NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
585737 | 2mih | 19679 | cing | 4-filtered-FRED | STAR | entry | full | 53 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2mih # This FRED archive file contains, for PDB entry <2mih>: # # - 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_2mih _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2mih _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 1556.77 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 $CLAVATA_LIKE_ENCODED_PEPTIDE_OF_MELOIDOGYNE_HAPLA___MHCLE6_7 A . 1 1 stop_ save_ save_CLAVATA_LIKE_ENCODED_PEPTIDE_OF_MELOIDOGYNE_HAPLA___MHCLE6_7 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "CLAVATA LIKE ENCODED PEPTIDE OF MELOIDOGYNE HAPLA MHCLE6 7" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code HQVPSGPNPLHNKK _Entity.Number_of_monomers 14 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 HIS . 1 1 2 GLN . 1 1 3 VAL . 1 1 4 PRO . 1 1 5 SER . 1 1 6 GLY . 1 1 7 PRO . 1 1 8 ASN . 1 1 9 PRO . 1 1 10 LEU . 1 1 11 HIS . 1 1 12 ASN . 1 1 13 LYS . 1 1 14 LYS . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID HIS 1 1 1 1 GLN 2 2 1 1 VAL 3 3 1 1 PRO 4 4 1 1 SER 5 5 1 1 GLY 6 6 1 1 PRO 7 7 1 1 ASN 8 8 1 1 PRO 9 9 1 1 LEU 10 10 1 1 HIS 11 11 1 1 ASN 12 12 1 1 LYS 13 13 1 1 LYS 14 14 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 2 . OR 1 1 1 2 . 3 . 1 1 1 3 . . . 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 2 . OR 1 1 11 2 . 3 . 1 1 11 3 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 2 . OR 1 1 16 2 . 3 . 1 1 16 3 . . . 1 1 17 1 . . . 1 1 18 1 2 . OR 1 1 18 2 . 3 . 1 1 18 3 . . . 1 1 19 1 2 . OR 1 1 19 2 . 3 . 1 1 19 3 . . . 1 1 20 1 . . . 1 1 21 1 2 . OR 1 1 21 2 . 3 . 1 1 21 3 . . . 1 1 22 1 2 . OR 1 1 22 2 . 3 . 1 1 22 3 . . . 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 2 . OR 1 1 41 2 . 3 . 1 1 41 3 . . . 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 2 . OR 1 1 48 2 . 3 . 1 1 48 3 . . . 1 1 49 1 . . . 1 1 50 1 2 . OR 1 1 50 2 . 3 . 1 1 50 3 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 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 2 1 1 1 1 HIS H1 . 1 . HT1 1 1 1 2 2 1 1 1 HIS HA . 1 . HA 1 1 1 3 1 1 1 8 ASN H . 8 . HN 1 1 1 3 2 1 1 8 ASN HA . 8 . HA 1 1 2 1 1 1 1 1 HIS H1 . 1 . HT1 1 1 2 1 1 1 1 8 ASN H . 8 . HN 1 1 2 1 2 1 1 10 LEU HA . 10 . HA 1 1 3 1 1 1 1 1 HIS HA . 1 . HA 1 1 3 1 2 1 1 2 GLN HA . 2 . HA 1 1 3 1 2 1 1 3 VAL HA . 3 . HA 1 1 4 1 1 1 1 1 HIS HE1 . 1 . HE1 1 1 4 1 2 1 1 7 PRO HA . 7 . HA 1 1 5 1 1 1 1 1 HIS HE1 . 1 . HE1 1 1 5 1 2 1 1 8 ASN QB . 8 . HB1 1 1 6 1 1 1 1 2 GLN H . 2 . HN 1 1 6 1 2 1 1 14 LYS HA . 14 . HA 1 1 7 1 1 1 1 2 GLN HA . 2 . HA 1 1 7 1 2 1 1 2 GLN HB2 . 2 . HB2 1 1 8 1 1 1 1 2 GLN HA . 2 . HA 1 1 8 1 2 1 1 2 GLN HG3 . 2 . HG1 1 1 9 1 1 1 1 2 GLN HA . 2 . HA 1 1 9 1 1 1 1 3 VAL HA . 3 . HA 1 1 9 1 2 1 1 3 VAL H . 3 . HN 1 1 10 1 1 1 1 2 GLN HA . 2 . HA 1 1 10 1 1 1 1 3 VAL HA . 3 . HA 1 1 10 1 2 1 1 9 PRO HB2 . 9 . HB2 1 1 11 2 1 1 1 2 GLN HB2 . 2 . HB2 1 1 11 2 2 1 1 2 GLN HG2 . 2 . HG2 1 1 11 3 1 1 1 9 PRO HB2 . 9 . HB2 1 1 11 3 2 1 1 9 PRO HG2 . 9 . HG2 1 1 12 1 1 1 1 2 GLN HB2 . 2 . HB2 1 1 12 1 2 1 1 2 GLN HG3 . 2 . HG1 1 1 13 1 1 1 1 2 GLN HB2 . 2 . HB2 1 1 13 1 2 1 1 9 PRO HB3 . 9 . HB1 1 1 14 1 1 1 1 3 VAL H . 3 . HN 1 1 14 1 2 1 1 3 VAL HB . 3 . HB 1 1 15 1 1 1 1 3 VAL H . 3 . HN 1 1 15 1 2 1 1 3 VAL MG2 . 3 . HG21 1 1 16 2 1 1 1 3 VAL HA . 3 . HA 1 1 16 2 2 1 1 4 PRO HD2 . 4 . HD2 1 1 16 3 1 1 1 5 SER HA . 5 . HA 1 1 16 3 2 1 1 5 SER HB2 . 5 . HB2 1 1 17 1 1 1 1 3 VAL HB . 3 . HB 1 1 17 1 2 1 1 3 VAL MG1 . 3 . HG11 1 1 18 2 1 1 1 4 PRO HA . 4 . HA 1 1 18 2 2 1 1 4 PRO HB2 . 4 . HB2 1 1 18 3 1 1 1 7 PRO HA . 7 . HA 1 1 18 3 2 1 1 7 PRO HB2 . 7 . HB2 1 1 19 2 1 1 1 4 PRO HA . 4 . HA 1 1 19 2 2 1 1 4 PRO HG3 . 4 . HG1 1 1 19 3 1 1 1 7 PRO HA . 7 . HA 1 1 19 3 2 1 1 7 PRO HG2 . 7 . HG2 1 1 20 1 1 1 1 4 PRO HA . 4 . HA 1 1 20 1 2 1 1 10 LEU H . 10 . HN 1 1 21 2 1 1 1 4 PRO HB2 . 4 . HB2 1 1 21 2 2 1 1 4 PRO HG2 . 4 . HG2 1 1 21 3 1 1 1 7 PRO HB2 . 7 . HB2 1 1 21 3 2 1 1 7 PRO HG3 . 7 . HG1 1 1 22 2 1 1 1 4 PRO HB2 . 4 . HB2 1 1 22 2 2 1 1 4 PRO HG3 . 4 . HG1 1 1 22 3 1 1 1 7 PRO HB2 . 7 . HB2 1 1 22 3 2 1 1 7 PRO HG2 . 7 . HG2 1 1 23 1 1 1 1 4 PRO HG3 . 4 . HG1 1 1 23 1 2 1 1 10 LEU H . 10 . HN 1 1 24 1 1 1 1 5 SER H . 5 . HN 1 1 24 1 2 1 1 5 SER HB2 . 5 . HB2 1 1 25 1 1 1 1 5 SER HA . 5 . HA 1 1 25 1 2 1 1 6 GLY H . 6 . HN 1 1 26 1 1 1 1 6 GLY H . 6 . HN 1 1 26 1 2 1 1 6 GLY HA2 . 6 . HA1 1 1 27 1 1 1 1 6 GLY H . 6 . HN 1 1 27 1 2 1 1 6 GLY HA3 . 6 . HA2 1 1 28 1 1 1 1 6 GLY HA2 . 6 . HA1 1 1 28 1 2 1 1 7 PRO HD3 . 7 . HD2 1 1 29 1 1 1 1 6 GLY HA3 . 6 . HA2 1 1 29 1 2 1 1 7 PRO HD3 . 7 . HD2 1 1 30 1 1 1 1 7 PRO HD3 . 7 . HD2 1 1 30 1 2 1 1 7 PRO HG3 . 7 . HG1 1 1 31 1 1 1 1 8 ASN H . 8 . HN 1 1 31 1 2 1 1 8 ASN QB . 8 . HB1 1 1 32 1 1 1 1 8 ASN HA . 8 . HA 1 1 32 1 2 1 1 8 ASN QB . 8 . HB2 1 1 33 1 1 1 1 9 PRO HD2 . 9 . HD2 1 1 33 1 2 1 1 14 LYS QB . 14 . HB1 1 1 34 1 1 1 1 10 LEU H . 10 . HN 1 1 34 1 2 1 1 10 LEU HA . 10 . HA 1 1 35 1 1 1 1 10 LEU H . 10 . HN 1 1 35 1 2 1 1 10 LEU HB2 . 10 . HB1 1 1 36 1 1 1 1 10 LEU H . 10 . HN 1 1 36 1 2 1 1 10 LEU HB3 . 10 . HB2 1 1 37 1 1 1 1 10 LEU HA . 10 . HA 1 1 37 1 2 1 1 10 LEU HB2 . 10 . HB1 1 1 38 1 1 1 1 10 LEU HA . 10 . HA 1 1 38 1 2 1 1 10 LEU HB3 . 10 . HB2 1 1 39 1 1 1 1 10 LEU HA . 10 . HA 1 1 39 1 2 1 1 10 LEU HG . 10 . HG 1 1 40 1 1 1 1 10 LEU HA . 10 . HA 1 1 40 1 2 1 1 11 HIS H . 11 . HN 1 1 41 2 1 1 1 10 LEU HA . 10 . HA 1 1 41 2 2 1 1 11 HIS H . 11 . HN 1 1 41 3 1 1 1 13 LYS H . 13 . HN 1 1 41 3 2 1 1 13 LYS HA . 13 . HA 1 1 42 1 1 1 1 11 HIS H . 11 . HN 1 1 42 1 1 1 1 13 LYS H . 13 . HN 1 1 42 1 2 1 1 11 HIS HA . 11 . HA 1 1 43 1 1 1 1 11 HIS H . 11 . HN 1 1 43 1 2 1 1 11 HIS HB2 . 11 . HB2 1 1 44 1 1 1 1 11 HIS H . 11 . HN 1 1 44 1 2 1 1 11 HIS HB3 . 11 . HB1 1 1 45 1 1 1 1 11 HIS HA . 11 . HA 1 1 45 1 2 1 1 13 LYS H . 13 . HN 1 1 46 1 1 1 1 13 LYS H . 13 . HN 1 1 46 1 2 1 1 13 LYS HA . 13 . HA 1 1 47 1 1 1 1 13 LYS HB3 . 13 . HB1 1 1 47 1 2 1 1 13 LYS QG . 13 . HG2 1 1 48 2 1 1 1 13 LYS HB3 . 13 . HB1 1 1 48 2 2 1 1 13 LYS QG . 13 . HG2 1 1 48 3 1 1 1 14 LYS QB . 14 . HB1 1 1 48 3 2 1 1 14 LYS HG3 . 14 . HG2 1 1 49 1 1 1 1 13 LYS HB3 . 13 . HB1 1 1 49 1 1 1 1 14 LYS QB . 14 . HB1 1 1 49 1 2 1 1 14 LYS H . 14 . HN 1 1 50 2 1 1 1 13 LYS HD2 . 13 . HD2 1 1 50 2 2 1 1 13 LYS QG . 13 . HG2 1 1 50 3 1 1 1 14 LYS HD2 . 14 . HD2 1 1 50 3 2 1 1 14 LYS HG3 . 14 . HG2 1 1 51 1 1 1 1 13 LYS HE2 . 13 . HE2 1 1 51 1 2 1 1 13 LYS QG . 13 . HG2 1 1 52 1 1 1 1 14 LYS H . 14 . HN 1 1 52 1 2 1 1 14 LYS HA . 14 . HA 1 1 53 1 1 1 1 14 LYS H . 14 . HN 1 1 53 1 2 1 1 14 LYS QB . 14 . HB2 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 2 . . . . . 3.731 1.991 5.471 1 1 1 3 . . . . . 3.731 1.991 5.471 1 1 2 1 . . . . . 3.131 1.8 6.0 1 1 3 1 . . . . . 2.589 1.8 6.0 1 1 4 1 . . . . . 2.11 1.554 2.666 1 1 5 1 . . . . . 2.912 1.852 3.972 1 1 6 1 . . . . . 3.26 1.931 4.589 1 1 7 1 . . . . . 2.807 1.822 3.792 1 1 8 1 . . . . . 2.703 1.79 3.616 1 1 9 1 . . . . . 2.163 1.578 2.748 1 1 10 1 . . . . . 3.766 1.993 5.539 1 1 11 2 . . . . . 2.333 1.652 3.014 1 1 11 3 . . . . . 2.333 1.652 3.014 1 1 12 1 . . . . . 2.223 1.605 2.841 1 1 13 1 . . . . . 2.314 1.645 2.983 1 1 14 1 . . . . . 2.815 1.824 3.806 1 1 15 1 . . . . . 3.109 1.901 4.317 1 1 16 2 . . . . . 2.622 1.763 3.481 1 1 16 3 . . . . . 2.622 1.763 3.481 1 1 17 1 . . . . . 2.391 1.676 3.106 1 1 18 2 . . . . . 2.279 1.63 2.928 1 1 18 3 . . . . . 2.279 1.63 2.928 1 1 19 2 . . . . . 2.857 1.836 3.878 1 1 19 3 . . . . . 2.857 1.836 3.878 1 1 20 1 . . . . . 2.159 1.576 2.742 1 1 21 2 . . . . . 2.232 1.609 2.855 1 1 21 3 . . . . . 2.232 1.609 2.855 1 1 22 2 . . . . . 1.773 1.38 2.166 1 1 22 3 . . . . . 1.773 1.38 2.166 1 1 23 1 . . . . . 2.657 1.774 3.54 1 1 24 1 . . . . . 3.14 1.908 4.372 1 1 25 1 . . . . . 2.303 1.64 2.966 1 1 26 1 . . . . . 2.796 1.819 3.773 1 1 27 1 . . . . . 2.766 1.81 3.722 1 1 28 1 . . . . . 2.392 1.677 3.107 1 1 29 1 . . . . . 2.255 1.62 2.89 1 1 30 1 . . . . . 2.025 1.512 2.538 1 1 31 1 . . . . . 3.074 1.893 4.094 1 1 32 1 . . . . . 3.308 1.983 4.676 1 1 33 1 . . . . . 2.616 1.76 3.472 1 1 34 1 . . . . . 2.83 1.829 3.831 1 1 35 1 . . . . . 2.303 1.64 2.966 1 1 36 1 . . . . . 2.928 1.856 4.0 1 1 37 1 . . . . . 2.738 1.801 3.675 1 1 38 1 . . . . . 2.9 1.849 3.951 1 1 39 1 . . . . . 3.498 1.968 5.028 1 1 40 1 . . . . . 2.331 1.652 3.01 1 1 41 2 . . . . . 4.13 1.998 6.262 1 1 41 3 . . . . . 4.13 1.998 6.262 1 1 42 1 . . . . . 2.327 1.65 3.004 1 1 43 1 . . . . . 2.981 1.87 4.092 1 1 44 1 . . . . . 3.35 1.947 4.753 1 1 45 1 . . . . . 2.228 1.608 2.848 1 1 46 1 . . . . . 2.994 1.874 4.114 1 1 47 1 . . . . . 2.59 1.751 3.429 1 1 48 2 . . . . . 1.945 1.472 2.418 1 1 48 3 . . . . . 1.945 1.472 2.418 1 1 49 1 . . . . . 2.784 1.815 3.753 1 1 50 2 . . . . . 1.708 1.343 2.073 1 1 50 3 . . . . . 1.708 1.343 2.073 1 1 51 1 . . . . . 1.98 1.49 2.47 1 1 52 1 . . . . . 2.427 1.691 3.163 1 1 53 1 . . . . . 2.927 1.856 3.998 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 HIS C C -0.174 -1.108 -4.485 1.00 . A A . 1 HIS C 1 1 1 2 1 1 1 HIS CA C 0.231 -2.498 -4.005 1.00 . A A . 1 HIS CA 1 1 1 3 1 1 1 HIS CB C 1.666 -2.816 -4.456 1.00 . A A . 1 HIS CB 1 1 1 4 1 1 1 HIS CD2 C 2.300 -5.158 -3.511 1.00 . A A . 1 HIS CD2 1 1 1 5 1 1 1 HIS CE1 C 3.757 -4.510 -2.007 1.00 . A A . 1 HIS CE1 1 1 1 6 1 1 1 HIS CG C 2.380 -3.807 -3.581 1.00 . A A . 1 HIS CG 1 1 1 7 1 1 1 HIS H1 H -1.677 -3.314 -4.104 1.00 . A A . 1 HIS H1 1 1 1 8 1 1 1 HIS H2 H -0.440 -4.462 -4.180 1.00 . A A . 1 HIS H2 1 1 1 9 1 1 1 HIS H3 H -0.777 -3.498 -5.526 1.00 . A A . 1 HIS H3 1 1 1 10 1 1 1 HIS HA H 0.194 -2.511 -2.932 1.00 . A A . 1 HIS HA 1 1 1 11 1 1 1 HIS HB2 H 1.639 -3.216 -5.457 1.00 . A A . 1 HIS HB2 1 1 1 12 1 1 1 HIS HB3 H 2.239 -1.901 -4.457 1.00 . A A . 1 HIS HB3 1 1 1 13 1 1 1 HIS HD1 H 3.623 -2.520 -2.458 1.00 . A A . 1 HIS HD1 1 1 1 14 1 1 1 HIS HD2 H 1.673 -5.794 -4.118 1.00 . A A . 1 HIS HD2 1 1 1 15 1 1 1 HIS HE1 H 4.480 -4.518 -1.191 1.00 . A A . 1 HIS HE1 1 1 1 16 1 1 1 HIS HE2 H 3.449 -6.499 -2.372 1.00 . A A . 1 HIS HE2 1 1 1 17 1 1 1 HIS N N -0.729 -3.515 -4.488 1.00 . A A . 1 HIS N 1 1 1 18 1 1 1 HIS ND1 N 3.307 -3.436 -2.626 1.00 . A A . 1 HIS ND1 1 1 1 19 1 1 1 HIS NE2 N 3.164 -5.568 -2.525 1.00 . A A . 1 HIS NE2 1 1 1 20 1 1 1 HIS O O 0.320 -0.629 -5.505 1.00 . A A . 1 HIS O 1 1 1 21 1 1 2 GLN C C -0.607 1.971 -3.918 1.00 . A A . 2 GLN C 1 1 1 22 1 1 2 GLN CA C -1.609 0.835 -4.144 1.00 . A A . 2 GLN CA 1 1 1 23 1 1 2 GLN CB C -2.916 1.139 -3.403 1.00 . A A . 2 GLN CB 1 1 1 24 1 1 2 GLN CD C -4.183 -0.592 -4.759 1.00 . A A . 2 GLN CD 1 1 1 25 1 1 2 GLN CG C -3.898 -0.021 -3.384 1.00 . A A . 2 GLN CG 1 1 1 26 1 1 2 GLN H H -1.399 -0.886 -2.916 1.00 . A A . 2 GLN H 1 1 1 27 1 1 2 GLN HA H -1.822 0.779 -5.199 1.00 . A A . 2 GLN HA 1 1 1 28 1 1 2 GLN HB2 H -2.681 1.398 -2.382 1.00 . A A . 2 GLN HB2 1 1 1 29 1 1 2 GLN HB3 H -3.397 1.982 -3.877 1.00 . A A . 2 GLN HB3 1 1 1 30 1 1 2 GLN HE21 H -4.387 -2.403 -3.967 1.00 . A A . 2 GLN HE21 1 1 1 31 1 1 2 GLN HE22 H -4.596 -2.295 -5.685 1.00 . A A . 2 GLN HE22 1 1 1 32 1 1 2 GLN HG2 H -3.492 -0.807 -2.765 1.00 . A A . 2 GLN HG2 1 1 1 33 1 1 2 GLN HG3 H -4.829 0.324 -2.955 1.00 . A A . 2 GLN HG3 1 1 1 34 1 1 2 GLN N N -1.070 -0.463 -3.742 1.00 . A A . 2 GLN N 1 1 1 35 1 1 2 GLN NE2 N -4.413 -1.893 -4.812 1.00 . A A . 2 GLN NE2 1 1 1 36 1 1 2 GLN O O 0.169 2.305 -4.813 1.00 . A A . 2 GLN O 1 1 1 37 1 1 2 GLN OE1 O -4.178 0.120 -5.762 1.00 . A A . 2 GLN OE1 1 1 1 38 1 1 3 VAL C C 1.141 3.457 -1.210 1.00 . A A . 3 VAL C 1 1 1 39 1 1 3 VAL CA C 0.246 3.710 -2.431 1.00 . A A . 3 VAL CA 1 1 1 40 1 1 3 VAL CB C -0.592 4.990 -2.190 1.00 . A A . 3 VAL CB 1 1 1 41 1 1 3 VAL CG1 C 0.303 6.216 -2.091 1.00 . A A . 3 VAL CG1 1 1 1 42 1 1 3 VAL CG2 C -1.627 5.175 -3.291 1.00 . A A . 3 VAL CG2 1 1 1 43 1 1 3 VAL H H -1.203 2.218 -2.020 1.00 . A A . 3 VAL H 1 1 1 44 1 1 3 VAL HA H 0.874 3.875 -3.292 1.00 . A A . 3 VAL HA 1 1 1 45 1 1 3 VAL HB H -1.115 4.880 -1.252 1.00 . A A . 3 VAL HB 1 1 1 46 1 1 3 VAL HG11 H 0.983 6.098 -1.260 1.00 . A A . 3 VAL HG11 1 1 1 47 1 1 3 VAL HG12 H -0.304 7.095 -1.937 1.00 . A A . 3 VAL HG12 1 1 1 48 1 1 3 VAL HG13 H 0.868 6.324 -3.005 1.00 . A A . 3 VAL HG13 1 1 1 49 1 1 3 VAL HG21 H -2.212 6.059 -3.088 1.00 . A A . 3 VAL HG21 1 1 1 50 1 1 3 VAL HG22 H -2.276 4.313 -3.323 1.00 . A A . 3 VAL HG22 1 1 1 51 1 1 3 VAL HG23 H -1.125 5.284 -4.241 1.00 . A A . 3 VAL HG23 1 1 1 52 1 1 3 VAL N N -0.612 2.558 -2.719 1.00 . A A . 3 VAL N 1 1 1 53 1 1 3 VAL O O 0.900 3.982 -0.121 1.00 . A A . 3 VAL O 1 1 1 54 1 1 4 PRO C C 4.376 3.189 -0.363 1.00 . A A . 4 PRO C 1 1 1 55 1 1 4 PRO CA C 3.136 2.306 -0.314 1.00 . A A . 4 PRO CA 1 1 1 56 1 1 4 PRO CB C 3.551 0.859 -0.641 1.00 . A A . 4 PRO CB 1 1 1 57 1 1 4 PRO CD C 2.405 1.747 -2.508 1.00 . A A . 4 PRO CD 1 1 1 58 1 1 4 PRO CG C 2.687 0.467 -1.794 1.00 . A A . 4 PRO CG 1 1 1 59 1 1 4 PRO HA H 2.699 2.343 0.671 1.00 . A A . 4 PRO HA 1 1 1 60 1 1 4 PRO HB2 H 4.597 0.833 -0.904 1.00 . A A . 4 PRO HB2 1 1 1 61 1 1 4 PRO HB3 H 3.375 0.226 0.217 1.00 . A A . 4 PRO HB3 1 1 1 62 1 1 4 PRO HD2 H 3.265 2.075 -3.075 1.00 . A A . 4 PRO HD2 1 1 1 63 1 1 4 PRO HD3 H 1.529 1.663 -3.133 1.00 . A A . 4 PRO HD3 1 1 1 64 1 1 4 PRO HG2 H 3.200 -0.228 -2.436 1.00 . A A . 4 PRO HG2 1 1 1 65 1 1 4 PRO HG3 H 1.768 0.042 -1.417 1.00 . A A . 4 PRO HG3 1 1 1 66 1 1 4 PRO N N 2.158 2.600 -1.360 1.00 . A A . 4 PRO N 1 1 1 67 1 1 4 PRO O O 4.485 4.111 -1.172 1.00 . A A . 4 PRO O 1 1 1 68 1 1 5 SER C C 7.587 2.309 0.951 1.00 . A A . 5 SER C 1 1 1 69 1 1 5 SER CA C 6.634 3.424 0.534 1.00 . A A . 5 SER CA 1 1 1 70 1 1 5 SER CB C 6.727 4.614 1.491 1.00 . A A . 5 SER CB 1 1 1 71 1 1 5 SER H H 5.051 2.254 1.251 1.00 . A A . 5 SER H 1 1 1 72 1 1 5 SER HA H 6.871 3.742 -0.471 1.00 . A A . 5 SER HA 1 1 1 73 1 1 5 SER HB2 H 7.764 4.880 1.630 1.00 . A A . 5 SER HB2 1 1 1 74 1 1 5 SER HB3 H 6.193 5.454 1.072 1.00 . A A . 5 SER HB3 1 1 1 75 1 1 5 SER HG H 6.872 4.080 3.374 1.00 . A A . 5 SER HG 1 1 1 76 1 1 5 SER N N 5.292 2.878 0.536 1.00 . A A . 5 SER N 1 1 1 77 1 1 5 SER O O 8.590 2.535 1.623 1.00 . A A . 5 SER O 1 1 1 78 1 1 5 SER OG O 6.164 4.297 2.754 1.00 . A A . 5 SER OG 1 1 1 79 1 1 6 GLY C C 7.294 -1.342 0.401 1.00 . A A . 6 GLY C 1 1 1 80 1 1 6 GLY CA C 7.947 -0.091 0.958 1.00 . A A . 6 GLY CA 1 1 1 81 1 1 6 GLY H H 6.479 1.006 -0.076 1.00 . A A . 6 GLY H 1 1 1 82 1 1 6 GLY HA2 H 8.966 -0.033 0.602 1.00 . A A . 6 GLY HA2 1 1 1 83 1 1 6 GLY HA3 H 7.950 -0.144 2.036 1.00 . A A . 6 GLY HA3 1 1 1 84 1 1 6 GLY N N 7.233 1.096 0.542 1.00 . A A . 6 GLY N 1 1 1 85 1 1 6 GLY O O 6.594 -1.268 -0.607 1.00 . A A . 6 GLY O 1 1 1 86 1 1 7 PRO C C 5.500 -4.052 0.859 1.00 . A A . 7 PRO C 1 1 1 87 1 1 7 PRO CA C 6.971 -3.787 0.545 1.00 . A A . 7 PRO CA 1 1 1 88 1 1 7 PRO CB C 7.860 -4.793 1.270 1.00 . A A . 7 PRO CB 1 1 1 89 1 1 7 PRO CD C 8.178 -2.662 2.337 1.00 . A A . 7 PRO CD 1 1 1 90 1 1 7 PRO CG C 8.161 -4.151 2.582 1.00 . A A . 7 PRO CG 1 1 1 91 1 1 7 PRO HA H 7.119 -3.877 -0.521 1.00 . A A . 7 PRO HA 1 1 1 92 1 1 7 PRO HB2 H 7.327 -5.725 1.397 1.00 . A A . 7 PRO HB2 1 1 1 93 1 1 7 PRO HB3 H 8.760 -4.961 0.698 1.00 . A A . 7 PRO HB3 1 1 1 94 1 1 7 PRO HD2 H 7.656 -2.145 3.129 1.00 . A A . 7 PRO HD2 1 1 1 95 1 1 7 PRO HD3 H 9.195 -2.304 2.261 1.00 . A A . 7 PRO HD3 1 1 1 96 1 1 7 PRO HG2 H 7.392 -4.403 3.297 1.00 . A A . 7 PRO HG2 1 1 1 97 1 1 7 PRO HG3 H 9.126 -4.482 2.939 1.00 . A A . 7 PRO HG3 1 1 1 98 1 1 7 PRO N N 7.468 -2.502 1.053 1.00 . A A . 7 PRO N 1 1 1 99 1 1 7 PRO O O 5.015 -5.172 0.676 1.00 . A A . 7 PRO O 1 1 1 100 1 1 8 ASN C C 2.717 -1.803 1.599 1.00 . A A . 8 ASN C 1 1 1 101 1 1 8 ASN CA C 3.363 -3.177 1.576 1.00 . A A . 8 ASN CA 1 1 1 102 1 1 8 ASN CB C 3.128 -3.928 2.893 1.00 . A A . 8 ASN CB 1 1 1 103 1 1 8 ASN CG C 3.625 -3.176 4.119 1.00 . A A . 8 ASN CG 1 1 1 104 1 1 8 ASN H H 5.218 -2.177 1.513 1.00 . A A . 8 ASN H 1 1 1 105 1 1 8 ASN HA H 2.941 -3.749 0.766 1.00 . A A . 8 ASN HA 1 1 1 106 1 1 8 ASN HB2 H 2.071 -4.110 3.011 1.00 . A A . 8 ASN HB2 1 1 1 107 1 1 8 ASN HB3 H 3.645 -4.875 2.836 1.00 . A A . 8 ASN HB3 1 1 1 108 1 1 8 ASN HD21 H 1.802 -2.471 4.470 1.00 . A A . 8 ASN HD21 1 1 1 109 1 1 8 ASN HD22 H 3.028 -1.982 5.590 1.00 . A A . 8 ASN HD22 1 1 1 110 1 1 8 ASN N N 4.783 -3.038 1.323 1.00 . A A . 8 ASN N 1 1 1 111 1 1 8 ASN ND2 N 2.729 -2.471 4.792 1.00 . A A . 8 ASN ND2 1 1 1 112 1 1 8 ASN O O 3.280 -0.863 2.154 1.00 . A A . 8 ASN O 1 1 1 113 1 1 8 ASN OD1 O 4.802 -3.251 4.476 1.00 . A A . 8 ASN OD1 1 1 1 114 1 1 9 PRO C C 0.446 0.124 2.246 1.00 . A A . 9 PRO C 1 1 1 115 1 1 9 PRO CA C 0.845 -0.368 0.879 1.00 . A A . 9 PRO CA 1 1 1 116 1 1 9 PRO CB C -0.383 -0.675 0.022 1.00 . A A . 9 PRO CB 1 1 1 117 1 1 9 PRO CD C 0.847 -2.687 0.182 1.00 . A A . 9 PRO CD 1 1 1 118 1 1 9 PRO CG C 0.039 -1.857 -0.766 1.00 . A A . 9 PRO CG 1 1 1 119 1 1 9 PRO HA H 1.441 0.389 0.398 1.00 . A A . 9 PRO HA 1 1 1 120 1 1 9 PRO HB2 H -1.229 -0.892 0.653 1.00 . A A . 9 PRO HB2 1 1 1 121 1 1 9 PRO HB3 H -0.604 0.168 -0.617 1.00 . A A . 9 PRO HB3 1 1 1 122 1 1 9 PRO HD2 H 0.202 -3.273 0.821 1.00 . A A . 9 PRO HD2 1 1 1 123 1 1 9 PRO HD3 H 1.536 -3.317 -0.357 1.00 . A A . 9 PRO HD3 1 1 1 124 1 1 9 PRO HG2 H -0.821 -2.403 -1.120 1.00 . A A . 9 PRO HG2 1 1 1 125 1 1 9 PRO HG3 H 0.653 -1.534 -1.590 1.00 . A A . 9 PRO HG3 1 1 1 126 1 1 9 PRO N N 1.558 -1.648 0.940 1.00 . A A . 9 PRO N 1 1 1 127 1 1 9 PRO O O -0.305 -0.532 2.964 1.00 . A A . 9 PRO O 1 1 1 128 1 1 10 LEU C C -0.624 2.606 3.923 1.00 . A A . 10 LEU C 1 1 1 129 1 1 10 LEU CA C 0.703 1.856 3.911 1.00 . A A . 10 LEU CA 1 1 1 130 1 1 10 LEU CB C 1.831 2.801 4.357 1.00 . A A . 10 LEU CB 1 1 1 131 1 1 10 LEU CD1 C 2.993 0.911 5.542 1.00 . A A . 10 LEU CD1 1 1 1 132 1 1 10 LEU CD2 C 3.954 1.824 3.419 1.00 . A A . 10 LEU CD2 1 1 1 133 1 1 10 LEU CG C 3.182 2.150 4.685 1.00 . A A . 10 LEU CG 1 1 1 134 1 1 10 LEU H H 1.517 1.774 1.951 1.00 . A A . 10 LEU H 1 1 1 135 1 1 10 LEU HA H 0.644 1.030 4.596 1.00 . A A . 10 LEU HA 1 1 1 136 1 1 10 LEU HB2 H 1.993 3.521 3.570 1.00 . A A . 10 LEU HB2 1 1 1 137 1 1 10 LEU HB3 H 1.493 3.331 5.236 1.00 . A A . 10 LEU HB3 1 1 1 138 1 1 10 LEU HD11 H 2.435 0.170 4.990 1.00 . A A . 10 LEU HD11 1 1 1 139 1 1 10 LEU HD12 H 2.453 1.172 6.439 1.00 . A A . 10 LEU HD12 1 1 1 140 1 1 10 LEU HD13 H 3.959 0.508 5.809 1.00 . A A . 10 LEU HD13 1 1 1 141 1 1 10 LEU HD21 H 4.142 2.733 2.868 1.00 . A A . 10 LEU HD21 1 1 1 142 1 1 10 LEU HD22 H 3.376 1.146 2.808 1.00 . A A . 10 LEU HD22 1 1 1 143 1 1 10 LEU HD23 H 4.895 1.362 3.680 1.00 . A A . 10 LEU HD23 1 1 1 144 1 1 10 LEU HG H 3.771 2.851 5.257 1.00 . A A . 10 LEU HG 1 1 1 145 1 1 10 LEU N N 0.958 1.288 2.596 1.00 . A A . 10 LEU N 1 1 1 146 1 1 10 LEU O O -1.010 3.209 4.924 1.00 . A A . 10 LEU O 1 1 1 147 1 1 11 HIS C C -3.327 2.600 1.469 1.00 . A A . 11 HIS C 1 1 1 148 1 1 11 HIS CA C -2.570 3.250 2.614 1.00 . A A . 11 HIS CA 1 1 1 149 1 1 11 HIS CB C -2.304 4.737 2.324 1.00 . A A . 11 HIS CB 1 1 1 150 1 1 11 HIS CD2 C -4.380 6.061 1.484 1.00 . A A . 11 HIS CD2 1 1 1 151 1 1 11 HIS CE1 C -4.979 6.954 3.388 1.00 . A A . 11 HIS CE1 1 1 1 152 1 1 11 HIS CG C -3.509 5.627 2.427 1.00 . A A . 11 HIS CG 1 1 1 153 1 1 11 HIS H H -0.968 1.993 2.073 1.00 . A A . 11 HIS H 1 1 1 154 1 1 11 HIS HA H -3.155 3.151 3.517 1.00 . A A . 11 HIS HA 1 1 1 155 1 1 11 HIS HB2 H -1.569 5.103 3.026 1.00 . A A . 11 HIS HB2 1 1 1 156 1 1 11 HIS HB3 H -1.908 4.831 1.322 1.00 . A A . 11 HIS HB3 1 1 1 157 1 1 11 HIS HD1 H -3.478 6.091 4.483 1.00 . A A . 11 HIS HD1 1 1 1 158 1 1 11 HIS HD2 H -4.366 5.804 0.434 1.00 . A A . 11 HIS HD2 1 1 1 159 1 1 11 HIS HE1 H -5.512 7.528 4.131 1.00 . A A . 11 HIS HE1 1 1 1 160 1 1 11 HIS HE2 H -5.912 7.486 1.646 1.00 . A A . 11 HIS HE2 1 1 1 161 1 1 11 HIS N N -1.313 2.547 2.800 1.00 . A A . 11 HIS N 1 1 1 162 1 1 11 HIS ND1 N -3.914 6.206 3.609 1.00 . A A . 11 HIS ND1 1 1 1 163 1 1 11 HIS NE2 N -5.283 6.884 2.107 1.00 . A A . 11 HIS NE2 1 1 1 164 1 1 11 HIS O O -2.715 1.958 0.611 1.00 . A A . 11 HIS O 1 1 1 165 1 1 12 ASN C C -5.551 0.615 0.710 1.00 . A A . 12 ASN C 1 1 1 166 1 1 12 ASN CA C -5.532 2.123 0.497 1.00 . A A . 12 ASN CA 1 1 1 167 1 1 12 ASN CB C -5.113 2.444 -0.945 1.00 . A A . 12 ASN CB 1 1 1 168 1 1 12 ASN CG C -5.079 3.932 -1.236 1.00 . A A . 