.516 1.00 . A X . 4 LYS HA 1 1 5 1790 1 1 4 LYS HB2 H 10.676 15.846 4.776 1.00 . A X . 4 LYS HB2 1 1 5 1791 1 1 4 LYS HB3 H 8.958 15.710 4.428 1.00 . A X . 4 LYS HB3 1 1 5 1792 1 1 4 LYS HD2 H 8.721 17.424 7.606 1.00 . A X . 4 LYS HD2 1 1 5 1793 1 1 4 LYS HD3 H 9.553 17.843 6.105 1.00 . A X . 4 LYS HD3 1 1 5 1794 1 1 4 LYS HE2 H 7.674 16.984 4.809 1.00 . A X . 4 LYS HE2 1 1 5 1795 1 1 4 LYS HE3 H 6.846 16.524 6.295 1.00 . A X . 4 LYS HE3 1 1 5 1796 1 1 4 LYS HG2 H 8.717 15.054 6.898 1.00 . A X . 4 LYS HG2 1 1 5 1797 1 1 4 LYS HG3 H 10.344 15.713 7.082 1.00 . A X . 4 LYS HG3 1 1 5 1798 1 1 4 LYS HZ1 H 7.569 19.296 5.510 1.00 . A X . 4 LYS HZ1 1 1 5 1799 1 1 4 LYS HZ2 H 6.742 18.847 6.921 1.00 . A X . 4 LYS HZ2 1 1 5 1800 1 1 4 LYS HZ3 H 6.020 18.611 5.408 1.00 . A X . 4 LYS HZ3 1 1 5 1801 1 1 4 LYS N N 10.322 13.561 3.490 1.00 . A X . 4 LYS N 1 1 5 1802 1 1 4 LYS NZ N 6.923 18.591 5.928 1.00 . A X . 4 LYS NZ 1 1 5 1803 1 1 4 LYS O O 8.590 12.211 5.997 1.00 . A X . 4 LYS O 1 1 5 1804 1 1 5 LEU C C 5.196 13.610 3.821 1.00 . A X . 5 LEU C 1 1 5 1805 1 1 5 LEU CA C 6.212 13.004 4.783 1.00 . A X . 5 LEU CA 1 1 5 1806 1 1 5 LEU CB C 5.757 13.242 6.228 1.00 . A X . 5 LEU CB 1 1 5 1807 1 1 5 LEU CD1 C 4.516 11.072 6.480 1.00 . A X . 5 LEU CD1 1 1 5 1808 1 1 5 LEU CD2 C 4.020 12.975 8.018 1.00 . A X . 5 LEU CD2 1 1 5 1809 1 1 5 LEU CG C 4.425 12.585 6.606 1.00 . A X . 5 LEU CG 1 1 5 1810 1 1 5 LEU H H 7.620 14.320 3.908 1.00 . A X . 5 LEU H 1 1 5 1811 1 1 5 LEU HA H 6.279 11.941 4.603 1.00 . A X . 5 LEU HA 1 1 5 1812 1 1 5 LEU HB2 H 6.524 12.866 6.891 1.00 . A X . 5 LEU HB2 1 1 5 1813 1 1 5 LEU HB3 H 5.663 14.306 6.381 1.00 . A X . 5 LEU HB3 1 1 5 1814 1 1 5 LEU HD11 H 5.311 10.706 7.112 1.00 . A X . 5 LEU HD11 1 1 5 1815 1 1 5 LEU HD12 H 4.722 10.807 5.453 1.00 . A X . 5 LEU HD12 1 1 5 1816 1 1 5 LEU HD13 H 3.578 10.628 6.785 1.00 . A X . 5 LEU HD13 1 1 5 1817 1 1 5 LEU HD21 H 4.775 12.642 8.713 1.00 . A X . 5 LEU HD21 1 1 5 1818 1 1 5 LEU HD22 H 3.076 12.509 8.260 1.00 . A X . 5 LEU HD22 1 1 5 1819 1 1 5 LEU HD23 H 3.918 14.048 8.080 1.00 . A X . 5 LEU HD23 1 1 5 1820 1 1 5 LEU HG H 3.657 12.930 5.930 1.00 . A X . 5 LEU HG 1 1 5 1821 1 1 5 LEU N N 7.530 13.581 4.555 1.00 . A X . 5 LEU N 1 1 5 1822 1 1 5 LEU O O 4.843 14.783 3.939 1.00 . A X . 5 LEU O 1 1 5 1823 1 1 6 ALA C C 3.031 12.070 1.274 1.00 . A X . 6 ALA C 1 1 5 1824 1 1 6 ALA CA C 3.759 13.259 1.888 1.00 . A X . 6 ALA CA 1 1 5 1825 1 1 6 ALA CB C 4.428 14.095 0.803 1.00 . A X . 6 ALA CB 1 1 5 1826 1 1 6 ALA H H 5.059 11.886 2.831 1.00 . A X . 6 ALA H 1 1 5 1827 1 1 6 ALA HA H 3.037 13.880 2.398 1.00 . A X . 6 ALA HA 1 1 5 1828 1 1 6 ALA HB1 H 3.683 14.433 0.097 1.00 . A X . 6 ALA HB1 1 1 5 1829 1 1 6 ALA HB2 H 5.166 13.497 0.291 1.00 . A X . 6 ALA HB2 1 1 5 1830 1 1 6 ALA HB3 H 4.909 14.952 1.255 1.00 . A X . 6 ALA HB3 1 1 5 1831 1 1 6 ALA N N 4.739 12.807 2.869 1.00 . A X . 6 ALA N 1 1 5 1832 1 1 6 ALA O O 1.810 12.072 1.154 1.00 . A X . 6 ALA O 1 1 5 1833 1 1 7 LEU C C 2.676 8.937 1.426 1.00 . A X . 7 LEU C 1 1 5 1834 1 1 7 LEU CA C 3.228 9.836 0.326 1.00 . A X . 7 LEU CA 1 1 5 1835 1 1 7 LEU CB C 4.294 9.099 -0.483 1.00 . A X . 7 LEU CB 1 1 5 1836 1 1 7 LEU CD1 C 5.941 9.067 -2.369 1.00 . A X . 7 LEU CD1 1 1 5 1837 1 1 7 LEU CD2 C 3.740 10.207 -2.665 1.00 . A X . 7 LEU CD2 1 1 5 1838 1 1 7 LEU CG C 4.850 9.870 -1.682 1.00 . A X . 7 LEU CG 1 1 5 1839 1 1 7 LEU H H 4.750 11.110 1.021 1.00 . A X . 7 LEU H 1 1 5 1840 1 1 7 LEU HA H 2.419 10.123 -0.329 1.00 . A X . 7 LEU HA 1 1 5 1841 1 1 7 LEU HB2 H 5.114 8.865 0.179 1.00 . A X . 7 LEU HB2 1 1 5 1842 1 1 7 LEU HB3 H 3.866 8.173 -0.842 1.00 . A X . 7 LEU HB3 1 1 5 1843 1 1 7 LEU HD11 H 5.538 8.123 -2.704 1.00 . A X . 7 LEU HD11 1 1 5 1844 1 1 7 LEU HD12 H 6.748 8.887 -1.673 1.00 . A X . 7 LEU HD12 1 1 5 1845 1 1 7 LEU HD13 H 6.315 9.622 -3.218 1.00 . A X . 7 LEU HD13 1 1 5 1846 1 1 7 LEU HD21 H 2.988 10.802 -2.170 1.00 . A X . 7 LEU HD21 1 1 5 1847 1 1 7 LEU HD22 H 3.294 9.293 -3.031 1.00 . A X . 7 LEU HD22 1 1 5 1848 1 1 7 LEU HD23 H 4.153 10.763 -3.494 1.00 . A X . 7 LEU HD23 1 1 5 1849 1 1 7 LEU HG H 5.284 10.798 -1.335 1.00 . A X . 7 LEU HG 1 1 5 1850 1 1 7 LEU N N 3.789 11.050 0.904 1.00 . A X . 7 LEU N 1 1 5 1851 1 1 7 LEU O O 3.220 7.872 1.713 1.00 . A X . 7 LEU O 1 1 5 1852 1 1 8 ALA C C -0.407 9.283 3.402 1.00 . A X . 8 ALA C 1 1 5 1853 1 1 8 ALA CA C 0.956 8.675 3.126 1.00 . A X . 8 ALA CA 1 1 5 1854 1 1 8 ALA CB C 1.809 8.698 4.390 1.00 . A X . 8 ALA CB 1 1 5 1855 1 1 8 ALA H H 1.234 10.261 1.761 1.00 . A X . 8 ALA H 1 1 5 1856 1 1 8 ALA HA H 0.830 7.648 2.816 1.00 . A X . 8 ALA HA 1 1 5 1857 1 1 8 ALA HB1 H 1.310 8.143 5.171 1.00 . A X . 8 ALA HB1 1 1 5 1858 1 1 8 ALA HB2 H 1.953 9.721 4.712 1.00 . A X . 8 ALA HB2 1 1 5 1859 1 1 8 ALA HB3 H 2.769 8.248 4.185 1.00 . A X . 8 ALA HB3 1 1 5 1860 1 1 8 ALA N N 1.606 9.399 2.047 1.00 . A X . 8 ALA N 1 1 5 1861 1 1 8 ALA O O -1.412 8.583 3.464 1.00 . A X . 8 ALA O 1 1 5 1862 1 1 9 LYS C C -2.733 11.114 2.761 1.00 . A X . 9 LYS C 1 1 5 1863 1 1 9 LYS CA C -1.654 11.334 3.831 1.00 . A X . 9 LYS CA 1 1 5 1864 1 1 9 LYS CB C -1.359 12.829 4.003 1.00 . A X . 9 LYS CB 1 1 5 1865 1 1 9 LYS CD C -1.251 12.769 6.508 1.00 . A X . 9 LYS CD 1 1 5 1866 1 1 9 LYS CE C -2.490 13.628 6.725 1.00 . A X . 9 LYS CE 1 1 5 1867 1 1 9 LYS CG C -0.520 13.150 5.231 1.00 . A X . 9 LYS CG 1 1 5 1868 1 1 9 LYS H H 0.410 11.109 3.429 1.00 . A X . 9 LYS H 1 1 5 1869 1 1 9 LYS HA H -2.030 10.952 4.768 1.00 . A X . 9 LYS HA 1 1 5 1870 1 1 9 LYS HB2 H -0.829 13.181 3.130 1.00 . A X . 9 LYS HB2 1 1 5 1871 1 1 9 LYS HB3 H -2.295 13.362 4.084 1.00 . A X . 9 LYS HB3 1 1 5 1872 1 1 9 LYS HD2 H -1.552 11.735 6.440 1.00 . A X . 9 LYS HD2 1 1 5 1873 1 1 9 LYS HD3 H -0.582 12.897 7.346 1.00 . A X . 9 LYS HD3 1 1 5 1874 1 1 9 LYS HE2 H -2.179 14.624 7.001 1.00 . A X . 9 LYS HE2 1 1 5 1875 1 1 9 LYS HE3 H -3.048 13.668 5.802 1.00 . A X . 9 LYS HE3 1 1 5 1876 1 1 9 LYS HG2 H 0.408 12.598 5.179 1.00 . A X . 9 LYS HG2 1 1 5 1877 1 1 9 LYS HG3 H -0.311 14.210 5.246 1.00 . A X . 9 LYS HG3 1 1 5 1878 1 1 9 LYS HZ1 H -4.073 13.795 8.079 1.00 . A X . 9 LYS HZ1 1 1 5 1879 1 1 9 LYS HZ2 H -2.797 12.817 8.627 1.00 . A X . 9 LYS HZ2 1 1 5 1880 1 1 9 LYS HZ3 H -3.863 12.234 7.446 1.00 . A X . 9 LYS HZ3 1 1 5 1881 1 1 9 LYS N N -0.426 10.606 3.533 1.00 . A X . 9 LYS N 1 1 5 1882 1 1 9 LYS NZ N -3.365 13.083 7.794 1.00 . A X . 9 LYS NZ 1 1 5 1883 1 1 9 LYS O O -3.848 10.717 3.093 1.00 . A X . 9 LYS O 1 1 5 1884 1 1 10 PRO C C -3.627 9.708 -0.004 1.00 . A X . 10 PRO C 1 1 5 1885 1 1 10 PRO CA C -3.444 11.167 0.408 1.00 . A X . 10 PRO CA 1 1 5 1886 1 1 10 PRO CB C -2.876 11.973 -0.755 1.00 . A X . 10 PRO CB 1 1 5 1887 1 1 10 PRO CD C -1.160 11.854 0.909 1.00 . A X . 10 PRO CD 1 1 5 1888 1 1 10 PRO CG C -1.400 11.881 -0.580 1.00 . A X . 10 PRO CG 1 1 5 1889 1 1 10 PRO HA H -4.400 11.577 0.697 1.00 . A X . 10 PRO HA 1 1 5 1890 1 1 10 PRO HB2 H -3.195 11.537 -1.690 1.00 . A X . 10 PRO HB2 1 1 5 1891 1 1 10 PRO HB3 H -3.218 12.995 -0.689 1.00 . A X . 10 PRO HB3 1 1 5 1892 1 1 10 PRO HD2 H -0.336 11.188 1.148 1.00 . A X . 10 PRO HD2 1 1 5 1893 1 1 10 PRO HD3 H -0.954 12.851 1.271 1.00 . A X . 10 PRO HD3 1 1 5 1894 1 1 10 PRO HG2 H -1.031 10.971 -1.034 1.00 . A X . 10 PRO HG2 1 1 5 1895 1 1 10 PRO HG3 H -0.922 12.741 -1.020 1.00 . A X . 10 PRO HG3 1 1 5 1896 1 1 10 PRO N N -2.440 11.351 1.462 1.00 . A X . 10 PRO N 1 1 5 1897 1 1 10 PRO O O -4.491 9.392 -0.827 1.00 . A X . 10 PRO O 1 1 5 1898 1 1 11 ALA C C -2.485 7.206 -1.236 1.00 . A X . 11 ALA C 1 1 5 1899 1 1 11 ALA CA C -2.811 7.402 0.242 1.00 . A X . 11 ALA CA 1 1 5 1900 1 1 11 ALA CB C -4.142 6.752 0.599 1.00 . A X . 11 ALA CB 1 1 5 1901 1 1 11 ALA H H -2.214 9.142 1.294 1.00 . A X . 11 ALA H 1 1 5 1902 1 1 11 ALA HA H -2.039 6.926 0.829 1.00 . A X . 11 ALA HA 1 1 5 1903 1 1 11 ALA HB1 H -4.341 6.892 1.652 1.00 . A X . 11 ALA HB1 1 1 5 1904 1 1 11 ALA HB2 H -4.101 5.697 0.377 1.00 . A X . 11 ALA HB2 1 1 5 1905 1 1 11 ALA HB3 H -4.932 7.210 0.020 1.00 . A X . 11 ALA HB3 1 1 5 1906 1 1 11 ALA N N -2.817 8.826 0.588 1.00 . A X . 11 ALA N 1 1 5 1907 1 1 11 ALA O O -2.972 6.275 -1.882 1.00 . A X . 11 ALA O 1 1 5 1908 1 1 12 LEU C C -0.169 7.052 -3.413 1.00 . A X . 12 LEU C 1 1 5 1909 1 1 12 LEU CA C -1.274 8.068 -3.162 1.00 . A X . 12 LEU CA 1 1 5 1910 1 1 12 LEU CB C -0.815 9.461 -3.604 1.00 . A X . 12 LEU CB 1 1 5 1911 1 1 12 LEU CD1 C -1.497 9.307 -6.015 1.00 . A X . 12 LEU CD1 1 1 5 1912 1 1 12 LEU CD2 C 0.257 10.942 -5.322 1.00 . A X . 12 LEU CD2 1 1 5 1913 1 1 12 LEU CG C -0.347 9.571 -5.057 1.00 . A X . 12 LEU CG 1 1 5 1914 1 1 12 LEU H H -1.274 8.783 -1.179 1.00 . A X . 12 LEU H 1 1 5 1915 1 1 12 LEU HA H -2.144 7.786 -3.734 1.00 . A X . 12 LEU HA 1 1 5 1916 1 1 12 LEU HB2 H -1.637 10.146 -3.460 1.00 . A X . 12 LEU HB2 1 1 5 1917 1 1 12 LEU HB3 H 0.000 9.766 -2.963 1.00 . A X . 12 LEU HB3 1 1 5 1918 1 1 12 LEU HD11 H -2.279 10.031 -5.842 1.00 . A X . 12 LEU HD11 1 1 5 1919 1 1 12 LEU HD12 H -1.883 8.312 -5.852 1.00 . A X . 12 LEU HD12 1 1 5 1920 1 1 12 LEU HD13 H -1.146 9.395 -7.033 1.00 . A X . 12 LEU HD13 1 1 5 1921 1 1 12 LEU HD21 H -0.499 11.702 -5.184 1.00 . A X . 12 LEU HD21 1 1 5 1922 1 1 12 LEU HD22 H 0.627 10.982 -6.336 1.00 . A X . 12 LEU HD22 1 1 5 1923 1 1 12 LEU HD23 H 1.072 11.116 -4.635 1.00 . A X . 12 LEU HD23 1 1 5 1924 1 1 12 LEU HG H 0.415 8.826 -5.239 1.00 . A X . 12 LEU HG 1 1 5 1925 1 1 12 LEU N N -1.650 8.092 -1.758 1.00 . A X . 12 LEU N 1 1 5 1926 1 1 12 LEU O O 0.942 7.199 -2.906 1.00 . A X . 12 LEU O 1 1 5 1927 1 1 13 LEU C C 1.004 4.260 -3.349 1.00 . A X . 13 LEU C 1 1 5 1928 1 1 13 LEU CA C 0.457 4.985 -4.571 1.00 . A X . 13 LEU CA 1 1 5 1929 1 1 13 LEU CB C 1.619 5.588 -5.376 1.00 . A X . 13 LEU CB 1 1 5 1930 1 1 13 LEU CD1 C 2.441 6.926 -7.332 1.00 . A X . 13 LEU CD1 1 1 5 1931 1 1 13 LEU CD2 C 0.583 5.283 -7.634 1.00 . A X . 13 LEU CD2 1 1 5 1932 1 1 13 LEU CG C 1.225 6.279 -6.683 1.00 . A X . 13 LEU CG 1 1 5 1933 1 1 13 LEU H H -1.429 5.949 -4.510 1.00 . A X . 13 LEU H 1 1 5 1934 1 1 13 LEU HA H -0.063 4.270 -5.192 1.00 . A X . 13 LEU HA 1 1 5 1935 1 1 13 LEU HB2 H 2.122 6.310 -4.750 1.00 . A X . 13 LEU HB2 1 1 5 1936 1 1 13 LEU HB3 H 2.315 4.795 -5.611 1.00 . A X . 13 LEU HB3 1 1 5 1937 1 1 13 LEU HD11 H 2.885 7.630 -6.644 1.00 . A X . 13 LEU HD11 1 1 5 1938 1 1 13 LEU HD12 H 2.136 7.444 -8.230 1.00 . A X . 13 LEU HD12 1 1 5 1939 1 1 13 LEU HD13 H 3.163 6.165 -7.583 1.00 . A X . 13 LEU HD13 1 1 5 1940 1 1 13 LEU HD21 H 0.343 5.775 -8.564 1.00 . A X . 13 LEU HD21 1 1 5 1941 1 1 13 LEU HD22 H -0.320 4.892 -7.188 1.00 . A X . 13 LEU HD22 1 1 5 1942 1 1 13 LEU HD23 H 1.271 4.471 -7.822 1.00 . A X . 13 LEU HD23 1 1 5 1943 1 1 13 LEU HG H 0.505 7.056 -6.472 1.00 . A X . 13 LEU HG 1 1 5 1944 1 1 13 LEU N N -0.500 6.019 -4.187 1.00 . A X . 13 LEU N 1 1 5 1945 1 1 13 LEU O O 2.117 3.737 -3.376 1.00 . A X . 13 LEU O 1 1 5 1946 1 1 14 TRP C C 0.754 2.133 -1.161 1.00 . A X . 14 TRP C 1 1 5 1947 1 1 14 TRP CA C 0.642 3.640 -1.029 1.00 . A X . 14 TRP CA 1 1 5 1948 1 1 14 TRP CB C -0.350 4.021 0.079 1.00 . A X . 14 TRP CB 1 1 5 1949 1 1 14 TRP CD1 C 1.384 3.344 1.855 1.00 . A X . 14 TRP CD1 1 1 5 1950 1 1 14 TRP CD2 C -0.429 4.368 2.677 1.00 . A X . 14 TRP CD2 1 1 5 1951 1 1 14 TRP CE2 C 0.431 4.054 3.746 1.00 . A X . 14 TRP CE2 1 1 5 1952 1 1 14 TRP CE3 C -1.634 5.021 2.954 1.00 . A X . 14 TRP CE3 1 1 5 1953 1 1 14 TRP CG C 0.199 3.905 1.475 1.00 . A X . 14 TRP CG 1 1 5 1954 1 1 14 TRP CH2 C -1.064 5.006 5.307 1.00 . A X . 14 TRP CH2 1 1 5 1955 1 1 14 TRP CZ2 C 0.121 4.366 5.067 1.00 . A X . 14 TRP CZ2 1 1 5 1956 1 1 14 TRP CZ3 C -1.940 5.331 4.264 1.00 . A X . 14 TRP CZ3 1 1 5 1957 1 1 14 TRP H H -0.734 4.466 -2.392 1.00 . A X . 14 TRP H 1 1 5 1958 1 1 14 TRP HA H 1.613 4.053 -0.802 1.00 . A X . 14 TRP HA 1 1 5 1959 1 1 14 TRP HB2 H -0.661 5.044 -0.069 1.00 . A X . 14 TRP HB2 1 1 5 1960 1 1 14 TRP HB3 H -1.215 3.379 0.006 1.00 . A X . 14 TRP HB3 1 1 5 1961 1 1 14 TRP HD1 H 2.093 2.899 1.173 1.00 . A X . 14 TRP HD1 1 1 5 1962 1 1 14 TRP HE1 H 2.301 3.089 3.732 1.00 . A X . 14 TRP HE1 1 1 5 1963 1 1 14 TRP HE3 H -2.323 5.279 2.164 1.00 . A X . 14 TRP HE3 1 1 5 1964 1 1 14 TRP HH2 H -1.343 5.267 6.317 1.00 . A X . 14 TRP HH2 1 1 5 1965 1 1 14 TRP HZ2 H 0.787 4.121 5.884 1.00 . A X . 14 TRP HZ2 1 1 5 1966 1 1 14 TRP HZ3 H -2.865 5.834 4.496 1.00 . A X . 14 TRP HZ3 1 1 5 1967 1 1 14 TRP N N 0.197 4.186 -2.299 1.00 . A X . 14 TRP N 1 1 5 1968 1 1 14 TRP NE1 N 1.529 3.426 3.218 1.00 . A X . 14 TRP NE1 1 1 5 1969 1 1 14 TRP O O 1.593 1.490 -0.529 1.00 . A X . 14 TRP O 1 1 5 1970 1 1 15 LYS C C 1.215 -0.235 -3.036 1.00 . A X . 15 LYS C 1 1 5 1971 1 1 15 LYS CA C -0.064 0.154 -2.296 1.00 . A X . 15 LYS CA 1 1 5 1972 1 1 15 LYS CB C -1.290 -0.260 -3.113 1.00 . A X . 15 LYS CB 1 1 5 1973 1 1 15 LYS CD C -3.792 -0.458 -3.255 1.00 . A X . 15 LYS CD 1 1 5 1974 1 1 15 LYS CE C -5.121 -0.082 -2.619 1.00 . A X . 15 LYS CE 1 1 5 1975 1 1 15 LYS CG C -2.616 0.031 -2.425 1.00 . A X . 15 LYS CG 1 1 5 1976 1 1 15 LYS H H -0.742 2.145 -2.484 1.00 . A X . 15 LYS H 1 1 5 1977 1 1 15 LYS HA H -0.085 -0.349 -1.347 1.00 . A X . 15 LYS HA 1 1 5 1978 1 1 15 LYS HB2 H -1.275 0.269 -4.055 1.00 . A X . 15 LYS HB2 1 1 5 1979 1 1 15 LYS HB3 H -1.235 -1.322 -3.307 1.00 . A X . 15 LYS HB3 1 1 5 1980 1 1 15 LYS HD2 H -3.737 -0.014 -4.237 1.00 . A X . 15 LYS HD2 1 1 5 1981 1 1 15 LYS HD3 H -3.736 -1.535 -3.341 1.00 . A X . 15 LYS HD3 1 1 5 1982 1 1 15 LYS HE2 H -5.919 -0.535 -3.188 1.00 . A X . 15 LYS HE2 1 1 5 1983 1 1 15 LYS HE3 H -5.139 -0.463 -1.608 1.00 . A X . 15 LYS HE3 1 1 5 1984 1 1 15 LYS HG2 H -2.632 -0.469 -1.469 1.00 . A X . 15 LYS HG2 1 1 5 1985 1 1 15 LYS HG3 H -2.709 1.097 -2.279 1.00 . A X . 15 LYS HG3 1 1 5 1986 1 1 15 LYS HZ1 H -4.571 1.848 -2.030 1.00 . A X . 15 LYS HZ1 1 1 5 1987 1 1 15 LYS HZ2 H -6.244 1.622 -2.152 1.00 . A X . 15 LYS HZ2 1 1 5 1988 1 1 15 LYS HZ3 H -5.308 1.778 -3.556 1.00 . A X . 15 LYS HZ3 1 1 5 1989 1 1 15 LYS N N -0.085 1.577 -2.024 1.00 . A X . 15 LYS N 1 1 5 1990 1 1 15 LYS NZ N -5.322 1.392 -2.585 1.00 . A X . 15 LYS NZ 1 1 5 1991 1 1 15 LYS O O 1.634 -1.393 -3.021 1.00 . A X . 15 LYS O 1 1 5 1992 1 1 16 ALA C C 4.281 0.955 -3.646 1.00 . A X . 16 ALA C 1 1 5 1993 1 1 16 ALA CA C 3.056 0.516 -4.437 1.00 . A X . 16 ALA CA 1 1 5 1994 1 1 16 ALA CB C 2.988 1.245 -5.768 1.00 . A X . 16 ALA CB 1 1 5 1995 1 1 16 ALA H H 1.465 1.653 -3.638 1.00 . A X . 16 ALA H 1 1 5 1996 1 1 16 ALA HA H 3.131 -0.543 -4.636 1.00 . A X . 16 ALA HA 1 1 5 1997 1 1 16 ALA HB1 H 2.132 0.893 -6.325 1.00 . A X . 16 ALA HB1 1 1 5 1998 1 1 16 ALA HB2 H 3.888 1.052 -6.332 1.00 . A X . 16 ALA HB2 1 1 5 1999 1 1 16 ALA HB3 H 2.892 2.307 -5.594 1.00 . A X . 16 ALA HB3 1 1 5 2000 1 1 16 ALA N N 1.836 0.746 -3.678 1.00 . A X . 16 ALA N 1 1 5 2001 1 1 16 ALA O O 5.416 0.713 -4.052 1.00 . A X . 16 ALA O 1 1 5 2002 1 1 17 LEU C C 5.650 0.950 -0.775 1.00 . A X . 17 LEU C 1 1 5 2003 1 1 17 LEU CA C 5.131 2.067 -1.663 1.00 . A X . 17 LEU CA 1 1 5 2004 1 1 17 LEU CB C 4.675 3.255 -0.811 1.00 . A X . 17 LEU CB 1 1 5 2005 1 1 17 LEU CD1 C 3.829 5.605 -0.654 1.00 . A X . 17 LEU CD1 1 1 5 2006 1 1 17 LEU CD2 C 5.577 5.019 -2.348 1.00 . A X . 17 LEU CD2 1 1 5 2007 1 1 17 LEU CG C 4.351 4.528 -1.592 1.00 . A X . 17 LEU CG 1 1 5 2008 1 1 17 LEU H H 3.123 1.695 -2.192 1.00 . A X . 17 LEU H 1 1 5 2009 1 1 17 LEU HA H 5.929 2.389 -2.316 1.00 . A X . 17 LEU HA 1 1 5 2010 1 1 17 LEU HB2 H 3.791 2.960 -0.266 1.00 . A X . 17 LEU HB2 1 1 5 2011 1 1 17 LEU HB3 H 5.456 3.483 -0.101 1.00 . A X . 17 LEU HB3 1 1 5 2012 1 1 17 LEU HD11 H 4.584 5.839 0.081 1.00 . A X . 17 LEU HD11 1 1 5 2013 1 1 17 LEU HD12 H 2.940 5.246 -0.157 1.00 . A X . 17 LEU HD12 1 1 5 2014 1 1 17 LEU HD13 H 3.593 6.492 -1.222 1.00 . A X . 17 LEU HD13 1 1 5 2015 1 1 17 LEU HD21 H 5.894 4.257 -3.046 1.00 . A X . 17 LEU HD21 1 1 5 2016 1 1 17 LEU HD22 H 6.376 5.221 -1.649 1.00 . A X . 17 LEU HD22 1 1 5 2017 1 1 17 LEU HD23 H 5.332 5.921 -2.887 1.00 . A X . 17 LEU HD23 1 1 5 2018 1 1 17 LEU HG H 3.576 4.313 -2.313 1.00 . A X . 17 LEU HG 1 1 5 2019 1 1 17 LEU N N 4.047 1.578 -2.497 1.00 . A X . 17 LEU N 1 1 5 2020 1 1 17 LEU O O 6.590 1.131 -0.003 1.00 . A X . 17 LEU O 1 1 5 2021 1 1 18 ALA C C 6.829 -1.859 -0.724 1.00 . A X . 18 ALA C 1 1 5 2022 1 1 18 ALA CA C 5.481 -1.392 -0.184 1.00 . A X . 18 ALA CA 1 1 5 2023 1 1 18 ALA CB C 4.445 -2.499 -0.286 1.00 . A X . 18 ALA CB 1 1 5 2024 1 1 18 ALA H H 4.255 -0.282 -1.493 1.00 . A X . 18 ALA H 1 1 5 2025 1 1 18 ALA HA H 5.586 -1.119 0.854 1.00 . A X . 18 ALA HA 1 1 5 2026 1 1 18 ALA HB1 H 3.496 -2.135 0.079 1.00 . A X . 18 ALA HB1 1 1 5 2027 1 1 18 ALA HB2 H 4.761 -3.344 0.306 1.00 . A X . 18 ALA HB2 1 1 5 2028 1 1 18 ALA HB3 H 4.341 -2.797 -1.319 1.00 . A X . 18 ALA HB3 1 1 5 2029 1 1 18 ALA N N 5.034 -0.216 -0.903 1.00 . A X . 18 ALA N 1 1 5 2030 1 1 18 ALA O O 7.538 -2.636 -0.088 1.00 . A X . 18 ALA O 1 1 5 2031 1 1 19 LEU C C 9.296 -0.437 -2.684 1.00 . A X . 19 LEU C 1 1 5 2032 1 1 19 LEU CA C 8.441 -1.695 -2.545 1.00 . A X . 19 LEU CA 1 1 5 2033 1 1 19 LEU CB C 8.201 -2.316 -3.926 1.00 . A X . 19 LEU CB 1 1 5 2034 1 1 19 LEU CD1 C 7.053 -4.002 -5.384 1.00 . A X . 19 LEU CD1 1 1 5 2035 1 1 19 LEU CD2 C 7.739 -4.633 -3.067 1.00 . A X . 19 LEU CD2 1 1 5 2036 1 1 19 LEU CG C 7.237 -3.507 -3.958 1.00 . A X . 19 LEU CG 1 1 5 2037 1 1 19 LEU H H 6.554 -0.760 -2.370 1.00 . A X . 19 LEU H 1 1 5 2038 1 1 19 LEU HA H 8.956 -2.405 -1.917 1.00 . A X . 19 LEU HA 1 1 5 2039 1 1 19 LEU HB2 H 7.812 -1.550 -4.580 1.00 . A X . 19 LEU HB2 1 1 5 2040 1 1 19 LEU HB3 H 9.153 -2.646 -4.315 1.00 . A X . 19 LEU HB3 1 1 5 2041 1 1 19 LEU HD11 H 8.006 -4.322 -5.780 1.00 . A X . 19 LEU HD11 1 1 5 2042 1 1 19 LEU HD12 H 6.660 -3.204 -5.996 1.00 . A X . 19 LEU HD12 1 1 5 2043 1 1 19 LEU HD13 H 6.362 -4.832 -5.391 1.00 . A X . 19 LEU HD13 1 1 5 2044 1 1 19 LEU HD21 H 7.042 -5.457 -3.100 1.00 . A X . 19 LEU HD21 1 1 5 2045 1 1 19 LEU HD22 H 7.827 -4.276 -2.051 1.00 . A X . 19 LEU HD22 1 1 5 2046 1 1 19 LEU HD23 H 8.704 -4.966 -3.417 1.00 . A X . 19 LEU HD23 1 1 5 2047 1 1 19 LEU HG H 6.271 -3.191 -3.589 1.00 . A X . 19 LEU HG 1 1 5 2048 1 1 19 LEU N N 7.172 -1.367 -1.909 1.00 . A X . 19 LEU N 1 1 5 2049 1 1 19 LEU O O 10.050 -0.286 -3.649 1.00 . A X . 19 LEU O 1 1 5 2050 1 1 20 LYS C C 11.398 1.547 -1.688 1.00 . A X . 20 LYS C 1 1 5 2051 1 1 20 LYS CA C 9.884 1.742 -1.747 1.00 . A X . 20 LYS CA 1 1 5 2052 1 1 20 LYS CB C 9.428 2.651 -0.597 1.00 . A X . 20 LYS CB 1 1 5 2053 1 1 20 LYS CD C 9.255 3.046 1.881 1.00 . A X . 20 LYS CD 1 1 5 2054 1 1 20 LYS CE C 9.477 2.448 3.265 1.00 . A X . 20 LYS CE 1 1 5 2055 1 1 20 LYS CG C 9.649 2.064 0.788 1.00 . A X . 20 LYS CG 1 1 5 2056 1 1 20 LYS H H 8.587 0.266 -0.950 1.00 . A X . 20 LYS H 1 1 5 2057 1 1 20 LYS HA H 9.639 2.221 -2.683 1.00 . A X . 20 LYS HA 1 1 5 2058 1 1 20 LYS HB2 H 9.971 3.583 -0.657 1.00 . A X . 20 LYS HB2 1 1 5 2059 1 1 20 LYS HB3 H 8.374 2.855 -0.713 1.00 . A X . 20 LYS HB3 1 1 5 2060 1 1 20 LYS HD2 H 9.852 3.942 1.783 1.00 . A X . 20 LYS HD2 1 1 5 2061 1 1 20 LYS HD3 H 8.210 3.292 1.768 1.00 . A X . 20 LYS HD3 1 1 5 2062 1 1 20 LYS HE2 H 8.836 1.586 3.373 1.00 . A X . 20 LYS HE2 1 1 5 2063 1 1 20 LYS HE3 H 10.509 2.139 3.348 1.00 . A X . 20 LYS HE3 1 1 5 2064 1 1 20 LYS HG2 H 9.052 1.172 0.890 1.00 . A X . 20 LYS HG2 1 1 5 2065 1 1 20 LYS HG3 H 10.695 1.814 0.901 1.00 . A X . 20 LYS HG3 1 1 5 2066 1 1 20 LYS HZ1 H 9.294 2.952 5.284 1.00 . A X . 20 LYS HZ1 1 1 5 2067 1 1 20 LYS HZ2 H 8.187 3.747 4.278 1.00 . A X . 20 LYS HZ2 1 1 5 2068 1 1 20 LYS HZ3 H 9.809 4.235 4.302 1.00 . A X . 20 LYS HZ3 1 1 5 2069 1 1 20 LYS N N 9.175 0.462 -1.710 1.00 . A X . 20 LYS N 1 1 5 2070 1 1 20 LYS NZ N 9.169 3.413 4.356 1.00 . A X . 20 LYS NZ 1 1 5 2071 1 1 20 LYS O O 12.155 2.325 -2.272 1.00 . A X . 20 LYS O 1 1 5 2072 1 1 21 LEU C C 13.735 -0.882 -1.718 1.00 . A X . 21 LEU C 1 1 5 2073 1 1 21 LEU CA C 13.271 0.272 -0.842 1.00 . A X . 21 LEU CA 1 1 5 2074 1 1 21 LEU CB C 13.627 -0.012 0.619 1.00 . A X . 21 LEU CB 1 1 5 2075 1 1 21 LEU CD1 C 13.746 0.752 3.000 1.00 . A X . 21 LEU CD1 1 1 5 2076 1 1 21 LEU CD2 C 14.439 2.293 1.163 1.00 . A X . 21 LEU CD2 1 1 5 2077 1 1 21 LEU CG C 13.485 1.179 1.566 1.00 . A X . 21 LEU CG 1 1 5 2078 1 1 21 LEU H H 11.202 -0.106 -0.574 1.00 . A X . 21 LEU H 1 1 5 2079 1 1 21 LEU HA H 13.785 1.169 -1.155 1.00 . A X . 21 LEU HA 1 1 5 2080 1 1 21 LEU HB2 H 12.987 -0.805 0.975 1.00 . A X . 21 LEU HB2 1 1 5 2081 1 1 21 LEU HB3 H 14.651 -0.355 0.659 1.00 . A X . 21 LEU HB3 1 1 5 2082 1 1 21 LEU HD11 H 14.742 0.342 3.078 1.00 . A X . 21 LEU HD11 1 1 5 2083 1 1 21 LEU HD12 H 13.024 0.001 3.291 1.00 . A X . 21 LEU HD12 1 1 5 2084 1 1 21 LEU HD13 H 13.658 1.608 3.653 1.00 . A X . 21 LEU HD13 1 1 5 2085 1 1 21 LEU HD21 H 14.228 2.597 0.149 1.00 . A X . 21 LEU HD21 1 1 5 2086 1 1 21 LEU HD22 H 15.456 1.938 1.229 1.00 . A X . 21 LEU HD22 1 1 5 2087 1 1 21 LEU HD23 H 14.308 3.136 1.825 1.00 . A X . 21 LEU HD23 1 1 5 2088 1 1 21 LEU HG H 12.477 1.560 1.507 1.00 . A X . 21 LEU HG 1 1 5 2089 1 1 21 LEU N N 11.844 0.512 -0.992 1.00 . A X . 21 LEU N 1 1 5 2090 1 1 21 LEU O O 14.924 -1.019 -1.997 1.00 . A X . 21 LEU O 1 1 5 2091 1 1 22 LYS C C 13.962 -3.844 -2.116 1.00 . A X . 22 LYS C 1 1 5 2092 1 1 22 LYS CA C 13.073 -2.908 -2.929 1.00 . A X . 22 LYS CA 1 1 5 2093 1 1 22 LYS CB C 13.754 -2.553 -4.258 1.00 . A X . 22 LYS CB 1 1 5 2094 1 1 22 LYS CD C 13.716 -1.180 -6.361 1.00 . A X . 22 LYS CD 1 1 5 2095 1 1 22 LYS CE C 14.921 -0.346 -5.942 1.00 . A X . 22 LYS CE 1 1 5 2096 1 1 22 LYS CG C 12.918 -1.656 -5.157 1.00 . A X . 22 LYS CG 1 1 5 2097 1 1 22 LYS H H 11.843 -1.487 -1.947 1.00 . A X . 22 LYS H 1 1 5 2098 1 1 22 LYS HA H 12.135 -3.406 -3.132 1.00 . A X . 22 LYS HA 1 1 5 2099 1 1 22 LYS HB2 H 14.684 -2.047 -4.050 1.00 . A X . 22 LYS HB2 1 1 5 2100 1 1 22 LYS HB3 H 13.966 -3.465 -4.797 1.00 . A X . 22 LYS HB3 1 1 5 2101 1 1 22 LYS HD2 H 14.065 -2.042 -6.910 1.00 . A X . 22 LYS HD2 1 1 5 2102 1 1 22 LYS HD3 H 13.077 -0.581 -6.994 1.00 . A X . 22 LYS HD3 1 1 5 2103 1 1 22 LYS HE2 H 14.585 0.456 -5.299 1.00 . A X . 