NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
587231 | 2mr9 | 25066 | cing | 4-filtered-FRED | STAR | entry | full | 112 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2mr9 # This FRED archive file contains, for PDB entry <2mr9>: # # - 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_2mr9 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2mr9 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 4741.34 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 $DNA_damage_inducible_protein_1 A . 1 1 stop_ save_ save_DNA_damage_inducible_protein_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "DNA damage inducible protein 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GSATFPEQTIKQLMDLGFPRDAVVKALKQTNGNAEFAASLLFQS _Entity.Number_of_monomers 44 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 GLY . 1 1 2 SER . 1 1 3 ALA . 1 1 4 THR . 1 1 5 PHE . 1 1 6 PRO . 1 1 7 GLU . 1 1 8 GLN . 1 1 9 THR . 1 1 10 ILE . 1 1 11 LYS . 1 1 12 GLN . 1 1 13 LEU . 1 1 14 MET . 1 1 15 ASP . 1 1 16 LEU . 1 1 17 GLY . 1 1 18 PHE . 1 1 19 PRO . 1 1 20 ARG . 1 1 21 ASP . 1 1 22 ALA . 1 1 23 VAL . 1 1 24 VAL . 1 1 25 LYS . 1 1 26 ALA . 1 1 27 LEU . 1 1 28 LYS . 1 1 29 GLN . 1 1 30 THR . 1 1 31 ASN . 1 1 32 GLY . 1 1 33 ASN . 1 1 34 ALA . 1 1 35 GLU . 1 1 36 PHE . 1 1 37 ALA . 1 1 38 ALA . 1 1 39 SER . 1 1 40 LEU . 1 1 41 LEU . 1 1 42 PHE . 1 1 43 GLN . 1 1 44 SER . 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 GLY 1 1 1 1 SER 2 2 1 1 ALA 3 3 1 1 THR 4 4 1 1 PHE 5 5 1 1 PRO 6 6 1 1 GLU 7 7 1 1 GLN 8 8 1 1 THR 9 9 1 1 ILE 10 10 1 1 LYS 11 11 1 1 GLN 12 12 1 1 LEU 13 13 1 1 MET 14 14 1 1 ASP 15 15 1 1 LEU 16 16 1 1 GLY 17 17 1 1 PHE 18 18 1 1 PRO 19 19 1 1 ARG 20 20 1 1 ASP 21 21 1 1 ALA 22 22 1 1 VAL 23 23 1 1 VAL 24 24 1 1 LYS 25 25 1 1 ALA 26 26 1 1 LEU 27 27 1 1 LYS 28 28 1 1 GLN 29 29 1 1 THR 30 30 1 1 ASN 31 31 1 1 GLY 32 32 1 1 ASN 33 33 1 1 ALA 34 34 1 1 GLU 35 35 1 1 PHE 36 36 1 1 ALA 37 37 1 1 ALA 38 38 1 1 SER 39 39 1 1 LEU 40 40 1 1 LEU 41 41 1 1 PHE 42 42 1 1 GLN 43 43 1 1 SER 44 44 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 36 PHE O . 36 . O 1 1 1 1 2 1 1 41 LEU H . 41 . HN 1 1 2 1 1 1 1 36 PHE O . 36 . O 1 1 2 1 2 1 1 41 LEU N . 41 . N 1 1 3 1 1 1 1 37 ALA O . 37 . O 1 1 3 1 2 1 1 42 PHE H . 42 . HN 1 1 4 1 1 1 1 37 ALA O . 37 . O 1 1 4 1 2 1 1 42 PHE N . 42 . N 1 1 5 1 1 1 1 38 ALA O . 38 . O 1 1 5 1 2 1 1 43 GLN H . 43 . HN 1 1 6 1 1 1 1 38 ALA O . 38 . O 1 1 6 1 2 1 1 43 GLN N . 43 . N 1 1 7 1 1 1 1 39 SER O . 39 . O 1 1 7 1 2 1 1 44 SER H . 44 . HN 1 1 8 1 1 1 1 39 SER O . 39 . O 1 1 8 1 2 1 1 44 SER N . 44 . N 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.2 1.2 2.2 1 1 2 1 . . . . . 3.2 2.2 3.2 1 1 3 1 . . . . . 2.2 1.2 2.2 1 1 4 1 . . . . . 3.2 2.2 3.2 1 1 5 1 . . . . . 2.2 1.2 2.2 1 1 6 1 . . . . . 3.2 2.2 3.2 1 1 7 1 . . . . . 2.2 1.2 2.2 1 1 8 1 . . . . . 3.2 2.2 3.2 1 1 stop_ save_ save_CNS/XPLOR_dihedral_2 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 3 ALA C 1 1 4 THR N 1 1 4 THR CA 1 1 4 THR C -89.0 -30.999998 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 2 . 1 1 4 THR C 1 1 5 PHE N 1 1 5 PHE CA 1 1 5 PHE C -150.0 -46.0 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1 3 . 1 1 5 PHE C 1 1 6 PRO N 1 1 6 PRO CA 1 1 6 PRO C -83.0 -44.999996 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 4 . 1 1 6 PRO C 1 1 7 GLU N 1 1 7 GLU CA 1 1 7 GLU C -63.0 -43.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 5 . 1 1 7 GLU C 1 1 8 GLN N 1 1 8 GLN CA 1 1 8 GLN C -84.0 -44.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 6 . 1 1 8 GLN C 1 1 9 THR N 1 1 9 THR CA 1 1 9 THR C -80.0 -50.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 7 . 1 1 9 THR C 1 1 10 ILE N 1 1 10 ILE CA 1 1 10 ILE C -68.0 -58.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 8 . 1 1 10 ILE C 1 1 11 LYS N 1 1 11 LYS CA 1 1 11 LYS C -68.0 -47.999996 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 9 . 1 1 11 LYS C 1 1 12 GLN N 1 1 12 GLN CA 1 1 12 GLN C -100.0 -44.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 10 . 1 1 12 GLN C 1 1 13 LEU N 1 1 13 LEU CA 1 1 13 LEU C -107.99999 -47.999996 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 11 . 1 1 13 LEU C 1 1 14 MET N 1 1 14 MET CA 1 1 14 MET C -71.0 -50.999996 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 12 . 1 1 14 MET C 1 1 15 ASP N 1 1 15 ASP CA 1 1 15 ASP C -72.0 -53.999996 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 13 . 1 1 15 ASP C 1 1 16 LEU N 1 1 16 LEU CA 1 1 16 LEU C -95.0 -44.999996 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 14 . 1 1 17 GLY C 1 1 18 PHE N 1 1 18 PHE CA 1 1 18 PHE C -153.0 -57.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 15 . 1 1 18 PHE C 1 1 19 PRO N 1 1 19 PRO CA 1 1 19 PRO C -77.0 -47.0 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 16 . 1 1 19 PRO C 1 1 20 ARG N 1 1 20 ARG CA 1 1 20 ARG C -73.0 -26.999998 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 17 . 1 1 20 ARG C 1 1 21 ASP N 1 1 21 ASP CA 1 1 21 ASP C -92.0 -38.0 . 20 . C . 21 . N . 21 . CA . 21 . C 1 1 18 . 1 1 21 ASP C 1 1 22 ALA N 1 1 22 ALA CA 1 1 22 ALA C -83.0 -50.999996 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 19 . 1 1 22 ALA C 1 1 23 VAL N 1 1 23 VAL CA 1 1 23 VAL C -76.0 -47.999996 . 22 . C . 23 . N . 23 . CA . 23 . C 1 1 20 . 1 1 23 VAL C 1 1 24 VAL N 1 1 24 VAL CA 1 1 24 VAL C -71.0 -47.0 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1 21 . 1 1 24 VAL C 1 1 25 LYS N 1 1 25 LYS CA 1 1 25 LYS C -68.0 -52.0 . 24 . C . 25 . N . 25 . CA . 25 . C 1 1 22 . 1 1 25 LYS C 1 1 26 ALA N 1 1 26 ALA CA 1 1 26 ALA C -79.0 -47.0 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1 23 . 1 1 26 ALA C 1 1 27 LEU N 1 1 27 LEU CA 1 1 27 LEU C -76.0 -53.999996 . 26 . C . 27 . N . 27 . CA . 27 . C 1 1 24 . 1 1 27 LEU C 1 1 28 LYS N 1 1 28 LYS CA 1 1 28 LYS C -75.0 -47.0 . 27 . C . 28 . N . 28 . CA . 28 . C 1 1 25 . 1 1 28 LYS C 1 1 29 GLN N 1 1 29 GLN CA 1 1 29 GLN C -87.0 -47.0 . 28 . C . 29 . N . 29 . CA . 29 . C 1 1 26 . 1 1 29 GLN C 1 1 30 THR N 1 1 30 THR CA 1 1 30 THR C -126.0 -52.0 . 29 . C . 30 . N . 30 . CA . 30 . C 1 1 27 . 1 1 30 THR C 1 1 31 ASN N 1 1 31 ASN CA 1 1 31 ASN C 47.999996 68.0 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 28 . 1 1 31 ASN C 1 1 32 GLY N 1 1 32 GLY CA 1 1 32 GLY C 38.0 121.99999 . 31 . C . 32 . N . 32 . CA . 32 . C 1 1 29 . 1 1 32 GLY C 1 1 33 ASN N 1 1 33 ASN CA 1 1 33 ASN C -147.0 21.0 . 32 . C . 33 . N . 33 . CA . 33 . C 1 1 30 . 1 1 33 ASN C 1 1 34 ALA N 1 1 34 ALA CA 1 1 34 ALA C -111.0 -25.0 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1 31 . 1 1 34 ALA C 1 1 35 GLU N 1 1 35 GLU CA 1 1 35 GLU C -74.0 -53.999996 . 34 . C . 35 . N . 35 . CA . 35 . C 1 1 32 . 1 1 35 GLU C 1 1 36 PHE N 1 1 36 PHE CA 1 1 36 PHE C -83.0 -50.999996 . 35 . C . 36 . N . 36 . CA . 36 . C 1 1 33 . 1 1 36 PHE C 1 1 37 ALA N 1 1 37 ALA CA 1 1 37 ALA C -68.0 -53.999996 . 36 . C . 37 . N . 37 . CA . 37 . C 1 1 34 . 1 1 37 ALA C 1 1 38 ALA N 1 1 38 ALA CA 1 1 38 ALA C -72.0 -50.0 . 37 . C . 38 . N . 38 . CA . 38 . C 1 1 35 . 1 1 38 ALA C 1 1 39 SER N 1 1 39 SER CA 1 1 39 SER C -86.0 -47.999996 . 38 . C . 39 . N . 39 . CA . 39 . C 1 1 36 . 1 1 39 SER C 1 1 40 LEU N 1 1 40 LEU CA 1 1 40 LEU C -81.0 -49.0 . 39 . C . 40 . N . 40 . CA . 40 . C 1 1 37 . 1 1 40 LEU C 1 1 41 LEU N 1 1 41 LEU CA 1 1 41 LEU C -72.0 -53.999996 . 40 . C . 41 . N . 41 . CA . 41 . C 1 1 38 . 1 1 41 LEU C 1 1 42 PHE N 1 1 42 PHE CA 1 1 42 PHE C -95.0 -43.0 . 41 . C . 42 . N . 42 . CA . 42 . C 1 1 39 . 1 1 4 THR N 1 1 4 THR CA 1 1 4 THR C 1 1 5 PHE N -58.0 -14.0 . 4 . N . 4 . CA . 4 . C . 5 . N 1 1 40 . 1 1 5 PHE N 1 1 5 PHE CA 1 1 5 PHE C 1 1 6 PRO N 53.999996 186.0 . 5 . N . 5 . CA . 5 . C . 6 . N 1 1 41 . 1 1 6 PRO N 1 1 6 PRO CA 1 1 6 PRO C 1 1 7 GLU N 95.99999 179.99998 . 6 . N . 6 . CA . 6 . C . 7 . N 1 1 42 . 1 1 7 GLU N 1 1 7 GLU CA 1 1 7 GLU C 1 1 8 GLN N -60.0 -23.999998 . 7 . N . 7 . CA . 7 . C . 8 . N 1 1 43 . 1 1 8 GLN N 1 1 8 GLN CA 1 1 8 GLN C 1 1 9 THR N -63.0 -9.0 . 8 . N . 8 . CA . 8 . C . 9 . N 1 1 44 . 1 1 9 THR N 1 1 9 THR CA 1 1 9 THR C 1 1 10 ILE N -49.0 -37.0 . 9 . N . 9 . CA . 9 . C . 10 . N 1 1 45 . 1 1 10 ILE N 1 1 10 ILE CA 1 1 10 ILE C 1 1 11 LYS N -55.0 -35.0 . 10 . N . 10 . CA . 10 . C . 11 . N 1 1 46 . 1 1 11 LYS N 1 1 11 LYS CA 1 1 11 LYS C 1 1 12 GLN N -50.0 -34.0 . 11 . N . 11 . CA . 11 . C . 12 . N 1 1 47 . 1 1 12 GLN N 1 1 12 GLN CA 1 1 12 GLN C 1 1 13 LEU N -55.0 -7.0 . 12 . N . 12 . CA . 12 . C . 13 . N 1 1 48 . 1 1 13 LEU N 1 1 13 LEU CA 1 1 13 LEU C 1 1 14 MET N -61.999996 -22.0 . 13 . N . 13 . CA . 13 . C . 14 . N 1 1 49 . 1 1 14 MET N 1 1 14 MET CA 1 1 14 MET C 1 1 15 ASP N -57.0 -25.0 . 14 . N . 14 . CA . 14 . C . 15 . N 1 1 50 . 1 1 15 ASP N 1 1 15 ASP CA 1 1 15 ASP C 1 1 16 LEU N -65.0 -7.0 . 15 . N . 15 . CA . 15 . C . 16 . N 1 1 51 . 1 1 16 LEU N 1 1 16 LEU CA 1 1 16 LEU C 1 1 17 GLY N -63.0 11.0 . 16 . N . 16 . CA . 16 . C . 17 . N 1 1 52 . 1 1 18 PHE N 1 1 18 PHE CA 1 1 18 PHE C 1 1 19 PRO N 43.0 183.0 . 18 . N . 18 . CA . 18 . C . 19 . N 1 1 53 . 1 1 19 PRO N 1 1 19 PRO CA 1 1 19 PRO C 1 1 20 ARG N 130.0 164.0 . 19 . N . 19 . CA . 19 . C . 20 . N 1 1 54 . 1 1 20 ARG N 1 1 20 ARG CA 1 1 20 ARG C 1 1 21 ASP N -64.0 -16.0 . 20 . N . 20 . CA . 20 . C . 21 . N 1 1 55 . 1 1 21 ASP N 1 1 21 ASP CA 1 1 21 ASP C 1 1 22 ALA N -73.0 21.0 . 21 . N . 21 . CA . 21 . C . 22 . N 1 1 56 . 1 1 22 ALA N 1 1 22 ALA CA 1 1 22 ALA C 1 1 23 VAL N -50.999996 -30.999998 . 22 . N . 22 . CA . 22 . C . 23 . N 1 1 57 . 1 1 23 VAL N 1 1 23 VAL CA 1 1 23 VAL C 1 1 24 VAL N -65.0 -26.999998 . 23 . N . 23 . CA . 23 . C . 24 . N 1 1 58 . 1 1 24 VAL N 1 1 24 VAL CA 1 1 24 VAL C 1 1 25 LYS N -60.999996 -21.0 . 24 . N . 24 . CA . 24 . C . 25 . N 1 1 59 . 1 1 25 LYS N 1 1 25 LYS CA 1 1 25 LYS C 1 1 26 ALA N -53.0 -30.999998 . 25 . N . 25 . CA . 25 . C . 26 . N 1 1 60 . 1 1 26 ALA N 1 1 26 ALA CA 1 1 26 ALA C 1 1 27 LEU N -60.999996 -23.0 . 26 . N . 26 . CA . 26 . C . 27 . N 1 1 61 . 1 1 27 LEU N 1 1 27 LEU CA 1 1 27 LEU C 1 1 28 LYS N -53.0 -30.999998 . 27 . N . 27 . CA . 27 . C . 28 . N 1 1 62 . 1 1 28 LYS N 1 1 28 LYS CA 1 1 28 LYS C 1 1 29 GLN N -60.0 -28.0 . 28 . N . 28 . CA . 28 . C . 29 . N 1 1 63 . 1 1 29 GLN N 1 1 29 GLN CA 1 1 29 GLN C 1 1 30 THR N -59.0 -9.0 . 29 . N . 29 . CA . 29 . C . 30 . N 1 1 64 . 1 1 30 THR N 1 1 30 THR CA 1 1 30 THR C 1 1 31 ASN N -49.0 33.0 . 30 . N . 30 . CA . 30 . C . 31 . N 1 1 65 . 1 1 31 ASN N 1 1 31 ASN CA 1 1 31 ASN C 1 1 32 GLY N 13.0 60.999996 . 31 . N . 31 . CA . 31 . C . 32 . N 1 1 66 . 1 1 32 GLY N 1 1 32 GLY CA 1 1 32 GLY C 1 1 33 ASN N -23.0 33.0 . 32 . N . 32 . CA . 32 . C . 33 . N 1 1 67 . 1 1 33 ASN N 1 1 33 ASN CA 1 1 33 ASN C 1 1 34 ALA N 44.999996 213.0 . 33 . N . 33 . CA . 33 . C . 34 . N 1 1 68 . 1 1 34 ALA N 1 1 34 ALA CA 1 1 34 ALA C 1 1 35 GLU N -64.0 22.0 . 34 . N . 34 . CA . 34 . C . 35 . N 1 1 69 . 1 1 35 GLU N 1 1 35 GLU CA 1 1 35 GLU C 1 1 36 PHE N -60.0 -20.0 . 35 . N . 35 . CA . 35 . C . 36 . N 1 1 70 . 1 1 36 PHE N 1 1 36 PHE CA 1 1 36 PHE C 1 1 37 ALA N -49.0 -23.0 . 36 . N . 36 . CA . 36 . C . 37 . N 1 1 71 . 1 1 37 ALA N 1 1 37 ALA CA 1 1 37 ALA C 1 1 38 ALA N -53.0 -33.0 . 37 . N . 37 . CA . 37 . C . 38 . N 1 1 72 . 1 1 38 ALA N 1 1 38 ALA CA 1 1 38 ALA C 1 1 39 SER N -53.0 -29.0 . 38 . N . 38 . CA . 38 . C . 39 . N 1 1 73 . 1 1 39 SER N 1 1 39 SER CA 1 1 39 SER C 1 1 40 LEU N -60.999996 -5.0 . 39 . N . 39 . CA . 39 . C . 40 . N 1 1 74 . 1 1 40 LEU N 1 1 40 LEU CA 1 1 40 LEU C 1 1 41 LEU N -49.0 -29.0 . 40 . N . 40 . CA . 40 . C . 41 . N 1 1 75 . 1 1 41 LEU N 1 1 41 LEU CA 1 1 41 LEU C 1 1 42 PHE N -52.0 -36.0 . 41 . N . 41 . CA . 41 . C . 42 . N 1 1 76 . 1 1 42 PHE N 1 1 42 PHE CA 1 1 42 PHE C 1 1 43 GLN N -58.0 -2.0 . 42 . N . 42 . CA . 42 . C . 43 . N 1 1 stop_ save_ save_CNS/XPLOR_dipolar_coupling_4 _RDC_constraint_list.Sf_category RDC_constraints _RDC_constraint_list.Entry_ID 1 _RDC_constraint_list.ID 1 _RDC_constraint_list.Constraint_file_ID . _RDC_constraint_list.Block_ID . loop_ _RDC_constraint.ID _RDC_constraint.Entity_assembly_ID_1 _RDC_constraint.Entity_ID_1 _RDC_constraint.Comp_index_ID_1 _RDC_constraint.Comp_ID_1 _RDC_constraint.Atom_ID_1 _RDC_constraint.Entity_assembly_ID_2 _RDC_constraint.Entity_ID_2 _RDC_constraint.Comp_index_ID_2 _RDC_constraint.Comp_ID_2 _RDC_constraint.Atom_ID_2 _RDC_constraint.RDC_val _RDC_constraint.RDC_lower_bound _RDC_constraint.RDC_upper_bound _RDC_constraint.RDC_val_err _RDC_constraint.Auth_asym_ID_1 _RDC_constraint.Auth_seq_ID_1 _RDC_constraint.Auth_comp_ID_1 _RDC_constraint.Auth_atom_ID_1 _RDC_constraint.Auth_asym_ID_2 _RDC_constraint.Auth_seq_ID_2 _RDC_constraint.Auth_comp_ID_2 _RDC_constraint.Auth_atom_ID_2 _RDC_constraint.Entry_ID _RDC_constraint.RDC_constraint_list_ID 1 1 1 7 GLU N 1 1 7 GLU H -3.51 . . . . 7 . N . 7 . HN 1 1 2 1 1 8 GLN N 1 1 8 GLN H -4.296 . . . . 8 . N . 8 . HN 1 1 3 1 1 9 THR N 1 1 9 THR H -1.433 . . . . 9 . N . 9 . HN 1 1 4 1 1 10 ILE N 1 1 10 ILE H -3.482 . . . . 10 . N . 10 . HN 1 1 5 1 1 11 LYS N 1 1 11 LYS H -5.85 . . . . 11 . N . 11 . HN 1 1 6 1 1 12 GLN N 1 1 12 GLN H -3.03 . . . . 12 . N . 12 . HN 1 1 7 1 1 13 LEU N 1 1 13 LEU H -1.739 . . . . 13 . N . 13 . HN 1 1 8 1 1 14 MET N 1 1 14 MET H -4.35 . . . . 14 . N . 14 . HN 1 1 9 1 1 20 ARG N 1 1 20 ARG H 3.782 . . . . 20 . N . 20 . HN 1 1 10 1 1 21 ASP N 1 1 21 ASP H 2.582 . . . . 21 . N . 21 . HN 1 1 11 1 1 22 ALA N 1 1 22 ALA H 1.312 . . . . 22 . N . 22 . HN 1 1 12 1 1 23 VAL N 1 1 23 VAL H 4.233 . . . . 23 . N . 23 . HN 1 1 13 1 1 24 VAL N 1 1 24 VAL H 4.31 . . . . 24 . N . 24 . HN 1 1 14 1 1 25 LYS N 1 1 25 LYS H 1.941 . . . . 25 . N . 25 . HN 1 1 15 1 1 26 ALA N 1 1 26 ALA H 2.182 . . . . 26 . N . 26 . HN 1 1 16 1 1 27 LEU N 1 1 27 LEU H 4.5 . . . . 27 . N . 27 . HN 1 1 17 1 1 28 LYS N 1 1 28 LYS H 2.334 . . . . 28 . N . 28 . HN 1 1 18 1 1 29 GLN N 1 1 29 GLN H 1.472 . . . . 29 . N . 29 . HN 1 1 19 1 1 30 THR N 1 1 30 THR H 3.586 . . . . 30 . N . 30 . HN 1 1 20 1 1 34 ALA N 1 1 34 ALA H -6.158 . . . . 34 . N . 34 . HN 1 1 21 1 1 35 GLU N 1 1 35 GLU H -2.018 . . . . 35 . N . 35 . HN 1 1 22 1 1 36 PHE N 1 1 36 PHE H -4.623 . . . . 36 . N . 36 . HN 1 1 23 1 1 37 ALA N 1 1 37 ALA H -5.859 . . . . 37 . N . 37 . HN 1 1 24 1 1 38 ALA N 1 1 38 ALA H -4.074 . . . . 38 . N . 38 . HN 1 1 25 1 1 39 SER N 1 1 39 SER H -1.659 . . . . 39 . N . 39 . HN 1 1 26 1 1 40 LEU N 1 1 40 LEU H -6.046 . . . . 40 . N . 40 . HN 1 1 27 1 1 41 LEU N 1 1 41 LEU H -4.524 . . . . 41 . N . 41 . HN 1 1 28 1 1 42 PHE N 1 1 42 PHE H -1.069 . . . . 42 . N . 42 . HN 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 GLY C C -15.561 0.458 -2.200 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C -16.655 1.436 -2.561 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H -18.150 0.044 -2.962 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H -18.733 1.577 -2.535 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H -18.098 0.550 -1.348 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H -16.556 1.702 -3.604 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H -16.545 2.327 -1.958 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N -18.002 0.864 -2.336 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O -15.148 0.382 -1.043 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 SER C C -12.678 -0.588 -2.953 1.00 . A A . 2 SER C 1 1 1 11 1 1 2 SER CA C -14.043 -1.274 -2.962 1.00 . A A . 2 SER CA 1 1 1 12 1 1 2 SER CB C -14.106 -2.360 -4.037 1.00 . A A . 2 SER CB 1 1 1 13 1 1 2 SER H H -15.478 -0.206 -4.084 1.00 . A A . 2 SER H 1 1 1 14 1 1 2 SER HA H -14.209 -1.726 -1.997 1.00 . A A . 2 SER HA 1 1 1 15 1 1 2 SER HB2 H -13.208 -2.959 -3.993 1.00 . A A . 2 SER HB2 1 1 1 16 1 1 2 SER HB3 H -14.969 -2.986 -3.863 1.00 . A A . 2 SER HB3 1 1 1 17 1 1 2 SER HG H -13.314 -1.673 -5.698 1.00 . A A . 2 SER HG 1 1 1 18 1 1 2 SER N N -15.099 -0.302 -3.183 1.00 . A A . 2 SER N 1 1 1 19 1 1 2 SER O O -11.942 -0.609 -3.942 1.00 . A A . 2 SER O 1 1 1 20 1 1 2 SER OG O -14.207 -1.789 -5.331 1.00 . A A . 2 SER OG 1 1 1 21 1 1 3 ALA C C -10.195 -0.037 -0.709 1.00 . A A . 3 ALA C 1 1 1 22 1 1 3 ALA CA C -11.094 0.725 -1.672 1.00 . A A . 3 ALA CA 1 1 1 23 1 1 3 ALA CB C -11.329 2.149 -1.184 1.00 . A A . 3 ALA CB 1 1 1 24 1 1 3 ALA H H -12.988 0.010 -1.076 1.00 . A A . 3 ALA H 1 1 1 25 1 1 3 ALA HA H -10.614 0.771 -2.639 1.00 . A A . 3 ALA HA 1 1 1 26 1 1 3 ALA HB1 H -11.818 2.124 -0.220 1.00 . A A . 3 ALA HB1 1 1 1 27 1 1 3 ALA HB2 H -11.954 2.672 -1.893 1.00 . A A . 3 ALA HB2 1 1 1 28 1 1 3 ALA HB3 H -10.382 2.660 -1.094 1.00 . A A . 3 ALA HB3 1 1 1 29 1 1 3 ALA N N -12.357 0.030 -1.831 1.00 . A A . 3 ALA N 1 1 1 30 1 1 3 ALA O O -10.227 0.189 0.502 1.00 . A A . 3 ALA O 1 1 1 31 1 1 4 THR C C -7.346 -0.900 0.031 1.00 . A A . 4 THR C 1 1 1 32 1 1 4 THR CA C -8.491 -1.748 -0.444 1.00 . A A . 4 THR CA 1 1 1 33 1 1 4 THR CB C -7.964 -2.956 -1.239 1.00 . A A . 4 THR CB 1 1 1 34 1 1 4 THR CG2 C -7.624 -4.113 -0.313 1.00 . A A . 4 THR CG2 1 1 1 35 1 1 4 THR H H -9.439 -1.099 -2.224 1.00 . A A . 4 THR H 1 1 1 36 1 1 4 THR HA H -9.001 -2.087 0.393 1.00 . A A . 4 THR HA 1 1 1 37 1 1 4 THR HB H -7.069 -2.657 -1.767 1.00 . A A . 4 THR HB 1 1 1 38 1 1 4 THR HG1 H -9.099 -2.682 -2.843 1.00 . A A . 4 THR HG1 1 1 1 39 1 1 4 THR HG21 H -7.239 -4.937 -0.895 1.00 . A A . 4 THR HG21 1 1 1 40 1 1 4 THR HG22 H -8.513 -4.427 0.211 1.00 . A A . 4 THR HG22 1 1 1 41 1 1 4 THR HG23 H -6.877 -3.795 0.401 1.00 . A A . 4 THR HG23 1 1 1 42 1 1 4 THR N N -9.405 -0.953 -1.252 1.00 . A A . 4 THR N 1 1 1 43 1 1 4 THR O O -6.695 -1.168 1.031 1.00 . A A . 4 THR O 1 1 1 44 1 1 4 THR OG1 O -8.951 -3.386 -2.192 1.00 . A A . 4 THR OG1 1 1 1 45 1 1 5 PHE C C -6.550 2.379 -0.072 1.00 . A A . 5 PHE C 1 1 1 46 1 1 5 PHE CA C -6.056 1.029 -0.535 1.00 . A A . 5 PHE CA 1 1 1 47 1 1 5 PHE CB C -5.306 1.081 -1.840 1.00 . A A . 5 PHE CB 1 1 1 48 1 1 5 PHE CD1 C -4.665 -1.102 -1.728 1.00 . A A . 5 PHE CD1 1 1 1 49 1 1 5 PHE CD2 C -5.979 -0.637 -3.567 1.00 . A A . 5 PHE CD2 1 1 1 50 1 1 5 PHE CE1 C -4.625 -2.365 -2.037 1.00 . A A . 5 PHE CE1 1 1 1 51 1 1 5 PHE CE2 C -5.929 -1.976 -3.928 1.00 . A A . 5 PHE CE2 1 1 1 52 1 1 5 PHE CG C -5.298 -0.238 -2.425 1.00 . A A . 5 PHE CG 1 1 1 53 1 1 5 PHE CZ C -5.223 -2.838 -3.104 1.00 . A A . 5 PHE CZ 1 1 1 54 1 1 5 PHE H H -7.734 0.266 -1.439 1.00 . A A . 5 PHE H 1 1 1 55 1 1 5 PHE HA H -5.404 0.612 0.216 1.00 . A A . 5 PHE HA 1 1 1 56 1 1 5 PHE HB2 H -5.752 1.697 -2.498 1.00 . A A . 5 PHE HB2 1 1 1 57 1 1 5 PHE HB3 H -4.296 1.374 -1.641 1.00 . A A . 5 PHE HB3 1 1 1 58 1 1 5 PHE HD1 H -4.171 -0.753 -0.882 1.00 . A A . 5 PHE HD1 1 1 1 59 1 1 5 PHE HD2 H -6.514 0.084 -4.169 1.00 . A A . 5 PHE HD2 1 1 1 60 1 1 5 PHE HE1 H -4.109 -3.001 -1.415 1.00 . A A . 5 PHE HE1 1 1 1 61 1 1 5 PHE HE2 H -6.432 -2.337 -4.813 1.00 . A A . 5 PHE HE2 1 1 1 62 1 1 5 PHE HZ H -5.143 -3.878 -3.269 1.00 . A A . 5 PHE HZ 1 1 1 63 1 1 5 PHE N N -7.146 0.130 -0.713 1.00 . A A . 5 PHE N 1 1 1 64 1 1 5 PHE O O -7.140 3.150 -0.829 1.00 . A A . 5 PHE O 1 1 1 65 1 1 6 PRO C C -5.833 4.963 1.732 1.00 . A A . 6 PRO C 1 1 1 66 1 1 6 PRO CA C -6.793 3.799 1.893 1.00 . A A . 6 PRO CA 1 1 1 67 1 1 6 PRO CB C -6.910 3.300 3.317 1.00 . A A . 6 PRO CB 1 1 1 68 1 1 6 PRO CD C -5.530 1.804 2.078 1.00 . A A . 6 PRO CD 1 1 1 69 1 1 6 PRO CG C -5.919 2.237 3.454 1.00 . A A . 6 PRO CG 1 1 1 70 1 1 6 PRO HA H -7.757 4.080 1.557 1.00 . A A . 6 PRO HA 1 1 1 71 1 1 6 PRO HB2 H -6.742 4.100 4.017 1.00 . A A . 6 PRO HB2 1 1 1 72 1 1 6 PRO HB3 H -7.872 2.892 3.450 1.00 . A A . 6 PRO HB3 1 1 1 73 1 1 6 PRO HD2 H -4.499 1.997 1.928 1.00 . A A . 6 PRO HD2 1 1 1 74 1 1 6 PRO HD3 H -5.752 0.769 1.913 1.00 . A A . 6 PRO HD3 1 1 1 75 1 1 6 PRO HG2 H -5.076 2.621 3.974 1.00 . A A . 6 PRO HG2 1 1 1 76 1 1 6 PRO HG3 H -6.361 1.421 3.988 1.00 . A A . 6 PRO HG3 1 1 1 77 1 1 6 PRO N N -6.328 2.638 1.205 1.00 . A A . 6 PRO N 1 1 1 78 1 1 6 PRO O O -4.677 4.891 2.167 1.00 . A A . 6 PRO O 1 1 1 79 1 1 7 GLU C C -4.506 7.595 1.708 1.00 . A A . 7 GLU C 1 1 1 80 1 1 7 GLU CA C -5.516 7.150 0.657 1.00 . A A . 7 GLU CA 1 1 1 81 1 1 7 GLU CB C -6.427 8.305 0.272 1.00 . A A . 7 GLU CB 1 1 1 82 1 1 7 GLU CD C -8.385 9.070 -1.122 1.00 . A A . 7 GLU CD 1 1 1 83 1 1 7 GLU CG C -7.479 7.919 -0.753 1.00 . A A . 7 GLU CG 1 1 1 84 1 1 7 GLU H H -7.284 6.037 0.904 1.00 . A A . 7 GLU H 1 1 1 85 1 1 7 GLU HA H -4.972 6.836 -0.219 1.00 . A A . 7 GLU HA 1 1 1 86 1 1 7 GLU HB2 H -6.926 8.672 1.157 1.00 . A A . 7 GLU HB2 1 1 1 87 1 1 7 GLU HB3 H -5.827 9.090 -0.144 1.00 . A A . 7 GLU HB3 1 1 1 88 1 1 7 GLU HG2 H -6.981 7.572 -1.645 1.00 . A A . 7 GLU HG2 1 1 1 89 1 1 7 GLU HG3 H -8.083 7.121 -0.345 1.00 . A A . 7 GLU HG3 1 1 1 90 1 1 7 GLU N N -6.323 6.018 1.092 1.00 . A A . 7 GLU N 1 1 1 91 1 1 7 GLU O O -3.341 7.779 1.387 1.00 . A A . 7 GLU O 1 1 1 92 1 1 7 GLU OE1 O -9.296 9.396 -0.331 1.00 . A A . 7 GLU OE1 1 1 1 93 1 1 7 GLU OE2 O -8.189 9.661 -2.202 1.00 . A A . 7 GLU OE2 1 1 1 94 1 1 8 GLN C C -2.762 7.278 4.004 1.00 . A A . 8 GLN C 1 1 1 95 1 1 8 GLN CA C -4.054 8.090 4.062 1.00 . A A . 8 GLN CA 1 1 1 96 1 1 8 GLN CB C -4.751 7.817 5.393 1.00 . A A . 8 GLN CB 1 1 1 97 1 1 8 GLN CD C -4.532 7.778 7.923 1.00 . A A . 8 GLN CD 1 1 1 98 1 1 8 GLN CG C -3.821 7.894 6.587 1.00 . A A . 8 GLN CG 1 1 1 99 1 1 8 GLN H H -5.912 7.648 3.130 1.00 . A A . 8 GLN H 1 1 1 100 1 1 8 GLN HA H -3.818 9.139 3.996 1.00 . A A . 8 GLN HA 1 1 1 101 1 1 8 GLN HB2 H -5.545 8.535 5.529 1.00 . A A . 8 GLN HB2 1 1 1 102 1 1 8 GLN HB3 H -5.171 6.830 5.358 1.00 . A A . 8 GLN HB3 1 1 1 103 1 1 8 GLN HE21 H -5.924 6.595 7.137 1.00 . A A . 8 GLN HE21 1 1 1 104 1 1 8 GLN HE22 H -6.097 6.949 8.817 1.00 . A A . 8 GLN HE22 1 1 1 105 1 1 8 GLN HG2 H -3.101 7.092 6.512 1.00 . A A . 8 GLN HG2 1 1 1 106 1 1 8 GLN HG3 H -3.305 8.832 6.548 1.00 . A A . 8 GLN HG3 1 1 1 107 1 1 8 GLN N N -4.949 7.748 2.953 1.00 . A A . 8 GLN N 1 1 1 108 1 1 8 GLN NE2 N -5.627 7.032 7.960 1.00 . A A . 8 GLN NE2 1 1 1 109 1 1 8 GLN O O -1.665 7.820 3.859 1.00 . A A . 8 GLN O 1 1 1 110 1 1 8 GLN OE1 O -4.092 8.345 8.923 1.00 . A A . 8 GLN OE1 1 1 1 111 1 1 9 THR C C -1.107 5.006 2.785 1.00 . A A . 9 THR C 1 1 1 112 1 1 9 THR CA C -1.822 5.056 4.113 1.00 . A A . 9 THR CA 1 1 1 113 1 1 9 THR CB C -2.295 3.663 4.508 1.00 . A A . 9 THR CB 1 1 1 114 1 1 9 THR CG2 C -3.122 3.714 5.787 1.00 . A A . 9 THR CG2 1 1 1 115 1 1 9 THR H H -3.806 5.610 4.149 1.00 . A A . 9 THR H 1 1 1 116 1 1 9 THR HA H -1.141 5.400 4.841 1.00 . A A . 9 THR HA 1 1 1 117 1 1 9 THR HB H -1.435 3.063 4.678 1.00 . A A . 9 THR HB 1 1 1 118 1 1 9 THR HG1 H -3.630 3.770 3.058 1.00 . A A . 9 THR HG1 1 1 1 119 1 1 9 THR HG21 H -2.507 4.077 6.598 1.00 . A A . 9 THR HG21 1 1 1 120 1 1 9 THR HG22 H -3.482 2.724 6.025 1.00 . A A . 9 THR HG22 1 1 1 121 1 1 9 THR HG23 H -3.960 4.379 5.646 1.00 . A A . 9 THR HG23 1 1 1 122 1 1 9 THR N N -2.918 5.974 4.090 1.00 . A A . 9 THR N 1 1 1 123 1 1 9 THR O O 0.085 4.763 2.724 1.00 . A A . 9 THR O 1 1 1 124 1 1 9 THR OG1 O -3.073 3.090 3.456 1.00 . A A . 9 THR OG1 1 1 1 125 1 1 10 ILE C C -0.238 6.229 0.313 1.00 . A A . 10 ILE C 1 1 1 126 1 1 10 ILE CA C -1.332 5.220 0.393 1.00 . A A . 10 ILE CA 1 1 1 127 1 1 10 ILE CB C -2.415 5.573 -0.624 1.00 . A A . 10 ILE CB 1 1 1 128 1 1 10 ILE CD1 C -4.550 4.759 -1.649 1.00 . A A . 10 ILE CD1 1 1 1 129 1 1 10 ILE CG1 C -3.429 4.453 -0.707 1.00 . A A . 10 ILE CG1 1 1 1 130 1 1 10 ILE CG2 C -1.808 5.834 -1.983 1.00 . A A . 10 ILE CG2 1 1 1 131 1 1 10 ILE H H -2.775 5.457 1.870 1.00 . A A . 10 ILE H 1 1 1 132 1 1 10 ILE HA H -0.952 4.254 0.160 1.00 . A A . 10 ILE HA 1 1 1 133 1 1 10 ILE HB H -2.910 6.473 -0.295 1.00 . A A . 10 ILE HB 1 1 1 134 1 1 10 ILE HD11 H -4.151 4.919 -2.635 1.00 . A A . 10 ILE HD11 1 1 1 135 1 1 10 ILE HD12 H -5.058 5.648 -1.312 1.00 . A A . 10 ILE HD12 1 1 1 136 1 1 10 ILE HD13 H -5.239 3.929 -1.662 1.00 . A A . 10 ILE HD13 1 1 1 137 1 1 10 ILE HG12 H -2.940 3.554 -1.048 1.00 . A A . 10 ILE HG12 1 1 1 138 1 1 10 ILE HG13 H -3.850 4.284 0.270 1.00 . A A . 10 ILE HG13 1 1 1 139 1 1 10 ILE HG21 H -1.306 4.943 -2.323 1.00 . A A . 10 ILE HG21 1 1 1 140 1 1 10 ILE HG22 H -1.098 6.643 -1.905 1.00 . A A . 10 ILE HG22 1 1 1 141 1 1 10 ILE HG23 H -2.587 6.098 -2.677 1.00 . A A . 10 ILE HG23 1 1 1 142 1 1 10 ILE N N -1.856 5.224 1.734 1.00 . A A . 10 ILE N 1 1 1 143 1 1 10 ILE O O 0.878 5.934 -0.072 1.00 . A A . 10 ILE O 1 1 1 144 1 1 11 LYS C C 1.416 8.267 1.812 1.00 . A A . 11 LYS C 1 1 1 145 1 1 11 LYS CA C 0.330 8.499 0.779 1.00 . A A . 11 LYS CA 1 1 1 146 1 1 11 LYS CB C -0.473 9.761 0.991 1.00 . A A . 11 LYS CB 1 1 1 147 1 1 11 LYS CD C -2.304 11.114 -0.132 1.00 . A A . 11 LYS CD 1 1 1 148 1 1 11 LYS CE C -3.565 10.996 -0.976 1.00 . A A . 11 LYS CE 1 1 1 149 1 1 11 LYS CG C -1.718 9.738 0.125 1.00 . A A . 11 LYS CG 1 1 1 150 1 1 11 LYS H H -1.480 7.546 1.102 1.00 . A A . 11 LYS H 1 1 1 151 1 1 11 LYS HA H 0.798 8.543 -0.187 1.00 . A A . 11 LYS HA 1 1 1 152 1 1 11 LYS HB2 H -0.773 9.806 2.021 1.00 . A A . 11 LYS HB2 1 1 1 153 1 1 11 LYS HB3 H 0.120 10.628 0.735 1.00 . A A . 11 LYS HB3 1 1 1 154 1 1 11 LYS HD2 H -2.551 11.573 0.813 1.00 . A A . 11 LYS HD2 1 1 1 155 1 1 11 LYS HD3 H -1.579 11.718 -0.656 1.00 . A A . 11 LYS HD3 1 1 1 156 1 1 11 LYS HE2 H -3.290 10.620 -1.950 1.00 . A A . 11 LYS HE2 1 1 1 157 1 1 11 LYS HE3 H -4.232 10.294 -0.500 1.00 . A A . 11 LYS HE3 1 1 1 158 1 1 11 LYS HG2 H -1.478 9.259 -0.815 1.00 . A A . 11 LYS HG2 1 1 1 159 1 1 11 LYS HG3 H -2.463 9.143 0.633 1.00 . A A . 11 LYS HG3 1 1 1 160 1 1 11 LYS HZ1 H -4.670 12.610 -0.235 1.00 . A A . 11 LYS HZ1 1 1 1 161 1 1 11 LYS HZ2 H -5.056 12.180 -1.828 1.00 . A A . 11 LYS HZ2 1 1 1 162 1 1 11 LYS HZ3 H -3.622 13.021 -1.506 1.00 . A A . 11 LYS HZ3 1 1 1 163 1 1 11 LYS N N -0.571 7.403 0.758 1.00 . A A . 11 LYS N 1 1 1 164 1 1 11 LYS NZ N -4.273 12.293 -1.148 1.00 . A A . 11 LYS NZ 1 1 1 165 1 1 11 LYS O O 2.496 8.812 1.687 1.00 . A A . 11 LYS O 1 1 1 166 1 1 12 GLN C C 3.111 6.093 3.244 1.00 . A A . 12 GLN C 1 1 1 167 1 1 12 GLN CA C 2.087 7.090 3.823 1.00 . A A . 12 GLN CA 1 1 1 168 1 1 12 GLN CB C 1.331 6.477 4.984 1.00 . A A . 12 GLN CB 1 1 1 169 1 1 12 GLN CD C 1.819 8.451 6.475 1.00 . A A . 12 GLN CD 1 1 1 170 1 1 12 GLN CG C 0.769 7.491 5.964 1.00 . A A . 12 GLN CG 1 1 1 171 1 1 12 GLN H H 0.199 7.119 2.959 1.00 . A A . 12 GLN H 1 1 1 172 1 1 12 GLN HA H 2.592 7.975 4.157 1.00 . A A . 12 GLN HA 1 1 1 173 1 1 12 GLN HB2 H 0.502 5.909 4.587 1.00 . A A . 12 GLN HB2 1 1 1 174 1 1 12 GLN HB3 H 1.971 5.822 5.487 1.00 . A A . 12 GLN HB3 1 1 1 175 1 1 12 GLN HE21 H 1.456 9.676 4.956 1.00 . A A . 12 GLN HE21 1 1 1 176 1 1 12 GLN HE22 H 2.682 10.187 6.061 1.00 . A A . 12 GLN HE22 1 1 1 177 1 1 12 GLN HG2 H -0.006 8.059 5.471 1.00 . A A . 12 GLN HG2 1 1 1 178 1 1 12 GLN HG3 H 0.346 6.961 6.803 1.00 . A A . 12 GLN HG3 1 1 1 179 1 1 12 GLN N N 1.114 7.472 2.845 1.00 . A A . 12 GLN N 1 1 1 180 1 1 12 GLN NE2 N 2.005 9.548 5.763 1.00 . A A . 12 GLN NE2 1 1 1 181 1 1 12 GLN O O 4.287 6.052 3.629 1.00 . A A . 12 GLN O 1 1 1 182 1 1 12 GLN OE1 O 2.460 8.209 7.497 1.00 . A A . 12 GLN OE1 1 1 1 183 1 1 13 LEU C C 4.253 4.933 0.533 1.00 . A A . 13 LEU C 1 1 1 184 1 1 13 LEU CA C 3.507 4.313 1.686 1.00 . A A . 13 LEU CA 1 1 1 185 1 1 13 LEU CB C 2.660 3.146 1.235 1.00 . A A . 13 LEU CB 1 1 1 186 1 1 13 LEU CD1 C 1.067 1.316 1.879 1.00 . A A . 13 LEU CD1 1 1 1 187 1 1 13 LEU CD2 C 2.767 2.133 3.512 1.00 . A A . 13 LEU CD2 1 1 1 188 1 1 13 LEU CG C 1.860 2.517 2.361 1.00 . A A . 13 LEU CG 1 1 1 189 1 1 13 LEU H H 1.761 5.427 1.967 1.00 . A A . 13 LEU H 1 1 1 190 1 1 13 LEU HA H 4.204 3.975 2.432 1.00 . A A . 13 LEU HA 1 1 1 191 1 1 13 LEU HB2 H 1.976 3.493 0.475 1.00 . A A . 13 LEU HB2 1 1 1 192 1 1 13 LEU HB3 H 3.296 2.406 0.814 1.00 . A A . 13 LEU HB3 1 1 1 193 1 1 13 LEU HD11 H 0.378 1.627 1.107 1.00 . A A . 13 LEU HD11 1 1 1 194 1 1 13 LEU HD12 H 0.516 0.893 2.705 1.00 . A A . 13 LEU HD12 1 1 1 195 1 1 13 LEU HD13 H 1.743 0.575 1.480 1.00 . A A . 13 LEU HD13 1 1 1 196 1 1 13 LEU HD21 H 3.495 1.411 3.173 1.00 . A A . 13 LEU HD21 1 1 1 197 1 1 13 LEU HD22 H 2.176 1.702 4.306 1.00 . A A . 13 LEU HD22 1 1 1 198 1 1 13 LEU HD23 H 3.274 3.014 3.878 1.00 . A A . 13 LEU HD23 1 1 1 199 1 1 13 LEU HG H 1.173 3.260 2.721 1.00 . A A . 13 LEU HG 1 1 1 200 1 1 13 LEU N N 2.672 5.316 2.288 1.00 . A A . 13 LEU N 1 1 1 201 1 1 13 LEU O O 5.442 4.711 0.343 1.00 . A A . 13 LEU O 1 1 1 202 1 1 14 MET C C 5.108 7.539 -0.470 1.00 . A A . 14 MET C 1 1 1 203 1 1 14 MET CA C 4.124 6.637 -1.172 1.00 . A A . 14 MET CA 1 1 1 204 1 1 14 MET CB C 3.020 7.449 -1.791 1.00 . A A . 14 MET CB 1 1 1 205 1 1 14 MET CE C 1.836 3.958 -2.086 1.00 . A A . 14 MET CE 1 1 1 206 1 1 14 MET CG C 2.138 6.625 -2.674 1.00 . A A . 14 MET CG 1 1 1 207 1 1 14 MET H H 2.535 5.695 -0.177 1.00 . A A . 14 MET H 1 1 1 208 1 1 14 MET HA H 4.623 6.066 -1.937 1.00 . A A . 14 MET HA 1 1 1 209 1 1 14 MET HB2 H 2.408 7.875 -1.003 1.00 . A A . 14 MET HB2 1 1 1 210 1 1 14 MET HB3 H 3.446 8.232 -2.373 1.00 . A A . 14 MET HB3 1 1 1 211 1 1 14 MET HE1 H 2.145 2.936 -2.235 1.00 . A A . 14 MET HE1 1 1 1 212 1 1 14 MET HE2 H 0.806 4.076 -2.381 1.00 . A A . 14 MET HE2 1 1 1 213 1 1 14 MET HE3 H 1.951 4.225 -1.047 1.00 . A A . 14 MET HE3 1 1 1 214 1 1 14 MET HG2 H 1.184 6.476 -2.196 1.00 . A A . 14 MET HG2 1 1 1 215 1 1 14 MET HG3 H 2.008 7.153 -3.563 1.00 . A A . 14 MET HG3 1 1 1 216 1 1 14 MET N N 3.529 5.733 -0.226 1.00 . A A . 14 MET N 1 1 1 217 1 1 14 MET O O 6.101 7.988 -1.042 1.00 . A A . 14 MET O 1 1 1 218 1 1 14 MET SD S 2.852 5.033 -3.065 1.00 . A A . 14 MET SD 1 1 1 219 1 1 15 ASP C C 6.999 7.853 1.845 1.00 . A A . 15 ASP C 1 1 1 220 1 1 15 ASP CA C 5.656 8.539 1.676 1.00 . A A . 15 ASP CA 1 1 1 221 1 1 15 ASP CB C 4.987 8.687 3.035 1.00 . A A . 15 ASP CB 1 1 1 222 1 1 15 ASP CG C 5.618 9.760 3.896 1.00 . A A . 15 ASP CG 1 1 1 223 1 1 15 ASP H H 3.939 7.462 1.119 1.00 . A A . 15 ASP H 1 1 1 224 1 1 15 ASP HA H 5.810 9.517 1.247 1.00 . A A . 15 ASP HA 1 1 1 225 1 1 15 ASP HB2 H 3.938 8.912 2.892 1.00 . A A . 15 ASP HB2 1 1 1 226 1 1 15 ASP HB3 H 5.067 7.744 3.555 1.00 . A A . 15 ASP HB3 1 1 1 227 1 1 15 ASP N N 4.802 7.784 0.785 1.00 . A A . 15 ASP N 1 1 1 228 1 1 15 ASP O O 8.013 8.526 2.014 1.00 . A A . 15 ASP O 1 1 1 229 1 1 15 ASP OD1 O 5.290 10.951 3.705 1.00 . A A . 15 ASP OD1 1 1 1 230 1 1 15 ASP OD2 O 6.432 9.412 4.775 1.00 . A A . 15 ASP OD2 1 1 1 231 1 1 16 LEU C C 9.060 5.991 0.554 1.00 . A A . 16 LEU C 1 1 1 232 1 1 16 LEU CA C 8.297 5.824 1.871 1.00 . A A . 16 LEU CA 1 1 1 233 1 1 16 LEU CB C 8.051 4.360 2.169 1.00 . A A . 16 LEU CB 1 1 1 234 1 1 16 LEU CD1 C 6.635 2.628 3.271 1.00 . A A . 16 LEU CD1 1 1 1 235 1 1 16 LEU CD2 C 7.376 4.622 4.572 1.00 . A A . 16 LEU CD2 1 1 1 236 1 1 16 LEU CG C 6.971 4.094 3.205 1.00 . A A . 16 LEU CG 1 1 1 237 1 1 16 LEU H H 6.188 5.956 1.738 1.00 . A A . 16 LEU H 1 1 1 238 1 1 16 LEU HA H 8.868 6.259 2.675 1.00 . A A . 16 LEU HA 1 1 1 239 1 1 16 LEU HB2 H 7.769 3.868 1.251 1.00 . A A . 16 LEU HB2 1 1 1 240 1 1 16 LEU HB3 H 8.963 3.935 2.521 1.00 . A A . 16 LEU HB3 1 1 1 241 1 1 16 LEU HD11 H 7.533 2.054 3.437 1.00 . A A . 16 LEU HD11 1 1 1 242 1 1 16 LEU HD12 H 6.181 2.340 2.336 1.00 . A A . 16 LEU HD12 1 1 1 243 1 1 16 LEU HD13 H 5.939 2.460 4.076 1.00 . A A . 16 LEU HD13 1 1 1 244 1 1 16 LEU HD21 H 8.276 4.123 4.898 1.00 . A A . 16 LEU HD21 1 1 1 245 1 1 16 LEU HD22 H 6.583 4.430 5.280 1.00 . A A . 16 LEU HD22 1 1 1 246 1 1 16 LEU HD23 H 7.555 5.686 4.511 1.00 . A A . 16 LEU HD23 1 1 1 247 1 1 16 LEU HG H 6.087 4.598 2.892 1.00 . A A . 16 LEU HG 1 1 1 248 1 1 16 LEU N N 7.031 6.510 1.800 1.00 . A A . 16 LEU N 1 1 1 249 1 1 16 LEU O O 10.240 5.660 0.461 1.00 . A A . 16 LEU O 1 1 1 250 1 1 17 GLY C C 8.474 5.859 -2.832 1.00 . A A . 17 GLY C 1 1 1 251 1 1 17 GLY CA C 8.986 6.781 -1.742 1.00 . A A . 17 GLY CA 1 1 1 252 1 1 17 GLY H H 7.427 6.751 -0.315 1.00 . A A . 17 GLY H 1 1 1 253 1 1 17 GLY HA2 H 8.780 7.802 -2.027 1.00 . A A . 17 GLY HA2 1 1 1 254 1 1 17 GLY HA3 H 10.054 6.652 -1.650 1.00 . A A . 17 GLY HA3 1 1 1 255 1 1 17 GLY N N 8.370 6.521 -0.454 1.00 . A A . 17 GLY N 1 1 1 256 1 1 17 GLY O O 9.112 5.709 -3.875 1.00 . A A . 17 GLY O 1 1 1 257 1 1 18 PHE C C 5.762 4.809 -4.465 1.00 . A A . 18 PHE C 1 1 1 258 1 1 18 PHE CA C 6.802 4.244 -3.514 1.00 . A A . 18 PHE CA 1 1 1 259 1 1 18 PHE CB C 6.227 3.133 -2.672 1.00 . A A . 18 PHE CB 1 1 1 260 1 1 18 PHE CD1 C 8.490 2.160 -2.351 1.00 . A A . 18 PHE CD1 1 1 1 261 1 1 18 PHE CD2 C 7.025 2.443 -0.542 1.00 . A A . 18 PHE CD2 1 1 1 262 1 1 18 PHE CE1 C 9.444 1.652 -1.503 1.00 . A A . 18 PHE CE1 1 1 1 263 1 1 18 PHE CE2 C 7.933 1.963 0.298 1.00 . A A . 18 PHE CE2 1 1 1 264 1 1 18 PHE CG C 7.267 2.551 -1.841 1.00 . A A . 18 PHE CG 1 1 1 265 1 1 18 PHE CZ C 9.151 1.561 -0.162 1.00 . A A . 18 PHE CZ 1 1 1 266 1 1 18 PHE H H 6.808 5.437 -1.782 1.00 . A A . 18 PHE H 1 1 1 267 1 1 18 PHE HA H 7.630 3.849 -4.077 1.00 . A A . 18 PHE HA 1 1 1 268 1 1 18 PHE HB2 H 5.470 3.538 -2.021 1.00 . A A . 18 PHE HB2 1 1 1 269 1 1 18 PHE HB3 H 5.810 2.356 -3.255 1.00 . A A . 18 PHE HB3 1 1 1 270 1 1 18 PHE HD1 H 8.688 2.246 -3.408 1.00 . A A . 18 PHE HD1 1 1 1 271 1 1 18 PHE HD2 H 6.084 2.739 -0.179 1.00 . A A . 18 PHE HD2 1 1 1 272 1 1 18 PHE HE1 H 10.405 1.338 -1.882 1.00 . A A . 18 PHE HE1 1 1 1 273 1 1 18 PHE HE2 H 7.686 1.905 1.320 1.00 . A A . 18 PHE HE2 1 1 1 274 1 1 18 PHE HZ H 9.858 1.188 0.521 1.00 . A A . 18 PHE HZ 1 1 1 275 1 1 18 PHE N N 7.319 5.243 -2.603 1.00 . A A . 18 PHE N 1 1 1 276 1 1 18 PHE O O 5.318 5.951 -4.316 1.00 . A A . 18 PHE O 1 1 1 277 1 1 19 PRO C C 2.997 3.891 -5.840 1.00 . A A . 19 PRO C 1 1 1 278 1 1 19 PRO CA C 4.330 4.328 -6.410 1.00 . A A . 19 PRO CA 1 1 1 279 1 1 19 PRO CB C 4.671 3.457 -7.588 1.00 . A A . 19 PRO CB 1 1 1 280 1 1 19 PRO CD C 6.054 2.748 -5.847 1.00 . A A . 19 PRO CD 1 1 1 281 1 1 19 PRO CG C 5.143 2.245 -6.937 1.00 . A A . 19 PRO CG 1 1 1 282 1 1 19 PRO HA H 4.299 5.367 -6.704 1.00 . A A . 19 PRO HA 1 1 1 283 1 1 19 PRO HB2 H 3.801 3.282 -8.197 1.00 . A A . 19 PRO HB2 1 1 1 284 1 1 19 PRO HB3 H 5.455 3.901 -8.164 1.00 . A A . 19 PRO HB3 1 1 1 285 1 1 19 PRO HD2 H 6.054 2.083 -4.989 1.00 . A A . 19 PRO HD2 1 1 1 286 1 1 19 PRO HD3 H 7.052 2.898 -6.222 1.00 . A A . 19 PRO HD3 1 1 1 287 1 1 19 PRO HG2 H 4.309 1.688 -6.527 1.00 . A A . 19 PRO HG2 1 1 1 288 1 1 19 PRO HG3 H 5.671 1.673 -7.647 1.00 . A A . 19 PRO HG3 1 1 1 289 1 1 19 PRO N N 5.425 4.033 -5.498 1.00 . A A . 19 PRO N 1 1 1 290 1 1 19 PRO O O 2.927 3.024 -4.968 1.00 . A A . 19 PRO O 1 1 1 291 1 1 20 ARG C C 0.297 2.675 -6.252 1.00 . A A . 20 ARG C 1 1 1 292 1 1 20 ARG CA C 0.602 4.127 -5.963 1.00 . A A . 20 ARG CA 1 1 1 293 1 1 20 ARG CB C -0.380 5.017 -6.697 1.00 . A A . 20 ARG CB 1 1 1 294 1 1 20 ARG CD C -2.736 5.815 -6.711 1.00 . A A . 20 ARG CD 1 1 1 295 1 1 20 ARG CG C -1.805 4.670 -6.386 1.00 . A A . 20 ARG CG 1 1 1 296 1 1 20 ARG CZ C -4.911 6.677 -5.911 1.00 . A A . 20 ARG CZ 1 1 1 297 1 1 20 ARG H H 2.089 4.990 -7.182 1.00 . A A . 20 ARG H 1 1 1 298 1 1 20 ARG HA H 0.543 4.311 -4.900 1.00 . A A . 20 ARG HA 1 1 1 299 1 1 20 ARG HB2 H -0.201 6.040 -6.419 1.00 . A A . 20 ARG HB2 1 1 1 300 1 1 20 ARG HB3 H -0.231 4.908 -7.757 1.00 . A A . 20 ARG HB3 1 1 1 301 1 1 20 ARG HD2 H -2.248 6.734 -6.433 1.00 . A A . 20 ARG HD2 1 1 1 302 1 1 20 ARG HD3 H -2.928 5.816 -7.775 1.00 . A A . 20 ARG HD3 1 1 1 303 1 1 20 ARG HE H -4.188 4.851 -5.535 1.00 . A A . 20 ARG HE 1 1 1 304 1 1 20 ARG HG2 H -2.078 3.813 -6.976 1.00 . A A . 20 ARG HG2 1 1 1 305 1 1 20 ARG HG3 H -1.878 4.429 -5.345 1.00 . A A . 20 ARG HG3 1 1 1 306 1 1 20 ARG HH11 H -3.900 7.969 -7.118 1.00 . A A . 20 ARG HH11 1 1 1 307 1 1 20 ARG HH12 H -5.424 8.549 -6.507 1.00 . A A . 20 ARG HH12 1 1 1 308 1 1 20 ARG HH21 H -6.160 5.621 -4.709 1.00 . A A . 20 ARG HH21 1 1 1 309 1 1 20 ARG HH22 H -6.694 7.237 -5.105 1.00 . A A . 20 ARG HH22 1 1 1 310 1 1 20 ARG N N 1.948 4.422 -6.408 1.00 . A A . 20 ARG N 1 1 1 311 1 1 20 ARG NE N -4.007 5.701 -5.996 1.00 . A A . 20 ARG NE 1 1 1 312 1 1 20 ARG NH1 N -4.729 7.824 -6.558 1.00 . A A . 20 ARG NH1 1 1 1 313 1 1 20 ARG NH2 N -6.009 6.496 -5.190 1.00 . A A . 20 ARG NH2 1 1 1 314 1 1 20 ARG O O -0.436 1.995 -5.532 1.00 . A A . 20 ARG O 1 1 1 315 1 1 21 ASP C C 1.346 -0.076 -6.618 1.00 . A A . 21 ASP C 1 1 1 316 1 1 21 ASP CA C 0.882 0.845 -7.752 1.00 . A A . 21 ASP CA 1 1 1 317 1 1 21 ASP CB C 1.789 0.693 -8.977 1.00 . A A . 21 ASP CB 1 1 1 318 1 1 21 ASP CG C 2.037 -0.745 -9.372 1.00 . A A . 21 ASP CG 1 1 1 319 1 1 21 ASP H H 1.366 2.902 -7.884 1.00 . A A . 21 ASP H 1 1 1 320 1 1 21 ASP HA H -0.128 0.586 -8.028 1.00 . A A . 21 ASP HA 1 1 1 321 1 1 21 ASP HB2 H 1.330 1.197 -9.815 1.00 . A A . 21 ASP HB2 1 1 1 322 1 1 21 ASP HB3 H 2.742 1.159 -8.768 1.00 . A A . 21 ASP HB3 1 1 1 323 1 1 21 ASP N N 0.893 2.240 -7.333 1.00 . A A . 21 ASP N 1 1 1 324 1 1 21 ASP O O 0.844 -1.189 -6.465 1.00 . A A . 21 ASP O 1 1 1 325 1 1 21 ASP OD1 O 1.139 -1.363 -9.980 1.00 . A A . 21 ASP OD1 1 1 1 326 1 1 21 ASP OD2 O 3.149 -1.249 -9.111 1.00 . A A . 21 ASP OD2 1 1 1 327 1 1 22 ALA C C 1.776 -0.557 -3.588 1.00 . A A . 22 ALA C 1 1 1 328 1 1 22 ALA CA C 2.811 -0.371 -4.693 1.00 . A A . 22 ALA CA 1 1 1 329 1 1 22 ALA CB C 4.068 0.276 -4.136 1.00 . A A . 22 ALA CB 1 1 1 330 1 1 22 ALA H H 2.589 1.335 -5.924 1.00 . A A . 22 ALA H 1 1 1 331 1 1 22 ALA HA H 3.079 -1.342 -5.083 1.00 . A A . 22 ALA HA 1 1 1 332 1 1 22 ALA HB1 H 4.793 0.395 -4.928 1.00 . A A . 22 ALA HB1 1 1 1 333 1 1 22 ALA HB2 H 4.481 -0.350 -3.359 1.00 . A A . 22 ALA HB2 1 1 1 334 1 1 22 ALA HB3 H 3.820 1.243 -3.727 1.00 . A A . 22 ALA HB3 1 1 1 335 1 1 22 ALA N N 2.271 0.416 -5.796 1.00 . A A . 22 ALA N 1 1 1 336 1 1 22 ALA O O 1.715 -1.620 -2.971 1.00 . A A . 22 ALA O 1 1 1 337 1 1 23 VAL C C -1.065 -0.697 -2.786 1.00 . A A . 23 VAL C 1 1 1 338 1 1 23 VAL CA C -0.090 0.360 -2.340 1.00 . A A . 23 VAL CA 1 1 1 339 1 1 23 VAL CB C -0.801 1.722 -2.133 1.00 . A A . 23 VAL CB 1 1 1 340 1 1 23 VAL CG1 C -2.114 1.807 -2.864 1.00 . A A . 23 VAL CG1 1 1 1 341 1 1 23 VAL CG2 C -1.030 1.995 -0.674 1.00 . A A . 23 VAL CG2 1 1 1 342 1 1 23 VAL H H 1.036 1.301 -3.851 1.00 . A A . 23 VAL H 1 1 1 343 1 1 23 VAL HA H 0.343 0.054 -1.416 1.00 . A A . 23 VAL HA 1 1 1 344 1 1 23 VAL HB H -0.159 2.489 -2.526 1.00 . A A . 23 VAL HB 1 1 1 345 1 1 23 VAL HG11 H -1.925 1.756 -3.923 1.00 . A A . 23 VAL HG11 1 1 1 346 1 1 23 VAL HG12 H -2.615 2.733 -2.618 1.00 . A A . 23 VAL HG12 1 1 1 347 1 1 23 VAL HG13 H -2.732 0.970 -2.567 1.00 . A A . 23 VAL HG13 1 1 1 348 1 1 23 VAL HG21 H -0.563 2.941 -0.410 1.00 . A A . 23 VAL HG21 1 1 1 349 1 1 23 VAL HG22 H -0.594 1.200 -0.094 1.00 . A A . 23 VAL HG22 1 1 1 350 1 1 23 VAL HG23 H -2.103 2.038 -0.489 1.00 . A A . 23 VAL HG23 1 1 1 351 1 1 23 VAL N N 0.955 0.467 -3.339 1.00 . A A . 23 VAL N 1 1 1 352 1 1 23 VAL O O -1.494 -1.562 -2.057 1.00 . A A . 23 VAL O 1 1 1 353 1 1 24 VAL C C -1.843 -2.972 -4.645 1.00 . A A . 24 VAL C 1 1 1 354 1 1 24 VAL CA C -2.336 -1.542 -4.555 1.00 . A A . 24 VAL CA 1 1 1 355 1 1 24 VAL CB C -2.841 -1.023 -5.892 1.00 . A A . 24 VAL CB 1 1 1 356 1 1 24 VAL CG1 C -3.631 -2.092 -6.628 1.00 . A A . 24 VAL CG1 1 1 1 357 1 1 24 VAL CG2 C -3.686 0.209 -5.638 1.00 . A A . 24 VAL CG2 1 1 1 358 1 1 24 VAL H H -0.984 0.062 -4.562 1.00 . A A . 24 VAL H 1 1 1 359 1 1 24 VAL HA H -3.161 -1.540 -3.861 1.00 . A A . 24 VAL HA 1 1 1 360 1 1 24 VAL HB H -1.982 -0.727 -6.485 1.00 . A A . 24 VAL HB 1 1 1 361 1 1 24 VAL HG11 H -4.011 -1.691 -7.555 1.00 . A A . 24 VAL HG11 1 1 1 362 1 1 24 VAL HG12 H -4.453 -2.415 -6.005 1.00 . A A . 24 VAL HG12 1 1 1 363 1 1 24 VAL HG13 H -2.984 -2.933 -6.833 1.00 . A A . 24 VAL HG13 1 1 1 364 1 1 24 VAL HG21 H -4.352 0.375 -6.471 1.00 . A A . 24 VAL HG21 1 1 1 365 1 1 24 VAL HG22 H -3.040 1.063 -5.503 1.00 . A A . 24 VAL HG22 1 1 1 366 1 1 24 VAL HG23 H -4.266 0.053 -4.727 1.00 . A A . 24 VAL HG23 1 1 1 367 1 1 24 VAL N N -1.369 -0.646 -4.017 1.00 . A A . 24 VAL N 1 1 1 368 1 1 24 VAL O O -2.557 -3.871 -4.235 1.00 . A A . 24 VAL O 1 1 1 369 1 1 25 LYS C C -0.030 -5.142 -3.799 1.00 . A A . 25 LYS C 1 1 1 370 1 1 25 LYS CA C -0.138 -4.559 -5.196 1.00 . A A . 25 LYS CA 1 1 1 371 1 1 25 LYS CB C 1.221 -4.602 -5.890 1.00 . A A . 25 LYS CB 1 1 1 372 1 1 25 LYS CD C 2.502 -4.249 -8.014 1.00 . A A . 25 LYS CD 1 1 1 373 1 1 25 LYS CE C 2.440 -4.226 -9.532 1.00 . A A . 25 LYS CE 1 1 1 374 1 1 25 LYS CG C 1.136 -4.502 -7.403 1.00 . A A . 25 LYS CG 1 1 1 375 1 1 25 LYS H H -0.082 -2.453 -5.441 1.00 . A A . 25 LYS H 1 1 1 376 1 1 25 LYS HA H -0.847 -5.146 -5.761 1.00 . A A . 25 LYS HA 1 1 1 377 1 1 25 LYS HB2 H 1.821 -3.779 -5.531 1.00 . A A . 25 LYS HB2 1 1 1 378 1 1 25 LYS HB3 H 1.713 -5.530 -5.639 1.00 . A A . 25 LYS HB3 1 1 1 379 1 1 25 LYS HD2 H 2.863 -3.295 -7.662 1.00 . A A . 25 LYS HD2 1 1 1 380 1 1 25 LYS HD3 H 3.177 -5.032 -7.702 1.00 . A A . 25 LYS HD3 1 1 1 381 1 1 25 LYS HE2 H 2.307 -5.236 -9.890 1.00 . A A . 25 LYS HE2 1 1 1 382 1 1 25 LYS HE3 H 1.597 -3.623 -9.838 1.00 . A A . 25 LYS HE3 1 1 1 383 1 1 25 LYS HG2 H 0.743 -5.428 -7.795 1.00 . A A . 25 LYS HG2 1 1 1 384 1 1 25 LYS HG3 H 0.476 -3.687 -7.666 1.00 . A A . 25 LYS HG3 1 1 1 385 1 1 25 LYS HZ1 H 3.912 -2.755 -9.669 1.00 . A A . 25 LYS HZ1 1 1 1 386 1 1 25 LYS HZ2 H 3.549 -3.505 -11.145 1.00 . A A . 25 LYS HZ2 1 1 1 387 1 1 25 LYS HZ3 H 4.480 -4.325 -9.992 1.00 . A A . 25 LYS HZ3 1 1 1 388 1 1 25 LYS N N -0.642 -3.200 -5.131 1.00 . A A . 25 LYS N 1 1 1 389 1 1 25 LYS NZ N 3.680 -3.665 -10.126 1.00 . A A . 25 LYS NZ 1 1 1 390 1 1 25 LYS O O -0.453 -6.278 -3.542 1.00 . A A . 25 LYS O 1 1 1 391 1 1 26 ALA C C -0.357 -4.949 -0.699 1.00 . A A . 26 ALA C 1 1 1 392 1 1 26 ALA CA C 0.837 -4.864 -1.595 1.00 . A A . 26 ALA CA 1 1 1 393 1 1 26 ALA CB C 1.930 -4.032 -0.971 1.00 . A A . 26 ALA CB 1 1 1 394 1 1 26 ALA H H 0.566 -3.372 -3.050 1.00 . A A . 26 ALA H 1 1 1 395 1 1 26 ALA HA H 1.206 -5.868 -1.742 1.00 . A A . 26 ALA HA 1 1 1 396 1 1 26 ALA HB1 H 2.212 -4.462 -0.021 1.00 . A A . 26 ALA HB1 1 1 1 397 1 1 26 ALA HB2 H 1.573 -3.024 -0.821 1.00 . A A . 26 ALA HB2 1 1 1 398 1 1 26 ALA HB3 H 2.787 -4.016 -1.628 1.00 . A A . 26 ALA HB3 1 1 1 399 1 1 26 ALA N N 0.483 -4.345 -2.881 1.00 . A A . 26 ALA N 1 1 1 400 1 1 26 ALA O O -0.514 -5.922 0.033 1.00 . A A . 26 ALA O 1 1 1 401 1 1 27 LEU C C -3.341 -4.929 -0.436 1.00 . A A . 27 LEU C 1 1 1 402 1 1 27 LEU CA C -2.331 -3.944 0.123 1.00 . A A . 27 LEU CA 1 1 1 403 1 1 27 LEU CB C -2.922 -2.538 0.279 1.00 . A A . 27 LEU CB 1 1 1 404 1 1 27 LEU CD1 C -2.185 -1.434 2.392 1.00 . A A . 27 LEU CD1 1 1 1 405 1 1 27 LEU CD2 C -0.634 -1.573 0.498 1.00 . A A . 27 LEU CD2 1 1 1 406 1 1 27 LEU CG C -2.059 -1.438 0.899 1.00 . A A . 27 LEU CG 1 1 1 407 1 1 27 LEU H H -1.083 -3.190 -1.378 1.00 . A A . 27 LEU H 1 1 1 408 1 1 27 LEU HA H -1.998 -4.292 1.089 1.00 . A A . 27 LEU HA 1 1 1 409 1 1 27 LEU HB2 H -3.187 -2.194 -0.700 1.00 . A A . 27 LEU HB2 1 1 1 410 1 1 27 LEU HB3 H -3.826 -2.622 0.863 1.00 . A A . 27 LEU HB3 1 1 1 411 1 1 27 LEU HD11 H -1.848 -2.385 2.769 1.00 . A A . 27 LEU HD11 1 1 1 412 1 1 27 LEU HD12 H -3.218 -1.283 2.657 1.00 . A A . 27 LEU HD12 1 1 1 413 1 1 27 LEU HD13 H -1.581 -0.644 2.805 1.00 . A A . 27 LEU HD13 1 1 1 414 1 1 27 LEU HD21 H -0.052 -0.765 0.899 1.00 . A A . 27 LEU HD21 1 1 1 415 1 1 27 LEU HD22 H -0.593 -1.568 -0.584 1.00 . A A . 27 LEU HD22 1 1 1 416 1 1 27 LEU HD23 H -0.271 -2.522 0.862 1.00 . A A . 27 LEU HD23 1 1 1 417 1 1 27 LEU HG H -2.389 -0.504 0.524 1.00 . A A . 27 LEU HG 1 1 1 418 1 1 27 LEU N N -1.208 -3.950 -0.746 1.00 . A A . 27 LEU N 1 1 1 419 1 1 27 LEU O O -4.064 -5.531 0.288 1.00 . A A . 27 LEU O 1 1 1 420 1 1 28 LYS C C -3.956 -7.503 -1.738 1.00 . A A . 28 LYS C 1 1 1 421 1 1 28 LYS CA C -4.246 -6.125 -2.324 1.00 . A A . 28 LYS CA 1 1 1 422 1 1 28 LYS CB C -4.102 -6.170 -3.844 1.00 . A A . 28 LYS CB 1 1 1 423 1 1 28 LYS CD C -6.622 -5.944 -3.752 1.00 . A A . 28 LYS CD 1 1 1 424 1 1 28 LYS CE C -7.892 -5.780 -4.573 1.00 . A A . 28 LYS CE 1 1 1 425 1 1 28 LYS CG C -5.397 -6.030 -4.638 1.00 . A A . 28 LYS CG 1 1 1 426 1 1 28 LYS H H -2.841 -4.544 -2.325 1.00 . A A . 28 LYS H 1 1 1 427 1 1 28 LYS HA H -5.251 -5.854 -2.070 1.00 . A A . 28 LYS HA 1 1 1 428 1 1 28 LYS HB2 H -3.468 -5.357 -4.133 1.00 . A A . 28 LYS HB2 1 1 1 429 1 1 28 LYS HB3 H -3.630 -7.101 -4.125 1.00 . A A . 28 LYS HB3 1 1 1 430 1 1 28 LYS HD2 H -6.697 -6.844 -3.159 1.00 . A A . 28 LYS HD2 1 1 1 431 1 1 28 LYS HD3 H -6.509 -5.092 -3.108 1.00 . A A . 28 LYS HD3 1 1 1 432 1 1 28 LYS HE2 H -7.804 -4.889 -5.176 1.00 . A A . 28 LYS HE2 1 1 1 433 1 1 28 LYS HE3 H -7.997 -6.639 -5.219 1.00 . A A . 28 LYS HE3 1 1 1 434 1 1 28 LYS HG2 H -5.340 -5.122 -5.219 1.00 . A A . 28 LYS HG2 1 1 1 435 1 1 28 LYS HG3 H -5.497 -6.878 -5.298 1.00 . A A . 28 LYS HG3 1 1 1 436 1 1 28 LYS HZ1 H -8.992 -4.888 -3.034 1.00 . A A . 28 LYS HZ1 1 1 1 437 1 1 28 LYS HZ2 H -9.256 -6.555 -3.194 1.00 . A A . 28 LYS HZ2 1 1 1 438 1 1 28 LYS HZ3 H -9.942 -5.473 -4.308 1.00 . A A . 28 LYS HZ3 1 1 1 439 1 1 28 LYS N N -3.372 -5.115 -1.742 1.00 . A A . 28 LYS N 1 1 1 440 1 1 28 LYS NZ N -9.103 -5.666 -3.718 1.00 . A A . 28 LYS NZ 1 1 1 441 1 1 28 LYS O O -4.887 -8.213 -1.352 1.00 . A A . 28 LYS O 1 1 1 442 1 1 29 GLN C C -2.558 -9.303 0.362 1.00 . A A . 29 GLN C 1 1 1 443 1 1 29 GLN CA C -2.372 -9.212 -1.149 1.00 . A A . 29 GLN CA 1 1 1 444 1 1 29 GLN CB C -0.967 -9.565 -1.564 1.00 . A A . 29 GLN CB 1 1 1 445 1 1 29 GLN CD C 1.359 -8.727 -1.874 1.00 . A A . 29 GLN CD 1 1 1 446 1 1 29 GLN CG C 0.108 -8.665 -1.028 1.00 . A A . 29 GLN CG 1 1 1 447 1 1 29 GLN H H -1.927 -7.283 -1.916 1.00 . A A . 29 GLN H 1 1 1 448 1 1 29 GLN HA H -3.055 -9.902 -1.621 1.00 . A A . 29 GLN HA 1 1 1 449 1 1 29 GLN HB2 H -0.762 -10.547 -1.247 1.00 . A A . 29 GLN HB2 1 1 1 450 1 1 29 GLN HB3 H -0.918 -9.520 -2.621 1.00 . A A . 29 GLN HB3 1 1 1 451 1 1 29 GLN HE21 H 1.725 -6.823 -1.496 1.00 . A A . 29 GLN HE21 1 1 1 452 1 1 29 GLN HE22 H 2.844 -7.612 -2.537 1.00 . A A . 29 GLN HE22 1 1 1 453 1 1 29 GLN HG2 H -0.257 -7.650 -1.011 1.00 . A A . 29 GLN HG2 1 1 1 454 1 1 29 GLN HG3 H 0.345 -8.982 -0.035 1.00 . A A . 29 GLN HG3 1 1 1 455 1 1 29 GLN N N -2.677 -7.890 -1.639 1.00 . A A . 29 GLN N 1 1 1 456 1 1 29 GLN NE2 N 2.051 -7.610 -1.973 1.00 . A A . 29 GLN NE2 1 1 1 457 1 1 29 GLN O O -2.860 -10.364 0.907 1.00 . A A . 29 GLN O 1 1 1 458 1 1 29 GLN OE1 O 1.693 -9.760 -2.451 1.00 . A A . 29 GLN OE1 1 1 1 459 1 1 30 THR C C -3.985 -7.626 2.837 1.00 . A A . 30 THR C 1 1 1 460 1 1 30 THR CA C -2.569 -8.067 2.460 1.00 . A A . 30 THR CA 1 1 1 461 1 1 30 THR CB C -1.598 -7.034 3.021 1.00 . A A . 30 THR CB 1 1 1 462 1 1 30 THR CG2 C -0.156 -7.493 2.889 1.00 . A A . 30 THR CG2 1 1 1 463 1 1 30 THR H H -2.078 -7.394 0.519 1.00 . A A . 30 THR H 1 1 1 464 1 1 30 THR HA H -2.354 -9.021 2.911 1.00 . A A . 30 THR HA 1 1 1 465 1 1 30 THR HB H -1.829 -6.879 4.056 1.00 . A A . 30 THR HB 1 1 1 466 1 1 30 THR HG1 H -1.199 -5.782 1.557 1.00 . A A . 30 THR HG1 1 1 1 467 1 1 30 THR HG21 H 0.499 -6.745 3.312 1.00 . A A . 30 THR HG21 1 1 1 468 1 1 30 THR HG22 H 0.081 -7.628 1.841 1.00 . A A . 30 THR HG22 1 1 1 469 1 1 30 THR HG23 H -0.024 -8.428 3.413 1.00 . A A . 30 THR HG23 1 1 1 470 1 1 30 THR N N -2.385 -8.176 1.017 1.00 . A A . 30 THR N 1 1 1 471 1 1 30 THR O O -4.339 -7.548 4.015 1.00 . A A . 30 THR O 1 1 1 472 1 1 30 THR OG1 O -1.775 -5.798 2.334 1.00 . A A . 30 THR OG1 1 1 1 473 1 1 31 ASN C C -6.023 -5.373 2.688 1.00 . A A . 31 ASN C 1 1 1 474 1 1 31 ASN CA C -6.085 -6.712 1.940 1.00 . A A . 31 ASN CA 1 1 1 475 1 1 31 ASN CB C -7.114 -7.645 2.592 1.00 . A A . 31 ASN CB 1 1 1 476 1 1 31 ASN CG C -7.489 -8.814 1.705 1.00 . A A . 31 ASN CG 1 1 1 477 1 1 31 ASN H H -4.459 -7.582 0.917 1.00 . A A . 31 ASN H 1 1 1 478 1 1 31 ASN HA H -6.410 -6.489 0.929 1.00 . A A . 31 ASN HA 1 1 1 479 1 1 31 ASN HB2 H -6.704 -8.036 3.510 1.00 . A A . 31 ASN HB2 1 1 1 480 1 1 31 ASN HB3 H -8.012 -7.083 2.815 1.00 . A A . 31 ASN HB3 1 1 1 481 1 1 31 ASN HD21 H -6.164 -9.977 2.633 1.00 . A A . 31 ASN HD21 1 1 1 482 1 1 31 ASN HD22 H -7.061 -10.723 1.345 1.00 . A A . 31 ASN HD22 1 1 1 483 1 1 31 ASN N N -4.774 -7.350 1.815 1.00 . A A . 31 ASN N 1 1 1 484 1 1 31 ASN ND2 N -6.843 -9.950 1.916 1.00 . A A . 31 ASN ND2 1 1 1 485 1 1 31 ASN O O -6.700 -5.181 3.697 1.00 . A A . 31 ASN O 1 1 1 486 1 1 31 ASN OD1 O -8.375 -8.704 0.854 1.00 . A A . 31 ASN OD1 1 1 1 487 1 1 32 GLY C C -4.724 -2.765 3.985 1.00 . A A . 32 GLY C 1 1 1 488 1 1 32 GLY CA C -5.289 -3.074 2.598 1.00 . A A . 32 GLY CA 1 1 1 489 1 1 32 GLY H H -4.592 -4.675 1.422 1.00 . A A . 32 GLY H 1 1 1 490 1 1 32 GLY HA2 H -4.754 -2.481 1.860 1.00 . A A . 32 GLY HA2 1 1 1 491 1 1 32 GLY HA3 H -6.327 -2.770 2.576 1.00 . A A . 32 GLY HA3 1 1 1 492 1 1 32 GLY N N -5.225 -4.439 2.165 1.00 . A A . 32 GLY N 1 1 1 493 1 1 32 GLY O O -4.880 -1.634 4.444 1.00 . A A . 32 GLY O 1 1 1 494 1 1 33 ASN C C -2.159 -2.724 5.845 1.00 . A A . 33 ASN C 1 1 1 495 1 1 33 ASN CA C -3.546 -3.365 5.985 1.00 . A A . 33 ASN CA 1 1 1 496 1 1 33 ASN CB C -3.630 -4.562 6.940 1.00 . A A . 33 ASN CB 1 1 1 497 1 1 33 ASN CG C -2.673 -5.711 6.699 1.00 . A A . 33 ASN CG 1 1 1 498 1 1 33 ASN H H -3.994 -4.628 4.377 1.00 . A A . 33 ASN H 1 1 1 499 1 1 33 ASN HA H -4.195 -2.602 6.371 1.00 . A A . 33 ASN HA 1 1 1 500 1 1 33 ASN HB2 H -3.466 -4.207 7.920 1.00 . A A . 33 ASN HB2 1 1 1 501 1 1 33 ASN HB3 H -4.631 -4.960 6.883 1.00 . A A . 33 ASN HB3 1 1 1 502 1 1 33 ASN HD21 H -2.288 -5.079 4.876 1.00 . A A . 33 ASN HD21 1 1 1 503 1 1 33 ASN HD22 H -1.484 -6.526 5.363 1.00 . A A . 33 ASN HD22 1 1 1 504 1 1 33 ASN N N -4.081 -3.708 4.693 1.00 . A A . 33 ASN N 1 1 1 505 1 1 33 ASN ND2 N -2.090 -5.779 5.531 1.00 . A A . 33 ASN ND2 1 1 1 506 1 1 33 ASN O O -1.176 -3.360 5.467 1.00 . A A . 33 ASN O 1 1 1 507 1 1 33 ASN OD1 O -2.438 -6.524 7.592 1.00 . A A . 33 ASN OD1 1 1 1 508 1 1 34 ALA C C 0.352 -1.031 6.064 1.00 . A A . 34 ALA C 1 1 1 509 1 1 34 ALA CA C -1.045 -0.530 5.730 1.00 . A A . 34 ALA CA 1 1 1 510 1 1 34 ALA CB C -1.256 0.841 6.345 1.00 . A A . 34 ALA CB 1 1 1 511 1 1 34 ALA H H -2.898 -1.043 6.612 1.00 . A A . 34 ALA H 1 1 1 512 1 1 34 ALA HA H -1.103 -0.419 4.664 1.00 . A A . 34 ALA HA 1 1 1 513 1 1 34 ALA HB1 H -0.541 1.535 5.929 1.00 . A A . 34 ALA HB1 1 1 1 514 1 1 34 ALA HB2 H -1.120 0.782 7.414 1.00 . A A . 34 ALA HB2 1 1 1 515 1 1 34 ALA HB3 H -2.258 1.184 6.127 1.00 . A A . 34 ALA HB3 1 1 1 516 1 1 34 ALA N N -2.133 -1.427 6.127 1.00 . A A . 34 ALA N 1 1 1 517 1 1 34 ALA O O 1.138 -1.305 5.156 1.00 . A A . 34 ALA O 1 1 1 518 1 1 35 GLU C C 2.498 -2.733 7.205 1.00 . A A . 35 GLU C 1 1 1 519 1 1 35 GLU CA C 1.982 -1.448 7.786 1.00 . A A . 35 GLU CA 1 1 1 520 1 1 35 GLU CB C 1.996 -1.481 9.288 1.00 . A A . 35 GLU CB 1 1 1 521 1 1 35 GLU CD C 3.407 0.539 9.746 1.00 . A A . 35 GLU CD 1 1 1 522 1 1 35 GLU CG C 2.052 -0.117 9.882 1.00 . A A . 35 GLU CG 1 1 1 523 1 1 35 GLU H H -0.004 -1.013 8.029 1.00 . A A . 35 GLU H 1 1 1 524 1 1 35 GLU HA H 2.573 -0.664 7.473 1.00 . A A . 35 GLU HA 1 1 1 525 1 1 35 GLU HB2 H 1.100 -1.951 9.644 1.00 . A A . 35 GLU HB2 1 1 1 526 1 1 35 GLU HB3 H 2.840 -2.031 9.617 1.00 . A A . 35 GLU HB3 1 1 1 527 1 1 35 GLU HG2 H 1.321 0.489 9.387 1.00 . A A . 35 GLU HG2 1 1 1 528 1 1 35 GLU HG3 H 1.807 -0.202 10.908 1.00 . A A . 35 GLU HG3 1 1 1 529 1 1 35 GLU N N 0.663 -1.145 7.347 1.00 . A A . 35 GLU N 1 1 1 530 1 1 35 GLU O O 3.652 -2.849 6.787 1.00 . A A . 35 GLU O 1 1 1 531 1 1 35 GLU OE1 O 3.779 0.934 8.621 1.00 . A A . 35 GLU OE1 1 1 1 532 1 1 35 GLU OE2 O 4.105 0.669 10.773 1.00 . A A . 35 GLU OE2 1 1 1 533 1 1 36 PHE C C 2.185 -4.944 5.185 1.00 . A A . 36 PHE C 1 1 1 534 1 1 36 PHE CA C 1.870 -4.985 6.654 1.00 . A A . 36 PHE CA 1 1 1 535 1 1 36 PHE CB C 0.639 -5.842 6.914 1.00 . A A . 36 PHE CB 1 1 1 536 1 1 36 PHE CD1 C 0.734 -5.532 9.358 1.00 . A A . 36 PHE CD1 1 1 1 537 1 1 36 PHE CD2 C 0.522 -7.755 8.547 1.00 . A A . 36 PHE CD2 1 1 1 538 1 1 36 PHE CE1 C 0.742 -5.977 10.628 1.00 . A A . 36 PHE CE1 1 1 1 539 1 1 36 PHE CE2 C 0.525 -8.224 9.849 1.00 . A A . 36 PHE CE2 1 1 1 540 1 1 36 PHE CG C 0.627 -6.396 8.296 1.00 . A A . 36 PHE CG 1 1 1 541 1 1 36 PHE CZ C 0.637 -7.328 10.897 1.00 . A A . 36 PHE CZ 1 1 1 542 1 1 36 PHE H H 0.704 -3.447 7.471 1.00 . A A . 36 PHE H 1 1 1 543 1 1 36 PHE HA H 2.712 -5.385 7.191 1.00 . A A . 36 PHE HA 1 1 1 544 1 1 36 PHE HB2 H -0.238 -5.217 6.808 1.00 . A A . 36 PHE HB2 1 1 1 545 1 1 36 PHE HB3 H 0.577 -6.642 6.205 1.00 . A A . 36 PHE HB3 1 1 1 546 1 1 36 PHE HD1 H 0.816 -4.478 9.180 1.00 . A A . 36 PHE HD1 1 1 1 547 1 1 36 PHE HD2 H 0.435 -8.446 7.722 1.00 . A A . 36 PHE HD2 1 1 1 548 1 1 36 PHE HE1 H 0.832 -5.260 11.410 1.00 . A A . 36 PHE HE1 1 1 1 549 1 1 36 PHE HE2 H 0.443 -9.283 10.046 1.00 . A A . 36 PHE HE2 1 1 1 550 1 1 36 PHE HZ H 0.644 -7.682 11.918 1.00 . A A . 36 PHE HZ 1 1 1 551 1 1 36 PHE N N 1.603 -3.664 7.158 1.00 . A A . 36 PHE N 1 1 1 552 1 1 36 PHE O O 3.157 -5.536 4.718 1.00 . A A . 36 PHE O 1 1 1 553 1 1 37 ALA C C 2.702 -3.366 2.624 1.00 . A A . 37 ALA C 1 1 1 554 1 1 37 ALA CA C 1.494 -4.178 3.041 1.00 . A A . 37 ALA CA 1 1 1 555 1 1 37 ALA CB C 0.251 -3.622 2.475 1.00 . A A . 37 ALA CB 1 1 1 556 1 1 37 ALA H H 0.652 -3.691 4.892 1.00 . A A . 37 ALA H 1 1 1 557 1 1 37 ALA HA H 1.607 -5.187 2.675 1.00 . A A . 37 ALA HA 1 1 1 558 1 1 37 ALA HB1 H 0.300 -3.655 1.397 1.00 . A A . 37 ALA HB1 1 1 1 559 1 1 37 ALA HB2 H 0.141 -2.599 2.800 1.00 . A A . 37 ALA HB2 1 1 1 560 1 1 37 ALA HB3 H -0.590 -4.202 2.815 1.00 . A A . 37 ALA HB3 1 1 1 561 1 1 37 ALA N N 1.362 -4.234 4.456 1.00 . A A . 37 ALA N 1 1 1 562 1 1 37 ALA O O 3.288 -3.619 1.597 1.00 . A A . 37 ALA O 1 1 1 563 1 1 38 ALA C C 5.444 -2.566 3.226 1.00 . A A . 38 ALA C 1 1 1 564 1 1 38 ALA CA C 4.268 -1.621 3.199 1.00 . A A . 38 ALA CA 1 1 1 565 1 1 38 ALA CB C 4.436 -0.569 4.271 1.00 . A A . 38 ALA CB 1 1 1 566 1 1 38 ALA H H 2.436 -2.091 4.109 1.00 . A A . 38 ALA H 1 1 1 567 1 1 38 ALA HA H 4.221 -1.131 2.236 1.00 . A A . 38 ALA HA 1 1 1 568 1 1 38 ALA HB1 H 3.593 0.102 4.248 1.00 . A A . 38 ALA HB1 1 1 1 569 1 1 38 ALA HB2 H 5.344 -0.018 4.089 1.00 . A A . 38 ALA HB2 1 1 1 570 1 1 38 ALA HB3 H 4.490 -1.049 5.238 1.00 . A A . 38 ALA HB3 1 1 1 571 1 1 38 ALA N N 3.040 -2.362 3.402 1.00 . A A . 38 ALA N 1 1 1 572 1 1 38 ALA O O 6.311 -2.524 2.364 1.00 . A A . 38 ALA O 1 1 1 573 1 1 39 SER C C 6.444 -5.442 3.268 1.00 . A A . 39 SER C 1 1 1 574 1 1 39 SER CA C 6.495 -4.419 4.376 1.00 . A A . 39 SER CA 1 1 1 575 1 1 39 SER CB C 6.353 -5.105 5.730 1.00 . A A . 39 SER CB 1 1 1 576 1 1 39 SER H H 4.618 -3.553 4.747 1.00 . A A . 39 SER H 1 1 1 577 1 1 39 SER HA H 7.429 -3.883 4.334 1.00 . A A . 39 SER HA 1 1 1 578 1 1 39 SER HB2 H 5.413 -5.636 5.758 1.00 . A A . 39 SER HB2 1 1 1 579 1 1 39 SER HB3 H 7.167 -5.803 5.865 1.00 . A A . 39 SER HB3 1 1 1 580 1 1 39 SER HG H 7.120 -3.542 6.646 1.00 . A A . 39 SER HG 1 1 1 581 1 1 39 SER N N 5.414 -3.476 4.184 1.00 . A A . 39 SER N 1 1 1 582 1 1 39 SER O O 7.421 -6.133 2.977 1.00 . A A . 39 SER O 1 1 1 583 1 1 39 SER OG O 6.377 -4.158 6.787 1.00 . A A . 39 SER OG 1 1 1 584 1 1 40 LEU C C 5.618 -5.671 0.301 1.00 . A A . 40 LEU C 1 1 1 585 1 1 40 LEU CA C 5.078 -6.359 1.529 1.00 . A A . 40 LEU CA 1 1 1 586 1 1 40 LEU CB C 3.587 -6.614 1.376 1.00 . A A . 40 LEU CB 1 1 1 587 1 1 40 LEU CD1 C 3.996 -8.840 0.284 1.00 . A A . 40 LEU CD1 1 1 1 588 1 1 40 LEU CD2 C 3.303 -8.738 2.678 1.00 . A A . 40 LEU CD2 1 1 1 589 1 1 40 LEU CG C 3.168 -8.086 1.310 1.00 . A A . 40 LEU CG 1 1 1 590 1 1 40 LEU H H 4.531 -4.968 2.942 1.00 . A A . 40 LEU H 1 1 1 591 1 1 40 LEU HA H 5.601 -7.288 1.682 1.00 . A A . 40 LEU HA 1 1 1 592 1 1 40 LEU HB2 H 3.072 -6.148 2.199 1.00 . A A . 40 LEU HB2 1 1 1 593 1 1 40 LEU HB3 H 3.273 -6.118 0.494 1.00 . A A . 40 LEU HB3 1 1 1 594 1 1 40 LEU HD11 H 5.042 -8.763 0.541 1.00 . A A . 40 LEU HD11 1 1 1 595 1 1 40 LEU HD12 H 3.834 -8.414 -0.695 1.00 . A A . 40 LEU HD12 1 1 1 596 1 1 40 LEU HD13 H 3.703 -9.879 0.277 1.00 . A A . 40 LEU HD13 1 1 1 597 1 1 40 LEU HD21 H 3.007 -9.775 2.613 1.00 . A A . 40 LEU HD21 1 1 1 598 1 1 40 LEU HD22 H 2.668 -8.227 3.386 1.00 . A A . 40 LEU HD22 1 1 1 599 1 1 40 LEU HD23 H 4.330 -8.678 3.006 1.00 . A A . 40 LEU HD23 1 1 1 600 1 1 40 LEU HG H 2.132 -8.146 1.012 1.00 . A A . 40 LEU HG 1 1 1 601 1 1 40 LEU N N 5.282 -5.516 2.644 1.00 . A A . 40 LEU N 1 1 1 602 1 1 40 LEU O O 6.426 -6.237 -0.415 1.00 . A A . 40 LEU O 1 1 1 603 1 1 41 LEU C C 7.097 -3.566 -1.141 1.00 . A A . 41 LEU C 1 1 1 604 1 1 41 LEU CA C 5.592 -3.699 -1.093 1.00 . A A . 41 LEU CA 1 1 1 605 1 1 41 LEU CB C 4.817 -2.382 -1.188 1.00 . A A . 41 LEU CB 1 1 1 606 1 1 41 LEU CD1 C 6.565 -0.696 -0.803 1.00 . A A . 41 LEU CD1 1 1 1 607 1 1 41 LEU CD2 C 4.194 -0.171 -0.271 1.00 . A A . 41 LEU CD2 1 1 1 608 1 1 41 LEU CG C 5.266 -1.236 -0.308 1.00 . A A . 41 LEU CG 1 1 1 609 1 1 41 LEU H H 4.744 -3.902 0.823 1.00 . A A . 41 LEU H 1 1 1 610 1 1 41 LEU HA H 5.298 -4.307 -1.910 1.00 . A A . 41 LEU HA 1 1 1 611 1 1 41 LEU HB2 H 4.842 -2.046 -2.212 1.00 . A A . 41 LEU HB2 1 1 1 612 1 1 41 LEU HB3 H 3.791 -2.606 -0.930 1.00 . A A . 41 LEU HB3 1 1 1 613 1 1 41 LEU HD11 H 7.264 -1.518 -0.863 1.00 . A A . 41 LEU HD11 1 1 1 614 1 1 41 LEU HD12 H 6.932 0.048 -0.115 1.00 . A A . 41 LEU HD12 1 1 1 615 1 1 41 LEU HD13 H 6.432 -0.263 -1.781 1.00 . A A . 41 LEU HD13 1 1 1 616 1 1 41 LEU HD21 H 4.517 0.648 0.350 1.00 . A A . 41 LEU HD21 1 1 1 617 1 1 41 LEU HD22 H 3.292 -0.601 0.136 1.00 . A A . 41 LEU HD22 1 1 1 618 1 1 41 LEU HD23 H 4.007 0.182 -1.273 1.00 . A A . 41 LEU HD23 1 1 1 619 1 1 41 LEU HG H 5.422 -1.586 0.687 1.00 . A A . 41 LEU HG 1 1 1 620 1 1 41 LEU N N 5.240 -4.405 0.106 1.00 . A A . 41 LEU N 1 1 1 621 1 1 41 LEU O O 7.701 -3.478 -2.211 1.00 . A A . 41 LEU O 1 1 1 622 1 1 42 PHE C C 9.847 -4.465 -0.608 1.00 . A A . 42 PHE C 1 1 1 623 1 1 42 PHE CA C 9.100 -3.458 0.263 1.00 . A A . 42 PHE CA 1 1 1 624 1 1 42 PHE CB C 9.431 -3.724 1.723 1.00 . A A . 42 PHE CB 1 1 1 625 1 1 42 PHE CD1 C 8.954 -1.564 2.655 1.00 . A A . 42 PHE CD1 1 1 1 626 1 1 42 PHE CD2 C 11.212 -2.268 2.716 1.00 . A A . 42 PHE CD2 1 1 1 627 1 1 42 PHE CE1 C 9.287 -0.388 3.233 1.00 . A A . 42 PHE CE1 1 1 1 628 1 1 42 PHE CE2 C 11.573 -1.077 3.314 1.00 . A A . 42 PHE CE2 1 1 1 629 1 1 42 PHE CG C 9.886 -2.501 2.391 1.00 . A A . 42 PHE CG 1 1 1 630 1 1 42 PHE CZ C 10.601 -0.129 3.575 1.00 . A A . 42 PHE CZ 1 1 1 631 1 1 42 PHE H H 7.101 -3.613 0.842 1.00 . A A . 42 PHE H 1 1 1 632 1 1 42 PHE HA H 9.399 -2.433 0.037 1.00 . A A . 42 PHE HA 1 1 1 633 1 1 42 PHE HB2 H 8.539 -4.047 2.239 1.00 . A A . 42 PHE HB2 1 1 1 634 1 1 42 PHE HB3 H 10.193 -4.464 1.801 1.00 . A A . 42 PHE HB3 1 1 1 635 1 1 42 PHE HD1 H 7.921 -1.780 2.399 1.00 . A A . 42 PHE HD1 1 1 1 636 1 1 42 PHE HD2 H 11.956 -3.021 2.506 1.00 . A A . 