12 ASN CG 1 1 1 169 1 1 12 ASN H H -5.056 3.303 2.186 1.00 . A A . 12 ASN H 1 1 1 170 1 1 12 ASN HA H -6.529 2.503 0.664 1.00 . A A . 12 ASN HA 1 1 1 171 1 1 12 ASN HB2 H -4.126 2.046 -1.119 1.00 . A A . 12 ASN HB2 1 1 1 172 1 1 12 ASN HB3 H -5.808 1.978 -1.626 1.00 . A A . 12 ASN HB3 1 1 1 173 1 1 12 ASN HD21 H -6.997 3.907 -1.744 1.00 . A A . 12 ASN HD21 1 1 1 174 1 1 12 ASN HD22 H -6.207 5.443 -1.851 1.00 . A A . 12 ASN HD22 1 1 1 175 1 1 12 ASN N N -4.651 2.753 1.481 1.00 . A A . 12 ASN N 1 1 1 176 1 1 12 ASN ND2 N -6.207 4.482 -1.649 1.00 . A A . 12 ASN ND2 1 1 1 177 1 1 12 ASN O O -5.873 -0.150 -0.202 1.00 . A A . 12 ASN O 1 1 1 178 1 1 12 ASN OD1 O -4.046 4.580 -1.084 1.00 . A A . 12 ASN OD1 1 1 1 179 1 1 13 LYS C C -4.046 -1.972 1.680 1.00 . A A . 13 LYS C 1 1 1 180 1 1 13 LYS CA C -5.184 -1.193 2.344 1.00 . A A . 13 LYS CA 1 1 1 181 1 1 13 LYS CB C -6.535 -1.864 2.058 1.00 . A A . 13 LYS CB 1 1 1 182 1 1 13 LYS CD C -7.917 -3.968 2.130 1.00 . A A . 13 LYS CD 1 1 1 183 1 1 13 LYS CE C -9.123 -3.312 2.785 1.00 . A A . 13 LYS CE 1 1 1 184 1 1 13 LYS CG C -6.616 -3.305 2.545 1.00 . A A . 13 LYS CG 1 1 1 185 1 1 13 LYS H H -4.885 0.892 2.576 1.00 . A A . 13 LYS H 1 1 1 186 1 1 13 LYS HA H -5.019 -1.207 3.411 1.00 . A A . 13 LYS HA 1 1 1 187 1 1 13 LYS HB2 H -7.315 -1.299 2.546 1.00 . A A . 13 LYS HB2 1 1 1 188 1 1 13 LYS HB3 H -6.710 -1.856 0.992 1.00 . A A . 13 LYS HB3 1 1 1 189 1 1 13 LYS HD2 H -8.020 -3.897 1.059 1.00 . A A . 13 LYS HD2 1 1 1 190 1 1 13 LYS HD3 H -7.882 -5.007 2.421 1.00 . A A . 13 LYS HD3 1 1 1 191 1 1 13 LYS HE2 H -9.026 -3.398 3.857 1.00 . A A . 13 LYS HE2 1 1 1 192 1 1 13 LYS HE3 H -9.144 -2.269 2.509 1.00 . A A . 13 LYS HE3 1 1 1 193 1 1 13 LYS HG2 H -5.792 -3.862 2.127 1.00 . A A . 13 LYS HG2 1 1 1 194 1 1 13 LYS HG3 H -6.548 -3.314 3.621 1.00 . A A . 13 LYS HG3 1 1 1 195 1 1 13 LYS HZ1 H -11.202 -3.509 2.850 1.00 . A A . 13 LYS HZ1 1 1 1 196 1 1 13 LYS HZ2 H -10.386 -4.964 2.592 1.00 . A A . 13 LYS HZ2 1 1 1 197 1 1 13 LYS HZ3 H -10.529 -3.842 1.334 1.00 . A A . 13 LYS HZ3 1 1 1 198 1 1 13 LYS N N -5.186 0.211 1.929 1.00 . A A . 13 LYS N 1 1 1 199 1 1 13 LYS NZ N -10.398 -3.951 2.362 1.00 . A A . 13 LYS NZ 1 1 1 200 1 1 13 LYS O O -3.011 -2.214 2.306 1.00 . A A . 13 LYS O 1 1 1 201 1 1 14 LYS C C -3.392 -3.006 -1.798 1.00 . A A . 14 LYS C 1 1 1 202 1 1 14 LYS CA C -3.223 -3.143 -0.286 1.00 . A A . 14 LYS CA 1 1 1 203 1 1 14 LYS CB C -3.285 -4.618 0.133 1.00 . A A . 14 LYS CB 1 1 1 204 1 1 14 LYS CD C -4.556 -6.780 0.159 1.00 . A A . 14 LYS CD 1 1 1 205 1 1 14 LYS CE C -5.803 -7.502 -0.319 1.00 . A A . 14 LYS CE 1 1 1 206 1 1 14 LYS CG C -4.598 -5.308 -0.198 1.00 . A A . 14 LYS CG 1 1 1 207 1 1 14 LYS H H -5.039 -2.081 -0.057 1.00 . A A . 14 LYS H 1 1 1 208 1 1 14 LYS HA H -2.258 -2.748 -0.014 1.00 . A A . 14 LYS HA 1 1 1 209 1 1 14 LYS HB2 H -2.489 -5.153 -0.364 1.00 . A A . 14 LYS HB2 1 1 1 210 1 1 14 LYS HB3 H -3.132 -4.680 1.201 1.00 . A A . 14 LYS HB3 1 1 1 211 1 1 14 LYS HD2 H -3.691 -7.231 -0.303 1.00 . A A . 14 LYS HD2 1 1 1 212 1 1 14 LYS HD3 H -4.485 -6.874 1.231 1.00 . A A . 14 LYS HD3 1 1 1 213 1 1 14 LYS HE2 H -5.757 -8.530 0.009 1.00 . A A . 14 LYS HE2 1 1 1 214 1 1 14 LYS HE3 H -6.670 -7.026 0.117 1.00 . A A . 14 LYS HE3 1 1 1 215 1 1 14 LYS HG2 H -5.390 -4.839 0.363 1.00 . A A . 14 LYS HG2 1 1 1 216 1 1 14 LYS HG3 H -4.792 -5.207 -1.254 1.00 . A A . 14 LYS HG3 1 1 1 217 1 1 14 LYS HZ1 H -5.967 -6.491 -2.141 1.00 . A A . 14 LYS HZ1 1 1 1 218 1 1 14 LYS HZ2 H -6.795 -7.962 -2.099 1.00 . A A . 14 LYS HZ2 1 1 1 219 1 1 14 LYS HZ3 H -5.112 -7.943 -2.238 1.00 . A A . 14 LYS HZ3 1 1 1 220 1 1 14 LYS N N -4.224 -2.353 0.419 1.00 . A A . 14 LYS N 1 1 1 221 1 1 14 LYS NZ N -5.928 -7.471 -1.802 1.00 . A A . 14 LYS NZ 1 1 1 222 1 1 14 LYS O O -2.417 -2.625 -2.474 1.00 . A A . 14 LYS O 1 1 1 223 1 1 14 LYS OXT O -4.510 -3.252 -2.303 1.00 . A A . 14 LYS OXT 1 1 2 224 1 1 1 HIS C C 0.685 -1.404 -5.204 1.00 . A A . 1 HIS C 1 1 2 225 1 1 1 HIS CA C 1.302 -2.634 -4.547 1.00 . A A . 1 HIS CA 1 1 2 226 1 1 1 HIS CB C 1.873 -2.236 -3.176 1.00 . A A . 1 HIS CB 1 1 2 227 1 1 1 HIS CD2 C 4.093 -3.530 -2.771 1.00 . A A . 1 HIS CD2 1 1 2 228 1 1 1 HIS CE1 C 3.477 -4.696 -1.026 1.00 . A A . 1 HIS CE1 1 1 2 229 1 1 1 HIS CG C 2.792 -3.237 -2.531 1.00 . A A . 1 HIS CG 1 1 2 230 1 1 1 HIS H1 H 1.963 -3.371 -6.377 1.00 . A A . 1 HIS H1 1 1 2 231 1 1 1 HIS H2 H 2.740 -4.060 -5.048 1.00 . A A . 1 HIS H2 1 1 2 232 1 1 1 HIS H3 H 3.135 -2.488 -5.538 1.00 . A A . 1 HIS H3 1 1 2 233 1 1 1 HIS HA H 0.540 -3.387 -4.416 1.00 . A A . 1 HIS HA 1 1 2 234 1 1 1 HIS HB2 H 2.426 -1.318 -3.287 1.00 . A A . 1 HIS HB2 1 1 2 235 1 1 1 HIS HB3 H 1.050 -2.065 -2.499 1.00 . A A . 1 HIS HB3 1 1 2 236 1 1 1 HIS HD1 H 1.538 -4.038 -1.035 1.00 . A A . 1 HIS HD1 1 1 2 237 1 1 1 HIS HD2 H 4.702 -3.124 -3.565 1.00 . A A . 1 HIS HD2 1 1 2 238 1 1 1 HIS HE1 H 3.517 -5.307 -0.133 1.00 . A A . 1 HIS HE1 1 1 2 239 1 1 1 HIS HE2 H 5.431 -4.677 -1.632 1.00 . A A . 1 HIS HE2 1 1 2 240 1 1 1 HIS N N 2.359 -3.176 -5.436 1.00 . A A . 1 HIS N 1 1 2 241 1 1 1 HIS ND1 N 2.433 -3.996 -1.437 1.00 . A A . 1 HIS ND1 1 1 2 242 1 1 1 HIS NE2 N 4.494 -4.436 -1.824 1.00 . A A . 1 HIS NE2 1 1 2 243 1 1 1 HIS O O 1.065 -1.052 -6.319 1.00 . A A . 1 HIS O 1 1 2 244 1 1 2 GLN C C 0.158 1.628 -5.038 1.00 . A A . 2 GLN C 1 1 2 245 1 1 2 GLN CA C -0.855 0.477 -5.063 1.00 . A A . 2 GLN CA 1 1 2 246 1 1 2 GLN CB C -2.132 0.855 -4.303 1.00 . A A . 2 GLN CB 1 1 2 247 1 1 2 GLN CD C -3.401 1.804 -6.282 1.00 . A A . 2 GLN CD 1 1 2 248 1 1 2 GLN CG C -2.869 2.056 -4.884 1.00 . A A . 2 GLN CG 1 1 2 249 1 1 2 GLN H H -0.589 -1.109 -3.677 1.00 . A A . 2 GLN H 1 1 2 250 1 1 2 GLN HA H -1.116 0.283 -6.092 1.00 . A A . 2 GLN HA 1 1 2 251 1 1 2 GLN HB2 H -2.804 0.011 -4.313 1.00 . A A . 2 GLN HB2 1 1 2 252 1 1 2 GLN HB3 H -1.873 1.081 -3.281 1.00 . A A . 2 GLN HB3 1 1 2 253 1 1 2 GLN HE21 H -1.722 2.495 -7.093 1.00 . A A . 2 GLN HE21 1 1 2 254 1 1 2 GLN HE22 H -2.933 1.964 -8.205 1.00 . A A . 2 GLN HE22 1 1 2 255 1 1 2 GLN HG2 H -3.702 2.294 -4.239 1.00 . A A . 2 GLN HG2 1 1 2 256 1 1 2 GLN HG3 H -2.191 2.895 -4.916 1.00 . A A . 2 GLN HG3 1 1 2 257 1 1 2 GLN N N -0.264 -0.750 -4.529 1.00 . A A . 2 GLN N 1 1 2 258 1 1 2 GLN NE2 N -2.606 2.119 -7.294 1.00 . A A . 2 GLN NE2 1 1 2 259 1 1 2 GLN O O 0.917 1.801 -5.991 1.00 . A A . 2 GLN O 1 1 2 260 1 1 2 GLN OE1 O -4.526 1.336 -6.454 1.00 . A A . 2 GLN OE1 1 1 2 261 1 1 3 VAL C C 1.692 3.596 -2.390 1.00 . A A . 3 VAL C 1 1 2 262 1 1 3 VAL CA C 1.159 3.497 -3.826 1.00 . A A . 3 VAL CA 1 1 2 263 1 1 3 VAL CB C 0.574 4.873 -4.249 1.00 . A A . 3 VAL CB 1 1 2 264 1 1 3 VAL CG1 C 1.643 5.954 -4.186 1.00 . A A . 3 VAL CG1 1 1 2 265 1 1 3 VAL CG2 C -0.022 4.817 -5.648 1.00 . A A . 3 VAL CG2 1 1 2 266 1 1 3 VAL H H -0.465 2.266 -3.239 1.00 . A A . 3 VAL H 1 1 2 267 1 1 3 VAL HA H 1.985 3.268 -4.483 1.00 . A A . 3 VAL HA 1 1 2 268 1 1 3 VAL HB H -0.212 5.134 -3.555 1.00 . A A . 3 VAL HB 1 1 2 269 1 1 3 VAL HG11 H 1.211 6.904 -4.465 1.00 . A A . 3 VAL HG11 1 1 2 270 1 1 3 VAL HG12 H 2.444 5.709 -4.867 1.00 . A A . 3 VAL HG12 1 1 2 271 1 1 3 VAL HG13 H 2.032 6.018 -3.181 1.00 . A A . 3 VAL HG13 1 1 2 272 1 1 3 VAL HG21 H -0.409 5.788 -5.913 1.00 . A A . 3 VAL HG21 1 1 2 273 1 1 3 VAL HG22 H -0.821 4.092 -5.672 1.00 . A A . 3 VAL HG22 1 1 2 274 1 1 3 VAL HG23 H 0.744 4.530 -6.354 1.00 . A A . 3 VAL HG23 1 1 2 275 1 1 3 VAL N N 0.185 2.411 -3.957 1.00 . A A . 3 VAL N 1 1 2 276 1 1 3 VAL O O 1.311 4.487 -1.625 1.00 . A A . 3 VAL O 1 1 2 277 1 1 4 PRO C C 4.645 3.273 -0.822 1.00 . A A . 4 PRO C 1 1 2 278 1 1 4 PRO CA C 3.246 2.686 -0.709 1.00 . A A . 4 PRO CA 1 1 2 279 1 1 4 PRO CB C 3.358 1.205 -0.352 1.00 . A A . 4 PRO CB 1 1 2 280 1 1 4 PRO CD C 2.929 1.454 -2.726 1.00 . A A . 4 PRO CD 1 1 2 281 1 1 4 PRO CG C 3.092 0.445 -1.617 1.00 . A A . 4 PRO CG 1 1 2 282 1 1 4 PRO HA H 2.680 3.207 0.049 1.00 . A A . 4 PRO HA 1 1 2 283 1 1 4 PRO HB2 H 4.352 1.002 0.021 1.00 . A A . 4 PRO HB2 1 1 2 284 1 1 4 PRO HB3 H 2.634 0.963 0.411 1.00 . A A . 4 PRO HB3 1 1 2 285 1 1 4 PRO HD2 H 3.860 1.593 -3.254 1.00 . A A . 4 PRO HD2 1 1 2 286 1 1 4 PRO HD3 H 2.142 1.156 -3.401 1.00 . A A . 4 PRO HD3 1 1 2 287 1 1 4 PRO HG2 H 3.922 -0.210 -1.832 1.00 . A A . 4 PRO HG2 1 1 2 288 1 1 4 PRO HG3 H 2.185 -0.130 -1.501 1.00 . A A . 4 PRO HG3 1 1 2 289 1 1 4 PRO N N 2.560 2.656 -1.991 1.00 . A A . 4 PRO N 1 1 2 290 1 1 4 PRO O O 5.024 3.823 -1.855 1.00 . A A . 4 PRO O 1 1 2 291 1 1 5 SER C C 7.640 2.297 0.648 1.00 . A A . 5 SER C 1 1 2 292 1 1 5 SER CA C 6.805 3.512 0.250 1.00 . A A . 5 SER CA 1 1 2 293 1 1 5 SER CB C 7.039 4.675 1.214 1.00 . A A . 5 SER CB 1 1 2 294 1 1 5 SER H H 5.009 2.783 1.073 1.00 . A A . 5 SER H 1 1 2 295 1 1 5 SER HA H 7.074 3.815 -0.751 1.00 . A A . 5 SER HA 1 1 2 296 1 1 5 SER HB2 H 6.851 4.346 2.225 1.00 . A A . 5 SER HB2 1 1 2 297 1 1 5 SER HB3 H 8.062 5.012 1.128 1.00 . A A . 5 SER HB3 1 1 2 298 1 1 5 SER HG H 5.344 5.419 0.558 1.00 . A A . 5 SER HG 1 1 2 299 1 1 5 SER N N 5.404 3.144 0.248 1.00 . A A . 5 SER N 1 1 2 300 1 1 5 SER O O 8.725 2.422 1.220 1.00 . A A . 5 SER O 1 1 2 301 1 1 5 SER OG O 6.173 5.761 0.916 1.00 . A A . 5 SER OG 1 1 2 302 1 1 6 GLY C C 6.786 -1.302 0.552 1.00 . A A . 6 GLY C 1 1 2 303 1 1 6 GLY CA C 7.739 -0.128 0.700 1.00 . A A . 6 GLY CA 1 1 2 304 1 1 6 GLY H H 6.274 1.101 -0.181 1.00 . A A . 6 GLY H 1 1 2 305 1 1 6 GLY HA2 H 8.601 -0.292 0.073 1.00 . A A . 6 GLY HA2 1 1 2 306 1 1 6 GLY HA3 H 8.060 -0.065 1.728 1.00 . A A . 6 GLY HA3 1 1 2 307 1 1 6 GLY N N 7.109 1.120 0.327 1.00 . A A . 6 GLY N 1 1 2 308 1 1 6 GLY O O 6.381 -1.629 -0.562 1.00 . A A . 6 GLY O 1 1 2 309 1 1 7 PRO C C 4.025 -2.593 1.270 1.00 . A A . 7 PRO C 1 1 2 310 1 1 7 PRO CA C 5.425 -3.047 1.694 1.00 . A A . 7 PRO CA 1 1 2 311 1 1 7 PRO CB C 5.427 -3.488 3.167 1.00 . A A . 7 PRO CB 1 1 2 312 1 1 7 PRO CD C 6.992 -1.708 2.999 1.00 . A A . 7 PRO CD 1 1 2 313 1 1 7 PRO CG C 6.715 -2.991 3.721 1.00 . A A . 7 PRO CG 1 1 2 314 1 1 7 PRO HA H 5.720 -3.880 1.066 1.00 . A A . 7 PRO HA 1 1 2 315 1 1 7 PRO HB2 H 4.585 -3.048 3.678 1.00 . A A . 7 PRO HB2 1 1 2 316 1 1 7 PRO HB3 H 5.366 -4.565 3.223 1.00 . A A . 7 PRO HB3 1 1 2 317 1 1 7 PRO HD2 H 6.496 -0.883 3.486 1.00 . A A . 7 PRO HD2 1 1 2 318 1 1 7 PRO HD3 H 8.056 -1.531 2.935 1.00 . A A . 7 PRO HD3 1 1 2 319 1 1 7 PRO HG2 H 6.615 -2.813 4.782 1.00 . A A . 7 PRO HG2 1 1 2 320 1 1 7 PRO HG3 H 7.501 -3.707 3.531 1.00 . A A . 7 PRO HG3 1 1 2 321 1 1 7 PRO N N 6.422 -1.957 1.668 1.00 . A A . 7 PRO N 1 1 2 322 1 1 7 PRO O O 3.864 -1.905 0.264 1.00 . A A . 7 PRO O 1 1 2 323 1 1 8 ASN C C 1.353 -1.286 1.418 1.00 . A A . 8 ASN C 1 1 2 324 1 1 8 ASN CA C 1.614 -2.774 1.651 1.00 . A A . 8 ASN CA 1 1 2 325 1 1 8 ASN CB C 0.677 -3.348 2.725 1.00 . A A . 8 ASN CB 1 1 2 326 1 1 8 ASN CG C 0.634 -2.557 4.033 1.00 . A A . 8 ASN CG 1 1 2 327 1 1 8 ASN H H 3.201 -3.479 2.859 1.00 . A A . 8 ASN H 1 1 2 328 1 1 8 ASN HA H 1.438 -3.299 0.724 1.00 . A A . 8 ASN HA 1 1 2 329 1 1 8 ASN HB2 H -0.325 -3.384 2.327 1.00 . A A . 8 ASN HB2 1 1 2 330 1 1 8 ASN HB3 H 1.001 -4.356 2.949 1.00 . A A . 8 ASN HB3 1 1 2 331 1 1 8 ASN HD21 H 2.482 -1.873 3.771 1.00 . A A . 8 ASN HD21 1 1 2 332 1 1 8 ASN HD22 H 1.686 -1.357 5.216 1.00 . A A . 8 ASN HD22 1 1 2 333 1 1 8 ASN N N 3.009 -3.009 2.024 1.00 . A A . 8 ASN N 1 1 2 334 1 1 8 ASN ND2 N 1.709 -1.860 4.372 1.00 . A A . 8 ASN ND2 1 1 2 335 1 1 8 ASN O O 2.085 -0.451 1.942 1.00 . A A . 8 ASN O 1 1 2 336 1 1 8 ASN OD1 O -0.376 -2.568 4.734 1.00 . A A . 8 ASN OD1 1 1 2 337 1 1 9 PRO C C -0.247 1.388 1.331 1.00 . A A . 9 PRO C 1 1 2 338 1 1 9 PRO CA C 0.031 0.435 0.174 1.00 . A A . 9 PRO CA 1 1 2 339 1 1 9 PRO CB C -1.212 0.294 -0.705 1.00 . A A . 9 PRO CB 1 1 2 340 1 1 9 PRO CD C -0.650 -1.899 0.038 1.00 . A A . 9 PRO CD 1 1 2 341 1 1 9 PRO CG C -1.248 -1.136 -1.106 1.00 . A A . 9 PRO CG 1 1 2 342 1 1 9 PRO HA H 0.840 0.836 -0.418 1.00 . A A . 9 PRO HA 1 1 2 343 1 1 9 PRO HB2 H -2.088 0.566 -0.139 1.00 . A A . 9 PRO HB2 1 1 2 344 1 1 9 PRO HB3 H -1.119 0.939 -1.563 1.00 . A A . 9 PRO HB3 1 1 2 345 1 1 9 PRO HD2 H -1.410 -2.151 0.763 1.00 . A A . 9 PRO HD2 1 1 2 346 1 1 9 PRO HD3 H -0.156 -2.790 -0.320 1.00 . A A . 9 PRO HD3 1 1 2 347 1 1 9 PRO HG2 H -2.268 -1.447 -1.270 1.00 . A A . 9 PRO HG2 1 1 2 348 1 1 9 PRO HG3 H -0.662 -1.283 -1.999 1.00 . A A . 9 PRO HG3 1 1 2 349 1 1 9 PRO N N 0.322 -0.950 0.605 1.00 . A A . 9 PRO N 1 1 2 350 1 1 9 PRO O O -1.387 1.800 1.555 1.00 . A A . 9 PRO O 1 1 2 351 1 1 10 LEU C C -0.308 2.207 4.211 1.00 . A A . 10 LEU C 1 1 2 352 1 1 10 LEU CA C 0.784 2.612 3.210 1.00 . A A . 10 LEU CA 1 1 2 353 1 1 10 LEU CB C 0.585 4.055 2.733 1.00 . A A . 10 LEU CB 1 1 2 354 1 1 10 LEU CD1 C 2.306 5.194 4.150 1.00 . A A . 10 LEU CD1 1 1 2 355 1 1 10 LEU CD2 C 0.351 6.486 3.283 1.00 . A A . 10 LEU CD2 1 1 2 356 1 1 10 LEU CG C 0.833 5.136 3.784 1.00 . A A . 10 LEU CG 1 1 2 357 1 1 10 LEU H H 1.681 1.305 1.812 1.00 . A A . 10 LEU H 1 1 2 358 1 1 10 LEU HA H 1.743 2.531 3.700 1.00 . A A . 10 LEU HA 1 1 2 359 1 1 10 LEU HB2 H 1.254 4.231 1.904 1.00 . A A . 10 LEU HB2 1 1 2 360 1 1 10 LEU HB3 H -0.429 4.156 2.379 1.00 . A A . 10 LEU HB3 1 1 2 361 1 1 10 LEU HD11 H 2.889 5.405 3.266 1.00 . A A . 10 LEU HD11 1 1 2 362 1 1 10 LEU HD12 H 2.612 4.246 4.565 1.00 . A A . 10 LEU HD12 1 1 2 363 1 1 10 LEU HD13 H 2.464 5.974 4.879 1.00 . A A . 10 LEU HD13 1 1 2 364 1 1 10 LEU HD21 H 0.525 7.234 4.041 1.00 . A A . 10 LEU HD21 1 1 2 365 1 1 10 LEU HD22 H -0.705 6.434 3.063 1.00 . A A . 10 LEU HD22 1 1 2 366 1 1 10 LEU HD23 H 0.892 6.750 2.386 1.00 . A A . 10 LEU HD23 1 1 2 367 1 1 10 LEU HG H 0.278 4.892 4.677 1.00 . A A . 10 LEU HG 1 1 2 368 1 1 10 LEU N N 0.818 1.711 2.060 1.00 . A A . 10 LEU N 1 1 2 369 1 1 10 LEU O O -0.766 3.017 5.019 1.00 . A A . 10 LEU O 1 1 2 370 1 1 11 HIS C C -3.031 1.221 4.981 1.00 . A A . 11 HIS C 1 1 2 371 1 1 11 HIS CA C -1.756 0.371 4.983 1.00 . A A . 11 HIS CA 1 1 2 372 1 1 11 HIS CB C -1.247 0.150 6.414 1.00 . A A . 11 HIS CB 1 1 2 373 1 1 11 HIS CD2 C -2.973 -0.591 8.212 1.00 . A A . 11 HIS CD2 1 1 2 374 1 1 11 HIS CE1 C -2.905 -2.747 7.848 1.00 . A A . 11 HIS CE1 1 1 2 375 1 1 11 HIS CG C -2.085 -0.805 7.212 1.00 . A A . 11 HIS CG 1 1 2 376 1 1 11 HIS H H -0.275 0.360 3.481 1.00 . A A . 11 HIS H 1 1 2 377 1 1 11 HIS HA H -2.011 -0.588 4.557 1.00 . A A . 11 HIS HA 1 1 2 378 1 1 11 HIS HB2 H -0.243 -0.245 6.372 1.00 . A A . 11 HIS HB2 1 1 2 379 1 1 11 HIS HB3 H -1.234 1.098 6.932 1.00 . A A . 11 HIS HB3 1 1 2 380 1 1 11 HIS HD1 H -1.521 -2.643 6.338 1.00 . A A . 11 HIS HD1 1 1 2 381 1 1 11 HIS HD2 H -3.244 0.367 8.634 1.00 . A A . 11 HIS HD2 1 1 2 382 1 1 11 HIS HE1 H -3.096 -3.808 7.918 1.00 . A A . 11 HIS HE1 1 1 2 383 1 1 11 HIS HE2 H -4.016 -1.984 9.386 1.00 . A A . 11 HIS HE2 1 1 2 384 1 1 11 HIS N N -0.709 0.942 4.138 1.00 . A A . 11 HIS N 1 1 2 385 1 1 11 HIS ND1 N -2.067 -2.168 7.009 1.00 . A A . 11 HIS ND1 1 1 2 386 1 1 11 HIS NE2 N -3.467 -1.814 8.588 1.00 . A A . 11 HIS NE2 1 1 2 387 1 1 11 HIS O O -3.736 1.314 5.983 1.00 . A A . 11 HIS O 1 1 2 388 1 1 12 ASN C C -5.327 1.717 2.538 1.00 . A A . 12 ASN C 1 1 2 389 1 1 12 ASN CA C -4.618 2.467 3.648 1.00 . A A . 12 ASN CA 1 1 2 390 1 1 12 ASN CB C -4.506 3.963 3.310 1.00 . A A . 12 ASN CB 1 1 2 391 1 1 12 ASN CG C -3.797 4.240 1.995 1.00 . A A . 12 ASN CG 1 1 2 392 1 1 12 ASN H H -2.633 1.910 3.147 1.00 . A A . 12 ASN H 1 1 2 393 1 1 12 ASN HA H -5.186 2.350 4.561 1.00 . A A . 12 ASN HA 1 1 2 394 1 1 12 ASN HB2 H -5.498 4.383 3.251 1.00 . A A . 12 ASN HB2 1 1 2 395 1 1 12 ASN HB3 H -3.961 4.460 4.101 1.00 . A A . 12 ASN HB3 1 1 2 396 1 1 12 ASN HD21 H -2.080 4.488 2.950 1.00 . A A . 12 ASN HD21 1 1 2 397 1 1 12 ASN HD22 H -2.018 4.672 1.232 1.00 . A A . 12 ASN HD22 1 1 2 398 1 1 12 ASN N N -3.315 1.851 3.855 1.00 . A A . 12 ASN N 1 1 2 399 1 1 12 ASN ND2 N -2.503 4.493 2.068 1.00 . A A . 12 ASN ND2 1 1 2 400 1 1 12 ASN O O -6.477 1.997 2.203 1.00 . A A . 12 ASN O 1 1 2 401 1 1 12 ASN OD1 O -4.414 4.259 0.929 1.00 . A A . 12 ASN OD1 1 1 2 402 1 1 13 LYS C C -4.293 -1.389 0.886 1.00 . A A . 13 LYS C 1 1 2 403 1 1 13 LYS CA C -5.091 -0.096 0.904 1.00 . A A . 13 LYS CA 1 1 2 404 1 1 13 LYS CB C -4.932 0.619 -0.447 1.00 . A A . 13 LYS CB 1 1 2 405 1 1 13 LYS CD C -7.361 0.998 -0.953 1.00 . A A . 13 LYS CD 1 1 2 406 1 1 13 LYS CE C -8.447 2.034 -1.175 1.00 . A A . 13 LYS CE 1 1 2 407 1 1 13 LYS CG C -6.008 1.650 -0.747 1.00 . A A . 13 LYS CG 1 1 2 408 1 1 13 LYS H H -3.721 0.545 2.375 1.00 . A A . 13 LYS H 1 1 2 409 1 1 13 LYS HA H -6.132 -0.321 1.076 1.00 . A A . 13 LYS HA 1 1 2 410 1 1 13 LYS HB2 H -3.977 1.121 -0.460 1.00 . A A . 13 LYS HB2 1 1 2 411 1 1 13 LYS HB3 H -4.946 -0.122 -1.231 1.00 . A A . 13 LYS HB3 1 1 2 412 1 1 13 LYS HD2 H -7.312 0.350 -1.816 1.00 . A A . 13 LYS HD2 1 1 2 413 1 1 13 LYS HD3 H -7.603 0.417 -0.077 1.00 . A A . 13 LYS HD3 1 1 2 414 1 1 13 LYS HE2 H -8.524 2.648 -0.290 1.00 . A A . 13 LYS HE2 1 1 2 415 1 1 13 LYS HE3 H -8.173 2.651 -2.017 1.00 . A A . 13 LYS HE3 1 1 2 416 1 1 13 LYS HG2 H -6.079 2.334 0.084 1.00 . A A . 13 LYS HG2 1 1 2 417 1 1 13 LYS HG3 H -5.737 2.190 -1.641 1.00 . A A . 13 LYS HG3 1 1 2 418 1 1 13 LYS HZ1 H -10.019 0.751 -0.673 1.00 . A A . 13 LYS HZ1 1 1 2 419 1 1 13 LYS HZ2 H -9.737 0.872 -2.338 1.00 . A A . 13 LYS HZ2 1 1 2 420 1 1 13 LYS HZ3 H -10.504 2.135 -1.518 1.00 . A A . 13 LYS HZ3 1 1 2 421 1 1 13 LYS N N -4.613 0.735 2.000 1.00 . A A . 13 LYS N 1 1 2 422 1 1 13 LYS NZ N -9.768 1.404 -1.444 1.00 . A A . 13 LYS NZ 1 1 2 423 1 1 13 LYS O O -3.324 -1.528 1.637 1.00 . A A . 13 LYS O 1 1 2 424 1 1 14 LYS C C -4.464 -4.295 -1.387 1.00 . A A . 14 LYS C 1 1 2 425 1 1 14 LYS CA C -3.960 -3.567 -0.150 1.00 . A A . 14 LYS CA 1 1 2 426 1 1 14 LYS CB C -4.027 -4.475 1.088 1.00 . A A . 14 LYS CB 1 1 2 427 1 1 14 LYS CD C -5.403 -5.664 2.817 1.00 . A A . 14 LYS CD 1 1 2 428 1 1 14 LYS CE C -6.798 -5.911 3.369 1.00 . A A . 14 LYS CE 1 1 2 429 1 1 14 LYS CG C -5.434 -4.779 1.581 1.00 . A A . 14 LYS CG 1 1 2 430 1 1 14 LYS H H -5.533 -2.190 -0.458 1.00 . A A . 14 LYS H 1 1 2 431 1 1 14 LYS HA H -2.926 -3.294 -0.323 1.00 . A A . 14 LYS HA 1 1 2 432 1 1 14 LYS HB2 H -3.547 -5.412 0.854 1.00 . A A . 14 LYS HB2 1 1 2 433 1 1 14 LYS HB3 H -3.484 -4.000 1.892 1.00 . A A . 14 LYS HB3 1 1 2 434 1 1 14 LYS HD2 H -4.962 -6.612 2.551 1.00 . A A . 14 LYS HD2 1 1 2 435 1 1 14 LYS HD3 H -4.804 -5.185 3.576 1.00 . A A . 14 LYS HD3 1 1 2 436 1 1 14 LYS HE2 H -7.398 -6.377 2.601 1.00 . A A . 14 LYS HE2 1 1 2 437 1 1 14 LYS HE3 H -6.721 -6.576 4.216 1.00 . A A . 14 LYS HE3 1 1 2 438 1 1 14 LYS HG2 H -5.931 -3.852 1.824 1.00 . A A . 14 LYS HG2 1 1 2 439 1 1 14 LYS HG3 H -5.976 -5.289 0.799 1.00 . A A . 14 LYS HG3 1 1 2 440 1 1 14 LYS HZ1 H -7.547 -3.999 2.994 1.00 . A A . 14 LYS HZ1 1 1 2 441 1 1 14 LYS HZ2 H -6.899 -4.188 4.543 1.00 . A A . 14 LYS HZ2 1 1 2 442 1 1 14 LYS HZ3 H -8.407 -4.851 4.173 1.00 . A A . 14 LYS HZ3 1 1 2 443 1 1 14 LYS N N -4.702 -2.329 0.045 1.00 . A A . 14 LYS N 1 1 2 444 1 1 14 LYS NZ N -7.457 -4.651 3.801 1.00 . A A . 14 LYS NZ 1 1 2 445 1 1 14 LYS O O -3.698 -4.394 -2.364 1.00 . A A . 14 LYS O 1 1 2 446 1 1 14 LYS OXT O -5.636 -4.733 -1.395 1.00 . A A . 14 LYS OXT 1 1 3 447 1 1 1 HIS C C 0.749 -1.283 -4.774 1.00 . A A . 1 HIS C 1 1 3 448 1 1 1 HIS CA C 1.396 -2.498 -4.128 1.00 . A A . 1 HIS CA 1 1 3 449 1 1 1 HIS CB C 2.924 -2.371 -4.166 1.00 . A A . 1 HIS CB 1 1 3 450 1 1 1 HIS CD2 C 4.073 -4.631 -3.620 1.00 . A A . 1 HIS CD2 1 1 3 451 1 1 1 HIS CE1 C 4.500 -4.273 -1.504 1.00 . A A . 1 HIS CE1 1 1 3 452 1 1 1 HIS CG C 3.628 -3.389 -3.322 1.00 . A A . 1 HIS CG 1 1 3 453 1 1 1 HIS H1 H -0.086 -3.803 -4.795 1.00 . A A . 1 HIS H1 1 1 3 454 1 1 1 HIS H2 H 1.347 -4.574 -4.342 1.00 . A A . 1 HIS H2 1 1 3 455 1 1 1 HIS H3 H 1.268 -3.729 -5.805 1.00 . A A . 1 HIS H3 1 1 3 456 1 1 1 HIS HA H 1.075 -2.546 -3.098 1.00 . A A . 1 HIS HA 1 1 3 457 1 1 1 HIS HB2 H 3.264 -2.489 -5.183 1.00 . A A . 1 HIS HB2 1 1 3 458 1 1 1 HIS HB3 H 3.205 -1.391 -3.811 1.00 . A A . 1 HIS HB3 1 1 3 459 1 1 1 HIS HD1 H 3.741 -2.374 -1.474 1.00 . A A . 1 HIS HD1 1 1 3 460 1 1 1 HIS HD2 H 4.015 -5.118 -4.583 1.00 . A A . 1 HIS HD2 1 1 3 461 1 1 1 HIS HE1 H 4.814 -4.414 -0.474 1.00 . A A . 1 HIS HE1 1 1 3 462 1 1 1 HIS HE2 H 4.789 -6.119 -2.334 1.00 . A A . 1 HIS HE2 1 1 3 463 1 1 1 HIS N N 0.953 -3.736 -4.813 1.00 . A A . 1 HIS N 1 1 3 464 1 1 1 HIS ND1 N 3.918 -3.192 -1.987 1.00 . A A . 