22 LYS HE2 1 1 5 2104 1 1 22 LYS HE3 H 15.605 -0.980 -5.398 1.00 . A X . 22 LYS HE3 1 1 5 2105 1 1 22 LYS HG2 H 12.061 -2.211 -5.504 1.00 . A X . 22 LYS HG2 1 1 5 2106 1 1 22 LYS HG3 H 12.591 -0.798 -4.589 1.00 . A X . 22 LYS HG3 1 1 5 2107 1 1 22 LYS HZ1 H 14.975 0.827 -7.674 1.00 . A X . 22 LYS HZ1 1 1 5 2108 1 1 22 LYS HZ2 H 16.004 -0.518 -7.727 1.00 . A X . 22 LYS HZ2 1 1 5 2109 1 1 22 LYS HZ3 H 16.424 0.831 -6.796 1.00 . A X . 22 LYS HZ3 1 1 5 2110 1 1 22 LYS N N 12.777 -1.702 -2.153 1.00 . A X . 22 LYS N 1 1 5 2111 1 1 22 LYS NZ N 15.630 0.237 -7.114 1.00 . A X . 22 LYS NZ 1 1 5 2112 1 1 22 LYS O O 14.788 -4.573 -2.670 1.00 . A X . 22 LYS O 1 1 5 2113 1 1 23 LYS C C 16.032 -4.006 0.101 1.00 . A X . 23 LYS C 1 1 5 2114 1 1 23 LYS CA C 14.600 -4.527 0.155 1.00 . A X . 23 LYS CA 1 1 5 2115 1 1 23 LYS CB C 14.565 -6.039 -0.085 1.00 . A X . 23 LYS CB 1 1 5 2116 1 1 23 LYS CD C 13.305 -8.181 0.256 1.00 . A X . 23 LYS CD 1 1 5 2117 1 1 23 LYS CE C 11.999 -8.797 0.721 1.00 . A X . 23 LYS CE 1 1 5 2118 1 1 23 LYS CG C 13.216 -6.664 0.209 1.00 . A X . 23 LYS CG 1 1 5 2119 1 1 23 LYS H H 13.011 -3.278 -0.456 1.00 . A X . 23 LYS H 1 1 5 2120 1 1 23 LYS HA H 14.208 -4.327 1.141 1.00 . A X . 23 LYS HA 1 1 5 2121 1 1 23 LYS HB2 H 14.814 -6.234 -1.119 1.00 . A X . 23 LYS HB2 1 1 5 2122 1 1 23 LYS HB3 H 15.304 -6.507 0.548 1.00 . A X . 23 LYS HB3 1 1 5 2123 1 1 23 LYS HD2 H 13.533 -8.550 -0.732 1.00 . A X . 23 LYS HD2 1 1 5 2124 1 1 23 LYS HD3 H 14.091 -8.467 0.940 1.00 . A X . 23 LYS HD3 1 1 5 2125 1 1 23 LYS HE2 H 11.255 -8.655 -0.047 1.00 . A X . 23 LYS HE2 1 1 5 2126 1 1 23 LYS HE3 H 12.151 -9.855 0.882 1.00 . A X . 23 LYS HE3 1 1 5 2127 1 1 23 LYS HG2 H 12.863 -6.303 1.164 1.00 . A X . 23 LYS HG2 1 1 5 2128 1 1 23 LYS HG3 H 12.522 -6.375 -0.567 1.00 . A X . 23 LYS HG3 1 1 5 2129 1 1 23 LYS HZ1 H 10.763 -8.762 2.406 1.00 . A X . 23 LYS HZ1 1 1 5 2130 1 1 23 LYS HZ2 H 11.130 -7.229 1.791 1.00 . A X . 23 LYS HZ2 1 1 5 2131 1 1 23 LYS HZ3 H 12.299 -8.088 2.670 1.00 . A X . 23 LYS HZ3 1 1 5 2132 1 1 23 LYS N N 13.759 -3.811 -0.798 1.00 . A X . 23 LYS N 1 1 5 2133 1 1 23 LYS NZ N 11.516 -8.180 1.983 1.00 . A X . 23 LYS NZ 1 1 5 2134 1 1 23 LYS O O 16.932 -4.660 -0.429 1.00 . A X . 23 LYS O 1 1 5 2135 1 1 24 ALA C C 17.966 -1.953 2.114 1.00 . A X . 24 ALA C 1 1 5 2136 1 1 24 ALA CA C 17.530 -2.178 0.675 1.00 . A X . 24 ALA CA 1 1 5 2137 1 1 24 ALA CB C 17.499 -0.862 -0.088 1.00 . A X . 24 ALA CB 1 1 5 2138 1 1 24 ALA H H 15.466 -2.347 1.054 1.00 . A X . 24 ALA H 1 1 5 2139 1 1 24 ALA HA H 18.238 -2.838 0.190 1.00 . A X . 24 ALA HA 1 1 5 2140 1 1 24 ALA HB1 H 16.778 -0.200 0.367 1.00 . A X . 24 ALA HB1 1 1 5 2141 1 1 24 ALA HB2 H 17.221 -1.047 -1.115 1.00 . A X . 24 ALA HB2 1 1 5 2142 1 1 24 ALA HB3 H 18.476 -0.403 -0.057 1.00 . A X . 24 ALA HB3 1 1 5 2143 1 1 24 ALA N N 16.225 -2.813 0.646 1.00 . A X . 24 ALA N 1 1 5 2144 1 1 24 ALA O O 17.402 -1.052 2.775 1.00 . A X . 24 ALA O 1 1 5 2145 1 1 24 ALA OXT O 18.857 -2.688 2.589 1.00 . A X . 24 ALA OXT 1 1 6 2146 1 1 1 LYS C C -9.546 16.976 14.800 1.00 . A X . 1 LYS C 1 1 6 2147 1 1 1 LYS CA C -9.078 16.398 16.134 1.00 . A X . 1 LYS CA 1 1 6 2148 1 1 1 LYS CB C -8.649 17.528 17.076 1.00 . A X . 1 LYS CB 1 1 6 2149 1 1 1 LYS CD C -10.755 17.723 18.451 1.00 . A X . 1 LYS CD 1 1 6 2150 1 1 1 LYS CE C -11.721 18.692 19.122 1.00 . A X . 1 LYS CE 1 1 6 2151 1 1 1 LYS CG C -9.784 18.440 17.522 1.00 . A X . 1 LYS CG 1 1 6 2152 1 1 1 LYS H1 H -8.248 14.688 15.279 1.00 . A X . 1 LYS H1 1 1 6 2153 1 1 1 LYS H2 H -7.641 15.050 16.821 1.00 . A X . 1 LYS H2 1 1 6 2154 1 1 1 LYS H3 H -7.146 15.961 15.477 1.00 . A X . 1 LYS H3 1 1 6 2155 1 1 1 LYS HA H -9.894 15.851 16.581 1.00 . A X . 1 LYS HA 1 1 6 2156 1 1 1 LYS HB2 H -8.200 17.092 17.957 1.00 . A X . 1 LYS HB2 1 1 6 2157 1 1 1 LYS HB3 H -7.907 18.134 16.574 1.00 . A X . 1 LYS HB3 1 1 6 2158 1 1 1 LYS HD2 H -11.325 17.011 17.873 1.00 . A X . 1 LYS HD2 1 1 6 2159 1 1 1 LYS HD3 H -10.194 17.204 19.213 1.00 . A X . 1 LYS HD3 1 1 6 2160 1 1 1 LYS HE2 H -12.320 18.145 19.835 1.00 . A X . 1 LYS HE2 1 1 6 2161 1 1 1 LYS HE3 H -11.150 19.447 19.641 1.00 . A X . 1 LYS HE3 1 1 6 2162 1 1 1 LYS HG2 H -9.366 19.291 18.040 1.00 . A X . 1 LYS HG2 1 1 6 2163 1 1 1 LYS HG3 H -10.320 18.779 16.647 1.00 . A X . 1 LYS HG3 1 1 6 2164 1 1 1 LYS HZ1 H -13.203 18.637 17.653 1.00 . A X . 1 LYS HZ1 1 1 6 2165 1 1 1 LYS HZ2 H -12.070 19.878 17.434 1.00 . A X . 1 LYS HZ2 1 1 6 2166 1 1 1 LYS HZ3 H -13.259 20.014 18.634 1.00 . A X . 1 LYS HZ3 1 1 6 2167 1 1 1 LYS N N -7.951 15.462 15.914 1.00 . A X . 1 LYS N 1 1 6 2168 1 1 1 LYS NZ N -12.623 19.353 18.145 1.00 . A X . 1 LYS NZ 1 1 6 2169 1 1 1 LYS O O -10.672 16.728 14.364 1.00 . A X . 1 LYS O 1 1 6 2170 1 1 2 LYS C C -8.155 17.664 11.762 1.00 . A X . 2 LYS C 1 1 6 2171 1 1 2 LYS CA C -8.976 18.337 12.858 1.00 . A X . 2 LYS CA 1 1 6 2172 1 1 2 LYS CB C -8.683 19.841 12.892 1.00 . A X . 2 LYS CB 1 1 6 2173 1 1 2 LYS CD C -8.996 22.005 14.141 1.00 . A X . 2 LYS CD 1 1 6 2174 1 1 2 LYS CE C -9.101 22.862 12.891 1.00 . A X . 2 LYS CE 1 1 6 2175 1 1 2 LYS CG C -9.520 20.596 13.913 1.00 . A X . 2 LYS CG 1 1 6 2176 1 1 2 LYS H H -7.791 17.905 14.559 1.00 . A X . 2 LYS H 1 1 6 2177 1 1 2 LYS HA H -10.024 18.184 12.654 1.00 . A X . 2 LYS HA 1 1 6 2178 1 1 2 LYS HB2 H -7.640 19.991 13.129 1.00 . A X . 2 LYS HB2 1 1 6 2179 1 1 2 LYS HB3 H -8.885 20.257 11.916 1.00 . A X . 2 LYS HB3 1 1 6 2180 1 1 2 LYS HD2 H -9.568 22.469 14.929 1.00 . A X . 2 LYS HD2 1 1 6 2181 1 1 2 LYS HD3 H -7.958 21.944 14.435 1.00 . A X . 2 LYS HD3 1 1 6 2182 1 1 2 LYS HE2 H -8.579 22.368 12.083 1.00 . A X . 2 LYS HE2 1 1 6 2183 1 1 2 LYS HE3 H -10.144 22.972 12.631 1.00 . A X . 2 LYS HE3 1 1 6 2184 1 1 2 LYS HG2 H -10.537 20.655 13.555 1.00 . A X . 2 LYS HG2 1 1 6 2185 1 1 2 LYS HG3 H -9.497 20.058 14.849 1.00 . A X . 2 LYS HG3 1 1 6 2186 1 1 2 LYS HZ1 H -7.495 24.121 13.336 1.00 . A X . 2 LYS HZ1 1 1 6 2187 1 1 2 LYS HZ2 H -8.990 24.693 13.890 1.00 . A X . 2 LYS HZ2 1 1 6 2188 1 1 2 LYS HZ3 H -8.606 24.786 12.241 1.00 . A X . 2 LYS HZ3 1 1 6 2189 1 1 2 LYS N N -8.673 17.739 14.154 1.00 . A X . 2 LYS N 1 1 6 2190 1 1 2 LYS NZ N -8.507 24.208 13.102 1.00 . A X . 2 LYS NZ 1 1 6 2191 1 1 2 LYS O O -6.940 17.501 11.909 1.00 . A X . 2 LYS O 1 1 6 2192 1 1 3 LEU C C -7.768 15.165 9.955 1.00 . A X . 3 LEU C 1 1 6 2193 1 1 3 LEU CA C -8.202 16.571 9.552 1.00 . A X . 3 LEU CA 1 1 6 2194 1 1 3 LEU CB C -7.008 17.350 8.978 1.00 . A X . 3 LEU CB 1 1 6 2195 1 1 3 LEU CD1 C -8.105 19.605 8.703 1.00 . A X . 3 LEU CD1 1 1 6 2196 1 1 3 LEU CD2 C -6.100 19.015 7.325 1.00 . A X . 3 LEU CD2 1 1 6 2197 1 1 3 LEU CG C -7.357 18.482 8.000 1.00 . A X . 3 LEU CG 1 1 6 2198 1 1 3 LEU H H -9.798 17.465 10.628 1.00 . A X . 3 LEU H 1 1 6 2199 1 1 3 LEU HA H -8.951 16.477 8.778 1.00 . A X . 3 LEU HA 1 1 6 2200 1 1 3 LEU HB2 H -6.459 17.778 9.803 1.00 . A X . 3 LEU HB2 1 1 6 2201 1 1 3 LEU HB3 H -6.364 16.650 8.467 1.00 . A X . 3 LEU HB3 1 1 6 2202 1 1 3 LEU HD11 H -9.026 19.221 9.117 1.00 . A X . 3 LEU HD11 1 1 6 2203 1 1 3 LEU HD12 H -8.329 20.389 7.995 1.00 . A X . 3 LEU HD12 1 1 6 2204 1 1 3 LEU HD13 H -7.493 20.005 9.500 1.00 . A X . 3 LEU HD13 1 1 6 2205 1 1 3 LEU HD21 H -6.369 19.798 6.629 1.00 . A X . 3 LEU HD21 1 1 6 2206 1 1 3 LEU HD22 H -5.609 18.214 6.791 1.00 . A X . 3 LEU HD22 1 1 6 2207 1 1 3 LEU HD23 H -5.430 19.414 8.071 1.00 . A X . 3 LEU HD23 1 1 6 2208 1 1 3 LEU HG H -8.005 18.088 7.231 1.00 . A X . 3 LEU HG 1 1 6 2209 1 1 3 LEU N N -8.831 17.276 10.676 1.00 . A X . 3 LEU N 1 1 6 2210 1 1 3 LEU O O -6.903 14.980 10.814 1.00 . A X . 3 LEU O 1 1 6 2211 1 1 4 LYS C C -7.321 12.178 8.426 1.00 . A X . 4 LYS C 1 1 6 2212 1 1 4 LYS CA C -8.076 12.785 9.603 1.00 . A X . 4 LYS CA 1 1 6 2213 1 1 4 LYS CB C -9.369 12.020 9.879 1.00 . A X . 4 LYS CB 1 1 6 2214 1 1 4 LYS CD C -11.509 11.967 11.214 1.00 . A X . 4 LYS CD 1 1 6 2215 1 1 4 LYS CE C -12.378 12.542 10.105 1.00 . A X . 4 LYS CE 1 1 6 2216 1 1 4 LYS CG C -10.086 12.493 11.135 1.00 . A X . 4 LYS CG 1 1 6 2217 1 1 4 LYS H H -9.066 14.390 8.652 1.00 . A X . 4 LYS H 1 1 6 2218 1 1 4 LYS HA H -7.448 12.747 10.481 1.00 . A X . 4 LYS HA 1 1 6 2219 1 1 4 LYS HB2 H -10.035 12.142 9.038 1.00 . A X . 4 LYS HB2 1 1 6 2220 1 1 4 LYS HB3 H -9.137 10.971 9.996 1.00 . A X . 4 LYS HB3 1 1 6 2221 1 1 4 LYS HD2 H -11.490 10.891 11.121 1.00 . A X . 4 LYS HD2 1 1 6 2222 1 1 4 LYS HD3 H -11.933 12.241 12.170 1.00 . A X . 4 LYS HD3 1 1 6 2223 1 1 4 LYS HE2 H -12.322 13.618 10.148 1.00 . A X . 4 LYS HE2 1 1 6 2224 1 1 4 LYS HE3 H -11.998 12.200 9.152 1.00 . A X . 4 LYS HE3 1 1 6 2225 1 1 4 LYS HG2 H -9.540 12.145 11.998 1.00 . A X . 4 LYS HG2 1 1 6 2226 1 1 4 LYS HG3 H -10.111 13.573 11.138 1.00 . A X . 4 LYS HG3 1 1 6 2227 1 1 4 LYS HZ1 H -14.350 12.479 9.424 1.00 . A X . 4 LYS HZ1 1 1 6 2228 1 1 4 LYS HZ2 H -14.207 12.527 11.111 1.00 . A X . 4 LYS HZ2 1 1 6 2229 1 1 4 LYS HZ3 H -13.871 11.089 10.274 1.00 . A X . 4 LYS HZ3 1 1 6 2230 1 1 4 LYS N N -8.383 14.176 9.331 1.00 . A X . 4 LYS N 1 1 6 2231 1 1 4 LYS NZ N -13.799 12.130 10.237 1.00 . A X . 4 LYS NZ 1 1 6 2232 1 1 4 LYS O O -7.913 11.842 7.397 1.00 . A X . 4 LYS O 1 1 6 2233 1 1 5 LEU C C -5.234 10.062 7.336 1.00 . A X . 5 LEU C 1 1 6 2234 1 1 5 LEU CA C -5.140 11.579 7.509 1.00 . A X . 5 LEU CA 1 1 6 2235 1 1 5 LEU CB C -3.690 11.992 7.786 1.00 . A X . 5 LEU CB 1 1 6 2236 1 1 5 LEU CD1 C -1.990 13.785 8.218 1.00 . A X . 5 LEU CD1 1 1 6 2237 1 1 5 LEU CD2 C -3.817 14.181 6.564 1.00 . A X . 5 LEU CD2 1 1 6 2238 1 1 5 LEU CG C -3.445 13.502 7.872 1.00 . A X . 5 LEU CG 1 1 6 2239 1 1 5 LEU H H -5.608 12.278 9.455 1.00 . A X . 5 LEU H 1 1 6 2240 1 1 5 LEU HA H -5.467 12.052 6.594 1.00 . A X . 5 LEU HA 1 1 6 2241 1 1 5 LEU HB2 H -3.387 11.547 8.720 1.00 . A X . 5 LEU HB2 1 1 6 2242 1 1 5 LEU HB3 H -3.068 11.596 6.998 1.00 . A X . 5 LEU HB3 1 1 6 2243 1 1 5 LEU HD11 H -1.350 13.353 7.463 1.00 . A X . 5 LEU HD11 1 1 6 2244 1 1 5 LEU HD12 H -1.759 13.353 9.179 1.00 . A X . 5 LEU HD12 1 1 6 2245 1 1 5 LEU HD13 H -1.831 14.853 8.253 1.00 . A X . 5 LEU HD13 1 1 6 2246 1 1 5 LEU HD21 H -3.618 15.240 6.640 1.00 . A X . 5 LEU HD21 1 1 6 2247 1 1 5 LEU HD22 H -4.867 14.024 6.366 1.00 . A X . 5 LEU HD22 1 1 6 2248 1 1 5 LEU HD23 H -3.231 13.762 5.761 1.00 . A X . 5 LEU HD23 1 1 6 2249 1 1 5 LEU HG H -4.062 13.917 8.656 1.00 . A X . 5 LEU HG 1 1 6 2250 1 1 5 LEU N N -6.009 12.049 8.581 1.00 . A X . 5 LEU N 1 1 6 2251 1 1 5 LEU O O -4.270 9.331 7.565 1.00 . A X . 5 LEU O 1 1 6 2252 1 1 6 ALA C C -7.390 8.016 5.360 1.00 . A X . 6 ALA C 1 1 6 2253 1 1 6 ALA CA C -6.625 8.187 6.666 1.00 . A X . 6 ALA CA 1 1 6 2254 1 1 6 ALA CB C -7.375 7.526 7.817 1.00 . A X . 6 ALA CB 1 1 6 2255 1 1 6 ALA H H -7.157 10.226 6.852 1.00 . A X . 6 ALA H 1 1 6 2256 1 1 6 ALA HA H -5.659 7.710 6.573 1.00 . A X . 6 ALA HA 1 1 6 2257 1 1 6 ALA HB1 H -7.490 6.470 7.616 1.00 . A X . 6 ALA HB1 1 1 6 2258 1 1 6 ALA HB2 H -8.351 7.980 7.921 1.00 . A X . 6 ALA HB2 1 1 6 2259 1 1 6 ALA HB3 H -6.818 7.658 8.733 1.00 . A X . 6 ALA HB3 1 1 6 2260 1 1 6 ALA N N -6.408 9.599 6.944 1.00 . A X . 6 ALA N 1 1 6 2261 1 1 6 ALA O O -7.383 6.944 4.756 1.00 . A X . 6 ALA O 1 1 6 2262 1 1 7 LEU C C -8.010 9.659 2.539 1.00 . A X . 7 LEU C 1 1 6 2263 1 1 7 LEU CA C -8.815 9.055 3.687 1.00 . A X . 7 LEU CA 1 1 6 2264 1 1 7 LEU CB C -10.142 9.818 3.858 1.00 . A X . 7 LEU CB 1 1 6 2265 1 1 7 LEU CD1 C -11.224 7.753 4.816 1.00 . A X . 7 LEU CD1 1 1 6 2266 1 1 7 LEU CD2 C -10.716 9.697 6.317 1.00 . A X . 7 LEU CD2 1 1 6 2267 1 1 7 LEU CG C -11.116 9.266 4.912 1.00 . A X . 7 LEU CG 1 1 6 2268 1 1 7 LEU H H -7.979 9.920 5.420 1.00 . A X . 7 LEU H 1 1 6 2269 1 1 7 LEU HA H -9.028 8.022 3.458 1.00 . A X . 7 LEU HA 1 1 6 2270 1 1 7 LEU HB2 H -9.906 10.837 4.126 1.00 . A X . 7 LEU HB2 1 1 6 2271 1 1 7 LEU HB3 H -10.649 9.826 2.905 1.00 . A X . 7 LEU HB3 1 1 6 2272 1 1 7 LEU HD11 H -11.915 7.393 5.564 1.00 . A X . 7 LEU HD11 1 1 6 2273 1 1 7 LEU HD12 H -10.252 7.311 4.981 1.00 . A X . 7 LEU HD12 1 1 6 2274 1 1 7 LEU HD13 H -11.581 7.480 3.833 1.00 . A X . 7 LEU HD13 1 1 6 2275 1 1 7 LEU HD21 H -9.713 9.355 6.527 1.00 . A X . 7 LEU HD21 1 1 6 2276 1 1 7 LEU HD22 H -11.399 9.266 7.034 1.00 . A X . 7 LEU HD22 1 1 6 2277 1 1 7 LEU HD23 H -10.753 10.775 6.387 1.00 . A X . 7 LEU HD23 1 1 6 2278 1 1 7 LEU HG H -12.100 9.671 4.713 1.00 . A X . 7 LEU HG 1 1 6 2279 1 1 7 LEU N N -8.033 9.086 4.916 1.00 . A X . 7 LEU N 1 1 6 2280 1 1 7 LEU O O -8.410 10.663 1.944 1.00 . A X . 7 LEU O 1 1 6 2281 1 1 8 ALA C C -4.776 8.596 1.041 1.00 . A X . 8 ALA C 1 1 6 2282 1 1 8 ALA CA C -5.964 9.534 1.213 1.00 . A X . 8 ALA CA 1 1 6 2283 1 1 8 ALA CB C -5.469 10.933 1.556 1.00 . A X . 8 ALA CB 1 1 6 2284 1 1 8 ALA H H -6.645 8.205 2.707 1.00 . A X . 8 ALA H 1 1 6 2285 1 1 8 ALA HA H -6.509 9.586 0.282 1.00 . A X . 8 ALA HA 1 1 6 2286 1 1 8 ALA HB1 H -4.805 11.282 0.778 1.00 . A X . 8 ALA HB1 1 1 6 2287 1 1 8 ALA HB2 H -4.939 10.905 2.496 1.00 . A X . 8 ALA HB2 1 1 6 2288 1 1 8 ALA HB3 H -6.312 11.603 1.638 1.00 . A X . 8 ALA HB3 1 1 6 2289 1 1 8 ALA N N -6.870 9.038 2.240 1.00 . A X . 8 ALA N 1 1 6 2290 1 1 8 ALA O O -4.538 8.079 -0.047 1.00 . A X . 8 ALA O 1 1 6 2291 1 1 9 LYS C C -2.985 6.180 1.536 1.00 . A X . 9 LYS C 1 1 6 2292 1 1 9 LYS CA C -2.806 7.593 2.117 1.00 . A X . 9 LYS CA 1 1 6 2293 1 1 9 LYS CB C -2.201 7.520 3.525 1.00 . A X . 9 LYS CB 1 1 6 2294 1 1 9 LYS CD C -0.194 6.931 4.918 1.00 . A X . 9 LYS CD 1 1 6 2295 1 1 9 LYS CE C 0.232 8.382 5.077 1.00 . A X . 9 LYS CE 1 1 6 2296 1 1 9 LYS CG C -0.913 6.713 3.598 1.00 . A X . 9 LYS CG 1 1 6 2297 1 1 9 LYS H H -4.355 8.742 2.989 1.00 . A X . 9 LYS H 1 1 6 2298 1 1 9 LYS HA H -2.111 8.125 1.483 1.00 . A X . 9 LYS HA 1 1 6 2299 1 1 9 LYS HB2 H -1.992 8.523 3.868 1.00 . A X . 9 LYS HB2 1 1 6 2300 1 1 9 LYS HB3 H -2.921 7.065 4.187 1.00 . A X . 9 LYS HB3 1 1 6 2301 1 1 9 LYS HD2 H -0.858 6.669 5.729 1.00 . A X . 9 LYS HD2 1 1 6 2302 1 1 9 LYS HD3 H 0.682 6.300 4.947 1.00 . A X . 9 LYS HD3 1 1 6 2303 1 1 9 LYS HE2 H -0.650 9.006 5.052 1.00 . A X . 9 LYS HE2 1 1 6 2304 1 1 9 LYS HE3 H 0.724 8.496 6.031 1.00 . A X . 9 LYS HE3 1 1 6 2305 1 1 9 LYS HG2 H -1.147 5.664 3.496 1.00 . A X . 9 LYS HG2 1 1 6 2306 1 1 9 LYS HG3 H -0.263 7.018 2.792 1.00 . A X . 9 LYS HG3 1 1 6 2307 1 1 9 LYS HZ1 H 1.332 9.846 4.070 1.00 . A X . 9 LYS HZ1 1 1 6 2308 1 1 9 LYS HZ2 H 0.752 8.615 3.057 1.00 . A X . 9 LYS HZ2 1 1 6 2309 1 1 9 LYS HZ3 H 2.073 8.321 4.084 1.00 . A X . 9 LYS HZ3 1 1 6 2310 1 1 9 LYS N N -4.049 8.371 2.137 1.00 . A X . 9 LYS N 1 1 6 2311 1 1 9 LYS NZ N 1.159 8.819 3.997 1.00 . A X . 9 LYS NZ 1 1 6 2312 1 1 9 LYS O O -2.226 5.792 0.650 1.00 . A X . 9 LYS O 1 1 6 2313 1 1 10 PRO C C -4.369 3.929 0.017 1.00 . A X . 10 PRO C 1 1 6 2314 1 1 10 PRO CA C -4.181 4.007 1.533 1.00 . A X . 10 PRO CA 1 1 6 2315 1 1 10 PRO CB C -5.461 3.562 2.244 1.00 . A X . 10 PRO CB 1 1 6 2316 1 1 10 PRO CD C -4.933 5.731 3.084 1.00 . A X . 10 PRO CD 1 1 6 2317 1 1 10 PRO CG C -5.529 4.405 3.465 1.00 . A X . 10 PRO CG 1 1 6 2318 1 1 10 PRO HA H -3.366 3.360 1.824 1.00 . A X . 10 PRO HA 1 1 6 2319 1 1 10 PRO HB2 H -6.311 3.730 1.598 1.00 . A X . 10 PRO HB2 1 1 6 2320 1 1 10 PRO HB3 H -5.394 2.513 2.492 1.00 . A X . 10 PRO HB3 1 1 6 2321 1 1 10 PRO HD2 H -5.697 6.397 2.708 1.00 . A X . 10 PRO HD2 1 1 6 2322 1 1 10 PRO HD3 H -4.428 6.173 3.930 1.00 . A X . 10 PRO HD3 1 1 6 2323 1 1 10 PRO HG2 H -6.558 4.529 3.770 1.00 . A X . 10 PRO HG2 1 1 6 2324 1 1 10 PRO HG3 H -4.955 3.952 4.259 1.00 . A X . 10 PRO HG3 1 1 6 2325 1 1 10 PRO N N -3.970 5.383 2.020 1.00 . A X . 10 PRO N 1 1 6 2326 1 1 10 PRO O O -4.115 2.889 -0.598 1.00 . A X . 10 PRO O 1 1 6 2327 1 1 11 ALA C C -3.838 5.743 -2.710 1.00 . A X . 11 ALA C 1 1 6 2328 1 1 11 ALA CA C -5.026 5.086 -2.012 1.00 . A X . 11 ALA CA 1 1 6 2329 1 1 11 ALA CB C -6.312 5.837 -2.327 1.00 . A X . 11 ALA CB 1 1 6 2330 1 1 11 ALA H H -5.005 5.823 -0.030 1.00 . A X . 11 ALA H 1 1 6 2331 1 1 11 ALA HA H -5.131 4.075 -2.377 1.00 . A X . 11 ALA HA 1 1 6 2332 1 1 11 ALA HB1 H -6.221 6.860 -1.992 1.00 . A X . 11 ALA HB1 1 1 6 2333 1 1 11 ALA HB2 H -7.138 5.364 -1.819 1.00 . A X . 11 ALA HB2 1 1 6 2334 1 1 11 ALA HB3 H -6.488 5.821 -3.393 1.00 . A X . 11 ALA HB3 1 1 6 2335 1 1 11 ALA N N -4.818 5.027 -0.575 1.00 . A X . 11 ALA N 1 1 6 2336 1 1 11 ALA O O -3.322 5.225 -3.704 1.00 . A X . 11 ALA O 1 1 6 2337 1 1 12 LEU C C -0.956 7.158 -2.357 1.00 . A X . 12 LEU C 1 1 6 2338 1 1 12 LEU CA C -2.334 7.652 -2.792 1.00 . A X . 12 LEU CA 1 1 6 2339 1 1 12 LEU CB C -2.514 9.137 -2.440 1.00 . A X . 12 LEU CB 1 1 6 2340 1 1 12 LEU CD1 C -0.374 10.110 -3.381 1.00 . A X . 12 LEU CD1 1 1 6 2341 1 1 12 LEU CD2 C -2.398 9.896 -4.833 1.00 . A X . 12 LEU CD2 1 1 6 2342 1 1 12 LEU CG C -1.896 10.151 -3.419 1.00 . A X . 12 LEU CG 1 1 6 2343 1 1 12 LEU H H -3.770 7.168 -1.310 1.00 . A X . 12 LEU H 1 1 6 2344 1 1 12 LEU HA H -2.424 7.532 -3.862 1.00 . A X . 12 LEU HA 1 1 6 2345 1 1 12 LEU HB2 H -3.574 9.340 -2.374 1.00 . A X . 12 LEU HB2 1 1 6 2346 1 1 12 LEU HB3 H -2.078 9.304 -1.467 1.00 . A X . 12 LEU HB3 1 1 6 2347 1 1 12 LEU HD11 H 0.025 10.827 -4.085 1.00 . A X . 12 LEU HD11 1 1 6 2348 1 1 12 LEU HD12 H -0.036 9.120 -3.643 1.00 . A X . 12 LEU HD12 1 1 6 2349 1 1 12 LEU HD13 H -0.033 10.355 -2.386 1.00 . A X . 12 LEU HD13 1 1 6 2350 1 1 12 LEU HD21 H -2.106 8.903 -5.143 1.00 . A X . 12 LEU HD21 1 1 6 2351 1 1 12 LEU HD22 H -1.969 10.624 -5.506 1.00 . A X . 12 LEU HD22 1 1 6 2352 1 1 12 LEU HD23 H -3.474 9.977 -4.852 1.00 . A X . 12 LEU HD23 1 1 6 2353 1 1 12 LEU HG H -2.205 11.146 -3.133 1.00 . A X . 12 LEU HG 1 1 6 2354 1 1 12 LEU N N -3.388 6.864 -2.166 1.00 . A X . 12 LEU N 1 1 6 2355 1 1 12 LEU O O -0.460 7.526 -1.287 1.00 . A X . 12 LEU O 1 1 6 2356 1 1 13 LEU C C 1.130 5.033 -1.709 1.00 . A X . 13 LEU C 1 1 6 2357 1 1 13 LEU CA C 1.000 5.825 -3.011 1.00 . A X . 13 LEU CA 1 1 6 2358 1 1 13 LEU CB C 2.009 6.981 -3.050 1.00 . A X . 13 LEU CB 1 1 6 2359 1 1 13 LEU CD1 C 3.766 5.745 -4.352 1.00 . A X . 13 LEU CD1 1 1 6 2360 1 1 13 LEU CD2 C 4.385 7.786 -3.045 1.00 . A X . 13 LEU CD2 1 1 6 2361 1 1 13 LEU CG C 3.483 6.562 -3.102 1.00 . A X . 13 LEU CG 1 1 6 2362 1 1 13 LEU H H -0.865 6.015 -3.985 1.00 . A X . 13 LEU H 1 1 6 2363 1 1 13 LEU HA H 1.215 5.158 -3.834 1.00 . A X . 13 LEU HA 1 1 6 2364 1 1 13 LEU HB2 H 1.797 7.586 -3.920 1.00 . A X . 13 LEU HB2 1 1 6 2365 1 1 13 LEU HB3 H 1.862 7.586 -2.167 1.00 . A X . 13 LEU HB3 1 1 6 2366 1 1 13 LEU HD11 H 3.169 4.844 -4.333 1.00 . A X . 13 LEU HD11 1 1 6 2367 1 1 13 LEU HD12 H 4.813 5.482 -4.384 1.00 . A X . 13 LEU HD12 1 1 6 2368 1 1 13 LEU HD13 H 3.513 6.325 -5.226 1.00 . A X . 13 LEU HD13 1 1 6 2369 1 1 13 LEU HD21 H 4.149 8.448 -3.865 1.00 . A X . 13 LEU HD21 1 1 6 2370 1 1 13 LEU HD22 H 5.417 7.476 -3.117 1.00 . A X . 13 LEU HD22 1 1 6 2371 1 1 13 LEU HD23 H 4.231 8.304 -2.109 1.00 . A X . 13 LEU HD23 1 1 6 2372 1 1 13 LEU HG H 3.705 5.942 -2.245 1.00 . A X . 13 LEU HG 1 1 6 2373 1 1 13 LEU N N -0.362 6.320 -3.202 1.00 . A X . 13 LEU N 1 1 6 2374 1 1 13 LEU O O 1.852 5.425 -0.789 1.00 . A X . 13 LEU O 1 1 6 2375 1 1 14 TRP C C 0.962 1.634 -0.980 1.00 . A X . 14 TRP C 1 1 6 2376 1 1 14 TRP CA C 0.507 3.012 -0.509 1.00 . A X . 14 TRP CA 1 1 6 2377 1 1 14 TRP CB C -0.851 2.920 0.199 1.00 . A X . 14 TRP CB 1 1 6 2378 1 1 14 TRP CD1 C -0.371 1.962 2.525 1.00 . A X . 14 TRP CD1 1 1 6 2379 1 1 14 TRP CD2 C -1.562 0.611 1.197 1.00 . A X . 14 TRP CD2 1 1 6 2380 1 1 14 TRP CE2 C -1.370 -0.031 2.434 1.00 . A X . 14 TRP CE2 1 1 6 2381 1 1 14 TRP CE3 C -2.288 -0.048 0.200 1.00 . A X . 14 TRP CE3 1 1 6 2382 1 1 14 TRP CG C -0.910 1.882 1.274 1.00 . A X . 14 TRP CG 1 1 6 2383 1 1 14 TRP CH2 C -2.585 -1.917 1.707 1.00 . A X . 14 TRP CH2 1 1 6 2384 1 1 14 TRP CZ2 C -1.880 -1.297 2.701 1.00 . A X . 14 TRP CZ2 1 1 6 2385 1 1 14 TRP CZ3 C -2.790 -1.306 0.466 1.00 . A X . 14 TRP CZ3 1 1 6 2386 1 1 14 TRP H H -0.181 3.696 -2.386 1.00 . A X . 14 TRP H 1 1 6 2387 1 1 14 TRP HA H 1.240 3.408 0.179 1.00 . A X . 14 TRP HA 1 1 6 2388 1 1 14 TRP HB2 H -1.078 3.872 0.653 1.00 . A X . 14 TRP HB2 1 1 6 2389 1 1 14 TRP HB3 H -1.614 2.686 -0.529 1.00 . A X . 14 TRP HB3 1 1 6 2390 1 1 14 TRP HD1 H 0.190 2.808 2.891 1.00 . A X . 14 TRP HD1 1 1 6 2391 1 1 14 TRP HE1 H -0.356 0.626 4.151 1.00 . A X . 14 TRP HE1 1 1 6 2392 1 1 14 TRP HE3 H -2.453 0.408 -0.765 1.00 . A X . 14 TRP HE3 1 1 6 2393 1 1 14 TRP HH2 H -2.998 -2.902 1.872 1.00 . A X . 14 TRP HH2 1 1 6 2394 1 1 14 TRP HZ2 H -1.730 -1.782 3.654 1.00 . A X . 14 TRP HZ2 1 1 6 2395 1 1 14 TRP HZ3 H -3.353 -1.832 -0.290 1.00 . A X . 14 TRP HZ3 1 1 6 2396 1 1 14 TRP N N 0.422 3.917 -1.645 1.00 . A X . 14 TRP N 1 1 6 2397 1 1 14 TRP NE1 N -0.639 0.812 3.228 1.00 . A X . 14 TRP NE1 1 1 6 2398 1 1 14 TRP O O 1.970 1.105 -0.510 1.00 . A X . 14 TRP O 1 1 6 2399 1 1 15 LYS C C 1.873 -0.265 -3.164 1.00 . A X . 15 LYS C 1 1 6 2400 1 1 15 LYS CA C 0.513 -0.248 -2.472 1.00 . A X . 15 LYS CA 1 1 6 2401 1 1 15 LYS CB C -0.581 -0.655 -3.467 1.00 . A X . 15 LYS CB 1 1 6 2402 1 1 15 LYS CD C -1.240 -2.892 -2.554 1.00 . A X . 15 LYS CD 1 1 6 2403 1 1 15 LYS CE C -1.468 -4.361 -2.872 1.00 . A X . 15 LYS CE 1 1 6 2404 1 1 15 LYS CG C -0.645 -2.148 -3.737 1.00 . A X . 15 LYS CG 1 1 6 2405 1 1 15 LYS H H -0.526 1.586 -2.312 1.00 . A X . 15 LYS H 1 1 6 2406 1 1 15 LYS HA H 0.524 -0.946 -1.649 1.00 . A X . 15 LYS HA 1 1 6 2407 1 1 15 LYS HB2 H -1.539 -0.344 -3.076 1.00 . A X . 15 LYS HB2 1 1 6 2408 1 1 15 LYS HB3 H -0.403 -0.148 -4.404 1.00 . A X . 15 LYS HB3 1 1 6 2409 1 1 15 LYS HD2 H -0.561 -2.816 -1.716 1.00 . A X . 15 LYS HD2 1 1 6 2410 1 1 15 LYS HD3 H -2.186 -2.437 -2.295 1.00 . A X . 15 LYS HD3 1 1 6 2411 1 1 15 LYS HE2 H -2.008 -4.435 -3.805 1.00 . A X . 15 LYS HE2 1 1 6 2412 1 1 15 LYS HE3 H -0.511 -4.849 -2.970 1.00 . A X . 15 LYS HE3 1 1 6 2413 1 1 15 LYS HG2 H -1.261 -2.324 -4.606 1.00 . A X . 15 LYS HG2 1 1 6 2414 1 1 15 LYS HG3 H 0.353 -2.517 -3.917 1.00 . A X . 15 LYS HG3 1 1 6 2415 1 1 15 LYS HZ1 H -1.730 -5.011 -0.901 1.00 . A X . 15 LYS HZ1 1 1 6 2416 1 1 15 LYS HZ2 H -2.426 -6.030 -2.066 1.00 . A X . 