42 PHE HD2 1 1 1 637 1 1 42 PHE HE1 H 8.525 0.320 3.413 1.00 . A A . 42 PHE HE1 1 1 1 638 1 1 42 PHE HE2 H 12.604 -0.888 3.574 1.00 . A A . 42 PHE HE2 1 1 1 639 1 1 42 PHE HZ H 10.868 0.812 4.036 1.00 . A A . 42 PHE HZ 1 1 1 640 1 1 42 PHE N N 7.674 -3.546 0.059 1.00 . A A . 42 PHE N 1 1 1 641 1 1 42 PHE O O 11.016 -4.263 -0.940 1.00 . A A . 42 PHE O 1 1 1 642 1 1 43 GLN C C 10.280 -6.148 -3.096 1.00 . A A . 43 GLN C 1 1 1 643 1 1 43 GLN CA C 9.798 -6.641 -1.733 1.00 . A A . 43 GLN CA 1 1 1 644 1 1 43 GLN CB C 8.864 -7.857 -1.900 1.00 . A A . 43 GLN CB 1 1 1 645 1 1 43 GLN CD C 6.808 -7.449 -3.377 1.00 . A A . 43 GLN CD 1 1 1 646 1 1 43 GLN CG C 8.227 -7.984 -3.287 1.00 . A A . 43 GLN CG 1 1 1 647 1 1 43 GLN H H 8.195 -5.646 -0.714 1.00 . A A . 43 GLN H 1 1 1 648 1 1 43 GLN HA H 10.660 -6.944 -1.177 1.00 . A A . 43 GLN HA 1 1 1 649 1 1 43 GLN HB2 H 9.434 -8.754 -1.710 1.00 . A A . 43 GLN HB2 1 1 1 650 1 1 43 GLN HB3 H 8.078 -7.784 -1.167 1.00 . A A . 43 GLN HB3 1 1 1 651 1 1 43 GLN HE21 H 6.310 -8.348 -1.678 1.00 . A A . 43 GLN HE21 1 1 1 652 1 1 43 GLN HE22 H 5.076 -7.397 -2.418 1.00 . A A . 43 GLN HE22 1 1 1 653 1 1 43 GLN HG2 H 8.835 -7.441 -3.993 1.00 . A A . 43 GLN HG2 1 1 1 654 1 1 43 GLN HG3 H 8.216 -9.030 -3.564 1.00 . A A . 43 GLN HG3 1 1 1 655 1 1 43 GLN N N 9.160 -5.564 -0.972 1.00 . A A . 43 GLN N 1 1 1 656 1 1 43 GLN NE2 N 5.977 -7.772 -2.401 1.00 . A A . 43 GLN NE2 1 1 1 657 1 1 43 GLN O O 11.230 -6.683 -3.665 1.00 . A A . 43 GLN O 1 1 1 658 1 1 43 GLN OE1 O 6.439 -6.819 -4.366 1.00 . A A . 43 GLN OE1 1 1 1 659 1 1 44 SER C C 10.449 -3.115 -4.725 1.00 . A A . 44 SER C 1 1 1 660 1 1 44 SER CA C 9.976 -4.553 -4.888 1.00 . A A . 44 SER CA 1 1 1 661 1 1 44 SER CB C 8.777 -4.621 -5.840 1.00 . A A . 44 SER CB 1 1 1 662 1 1 44 SER H H 8.916 -4.715 -3.064 1.00 . A A . 44 SER H 1 1 1 663 1 1 44 SER HA H 10.784 -5.139 -5.300 1.00 . A A . 44 SER HA 1 1 1 664 1 1 44 SER HB2 H 7.945 -4.083 -5.409 1.00 . A A . 44 SER HB2 1 1 1 665 1 1 44 SER HB3 H 9.043 -4.170 -6.784 1.00 . A A . 44 SER HB3 1 1 1 666 1 1 44 SER HG H 7.831 -6.267 -5.333 1.00 . A A . 44 SER HG 1 1 1 667 1 1 44 SER N N 9.632 -5.121 -3.594 1.00 . A A . 44 SER N 1 1 1 668 1 1 44 SER O O 9.598 -2.206 -4.685 1.00 . A A . 44 SER O 1 1 1 669 1 1 44 SER OXT O 11.678 -2.898 -4.630 1.00 . A A . 44 SER OXT 1 1 1 670 1 1 44 SER OG O 8.380 -5.966 -6.071 1.00 . A A . 44 SER OG 1 1 2 671 1 1 1 GLY C C -12.074 4.849 -1.908 1.00 . A A . 1 GLY C 1 1 2 672 1 1 1 GLY CA C -12.463 6.312 -1.782 1.00 . A A . 1 GLY CA 1 1 2 673 1 1 1 GLY H1 H -10.614 7.041 -1.119 1.00 . A A . 1 GLY H1 1 1 2 674 1 1 1 GLY H2 H -11.675 6.592 0.127 1.00 . A A . 1 GLY H2 1 1 2 675 1 1 1 GLY H3 H -11.934 8.031 -0.723 1.00 . A A . 1 GLY H3 1 1 2 676 1 1 1 GLY HA2 H -13.491 6.373 -1.460 1.00 . A A . 1 GLY HA2 1 1 2 677 1 1 1 GLY HA3 H -12.370 6.784 -2.750 1.00 . A A . 1 GLY HA3 1 1 2 678 1 1 1 GLY N N -11.613 7.044 -0.809 1.00 . A A . 1 GLY N 1 1 2 679 1 1 1 GLY O O -12.104 4.286 -3.006 1.00 . A A . 1 GLY O 1 1 2 680 1 1 2 SER C C -11.081 2.381 0.672 1.00 . A A . 2 SER C 1 1 2 681 1 1 2 SER CA C -11.302 2.832 -0.766 1.00 . A A . 2 SER CA 1 1 2 682 1 1 2 SER CB C -10.009 2.651 -1.575 1.00 . A A . 2 SER CB 1 1 2 683 1 1 2 SER H H -11.761 4.720 0.069 1.00 . A A . 2 SER H 1 1 2 684 1 1 2 SER HA H -12.087 2.236 -1.207 1.00 . A A . 2 SER HA 1 1 2 685 1 1 2 SER HB2 H -10.173 2.984 -2.588 1.00 . A A . 2 SER HB2 1 1 2 686 1 1 2 SER HB3 H -9.223 3.242 -1.126 1.00 . A A . 2 SER HB3 1 1 2 687 1 1 2 SER HG H -10.356 0.725 -1.809 1.00 . A A . 2 SER HG 1 1 2 688 1 1 2 SER N N -11.724 4.227 -0.784 1.00 . A A . 2 SER N 1 1 2 689 1 1 2 SER O O -10.844 3.201 1.561 1.00 . A A . 2 SER O 1 1 2 690 1 1 2 SER OG O -9.597 1.291 -1.603 1.00 . A A . 2 SER OG 1 1 2 691 1 1 3 ALA C C -9.591 -0.252 2.186 1.00 . A A . 3 ALA C 1 1 2 692 1 1 3 ALA CA C -10.912 0.506 2.205 1.00 . A A . 3 ALA CA 1 1 2 693 1 1 3 ALA CB C -12.050 -0.413 2.626 1.00 . A A . 3 ALA CB 1 1 2 694 1 1 3 ALA H H -11.437 0.485 0.153 1.00 . A A . 3 ALA H 1 1 2 695 1 1 3 ALA HA H -10.847 1.314 2.918 1.00 . A A . 3 ALA HA 1 1 2 696 1 1 3 ALA HB1 H -12.159 -1.209 1.903 1.00 . A A . 3 ALA HB1 1 1 2 697 1 1 3 ALA HB2 H -12.968 0.152 2.680 1.00 . A A . 3 ALA HB2 1 1 2 698 1 1 3 ALA HB3 H -11.831 -0.838 3.595 1.00 . A A . 3 ALA HB3 1 1 2 699 1 1 3 ALA N N -11.178 1.080 0.896 1.00 . A A . 3 ALA N 1 1 2 700 1 1 3 ALA O O -8.945 -0.432 3.218 1.00 . A A . 3 ALA O 1 1 2 701 1 1 4 THR C C -6.798 -0.537 0.531 1.00 . A A . 4 THR C 1 1 2 702 1 1 4 THR CA C -7.968 -1.436 0.816 1.00 . A A . 4 THR CA 1 1 2 703 1 1 4 THR CB C -8.135 -2.465 -0.309 1.00 . A A . 4 THR CB 1 1 2 704 1 1 4 THR CG2 C -8.680 -3.779 0.226 1.00 . A A . 4 THR CG2 1 1 2 705 1 1 4 THR H H -9.758 -0.507 0.217 1.00 . A A . 4 THR H 1 1 2 706 1 1 4 THR HA H -7.763 -1.937 1.690 1.00 . A A . 4 THR HA 1 1 2 707 1 1 4 THR HB H -7.169 -2.646 -0.757 1.00 . A A . 4 THR HB 1 1 2 708 1 1 4 THR HG1 H -9.271 -2.642 -1.923 1.00 . A A . 4 THR HG1 1 1 2 709 1 1 4 THR HG21 H -9.642 -3.608 0.688 1.00 . A A . 4 THR HG21 1 1 2 710 1 1 4 THR HG22 H -7.996 -4.181 0.959 1.00 . A A . 4 THR HG22 1 1 2 711 1 1 4 THR HG23 H -8.791 -4.484 -0.586 1.00 . A A . 4 THR HG23 1 1 2 712 1 1 4 THR N N -9.200 -0.690 0.999 1.00 . A A . 4 THR N 1 1 2 713 1 1 4 THR O O -5.750 -0.596 1.161 1.00 . A A . 4 THR O 1 1 2 714 1 1 4 THR OG1 O -9.024 -1.939 -1.306 1.00 . A A . 4 THR OG1 1 1 2 715 1 1 5 PHE C C -6.475 2.719 -0.869 1.00 . A A . 5 PHE C 1 1 2 716 1 1 5 PHE CA C -6.058 1.221 -0.969 1.00 . A A . 5 PHE CA 1 1 2 717 1 1 5 PHE CB C -6.067 0.904 -2.417 1.00 . A A . 5 PHE CB 1 1 2 718 1 1 5 PHE CD1 C -5.271 -1.340 -2.012 1.00 . A A . 5 PHE CD1 1 1 2 719 1 1 5 PHE CD2 C -6.995 -1.123 -3.591 1.00 . A A . 5 PHE CD2 1 1 2 720 1 1 5 PHE CE1 C -5.281 -2.643 -2.157 1.00 . A A . 5 PHE CE1 1 1 2 721 1 1 5 PHE CE2 C -6.995 -2.500 -3.752 1.00 . A A . 5 PHE CE2 1 1 2 722 1 1 5 PHE CG C -6.105 -0.545 -2.697 1.00 . A A . 5 PHE CG 1 1 2 723 1 1 5 PHE CZ C -6.112 -3.251 -2.999 1.00 . A A . 5 PHE CZ 1 1 2 724 1 1 5 PHE H H -7.917 0.282 -0.758 1.00 . A A . 5 PHE H 1 1 2 725 1 1 5 PHE HA H -5.083 1.027 -0.554 1.00 . A A . 5 PHE HA 1 1 2 726 1 1 5 PHE HB2 H -6.964 1.319 -2.757 1.00 . A A . 5 PHE HB2 1 1 2 727 1 1 5 PHE HB3 H -5.213 1.335 -2.909 1.00 . A A . 5 PHE HB3 1 1 2 728 1 1 5 PHE HD1 H -4.590 -0.923 -1.314 1.00 . A A . 5 PHE HD1 1 1 2 729 1 1 5 PHE HD2 H -7.670 -0.504 -4.163 1.00 . A A . 5 PHE HD2 1 1 2 730 1 1 5 PHE HE1 H -4.609 -3.196 -1.591 1.00 . A A . 5 PHE HE1 1 1 2 731 1 1 5 PHE HE2 H -7.677 -2.977 -4.441 1.00 . A A . 5 PHE HE2 1 1 2 732 1 1 5 PHE HZ H -6.077 -4.307 -3.043 1.00 . A A . 5 PHE HZ 1 1 2 733 1 1 5 PHE N N -7.042 0.301 -0.408 1.00 . A A . 5 PHE N 1 1 2 734 1 1 5 PHE O O -6.381 3.460 -1.849 1.00 . A A . 5 PHE O 1 1 2 735 1 1 6 PRO C C -6.199 5.518 0.621 1.00 . A A . 6 PRO C 1 1 2 736 1 1 6 PRO CA C -7.357 4.537 0.566 1.00 . A A . 6 PRO CA 1 1 2 737 1 1 6 PRO CB C -8.023 4.437 1.925 1.00 . A A . 6 PRO CB 1 1 2 738 1 1 6 PRO CD C -7.257 2.307 1.383 1.00 . A A . 6 PRO CD 1 1 2 739 1 1 6 PRO CG C -7.471 3.240 2.518 1.00 . A A . 6 PRO CG 1 1 2 740 1 1 6 PRO HA H -8.077 4.873 -0.134 1.00 . A A . 6 PRO HA 1 1 2 741 1 1 6 PRO HB2 H -7.816 5.314 2.516 1.00 . A A . 6 PRO HB2 1 1 2 742 1 1 6 PRO HB3 H -9.063 4.316 1.794 1.00 . A A . 6 PRO HB3 1 1 2 743 1 1 6 PRO HD2 H -6.444 1.663 1.552 1.00 . A A . 6 PRO HD2 1 1 2 744 1 1 6 PRO HD3 H -8.139 1.730 1.142 1.00 . A A . 6 PRO HD3 1 1 2 745 1 1 6 PRO HG2 H -6.554 3.473 3.003 1.00 . A A . 6 PRO HG2 1 1 2 746 1 1 6 PRO HG3 H -8.184 2.839 3.197 1.00 . A A . 6 PRO HG3 1 1 2 747 1 1 6 PRO N N -6.955 3.161 0.290 1.00 . A A . 6 PRO N 1 1 2 748 1 1 6 PRO O O -5.077 5.171 0.979 1.00 . A A . 6 PRO O 1 1 2 749 1 1 7 GLU C C -4.647 7.998 1.330 1.00 . A A . 7 GLU C 1 1 2 750 1 1 7 GLU CA C -5.574 7.845 0.128 1.00 . A A . 7 GLU CA 1 1 2 751 1 1 7 GLU CB C -6.328 9.148 -0.121 1.00 . A A . 7 GLU CB 1 1 2 752 1 1 7 GLU CD C -8.697 8.672 -0.900 1.00 . A A . 7 GLU CD 1 1 2 753 1 1 7 GLU CG C -7.290 9.086 -1.296 1.00 . A A . 7 GLU CG 1 1 2 754 1 1 7 GLU H H -7.470 6.951 0.101 1.00 . A A . 7 GLU H 1 1 2 755 1 1 7 GLU HA H -4.971 7.629 -0.739 1.00 . A A . 7 GLU HA 1 1 2 756 1 1 7 GLU HB2 H -6.895 9.393 0.758 1.00 . A A . 7 GLU HB2 1 1 2 757 1 1 7 GLU HB3 H -5.615 9.929 -0.308 1.00 . A A . 7 GLU HB3 1 1 2 758 1 1 7 GLU HG2 H -7.335 10.060 -1.757 1.00 . A A . 7 GLU HG2 1 1 2 759 1 1 7 GLU HG3 H -6.909 8.372 -2.004 1.00 . A A . 7 GLU HG3 1 1 2 760 1 1 7 GLU N N -6.524 6.756 0.278 1.00 . A A . 7 GLU N 1 1 2 761 1 1 7 GLU O O -3.486 8.363 1.161 1.00 . A A . 7 GLU O 1 1 2 762 1 1 7 GLU OE1 O -8.921 7.480 -0.598 1.00 . A A . 7 GLU OE1 1 1 2 763 1 1 7 GLU OE2 O -9.590 9.545 -0.895 1.00 . A A . 7 GLU OE2 1 1 2 764 1 1 8 GLN C C -3.151 6.812 3.553 1.00 . A A . 8 GLN C 1 1 2 765 1 1 8 GLN CA C -4.318 7.757 3.734 1.00 . A A . 8 GLN CA 1 1 2 766 1 1 8 GLN CB C -5.102 7.298 4.959 1.00 . A A . 8 GLN CB 1 1 2 767 1 1 8 GLN CD C -7.060 8.000 6.371 1.00 . A A . 8 GLN CD 1 1 2 768 1 1 8 GLN CG C -6.536 7.757 4.968 1.00 . A A . 8 GLN CG 1 1 2 769 1 1 8 GLN H H -6.122 7.601 2.620 1.00 . A A . 8 GLN H 1 1 2 770 1 1 8 GLN HA H -3.949 8.759 3.892 1.00 . A A . 8 GLN HA 1 1 2 771 1 1 8 GLN HB2 H -5.092 6.220 4.997 1.00 . A A . 8 GLN HB2 1 1 2 772 1 1 8 GLN HB3 H -4.620 7.686 5.842 1.00 . A A . 8 GLN HB3 1 1 2 773 1 1 8 GLN HE21 H -5.912 6.539 7.086 1.00 . A A . 8 GLN HE21 1 1 2 774 1 1 8 GLN HE22 H -6.893 7.370 8.243 1.00 . A A . 8 GLN HE22 1 1 2 775 1 1 8 GLN HG2 H -6.598 8.659 4.399 1.00 . A A . 8 GLN HG2 1 1 2 776 1 1 8 GLN HG3 H -7.144 6.996 4.502 1.00 . A A . 8 GLN HG3 1 1 2 777 1 1 8 GLN N N -5.158 7.750 2.534 1.00 . A A . 8 GLN N 1 1 2 778 1 1 8 GLN NE2 N -6.577 7.227 7.330 1.00 . A A . 8 GLN NE2 1 1 2 779 1 1 8 GLN O O -1.985 7.207 3.598 1.00 . A A . 8 GLN O 1 1 2 780 1 1 8 GLN OE1 O -7.901 8.869 6.591 1.00 . A A . 8 GLN OE1 1 1 2 781 1 1 9 THR C C -1.726 4.729 1.897 1.00 . A A . 9 THR C 1 1 2 782 1 1 9 THR CA C -2.526 4.516 3.156 1.00 . A A . 9 THR CA 1 1 2 783 1 1 9 THR CB C -3.194 3.138 3.156 1.00 . A A . 9 THR CB 1 1 2 784 1 1 9 THR CG2 C -3.890 2.883 4.480 1.00 . A A . 9 THR CG2 1 1 2 785 1 1 9 THR H H -4.426 5.325 3.277 1.00 . A A . 9 THR H 1 1 2 786 1 1 9 THR HA H -1.865 4.568 3.979 1.00 . A A . 9 THR HA 1 1 2 787 1 1 9 THR HB H -2.437 2.409 3.025 1.00 . A A . 9 THR HB 1 1 2 788 1 1 9 THR HG1 H -4.225 3.863 1.632 1.00 . A A . 9 THR HG1 1 1 2 789 1 1 9 THR HG21 H -3.168 2.923 5.281 1.00 . A A . 9 THR HG21 1 1 2 790 1 1 9 THR HG22 H -4.357 1.910 4.462 1.00 . A A . 9 THR HG22 1 1 2 791 1 1 9 THR HG23 H -4.645 3.641 4.637 1.00 . A A . 9 THR HG23 1 1 2 792 1 1 9 THR N N -3.490 5.559 3.329 1.00 . A A . 9 THR N 1 1 2 793 1 1 9 THR O O -0.543 4.422 1.840 1.00 . A A . 9 THR O 1 1 2 794 1 1 9 THR OG1 O -4.145 3.021 2.095 1.00 . A A . 9 THR OG1 1 1 2 795 1 1 10 ILE C C -0.589 6.550 0.009 1.00 . A A . 10 ILE C 1 1 2 796 1 1 10 ILE CA C -1.762 5.675 -0.323 1.00 . A A . 10 ILE CA 1 1 2 797 1 1 10 ILE CB C -2.726 6.508 -1.205 1.00 . A A . 10 ILE CB 1 1 2 798 1 1 10 ILE CD1 C -3.485 4.776 -2.901 1.00 . A A . 10 ILE CD1 1 1 2 799 1 1 10 ILE CG1 C -3.876 5.670 -1.758 1.00 . A A . 10 ILE CG1 1 1 2 800 1 1 10 ILE CG2 C -1.972 7.164 -2.340 1.00 . A A . 10 ILE CG2 1 1 2 801 1 1 10 ILE H H -3.332 5.440 1.030 1.00 . A A . 10 ILE H 1 1 2 802 1 1 10 ILE HA H -1.440 4.804 -0.860 1.00 . A A . 10 ILE HA 1 1 2 803 1 1 10 ILE HB H -3.137 7.297 -0.589 1.00 . A A . 10 ILE HB 1 1 2 804 1 1 10 ILE HD11 H -4.358 4.255 -3.266 1.00 . A A . 10 ILE HD11 1 1 2 805 1 1 10 ILE HD12 H -2.757 4.058 -2.555 1.00 . A A . 10 ILE HD12 1 1 2 806 1 1 10 ILE HD13 H -3.060 5.370 -3.695 1.00 . A A . 10 ILE HD13 1 1 2 807 1 1 10 ILE HG12 H -4.265 5.047 -0.971 1.00 . A A . 10 ILE HG12 1 1 2 808 1 1 10 ILE HG13 H -4.659 6.331 -2.105 1.00 . A A . 10 ILE HG13 1 1 2 809 1 1 10 ILE HG21 H -1.520 6.401 -2.949 1.00 . A A . 10 ILE HG21 1 1 2 810 1 1 10 ILE HG22 H -1.208 7.804 -1.932 1.00 . A A . 10 ILE HG22 1 1 2 811 1 1 10 ILE HG23 H -2.656 7.747 -2.936 1.00 . A A . 10 ILE HG23 1 1 2 812 1 1 10 ILE N N -2.391 5.289 0.914 1.00 . A A . 10 ILE N 1 1 2 813 1 1 10 ILE O O 0.545 6.213 -0.236 1.00 . A A . 10 ILE O 1 1 2 814 1 1 11 LYS C C 1.155 8.120 1.943 1.00 . A A . 11 LYS C 1 1 2 815 1 1 11 LYS CA C 0.150 8.594 0.935 1.00 . A A . 11 LYS CA 1 1 2 816 1 1 11 LYS CB C -0.469 9.920 1.311 1.00 . A A . 11 LYS CB 1 1 2 817 1 1 11 LYS CD C -2.097 11.694 0.624 1.00 . A A . 11 LYS CD 1 1 2 818 1 1 11 LYS CE C -2.667 12.433 -0.572 1.00 . A A . 11 LYS CE 1 1 2 819 1 1 11 LYS CG C -1.317 10.475 0.189 1.00 . A A . 11 LYS CG 1 1 2 820 1 1 11 LYS H H -1.783 7.790 0.978 1.00 . A A . 11 LYS H 1 1 2 821 1 1 11 LYS HA H 0.683 8.711 0.016 1.00 . A A . 11 LYS HA 1 1 2 822 1 1 11 LYS HB2 H -1.088 9.783 2.178 1.00 . A A . 11 LYS HB2 1 1 2 823 1 1 11 LYS HB3 H 0.313 10.629 1.533 1.00 . A A . 11 LYS HB3 1 1 2 824 1 1 11 LYS HD2 H -2.909 11.382 1.263 1.00 . A A . 11 LYS HD2 1 1 2 825 1 1 11 LYS HD3 H -1.437 12.355 1.168 1.00 . A A . 11 LYS HD3 1 1 2 826 1 1 11 LYS HE2 H -3.351 11.779 -1.093 1.00 . A A . 11 LYS HE2 1 1 2 827 1 1 11 LYS HE3 H -3.198 13.306 -0.223 1.00 . A A . 11 LYS HE3 1 1 2 828 1 1 11 LYS HG2 H -0.670 10.750 -0.632 1.00 . A A . 11 LYS HG2 1 1 2 829 1 1 11 LYS HG3 H -2.007 9.701 -0.139 1.00 . A A . 11 LYS HG3 1 1 2 830 1 1 11 LYS HZ1 H -1.142 12.031 -1.951 1.00 . A A . 11 LYS HZ1 1 1 2 831 1 1 11 LYS HZ2 H -0.871 13.413 -1.007 1.00 . A A . 11 LYS HZ2 1 1 2 832 1 1 11 LYS HZ3 H -1.999 13.460 -2.268 1.00 . A A . 11 LYS HZ3 1 1 2 833 1 1 11 LYS N N -0.865 7.629 0.669 1.00 . A A . 11 LYS N 1 1 2 834 1 1 11 LYS NZ N -1.598 12.863 -1.513 1.00 . A A . 11 LYS NZ 1 1 2 835 1 1 11 LYS O O 2.289 8.538 1.882 1.00 . A A . 11 LYS O 1 1 2 836 1 1 12 GLN C C 2.679 5.810 3.141 1.00 . A A . 12 GLN C 1 1 2 837 1 1 12 GLN CA C 1.651 6.719 3.824 1.00 . A A . 12 GLN CA 1 1 2 838 1 1 12 GLN CB C 0.816 5.940 4.823 1.00 . A A . 12 GLN CB 1 1 2 839 1 1 12 GLN CD C 1.429 7.562 6.659 1.00 . A A . 12 GLN CD 1 1 2 840 1 1 12 GLN CG C 0.325 6.766 5.997 1.00 . A A . 12 GLN CG 1 1 2 841 1 1 12 GLN H H -0.191 7.006 2.929 1.00 . A A . 12 GLN H 1 1 2 842 1 1 12 GLN HA H 2.154 7.525 4.328 1.00 . A A . 12 GLN HA 1 1 2 843 1 1 12 GLN HB2 H -0.055 5.550 4.311 1.00 . A A . 12 GLN HB2 1 1 2 844 1 1 12 GLN HB3 H 1.387 5.132 5.179 1.00 . A A . 12 GLN HB3 1 1 2 845 1 1 12 GLN HE21 H 1.060 9.104 5.461 1.00 . A A . 12 GLN HE21 1 1 2 846 1 1 12 GLN HE22 H 2.332 9.330 6.609 1.00 . A A . 12 GLN HE22 1 1 2 847 1 1 12 GLN HG2 H -0.431 7.452 5.644 1.00 . A A . 12 GLN HG2 1 1 2 848 1 1 12 GLN HG3 H -0.107 6.100 6.725 1.00 . A A . 12 GLN HG3 1 1 2 849 1 1 12 GLN N N 0.748 7.276 2.873 1.00 . A A . 12 GLN N 1 1 2 850 1 1 12 GLN NE2 N 1.628 8.786 6.197 1.00 . A A . 12 GLN NE2 1 1 2 851 1 1 12 GLN O O 3.883 5.848 3.419 1.00 . A A . 12 GLN O 1 1 2 852 1 1 12 GLN OE1 O 2.101 7.083 7.574 1.00 . A A . 12 GLN OE1 1 1 2 853 1 1 13 LEU C C 3.728 4.530 0.407 1.00 . A A . 13 LEU C 1 1 2 854 1 1 13 LEU CA C 3.005 4.002 1.613 1.00 . A A . 13 LEU CA 1 1 2 855 1 1 13 LEU CB C 2.122 2.832 1.265 1.00 . A A . 13 LEU CB 1 1 2 856 1 1 13 LEU CD1 C 0.446 1.160 2.074 1.00 . A A . 13 LEU CD1 1 1 2 857 1 1 13 LEU CD2 C 2.265 1.939 3.596 1.00 . A A . 13 LEU CD2 1 1 2 858 1 1 13 LEU CG C 1.338 2.325 2.456 1.00 . A A . 13 LEU CG 1 1 2 859 1 1 13 LEU H H 1.311 5.194 1.860 1.00 . A A . 13 LEU H 1 1 2 860 1 1 13 LEU HA H 3.719 3.686 2.352 1.00 . A A . 13 LEU HA 1 1 2 861 1 1 13 LEU HB2 H 1.431 3.132 0.490 1.00 . A A . 13 LEU HB2 1 1 2 862 1 1 13 LEU HB3 H 2.733 2.043 0.898 1.00 . A A . 13 LEU HB3 1 1 2 863 1 1 13 LEU HD11 H -0.106 0.830 2.940 1.00 . A A . 13 LEU HD11 1 1 2 864 1 1 13 LEU HD12 H 1.054 0.347 1.703 1.00 . A A . 13 LEU HD12 1 1 2 865 1 1 13 LEU HD13 H -0.244 1.473 1.305 1.00 . A A . 13 LEU HD13 1 1 2 866 1 1 13 LEU HD21 H 1.682 1.565 4.424 1.00 . A A . 13 LEU HD21 1 1 2 867 1 1 13 LEU HD22 H 2.826 2.805 3.912 1.00 . A A . 13 LEU HD22 1 1 2 868 1 1 13 LEU HD23 H 2.947 1.171 3.260 1.00 . A A . 13 LEU HD23 1 1 2 869 1 1 13 LEU HG H 0.718 3.136 2.796 1.00 . A A . 13 LEU HG 1 1 2 870 1 1 13 LEU N N 2.208 5.040 2.197 1.00 . A A . 13 LEU N 1 1 2 871 1 1 13 LEU O O 4.838 4.121 0.101 1.00 . A A . 13 LEU O 1 1 2 872 1 1 14 MET C C 4.761 7.130 -0.678 1.00 . A A . 14 MET C 1 1 2 873 1 1 14 MET CA C 3.743 6.192 -1.310 1.00 . A A . 14 MET CA 1 1 2 874 1 1 14 MET CB C 2.689 6.939 -2.061 1.00 . A A . 14 MET CB 1 1 2 875 1 1 14 MET CE C 2.443 3.408 -2.320 1.00 . A A . 14 MET CE 1 1 2 876 1 1 14 MET CG C 1.899 6.077 -3.019 1.00 . A A . 14 MET CG 1 1 2 877 1 1 14 MET H H 2.090 5.557 -0.207 1.00 . A A . 14 MET H 1 1 2 878 1 1 14 MET HA H 4.240 5.512 -1.982 1.00 . A A . 14 MET HA 1 1 2 879 1 1 14 MET HB2 H 1.995 7.364 -1.356 1.00 . A A . 14 MET HB2 1 1 2 880 1 1 14 MET HB3 H 3.163 7.727 -2.621 1.00 . A A . 14 MET HB3 1 1 2 881 1 1 14 MET HE1 H 3.245 3.798 -1.709 1.00 . A A . 14 MET HE1 1 1 2 882 1 1 14 MET HE2 H 2.803 3.249 -3.325 1.00 . A A . 14 MET HE2 1 1 2 883 1 1 14 MET HE3 H 2.094 2.474 -1.906 1.00 . A A . 14 MET HE3 1 1 2 884 1 1 14 MET HG2 H 1.134 6.681 -3.407 1.00 . A A . 14 MET HG2 1 1 2 885 1 1 14 MET HG3 H 2.560 5.785 -3.797 1.00 . A A . 14 MET HG3 1 1 2 886 1 1 14 MET N N 3.083 5.434 -0.304 1.00 . A A . 14 MET N 1 1 2 887 1 1 14 MET O O 5.728 7.548 -1.310 1.00 . A A . 14 MET O 1 1 2 888 1 1 14 MET SD S 1.104 4.590 -2.350 1.00 . A A . 14 MET SD 1 1 2 889 1 1 15 ASP C C 6.771 7.484 1.542 1.00 . A A . 15 ASP C 1 1 2 890 1 1 15 ASP CA C 5.449 8.219 1.401 1.00 . A A . 15 ASP CA 1 1 2 891 1 1 15 ASP CB C 4.854 8.485 2.782 1.00 . A A . 15 ASP CB 1 1 2 892 1 1 15 ASP CG C 5.816 9.180 3.727 1.00 . A A . 15 ASP CG 1 1 2 893 1 1 15 ASP H H 3.663 7.161 0.976 1.00 . A A . 15 ASP H 1 1 2 894 1 1 15 ASP HA H 5.625 9.162 0.905 1.00 . A A . 15 ASP HA 1 1 2 895 1 1 15 ASP HB2 H 3.985 9.115 2.661 1.00 . A A . 15 ASP HB2 1 1 2 896 1 1 15 ASP HB3 H 4.542 7.541 3.218 1.00 . A A . 15 ASP HB3 1 1 2 897 1 1 15 ASP N N 4.515 7.447 0.584 1.00 . A A . 15 ASP N 1 1 2 898 1 1 15 ASP O O 7.829 8.109 1.594 1.00 . A A . 15 ASP O 1 1 2 899 1 1 15 ASP OD1 O 5.920 10.425 3.665 1.00 . A A . 15 ASP OD1 1 1 2 900 1 1 15 ASP OD2 O 6.460 8.494 4.546 1.00 . A A . 15 ASP OD2 1 1 2 901 1 1 16 LEU C C 8.755 5.600 0.352 1.00 . A A . 16 LEU C 1 1 2 902 1 1 16 LEU CA C 7.874 5.331 1.576 1.00 . A A . 16 LEU CA 1 1 2 903 1 1 16 LEU CB C 7.313 3.950 1.528 1.00 . A A . 16 LEU CB 1 1 2 904 1 1 16 LEU CD1 C 6.414 4.245 3.858 1.00 . A A . 16 LEU CD1 1 1 2 905 1 1 16 LEU CD2 C 6.128 2.087 2.653 1.00 . A A . 16 LEU CD2 1 1 2 906 1 1 16 LEU CG C 7.031 3.288 2.853 1.00 . A A . 16 LEU CG 1 1 2 907 1 1 16 LEU H H 5.851 5.659 1.652 1.00 . A A . 16 LEU H 1 1 2 908 1 1 16 LEU HA H 8.429 5.471 2.486 1.00 . A A . 16 LEU HA 1 1 2 909 1 1 16 LEU HB2 H 6.382 3.994 0.985 1.00 . A A . 16 LEU HB2 1 1 2 910 1 1 16 LEU HB3 H 7.981 3.346 0.980 1.00 . A A . 16 LEU HB3 1 1 2 911 1 1 16 LEU HD11 H 7.106 5.048 4.061 1.00 . A A . 16 LEU HD11 1 1 2 912 1 1 16 LEU HD12 H 6.193 3.715 4.774 1.00 . A A . 16 LEU HD12 1 1 2 913 1 1 16 LEU HD13 H 5.503 4.653 3.448 1.00 . A A . 16 LEU HD13 1 1 2 914 1 1 16 LEU HD21 H 5.913 1.632 3.607 1.00 . A A . 16 LEU HD21 1 1 2 915 1 1 16 LEU HD22 H 6.618 1.370 2.011 1.00 . A A . 16 LEU HD22 1 1 2 916 1 1 16 LEU HD23 H 5.206 2.412 2.191 1.00 . A A . 16 LEU HD23 1 1 2 917 1 1 16 LEU HG H 7.945 2.956 3.231 1.00 . A A . 16 LEU HG 1 1 2 918 1 1 16 LEU N N 6.716 6.149 1.589 1.00 . A A . 16 LEU N 1 1 2 919 1 1 16 LEU O O 9.941 5.271 0.332 1.00 . A A . 16 LEU O 1 1 2 920 1 1 17 GLY C C 8.221 5.659 -3.024 1.00 . A A . 17 GLY C 1 1 2 921 1 1 17 GLY CA C 8.833 6.468 -1.908 1.00 . A A . 17 GLY CA 1 1 2 922 1 1 17 GLY H H 7.217 6.472 -0.546 1.00 . A A . 17 GLY H 1 1 2 923 1 1 17 GLY HA2 H 8.749 7.521 -2.140 1.00 . A A . 17 GLY HA2 1 1 2 924 1 1 17 GLY HA3 H 9.876 6.206 -1.810 1.00 . A A . 17 GLY HA3 1 1 2 925 1 1 17 GLY N N 8.152 6.201 -0.656 1.00 . A A . 17 GLY N 1 1 2 926 1 1 17 GLY O O 8.658 5.708 -4.172 1.00 . A A . 17 GLY O 1 1 2 927 1 1 18 PHE C C 5.421 4.643 -4.356 1.00 . A A . 18 PHE C 1 1 2 928 1 1 18 PHE CA C 6.531 3.983 -3.547 1.00 . A A . 18 PHE CA 1 1 2 929 1 1 18 PHE CB C 6.008 2.864 -2.673 1.00 . A A . 18 PHE CB 1 1 2 930 1 1 18 PHE CD1 C 8.176 1.670 -2.824 1.00 . A A . 18 PHE CD1 1 1 2 931 1 1 18 PHE CD2 C 7.135 1.979 -0.735 1.00 . A A . 18 PHE CD2 1 1 2 932 1 1 18 PHE CE1 C 9.221 1.026 -2.209 1.00 . A A . 18 PHE CE1 1 1 2 933 1 1 18 PHE CE2 C 8.145 1.365 -0.128 1.00 . A A . 18 PHE CE2 1 1 2 934 1 1 18 PHE CG C 7.121 2.145 -2.065 1.00 . A A . 18 PHE CG 1 1 2 935 1 1 18 PHE CZ C 9.193 0.884 -0.842 1.00 . A A . 18 PHE CZ 1 1 2 936 1 1 18 PHE H H 6.865 4.991 -1.738 1.00 . A A . 18 PHE H 1 1 2 937 1 1 18 PHE HA H 7.274 3.577 -4.211 1.00 . A A . 18 PHE HA 1 1 2 938 1 1 18 PHE HB2 H 5.410 3.280 -1.878 1.00 . A A . 18 PHE HB2 1 1 2 939 1 1 18 PHE HB3 H 5.433 2.162 -3.213 1.00 . A A . 18 PHE HB3 1 1 2 940 1 1 18 PHE HD1 H 8.169 1.799 -3.896 1.00 . A A . 18 PHE HD1 1 1 2 941 1 1 18 PHE HD2 H 6.325 2.343 -0.148 1.00 . A A . 18 PHE HD2 1 1 2 942 1 1 18 PHE HE1 H 10.050 0.644 -2.786 1.00 . A A . 18 PHE HE1 1 1 2 943 1 1 18 PHE HE2 H 8.107 1.261 0.913 1.00 . A A . 18 PHE HE2 1 1 2 944 1 1 18 PHE HZ H 9.978 0.411 -0.333 1.00 . A A . 18 PHE HZ 1 1 2 945 1 1 18 PHE N N 7.189 4.921 -2.661 1.00 . A A . 18 PHE N 1 1 2 946 1 1 18 PHE O O 4.881 5.674 -3.962 1.00 . A A . 18 PHE O 1 1 2 947 1 1 19 PRO C C 2.660 4.072 -5.894 1.00 . A A . 19 PRO C 1 1 2 948 1 1 19 PRO CA C 4.010 4.563 -6.370 1.00 . A A . 19 PRO CA 1 1 2 949 1 1 19 PRO CB C 4.331 3.933 -7.701 1.00 . A A . 19 PRO CB 1 1 2 950 1 1 19 PRO CD C 5.752 2.914 -6.148 1.00 . A A . 19 PRO CD 1 1 2 951 1 1 19 PRO CG C 4.841 2.624 -7.313 1.00 . A A . 19 PRO CG 1 1 2 952 1 1 19 PRO HA H 4.007 5.639 -6.459 1.00 . A A . 19 PRO HA 1 1 2 953 1 1 19 PRO HB2 H 3.447 3.861 -8.307 1.00 . A A . 19 PRO HB2 1 1 2 954 1 1 19 PRO HB3 H 5.090 4.495 -8.202 1.00 . A A . 19 PRO HB3 1 1 2 955 1 1 19 PRO HD2 H 5.777 2.084 -5.463 1.00 . A A . 19 PRO HD2 1 1 2 956 1 1 19 PRO HD3 H 6.742 3.161 -6.492 1.00 . A A . 19 PRO HD3 1 1 2 957 1 1 19 PRO HG2 H 4.027 1.973 -7.022 1.00 . A A . 19 PRO HG2 1 1 2 958 1 1 19 PRO HG3 H 5.377 2.223 -8.130 1.00 . A A . 19 PRO HG3 1 1 2 959 1 1 19 PRO N N 5.101 4.085 -5.528 1.00 . A A . 19 PRO N 1 1 2 960 1 1 19 PRO O O 2.572 3.132 -5.123 1.00 . A A . 19 PRO O 1 1 2 961 1 1 20 ARG C C -0.006 2.857 -6.338 1.00 . A A . 20 ARG C 1 1 2 962 1 1 20 ARG CA C 0.256 4.325 -6.059 1.00 . A A . 20 ARG CA 1 1 2 963 1 1 20 ARG CB C -0.691 5.178 -6.881 1.00 . A A . 20 ARG CB 1 1 2 964 1 1 20 ARG CD C -3.020 5.639 -7.602 1.00 . A A . 20 ARG CD 1 1 2 965 1 1 20 ARG CG C -2.115 4.704 -6.838 1.00 . A A . 20 ARG CG 1 1 2 966 1 1 20 ARG CZ C -5.416 5.889 -8.108 1.00 . A A . 20 ARG CZ 1 1 2 967 1 1 20 ARG H H 1.784 5.339 -7.103 1.00 . A A . 20 ARG H 1 1 2 968 1 1 20 ARG HA H 0.108 4.524 -5.007 1.00 . A A . 20 ARG HA 1 1 2 969 1 1 20 ARG HB2 H -0.653 6.187 -6.518 1.00 . A A . 20 ARG HB2 1 1 2 970 1 1 20 ARG HB3 H -0.366 5.164 -7.907 1.00 . A A . 20 ARG HB3 1 1 2 971 1 1 20 ARG HD2 H -2.954 6.617 -7.157 1.00 . A A . 20 ARG HD2 1 1 2 972 1 1 20 ARG HD3 H -2.680 5.688 -8.627 1.00 . A A . 20 ARG HD3 1 1 2 973 1 1 20 ARG HE H -4.602 4.322 -7.166 1.00 . A A . 20 ARG HE 1 1 2 974 1 1 20 ARG HG2 H -2.164 3.721 -7.280 1.00 . A A . 20 ARG HG2 1 1 2 975 1 1 20 ARG HG3 H -2.427 4.658 -5.816 1.00 . A A . 20 ARG HG3 1 1 2 976 1 1 20 ARG HH11 H -4.256 7.451 -8.714 1.00 . A A . 20 ARG HH11 1 1 2 977 1 1 20 ARG HH12 H -5.951 7.584 -9.090 1.00 . A A . 20 ARG HH12 1 1 2 978 1 1 20 ARG HH21 H -6.811 4.507 -7.609 1.00 . A A . 20 ARG HH21 1 1 2 979 1 1 20 ARG HH22 H -7.422 5.904 -8.445 1.00 . A A . 20 ARG HH22 1 1 2 980 1 1 20 ARG N N 1.623 4.669 -6.416 1.00 . A A . 20 ARG N 1 1 2 981 1 1 20 ARG NE N -4.409 5.197 -7.584 1.00 . A A . 20 ARG NE 1 1 2 982 1 1 20 ARG NH1 N -5.192 7.069 -8.679 1.00 . A A . 20 ARG NH1 1 1 2 983 1 1 20 ARG NH2 N -6.647 5.397 -8.050 1.00 . A A . 20 ARG NH2 1 1 2 984 1 1 20 ARG O O -0.656 2.153 -5.563 1.00 . A A . 20 ARG O 1 1 2 985 1 1 21 ASP C C 1.002 0.092 -6.789 1.00 . A A . 21 ASP C 1 1 2 986 1 1 21 ASP CA C 0.473 1.026 -7.881 1.00 . A A . 21 ASP CA 1 1 2 987 1 1 21 ASP CB C 1.281 0.845 -9.168 1.00 . A A . 21 ASP CB 1 1 2 988 1 1 21 ASP CG C 1.315 -0.593 -9.645 1.00 . A A . 21 ASP CG 1 1 2 989 1 1 21 ASP H H 0.998 3.077 -8.025 1.00 . A A . 21 ASP H 1 1 2 990 1 1 21 ASP HA H -0.560 0.783 -8.076 1.00 . A A . 21 ASP HA 1 1 2 991 1 1 21 ASP HB2 H 0.842 1.450 -9.946 1.00 . A A . 21 ASP HB2 1 1 2 992 1 1 21 ASP HB3 H 2.295 1.171 -8.994 1.00 . A A . 21 ASP HB3 1 1 2 993 1 1 21 ASP N N 0.535 2.422 -7.455 1.00 . A A . 21 ASP N 1 1 2 994 1 1 21 ASP O O 0.570 -1.056 -6.674 1.00 . A A . 21 ASP O 1 1 2 995 1 1 21 ASP OD1 O 0.248 -1.139 -9.981 1.00 . A A . 21 ASP OD1 1 1 2 996 1 1 21 ASP OD2 O 2.415 -1.178 -9.702 1.00 . A A . 21 ASP OD2 1 1 2 997 1 1 22 ALA C C 1.527 -0.351 -3.734 1.00 . A A . 22 ALA C 1 1 2 998 1 1 22 ALA CA C 2.505 -0.177 -4.891 1.00 . A A . 22 ALA CA 1 1 2 999 1 1 22 ALA CB C 3.800 0.452 -4.404 1.00 . A A . 22 ALA CB 1 1 2 1000 1 1 22 ALA H H 2.191 1.539 -6.084 1.00 . A A . 22 ALA H 1 1 2 1001 1 1 22 ALA HA H 2.742 -1.154 -5.290 1.00 . A A . 22 ALA HA 1 1 2 1002 1 1 22 ALA HB1 H 4.480 0.566 -5.236 1.00 . A A . 22 ALA HB1 1 1 2 1003 1 1 22 ALA HB2 H 4.249 -0.183 -3.657 1.00 . A A . 22 ALA HB2 1 1 2 1004 1 1 22 ALA HB3 H 3.591 1.422 -3.975 1.00 . A A . 22 ALA HB3 1 1 2 1005 1 1 22 ALA N N 1.916 0.604 -5.968 1.00 . A A . 22 ALA N 1 1 2 1006 1 1 22 ALA O O 1.569 -1.370 -3.048 1.00 . A A . 22 ALA O 1 1 2 1007 1 1 23 VAL C C -1.284 -0.634 -2.908 1.00 . A A . 23 VAL C 1 1 2 1008 1 1 23 VAL CA C -0.371 0.487 -2.486 1.00 . A A . 23 VAL CA 1 1 2 1009 1 1 23 VAL CB C -1.170 1.802 -2.257 1.00 . A A . 23 VAL CB 1 1 2 1010 1 1 23 VAL CG1 C -2.534 1.756 -2.890 1.00 . A A . 23 VAL CG1 1 1 2 1011 1 1 23 VAL CG2 C -1.325 2.086 -0.788 1.00 . A A . 23 VAL CG2 1 1 2 1012 1 1 23 VAL H H 0.643 1.435 -4.064 1.00 . A A . 23 VAL H 1 1 2 1013 1 1 23 VAL HA H 0.102 0.215 -1.568 1.00 . A A . 23 VAL HA 1 1 2 1014 1 1 23 VAL HB H -0.621 2.611 -2.705 1.00 . A A . 23 VAL HB 1 1 2 1015 1 1 23 VAL HG11 H -3.072 0.907 -2.494 1.00 . A A . 23 VAL HG11 1 1 2 1016 1 1 23 VAL HG12 H -2.413 1.649 -3.954 1.00 . A A . 23 VAL HG12 1 1 2 1017 1 1 23 VAL HG13 H -3.076 2.666 -2.665 1.00 . A A . 23 VAL HG13 1 1 2 1018 1 1 23 VAL HG21 H -1.832 3.029 -0.661 1.00 . A A . 23 VAL HG21 1 1 2 1019 1 1 23 VAL HG22 H -0.349 2.132 -0.331 1.00 . A A . 23 VAL HG22 1 1 2 1020 1 1 23 VAL HG23 H -1.915 1.298 -0.336 1.00 . A A . 23 VAL HG23 1 1 2 1021 1 1 23 VAL N N 0.640 0.628 -3.512 1.00 . A A . 23 VAL N 1 1 2 1022 1 1 23 VAL O O -1.547 -1.567 -2.189 1.00 . A A . 23 VAL O 1 1 2 1023 1 1 24 VAL C C -2.039 -2.932 -4.649 1.00 . A A . 24 VAL C 1 1 2 1024 1 1 24 VAL CA C -2.623 -1.533 -4.628 1.00 . A A . 24 VAL CA 1 1 2 1025 1 1 24 VAL CB C -3.157 -1.106 -5.997 1.00 . A A . 24 VAL CB 1 1 2 1026 1 1 24 VAL CG1 C -3.819 -2.271 -6.713 1.00 . A A . 24 VAL CG1 1 1 2 1027 1 1 24 VAL CG2 C -4.140 0.036 -5.815 1.00 . A A . 24 VAL CG2 1 1 2 1028 1 1 24 VAL H H -1.417 0.188 -4.676 1.00 . A A . 24 VAL H 1 1 2 1029 1 1 24 VAL HA H -3.449 -1.552 -3.932 1.00 . A A . 24 VAL HA 1 1 2 1030 1 1 24 VAL HB H -2.320 -0.745 -6.586 1.00 . A A . 24 VAL HB 1 1 2 1031 1 1 24 VAL HG11 H -4.204 -1.940 -7.664 1.00 . A A . 24 VAL HG11 1 1 2 1032 1 1 24 VAL HG12 H -4.629 -2.649 -6.103 1.00 . A A . 24 VAL HG12 1 1 2 1033 1 1 24 VAL HG13 H -3.092 -3.055 -6.868 1.00 . A A . 24 VAL HG13 1 1 2 1034 1 1 24 VAL HG21 H -4.626 0.251 -6.754 1.00 . A A . 24 VAL HG21 1 1 2 1035 1 1 24 VAL HG22 H -3.613 0.913 -5.469 1.00 . A A . 24 VAL HG22 1 1 2 1036 1 1 24 VAL HG23 H -4.881 -0.249 -5.078 1.00 . A A . 24 VAL HG23 1 1 2 1037 1 1 24 VAL N N -1.699 -0.569 -4.125 1.00 . A A . 24 VAL N 1 1 2 1038 1 1 24 VAL O O -2.660 -3.835 -4.124 1.00 . A A . 24 VAL O 1 1 2 1039 1 1 25 LYS C C -0.124 -4.979 -3.773 1.00 . A A . 25 LYS C 1 1 2 1040 1 1 25 LYS CA C -0.234 -4.442 -5.191 1.00 . A A . 25 LYS CA 1 1 2 1041 1 1 25 LYS CB C 1.157 -4.388 -5.810 1.00 . A A . 25 LYS CB 1 1 2 1042 1 1 25 LYS CD C 2.543 -4.107 -7.858 1.00 . A A . 25 LYS CD 1 1 2 1043 1 1 25 LYS CE C 2.681 -4.475 -9.328 1.00 . A A . 25 LYS CE 1 1 2 1044 1 1 25 LYS CG C 1.161 -4.421 -7.321 1.00 . A A . 25 LYS CG 1 1 2 1045 1 1 25 LYS H H -0.342 -2.353 -5.555 1.00 . A A . 25 LYS H 1 1 2 1046 1 1 25 LYS HA H -0.860 -5.100 -5.773 1.00 . A A . 25 LYS HA 1 1 2 1047 1 1 25 LYS HB2 H 1.644 -3.478 -5.492 1.00 . A A . 25 LYS HB2 1 1 2 1048 1 1 25 LYS HB3 H 1.728 -5.233 -5.452 1.00 . A A . 25 LYS HB3 1 1 2 1049 1 1 25 LYS HD2 H 2.718 -3.047 -7.742 1.00 . A A . 25 LYS HD2 1 1 2 1050 1 1 25 LYS HD3 H 3.275 -4.659 -7.286 1.00 . A A . 25 LYS HD3 1 1 2 1051 1 1 25 LYS HE2 H 3.692 -4.261 -9.644 1.00 . A A . 25 LYS HE2 1 1 2 1052 1 1 25 LYS HE3 H 2.487 -5.531 -9.441 1.00 . A A . 25 LYS HE3 1 1 2 1053 1 1 25 LYS HG2 H 0.867 -5.406 -7.653 1.00 . A A . 25 LYS HG2 1 1 2 1054 1 1 25 LYS HG3 H 0.461 -3.686 -7.691 1.00 . A A . 25 LYS HG3 1 1 2 1055 1 1 25 LYS HZ1 H 1.919 -2.687 -10.096 1.00 . A A . 25 LYS HZ1 1 1 2 1056 1 1 25 LYS HZ2 H 0.756 -3.911 -9.916 1.00 . A A . 25 LYS HZ2 1 1 2 1057 1 1 25 LYS HZ3 H 1.875 -3.985 -11.190 1.00 . A A . 25 LYS HZ3 1 1 2 1058 1 1 25 LYS N N -0.841 -3.115 -5.185 1.00 . A A . 25 LYS N 1 1 2 1059 1 1 25 LYS NZ N 1.742 -3.715 -10.191 1.00 . A A . 25 LYS NZ 1 1 2 1060 1 1 25 LYS O O -0.440 -6.143 -3.490 1.00 . A A . 25 LYS O 1 1 2 1061 1 1 26 ALA C C -0.562 -4.736 -0.692 1.00 . A A . 26 ALA C 1 1 2 1062 1 1 26 ALA CA C 0.643 -4.521 -1.544 1.00 . A A . 26 ALA CA 1 1 2 1063 1 1 26 ALA CB C 1.576 -3.523 -0.898 1.00 . A A . 26 ALA CB 1 1 2 1064 1 1 26 ALA H H 0.252 -3.132 -3.098 1.00 . A A . 26 ALA H 1 1 2 1065 1 1 26 ALA HA H 1.156 -5.467 -1.633 1.00 . A A . 26 ALA HA 1 1 2 1066 1 1 26 ALA HB1 H 2.434 -3.368 -1.535 1.00 . A A . 26 ALA HB1 1 1 2 1067 1 1 26 ALA HB2 H 1.907 -3.906 0.060 1.00 . A A . 26 ALA HB2 1 1 2 1068 1 1 26 ALA HB3 H 1.061 -2.586 -0.753 1.00 . A A . 26 ALA HB3 1 1 2 1069 1 1 26 ALA N N 0.269 -4.098 -2.873 1.00 . A A . 26 ALA N 1 1 2 1070 1 1 26 ALA O O -0.679 -5.752 -0.002 1.00 . A A . 26 ALA O 1 1 2 1071 1 1 27 LEU C C -3.524 -4.940 -0.564 1.00 . A A . 27 LEU C 1 1 2 1072 1 1 27 LEU CA C -2.651 -3.848 0.023 1.00 . A A . 27 LEU CA 1 1 2 1073 1 1 27 LEU CB C -3.347 -2.490 0.026 1.00 . A A . 27 LEU CB 1 1 2 1074 1 1 27 LEU CD1 C -2.922 -1.317 2.186 1.00 . A A . 27 LEU CD1 1 1 2 1075 1 1 27 LEU CD2 C -1.181 -1.333 0.483 1.00 . A A . 27 LEU CD2 1 1 2 1076 1 1 27 LEU CG C -2.649 -1.318 0.712 1.00 . A A . 27 LEU CG 1 1 2 1077 1 1 27 LEU H H -1.338 -3.022 -1.368 1.00 . A A . 27 LEU H 1 1 2 1078 1 1 27 LEU HA H -2.381 -4.112 1.035 1.00 . A A . 27 LEU HA 1 1 2 1079 1 1 27 LEU HB2 H -3.489 -2.203 -0.996 1.00 . A A . 27 LEU HB2 1 1 2 1080 1 1 27 LEU HB3 H -4.319 -2.614 0.480 1.00 . A A . 27 LEU HB3 1 1 2 1081 1 1 27 LEU HD11 H -2.541 -2.230 2.612 1.00 . A A . 27 LEU HD11 1 1 2 1082 1 1 27 LEU HD12 H -3.986 -1.257 2.348 1.00 . A A . 27 LEU HD12 1 1 2 1083 1 1 27 LEU HD13 H -2.433 -0.471 2.642 1.00 . A A . 27 LEU HD13 1 1 2 1084 1 1 27 LEU HD21 H -1.002 -1.314 -0.579 1.00 . A A . 27 LEU HD21 1 1 2 1085 1 1 27 LEU HD22 H -0.781 -2.245 0.896 1.00 . A A . 27 LEU HD22 1 1 2 1086 1 1 27 LEU HD23 H -0.728 -0.479 0.955 1.00 . A A . 27 LEU HD23 1 1 2 1087 1 1 27 LEU HG H -3.017 -0.415 0.284 1.00 . A A . 27 LEU HG 1 1 2 1088 1 1 27 LEU N N -1.463 -3.795 -0.754 1.00 . A A . 27 LEU N 1 1 2 1089 1 1 27 LEU O O -4.368 -5.487 0.095 1.00 . A A . 27 LEU O 1 1 2 1090 1 1 28 LYS C C -3.729 -7.642 -1.733 1.00 . A A . 28 LYS C 1 1 2 1091 1 1 28 LYS CA C -4.018 -6.348 -2.463 1.00 . A A . 28 LYS CA 1 1 2 1092 1 1 28 LYS CB C -3.656 -6.506 -3.929 1.00 . A A . 28 LYS CB 1 1 2 1093 1 1 28 LYS CD C -4.064 -5.702 -6.240 1.00 . A A . 28 LYS CD 1 1 2 1094 1 1 28 LYS CE C -3.865 -7.048 -6.921 1.00 . A A . 28 LYS CE 1 1 2 1095 1 1 28 LYS CG C -4.656 -5.852 -4.862 1.00 . A A . 28 LYS CG 1 1 2 1096 1 1 28 LYS H H -2.748 -4.662 -2.380 1.00 . A A . 28 LYS H 1 1 2 1097 1 1 28 LYS HA H -5.074 -6.149 -2.403 1.00 . A A . 28 LYS HA 1 1 2 1098 1 1 28 LYS HB2 H -2.688 -6.058 -4.100 1.00 . A A . 28 LYS HB2 1 1 2 1099 1 1 28 LYS HB3 H -3.606 -7.558 -4.168 1.00 . A A . 28 LYS HB3 1 1 2 1100 1 1 28 LYS HD2 H -4.718 -5.091 -6.845 1.00 . A A . 28 LYS HD2 1 1 2 1101 1 1 28 LYS HD3 H -3.108 -5.216 -6.131 1.00 . A A . 28 LYS HD3 1 1 2 1102 1 1 28 LYS HE2 H -3.346 -6.892 -7.856 1.00 . A A . 28 LYS HE2 1 1 2 1103 1 1 28 LYS HE3 H -3.266 -7.678 -6.280 1.00 . A A . 28 LYS HE3 1 1 2 1104 1 1 28 LYS HG2 H -5.540 -6.471 -4.923 1.00 . A A . 28 LYS HG2 1 1 2 1105 1 1 28 LYS HG3 H -4.918 -4.873 -4.477 1.00 . A A . 28 LYS HG3 1 1 2 1106 1 1 28 LYS HZ1 H -4.991 -8.681 -7.587 1.00 . A A . 28 LYS HZ1 1 1 2 1107 1 1 28 LYS HZ2 H -5.714 -7.173 -7.884 1.00 . A A . 28 LYS HZ2 1 1 2 1108 1 1 28 LYS HZ3 H -5.714 -7.817 -6.315 1.00 . A A . 28 LYS HZ3 1 1 2 1109 1 1 28 LYS N N -3.338 -5.224 -1.843 1.00 . A A . 28 LYS N 1 1 2 1110 1 1 28 LYS NZ N -5.159 -7.726 -7.194 1.00 . A A . 28 LYS NZ 1 1 2 1111 1 1 28 LYS O O -4.665 -8.321 -1.315 1.00 . A A . 28 LYS O 1 1 2 1112 1 1 29 GLN C C -2.449 -9.297 0.546 1.00 . A A . 29 GLN C 1 1 2 1113 1 1 29 GLN CA C -2.197 -9.307 -0.956 1.00 . A A . 29 GLN CA 1 1 2 1114 1 1 29 GLN CB C -0.800 -9.747 -1.270 1.00 . A A . 29 GLN CB 1 1 2 1115 1 1 29 GLN CD C 1.137 -8.258 -1.596 1.00 . A A . 29 GLN CD 1 1 2 1116 1 1 29 GLN CG C 0.275 -8.965 -0.595 1.00 . A A . 29 GLN CG 1 1 2 1117 1 1 29 GLN H H -1.670 -7.412 -1.811 1.00 . A A . 29 GLN H 1 1 2 1118 1 1 29 GLN HA H -2.882 -10.004 -1.406 1.00 . A A . 29 GLN HA 1 1 2 1119 1 1 29 GLN HB2 H -0.702 -10.749 -0.990 1.00 . A A . 29 GLN HB2 1 1 2 1120 1 1 29 GLN HB3 H -0.650 -9.657 -2.322 1.00 . A A . 29 GLN HB3 1 1 2 1121 1 1 29 GLN HE21 H 1.439 -6.803 -0.307 1.00 . A A . 29 GLN HE21 1 1 2 1122 1 1 29 GLN HE22 H 2.145 -6.609 -1.860 1.00 . A A . 29 GLN HE22 1 1 2 1123 1 1 29 GLN HG2 H -0.180 -8.235 0.052 1.00 . A A . 29 GLN HG2 1 1 2 1124 1 1 29 GLN HG3 H 0.882 -9.638 -0.020 1.00 . A A . 29 GLN HG3 1 1 2 1125 1 1 29 GLN N N -2.450 -8.010 -1.546 1.00 . A A . 29 GLN N 1 1 2 1126 1 1 29 GLN NE2 N 1.639 -7.117 -1.213 1.00 . A A . 29 GLN NE2 1 1 2 1127 1 1 29 GLN O O -2.834 -10.305 1.138 1.00 . A A . 29 GLN O 1 1 2 1128 1 1 29 GLN OE1 O 1.344 -8.733 -2.711 1.00 . A A . 29 GLN OE1 1 1 2 1129 1 1 30 THR C C -3.909 -7.599 2.869 1.00 . A A . 30 THR C 1 1 2 1130 1 1 30 THR CA C -2.458 -7.956 2.565 1.00 . A A . 30 THR CA 1 1 2 1131 1 1 30 THR CB C -1.568 -6.836 3.092 1.00 . A A . 30 THR CB 1 1 2 1132 1 1 30 THR CG2 C -0.105 -7.243 3.038 1.00 . A A . 30 THR CG2 1 1 2 1133 1 1 30 THR H H -1.864 -7.411 0.617 1.00 . A A . 30 THR H 1 1 2 1134 1 1 30 THR HA H -2.200 -8.869 3.078 1.00 . A A . 30 THR HA 1 1 2 1135 1 1 30 THR HB H -1.843 -6.633 4.107 1.00 . A A . 30 THR HB 1 1 2 1136 1 1 30 THR HG1 H -1.218 -5.669 1.538 1.00 . A A . 30 THR HG1 1 1 2 1137 1 1 30 THR HG21 H 0.506 -6.446 3.436 1.00 . A A . 30 THR HG21 1 1 2 1138 1 1 30 THR HG22 H 0.176 -7.432 2.011 1.00 . A A . 30 THR HG22 1 1 2 1139 1 1 30 THR HG23 H 0.043 -8.138 3.624 1.00 . A A . 30 THR HG23 1 1 2 1140 1 1 30 THR N N -2.229 -8.147 1.144 1.00 . A A . 30 THR N 1 1 2 1141 1 1 30 THR O O -4.321 -7.529 4.025 1.00 . A A . 30 THR O 1 1 2 1142 1 1 30 THR OG1 O -1.779 -5.649 2.324 1.00 . A A . 30 THR OG1 1 1 2 1143 1 1 31 ASN C C -6.184 -5.593 2.626 1.00 . A A . 31 ASN C 1 1 2 1144 1 1 31 ASN CA C -6.050 -6.919 1.879 1.00 . A A . 31 ASN CA 1 1 2 1145 1 1 31 ASN CB C -6.945 -7.986 2.527 1.00 . A A . 31 ASN CB 1 1 2 1146 1 1 31 ASN CG C -6.920 -9.324 1.806 1.00 . A A . 31 ASN CG 1 1 2 1147 1 1 31 ASN H H -4.261 -7.488 0.920 1.00 . A A . 31 ASN H 1 1 2 1148 1 1 31 ASN HA H -6.381 -6.753 0.861 1.00 . A A . 31 ASN HA 1 1 2 1149 1 1 31 ASN HB2 H -6.615 -8.146 3.542 1.00 . A A . 31 ASN HB2 1 1 2 1150 1 1 31 ASN HB3 H -7.963 -7.625 2.540 1.00 . A A . 31 ASN HB3 1 1 2 1151 1 1 31 ASN HD21 H -6.847 -8.441 0.021 1.00 . A A . 31 ASN HD21 1 1 2 1152 1 1 31 ASN HD22 H -6.842 -10.167 0.006 1.00 . A A . 31 ASN HD22 1 1 2 1153 1 1 31 ASN N N -4.660 -7.363 1.807 1.00 . A A . 31 ASN N 1 1 2 1154 1 1 31 ASN ND2 N -6.867 -9.307 0.479 1.00 . A A . 31 ASN ND2 1 1 2 1155 1 1 31 ASN O O -6.924 -5.496 3.605 1.00 . A A . 31 ASN O 1 1 2 1156 1 1 31 ASN OD1 O -6.978 -10.374 2.445 1.00 . A A . 31 ASN OD1 1 1 2 1157 1 1 32 GLY C C -5.110 -2.873 3.993 1.00 . A A . 32 GLY C 1 1 2 1158 1 1 32 GLY CA C -5.714 -3.236 2.633 1.00 . A A . 32 GLY CA 1 1 2 1159 1 1 32 GLY H H -4.796 -4.705 1.438 1.00 . A A . 32 GLY H 1 1 2 1160 1 1 32 GLY HA2 H -5.320 -2.557 1.883 1.00 . A A . 32 GLY HA2 1 1 2 1161 1 1 32 GLY HA3 H -6.785 -3.091 2.685 1.00 . A A . 32 GLY HA3 1 1 2 1162 1 1 32 GLY N N -5.473 -4.566 2.161 1.00 . A A . 32 GLY N 1 1 2 1163 1 1 32 GLY O O -5.305 -1.744 4.441 1.00 . A A . 32 GLY O 1 1 2 1164 1 1 33 ASN C C -2.387 -2.819 5.744 1.00 . A A . 33 ASN C 1 1 2 1165 1 1 33 ASN CA C -3.808 -3.358 5.948 1.00 . A A . 33 ASN CA 1 1 2 1166 1 1 33 ASN CB C -3.946 -4.460 7.010 1.00 . A A . 33 ASN CB 1 1 2 1167 1 1 33 ASN CG C -2.986 -5.630 6.934 1.00 . A A . 33 ASN CG 1 1 2 1168 1 1 33 ASN H H -4.279 -4.688 4.387 1.00 . A A . 33 ASN H 1 1 2 1169 1 1 33 ASN HA H -4.398 -2.526 6.276 1.00 . A A . 33 ASN HA 1 1 2 1170 1 1 33 ASN HB2 H -3.831 -4.013 7.962 1.00 . A A . 33 ASN HB2 1 1 2 1171 1 1 33 ASN HB3 H -4.948 -4.856 6.935 1.00 . A A . 33 ASN HB3 1 1 2 1172 1 1 33 ASN HD21 H -2.711 -5.348 5.011 1.00 . A A . 33 ASN HD21 1 1 2 1173 1 1 33 ASN HD22 H -1.881 -6.701 5.699 1.00 . A A . 33 ASN HD22 1 1 2 1174 1 1 33 ASN N N -4.391 -3.768 4.689 1.00 . A A . 33 ASN N 1 1 2 1175 1 1 33 ASN ND2 N -2.470 -5.914 5.767 1.00 . A A . 33 ASN ND2 1 1 2 1176 1 1 33 ASN O O -1.468 -3.528 5.340 1.00 . A A . 33 ASN O 1 1 2 1177 1 1 33 ASN OD1 O -2.699 -6.263 7.950 1.00 . A A . 33 ASN OD1 1 1 2 1178 1 1 34 ALA C C 0.236 -1.202 5.990 1.00 . A A . 34 ALA C 1 1 2 1179 1 1 34 ALA CA C -1.122 -0.729 5.519 1.00 . A A . 34 ALA CA 1 1 2 1180 1 1 34 ALA CB C -1.317 0.736 5.879 1.00 . A A . 34 ALA CB 1 1 2 1181 1 1 34 ALA H H -2.944 -1.074 6.529 1.00 . A A . 34 ALA H 1 1 2 1182 1 1 34 ALA HA H -1.130 -0.803 4.452 1.00 . A A . 34 ALA HA 1 1 2 1183 1 1 34 ALA HB1 H -0.549 1.327 5.404 1.00 . A A . 34 ALA HB1 1 1 2 1184 1 1 34 ALA HB2 H -1.252 0.855 6.950 1.00 . A A . 34 ALA HB2 1 1 2 1185 1 1 34 ALA HB3 H -2.288 1.065 5.538 1.00 . A A . 34 ALA HB3 1 1 2 1186 1 1 34 ALA N N -2.249 -1.522 6.003 1.00 . A A . 34 ALA N 1 1 2 1187 1 1 34 ALA O O 1.158 -1.310 5.180 1.00 . A A . 34 ALA O 1 1 2 1188 1 1 35 GLU C C 2.192 -3.044 7.183 1.00 . A A . 35 GLU C 1 1 2 1189 1 1 35 GLU CA C 1.617 -1.814 7.825 1.00 . A A . 35 GLU CA 1 1 2 1190 1 1 35 GLU CB C 1.367 -2.018 9.281 1.00 . A A . 35 GLU CB 1 1 2 1191 1 1 35 GLU CD C 0.894 0.316 10.024 1.00 . A A . 35 GLU CD 1 1 2 1192 1 1 35 GLU CG C 1.823 -0.875 10.113 1.00 . A A . 35 GLU CG 1 1 2 1193 1 1 35 GLU H H -0.356 -1.450 7.880 1.00 . A A . 35 GLU H 1 1 2 1194 1 1 35 GLU HA H 2.250 -1.013 7.694 1.00 . A A . 35 GLU HA 1 1 2 1195 1 1 35 GLU HB2 H 0.309 -2.135 9.433 1.00 . A A . 35 GLU HB2 1 1 2 1196 1 1 35 GLU HB3 H 1.851 -2.883 9.591 1.00 . A A . 35 GLU HB3 1 1 2 1197 1 1 35 GLU HG2 H 1.882 -1.207 11.119 1.00 . A A . 35 GLU HG2 1 1 2 1198 1 1 35 GLU HG3 H 2.792 -0.589 9.769 1.00 . A A . 35 GLU HG3 1 1 2 1199 1 1 35 GLU N N 0.382 -1.472 7.271 1.00 . A A . 35 GLU N 1 1 2 1200 1 1 35 GLU O O 3.356 -3.102 6.768 1.00 . A A . 35 GLU O 1 1 2 1201 1 1 35 GLU OE1 O -0.195 0.269 10.635 1.00 . A A . 35 GLU OE1 1 1 2 1202 1 1 35 GLU OE2 O 1.227 1.291 9.320 1.00 . A A . 35 GLU OE2 1 1 2 1203 1 1 36 PHE C C 1.876 -5.091 5.002 1.00 . A A . 36 PHE C 1 1 2 1204 1 1 36 PHE CA C 1.606 -5.262 6.471 1.00 . A A . 36 PHE CA 1 1 2 1205 1 1 36 PHE CB C 0.411 -6.173 6.700 1.00 . A A . 36 PHE CB 1 1 2 1206 1 1 36 PHE CD1 C 0.597 -6.115 9.154 1.00 . A A . 36 PHE CD1 1 1 2 1207 1 1 36 PHE CD2 C 0.504 -8.249 8.114 1.00 . A A . 36 PHE CD2 1 1 2 1208 1 1 36 PHE CE1 C 0.702 -6.688 10.366 1.00 . A A . 36 PHE CE1 1 1 2 1209 1 1 36 PHE CE2 C 0.608 -8.851 9.355 1.00 . A A . 36 PHE CE2 1 1 2 1210 1 1 36 PHE CG C 0.498 -6.868 8.011 1.00 . A A . 36 PHE CG 1 1 2 1211 1 1 36 PHE CZ C 0.707 -8.065 10.489 1.00 . A A . 36 PHE CZ 1 1 2 1212 1 1 36 PHE H H 0.445 -3.838 7.477 1.00 . A A . 36 PHE H 1 1 2 1213 1 1 36 PHE HA H 2.477 -5.685 6.945 1.00 . A A . 36 PHE HA 1 1 2 1214 1 1 36 PHE HB2 H -0.485 -5.563 6.713 1.00 . A A . 36 PHE HB2 1 1 2 1215 1 1 36 PHE HB3 H 0.323 -6.894 5.912 1.00 . A A . 36 PHE HB3 1 1 2 1216 1 1 36 PHE HD1 H 0.593 -5.044 9.089 1.00 . A A . 36 PHE HD1 1 1 2 1217 1 1 36 PHE HD2 H 0.426 -8.854 7.223 1.00 . A A . 36 PHE HD2 1 1 2 1218 1 1 36 PHE HE1 H 0.780 -6.052 11.215 1.00 . A A . 36 PHE HE1 1 1 2 1219 1 1 36 PHE HE2 H 0.610 -9.928 9.438 1.00 . A A . 36 PHE HE2 1 1 2 1220 1 1 36 PHE HZ H 0.790 -8.526 11.464 1.00 . A A . 36 PHE HZ 1 1 2 1221 1 1 36 PHE N N 1.327 -3.998 7.093 1.00 . A A . 36 PHE N 1 1 2 1222 1 1 36 PHE O O 2.753 -5.738 4.436 1.00 . A A . 36 PHE O 1 1 2 1223 1 1 37 ALA C C 2.553 -3.371 2.605 1.00 . A A . 37 ALA C 1 1 2 1224 1 1 37 ALA CA C 1.225 -3.985 2.983 1.00 . A A . 37 ALA CA 1 1 2 1225 1 1 37 ALA CB C 0.095 -3.108 2.557 1.00 . A A . 37 ALA CB 1 1 2 1226 1 1 37 ALA H H 0.529 -3.615 4.925 1.00 . A A . 37 ALA H 1 1 2 1227 1 1 37 ALA HA H 1.120 -4.942 2.494 1.00 . A A . 37 ALA HA 1 1 2 1228 1 1 37 ALA HB1 H 0.179 -2.152 3.052 1.00 . A A . 37 ALA HB1 1 1 2 1229 1 1 37 ALA HB2 H -0.843 -3.572 2.824 1.00 . A A . 37 ALA HB2 1 1 2 1230 1 1 37 ALA HB3 H 0.135 -2.964 1.488 1.00 . A A . 37 ALA HB3 1 1 2 1231 1 1 37 ALA N N 1.140 -4.188 4.396 1.00 . A A . 37 ALA N 1 1 2 1232 1 1 37 ALA O O 3.183 -3.792 1.656 1.00 . A A . 37 ALA O 1 1 2 1233 1 1 38 ALA C C 5.366 -2.708 3.266 1.00 . A A . 38 ALA C 1 1 2 1234 1 1 38 ALA CA C 4.236 -1.717 3.149 1.00 . A A . 38 ALA CA 1 1 2 1235 1 1 38 ALA CB C 4.429 -0.607 4.160 1.00 . A A . 38 ALA CB 1 1 2 1236 1 1 38 ALA H H 2.387 -2.063 4.076 1.00 . A A . 38 ALA H 1 1 2 1237 1 1 38 ALA HA H 4.239 -1.285 2.160 1.00 . A A . 38 ALA HA 1 1 2 1238 1 1 38 ALA HB1 H 3.629 0.110 4.065 1.00 . A A . 38 ALA HB1 1 1 2 1239 1 1 38 ALA HB2 H 5.375 -0.120 3.979 1.00 . A A . 38 ALA HB2 1 1 2 1240 1 1 38 ALA HB3 H 4.422 -1.025 5.155 1.00 . A A . 38 ALA HB3 1 1 2 1241 1 1 38 ALA N N 2.965 -2.376 3.361 1.00 . A A . 38 ALA N 1 1 2 1242 1 1 38 ALA O O 6.239 -2.767 2.416 1.00 . A A . 38 ALA O 1 1 2 1243 1 1 39 SER C C 6.404 -5.546 3.596 1.00 . A A . 39 SER C 1 1 2 1244 1 1 39 SER CA C 6.375 -4.439 4.616 1.00 . A A . 39 SER CA 1 1 2 1245 1 1 39 SER CB C 6.169 -5.004 6.018 1.00 . A A . 39 SER CB 1 1 2 1246 1 1 39 SER H H 4.445 -3.645 4.754 1.00 . A A . 39 SER H 1 1 2 1247 1 1 39 SER HA H 7.299 -3.882 4.575 1.00 . A A . 39 SER HA 1 1 2 1248 1 1 39 SER HB2 H 5.266 -5.598 6.030 1.00 . A A . 39 SER HB2 1 1 2 1249 1 1 39 SER HB3 H 7.014 -5.622 6.287 1.00 . A A . 39 SER HB3 1 1 2 1250 1 1 39 SER HG H 5.210 -3.485 6.816 1.00 . A A . 39 SER HG 1 1 2 1251 1 1 39 SER N N 5.286 -3.551 4.278 1.00 . A A . 39 SER N 1 1 2 1252 1 1 39 SER O O 7.423 -6.201 3.367 1.00 . A A . 39 SER O 1 1 2 1253 1 1 39 SER OG O 6.038 -3.961 6.972 1.00 . A A . 39 SER OG 1 1 2 1254 1 1 40 LEU C C 5.560 -6.074 0.639 1.00 . A A . 40 LEU C 1 1 2 1255 1 1 40 LEU CA C 5.094 -6.686 1.947 1.00 . A A . 40 LEU CA 1 1 2 1256 1 1 40 LEU CB C 3.631 -7.079 1.883 1.00 . A A . 40 LEU CB 1 1 2 1257 1 1 40 LEU CD1 C 4.046 -8.812 0.069 1.00 . A A . 40 LEU CD1 1 1 2 1258 1 1 40 LEU CD2 C 3.683 -9.523 2.435 1.00 . A A . 40 LEU CD2 1 1 2 1259 1 1 40 LEU CG C 3.323 -8.498 1.372 1.00 . A A . 40 LEU CG 1 1 2 1260 1 1 40 LEU H H 4.479 -5.183 3.234 1.00 . A A . 40 LEU H 1 1 2 1261 1 1 40 LEU HA H 5.693 -7.549 2.177 1.00 . A A . 40 LEU HA 1 1 2 1262 1 1 40 LEU HB2 H 3.232 -6.991 2.882 1.00 . A A . 40 LEU HB2 1 1 2 1263 1 1 40 LEU HB3 H 3.132 -6.360 1.268 1.00 . A A . 40 LEU HB3 1 1 2 1264 1 1 40 LEU HD11 H 3.780 -9.806 -0.261 1.00 . A A . 40 LEU HD11 1 1 2 1265 1 1 40 LEU HD12 H 5.113 -8.761 0.228 1.00 . A A . 40 LEU HD12 1 1 2 1266 1 1 40 LEU HD13 H 3.760 -8.093 -0.686 1.00 . A A . 40 LEU HD13 1 1 2 1267 1 1 40 LEU HD21 H 3.101 -9.337 3.325 1.00 . A A . 40 LEU HD21 1 1 2 1268 1 1 40 LEU HD22 H 4.734 -9.445 2.669 1.00 . A A . 40 LEU HD22 1 1 2 1269 1 1 40 LEU HD23 H 3.469 -10.517 2.067 1.00 . A A . 40 LEU HD23 1 1 2 1270 1 1 40 LEU HG H 2.261 -8.577 1.186 1.00 . A A . 40 LEU HG 1 1 2 1271 1 1 40 LEU N N 5.255 -5.730 2.983 1.00 . A A . 40 LEU N 1 1 2 1272 1 1 40 LEU O O 6.285 -6.709 -0.108 1.00 . A A . 40 LEU O 1 1 2 1273 1 1 41 LEU C C 7.022 -3.999 -0.943 1.00 . A A . 41 LEU C 1 1 2 1274 1 1 41 LEU CA C 5.521 -4.191 -0.871 1.00 . A A . 41 LEU CA 1 1 2 1275 1 1 41 LEU CB C 4.703 -2.913 -1.076 1.00 . A A . 41 LEU CB 1 1 2 1276 1 1 41 LEU CD1 C 6.392 -1.142 -0.940 1.00 . A A . 41 LEU CD1 1 1 2 1277 1 1 41 LEU CD2 C 4.039 -0.636 -0.359 1.00 . A A . 41 LEU CD2 1 1 2 1278 1 1 41 LEU CG C 5.139 -1.669 -0.334 1.00 . A A . 41 LEU CG 1 1 2 1279 1 1 41 LEU H H 4.716 -4.263 1.074 1.00 . A A . 41 LEU H 1 1 2 1280 1 1 41 LEU HA H 5.249 -4.873 -1.637 1.00 . A A . 41 LEU HA 1 1 2 1281 1 1 41 LEU HB2 H 4.692 -2.687 -2.129 1.00 . A A . 41 LEU HB2 1 1 2 1282 1 1 41 LEU HB3 H 3.691 -3.136 -0.767 1.00 . A A . 41 LEU HB3 1 1 2 1283 1 1 41 LEU HD11 H 6.717 -0.270 -0.402 1.00 . A A . 41 LEU HD11 1 1 2 1284 1 1 41 LEU HD12 H 6.219 -0.900 -1.976 1.00 . A A . 41 LEU HD12 1 1 2 1285 1 1 41 LEU HD13 H 7.140 -1.917 -0.867 1.00 . A A . 41 LEU HD13 1 1 2 1286 1 1 41 LEU HD21 H 4.380 0.263 0.128 1.00 . A A . 41 LEU HD21 1 1 2 1287 1 1 41 LEU HD22 H 3.180 -1.031 0.160 1.00 . A A . 41 LEU HD22 1 1 2 1288 1 1 41 LEU HD23 H 3.774 -0.418 -1.385 1.00 . A A . 41 LEU HD23 1 1 2 1289 1 1 41 LEU HG H 5.350 -1.912 0.683 1.00 . A A . 41 LEU HG 1 1 2 1290 1 1 41 LEU N N 5.194 -4.813 0.383 1.00 . A A . 41 LEU N 1 1 2 1291 1 1 41 LEU O O 7.612 -3.978 -2.024 1.00 . A A . 41 LEU O 1 1 2 1292 1 1 42 PHE C C 9.791 -4.768 -0.354 1.00 . A A . 42 PHE C 1 1 2 1293 1 1 42 PHE CA C 9.036 -3.684 0.400 1.00 . A A . 42 PHE CA 1 1 2 1294 1 1 42 PHE CB C 9.403 -3.739 1.873 1.00 . A A . 42 PHE CB 1 1 2 1295 1 1 42 PHE CD1 C 8.709 -1.537 2.511 1.00 . A A . 42 PHE CD1 1 1 2 1296 1 1 42 PHE CD2 C 11.015 -2.012 2.698 1.00 . A A . 42 PHE CD2 1 1 2 1297 1 1 42 PHE CE1 C 8.916 -0.274 2.942 1.00 . A A . 42 PHE CE1 1 1 2 1298 1 1 42 PHE CE2 C 11.251 -0.728 3.148 1.00 . A A . 42 PHE CE2 1 1 2 1299 1 1 42 PHE CG C 9.728 -2.407 2.385 1.00 . A A . 42 PHE CG 1 1 2 1300 1 1 42 PHE CZ C 10.190 0.151 3.271 1.00 . A A . 42 PHE CZ 1 1 2 1301 1 1 42 PHE H H 7.058 -3.847 1.040 1.00 . A A . 42 PHE H 1 1 2 1302 1 1 42 PHE HA H 9.294 -2.697 0.030 1.00 . A A . 42 PHE HA 1 1 2 1303 1 1 42 PHE HB2 H 8.553 -4.088 2.438 1.00 . A A . 42 PHE HB2 1 1 2 1304 1 1 42 PHE HB3 H 10.238 -4.384 2.025 1.00 . A A . 42 PHE HB3 1 1 2 1305 1 1 42 PHE HD1 H 7.707 -1.880 2.270 1.00 . A A . 42 PHE HD1 1 1 2 1306 1 1 42 PHE HD2 H 11.831 -2.710 2.596 1.00 . A A . 42 PHE HD2 1 1 2 1307 1 1 42 PHE HE1 H 8.088 0.377 3.014 1.00 . A A . 42 PHE HE1 1 1 2 1308 1 1 42 PHE HE2 H 12.252 -0.412 3.400 1.00 . A A . 42 PHE HE2 1 1 2 1309 1 1 42 PHE HZ H 10.355 1.160 3.615 1.00 . A A . 42 PHE HZ 1 1 2 1310 1 1 42 PHE N N 7.613 -3.843 0.241 1.00 . A A . 42 PHE N 1 1 2 1311 1 1 42 PHE O O 10.902 -4.542 -0.834 1.00 . A A . 42 PHE O 1 1 2 1312 1 1 43 GLN C C 11.097 -7.352 -0.423 1.00 . A A . 43 GLN C 1 1 2 1313 1 1 43 GLN CA C 9.730 -7.100 -1.034 1.00 . A A . 43 GLN CA 1 1 2 1314 1 1 43 GLN CB C 9.750 -6.919 -2.520 1.00 . A A . 43 GLN CB 1 1 2 1315 1 1 43 GLN CD C 7.349 -7.759 -2.637 1.00 . A A . 43 GLN CD 1 1 2 1316 1 1 43 GLN CG C 8.744 -7.788 -3.239 1.00 . A A . 43 GLN CG 1 1 2 1317 1 1 43 GLN H H 8.221 -5.991 -0.273 1.00 . A A . 43 GLN H 1 1 2 1318 1 1 43 GLN HA H 9.089 -7.935 -0.795 1.00 . A A . 43 GLN HA 1 1 2 1319 1 1 43 GLN HB2 H 9.533 -5.886 -2.748 1.00 . A A . 43 GLN HB2 1 1 2 1320 1 1 43 GLN HB3 H 10.715 -7.153 -2.862 1.00 . A A . 43 GLN HB3 1 1 2 1321 1 1 43 GLN HE21 H 6.949 -6.027 -3.509 1.00 . A A . 43 GLN HE21 1 1 2 1322 1 1 43 GLN HE22 H 5.666 -6.698 -2.555 1.00 . A A . 43 GLN HE22 1 1 2 1323 1 1 43 GLN HG2 H 8.685 -7.487 -4.272 1.00 . A A . 43 GLN HG2 1 1 2 1324 1 1 43 GLN HG3 H 9.100 -8.790 -3.175 1.00 . A A . 43 GLN HG3 1 1 2 1325 1 1 43 GLN N N 9.143 -5.940 -0.480 1.00 . A A . 43 GLN N 1 1 2 1326 1 1 43 GLN NE2 N 6.579 -6.723 -2.932 1.00 . A A . 43 GLN NE2 1 1 2 1327 1 1 43 GLN O O 12.051 -7.733 -1.100 1.00 . A A . 43 GLN O 1 1 2 1328 1 1 43 GLN OE1 O 6.987 -8.650 -1.868 1.00 . A A . 43 GLN OE1 1 1 2 1329 1 1 44 SER C C 13.507 -6.490 1.133 1.00 . A A . 44 SER C 1 1 2 1330 1 1 44 SER CA C 12.330 -7.295 1.695 1.00 . A A . 44 SER CA 1 1 2 1331 1 1 44 SER CB C 12.659 -8.779 1.784 1.00 . A A . 44 SER CB 1 1 2 1332 1 1 44 SER H H 10.307 -6.859 1.320 1.00 . A A . 44 SER H 1 1 2 1333 1 1 44 SER HA H 12.106 -6.930 2.687 1.00 . A A . 44 SER HA 1 1 2 1334 1 1 44 SER HB2 H 12.700 -9.176 0.784 1.00 . A A . 44 SER HB2 1 1 2 1335 1 1 44 SER HB3 H 13.611 -8.915 2.273 1.00 . A A . 44 SER HB3 1 1 2 1336 1 1 44 SER HG H 11.581 -9.111 3.400 1.00 . A A . 44 SER HG 1 1 2 1337 1 1 44 SER N N 11.134 -7.131 0.885 1.00 . A A . 44 SER N 1 1 2 1338 1 1 44 SER O O 13.478 -5.243 1.240 1.00 . A A . 44 SER O 1 1 2 1339 1 1 44 SER OXT O 14.462 -7.097 0.610 1.00 . A A . 44 SER OXT 1 1 2 1340 1 1 44 SER OG O 11.657 -9.482 2.506 1.00 . A A . 44 SER OG 1 1 3 1341 1 1 1 GLY C C -12.625 -3.667 3.795 1.00 . A A . 1 GLY C 1 1 3 1342 1 1 1 GLY CA C -12.335 -4.235 5.166 1.00 . A A . 1 GLY CA 1 1 3 1343 1 1 1 GLY H1 H -10.322 -4.641 4.806 1.00 . A A . 1 GLY H1 1 1 3 1344 1 1 1 GLY H2 H -11.357 -5.955 4.517 1.00 . A A . 1 GLY H2 1 1 3 1345 1 1 1 GLY H3 H -10.981 -5.508 6.108 1.00 . A A . 1 GLY H3 1 1 3 1346 1 1 1 GLY HA2 H -13.202 -4.779 5.509 1.00 . A A . 1 GLY HA2 1 1 3 1347 1 1 1 GLY HA3 H -12.136 -3.422 5.848 1.00 . A A . 1 GLY HA3 1 1 3 1348 1 1 1 GLY N N -11.168 -5.147 5.149 1.00 . A A . 1 GLY N 1 1 3 1349 1 1 1 GLY O O -12.441 -4.345 2.783 1.00 . A A . 1 GLY O 1 1 3 1350 1 1 2 SER C C -12.314 -0.701 2.199 1.00 . A A . 2 SER C 1 1 3 1351 1 1 2 SER CA C -13.372 -1.756 2.506 1.00 . A A . 2 SER CA 1 1 3 1352 1 1 2 SER CB C -14.762 -1.127 2.572 1.00 . A A . 2 SER CB 1 1 3 1353 1 1 2 SER H H -13.204 -1.936 4.604 1.00 . A A . 2 SER H 1 1 3 1354 1 1 2 SER HA H -13.359 -2.499 1.724 1.00 . A A . 2 SER HA 1 1 3 1355 1 1 2 SER HB2 H -14.908 -0.491 1.713 1.00 . A A . 2 SER HB2 1 1 3 1356 1 1 2 SER HB3 H -15.508 -1.907 2.576 1.00 . A A . 2 SER HB3 1 1 3 1357 1 1 2 SER HG H -14.871 0.594 3.513 1.00 . A A . 2 SER HG 1 1 3 1358 1 1 2 SER N N -13.074 -2.425 3.759 1.00 . A A . 2 SER N 1 1 3 1359 1 1 2 SER O O -12.233 -0.186 1.083 1.00 . A A . 2 SER O 1 1 3 1360 1 1 2 SER OG O -14.910 -0.346 3.748 1.00 . A A . 2 SER OG 1 1 3 1361 1 1 3 ALA C C -9.125 -0.209 2.709 1.00 . A A . 3 ALA C 1 1 3 1362 1 1 3 ALA CA C -10.403 0.553 3.034 1.00 . A A . 3 ALA CA 1 1 3 1363 1 1 3 ALA CB C -10.224 1.405 4.284 1.00 . A A . 3 ALA CB 1 1 3 1364 1 1 3 ALA H H -11.658 -0.786 4.087 1.00 . A A . 3 ALA H 1 1 3 1365 1 1 3 ALA HA H -10.640 1.207 2.208 1.00 . A A . 3 ALA HA 1 1 3 1366 1 1 3 ALA HB1 H -11.136 1.949 4.480 1.00 . A A . 3 ALA HB1 1 1 3 1367 1 1 3 ALA HB2 H -9.415 2.104 4.131 1.00 . A A . 3 ALA HB2 1 1 3 1368 1 1 3 ALA HB3 H -9.996 0.768 5.126 1.00 . A A . 3 ALA HB3 1 1 3 1369 1 1 3 ALA N N -11.506 -0.380 3.204 1.00 . A A . 3 ALA N 1 1 3 1370 1 1 3 ALA O O -8.310 -0.494 3.588 1.00 . A A . 3 ALA O 1 1 3 1371 1 1 4 THR C C -6.690 -0.450 0.555 1.00 . A A . 4 THR C 1 1 3 1372 1 1 4 THR CA C -7.822 -1.329 0.999 1.00 . A A . 4 THR CA 1 1 3 1373 1 1 4 THR CB C -8.216 -2.294 -0.129 1.00 . A A . 4 THR CB 1 1 3 1374 1 1 4 THR CG2 C -8.779 -3.585 0.436 1.00 . A A . 4 THR CG2 1 1 3 1375 1 1 4 THR H H -9.655 -0.309 0.787 1.00 . A A . 4 THR H 1 1 3 1376 1 1 4 THR HA H -7.484 -1.886 1.795 1.00 . A A . 4 THR HA 1 1 3 1377 1 1 4 THR HB H -7.334 -2.525 -0.711 1.00 . A A . 4 THR HB 1 1 3 1378 1 1 4 THR HG1 H -10.063 -2.057 -0.810 1.00 . A A . 4 THR HG1 1 1 3 1379 1 1 4 THR HG21 H -9.683 -3.374 0.985 1.00 . A A . 4 THR HG21 1 1 3 1380 1 1 4 THR HG22 H -8.053 -4.037 1.095 1.00 . A A . 4 THR HG22 1 1 3 1381 1 1 4 THR HG23 H -9.000 -4.266 -0.374 1.00 . A A . 4 THR HG23 1 1 3 1382 1 1 4 THR N N -8.974 -0.568 1.444 1.00 . A A . 4 THR N 1 1 3 1383 1 1 4 THR O O -5.589 -0.461 1.092 1.00 . A A . 4 THR O 1 1 3 1384 1 1 4 THR OG1 O -9.188 -1.670 -0.978 1.00 . A A . 4 THR OG1 1 1 3 1385 1 1 5 PHE C C -6.560 2.701 -1.049 1.00 . A A . 5 PHE C 1 1 3 1386 1 1 5 PHE CA C -6.106 1.214 -1.089 1.00 . A A . 5 PHE CA 1 1 3 1387 1 1 5 PHE CB C -6.207 0.828 -2.512 1.00 . A A . 5 PHE CB 1 1 3 1388 1 1 5 PHE CD1 C -5.357 -1.405 -2.099 1.00 . A A . 5 PHE CD1 1 1 3 1389 1 1 5 PHE CD2 C -7.246 -1.234 -3.494 1.00 . A A . 5 PHE CD2 1 1 3 1390 1 1 5 PHE CE1 C -5.387 -2.713 -2.197 1.00 . A A . 5 PHE CE1 1 1 3 1391 1 1 5 PHE CE2 C -7.268 -2.611 -3.606 1.00 . A A . 5 PHE CE2 1 1 3 1392 1 1 5 PHE CG C -6.266 -0.629 -2.720 1.00 . A A . 5 PHE CG 1 1 3 1393 1 1 5 PHE CZ C -6.312 -3.342 -2.928 1.00 . A A . 5 PHE CZ 1 1 3 1394 1 1 5 PHE H H -7.906 0.241 -0.706 1.00 . A A . 5 PHE H 1 1 3 1395 1 1 5 PHE HA H -5.100 1.063 -0.736 1.00 . A A . 5 PHE HA 1 1 3 1396 1 1 5 PHE HB2 H -7.125 1.231 -2.815 1.00 . A A . 5 PHE HB2 1 1 3 1397 1 1 5 PHE HB3 H -5.387 1.232 -3.078 1.00 . A A . 5 PHE HB3 1 1 3 1398 1 1 5 PHE HD1 H -4.607 -0.971 -1.489 1.00 . A A . 5 PHE HD1 1 1 3 1399 1 1 5 PHE HD2 H -7.977 -0.629 -4.010 1.00 . A A . 5 PHE HD2 1 1 3 1400 1 1 5 PHE HE1 H -4.658 -3.252 -1.693 1.00 . A A . 5 PHE HE1 1 1 3 1401 1 1 5 PHE HE2 H -8.022 -3.105 -4.200 1.00 . A A . 5 PHE HE2 1 1 3 1402 1 1 5 PHE HZ H -6.290 -4.400 -2.952 1.00 . A A . 5 PHE HZ 1 1 3 1403 1 1 5 PHE N N -7.018 0.313 -0.411 1.00 . A A . 5 PHE N 1 1 3 1404 1 1 5 PHE O O -6.557 3.378 -2.079 1.00 . A A . 5 PHE O 1 1 3 1405 1 1 6 PRO C C -6.201 5.546 0.233 1.00 . A A . 6 PRO C 1 1 3 1406 1 1 6 PRO CA C -7.372 4.590 0.308 1.00 . A A . 6 PRO CA 1 1 3 1407 1 1 6 PRO CB C -7.974 4.580 1.703 1.00 . A A . 6 PRO CB 1 1 3 1408 1 1 6 PRO CD C -7.217 2.421 1.258 1.00 . A A . 6 PRO CD 1 1 3 1409 1 1 6 PRO CG C -7.398 3.420 2.344 1.00 . A A . 6 PRO CG 1 1 3 1410 1 1 6 PRO HA H -8.123 4.879 -0.382 1.00 . A A . 6 PRO HA 1 1 3 1411 1 1 6 PRO HB2 H -7.736 5.489 2.227 1.00 . A A . 6 PRO HB2 1 1 3 1412 1 1 6 PRO HB3 H -9.021 4.456 1.633 1.00 . A A . 6 PRO HB3 1 1 3 1413 1 1 6 PRO HD2 H -6.387 1.802 1.429 1.00 . A A . 6 PRO HD2 1 1 3 1414 1 1 6 PRO HD3 H -8.097 1.818 1.091 1.00 . A A . 6 PRO HD3 1 1 3 1415 1 1 6 PRO HG2 H -6.464 3.686 2.780 1.00 . A A . 6 PRO HG2 1 1 3 1416 1 1 6 PRO HG3 H -8.083 3.058 3.072 1.00 . A A . 6 PRO HG3 1 1 3 1417 1 1 6 PRO N N -6.978 3.204 0.104 1.00 . A A . 6 PRO N 1 1 3 1418 1 1 6 PRO O O -5.073 5.201 0.574 1.00 . A A . 6 PRO O 1 1 3 1419 1 1 7 GLU C C -4.584 8.049 0.686 1.00 . A A . 7 GLU C 1 1 3 1420 1 1 7 GLU CA C -5.478 7.748 -0.510 1.00 . A A . 7 GLU CA 1 1 3 1421 1 1 7 GLU CB C -6.118 9.014 -1.072 1.00 . A A . 7 GLU CB 1 1 3 1422 1 1 7 GLU CD C -6.840 10.522 0.813 1.00 . A A . 7 GLU CD 1 1 3 1423 1 1 7 GLU CG C -7.267 9.526 -0.243 1.00 . A A . 7 GLU CG 1 1 3 1424 1 1 7 GLU H H -7.431 7.002 -0.330 1.00 . A A . 7 GLU H 1 1 3 1425 1 1 7 GLU HA H -4.867 7.324 -1.272 1.00 . A A . 7 GLU HA 1 1 3 1426 1 1 7 GLU HB2 H -5.371 9.784 -1.122 1.00 . A A . 7 GLU HB2 1 1 3 1427 1 1 7 GLU HB3 H -6.482 8.811 -2.069 1.00 . A A . 7 GLU HB3 1 1 3 1428 1 1 7 GLU HG2 H -7.992 9.993 -0.891 1.00 . A A . 7 GLU HG2 1 1 3 1429 1 1 7 GLU HG3 H -7.709 8.677 0.245 1.00 . A A . 7 GLU HG3 1 1 3 1430 1 1 7 GLU N N -6.496 6.761 -0.210 1.00 . A A . 7 GLU N 1 1 3 1431 1 1 7 GLU O O -3.430 8.413 0.504 1.00 . A A . 7 GLU O 1 1 3 1432 1 1 7 GLU OE1 O -6.263 11.566 0.454 1.00 . A A . 7 GLU OE1 1 1 3 1433 1 1 7 GLU OE2 O -7.078 10.260 2.011 1.00 . A A . 7 GLU OE2 1 1 3 1434 1 1 8 GLN C C -3.119 7.076 3.055 1.00 . A A . 8 GLN C 1 1 3 1435 1 1 8 GLN CA C -4.298 8.035 3.106 1.00 . A A . 8 GLN CA 1 1 3 1436 1 1 8 GLN CB C -5.117 7.723 4.362 1.00 . A A . 8 GLN CB 1 1 3 1437 1 1 8 GLN CD C -7.407 7.689 5.450 1.00 . A A . 8 GLN CD 1 1 3 1438 1 1 8 GLN CG C -6.617 7.751 4.152 1.00 . A A . 8 GLN CG 1 1 3 1439 1 1 8 GLN H H -6.069 7.725 1.986 1.00 . A A . 8 GLN H 1 1 3 1440 1 1 8 GLN HA H -3.933 9.049 3.155 1.00 . A A . 8 GLN HA 1 1 3 1441 1 1 8 GLN HB2 H -4.851 6.739 4.704 1.00 . A A . 8 GLN HB2 1 1 3 1442 1 1 8 GLN HB3 H -4.868 8.441 5.129 1.00 . A A . 8 GLN HB3 1 1 3 1443 1 1 8 GLN HE21 H -5.982 6.606 6.315 1.00 . A A . 8 GLN HE21 1 1 3 1444 1 1 8 GLN HE22 H -7.349 6.965 7.306 1.00 . A A . 8 GLN HE22 1 1 3 1445 1 1 8 GLN HG2 H -6.868 8.654 3.634 1.00 . A A . 8 GLN HG2 1 1 3 1446 1 1 8 GLN HG3 H -6.894 6.903 3.542 1.00 . A A . 8 GLN HG3 1 1 3 1447 1 1 8 GLN N N -5.110 7.896 1.899 1.00 . A A . 8 GLN N 1 1 3 1448 1 1 8 GLN NE2 N -6.856 7.020 6.456 1.00 . A A . 8 GLN NE2 1 1 3 1449 1 1 8 GLN O O -1.963 7.488 2.983 1.00 . A A . 8 GLN O 1 1 3 1450 1 1 8 GLN OE1 O -8.507 8.234 5.547 1.00 . A A . 8 GLN OE1 1 1 3 1451 1 1 9 THR C C -1.610 4.763 1.837 1.00 . A A . 9 THR C 1 1 3 1452 1 1 9 THR CA C -2.463 4.740 3.072 1.00 . A A . 9 THR CA 1 1 3 1453 1 1 9 THR CB C -3.138 3.381 3.225 1.00 . A A . 9 THR CB 1 1 3 1454 1 1 9 THR CG2 C -3.811 3.269 4.576 1.00 . A A . 9 THR CG2 1 1 3 1455 1 1 9 THR H H -4.370 5.533 3.001 1.00 . A A . 9 THR H 1 1 3 1456 1 1 9 THR HA H -1.843 4.906 3.910 1.00 . A A . 9 THR HA 1 1 3 1457 1 1 9 THR HB H -2.389 2.634 3.149 1.00 . A A . 9 THR HB 1 1 3 1458 1 1 9 THR HG1 H -4.201 2.240 2.020 1.00 . A A . 9 THR HG1 1 1 3 1459 1 1 9 THR HG21 H -3.075 3.397 5.354 1.00 . A A . 9 THR HG21 1 1 3 1460 1 1 9 THR HG22 H -4.272 2.298 4.670 1.00 . A A . 9 THR HG22 1 1 3 1461 1 1 9 THR HG23 H -4.565 4.037 4.662 1.00 . A A . 9 THR HG23 1 1 3 1462 1 1 9 THR N N -3.439 5.790 3.046 1.00 . A A . 9 THR N 1 1 3 1463 1 1 9 THR O O -0.430 4.408 1.863 1.00 . A A . 9 THR O 1 1 3 1464 1 1 9 THR OG1 O -4.105 3.183 2.191 1.00 . A A . 9 THR OG1 1 1 3 1465 1 1 10 ILE C C -0.379 6.290 -0.260 1.00 . A A . 10 ILE C 1 1 3 1466 1 1 10 ILE CA C -1.547 5.378 -0.486 1.00 . A A . 10 ILE CA 1 1 3 1467 1 1 10 ILE CB C -2.484 5.984 -1.534 1.00 . A A . 10 ILE CB 1 1 3 1468 1 1 10 ILE CD1 C -4.484 5.475 -2.970 1.00 . A A . 10 ILE CD1 1 1 3 1469 1 1 10 ILE CG1 C -3.484 4.938 -1.992 1.00 . A A . 10 ILE CG1 1 1 3 1470 1 1 10 ILE CG2 C -1.701 6.517 -2.711 1.00 . A A . 10 ILE CG2 1 1 3 1471 1 1 10 ILE H H -3.179 5.370 0.823 1.00 . A A . 10 ILE H 1 1 3 1472 1 1 10 ILE HA H -1.205 4.435 -0.847 1.00 . A A . 10 ILE HA 1 1 3 1473 1 1 10 ILE HB H -3.016 6.806 -1.081 1.00 . A A . 10 ILE HB 1 1 3 1474 1 1 10 ILE HD11 H -3.965 5.874 -3.826 1.00 . A A . 10 ILE HD11 1 1 3 1475 1 1 10 ILE HD12 H -5.051 6.258 -2.492 1.00 . A A . 10 ILE HD12 1 1 3 1476 1 1 10 ILE HD13 H -5.144 4.681 -3.278 1.00 . A A . 10 ILE HD13 1 1 3 1477 1 1 10 ILE HG12 H -2.957 4.123 -2.467 1.00 . A A . 