1 HIS ND1 1 1 3 465 1 1 1 HIS NE2 N 4.608 -5.160 -2.473 1.00 . A A . 1 HIS NE2 1 1 3 466 1 1 1 HIS O O 1.316 -0.669 -5.675 1.00 . A A . 1 HIS O 1 1 3 467 1 1 2 GLN C C -0.461 1.479 -4.749 1.00 . A A . 2 GLN C 1 1 3 468 1 1 2 GLN CA C -1.234 0.156 -4.817 1.00 . A A . 2 GLN CA 1 1 3 469 1 1 2 GLN CB C -2.557 0.249 -4.052 1.00 . A A . 2 GLN CB 1 1 3 470 1 1 2 GLN CD C -3.912 1.022 -6.038 1.00 . A A . 2 GLN CD 1 1 3 471 1 1 2 GLN CG C -3.516 1.292 -4.599 1.00 . A A . 2 GLN CG 1 1 3 472 1 1 2 GLN H H -0.824 -1.488 -3.560 1.00 . A A . 2 GLN H 1 1 3 473 1 1 2 GLN HA H -1.448 -0.062 -5.850 1.00 . A A . 2 GLN HA 1 1 3 474 1 1 2 GLN HB2 H -3.048 -0.713 -4.093 1.00 . A A . 2 GLN HB2 1 1 3 475 1 1 2 GLN HB3 H -2.346 0.489 -3.019 1.00 . A A . 2 GLN HB3 1 1 3 476 1 1 2 GLN HE21 H -4.095 2.967 -6.371 1.00 . A A . 2 GLN HE21 1 1 3 477 1 1 2 GLN HE22 H -4.434 1.939 -7.720 1.00 . A A . 2 GLN HE22 1 1 3 478 1 1 2 GLN HG2 H -4.409 1.296 -3.992 1.00 . A A . 2 GLN HG2 1 1 3 479 1 1 2 GLN HG3 H -3.044 2.258 -4.546 1.00 . A A . 2 GLN HG3 1 1 3 480 1 1 2 GLN N N -0.446 -0.952 -4.291 1.00 . A A . 2 GLN N 1 1 3 481 1 1 2 GLN NE2 N -4.172 2.082 -6.785 1.00 . A A . 2 GLN NE2 1 1 3 482 1 1 2 GLN O O 0.138 1.895 -5.737 1.00 . A A . 2 GLN O 1 1 3 483 1 1 2 GLN OE1 O -3.975 -0.127 -6.477 1.00 . A A . 2 GLN OE1 1 1 3 484 1 1 3 VAL C C 1.036 3.324 -2.061 1.00 . A A . 3 VAL C 1 1 3 485 1 1 3 VAL CA C 0.308 3.361 -3.407 1.00 . A A . 3 VAL CA 1 1 3 486 1 1 3 VAL CB C -0.568 4.641 -3.485 1.00 . A A . 3 VAL CB 1 1 3 487 1 1 3 VAL CG1 C 0.294 5.894 -3.377 1.00 . A A . 3 VAL CG1 1 1 3 488 1 1 3 VAL CG2 C -1.379 4.679 -4.772 1.00 . A A . 3 VAL CG2 1 1 3 489 1 1 3 VAL H H -1.007 1.794 -2.846 1.00 . A A . 3 VAL H 1 1 3 490 1 1 3 VAL HA H 1.043 3.404 -4.196 1.00 . A A . 3 VAL HA 1 1 3 491 1 1 3 VAL HB H -1.256 4.633 -2.652 1.00 . A A . 3 VAL HB 1 1 3 492 1 1 3 VAL HG11 H 0.835 5.879 -2.442 1.00 . A A . 3 VAL HG11 1 1 3 493 1 1 3 VAL HG12 H -0.337 6.768 -3.414 1.00 . A A . 3 VAL HG12 1 1 3 494 1 1 3 VAL HG13 H 0.995 5.921 -4.198 1.00 . A A . 3 VAL HG13 1 1 3 495 1 1 3 VAL HG21 H -2.021 3.815 -4.818 1.00 . A A . 3 VAL HG21 1 1 3 496 1 1 3 VAL HG22 H -0.710 4.676 -5.619 1.00 . A A . 3 VAL HG22 1 1 3 497 1 1 3 VAL HG23 H -1.981 5.576 -4.792 1.00 . A A . 3 VAL HG23 1 1 3 498 1 1 3 VAL N N -0.469 2.136 -3.593 1.00 . A A . 3 VAL N 1 1 3 499 1 1 3 VAL O O 0.630 3.971 -1.101 1.00 . A A . 3 VAL O 1 1 3 500 1 1 4 PRO C C 4.143 3.279 -0.764 1.00 . A A . 4 PRO C 1 1 3 501 1 1 4 PRO CA C 2.894 2.405 -0.753 1.00 . A A . 4 PRO CA 1 1 3 502 1 1 4 PRO CB C 3.304 0.929 -0.774 1.00 . A A . 4 PRO CB 1 1 3 503 1 1 4 PRO CD C 2.628 1.641 -2.993 1.00 . A A . 4 PRO CD 1 1 3 504 1 1 4 PRO CG C 3.086 0.453 -2.183 1.00 . A A . 4 PRO CG 1 1 3 505 1 1 4 PRO HA H 2.312 2.608 0.131 1.00 . A A . 4 PRO HA 1 1 3 506 1 1 4 PRO HB2 H 4.342 0.842 -0.488 1.00 . A A . 4 PRO HB2 1 1 3 507 1 1 4 PRO HB3 H 2.693 0.378 -0.076 1.00 . A A . 4 PRO HB3 1 1 3 508 1 1 4 PRO HD2 H 3.461 2.094 -3.511 1.00 . A A . 4 PRO HD2 1 1 3 509 1 1 4 PRO HD3 H 1.854 1.354 -3.689 1.00 . A A . 4 PRO HD3 1 1 3 510 1 1 4 PRO HG2 H 4.011 0.066 -2.583 1.00 . A A . 4 PRO HG2 1 1 3 511 1 1 4 PRO HG3 H 2.327 -0.315 -2.191 1.00 . A A . 4 PRO HG3 1 1 3 512 1 1 4 PRO N N 2.105 2.526 -1.962 1.00 . A A . 4 PRO N 1 1 3 513 1 1 4 PRO O O 4.453 3.945 -1.752 1.00 . A A . 4 PRO O 1 1 3 514 1 1 5 SER C C 7.178 2.883 0.879 1.00 . A A . 5 SER C 1 1 3 515 1 1 5 SER CA C 6.139 3.916 0.457 1.00 . A A . 5 SER CA 1 1 3 516 1 1 5 SER CB C 6.065 5.060 1.471 1.00 . A A . 5 SER CB 1 1 3 517 1 1 5 SER H H 4.492 2.798 1.133 1.00 . A A . 5 SER H 1 1 3 518 1 1 5 SER HA H 6.402 4.309 -0.513 1.00 . A A . 5 SER HA 1 1 3 519 1 1 5 SER HB2 H 5.919 4.654 2.460 1.00 . A A . 5 SER HB2 1 1 3 520 1 1 5 SER HB3 H 6.986 5.624 1.444 1.00 . A A . 5 SER HB3 1 1 3 521 1 1 5 SER HG H 4.833 5.938 0.214 1.00 . A A . 5 SER HG 1 1 3 522 1 1 5 SER N N 4.851 3.264 0.349 1.00 . A A . 5 SER N 1 1 3 523 1 1 5 SER O O 8.022 3.133 1.742 1.00 . A A . 5 SER O 1 1 3 524 1 1 5 SER OG O 4.985 5.932 1.170 1.00 . A A . 5 SER OG 1 1 3 525 1 1 6 GLY C C 7.201 -0.714 0.678 1.00 . A A . 6 GLY C 1 1 3 526 1 1 6 GLY CA C 7.951 0.605 0.626 1.00 . A A . 6 GLY CA 1 1 3 527 1 1 6 GLY H H 6.417 1.586 -0.440 1.00 . A A . 6 GLY H 1 1 3 528 1 1 6 GLY HA2 H 8.741 0.533 -0.106 1.00 . A A . 6 GLY HA2 1 1 3 529 1 1 6 GLY HA3 H 8.384 0.799 1.595 1.00 . A A . 6 GLY HA3 1 1 3 530 1 1 6 GLY N N 7.083 1.706 0.272 1.00 . A A . 6 GLY N 1 1 3 531 1 1 6 GLY O O 6.293 -0.946 -0.126 1.00 . A A . 6 GLY O 1 1 3 532 1 1 7 PRO C C 5.457 -2.843 2.132 1.00 . A A . 7 PRO C 1 1 3 533 1 1 7 PRO CA C 6.936 -2.920 1.772 1.00 . A A . 7 PRO CA 1 1 3 534 1 1 7 PRO CB C 7.720 -3.573 2.916 1.00 . A A . 7 PRO CB 1 1 3 535 1 1 7 PRO CD C 8.619 -1.384 2.617 1.00 . A A . 7 PRO CD 1 1 3 536 1 1 7 PRO CG C 8.973 -2.777 3.036 1.00 . A A . 7 PRO CG 1 1 3 537 1 1 7 PRO HA H 7.047 -3.512 0.873 1.00 . A A . 7 PRO HA 1 1 3 538 1 1 7 PRO HB2 H 7.137 -3.530 3.824 1.00 . A A . 7 PRO HB2 1 1 3 539 1 1 7 PRO HB3 H 7.931 -4.602 2.667 1.00 . A A . 7 PRO HB3 1 1 3 540 1 1 7 PRO HD2 H 8.252 -0.816 3.459 1.00 . A A . 7 PRO HD2 1 1 3 541 1 1 7 PRO HD3 H 9.472 -0.895 2.172 1.00 . A A . 7 PRO HD3 1 1 3 542 1 1 7 PRO HG2 H 9.318 -2.786 4.060 1.00 . A A . 7 PRO HG2 1 1 3 543 1 1 7 PRO HG3 H 9.730 -3.183 2.382 1.00 . A A . 7 PRO HG3 1 1 3 544 1 1 7 PRO N N 7.560 -1.597 1.624 1.00 . A A . 7 PRO N 1 1 3 545 1 1 7 PRO O O 5.048 -2.017 2.955 1.00 . A A . 7 PRO O 1 1 3 546 1 1 8 ASN C C 2.568 -2.566 1.099 1.00 . A A . 8 ASN C 1 1 3 547 1 1 8 ASN CA C 3.234 -3.822 1.657 1.00 . A A . 8 ASN CA 1 1 3 548 1 1 8 ASN CB C 2.859 -4.051 3.120 1.00 . A A . 8 ASN CB 1 1 3 549 1 1 8 ASN CG C 1.365 -4.224 3.348 1.00 . A A . 8 ASN CG 1 1 3 550 1 1 8 ASN H H 5.129 -4.437 1.009 1.00 . A A . 8 ASN H 1 1 3 551 1 1 8 ASN HA H 2.897 -4.671 1.080 1.00 . A A . 8 ASN HA 1 1 3 552 1 1 8 ASN HB2 H 3.362 -4.943 3.453 1.00 . A A . 8 ASN HB2 1 1 3 553 1 1 8 ASN HB3 H 3.201 -3.211 3.707 1.00 . A A . 8 ASN HB3 1 1 3 554 1 1 8 ASN HD21 H 1.167 -2.294 3.761 1.00 . A A . 8 ASN HD21 1 1 3 555 1 1 8 ASN HD22 H -0.286 -3.226 3.822 1.00 . A A . 8 ASN HD22 1 1 3 556 1 1 8 ASN N N 4.690 -3.756 1.531 1.00 . A A . 8 ASN N 1 1 3 557 1 1 8 ASN ND2 N 0.682 -3.140 3.678 1.00 . A A . 8 ASN ND2 1 1 3 558 1 1 8 ASN O O 3.110 -1.469 1.199 1.00 . A A . 8 ASN O 1 1 3 559 1 1 8 ASN OD1 O 0.834 -5.332 3.246 1.00 . A A . 8 ASN OD1 1 1 3 560 1 1 9 PRO C C 0.090 -0.883 1.297 1.00 . A A . 9 PRO C 1 1 3 561 1 1 9 PRO CA C 0.629 -1.540 0.051 1.00 . A A . 9 PRO CA 1 1 3 562 1 1 9 PRO CB C -0.503 -2.097 -0.818 1.00 . A A . 9 PRO CB 1 1 3 563 1 1 9 PRO CD C 0.707 -3.953 0.126 1.00 . A A . 9 PRO CD 1 1 3 564 1 1 9 PRO CG C -0.219 -3.554 -0.987 1.00 . A A . 9 PRO CG 1 1 3 565 1 1 9 PRO HA H 1.227 -0.835 -0.509 1.00 . A A . 9 PRO HA 1 1 3 566 1 1 9 PRO HB2 H -1.443 -1.939 -0.318 1.00 . A A . 9 PRO HB2 1 1 3 567 1 1 9 PRO HB3 H -0.511 -1.585 -1.770 1.00 . A A . 9 PRO HB3 1 1 3 568 1 1 9 PRO HD2 H 0.136 -4.312 0.972 1.00 . A A . 9 PRO HD2 1 1 3 569 1 1 9 PRO HD3 H 1.404 -4.703 -0.211 1.00 . A A . 9 PRO HD3 1 1 3 570 1 1 9 PRO HG2 H -1.138 -4.113 -0.920 1.00 . A A . 9 PRO HG2 1 1 3 571 1 1 9 PRO HG3 H 0.251 -3.727 -1.941 1.00 . A A . 9 PRO HG3 1 1 3 572 1 1 9 PRO N N 1.396 -2.699 0.455 1.00 . A A . 9 PRO N 1 1 3 573 1 1 9 PRO O O -0.879 -1.364 1.880 1.00 . A A . 9 PRO O 1 1 3 574 1 1 10 LEU C C -0.967 0.987 3.261 1.00 . A A . 10 LEU C 1 1 3 575 1 1 10 LEU CA C 0.523 0.736 3.048 1.00 . A A . 10 LEU CA 1 1 3 576 1 1 10 LEU CB C 1.310 2.035 3.227 1.00 . A A . 10 LEU CB 1 1 3 577 1 1 10 LEU CD1 C 3.503 3.230 3.402 1.00 . A A . 10 LEU CD1 1 1 3 578 1 1 10 LEU CD2 C 3.331 0.850 4.130 1.00 . A A . 10 LEU CD2 1 1 3 579 1 1 10 LEU CG C 2.831 1.894 3.144 1.00 . A A . 10 LEU CG 1 1 3 580 1 1 10 LEU H H 1.448 0.568 1.160 1.00 . A A . 10 LEU H 1 1 3 581 1 1 10 LEU HA H 0.873 0.006 3.766 1.00 . A A . 10 LEU HA 1 1 3 582 1 1 10 LEU HB2 H 0.992 2.731 2.465 1.00 . A A . 10 LEU HB2 1 1 3 583 1 1 10 LEU HB3 H 1.063 2.448 4.193 1.00 . A A . 10 LEU HB3 1 1 3 584 1 1 10 LEU HD11 H 3.171 3.949 2.669 1.00 . A A . 10 LEU HD11 1 1 3 585 1 1 10 LEU HD12 H 4.575 3.114 3.330 1.00 . A A . 10 LEU HD12 1 1 3 586 1 1 10 LEU HD13 H 3.245 3.578 4.390 1.00 . A A . 10 LEU HD13 1 1 3 587 1 1 10 LEU HD21 H 2.919 -0.115 3.873 1.00 . A A . 10 LEU HD21 1 1 3 588 1 1 10 LEU HD22 H 3.020 1.121 5.127 1.00 . A A . 10 LEU HD22 1 1 3 589 1 1 10 LEU HD23 H 4.408 0.804 4.088 1.00 . A A . 10 LEU HD23 1 1 3 590 1 1 10 LEU HG H 3.101 1.571 2.149 1.00 . A A . 10 LEU HG 1 1 3 591 1 1 10 LEU N N 0.768 0.167 1.735 1.00 . A A . 10 LEU N 1 1 3 592 1 1 10 LEU O O -1.655 1.459 2.359 1.00 . A A . 10 LEU O 1 1 3 593 1 1 11 HIS C C -3.510 2.029 4.363 1.00 . A A . 11 HIS C 1 1 3 594 1 1 11 HIS CA C -2.884 0.698 4.760 1.00 . A A . 11 HIS CA 1 1 3 595 1 1 11 HIS CB C -3.145 0.403 6.247 1.00 . A A . 11 HIS CB 1 1 3 596 1 1 11 HIS CD2 C -3.186 2.588 7.653 1.00 . A A . 11 HIS CD2 1 1 3 597 1 1 11 HIS CE1 C -1.226 2.395 8.605 1.00 . A A . 11 HIS CE1 1 1 3 598 1 1 11 HIS CG C -2.625 1.442 7.199 1.00 . A A . 11 HIS CG 1 1 3 599 1 1 11 HIS H H -0.827 0.362 5.155 1.00 . A A . 11 HIS H 1 1 3 600 1 1 11 HIS HA H -3.356 -0.071 4.169 1.00 . A A . 11 HIS HA 1 1 3 601 1 1 11 HIS HB2 H -4.209 0.324 6.403 1.00 . A A . 11 HIS HB2 1 1 3 602 1 1 11 HIS HB3 H -2.682 -0.539 6.500 1.00 . A A . 11 HIS HB3 1 1 3 603 1 1 11 HIS HD1 H -0.749 0.618 7.705 1.00 . A A . 11 HIS HD1 1 1 3 604 1 1 11 HIS HD2 H -4.157 2.977 7.380 1.00 . A A . 11 HIS HD2 1 1 3 605 1 1 11 HIS HE1 H -0.355 2.588 9.215 1.00 . A A . 11 HIS HE1 1 1 3 606 1 1 11 HIS HE2 H -2.508 3.894 9.151 1.00 . A A . 11 HIS HE2 1 1 3 607 1 1 11 HIS N N -1.451 0.655 4.457 1.00 . A A . 11 HIS N 1 1 3 608 1 1 11 HIS ND1 N -1.398 1.351 7.816 1.00 . A A . 11 HIS ND1 1 1 3 609 1 1 11 HIS NE2 N -2.296 3.161 8.525 1.00 . A A . 11 HIS NE2 1 1 3 610 1 1 11 HIS O O -2.874 3.079 4.467 1.00 . A A . 11 HIS O 1 1 3 611 1 1 12 ASN C C -5.063 3.380 1.941 1.00 . A A . 12 ASN C 1 1 3 612 1 1 12 ASN CA C -5.509 3.086 3.367 1.00 . A A . 12 ASN CA 1 1 3 613 1 1 12 ASN CB C -5.389 4.343 4.243 1.00 . A A . 12 ASN CB 1 1 3 614 1 1 12 ASN CG C -6.074 4.194 5.589 1.00 . A A . 12 ASN CG 1 1 3 615 1 1 12 ASN H H -5.214 1.079 3.959 1.00 . A A . 12 ASN H 1 1 3 616 1 1 12 ASN HA H -6.549 2.791 3.335 1.00 . A A . 12 ASN HA 1 1 3 617 1 1 12 ASN HB2 H -4.344 4.553 4.415 1.00 . A A . 12 ASN HB2 1 1 3 618 1 1 12 ASN HB3 H -5.836 5.177 3.722 1.00 . A A . 12 ASN HB3 1 1 3 619 1 1 12 ASN HD21 H -6.470 6.137 5.625 1.00 . A A . 12 ASN HD21 1 1 3 620 1 1 12 ASN HD22 H -7.027 5.228 6.988 1.00 . A A . 12 ASN HD22 1 1 3 621 1 1 12 ASN N N -4.762 1.949 3.914 1.00 . A A . 12 ASN N 1 1 3 622 1 1 12 ASN ND2 N -6.571 5.296 6.122 1.00 . A A . 12 ASN ND2 1 1 3 623 1 1 12 ASN O O -5.611 4.262 1.278 1.00 . A A . 12 ASN O 1 1 3 624 1 1 12 ASN OD1 O -6.154 3.099 6.148 1.00 . A A . 12 ASN OD1 1 1 3 625 1 1 13 LYS C C -3.215 1.350 -0.429 1.00 . A A . 13 LYS C 1 1 3 626 1 1 13 LYS CA C -3.594 2.732 0.098 1.00 . A A . 13 LYS CA 1 1 3 627 1 1 13 LYS CB C -2.387 3.675 0.008 1.00 . A A . 13 LYS CB 1 1 3 628 1 1 13 LYS CD C -1.500 6.023 0.133 1.00 . A A . 13 LYS CD 1 1 3 629 1 1 13 LYS CE C -1.831 7.477 0.422 1.00 . A A . 13 LYS CE 1 1 3 630 1 1 13 LYS CG C -2.716 5.131 0.301 1.00 . A A . 13 LYS CG 1 1 3 631 1 1 13 LYS H H -3.643 1.975 2.073 1.00 . A A . 13 LYS H 1 1 3 632 1 1 13 LYS HA H -4.397 3.128 -0.505 1.00 . A A . 13 LYS HA 1 1 3 633 1 1 13 LYS HB2 H -1.640 3.351 0.717 1.00 . A A . 13 LYS HB2 1 1 3 634 1 1 13 LYS HB3 H -1.973 3.615 -0.988 1.00 . A A . 13 LYS HB3 1 1 3 635 1 1 13 LYS HD2 H -0.730 5.696 0.815 1.00 . A A . 13 LYS HD2 1 1 3 636 1 1 13 LYS HD3 H -1.144 5.938 -0.882 1.00 . A A . 13 LYS HD3 1 1 3 637 1 1 13 LYS HE2 H -0.949 8.075 0.248 1.00 . A A . 13 LYS HE2 1 1 3 638 1 1 13 LYS HE3 H -2.616 7.791 -0.250 1.00 . A A . 13 LYS HE3 1 1 3 639 1 1 13 LYS HG2 H -3.483 5.462 -0.382 1.00 . A A . 13 LYS HG2 1 1 3 640 1 1 13 LYS HG3 H -3.074 5.212 1.316 1.00 . A A . 13 LYS HG3 1 1 3 641 1 1 13 LYS HZ1 H -2.442 8.695 2.003 1.00 . A A . 13 LYS HZ1 1 1 3 642 1 1 13 LYS HZ2 H -1.568 7.333 2.490 1.00 . A A . 13 LYS HZ2 1 1 3 643 1 1 13 LYS HZ3 H -3.173 7.173 1.991 1.00 . A A . 13 LYS HZ3 1 1 3 644 1 1 13 LYS N N -4.074 2.626 1.471 1.00 . A A . 13 LYS N 1 1 3 645 1 1 13 LYS NZ N -2.284 7.683 1.823 1.00 . A A . 13 LYS NZ 1 1 3 646 1 1 13 LYS O O -2.165 1.172 -1.054 1.00 . A A . 13 LYS O 1 1 3 647 1 1 14 LYS C C -4.912 -1.538 -1.454 1.00 . A A . 14 LYS C 1 1 3 648 1 1 14 LYS CA C -3.803 -1.005 -0.556 1.00 . A A . 14 LYS CA 1 1 3 649 1 1 14 LYS CB C -3.627 -1.903 0.689 1.00 . A A . 14 LYS CB 1 1 3 650 1 1 14 LYS CD C -5.825 -1.312 1.786 1.00 . A A . 14 LYS CD 1 1 3 651 1 1 14 LYS CE C -7.189 -1.839 2.188 1.00 . A A . 14 LYS CE 1 1 3 652 1 1 14 LYS CG C -4.923 -2.429 1.299 1.00 . A A . 14 LYS CG 1 1 3 653 1 1 14 LYS H H -4.929 0.588 0.260 1.00 . A A . 14 LYS H 1 1 3 654 1 1 14 LYS HA H -2.881 -1.005 -1.118 1.00 . A A . 14 LYS HA 1 1 3 655 1 1 14 LYS HB2 H -3.017 -2.756 0.420 1.00 . A A . 14 LYS HB2 1 1 3 656 1 1 14 LYS HB3 H -3.109 -1.335 1.448 1.00 . A A . 14 LYS HB3 1 1 3 657 1 1 14 LYS HD2 H -5.364 -0.841 2.640 1.00 . A A . 14 LYS HD2 1 1 3 658 1 1 14 LYS HD3 H -5.946 -0.589 0.994 1.00 . A A . 14 LYS HD3 1 1 3 659 1 1 14 LYS HE2 H -7.553 -2.493 1.409 1.00 . A A . 14 LYS HE2 1 1 3 660 1 1 14 LYS HE3 H -7.089 -2.396 3.108 1.00 . A A . 14 LYS HE3 1 1 3 661 1 1 14 LYS HG2 H -5.453 -3.002 0.553 1.00 . A A . 14 LYS HG2 1 1 3 662 1 1 14 LYS HG3 H -4.678 -3.066 2.135 1.00 . A A . 14 LYS HG3 1 1 3 663 1 1 14 LYS HZ1 H -8.251 -0.176 1.520 1.00 . A A . 14 LYS HZ1 1 1 3 664 1 1 14 LYS HZ2 H -7.849 -0.115 3.161 1.00 . A A . 14 LYS HZ2 1 1 3 665 1 1 14 LYS HZ3 H -9.095 -1.127 2.635 1.00 . A A . 14 LYS HZ3 1 1 3 666 1 1 14 LYS N N -4.078 0.373 -0.176 1.00 . A A . 14 LYS N 1 1 3 667 1 1 14 LYS NZ N -8.164 -0.738 2.391 1.00 . A A . 14 LYS NZ 1 1 3 668 1 1 14 LYS O O -4.629 -2.407 -2.299 1.00 . A A . 14 LYS O 1 1 3 669 1 1 14 LYS OXT O -6.064 -1.067 -1.326 1.00 . A A . 14 LYS OXT 1 1 4 670 1 1 1 HIS C C 0.529 -0.940 -4.755 1.00 . A A . 1 HIS C 1 1 4 671 1 1 1 HIS CA C 0.949 -2.281 -4.161 1.00 . A A . 1 HIS CA 1 1 4 672 1 1 1 HIS CB C 2.451 -2.528 -4.389 1.00 . A A . 1 HIS CB 1 1 4 673 1 1 1 HIS CD2 C 2.957 -4.861 -3.353 1.00 . A A . 1 HIS CD2 1 1 4 674 1 1 1 HIS CE1 C 4.218 -4.210 -1.685 1.00 . A A . 1 HIS CE1 1 1 4 675 1 1 1 HIS CG C 3.058 -3.513 -3.426 1.00 . A A . 1 HIS CG 1 1 4 676 1 1 1 HIS H1 H -0.871 -3.182 -4.614 1.00 . A A . 1 HIS H1 1 1 4 677 1 1 1 HIS H2 H 0.370 -4.281 -4.291 1.00 . A A . 1 HIS H2 1 1 4 678 1 1 1 HIS H3 H 0.334 -3.458 -5.767 1.00 . A A . 1 HIS H3 1 1 4 679 1 1 1 HIS HA H 0.757 -2.257 -3.100 1.00 . A A . 1 HIS HA 1 1 4 680 1 1 1 HIS HB2 H 2.595 -2.912 -5.386 1.00 . A A . 1 HIS HB2 1 1 4 681 1 1 1 HIS HB3 H 2.981 -1.595 -4.288 1.00 . A A . 1 HIS HB3 1 1 4 682 1 1 1 HIS HD1 H 4.171 -2.226 -2.176 1.00 . A A . 1 HIS HD1 1 1 4 683 1 1 1 HIS HD2 H 2.408 -5.500 -4.027 1.00 . A A . 1 HIS HD2 1 1 4 684 1 1 1 HIS HE1 H 4.827 -4.219 -0.781 1.00 . A A . 1 HIS HE1 1 1 4 685 1 1 1 HIS HE2 H 3.648 -6.166 -1.862 1.00 . A A . 1 HIS HE2 1 1 4 686 1 1 1 HIS N N 0.144 -3.375 -4.748 1.00 . A A . 1 HIS N 1 1 4 687 1 1 1 HIS ND1 N 3.862 -3.137 -2.367 1.00 . A A . 1 HIS ND1 1 1 4 688 1 1 1 HIS NE2 N 3.684 -5.267 -2.262 1.00 . A A . 1 HIS NE2 1 1 4 689 1 1 1 HIS O O 1.143 -0.440 -5.698 1.00 . A A . 1 HIS O 1 1 4 690 1 1 2 GLN C C -0.164 2.056 -4.546 1.00 . A A . 2 GLN C 1 1 4 691 1 1 2 GLN CA C -1.125 0.871 -4.675 1.00 . A A . 2 GLN CA 1 1 4 692 1 1 2 GLN CB C -2.427 1.156 -3.920 1.00 . A A . 2 GLN CB 1 1 4 693 1 1 2 GLN CD C -4.432 2.646 -3.616 1.00 . A A . 2 GLN CD 1 1 4 694 1 1 2 GLN CG C -3.221 2.330 -4.468 1.00 . A A . 2 GLN CG 1 1 4 695 1 1 2 GLN H H -0.942 -0.813 -3.408 1.00 . A A . 2 GLN H 1 1 4 696 1 1 2 GLN HA H -1.357 0.728 -5.717 1.00 . A A . 2 GLN HA 1 1 4 697 1 1 2 GLN HB2 H -3.054 0.277 -3.965 1.00 . A A . 2 GLN HB2 1 1 4 698 1 1 2 GLN HB3 H -2.192 1.361 -2.886 1.00 . A A . 2 GLN HB3 1 1 4 699 1 1 2 GLN HE21 H -5.546 1.389 -4.674 1.00 . A A . 2 GLN HE21 1 1 4 700 1 1 2 GLN HE22 H -6.351 2.207 -3.378 1.00 . A A . 2 GLN HE22 1 1 4 701 1 1 2 GLN HG2 H -2.581 3.199 -4.497 1.00 . A A . 2 GLN HG2 1 1 4 702 1 1 2 GLN HG3 H -3.552 2.091 -5.468 1.00 . A A . 2 GLN HG3 1 1 4 703 1 1 2 GLN N N -0.530 -0.370 -4.182 1.00 . A A . 2 GLN N 1 1 4 704 1 1 2 GLN NE2 N -5.555 2.020 -3.920 1.00 . A A . 2 GLN NE2 1 1 4 705 1 1 2 GLN O O 0.522 2.410 -5.502 1.00 . A A . 2 GLN O 1 1 4 706 1 1 2 GLN OE1 O -4.354 3.442 -2.683 1.00 . A A . 2 GLN OE1 1 1 4 707 1 1 3 VAL C C 1.661 3.555 -1.897 1.00 . A A . 3 VAL C 1 1 4 708 1 1 3 VAL CA C 0.784 3.796 -3.128 1.00 . A A . 3 VAL CA 1 1 4 709 1 1 3 VAL CB C -0.001 5.121 -2.973 1.00 . A A . 3 VAL CB 1 1 4 710 1 1 3 VAL CG1 C -0.524 5.593 -4.323 1.00 . A A . 3 VAL CG1 1 1 4 711 1 1 3 VAL CG2 C -1.154 4.961 -1.990 1.00 . A A . 3 VAL CG2 1 1 4 712 1 1 3 VAL H H -0.683 2.349 -2.640 1.00 . A A . 3 VAL H 1 1 4 713 1 1 3 VAL HA H 1.424 3.886 -3.992 1.00 . A A . 3 VAL HA 1 1 4 714 1 1 3 VAL HB H 0.673 5.874 -2.589 1.00 . A A . 3 VAL HB 1 1 4 715 1 1 3 VAL HG11 H -1.164 4.834 -4.747 1.00 . A A . 3 VAL HG11 1 1 4 716 1 1 3 VAL HG12 H 0.308 5.776 -4.988 1.00 . A A . 3 VAL HG12 1 1 4 717 1 1 3 VAL HG13 H -1.087 6.506 -4.192 1.00 . A A . 3 VAL HG13 1 1 4 718 1 1 3 VAL HG21 H -0.764 4.692 -1.019 1.00 . A A . 3 VAL HG21 1 1 4 719 1 1 3 VAL HG22 H -1.819 4.184 -2.337 1.00 . A A . 3 VAL HG22 1 1 4 720 1 1 3 VAL HG23 H -1.696 5.891 -1.916 1.00 . A A . 3 VAL HG23 1 1 4 721 1 1 3 VAL N N -0.110 2.663 -3.365 1.00 . A A . 3 VAL N 1 1 4 722 1 1 3 VAL O O 1.506 4.201 -0.862 1.00 . A A . 3 VAL O 1 1 4 723 1 1 4 PRO C C 4.675 3.030 -0.671 1.00 . A A . 4 PRO C 1 1 4 724 1 1 4 PRO CA C 3.436 2.170 -0.882 1.00 . A A . 4 PRO CA 1 1 4 725 1 1 4 PRO CB C 3.864 0.753 -1.301 1.00 . A A . 4 PRO CB 1 1 4 726 1 1 4 PRO CD C 2.906 1.827 -3.189 1.00 . A A . 4 PRO CD 1 1 4 727 1 1 4 PRO CG C 3.148 0.484 -2.582 1.00 . A A . 4 PRO CG 1 1 4 728 1 1 4 PRO HA H 2.878 2.115 0.039 1.00 . A A . 4 PRO HA 1 1 4 729 1 1 4 PRO HB2 H 4.933 0.726 -1.435 1.00 . A A . 4 PRO HB2 1 1 4 730 1 1 4 PRO HB3 H 3.578 0.047 -0.535 1.00 . A A . 4 PRO HB3 1 1 4 731 1 1 4 PRO HD2 H 3.796 2.196 -3.680 1.00 . A A . 4 PRO HD2 1 1 4 732 1 1 4 PRO HD3 H 2.068 1.800 -3.870 1.00 . A A . 4 PRO HD3 1 1 4 733 1 1 4 PRO HG2 H 3.758 -0.124 -3.232 1.00 . A A . 4 PRO HG2 1 1 4 734 1 1 4 PRO HG3 H 2.206 -0.005 -2.372 1.00 . A A . 4 PRO HG3 1 1 4 735 1 1 4 PRO N N 2.594 2.601 -1.996 1.00 . A A . 4 PRO N 1 1 4 736 1 1 4 PRO O O 5.021 3.884 -1.491 1.00 . A A . 4 PRO O 1 1 4 737 1 1 5 SER C C 7.494 2.315 1.388 1.00 . A A . 5 SER C 1 1 4 738 1 1 5 SER CA C 6.604 3.392 0.772 1.00 . A A . 5 SER CA 1 1 4 739 1 1 5 SER CB C 6.390 4.561 1.743 1.00 . A A . 5 SER CB 1 1 4 740 1 1 5 SER H H 4.950 2.137 1.082 1.00 . A A . 5 SER H 1 1 4 741 1 1 5 SER HA H 7.055 3.752 -0.142 1.00 . A A . 5 SER HA 1 1 4 742 1 1 5 SER HB2 H 5.550 5.151 1.410 1.00 . A A . 5 SER HB2 1 1 4 743 1 1 5 SER HB3 H 6.183 4.171 2.729 1.00 . A A . 5 SER HB3 1 1 4 744 1 1 5 SER HG H 7.270 6.258 2.185 1.00 . A A . 5 SER HG 1 1 4 745 1 1 5 SER N N 5.334 2.775 0.446 1.00 . A A . 5 SER N 1 1 4 746 1 1 5 SER O O 8.259 2.557 2.323 1.00 . A A . 5 SER O 1 1 4 747 1 1 5 SER OG O 7.531 5.403 1.816 1.00 . A A . 5 SER OG 1 1 4 748 1 1 6 GLY C C 7.443 -1.329 0.852 1.00 . A A . 6 GLY C 1 1 4 749 1 1 6 GLY CA C 8.034 -0.044 1.396 1.00 . A A . 6 GLY CA 1 1 4 750 1 1 6 GLY H H 6.799 1.005 0.048 1.00 . A A . 6 GLY H 1 1 4 751 1 1 6 GLY HA2 H 9.082 0.003 1.137 1.00 . A A . 6 GLY HA2 1 1 4 752 1 1 6 GLY HA3 H 7.934 -0.038 2.470 1.00 . A A . 6 GLY HA3 1 1 4 753 1 1 6 GLY N N 7.360 1.110 0.850 1.00 . A A . 6 GLY N 1 1 4 754 1 1 6 GLY O O 6.760 -1.301 -0.169 1.00 . A A . 6 GLY O 1 1 4 755 1 1 7 PRO C C 5.689 -3.999 1.236 1.00 . A A . 7 PRO C 1 1 4 756 1 1 7 PRO CA C 7.192 -3.782 1.059 1.00 . A A . 7 PRO CA 1 1 4 757 1 1 7 PRO CB C 7.972 -4.782 1.929 1.00 . A A . 7 PRO CB 1 1 4 758 1 1 7 PRO CD C 8.410 -2.584 2.776 1.00 . A A . 7 PRO CD 1 1 4 759 1 1 7 PRO CG C 8.972 -3.973 2.691 1.00 . A A . 7 PRO CG 1 1 4 760 1 1 7 PRO HA H 7.443 -3.942 0.022 1.00 . A A . 7 PRO HA 1 1 4 761 1 1 7 PRO HB2 H 7.287 -5.287 2.595 1.00 . A A . 7 PRO HB2 1 1 4 762 1 1 7 PRO HB3 H 8.457 -5.508 1.294 1.00 . A A . 7 PRO HB3 1 1 4 763 1 1 7 PRO HD2 H 7.758 -2.489 3.629 1.00 . A A . 7 PRO HD2 1 1 4 764 1 1 7 PRO HD3 H 9.207 -1.856 2.821 1.00 . A A . 