15 LYS HZ2 1 1 6 2417 1 1 15 LYS HZ3 H -3.170 -4.557 -1.677 1.00 . A X . 15 LYS HZ3 1 1 6 2418 1 1 15 LYS N N 0.230 1.081 -1.943 1.00 . A X . 15 LYS N 1 1 6 2419 1 1 15 LYS NZ N -2.251 -5.037 -1.806 1.00 . A X . 15 LYS NZ 1 1 6 2420 1 1 15 LYS O O 2.715 -1.125 -2.896 1.00 . A X . 15 LYS O 1 1 6 2421 1 1 16 ALA C C 4.472 1.334 -3.950 1.00 . A X . 16 ALA C 1 1 6 2422 1 1 16 ALA CA C 3.320 0.813 -4.804 1.00 . A X . 16 ALA CA 1 1 6 2423 1 1 16 ALA CB C 3.115 1.715 -6.010 1.00 . A X . 16 ALA CB 1 1 6 2424 1 1 16 ALA H H 1.381 1.389 -4.176 1.00 . A X . 16 ALA H 1 1 6 2425 1 1 16 ALA HA H 3.568 -0.175 -5.163 1.00 . A X . 16 ALA HA 1 1 6 2426 1 1 16 ALA HB1 H 2.302 1.334 -6.611 1.00 . A X . 16 ALA HB1 1 1 6 2427 1 1 16 ALA HB2 H 4.020 1.737 -6.600 1.00 . A X . 16 ALA HB2 1 1 6 2428 1 1 16 ALA HB3 H 2.877 2.715 -5.678 1.00 . A X . 16 ALA HB3 1 1 6 2429 1 1 16 ALA N N 2.085 0.714 -4.037 1.00 . A X . 16 ALA N 1 1 6 2430 1 1 16 ALA O O 5.637 1.185 -4.308 1.00 . A X . 16 ALA O 1 1 6 2431 1 1 17 LEU C C 5.737 1.426 -1.046 1.00 . A X . 17 LEU C 1 1 6 2432 1 1 17 LEU CA C 5.162 2.504 -1.944 1.00 . A X . 17 LEU CA 1 1 6 2433 1 1 17 LEU CB C 4.571 3.634 -1.100 1.00 . A X . 17 LEU CB 1 1 6 2434 1 1 17 LEU CD1 C 6.610 5.101 -1.085 1.00 . A X . 17 LEU CD1 1 1 6 2435 1 1 17 LEU CD2 C 4.867 5.364 0.688 1.00 . A X . 17 LEU CD2 1 1 6 2436 1 1 17 LEU CG C 5.579 4.382 -0.226 1.00 . A X . 17 LEU CG 1 1 6 2437 1 1 17 LEU H H 3.208 1.963 -2.532 1.00 . A X . 17 LEU H 1 1 6 2438 1 1 17 LEU HA H 5.950 2.900 -2.566 1.00 . A X . 17 LEU HA 1 1 6 2439 1 1 17 LEU HB2 H 4.103 4.345 -1.766 1.00 . A X . 17 LEU HB2 1 1 6 2440 1 1 17 LEU HB3 H 3.810 3.216 -0.457 1.00 . A X . 17 LEU HB3 1 1 6 2441 1 1 17 LEU HD11 H 6.112 5.803 -1.739 1.00 . A X . 17 LEU HD11 1 1 6 2442 1 1 17 LEU HD12 H 7.153 4.380 -1.678 1.00 . A X . 17 LEU HD12 1 1 6 2443 1 1 17 LEU HD13 H 7.298 5.632 -0.445 1.00 . A X . 17 LEU HD13 1 1 6 2444 1 1 17 LEU HD21 H 4.175 4.831 1.321 1.00 . A X . 17 LEU HD21 1 1 6 2445 1 1 17 LEU HD22 H 4.327 6.086 0.093 1.00 . A X . 17 LEU HD22 1 1 6 2446 1 1 17 LEU HD23 H 5.595 5.876 1.299 1.00 . A X . 17 LEU HD23 1 1 6 2447 1 1 17 LEU HG H 6.103 3.670 0.394 1.00 . A X . 17 LEU HG 1 1 6 2448 1 1 17 LEU N N 4.146 1.931 -2.811 1.00 . A X . 17 LEU N 1 1 6 2449 1 1 17 LEU O O 6.907 1.471 -0.666 1.00 . A X . 17 LEU O 1 1 6 2450 1 1 18 ALA C C 6.358 -1.533 -0.486 1.00 . A X . 18 ALA C 1 1 6 2451 1 1 18 ALA CA C 5.268 -0.658 0.127 1.00 . A X . 18 ALA CA 1 1 6 2452 1 1 18 ALA CB C 4.040 -1.492 0.455 1.00 . A X . 18 ALA CB 1 1 6 2453 1 1 18 ALA H H 4.002 0.450 -1.141 1.00 . A X . 18 ALA H 1 1 6 2454 1 1 18 ALA HA H 5.637 -0.228 1.043 1.00 . A X . 18 ALA HA 1 1 6 2455 1 1 18 ALA HB1 H 3.646 -1.928 -0.452 1.00 . A X . 18 ALA HB1 1 1 6 2456 1 1 18 ALA HB2 H 3.289 -0.864 0.908 1.00 . A X . 18 ALA HB2 1 1 6 2457 1 1 18 ALA HB3 H 4.313 -2.279 1.143 1.00 . A X . 18 ALA HB3 1 1 6 2458 1 1 18 ALA N N 4.903 0.436 -0.755 1.00 . A X . 18 ALA N 1 1 6 2459 1 1 18 ALA O O 6.994 -2.324 0.208 1.00 . A X . 18 ALA O 1 1 6 2460 1 1 19 LEU C C 8.787 -1.246 -2.815 1.00 . A X . 19 LEU C 1 1 6 2461 1 1 19 LEU CA C 7.607 -2.153 -2.468 1.00 . A X . 19 LEU CA 1 1 6 2462 1 1 19 LEU CB C 7.045 -2.845 -3.719 1.00 . A X . 19 LEU CB 1 1 6 2463 1 1 19 LEU CD1 C 7.473 -1.485 -5.788 1.00 . A X . 19 LEU CD1 1 1 6 2464 1 1 19 LEU CD2 C 5.280 -2.630 -5.479 1.00 . A X . 19 LEU CD2 1 1 6 2465 1 1 19 LEU CG C 6.428 -1.929 -4.779 1.00 . A X . 19 LEU CG 1 1 6 2466 1 1 19 LEU H H 5.998 -0.788 -2.300 1.00 . A X . 19 LEU H 1 1 6 2467 1 1 19 LEU HA H 7.952 -2.913 -1.781 1.00 . A X . 19 LEU HA 1 1 6 2468 1 1 19 LEU HB2 H 7.846 -3.397 -4.184 1.00 . A X . 19 LEU HB2 1 1 6 2469 1 1 19 LEU HB3 H 6.287 -3.548 -3.403 1.00 . A X . 19 LEU HB3 1 1 6 2470 1 1 19 LEU HD11 H 7.888 -2.352 -6.283 1.00 . A X . 19 LEU HD11 1 1 6 2471 1 1 19 LEU HD12 H 8.261 -0.951 -5.278 1.00 . A X . 19 LEU HD12 1 1 6 2472 1 1 19 LEU HD13 H 7.014 -0.838 -6.521 1.00 . A X . 19 LEU HD13 1 1 6 2473 1 1 19 LEU HD21 H 4.520 -2.886 -4.755 1.00 . A X . 19 LEU HD21 1 1 6 2474 1 1 19 LEU HD22 H 5.643 -3.530 -5.953 1.00 . A X . 19 LEU HD22 1 1 6 2475 1 1 19 LEU HD23 H 4.859 -1.973 -6.225 1.00 . A X . 19 LEU HD23 1 1 6 2476 1 1 19 LEU HG H 6.036 -1.046 -4.295 1.00 . A X . 19 LEU HG 1 1 6 2477 1 1 19 LEU N N 6.563 -1.399 -1.788 1.00 . A X . 19 LEU N 1 1 6 2478 1 1 19 LEU O O 9.933 -1.696 -2.858 1.00 . A X . 19 LEU O 1 1 6 2479 1 1 20 LYS C C 10.402 1.296 -2.131 1.00 . A X . 20 LYS C 1 1 6 2480 1 1 20 LYS CA C 9.542 1.012 -3.356 1.00 . A X . 20 LYS CA 1 1 6 2481 1 1 20 LYS CB C 8.928 2.319 -3.866 1.00 . A X . 20 LYS CB 1 1 6 2482 1 1 20 LYS CD C 8.106 3.684 -5.800 1.00 . A X . 20 LYS CD 1 1 6 2483 1 1 20 LYS CE C 8.175 3.846 -7.311 1.00 . A X . 20 LYS CE 1 1 6 2484 1 1 20 LYS CG C 8.611 2.319 -5.351 1.00 . A X . 20 LYS CG 1 1 6 2485 1 1 20 LYS H H 7.569 0.328 -3.016 1.00 . A X . 20 LYS H 1 1 6 2486 1 1 20 LYS HA H 10.169 0.595 -4.131 1.00 . A X . 20 LYS HA 1 1 6 2487 1 1 20 LYS HB2 H 8.010 2.505 -3.328 1.00 . A X . 20 LYS HB2 1 1 6 2488 1 1 20 LYS HB3 H 9.617 3.128 -3.670 1.00 . A X . 20 LYS HB3 1 1 6 2489 1 1 20 LYS HD2 H 7.079 3.797 -5.485 1.00 . A X . 20 LYS HD2 1 1 6 2490 1 1 20 LYS HD3 H 8.712 4.450 -5.337 1.00 . A X . 20 LYS HD3 1 1 6 2491 1 1 20 LYS HE2 H 7.910 4.862 -7.561 1.00 . A X . 20 LYS HE2 1 1 6 2492 1 1 20 LYS HE3 H 9.187 3.653 -7.633 1.00 . A X . 20 LYS HE3 1 1 6 2493 1 1 20 LYS HG2 H 9.507 2.072 -5.905 1.00 . A X . 20 LYS HG2 1 1 6 2494 1 1 20 LYS HG3 H 7.848 1.580 -5.547 1.00 . A X . 20 LYS HG3 1 1 6 2495 1 1 20 LYS HZ1 H 7.445 1.934 -7.752 1.00 . A X . 20 LYS HZ1 1 1 6 2496 1 1 20 LYS HZ2 H 7.393 3.014 -9.057 1.00 . A X . 20 LYS HZ2 1 1 6 2497 1 1 20 LYS HZ3 H 6.264 3.153 -7.800 1.00 . A X . 20 LYS HZ3 1 1 6 2498 1 1 20 LYS N N 8.501 0.035 -3.049 1.00 . A X . 20 LYS N 1 1 6 2499 1 1 20 LYS NZ N 7.256 2.923 -8.026 1.00 . A X . 20 LYS NZ 1 1 6 2500 1 1 20 LYS O O 11.614 1.088 -2.146 1.00 . A X . 20 LYS O 1 1 6 2501 1 1 21 LEU C C 10.183 1.095 1.241 1.00 . A X . 21 LEU C 1 1 6 2502 1 1 21 LEU CA C 10.475 2.113 0.150 1.00 . A X . 21 LEU CA 1 1 6 2503 1 1 21 LEU CB C 10.081 3.521 0.608 1.00 . A X . 21 LEU CB 1 1 6 2504 1 1 21 LEU CD1 C 9.963 5.989 0.173 1.00 . A X . 21 LEU CD1 1 1 6 2505 1 1 21 LEU CD2 C 11.851 4.644 -0.765 1.00 . A X . 21 LEU CD2 1 1 6 2506 1 1 21 LEU CG C 10.375 4.639 -0.396 1.00 . A X . 21 LEU CG 1 1 6 2507 1 1 21 LEU H H 8.786 1.859 -1.098 1.00 . A X . 21 LEU H 1 1 6 2508 1 1 21 LEU HA H 11.533 2.096 -0.068 1.00 . A X . 21 LEU HA 1 1 6 2509 1 1 21 LEU HB2 H 9.021 3.525 0.819 1.00 . A X . 21 LEU HB2 1 1 6 2510 1 1 21 LEU HB3 H 10.615 3.740 1.521 1.00 . A X . 21 LEU HB3 1 1 6 2511 1 1 21 LEU HD11 H 10.512 6.177 1.083 1.00 . A X . 21 LEU HD11 1 1 6 2512 1 1 21 LEU HD12 H 8.905 5.981 0.385 1.00 . A X . 21 LEU HD12 1 1 6 2513 1 1 21 LEU HD13 H 10.180 6.765 -0.547 1.00 . A X . 21 LEU HD13 1 1 6 2514 1 1 21 LEU HD21 H 12.441 4.833 0.119 1.00 . A X . 21 LEU HD21 1 1 6 2515 1 1 21 LEU HD22 H 12.040 5.419 -1.496 1.00 . A X . 21 LEU HD22 1 1 6 2516 1 1 21 LEU HD23 H 12.121 3.684 -1.180 1.00 . A X . 21 LEU HD23 1 1 6 2517 1 1 21 LEU HG H 9.803 4.467 -1.299 1.00 . A X . 21 LEU HG 1 1 6 2518 1 1 21 LEU N N 9.764 1.760 -1.068 1.00 . A X . 21 LEU N 1 1 6 2519 1 1 21 LEU O O 10.412 1.356 2.427 1.00 . A X . 21 LEU O 1 1 6 2520 1 1 22 LYS C C 8.334 -0.742 2.772 1.00 . A X . 22 LYS C 1 1 6 2521 1 1 22 LYS CA C 9.353 -1.163 1.717 1.00 . A X . 22 LYS CA 1 1 6 2522 1 1 22 LYS CB C 10.621 -1.710 2.381 1.00 . A X . 22 LYS CB 1 1 6 2523 1 1 22 LYS CD C 12.710 -3.083 2.166 1.00 . A X . 22 LYS CD 1 1 6 2524 1 1 22 LYS CE C 13.534 -3.983 1.258 1.00 . A X . 22 LYS CE 1 1 6 2525 1 1 22 LYS CG C 11.501 -2.517 1.442 1.00 . A X . 22 LYS CG 1 1 6 2526 1 1 22 LYS H H 9.503 -0.174 -0.139 1.00 . A X . 22 LYS H 1 1 6 2527 1 1 22 LYS HA H 8.913 -1.948 1.118 1.00 . A X . 22 LYS HA 1 1 6 2528 1 1 22 LYS HB2 H 11.201 -0.882 2.759 1.00 . A X . 22 LYS HB2 1 1 6 2529 1 1 22 LYS HB3 H 10.335 -2.346 3.207 1.00 . A X . 22 LYS HB3 1 1 6 2530 1 1 22 LYS HD2 H 13.329 -2.266 2.505 1.00 . A X . 22 LYS HD2 1 1 6 2531 1 1 22 LYS HD3 H 12.372 -3.658 3.016 1.00 . A X . 22 LYS HD3 1 1 6 2532 1 1 22 LYS HE2 H 14.374 -4.363 1.818 1.00 . A X . 22 LYS HE2 1 1 6 2533 1 1 22 LYS HE3 H 12.914 -4.807 0.937 1.00 . A X . 22 LYS HE3 1 1 6 2534 1 1 22 LYS HG2 H 10.924 -3.331 1.032 1.00 . A X . 22 LYS HG2 1 1 6 2535 1 1 22 LYS HG3 H 11.841 -1.875 0.641 1.00 . A X . 22 LYS HG3 1 1 6 2536 1 1 22 LYS HZ1 H 14.500 -2.370 0.338 1.00 . A X . 22 LYS HZ1 1 1 6 2537 1 1 22 LYS HZ2 H 13.255 -3.051 -0.592 1.00 . A X . 22 LYS HZ2 1 1 6 2538 1 1 22 LYS HZ3 H 14.738 -3.855 -0.443 1.00 . A X . 22 LYS HZ3 1 1 6 2539 1 1 22 LYS N N 9.676 -0.062 0.817 1.00 . A X . 22 LYS N 1 1 6 2540 1 1 22 LYS NZ N 14.041 -3.265 0.058 1.00 . A X . 22 LYS NZ 1 1 6 2541 1 1 22 LYS O O 7.547 0.187 2.557 1.00 . A X . 22 LYS O 1 1 6 2542 1 1 23 LYS C C 6.008 -1.650 4.578 1.00 . A X . 23 LYS C 1 1 6 2543 1 1 23 LYS CA C 7.417 -1.226 4.993 1.00 . A X . 23 LYS CA 1 1 6 2544 1 1 23 LYS CB C 7.442 0.235 5.477 1.00 . A X . 23 LYS CB 1 1 6 2545 1 1 23 LYS CD C 6.919 -0.491 7.815 1.00 . A X . 23 LYS CD 1 1 6 2546 1 1 23 LYS CE C 5.957 -0.373 8.980 1.00 . A X . 23 LYS CE 1 1 6 2547 1 1 23 LYS CG C 6.576 0.482 6.700 1.00 . A X . 23 LYS CG 1 1 6 2548 1 1 23 LYS H H 9.047 -2.131 4.010 1.00 . A X . 23 LYS H 1 1 6 2549 1 1 23 LYS HA H 7.728 -1.862 5.808 1.00 . A X . 23 LYS HA 1 1 6 2550 1 1 23 LYS HB2 H 8.459 0.503 5.723 1.00 . A X . 23 LYS HB2 1 1 6 2551 1 1 23 LYS HB3 H 7.093 0.875 4.679 1.00 . A X . 23 LYS HB3 1 1 6 2552 1 1 23 LYS HD2 H 6.872 -1.497 7.428 1.00 . A X . 23 LYS HD2 1 1 6 2553 1 1 23 LYS HD3 H 7.920 -0.284 8.166 1.00 . A X . 23 LYS HD3 1 1 6 2554 1 1 23 LYS HE2 H 6.135 0.565 9.489 1.00 . A X . 23 LYS HE2 1 1 6 2555 1 1 23 LYS HE3 H 4.947 -0.391 8.599 1.00 . A X . 23 LYS HE3 1 1 6 2556 1 1 23 LYS HG2 H 6.740 1.490 7.050 1.00 . A X . 23 LYS HG2 1 1 6 2557 1 1 23 LYS HG3 H 5.539 0.355 6.429 1.00 . A X . 23 LYS HG3 1 1 6 2558 1 1 23 LYS HZ1 H 7.125 -1.528 10.264 1.00 . A X . 23 LYS HZ1 1 1 6 2559 1 1 23 LYS HZ2 H 5.897 -2.396 9.475 1.00 . A X . 23 LYS HZ2 1 1 6 2560 1 1 23 LYS HZ3 H 5.512 -1.365 10.762 1.00 . A X . 23 LYS HZ3 1 1 6 2561 1 1 23 LYS N N 8.359 -1.441 3.902 1.00 . A X . 23 LYS N 1 1 6 2562 1 1 23 LYS NZ N 6.135 -1.490 9.938 1.00 . A X . 23 LYS NZ 1 1 6 2563 1 1 23 LYS O O 5.131 -0.821 4.329 1.00 . A X . 23 LYS O 1 1 6 2564 1 1 24 ALA C C 4.091 -4.508 5.258 1.00 . A X . 24 ALA C 1 1 6 2565 1 1 24 ALA CA C 4.507 -3.513 4.181 1.00 . A X . 24 ALA CA 1 1 6 2566 1 1 24 ALA CB C 4.520 -4.172 2.807 1.00 . A X . 24 ALA CB 1 1 6 2567 1 1 24 ALA H H 6.565 -3.565 4.637 1.00 . A X . 24 ALA H 1 1 6 2568 1 1 24 ALA HA H 3.792 -2.701 4.159 1.00 . A X . 24 ALA HA 1 1 6 2569 1 1 24 ALA HB1 H 5.221 -4.992 2.808 1.00 . A X . 24 ALA HB1 1 1 6 2570 1 1 24 ALA HB2 H 4.815 -3.445 2.064 1.00 . A X . 24 ALA HB2 1 1 6 2571 1 1 24 ALA HB3 H 3.531 -4.539 2.575 1.00 . A X . 24 ALA HB3 1 1 6 2572 1 1 24 ALA N N 5.810 -2.955 4.489 1.00 . A X . 24 ALA N 1 1 6 2573 1 1 24 ALA O O 4.311 -5.726 5.073 1.00 . A X . 24 ALA O 1 1 6 2574 1 1 24 ALA OXT O 3.567 -4.067 6.302 1.00 . A X . 24 ALA OXT 1 1 7 2575 1 1 1 LYS C C 0.026 15.997 0.840 1.00 . A X . 1 LYS C 1 1 7 2576 1 1 1 LYS CA C 0.162 17.301 1.627 1.00 . A X . 1 LYS CA 1 1 7 2577 1 1 1 LYS CB C 1.636 17.575 1.947 1.00 . A X . 1 LYS CB 1 1 7 2578 1 1 1 LYS CD C 2.138 18.853 -0.165 1.00 . A X . 1 LYS CD 1 1 7 2579 1 1 1 LYS CE C 3.090 18.997 -1.342 1.00 . A X . 1 LYS CE 1 1 7 2580 1 1 1 LYS CG C 2.531 17.683 0.720 1.00 . A X . 1 LYS CG 1 1 7 2581 1 1 1 LYS H1 H -1.642 17.158 2.661 1.00 . A X . 1 LYS H1 1 1 7 2582 1 1 1 LYS H2 H -0.481 18.126 3.429 1.00 . A X . 1 LYS H2 1 1 7 2583 1 1 1 LYS H3 H -0.332 16.437 3.461 1.00 . A X . 1 LYS H3 1 1 7 2584 1 1 1 LYS HA H -0.223 18.110 1.020 1.00 . A X . 1 LYS HA 1 1 7 2585 1 1 1 LYS HB2 H 1.706 18.500 2.496 1.00 . A X . 1 LYS HB2 1 1 7 2586 1 1 1 LYS HB3 H 2.011 16.772 2.565 1.00 . A X . 1 LYS HB3 1 1 7 2587 1 1 1 LYS HD2 H 1.139 18.687 -0.541 1.00 . A X . 1 LYS HD2 1 1 7 2588 1 1 1 LYS HD3 H 2.160 19.762 0.420 1.00 . A X . 1 LYS HD3 1 1 7 2589 1 1 1 LYS HE2 H 4.082 19.199 -0.968 1.00 . A X . 1 LYS HE2 1 1 7 2590 1 1 1 LYS HE3 H 3.099 18.069 -1.896 1.00 . A X . 1 LYS HE3 1 1 7 2591 1 1 1 LYS HG2 H 3.552 17.815 1.042 1.00 . A X . 1 LYS HG2 1 1 7 2592 1 1 1 LYS HG3 H 2.448 16.770 0.148 1.00 . A X . 1 LYS HG3 1 1 7 2593 1 1 1 LYS HZ1 H 2.692 21.008 -1.746 1.00 . A X . 1 LYS HZ1 1 1 7 2594 1 1 1 LYS HZ2 H 1.725 19.926 -2.620 1.00 . A X . 1 LYS HZ2 1 1 7 2595 1 1 1 LYS HZ3 H 3.348 20.158 -3.057 1.00 . A X . 1 LYS HZ3 1 1 7 2596 1 1 1 LYS N N -0.625 17.250 2.879 1.00 . A X . 1 LYS N 1 1 7 2597 1 1 1 LYS NZ N 2.686 20.098 -2.253 1.00 . A X . 1 LYS NZ 1 1 7 2598 1 1 1 LYS O O -0.526 15.980 -0.258 1.00 . A X . 1 LYS O 1 1 7 2599 1 1 2 LYS C C -0.838 12.957 0.728 1.00 . A X . 2 LYS C 1 1 7 2600 1 1 2 LYS CA C 0.538 13.621 0.725 1.00 . A X . 2 LYS CA 1 1 7 2601 1 1 2 LYS CB C 1.563 12.669 1.361 1.00 . A X . 2 LYS CB 1 1 7 2602 1 1 2 LYS CD C 3.238 14.082 2.613 1.00 . A X . 2 LYS CD 1 1 7 2603 1 1 2 LYS CE C 4.672 14.584 2.665 1.00 . A X . 2 LYS CE 1 1 7 2604 1 1 2 LYS CG C 2.991 13.203 1.398 1.00 . A X . 2 LYS CG 1 1 7 2605 1 1 2 LYS H H 0.833 14.954 2.345 1.00 . A X . 2 LYS H 1 1 7 2606 1 1 2 LYS HA H 0.829 13.809 -0.298 1.00 . A X . 2 LYS HA 1 1 7 2607 1 1 2 LYS HB2 H 1.258 12.461 2.377 1.00 . A X . 2 LYS HB2 1 1 7 2608 1 1 2 LYS HB3 H 1.563 11.744 0.802 1.00 . A X . 2 LYS HB3 1 1 7 2609 1 1 2 LYS HD2 H 2.574 14.932 2.570 1.00 . A X . 2 LYS HD2 1 1 7 2610 1 1 2 LYS HD3 H 3.034 13.508 3.505 1.00 . A X . 2 LYS HD3 1 1 7 2611 1 1 2 LYS HE2 H 5.341 13.736 2.631 1.00 . A X . 2 LYS HE2 1 1 7 2612 1 1 2 LYS HE3 H 4.849 15.219 1.808 1.00 . A X . 2 LYS HE3 1 1 7 2613 1 1 2 LYS HG2 H 3.673 12.368 1.431 1.00 . A X . 2 LYS HG2 1 1 7 2614 1 1 2 LYS HG3 H 3.170 13.781 0.504 1.00 . A X . 2 LYS HG3 1 1 7 2615 1 1 2 LYS HZ1 H 5.894 15.770 3.874 1.00 . A X . 2 LYS HZ1 1 1 7 2616 1 1 2 LYS HZ2 H 4.874 14.733 4.741 1.00 . A X . 2 LYS HZ2 1 1 7 2617 1 1 2 LYS HZ3 H 4.245 16.127 4.007 1.00 . A X . 2 LYS HZ3 1 1 7 2618 1 1 2 LYS N N 0.505 14.902 1.421 1.00 . A X . 2 LYS N 1 1 7 2619 1 1 2 LYS NZ N 4.940 15.358 3.905 1.00 . A X . 2 LYS NZ 1 1 7 2620 1 1 2 LYS O O -1.173 12.205 -0.185 1.00 . A X . 2 LYS O 1 1 7 2621 1 1 3 LEU C C -3.867 12.932 0.721 1.00 . A X . 3 LEU C 1 1 7 2622 1 1 3 LEU CA C -2.950 12.631 1.906 1.00 . A X . 3 LEU CA 1 1 7 2623 1 1 3 LEU CB C -3.604 13.099 3.210 1.00 . A X . 3 LEU CB 1 1 7 2624 1 1 3 LEU CD1 C -3.593 13.215 5.714 1.00 . A X . 3 LEU CD1 1 1 7 2625 1 1 3 LEU CD2 C -2.824 11.136 4.559 1.00 . A X . 3 LEU CD2 1 1 7 2626 1 1 3 LEU CG C -2.891 12.654 4.487 1.00 . A X . 3 LEU CG 1 1 7 2627 1 1 3 LEU H H -1.321 13.886 2.434 1.00 . A X . 3 LEU H 1 1 7 2628 1 1 3 LEU HA H -2.803 11.565 1.959 1.00 . A X . 3 LEU HA 1 1 7 2629 1 1 3 LEU HB2 H -3.641 14.179 3.200 1.00 . A X . 3 LEU HB2 1 1 7 2630 1 1 3 LEU HB3 H -4.615 12.722 3.238 1.00 . A X . 3 LEU HB3 1 1 7 2631 1 1 3 LEU HD11 H -3.078 12.887 6.604 1.00 . A X . 3 LEU HD11 1 1 7 2632 1 1 3 LEU HD12 H -4.614 12.865 5.739 1.00 . A X . 3 LEU HD12 1 1 7 2633 1 1 3 LEU HD13 H -3.582 14.295 5.671 1.00 . A X . 3 LEU HD13 1 1 7 2634 1 1 3 LEU HD21 H -2.295 10.759 3.697 1.00 . A X . 3 LEU HD21 1 1 7 2635 1 1 3 LEU HD22 H -3.824 10.730 4.572 1.00 . A X . 3 LEU HD22 1 1 7 2636 1 1 3 LEU HD23 H -2.304 10.842 5.457 1.00 . A X . 3 LEU HD23 1 1 7 2637 1 1 3 LEU HG H -1.881 13.034 4.478 1.00 . A X . 3 LEU HG 1 1 7 2638 1 1 3 LEU N N -1.634 13.249 1.751 1.00 . A X . 3 LEU N 1 1 7 2639 1 1 3 LEU O O -4.755 12.145 0.396 1.00 . A X . 3 LEU O 1 1 7 2640 1 1 4 LYS C C -3.829 14.035 -2.387 1.00 . A X . 4 LYS C 1 1 7 2641 1 1 4 LYS CA C -4.467 14.459 -1.069 1.00 . A X . 4 LYS CA 1 1 7 2642 1 1 4 LYS CB C -4.712 15.972 -1.060 1.00 . A X . 4 LYS CB 1 1 7 2643 1 1 4 LYS CD C -5.730 16.037 1.257 1.00 . A X . 4 LYS CD 1 1 7 2644 1 1 4 LYS CE C -7.004 16.273 2.055 1.00 . A X . 4 LYS CE 1 1 7 2645 1 1 4 LYS CG C -5.906 16.396 -0.212 1.00 . A X . 4 LYS CG 1 1 7 2646 1 1 4 LYS H H -2.908 14.643 0.352 1.00 . A X . 4 LYS H 1 1 7 2647 1 1 4 LYS HA H -5.418 13.955 -0.971 1.00 . A X . 4 LYS HA 1 1 7 2648 1 1 4 LYS HB2 H -3.830 16.463 -0.674 1.00 . A X . 4 LYS HB2 1 1 7 2649 1 1 4 LYS HB3 H -4.882 16.304 -2.075 1.00 . A X . 4 LYS HB3 1 1 7 2650 1 1 4 LYS HD2 H -5.458 14.996 1.333 1.00 . A X . 4 LYS HD2 1 1 7 2651 1 1 4 LYS HD3 H -4.941 16.646 1.671 1.00 . A X . 4 LYS HD3 1 1 7 2652 1 1 4 LYS HE2 H -7.786 15.641 1.659 1.00 . A X . 4 LYS HE2 1 1 7 2653 1 1 4 LYS HE3 H -6.819 16.010 3.086 1.00 . A X . 4 LYS HE3 1 1 7 2654 1 1 4 LYS HG2 H -6.029 17.464 -0.296 1.00 . A X . 4 LYS HG2 1 1 7 2655 1 1 4 LYS HG3 H -6.792 15.904 -0.588 1.00 . A X . 4 LYS HG3 1 1 7 2656 1 1 4 LYS HZ1 H -6.688 18.317 2.325 1.00 . A X . 4 LYS HZ1 1 1 7 2657 1 1 4 LYS HZ2 H -8.291 17.827 2.593 1.00 . A X . 4 LYS HZ2 1 1 7 2658 1 1 4 LYS HZ3 H -7.694 17.946 1.011 1.00 . A X . 4 LYS HZ3 1 1 7 2659 1 1 4 LYS N N -3.644 14.064 0.068 1.00 . A X . 4 LYS N 1 1 7 2660 1 1 4 LYS NZ N -7.449 17.689 1.988 1.00 . A X . 4 LYS NZ 1 1 7 2661 1 1 4 LYS O O -4.286 14.424 -3.463 1.00 . A X . 4 LYS O 1 1 7 2662 1 1 5 LEU C C -2.100 11.233 -3.545 1.00 . A X . 5 LEU C 1 1 7 2663 1 1 5 LEU CA C -2.085 12.758 -3.495 1.00 . A X . 5 LEU CA 1 1 7 2664 1 1 5 LEU CB C -0.641 13.270 -3.509 1.00 . A X . 5 LEU CB 1 1 7 2665 1 1 5 LEU CD1 C 0.988 15.175 -3.452 1.00 . A X . 5 LEU CD1 1 1 7 2666 1 1 5 LEU CD2 C -1.167 15.430 -4.681 1.00 . A X . 5 LEU CD2 1 1 7 2667 1 1 5 LEU CG C -0.482 14.794 -3.481 1.00 . A X . 5 LEU CG 1 1 7 2668 1 1 5 LEU H H -2.440 12.971 -1.418 1.00 . A X . 5 LEU H 1 1 7 2669 1 1 5 LEU HA H -2.606 13.142 -4.356 1.00 . A X . 5 LEU HA 1 1 7 2670 1 1 5 LEU HB2 H -0.130 12.861 -2.648 1.00 . A X . 5 LEU HB2 1 1 7 2671 1 1 5 LEU HB3 H -0.158 12.896 -4.400 1.00 . A X . 5 LEU HB3 1 1 7 2672 1 1 5 LEU HD11 H 1.078 16.250 -3.406 1.00 . A X . 5 LEU HD11 1 1 7 2673 1 1 5 LEU HD12 H 1.472 14.812 -4.345 1.00 . A X . 5 LEU HD12 1 1 7 2674 1 1 5 LEU HD13 H 1.457 14.736 -2.583 1.00 . A X . 5 LEU HD13 1 1 7 2675 1 1 5 LEU HD21 H -2.220 15.185 -4.667 1.00 . A X . 5 LEU HD21 1 1 7 2676 1 1 5 LEU HD22 H -0.721 15.054 -5.590 1.00 . A X . 5 LEU HD22 1 1 7 2677 1 1 5 LEU HD23 H -1.047 16.503 -4.636 1.00 . A X . 5 LEU HD23 1 1 7 2678 1 1 5 LEU HG H -0.946 15.181 -2.585 1.00 . A X . 5 LEU HG 1 1 7 2679 1 1 5 LEU N N -2.773 13.238 -2.304 1.00 . A X . 5 LEU N 1 1 7 2680 1 1 5 LEU O O -1.641 10.623 -4.513 1.00 . A X . 5 LEU O 1 1 7 2681 1 1 6 ALA C C -3.572 8.513 -3.394 1.00 . A X . 6 ALA C 1 1 7 2682 1 1 6 ALA CA C -2.661 9.174 -2.363 1.00 . A X . 6 ALA CA 1 1 7 2683 1 1 6 ALA CB C -3.073 8.776 -0.952 1.00 . A X . 6 ALA CB 1 1 7 2684 1 1 6 ALA H H -3.083 11.172 -1.815 1.00 . A X . 6 ALA H 1 1 7 2685 1 1 6 ALA HA H -1.651 8.826 -2.527 1.00 . A X . 6 ALA HA 1 1 7 2686 1 1 6 ALA HB1 H -2.442 9.280 -0.235 1.00 . A X . 6 ALA HB1 1 1 7 2687 1 1 6 ALA HB2 H -2.967 7.706 -0.834 1.00 . A X . 6 ALA HB2 1 1 7 2688 1 1 6 ALA HB3 H -4.103 9.054 -0.784 1.00 . A X . 6 ALA HB3 1 1 7 2689 1 1 6 ALA N N -2.659 10.627 -2.505 1.00 . A X . 6 ALA N 1 1 7 2690 1 1 6 ALA O O -3.215 7.502 -3.993 1.00 . A X . 6 ALA O 1 1 7 2691 1 1 7 LEU C C -5.396 9.013 -5.988 1.00 . A X . 7 LEU C 1 1 7 2692 1 1 7 LEU CA C -5.704 8.551 -4.561 1.00 . A X . 7 LEU CA 1 1 7 2693 1 1 7 LEU CB C -7.124 8.968 -4.152 1.00 . A X . 7 LEU CB 1 1 7 2694 1 1 7 LEU CD1 C -8.208 6.734 -4.561 1.00 . A X . 7 LEU CD1 1 1 7 2695 1 1 7 LEU CD2 C -9.607 8.806 -4.458 1.00 . A X . 7 LEU CD2 1 1 7 2696 1 1 7 LEU CG C -8.262 8.225 -4.863 1.00 . A X . 7 LEU CG 1 1 7 2697 1 1 7 LEU H H -4.944 9.940 -3.155 1.00 . A X . 7 LEU H 1 1 7 2698 1 1 7 LEU HA H -5.628 7.474 -4.520 1.00 . A X . 7 LEU HA 1 1 7 2699 1 1 7 LEU HB2 H -7.226 8.809 -3.090 1.00 . A X . 7 LEU HB2 1 1 7 2700 1 1 7 LEU HB3 H -7.236 10.024 -4.351 1.00 . A X . 7 LEU HB3 1 1 7 2701 1 1 7 LEU HD11 H -9.010 6.232 -5.084 1.00 . A X . 7 LEU HD11 1 1 7 2702 1 1 7 LEU HD12 H -8.318 6.577 -3.498 1.00 . A X . 7 LEU HD12 1 1 7 2703 1 1 7 LEU HD13 H -7.260 6.334 -4.889 1.00 . A X . 7 LEU HD13 1 1 7 2704 1 1 7 LEU HD21 H -9.724 8.727 -3.387 1.00 . A X . 7 LEU HD21 1 1 7 2705 1 1 7 LEU HD22 H -10.399 8.257 -4.948 1.00 . A X . 7 LEU HD22 1 1 7 2706 1 1 7 LEU HD23 H -9.654 9.845 -4.751 1.00 . A X . 7 LEU HD23 1 1 7 2707 1 1 7 LEU HG H -8.151 8.352 -5.930 1.00 . A X . 7 LEU HG 1 1 7 2708 1 1 7 LEU N N -4.732 9.108 -3.623 1.00 . A X . 7 LEU N 1 1 7 2709 1 1 7 LEU O O -6.275 9.063 -6.849 1.00 . A X . 7 LEU O 1 1 7 2710 1 1 8 ALA C C -2.367 9.254 -7.954 1.00 . A X . 8 ALA C 1 1 7 2711 1 1 8 ALA CA C -3.715 9.835 -7.534 1.00 . A X . 8 ALA CA 1 1 7 2712 1 1 8 ALA CB C -3.653 11.355 -7.515 1.00 . A X . 8 ALA CB 1 1 7 2713 1 1 8 ALA H H -3.466 9.227 -5.527 1.00 . A X . 8 ALA H 1 1 7 2714 1 1 8 ALA HA H -4.463 9.542 -8.256 1.00 . A X . 8 ALA HA 1 1 7 2715 1 1 8 ALA HB1 H -2.915 11.676 -6.794 1.00 . A X . 8 ALA HB1 1 1 7 2716 1 1 8 ALA HB2 H -4.620 11.749 -7.241 1.00 . A X . 8 ALA HB2 1 1 7 2717 1 1 8 ALA HB3 H -3.380 11.717 -8.495 1.00 . A X . 8 ALA HB3 1 1 7 2718 1 1 8 ALA N N -4.133 9.335 -6.235 1.00 . A X . 8 ALA N 1 1 7 2719 1 1 8 ALA O O -2.271 8.568 -8.972 1.00 . A X . 8 ALA O 1 1 7 2720 1 1 9 LYS C C 0.259 7.611 -7.356 1.00 . A X . 9 LYS C 1 1 7 2721 1 1 9 LYS CA C 0.028 9.118 -7.529 1.00 . A X . 9 LYS CA 1 1 7 2722 1 1 9 LYS CB C 1.058 9.925 -6.732 1.00 . A X . 9 LYS CB 1 1 7 2723 1 1 9 LYS CD C 3.466 10.555 -6.415 1.00 . A X . 9 LYS CD 1 1 7 2724 1 1 9 LYS CE C 3.255 11.960 -6.951 1.00 . A X . 9 LYS CE 1 1 7 2725 1 1 9 LYS CG C 2.500 9.574 -7.056 1.00 . A X . 9 LYS CG 1 1 7 2726 1 1 9 LYS H H -1.478 9.976 -6.304 1.00 . A X . 9 LYS H 1 1 7 2727 1 1 9 LYS HA H 0.148 9.355 -8.575 1.00 . A X . 9 LYS HA 1 1 7 2728 1 1 9 LYS HB2 H 0.909 10.974 -6.936 1.00 . A X . 9 LYS HB2 1 1 7 2729 1 1 9 LYS HB3 H 0.897 9.748 -5.679 1.00 . A X . 9 LYS HB3 1 1 7 2730 1 1 9 LYS HD2 H 3.307 10.559 -5.348 1.00 . A X . 9 LYS HD2 1 1 7 2731 1 1 9 LYS HD3 H 4.477 10.246 -6.632 1.00 . A X . 