10 ILE HG12 1 1 3 1478 1 1 10 ILE HG13 H -4.021 4.565 -1.137 1.00 . A A . 10 ILE HG13 1 1 3 1479 1 1 10 ILE HG21 H -1.016 7.273 -2.366 1.00 . A A . 10 ILE HG21 1 1 3 1480 1 1 10 ILE HG22 H -2.384 6.944 -3.426 1.00 . A A . 10 ILE HG22 1 1 3 1481 1 1 10 ILE HG23 H -1.152 5.709 -3.168 1.00 . A A . 10 ILE HG23 1 1 3 1482 1 1 10 ILE N N -2.229 5.182 0.763 1.00 . A A . 10 ILE N 1 1 3 1483 1 1 10 ILE O O 0.760 5.910 -0.483 1.00 . A A . 10 ILE O 1 1 3 1484 1 1 11 LYS C C 1.321 7.992 1.579 1.00 . A A . 11 LYS C 1 1 3 1485 1 1 11 LYS CA C 0.321 8.451 0.544 1.00 . A A . 11 LYS CA 1 1 3 1486 1 1 11 LYS CB C -0.346 9.752 0.945 1.00 . A A . 11 LYS CB 1 1 3 1487 1 1 11 LYS CD C -2.216 11.327 0.394 1.00 . A A . 11 LYS CD 1 1 3 1488 1 1 11 LYS CE C -3.041 11.951 -0.717 1.00 . A A . 11 LYS CE 1 1 3 1489 1 1 11 LYS CG C -1.253 10.284 -0.145 1.00 . A A . 11 LYS CG 1 1 3 1490 1 1 11 LYS H H -1.600 7.635 0.530 1.00 . A A . 11 LYS H 1 1 3 1491 1 1 11 LYS HA H 0.850 8.610 -0.371 1.00 . A A . 11 LYS HA 1 1 3 1492 1 1 11 LYS HB2 H -0.932 9.585 1.830 1.00 . A A . 11 LYS HB2 1 1 3 1493 1 1 11 LYS HB3 H 0.412 10.493 1.152 1.00 . A A . 11 LYS HB3 1 1 3 1494 1 1 11 LYS HD2 H -2.883 10.855 1.100 1.00 . A A . 11 LYS HD2 1 1 3 1495 1 1 11 LYS HD3 H -1.652 12.101 0.892 1.00 . A A . 11 LYS HD3 1 1 3 1496 1 1 11 LYS HE2 H -2.378 12.473 -1.391 1.00 . A A . 11 LYS HE2 1 1 3 1497 1 1 11 LYS HE3 H -3.554 11.166 -1.253 1.00 . A A . 11 LYS HE3 1 1 3 1498 1 1 11 LYS HG2 H -0.646 10.731 -0.919 1.00 . A A . 11 LYS HG2 1 1 3 1499 1 1 11 LYS HG3 H -1.817 9.449 -0.557 1.00 . A A . 11 LYS HG3 1 1 3 1500 1 1 11 LYS HZ1 H -3.584 13.599 0.449 1.00 . A A . 11 LYS HZ1 1 1 3 1501 1 1 11 LYS HZ2 H -4.782 12.400 0.351 1.00 . A A . 11 LYS HZ2 1 1 3 1502 1 1 11 LYS HZ3 H -4.497 13.426 -0.967 1.00 . A A . 11 LYS HZ3 1 1 3 1503 1 1 11 LYS N N -0.672 7.448 0.284 1.00 . A A . 11 LYS N 1 1 3 1504 1 1 11 LYS NZ N -4.043 12.910 -0.185 1.00 . A A . 11 LYS NZ 1 1 3 1505 1 1 11 LYS O O 2.448 8.449 1.560 1.00 . A A . 11 LYS O 1 1 3 1506 1 1 12 GLN C C 2.886 5.696 2.734 1.00 . A A . 12 GLN C 1 1 3 1507 1 1 12 GLN CA C 1.817 6.543 3.436 1.00 . A A . 12 GLN CA 1 1 3 1508 1 1 12 GLN CB C 0.990 5.708 4.382 1.00 . A A . 12 GLN CB 1 1 3 1509 1 1 12 GLN CD C -0.361 7.475 5.565 1.00 . A A . 12 GLN CD 1 1 3 1510 1 1 12 GLN CG C 0.701 6.406 5.678 1.00 . A A . 12 GLN CG 1 1 3 1511 1 1 12 GLN H H -0.033 6.870 2.582 1.00 . A A . 12 GLN H 1 1 3 1512 1 1 12 GLN HA H 2.293 7.336 3.988 1.00 . A A . 12 GLN HA 1 1 3 1513 1 1 12 GLN HB2 H 0.041 5.482 3.913 1.00 . A A . 12 GLN HB2 1 1 3 1514 1 1 12 GLN HB3 H 1.500 4.804 4.578 1.00 . A A . 12 GLN HB3 1 1 3 1515 1 1 12 GLN HE21 H 1.023 8.841 5.152 1.00 . A A . 12 GLN HE21 1 1 3 1516 1 1 12 GLN HE22 H -0.610 9.400 5.177 1.00 . A A . 12 GLN HE22 1 1 3 1517 1 1 12 GLN HG2 H 0.378 5.676 6.391 1.00 . A A . 12 GLN HG2 1 1 3 1518 1 1 12 GLN HG3 H 1.608 6.868 6.008 1.00 . A A . 12 GLN HG3 1 1 3 1519 1 1 12 GLN N N 0.913 7.127 2.503 1.00 . A A . 12 GLN N 1 1 3 1520 1 1 12 GLN NE2 N 0.057 8.695 5.272 1.00 . A A . 12 GLN NE2 1 1 3 1521 1 1 12 GLN O O 4.058 5.689 3.113 1.00 . A A . 12 GLN O 1 1 3 1522 1 1 12 GLN OE1 O -1.548 7.208 5.758 1.00 . A A . 12 GLN OE1 1 1 3 1523 1 1 13 LEU C C 4.128 4.887 -0.081 1.00 . A A . 13 LEU C 1 1 3 1524 1 1 13 LEU CA C 3.396 4.130 0.998 1.00 . A A . 13 LEU CA 1 1 3 1525 1 1 13 LEU CB C 2.620 2.955 0.464 1.00 . A A . 13 LEU CB 1 1 3 1526 1 1 13 LEU CD1 C 1.157 1.001 1.056 1.00 . A A . 13 LEU CD1 1 1 3 1527 1 1 13 LEU CD2 C 2.823 1.850 2.698 1.00 . A A . 13 LEU CD2 1 1 3 1528 1 1 13 LEU CG C 1.877 2.229 1.570 1.00 . A A . 13 LEU CG 1 1 3 1529 1 1 13 LEU H H 1.579 5.093 1.370 1.00 . A A . 13 LEU H 1 1 3 1530 1 1 13 LEU HA H 4.105 3.770 1.721 1.00 . A A . 13 LEU HA 1 1 3 1531 1 1 13 LEU HB2 H 1.911 3.305 -0.273 1.00 . A A . 13 LEU HB2 1 1 3 1532 1 1 13 LEU HB3 H 3.298 2.278 0.006 1.00 . A A . 13 LEU HB3 1 1 3 1533 1 1 13 LEU HD11 H 0.606 0.539 1.870 1.00 . A A . 13 LEU HD11 1 1 3 1534 1 1 13 LEU HD12 H 1.878 0.298 0.665 1.00 . A A . 13 LEU HD12 1 1 3 1535 1 1 13 LEU HD13 H 0.470 1.285 0.274 1.00 . A A . 13 LEU HD13 1 1 3 1536 1 1 13 LEU HD21 H 3.622 1.236 2.308 1.00 . A A . 13 LEU HD21 1 1 3 1537 1 1 13 LEU HD22 H 2.280 1.298 3.453 1.00 . A A . 13 LEU HD22 1 1 3 1538 1 1 13 LEU HD23 H 3.238 2.746 3.136 1.00 . A A . 13 LEU HD23 1 1 3 1539 1 1 13 LEU HG H 1.150 2.914 1.969 1.00 . A A . 13 LEU HG 1 1 3 1540 1 1 13 LEU N N 2.494 5.009 1.687 1.00 . A A . 13 LEU N 1 1 3 1541 1 1 13 LEU O O 5.320 4.682 -0.303 1.00 . A A . 13 LEU O 1 1 3 1542 1 1 14 MET C C 5.086 7.538 -0.701 1.00 . A A . 14 MET C 1 1 3 1543 1 1 14 MET CA C 4.014 6.825 -1.519 1.00 . A A . 14 MET CA 1 1 3 1544 1 1 14 MET CB C 2.960 7.831 -1.926 1.00 . A A . 14 MET CB 1 1 3 1545 1 1 14 MET CE C 2.969 7.512 -5.006 1.00 . A A . 14 MET CE 1 1 3 1546 1 1 14 MET CG C 1.800 7.238 -2.694 1.00 . A A . 14 MET CG 1 1 3 1547 1 1 14 MET H H 2.426 5.747 -0.701 1.00 . A A . 14 MET H 1 1 3 1548 1 1 14 MET HA H 4.444 6.385 -2.398 1.00 . A A . 14 MET HA 1 1 3 1549 1 1 14 MET HB2 H 2.562 8.306 -1.040 1.00 . A A . 14 MET HB2 1 1 3 1550 1 1 14 MET HB3 H 3.439 8.556 -2.538 1.00 . A A . 14 MET HB3 1 1 3 1551 1 1 14 MET HE1 H 3.472 6.846 -4.292 1.00 . A A . 14 MET HE1 1 1 3 1552 1 1 14 MET HE2 H 3.610 8.344 -5.240 1.00 . A A . 14 MET HE2 1 1 3 1553 1 1 14 MET HE3 H 2.724 6.961 -5.905 1.00 . A A . 14 MET HE3 1 1 3 1554 1 1 14 MET HG2 H 2.030 6.208 -2.910 1.00 . A A . 14 MET HG2 1 1 3 1555 1 1 14 MET HG3 H 0.922 7.282 -2.089 1.00 . A A . 14 MET HG3 1 1 3 1556 1 1 14 MET N N 3.408 5.791 -0.731 1.00 . A A . 14 MET N 1 1 3 1557 1 1 14 MET O O 6.114 7.977 -1.214 1.00 . A A . 14 MET O 1 1 3 1558 1 1 14 MET SD S 1.490 8.082 -4.235 1.00 . A A . 14 MET SD 1 1 3 1559 1 1 15 ASP C C 7.004 7.616 1.715 1.00 . A A . 15 ASP C 1 1 3 1560 1 1 15 ASP CA C 5.653 8.296 1.561 1.00 . A A . 15 ASP CA 1 1 3 1561 1 1 15 ASP CB C 4.927 8.346 2.896 1.00 . A A . 15 ASP CB 1 1 3 1562 1 1 15 ASP CG C 5.763 8.927 4.018 1.00 . A A . 15 ASP CG 1 1 3 1563 1 1 15 ASP H H 3.966 7.230 0.900 1.00 . A A . 15 ASP H 1 1 3 1564 1 1 15 ASP HA H 5.812 9.305 1.216 1.00 . A A . 15 ASP HA 1 1 3 1565 1 1 15 ASP HB2 H 4.036 8.944 2.776 1.00 . A A . 15 ASP HB2 1 1 3 1566 1 1 15 ASP HB3 H 4.630 7.336 3.166 1.00 . A A . 15 ASP HB3 1 1 3 1567 1 1 15 ASP N N 4.806 7.626 0.588 1.00 . A A . 15 ASP N 1 1 3 1568 1 1 15 ASP O O 8.015 8.300 1.869 1.00 . A A . 15 ASP O 1 1 3 1569 1 1 15 ASP OD1 O 5.963 10.160 4.038 1.00 . A A . 15 ASP OD1 1 1 3 1570 1 1 15 ASP OD2 O 6.232 8.156 4.879 1.00 . A A . 15 ASP OD2 1 1 3 1571 1 1 16 LEU C C 9.107 5.944 0.428 1.00 . A A . 16 LEU C 1 1 3 1572 1 1 16 LEU CA C 8.300 5.595 1.673 1.00 . A A . 16 LEU CA 1 1 3 1573 1 1 16 LEU CB C 7.981 4.147 1.688 1.00 . A A . 16 LEU CB 1 1 3 1574 1 1 16 LEU CD1 C 8.631 4.095 4.088 1.00 . A A . 16 LEU CD1 1 1 3 1575 1 1 16 LEU CD2 C 6.246 3.814 3.410 1.00 . A A . 16 LEU CD2 1 1 3 1576 1 1 16 LEU CG C 7.678 3.571 3.031 1.00 . A A . 16 LEU CG 1 1 3 1577 1 1 16 LEU H H 6.231 5.714 1.707 1.00 . A A . 16 LEU H 1 1 3 1578 1 1 16 LEU HA H 8.851 5.834 2.563 1.00 . A A . 16 LEU HA 1 1 3 1579 1 1 16 LEU HB2 H 7.122 3.984 1.058 1.00 . A A . 16 LEU HB2 1 1 3 1580 1 1 16 LEU HB3 H 8.788 3.626 1.278 1.00 . A A . 16 LEU HB3 1 1 3 1581 1 1 16 LEU HD11 H 8.429 3.604 5.029 1.00 . A A . 16 LEU HD11 1 1 3 1582 1 1 16 LEU HD12 H 8.485 5.159 4.197 1.00 . A A . 16 LEU HD12 1 1 3 1583 1 1 16 LEU HD13 H 9.647 3.899 3.785 1.00 . A A . 16 LEU HD13 1 1 3 1584 1 1 16 LEU HD21 H 5.609 3.390 2.652 1.00 . A A . 16 LEU HD21 1 1 3 1585 1 1 16 LEU HD22 H 6.071 4.876 3.473 1.00 . A A . 16 LEU HD22 1 1 3 1586 1 1 16 LEU HD23 H 6.039 3.352 4.362 1.00 . A A . 16 LEU HD23 1 1 3 1587 1 1 16 LEU HG H 7.812 2.541 2.946 1.00 . A A . 16 LEU HG 1 1 3 1588 1 1 16 LEU N N 7.052 6.280 1.689 1.00 . A A . 16 LEU N 1 1 3 1589 1 1 16 LEU O O 10.331 5.827 0.399 1.00 . A A . 16 LEU O 1 1 3 1590 1 1 17 GLY C C 8.398 5.893 -2.978 1.00 . A A . 17 GLY C 1 1 3 1591 1 1 17 GLY CA C 8.993 6.715 -1.862 1.00 . A A . 17 GLY CA 1 1 3 1592 1 1 17 GLY H H 7.419 6.441 -0.480 1.00 . A A . 17 GLY H 1 1 3 1593 1 1 17 GLY HA2 H 8.826 7.763 -2.060 1.00 . A A . 17 GLY HA2 1 1 3 1594 1 1 17 GLY HA3 H 10.055 6.527 -1.811 1.00 . A A . 17 GLY HA3 1 1 3 1595 1 1 17 GLY N N 8.388 6.367 -0.593 1.00 . A A . 17 GLY N 1 1 3 1596 1 1 17 GLY O O 8.908 5.864 -4.098 1.00 . A A . 17 GLY O 1 1 3 1597 1 1 18 PHE C C 5.566 4.911 -4.350 1.00 . A A . 18 PHE C 1 1 3 1598 1 1 18 PHE CA C 6.684 4.281 -3.565 1.00 . A A . 18 PHE CA 1 1 3 1599 1 1 18 PHE CB C 6.176 3.122 -2.750 1.00 . A A . 18 PHE CB 1 1 3 1600 1 1 18 PHE CD1 C 8.412 2.043 -2.808 1.00 . A A . 18 PHE CD1 1 1 3 1601 1 1 18 PHE CD2 C 7.227 2.278 -0.799 1.00 . A A . 18 PHE CD2 1 1 3 1602 1 1 18 PHE CE1 C 9.449 1.452 -2.132 1.00 . A A . 18 PHE CE1 1 1 3 1603 1 1 18 PHE CE2 C 8.226 1.718 -0.124 1.00 . A A . 18 PHE CE2 1 1 3 1604 1 1 18 PHE CG C 7.291 2.450 -2.111 1.00 . A A . 18 PHE CG 1 1 3 1605 1 1 18 PHE CZ C 9.344 1.296 -0.771 1.00 . A A . 18 PHE CZ 1 1 3 1606 1 1 18 PHE H H 6.899 5.357 -1.774 1.00 . A A . 18 PHE H 1 1 3 1607 1 1 18 PHE HA H 7.441 3.919 -4.237 1.00 . A A . 18 PHE HA 1 1 3 1608 1 1 18 PHE HB2 H 5.527 3.496 -1.974 1.00 . A A . 18 PHE HB2 1 1 3 1609 1 1 18 PHE HB3 H 5.650 2.409 -3.333 1.00 . A A . 18 PHE HB3 1 1 3 1610 1 1 18 PHE HD1 H 8.463 2.180 -3.879 1.00 . A A . 18 PHE HD1 1 1 3 1611 1 1 18 PHE HD2 H 6.358 2.588 -0.294 1.00 . A A . 18 PHE HD2 1 1 3 1612 1 1 18 PHE HE1 H 10.333 1.120 -2.658 1.00 . A A . 18 PHE HE1 1 1 3 1613 1 1 18 PHE HE2 H 8.124 1.604 0.915 1.00 . A A . 18 PHE HE2 1 1 3 1614 1 1 18 PHE HZ H 10.119 0.858 -0.217 1.00 . A A . 18 PHE HZ 1 1 3 1615 1 1 18 PHE N N 7.304 5.222 -2.660 1.00 . A A . 18 PHE N 1 1 3 1616 1 1 18 PHE O O 5.121 6.000 -4.034 1.00 . A A . 18 PHE O 1 1 3 1617 1 1 19 PRO C C 2.664 4.271 -5.625 1.00 . A A . 19 PRO C 1 1 3 1618 1 1 19 PRO CA C 4.013 4.626 -6.235 1.00 . A A . 19 PRO CA 1 1 3 1619 1 1 19 PRO CB C 4.232 3.811 -7.487 1.00 . A A . 19 PRO CB 1 1 3 1620 1 1 19 PRO CD C 5.744 2.987 -5.905 1.00 . A A . 19 PRO CD 1 1 3 1621 1 1 19 PRO CG C 4.776 2.560 -6.973 1.00 . A A . 19 PRO CG 1 1 3 1622 1 1 19 PRO HA H 4.038 5.677 -6.477 1.00 . A A . 19 PRO HA 1 1 3 1623 1 1 19 PRO HB2 H 3.304 3.664 -8.009 1.00 . A A . 19 PRO HB2 1 1 3 1624 1 1 19 PRO HB3 H 4.946 4.295 -8.119 1.00 . A A . 19 PRO HB3 1 1 3 1625 1 1 19 PRO HD2 H 5.802 2.256 -5.106 1.00 . A A . 19 PRO HD2 1 1 3 1626 1 1 19 PRO HD3 H 6.716 3.173 -6.330 1.00 . A A . 19 PRO HD3 1 1 3 1627 1 1 19 PRO HG2 H 3.986 1.946 -6.561 1.00 . A A . 19 PRO HG2 1 1 3 1628 1 1 19 PRO HG3 H 5.275 2.065 -7.762 1.00 . A A . 19 PRO HG3 1 1 3 1629 1 1 19 PRO N N 5.142 4.233 -5.408 1.00 . A A . 19 PRO N 1 1 3 1630 1 1 19 PRO O O 2.565 3.532 -4.646 1.00 . A A . 19 PRO O 1 1 3 1631 1 1 20 ARG C C 0.028 3.019 -6.152 1.00 . A A . 20 ARG C 1 1 3 1632 1 1 20 ARG CA C 0.263 4.494 -5.908 1.00 . A A . 20 ARG CA 1 1 3 1633 1 1 20 ARG CB C -0.652 5.325 -6.797 1.00 . A A . 20 ARG CB 1 1 3 1634 1 1 20 ARG CD C -2.928 5.720 -7.736 1.00 . A A . 20 ARG CD 1 1 3 1635 1 1 20 ARG CG C -2.078 4.841 -6.838 1.00 . A A . 20 ARG CG 1 1 3 1636 1 1 20 ARG CZ C -5.143 5.636 -8.805 1.00 . A A . 20 ARG CZ 1 1 3 1637 1 1 20 ARG H H 1.828 5.431 -6.965 1.00 . A A . 20 ARG H 1 1 3 1638 1 1 20 ARG HA H 0.081 4.722 -4.870 1.00 . A A . 20 ARG HA 1 1 3 1639 1 1 20 ARG HB2 H -0.646 6.338 -6.445 1.00 . A A . 20 ARG HB2 1 1 3 1640 1 1 20 ARG HB3 H -0.266 5.305 -7.801 1.00 . A A . 20 ARG HB3 1 1 3 1641 1 1 20 ARG HD2 H -2.925 6.722 -7.339 1.00 . A A . 20 ARG HD2 1 1 3 1642 1 1 20 ARG HD3 H -2.491 5.728 -8.724 1.00 . A A . 20 ARG HD3 1 1 3 1643 1 1 20 ARG HE H -4.634 4.634 -7.150 1.00 . A A . 20 ARG HE 1 1 3 1644 1 1 20 ARG HG2 H -2.090 3.832 -7.220 1.00 . A A . 20 ARG HG2 1 1 3 1645 1 1 20 ARG HG3 H -2.470 4.858 -5.844 1.00 . A A . 20 ARG HG3 1 1 3 1646 1 1 20 ARG HH11 H -3.790 6.841 -9.731 1.00 . A A . 20 ARG HH11 1 1 3 1647 1 1 20 ARG HH12 H -5.353 6.752 -10.494 1.00 . A A . 20 ARG HH12 1 1 3 1648 1 1 20 ARG HH21 H -6.700 4.536 -8.113 1.00 . A A . 20 ARG HH21 1 1 3 1649 1 1 20 ARG HH22 H -7.022 5.470 -9.551 1.00 . A A . 20 ARG HH22 1 1 3 1650 1 1 20 ARG N N 1.641 4.813 -6.234 1.00 . A A . 20 ARG N 1 1 3 1651 1 1 20 ARG NE N -4.311 5.256 -7.838 1.00 . A A . 20 ARG NE 1 1 3 1652 1 1 20 ARG NH1 N -4.732 6.479 -9.749 1.00 . A A . 20 ARG NH1 1 1 3 1653 1 1 20 ARG NH2 N -6.385 5.176 -8.828 1.00 . A A . 20 ARG NH2 1 1 3 1654 1 1 20 ARG O O -0.637 2.328 -5.382 1.00 . A A . 20 ARG O 1 1 3 1655 1 1 21 ASP C C 1.189 0.292 -6.507 1.00 . A A . 21 ASP C 1 1 3 1656 1 1 21 ASP CA C 0.591 1.155 -7.609 1.00 . A A . 21 ASP CA 1 1 3 1657 1 1 21 ASP CB C 1.370 0.943 -8.907 1.00 . A A . 21 ASP CB 1 1 3 1658 1 1 21 ASP CG C 0.826 1.780 -10.046 1.00 . A A . 21 ASP CG 1 1 3 1659 1 1 21 ASP H H 1.050 3.207 -7.830 1.00 . A A . 21 ASP H 1 1 3 1660 1 1 21 ASP HA H -0.437 0.863 -7.765 1.00 . A A . 21 ASP HA 1 1 3 1661 1 1 21 ASP HB2 H 2.404 1.210 -8.749 1.00 . A A . 21 ASP HB2 1 1 3 1662 1 1 21 ASP HB3 H 1.311 -0.099 -9.189 1.00 . A A . 21 ASP HB3 1 1 3 1663 1 1 21 ASP N N 0.607 2.562 -7.239 1.00 . A A . 21 ASP N 1 1 3 1664 1 1 21 ASP O O 0.839 -0.879 -6.373 1.00 . A A . 21 ASP O 1 1 3 1665 1 1 21 ASP OD1 O 1.282 2.929 -10.212 1.00 . A A . 21 ASP OD1 1 1 3 1666 1 1 21 ASP OD2 O -0.069 1.295 -10.772 1.00 . A A . 21 ASP OD2 1 1 3 1667 1 1 22 ALA C C 1.698 -0.125 -3.506 1.00 . A A . 22 ALA C 1 1 3 1668 1 1 22 ALA CA C 2.699 0.123 -4.616 1.00 . A A . 22 ALA CA 1 1 3 1669 1 1 22 ALA CB C 3.921 0.835 -4.068 1.00 . A A . 22 ALA CB 1 1 3 1670 1 1 22 ALA H H 2.301 1.830 -5.821 1.00 . A A . 22 ALA H 1 1 3 1671 1 1 22 ALA HA H 3.016 -0.830 -5.016 1.00 . A A . 22 ALA HA 1 1 3 1672 1 1 22 ALA HB1 H 4.364 0.236 -3.286 1.00 . A A . 22 ALA HB1 1 1 3 1673 1 1 22 ALA HB2 H 3.631 1.794 -3.667 1.00 . A A . 22 ALA HB2 1 1 3 1674 1 1 22 ALA HB3 H 4.641 0.978 -4.861 1.00 . A A . 22 ALA HB3 1 1 3 1675 1 1 22 ALA N N 2.078 0.874 -5.699 1.00 . A A . 22 ALA N 1 1 3 1676 1 1 22 ALA O O 1.766 -1.143 -2.825 1.00 . A A . 22 ALA O 1 1 3 1677 1 1 23 VAL C C -1.144 -0.542 -2.861 1.00 . A A . 23 VAL C 1 1 3 1678 1 1 23 VAL CA C -0.305 0.613 -2.377 1.00 . A A . 23 VAL CA 1 1 3 1679 1 1 23 VAL CB C -1.162 1.900 -2.192 1.00 . A A . 23 VAL CB 1 1 3 1680 1 1 23 VAL CG1 C -2.516 1.794 -2.843 1.00 . A A . 23 VAL CG1 1 1 3 1681 1 1 23 VAL CG2 C -1.335 2.219 -0.734 1.00 . A A . 23 VAL CG2 1 1 3 1682 1 1 23 VAL H H 0.768 1.618 -3.873 1.00 . A A . 23 VAL H 1 1 3 1683 1 1 23 VAL HA H 0.119 0.350 -1.434 1.00 . A A . 23 VAL HA 1 1 3 1684 1 1 23 VAL HB H -0.639 2.719 -2.654 1.00 . A A . 23 VAL HB 1 1 3 1685 1 1 23 VAL HG11 H -3.038 0.945 -2.425 1.00 . A A . 23 VAL HG11 1 1 3 1686 1 1 23 VAL HG12 H -2.373 1.651 -3.901 1.00 . A A . 23 VAL HG12 1 1 3 1687 1 1 23 VAL HG13 H -3.083 2.694 -2.662 1.00 . A A . 23 VAL HG13 1 1 3 1688 1 1 23 VAL HG21 H -0.532 2.878 -0.411 1.00 . A A . 23 VAL HG21 1 1 3 1689 1 1 23 VAL HG22 H -1.316 1.304 -0.165 1.00 . A A . 23 VAL HG22 1 1 3 1690 1 1 23 VAL HG23 H -2.296 2.704 -0.592 1.00 . A A . 23 VAL HG23 1 1 3 1691 1 1 23 VAL N N 0.758 0.805 -3.332 1.00 . A A . 23 VAL N 1 1 3 1692 1 1 23 VAL O O -1.363 -1.510 -2.178 1.00 . A A . 23 VAL O 1 1 3 1693 1 1 24 VAL C C -1.782 -2.856 -4.609 1.00 . A A . 24 VAL C 1 1 3 1694 1 1 24 VAL CA C -2.406 -1.471 -4.623 1.00 . A A . 24 VAL CA 1 1 3 1695 1 1 24 VAL CB C -2.870 -1.073 -6.019 1.00 . A A . 24 VAL CB 1 1 3 1696 1 1 24 VAL CG1 C -3.462 -2.265 -6.752 1.00 . A A . 24 VAL CG1 1 1 3 1697 1 1 24 VAL CG2 C -3.890 0.043 -5.903 1.00 . A A . 24 VAL CG2 1 1 3 1698 1 1 24 VAL H H -1.269 0.303 -4.623 1.00 . A A . 24 VAL H 1 1 3 1699 1 1 24 VAL HA H -3.270 -1.507 -3.978 1.00 . A A . 24 VAL HA 1 1 3 1700 1 1 24 VAL HB H -2.010 -0.697 -6.564 1.00 . A A . 24 VAL HB 1 1 3 1701 1 1 24 VAL HG11 H -3.829 -1.952 -7.719 1.00 . A A . 24 VAL HG11 1 1 3 1702 1 1 24 VAL HG12 H -4.278 -2.671 -6.168 1.00 . A A . 24 VAL HG12 1 1 3 1703 1 1 24 VAL HG13 H -2.701 -3.021 -6.878 1.00 . A A . 24 VAL HG13 1 1 3 1704 1 1 24 VAL HG21 H -4.298 0.265 -6.877 1.00 . A A . 24 VAL HG21 1 1 3 1705 1 1 24 VAL HG22 H -3.414 0.922 -5.498 1.00 . A A . 24 VAL HG22 1 1 3 1706 1 1 24 VAL HG23 H -4.686 -0.274 -5.238 1.00 . A A . 24 VAL HG23 1 1 3 1707 1 1 24 VAL N N -1.535 -0.472 -4.084 1.00 . A A . 24 VAL N 1 1 3 1708 1 1 24 VAL O O -2.387 -3.776 -4.084 1.00 . A A . 24 VAL O 1 1 3 1709 1 1 25 LYS C C 0.205 -4.884 -3.759 1.00 . A A . 25 LYS C 1 1 3 1710 1 1 25 LYS CA C 0.047 -4.315 -5.160 1.00 . A A . 25 LYS CA 1 1 3 1711 1 1 25 LYS CB C 1.402 -4.245 -5.850 1.00 . A A . 25 LYS CB 1 1 3 1712 1 1 25 LYS CD C 2.686 -3.760 -7.929 1.00 . A A . 25 LYS CD 1 1 3 1713 1 1 25 LYS CE C 2.628 -3.565 -9.434 1.00 . A A . 25 LYS CE 1 1 3 1714 1 1 25 LYS CG C 1.310 -3.940 -7.332 1.00 . A A . 25 LYS CG 1 1 3 1715 1 1 25 LYS H H -0.069 -2.220 -5.436 1.00 . A A . 25 LYS H 1 1 3 1716 1 1 25 LYS HA H -0.603 -4.965 -5.728 1.00 . A A . 25 LYS HA 1 1 3 1717 1 1 25 LYS HB2 H 1.994 -3.473 -5.381 1.00 . A A . 25 LYS HB2 1 1 3 1718 1 1 25 LYS HB3 H 1.902 -5.194 -5.731 1.00 . A A . 25 LYS HB3 1 1 3 1719 1 1 25 LYS HD2 H 3.133 -2.886 -7.480 1.00 . A A . 25 LYS HD2 1 1 3 1720 1 1 25 LYS HD3 H 3.285 -4.631 -7.706 1.00 . A A . 25 LYS HD3 1 1 3 1721 1 1 25 LYS HE2 H 1.937 -4.281 -9.852 1.00 . A A . 25 LYS HE2 1 1 3 1722 1 1 25 LYS HE3 H 2.281 -2.564 -9.642 1.00 . A A . 25 LYS HE3 1 1 3 1723 1 1 25 LYS HG2 H 0.812 -4.758 -7.833 1.00 . A A . 25 LYS HG2 1 1 3 1724 1 1 25 LYS HG3 H 0.743 -3.030 -7.469 1.00 . A A . 25 LYS HG3 1 1 3 1725 1 1 25 LYS HZ1 H 3.934 -3.464 -11.063 1.00 . A A . 25 LYS HZ1 1 1 3 1726 1 1 25 LYS HZ2 H 4.239 -4.760 -10.012 1.00 . A A . 25 LYS HZ2 1 1 3 1727 1 1 25 LYS HZ3 H 4.679 -3.187 -9.564 1.00 . A A . 25 LYS HZ3 1 1 3 1728 1 1 25 LYS N N -0.568 -3.003 -5.110 1.00 . A A . 25 LYS N 1 1 3 1729 1 1 25 LYS NZ N 3.960 -3.754 -10.062 1.00 . A A . 25 LYS NZ 1 1 3 1730 1 1 25 LYS O O -0.024 -6.068 -3.531 1.00 . A A . 25 LYS O 1 1 3 1731 1 1 26 ALA C C -0.398 -4.708 -0.683 1.00 . A A . 26 ALA C 1 1 3 1732 1 1 26 ALA CA C 0.862 -4.480 -1.477 1.00 . A A . 26 ALA CA 1 1 3 1733 1 1 26 ALA CB C 1.747 -3.476 -0.779 1.00 . A A . 26 ALA CB 1 1 3 1734 1 1 26 ALA H H 0.538 -3.057 -2.996 1.00 . A A . 26 ALA H 1 1 3 1735 1 1 26 ALA HA H 1.397 -5.415 -1.556 1.00 . A A . 26 ALA HA 1 1 3 1736 1 1 26 ALA HB1 H 2.004 -3.843 0.203 1.00 . A A . 26 ALA HB1 1 1 3 1737 1 1 26 ALA HB2 H 1.222 -2.536 -0.686 1.00 . A A . 26 ALA HB2 1 1 3 1738 1 1 26 ALA HB3 H 2.649 -3.328 -1.355 1.00 . A A . 26 ALA HB3 1 1 3 1739 1 1 26 ALA N N 0.550 -4.026 -2.810 1.00 . A A . 26 ALA N 1 1 3 1740 1 1 26 ALA O O -0.518 -5.686 0.053 1.00 . A A . 26 ALA O 1 1 3 1741 1 1 27 LEU C C -3.446 -4.919 -0.683 1.00 . A A . 27 LEU C 1 1 3 1742 1 1 27 LEU CA C -2.560 -3.840 -0.097 1.00 . A A . 27 LEU CA 1 1 3 1743 1 1 27 LEU CB C -3.243 -2.476 -0.122 1.00 . A A . 27 LEU CB 1 1 3 1744 1 1 27 LEU CD1 C -2.911 -1.400 2.099 1.00 . A A . 27 LEU CD1 1 1 3 1745 1 1 27 LEU CD2 C -1.093 -1.392 0.491 1.00 . A A . 27 LEU CD2 1 1 3 1746 1 1 27 LEU CG C -2.568 -1.342 0.643 1.00 . A A . 27 LEU CG 1 1 3 1747 1 1 27 LEU H H -1.196 -3.039 -1.461 1.00 . A A . 27 LEU H 1 1 3 1748 1 1 27 LEU HA H -2.324 -4.095 0.926 1.00 . A A . 27 LEU HA 1 1 3 1749 1 1 27 LEU HB2 H -3.314 -2.166 -1.144 1.00 . A A . 27 LEU HB2 1 1 3 1750 1 1 27 LEU HB3 H -4.243 -2.594 0.270 1.00 . A A . 27 LEU HB3 1 1 3 1751 1 1 27 LEU HD11 H -3.982 -1.358 2.210 1.00 . A A . 27 LEU HD11 1 1 3 1752 1 1 27 LEU HD12 H -2.456 -0.566 2.610 1.00 . A A . 27 LEU HD12 1 1 3 1753 1 1 27 LEU HD13 H -2.542 -2.326 2.507 1.00 . A A . 27 LEU HD13 1 1 3 1754 1 1 27 LEU HD21 H -0.731 -2.307 0.934 1.00 . A A . 27 LEU HD21 1 1 3 1755 1 1 27 LEU HD22 H -0.645 -0.545 0.982 1.00 . A A . 27 LEU HD22 1 1 3 1756 1 1 27 LEU HD23 H -0.854 -1.382 -0.560 1.00 . A A . 27 LEU HD23 1 1 3 1757 1 1 27 LEU HG H -2.890 -0.413 0.238 1.00 . A A . 27 LEU HG 1 1 3 1758 1 1 27 LEU N N -1.335 -3.798 -0.834 1.00 . A A . 27 LEU N 1 1 3 1759 1 1 27 LEU O O -4.288 -5.459 -0.013 1.00 . A A . 27 LEU O 1 1 3 1760 1 1 28 LYS C C -3.355 -7.648 -1.848 1.00 . A A . 28 LYS C 1 1 3 1761 1 1 28 LYS CA C -3.889 -6.387 -2.535 1.00 . A A . 28 LYS CA 1 1 3 1762 1 1 28 LYS CB C -3.644 -6.479 -4.049 1.00 . A A . 28 LYS CB 1 1 3 1763 1 1 28 LYS CD C -5.925 -6.044 -4.771 1.00 . A A . 28 LYS CD 1 1 3 1764 1 1 28 LYS CE C -6.190 -7.295 -5.591 1.00 . A A . 28 LYS CE 1 1 3 1765 1 1 28 LYS CG C -4.520 -5.586 -4.894 1.00 . A A . 28 LYS CG 1 1 3 1766 1 1 28 LYS H H -2.800 -4.575 -2.539 1.00 . A A . 28 LYS H 1 1 3 1767 1 1 28 LYS HA H -4.945 -6.319 -2.345 1.00 . A A . 28 LYS HA 1 1 3 1768 1 1 28 LYS HB2 H -2.653 -6.206 -4.238 1.00 . A A . 28 LYS HB2 1 1 3 1769 1 1 28 LYS HB3 H -3.796 -7.499 -4.368 1.00 . A A . 28 LYS HB3 1 1 3 1770 1 1 28 LYS HD2 H -6.052 -6.275 -3.740 1.00 . A A . 28 LYS HD2 1 1 3 1771 1 1 28 LYS HD3 H -6.598 -5.255 -5.073 1.00 . A A . 28 LYS HD3 1 1 3 1772 1 1 28 LYS HE2 H -5.908 -7.104 -6.617 1.00 . A A . 28 LYS HE2 1 1 3 1773 1 1 28 LYS HE3 H -5.588 -8.102 -5.198 1.00 . A A . 28 LYS HE3 1 1 3 1774 1 1 28 LYS HG2 H -4.446 -4.564 -4.537 1.00 . A A . 28 LYS HG2 1 1 3 1775 1 1 28 LYS HG3 H -4.211 -5.645 -5.928 1.00 . A A . 28 LYS HG3 1 1 3 1776 1 1 28 LYS HZ1 H -7.941 -7.791 -4.560 1.00 . A A . 28 LYS HZ1 1 1 3 1777 1 1 28 LYS HZ2 H -7.751 -8.607 -6.036 1.00 . A A . 28 LYS HZ2 1 1 3 1778 1 1 28 LYS HZ3 H -8.206 -6.976 -6.026 1.00 . A A . 28 LYS HZ3 1 1 3 1779 1 1 28 LYS N N -3.287 -5.198 -1.961 1.00 . A A . 28 LYS N 1 1 3 1780 1 1 28 LYS NZ N -7.620 -7.694 -5.549 1.00 . A A . 28 LYS NZ 1 1 3 1781 1 1 28 LYS O O -4.128 -8.544 -1.512 1.00 . A A . 28 LYS O 1 1 3 1782 1 1 29 GLN C C -1.821 -8.973 0.485 1.00 . A A . 29 GLN C 1 1 3 1783 1 1 29 GLN CA C -1.439 -8.868 -0.992 1.00 . A A . 29 GLN CA 1 1 3 1784 1 1 29 GLN CB C 0.065 -8.749 -1.157 1.00 . A A . 29 GLN CB 1 1 3 1785 1 1 29 GLN CD C 1.968 -8.509 -2.850 1.00 . A A . 29 GLN CD 1 1 3 1786 1 1 29 GLN CG C 0.501 -8.824 -2.604 1.00 . A A . 29 GLN CG 1 1 3 1787 1 1 29 GLN H H -1.438 -6.975 -1.894 1.00 . A A . 29 GLN H 1 1 3 1788 1 1 29 GLN HA H -1.782 -9.750 -1.511 1.00 . A A . 29 GLN HA 1 1 3 1789 1 1 29 GLN HB2 H 0.377 -7.813 -0.759 1.00 . A A . 29 GLN HB2 1 1 3 1790 1 1 29 GLN HB3 H 0.537 -9.535 -0.617 1.00 . A A . 29 GLN HB3 1 1 3 1791 1 1 29 GLN HE21 H 1.989 -7.096 -1.456 1.00 . A A . 29 GLN HE21 1 1 3 1792 1 1 29 GLN HE22 H 3.448 -7.325 -2.302 1.00 . A A . 29 GLN HE22 1 1 3 1793 1 1 29 GLN HG2 H 0.309 -9.814 -2.953 1.00 . A A . 29 GLN HG2 1 1 3 1794 1 1 29 GLN HG3 H -0.096 -8.122 -3.170 1.00 . A A . 29 GLN HG3 1 1 3 1795 1 1 29 GLN N N -2.038 -7.714 -1.619 1.00 . A A . 29 GLN N 1 1 3 1796 1 1 29 GLN NE2 N 2.525 -7.552 -2.122 1.00 . A A . 29 GLN NE2 1 1 3 1797 1 1 29 GLN O O -1.894 -10.068 1.043 1.00 . A A . 29 GLN O 1 1 3 1798 1 1 29 GLN OE1 O 2.591 -9.101 -3.730 1.00 . A A . 29 GLN OE1 1 1 3 1799 1 1 30 THR C C -3.854 -7.568 2.801 1.00 . A A . 30 THR C 1 1 3 1800 1 1 30 THR CA C -2.367 -7.769 2.526 1.00 . A A . 30 THR CA 1 1 3 1801 1 1 30 THR CB C -1.604 -6.603 3.142 1.00 . A A . 30 THR CB 1 1 3 1802 1 1 30 THR CG2 C -0.115 -6.854 3.094 1.00 . A A . 30 THR CG2 1 1 3 1803 1 1 30 THR H H -2.006 -6.988 0.618 1.00 . A A . 30 THR H 1 1 3 1804 1 1 30 THR HA H -2.033 -8.683 2.993 1.00 . A A . 30 THR HA 1 1 3 1805 1 1 30 THR HB H -1.911 -6.494 4.161 1.00 . A A . 30 THR HB 1 1 3 1806 1 1 30 THR HG1 H -1.201 -5.212 1.801 1.00 . A A . 30 THR HG1 1 1 3 1807 1 1 30 THR HG21 H 0.195 -6.957 2.063 1.00 . A A . 30 THR HG21 1 1 3 1808 1 1 30 THR HG22 H 0.116 -7.760 3.634 1.00 . A A . 30 THR HG22 1 1 3 1809 1 1 30 THR HG23 H 0.404 -6.020 3.547 1.00 . A A . 30 THR HG23 1 1 3 1810 1 1 30 THR N N -2.068 -7.829 1.110 1.00 . A A . 30 THR N 1 1 3 1811 1 1 30 THR O O -4.319 -7.707 3.933 1.00 . A A . 30 THR O 1 1 3 1812 1 1 30 THR OG1 O -1.908 -5.395 2.432 1.00 . A A . 30 THR OG1 1 1 3 1813 1 1 31 ASN C C -6.196 -5.528 2.537 1.00 . A A . 31 ASN C 1 1 3 1814 1 1 31 ASN CA C -5.988 -6.858 1.811 1.00 . A A . 31 ASN CA 1 1 3 1815 1 1 31 ASN CB C -6.843 -7.963 2.440 1.00 . A A . 31 ASN CB 1 1 3 1816 1 1 31 ASN CG C -7.213 -9.054 1.450 1.00 . A A . 31 ASN CG 1 1 3 1817 1 1 31 ASN H H -4.132 -7.202 0.872 1.00 . A A . 31 ASN H 1 1 3 1818 1 1 31 ASN HA H -6.314 -6.720 0.789 1.00 . A A . 31 ASN HA 1 1 3 1819 1 1 31 ASN HB2 H -6.293 -8.414 3.251 1.00 . A A . 31 ASN HB2 1 1 3 1820 1 1 31 ASN HB3 H -7.753 -7.529 2.826 1.00 . A A . 31 ASN HB3 1 1 3 1821 1 1 31 ASN HD21 H -5.519 -8.786 0.455 1.00 . A A . 31 ASN HD21 1 1 3 1822 1 1 31 ASN HD22 H -6.572 -9.999 -0.177 1.00 . A A . 31 ASN HD22 1 1 3 1823 1 1 31 ASN N N -4.576 -7.227 1.746 1.00 . A A . 31 ASN N 1 1 3 1824 1 1 31 ASN ND2 N -6.346 -9.306 0.482 1.00 . A A . 31 ASN ND2 1 1 3 1825 1 1 31 ASN O O -7.023 -5.423 3.445 1.00 . A A . 31 ASN O 1 1 3 1826 1 1 31 ASN OD1 O -8.274 -9.669 1.559 1.00 . A A . 31 ASN OD1 1 1 3 1827 1 1 32 GLY C C -5.166 -2.754 3.925 1.00 . A A . 32 GLY C 1 1 3 1828 1 1 32 GLY CA C -5.724 -3.159 2.554 1.00 . A A . 32 GLY CA 1 1 3 1829 1 1 32 GLY H H -4.758 -4.642 1.416 1.00 . A A . 32 GLY H 1 1 3 1830 1 1 32 GLY HA2 H -5.315 -2.488 1.806 1.00 . A A . 32 GLY HA2 1 1 3 1831 1 1 32 GLY HA3 H -6.798 -3.022 2.570 1.00 . A A . 32 GLY HA3 1 1 3 1832 1 1 32 GLY N N -5.459 -4.499 2.107 1.00 . A A . 32 GLY N 1 1 3 1833 1 1 32 GLY O O -5.490 -1.664 4.390 1.00 . A A . 32 GLY O 1 1 3 1834 1 1 33 ASN C C -2.350 -2.573 5.658 1.00 . A A . 33 ASN C 1 1 3 1835 1 1 33 ASN CA C -3.778 -3.116 5.859 1.00 . A A . 33 ASN CA 1 1 3 1836 1 1 33 ASN CB C -3.909 -4.197 6.945 1.00 . A A . 33 ASN CB 1 1 3 1837 1 1 33 ASN CG C -2.919 -5.343 6.899 1.00 . A A . 33 ASN CG 1 1 3 1838 1 1 33 ASN H H -4.192 -4.489 4.314 1.00 . A A . 33 ASN H 1 1 3 1839 1 1 33 ASN HA H -4.379 -2.282 6.163 1.00 . A A . 33 ASN HA 1 1 3 1840 1 1 33 ASN HB2 H -3.817 -3.726 7.891 1.00 . A A . 33 ASN HB2 1 1 3 1841 1 1 33 ASN HB3 H -4.898 -4.618 6.863 1.00 . A A . 33 ASN HB3 1 1 3 1842 1 1 33 ASN HD21 H -2.592 -5.046 4.985 1.00 . A A . 33 ASN HD21 1 1 3 1843 1 1 33 ASN HD22 H -1.748 -6.374 5.697 1.00 . A A . 33 ASN HD22 1 1 3 1844 1 1 33 ASN N N -4.358 -3.576 4.608 1.00 . A A . 33 ASN N 1 1 3 1845 1 1 33 ASN ND2 N -2.362 -5.610 5.748 1.00 . A A . 33 ASN ND2 1 1 3 1846 1 1 33 ASN O O -1.492 -3.221 5.065 1.00 . A A . 33 ASN O 1 1 3 1847 1 1 33 ASN OD1 O -2.643 -5.972 7.923 1.00 . A A . 33 ASN OD1 1 1 3 1848 1 1 34 ALA C C 0.371 -0.897 6.218 1.00 . A A . 34 ALA C 1 1 3 1849 1 1 34 ALA CA C -1.011 -0.503 5.702 1.00 . A A . 34 ALA CA 1 1 3 1850 1 1 34 ALA CB C -1.299 0.947 6.052 1.00 . A A . 34 ALA CB 1 1 3 1851 1 1 34 ALA H H -2.778 -0.973 6.786 1.00 . A A . 34 ALA H 1 1 3 1852 1 1 34 ALA HA H -0.974 -0.568 4.628 1.00 . A A . 34 ALA HA 1 1 3 1853 1 1 34 ALA HB1 H -1.246 1.076 7.122 1.00 . A A . 34 ALA HB1 1 1 3 1854 1 1 34 ALA HB2 H -2.290 1.209 5.707 1.00 . A A . 34 ALA HB2 1 1 3 1855 1 1 34 ALA HB3 H -0.570 1.585 5.575 1.00 . A A . 34 ALA HB3 1 1 3 1856 1 1 34 ALA N N -2.132 -1.347 6.140 1.00 . A A . 34 ALA N 1 1 3 1857 1 1 34 ALA O O 1.354 -0.724 5.501 1.00 . A A . 34 ALA O 1 1 3 1858 1 1 35 GLU C C 2.324 -2.914 7.160 1.00 . A A . 35 GLU C 1 1 3 1859 1 1 35 GLU CA C 1.766 -1.768 7.942 1.00 . A A . 35 GLU CA 1 1 3 1860 1 1 35 GLU CB C 1.596 -2.137 9.383 1.00 . A A . 35 GLU CB 1 1 3 1861 1 1 35 GLU CD C 3.896 -2.048 10.379 1.00 . A A . 35 GLU CD 1 1 3 1862 1 1 35 GLU CG C 2.525 -1.414 10.289 1.00 . A A . 35 GLU CG 1 1 3 1863 1 1 35 GLU H H -0.271 -1.492 8.013 1.00 . A A . 35 GLU H 1 1 3 1864 1 1 35 GLU HA H 2.385 -0.949 7.858 1.00 . A A . 35 GLU HA 1 1 3 1865 1 1 35 GLU HB2 H 0.598 -1.893 9.678 1.00 . A A . 35 GLU HB2 1 1 3 1866 1 1 35 GLU HB3 H 1.745 -3.186 9.493 1.00 . A A . 35 GLU HB3 1 1 3 1867 1 1 35 GLU HG2 H 2.623 -0.417 9.917 1.00 . A A . 35 GLU HG2 1 1 3 1868 1 1 35 GLU HG3 H 2.076 -1.388 11.250 1.00 . A A . 35 GLU HG3 1 1 3 1869 1 1 35 GLU N N 0.489 -1.393 7.434 1.00 . A A . 35 GLU N 1 1 3 1870 1 1 35 GLU O O 3.461 -2.916 6.656 1.00 . A A . 35 GLU O 1 1 3 1871 1 1 35 GLU OE1 O 4.066 -3.016 11.145 1.00 . A A . 35 GLU OE1 1 1 3 1872 1 1 35 GLU OE2 O 4.817 -1.574 9.678 1.00 . A A . 35 GLU OE2 1 1 3 1873 1 1 36 PHE C C 1.916 -4.672 4.824 1.00 . A A . 36 PHE C 1 1 3 1874 1 1 36 PHE CA C 1.714 -5.043 6.271 1.00 . A A . 36 PHE CA 1 1 3 1875 1 1 36 PHE CB C 0.531 -5.978 6.432 1.00 . A A . 36 PHE CB 1 1 3 1876 1 1 36 PHE CD1 C 0.750 -6.125 8.890 1.00 . A A . 36 PHE CD1 1 1 3 1877 1 1 36 PHE CD2 C 0.557 -8.158 7.680 1.00 . A A . 36 PHE CD2 1 1 3 1878 1 1 36 PHE CE1 C 0.838 -6.804 10.051 1.00 . A A . 36 PHE CE1 1 1 3 1879 1 1 36 PHE CE2 C 0.643 -8.865 8.865 1.00 . A A . 36 PHE CE2 1 1 3 1880 1 1 36 PHE CG C 0.610 -6.776 7.689 1.00 . A A . 36 PHE CG 1 1 3 1881 1 1 36 PHE CZ C 0.785 -8.183 10.059 1.00 . A A . 36 PHE CZ 1 1 3 1882 1 1 36 PHE H H 0.602 -3.748 7.488 1.00 . A A . 36 PHE H 1 1 3 1883 1 1 36 PHE HA H 2.606 -5.515 6.656 1.00 . A A . 36 PHE HA 1 1 3 1884 1 1 36 PHE HB2 H -0.372 -5.383 6.479 1.00 . A A . 36 PHE HB2 1 1 3 1885 1 1 36 PHE HB3 H 0.466 -6.639 5.595 1.00 . A A . 36 PHE HB3 1 1 3 1886 1 1 36 PHE HD1 H 0.794 -5.053 8.916 1.00 . A A . 36 PHE HD1 1 1 3 1887 1 1 36 PHE HD2 H 0.445 -8.682 6.741 1.00 . A A . 36 PHE HD2 1 1 3 1888 1 1 36 PHE HE1 H 0.951 -6.248 10.950 1.00 . A A . 36 PHE HE1 1 1 3 1889 1 1 36 PHE HE2 H 0.600 -9.945 8.857 1.00 . A A . 36 PHE HE2 1 1 3 1890 1 1 36 PHE HZ H 0.857 -8.725 10.990 1.00 . A A . 36 PHE HZ 1 1 3 1891 1 1 36 PHE N N 1.464 -3.862 7.039 1.00 . A A . 36 PHE N 1 1 3 1892 1 1 36 PHE O O 2.614 -5.354 4.089 1.00 . A A . 36 PHE O 1 1 3 1893 1 1 37 ALA C C 2.755 -2.712 2.662 1.00 . A A . 37 ALA C 1 1 3 1894 1 1 37 ALA CA C 1.357 -3.091 3.081 1.00 . A A . 37 ALA CA 1 1 3 1895 1 1 37 ALA CB C 0.461 -1.896 2.966 1.00 . A A . 37 ALA CB 1 1 3 1896 1 1 37 ALA H H 0.857 -2.999 5.116 1.00 . A A . 37 ALA H 1 1 3 1897 1 1 37 ALA HA H 0.981 -3.871 2.438 1.00 . A A . 37 ALA HA 1 1 3 1898 1 1 37 ALA HB1 H 0.450 -1.553 1.943 1.00 . A A . 37 ALA HB1 1 1 3 1899 1 1 37 ALA HB2 H 0.830 -1.107 3.606 1.00 . A A . 37 ALA HB2 1 1 3 1900 1 1 37 ALA HB3 H -0.540 -2.165 3.265 1.00 . A A . 37 ALA HB3 1 1 3 1901 1 1 37 ALA N N 1.327 -3.552 4.445 1.00 . A A . 37 ALA N 1 1 3 1902 1 1 37 ALA O O 3.275 -3.212 1.682 1.00 . A A . 37 ALA O 1 1 3 1903 1 1 38 ALA C C 5.640 -2.527 3.112 1.00 . A A . 38 ALA C 1 1 3 1904 1 1 38 ALA CA C 4.689 -1.364 3.157 1.00 . A A . 38 ALA CA 1 1 3 1905 1 1 38 ALA CB C 5.136 -0.365 4.203 1.00 . A A . 38 ALA CB 1 1 3 1906 1 1 38 ALA H H 2.885 -1.496 4.197 1.00 . A A . 38 ALA H 1 1 3 1907 1 1 38 ALA HA H 4.683 -0.872 2.195 1.00 . A A . 38 ALA HA 1 1 3 1908 1 1 38 ALA HB1 H 6.123 -0.008 3.957 1.00 . A A . 38 ALA HB1 1 1 3 1909 1 1 38 ALA HB2 H 5.157 -0.846 5.168 1.00 . A A . 38 ALA HB2 1 1 3 1910 1 1 38 ALA HB3 H 4.446 0.464 4.227 1.00 . A A . 38 ALA HB3 1 1 3 1911 1 1 38 ALA N N 3.357 -1.837 3.431 1.00 . A A . 38 ALA N 1 1 3 1912 1 1 38 ALA O O 6.463 -2.617 2.222 1.00 . A A . 38 ALA O 1 1 3 1913 1 1 39 SER C C 6.178 -5.494 2.963 1.00 . A A . 39 SER C 1 1 3 1914 1 1 39 SER CA C 6.385 -4.565 4.142 1.00 . A A . 39 SER CA 1 1 3 1915 1 1 39 SER CB C 6.140 -5.290 5.464 1.00 . A A . 39 SER CB 1 1 3 1916 1 1 39 SER H H 4.668 -3.465 4.588 1.00 . A A . 39 SER H 1 1 3 1917 1 1 39 SER HA H 7.389 -4.174 4.121 1.00 . A A . 39 SER HA 1 1 3 1918 1 1 39 SER HB2 H 5.158 -5.738 5.445 1.00 . A A . 39 SER HB2 1 1 3 1919 1 1 39 SER HB3 H 6.887 -6.056 5.599 1.00 . A A . 39 SER HB3 1 1 3 1920 1 1 39 SER HG H 5.360 -3.924 6.649 1.00 . A A . 39 SER HG 1 1 3 1921 1 1 39 SER N N 5.465 -3.465 4.024 1.00 . A A . 39 SER N 1 1 3 1922 1 1 39 SER O O 7.095 -6.177 2.512 1.00 . A A . 39 SER O 1 1 3 1923 1 1 39 SER OG O 6.206 -4.385 6.557 1.00 . A A . 39 SER OG 1 1 3 1924 1 1 40 LEU C C 4.956 -5.660 0.054 1.00 . A A . 40 LEU C 1 1 3 1925 1 1 40 LEU CA C 4.585 -6.308 1.364 1.00 . A A . 40 LEU CA 1 1 3 1926 1 1 40 LEU CB C 3.098 -6.521 1.453 1.00 . A A . 40 LEU CB 1 1 3 1927 1 1 40 LEU CD1 C 3.242 -8.884 0.580 1.00 . A A . 40 LEU CD1 1 1 3 1928 1 1 40 LEU CD2 C 2.993 -8.476 3.027 1.00 . A A . 40 LEU CD2 1 1 3 1929 1 1 40 LEU CG C 2.637 -7.974 1.634 1.00 . A A . 40 LEU CG 1 1 3 1930 1 1 40 LEU H H 4.279 -4.860 2.792 1.00 . A A . 40 LEU H 1 1 3 1931 1 1 40 LEU HA H 5.102 -7.250 1.448 1.00 . A A . 40 LEU HA 1 1 3 1932 1 1 40 LEU HB2 H 2.733 -5.941 2.286 1.00 . A A . 40 LEU HB2 1 1 3 1933 1 1 40 LEU HB3 H 2.669 -6.110 0.587 1.00 . A A . 40 LEU HB3 1 1 3 1934 1 1 40 LEU HD11 H 4.317 -8.888 0.683 1.00 . A A . 40 LEU HD11 1 1 3 1935 1 1 40 LEU HD12 H 2.974 -8.526 -0.402 1.00 . A A . 40 LEU HD12 1 1 3 1936 1 1 40 LEU HD13 H 2.864 -9.887 0.712 1.00 . A A . 40 LEU HD13 1 1 3 1937 1 1 40 LEU HD21 H 4.066 -8.470 3.152 1.00 . A A . 40 LEU HD21 1 1 3 1938 1 1 40 LEU HD22 H 2.623 -9.484 3.149 1.00 . A A . 40 LEU HD22 1 1 3 1939 1 1 40 LEU HD23 H 2.540 -7.834 3.769 1.00 . A A . 40 LEU HD23 1 1 3 1940 1 1 40 LEU HG H 1.563 -8.017 1.532 1.00 . A A . 40 LEU HG 1 1 3 1941 1 1 40 LEU N N 4.959 -5.480 2.447 1.00 . A A . 40 LEU N 1 1 3 1942 1 1 40 LEU O O 5.190 -6.335 -0.936 1.00 . A A . 40 LEU O 1 1 3 1943 1 1 41 LEU C C 6.970 -3.774 -1.170 1.00 . A A . 41 LEU C 1 1 3 1944 1 1 41 LEU CA C 5.447 -3.686 -1.160 1.00 . A A . 41 LEU CA 1 1 3 1945 1 1 41 LEU CB C 4.861 -2.282 -1.271 1.00 . A A . 41 LEU CB 1 1 3 1946 1 1 41 LEU CD1 C 6.798 -0.876 -0.778 1.00 . A A . 41 LEU CD1 1 1 3 1947 1 1 41 LEU CD2 C 4.497 -0.032 -0.347 1.00 . A A . 41 LEU CD2 1 1 3 1948 1 1 41 LEU CG C 5.415 -1.230 -0.352 1.00 . A A . 41 LEU CG 1 1 3 1949 1 1 41 LEU H H 4.625 -3.787 0.786 1.00 . A A . 41 LEU H 1 1 3 1950 1 1 41 LEU HA H 5.095 -4.246 -1.993 1.00 . A A . 41 LEU HA 1 1 3 1951 1 1 41 LEU HB2 H 4.984 -1.940 -2.287 1.00 . A A . 41 LEU HB2 1 1 3 1952 1 1 41 LEU HB3 H 3.801 -2.366 -1.066 1.00 . A A . 41 LEU HB3 1 1 3 1953 1 1 41 LEU HD11 H 7.393 -1.777 -0.773 1.00 . A A . 41 LEU HD11 1 1 3 1954 1 1 41 LEU HD12 H 7.217 -0.157 -0.090 1.00 . A A . 41 LEU HD12 1 1 3 1955 1 1 41 LEU HD13 H 6.777 -0.464 -1.774 1.00 . A A . 41 LEU HD13 1 1 3 1956 1 1 41 LEU HD21 H 3.536 -0.334 0.041 1.00 . A A . 41 LEU HD21 1 1 3 1957 1 1 41 LEU HD22 H 4.378 0.334 -1.355 1.00 . A A . 41 LEU HD22 1 1 3 1958 1 1 41 LEU HD23 H 4.916 0.743 0.277 1.00 . A A . 41 LEU HD23 1 1 3 1959 1 1 41 LEU HG H 5.467 -1.617 0.641 1.00 . A A . 41 LEU HG 1 1 3 1960 1 1 41 LEU N N 4.961 -4.344 0.011 1.00 . A A . 41 LEU N 1 1 3 1961 1 1 41 LEU O O 7.606 -3.763 -2.219 1.00 . A A . 41 LEU O 1 1 3 1962 1 1 42 PHE C C 9.746 -4.844 -0.468 1.00 . A A . 42 PHE C 1 1 3 1963 1 1 42 PHE CA C 8.960 -3.768 0.272 1.00 . A A . 42 PHE CA 1 1 3 1964 1 1 42 PHE CB C 9.276 -3.851 1.756 1.00 . A A . 42 PHE CB 1 1 3 1965 1 1 42 PHE CD1 C 9.005 -1.552 2.402 1.00 . A A . 42 PHE CD1 1 1 3 1966 1 1 42 PHE CD2 C 11.203 -2.413 2.465 1.00 . A A . 42 PHE CD2 1 1 3 1967 1 1 42 PHE CE1 C 9.447 -0.336 2.798 1.00 . A A . 42 PHE CE1 1 1 3 1968 1 1 42 PHE CE2 C 11.678 -1.183 2.878 1.00 . A A . 42 PHE CE2 1 1 3 1969 1 1 42 PHE CG C 9.852 -2.587 2.234 1.00 . A A . 42 PHE CG 1 1 3 1970 1 1 42 PHE CZ C 10.793 -0.134 3.044 1.00 . A A . 42 PHE CZ 1 1 3 1971 1 1 42 PHE H H 6.946 -4.006 0.806 1.00 . A A . 42 PHE H 1 1 3 1972 1 1 42 PHE HA H 9.271 -2.779 -0.067 1.00 . A A . 42 PHE HA 1 1 3 1973 1 1 42 PHE HB2 H 8.362 -4.007 2.307 1.00 . A A . 42 PHE HB2 1 1 3 1974 1 1 42 PHE HB3 H 9.968 -4.643 1.949 1.00 . A A . 42 PHE HB3 1 1 3 1975 1 1 42 PHE HD1 H 7.948 -1.722 2.223 1.00 . A A . 42 PHE HD1 1 1 3 1976 1 1 42 PHE HD2 H 11.882 -3.242 2.332 1.00 . A A . 42 PHE HD2 1 1 3 1977 1 1 42 PHE HE1 H 8.744 0.449 2.908 1.00 . A A . 42 PHE HE1 1 1 3 1978 1 1 42 PHE HE2 H 12.732 -1.041 3.065 1.00 . A A . 42 PHE HE2 1 1 3 1979 1 1 42 PHE HZ H 11.151 0.835 3.358 1.00 . A A . 42 PHE HZ 1 1 3 1980 1 1 42 PHE N N 7.529 -3.861 0.040 1.00 . A A . 42 PHE N 1 1 3 1981 1 1 42 PHE O O 10.971 -4.760 -0.552 1.00 . A A . 42 PHE O 1 1 3 1982 1 1 43 GLN C C 10.250 -6.268 -3.112 1.00 . A A . 43 GLN C 1 1 3 1983 1 1 43 GLN CA C 9.753 -6.874 -1.798 1.00 . A A . 43 GLN CA 1 1 3 1984 1 1 43 GLN CB C 8.841 -8.048 -2.100 1.00 . A A . 43 GLN CB 1 1 3 1985 1 1 43 GLN CD C 7.044 -8.786 -0.440 1.00 . A A . 43 GLN CD 1 1 3 1986 1 1 43 GLN CG C 8.496 -8.894 -0.874 1.00 . A A . 43 GLN CG 1 1 3 1987 1 1 43 GLN H H 8.087 -5.983 -0.784 1.00 . A A . 43 GLN H 1 1 3 1988 1 1 43 GLN HA H 10.604 -7.223 -1.241 1.00 . A A . 43 GLN HA 1 1 3 1989 1 1 43 GLN HB2 H 7.939 -7.654 -2.522 1.00 . A A . 43 GLN HB2 1 1 3 1990 1 1 43 GLN HB3 H 9.320 -8.681 -2.826 1.00 . A A . 43 GLN HB3 1 1 3 1991 1 1 43 GLN HE21 H 6.421 -8.704 -2.315 1.00 . A A . 43 GLN HE21 1 1 3 1992 1 1 43 GLN HE22 H 5.194 -8.559 -1.124 1.00 . A A . 43 GLN HE22 1 1 3 1993 1 1 43 GLN HG2 H 8.707 -9.927 -1.099 1.00 . A A . 43 GLN HG2 1 1 3 1994 1 1 43 GLN HG3 H 9.124 -8.575 -0.053 1.00 . A A . 43 GLN HG3 1 1 3 1995 1 1 43 GLN N N 9.065 -5.877 -0.979 1.00 . A A . 43 GLN N 1 1 3 1996 1 1 43 GLN NE2 N 6.130 -8.688 -1.392 1.00 . A A . 43 GLN NE2 1 1 3 1997 1 1 43 GLN O O 11.014 -6.893 -3.848 1.00 . A A . 43 GLN O 1 1 3 1998 1 1 43 GLN OE1 O 6.742 -8.846 0.748 1.00 . A A . 43 GLN OE1 1 1 3 1999 1 1 44 SER C C 11.636 -3.801 -4.403 1.00 . A A . 44 SER C 1 1 3 2000 1 1 44 SER CA C 10.217 -4.337 -4.590 1.00 . A A . 44 SER CA 1 1 3 2001 1 1 44 SER CB C 9.243 -3.190 -4.878 1.00 . A A . 44 SER CB 1 1 3 2002 1 1 44 SER H H 9.154 -4.641 -2.787 1.00 . A A . 44 SER H 1 1 3 2003 1 1 44 SER HA H 10.209 -5.026 -5.420 1.00 . A A . 44 SER HA 1 1 3 2004 1 1 44 SER HB2 H 8.235 -3.573 -4.882 1.00 . A A . 44 SER HB2 1 1 3 2005 1 1 44 SER HB3 H 9.337 -2.439 -4.108 1.00 . A A . 44 SER HB3 1 1 3 2006 1 1 44 SER HG H 10.226 -1.944 -6.041 1.00 . A A . 44 SER HG 1 1 3 2007 1 1 44 SER N N 9.797 -5.060 -3.400 1.00 . A A . 44 SER N 1 1 3 2008 1 1 44 SER O O 12.583 -4.410 -4.943 1.00 . A A . 44 SER O 1 1 3 2009 1 1 44 SER OXT O 11.806 -2.787 -3.693 1.00 . A A . 44 SER OXT 1 1 3 2010 1 1 44 SER OG O 9.504 -2.588 -6.137 1.00 . A A . 44 SER OG 1 1 4 2011 1 1 1 GLY C C -14.436 2.750 -0.283 1.00 . A A . 1 GLY C 1 1 4 2012 1 1 1 GLY CA C -14.846 4.190 -0.478 1.00 . A A . 1 GLY CA 1 1 4 2013 1 1 1 GLY H1 H -16.856 3.972 -0.987 1.00 . A A . 1 GLY H1 1 1 4 2014 1 1 1 GLY H2 H -16.507 5.408 -0.149 1.00 . A A . 1 GLY H2 1 1 4 2015 1 1 1 GLY H3 H -16.557 3.928 0.678 1.00 . A A . 1 GLY H3 1 1 4 2016 1 1 1 GLY HA2 H -14.627 4.481 -1.495 1.00 . A A . 1 GLY HA2 1 1 4 2017 1 1 1 GLY HA3 H -14.275 4.812 0.195 1.00 . A A . 1 GLY HA3 1 1 4 2018 1 1 1 GLY N N -16.290 4.392 -0.218 1.00 . A A . 1 GLY N 1 1 4 2019 1 1 1 GLY O O -15.285 1.877 -0.121 1.00 . A A . 1 GLY O 1 1 4 2020 1 1 2 SER C C -11.356 1.334 0.837 1.00 . A A . 2 SER C 1 1 4 2021 1 1 2 SER CA C -12.609 1.179 -0.012 1.00 . A A . 2 SER CA 1 1 4 2022 1 1 2 SER CB C -12.300 0.409 -1.303 1.00 . A A . 2 SER CB 1 1 4 2023 1 1 2 SER H H -12.514 3.223 -0.522 1.00 . A A . 2 SER H 1 1 4 2024 1 1 2 SER HA H -13.354 0.642 0.558 1.00 . A A . 2 SER HA 1 1 4 2025 1 1 2 SER HB2 H -13.168 0.426 -1.945 1.00 . A A . 2 SER HB2 1 1 4 2026 1 1 2 SER HB3 H -11.470 0.881 -1.807 1.00 . A A . 2 SER HB3 1 1 4 2027 1 1 2 SER HG H -11.448 -1.302 -1.776 1.00 . A A . 2 SER HG 1 1 4 2028 1 1 2 SER N N -13.138 2.499 -0.306 1.00 . A A . 2 SER N 1 1 4 2029 1 1 2 SER O O -10.446 2.086 0.481 1.00 . A A . 2 SER O 1 1 4 2030 1 1 2 SER OG O -11.960 -0.944 -1.033 1.00 . A A . 2 SER OG 1 1 4 2031 1 1 3 ALA C C -9.073 -0.117 2.676 1.00 . A A . 3 ALA C 1 1 4 2032 1 1 3 ALA CA C -10.252 0.814 2.934 1.00 . A A . 3 ALA CA 1 1 4 2033 1 1 3 ALA CB C -10.800 0.606 4.333 1.00 . A A . 3 ALA CB 1 1 4 2034 1 1 3 ALA H H -12.011 -0.044 2.127 1.00 . A A . 3 ALA H 1 1 4 2035 1 1 3 ALA HA H -9.911 1.835 2.859 1.00 . A A . 3 ALA HA 1 1 4 2036 1 1 3 ALA HB1 H -11.613 1.294 4.507 1.00 . A A . 3 ALA HB1 1 1 4 2037 1 1 3 ALA HB2 H -10.017 0.781 5.055 1.00 . A A . 3 ALA HB2 1 1 4 2038 1 1 3 ALA HB3 H -11.160 -0.407 4.429 1.00 . A A . 3 ALA HB3 1 1 4 2039 1 1 3 ALA N N -11.313 0.630 1.956 1.00 . A A . 3 ALA N 1 1 4 2040 1 1 3 ALA O O -8.339 -0.474 3.596 1.00 . A A . 3 ALA O 1 1 4 2041 1 1 4 THR C C -6.597 -0.507 0.612 1.00 . A A . 4 THR C 1 1 4 2042 1 1 4 THR CA C -7.776 -1.342 1.037 1.00 . A A . 4 THR CA 1 1 4 2043 1 1 4 THR CB C -8.186 -2.281 -0.106 1.00 . A A . 4 THR CB 1 1 4 2044 1 1 4 THR CG2 C -8.911 -3.506 0.428 1.00 . A A . 4 THR CG2 1 1 4 2045 1 1 4 THR H H -9.558 -0.250 0.746 1.00 . A A . 4 THR H 1 1 4 2046 1 1 4 THR HA H -7.489 -1.913 1.844 1.00 . A A . 4 THR HA 1 1 4 2047 1 1 4 THR HB H -7.297 -2.603 -0.627 1.00 . A A . 4 THR HB 1 1 4 2048 1 1 4 THR HG1 H -9.438 -2.189 -1.644 1.00 . A A . 4 THR HG1 1 1 4 2049 1 1 4 THR HG21 H -9.805 -3.197 0.949 1.00 . A A . 4 THR HG21 1 1 4 2050 1 1 4 THR HG22 H -8.264 -4.036 1.110 1.00 . A A . 4 THR HG22 1 1 4 2051 1 1 4 THR HG23 H -9.179 -4.155 -0.392 1.00 . A A . 4 THR HG23 1 1 4 2052 1 1 4 THR N N -8.904 -0.516 1.427 1.00 . A A . 4 THR N 1 1 4 2053 1 1 4 THR O O -5.526 -0.505 1.209 1.00 . A A . 4 THR O 1 1 4 2054 1 1 4 THR OG1 O -9.035 -1.567 -1.016 1.00 . A A . 4 THR OG1 1 1 4 2055 1 1 5 PHE C C -6.380 2.602 -1.067 1.00 . A A . 5 PHE C 1 1 4 2056 1 1 5 PHE CA C -5.933 1.112 -1.068 1.00 . A A . 5 PHE CA 1 1 4 2057 1 1 5 PHE CB C -6.005 0.707 -2.488 1.00 . A A . 5 PHE CB 1 1 4 2058 1 1 5 PHE CD1 C -5.201 -1.520 -2.000 1.00 . A A . 5 PHE CD1 1 1 4 2059 1 1 5 PHE CD2 C -7.006 -1.364 -3.495 1.00 . A A . 5 PHE CD2 1 1 4 2060 1 1 5 PHE CE1 C -5.230 -2.826 -2.081 1.00 . A A . 5 PHE CE1 1 1 4 2061 1 1 5 PHE CE2 C -7.028 -2.743 -3.588 1.00 . A A . 5 PHE CE2 1 1 4 2062 1 1 5 PHE CG C -6.066 -0.752 -2.681 1.00 . A A . 5 PHE CG 1 1 4 2063 1 1 5 PHE CZ C -6.113 -3.466 -2.848 1.00 . A A . 5 PHE CZ 1 1 4 2064 1 1 5 PHE H H -7.733 0.108 -0.763 1.00 . A A . 5 PHE H 1 1 4 2065 1 1 5 PHE HA H -4.935 0.963 -0.689 1.00 . A A . 5 PHE HA 1 1 4 2066 1 1 5 PHE HB2 H -6.918 1.110 -2.815 1.00 . A A . 5 PHE HB2 1 1 4 2067 1 1 5 PHE HB3 H -5.171 1.101 -3.041 1.00 . A A . 5 PHE HB3 1 1 4 2068 1 1 5 PHE HD1 H -4.484 -1.078 -1.357 1.00 . A A . 5 PHE HD1 1 1 4 2069 1 1 5 PHE HD2 H -7.706 -0.764 -4.058 1.00 . A A . 5 PHE HD2 1 1 4 2070 1 1 5 PHE HE1 H -4.532 -3.354 -1.528 1.00 . A A . 5 PHE HE1 1 1 4 2071 1 1 5 PHE HE2 H -7.753 -3.242 -4.214 1.00 . A A . 5 PHE HE2 1 1 4 2072 1 1 5 PHE HZ H -6.093 -4.526 -2.851 1.00 . A A . 5 PHE HZ 1 1 4 2073 1 1 5 PHE N N -6.870 0.220 -0.405 1.00 . A A . 5 PHE N 1 1 4 2074 1 1 5 PHE O O -6.360 3.253 -2.110 1.00 . A A . 5 PHE O 1 1 4 2075 1 1 6 PRO C C -5.973 5.432 0.368 1.00 . A A . 6 PRO C 1 1 4 2076 1 1 6 PRO CA C -7.183 4.532 0.230 1.00 . A A . 6 PRO CA 1 1 4 2077 1 1 6 PRO CB C -7.992 4.527 1.510 1.00 . A A . 6 PRO CB 1 1 4 2078 1 1 6 PRO CD C -7.184 2.366 1.199 1.00 . A A . 6 PRO CD 1 1 4 2079 1 1 6 PRO CG C -7.503 3.381 2.238 1.00 . A A . 6 PRO CG 1 1 4 2080 1 1 6 PRO HA H -7.803 4.874 -0.557 1.00 . A A . 6 PRO HA 1 1 4 2081 1 1 6 PRO HB2 H -7.847 5.444 2.055 1.00 . A A . 6 PRO HB2 1 1 4 2082 1 1 6 PRO HB3 H -9.013 4.389 1.282 1.00 . A A . 6 PRO HB3 1 1 4 2083 1 1 6 PRO HD2 H -6.367 1.767 1.473 1.00 . A A . 6 PRO HD2 1 1 4 2084 1 1 6 PRO HD3 H -8.032 1.740 0.951 1.00 . A A . 6 PRO HD3 1 1 4 2085 1 1 6 PRO HG2 H -6.634 3.655 2.792 1.00 . A A . 6 PRO HG2 1 1 4 2086 1 1 6 PRO HG3 H -8.278 3.030 2.873 1.00 . A A . 6 PRO HG3 1 1 4 2087 1 1 6 PRO N N -6.838 3.130 0.057 1.00 . A A . 6 PRO N 1 1 4 2088 1 1 6 PRO O O -4.882 4.989 0.724 1.00 . A A . 6 PRO O 1 1 4 2089 1 1 7 GLU C C -4.361 7.735 1.409 1.00 . A A . 7 GLU C 1 1 4 2090 1 1 7 GLU CA C -5.152 7.720 0.110 1.00 . A A . 7 GLU CA 1 1 4 2091 1 1 7 GLU CB C -5.773 9.090 -0.142 1.00 . A A . 7 GLU CB 1 1 4 2092 1 1 7 GLU CD C -5.121 9.519 -2.534 1.00 . A A . 7 GLU CD 1 1 4 2093 1 1 7 GLU CG C -6.260 9.294 -1.565 1.00 . A A . 7 GLU CG 1 1 4 2094 1 1 7 GLU H H -7.123 7.003 -0.030 1.00 . A A . 7 GLU H 1 1 4 2095 1 1 7 GLU HA H -4.479 7.483 -0.697 1.00 . A A . 7 GLU HA 1 1 4 2096 1 1 7 GLU HB2 H -6.614 9.217 0.523 1.00 . A A . 7 GLU HB2 1 1 4 2097 1 1 7 GLU HB3 H -5.041 9.845 0.075 1.00 . A A . 7 GLU HB3 1 1 4 2098 1 1 7 GLU HG2 H -6.811 8.417 -1.875 1.00 . A A . 7 GLU HG2 1 1 4 2099 1 1 7 GLU HG3 H -6.913 10.155 -1.590 1.00 . A A . 7 GLU HG3 1 1 4 2100 1 1 7 GLU N N -6.200 6.715 0.125 1.00 . A A . 7 GLU N 1 1 4 2101 1 1 7 GLU O O -3.183 8.070 1.410 1.00 . A A . 7 GLU O 1 1 4 2102 1 1 7 GLU OE1 O -4.561 10.630 -2.561 1.00 . A A . 7 GLU OE1 1 1 4 2103 1 1 7 GLU OE2 O -4.775 8.570 -3.263 1.00 . A A . 7 GLU OE2 1 1 4 2104 1 1 8 GLN C C -3.136 6.351 3.670 1.00 . A A . 8 GLN C 1 1 4 2105 1 1 8 GLN CA C -4.342 7.265 3.799 1.00 . A A . 8 GLN CA 1 1 4 2106 1 1 8 GLN CB C -5.279 6.674 4.853 1.00 . A A . 8 GLN CB 1 1 4 2107 1 1 8 GLN CD C -7.648 6.484 5.690 1.00 . A A . 8 GLN CD 1 1 4 2108 1 1 8 GLN CG C -6.744 6.823 4.522 1.00 . A A . 8 GLN CG 1 1 4 2109 1 1 8 GLN H H -5.987 7.241 2.466 1.00 . A A . 8 GLN H 1 1 4 2110 1 1 8 GLN HA H -4.019 8.245 4.112 1.00 . A A . 8 GLN HA 1 1 4 2111 1 1 8 GLN HB2 H -5.067 5.623 4.953 1.00 . A A . 8 GLN HB2 1 1 4 2112 1 1 8 GLN HB3 H -5.093 7.162 5.799 1.00 . A A . 8 GLN HB3 1 1 4 2113 1 1 8 GLN HE21 H -7.556 8.360 6.345 1.00 . A A . 8 GLN HE21 1 1 4 2114 1 1 8 GLN HE22 H -8.518 7.272 7.294 1.00 . A A . 8 GLN HE22 1 1 4 2115 1 1 8 GLN HG2 H -6.918 7.832 4.221 1.00 . A A . 8 GLN HG2 1 1 4 2116 1 1 8 GLN HG3 H -6.980 6.160 3.701 1.00 . A A . 8 GLN HG3 1 1 4 2117 1 1 8 GLN N N -5.017 7.388 2.511 1.00 . A A . 8 GLN N 1 1 4 2118 1 1 8 GLN NE2 N -7.938 7.470 6.523 1.00 . A A . 8 GLN NE2 1 1 4 2119 1 1 8 GLN O O -1.995 6.760 3.883 1.00 . A A . 8 GLN O 1 1 4 2120 1 1 8 GLN OE1 O -8.071 5.341 5.848 1.00 . A A . 8 GLN OE1 1 1 4 2121 1 1 9 THR C C -1.523 4.329 1.996 1.00 . A A . 9 THR C 1 1 4 2122 1 1 9 THR CA C -2.412 4.096 3.192 1.00 . A A . 9 THR CA 1 1 4 2123 1 1 9 THR CB C -3.067 2.716 3.107 1.00 . A A . 9 THR CB 1 1 4 2124 1 1 9 THR CG2 C -3.792 2.380 4.398 1.00 . A A . 9 THR CG2 1 1 4 2125 1 1 9 THR H H -4.319 4.875 3.090 1.00 . A A . 9 THR H 1 1 4 2126 1 1 9 THR HA H -1.822 4.137 4.064 1.00 . A A . 9 THR HA 1 1 4 2127 1 1 9 THR HB H -2.301 1.999 2.946 1.00 . A A . 9 THR HB 1 1 4 2128 1 1 9 THR HG1 H -4.216 1.755 1.824 1.00 . A A . 9 THR HG1 1 1 4 2129 1 1 9 THR HG21 H -3.089 2.385 5.217 1.00 . A A . 9 THR HG21 1 1 4 2130 1 1 9 THR HG22 H -4.242 1.403 4.313 1.00 . A A . 9 THR HG22 1 1 4 2131 1 1 9 THR HG23 H -4.561 3.118 4.578 1.00 . A A . 9 THR HG23 1 1 4 2132 1 1 9 THR N N -3.410 5.113 3.303 1.00 . A A . 9 THR N 1 1 4 2133 1 1 9 THR O O -0.322 4.072 2.031 1.00 . A A . 9 THR O 1 1 4 2134 1 1 9 THR OG1 O -3.994 2.671 2.018 1.00 . A A . 9 THR OG1 1 1 4 2135 1 1 10 ILE C C -0.324 6.154 0.063 1.00 . A A . 10 ILE C 1 1 4 2136 1 1 10 ILE CA C -1.439 5.204 -0.254 1.00 . A A . 10 ILE CA 1 1 4 2137 1 1 10 ILE CB C -2.391 5.864 -1.254 1.00 . A A . 10 ILE CB 1 1 4 2138 1 1 10 ILE CD1 C -4.322 5.395 -2.794 1.00 . A A . 10 ILE CD1 1 1 4 2139 1 1 10 ILE CG1 C -3.317 4.819 -1.846 1.00 . A A . 10 ILE CG1 1 1 4 2140 1 1 10 ILE CG2 C -1.618 6.564 -2.347 1.00 . A A . 10 ILE CG2 1 1 4 2141 1 1 10 ILE H H -3.100 4.932 0.992 1.00 . A A . 10 ILE H 1 1 4 2142 1 1 10 ILE HA H -1.041 4.325 -0.711 1.00 . A A . 10 ILE HA 1 1 4 2143 1 1 10 ILE HB H -2.980 6.601 -0.730 1.00 . A A . 10 ILE HB 1 1 4 2144 1 1 10 ILE HD11 H -4.922 6.119 -2.268 1.00 . A A . 10 ILE HD11 1 1 4 2145 1 1 10 ILE HD12 H -4.951 4.607 -3.171 1.00 . A A . 10 ILE HD12 1 1 4 2146 1 1 10 ILE HD13 H -3.804 5.873 -3.610 1.00 . A A . 10 ILE HD13 1 1 4 2147 1 1 10 ILE HG12 H -2.731 4.090 -2.384 1.00 . A A . 10 ILE HG12 1 1 4 2148 1 1 10 ILE HG13 H -3.851 4.331 -1.049 1.00 . A A . 10 ILE HG13 1 1 4 2149 1 1 10 ILE HG21 H -2.308 7.036 -3.025 1.00 . A A . 10 ILE HG21 1 1 4 2150 1 1 10 ILE HG22 H -1.023 5.839 -2.878 1.00 . A A . 10 ILE HG22 1 1 4 2151 1 1 10 ILE HG23 H -0.976 7.306 -1.903 1.00 . A A . 10 ILE HG23 1 1 4 2152 1 1 10 ILE N N -2.136 4.833 0.953 1.00 . A A . 10 ILE N 1 1 4 2153 1 1 10 ILE O O 0.834 5.866 -0.182 1.00 . A A . 10 ILE O 1 1 4 2154 1 1 11 LYS C C 1.289 7.820 2.002 1.00 . A A . 11 LYS C 1 1 4 2155 1 1 11 LYS CA C 0.290 8.270 0.969 1.00 . A A . 11 LYS CA 1 1 4 2156 1 1 11 LYS CB C -0.407 9.559 1.346 1.00 . A A . 11 LYS CB 1 1 4 2157 1 1 11 LYS CD C -2.161 11.209 0.613 1.00 . A A . 11 LYS CD 1 1 4 2158 1 1 11 LYS CE C -2.216 12.380 -0.360 1.00 . A A . 11 LYS CE 1 1 4 2159 1 1 11 LYS CG C -1.171 10.144 0.171 1.00 . A A . 11 LYS CG 1 1 4 2160 1 1 11 LYS H H -1.600 7.371 0.963 1.00 . A A . 11 LYS H 1 1 4 2161 1 1 11 LYS HA H 0.832 8.432 0.061 1.00 . A A . 11 LYS HA 1 1 4 2162 1 1 11 LYS HB2 H -1.098 9.360 2.145 1.00 . A A . 11 LYS HB2 1 1 4 2163 1 1 11 LYS HB3 H 0.327 10.282 1.673 1.00 . A A . 11 LYS HB3 1 1 4 2164 1 1 11 LYS HD2 H -3.143 10.767 0.679 1.00 . A A . 11 LYS HD2 1 1 4 2165 1 1 11 LYS HD3 H -1.866 11.576 1.585 1.00 . A A . 11 LYS HD3 1 1 4 2166 1 1 11 LYS HE2 H -2.985 13.063 -0.034 1.00 . A A . 11 LYS HE2 1 1 4 2167 1 1 11 LYS HE3 H -1.261 12.885 -0.345 1.00 . A A . 11 LYS HE3 1 1 4 2168 1 1 11 LYS HG2 H -0.466 10.584 -0.518 1.00 . A A . 11 LYS HG2 1 1 4 2169 1 1 11 LYS HG3 H -1.707 9.334 -0.322 1.00 . A A . 11 LYS HG3 1 1 4 2170 1 1 11 LYS HZ1 H -3.347 11.324 -1.780 1.00 . A A . 11 LYS HZ1 1 1 4 2171 1 1 11 LYS HZ2 H -1.699 11.458 -2.167 1.00 . A A . 11 LYS HZ2 1 1 4 2172 1 1 11 LYS HZ3 H -2.720 12.795 -2.343 1.00 . A A . 11 LYS HZ3 1 1 4 2173 1 1 11 LYS N N -0.668 7.246 0.684 1.00 . A A . 11 LYS N 1 1 4 2174 1 1 11 LYS NZ N -2.515 11.958 -1.755 1.00 . A A . 11 LYS NZ 1 1 4 2175 1 1 11 LYS O O 2.404 8.300 2.001 1.00 . A A . 11 LYS O 1 1 4 2176 1 1 12 GLN C C 2.878 5.494 3.147 1.00 . A A . 12 GLN C 1 1 4 2177 1 1 12 GLN CA C 1.790 6.340 3.831 1.00 . A A . 12 GLN CA 1 1 4 2178 1 1 12 GLN CB C 0.937 5.517 4.765 1.00 . A A . 12 GLN CB 1 1 4 2179 1 1 12 GLN CD C -0.522 5.532 6.806 1.00 . A A . 12 GLN CD 1 1 4 2180 1 1 12 GLN CG C 0.369 6.329 5.884 1.00 . A A . 12 GLN CG 1 1 4 2181 1 1 12 GLN H H -0.047 6.631 2.936 1.00 . A A . 12 GLN H 1 1 4 2182 1 1 12 GLN HA H 2.251 7.137 4.386 1.00 . A A . 12 GLN HA 1 1 4 2183 1 1 12 GLN HB2 H 0.110 5.089 4.207 1.00 . A A . 12 GLN HB2 1 1 4 2184 1 1 12 GLN HB3 H 1.508 4.755 5.167 1.00 . A A . 12 GLN HB3 1 1 4 2185 1 1 12 GLN HE21 H -2.084 5.997 5.689 1.00 . A A . 12 GLN HE21 1 1 4 2186 1 1 12 GLN HE22 H -2.416 5.019 7.072 1.00 . A A . 12 GLN HE22 1 1 4 2187 1 1 12 GLN HG2 H 1.177 6.750 6.449 1.00 . A A . 12 GLN HG2 1 1 4 2188 1 1 12 GLN HG3 H -0.201 7.109 5.450 1.00 . A A . 12 GLN HG3 1 1 4 2189 1 1 12 GLN N N 0.891 6.920 2.891 1.00 . A A . 12 GLN N 1 1 4 2190 1 1 12 GLN NE2 N -1.801 5.508 6.489 1.00 . A A . 12 GLN NE2 1 1 4 2191 1 1 12 GLN O O 4.054 5.503 3.535 1.00 . A A . 12 GLN O 1 1 4 2192 1 1 12 GLN OE1 O -0.068 4.950 7.789 1.00 . A A . 12 GLN OE1 1 1 4 2193 1 1 13 LEU C C 4.204 4.728 0.400 1.00 . A A . 13 LEU C 1 1 4 2194 1 1 13 LEU CA C 3.444 3.936 1.430 1.00 . A A . 13 LEU CA 1 1 4 2195 1 1 13 LEU CB C 2.700 2.787 0.817 1.00 . A A . 13 LEU CB 1 1 4 2196 1 1 13 LEU CD1 C 1.200 0.839 1.194 1.00 . A A . 13 LEU CD1 1 1 4 2197 1 1 13 LEU CD2 C 2.746 1.573 3.005 1.00 . A A . 13 LEU CD2 1 1 4 2198 1 1 13 LEU CG C 1.884 2.021 1.834 1.00 . A A . 13 LEU CG 1 1 4 2199 1 1 13 LEU H H 1.594 4.833 1.777 1.00 . A A . 13 LEU H 1 1 4 2200 1 1 13 LEU HA H 4.126 3.552 2.168 1.00 . A A . 13 LEU HA 1 1 4 2201 1 1 13 LEU HB2 H 2.040 3.170 0.050 1.00 . A A . 13 LEU HB2 1 1 4 2202 1 1 13 LEU HB3 H 3.403 2.127 0.374 1.00 . A A . 13 LEU HB3 1 1 4 2203 1 1 13 LEU HD11 H 0.660 0.284 1.948 1.00 . A A . 13 LEU HD11 1 1 4 2204 1 1 13 LEU HD12 H 1.941 0.199 0.736 1.00 . A A . 13 LEU HD12 1 1 4 2205 1 1 13 LEU HD13 H 0.510 1.187 0.440 1.00 . A A . 13 LEU HD13 1 1 4 2206 1 1 13 LEU HD21 H 3.506 0.891 2.653 1.00 . A A . 13 LEU HD21 1 1 4 2207 1 1 13 LEU HD22 H 2.127 1.073 3.737 1.00 . A A . 13 LEU HD22 1 1 4 2208 1 1 13 LEU HD23 H 3.215 2.434 3.457 1.00 . A A . 13 LEU HD23 1 1 4 2209 1 1 13 LEU HG H 1.134 2.689 2.215 1.00 . A A . 13 LEU HG 1 1 4 2210 1 1 13 LEU N N 2.509 4.787 2.104 1.00 . A A . 13 LEU N 1 1 4 2211 1 1 13 LEU O O 5.403 4.558 0.225 1.00 . A A . 13 LEU O 1 1 4 2212 1 1 14 MET C C 5.112 7.415 -0.297 1.00 . A A . 14 MET C 1 1 4 2213 1 1 14 MET CA C 4.119 6.611 -1.105 1.00 . A A . 14 MET CA 1 1 4 2214 1 1 14 MET CB C 3.036 7.504 -1.653 1.00 . A A . 14 MET CB 1 1 4 2215 1 1 14 MET CE C 1.785 4.095 -2.333 1.00 . A A . 14 MET CE 1 1 4 2216 1 1 14 MET CG C 2.160 6.800 -2.648 1.00 . A A . 14 MET CG 1 1 4 2217 1 1 14 MET H H 2.504 5.600 -0.223 1.00 . A A . 14 MET H 1 1 4 2218 1 1 14 MET HA H 4.622 6.114 -1.917 1.00 . A A . 14 MET HA 1 1 4 2219 1 1 14 MET HB2 H 2.415 7.853 -0.838 1.00 . A A . 14 MET HB2 1 1 4 2220 1 1 14 MET HB3 H 3.490 8.339 -2.134 1.00 . A A . 14 MET HB3 1 1 4 2221 1 1 14 MET HE1 H 1.907 4.239 -1.270 1.00 . A A . 14 MET HE1 1 1 4 2222 1 1 14 MET HE2 H 2.058 3.086 -2.596 1.00 . A A . 14 MET HE2 1 1 4 2223 1 1 14 MET HE3 H 0.760 4.283 -2.607 1.00 . A A . 14 MET HE3 1 1 4 2224 1 1 14 MET HG2 H 1.188 6.627 -2.221 1.00 . A A . 14 MET HG2 1 1 4 2225 1 1 14 MET HG3 H 2.070 7.424 -3.480 1.00 . A A . 14 MET HG3 1 1 4 2226 1 1 14 MET N N 3.498 5.619 -0.268 1.00 . A A . 14 MET N 1 1 4 2227 1 1 14 MET O O 6.143 7.864 -0.796 1.00 . A A . 14 MET O 1 1 4 2228 1 1 14 MET SD S 2.841 5.241 -3.191 1.00 . A A . 14 MET SD 1 1 4 2229 1 1 15 ASP C C 6.946 7.481 2.078 1.00 . A A . 15 ASP C 1 1 4 2230 1 1 15 ASP CA C 5.617 8.208 1.948 1.00 . A A . 15 ASP CA 1 1 4 2231 1 1 15 ASP CB C 4.892 8.237 3.290 1.00 . A A . 15 ASP CB 1 1 4 2232 1 1 15 ASP CG C 5.741 8.758 4.430 1.00 . A A . 15 ASP CG 1 1 4 2233 1 1 15 ASP H H 3.878 7.265 1.240 1.00 . A A . 15 ASP H 1 1 4 2234 1 1 15 ASP HA H 5.802 9.222 1.627 1.00 . A A . 15 ASP HA 1 1 4 2235 1 1 15 ASP HB2 H 4.020 8.866 3.194 1.00 . A A . 15 ASP HB2 1 1 4 2236 1 1 15 ASP HB3 H 4.564 7.226 3.529 1.00 . A A . 15 ASP HB3 1 1 4 2237 1 1 15 ASP N N 4.767 7.574 0.961 1.00 . A A . 15 ASP N 1 1 4 2238 1 1 15 ASP O O 7.980 8.122 2.263 1.00 . A A . 15 ASP O 1 1 4 2239 1 1 15 ASP OD1 O 5.827 9.992 4.595 1.00 . A A . 15 ASP OD1 1 1 4 2240 1 1 15 ASP OD2 O 6.342 7.937 5.157 1.00 . A A . 15 ASP OD2 1 1 4 2241 1 1 16 LEU C C 8.993 5.573 0.738 1.00 . A A . 16 LEU C 1 1 4 2242 1 1 16 LEU CA C 8.191 5.414 2.035 1.00 . A A . 16 LEU CA 1 1 4 2243 1 1 16 LEU CB C 7.888 3.958 2.288 1.00 . A A . 16 LEU CB 1 1 4 2244 1 1 16 LEU CD1 C 6.391 2.251 3.276 1.00 . A A . 16 LEU CD1 1 1 4 2245 1 1 16 LEU CD2 C 7.181 4.157 4.686 1.00 . A A . 16 LEU CD2 1 1 4 2246 1 1 16 LEU CG C 6.779 3.703 3.289 1.00 . A A . 16 LEU CG 1 1 4 2247 1 1 16 LEU H H 6.096 5.627 1.863 1.00 . A A . 16 LEU H 1 1 4 2248 1 1 16 LEU HA H 8.763 5.804 2.860 1.00 . A A . 16 LEU HA 1 1 4 2249 1 1 16 LEU HB2 H 7.608 3.502 1.352 1.00 . A A . 16 LEU HB2 1 1 4 2250 1 1 16 LEU HB3 H 8.777 3.490 2.646 1.00 . A A . 16 LEU HB3 1 1 4 2251 1 1 16 LEU HD11 H 7.267 1.639 3.426 1.00 . A A . 16 LEU HD11 1 1 4 2252 1 1 16 LEU HD12 H 5.944 2.025 2.322 1.00 . A A . 16 LEU HD12 1 1 4 2253 1 1 16 LEU HD13 H 5.678 2.064 4.062 1.00 . A A . 16 LEU HD13 1 1 4 2254 1 1 16 LEU HD21 H 6.370 3.970 5.374 1.00 . A A . 16 LEU HD21 1 1 4 2255 1 1 16 LEU HD22 H 7.402 5.214 4.671 1.00 . A A . 16 LEU HD22 1 1 4 2256 1 1 16 LEU HD23 H 8.056 3.611 5.006 1.00 . A A . 16 LEU HD23 1 1 4 2257 1 1 16 LEU HG H 5.918 4.256 2.983 1.00 . A A . 16 LEU HG 1 1 4 2258 1 1 16 LEU N N 6.948 6.146 1.967 1.00 . A A . 16 LEU N 1 1 4 2259 1 1 16 LEU O O 10.152 5.163 0.659 1.00 . A A . 16 LEU O 1 1 4 2260 1 1 17 GLY C C 8.580 5.499 -2.654 1.00 . A A . 17 GLY C 1 1 4 2261 1 1 17 GLY CA C 9.040 6.419 -1.538 1.00 . A A . 17 GLY CA 1 1 4 2262 1 1 17 GLY H H 7.431 6.450 -0.159 1.00 . A A . 17 GLY H 1 1 4 2263 1 1 17 GLY HA2 H 8.856 7.441 -1.832 1.00 . A A . 17 GLY HA2 1 1 4 2264 1 1 17 GLY HA3 H 10.102 6.286 -1.392 1.00 . A A . 17 GLY HA3 1 1 4 2265 1 1 17 GLY N N 8.363 6.168 -0.276 1.00 . A A . 17 GLY N 1 1 4 2266 1 1 17 GLY O O 9.355 5.172 -3.555 1.00 . A A . 17 GLY O 1 1 4 2267 1 1 18 PHE C C 5.783 4.778 -4.509 1.00 . A A . 18 PHE C 1 1 4 2268 1 1 18 PHE CA C 6.790 4.133 -3.571 1.00 . A A . 18 PHE CA 1 1 4 2269 1 1 18 PHE CB C 6.142 3.015 -2.802 1.00 . A A . 18 PHE CB 1 1 4 2270 1 1 18 PHE CD1 C 8.286 1.813 -2.445 1.00 . A A . 18 PHE CD1 1 1 4 2271 1 1 18 PHE CD2 C 6.845 2.309 -0.666 1.00 . A A . 18 PHE CD2 1 1 4 2272 1 1 18 PHE CE1 C 9.164 1.231 -1.568 1.00 . A A . 18 PHE CE1 1 1 4 2273 1 1 18 PHE CE2 C 7.675 1.760 0.196 1.00 . A A . 18 PHE CE2 1 1 4 2274 1 1 18 PHE CG C 7.111 2.352 -1.959 1.00 . A A . 18 PHE CG 1 1 4 2275 1 1 18 PHE CZ C 8.840 1.216 -0.230 1.00 . A A . 18 PHE CZ 1 1 4 2276 1 1 18 PHE H H 6.758 5.338 -1.842 1.00 . A A . 18 PHE H 1 1 4 2277 1 1 18 PHE HA H 7.612 3.728 -4.135 1.00 . A A . 18 PHE HA 1 1 4 2278 1 1 18 PHE HB2 H 5.378 3.427 -2.161 1.00 . A A . 18 PHE HB2 1 1 4 2279 1 1 18 PHE HB3 H 5.710 2.289 -3.429 1.00 . A A . 18 PHE HB3 1 1 4 2280 1 1 18 PHE HD1 H 8.503 1.846 -3.504 1.00 . A A . 18 PHE HD1 1 1 4 2281 1 1 18 PHE HD2 H 5.943 2.724 -0.327 1.00 . A A . 18 PHE HD2 1 1 4 2282 1 1 18 PHE HE1 H 10.091 0.801 -1.918 1.00 . A A . 18 PHE HE1 1 1 4 2283 1 1 18 PHE HE2 H 7.409 1.761 1.214 1.00 . A A . 18 PHE HE2 1 1 4 2284 1 1 18 PHE HZ H 9.485 0.797 0.474 1.00 . A A . 18 PHE HZ 1 1 4 2285 1 1 18 PHE N N 7.328 5.067 -2.594 1.00 . A A . 18 PHE N 1 1 4 2286 1 1 18 PHE O O 5.394 5.932 -4.324 1.00 . A A . 18 PHE O 1 1 4 2287 1 1 19 PRO C C 2.948 3.974 -5.881 1.00 . A A . 19 PRO C 1 1 4 2288 1 1 19 PRO CA C 4.294 4.402 -6.447 1.00 . A A . 19 PRO CA 1 1 4 2289 1 1 19 PRO CB C 4.598 3.579 -7.669 1.00 . A A . 19 PRO CB 1 1 4 2290 1 1 19 PRO CD C 5.990 2.762 -5.981 1.00 . A A . 19 PRO CD 1 1 4 2291 1 1 19 PRO CG C 5.053 2.326 -7.083 1.00 . A A . 19 PRO CG 1 1 4 2292 1 1 19 PRO HA H 4.286 5.453 -6.693 1.00 . A A . 19 PRO HA 1 1 4 2293 1 1 19 PRO HB2 H 3.717 3.452 -8.270 1.00 . A A . 19 PRO HB2 1 1 4 2294 1 1 19 PRO HB3 H 5.384 4.032 -8.235 1.00 . A A . 19 PRO HB3 1 1 4 2295 1 1 19 PRO HD2 H 5.984 2.061 -5.154 1.00 . A A . 19 PRO HD2 1 1 4 2296 1 1 19 PRO HD3 H 6.985 2.905 -6.364 1.00 . A A . 19 PRO HD3 1 1 4 2297 1 1 19 PRO HG2 H 4.211 1.771 -6.687 1.00 . A A . 19 PRO HG2 1 1 4 2298 1 1 19 PRO HG3 H 5.558 1.775 -7.827 1.00 . A A . 19 PRO HG3 1 1 4 2299 1 1 19 PRO N N 5.397 4.046 -5.565 1.00 . A A . 19 PRO N 1 1 4 2300 1 1 19 PRO O O 2.859 3.100 -5.023 1.00 . A A . 19 PRO O 1 1 4 2301 1 1 20 ARG C C 0.185 2.839 -6.303 1.00 . A A . 20 ARG C 1 1 4 2302 1 1 20 ARG CA C 0.546 4.284 -6.048 1.00 . A A . 20 ARG CA 1 1 4 2303 1 1 20 ARG CB C -0.350 5.197 -6.861 1.00 . A A . 20 ARG CB 1 1 4 2304 1 1 20 ARG CD C -2.643 5.945 -7.436 1.00 . A A . 20 ARG CD 1 1 4 2305 1 1 20 ARG CG C -1.813 4.905 -6.711 1.00 . A A . 20 ARG CG 1 1 4 2306 1 1 20 ARG CZ C -4.921 5.171 -7.959 1.00 . A A . 20 ARG CZ 1 1 4 2307 1 1 20 ARG H H 2.084 5.093 -7.227 1.00 . A A . 20 ARG H 1 1 4 2308 1 1 20 ARG HA H 0.441 4.501 -4.995 1.00 . A A . 20 ARG HA 1 1 4 2309 1 1 20 ARG HB2 H -0.172 6.213 -6.562 1.00 . A A . 20 ARG HB2 1 1 4 2310 1 1 20 ARG HB3 H -0.097 5.092 -7.902 1.00 . A A . 20 ARG HB3 1 1 4 2311 1 1 20 ARG HD2 H -2.312 6.922 -7.124 1.00 . A A . 20 ARG HD2 1 1 4 2312 1 1 20 ARG HD3 H -2.480 5.835 -8.498 1.00 . A A . 