7 PRO HD3 1 1 4 765 1 1 7 PRO HG2 H 9.101 -4.386 3.680 1.00 . A A . 7 PRO HG2 1 1 4 766 1 1 7 PRO HG3 H 9.913 -3.964 2.164 1.00 . A A . 7 PRO HG3 1 1 4 767 1 1 7 PRO N N 7.663 -2.469 1.523 1.00 . A A . 7 PRO N 1 1 4 768 1 1 7 PRO O O 5.213 -5.133 1.179 1.00 . A A . 7 PRO O 1 1 4 769 1 1 8 ASN C C 2.879 -1.666 1.195 1.00 . A A . 8 ASN C 1 1 4 770 1 1 8 ASN CA C 3.493 -3.014 1.532 1.00 . A A . 8 ASN CA 1 1 4 771 1 1 8 ASN CB C 3.071 -3.476 2.931 1.00 . A A . 8 ASN CB 1 1 4 772 1 1 8 ASN CG C 3.328 -2.451 4.025 1.00 . A A . 8 ASN CG 1 1 4 773 1 1 8 ASN H H 5.367 -2.043 1.517 1.00 . A A . 8 ASN H 1 1 4 774 1 1 8 ASN HA H 3.158 -3.739 0.804 1.00 . A A . 8 ASN HA 1 1 4 775 1 1 8 ASN HB2 H 2.016 -3.703 2.923 1.00 . A A . 8 ASN HB2 1 1 4 776 1 1 8 ASN HB3 H 3.622 -4.374 3.167 1.00 . A A . 8 ASN HB3 1 1 4 777 1 1 8 ASN HD21 H 1.770 -3.130 5.053 1.00 . A A . 8 ASN HD21 1 1 4 778 1 1 8 ASN HD22 H 2.642 -1.823 5.778 1.00 . A A . 8 ASN HD22 1 1 4 779 1 1 8 ASN N N 4.939 -2.924 1.433 1.00 . A A . 8 ASN N 1 1 4 780 1 1 8 ASN ND2 N 2.497 -2.468 5.054 1.00 . A A . 8 ASN ND2 1 1 4 781 1 1 8 ASN O O 3.538 -0.634 1.331 1.00 . A A . 8 ASN O 1 1 4 782 1 1 8 ASN OD1 O 4.266 -1.656 3.956 1.00 . A A . 8 ASN OD1 1 1 4 783 1 1 9 PRO C C 0.671 0.467 1.512 1.00 . A A . 9 PRO C 1 1 4 784 1 1 9 PRO CA C 0.965 -0.415 0.317 1.00 . A A . 9 PRO CA 1 1 4 785 1 1 9 PRO CB C -0.337 -0.866 -0.357 1.00 . A A . 9 PRO CB 1 1 4 786 1 1 9 PRO CD C 0.726 -2.807 0.609 1.00 . A A . 9 PRO CD 1 1 4 787 1 1 9 PRO CG C -0.292 -2.360 -0.399 1.00 . A A . 9 PRO CG 1 1 4 788 1 1 9 PRO HA H 1.569 0.135 -0.390 1.00 . A A . 9 PRO HA 1 1 4 789 1 1 9 PRO HB2 H -1.179 -0.514 0.215 1.00 . A A . 9 PRO HB2 1 1 4 790 1 1 9 PRO HB3 H -0.382 -0.451 -1.353 1.00 . A A . 9 PRO HB3 1 1 4 791 1 1 9 PRO HD2 H 0.250 -3.024 1.553 1.00 . A A . 9 PRO HD2 1 1 4 792 1 1 9 PRO HD3 H 1.261 -3.671 0.246 1.00 . A A . 9 PRO HD3 1 1 4 793 1 1 9 PRO HG2 H -1.262 -2.760 -0.145 1.00 . A A . 9 PRO HG2 1 1 4 794 1 1 9 PRO HG3 H -0.005 -2.686 -1.386 1.00 . A A . 9 PRO HG3 1 1 4 795 1 1 9 PRO N N 1.619 -1.647 0.728 1.00 . A A . 9 PRO N 1 1 4 796 1 1 9 PRO O O 0.188 -0.007 2.540 1.00 . A A . 9 PRO O 1 1 4 797 1 1 10 LEU C C -0.679 3.119 2.563 1.00 . A A . 10 LEU C 1 1 4 798 1 1 10 LEU CA C 0.785 2.684 2.478 1.00 . A A . 10 LEU CA 1 1 4 799 1 1 10 LEU CB C 1.708 3.897 2.310 1.00 . A A . 10 LEU CB 1 1 4 800 1 1 10 LEU CD1 C 2.391 4.085 4.721 1.00 . A A . 10 LEU CD1 1 1 4 801 1 1 10 LEU CD2 C 2.641 6.049 3.202 1.00 . A A . 10 LEU CD2 1 1 4 802 1 1 10 LEU CG C 1.805 4.823 3.528 1.00 . A A . 10 LEU CG 1 1 4 803 1 1 10 LEU H H 1.284 2.081 0.509 1.00 . A A . 10 LEU H 1 1 4 804 1 1 10 LEU HA H 1.051 2.160 3.384 1.00 . A A . 10 LEU HA 1 1 4 805 1 1 10 LEU HB2 H 2.699 3.537 2.079 1.00 . A A . 10 LEU HB2 1 1 4 806 1 1 10 LEU HB3 H 1.352 4.479 1.473 1.00 . A A . 10 LEU HB3 1 1 4 807 1 1 10 LEU HD11 H 1.747 3.261 4.987 1.00 . A A . 10 LEU HD11 1 1 4 808 1 1 10 LEU HD12 H 2.474 4.762 5.557 1.00 . A A . 10 LEU HD12 1 1 4 809 1 1 10 LEU HD13 H 3.371 3.707 4.465 1.00 . A A . 10 LEU HD13 1 1 4 810 1 1 10 LEU HD21 H 2.733 6.667 4.082 1.00 . A A . 10 LEU HD21 1 1 4 811 1 1 10 LEU HD22 H 2.160 6.612 2.416 1.00 . A A . 10 LEU HD22 1 1 4 812 1 1 10 LEU HD23 H 3.622 5.740 2.875 1.00 . A A . 10 LEU HD23 1 1 4 813 1 1 10 LEU HG H 0.813 5.156 3.799 1.00 . A A . 10 LEU HG 1 1 4 814 1 1 10 LEU N N 0.960 1.752 1.374 1.00 . A A . 10 LEU N 1 1 4 815 1 1 10 LEU O O -1.000 4.305 2.538 1.00 . A A . 10 LEU O 1 1 4 816 1 1 11 HIS C C -3.657 1.092 3.249 1.00 . A A . 11 HIS C 1 1 4 817 1 1 11 HIS CA C -2.996 2.320 2.673 1.00 . A A . 11 HIS CA 1 1 4 818 1 1 11 HIS CB C -3.541 2.592 1.262 1.00 . A A . 11 HIS CB 1 1 4 819 1 1 11 HIS CD2 C -3.747 5.133 1.782 1.00 . A A . 11 HIS CD2 1 1 4 820 1 1 11 HIS CE1 C -4.282 5.830 -0.221 1.00 . A A . 11 HIS CE1 1 1 4 821 1 1 11 HIS CG C -3.787 4.047 0.973 1.00 . A A . 11 HIS CG 1 1 4 822 1 1 11 HIS H H -1.206 1.208 2.713 1.00 . A A . 11 HIS H 1 1 4 823 1 1 11 HIS HA H -3.236 3.154 3.306 1.00 . A A . 11 HIS HA 1 1 4 824 1 1 11 HIS HB2 H -2.831 2.227 0.537 1.00 . A A . 11 HIS HB2 1 1 4 825 1 1 11 HIS HB3 H -4.477 2.066 1.140 1.00 . A A . 11 HIS HB3 1 1 4 826 1 1 11 HIS HD1 H -4.246 3.975 -1.090 1.00 . A A . 11 HIS HD1 1 1 4 827 1 1 11 HIS HD2 H -3.514 5.137 2.836 1.00 . A A . 11 HIS HD2 1 1 4 828 1 1 11 HIS HE1 H -4.548 6.469 -1.048 1.00 . A A . 11 HIS HE1 1 1 4 829 1 1 11 HIS HE2 H -3.974 7.163 1.301 1.00 . A A . 11 HIS HE2 1 1 4 830 1 1 11 HIS N N -1.552 2.128 2.649 1.00 . A A . 11 HIS N 1 1 4 831 1 1 11 HIS ND1 N -4.127 4.521 -0.275 1.00 . A A . 11 HIS ND1 1 1 4 832 1 1 11 HIS NE2 N -4.059 6.225 1.015 1.00 . A A . 11 HIS NE2 1 1 4 833 1 1 11 HIS O O -3.317 -0.037 2.894 1.00 . A A . 11 HIS O 1 1 4 834 1 1 12 ASN C C -6.329 -0.182 3.516 1.00 . A A . 12 ASN C 1 1 4 835 1 1 12 ASN CA C -5.444 0.274 4.663 1.00 . A A . 12 ASN CA 1 1 4 836 1 1 12 ASN CB C -6.292 0.781 5.834 1.00 . A A . 12 ASN CB 1 1 4 837 1 1 12 ASN CG C -7.051 -0.328 6.539 1.00 . A A . 12 ASN CG 1 1 4 838 1 1 12 ASN H H -4.693 2.237 4.512 1.00 . A A . 12 ASN H 1 1 4 839 1 1 12 ASN HA H -4.824 -0.550 4.989 1.00 . A A . 12 ASN HA 1 1 4 840 1 1 12 ASN HB2 H -5.646 1.260 6.554 1.00 . A A . 12 ASN HB2 1 1 4 841 1 1 12 ASN HB3 H -7.006 1.502 5.464 1.00 . A A . 12 ASN HB3 1 1 4 842 1 1 12 ASN HD21 H -8.644 -0.016 5.392 1.00 . A A . 12 ASN HD21 1 1 4 843 1 1 12 ASN HD22 H -8.793 -1.280 6.564 1.00 . A A . 12 ASN HD22 1 1 4 844 1 1 12 ASN N N -4.583 1.326 4.165 1.00 . A A . 12 ASN N 1 1 4 845 1 1 12 ASN ND2 N -8.286 -0.565 6.125 1.00 . A A . 12 ASN ND2 1 1 4 846 1 1 12 ASN O O -6.915 -1.263 3.539 1.00 . A A . 12 ASN O 1 1 4 847 1 1 12 ASN OD1 O -6.534 -0.957 7.463 1.00 . A A . 12 ASN OD1 1 1 4 848 1 1 13 LYS C C -6.107 -0.323 0.290 1.00 . A A . 13 LYS C 1 1 4 849 1 1 13 LYS CA C -7.087 0.324 1.262 1.00 . A A . 13 LYS CA 1 1 4 850 1 1 13 LYS CB C -7.722 1.562 0.622 1.00 . A A . 13 LYS CB 1 1 4 851 1 1 13 LYS CD C -9.488 3.342 0.722 1.00 . A A . 13 LYS CD 1 1 4 852 1 1 13 LYS CE C -10.558 4.006 1.570 1.00 . A A . 13 LYS CE 1 1 4 853 1 1 13 LYS CG C -8.826 2.192 1.458 1.00 . A A . 13 LYS CG 1 1 4 854 1 1 13 LYS H H -5.923 1.540 2.568 1.00 . A A . 13 LYS H 1 1 4 855 1 1 13 LYS HA H -7.862 -0.389 1.503 1.00 . A A . 13 LYS HA 1 1 4 856 1 1 13 LYS HB2 H -6.954 2.305 0.465 1.00 . A A . 13 LYS HB2 1 1 4 857 1 1 13 LYS HB3 H -8.141 1.284 -0.334 1.00 . A A . 13 LYS HB3 1 1 4 858 1 1 13 LYS HD2 H -8.739 4.075 0.467 1.00 . A A . 13 LYS HD2 1 1 4 859 1 1 13 LYS HD3 H -9.943 2.960 -0.180 1.00 . A A . 13 LYS HD3 1 1 4 860 1 1 13 LYS HE2 H -11.034 4.780 0.987 1.00 . A A . 13 LYS HE2 1 1 4 861 1 1 13 LYS HE3 H -11.290 3.261 1.845 1.00 . A A . 13 LYS HE3 1 1 4 862 1 1 13 LYS HG2 H -9.574 1.445 1.675 1.00 . A A . 13 LYS HG2 1 1 4 863 1 1 13 LYS HG3 H -8.402 2.560 2.380 1.00 . A A . 13 LYS HG3 1 1 4 864 1 1 13 LYS HZ1 H -10.748 5.075 3.352 1.00 . A A . 13 LYS HZ1 1 1 4 865 1 1 13 LYS HZ2 H -9.273 5.319 2.564 1.00 . A A . 13 LYS HZ2 1 1 4 866 1 1 13 LYS HZ3 H -9.559 3.875 3.397 1.00 . A A . 13 LYS HZ3 1 1 4 867 1 1 13 LYS N N -6.390 0.664 2.493 1.00 . A A . 13 LYS N 1 1 4 868 1 1 13 LYS NZ N -9.995 4.611 2.807 1.00 . A A . 13 LYS NZ 1 1 4 869 1 1 13 LYS O O -5.656 0.305 -0.670 1.00 . A A . 13 LYS O 1 1 4 870 1 1 14 LYS C C -5.486 -3.293 -1.173 1.00 . A A . 14 LYS C 1 1 4 871 1 1 14 LYS CA C -4.798 -2.297 -0.243 1.00 . A A . 14 LYS CA 1 1 4 872 1 1 14 LYS CB C -3.788 -3.002 0.674 1.00 . A A . 14 LYS CB 1 1 4 873 1 1 14 LYS CD C -3.389 -4.397 2.740 1.00 . A A . 14 LYS CD 1 1 4 874 1 1 14 LYS CE C -2.537 -3.357 3.450 1.00 . A A . 14 LYS CE 1 1 4 875 1 1 14 LYS CG C -4.428 -3.753 1.836 1.00 . A A . 14 LYS CG 1 1 4 876 1 1 14 LYS H H -6.200 -2.030 1.314 1.00 . A A . 14 LYS H 1 1 4 877 1 1 14 LYS HA H -4.270 -1.573 -0.846 1.00 . A A . 14 LYS HA 1 1 4 878 1 1 14 LYS HB2 H -3.221 -3.708 0.087 1.00 . A A . 14 LYS HB2 1 1 4 879 1 1 14 LYS HB3 H -3.113 -2.263 1.080 1.00 . A A . 14 LYS HB3 1 1 4 880 1 1 14 LYS HD2 H -3.896 -4.998 3.479 1.00 . A A . 14 LYS HD2 1 1 4 881 1 1 14 LYS HD3 H -2.747 -5.026 2.141 1.00 . A A . 14 LYS HD3 1 1 4 882 1 1 14 LYS HE2 H -1.988 -2.792 2.711 1.00 . A A . 14 LYS HE2 1 1 4 883 1 1 14 LYS HE3 H -3.188 -2.692 3.999 1.00 . A A . 14 LYS HE3 1 1 4 884 1 1 14 LYS HG2 H -5.013 -3.060 2.420 1.00 . A A . 14 LYS HG2 1 1 4 885 1 1 14 LYS HG3 H -5.072 -4.525 1.442 1.00 . A A . 14 LYS HG3 1 1 4 886 1 1 14 LYS HZ1 H -1.013 -3.244 4.869 1.00 . A A . 14 LYS HZ1 1 1 4 887 1 1 14 LYS HZ2 H -0.926 -4.611 3.883 1.00 . A A . 14 LYS HZ2 1 1 4 888 1 1 14 LYS HZ3 H -2.080 -4.531 5.112 1.00 . A A . 14 LYS HZ3 1 1 4 889 1 1 14 LYS N N -5.773 -1.574 0.558 1.00 . A A . 14 LYS N 1 1 4 890 1 1 14 LYS NZ N -1.573 -3.979 4.394 1.00 . A A . 14 LYS NZ 1 1 4 891 1 1 14 LYS O O -5.936 -2.873 -2.260 1.00 . A A . 14 LYS O 1 1 4 892 1 1 14 LYS OXT O -5.587 -4.486 -0.821 1.00 . A A . 14 LYS OXT 1 1 5 893 1 1 1 HIS C C -0.018 -0.978 -5.045 1.00 . A A . 1 HIS C 1 1 5 894 1 1 1 HIS CA C 0.577 -2.291 -4.539 1.00 . A A . 1 HIS CA 1 1 5 895 1 1 1 HIS CB C 1.391 -1.993 -3.273 1.00 . A A . 1 HIS CB 1 1 5 896 1 1 1 HIS CD2 C 3.653 -3.277 -3.312 1.00 . A A . 1 HIS CD2 1 1 5 897 1 1 1 HIS CE1 C 3.329 -4.562 -1.571 1.00 . A A . 1 HIS CE1 1 1 5 898 1 1 1 HIS CG C 2.401 -3.028 -2.855 1.00 . A A . 1 HIS CG 1 1 5 899 1 1 1 HIS H1 H 2.200 -2.234 -5.848 1.00 . A A . 1 HIS H1 1 1 5 900 1 1 1 HIS H2 H 0.850 -3.029 -6.467 1.00 . A A . 1 HIS H2 1 1 5 901 1 1 1 HIS H3 H 1.814 -3.788 -5.310 1.00 . A A . 1 HIS H3 1 1 5 902 1 1 1 HIS HA H -0.223 -2.979 -4.308 1.00 . A A . 1 HIS HA 1 1 5 903 1 1 1 HIS HB2 H 1.927 -1.073 -3.428 1.00 . A A . 1 HIS HB2 1 1 5 904 1 1 1 HIS HB3 H 0.704 -1.854 -2.449 1.00 . A A . 1 HIS HB3 1 1 5 905 1 1 1 HIS HD1 H 1.402 -3.961 -1.243 1.00 . A A . 1 HIS HD1 1 1 5 906 1 1 1 HIS HD2 H 4.129 -2.806 -4.160 1.00 . A A . 1 HIS HD2 1 1 5 907 1 1 1 HIS HE1 H 3.515 -5.225 -0.732 1.00 . A A . 1 HIS HE1 1 1 5 908 1 1 1 HIS HE2 H 5.033 -4.733 -2.692 1.00 . A A . 1 HIS HE2 1 1 5 909 1 1 1 HIS N N 1.420 -2.879 -5.611 1.00 . A A . 1 HIS N 1 1 5 910 1 1 1 HIS ND1 N 2.226 -3.863 -1.769 1.00 . A A . 1 HIS ND1 1 1 5 911 1 1 1 HIS NE2 N 4.205 -4.231 -2.497 1.00 . A A . 1 HIS NE2 1 1 5 912 1 1 1 HIS O O 0.185 -0.623 -6.202 1.00 . A A . 1 HIS O 1 1 5 913 1 1 2 GLN C C -0.144 2.125 -4.551 1.00 . A A . 2 GLN C 1 1 5 914 1 1 2 GLN CA C -1.258 1.064 -4.577 1.00 . A A . 2 GLN CA 1 1 5 915 1 1 2 GLN CB C -2.418 1.504 -3.679 1.00 . A A . 2 GLN CB 1 1 5 916 1 1 2 GLN CD C -4.108 3.331 -3.192 1.00 . A A . 2 GLN CD 1 1 5 917 1 1 2 GLN CG C -3.140 2.740 -4.198 1.00 . A A . 2 GLN CG 1 1 5 918 1 1 2 GLN H H -0.999 -0.641 -3.319 1.00 . A A . 2 GLN H 1 1 5 919 1 1 2 GLN HA H -1.621 0.984 -5.591 1.00 . A A . 2 GLN HA 1 1 5 920 1 1 2 GLN HB2 H -3.133 0.699 -3.610 1.00 . A A . 2 GLN HB2 1 1 5 921 1 1 2 GLN HB3 H -2.037 1.722 -2.694 1.00 . A A . 2 GLN HB3 1 1 5 922 1 1 2 GLN HE21 H -5.296 3.945 -4.660 1.00 . A A . 2 GLN HE21 1 1 5 923 1 1 2 GLN HE22 H -5.829 4.313 -3.057 1.00 . A A . 2 GLN HE22 1 1 5 924 1 1 2 GLN HG2 H -2.404 3.491 -4.446 1.00 . A A . 2 GLN HG2 1 1 5 925 1 1 2 GLN HG3 H -3.689 2.472 -5.088 1.00 . A A . 2 GLN HG3 1 1 5 926 1 1 2 GLN N N -0.751 -0.257 -4.193 1.00 . A A . 2 GLN N 1 1 5 927 1 1 2 GLN NE2 N -5.183 3.922 -3.684 1.00 . A A . 2 GLN NE2 1 1 5 928 1 1 2 GLN O O 0.552 2.320 -5.548 1.00 . A A . 2 GLN O 1 1 5 929 1 1 2 GLN OE1 O -3.891 3.258 -1.984 1.00 . A A . 2 GLN OE1 1 1 5 930 1 1 3 VAL C C 1.828 3.677 -1.950 1.00 . A A . 3 VAL C 1 1 5 931 1 1 3 VAL CA C 1.050 3.845 -3.265 1.00 . A A . 3 VAL CA 1 1 5 932 1 1 3 VAL CB C 0.433 5.266 -3.334 1.00 . A A . 3 VAL CB 1 1 5 933 1 1 3 VAL CG1 C 0.063 5.620 -4.766 1.00 . A A . 3 VAL CG1 1 1 5 934 1 1 3 VAL CG2 C -0.791 5.379 -2.432 1.00 . A A . 3 VAL CG2 1 1 5 935 1 1 3 VAL H H -0.553 2.603 -2.649 1.00 . A A . 3 VAL H 1 1 5 936 1 1 3 VAL HA H 1.741 3.739 -4.088 1.00 . A A . 3 VAL HA 1 1 5 937 1 1 3 VAL HB H 1.173 5.975 -2.991 1.00 . A A . 3 VAL HB 1 1 5 938 1 1 3 VAL HG11 H 0.949 5.593 -5.385 1.00 . A A . 3 VAL HG11 1 1 5 939 1 1 3 VAL HG12 H -0.363 6.613 -4.793 1.00 . A A . 3 VAL HG12 1 1 5 940 1 1 3 VAL HG13 H -0.657 4.909 -5.140 1.00 . A A . 3 VAL HG13 1 1 5 941 1 1 3 VAL HG21 H -1.532 4.656 -2.738 1.00 . A A . 3 VAL HG21 1 1 5 942 1 1 3 VAL HG22 H -1.205 6.373 -2.509 1.00 . A A . 3 VAL HG22 1 1 5 943 1 1 3 VAL HG23 H -0.503 5.188 -1.408 1.00 . A A . 3 VAL HG23 1 1 5 944 1 1 3 VAL N N 0.027 2.800 -3.410 1.00 . A A . 3 VAL N 1 1 5 945 1 1 3 VAL O O 1.598 4.387 -0.976 1.00 . A A . 3 VAL O 1 1 5 946 1 1 4 PRO C C 4.770 3.098 -0.459 1.00 . A A . 4 PRO C 1 1 5 947 1 1 4 PRO CA C 3.479 2.324 -0.697 1.00 . A A . 4 PRO CA 1 1 5 948 1 1 4 PRO CB C 3.836 0.856 -0.971 1.00 . A A . 4 PRO CB 1 1 5 949 1 1 4 PRO CD C 3.113 1.828 -3.005 1.00 . A A . 4 PRO CD 1 1 5 950 1 1 4 PRO CG C 3.190 0.532 -2.271 1.00 . A A . 4 PRO CG 1 1 5 951 1 1 4 PRO HA H 2.858 2.377 0.181 1.00 . A A . 4 PRO HA 1 1 5 952 1 1 4 PRO HB2 H 4.909 0.752 -1.028 1.00 . A A . 4 PRO HB2 1 1 5 953 1 1 4 PRO HB3 H 3.452 0.235 -0.174 1.00 . A A . 4 PRO HB3 1 1 5 954 1 1 4 PRO HD2 H 4.073 2.095 -3.426 1.00 . A A . 4 PRO HD2 1 1 5 955 1 1 4 PRO HD3 H 2.344 1.801 -3.763 1.00 . A A . 4 PRO HD3 1 1 5 956 1 1 4 PRO HG2 H 3.781 -0.185 -2.818 1.00 . A A . 4 PRO HG2 1 1 5 957 1 1 4 PRO HG3 H 2.196 0.153 -2.086 1.00 . A A . 4 PRO HG3 1 1 5 958 1 1 4 PRO N N 2.744 2.704 -1.906 1.00 . A A . 4 PRO N 1 1 5 959 1 1 4 PRO O O 5.177 3.956 -1.247 1.00 . A A . 4 PRO O 1 1 5 960 1 1 5 SER C C 7.536 1.927 1.364 1.00 . A A . 5 SER C 1 1 5 961 1 1 5 SER CA C 6.748 3.177 0.977 1.00 . A A . 5 SER CA 1 1 5 962 1 1 5 SER CB C 6.746 4.204 2.116 1.00 . A A . 5 SER CB 1 1 5 963 1 1 5 SER H H 4.913 2.214 1.318 1.00 . A A . 5 SER H 1 1 5 964 1 1 5 SER HA H 7.186 3.614 0.091 1.00 . A A . 5 SER HA 1 1 5 965 1 1 5 SER HB2 H 6.220 5.089 1.793 1.00 . A A . 5 SER HB2 1 1 5 966 1 1 5 SER HB3 H 6.243 3.783 2.973 1.00 . A A . 5 SER HB3 1 1 5 967 1 1 5 SER HG H 8.626 3.786 2.488 1.00 . A A . 5 SER HG 1 1 5 968 1 1 5 SER N N 5.393 2.766 0.663 1.00 . A A . 5 SER N 1 1 5 969 1 1 5 SER O O 8.588 1.991 2.002 1.00 . A A . 5 SER O 1 1 5 970 1 1 5 SER OG O 8.061 4.575 2.494 1.00 . A A . 5 SER OG 1 1 5 971 1 1 6 GLY C C 6.693 -1.618 0.738 1.00 . A A . 6 GLY C 1 1 5 972 1 1 6 GLY CA C 7.555 -0.499 1.288 1.00 . A A . 6 GLY CA 1 1 5 973 1 1 6 GLY H H 6.199 0.825 0.382 1.00 . A A . 6 GLY H 1 1 5 974 1 1 6 GLY HA2 H 8.549 -0.573 0.871 1.00 . A A . 6 GLY HA2 1 1 5 975 1 1 6 GLY HA3 H 7.611 -0.590 2.362 1.00 . A A . 6 GLY HA3 1 1 5 976 1 1 6 GLY N N 6.996 0.790 0.949 1.00 . A A . 6 GLY N 1 1 5 977 1 1 6 GLY O O 5.909 -1.388 -0.183 1.00 . A A . 6 GLY O 1 1 5 978 1 1 7 PRO C C 4.562 -3.980 1.251 1.00 . A A . 7 PRO C 1 1 5 979 1 1 7 PRO CA C 6.027 -3.999 0.822 1.00 . A A . 7 PRO CA 1 1 5 980 1 1 7 PRO CB C 6.752 -5.195 1.464 1.00 . A A . 7 PRO CB 1 1 5 981 1 1 7 PRO CD C 7.662 -3.188 2.412 1.00 . A A . 7 PRO CD 1 1 5 982 1 1 7 PRO CG C 7.963 -4.633 2.138 1.00 . A A . 7 PRO CG 1 1 5 983 1 1 7 PRO HA H 6.067 -4.093 -0.254 1.00 . A A . 7 PRO HA 1 1 5 984 1 1 7 PRO HB2 H 6.094 -5.671 2.175 1.00 . A A . 7 PRO HB2 1 1 5 985 1 1 7 PRO HB3 H 7.025 -5.904 0.695 1.00 . A A . 7 PRO HB3 1 1 5 986 1 1 7 PRO HD2 H 7.147 -3.080 3.355 1.00 . A A . 7 PRO HD2 1 1 5 987 1 1 7 PRO HD3 H 8.568 -2.600 2.401 1.00 . A A . 7 PRO HD3 1 1 5 988 1 1 7 PRO HG2 H 8.142 -5.157 3.063 1.00 . A A . 7 PRO HG2 1 1 5 989 1 1 7 PRO HG3 H 8.820 -4.719 1.486 1.00 . A A . 7 PRO HG3 1 1 5 990 1 1 7 PRO N N 6.790 -2.832 1.291 1.00 . A A . 7 PRO N 1 1 5 991 1 1 7 PRO O O 3.988 -5.026 1.552 1.00 . A A . 7 PRO O 1 1 5 992 1 1 8 ASN C C 2.070 -1.256 1.207 1.00 . A A . 8 ASN C 1 1 5 993 1 1 8 ASN CA C 2.530 -2.670 1.521 1.00 . A A . 8 ASN CA 1 1 5 994 1 1 8 ASN CB C 2.207 -3.043 2.971 1.00 . A A . 8 ASN CB 1 1 5 995 1 1 8 ASN CG C 2.863 -2.129 3.997 1.00 . A A . 8 ASN CG 1 1 5 996 1 1 8 ASN H H 4.479 -1.983 1.094 1.00 . A A . 8 ASN H 1 1 5 997 1 1 8 ASN HA H 2.015 -3.350 0.861 1.00 . A A . 8 ASN HA 1 1 5 998 1 1 8 ASN HB2 H 1.137 -3.003 3.116 1.00 . A A . 8 ASN HB2 1 1 5 999 1 1 8 ASN HB3 H 2.550 -4.054 3.142 1.00 . A A . 8 ASN HB3 1 1 5 1000 1 1 8 ASN HD21 H 1.298 -2.322 5.206 1.00 . A A . 8 ASN HD21 1 1 5 1001 1 1 8 ASN HD22 H 2.578 -1.312 5.783 1.00 . A A . 8 ASN HD22 1 1 5 1002 1 1 8 ASN N N 3.953 -2.799 1.256 1.00 . A A . 8 ASN N 1 1 5 1003 1 1 8 ASN ND2 N 2.179 -1.898 5.106 1.00 . A A . 8 ASN ND2 1 1 5 1004 1 1 8 ASN O O 2.755 -0.287 1.533 1.00 . A A . 8 ASN O 1 1 5 1005 1 1 8 ASN OD1 O 3.969 -1.632 3.795 1.00 . A A . 8 ASN OD1 1 1 5 1006 1 1 9 PRO C C 0.032 1.069 1.270 1.00 . A A . 9 PRO C 1 1 5 1007 1 1 9 PRO CA C 0.418 0.188 0.101 1.00 . A A . 9 PRO CA 1 1 5 1008 1 1 9 PRO CB C -0.802 -0.155 -0.747 1.00 . A A . 9 PRO CB 1 1 5 1009 1 1 9 PRO CD C -0.023 -2.204 0.208 1.00 . A A . 9 PRO CD 1 1 5 1010 1 1 9 PRO CG C -1.262 -1.474 -0.235 1.00 . A A . 9 PRO CG 1 1 5 1011 1 1 9 PRO HA H 1.149 0.701 -0.504 1.00 . A A . 9 PRO HA 1 1 5 1012 1 1 9 PRO HB2 H -1.554 0.607 -0.620 1.00 . A A . 9 PRO HB2 1 1 5 1013 1 1 9 PRO HB3 H -0.515 -0.214 -1.785 1.00 . A A . 9 PRO HB3 1 1 5 1014 1 1 9 PRO HD2 H -0.235 -2.814 1.074 1.00 . A A . 9 PRO HD2 1 1 5 1015 1 1 9 PRO HD3 H 0.364 -2.808 -0.597 1.00 . A A . 9 PRO HD3 1 1 5 1016 1 1 9 PRO HG2 H -1.930 -1.331 0.603 1.00 . A A . 9 PRO HG2 1 1 5 1017 1 1 9 PRO HG3 H -1.758 -2.021 -1.021 1.00 . A A . 9 PRO HG3 1 1 5 1018 1 1 9 PRO N N 0.912 -1.114 0.545 1.00 . A A . 9 PRO N 1 1 5 1019 1 1 9 PRO O O -0.758 0.661 2.128 1.00 . A A . 9 PRO O 1 1 5 1020 1 1 10 LEU C C -1.043 3.454 2.720 1.00 . A A . 10 LEU C 1 1 5 1021 1 1 10 LEU CA C 0.427 3.180 2.417 1.00 . A A . 10 LEU CA 1 1 5 1022 1 1 10 LEU CB C 1.151 4.506 2.169 1.00 . A A . 10 LEU CB 1 1 5 1023 1 1 10 LEU CD1 C 3.269 5.820 1.946 1.00 . A A . 10 LEU CD1 1 1 5 1024 1 1 10 LEU CD2 C 3.173 3.868 3.510 1.00 . A A . 10 LEU CD2 1 1 5 1025 1 1 10 LEU CG C 2.679 4.441 2.189 1.00 . A A . 10 LEU CG 1 1 5 1026 1 1 10 LEU H H 1.126 2.557 0.516 1.00 . A A . 10 LEU H 1 1 5 1027 1 1 10 LEU HA H 0.876 2.697 3.272 1.00 . A A . 10 LEU HA 1 1 5 1028 1 1 10 LEU HB2 H 0.844 4.882 1.203 1.00 . A A . 10 LEU HB2 1 1 5 1029 1 1 10 LEU HB3 H 0.836 5.209 2.924 1.00 . A A . 10 LEU HB3 1 1 5 1030 1 1 10 LEU HD11 H 4.345 5.763 1.987 1.00 . A A . 10 LEU HD11 1 1 5 1031 1 1 10 LEU HD12 H 2.916 6.501 2.705 1.00 . A A . 10 LEU HD12 1 1 5 1032 1 1 10 LEU HD13 H 2.964 6.175 0.973 1.00 . A A . 10 LEU HD13 1 1 5 1033 1 1 10 LEU HD21 H 4.251 3.917 3.542 1.00 . A A . 10 LEU HD21 1 1 5 1034 1 1 10 LEU HD22 H 2.859 2.838 3.596 1.00 . A A . 10 LEU HD22 1 1 5 1035 1 1 10 LEU HD23 H 2.762 4.440 4.328 1.00 . A A . 10 LEU HD23 1 1 5 1036 1 1 10 LEU HG H 3.015 3.792 1.395 1.00 . A A . 10 LEU HG 1 1 5 1037 1 1 10 LEU N N 0.589 2.272 1.289 1.00 . A A . 10 LEU N 1 1 5 1038 1 1 10 LEU O O -1.708 4.190 1.991 1.00 . A A . 10 LEU O 1 1 5 1039 1 1 11 HIS C C -3.947 2.640 3.266 1.00 . A A . 11 HIS C 1 1 5 1040 1 1 11 HIS CA C -2.897 3.057 4.286 1.00 . A A . 11 HIS CA 1 1 5 1041 1 1 11 HIS CB C -3.117 4.514 4.709 1.00 . A A . 11 HIS CB 1 1 5 1042 1 1 11 HIS CD2 C -1.037 5.618 5.793 1.00 . A A . 11 HIS CD2 1 1 5 1043 1 1 11 HIS CE1 C -1.539 5.264 7.894 1.00 . A A . 11 HIS CE1 1 1 5 1044 1 1 11 HIS CG C -2.221 4.964 5.823 1.00 . A A . 11 HIS CG 1 1 5 1045 1 1 11 HIS H H -0.956 2.209 4.278 1.00 . A A . 11 HIS H 1 1 5 1046 1 1 11 HIS HA H -3.020 2.425 5.152 1.00 . A A . 11 HIS HA 1 1 5 1047 1 1 11 HIS HB2 H -2.938 5.158 3.861 1.00 . A A . 11 HIS HB2 1 1 5 1048 1 1 11 HIS HB3 H -4.140 4.634 5.035 1.00 . A A . 11 HIS HB3 1 1 5 1049 1 1 11 HIS HD1 H -3.301 4.297 7.509 1.00 . A A . 11 HIS HD1 1 1 5 1050 1 1 11 HIS HD2 H -0.508 5.942 4.909 1.00 . A A . 11 HIS HD2 1 1 5 1051 1 1 11 HIS HE1 H -1.496 5.250 8.973 1.00 . A A . 11 HIS HE1 1 1 5 1052 1 1 11 HIS HE2 H 0.257 6.096 7.372 1.00 . A A . 11 HIS HE2 1 1 5 1053 1 1 11 HIS N N -1.534 2.843 3.794 1.00 . A A . 11 HIS N 1 1 5 1054 1 1 11 HIS ND1 N -2.506 4.756 7.155 1.00 . A A . 11 HIS ND1 1 1 5 1055 1 1 11 HIS NE2 N -0.635 5.794 7.093 1.00 . A A . 11 HIS NE2 1 1 5 1056 1 1 11 HIS O O -5.017 3.243 3.175 1.00 . A A . 11 HIS O 1 1 5 1057 1 1 12 ASN C C -4.717 -0.491 2.053 1.00 . A A . 12 ASN C 1 1 5 1058 1 1 12 ASN CA C -4.617 0.965 1.644 1.00 . A A . 12 ASN CA 1 1 5 1059 1 1 12 ASN CB C -4.233 1.088 0.165 1.00 . A A . 12 ASN CB 1 1 5 1060 1 1 12 ASN CG C -5.306 0.561 -0.777 1.00 . A A . 12 ASN CG 1 1 5 1061 1 1 12 ASN H H -2.703 1.285 2.494 1.00 . A A . 