9 LYS HD3 1 1 7 2732 1 1 9 LYS HE2 H 3.375 11.940 -8.023 1.00 . A X . 9 LYS HE2 1 1 7 2733 1 1 9 LYS HE3 H 2.249 12.275 -6.710 1.00 . A X . 9 LYS HE3 1 1 7 2734 1 1 9 LYS HG2 H 2.710 8.582 -6.685 1.00 . A X . 9 LYS HG2 1 1 7 2735 1 1 9 LYS HG3 H 2.634 9.595 -8.128 1.00 . A X . 9 LYS HG3 1 1 7 2736 1 1 9 LYS HZ1 H 5.194 12.653 -6.615 1.00 . A X . 9 LYS HZ1 1 1 7 2737 1 1 9 LYS HZ2 H 4.120 12.965 -5.338 1.00 . A X . 9 LYS HZ2 1 1 7 2738 1 1 9 LYS HZ3 H 4.032 13.882 -6.763 1.00 . A X . 9 LYS HZ3 1 1 7 2739 1 1 9 LYS N N -1.331 9.511 -7.159 1.00 . A X . 9 LYS N 1 1 7 2740 1 1 9 LYS NZ N 4.216 12.931 -6.377 1.00 . A X . 9 LYS NZ 1 1 7 2741 1 1 9 LYS O O 0.670 6.945 -8.308 1.00 . A X . 9 LYS O 1 1 7 2742 1 1 10 PRO C C -0.944 4.812 -6.655 1.00 . A X . 10 PRO C 1 1 7 2743 1 1 10 PRO CA C 0.157 5.594 -5.945 1.00 . A X . 10 PRO CA 1 1 7 2744 1 1 10 PRO CB C 0.032 5.417 -4.423 1.00 . A X . 10 PRO CB 1 1 7 2745 1 1 10 PRO CD C -0.306 7.730 -4.898 1.00 . A X . 10 PRO CD 1 1 7 2746 1 1 10 PRO CG C 0.202 6.784 -3.852 1.00 . A X . 10 PRO CG 1 1 7 2747 1 1 10 PRO HA H 1.119 5.234 -6.274 1.00 . A X . 10 PRO HA 1 1 7 2748 1 1 10 PRO HB2 H -0.938 5.006 -4.185 1.00 . A X . 10 PRO HB2 1 1 7 2749 1 1 10 PRO HB3 H 0.806 4.746 -4.075 1.00 . A X . 10 PRO HB3 1 1 7 2750 1 1 10 PRO HD2 H -1.376 7.862 -4.803 1.00 . A X . 10 PRO HD2 1 1 7 2751 1 1 10 PRO HD3 H 0.203 8.680 -4.833 1.00 . A X . 10 PRO HD3 1 1 7 2752 1 1 10 PRO HG2 H -0.377 6.883 -2.946 1.00 . A X . 10 PRO HG2 1 1 7 2753 1 1 10 PRO HG3 H 1.248 6.973 -3.654 1.00 . A X . 10 PRO HG3 1 1 7 2754 1 1 10 PRO N N 0.031 7.040 -6.151 1.00 . A X . 10 PRO N 1 1 7 2755 1 1 10 PRO O O -0.807 3.611 -6.901 1.00 . A X . 10 PRO O 1 1 7 2756 1 1 11 ALA C C -3.930 3.934 -6.734 1.00 . A X . 11 ALA C 1 1 7 2757 1 1 11 ALA CA C -3.211 4.943 -7.631 1.00 . A X . 11 ALA CA 1 1 7 2758 1 1 11 ALA CB C -2.823 4.306 -8.961 1.00 . A X . 11 ALA CB 1 1 7 2759 1 1 11 ALA H H -2.055 6.468 -6.728 1.00 . A X . 11 ALA H 1 1 7 2760 1 1 11 ALA HA H -3.892 5.757 -7.842 1.00 . A X . 11 ALA HA 1 1 7 2761 1 1 11 ALA HB1 H -3.709 3.933 -9.454 1.00 . A X . 11 ALA HB1 1 1 7 2762 1 1 11 ALA HB2 H -2.137 3.492 -8.782 1.00 . A X . 11 ALA HB2 1 1 7 2763 1 1 11 ALA HB3 H -2.348 5.047 -9.589 1.00 . A X . 11 ALA HB3 1 1 7 2764 1 1 11 ALA N N -2.039 5.517 -6.960 1.00 . A X . 11 ALA N 1 1 7 2765 1 1 11 ALA O O -4.929 3.334 -7.130 1.00 . A X . 11 ALA O 1 1 7 2766 1 1 12 LEU C C -3.908 3.491 -3.164 1.00 . A X . 12 LEU C 1 1 7 2767 1 1 12 LEU CA C -3.969 2.851 -4.546 1.00 . A X . 12 LEU CA 1 1 7 2768 1 1 12 LEU CB C -3.179 1.537 -4.549 1.00 . A X . 12 LEU CB 1 1 7 2769 1 1 12 LEU CD1 C -2.322 -0.485 -5.763 1.00 . A X . 12 LEU CD1 1 1 7 2770 1 1 12 LEU CD2 C -4.679 0.261 -6.100 1.00 . A X . 12 LEU CD2 1 1 7 2771 1 1 12 LEU CG C -3.252 0.717 -5.842 1.00 . A X . 12 LEU CG 1 1 7 2772 1 1 12 LEU H H -2.650 4.318 -5.265 1.00 . A X . 12 LEU H 1 1 7 2773 1 1 12 LEU HA H -4.998 2.656 -4.804 1.00 . A X . 12 LEU HA 1 1 7 2774 1 1 12 LEU HB2 H -2.142 1.768 -4.355 1.00 . A X . 12 LEU HB2 1 1 7 2775 1 1 12 LEU HB3 H -3.547 0.922 -3.743 1.00 . A X . 12 LEU HB3 1 1 7 2776 1 1 12 LEU HD11 H -2.366 -1.039 -6.689 1.00 . A X . 12 LEU HD11 1 1 7 2777 1 1 12 LEU HD12 H -2.627 -1.124 -4.947 1.00 . A X . 12 LEU HD12 1 1 7 2778 1 1 12 LEU HD13 H -1.310 -0.145 -5.595 1.00 . A X . 12 LEU HD13 1 1 7 2779 1 1 12 LEU HD21 H -5.018 -0.344 -5.271 1.00 . A X . 12 LEU HD21 1 1 7 2780 1 1 12 LEU HD22 H -4.714 -0.320 -7.009 1.00 . A X . 12 LEU HD22 1 1 7 2781 1 1 12 LEU HD23 H -5.319 1.125 -6.200 1.00 . A X . 12 LEU HD23 1 1 7 2782 1 1 12 LEU HG H -2.939 1.333 -6.676 1.00 . A X . 12 LEU HG 1 1 7 2783 1 1 12 LEU N N -3.421 3.777 -5.522 1.00 . A X . 12 LEU N 1 1 7 2784 1 1 12 LEU O O -3.574 4.668 -3.046 1.00 . A X . 12 LEU O 1 1 7 2785 1 1 13 LEU C C -2.740 3.663 -0.411 1.00 . A X . 13 LEU C 1 1 7 2786 1 1 13 LEU CA C -4.166 3.234 -0.761 1.00 . A X . 13 LEU CA 1 1 7 2787 1 1 13 LEU CB C -4.666 2.170 0.220 1.00 . A X . 13 LEU CB 1 1 7 2788 1 1 13 LEU CD1 C -5.768 3.809 1.764 1.00 . A X . 13 LEU CD1 1 1 7 2789 1 1 13 LEU CD2 C -5.299 1.475 2.539 1.00 . A X . 13 LEU CD2 1 1 7 2790 1 1 13 LEU CG C -4.814 2.629 1.672 1.00 . A X . 13 LEU CG 1 1 7 2791 1 1 13 LEU H H -4.497 1.788 -2.281 1.00 . A X . 13 LEU H 1 1 7 2792 1 1 13 LEU HA H -4.814 4.099 -0.706 1.00 . A X . 13 LEU HA 1 1 7 2793 1 1 13 LEU HB2 H -5.629 1.819 -0.122 1.00 . A X . 13 LEU HB2 1 1 7 2794 1 1 13 LEU HB3 H -3.974 1.343 0.199 1.00 . A X . 13 LEU HB3 1 1 7 2795 1 1 13 LEU HD11 H -5.397 4.617 1.151 1.00 . A X . 13 LEU HD11 1 1 7 2796 1 1 13 LEU HD12 H -5.838 4.139 2.791 1.00 . A X . 13 LEU HD12 1 1 7 2797 1 1 13 LEU HD13 H -6.745 3.511 1.413 1.00 . A X . 13 LEU HD13 1 1 7 2798 1 1 13 LEU HD21 H -5.389 1.808 3.562 1.00 . A X . 13 LEU HD21 1 1 7 2799 1 1 13 LEU HD22 H -4.589 0.663 2.484 1.00 . A X . 13 LEU HD22 1 1 7 2800 1 1 13 LEU HD23 H -6.262 1.136 2.184 1.00 . A X . 13 LEU HD23 1 1 7 2801 1 1 13 LEU HG H -3.851 2.947 2.044 1.00 . A X . 13 LEU HG 1 1 7 2802 1 1 13 LEU N N -4.219 2.722 -2.127 1.00 . A X . 13 LEU N 1 1 7 2803 1 1 13 LEU O O -2.498 4.821 -0.068 1.00 . A X . 13 LEU O 1 1 7 2804 1 1 14 TRP C C 0.475 1.880 -0.857 1.00 . A X . 14 TRP C 1 1 7 2805 1 1 14 TRP CA C -0.380 3.015 -0.310 1.00 . A X . 14 TRP CA 1 1 7 2806 1 1 14 TRP CB C -0.051 3.265 1.174 1.00 . A X . 14 TRP CB 1 1 7 2807 1 1 14 TRP CD1 C -0.553 0.905 2.074 1.00 . A X . 14 TRP CD1 1 1 7 2808 1 1 14 TRP CD2 C -1.435 2.566 3.283 1.00 . A X . 14 TRP CD2 1 1 7 2809 1 1 14 TRP CE2 C -1.779 1.343 3.885 1.00 . A X . 14 TRP CE2 1 1 7 2810 1 1 14 TRP CE3 C -1.874 3.754 3.875 1.00 . A X . 14 TRP CE3 1 1 7 2811 1 1 14 TRP CG C -0.652 2.266 2.124 1.00 . A X . 14 TRP CG 1 1 7 2812 1 1 14 TRP CH2 C -2.965 2.452 5.600 1.00 . A X . 14 TRP CH2 1 1 7 2813 1 1 14 TRP CZ2 C -2.549 1.273 5.042 1.00 . A X . 14 TRP CZ2 1 1 7 2814 1 1 14 TRP CZ3 C -2.637 3.684 5.025 1.00 . A X . 14 TRP CZ3 1 1 7 2815 1 1 14 TRP H H -2.074 1.801 -0.699 1.00 . A X . 14 TRP H 1 1 7 2816 1 1 14 TRP HA H -0.155 3.910 -0.871 1.00 . A X . 14 TRP HA 1 1 7 2817 1 1 14 TRP HB2 H 1.020 3.233 1.304 1.00 . A X . 14 TRP HB2 1 1 7 2818 1 1 14 TRP HB3 H -0.408 4.245 1.451 1.00 . A X . 14 TRP HB3 1 1 7 2819 1 1 14 TRP HD1 H -0.021 0.364 1.307 1.00 . A X . 14 TRP HD1 1 1 7 2820 1 1 14 TRP HE1 H -1.320 -0.622 3.305 1.00 . A X . 14 TRP HE1 1 1 7 2821 1 1 14 TRP HE3 H -1.632 4.717 3.443 1.00 . A X . 14 TRP HE3 1 1 7 2822 1 1 14 TRP HH2 H -3.565 2.444 6.497 1.00 . A X . 14 TRP HH2 1 1 7 2823 1 1 14 TRP HZ2 H -2.809 0.332 5.499 1.00 . A X . 14 TRP HZ2 1 1 7 2824 1 1 14 TRP HZ3 H -2.989 4.593 5.493 1.00 . A X . 14 TRP HZ3 1 1 7 2825 1 1 14 TRP N N -1.802 2.723 -0.506 1.00 . A X . 14 TRP N 1 1 7 2826 1 1 14 TRP NE1 N -1.237 0.343 3.124 1.00 . A X . 14 TRP NE1 1 1 7 2827 1 1 14 TRP O O 1.596 1.648 -0.406 1.00 . A X . 14 TRP O 1 1 7 2828 1 1 15 LYS C C 1.343 0.316 -3.673 1.00 . A X . 15 LYS C 1 1 7 2829 1 1 15 LYS CA C 0.592 -0.001 -2.382 1.00 . A X . 15 LYS CA 1 1 7 2830 1 1 15 LYS CB C -0.448 -1.094 -2.626 1.00 . A X . 15 LYS CB 1 1 7 2831 1 1 15 LYS CD C -2.334 -2.469 -1.708 1.00 . A X . 15 LYS CD 1 1 7 2832 1 1 15 LYS CE C -3.103 -2.896 -0.467 1.00 . A X . 15 LYS CE 1 1 7 2833 1 1 15 LYS CG C -1.210 -1.503 -1.375 1.00 . A X . 15 LYS CG 1 1 7 2834 1 1 15 LYS H H -0.901 1.485 -2.242 1.00 . A X . 15 LYS H 1 1 7 2835 1 1 15 LYS HA H 1.301 -0.351 -1.646 1.00 . A X . 15 LYS HA 1 1 7 2836 1 1 15 LYS HB2 H -1.161 -0.736 -3.353 1.00 . A X . 15 LYS HB2 1 1 7 2837 1 1 15 LYS HB3 H 0.050 -1.968 -3.022 1.00 . A X . 15 LYS HB3 1 1 7 2838 1 1 15 LYS HD2 H -3.016 -1.990 -2.395 1.00 . A X . 15 LYS HD2 1 1 7 2839 1 1 15 LYS HD3 H -1.910 -3.346 -2.175 1.00 . A X . 15 LYS HD3 1 1 7 2840 1 1 15 LYS HE2 H -2.437 -3.445 0.179 1.00 . A X . 15 LYS HE2 1 1 7 2841 1 1 15 LYS HE3 H -3.458 -2.015 0.046 1.00 . A X . 15 LYS HE3 1 1 7 2842 1 1 15 LYS HG2 H -0.527 -1.985 -0.691 1.00 . A X . 15 LYS HG2 1 1 7 2843 1 1 15 LYS HG3 H -1.628 -0.621 -0.913 1.00 . A X . 15 LYS HG3 1 1 7 2844 1 1 15 LYS HZ1 H -4.721 -4.117 0.062 1.00 . A X . 15 LYS HZ1 1 1 7 2845 1 1 15 LYS HZ2 H -3.957 -4.576 -1.381 1.00 . A X . 15 LYS HZ2 1 1 7 2846 1 1 15 LYS HZ3 H -4.970 -3.218 -1.353 1.00 . A X . 15 LYS HZ3 1 1 7 2847 1 1 15 LYS N N -0.057 1.183 -1.847 1.00 . A X . 15 LYS N 1 1 7 2848 1 1 15 LYS NZ N -4.265 -3.761 -0.808 1.00 . A X . 15 LYS NZ 1 1 7 2849 1 1 15 LYS O O 1.139 -0.333 -4.697 1.00 . A X . 15 LYS O 1 1 7 2850 1 1 16 ALA C C 4.492 1.602 -4.458 1.00 . A X . 16 ALA C 1 1 7 2851 1 1 16 ALA CA C 3.007 1.686 -4.782 1.00 . A X . 16 ALA CA 1 1 7 2852 1 1 16 ALA CB C 2.647 3.080 -5.265 1.00 . A X . 16 ALA CB 1 1 7 2853 1 1 16 ALA H H 2.305 1.826 -2.785 1.00 . A X . 16 ALA H 1 1 7 2854 1 1 16 ALA HA H 2.782 0.987 -5.574 1.00 . A X . 16 ALA HA 1 1 7 2855 1 1 16 ALA HB1 H 1.591 3.120 -5.497 1.00 . A X . 16 ALA HB1 1 1 7 2856 1 1 16 ALA HB2 H 3.219 3.308 -6.150 1.00 . A X . 16 ALA HB2 1 1 7 2857 1 1 16 ALA HB3 H 2.874 3.800 -4.492 1.00 . A X . 16 ALA HB3 1 1 7 2858 1 1 16 ALA N N 2.205 1.319 -3.621 1.00 . A X . 16 ALA N 1 1 7 2859 1 1 16 ALA O O 5.255 0.949 -5.170 1.00 . A X . 16 ALA O 1 1 7 2860 1 1 17 LEU C C 6.476 1.294 -1.770 1.00 . A X . 17 LEU C 1 1 7 2861 1 1 17 LEU CA C 6.287 2.241 -2.948 1.00 . A X . 17 LEU CA 1 1 7 2862 1 1 17 LEU CB C 6.749 3.644 -2.549 1.00 . A X . 17 LEU CB 1 1 7 2863 1 1 17 LEU CD1 C 7.201 6.028 -3.142 1.00 . A X . 17 LEU CD1 1 1 7 2864 1 1 17 LEU CD2 C 7.607 4.233 -4.833 1.00 . A X . 17 LEU CD2 1 1 7 2865 1 1 17 LEU CG C 6.734 4.684 -3.669 1.00 . A X . 17 LEU CG 1 1 7 2866 1 1 17 LEU H H 4.241 2.802 -2.876 1.00 . A X . 17 LEU H 1 1 7 2867 1 1 17 LEU HA H 6.886 1.894 -3.775 1.00 . A X . 17 LEU HA 1 1 7 2868 1 1 17 LEU HB2 H 6.111 3.996 -1.752 1.00 . A X . 17 LEU HB2 1 1 7 2869 1 1 17 LEU HB3 H 7.758 3.571 -2.174 1.00 . A X . 17 LEU HB3 1 1 7 2870 1 1 17 LEU HD11 H 7.193 6.753 -3.942 1.00 . A X . 17 LEU HD11 1 1 7 2871 1 1 17 LEU HD12 H 8.202 5.932 -2.752 1.00 . A X . 17 LEU HD12 1 1 7 2872 1 1 17 LEU HD13 H 6.539 6.354 -2.352 1.00 . A X . 17 LEU HD13 1 1 7 2873 1 1 17 LEU HD21 H 8.625 4.114 -4.493 1.00 . A X . 17 LEU HD21 1 1 7 2874 1 1 17 LEU HD22 H 7.572 4.973 -5.620 1.00 . A X . 17 LEU HD22 1 1 7 2875 1 1 17 LEU HD23 H 7.241 3.288 -5.213 1.00 . A X . 17 LEU HD23 1 1 7 2876 1 1 17 LEU HG H 5.722 4.799 -4.030 1.00 . A X . 17 LEU HG 1 1 7 2877 1 1 17 LEU N N 4.894 2.265 -3.383 1.00 . A X . 17 LEU N 1 1 7 2878 1 1 17 LEU O O 7.548 1.247 -1.174 1.00 . A X . 17 LEU O 1 1 7 2879 1 1 18 ALA C C 6.532 -1.420 -0.393 1.00 . A X . 18 ALA C 1 1 7 2880 1 1 18 ALA CA C 5.447 -0.350 -0.283 1.00 . A X . 18 ALA CA 1 1 7 2881 1 1 18 ALA CB C 4.082 -0.994 -0.096 1.00 . A X . 18 ALA CB 1 1 7 2882 1 1 18 ALA H H 4.646 0.537 -2.031 1.00 . A X . 18 ALA H 1 1 7 2883 1 1 18 ALA HA H 5.650 0.264 0.585 1.00 . A X . 18 ALA HA 1 1 7 2884 1 1 18 ALA HB1 H 4.081 -1.571 0.816 1.00 . A X . 18 ALA HB1 1 1 7 2885 1 1 18 ALA HB2 H 3.873 -1.644 -0.934 1.00 . A X . 18 ALA HB2 1 1 7 2886 1 1 18 ALA HB3 H 3.324 -0.226 -0.039 1.00 . A X . 18 ALA HB3 1 1 7 2887 1 1 18 ALA N N 5.437 0.526 -1.454 1.00 . A X . 18 ALA N 1 1 7 2888 1 1 18 ALA O O 7.073 -1.876 0.618 1.00 . A X . 18 ALA O 1 1 7 2889 1 1 19 LEU C C 9.234 -2.358 -1.330 1.00 . A X . 19 LEU C 1 1 7 2890 1 1 19 LEU CA C 7.880 -2.811 -1.871 1.00 . A X . 19 LEU CA 1 1 7 2891 1 1 19 LEU CB C 7.982 -3.111 -3.370 1.00 . A X . 19 LEU CB 1 1 7 2892 1 1 19 LEU CD1 C 8.549 -5.544 -3.108 1.00 . A X . 19 LEU CD1 1 1 7 2893 1 1 19 LEU CD2 C 9.063 -4.361 -5.258 1.00 . A X . 19 LEU CD2 1 1 7 2894 1 1 19 LEU CG C 8.965 -4.223 -3.744 1.00 . A X . 19 LEU CG 1 1 7 2895 1 1 19 LEU H H 6.365 -1.423 -2.386 1.00 . A X . 19 LEU H 1 1 7 2896 1 1 19 LEU HA H 7.590 -3.714 -1.354 1.00 . A X . 19 LEU HA 1 1 7 2897 1 1 19 LEU HB2 H 7.001 -3.393 -3.726 1.00 . A X . 19 LEU HB2 1 1 7 2898 1 1 19 LEU HB3 H 8.285 -2.209 -3.878 1.00 . A X . 19 LEU HB3 1 1 7 2899 1 1 19 LEU HD11 H 7.560 -5.813 -3.452 1.00 . A X . 19 LEU HD11 1 1 7 2900 1 1 19 LEU HD12 H 8.540 -5.441 -2.033 1.00 . A X . 19 LEU HD12 1 1 7 2901 1 1 19 LEU HD13 H 9.249 -6.315 -3.391 1.00 . A X . 19 LEU HD13 1 1 7 2902 1 1 19 LEU HD21 H 9.419 -3.433 -5.683 1.00 . A X . 19 LEU HD21 1 1 7 2903 1 1 19 LEU HD22 H 8.090 -4.592 -5.664 1.00 . A X . 19 LEU HD22 1 1 7 2904 1 1 19 LEU HD23 H 9.753 -5.155 -5.502 1.00 . A X . 19 LEU HD23 1 1 7 2905 1 1 19 LEU HG H 9.943 -3.966 -3.367 1.00 . A X . 19 LEU HG 1 1 7 2906 1 1 19 LEU N N 6.851 -1.809 -1.622 1.00 . A X . 19 LEU N 1 1 7 2907 1 1 19 LEU O O 9.919 -3.118 -0.643 1.00 . A X . 19 LEU O 1 1 7 2908 1 1 20 LYS C C 10.745 0.068 0.202 1.00 . A X . 20 LYS C 1 1 7 2909 1 1 20 LYS CA C 10.896 -0.599 -1.162 1.00 . A X . 20 LYS CA 1 1 7 2910 1 1 20 LYS CB C 11.490 0.384 -2.177 1.00 . A X . 20 LYS CB 1 1 7 2911 1 1 20 LYS CD C 13.528 1.659 -2.940 1.00 . A X . 20 LYS CD 1 1 7 2912 1 1 20 LYS CE C 15.030 1.823 -2.766 1.00 . A X . 20 LYS CE 1 1 7 2913 1 1 20 LYS CG C 12.967 0.663 -1.941 1.00 . A X . 20 LYS CG 1 1 7 2914 1 1 20 LYS H H 9.019 -0.540 -2.147 1.00 . A X . 20 LYS H 1 1 7 2915 1 1 20 LYS HA H 11.567 -1.439 -1.057 1.00 . A X . 20 LYS HA 1 1 7 2916 1 1 20 LYS HB2 H 11.375 -0.027 -3.171 1.00 . A X . 20 LYS HB2 1 1 7 2917 1 1 20 LYS HB3 H 10.954 1.319 -2.119 1.00 . A X . 20 LYS HB3 1 1 7 2918 1 1 20 LYS HD2 H 13.326 1.309 -3.941 1.00 . A X . 20 LYS HD2 1 1 7 2919 1 1 20 LYS HD3 H 13.050 2.615 -2.785 1.00 . A X . 20 LYS HD3 1 1 7 2920 1 1 20 LYS HE2 H 15.503 0.864 -2.920 1.00 . A X . 20 LYS HE2 1 1 7 2921 1 1 20 LYS HE3 H 15.387 2.523 -3.508 1.00 . A X . 20 LYS HE3 1 1 7 2922 1 1 20 LYS HG2 H 13.088 1.063 -0.947 1.00 . A X . 20 LYS HG2 1 1 7 2923 1 1 20 LYS HG3 H 13.515 -0.266 -2.025 1.00 . A X . 20 LYS HG3 1 1 7 2924 1 1 20 LYS HZ1 H 15.025 1.679 -0.677 1.00 . A X . 20 LYS HZ1 1 1 7 2925 1 1 20 LYS HZ2 H 14.981 3.273 -1.258 1.00 . A X . 20 LYS HZ2 1 1 7 2926 1 1 20 LYS HZ3 H 16.426 2.388 -1.318 1.00 . A X . 20 LYS HZ3 1 1 7 2927 1 1 20 LYS N N 9.612 -1.116 -1.619 1.00 . A X . 20 LYS N 1 1 7 2928 1 1 20 LYS NZ N 15.389 2.324 -1.412 1.00 . A X . 20 LYS NZ 1 1 7 2929 1 1 20 LYS O O 11.730 0.311 0.902 1.00 . A X . 20 LYS O 1 1 7 2930 1 1 21 LEU C C 9.558 -0.163 2.950 1.00 . A X . 21 LEU C 1 1 7 2931 1 1 21 LEU CA C 9.221 0.893 1.905 1.00 . A X . 21 LEU CA 1 1 7 2932 1 1 21 LEU CB C 7.748 1.298 2.016 1.00 . A X . 21 LEU CB 1 1 7 2933 1 1 21 LEU CD1 C 8.080 3.249 3.554 1.00 . A X . 21 LEU CD1 1 1 7 2934 1 1 21 LEU CD2 C 5.837 2.163 3.385 1.00 . A X . 21 LEU CD2 1 1 7 2935 1 1 21 LEU CG C 7.340 1.940 3.343 1.00 . A X . 21 LEU CG 1 1 7 2936 1 1 21 LEU H H 8.768 0.244 -0.054 1.00 . A X . 21 LEU H 1 1 7 2937 1 1 21 LEU HA H 9.845 1.758 2.064 1.00 . A X . 21 LEU HA 1 1 7 2938 1 1 21 LEU HB2 H 7.529 1.998 1.223 1.00 . A X . 21 LEU HB2 1 1 7 2939 1 1 21 LEU HB3 H 7.143 0.416 1.870 1.00 . A X . 21 LEU HB3 1 1 7 2940 1 1 21 LEU HD11 H 7.878 3.914 2.727 1.00 . A X . 21 LEU HD11 1 1 7 2941 1 1 21 LEU HD12 H 9.142 3.057 3.611 1.00 . A X . 21 LEU HD12 1 1 7 2942 1 1 21 LEU HD13 H 7.746 3.707 4.473 1.00 . A X . 21 LEU HD13 1 1 7 2943 1 1 21 LEU HD21 H 5.328 1.218 3.270 1.00 . A X . 21 LEU HD21 1 1 7 2944 1 1 21 LEU HD22 H 5.548 2.826 2.583 1.00 . A X . 21 LEU HD22 1 1 7 2945 1 1 21 LEU HD23 H 5.564 2.604 4.333 1.00 . A X . 21 LEU HD23 1 1 7 2946 1 1 21 LEU HG H 7.604 1.274 4.153 1.00 . A X . 21 LEU HG 1 1 7 2947 1 1 21 LEU N N 9.506 0.367 0.579 1.00 . A X . 21 LEU N 1 1 7 2948 1 1 21 LEU O O 10.025 0.148 4.045 1.00 . A X . 21 LEU O 1 1 7 2949 1 1 22 LYS C C 11.062 -3.085 3.059 1.00 . A X . 22 LYS C 1 1 7 2950 1 1 22 LYS CA C 9.694 -2.533 3.451 1.00 . A X . 22 LYS CA 1 1 7 2951 1 1 22 LYS CB C 8.642 -3.641 3.379 1.00 . A X . 22 LYS CB 1 1 7 2952 1 1 22 LYS CD C 7.448 -2.934 5.473 1.00 . A X . 22 LYS CD 1 1 7 2953 1 1 22 LYS CE C 6.097 -2.712 6.133 1.00 . A X . 22 LYS CE 1 1 7 2954 1 1 22 LYS CG C 7.302 -3.269 3.998 1.00 . A X . 22 LYS CG 1 1 7 2955 1 1 22 LYS H H 8.893 -1.602 1.731 1.00 . A X . 22 LYS H 1 1 7 2956 1 1 22 LYS HA H 9.747 -2.165 4.464 1.00 . A X . 22 LYS HA 1 1 7 2957 1 1 22 LYS HB2 H 8.477 -3.897 2.342 1.00 . A X . 22 LYS HB2 1 1 7 2958 1 1 22 LYS HB3 H 9.023 -4.509 3.895 1.00 . A X . 22 LYS HB3 1 1 7 2959 1 1 22 LYS HD2 H 7.948 -3.753 5.967 1.00 . A X . 22 LYS HD2 1 1 7 2960 1 1 22 LYS HD3 H 8.040 -2.035 5.571 1.00 . A X . 22 LYS HD3 1 1 7 2961 1 1 22 LYS HE2 H 6.256 -2.384 7.150 1.00 . A X . 22 LYS HE2 1 1 7 2962 1 1 22 LYS HE3 H 5.563 -1.946 5.588 1.00 . A X . 22 LYS HE3 1 1 7 2963 1 1 22 LYS HG2 H 6.899 -2.410 3.482 1.00 . A X . 22 LYS HG2 1 1 7 2964 1 1 22 LYS HG3 H 6.626 -4.105 3.893 1.00 . A X . 22 LYS HG3 1 1 7 2965 1 1 22 LYS HZ1 H 4.390 -3.792 6.669 1.00 . A X . 22 LYS HZ1 1 1 7 2966 1 1 22 LYS HZ2 H 5.804 -4.726 6.617 1.00 . A X . 22 LYS HZ2 1 1 7 2967 1 1 22 LYS HZ3 H 5.049 -4.251 5.174 1.00 . A X . 22 LYS HZ3 1 1 7 2968 1 1 22 LYS N N 9.327 -1.419 2.595 1.00 . A X . 22 LYS N 1 1 7 2969 1 1 22 LYS NZ N 5.279 -3.955 6.149 1.00 . A X . 22 LYS NZ 1 1 7 2970 1 1 22 LYS O O 11.297 -4.294 3.101 1.00 . A X . 22 LYS O 1 1 7 2971 1 1 23 LYS C C 14.307 -1.922 3.252 1.00 . A X . 23 LYS C 1 1 7 2972 1 1 23 LYS CA C 13.306 -2.570 2.302 1.00 . A X . 23 LYS CA 1 1 7 2973 1 1 23 LYS CB C 13.597 -2.171 0.850 1.00 . A X . 23 LYS CB 1 1 7 2974 1 1 23 LYS CD C 15.369 -3.927 0.511 1.00 . A X . 23 LYS CD 1 1 7 2975 1 1 23 LYS CE C 16.799 -4.184 0.074 1.00 . A X . 23 LYS CE 1 1 7 2976 1 1 23 LYS CG C 15.022 -2.453 0.398 1.00 . A X . 23 LYS CG 1 1 7 2977 1 1 23 LYS H H 11.703 -1.253 2.635 1.00 . A X . 23 LYS H 1 1 7 2978 1 1 23 LYS HA H 13.383 -3.639 2.398 1.00 . A X . 23 LYS HA 1 1 7 2979 1 1 23 LYS HB2 H 12.924 -2.713 0.200 1.00 . A X . 23 LYS HB2 1 1 7 2980 1 1 23 LYS HB3 H 13.410 -1.112 0.738 1.00 . A X . 23 LYS HB3 1 1 7 2981 1 1 23 LYS HD2 H 15.256 -4.237 1.539 1.00 . A X . 23 LYS HD2 1 1 7 2982 1 1 23 LYS HD3 H 14.698 -4.499 -0.118 1.00 . A X . 23 LYS HD3 1 1 7 2983 1 1 23 LYS HE2 H 16.886 -3.961 -0.978 1.00 . A X . 23 LYS HE2 1 1 7 2984 1 1 23 LYS HE3 H 17.454 -3.533 0.634 1.00 . A X . 23 LYS HE3 1 1 7 2985 1 1 23 LYS HG2 H 15.134 -2.145 -0.632 1.00 . A X . 23 LYS HG2 1 1 7 2986 1 1 23 LYS HG3 H 15.698 -1.887 1.019 1.00 . A X . 23 LYS HG3 1 1 7 2987 1 1 23 LYS HZ1 H 17.057 -5.847 1.308 1.00 . A X . 23 LYS HZ1 1 1 7 2988 1 1 23 LYS HZ2 H 18.220 -5.709 0.082 1.00 . A X . 23 LYS HZ2 1 1 7 2989 1 1 23 LYS HZ3 H 16.654 -6.239 -0.298 1.00 . A X . 23 LYS HZ3 1 1 7 2990 1 1 23 LYS N N 11.955 -2.194 2.670 1.00 . A X . 23 LYS N 1 1 7 2991 1 1 23 LYS NZ N 17.207 -5.592 0.307 1.00 . A X . 23 LYS NZ 1 1 7 2992 1 1 23 LYS O O 14.599 -0.730 3.150 1.00 . A X . 23 LYS O 1 1 7 2993 1 1 24 ALA C C 16.778 -3.362 5.432 1.00 . A X . 24 ALA C 1 1 7 2994 1 1 24 ALA CA C 15.788 -2.247 5.143 1.00 . A X . 24 ALA CA 1 1 7 2995 1 1 24 ALA CB C 15.112 -1.780 6.425 1.00 . A X . 24 ALA CB 1 1 7 2996 1 1 24 ALA H H 14.502 -3.647 4.236 1.00 . A X . 24 ALA H 1 1 7 2997 1 1 24 ALA HA H 16.314 -1.407 4.708 1.00 . A X . 24 ALA HA 1 1 7 2998 1 1 24 ALA HB1 H 15.855 -1.385 7.103 1.00 . A X . 24 ALA HB1 1 1 7 2999 1 1 24 ALA HB2 H 14.607 -2.614 6.889 1.00 . A X . 24 ALA HB2 1 1 7 3000 1 1 24 ALA HB3 H 14.394 -1.006 6.193 1.00 . A X . 24 ALA HB3 1 1 7 3001 1 1 24 ALA N N 14.803 -2.711 4.187 1.00 . A X . 24 ALA N 1 1 7 3002 1 1 24 ALA O O 16.481 -4.208 6.302 1.00 . A X . 24 ALA O 1 1 7 3003 1 1 24 ALA OXT O 17.825 -3.416 4.755 1.00 . A X . 24 ALA OXT 1 1 8 3004 1 1 1 LYS C C -7.571 5.673 11.168 1.00 . A X . 1 LYS C 1 1 8 3005 1 1 1 LYS CA C -6.807 4.355 11.032 1.00 . A X . 1 LYS CA 1 1 8 3006 1 1 1 LYS CB C -7.610 3.390 10.148 1.00 . A X . 1 LYS CB 1 1 8 3007 1 1 1 LYS CD C -5.713 2.174 8.992 1.00 . A X . 1 LYS CD 1 1 8 3008 1 1 1 LYS CE C -6.096 2.614 7.584 1.00 . A X . 1 LYS CE 1 1 8 3009 1 1 1 LYS CG C -6.934 2.047 9.896 1.00 . A X . 1 LYS CG 1 1 8 3010 1 1 1 LYS H1 H -7.478 3.524 12.823 1.00 . A X . 1 LYS H1 1 1 8 3011 1 1 1 LYS H2 H -6.044 4.411 12.973 1.00 . A X . 1 LYS H2 1 1 8 3012 1 1 1 LYS H3 H -6.014 2.870 12.269 1.00 . A X . 1 LYS H3 1 1 8 3013 1 1 1 LYS HA H -5.850 4.552 10.568 1.00 . A X . 1 LYS HA 1 1 8 3014 1 1 1 LYS HB2 H -8.560 3.201 10.623 1.00 . A X . 1 LYS HB2 1 1 8 3015 1 1 1 LYS HB3 H -7.787 3.863 9.192 1.00 . A X . 1 LYS HB3 1 1 8 3016 1 1 1 LYS HD2 H -5.041 2.907 9.415 1.00 . A X . 1 LYS HD2 1 1 8 3017 1 1 1 LYS HD3 H -5.216 1.216 8.938 1.00 . A X . 1 LYS HD3 1 1 8 3018 1 1 1 LYS HE2 H -6.840 1.935 7.198 1.00 . A X . 1 LYS HE2 1 1 8 3019 1 1 1 LYS HE3 H -6.511 3.611 7.635 1.00 . A X . 1 LYS HE3 1 1 8 3020 1 1 1 LYS HG2 H -6.622 1.631 10.840 1.00 . A X . 1 LYS HG2 1 1 8 3021 1 1 1 LYS HG3 H -7.646 1.382 9.428 1.00 . A X . 1 LYS HG3 1 1 8 3022 1 1 1 LYS HZ1 H -4.678 1.650 6.377 1.00 . A X . 1 LYS HZ1 1 1 8 3023 1 1 1 LYS HZ2 H -4.101 3.049 7.137 1.00 . A X . 1 LYS HZ2 1 1 8 3024 1 1 1 LYS HZ3 H -5.144 3.178 5.809 1.00 . A X . 1 LYS HZ3 1 1 8 3025 1 1 1 LYS N N -6.570 3.748 12.365 1.00 . A X . 1 LYS N 1 1 8 3026 1 1 1 LYS NZ N -4.927 2.622 6.663 1.00 . A X . 1 LYS NZ 1 1 8 3027 1 1 1 LYS O O -8.369 6.029 10.295 1.00 . A X . 1 LYS O 1 1 8 3028 1 1 2 LYS C C -7.627 8.706 11.512 1.00 . A X . 2 LYS C 1 1 8 3029 1 1 2 LYS CA C -8.018 7.646 12.537 1.00 . A X . 2 LYS CA 1 1 8 3030 1 1 2 LYS CB C -7.688 8.143 13.947 1.00 . A X . 2 LYS CB 1 1 8 3031 1 1 2 LYS CD C -7.943 9.991 15.628 1.00 . A X . 2 LYS CD 1 1 8 3032 1 1 2 LYS CE C -8.775 11.191 16.051 1.00 . A X . 2 LYS CE 1 1 8 3033 1 1 2 LYS CG C -8.490 9.365 14.358 1.00 . A X . 2 LYS CG 1 1 8 3034 1 1 2 LYS H H -6.649 6.074 12.903 1.00 . A X . 2 LYS H 1 1 8 3035 1 1 2 LYS HA H -9.078 7.463 12.465 1.00 . A X . 2 LYS HA 1 1 8 3036 1 1 2 LYS HB2 H -7.889 7.350 14.652 1.00 . A X . 2 LYS HB2 1 1 8 3037 1 1 2 LYS HB3 H -6.639 8.395 13.992 1.00 . A X . 2 LYS HB3 1 1 8 3038 1 1 2 LYS HD2 H -7.958 9.254 16.417 1.00 . A X . 2 LYS HD2 1 1 8 3039 1 1 2 LYS HD3 H -6.926 10.312 15.450 1.00 . A X . 2 LYS HD3 1 1 8 3040 1 1 2 LYS HE2 H -8.881 11.855 15.206 1.00 . A X . 2 LYS HE2 1 1 8 3041 1 1 2 LYS HE3 H -9.751 10.847 16.363 1.00 . A X . 2 LYS HE3 1 1 8 3042 1 1 2 LYS HG2 H -8.448 10.094 13.563 1.00 . A X . 2 LYS HG2 1 1 8 3043 1 1 2 LYS HG3 H -9.515 9.068 14.526 1.00 . A X . 2 LYS HG3 1 1 8 3044 1 1 2 LYS HZ1 H -7.297 12.443 16.833 1.00 . A X . 