20 ARG HD3 1 1 4 2313 1 1 20 ARG HE H -4.426 6.276 -6.358 1.00 . A A . 20 ARG HE 1 1 4 2314 1 1 20 ARG HG2 H -2.013 3.931 -7.131 1.00 . A A . 20 ARG HG2 1 1 4 2315 1 1 20 ARG HG3 H -2.054 4.906 -5.671 1.00 . A A . 20 ARG HG3 1 1 4 2316 1 1 20 ARG HH11 H -3.486 4.475 -9.219 1.00 . A A . 20 ARG HH11 1 1 4 2317 1 1 20 ARG HH12 H -5.112 4.019 -9.614 1.00 . A A . 20 ARG HH12 1 1 4 2318 1 1 20 ARG HH21 H -6.562 5.687 -6.886 1.00 . A A . 20 ARG HH21 1 1 4 2319 1 1 20 ARG HH22 H -6.871 4.704 -8.290 1.00 . A A . 20 ARG HH22 1 1 4 2320 1 1 20 ARG N N 1.915 4.529 -6.453 1.00 . A A . 20 ARG N 1 1 4 2321 1 1 20 ARG NE N -4.071 5.816 -7.165 1.00 . A A . 20 ARG NE 1 1 4 2322 1 1 20 ARG NH1 N -4.472 4.500 -9.015 1.00 . A A . 20 ARG NH1 1 1 4 2323 1 1 20 ARG NH2 N -6.220 5.186 -7.691 1.00 . A A . 20 ARG NH2 1 1 4 2324 1 1 20 ARG O O -0.536 2.202 -5.532 1.00 . A A . 20 ARG O 1 1 4 2325 1 1 21 ASP C C 1.038 0.044 -6.643 1.00 . A A . 21 ASP C 1 1 4 2326 1 1 21 ASP CA C 0.571 0.946 -7.777 1.00 . A A . 21 ASP CA 1 1 4 2327 1 1 21 ASP CB C 1.387 0.643 -9.037 1.00 . A A . 21 ASP CB 1 1 4 2328 1 1 21 ASP CG C 0.791 1.254 -10.288 1.00 . A A . 21 ASP CG 1 1 4 2329 1 1 21 ASP H H 1.188 2.962 -7.995 1.00 . A A . 21 ASP H 1 1 4 2330 1 1 21 ASP HA H -0.471 0.749 -7.974 1.00 . A A . 21 ASP HA 1 1 4 2331 1 1 21 ASP HB2 H 2.384 1.036 -8.912 1.00 . A A . 21 ASP HB2 1 1 4 2332 1 1 21 ASP HB3 H 1.442 -0.427 -9.170 1.00 . A A . 21 ASP HB3 1 1 4 2333 1 1 21 ASP N N 0.705 2.348 -7.404 1.00 . A A . 21 ASP N 1 1 4 2334 1 1 21 ASP O O 0.486 -1.030 -6.430 1.00 . A A . 21 ASP O 1 1 4 2335 1 1 21 ASP OD1 O 0.614 2.489 -10.330 1.00 . A A . 21 ASP OD1 1 1 4 2336 1 1 21 ASP OD2 O 0.490 0.498 -11.235 1.00 . A A . 21 ASP OD2 1 1 4 2337 1 1 22 ALA C C 1.645 -0.440 -3.664 1.00 . A A . 22 ALA C 1 1 4 2338 1 1 22 ALA CA C 2.621 -0.287 -4.823 1.00 . A A . 22 ALA CA 1 1 4 2339 1 1 22 ALA CB C 3.920 0.333 -4.344 1.00 . A A . 22 ALA CB 1 1 4 2340 1 1 22 ALA H H 2.406 1.394 -6.081 1.00 . A A . 22 ALA H 1 1 4 2341 1 1 22 ALA HA H 2.845 -1.268 -5.215 1.00 . A A . 22 ALA HA 1 1 4 2342 1 1 22 ALA HB1 H 4.605 0.418 -5.175 1.00 . A A . 22 ALA HB1 1 1 4 2343 1 1 22 ALA HB2 H 4.357 -0.292 -3.579 1.00 . A A . 22 ALA HB2 1 1 4 2344 1 1 22 ALA HB3 H 3.724 1.314 -3.938 1.00 . A A . 22 ALA HB3 1 1 4 2345 1 1 22 ALA N N 2.047 0.499 -5.905 1.00 . A A . 22 ALA N 1 1 4 2346 1 1 22 ALA O O 1.628 -1.480 -3.011 1.00 . A A . 22 ALA O 1 1 4 2347 1 1 23 VAL C C -1.137 -0.636 -2.816 1.00 . A A . 23 VAL C 1 1 4 2348 1 1 23 VAL CA C -0.207 0.470 -2.396 1.00 . A A . 23 VAL CA 1 1 4 2349 1 1 23 VAL CB C -0.988 1.799 -2.189 1.00 . A A . 23 VAL CB 1 1 4 2350 1 1 23 VAL CG1 C -2.327 1.810 -2.879 1.00 . A A . 23 VAL CG1 1 1 4 2351 1 1 23 VAL CG2 C -1.186 2.065 -0.727 1.00 . A A . 23 VAL CG2 1 1 4 2352 1 1 23 VAL H H 0.904 1.409 -3.915 1.00 . A A . 23 VAL H 1 1 4 2353 1 1 23 VAL HA H 0.247 0.202 -1.469 1.00 . A A . 23 VAL HA 1 1 4 2354 1 1 23 VAL HB H -0.397 2.598 -2.601 1.00 . A A . 23 VAL HB 1 1 4 2355 1 1 23 VAL HG11 H -2.917 0.980 -2.507 1.00 . A A . 23 VAL HG11 1 1 4 2356 1 1 23 VAL HG12 H -2.167 1.700 -3.938 1.00 . A A . 23 VAL HG12 1 1 4 2357 1 1 23 VAL HG13 H -2.837 2.739 -2.675 1.00 . A A . 23 VAL HG13 1 1 4 2358 1 1 23 VAL HG21 H -2.106 2.616 -0.587 1.00 . A A . 23 VAL HG21 1 1 4 2359 1 1 23 VAL HG22 H -0.345 2.641 -0.351 1.00 . A A . 23 VAL HG22 1 1 4 2360 1 1 23 VAL HG23 H -1.251 1.122 -0.204 1.00 . A A . 23 VAL HG23 1 1 4 2361 1 1 23 VAL N N 0.825 0.582 -3.408 1.00 . A A . 23 VAL N 1 1 4 2362 1 1 23 VAL O O -1.414 -1.564 -2.095 1.00 . A A . 23 VAL O 1 1 4 2363 1 1 24 VAL C C -1.930 -2.914 -4.598 1.00 . A A . 24 VAL C 1 1 4 2364 1 1 24 VAL CA C -2.494 -1.508 -4.536 1.00 . A A . 24 VAL CA 1 1 4 2365 1 1 24 VAL CB C -3.011 -1.051 -5.896 1.00 . A A . 24 VAL CB 1 1 4 2366 1 1 24 VAL CG1 C -3.712 -2.188 -6.617 1.00 . A A . 24 VAL CG1 1 1 4 2367 1 1 24 VAL CG2 C -3.947 0.127 -5.714 1.00 . A A . 24 VAL CG2 1 1 4 2368 1 1 24 VAL H H -1.238 0.184 -4.586 1.00 . A A . 24 VAL H 1 1 4 2369 1 1 24 VAL HA H -3.318 -1.524 -3.838 1.00 . A A . 24 VAL HA 1 1 4 2370 1 1 24 VAL HB H -2.157 -0.722 -6.480 1.00 . A A . 24 VAL HB 1 1 4 2371 1 1 24 VAL HG11 H -4.504 -2.573 -5.986 1.00 . A A . 24 VAL HG11 1 1 4 2372 1 1 24 VAL HG12 H -3.001 -2.974 -6.820 1.00 . A A . 24 VAL HG12 1 1 4 2373 1 1 24 VAL HG13 H -4.132 -1.827 -7.543 1.00 . A A . 24 VAL HG13 1 1 4 2374 1 1 24 VAL HG21 H -3.394 0.965 -5.316 1.00 . A A . 24 VAL HG21 1 1 4 2375 1 1 24 VAL HG22 H -4.734 -0.147 -5.023 1.00 . A A . 24 VAL HG22 1 1 4 2376 1 1 24 VAL HG23 H -4.378 0.397 -6.667 1.00 . A A . 24 VAL HG23 1 1 4 2377 1 1 24 VAL N N -1.547 -0.564 -4.030 1.00 . A A . 24 VAL N 1 1 4 2378 1 1 24 VAL O O -2.601 -3.851 -4.195 1.00 . A A . 24 VAL O 1 1 4 2379 1 1 25 LYS C C 0.044 -4.944 -3.712 1.00 . A A . 25 LYS C 1 1 4 2380 1 1 25 LYS CA C -0.081 -4.370 -5.114 1.00 . A A . 25 LYS CA 1 1 4 2381 1 1 25 LYS CB C 1.297 -4.283 -5.768 1.00 . A A . 25 LYS CB 1 1 4 2382 1 1 25 LYS CD C 2.632 -3.535 -7.752 1.00 . A A . 25 LYS CD 1 1 4 2383 1 1 25 LYS CE C 2.586 -3.117 -9.214 1.00 . A A . 25 LYS CE 1 1 4 2384 1 1 25 LYS CG C 1.249 -3.850 -7.220 1.00 . A A . 25 LYS CG 1 1 4 2385 1 1 25 LYS H H -0.197 -2.271 -5.360 1.00 . A A . 25 LYS H 1 1 4 2386 1 1 25 LYS HA H -0.713 -5.015 -5.703 1.00 . A A . 25 LYS HA 1 1 4 2387 1 1 25 LYS HB2 H 1.901 -3.575 -5.221 1.00 . A A . 25 LYS HB2 1 1 4 2388 1 1 25 LYS HB3 H 1.764 -5.255 -5.722 1.00 . A A . 25 LYS HB3 1 1 4 2389 1 1 25 LYS HD2 H 3.050 -2.728 -7.169 1.00 . A A . 25 LYS HD2 1 1 4 2390 1 1 25 LYS HD3 H 3.253 -4.414 -7.654 1.00 . A A . 25 LYS HD3 1 1 4 2391 1 1 25 LYS HE2 H 1.928 -2.266 -9.312 1.00 . A A . 25 LYS HE2 1 1 4 2392 1 1 25 LYS HE3 H 3.581 -2.839 -9.526 1.00 . A A . 25 LYS HE3 1 1 4 2393 1 1 25 LYS HG2 H 0.822 -4.647 -7.809 1.00 . A A . 25 LYS HG2 1 1 4 2394 1 1 25 LYS HG3 H 0.630 -2.966 -7.304 1.00 . A A . 25 LYS HG3 1 1 4 2395 1 1 25 LYS HZ1 H 2.047 -3.880 -11.082 1.00 . A A . 25 LYS HZ1 1 1 4 2396 1 1 25 LYS HZ2 H 1.131 -4.504 -9.802 1.00 . A A . 25 LYS HZ2 1 1 4 2397 1 1 25 LYS HZ3 H 2.726 -5.031 -10.043 1.00 . A A . 25 LYS HZ3 1 1 4 2398 1 1 25 LYS N N -0.702 -3.059 -5.058 1.00 . A A . 25 LYS N 1 1 4 2399 1 1 25 LYS NZ N 2.089 -4.209 -10.097 1.00 . A A . 25 LYS NZ 1 1 4 2400 1 1 25 LYS O O -0.272 -6.112 -3.466 1.00 . A A . 25 LYS O 1 1 4 2401 1 1 26 ALA C C -0.445 -4.788 -0.631 1.00 . A A . 26 ALA C 1 1 4 2402 1 1 26 ALA CA C 0.783 -4.557 -1.451 1.00 . A A . 26 ALA CA 1 1 4 2403 1 1 26 ALA CB C 1.687 -3.573 -0.750 1.00 . A A . 26 ALA CB 1 1 4 2404 1 1 26 ALA H H 0.423 -3.120 -2.966 1.00 . A A . 26 ALA H 1 1 4 2405 1 1 26 ALA HA H 1.308 -5.493 -1.553 1.00 . A A . 26 ALA HA 1 1 4 2406 1 1 26 ALA HB1 H 1.999 -3.984 0.199 1.00 . A A . 26 ALA HB1 1 1 4 2407 1 1 26 ALA HB2 H 1.152 -2.649 -0.584 1.00 . A A . 26 ALA HB2 1 1 4 2408 1 1 26 ALA HB3 H 2.555 -3.381 -1.363 1.00 . A A . 26 ALA HB3 1 1 4 2409 1 1 26 ALA N N 0.433 -4.092 -2.776 1.00 . A A . 26 ALA N 1 1 4 2410 1 1 26 ALA O O -0.584 -5.817 0.030 1.00 . A A . 26 ALA O 1 1 4 2411 1 1 27 LEU C C -3.425 -4.938 -0.495 1.00 . A A . 27 LEU C 1 1 4 2412 1 1 27 LEU CA C -2.536 -3.858 0.080 1.00 . A A . 27 LEU CA 1 1 4 2413 1 1 27 LEU CB C -3.207 -2.483 0.082 1.00 . A A . 27 LEU CB 1 1 4 2414 1 1 27 LEU CD1 C -2.772 -1.372 2.266 1.00 . A A . 27 LEU CD1 1 1 4 2415 1 1 27 LEU CD2 C -1.019 -1.427 0.589 1.00 . A A . 27 LEU CD2 1 1 4 2416 1 1 27 LEU CG C -2.482 -1.344 0.797 1.00 . A A . 27 LEU CG 1 1 4 2417 1 1 27 LEU H H -1.203 -3.060 -1.312 1.00 . A A . 27 LEU H 1 1 4 2418 1 1 27 LEU HA H -2.268 -4.123 1.091 1.00 . A A . 27 LEU HA 1 1 4 2419 1 1 27 LEU HB2 H -3.332 -2.180 -0.938 1.00 . A A . 27 LEU HB2 1 1 4 2420 1 1 27 LEU HB3 H -4.184 -2.588 0.529 1.00 . A A . 27 LEU HB3 1 1 4 2421 1 1 27 LEU HD11 H -3.837 -1.310 2.415 1.00 . A A . 27 LEU HD11 1 1 4 2422 1 1 27 LEU HD12 H -2.284 -0.539 2.746 1.00 . A A . 27 LEU HD12 1 1 4 2423 1 1 27 LEU HD13 H -2.405 -2.298 2.676 1.00 . A A . 27 LEU HD13 1 1 4 2424 1 1 27 LEU HD21 H -0.534 -0.594 1.068 1.00 . A A . 27 LEU HD21 1 1 4 2425 1 1 27 LEU HD22 H -0.821 -1.410 -0.471 1.00 . A A . 27 LEU HD22 1 1 4 2426 1 1 27 LEU HD23 H -0.664 -2.357 1.009 1.00 . A A . 27 LEU HD23 1 1 4 2427 1 1 27 LEU HG H -2.802 -0.409 0.389 1.00 . A A . 27 LEU HG 1 1 4 2428 1 1 27 LEU N N -1.343 -3.831 -0.699 1.00 . A A . 27 LEU N 1 1 4 2429 1 1 27 LEU O O -4.270 -5.474 0.179 1.00 . A A . 27 LEU O 1 1 4 2430 1 1 28 LYS C C -3.484 -7.649 -1.592 1.00 . A A . 28 LYS C 1 1 4 2431 1 1 28 LYS CA C -3.875 -6.399 -2.359 1.00 . A A . 28 LYS CA 1 1 4 2432 1 1 28 LYS CB C -3.487 -6.562 -3.816 1.00 . A A . 28 LYS CB 1 1 4 2433 1 1 28 LYS CD C -4.029 -5.900 -6.145 1.00 . A A . 28 LYS CD 1 1 4 2434 1 1 28 LYS CE C -5.103 -5.864 -7.221 1.00 . A A . 28 LYS CE 1 1 4 2435 1 1 28 LYS CG C -4.600 -6.211 -4.781 1.00 . A A . 28 LYS CG 1 1 4 2436 1 1 28 LYS H H -2.715 -4.626 -2.342 1.00 . A A . 28 LYS H 1 1 4 2437 1 1 28 LYS HA H -4.943 -6.271 -2.296 1.00 . A A . 28 LYS HA 1 1 4 2438 1 1 28 LYS HB2 H -2.643 -5.921 -4.025 1.00 . A A . 28 LYS HB2 1 1 4 2439 1 1 28 LYS HB3 H -3.200 -7.588 -3.988 1.00 . A A . 28 LYS HB3 1 1 4 2440 1 1 28 LYS HD2 H -3.546 -4.937 -6.091 1.00 . A A . 28 LYS HD2 1 1 4 2441 1 1 28 LYS HD3 H -3.301 -6.658 -6.400 1.00 . A A . 28 LYS HD3 1 1 4 2442 1 1 28 LYS HE2 H -4.641 -5.600 -8.159 1.00 . A A . 28 LYS HE2 1 1 4 2443 1 1 28 LYS HE3 H -5.539 -6.848 -7.302 1.00 . A A . 28 LYS HE3 1 1 4 2444 1 1 28 LYS HG2 H -5.277 -7.049 -4.861 1.00 . A A . 28 LYS HG2 1 1 4 2445 1 1 28 LYS HG3 H -5.132 -5.339 -4.409 1.00 . A A . 28 LYS HG3 1 1 4 2446 1 1 28 LYS HZ1 H -5.788 -3.923 -6.848 1.00 . A A . 28 LYS HZ1 1 1 4 2447 1 1 28 LYS HZ2 H -6.651 -5.125 -6.021 1.00 . A A . 28 LYS HZ2 1 1 4 2448 1 1 28 LYS HZ3 H -6.893 -4.897 -7.680 1.00 . A A . 28 LYS HZ3 1 1 4 2449 1 1 28 LYS N N -3.253 -5.225 -1.776 1.00 . A A . 28 LYS N 1 1 4 2450 1 1 28 LYS NZ N -6.180 -4.883 -6.921 1.00 . A A . 28 LYS NZ 1 1 4 2451 1 1 28 LYS O O -4.352 -8.429 -1.206 1.00 . A A . 28 LYS O 1 1 4 2452 1 1 29 GLN C C -2.122 -9.009 0.811 1.00 . A A . 29 GLN C 1 1 4 2453 1 1 29 GLN CA C -1.770 -9.053 -0.674 1.00 . A A . 29 GLN CA 1 1 4 2454 1 1 29 GLN CB C -0.291 -9.213 -0.861 1.00 . A A . 29 GLN CB 1 1 4 2455 1 1 29 GLN CD C 1.459 -8.305 -2.379 1.00 . A A . 29 GLN CD 1 1 4 2456 1 1 29 GLN CG C 0.151 -9.033 -2.290 1.00 . A A . 29 GLN CG 1 1 4 2457 1 1 29 GLN H H -1.477 -7.192 -1.647 1.00 . A A . 29 GLN H 1 1 4 2458 1 1 29 GLN HA H -2.275 -9.889 -1.132 1.00 . A A . 29 GLN HA 1 1 4 2459 1 1 29 GLN HB2 H 0.224 -8.497 -0.256 1.00 . A A . 29 GLN HB2 1 1 4 2460 1 1 29 GLN HB3 H -0.019 -10.187 -0.550 1.00 . A A . 29 GLN HB3 1 1 4 2461 1 1 29 GLN HE21 H 0.907 -7.171 -0.855 1.00 . A A . 29 GLN HE21 1 1 4 2462 1 1 29 GLN HE22 H 2.437 -6.832 -1.526 1.00 . A A . 29 GLN HE22 1 1 4 2463 1 1 29 GLN HG2 H 0.251 -9.996 -2.746 1.00 . A A . 29 GLN HG2 1 1 4 2464 1 1 29 GLN HG3 H -0.597 -8.447 -2.811 1.00 . A A . 29 GLN HG3 1 1 4 2465 1 1 29 GLN N N -2.183 -7.854 -1.350 1.00 . A A . 29 GLN N 1 1 4 2466 1 1 29 GLN NE2 N 1.627 -7.342 -1.496 1.00 . A A . 29 GLN NE2 1 1 4 2467 1 1 29 GLN O O -2.466 -10.026 1.406 1.00 . A A . 29 GLN O 1 1 4 2468 1 1 29 GLN OE1 O 2.283 -8.568 -3.253 1.00 . A A . 29 GLN OE1 1 1 4 2469 1 1 30 THR C C -3.794 -7.366 3.076 1.00 . A A . 30 THR C 1 1 4 2470 1 1 30 THR CA C -2.319 -7.653 2.816 1.00 . A A . 30 THR CA 1 1 4 2471 1 1 30 THR CB C -1.490 -6.497 3.382 1.00 . A A . 30 THR CB 1 1 4 2472 1 1 30 THR CG2 C -0.011 -6.793 3.254 1.00 . A A . 30 THR CG2 1 1 4 2473 1 1 30 THR H H -1.734 -7.048 0.892 1.00 . A A . 30 THR H 1 1 4 2474 1 1 30 THR HA H -2.037 -8.556 3.332 1.00 . A A . 30 THR HA 1 1 4 2475 1 1 30 THR HB H -1.733 -6.382 4.416 1.00 . A A . 30 THR HB 1 1 4 2476 1 1 30 THR HG1 H -1.462 -4.531 3.210 1.00 . A A . 30 THR HG1 1 1 4 2477 1 1 30 THR HG21 H 0.239 -6.925 2.210 1.00 . A A . 30 THR HG21 1 1 4 2478 1 1 30 THR HG22 H 0.223 -7.697 3.796 1.00 . A A . 30 THR HG22 1 1 4 2479 1 1 30 THR HG23 H 0.558 -5.971 3.660 1.00 . A A . 30 THR HG23 1 1 4 2480 1 1 30 THR N N -2.035 -7.826 1.405 1.00 . A A . 30 THR N 1 1 4 2481 1 1 30 THR O O -4.222 -7.217 4.221 1.00 . A A . 30 THR O 1 1 4 2482 1 1 30 THR OG1 O -1.796 -5.276 2.695 1.00 . A A . 30 THR OG1 1 1 4 2483 1 1 31 ASN C C -6.147 -5.542 2.716 1.00 . A A . 31 ASN C 1 1 4 2484 1 1 31 ASN CA C -5.959 -6.903 2.044 1.00 . A A . 31 ASN CA 1 1 4 2485 1 1 31 ASN CB C -6.812 -7.972 2.741 1.00 . A A . 31 ASN CB 1 1 4 2486 1 1 31 ASN CG C -6.996 -9.217 1.893 1.00 . A A . 31 ASN CG 1 1 4 2487 1 1 31 ASN H H -4.153 -7.487 1.123 1.00 . A A . 31 ASN H 1 1 4 2488 1 1 31 ASN HA H -6.292 -6.808 1.018 1.00 . A A . 31 ASN HA 1 1 4 2489 1 1 31 ASN HB2 H -6.332 -8.257 3.665 1.00 . A A . 31 ASN HB2 1 1 4 2490 1 1 31 ASN HB3 H -7.786 -7.558 2.959 1.00 . A A . 31 ASN HB3 1 1 4 2491 1 1 31 ASN HD21 H -5.411 -10.073 2.731 1.00 . A A . 31 ASN HD21 1 1 4 2492 1 1 31 ASN HD22 H -6.227 -11.014 1.529 1.00 . A A . 31 ASN HD22 1 1 4 2493 1 1 31 ASN N N -4.554 -7.287 1.997 1.00 . A A . 31 ASN N 1 1 4 2494 1 1 31 ASN ND2 N -6.125 -10.197 2.070 1.00 . A A . 31 ASN ND2 1 1 4 2495 1 1 31 ASN O O -6.976 -5.389 3.614 1.00 . A A . 31 ASN O 1 1 4 2496 1 1 31 ASN OD1 O -7.930 -9.302 1.094 1.00 . A A . 31 ASN OD1 1 1 4 2497 1 1 32 GLY C C -5.081 -2.775 4.042 1.00 . A A . 32 GLY C 1 1 4 2498 1 1 32 GLY CA C -5.627 -3.197 2.673 1.00 . A A . 32 GLY CA 1 1 4 2499 1 1 32 GLY H H -4.677 -4.725 1.583 1.00 . A A . 32 GLY H 1 1 4 2500 1 1 32 GLY HA2 H -5.198 -2.551 1.915 1.00 . A A . 32 GLY HA2 1 1 4 2501 1 1 32 GLY HA3 H -6.697 -3.042 2.674 1.00 . A A . 32 GLY HA3 1 1 4 2502 1 1 32 GLY N N -5.384 -4.548 2.265 1.00 . A A . 32 GLY N 1 1 4 2503 1 1 32 GLY O O -5.435 -1.693 4.505 1.00 . A A . 32 GLY O 1 1 4 2504 1 1 33 ASN C C -2.246 -2.587 5.747 1.00 . A A . 33 ASN C 1 1 4 2505 1 1 33 ASN CA C -3.678 -3.074 5.963 1.00 . A A . 33 ASN CA 1 1 4 2506 1 1 33 ASN CB C -3.804 -4.101 7.070 1.00 . A A . 33 ASN CB 1 1 4 2507 1 1 33 ASN CG C -2.695 -5.093 7.104 1.00 . A A . 33 ASN CG 1 1 4 2508 1 1 33 ASN H H -3.985 -4.451 4.406 1.00 . A A . 33 ASN H 1 1 4 2509 1 1 33 ASN HA H -4.268 -2.243 6.230 1.00 . A A . 33 ASN HA 1 1 4 2510 1 1 33 ASN HB2 H -3.831 -3.593 8.001 1.00 . A A . 33 ASN HB2 1 1 4 2511 1 1 33 ASN HB3 H -4.730 -4.637 6.930 1.00 . A A . 33 ASN HB3 1 1 4 2512 1 1 33 ASN HD21 H -3.493 -5.886 5.523 1.00 . A A . 33 ASN HD21 1 1 4 2513 1 1 33 ASN HD22 H -2.078 -6.693 6.130 1.00 . A A . 33 ASN HD22 1 1 4 2514 1 1 33 ASN N N -4.232 -3.563 4.720 1.00 . A A . 33 ASN N 1 1 4 2515 1 1 33 ASN ND2 N -2.750 -5.974 6.158 1.00 . A A . 33 ASN ND2 1 1 4 2516 1 1 33 ASN O O -1.426 -3.278 5.140 1.00 . A A . 33 ASN O 1 1 4 2517 1 1 33 ASN OD1 O -1.799 -5.037 7.941 1.00 . A A . 33 ASN OD1 1 1 4 2518 1 1 34 ALA C C 0.531 -1.084 6.276 1.00 . A A . 34 ALA C 1 1 4 2519 1 1 34 ALA CA C -0.818 -0.604 5.767 1.00 . A A . 34 ALA CA 1 1 4 2520 1 1 34 ALA CB C -1.006 0.866 6.104 1.00 . A A . 34 ALA CB 1 1 4 2521 1 1 34 ALA H H -2.571 -0.981 6.895 1.00 . A A . 34 ALA H 1 1 4 2522 1 1 34 ALA HA H -0.799 -0.689 4.699 1.00 . A A . 34 ALA HA 1 1 4 2523 1 1 34 ALA HB1 H -0.946 1.000 7.174 1.00 . A A . 34 ALA HB1 1 1 4 2524 1 1 34 ALA HB2 H -1.973 1.194 5.753 1.00 . A A . 34 ALA HB2 1 1 4 2525 1 1 34 ALA HB3 H -0.232 1.447 5.624 1.00 . A A . 34 ALA HB3 1 1 4 2526 1 1 34 ALA N N -1.969 -1.378 6.227 1.00 . A A . 34 ALA N 1 1 4 2527 1 1 34 ALA O O 1.512 -1.022 5.538 1.00 . A A . 34 ALA O 1 1 4 2528 1 1 35 GLU C C 2.439 -3.103 7.379 1.00 . A A . 35 GLU C 1 1 4 2529 1 1 35 GLU CA C 1.864 -1.902 8.068 1.00 . A A . 35 GLU CA 1 1 4 2530 1 1 35 GLU CB C 1.666 -2.131 9.538 1.00 . A A . 35 GLU CB 1 1 4 2531 1 1 35 GLU CD C 3.703 -1.029 10.507 1.00 . A A . 35 GLU CD 1 1 4 2532 1 1 35 GLU CG C 2.197 -1.015 10.371 1.00 . A A . 35 GLU CG 1 1 4 2533 1 1 35 GLU H H -0.173 -1.671 8.053 1.00 . A A . 35 GLU H 1 1 4 2534 1 1 35 GLU HA H 2.486 -1.097 7.925 1.00 . A A . 35 GLU HA 1 1 4 2535 1 1 35 GLU HB2 H 0.615 -2.209 9.738 1.00 . A A . 35 GLU HB2 1 1 4 2536 1 1 35 GLU HB3 H 2.139 -3.033 9.816 1.00 . A A . 35 GLU HB3 1 1 4 2537 1 1 35 GLU HG2 H 1.898 -0.098 9.910 1.00 . A A . 35 GLU HG2 1 1 4 2538 1 1 35 GLU HG3 H 1.756 -1.088 11.334 1.00 . A A . 35 GLU HG3 1 1 4 2539 1 1 35 GLU N N 0.612 -1.548 7.505 1.00 . A A . 35 GLU N 1 1 4 2540 1 1 35 GLU O O 3.610 -3.152 6.970 1.00 . A A . 35 GLU O 1 1 4 2541 1 1 35 GLU OE1 O 4.394 -0.632 9.540 1.00 . A A . 35 GLU OE1 1 1 4 2542 1 1 35 GLU OE2 O 4.209 -1.425 11.573 1.00 . A A . 35 GLU OE2 1 1 4 2543 1 1 36 PHE C C 2.110 -4.916 5.045 1.00 . A A . 36 PHE C 1 1 4 2544 1 1 36 PHE CA C 1.835 -5.243 6.485 1.00 . A A . 36 PHE CA 1 1 4 2545 1 1 36 PHE CB C 0.622 -6.157 6.612 1.00 . A A . 36 PHE CB 1 1 4 2546 1 1 36 PHE CD1 C 0.825 -6.257 9.077 1.00 . A A . 36 PHE CD1 1 1 4 2547 1 1 36 PHE CD2 C 0.424 -8.297 7.926 1.00 . A A . 36 PHE CD2 1 1 4 2548 1 1 36 PHE CE1 C 0.831 -6.903 10.260 1.00 . A A . 36 PHE CE1 1 1 4 2549 1 1 36 PHE CE2 C 0.428 -8.973 9.134 1.00 . A A . 36 PHE CE2 1 1 4 2550 1 1 36 PHE CG C 0.624 -6.927 7.892 1.00 . A A . 36 PHE CG 1 1 4 2551 1 1 36 PHE CZ C 0.633 -8.270 10.310 1.00 . A A . 36 PHE CZ 1 1 4 2552 1 1 36 PHE H H 0.675 -3.895 7.593 1.00 . A A . 36 PHE H 1 1 4 2553 1 1 36 PHE HA H 2.702 -5.714 6.918 1.00 . A A . 36 PHE HA 1 1 4 2554 1 1 36 PHE HB2 H -0.268 -5.541 6.607 1.00 . A A . 36 PHE HB2 1 1 4 2555 1 1 36 PHE HB3 H 0.572 -6.834 5.786 1.00 . A A . 36 PHE HB3 1 1 4 2556 1 1 36 PHE HD1 H 0.982 -5.195 9.069 1.00 . A A . 36 PHE HD1 1 1 4 2557 1 1 36 PHE HD2 H 0.266 -8.837 7.003 1.00 . A A . 36 PHE HD2 1 1 4 2558 1 1 36 PHE HE1 H 0.996 -6.331 11.144 1.00 . A A . 36 PHE HE1 1 1 4 2559 1 1 36 PHE HE2 H 0.273 -10.041 9.160 1.00 . A A . 36 PHE HE2 1 1 4 2560 1 1 36 PHE HZ H 0.637 -8.786 11.258 1.00 . A A . 36 PHE HZ 1 1 4 2561 1 1 36 PHE N N 1.563 -4.034 7.211 1.00 . A A . 36 PHE N 1 1 4 2562 1 1 36 PHE O O 2.885 -5.590 4.371 1.00 . A A . 36 PHE O 1 1 4 2563 1 1 37 ALA C C 2.950 -2.953 2.899 1.00 . A A . 37 ALA C 1 1 4 2564 1 1 37 ALA CA C 1.580 -3.460 3.214 1.00 . A A . 37 ALA CA 1 1 4 2565 1 1 37 ALA CB C 0.572 -2.395 2.943 1.00 . A A . 37 ALA CB 1 1 4 2566 1 1 37 ALA H H 0.974 -3.271 5.212 1.00 . A A . 37 ALA H 1 1 4 2567 1 1 37 ALA HA H 1.368 -4.317 2.597 1.00 . A A . 37 ALA HA 1 1 4 2568 1 1 37 ALA HB1 H 0.806 -1.525 3.537 1.00 . A A . 37 ALA HB1 1 1 4 2569 1 1 37 ALA HB2 H -0.412 -2.756 3.201 1.00 . A A . 37 ALA HB2 1 1 4 2570 1 1 37 ALA HB3 H 0.599 -2.133 1.896 1.00 . A A . 37 ALA HB3 1 1 4 2571 1 1 37 ALA N N 1.488 -3.848 4.588 1.00 . A A . 37 ALA N 1 1 4 2572 1 1 37 ALA O O 3.529 -3.308 1.899 1.00 . A A . 37 ALA O 1 1 4 2573 1 1 38 ALA C C 5.796 -2.580 3.519 1.00 . A A . 38 ALA C 1 1 4 2574 1 1 38 ALA CA C 4.743 -1.514 3.618 1.00 . A A . 38 ALA CA 1 1 4 2575 1 1 38 ALA CB C 5.042 -0.608 4.787 1.00 . A A . 38 ALA CB 1 1 4 2576 1 1 38 ALA H H 2.902 -1.869 4.526 1.00 . A A . 38 ALA H 1 1 4 2577 1 1 38 ALA HA H 4.746 -0.922 2.717 1.00 . A A . 38 ALA HA 1 1 4 2578 1 1 38 ALA HB1 H 4.276 0.148 4.860 1.00 . A A . 38 ALA HB1 1 1 4 2579 1 1 38 ALA HB2 H 6.002 -0.140 4.637 1.00 . A A . 38 ALA HB2 1 1 4 2580 1 1 38 ALA HB3 H 5.061 -1.193 5.692 1.00 . A A . 38 ALA HB3 1 1 4 2581 1 1 38 ALA N N 3.442 -2.109 3.767 1.00 . A A . 38 ALA N 1 1 4 2582 1 1 38 ALA O O 6.594 -2.580 2.598 1.00 . A A . 38 ALA O 1 1 4 2583 1 1 39 SER C C 6.709 -5.478 3.378 1.00 . A A . 39 SER C 1 1 4 2584 1 1 39 SER CA C 6.798 -4.512 4.534 1.00 . A A . 39 SER CA 1 1 4 2585 1 1 39 SER CB C 6.679 -5.252 5.861 1.00 . A A . 39 SER CB 1 1 4 2586 1 1 39 SER H H 4.923 -3.657 4.960 1.00 . A A . 39 SER H 1 1 4 2587 1 1 39 SER HA H 7.738 -3.987 4.493 1.00 . A A . 39 SER HA 1 1 4 2588 1 1 39 SER HB2 H 5.745 -5.791 5.883 1.00 . A A . 39 SER HB2 1 1 4 2589 1 1 39 SER HB3 H 7.500 -5.948 5.961 1.00 . A A . 39 SER HB3 1 1 4 2590 1 1 39 SER HG H 7.457 -3.743 6.843 1.00 . A A . 39 SER HG 1 1 4 2591 1 1 39 SER N N 5.733 -3.544 4.415 1.00 . A A . 39 SER N 1 1 4 2592 1 1 39 SER O O 7.692 -6.099 2.970 1.00 . A A . 39 SER O 1 1 4 2593 1 1 39 SER OG O 6.709 -4.349 6.949 1.00 . A A . 39 SER OG 1 1 4 2594 1 1 40 LEU C C 5.564 -5.738 0.445 1.00 . A A . 40 LEU C 1 1 4 2595 1 1 40 LEU CA C 5.247 -6.447 1.743 1.00 . A A . 40 LEU CA 1 1 4 2596 1 1 40 LEU CB C 3.803 -6.865 1.797 1.00 . A A . 40 LEU CB 1 1 4 2597 1 1 40 LEU CD1 C 4.501 -9.220 1.275 1.00 . A A . 40 LEU CD1 1 1 4 2598 1 1 40 LEU CD2 C 2.089 -8.651 1.437 1.00 . A A . 40 LEU CD2 1 1 4 2599 1 1 40 LEU CG C 3.456 -8.141 1.024 1.00 . A A . 40 LEU CG 1 1 4 2600 1 1 40 LEU H H 4.751 -5.089 3.254 1.00 . A A . 40 LEU H 1 1 4 2601 1 1 40 LEU HA H 5.873 -7.317 1.825 1.00 . A A . 40 LEU HA 1 1 4 2602 1 1 40 LEU HB2 H 3.543 -6.997 2.829 1.00 . A A . 40 LEU HB2 1 1 4 2603 1 1 40 LEU HB3 H 3.219 -6.051 1.414 1.00 . A A . 40 LEU HB3 1 1 4 2604 1 1 40 LEU HD11 H 4.234 -10.116 0.734 1.00 . A A . 40 LEU HD11 1 1 4 2605 1 1 40 LEU HD12 H 4.546 -9.438 2.331 1.00 . A A . 40 LEU HD12 1 1 4 2606 1 1 40 LEU HD13 H 5.467 -8.872 0.939 1.00 . A A . 40 LEU HD13 1 1 4 2607 1 1 40 LEU HD21 H 1.860 -9.552 0.887 1.00 . A A . 40 LEU HD21 1 1 4 2608 1 1 40 LEU HD22 H 1.344 -7.898 1.224 1.00 . A A . 40 LEU HD22 1 1 4 2609 1 1 40 LEU HD23 H 2.091 -8.867 2.495 1.00 . A A . 40 LEU HD23 1 1 4 2610 1 1 40 LEU HG H 3.433 -7.926 -0.035 1.00 . A A . 40 LEU HG 1 1 4 2611 1 1 40 LEU N N 5.505 -5.597 2.861 1.00 . A A . 40 LEU N 1 1 4 2612 1 1 40 LEU O O 6.136 -6.321 -0.460 1.00 . A A . 40 LEU O 1 1 4 2613 1 1 41 LEU C C 6.949 -3.472 -0.965 1.00 . A A . 41 LEU C 1 1 4 2614 1 1 41 LEU CA C 5.457 -3.733 -0.844 1.00 . A A . 41 LEU CA 1 1 4 2615 1 1 41 LEU CB C 4.612 -2.492 -0.844 1.00 . A A . 41 LEU CB 1 1 4 2616 1 1 41 LEU CD1 C 5.651 -0.534 -1.583 1.00 . A A . 41 LEU CD1 1 1 4 2617 1 1 41 LEU CD2 C 4.314 -0.481 0.479 1.00 . A A . 41 LEU CD2 1 1 4 2618 1 1 41 LEU CG C 5.266 -1.263 -0.364 1.00 . A A . 41 LEU CG 1 1 4 2619 1 1 41 LEU H H 4.808 -3.985 1.131 1.00 . A A . 41 LEU H 1 1 4 2620 1 1 41 LEU HA H 5.147 -4.337 -1.663 1.00 . A A . 41 LEU HA 1 1 4 2621 1 1 41 LEU HB2 H 4.280 -2.317 -1.856 1.00 . A A . 41 LEU HB2 1 1 4 2622 1 1 41 LEU HB3 H 3.747 -2.667 -0.237 1.00 . A A . 41 LEU HB3 1 1 4 2623 1 1 41 LEU HD11 H 6.260 0.311 -1.329 1.00 . A A . 41 LEU HD11 1 1 4 2624 1 1 41 LEU HD12 H 4.745 -0.212 -2.090 1.00 . A A . 41 LEU HD12 1 1 4 2625 1 1 41 LEU HD13 H 6.195 -1.217 -2.211 1.00 . A A . 41 LEU HD13 1 1 4 2626 1 1 41 LEU HD21 H 3.972 -1.113 1.283 1.00 . A A . 41 LEU HD21 1 1 4 2627 1 1 41 LEU HD22 H 3.475 -0.181 -0.125 1.00 . A A . 41 LEU HD22 1 1 4 2628 1 1 41 LEU HD23 H 4.814 0.389 0.881 1.00 . A A . 41 LEU HD23 1 1 4 2629 1 1 41 LEU HG H 6.145 -1.503 0.212 1.00 . A A . 41 LEU HG 1 1 4 2630 1 1 41 LEU N N 5.222 -4.470 0.354 1.00 . A A . 41 LEU N 1 1 4 2631 1 1 41 LEU O O 7.483 -3.302 -2.061 1.00 . A A . 41 LEU O 1 1 4 2632 1 1 42 PHE C C 9.803 -4.238 -0.554 1.00 . A A . 42 PHE C 1 1 4 2633 1 1 42 PHE CA C 9.038 -3.271 0.344 1.00 . A A . 42 PHE CA 1 1 4 2634 1 1 42 PHE CB C 9.459 -3.503 1.786 1.00 . A A . 42 PHE CB 1 1 4 2635 1 1 42 PHE CD1 C 9.071 -1.328 2.726 1.00 . A A . 42 PHE CD1 1 1 4 2636 1 1 42 PHE CD2 C 11.324 -2.031 2.578 1.00 . A A . 42 PHE CD2 1 1 4 2637 1 1 42 PHE CE1 C 9.455 -0.143 3.250 1.00 . A A . 42 PHE CE1 1 1 4 2638 1 1 42 PHE CE2 C 11.740 -0.830 3.121 1.00 . A A . 42 PHE CE2 1 1 4 2639 1 1 42 PHE CG C 9.975 -2.269 2.388 1.00 . A A . 42 PHE CG 1 1 4 2640 1 1 42 PHE CZ C 10.796 0.124 3.460 1.00 . A A . 42 PHE CZ 1 1 4 2641 1 1 42 PHE H H 7.070 -3.531 1.022 1.00 . A A . 42 PHE H 1 1 4 2642 1 1 42 PHE HA H 9.274 -2.240 0.093 1.00 . A A . 42 PHE HA 1 1 4 2643 1 1 42 PHE HB2 H 8.598 -3.798 2.367 1.00 . A A . 42 PHE HB2 1 1 4 2644 1 1 42 PHE HB3 H 10.215 -4.256 1.837 1.00 . A A . 42 PHE HB3 1 1 4 2645 1 1 42 PHE HD1 H 8.019 -1.548 2.574 1.00 . A A . 42 PHE HD1 1 1 4 2646 1 1 42 PHE HD2 H 12.046 -2.786 2.308 1.00 . A A . 42 PHE HD2 1 1 4 2647 1 1 42 PHE HE1 H 8.710 0.569 3.490 1.00 . A A . 42 PHE HE1 1 1 4 2648 1 1 42 PHE HE2 H 12.791 -0.636 3.279 1.00 . A A . 42 PHE HE2 1 1 4 2649 1 1 42 PHE HZ H 11.103 1.072 3.877 1.00 . A A . 42 PHE HZ 1 1 4 2650 1 1 42 PHE N N 7.597 -3.436 0.208 1.00 . A A . 42 PHE N 1 1 4 2651 1 1 42 PHE O O 10.989 -4.039 -0.824 1.00 . A A . 42 PHE O 1 1 4 2652 1 1 43 GLN C C 10.229 -5.599 -3.160 1.00 . A A . 43 GLN C 1 1 4 2653 1 1 43 GLN CA C 9.692 -6.279 -1.911 1.00 . A A . 43 GLN CA 1 1 4 2654 1 1 43 GLN CB C 8.641 -7.314 -2.306 1.00 . A A . 43 GLN CB 1 1 4 2655 1 1 43 GLN CD C 7.035 -9.114 -1.450 1.00 . A A . 43 GLN CD 1 1 4 2656 1 1 43 GLN CG C 8.300 -8.300 -1.194 1.00 . A A . 43 GLN CG 1 1 4 2657 1 1 43 GLN H H 8.182 -5.427 -0.675 1.00 . A A . 43 GLN H 1 1 4 2658 1 1 43 GLN HA H 10.501 -6.765 -1.413 1.00 . A A . 43 GLN HA 1 1 4 2659 1 1 43 GLN HB2 H 7.749 -6.791 -2.597 1.00 . A A . 43 GLN HB2 1 1 4 2660 1 1 43 GLN HB3 H 9.006 -7.874 -3.152 1.00 . A A . 43 GLN HB3 1 1 4 2661 1 1 43 GLN HE21 H 6.063 -7.523 -2.148 1.00 . A A . 43 GLN HE21 1 1 4 2662 1 1 43 GLN HE22 H 5.169 -8.985 -2.123 1.00 . A A . 43 GLN HE22 1 1 4 2663 1 1 43 GLN HG2 H 9.126 -8.986 -1.079 1.00 . A A . 43 GLN HG2 1 1 4 2664 1 1 43 GLN HG3 H 8.171 -7.747 -0.274 1.00 . A A . 43 GLN HG3 1 1 4 2665 1 1 43 GLN N N 9.116 -5.302 -0.987 1.00 . A A . 43 GLN N 1 1 4 2666 1 1 43 GLN NE2 N 5.985 -8.479 -1.963 1.00 . A A . 43 GLN NE2 1 1 4 2667 1 1 43 GLN O O 11.186 -6.061 -3.780 1.00 . A A . 43 GLN O 1 1 4 2668 1 1 43 GLN OE1 O 6.980 -10.296 -1.116 1.00 . A A . 43 GLN OE1 1 1 4 2669 1 1 44 SER C C 10.094 -2.238 -4.327 1.00 . A A . 44 SER C 1 1 4 2670 1 1 44 SER CA C 9.991 -3.723 -4.675 1.00 . A A . 44 SER CA 1 1 4 2671 1 1 44 SER CB C 8.976 -3.948 -5.802 1.00 . A A . 44 SER CB 1 1 4 2672 1 1 44 SER H H 8.879 -4.177 -2.931 1.00 . A A . 44 SER H 1 1 4 2673 1 1 44 SER HA H 10.959 -4.071 -5.000 1.00 . A A . 44 SER HA 1 1 4 2674 1 1 44 SER HB2 H 7.998 -3.625 -5.473 1.00 . A A . 44 SER HB2 1 1 4 2675 1 1 44 SER HB3 H 9.271 -3.377 -6.668 1.00 . A A . 44 SER HB3 1 1 4 2676 1 1 44 SER HG H 9.791 -5.712 -6.090 1.00 . A A . 44 SER HG 1 1 4 2677 1 1 44 SER N N 9.610 -4.495 -3.504 1.00 . A A . 44 SER N 1 1 4 2678 1 1 44 SER O O 11.146 -1.825 -3.791 1.00 . A A . 44 SER O 1 1 4 2679 1 1 44 SER OXT O 9.128 -1.493 -4.583 1.00 . A A . 44 SER OXT 1 1 4 2680 1 1 44 SER OG O 8.908 -5.322 -6.159 1.00 . A A . 44 SER OG 1 1 5 2681 1 1 1 GLY C C -15.353 -0.883 -0.363 1.00 . A A . 1 GLY C 1 1 5 2682 1 1 1 GLY CA C -15.936 -0.761 -1.752 1.00 . A A . 1 GLY CA 1 1 5 2683 1 1 1 GLY H1 H -17.614 -1.957 -1.434 1.00 . A A . 1 GLY H1 1 1 5 2684 1 1 1 GLY H2 H -16.267 -2.802 -2.014 1.00 . A A . 1 GLY H2 1 1 5 2685 1 1 1 GLY H3 H -17.164 -1.818 -3.061 1.00 . A A . 1 GLY H3 1 1 5 2686 1 1 1 GLY HA2 H -15.128 -0.708 -2.467 1.00 . A A . 1 GLY HA2 1 1 5 2687 1 1 1 GLY HA3 H -16.517 0.146 -1.811 1.00 . A A . 1 GLY HA3 1 1 5 2688 1 1 1 GLY N N -16.805 -1.913 -2.089 1.00 . A A . 1 GLY N 1 1 5 2689 1 1 1 GLY O O -16.086 -0.883 0.627 1.00 . A A . 1 GLY O 1 1 5 2690 1 1 2 SER C C -12.217 -0.131 1.094 1.00 . A A . 2 SER C 1 1 5 2691 1 1 2 SER CA C -13.354 -1.140 0.979 1.00 . A A . 2 SER CA 1 1 5 2692 1 1 2 SER CB C -12.807 -2.564 1.091 1.00 . A A . 2 SER CB 1 1 5 2693 1 1 2 SER H H -13.505 -0.953 -1.113 1.00 . A A . 2 SER H 1 1 5 2694 1 1 2 SER HA H -14.066 -0.968 1.771 1.00 . A A . 2 SER HA 1 1 5 2695 1 1 2 SER HB2 H -12.186 -2.640 1.969 1.00 . A A . 2 SER HB2 1 1 5 2696 1 1 2 SER HB3 H -13.631 -3.257 1.168 1.00 . A A . 2 SER HB3 1 1 5 2697 1 1 2 SER HG H -12.352 -3.741 -0.420 1.00 . A A . 2 SER HG 1 1 5 2698 1 1 2 SER N N -14.037 -0.986 -0.289 1.00 . A A . 2 SER N 1 1 5 2699 1 1 2 SER O O -11.715 0.367 0.087 1.00 . A A . 2 SER O 1 1 5 2700 1 1 2 SER OG O -12.029 -2.901 -0.051 1.00 . A A . 2 SER OG 1 1 5 2701 1 1 3 ALA C C -9.389 0.252 2.449 1.00 . A A . 3 ALA C 1 1 5 2702 1 1 3 ALA CA C -10.685 1.048 2.561 1.00 . A A . 3 ALA CA 1 1 5 2703 1 1 3 ALA CB C -10.800 1.707 3.928 1.00 . A A . 3 ALA CB 1 1 5 2704 1 1 3 ALA H H -12.330 -0.181 3.087 1.00 . A A . 3 ALA H 1 1 5 2705 1 1 3 ALA HA H -10.688 1.824 1.809 1.00 . A A . 3 ALA HA 1 1 5 2706 1 1 3 ALA HB1 H -11.718 2.275 3.978 1.00 . A A . 3 ALA HB1 1 1 5 2707 1 1 3 ALA HB2 H -9.959 2.367 4.080 1.00 . A A . 3 ALA HB2 1 1 5 2708 1 1 3 ALA HB3 H -10.804 0.946 4.694 1.00 . A A . 3 ALA HB3 1 1 5 2709 1 1 3 ALA N N -11.829 0.179 2.318 1.00 . A A . 3 ALA N 1 1 5 2710 1 1 3 ALA O O -8.614 0.160 3.403 1.00 . A A . 3 ALA O 1 1 5 2711 1 1 4 THR C C -6.798 -0.326 0.648 1.00 . A A . 4 THR C 1 1 5 2712 1 1 4 THR CA C -7.997 -1.145 1.030 1.00 . A A . 4 THR CA 1 1 5 2713 1 1 4 THR CB C -8.306 -2.200 -0.046 1.00 . A A . 4 THR CB 1 1 5 2714 1 1 4 THR CG2 C -8.720 -3.520 0.587 1.00 . A A . 4 THR CG2 1 1 5 2715 1 1 4 THR H H -9.809 -0.185 0.545 1.00 . A A . 4 THR H 1 1 5 2716 1 1 4 THR HA H -7.761 -1.635 1.901 1.00 . A A . 4 THR HA 1 1 5 2717 1 1 4 THR HB H -7.415 -2.363 -0.636 1.00 . A A . 4 THR HB 1 1 5 2718 1 1 4 THR HG1 H -10.176 -2.190 -0.700 1.00 . A A . 4 THR HG1 1 1 5 2719 1 1 4 THR HG21 H -8.905 -4.249 -0.188 1.00 . A A . 4 THR HG21 1 1 5 2720 1 1 4 THR HG22 H -9.620 -3.376 1.166 1.00 . A A . 4 THR HG22 1 1 5 2721 1 1 4 THR HG23 H -7.930 -3.873 1.233 1.00 . A A . 4 THR HG23 1 1 5 2722 1 1 4 THR N N -9.164 -0.320 1.275 1.00 . A A . 4 THR N 1 1 5 2723 1 1 4 THR O O -5.788 -0.295 1.337 1.00 . A A . 4 THR O 1 1 5 2724 1 1 4 THR OG1 O -9.354 -1.720 -0.903 1.00 . A A . 4 THR OG1 1 1 5 2725 1 1 5 PHE C C -6.368 2.724 -1.117 1.00 . A A . 5 PHE C 1 1 5 2726 1 1 5 PHE CA C -5.994 1.207 -1.065 1.00 . A A . 5 PHE CA 1 1 5 2727 1 1 5 PHE CB C -6.045 0.766 -2.479 1.00 . A A . 5 PHE CB 1 1 5 2728 1 1 5 PHE CD1 C -5.363 -1.508 -1.970 1.00 . A A . 5 PHE CD1 1 1 5 2729 1 1 5 PHE CD2 C -7.210 -1.254 -3.403 1.00 . A A . 5 PHE CD2 1 1 5 2730 1 1 5 PHE CE1 C -5.480 -2.810 -2.020 1.00 . A A . 5 PHE CE1 1 1 5 2731 1 1 5 PHE CE2 C -7.328 -2.628 -3.465 1.00 . A A . 5 PHE CE2 1 1 5 2732 1 1 5 PHE CG C -6.201 -0.692 -2.635 1.00 . A A . 5 PHE CG 1 1 5 2733 1 1 5 PHE CZ C -6.437 -3.400 -2.747 1.00 . A A . 5 PHE CZ 1 1 5 2734 1 1 5 PHE H H -7.845 0.311 -0.792 1.00 . A A . 5 PHE H 1 1 5 2735 1 1 5 PHE HA H -5.017 1.015 -0.654 1.00 . A A . 5 PHE HA 1 1 5 2736 1 1 5 PHE HB2 H -6.917 1.219 -2.853 1.00 . A A . 5 PHE HB2 1 1 5 2737 1 1 5 PHE HB3 H -5.168 1.087 -3.014 1.00 . A A . 5 PHE HB3 1 1 5 2738 1 1 5 PHE HD1 H -4.594 -1.109 -1.368 1.00 . A A . 5 PHE HD1 1 1 5 2739 1 1 5 PHE HD2 H -7.889 -0.618 -3.952 1.00 . A A . 5 PHE HD2 1 1 5 2740 1 1 5 PHE HE1 H -4.798 -3.374 -1.481 1.00 . A A . 5 PHE HE1 1 1 5 2741 1 1 5 PHE HE2 H -8.108 -3.089 -4.056 1.00 . A A . 5 PHE HE2 1 1 5 2742 1 1 5 PHE HZ H -6.491 -4.456 -2.735 1.00 . A A . 5 PHE HZ 1 1 5 2743 1 1 5 PHE N N -6.994 0.377 -0.412 1.00 . A A . 5 PHE N 1 1 5 2744 1 1 5 PHE O O -6.240 3.357 -2.166 1.00 . A A . 5 PHE O 1 1 5 2745 1 1 6 PRO C C -5.933 5.580 0.350 1.00 . A A . 6 PRO C 1 1 5 2746 1 1 6 PRO CA C -7.164 4.726 0.106 1.00 . A A . 6 PRO CA 1 1 5 2747 1 1 6 PRO CB C -8.084 4.758 1.308 1.00 . A A . 6 PRO CB 1 1 5 2748 1 1 6 PRO CD C -7.304 2.578 1.113 1.00 . A A . 6 PRO CD 1 1 5 2749 1 1 6 PRO CG C -7.673 3.627 2.101 1.00 . A A . 6 PRO CG 1 1 5 2750 1 1 6 PRO HA H -7.695 5.086 -0.734 1.00 . A A . 6 PRO HA 1 1 5 2751 1 1 6 PRO HB2 H -7.984 5.686 1.844 1.00 . A A . 6 PRO HB2 1 1 5 2752 1 1 6 PRO HB3 H -9.082 4.619 0.991 1.00 . A A . 6 PRO HB3 1 1 5 2753 1 1 6 PRO HD2 H -6.525 1.967 1.459 1.00 . A A . 6 PRO HD2 1 1 5 2754 1 1 6 PRO HD3 H -8.151 1.966 0.825 1.00 . A A . 6 PRO HD3 1 1 5 2755 1 1 6 PRO HG2 H -6.839 3.900 2.707 1.00 . A A . 6 PRO HG2 1 1 5 2756 1 1 6 PRO HG3 H -8.498 3.311 2.687 1.00 . A A . 6 PRO HG3 1 1 5 2757 1 1 6 PRO N N -6.862 3.302 -0.025 1.00 . A A . 6 PRO N 1 1 5 2758 1 1 6 PRO O O -4.895 5.094 0.783 1.00 . A A . 6 PRO O 1 1 5 2759 1 1 7 GLU C C -4.274 7.905 1.432 1.00 . A A . 7 GLU C 1 1 5 2760 1 1 7 GLU CA C -4.960 7.792 0.077 1.00 . A A . 7 GLU CA 1 1 5 2761 1 1 7 GLU CB C -5.410 9.155 -0.428 1.00 . A A . 7 GLU CB 1 1 5 2762 1 1 7 GLU CD C -6.075 10.519 -2.456 1.00 . A A . 7 GLU CD 1 1 5 2763 1 1 7 GLU CG C -5.637 9.171 -1.930 1.00 . A A . 7 GLU CG 1 1 5 2764 1 1 7 GLU H H -6.977 7.229 -0.068 1.00 . A A . 7 GLU H 1 1 5 2765 1 1 7 GLU HA H -4.242 7.398 -0.626 1.00 . A A . 7 GLU HA 1 1 5 2766 1 1 7 GLU HB2 H -6.335 9.422 0.062 1.00 . A A . 7 GLU HB2 1 1 5 2767 1 1 7 GLU HB3 H -4.659 9.884 -0.187 1.00 . A A . 7 GLU HB3 1 1 5 2768 1 1 7 GLU HG2 H -4.715 8.894 -2.420 1.00 . A A . 7 GLU HG2 1 1 5 2769 1 1 7 GLU HG3 H -6.398 8.444 -2.169 1.00 . A A . 7 GLU HG3 1 1 5 2770 1 1 7 GLU N N -6.078 6.875 0.094 1.00 . A A . 7 GLU N 1 1 5 2771 1 1 7 GLU O O -3.106 8.267 1.488 1.00 . A A . 7 GLU O 1 1 5 2772 1 1 7 GLU OE1 O -5.267 11.467 -2.419 1.00 . A A . 7 GLU OE1 1 1 5 2773 1 1 7 GLU OE2 O -7.224 10.625 -2.937 1.00 . A A . 7 GLU OE2 1 1 5 2774 1 1 8 GLN C C -3.168 6.588 3.788 1.00 . A A . 8 GLN C 1 1 5 2775 1 1 8 GLN CA C -4.350 7.540 3.836 1.00 . A A . 8 GLN CA 1 1 5 2776 1 1 8 GLN CB C -5.326 7.027 4.896 1.00 . A A . 8 GLN CB 1 1 5 2777 1 1 8 GLN CD C -7.702 6.989 5.723 1.00 . A A . 8 GLN CD 1 1 5 2778 1 1 8 GLN CG C -6.777 7.241 4.547 1.00 . A A . 8 GLN CG 1 1 5 2779 1 1 8 GLN H H -5.951 7.458 2.439 1.00 . A A . 8 GLN H 1 1 5 2780 1 1 8 GLN HA H -4.008 8.528 4.104 1.00 . A A . 8 GLN HA 1 1 5 2781 1 1 8 GLN HB2 H -5.169 5.970 5.029 1.00 . A A . 8 GLN HB2 1 1 5 2782 1 1 8 GLN HB3 H -5.123 7.531 5.830 1.00 . A A . 8 GLN HB3 1 1 5 2783 1 1 8 GLN HE21 H -7.523 8.879 6.313 1.00 . A A . 8 GLN HE21 1 1 5 2784 1 1 8 GLN HE22 H -8.527 7.872 7.299 1.00 . A A . 8 GLN HE22 1 1 5 2785 1 1 8 GLN HG2 H -6.894 8.245 4.210 1.00 . A A . 8 GLN HG2 1 1 5 2786 1 1 8 GLN HG3 H -7.041 6.563 3.749 1.00 . A A . 8 GLN HG3 1 1 5 2787 1 1 8 GLN N N -4.983 7.605 2.516 1.00 . A A . 8 GLN N 1 1 5 2788 1 1 8 GLN NE2 N -7.944 8.016 6.521 1.00 . A A . 8 GLN NE2 1 1 5 2789 1 1 8 GLN O O -2.025 6.953 4.069 1.00 . A A . 8 GLN O 1 1 5 2790 1 1 8 GLN OE1 O -8.195 5.875 5.912 1.00 . A A . 8 GLN OE1 1 1 5 2791 1 1 9 THR C C -1.609 4.491 2.125 1.00 . A A . 9 THR C 1 1 5 2792 1 1 9 THR CA C -2.516 4.307 3.317 1.00 . A A . 9 THR CA 1 1 5 2793 1 1 9 THR CB C -3.224 2.950 3.260 1.00 . A A . 9 THR CB 1 1 5 2794 1 1 9 THR CG2 C -3.980 2.686 4.549 1.00 . A A . 9 THR CG2 1 1 5 2795 1 1 9 THR H H -4.387 5.160 3.164 1.00 . A A . 9 THR H 1 1 5 2796 1 1 9 THR HA H -1.931 4.344 4.193 1.00 . A A . 9 THR HA 1 1 5 2797 1 1 9 THR HB H -2.483 2.200 3.134 1.00 . A A . 9 THR HB 1 1 5 2798 1 1 9 THR HG1 H -4.353 1.983 1.966 1.00 . A A . 9 THR HG1 1 1 5 2799 1 1 9 THR HG21 H -4.443 1.714 4.502 1.00 . A A . 9 THR HG21 1 1 5 2800 1 1 9 THR HG22 H -4.739 3.442 4.678 1.00 . A A . 9 THR HG22 1 1 5 2801 1 1 9 THR HG23 H -3.292 2.720 5.381 1.00 . A A . 9 THR HG23 1 1 5 2802 1 1 9 THR N N -3.475 5.363 3.403 1.00 . A A . 9 THR N 1 1 5 2803 1 1 9 THR O O -0.430 4.135 2.154 1.00 . A A . 9 THR O 1 1 5 2804 1 1 9 THR OG1 O -4.137 2.901 2.162 1.00 . A A . 9 THR OG1 1 1 5 2805 1 1 10 ILE C C -0.300 6.254 0.218 1.00 . A A . 10 ILE C 1 1 5 2806 1 1 10 ILE CA C -1.464 5.378 -0.116 1.00 . A A . 10 ILE CA 1 1 5 2807 1 1 10 ILE CB C -2.371 6.082 -1.131 1.00 . A A . 10 ILE CB 1 1 5 2808 1 1 10 ILE CD1 C -4.262 5.681 -2.737 1.00 . A A . 10 ILE CD1 1 1 5 2809 1 1 10 ILE CG1 C -3.261 5.061 -1.813 1.00 . A A . 10 ILE CG1 1 1 5 2810 1 1 10 ILE CG2 C -1.554 6.835 -2.156 1.00 . A A . 10 ILE CG2 1 1 5 2811 1 1 10 ILE H H -3.122 5.264 1.149 1.00 . A A . 10 ILE H 1 1 5 2812 1 1 10 ILE HA H -1.112 4.475 -0.560 1.00 . A A . 10 ILE HA 1 1 5 2813 1 1 10 ILE HB H -2.989 6.792 -0.601 1.00 . A A . 10 ILE HB 1 1 5 2814 1 1 10 ILE HD11 H -4.866 4.909 -3.183 1.00 . A A . 10 ILE HD11 1 1 5 2815 1 1 10 ILE HD12 H -3.745 6.230 -3.507 1.00 . A A . 10 ILE HD12 1 1 5 2816 1 1 10 ILE HD13 H -4.888 6.351 -2.169 1.00 . A A . 10 ILE HD13 1 1 5 2817 1 1 10 ILE HG12 H -2.649 4.386 -2.389 1.00 . A A . 10 ILE HG12 1 1 5 2818 1 1 10 ILE HG13 H -3.798 4.505 -1.063 1.00 . A A . 10 ILE HG13 1 1 5 2819 1 1 10 ILE HG21 H -0.947 7.568 -1.652 1.00 . A A . 10 ILE HG21 1 1 5 2820 1 1 10 ILE HG22 H -2.217 7.325 -2.850 1.00 . A A . 10 ILE HG22 1 1 5 2821 1 1 10 ILE HG23 H -0.921 6.141 -2.684 1.00 . A A . 10 ILE HG23 1 1 5 2822 1 1 10 ILE N N -2.181 5.054 1.091 1.00 . A A . 10 ILE N 1 1 5 2823 1 1 10 ILE O O 0.843 5.900 -0.007 1.00 . A A . 10 ILE O 1 1 5 2824 1 1 11 LYS C C 1.390 7.696 2.173 1.00 . A A . 11 LYS C 1 1 5 2825 1 1 11 LYS CA C 0.436 8.286 1.177 1.00 . A A . 11 LYS CA 1 1 5 2826 1 1 11 LYS CB C -0.158 9.592 1.662 1.00 . A A . 11 LYS CB 1 1 5 2827 1 1 11 LYS CD C -1.965 11.278 1.312 1.00 . A A . 11 LYS CD 1 1 5 2828 1 1 11 LYS CE C -2.921 11.931 0.324 1.00 . A A . 11 LYS CE 1 1 5 2829 1 1 11 LYS CG C -1.090 10.227 0.653 1.00 . A A . 11 LYS CG 1 1 5 2830 1 1 11 LYS H H -1.514 7.546 1.102 1.00 . A A . 11 LYS H 1 1 5 2831 1 1 11 LYS HA H 0.992 8.456 0.280 1.00 . A A . 11 LYS HA 1 1 5 2832 1 1 11 LYS HB2 H -0.717 9.401 2.558 1.00 . A A . 11 LYS HB2 1 1 5 2833 1 1 11 LYS HB3 H 0.639 10.286 1.878 1.00 . A A . 11 LYS HB3 1 1 5 2834 1 1 11 LYS HD2 H -2.541 10.809 2.095 1.00 . A A . 11 LYS HD2 1 1 5 2835 1 1 11 LYS HD3 H -1.329 12.037 1.741 1.00 . A A . 11 LYS HD3 1 1 5 2836 1 1 11 LYS HE2 H -3.460 11.154 -0.196 1.00 . A A . 11 LYS HE2 1 1 5 2837 1 1 11 LYS HE3 H -3.622 12.544 0.874 1.00 . A A . 11 LYS HE3 1 1 5 2838 1 1 11 LYS HG2 H -0.504 10.692 -0.126 1.00 . A A . 11 LYS HG2 1 1 5 2839 1 1 11 LYS HG3 H -1.718 9.447 0.227 1.00 . A A . 11 LYS HG3 1 1 5 2840 1 1 11 LYS HZ1 H -1.672 13.528 -0.194 1.00 . A A . 11 LYS HZ1 1 1 5 2841 1 1 11 LYS HZ2 H -2.910 13.225 -1.312 1.00 . A A . 11 LYS HZ2 1 1 5 2842 1 1 11 LYS HZ3 H -1.562 12.196 -1.246 1.00 . A A . 11 LYS HZ3 1 1 5 2843 1 1 11 LYS N N -0.585 7.354 0.847 1.00 . A A . 11 LYS N 1 1 5 2844 1 1 11 LYS NZ N -2.216 12.778 -0.676 1.00 . A A . 11 LYS NZ 1 1 5 2845 1 1 11 LYS O O 2.524 8.105 2.210 1.00 . A A . 11 LYS O 1 1 5 2846 1 1 12 GLN C C 2.855 5.256 3.139 1.00 . A A . 12 GLN C 1 1 5 2847 1 1 12 GLN CA C 1.789 6.069 3.895 1.00 . A A . 12 GLN CA 1 1 5 2848 1 1 12 GLN CB C 0.912 5.172 4.749 1.00 . A A . 12 GLN CB 1 1 5 2849 1 1 12 GLN CD C 1.610 6.448 6.796 1.00 . A A . 12 GLN CD 1 1 5 2850 1 1 12 GLN CG C 0.460 5.818 6.040 1.00 . A A . 12 GLN CG 1 1 5 2851 1 1 12 GLN H H -0.020 6.508 2.987 1.00 . A A . 12 GLN H 1 1 5 2852 1 1 12 GLN HA H 2.270 6.796 4.521 1.00 . A A . 12 GLN HA 1 1 5 2853 1 1 12 GLN HB2 H 0.024 4.916 4.182 1.00 . A A . 12 GLN HB2 1 1 5 2854 1 1 12 GLN HB3 H 1.442 4.289 4.967 1.00 . A A . 12 GLN HB3 1 1 5 2855 1 1 12 GLN HE21 H 1.321 8.164 5.841 1.00 . A A . 12 GLN HE21 1 1 5 2856 1 1 12 GLN HE22 H 2.639 8.137 6.953 1.00 . A A . 12 GLN HE22 1 1 5 2857 1 1 12 GLN HG2 H -0.268 6.584 5.813 1.00 . A A . 12 GLN HG2 1 1 5 2858 1 1 12 GLN HG3 H 0.007 5.063 6.661 1.00 . A A . 12 GLN HG3 1 1 5 2859 1 1 12 GLN N N 0.928 6.762 2.993 1.00 . A A . 12 GLN N 1 1 5 2860 1 1 12 GLN NE2 N 1.879 7.712 6.508 1.00 . A A . 12 GLN NE2 1 1 5 2861 1 1 12 GLN O O 4.052 5.305 3.443 1.00 . A A . 12 GLN O 1 1 5 2862 1 1 12 GLN OE1 O 2.249 5.807 7.634 1.00 . A A . 12 GLN OE1 1 1 5 2863 1 1 13 LEU C C 4.103 4.421 0.390 1.00 . A A . 13 LEU C 1 1 5 2864 1 1 13 LEU CA C 3.300 3.661 1.413 1.00 . A A . 13 LEU CA 1 1 5 2865 1 1 13 LEU CB C 2.483 2.568 0.773 1.00 . A A . 13 LEU CB 1 1 5 2866 1 1 13 LEU CD1 C 0.902 0.659 1.107 1.00 . A A . 13 LEU CD1 1 1 5 2867 1 1 13 LEU CD2 C 2.470 1.320 2.930 1.00 . A A . 13 LEU CD2 1 1 5 2868 1 1 13 LEU CG C 1.630 1.813 1.769 1.00 . A A . 13 LEU CG 1 1 5 2869 1 1 13 LEU H H 1.524 4.665 1.796 1.00 . A A . 13 LEU H 1 1 5 2870 1 1 13 LEU HA H 3.961 3.218 2.136 1.00 . A A . 13 LEU HA 1 1 5 2871 1 1 13 LEU HB2 H 1.841 3.010 0.026 1.00 . A A . 13 LEU HB2 1 1 5 2872 1 1 13 LEU HB3 H 3.144 1.884 0.302 1.00 . A A . 13 LEU HB3 1 1 5 2873 1 1 13 LEU HD11 H 1.622 -0.045 0.716 1.00 . A A . 13 LEU HD11 1 1 5 2874 1 1 13 LEU HD12 H 0.292 1.034 0.298 1.00 . A A . 13 LEU HD12 1 1 5 2875 1 1 13 LEU HD13 H 0.272 0.165 1.832 1.00 . A A . 13 LEU HD13 1 1 5 2876 1 1 13 LEU HD21 H 1.849 0.753 3.610 1.00 . A A . 13 LEU HD21 1 1 5 2877 1 1 13 LEU HD22 H 2.896 2.164 3.451 1.00 . A A . 13 LEU HD22 1 1 5 2878 1 1 13 LEU HD23 H 3.265 0.688 2.559 1.00 . A A . 13 LEU HD23 1 1 5 2879 1 1 13 LEU HG H 0.906 2.504 2.158 1.00 . A A . 13 LEU HG 1 1 5 2880 1 1 13 LEU N N 2.431 4.556 2.110 1.00 . A A . 13 LEU N 1 1 5 2881 1 1 13 LEU O O 5.293 4.181 0.207 1.00 . A A . 13 LEU O 1 1 5 2882 1 1 14 MET C C 5.090 7.119 -0.358 1.00 . A A . 14 MET C 1 1 5 2883 1 1 14 MET CA C 4.115 6.262 -1.151 1.00 . A A . 14 MET CA 1 1 5 2884 1 1 14 MET CB C 3.053 7.085 -1.816 1.00 . A A . 14 MET CB 1 1 5 2885 1 1 14 MET CE C 2.762 3.602 -2.458 1.00 . A A . 14 MET CE 1 1 5 2886 1 1 14 MET CG C 2.306 6.348 -2.908 1.00 . A A . 14 MET CG 1 1 5 2887 1 1 14 MET H H 2.443 5.406 -0.239 1.00 . A A . 14 MET H 1 1 5 2888 1 1 14 MET HA H 4.647 5.699 -1.901 1.00 . A A . 14 MET HA 1 1 5 2889 1 1 14 MET HB2 H 2.333 7.385 -1.075 1.00 . A A . 14 MET HB2 1 1 5 2890 1 1 14 MET HB3 H 3.510 7.960 -2.245 1.00 . A A . 14 MET HB3 1 1 5 2891 1 1 14 MET HE1 H 3.171 3.533 -3.454 1.00 . A A . 14 MET HE1 1 1 5 2892 1 1 14 MET HE2 H 2.368 2.642 -2.162 1.00 . A A . 14 MET HE2 1 1 5 2893 1 1 14 MET HE3 H 3.537 3.906 -1.770 1.00 . A A . 14 MET HE3 1 1 5 2894 1 1 14 MET HG2 H 1.571 7.006 -3.264 1.00 . A A . 14 MET HG2 1 1 5 2895 1 1 14 MET HG3 H 3.003 6.129 -3.686 1.00 . A A . 14 MET HG3 1 1 5 2896 1 1 14 MET N N 3.446 5.349 -0.284 1.00 . A A . 14 MET N 1 1 5 2897 1 1 14 MET O O 6.070 7.633 -0.888 1.00 . A A . 14 MET O 1 1 5 2898 1 1 14 MET SD S 1.452 4.815 -2.439 1.00 . A A . 14 MET SD 1 1 5 2899 1 1 15 ASP C C 7.018 7.235 1.998 1.00 . A A . 15 ASP C 1 1 5 2900 1 1 15 ASP CA C 5.664 7.920 1.888 1.00 . A A . 15 ASP CA 1 1 5 2901 1 1 15 ASP CB C 4.986 7.966 3.256 1.00 . A A . 15 ASP CB 1 1 5 2902 1 1 15 ASP CG C 5.862 8.532 4.354 1.00 . A A . 15 ASP CG 1 1 5 2903 1 1 15 ASP H H 3.951 6.860 1.243 1.00 . A A . 15 ASP H 1 1 5 2904 1 1 15 ASP HA H 5.813 8.931 1.538 1.00 . A A . 15 ASP HA 1 1 5 2905 1 1 15 ASP HB2 H 4.107 8.589 3.172 1.00 . A A . 15 ASP HB2 1 1 5 2906 1 1 15 ASP HB3 H 4.670 6.958 3.526 1.00 . A A . 15 ASP HB3 1 1 5 2907 1 1 15 ASP N N 4.799 7.238 0.927 1.00 . A A . 15 ASP N 1 1 5 2908 1 1 15 ASP O O 8.036 7.904 2.192 1.00 . A A . 15 ASP O 1 1 5 2909 1 1 15 ASP OD1 O 6.184 9.736 4.311 1.00 . A A . 15 ASP OD1 1 1 5 2910 1 1 15 ASP OD2 O 6.243 7.765 5.260 1.00 . A A . 15 ASP OD2 1 1 5 2911 1 1 16 LEU C C 9.102 5.617 0.582 1.00 . A A . 16 LEU C 1 1 5 2912 1 1 16 LEU CA C 8.282 5.193 1.799 1.00 . A A . 16 LEU CA 1 1 5 2913 1 1 16 LEU CB C 7.938 3.754 1.696 1.00 . A A . 16 LEU CB 1 1 5 2914 1 1 16 LEU CD1 C 8.542 3.494 4.100 1.00 . A A . 16 LEU CD1 1 1 5 2915 1 1 16 LEU CD2 C 6.164 3.334 3.361 1.00 . A A . 16 LEU CD2 1 1 5 2916 1 1 16 LEU CG C 7.595 3.081 2.987 1.00 . A A . 16 LEU CG 1 1 5 2917 1 1 16 LEU H H 6.213 5.353 1.874 1.00 . A A . 16 LEU H 1 1 5 2918 1 1 16 LEU HA H 8.841 5.347 2.705 1.00 . A A . 16 LEU HA 1 1 5 2919 1 1 16 LEU HB2 H 7.090 3.656 1.038 1.00 . A A . 16 LEU HB2 1 1 5 2920 1 1 16 LEU HB3 H 8.743 3.250 1.267 1.00 . A A . 16 LEU HB3 1 1 5 2921 1 1 16 LEU HD11 H 8.287 2.968 5.007 1.00 . A A . 16 LEU HD11 1 1 5 2922 1 1 16 LEU HD12 H 8.457 4.559 4.262 1.00 . A A . 16 LEU HD12 1 1 5 2923 1 1 16 LEU HD13 H 9.558 3.255 3.817 1.00 . A A . 16 LEU HD13 1 1 5 2924 1 1 16 LEU HD21 H 5.531 3.024 2.545 1.00 . A A . 16 LEU HD21 1 1 5 2925 1 1 16 LEU HD22 H 6.027 4.388 3.539 1.00 . A A . 16 LEU HD22 1 1 5 2926 1 1 16 LEU HD23 H 5.917 2.777 4.250 1.00 . A A . 16 LEU HD23 1 1 5 2927 1 1 16 LEU HG H 7.702 2.056 2.819 1.00 . A A . 16 LEU HG 1 1 5 2928 1 1 16 LEU N N 7.047 5.902 1.881 1.00 . A A . 16 LEU N 1 1 5 2929 1 1 16 LEU O O 10.329 5.499 0.566 1.00 . A A . 16 LEU O 1 1 5 2930 1 1 17 GLY C C 8.519 5.704 -2.852 1.00 . A A . 17 GLY C 1 1 5 2931 1 1 17 GLY CA C 9.039 6.501 -1.674 1.00 . A A . 17 GLY CA 1 1 5 2932 1 1 17 GLY H H 7.428 6.166 -0.341 1.00 . A A . 17 GLY H 1 1 5 2933 1 1 17 GLY HA2 H 8.845 7.552 -1.841 1.00 . A A . 17 GLY HA2 1 1 5 2934 1 1 17 GLY HA3 H 10.105 6.348 -1.591 1.00 . A A . 17 GLY HA3 1 1 5 2935 1 1 17 GLY N N 8.402 6.090 -0.436 1.00 . A A . 17 GLY N 1 1 5 2936 1 1 17 GLY O O 9.105 5.710 -3.934 1.00 . A A . 17 GLY O 1 1 5 2937 1 1 18 PHE C C 5.744 4.836 -4.450 1.00 . A A . 18 PHE C 1 1 5 2938 1 1 18 PHE CA C 6.817 4.133 -3.620 1.00 . A A . 18 PHE CA 1 1 5 2939 1 1 18 PHE CB C 6.198 2.965 -2.903 1.00 . A A . 18 PHE CB 1 1 5 2940 1 1 18 PHE CD1 C 8.241 1.540 -2.857 1.00 . A A . 18 PHE CD1 1 1 5 2941 1 1 18 PHE CD2 C 7.022 2.008 -0.910 1.00 . A A . 18 PHE CD2 1 1 5 2942 1 1 18 PHE CE1 C 9.121 0.783 -2.121 1.00 . A A . 18 PHE CE1 1 1 5 2943 1 1 18 PHE CE2 C 7.855 1.280 -0.182 1.00 . A A . 18 PHE CE2 1 1 5 2944 1 1 18 PHE CG C 7.183 2.154 -2.215 1.00 . A A . 18 PHE CG 1 1 5 2945 1 1 18 PHE CZ C 8.910 0.660 -0.765 1.00 . A A . 18 PHE CZ 1 1 5 2946 1 1 18 PHE H H 7.045 5.003 -1.715 1.00 . A A . 18 PHE H 1 1 5 2947 1 1 18 PHE HA H 7.594 3.764 -4.262 1.00 . A A . 18 PHE HA 1 1 5 2948 1 1 18 PHE HB2 H 5.513 3.335 -2.161 1.00 . A A . 18 PHE HB2 1 1 5 2949 1 1 18 PHE HB3 H 5.676 2.331 -3.564 1.00 . A A . 18 PHE HB3 1 1 5 2950 1 1 18 PHE HD1 H 8.373 1.658 -3.921 1.00 . A A . 18 PHE HD1 1 1 5 2951 1 1 18 PHE HD2 H 6.210 2.491 -0.452 1.00 . A A . 18 PHE HD2 1 1 5 2952 1 1 18 PHE HE1 H 9.958 0.293 -2.596 1.00 . A A . 18 PHE HE1 1 1 5 2953 1 1 18 PHE HE2 H 7.676 1.198 0.850 1.00 . A A . 18 PHE HE2 1 1 5 2954 1 1 18 PHE HZ H 9.556 0.091 -0.167 1.00 . A A . 18 PHE HZ 1 1 5 2955 1 1 18 PHE N N 7.430 4.991 -2.616 1.00 . A A . 18 PHE N 1 1 5 2956 1 1 18 PHE O O 5.265 5.913 -4.098 1.00 . A A . 18 PHE O 1 1 5 2957 1 1 19 PRO C C 2.929 4.171 -5.977 1.00 . A A . 19 PRO C 1 1 5 2958 1 1 19 PRO CA C 4.293 4.640 -6.458 1.00 . A A . 19 PRO CA 1 1 5 2959 1 1 19 PRO CB C 4.628 3.917 -7.736 1.00 . A A . 19 PRO CB 1 1 5 2960 1 1 19 PRO CD C 5.991 2.975 -6.094 1.00 . A A . 19 PRO CD 1 1 5 2961 1 1 19 PRO CG C 5.065 2.623 -7.235 1.00 . A A . 19 PRO CG 1 1 5 2962 1 1 19 PRO HA H 4.290 5.706 -6.623 1.00 . A A . 19 PRO HA 1 1 5 2963 1 1 19 PRO HB2 H 3.759 3.841 -8.366 1.00 . A A . 19 PRO HB2 1 1 5 2964 1 1 19 PRO HB3 H 5.428 4.410 -8.245 1.00 . A A . 19 PRO HB3 1 1 5 2965 1 1 19 PRO HD2 H 5.990 2.209 -5.323 1.00 . A A . 19 PRO HD2 1 1 5 2966 1 1 19 PRO HD3 H 6.989 3.158 -6.458 1.00 . A A . 19 PRO HD3 1 1 5 2967 1 1 19 PRO HG2 H 4.218 2.045 -6.889 1.00 . A A . 19 PRO HG2 1 1 5 2968 1 1 19 PRO HG3 H 5.578 2.122 -8.008 1.00 . A A . 19 PRO HG3 1 1 5 2969 1 1 19 PRO N N 5.382 4.214 -5.579 1.00 . A A . 19 PRO N 1 1 5 2970 1 1 19 PRO O O 2.828 3.252 -5.183 1.00 . A A . 19 PRO O 1 1 5 2971 1 1 20 ARG C C 0.208 2.963 -6.383 1.00 . A A . 20 ARG C 1 1 5 2972 1 1 20 ARG CA C 0.523 4.434 -6.167 1.00 . A A . 20 ARG CA 1 1 5 2973 1 1 20 ARG CB C -0.409 5.285 -7.011 1.00 . A A . 20 ARG CB 1 1 5 2974 1 1 20 ARG CD C -2.754 5.929 -7.558 1.00 . A A . 20 ARG CD 1 1 5 2975 1 1 20 ARG CG C -1.860 4.928 -6.851 1.00 . A A . 20 ARG CG 1 1 5 2976 1 1 20 ARG CZ C -5.152 6.504 -7.695 1.00 . A A . 20 ARG CZ 1 1 5 2977 1 1 20 ARG H H 2.063 5.356 -7.277 1.00 . A A . 20 ARG H 1 1 5 2978 1 1 20 ARG HA H 0.387 4.670 -5.120 1.00 . A A . 20 ARG HA 1 1 5 2979 1 1 20 ARG HB2 H -0.278 6.316 -6.744 1.00 . A A . 20 ARG HB2 1 1 5 2980 1 1 20 ARG HB3 H -0.150 5.159 -8.048 1.00 . A A . 20 ARG HB3 1 1 5 2981 1 1 20 ARG HD2 H -2.441 6.924 -7.276 1.00 . A A . 20 ARG HD2 1 1 5 2982 1 1 20 ARG HD3 H -2.634 5.807 -8.624 1.00 . A A . 20 ARG HD3 1 1 5 2983 1 1 20 ARG HE H -4.387 5.032 -6.574 1.00 . A A . 20 ARG HE 1 1 5 2984 1 1 20 ARG HG2 H -2.017 3.952 -7.276 1.00 . A A . 20 ARG HG2 1 1 5 2985 1 1 20 ARG HG3 H -2.093 4.910 -5.808 1.00 . A A . 20 ARG HG3 1 1 5 2986 1 1 20 ARG HH11 H -3.944 7.651 -8.853 1.00 . A A . 20 ARG HH11 1 1 5 2987 1 1 20 ARG HH12 H -5.637 8.040 -8.934 1.00 . A A . 20 ARG HH12 1 1 5 2988 1 1 20 ARG HH21 H -6.604 5.547 -6.659 1.00 . A A . 20 ARG HH21 1 1 5 2989 1 1 20 ARG HH22 H -7.151 6.854 -7.666 1.00 . A A . 20 ARG HH22 1 1 5 2990 1 1 20 ARG N N 1.897 4.738 -6.544 1.00 . A A . 20 ARG N 1 1 5 2991 1 1 20 ARG NE N -4.164 5.753 -7.213 1.00 . A A . 20 ARG NE 1 1 5 2992 1 1 20 ARG NH1 N -4.889 7.476 -8.561 1.00 . A A . 20 ARG NH1 1 1 5 2993 1 1 20 ARG NH2 N -6.402 6.282 -7.311 1.00 . A A . 20 ARG NH2 1 1 5 2994 1 1 20 ARG O O -0.437 2.318 -5.549 1.00 . A A . 20 ARG O 1 1 5 2995 1 1 21 ASP C C 1.014 0.154 -6.712 1.00 . A A . 21 ASP C 1 1 5 2996 1 1 21 ASP CA C 0.497 1.034 -7.840 1.00 . A A . 21 ASP CA 1 1 5 2997 1 1 21 ASP CB C 1.220 0.667 -9.141 1.00 . A A . 21 ASP CB 1 1 5 2998 1 1 21 ASP CG C 0.483 1.128 -10.382 1.00 . A A . 21 ASP CG 1 1 5 2999 1 1 21 ASP H H 1.147 3.046 -8.130 1.00 . A A . 21 ASP H 1 1 5 3000 1 1 21 ASP HA H -0.561 0.854 -7.963 1.00 . A A . 21 ASP HA 1 1 5 3001 1 1 21 ASP HB2 H 2.199 1.124 -9.141 1.00 . A A . 21 ASP HB2 1 1 5 3002 1 1 21 ASP HB3 H 1.332 -0.407 -9.191 1.00 . A A . 21 ASP HB3 1 1 5 3003 1 1 21 ASP N N 0.672 2.450 -7.506 1.00 . A A . 21 ASP N 1 1 5 3004 1 1 21 ASP O O 0.505 -0.939 -6.480 1.00 . A A . 21 ASP O 1 1 5 3005 1 1 21 ASP OD1 O -0.394 0.382 -10.865 1.00 . A A . 21 ASP OD1 1 1 5 3006 1 1 21 ASP OD2 O 0.764 2.243 -10.871 1.00 . A A . 21 ASP OD2 1 1 5 3007 1 1 22 ALA C C 1.678 -0.202 -3.709 1.00 . A A . 22 ALA C 1 1 5 3008 1 1 22 ALA CA C 2.618 -0.088 -4.907 1.00 . A A . 22 ALA CA 1 1 5 3009 1 1 22 ALA CB C 3.929 0.549 -4.497 1.00 . A A . 22 ALA CB 1 1 5 3010 1 1 22 ALA H H 2.342 1.555 -6.204 1.00 . A A . 22 ALA H 1 1 5 3011 1 1 22 ALA HA H 2.835 -1.082 -5.271 1.00 . A A . 22 ALA HA 1 1 5 3012 1 1 22 ALA HB1 H 4.414 -0.068 -3.756 1.00 . A A . 22 ALA HB1 1 1 5 3013 1 1 22 ALA HB2 H 3.739 1.527 -4.083 1.00 . A A . 22 ALA HB2 1 1 5 3014 1 1 22 ALA HB3 H 4.570 0.643 -5.363 1.00 . A A . 22 ALA HB3 1 1 5 3015 1 1 22 ALA N N 2.011 0.654 -5.995 1.00 . A A . 22 ALA N 1 1 5 3016 1 1 22 ALA O O 1.721 -1.199 -2.997 1.00 . A A . 22 ALA O 1 1 5 3017 1 1 23 VAL C C -1.077 -0.420 -2.760 1.00 . A A . 23 VAL C 1 1 5 3018 1 1 23 VAL CA C -0.174 0.722 -2.434 1.00 . A A . 23 VAL CA 1 1 5 3019 1 1 23 VAL CB C -0.997 2.033 -2.267 1.00 . A A . 23 VAL CB 1 1 5 3020 1 1 23 VAL CG1 C -2.336 1.998 -2.975 1.00 . A A . 23 VAL CG1 1 1 5 3021 1 1 23 VAL CG2 C -1.229 2.313 -0.814 1.00 . A A . 23 VAL CG2 1 1 5 3022 1 1 23 VAL H H 0.853 1.600 -4.048 1.00 . A A . 23 VAL H 1 1 5 3023 1 1 23 VAL HA H 0.318 0.509 -1.511 1.00 . A A . 23 VAL HA 1 1 5 3024 1 1 23 VAL HB H -0.424 2.840 -2.682 1.00 . A A . 23 VAL HB 1 1 5 3025 1 1 23 VAL HG11 H -2.855 2.933 -2.827 1.00 . A A . 23 VAL HG11 1 1 5 3026 1 1 23 VAL HG12 H -2.932 1.186 -2.566 1.00 . A A . 23 VAL HG12 1 1 5 3027 1 1 23 VAL HG13 H -2.166 1.833 -4.024 1.00 . A A . 23 VAL HG13 1 1 5 3028 1 1 23 VAL HG21 H -1.933 1.583 -0.423 1.00 . A A . 23 VAL HG21 1 1 5 3029 1 1 23 VAL HG22 H -1.646 3.302 -0.703 1.00 . A A . 23 VAL HG22 1 1 5 3030 1 1 23 VAL HG23 H -0.293 2.247 -0.285 1.00 . A A . 23 VAL HG23 1 1 5 3031 1 1 23 VAL N N 0.824 0.807 -3.486 1.00 . A A . 23 VAL N 1 1 5 3032 1 1 23 VAL O O -1.313 -1.304 -1.958 1.00 . A A . 23 VAL O 1 1 5 3033 1 1 24 VAL C C -1.848 -2.797 -4.405 1.00 . A A . 24 VAL C 1 1 5 3034 1 1 24 VAL CA C -2.439 -1.402 -4.444 1.00 . A A . 24 VAL CA 1 1 5 3035 1 1 24 VAL CB C -2.945 -1.060 -5.843 1.00 . A A . 24 VAL CB 1 1 5 3036 1 1 24 VAL CG1 C -3.671 -2.247 -6.447 1.00 . A A . 24 VAL CG1 1 1 5 3037 1 1 24 VAL CG2 C -3.864 0.146 -5.773 1.00 . A A . 24 VAL CG2 1 1 5 3038 1 1 24 VAL H H -1.211 0.309 -4.588 1.00 . A A . 24 VAL H 1 1 5 3039 1 1 24 VAL HA H -3.280 -1.381 -3.768 1.00 . A A . 24 VAL HA 1 1 5 3040 1 1 24 VAL HB H -2.088 -0.802 -6.457 1.00 . A A . 24 VAL HB 1 1 5 3041 1 1 24 VAL HG11 H -4.464 -2.557 -5.776 1.00 . A A . 24 VAL HG11 1 1 5 3042 1 1 24 VAL HG12 H -2.974 -3.062 -6.579 1.00 . A A . 24 VAL HG12 1 1 5 3043 1 1 24 VAL HG13 H -4.091 -1.970 -7.401 1.00 . A A . 24 VAL HG13 1 1 5 3044 1 1 24 VAL HG21 H -4.287 0.337 -6.748 1.00 . A A . 24 VAL HG21 1 1 5 3045 1 1 24 VAL HG22 H -3.302 1.007 -5.444 1.00 . A A . 24 VAL HG22 1 1 5 3046 1 1 24 VAL HG23 H -4.658 -0.054 -5.066 1.00 . A A . 24 VAL HG23 1 1 5 3047 1 1 24 VAL N N -1.506 -0.420 -3.985 1.00 . A A . 24 VAL N 1 1 5 3048 1 1 24 VAL O O -2.442 -3.681 -3.817 1.00 . A A . 24 VAL O 1 1 5 3049 1 1 25 LYS C C 0.176 -4.793 -3.590 1.00 . A A . 25 LYS C 1 1 5 3050 1 1 25 LYS CA C -0.058 -4.306 -5.008 1.00 . A A . 25 LYS CA 1 1 5 3051 1 1 25 LYS CB C 1.266 -4.276 -5.776 1.00 . A A . 25 LYS CB 1 1 5 3052 1 1 25 LYS CD C 0.036 -4.520 -7.872 1.00 . A A . 25 LYS CD 1 1 5 3053 1 1 25 LYS CE C 0.209 -4.560 -9.381 1.00 . A A . 25 LYS CE 1 1 5 3054 1 1 25 LYS CG C 1.128 -3.776 -7.194 1.00 . A A . 25 LYS CG 1 1 5 3055 1 1 25 LYS H H -0.212 -2.243 -5.415 1.00 . A A . 25 LYS H 1 1 5 3056 1 1 25 LYS HA H -0.737 -4.984 -5.504 1.00 . A A . 25 LYS HA 1 1 5 3057 1 1 25 LYS HB2 H 1.948 -3.642 -5.266 1.00 . A A . 25 LYS HB2 1 1 5 3058 1 1 25 LYS HB3 H 1.671 -5.275 -5.810 1.00 . A A . 25 LYS HB3 1 1 5 3059 1 1 25 LYS HD2 H 0.047 -5.497 -7.471 1.00 . A A . 25 LYS HD2 1 1 5 3060 1 1 25 LYS HD3 H -0.907 -4.045 -7.638 1.00 . A A . 25 LYS HD3 1 1 5 3061 1 1 25 LYS HE2 H 1.177 -4.982 -9.610 1.00 . A A . 25 LYS HE2 1 1 5 3062 1 1 25 LYS HE3 H -0.564 -5.184 -9.803 1.00 . A A . 25 LYS HE3 1 1 5 3063 1 1 25 LYS HG2 H 0.878 -2.737 -7.178 1.00 . A A . 25 LYS HG2 1 1 5 3064 1 1 25 LYS HG3 H 2.054 -3.931 -7.725 1.00 . A A . 25 LYS HG3 1 1 5 3065 1 1 25 LYS HZ1 H -0.761 -2.733 -9.670 1.00 . A A . 25 LYS HZ1 1 1 5 3066 1 1 25 LYS HZ2 H 0.112 -3.270 -11.020 1.00 . A A . 25 LYS HZ2 1 1 5 3067 1 1 25 LYS HZ3 H 0.931 -2.627 -9.689 1.00 . A A . 25 LYS HZ3 1 1 5 3068 1 1 25 LYS N N -0.674 -2.992 -4.990 1.00 . A A . 25 LYS N 1 1 5 3069 1 1 25 LYS NZ N 0.118 -3.205 -9.979 1.00 . A A . 25 LYS NZ 1 1 5 3070 1 1 25 LYS O O -0.075 -5.952 -3.268 1.00 . A A . 25 LYS O 1 1 5 3071 1 1 26 ALA C C -0.262 -4.475 -0.516 1.00 . A A . 26 ALA C 1 1 5 3072 1 1 26 ALA CA C 0.961 -4.234 -1.368 1.00 . A A . 26 ALA CA 1 1 5 3073 1 1 26 ALA CB C 1.809 -3.159 -0.733 1.00 . A A . 26 ALA CB 1 1 5 3074 1 1 26 ALA H H 0.658 -2.936 -3.028 1.00 . A A . 26 ALA H 1 1 5 3075 1 1 26 ALA HA H 1.540 -5.144 -1.405 1.00 . A A . 26 ALA HA 1 1 5 3076 1 1 26 ALA HB1 H 2.179 -3.507 0.223 1.00 . A A . 26 ALA HB1 1 1 5 3077 1 1 26 ALA HB2 H 1.213 -2.272 -0.587 1.00 . A A . 26 ALA HB2 1 1 5 3078 1 1 26 ALA HB3 H 2.644 -2.931 -1.380 1.00 . A A . 26 ALA HB3 1 1 5 3079 1 1 26 ALA N N 0.601 -3.880 -2.732 1.00 . A A . 26 ALA N 1 1 5 3080 1 1 26 ALA O O -0.293 -5.395 0.295 1.00 . A A . 26 ALA O 1 1 5 3081 1 1 27 LEU C C -3.307 -4.915 -0.444 1.00 . A A . 27 LEU C 1 1 5 3082 1 1 27 LEU CA C -2.471 -3.776 0.086 1.00 . A A . 27 LEU CA 1 1 5 3083 1 1 27 LEU CB C -3.229 -2.513 0.061 1.00 . A A . 27 LEU CB 1 1 5 3084 1 1 27 LEU CD1 C -3.189 -0.154 0.222 1.00 . A A . 27 LEU CD1 1 1 5 3085 1 1 27 LEU CD2 C -2.480 -1.458 2.166 1.00 . A A . 27 LEU CD2 1 1 5 3086 1 1 27 LEU CG C -2.498 -1.363 0.664 1.00 . A A . 27 LEU CG 1 1 5 3087 1 1 27 LEU H H -1.185 -2.900 -1.338 1.00 . A A . 27 LEU H 1 1 5 3088 1 1 27 LEU HA H -2.200 -3.961 1.102 1.00 . A A . 27 LEU HA 1 1 5 3089 1 1 27 LEU HB2 H -3.444 -2.266 -0.957 1.00 . A A . 27 LEU HB2 1 1 5 3090 1 1 27 LEU HB3 H -4.155 -2.649 0.596 1.00 . A A . 27 LEU HB3 1 1 5 3091 1 1 27 LEU HD11 H -4.226 -0.256 0.490 1.00 . A A . 27 LEU HD11 1 1 5 3092 1 1 27 LEU HD12 H -3.090 -0.091 -0.848 1.00 . A A . 27 LEU HD12 1 1 5 3093 1 1 27 LEU HD13 H -2.760 0.706 0.696 1.00 . A A . 27 LEU HD13 1 1 5 3094 1 1 27 LEU HD21 H -3.493 -1.426 2.534 1.00 . A A . 27 LEU HD21 1 1 5 3095 1 1 27 LEU HD22 H -1.921 -0.631 2.573 1.00 . A A . 27 LEU HD22 1 1 5 3096 1 1 27 LEU HD23 H -2.019 -2.389 2.457 1.00 . A A . 27 LEU HD23 1 1 5 3097 1 1 27 LEU HG H -1.492 -1.336 0.288 1.00 . A A . 27 LEU HG 1 1 5 3098 1 1 27 LEU N N -1.262 -3.640 -0.681 1.00 . A A . 27 LEU N 1 1 5 3099 1 1 27 LEU O O -4.012 -5.559 0.292 1.00 . A A . 27 LEU O 1 1 5 3100 1 1 28 LYS C C -3.097 -7.573 -1.677 1.00 . A A . 28 LYS C 1 1 5 3101 1 1 28 LYS CA C -3.772 -6.365 -2.330 1.00 . A A . 28 LYS CA 1 1 5 3102 1 1 28 LYS CB C -3.540 -6.429 -3.854 1.00 . A A . 28 LYS CB 1 1 5 3103 1 1 28 LYS CD C -5.867 -6.116 -4.530 1.00 . A A . 28 LYS CD 1 1 5 3104 1 1 28 LYS CE C -6.092 -7.430 -5.257 1.00 . A A . 28 LYS CE 1 1 5 3105 1 1 28 LYS CG C -4.482 -5.609 -4.705 1.00 . A A . 28 LYS CG 1 1 5 3106 1 1 28 LYS H H -2.906 -4.401 -2.320 1.00 . A A . 28 LYS H 1 1 5 3107 1 1 28 LYS HA H -4.826 -6.410 -2.121 1.00 . A A . 28 LYS HA 1 1 5 3108 1 1 28 LYS HB2 H -2.576 -6.076 -4.046 1.00 . A A . 28 LYS HB2 1 1 5 3109 1 1 28 LYS HB3 H -3.609 -7.458 -4.174 1.00 . A A . 28 LYS HB3 1 1 5 3110 1 1 28 LYS HD2 H -5.981 -6.280 -3.485 1.00 . A A . 28 LYS HD2 1 1 5 3111 1 1 28 LYS HD3 H -6.576 -5.378 -4.876 1.00 . A A . 28 LYS HD3 1 1 5 3112 1 1 28 LYS HE2 H -5.905 -7.280 -6.310 1.00 . A A . 28 LYS HE2 1 1 5 3113 1 1 28 LYS HE3 H -5.400 -8.163 -4.870 1.00 . A A . 28 LYS HE3 1 1 5 3114 1 1 28 LYS HG2 H -4.438 -4.576 -4.395 1.00 . A A . 28 LYS HG2 1 1 5 3115 1 1 28 LYS HG3 H -4.196 -5.698 -5.743 1.00 . A A . 28 LYS HG3 1 1 5 3116 1 1 28 LYS HZ1 H -7.804 -7.757 -4.099 1.00 . A A . 28 LYS HZ1 1 1 5 3117 1 1 28 LYS HZ2 H -7.523 -8.952 -5.268 1.00 . A A . 28 LYS HZ2 1 1 5 3118 1 1 28 LYS HZ3 H -8.126 -7.444 -5.734 1.00 . A A . 28 LYS HZ3 1 1 5 3119 1 1 28 LYS N N -3.258 -5.122 -1.742 1.00 . A A . 28 LYS N 1 1 5 3120 1 1 28 LYS NZ N -7.480 -7.930 -5.076 1.00 . A A . 28 LYS NZ 1 1 5 3121 1 1 28 LYS O O -3.749 -8.577 -1.382 1.00 . A A . 28 LYS O 1 1 5 3122 1 1 29 GLN C C -1.490 -8.725 0.634 1.00 . A A . 29 GLN C 1 1 5 3123 1 1 29 GLN CA C -1.017 -8.501 -0.800 1.00 . A A . 29 GLN CA 1 1 5 3124 1 1 29 GLN CB C 0.441 -8.060 -0.792 1.00 . A A . 29 GLN CB 1 1 5 3125 1 1 29 GLN CD C 2.054 -8.134 -2.748 1.00 . A A . 29 GLN CD 1 1 5 3126 1 1 29 GLN CG C 1.347 -8.901 -1.644 1.00 . A A . 29 GLN CG 1 1 5 3127 1 1 29 GLN H H -1.303 -6.653 -1.740 1.00 . A A . 29 GLN H 1 1 5 3128 1 1 29 GLN HA H -1.114 -9.414 -1.365 1.00 . A A . 29 GLN HA 1 1 5 3129 1 1 29 GLN HB2 H 0.492 -7.052 -1.156 1.00 . A A . 29 GLN HB2 1 1 5 3130 1 1 29 GLN HB3 H 0.809 -8.085 0.222 1.00 . A A . 29 GLN HB3 1 1 5 3131 1 1 29 GLN HE21 H 2.354 -6.581 -1.546 1.00 . A A . 29 GLN HE21 1 1 5 3132 1 1 29 GLN HE22 H 2.952 -6.406 -3.157 1.00 . A A . 29 GLN HE22 1 1 5 3133 1 1 29 GLN HG2 H 2.094 -9.298 -0.997 1.00 . A A . 29 GLN HG2 1 1 5 3134 1 1 29 GLN HG3 H 0.774 -9.698 -2.081 1.00 . A A . 29 GLN HG3 1 1 5 3135 1 1 29 GLN N N -1.786 -7.463 -1.451 1.00 . A A . 29 GLN N 1 1 5 3136 1 1 29 GLN NE2 N 2.497 -6.920 -2.451 1.00 . A A . 29 GLN NE2 1 1 5 3137 1 1 29 GLN O O -1.434 -9.839 1.158 1.00 . A A . 29 GLN O 1 1 5 3138 1 1 29 GLN OE1 O 2.261 -8.658 -3.844 1.00 . A A . 29 GLN OE1 1 1 5 3139 1 1 30 THR C C -3.693 -7.436 3.010 1.00 . A A . 30 THR C 1 1 5 3140 1 1 30 THR CA C -2.218 -7.644 2.675 1.00 . A A . 30 THR CA 1 1 5 3141 1 1 30 THR CB C -1.409 -6.511 3.281 1.00 . A A . 30 THR CB 1 1 5 3142 1 1 30 THR CG2 C 0.074 -6.829 3.227 1.00 . A A . 30 THR CG2 1 1 5 3143 1 1 30 THR H H -2.093 -6.829 0.754 1.00 . A A . 30 THR H 1 1 5 3144 1 1 30 THR HA H -1.875 -8.574 3.102 1.00 . A A . 