12 ASN H 1 1 5 1062 1 1 12 ASN HA H -5.571 1.444 1.809 1.00 . A A . 12 ASN HA 1 1 5 1063 1 1 12 ASN HB2 H -4.057 2.127 -0.069 1.00 . A A . 12 ASN HB2 1 1 5 1064 1 1 12 ASN HB3 H -3.327 0.530 -0.007 1.00 . A A . 12 ASN HB3 1 1 5 1065 1 1 12 ASN HD21 H -4.330 -1.156 -1.011 1.00 . A A . 12 ASN HD21 1 1 5 1066 1 1 12 ASN HD22 H -5.813 -1.008 -1.884 1.00 . A A . 12 ASN HD22 1 1 5 1067 1 1 12 ASN N N -3.630 1.614 2.496 1.00 . A A . 12 ASN N 1 1 5 1068 1 1 12 ASN ND2 N -5.132 -0.656 -1.271 1.00 . A A . 12 ASN ND2 1 1 5 1069 1 1 12 ASN O O -5.479 -1.274 1.478 1.00 . A A . 12 ASN O 1 1 5 1070 1 1 12 ASN OD1 O -6.276 1.257 -1.079 1.00 . A A . 12 ASN OD1 1 1 5 1071 1 1 13 LYS C C -3.109 -3.066 2.523 1.00 . A A . 13 LYS C 1 1 5 1072 1 1 13 LYS CA C -3.808 -2.202 3.574 1.00 . A A . 13 LYS CA 1 1 5 1073 1 1 13 LYS CB C -5.168 -2.808 3.943 1.00 . A A . 13 LYS CB 1 1 5 1074 1 1 13 LYS CD C -5.323 -1.708 6.205 1.00 . A A . 13 LYS CD 1 1 5 1075 1 1 13 LYS CE C -6.139 -0.775 7.085 1.00 . A A . 13 LYS CE 1 1 5 1076 1 1 13 LYS CG C -5.999 -1.931 4.866 1.00 . A A . 13 LYS CG 1 1 5 1077 1 1 13 LYS H H -3.479 -0.106 3.581 1.00 . A A . 13 LYS H 1 1 5 1078 1 1 13 LYS HA H -3.189 -2.174 4.457 1.00 . A A . 13 LYS HA 1 1 5 1079 1 1 13 LYS HB2 H -5.733 -2.975 3.037 1.00 . A A . 13 LYS HB2 1 1 5 1080 1 1 13 LYS HB3 H -5.003 -3.756 4.434 1.00 . A A . 13 LYS HB3 1 1 5 1081 1 1 13 LYS HD2 H -5.212 -2.658 6.708 1.00 . A A . 13 LYS HD2 1 1 5 1082 1 1 13 LYS HD3 H -4.352 -1.271 6.035 1.00 . A A . 13 LYS HD3 1 1 5 1083 1 1 13 LYS HE2 H -5.629 -0.649 8.027 1.00 . A A . 13 LYS HE2 1 1 5 1084 1 1 13 LYS HE3 H -6.221 0.183 6.591 1.00 . A A . 13 LYS HE3 1 1 5 1085 1 1 13 LYS HG2 H -6.146 -0.972 4.395 1.00 . A A . 13 LYS HG2 1 1 5 1086 1 1 13 LYS HG3 H -6.956 -2.403 5.030 1.00 . A A . 13 LYS HG3 1 1 5 1087 1 1 13 LYS HZ1 H -8.022 -0.670 7.977 1.00 . A A . 13 LYS HZ1 1 1 5 1088 1 1 13 LYS HZ2 H -7.443 -2.248 7.780 1.00 . A A . 13 LYS HZ2 1 1 5 1089 1 1 13 LYS HZ3 H -8.028 -1.387 6.447 1.00 . A A . 13 LYS HZ3 1 1 5 1090 1 1 13 LYS N N -3.953 -0.826 3.096 1.00 . A A . 13 LYS N 1 1 5 1091 1 1 13 LYS NZ N -7.502 -1.306 7.340 1.00 . A A . 13 LYS NZ 1 1 5 1092 1 1 13 LYS O O -1.939 -3.424 2.683 1.00 . A A . 13 LYS O 1 1 5 1093 1 1 14 LYS C C -4.362 -4.270 -0.738 1.00 . A A . 14 LYS C 1 1 5 1094 1 1 14 LYS CA C -3.322 -4.204 0.369 1.00 . A A . 14 LYS CA 1 1 5 1095 1 1 14 LYS CB C -3.012 -5.610 0.896 1.00 . A A . 14 LYS CB 1 1 5 1096 1 1 14 LYS CD C -2.064 -7.885 0.495 1.00 . A A . 14 LYS CD 1 1 5 1097 1 1 14 LYS CE C -1.473 -8.848 -0.518 1.00 . A A . 14 LYS CE 1 1 5 1098 1 1 14 LYS CG C -2.416 -6.551 -0.134 1.00 . A A . 14 LYS CG 1 1 5 1099 1 1 14 LYS H H -4.729 -2.989 1.363 1.00 . A A . 14 LYS H 1 1 5 1100 1 1 14 LYS HA H -2.418 -3.753 -0.024 1.00 . A A . 14 LYS HA 1 1 5 1101 1 1 14 LYS HB2 H -2.314 -5.524 1.715 1.00 . A A . 14 LYS HB2 1 1 5 1102 1 1 14 LYS HB3 H -3.929 -6.050 1.265 1.00 . A A . 14 LYS HB3 1 1 5 1103 1 1 14 LYS HD2 H -1.340 -7.717 1.276 1.00 . A A . 14 LYS HD2 1 1 5 1104 1 1 14 LYS HD3 H -2.958 -8.323 0.916 1.00 . A A . 14 LYS HD3 1 1 5 1105 1 1 14 LYS HE2 H -2.211 -9.051 -1.279 1.00 . A A . 14 LYS HE2 1 1 5 1106 1 1 14 LYS HE3 H -0.606 -8.390 -0.970 1.00 . A A . 14 LYS HE3 1 1 5 1107 1 1 14 LYS HG2 H -3.134 -6.711 -0.925 1.00 . A A . 14 LYS HG2 1 1 5 1108 1 1 14 LYS HG3 H -1.521 -6.107 -0.538 1.00 . A A . 14 LYS HG3 1 1 5 1109 1 1 14 LYS HZ1 H -1.900 -10.604 0.524 1.00 . A A . 14 LYS HZ1 1 1 5 1110 1 1 14 LYS HZ2 H -0.381 -9.954 0.874 1.00 . A A . 14 LYS HZ2 1 1 5 1111 1 1 14 LYS HZ3 H -0.639 -10.758 -0.590 1.00 . A A . 14 LYS HZ3 1 1 5 1112 1 1 14 LYS N N -3.824 -3.363 1.445 1.00 . A A . 14 LYS N 1 1 5 1113 1 1 14 LYS NZ N -1.070 -10.128 0.116 1.00 . A A . 14 LYS NZ 1 1 5 1114 1 1 14 LYS O O -4.172 -3.602 -1.768 1.00 . A A . 14 LYS O 1 1 5 1115 1 1 14 LYS OXT O -5.388 -4.955 -0.552 1.00 . A A . 14 LYS OXT 1 1 6 1116 1 1 1 HIS C C 0.532 -0.987 -4.713 1.00 . A A . 1 HIS C 1 1 6 1117 1 1 1 HIS CA C 1.061 -2.386 -4.422 1.00 . A A . 1 HIS CA 1 1 6 1118 1 1 1 HIS CB C 2.571 -2.423 -4.678 1.00 . A A . 1 HIS CB 1 1 6 1119 1 1 1 HIS CD2 C 3.221 -4.872 -4.099 1.00 . A A . 1 HIS CD2 1 1 6 1120 1 1 1 HIS CE1 C 4.684 -4.439 -2.532 1.00 . A A . 1 HIS CE1 1 1 6 1121 1 1 1 HIS CG C 3.289 -3.526 -3.965 1.00 . A A . 1 HIS CG 1 1 6 1122 1 1 1 HIS H1 H -0.666 -3.331 -5.096 1.00 . A A . 1 HIS H1 1 1 6 1123 1 1 1 HIS H2 H 0.669 -4.356 -4.992 1.00 . A A . 1 HIS H2 1 1 6 1124 1 1 1 HIS H3 H 0.557 -3.239 -6.257 1.00 . A A . 1 HIS H3 1 1 6 1125 1 1 1 HIS HA H 0.874 -2.615 -3.383 1.00 . A A . 1 HIS HA 1 1 6 1126 1 1 1 HIS HB2 H 2.746 -2.546 -5.734 1.00 . A A . 1 HIS HB2 1 1 6 1127 1 1 1 HIS HB3 H 3.003 -1.486 -4.357 1.00 . A A . 1 HIS HB3 1 1 6 1128 1 1 1 HIS HD1 H 4.515 -2.406 -2.667 1.00 . A A . 1 HIS HD1 1 1 6 1129 1 1 1 HIS HD2 H 2.590 -5.416 -4.787 1.00 . A A . 1 HIS HD2 1 1 6 1130 1 1 1 HIS HE1 H 5.415 -4.557 -1.738 1.00 . A A . 1 HIS HE1 1 1 6 1131 1 1 1 HIS HE2 H 4.157 -6.369 -2.962 1.00 . A A . 1 HIS HE2 1 1 6 1132 1 1 1 HIS N N 0.358 -3.398 -5.248 1.00 . A A . 1 HIS N 1 1 6 1133 1 1 1 HIS ND1 N 4.216 -3.290 -2.976 1.00 . A A . 1 HIS ND1 1 1 6 1134 1 1 1 HIS NE2 N 4.098 -5.413 -3.195 1.00 . A A . 1 HIS NE2 1 1 6 1135 1 1 1 HIS O O 1.168 -0.210 -5.419 1.00 . A A . 1 HIS O 1 1 6 1136 1 1 2 GLN C C -0.819 1.607 -3.267 1.00 . A A . 2 GLN C 1 1 6 1137 1 1 2 GLN CA C -1.240 0.633 -4.362 1.00 . A A . 2 GLN CA 1 1 6 1138 1 1 2 GLN CB C -2.759 0.496 -4.395 1.00 . A A . 2 GLN CB 1 1 6 1139 1 1 2 GLN CD C -4.763 -0.503 -5.577 1.00 . A A . 2 GLN CD 1 1 6 1140 1 1 2 GLN CG C -3.267 -0.264 -5.610 1.00 . A A . 2 GLN CG 1 1 6 1141 1 1 2 GLN H H -1.095 -1.337 -3.606 1.00 . A A . 2 GLN H 1 1 6 1142 1 1 2 GLN HA H -0.902 1.013 -5.315 1.00 . A A . 2 GLN HA 1 1 6 1143 1 1 2 GLN HB2 H -3.076 -0.033 -3.505 1.00 . A A . 2 GLN HB2 1 1 6 1144 1 1 2 GLN HB3 H -3.201 1.481 -4.398 1.00 . A A . 2 GLN HB3 1 1 6 1145 1 1 2 GLN HE21 H -4.834 -0.472 -7.558 1.00 . A A . 2 GLN HE21 1 1 6 1146 1 1 2 GLN HE22 H -6.343 -0.735 -6.756 1.00 . A A . 2 GLN HE22 1 1 6 1147 1 1 2 GLN HG2 H -3.032 0.305 -6.497 1.00 . A A . 2 GLN HG2 1 1 6 1148 1 1 2 GLN HG3 H -2.767 -1.219 -5.655 1.00 . A A . 2 GLN HG3 1 1 6 1149 1 1 2 GLN N N -0.629 -0.672 -4.162 1.00 . A A . 2 GLN N 1 1 6 1150 1 1 2 GLN NE2 N -5.374 -0.577 -6.747 1.00 . A A . 2 GLN NE2 1 1 6 1151 1 1 2 GLN O O -1.081 1.374 -2.086 1.00 . A A . 2 GLN O 1 1 6 1152 1 1 2 GLN OE1 O -5.363 -0.626 -4.511 1.00 . A A . 2 GLN OE1 1 1 6 1153 1 1 3 VAL C C 0.995 3.204 -1.523 1.00 . A A . 3 VAL C 1 1 6 1154 1 1 3 VAL CA C 0.306 3.753 -2.783 1.00 . A A . 3 VAL CA 1 1 6 1155 1 1 3 VAL CB C -0.869 4.673 -2.375 1.00 . A A . 3 VAL CB 1 1 6 1156 1 1 3 VAL CG1 C -0.359 5.953 -1.730 1.00 . A A . 3 VAL CG1 1 1 6 1157 1 1 3 VAL CG2 C -1.742 4.996 -3.578 1.00 . A A . 3 VAL CG2 1 1 6 1158 1 1 3 VAL H H 0.070 2.752 -4.636 1.00 . A A . 3 VAL H 1 1 6 1159 1 1 3 VAL HA H 1.021 4.351 -3.329 1.00 . A A . 3 VAL HA 1 1 6 1160 1 1 3 VAL HB H -1.474 4.148 -1.650 1.00 . A A . 3 VAL HB 1 1 6 1161 1 1 3 VAL HG11 H 0.228 5.707 -0.858 1.00 . A A . 3 VAL HG11 1 1 6 1162 1 1 3 VAL HG12 H -1.197 6.567 -1.438 1.00 . A A . 3 VAL HG12 1 1 6 1163 1 1 3 VAL HG13 H 0.255 6.492 -2.437 1.00 . A A . 3 VAL HG13 1 1 6 1164 1 1 3 VAL HG21 H -2.570 5.615 -3.267 1.00 . A A . 3 VAL HG21 1 1 6 1165 1 1 3 VAL HG22 H -2.119 4.079 -4.006 1.00 . A A . 3 VAL HG22 1 1 6 1166 1 1 3 VAL HG23 H -1.156 5.523 -4.317 1.00 . A A . 3 VAL HG23 1 1 6 1167 1 1 3 VAL N N -0.144 2.679 -3.681 1.00 . A A . 3 VAL N 1 1 6 1168 1 1 3 VAL O O 0.516 3.392 -0.405 1.00 . A A . 3 VAL O 1 1 6 1169 1 1 4 PRO C C 3.695 2.935 0.203 1.00 . A A . 4 PRO C 1 1 6 1170 1 1 4 PRO CA C 2.876 1.913 -0.571 1.00 . A A . 4 PRO CA 1 1 6 1171 1 1 4 PRO CB C 3.822 0.923 -1.264 1.00 . A A . 4 PRO CB 1 1 6 1172 1 1 4 PRO CD C 2.662 2.024 -2.967 1.00 . A A . 4 PRO CD 1 1 6 1173 1 1 4 PRO CG C 3.179 0.681 -2.571 1.00 . A A . 4 PRO CG 1 1 6 1174 1 1 4 PRO HA H 2.240 1.377 0.111 1.00 . A A . 4 PRO HA 1 1 6 1175 1 1 4 PRO HB2 H 4.799 1.368 -1.376 1.00 . A A . 4 PRO HB2 1 1 6 1176 1 1 4 PRO HB3 H 3.894 0.015 -0.683 1.00 . A A . 4 PRO HB3 1 1 6 1177 1 1 4 PRO HD2 H 3.467 2.666 -3.297 1.00 . A A . 4 PRO HD2 1 1 6 1178 1 1 4 PRO HD3 H 1.895 1.938 -3.721 1.00 . A A . 4 PRO HD3 1 1 6 1179 1 1 4 PRO HG2 H 3.897 0.311 -3.289 1.00 . A A . 4 PRO HG2 1 1 6 1180 1 1 4 PRO HG3 H 2.360 -0.013 -2.439 1.00 . A A . 4 PRO HG3 1 1 6 1181 1 1 4 PRO N N 2.103 2.469 -1.690 1.00 . A A . 4 PRO N 1 1 6 1182 1 1 4 PRO O O 4.017 4.015 -0.293 1.00 . A A . 4 PRO O 1 1 6 1183 1 1 5 SER C C 6.175 2.389 2.501 1.00 . A A . 5 SER C 1 1 6 1184 1 1 5 SER CA C 4.976 3.296 2.245 1.00 . A A . 5 SER CA 1 1 6 1185 1 1 5 SER CB C 4.327 3.717 3.566 1.00 . A A . 5 SER CB 1 1 6 1186 1 1 5 SER H H 3.611 1.759 1.804 1.00 . A A . 5 SER H 1 1 6 1187 1 1 5 SER HA H 5.295 4.169 1.698 1.00 . A A . 5 SER HA 1 1 6 1188 1 1 5 SER HB2 H 4.165 2.844 4.181 1.00 . A A . 5 SER HB2 1 1 6 1189 1 1 5 SER HB3 H 4.980 4.405 4.080 1.00 . A A . 5 SER HB3 1 1 6 1190 1 1 5 SER HG H 2.389 3.898 3.840 1.00 . A A . 5 SER HG 1 1 6 1191 1 1 5 SER N N 4.025 2.561 1.430 1.00 . A A . 5 SER N 1 1 6 1192 1 1 5 SER O O 6.954 2.588 3.434 1.00 . A A . 5 SER O 1 1 6 1193 1 1 5 SER OG O 3.080 4.354 3.337 1.00 . A A . 5 SER OG 1 1 6 1194 1 1 6 GLY C C 7.045 -0.760 0.785 1.00 . A A . 6 GLY C 1 1 6 1195 1 1 6 GLY CA C 7.312 0.368 1.761 1.00 . A A . 6 GLY CA 1 1 6 1196 1 1 6 GLY H H 5.665 1.336 0.890 1.00 . A A . 6 GLY H 1 1 6 1197 1 1 6 GLY HA2 H 8.278 0.806 1.549 1.00 . A A . 6 GLY HA2 1 1 6 1198 1 1 6 GLY HA3 H 7.310 -0.023 2.766 1.00 . A A . 6 GLY HA3 1 1 6 1199 1 1 6 GLY N N 6.291 1.385 1.640 1.00 . A A . 6 GLY N 1 1 6 1200 1 1 6 GLY O O 6.407 -0.536 -0.241 1.00 . A A . 6 GLY O 1 1 6 1201 1 1 7 PRO C C 5.861 -3.740 0.377 1.00 . A A . 7 PRO C 1 1 6 1202 1 1 7 PRO CA C 7.257 -3.144 0.206 1.00 . A A . 7 PRO CA 1 1 6 1203 1 1 7 PRO CB C 8.327 -4.131 0.667 1.00 . A A . 7 PRO CB 1 1 6 1204 1 1 7 PRO CD C 8.256 -2.354 2.285 1.00 . A A . 7 PRO CD 1 1 6 1205 1 1 7 PRO CG C 8.520 -3.829 2.114 1.00 . A A . 7 PRO CG 1 1 6 1206 1 1 7 PRO HA H 7.413 -2.897 -0.833 1.00 . A A . 7 PRO HA 1 1 6 1207 1 1 7 PRO HB2 H 7.976 -5.142 0.515 1.00 . A A . 7 PRO HB2 1 1 6 1208 1 1 7 PRO HB3 H 9.235 -3.971 0.106 1.00 . A A . 7 PRO HB3 1 1 6 1209 1 1 7 PRO HD2 H 7.676 -2.177 3.178 1.00 . A A . 7 PRO HD2 1 1 6 1210 1 1 7 PRO HD3 H 9.187 -1.807 2.326 1.00 . A A . 7 PRO HD3 1 1 6 1211 1 1 7 PRO HG2 H 7.820 -4.403 2.703 1.00 . A A . 7 PRO HG2 1 1 6 1212 1 1 7 PRO HG3 H 9.533 -4.063 2.403 1.00 . A A . 7 PRO HG3 1 1 6 1213 1 1 7 PRO N N 7.487 -1.989 1.080 1.00 . A A . 7 PRO N 1 1 6 1214 1 1 7 PRO O O 5.696 -4.960 0.442 1.00 . A A . 7 PRO O 1 1 6 1215 1 1 8 ASN C C 2.587 -2.035 0.514 1.00 . A A . 8 ASN C 1 1 6 1216 1 1 8 ASN CA C 3.473 -3.272 0.625 1.00 . A A . 8 ASN CA 1 1 6 1217 1 1 8 ASN CB C 3.336 -3.922 2.009 1.00 . A A . 8 ASN CB 1 1 6 1218 1 1 8 ASN CG C 1.927 -4.384 2.323 1.00 . A A . 8 ASN CG 1 1 6 1219 1 1 8 ASN H H 5.059 -1.912 0.313 1.00 . A A . 8 ASN H 1 1 6 1220 1 1 8 ASN HA H 3.200 -3.982 -0.142 1.00 . A A . 8 ASN HA 1 1 6 1221 1 1 8 ASN HB2 H 3.988 -4.781 2.049 1.00 . A A . 8 ASN HB2 1 1 6 1222 1 1 8 ASN HB3 H 3.642 -3.211 2.764 1.00 . A A . 8 ASN HB3 1 1 6 1223 1 1 8 ASN HD21 H 2.327 -6.195 1.617 1.00 . A A . 8 ASN HD21 1 1 6 1224 1 1 8 ASN HD22 H 0.728 -5.960 2.232 1.00 . A A . 8 ASN HD22 1 1 6 1225 1 1 8 ASN N N 4.859 -2.869 0.417 1.00 . A A . 8 ASN N 1 1 6 1226 1 1 8 ASN ND2 N 1.630 -5.635 2.024 1.00 . A A . 8 ASN ND2 1 1 6 1227 1 1 8 ASN O O 3.038 -0.947 0.864 1.00 . A A . 8 ASN O 1 1 6 1228 1 1 8 ASN OD1 O 1.114 -3.621 2.838 1.00 . A A . 8 ASN OD1 1 1 6 1229 1 1 9 PRO C C 0.019 -0.458 1.208 1.00 . A A . 9 PRO C 1 1 6 1230 1 1 9 PRO CA C 0.407 -1.036 -0.152 1.00 . A A . 9 PRO CA 1 1 6 1231 1 1 9 PRO CB C -0.818 -1.634 -0.853 1.00 . A A . 9 PRO CB 1 1 6 1232 1 1 9 PRO CD C 0.782 -3.413 -0.564 1.00 . A A . 9 PRO CD 1 1 6 1233 1 1 9 PRO CG C -0.683 -3.113 -0.718 1.00 . A A . 9 PRO CG 1 1 6 1234 1 1 9 PRO HA H 0.825 -0.248 -0.763 1.00 . A A . 9 PRO HA 1 1 6 1235 1 1 9 PRO HB2 H -1.716 -1.278 -0.369 1.00 . A A . 9 PRO HB2 1 1 6 1236 1 1 9 PRO HB3 H -0.826 -1.332 -1.892 1.00 . A A . 9 PRO HB3 1 1 6 1237 1 1 9 PRO HD2 H 0.924 -4.227 0.133 1.00 . A A . 9 PRO HD2 1 1 6 1238 1 1 9 PRO HD3 H 1.221 -3.655 -1.521 1.00 . A A . 9 PRO HD3 1 1 6 1239 1 1 9 PRO HG2 H -1.222 -3.449 0.152 1.00 . A A . 9 PRO HG2 1 1 6 1240 1 1 9 PRO HG3 H -1.070 -3.596 -1.603 1.00 . A A . 9 PRO HG3 1 1 6 1241 1 1 9 PRO N N 1.349 -2.165 -0.027 1.00 . A A . 9 PRO N 1 1 6 1242 1 1 9 PRO O O -1.105 -0.630 1.685 1.00 . A A . 9 PRO O 1 1 6 1243 1 1 10 LEU C C 0.261 2.139 3.256 1.00 . A A . 10 LEU C 1 1 6 1244 1 1 10 LEU CA C 0.842 0.728 3.175 1.00 . A A . 10 LEU CA 1 1 6 1245 1 1 10 LEU CB C 2.212 0.694 3.856 1.00 . A A . 10 LEU CB 1 1 6 1246 1 1 10 LEU CD1 C 4.261 -0.598 4.496 1.00 . A A . 10 LEU CD1 1 1 6 1247 1 1 10 LEU CD2 C 2.001 -1.476 5.095 1.00 . A A . 10 LEU CD2 1 1 6 1248 1 1 10 LEU CG C 2.807 -0.700 4.063 1.00 . A A . 10 LEU CG 1 1 6 1249 1 1 10 LEU H H 1.782 0.441 1.294 1.00 . A A . 10 LEU H 1 1 6 1250 1 1 10 LEU HA H 0.183 0.054 3.694 1.00 . A A . 10 LEU HA 1 1 6 1251 1 1 10 LEU HB2 H 2.901 1.270 3.258 1.00 . A A . 10 LEU HB2 1 1 6 1252 1 1 10 LEU HB3 H 2.121 1.168 4.822 1.00 . A A . 10 LEU HB3 1 1 6 1253 1 1 10 LEU HD11 H 4.829 -0.087 3.733 1.00 . A A . 10 LEU HD11 1 1 6 1254 1 1 10 LEU HD12 H 4.663 -1.590 4.640 1.00 . A A . 10 LEU HD12 1 1 6 1255 1 1 10 LEU HD13 H 4.322 -0.046 5.421 1.00 . A A . 10 LEU HD13 1 1 6 1256 1 1 10 LEU HD21 H 2.009 -0.940 6.033 1.00 . A A . 10 LEU HD21 1 1 6 1257 1 1 10 LEU HD22 H 2.440 -2.451 5.234 1.00 . A A . 10 LEU HD22 1 1 6 1258 1 1 10 LEU HD23 H 0.984 -1.585 4.750 1.00 . A A . 10 LEU HD23 1 1 6 1259 1 1 10 LEU HG H 2.771 -1.242 3.129 1.00 . A A . 10 LEU HG 1 1 6 1260 1 1 10 LEU N N 0.960 0.251 1.800 1.00 . A A . 10 LEU N 1 1 6 1261 1 1 10 LEU O O 0.746 2.971 4.025 1.00 . A A . 10 LEU O 1 1 6 1262 1 1 11 HIS C C -2.837 3.553 1.869 1.00 . A A . 11 HIS C 1 1 6 1263 1 1 11 HIS CA C -1.492 3.671 2.557 1.00 . A A . 11 HIS CA 1 1 6 1264 1 1 11 HIS CB C -0.686 4.842 1.975 1.00 . A A . 11 HIS CB 1 1 6 1265 1 1 11 HIS CD2 C -2.237 6.845 1.397 1.00 . A A . 11 HIS CD2 1 1 6 1266 1 1 11 HIS CE1 C -1.837 8.081 3.158 1.00 . A A . 11 HIS CE1 1 1 6 1267 1 1 11 HIS CG C -1.343 6.179 2.165 1.00 . A A . 11 HIS CG 1 1 6 1268 1 1 11 HIS H H -1.043 1.739 1.803 1.00 . A A . 11 HIS H 1 1 6 1269 1 1 11 HIS HA H -1.675 3.851 3.601 1.00 . A A . 11 HIS HA 1 1 6 1270 1 1 11 HIS HB2 H 0.281 4.877 2.454 1.00 . A A . 11 HIS HB2 1 1 6 1271 1 1 11 HIS HB3 H -0.552 4.684 0.915 1.00 . A A . 11 HIS HB3 1 1 6 1272 1 1 11 HIS HD1 H -0.508 6.775 4.007 1.00 . A A . 11 HIS HD1 1 1 6 1273 1 1 11 HIS HD2 H -2.646 6.509 0.454 1.00 . A A . 11 HIS HD2 1 1 6 1274 1 1 11 HIS HE1 H -1.859 8.889 3.872 1.00 . A A . 11 HIS HE1 1 1 6 1275 1 1 11 HIS HE2 H -3.259 8.634 1.793 1.00 . A A . 11 HIS HE2 1 1 6 1276 1 1 11 HIS N N -0.764 2.408 2.461 1.00 . A A . 11 HIS N 1 1 6 1277 1 1 11 HIS ND1 N -1.113 6.982 3.261 1.00 . A A . 11 HIS ND1 1 1 6 1278 1 1 11 HIS NE2 N -2.529 8.023 2.036 1.00 . A A . 11 HIS NE2 1 1 6 1279 1 1 11 HIS O O -3.799 4.223 2.240 1.00 . A A . 11 HIS O 1 1 6 1280 1 1 12 ASN C C -4.917 1.368 1.181 1.00 . A A . 12 ASN C 1 1 6 1281 1 1 12 ASN CA C -4.176 2.341 0.263 1.00 . A A . 12 ASN CA 1 1 6 1282 1 1 12 ASN CB C -3.941 1.725 -1.121 1.00 . A A . 12 ASN CB 1 1 6 1283 1 1 12 ASN CG C -5.218 1.483 -1.907 1.00 . A A . 12 ASN CG 1 1 6 1284 1 1 12 ASN H H -2.080 2.294 0.522 1.00 . A A . 12 ASN H 1 1 6 1285 1 1 12 ASN HA H -4.760 3.243 0.161 1.00 . A A . 12 ASN HA 1 1 6 1286 1 1 12 ASN HB2 H -3.315 2.389 -1.697 1.00 . A A . 12 ASN HB2 1 1 6 1287 1 1 12 ASN HB3 H -3.432 0.780 -1.001 1.00 . A A . 12 ASN HB3 1 1 6 1288 1 1 12 ASN HD21 H -5.103 3.295 -2.713 1.00 . A A . 12 ASN HD21 1 1 6 1289 1 1 12 ASN HD22 H -6.451 2.335 -3.210 1.00 . A A . 12 ASN HD22 1 1 6 1290 1 1 12 ASN N N -2.904 2.691 0.872 1.00 . A A . 12 ASN N 1 1 6 1291 1 1 12 ASN ND2 N -5.633 2.470 -2.685 1.00 . A A . 12 ASN ND2 1 1 6 1292 1 1 12 ASN O O -6.019 0.913 0.876 1.00 . A A . 12 ASN O 1 1 6 1293 1 1 12 ASN OD1 O -5.815 0.409 -1.829 1.00 . A A . 12 ASN OD1 1 1 6 1294 1 1 13 LYS C C -4.990 -1.247 2.668 1.00 . A A . 13 LYS C 1 1 6 1295 1 1 13 LYS CA C -4.826 0.131 3.303 1.00 . A A . 13 LYS CA 1 1 6 1296 1 1 13 LYS CB C -6.157 0.617 3.886 1.00 . A A . 13 LYS CB 1 1 6 1297 1 1 13 LYS CD C -7.385 2.366 5.205 1.00 . A A . 13 LYS CD 1 1 6 1298 1 1 13 LYS CE C -7.247 3.578 6.110 1.00 . A A . 13 LYS CE 1 1 6 1299 1 1 13 LYS CG C -6.032 1.879 4.725 1.00 . A A . 13 LYS CG 1 1 6 1300 1 1 13 LYS H H -3.474 1.587 2.565 1.00 . A A . 13 LYS H 1 1 6 1301 1 1 13 LYS HA H -4.108 0.051 4.106 1.00 . A A . 13 LYS HA 1 1 6 1302 1 1 13 LYS HB2 H -6.840 0.818 3.074 1.00 . A A . 13 LYS HB2 1 1 6 1303 1 1 13 LYS HB3 H -6.571 -0.163 4.507 1.00 . A A . 13 LYS HB3 1 1 6 1304 1 1 13 LYS HD2 H -7.987 2.634 4.350 1.00 . A A . 13 LYS HD2 1 1 6 1305 1 1 13 LYS HD3 H -7.866 1.572 5.753 1.00 . A A . 13 LYS HD3 1 1 6 1306 1 1 13 LYS HE2 H -6.684 3.292 6.985 1.00 . A A . 13 LYS HE2 1 1 6 1307 1 1 13 LYS HE3 H -6.712 4.350 5.577 1.00 . A A . 13 LYS HE3 1 1 6 1308 1 1 13 LYS HG2 H -5.416 1.667 5.585 1.00 . A A . 13 LYS HG2 1 1 6 1309 1 1 13 LYS HG3 H -5.569 2.651 4.129 1.00 . A A . 13 LYS HG3 1 1 6 1310 1 1 13 LYS HZ1 H -9.098 4.451 5.708 1.00 . A A . 13 LYS HZ1 1 1 6 1311 1 1 13 LYS HZ2 H -8.442 4.898 7.199 1.00 . A A . 13 LYS HZ2 1 1 6 1312 1 1 13 LYS HZ3 H -9.123 3.363 7.002 1.00 . A A . 13 LYS HZ3 1 1 6 1313 1 1 13 LYS N N -4.301 1.095 2.340 1.00 . A A . 13 LYS N 1 1 6 1314 1 1 13 LYS NZ N -8.569 4.109 6.535 1.00 . A A . 13 LYS NZ 1 1 6 1315 1 1 13 LYS O O -5.957 -1.953 2.955 1.00 . A A . 13 LYS O 1 1 6 1316 1 1 14 LYS C C -5.366 -3.405 0.720 1.00 . A A . 14 LYS C 1 1 6 1317 1 1 14 LYS CA C -3.970 -2.884 1.088 1.00 . A A . 14 LYS CA 1 1 6 1318 1 1 14 LYS CB C -3.152 -3.965 1.836 1.00 . A A . 14 LYS CB 1 1 6 1319 1 1 14 LYS CD C -2.974 -3.230 4.263 1.00 . A A . 14 LYS CD 1 1 6 1320 1 1 14 LYS CE C -1.457 -3.307 4.319 1.00 . A A . 14 LYS CE 1 1 6 1321 1 1 14 LYS CG C -3.564 -4.237 3.283 1.00 . A A . 14 LYS CG 1 1 6 1322 1 1 14 LYS H H -3.268 -0.982 1.695 1.00 . A A . 14 LYS H 1 1 6 1323 1 1 14 LYS HA H -3.457 -2.673 0.157 1.00 . A A . 14 LYS HA 1 1 6 1324 1 1 14 LYS HB2 H -3.241 -4.893 1.293 1.00 . A A . 14 LYS HB2 1 1 6 1325 1 1 14 LYS HB3 H -2.113 -3.667 1.834 1.00 . A A . 14 LYS HB3 1 1 6 1326 1 1 14 LYS HD2 H -3.261 -2.235 3.955 1.00 . A A . 14 LYS HD2 1 1 6 1327 1 1 14 LYS HD3 H -3.373 -3.431 5.245 1.00 . A A . 14 LYS HD3 1 1 6 1328 1 1 14 LYS HE2 H -1.060 -3.068 3.345 1.00 . A A . 14 LYS HE2 1 1 6 1329 1 1 14 LYS HE3 H -1.101 -2.583 5.036 1.00 . A A . 14 LYS HE3 1 1 6 1330 1 1 14 LYS HG2 H -4.637 -4.190 3.352 1.00 . A A . 14 LYS HG2 1 1 6 1331 1 1 14 LYS HG3 H -3.230 -5.228 3.558 1.00 . A A . 14 LYS HG3 1 1 6 1332 1 1 14 LYS HZ1 H -1.326 -5.375 4.054 1.00 . A A . 14 LYS HZ1 1 1 6 1333 1 1 14 LYS HZ2 H -1.316 -4.890 5.673 1.00 . A A . 14 LYS HZ2 1 1 6 1334 1 1 14 LYS HZ3 H 0.063 -4.680 4.719 1.00 . A A . 14 LYS HZ3 1 1 6 1335 1 1 14 LYS N N -4.009 -1.608 1.826 1.00 . A A . 14 LYS N 1 1 6 1336 1 1 14 LYS NZ N -0.977 -4.656 4.718 1.00 . A A . 14 LYS NZ 1 1 6 1337 1 1 14 LYS O O -5.912 -4.258 1.452 1.00 . A A . 14 LYS O 1 1 6 1338 1 1 14 LYS OXT O -5.909 -2.957 -0.312 1.00 . A A . 14 LYS OXT 1 1 7 1339 1 1 1 HIS C C 0.389 -1.106 -4.274 1.00 . A A . 1 HIS C 1 1 7 1340 1 1 1 HIS CA C 0.873 -2.534 -4.056 1.00 . A A . 1 HIS CA 1 1 7 1341 1 1 1 HIS CB C 2.404 -2.590 -4.171 1.00 . A A . 1 HIS CB 1 1 7 1342 1 1 1 HIS CD2 C 3.101 -5.027 -3.572 1.00 . A A . 1 HIS CD2 1 1 7 1343 1 1 1 HIS CE1 C 4.203 -4.597 -1.729 1.00 . A A . 1 HIS CE1 1 1 7 1344 1 1 1 HIS CG C 3.047 -3.688 -3.373 1.00 . A A . 1 HIS CG 1 1 7 1345 1 1 1 HIS H1 H -0.796 -3.410 -4.941 1.00 . A A . 1 HIS H1 1 1 7 1346 1 1 1 HIS H2 H 0.540 -4.436 -4.847 1.00 . A A . 1 HIS H2 1 1 7 1347 1 1 1 HIS H3 H 0.505 -3.196 -5.998 1.00 . A A . 1 HIS H3 1 1 7 1348 1 1 1 HIS HA H 0.588 -2.844 -3.066 1.00 . A A . 1 HIS HA 1 1 7 1349 1 1 1 HIS HB2 H 2.672 -2.735 -5.206 1.00 . A A . 1 HIS HB2 1 1 7 1350 1 1 1 HIS HB3 H 2.813 -1.649 -3.832 1.00 . A A . 1 HIS HB3 1 1 7 1351 1 1 1 HIS HD1 H 3.936 -2.573 -1.821 1.00 . A A . 1 HIS HD1 1 1 7 1352 1 1 1 HIS HD2 H 2.657 -5.571 -4.392 1.00 . A A . 1 HIS HD2 1 1 7 1353 1 1 1 HIS HE1 H 4.778 -4.714 -0.815 1.00 . A A . 