2 LYS HZ1 1 1 8 3045 1 1 2 LYS HZ2 H -7.851 11.273 17.925 1.00 . A X . 2 LYS HZ2 1 1 8 3046 1 1 2 LYS HZ3 H -8.814 12.625 17.573 1.00 . A X . 2 LYS HZ3 1 1 8 3047 1 1 2 LYS N N -7.324 6.393 12.262 1.00 . A X . 2 LYS N 1 1 8 3048 1 1 2 LYS NZ N -8.141 11.935 17.171 1.00 . A X . 2 LYS NZ 1 1 8 3049 1 1 2 LYS O O -8.483 9.288 10.840 1.00 . A X . 2 LYS O 1 1 8 3050 1 1 3 LEU C C -5.125 9.112 9.304 1.00 . A X . 3 LEU C 1 1 8 3051 1 1 3 LEU CA C -5.821 9.883 10.410 1.00 . A X . 3 LEU CA 1 1 8 3052 1 1 3 LEU CB C -4.855 10.908 11.019 1.00 . A X . 3 LEU CB 1 1 8 3053 1 1 3 LEU CD1 C -6.291 11.808 12.882 1.00 . A X . 3 LEU CD1 1 1 8 3054 1 1 3 LEU CD2 C -4.442 13.196 11.947 1.00 . A X . 3 LEU CD2 1 1 8 3055 1 1 3 LEU CG C -5.502 12.154 11.632 1.00 . A X . 3 LEU CG 1 1 8 3056 1 1 3 LEU H H -5.702 8.524 12.025 1.00 . A X . 3 LEU H 1 1 8 3057 1 1 3 LEU HA H -6.664 10.406 9.986 1.00 . A X . 3 LEU HA 1 1 8 3058 1 1 3 LEU HB2 H -4.285 10.413 11.790 1.00 . A X . 3 LEU HB2 1 1 8 3059 1 1 3 LEU HB3 H -4.174 11.230 10.245 1.00 . A X . 3 LEU HB3 1 1 8 3060 1 1 3 LEU HD11 H -6.746 12.704 13.281 1.00 . A X . 3 LEU HD11 1 1 8 3061 1 1 3 LEU HD12 H -5.628 11.384 13.619 1.00 . A X . 3 LEU HD12 1 1 8 3062 1 1 3 LEU HD13 H -7.060 11.092 12.636 1.00 . A X . 3 LEU HD13 1 1 8 3063 1 1 3 LEU HD21 H -4.916 14.080 12.351 1.00 . A X . 3 LEU HD21 1 1 8 3064 1 1 3 LEU HD22 H -3.908 13.452 11.045 1.00 . A X . 3 LEU HD22 1 1 8 3065 1 1 3 LEU HD23 H -3.751 12.795 12.674 1.00 . A X . 3 LEU HD23 1 1 8 3066 1 1 3 LEU HG H -6.187 12.583 10.914 1.00 . A X . 3 LEU HG 1 1 8 3067 1 1 3 LEU N N -6.333 8.966 11.412 1.00 . A X . 3 LEU N 1 1 8 3068 1 1 3 LEU O O -3.973 8.701 9.445 1.00 . A X . 3 LEU O 1 1 8 3069 1 1 4 LYS C C -4.427 9.135 6.213 1.00 . A X . 4 LYS C 1 1 8 3070 1 1 4 LYS CA C -5.292 8.203 7.054 1.00 . A X . 4 LYS CA 1 1 8 3071 1 1 4 LYS CB C -6.439 7.642 6.210 1.00 . A X . 4 LYS CB 1 1 8 3072 1 1 4 LYS CD C -8.597 6.364 6.154 1.00 . A X . 4 LYS CD 1 1 8 3073 1 1 4 LYS CE C -9.616 5.578 6.960 1.00 . A X . 4 LYS CE 1 1 8 3074 1 1 4 LYS CG C -7.418 6.793 7.006 1.00 . A X . 4 LYS CG 1 1 8 3075 1 1 4 LYS H H -6.741 9.295 8.144 1.00 . A X . 4 LYS H 1 1 8 3076 1 1 4 LYS HA H -4.685 7.388 7.418 1.00 . A X . 4 LYS HA 1 1 8 3077 1 1 4 LYS HB2 H -6.985 8.462 5.768 1.00 . A X . 4 LYS HB2 1 1 8 3078 1 1 4 LYS HB3 H -6.026 7.030 5.421 1.00 . A X . 4 LYS HB3 1 1 8 3079 1 1 4 LYS HD2 H -9.076 7.244 5.751 1.00 . A X . 4 LYS HD2 1 1 8 3080 1 1 4 LYS HD3 H -8.237 5.746 5.344 1.00 . A X . 4 LYS HD3 1 1 8 3081 1 1 4 LYS HE2 H -10.408 5.259 6.301 1.00 . A X . 4 LYS HE2 1 1 8 3082 1 1 4 LYS HE3 H -9.129 4.712 7.384 1.00 . A X . 4 LYS HE3 1 1 8 3083 1 1 4 LYS HG2 H -6.907 5.911 7.365 1.00 . A X . 4 LYS HG2 1 1 8 3084 1 1 4 LYS HG3 H -7.781 7.368 7.846 1.00 . A X . 4 LYS HG3 1 1 8 3085 1 1 4 LYS HZ1 H -9.479 6.602 8.779 1.00 . A X . 4 LYS HZ1 1 1 8 3086 1 1 4 LYS HZ2 H -10.982 5.868 8.516 1.00 . A X . 4 LYS HZ2 1 1 8 3087 1 1 4 LYS HZ3 H -10.577 7.287 7.684 1.00 . A X . 4 LYS HZ3 1 1 8 3088 1 1 4 LYS N N -5.828 8.924 8.199 1.00 . A X . 4 LYS N 1 1 8 3089 1 1 4 LYS NZ N -10.202 6.390 8.061 1.00 . A X . 4 LYS NZ 1 1 8 3090 1 1 4 LYS O O -4.513 9.152 4.985 1.00 . A X . 4 LYS O 1 1 8 3091 1 1 5 LEU C C -1.537 10.312 5.588 1.00 . A X . 5 LEU C 1 1 8 3092 1 1 5 LEU CA C -2.777 10.921 6.229 1.00 . A X . 5 LEU CA 1 1 8 3093 1 1 5 LEU CB C -2.389 12.015 7.227 1.00 . A X . 5 LEU CB 1 1 8 3094 1 1 5 LEU CD1 C -2.825 13.899 5.643 1.00 . A X . 5 LEU CD1 1 1 8 3095 1 1 5 LEU CD2 C -1.437 14.285 7.677 1.00 . A X . 5 LEU CD2 1 1 8 3096 1 1 5 LEU CG C -1.818 13.285 6.600 1.00 . A X . 5 LEU CG 1 1 8 3097 1 1 5 LEU H H -3.483 9.763 7.855 1.00 . A X . 5 LEU H 1 1 8 3098 1 1 5 LEU HA H -3.382 11.355 5.452 1.00 . A X . 5 LEU HA 1 1 8 3099 1 1 5 LEU HB2 H -3.268 12.283 7.795 1.00 . A X . 5 LEU HB2 1 1 8 3100 1 1 5 LEU HB3 H -1.651 11.611 7.904 1.00 . A X . 5 LEU HB3 1 1 8 3101 1 1 5 LEU HD11 H -2.397 14.781 5.190 1.00 . A X . 5 LEU HD11 1 1 8 3102 1 1 5 LEU HD12 H -3.717 14.171 6.187 1.00 . A X . 5 LEU HD12 1 1 8 3103 1 1 5 LEU HD13 H -3.076 13.184 4.874 1.00 . A X . 5 LEU HD13 1 1 8 3104 1 1 5 LEU HD21 H -1.078 15.193 7.216 1.00 . A X . 5 LEU HD21 1 1 8 3105 1 1 5 LEU HD22 H -0.659 13.866 8.298 1.00 . A X . 5 LEU HD22 1 1 8 3106 1 1 5 LEU HD23 H -2.303 14.506 8.283 1.00 . A X . 5 LEU HD23 1 1 8 3107 1 1 5 LEU HG H -0.929 13.036 6.037 1.00 . A X . 5 LEU HG 1 1 8 3108 1 1 5 LEU N N -3.577 9.898 6.886 1.00 . A X . 5 LEU N 1 1 8 3109 1 1 5 LEU O O -0.747 10.999 4.941 1.00 . A X . 5 LEU O 1 1 8 3110 1 1 6 ALA C C -0.667 7.886 3.708 1.00 . A X . 6 ALA C 1 1 8 3111 1 1 6 ALA CA C -0.290 8.285 5.128 1.00 . A X . 6 ALA CA 1 1 8 3112 1 1 6 ALA CB C 0.081 7.061 5.951 1.00 . A X . 6 ALA CB 1 1 8 3113 1 1 6 ALA H H -2.021 8.527 6.322 1.00 . A X . 6 ALA H 1 1 8 3114 1 1 6 ALA HA H 0.567 8.942 5.091 1.00 . A X . 6 ALA HA 1 1 8 3115 1 1 6 ALA HB1 H -0.751 6.372 5.969 1.00 . A X . 6 ALA HB1 1 1 8 3116 1 1 6 ALA HB2 H 0.319 7.364 6.959 1.00 . A X . 6 ALA HB2 1 1 8 3117 1 1 6 ALA HB3 H 0.939 6.575 5.509 1.00 . A X . 6 ALA HB3 1 1 8 3118 1 1 6 ALA N N -1.382 9.011 5.757 1.00 . A X . 6 ALA N 1 1 8 3119 1 1 6 ALA O O 0.135 7.308 2.971 1.00 . A X . 6 ALA O 1 1 8 3120 1 1 7 LEU C C -1.750 8.767 0.947 1.00 . A X . 7 LEU C 1 1 8 3121 1 1 7 LEU CA C -2.416 7.897 2.011 1.00 . A X . 7 LEU CA 1 1 8 3122 1 1 7 LEU CB C -3.935 8.100 1.987 1.00 . A X . 7 LEU CB 1 1 8 3123 1 1 7 LEU CD1 C -4.492 6.087 0.596 1.00 . A X . 7 LEU CD1 1 1 8 3124 1 1 7 LEU CD2 C -6.120 7.980 0.762 1.00 . A X . 7 LEU CD2 1 1 8 3125 1 1 7 LEU CG C -4.648 7.593 0.731 1.00 . A X . 7 LEU CG 1 1 8 3126 1 1 7 LEU H H -2.472 8.698 3.963 1.00 . A X . 7 LEU H 1 1 8 3127 1 1 7 LEU HA H -2.192 6.860 1.807 1.00 . A X . 7 LEU HA 1 1 8 3128 1 1 7 LEU HB2 H -4.358 7.596 2.844 1.00 . A X . 7 LEU HB2 1 1 8 3129 1 1 7 LEU HB3 H -4.136 9.157 2.082 1.00 . A X . 7 LEU HB3 1 1 8 3130 1 1 7 LEU HD11 H -4.905 5.600 1.467 1.00 . A X . 7 LEU HD11 1 1 8 3131 1 1 7 LEU HD12 H -3.444 5.839 0.509 1.00 . A X . 7 LEU HD12 1 1 8 3132 1 1 7 LEU HD13 H -5.015 5.748 -0.287 1.00 . A X . 7 LEU HD13 1 1 8 3133 1 1 7 LEU HD21 H -6.606 7.623 -0.134 1.00 . A X . 7 LEU HD21 1 1 8 3134 1 1 7 LEU HD22 H -6.210 9.056 0.815 1.00 . A X . 7 LEU HD22 1 1 8 3135 1 1 7 LEU HD23 H -6.592 7.537 1.627 1.00 . A X . 7 LEU HD23 1 1 8 3136 1 1 7 LEU HG H -4.200 8.055 -0.137 1.00 . A X . 7 LEU HG 1 1 8 3137 1 1 7 LEU N N -1.894 8.218 3.330 1.00 . A X . 7 LEU N 1 1 8 3138 1 1 7 LEU O O -2.214 9.868 0.651 1.00 . A X . 7 LEU O 1 1 8 3139 1 1 8 ALA C C 0.854 10.153 -0.321 1.00 . A X . 8 ALA C 1 1 8 3140 1 1 8 ALA CA C 0.092 8.881 -0.700 1.00 . A X . 8 ALA CA 1 1 8 3141 1 1 8 ALA CB C -0.856 9.160 -1.863 1.00 . A X . 8 ALA CB 1 1 8 3142 1 1 8 ALA H H -0.247 7.464 0.837 1.00 . A X . 8 ALA H 1 1 8 3143 1 1 8 ALA HA H 0.814 8.153 -1.042 1.00 . A X . 8 ALA HA 1 1 8 3144 1 1 8 ALA HB1 H -1.380 8.253 -2.124 1.00 . A X . 8 ALA HB1 1 1 8 3145 1 1 8 ALA HB2 H -0.291 9.507 -2.714 1.00 . A X . 8 ALA HB2 1 1 8 3146 1 1 8 ALA HB3 H -1.571 9.917 -1.573 1.00 . A X . 8 ALA HB3 1 1 8 3147 1 1 8 ALA N N -0.623 8.273 0.432 1.00 . A X . 8 ALA N 1 1 8 3148 1 1 8 ALA O O 1.725 10.595 -1.071 1.00 . A X . 8 ALA O 1 1 8 3149 1 1 9 LYS C C 2.680 11.739 1.587 1.00 . A X . 9 LYS C 1 1 8 3150 1 1 9 LYS CA C 1.206 11.981 1.231 1.00 . A X . 9 LYS CA 1 1 8 3151 1 1 9 LYS CB C 0.459 12.669 2.384 1.00 . A X . 9 LYS CB 1 1 8 3152 1 1 9 LYS CD C 0.243 14.716 3.844 1.00 . A X . 9 LYS CD 1 1 8 3153 1 1 9 LYS CE C 0.734 16.137 4.063 1.00 . A X . 9 LYS CE 1 1 8 3154 1 1 9 LYS CG C 1.017 14.044 2.723 1.00 . A X . 9 LYS CG 1 1 8 3155 1 1 9 LYS H H -0.118 10.329 1.424 1.00 . A X . 9 LYS H 1 1 8 3156 1 1 9 LYS HA H 1.179 12.636 0.371 1.00 . A X . 9 LYS HA 1 1 8 3157 1 1 9 LYS HB2 H -0.580 12.777 2.111 1.00 . A X . 9 LYS HB2 1 1 8 3158 1 1 9 LYS HB3 H 0.528 12.047 3.264 1.00 . A X . 9 LYS HB3 1 1 8 3159 1 1 9 LYS HD2 H -0.804 14.743 3.586 1.00 . A X . 9 LYS HD2 1 1 8 3160 1 1 9 LYS HD3 H 0.381 14.152 4.754 1.00 . A X . 9 LYS HD3 1 1 8 3161 1 1 9 LYS HE2 H 1.793 16.108 4.272 1.00 . A X . 9 LYS HE2 1 1 8 3162 1 1 9 LYS HE3 H 0.566 16.705 3.159 1.00 . A X . 9 LYS HE3 1 1 8 3163 1 1 9 LYS HG2 H 2.046 13.937 3.029 1.00 . A X . 9 LYS HG2 1 1 8 3164 1 1 9 LYS HG3 H 0.967 14.668 1.843 1.00 . A X . 9 LYS HG3 1 1 8 3165 1 1 9 LYS HZ1 H 0.343 17.809 5.247 1.00 . A X . 9 LYS HZ1 1 1 8 3166 1 1 9 LYS HZ2 H 0.277 16.343 6.089 1.00 . A X . 9 LYS HZ2 1 1 8 3167 1 1 9 LYS HZ3 H -0.993 16.782 5.049 1.00 . A X . 9 LYS HZ3 1 1 8 3168 1 1 9 LYS N N 0.554 10.736 0.834 1.00 . A X . 9 LYS N 1 1 8 3169 1 1 9 LYS NZ N 0.042 16.812 5.190 1.00 . A X . 9 LYS NZ 1 1 8 3170 1 1 9 LYS O O 3.564 12.307 0.947 1.00 . A X . 9 LYS O 1 1 8 3171 1 1 10 PRO C C 4.945 9.467 2.051 1.00 . A X . 10 PRO C 1 1 8 3172 1 1 10 PRO CA C 4.364 10.561 2.947 1.00 . A X . 10 PRO CA 1 1 8 3173 1 1 10 PRO CB C 4.265 10.067 4.401 1.00 . A X . 10 PRO CB 1 1 8 3174 1 1 10 PRO CD C 2.051 10.194 3.483 1.00 . A X . 10 PRO CD 1 1 8 3175 1 1 10 PRO CG C 2.816 10.153 4.773 1.00 . A X . 10 PRO CG 1 1 8 3176 1 1 10 PRO HA H 5.000 11.434 2.902 1.00 . A X . 10 PRO HA 1 1 8 3177 1 1 10 PRO HB2 H 4.623 9.050 4.457 1.00 . A X . 10 PRO HB2 1 1 8 3178 1 1 10 PRO HB3 H 4.871 10.697 5.035 1.00 . A X . 10 PRO HB3 1 1 8 3179 1 1 10 PRO HD2 H 1.845 9.194 3.132 1.00 . A X . 10 PRO HD2 1 1 8 3180 1 1 10 PRO HD3 H 1.136 10.757 3.598 1.00 . A X . 10 PRO HD3 1 1 8 3181 1 1 10 PRO HG2 H 2.531 9.283 5.346 1.00 . A X . 10 PRO HG2 1 1 8 3182 1 1 10 PRO HG3 H 2.635 11.054 5.344 1.00 . A X . 10 PRO HG3 1 1 8 3183 1 1 10 PRO N N 2.985 10.886 2.591 1.00 . A X . 10 PRO N 1 1 8 3184 1 1 10 PRO O O 6.105 9.082 2.196 1.00 . A X . 10 PRO O 1 1 8 3185 1 1 11 ALA C C 4.894 6.638 0.868 1.00 . A X . 11 ALA C 1 1 8 3186 1 1 11 ALA CA C 4.499 7.939 0.170 1.00 . A X . 11 ALA CA 1 1 8 3187 1 1 11 ALA CB C 5.628 8.434 -0.725 1.00 . A X . 11 ALA CB 1 1 8 3188 1 1 11 ALA H H 3.197 9.329 1.093 1.00 . A X . 11 ALA H 1 1 8 3189 1 1 11 ALA HA H 3.643 7.743 -0.459 1.00 . A X . 11 ALA HA 1 1 8 3190 1 1 11 ALA HB1 H 6.500 8.638 -0.122 1.00 . A X . 11 ALA HB1 1 1 8 3191 1 1 11 ALA HB2 H 5.319 9.337 -1.230 1.00 . A X . 11 ALA HB2 1 1 8 3192 1 1 11 ALA HB3 H 5.867 7.675 -1.457 1.00 . A X . 11 ALA HB3 1 1 8 3193 1 1 11 ALA N N 4.109 8.973 1.130 1.00 . A X . 11 ALA N 1 1 8 3194 1 1 11 ALA O O 5.741 5.891 0.381 1.00 . A X . 11 ALA O 1 1 8 3195 1 1 12 LEU C C 3.441 4.164 2.738 1.00 . A X . 12 LEU C 1 1 8 3196 1 1 12 LEU CA C 4.580 5.175 2.779 1.00 . A X . 12 LEU CA 1 1 8 3197 1 1 12 LEU CB C 4.877 5.567 4.230 1.00 . A X . 12 LEU CB 1 1 8 3198 1 1 12 LEU CD1 C 6.504 3.744 4.808 1.00 . A X . 12 LEU CD1 1 1 8 3199 1 1 12 LEU CD2 C 5.199 4.880 6.622 1.00 . A X . 12 LEU CD2 1 1 8 3200 1 1 12 LEU CG C 5.182 4.402 5.175 1.00 . A X . 12 LEU CG 1 1 8 3201 1 1 12 LEU H H 3.553 6.959 2.311 1.00 . A X . 12 LEU H 1 1 8 3202 1 1 12 LEU HA H 5.463 4.723 2.350 1.00 . A X . 12 LEU HA 1 1 8 3203 1 1 12 LEU HB2 H 5.724 6.236 4.234 1.00 . A X . 12 LEU HB2 1 1 8 3204 1 1 12 LEU HB3 H 4.020 6.098 4.617 1.00 . A X . 12 LEU HB3 1 1 8 3205 1 1 12 LEU HD11 H 7.304 4.462 4.908 1.00 . A X . 12 LEU HD11 1 1 8 3206 1 1 12 LEU HD12 H 6.460 3.395 3.785 1.00 . A X . 12 LEU HD12 1 1 8 3207 1 1 12 LEU HD13 H 6.684 2.908 5.467 1.00 . A X . 12 LEU HD13 1 1 8 3208 1 1 12 LEU HD21 H 4.242 5.318 6.869 1.00 . A X . 12 LEU HD21 1 1 8 3209 1 1 12 LEU HD22 H 5.976 5.619 6.748 1.00 . A X . 12 LEU HD22 1 1 8 3210 1 1 12 LEU HD23 H 5.390 4.041 7.276 1.00 . A X . 12 LEU HD23 1 1 8 3211 1 1 12 LEU HG H 4.403 3.659 5.080 1.00 . A X . 12 LEU HG 1 1 8 3212 1 1 12 LEU N N 4.258 6.359 1.997 1.00 . A X . 12 LEU N 1 1 8 3213 1 1 12 LEU O O 2.346 4.438 3.226 1.00 . A X . 12 LEU O 1 1 8 3214 1 1 13 LEU C C 1.434 2.256 1.474 1.00 . A X . 13 LEU C 1 1 8 3215 1 1 13 LEU CA C 2.775 1.882 2.110 1.00 . A X . 13 LEU CA 1 1 8 3216 1 1 13 LEU CB C 2.545 1.360 3.532 1.00 . A X . 13 LEU CB 1 1 8 3217 1 1 13 LEU CD1 C 3.474 0.488 5.695 1.00 . A X . 13 LEU CD1 1 1 8 3218 1 1 13 LEU CD2 C 4.389 -0.345 3.522 1.00 . A X . 13 LEU CD2 1 1 8 3219 1 1 13 LEU CG C 3.798 0.853 4.254 1.00 . A X . 13 LEU CG 1 1 8 3220 1 1 13 LEU H H 4.575 2.912 1.669 1.00 . A X . 13 LEU H 1 1 8 3221 1 1 13 LEU HA H 3.225 1.096 1.524 1.00 . A X . 13 LEU HA 1 1 8 3222 1 1 13 LEU HB2 H 2.116 2.158 4.118 1.00 . A X . 13 LEU HB2 1 1 8 3223 1 1 13 LEU HB3 H 1.834 0.549 3.483 1.00 . A X . 13 LEU HB3 1 1 8 3224 1 1 13 LEU HD11 H 4.374 0.161 6.195 1.00 . A X . 13 LEU HD11 1 1 8 3225 1 1 13 LEU HD12 H 2.747 -0.309 5.709 1.00 . A X . 13 LEU HD12 1 1 8 3226 1 1 13 LEU HD13 H 3.072 1.351 6.203 1.00 . A X . 13 LEU HD13 1 1 8 3227 1 1 13 LEU HD21 H 4.657 -0.060 2.515 1.00 . A X . 13 LEU HD21 1 1 8 3228 1 1 13 LEU HD22 H 3.662 -1.142 3.489 1.00 . A X . 13 LEU HD22 1 1 8 3229 1 1 13 LEU HD23 H 5.270 -0.685 4.045 1.00 . A X . 13 LEU HD23 1 1 8 3230 1 1 13 LEU HG H 4.538 1.640 4.265 1.00 . A X . 13 LEU HG 1 1 8 3231 1 1 13 LEU N N 3.711 3.010 2.126 1.00 . A X . 13 LEU N 1 1 8 3232 1 1 13 LEU O O 0.373 1.839 1.946 1.00 . A X . 13 LEU O 1 1 8 3233 1 1 14 TRP C C -0.276 2.257 -1.091 1.00 . A X . 14 TRP C 1 1 8 3234 1 1 14 TRP CA C 0.278 3.436 -0.302 1.00 . A X . 14 TRP CA 1 1 8 3235 1 1 14 TRP CB C 0.579 4.623 -1.224 1.00 . A X . 14 TRP CB 1 1 8 3236 1 1 14 TRP CD1 C -1.748 5.663 -1.484 1.00 . A X . 14 TRP CD1 1 1 8 3237 1 1 14 TRP CD2 C -0.766 5.117 -3.415 1.00 . A X . 14 TRP CD2 1 1 8 3238 1 1 14 TRP CE2 C -2.029 5.671 -3.697 1.00 . A X . 14 TRP CE2 1 1 8 3239 1 1 14 TRP CE3 C 0.040 4.699 -4.477 1.00 . A X . 14 TRP CE3 1 1 8 3240 1 1 14 TRP CG C -0.610 5.116 -1.994 1.00 . A X . 14 TRP CG 1 1 8 3241 1 1 14 TRP CH2 C -1.691 5.404 -6.018 1.00 . A X . 14 TRP CH2 1 1 8 3242 1 1 14 TRP CZ2 C -2.501 5.819 -4.998 1.00 . A X . 14 TRP CZ2 1 1 8 3243 1 1 14 TRP CZ3 C -0.430 4.849 -5.766 1.00 . A X . 14 TRP CZ3 1 1 8 3244 1 1 14 TRP H H 2.354 3.310 0.055 1.00 . A X . 14 TRP H 1 1 8 3245 1 1 14 TRP HA H -0.450 3.736 0.439 1.00 . A X . 14 TRP HA 1 1 8 3246 1 1 14 TRP HB2 H 0.950 5.442 -0.628 1.00 . A X . 14 TRP HB2 1 1 8 3247 1 1 14 TRP HB3 H 1.340 4.331 -1.933 1.00 . A X . 14 TRP HB3 1 1 8 3248 1 1 14 TRP HD1 H -1.935 5.803 -0.431 1.00 . A X . 14 TRP HD1 1 1 8 3249 1 1 14 TRP HE1 H -3.498 6.396 -2.390 1.00 . A X . 14 TRP HE1 1 1 8 3250 1 1 14 TRP HE3 H 1.016 4.266 -4.304 1.00 . A X . 14 TRP HE3 1 1 8 3251 1 1 14 TRP HH2 H -2.018 5.503 -7.043 1.00 . A X . 14 TRP HH2 1 1 8 3252 1 1 14 TRP HZ2 H -3.468 6.246 -5.211 1.00 . A X . 14 TRP HZ2 1 1 8 3253 1 1 14 TRP HZ3 H 0.179 4.534 -6.600 1.00 . A X . 14 TRP HZ3 1 1 8 3254 1 1 14 TRP N N 1.485 3.025 0.394 1.00 . A X . 14 TRP N 1 1 8 3255 1 1 14 TRP NE1 N -2.611 5.992 -2.502 1.00 . A X . 14 TRP NE1 1 1 8 3256 1 1 14 TRP O O -1.284 1.662 -0.709 1.00 . A X . 14 TRP O 1 1 8 3257 1 1 15 LYS C C 1.378 0.077 -3.445 1.00 . A X . 15 LYS C 1 1 8 3258 1 1 15 LYS CA C 0.090 0.711 -2.936 1.00 . A X . 15 LYS CA 1 1 8 3259 1 1 15 LYS CB C -0.865 1.000 -4.103 1.00 . A X . 15 LYS CB 1 1 8 3260 1 1 15 LYS CD C -3.221 1.424 -4.873 1.00 . A X . 15 LYS CD 1 1 8 3261 1 1 15 LYS CE C -4.687 1.408 -4.466 1.00 . A X . 15 LYS CE 1 1 8 3262 1 1 15 LYS CG C -2.306 1.242 -3.675 1.00 . A X . 15 LYS CG 1 1 8 3263 1 1 15 LYS H H 1.108 2.509 -2.505 1.00 . A X . 15 LYS H 1 1 8 3264 1 1 15 LYS HA H -0.385 0.024 -2.253 1.00 . A X . 15 LYS HA 1 1 8 3265 1 1 15 LYS HB2 H -0.516 1.879 -4.624 1.00 . A X . 15 LYS HB2 1 1 8 3266 1 1 15 LYS HB3 H -0.850 0.160 -4.782 1.00 . A X . 15 LYS HB3 1 1 8 3267 1 1 15 LYS HD2 H -3.000 2.369 -5.345 1.00 . A X . 15 LYS HD2 1 1 8 3268 1 1 15 LYS HD3 H -3.044 0.620 -5.573 1.00 . A X . 15 LYS HD3 1 1 8 3269 1 1 15 LYS HE2 H -5.294 1.455 -5.357 1.00 . A X . 15 LYS HE2 1 1 8 3270 1 1 15 LYS HE3 H -4.889 0.483 -3.947 1.00 . A X . 15 LYS HE3 1 1 8 3271 1 1 15 LYS HG2 H -2.646 0.395 -3.099 1.00 . A X . 15 LYS HG2 1 1 8 3272 1 1 15 LYS HG3 H -2.344 2.133 -3.065 1.00 . A X . 15 LYS HG3 1 1 8 3273 1 1 15 LYS HZ1 H -4.409 2.582 -2.757 1.00 . A X . 15 LYS HZ1 1 1 8 3274 1 1 15 LYS HZ2 H -6.028 2.433 -3.235 1.00 . A X . 15 LYS HZ2 1 1 8 3275 1 1 15 LYS HZ3 H -4.984 3.447 -4.103 1.00 . A X . 15 LYS HZ3 1 1 8 3276 1 1 15 LYS N N 0.396 1.921 -2.186 1.00 . A X . 15 LYS N 1 1 8 3277 1 1 15 LYS NZ N -5.048 2.546 -3.580 1.00 . A X . 15 LYS NZ 1 1 8 3278 1 1 15 LYS O O 1.897 -0.867 -2.848 1.00 . A X . 15 LYS O 1 1 8 3279 1 1 16 ALA C C 4.349 0.699 -4.229 1.00 . A X . 16 ALA C 1 1 8 3280 1 1 16 ALA CA C 3.191 0.165 -5.066 1.00 . A X . 16 ALA CA 1 1 8 3281 1 1 16 ALA CB C 3.337 0.595 -6.515 1.00 . A X . 16 ALA CB 1 1 8 3282 1 1 16 ALA H H 1.437 1.349 -4.987 1.00 . A X . 16 ALA H 1 1 8 3283 1 1 16 ALA HA H 3.197 -0.913 -5.030 1.00 . A X . 16 ALA HA 1 1 8 3284 1 1 16 ALA HB1 H 2.523 0.187 -7.096 1.00 . A X . 16 ALA HB1 1 1 8 3285 1 1 16 ALA HB2 H 4.276 0.232 -6.905 1.00 . A X . 16 ALA HB2 1 1 8 3286 1 1 16 ALA HB3 H 3.316 1.673 -6.575 1.00 . A X . 16 ALA HB3 1 1 8 3287 1 1 16 ALA N N 1.916 0.627 -4.527 1.00 . A X . 16 ALA N 1 1 8 3288 1 1 16 ALA O O 5.512 0.367 -4.455 1.00 . A X . 16 ALA O 1 1 8 3289 1 1 17 LEU C C 5.192 1.290 -1.120 1.00 . A X . 17 LEU C 1 1 8 3290 1 1 17 LEU CA C 4.986 2.133 -2.371 1.00 . A X . 17 LEU CA 1 1 8 3291 1 1 17 LEU CB C 4.527 3.544 -2.001 1.00 . A X . 17 LEU CB 1 1 8 3292 1 1 17 LEU CD1 C 3.750 5.816 -2.725 1.00 . A X . 17 LEU CD1 1 1 8 3293 1 1 17 LEU CD2 C 5.645 4.712 -3.922 1.00 . A X . 17 LEU CD2 1 1 8 3294 1 1 17 LEU CG C 4.330 4.490 -3.189 1.00 . A X . 17 LEU CG 1 1 8 3295 1 1 17 LEU H H 3.059 1.655 -3.063 1.00 . A X . 17 LEU H 1 1 8 3296 1 1 17 LEU HA H 5.918 2.193 -2.911 1.00 . A X . 17 LEU HA 1 1 8 3297 1 1 17 LEU HB2 H 3.591 3.467 -1.468 1.00 . A X . 17 LEU HB2 1 1 8 3298 1 1 17 LEU HB3 H 5.264 3.978 -1.341 1.00 . A X . 17 LEU HB3 1 1 8 3299 1 1 17 LEU HD11 H 2.793 5.644 -2.251 1.00 . A X . 17 LEU HD11 1 1 8 3300 1 1 17 LEU HD12 H 3.617 6.468 -3.576 1.00 . A X . 17 LEU HD12 1 1 8 3301 1 1 17 LEU HD13 H 4.424 6.276 -2.019 1.00 . A X . 17 LEU HD13 1 1 8 3302 1 1 17 LEU HD21 H 5.488 5.391 -4.747 1.00 . A X . 17 LEU HD21 1 1 8 3303 1 1 17 LEU HD22 H 6.011 3.767 -4.299 1.00 . A X . 17 LEU HD22 1 1 8 3304 1 1 17 LEU HD23 H 6.371 5.133 -3.242 1.00 . A X . 17 LEU HD23 1 1 8 3305 1 1 17 LEU HG H 3.631 4.044 -3.883 1.00 . A X . 17 LEU HG 1 1 8 3306 1 1 17 LEU N N 4.005 1.502 -3.235 1.00 . A X . 17 LEU N 1 1 8 3307 1 1 17 LEU O O 5.498 1.804 -0.044 1.00 . A X . 17 LEU O 1 1 8 3308 1 1 18 ALA C C 6.668 -1.469 -0.311 1.00 . A X . 18 ALA C 1 1 8 3309 1 1 18 ALA CA C 5.240 -0.953 -0.204 1.00 . A X . 18 ALA CA 1 1 8 3310 1 1 18 ALA CB C 4.247 -2.105 -0.255 1.00 . A X . 18 ALA CB 1 1 8 3311 1 1 18 ALA H H 4.637 -0.336 -2.128 1.00 . A X . 18 ALA H 1 1 8 3312 1 1 18 ALA HA H 5.116 -0.436 0.734 1.00 . A X . 18 ALA HA 1 1 8 3313 1 1 18 ALA HB1 H 4.419 -2.767 0.581 1.00 . A X . 18 ALA HB1 1 1 8 3314 1 1 18 ALA HB2 H 4.375 -2.651 -1.177 1.00 . A X . 18 ALA HB2 1 1 8 3315 1 1 18 ALA HB3 H 3.241 -1.715 -0.205 1.00 . A X . 18 ALA HB3 1 1 8 3316 1 1 18 ALA N N 4.980 -0.008 -1.272 1.00 . A X . 18 ALA N 1 1 8 3317 1 1 18 ALA O O 7.299 -1.816 0.687 1.00 . A X . 18 ALA O 1 1 8 3318 1 1 19 LEU C C 9.333 -0.680 -2.236 1.00 . A X . 19 LEU C 1 1 8 3319 1 1 19 LEU CA C 8.541 -1.906 -1.806 1.00 . A X . 19 LEU CA 1 1 8 3320 1 1 19 LEU CB C 8.623 -2.985 -2.897 1.00 . A X . 19 LEU CB 1 1 8 3321 1 1 19 LEU CD1 C 6.695 -4.489 -2.303 1.00 . A X . 19 LEU CD1 1 1 8 3322 1 1 19 LEU CD2 C 8.673 -5.408 -3.512 1.00 . A X . 19 LEU CD2 1 1 8 3323 1 1 19 LEU CG C 8.201 -4.398 -2.481 1.00 . A X . 19 LEU CG 1 1 8 3324 1 1 19 LEU H H 6.584 -1.298 -2.297 1.00 . A X . 19 LEU H 1 1 8 3325 1 1 19 LEU HA H 8.960 -2.295 -0.890 1.00 . A X . 19 LEU HA 1 1 8 3326 1 1 19 LEU HB2 H 7.993 -2.677 -3.718 1.00 . A X . 19 LEU HB2 1 1 8 3327 1 1 19 LEU HB3 H 9.643 -3.031 -3.251 1.00 . A X . 19 LEU HB3 1 1 8 3328 1 1 19 LEU HD11 H 6.207 -4.233 -3.231 1.00 . A X . 19 LEU HD11 1 1 8 3329 1 1 19 LEU HD12 H 6.381 -3.803 -1.529 1.00 . A X . 19 LEU HD12 1 1 8 3330 1 1 19 LEU HD13 H 6.427 -5.496 -2.021 1.00 . A X . 19 LEU HD13 1 1 8 3331 1 1 19 LEU HD21 H 8.338 -6.395 -3.229 1.00 . A X . 19 LEU HD21 1 1 8 3332 1 1 19 LEU HD22 H 9.750 -5.394 -3.563 1.00 . A X . 19 LEU HD22 1 1 8 3333 1 1 19 LEU HD23 H 8.263 -5.152 -4.478 1.00 . A X . 19 LEU HD23 1 1 8 3334 1 1 19 LEU HG H 8.665 -4.642 -1.536 1.00 . A X . 19 LEU HG 1 1 8 3335 1 1 19 LEU N N 7.162 -1.526 -1.543 1.00 . A X . 19 LEU N 1 1 8 3336 1 1 19 LEU O O 10.357 -0.363 -1.638 1.00 . A X . 19 LEU O 1 1 8 3337 1 1 20 LYS C C 10.942 0.978 -4.126 1.00 . A X . 20 LYS C 1 1 8 3338 1 1 20 LYS CA C 9.477 1.239 -3.753 1.00 . A X . 20 LYS CA 1 1 8 3339 1 1 20 LYS CB C 9.354 2.344 -2.691 1.00 . A X . 20 LYS CB 1 1 8 3340 1 1 20 LYS CD C 9.680 4.747 -2.059 1.00 . A X . 20 LYS CD 1 1 8 3341 1 1 20 LYS CE C 10.299 6.072 -2.465 1.00 . A X . 20 LYS CE 1 1 8 3342 1 1 20 LYS CG C 9.816 3.711 -3.160 1.00 . A X . 20 LYS CG 1 1 8 3343 1 1 20 LYS H H 8.044 -0.319 -3.729 1.00 . A X . 20 LYS H 1 1 8 3344 1 1 20 LYS HA H 8.948 1.550 -4.643 1.00 . A X . 20 LYS HA 1 1 8 3345 1 1 20 LYS HB2 H 8.319 2.424 -2.393 1.00 . A X . 20 LYS HB2 1 1 8 3346 1 1 20 LYS HB3 H 9.943 2.065 -1.830 1.00 . A X . 20 LYS HB3 1 1 8 3347 1 1 20 LYS HD2 H 8.633 4.901 -1.848 1.00 . A X . 20 LYS HD2 1 1 8 3348 1 1 20 LYS HD3 H 10.180 4.383 -1.175 1.00 . A X . 20 LYS HD3 1 1 8 3349 1 1 20 LYS HE2 H 9.821 6.417 -3.370 1.00 . A X . 20 LYS HE2 1 1 8 3350 1 1 20 LYS HE3 H 10.133 6.789 -1.675 1.00 . A X . 20 LYS HE3 1 1 8 3351 1 1 20 LYS HG2 H 10.851 3.648 -3.458 1.00 . A X . 20 LYS HG2 1 1 8 3352 1 1 20 LYS HG3 H 9.214 4.014 -4.004 1.00 . A X . 20 LYS HG3 1 1 8 3353 1 1 20 LYS HZ1 H 12.248 5.650 -1.832 1.00 . A X . 20 LYS HZ1 1 1 8 3354 1 1 20 LYS HZ2 H 12.152 6.864 -3.013 1.00 . A X . 20 LYS HZ2 1 1 8 3355 1 1 20 LYS HZ3 H 11.946 5.240 -3.450 1.00 . A X . 20 LYS HZ3 1 1 8 3356 1 1 20 LYS N N 8.846 0.009 -3.272 1.00 . A X . 20 LYS N 1 1 8 3357 1 1 20 LYS NZ N 11.761 5.947 -2.706 1.00 . A X . 20 LYS NZ 1 1 8 3358 1 1 20 LYS O O 11.856 1.681 -3.683 1.00 . A X . 20 LYS O 1 1 8 3359 1 1 21 LEU C C 13.387 -0.923 -4.230 1.00 . A X . 