30 THR HA 1 1 5 3145 1 1 30 THR HB H -1.712 -6.381 4.298 1.00 . A A . 30 THR HB 1 1 5 3146 1 1 30 THR HG1 H -1.014 -5.197 1.864 1.00 . A A . 30 THR HG1 1 1 5 3147 1 1 30 THR HG21 H 0.636 -6.025 3.680 1.00 . A A . 30 THR HG21 1 1 5 3148 1 1 30 THR HG22 H 0.377 -6.942 2.192 1.00 . A A . 30 THR HG22 1 1 5 3149 1 1 30 THR HG23 H 0.264 -7.749 3.760 1.00 . A A . 30 THR HG23 1 1 5 3150 1 1 30 THR N N -1.953 -7.655 1.257 1.00 . A A . 30 THR N 1 1 5 3151 1 1 30 THR O O -4.077 -7.351 4.177 1.00 . A A . 30 THR O 1 1 5 3152 1 1 30 THR OG1 O -1.670 -5.299 2.567 1.00 . A A . 30 THR OG1 1 1 5 3153 1 1 31 ASN C C -6.122 -5.672 2.796 1.00 . A A . 31 ASN C 1 1 5 3154 1 1 31 ASN CA C -5.913 -7.006 2.073 1.00 . A A . 31 ASN CA 1 1 5 3155 1 1 31 ASN CB C -6.720 -8.116 2.756 1.00 . A A . 31 ASN CB 1 1 5 3156 1 1 31 ASN CG C -6.933 -9.320 1.859 1.00 . A A . 31 ASN CG 1 1 5 3157 1 1 31 ASN H H -4.132 -7.542 1.079 1.00 . A A . 31 ASN H 1 1 5 3158 1 1 31 ASN HA H -6.281 -6.889 1.061 1.00 . A A . 31 ASN HA 1 1 5 3159 1 1 31 ASN HB2 H -6.194 -8.439 3.641 1.00 . A A . 31 ASN HB2 1 1 5 3160 1 1 31 ASN HB3 H -7.687 -7.724 3.040 1.00 . A A . 31 ASN HB3 1 1 5 3161 1 1 31 ASN HD21 H -5.335 -10.214 2.633 1.00 . A A . 31 ASN HD21 1 1 5 3162 1 1 31 ASN HD22 H -6.183 -11.102 1.417 1.00 . A A . 31 ASN HD22 1 1 5 3163 1 1 31 ASN N N -4.502 -7.360 1.968 1.00 . A A . 31 ASN N 1 1 5 3164 1 1 31 ASN ND2 N -6.064 -10.311 1.978 1.00 . A A . 31 ASN ND2 1 1 5 3165 1 1 31 ASN O O -6.870 -5.602 3.770 1.00 . A A . 31 ASN O 1 1 5 3166 1 1 31 ASN OD1 O -7.880 -9.366 1.076 1.00 . A A . 31 ASN OD1 1 1 5 3167 1 1 32 GLY C C -4.990 -2.780 4.004 1.00 . A A . 32 GLY C 1 1 5 3168 1 1 32 GLY CA C -5.789 -3.290 2.796 1.00 . A A . 32 GLY CA 1 1 5 3169 1 1 32 GLY H H -4.800 -4.713 1.590 1.00 . A A . 32 GLY H 1 1 5 3170 1 1 32 GLY HA2 H -5.640 -2.602 1.973 1.00 . A A . 32 GLY HA2 1 1 5 3171 1 1 32 GLY HA3 H -6.840 -3.274 3.055 1.00 . A A . 32 GLY HA3 1 1 5 3172 1 1 32 GLY N N -5.470 -4.609 2.316 1.00 . A A . 32 GLY N 1 1 5 3173 1 1 32 GLY O O -5.029 -1.579 4.266 1.00 . A A . 32 GLY O 1 1 5 3174 1 1 33 ASN C C -2.187 -2.617 5.606 1.00 . A A . 33 ASN C 1 1 5 3175 1 1 33 ASN CA C -3.602 -3.109 5.943 1.00 . A A . 33 ASN CA 1 1 5 3176 1 1 33 ASN CB C -3.686 -4.121 7.096 1.00 . A A . 33 ASN CB 1 1 5 3177 1 1 33 ASN CG C -2.799 -5.348 7.014 1.00 . A A . 33 ASN CG 1 1 5 3178 1 1 33 ASN H H -4.219 -4.578 4.576 1.00 . A A . 33 ASN H 1 1 5 3179 1 1 33 ASN HA H -4.163 -2.243 6.238 1.00 . A A . 33 ASN HA 1 1 5 3180 1 1 33 ASN HB2 H -3.451 -3.614 7.992 1.00 . A A . 33 ASN HB2 1 1 5 3181 1 1 33 ASN HB3 H -4.708 -4.464 7.154 1.00 . A A . 33 ASN HB3 1 1 5 3182 1 1 33 ASN HD21 H -2.551 -5.110 5.080 1.00 . A A . 33 ASN HD21 1 1 5 3183 1 1 33 ASN HD22 H -1.780 -6.493 5.778 1.00 . A A . 33 ASN HD22 1 1 5 3184 1 1 33 ASN N N -4.278 -3.625 4.772 1.00 . A A . 33 ASN N 1 1 5 3185 1 1 33 ASN ND2 N -2.327 -5.679 5.844 1.00 . A A . 33 ASN ND2 1 1 5 3186 1 1 33 ASN O O -1.330 -3.360 5.131 1.00 . A A . 33 ASN O 1 1 5 3187 1 1 33 ASN OD1 O -2.514 -5.977 8.032 1.00 . A A . 33 ASN OD1 1 1 5 3188 1 1 34 ALA C C 0.498 -0.929 5.803 1.00 . A A . 34 ALA C 1 1 5 3189 1 1 34 ALA CA C -0.867 -0.585 5.240 1.00 . A A . 34 ALA CA 1 1 5 3190 1 1 34 ALA CB C -1.107 0.910 5.356 1.00 . A A . 34 ALA CB 1 1 5 3191 1 1 34 ALA H H -2.625 -0.834 6.401 1.00 . A A . 34 ALA H 1 1 5 3192 1 1 34 ALA HA H -0.855 -0.828 4.194 1.00 . A A . 34 ALA HA 1 1 5 3193 1 1 34 ALA HB1 H -2.087 1.148 4.969 1.00 . A A . 34 ALA HB1 1 1 5 3194 1 1 34 ALA HB2 H -0.357 1.439 4.787 1.00 . A A . 34 ALA HB2 1 1 5 3195 1 1 34 ALA HB3 H -1.047 1.203 6.393 1.00 . A A . 34 ALA HB3 1 1 5 3196 1 1 34 ALA N N -1.981 -1.323 5.832 1.00 . A A . 34 ALA N 1 1 5 3197 1 1 34 ALA O O 1.472 -0.965 5.056 1.00 . A A . 34 ALA O 1 1 5 3198 1 1 35 GLU C C 2.436 -2.713 7.215 1.00 . A A . 35 GLU C 1 1 5 3199 1 1 35 GLU CA C 1.863 -1.411 7.692 1.00 . A A . 35 GLU CA 1 1 5 3200 1 1 35 GLU CB C 1.700 -1.365 9.186 1.00 . A A . 35 GLU CB 1 1 5 3201 1 1 35 GLU CD C 3.456 0.279 9.907 1.00 . A A . 35 GLU CD 1 1 5 3202 1 1 35 GLU CG C 1.982 -0.015 9.753 1.00 . A A . 35 GLU CG 1 1 5 3203 1 1 35 GLU H H -0.170 -1.199 7.662 1.00 . A A . 35 GLU H 1 1 5 3204 1 1 35 GLU HA H 2.477 -0.641 7.392 1.00 . A A . 35 GLU HA 1 1 5 3205 1 1 35 GLU HB2 H 0.684 -1.606 9.432 1.00 . A A . 35 GLU HB2 1 1 5 3206 1 1 35 GLU HB3 H 2.346 -2.070 9.630 1.00 . A A . 35 GLU HB3 1 1 5 3207 1 1 35 GLU HG2 H 1.549 0.712 9.100 1.00 . A A . 35 GLU HG2 1 1 5 3208 1 1 35 GLU HG3 H 1.513 0.042 10.704 1.00 . A A . 35 GLU HG3 1 1 5 3209 1 1 35 GLU N N 0.602 -1.168 7.095 1.00 . A A . 35 GLU N 1 1 5 3210 1 1 35 GLU O O 3.620 -2.848 6.879 1.00 . A A . 35 GLU O 1 1 5 3211 1 1 35 GLU OE1 O 4.193 0.158 8.906 1.00 . A A . 35 GLU OE1 1 1 5 3212 1 1 35 GLU OE2 O 3.886 0.646 11.017 1.00 . A A . 35 GLU OE2 1 1 5 3213 1 1 36 PHE C C 2.106 -4.802 5.101 1.00 . A A . 36 PHE C 1 1 5 3214 1 1 36 PHE CA C 1.810 -4.934 6.577 1.00 . A A . 36 PHE CA 1 1 5 3215 1 1 36 PHE CB C 0.587 -5.803 6.828 1.00 . A A . 36 PHE CB 1 1 5 3216 1 1 36 PHE CD1 C 0.762 -5.620 9.283 1.00 . A A . 36 PHE CD1 1 1 5 3217 1 1 36 PHE CD2 C 0.567 -7.798 8.361 1.00 . A A . 36 PHE CD2 1 1 5 3218 1 1 36 PHE CE1 C 0.826 -6.130 10.529 1.00 . A A . 36 PHE CE1 1 1 5 3219 1 1 36 PHE CE2 C 0.628 -8.336 9.634 1.00 . A A . 36 PHE CE2 1 1 5 3220 1 1 36 PHE CG C 0.633 -6.429 8.180 1.00 . A A . 36 PHE CG 1 1 5 3221 1 1 36 PHE CZ C 0.759 -7.495 10.727 1.00 . A A . 36 PHE CZ 1 1 5 3222 1 1 36 PHE H H 0.658 -3.455 7.506 1.00 . A A . 36 PHE H 1 1 5 3223 1 1 36 PHE HA H 2.666 -5.357 7.078 1.00 . A A . 36 PHE HA 1 1 5 3224 1 1 36 PHE HB2 H -0.292 -5.172 6.792 1.00 . A A . 36 PHE HB2 1 1 5 3225 1 1 36 PHE HB3 H 0.496 -6.566 6.079 1.00 . A A . 36 PHE HB3 1 1 5 3226 1 1 36 PHE HD1 H 0.815 -4.556 9.159 1.00 . A A . 36 PHE HD1 1 1 5 3227 1 1 36 PHE HD2 H 0.465 -8.446 7.503 1.00 . A A . 36 PHE HD2 1 1 5 3228 1 1 36 PHE HE1 H 0.929 -5.454 11.343 1.00 . A A . 36 PHE HE1 1 1 5 3229 1 1 36 PHE HE2 H 0.574 -9.404 9.777 1.00 . A A . 36 PHE HE2 1 1 5 3230 1 1 36 PHE HZ H 0.810 -7.904 11.726 1.00 . A A . 36 PHE HZ 1 1 5 3231 1 1 36 PHE N N 1.548 -3.646 7.146 1.00 . A A . 36 PHE N 1 1 5 3232 1 1 36 PHE O O 2.899 -5.559 4.535 1.00 . A A . 36 PHE O 1 1 5 3233 1 1 37 ALA C C 2.996 -3.115 2.736 1.00 . A A . 37 ALA C 1 1 5 3234 1 1 37 ALA CA C 1.615 -3.608 3.065 1.00 . A A . 37 ALA CA 1 1 5 3235 1 1 37 ALA CB C 0.571 -2.637 2.564 1.00 . A A . 37 ALA CB 1 1 5 3236 1 1 37 ALA H H 0.973 -3.157 5.033 1.00 . A A . 37 ALA H 1 1 5 3237 1 1 37 ALA HA H 1.461 -4.558 2.577 1.00 . A A . 37 ALA HA 1 1 5 3238 1 1 37 ALA HB1 H -0.412 -3.006 2.815 1.00 . A A . 37 ALA HB1 1 1 5 3239 1 1 37 ALA HB2 H 0.657 -2.537 1.493 1.00 . A A . 37 ALA HB2 1 1 5 3240 1 1 37 ALA HB3 H 0.725 -1.675 3.030 1.00 . A A . 37 ALA HB3 1 1 5 3241 1 1 37 ALA N N 1.489 -3.809 4.492 1.00 . A A . 37 ALA N 1 1 5 3242 1 1 37 ALA O O 3.644 -3.621 1.840 1.00 . A A . 37 ALA O 1 1 5 3243 1 1 38 ALA C C 5.799 -2.579 3.441 1.00 . A A . 38 ALA C 1 1 5 3244 1 1 38 ALA CA C 4.733 -1.531 3.328 1.00 . A A . 38 ALA CA 1 1 5 3245 1 1 38 ALA CB C 4.964 -0.459 4.366 1.00 . A A . 38 ALA CB 1 1 5 3246 1 1 38 ALA H H 2.838 -1.778 4.163 1.00 . A A . 38 ALA H 1 1 5 3247 1 1 38 ALA HA H 4.783 -1.075 2.352 1.00 . A A . 38 ALA HA 1 1 5 3248 1 1 38 ALA HB1 H 5.930 -0.008 4.200 1.00 . A A . 38 ALA HB1 1 1 5 3249 1 1 38 ALA HB2 H 4.934 -0.903 5.349 1.00 . A A . 38 ALA HB2 1 1 5 3250 1 1 38 ALA HB3 H 4.194 0.291 4.283 1.00 . A A . 38 ALA HB3 1 1 5 3251 1 1 38 ALA N N 3.427 -2.125 3.486 1.00 . A A . 38 ALA N 1 1 5 3252 1 1 38 ALA O O 6.667 -2.677 2.594 1.00 . A A . 38 ALA O 1 1 5 3253 1 1 39 SER C C 6.770 -5.390 3.662 1.00 . A A . 39 SER C 1 1 5 3254 1 1 39 SER CA C 6.698 -4.375 4.770 1.00 . A A . 39 SER CA 1 1 5 3255 1 1 39 SER CB C 6.374 -5.046 6.105 1.00 . A A . 39 SER CB 1 1 5 3256 1 1 39 SER H H 4.808 -3.484 4.908 1.00 . A A . 39 SER H 1 1 5 3257 1 1 39 SER HA H 7.637 -3.848 4.843 1.00 . A A . 39 SER HA 1 1 5 3258 1 1 39 SER HB2 H 5.451 -5.598 6.011 1.00 . A A . 39 SER HB2 1 1 5 3259 1 1 39 SER HB3 H 7.175 -5.721 6.372 1.00 . A A . 39 SER HB3 1 1 5 3260 1 1 39 SER HG H 5.365 -3.640 7.042 1.00 . A A . 39 SER HG 1 1 5 3261 1 1 39 SER N N 5.661 -3.428 4.439 1.00 . A A . 39 SER N 1 1 5 3262 1 1 39 SER O O 7.812 -5.983 3.386 1.00 . A A . 39 SER O 1 1 5 3263 1 1 39 SER OG O 6.223 -4.079 7.133 1.00 . A A . 39 SER OG 1 1 5 3264 1 1 40 LEU C C 6.001 -5.812 0.644 1.00 . A A . 40 LEU C 1 1 5 3265 1 1 40 LEU CA C 5.508 -6.457 1.922 1.00 . A A . 40 LEU CA 1 1 5 3266 1 1 40 LEU CB C 4.046 -6.850 1.830 1.00 . A A . 40 LEU CB 1 1 5 3267 1 1 40 LEU CD1 C 4.430 -8.403 -0.145 1.00 . A A . 40 LEU CD1 1 1 5 3268 1 1 40 LEU CD2 C 4.098 -9.339 2.148 1.00 . A A . 40 LEU CD2 1 1 5 3269 1 1 40 LEU CG C 3.727 -8.214 1.191 1.00 . A A . 40 LEU CG 1 1 5 3270 1 1 40 LEU H H 4.845 -5.016 3.275 1.00 . A A . 40 LEU H 1 1 5 3271 1 1 40 LEU HA H 6.109 -7.321 2.115 1.00 . A A . 40 LEU HA 1 1 5 3272 1 1 40 LEU HB2 H 3.657 -6.857 2.835 1.00 . A A . 40 LEU HB2 1 1 5 3273 1 1 40 LEU HB3 H 3.537 -6.075 1.293 1.00 . A A . 40 LEU HB3 1 1 5 3274 1 1 40 LEU HD11 H 4.196 -9.381 -0.540 1.00 . A A . 40 LEU HD11 1 1 5 3275 1 1 40 LEU HD12 H 5.498 -8.317 -0.005 1.00 . A A . 40 LEU HD12 1 1 5 3276 1 1 40 LEU HD13 H 4.095 -7.646 -0.839 1.00 . A A . 40 LEU HD13 1 1 5 3277 1 1 40 LEU HD21 H 3.876 -10.290 1.688 1.00 . A A . 40 LEU HD21 1 1 5 3278 1 1 40 LEU HD22 H 3.530 -9.237 3.061 1.00 . A A . 40 LEU HD22 1 1 5 3279 1 1 40 LEU HD23 H 5.153 -9.286 2.372 1.00 . A A . 40 LEU HD23 1 1 5 3280 1 1 40 LEU HG H 2.664 -8.275 1.012 1.00 . A A . 40 LEU HG 1 1 5 3281 1 1 40 LEU N N 5.637 -5.549 3.011 1.00 . A A . 40 LEU N 1 1 5 3282 1 1 40 LEU O O 6.845 -6.384 -0.034 1.00 . A A . 40 LEU O 1 1 5 3283 1 1 41 LEU C C 7.312 -3.618 -0.931 1.00 . A A . 41 LEU C 1 1 5 3284 1 1 41 LEU CA C 5.842 -3.985 -0.909 1.00 . A A . 41 LEU CA 1 1 5 3285 1 1 41 LEU CB C 4.924 -2.847 -1.156 1.00 . A A . 41 LEU CB 1 1 5 3286 1 1 41 LEU CD1 C 5.510 -0.693 -1.870 1.00 . A A . 41 LEU CD1 1 1 5 3287 1 1 41 LEU CD2 C 4.431 -1.010 0.304 1.00 . A A . 41 LEU CD2 1 1 5 3288 1 1 41 LEU CG C 5.401 -1.548 -0.676 1.00 . A A . 41 LEU CG 1 1 5 3289 1 1 41 LEU H H 5.015 -4.051 1.009 1.00 . A A . 41 LEU H 1 1 5 3290 1 1 41 LEU HA H 5.663 -4.694 -1.661 1.00 . A A . 41 LEU HA 1 1 5 3291 1 1 41 LEU HB2 H 4.751 -2.774 -2.219 1.00 . A A . 41 LEU HB2 1 1 5 3292 1 1 41 LEU HB3 H 3.986 -3.061 -0.670 1.00 . A A . 41 LEU HB3 1 1 5 3293 1 1 41 LEU HD11 H 6.081 0.183 -1.641 1.00 . A A . 41 LEU HD11 1 1 5 3294 1 1 41 LEU HD12 H 4.511 -0.419 -2.194 1.00 . A A . 41 LEU HD12 1 1 5 3295 1 1 41 LEU HD13 H 5.997 -1.270 -2.637 1.00 . A A . 41 LEU HD13 1 1 5 3296 1 1 41 LEU HD21 H 3.553 -0.672 -0.215 1.00 . A A . 41 LEU HD21 1 1 5 3297 1 1 41 LEU HD22 H 4.881 -0.195 0.849 1.00 . A A . 41 LEU HD22 1 1 5 3298 1 1 41 LEU HD23 H 4.169 -1.814 0.977 1.00 . A A . 41 LEU HD23 1 1 5 3299 1 1 41 LEU HG H 6.364 -1.661 -0.205 1.00 . A A . 41 LEU HG 1 1 5 3300 1 1 41 LEU N N 5.538 -4.598 0.343 1.00 . A A . 41 LEU N 1 1 5 3301 1 1 41 LEU O O 7.913 -3.413 -1.984 1.00 . A A . 41 LEU O 1 1 5 3302 1 1 42 PHE C C 10.105 -4.283 -0.266 1.00 . A A . 42 PHE C 1 1 5 3303 1 1 42 PHE CA C 9.265 -3.278 0.517 1.00 . A A . 42 PHE CA 1 1 5 3304 1 1 42 PHE CB C 9.577 -3.423 1.998 1.00 . A A . 42 PHE CB 1 1 5 3305 1 1 42 PHE CD1 C 9.009 -1.224 2.777 1.00 . A A . 42 PHE CD1 1 1 5 3306 1 1 42 PHE CD2 C 11.291 -1.829 2.892 1.00 . A A . 42 PHE CD2 1 1 5 3307 1 1 42 PHE CE1 C 9.293 0.001 3.274 1.00 . A A . 42 PHE CE1 1 1 5 3308 1 1 42 PHE CE2 C 11.604 -0.587 3.407 1.00 . A A . 42 PHE CE2 1 1 5 3309 1 1 42 PHE CG C 9.980 -2.140 2.582 1.00 . A A . 42 PHE CG 1 1 5 3310 1 1 42 PHE CZ C 10.594 0.338 3.598 1.00 . A A . 42 PHE CZ 1 1 5 3311 1 1 42 PHE H H 7.261 -3.538 1.051 1.00 . A A . 42 PHE H 1 1 5 3312 1 1 42 PHE HA H 9.506 -2.259 0.228 1.00 . A A . 42 PHE HA 1 1 5 3313 1 1 42 PHE HB2 H 8.687 -3.738 2.521 1.00 . A A . 42 PHE HB2 1 1 5 3314 1 1 42 PHE HB3 H 10.363 -4.132 2.146 1.00 . A A . 42 PHE HB3 1 1 5 3315 1 1 42 PHE HD1 H 7.987 -1.499 2.534 1.00 . A A . 42 PHE HD1 1 1 5 3316 1 1 42 PHE HD2 H 12.066 -2.566 2.737 1.00 . A A . 42 PHE HD2 1 1 5 3317 1 1 42 PHE HE1 H 8.500 0.690 3.402 1.00 . A A . 42 PHE HE1 1 1 5 3318 1 1 42 PHE HE2 H 12.627 -0.341 3.654 1.00 . A A . 42 PHE HE2 1 1 5 3319 1 1 42 PHE HZ H 10.821 1.317 3.995 1.00 . A A . 42 PHE HZ 1 1 5 3320 1 1 42 PHE N N 7.850 -3.479 0.280 1.00 . A A . 42 PHE N 1 1 5 3321 1 1 42 PHE O O 11.312 -4.098 -0.425 1.00 . A A . 42 PHE O 1 1 5 3322 1 1 43 GLN C C 10.655 -5.824 -2.857 1.00 . A A . 43 GLN C 1 1 5 3323 1 1 43 GLN CA C 10.159 -6.382 -1.517 1.00 . A A . 43 GLN CA 1 1 5 3324 1 1 43 GLN CB C 9.254 -7.604 -1.714 1.00 . A A . 43 GLN CB 1 1 5 3325 1 1 43 GLN CD C 7.430 -6.537 -3.185 1.00 . A A . 43 GLN CD 1 1 5 3326 1 1 43 GLN CG C 8.443 -7.659 -3.000 1.00 . A A . 43 GLN CG 1 1 5 3327 1 1 43 GLN H H 8.489 -5.492 -0.528 1.00 . A A . 43 GLN H 1 1 5 3328 1 1 43 GLN HA H 11.019 -6.689 -0.945 1.00 . A A . 43 GLN HA 1 1 5 3329 1 1 43 GLN HB2 H 9.869 -8.488 -1.683 1.00 . A A . 43 GLN HB2 1 1 5 3330 1 1 43 GLN HB3 H 8.561 -7.644 -0.892 1.00 . A A . 43 GLN HB3 1 1 5 3331 1 1 43 GLN HE21 H 6.116 -7.533 -2.102 1.00 . A A . 43 GLN HE21 1 1 5 3332 1 1 43 GLN HE22 H 5.561 -6.025 -2.738 1.00 . A A . 43 GLN HE22 1 1 5 3333 1 1 43 GLN HG2 H 9.123 -7.637 -3.828 1.00 . A A . 43 GLN HG2 1 1 5 3334 1 1 43 GLN HG3 H 7.914 -8.591 -3.006 1.00 . A A . 43 GLN HG3 1 1 5 3335 1 1 43 GLN N N 9.464 -5.366 -0.734 1.00 . A A . 43 GLN N 1 1 5 3336 1 1 43 GLN NE2 N 6.254 -6.713 -2.612 1.00 . A A . 43 GLN NE2 1 1 5 3337 1 1 43 GLN O O 11.355 -6.506 -3.612 1.00 . A A . 43 GLN O 1 1 5 3338 1 1 43 GLN OE1 O 7.707 -5.523 -3.815 1.00 . A A . 43 GLN OE1 1 1 5 3339 1 1 44 SER C C 12.144 -3.279 -4.066 1.00 . A A . 44 SER C 1 1 5 3340 1 1 44 SER CA C 10.755 -3.871 -4.316 1.00 . A A . 44 SER CA 1 1 5 3341 1 1 44 SER CB C 9.773 -2.758 -4.695 1.00 . A A . 44 SER CB 1 1 5 3342 1 1 44 SER H H 9.655 -4.134 -2.524 1.00 . A A . 44 SER H 1 1 5 3343 1 1 44 SER HA H 10.819 -4.579 -5.127 1.00 . A A . 44 SER HA 1 1 5 3344 1 1 44 SER HB2 H 9.708 -2.047 -3.883 1.00 . A A . 44 SER HB2 1 1 5 3345 1 1 44 SER HB3 H 10.127 -2.257 -5.583 1.00 . A A . 44 SER HB3 1 1 5 3346 1 1 44 SER HG H 8.344 -4.079 -4.414 1.00 . A A . 44 SER HG 1 1 5 3347 1 1 44 SER N N 10.282 -4.583 -3.137 1.00 . A A . 44 SER N 1 1 5 3348 1 1 44 SER O O 12.232 -2.222 -3.410 1.00 . A A . 44 SER O 1 1 5 3349 1 1 44 SER OXT O 13.147 -3.871 -4.527 1.00 . A A . 44 SER OXT 1 1 5 3350 1 1 44 SER OG O 8.477 -3.277 -4.947 1.00 . A A . 44 SER OG 1 1 6 3351 1 1 1 GLY C C -13.339 -0.133 0.331 1.00 . A A . 1 GLY C 1 1 6 3352 1 1 1 GLY CA C -13.002 -0.617 -1.058 1.00 . A A . 1 GLY CA 1 1 6 3353 1 1 1 GLY H1 H -14.940 -1.042 -1.680 1.00 . A A . 1 GLY H1 1 1 6 3354 1 1 1 GLY H2 H -13.865 -0.714 -2.951 1.00 . A A . 1 GLY H2 1 1 6 3355 1 1 1 GLY H3 H -14.450 0.552 -1.988 1.00 . A A . 1 GLY H3 1 1 6 3356 1 1 1 GLY HA2 H -12.741 -1.664 -1.012 1.00 . A A . 1 GLY HA2 1 1 6 3357 1 1 1 GLY HA3 H -12.156 -0.058 -1.432 1.00 . A A . 1 GLY HA3 1 1 6 3358 1 1 1 GLY N N -14.141 -0.444 -1.985 1.00 . A A . 1 GLY N 1 1 6 3359 1 1 1 GLY O O -13.655 1.041 0.522 1.00 . A A . 1 GLY O 1 1 6 3360 1 1 2 SER C C -12.488 0.244 3.211 1.00 . A A . 2 SER C 1 1 6 3361 1 1 2 SER CA C -13.577 -0.679 2.676 1.00 . A A . 2 SER CA 1 1 6 3362 1 1 2 SER CB C -13.685 -1.943 3.534 1.00 . A A . 2 SER CB 1 1 6 3363 1 1 2 SER H H -13.048 -1.964 1.080 1.00 . A A . 2 SER H 1 1 6 3364 1 1 2 SER HA H -14.522 -0.155 2.695 1.00 . A A . 2 SER HA 1 1 6 3365 1 1 2 SER HB2 H -14.422 -2.604 3.106 1.00 . A A . 2 SER HB2 1 1 6 3366 1 1 2 SER HB3 H -12.726 -2.443 3.557 1.00 . A A . 2 SER HB3 1 1 6 3367 1 1 2 SER HG H -13.316 -1.796 5.456 1.00 . A A . 2 SER HG 1 1 6 3368 1 1 2 SER N N -13.290 -1.032 1.300 1.00 . A A . 2 SER N 1 1 6 3369 1 1 2 SER O O -12.764 1.361 3.653 1.00 . A A . 2 SER O 1 1 6 3370 1 1 2 SER OG O -14.068 -1.633 4.863 1.00 . A A . 2 SER OG 1 1 6 3371 1 1 3 ALA C C -8.819 -0.166 3.124 1.00 . A A . 3 ALA C 1 1 6 3372 1 1 3 ALA CA C -10.092 0.544 3.564 1.00 . A A . 3 ALA CA 1 1 6 3373 1 1 3 ALA CB C -10.096 0.746 5.075 1.00 . A A . 3 ALA CB 1 1 6 3374 1 1 3 ALA H H -11.110 -1.138 2.800 1.00 . A A . 3 ALA H 1 1 6 3375 1 1 3 ALA HA H -10.142 1.512 3.087 1.00 . A A . 3 ALA HA 1 1 6 3376 1 1 3 ALA HB1 H -9.244 1.344 5.361 1.00 . A A . 3 ALA HB1 1 1 6 3377 1 1 3 ALA HB2 H -10.044 -0.214 5.565 1.00 . A A . 3 ALA HB2 1 1 6 3378 1 1 3 ALA HB3 H -11.005 1.252 5.369 1.00 . A A . 3 ALA HB3 1 1 6 3379 1 1 3 ALA N N -11.250 -0.230 3.143 1.00 . A A . 3 ALA N 1 1 6 3380 1 1 3 ALA O O -7.922 -0.414 3.927 1.00 . A A . 3 ALA O 1 1 6 3381 1 1 4 THR C C -6.552 -0.373 0.790 1.00 . A A . 4 THR C 1 1 6 3382 1 1 4 THR CA C -7.646 -1.267 1.308 1.00 . A A . 4 THR CA 1 1 6 3383 1 1 4 THR CB C -8.132 -2.219 0.199 1.00 . A A . 4 THR CB 1 1 6 3384 1 1 4 THR CG2 C -8.716 -3.492 0.790 1.00 . A A . 4 THR CG2 1 1 6 3385 1 1 4 THR H H -9.490 -0.239 1.242 1.00 . A A . 4 THR H 1 1 6 3386 1 1 4 THR HA H -7.245 -1.834 2.068 1.00 . A A . 4 THR HA 1 1 6 3387 1 1 4 THR HB H -7.290 -2.481 -0.426 1.00 . A A . 4 THR HB 1 1 6 3388 1 1 4 THR HG1 H -9.451 -2.174 -1.274 1.00 . A A . 4 THR HG1 1 1 6 3389 1 1 4 THR HG21 H -7.958 -4.001 1.367 1.00 . A A . 4 THR HG21 1 1 6 3390 1 1 4 THR HG22 H -9.053 -4.137 -0.009 1.00 . A A . 4 THR HG22 1 1 6 3391 1 1 4 THR HG23 H -9.550 -3.244 1.430 1.00 . A A . 4 THR HG23 1 1 6 3392 1 1 4 THR N N -8.764 -0.513 1.847 1.00 . A A . 4 THR N 1 1 6 3393 1 1 4 THR O O -5.419 -0.368 1.255 1.00 . A A . 4 THR O 1 1 6 3394 1 1 4 THR OG1 O -9.125 -1.563 -0.606 1.00 . A A . 4 THR OG1 1 1 6 3395 1 1 5 PHE C C -6.598 2.788 -0.814 1.00 . A A . 5 PHE C 1 1 6 3396 1 1 5 PHE CA C -6.112 1.310 -0.887 1.00 . A A . 5 PHE CA 1 1 6 3397 1 1 5 PHE CB C -6.307 0.928 -2.301 1.00 . A A . 5 PHE CB 1 1 6 3398 1 1 5 PHE CD1 C -5.396 -1.285 -1.939 1.00 . A A . 5 PHE CD1 1 1 6 3399 1 1 5 PHE CD2 C -7.312 -1.148 -3.294 1.00 . A A . 5 PHE CD2 1 1 6 3400 1 1 5 PHE CE1 C -5.389 -2.589 -2.058 1.00 . A A . 5 PHE CE1 1 1 6 3401 1 1 5 PHE CE2 C -7.297 -2.525 -3.426 1.00 . A A . 5 PHE CE2 1 1 6 3402 1 1 5 PHE CG C -6.335 -0.527 -2.529 1.00 . A A . 5 PHE CG 1 1 6 3403 1 1 5 PHE CZ C -6.308 -3.236 -2.780 1.00 . A A . 5 PHE CZ 1 1 6 3404 1 1 5 PHE H H -7.857 0.299 -0.388 1.00 . A A . 5 PHE H 1 1 6 3405 1 1 5 PHE HA H -5.080 1.183 -0.606 1.00 . A A . 5 PHE HA 1 1 6 3406 1 1 5 PHE HB2 H -7.260 1.304 -2.527 1.00 . A A . 5 PHE HB2 1 1 6 3407 1 1 5 PHE HB3 H -5.547 1.365 -2.922 1.00 . A A . 5 PHE HB3 1 1 6 3408 1 1 5 PHE HD1 H -4.648 -0.839 -1.336 1.00 . A A . 5 PHE HD1 1 1 6 3409 1 1 5 PHE HD2 H -8.072 -0.559 -3.787 1.00 . A A . 5 PHE HD2 1 1 6 3410 1 1 5 PHE HE1 H -4.635 -3.108 -1.574 1.00 . A A . 5 PHE HE1 1 1 6 3411 1 1 5 PHE HE2 H -8.048 -3.032 -4.015 1.00 . A A . 5 PHE HE2 1 1 6 3412 1 1 5 PHE HZ H -6.254 -4.292 -2.820 1.00 . A A . 5 PHE HZ 1 1 6 3413 1 1 5 PHE N N -6.956 0.389 -0.150 1.00 . A A . 5 PHE N 1 1 6 3414 1 1 5 PHE O O -6.698 3.456 -1.840 1.00 . A A . 5 PHE O 1 1 6 3415 1 1 6 PRO C C -6.135 5.625 0.581 1.00 . A A . 6 PRO C 1 1 6 3416 1 1 6 PRO CA C -7.321 4.674 0.595 1.00 . A A . 6 PRO CA 1 1 6 3417 1 1 6 PRO CB C -7.963 4.632 1.967 1.00 . A A . 6 PRO CB 1 1 6 3418 1 1 6 PRO CD C -7.157 2.490 1.517 1.00 . A A . 6 PRO CD 1 1 6 3419 1 1 6 PRO CG C -7.377 3.478 2.608 1.00 . A A . 6 PRO CG 1 1 6 3420 1 1 6 PRO HA H -8.049 4.996 -0.104 1.00 . A A . 6 PRO HA 1 1 6 3421 1 1 6 PRO HB2 H -7.764 5.541 2.509 1.00 . A A . 6 PRO HB2 1 1 6 3422 1 1 6 PRO HB3 H -9.005 4.483 1.862 1.00 . A A . 6 PRO HB3 1 1 6 3423 1 1 6 PRO HD2 H -6.305 1.903 1.684 1.00 . A A . 6 PRO HD2 1 1 6 3424 1 1 6 PRO HD3 H -8.016 1.852 1.348 1.00 . A A . 6 PRO HD3 1 1 6 3425 1 1 6 PRO HG2 H -6.457 3.756 3.066 1.00 . A A . 6 PRO HG2 1 1 6 3426 1 1 6 PRO HG3 H -8.070 3.096 3.319 1.00 . A A . 6 PRO HG3 1 1 6 3427 1 1 6 PRO N N -6.950 3.284 0.362 1.00 . A A . 6 PRO N 1 1 6 3428 1 1 6 PRO O O -5.036 5.288 1.006 1.00 . A A . 6 PRO O 1 1 6 3429 1 1 7 GLU C C -4.561 8.144 1.114 1.00 . A A . 7 GLU C 1 1 6 3430 1 1 7 GLU CA C -5.386 7.847 -0.132 1.00 . A A . 7 GLU CA 1 1 6 3431 1 1 7 GLU CB C -6.068 9.118 -0.627 1.00 . A A . 7 GLU CB 1 1 6 3432 1 1 7 GLU CD C -8.009 9.904 -2.038 1.00 . A A . 7 GLU CD 1 1 6 3433 1 1 7 GLU CG C -6.879 8.906 -1.893 1.00 . A A . 7 GLU CG 1 1 6 3434 1 1 7 GLU H H -7.333 7.060 -0.092 1.00 . A A . 7 GLU H 1 1 6 3435 1 1 7 GLU HA H -4.727 7.483 -0.904 1.00 . A A . 7 GLU HA 1 1 6 3436 1 1 7 GLU HB2 H -6.728 9.485 0.146 1.00 . A A . 7 GLU HB2 1 1 6 3437 1 1 7 GLU HB3 H -5.316 9.858 -0.828 1.00 . A A . 7 GLU HB3 1 1 6 3438 1 1 7 GLU HG2 H -6.225 9.006 -2.746 1.00 . A A . 7 GLU HG2 1 1 6 3439 1 1 7 GLU HG3 H -7.297 7.911 -1.874 1.00 . A A . 7 GLU HG3 1 1 6 3440 1 1 7 GLU N N -6.401 6.833 0.103 1.00 . A A . 7 GLU N 1 1 6 3441 1 1 7 GLU O O -3.383 8.468 1.008 1.00 . A A . 7 GLU O 1 1 6 3442 1 1 7 GLU OE1 O -7.776 11.008 -2.572 1.00 . A A . 7 GLU OE1 1 1 6 3443 1 1 7 GLU OE2 O -9.141 9.579 -1.622 1.00 . A A . 7 GLU OE2 1 1 6 3444 1 1 8 GLN C C -3.269 7.339 3.645 1.00 . A A . 8 GLN C 1 1 6 3445 1 1 8 GLN CA C -4.477 8.256 3.552 1.00 . A A . 8 GLN CA 1 1 6 3446 1 1 8 GLN CB C -5.399 7.962 4.734 1.00 . A A . 8 GLN CB 1 1 6 3447 1 1 8 GLN CD C -7.721 8.358 5.630 1.00 . A A . 8 GLN CD 1 1 6 3448 1 1 8 GLN CG C -6.866 8.103 4.408 1.00 . A A . 8 GLN CG 1 1 6 3449 1 1 8 GLN H H -6.147 7.872 2.300 1.00 . A A . 8 GLN H 1 1 6 3450 1 1 8 GLN HA H -4.152 9.285 3.597 1.00 . A A . 8 GLN HA 1 1 6 3451 1 1 8 GLN HB2 H -5.224 6.949 5.061 1.00 . A A . 8 GLN HB2 1 1 6 3452 1 1 8 GLN HB3 H -5.161 8.640 5.541 1.00 . A A . 8 GLN HB3 1 1 6 3453 1 1 8 GLN HE21 H -7.489 10.321 5.407 1.00 . A A . 8 GLN HE21 1 1 6 3454 1 1 8 GLN HE22 H -8.468 9.819 6.746 1.00 . A A . 8 GLN HE22 1 1 6 3455 1 1 8 GLN HG2 H -6.983 8.919 3.720 1.00 . A A . 8 GLN HG2 1 1 6 3456 1 1 8 GLN HG3 H -7.203 7.190 3.939 1.00 . A A . 8 GLN HG3 1 1 6 3457 1 1 8 GLN N N -5.182 8.051 2.286 1.00 . A A . 8 GLN N 1 1 6 3458 1 1 8 GLN NE2 N -7.911 9.624 5.964 1.00 . A A . 8 GLN NE2 1 1 6 3459 1 1 8 GLN O O -2.133 7.784 3.810 1.00 . A A . 8 GLN O 1 1 6 3460 1 1 8 GLN OE1 O -8.202 7.427 6.272 1.00 . A A . 8 GLN OE1 1 1 6 3461 1 1 9 THR C C -1.672 5.038 2.386 1.00 . A A . 9 THR C 1 1 6 3462 1 1 9 THR CA C -2.535 5.036 3.615 1.00 . A A . 9 THR CA 1 1 6 3463 1 1 9 THR CB C -3.176 3.663 3.811 1.00 . A A . 9 THR CB 1 1 6 3464 1 1 9 THR CG2 C -3.820 3.564 5.180 1.00 . A A . 9 THR CG2 1 1 6 3465 1 1 9 THR H H -4.441 5.769 3.371 1.00 . A A . 9 THR H 1 1 6 3466 1 1 9 THR HA H -1.933 5.254 4.452 1.00 . A A . 9 THR HA 1 1 6 3467 1 1 9 THR HB H -2.411 2.930 3.733 1.00 . A A . 9 THR HB 1 1 6 3468 1 1 9 THR HG1 H -3.999 2.570 2.390 1.00 . A A . 9 THR HG1 1 1 6 3469 1 1 9 THR HG21 H -3.069 3.709 5.942 1.00 . A A . 9 THR HG21 1 1 6 3470 1 1 9 THR HG22 H -4.273 2.593 5.297 1.00 . A A . 9 THR HG22 1 1 6 3471 1 1 9 THR HG23 H -4.576 4.330 5.270 1.00 . A A . 9 THR HG23 1 1 6 3472 1 1 9 THR N N -3.537 6.051 3.531 1.00 . A A . 9 THR N 1 1 6 3473 1 1 9 THR O O -0.476 4.778 2.448 1.00 . A A . 9 THR O 1 1 6 3474 1 1 9 THR OG1 O -4.159 3.425 2.801 1.00 . A A . 9 THR OG1 1 1 6 3475 1 1 10 ILE C C -0.480 6.427 0.150 1.00 . A A . 10 ILE C 1 1 6 3476 1 1 10 ILE CA C -1.622 5.466 0.018 1.00 . A A . 10 ILE CA 1 1 6 3477 1 1 10 ILE CB C -2.572 5.966 -1.072 1.00 . A A . 10 ILE CB 1 1 6 3478 1 1 10 ILE CD1 C -4.484 5.295 -2.531 1.00 . A A . 10 ILE CD1 1 1 6 3479 1 1 10 ILE CG1 C -3.473 4.841 -1.529 1.00 . A A . 10 ILE CG1 1 1 6 3480 1 1 10 ILE CG2 C -1.805 6.528 -2.248 1.00 . A A . 10 ILE CG2 1 1 6 3481 1 1 10 ILE H H -3.256 5.508 1.324 1.00 . A A . 10 ILE H 1 1 6 3482 1 1 10 ILE HA H -1.257 4.507 -0.272 1.00 . A A . 10 ILE HA 1 1 6 3483 1 1 10 ILE HB H -3.179 6.756 -0.657 1.00 . A A . 10 ILE HB 1 1 6 3484 1 1 10 ILE HD11 H -3.976 5.710 -3.385 1.00 . A A . 10 ILE HD11 1 1 6 3485 1 1 10 ILE HD12 H -5.106 6.047 -2.076 1.00 . A A . 10 ILE HD12 1 1 6 3486 1 1 10 ILE HD13 H -5.088 4.455 -2.835 1.00 . A A . 10 ILE HD13 1 1 6 3487 1 1 10 ILE HG12 H -2.873 4.065 -1.983 1.00 . A A . 10 ILE HG12 1 1 6 3488 1 1 10 ILE HG13 H -3.998 4.439 -0.678 1.00 . A A . 10 ILE HG13 1 1 6 3489 1 1 10 ILE HG21 H -1.180 7.336 -1.908 1.00 . A A . 10 ILE HG21 1 1 6 3490 1 1 10 ILE HG22 H -2.501 6.892 -2.986 1.00 . A A . 10 ILE HG22 1 1 6 3491 1 1 10 ILE HG23 H -1.194 5.751 -2.676 1.00 . A A . 10 ILE HG23 1 1 6 3492 1 1 10 ILE N N -2.300 5.353 1.282 1.00 . A A . 10 ILE N 1 1 6 3493 1 1 10 ILE O O 0.658 6.074 -0.048 1.00 . A A . 10 ILE O 1 1 6 3494 1 1 11 LYS C C 1.259 8.305 1.701 1.00 . A A . 11 LYS C 1 1 6 3495 1 1 11 LYS CA C 0.223 8.635 0.658 1.00 . A A . 11 LYS CA 1 1 6 3496 1 1 11 LYS CB C -0.423 9.986 0.887 1.00 . A A . 11 LYS CB 1 1 6 3497 1 1 11 LYS CD C -2.249 11.545 0.149 1.00 . A A . 11 LYS CD 1 1 6 3498 1 1 11 LYS CE C -1.417 12.751 0.551 1.00 . A A . 11 LYS CE 1 1 6 3499 1 1 11 LYS CG C -1.372 10.362 -0.233 1.00 . A A . 11 LYS CG 1 1 6 3500 1 1 11 LYS H H -1.701 7.822 0.838 1.00 . A A . 11 LYS H 1 1 6 3501 1 1 11 LYS HA H 0.723 8.644 -0.287 1.00 . A A . 11 LYS HA 1 1 6 3502 1 1 11 LYS HB2 H -0.979 9.950 1.806 1.00 . A A . 11 LYS HB2 1 1 6 3503 1 1 11 LYS HB3 H 0.343 10.742 0.959 1.00 . A A . 11 LYS HB3 1 1 6 3504 1 1 11 LYS HD2 H -2.866 11.812 -0.695 1.00 . A A . 11 LYS HD2 1 1 6 3505 1 1 11 LYS HD3 H -2.876 11.258 0.980 1.00 . A A . 11 LYS HD3 1 1 6 3506 1 1 11 LYS HE2 H -0.808 12.484 1.402 1.00 . A A . 11 LYS HE2 1 1 6 3507 1 1 11 LYS HE3 H -0.777 13.023 -0.276 1.00 . A A . 11 LYS HE3 1 1 6 3508 1 1 11 LYS HG2 H -0.795 10.622 -1.109 1.00 . A A . 11 LYS HG2 1 1 6 3509 1 1 11 LYS HG3 H -2.001 9.501 -0.452 1.00 . A A . 11 LYS HG3 1 1 6 3510 1 1 11 LYS HZ1 H -1.675 14.682 1.297 1.00 . A A . 11 LYS HZ1 1 1 6 3511 1 1 11 LYS HZ2 H -2.977 13.640 1.624 1.00 . A A . 11 LYS HZ2 1 1 6 3512 1 1 11 LYS HZ3 H -2.761 14.273 0.062 1.00 . A A . 11 LYS HZ3 1 1 6 3513 1 1 11 LYS N N -0.779 7.617 0.574 1.00 . A A . 11 LYS N 1 1 6 3514 1 1 11 LYS NZ N -2.266 13.915 0.908 1.00 . A A . 11 LYS NZ 1 1 6 3515 1 1 11 LYS O O 2.391 8.731 1.574 1.00 . A A . 11 LYS O 1 1 6 3516 1 1 12 GLN C C 2.774 6.075 3.136 1.00 . A A . 12 GLN C 1 1 6 3517 1 1 12 GLN CA C 1.786 7.100 3.720 1.00 . A A . 12 GLN CA 1 1 6 3518 1 1 12 GLN CB C 0.930 6.500 4.811 1.00 . A A . 12 GLN CB 1 1 6 3519 1 1 12 GLN CD C -0.452 6.909 6.852 1.00 . A A . 12 GLN CD 1 1 6 3520 1 1 12 GLN CG C 0.404 7.520 5.770 1.00 . A A . 12 GLN CG 1 1 6 3521 1 1 12 GLN H H -0.070 7.314 2.845 1.00 . A A . 12 GLN H 1 1 6 3522 1 1 12 GLN HA H 2.323 7.944 4.113 1.00 . A A . 12 GLN HA 1 1 6 3523 1 1 12 GLN HB2 H 0.074 6.002 4.356 1.00 . A A . 12 GLN HB2 1 1 6 3524 1 1 12 GLN HB3 H 1.485 5.807 5.340 1.00 . A A . 12 GLN HB3 1 1 6 3525 1 1 12 GLN HE21 H -2.057 7.142 5.715 1.00 . A A . 12 GLN HE21 1 1 6 3526 1 1 12 GLN HE22 H -2.323 6.416 7.254 1.00 . A A . 12 GLN HE22 1 1 6 3527 1 1 12 GLN HG2 H 1.232 8.038 6.218 1.00 . A A . 12 GLN HG2 1 1 6 3528 1 1 12 GLN HG3 H -0.183 8.203 5.213 1.00 . A A . 12 GLN HG3 1 1 6 3529 1 1 12 GLN N N 0.872 7.568 2.733 1.00 . A A . 12 GLN N 1 1 6 3530 1 1 12 GLN NE2 N -1.741 6.812 6.584 1.00 . A A . 12 GLN NE2 1 1 6 3531 1 1 12 GLN O O 3.979 6.076 3.430 1.00 . A A . 12 GLN O 1 1 6 3532 1 1 12 GLN OE1 O 0.040 6.529 7.914 1.00 . A A . 12 GLN OE1 1 1 6 3533 1 1 13 LEU C C 3.827 4.617 0.529 1.00 . A A . 13 LEU C 1 1 6 3534 1 1 13 LEU CA C 3.054 4.152 1.729 1.00 . A A . 13 LEU CA 1 1 6 3535 1 1 13 LEU CB C 2.138 3.009 1.374 1.00 . A A . 13 LEU CB 1 1 6 3536 1 1 13 LEU CD1 C 0.437 1.354 2.172 1.00 . A A . 13 LEU CD1 1 1 6 3537 1 1 13 LEU CD2 C 2.273 2.108 3.701 1.00 . A A . 13 LEU CD2 1 1 6 3538 1 1 13 LEU CG C 1.345 2.505 2.561 1.00 . A A . 13 LEU CG 1 1 6 3539 1 1 13 LEU H H 1.376 5.379 1.921 1.00 . A A . 13 LEU H 1 1 6 3540 1 1 13 LEU HA H 3.735 3.830 2.497 1.00 . A A . 13 LEU HA 1 1 6 3541 1 1 13 LEU HB2 H 1.450 3.343 0.610 1.00 . A A . 13 LEU HB2 1 1 6 3542 1 1 13 LEU HB3 H 2.725 2.214 0.989 1.00 . A A . 13 LEU HB3 1 1 6 3543 1 1 13 LEU HD11 H -0.280 1.693 1.439 1.00 . A A . 13 LEU HD11 1 1 6 3544 1 1 13 LEU HD12 H -0.084 0.994 3.046 1.00 . A A . 13 LEU HD12 1 1 6 3545 1 1 13 LEU HD13 H 1.028 0.554 1.751 1.00 . A A . 13 LEU HD13 1 1 6 3546 1 1 13 LEU HD21 H 2.801 2.982 4.056 1.00 . A A . 13 LEU HD21 1 1 6 3547 1 1 13 LEU HD22 H 2.989 1.375 3.349 1.00 . A A . 13 LEU HD22 1 1 6 3548 1 1 13 LEU HD23 H 1.694 1.685 4.509 1.00 . A A . 13 LEU HD23 1 1 6 3549 1 1 13 LEU HG H 0.735 3.320 2.905 1.00 . A A . 13 LEU HG 1 1 6 3550 1 1 13 LEU N N 2.277 5.241 2.255 1.00 . A A . 13 LEU N 1 1 6 3551 1 1 13 LEU O O 4.955 4.210 0.298 1.00 . A A . 13 LEU O 1 1 6 3552 1 1 14 MET C C 4.892 7.128 -0.669 1.00 . A A . 14 MET C 1 1 6 3553 1 1 14 MET CA C 3.867 6.183 -1.275 1.00 . A A . 14 MET CA 1 1 6 3554 1 1 14 MET CB C 2.821 6.925 -2.043 1.00 . A A . 14 MET CB 1 1 6 3555 1 1 14 MET CE C 2.558 3.397 -2.235 1.00 . A A . 14 MET CE 1 1 6 3556 1 1 14 MET CG C 2.023 6.051 -2.984 1.00 . A A . 14 MET CG 1 1 6 3557 1 1 14 MET H H 2.202 5.567 -0.190 1.00 . A A . 14 MET H 1 1 6 3558 1 1 14 MET HA H 4.356 5.482 -1.931 1.00 . A A . 14 MET HA 1 1 6 3559 1 1 14 MET HB2 H 2.130 7.372 -1.348 1.00 . A A . 14 MET HB2 1 1 6 3560 1 1 14 MET HB3 H 3.303 7.695 -2.620 1.00 . A A . 14 MET HB3 1 1 6 3561 1 1 14 MET HE1 H 3.369 3.803 -1.648 1.00 . A A . 14 MET HE1 1 1 6 3562 1 1 14 MET HE2 H 2.901 3.206 -3.240 1.00 . A A . 14 MET HE2 1 1 6 3563 1 1 14 MET HE3 H 2.214 2.476 -1.788 1.00 . A A . 14 MET HE3 1 1 6 3564 1 1 14 MET HG2 H 1.260 6.652 -3.385 1.00 . A A . 14 MET HG2 1 1 6 3565 1 1 14 MET HG3 H 2.681 5.737 -3.758 1.00 . A A . 14 MET HG3 1 1 6 3566 1 1 14 MET N N 3.196 5.461 -0.253 1.00 . A A . 14 MET N 1 1 6 3567 1 1 14 MET O O 5.868 7.513 -1.308 1.00 . A A . 14 MET O 1 1 6 3568 1 1 14 MET SD S 1.223 4.583 -2.277 1.00 . A A . 14 MET SD 1 1 6 3569 1 1 15 ASP C C 6.875 7.586 1.600 1.00 . A A . 15 ASP C 1 1 6 3570 1 1 15 ASP CA C 5.560 8.310 1.366 1.00 . A A . 15 ASP CA 1 1 6 3571 1 1 15 ASP CB C 4.914 8.690 2.697 1.00 . A A . 15 ASP CB 1 1 6 3572 1 1 15 ASP CG C 5.842 9.447 3.631 1.00 . A A . 15 ASP CG 1 1 6 3573 1 1 15 ASP H H 3.802 7.196 0.985 1.00 . A A . 15 ASP H 1 1 6 3574 1 1 15 ASP HA H 5.757 9.211 0.805 1.00 . A A . 15 ASP HA 1 1 6 3575 1 1 15 ASP HB2 H 4.055 9.309 2.493 1.00 . A A . 15 ASP HB2 1 1 6 3576 1 1 15 ASP HB3 H 4.579 7.783 3.191 1.00 . A A . 15 ASP HB3 1 1 6 3577 1 1 15 ASP N N 4.645 7.487 0.580 1.00 . A A . 15 ASP N 1 1 6 3578 1 1 15 ASP O O 7.917 8.221 1.737 1.00 . A A . 15 ASP O 1 1 6 3579 1 1 15 ASP OD1 O 6.214 10.595 3.311 1.00 . A A . 15 ASP OD1 1 1 6 3580 1 1 15 ASP OD2 O 6.181 8.905 4.703 1.00 . A A . 15 ASP OD2 1 1 6 3581 1 1 16 LEU C C 8.904 5.721 0.437 1.00 . A A . 16 LEU C 1 1 6 3582 1 1 16 LEU CA C 8.010 5.450 1.651 1.00 . A A . 16 LEU CA 1 1 6 3583 1 1 16 LEU CB C 7.476 4.056 1.603 1.00 . A A . 16 LEU CB 1 1 6 3584 1 1 16 LEU CD1 C 6.498 4.351 3.901 1.00 . A A . 16 LEU CD1 1 1 6 3585 1 1 16 LEU CD2 C 6.290 2.183 2.711 1.00 . A A . 16 LEU CD2 1 1 6 3586 1 1 16 LEU CG C 7.163 3.400 2.925 1.00 . A A . 16 LEU CG 1 1 6 3587 1 1 16 LEU H H 5.978 5.746 1.666 1.00 . A A . 16 LEU H 1 1 6 3588 1 1 16 LEU HA H 8.547 5.609 2.570 1.00 . A A . 16 LEU HA 1 1 6 3589 1 1 16 LEU HB2 H 6.561 4.079 1.030 1.00 . A A . 16 LEU HB2 1 1 6 3590 1 1 16 LEU HB3 H 8.172 3.461 1.082 1.00 . A A . 16 LEU HB3 1 1 6 3591 1 1 16 LEU HD11 H 7.167 5.171 4.115 1.00 . A A . 16 LEU HD11 1 1 6 3592 1 1 16 LEU HD12 H 6.266 3.825 4.815 1.00 . A A . 16 LEU HD12 1 1 6 3593 1 1 16 LEU HD13 H 5.589 4.733 3.462 1.00 . A A . 16 LEU HD13 1 1 6 3594 1 1 16 LEU HD21 H 5.387 2.481 2.197 1.00 . A A . 16 LEU HD21 1 1 6 3595 1 1 16 LEU HD22 H 6.035 1.750 3.668 1.00 . A A . 16 LEU HD22 1 1 6 3596 1 1 16 LEU HD23 H 6.822 1.457 2.116 1.00 . A A . 16 LEU HD23 1 1 6 3597 1 1 16 LEU HG H 8.071 3.088 3.336 1.00 . A A . 16 LEU HG 1 1 6 3598 1 1 16 LEU N N 6.837 6.250 1.632 1.00 . A A . 16 LEU N 1 1 6 3599 1 1 16 LEU O O 10.094 5.404 0.434 1.00 . A A . 16 LEU O 1 1 6 3600 1 1 17 GLY C C 8.348 5.743 -2.951 1.00 . A A . 17 GLY C 1 1 6 3601 1 1 17 GLY CA C 8.977 6.555 -1.843 1.00 . A A . 17 GLY CA 1 1 6 3602 1 1 17 GLY H H 7.357 6.548 -0.484 1.00 . A A . 17 GLY H 1 1 6 3603 1 1 17 GLY HA2 H 8.899 7.607 -2.081 1.00 . A A . 17 GLY HA2 1 1 6 3604 1 1 17 GLY HA3 H 10.018 6.285 -1.751 1.00 . A A . 17 GLY HA3 1 1 6 3605 1 1 17 GLY N N 8.298 6.297 -0.585 1.00 . A A . 17 GLY N 1 1 6 3606 1 1 17 GLY O O 8.749 5.812 -4.113 1.00 . A A . 17 GLY O 1 1 6 3607 1 1 18 PHE C C 5.567 4.696 -4.252 1.00 . A A . 18 PHE C 1 1 6 3608 1 1 18 PHE CA C 6.672 4.040 -3.435 1.00 . A A . 18 PHE CA 1 1 6 3609 1 1 18 PHE CB C 6.141 2.936 -2.548 1.00 . A A . 18 PHE CB 1 1 6 3610 1 1 18 PHE CD1 C 8.304 1.741 -2.727 1.00 . A A . 18 PHE CD1 1 1 6 3611 1 1 18 PHE CD2 C 7.278 2.036 -0.630 1.00 . A A . 18 PHE CD2 1 1 6 3612 1 1 18 PHE CE1 C 9.354 1.098 -2.124 1.00 . A A . 18 PHE CE1 1 1 6 3613 1 1 18 PHE CE2 C 8.293 1.421 -0.033 1.00 . A A . 18 PHE CE2 1 1 6 3614 1 1 18 PHE CG C 7.255 2.210 -1.957 1.00 . A A . 18 PHE CG 1 1 6 3615 1 1 18 PHE CZ C 9.338 0.945 -0.759 1.00 . A A . 18 PHE CZ 1 1 6 3616 1 1 18 PHE H H 7.034 5.053 -1.635 1.00 . A A . 18 PHE H 1 1 6 3617 1 1 18 PHE HA H 7.412 3.621 -4.092 1.00 . A A . 18 PHE HA 1 1 6 3618 1 1 18 PHE HB2 H 5.563 3.368 -1.746 1.00 . A A . 18 PHE HB2 1 1 6 3619 1 1 18 PHE HB3 H 5.544 2.237 -3.075 1.00 . A A . 18 PHE HB3 1 1 6 3620 1 1 18 PHE HD1 H 8.288 1.878 -3.798 1.00 . A A . 18 PHE HD1 1 1 6 3621 1 1 18 PHE HD2 H 6.473 2.398 -0.037 1.00 . A A . 18 PHE HD2 1 1 6 3622 1 1 18 PHE HE1 H 10.180 0.723 -2.710 1.00 . A A . 18 PHE HE1 1 1 6 3623 1 1 18 PHE HE2 H 8.262 1.308 1.006 1.00 . A A . 18 PHE HE2 1 1 6 3624 1 1 18 PHE HZ H 10.131 0.467 -0.259 1.00 . A A . 18 PHE HZ 1 1 6 3625 1 1 18 PHE N N 7.339 4.986 -2.563 1.00 . A A . 18 PHE N 1 1 6 3626 1 1 18 PHE O O 5.022 5.720 -3.860 1.00 . A A . 18 PHE O 1 1 6 3627 1 1 19 PRO C C 2.827 4.149 -5.841 1.00 . A A . 19 PRO C 1 1 6 3628 1 1 19 PRO CA C 4.196 4.623 -6.290 1.00 . A A . 19 PRO CA 1 1 6 3629 1 1 19 PRO CB C 4.541 3.983 -7.613 1.00 . A A . 19 PRO CB 1 1 6 3630 1 1 19 PRO CD C 5.914 2.957 -6.023 1.00 . A A . 19 PRO CD 1 1 6 3631 1 1 19 PRO CG C 5.030 2.670 -7.208 1.00 . A A . 19 PRO CG 1 1 6 3632 1 1 19 PRO HA H 4.206 5.698 -6.386 1.00 . A A . 19 PRO HA 1 1 6 3633 1 1 19 PRO HB2 H 3.671 3.916 -8.242 1.00 . A A . 19 PRO HB2 1 1 6 3634 1 1 19 PRO HB3 H 5.318 4.535 -8.100 1.00 . A A . 19 PRO HB3 1 1 6 3635 1 1 19 PRO HD2 H 5.913 2.131 -5.333 1.00 . A A . 19 PRO HD2 1 1 6 3636 1 1 19 PRO HD3 H 6.914 3.189 -6.345 1.00 . A A . 19 PRO HD3 1 1 6 3637 1 1 19 PRO HG2 H 4.204 2.028 -6.932 1.00 . A A . 19 PRO HG2 1 1 6 3638 1 1 19 PRO HG3 H 5.584 2.260 -8.007 1.00 . A A . 19 PRO HG3 1 1 6 3639 1 1 19 PRO N N 5.263 4.137 -5.426 1.00 . A A . 19 PRO N 1 1 6 3640 1 1 19 PRO O O 2.707 3.222 -5.055 1.00 . A A . 19 PRO O 1 1 6 3641 1 1 20 ARG C C 0.178 2.951 -6.409 1.00 . A A . 20 ARG C 1 1 6 3642 1 1 20 ARG CA C 0.429 4.419 -6.105 1.00 . A A . 20 ARG CA 1 1 6 3643 1 1 20 ARG CB C -0.465 5.293 -6.970 1.00 . A A . 20 ARG CB 1 1 6 3644 1 1 20 ARG CD C -2.769 5.856 -7.747 1.00 . A A . 20 ARG CD 1 1 6 3645 1 1 20 ARG CG C -1.915 4.907 -6.923 1.00 . A A . 20 ARG CG 1 1 6 3646 1 1 20 ARG CZ C -5.117 5.382 -8.330 1.00 . A A . 20 ARG CZ 1 1 6 3647 1 1 20 ARG H H 2.010 5.432 -7.075 1.00 . A A . 20 ARG H 1 1 6 3648 1 1 20 ARG HA H 0.235 4.612 -5.056 1.00 . A A . 20 ARG HA 1 1 6 3649 1 1 20 ARG HB2 H -0.370 6.314 -6.648 1.00 . A A . 20 ARG HB2 1 1 6 3650 1 1 20 ARG HB3 H -0.134 5.218 -7.991 1.00 . A A . 20 ARG HB3 1 1 6 3651 1 1 20 ARG HD2 H -2.454 6.868 -7.546 1.00 . A A . 20 ARG HD2 1 1 6 3652 1 1 20 ARG HD3 H -2.617 5.633 -8.793 1.00 . A A . 20 ARG HD3 1 1 6 3653 1 1 20 ARG HE H -4.481 5.983 -6.528 1.00 . A A . 20 ARG HE 1 1 6 3654 1 1 20 ARG HG2 H -2.010 3.911 -7.322 1.00 . A A . 20 ARG HG2 1 1 6 3655 1 1 20 ARG HG3 H -2.236 4.920 -5.905 1.00 . A A . 20 ARG HG3 1 1 6 3656 1 1 20 ARG HH11 H -3.788 4.922 -9.797 1.00 . A A . 20 ARG HH11 1 1 6 3657 1 1 20 ARG HH12 H -5.464 4.704 -10.215 1.00 . A A . 20 ARG HH12 1 1 6 3658 1 1 20 ARG HH21 H -6.664 5.705 -7.067 1.00 . A A . 20 ARG HH21 1 1 6 3659 1 1 20 ARG HH22 H -7.109 5.162 -8.655 1.00 . A A . 20 ARG HH22 1 1 6 3660 1 1 20 ARG N N 1.815 4.753 -6.400 1.00 . A A . 20 ARG N 1 1 6 3661 1 1 20 ARG NE N -4.192 5.736 -7.442 1.00 . A A . 20 ARG NE 1 1 6 3662 1 1 20 ARG NH1 N -4.762 4.971 -9.543 1.00 . A A . 20 ARG NH1 1 1 6 3663 1 1 20 ARG NH2 N -6.398 5.415 -7.990 1.00 . A A . 20 ARG NH2 1 1 6 3664 1 1 20 ARG O O -0.526 2.242 -5.682 1.00 . A A . 20 ARG O 1 1 6 3665 1 1 21 ASP C C 1.216 0.204 -6.790 1.00 . A A . 21 ASP C 1 1 6 3666 1 1 21 ASP CA C 0.798 1.137 -7.930 1.00 . A A . 21 ASP CA 1 1 6 3667 1 1 21 ASP CB C 1.764 1.001 -9.113 1.00 . A A . 21 ASP CB 1 1 6 3668 1 1 21 ASP CG C 2.106 -0.432 -9.468 1.00 . A A . 21 ASP CG 1 1 6 3669 1 1 21 ASP H H 1.239 3.203 -8.050 1.00 . A A . 21 ASP H 1 1 6 3670 1 1 21 ASP HA H -0.195 0.872 -8.254 1.00 . A A . 21 ASP HA 1 1 6 3671 1 1 21 ASP HB2 H 1.319 1.465 -9.981 1.00 . A A . 21 ASP HB2 1 1 6 3672 1 1 21 ASP HB3 H 2.681 1.519 -8.873 1.00 . A A . 21 ASP HB3 1 1 6 3673 1 1 21 ASP N N 0.781 2.531 -7.500 1.00 . A A . 21 ASP N 1 1 6 3674 1 1 21 ASP O O 0.712 -0.915 -6.676 1.00 . A A . 21 ASP O 1 1 6 3675 1 1 21 ASP OD1 O 1.255 -1.124 -10.067 1.00 . A A . 21 ASP OD1 1 1 6 3676 1 1 21 ASP OD2 O 3.250 -0.858 -9.185 1.00 . A A . 21 ASP OD2 1 1 6 3677 1 1 22 ALA C C 1.586 -0.293 -3.725 1.00 . A A . 22 ALA C 1 1 6 3678 1 1 22 ALA CA C 2.621 -0.113 -4.830 1.00 . A A . 22 ALA CA 1 1 6 3679 1 1 22 ALA CB C 3.895 0.494 -4.265 1.00 . A A . 22 ALA CB 1 1 6 3680 1 1 22 ALA H H 2.425 1.611 -6.039 1.00 . A A . 22 ALA H 1 1 6 3681 1 1 22 ALA HA H 2.870 -1.086 -5.226 1.00 . A A . 22 ALA HA 1 1 6 3682 1 1 22 ALA HB1 H 3.667 1.446 -3.807 1.00 . A A . 22 ALA HB1 1 1 6 3683 1 1 22 ALA HB2 H 4.608 0.639 -5.062 1.00 . A A . 22 ALA HB2 1 1 6 3684 1 1 22 ALA HB3 H 4.313 -0.171 -3.524 1.00 . A A . 22 ALA HB3 1 1 6 3685 1 1 22 ALA N N 2.108 0.688 -5.931 1.00 . A A . 22 ALA N 1 1 6 3686 1 1 22 ALA O O 1.572 -1.334 -3.068 1.00 . A A . 22 ALA O 1 1 6 3687 1 1 23 VAL C C -1.236 -0.561 -2.963 1.00 . A A . 23 VAL C 1 1 6 3688 1 1 23 VAL CA C -0.329 0.549 -2.512 1.00 . A A . 23 VAL CA 1 1 6 3689 1 1 23 VAL CB C -1.132 1.861 -2.272 1.00 . A A . 23 VAL CB 1 1 6 3690 1 1 23 VAL CG1 C -2.502 1.827 -2.903 1.00 . A A . 23 VAL CG1 1 1 6 3691 1 1 23 VAL CG2 C -1.274 2.125 -0.799 1.00 . A A . 23 VAL CG2 1 1 6 3692 1 1 23 VAL H H 0.744 1.517 -4.046 1.00 . A A . 23 VAL H 1 1 6 3693 1 1 23 VAL HA H 0.120 0.260 -1.588 1.00 . A A . 23 VAL HA 1 1 6 3694 1 1 23 VAL HB H -0.583 2.675 -2.714 1.00 . A A . 23 VAL HB 1 1 6 3695 1 1 23 VAL HG11 H -2.385 1.613 -3.952 1.00 . A A . 23 VAL HG11 1 1 6 3696 1 1 23 VAL HG12 H -2.991 2.780 -2.770 1.00 . A A . 23 VAL HG12 1 1 6 3697 1 1 23 VAL HG13 H -3.090 1.045 -2.434 1.00 . A A . 23 VAL HG13 1 1 6 3698 1 1 23 VAL HG21 H -0.295 2.216 -0.357 1.00 . A A . 23 VAL HG21 1 1 6 3699 1 1 23 VAL HG22 H -1.814 1.306 -0.341 1.00 . A A . 23 VAL HG22 1 1 6 3700 1 1 23 VAL HG23 H -1.827 3.042 -0.657 1.00 . A A . 23 VAL HG23 1 1 6 3701 1 1 23 VAL N N 0.711 0.698 -3.510 1.00 . A A . 23 VAL N 1 1 6 3702 1 1 23 VAL O O -1.524 -1.494 -2.259 1.00 . A A . 23 VAL O 1 1 6 3703 1 1 24 VAL C C -1.980 -2.845 -4.771 1.00 . A A . 24 VAL C 1 1 6 3704 1 1 24 VAL CA C -2.552 -1.439 -4.695 1.00 . A A . 24 VAL CA 1 1 6 3705 1 1 24 VAL CB C -3.103 -0.970 -6.039 1.00 . A A . 24 VAL CB 1 1 6 3706 1 1 24 VAL CG1 C -3.763 -2.115 -6.786 1.00 . A A . 24 VAL CG1 1 1 6 3707 1 1 24 VAL CG2 C -4.094 0.155 -5.802 1.00 . A A . 24 VAL CG2 1 1 6 3708 1 1 24 VAL H H -1.306 0.262 -4.734 1.00 . A A . 24 VAL H 1 1 6 3709 1 1 24 VAL HA H -3.368 -1.473 -3.987 1.00 . A A . 24 VAL HA 1 1 6 3710 1 1 24 VAL HB H -2.277 -0.580 -6.624 1.00 . A A . 24 VAL HB 1 1 6 3711 1 1 24 VAL HG11 H -3.025 -2.877 -6.990 1.00 . A A . 24 VAL HG11 1 1 6 3712 1 1 24 VAL HG12 H -4.179 -1.752 -7.714 1.00 . A A . 24 VAL HG12 1 1 6 3713 1 1 24 VAL HG13 H -4.549 -2.533 -6.172 1.00 . A A . 24 VAL HG13 1 1 6 3714 1 1 24 VAL HG21 H -3.569 1.018 -5.422 1.00 . A A . 24 VAL HG21 1 1 6 3715 1 1 24 VAL HG22 H -4.831 -0.169 -5.077 1.00 . A A . 24 VAL HG22 1 1 6 3716 1 1 24 VAL HG23 H -4.586 0.408 -6.731 1.00 . A A . 24 VAL HG23 1 1 6 3717 1 1 24 VAL N N -1.619 -0.487 -4.182 1.00 . A A . 24 VAL N 1 1 6 3718 1 1 24 VAL O O -2.635 -3.776 -4.333 1.00 . A A . 24 VAL O 1 1 6 3719 1 1 25 LYS C C -0.060 -4.926 -3.922 1.00 . A A . 25 LYS C 1 1 6 3720 1 1 25 LYS CA C -0.164 -4.338 -5.318 1.00 . A A . 25 LYS CA 1 1 6 3721 1 1 25 LYS CB C 1.228 -4.276 -5.938 1.00 . A A . 25 LYS CB 1 1 6 3722 1 1 25 LYS CD C 2.616 -3.836 -7.947 1.00 . A A . 25 LYS CD 1 1 6 3723 1 1 25 LYS CE C 2.715 -3.942 -9.455 1.00 . A A . 25 LYS CE 1 1 6 3724 1 1 25 LYS CG C 1.229 -4.173 -7.445 1.00 . A A . 25 LYS CG 1 1 6 3725 1 1 25 LYS H H -0.248 -2.232 -5.578 1.00 . A A . 25 LYS H 1 1 6 3726 1 1 25 LYS HA H -0.797 -4.972 -5.923 1.00 . A A . 25 LYS HA 1 1 6 3727 1 1 25 LYS HB2 H 1.746 -3.415 -5.542 1.00 . A A . 25 LYS HB2 1 1 6 3728 1 1 25 LYS HB3 H 1.772 -5.168 -5.660 1.00 . A A . 25 LYS HB3 1 1 6 3729 1 1 25 LYS HD2 H 2.850 -2.823 -7.652 1.00 . A A . 25 LYS HD2 1 1 6 3730 1 1 25 LYS HD3 H 3.324 -4.516 -7.500 1.00 . A A . 25 LYS HD3 1 1 6 3731 1 1 25 LYS HE2 H 2.667 -4.983 -9.736 1.00 . A A . 25 LYS HE2 1 1 6 3732 1 1 25 LYS HE3 H 1.888 -3.407 -9.898 1.00 . A A . 25 LYS HE3 1 1 6 3733 1 1 25 LYS HG2 H 0.920 -5.119 -7.866 1.00 . A A . 25 LYS HG2 1 1 6 3734 1 1 25 LYS HG3 H 0.545 -3.395 -7.750 1.00 . A A . 25 LYS HG3 1 1 6 3735 1 1 25 LYS HZ1 H 4.092 -3.534 -10.971 1.00 . A A . 25 LYS HZ1 1 1 6 3736 1 1 25 LYS HZ2 H 4.797 -3.793 -9.451 1.00 . A A . 25 LYS HZ2 1 1 6 3737 1 1 25 LYS HZ3 H 3.996 -2.335 -9.779 1.00 . A A . 25 LYS HZ3 1 1 6 3738 1 1 25 LYS N N -0.762 -3.010 -5.263 1.00 . A A . 25 LYS N 1 1 6 3739 1 1 25 LYS NZ N 3.989 -3.363 -9.949 1.00 . A A . 25 LYS NZ 1 1 6 3740 1 1 25 LYS O O -0.413 -6.086 -3.677 1.00 . A A . 25 LYS O 1 1 6 3741 1 1 26 ALA C C -0.501 -4.753 -0.840 1.00 . A A . 26 ALA C 1 1 6 3742 1 1 26 ALA CA C 0.724 -4.582 -1.679 1.00 . A A . 26 ALA CA 1 1 6 3743 1 1 26 ALA CB C 1.706 -3.648 -1.005 1.00 . A A . 26 ALA CB 1 1 6 3744 1 1 26 ALA H H 0.418 -3.124 -3.190 1.00 . A A . 26 ALA H 1 1 6 3745 1 1 26 ALA HA H 1.191 -5.549 -1.795 1.00 . A A . 26 ALA HA 1 1 6 3746 1 1 26 ALA HB1 H 1.247 -2.678 -0.874 1.00 . A A . 26 ALA HB1 1 1 6 3747 1 1 26 ALA HB2 H 2.587 -3.550 -1.622 1.00 . A A . 26 ALA HB2 1 1 6 3748 1 1 26 ALA HB3 H 1.983 -4.050 -0.041 1.00 . A A . 26 ALA HB3 1 1 6 3749 1 1 26 ALA N N 0.379 -4.097 -2.994 1.00 . A A . 26 ALA N 1 1 6 3750 1 1 26 ALA O O -0.671 -5.766 -0.170 1.00 . A A . 26 ALA O 1 1 6 3751 1 1 27 LEU C C -3.492 -4.821 -0.668 1.00 . A A . 27 LEU C 1 1 6 3752 1 1 27 LEU CA C -2.548 -3.775 -0.102 1.00 . A A . 27 LEU CA 1 1 6 3753 1 1 27 LEU CB C -3.168 -2.382 -0.082 1.00 . A A . 27 LEU CB 1 1 6 3754 1 1 27 LEU CD1 C -2.668 -1.295 2.106 1.00 . A A . 27 LEU CD1 1 1 6 3755 1 1 27 LEU CD2 C -0.928 -1.356 0.399 1.00 . A A . 27 LEU CD2 1 1 6 3756 1 1 27 LEU CG C -2.401 -1.268 0.633 1.00 . A A . 27 LEU CG 1 1 6 3757 1 1 27 LEU H H -1.211 -3.002 -1.505 1.00 . A A . 27 LEU H 1 1 6 3758 1 1 27 LEU HA H -2.275 -4.053 0.904 1.00 . A A . 27 LEU HA 1 1 6 3759 1 1 27 LEU HB2 H -3.289 -2.070 -1.099 1.00 . A A . 27 LEU HB2 1 1 6 3760 1 1 27 LEU HB3 H -4.147 -2.457 0.368 1.00 . A A . 27 LEU HB3 1 1 6 3761 1 1 27 LEU HD11 H -2.337 -2.242 2.503 1.00 . A A . 27 LEU HD11 1 1 6 3762 1 1 27 LEU HD12 H -3.727 -1.180 2.276 1.00 . A A . 27 LEU HD12 1 1 6 3763 1 1 27 LEU HD13 H -2.130 -0.493 2.585 1.00 . A A . 27 LEU HD13 1 1 6 3764 1 1 27 LEU HD21 H -0.432 -0.527 0.871 1.00 . A A . 27 LEU HD21 1 1 6 3765 1 1 27 LEU HD22 H -0.749 -1.341 -0.663 1.00 . A A . 27 LEU HD22 1 1 6 3766 1 1 27 LEU HD23 H -0.572 -2.288 0.812 1.00 . A A . 27 LEU HD23 1 1 6 3767 1 1 27 LEU HG H -2.722 -0.333 0.235 1.00 . A A . 27 LEU HG 1 1 6 3768 1 1 27 LEU N N -1.365 -3.772 -0.895 1.00 . A A . 27 LEU N 1 1 6 3769 1 1 27 LEU O O -4.330 -5.345 0.025 1.00 . A A . 27 LEU O 1 1 6 3770 1 1 28 LYS C C -3.738 -7.536 -1.842 1.00 . A A . 28 LYS C 1 1 6 3771 1 1 28 LYS CA C -4.098 -6.228 -2.532 1.00 . A A . 28 LYS CA 1 1 6 3772 1 1 28 LYS CB C -3.847 -6.364 -4.019 1.00 . A A . 28 LYS CB 1 1 6 3773 1 1 28 LYS CD C -4.429 -5.540 -6.284 1.00 . A A . 28 LYS CD 1 1 6 3774 1 1 28 LYS CE C -4.214 -6.896 -6.940 1.00 . A A . 28 LYS CE 1 1 6 3775 1 1 28 LYS CG C -4.905 -5.683 -4.863 1.00 . A A . 28 LYS CG 1 1 6 3776 1 1 28 LYS H H -2.813 -4.535 -2.529 1.00 . A A . 28 LYS H 1 1 6 3777 1 1 28 LYS HA H -5.148 -6.038 -2.388 1.00 . A A . 28 LYS HA 1 1 6 3778 1 1 28 LYS HB2 H -2.888 -5.927 -4.255 1.00 . A A . 28 LYS HB2 1 1 6 3779 1 1 28 LYS HB3 H -3.831 -7.413 -4.279 1.00 . A A . 28 LYS HB3 1 1 6 3780 1 1 28 LYS HD2 H -5.157 -4.979 -6.851 1.00 . A A . 28 LYS HD2 1 1 6 3781 1 1 28 LYS HD3 H -3.492 -5.008 -6.258 1.00 . A A . 28 LYS HD3 1 1 6 3782 1 1 28 LYS HE2 H -3.449 -7.427 -6.391 1.00 . A A . 28 LYS HE2 1 1 6 3783 1 1 28 LYS HE3 H -5.139 -7.452 -6.893 1.00 . A A . 28 LYS HE3 1 1 6 3784 1 1 28 LYS HG2 H -5.806 -6.280 -4.850 1.00 . A A . 28 LYS HG2 1 1 6 3785 1 1 28 LYS HG3 H -5.109 -4.702 -4.454 1.00 . A A . 28 LYS HG3 1 1 6 3786 1 1 28 LYS HZ1 H -3.716 -7.726 -8.789 1.00 . A A . 28 LYS HZ1 1 1 6 3787 1 1 28 LYS HZ2 H -2.862 -6.306 -8.420 1.00 . A A . 28 LYS HZ2 1 1 6 3788 1 1 28 LYS HZ3 H -4.487 -6.221 -8.897 1.00 . A A . 28 LYS HZ3 1 1 6 3789 1 1 28 LYS N N -3.374 -5.103 -1.955 1.00 . A A . 28 LYS N 1 1 6 3790 1 1 28 LYS NZ N -3.790 -6.779 -8.358 1.00 . A A . 28 LYS NZ 1 1 6 3791 1 1 28 LYS O O -4.629 -8.273 -1.418 1.00 . A A . 28 LYS O 1 1 6 3792 1 1 29 GLN C C -2.208 -9.168 0.334 1.00 . A A . 29 GLN C 1 1 6 3793 1 1 29 GLN CA C -2.048 -9.116 -1.179 1.00 . A A . 29 GLN CA 1 1 6 3794 1 1 29 GLN CB C -0.626 -9.401 -1.609 1.00 . A A . 29 GLN CB 1 1 6 3795 1 1 29 GLN CD C 1.622 -8.403 -2.045 1.00 . A A . 29 GLN CD 1 1 6 3796 1 1 29 GLN CG C 0.407 -8.411 -1.140 1.00 . A A . 29 GLN CG 1 1 6 3797 1 1 29 GLN H H -1.729 -7.191 -1.988 1.00 . A A . 29 GLN H 1 1 6 3798 1 1 29 GLN HA H -2.695 -9.860 -1.617 1.00 . A A . 29 GLN HA 1 1 6 3799 1 1 29 GLN HB2 H -0.353 -10.355 -1.252 1.00 . A A . 29 GLN HB2 1 1 6 3800 1 1 29 GLN HB3 H -0.598 -9.407 -2.668 1.00 . A A . 29 GLN HB3 1 1 6 3801 1 1 29 GLN HE21 H 1.900 -6.478 -1.692 1.00 . A A . 29 GLN HE21 1 1 6 3802 1 1 29 GLN HE22 H 3.021 -7.207 -2.776 1.00 . A A . 29 GLN HE22 1 1 6 3803 1 1 29 GLN HG2 H -0.027 -7.423 -1.122 1.00 . A A . 29 GLN HG2 1 1 6 3804 1 1 29 GLN HG3 H 0.715 -8.691 -0.154 1.00 . A A . 29 GLN HG3 1 1 6 3805 1 1 29 GLN N N -2.440 -7.836 -1.711 1.00 . A A . 29 GLN N 1 1 6 3806 1 1 29 GLN NE2 N 2.247 -7.249 -2.179 1.00 . A A . 29 GLN NE2 1 1 6 3807 1 1 29 GLN O O -2.504 -10.214 0.905 1.00 . A A . 29 GLN O 1 1 6 3808 1 1 29 GLN OE1 O 1.984 -9.423 -2.631 1.00 . A A . 29 GLN OE1 1 1 6 3809 1 1 30 THR C C -3.627 -7.593 2.791 1.00 . A A . 30 THR C 1 1 6 3810 1 1 30 THR CA C -2.188 -7.901 2.402 1.00 . A A . 30 THR CA 1 1 6 3811 1 1 30 THR CB C -1.308 -6.776 2.929 1.00 . A A . 30 THR CB 1 1 6 3812 1 1 30 THR CG2 C 0.159 -7.134 2.786 1.00 . A A . 30 THR CG2 1 1 6 3813 1 1 30 THR H H -1.719 -7.253 0.448 1.00 . A A . 30 THR H 1 1 6 3814 1 1 30 THR HA H -1.879 -8.825 2.867 1.00 . A A . 30 THR HA 1 1 6 3815 1 1 30 THR HB H -1.541 -6.618 3.964 1.00 . A A . 30 THR HB 1 1 6 3816 1 1 30 THR HG1 H -1.078 -5.558 1.396 1.00 . A A . 30 THR HG1 1 1 6 3817 1 1 30 THR HG21 H 0.360 -8.051 3.319 1.00 . A A . 30 THR HG21 1 1 6 3818 1 1 30 THR HG22 H 0.767 -6.339 3.192 1.00 . A A . 30 THR HG22 1 1 6 3819 1 1 30 THR HG23 H 0.392 -7.268 1.736 1.00 . A A . 30 THR HG23 1 1 6 3820 1 1 30 THR N N -2.022 -8.029 0.962 1.00 . A A . 30 THR N 1 1 6 3821 1 1 30 THR O O -3.995 -7.649 3.965 1.00 . A A . 30 THR O 1 1 6 3822 1 1 30 THR OG1 O -1.591 -5.571 2.215 1.00 . A A . 30 THR OG1 1 1 6 3823 1 1 31 ASN C C -5.906 -5.513 2.729 1.00 . A A . 31 ASN C 1 1 6 3824 1 1 31 ASN CA C -5.804 -6.832 1.960 1.00 . A A . 31 ASN CA 1 1 6 3825 1 1 31 ASN CB C -6.633 -7.923 2.654 1.00 . A A . 31 ASN CB 1 1 6 3826 1 1 31 ASN CG C -6.715 -9.221 1.861 1.00 . A A . 31 ASN CG 1 1 6 3827 1 1 31 ASN H H -4.048 -7.268 0.879 1.00 . A A . 31 ASN H 1 1 6 3828 1 1 31 ASN HA H -6.205 -6.662 0.971 1.00 . A A . 31 ASN HA 1 1 6 3829 1 1 31 ASN HB2 H -6.190 -8.143 3.613 1.00 . A A . 31 ASN HB2 1 1 6 3830 1 1 31 ASN HB3 H -7.638 -7.555 2.807 1.00 . A A . 31 ASN HB3 1 1 6 3831 1 1 31 ASN HD21 H -6.955 -8.240 0.148 1.00 . A A . 31 ASN HD21 1 1 6 3832 1 1 31 ASN HD22 H -6.933 -9.964 0.028 1.00 . A A . 31 ASN HD22 1 1 6 3833 1 1 31 ASN N N -4.416 -7.247 1.787 1.00 . A A . 31 ASN N 1 1 6 3834 1 1 31 ASN ND2 N -6.885 -9.129 0.549 1.00 . A A . 31 ASN ND2 1 1 6 3835 1 1 31 ASN O O -6.598 -5.427 3.741 1.00 . A A . 31 ASN O 1 1 6 3836 1 1 31 ASN OD1 O -6.663 -10.309 2.435 1.00 . A A . 31 ASN OD1 1 1 6 3837 1 1 32 GLY C C -4.786 -2.802 4.069 1.00 . A A . 32 GLY C 1 1 6 3838 1 1 32 GLY CA C -5.431 -3.152 2.725 1.00 . A A . 32 GLY CA 1 1 6 3839 1 1 32 GLY H H -4.580 -4.617 1.481 1.00 . A A . 32 GLY H 1 1 6 3840 1 1 32 GLY HA2 H -5.055 -2.469 1.968 1.00 . A A . 32 GLY HA2 1 1 6 3841 1 1 32 GLY HA3 H -6.498 -2.999 2.810 1.00 . A A . 32 GLY HA3 1 1 6 3842 1 1 32 GLY N N -5.216 -4.482 2.237 1.00 . A A . 32 GLY N 1 1 6 3843 1 1 32 GLY O O -4.910 -1.660 4.505 1.00 . A A . 32 GLY O 1 1 6 3844 1 1 33 ASN C C -2.141 -2.736 5.837 1.00 . A A . 33 ASN C 1 1 6 3845 1 1 33 ASN CA C -3.529 -3.362 6.031 1.00 . A A . 33 ASN CA 1 1 6 3846 1 1 33 ASN CB C -3.593 -4.553 6.998 1.00 . A A . 33 ASN CB 1 1 6 3847 1 1 33 ASN CG C -2.676 -5.726 6.717 1.00 . A A . 33 ASN CG 1 1 6 3848 1 1 33 ASN H H -4.014 -4.649 4.452 1.00 . A A . 33 ASN H 1 1 6 3849 1 1 33 ASN HA H -4.159 -2.590 6.427 1.00 . A A . 33 ASN HA 1 1 6 3850 1 1 33 ASN HB2 H -3.375 -4.202 7.967 1.00 . A A . 33 ASN HB2 1 1 6 3851 1 1 33 ASN HB3 H -4.605 -4.926 6.986 1.00 . A A . 33 ASN HB3 1 1 6 3852 1 1 33 ASN HD21 H -2.309 -5.079 4.896 1.00 . A A . 33 ASN HD21 1 1 6 3853 1 1 33 ASN HD22 H -1.542 -6.555 5.346 1.00 . A A . 33 ASN HD22 1 1 6 3854 1 1 33 ASN N N -4.107 -3.727 4.765 1.00 . A A . 33 ASN N 1 1 6 3855 1 1 33 ASN ND2 N -2.121 -5.794 5.536 1.00 . A A . 33 ASN ND2 1 1 6 3856 1 1 33 ASN O O -1.164 -3.398 5.511 1.00 . A A . 33 ASN O 1 1 6 3857 1 1 33 ASN OD1 O -2.445 -6.557 7.592 1.00 . A A . 33 ASN OD1 1 1 6 3858 1 1 34 ALA C C 0.376 -1.015 5.972 1.00 . A A . 34 ALA C 1 1 6 3859 1 1 34 ALA CA C -1.010 -0.573 5.543 1.00 . A A . 34 ALA CA 1 1 6 3860 1 1 34 ALA CB C -1.251 0.871 5.954 1.00 . A A . 34 ALA CB 1 1 6 3861 1 1 34 ALA H H -2.851 -0.993 6.490 1.00 . A A . 34 ALA H 1 1 6 3862 1 1 34 ALA HA H -1.038 -0.612 4.474 1.00 . A A . 34 ALA HA 1 1 6 3863 1 1 34 ALA HB1 H -1.167 0.958 7.029 1.00 . A A . 34 ALA HB1 1 1 6 3864 1 1 34 ALA HB2 H -2.241 1.172 5.647 1.00 . A A . 34 ALA HB2 1 1 6 3865 1 1 34 ALA HB3 H -0.517 1.507 5.483 1.00 . A A . 34 ALA HB3 1 1 6 3866 1 1 34 ALA N N -2.101 -1.421 6.023 1.00 . A A . 34 ALA N 1 1 6 3867 1 1 34 ALA O O 1.253 -1.183 5.127 1.00 . A A . 34 ALA O 1 1 6 3868 1 1 35 GLU C C 2.406 -2.762 7.171 1.00 . A A . 35 GLU C 1 1 6 3869 1 1 35 GLU CA C 1.863 -1.514 7.791 1.00 . A A . 35 GLU CA 1 1 6 3870 1 1 35 GLU CB C 1.699 -1.711 9.267 1.00 . A A . 35 GLU CB 1 1 6 3871 1 1 35 GLU CD C 3.981 -1.807 10.292 1.00 . A A . 35 GLU CD 1 1 6 3872 1 1 35 GLU CG C 2.717 -1.004 10.082 1.00 . A A . 35 GLU CG 1 1 6 3873 1 1 35 GLU H H -0.138 -1.085 7.896 1.00 . A A . 35 GLU H 1 1 6 3874 1 1 35 GLU HA H 2.492 -0.717 7.609 1.00 . A A . 35 GLU HA 1 1 6 3875 1 1 35 GLU HB2 H 0.741 -1.342 9.550 1.00 . A A . 35 GLU HB2 1 1 6 3876 1 1 35 GLU HB3 H 1.748 -2.755 9.484 1.00 . A A . 35 GLU HB3 1 1 6 3877 1 1 35 GLU HG2 H 2.959 -0.095 9.576 1.00 . A A . 35 GLU HG2 1 1 6 3878 1 1 35 GLU HG3 H 2.279 -0.777 11.025 1.00 . A A . 35 GLU HG3 1 1 6 3879 1 1 35 GLU N N 0.584 -1.185 7.262 1.00 . A A . 35 GLU N 1 1 6 3880 1 1 35 GLU O O 3.550 -2.846 6.714 1.00 . A A . 35 GLU O 1 1 6 3881 1 1 35 GLU OE1 O 3.918 -2.838 10.993 1.00 . A A . 35 GLU OE1 1 1 6 3882 1 1 35 GLU OE2 O 5.036 -1.414 9.761 1.00 . A A . 35 GLU OE2 1 1 6 3883 1 1 36 PHE C C 2.021 -4.942 5.135 1.00 . A A . 36 PHE C 1 1 6 3884 1 1 36 PHE CA C 1.797 -5.015 6.624 1.00 . A A . 36 PHE CA 1 1 6 3885 1 1 36 PHE CB C 0.611 -5.907 6.951 1.00 . A A . 36 PHE CB 1 1 6 3886 1 1 36 PHE CD1 C 0.876 -5.608 9.389 1.00 . A A . 36 PHE CD1 1 1 6 3887 1 1 36 PHE CD2 C 0.585 -7.820 8.578 1.00 . A A . 36 PHE CD2 1 1 6 3888 1 1 36 PHE CE1 C 0.962 -6.063 10.655 1.00 . A A . 36 PHE CE1 1 1 6 3889 1 1 36 PHE CE2 C 0.670 -8.300 9.873 1.00 . A A . 36 PHE CE2 1 1 6 3890 1 1 36 PHE CG C 0.688 -6.463 8.331 1.00 . A A . 36 PHE CG 1 1 6 3891 1 1 36 PHE CZ C 0.861 -7.414 10.918 1.00 . A A . 36 PHE CZ 1 1 6 3892 1 1 36 PHE H H 0.661 -3.517 7.566 1.00 . A A . 36 PHE H 1 1 6 3893 1 1 36 PHE HA H 2.685 -5.402 7.098 1.00 . A A . 36 PHE HA 1 1 6 3894 1 1 36 PHE HB2 H -0.290 -5.313 6.890 1.00 . A A . 36 PHE HB2 1 1 6 3895 1 1 36 PHE HB3 H 0.541 -6.709 6.246 1.00 . A A . 36 PHE HB3 1 1 6 3896 1 1 36 PHE HD1 H 0.958 -4.553 9.214 1.00 . A A . 36 PHE HD1 1 1 6 3897 1 1 36 PHE HD2 H 0.436 -8.503 7.755 1.00 . A A . 36 PHE HD2 1 1 6 3898 1 1 36 PHE HE1 H 1.112 -5.354 11.434 1.00 . A A . 36 PHE HE1 1 1 6 3899 1 1 36 PHE HE2 H 0.590 -9.359 10.064 1.00 . A A . 36 PHE HE2 1 1 6 3900 1 1 36 PHE HZ H 0.931 -7.778 11.933 1.00 . A A . 36 PHE HZ 1 1 6 3901 1 1 36 PHE N N 1.536 -3.710 7.168 1.00 . A A . 36 PHE N 1 1 6 3902 1 1 36 PHE O O 2.875 -5.631 4.587 1.00 . A A . 36 PHE O 1 1 6 3903 1 1 37 ALA C C 2.623 -3.331 2.628 1.00 . A A . 37 ALA C 1 1 6 3904 1 1 37 ALA CA C 1.316 -3.949 3.065 1.00 . A A . 37 ALA CA 1 1 6 3905 1 1 37 ALA CB C 0.164 -3.112 2.615 1.00 . A A . 37 ALA CB 1 1 6 3906 1 1 37 ALA H H 0.650 -3.491 5.000 1.00 . A A . 37 ALA H 1 1 6 3907 1 1 37 ALA HA H 1.220 -4.930 2.627 1.00 . A A . 37 ALA HA 1 1 6 3908 1 1 37 ALA HB1 H -0.760 -3.573 2.927 1.00 . A A . 37 ALA HB1 1 1 6 3909 1 1 37 ALA HB2 H 0.180 -3.025 1.539 1.00 . A A . 37 ALA HB2 1 1 6 3910 1 1 37 ALA HB3 H 0.243 -2.130 3.056 1.00 . A A . 37 ALA HB3 1 1 6 3911 1 1 37 ALA N N 1.262 -4.081 4.492 1.00 . A A . 37 ALA N 1 1 6 3912 1 1 37 ALA O O 3.240 -3.781 1.680 1.00 . A A . 37 ALA O 1 1 6 3913 1 1 38 ALA C C 5.426 -2.567 3.181 1.00 . A A . 38 ALA C 1 1 6 3914 1 1 38 ALA CA C 4.267 -1.611 3.050 1.00 . A A . 38 ALA CA 1 1 6 3915 1 1 38 ALA CB C 4.454 -0.447 3.997 1.00 . A A . 38 ALA CB 1 1 6 3916 1 1 38 ALA H H 2.455 -1.954 4.038 1.00 . A A . 38 ALA H 1 1 6 3917 1 1 38 ALA HA H 4.231 -1.229 2.041 1.00 . A A . 38 ALA HA 1 1 6 3918 1 1 38 ALA HB1 H 5.398 0.034 3.792 1.00 . A A . 38 ALA HB1 1 1 6 3919 1 1 38 ALA HB2 H 4.444 -0.808 5.014 1.00 . A A . 38 ALA HB2 1 1 6 3920 1 1 38 ALA HB3 H 3.652 0.261 3.857 1.00 . A A . 38 ALA HB3 1 1 6 3921 1 1 38 ALA N N 3.025 -2.290 3.326 1.00 . A A . 38 ALA N 1 1 6 3922 1 1 38 ALA O O 6.272 -2.643 2.308 1.00 . A A . 38 ALA O 1 1 6 3923 1 1 39 SER C C 6.536 -5.360 3.582 1.00 . A A . 39 SER C 1 1 6 3924 1 1 39 SER CA C 6.516 -4.215 4.562 1.00 . A A . 39 SER CA 1 1 6 3925 1 1 39 SER CB C 6.371 -4.718 5.996 1.00 . A A . 39 SER CB 1 1 6 3926 1 1 39 SER H H 4.577 -3.454 4.744 1.00 . A A . 39 SER H 1 1 6 3927 1 1 39 SER HA H 7.422 -3.639 4.465 1.00 . A A . 39 SER HA 1 1 6 3928 1 1 39 SER HB2 H 5.479 -5.323 6.074 1.00 . A A . 39 SER HB2 1 1 6 3929 1 1 39 SER HB3 H 7.235 -5.310 6.259 1.00 . A A . 39 SER HB3 1 1 6 3930 1 1 39 SER HG H 5.332 -3.395 7.015 1.00 . A A . 39 SER HG 1 1 6 3931 1 1 39 SER N N 5.397 -3.367 4.228 1.00 . A A . 39 SER N 1 1 6 3932 1 1 39 SER O O 7.558 -6.004 3.341 1.00 . A A . 39 SER O 1 1 6 3933 1 1 39 SER OG O 6.264 -3.629 6.900 1.00 . A A . 39 SER OG 1 1 6 3934 1 1 40 LEU C C 5.646 -6.014 0.671 1.00 . A A . 40 LEU C 1 1 6 3935 1 1 40 LEU CA C 5.195 -6.571 2.004 1.00 . A A . 40 LEU CA 1 1 6 3936 1 1 40 LEU CB C 3.727 -6.961 1.981 1.00 . A A . 40 LEU CB 1 1 6 3937 1 1 40 LEU CD1 C 4.058 -8.739 0.197 1.00 . A A . 40 LEU CD1 1 1 6 3938 1 1 40 LEU CD2 C 3.800 -9.394 2.594 1.00 . A A . 40 LEU CD2 1 1 6 3939 1 1 40 LEU CG C 3.394 -8.395 1.522 1.00 . A A . 40 LEU CG 1 1 6 3940 1 1 40 LEU H H 4.607 -5.008 3.231 1.00 . A A . 40 LEU H 1 1 6 3941 1 1 40 LEU HA H 5.798 -7.425 2.255 1.00 . A A . 40 LEU HA 1 1 6 3942 1 1 40 LEU HB2 H 3.347 -6.839 2.985 1.00 . A A . 40 LEU HB2 1 1 6 3943 1 1 40 LEU HB3 H 3.217 -6.257 1.351 1.00 . A A . 40 LEU HB3 1 1 6 3944 1 1 40 LEU HD11 H 5.131 -8.668 0.304 1.00 . A A . 40 LEU HD11 1 1 6 3945 1 1 40 LEU HD12 H 3.725 -8.049 -0.564 1.00 . A A . 40 LEU HD12 1 1 6 3946 1 1 40 LEU HD13 H 3.789 -9.745 -0.089 1.00 . A A . 40 LEU HD13 1 1 6 3947 1 1 40 LEU HD21 H 3.277 -9.169 3.513 1.00 . A A . 40 LEU HD21 1 1 6 3948 1 1 40 LEU HD22 H 4.865 -9.330 2.759 1.00 . A A . 40 LEU HD22 1 1 6 3949 1 1 40 LEU HD23 H 3.545 -10.393 2.271 1.00 . A A . 40 LEU HD23 1 1 6 3950 1 1 40 LEU HG H 2.324 -8.478 1.384 1.00 . A A . 40 LEU HG 1 1 6 3951 1 1 40 LEU N N 5.377 -5.572 2.995 1.00 . A A . 40 LEU N 1 1 6 3952 1 1 40 LEU O O 6.348 -6.691 -0.067 1.00 . A A . 40 LEU O 1 1 6 3953 1 1 41 LEU C C 7.145 -4.012 -0.954 1.00 . A A . 41 LEU C 1 1 6 3954 1 1 41 LEU CA C 5.636 -4.158 -0.878 1.00 . A A . 41 LEU CA 1 1 6 3955 1 1 41 LEU CB C 4.848 -2.864 -1.108 1.00 . A A . 41 LEU CB 1 1 6 3956 1 1 41 LEU CD1 C 6.573 -1.126 -0.951 1.00 . A A . 41 LEU CD1 1 1 6 3957 1 1 41 LEU CD2 C 4.211 -0.574 -0.426 1.00 . A A . 41 LEU CD2 1 1 6 3958 1 1 41 LEU CG C 5.294 -1.624 -0.368 1.00 . A A . 41 LEU CG 1 1 6 3959 1 1 41 LEU H H 4.807 -4.189 1.057 1.00 . A A . 41 LEU H 1 1 6 3960 1 1 41 LEU HA H 5.345 -4.847 -1.632 1.00 . A A . 41 LEU HA 1 1 6 3961 1 1 41 LEU HB2 H 4.865 -2.645 -2.164 1.00 . A A . 41 LEU HB2 1 1 6 3962 1 1 41 LEU HB3 H 3.824 -3.063 -0.821 1.00 . A A . 41 LEU HB3 1 1 6 3963 1 1 41 LEU HD11 H 6.933 -0.294 -0.373 1.00 . A A . 41 LEU HD11 1 1 6 3964 1 1 41 LEU HD12 H 6.410 -0.827 -1.973 1.00 . A A . 41 LEU HD12 1 1 6 3965 1 1 41 LEU HD13 H 7.289 -1.935 -0.913 1.00 . A A . 41 LEU HD13 1 1 6 3966 1 1 41 LEU HD21 H 3.327 -0.958 0.060 1.00 . A A . 41 LEU HD21 1 1 6 3967 1 1 41 LEU HD22 H 3.986 -0.346 -1.458 1.00 . A A . 41 LEU HD22 1 1 6 3968 1 1 41 LEU HD23 H 4.548 0.318 0.079 1.00 . A A . 41 LEU HD23 1 1 6 3969 1 1 41 LEU HG H 5.477 -1.864 0.658 1.00 . A A . 41 LEU HG 1 1 6 3970 1 1 41 LEU N N 5.292 -4.754 0.384 1.00 . A A . 41 LEU N 1 1 6 3971 1 1 41 LEU O O 7.734 -3.995 -2.035 1.00 . A A . 41 LEU O 1 1 6 3972 1 1 42 PHE C C 9.890 -4.973 -0.330 1.00 . A A . 42 PHE C 1 1 6 3973 1 1 42 PHE CA C 9.190 -3.819 0.392 1.00 . A A . 42 PHE CA 1 1 6 3974 1 1 42 PHE CB C 9.541 -3.855 1.872 1.00 . A A . 42 PHE CB 1 1 6 3975 1 1 42 PHE CD1 C 8.802 -1.649 2.451 1.00 . A A . 42 PHE CD1 1 1 6 3976 1 1 42 PHE CD2 C 11.093 -2.106 2.784 1.00 . A A . 42 PHE CD2 1 1 6 3977 1 1 42 PHE CE1 C 8.968 -0.383 2.886 1.00 . A A . 