1 HIS HE1 1 1 7 1354 1 1 1 HIS HE2 H 4.159 -6.492 -2.501 1.00 . A A . 1 HIS HE2 1 1 7 1355 1 1 1 HIS N N 0.241 -3.458 -5.026 1.00 . A A . 1 HIS N 1 1 7 1356 1 1 1 HIS ND1 N 3.750 -3.453 -2.210 1.00 . A A . 1 HIS ND1 1 1 7 1357 1 1 1 HIS NE2 N 3.822 -5.567 -2.536 1.00 . A A . 1 HIS NE2 1 1 7 1358 1 1 1 HIS O O 0.957 -0.365 -5.073 1.00 . A A . 1 HIS O 1 1 7 1359 1 1 2 GLN C C -0.521 1.637 -2.812 1.00 . A A . 2 GLN C 1 1 7 1360 1 1 2 GLN CA C -1.236 0.614 -3.688 1.00 . A A . 2 GLN CA 1 1 7 1361 1 1 2 GLN CB C -2.727 0.593 -3.348 1.00 . A A . 2 GLN CB 1 1 7 1362 1 1 2 GLN CD C -3.485 0.863 -5.737 1.00 . A A . 2 GLN CD 1 1 7 1363 1 1 2 GLN CG C -3.597 0.042 -4.465 1.00 . A A . 2 GLN CG 1 1 7 1364 1 1 2 GLN H H -1.076 -1.358 -2.935 1.00 . A A . 2 GLN H 1 1 7 1365 1 1 2 GLN HA H -1.124 0.912 -4.716 1.00 . A A . 2 GLN HA 1 1 7 1366 1 1 2 GLN HB2 H -2.876 -0.019 -2.470 1.00 . A A . 2 GLN HB2 1 1 7 1367 1 1 2 GLN HB3 H -3.050 1.601 -3.133 1.00 . A A . 2 GLN HB3 1 1 7 1368 1 1 2 GLN HE21 H -2.019 -0.302 -6.401 1.00 . A A . 2 GLN HE21 1 1 7 1369 1 1 2 GLN HE22 H -2.471 1.006 -7.443 1.00 . A A . 2 GLN HE22 1 1 7 1370 1 1 2 GLN HG2 H -3.291 -0.971 -4.678 1.00 . A A . 2 GLN HG2 1 1 7 1371 1 1 2 GLN HG3 H -4.628 0.046 -4.140 1.00 . A A . 2 GLN HG3 1 1 7 1372 1 1 2 GLN N N -0.663 -0.722 -3.559 1.00 . A A . 2 GLN N 1 1 7 1373 1 1 2 GLN NE2 N -2.569 0.483 -6.615 1.00 . A A . 2 GLN NE2 1 1 7 1374 1 1 2 GLN O O -0.508 1.515 -1.586 1.00 . A A . 2 GLN O 1 1 7 1375 1 1 2 GLN OE1 O -4.221 1.828 -5.936 1.00 . A A . 2 GLN OE1 1 1 7 1376 1 1 3 VAL C C 1.573 3.388 -1.610 1.00 . A A . 3 VAL C 1 1 7 1377 1 1 3 VAL CA C 0.718 3.784 -2.826 1.00 . A A . 3 VAL CA 1 1 7 1378 1 1 3 VAL CB C -0.338 4.831 -2.395 1.00 . A A . 3 VAL CB 1 1 7 1379 1 1 3 VAL CG1 C 0.320 6.162 -2.062 1.00 . A A . 3 VAL CG1 1 1 7 1380 1 1 3 VAL CG2 C -1.391 5.015 -3.479 1.00 . A A . 3 VAL CG2 1 1 7 1381 1 1 3 VAL H H 0.101 2.581 -4.455 1.00 . A A . 3 VAL H 1 1 7 1382 1 1 3 VAL HA H 1.362 4.249 -3.558 1.00 . A A . 3 VAL HA 1 1 7 1383 1 1 3 VAL HB H -0.831 4.467 -1.505 1.00 . A A . 3 VAL HB 1 1 7 1384 1 1 3 VAL HG11 H 0.844 6.531 -2.931 1.00 . A A . 3 VAL HG11 1 1 7 1385 1 1 3 VAL HG12 H 1.020 6.027 -1.252 1.00 . A A . 3 VAL HG12 1 1 7 1386 1 1 3 VAL HG13 H -0.436 6.875 -1.770 1.00 . A A . 3 VAL HG13 1 1 7 1387 1 1 3 VAL HG21 H -0.916 5.353 -4.388 1.00 . A A . 3 VAL HG21 1 1 7 1388 1 1 3 VAL HG22 H -2.114 5.750 -3.157 1.00 . A A . 3 VAL HG22 1 1 7 1389 1 1 3 VAL HG23 H -1.889 4.075 -3.660 1.00 . A A . 3 VAL HG23 1 1 7 1390 1 1 3 VAL N N 0.079 2.629 -3.475 1.00 . A A . 3 VAL N 1 1 7 1391 1 1 3 VAL O O 1.340 3.856 -0.499 1.00 . A A . 3 VAL O 1 1 7 1392 1 1 4 PRO C C 4.656 2.903 -0.492 1.00 . A A . 4 PRO C 1 1 7 1393 1 1 4 PRO CA C 3.431 2.028 -0.724 1.00 . A A . 4 PRO CA 1 1 7 1394 1 1 4 PRO CB C 3.874 0.647 -1.236 1.00 . A A . 4 PRO CB 1 1 7 1395 1 1 4 PRO CD C 2.938 1.872 -3.053 1.00 . A A . 4 PRO CD 1 1 7 1396 1 1 4 PRO CG C 3.219 0.485 -2.570 1.00 . A A . 4 PRO CG 1 1 7 1397 1 1 4 PRO HA H 2.888 1.913 0.201 1.00 . A A . 4 PRO HA 1 1 7 1398 1 1 4 PRO HB2 H 4.951 0.623 -1.323 1.00 . A A . 4 PRO HB2 1 1 7 1399 1 1 4 PRO HB3 H 3.549 -0.116 -0.543 1.00 . A A . 4 PRO HB3 1 1 7 1400 1 1 4 PRO HD2 H 3.824 2.318 -3.484 1.00 . A A . 4 PRO HD2 1 1 7 1401 1 1 4 PRO HD3 H 2.116 1.880 -3.752 1.00 . A A . 4 PRO HD3 1 1 7 1402 1 1 4 PRO HG2 H 3.880 -0.026 -3.251 1.00 . A A . 4 PRO HG2 1 1 7 1403 1 1 4 PRO HG3 H 2.294 -0.063 -2.452 1.00 . A A . 4 PRO HG3 1 1 7 1404 1 1 4 PRO N N 2.572 2.513 -1.800 1.00 . A A . 4 PRO N 1 1 7 1405 1 1 4 PRO O O 5.134 3.585 -1.402 1.00 . A A . 4 PRO O 1 1 7 1406 1 1 5 SER C C 7.497 2.449 1.240 1.00 . A A . 5 SER C 1 1 7 1407 1 1 5 SER CA C 6.423 3.516 1.059 1.00 . A A . 5 SER CA 1 1 7 1408 1 1 5 SER CB C 6.285 4.355 2.329 1.00 . A A . 5 SER CB 1 1 7 1409 1 1 5 SER H H 4.666 2.410 1.445 1.00 . A A . 5 SER H 1 1 7 1410 1 1 5 SER HA H 6.697 4.151 0.234 1.00 . A A . 5 SER HA 1 1 7 1411 1 1 5 SER HB2 H 6.051 3.708 3.162 1.00 . A A . 5 SER HB2 1 1 7 1412 1 1 5 SER HB3 H 7.216 4.866 2.522 1.00 . A A . 5 SER HB3 1 1 7 1413 1 1 5 SER HG H 4.832 5.226 1.331 1.00 . A A . 5 SER HG 1 1 7 1414 1 1 5 SER N N 5.161 2.875 0.733 1.00 . A A . 5 SER N 1 1 7 1415 1 1 5 SER O O 8.565 2.696 1.801 1.00 . A A . 5 SER O 1 1 7 1416 1 1 5 SER OG O 5.253 5.320 2.196 1.00 . A A . 5 SER OG 1 1 7 1417 1 1 6 GLY C C 7.458 -1.131 0.343 1.00 . A A . 6 GLY C 1 1 7 1418 1 1 6 GLY CA C 8.092 0.138 0.870 1.00 . A A . 6 GLY CA 1 1 7 1419 1 1 6 GLY H H 6.352 1.152 0.263 1.00 . A A . 6 GLY H 1 1 7 1420 1 1 6 GLY HA2 H 8.997 0.340 0.315 1.00 . A A . 6 GLY HA2 1 1 7 1421 1 1 6 GLY HA3 H 8.340 0.001 1.911 1.00 . A A . 6 GLY HA3 1 1 7 1422 1 1 6 GLY N N 7.198 1.263 0.740 1.00 . A A . 6 GLY N 1 1 7 1423 1 1 6 GLY O O 6.624 -1.070 -0.559 1.00 . A A . 6 GLY O 1 1 7 1424 1 1 7 PRO C C 5.895 -3.913 0.956 1.00 . A A . 7 PRO C 1 1 7 1425 1 1 7 PRO CA C 7.293 -3.590 0.430 1.00 . A A . 7 PRO CA 1 1 7 1426 1 1 7 PRO CB C 8.314 -4.580 0.984 1.00 . A A . 7 PRO CB 1 1 7 1427 1 1 7 PRO CD C 8.742 -2.459 2.032 1.00 . A A . 7 PRO CD 1 1 7 1428 1 1 7 PRO CG C 8.800 -3.951 2.245 1.00 . A A . 7 PRO CG 1 1 7 1429 1 1 7 PRO HA H 7.285 -3.645 -0.649 1.00 . A A . 7 PRO HA 1 1 7 1430 1 1 7 PRO HB2 H 7.831 -5.529 1.173 1.00 . A A . 7 PRO HB2 1 1 7 1431 1 1 7 PRO HB3 H 9.115 -4.712 0.274 1.00 . A A . 7 PRO HB3 1 1 7 1432 1 1 7 PRO HD2 H 8.362 -1.968 2.915 1.00 . A A . 7 PRO HD2 1 1 7 1433 1 1 7 PRO HD3 H 9.720 -2.077 1.779 1.00 . A A . 7 PRO HD3 1 1 7 1434 1 1 7 PRO HG2 H 8.157 -4.236 3.065 1.00 . A A . 7 PRO HG2 1 1 7 1435 1 1 7 PRO HG3 H 9.816 -4.261 2.442 1.00 . A A . 7 PRO HG3 1 1 7 1436 1 1 7 PRO N N 7.808 -2.300 0.899 1.00 . A A . 7 PRO N 1 1 7 1437 1 1 7 PRO O O 5.574 -5.075 1.206 1.00 . A A . 7 PRO O 1 1 7 1438 1 1 8 ASN C C 2.869 -1.842 1.257 1.00 . A A . 8 ASN C 1 1 7 1439 1 1 8 ASN CA C 3.695 -3.084 1.568 1.00 . A A . 8 ASN CA 1 1 7 1440 1 1 8 ASN CB C 3.704 -3.375 3.068 1.00 . A A . 8 ASN CB 1 1 7 1441 1 1 8 ASN CG C 2.320 -3.610 3.641 1.00 . A A . 8 ASN CG 1 1 7 1442 1 1 8 ASN H H 5.370 -1.978 0.913 1.00 . A A . 8 ASN H 1 1 7 1443 1 1 8 ASN HA H 3.277 -3.929 1.043 1.00 . A A . 8 ASN HA 1 1 7 1444 1 1 8 ASN HB2 H 4.297 -4.261 3.239 1.00 . A A . 8 ASN HB2 1 1 7 1445 1 1 8 ASN HB3 H 4.154 -2.540 3.587 1.00 . A A . 8 ASN HB3 1 1 7 1446 1 1 8 ASN HD21 H 2.467 -5.556 3.265 1.00 . A A . 8 ASN HD21 1 1 7 1447 1 1 8 ASN HD22 H 0.991 -5.041 4.006 1.00 . A A . 8 ASN HD22 1 1 7 1448 1 1 8 ASN N N 5.058 -2.892 1.104 1.00 . A A . 8 ASN N 1 1 7 1449 1 1 8 ASN ND2 N 1.882 -4.859 3.637 1.00 . A A . 8 ASN ND2 1 1 7 1450 1 1 8 ASN O O 3.356 -0.726 1.424 1.00 . A A . 8 ASN O 1 1 7 1451 1 1 8 ASN OD1 O 1.653 -2.677 4.091 1.00 . A A . 8 ASN OD1 1 1 7 1452 1 1 9 PRO C C 0.464 0.008 1.581 1.00 . A A . 9 PRO C 1 1 7 1453 1 1 9 PRO CA C 0.770 -0.883 0.390 1.00 . A A . 9 PRO CA 1 1 7 1454 1 1 9 PRO CB C -0.517 -1.529 -0.137 1.00 . A A . 9 PRO CB 1 1 7 1455 1 1 9 PRO CD C 0.938 -3.301 0.593 1.00 . A A . 9 PRO CD 1 1 7 1456 1 1 9 PRO CG C -0.204 -2.976 -0.324 1.00 . A A . 9 PRO CG 1 1 7 1457 1 1 9 PRO HA H 1.225 -0.291 -0.390 1.00 . A A . 9 PRO HA 1 1 7 1458 1 1 9 PRO HB2 H -1.311 -1.388 0.581 1.00 . A A . 9 PRO HB2 1 1 7 1459 1 1 9 PRO HB3 H -0.793 -1.065 -1.072 1.00 . A A . 9 PRO HB3 1 1 7 1460 1 1 9 PRO HD2 H 0.567 -3.675 1.536 1.00 . A A . 9 PRO HD2 1 1 7 1461 1 1 9 PRO HD3 H 1.593 -4.021 0.132 1.00 . A A . 9 PRO HD3 1 1 7 1462 1 1 9 PRO HG2 H -1.066 -3.572 -0.067 1.00 . A A . 9 PRO HG2 1 1 7 1463 1 1 9 PRO HG3 H 0.079 -3.158 -1.347 1.00 . A A . 9 PRO HG3 1 1 7 1464 1 1 9 PRO N N 1.621 -2.010 0.771 1.00 . A A . 9 PRO N 1 1 7 1465 1 1 9 PRO O O -0.079 -0.451 2.588 1.00 . A A . 9 PRO O 1 1 7 1466 1 1 10 LEU C C -0.816 2.649 2.643 1.00 . A A . 10 LEU C 1 1 7 1467 1 1 10 LEU CA C 0.639 2.203 2.568 1.00 . A A . 10 LEU CA 1 1 7 1468 1 1 10 LEU CB C 1.552 3.423 2.419 1.00 . A A . 10 LEU CB 1 1 7 1469 1 1 10 LEU CD1 C 2.033 3.869 4.842 1.00 . A A . 10 LEU CD1 1 1 7 1470 1 1 10 LEU CD2 C 2.179 5.731 3.178 1.00 . A A . 10 LEU CD2 1 1 7 1471 1 1 10 LEU CG C 1.462 4.445 3.555 1.00 . A A . 10 LEU CG 1 1 7 1472 1 1 10 LEU H H 1.195 1.597 0.617 1.00 . A A . 10 LEU H 1 1 7 1473 1 1 10 LEU HA H 0.896 1.678 3.475 1.00 . A A . 10 LEU HA 1 1 7 1474 1 1 10 LEU HB2 H 2.573 3.076 2.354 1.00 . A A . 10 LEU HB2 1 1 7 1475 1 1 10 LEU HB3 H 1.302 3.922 1.495 1.00 . A A . 10 LEU HB3 1 1 7 1476 1 1 10 LEU HD11 H 1.957 4.604 5.630 1.00 . A A . 10 LEU HD11 1 1 7 1477 1 1 10 LEU HD12 H 3.070 3.609 4.690 1.00 . A A . 10 LEU HD12 1 1 7 1478 1 1 10 LEU HD13 H 1.478 2.986 5.119 1.00 . A A . 10 LEU HD13 1 1 7 1479 1 1 10 LEU HD21 H 1.717 6.156 2.300 1.00 . A A . 10 LEU HD21 1 1 7 1480 1 1 10 LEU HD22 H 3.217 5.517 2.971 1.00 . A A . 10 LEU HD22 1 1 7 1481 1 1 10 LEU HD23 H 2.113 6.432 3.996 1.00 . A A . 10 LEU HD23 1 1 7 1482 1 1 10 LEU HG H 0.423 4.682 3.730 1.00 . A A . 10 LEU HG 1 1 7 1483 1 1 10 LEU N N 0.820 1.276 1.467 1.00 . A A . 10 LEU N 1 1 7 1484 1 1 10 LEU O O -1.241 3.529 1.890 1.00 . A A . 10 LEU O 1 1 7 1485 1 1 11 HIS C C -3.770 1.987 2.455 1.00 . A A . 11 HIS C 1 1 7 1486 1 1 11 HIS CA C -2.991 2.338 3.721 1.00 . A A . 11 HIS CA 1 1 7 1487 1 1 11 HIS CB C -3.190 3.815 4.101 1.00 . A A . 11 HIS CB 1 1 7 1488 1 1 11 HIS CD2 C -1.525 4.139 6.071 1.00 . A A . 11 HIS CD2 1 1 7 1489 1 1 11 HIS CE1 C -2.961 4.757 7.602 1.00 . A A . 11 HIS CE1 1 1 7 1490 1 1 11 HIS CG C -2.752 4.143 5.498 1.00 . A A . 11 HIS CG 1 1 7 1491 1 1 11 HIS H H -1.165 1.341 4.116 1.00 . A A . 11 HIS H 1 1 7 1492 1 1 11 HIS HA H -3.363 1.719 4.522 1.00 . A A . 11 HIS HA 1 1 7 1493 1 1 11 HIS HB2 H -2.623 4.433 3.422 1.00 . A A . 11 HIS HB2 1 1 7 1494 1 1 11 HIS HB3 H -4.237 4.064 4.015 1.00 . A A . 11 HIS HB3 1 1 7 1495 1 1 11 HIS HD1 H -4.602 4.645 6.380 1.00 . A A . 11 HIS HD1 1 1 7 1496 1 1 11 HIS HD2 H -0.592 3.882 5.588 1.00 . A A . 11 HIS HD2 1 1 7 1497 1 1 11 HIS HE1 H -3.390 5.079 8.540 1.00 . A A . 11 HIS HE1 1 1 7 1498 1 1 11 HIS HE2 H -1.000 4.445 8.080 1.00 . A A . 11 HIS HE2 1 1 7 1499 1 1 11 HIS N N -1.573 2.033 3.550 1.00 . A A . 11 HIS N 1 1 7 1500 1 1 11 HIS ND1 N -3.628 4.536 6.486 1.00 . A A . 11 HIS ND1 1 1 7 1501 1 1 11 HIS NE2 N -1.683 4.523 7.380 1.00 . A A . 11 HIS NE2 1 1 7 1502 1 1 11 HIS O O -3.362 1.099 1.702 1.00 . A A . 11 HIS O 1 1 7 1503 1 1 12 ASN C C -6.483 1.060 1.228 1.00 . A A . 12 ASN C 1 1 7 1504 1 1 12 ASN CA C -5.788 2.415 1.106 1.00 . A A . 12 ASN CA 1 1 7 1505 1 1 12 ASN CB C -5.003 2.506 -0.219 1.00 . A A . 12 ASN CB 1 1 7 1506 1 1 12 ASN CG C -5.892 2.502 -1.458 1.00 . A A . 12 ASN CG 1 1 7 1507 1 1 12 ASN H H -5.183 3.327 2.915 1.00 . A A . 12 ASN H 1 1 7 1508 1 1 12 ASN HA H -6.546 3.186 1.112 1.00 . A A . 12 ASN HA 1 1 7 1509 1 1 12 ASN HB2 H -4.426 3.416 -0.223 1.00 . A A . 12 ASN HB2 1 1 7 1510 1 1 12 ASN HB3 H -4.329 1.663 -0.284 1.00 . A A . 12 ASN HB3 1 1 7 1511 1 1 12 ASN HD21 H -5.684 0.529 -1.668 1.00 . A A . 12 ASN HD21 1 1 7 1512 1 1 12 ASN HD22 H -6.682 1.317 -2.843 1.00 . A A . 12 ASN HD22 1 1 7 1513 1 1 12 ASN N N -4.913 2.652 2.259 1.00 . A A . 12 ASN N 1 1 7 1514 1 1 12 ASN ND2 N -6.106 1.335 -2.051 1.00 . A A . 12 ASN ND2 1 1 7 1515 1 1 12 ASN O O -7.267 0.674 0.369 1.00 . A A . 12 ASN O 1 1 7 1516 1 1 12 ASN OD1 O -6.369 3.553 -1.894 1.00 . A A . 12 ASN OD1 1 1 7 1517 1 1 13 LYS C C -6.209 -1.901 1.417 1.00 . A A . 13 LYS C 1 1 7 1518 1 1 13 LYS CA C -6.721 -0.994 2.540 1.00 . A A . 13 LYS CA 1 1 7 1519 1 1 13 LYS CB C -8.258 -0.990 2.600 1.00 . A A . 13 LYS CB 1 1 7 1520 1 1 13 LYS CD C -10.389 -2.252 3.004 1.00 . A A . 13 LYS CD 1 1 7 1521 1 1 13 LYS CE C -11.006 -3.582 3.404 1.00 . A A . 13 LYS CE 1 1 7 1522 1 1 13 LYS CG C -8.874 -2.308 3.045 1.00 . A A . 13 LYS CG 1 1 7 1523 1 1 13 LYS H H -5.656 0.769 3.028 1.00 . A A . 13 LYS H 1 1 7 1524 1 1 13 LYS HA H -6.329 -1.353 3.481 1.00 . A A . 13 LYS HA 1 1 7 1525 1 1 13 LYS HB2 H -8.573 -0.223 3.292 1.00 . A A . 13 LYS HB2 1 1 7 1526 1 1 13 LYS HB3 H -8.640 -0.754 1.619 1.00 . A A . 13 LYS HB3 1 1 7 1527 1 1 13 LYS HD2 H -10.727 -1.492 3.690 1.00 . A A . 13 LYS HD2 1 1 7 1528 1 1 13 LYS HD3 H -10.704 -2.005 2.001 1.00 . A A . 13 LYS HD3 1 1 7 1529 1 1 13 LYS HE2 H -10.687 -4.338 2.703 1.00 . A A . 13 LYS HE2 1 1 7 1530 1 1 13 LYS HE3 H -10.656 -3.839 4.392 1.00 . A A . 13 LYS HE3 1 1 7 1531 1 1 13 LYS HG2 H -8.533 -3.095 2.388 1.00 . A A . 13 LYS HG2 1 1 7 1532 1 1 13 LYS HG3 H -8.560 -2.518 4.056 1.00 . A A . 13 LYS HG3 1 1 7 1533 1 1 13 LYS HZ1 H -12.846 -3.270 2.471 1.00 . A A . 13 LYS HZ1 1 1 7 1534 1 1 13 LYS HZ2 H -12.819 -2.815 4.097 1.00 . A A . 13 LYS HZ2 1 1 7 1535 1 1 13 LYS HZ3 H -12.885 -4.452 3.679 1.00 . A A . 13 LYS HZ3 1 1 7 1536 1 1 13 LYS N N -6.214 0.359 2.332 1.00 . A A . 13 LYS N 1 1 7 1537 1 1 13 LYS NZ N -12.491 -3.525 3.413 1.00 . A A . 13 LYS NZ 1 1 7 1538 1 1 13 LYS O O -6.935 -2.756 0.911 1.00 . A A . 13 LYS O 1 1 7 1539 1 1 14 LYS C C -5.182 -2.494 -1.284 1.00 . A A . 14 LYS C 1 1 7 1540 1 1 14 LYS CA C -4.269 -2.369 -0.060 1.00 . A A . 14 LYS CA 1 1 7 1541 1 1 14 LYS CB C -3.699 -3.742 0.367 1.00 . A A . 14 LYS CB 1 1 7 1542 1 1 14 LYS CD C -4.075 -6.049 1.313 1.00 . A A . 14 LYS CD 1 1 7 1543 1 1 14 LYS CE C -3.014 -5.922 2.396 1.00 . A A . 14 LYS CE 1 1 7 1544 1 1 14 LYS CG C -4.708 -4.708 0.979 1.00 . A A . 14 LYS CG 1 1 7 1545 1 1 14 LYS H H -4.421 -1.026 1.564 1.00 . A A . 14 LYS H 1 1 7 1546 1 1 14 LYS HA H -3.435 -1.740 -0.345 1.00 . A A . 14 LYS HA 1 1 7 1547 1 1 14 LYS HB2 H -3.271 -4.220 -0.500 1.00 . A A . 14 LYS HB2 1 1 7 1548 1 1 14 LYS HB3 H -2.912 -3.576 1.091 1.00 . A A . 14 LYS HB3 1 1 7 1549 1 1 14 LYS HD2 H -4.847 -6.722 1.656 1.00 . A A . 14 LYS HD2 1 1 7 1550 1 1 14 LYS HD3 H -3.619 -6.450 0.419 1.00 . A A . 14 LYS HD3 1 1 7 1551 1 1 14 LYS HE2 H -2.269 -5.212 2.072 1.00 . A A . 14 LYS HE2 1 1 7 1552 1 1 14 LYS HE3 H -3.483 -5.565 3.300 1.00 . A A . 14 LYS HE3 1 1 7 1553 1 1 14 LYS HG2 H -5.101 -4.273 1.885 1.00 . A A . 14 LYS HG2 1 1 7 1554 1 1 14 LYS HG3 H -5.512 -4.866 0.277 1.00 . A A . 14 LYS HG3 1 1 7 1555 1 1 14 LYS HZ1 H -1.929 -7.605 1.803 1.00 . A A . 14 LYS HZ1 1 1 7 1556 1 1 14 LYS HZ2 H -3.037 -7.907 3.044 1.00 . A A . 14 LYS HZ2 1 1 7 1557 1 1 14 LYS HZ3 H -1.594 -7.094 3.380 1.00 . A A . 14 LYS HZ3 1 1 7 1558 1 1 14 LYS N N -4.937 -1.686 1.055 1.00 . A A . 14 LYS N 1 1 7 1559 1 1 14 LYS NZ N -2.348 -7.222 2.676 1.00 . A A . 14 LYS NZ 1 1 7 1560 1 1 14 LYS O O -5.615 -1.447 -1.809 1.00 . A A . 14 LYS O 1 1 7 1561 1 1 14 LYS OXT O -5.438 -3.627 -1.741 1.00 . A A . 14 LYS OXT 1 1 8 1562 1 1 1 HIS C C 0.137 -0.887 -4.416 1.00 . A A . 1 HIS C 1 1 8 1563 1 1 1 HIS CA C 0.417 -2.292 -3.895 1.00 . A A . 1 HIS CA 1 1 8 1564 1 1 1 HIS CB C 1.875 -2.687 -4.173 1.00 . A A . 1 HIS CB 1 1 8 1565 1 1 1 HIS CD2 C 1.963 -4.971 -2.929 1.00 . A A . 1 HIS CD2 1 1 8 1566 1 1 1 HIS CE1 C 3.745 -4.605 -1.711 1.00 . A A . 1 HIS CE1 1 1 8 1567 1 1 1 HIS CG C 2.409 -3.728 -3.230 1.00 . A A . 1 HIS CG 1 1 8 1568 1 1 1 HIS H1 H -1.503 -3.010 -4.282 1.00 . A A . 1 HIS H1 1 1 8 1569 1 1 1 HIS H2 H -0.334 -4.224 -4.172 1.00 . A A . 1 HIS H2 1 1 8 1570 1 1 1 HIS H3 H -0.413 -3.251 -5.551 1.00 . A A . 1 HIS H3 1 1 8 1571 1 1 1 HIS HA H 0.248 -2.300 -2.827 1.00 . A A . 1 HIS HA 1 1 8 1572 1 1 1 HIS HB2 H 1.949 -3.079 -5.175 1.00 . A A . 1 HIS HB2 1 1 8 1573 1 1 1 HIS HB3 H 2.498 -1.809 -4.088 1.00 . A A . 1 HIS HB3 1 1 8 1574 1 1 1 HIS HD1 H 4.117 -2.741 -2.477 1.00 . A A . 1 HIS HD1 1 1 8 1575 1 1 1 HIS HD2 H 1.099 -5.461 -3.354 1.00 . A A . 1 HIS HD2 1 1 8 1576 1 1 1 HIS HE1 H 4.535 -4.720 -0.976 1.00 . A A . 1 HIS HE1 1 1 8 1577 1 1 1 HIS HE2 H 2.860 -6.447 -1.740 1.00 . A A . 1 HIS HE2 1 1 8 1578 1 1 1 HIS N N -0.520 -3.262 -4.514 1.00 . A A . 1 HIS N 1 1 8 1579 1 1 1 HIS ND1 N 3.533 -3.533 -2.453 1.00 . A A . 1 HIS ND1 1 1 8 1580 1 1 1 HIS NE2 N 2.808 -5.493 -1.981 1.00 . A A . 1 HIS NE2 1 1 8 1581 1 1 1 HIS O O 0.814 -0.395 -5.316 1.00 . A A . 1 HIS O 1 1 8 1582 1 1 2 GLN C C -0.314 2.152 -4.146 1.00 . A A . 2 GLN C 1 1 8 1583 1 1 2 GLN CA C -1.366 1.047 -4.256 1.00 . A A . 2 GLN CA 1 1 8 1584 1 1 2 GLN CB C -2.605 1.411 -3.430 1.00 . A A . 2 GLN CB 1 1 8 1585 1 1 2 GLN CD C -3.828 2.603 -5.284 1.00 . A A . 2 GLN CD 1 1 8 1586 1 1 2 GLN CG C -3.296 2.691 -3.870 1.00 . A A . 2 GLN CG 1 1 8 1587 1 1 2 GLN H H -1.290 -0.677 -3.042 1.00 . A A . 2 GLN H 1 1 8 1588 1 1 2 GLN HA H -1.659 0.950 -5.290 1.00 . A A . 2 GLN HA 1 1 8 1589 1 1 2 GLN HB2 H -3.317 0.603 -3.502 1.00 . A A . 2 GLN HB2 1 1 8 1590 1 1 2 GLN HB3 H -2.308 1.521 -2.396 1.00 . A A . 2 GLN HB3 1 1 8 1591 1 1 2 GLN HE21 H -5.534 1.838 -4.615 1.00 . A A . 2 GLN HE21 1 1 8 1592 1 1 2 GLN HE22 H -5.412 2.027 -6.331 1.00 . A A . 2 GLN HE22 1 1 8 1593 1 1 2 GLN HG2 H -4.122 2.889 -3.203 1.00 . A A . 2 GLN HG2 1 1 8 1594 1 1 2 GLN HG3 H -2.588 3.504 -3.817 1.00 . A A . 2 GLN HG3 1 1 8 1595 1 1 2 GLN N N -0.861 -0.250 -3.813 1.00 . A A . 2 GLN N 1 1 8 1596 1 1 2 GLN NE2 N -5.048 2.113 -5.424 1.00 . A A . 2 GLN NE2 1 1 8 1597 1 1 2 GLN O O 0.330 2.509 -5.133 1.00 . A A . 2 GLN O 1 1 8 1598 1 1 2 GLN OE1 O -3.146 2.970 -6.241 1.00 . A A . 2 GLN OE1 1 1 8 1599 1 1 3 VAL C C 1.703 3.545 -1.528 1.00 . A A . 3 VAL C 1 1 8 1600 1 1 3 VAL CA C 0.783 3.800 -2.724 1.00 . A A . 3 VAL CA 1 1 8 1601 1 1 3 VAL CB C 0.011 5.123 -2.517 1.00 . A A . 3 VAL CB 1 1 8 1602 1 1 3 VAL CG1 C -0.449 5.690 -3.853 1.00 . A A . 3 VAL CG1 1 1 8 1603 1 1 3 VAL CG2 C -1.186 4.907 -1.598 1.00 . A A . 3 VAL CG2 1 1 8 1604 1 1 3 VAL H H -0.636 2.327 -2.184 1.00 . A A . 3 VAL H 1 1 8 1605 1 1 3 VAL HA H 1.388 3.901 -3.610 1.00 . A A . 3 VAL HA 1 1 8 1606 1 1 3 VAL HB H 0.674 5.838 -2.053 1.00 . A A . 3 VAL HB 1 1 8 1607 1 1 3 VAL HG11 H -1.086 4.973 -4.348 1.00 . A A . 3 VAL HG11 1 1 8 1608 1 1 3 VAL HG12 H 0.411 5.895 -4.472 1.00 . A A . 3 VAL HG12 1 1 8 1609 1 1 3 VAL HG13 H -0.998 6.605 -3.686 1.00 . A A . 3 VAL HG13 1 1 8 1610 1 1 3 VAL HG21 H -1.840 4.164 -2.028 1.00 . A A . 3 VAL HG21 1 1 8 1611 1 1 3 VAL HG22 H -1.725 5.836 -1.482 1.00 . A A . 3 VAL HG22 1 1 8 1612 1 1 3 VAL HG23 H -0.841 4.568 -0.632 1.00 . A A . 3 VAL HG23 1 1 8 1613 1 1 3 VAL N N -0.136 2.685 -2.943 1.00 . A A . 3 VAL N 1 1 8 1614 1 1 3 VAL O O 1.621 4.221 -0.502 1.00 . A A . 3 VAL O 1 1 8 1615 1 1 4 PRO C C 4.802 2.963 -0.550 1.00 . A A . 4 PRO C 1 1 8 1616 1 1 4 PRO CA C 3.505 2.162 -0.576 1.00 . A A . 4 PRO CA 1 1 8 1617 1 1 4 PRO CB C 3.813 0.692 -0.909 1.00 . A A . 4 PRO CB 1 1 8 1618 1 1 4 PRO CD C 2.803 1.718 -2.821 1.00 . A A . 4 PRO CD 1 1 8 1619 1 1 4 PRO CG C 3.088 0.394 -2.187 1.00 . A A . 4 PRO CG 1 1 8 1620 1 1 4 PRO HA H 3.029 2.220 0.390 1.00 . A A . 4 PRO HA 1 1 8 1621 1 1 4 PRO HB2 H 4.879 0.569 -1.028 1.00 . A A . 4 PRO HB2 1 1 8 1622 1 1 4 PRO HB3 H 3.465 0.060 -0.105 1.00 . A A . 4 PRO HB3 1 1 8 1623 1 1 4 PRO HD2 H 3.649 2.056 -3.402 1.00 . A A . 4 PRO HD2 1 1 8 1624 1 1 4 PRO HD3 H 1.910 1.671 -3.427 1.00 . A A . 4 PRO HD3 1 1 8 1625 1 1 4 PRO HG2 H 3.710 -0.205 -2.831 1.00 . A A . 4 PRO HG2 1 1 8 1626 1 1 4 PRO HG3 H 2.164 -0.123 -1.971 1.00 . A A . 4 PRO HG3 1 1 8 1627 1 1 4 PRO N N 2.599 2.558 -1.647 1.00 . A A . 4 PRO N 1 1 8 1628 1 1 4 PRO O O 5.229 3.518 -1.563 1.00 . A A . 4 PRO O 1 1 8 1629 1 1 5 SER C C 7.684 2.392 1.162 1.00 . A A . 5 SER C 1 1 8 1630 1 1 5 SER CA C 6.758 3.546 0.781 1.00 . A A . 5 SER CA 1 1 8 1631 1 1 5 SER CB C 6.768 4.642 1.858 1.00 . A A . 5 SER CB 1 1 8 1632 1 1 5 SER H H 4.955 2.661 1.416 1.00 . A A . 5 SER H 1 1 8 1633 1 1 5 SER HA H 7.073 3.958 -0.165 1.00 . A A . 5 SER HA 1 1 8 1634 1 1 5 SER HB2 H 5.995 5.363 1.638 1.00 . A A . 5 SER HB2 1 1 8 1635 1 1 5 SER HB3 H 6.574 4.195 2.822 1.00 . A A . 5 SER HB3 1 1 8 1636 1 1 5 SER HG H 8.156 5.796 1.084 1.00 . A A . 5 SER HG 1 1 8 1637 1 1 5 SER N N 5.418 3.007 0.623 1.00 . A A . 5 SER N 1 1 8 1638 1 1 5 SER O O 8.804 2.583 1.644 1.00 . A A . 5 SER O 1 1 8 1639 1 1 5 SER OG O 8.016 5.318 1.911 1.00 . A A . 5 SER OG 1 1 8 1640 1 1 6 GLY C C 7.211 -1.230 0.647 1.00 . A A . 6 GLY C 1 1 8 1641 1 1 6 GLY CA C 7.882 -0.024 1.272 1.00 . A A . 6 GLY CA 1 1 8 1642 1 1 6 GLY H H 6.307 1.127 0.491 1.00 . A A . 6 GLY H 1 1 8 1643 1 1 6 GLY HA2 H 8.902 0.037 0.923 1.00 . A A . 6 GLY HA2 1 1 8 1644 1 1 6 GLY HA3 H 7.881 -0.139 2.344 1.00 . A A . 6 GLY HA3 1 1 8 1645 1 1 6 GLY N N 7.181 1.191 0.926 1.00 . A A . 6 GLY N 1 1 8 1646 1 1 6 GLY O O 6.379 -1.073 -0.250 1.00 . A A . 6 GLY O 1 1 8 1647 1 1 7 PRO C C 5.525 -3.953 1.005 1.00 . A A . 7 PRO C 1 1 8 1648 1 1 7 PRO CA C 6.965 -3.685 0.560 1.00 . A A . 