21 LEU C 1 1 8 3360 1 1 21 LEU CA C 12.481 -0.482 -5.385 1.00 . A X . 21 LEU CA 1 1 8 3361 1 1 21 LEU CB C 13.152 0.649 -6.173 1.00 . A X . 21 LEU CB 1 1 8 3362 1 1 21 LEU CD1 C 13.164 2.210 -8.140 1.00 . A X . 21 LEU CD1 1 1 8 3363 1 1 21 LEU CD2 C 12.307 -0.125 -8.402 1.00 . A X . 21 LEU CD2 1 1 8 3364 1 1 21 LEU CG C 12.431 1.064 -7.458 1.00 . A X . 21 LEU CG 1 1 8 3365 1 1 21 LEU H H 10.366 -0.603 -5.213 1.00 . A X . 21 LEU H 1 1 8 3366 1 1 21 LEU HA H 12.345 -1.325 -6.046 1.00 . A X . 21 LEU HA 1 1 8 3367 1 1 21 LEU HB2 H 13.222 1.513 -5.528 1.00 . A X . 21 LEU HB2 1 1 8 3368 1 1 21 LEU HB3 H 14.151 0.333 -6.433 1.00 . A X . 21 LEU HB3 1 1 8 3369 1 1 21 LEU HD11 H 13.224 3.052 -7.468 1.00 . A X . 21 LEU HD11 1 1 8 3370 1 1 21 LEU HD12 H 12.628 2.499 -9.032 1.00 . A X . 21 LEU HD12 1 1 8 3371 1 1 21 LEU HD13 H 14.161 1.891 -8.408 1.00 . A X . 21 LEU HD13 1 1 8 3372 1 1 21 LEU HD21 H 11.784 0.178 -9.296 1.00 . A X . 21 LEU HD21 1 1 8 3373 1 1 21 LEU HD22 H 11.759 -0.917 -7.913 1.00 . A X . 21 LEU HD22 1 1 8 3374 1 1 21 LEU HD23 H 13.293 -0.480 -8.665 1.00 . A X . 21 LEU HD23 1 1 8 3375 1 1 21 LEU HG H 11.435 1.403 -7.212 1.00 . A X . 21 LEU HG 1 1 8 3376 1 1 21 LEU N N 11.148 -0.076 -4.919 1.00 . A X . 21 LEU N 1 1 8 3377 1 1 21 LEU O O 14.572 -1.197 -4.427 1.00 . A X . 21 LEU O 1 1 8 3378 1 1 22 LYS C C 12.999 -2.758 -1.381 1.00 . A X . 22 LYS C 1 1 8 3379 1 1 22 LYS CA C 13.556 -1.424 -1.858 1.00 . A X . 22 LYS CA 1 1 8 3380 1 1 22 LYS CB C 13.451 -0.362 -0.759 1.00 . A X . 22 LYS CB 1 1 8 3381 1 1 22 LYS CD C 14.092 0.423 1.531 1.00 . A X . 22 LYS CD 1 1 8 3382 1 1 22 LYS CE C 14.852 0.109 2.809 1.00 . A X . 22 LYS CE 1 1 8 3383 1 1 22 LYS CG C 14.237 -0.683 0.500 1.00 . A X . 22 LYS CG 1 1 8 3384 1 1 22 LYS H H 11.885 -0.728 -2.935 1.00 . A X . 22 LYS H 1 1 8 3385 1 1 22 LYS HA H 14.592 -1.555 -2.134 1.00 . A X . 22 LYS HA 1 1 8 3386 1 1 22 LYS HB2 H 13.810 0.579 -1.149 1.00 . A X . 22 LYS HB2 1 1 8 3387 1 1 22 LYS HB3 H 12.412 -0.251 -0.485 1.00 . A X . 22 LYS HB3 1 1 8 3388 1 1 22 LYS HD2 H 14.477 1.341 1.114 1.00 . A X . 22 LYS HD2 1 1 8 3389 1 1 22 LYS HD3 H 13.045 0.545 1.765 1.00 . A X . 22 LYS HD3 1 1 8 3390 1 1 22 LYS HE2 H 15.892 -0.034 2.563 1.00 . A X . 22 LYS HE2 1 1 8 3391 1 1 22 LYS HE3 H 14.755 0.948 3.482 1.00 . A X . 22 LYS HE3 1 1 8 3392 1 1 22 LYS HG2 H 13.865 -1.605 0.921 1.00 . A X . 22 LYS HG2 1 1 8 3393 1 1 22 LYS HG3 H 15.282 -0.794 0.246 1.00 . A X . 22 LYS HG3 1 1 8 3394 1 1 22 LYS HZ1 H 14.642 -1.971 2.964 1.00 . A X . 22 LYS HZ1 1 1 8 3395 1 1 22 LYS HZ2 H 13.307 -1.098 3.544 1.00 . A X . 22 LYS HZ2 1 1 8 3396 1 1 22 LYS HZ3 H 14.729 -1.169 4.458 1.00 . A X . 22 LYS HZ3 1 1 8 3397 1 1 22 LYS N N 12.825 -0.990 -3.034 1.00 . A X . 22 LYS N 1 1 8 3398 1 1 22 LYS NZ N 14.347 -1.116 3.488 1.00 . A X . 22 LYS NZ 1 1 8 3399 1 1 22 LYS O O 12.116 -2.812 -0.524 1.00 . A X . 22 LYS O 1 1 8 3400 1 1 23 LYS C C 13.441 -5.551 -0.228 1.00 . A X . 23 LYS C 1 1 8 3401 1 1 23 LYS CA C 13.039 -5.172 -1.646 1.00 . A X . 23 LYS CA 1 1 8 3402 1 1 23 LYS CB C 13.604 -6.178 -2.651 1.00 . A X . 23 LYS CB 1 1 8 3403 1 1 23 LYS CD C 13.850 -6.847 -5.069 1.00 . A X . 23 LYS CD 1 1 8 3404 1 1 23 LYS CE C 13.321 -8.260 -4.870 1.00 . A X . 23 LYS CE 1 1 8 3405 1 1 23 LYS CG C 13.228 -5.864 -4.089 1.00 . A X . 23 LYS CG 1 1 8 3406 1 1 23 LYS H H 14.230 -3.726 -2.614 1.00 . A X . 23 LYS H 1 1 8 3407 1 1 23 LYS HA H 11.962 -5.168 -1.716 1.00 . A X . 23 LYS HA 1 1 8 3408 1 1 23 LYS HB2 H 14.680 -6.181 -2.571 1.00 . A X . 23 LYS HB2 1 1 8 3409 1 1 23 LYS HB3 H 13.231 -7.163 -2.408 1.00 . A X . 23 LYS HB3 1 1 8 3410 1 1 23 LYS HD2 H 13.620 -6.529 -6.075 1.00 . A X . 23 LYS HD2 1 1 8 3411 1 1 23 LYS HD3 H 14.921 -6.850 -4.930 1.00 . A X . 23 LYS HD3 1 1 8 3412 1 1 23 LYS HE2 H 13.623 -8.610 -3.894 1.00 . A X . 23 LYS HE2 1 1 8 3413 1 1 23 LYS HE3 H 12.243 -8.241 -4.928 1.00 . A X . 23 LYS HE3 1 1 8 3414 1 1 23 LYS HG2 H 12.154 -5.909 -4.186 1.00 . A X . 23 LYS HG2 1 1 8 3415 1 1 23 LYS HG3 H 13.569 -4.868 -4.330 1.00 . A X . 23 LYS HG3 1 1 8 3416 1 1 23 LYS HZ1 H 14.889 -9.246 -5.841 1.00 . A X . 23 LYS HZ1 1 1 8 3417 1 1 23 LYS HZ2 H 13.579 -8.868 -6.853 1.00 . A X . 23 LYS HZ2 1 1 8 3418 1 1 23 LYS HZ3 H 13.455 -10.152 -5.751 1.00 . A X . 23 LYS HZ3 1 1 8 3419 1 1 23 LYS N N 13.509 -3.834 -1.962 1.00 . A X . 23 LYS N 1 1 8 3420 1 1 23 LYS NZ N 13.847 -9.195 -5.899 1.00 . A X . 23 LYS NZ 1 1 8 3421 1 1 23 LYS O O 12.698 -6.224 0.486 1.00 . A X . 23 LYS O 1 1 8 3422 1 1 24 ALA C C 14.904 -4.068 2.352 1.00 . A X . 24 ALA C 1 1 8 3423 1 1 24 ALA CA C 15.098 -5.328 1.524 1.00 . A X . 24 ALA CA 1 1 8 3424 1 1 24 ALA CB C 16.562 -5.745 1.509 1.00 . A X . 24 ALA CB 1 1 8 3425 1 1 24 ALA H H 15.180 -4.602 -0.455 1.00 . A X . 24 ALA H 1 1 8 3426 1 1 24 ALA HA H 14.519 -6.132 1.959 1.00 . A X . 24 ALA HA 1 1 8 3427 1 1 24 ALA HB1 H 16.882 -5.963 2.517 1.00 . A X . 24 ALA HB1 1 1 8 3428 1 1 24 ALA HB2 H 17.162 -4.940 1.108 1.00 . A X . 24 ALA HB2 1 1 8 3429 1 1 24 ALA HB3 H 16.682 -6.625 0.892 1.00 . A X . 24 ALA HB3 1 1 8 3430 1 1 24 ALA N N 14.619 -5.105 0.174 1.00 . A X . 24 ALA N 1 1 8 3431 1 1 24 ALA O O 13.924 -3.995 3.118 1.00 . A X . 24 ALA O 1 1 8 3432 1 1 24 ALA OXT O 15.717 -3.135 2.211 1.00 . A X . 24 ALA OXT 1 1 9 3433 1 1 1 LYS C C -4.859 14.727 13.349 1.00 . A X . 1 LYS C 1 1 9 3434 1 1 1 LYS CA C -4.236 14.358 14.692 1.00 . A X . 1 LYS CA 1 1 9 3435 1 1 1 LYS CB C -5.124 14.909 15.810 1.00 . A X . 1 LYS CB 1 1 9 3436 1 1 1 LYS CD C -5.588 15.164 18.255 1.00 . A X . 1 LYS CD 1 1 9 3437 1 1 1 LYS CE C -5.118 14.892 19.675 1.00 . A X . 1 LYS CE 1 1 9 3438 1 1 1 LYS CG C -4.644 14.583 17.214 1.00 . A X . 1 LYS CG 1 1 9 3439 1 1 1 LYS H1 H -2.875 15.938 14.784 1.00 . A X . 1 LYS H1 1 1 9 3440 1 1 1 LYS H2 H -2.277 14.556 14.003 1.00 . A X . 1 LYS H2 1 1 9 3441 1 1 1 LYS H3 H -2.418 14.581 15.690 1.00 . A X . 1 LYS H3 1 1 9 3442 1 1 1 LYS HA H -4.190 13.283 14.772 1.00 . A X . 1 LYS HA 1 1 9 3443 1 1 1 LYS HB2 H -5.175 15.983 15.714 1.00 . A X . 1 LYS HB2 1 1 9 3444 1 1 1 LYS HB3 H -6.119 14.502 15.691 1.00 . A X . 1 LYS HB3 1 1 9 3445 1 1 1 LYS HD2 H -5.652 16.231 18.111 1.00 . A X . 1 LYS HD2 1 1 9 3446 1 1 1 LYS HD3 H -6.565 14.723 18.121 1.00 . A X . 1 LYS HD3 1 1 9 3447 1 1 1 LYS HE2 H -5.851 15.282 20.364 1.00 . A X . 1 LYS HE2 1 1 9 3448 1 1 1 LYS HE3 H -5.026 13.825 19.813 1.00 . A X . 1 LYS HE3 1 1 9 3449 1 1 1 LYS HG2 H -4.602 13.511 17.332 1.00 . A X . 1 LYS HG2 1 1 9 3450 1 1 1 LYS HG3 H -3.659 15.005 17.356 1.00 . A X . 1 LYS HG3 1 1 9 3451 1 1 1 LYS HZ1 H -3.037 14.989 19.504 1.00 . A X . 1 LYS HZ1 1 1 9 3452 1 1 1 LYS HZ2 H -3.637 15.558 20.986 1.00 . A X . 1 LYS HZ2 1 1 9 3453 1 1 1 LYS HZ3 H -3.796 16.504 19.591 1.00 . A X . 1 LYS HZ3 1 1 9 3454 1 1 1 LYS N N -2.859 14.894 14.802 1.00 . A X . 1 LYS N 1 1 9 3455 1 1 1 LYS NZ N -3.807 15.529 19.957 1.00 . A X . 1 LYS NZ 1 1 9 3456 1 1 1 LYS O O -5.653 13.965 12.794 1.00 . A X . 1 LYS O 1 1 9 3457 1 1 2 LYS C C -4.271 15.943 10.391 1.00 . A X . 2 LYS C 1 1 9 3458 1 1 2 LYS CA C -5.080 16.402 11.600 1.00 . A X . 2 LYS CA 1 1 9 3459 1 1 2 LYS CB C -5.136 17.932 11.643 1.00 . A X . 2 LYS CB 1 1 9 3460 1 1 2 LYS CD C -5.836 20.070 10.530 1.00 . A X . 2 LYS CD 1 1 9 3461 1 1 2 LYS CE C -6.785 20.707 9.524 1.00 . A X . 2 LYS CE 1 1 9 3462 1 1 2 LYS CG C -5.942 18.553 10.513 1.00 . A X . 2 LYS CG 1 1 9 3463 1 1 2 LYS H H -3.816 16.437 13.293 1.00 . A X . 2 LYS H 1 1 9 3464 1 1 2 LYS HA H -6.085 16.013 11.518 1.00 . A X . 2 LYS HA 1 1 9 3465 1 1 2 LYS HB2 H -5.580 18.236 12.579 1.00 . A X . 2 LYS HB2 1 1 9 3466 1 1 2 LYS HB3 H -4.129 18.316 11.590 1.00 . A X . 2 LYS HB3 1 1 9 3467 1 1 2 LYS HD2 H -6.082 20.428 11.518 1.00 . A X . 2 LYS HD2 1 1 9 3468 1 1 2 LYS HD3 H -4.823 20.353 10.284 1.00 . A X . 2 LYS HD3 1 1 9 3469 1 1 2 LYS HE2 H -7.800 20.470 9.808 1.00 . A X . 2 LYS HE2 1 1 9 3470 1 1 2 LYS HE3 H -6.647 21.778 9.547 1.00 . A X . 2 LYS HE3 1 1 9 3471 1 1 2 LYS HG2 H -5.568 18.184 9.568 1.00 . A X . 2 LYS HG2 1 1 9 3472 1 1 2 LYS HG3 H -6.979 18.272 10.626 1.00 . A X . 2 LYS HG3 1 1 9 3473 1 1 2 LYS HZ1 H -5.577 20.440 7.833 1.00 . A X . 2 LYS HZ1 1 1 9 3474 1 1 2 LYS HZ2 H -7.223 20.665 7.482 1.00 . A X . 2 LYS HZ2 1 1 9 3475 1 1 2 LYS HZ3 H -6.687 19.182 8.101 1.00 . A X . 2 LYS HZ3 1 1 9 3476 1 1 2 LYS N N -4.499 15.895 12.833 1.00 . A X . 2 LYS N 1 1 9 3477 1 1 2 LYS NZ N -6.548 20.216 8.141 1.00 . A X . 2 LYS NZ 1 1 9 3478 1 1 2 LYS O O -3.352 16.632 9.946 1.00 . A X . 2 LYS O 1 1 9 3479 1 1 3 LEU C C -5.019 13.667 7.727 1.00 . A X . 3 LEU C 1 1 9 3480 1 1 3 LEU CA C -3.974 14.274 8.658 1.00 . A X . 3 LEU CA 1 1 9 3481 1 1 3 LEU CB C -2.854 13.257 8.961 1.00 . A X . 3 LEU CB 1 1 9 3482 1 1 3 LEU CD1 C -2.233 10.883 9.473 1.00 . A X . 3 LEU CD1 1 1 9 3483 1 1 3 LEU CD2 C -3.433 12.218 11.190 1.00 . A X . 3 LEU CD2 1 1 9 3484 1 1 3 LEU CG C -3.267 11.972 9.698 1.00 . A X . 3 LEU CG 1 1 9 3485 1 1 3 LEU H H -5.292 14.231 10.311 1.00 . A X . 3 LEU H 1 1 9 3486 1 1 3 LEU HA H -3.538 15.127 8.156 1.00 . A X . 3 LEU HA 1 1 9 3487 1 1 3 LEU HB2 H -2.405 12.969 8.021 1.00 . A X . 3 LEU HB2 1 1 9 3488 1 1 3 LEU HB3 H -2.101 13.755 9.554 1.00 . A X . 3 LEU HB3 1 1 9 3489 1 1 3 LEU HD11 H -1.269 11.226 9.815 1.00 . A X . 3 LEU HD11 1 1 9 3490 1 1 3 LEU HD12 H -2.180 10.649 8.419 1.00 . A X . 3 LEU HD12 1 1 9 3491 1 1 3 LEU HD13 H -2.515 9.999 10.025 1.00 . A X . 3 LEU HD13 1 1 9 3492 1 1 3 LEU HD21 H -3.734 11.301 11.676 1.00 . A X . 3 LEU HD21 1 1 9 3493 1 1 3 LEU HD22 H -4.188 12.973 11.348 1.00 . A X . 3 LEU HD22 1 1 9 3494 1 1 3 LEU HD23 H -2.495 12.556 11.604 1.00 . A X . 3 LEU HD23 1 1 9 3495 1 1 3 LEU HG H -4.211 11.625 9.304 1.00 . A X . 3 LEU HG 1 1 9 3496 1 1 3 LEU N N -4.604 14.772 9.871 1.00 . A X . 3 LEU N 1 1 9 3497 1 1 3 LEU O O -5.431 12.518 7.888 1.00 . A X . 3 LEU O 1 1 9 3498 1 1 4 LYS C C -5.960 14.383 4.385 1.00 . A X . 4 LYS C 1 1 9 3499 1 1 4 LYS CA C -6.428 13.993 5.783 1.00 . A X . 4 LYS CA 1 1 9 3500 1 1 4 LYS CB C -7.820 14.561 6.087 1.00 . A X . 4 LYS CB 1 1 9 3501 1 1 4 LYS CD C -10.307 14.366 5.748 1.00 . A X . 4 LYS CD 1 1 9 3502 1 1 4 LYS CE C -10.582 13.908 7.170 1.00 . A X . 4 LYS CE 1 1 9 3503 1 1 4 LYS CG C -8.936 13.916 5.273 1.00 . A X . 4 LYS CG 1 1 9 3504 1 1 4 LYS H H -5.131 15.385 6.712 1.00 . A X . 4 LYS H 1 1 9 3505 1 1 4 LYS HA H -6.468 12.914 5.845 1.00 . A X . 4 LYS HA 1 1 9 3506 1 1 4 LYS HB2 H -8.035 14.413 7.134 1.00 . A X . 4 LYS HB2 1 1 9 3507 1 1 4 LYS HB3 H -7.818 15.620 5.875 1.00 . A X . 4 LYS HB3 1 1 9 3508 1 1 4 LYS HD2 H -10.355 15.443 5.711 1.00 . A X . 4 LYS HD2 1 1 9 3509 1 1 4 LYS HD3 H -11.059 13.947 5.094 1.00 . A X . 4 LYS HD3 1 1 9 3510 1 1 4 LYS HE2 H -10.478 12.834 7.213 1.00 . A X . 4 LYS HE2 1 1 9 3511 1 1 4 LYS HE3 H -9.858 14.366 7.831 1.00 . A X . 4 LYS HE3 1 1 9 3512 1 1 4 LYS HG2 H -8.820 14.189 4.236 1.00 . A X . 4 LYS HG2 1 1 9 3513 1 1 4 LYS HG3 H -8.865 12.843 5.376 1.00 . A X . 4 LYS HG3 1 1 9 3514 1 1 4 LYS HZ1 H -12.661 13.778 7.044 1.00 . A X . 4 LYS HZ1 1 1 9 3515 1 1 4 LYS HZ2 H -12.099 15.303 7.514 1.00 . A X . 4 LYS HZ2 1 1 9 3516 1 1 4 LYS HZ3 H -12.081 14.016 8.619 1.00 . A X . 4 LYS HZ3 1 1 9 3517 1 1 4 LYS N N -5.464 14.456 6.765 1.00 . A X . 4 LYS N 1 1 9 3518 1 1 4 LYS NZ N -11.949 14.276 7.619 1.00 . A X . 4 LYS NZ 1 1 9 3519 1 1 4 LYS O O -6.672 15.046 3.627 1.00 . A X . 4 LYS O 1 1 9 3520 1 1 5 LEU C C -3.139 13.135 2.442 1.00 . A X . 5 LEU C 1 1 9 3521 1 1 5 LEU CA C -4.152 14.228 2.760 1.00 . A X . 5 LEU CA 1 1 9 3522 1 1 5 LEU CB C -3.482 15.607 2.721 1.00 . A X . 5 LEU CB 1 1 9 3523 1 1 5 LEU CD1 C -4.006 16.071 0.309 1.00 . A X . 5 LEU CD1 1 1 9 3524 1 1 5 LEU CD2 C -2.195 17.358 1.464 1.00 . A X . 5 LEU CD2 1 1 9 3525 1 1 5 LEU CG C -2.907 16.016 1.360 1.00 . A X . 5 LEU CG 1 1 9 3526 1 1 5 LEU H H -4.216 13.492 4.737 1.00 . A X . 5 LEU H 1 1 9 3527 1 1 5 LEU HA H -4.945 14.195 2.027 1.00 . A X . 5 LEU HA 1 1 9 3528 1 1 5 LEU HB2 H -4.211 16.348 3.016 1.00 . A X . 5 LEU HB2 1 1 9 3529 1 1 5 LEU HB3 H -2.677 15.613 3.440 1.00 . A X . 5 LEU HB3 1 1 9 3530 1 1 5 LEU HD11 H -4.483 15.104 0.237 1.00 . A X . 5 LEU HD11 1 1 9 3531 1 1 5 LEU HD12 H -3.577 16.332 -0.647 1.00 . A X . 5 LEU HD12 1 1 9 3532 1 1 5 LEU HD13 H -4.736 16.816 0.589 1.00 . A X . 5 LEU HD13 1 1 9 3533 1 1 5 LEU HD21 H -1.386 17.282 2.176 1.00 . A X . 5 LEU HD21 1 1 9 3534 1 1 5 LEU HD22 H -2.894 18.112 1.793 1.00 . A X . 5 LEU HD22 1 1 9 3535 1 1 5 LEU HD23 H -1.802 17.631 0.496 1.00 . A X . 5 LEU HD23 1 1 9 3536 1 1 5 LEU HG H -2.183 15.276 1.047 1.00 . A X . 5 LEU HG 1 1 9 3537 1 1 5 LEU N N -4.741 13.980 4.068 1.00 . A X . 5 LEU N 1 1 9 3538 1 1 5 LEU O O -1.950 13.269 2.735 1.00 . A X . 5 LEU O 1 1 9 3539 1 1 6 ALA C C -2.249 10.979 0.130 1.00 . A X . 6 ALA C 1 1 9 3540 1 1 6 ALA CA C -2.777 10.903 1.557 1.00 . A X . 6 ALA CA 1 1 9 3541 1 1 6 ALA CB C -3.543 9.606 1.768 1.00 . A X . 6 ALA CB 1 1 9 3542 1 1 6 ALA H H -4.578 12.015 1.621 1.00 . A X . 6 ALA H 1 1 9 3543 1 1 6 ALA HA H -1.941 10.915 2.241 1.00 . A X . 6 ALA HA 1 1 9 3544 1 1 6 ALA HB1 H -2.904 8.769 1.538 1.00 . A X . 6 ALA HB1 1 1 9 3545 1 1 6 ALA HB2 H -4.406 9.590 1.118 1.00 . A X . 6 ALA HB2 1 1 9 3546 1 1 6 ALA HB3 H -3.865 9.541 2.796 1.00 . A X . 6 ALA HB3 1 1 9 3547 1 1 6 ALA N N -3.622 12.046 1.863 1.00 . A X . 6 ALA N 1 1 9 3548 1 1 6 ALA O O -1.272 10.325 -0.218 1.00 . A X . 6 ALA O 1 1 9 3549 1 1 7 LEU C C -1.352 12.956 -2.219 1.00 . A X . 7 LEU C 1 1 9 3550 1 1 7 LEU CA C -2.487 11.947 -2.087 1.00 . A X . 7 LEU CA 1 1 9 3551 1 1 7 LEU CB C -3.680 12.397 -2.934 1.00 . A X . 7 LEU CB 1 1 9 3552 1 1 7 LEU CD1 C -6.023 12.051 -3.741 1.00 . A X . 7 LEU CD1 1 1 9 3553 1 1 7 LEU CD2 C -4.512 10.082 -3.425 1.00 . A X . 7 LEU CD2 1 1 9 3554 1 1 7 LEU CG C -4.890 11.464 -2.913 1.00 . A X . 7 LEU CG 1 1 9 3555 1 1 7 LEU H H -3.648 12.315 -0.355 1.00 . A X . 7 LEU H 1 1 9 3556 1 1 7 LEU HA H -2.145 10.986 -2.441 1.00 . A X . 7 LEU HA 1 1 9 3557 1 1 7 LEU HB2 H -3.995 13.368 -2.582 1.00 . A X . 7 LEU HB2 1 1 9 3558 1 1 7 LEU HB3 H -3.347 12.496 -3.957 1.00 . A X . 7 LEU HB3 1 1 9 3559 1 1 7 LEU HD11 H -6.312 13.006 -3.325 1.00 . A X . 7 LEU HD11 1 1 9 3560 1 1 7 LEU HD12 H -6.868 11.380 -3.723 1.00 . A X . 7 LEU HD12 1 1 9 3561 1 1 7 LEU HD13 H -5.692 12.187 -4.760 1.00 . A X . 7 LEU HD13 1 1 9 3562 1 1 7 LEU HD21 H -5.368 9.428 -3.358 1.00 . A X . 7 LEU HD21 1 1 9 3563 1 1 7 LEU HD22 H -3.707 9.683 -2.826 1.00 . A X . 7 LEU HD22 1 1 9 3564 1 1 7 LEU HD23 H -4.192 10.154 -4.456 1.00 . A X . 7 LEU HD23 1 1 9 3565 1 1 7 LEU HG H -5.238 11.361 -1.896 1.00 . A X . 7 LEU HG 1 1 9 3566 1 1 7 LEU N N -2.887 11.799 -0.691 1.00 . A X . 7 LEU N 1 1 9 3567 1 1 7 LEU O O -1.414 13.868 -3.046 1.00 . A X . 7 LEU O 1 1 9 3568 1 1 8 ALA C C 1.971 13.176 -0.547 1.00 . A X . 8 ALA C 1 1 9 3569 1 1 8 ALA CA C 0.813 13.714 -1.383 1.00 . A X . 8 ALA CA 1 1 9 3570 1 1 8 ALA CB C 0.374 15.070 -0.840 1.00 . A X . 8 ALA CB 1 1 9 3571 1 1 8 ALA H H -0.300 12.004 -0.810 1.00 . A X . 8 ALA H 1 1 9 3572 1 1 8 ALA HA H 1.148 13.853 -2.401 1.00 . A X . 8 ALA HA 1 1 9 3573 1 1 8 ALA HB1 H -0.429 15.457 -1.449 1.00 . A X . 8 ALA HB1 1 1 9 3574 1 1 8 ALA HB2 H 1.208 15.755 -0.868 1.00 . A X . 8 ALA HB2 1 1 9 3575 1 1 8 ALA HB3 H 0.035 14.958 0.178 1.00 . A X . 8 ALA HB3 1 1 9 3576 1 1 8 ALA N N -0.314 12.784 -1.403 1.00 . A X . 8 ALA N 1 1 9 3577 1 1 8 ALA O O 3.111 13.131 -1.004 1.00 . A X . 8 ALA O 1 1 9 3578 1 1 9 LYS C C 3.539 11.168 1.160 1.00 . A X . 9 LYS C 1 1 9 3579 1 1 9 LYS CA C 2.688 12.353 1.646 1.00 . A X . 9 LYS CA 1 1 9 3580 1 1 9 LYS CB C 2.045 12.058 3.004 1.00 . A X . 9 LYS CB 1 1 9 3581 1 1 9 LYS CD C 0.707 12.967 4.940 1.00 . A X . 9 LYS CD 1 1 9 3582 1 1 9 LYS CE C 0.035 14.205 5.516 1.00 . A X . 9 LYS CE 1 1 9 3583 1 1 9 LYS CG C 1.361 13.274 3.605 1.00 . A X . 9 LYS CG 1 1 9 3584 1 1 9 LYS H H 0.722 12.724 0.942 1.00 . A X . 9 LYS H 1 1 9 3585 1 1 9 LYS HA H 3.350 13.199 1.768 1.00 . A X . 9 LYS HA 1 1 9 3586 1 1 9 LYS HB2 H 1.308 11.277 2.882 1.00 . A X . 9 LYS HB2 1 1 9 3587 1 1 9 LYS HB3 H 2.808 11.720 3.690 1.00 . A X . 9 LYS HB3 1 1 9 3588 1 1 9 LYS HD2 H -0.036 12.199 4.798 1.00 . A X . 9 LYS HD2 1 1 9 3589 1 1 9 LYS HD3 H 1.462 12.623 5.632 1.00 . A X . 9 LYS HD3 1 1 9 3590 1 1 9 LYS HE2 H -0.693 14.566 4.805 1.00 . A X . 9 LYS HE2 1 1 9 3591 1 1 9 LYS HE3 H -0.464 13.934 6.435 1.00 . A X . 9 LYS HE3 1 1 9 3592 1 1 9 LYS HG2 H 2.098 14.051 3.750 1.00 . A X . 9 LYS HG2 1 1 9 3593 1 1 9 LYS HG3 H 0.606 13.622 2.916 1.00 . A X . 9 LYS HG3 1 1 9 3594 1 1 9 LYS HZ1 H 1.614 15.465 4.958 1.00 . A X . 9 LYS HZ1 1 1 9 3595 1 1 9 LYS HZ2 H 1.623 15.021 6.598 1.00 . A X . 9 LYS HZ2 1 1 9 3596 1 1 9 LYS HZ3 H 0.517 16.174 6.040 1.00 . A X . 9 LYS HZ3 1 1 9 3597 1 1 9 LYS N N 1.663 12.756 0.677 1.00 . A X . 9 LYS N 1 1 9 3598 1 1 9 LYS NZ N 1.014 15.288 5.796 1.00 . A X . 9 LYS NZ 1 1 9 3599 1 1 9 LYS O O 4.764 11.261 1.167 1.00 . A X . 9 LYS O 1 1 9 3600 1 1 10 PRO C C 4.145 9.177 -1.271 1.00 . A X . 10 PRO C 1 1 9 3601 1 1 10 PRO CA C 3.700 8.920 0.169 1.00 . A X . 10 PRO CA 1 1 9 3602 1 1 10 PRO CB C 2.716 7.753 0.222 1.00 . A X . 10 PRO CB 1 1 9 3603 1 1 10 PRO CD C 1.488 9.735 0.777 1.00 . A X . 10 PRO CD 1 1 9 3604 1 1 10 PRO CG C 1.376 8.389 0.108 1.00 . A X . 10 PRO CG 1 1 9 3605 1 1 10 PRO HA H 4.565 8.694 0.776 1.00 . A X . 10 PRO HA 1 1 9 3606 1 1 10 PRO HB2 H 2.908 7.079 -0.600 1.00 . A X . 10 PRO HB2 1 1 9 3607 1 1 10 PRO HB3 H 2.826 7.229 1.160 1.00 . A X . 10 PRO HB3 1 1 9 3608 1 1 10 PRO HD2 H 0.922 10.478 0.232 1.00 . A X . 10 PRO HD2 1 1 9 3609 1 1 10 PRO HD3 H 1.147 9.676 1.799 1.00 . A X . 10 PRO HD3 1 1 9 3610 1 1 10 PRO HG2 H 1.115 8.509 -0.933 1.00 . A X . 10 PRO HG2 1 1 9 3611 1 1 10 PRO HG3 H 0.639 7.781 0.613 1.00 . A X . 10 PRO HG3 1 1 9 3612 1 1 10 PRO N N 2.932 10.038 0.726 1.00 . A X . 10 PRO N 1 1 9 3613 1 1 10 PRO O O 4.641 8.277 -1.946 1.00 . A X . 10 PRO O 1 1 9 3614 1 1 11 ALA C C 3.578 10.038 -4.129 1.00 . A X . 11 ALA C 1 1 9 3615 1 1 11 ALA CA C 4.327 10.844 -3.072 1.00 . A X . 11 ALA CA 1 1 9 3616 1 1 11 ALA CB C 5.836 10.747 -3.273 1.00 . A X . 11 ALA CB 1 1 9 3617 1 1 11 ALA H H 3.548 11.081 -1.120 1.00 . A X . 11 ALA H 1 1 9 3618 1 1 11 ALA HA H 4.044 11.882 -3.174 1.00 . A X . 11 ALA HA 1 1 9 3619 1 1 11 ALA HB1 H 6.092 11.120 -4.253 1.00 . A X . 11 ALA HB1 1 1 9 3620 1 1 11 ALA HB2 H 6.147 9.717 -3.185 1.00 . A X . 11 ALA HB2 1 1 9 3621 1 1 11 ALA HB3 H 6.336 11.340 -2.521 1.00 . A X . 11 ALA HB3 1 1 9 3622 1 1 11 ALA N N 3.954 10.420 -1.723 1.00 . A X . 11 ALA N 1 1 9 3623 1 1 11 ALA O O 4.143 9.668 -5.160 1.00 . A X . 11 ALA O 1 1 9 3624 1 1 12 LEU C C 1.811 7.529 -4.746 1.00 . A X . 12 LEU C 1 1 9 3625 1 1 12 LEU CA C 1.422 9.005 -4.737 1.00 . A X . 12 LEU CA 1 1 9 3626 1 1 12 LEU CB C 1.415 9.572 -6.164 1.00 . A X . 12 LEU CB 1 1 9 3627 1 1 12 LEU CD1 C 0.918 11.456 -7.734 1.00 . A X . 12 LEU CD1 1 1 9 3628 1 1 12 LEU CD2 C -0.582 11.039 -5.786 1.00 . A X . 12 LEU CD2 1 1 9 3629 1 1 12 LEU CG C 0.849 10.985 -6.293 1.00 . A X . 12 LEU CG 1 1 9 3630 1 1 12 LEU H H 1.925 10.122 -3.013 1.00 . A X . 12 LEU H 1 1 9 3631 1 1 12 LEU HA H 0.419 9.079 -4.336 1.00 . A X . 12 LEU HA 1 1 9 3632 1 1 12 LEU HB2 H 2.431 9.577 -6.530 1.00 . A X . 12 LEU HB2 1 1 9 3633 1 1 12 LEU HB3 H 0.830 8.914 -6.789 1.00 . A X . 12 LEU HB3 1 1 9 3634 1 1 12 LEU HD11 H 0.489 12.444 -7.809 1.00 . A X . 12 LEU HD11 1 1 9 3635 1 1 12 LEU HD12 H 0.365 10.775 -8.362 1.00 . A X . 12 LEU HD12 1 1 9 3636 1 1 12 LEU HD13 H 1.949 11.484 -8.052 1.00 . A X . 12 LEU HD13 1 1 9 3637 1 1 12 LEU HD21 H -1.190 10.345 -6.345 1.00 . A X . 12 LEU HD21 1 1 9 3638 1 1 12 LEU HD22 H -0.969 12.038 -5.912 1.00 . A X . 12 LEU HD22 1 1 9 3639 1 1 12 LEU HD23 H -0.603 10.775 -4.739 1.00 . A X . 12 LEU HD23 1 1 9 3640 1 1 12 LEU HG H 1.443 11.659 -5.693 1.00 . A X . 12 LEU HG 1 1 9 3641 1 1 12 LEU N N 2.296 9.782 -3.852 1.00 . A X . 12 LEU N 1 1 9 3642 1 1 12 LEU O O 2.908 7.159 -4.320 1.00 . A X . 12 LEU O 1 1 9 3643 1 1 13 LEU C C 1.153 4.825 -3.705 1.00 . A X . 13 LEU C 1 1 9 3644 1 1 13 LEU CA C 1.045 5.243 -5.165 1.00 . A X . 13 LEU CA 1 1 9 3645 1 1 13 LEU CB C 2.248 4.726 -5.967 1.00 . A X . 13 LEU CB 1 1 9 3646 1 1 13 LEU CD1 C 2.289 6.204 -8.004 1.00 . A X . 13 LEU CD1 1 1 9 3647 1 1 13 LEU CD2 C 3.086 3.837 -8.157 1.00 . A X . 13 LEU CD2 1 1 9 3648 1 1 13 LEU CG C 2.101 4.786 -7.492 1.00 . A X . 13 LEU CG 1 1 9 3649 1 1 13 LEU H H 0.103 7.066 -5.686 1.00 . A X . 13 LEU H 1 1 9 3650 1 1 13 LEU HA H 0.142 4.810 -5.574 1.00 . A X . 13 LEU HA 1 1 9 3651 1 1 13 LEU HB2 H 3.111 5.312 -5.689 1.00 . A X . 13 LEU HB2 1 1 9 3652 1 1 13 LEU HB3 H 2.425 3.700 -5.685 1.00 . A X . 13 LEU HB3 1 1 9 3653 1 1 13 LEU HD11 H 1.552 6.851 -7.551 1.00 . A X . 13 LEU HD11 1 1 9 3654 1 1 13 LEU HD12 H 2.168 6.219 -9.077 1.00 . A X . 13 LEU HD12 1 1 9 3655 1 1 13 LEU HD13 H 3.279 6.551 -7.747 1.00 . A X . 13 LEU HD13 1 1 9 3656 1 1 13 LEU HD21 H 2.954 3.875 -9.229 1.00 . A X . 13 LEU HD21 1 1 9 3657 1 1 13 LEU HD22 H 2.909 2.832 -7.809 1.00 . A X . 13 LEU HD22 1 1 9 3658 1 1 13 LEU HD23 H 4.094 4.133 -7.909 1.00 . A X . 13 LEU HD23 1 1 9 3659 1 1 13 LEU HG H 1.101 4.468 -7.758 1.00 . A X . 13 LEU HG 1 1 9 3660 1 1 13 LEU N N 0.903 6.694 -5.246 1.00 . A X . 13 LEU N 1 1 9 3661 1 1 13 LEU O O 2.218 4.442 -3.223 1.00 . A X . 13 LEU O 1 1 9 3662 1 1 14 TRP C C -0.360 3.242 -1.268 1.00 . A X . 14 TRP C 1 1 9 3663 1 1 14 TRP CA C -0.034 4.691 -1.581 1.00 . A X . 14 TRP CA 1 1 9 3664 1 1 14 TRP CB C -1.070 5.633 -0.953 1.00 . A X . 14 TRP CB 1 1 9 3665 1 1 14 TRP CD1 C -2.558 6.784 -2.697 1.00 . A X . 14 TRP CD1 1 1 9 3666 1 1 14 TRP CD2 C -3.486 4.968 -1.768 1.00 . A X . 14 TRP CD2 1 1 9 3667 1 1 14 TRP CE2 C -4.386 5.502 -2.707 1.00 . A X . 14 TRP CE2 1 1 9 3668 1 1 14 TRP CE3 C -3.850 3.818 -1.062 1.00 . A X . 14 TRP CE3 1 1 9 3669 1 1 14 TRP CG C -2.315 5.799 -1.781 1.00 . A X . 14 TRP CG 1 1 9 3670 1 1 14 TRP CH2 C -5.965 3.807 -2.245 1.00 . A X . 14 TRP CH2 1 1 9 3671 1 1 14 TRP CZ2 C -5.634 4.931 -2.952 1.00 . A X . 14 TRP CZ2 1 1 9 3672 1 1 14 TRP CZ3 C -5.090 3.254 -1.305 1.00 . A X . 14 TRP CZ3 1 1 9 3673 1 1 14 TRP H H -0.809 5.089 -3.496 1.00 . A X . 