42 PHE CE1 1 1 6 3978 1 1 42 PHE CE2 C 11.290 -0.815 3.239 1.00 . A A . 42 PHE CE2 1 1 6 3979 1 1 42 PHE CG C 9.830 -2.512 2.392 1.00 . A A . 42 PHE CG 1 1 6 3980 1 1 42 PHE CZ C 10.216 0.056 3.290 1.00 . A A . 42 PHE CZ 1 1 6 3981 1 1 42 PHE H H 7.196 -3.856 1.031 1.00 . A A . 42 PHE H 1 1 6 3982 1 1 42 PHE HA H 9.509 -2.859 -0.001 1.00 . A A . 42 PHE HA 1 1 6 3983 1 1 42 PHE HB2 H 8.692 -4.223 2.424 1.00 . A A . 42 PHE HB2 1 1 6 3984 1 1 42 PHE HB3 H 10.387 -4.480 2.036 1.00 . A A . 42 PHE HB3 1 1 6 3985 1 1 42 PHE HD1 H 7.823 -1.998 2.147 1.00 . A A . 42 PHE HD1 1 1 6 3986 1 1 42 PHE HD2 H 11.918 -2.800 2.738 1.00 . A A . 42 PHE HD2 1 1 6 3987 1 1 42 PHE HE1 H 8.125 0.258 2.905 1.00 . A A . 42 PHE HE1 1 1 6 3988 1 1 42 PHE HE2 H 12.272 -0.490 3.551 1.00 . A A . 42 PHE HE2 1 1 6 3989 1 1 42 PHE HZ H 10.353 1.069 3.636 1.00 . A A . 42 PHE HZ 1 1 6 3990 1 1 42 PHE N N 7.751 -3.889 0.231 1.00 . A A . 42 PHE N 1 1 6 3991 1 1 42 PHE O O 11.106 -4.953 -0.525 1.00 . A A . 42 PHE O 1 1 6 3992 1 1 43 GLN C C 10.199 -6.761 -2.782 1.00 . A A . 43 GLN C 1 1 6 3993 1 1 43 GLN CA C 9.636 -7.149 -1.416 1.00 . A A . 43 GLN CA 1 1 6 3994 1 1 43 GLN CB C 8.555 -8.238 -1.556 1.00 . A A . 43 GLN CB 1 1 6 3995 1 1 43 GLN CD C 6.914 -7.530 -3.444 1.00 . A A . 43 GLN CD 1 1 6 3996 1 1 43 GLN CG C 8.045 -8.454 -2.984 1.00 . A A . 43 GLN CG 1 1 6 3997 1 1 43 GLN H H 8.144 -5.963 -0.487 1.00 . A A . 43 GLN H 1 1 6 3998 1 1 43 GLN HA H 10.441 -7.538 -0.826 1.00 . A A . 43 GLN HA 1 1 6 3999 1 1 43 GLN HB2 H 8.968 -9.172 -1.206 1.00 . A A . 43 GLN HB2 1 1 6 4000 1 1 43 GLN HB3 H 7.722 -7.975 -0.927 1.00 . A A . 43 GLN HB3 1 1 6 4001 1 1 43 GLN HE21 H 6.003 -7.605 -1.675 1.00 . A A . 43 GLN HE21 1 1 6 4002 1 1 43 GLN HE22 H 5.222 -6.638 -2.880 1.00 . A A . 43 GLN HE22 1 1 6 4003 1 1 43 GLN HG2 H 8.874 -8.301 -3.649 1.00 . A A . 43 GLN HG2 1 1 6 4004 1 1 43 GLN HG3 H 7.708 -9.477 -3.072 1.00 . A A . 43 GLN HG3 1 1 6 4005 1 1 43 GLN N N 9.108 -5.992 -0.707 1.00 . A A . 43 GLN N 1 1 6 4006 1 1 43 GLN NE2 N 5.955 -7.229 -2.578 1.00 . A A . 43 GLN NE2 1 1 6 4007 1 1 43 GLN O O 11.012 -7.482 -3.364 1.00 . A A . 43 GLN O 1 1 6 4008 1 1 43 GLN OE1 O 6.873 -7.141 -4.610 1.00 . A A . 43 GLN OE1 1 1 6 4009 1 1 44 SER C C 11.156 -3.900 -4.322 1.00 . A A . 44 SER C 1 1 6 4010 1 1 44 SER CA C 10.262 -5.115 -4.552 1.00 . A A . 44 SER CA 1 1 6 4011 1 1 44 SER CB C 9.089 -4.770 -5.479 1.00 . A A . 44 SER CB 1 1 6 4012 1 1 44 SER H H 9.116 -5.100 -2.770 1.00 . A A . 44 SER H 1 1 6 4013 1 1 44 SER HA H 10.853 -5.896 -5.009 1.00 . A A . 44 SER HA 1 1 6 4014 1 1 44 SER HB2 H 9.465 -4.277 -6.365 1.00 . A A . 44 SER HB2 1 1 6 4015 1 1 44 SER HB3 H 8.576 -5.678 -5.763 1.00 . A A . 44 SER HB3 1 1 6 4016 1 1 44 SER HG H 8.648 -3.333 -4.225 1.00 . A A . 44 SER HG 1 1 6 4017 1 1 44 SER N N 9.772 -5.621 -3.280 1.00 . A A . 44 SER N 1 1 6 4018 1 1 44 SER O O 10.642 -2.762 -4.317 1.00 . A A . 44 SER O 1 1 6 4019 1 1 44 SER OXT O 12.375 -4.092 -4.114 1.00 . A A . 44 SER OXT 1 1 6 4020 1 1 44 SER OG O 8.165 -3.906 -4.839 1.00 . A A . 44 SER OG 1 1 7 4021 1 1 1 GLY C C -14.266 1.904 -0.935 1.00 . A A . 1 GLY C 1 1 7 4022 1 1 1 GLY CA C -15.298 3.008 -0.875 1.00 . A A . 1 GLY CA 1 1 7 4023 1 1 1 GLY H1 H -15.984 4.459 0.464 1.00 . A A . 1 GLY H1 1 1 7 4024 1 1 1 GLY H2 H -14.333 4.093 0.617 1.00 . A A . 1 GLY H2 1 1 7 4025 1 1 1 GLY H3 H -15.494 3.009 1.198 1.00 . A A . 1 GLY H3 1 1 7 4026 1 1 1 GLY HA2 H -16.278 2.582 -1.038 1.00 . A A . 1 GLY HA2 1 1 7 4027 1 1 1 GLY HA3 H -15.093 3.730 -1.654 1.00 . A A . 1 GLY HA3 1 1 7 4028 1 1 1 GLY N N -15.279 3.691 0.440 1.00 . A A . 1 GLY N 1 1 7 4029 1 1 1 GLY O O -14.537 0.771 -0.541 1.00 . A A . 1 GLY O 1 1 7 4030 1 1 2 SER C C -11.177 1.350 -0.158 1.00 . A A . 2 SER C 1 1 7 4031 1 1 2 SER CA C -11.984 1.277 -1.452 1.00 . A A . 2 SER CA 1 1 7 4032 1 1 2 SER CB C -11.095 1.557 -2.667 1.00 . A A . 2 SER CB 1 1 7 4033 1 1 2 SER H H -12.921 3.155 -1.727 1.00 . A A . 2 SER H 1 1 7 4034 1 1 2 SER HA H -12.409 0.289 -1.543 1.00 . A A . 2 SER HA 1 1 7 4035 1 1 2 SER HB2 H -10.211 0.939 -2.614 1.00 . A A . 2 SER HB2 1 1 7 4036 1 1 2 SER HB3 H -11.640 1.329 -3.572 1.00 . A A . 2 SER HB3 1 1 7 4037 1 1 2 SER HG H -10.283 3.144 -1.857 1.00 . A A . 2 SER HG 1 1 7 4038 1 1 2 SER N N -13.075 2.234 -1.406 1.00 . A A . 2 SER N 1 1 7 4039 1 1 2 SER O O -10.226 2.122 -0.051 1.00 . A A . 2 SER O 1 1 7 4040 1 1 2 SER OG O -10.699 2.917 -2.700 1.00 . A A . 2 SER OG 1 1 7 4041 1 1 3 ALA C C -9.610 -0.129 2.185 1.00 . A A . 3 ALA C 1 1 7 4042 1 1 3 ALA CA C -10.956 0.591 2.150 1.00 . A A . 3 ALA CA 1 1 7 4043 1 1 3 ALA CB C -11.901 -0.009 3.180 1.00 . A A . 3 ALA CB 1 1 7 4044 1 1 3 ALA H H -12.283 -0.105 0.654 1.00 . A A . 3 ALA H 1 1 7 4045 1 1 3 ALA HA H -10.801 1.629 2.405 1.00 . A A . 3 ALA HA 1 1 7 4046 1 1 3 ALA HB1 H -12.846 0.512 3.148 1.00 . A A . 3 ALA HB1 1 1 7 4047 1 1 3 ALA HB2 H -11.471 0.087 4.166 1.00 . A A . 3 ALA HB2 1 1 7 4048 1 1 3 ALA HB3 H -12.058 -1.054 2.957 1.00 . A A . 3 ALA HB3 1 1 7 4049 1 1 3 ALA N N -11.565 0.544 0.825 1.00 . A A . 3 ALA N 1 1 7 4050 1 1 3 ALA O O -8.940 -0.168 3.218 1.00 . A A . 3 ALA O 1 1 7 4051 1 1 4 THR C C -6.814 -0.497 0.577 1.00 . A A . 4 THR C 1 1 7 4052 1 1 4 THR CA C -7.950 -1.409 0.973 1.00 . A A . 4 THR CA 1 1 7 4053 1 1 4 THR CB C -8.063 -2.593 0.000 1.00 . A A . 4 THR CB 1 1 7 4054 1 1 4 THR CG2 C -8.772 -3.768 0.653 1.00 . A A . 4 THR CG2 1 1 7 4055 1 1 4 THR H H -9.794 -0.652 0.271 1.00 . A A . 4 THR H 1 1 7 4056 1 1 4 THR HA H -7.732 -1.775 1.911 1.00 . A A . 4 THR HA 1 1 7 4057 1 1 4 THR HB H -7.069 -2.904 -0.291 1.00 . A A . 4 THR HB 1 1 7 4058 1 1 4 THR HG1 H -9.735 -2.338 -1.029 1.00 . A A . 4 THR HG1 1 1 7 4059 1 1 4 THR HG21 H -8.801 -4.599 -0.036 1.00 . A A . 4 THR HG21 1 1 7 4060 1 1 4 THR HG22 H -9.780 -3.481 0.915 1.00 . A A . 4 THR HG22 1 1 7 4061 1 1 4 THR HG23 H -8.236 -4.059 1.545 1.00 . A A . 4 THR HG23 1 1 7 4062 1 1 4 THR N N -9.215 -0.699 1.060 1.00 . A A . 4 THR N 1 1 7 4063 1 1 4 THR O O -5.743 -0.475 1.173 1.00 . A A . 4 THR O 1 1 7 4064 1 1 4 THR OG1 O -8.787 -2.186 -1.164 1.00 . A A . 4 THR OG1 1 1 7 4065 1 1 5 PHE C C -6.676 2.669 -1.038 1.00 . A A . 5 PHE C 1 1 7 4066 1 1 5 PHE CA C -6.203 1.189 -1.062 1.00 . A A . 5 PHE CA 1 1 7 4067 1 1 5 PHE CB C -6.271 0.803 -2.489 1.00 . A A . 5 PHE CB 1 1 7 4068 1 1 5 PHE CD1 C -5.395 -1.384 -1.990 1.00 . A A . 5 PHE CD1 1 1 7 4069 1 1 5 PHE CD2 C -7.130 -1.298 -3.570 1.00 . A A . 5 PHE CD2 1 1 7 4070 1 1 5 PHE CE1 C -5.362 -2.685 -2.074 1.00 . A A . 5 PHE CE1 1 1 7 4071 1 1 5 PHE CE2 C -7.084 -2.679 -3.669 1.00 . A A . 5 PHE CE2 1 1 7 4072 1 1 5 PHE CG C -6.260 -0.652 -2.704 1.00 . A A . 5 PHE CG 1 1 7 4073 1 1 5 PHE CZ C -6.174 -3.362 -2.885 1.00 . A A . 5 PHE CZ 1 1 7 4074 1 1 5 PHE H H -7.999 0.212 -0.708 1.00 . A A . 5 PHE H 1 1 7 4075 1 1 5 PHE HA H -5.205 1.057 -0.687 1.00 . A A . 5 PHE HA 1 1 7 4076 1 1 5 PHE HB2 H -7.206 1.162 -2.797 1.00 . A A . 5 PHE HB2 1 1 7 4077 1 1 5 PHE HB3 H -5.467 1.246 -3.044 1.00 . A A . 5 PHE HB3 1 1 7 4078 1 1 5 PHE HD1 H -4.732 -0.914 -1.307 1.00 . A A . 5 PHE HD1 1 1 7 4079 1 1 5 PHE HD2 H -7.826 -0.727 -4.166 1.00 . A A . 5 PHE HD2 1 1 7 4080 1 1 5 PHE HE1 H -4.663 -3.182 -1.493 1.00 . A A . 5 PHE HE1 1 1 7 4081 1 1 5 PHE HE2 H -7.752 -3.210 -4.332 1.00 . A A . 5 PHE HE2 1 1 7 4082 1 1 5 PHE HZ H -6.104 -4.418 -2.878 1.00 . A A . 5 PHE HZ 1 1 7 4083 1 1 5 PHE N N -7.121 0.276 -0.400 1.00 . A A . 5 PHE N 1 1 7 4084 1 1 5 PHE O O -6.690 3.330 -2.072 1.00 . A A . 5 PHE O 1 1 7 4085 1 1 6 PRO C C -6.226 5.455 0.424 1.00 . A A . 6 PRO C 1 1 7 4086 1 1 6 PRO CA C -7.449 4.572 0.308 1.00 . A A . 6 PRO CA 1 1 7 4087 1 1 6 PRO CB C -8.222 4.548 1.611 1.00 . A A . 6 PRO CB 1 1 7 4088 1 1 6 PRO CD C -7.442 2.388 1.233 1.00 . A A . 6 PRO CD 1 1 7 4089 1 1 6 PRO CG C -7.730 3.382 2.303 1.00 . A A . 6 PRO CG 1 1 7 4090 1 1 6 PRO HA H -8.089 4.931 -0.458 1.00 . A A . 6 PRO HA 1 1 7 4091 1 1 6 PRO HB2 H -8.053 5.452 2.172 1.00 . A A . 6 PRO HB2 1 1 7 4092 1 1 6 PRO HB3 H -9.250 4.426 1.406 1.00 . A A . 6 PRO HB3 1 1 7 4093 1 1 6 PRO HD2 H -6.626 1.775 1.476 1.00 . A A . 6 PRO HD2 1 1 7 4094 1 1 6 PRO HD3 H -8.300 1.776 0.989 1.00 . A A . 6 PRO HD3 1 1 7 4095 1 1 6 PRO HG2 H -6.849 3.633 2.843 1.00 . A A . 6 PRO HG2 1 1 7 4096 1 1 6 PRO HG3 H -8.496 3.023 2.945 1.00 . A A . 6 PRO HG3 1 1 7 4097 1 1 6 PRO N N -7.113 3.174 0.102 1.00 . A A . 6 PRO N 1 1 7 4098 1 1 6 PRO O O -5.158 5.016 0.850 1.00 . A A . 6 PRO O 1 1 7 4099 1 1 7 GLU C C -4.589 7.815 1.295 1.00 . A A . 7 GLU C 1 1 7 4100 1 1 7 GLU CA C -5.332 7.681 -0.024 1.00 . A A . 7 GLU CA 1 1 7 4101 1 1 7 GLU CB C -5.888 9.032 -0.457 1.00 . A A . 7 GLU CB 1 1 7 4102 1 1 7 GLU CD C -7.032 10.363 -2.265 1.00 . A A . 7 GLU CD 1 1 7 4103 1 1 7 GLU CG C -6.365 9.056 -1.898 1.00 . A A . 7 GLU CG 1 1 7 4104 1 1 7 GLU H H -7.320 7.016 -0.137 1.00 . A A . 7 GLU H 1 1 7 4105 1 1 7 GLU HA H -4.636 7.332 -0.773 1.00 . A A . 7 GLU HA 1 1 7 4106 1 1 7 GLU HB2 H -6.721 9.286 0.180 1.00 . A A . 7 GLU HB2 1 1 7 4107 1 1 7 GLU HB3 H -5.121 9.773 -0.342 1.00 . A A . 7 GLU HB3 1 1 7 4108 1 1 7 GLU HG2 H -5.516 8.909 -2.549 1.00 . A A . 7 GLU HG2 1 1 7 4109 1 1 7 GLU HG3 H -7.073 8.254 -2.043 1.00 . A A . 7 GLU HG3 1 1 7 4110 1 1 7 GLU N N -6.410 6.716 0.061 1.00 . A A . 7 GLU N 1 1 7 4111 1 1 7 GLU O O -3.412 8.152 1.303 1.00 . A A . 7 GLU O 1 1 7 4112 1 1 7 GLU OE1 O -6.376 11.420 -2.176 1.00 . A A . 7 GLU OE1 1 1 7 4113 1 1 7 GLU OE2 O -8.219 10.341 -2.647 1.00 . A A . 7 GLU OE2 1 1 7 4114 1 1 8 GLN C C -3.431 6.614 3.708 1.00 . A A . 8 GLN C 1 1 7 4115 1 1 8 GLN CA C -4.649 7.538 3.705 1.00 . A A . 8 GLN CA 1 1 7 4116 1 1 8 GLN CB C -5.666 7.056 4.732 1.00 . A A . 8 GLN CB 1 1 7 4117 1 1 8 GLN CD C -5.544 8.908 6.369 1.00 . A A . 8 GLN CD 1 1 7 4118 1 1 8 GLN CG C -5.349 7.430 6.132 1.00 . A A . 8 GLN CG 1 1 7 4119 1 1 8 GLN H H -6.251 7.443 2.348 1.00 . A A . 8 GLN H 1 1 7 4120 1 1 8 GLN HA H -4.339 8.541 3.956 1.00 . A A . 8 GLN HA 1 1 7 4121 1 1 8 GLN HB2 H -6.600 7.501 4.517 1.00 . A A . 8 GLN HB2 1 1 7 4122 1 1 8 GLN HB3 H -5.752 5.982 4.671 1.00 . A A . 8 GLN HB3 1 1 7 4123 1 1 8 GLN HE21 H -6.351 8.512 8.112 1.00 . A A . 8 GLN HE21 1 1 7 4124 1 1 8 GLN HE22 H -6.252 10.179 7.689 1.00 . A A . 8 GLN HE22 1 1 7 4125 1 1 8 GLN HG2 H -5.985 6.874 6.804 1.00 . A A . 8 GLN HG2 1 1 7 4126 1 1 8 GLN HG3 H -4.337 7.184 6.306 1.00 . A A . 8 GLN HG3 1 1 7 4127 1 1 8 GLN N N -5.280 7.568 2.400 1.00 . A A . 8 GLN N 1 1 7 4128 1 1 8 GLN NE2 N -6.102 9.234 7.504 1.00 . A A . 8 GLN NE2 1 1 7 4129 1 1 8 GLN O O -2.312 7.047 3.988 1.00 . A A . 8 GLN O 1 1 7 4130 1 1 8 GLN OE1 O -5.265 9.742 5.508 1.00 . A A . 8 GLN OE1 1 1 7 4131 1 1 9 THR C C -1.730 4.501 2.166 1.00 . A A . 9 THR C 1 1 7 4132 1 1 9 THR CA C -2.625 4.353 3.365 1.00 . A A . 9 THR CA 1 1 7 4133 1 1 9 THR CB C -3.242 2.956 3.389 1.00 . A A . 9 THR CB 1 1 7 4134 1 1 9 THR CG2 C -3.796 2.644 4.763 1.00 . A A . 9 THR CG2 1 1 7 4135 1 1 9 THR H H -4.539 5.068 3.111 1.00 . A A . 9 THR H 1 1 7 4136 1 1 9 THR HA H -2.049 4.484 4.236 1.00 . A A . 9 THR HA 1 1 7 4137 1 1 9 THR HB H -2.478 2.253 3.153 1.00 . A A . 9 THR HB 1 1 7 4138 1 1 9 THR HG1 H -4.415 1.938 2.167 1.00 . A A . 9 THR HG1 1 1 7 4139 1 1 9 THR HG21 H -3.002 2.701 5.492 1.00 . A A . 9 THR HG21 1 1 7 4140 1 1 9 THR HG22 H -4.220 1.651 4.763 1.00 . A A . 9 THR HG22 1 1 7 4141 1 1 9 THR HG23 H -4.562 3.362 5.007 1.00 . A A . 9 THR HG23 1 1 7 4142 1 1 9 THR N N -3.656 5.347 3.371 1.00 . A A . 9 THR N 1 1 7 4143 1 1 9 THR O O -0.522 4.303 2.246 1.00 . A A . 9 THR O 1 1 7 4144 1 1 9 THR OG1 O -4.289 2.860 2.414 1.00 . A A . 9 THR OG1 1 1 7 4145 1 1 10 ILE C C -0.546 6.154 0.111 1.00 . A A . 10 ILE C 1 1 7 4146 1 1 10 ILE CA C -1.638 5.160 -0.148 1.00 . A A . 10 ILE CA 1 1 7 4147 1 1 10 ILE CB C -2.583 5.749 -1.201 1.00 . A A . 10 ILE CB 1 1 7 4148 1 1 10 ILE CD1 C -4.513 5.231 -2.711 1.00 . A A . 10 ILE CD1 1 1 7 4149 1 1 10 ILE CG1 C -3.566 4.700 -1.678 1.00 . A A . 10 ILE CG1 1 1 7 4150 1 1 10 ILE CG2 C -1.800 6.297 -2.370 1.00 . A A . 10 ILE CG2 1 1 7 4151 1 1 10 ILE H H -3.309 4.908 1.083 1.00 . A A . 10 ILE H 1 1 7 4152 1 1 10 ILE HA H -1.225 4.256 -0.538 1.00 . A A . 10 ILE HA 1 1 7 4153 1 1 10 ILE HB H -3.128 6.564 -0.749 1.00 . A A . 10 ILE HB 1 1 7 4154 1 1 10 ILE HD11 H -3.948 5.601 -3.548 1.00 . A A . 10 ILE HD11 1 1 7 4155 1 1 10 ILE HD12 H -5.087 6.033 -2.278 1.00 . A A . 10 ILE HD12 1 1 7 4156 1 1 10 ILE HD13 H -5.171 4.440 -3.031 1.00 . A A . 10 ILE HD13 1 1 7 4157 1 1 10 ILE HG12 H -3.025 3.872 -2.112 1.00 . A A . 10 ILE HG12 1 1 7 4158 1 1 10 ILE HG13 H -4.146 4.348 -0.841 1.00 . A A . 10 ILE HG13 1 1 7 4159 1 1 10 ILE HG21 H -2.486 6.697 -3.099 1.00 . A A . 10 ILE HG21 1 1 7 4160 1 1 10 ILE HG22 H -1.222 5.503 -2.810 1.00 . A A . 10 ILE HG22 1 1 7 4161 1 1 10 ILE HG23 H -1.143 7.076 -2.021 1.00 . A A . 10 ILE HG23 1 1 7 4162 1 1 10 ILE N N -2.343 4.876 1.074 1.00 . A A . 10 ILE N 1 1 7 4163 1 1 10 ILE O O 0.620 5.863 -0.054 1.00 . A A . 10 ILE O 1 1 7 4164 1 1 11 LYS C C 1.031 8.010 1.872 1.00 . A A . 11 LYS C 1 1 7 4165 1 1 11 LYS CA C 0.040 8.341 0.791 1.00 . A A . 11 LYS CA 1 1 7 4166 1 1 11 LYS CB C -0.654 9.670 1.020 1.00 . A A . 11 LYS CB 1 1 7 4167 1 1 11 LYS CD C -2.480 11.186 0.226 1.00 . A A . 11 LYS CD 1 1 7 4168 1 1 11 LYS CE C -3.309 11.649 -0.962 1.00 . A A . 11 LYS CE 1 1 7 4169 1 1 11 LYS CG C -1.523 10.071 -0.153 1.00 . A A . 11 LYS CG 1 1 7 4170 1 1 11 LYS H H -1.849 7.427 0.873 1.00 . A A . 11 LYS H 1 1 7 4171 1 1 11 LYS HA H 0.595 8.392 -0.124 1.00 . A A . 11 LYS HA 1 1 7 4172 1 1 11 LYS HB2 H -1.274 9.591 1.892 1.00 . A A . 11 LYS HB2 1 1 7 4173 1 1 11 LYS HB3 H 0.089 10.438 1.176 1.00 . A A . 11 LYS HB3 1 1 7 4174 1 1 11 LYS HD2 H -3.146 10.826 0.997 1.00 . A A . 11 LYS HD2 1 1 7 4175 1 1 11 LYS HD3 H -1.909 12.019 0.606 1.00 . A A . 11 LYS HD3 1 1 7 4176 1 1 11 LYS HE2 H -3.801 10.793 -1.396 1.00 . A A . 11 LYS HE2 1 1 7 4177 1 1 11 LYS HE3 H -4.053 12.350 -0.613 1.00 . A A . 11 LYS HE3 1 1 7 4178 1 1 11 LYS HG2 H -0.890 10.410 -0.961 1.00 . A A . 11 LYS HG2 1 1 7 4179 1 1 11 LYS HG3 H -2.091 9.201 -0.473 1.00 . A A . 11 LYS HG3 1 1 7 4180 1 1 11 LYS HZ1 H -3.084 12.612 -2.804 1.00 . A A . 11 LYS HZ1 1 1 7 4181 1 1 11 LYS HZ2 H -1.757 11.648 -2.370 1.00 . A A . 11 LYS HZ2 1 1 7 4182 1 1 11 LYS HZ3 H -2.002 13.146 -1.612 1.00 . A A . 11 LYS HZ3 1 1 7 4183 1 1 11 LYS N N -0.913 7.289 0.612 1.00 . A A . 11 LYS N 1 1 7 4184 1 1 11 LYS NZ N -2.481 12.308 -2.009 1.00 . A A . 11 LYS NZ 1 1 7 4185 1 1 11 LYS O O 2.138 8.487 1.816 1.00 . A A . 11 LYS O 1 1 7 4186 1 1 12 GLN C C 2.651 5.875 3.222 1.00 . A A . 12 GLN C 1 1 7 4187 1 1 12 GLN CA C 1.544 6.736 3.846 1.00 . A A . 12 GLN CA 1 1 7 4188 1 1 12 GLN CB C 0.724 5.932 4.841 1.00 . A A . 12 GLN CB 1 1 7 4189 1 1 12 GLN CD C 1.508 7.436 6.680 1.00 . A A . 12 GLN CD 1 1 7 4190 1 1 12 GLN CG C 0.328 6.723 6.068 1.00 . A A . 12 GLN CG 1 1 7 4191 1 1 12 GLN H H -0.294 6.930 2.924 1.00 . A A . 12 GLN H 1 1 7 4192 1 1 12 GLN HA H 1.983 7.583 4.343 1.00 . A A . 12 GLN HA 1 1 7 4193 1 1 12 GLN HB2 H -0.189 5.602 4.352 1.00 . A A . 12 GLN HB2 1 1 7 4194 1 1 12 GLN HB3 H 1.280 5.085 5.135 1.00 . A A . 12 GLN HB3 1 1 7 4195 1 1 12 GLN HE21 H 1.187 8.989 5.490 1.00 . A A . 12 GLN HE21 1 1 7 4196 1 1 12 GLN HE22 H 2.549 9.117 6.538 1.00 . A A . 12 GLN HE22 1 1 7 4197 1 1 12 GLN HG2 H -0.414 7.456 5.787 1.00 . A A . 12 GLN HG2 1 1 7 4198 1 1 12 GLN HG3 H -0.089 6.047 6.794 1.00 . A A . 12 GLN HG3 1 1 7 4199 1 1 12 GLN N N 0.635 7.215 2.854 1.00 . A A . 12 GLN N 1 1 7 4200 1 1 12 GLN NE2 N 1.770 8.638 6.196 1.00 . A A . 12 GLN NE2 1 1 7 4201 1 1 12 GLN O O 3.848 6.033 3.494 1.00 . A A . 12 GLN O 1 1 7 4202 1 1 12 GLN OE1 O 2.185 6.910 7.561 1.00 . A A . 12 GLN OE1 1 1 7 4203 1 1 13 LEU C C 3.906 4.582 0.639 1.00 . A A . 13 LEU C 1 1 7 4204 1 1 13 LEU CA C 3.134 4.017 1.797 1.00 . A A . 13 LEU CA 1 1 7 4205 1 1 13 LEU CB C 2.330 2.808 1.393 1.00 . A A . 13 LEU CB 1 1 7 4206 1 1 13 LEU CD1 C 0.751 1.007 2.105 1.00 . A A . 13 LEU CD1 1 1 7 4207 1 1 13 LEU CD2 C 2.410 1.929 3.724 1.00 . A A . 13 LEU CD2 1 1 7 4208 1 1 13 LEU CG C 1.519 2.240 2.536 1.00 . A A . 13 LEU CG 1 1 7 4209 1 1 13 LEU H H 1.343 5.065 1.987 1.00 . A A . 13 LEU H 1 1 7 4210 1 1 13 LEU HA H 3.814 3.734 2.580 1.00 . A A . 13 LEU HA 1 1 7 4211 1 1 13 LEU HB2 H 1.660 3.087 0.591 1.00 . A A . 13 LEU HB2 1 1 7 4212 1 1 13 LEU HB3 H 2.996 2.059 1.042 1.00 . A A . 13 LEU HB3 1 1 7 4213 1 1 13 LEU HD11 H 0.170 0.636 2.937 1.00 . A A . 13 LEU HD11 1 1 7 4214 1 1 13 LEU HD12 H 1.446 0.245 1.784 1.00 . A A . 13 LEU HD12 1 1 7 4215 1 1 13 LEU HD13 H 0.092 1.259 1.288 1.00 . A A . 13 LEU HD13 1 1 7 4216 1 1 13 LEU HD21 H 3.177 1.227 3.426 1.00 . A A . 13 LEU HD21 1 1 7 4217 1 1 13 LEU HD22 H 1.816 1.496 4.515 1.00 . A A . 13 LEU HD22 1 1 7 4218 1 1 13 LEU HD23 H 2.872 2.839 4.077 1.00 . A A . 13 LEU HD23 1 1 7 4219 1 1 13 LEU HG H 0.817 2.998 2.839 1.00 . A A . 13 LEU HG 1 1 7 4220 1 1 13 LEU N N 2.250 5.012 2.327 1.00 . A A . 13 LEU N 1 1 7 4221 1 1 13 LEU O O 5.102 4.345 0.492 1.00 . A A . 13 LEU O 1 1 7 4222 1 1 14 MET C C 4.780 7.127 -0.595 1.00 . A A . 14 MET C 1 1 7 4223 1 1 14 MET CA C 3.840 6.102 -1.210 1.00 . A A . 14 MET CA 1 1 7 4224 1 1 14 MET CB C 2.739 6.745 -1.998 1.00 . A A . 14 MET CB 1 1 7 4225 1 1 14 MET CE C 2.704 3.193 -2.073 1.00 . A A . 14 MET CE 1 1 7 4226 1 1 14 MET CG C 2.029 5.792 -2.935 1.00 . A A . 14 MET CG 1 1 7 4227 1 1 14 MET H H 2.206 5.358 -0.148 1.00 . A A . 14 MET H 1 1 7 4228 1 1 14 MET HA H 4.391 5.436 -1.852 1.00 . A A . 14 MET HA 1 1 7 4229 1 1 14 MET HB2 H 2.007 7.131 -1.312 1.00 . A A . 14 MET HB2 1 1 7 4230 1 1 14 MET HB3 H 3.149 7.554 -2.577 1.00 . A A . 14 MET HB3 1 1 7 4231 1 1 14 MET HE1 H 3.460 3.652 -1.452 1.00 . A A . 14 MET HE1 1 1 7 4232 1 1 14 MET HE2 H 3.106 3.012 -3.057 1.00 . A A . 14 MET HE2 1 1 7 4233 1 1 14 MET HE3 H 2.389 2.259 -1.632 1.00 . A A . 14 MET HE3 1 1 7 4234 1 1 14 MET HG2 H 1.239 6.330 -3.372 1.00 . A A . 14 MET HG2 1 1 7 4235 1 1 14 MET HG3 H 2.728 5.501 -3.684 1.00 . A A . 14 MET HG3 1 1 7 4236 1 1 14 MET N N 3.213 5.338 -0.188 1.00 . A A . 14 MET N 1 1 7 4237 1 1 14 MET O O 5.741 7.573 -1.217 1.00 . A A . 14 MET O 1 1 7 4238 1 1 14 MET SD S 1.303 4.296 -2.200 1.00 . A A . 14 MET SD 1 1 7 4239 1 1 15 ASP C C 6.698 7.753 1.708 1.00 . A A . 15 ASP C 1 1 7 4240 1 1 15 ASP CA C 5.324 8.353 1.453 1.00 . A A . 15 ASP CA 1 1 7 4241 1 1 15 ASP CB C 4.641 8.660 2.778 1.00 . A A . 15 ASP CB 1 1 7 4242 1 1 15 ASP CG C 5.496 9.477 3.723 1.00 . A A . 15 ASP CG 1 1 7 4243 1 1 15 ASP H H 3.657 7.120 1.041 1.00 . A A . 15 ASP H 1 1 7 4244 1 1 15 ASP HA H 5.446 9.275 0.905 1.00 . A A . 15 ASP HA 1 1 7 4245 1 1 15 ASP HB2 H 3.735 9.212 2.572 1.00 . A A . 15 ASP HB2 1 1 7 4246 1 1 15 ASP HB3 H 4.372 7.721 3.259 1.00 . A A . 15 ASP HB3 1 1 7 4247 1 1 15 ASP N N 4.485 7.468 0.649 1.00 . A A . 15 ASP N 1 1 7 4248 1 1 15 ASP O O 7.681 8.489 1.818 1.00 . A A . 15 ASP O 1 1 7 4249 1 1 15 ASP OD1 O 5.797 10.641 3.398 1.00 . A A . 15 ASP OD1 1 1 7 4250 1 1 15 ASP OD2 O 5.848 8.970 4.807 1.00 . A A . 15 ASP OD2 1 1 7 4251 1 1 16 LEU C C 8.909 6.084 0.628 1.00 . A A . 16 LEU C 1 1 7 4252 1 1 16 LEU CA C 8.072 5.781 1.868 1.00 . A A . 16 LEU CA 1 1 7 4253 1 1 16 LEU CB C 7.804 4.327 1.966 1.00 . A A . 16 LEU CB 1 1 7 4254 1 1 16 LEU CD1 C 8.385 4.436 4.383 1.00 . A A . 16 LEU CD1 1 1 7 4255 1 1 16 LEU CD2 C 6.028 4.076 3.660 1.00 . A A . 16 LEU CD2 1 1 7 4256 1 1 16 LEU CG C 7.471 3.832 3.335 1.00 . A A . 16 LEU CG 1 1 7 4257 1 1 16 LEU H H 5.991 5.827 1.865 1.00 . A A . 16 LEU H 1 1 7 4258 1 1 16 LEU HA H 8.585 6.097 2.758 1.00 . A A . 16 LEU HA 1 1 7 4259 1 1 16 LEU HB2 H 6.973 4.095 1.321 1.00 . A A . 16 LEU HB2 1 1 7 4260 1 1 16 LEU HB3 H 8.642 3.812 1.620 1.00 . A A . 16 LEU HB3 1 1 7 4261 1 1 16 LEU HD11 H 9.406 4.160 4.173 1.00 . A A . 16 LEU HD11 1 1 7 4262 1 1 16 LEU HD12 H 8.103 4.072 5.360 1.00 . A A . 16 LEU HD12 1 1 7 4263 1 1 16 LEU HD13 H 8.289 5.514 4.357 1.00 . A A . 16 LEU HD13 1 1 7 4264 1 1 16 LEU HD21 H 5.420 3.625 2.893 1.00 . A A . 16 LEU HD21 1 1 7 4265 1 1 16 LEU HD22 H 5.844 5.138 3.683 1.00 . A A . 16 LEU HD22 1 1 7 4266 1 1 16 LEU HD23 H 5.794 3.640 4.618 1.00 . A A . 16 LEU HD23 1 1 7 4267 1 1 16 LEU HG H 7.622 2.801 3.317 1.00 . A A . 16 LEU HG 1 1 7 4268 1 1 16 LEU N N 6.796 6.420 1.808 1.00 . A A . 16 LEU N 1 1 7 4269 1 1 16 LEU O O 10.135 5.945 0.627 1.00 . A A . 16 LEU O 1 1 7 4270 1 1 17 GLY C C 8.281 5.943 -2.791 1.00 . A A . 17 GLY C 1 1 7 4271 1 1 17 GLY CA C 8.847 6.807 -1.690 1.00 . A A . 17 GLY CA 1 1 7 4272 1 1 17 GLY H H 7.246 6.577 -0.329 1.00 . A A . 17 GLY H 1 1 7 4273 1 1 17 GLY HA2 H 8.673 7.847 -1.925 1.00 . A A . 17 GLY HA2 1 1 7 4274 1 1 17 GLY HA3 H 9.909 6.631 -1.613 1.00 . A A . 17 GLY HA3 1 1 7 4275 1 1 17 GLY N N 8.218 6.491 -0.421 1.00 . A A . 17 GLY N 1 1 7 4276 1 1 17 GLY O O 8.704 6.011 -3.945 1.00 . A A . 17 GLY O 1 1 7 4277 1 1 18 PHE C C 5.668 4.693 -4.211 1.00 . A A . 18 PHE C 1 1 7 4278 1 1 18 PHE CA C 6.734 4.133 -3.285 1.00 . A A . 18 PHE CA 1 1 7 4279 1 1 18 PHE CB C 6.166 3.053 -2.405 1.00 . A A . 18 PHE CB 1 1 7 4280 1 1 18 PHE CD1 C 8.414 1.986 -2.263 1.00 . A A . 18 PHE CD1 1 1 7 4281 1 1 18 PHE CD2 C 7.055 2.203 -0.359 1.00 . A A . 18 PHE CD2 1 1 7 4282 1 1 18 PHE CE1 C 9.391 1.390 -1.500 1.00 . A A . 18 PHE CE1 1 1 7 4283 1 1 18 PHE CE2 C 7.989 1.631 0.398 1.00 . A A . 18 PHE CE2 1 1 7 4284 1 1 18 PHE CG C 7.233 2.389 -1.664 1.00 . A A . 18 PHE CG 1 1 7 4285 1 1 18 PHE CZ C 9.164 1.216 -0.153 1.00 . A A . 18 PHE CZ 1 1 7 4286 1 1 18 PHE H H 6.977 5.191 -1.491 1.00 . A A . 18 PHE H 1 1 7 4287 1 1 18 PHE HA H 7.532 3.706 -3.867 1.00 . A A . 18 PHE HA 1 1 7 4288 1 1 18 PHE HB2 H 5.496 3.499 -1.688 1.00 . A A . 18 PHE HB2 1 1 7 4289 1 1 18 PHE HB3 H 5.640 2.309 -2.960 1.00 . A A . 18 PHE HB3 1 1 7 4290 1 1 18 PHE HD1 H 8.561 2.136 -3.322 1.00 . A A . 18 PHE HD1 1 1 7 4291 1 1 18 PHE HD2 H 6.149 2.511 0.075 1.00 . A A . 18 PHE HD2 1 1 7 4292 1 1 18 PHE HE1 H 10.318 1.066 -1.948 1.00 . A A . 18 PHE HE1 1 1 7 4293 1 1 18 PHE HE2 H 7.796 1.505 1.423 1.00 . A A . 18 PHE HE2 1 1 7 4294 1 1 18 PHE HZ H 9.891 0.766 0.465 1.00 . A A . 18 PHE HZ 1 1 7 4295 1 1 18 PHE N N 7.310 5.132 -2.413 1.00 . A A . 18 PHE N 1 1 7 4296 1 1 18 PHE O O 5.114 5.765 -3.982 1.00 . A A . 18 PHE O 1 1 7 4297 1 1 19 PRO C C 2.977 3.917 -5.790 1.00 . A A . 19 PRO C 1 1 7 4298 1 1 19 PRO CA C 4.368 4.281 -6.267 1.00 . A A . 19 PRO CA 1 1 7 4299 1 1 19 PRO CB C 4.748 3.389 -7.420 1.00 . A A . 19 PRO CB 1 1 7 4300 1 1 19 PRO CD C 6.030 2.666 -5.608 1.00 . A A . 19 PRO CD 1 1 7 4301 1 1 19 PRO CG C 5.171 2.169 -6.742 1.00 . A A . 19 PRO CG 1 1 7 4302 1 1 19 PRO HA H 4.404 5.317 -6.568 1.00 . A A . 19 PRO HA 1 1 7 4303 1 1 19 PRO HB2 H 3.903 3.223 -8.066 1.00 . A A . 19 PRO HB2 1 1 7 4304 1 1 19 PRO HB3 H 5.564 3.813 -7.965 1.00 . A A . 19 PRO HB3 1 1 7 4305 1 1 19 PRO HD2 H 5.990 1.998 -4.753 1.00 . A A . 19 PRO HD2 1 1 7 4306 1 1 19 PRO HD3 H 7.045 2.816 -5.937 1.00 . A A . 19 PRO HD3 1 1 7 4307 1 1 19 PRO HG2 H 4.311 1.626 -6.372 1.00 . A A . 19 PRO HG2 1 1 7 4308 1 1 19 PRO HG3 H 5.729 1.585 -7.423 1.00 . A A . 19 PRO HG3 1 1 7 4309 1 1 19 PRO N N 5.389 3.951 -5.281 1.00 . A A . 19 PRO N 1 1 7 4310 1 1 19 PRO O O 2.813 3.143 -4.865 1.00 . A A . 19 PRO O 1 1 7 4311 1 1 20 ARG C C 0.285 2.711 -6.316 1.00 . A A . 20 ARG C 1 1 7 4312 1 1 20 ARG CA C 0.605 4.181 -6.155 1.00 . A A . 20 ARG CA 1 1 7 4313 1 1 20 ARG CB C -0.259 5.004 -7.098 1.00 . A A . 20 ARG CB 1 1 7 4314 1 1 20 ARG CD C -2.553 5.572 -7.906 1.00 . A A . 20 ARG CD 1 1 7 4315 1 1 20 ARG CG C -1.718 4.664 -7.021 1.00 . A A . 20 ARG CG 1 1 7 4316 1 1 20 ARG CZ C -4.760 4.474 -8.111 1.00 . A A . 20 ARG CZ 1 1 7 4317 1 1 20 ARG H H 2.216 4.873 -7.319 1.00 . A A . 20 ARG H 1 1 7 4318 1 1 20 ARG HA H 0.433 4.481 -5.127 1.00 . A A . 20 ARG HA 1 1 7 4319 1 1 20 ARG HB2 H -0.135 6.044 -6.863 1.00 . A A . 20 ARG HB2 1 1 7 4320 1 1 20 ARG HB3 H 0.071 4.832 -8.108 1.00 . A A . 20 ARG HB3 1 1 7 4321 1 1 20 ARG HD2 H -2.246 6.592 -7.736 1.00 . A A . 20 ARG HD2 1 1 7 4322 1 1 20 ARG HD3 H -2.371 5.311 -8.939 1.00 . A A . 20 ARG HD3 1 1 7 4323 1 1 20 ARG HE H -4.392 6.133 -7.042 1.00 . A A . 20 ARG HE 1 1 7 4324 1 1 20 ARG HG2 H -1.847 3.643 -7.343 1.00 . A A . 20 ARG HG2 1 1 7 4325 1 1 20 ARG HG3 H -2.031 4.761 -6.007 1.00 . A A . 20 ARG HG3 1 1 7 4326 1 1 20 ARG HH11 H -3.287 3.598 -9.200 1.00 . A A . 20 ARG HH11 1 1 7 4327 1 1 20 ARG HH12 H -4.843 2.822 -9.290 1.00 . A A . 20 ARG HH12 1 1 7 4328 1 1 20 ARG HH21 H -6.436 5.135 -7.184 1.00 . A A . 20 ARG HH21 1 1 7 4329 1 1 20 ARG HH22 H -6.637 3.700 -8.138 1.00 . A A . 20 ARG HH22 1 1 7 4330 1 1 20 ARG N N 1.997 4.409 -6.492 1.00 . A A . 20 ARG N 1 1 7 4331 1 1 20 ARG NE N -3.985 5.446 -7.629 1.00 . A A . 20 ARG NE 1 1 7 4332 1 1 20 ARG NH1 N -4.257 3.560 -8.933 1.00 . A A . 20 ARG NH1 1 1 7 4333 1 1 20 ARG NH2 N -6.045 4.435 -7.787 1.00 . A A . 20 ARG NH2 1 1 7 4334 1 1 20 ARG O O -0.462 2.113 -5.538 1.00 . A A . 20 ARG O 1 1 7 4335 1 1 21 ASP C C 1.227 -0.097 -6.437 1.00 . A A . 21 ASP C 1 1 7 4336 1 1 21 ASP CA C 0.789 0.730 -7.636 1.00 . A A . 21 ASP CA 1 1 7 4337 1 1 21 ASP CB C 1.661 0.369 -8.842 1.00 . A A . 21 ASP CB 1 1 7 4338 1 1 21 ASP CG C 1.192 1.019 -10.128 1.00 . A A . 21 ASP CG 1 1 7 4339 1 1 21 ASP H H 1.409 2.732 -7.935 1.00 . A A . 21 ASP H 1 1 7 4340 1 1 21 ASP HA H -0.240 0.504 -7.864 1.00 . A A . 21 ASP HA 1 1 7 4341 1 1 21 ASP HB2 H 2.675 0.688 -8.652 1.00 . A A . 21 ASP HB2 1 1 7 4342 1 1 21 ASP HB3 H 1.646 -0.702 -8.977 1.00 . A A . 21 ASP HB3 1 1 7 4343 1 1 21 ASP N N 0.885 2.153 -7.343 1.00 . A A . 21 ASP N 1 1 7 4344 1 1 21 ASP O O 0.746 -1.206 -6.229 1.00 . A A . 21 ASP O 1 1 7 4345 1 1 21 ASP OD1 O 1.537 2.197 -10.366 1.00 . A A . 21 ASP OD1 1 1 7 4346 1 1 21 ASP OD2 O 0.456 0.364 -10.898 1.00 . A A . 21 ASP OD2 1 1 7 4347 1 1 22 ALA C C 1.611 -0.398 -3.395 1.00 . A A . 22 ALA C 1 1 7 4348 1 1 22 ALA CA C 2.658 -0.260 -4.488 1.00 . A A . 22 ALA CA 1 1 7 4349 1 1 22 ALA CB C 3.906 0.411 -3.946 1.00 . A A . 22 ALA CB 1 1 7 4350 1 1 22 ALA H H 2.424 1.377 -5.797 1.00 . A A . 22 ALA H 1 1 7 4351 1 1 22 ALA HA H 2.934 -1.249 -4.825 1.00 . A A . 22 ALA HA 1 1 7 4352 1 1 22 ALA HB1 H 4.318 -0.188 -3.149 1.00 . A A . 22 ALA HB1 1 1 7 4353 1 1 22 ALA HB2 H 3.652 1.390 -3.568 1.00 . A A . 22 ALA HB2 1 1 7 4354 1 1 22 ALA HB3 H 4.635 0.508 -4.738 1.00 . A A . 22 ALA HB3 1 1 7 4355 1 1 22 ALA N N 2.128 0.457 -5.632 1.00 . A A . 22 ALA N 1 1 7 4356 1 1 22 ALA O O 1.583 -1.413 -2.703 1.00 . A A . 22 ALA O 1 1 7 4357 1 1 23 VAL C C -1.246 -0.615 -2.745 1.00 . A A . 23 VAL C 1 1 7 4358 1 1 23 VAL CA C -0.339 0.477 -2.271 1.00 . A A . 23 VAL CA 1 1 7 4359 1 1 23 VAL CB C -1.134 1.794 -2.063 1.00 . A A . 23 VAL CB 1 1 7 4360 1 1 23 VAL CG1 C -2.461 1.794 -2.782 1.00 . A A . 23 VAL CG1 1 1 7 4361 1 1 23 VAL CG2 C -1.372 2.027 -0.601 1.00 . A A . 23 VAL CG2 1 1 7 4362 1 1 23 VAL H H 0.808 1.426 -3.769 1.00 . A A . 23 VAL H 1 1 7 4363 1 1 23 VAL HA H 0.075 0.186 -1.331 1.00 . A A . 23 VAL HA 1 1 7 4364 1 1 23 VAL HB H -0.544 2.606 -2.449 1.00 . A A . 23 VAL HB 1 1 7 4365 1 1 23 VAL HG11 H -3.083 1.004 -2.371 1.00 . A A . 23 VAL HG11 1 1 7 4366 1 1 23 VAL HG12 H -2.283 1.611 -3.827 1.00 . A A . 23 VAL HG12 1 1 7 4367 1 1 23 VAL HG13 H -2.952 2.746 -2.648 1.00 . A A . 23 VAL HG13 1 1 7 4368 1 1 23 VAL HG21 H -1.915 2.951 -0.473 1.00 . A A . 23 VAL HG21 1 1 7 4369 1 1 23 VAL HG22 H -0.423 2.089 -0.090 1.00 . A A . 23 VAL HG22 1 1 7 4370 1 1 23 VAL HG23 H -1.961 1.209 -0.204 1.00 . A A . 23 VAL HG23 1 1 7 4371 1 1 23 VAL N N 0.738 0.606 -3.231 1.00 . A A . 23 VAL N 1 1 7 4372 1 1 23 VAL O O -1.578 -1.534 -2.042 1.00 . A A . 23 VAL O 1 1 7 4373 1 1 24 VAL C C -2.025 -2.892 -4.516 1.00 . A A . 24 VAL C 1 1 7 4374 1 1 24 VAL CA C -2.538 -1.466 -4.497 1.00 . A A . 24 VAL CA 1 1 7 4375 1 1 24 VAL CB C -3.022 -1.012 -5.871 1.00 . A A . 24 VAL CB 1 1 7 4376 1 1 24 VAL CG1 C -3.679 -2.155 -6.621 1.00 . A A . 24 VAL CG1 1 1 7 4377 1 1 24 VAL CG2 C -3.989 0.146 -5.706 1.00 . A A . 24 VAL CG2 1 1 7 4378 1 1 24 VAL H H -1.233 0.191 -4.522 1.00 . A A . 24 VAL H 1 1 7 4379 1 1 24 VAL HA H -3.375 -1.449 -3.815 1.00 . A A . 24 VAL HA 1 1 7 4380 1 1 24 VAL HB H -2.160 -0.658 -6.426 1.00 . A A . 24 VAL HB 1 1 7 4381 1 1 24 VAL HG11 H -2.947 -2.931 -6.799 1.00 . A A . 24 VAL HG11 1 1 7 4382 1 1 24 VAL HG12 H -4.066 -1.799 -7.564 1.00 . A A . 24 VAL HG12 1 1 7 4383 1 1 24 VAL HG13 H -4.487 -2.556 -6.023 1.00 . A A . 24 VAL HG13 1 1 7 4384 1 1 24 VAL HG21 H -4.747 -0.125 -4.982 1.00 . A A . 24 VAL HG21 1 1 7 4385 1 1 24 VAL HG22 H -4.453 0.371 -6.653 1.00 . A A . 24 VAL HG22 1 1 7 4386 1 1 24 VAL HG23 H -3.450 1.013 -5.352 1.00 . A A . 24 VAL HG23 1 1 7 4387 1 1 24 VAL N N -1.586 -0.544 -3.973 1.00 . A A . 24 VAL N 1 1 7 4388 1 1 24 VAL O O -2.734 -3.782 -4.087 1.00 . A A . 24 VAL O 1 1 7 4389 1 1 25 LYS C C -0.162 -5.036 -3.585 1.00 . A A . 25 LYS C 1 1 7 4390 1 1 25 LYS CA C -0.276 -4.467 -4.992 1.00 . A A . 25 LYS CA 1 1 7 4391 1 1 25 LYS CB C 1.079 -4.493 -5.691 1.00 . A A . 25 LYS CB 1 1 7 4392 1 1 25 LYS CD C 2.376 -3.954 -7.771 1.00 . A A . 25 LYS CD 1 1 7 4393 1 1 25 LYS CE C 3.198 -5.231 -7.699 1.00 . A A . 25 LYS CE 1 1 7 4394 1 1 25 LYS CG C 0.999 -4.140 -7.166 1.00 . A A . 25 LYS CG 1 1 7 4395 1 1 25 LYS H H -0.236 -2.362 -5.244 1.00 . A A . 25 LYS H 1 1 7 4396 1 1 25 LYS HA H -0.972 -5.073 -5.555 1.00 . A A . 25 LYS HA 1 1 7 4397 1 1 25 LYS HB2 H 1.736 -3.786 -5.205 1.00 . A A . 25 LYS HB2 1 1 7 4398 1 1 25 LYS HB3 H 1.499 -5.483 -5.602 1.00 . A A . 25 LYS HB3 1 1 7 4399 1 1 25 LYS HD2 H 2.269 -3.665 -8.806 1.00 . A A . 25 LYS HD2 1 1 7 4400 1 1 25 LYS HD3 H 2.887 -3.174 -7.227 1.00 . A A . 25 LYS HD3 1 1 7 4401 1 1 25 LYS HE2 H 3.397 -5.459 -6.662 1.00 . A A . 25 LYS HE2 1 1 7 4402 1 1 25 LYS HE3 H 2.629 -6.035 -8.141 1.00 . A A . 25 LYS HE3 1 1 7 4403 1 1 25 LYS HG2 H 0.491 -4.936 -7.689 1.00 . A A . 25 LYS HG2 1 1 7 4404 1 1 25 LYS HG3 H 0.440 -3.223 -7.277 1.00 . A A . 25 LYS HG3 1 1 7 4405 1 1 25 LYS HZ1 H 5.014 -5.999 -8.388 1.00 . A A . 25 LYS HZ1 1 1 7 4406 1 1 25 LYS HZ2 H 5.071 -4.350 -7.987 1.00 . A A . 25 LYS HZ2 1 1 7 4407 1 1 25 LYS HZ3 H 4.315 -4.852 -9.419 1.00 . A A . 25 LYS HZ3 1 1 7 4408 1 1 25 LYS N N -0.801 -3.115 -4.952 1.00 . A A . 25 LYS N 1 1 7 4409 1 1 25 LYS NZ N 4.490 -5.098 -8.419 1.00 . A A . 25 LYS NZ 1 1 7 4410 1 1 25 LYS O O -0.506 -6.195 -3.339 1.00 . A A . 25 LYS O 1 1 7 4411 1 1 26 ALA C C -0.728 -4.757 -0.519 1.00 . A A . 26 ALA C 1 1 7 4412 1 1 26 ALA CA C 0.548 -4.662 -1.316 1.00 . A A . 26 ALA CA 1 1 7 4413 1 1 26 ALA CB C 1.538 -3.736 -0.651 1.00 . A A . 26 ALA CB 1 1 7 4414 1 1 26 ALA H H 0.340 -3.242 -2.833 1.00 . A A . 26 ALA H 1 1 7 4415 1 1 26 ALA HA H 0.987 -5.646 -1.385 1.00 . A A . 26 ALA HA 1 1 7 4416 1 1 26 ALA HB1 H 1.114 -2.745 -0.583 1.00 . A A . 26 ALA HB1 1 1 7 4417 1 1 26 ALA HB2 H 2.447 -3.700 -1.233 1.00 . A A . 26 ALA HB2 1 1 7 4418 1 1 26 ALA HB3 H 1.760 -4.100 0.342 1.00 . A A . 26 ALA HB3 1 1 7 4419 1 1 26 ALA N N 0.268 -4.203 -2.646 1.00 . A A . 26 ALA N 1 1 7 4420 1 1 26 ALA O O -1.001 -5.755 0.143 1.00 . A A . 26 ALA O 1 1 7 4421 1 1 27 LEU C C -3.661 -4.786 -0.455 1.00 . A A . 27 LEU C 1 1 7 4422 1 1 27 LEU CA C -2.755 -3.707 0.130 1.00 . A A . 27 LEU CA 1 1 7 4423 1 1 27 LEU CB C -3.375 -2.304 0.086 1.00 . A A . 27 LEU CB 1 1 7 4424 1 1 27 LEU CD1 C -2.965 -1.163 2.274 1.00 . A A . 27 LEU CD1 1 1 7 4425 1 1 27 LEU CD2 C -1.164 -1.278 0.639 1.00 . A A . 27 LEU CD2 1 1 7 4426 1 1 27 LEU CG C -2.637 -1.169 0.810 1.00 . A A . 27 LEU CG 1 1 7 4427 1 1 27 LEU H H -1.331 -2.972 -1.209 1.00 . A A . 27 LEU H 1 1 7 4428 1 1 27 LEU HA H -2.526 -3.958 1.155 1.00 . A A . 27 LEU HA 1 1 7 4429 1 1 27 LEU HB2 H -3.448 -2.017 -0.942 1.00 . A A . 27 LEU HB2 1 1 7 4430 1 1 27 LEU HB3 H -4.372 -2.366 0.494 1.00 . A A . 27 LEU HB3 1 1 7 4431 1 1 27 LEU HD11 H -2.487 -0.323 2.749 1.00 . A A . 27 LEU HD11 1 1 7 4432 1 1 27 LEU HD12 H -2.611 -2.081 2.714 1.00 . A A . 27 LEU HD12 1 1 7 4433 1 1 27 LEU HD13 H -4.034 -1.092 2.396 1.00 . A A . 27 LEU HD13 1 1 7 4434 1 1 27 LEU HD21 H -0.836 -2.214 1.063 1.00 . A A . 27 LEU HD21 1 1 7 4435 1 1 27 LEU HD22 H -0.672 -0.459 1.136 1.00 . A A . 27 LEU HD22 1 1 7 4436 1 1 27 LEU HD23 H -0.938 -1.264 -0.417 1.00 . A A . 27 LEU HD23 1 1 7 4437 1 1 27 LEU HG H -2.930 -0.233 0.378 1.00 . A A . 27 LEU HG 1 1 7 4438 1 1 27 LEU N N -1.538 -3.735 -0.608 1.00 . A A . 27 LEU N 1 1 7 4439 1 1 27 LEU O O -4.525 -5.307 0.202 1.00 . A A . 27 LEU O 1 1 7 4440 1 1 28 LYS C C -3.863 -7.539 -1.592 1.00 . A A . 28 LYS C 1 1 7 4441 1 1 28 LYS CA C -4.144 -6.243 -2.336 1.00 . A A . 28 LYS CA 1 1 7 4442 1 1 28 LYS CB C -3.753 -6.416 -3.797 1.00 . A A . 28 LYS CB 1 1 7 4443 1 1 28 LYS CD C -4.229 -5.687 -6.135 1.00 . A A . 28 LYS CD 1 1 7 4444 1 1 28 LYS CE C -3.727 -6.971 -6.769 1.00 . A A . 28 LYS CE 1 1 7 4445 1 1 28 LYS CG C -4.813 -5.924 -4.761 1.00 . A A . 28 LYS CG 1 1 7 4446 1 1 28 LYS H H -2.864 -4.550 -2.267 1.00 . A A . 28 LYS H 1 1 7 4447 1 1 28 LYS HA H -5.203 -6.044 -2.290 1.00 . A A . 28 LYS HA 1 1 7 4448 1 1 28 LYS HB2 H -2.843 -5.867 -3.982 1.00 . A A . 28 LYS HB2 1 1 7 4449 1 1 28 LYS HB3 H -3.579 -7.465 -3.990 1.00 . A A . 28 LYS HB3 1 1 7 4450 1 1 28 LYS HD2 H -4.987 -5.254 -6.770 1.00 . A A . 28 LYS HD2 1 1 7 4451 1 1 28 LYS HD3 H -3.404 -4.999 -6.028 1.00 . A A . 28 LYS HD3 1 1 7 4452 1 1 28 LYS HE2 H -2.902 -7.350 -6.184 1.00 . A A . 28 LYS HE2 1 1 7 4453 1 1 28 LYS HE3 H -4.528 -7.696 -6.770 1.00 . A A . 28 LYS HE3 1 1 7 4454 1 1 28 LYS HG2 H -5.596 -6.664 -4.835 1.00 . A A . 28 LYS HG2 1 1 7 4455 1 1 28 LYS HG3 H -5.222 -4.998 -4.391 1.00 . A A . 28 LYS HG3 1 1 7 4456 1 1 28 LYS HZ1 H -2.529 -6.017 -8.192 1.00 . A A . 28 LYS HZ1 1 1 7 4457 1 1 28 LYS HZ2 H -4.073 -6.436 -8.755 1.00 . A A . 28 LYS HZ2 1 1 7 4458 1 1 28 LYS HZ3 H -2.891 -7.633 -8.562 1.00 . A A . 28 LYS HZ3 1 1 7 4459 1 1 28 LYS N N -3.460 -5.106 -1.724 1.00 . A A . 28 LYS N 1 1 7 4460 1 1 28 LYS NZ N -3.271 -6.752 -8.164 1.00 . A A . 28 LYS NZ 1 1 7 4461 1 1 28 LYS O O -4.801 -8.220 -1.173 1.00 . A A . 28 LYS O 1 1 7 4462 1 1 29 GLN C C -2.595 -9.250 0.619 1.00 . A A . 29 GLN C 1 1 7 4463 1 1 29 GLN CA C -2.273 -9.184 -0.874 1.00 . A A . 29 GLN CA 1 1 7 4464 1 1 29 GLN CB C -0.811 -9.479 -1.136 1.00 . A A . 29 GLN CB 1 1 7 4465 1 1 29 GLN CD C 0.925 -7.786 -0.416 1.00 . A A . 29 GLN CD 1 1 7 4466 1 1 29 GLN CG C 0.116 -9.005 -0.059 1.00 . A A . 29 GLN CG 1 1 7 4467 1 1 29 GLN H H -1.836 -7.273 -1.637 1.00 . A A . 29 GLN H 1 1 7 4468 1 1 29 GLN HA H -2.875 -9.914 -1.393 1.00 . A A . 29 GLN HA 1 1 7 4469 1 1 29 GLN HB2 H -0.698 -10.520 -1.232 1.00 . A A . 29 GLN HB2 1 1 7 4470 1 1 29 GLN HB3 H -0.521 -9.005 -2.051 1.00 . A A . 29 GLN HB3 1 1 7 4471 1 1 29 GLN HE21 H 1.044 -8.324 -2.326 1.00 . A A . 29 GLN HE21 1 1 7 4472 1 1 29 GLN HE22 H 1.824 -6.839 -1.894 1.00 . A A . 29 GLN HE22 1 1 7 4473 1 1 29 GLN HG2 H -0.471 -8.770 0.803 1.00 . A A . 29 GLN HG2 1 1 7 4474 1 1 29 GLN HG3 H 0.778 -9.795 0.171 1.00 . A A . 29 GLN HG3 1 1 7 4475 1 1 29 GLN N N -2.586 -7.892 -1.408 1.00 . A A . 29 GLN N 1 1 7 4476 1 1 29 GLN NE2 N 1.303 -7.638 -1.668 1.00 . A A . 29 GLN NE2 1 1 7 4477 1 1 29 GLN O O -3.015 -10.284 1.139 1.00 . A A . 29 GLN O 1 1 7 4478 1 1 29 GLN OE1 O 1.231 -6.980 0.448 1.00 . A A . 29 GLN OE1 1 1 7 4479 1 1 30 THR C C -4.090 -7.654 3.004 1.00 . A A . 30 THR C 1 1 7 4480 1 1 30 THR CA C -2.639 -8.006 2.709 1.00 . A A . 30 THR CA 1 1 7 4481 1 1 30 THR CB C -1.754 -6.906 3.292 1.00 . A A . 30 THR CB 1 1 7 4482 1 1 30 THR CG2 C -0.292 -7.312 3.242 1.00 . A A . 30 THR CG2 1 1 7 4483 1 1 30 THR H H -2.001 -7.373 0.809 1.00 . A A . 30 THR H 1 1 7 4484 1 1 30 THR HA H -2.389 -8.940 3.188 1.00 . A A . 30 THR HA 1 1 7 4485 1 1 30 THR HB H -2.042 -6.740 4.310 1.00 . A A . 30 THR HB 1 1 7 4486 1 1 30 THR HG1 H -1.325 -5.656 1.820 1.00 . A A . 30 THR HG1 1 1 7 4487 1 1 30 THR HG21 H -0.151 -8.228 3.797 1.00 . A A . 30 THR HG21 1 1 7 4488 1 1 30 THR HG22 H 0.316 -6.529 3.674 1.00 . A A . 30 THR HG22 1 1 7 4489 1 1 30 THR HG23 H 0.001 -7.466 2.212 1.00 . A A . 30 THR HG23 1 1 7 4490 1 1 30 THR N N -2.385 -8.133 1.286 1.00 . A A . 30 THR N 1 1 7 4491 1 1 30 THR O O -4.541 -7.727 4.148 1.00 . A A . 30 THR O 1 1 7 4492 1 1 30 THR OG1 O -1.951 -5.692 2.560 1.00 . A A . 30 THR OG1 1 1 7 4493 1 1 31 ASN C C -6.256 -5.443 2.787 1.00 . A A . 31 ASN C 1 1 7 4494 1 1 31 ASN CA C -6.165 -6.772 2.038 1.00 . A A . 31 ASN CA 1 1 7 4495 1 1 31 ASN CB C -7.109 -7.811 2.656 1.00 . A A . 31 ASN CB 1 1 7 4496 1 1 31 ASN CG C -7.398 -8.965 1.717 1.00 . A A . 31 ASN CG 1 1 7 4497 1 1 31 ASN H H -4.363 -7.285 1.072 1.00 . A A . 31 ASN H 1 1 7 4498 1 1 31 ASN HA H -6.486 -6.588 1.019 1.00 . A A . 31 ASN HA 1 1 7 4499 1 1 31 ASN HB2 H -6.658 -8.208 3.554 1.00 . A A . 31 ASN HB2 1 1 7 4500 1 1 31 ASN HB3 H -8.043 -7.334 2.908 1.00 . A A . 31 ASN HB3 1 1 7 4501 1 1 31 ASN HD21 H -5.988 -10.070 2.576 1.00 . A A . 31 ASN HD21 1 1 7 4502 1 1 31 ASN HD22 H -6.842 -10.818 1.273 1.00 . A A . 31 ASN HD22 1 1 7 4503 1 1 31 ASN N N -4.792 -7.257 1.954 1.00 . A A . 31 ASN N 1 1 7 4504 1 1 31 ASN ND2 N -6.668 -10.059 1.869 1.00 . A A . 31 ASN ND2 1 1 7 4505 1 1 31 ASN O O -6.990 -5.316 3.766 1.00 . A A . 31 ASN O 1 1 7 4506 1 1 31 ASN OD1 O -8.287 -8.877 0.869 1.00 . A A . 31 ASN OD1 1 1 7 4507 1 1 32 GLY C C -5.156 -2.736 4.114 1.00 . A A . 32 GLY C 1 1 7 4508 1 1 32 GLY CA C -5.716 -3.104 2.740 1.00 . A A . 32 GLY CA 1 1 7 4509 1 1 32 GLY H H -4.831 -4.623 1.600 1.00 . A A . 32 GLY H 1 1 7 4510 1 1 32 GLY HA2 H -5.270 -2.458 1.991 1.00 . A A . 32 GLY HA2 1 1 7 4511 1 1 32 GLY HA3 H -6.782 -2.917 2.745 1.00 . A A . 32 GLY HA3 1 1 7 4512 1 1 32 GLY N N -5.512 -4.448 2.310 1.00 . A A . 32 GLY N 1 1 7 4513 1 1 32 GLY O O -5.496 -1.666 4.615 1.00 . A A . 32 GLY O 1 1 7 4514 1 1 33 ASN C C -2.351 -2.649 5.881 1.00 . A A . 33 ASN C 1 1 7 4515 1 1 33 ASN CA C -3.786 -3.145 6.034 1.00 . A A . 33 ASN CA 1 1 7 4516 1 1 33 ASN CB C -3.941 -4.230 7.079 1.00 . A A . 33 ASN CB 1 1 7 4517 1 1 33 ASN CG C -2.855 -5.246 7.053 1.00 . A A . 33 ASN CG 1 1 7 4518 1 1 33 ASN H H -4.054 -4.429 4.396 1.00 . A A . 33 ASN H 1 1 7 4519 1 1 33 ASN HA H -4.382 -2.329 6.336 1.00 . A A . 33 ASN HA 1 1 7 4520 1 1 33 ASN HB2 H -3.958 -3.779 8.039 1.00 . A A . 33 ASN HB2 1 1 7 4521 1 1 33 ASN HB3 H -4.878 -4.737 6.904 1.00 . A A . 33 ASN HB3 1 1 7 4522 1 1 33 ASN HD21 H -3.695 -5.947 5.450 1.00 . A A . 33 ASN HD21 1 1 7 4523 1 1 33 ASN HD22 H -2.278 -6.795 5.986 1.00 . A A . 33 ASN HD22 1 1 7 4524 1 1 33 ASN N N -4.316 -3.561 4.759 1.00 . A A . 33 ASN N 1 1 7 4525 1 1 33 ASN ND2 N -2.944 -6.081 6.065 1.00 . A A . 33 ASN ND2 1 1 7 4526 1 1 33 ASN O O -1.490 -3.334 5.322 1.00 . A A . 33 ASN O 1 1 7 4527 1 1 33 ASN OD1 O -1.948 -5.244 7.878 1.00 . A A . 33 ASN OD1 1 1 7 4528 1 1 34 ALA C C 0.387 -1.307 6.285 1.00 . A A . 34 ALA C 1 1 7 4529 1 1 34 ALA CA C -0.950 -0.639 6.009 1.00 . A A . 34 ALA CA 1 1 7 4530 1 1 34 ALA CB C -1.009 0.715 6.698 1.00 . A A . 34 ALA CB 1 1 7 4531 1 1 34 ALA H H -2.790 -1.042 6.979 1.00 . A A . 34 ALA H 1 1 7 4532 1 1 34 ALA HA H -1.006 -0.464 4.952 1.00 . A A . 34 ALA HA 1 1 7 4533 1 1 34 ALA HB1 H -0.207 1.338 6.334 1.00 . A A . 34 ALA HB1 1 1 7 4534 1 1 34 ALA HB2 H -0.906 0.580 7.764 1.00 . A A . 34 ALA HB2 1 1 7 4535 1 1 34 ALA HB3 H -1.957 1.187 6.485 1.00 . A A . 34 ALA HB3 1 1 7 4536 1 1 34 ALA N N -2.124 -1.435 6.368 1.00 . A A . 34 ALA N 1 1 7 4537 1 1 34 ALA O O 1.140 -1.578 5.347 1.00 . A A . 34 ALA O 1 1 7 4538 1 1 35 GLU C C 2.453 -3.229 7.202 1.00 . A A . 35 GLU C 1 1 7 4539 1 1 35 GLU CA C 1.999 -1.993 7.938 1.00 . A A . 35 GLU CA 1 1 7 4540 1 1 35 GLU CB C 2.027 -2.203 9.427 1.00 . A A . 35 GLU CB 1 1 7 4541 1 1 35 GLU CD C 3.021 0.042 9.945 1.00 . A A . 35 GLU CD 1 1 7 4542 1 1 35 GLU CG C 1.880 -0.923 10.180 1.00 . A A . 35 GLU CG 1 1 7 4543 1 1 35 GLU H H 0.050 -1.438 8.248 1.00 . A A . 35 GLU H 1 1 7 4544 1 1 35 GLU HA H 2.632 -1.211 7.712 1.00 . A A . 35 GLU HA 1 1 7 4545 1 1 35 GLU HB2 H 1.224 -2.853 9.722 1.00 . A A . 35 GLU HB2 1 1 7 4546 1 1 35 GLU HB3 H 2.952 -2.641 9.695 1.00 . A A . 35 GLU HB3 1 1 7 4547 1 1 35 GLU HG2 H 0.963 -0.455 9.880 1.00 . A A . 35 GLU HG2 1 1 7 4548 1 1 35 GLU HG3 H 1.837 -1.165 11.207 1.00 . A A . 35 GLU HG3 1 1 7 4549 1 1 35 GLU N N 0.695 -1.561 7.550 1.00 . A A . 35 GLU N 1 1 7 4550 1 1 35 GLU O O 3.602 -3.349 6.765 1.00 . A A . 35 GLU O 1 1 7 4551 1 1 35 GLU OE1 O 2.948 0.837 8.991 1.00 . A A . 35 GLU OE1 1 1 7 4552 1 1 35 GLU OE2 O 4.002 0.009 10.716 1.00 . A A . 35 GLU OE2 1 1 7 4553 1 1 36 PHE C C 2.013 -5.168 4.921 1.00 . A A . 36 PHE C 1 1 7 4554 1 1 36 PHE CA C 1.745 -5.375 6.383 1.00 . A A . 36 PHE CA 1 1 7 4555 1 1 36 PHE CB C 0.516 -6.245 6.585 1.00 . A A . 36 PHE CB 1 1 7 4556 1 1 36 PHE CD1 C 0.782 -6.238 9.036 1.00 . A A . 36 PHE CD1 1 1 7 4557 1 1 36 PHE CD2 C 0.380 -8.330 7.985 1.00 . A A . 36 PHE CD2 1 1 7 4558 1 1 36 PHE CE1 C 0.835 -6.832 10.244 1.00 . A A . 36 PHE CE1 1 1 7 4559 1 1 36 PHE CE2 C 0.430 -8.952 9.220 1.00 . A A . 36 PHE CE2 1 1 7 4560 1 1 36 PHE CG C 0.555 -6.961 7.890 1.00 . A A . 36 PHE CG 1 1 7 4561 1 1 36 PHE CZ C 0.661 -8.198 10.357 1.00 . A A . 36 PHE CZ 1 1 7 4562 1 1 36 PHE H H 0.639 -3.918 7.416 1.00 . A A . 36 PHE H 1 1 7 4563 1 1 36 PHE HA H 2.601 -5.848 6.834 1.00 . A A . 36 PHE HA 1 1 7 4564 1 1 36 PHE HB2 H -0.357 -5.607 6.589 1.00 . A A . 36 PHE HB2 1 1 7 4565 1 1 36 PHE HB3 H 0.422 -6.953 5.789 1.00 . A A . 36 PHE HB3 1 1 7 4566 1 1 36 PHE HD1 H 0.920 -5.176 8.979 1.00 . A A . 36 PHE HD1 1 1 7 4567 1 1 36 PHE HD2 H 0.199 -8.910 7.091 1.00 . A A . 36 PHE HD2 1 1 7 4568 1 1 36 PHE HE1 H 1.018 -6.220 11.097 1.00 . A A . 36 PHE HE1 1 1 7 4569 1 1 36 PHE HE2 H 0.294 -10.021 9.295 1.00 . A A . 36 PHE HE2 1 1 7 4570 1 1 36 PHE HZ H 0.704 -8.672 11.326 1.00 . A A . 36 PHE HZ 1 1 7 4571 1 1 36 PHE N N 1.523 -4.118 7.054 1.00 . A A . 36 PHE N 1 1 7 4572 1 1 36 PHE O O 2.907 -5.785 4.344 1.00 . A A . 36 PHE O 1 1 7 4573 1 1 37 ALA C C 2.662 -3.398 2.573 1.00 . A A . 37 ALA C 1 1 7 4574 1 1 37 ALA CA C 1.342 -4.050 2.925 1.00 . A A . 37 ALA CA 1 1 7 4575 1 1 37 ALA CB C 0.193 -3.195 2.513 1.00 . A A . 37 ALA CB 1 1 7 4576 1 1 37 ALA H H 0.622 -3.731 4.863 1.00 . A A . 37 ALA H 1 1 7 4577 1 1 37 ALA HA H 1.264 -4.998 2.417 1.00 . A A . 37 ALA HA 1 1 7 4578 1 1 37 ALA HB1 H 0.220 -3.050 1.443 1.00 . A A . 37 ALA HB1 1 1 7 4579 1 1 37 ALA HB2 H 0.264 -2.237 3.008 1.00 . A A . 37 ALA HB2 1 1 7 4580 1 1 37 ALA HB3 H -0.734 -3.677 2.788 1.00 . A A . 37 ALA HB3 1 1 7 4581 1 1 37 ALA N N 1.253 -4.279 4.331 1.00 . A A . 37 ALA N 1 1 7 4582 1 1 37 ALA O O 3.321 -3.791 1.630 1.00 . A A . 37 ALA O 1 1 7 4583 1 1 38 ALA C C 5.450 -2.691 3.218 1.00 . A A . 38 ALA C 1 1 7 4584 1 1 38 ALA CA C 4.301 -1.720 3.147 1.00 . A A . 38 ALA CA 1 1 7 4585 1 1 38 ALA CB C 4.493 -0.634 4.181 1.00 . A A . 38 ALA CB 1 1 7 4586 1 1 38 ALA H H 2.465 -2.132 4.070 1.00 . A A . 38 ALA H 1 1 7 4587 1 1 38 ALA HA H 4.282 -1.262 2.170 1.00 . A A . 38 ALA HA 1 1 7 4588 1 1 38 ALA HB1 H 5.424 -0.122 3.992 1.00 . A A . 38 ALA HB1 1 1 7 4589 1 1 38 ALA HB2 H 4.518 -1.074 5.166 1.00 . A A . 38 ALA HB2 1 1 7 4590 1 1 38 ALA HB3 H 3.677 0.067 4.119 1.00 . A A . 38 ALA HB3 1 1 7 4591 1 1 38 ALA N N 3.045 -2.410 3.350 1.00 . A A . 38 ALA N 1 1 7 4592 1 1 38 ALA O O 6.342 -2.663 2.385 1.00 . A A . 38 ALA O 1 1 7 4593 1 1 39 SER C C 6.531 -5.529 3.337 1.00 . A A . 39 SER C 1 1 7 4594 1 1 39 SER CA C 6.480 -4.492 4.431 1.00 . A A . 39 SER CA 1 1 7 4595 1 1 39 SER CB C 6.299 -5.147 5.796 1.00 . A A . 39 SER CB 1 1 7 4596 1 1 39 SER H H 4.539 -3.744 4.638 1.00 . A A . 39 SER H 1 1 7 4597 1 1 39 SER HA H 7.391 -3.914 4.424 1.00 . A A . 39 SER HA 1 1 7 4598 1 1 39 SER HB2 H 5.388 -5.729 5.794 1.00 . A A . 39 SER HB2 1 1 7 4599 1 1 39 SER HB3 H 7.140 -5.790 6.000 1.00 . A A . 39 SER HB3 1 1 7 4600 1 1 39 SER HG H 5.291 -3.883 6.917 1.00 . A A . 39 SER HG 1 1 7 4601 1 1 39 SER N N 5.378 -3.605 4.162 1.00 . A A . 39 SER N 1 1 7 4602 1 1 39 SER O O 7.563 -6.148 3.080 1.00 . A A . 39 SER O 1 1 7 4603 1 1 39 SER OG O 6.214 -4.165 6.820 1.00 . A A . 39 SER OG 1 1 7 4604 1 1 40 LEU C C 5.757 -5.854 0.339 1.00 . A A . 40 LEU C 1 1 7 4605 1 1 40 LEU CA C 5.283 -6.560 1.576 1.00 . A A . 40 LEU CA 1 1 7 4606 1 1 40 LEU CB C 3.839 -6.945 1.425 1.00 . A A . 40 LEU CB 1 1 7 4607 1 1 40 LEU CD1 C 4.322 -9.241 0.528 1.00 . A A . 40 LEU CD1 1 1 7 4608 1 1 40 LEU CD2 C 3.839 -8.934 2.962 1.00 . A A . 40 LEU CD2 1 1 7 4609 1 1 40 LEU CG C 3.535 -8.443 1.554 1.00 . A A . 40 LEU CG 1 1 7 4610 1 1 40 LEU H H 4.590 -5.204 2.946 1.00 . A A . 40 LEU H 1 1 7 4611 1 1 40 LEU HA H 5.888 -7.434 1.742 1.00 . A A . 40 LEU HA 1 1 7 4612 1 1 40 LEU HB2 H 3.254 -6.400 2.155 1.00 . A A . 40 LEU HB2 1 1 7 4613 1 1 40 LEU HB3 H 3.533 -6.605 0.476 1.00 . A A . 40 LEU HB3 1 1 7 4614 1 1 40 LEU HD11 H 4.112 -10.293 0.651 1.00 . A A . 40 LEU HD11 1 1 7 4615 1 1 40 LEU HD12 H 5.378 -9.065 0.668 1.00 . A A . 40 LEU HD12 1 1 7 4616 1 1 40 LEU HD13 H 4.034 -8.930 -0.465 1.00 . A A . 40 LEU HD13 1 1 7 4617 1 1 40 LEU HD21 H 3.265 -8.361 3.675 1.00 . A A . 40 LEU HD21 1 1 7 4618 1 1 40 LEU HD22 H 4.892 -8.812 3.167 1.00 . A A . 40 LEU HD22 1 1 7 4619 1 1 40 LEU HD23 H 3.574 -9.978 3.044 1.00 . A A . 40 LEU HD23 1 1 7 4620 1 1 40 LEU HG H 2.482 -8.606 1.364 1.00 . A A . 40 LEU HG 1 1 7 4621 1 1 40 LEU N N 5.395 -5.696 2.681 1.00 . A A . 40 LEU N 1 1 7 4622 1 1 40 LEU O O 6.547 -6.405 -0.420 1.00 . A A . 40 LEU O 1 1 7 4623 1 1 41 LEU C C 7.121 -3.635 -1.061 1.00 . A A . 41 LEU C 1 1 7 4624 1 1 41 LEU CA C 5.621 -3.868 -1.025 1.00 . A A . 41 LEU CA 1 1 7 4625 1 1 41 LEU CB C 4.762 -2.604 -1.114 1.00 . A A . 41 LEU CB 1 1 7 4626 1 1 41 LEU CD1 C 6.391 -0.814 -0.783 1.00 . A A . 41 LEU CD1 1 1 7 4627 1 1 41 LEU CD2 C 4.023 -0.446 -0.139 1.00 . A A . 41 LEU CD2 1 1 7 4628 1 1 41 LEU CG C 5.156 -1.440 -0.238 1.00 . A A . 41 LEU CG 1 1 7 4629 1 1 41 LEU H H 4.796 -4.136 0.887 1.00 . A A . 41 LEU H 1 1 7 4630 1 1 41 LEU HA H 5.370 -4.491 -1.849 1.00 . A A . 41 LEU HA 1 1 7 4631 1 1 41 LEU HB2 H 4.767 -2.268 -2.139 1.00 . A A . 41 LEU HB2 1 1 7 4632 1 1 41 LEU HB3 H 3.750 -2.883 -0.853 1.00 . A A . 41 LEU HB3 1 1 7 4633 1 1 41 LEU HD11 H 6.207 -0.461 -1.784 1.00 . A A . 41 LEU HD11 1 1 7 4634 1 1 41 LEU HD12 H 7.164 -1.569 -0.799 1.00 . A A . 41 LEU HD12 1 1 7 4635 1 1 41 LEU HD13 H 6.692 0.004 -0.152 1.00 . A A . 41 LEU HD13 1 1 7 4636 1 1 41 LEU HD21 H 3.169 -0.933 0.305 1.00 . A A . 41 LEU HD21 1 1 7 4637 1 1 41 LEU HD22 H 3.767 -0.097 -1.126 1.00 . A A . 41 LEU HD22 1 1 7 4638 1 1 41 LEU HD23 H 4.330 0.388 0.475 1.00 . A A . 41 LEU HD23 1 1 7 4639 1 1 41 LEU HG H 5.380 -1.791 0.746 1.00 . A A . 41 LEU HG 1 1 7 4640 1 1 41 LEU N N 5.316 -4.604 0.163 1.00 . A A . 41 LEU N 1 1 7 4641 1 1 41 LEU O O 7.718 -3.475 -2.124 1.00 . A A . 41 LEU O 1 1 7 4642 1 1 42 PHE C C 9.917 -4.486 -0.478 1.00 . A A . 42 PHE C 1 1 7 4643 1 1 42 PHE CA C 9.131 -3.483 0.360 1.00 . A A . 42 PHE CA 1 1 7 4644 1 1 42 PHE CB C 9.460 -3.694 1.829 1.00 . A A . 42 PHE CB 1 1 7 4645 1 1 42 PHE CD1 C 8.861 -1.534 2.689 1.00 . A A . 42 PHE CD1 1 1 7 4646 1 1 42 PHE CD2 C 11.149 -2.117 2.810 1.00 . A A . 42 PHE CD2 1 1 7 4647 1 1 42 PHE CE1 C 9.121 -0.328 3.242 1.00 . A A . 42 PHE CE1 1 1 7 4648 1 1 42 PHE CE2 C 11.437 -0.892 3.383 1.00 . A A . 42 PHE CE2 1 1 7 4649 1 1 42 PHE CG C 9.844 -2.429 2.469 1.00 . A A . 42 PHE CG 1 1 7 4650 1 1 42 PHE CZ C 10.413 0.013 3.599 1.00 . A A . 42 PHE CZ 1 1 7 4651 1 1 42 PHE H H 7.126 -3.672 0.926 1.00 . A A . 42 PHE H 1 1 7 4652 1 1 42 PHE HA H 9.411 -2.464 0.108 1.00 . A A . 42 PHE HA 1 1 7 4653 1 1 42 PHE HB2 H 8.581 -4.051 2.342 1.00 . A A . 42 PHE HB2 1 1 7 4654 1 1 42 PHE HB3 H 10.258 -4.392 1.933 1.00 . A A . 42 PHE HB3 1 1 7 4655 1 1 42 PHE HD1 H 7.844 -1.808 2.420 1.00 . A A . 42 PHE HD1 1 1 7 4656 1 1 42 PHE HD2 H 11.935 -2.834 2.633 1.00 . A A . 42 PHE HD2 1 1 7 4657 1 1 42 PHE HE1 H 8.316 0.346 3.386 1.00 . A A . 42 PHE HE1 1 1 7 4658 1 1 42 PHE HE2 H 12.452 -0.642 3.657 1.00 . A A . 42 PHE HE2 1 1 7 4659 1 1 42 PHE HZ H 10.621 0.977 4.040 1.00 . A A . 42 PHE HZ 1 1 7 4660 1 1 42 PHE N N 7.701 -3.604 0.145 1.00 . A A . 42 PHE N 1 1 7 4661 1 1 42 PHE O O 11.133 -4.357 -0.637 1.00 . A A . 42 PHE O 1 1 7 4662 1 1 43 GLN C C 10.395 -5.854 -3.132 1.00 . A A . 43 GLN C 1 1 7 4663 1 1 43 GLN CA C 9.831 -6.504 -1.870 1.00 . A A . 43 GLN CA 1 1 7 4664 1 1 43 GLN CB C 8.831 -7.610 -2.252 1.00 . A A . 43 GLN CB 1 1 7 4665 1 1 43 GLN CD C 6.540 -7.303 -3.307 1.00 . A A . 43 GLN CD 1 1 7 4666 1 1 43 GLN CG C 8.040 -7.348 -3.531 1.00 . A A . 43 GLN CG 1 1 7 4667 1 1 43 GLN H H 8.244 -5.575 -0.770 1.00 . A A . 43 GLN H 1 1 7 4668 1 1 43 GLN HA H 10.647 -6.943 -1.327 1.00 . A A . 43 GLN HA 1 1 7 4669 1 1 43 GLN HB2 H 9.374 -8.534 -2.379 1.00 . A A . 43 GLN HB2 1 1 7 4670 1 1 43 GLN HB3 H 8.127 -7.731 -1.440 1.00 . A A . 43 GLN HB3 1 1 7 4671 1 1 43 GLN HE21 H 6.601 -5.328 -3.156 1.00 . A A . 43 GLN HE21 1 1 7 4672 1 1 43 GLN HE22 H 5.045 -6.053 -2.948 1.00 . A A . 43 GLN HE22 1 1 7 4673 1 1 43 GLN HG2 H 8.352 -6.399 -3.942 1.00 . A A . 43 GLN HG2 1 1 7 4674 1 1 43 GLN HG3 H 8.260 -8.134 -4.239 1.00 . A A . 43 GLN HG3 1 1 7 4675 1 1 43 GLN N N 9.213 -5.500 -0.996 1.00 . A A . 43 GLN N 1 1 7 4676 1 1 43 GLN NE2 N 6.007 -6.108 -3.127 1.00 . A A . 43 GLN NE2 1 1 7 4677 1 1 43 GLN O O 11.212 -6.442 -3.841 1.00 . A A . 43 GLN O 1 1 7 4678 1 1 43 GLN OE1 O 5.864 -8.329 -3.327 1.00 . A A . 43 GLN OE1 1 1 7 4679 1 1 44 SER C C 11.693 -3.106 -4.150 1.00 . A A . 44 SER C 1 1 7 4680 1 1 44 SER CA C 10.423 -3.871 -4.526 1.00 . A A . 44 SER CA 1 1 7 4681 1 1 44 SER CB C 9.329 -2.904 -4.985 1.00 . A A . 44 SER CB 1 1 7 4682 1 1 44 SER H H 9.288 -4.243 -2.788 1.00 . A A . 44 SER H 1 1 7 4683 1 1 44 SER HA H 10.650 -4.558 -5.326 1.00 . A A . 44 SER HA 1 1 7 4684 1 1 44 SER HB2 H 9.178 -2.149 -4.228 1.00 . A A . 44 SER HB2 1 1 7 4685 1 1 44 SER HB3 H 9.631 -2.433 -5.909 1.00 . A A . 44 SER HB3 1 1 7 4686 1 1 44 SER HG H 7.407 -2.946 -5.389 1.00 . A A . 44 SER HG 1 1 7 4687 1 1 44 SER N N 9.953 -4.640 -3.391 1.00 . A A . 44 SER N 1 1 7 4688 1 1 44 SER O O 11.583 -1.997 -3.590 1.00 . A A . 44 SER O 1 1 7 4689 1 1 44 SER OXT O 12.803 -3.629 -4.393 1.00 . A A . 44 SER OXT 1 1 7 4690 1 1 44 SER OG O 8.100 -3.588 -5.200 1.00 . A A . 44 SER OG 1 1 8 4691 1 1 1 GLY C C -13.151 -1.762 -3.798 1.00 . A A . 1 GLY C 1 1 8 4692 1 1 1 GLY CA C -12.363 -2.720 -4.662 1.00 . A A . 1 GLY CA 1 1 8 4693 1 1 1 GLY H1 H -12.861 -1.852 -6.494 1.00 . A A . 1 GLY H1 1 1 8 4694 1 1 1 GLY H2 H -13.884 -3.117 -6.029 1.00 . A A . 1 GLY H2 1 1 8 4695 1 1 1 GLY H3 H -12.329 -3.456 -6.615 1.00 . A A . 1 GLY H3 1 1 8 4696 1 1 1 GLY HA2 H -12.404 -3.704 -4.219 1.00 . A A . 1 GLY HA2 1 1 8 4697 1 1 1 GLY HA3 H -11.335 -2.393 -4.699 1.00 . A A . 1 GLY HA3 1 1 8 4698 1 1 1 GLY N N -12.897 -2.791 -6.045 1.00 . A A . 1 GLY N 1 1 8 4699 1 1 1 GLY O O -13.892 -0.927 -4.314 1.00 . A A . 1 GLY O 1 1 8 4700 1 1 2 SER C C -12.744 -0.323 -0.623 1.00 . A A . 2 SER C 1 1 8 4701 1 1 2 SER CA C -13.723 -1.030 -1.555 1.00 . A A . 2 SER CA 1 1 8 4702 1 1 2 SER CB C -14.730 -1.857 -0.749 1.00 . A A . 2 SER CB 1 1 8 4703 1 1 2 SER H H -12.392 -2.566 -2.134 1.00 . A A . 2 SER H 1 1 8 4704 1 1 2 SER HA H -14.257 -0.287 -2.130 1.00 . A A . 2 SER HA 1 1 8 4705 1 1 2 SER HB2 H -14.201 -2.584 -0.151 1.00 . A A . 2 SER HB2 1 1 8 4706 1 1 2 SER HB3 H -15.295 -1.200 -0.103 1.00 . A A . 2 SER HB3 1 1 8 4707 1 1 2 SER HG H -15.467 -3.496 -1.550 1.00 . A A . 2 SER HG 1 1 8 4708 1 1 2 SER N N -13.004 -1.885 -2.487 1.00 . A A . 2 SER N 1 1 8 4709 1 1 2 SER O O -12.617 -0.684 0.549 1.00 . A A . 2 SER O 1 1 8 4710 1 1 2 SER OG O -15.632 -2.540 -1.607 1.00 . A A . 2 SER OG 1 1 8 4711 1 1 3 ALA C C -10.021 0.521 0.219 1.00 . A A . 3 ALA C 1 1 8 4712 1 1 3 ALA CA C -11.048 1.442 -0.429 1.00 . A A . 3 ALA CA 1 1 8 4713 1 1 3 ALA CB C -11.701 2.343 0.609 1.00 . A A . 3 ALA CB 1 1 8 4714 1 1 3 ALA H H -12.243 0.928 -2.100 1.00 . A A . 3 ALA H 1 1 8 4715 1 1 3 ALA HA H -10.537 2.076 -1.140 1.00 . A A . 3 ALA HA 1 1 8 4716 1 1 3 ALA HB1 H -12.225 1.736 1.332 1.00 . A A . 3 ALA HB1 1 1 8 4717 1 1 3 ALA HB2 H -12.400 3.005 0.120 1.00 . A A . 3 ALA HB2 1 1 8 4718 1 1 3 ALA HB3 H -10.941 2.925 1.108 1.00 . A A . 3 ALA HB3 1 1 8 4719 1 1 3 ALA N N -12.057 0.681 -1.164 1.00 . A A . 3 ALA N 1 1 8 4720 1 1 3 ALA O O -9.752 0.610 1.418 1.00 . A A . 3 ALA O 1 1 8 4721 1 1 4 THR C C -7.079 -0.634 -0.160 1.00 . A A . 4 THR C 1 1 8 4722 1 1 4 THR CA C -8.436 -1.292 -0.107 1.00 . A A . 4 THR CA 1 1 8 4723 1 1 4 THR CB C -8.461 -2.593 -0.935 1.00 . A A . 4 THR CB 1 1 8 4724 1 1 4 THR CG2 C -7.799 -3.739 -0.185 1.00 . A A . 4 THR CG2 1 1 8 4725 1 1 4 THR H H -9.746 -0.417 -1.523 1.00 . A A . 4 THR H 1 1 8 4726 1 1 4 THR HA H -8.637 -1.515 0.891 1.00 . A A . 4 THR HA 1 1 8 4727 1 1 4 THR HB H -7.930 -2.428 -1.862 1.00 . A A . 4 THR HB 1 1 8 4728 1 1 4 THR HG1 H -10.129 -3.591 -0.568 1.00 . A A . 4 THR HG1 1 1 8 4729 1 1 4 THR HG21 H -6.783 -3.469 0.061 1.00 . A A . 4 THR HG21 1 1 8 4730 1 1 4 THR HG22 H -7.798 -4.623 -0.805 1.00 . A A . 4 THR HG22 1 1 8 4731 1 1 4 THR HG23 H -8.349 -3.939 0.723 1.00 . A A . 4 THR HG23 1 1 8 4732 1 1 4 THR N N -9.456 -0.369 -0.583 1.00 . A A . 4 THR N 1 1 8 4733 1 1 4 THR O O -6.143 -0.991 0.542 1.00 . A A . 4 THR O 1 1 8 4734 1 1 4 THR OG1 O -9.823 -2.947 -1.223 1.00 . A A . 4 THR OG1 1 1 8 4735 1 1 5 PHE C C -6.080 2.661 -1.214 1.00 . A A . 5 PHE C 1 1 8 4736 1 1 5 PHE CA C -5.834 1.137 -1.302 1.00 . A A . 5 PHE CA 1 1 8 4737 1 1 5 PHE CB C -5.590 0.806 -2.726 1.00 . A A . 5 PHE CB 1 1 8 4738 1 1 5 PHE CD1 C -5.032 -1.440 -2.130 1.00 . A A . 5 PHE CD1 1 1 8 4739 1 1 5 PHE CD2 C -6.502 -1.205 -3.936 1.00 . A A . 5 PHE CD2 1 1 8 4740 1 1 5 PHE CE1 C -5.130 -2.744 -2.189 1.00 . A A . 5 PHE CE1 1 1 8 4741 1 1 5 PHE CE2 C -6.591 -2.584 -4.013 1.00 . A A . 5 PHE CE2 1 1 8 4742 1 1 5 PHE CG C -5.696 -0.640 -2.963 1.00 . A A . 5 PHE CG 1 1 8 4743 1 1 5 PHE CZ C -5.884 -3.342 -3.095 1.00 . A A . 5 PHE CZ 1 1 8 4744 1 1 5 PHE H H -7.845 0.609 -1.396 1.00 . A A . 5 PHE H 1 1 8 4745 1 1 5 PHE HA H -5.005 0.816 -0.691 1.00 . A A . 5 PHE HA 1 1 8 4746 1 1 5 PHE HB2 H -6.368 1.277 -3.235 1.00 . A A . 5 PHE HB2 1 1 8 4747 1 1 5 PHE HB3 H -4.625 1.153 -3.051 1.00 . A A . 5 PHE HB3 1 1 8 4748 1 1 5 PHE HD1 H -4.430 -1.017 -1.368 1.00 . A A . 5 PHE HD1 1 1 8 4749 1 1 5 PHE HD2 H -7.038 -0.575 -4.632 1.00 . A A . 5 PHE HD2 1 1 8 4750 1 1 5 PHE HE1 H -4.586 -3.312 -1.506 1.00 . A A . 5 PHE HE1 1 1 8 4751 1 1 5 PHE HE2 H -7.213 -3.058 -4.759 1.00 . A A . 5 PHE HE2 1 1 8 4752 1 1 5 PHE HZ H -5.931 -4.399 -3.060 1.00 . A A . 5 PHE HZ 1 1 8 4753 1 1 5 PHE N N -7.036 0.375 -0.979 1.00 . A A . 5 PHE N 1 1 8 4754 1 1 5 PHE O O -5.730 3.412 -2.124 1.00 . A A . 5 PHE O 1 1 8 4755 1 1 6 PRO C C -5.963 5.439 0.418 1.00 . A A . 6 PRO C 1 1 8 4756 1 1 6 PRO CA C -7.101 4.478 0.121 1.00 . A A . 6 PRO CA 1 1 8 4757 1 1 6 PRO CB C -8.006 4.339 1.326 1.00 . A A . 6 PRO CB 1 1 8 4758 1 1 6 PRO CD C -7.053 2.249 0.959 1.00 . A A . 6 PRO CD 1 1 8 4759 1 1 6 PRO CG C -7.498 3.185 2.027 1.00 . A A . 6 PRO CG 1 1 8 4760 1 1 6 PRO HA H -7.683 4.843 -0.686 1.00 . A A . 6 PRO HA 1 1 8 4761 1 1 6 PRO HB2 H -7.974 5.229 1.934 1.00 . A A . 6 PRO HB2 1 1 8 4762 1 1 6 PRO HB3 H -8.994 4.147 1.005 1.00 . A A . 6 PRO HB3 1 1 8 4763 1 1 6 PRO HD2 H -6.221 1.681 1.255 1.00 . A A . 6 PRO HD2 1 1 8 4764 1 1 6 PRO HD3 H -7.849 1.595 0.623 1.00 . A A . 6 PRO HD3 1 1 8 4765 1 1 6 PRO HG2 H -6.685 3.476 2.649 1.00 . A A . 6 PRO HG2 1 1 8 4766 1 1 6 PRO HG3 H -8.290 2.755 2.589 1.00 . A A . 6 PRO HG3 1 1 8 4767 1 1 6 PRO N N -6.680 3.103 -0.119 1.00 . A A . 6 PRO N 1 1 8 4768 1 1 6 PRO O O -4.844 5.019 0.702 1.00 . A A . 6 PRO O 1 1 8 4769 1 1 7 GLU C C -4.507 7.628 1.837 1.00 . A A . 7 GLU C 1 1 8 4770 1 1 7 GLU CA C -5.306 7.793 0.550 1.00 . A A . 7 GLU CA 1 1 8 4771 1 1 7 GLU CB C -6.002 9.156 0.556 1.00 . A A . 7 GLU CB 1 1 8 4772 1 1 7 GLU CD C -8.399 8.677 -0.051 1.00 . A A . 7 GLU CD 1 1 8 4773 1 1 7 GLU CG C -7.093 9.311 -0.483 1.00 . A A . 7 GLU CG 1 1 8 4774 1 1 7 GLU H H -7.215 6.970 0.243 1.00 . A A . 7 GLU H 1 1 8 4775 1 1 7 GLU HA H -4.624 7.750 -0.285 1.00 . A A . 7 GLU HA 1 1 8 4776 1 1 7 GLU HB2 H -6.445 9.312 1.519 1.00 . A A . 7 GLU HB2 1 1 8 4777 1 1 7 GLU HB3 H -5.265 9.918 0.382 1.00 . A A . 7 GLU HB3 1 1 8 4778 1 1 7 GLU HG2 H -7.260 10.362 -0.662 1.00 . A A . 7 GLU HG2 1 1 8 4779 1 1 7 GLU HG3 H -6.766 8.839 -1.389 1.00 . A A . 7 GLU HG3 1 1 8 4780 1 1 7 GLU N N -6.279 6.724 0.382 1.00 . A A . 7 GLU N 1 1 8 4781 1 1 7 GLU O O -3.318 7.918 1.866 1.00 . A A . 7 GLU O 1 1 8 4782 1 1 7 GLU OE1 O -9.112 9.270 0.787 1.00 . A A . 7 GLU OE1 1 1 8 4783 1 1 7 GLU OE2 O -8.728 7.589 -0.556 1.00 . A A . 7 GLU OE2 1 1 8 4784 1 1 8 GLN C C -3.236 6.045 3.935 1.00 . A A . 8 GLN C 1 1 8 4785 1 1 8 GLN CA C -4.495 6.886 4.159 1.00 . A A . 8 GLN CA 1 1 8 4786 1 1 8 GLN CB C -5.455 6.136 5.084 1.00 . A A . 8 GLN CB 1 1 8 4787 1 1 8 GLN CD C -5.678 4.703 7.168 1.00 . A A . 8 GLN CD 1 1 8 4788 1 1 8 GLN CG C -4.777 5.575 6.311 1.00 . A A . 8 GLN CG 1 1 8 4789 1 1 8 GLN H H -6.149 7.088 2.849 1.00 . A A . 8 GLN H 1 1 8 4790 1 1 8 GLN HA H -4.217 7.820 4.621 1.00 . A A . 8 GLN HA 1 1 8 4791 1 1 8 GLN HB2 H -6.231 6.814 5.404 1.00 . A A . 8 GLN HB2 1 1 8 4792 1 1 8 GLN HB3 H -5.900 5.320 4.543 1.00 . A A . 8 GLN HB3 1 1 8 4793 1 1 8 GLN HE21 H -7.305 5.719 6.623 1.00 . A A . 8 GLN HE21 1 1 8 4794 1 1 8 GLN HE22 H -7.565 4.400 7.709 1.00 . A A . 8 GLN HE22 1 1 8 4795 1 1 8 GLN HG2 H -3.935 4.978 5.992 1.00 . A A . 8 GLN HG2 1 1 8 4796 1 1 8 GLN HG3 H -4.422 6.392 6.898 1.00 . A A . 8 GLN HG3 1 1 8 4797 1 1 8 GLN N N -5.168 7.185 2.898 1.00 . A A . 8 GLN N 1 1 8 4798 1 1 8 GLN NE2 N -6.977 4.971 7.168 1.00 . A A . 8 GLN NE2 1 1 8 4799 1 1 8 GLN O O -2.120 6.469 4.234 1.00 . A A . 8 GLN O 1 1 8 4800 1 1 8 GLN OE1 O -5.200 3.786 7.832 1.00 . A A . 8 GLN OE1 1 1 8 4801 1 1 9 THR C C -1.538 4.400 1.975 1.00 . A A . 9 THR C 1 1 8 4802 1 1 9 THR CA C -2.390 3.921 3.124 1.00 . A A . 9 THR CA 1 1 8 4803 1 1 9 THR CB C -2.983 2.546 2.813 1.00 . A A . 9 THR CB 1 1 8 4804 1 1 9 THR CG2 C -3.652 1.963 4.045 1.00 . A A . 9 THR CG2 1 1 8 4805 1 1 9 THR H H -4.332 4.573 3.237 1.00 . A A . 9 THR H 1 1 8 4806 1 1 9 THR HA H -1.783 3.840 3.984 1.00 . A A . 9 THR HA 1 1 8 4807 1 1 9 THR HB H -2.191 1.904 2.511 1.00 . A A . 9 THR HB 1 1 8 4808 1 1 9 THR HG1 H -3.575 3.132 1.017 1.00 . A A . 9 THR HG1 1 1 8 4809 1 1 9 THR HG21 H -4.057 0.991 3.810 1.00 . A A . 9 THR HG21 1 1 8 4810 1 1 9 THR HG22 H -4.450 2.620 4.360 1.00 . A A . 9 THR HG22 1 1 8 4811 1 1 9 THR HG23 H -2.927 1.871 4.838 1.00 . A A . 9 THR HG23 1 1 8 4812 1 1 9 THR N N -3.440 4.850 3.419 1.00 . A A . 9 THR N 1 1 8 4813 1 1 9 THR O O -0.330 4.180 1.942 1.00 . A A . 