7 PRO CA 1 1 8 1649 1 1 7 PRO CB C 7.899 -4.758 1.121 1.00 . A A . 7 PRO CB 1 1 8 1650 1 1 7 PRO CD C 8.493 -2.710 2.193 1.00 . A A . 7 PRO CD 1 1 8 1651 1 1 7 PRO CG C 8.369 -4.192 2.416 1.00 . A A . 7 PRO CG 1 1 8 1652 1 1 7 PRO HA H 7.010 -3.698 -0.517 1.00 . A A . 7 PRO HA 1 1 8 1653 1 1 7 PRO HB2 H 7.350 -5.678 1.263 1.00 . A A . 7 PRO HB2 1 1 8 1654 1 1 7 PRO HB3 H 8.719 -4.921 0.439 1.00 . A A . 7 PRO HB3 1 1 8 1655 1 1 7 PRO HD2 H 8.224 -2.168 3.085 1.00 . A A . 7 PRO HD2 1 1 8 1656 1 1 7 PRO HD3 H 9.497 -2.458 1.886 1.00 . A A . 7 PRO HD3 1 1 8 1657 1 1 7 PRO HG2 H 7.644 -4.396 3.191 1.00 . A A . 7 PRO HG2 1 1 8 1658 1 1 7 PRO HG3 H 9.328 -4.615 2.677 1.00 . A A . 7 PRO HG3 1 1 8 1659 1 1 7 PRO N N 7.531 -2.444 1.107 1.00 . A A . 7 PRO N 1 1 8 1660 1 1 7 PRO O O 5.148 -5.102 1.226 1.00 . A A . 7 PRO O 1 1 8 1661 1 1 8 ASN C C 2.594 -1.708 1.327 1.00 . A A . 8 ASN C 1 1 8 1662 1 1 8 ASN CA C 3.315 -3.038 1.496 1.00 . A A . 8 ASN CA 1 1 8 1663 1 1 8 ASN CB C 3.207 -3.529 2.943 1.00 . A A . 8 ASN CB 1 1 8 1664 1 1 8 ASN CG C 1.779 -3.561 3.460 1.00 . A A . 8 ASN CG 1 1 8 1665 1 1 8 ASN H H 5.078 -2.001 0.951 1.00 . A A . 8 ASN H 1 1 8 1666 1 1 8 ASN HA H 2.862 -3.767 0.840 1.00 . A A . 8 ASN HA 1 1 8 1667 1 1 8 ASN HB2 H 3.611 -4.530 2.996 1.00 . A A . 8 ASN HB2 1 1 8 1668 1 1 8 ASN HB3 H 3.788 -2.878 3.581 1.00 . A A . 8 ASN HB3 1 1 8 1669 1 1 8 ASN HD21 H 1.997 -1.767 4.280 1.00 . A A . 8 ASN HD21 1 1 8 1670 1 1 8 ASN HD22 H 0.449 -2.505 4.487 1.00 . A A . 8 ASN HD22 1 1 8 1671 1 1 8 ASN N N 4.719 -2.900 1.117 1.00 . A A . 8 ASN N 1 1 8 1672 1 1 8 ASN ND2 N 1.366 -2.505 4.143 1.00 . A A . 8 ASN ND2 1 1 8 1673 1 1 8 ASN O O 3.110 -0.669 1.736 1.00 . A A . 8 ASN O 1 1 8 1674 1 1 8 ASN OD1 O 1.056 -4.537 3.261 1.00 . A A . 8 ASN OD1 1 1 8 1675 1 1 9 PRO C C 0.372 0.300 1.702 1.00 . A A . 9 PRO C 1 1 8 1676 1 1 9 PRO CA C 0.627 -0.504 0.435 1.00 . A A . 9 PRO CA 1 1 8 1677 1 1 9 PRO CB C -0.698 -1.011 -0.153 1.00 . A A . 9 PRO CB 1 1 8 1678 1 1 9 PRO CD C 0.718 -2.919 0.186 1.00 . A A . 9 PRO CD 1 1 8 1679 1 1 9 PRO CG C -0.716 -2.483 0.099 1.00 . A A . 9 PRO CG 1 1 8 1680 1 1 9 PRO HA H 1.121 0.127 -0.288 1.00 . A A . 9 PRO HA 1 1 8 1681 1 1 9 PRO HB2 H -1.520 -0.520 0.346 1.00 . A A . 9 PRO HB2 1 1 8 1682 1 1 9 PRO HB3 H -0.732 -0.791 -1.210 1.00 . A A . 9 PRO HB3 1 1 8 1683 1 1 9 PRO HD2 H 0.820 -3.742 0.878 1.00 . A A . 9 PRO HD2 1 1 8 1684 1 1 9 PRO HD3 H 1.091 -3.195 -0.789 1.00 . A A . 9 PRO HD3 1 1 8 1685 1 1 9 PRO HG2 H -1.225 -2.688 1.030 1.00 . A A . 9 PRO HG2 1 1 8 1686 1 1 9 PRO HG3 H -1.212 -2.987 -0.716 1.00 . A A . 9 PRO HG3 1 1 8 1687 1 1 9 PRO N N 1.403 -1.720 0.691 1.00 . A A . 9 PRO N 1 1 8 1688 1 1 9 PRO O O -0.375 -0.124 2.584 1.00 . A A . 9 PRO O 1 1 8 1689 1 1 10 LEU C C -0.459 3.052 2.876 1.00 . A A . 10 LEU C 1 1 8 1690 1 1 10 LEU CA C 0.877 2.325 2.937 1.00 . A A . 10 LEU CA 1 1 8 1691 1 1 10 LEU CB C 2.029 3.334 2.986 1.00 . A A . 10 LEU CB 1 1 8 1692 1 1 10 LEU CD1 C 2.142 3.498 5.491 1.00 . A A . 10 LEU CD1 1 1 8 1693 1 1 10 LEU CD2 C 3.144 5.296 4.072 1.00 . A A . 10 LEU CD2 1 1 8 1694 1 1 10 LEU CG C 2.020 4.280 4.191 1.00 . A A . 10 LEU CG 1 1 8 1695 1 1 10 LEU H H 1.581 1.737 1.040 1.00 . A A . 10 LEU H 1 1 8 1696 1 1 10 LEU HA H 0.909 1.704 3.819 1.00 . A A . 10 LEU HA 1 1 8 1697 1 1 10 LEU HB2 H 2.957 2.785 2.995 1.00 . A A . 10 LEU HB2 1 1 8 1698 1 1 10 LEU HB3 H 1.993 3.932 2.089 1.00 . A A . 10 LEU HB3 1 1 8 1699 1 1 10 LEU HD11 H 2.156 4.184 6.324 1.00 . A A . 10 LEU HD11 1 1 8 1700 1 1 10 LEU HD12 H 3.056 2.924 5.481 1.00 . A A . 10 LEU HD12 1 1 8 1701 1 1 10 LEU HD13 H 1.299 2.830 5.590 1.00 . A A . 10 LEU HD13 1 1 8 1702 1 1 10 LEU HD21 H 3.123 5.956 4.928 1.00 . A A . 10 LEU HD21 1 1 8 1703 1 1 10 LEU HD22 H 3.015 5.873 3.169 1.00 . A A . 10 LEU HD22 1 1 8 1704 1 1 10 LEU HD23 H 4.092 4.780 4.039 1.00 . A A . 10 LEU HD23 1 1 8 1705 1 1 10 LEU HG H 1.082 4.816 4.212 1.00 . A A . 10 LEU HG 1 1 8 1706 1 1 10 LEU N N 1.013 1.457 1.782 1.00 . A A . 10 LEU N 1 1 8 1707 1 1 10 LEU O O -0.598 4.037 2.148 1.00 . A A . 10 LEU O 1 1 8 1708 1 1 11 HIS C C -3.520 2.683 2.342 1.00 . A A . 11 HIS C 1 1 8 1709 1 1 11 HIS CA C -2.802 3.064 3.631 1.00 . A A . 11 HIS CA 1 1 8 1710 1 1 11 HIS CB C -2.846 4.583 3.850 1.00 . A A . 11 HIS CB 1 1 8 1711 1 1 11 HIS CD2 C -2.772 4.685 6.439 1.00 . A A . 11 HIS CD2 1 1 8 1712 1 1 11 HIS CE1 C -1.070 6.044 6.662 1.00 . A A . 11 HIS CE1 1 1 8 1713 1 1 11 HIS CG C -2.345 5.006 5.197 1.00 . A A . 11 HIS CG 1 1 8 1714 1 1 11 HIS H H -1.222 1.786 4.219 1.00 . A A . 11 HIS H 1 1 8 1715 1 1 11 HIS HA H -3.321 2.586 4.449 1.00 . A A . 11 HIS HA 1 1 8 1716 1 1 11 HIS HB2 H -2.235 5.066 3.102 1.00 . A A . 11 HIS HB2 1 1 8 1717 1 1 11 HIS HB3 H -3.866 4.925 3.750 1.00 . A A . 11 HIS HB3 1 1 8 1718 1 1 11 HIS HD1 H -0.753 6.279 4.654 1.00 . A A . 11 HIS HD1 1 1 8 1719 1 1 11 HIS HD2 H -3.594 4.028 6.683 1.00 . A A . 11 HIS HD2 1 1 8 1720 1 1 11 HIS HE1 H -0.299 6.664 7.097 1.00 . A A . 11 HIS HE1 1 1 8 1721 1 1 11 HIS HE2 H -2.036 5.303 8.308 1.00 . A A . 11 HIS HE2 1 1 8 1722 1 1 11 HIS N N -1.431 2.547 3.637 1.00 . A A . 11 HIS N 1 1 8 1723 1 1 11 HIS ND1 N -1.278 5.861 5.372 1.00 . A A . 11 HIS ND1 1 1 8 1724 1 1 11 HIS NE2 N -1.963 5.343 7.329 1.00 . A A . 11 HIS NE2 1 1 8 1725 1 1 11 HIS O O -2.886 2.324 1.348 1.00 . A A . 11 HIS O 1 1 8 1726 1 1 12 ASN C C -5.695 0.763 1.158 1.00 . A A . 12 ASN C 1 1 8 1727 1 1 12 ASN CA C -5.723 2.290 1.293 1.00 . A A . 12 ASN CA 1 1 8 1728 1 1 12 ASN CB C -5.335 2.968 -0.033 1.00 . A A . 12 ASN CB 1 1 8 1729 1 1 12 ASN CG C -6.403 2.838 -1.111 1.00 . A A . 12 ASN CG 1 1 8 1730 1 1 12 ASN H H -5.275 3.046 3.222 1.00 . A A . 12 ASN H 1 1 8 1731 1 1 12 ASN HA H -6.730 2.584 1.551 1.00 . A A . 12 ASN HA 1 1 8 1732 1 1 12 ASN HB2 H -5.166 4.019 0.147 1.00 . A A . 12 ASN HB2 1 1 8 1733 1 1 12 ASN HB3 H -4.423 2.523 -0.402 1.00 . A A . 12 ASN HB3 1 1 8 1734 1 1 12 ASN HD21 H -7.851 2.960 0.245 1.00 . A A . 12 ASN HD21 1 1 8 1735 1 1 12 ASN HD22 H -8.369 2.763 -1.392 1.00 . A A . 12 ASN HD22 1 1 8 1736 1 1 12 ASN N N -4.852 2.720 2.398 1.00 . A A . 12 ASN N 1 1 8 1737 1 1 12 ASN ND2 N -7.667 2.859 -0.712 1.00 . A A . 12 ASN ND2 1 1 8 1738 1 1 12 ASN O O -6.438 0.177 0.370 1.00 . A A . 12 ASN O 1 1 8 1739 1 1 12 ASN OD1 O -6.092 2.751 -2.300 1.00 . A A . 12 ASN OD1 1 1 8 1740 1 1 13 LYS C C -4.399 -1.991 0.743 1.00 . A A . 13 LYS C 1 1 8 1741 1 1 13 LYS CA C -4.747 -1.324 2.076 1.00 . A A . 13 LYS CA 1 1 8 1742 1 1 13 LYS CB C -6.068 -1.883 2.616 1.00 . A A . 13 LYS CB 1 1 8 1743 1 1 13 LYS CD C -5.548 -1.306 5.011 1.00 . A A . 13 LYS CD 1 1 8 1744 1 1 13 LYS CE C -6.065 -0.645 6.277 1.00 . A A . 13 LYS CE 1 1 8 1745 1 1 13 LYS CG C -6.556 -1.199 3.884 1.00 . A A . 13 LYS CG 1 1 8 1746 1 1 13 LYS H H -4.200 0.678 2.474 1.00 . A A . 13 LYS H 1 1 8 1747 1 1 13 LYS HA H -3.963 -1.548 2.783 1.00 . A A . 13 LYS HA 1 1 8 1748 1 1 13 LYS HB2 H -6.829 -1.773 1.860 1.00 . A A . 13 LYS HB2 1 1 8 1749 1 1 13 LYS HB3 H -5.936 -2.932 2.831 1.00 . A A . 13 LYS HB3 1 1 8 1750 1 1 13 LYS HD2 H -5.351 -2.347 5.211 1.00 . A A . 13 LYS HD2 1 1 8 1751 1 1 13 LYS HD3 H -4.636 -0.815 4.708 1.00 . A A . 13 LYS HD3 1 1 8 1752 1 1 13 LYS HE2 H -5.297 -0.694 7.035 1.00 . A A . 13 LYS HE2 1 1 8 1753 1 1 13 LYS HE3 H -6.292 0.387 6.060 1.00 . A A . 13 LYS HE3 1 1 8 1754 1 1 13 LYS HG2 H -6.725 -0.154 3.674 1.00 . A A . 13 LYS HG2 1 1 8 1755 1 1 13 LYS HG3 H -7.480 -1.658 4.195 1.00 . A A . 13 LYS HG3 1 1 8 1756 1 1 13 LYS HZ1 H -8.038 -1.305 6.068 1.00 . A A . 13 LYS HZ1 1 1 8 1757 1 1 13 LYS HZ2 H -7.642 -0.813 7.636 1.00 . A A . 13 LYS HZ2 1 1 8 1758 1 1 13 LYS HZ3 H -7.082 -2.295 7.052 1.00 . A A . 13 LYS HZ3 1 1 8 1759 1 1 13 LYS N N -4.826 0.133 1.954 1.00 . A A . 13 LYS N 1 1 8 1760 1 1 13 LYS NZ N -7.291 -1.310 6.792 1.00 . A A . 13 LYS NZ 1 1 8 1761 1 1 13 LYS O O -3.947 -1.336 -0.199 1.00 . A A . 13 LYS O 1 1 8 1762 1 1 14 LYS C C -5.604 -4.555 -1.164 1.00 . A A . 14 LYS C 1 1 8 1763 1 1 14 LYS CA C -4.310 -4.053 -0.533 1.00 . A A . 14 LYS CA 1 1 8 1764 1 1 14 LYS CB C -3.333 -5.219 -0.267 1.00 . A A . 14 LYS CB 1 1 8 1765 1 1 14 LYS CD C -3.522 -5.783 2.191 1.00 . A A . 14 LYS CD 1 1 8 1766 1 1 14 LYS CE C -3.927 -6.842 3.205 1.00 . A A . 14 LYS CE 1 1 8 1767 1 1 14 LYS CG C -3.792 -6.243 0.769 1.00 . A A . 14 LYS CG 1 1 8 1768 1 1 14 LYS H H -4.981 -3.765 1.445 1.00 . A A . 14 LYS H 1 1 8 1769 1 1 14 LYS HA H -3.846 -3.370 -1.227 1.00 . A A . 14 LYS HA 1 1 8 1770 1 1 14 LYS HB2 H -3.167 -5.743 -1.194 1.00 . A A . 14 LYS HB2 1 1 8 1771 1 1 14 LYS HB3 H -2.393 -4.805 0.068 1.00 . A A . 14 LYS HB3 1 1 8 1772 1 1 14 LYS HD2 H -2.466 -5.586 2.296 1.00 . A A . 14 LYS HD2 1 1 8 1773 1 1 14 LYS HD3 H -4.080 -4.880 2.383 1.00 . A A . 14 LYS HD3 1 1 8 1774 1 1 14 LYS HE2 H -4.981 -7.046 3.091 1.00 . A A . 14 LYS HE2 1 1 8 1775 1 1 14 LYS HE3 H -3.365 -7.742 3.009 1.00 . A A . 14 LYS HE3 1 1 8 1776 1 1 14 LYS HG2 H -4.852 -6.405 0.653 1.00 . A A . 14 LYS HG2 1 1 8 1777 1 1 14 LYS HG3 H -3.265 -7.168 0.596 1.00 . A A . 14 LYS HG3 1 1 8 1778 1 1 14 LYS HZ1 H -3.937 -7.157 5.268 1.00 . A A . 14 LYS HZ1 1 1 8 1779 1 1 14 LYS HZ2 H -4.224 -5.553 4.818 1.00 . A A . 14 LYS HZ2 1 1 8 1780 1 1 14 LYS HZ3 H -2.660 -6.186 4.730 1.00 . A A . 14 LYS HZ3 1 1 8 1781 1 1 14 LYS N N -4.601 -3.298 0.673 1.00 . A A . 14 LYS N 1 1 8 1782 1 1 14 LYS NZ N -3.669 -6.404 4.602 1.00 . A A . 14 LYS NZ 1 1 8 1783 1 1 14 LYS O O -6.347 -5.305 -0.495 1.00 . A A . 14 LYS O 1 1 8 1784 1 1 14 LYS OXT O -5.880 -4.178 -2.324 1.00 . A A . 14 LYS OXT 1 1 9 1785 1 1 1 HIS C C 0.265 -0.567 -4.258 1.00 . A A . 1 HIS C 1 1 9 1786 1 1 1 HIS CA C 0.631 -2.027 -4.029 1.00 . A A . 1 HIS CA 1 1 9 1787 1 1 1 HIS CB C 2.150 -2.210 -4.187 1.00 . A A . 1 HIS CB 1 1 9 1788 1 1 1 HIS CD2 C 2.488 -4.732 -3.630 1.00 . A A . 1 HIS CD2 1 1 9 1789 1 1 1 HIS CE1 C 3.993 -4.506 -2.056 1.00 . A A . 1 HIS CE1 1 1 9 1790 1 1 1 HIS CG C 2.720 -3.406 -3.480 1.00 . A A . 1 HIS CG 1 1 9 1791 1 1 1 HIS H1 H -1.131 -2.762 -4.859 1.00 . A A . 1 HIS H1 1 1 9 1792 1 1 1 HIS H2 H 0.117 -3.894 -4.810 1.00 . A A . 1 HIS H2 1 1 9 1793 1 1 1 HIS H3 H 0.146 -2.654 -5.958 1.00 . A A . 1 HIS H3 1 1 9 1794 1 1 1 HIS HA H 0.343 -2.302 -3.025 1.00 . A A . 1 HIS HA 1 1 9 1795 1 1 1 HIS HB2 H 2.383 -2.310 -5.235 1.00 . A A . 1 HIS HB2 1 1 9 1796 1 1 1 HIS HB3 H 2.648 -1.332 -3.801 1.00 . A A . 1 HIS HB3 1 1 9 1797 1 1 1 HIS HD1 H 4.085 -2.466 -2.171 1.00 . A A . 1 HIS HD1 1 1 9 1798 1 1 1 HIS HD2 H 1.797 -5.186 -4.327 1.00 . A A . 1 HIS HD2 1 1 9 1799 1 1 1 HIS HE1 H 4.701 -4.726 -1.263 1.00 . A A . 1 HIS HE1 1 1 9 1800 1 1 1 HIS HE2 H 3.453 -6.362 -2.723 1.00 . A A . 1 HIS HE2 1 1 9 1801 1 1 1 HIS N N -0.107 -2.895 -4.977 1.00 . A A . 1 HIS N 1 1 9 1802 1 1 1 HIS ND1 N 3.672 -3.302 -2.487 1.00 . A A . 1 HIS ND1 1 1 9 1803 1 1 1 HIS NE2 N 3.290 -5.391 -2.732 1.00 . A A . 1 HIS NE2 1 1 9 1804 1 1 1 HIS O O 0.996 0.167 -4.927 1.00 . A A . 1 HIS O 1 1 9 1805 1 1 2 GLN C C -0.595 2.196 -2.973 1.00 . A A . 2 GLN C 1 1 9 1806 1 1 2 GLN CA C -1.336 1.222 -3.884 1.00 . A A . 2 GLN CA 1 1 9 1807 1 1 2 GLN CB C -2.839 1.319 -3.630 1.00 . A A . 2 GLN CB 1 1 9 1808 1 1 2 GLN CD C -5.155 0.835 -4.488 1.00 . A A . 2 GLN CD 1 1 9 1809 1 1 2 GLN CG C -3.676 0.547 -4.633 1.00 . A A . 2 GLN CG 1 1 9 1810 1 1 2 GLN H H -1.409 -0.775 -3.175 1.00 . A A . 2 GLN H 1 1 9 1811 1 1 2 GLN HA H -1.141 1.500 -4.910 1.00 . A A . 2 GLN HA 1 1 9 1812 1 1 2 GLN HB2 H -3.049 0.932 -2.643 1.00 . A A . 2 GLN HB2 1 1 9 1813 1 1 2 GLN HB3 H -3.133 2.357 -3.672 1.00 . A A . 2 GLN HB3 1 1 9 1814 1 1 2 GLN HE21 H -5.006 2.344 -5.769 1.00 . A A . 2 GLN HE21 1 1 9 1815 1 1 2 GLN HE22 H -6.583 2.064 -5.112 1.00 . A A . 2 GLN HE22 1 1 9 1816 1 1 2 GLN HG2 H -3.366 0.819 -5.629 1.00 . A A . 2 GLN HG2 1 1 9 1817 1 1 2 GLN HG3 H -3.514 -0.510 -4.482 1.00 . A A . 2 GLN HG3 1 1 9 1818 1 1 2 GLN N N -0.868 -0.147 -3.706 1.00 . A A . 2 GLN N 1 1 9 1819 1 1 2 GLN NE2 N -5.630 1.845 -5.196 1.00 . A A . 2 GLN NE2 1 1 9 1820 1 1 2 GLN O O -0.648 2.075 -1.748 1.00 . A A . 2 GLN O 1 1 9 1821 1 1 2 GLN OE1 O -5.862 0.159 -3.740 1.00 . A A . 2 GLN OE1 1 1 9 1822 1 1 3 VAL C C 1.549 3.765 -1.654 1.00 . A A . 3 VAL C 1 1 9 1823 1 1 3 VAL CA C 0.834 4.227 -2.933 1.00 . A A . 3 VAL CA 1 1 9 1824 1 1 3 VAL CB C -0.097 5.412 -2.592 1.00 . A A . 3 VAL CB 1 1 9 1825 1 1 3 VAL CG1 C 0.715 6.663 -2.281 1.00 . A A . 3 VAL CG1 1 1 9 1826 1 1 3 VAL CG2 C -1.075 5.680 -3.727 1.00 . A A . 3 VAL CG2 1 1 9 1827 1 1 3 VAL H H 0.127 3.112 -4.590 1.00 . A A . 3 VAL H 1 1 9 1828 1 1 3 VAL HA H 1.581 4.587 -3.625 1.00 . A A . 3 VAL HA 1 1 9 1829 1 1 3 VAL HB H -0.667 5.153 -1.711 1.00 . A A . 3 VAL HB 1 1 9 1830 1 1 3 VAL HG11 H 1.369 6.467 -1.443 1.00 . A A . 3 VAL HG11 1 1 9 1831 1 1 3 VAL HG12 H 0.047 7.474 -2.032 1.00 . A A . 3 VAL HG12 1 1 9 1832 1 1 3 VAL HG13 H 1.305 6.933 -3.143 1.00 . A A . 3 VAL HG13 1 1 9 1833 1 1 3 VAL HG21 H -1.676 4.800 -3.901 1.00 . A A . 3 VAL HG21 1 1 9 1834 1 1 3 VAL HG22 H -0.524 5.923 -4.624 1.00 . A A . 3 VAL HG22 1 1 9 1835 1 1 3 VAL HG23 H -1.715 6.508 -3.463 1.00 . A A . 3 VAL HG23 1 1 9 1836 1 1 3 VAL N N 0.103 3.141 -3.608 1.00 . A A . 3 VAL N 1 1 9 1837 1 1 3 VAL O O 1.188 4.169 -0.545 1.00 . A A . 3 VAL O 1 1 9 1838 1 1 4 PRO C C 4.652 3.246 -0.524 1.00 . A A . 4 PRO C 1 1 9 1839 1 1 4 PRO CA C 3.364 2.442 -0.663 1.00 . A A . 4 PRO CA 1 1 9 1840 1 1 4 PRO CB C 3.691 0.987 -1.038 1.00 . A A . 4 PRO CB 1 1 9 1841 1 1 4 PRO CD C 2.952 2.187 -2.991 1.00 . A A . 4 PRO CD 1 1 9 1842 1 1 4 PRO CG C 3.213 0.809 -2.451 1.00 . A A . 4 PRO CG 1 1 9 1843 1 1 4 PRO HA H 2.818 2.465 0.266 1.00 . A A . 4 PRO HA 1 1 9 1844 1 1 4 PRO HB2 H 4.758 0.830 -0.962 1.00 . A A . 4 PRO HB2 1 1 9 1845 1 1 4 PRO HB3 H 3.179 0.318 -0.363 1.00 . A A . 4 PRO HB3 1 1 9 1846 1 1 4 PRO HD2 H 3.853 2.613 -3.411 1.00 . A A . 4 PRO HD2 1 1 9 1847 1 1 4 PRO HD3 H 2.154 2.173 -3.717 1.00 . A A . 4 PRO HD3 1 1 9 1848 1 1 4 PRO HG2 H 3.972 0.315 -3.037 1.00 . A A . 4 PRO HG2 1 1 9 1849 1 1 4 PRO HG3 H 2.301 0.231 -2.452 1.00 . A A . 4 PRO HG3 1 1 9 1850 1 1 4 PRO N N 2.550 2.886 -1.780 1.00 . A A . 4 PRO N 1 1 9 1851 1 1 4 PRO O O 4.984 4.071 -1.375 1.00 . A A . 4 PRO O 1 1 9 1852 1 1 5 SER C C 7.634 2.457 1.155 1.00 . A A . 5 SER C 1 1 9 1853 1 1 5 SER CA C 6.680 3.579 0.764 1.00 . A A . 5 SER CA 1 1 9 1854 1 1 5 SER CB C 6.627 4.666 1.844 1.00 . A A . 5 SER CB 1 1 9 1855 1 1 5 SER H H 4.993 2.419 1.254 1.00 . A A . 5 SER H 1 1 9 1856 1 1 5 SER HA H 7.007 4.013 -0.171 1.00 . A A . 5 SER HA 1 1 9 1857 1 1 5 SER HB2 H 5.813 5.342 1.629 1.00 . A A . 5 SER HB2 1 1 9 1858 1 1 5 SER HB3 H 6.466 4.204 2.807 1.00 . A A . 5 SER HB3 1 1 9 1859 1 1 5 SER HG H 8.275 5.244 2.733 1.00 . A A . 5 SER HG 1 1 9 1860 1 1 5 SER N N 5.365 3.004 0.562 1.00 . A A . 5 SER N 1 1 9 1861 1 1 5 SER O O 8.615 2.654 1.877 1.00 . A A . 5 SER O 1 1 9 1862 1 1 5 SER OG O 7.833 5.410 1.892 1.00 . A A . 5 SER OG 1 1 9 1863 1 1 6 GLY C C 7.206 -1.155 0.827 1.00 . A A . 6 GLY C 1 1 9 1864 1 1 6 GLY CA C 8.063 0.081 1.001 1.00 . A A . 6 GLY CA 1 1 9 1865 1 1 6 GLY H H 6.572 1.200 0.029 1.00 . A A . 6 GLY H 1 1 9 1866 1 1 6 GLY HA2 H 8.931 0.007 0.363 1.00 . A A . 6 GLY HA2 1 1 9 1867 1 1 6 GLY HA3 H 8.381 0.149 2.029 1.00 . A A . 6 GLY HA3 1 1 9 1868 1 1 6 GLY N N 7.322 1.270 0.656 1.00 . A A . 6 GLY N 1 1 9 1869 1 1 6 GLY O O 6.231 -1.123 0.072 1.00 . A A . 6 GLY O 1 1 9 1870 1 1 7 PRO C C 5.333 -3.376 1.871 1.00 . A A . 7 PRO C 1 1 9 1871 1 1 7 PRO CA C 6.783 -3.513 1.421 1.00 . A A . 7 PRO CA 1 1 9 1872 1 1 7 PRO CB C 7.545 -4.467 2.349 1.00 . A A . 7 PRO CB 1 1 9 1873 1 1 7 PRO CD C 8.663 -2.363 2.456 1.00 . A A . 7 PRO CD 1 1 9 1874 1 1 7 PRO CG C 8.323 -3.583 3.261 1.00 . A A . 7 PRO CG 1 1 9 1875 1 1 7 PRO HA H 6.796 -3.905 0.410 1.00 . A A . 7 PRO HA 1 1 9 1876 1 1 7 PRO HB2 H 6.842 -5.079 2.895 1.00 . A A . 7 PRO HB2 1 1 9 1877 1 1 7 PRO HB3 H 8.198 -5.097 1.764 1.00 . A A . 7 PRO HB3 1 1 9 1878 1 1 7 PRO HD2 H 8.722 -1.492 3.093 1.00 . A A . 7 PRO HD2 1 1 9 1879 1 1 7 PRO HD3 H 9.593 -2.507 1.925 1.00 . A A . 7 PRO HD3 1 1 9 1880 1 1 7 PRO HG2 H 7.719 -3.312 4.115 1.00 . A A . 7 PRO HG2 1 1 9 1881 1 1 7 PRO HG3 H 9.223 -4.084 3.581 1.00 . A A . 7 PRO HG3 1 1 9 1882 1 1 7 PRO N N 7.533 -2.255 1.520 1.00 . A A . 7 PRO N 1 1 9 1883 1 1 7 PRO O O 5.058 -3.091 3.042 1.00 . A A . 7 PRO O 1 1 9 1884 1 1 8 ASN C C 2.398 -2.202 1.081 1.00 . A A . 8 ASN C 1 1 9 1885 1 1 8 ASN CA C 2.984 -3.602 1.121 1.00 . A A . 8 ASN CA 1 1 9 1886 1 1 8 ASN CB C 2.649 -4.325 2.436 1.00 . A A . 8 ASN CB 1 1 9 1887 1 1 8 ASN CG C 1.160 -4.396 2.730 1.00 . A A . 8 ASN CG 1 1 9 1888 1 1 8 ASN H H 4.754 -3.571 -0.010 1.00 . A A . 8 ASN H 1 1 9 1889 1 1 8 ASN HA H 2.563 -4.166 0.300 1.00 . A A . 8 ASN HA 1 1 9 1890 1 1 8 ASN HB2 H 3.031 -5.333 2.381 1.00 . A A . 8 ASN HB2 1 1 9 1891 1 1 8 ASN HB3 H 3.134 -3.809 3.253 1.00 . A A . 8 ASN HB3 1 1 9 1892 1 1 8 ASN HD21 H 1.023 -6.136 1.781 1.00 . A A . 8 ASN HD21 1 1 9 1893 1 1 8 ASN HD22 H -0.446 -5.531 2.464 1.00 . A A . 8 ASN HD22 1 1 9 1894 1 1 8 ASN N N 4.430 -3.539 0.903 1.00 . A A . 8 ASN N 1 1 9 1895 1 1 8 ASN ND2 N 0.514 -5.459 2.277 1.00 . A A . 8 ASN ND2 1 1 9 1896 1 1 8 ASN O O 2.976 -1.273 1.648 1.00 . A A . 8 ASN O 1 1 9 1897 1 1 8 ASN OD1 O 0.598 -3.506 3.370 1.00 . A A . 8 ASN OD1 1 1 9 1898 1 1 9 PRO C C 0.535 -0.005 1.535 1.00 . A A . 9 PRO C 1 1 9 1899 1 1 9 PRO CA C 0.605 -0.732 0.211 1.00 . A A . 9 PRO CA 1 1 9 1900 1 1 9 PRO CB C -0.803 -1.076 -0.299 1.00 . A A . 9 PRO CB 1 1 9 1901 1 1 9 PRO CD C 0.508 -3.085 -0.312 1.00 . A A . 9 PRO CD 1 1 9 1902 1 1 9 PRO CG C -0.900 -2.567 -0.250 1.00 . A A . 9 PRO CG 1 1 9 1903 1 1 9 PRO HA H 1.116 -0.114 -0.512 1.00 . A A . 9 PRO HA 1 1 9 1904 1 1 9 PRO HB2 H -1.540 -0.614 0.342 1.00 . A A . 9 PRO HB2 1 1 9 1905 1 1 9 PRO HB3 H -0.919 -0.708 -1.308 1.00 . A A . 9 PRO HB3 1 1 9 1906 1 1 9 PRO HD2 H 0.590 -4.023 0.218 1.00 . A A . 9 PRO HD2 1 1 9 1907 1 1 9 PRO HD3 H 0.831 -3.196 -1.336 1.00 . A A . 9 PRO HD3 1 1 9 1908 1 1 9 PRO HG2 H -1.367 -2.870 0.674 1.00 . A A . 9 PRO HG2 1 1 9 1909 1 1 9 PRO HG3 H -1.470 -2.926 -1.093 1.00 . A A . 9 PRO HG3 1 1 9 1910 1 1 9 PRO N N 1.262 -2.028 0.366 1.00 . A A . 9 PRO N 1 1 9 1911 1 1 9 PRO O O -0.005 -0.526 2.512 1.00 . A A . 9 PRO O 1 1 9 1912 1 1 10 LEU C C -0.022 2.341 3.422 1.00 . A A . 10 LEU C 1 1 9 1913 1 1 10 LEU CA C 1.302 1.868 2.842 1.00 . A A . 10 LEU CA 1 1 9 1914 1 1 10 LEU CB C 2.271 3.044 2.684 1.00 . A A . 10 LEU CB 1 1 9 1915 1 1 10 LEU CD1 C 3.452 2.861 4.892 1.00 . A A . 10 LEU CD1 1 1 9 1916 1 1 10 LEU CD2 C 3.398 5.050 3.681 1.00 . A A . 10 LEU CD2 1 1 9 1917 1 1 10 LEU CG C 2.638 3.769 3.982 1.00 . A A . 10 LEU CG 1 1 9 1918 1 1 10 LEU H H 1.372 1.625 0.739 1.00 . A A . 10 LEU H 1 1 9 1919 1 1 10 LEU HA H 1.731 1.140 3.500 1.00 . A A . 10 LEU HA 1 1 9 1920 1 1 10 LEU HB2 H 3.180 2.673 2.235 1.00 . A A . 10 LEU HB2 1 1 9 1921 1 1 10 LEU HB3 H 1.823 3.762 2.012 1.00 . A A . 10 LEU HB3 1 1 9 1922 1 1 10 LEU HD11 H 2.869 1.986 5.141 1.00 . A A . 10 LEU HD11 1 1 9 1923 1 1 10 LEU HD12 H 3.707 3.394 5.796 1.00 . A A . 10 LEU HD12 1 1 9 1924 1 1 10 LEU HD13 H 4.356 2.559 4.385 1.00 . A A . 10 LEU HD13 1 1 9 1925 1 1 10 LEU HD21 H 2.780 5.704 3.085 1.00 . A A . 10 LEU HD21 1 1 9 1926 1 1 10 LEU HD22 H 4.300 4.813 3.136 1.00 . A A . 10 LEU HD22 1 1 9 1927 1 1 10 LEU HD23 H 3.656 5.542 4.607 1.00 . A A . 10 LEU HD23 1 1 9 1928 1 1 10 LEU HG H 1.731 4.033 4.505 1.00 . A A . 10 LEU HG 1 1 9 1929 1 1 10 LEU N N 1.098 1.190 1.575 1.00 . A A . 10 LEU N 1 1 9 1930 1 1 10 LEU O O -0.143 2.629 4.612 1.00 . A A . 10 LEU O 1 1 9 1931 1 1 11 HIS C C -3.326 2.467 1.799 1.00 . A A . 11 HIS C 1 1 9 1932 1 1 11 HIS CA C -2.356 2.820 2.914 1.00 . A A . 11 HIS CA 1 1 9 1933 1 1 11 HIS CB C -2.410 4.326 3.226 1.00 . A A . 11 HIS CB 1 1 9 1934 1 1 11 HIS CD2 C -2.240 5.529 0.924 1.00 . A A . 11 HIS CD2 1 1 9 1935 1 1 11 HIS CE1 C -0.378 6.623 1.282 1.00 . A A . 11 HIS CE1 1 1 9 1936 1 1 11 HIS CG C -1.814 5.213 2.171 1.00 . A A . 11 HIS CG 1 1 9 1937 1 1 11 HIS H H -0.828 2.103 1.641 1.00 . A A . 11 HIS H 1 1 9 1938 1 1 11 HIS HA H -2.645 2.271 3.798 1.00 . A A . 11 HIS HA 1 1 9 1939 1 1 11 HIS HB2 H -3.441 4.619 3.351 1.00 . A A . 11 HIS HB2 1 1 9 1940 1 1 11 HIS HB3 H -1.880 4.509 4.149 1.00 . A A . 11 HIS HB3 1 1 9 1941 1 1 11 HIS HD1 H -0.099 5.905 3.179 1.00 . A A . 11 HIS HD1 1 1 9 1942 1 1 11 HIS HD2 H -3.129 5.155 0.438 1.00 . A A . 