14 TRP H 1 1 9 3674 1 1 14 TRP HA H 0.940 4.918 -1.175 1.00 . A X . 14 TRP HA 1 1 9 3675 1 1 14 TRP HB2 H -1.362 5.243 0.010 1.00 . A X . 14 TRP HB2 1 1 9 3676 1 1 14 TRP HB3 H -0.626 6.608 -0.819 1.00 . A X . 14 TRP HB3 1 1 9 3677 1 1 14 TRP HD1 H -1.863 7.578 -2.935 1.00 . A X . 14 TRP HD1 1 1 9 3678 1 1 14 TRP HE1 H -4.197 7.190 -3.952 1.00 . A X . 14 TRP HE1 1 1 9 3679 1 1 14 TRP HE3 H -3.190 3.375 -0.332 1.00 . A X . 14 TRP HE3 1 1 9 3680 1 1 14 TRP HH2 H -6.920 3.330 -2.403 1.00 . A X . 14 TRP HH2 1 1 9 3681 1 1 14 TRP HZ2 H -6.322 5.344 -3.674 1.00 . A X . 14 TRP HZ2 1 1 9 3682 1 1 14 TRP HZ3 H -5.389 2.366 -0.769 1.00 . A X . 14 TRP HZ3 1 1 9 3683 1 1 14 TRP N N 0.024 4.905 -3.017 1.00 . A X . 14 TRP N 1 1 9 3684 1 1 14 TRP NE1 N -3.799 6.611 -3.260 1.00 . A X . 14 TRP NE1 1 1 9 3685 1 1 14 TRP O O -0.473 2.850 -0.105 1.00 . A X . 14 TRP O 1 1 9 3686 1 1 15 LYS C C 0.554 0.286 -2.507 1.00 . A X . 15 LYS C 1 1 9 3687 1 1 15 LYS CA C -0.725 1.028 -2.149 1.00 . A X . 15 LYS CA 1 1 9 3688 1 1 15 LYS CB C -1.881 0.529 -3.011 1.00 . A X . 15 LYS CB 1 1 9 3689 1 1 15 LYS CD C -3.103 -1.499 -3.860 1.00 . A X . 15 LYS CD 1 1 9 3690 1 1 15 LYS CE C -3.235 -3.004 -3.728 1.00 . A X . 15 LYS CE 1 1 9 3691 1 1 15 LYS CG C -2.191 -0.937 -2.786 1.00 . A X . 15 LYS CG 1 1 9 3692 1 1 15 LYS H H -0.506 2.835 -3.217 1.00 . A X . 15 LYS H 1 1 9 3693 1 1 15 LYS HA H -0.954 0.851 -1.112 1.00 . A X . 15 LYS HA 1 1 9 3694 1 1 15 LYS HB2 H -2.766 1.105 -2.779 1.00 . A X . 15 LYS HB2 1 1 9 3695 1 1 15 LYS HB3 H -1.632 0.669 -4.053 1.00 . A X . 15 LYS HB3 1 1 9 3696 1 1 15 LYS HD2 H -4.082 -1.052 -3.762 1.00 . A X . 15 LYS HD2 1 1 9 3697 1 1 15 LYS HD3 H -2.693 -1.264 -4.832 1.00 . A X . 15 LYS HD3 1 1 9 3698 1 1 15 LYS HE2 H -3.800 -3.226 -2.836 1.00 . A X . 15 LYS HE2 1 1 9 3699 1 1 15 LYS HE3 H -3.762 -3.385 -4.591 1.00 . A X . 15 LYS HE3 1 1 9 3700 1 1 15 LYS HG2 H -1.265 -1.493 -2.788 1.00 . A X . 15 LYS HG2 1 1 9 3701 1 1 15 LYS HG3 H -2.672 -1.048 -1.825 1.00 . A X . 15 LYS HG3 1 1 9 3702 1 1 15 LYS HZ1 H -1.999 -4.687 -3.824 1.00 . A X . 15 LYS HZ1 1 1 9 3703 1 1 15 LYS HZ2 H -1.505 -3.535 -2.684 1.00 . A X . 15 LYS HZ2 1 1 9 3704 1 1 15 LYS HZ3 H -1.251 -3.256 -4.336 1.00 . A X . 15 LYS HZ3 1 1 9 3705 1 1 15 LYS N N -0.524 2.451 -2.313 1.00 . A X . 15 LYS N 1 1 9 3706 1 1 15 LYS NZ N -1.907 -3.666 -3.638 1.00 . A X . 15 LYS NZ 1 1 9 3707 1 1 15 LYS O O 0.948 -0.666 -1.833 1.00 . A X . 15 LYS O 1 1 9 3708 1 1 16 ALA C C 3.633 0.710 -3.221 1.00 . A X . 16 ALA C 1 1 9 3709 1 1 16 ALA CA C 2.458 0.153 -4.018 1.00 . A X . 16 ALA CA 1 1 9 3710 1 1 16 ALA CB C 2.655 0.414 -5.501 1.00 . A X . 16 ALA CB 1 1 9 3711 1 1 16 ALA H H 0.827 1.494 -4.071 1.00 . A X . 16 ALA H 1 1 9 3712 1 1 16 ALA HA H 2.401 -0.917 -3.867 1.00 . A X . 16 ALA HA 1 1 9 3713 1 1 16 ALA HB1 H 3.570 -0.058 -5.832 1.00 . A X . 16 ALA HB1 1 1 9 3714 1 1 16 ALA HB2 H 2.717 1.477 -5.673 1.00 . A X . 16 ALA HB2 1 1 9 3715 1 1 16 ALA HB3 H 1.820 0.008 -6.052 1.00 . A X . 16 ALA HB3 1 1 9 3716 1 1 16 ALA N N 1.205 0.740 -3.569 1.00 . A X . 16 ALA N 1 1 9 3717 1 1 16 ALA O O 4.482 1.425 -3.758 1.00 . A X . 16 ALA O 1 1 9 3718 1 1 17 LEU C C 5.699 -0.318 -0.766 1.00 . A X . 17 LEU C 1 1 9 3719 1 1 17 LEU CA C 4.734 0.828 -1.055 1.00 . A X . 17 LEU CA 1 1 9 3720 1 1 17 LEU CB C 4.153 1.350 0.265 1.00 . A X . 17 LEU CB 1 1 9 3721 1 1 17 LEU CD1 C 2.569 2.847 1.501 1.00 . A X . 17 LEU CD1 1 1 9 3722 1 1 17 LEU CD2 C 3.909 3.753 -0.402 1.00 . A X . 17 LEU CD2 1 1 9 3723 1 1 17 LEU CG C 3.188 2.534 0.147 1.00 . A X . 17 LEU CG 1 1 9 3724 1 1 17 LEU H H 2.942 -0.166 -1.569 1.00 . A X . 17 LEU H 1 1 9 3725 1 1 17 LEU HA H 5.272 1.626 -1.548 1.00 . A X . 17 LEU HA 1 1 9 3726 1 1 17 LEU HB2 H 3.628 0.538 0.746 1.00 . A X . 17 LEU HB2 1 1 9 3727 1 1 17 LEU HB3 H 4.973 1.650 0.901 1.00 . A X . 17 LEU HB3 1 1 9 3728 1 1 17 LEU HD11 H 1.999 1.996 1.843 1.00 . A X . 17 LEU HD11 1 1 9 3729 1 1 17 LEU HD12 H 1.917 3.704 1.409 1.00 . A X . 17 LEU HD12 1 1 9 3730 1 1 17 LEU HD13 H 3.352 3.064 2.213 1.00 . A X . 17 LEU HD13 1 1 9 3731 1 1 17 LEU HD21 H 3.215 4.577 -0.488 1.00 . A X . 17 LEU HD21 1 1 9 3732 1 1 17 LEU HD22 H 4.313 3.522 -1.375 1.00 . A X . 17 LEU HD22 1 1 9 3733 1 1 17 LEU HD23 H 4.712 4.028 0.266 1.00 . A X . 17 LEU HD23 1 1 9 3734 1 1 17 LEU HG H 2.389 2.278 -0.534 1.00 . A X . 17 LEU HG 1 1 9 3735 1 1 17 LEU N N 3.667 0.385 -1.938 1.00 . A X . 17 LEU N 1 1 9 3736 1 1 17 LEU O O 6.442 -0.274 0.214 1.00 . A X . 17 LEU O 1 1 9 3737 1 1 18 ALA C C 7.973 -2.186 -1.195 1.00 . A X . 18 ALA C 1 1 9 3738 1 1 18 ALA CA C 6.504 -2.530 -1.439 1.00 . A X . 18 ALA CA 1 1 9 3739 1 1 18 ALA CB C 6.373 -3.446 -2.642 1.00 . A X . 18 ALA CB 1 1 9 3740 1 1 18 ALA H H 5.106 -1.274 -2.416 1.00 . A X . 18 ALA H 1 1 9 3741 1 1 18 ALA HA H 6.122 -3.056 -0.577 1.00 . A X . 18 ALA HA 1 1 9 3742 1 1 18 ALA HB1 H 6.946 -4.345 -2.475 1.00 . A X . 18 ALA HB1 1 1 9 3743 1 1 18 ALA HB2 H 6.745 -2.941 -3.521 1.00 . A X . 18 ALA HB2 1 1 9 3744 1 1 18 ALA HB3 H 5.335 -3.703 -2.787 1.00 . A X . 18 ALA HB3 1 1 9 3745 1 1 18 ALA N N 5.686 -1.332 -1.629 1.00 . A X . 18 ALA N 1 1 9 3746 1 1 18 ALA O O 8.574 -2.639 -0.222 1.00 . A X . 18 ALA O 1 1 9 3747 1 1 19 LEU C C 9.963 0.573 -1.805 1.00 . A X . 19 LEU C 1 1 9 3748 1 1 19 LEU CA C 9.916 -0.940 -1.937 1.00 . A X . 19 LEU CA 1 1 9 3749 1 1 19 LEU CB C 10.764 -1.394 -3.126 1.00 . A X . 19 LEU CB 1 1 9 3750 1 1 19 LEU CD1 C 11.786 -3.246 -4.468 1.00 . A X . 19 LEU CD1 1 1 9 3751 1 1 19 LEU CD2 C 11.620 -3.461 -1.986 1.00 . A X . 19 LEU CD2 1 1 9 3752 1 1 19 LEU CG C 10.958 -2.908 -3.241 1.00 . A X . 19 LEU CG 1 1 9 3753 1 1 19 LEU H H 8.015 -1.078 -2.858 1.00 . A X . 19 LEU H 1 1 9 3754 1 1 19 LEU HA H 10.311 -1.381 -1.033 1.00 . A X . 19 LEU HA 1 1 9 3755 1 1 19 LEU HB2 H 10.290 -1.043 -4.032 1.00 . A X . 19 LEU HB2 1 1 9 3756 1 1 19 LEU HB3 H 11.737 -0.934 -3.047 1.00 . A X . 19 LEU HB3 1 1 9 3757 1 1 19 LEU HD11 H 12.756 -2.777 -4.388 1.00 . A X . 19 LEU HD11 1 1 9 3758 1 1 19 LEU HD12 H 11.284 -2.885 -5.352 1.00 . A X . 19 LEU HD12 1 1 9 3759 1 1 19 LEU HD13 H 11.909 -4.317 -4.535 1.00 . A X . 19 LEU HD13 1 1 9 3760 1 1 19 LEU HD21 H 11.705 -4.534 -2.068 1.00 . A X . 19 LEU HD21 1 1 9 3761 1 1 19 LEU HD22 H 11.021 -3.211 -1.122 1.00 . A X . 19 LEU HD22 1 1 9 3762 1 1 19 LEU HD23 H 12.604 -3.030 -1.879 1.00 . A X . 19 LEU HD23 1 1 9 3763 1 1 19 LEU HG H 9.993 -3.381 -3.349 1.00 . A X . 19 LEU HG 1 1 9 3764 1 1 19 LEU N N 8.540 -1.385 -2.082 1.00 . A X . 19 LEU N 1 1 9 3765 1 1 19 LEU O O 11.027 1.189 -1.890 1.00 . A X . 19 LEU O 1 1 9 3766 1 1 20 LYS C C 8.691 2.867 0.125 1.00 . A X . 20 LYS C 1 1 9 3767 1 1 20 LYS CA C 8.701 2.601 -1.375 1.00 . A X . 20 LYS CA 1 1 9 3768 1 1 20 LYS CB C 7.446 3.184 -2.033 1.00 . A X . 20 LYS CB 1 1 9 3769 1 1 20 LYS CD C 6.188 5.260 -2.730 1.00 . A X . 20 LYS CD 1 1 9 3770 1 1 20 LYS CE C 6.282 4.896 -4.202 1.00 . A X . 20 LYS CE 1 1 9 3771 1 1 20 LYS CG C 7.362 4.702 -1.940 1.00 . A X . 20 LYS CG 1 1 9 3772 1 1 20 LYS H H 7.973 0.634 -1.652 1.00 . A X . 20 LYS H 1 1 9 3773 1 1 20 LYS HA H 9.577 3.066 -1.805 1.00 . A X . 20 LYS HA 1 1 9 3774 1 1 20 LYS HB2 H 7.438 2.906 -3.077 1.00 . A X . 20 LYS HB2 1 1 9 3775 1 1 20 LYS HB3 H 6.574 2.767 -1.550 1.00 . A X . 20 LYS HB3 1 1 9 3776 1 1 20 LYS HD2 H 5.271 4.855 -2.327 1.00 . A X . 20 LYS HD2 1 1 9 3777 1 1 20 LYS HD3 H 6.182 6.336 -2.635 1.00 . A X . 20 LYS HD3 1 1 9 3778 1 1 20 LYS HE2 H 7.269 5.144 -4.558 1.00 . A X . 20 LYS HE2 1 1 9 3779 1 1 20 LYS HE3 H 6.119 3.832 -4.306 1.00 . A X . 20 LYS HE3 1 1 9 3780 1 1 20 LYS HG2 H 7.250 4.982 -0.904 1.00 . A X . 20 LYS HG2 1 1 9 3781 1 1 20 LYS HG3 H 8.279 5.125 -2.329 1.00 . A X . 20 LYS HG3 1 1 9 3782 1 1 20 LYS HZ1 H 5.482 6.644 -5.011 1.00 . A X . 20 LYS HZ1 1 1 9 3783 1 1 20 LYS HZ2 H 4.320 5.468 -4.638 1.00 . A X . 20 LYS HZ2 1 1 9 3784 1 1 20 LYS HZ3 H 5.310 5.281 -6.006 1.00 . A X . 20 LYS HZ3 1 1 9 3785 1 1 20 LYS N N 8.794 1.170 -1.615 1.00 . A X . 20 LYS N 1 1 9 3786 1 1 20 LYS NZ N 5.277 5.621 -5.020 1.00 . A X . 20 LYS NZ 1 1 9 3787 1 1 20 LYS O O 9.176 3.897 0.592 1.00 . A X . 20 LYS O 1 1 9 3788 1 1 21 LEU C C 9.428 1.356 2.847 1.00 . A X . 21 LEU C 1 1 9 3789 1 1 21 LEU CA C 8.155 2.005 2.327 1.00 . A X . 21 LEU CA 1 1 9 3790 1 1 21 LEU CB C 6.921 1.324 2.927 1.00 . A X . 21 LEU CB 1 1 9 3791 1 1 21 LEU CD1 C 6.714 2.835 4.919 1.00 . A X . 21 LEU CD1 1 1 9 3792 1 1 21 LEU CD2 C 5.610 0.594 4.930 1.00 . A X . 21 LEU CD2 1 1 9 3793 1 1 21 LEU CG C 6.810 1.391 4.451 1.00 . A X . 21 LEU CG 1 1 9 3794 1 1 21 LEU H H 7.692 1.165 0.442 1.00 . A X . 21 LEU H 1 1 9 3795 1 1 21 LEU HA H 8.155 3.049 2.604 1.00 . A X . 21 LEU HA 1 1 9 3796 1 1 21 LEU HB2 H 6.042 1.785 2.502 1.00 . A X . 21 LEU HB2 1 1 9 3797 1 1 21 LEU HB3 H 6.935 0.283 2.635 1.00 . A X . 21 LEU HB3 1 1 9 3798 1 1 21 LEU HD11 H 6.638 2.859 5.997 1.00 . A X . 21 LEU HD11 1 1 9 3799 1 1 21 LEU HD12 H 5.837 3.295 4.486 1.00 . A X . 21 LEU HD12 1 1 9 3800 1 1 21 LEU HD13 H 7.596 3.375 4.609 1.00 . A X . 21 LEU HD13 1 1 9 3801 1 1 21 LEU HD21 H 5.710 -0.434 4.613 1.00 . A X . 21 LEU HD21 1 1 9 3802 1 1 21 LEU HD22 H 4.709 1.013 4.510 1.00 . A X . 21 LEU HD22 1 1 9 3803 1 1 21 LEU HD23 H 5.560 0.635 6.009 1.00 . A X . 21 LEU HD23 1 1 9 3804 1 1 21 LEU HG H 7.698 0.958 4.890 1.00 . A X . 21 LEU HG 1 1 9 3805 1 1 21 LEU N N 8.132 1.929 0.876 1.00 . A X . 21 LEU N 1 1 9 3806 1 1 21 LEU O O 9.980 1.767 3.867 1.00 . A X . 21 LEU O 1 1 9 3807 1 1 22 LYS C C 12.299 0.410 1.813 1.00 . A X . 22 LYS C 1 1 9 3808 1 1 22 LYS CA C 11.140 -0.318 2.479 1.00 . A X . 22 LYS CA 1 1 9 3809 1 1 22 LYS CB C 11.118 -1.791 2.067 1.00 . A X . 22 LYS CB 1 1 9 3810 1 1 22 LYS CD C 12.238 -4.036 2.268 1.00 . A X . 22 LYS CD 1 1 9 3811 1 1 22 LYS CE C 13.495 -4.767 2.705 1.00 . A X . 22 LYS CE 1 1 9 3812 1 1 22 LYS CG C 12.386 -2.537 2.449 1.00 . A X . 22 LYS CG 1 1 9 3813 1 1 22 LYS H H 9.383 0.021 1.360 1.00 . A X . 22 LYS H 1 1 9 3814 1 1 22 LYS HA H 11.260 -0.255 3.550 1.00 . A X . 22 LYS HA 1 1 9 3815 1 1 22 LYS HB2 H 10.279 -2.275 2.548 1.00 . A X . 22 LYS HB2 1 1 9 3816 1 1 22 LYS HB3 H 10.996 -1.855 0.996 1.00 . A X . 22 LYS HB3 1 1 9 3817 1 1 22 LYS HD2 H 11.406 -4.382 2.862 1.00 . A X . 22 LYS HD2 1 1 9 3818 1 1 22 LYS HD3 H 12.053 -4.247 1.223 1.00 . A X . 22 LYS HD3 1 1 9 3819 1 1 22 LYS HE2 H 14.283 -4.561 1.996 1.00 . A X . 22 LYS HE2 1 1 9 3820 1 1 22 LYS HE3 H 13.788 -4.403 3.680 1.00 . A X . 22 LYS HE3 1 1 9 3821 1 1 22 LYS HG2 H 13.197 -2.187 1.827 1.00 . A X . 22 LYS HG2 1 1 9 3822 1 1 22 LYS HG3 H 12.612 -2.331 3.486 1.00 . A X . 22 LYS HG3 1 1 9 3823 1 1 22 LYS HZ1 H 12.575 -6.460 3.512 1.00 . A X . 22 LYS HZ1 1 1 9 3824 1 1 22 LYS HZ2 H 14.182 -6.713 3.031 1.00 . A X . 22 LYS HZ2 1 1 9 3825 1 1 22 LYS HZ3 H 12.956 -6.604 1.866 1.00 . A X . 22 LYS HZ3 1 1 9 3826 1 1 22 LYS N N 9.891 0.337 2.136 1.00 . A X . 22 LYS N 1 1 9 3827 1 1 22 LYS NZ N 13.287 -6.237 2.783 1.00 . A X . 22 LYS NZ 1 1 9 3828 1 1 22 LYS O O 12.533 0.266 0.611 1.00 . A X . 22 LYS O 1 1 9 3829 1 1 23 LYS C C 14.901 2.558 3.274 1.00 . A X . 23 LYS C 1 1 9 3830 1 1 23 LYS CA C 14.089 2.032 2.102 1.00 . A X . 23 LYS CA 1 1 9 3831 1 1 23 LYS CB C 13.537 3.206 1.281 1.00 . A X . 23 LYS CB 1 1 9 3832 1 1 23 LYS CD C 12.116 5.283 1.240 1.00 . A X . 23 LYS CD 1 1 9 3833 1 1 23 LYS CE C 11.095 6.122 1.998 1.00 . A X . 23 LYS CE 1 1 9 3834 1 1 23 LYS CG C 12.574 4.092 2.060 1.00 . A X . 23 LYS CG 1 1 9 3835 1 1 23 LYS H H 12.813 1.211 3.561 1.00 . A X . 23 LYS H 1 1 9 3836 1 1 23 LYS HA H 14.723 1.422 1.477 1.00 . A X . 23 LYS HA 1 1 9 3837 1 1 23 LYS HB2 H 14.364 3.814 0.945 1.00 . A X . 23 LYS HB2 1 1 9 3838 1 1 23 LYS HB3 H 13.016 2.815 0.420 1.00 . A X . 23 LYS HB3 1 1 9 3839 1 1 23 LYS HD2 H 12.970 5.898 1.006 1.00 . A X . 23 LYS HD2 1 1 9 3840 1 1 23 LYS HD3 H 11.666 4.924 0.325 1.00 . A X . 23 LYS HD3 1 1 9 3841 1 1 23 LYS HE2 H 10.225 5.516 2.197 1.00 . A X . 23 LYS HE2 1 1 9 3842 1 1 23 LYS HE3 H 11.531 6.442 2.933 1.00 . A X . 23 LYS HE3 1 1 9 3843 1 1 23 LYS HG2 H 11.709 3.509 2.338 1.00 . A X . 23 LYS HG2 1 1 9 3844 1 1 23 LYS HG3 H 13.072 4.449 2.948 1.00 . A X . 23 LYS HG3 1 1 9 3845 1 1 23 LYS HZ1 H 11.493 7.961 1.087 1.00 . A X . 23 LYS HZ1 1 1 9 3846 1 1 23 LYS HZ2 H 9.924 7.833 1.727 1.00 . A X . 23 LYS HZ2 1 1 9 3847 1 1 23 LYS HZ3 H 10.320 7.033 0.287 1.00 . A X . 23 LYS HZ3 1 1 9 3848 1 1 23 LYS N N 13.007 1.199 2.600 1.00 . A X . 23 LYS N 1 1 9 3849 1 1 23 LYS NZ N 10.678 7.319 1.224 1.00 . A X . 23 LYS NZ 1 1 9 3850 1 1 23 LYS O O 14.396 2.637 4.397 1.00 . A X . 23 LYS O 1 1 9 3851 1 1 24 ALA C C 17.492 4.822 3.687 1.00 . A X . 24 ALA C 1 1 9 3852 1 1 24 ALA CA C 17.017 3.425 4.055 1.00 . A X . 24 ALA CA 1 1 9 3853 1 1 24 ALA CB C 18.196 2.486 4.268 1.00 . A X . 24 ALA CB 1 1 9 3854 1 1 24 ALA H H 16.488 2.827 2.105 1.00 . A X . 24 ALA H 1 1 9 3855 1 1 24 ALA HA H 16.450 3.475 4.975 1.00 . A X . 24 ALA HA 1 1 9 3856 1 1 24 ALA HB1 H 18.776 2.425 3.359 1.00 . A X . 24 ALA HB1 1 1 9 3857 1 1 24 ALA HB2 H 17.831 1.503 4.529 1.00 . A X . 24 ALA HB2 1 1 9 3858 1 1 24 ALA HB3 H 18.818 2.863 5.068 1.00 . A X . 24 ALA HB3 1 1 9 3859 1 1 24 ALA N N 16.146 2.908 3.018 1.00 . A X . 24 ALA N 1 1 9 3860 1 1 24 ALA O O 18.528 4.939 3.002 1.00 . A X . 24 ALA O 1 1 9 3861 1 1 24 ALA OXT O 16.815 5.798 4.063 1.00 . A X . 24 ALA OXT 1 1 10 3862 1 1 1 LYS C C -2.396 19.408 -0.768 1.00 . A X . 1 LYS C 1 1 10 3863 1 1 1 LYS CA C -2.434 19.267 0.750 1.00 . A X . 1 LYS CA 1 1 10 3864 1 1 1 LYS CB C -1.361 20.150 1.390 1.00 . A X . 1 LYS CB 1 1 10 3865 1 1 1 LYS CD C -0.379 21.153 3.468 1.00 . A X . 1 LYS CD 1 1 10 3866 1 1 1 LYS CE C -0.537 21.367 4.966 1.00 . A X . 1 LYS CE 1 1 10 3867 1 1 1 LYS CG C -1.493 20.288 2.897 1.00 . A X . 1 LYS CG 1 1 10 3868 1 1 1 LYS H1 H -3.064 17.287 0.815 1.00 . A X . 1 LYS H1 1 1 10 3869 1 1 1 LYS H2 H -2.200 17.773 2.192 1.00 . A X . 1 LYS H2 1 1 10 3870 1 1 1 LYS H3 H -1.380 17.470 0.737 1.00 . A X . 1 LYS H3 1 1 10 3871 1 1 1 LYS HA H -3.406 19.590 1.098 1.00 . A X . 1 LYS HA 1 1 10 3872 1 1 1 LYS HB2 H -0.390 19.729 1.174 1.00 . A X . 1 LYS HB2 1 1 10 3873 1 1 1 LYS HB3 H -1.419 21.138 0.955 1.00 . A X . 1 LYS HB3 1 1 10 3874 1 1 1 LYS HD2 H 0.568 20.670 3.283 1.00 . A X . 1 LYS HD2 1 1 10 3875 1 1 1 LYS HD3 H -0.396 22.114 2.972 1.00 . A X . 1 LYS HD3 1 1 10 3876 1 1 1 LYS HE2 H -1.460 21.899 5.143 1.00 . A X . 1 LYS HE2 1 1 10 3877 1 1 1 LYS HE3 H -0.579 20.403 5.451 1.00 . A X . 1 LYS HE3 1 1 10 3878 1 1 1 LYS HG2 H -2.443 20.744 3.126 1.00 . A X . 1 LYS HG2 1 1 10 3879 1 1 1 LYS HG3 H -1.442 19.306 3.348 1.00 . A X . 1 LYS HG3 1 1 10 3880 1 1 1 LYS HZ1 H 0.405 22.366 6.545 1.00 . A X . 1 LYS HZ1 1 1 10 3881 1 1 1 LYS HZ2 H 0.705 23.051 5.022 1.00 . A X . 1 LYS HZ2 1 1 10 3882 1 1 1 LYS HZ3 H 1.480 21.608 5.470 1.00 . A X . 1 LYS HZ3 1 1 10 3883 1 1 1 LYS N N -2.257 17.854 1.152 1.00 . A X . 1 LYS N 1 1 10 3884 1 1 1 LYS NZ N 0.591 22.151 5.540 1.00 . A X . 1 LYS NZ 1 1 10 3885 1 1 1 LYS O O -3.429 19.342 -1.429 1.00 . A X . 1 LYS O 1 1 10 3886 1 1 2 LYS C C -0.971 18.411 -3.458 1.00 . A X . 2 LYS C 1 1 10 3887 1 1 2 LYS CA C -1.035 19.760 -2.753 1.00 . A X . 2 LYS CA 1 1 10 3888 1 1 2 LYS CB C 0.231 20.572 -3.045 1.00 . A X . 2 LYS CB 1 1 10 3889 1 1 2 LYS CD C 1.686 21.698 -4.749 1.00 . A X . 2 LYS CD 1 1 10 3890 1 1 2 LYS CE C 1.791 22.175 -6.187 1.00 . A X . 2 LYS CE 1 1 10 3891 1 1 2 LYS CG C 0.399 20.930 -4.510 1.00 . A X . 2 LYS CG 1 1 10 3892 1 1 2 LYS H H -0.402 19.570 -0.747 1.00 . A X . 2 LYS H 1 1 10 3893 1 1 2 LYS HA H -1.894 20.304 -3.118 1.00 . A X . 2 LYS HA 1 1 10 3894 1 1 2 LYS HB2 H 0.198 21.488 -2.475 1.00 . A X . 2 LYS HB2 1 1 10 3895 1 1 2 LYS HB3 H 1.093 19.998 -2.736 1.00 . A X . 2 LYS HB3 1 1 10 3896 1 1 2 LYS HD2 H 1.712 22.554 -4.090 1.00 . A X . 2 LYS HD2 1 1 10 3897 1 1 2 LYS HD3 H 2.524 21.051 -4.531 1.00 . A X . 2 LYS HD3 1 1 10 3898 1 1 2 LYS HE2 H 2.733 22.688 -6.315 1.00 . A X . 2 LYS HE2 1 1 10 3899 1 1 2 LYS HE3 H 1.759 21.314 -6.838 1.00 . A X . 2 LYS HE3 1 1 10 3900 1 1 2 LYS HG2 H 0.422 20.021 -5.091 1.00 . A X . 2 LYS HG2 1 1 10 3901 1 1 2 LYS HG3 H -0.437 21.538 -4.821 1.00 . A X . 2 LYS HG3 1 1 10 3902 1 1 2 LYS HZ1 H 0.646 23.901 -5.888 1.00 . A X . 2 LYS HZ1 1 1 10 3903 1 1 2 LYS HZ2 H -0.234 22.598 -6.530 1.00 . A X . 2 LYS HZ2 1 1 10 3904 1 1 2 LYS HZ3 H 0.832 23.471 -7.516 1.00 . A X . 2 LYS HZ3 1 1 10 3905 1 1 2 LYS N N -1.198 19.575 -1.319 1.00 . A X . 2 LYS N 1 1 10 3906 1 1 2 LYS NZ N 0.682 23.099 -6.554 1.00 . A X . 2 LYS NZ 1 1 10 3907 1 1 2 LYS O O -1.938 17.980 -4.092 1.00 . A X . 2 LYS O 1 1 10 3908 1 1 3 LEU C C -0.448 15.376 -3.225 1.00 . A X . 3 LEU C 1 1 10 3909 1 1 3 LEU CA C 0.357 16.441 -3.950 1.00 . A X . 3 LEU CA 1 1 10 3910 1 1 3 LEU CB C 1.839 16.054 -3.973 1.00 . A X . 3 LEU CB 1 1 10 3911 1 1 3 LEU CD1 C 4.163 16.450 -4.814 1.00 . A X . 3 LEU CD1 1 1 10 3912 1 1 3 LEU CD2 C 2.210 17.067 -6.240 1.00 . A X . 3 LEU CD2 1 1 10 3913 1 1 3 LEU CG C 2.735 16.963 -4.816 1.00 . A X . 3 LEU CG 1 1 10 3914 1 1 3 LEU H H 0.884 18.121 -2.783 1.00 . A X . 3 LEU H 1 1 10 3915 1 1 3 LEU HA H 0.000 16.512 -4.967 1.00 . A X . 3 LEU HA 1 1 10 3916 1 1 3 LEU HB2 H 2.209 16.066 -2.959 1.00 . A X . 3 LEU HB2 1 1 10 3917 1 1 3 LEU HB3 H 1.923 15.049 -4.359 1.00 . A X . 3 LEU HB3 1 1 10 3918 1 1 3 LEU HD11 H 4.188 15.446 -5.212 1.00 . A X . 3 LEU HD11 1 1 10 3919 1 1 3 LEU HD12 H 4.543 16.446 -3.802 1.00 . A X . 3 LEU HD12 1 1 10 3920 1 1 3 LEU HD13 H 4.778 17.094 -5.426 1.00 . A X . 3 LEU HD13 1 1 10 3921 1 1 3 LEU HD21 H 1.215 17.486 -6.225 1.00 . A X . 3 LEU HD21 1 1 10 3922 1 1 3 LEU HD22 H 2.181 16.086 -6.688 1.00 . A X . 3 LEU HD22 1 1 10 3923 1 1 3 LEU HD23 H 2.862 17.708 -6.817 1.00 . A X . 3 LEU HD23 1 1 10 3924 1 1 3 LEU HG H 2.738 17.952 -4.385 1.00 . A X . 3 LEU HG 1 1 10 3925 1 1 3 LEU N N 0.162 17.738 -3.322 1.00 . A X . 3 LEU N 1 1 10 3926 1 1 3 LEU O O -0.160 15.036 -2.077 1.00 . A X . 3 LEU O 1 1 10 3927 1 1 4 LYS C C -2.487 12.715 -4.355 1.00 . A X . 4 LYS C 1 1 10 3928 1 1 4 LYS CA C -2.328 13.844 -3.344 1.00 . A X . 4 LYS CA 1 1 10 3929 1 1 4 LYS CB C -3.689 14.442 -2.969 1.00 . A X . 4 LYS CB 1 1 10 3930 1 1 4 LYS CD C -5.691 15.794 -3.689 1.00 . A X . 4 LYS CD 1 1 10 3931 1 1 4 LYS CE C -5.414 17.070 -2.905 1.00 . A X . 4 LYS CE 1 1 10 3932 1 1 4 LYS CG C -4.407 15.110 -4.135 1.00 . A X . 4 LYS CG 1 1 10 3933 1 1 4 LYS H H -1.660 15.217 -4.799 1.00 . A X . 4 LYS H 1 1 10 3934 1 1 4 LYS HA H -1.854 13.455 -2.455 1.00 . A X . 4 LYS HA 1 1 10 3935 1 1 4 LYS HB2 H -4.324 13.653 -2.589 1.00 . A X . 4 LYS HB2 1 1 10 3936 1 1 4 LYS HB3 H -3.545 15.180 -2.193 1.00 . A X . 4 LYS HB3 1 1 10 3937 1 1 4 LYS HD2 H -6.275 16.044 -4.562 1.00 . A X . 4 LYS HD2 1 1 10 3938 1 1 4 LYS HD3 H -6.250 15.114 -3.064 1.00 . A X . 4 LYS HD3 1 1 10 3939 1 1 4 LYS HE2 H -6.353 17.474 -2.560 1.00 . A X . 4 LYS HE2 1 1 10 3940 1 1 4 LYS HE3 H -4.790 16.829 -2.058 1.00 . A X . 4 LYS HE3 1 1 10 3941 1 1 4 LYS HG2 H -3.752 15.849 -4.572 1.00 . A X . 4 LYS HG2 1 1 10 3942 1 1 4 LYS HG3 H -4.648 14.358 -4.873 1.00 . A X . 4 LYS HG3 1 1 10 3943 1 1 4 LYS HZ1 H -4.730 19.019 -3.251 1.00 . A X . 4 LYS HZ1 1 1 10 3944 1 1 4 LYS HZ2 H -5.213 18.199 -4.655 1.00 . A X . 4 LYS HZ2 1 1 10 3945 1 1 4 LYS HZ3 H -3.740 17.815 -3.914 1.00 . A X . 4 LYS HZ3 1 1 10 3946 1 1 4 LYS N N -1.471 14.877 -3.898 1.00 . A X . 4 LYS N 1 1 10 3947 1 1 4 LYS NZ N -4.727 18.094 -3.738 1.00 . A X . 4 LYS NZ 1 1 10 3948 1 1 4 LYS O O -3.526 12.054 -4.429 1.00 . A X . 4 LYS O 1 1 10 3949 1 1 5 LEU C C -1.309 10.101 -5.691 1.00 . A X . 5 LEU C 1 1 10 3950 1 1 5 LEU CA C -1.453 11.524 -6.213 1.00 . A X . 5 LEU CA 1 1 10 3951 1 1 5 LEU CB C -0.337 11.836 -7.213 1.00 . A X . 5 LEU CB 1 1 10 3952 1 1 5 LEU CD1 C 0.834 13.473 -8.698 1.00 . A X . 5 LEU CD1 1 1 10 3953 1 1 5 LEU CD2 C -1.661 13.469 -8.580 1.00 . A X . 5 LEU CD2 1 1 10 3954 1 1 5 LEU CG C -0.372 13.244 -7.805 1.00 . A X . 5 LEU CG 1 1 10 3955 1 1 5 LEU H H -0.596 12.970 -4.932 1.00 . A X . 5 LEU H 1 1 10 3956 1 1 5 LEU HA H -2.404 11.615 -6.705 1.00 . A X . 5 LEU HA 1 1 10 3957 1 1 5 LEU HB2 H 0.612 11.702 -6.715 1.00 . A X . 5 LEU HB2 1 1 10 3958 1 1 5 LEU HB3 H -0.401 11.127 -8.025 1.00 . A X . 5 LEU HB3 1 1 10 3959 1 1 5 LEU HD11 H 0.826 12.760 -9.508 1.00 . A X . 5 LEU HD11 1 1 10 3960 1 1 5 LEU HD12 H 1.737 13.349 -8.119 1.00 . A X . 5 LEU HD12 1 1 10 3961 1 1 5 LEU HD13 H 0.800 14.476 -9.101 1.00 . A X . 5 LEU HD13 1 1 10 3962 1 1 5 LEU HD21 H -1.724 12.757 -9.389 1.00 . A X . 5 LEU HD21 1 1 10 3963 1 1 5 LEU HD22 H -1.668 14.471 -8.981 1.00 . A X . 5 LEU HD22 1 1 10 3964 1 1 5 LEU HD23 H -2.504 13.340 -7.917 1.00 . A X . 5 LEU HD23 1 1 10 3965 1 1 5 LEU HG H -0.333 13.964 -7.002 1.00 . A X . 5 LEU HG 1 1 10 3966 1 1 5 LEU N N -1.427 12.487 -5.120 1.00 . A X . 5 LEU N 1 1 10 3967 1 1 5 LEU O O -1.515 9.131 -6.424 1.00 . A X . 5 LEU O 1 1 10 3968 1 1 6 ALA C C -2.141 7.957 -3.659 1.00 . A X . 6 ALA C 1 1 10 3969 1 1 6 ALA CA C -0.810 8.692 -3.770 1.00 . A X . 6 ALA CA 1 1 10 3970 1 1 6 ALA CB C -0.192 8.865 -2.394 1.00 . A X . 6 ALA CB 1 1 10 3971 1 1 6 ALA H H -0.828 10.806 -3.895 1.00 . A X . 6 ALA H 1 1 10 3972 1 1 6 ALA HA H -0.135 8.102 -4.371 1.00 . A X . 6 ALA HA 1 1 10 3973 1 1 6 ALA HB1 H -0.860 9.436 -1.768 1.00 . A X . 6 ALA HB1 1 1 10 3974 1 1 6 ALA HB2 H 0.748 9.389 -2.485 1.00 . A X . 6 ALA HB2 1 1 10 3975 1 1 6 ALA HB3 H -0.023 7.897 -1.948 1.00 . A X . 6 ALA HB3 1 1 10 3976 1 1 6 ALA N N -0.976 9.987 -4.417 1.00 . A X . 6 ALA N 1 1 10 3977 1 1 6 ALA O O -2.179 6.763 -3.386 1.00 . A X . 6 ALA O 1 1 10 3978 1 1 7 LEU C C -5.144 7.945 -5.212 1.00 . A X . 7 LEU C 1 1 10 3979 1 1 7 LEU CA C -4.556 8.092 -3.814 1.00 . A X . 7 LEU CA 1 1 10 3980 1 1 7 LEU CB C -5.471 8.960 -2.947 1.00 . A X . 7 LEU CB 1 1 10 3981 1 1 7 LEU CD1 C -5.963 10.073 -0.753 1.00 . A X . 7 LEU CD1 1 1 10 3982 1 1 7 LEU CD2 C -4.778 7.874 -0.800 1.00 . A X . 7 LEU CD2 1 1 10 3983 1 1 7 LEU CG C -4.981 9.198 -1.516 1.00 . A X . 7 LEU CG 1 1 10 3984 1 1 7 LEU H H -3.137 9.632 -4.078 1.00 . A X . 7 LEU H 1 1 10 3985 1 1 7 LEU HA H -4.466 7.113 -3.366 1.00 . A X . 