9 THR O 1 1 8 4814 1 1 9 THR OG1 O -3.948 2.642 1.757 1.00 . A A . 9 THR OG1 1 1 8 4815 1 1 10 ILE C C -0.428 6.541 0.416 1.00 . A A . 10 ILE C 1 1 8 4816 1 1 10 ILE CA C -1.550 5.683 -0.080 1.00 . A A . 10 ILE CA 1 1 8 4817 1 1 10 ILE CB C -2.548 6.582 -0.865 1.00 . A A . 10 ILE CB 1 1 8 4818 1 1 10 ILE CD1 C -2.652 5.128 -2.925 1.00 . A A . 10 ILE CD1 1 1 8 4819 1 1 10 ILE CG1 C -3.421 5.761 -1.802 1.00 . A A . 10 ILE CG1 1 1 8 4820 1 1 10 ILE CG2 C -1.822 7.654 -1.648 1.00 . A A . 10 ILE CG2 1 1 8 4821 1 1 10 ILE H H -3.153 5.123 1.132 1.00 . A A . 10 ILE H 1 1 8 4822 1 1 10 ILE HA H -1.171 4.926 -0.732 1.00 . A A . 10 ILE HA 1 1 8 4823 1 1 10 ILE HB H -3.183 7.075 -0.144 1.00 . A A . 10 ILE HB 1 1 8 4824 1 1 10 ILE HD11 H -3.325 4.558 -3.546 1.00 . A A . 10 ILE HD11 1 1 8 4825 1 1 10 ILE HD12 H -1.903 4.471 -2.507 1.00 . A A . 10 ILE HD12 1 1 8 4826 1 1 10 ILE HD13 H -2.173 5.895 -3.515 1.00 . A A . 10 ILE HD13 1 1 8 4827 1 1 10 ILE HG12 H -3.896 4.974 -1.240 1.00 . A A . 10 ILE HG12 1 1 8 4828 1 1 10 ILE HG13 H -4.178 6.399 -2.233 1.00 . A A . 10 ILE HG13 1 1 8 4829 1 1 10 ILE HG21 H -1.257 8.268 -0.965 1.00 . A A . 10 ILE HG21 1 1 8 4830 1 1 10 ILE HG22 H -2.541 8.261 -2.172 1.00 . A A . 10 ILE HG22 1 1 8 4831 1 1 10 ILE HG23 H -1.155 7.187 -2.353 1.00 . A A . 10 ILE HG23 1 1 8 4832 1 1 10 ILE N N -2.195 5.067 1.053 1.00 . A A . 10 ILE N 1 1 8 4833 1 1 10 ILE O O 0.726 6.305 0.124 1.00 . A A . 10 ILE O 1 1 8 4834 1 1 11 LYS C C 1.253 7.802 2.552 1.00 . A A . 11 LYS C 1 1 8 4835 1 1 11 LYS CA C 0.213 8.419 1.677 1.00 . A A . 11 LYS CA 1 1 8 4836 1 1 11 LYS CB C -0.454 9.591 2.361 1.00 . A A . 11 LYS CB 1 1 8 4837 1 1 11 LYS CD C -2.277 11.282 2.297 1.00 . A A . 11 LYS CD 1 1 8 4838 1 1 11 LYS CE C -3.075 12.233 1.428 1.00 . A A . 11 LYS CE 1 1 8 4839 1 1 11 LYS CG C -1.438 10.321 1.477 1.00 . A A . 11 LYS CG 1 1 8 4840 1 1 11 LYS H H -1.677 7.526 1.586 1.00 . A A . 11 LYS H 1 1 8 4841 1 1 11 LYS HA H 0.715 8.751 0.794 1.00 . A A . 11 LYS HA 1 1 8 4842 1 1 11 LYS HB2 H -0.981 9.225 3.223 1.00 . A A . 11 LYS HB2 1 1 8 4843 1 1 11 LYS HB3 H 0.303 10.292 2.680 1.00 . A A . 11 LYS HB3 1 1 8 4844 1 1 11 LYS HD2 H -2.962 10.712 2.906 1.00 . A A . 11 LYS HD2 1 1 8 4845 1 1 11 LYS HD3 H -1.621 11.858 2.937 1.00 . A A . 11 LYS HD3 1 1 8 4846 1 1 11 LYS HE2 H -2.394 12.785 0.797 1.00 . A A . 11 LYS HE2 1 1 8 4847 1 1 11 LYS HE3 H -3.753 11.660 0.813 1.00 . A A . 11 LYS HE3 1 1 8 4848 1 1 11 LYS HG2 H -0.893 10.876 0.727 1.00 . A A . 11 LYS HG2 1 1 8 4849 1 1 11 LYS HG3 H -2.084 9.589 0.998 1.00 . A A . 11 LYS HG3 1 1 8 4850 1 1 11 LYS HZ1 H -4.661 12.700 2.703 1.00 . A A . 11 LYS HZ1 1 1 8 4851 1 1 11 LYS HZ2 H -4.224 13.964 1.658 1.00 . A A . 11 LYS HZ2 1 1 8 4852 1 1 11 LYS HZ3 H -3.250 13.599 2.999 1.00 . A A . 11 LYS HZ3 1 1 8 4853 1 1 11 LYS N N -0.756 7.468 1.252 1.00 . A A . 11 LYS N 1 1 8 4854 1 1 11 LYS NZ N -3.855 13.192 2.253 1.00 . A A . 11 LYS NZ 1 1 8 4855 1 1 11 LYS O O 2.372 8.237 2.517 1.00 . A A . 11 LYS O 1 1 8 4856 1 1 12 GLN C C 2.906 5.400 3.323 1.00 . A A . 12 GLN C 1 1 8 4857 1 1 12 GLN CA C 1.835 6.118 4.152 1.00 . A A . 12 GLN CA 1 1 8 4858 1 1 12 GLN CB C 1.017 5.159 4.984 1.00 . A A . 12 GLN CB 1 1 8 4859 1 1 12 GLN CD C -0.394 4.863 7.031 1.00 . A A . 12 GLN CD 1 1 8 4860 1 1 12 GLN CG C 0.468 5.796 6.217 1.00 . A A . 12 GLN CG 1 1 8 4861 1 1 12 GLN H H -0.034 6.495 3.362 1.00 . A A . 12 GLN H 1 1 8 4862 1 1 12 GLN HA H 2.302 6.839 4.794 1.00 . A A . 12 GLN HA 1 1 8 4863 1 1 12 GLN HB2 H 0.175 4.803 4.391 1.00 . A A . 12 GLN HB2 1 1 8 4864 1 1 12 GLN HB3 H 1.606 4.356 5.260 1.00 . A A . 12 GLN HB3 1 1 8 4865 1 1 12 GLN HE21 H -1.992 5.468 6.033 1.00 . A A . 12 GLN HE21 1 1 8 4866 1 1 12 GLN HE22 H -2.269 4.286 7.261 1.00 . A A . 12 GLN HE22 1 1 8 4867 1 1 12 GLN HG2 H 1.284 6.142 6.822 1.00 . A A . 12 GLN HG2 1 1 8 4868 1 1 12 GLN HG3 H -0.119 6.623 5.910 1.00 . A A . 12 GLN HG3 1 1 8 4869 1 1 12 GLN N N 0.896 6.798 3.326 1.00 . A A . 12 GLN N 1 1 8 4870 1 1 12 GLN NE2 N -1.681 4.868 6.746 1.00 . A A . 12 GLN NE2 1 1 8 4871 1 1 12 GLN O O 4.114 5.427 3.620 1.00 . A A . 12 GLN O 1 1 8 4872 1 1 12 GLN OE1 O 0.090 4.145 7.906 1.00 . A A . 12 GLN OE1 1 1 8 4873 1 1 13 LEU C C 4.055 4.857 0.443 1.00 . A A . 13 LEU C 1 1 8 4874 1 1 13 LEU CA C 3.345 4.006 1.454 1.00 . A A . 13 LEU CA 1 1 8 4875 1 1 13 LEU CB C 2.543 2.924 0.795 1.00 . A A . 13 LEU CB 1 1 8 4876 1 1 13 LEU CD1 C 1.034 0.976 1.074 1.00 . A A . 13 LEU CD1 1 1 8 4877 1 1 13 LEU CD2 C 2.710 1.500 2.842 1.00 . A A . 13 LEU CD2 1 1 8 4878 1 1 13 LEU CG C 1.782 2.075 1.784 1.00 . A A . 13 LEU CG 1 1 8 4879 1 1 13 LEU H H 1.559 4.950 1.949 1.00 . A A . 13 LEU H 1 1 8 4880 1 1 13 LEU HA H 4.060 3.554 2.115 1.00 . A A . 13 LEU HA 1 1 8 4881 1 1 13 LEU HB2 H 1.840 3.379 0.113 1.00 . A A . 13 LEU HB2 1 1 8 4882 1 1 13 LEU HB3 H 3.203 2.300 0.247 1.00 . A A . 13 LEU HB3 1 1 8 4883 1 1 13 LEU HD11 H 0.323 1.412 0.389 1.00 . A A . 13 LEU HD11 1 1 8 4884 1 1 13 LEU HD12 H 0.512 0.367 1.798 1.00 . A A . 13 LEU HD12 1 1 8 4885 1 1 13 LEU HD13 H 1.733 0.362 0.523 1.00 . A A . 13 LEU HD13 1 1 8 4886 1 1 13 LEU HD21 H 2.137 0.911 3.541 1.00 . A A . 13 LEU HD21 1 1 8 4887 1 1 13 LEU HD22 H 3.199 2.308 3.369 1.00 . A A . 13 LEU HD22 1 1 8 4888 1 1 13 LEU HD23 H 3.453 0.877 2.369 1.00 . A A . 13 LEU HD23 1 1 8 4889 1 1 13 LEU HG H 1.074 2.713 2.279 1.00 . A A . 13 LEU HG 1 1 8 4890 1 1 13 LEU N N 2.477 4.815 2.241 1.00 . A A . 13 LEU N 1 1 8 4891 1 1 13 LEU O O 5.263 4.734 0.247 1.00 . A A . 13 LEU O 1 1 8 4892 1 1 14 MET C C 4.827 7.604 -0.274 1.00 . A A . 14 MET C 1 1 8 4893 1 1 14 MET CA C 3.885 6.712 -1.061 1.00 . A A . 14 MET CA 1 1 8 4894 1 1 14 MET CB C 2.761 7.489 -1.672 1.00 . A A . 14 MET CB 1 1 8 4895 1 1 14 MET CE C 2.586 4.018 -2.385 1.00 . A A . 14 MET CE 1 1 8 4896 1 1 14 MET CG C 2.009 6.741 -2.754 1.00 . A A . 14 MET CG 1 1 8 4897 1 1 14 MET H H 2.303 5.755 -0.098 1.00 . A A . 14 MET H 1 1 8 4898 1 1 14 MET HA H 4.426 6.199 -1.839 1.00 . A A . 14 MET HA 1 1 8 4899 1 1 14 MET HB2 H 2.050 7.740 -0.898 1.00 . A A . 14 MET HB2 1 1 8 4900 1 1 14 MET HB3 H 3.162 8.391 -2.098 1.00 . A A . 14 MET HB3 1 1 8 4901 1 1 14 MET HE1 H 3.381 4.358 -1.738 1.00 . A A . 14 MET HE1 1 1 8 4902 1 1 14 MET HE2 H 2.945 3.968 -3.401 1.00 . A A . 14 MET HE2 1 1 8 4903 1 1 14 MET HE3 H 2.254 3.042 -2.069 1.00 . A A . 14 MET HE3 1 1 8 4904 1 1 14 MET HG2 H 1.239 7.375 -3.072 1.00 . A A . 14 MET HG2 1 1 8 4905 1 1 14 MET HG3 H 2.688 6.565 -3.556 1.00 . A A . 14 MET HG3 1 1 8 4906 1 1 14 MET N N 3.307 5.748 -0.193 1.00 . A A . 14 MET N 1 1 8 4907 1 1 14 MET O O 5.760 8.193 -0.819 1.00 . A A . 14 MET O 1 1 8 4908 1 1 14 MET SD S 1.229 5.169 -2.292 1.00 . A A . 14 MET SD 1 1 8 4909 1 1 15 ASP C C 6.818 7.798 1.937 1.00 . A A . 15 ASP C 1 1 8 4910 1 1 15 ASP CA C 5.416 8.357 1.978 1.00 . A A . 15 ASP CA 1 1 8 4911 1 1 15 ASP CB C 4.884 8.173 3.387 1.00 . A A . 15 ASP CB 1 1 8 4912 1 1 15 ASP CG C 5.433 9.189 4.367 1.00 . A A . 15 ASP CG 1 1 8 4913 1 1 15 ASP H H 3.736 7.247 1.351 1.00 . A A . 15 ASP H 1 1 8 4914 1 1 15 ASP HA H 5.435 9.408 1.734 1.00 . A A . 15 ASP HA 1 1 8 4915 1 1 15 ASP HB2 H 3.801 8.245 3.365 1.00 . A A . 15 ASP HB2 1 1 8 4916 1 1 15 ASP HB3 H 5.150 7.183 3.724 1.00 . A A . 15 ASP HB3 1 1 8 4917 1 1 15 ASP N N 4.560 7.670 1.023 1.00 . A A . 15 ASP N 1 1 8 4918 1 1 15 ASP O O 7.786 8.557 1.908 1.00 . A A . 15 ASP O 1 1 8 4919 1 1 15 ASP OD1 O 4.856 10.296 4.470 1.00 . A A . 15 ASP OD1 1 1 8 4920 1 1 15 ASP OD2 O 6.428 8.882 5.058 1.00 . A A . 15 ASP OD2 1 1 8 4921 1 1 16 LEU C C 8.971 6.078 0.594 1.00 . A A . 16 LEU C 1 1 8 4922 1 1 16 LEU CA C 8.256 5.858 1.933 1.00 . A A . 16 LEU CA 1 1 8 4923 1 1 16 LEU CB C 8.105 4.384 2.228 1.00 . A A . 16 LEU CB 1 1 8 4924 1 1 16 LEU CD1 C 6.883 2.570 3.407 1.00 . A A . 16 LEU CD1 1 1 8 4925 1 1 16 LEU CD2 C 7.647 4.571 4.687 1.00 . A A . 16 LEU CD2 1 1 8 4926 1 1 16 LEU CG C 7.139 4.051 3.351 1.00 . A A . 16 LEU CG 1 1 8 4927 1 1 16 LEU H H 6.140 5.859 1.948 1.00 . A A . 16 LEU H 1 1 8 4928 1 1 16 LEU HA H 8.831 6.315 2.721 1.00 . A A . 16 LEU HA 1 1 8 4929 1 1 16 LEU HB2 H 7.766 3.889 1.332 1.00 . A A . 16 LEU HB2 1 1 8 4930 1 1 16 LEU HB3 H 9.062 4.000 2.489 1.00 . A A . 16 LEU HB3 1 1 8 4931 1 1 16 LEU HD11 H 6.368 2.276 2.507 1.00 . A A . 16 LEU HD11 1 1 8 4932 1 1 16 LEU HD12 H 6.271 2.343 4.265 1.00 . A A . 16 LEU HD12 1 1 8 4933 1 1 16 LEU HD13 H 7.822 2.043 3.478 1.00 . A A . 16 LEU HD13 1 1 8 4934 1 1 16 LEU HD21 H 8.599 4.112 4.915 1.00 . A A . 16 LEU HD21 1 1 8 4935 1 1 16 LEU HD22 H 6.937 4.328 5.464 1.00 . A A . 16 LEU HD22 1 1 8 4936 1 1 16 LEU HD23 H 7.768 5.643 4.634 1.00 . A A . 16 LEU HD23 1 1 8 4937 1 1 16 LEU HG H 6.204 4.516 3.134 1.00 . A A . 16 LEU HG 1 1 8 4938 1 1 16 LEU N N 6.945 6.463 1.933 1.00 . A A . 16 LEU N 1 1 8 4939 1 1 16 LEU O O 10.144 5.736 0.440 1.00 . A A . 16 LEU O 1 1 8 4940 1 1 17 GLY C C 8.260 6.100 -2.761 1.00 . A A . 17 GLY C 1 1 8 4941 1 1 17 GLY CA C 8.836 6.968 -1.661 1.00 . A A . 17 GLY CA 1 1 8 4942 1 1 17 GLY H H 7.324 6.909 -0.180 1.00 . A A . 17 GLY H 1 1 8 4943 1 1 17 GLY HA2 H 8.646 8.005 -1.896 1.00 . A A . 17 GLY HA2 1 1 8 4944 1 1 17 GLY HA3 H 9.903 6.808 -1.614 1.00 . A A . 17 GLY HA3 1 1 8 4945 1 1 17 GLY N N 8.257 6.665 -0.364 1.00 . A A . 17 GLY N 1 1 8 4946 1 1 17 GLY O O 8.749 6.101 -3.892 1.00 . A A . 17 GLY O 1 1 8 4947 1 1 18 PHE C C 5.504 4.978 -4.158 1.00 . A A . 18 PHE C 1 1 8 4948 1 1 18 PHE CA C 6.629 4.390 -3.328 1.00 . A A . 18 PHE CA 1 1 8 4949 1 1 18 PHE CB C 6.138 3.238 -2.484 1.00 . A A . 18 PHE CB 1 1 8 4950 1 1 18 PHE CD1 C 8.428 2.271 -2.327 1.00 . A A . 18 PHE CD1 1 1 8 4951 1 1 18 PHE CD2 C 7.090 2.520 -0.411 1.00 . A A . 18 PHE CD2 1 1 8 4952 1 1 18 PHE CE1 C 9.442 1.753 -1.554 1.00 . A A . 18 PHE CE1 1 1 8 4953 1 1 18 PHE CE2 C 8.058 2.027 0.352 1.00 . A A . 18 PHE CE2 1 1 8 4954 1 1 18 PHE CG C 7.239 2.653 -1.730 1.00 . A A . 18 PHE CG 1 1 8 4955 1 1 18 PHE CZ C 9.241 1.635 -0.195 1.00 . A A . 18 PHE CZ 1 1 8 4956 1 1 18 PHE H H 6.804 5.495 -1.540 1.00 . A A . 18 PHE H 1 1 8 4957 1 1 18 PHE HA H 7.411 4.034 -3.974 1.00 . A A . 18 PHE HA 1 1 8 4958 1 1 18 PHE HB2 H 5.412 3.604 -1.776 1.00 . A A . 18 PHE HB2 1 1 8 4959 1 1 18 PHE HB3 H 5.701 2.470 -3.064 1.00 . A A . 18 PHE HB3 1 1 8 4960 1 1 18 PHE HD1 H 8.554 2.375 -3.393 1.00 . A A . 18 PHE HD1 1 1 8 4961 1 1 18 PHE HD2 H 6.175 2.804 0.030 1.00 . A A . 18 PHE HD2 1 1 8 4962 1 1 18 PHE HE1 H 10.375 1.447 -2.001 1.00 . A A . 18 PHE HE1 1 1 8 4963 1 1 18 PHE HE2 H 7.881 1.953 1.389 1.00 . A A . 18 PHE HE2 1 1 8 4964 1 1 18 PHE HZ H 9.996 1.247 0.431 1.00 . A A . 18 PHE HZ 1 1 8 4965 1 1 18 PHE N N 7.205 5.376 -2.429 1.00 . A A . 18 PHE N 1 1 8 4966 1 1 18 PHE O O 4.877 5.956 -3.761 1.00 . A A . 18 PHE O 1 1 8 4967 1 1 19 PRO C C 2.841 4.293 -5.803 1.00 . A A . 19 PRO C 1 1 8 4968 1 1 19 PRO CA C 4.187 4.843 -6.226 1.00 . A A . 19 PRO CA 1 1 8 4969 1 1 19 PRO CB C 4.592 4.224 -7.539 1.00 . A A . 19 PRO CB 1 1 8 4970 1 1 19 PRO CD C 5.974 3.260 -5.925 1.00 . A A . 19 PRO CD 1 1 8 4971 1 1 19 PRO CG C 5.116 2.931 -7.117 1.00 . A A . 19 PRO CG 1 1 8 4972 1 1 19 PRO HA H 4.141 5.917 -6.318 1.00 . A A . 19 PRO HA 1 1 8 4973 1 1 19 PRO HB2 H 3.742 4.126 -8.191 1.00 . A A . 19 PRO HB2 1 1 8 4974 1 1 19 PRO HB3 H 5.362 4.804 -8.002 1.00 . A A . 19 PRO HB3 1 1 8 4975 1 1 19 PRO HD2 H 6.005 2.438 -5.230 1.00 . A A . 19 PRO HD2 1 1 8 4976 1 1 19 PRO HD3 H 6.966 3.541 -6.237 1.00 . A A . 19 PRO HD3 1 1 8 4977 1 1 19 PRO HG2 H 4.307 2.266 -6.846 1.00 . A A . 19 PRO HG2 1 1 8 4978 1 1 19 PRO HG3 H 5.691 2.531 -7.906 1.00 . A A . 19 PRO HG3 1 1 8 4979 1 1 19 PRO N N 5.258 4.410 -5.342 1.00 . A A . 19 PRO N 1 1 8 4980 1 1 19 PRO O O 2.766 3.321 -5.065 1.00 . A A . 19 PRO O 1 1 8 4981 1 1 20 ARG C C 0.202 3.014 -6.204 1.00 . A A . 20 ARG C 1 1 8 4982 1 1 20 ARG CA C 0.435 4.497 -6.008 1.00 . A A . 20 ARG CA 1 1 8 4983 1 1 20 ARG CB C -0.499 5.288 -6.908 1.00 . A A . 20 ARG CB 1 1 8 4984 1 1 20 ARG CD C -2.774 5.605 -7.866 1.00 . A A . 20 ARG CD 1 1 8 4985 1 1 20 ARG CG C -1.910 4.764 -6.947 1.00 . A A . 20 ARG CG 1 1 8 4986 1 1 20 ARG CZ C -4.810 5.074 -9.146 1.00 . A A . 20 ARG CZ 1 1 8 4987 1 1 20 ARG H H 1.964 5.494 -7.066 1.00 . A A . 20 ARG H 1 1 8 4988 1 1 20 ARG HA H 0.256 4.750 -4.968 1.00 . A A . 20 ARG HA 1 1 8 4989 1 1 20 ARG HB2 H -0.521 6.303 -6.572 1.00 . A A . 20 ARG HB2 1 1 8 4990 1 1 20 ARG HB3 H -0.110 5.263 -7.910 1.00 . A A . 20 ARG HB3 1 1 8 4991 1 1 20 ARG HD2 H -2.829 6.604 -7.466 1.00 . A A . 20 ARG HD2 1 1 8 4992 1 1 20 ARG HD3 H -2.310 5.637 -8.840 1.00 . A A . 20 ARG HD3 1 1 8 4993 1 1 20 ARG HE H -4.550 4.691 -7.194 1.00 . A A . 20 ARG HE 1 1 8 4994 1 1 20 ARG HG2 H -1.891 3.749 -7.310 1.00 . A A . 20 ARG HG2 1 1 8 4995 1 1 20 ARG HG3 H -2.312 4.788 -5.956 1.00 . A A . 20 ARG HG3 1 1 8 4996 1 1 20 ARG HH11 H -3.355 6.000 -10.216 1.00 . A A . 20 ARG HH11 1 1 8 4997 1 1 20 ARG HH12 H -4.785 5.590 -11.112 1.00 . A A . 20 ARG HH12 1 1 8 4998 1 1 20 ARG HH21 H -6.450 4.174 -8.362 1.00 . A A . 20 ARG HH21 1 1 8 4999 1 1 20 ARG HH22 H -6.556 4.565 -10.053 1.00 . A A . 20 ARG HH22 1 1 8 5000 1 1 20 ARG N N 1.804 4.854 -6.353 1.00 . A A . 20 ARG N 1 1 8 5001 1 1 20 ARG NE N -4.127 5.073 -8.003 1.00 . A A . 20 ARG NE 1 1 8 5002 1 1 20 ARG NH1 N -4.276 5.600 -10.244 1.00 . A A . 20 ARG NH1 1 1 8 5003 1 1 20 ARG NH2 N -6.036 4.564 -9.190 1.00 . A A . 20 ARG NH2 1 1 8 5004 1 1 20 ARG O O -0.424 2.345 -5.380 1.00 . A A . 20 ARG O 1 1 8 5005 1 1 21 ASP C C 1.176 0.213 -6.540 1.00 . A A . 21 ASP C 1 1 8 5006 1 1 21 ASP CA C 0.604 1.101 -7.640 1.00 . A A . 21 ASP CA 1 1 8 5007 1 1 21 ASP CB C 1.290 0.803 -8.974 1.00 . A A . 21 ASP CB 1 1 8 5008 1 1 21 ASP CG C 0.534 1.381 -10.153 1.00 . A A . 21 ASP CG 1 1 8 5009 1 1 21 ASP H H 1.214 3.123 -7.904 1.00 . A A . 21 ASP H 1 1 8 5010 1 1 21 ASP HA H -0.449 0.885 -7.738 1.00 . A A . 21 ASP HA 1 1 8 5011 1 1 21 ASP HB2 H 2.284 1.229 -8.964 1.00 . A A . 21 ASP HB2 1 1 8 5012 1 1 21 ASP HB3 H 1.362 -0.266 -9.105 1.00 . A A . 21 ASP HB3 1 1 8 5013 1 1 21 ASP N N 0.728 2.513 -7.299 1.00 . A A . 21 ASP N 1 1 8 5014 1 1 21 ASP O O 0.756 -0.930 -6.379 1.00 . A A . 21 ASP O 1 1 8 5015 1 1 21 ASP OD1 O -0.462 0.772 -10.578 1.00 . A A . 21 ASP OD1 1 1 8 5016 1 1 21 ASP OD2 O 0.937 2.451 -10.662 1.00 . A A . 21 ASP OD2 1 1 8 5017 1 1 22 ALA C C 1.735 -0.139 -3.507 1.00 . A A . 22 ALA C 1 1 8 5018 1 1 22 ALA CA C 2.713 0.004 -4.667 1.00 . A A . 22 ALA CA 1 1 8 5019 1 1 22 ALA CB C 4.005 0.656 -4.201 1.00 . A A . 22 ALA CB 1 1 8 5020 1 1 22 ALA H H 2.388 1.681 -5.914 1.00 . A A . 22 ALA H 1 1 8 5021 1 1 22 ALA HA H 2.953 -0.982 -5.039 1.00 . A A . 22 ALA HA 1 1 8 5022 1 1 22 ALA HB1 H 4.687 0.740 -5.034 1.00 . A A . 22 ALA HB1 1 1 8 5023 1 1 22 ALA HB2 H 4.454 0.051 -3.427 1.00 . A A . 22 ALA HB2 1 1 8 5024 1 1 22 ALA HB3 H 3.791 1.641 -3.810 1.00 . A A . 22 ALA HB3 1 1 8 5025 1 1 22 ALA N N 2.110 0.751 -5.762 1.00 . A A . 22 ALA N 1 1 8 5026 1 1 22 ALA O O 1.771 -1.141 -2.791 1.00 . A A . 22 ALA O 1 1 8 5027 1 1 23 VAL C C -1.071 -0.416 -2.704 1.00 . A A . 23 VAL C 1 1 8 5028 1 1 23 VAL CA C -0.189 0.742 -2.319 1.00 . A A . 23 VAL CA 1 1 8 5029 1 1 23 VAL CB C -1.020 2.050 -2.200 1.00 . A A . 23 VAL CB 1 1 8 5030 1 1 23 VAL CG1 C -2.313 1.987 -2.963 1.00 . A A . 23 VAL CG1 1 1 8 5031 1 1 23 VAL CG2 C -1.317 2.368 -0.765 1.00 . A A . 23 VAL CG2 1 1 8 5032 1 1 23 VAL H H 0.897 1.662 -3.874 1.00 . A A . 23 VAL H 1 1 8 5033 1 1 23 VAL HA H 0.255 0.536 -1.372 1.00 . A A . 23 VAL HA 1 1 8 5034 1 1 23 VAL HB H -0.434 2.852 -2.611 1.00 . A A . 23 VAL HB 1 1 8 5035 1 1 23 VAL HG11 H -2.883 2.890 -2.794 1.00 . A A . 23 VAL HG11 1 1 8 5036 1 1 23 VAL HG12 H -2.872 1.131 -2.619 1.00 . A A . 23 VAL HG12 1 1 8 5037 1 1 23 VAL HG13 H -2.090 1.881 -4.010 1.00 . A A . 23 VAL HG13 1 1 8 5038 1 1 23 VAL HG21 H -0.410 2.695 -0.276 1.00 . A A . 23 VAL HG21 1 1 8 5039 1 1 23 VAL HG22 H -1.701 1.484 -0.278 1.00 . A A . 23 VAL HG22 1 1 8 5040 1 1 23 VAL HG23 H -2.062 3.149 -0.724 1.00 . A A . 23 VAL HG23 1 1 8 5041 1 1 23 VAL N N 0.855 0.852 -3.320 1.00 . A A . 23 VAL N 1 1 8 5042 1 1 23 VAL O O -1.340 -1.317 -1.937 1.00 . A A . 23 VAL O 1 1 8 5043 1 1 24 VAL C C -1.783 -2.795 -4.360 1.00 . A A . 24 VAL C 1 1 8 5044 1 1 24 VAL CA C -2.362 -1.399 -4.428 1.00 . A A . 24 VAL CA 1 1 8 5045 1 1 24 VAL CB C -2.801 -1.056 -5.848 1.00 . A A . 24 VAL CB 1 1 8 5046 1 1 24 VAL CG1 C -3.492 -2.246 -6.490 1.00 . A A . 24 VAL CG1 1 1 8 5047 1 1 24 VAL CG2 C -3.720 0.152 -5.827 1.00 . A A . 24 VAL CG2 1 1 8 5048 1 1 24 VAL H H -1.130 0.313 -4.523 1.00 . A A . 24 VAL H 1 1 8 5049 1 1 24 VAL HA H -3.227 -1.377 -3.784 1.00 . A A . 24 VAL HA 1 1 8 5050 1 1 24 VAL HB H -1.914 -0.797 -6.418 1.00 . A A . 24 VAL HB 1 1 8 5051 1 1 24 VAL HG11 H -3.862 -1.968 -7.464 1.00 . A A . 24 VAL HG11 1 1 8 5052 1 1 24 VAL HG12 H -4.315 -2.562 -5.862 1.00 . A A . 24 VAL HG12 1 1 8 5053 1 1 24 VAL HG13 H -2.786 -3.058 -6.589 1.00 . A A . 24 VAL HG13 1 1 8 5054 1 1 24 VAL HG21 H -4.545 -0.041 -5.153 1.00 . A A . 24 VAL HG21 1 1 8 5055 1 1 24 VAL HG22 H -4.096 0.337 -6.820 1.00 . A A . 24 VAL HG22 1 1 8 5056 1 1 24 VAL HG23 H -3.169 1.014 -5.481 1.00 . A A . 24 VAL HG23 1 1 8 5057 1 1 24 VAL N N -1.446 -0.416 -3.938 1.00 . A A . 24 VAL N 1 1 8 5058 1 1 24 VAL O O -2.447 -3.704 -3.874 1.00 . A A . 24 VAL O 1 1 8 5059 1 1 25 LYS C C 0.067 -4.812 -3.365 1.00 . A A . 25 LYS C 1 1 8 5060 1 1 25 LYS CA C 0.066 -4.268 -4.775 1.00 . A A . 25 LYS CA 1 1 8 5061 1 1 25 LYS CB C 1.498 -4.195 -5.298 1.00 . A A . 25 LYS CB 1 1 8 5062 1 1 25 LYS CD C 3.034 -3.510 -7.144 1.00 . A A . 25 LYS CD 1 1 8 5063 1 1 25 LYS CE C 3.145 -3.065 -8.591 1.00 . A A . 25 LYS CE 1 1 8 5064 1 1 25 LYS CG C 1.597 -3.797 -6.756 1.00 . A A . 25 LYS CG 1 1 8 5065 1 1 25 LYS H H -0.032 -2.187 -5.103 1.00 . A A . 25 LYS H 1 1 8 5066 1 1 25 LYS HA H -0.517 -4.922 -5.408 1.00 . A A . 25 LYS HA 1 1 8 5067 1 1 25 LYS HB2 H 2.045 -3.472 -4.712 1.00 . A A . 25 LYS HB2 1 1 8 5068 1 1 25 LYS HB3 H 1.961 -5.164 -5.180 1.00 . A A . 25 LYS HB3 1 1 8 5069 1 1 25 LYS HD2 H 3.416 -2.726 -6.506 1.00 . A A . 25 LYS HD2 1 1 8 5070 1 1 25 LYS HD3 H 3.620 -4.406 -7.006 1.00 . A A . 25 LYS HD3 1 1 8 5071 1 1 25 LYS HE2 H 2.728 -3.836 -9.223 1.00 . A A . 25 LYS HE2 1 1 8 5072 1 1 25 LYS HE3 H 2.582 -2.153 -8.718 1.00 . A A . 25 LYS HE3 1 1 8 5073 1 1 25 LYS HG2 H 1.222 -4.605 -7.367 1.00 . A A . 25 LYS HG2 1 1 8 5074 1 1 25 LYS HG3 H 1.001 -2.910 -6.920 1.00 . A A . 25 LYS HG3 1 1 8 5075 1 1 25 LYS HZ1 H 5.130 -3.676 -8.807 1.00 . A A . 25 LYS HZ1 1 1 8 5076 1 1 25 LYS HZ2 H 4.957 -2.025 -8.452 1.00 . A A . 25 LYS HZ2 1 1 8 5077 1 1 25 LYS HZ3 H 4.607 -2.600 -10.010 1.00 . A A . 25 LYS HZ3 1 1 8 5078 1 1 25 LYS N N -0.548 -2.961 -4.791 1.00 . A A . 25 LYS N 1 1 8 5079 1 1 25 LYS NZ N 4.557 -2.824 -8.992 1.00 . A A . 25 LYS NZ 1 1 8 5080 1 1 25 LYS O O -0.347 -5.940 -3.121 1.00 . A A . 25 LYS O 1 1 8 5081 1 1 26 ALA C C -0.495 -4.615 -0.299 1.00 . A A . 26 ALA C 1 1 8 5082 1 1 26 ALA CA C 0.761 -4.419 -1.099 1.00 . A A . 26 ALA CA 1 1 8 5083 1 1 26 ALA CB C 1.677 -3.422 -0.425 1.00 . A A . 26 ALA CB 1 1 8 5084 1 1 26 ALA H H 0.428 -2.988 -2.609 1.00 . A A . 26 ALA H 1 1 8 5085 1 1 26 ALA HA H 1.276 -5.365 -1.178 1.00 . A A . 26 ALA HA 1 1 8 5086 1 1 26 ALA HB1 H 1.907 -3.760 0.575 1.00 . A A . 26 ALA HB1 1 1 8 5087 1 1 26 ALA HB2 H 1.184 -2.460 -0.378 1.00 . A A . 26 ALA HB2 1 1 8 5088 1 1 26 ALA HB3 H 2.589 -3.330 -0.994 1.00 . A A . 26 ALA HB3 1 1 8 5089 1 1 26 ALA N N 0.444 -3.962 -2.426 1.00 . A A . 26 ALA N 1 1 8 5090 1 1 26 ALA O O -0.592 -5.514 0.534 1.00 . A A . 26 ALA O 1 1 8 5091 1 1 27 LEU C C -3.546 -4.893 -0.372 1.00 . A A . 27 LEU C 1 1 8 5092 1 1 27 LEU CA C -2.674 -3.777 0.189 1.00 . A A . 27 LEU CA 1 1 8 5093 1 1 27 LEU CB C -3.336 -2.400 0.121 1.00 . A A . 27 LEU CB 1 1 8 5094 1 1 27 LEU CD1 C -3.069 -1.100 2.231 1.00 . A A . 27 LEU CD1 1 1 8 5095 1 1 27 LEU CD2 C -1.161 -1.414 0.778 1.00 . A A . 27 LEU CD2 1 1 8 5096 1 1 27 LEU CG C -2.624 -1.234 0.812 1.00 . A A . 27 LEU CG 1 1 8 5097 1 1 27 LEU H H -1.319 -3.041 -1.217 1.00 . A A . 27 LEU H 1 1 8 5098 1 1 27 LEU HA H -2.438 -4.001 1.218 1.00 . A A . 27 LEU HA 1 1 8 5099 1 1 27 LEU HB2 H -3.418 -2.137 -0.915 1.00 . A A . 27 LEU HB2 1 1 8 5100 1 1 27 LEU HB3 H -4.331 -2.482 0.533 1.00 . A A . 27 LEU HB3 1 1 8 5101 1 1 27 LEU HD11 H -2.815 -2.004 2.760 1.00 . A A . 27 LEU HD11 1 1 8 5102 1 1 27 LEU HD12 H -4.135 -0.951 2.253 1.00 . A A . 27 LEU HD12 1 1 8 5103 1 1 27 LEU HD13 H -2.571 -0.260 2.688 1.00 . A A . 27 LEU HD13 1 1 8 5104 1 1 27 LEU HD21 H -0.671 -0.547 1.189 1.00 . A A . 27 LEU HD21 1 1 8 5105 1 1 27 LEU HD22 H -0.862 -1.554 -0.250 1.00 . A A . 27 LEU HD22 1 1 8 5106 1 1 27 LEU HD23 H -0.903 -2.293 1.351 1.00 . A A . 27 LEU HD23 1 1 8 5107 1 1 27 LEU HG H -2.834 -0.326 0.288 1.00 . A A . 27 LEU HG 1 1 8 5108 1 1 27 LEU N N -1.449 -3.752 -0.538 1.00 . A A . 27 LEU N 1 1 8 5109 1 1 27 LEU O O -4.359 -5.453 0.325 1.00 . A A . 27 LEU O 1 1 8 5110 1 1 28 LYS C C -3.476 -7.643 -1.434 1.00 . A A . 28 LYS C 1 1 8 5111 1 1 28 LYS CA C -3.951 -6.420 -2.221 1.00 . A A . 28 LYS CA 1 1 8 5112 1 1 28 LYS CB C -3.589 -6.596 -3.709 1.00 . A A . 28 LYS CB 1 1 8 5113 1 1 28 LYS CD C -5.816 -6.176 -4.611 1.00 . A A . 28 LYS CD 1 1 8 5114 1 1 28 LYS CE C -6.112 -7.352 -5.525 1.00 . A A . 28 LYS CE 1 1 8 5115 1 1 28 LYS CG C -4.391 -5.750 -4.672 1.00 . A A . 28 LYS CG 1 1 8 5116 1 1 28 LYS H H -2.938 -4.562 -2.244 1.00 . A A . 28 LYS H 1 1 8 5117 1 1 28 LYS HA H -5.018 -6.347 -2.117 1.00 . A A . 28 LYS HA 1 1 8 5118 1 1 28 LYS HB2 H -2.580 -6.339 -3.834 1.00 . A A . 28 LYS HB2 1 1 8 5119 1 1 28 LYS HB3 H -3.723 -7.632 -3.980 1.00 . A A . 28 LYS HB3 1 1 8 5120 1 1 28 LYS HD2 H -5.981 -6.476 -3.602 1.00 . A A . 28 LYS HD2 1 1 8 5121 1 1 28 LYS HD3 H -6.457 -5.345 -4.865 1.00 . A A . 28 LYS HD3 1 1 8 5122 1 1 28 LYS HE2 H -5.971 -7.042 -6.549 1.00 . A A . 28 LYS HE2 1 1 8 5123 1 1 28 LYS HE3 H -5.428 -8.155 -5.294 1.00 . A A . 28 LYS HE3 1 1 8 5124 1 1 28 LYS HG2 H -4.318 -4.708 -4.382 1.00 . A A . 28 LYS HG2 1 1 8 5125 1 1 28 LYS HG3 H -4.016 -5.888 -5.676 1.00 . A A . 28 LYS HG3 1 1 8 5126 1 1 28 LYS HZ1 H -7.625 -8.245 -4.395 1.00 . A A . 28 LYS HZ1 1 1 8 5127 1 1 28 LYS HZ2 H -7.727 -8.568 -6.056 1.00 . A A . 28 LYS HZ2 1 1 8 5128 1 1 28 LYS HZ3 H -8.178 -7.047 -5.458 1.00 . A A . 28 LYS HZ3 1 1 8 5129 1 1 28 LYS N N -3.389 -5.196 -1.657 1.00 . A A . 28 LYS N 1 1 8 5130 1 1 28 LYS NZ N -7.506 -7.837 -5.350 1.00 . A A . 28 LYS NZ 1 1 8 5131 1 1 28 LYS O O -4.269 -8.541 -1.150 1.00 . A A . 28 LYS O 1 1 8 5132 1 1 29 GLN C C -2.408 -8.766 1.097 1.00 . A A . 29 GLN C 1 1 8 5133 1 1 29 GLN CA C -1.665 -8.733 -0.229 1.00 . A A . 29 GLN CA 1 1 8 5134 1 1 29 GLN CB C -0.204 -8.461 0.089 1.00 . A A . 29 GLN CB 1 1 8 5135 1 1 29 GLN CD C 0.942 -8.440 -2.144 1.00 . A A . 29 GLN CD 1 1 8 5136 1 1 29 GLN CG C 0.811 -9.111 -0.805 1.00 . A A . 29 GLN CG 1 1 8 5137 1 1 29 GLN H H -1.562 -6.973 -1.391 1.00 . A A . 29 GLN H 1 1 8 5138 1 1 29 GLN HA H -1.762 -9.680 -0.734 1.00 . A A . 29 GLN HA 1 1 8 5139 1 1 29 GLN HB2 H -0.042 -7.407 0.025 1.00 . A A . 29 GLN HB2 1 1 8 5140 1 1 29 GLN HB3 H -0.016 -8.771 1.095 1.00 . A A . 29 GLN HB3 1 1 8 5141 1 1 29 GLN HE21 H 2.157 -7.086 -1.339 1.00 . A A . 29 GLN HE21 1 1 8 5142 1 1 29 GLN HE22 H 1.852 -6.920 -3.039 1.00 . A A . 29 GLN HE22 1 1 8 5143 1 1 29 GLN HG2 H 1.772 -9.060 -0.310 1.00 . A A . 29 GLN HG2 1 1 8 5144 1 1 29 GLN HG3 H 0.529 -10.133 -0.949 1.00 . A A . 29 GLN HG3 1 1 8 5145 1 1 29 GLN N N -2.185 -7.677 -1.078 1.00 . A A . 29 GLN N 1 1 8 5146 1 1 29 GLN NE2 N 1.727 -7.375 -2.177 1.00 . A A . 29 GLN NE2 1 1 8 5147 1 1 29 GLN O O -2.914 -9.797 1.541 1.00 . A A . 29 GLN O 1 1 8 5148 1 1 29 GLN OE1 O 0.320 -8.844 -3.128 1.00 . A A . 29 GLN OE1 1 1 8 5149 1 1 30 THR C C -4.285 -7.060 3.279 1.00 . A A . 30 THR C 1 1 8 5150 1 1 30 THR CA C -2.825 -7.446 3.091 1.00 . A A . 30 THR CA 1 1 8 5151 1 1 30 THR CB C -1.945 -6.353 3.678 1.00 . A A . 30 THR CB 1 1 8 5152 1 1 30 THR CG2 C -0.485 -6.766 3.646 1.00 . A A . 30 THR CG2 1 1 8 5153 1 1 30 THR H H -2.213 -6.796 1.208 1.00 . A A . 30 THR H 1 1 8 5154 1 1 30 THR HA H -2.621 -8.368 3.612 1.00 . A A . 30 THR HA 1 1 8 5155 1 1 30 THR HB H -2.243 -6.178 4.690 1.00 . A A . 30 THR HB 1 1 8 5156 1 1 30 THR HG1 H -1.398 -5.058 2.286 1.00 . A A . 30 THR HG1 1 1 8 5157 1 1 30 THR HG21 H -0.347 -7.649 4.252 1.00 . A A . 30 THR HG21 1 1 8 5158 1 1 30 THR HG22 H 0.127 -5.961 4.034 1.00 . A A . 30 THR HG22 1 1 8 5159 1 1 30 THR HG23 H -0.195 -6.980 2.626 1.00 . A A . 30 THR HG23 1 1 8 5160 1 1 30 THR N N -2.458 -7.600 1.707 1.00 . A A . 30 THR N 1 1 8 5161 1 1 30 THR O O -4.722 -6.742 4.385 1.00 . A A . 30 THR O 1 1 8 5162 1 1 30 THR OG1 O -2.114 -5.140 2.930 1.00 . A A . 30 THR OG1 1 1 8 5163 1 1 31 ASN C C -6.521 -5.209 2.711 1.00 . A A . 31 ASN C 1 1 8 5164 1 1 31 ASN CA C -6.393 -6.615 2.133 1.00 . A A . 31 ASN CA 1 1 8 5165 1 1 31 ASN CB C -7.339 -7.587 2.843 1.00 . A A . 31 ASN CB 1 1 8 5166 1 1 31 ASN CG C -7.544 -8.869 2.058 1.00 . A A . 31 ASN CG 1 1 8 5167 1 1 31 ASN H H -4.613 -7.436 1.358 1.00 . A A . 31 ASN H 1 1 8 5168 1 1 31 ASN HA H -6.669 -6.564 1.086 1.00 . A A . 31 ASN HA 1 1 8 5169 1 1 31 ASN HB2 H -6.928 -7.841 3.808 1.00 . A A . 31 ASN HB2 1 1 8 5170 1 1 31 ASN HB3 H -8.300 -7.112 2.979 1.00 . A A . 31 ASN HB3 1 1 8 5171 1 1 31 ASN HD21 H -6.021 -9.733 3.004 1.00 . A A . 31 ASN HD21 1 1 8 5172 1 1 31 ASN HD22 H -6.829 -10.705 1.822 1.00 . A A . 31 ASN HD22 1 1 8 5173 1 1 31 ASN N N -5.018 -7.089 2.180 1.00 . A A . 31 ASN N 1 1 8 5174 1 1 31 ASN ND2 N -6.717 -9.869 2.320 1.00 . A A . 31 ASN ND2 1 1 8 5175 1 1 31 ASN O O -7.383 -4.941 3.551 1.00 . A A . 31 ASN O 1 1 8 5176 1 1 31 ASN OD1 O -8.444 -8.961 1.220 1.00 . A A . 31 ASN OD1 1 1 8 5177 1 1 32 GLY C C -5.365 -2.490 3.970 1.00 . A A . 32 GLY C 1 1 8 5178 1 1 32 GLY CA C -5.813 -2.916 2.563 1.00 . A A . 32 GLY CA 1 1 8 5179 1 1 32 GLY H H -4.970 -4.575 1.577 1.00 . A A . 32 GLY H 1 1 8 5180 1 1 32 GLY HA2 H -5.255 -2.352 1.825 1.00 . A A . 32 GLY HA2 1 1 8 5181 1 1 32 GLY HA3 H -6.858 -2.659 2.451 1.00 . A A . 32 GLY HA3 1 1 8 5182 1 1 32 GLY N N -5.672 -4.304 2.232 1.00 . A A . 32 GLY N 1 1 8 5183 1 1 32 GLY O O -5.976 -1.579 4.531 1.00 . A A . 32 GLY O 1 1 8 5184 1 1 33 ASN C C -2.344 -2.086 5.622 1.00 . A A . 33 ASN C 1 1 8 5185 1 1 33 ASN CA C -3.799 -2.554 5.808 1.00 . A A . 33 ASN CA 1 1 8 5186 1 1 33 ASN CB C -4.001 -3.535 6.962 1.00 . A A . 33 ASN CB 1 1 8 5187 1 1 33 ASN CG C -2.888 -4.533 7.188 1.00 . A A . 33 ASN CG 1 1 8 5188 1 1 33 ASN H H -3.980 -3.952 4.241 1.00 . A A . 33 ASN H 1 1 8 5189 1 1 33 ASN HA H -4.383 -1.682 6.015 1.00 . A A . 33 ASN HA 1 1 8 5190 1 1 33 ASN HB2 H -4.134 -2.978 7.858 1.00 . A A . 33 ASN HB2 1 1 8 5191 1 1 33 ASN HB3 H -4.904 -4.092 6.759 1.00 . A A . 33 ASN HB3 1 1 8 5192 1 1 33 ASN HD21 H -2.547 -4.605 5.258 1.00 . A A . 33 ASN HD21 1 1 8 5193 1 1 33 ASN HD22 H -1.567 -5.638 6.241 1.00 . A A . 33 ASN HD22 1 1 8 5194 1 1 33 ASN N N -4.336 -3.108 4.576 1.00 . A A . 33 ASN N 1 1 8 5195 1 1 33 ASN ND2 N -2.268 -4.962 6.128 1.00 . A A . 33 ASN ND2 1 1 8 5196 1 1 33 ASN O O -1.562 -2.715 4.912 1.00 . A A . 33 ASN O 1 1 8 5197 1 1 33 ASN OD1 O -2.599 -4.910 8.322 1.00 . A A . 33 ASN OD1 1 1 8 5198 1 1 34 ALA C C 0.519 -0.679 6.352 1.00 . A A . 34 ALA C 1 1 8 5199 1 1 34 ALA CA C -0.824 -0.179 5.839 1.00 . A A . 34 ALA CA 1 1 8 5200 1 1 34 ALA CB C -1.007 1.278 6.224 1.00 . A A . 34 ALA CB 1 1 8 5201 1 1 34 ALA H H -2.594 -0.597 6.937 1.00 . A A . 34 ALA H 1 1 8 5202 1 1 34 ALA HA H -0.782 -0.222 4.771 1.00 . A A . 34 ALA HA 1 1 8 5203 1 1 34 ALA HB1 H -0.225 1.871 5.773 1.00 . A A . 34 ALA HB1 1 1 8 5204 1 1 34 ALA HB2 H -0.958 1.375 7.299 1.00 . A A . 34 ALA HB2 1 1 8 5205 1 1 34 ALA HB3 H -1.968 1.625 5.875 1.00 . A A . 34 ALA HB3 1 1 8 5206 1 1 34 ALA N N -2.006 -0.953 6.237 1.00 . A A . 34 ALA N 1 1 8 5207 1 1 34 ALA O O 1.518 -0.564 5.643 1.00 . A A . 34 ALA O 1 1 8 5208 1 1 35 GLU C C 2.379 -2.765 7.296 1.00 . A A . 35 GLU C 1 1 8 5209 1 1 35 GLU CA C 1.832 -1.630 8.096 1.00 . A A . 35 GLU CA 1 1 8 5210 1 1 35 GLU CB C 1.598 -2.052 9.521 1.00 . A A . 35 GLU CB 1 1 8 5211 1 1 35 GLU CD C 3.657 -2.608 10.839 1.00 . A A . 35 GLU CD 1 1 8 5212 1 1 35 GLU CG C 2.630 -1.559 10.467 1.00 . A A . 35 GLU CG 1 1 8 5213 1 1 35 GLU H H -0.201 -1.293 8.108 1.00 . A A . 35 GLU H 1 1 8 5214 1 1 35 GLU HA H 2.479 -0.830 8.057 1.00 . A A . 35 GLU HA 1 1 8 5215 1 1 35 GLU HB2 H 0.665 -1.656 9.831 1.00 . A A . 35 GLU HB2 1 1 8 5216 1 1 35 GLU HB3 H 1.562 -3.122 9.569 1.00 . A A . 35 GLU HB3 1 1 8 5217 1 1 35 GLU HG2 H 3.114 -0.737 10.003 1.00 . A A . 35 GLU HG2 1 1 8 5218 1 1 35 GLU HG3 H 2.128 -1.223 11.350 1.00 . A A . 35 GLU HG3 1 1 8 5219 1 1 35 GLU N N 0.585 -1.199 7.556 1.00 . A A . 35 GLU N 1 1 8 5220 1 1 35 GLU O O 3.509 -2.765 6.794 1.00 . A A . 35 GLU O 1 1 8 5221 1 1 35 GLU OE1 O 4.613 -2.803 10.056 1.00 . A A . 35 GLU OE1 1 1 8 5222 1 1 35 GLU OE2 O 3.525 -3.232 11.909 1.00 . A A . 35 GLU OE2 1 1 8 5223 1 1 36 PHE C C 1.962 -4.565 4.948 1.00 . A A . 36 PHE C 1 1 8 5224 1 1 36 PHE CA C 1.745 -4.894 6.404 1.00 . A A . 36 PHE CA 1 1 8 5225 1 1 36 PHE CB C 0.553 -5.807 6.599 1.00 . A A . 36 PHE CB 1 1 8 5226 1 1 36 PHE CD1 C 0.801 -5.928 9.047 1.00 . A A . 36 PHE CD1 1 1 8 5227 1 1 36 PHE CD2 C 0.682 -7.981 7.855 1.00 . A A . 36 PHE CD2 1 1 8 5228 1 1 36 PHE CE1 C 0.937 -6.591 10.211 1.00 . A A . 36 PHE CE1 1 1 8 5229 1 1 36 PHE CE2 C 0.816 -8.673 9.045 1.00 . A A . 36 PHE CE2 1 1 8 5230 1 1 36 PHE CG C 0.673 -6.597 7.853 1.00 . A A . 36 PHE CG 1 1 8 5231 1 1 36 PHE CZ C 0.944 -7.972 10.231 1.00 . A A . 36 PHE CZ 1 1 8 5232 1 1 36 PHE H H 0.636 -3.553 7.587 1.00 . A A . 36 PHE H 1 1 8 5233 1 1 36 PHE HA H 2.630 -5.368 6.803 1.00 . A A . 36 PHE HA 1 1 8 5234 1 1 36 PHE HB2 H -0.337 -5.195 6.680 1.00 . A A . 36 PHE HB2 1 1 8 5235 1 1 36 PHE HB3 H 0.446 -6.466 5.763 1.00 . A A . 36 PHE HB3 1 1 8 5236 1 1 36 PHE HD1 H 0.796 -4.854 9.060 1.00 . A A . 36 PHE HD1 1 1 8 5237 1 1 36 PHE HD2 H 0.582 -8.516 6.923 1.00 . A A . 36 PHE HD2 1 1 8 5238 1 1 36 PHE HE1 H 1.039 -6.022 11.103 1.00 . A A . 36 PHE HE1 1 1 8 5239 1 1 36 PHE HE2 H 0.821 -9.753 9.047 1.00 . A A . 36 PHE HE2 1 1 8 5240 1 1 36 PHE HZ H 1.052 -8.502 11.165 1.00 . A A . 36 PHE HZ 1 1 8 5241 1 1 36 PHE N N 1.505 -3.693 7.156 1.00 . A A . 36 PHE N 1 1 8 5242 1 1 36 PHE O O 2.583 -5.321 4.203 1.00 . A A . 36 PHE O 1 1 8 5243 1 1 37 ALA C C 2.993 -2.617 2.854 1.00 . A A . 37 ALA C 1 1 8 5244 1 1 37 ALA CA C 1.567 -2.950 3.205 1.00 . A A . 37 ALA CA 1 1 8 5245 1 1 37 ALA CB C 0.715 -1.728 3.047 1.00 . A A . 37 ALA CB 1 1 8 5246 1 1 37 ALA H H 0.985 -2.842 5.216 1.00 . A A . 37 ALA H 1 1 8 5247 1 1 37 ALA HA H 1.206 -3.720 2.543 1.00 . A A . 37 ALA HA 1 1 8 5248 1 1 37 ALA HB1 H 0.774 -1.377 2.027 1.00 . A A . 37 ALA HB1 1 1 8 5249 1 1 37 ALA HB2 H 1.067 -0.956 3.714 1.00 . A A . 37 ALA HB2 1 1 8 5250 1 1 37 ALA HB3 H -0.311 -1.970 3.284 1.00 . A A . 37 ALA HB3 1 1 8 5251 1 1 37 ALA N N 1.456 -3.413 4.560 1.00 . A A . 37 ALA N 1 1 8 5252 1 1 37 ALA O O 3.531 -3.114 1.883 1.00 . A A . 37 ALA O 1 1 8 5253 1 1 38 ALA C C 5.868 -2.522 3.404 1.00 . A A . 38 ALA C 1 1 8 5254 1 1 38 ALA CA C 4.944 -1.335 3.438 1.00 . A A . 38 ALA CA 1 1 8 5255 1 1 38 ALA CB C 5.368 -0.376 4.526 1.00 . A A . 38 ALA CB 1 1 8 5256 1 1 38 ALA H H 3.108 -1.444 4.420 1.00 . A A . 38 ALA H 1 1 8 5257 1 1 38 ALA HA H 4.985 -0.820 2.489 1.00 . A A . 38 ALA HA 1 1 8 5258 1 1 38 ALA HB1 H 5.309 -0.873 5.482 1.00 . A A . 38 ALA HB1 1 1 8 5259 1 1 38 ALA HB2 H 4.714 0.481 4.521 1.00 . A A . 38 ALA HB2 1 1 8 5260 1 1 38 ALA HB3 H 6.383 -0.059 4.346 1.00 . A A . 38 ALA HB3 1 1 8 5261 1 1 38 ALA N N 3.592 -1.777 3.658 1.00 . A A . 38 ALA N 1 1 8 5262 1 1 38 ALA O O 6.673 -2.661 2.501 1.00 . A A . 38 ALA O 1 1 8 5263 1 1 39 SER C C 6.403 -5.475 3.331 1.00 . A A . 39 SER C 1 1 8 5264 1 1 39 SER CA C 6.557 -4.549 4.509 1.00 . A A . 39 SER CA 1 1 8 5265 1 1 39 SER CB C 6.221 -5.275 5.807 1.00 . A A . 39 SER CB 1 1 8 5266 1 1 39 SER H H 4.865 -3.391 4.882 1.00 . A A . 39 SER H 1 1 8 5267 1 1 39 SER HA H 7.572 -4.181 4.550 1.00 . A A . 39 SER HA 1 1 8 5268 1 1 39 SER HB2 H 5.223 -5.681 5.738 1.00 . A A . 39 SER HB2 1 1 8 5269 1 1 39 SER HB3 H 6.928 -6.074 5.969 1.00 . A A . 39 SER HB3 1 1 8 5270 1 1 39 SER HG H 7.057 -4.583 7.444 1.00 . A A . 39 SER HG 1 1 8 5271 1 1 39 SER N N 5.667 -3.429 4.336 1.00 . A A . 39 SER N 1 1 8 5272 1 1 39 SER O O 7.321 -6.213 2.969 1.00 . A A . 39 SER O 1 1 8 5273 1 1 39 SER OG O 6.272 -4.386 6.910 1.00 . A A . 39 SER OG 1 1 8 5274 1 1 40 LEU C C 5.513 -5.512 0.355 1.00 . A A . 40 LEU C 1 1 8 5275 1 1 40 LEU CA C 4.964 -6.200 1.568 1.00 . A A . 40 LEU CA 1 1 8 5276 1 1 40 LEU CB C 3.470 -6.389 1.417 1.00 . A A . 40 LEU CB 1 1 8 5277 1 1 40 LEU CD1 C 3.967 -8.490 0.135 1.00 . A A . 40 LEU CD1 1 1 8 5278 1 1 40 LEU CD2 C 2.963 -8.622 2.429 1.00 . A A . 40 LEU CD2 1 1 8 5279 1 1 40 LEU CG C 3.031 -7.823 1.135 1.00 . A A . 40 LEU CG 1 1 8 5280 1 1 40 LEU H H 4.522 -4.805 3.043 1.00 . A A . 40 LEU H 1 1 8 5281 1 1 40 LEU HA H 5.451 -7.156 1.673 1.00 . A A . 40 LEU HA 1 1 8 5282 1 1 40 LEU HB2 H 2.990 -6.050 2.321 1.00 . A A . 40 LEU HB2 1 1 8 5283 1 1 40 LEU HB3 H 3.145 -5.757 0.624 1.00 . A A . 40 LEU HB3 1 1 8 5284 1 1 40 LEU HD11 H 4.973 -8.483 0.527 1.00 . A A . 40 LEU HD11 1 1 8 5285 1 1 40 LEU HD12 H 3.940 -7.949 -0.801 1.00 . A A . 40 LEU HD12 1 1 8 5286 1 1 40 LEU HD13 H 3.652 -9.510 -0.030 1.00 . A A . 40 LEU HD13 1 1 8 5287 1 1 40 LEU HD21 H 2.282 -8.139 3.114 1.00 . A A . 40 LEU HD21 1 1 8 5288 1 1 40 LEU HD22 H 3.946 -8.670 2.874 1.00 . A A . 40 LEU HD22 1 1 8 5289 1 1 40 LEU HD23 H 2.614 -9.622 2.218 1.00 . A A . 40 LEU HD23 1 1 8 5290 1 1 40 LEU HG H 2.042 -7.809 0.701 1.00 . A A . 40 LEU HG 1 1 8 5291 1 1 40 LEU N N 5.231 -5.415 2.717 1.00 . A A . 40 LEU N 1 1 8 5292 1 1 40 LEU O O 6.227 -6.122 -0.432 1.00 . A A . 40 LEU O 1 1 8 5293 1 1 41 LEU C C 7.082 -3.436 -1.064 1.00 . A A . 41 LEU C 1 1 8 5294 1 1 41 LEU CA C 5.572 -3.522 -0.974 1.00 . A A . 41 LEU CA 1 1 8 5295 1 1 41 LEU CB C 4.843 -2.185 -1.043 1.00 . A A . 41 LEU CB 1 1 8 5296 1 1 41 LEU CD1 C 6.654 -0.586 -0.604 1.00 . A A . 41 LEU CD1 1 1 8 5297 1 1 41 LEU CD2 C 4.304 0.020 -0.086 1.00 . A A . 41 LEU CD2 1 1 8 5298 1 1 41 LEU CG C 5.329 -1.084 -0.134 1.00 . A A . 41 LEU CG 1 1 8 5299 1 1 41 LEU H H 4.789 -3.710 0.976 1.00 . A A . 41 LEU H 1 1 8 5300 1 1 41 LEU HA H 5.237 -4.112 -1.790 1.00 . A A . 41 LEU HA 1 1 8 5301 1 1 41 LEU HB2 H 4.890 -1.827 -2.060 1.00 . A A . 41 LEU HB2 1 1 8 5302 1 1 41 LEU HB3 H 3.808 -2.380 -0.798 1.00 . A A . 41 LEU HB3 1 1 8 5303 1 1 41 LEU HD11 H 7.013 0.180 0.063 1.00 . A A . 41 LEU HD11 1 1 8 5304 1 1 41 LEU HD12 H 6.559 -0.191 -1.603 1.00 . A A . 41 LEU HD12 1 1 8 5305 1 1 41 LEU HD13 H 7.343 -1.418 -0.606 1.00 . A A . 41 LEU HD13 1 1 8 5306 1 1 41 LEU HD21 H 4.666 0.825 0.534 1.00 . A A . 41 LEU HD21 1 1 8 5307 1 1 41 LEU HD22 H 3.388 -0.374 0.328 1.00 . A A . 41 LEU HD22 1 1 8 5308 1 1 41 LEU HD23 H 4.122 0.385 -1.086 1.00 . A A . 41 LEU HD23 1 1 8 5309 1 1 41 LEU HG H 5.456 -1.466 0.854 1.00 . A A . 41 LEU HG 1 1 8 5310 1 1 41 LEU N N 5.220 -4.225 0.221 1.00 . A A . 41 LEU N 1 1 8 5311 1 1 41 LEU O O 7.654 -3.374 -2.155 1.00 . A A . 41 LEU O 1 1 8 5312 1 1 42 PHE C C 9.839 -4.445 -0.556 1.00 . A A . 42 PHE C 1 1 8 5313 1 1 42 PHE CA C 9.141 -3.363 0.262 1.00 . A A . 42 PHE CA 1 1 8 5314 1 1 42 PHE CB C 9.530 -3.506 1.721 1.00 . A A . 42 PHE CB 1 1 8 5315 1 1 42 PHE CD1 C 9.064 -1.285 2.500 1.00 . A A . 42 PHE CD1 1 1 8 5316 1 1 42 PHE CD2 C 11.331 -1.941 2.487 1.00 . A A . 42 PHE CD2 1 1 8 5317 1 1 42 PHE CE1 C 9.402 -0.061 2.970 1.00 . A A . 42 PHE CE1 1 1 8 5318 1 1 42 PHE CE2 C 11.700 -0.701 2.971 1.00 . A A . 42 PHE CE2 1 1 8 5319 1 1 42 PHE CG C 9.997 -2.225 2.262 1.00 . A A . 42 PHE CG 1 1 8 5320 1 1 42 PHE CZ C 10.726 0.249 3.212 1.00 . A A . 42 PHE CZ 1 1 8 5321 1 1 42 PHE H H 7.164 -3.496 0.927 1.00 . A A . 42 PHE H 1 1 8 5322 1 1 42 PHE HA H 9.444 -2.366 -0.056 1.00 . A A . 42 PHE HA 1 1 8 5323 1 1 42 PHE HB2 H 8.662 -3.793 2.296 1.00 . A A . 42 PHE HB2 1 1 8 5324 1 1 42 PHE HB3 H 10.304 -4.231 1.832 1.00 . A A . 42 PHE HB3 1 1 8 5325 1 1 42 PHE HD1 H 8.024 -1.540 2.321 1.00 . A A . 42 PHE HD1 1 1 8 5326 1 1 42 PHE HD2 H 12.080 -2.694 2.292 1.00 . A A . 42 PHE HD2 1 1 8 5327 1 1 42 PHE HE1 H 8.636 0.649 3.131 1.00 . A A . 42 PHE HE1 1 1 8 5328 1 1 42 PHE HE2 H 12.740 -0.475 3.156 1.00 . A A . 42 PHE HE2 1 1 8 5329 1 1 42 PHE HZ H 10.998 1.225 3.587 1.00 . A A . 42 PHE HZ 1 1 8 5330 1 1 42 PHE N N 7.705 -3.435 0.117 1.00 . A A . 42 PHE N 1 1 8 5331 1 1 42 PHE O O 11.046 -4.374 -0.784 1.00 . A A . 42 PHE O 1 1 8 5332 1 1 43 GLN C C 10.258 -6.044 -3.059 1.00 . A A . 43 GLN C 1 1 8 5333 1 1 43 GLN CA C 9.614 -6.566 -1.778 1.00 . A A . 43 GLN CA 1 1 8 5334 1 1 43 GLN CB C 8.523 -7.594 -2.130 1.00 . A A . 43 GLN CB 1 1 8 5335 1 1 43 GLN CD C 6.316 -7.187 -3.312 1.00 . A A . 43 GLN CD 1 1 8 5336 1 1 43 GLN CG C 7.815 -7.332 -3.457 1.00 . A A . 43 GLN CG 1 1 8 5337 1 1 43 GLN H H 8.100 -5.473 -0.730 1.00 . A A . 43 GLN H 1 1 8 5338 1 1 43 GLN HA H 10.372 -7.043 -1.191 1.00 . A A . 43 GLN HA 1 1 8 5339 1 1 43 GLN HB2 H 8.975 -8.571 -2.182 1.00 . A A . 43 GLN HB2 1 1 8 5340 1 1 43 GLN HB3 H 7.780 -7.593 -1.345 1.00 . A A . 43 GLN HB3 1 1 8 5341 1 1 43 GLN HE21 H 6.509 -5.227 -3.096 1.00 . A A . 43 GLN HE21 1 1 8 5342 1 1 43 GLN HE22 H 4.901 -5.843 -2.990 1.00 . A A . 43 GLN HE22 1 1 8 5343 1 1 43 GLN HG2 H 8.205 -6.420 -3.884 1.00 . A A . 43 GLN HG2 1 1 8 5344 1 1 43 GLN HG3 H 8.018 -8.156 -4.126 1.00 . A A . 43 GLN HG3 1 1 8 5345 1 1 43 GLN N N 9.067 -5.463 -0.979 1.00 . A A . 43 GLN N 1 1 8 5346 1 1 43 GLN NE2 N 5.862 -5.962 -3.123 1.00 . A A . 43 GLN NE2 1 1 8 5347 1 1 43 GLN O O 11.133 -6.685 -3.642 1.00 . A A . 43 GLN O 1 1 8 5348 1 1 43 GLN OE1 O 5.572 -8.162 -3.388 1.00 . A A . 43 GLN OE1 1 1 8 5349 1 1 44 SER C C 10.937 -2.916 -4.381 1.00 . A A . 44 SER C 1 1 8 5350 1 1 44 SER CA C 10.286 -4.259 -4.698 1.00 . A A . 44 SER CA 1 1 8 5351 1 1 44 SER CB C 9.117 -4.077 -5.677 1.00 . A A . 44 SER CB 1 1 8 5352 1 1 44 SER H H 9.164 -4.401 -2.915 1.00 . A A . 44 SER H 1 1 8 5353 1 1 44 SER HA H 11.024 -4.912 -5.142 1.00 . A A . 44 SER HA 1 1 8 5354 1 1 44 SER HB2 H 8.608 -5.020 -5.805 1.00 . A A . 44 SER HB2 1 1 8 5355 1 1 44 SER HB3 H 8.428 -3.348 -5.276 1.00 . A A . 44 SER HB3 1 1 8 5356 1 1 44 SER HG H 9.702 -2.669 -6.919 1.00 . A A . 44 SER HG 1 1 8 5357 1 1 44 SER N N 9.815 -4.875 -3.472 1.00 . A A . 44 SER N 1 1 8 5358 1 1 44 SER O O 10.210 -1.904 -4.304 1.00 . A A . 44 SER O 1 1 8 5359 1 1 44 SER OXT O 12.168 -2.883 -4.194 1.00 . A A . 44 SER OXT 1 1 8 5360 1 1 44 SER OG O 9.564 -3.628 -6.947 1.00 . A A . 44 SER OG 1 1 9 5361 1 1 1 GLY C C -15.404 -1.162 2.034 1.00 . A A . 1 GLY C 1 1 9 5362 1 1 1 GLY CA C -16.355 -1.901 2.948 1.00 . A A . 1 GLY CA 1 1 9 5363 1 1 1 GLY H1 H -17.633 -2.712 1.516 1.00 . A A . 1 GLY H1 1 1 9 5364 1 1 1 GLY H2 H -18.057 -1.147 2.010 1.00 . A A . 1 GLY H2 1 1 9 5365 1 1 1 GLY H3 H -18.358 -2.470 3.029 1.00 . A A . 1 GLY H3 1 1 9 5366 1 1 1 GLY HA2 H -16.459 -1.344 3.869 1.00 . A A . 1 GLY HA2 1 1 9 5367 1 1 1 GLY HA3 H -15.944 -2.874 3.169 1.00 . A A . 1 GLY HA3 1 1 9 5368 1 1 1 GLY N N -17.692 -2.072 2.334 1.00 . A A . 1 GLY N 1 1 9 5369 1 1 1 GLY O O -15.378 0.073 2.027 1.00 . A A . 1 GLY O 1 1 9 5370 1 1 2 SER C C -12.611 -0.517 1.076 1.00 . A A . 2 SER C 1 1 9 5371 1 1 2 SER CA C -13.661 -1.344 0.331 1.00 . A A . 2 SER CA 1 1 9 5372 1 1 2 SER CB C -14.381 -0.502 -0.726 1.00 . A A . 2 SER CB 1 1 9 5373 1 1 2 SER H H -14.699 -2.897 1.323 1.00 . A A . 2 SER H 1 1 9 5374 1 1 2 SER HA H -13.162 -2.164 -0.162 1.00 . A A . 2 SER HA 1 1 9 5375 1 1 2 SER HB2 H -14.942 0.285 -0.241 1.00 . A A . 2 SER HB2 1 1 9 5376 1 1 2 SER HB3 H -13.652 -0.068 -1.395 1.00 . A A . 2 SER HB3 1 1 9 5377 1 1 2 SER HG H -16.089 -0.806 -1.643 1.00 . A A . 2 SER HG 1 1 9 5378 1 1 2 SER N N -14.627 -1.917 1.260 1.00 . A A . 2 SER N 1 1 9 5379 1 1 2 SER O O -12.307 -0.806 2.236 1.00 . A A . 2 SER O 1 1 9 5380 1 1 2 SER OG O -15.274 -1.303 -1.483 1.00 . A A . 2 SER OG 1 1 9 5381 1 1 3 ALA C C -9.767 0.442 1.275 1.00 . A A . 3 ALA C 1 1 9 5382 1 1 3 ALA CA C -10.978 1.312 0.962 1.00 . A A . 3 ALA CA 1 1 9 5383 1 1 3 ALA CB C -11.448 2.066 2.202 1.00 . A A . 3 ALA CB 1 1 9 5384 1 1 3 ALA H H -12.370 0.687 -0.506 1.00 . A A . 3 ALA H 1 1 9 5385 1 1 3 ALA HA H -10.696 2.040 0.213 1.00 . A A . 3 ALA HA 1 1 9 5386 1 1 3 ALA HB1 H -11.746 1.359 2.962 1.00 . A A . 3 ALA HB1 1 1 9 5387 1 1 3 ALA HB2 H -12.289 2.694 1.945 1.00 . A A . 3 ALA HB2 1 1 9 5388 1 1 3 ALA HB3 H -10.642 2.679 2.579 1.00 . A A . 3 ALA HB3 1 1 9 5389 1 1 3 ALA N N -12.053 0.492 0.400 1.00 . A A . 3 ALA N 1 1 9 5390 1 1 3 ALA O O -9.241 0.436 2.390 1.00 . A A . 3 ALA O 1 1 9 5391 1 1 4 THR C C -6.919 -0.497 0.119 1.00 . A A . 4 THR C 1 1 9 5392 1 1 4 THR CA C -8.216 -1.211 0.403 1.00 . A A . 4 THR CA 1 1 9 5393 1 1 4 THR CB C -8.405 -2.410 -0.549 1.00 . A A . 4 THR CB 1 1 9 5394 1 1 4 THR CG2 C -7.851 -3.687 0.055 1.00 . A A . 4 THR CG2 1 1 9 5395 1 1 4 THR H H -9.789 -0.229 -0.604 1.00 . A A . 4 THR H 1 1 9 5396 1 1 4 THR HA H -8.182 -1.552 1.382 1.00 . A A . 4 THR HA 1 1 9 5397 1 1 4 THR HB H -7.885 -2.208 -1.473 1.00 . A A . 4 THR HB 1 1 9 5398 1 1 4 THR HG1 H -10.196 -3.141 -0.130 1.00 . A A . 4 THR HG1 1 1 9 5399 1 1 4 THR HG21 H -8.343 -3.885 0.996 1.00 . A A . 4 THR HG21 1 1 9 5400 1 1 4 THR HG22 H -6.789 -3.574 0.221 1.00 . A A . 4 THR HG22 1 1 9 5401 1 1 4 THR HG23 H -8.024 -4.510 -0.623 1.00 . A A . 4 THR HG23 1 1 9 5402 1 1 4 THR N N -9.334 -0.296 0.269 1.00 . A A . 4 THR N 1 1 9 5403 1 1 4 THR O O -5.872 -0.767 0.695 1.00 . A A . 4 THR O 1 1 9 5404 1 1 4 THR OG1 O -9.804 -2.595 -0.821 1.00 . A A . 4 THR OG1 1 1 9 5405 1 1 5 PHE C C -6.264 2.768 -1.271 1.00 . A A . 5 PHE C 1 1 9 5406 1 1 5 PHE CA C -5.963 1.246 -1.291 1.00 . A A . 5 PHE CA 1 1 9 5407 1 1 5 PHE CB C -5.937 0.862 -2.722 1.00 . A A . 5 PHE CB 1 1 9 5408 1 1 5 PHE CD1 C -5.269 -1.385 -2.177 1.00 . A A . 5 PHE CD1 1 1 9 5409 1 1 5 PHE CD2 C -6.990 -1.173 -3.757 1.00 . A A . 5 PHE CD2 1 1 9 5410 1 1 5 PHE CE1 C -5.368 -2.690 -2.217 1.00 . A A . 5 PHE CE1 1 1 9 5411 1 1 5 PHE CE2 C -7.082 -2.553 -3.815 1.00 . A A . 5 PHE CE2 1 1 9 5412 1 1 5 PHE CG C -6.056 -0.592 -2.913 1.00 . A A . 5 PHE CG 1 1 9 5413 1 1 5 PHE CZ C -6.248 -3.302 -3.008 1.00 . A A . 5 PHE CZ 1 1 9 5414 1 1 5 PHE H H -7.937 0.645 -1.015 1.00 . A A . 5 PHE H 1 1 9 5415 1 1 5 PHE HA H -5.028 0.992 -0.816 1.00 . A A . 5 PHE HA 1 1 9 5416 1 1 5 PHE HB2 H -6.798 1.310 -3.115 1.00 . A A . 5 PHE HB2 1 1 9 5417 1 1 5 PHE HB3 H -5.044 1.215 -3.202 1.00 . A A . 5 PHE HB3 1 1 9 5418 1 1 5 PHE HD1 H -4.566 -0.959 -1.511 1.00 . A A . 5 PHE HD1 1 1 9 5419 1 1 5 PHE HD2 H -7.624 -0.552 -4.372 1.00 . A A . 5 PHE HD2 1 1 9 5420 1 1 5 PHE HE1 H -4.725 -3.242 -1.616 1.00 . A A . 5 PHE HE1 1 1 9 5421 1 1 5 PHE HE2 H -7.802 -3.032 -4.463 1.00 . A A . 5 PHE HE2 1 1 9 5422 1 1 5 PHE HZ H -6.292 -4.358 -2.969 1.00 . A A . 5 PHE HZ 1 1 9 5423 1 1 5 PHE N N -7.057 0.458 -0.740 1.00 . A A . 5 PHE N 1 1 9 5424 1 1 5 PHE O O -6.038 3.465 -2.256 1.00 . A A . 5 PHE O 1 1 9 5425 1 1 6 PRO C C -5.993 5.607 0.248 1.00 . A A . 6 PRO C 1 1 9 5426 1 1 6 PRO CA C -7.160 4.669 0.016 1.00 . A A . 6 PRO CA 1 1 9 5427 1 1 6 PRO CB C -8.041 4.610 1.242 1.00 . A A . 6 PRO CB 1 1 9 5428 1 1 6 PRO CD C -7.105 2.498 0.981 1.00 . A A . 6 PRO CD 1 1 9 5429 1 1 6 PRO CG C -7.520 3.500 2.000 1.00 . A A . 6 PRO CG 1 1 9 5430 1 1 6 PRO HA H -7.742 5.011 -0.798 1.00 . A A . 6 PRO HA 1 1 9 5431 1 1 6 PRO HB2 H -7.994 5.533 1.793 1.00 . A A . 6 PRO HB2 1 1 9 5432 1 1 6 PRO HB3 H -9.036 4.401 0.954 1.00 . A A . 6 PRO HB3 1 1 9 5433 1 1 6 PRO HD2 H -6.263 1.951 1.286 1.00 . A A . 6 PRO HD2 1 1 9 5434 1 1 6 PRO HD3 H -7.908 1.822 0.710 1.00 . A A . 6 PRO HD3 1 1 9 5435 1 1 6 PRO HG2 H -6.690 3.824 2.583 1.00 . A A . 6 PRO HG2 1 1 9 5436 1 1 6 PRO HG3 H -8.299 3.111 2.605 1.00 . A A . 6 PRO HG3 1 1 9 5437 1 1 6 PRO N N -6.772 3.277 -0.160 1.00 . A A . 6 PRO N 1 1 9 5438 1 1 6 PRO O O -4.898 5.177 0.593 1.00 . A A . 6 PRO O 1 1 9 5439 1 1 7 GLU C C -4.484 7.810 1.538 1.00 . A A . 7 GLU C 1 1 9 5440 1 1 7 GLU CA C -5.270 7.952 0.237 1.00 . A A . 7 GLU CA 1 1 9 5441 1 1 7 GLU CB C -5.982 9.302 0.192 1.00 . A A . 7 GLU CB 1 1 9 5442 1 1 7 GLU CD C -7.820 10.616 -0.940 1.00 . A A . 7 GLU CD 1 1 9 5443 1 1 7 GLU CG C -6.816 9.491 -1.064 1.00 . A A . 7 GLU CG 1 1 9 5444 1 1 7 GLU H H -7.176 7.152 -0.125 1.00 . A A . 7 GLU H 1 1 9 5445 1 1 7 GLU HA H -4.585 7.886 -0.594 1.00 . A A . 7 GLU HA 1 1 9 5446 1 1 7 GLU HB2 H -6.633 9.386 1.051 1.00 . A A . 7 GLU HB2 1 1 9 5447 1 1 7 GLU HB3 H -5.247 10.083 0.230 1.00 . A A . 7 GLU HB3 1 1 9 5448 1 1 7 GLU HG2 H -6.156 9.710 -1.890 1.00 . A A . 7 GLU HG2 1 1 9 5449 1 1 7 GLU HG3 H -7.351 8.575 -1.267 1.00 . A A . 7 GLU HG3 1 1 9 5450 1 1 7 GLU N N -6.263 6.896 0.092 1.00 . A A . 7 GLU N 1 1 9 5451 1 1 7 GLU O O -3.312 8.163 1.600 1.00 . A A . 7 GLU O 1 1 9 5452 1 1 7 GLU OE1 O -8.897 10.397 -0.356 1.00 . A A . 7 GLU OE1 1 1 9 5453 1 1 7 GLU OE2 O -7.524 11.733 -1.416 1.00 . A A . 7 GLU OE2 1 1 9 5454 1 1 8 GLN C C -3.238 6.161 3.619 1.00 . A A . 8 GLN C 1 1 9 5455 1 1 8 GLN CA C -4.504 6.968 3.832 1.00 . A A . 8 GLN CA 1 1 9 5456 1 1 8 GLN CB C -5.453 6.097 4.619 1.00 . A A . 8 GLN CB 1 1 9 5457 1 1 8 GLN CD C -6.357 5.477 6.902 1.00 . A A . 8 GLN CD 1 1 9 5458 1 1 8 GLN CG C -5.533 6.454 6.085 1.00 . A A . 8 GLN CG 1 1 9 5459 1 1 8 GLN H H -6.121 7.195 2.488 1.00 . A A . 8 GLN H 1 1 9 5460 1 1 8 GLN HA H -4.288 7.868 4.382 1.00 . A A . 8 GLN HA 1 1 9 5461 1 1 8 GLN HB2 H -6.415 6.179 4.170 1.00 . A A . 8 GLN HB2 1 1 9 5462 1 1 8 GLN HB3 H -5.123 5.073 4.540 1.00 . A A . 8 GLN HB3 1 1 9 5463 1 1 8 GLN HE21 H -7.570 5.123 5.363 1.00 . A A . 8 GLN HE21 1 1 9 5464 1 1 8 GLN HE22 H -7.932 4.266 6.828 1.00 . A A . 8 GLN HE22 1 1 9 5465 1 1 8 GLN HG2 H -4.533 6.464 6.474 1.00 . A A . 8 GLN HG2 1 1 9 5466 1 1 8 GLN HG3 H -5.965 7.439 6.182 1.00 . A A . 8 GLN HG3 1 1 9 5467 1 1 8 GLN N N -5.147 7.308 2.566 1.00 . A A . 8 GLN N 1 1 9 5468 1 1 8 GLN NE2 N -7.384 4.897 6.303 1.00 . A A . 8 GLN NE2 1 1 9 5469 1 1 8 GLN O O -2.127 6.614 3.888 1.00 . A A . 8 GLN O 1 1 9 5470 1 1 8 GLN OE1 O -6.077 5.251 8.079 1.00 . A A . 8 GLN OE1 1 1 9 5471 1 1 9 THR C C -1.568 4.500 1.697 1.00 . A A . 9 THR C 1 1 9 5472 1 1 9 THR CA C -2.394 4.036 2.857 1.00 . A A . 9 THR CA 1 1 9 5473 1 1 9 THR CB C -2.975 2.647 2.592 1.00 . A A . 9 THR CB 1 1 9 5474 1 1 9 THR CG2 C -3.679 2.109 3.825 1.00 . A A . 9 THR CG2 1 1 9 5475 1 1 9 THR H H -4.330 4.704 2.854 1.00 . A A . 9 THR H 1 1 9 5476 1 1 9 THR HA H -1.787 3.999 3.721 1.00 . A A . 9 THR HA 1 1 9 5477 1 1 9 THR HB H -2.172 1.997 2.340 1.00 . A A . 9 THR HB 1 1 9 5478 1 1 9 THR HG1 H -4.050 1.801 1.180 1.00 . A A . 9 THR HG1 1 1 9 5479 1 1 9 THR HG21 H -2.978 2.059 4.646 1.00 . A A . 9 THR HG21 1 1 9 5480 1 1 9 THR HG22 H -4.062 1.122 3.618 1.00 . A A . 9 THR HG22 1 1 9 5481 1 1 9 THR HG23 H -4.495 2.766 4.086 1.00 . A A . 9 THR HG23 1 1 9 5482 1 1 9 THR N N -3.439 4.968 3.100 1.00 . A A . 9 THR N 1 1 9 5483 1 1 9 THR O O -0.360 4.282 1.633 1.00 . A A . 9 THR O 1 1 9 5484 1 1 9 THR OG1 O -3.903 2.692 1.506 1.00 . A A . 9 THR OG1 1 1 9 5485 1 1 10 ILE C C -0.503 6.587 0.021 1.00 . A A . 10 ILE C 1 1 9 5486 1 1 10 ILE CA C -1.652 5.716 -0.393 1.00 . A A . 10 ILE CA 1 1 9 5487 1 1 10 ILE CB C -2.665 6.578 -1.194 1.00 . A A . 10 ILE CB 1 1 9 5488 1 1 10 ILE CD1 C -2.846 4.930 -3.096 1.00 . A A . 10 ILE CD1 1 1 9 5489 1 1 10 ILE CG1 C -3.581 5.712 -2.046 1.00 . A A . 10 ILE CG1 1 1 9 5490 1 1 10 ILE CG2 C -1.956 7.587 -2.068 1.00 . A A . 10 ILE CG2 1 1 9 5491 1 1 10 ILE H H -3.211 5.296 0.970 1.00 . A A . 10 ILE H 1 1 9 5492 1 1 10 ILE HA H -1.299 4.921 -1.014 1.00 . A A . 10 ILE HA 1 1 9 5493 1 1 10 ILE HB H -3.269 7.125 -0.482 1.00 . A A . 10 ILE HB 1 1 9 5494 1 1 10 ILE HD11 H -2.314 5.607 -3.746 1.00 . A A . 10 ILE HD11 1 1 9 5495 1 1 10 ILE HD12 H -3.552 4.350 -3.673 1.00 . A A . 10 ILE HD12 1 1 9 5496 1 1 10 ILE HD13 H -2.144 4.266 -2.610 1.00 . A A . 10 ILE HD13 1 1 9 5497 1 1 10 ILE HG12 H -4.096 5.013 -1.410 1.00 . A A . 10 ILE HG12 1 1 9 5498 1 1 10 ILE HG13 H -4.304 6.342 -2.543 1.00 . A A . 10 ILE HG13 1 1 9 5499 1 1 10 ILE HG21 H -1.353 8.227 -1.446 1.00 . A A . 10 ILE HG21 1 1 9 5500 1 1 10 ILE HG22 H -2.687 8.176 -2.595 1.00 . A A . 10 ILE HG22 1 1 9 5501 1 1 10 ILE HG23 H -1.329 7.067 -2.773 1.00 . A A . 10 ILE HG23 1 1 9 5502 1 1 10 ILE N N -2.256 5.165 0.800 1.00 . A A . 10 ILE N 1 1 9 5503 1 1 10 ILE O O 0.642 6.326 -0.304 1.00 . A A . 10 ILE O 1 1 9 5504 1 1 11 LYS C C 1.129 7.885 2.234 1.00 . A A . 11 LYS C 1 1 9 5505 1 1 11 LYS CA C 0.164 8.502 1.264 1.00 . A A . 11 LYS CA 1 1 9 5506 1 1 11 LYS CB C -0.507 9.731 1.836 1.00 . A A . 11 LYS CB 1 1 9 5507 1 1 11 LYS CD C -2.167 11.583 1.435 1.00 . A A . 11 LYS CD 1 1 9 5508 1 1 11 LYS CE C -1.273 12.799 1.664 1.00 . A A . 11 LYS CE 1 1 9 5509 1 1 11 LYS CG C -1.406 10.413 0.826 1.00 . A A . 11 LYS CG 1 1 9 5510 1 1 11 LYS H H -1.744 7.663 1.116 1.00 . A A . 11 LYS H 1 1 9 5511 1 1 11 LYS HA H 0.728 8.786 0.400 1.00 . A A . 11 LYS HA 1 1 9 5512 1 1 11 LYS HB2 H -1.102 9.435 2.681 1.00 . A A . 11 LYS HB2 1 1 9 5513 1 1 11 LYS HB3 H 0.247 10.433 2.155 1.00 . A A . 11 LYS HB3 1 1 9 5514 1 1 11 LYS HD2 H -2.969 11.862 0.768 1.00 . A A . 11 LYS HD2 1 1 9 5515 1 1 11 LYS HD3 H -2.581 11.270 2.383 1.00 . A A . 11 LYS HD3 1 1 9 5516 1 1 11 LYS HE2 H -0.747 13.016 0.747 1.00 . A A . 11 LYS HE2 1 1 9 5517 1 1 11 LYS HE3 H -1.900 13.641 1.922 1.00 . A A . 11 LYS HE3 1 1 9 5518 1 1 11 LYS HG2 H -0.796 10.780 0.013 1.00 . A A . 11 LYS HG2 1 1 9 5519 1 1 11 LYS HG3 H -2.112 9.679 0.446 1.00 . A A . 11 LYS HG3 1 1 9 5520 1 1 11 LYS HZ1 H -0.746 12.306 3.633 1.00 . A A . 11 LYS HZ1 1 1 9 5521 1 1 11 LYS HZ2 H 0.253 13.477 2.924 1.00 . A A . 11 LYS HZ2 1 1 9 5522 1 1 11 LYS HZ3 H 0.410 11.853 2.479 1.00 . A A . 11 LYS HZ3 1 1 9 5523 1 1 11 LYS N N -0.813 7.562 0.818 1.00 . A A . 11 LYS N 1 1 9 5524 1 1 11 LYS NZ N -0.272 12.592 2.749 1.00 . A A . 11 LYS NZ 1 1 9 5525 1 1 11 LYS O O 2.253 8.335 2.321 1.00 . A A . 11 LYS O 1 1 9 5526 1 1 12 GLN C C 2.659 5.463 3.202 1.00 . A A . 12 GLN C 1 1 9 5527 1 1 12 GLN CA C 1.558 6.248 3.920 1.00 . A A . 12 GLN CA 1 1 9 5528 1 1 12 GLN CB C 0.710 5.350 4.790 1.00 . A A . 12 GLN CB 1 1 9 5529 1 1 12 GLN CD C 1.113 6.885 6.762 1.00 . A A . 12 GLN CD 1 1 9 5530 1 1 12 GLN CG C 0.105 6.052 5.994 1.00 . A A . 12 GLN CG 1 1 9 5531 1 1 12 GLN H H -0.225 6.548 2.915 1.00 . A A . 12 GLN H 1 1 9 5532 1 1 12 GLN HA H 2.003 7.012 4.530 1.00 . A A . 12 GLN HA 1 1 9 5533 1 1 12 GLN HB2 H -0.103 4.963 4.196 1.00 . A A . 12 GLN HB2 1 1 9 5534 1 1 12 GLN HB3 H 1.300 4.549 5.117 1.00 . A A . 12 GLN HB3 1 1 9 5535 1 1 12 GLN HE21 H 0.642 8.484 5.687 1.00 . A A . 12 GLN HE21 1 1 9 5536 1 1 12 GLN HE22 H 1.864 8.724 6.886 1.00 . A A . 12 GLN HE22 1 1 9 5537 1 1 12 GLN HG2 H -0.686 6.703 5.652 1.00 . A A . 12 GLN HG2 1 1 9 5538 1 1 12 GLN HG3 H -0.303 5.306 6.653 1.00 . A A . 12 GLN HG3 1 1 9 5539 1 1 12 GLN N N 0.696 6.885 2.989 1.00 . A A . 12 GLN N 1 1 9 5540 1 1 12 GLN NE2 N 1.216 8.157 6.411 1.00 . A A . 12 GLN NE2 1 1 9 5541 1 1 12 GLN O O 3.808 5.403 3.646 1.00 . A A . 12 GLN O 1 1 9 5542 1 1 12 GLN OE1 O 1.786 6.395 7.669 1.00 . A A . 12 GLN OE1 1 1 9 5543 1 1 13 LEU C C 4.012 4.891 0.329 1.00 . A A . 13 LEU C 1 1 9 5544 1 1 13 LEU CA C 3.257 4.075 1.339 1.00 . A A . 13 LEU CA 1 1 9 5545 1 1 13 LEU CB C 2.535 2.938 0.680 1.00 . A A . 13 LEU CB 1 1 9 5546 1 1 13 LEU CD1 C 1.184 0.877 1.007 1.00 . A A . 13 LEU CD1 1 1 9 5547 1 1 13 LEU CD2 C 2.562 1.762 2.882 1.00 . A A . 13 LEU CD2 1 1 9 5548 1 1 13 LEU CG C 1.734 2.121 1.662 1.00 . A A . 13 LEU CG 1 1 9 5549 1 1 13 LEU H H 1.444 5.073 1.678 1.00 . A A . 13 LEU H 1 1 9 5550 1 1 13 LEU HA H 3.940 3.669 2.060 1.00 . A A . 13 LEU HA 1 1 9 5551 1 1 13 LEU HB2 H 1.868 3.339 -0.071 1.00 . A A . 13 LEU HB2 1 1 9 5552 1 1 13 LEU HB3 H 3.251 2.306 0.211 1.00 . A A . 13 LEU HB3 1 1 9 5553 1 1 13 LEU HD11 H 0.618 0.311 1.732 1.00 . A A . 13 LEU HD11 1 1 9 5554 1 1 13 LEU HD12 H 2.000 0.274 0.635 1.00 . A A . 13 LEU HD12 1 1 9 5555 1 1 13 LEU HD13 H 0.539 1.158 0.186 1.00 . A A . 13 LEU HD13 1 1 9 5556 1 1 13 LEU HD21 H 2.872 2.666 3.385 1.00 . A A . 13 LEU HD21 1 1 9 5557 1 1 13 LEU HD22 H 3.434 1.202 2.573 1.00 . A A . 13 LEU HD22 1 1 9 5558 1 1 13 LEU HD23 H 1.968 1.161 3.556 1.00 . A A . 13 LEU HD23 1 1 9 5559 1 1 13 LEU HG H 0.917 2.734 1.991 1.00 . A A . 13 LEU HG 1 1 9 5560 1 1 13 LEU N N 2.327 4.908 2.055 1.00 . A A . 13 LEU N 1 1 9 5561 1 1 13 LEU O O 5.187 4.651 0.065 1.00 . A A . 13 LEU O 1 1 9 5562 1 1 14 MET C C 4.925 7.658 -0.110 1.00 . A A . 14 MET C 1 1 9 5563 1 1 14 MET CA C 3.985 6.874 -1.006 1.00 . A A . 14 MET CA 1 1 9 5564 1 1 14 MET CB C 2.942 7.776 -1.589 1.00 . A A . 14 MET CB 1 1 9 5565 1 1 14 MET CE C 1.591 4.439 -2.365 1.00 . A A . 14 MET CE 1 1 9 5566 1 1 14 MET CG C 2.126 7.116 -2.661 1.00 . A A . 14 MET CG 1 1 9 5567 1 1 14 MET H H 2.326 5.859 -0.222 1.00 . A A . 14 MET H 1 1 9 5568 1 1 14 MET HA H 4.540 6.402 -1.800 1.00 . A A . 14 MET HA 1 1 9 5569 1 1 14 MET HB2 H 2.269 8.101 -0.803 1.00 . A A . 14 MET HB2 1 1 9 5570 1 1 14 MET HB3 H 3.429 8.623 -2.013 1.00 . A A . 14 MET HB3 1 1 9 5571 1 1 14 MET HE1 H 0.589 4.717 -2.654 1.00 . A A . 14 MET HE1 1 1 9 5572 1 1 14 MET HE2 H 1.701 4.549 -1.299 1.00 . A A . 14 MET HE2 1 1 9 5573 1 1 14 MET HE3 H 1.787 3.418 -2.652 1.00 . A A . 14 MET HE3 1 1 9 5574 1 1 14 MET HG2 H 1.112 6.997 -2.322 1.00 . A A . 14 MET HG2 1 1 9 5575 1 1 14 MET HG3 H 2.145 7.747 -3.480 1.00 . A A . 14 MET HG3 1 1 9 5576 1 1 14 MET N N 3.325 5.855 -0.250 1.00 . A A . 14 MET N 1 1 9 5577 1 1 14 MET O O 5.899 8.256 -0.562 1.00 . A A . 14 MET O 1 1 9 5578 1 1 14 MET SD S 2.750 5.517 -3.171 1.00 . A A . 14 MET SD 1 1 9 5579 1 1 15 ASP C C 6.769 7.453 2.260 1.00 . A A . 15 ASP C 1 1 9 5580 1 1 15 ASP CA C 5.441 8.195 2.216 1.00 . A A . 15 ASP CA 1 1 9 5581 1 1 15 ASP CB C 4.738 8.106 3.568 1.00 . A A . 15 ASP CB 1 1 9 5582 1 1 15 ASP CG C 5.581 8.595 4.725 1.00 . A A . 15 ASP CG 1 1 9 5583 1 1 15 ASP H H 3.701 7.305 1.400 1.00 . A A . 15 ASP H 1 1 9 5584 1 1 15 ASP HA H 5.634 9.233 1.987 1.00 . A A . 15 ASP HA 1 1 9 5585 1 1 15 ASP HB2 H 3.841 8.705 3.526 1.00 . A A . 15 ASP HB2 1 1 9 5586 1 1 15 ASP HB3 H 4.459 7.073 3.747 1.00 . A A . 15 ASP HB3 1 1 9 5587 1 1 15 ASP N N 4.585 7.658 1.163 1.00 . A A . 15 ASP N 1 1 9 5588 1 1 15 ASP O O 7.813 8.076 2.446 1.00 . A A . 15 ASP O 1 1 9 5589 1 1 15 ASP OD1 O 5.567 9.815 4.995 1.00 . A A . 15 ASP OD1 1 1 9 5590 1 1 15 ASP OD2 O 6.242 7.764 5.383 1.00 . A A . 15 ASP OD2 1 1 9 5591 1 1 16 LEU C C 8.707 5.870 0.659 1.00 . A A . 16 LEU C 1 1 9 5592 1 1 16 LEU CA C 7.955 5.387 1.894 1.00 . A A . 16 LEU CA 1 1 9 5593 1 1 16 LEU CB C 7.568 3.961 1.731 1.00 . A A . 16 LEU CB 1 1 9 5594 1 1 16 LEU CD1 C 8.369 3.553 4.048 1.00 . A A . 16 LEU CD1 1 1 9 5595 1 1 16 LEU CD2 C 5.936 3.447 3.501 1.00 . A A . 16 LEU CD2 1 1 9 5596 1 1 16 LEU CG C 7.328 3.211 3.000 1.00 . A A . 16 LEU CG 1 1 9 5597 1 1 16 LEU H H 5.905 5.595 2.126 1.00 . A A . 16 LEU H 1 1 9 5598 1 1 16 LEU HA H 8.572 5.475 2.770 1.00 . A A . 16 LEU HA 1 1 9 5599 1 1 16 LEU HB2 H 6.662 3.922 1.152 1.00 . A A . 16 LEU HB2 1 1 9 5600 1 1 16 LEU HB3 H 8.318 3.472 1.194 1.00 . A A . 16 LEU HB3 1 1 9 5601 1 1 16 LEU HD11 H 8.175 2.990 4.948 1.00 . A A . 16 LEU HD11 1 1 9 5602 1 1 16 LEU HD12 H 8.319 4.612 4.266 1.00 . A A . 16 LEU HD12 1 1 9 5603 1 1 16 LEU HD13 H 9.349 3.308 3.672 1.00 . A A . 16 LEU HD13 1 1 9 5604 1 1 16 LEU HD21 H 5.241 3.160 2.731 1.00 . A A . 16 LEU HD21 1 1 9 5605 1 1 16 LEU HD22 H 5.812 4.493 3.727 1.00 . A A . 16 LEU HD22 1 1 9 5606 1 1 16 LEU HD23 H 5.763 2.857 4.388 1.00 . A A . 16 LEU HD23 1 1 9 5607 1 1 16 LEU HG H 7.413 2.195 2.768 1.00 . A A . 16 LEU HG 1 1 9 5608 1 1 16 LEU N N 6.748 6.121 2.091 1.00 . A A . 16 LEU N 1 1 9 5609 1 1 16 LEU O O 9.936 5.835 0.602 1.00 . A A . 16 LEU O 1 1 9 5610 1 1 17 GLY C C 8.127 5.989 -2.755 1.00 . A A . 17 GLY C 1 1 9 5611 1 1 17 GLY CA C 8.513 6.827 -1.558 1.00 . A A . 17 GLY CA 1 1 9 5612 1 1 17 GLY H H 6.971 6.294 -0.217 1.00 . A A . 17 GLY H 1 1 9 5613 1 1 17 GLY HA2 H 8.167 7.840 -1.710 1.00 . A A . 17 GLY HA2 1 1 9 5614 1 1 17 GLY HA3 H 9.589 6.834 -1.468 1.00 . A A . 17 GLY HA3 1 1 9 5615 1 1 17 GLY N N 7.943 6.313 -0.330 1.00 . A A . 17 GLY N 1 1 9 5616 1 1 17 GLY O O 8.759 6.066 -3.810 1.00 . A A . 17 GLY O 1 1 9 5617 1 1 18 PHE C C 5.660 4.844 -4.562 1.00 . A A . 18 PHE C 1 1 9 5618 1 1 18 PHE CA C 6.682 4.244 -3.621 1.00 . A A . 18 PHE CA 1 1 9 5619 1 1 18 PHE CB C 6.140 3.032 -2.911 1.00 . A A . 18 PHE CB 1 1 9 5620 1 1 18 PHE CD1 C 8.464 2.184 -2.723 1.00 . A A . 18 PHE CD1 1 1 9 5621 1 1 18 PHE CD2 C 6.971 2.031 -0.918 1.00 . A A . 18 PHE CD2 1 1 9 5622 1 1 18 PHE CE1 C 9.449 1.611 -1.962 1.00 . A A . 18 PHE CE1 1 1 9 5623 1 1 18 PHE CE2 C 7.915 1.484 -0.161 1.00 . A A . 18 PHE CE2 1 1 9 5624 1 1 18 PHE CG C 7.210 2.385 -2.175 1.00 . A A . 18 PHE CG 1 1 9 5625 1 1 18 PHE CZ C 9.159 1.265 -0.663 1.00 . A A . 18 PHE CZ 1 1 9 5626 1 1 18 PHE H H 6.578 5.192 -1.747 1.00 . A A . 18 PHE H 1 1 9 5627 1 1 18 PHE HA H 7.561 3.953 -4.171 1.00 . A A . 18 PHE HA 1 1 9 5628 1 1 18 PHE HB2 H 5.391 3.345 -2.198 1.00 . A A . 18 PHE HB2 1 1 9 5629 1 1 18 PHE HB3 H 5.718 2.321 -3.572 1.00 . A A . 18 PHE HB3 1 1 9 5630 1 1 18 PHE HD1 H 8.656 2.468 -3.747 1.00 . A A . 18 PHE HD1 1 1 9 5631 1 1 18 PHE HD2 H 6.014 2.188 -0.525 1.00 . A A . 18 PHE HD2 1 1 9 5632 1 1 18 PHE HE1 H 10.433 1.443 -2.371 1.00 . A A . 18 PHE HE1 1 1 9 5633 1 1 18 PHE HE2 H 7.674 1.218 0.827 1.00 . A A . 18 PHE HE2 1 1 9 5634 1 1 18 PHE HZ H 9.892 0.839 -0.044 1.00 . A A . 18 PHE HZ 1 1 9 5635 1 1 18 PHE N N 7.087 5.180 -2.595 1.00 . A A . 18 PHE N 1 1 9 5636 1 1 18 PHE O O 5.247 5.989 -4.384 1.00 . A A . 18 PHE O 1 1 9 5637 1 1 19 PRO C C 2.854 4.060 -5.896 1.00 . A A . 19 PRO C 1 1 9 5638 1 1 19 PRO CA C 4.190 4.467 -6.483 1.00 . A A . 19 PRO CA 1 1 9 5639 1 1 19 PRO CB C 4.465 3.647 -7.718 1.00 . A A . 19 PRO CB 1 1 9 5640 1 1 19 PRO CD C 5.932 2.858 -6.081 1.00 . A A . 19 PRO CD 1 1 9 5641 1 1 19 PRO CG C 4.986 2.405 -7.163 1.00 . A A . 19 PRO CG 1 1 9 5642 1 1 19 PRO HA H 4.186 5.517 -6.728 1.00 . A A . 19 PRO HA 1 1 9 5643 1 1 19 PRO HB2 H 3.560 3.493 -8.280 1.00 . A A . 19 PRO HB2 1 1 9 5644 1 1 19 PRO HB3 H 5.207 4.125 -8.321 1.00 . A A . 19 PRO HB3 1 1 9 5645 1 1 19 PRO HD2 H 5.981 2.136 -5.281 1.00 . A A . 19 PRO HD2 1 1 9 5646 1 1 19 PRO HD3 H 6.909 3.049 -6.491 1.00 . A A . 19 PRO HD3 1 1 9 5647 1 1 19 PRO HG2 H 4.183 1.804 -6.755 1.00 . A A . 19 PRO HG2 1 1 9 5648 1 1 19 PRO HG3 H 5.497 1.890 -7.928 1.00 . A A . 