11 HIS HD2 1 1 9 1943 1 1 11 HIS HE1 H 0.478 7.267 1.146 1.00 . A A . 11 HIS HE1 1 1 9 1944 1 1 11 HIS HE2 H -1.481 6.961 -0.404 1.00 . A A . 11 HIS HE2 1 1 9 1945 1 1 11 HIS N N -1.008 2.393 2.557 1.00 . A A . 11 HIS N 1 1 9 1946 1 1 11 HIS ND1 N -0.646 5.915 2.361 1.00 . A A . 11 HIS ND1 1 1 9 1947 1 1 11 HIS NE2 N -1.330 6.408 0.395 1.00 . A A . 11 HIS NE2 1 1 9 1948 1 1 11 HIS O O -2.918 1.909 0.778 1.00 . A A . 11 HIS O 1 1 9 1949 1 1 12 ASN C C -5.862 0.927 1.076 1.00 . A A . 12 ASN C 1 1 9 1950 1 1 12 ASN CA C -5.678 2.443 1.086 1.00 . A A . 12 ASN CA 1 1 9 1951 1 1 12 ASN CB C -5.412 2.982 -0.331 1.00 . A A . 12 ASN CB 1 1 9 1952 1 1 12 ASN CG C -6.675 3.088 -1.172 1.00 . A A . 12 ASN CG 1 1 9 1953 1 1 12 ASN H H -4.830 3.292 2.828 1.00 . A A . 12 ASN H 1 1 9 1954 1 1 12 ASN HA H -6.586 2.891 1.464 1.00 . A A . 12 ASN HA 1 1 9 1955 1 1 12 ASN HB2 H -4.971 3.964 -0.257 1.00 . A A . 12 ASN HB2 1 1 9 1956 1 1 12 ASN HB3 H -4.721 2.321 -0.835 1.00 . A A . 12 ASN HB3 1 1 9 1957 1 1 12 ASN HD21 H -6.347 1.304 -1.977 1.00 . A A . 12 ASN HD21 1 1 9 1958 1 1 12 ASN HD22 H -7.765 2.126 -2.521 1.00 . A A . 12 ASN HD22 1 1 9 1959 1 1 12 ASN N N -4.600 2.798 2.009 1.00 . A A . 12 ASN N 1 1 9 1960 1 1 12 ASN ND2 N -6.958 2.071 -1.968 1.00 . A A . 12 ASN ND2 1 1 9 1961 1 1 12 ASN O O -6.363 0.343 0.111 1.00 . A A . 12 ASN O 1 1 9 1962 1 1 12 ASN OD1 O -7.386 4.088 -1.116 1.00 . A A . 12 ASN OD1 1 1 9 1963 1 1 13 LYS C C -4.848 -1.941 1.325 1.00 . A A . 13 LYS C 1 1 9 1964 1 1 13 LYS CA C -5.592 -1.135 2.388 1.00 . A A . 13 LYS CA 1 1 9 1965 1 1 13 LYS CB C -7.075 -1.516 2.408 1.00 . A A . 13 LYS CB 1 1 9 1966 1 1 13 LYS CD C -9.282 -1.359 3.589 1.00 . A A . 13 LYS CD 1 1 9 1967 1 1 13 LYS CE C -10.076 -0.663 4.681 1.00 . A A . 13 LYS CE 1 1 9 1968 1 1 13 LYS CG C -7.854 -0.851 3.530 1.00 . A A . 13 LYS CG 1 1 9 1969 1 1 13 LYS H H -5.001 0.836 2.878 1.00 . A A . 13 LYS H 1 1 9 1970 1 1 13 LYS HA H -5.164 -1.366 3.351 1.00 . A A . 13 LYS HA 1 1 9 1971 1 1 13 LYS HB2 H -7.520 -1.228 1.469 1.00 . A A . 13 LYS HB2 1 1 9 1972 1 1 13 LYS HB3 H -7.160 -2.586 2.524 1.00 . A A . 13 LYS HB3 1 1 9 1973 1 1 13 LYS HD2 H -9.758 -1.176 2.638 1.00 . A A . 13 LYS HD2 1 1 9 1974 1 1 13 LYS HD3 H -9.264 -2.419 3.788 1.00 . A A . 13 LYS HD3 1 1 9 1975 1 1 13 LYS HE2 H -9.538 -0.748 5.611 1.00 . A A . 13 LYS HE2 1 1 9 1976 1 1 13 LYS HE3 H -10.181 0.380 4.421 1.00 . A A . 13 LYS HE3 1 1 9 1977 1 1 13 LYS HG2 H -7.371 -1.067 4.469 1.00 . A A . 13 LYS HG2 1 1 9 1978 1 1 13 LYS HG3 H -7.867 0.217 3.364 1.00 . A A . 13 LYS HG3 1 1 9 1979 1 1 13 LYS HZ1 H -11.940 -1.251 3.943 1.00 . A A . 13 LYS HZ1 1 1 9 1980 1 1 13 LYS HZ2 H -11.974 -0.715 5.546 1.00 . A A . 13 LYS HZ2 1 1 9 1981 1 1 13 LYS HZ3 H -11.348 -2.243 5.180 1.00 . A A . 13 LYS HZ3 1 1 9 1982 1 1 13 LYS N N -5.441 0.303 2.178 1.00 . A A . 13 LYS N 1 1 9 1983 1 1 13 LYS NZ N -11.429 -1.259 4.848 1.00 . A A . 13 LYS NZ 1 1 9 1984 1 1 13 LYS O O -4.024 -1.403 0.585 1.00 . A A . 13 LYS O 1 1 9 1985 1 1 14 LYS C C -5.596 -4.952 -0.393 1.00 . A A . 14 LYS C 1 1 9 1986 1 1 14 LYS CA C -4.520 -4.108 0.277 1.00 . A A . 14 LYS CA 1 1 9 1987 1 1 14 LYS CB C -3.419 -4.989 0.901 1.00 . A A . 14 LYS CB 1 1 9 1988 1 1 14 LYS CD C -4.702 -6.825 2.082 1.00 . A A . 14 LYS CD 1 1 9 1989 1 1 14 LYS CE C -5.059 -7.435 3.430 1.00 . A A . 14 LYS CE 1 1 9 1990 1 1 14 LYS CG C -3.779 -5.629 2.239 1.00 . A A . 14 LYS CG 1 1 9 1991 1 1 14 LYS H H -5.746 -3.617 1.925 1.00 . A A . 14 LYS H 1 1 9 1992 1 1 14 LYS HA H -4.068 -3.473 -0.476 1.00 . A A . 14 LYS HA 1 1 9 1993 1 1 14 LYS HB2 H -3.181 -5.781 0.208 1.00 . A A . 14 LYS HB2 1 1 9 1994 1 1 14 LYS HB3 H -2.538 -4.383 1.048 1.00 . A A . 14 LYS HB3 1 1 9 1995 1 1 14 LYS HD2 H -5.609 -6.506 1.591 1.00 . A A . 14 LYS HD2 1 1 9 1996 1 1 14 LYS HD3 H -4.207 -7.569 1.480 1.00 . A A . 14 LYS HD3 1 1 9 1997 1 1 14 LYS HE2 H -5.697 -8.291 3.265 1.00 . A A . 14 LYS HE2 1 1 9 1998 1 1 14 LYS HE3 H -4.149 -7.754 3.917 1.00 . A A . 14 LYS HE3 1 1 9 1999 1 1 14 LYS HG2 H -2.873 -5.958 2.722 1.00 . A A . 14 LYS HG2 1 1 9 2000 1 1 14 LYS HG3 H -4.267 -4.889 2.857 1.00 . A A . 14 LYS HG3 1 1 9 2001 1 1 14 LYS HZ1 H -6.644 -6.142 3.853 1.00 . A A . 14 LYS HZ1 1 1 9 2002 1 1 14 LYS HZ2 H -5.164 -5.642 4.498 1.00 . A A . 14 LYS HZ2 1 1 9 2003 1 1 14 LYS HZ3 H -6.010 -6.916 5.216 1.00 . A A . 14 LYS HZ3 1 1 9 2004 1 1 14 LYS N N -5.119 -3.234 1.274 1.00 . A A . 14 LYS N 1 1 9 2005 1 1 14 LYS NZ N -5.767 -6.468 4.310 1.00 . A A . 14 LYS NZ 1 1 9 2006 1 1 14 LYS O O -5.430 -5.317 -1.573 1.00 . A A . 14 LYS O 1 1 9 2007 1 1 14 LYS OXT O -6.633 -5.207 0.256 1.00 . A A . 14 LYS OXT 1 1 10 2008 1 1 1 HIS C C 0.614 -0.529 -4.505 1.00 . A A . 1 HIS C 1 1 10 2009 1 1 1 HIS CA C 0.907 -2.018 -4.337 1.00 . A A . 1 HIS CA 1 1 10 2010 1 1 1 HIS CB C 2.415 -2.255 -4.175 1.00 . A A . 1 HIS CB 1 1 10 2011 1 1 1 HIS CD2 C 2.138 -4.511 -2.908 1.00 . A A . 1 HIS CD2 1 1 10 2012 1 1 1 HIS CE1 C 3.921 -4.385 -1.640 1.00 . A A . 1 HIS CE1 1 1 10 2013 1 1 1 HIS CG C 2.767 -3.348 -3.207 1.00 . A A . 1 HIS CG 1 1 10 2014 1 1 1 HIS H1 H 0.598 -3.793 -5.388 1.00 . A A . 1 HIS H1 1 1 10 2015 1 1 1 HIS H2 H 0.812 -2.439 -6.375 1.00 . A A . 1 HIS H2 1 1 10 2016 1 1 1 HIS H3 H -0.654 -2.667 -5.558 1.00 . A A . 1 HIS H3 1 1 10 2017 1 1 1 HIS HA H 0.402 -2.367 -3.448 1.00 . A A . 1 HIS HA 1 1 10 2018 1 1 1 HIS HB2 H 2.834 -2.519 -5.132 1.00 . A A . 1 HIS HB2 1 1 10 2019 1 1 1 HIS HB3 H 2.875 -1.344 -3.829 1.00 . A A . 1 HIS HB3 1 1 10 2020 1 1 1 HIS HD1 H 4.568 -2.597 -2.400 1.00 . A A . 1 HIS HD1 1 1 10 2021 1 1 1 HIS HD2 H 1.225 -4.878 -3.353 1.00 . A A . 1 HIS HD2 1 1 10 2022 1 1 1 HIS HE1 H 4.669 -4.603 -0.880 1.00 . A A . 1 HIS HE1 1 1 10 2023 1 1 1 HIS HE2 H 2.579 -5.918 -1.414 1.00 . A A . 1 HIS HE2 1 1 10 2024 1 1 1 HIS N N 0.380 -2.784 -5.492 1.00 . A A . 1 HIS N 1 1 10 2025 1 1 1 HIS ND1 N 3.883 -3.304 -2.396 1.00 . A A . 1 HIS ND1 1 1 10 2026 1 1 1 HIS NE2 N 2.874 -5.134 -1.932 1.00 . A A . 1 HIS NE2 1 1 10 2027 1 1 1 HIS O O 1.365 0.194 -5.156 1.00 . A A . 1 HIS O 1 1 10 2028 1 1 2 GLN C C -0.099 2.256 -3.187 1.00 . A A . 2 GLN C 1 1 10 2029 1 1 2 GLN CA C -0.932 1.300 -4.047 1.00 . A A . 2 GLN CA 1 1 10 2030 1 1 2 GLN CB C -2.412 1.401 -3.676 1.00 . A A . 2 GLN CB 1 1 10 2031 1 1 2 GLN CD C -4.444 2.876 -3.420 1.00 . A A . 2 GLN CD 1 1 10 2032 1 1 2 GLN CG C -2.978 2.804 -3.791 1.00 . A A . 2 GLN CG 1 1 10 2033 1 1 2 GLN H H -1.023 -0.703 -3.374 1.00 . A A . 2 GLN H 1 1 10 2034 1 1 2 GLN HA H -0.816 1.580 -5.081 1.00 . A A . 2 GLN HA 1 1 10 2035 1 1 2 GLN HB2 H -2.979 0.753 -4.328 1.00 . A A . 2 GLN HB2 1 1 10 2036 1 1 2 GLN HB3 H -2.537 1.068 -2.655 1.00 . A A . 2 GLN HB3 1 1 10 2037 1 1 2 GLN HE21 H -4.194 4.713 -2.718 1.00 . A A . 2 GLN HE21 1 1 10 2038 1 1 2 GLN HE22 H -5.795 4.070 -2.593 1.00 . A A . 2 GLN HE22 1 1 10 2039 1 1 2 GLN HG2 H -2.427 3.454 -3.134 1.00 . A A . 2 GLN HG2 1 1 10 2040 1 1 2 GLN HG3 H -2.863 3.142 -4.811 1.00 . A A . 2 GLN HG3 1 1 10 2041 1 1 2 GLN N N -0.484 -0.082 -3.913 1.00 . A A . 2 GLN N 1 1 10 2042 1 1 2 GLN NE2 N -4.853 4.001 -2.858 1.00 . A A . 2 GLN NE2 1 1 10 2043 1 1 2 GLN O O -0.187 2.227 -1.957 1.00 . A A . 2 GLN O 1 1 10 2044 1 1 2 GLN OE1 O -5.203 1.929 -3.632 1.00 . A A . 2 GLN OE1 1 1 10 2045 1 1 3 VAL C C 2.103 3.752 -1.869 1.00 . A A . 3 VAL C 1 1 10 2046 1 1 3 VAL CA C 1.564 4.121 -3.264 1.00 . A A . 3 VAL CA 1 1 10 2047 1 1 3 VAL CB C 0.864 5.505 -3.226 1.00 . A A . 3 VAL CB 1 1 10 2048 1 1 3 VAL CG1 C 0.588 5.992 -4.640 1.00 . A A . 3 VAL CG1 1 1 10 2049 1 1 3 VAL CG2 C -0.431 5.475 -2.423 1.00 . A A . 3 VAL CG2 1 1 10 2050 1 1 3 VAL H H 0.708 3.013 -4.846 1.00 . A A . 3 VAL H 1 1 10 2051 1 1 3 VAL HA H 2.418 4.221 -3.919 1.00 . A A . 3 VAL HA 1 1 10 2052 1 1 3 VAL HB H 1.536 6.205 -2.759 1.00 . A A . 3 VAL HB 1 1 10 2053 1 1 3 VAL HG11 H 0.108 6.959 -4.599 1.00 . A A . 3 VAL HG11 1 1 10 2054 1 1 3 VAL HG12 H -0.062 5.289 -5.141 1.00 . A A . 3 VAL HG12 1 1 10 2055 1 1 3 VAL HG13 H 1.518 6.073 -5.182 1.00 . A A . 3 VAL HG13 1 1 10 2056 1 1 3 VAL HG21 H -0.849 6.470 -2.377 1.00 . A A . 3 VAL HG21 1 1 10 2057 1 1 3 VAL HG22 H -0.228 5.122 -1.424 1.00 . A A . 3 VAL HG22 1 1 10 2058 1 1 3 VAL HG23 H -1.134 4.813 -2.903 1.00 . A A . 3 VAL HG23 1 1 10 2059 1 1 3 VAL N N 0.700 3.089 -3.871 1.00 . A A . 3 VAL N 1 1 10 2060 1 1 3 VAL O O 1.804 4.411 -0.870 1.00 . A A . 3 VAL O 1 1 10 2061 1 1 4 PRO C C 4.753 2.945 -0.100 1.00 . A A . 4 PRO C 1 1 10 2062 1 1 4 PRO CA C 3.482 2.217 -0.518 1.00 . A A . 4 PRO CA 1 1 10 2063 1 1 4 PRO CB C 3.817 0.747 -0.816 1.00 . A A . 4 PRO CB 1 1 10 2064 1 1 4 PRO CD C 3.310 1.814 -2.877 1.00 . A A . 4 PRO CD 1 1 10 2065 1 1 4 PRO CG C 3.285 0.488 -2.184 1.00 . A A . 4 PRO CG 1 1 10 2066 1 1 4 PRO HA H 2.762 2.265 0.282 1.00 . A A . 4 PRO HA 1 1 10 2067 1 1 4 PRO HB2 H 4.888 0.606 -0.778 1.00 . A A . 4 PRO HB2 1 1 10 2068 1 1 4 PRO HB3 H 3.343 0.112 -0.083 1.00 . A A . 4 PRO HB3 1 1 10 2069 1 1 4 PRO HD2 H 4.304 2.045 -3.233 1.00 . A A . 4 PRO HD2 1 1 10 2070 1 1 4 PRO HD3 H 2.591 1.845 -3.682 1.00 . A A . 4 PRO HD3 1 1 10 2071 1 1 4 PRO HG2 H 3.912 -0.223 -2.698 1.00 . A A . 4 PRO HG2 1 1 10 2072 1 1 4 PRO HG3 H 2.270 0.124 -2.111 1.00 . A A . 4 PRO HG3 1 1 10 2073 1 1 4 PRO N N 2.915 2.691 -1.781 1.00 . A A . 4 PRO N 1 1 10 2074 1 1 4 PRO O O 4.796 3.554 0.968 1.00 . A A . 4 PRO O 1 1 10 2075 1 1 5 SER C C 7.589 2.274 0.541 1.00 . A A . 5 SER C 1 1 10 2076 1 1 5 SER CA C 7.134 3.242 -0.550 1.00 . A A . 5 SER CA 1 1 10 2077 1 1 5 SER CB C 7.210 4.696 -0.067 1.00 . A A . 5 SER CB 1 1 10 2078 1 1 5 SER H H 5.616 2.584 -1.866 1.00 . A A . 5 SER H 1 1 10 2079 1 1 5 SER HA H 7.774 3.117 -1.412 1.00 . A A . 5 SER HA 1 1 10 2080 1 1 5 SER HB2 H 6.595 4.811 0.813 1.00 . A A . 5 SER HB2 1 1 10 2081 1 1 5 SER HB3 H 8.234 4.939 0.175 1.00 . A A . 5 SER HB3 1 1 10 2082 1 1 5 SER HG H 7.397 5.629 -1.780 1.00 . A A . 5 SER HG 1 1 10 2083 1 1 5 SER N N 5.778 2.881 -0.948 1.00 . A A . 5 SER N 1 1 10 2084 1 1 5 SER O O 8.171 2.667 1.556 1.00 . A A . 5 SER O 1 1 10 2085 1 1 5 SER OG O 6.751 5.592 -1.067 1.00 . A A . 5 SER OG 1 1 10 2086 1 1 6 GLY C C 7.099 -1.397 0.803 1.00 . A A . 6 GLY C 1 1 10 2087 1 1 6 GLY CA C 7.581 -0.038 1.283 1.00 . A A . 6 GLY CA 1 1 10 2088 1 1 6 GLY H H 6.858 0.754 -0.531 1.00 . A A . 6 GLY H 1 1 10 2089 1 1 6 GLY HA2 H 8.648 -0.078 1.444 1.00 . A A . 6 GLY HA2 1 1 10 2090 1 1 6 GLY HA3 H 7.091 0.198 2.216 1.00 . A A . 6 GLY HA3 1 1 10 2091 1 1 6 GLY N N 7.286 0.999 0.318 1.00 . A A . 6 GLY N 1 1 10 2092 1 1 6 GLY O O 6.677 -1.531 -0.348 1.00 . A A . 6 GLY O 1 1 10 2093 1 1 7 PRO C C 5.262 -4.062 1.323 1.00 . A A . 7 PRO C 1 1 10 2094 1 1 7 PRO CA C 6.765 -3.792 1.290 1.00 . A A . 7 PRO CA 1 1 10 2095 1 1 7 PRO CB C 7.483 -4.624 2.348 1.00 . A A . 7 PRO CB 1 1 10 2096 1 1 7 PRO CD C 7.518 -2.331 3.087 1.00 . A A . 7 PRO CD 1 1 10 2097 1 1 7 PRO CG C 7.481 -3.762 3.567 1.00 . A A . 7 PRO CG 1 1 10 2098 1 1 7 PRO HA H 7.141 -4.046 0.311 1.00 . A A . 7 PRO HA 1 1 10 2099 1 1 7 PRO HB2 H 6.944 -5.546 2.512 1.00 . A A . 7 PRO HB2 1 1 10 2100 1 1 7 PRO HB3 H 8.488 -4.840 2.019 1.00 . A A . 7 PRO HB3 1 1 10 2101 1 1 7 PRO HD2 H 6.815 -1.730 3.643 1.00 . A A . 7 PRO HD2 1 1 10 2102 1 1 7 PRO HD3 H 8.515 -1.929 3.183 1.00 . A A . 7 PRO HD3 1 1 10 2103 1 1 7 PRO HG2 H 6.583 -3.940 4.138 1.00 . A A . 7 PRO HG2 1 1 10 2104 1 1 7 PRO HG3 H 8.354 -3.977 4.167 1.00 . A A . 7 PRO HG3 1 1 10 2105 1 1 7 PRO N N 7.123 -2.421 1.668 1.00 . A A . 7 PRO N 1 1 10 2106 1 1 7 PRO O O 4.829 -5.214 1.247 1.00 . A A . 7 PRO O 1 1 10 2107 1 1 8 ASN C C 2.398 -1.751 1.219 1.00 . A A . 8 ASN C 1 1 10 2108 1 1 8 ASN CA C 3.020 -3.122 1.425 1.00 . A A . 8 ASN CA 1 1 10 2109 1 1 8 ASN CB C 2.530 -3.749 2.735 1.00 . A A . 8 ASN CB 1 1 10 2110 1 1 8 ASN CG C 2.880 -2.924 3.962 1.00 . A A . 8 ASN CG 1 1 10 2111 1 1 8 ASN H H 4.876 -2.111 1.508 1.00 . A A . 8 ASN H 1 1 10 2112 1 1 8 ASN HA H 2.740 -3.760 0.599 1.00 . A A . 8 ASN HA 1 1 10 2113 1 1 8 ASN HB2 H 1.457 -3.859 2.695 1.00 . A A . 8 ASN HB2 1 1 10 2114 1 1 8 ASN HB3 H 2.985 -4.724 2.837 1.00 . A A . 8 ASN HB3 1 1 10 2115 1 1 8 ASN HD21 H 4.560 -3.950 4.218 1.00 . A A . 8 ASN HD21 1 1 10 2116 1 1 8 ASN HD22 H 4.263 -2.693 5.368 1.00 . A A . 8 ASN HD22 1 1 10 2117 1 1 8 ASN N N 4.472 -3.004 1.425 1.00 . A A . 8 ASN N 1 1 10 2118 1 1 8 ASN ND2 N 4.014 -3.220 4.577 1.00 . A A . 8 ASN ND2 1 1 10 2119 1 1 8 ASN O O 2.965 -0.750 1.647 1.00 . A A . 8 ASN O 1 1 10 2120 1 1 8 ASN OD1 O 2.129 -2.038 4.364 1.00 . A A . 8 ASN OD1 1 1 10 2121 1 1 9 PRO C C 0.134 0.312 1.486 1.00 . A A . 9 PRO C 1 1 10 2122 1 1 9 PRO CA C 0.576 -0.413 0.226 1.00 . A A . 9 PRO CA 1 1 10 2123 1 1 9 PRO CB C -0.634 -0.825 -0.615 1.00 . A A . 9 PRO CB 1 1 10 2124 1 1 9 PRO CD C 0.499 -2.835 -0.005 1.00 . A A . 9 PRO CD 1 1 10 2125 1 1 9 PRO CG C -0.857 -2.257 -0.287 1.00 . A A . 9 PRO CG 1 1 10 2126 1 1 9 PRO HA H 1.214 0.239 -0.352 1.00 . A A . 9 PRO HA 1 1 10 2127 1 1 9 PRO HB2 H -1.485 -0.218 -0.344 1.00 . A A . 9 PRO HB2 1 1 10 2128 1 1 9 PRO HB3 H -0.408 -0.691 -1.663 1.00 . A A . 9 PRO HB3 1 1 10 2129 1 1 9 PRO HD2 H 0.426 -3.625 0.729 1.00 . A A . 9 PRO HD2 1 1 10 2130 1 1 9 PRO HD3 H 0.951 -3.202 -0.916 1.00 . A A . 9 PRO HD3 1 1 10 2131 1 1 9 PRO HG2 H -1.487 -2.335 0.586 1.00 . A A . 9 PRO HG2 1 1 10 2132 1 1 9 PRO HG3 H -1.312 -2.761 -1.125 1.00 . A A . 9 PRO HG3 1 1 10 2133 1 1 9 PRO N N 1.247 -1.685 0.527 1.00 . A A . 9 PRO N 1 1 10 2134 1 1 9 PRO O O -0.686 -0.192 2.253 1.00 . A A . 9 PRO O 1 1 10 2135 1 1 10 LEU C C -0.981 2.867 2.871 1.00 . A A . 10 LEU C 1 1 10 2136 1 1 10 LEU CA C 0.420 2.265 2.898 1.00 . A A . 10 LEU CA 1 1 10 2137 1 1 10 LEU CB C 1.462 3.374 3.082 1.00 . A A . 10 LEU CB 1 1 10 2138 1 1 10 LEU CD1 C 2.267 2.637 5.350 1.00 . A A . 10 LEU CD1 1 1 10 2139 1 1 10 LEU CD2 C 3.472 1.869 3.303 1.00 . A A . 10 LEU CD2 1 1 10 2140 1 1 10 LEU CG C 2.686 3.007 3.935 1.00 . A A . 10 LEU CG 1 1 10 2141 1 1 10 LEU H H 1.287 1.860 1.006 1.00 . A A . 10 LEU H 1 1 10 2142 1 1 10 LEU HA H 0.487 1.584 3.733 1.00 . A A . 10 LEU HA 1 1 10 2143 1 1 10 LEU HB2 H 1.811 3.673 2.104 1.00 . A A . 10 LEU HB2 1 1 10 2144 1 1 10 LEU HB3 H 0.974 4.220 3.543 1.00 . A A . 10 LEU HB3 1 1 10 2145 1 1 10 LEU HD11 H 3.147 2.454 5.949 1.00 . A A . 10 LEU HD11 1 1 10 2146 1 1 10 LEU HD12 H 1.660 1.745 5.325 1.00 . A A . 10 LEU HD12 1 1 10 2147 1 1 10 LEU HD13 H 1.700 3.448 5.783 1.00 . A A . 10 LEU HD13 1 1 10 2148 1 1 10 LEU HD21 H 2.831 1.005 3.197 1.00 . A A . 10 LEU HD21 1 1 10 2149 1 1 10 LEU HD22 H 4.312 1.618 3.932 1.00 . A A . 10 LEU HD22 1 1 10 2150 1 1 10 LEU HD23 H 3.829 2.174 2.330 1.00 . A A . 10 LEU HD23 1 1 10 2151 1 1 10 LEU HG H 3.338 3.866 3.999 1.00 . A A . 10 LEU HG 1 1 10 2152 1 1 10 LEU N N 0.688 1.493 1.690 1.00 . A A . 10 LEU N 1 1 10 2153 1 1 10 LEU O O -1.272 3.735 2.049 1.00 . A A . 10 LEU O 1 1 10 2154 1 1 11 HIS C C -4.087 2.447 2.759 1.00 . A A . 11 HIS C 1 1 10 2155 1 1 11 HIS CA C -3.210 2.873 3.932 1.00 . A A . 11 HIS CA 1 1 10 2156 1 1 11 HIS CB C -3.265 4.395 4.115 1.00 . A A . 11 HIS CB 1 1 10 2157 1 1 11 HIS CD2 C -1.410 5.259 5.707 1.00 . A A . 11 HIS CD2 1 1 10 2158 1 1 11 HIS CE1 C -2.605 5.424 7.533 1.00 . A A . 11 HIS CE1 1 1 10 2159 1 1 11 HIS CG C -2.670 4.868 5.404 1.00 . A A . 11 HIS CG 1 1 10 2160 1 1 11 HIS H H -1.522 1.683 4.383 1.00 . A A . 11 HIS H 1 1 10 2161 1 1 11 HIS HA H -3.608 2.410 4.821 1.00 . A A . 11 HIS HA 1 1 10 2162 1 1 11 HIS HB2 H -2.725 4.867 3.308 1.00 . A A . 11 HIS HB2 1 1 10 2163 1 1 11 HIS HB3 H -4.297 4.714 4.086 1.00 . A A . 11 HIS HB3 1 1 10 2164 1 1 11 HIS HD1 H -4.349 4.773 6.678 1.00 . A A . 11 HIS HD1 1 1 10 2165 1 1 11 HIS HD2 H -0.570 5.294 5.028 1.00 . A A . 11 HIS HD2 1 1 10 2166 1 1 11 HIS HE1 H -2.898 5.608 8.556 1.00 . A A . 11 HIS HE1 1 1 10 2167 1 1 11 HIS HE2 H -0.603 5.869 7.553 1.00 . A A . 11 HIS HE2 1 1 10 2168 1 1 11 HIS N N -1.831 2.395 3.784 1.00 . A A . 11 HIS N 1 1 10 2169 1 1 11 HIS ND1 N -3.394 4.983 6.571 1.00 . A A . 11 HIS ND1 1 1 10 2170 1 1 11 HIS NE2 N -1.398 5.599 7.036 1.00 . A A . 11 HIS NE2 1 1 10 2171 1 1 11 HIS O O -3.590 2.119 1.680 1.00 . A A . 11 HIS O 1 1 10 2172 1 1 12 ASN C C -6.309 0.491 1.833 1.00 . A A . 12 ASN C 1 1 10 2173 1 1 12 ASN CA C -6.398 2.008 2.022 1.00 . A A . 12 ASN CA 1 1 10 2174 1 1 12 ASN CB C -6.224 2.751 0.683 1.00 . A A . 12 ASN CB 1 1 10 2175 1 1 12 ASN CG C -7.377 2.535 -0.286 1.00 . A A . 12 ASN CG 1 1 10 2176 1 1 12 ASN H H -5.712 2.736 3.887 1.00 . A A . 12 ASN H 1 1 10 2177 1 1 12 ASN HA H -7.372 2.243 2.426 1.00 . A A . 12 ASN HA 1 1 10 2178 1 1 12 ASN HB2 H -6.142 3.808 0.878 1.00 . A A . 12 ASN HB2 1 1 10 2179 1 1 12 ASN HB3 H -5.315 2.408 0.210 1.00 . A A . 12 ASN HB3 1 1 10 2180 1 1 12 ASN HD21 H -8.681 2.411 1.212 1.00 . A A . 12 ASN HD21 1 1 10 2181 1 1 12 ASN HD22 H -9.336 2.227 -0.376 1.00 . A A . 12 ASN HD22 1 1 10 2182 1 1 12 ASN N N -5.400 2.445 3.003 1.00 . A A . 12 ASN N 1 1 10 2183 1 1 12 ASN ND2 N -8.585 2.378 0.236 1.00 . A A . 12 ASN ND2 1 1 10 2184 1 1 12 ASN O O -6.871 -0.077 0.892 1.00 . A A . 12 ASN O 1 1 10 2185 1 1 12 ASN OD1 O -7.185 2.525 -1.502 1.00 . A A . 12 ASN OD1 1 1 10 2186 1 1 13 LYS C C -4.682 -2.088 1.526 1.00 . A A . 13 LYS C 1 1 10 2187 1 1 13 LYS CA C -5.418 -1.605 2.776 1.00 . A A . 13 LYS CA 1 1 10 2188 1 1 13 LYS CB C -6.768 -2.321 2.919 1.00 . A A . 13 LYS CB 1 1 10 2189 1 1 13 LYS CD C -6.729 -2.389 5.437 1.00 . A A . 13 LYS CD 1 1 10 2190 1 1 13 LYS CE C -7.456 -1.993 6.713 1.00 . A A . 13 LYS CE 1 1 10 2191 1 1 13 LYS CG C -7.512 -1.975 4.201 1.00 . A A . 13 LYS CG 1 1 10 2192 1 1 13 LYS H H -5.179 0.379 3.477 1.00 . A A . 13 LYS H 1 1 10 2193 1 1 13 LYS HA H -4.811 -1.846 3.636 1.00 . A A . 13 LYS HA 1 1 10 2194 1 1 13 LYS HB2 H -7.394 -2.054 2.080 1.00 . A A . 13 LYS HB2 1 1 10 2195 1 1 13 LYS HB3 H -6.598 -3.388 2.903 1.00 . A A . 13 LYS HB3 1 1 10 2196 1 1 13 LYS HD2 H -6.595 -3.460 5.428 1.00 . A A . 13 LYS HD2 1 1 10 2197 1 1 13 LYS HD3 H -5.765 -1.902 5.418 1.00 . A A . 13 LYS HD3 1 1 10 2198 1 1 13 LYS HE2 H -7.585 -0.921 6.720 1.00 . A A . 13 LYS HE2 1 1 10 2199 1 1 13 LYS HE3 H -8.425 -2.469 6.721 1.00 . A A . 13 LYS HE3 1 1 10 2200 1 1 13 LYS HG2 H -7.672 -0.910 4.234 1.00 . A A . 13 LYS HG2 1 1 10 2201 1 1 13 LYS HG3 H -8.465 -2.486 4.203 1.00 . A A . 13 LYS HG3 1 1 10 2202 1 1 13 LYS HZ1 H -5.768 -1.949 7.941 1.00 . A A . 13 LYS HZ1 1 1 10 2203 1 1 13 LYS HZ2 H -6.583 -3.428 7.955 1.00 . A A . 13 LYS HZ2 1 1 10 2204 1 1 13 LYS HZ3 H -7.223 -2.102 8.784 1.00 . A A . 13 LYS HZ3 1 1 10 2205 1 1 13 LYS N N -5.602 -0.152 2.767 1.00 . A A . 13 LYS N 1 1 10 2206 1 1 13 LYS NZ N -6.706 -2.396 7.932 1.00 . A A . 13 LYS NZ 1 1 10 2207 1 1 13 LYS O O -4.212 -1.289 0.713 1.00 . A A . 13 LYS O 1 1 10 2208 1 1 14 LYS C C -4.884 -4.435 -0.790 1.00 . A A . 14 LYS C 1 1 10 2209 1 1 14 LYS CA C -3.873 -3.981 0.251 1.00 . A A . 14 LYS CA 1 1 10 2210 1 1 14 LYS CB C -2.994 -5.163 0.678 1.00 . A A . 14 LYS CB 1 1 10 2211 1 1 14 LYS CD C -2.651 -5.151 3.181 1.00 . A A . 14 LYS CD 1 1 10 2212 1 1 14 LYS CE C -2.850 -6.645 3.391 1.00 . A A . 14 LYS CE 1 1 10 2213 1 1 14 LYS CG C -2.036 -4.855 1.822 1.00 . A A . 14 LYS CG 1 1 10 2214 1 1 14 LYS H H -4.981 -3.993 2.048 1.00 . A A . 14 LYS H 1 1 10 2215 1 1 14 LYS HA H -3.248 -3.213 -0.185 1.00 . A A . 14 LYS HA 1 1 10 2216 1 1 14 LYS HB2 H -3.631 -5.978 0.982 1.00 . A A . 14 LYS HB2 1 1 10 2217 1 1 14 LYS HB3 H -2.406 -5.480 -0.172 1.00 . A A . 14 LYS HB3 1 1 10 2218 1 1 14 LYS HD2 H -1.995 -4.772 3.949 1.00 . A A . 14 LYS HD2 1 1 10 2219 1 1 14 LYS HD3 H -3.608 -4.655 3.247 1.00 . A A . 14 LYS HD3 1 1 10 2220 1 1 14 LYS HE2 H -3.223 -6.809 4.391 1.00 . A A . 14 LYS HE2 1 1 10 2221 1 1 14 LYS HE3 H -3.574 -7.004 2.675 1.00 . A A . 14 LYS HE3 1 1 10 2222 1 1 14 LYS HG2 H -1.147 -5.456 1.707 1.00 . A A . 14 LYS HG2 1 1 10 2223 1 1 14 LYS HG3 H -1.770 -3.810 1.783 1.00 . A A . 14 LYS HG3 1 1 10 2224 1 1 14 LYS HZ1 H -0.856 -7.041 3.870 1.00 . A A . 14 LYS HZ1 1 1 10 2225 1 1 14 LYS HZ2 H -1.234 -7.311 2.245 1.00 . A A . 14 LYS HZ2 1 1 10 2226 1 1 14 LYS HZ3 H -1.736 -8.411 3.425 1.00 . A A . 14 LYS HZ3 1 1 10 2227 1 1 14 LYS N N -4.570 -3.401 1.385 1.00 . A A . 14 LYS N 1 1 10 2228 1 1 14 LYS NZ N -1.582 -7.403 3.220 1.00 . A A . 14 LYS NZ 1 1 10 2229 1 1 14 LYS O O -4.974 -3.799 -1.858 1.00 . A A . 14 LYS O 1 1 10 2230 1 1 14 LYS OXT O -5.613 -5.413 -0.518 1.00 . A A . 14 LYS OXT 1 1 stop_ save_
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