7 LEU HA 1 1 10 3986 1 1 7 LEU HB2 H -5.583 9.920 -3.430 1.00 . A X . 7 LEU HB2 1 1 10 3987 1 1 7 LEU HB3 H -6.441 8.488 -2.896 1.00 . A X . 7 LEU HB3 1 1 10 3988 1 1 7 LEU HD11 H -6.048 11.031 -1.244 1.00 . A X . 7 LEU HD11 1 1 10 3989 1 1 7 LEU HD12 H -5.607 10.216 0.257 1.00 . A X . 7 LEU HD12 1 1 10 3990 1 1 7 LEU HD13 H -6.929 9.591 -0.729 1.00 . A X . 7 LEU HD13 1 1 10 3991 1 1 7 LEU HD21 H -5.718 7.344 -0.757 1.00 . A X . 7 LEU HD21 1 1 10 3992 1 1 7 LEU HD22 H -4.421 8.056 0.203 1.00 . A X . 7 LEU HD22 1 1 10 3993 1 1 7 LEU HD23 H -4.054 7.281 -1.341 1.00 . A X . 7 LEU HD23 1 1 10 3994 1 1 7 LEU HG H -4.031 9.711 -1.548 1.00 . A X . 7 LEU HG 1 1 10 3995 1 1 7 LEU N N -3.229 8.678 -3.877 1.00 . A X . 7 LEU N 1 1 10 3996 1 1 7 LEU O O -6.315 7.611 -5.371 1.00 . A X . 7 LEU O 1 1 10 3997 1 1 8 ALA C C -3.938 7.196 -8.440 1.00 . A X . 8 ALA C 1 1 10 3998 1 1 8 ALA CA C -4.789 8.144 -7.604 1.00 . A X . 8 ALA CA 1 1 10 3999 1 1 8 ALA CB C -4.790 9.537 -8.216 1.00 . A X . 8 ALA CB 1 1 10 4000 1 1 8 ALA H H -3.390 8.427 -6.042 1.00 . A X . 8 ALA H 1 1 10 4001 1 1 8 ALA HA H -5.806 7.781 -7.599 1.00 . A X . 8 ALA HA 1 1 10 4002 1 1 8 ALA HB1 H -5.438 10.183 -7.640 1.00 . A X . 8 ALA HB1 1 1 10 4003 1 1 8 ALA HB2 H -5.146 9.485 -9.234 1.00 . A X . 8 ALA HB2 1 1 10 4004 1 1 8 ALA HB3 H -3.787 9.936 -8.206 1.00 . A X . 8 ALA HB3 1 1 10 4005 1 1 8 ALA N N -4.325 8.198 -6.226 1.00 . A X . 8 ALA N 1 1 10 4006 1 1 8 ALA O O -4.464 6.366 -9.180 1.00 . A X . 8 ALA O 1 1 10 4007 1 1 9 LYS C C -1.757 5.031 -8.756 1.00 . A X . 9 LYS C 1 1 10 4008 1 1 9 LYS CA C -1.703 6.520 -9.120 1.00 . A X . 9 LYS CA 1 1 10 4009 1 1 9 LYS CB C -0.274 7.062 -9.010 1.00 . A X . 9 LYS CB 1 1 10 4010 1 1 9 LYS CD C 2.073 7.034 -9.910 1.00 . A X . 9 LYS CD 1 1 10 4011 1 1 9 LYS CE C 1.980 8.468 -10.404 1.00 . A X . 9 LYS CE 1 1 10 4012 1 1 9 LYS CG C 0.714 6.360 -9.928 1.00 . A X . 9 LYS CG 1 1 10 4013 1 1 9 LYS H H -2.257 7.960 -7.670 1.00 . A X . 9 LYS H 1 1 10 4014 1 1 9 LYS HA H -2.022 6.617 -10.150 1.00 . A X . 9 LYS HA 1 1 10 4015 1 1 9 LYS HB2 H -0.278 8.113 -9.260 1.00 . A X . 9 LYS HB2 1 1 10 4016 1 1 9 LYS HB3 H 0.066 6.943 -7.991 1.00 . A X . 9 LYS HB3 1 1 10 4017 1 1 9 LYS HD2 H 2.454 7.035 -8.900 1.00 . A X . 9 LYS HD2 1 1 10 4018 1 1 9 LYS HD3 H 2.746 6.486 -10.552 1.00 . A X . 9 LYS HD3 1 1 10 4019 1 1 9 LYS HE2 H 1.561 8.465 -11.399 1.00 . A X . 9 LYS HE2 1 1 10 4020 1 1 9 LYS HE3 H 1.331 9.020 -9.742 1.00 . A X . 9 LYS HE3 1 1 10 4021 1 1 9 LYS HG2 H 0.827 5.337 -9.605 1.00 . A X . 9 LYS HG2 1 1 10 4022 1 1 9 LYS HG3 H 0.326 6.380 -10.935 1.00 . A X . 9 LYS HG3 1 1 10 4023 1 1 9 LYS HZ1 H 3.724 9.162 -9.489 1.00 . A X . 9 LYS HZ1 1 1 10 4024 1 1 9 LYS HZ2 H 3.213 10.101 -10.809 1.00 . A X . 9 LYS HZ2 1 1 10 4025 1 1 9 LYS HZ3 H 3.950 8.599 -11.072 1.00 . A X . 9 LYS HZ3 1 1 10 4026 1 1 9 LYS N N -2.621 7.316 -8.314 1.00 . A X . 9 LYS N 1 1 10 4027 1 1 9 LYS NZ N 3.309 9.128 -10.445 1.00 . A X . 9 LYS NZ 1 1 10 4028 1 1 9 LYS O O -1.965 4.195 -9.635 1.00 . A X . 9 LYS O 1 1 10 4029 1 1 10 PRO C C -3.103 2.780 -6.908 1.00 . A X . 10 PRO C 1 1 10 4030 1 1 10 PRO CA C -1.658 3.244 -7.079 1.00 . A X . 10 PRO CA 1 1 10 4031 1 1 10 PRO CB C -0.914 3.203 -5.748 1.00 . A X . 10 PRO CB 1 1 10 4032 1 1 10 PRO CD C -1.228 5.517 -6.327 1.00 . A X . 10 PRO CD 1 1 10 4033 1 1 10 PRO CG C -1.088 4.560 -5.167 1.00 . A X . 10 PRO CG 1 1 10 4034 1 1 10 PRO HA H -1.160 2.603 -7.792 1.00 . A X . 10 PRO HA 1 1 10 4035 1 1 10 PRO HB2 H -1.349 2.444 -5.115 1.00 . A X . 10 PRO HB2 1 1 10 4036 1 1 10 PRO HB3 H 0.128 2.980 -5.924 1.00 . A X . 10 PRO HB3 1 1 10 4037 1 1 10 PRO HD2 H -2.022 6.222 -6.138 1.00 . A X . 10 PRO HD2 1 1 10 4038 1 1 10 PRO HD3 H -0.297 6.035 -6.501 1.00 . A X . 10 PRO HD3 1 1 10 4039 1 1 10 PRO HG2 H -1.977 4.584 -4.555 1.00 . A X . 10 PRO HG2 1 1 10 4040 1 1 10 PRO HG3 H -0.221 4.815 -4.577 1.00 . A X . 10 PRO HG3 1 1 10 4041 1 1 10 PRO N N -1.568 4.648 -7.474 1.00 . A X . 10 PRO N 1 1 10 4042 1 1 10 PRO O O -3.363 1.582 -6.802 1.00 . A X . 10 PRO O 1 1 10 4043 1 1 11 ALA C C -5.902 2.943 -5.401 1.00 . A X . 11 ALA C 1 1 10 4044 1 1 11 ALA CA C -5.473 3.496 -6.766 1.00 . A X . 11 ALA CA 1 1 10 4045 1 1 11 ALA CB C -5.935 2.574 -7.889 1.00 . A X . 11 ALA CB 1 1 10 4046 1 1 11 ALA H H -3.719 4.680 -6.858 1.00 . A X . 11 ALA H 1 1 10 4047 1 1 11 ALA HA H -5.965 4.446 -6.908 1.00 . A X . 11 ALA HA 1 1 10 4048 1 1 11 ALA HB1 H -5.625 2.982 -8.842 1.00 . A X . 11 ALA HB1 1 1 10 4049 1 1 11 ALA HB2 H -7.012 2.492 -7.866 1.00 . A X . 11 ALA HB2 1 1 10 4050 1 1 11 ALA HB3 H -5.495 1.596 -7.756 1.00 . A X . 11 ALA HB3 1 1 10 4051 1 1 11 ALA N N -4.025 3.749 -6.848 1.00 . A X . 11 ALA N 1 1 10 4052 1 1 11 ALA O O -7.081 3.000 -5.045 1.00 . A X . 11 ALA O 1 1 10 4053 1 1 12 LEU C C -4.694 2.841 -2.256 1.00 . A X . 12 LEU C 1 1 10 4054 1 1 12 LEU CA C -5.229 1.886 -3.315 1.00 . A X . 12 LEU CA 1 1 10 4055 1 1 12 LEU CB C -4.609 0.493 -3.128 1.00 . A X . 12 LEU CB 1 1 10 4056 1 1 12 LEU CD1 C -6.829 -0.666 -3.409 1.00 . A X . 12 LEU CD1 1 1 10 4057 1 1 12 LEU CD2 C -5.198 -0.637 -5.312 1.00 . A X . 12 LEU CD2 1 1 10 4058 1 1 12 LEU CG C -5.357 -0.674 -3.797 1.00 . A X . 12 LEU CG 1 1 10 4059 1 1 12 LEU H H -4.039 2.357 -5.001 1.00 . A X . 12 LEU H 1 1 10 4060 1 1 12 LEU HA H -6.298 1.811 -3.204 1.00 . A X . 12 LEU HA 1 1 10 4061 1 1 12 LEU HB2 H -3.605 0.517 -3.524 1.00 . A X . 12 LEU HB2 1 1 10 4062 1 1 12 LEU HB3 H -4.552 0.291 -2.067 1.00 . A X . 12 LEU HB3 1 1 10 4063 1 1 12 LEU HD11 H -6.920 -0.791 -2.340 1.00 . A X . 12 LEU HD11 1 1 10 4064 1 1 12 LEU HD12 H -7.338 -1.475 -3.909 1.00 . A X . 12 LEU HD12 1 1 10 4065 1 1 12 LEU HD13 H -7.275 0.275 -3.699 1.00 . A X . 12 LEU HD13 1 1 10 4066 1 1 12 LEU HD21 H -5.725 -1.473 -5.748 1.00 . A X . 12 LEU HD21 1 1 10 4067 1 1 12 LEU HD22 H -4.150 -0.700 -5.568 1.00 . A X . 12 LEU HD22 1 1 10 4068 1 1 12 LEU HD23 H -5.607 0.285 -5.696 1.00 . A X . 12 LEU HD23 1 1 10 4069 1 1 12 LEU HG H -4.931 -1.603 -3.444 1.00 . A X . 12 LEU HG 1 1 10 4070 1 1 12 LEU N N -4.952 2.405 -4.650 1.00 . A X . 12 LEU N 1 1 10 4071 1 1 12 LEU O O -4.345 3.979 -2.566 1.00 . A X . 12 LEU O 1 1 10 4072 1 1 13 LEU C C -2.686 3.560 -0.112 1.00 . A X . 13 LEU C 1 1 10 4073 1 1 13 LEU CA C -4.152 3.198 0.096 1.00 . A X . 13 LEU CA 1 1 10 4074 1 1 13 LEU CB C -4.325 2.469 1.438 1.00 . A X . 13 LEU CB 1 1 10 4075 1 1 13 LEU CD1 C -6.428 1.122 1.071 1.00 . A X . 13 LEU CD1 1 1 10 4076 1 1 13 LEU CD2 C -5.812 1.879 3.367 1.00 . A X . 13 LEU CD2 1 1 10 4077 1 1 13 LEU CG C -5.772 2.224 1.888 1.00 . A X . 13 LEU CG 1 1 10 4078 1 1 13 LEU H H -4.923 1.459 -0.829 1.00 . A X . 13 LEU H 1 1 10 4079 1 1 13 LEU HA H -4.737 4.106 0.112 1.00 . A X . 13 LEU HA 1 1 10 4080 1 1 13 LEU HB2 H -3.831 1.510 1.363 1.00 . A X . 13 LEU HB2 1 1 10 4081 1 1 13 LEU HB3 H -3.830 3.048 2.200 1.00 . A X . 13 LEU HB3 1 1 10 4082 1 1 13 LEU HD11 H -7.436 0.964 1.423 1.00 . A X . 13 LEU HD11 1 1 10 4083 1 1 13 LEU HD12 H -5.862 0.209 1.177 1.00 . A X . 13 LEU HD12 1 1 10 4084 1 1 13 LEU HD13 H -6.452 1.411 0.031 1.00 . A X . 13 LEU HD13 1 1 10 4085 1 1 13 LEU HD21 H -6.835 1.714 3.671 1.00 . A X . 13 LEU HD21 1 1 10 4086 1 1 13 LEU HD22 H -5.393 2.696 3.937 1.00 . A X . 13 LEU HD22 1 1 10 4087 1 1 13 LEU HD23 H -5.233 0.984 3.544 1.00 . A X . 13 LEU HD23 1 1 10 4088 1 1 13 LEU HG H -6.343 3.129 1.742 1.00 . A X . 13 LEU HG 1 1 10 4089 1 1 13 LEU N N -4.634 2.377 -1.010 1.00 . A X . 13 LEU N 1 1 10 4090 1 1 13 LEU O O -2.333 4.733 -0.215 1.00 . A X . 13 LEU O 1 1 10 4091 1 1 14 TRP C C 0.187 1.445 -0.965 1.00 . A X . 14 TRP C 1 1 10 4092 1 1 14 TRP CA C -0.420 2.738 -0.440 1.00 . A X . 14 TRP CA 1 1 10 4093 1 1 14 TRP CB C 0.319 3.205 0.822 1.00 . A X . 14 TRP CB 1 1 10 4094 1 1 14 TRP CD1 C 2.862 2.864 0.707 1.00 . A X . 14 TRP CD1 1 1 10 4095 1 1 14 TRP CD2 C 2.184 4.915 0.125 1.00 . A X . 14 TRP CD2 1 1 10 4096 1 1 14 TRP CE2 C 3.586 4.861 0.022 1.00 . A X . 14 TRP CE2 1 1 10 4097 1 1 14 TRP CE3 C 1.533 6.112 -0.186 1.00 . A X . 14 TRP CE3 1 1 10 4098 1 1 14 TRP CG C 1.739 3.627 0.565 1.00 . A X . 14 TRP CG 1 1 10 4099 1 1 14 TRP CH2 C 3.682 7.111 -0.688 1.00 . A X . 14 TRP CH2 1 1 10 4100 1 1 14 TRP CZ2 C 4.346 5.953 -0.392 1.00 . A X . 14 TRP CZ2 1 1 10 4101 1 1 14 TRP CZ3 C 2.289 7.195 -0.591 1.00 . A X . 14 TRP CZ3 1 1 10 4102 1 1 14 TRP H H -2.174 1.633 -0.026 1.00 . A X . 14 TRP H 1 1 10 4103 1 1 14 TRP HA H -0.332 3.496 -1.202 1.00 . A X . 14 TRP HA 1 1 10 4104 1 1 14 TRP HB2 H -0.206 4.045 1.249 1.00 . A X . 14 TRP HB2 1 1 10 4105 1 1 14 TRP HB3 H 0.336 2.395 1.539 1.00 . A X . 14 TRP HB3 1 1 10 4106 1 1 14 TRP HD1 H 2.857 1.833 1.028 1.00 . A X . 14 TRP HD1 1 1 10 4107 1 1 14 TRP HE1 H 4.903 3.267 0.397 1.00 . A X . 14 TRP HE1 1 1 10 4108 1 1 14 TRP HE3 H 0.459 6.198 -0.118 1.00 . A X . 14 TRP HE3 1 1 10 4109 1 1 14 TRP HH2 H 4.235 7.984 -1.007 1.00 . A X . 14 TRP HH2 1 1 10 4110 1 1 14 TRP HZ2 H 5.422 5.906 -0.470 1.00 . A X . 14 TRP HZ2 1 1 10 4111 1 1 14 TRP HZ3 H 1.803 8.128 -0.835 1.00 . A X . 14 TRP HZ3 1 1 10 4112 1 1 14 TRP N N -1.839 2.541 -0.170 1.00 . A X . 14 TRP N 1 1 10 4113 1 1 14 TRP NE1 N 3.975 3.596 0.376 1.00 . A X . 14 TRP NE1 1 1 10 4114 1 1 14 TRP O O 0.879 0.723 -0.245 1.00 . A X . 14 TRP O 1 1 10 4115 1 1 15 LYS C C 1.393 0.353 -3.988 1.00 . A X . 15 LYS C 1 1 10 4116 1 1 15 LYS CA C 0.459 -0.045 -2.854 1.00 . A X . 15 LYS CA 1 1 10 4117 1 1 15 LYS CB C -0.658 -0.953 -3.381 1.00 . A X . 15 LYS CB 1 1 10 4118 1 1 15 LYS CD C -0.723 -2.326 -1.275 1.00 . A X . 15 LYS CD 1 1 10 4119 1 1 15 LYS CE C -1.610 -3.060 -0.284 1.00 . A X . 15 LYS CE 1 1 10 4120 1 1 15 LYS CG C -1.541 -1.545 -2.294 1.00 . A X . 15 LYS CG 1 1 10 4121 1 1 15 LYS H H -0.696 1.725 -2.730 1.00 . A X . 15 LYS H 1 1 10 4122 1 1 15 LYS HA H 1.027 -0.582 -2.110 1.00 . A X . 15 LYS HA 1 1 10 4123 1 1 15 LYS HB2 H -1.285 -0.380 -4.048 1.00 . A X . 15 LYS HB2 1 1 10 4124 1 1 15 LYS HB3 H -0.211 -1.766 -3.933 1.00 . A X . 15 LYS HB3 1 1 10 4125 1 1 15 LYS HD2 H -0.112 -3.047 -1.796 1.00 . A X . 15 LYS HD2 1 1 10 4126 1 1 15 LYS HD3 H -0.088 -1.639 -0.735 1.00 . A X . 15 LYS HD3 1 1 10 4127 1 1 15 LYS HE2 H -0.987 -3.502 0.480 1.00 . A X . 15 LYS HE2 1 1 10 4128 1 1 15 LYS HE3 H -2.284 -2.348 0.169 1.00 . A X . 15 LYS HE3 1 1 10 4129 1 1 15 LYS HG2 H -2.061 -0.745 -1.787 1.00 . A X . 15 LYS HG2 1 1 10 4130 1 1 15 LYS HG3 H -2.258 -2.210 -2.752 1.00 . A X . 15 LYS HG3 1 1 10 4131 1 1 15 LYS HZ1 H -2.934 -4.681 -0.226 1.00 . A X . 15 LYS HZ1 1 1 10 4132 1 1 15 LYS HZ2 H -1.779 -4.776 -1.461 1.00 . A X . 15 LYS HZ2 1 1 10 4133 1 1 15 LYS HZ3 H -3.087 -3.712 -1.611 1.00 . A X . 15 LYS HZ3 1 1 10 4134 1 1 15 LYS N N -0.097 1.141 -2.218 1.00 . A X . 15 LYS N 1 1 10 4135 1 1 15 LYS NZ N -2.407 -4.130 -0.938 1.00 . A X . 15 LYS NZ 1 1 10 4136 1 1 15 LYS O O 1.473 -0.321 -5.014 1.00 . A X . 15 LYS O 1 1 10 4137 1 1 16 ALA C C 4.462 1.800 -4.317 1.00 . A X . 16 ALA C 1 1 10 4138 1 1 16 ALA CA C 3.025 1.957 -4.794 1.00 . A X . 16 ALA CA 1 1 10 4139 1 1 16 ALA CB C 2.728 3.413 -5.120 1.00 . A X . 16 ALA CB 1 1 10 4140 1 1 16 ALA H H 1.990 1.946 -2.953 1.00 . A X . 16 ALA H 1 1 10 4141 1 1 16 ALA HA H 2.890 1.374 -5.695 1.00 . A X . 16 ALA HA 1 1 10 4142 1 1 16 ALA HB1 H 1.713 3.502 -5.474 1.00 . A X . 16 ALA HB1 1 1 10 4143 1 1 16 ALA HB2 H 3.408 3.756 -5.884 1.00 . A X . 16 ALA HB2 1 1 10 4144 1 1 16 ALA HB3 H 2.854 4.011 -4.231 1.00 . A X . 16 ALA HB3 1 1 10 4145 1 1 16 ALA N N 2.095 1.458 -3.794 1.00 . A X . 16 ALA N 1 1 10 4146 1 1 16 ALA O O 5.203 0.954 -4.814 1.00 . A X . 16 ALA O 1 1 10 4147 1 1 17 LEU C C 6.276 1.964 -1.465 1.00 . A X . 17 LEU C 1 1 10 4148 1 1 17 LEU CA C 6.216 2.589 -2.849 1.00 . A X . 17 LEU CA 1 1 10 4149 1 1 17 LEU CB C 6.772 4.019 -2.825 1.00 . A X . 17 LEU CB 1 1 10 4150 1 1 17 LEU CD1 C 8.655 5.627 -3.217 1.00 . A X . 17 LEU CD1 1 1 10 4151 1 1 17 LEU CD2 C 9.142 3.399 -2.211 1.00 . A X . 17 LEU CD2 1 1 10 4152 1 1 17 LEU CG C 8.258 4.162 -3.187 1.00 . A X . 17 LEU CG 1 1 10 4153 1 1 17 LEU H H 4.192 3.171 -2.888 1.00 . A X . 17 LEU H 1 1 10 4154 1 1 17 LEU HA H 6.805 1.991 -3.528 1.00 . A X . 17 LEU HA 1 1 10 4155 1 1 17 LEU HB2 H 6.198 4.614 -3.521 1.00 . A X . 17 LEU HB2 1 1 10 4156 1 1 17 LEU HB3 H 6.628 4.417 -1.834 1.00 . A X . 17 LEU HB3 1 1 10 4157 1 1 17 LEU HD11 H 9.705 5.714 -3.462 1.00 . A X . 17 LEU HD11 1 1 10 4158 1 1 17 LEU HD12 H 8.474 6.069 -2.249 1.00 . A X . 17 LEU HD12 1 1 10 4159 1 1 17 LEU HD13 H 8.067 6.140 -3.965 1.00 . A X . 17 LEU HD13 1 1 10 4160 1 1 17 LEU HD21 H 8.989 3.781 -1.211 1.00 . A X . 17 LEU HD21 1 1 10 4161 1 1 17 LEU HD22 H 10.177 3.522 -2.490 1.00 . A X . 17 LEU HD22 1 1 10 4162 1 1 17 LEU HD23 H 8.882 2.351 -2.237 1.00 . A X . 17 LEU HD23 1 1 10 4163 1 1 17 LEU HG H 8.417 3.754 -4.175 1.00 . A X . 17 LEU HG 1 1 10 4164 1 1 17 LEU N N 4.846 2.589 -3.322 1.00 . A X . 17 LEU N 1 1 10 4165 1 1 17 LEU O O 6.543 2.635 -0.470 1.00 . A X . 17 LEU O 1 1 10 4166 1 1 18 ALA C C 7.208 -1.093 -0.274 1.00 . A X . 18 ALA C 1 1 10 4167 1 1 18 ALA CA C 6.090 -0.064 -0.162 1.00 . A X . 18 ALA CA 1 1 10 4168 1 1 18 ALA CB C 4.765 -0.731 0.189 1.00 . A X . 18 ALA CB 1 1 10 4169 1 1 18 ALA H H 5.684 0.217 -2.215 1.00 . A X . 18 ALA H 1 1 10 4170 1 1 18 ALA HA H 6.331 0.639 0.620 1.00 . A X . 18 ALA HA 1 1 10 4171 1 1 18 ALA HB1 H 3.989 0.017 0.239 1.00 . A X . 18 ALA HB1 1 1 10 4172 1 1 18 ALA HB2 H 4.852 -1.223 1.146 1.00 . A X . 18 ALA HB2 1 1 10 4173 1 1 18 ALA HB3 H 4.516 -1.460 -0.568 1.00 . A X . 18 ALA HB3 1 1 10 4174 1 1 18 ALA N N 5.981 0.678 -1.404 1.00 . A X . 18 ALA N 1 1 10 4175 1 1 18 ALA O O 8.355 -0.827 0.087 1.00 . A X . 18 ALA O 1 1 10 4176 1 1 19 LEU C C 8.270 -3.221 -2.564 1.00 . A X . 19 LEU C 1 1 10 4177 1 1 19 LEU CA C 7.881 -3.275 -1.093 1.00 . A X . 19 LEU CA 1 1 10 4178 1 1 19 LEU CB C 7.353 -4.665 -0.726 1.00 . A X . 19 LEU CB 1 1 10 4179 1 1 19 LEU CD1 C 6.492 -6.263 1.001 1.00 . A X . 19 LEU CD1 1 1 10 4180 1 1 19 LEU CD2 C 8.340 -4.687 1.582 1.00 . A X . 19 LEU CD2 1 1 10 4181 1 1 19 LEU CG C 7.072 -4.879 0.763 1.00 . A X . 19 LEU CG 1 1 10 4182 1 1 19 LEU H H 5.945 -2.429 -1.036 1.00 . A X . 19 LEU H 1 1 10 4183 1 1 19 LEU HA H 8.752 -3.057 -0.494 1.00 . A X . 19 LEU HA 1 1 10 4184 1 1 19 LEU HB2 H 6.436 -4.834 -1.274 1.00 . A X . 19 LEU HB2 1 1 10 4185 1 1 19 LEU HB3 H 8.082 -5.398 -1.042 1.00 . A X . 19 LEU HB3 1 1 10 4186 1 1 19 LEU HD11 H 5.566 -6.364 0.454 1.00 . A X . 19 LEU HD11 1 1 10 4187 1 1 19 LEU HD12 H 6.303 -6.397 2.056 1.00 . A X . 19 LEU HD12 1 1 10 4188 1 1 19 LEU HD13 H 7.193 -7.010 0.663 1.00 . A X . 19 LEU HD13 1 1 10 4189 1 1 19 LEU HD21 H 9.080 -5.410 1.274 1.00 . A X . 19 LEU HD21 1 1 10 4190 1 1 19 LEU HD22 H 8.115 -4.826 2.629 1.00 . A X . 19 LEU HD22 1 1 10 4191 1 1 19 LEU HD23 H 8.722 -3.688 1.425 1.00 . A X . 19 LEU HD23 1 1 10 4192 1 1 19 LEU HG H 6.346 -4.150 1.095 1.00 . A X . 19 LEU HG 1 1 10 4193 1 1 19 LEU N N 6.881 -2.253 -0.817 1.00 . A X . 19 LEU N 1 1 10 4194 1 1 19 LEU O O 8.088 -4.184 -3.306 1.00 . A X . 19 LEU O 1 1 10 4195 1 1 20 LYS C C 10.543 -2.361 -4.660 1.00 . A X . 20 LYS C 1 1 10 4196 1 1 20 LYS CA C 9.136 -1.851 -4.376 1.00 . A X . 20 LYS CA 1 1 10 4197 1 1 20 LYS CB C 9.030 -0.362 -4.719 1.00 . A X . 20 LYS CB 1 1 10 4198 1 1 20 LYS CD C 9.065 1.433 -6.481 1.00 . A X . 20 LYS CD 1 1 10 4199 1 1 20 LYS CE C 9.107 1.722 -7.974 1.00 . A X . 20 LYS CE 1 1 10 4200 1 1 20 LYS CG C 9.202 -0.055 -6.198 1.00 . A X . 20 LYS CG 1 1 10 4201 1 1 20 LYS H H 8.916 -1.349 -2.331 1.00 . A X . 20 LYS H 1 1 10 4202 1 1 20 LYS HA H 8.436 -2.400 -4.988 1.00 . A X . 20 LYS HA 1 1 10 4203 1 1 20 LYS HB2 H 8.059 -0.005 -4.411 1.00 . A X . 20 LYS HB2 1 1 10 4204 1 1 20 LYS HB3 H 9.789 0.176 -4.171 1.00 . A X . 20 LYS HB3 1 1 10 4205 1 1 20 LYS HD2 H 8.122 1.779 -6.084 1.00 . A X . 20 LYS HD2 1 1 10 4206 1 1 20 LYS HD3 H 9.875 1.958 -5.997 1.00 . A X . 20 LYS HD3 1 1 10 4207 1 1 20 LYS HE2 H 8.288 1.206 -8.451 1.00 . A X . 20 LYS HE2 1 1 10 4208 1 1 20 LYS HE3 H 8.996 2.787 -8.125 1.00 . A X . 20 LYS HE3 1 1 10 4209 1 1 20 LYS HG2 H 10.183 -0.383 -6.512 1.00 . A X . 20 LYS HG2 1 1 10 4210 1 1 20 LYS HG3 H 8.448 -0.591 -6.756 1.00 . A X . 20 LYS HG3 1 1 10 4211 1 1 20 LYS HZ1 H 10.523 0.254 -8.434 1.00 . A X . 20 LYS HZ1 1 1 10 4212 1 1 20 LYS HZ2 H 11.184 1.797 -8.169 1.00 . A X . 20 LYS HZ2 1 1 10 4213 1 1 20 LYS HZ3 H 10.368 1.458 -9.616 1.00 . A X . 20 LYS HZ3 1 1 10 4214 1 1 20 LYS N N 8.779 -2.070 -2.981 1.00 . A X . 20 LYS N 1 1 10 4215 1 1 20 LYS NZ N 10.383 1.278 -8.589 1.00 . A X . 20 LYS NZ 1 1 10 4216 1 1 20 LYS O O 10.729 -3.285 -5.451 1.00 . A X . 20 LYS O 1 1 10 4217 1 1 21 LEU C C 13.439 -2.902 -2.972 1.00 . A X . 21 LEU C 1 1 10 4218 1 1 21 LEU CA C 12.922 -2.152 -4.194 1.00 . A X . 21 LEU CA 1 1 10 4219 1 1 21 LEU CB C 13.796 -0.918 -4.439 1.00 . A X . 21 LEU CB 1 1 10 4220 1 1 21 LEU CD1 C 14.310 1.152 -5.740 1.00 . A X . 21 LEU CD1 1 1 10 4221 1 1 21 LEU CD2 C 13.565 -0.909 -6.931 1.00 . A X . 21 LEU CD2 1 1 10 4222 1 1 21 LEU CG C 13.430 -0.082 -5.664 1.00 . A X . 21 LEU CG 1 1 10 4223 1 1 21 LEU H H 11.318 -1.024 -3.399 1.00 . A X . 21 LEU H 1 1 10 4224 1 1 21 LEU HA H 12.974 -2.800 -5.056 1.00 . A X . 21 LEU HA 1 1 10 4225 1 1 21 LEU HB2 H 13.732 -0.285 -3.567 1.00 . A X . 21 LEU HB2 1 1 10 4226 1 1 21 LEU HB3 H 14.819 -1.246 -4.550 1.00 . A X . 21 LEU HB3 1 1 10 4227 1 1 21 LEU HD11 H 14.167 1.753 -4.853 1.00 . A X . 21 LEU HD11 1 1 10 4228 1 1 21 LEU HD12 H 14.044 1.732 -6.612 1.00 . A X . 21 LEU HD12 1 1 10 4229 1 1 21 LEU HD13 H 15.346 0.854 -5.809 1.00 . A X . 21 LEU HD13 1 1 10 4230 1 1 21 LEU HD21 H 12.885 -1.747 -6.886 1.00 . A X . 21 LEU HD21 1 1 10 4231 1 1 21 LEU HD22 H 14.577 -1.274 -7.016 1.00 . A X . 21 LEU HD22 1 1 10 4232 1 1 21 LEU HD23 H 13.329 -0.297 -7.789 1.00 . A X . 21 LEU HD23 1 1 10 4233 1 1 21 LEU HG H 12.402 0.243 -5.579 1.00 . A X . 21 LEU HG 1 1 10 4234 1 1 21 LEU N N 11.529 -1.757 -4.009 1.00 . A X . 21 LEU N 1 1 10 4235 1 1 21 LEU O O 14.367 -3.708 -3.067 1.00 . A X . 21 LEU O 1 1 10 4236 1 1 22 LYS C C 12.873 -4.629 -0.398 1.00 . A X . 22 LYS C 1 1 10 4237 1 1 22 LYS CA C 13.289 -3.174 -0.561 1.00 . A X . 22 LYS CA 1 1 10 4238 1 1 22 LYS CB C 12.732 -2.336 0.593 1.00 . A X . 22 LYS CB 1 1 10 4239 1 1 22 LYS CD C 12.573 -1.935 3.064 1.00 . A X . 22 LYS CD 1 1 10 4240 1 1 22 LYS CE C 12.959 -2.427 4.451 1.00 . A X . 22 LYS CE 1 1 10 4241 1 1 22 LYS CG C 13.155 -2.819 1.971 1.00 . A X . 22 LYS CG 1 1 10 4242 1 1 22 LYS H H 12.030 -2.070 -1.839 1.00 . A X . 22 LYS H 1 1 10 4243 1 1 22 LYS HA H 14.366 -3.117 -0.549 1.00 . A X . 22 LYS HA 1 1 10 4244 1 1 22 LYS HB2 H 13.069 -1.316 0.475 1.00 . A X . 22 LYS HB2 1 1 10 4245 1 1 22 LYS HB3 H 11.653 -2.354 0.545 1.00 . A X . 22 LYS HB3 1 1 10 4246 1 1 22 LYS HD2 H 12.945 -0.930 2.934 1.00 . A X . 22 LYS HD2 1 1 10 4247 1 1 22 LYS HD3 H 11.497 -1.937 2.977 1.00 . A X . 22 LYS HD3 1 1 10 4248 1 1 22 LYS HE2 H 12.535 -3.408 4.602 1.00 . A X . 22 LYS HE2 1 1 10 4249 1 1 22 LYS HE3 H 14.035 -2.486 4.511 1.00 . A X . 22 LYS HE3 1 1 10 4250 1 1 22 LYS HG2 H 12.804 -3.830 2.114 1.00 . A X . 22 LYS HG2 1 1 10 4251 1 1 22 LYS HG3 H 14.233 -2.797 2.037 1.00 . A X . 22 LYS HG3 1 1 10 4252 1 1 22 LYS HZ1 H 12.889 -0.570 5.409 1.00 . A X . 22 LYS HZ1 1 1 10 4253 1 1 22 LYS HZ2 H 12.715 -1.891 6.460 1.00 . A X . 22 LYS HZ2 1 1 10 4254 1 1 22 LYS HZ3 H 11.424 -1.425 5.463 1.00 . A X . 22 LYS HZ3 1 1 10 4255 1 1 22 LYS N N 12.826 -2.634 -1.829 1.00 . A X . 22 LYS N 1 1 10 4256 1 1 22 LYS NZ N 12.463 -1.516 5.518 1.00 . A X . 22 LYS NZ 1 1 10 4257 1 1 22 LYS O O 11.688 -4.932 -0.249 1.00 . A X . 22 LYS O 1 1 10 4258 1 1 23 LYS C C 13.493 -7.146 1.320 1.00 . A X . 23 LYS C 1 1 10 4259 1 1 23 LYS CA C 13.611 -6.932 -0.184 1.00 . A X . 23 LYS CA 1 1 10 4260 1 1 23 LYS CB C 14.743 -7.806 -0.731 1.00 . A X . 23 LYS CB 1 1 10 4261 1 1 23 LYS CD C 16.082 -8.607 -2.690 1.00 . A X . 23 LYS CD 1 1 10 4262 1 1 23 LYS CE C 16.418 -8.412 -4.157 1.00 . A X . 23 LYS CE 1 1 10 4263 1 1 23 LYS CG C 14.972 -7.674 -2.227 1.00 . A X . 23 LYS CG 1 1 10 4264 1 1 23 LYS H H 14.747 -5.234 -0.706 1.00 . A X . 23 LYS H 1 1 10 4265 1 1 23 LYS HA H 12.682 -7.212 -0.654 1.00 . A X . 23 LYS HA 1 1 10 4266 1 1 23 LYS HB2 H 15.660 -7.541 -0.226 1.00 . A X . 23 LYS HB2 1 1 10 4267 1 1 23 LYS HB3 H 14.516 -8.840 -0.517 1.00 . A X . 23 LYS HB3 1 1 10 4268 1 1 23 LYS HD2 H 16.966 -8.409 -2.106 1.00 . A X . 23 LYS HD2 1 1 10 4269 1 1 23 LYS HD3 H 15.766 -9.629 -2.536 1.00 . A X . 23 LYS HD3 1 1 10 4270 1 1 23 LYS HE2 H 15.534 -8.600 -4.749 1.00 . A X . 23 LYS HE2 1 1 10 4271 1 1 23 LYS HE3 H 16.741 -7.391 -4.308 1.00 . A X . 23 LYS HE3 1 1 10 4272 1 1 23 LYS HG2 H 14.059 -7.924 -2.747 1.00 . A X . 23 LYS HG2 1 1 10 4273 1 1 23 LYS HG3 H 15.250 -6.655 -2.451 1.00 . A X . 23 LYS HG3 1 1 10 4274 1 1 23 LYS HZ1 H 17.160 -10.319 -4.592 1.00 . A X . 23 LYS HZ1 1 1 10 4275 1 1 23 LYS HZ2 H 18.315 -9.262 -3.940 1.00 . A X . 23 LYS HZ2 1 1 10 4276 1 1 23 LYS HZ3 H 17.823 -9.088 -5.553 1.00 . A X . 23 LYS HZ3 1 1 10 4277 1 1 23 LYS N N 13.849 -5.525 -0.459 1.00 . A X . 23 LYS N 1 1 10 4278 1 1 23 LYS NZ N 17.502 -9.332 -4.592 1.00 . A X . 23 LYS NZ 1 1 10 4279 1 1 23 LYS O O 14.456 -6.917 2.063 1.00 . A X . 23 LYS O 1 1 10 4280 1 1 24 ALA C C 12.073 -9.269 3.513 1.00 . A X . 24 ALA C 1 1 10 4281 1 1 24 ALA CA C 12.089 -7.781 3.187 1.00 . A X . 24 ALA CA 1 1 10 4282 1 1 24 ALA CB C 10.786 -7.120 3.607 1.00 . A X . 24 ALA CB 1 1 10 4283 1 1 24 ALA H H 11.598 -7.742 1.129 1.00 . A X . 24 ALA H 1 1 10 4284 1 1 24 ALA HA H 12.895 -7.313 3.730 1.00 . A X . 24 ALA HA 1 1 10 4285 1 1 24 ALA HB1 H 10.643 -7.253 4.670 1.00 . A X . 24 ALA HB1 1 1 10 4286 1 1 24 ALA HB2 H 9.963 -7.573 3.073 1.00 . A X . 24 ALA HB2 1 1 10 4287 1 1 24 ALA HB3 H 10.827 -6.065 3.378 1.00 . A X . 24 ALA HB3 1 1 10 4288 1 1 24 ALA N N 12.323 -7.567 1.768 1.00 . A X . 24 ALA N 1 1 10 4289 1 1 24 ALA O O 10.995 -9.886 3.430 1.00 . A X . 24 ALA O 1 1 10 4290 1 1 24 ALA OXT O 13.144 -9.821 3.837 1.00 . A X . 24 ALA OXT 1 1 stop_ save_
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