19 PRO HG3 1 1 9 5649 1 1 19 PRO N N 5.298 4.111 -5.620 1.00 . A A . 19 PRO N 1 1 9 5650 1 1 19 PRO O O 2.767 3.227 -4.995 1.00 . A A . 19 PRO O 1 1 9 5651 1 1 20 ARG C C 0.127 2.889 -6.303 1.00 . A A . 20 ARG C 1 1 9 5652 1 1 20 ARG CA C 0.455 4.350 -6.087 1.00 . A A . 20 ARG CA 1 1 9 5653 1 1 20 ARG CB C -0.441 5.216 -6.954 1.00 . A A . 20 ARG CB 1 1 9 5654 1 1 20 ARG CD C -2.716 5.809 -7.737 1.00 . A A . 20 ARG CD 1 1 9 5655 1 1 20 ARG CG C -1.897 4.850 -6.898 1.00 . A A . 20 ARG CG 1 1 9 5656 1 1 20 ARG CZ C -5.060 6.289 -8.291 1.00 . A A . 20 ARG CZ 1 1 9 5657 1 1 20 ARG H H 2.008 5.215 -7.214 1.00 . A A . 20 ARG H 1 1 9 5658 1 1 20 ARG HA H 0.323 4.600 -5.040 1.00 . A A . 20 ARG HA 1 1 9 5659 1 1 20 ARG HB2 H -0.334 6.237 -6.648 1.00 . A A . 20 ARG HB2 1 1 9 5660 1 1 20 ARG HB3 H -0.118 5.127 -7.977 1.00 . A A . 20 ARG HB3 1 1 9 5661 1 1 20 ARG HD2 H -2.504 6.814 -7.413 1.00 . A A . 20 ARG HD2 1 1 9 5662 1 1 20 ARG HD3 H -2.420 5.699 -8.771 1.00 . A A . 20 ARG HD3 1 1 9 5663 1 1 20 ARG HE H -4.454 4.839 -7.040 1.00 . A A . 20 ARG HE 1 1 9 5664 1 1 20 ARG HG2 H -2.016 3.848 -7.284 1.00 . A A . 20 ARG HG2 1 1 9 5665 1 1 20 ARG HG3 H -2.221 4.889 -5.881 1.00 . A A . 20 ARG HG3 1 1 9 5666 1 1 20 ARG HH11 H -3.696 7.469 -9.226 1.00 . A A . 20 ARG HH11 1 1 9 5667 1 1 20 ARG HH12 H -5.364 7.822 -9.584 1.00 . A A . 20 ARG HH12 1 1 9 5668 1 1 20 ARG HH21 H -6.655 5.295 -7.526 1.00 . A A . 20 ARG HH21 1 1 9 5669 1 1 20 ARG HH22 H -7.034 6.566 -8.646 1.00 . A A . 20 ARG HH22 1 1 9 5670 1 1 20 ARG N N 1.830 4.615 -6.471 1.00 . A A . 20 ARG N 1 1 9 5671 1 1 20 ARG NE N -4.151 5.571 -7.636 1.00 . A A . 20 ARG NE 1 1 9 5672 1 1 20 ARG NH1 N -4.677 7.265 -9.102 1.00 . A A . 20 ARG NH1 1 1 9 5673 1 1 20 ARG NH2 N -6.349 6.029 -8.142 1.00 . A A . 20 ARG NH2 1 1 9 5674 1 1 20 ARG O O -0.566 2.254 -5.508 1.00 . A A . 20 ARG O 1 1 9 5675 1 1 21 ASP C C 1.088 0.071 -6.660 1.00 . A A . 21 ASP C 1 1 9 5676 1 1 21 ASP CA C 0.503 0.971 -7.748 1.00 . A A . 21 ASP CA 1 1 9 5677 1 1 21 ASP CB C 1.186 0.680 -9.088 1.00 . A A . 21 ASP CB 1 1 9 5678 1 1 21 ASP CG C 0.558 1.435 -10.241 1.00 . A A . 21 ASP CG 1 1 9 5679 1 1 21 ASP H H 1.156 2.975 -7.983 1.00 . A A . 21 ASP H 1 1 9 5680 1 1 21 ASP HA H -0.553 0.764 -7.840 1.00 . A A . 21 ASP HA 1 1 9 5681 1 1 21 ASP HB2 H 2.226 0.964 -9.022 1.00 . A A . 21 ASP HB2 1 1 9 5682 1 1 21 ASP HB3 H 1.119 -0.379 -9.296 1.00 . A A . 21 ASP HB3 1 1 9 5683 1 1 21 ASP N N 0.653 2.377 -7.392 1.00 . A A . 21 ASP N 1 1 9 5684 1 1 21 ASP O O 0.679 -1.079 -6.513 1.00 . A A . 21 ASP O 1 1 9 5685 1 1 21 ASP OD1 O -0.387 0.908 -10.863 1.00 . A A . 21 ASP OD1 1 1 9 5686 1 1 21 ASP OD2 O 1.011 2.562 -10.538 1.00 . A A . 21 ASP OD2 1 1 9 5687 1 1 22 ALA C C 1.671 -0.314 -3.639 1.00 . A A . 22 ALA C 1 1 9 5688 1 1 22 ALA CA C 2.642 -0.152 -4.799 1.00 . A A . 22 ALA CA 1 1 9 5689 1 1 22 ALA CB C 3.929 0.504 -4.325 1.00 . A A . 22 ALA CB 1 1 9 5690 1 1 22 ALA H H 2.310 1.533 -6.039 1.00 . A A . 22 ALA H 1 1 9 5691 1 1 22 ALA HA H 2.889 -1.132 -5.181 1.00 . A A . 22 ALA HA 1 1 9 5692 1 1 22 ALA HB1 H 4.613 0.595 -5.155 1.00 . A A . 22 ALA HB1 1 1 9 5693 1 1 22 ALA HB2 H 4.378 -0.102 -3.553 1.00 . A A . 22 ALA HB2 1 1 9 5694 1 1 22 ALA HB3 H 3.709 1.485 -3.929 1.00 . A A . 22 ALA HB3 1 1 9 5695 1 1 22 ALA N N 2.029 0.605 -5.884 1.00 . A A . 22 ALA N 1 1 9 5696 1 1 22 ALA O O 1.693 -1.338 -2.954 1.00 . A A . 22 ALA O 1 1 9 5697 1 1 23 VAL C C -1.123 -0.584 -2.853 1.00 . A A . 23 VAL C 1 1 9 5698 1 1 23 VAL CA C -0.234 0.551 -2.423 1.00 . A A . 23 VAL CA 1 1 9 5699 1 1 23 VAL CB C -1.059 1.861 -2.255 1.00 . A A . 23 VAL CB 1 1 9 5700 1 1 23 VAL CG1 C -2.405 1.773 -2.920 1.00 . A A . 23 VAL CG1 1 1 9 5701 1 1 23 VAL CG2 C -1.250 2.202 -0.806 1.00 . A A . 23 VAL CG2 1 1 9 5702 1 1 23 VAL H H 0.851 1.504 -3.956 1.00 . A A . 23 VAL H 1 1 9 5703 1 1 23 VAL HA H 0.209 0.298 -1.487 1.00 . A A . 23 VAL HA 1 1 9 5704 1 1 23 VAL HB H -0.512 2.663 -2.722 1.00 . A A . 23 VAL HB 1 1 9 5705 1 1 23 VAL HG11 H -2.983 2.665 -2.708 1.00 . A A . 23 VAL HG11 1 1 9 5706 1 1 23 VAL HG12 H -2.922 0.904 -2.542 1.00 . A A . 23 VAL HG12 1 1 9 5707 1 1 23 VAL HG13 H -2.253 1.676 -3.983 1.00 . A A . 23 VAL HG13 1 1 9 5708 1 1 23 VAL HG21 H -2.222 2.663 -0.675 1.00 . A A . 23 VAL HG21 1 1 9 5709 1 1 23 VAL HG22 H -0.468 2.885 -0.489 1.00 . A A . 23 VAL HG22 1 1 9 5710 1 1 23 VAL HG23 H -1.204 1.297 -0.224 1.00 . A A . 23 VAL HG23 1 1 9 5711 1 1 23 VAL N N 0.806 0.684 -3.421 1.00 . A A . 23 VAL N 1 1 9 5712 1 1 23 VAL O O -1.411 -1.496 -2.116 1.00 . A A . 23 VAL O 1 1 9 5713 1 1 24 VAL C C -1.885 -2.916 -4.608 1.00 . A A . 24 VAL C 1 1 9 5714 1 1 24 VAL CA C -2.422 -1.496 -4.611 1.00 . A A . 24 VAL CA 1 1 9 5715 1 1 24 VAL CB C -2.888 -1.077 -6.004 1.00 . A A . 24 VAL CB 1 1 9 5716 1 1 24 VAL CG1 C -3.547 -2.237 -6.725 1.00 . A A . 24 VAL CG1 1 1 9 5717 1 1 24 VAL CG2 C -3.849 0.091 -5.889 1.00 . A A . 24 VAL CG2 1 1 9 5718 1 1 24 VAL H H -1.151 0.189 -4.653 1.00 . A A . 24 VAL H 1 1 9 5719 1 1 24 VAL HA H -3.274 -1.479 -3.951 1.00 . A A . 24 VAL HA 1 1 9 5720 1 1 24 VAL HB H -2.018 -0.749 -6.562 1.00 . A A . 24 VAL HB 1 1 9 5721 1 1 24 VAL HG11 H -3.950 -1.899 -7.667 1.00 . A A . 24 VAL HG11 1 1 9 5722 1 1 24 VAL HG12 H -4.344 -2.632 -6.107 1.00 . A A . 24 VAL HG12 1 1 9 5723 1 1 24 VAL HG13 H -2.815 -3.012 -6.899 1.00 . A A . 24 VAL HG13 1 1 9 5724 1 1 24 VAL HG21 H -4.652 -0.174 -5.215 1.00 . A A . 24 VAL HG21 1 1 9 5725 1 1 24 VAL HG22 H -4.253 0.324 -6.862 1.00 . A A . 24 VAL HG22 1 1 9 5726 1 1 24 VAL HG23 H -3.323 0.950 -5.501 1.00 . A A . 24 VAL HG23 1 1 9 5727 1 1 24 VAL N N -1.486 -0.545 -4.090 1.00 . A A . 24 VAL N 1 1 9 5728 1 1 24 VAL O O -2.578 -3.817 -4.156 1.00 . A A . 24 VAL O 1 1 9 5729 1 1 25 LYS C C -0.058 -5.014 -3.657 1.00 . A A . 25 LYS C 1 1 9 5730 1 1 25 LYS CA C -0.094 -4.462 -5.067 1.00 . A A . 25 LYS CA 1 1 9 5731 1 1 25 LYS CB C 1.322 -4.448 -5.627 1.00 . A A . 25 LYS CB 1 1 9 5732 1 1 25 LYS CD C 2.846 -3.917 -7.517 1.00 . A A . 25 LYS CD 1 1 9 5733 1 1 25 LYS CE C 2.967 -3.654 -9.005 1.00 . A A . 25 LYS CE 1 1 9 5734 1 1 25 LYS CG C 1.404 -4.105 -7.099 1.00 . A A . 25 LYS CG 1 1 9 5735 1 1 25 LYS H H -0.120 -2.365 -5.385 1.00 . A A . 25 LYS H 1 1 9 5736 1 1 25 LYS HA H -0.717 -5.093 -5.681 1.00 . A A . 25 LYS HA 1 1 9 5737 1 1 25 LYS HB2 H 1.903 -3.721 -5.079 1.00 . A A . 25 LYS HB2 1 1 9 5738 1 1 25 LYS HB3 H 1.761 -5.425 -5.482 1.00 . A A . 25 LYS HB3 1 1 9 5739 1 1 25 LYS HD2 H 3.250 -3.074 -6.977 1.00 . A A . 25 LYS HD2 1 1 9 5740 1 1 25 LYS HD3 H 3.403 -4.809 -7.270 1.00 . A A . 25 LYS HD3 1 1 9 5741 1 1 25 LYS HE2 H 2.495 -4.463 -9.540 1.00 . A A . 25 LYS HE2 1 1 9 5742 1 1 25 LYS HE3 H 2.460 -2.728 -9.239 1.00 . A A . 25 LYS HE3 1 1 9 5743 1 1 25 LYS HG2 H 0.971 -4.908 -7.676 1.00 . A A . 25 LYS HG2 1 1 9 5744 1 1 25 LYS HG3 H 0.861 -3.190 -7.280 1.00 . A A . 25 LYS HG3 1 1 9 5745 1 1 25 LYS HZ1 H 4.428 -3.343 -10.460 1.00 . A A . 25 LYS HZ1 1 1 9 5746 1 1 25 LYS HZ2 H 4.881 -4.449 -9.256 1.00 . A A . 25 LYS HZ2 1 1 9 5747 1 1 25 LYS HZ3 H 4.865 -2.789 -8.916 1.00 . A A . 25 LYS HZ3 1 1 9 5748 1 1 25 LYS N N -0.660 -3.123 -5.061 1.00 . A A . 25 LYS N 1 1 9 5749 1 1 25 LYS NZ N 4.382 -3.551 -9.438 1.00 . A A . 25 LYS NZ 1 1 9 5750 1 1 25 LYS O O -0.441 -6.162 -3.397 1.00 . A A . 25 LYS O 1 1 9 5751 1 1 26 ALA C C -0.612 -4.737 -0.600 1.00 . A A . 26 ALA C 1 1 9 5752 1 1 26 ALA CA C 0.652 -4.625 -1.401 1.00 . A A . 26 ALA CA 1 1 9 5753 1 1 26 ALA CB C 1.650 -3.702 -0.733 1.00 . A A . 26 ALA CB 1 1 9 5754 1 1 26 ALA H H 0.430 -3.202 -2.945 1.00 . A A . 26 ALA H 1 1 9 5755 1 1 26 ALA HA H 1.088 -5.610 -1.475 1.00 . A A . 26 ALA HA 1 1 9 5756 1 1 26 ALA HB1 H 1.882 -4.074 0.257 1.00 . A A . 26 ALA HB1 1 1 9 5757 1 1 26 ALA HB2 H 1.227 -2.711 -0.655 1.00 . A A . 26 ALA HB2 1 1 9 5758 1 1 26 ALA HB3 H 2.553 -3.661 -1.323 1.00 . A A . 26 ALA HB3 1 1 9 5759 1 1 26 ALA N N 0.366 -4.171 -2.734 1.00 . A A . 26 ALA N 1 1 9 5760 1 1 26 ALA O O -0.814 -5.708 0.119 1.00 . A A . 26 ALA O 1 1 9 5761 1 1 27 LEU C C -3.632 -4.767 -0.550 1.00 . A A . 27 LEU C 1 1 9 5762 1 1 27 LEU CA C -2.690 -3.715 0.006 1.00 . A A . 27 LEU CA 1 1 9 5763 1 1 27 LEU CB C -3.294 -2.315 -0.058 1.00 . A A . 27 LEU CB 1 1 9 5764 1 1 27 LEU CD1 C -2.992 -1.152 2.122 1.00 . A A . 27 LEU CD1 1 1 9 5765 1 1 27 LEU CD2 C -1.098 -1.377 0.638 1.00 . A A . 27 LEU CD2 1 1 9 5766 1 1 27 LEU CG C -2.568 -1.199 0.693 1.00 . A A . 27 LEU CG 1 1 9 5767 1 1 27 LEU H H -1.279 -3.011 -1.364 1.00 . A A . 27 LEU H 1 1 9 5768 1 1 27 LEU HA H -2.462 -3.954 1.032 1.00 . A A . 27 LEU HA 1 1 9 5769 1 1 27 LEU HB2 H -3.323 -2.025 -1.089 1.00 . A A . 27 LEU HB2 1 1 9 5770 1 1 27 LEU HB3 H -4.307 -2.366 0.311 1.00 . A A . 27 LEU HB3 1 1 9 5771 1 1 27 LEU HD11 H -2.474 -0.352 2.624 1.00 . A A . 27 LEU HD11 1 1 9 5772 1 1 27 LEU HD12 H -2.749 -2.094 2.586 1.00 . A A . 27 LEU HD12 1 1 9 5773 1 1 27 LEU HD13 H -4.056 -0.987 2.171 1.00 . A A . 27 LEU HD13 1 1 9 5774 1 1 27 LEU HD21 H -0.845 -2.295 1.145 1.00 . A A . 27 LEU HD21 1 1 9 5775 1 1 27 LEU HD22 H -0.608 -0.545 1.115 1.00 . A A . 27 LEU HD22 1 1 9 5776 1 1 27 LEU HD23 H -0.798 -1.445 -0.396 1.00 . A A . 27 LEU HD23 1 1 9 5777 1 1 27 LEU HG H -2.789 -0.265 0.229 1.00 . A A . 27 LEU HG 1 1 9 5778 1 1 27 LEU N N -1.470 -3.756 -0.739 1.00 . A A . 27 LEU N 1 1 9 5779 1 1 27 LEU O O -4.484 -5.269 0.143 1.00 . A A . 27 LEU O 1 1 9 5780 1 1 28 LYS C C -3.884 -7.497 -1.654 1.00 . A A . 28 LYS C 1 1 9 5781 1 1 28 LYS CA C -4.202 -6.213 -2.401 1.00 . A A . 28 LYS CA 1 1 9 5782 1 1 28 LYS CB C -3.877 -6.391 -3.872 1.00 . A A . 28 LYS CB 1 1 9 5783 1 1 28 LYS CD C -4.444 -5.684 -6.182 1.00 . A A . 28 LYS CD 1 1 9 5784 1 1 28 LYS CE C -5.530 -5.161 -7.109 1.00 . A A . 28 LYS CE 1 1 9 5785 1 1 28 LYS CG C -4.951 -5.834 -4.774 1.00 . A A . 28 LYS CG 1 1 9 5786 1 1 28 LYS H H -2.935 -4.517 -2.405 1.00 . A A . 28 LYS H 1 1 9 5787 1 1 28 LYS HA H -5.257 -6.013 -2.311 1.00 . A A . 28 LYS HA 1 1 9 5788 1 1 28 LYS HB2 H -2.948 -5.887 -4.091 1.00 . A A . 28 LYS HB2 1 1 9 5789 1 1 28 LYS HB3 H -3.768 -7.444 -4.083 1.00 . A A . 28 LYS HB3 1 1 9 5790 1 1 28 LYS HD2 H -3.623 -4.986 -6.159 1.00 . A A . 28 LYS HD2 1 1 9 5791 1 1 28 LYS HD3 H -4.098 -6.644 -6.541 1.00 . A A . 28 LYS HD3 1 1 9 5792 1 1 28 LYS HE2 H -5.820 -4.174 -6.780 1.00 . A A . 28 LYS HE2 1 1 9 5793 1 1 28 LYS HE3 H -5.133 -5.102 -8.112 1.00 . A A . 28 LYS HE3 1 1 9 5794 1 1 28 LYS HG2 H -5.799 -6.502 -4.773 1.00 . A A . 28 LYS HG2 1 1 9 5795 1 1 28 LYS HG3 H -5.250 -4.862 -4.406 1.00 . A A . 28 LYS HG3 1 1 9 5796 1 1 28 LYS HZ1 H -6.469 -7.008 -7.400 1.00 . A A . 28 LYS HZ1 1 1 9 5797 1 1 28 LYS HZ2 H -7.444 -5.674 -7.778 1.00 . A A . 28 LYS HZ2 1 1 9 5798 1 1 28 LYS HZ3 H -7.154 -6.080 -6.160 1.00 . A A . 28 LYS HZ3 1 1 9 5799 1 1 28 LYS N N -3.493 -5.079 -1.829 1.00 . A A . 28 LYS N 1 1 9 5800 1 1 28 LYS NZ N -6.730 -6.040 -7.113 1.00 . A A . 28 LYS NZ 1 1 9 5801 1 1 28 LYS O O -4.798 -8.208 -1.231 1.00 . A A . 28 LYS O 1 1 9 5802 1 1 29 GLN C C -2.448 -9.034 0.650 1.00 . A A . 29 GLN C 1 1 9 5803 1 1 29 GLN CA C -2.241 -9.057 -0.858 1.00 . A A . 29 GLN CA 1 1 9 5804 1 1 29 GLN CB C -0.816 -9.380 -1.233 1.00 . A A . 29 GLN CB 1 1 9 5805 1 1 29 GLN CD C 1.454 -8.469 -1.684 1.00 . A A . 29 GLN CD 1 1 9 5806 1 1 29 GLN CG C 0.220 -8.370 -0.817 1.00 . A A . 29 GLN CG 1 1 9 5807 1 1 29 GLN H H -1.877 -7.180 -1.763 1.00 . A A . 29 GLN H 1 1 9 5808 1 1 29 GLN HA H -2.884 -9.816 -1.277 1.00 . A A . 29 GLN HA 1 1 9 5809 1 1 29 GLN HB2 H -0.558 -10.309 -0.806 1.00 . A A . 29 GLN HB2 1 1 9 5810 1 1 29 GLN HB3 H -0.768 -9.458 -2.287 1.00 . A A . 29 GLN HB3 1 1 9 5811 1 1 29 GLN HE21 H 1.766 -6.527 -1.518 1.00 . A A . 29 GLN HE21 1 1 9 5812 1 1 29 GLN HE22 H 2.886 -7.389 -2.502 1.00 . A A . 29 GLN HE22 1 1 9 5813 1 1 29 GLN HG2 H -0.193 -7.376 -0.900 1.00 . A A . 29 GLN HG2 1 1 9 5814 1 1 29 GLN HG3 H 0.493 -8.567 0.198 1.00 . A A . 29 GLN HG3 1 1 9 5815 1 1 29 GLN N N -2.601 -7.802 -1.468 1.00 . A A . 29 GLN N 1 1 9 5816 1 1 29 GLN NE2 N 2.105 -7.350 -1.916 1.00 . A A . 29 GLN NE2 1 1 9 5817 1 1 29 GLN O O -2.750 -10.054 1.266 1.00 . A A . 29 GLN O 1 1 9 5818 1 1 29 GLN OE1 O 1.813 -9.546 -2.159 1.00 . A A . 29 GLN OE1 1 1 9 5819 1 1 30 THR C C -3.968 -7.380 2.996 1.00 . A A . 30 THR C 1 1 9 5820 1 1 30 THR CA C -2.509 -7.669 2.653 1.00 . A A . 30 THR CA 1 1 9 5821 1 1 30 THR CB C -1.668 -6.498 3.152 1.00 . A A . 30 THR CB 1 1 9 5822 1 1 30 THR CG2 C -0.189 -6.824 3.061 1.00 . A A . 30 THR CG2 1 1 9 5823 1 1 30 THR H H -1.973 -7.115 0.687 1.00 . A A . 30 THR H 1 1 9 5824 1 1 30 THR HA H -2.192 -8.559 3.172 1.00 . A A . 30 THR HA 1 1 9 5825 1 1 30 THR HB H -1.927 -6.308 4.174 1.00 . A A . 30 THR HB 1 1 9 5826 1 1 30 THR HG1 H -1.368 -5.285 1.628 1.00 . A A . 30 THR HG1 1 1 9 5827 1 1 30 THR HG21 H 0.023 -7.707 3.645 1.00 . A A . 30 THR HG21 1 1 9 5828 1 1 30 THR HG22 H 0.388 -5.993 3.441 1.00 . A A . 30 THR HG22 1 1 9 5829 1 1 30 THR HG23 H 0.074 -7.003 2.026 1.00 . A A . 30 THR HG23 1 1 9 5830 1 1 30 THR N N -2.293 -7.866 1.228 1.00 . A A . 30 THR N 1 1 9 5831 1 1 30 THR O O -4.365 -7.401 4.161 1.00 . A A . 30 THR O 1 1 9 5832 1 1 30 THR OG1 O -1.962 -5.326 2.390 1.00 . A A . 30 THR OG1 1 1 9 5833 1 1 31 ASN C C -6.249 -5.322 2.791 1.00 . A A . 31 ASN C 1 1 9 5834 1 1 31 ASN CA C -6.136 -6.678 2.098 1.00 . A A . 31 ASN CA 1 1 9 5835 1 1 31 ASN CB C -6.997 -7.722 2.823 1.00 . A A . 31 ASN CB 1 1 9 5836 1 1 31 ASN CG C -7.339 -8.911 1.946 1.00 . A A . 31 ASN CG 1 1 9 5837 1 1 31 ASN H H -4.368 -7.182 1.062 1.00 . A A . 31 ASN H 1 1 9 5838 1 1 31 ASN HA H -6.519 -6.561 1.092 1.00 . A A . 31 ASN HA 1 1 9 5839 1 1 31 ASN HB2 H -6.463 -8.083 3.690 1.00 . A A . 31 ASN HB2 1 1 9 5840 1 1 31 ASN HB3 H -7.918 -7.260 3.142 1.00 . A A . 31 ASN HB3 1 1 9 5841 1 1 31 ASN HD21 H -5.749 -9.902 2.604 1.00 . A A . 31 ASN HD21 1 1 9 5842 1 1 31 ASN HD22 H -6.728 -10.733 1.442 1.00 . A A . 31 ASN HD22 1 1 9 5843 1 1 31 ASN N N -4.746 -7.105 1.964 1.00 . A A . 31 ASN N 1 1 9 5844 1 1 31 ASN ND2 N -6.522 -9.951 2.004 1.00 . A A . 31 ASN ND2 1 1 9 5845 1 1 31 ASN O O -6.941 -5.181 3.797 1.00 . A A . 31 ASN O 1 1 9 5846 1 1 31 ASN OD1 O -8.340 -8.896 1.229 1.00 . A A . 31 ASN OD1 1 1 9 5847 1 1 32 GLY C C -5.158 -2.504 3.941 1.00 . A A . 32 GLY C 1 1 9 5848 1 1 32 GLY CA C -5.804 -2.959 2.632 1.00 . A A . 32 GLY CA 1 1 9 5849 1 1 32 GLY H H -4.922 -4.503 1.501 1.00 . A A . 32 GLY H 1 1 9 5850 1 1 32 GLY HA2 H -5.433 -2.331 1.825 1.00 . A A . 32 GLY HA2 1 1 9 5851 1 1 32 GLY HA3 H -6.873 -2.811 2.706 1.00 . A A . 32 GLY HA3 1 1 9 5852 1 1 32 GLY N N -5.569 -4.320 2.239 1.00 . A A . 32 GLY N 1 1 9 5853 1 1 32 GLY O O -5.371 -1.358 4.337 1.00 . A A . 32 GLY O 1 1 9 5854 1 1 33 ASN C C -2.266 -2.411 5.493 1.00 . A A . 33 ASN C 1 1 9 5855 1 1 33 ASN CA C -3.696 -2.867 5.824 1.00 . A A . 33 ASN CA 1 1 9 5856 1 1 33 ASN CB C -3.782 -3.891 6.965 1.00 . A A . 33 ASN CB 1 1 9 5857 1 1 33 ASN CG C -2.776 -5.028 6.942 1.00 . A A . 33 ASN CG 1 1 9 5858 1 1 33 ASN H H -4.329 -4.285 4.400 1.00 . A A . 33 ASN H 1 1 9 5859 1 1 33 ASN HA H -4.230 -1.992 6.136 1.00 . A A . 33 ASN HA 1 1 9 5860 1 1 33 ASN HB2 H -3.665 -3.374 7.881 1.00 . A A . 33 ASN HB2 1 1 9 5861 1 1 33 ASN HB3 H -4.774 -4.326 6.944 1.00 . A A . 33 ASN HB3 1 1 9 5862 1 1 33 ASN HD21 H -2.687 -4.961 4.981 1.00 . A A . 33 ASN HD21 1 1 9 5863 1 1 33 ASN HD22 H -1.731 -6.194 5.737 1.00 . A A . 33 ASN HD22 1 1 9 5864 1 1 33 ASN N N -4.389 -3.346 4.641 1.00 . A A . 33 ASN N 1 1 9 5865 1 1 33 ASN ND2 N -2.351 -5.428 5.773 1.00 . A A . 33 ASN ND2 1 1 9 5866 1 1 33 ASN O O -1.458 -3.142 4.921 1.00 . A A . 33 ASN O 1 1 9 5867 1 1 33 ASN OD1 O -2.387 -5.536 7.991 1.00 . A A . 33 ASN OD1 1 1 9 5868 1 1 34 ALA C C 0.508 -0.935 5.760 1.00 . A A . 34 ALA C 1 1 9 5869 1 1 34 ALA CA C -0.844 -0.417 5.306 1.00 . A A . 34 ALA CA 1 1 9 5870 1 1 34 ALA CB C -0.970 1.058 5.643 1.00 . A A . 34 ALA CB 1 1 9 5871 1 1 34 ALA H H -2.629 -0.678 6.415 1.00 . A A . 34 ALA H 1 1 9 5872 1 1 34 ALA HA H -0.876 -0.504 4.237 1.00 . A A . 34 ALA HA 1 1 9 5873 1 1 34 ALA HB1 H -0.868 1.196 6.711 1.00 . A A . 34 ALA HB1 1 1 9 5874 1 1 34 ALA HB2 H -1.939 1.418 5.326 1.00 . A A . 34 ALA HB2 1 1 9 5875 1 1 34 ALA HB3 H -0.197 1.612 5.133 1.00 . A A . 34 ALA HB3 1 1 9 5876 1 1 34 ALA N N -1.999 -1.150 5.826 1.00 . A A . 34 ALA N 1 1 9 5877 1 1 34 ALA O O 1.358 -1.228 4.920 1.00 . A A . 34 ALA O 1 1 9 5878 1 1 35 GLU C C 2.599 -2.595 7.059 1.00 . A A . 35 GLU C 1 1 9 5879 1 1 35 GLU CA C 2.014 -1.316 7.598 1.00 . A A . 35 GLU CA 1 1 9 5880 1 1 35 GLU CB C 1.909 -1.354 9.097 1.00 . A A . 35 GLU CB 1 1 9 5881 1 1 35 GLU CD C 3.478 0.511 9.683 1.00 . A A . 35 GLU CD 1 1 9 5882 1 1 35 GLU CG C 2.056 -0.005 9.715 1.00 . A A . 35 GLU CG 1 1 9 5883 1 1 35 GLU H H 0.013 -0.890 7.695 1.00 . A A . 35 GLU H 1 1 9 5884 1 1 35 GLU HA H 2.620 -0.525 7.335 1.00 . A A . 35 GLU HA 1 1 9 5885 1 1 35 GLU HB2 H 0.943 -1.730 9.375 1.00 . A A . 35 GLU HB2 1 1 9 5886 1 1 35 GLU HB3 H 2.660 -1.990 9.485 1.00 . A A . 35 GLU HB3 1 1 9 5887 1 1 35 GLU HG2 H 1.425 0.675 9.180 1.00 . A A . 35 GLU HG2 1 1 9 5888 1 1 35 GLU HG3 H 1.732 -0.072 10.720 1.00 . A A . 35 GLU HG3 1 1 9 5889 1 1 35 GLU N N 0.729 -1.023 7.063 1.00 . A A . 35 GLU N 1 1 9 5890 1 1 35 GLU O O 3.769 -2.676 6.668 1.00 . A A . 35 GLU O 1 1 9 5891 1 1 35 GLU OE1 O 4.270 0.156 10.580 1.00 . A A . 35 GLU OE1 1 1 9 5892 1 1 35 GLU OE2 O 3.816 1.269 8.752 1.00 . A A . 35 GLU OE2 1 1 9 5893 1 1 36 PHE C C 2.361 -4.878 5.090 1.00 . A A . 36 PHE C 1 1 9 5894 1 1 36 PHE CA C 2.103 -4.875 6.575 1.00 . A A . 36 PHE CA 1 1 9 5895 1 1 36 PHE CB C 0.951 -5.790 6.918 1.00 . A A . 36 PHE CB 1 1 9 5896 1 1 36 PHE CD1 C 1.085 -5.221 9.323 1.00 . A A . 36 PHE CD1 1 1 9 5897 1 1 36 PHE CD2 C 0.770 -7.504 8.746 1.00 . A A . 36 PHE CD2 1 1 9 5898 1 1 36 PHE CE1 C 1.085 -5.534 10.634 1.00 . A A . 36 PHE CE1 1 1 9 5899 1 1 36 PHE CE2 C 0.766 -7.837 10.088 1.00 . A A . 36 PHE CE2 1 1 9 5900 1 1 36 PHE CG C 0.931 -6.184 8.355 1.00 . A A . 36 PHE CG 1 1 9 5901 1 1 36 PHE CZ C 0.924 -6.844 11.038 1.00 . A A . 36 PHE CZ 1 1 9 5902 1 1 36 PHE H H 0.837 -3.406 7.275 1.00 . A A . 36 PHE H 1 1 9 5903 1 1 36 PHE HA H 2.990 -5.185 7.104 1.00 . A A . 36 PHE HA 1 1 9 5904 1 1 36 PHE HB2 H 0.023 -5.279 6.701 1.00 . A A . 36 PHE HB2 1 1 9 5905 1 1 36 PHE HB3 H 1.015 -6.652 6.324 1.00 . A A . 36 PHE HB3 1 1 9 5906 1 1 36 PHE HD1 H 1.208 -4.194 9.038 1.00 . A A . 36 PHE HD1 1 1 9 5907 1 1 36 PHE HD2 H 0.649 -8.271 7.995 1.00 . A A . 36 PHE HD2 1 1 9 5908 1 1 36 PHE HE1 H 1.213 -4.745 11.338 1.00 . A A . 36 PHE HE1 1 1 9 5909 1 1 36 PHE HE2 H 0.638 -8.866 10.391 1.00 . A A . 36 PHE HE2 1 1 9 5910 1 1 36 PHE HZ H 0.924 -7.093 12.088 1.00 . A A . 36 PHE HZ 1 1 9 5911 1 1 36 PHE N N 1.752 -3.570 7.011 1.00 . A A . 36 PHE N 1 1 9 5912 1 1 36 PHE O O 3.256 -5.560 4.600 1.00 . A A . 36 PHE O 1 1 9 5913 1 1 37 ALA C C 2.954 -3.387 2.513 1.00 . A A . 37 ALA C 1 1 9 5914 1 1 37 ALA CA C 1.660 -4.026 2.956 1.00 . A A . 37 ALA CA 1 1 9 5915 1 1 37 ALA CB C 0.489 -3.257 2.433 1.00 . A A . 37 ALA CB 1 1 9 5916 1 1 37 ALA H H 0.933 -3.493 4.848 1.00 . A A . 37 ALA H 1 1 9 5917 1 1 37 ALA HA H 1.606 -5.034 2.569 1.00 . A A . 37 ALA HA 1 1 9 5918 1 1 37 ALA HB1 H 0.514 -3.252 1.355 1.00 . A A . 37 ALA HB1 1 1 9 5919 1 1 37 ALA HB2 H 0.538 -2.242 2.800 1.00 . A A . 37 ALA HB2 1 1 9 5920 1 1 37 ALA HB3 H -0.426 -3.720 2.770 1.00 . A A . 37 ALA HB3 1 1 9 5921 1 1 37 ALA N N 1.580 -4.084 4.386 1.00 . A A . 37 ALA N 1 1 9 5922 1 1 37 ALA O O 3.580 -3.845 1.580 1.00 . A A . 37 ALA O 1 1 9 5923 1 1 38 ALA C C 5.743 -2.578 3.084 1.00 . A A . 38 ALA C 1 1 9 5924 1 1 38 ALA CA C 4.581 -1.639 2.903 1.00 . A A . 38 ALA CA 1 1 9 5925 1 1 38 ALA CB C 4.757 -0.445 3.813 1.00 . A A . 38 ALA CB 1 1 9 5926 1 1 38 ALA H H 2.752 -1.974 3.877 1.00 . A A . 38 ALA H 1 1 9 5927 1 1 38 ALA HA H 4.557 -1.291 1.881 1.00 . A A . 38 ALA HA 1 1 9 5928 1 1 38 ALA HB1 H 4.819 -0.781 4.837 1.00 . A A . 38 ALA HB1 1 1 9 5929 1 1 38 ALA HB2 H 3.916 0.219 3.700 1.00 . A A . 38 ALA HB2 1 1 9 5930 1 1 38 ALA HB3 H 5.666 0.073 3.550 1.00 . A A . 38 ALA HB3 1 1 9 5931 1 1 38 ALA N N 3.335 -2.321 3.184 1.00 . A A . 38 ALA N 1 1 9 5932 1 1 38 ALA O O 6.616 -2.668 2.236 1.00 . A A . 38 ALA O 1 1 9 5933 1 1 39 SER C C 6.873 -5.343 3.582 1.00 . A A . 39 SER C 1 1 9 5934 1 1 39 SER CA C 6.813 -4.175 4.537 1.00 . A A . 39 SER CA 1 1 9 5935 1 1 39 SER CB C 6.634 -4.652 5.977 1.00 . A A . 39 SER CB 1 1 9 5936 1 1 39 SER H H 4.870 -3.406 4.665 1.00 . A A . 39 SER H 1 1 9 5937 1 1 39 SER HA H 7.719 -3.595 4.454 1.00 . A A . 39 SER HA 1 1 9 5938 1 1 39 SER HB2 H 5.740 -5.253 6.044 1.00 . A A . 39 SER HB2 1 1 9 5939 1 1 39 SER HB3 H 7.490 -5.242 6.271 1.00 . A A . 39 SER HB3 1 1 9 5940 1 1 39 SER HG H 5.661 -3.108 6.713 1.00 . A A . 39 SER HG 1 1 9 5941 1 1 39 SER N N 5.699 -3.340 4.156 1.00 . A A . 39 SER N 1 1 9 5942 1 1 39 SER O O 7.919 -5.952 3.356 1.00 . A A . 39 SER O 1 1 9 5943 1 1 39 SER OG O 6.507 -3.551 6.866 1.00 . A A . 39 SER OG 1 1 9 5944 1 1 40 LEU C C 6.013 -6.131 0.693 1.00 . A A . 40 LEU C 1 1 9 5945 1 1 40 LEU CA C 5.589 -6.655 2.044 1.00 . A A . 40 LEU CA 1 1 9 5946 1 1 40 LEU CB C 4.143 -7.100 2.052 1.00 . A A . 40 LEU CB 1 1 9 5947 1 1 40 LEU CD1 C 2.429 -8.896 1.798 1.00 . A A . 40 LEU CD1 1 1 9 5948 1 1 40 LEU CD2 C 4.327 -8.767 0.182 1.00 . A A . 40 LEU CD2 1 1 9 5949 1 1 40 LEU CG C 3.891 -8.544 1.616 1.00 . A A . 40 LEU CG 1 1 9 5950 1 1 40 LEU H H 4.928 -5.094 3.222 1.00 . A A . 40 LEU H 1 1 9 5951 1 1 40 LEU HA H 6.223 -7.476 2.316 1.00 . A A . 40 LEU HA 1 1 9 5952 1 1 40 LEU HB2 H 3.772 -6.983 3.058 1.00 . A A . 40 LEU HB2 1 1 9 5953 1 1 40 LEU HB3 H 3.593 -6.429 1.415 1.00 . A A . 40 LEU HB3 1 1 9 5954 1 1 40 LEU HD11 H 1.829 -8.282 1.142 1.00 . A A . 40 LEU HD11 1 1 9 5955 1 1 40 LEU HD12 H 2.144 -8.713 2.822 1.00 . A A . 40 LEU HD12 1 1 9 5956 1 1 40 LEU HD13 H 2.275 -9.938 1.559 1.00 . A A . 40 LEU HD13 1 1 9 5957 1 1 40 LEU HD21 H 5.372 -8.504 0.088 1.00 . A A . 40 LEU HD21 1 1 9 5958 1 1 40 LEU HD22 H 3.739 -8.143 -0.474 1.00 . A A . 40 LEU HD22 1 1 9 5959 1 1 40 LEU HD23 H 4.188 -9.804 -0.081 1.00 . A A . 40 LEU HD23 1 1 9 5960 1 1 40 LEU HG H 4.469 -9.203 2.248 1.00 . A A . 40 LEU HG 1 1 9 5961 1 1 40 LEU N N 5.725 -5.621 3.002 1.00 . A A . 40 LEU N 1 1 9 5962 1 1 40 LEU O O 6.769 -6.789 -0.008 1.00 . A A . 40 LEU O 1 1 9 5963 1 1 41 LEU C C 7.399 -4.137 -0.998 1.00 . A A . 41 LEU C 1 1 9 5964 1 1 41 LEU CA C 5.897 -4.352 -0.930 1.00 . A A . 41 LEU CA 1 1 9 5965 1 1 41 LEU CB C 5.042 -3.113 -1.205 1.00 . A A . 41 LEU CB 1 1 9 5966 1 1 41 LEU CD1 C 6.667 -1.274 -1.064 1.00 . A A . 41 LEU CD1 1 1 9 5967 1 1 41 LEU CD2 C 4.269 -0.854 -0.568 1.00 . A A . 41 LEU CD2 1 1 9 5968 1 1 41 LEU CG C 5.410 -1.838 -0.483 1.00 . A A . 41 LEU CG 1 1 9 5969 1 1 41 LEU H H 5.074 -4.348 1.005 1.00 . A A . 41 LEU H 1 1 9 5970 1 1 41 LEU HA H 5.649 -5.085 -1.658 1.00 . A A . 41 LEU HA 1 1 9 5971 1 1 41 LEU HB2 H 5.062 -2.916 -2.266 1.00 . A A . 41 LEU HB2 1 1 9 5972 1 1 41 LEU HB3 H 4.027 -3.362 -0.925 1.00 . A A . 41 LEU HB3 1 1 9 5973 1 1 41 LEU HD11 H 6.960 -0.396 -0.513 1.00 . A A . 41 LEU HD11 1 1 9 5974 1 1 41 LEU HD12 H 6.505 -1.024 -2.101 1.00 . A A . 41 LEU HD12 1 1 9 5975 1 1 41 LEU HD13 H 7.435 -2.028 -0.985 1.00 . A A . 41 LEU HD13 1 1 9 5976 1 1 41 LEU HD21 H 3.401 -1.284 -0.089 1.00 . A A . 41 LEU HD21 1 1 9 5977 1 1 41 LEU HD22 H 4.045 -0.654 -1.605 1.00 . A A . 41 LEU HD22 1 1 9 5978 1 1 41 LEU HD23 H 4.542 0.063 -0.071 1.00 . A A . 41 LEU HD23 1 1 9 5979 1 1 41 LEU HG H 5.594 -2.053 0.548 1.00 . A A . 41 LEU HG 1 1 9 5980 1 1 41 LEU N N 5.585 -4.914 0.352 1.00 . A A . 41 LEU N 1 1 9 5981 1 1 41 LEU O O 8.005 -4.157 -2.068 1.00 . A A . 41 LEU O 1 1 9 5982 1 1 42 PHE C C 10.191 -4.912 -0.247 1.00 . A A . 42 PHE C 1 1 9 5983 1 1 42 PHE CA C 9.399 -3.769 0.380 1.00 . A A . 42 PHE CA 1 1 9 5984 1 1 42 PHE CB C 9.718 -3.702 1.860 1.00 . A A . 42 PHE CB 1 1 9 5985 1 1 42 PHE CD1 C 9.100 -1.430 2.303 1.00 . A A . 42 PHE CD1 1 1 9 5986 1 1 42 PHE CD2 C 11.390 -1.962 2.528 1.00 . A A . 42 PHE CD2 1 1 9 5987 1 1 42 PHE CE1 C 9.348 -0.140 2.621 1.00 . A A . 42 PHE CE1 1 1 9 5988 1 1 42 PHE CE2 C 11.667 -0.651 2.862 1.00 . A A . 42 PHE CE2 1 1 9 5989 1 1 42 PHE CG C 10.090 -2.342 2.253 1.00 . A A . 42 PHE CG 1 1 9 5990 1 1 42 PHE CZ C 10.636 0.269 2.907 1.00 . A A . 42 PHE CZ 1 1 9 5991 1 1 42 PHE H H 7.401 -3.912 0.977 1.00 . A A . 42 PHE H 1 1 9 5992 1 1 42 PHE HA H 9.674 -2.816 -0.059 1.00 . A A . 42 PHE HA 1 1 9 5993 1 1 42 PHE HB2 H 8.836 -3.962 2.423 1.00 . A A . 42 PHE HB2 1 1 9 5994 1 1 42 PHE HB3 H 10.520 -4.366 2.100 1.00 . A A . 42 PHE HB3 1 1 9 5995 1 1 42 PHE HD1 H 8.088 -1.761 2.092 1.00 . A A . 42 PHE HD1 1 1 9 5996 1 1 42 PHE HD2 H 12.184 -2.693 2.488 1.00 . A A . 42 PHE HD2 1 1 9 5997 1 1 42 PHE HE1 H 8.540 0.543 2.637 1.00 . A A . 42 PHE HE1 1 1 9 5998 1 1 42 PHE HE2 H 12.680 -0.348 3.082 1.00 . A A . 42 PHE HE2 1 1 9 5999 1 1 42 PHE HZ H 10.837 1.300 3.162 1.00 . A A . 42 PHE HZ 1 1 9 6000 1 1 42 PHE N N 7.973 -3.935 0.190 1.00 . A A . 42 PHE N 1 1 9 6001 1 1 42 PHE O O 11.416 -4.844 -0.344 1.00 . A A . 42 PHE O 1 1 9 6002 1 1 43 GLN C C 10.900 -6.741 -2.496 1.00 . A A . 43 GLN C 1 1 9 6003 1 1 43 GLN CA C 10.116 -7.145 -1.253 1.00 . A A . 43 GLN CA 1 1 9 6004 1 1 43 GLN CB C 9.066 -8.203 -1.616 1.00 . A A . 43 GLN CB 1 1 9 6005 1 1 43 GLN CD C 6.836 -8.094 -2.822 1.00 . A A . 43 GLN CD 1 1 9 6006 1 1 43 GLN CG C 8.339 -7.937 -2.932 1.00 . A A . 43 GLN CG 1 1 9 6007 1 1 43 GLN H H 8.497 -5.988 -0.484 1.00 . A A . 43 GLN H 1 1 9 6008 1 1 43 GLN HA H 10.801 -7.555 -0.543 1.00 . A A . 43 GLN HA 1 1 9 6009 1 1 43 GLN HB2 H 9.552 -9.163 -1.689 1.00 . A A . 43 GLN HB2 1 1 9 6010 1 1 43 GLN HB3 H 8.329 -8.243 -0.826 1.00 . A A . 43 GLN HB3 1 1 9 6011 1 1 43 GLN HE21 H 6.642 -6.144 -2.524 1.00 . A A . 43 GLN HE21 1 1 9 6012 1 1 43 GLN HE22 H 5.177 -7.055 -2.473 1.00 . A A . 43 GLN HE22 1 1 9 6013 1 1 43 GLN HG2 H 8.556 -6.927 -3.247 1.00 . A A . 43 GLN HG2 1 1 9 6014 1 1 43 GLN HG3 H 8.705 -8.629 -3.676 1.00 . A A . 43 GLN HG3 1 1 9 6015 1 1 43 GLN N N 9.484 -5.981 -0.633 1.00 . A A . 43 GLN N 1 1 9 6016 1 1 43 GLN NE2 N 6.147 -6.987 -2.595 1.00 . A A . 43 GLN NE2 1 1 9 6017 1 1 43 GLN O O 11.878 -7.386 -2.874 1.00 . A A . 43 GLN O 1 1 9 6018 1 1 43 GLN OE1 O 6.298 -9.191 -2.977 1.00 . A A . 43 GLN OE1 1 1 9 6019 1 1 44 SER C C 11.915 -3.911 -4.010 1.00 . A A . 44 SER C 1 1 9 6020 1 1 44 SER CA C 11.088 -5.155 -4.318 1.00 . A A . 44 SER CA 1 1 9 6021 1 1 44 SER CB C 10.018 -4.839 -5.364 1.00 . A A . 44 SER CB 1 1 9 6022 1 1 44 SER H H 9.707 -5.181 -2.714 1.00 . A A . 44 SER H 1 1 9 6023 1 1 44 SER HA H 11.741 -5.922 -4.704 1.00 . A A . 44 SER HA 1 1 9 6024 1 1 44 SER HB2 H 9.398 -4.030 -5.009 1.00 . A A . 44 SER HB2 1 1 9 6025 1 1 44 SER HB3 H 10.493 -4.549 -6.289 1.00 . A A . 44 SER HB3 1 1 9 6026 1 1 44 SER HG H 9.727 -6.781 -5.512 1.00 . A A . 44 SER HG 1 1 9 6027 1 1 44 SER N N 10.466 -5.661 -3.107 1.00 . A A . 44 SER N 1 1 9 6028 1 1 44 SER O O 13.143 -4.042 -3.825 1.00 . A A . 44 SER O 1 1 9 6029 1 1 44 SER OXT O 11.336 -2.811 -3.936 1.00 . A A . 44 SER OXT 1 1 9 6030 1 1 44 SER OG O 9.196 -5.972 -5.609 1.00 . A A . 44 SER OG 1 1 10 6031 1 1 1 GLY C C -12.643 -4.002 1.228 1.00 . A A . 1 GLY C 1 1 10 6032 1 1 1 GLY CA C -12.016 -5.329 0.854 1.00 . A A . 1 GLY CA 1 1 10 6033 1 1 1 GLY H1 H -11.691 -7.228 1.654 1.00 . A A . 1 GLY H1 1 1 10 6034 1 1 1 GLY H2 H -13.071 -6.445 2.260 1.00 . A A . 1 GLY H2 1 1 10 6035 1 1 1 GLY H3 H -11.528 -5.966 2.777 1.00 . A A . 1 GLY H3 1 1 10 6036 1 1 1 GLY HA2 H -10.982 -5.167 0.588 1.00 . A A . 1 GLY HA2 1 1 10 6037 1 1 1 GLY HA3 H -12.537 -5.734 -0.001 1.00 . A A . 1 GLY HA3 1 1 10 6038 1 1 1 GLY N N -12.080 -6.311 1.962 1.00 . A A . 1 GLY N 1 1 10 6039 1 1 1 GLY O O -13.623 -3.574 0.618 1.00 . A A . 1 GLY O 1 1 10 6040 1 1 2 SER C C -11.392 -1.200 3.152 1.00 . A A . 2 SER C 1 1 10 6041 1 1 2 SER CA C -12.565 -2.046 2.674 1.00 . A A . 2 SER CA 1 1 10 6042 1 1 2 SER CB C -13.611 -2.193 3.781 1.00 . A A . 2 SER CB 1 1 10 6043 1 1 2 SER H H -11.356 -3.778 2.743 1.00 . A A . 2 SER H 1 1 10 6044 1 1 2 SER HA H -13.018 -1.561 1.822 1.00 . A A . 2 SER HA 1 1 10 6045 1 1 2 SER HB2 H -13.161 -2.675 4.637 1.00 . A A . 2 SER HB2 1 1 10 6046 1 1 2 SER HB3 H -13.972 -1.216 4.065 1.00 . A A . 2 SER HB3 1 1 10 6047 1 1 2 SER HG H -14.606 -3.164 2.394 1.00 . A A . 2 SER HG 1 1 10 6048 1 1 2 SER N N -12.095 -3.357 2.249 1.00 . A A . 2 SER N 1 1 10 6049 1 1 2 SER O O -10.564 -1.672 3.937 1.00 . A A . 2 SER O 1 1 10 6050 1 1 2 SER OG O -14.710 -2.977 3.337 1.00 . A A . 2 SER OG 1 1 10 6051 1 1 3 ALA C C -8.883 0.294 2.616 1.00 . A A . 3 ALA C 1 1 10 6052 1 1 3 ALA CA C -10.214 0.947 2.961 1.00 . A A . 3 ALA CA 1 1 10 6053 1 1 3 ALA CB C -10.243 1.375 4.424 1.00 . A A . 3 ALA CB 1 1 10 6054 1 1 3 ALA H H -12.039 0.350 2.056 1.00 . A A . 3 ALA H 1 1 10 6055 1 1 3 ALA HA H -10.333 1.831 2.349 1.00 . A A . 3 ALA HA 1 1 10 6056 1 1 3 ALA HB1 H -9.460 2.097 4.603 1.00 . A A . 3 ALA HB1 1 1 10 6057 1 1 3 ALA HB2 H -10.089 0.512 5.055 1.00 . A A . 3 ALA HB2 1 1 10 6058 1 1 3 ALA HB3 H -11.201 1.819 4.649 1.00 . A A . 3 ALA HB3 1 1 10 6059 1 1 3 ALA N N -11.320 0.038 2.655 1.00 . A A . 3 ALA N 1 1 10 6060 1 1 3 ALA O O -7.967 0.233 3.437 1.00 . A A . 3 ALA O 1 1 10 6061 1 1 4 THR C C -6.540 -0.081 0.414 1.00 . A A . 4 THR C 1 1 10 6062 1 1 4 THR CA C -7.629 -0.953 0.972 1.00 . A A . 4 THR CA 1 1 10 6063 1 1 4 THR CB C -8.038 -2.022 -0.056 1.00 . A A . 4 THR CB 1 1 10 6064 1 1 4 THR CG2 C -8.658 -3.230 0.629 1.00 . A A . 4 THR CG2 1 1 10 6065 1 1 4 THR H H -9.501 -0.009 0.741 1.00 . A A . 4 THR H 1 1 10 6066 1 1 4 THR HA H -7.248 -1.429 1.799 1.00 . A A . 4 THR HA 1 1 10 6067 1 1 4 THR HB H -7.154 -2.343 -0.590 1.00 . A A . 4 THR HB 1 1 10 6068 1 1 4 THR HG1 H -9.738 -2.050 -1.076 1.00 . A A . 4 THR HG1 1 1 10 6069 1 1 4 THR HG21 H -9.541 -2.922 1.172 1.00 . A A . 4 THR HG21 1 1 10 6070 1 1 4 THR HG22 H -7.945 -3.659 1.317 1.00 . A A . 4 THR HG22 1 1 10 6071 1 1 4 THR HG23 H -8.930 -3.965 -0.114 1.00 . A A . 4 THR HG23 1 1 10 6072 1 1 4 THR N N -8.784 -0.189 1.390 1.00 . A A . 4 THR N 1 1 10 6073 1 1 4 THR O O -5.430 0.011 0.930 1.00 . A A . 4 THR O 1 1 10 6074 1 1 4 THR OG1 O -8.972 -1.459 -0.988 1.00 . A A . 4 THR OG1 1 1 10 6075 1 1 5 PHE C C -6.524 2.958 -1.362 1.00 . A A . 5 PHE C 1 1 10 6076 1 1 5 PHE CA C -6.054 1.478 -1.363 1.00 . A A . 5 PHE CA 1 1 10 6077 1 1 5 PHE CB C -6.207 1.043 -2.771 1.00 . A A . 5 PHE CB 1 1 10 6078 1 1 5 PHE CD1 C -5.371 -1.162 -2.266 1.00 . A A . 5 PHE CD1 1 1 10 6079 1 1 5 PHE CD2 C -7.264 -1.047 -3.656 1.00 . A A . 5 PHE CD2 1 1 10 6080 1 1 5 PHE CE1 C -5.407 -2.466 -2.299 1.00 . A A . 5 PHE CE1 1 1 10 6081 1 1 5 PHE CE2 C -7.295 -2.426 -3.701 1.00 . A A . 5 PHE CE2 1 1 10 6082 1 1 5 PHE CG C -6.275 -0.415 -2.919 1.00 . A A . 5 PHE CG 1 1 10 6083 1 1 5 PHE CZ C -6.339 -3.127 -2.993 1.00 . A A . 5 PHE CZ 1 1 10 6084 1 1 5 PHE H H -7.805 0.426 -0.891 1.00 . A A . 5 PHE H 1 1 10 6085 1 1 5 PHE HA H -5.034 1.359 -1.048 1.00 . A A . 5 PHE HA 1 1 10 6086 1 1 5 PHE HB2 H -7.136 1.436 -3.060 1.00 . A A . 5 PHE HB2 1 1 10 6087 1 1 5 PHE HB3 H -5.405 1.423 -3.380 1.00 . A A . 5 PHE HB3 1 1 10 6088 1 1 5 PHE HD1 H -4.616 -0.701 -1.681 1.00 . A A . 5 PHE HD1 1 1 10 6089 1 1 5 PHE HD2 H -7.994 -0.463 -4.196 1.00 . A A . 5 PHE HD2 1 1 10 6090 1 1 5 PHE HE1 H -4.677 -2.977 -1.770 1.00 . A A . 5 PHE HE1 1 1 10 6091 1 1 5 PHE HE2 H -8.054 -2.945 -4.266 1.00 . A A . 5 PHE HE2 1 1 10 6092 1 1 5 PHE HZ H -6.322 -4.184 -2.962 1.00 . A A . 5 PHE HZ 1 1 10 6093 1 1 5 PHE N N -6.920 0.580 -0.609 1.00 . A A . 5 PHE N 1 1 10 6094 1 1 5 PHE O O -6.496 3.620 -2.404 1.00 . A A . 5 PHE O 1 1 10 6095 1 1 6 PRO C C -6.046 5.734 0.129 1.00 . A A . 6 PRO C 1 1 10 6096 1 1 6 PRO CA C -7.276 4.882 -0.055 1.00 . A A . 6 PRO CA 1 1 10 6097 1 1 6 PRO CB C -8.120 4.885 1.200 1.00 . A A . 6 PRO CB 1 1 10 6098 1 1 6 PRO CD C -7.284 2.737 0.930 1.00 . A A . 6 PRO CD 1 1 10 6099 1 1 6 PRO CG C -7.632 3.759 1.952 1.00 . A A . 6 PRO CG 1 1 10 6100 1 1 6 PRO HA H -7.859 5.247 -0.858 1.00 . A A . 6 PRO HA 1 1 10 6101 1 1 6 PRO HB2 H -8.005 5.811 1.737 1.00 . A A . 6 PRO HB2 1 1 10 6102 1 1 6 PRO HB3 H -9.133 4.725 0.944 1.00 . A A . 6 PRO HB3 1 1 10 6103 1 1 6 PRO HD2 H -6.455 2.162 1.216 1.00 . A A . 6 PRO HD2 1 1 10 6104 1 1 6 PRO HD3 H -8.117 2.088 0.694 1.00 . A A . 6 PRO HD3 1 1 10 6105 1 1 6 PRO HG2 H -6.776 4.049 2.516 1.00 . A A . 6 PRO HG2 1 1 10 6106 1 1 6 PRO HG3 H -8.414 3.407 2.577 1.00 . A A . 6 PRO HG3 1 1 10 6107 1 1 6 PRO N N -6.951 3.488 -0.227 1.00 . A A . 6 PRO N 1 1 10 6108 1 1 6 PRO O O -4.955 5.231 0.393 1.00 . A A . 6 PRO O 1 1 10 6109 1 1 7 GLU C C -4.433 7.877 1.433 1.00 . A A . 7 GLU C 1 1 10 6110 1 1 7 GLU CA C -5.184 8.000 0.111 1.00 . A A . 7 GLU CA 1 1 10 6111 1 1 7 GLU CB C -5.760 9.403 -0.044 1.00 . A A . 7 GLU CB 1 1 10 6112 1 1 7 GLU CD C -5.775 9.278 -2.568 1.00 . A A . 7 GLU CD 1 1 10 6113 1 1 7 GLU CG C -6.569 9.592 -1.316 1.00 . A A . 7 GLU CG 1 1 10 6114 1 1 7 GLU H H -7.152 7.339 -0.169 1.00 . A A . 7 GLU H 1 1 10 6115 1 1 7 GLU HA H -4.488 7.814 -0.692 1.00 . A A . 7 GLU HA 1 1 10 6116 1 1 7 GLU HB2 H -6.401 9.614 0.801 1.00 . A A . 7 GLU HB2 1 1 10 6117 1 1 7 GLU HB3 H -4.951 10.108 -0.051 1.00 . A A . 7 GLU HB3 1 1 10 6118 1 1 7 GLU HG2 H -7.426 8.937 -1.278 1.00 . A A . 7 GLU HG2 1 1 10 6119 1 1 7 GLU HG3 H -6.904 10.618 -1.364 1.00 . A A . 7 GLU HG3 1 1 10 6120 1 1 7 GLU N N -6.247 7.026 0.005 1.00 . A A . 7 GLU N 1 1 10 6121 1 1 7 GLU O O -3.286 8.293 1.530 1.00 . A A . 7 GLU O 1 1 10 6122 1 1 7 GLU OE1 O -4.918 10.103 -2.962 1.00 . A A . 7 GLU OE1 1 1 10 6123 1 1 7 GLU OE2 O -6.001 8.204 -3.162 1.00 . A A . 7 GLU OE2 1 1 10 6124 1 1 8 GLN C C -3.175 6.118 3.433 1.00 . A A . 8 GLN C 1 1 10 6125 1 1 8 GLN CA C -4.389 7.011 3.699 1.00 . A A . 8 GLN CA 1 1 10 6126 1 1 8 GLN CB C -5.342 6.311 4.669 1.00 . A A . 8 GLN CB 1 1 10 6127 1 1 8 GLN CD C -5.613 5.251 6.964 1.00 . A A . 8 GLN CD 1 1 10 6128 1 1 8 GLN CG C -4.652 5.775 5.910 1.00 . A A . 8 GLN CG 1 1 10 6129 1 1 8 GLN H H -6.043 7.156 2.383 1.00 . A A . 8 GLN H 1 1 10 6130 1 1 8 GLN HA H -4.055 7.938 4.138 1.00 . A A . 8 GLN HA 1 1 10 6131 1 1 8 GLN HB2 H -6.104 7.010 4.977 1.00 . A A . 8 GLN HB2 1 1 10 6132 1 1 8 GLN HB3 H -5.806 5.485 4.161 1.00 . A A . 8 GLN HB3 1 1 10 6133 1 1 8 GLN HE21 H -6.937 4.731 5.580 1.00 . A A . 8 GLN HE21 1 1 10 6134 1 1 8 GLN HE22 H -7.391 4.398 7.215 1.00 . A A . 8 GLN HE22 1 1 10 6135 1 1 8 GLN HG2 H -3.997 4.969 5.617 1.00 . A A . 8 GLN HG2 1 1 10 6136 1 1 8 GLN HG3 H -4.068 6.566 6.335 1.00 . A A . 8 GLN HG3 1 1 10 6137 1 1 8 GLN N N -5.079 7.323 2.453 1.00 . A A . 8 GLN N 1 1 10 6138 1 1 8 GLN NE2 N -6.759 4.744 6.542 1.00 . A A . 8 GLN NE2 1 1 10 6139 1 1 8 GLN O O -2.033 6.540 3.589 1.00 . A A . 8 GLN O 1 1 10 6140 1 1 8 GLN OE1 O -5.321 5.298 8.159 1.00 . A A . 8 GLN OE1 1 1 10 6141 1 1 9 THR C C -1.550 4.382 1.551 1.00 . A A . 9 THR C 1 1 10 6142 1 1 9 THR CA C -2.416 3.940 2.702 1.00 . A A . 9 THR CA 1 1 10 6143 1 1 9 THR CB C -3.052 2.577 2.408 1.00 . A A . 9 THR CB 1 1 10 6144 1 1 9 THR CG2 C -3.720 2.016 3.649 1.00 . A A . 9 THR CG2 1 1 10 6145 1 1 9 THR H H -4.347 4.653 2.797 1.00 . A A . 9 THR H 1 1 10 6146 1 1 9 THR HA H -1.815 3.857 3.566 1.00 . A A . 9 THR HA 1 1 10 6147 1 1 9 THR HB H -2.281 1.913 2.100 1.00 . A A . 9 THR HB 1 1 10 6148 1 1 9 THR HG1 H -4.380 1.820 1.161 1.00 . A A . 9 THR HG1 1 1 10 6149 1 1 9 THR HG21 H -4.143 1.047 3.425 1.00 . A A . 9 THR HG21 1 1 10 6150 1 1 9 THR HG22 H -4.505 2.686 3.966 1.00 . A A . 9 THR HG22 1 1 10 6151 1 1 9 THR HG23 H -2.990 1.918 4.439 1.00 . A A . 9 THR HG23 1 1 10 6152 1 1 9 THR N N -3.439 4.907 2.969 1.00 . A A . 9 THR N 1 1 10 6153 1 1 9 THR O O -0.338 4.181 1.543 1.00 . A A . 9 THR O 1 1 10 6154 1 1 9 THR OG1 O -4.021 2.695 1.362 1.00 . A A . 9 THR OG1 1 1 10 6155 1 1 10 ILE C C -0.436 6.526 -0.027 1.00 . A A . 10 ILE C 1 1 10 6156 1 1 10 ILE CA C -1.542 5.630 -0.519 1.00 . A A . 10 ILE CA 1 1 10 6157 1 1 10 ILE CB C -2.545 6.486 -1.333 1.00 . A A . 10 ILE CB 1 1 10 6158 1 1 10 ILE CD1 C -2.762 4.948 -3.329 1.00 . A A . 10 ILE CD1 1 1 10 6159 1 1 10 ILE CG1 C -3.464 5.614 -2.179 1.00 . A A . 10 ILE CG1 1 1 10 6160 1 1 10 ILE CG2 C -1.820 7.478 -2.213 1.00 . A A . 10 ILE CG2 1 1 10 6161 1 1 10 ILE H H -3.160 5.036 0.660 1.00 . A A . 10 ILE H 1 1 10 6162 1 1 10 ILE HA H -1.139 4.869 -1.152 1.00 . A A . 10 ILE HA 1 1 10 6163 1 1 10 ILE HB H -3.146 7.046 -0.633 1.00 . A A . 10 ILE HB 1 1 10 6164 1 1 10 ILE HD11 H -3.461 4.327 -3.868 1.00 . A A . 10 ILE HD11 1 1 10 6165 1 1 10 ILE HD12 H -1.959 4.335 -2.945 1.00 . A A . 10 ILE HD12 1 1 10 6166 1 1 10 ILE HD13 H -2.359 5.700 -3.990 1.00 . A A . 10 ILE HD13 1 1 10 6167 1 1 10 ILE HG12 H -3.885 4.842 -1.558 1.00 . A A . 10 ILE HG12 1 1 10 6168 1 1 10 ILE HG13 H -4.260 6.223 -2.581 1.00 . A A . 10 ILE HG13 1 1 10 6169 1 1 10 ILE HG21 H -1.196 6.943 -2.910 1.00 . A A . 10 ILE HG21 1 1 10 6170 1 1 10 ILE HG22 H -1.210 8.117 -1.596 1.00 . A A . 10 ILE HG22 1 1 10 6171 1 1 10 ILE HG23 H -2.542 8.070 -2.751 1.00 . A A . 10 ILE HG23 1 1 10 6172 1 1 10 ILE N N -2.198 5.021 0.610 1.00 . A A . 10 ILE N 1 1 10 6173 1 1 10 ILE O O 0.723 6.292 -0.303 1.00 . A A . 10 ILE O 1 1 10 6174 1 1 11 LYS C C 1.190 7.929 2.159 1.00 . A A . 11 LYS C 1 1 10 6175 1 1 11 LYS CA C 0.167 8.478 1.199 1.00 . A A . 11 LYS CA 1 1 10 6176 1 1 11 LYS CB C -0.536 9.703 1.744 1.00 . A A . 11 LYS CB 1 1 10 6177 1 1 11 LYS CD C -2.200 11.524 1.237 1.00 . A A . 11 LYS CD 1 1 10 6178 1 1 11 LYS CE C -1.357 12.631 1.855 1.00 . A A . 11 LYS CE 1 1 10 6179 1 1 11 LYS CG C -1.343 10.404 0.670 1.00 . A A . 11 LYS CG 1 1 10 6180 1 1 11 LYS H H -1.718 7.545 1.085 1.00 . A A . 11 LYS H 1 1 10 6181 1 1 11 LYS HA H 0.701 8.767 0.315 1.00 . A A . 11 LYS HA 1 1 10 6182 1 1 11 LYS HB2 H -1.198 9.402 2.535 1.00 . A A . 11 LYS HB2 1 1 10 6183 1 1 11 LYS HB3 H 0.198 10.395 2.129 1.00 . A A . 11 LYS HB3 1 1 10 6184 1 1 11 LYS HD2 H -2.796 11.944 0.441 1.00 . A A . 11 LYS HD2 1 1 10 6185 1 1 11 LYS HD3 H -2.851 11.113 1.995 1.00 . A A . 11 LYS HD3 1 1 10 6186 1 1 11 LYS HE2 H -2.015 13.408 2.212 1.00 . A A . 11 LYS HE2 1 1 10 6187 1 1 11 LYS HE3 H -0.801 12.221 2.687 1.00 . A A . 11 LYS HE3 1 1 10 6188 1 1 11 LYS HG2 H -0.663 10.822 -0.057 1.00 . A A . 11 LYS HG2 1 1 10 6189 1 1 11 LYS HG3 H -1.982 9.668 0.186 1.00 . A A . 11 LYS HG3 1 1 10 6190 1 1 11 LYS HZ1 H 0.368 12.548 0.678 1.00 . A A . 11 LYS HZ1 1 1 10 6191 1 1 11 LYS HZ2 H 0.019 14.094 1.277 1.00 . A A . 11 LYS HZ2 1 1 10 6192 1 1 11 LYS HZ3 H -0.888 13.456 -0.011 1.00 . A A . 11 LYS HZ3 1 1 10 6193 1 1 11 LYS N N -0.788 7.488 0.775 1.00 . A A . 11 LYS N 1 1 10 6194 1 1 11 LYS NZ N -0.401 13.224 0.881 1.00 . A A . 11 LYS NZ 1 1 10 6195 1 1 11 LYS O O 2.302 8.408 2.168 1.00 . A A . 11 LYS O 1 1 10 6196 1 1 12 GLN C C 2.843 5.564 3.074 1.00 . A A . 12 GLN C 1 1 10 6197 1 1 12 GLN CA C 1.742 6.307 3.849 1.00 . A A . 12 GLN CA 1 1 10 6198 1 1 12 GLN CB C 0.909 5.366 4.695 1.00 . A A . 12 GLN CB 1 1 10 6199 1 1 12 GLN CD C -0.216 7.160 6.084 1.00 . A A . 12 GLN CD 1 1 10 6200 1 1 12 GLN CG C 0.647 5.913 6.073 1.00 . A A . 12 GLN CG 1 1 10 6201 1 1 12 GLN H H -0.111 6.668 3.032 1.00 . A A . 12 GLN H 1 1 10 6202 1 1 12 GLN HA H 2.190 7.051 4.485 1.00 . A A . 12 GLN HA 1 1 10 6203 1 1 12 GLN HB2 H -0.049 5.207 4.208 1.00 . A A . 12 GLN HB2 1 1 10 6204 1 1 12 GLN HB3 H 1.415 4.437 4.778 1.00 . A A . 12 GLN HB3 1 1 10 6205 1 1 12 GLN HE21 H 1.409 8.298 5.952 1.00 . A A . 12 GLN HE21 1 1 10 6206 1 1 12 GLN HE22 H -0.101 9.137 6.001 1.00 . A A . 12 GLN HE22 1 1 10 6207 1 1 12 GLN HG2 H 0.171 5.155 6.669 1.00 . A A . 12 GLN HG2 1 1 10 6208 1 1 12 GLN HG3 H 1.591 6.167 6.489 1.00 . A A . 12 GLN HG3 1 1 10 6209 1 1 12 GLN N N 0.822 6.956 2.978 1.00 . A A . 12 GLN N 1 1 10 6210 1 1 12 GLN NE2 N 0.424 8.314 6.006 1.00 . A A . 12 GLN NE2 1 1 10 6211 1 1 12 GLN O O 4.024 5.544 3.456 1.00 . A A . 12 GLN O 1 1 10 6212 1 1 12 GLN OE1 O -1.442 7.092 6.180 1.00 . A A . 12 GLN OE1 1 1 10 6213 1 1 13 LEU C C 4.096 5.027 0.169 1.00 . A A . 13 LEU C 1 1 10 6214 1 1 13 LEU CA C 3.384 4.186 1.194 1.00 . A A . 13 LEU CA 1 1 10 6215 1 1 13 LEU CB C 2.619 3.057 0.569 1.00 . A A . 13 LEU CB 1 1 10 6216 1 1 13 LEU CD1 C 1.145 1.082 0.966 1.00 . A A . 13 LEU CD1 1 1 10 6217 1 1 13 LEU CD2 C 2.826 1.735 2.679 1.00 . A A . 13 LEU CD2 1 1 10 6218 1 1 13 LEU CG C 1.878 2.236 1.603 1.00 . A A . 13 LEU CG 1 1 10 6219 1 1 13 LEU H H 1.569 5.127 1.622 1.00 . A A . 13 LEU H 1 1 10 6220 1 1 13 LEU HA H 4.104 3.777 1.880 1.00 . A A . 13 LEU HA 1 1 10 6221 1 1 13 LEU HB2 H 1.906 3.464 -0.135 1.00 . A A . 13 LEU HB2 1 1 10 6222 1 1 13 LEU HB3 H 3.300 2.427 0.052 1.00 . A A . 13 LEU HB3 1 1 10 6223 1 1 13 LEU HD11 H 0.598 0.539 1.725 1.00 . A A . 13 LEU HD11 1 1 10 6224 1 1 13 LEU HD12 H 1.856 0.422 0.492 1.00 . A A . 13 LEU HD12 1 1 10 6225 1 1 13 LEU HD13 H 0.455 1.459 0.226 1.00 . A A . 13 LEU HD13 1 1 10 6226 1 1 13 LEU HD21 H 3.591 1.120 2.227 1.00 . A A . 13 LEU HD21 1 1 10 6227 1 1 13 LEU HD22 H 2.276 1.150 3.401 1.00 . A A . 13 LEU HD22 1 1 10 6228 1 1 13 LEU HD23 H 3.286 2.577 3.175 1.00 . A A . 13 LEU HD23 1 1 10 6229 1 1 13 LEU HG H 1.160 2.884 2.073 1.00 . A A . 13 LEU HG 1 1 10 6230 1 1 13 LEU N N 2.474 4.997 1.952 1.00 . A A . 13 LEU N 1 1 10 6231 1 1 13 LEU O O 5.285 4.856 -0.076 1.00 . A A . 13 LEU O 1 1 10 6232 1 1 14 MET C C 4.938 7.780 -0.342 1.00 . A A . 14 MET C 1 1 10 6233 1 1 14 MET CA C 3.962 6.999 -1.198 1.00 . A A . 14 MET CA 1 1 10 6234 1 1 14 MET CB C 2.864 7.895 -1.698 1.00 . A A . 14 MET CB 1 1 10 6235 1 1 14 MET CE C 1.595 4.533 -2.495 1.00 . A A . 14 MET CE 1 1 10 6236 1 1 14 MET CG C 2.002 7.240 -2.738 1.00 . A A . 14 MET CG 1 1 10 6237 1 1 14 MET H H 2.368 5.925 -0.356 1.00 . A A . 14 MET H 1 1 10 6238 1 1 14 MET HA H 4.478 6.553 -2.033 1.00 . A A . 14 MET HA 1 1 10 6239 1 1 14 MET HB2 H 2.230 8.177 -0.863 1.00 . A A . 14 MET HB2 1 1 10 6240 1 1 14 MET HB3 H 3.299 8.771 -2.122 1.00 . A A . 14 MET HB3 1 1 10 6241 1 1 14 MET HE1 H 0.566 4.780 -2.701 1.00 . A A . 14 MET HE1 1 1 10 6242 1 1 14 MET HE2 H 1.778 4.607 -1.435 1.00 . A A . 14 MET HE2 1 1 10 6243 1 1 14 MET HE3 H 1.807 3.533 -2.833 1.00 . A A . 14 MET HE3 1 1 10 6244 1 1 14 MET HG2 H 1.019 7.069 -2.333 1.00 . A A . 14 MET HG2 1 1 10 6245 1 1 14 MET HG3 H 1.936 7.900 -3.540 1.00 . A A . 14 MET HG3 1 1 10 6246 1 1 14 MET N N 3.364 5.955 -0.416 1.00 . A A . 14 MET N 1 1 10 6247 1 1 14 MET O O 5.932 8.324 -0.821 1.00 . A A . 14 MET O 1 1 10 6248 1 1 14 MET SD S 2.653 5.685 -3.342 1.00 . A A . 14 MET SD 1 1 10 6249 1 1 15 ASP C C 6.814 7.672 2.023 1.00 . A A . 15 ASP C 1 1 10 6250 1 1 15 ASP CA C 5.480 8.394 1.956 1.00 . A A . 15 ASP CA 1 1 10 6251 1 1 15 ASP CB C 4.783 8.337 3.312 1.00 . A A . 15 ASP CB 1 1 10 6252 1 1 15 ASP CG C 5.643 8.816 4.461 1.00 . A A . 15 ASP CG 1 1 10 6253 1 1 15 ASP H H 3.740 7.472 1.202 1.00 . A A . 15 ASP H 1 1 10 6254 1 1 15 ASP HA H 5.657 9.427 1.698 1.00 . A A . 15 ASP HA 1 1 10 6255 1 1 15 ASP HB2 H 3.896 8.953 3.268 1.00 . A A . 15 ASP HB2 1 1 10 6256 1 1 15 ASP HB3 H 4.482 7.314 3.505 1.00 . A A . 15 ASP HB3 1 1 10 6257 1 1 15 ASP N N 4.618 7.822 0.936 1.00 . A A . 15 ASP N 1 1 10 6258 1 1 15 ASP O O 7.840 8.300 2.278 1.00 . A A . 15 ASP O 1 1 10 6259 1 1 15 ASP OD1 O 6.083 9.986 4.439 1.00 . A A . 15 ASP OD1 1 1 10 6260 1 1 15 ASP OD2 O 5.858 8.032 5.406 1.00 . A A . 15 ASP OD2 1 1 10 6261 1 1 16 LEU C C 8.842 5.953 0.456 1.00 . A A . 16 LEU C 1 1 10 6262 1 1 16 LEU CA C 8.105 5.667 1.769 1.00 . A A . 16 LEU CA 1 1 10 6263 1 1 16 LEU CB C 7.872 4.188 1.923 1.00 . A A . 16 LEU CB 1 1 10 6264 1 1 16 LEU CD1 C 6.462 2.349 2.799 1.00 . A A . 16 LEU CD1 1 1 10 6265 1 1 16 LEU CD2 C 7.270 4.126 4.352 1.00 . A A . 16 LEU CD2 1 1 10 6266 1 1 16 LEU CG C 6.817 3.804 2.939 1.00 . A A . 16 LEU CG 1 1 10 6267 1 1 16 LEU H H 5.995 5.817 1.678 1.00 . A A . 16 LEU H 1 1 10 6268 1 1 16 LEU HA H 8.697 6.024 2.594 1.00 . A A . 16 LEU HA 1 1 10 6269 1 1 16 LEU HB2 H 7.575 3.792 0.966 1.00 . A A . 16 LEU HB2 1 1 10 6270 1 1 16 LEU HB3 H 8.793 3.736 2.210 1.00 . A A . 16 LEU HB3 1 1 10 6271 1 1 16 LEU HD11 H 6.015 2.197 1.830 1.00 . A A . 16 LEU HD11 1 1 10 6272 1 1 16 LEU HD12 H 5.758 2.077 3.569 1.00 . A A . 16 LEU HD12 1 1 10 6273 1 1 16 LEU HD13 H 7.352 1.748 2.888 1.00 . A A . 16 LEU HD13 1 1 10 6274 1 1 16 LEU HD21 H 7.475 5.184 4.431 1.00 . A A . 16 LEU HD21 1 1 10 6275 1 1 16 LEU HD22 H 8.165 3.568 4.579 1.00 . A A . 16 LEU HD22 1 1 10 6276 1 1 16 LEU HD23 H 6.491 3.858 5.050 1.00 . A A . 16 LEU HD23 1 1 10 6277 1 1 16 LEU HG H 5.934 4.361 2.726 1.00 . A A . 16 LEU HG 1 1 10 6278 1 1 16 LEU N N 6.838 6.354 1.797 1.00 . A A . 16 LEU N 1 1 10 6279 1 1 16 LEU O O 10.002 5.577 0.287 1.00 . A A . 16 LEU O 1 1 10 6280 1 1 17 GLY C C 8.301 6.103 -2.881 1.00 . A A . 17 GLY C 1 1 10 6281 1 1 17 GLY CA C 8.745 6.994 -1.737 1.00 . A A . 17 GLY CA 1 1 10 6282 1 1 17 GLY H H 7.219 6.860 -0.280 1.00 . A A . 17 GLY H 1 1 10 6283 1 1 17 GLY HA2 H 8.472 8.015 -1.961 1.00 . A A . 17 GLY HA2 1 1 10 6284 1 1 17 GLY HA3 H 9.820 6.934 -1.646 1.00 . A A . 17 GLY HA3 1 1 10 6285 1 1 17 GLY N N 8.150 6.616 -0.468 1.00 . A A . 17 GLY N 1 1 10 6286 1 1 17 GLY O O 9.022 5.945 -3.866 1.00 . A A . 17 GLY O 1 1 10 6287 1 1 18 PHE C C 5.605 5.160 -4.670 1.00 . A A . 18 PHE C 1 1 10 6288 1 1 18 PHE CA C 6.638 4.558 -3.740 1.00 . A A . 18 PHE CA 1 1 10 6289 1 1 18 PHE CB C 6.074 3.387 -2.983 1.00 . A A . 18 PHE CB 1 1 10 6290 1 1 18 PHE CD1 C 8.343 2.392 -2.818 1.00 . A A . 18 PHE CD1 1 1 10 6291 1 1 18 PHE CD2 C 6.962 2.596 -0.935 1.00 . A A . 18 PHE CD2 1 1 10 6292 1 1 18 PHE CE1 C 9.334 1.854 -2.039 1.00 . A A . 18 PHE CE1 1 1 10 6293 1 1 18 PHE CE2 C 7.910 2.090 -0.164 1.00 . A A . 18 PHE CE2 1 1 10 6294 1 1 18 PHE CG C 7.141 2.755 -2.235 1.00 . A A . 18 PHE CG 1 1 10 6295 1 1 18 PHE CZ C 9.103 1.709 -0.692 1.00 . A A . 18 PHE CZ 1 1 10 6296 1 1 18 PHE H H 6.579 5.667 -1.952 1.00 . A A . 18 PHE H 1 1 10 6297 1 1 18 PHE HA H 7.484 4.215 -4.307 1.00 . A A . 18 PHE HA 1 1 10 6298 1 1 18 PHE HB2 H 5.335 3.739 -2.279 1.00 . A A . 18 PHE HB2 1 1 10 6299 1 1 18 PHE HB3 H 5.638 2.656 -3.613 1.00 . A A . 18 PHE HB3 1 1 10 6300 1 1 18 PHE HD1 H 8.490 2.521 -3.879 1.00 . A A . 18 PHE HD1 1 1 10 6301 1 1 18 PHE HD2 H 6.037 2.868 -0.513 1.00 . A A . 18 PHE HD2 1 1 10 6302 1 1 18 PHE HE1 H 10.279 1.555 -2.472 1.00 . A A . 18 PHE HE1 1 1 10 6303 1 1 18 PHE HE2 H 7.711 1.994 0.866 1.00 . A A . 18 PHE HE2 1 1 10 6304 1 1 18 PHE HZ H 9.838 1.315 -0.058 1.00 . A A . 18 PHE HZ 1 1 10 6305 1 1 18 PHE N N 7.123 5.505 -2.752 1.00 . A A . 18 PHE N 1 1 10 6306 1 1 18 PHE O O 5.191 6.304 -4.496 1.00 . A A . 18 PHE O 1 1 10 6307 1 1 19 PRO C C 2.804 4.259 -6.003 1.00 . A A . 19 PRO C 1 1 10 6308 1 1 19 PRO CA C 4.122 4.729 -6.588 1.00 . A A . 19 PRO CA 1 1 10 6309 1 1 19 PRO CB C 4.437 3.918 -7.818 1.00 . A A . 19 PRO CB 1 1 10 6310 1 1 19 PRO CD C 5.905 3.176 -6.159 1.00 . A A . 19 PRO CD 1 1 10 6311 1 1 19 PRO CG C 4.984 2.694 -7.250 1.00 . A A . 19 PRO CG 1 1 10 6312 1 1 19 PRO HA H 4.070 5.779 -6.836 1.00 . A A . 19 PRO HA 1 1 10 6313 1 1 19 PRO HB2 H 3.546 3.737 -8.391 1.00 . A A . 19 PRO HB2 1 1 10 6314 1 1 19 PRO HB3 H 5.175 4.415 -8.412 1.00 . A A . 19 PRO HB3 1 1 10 6315 1 1 19 PRO HD2 H 5.953 2.470 -5.340 1.00 . A A . 19 PRO HD2 1 1 10 6316 1 1 19 PRO HD3 H 6.885 3.379 -6.555 1.00 . A A . 19 PRO HD3 1 1 10 6317 1 1 19 PRO HG2 H 4.191 2.077 -6.848 1.00 . A A . 19 PRO HG2 1 1 10 6318 1 1 19 PRO HG3 H 5.517 2.189 -8.005 1.00 . A A . 19 PRO HG3 1 1 10 6319 1 1 19 PRO N N 5.247 4.418 -5.723 1.00 . A A . 19 PRO N 1 1 10 6320 1 1 19 PRO O O 2.758 3.396 -5.126 1.00 . A A . 19 PRO O 1 1 10 6321 1 1 20 ARG C C 0.139 2.963 -6.424 1.00 . A A . 20 ARG C 1 1 10 6322 1 1 20 ARG CA C 0.392 4.431 -6.157 1.00 . A A . 20 ARG CA 1 1 10 6323 1 1 20 ARG CB C -0.591 5.272 -6.953 1.00 . A A . 20 ARG CB 1 1 10 6324 1 1 20 ARG CD C -2.992 5.812 -7.402 1.00 . A A . 20 ARG CD 1 1 10 6325 1 1 20 ARG CG C -2.017 4.832 -6.780 1.00 . A A . 20 ARG CG 1 1 10 6326 1 1 20 ARG CZ C -5.405 5.342 -7.645 1.00 . A A . 20 ARG CZ 1 1 10 6327 1 1 20 ARG H H 1.879 5.412 -7.280 1.00 . A A . 20 ARG H 1 1 10 6328 1 1 20 ARG HA H 0.277 4.632 -5.099 1.00 . A A . 20 ARG HA 1 1 10 6329 1 1 20 ARG HB2 H -0.504 6.294 -6.645 1.00 . A A . 20 ARG HB2 1 1 10 6330 1 1 20 ARG HB3 H -0.344 5.197 -7.998 1.00 . A A . 20 ARG HB3 1 1 10 6331 1 1 20 ARG HD2 H -2.661 6.814 -7.180 1.00 . A A . 20 ARG HD2 1 1 10 6332 1 1 20 ARG HD3 H -2.998 5.666 -8.473 1.00 . A A . 20 ARG HD3 1 1 10 6333 1 1 20 ARG HE H -4.476 5.714 -5.915 1.00 . A A . 20 ARG HE 1 1 10 6334 1 1 20 ARG HG2 H -2.132 3.872 -7.258 1.00 . A A . 20 ARG HG2 1 1 10 6335 1 1 20 ARG HG3 H -2.215 4.736 -5.734 1.00 . A A . 20 ARG HG3 1 1 10 6336 1 1 20 ARG HH11 H -4.394 5.388 -9.405 1.00 . A A . 20 ARG HH11 1 1 10 6337 1 1 20 ARG HH12 H -6.094 5.038 -9.534 1.00 . A A . 20 ARG HH12 1 1 10 6338 1 1 20 ARG HH21 H -6.683 5.250 -6.075 1.00 . A A . 20 ARG HH21 1 1 10 6339 1 1 20 ARG HH22 H -7.390 4.934 -7.635 1.00 . A A . 20 ARG HH22 1 1 10 6340 1 1 20 ARG N N 1.742 4.780 -6.557 1.00 . A A . 20 ARG N 1 1 10 6341 1 1 20 ARG NE N -4.348 5.625 -6.888 1.00 . A A . 20 ARG NE 1 1 10 6342 1 1 20 ARG NH1 N -5.286 5.247 -8.963 1.00 . A A . 20 ARG NH1 1 1 10 6343 1 1 20 ARG NH2 N -6.589 5.166 -7.076 1.00 . A A . 20 ARG NH2 1 1 10 6344 1 1 20 ARG O O -0.554 2.274 -5.675 1.00 . A A . 20 ARG O 1 1 10 6345 1 1 21 ASP C C 1.194 0.226 -6.799 1.00 . A A . 21 ASP C 1 1 10 6346 1 1 21 ASP CA C 0.693 1.124 -7.926 1.00 . A A . 21 ASP CA 1 1 10 6347 1 1 21 ASP CB C 1.573 0.931 -9.167 1.00 . A A . 21 ASP CB 1 1 10 6348 1 1 21 ASP CG C 1.277 1.940 -10.259 1.00 . A A . 21 ASP CG 1 1 10 6349 1 1 21 ASP H H 1.179 3.176 -8.083 1.00 . A A . 21 ASP H 1 1 10 6350 1 1 21 ASP HA H -0.325 0.860 -8.166 1.00 . A A . 21 ASP HA 1 1 10 6351 1 1 21 ASP HB2 H 2.610 1.032 -8.883 1.00 . A A . 21 ASP HB2 1 1 10 6352 1 1 21 ASP HB3 H 1.410 -0.060 -9.565 1.00 . A A . 21 ASP HB3 1 1 10 6353 1 1 21 ASP N N 0.718 2.521 -7.515 1.00 . A A . 21 ASP N 1 1 10 6354 1 1 21 ASP O O 0.714 -0.893 -6.621 1.00 . A A . 21 ASP O 1 1 10 6355 1 1 21 ASP OD1 O 1.516 3.148 -10.052 1.00 . A A . 21 ASP OD1 1 1 10 6356 1 1 21 ASP OD2 O 0.785 1.531 -11.335 1.00 . A A . 21 ASP OD2 1 1 10 6357 1 1 22 ALA C C 1.720 -0.204 -3.791 1.00 . A A . 22 ALA C 1 1 10 6358 1 1 22 ALA CA C 2.725 -0.019 -4.920 1.00 . A A . 22 ALA CA 1 1 10 6359 1 1 22 ALA CB C 3.984 0.652 -4.397 1.00 . A A . 22 ALA CB 1 1 10 6360 1 1 22 ALA H H 2.457 1.654 -6.182 1.00 . A A . 22 ALA H 1 1 10 6361 1 1 22 ALA HA H 3.000 -0.992 -5.301 1.00 . A A . 22 ALA HA 1 1 10 6362 1 1 22 ALA HB1 H 4.432 0.031 -3.636 1.00 . A A . 22 ALA HB1 1 1 10 6363 1 1 22 ALA HB2 H 3.731 1.613 -3.976 1.00 . A A . 22 ALA HB2 1 1 10 6364 1 1 22 ALA HB3 H 4.683 0.787 -5.209 1.00 . A A . 22 ALA HB3 1 1 10 6365 1 1 22 ALA N N 2.146 0.738 -6.020 1.00 . A A . 22 ALA N 1 1 10 6366 1 1 22 ALA O O 1.757 -1.215 -3.090 1.00 . A A . 22 ALA O 1 1 10 6367 1 1 23 VAL C C -1.104 -0.540 -3.083 1.00 . A A . 23 VAL C 1 1 10 6368 1 1 23 VAL CA C -0.241 0.610 -2.639 1.00 . A A . 23 VAL CA 1 1 10 6369 1 1 23 VAL CB C -1.084 1.910 -2.467 1.00 . A A . 23 VAL CB 1 1 10 6370 1 1 23 VAL CG1 C -2.456 1.791 -3.077 1.00 . A A . 23 VAL CG1 1 1 10 6371 1 1 23 VAL CG2 C -1.223 2.270 -1.017 1.00 . A A . 23 VAL CG2 1 1 10 6372 1 1 23 VAL H H 0.830 1.568 -4.174 1.00 . A A . 23 VAL H 1 1 10 6373 1 1 23 VAL HA H 0.196 0.362 -1.696 1.00 . A A . 23 VAL HA 1 1 10 6374 1 1 23 VAL HB H -0.566 2.712 -2.966 1.00 . A A . 23 VAL HB 1 1 10 6375 1 1 23 VAL HG11 H -3.028 2.690 -2.875 1.00 . A A . 23 VAL HG11 1 1 10 6376 1 1 23 VAL HG12 H -2.953 0.936 -2.646 1.00 . A A . 23 VAL HG12 1 1 10 6377 1 1 23 VAL HG13 H -2.345 1.655 -4.139 1.00 . A A . 23 VAL HG13 1 1 10 6378 1 1 23 VAL HG21 H -0.403 2.920 -0.722 1.00 . A A . 23 VAL HG21 1 1 10 6379 1 1 23 VAL HG22 H -1.212 1.369 -0.427 1.00 . A A . 23 VAL HG22 1 1 10 6380 1 1 23 VAL HG23 H -2.170 2.778 -0.871 1.00 . A A . 23 VAL HG23 1 1 10 6381 1 1 23 VAL N N 0.811 0.761 -3.617 1.00 . A A . 23 VAL N 1 1 10 6382 1 1 23 VAL O O -1.345 -1.477 -2.372 1.00 . A A . 23 VAL O 1 1 10 6383 1 1 24 VAL C C -1.806 -2.888 -4.750 1.00 . A A . 24 VAL C 1 1 10 6384 1 1 24 VAL CA C -2.388 -1.488 -4.811 1.00 . A A . 24 VAL CA 1 1 10 6385 1 1 24 VAL CB C -2.841 -1.131 -6.224 1.00 . A A . 24 VAL CB 1 1 10 6386 1 1 24 VAL CG1 C -3.462 -2.334 -6.915 1.00 . A A . 24 VAL CG1 1 1 10 6387 1 1 24 VAL CG2 C -3.827 0.019 -6.157 1.00 . A A . 24 VAL CG2 1 1 10 6388 1 1 24 VAL H H -1.184 0.241 -4.869 1.00 . A A . 24 VAL H 1 1 10 6389 1 1 24 VAL HA H -3.252 -1.475 -4.164 1.00 . A A . 24 VAL HA 1 1 10 6390 1 1 24 VAL HB H -1.969 -0.801 -6.779 1.00 . A A . 24 VAL HB 1 1 10 6391 1 1 24 VAL HG11 H -3.785 -2.056 -7.906 1.00 . A A . 24 VAL HG11 1 1 10 6392 1 1 24 VAL HG12 H -4.309 -2.677 -6.338 1.00 . A A . 24 VAL HG12 1 1 10 6393 1 1 24 VAL HG13 H -2.728 -3.126 -6.981 1.00 . A A . 24 VAL HG13 1 1 10 6394 1 1 24 VAL HG21 H -4.282 0.164 -7.125 1.00 . A A . 24 VAL HG21 1 1 10 6395 1 1 24 VAL HG22 H -3.309 0.918 -5.859 1.00 . A A . 24 VAL HG22 1 1 10 6396 1 1 24 VAL HG23 H -4.592 -0.213 -5.426 1.00 . A A . 24 VAL HG23 1 1 10 6397 1 1 24 VAL N N -1.486 -0.500 -4.306 1.00 . A A . 24 VAL N 1 1 10 6398 1 1 24 VAL O O -2.449 -3.779 -4.226 1.00 . A A . 24 VAL O 1 1 10 6399 1 1 25 LYS C C 0.058 -4.954 -3.798 1.00 . A A . 25 LYS C 1 1 10 6400 1 1 25 LYS CA C 0.015 -4.401 -5.216 1.00 . A A . 25 LYS CA 1 1 10 6401 1 1 25 LYS CB C 1.433 -4.354 -5.800 1.00 . A A . 25 LYS CB 1 1 10 6402 1 1 25 LYS CD C 0.926 -4.916 -8.145 1.00 . A A . 25 LYS CD 1 1 10 6403 1 1 25 LYS CE C 1.919 -6.033 -8.426 1.00 . A A . 25 LYS CE 1 1 10 6404 1 1 25 LYS CG C 1.507 -3.878 -7.233 1.00 . A A . 25 LYS CG 1 1 10 6405 1 1 25 LYS H H -0.064 -2.305 -5.531 1.00 . A A . 25 LYS H 1 1 10 6406 1 1 25 LYS HA H -0.603 -5.045 -5.820 1.00 . A A . 25 LYS HA 1 1 10 6407 1 1 25 LYS HB2 H 2.014 -3.694 -5.214 1.00 . A A . 25 LYS HB2 1 1 10 6408 1 1 25 LYS HB3 H 1.865 -5.341 -5.751 1.00 . A A . 25 LYS HB3 1 1 10 6409 1 1 25 LYS HD2 H 0.076 -5.330 -7.640 1.00 . A A . 25 LYS HD2 1 1 10 6410 1 1 25 LYS HD3 H 0.623 -4.455 -9.074 1.00 . A A . 25 LYS HD3 1 1 10 6411 1 1 25 LYS HE2 H 2.813 -5.604 -8.852 1.00 . A A . 25 LYS HE2 1 1 10 6412 1 1 25 LYS HE3 H 2.165 -6.521 -7.494 1.00 . A A . 25 LYS HE3 1 1 10 6413 1 1 25 LYS HG2 H 0.945 -2.962 -7.332 1.00 . A A . 25 LYS HG2 1 1 10 6414 1 1 25 LYS HG3 H 2.540 -3.709 -7.500 1.00 . A A . 25 LYS HG3 1 1 10 6415 1 1 25 LYS HZ1 H 0.491 -7.452 -8.984 1.00 . A A . 25 LYS HZ1 1 1 10 6416 1 1 25 LYS HZ2 H 2.061 -7.808 -9.519 1.00 . A A . 25 LYS HZ2 1 1 10 6417 1 1 25 LYS HZ3 H 1.157 -6.599 -10.289 1.00 . A A . 25 LYS HZ3 1 1 10 6418 1 1 25 LYS N N -0.584 -3.073 -5.212 1.00 . A A . 25 LYS N 1 1 10 6419 1 1 25 LYS NZ N 1.370 -7.043 -9.371 1.00 . A A . 25 LYS NZ 1 1 10 6420 1 1 25 LYS O O -0.308 -6.107 -3.540 1.00 . A A . 25 LYS O 1 1 10 6421 1 1 26 ALA C C -0.606 -4.655 -0.760 1.00 . A A . 26 ALA C 1 1 10 6422 1 1 26 ALA CA C 0.683 -4.536 -1.516 1.00 . A A . 26 ALA CA 1 1 10 6423 1 1 26 ALA CB C 1.624 -3.578 -0.825 1.00 . A A . 26 ALA CB 1 1 10 6424 1 1 26 ALA H H 0.492 -3.135 -3.073 1.00 . A A . 26 ALA H 1 1 10 6425 1 1 26 ALA HA H 1.145 -5.512 -1.558 1.00 . A A . 26 ALA HA 1 1 10 6426 1 1 26 ALA HB1 H 2.567 -3.555 -1.353 1.00 . A A . 26 ALA HB1 1 1 10 6427 1 1 26 ALA HB2 H 1.787 -3.900 0.192 1.00 . A A . 26 ALA HB2 1 1 10 6428 1 1 26 ALA HB3 H 1.189 -2.588 -0.827 1.00 . A A . 26 ALA HB3 1 1 10 6429 1 1 26 ALA N N 0.439 -4.099 -2.864 1.00 . A A . 26 ALA N 1 1 10 6430 1 1 26 ALA O O -0.839 -5.632 -0.064 1.00 . A A . 26 ALA O 1 1 10 6431 1 1 27 LEU C C -3.635 -4.629 -0.754 1.00 . A A . 27 LEU C 1 1 10 6432 1 1 27 LEU CA C -2.680 -3.589 -0.194 1.00 . A A . 27 LEU CA 1 1 10 6433 1 1 27 LEU CB C -3.253 -2.173 -0.268 1.00 . A A . 27 LEU CB 1 1 10 6434 1 1 27 LEU CD1 C -2.802 -1.078 1.919 1.00 . A A . 27 LEU CD1 1 1 10 6435 1 1 27 LEU CD2 C -1.020 -1.212 0.278 1.00 . A A . 27 LEU CD2 1 1 10 6436 1 1 27 LEU CG C -2.487 -1.065 0.457 1.00 . A A . 27 LEU CG 1 1 10 6437 1 1 27 LEU H H -1.239 -2.927 -1.547 1.00 . A A . 27 LEU H 1 1 10 6438 1 1 27 LEU HA H -2.473 -3.828 0.837 1.00 . A A . 27 LEU HA 1 1 10 6439 1 1 27 LEU HB2 H -3.303 -1.897 -1.301 1.00 . A A . 27 LEU HB2 1 1 10 6440 1 1 27 LEU HB3 H -4.259 -2.197 0.125 1.00 . A A . 27 LEU HB3 1 1 10 6441 1 1 27 LEU HD11 H -2.460 -2.008 2.342 1.00 . A A . 27 LEU HD11 1 1 10 6442 1 1 27 LEU HD12 H -3.870 -0.993 2.049 1.00 . A A . 27 LEU HD12 1 1 10 6443 1 1 27 LEU HD13 H -2.308 -0.253 2.404 1.00 . A A . 27 LEU HD13 1 1 10 6444 1 1 27 LEU HD21 H -0.702 -2.129 0.751 1.00 . A A . 27 LEU HD21 1 1 10 6445 1 1 27 LEU HD22 H -0.512 -0.375 0.726 1.00 . A A . 27 LEU HD22 1 1 10 6446 1 1 27 LEU HD23 H -0.801 -1.256 -0.777 1.00 . A A . 27 LEU HD23 1 1 10 6447 1 1 27 LEU HG H -2.762 -0.116 0.040 1.00 . A A . 27 LEU HG 1 1 10 6448 1 1 27 LEU N N -1.450 -3.662 -0.915 1.00 . A A . 27 LEU N 1 1 10 6449 1 1 27 LEU O O -4.528 -5.079 -0.078 1.00 . A A . 27 LEU O 1 1 10 6450 1 1 28 LYS C C -3.828 -7.393 -1.773 1.00 . A A . 28 LYS C 1 1 10 6451 1 1 28 LYS CA C -4.185 -6.133 -2.553 1.00 . A A . 28 LYS CA 1 1 10 6452 1 1 28 LYS CB C -3.899 -6.363 -4.048 1.00 . A A . 28 LYS CB 1 1 10 6453 1 1 28 LYS CD C -6.095 -5.669 -4.891 1.00 . A A . 28 LYS CD 1 1 10 6454 1 1 28 LYS CE C -6.583 -6.837 -5.736 1.00 . A A . 28 LYS CE 1 1 10 6455 1 1 28 LYS CG C -4.628 -5.441 -5.001 1.00 . A A . 28 LYS CG 1 1 10 6456 1 1 28 LYS H H -2.914 -4.433 -2.610 1.00 . A A . 28 LYS H 1 1 10 6457 1 1 28 LYS HA H -5.234 -5.945 -2.418 1.00 . A A . 28 LYS HA 1 1 10 6458 1 1 28 LYS HB2 H -2.873 -6.223 -4.207 1.00 . A A . 28 LYS HB2 1 1 10 6459 1 1 28 LYS HB3 H -4.159 -7.381 -4.297 1.00 . A A . 28 LYS HB3 1 1 10 6460 1 1 28 LYS HD2 H -6.264 -5.896 -3.864 1.00 . A A . 28 LYS HD2 1 1 10 6461 1 1 28 LYS HD3 H -6.625 -4.770 -5.168 1.00 . A A . 28 LYS HD3 1 1 10 6462 1 1 28 LYS HE2 H -7.610 -6.656 -6.017 1.00 . A A . 28 LYS HE2 1 1 10 6463 1 1 28 LYS HE3 H -5.977 -6.894 -6.627 1.00 . A A . 28 LYS HE3 1 1 10 6464 1 1 28 LYS HG2 H -4.410 -4.411 -4.741 1.00 . A A . 28 LYS HG2 1 1 10 6465 1 1 28 LYS HG3 H -4.309 -5.646 -6.013 1.00 . A A . 28 LYS HG3 1 1 10 6466 1 1 28 LYS HZ1 H -7.030 -8.083 -4.117 1.00 . A A . 28 LYS HZ1 1 1 10 6467 1 1 28 LYS HZ2 H -5.508 -8.379 -4.804 1.00 . A A . 28 LYS HZ2 1 1 10 6468 1 1 28 LYS HZ3 H -6.918 -8.897 -5.594 1.00 . A A . 28 LYS HZ3 1 1 10 6469 1 1 28 LYS N N -3.475 -4.980 -2.019 1.00 . A A . 28 LYS N 1 1 10 6470 1 1 28 LYS NZ N -6.502 -8.136 -5.013 1.00 . A A . 28 LYS NZ 1 1 10 6471 1 1 28 LYS O O -4.724 -8.103 -1.316 1.00 . A A . 28 LYS O 1 1 10 6472 1 1 29 GLN C C -2.289 -8.868 0.551 1.00 . A A . 29 GLN C 1 1 10 6473 1 1 29 GLN CA C -2.154 -8.919 -0.967 1.00 . A A . 29 GLN CA 1 1 10 6474 1 1 29 GLN CB C -0.750 -9.260 -1.400 1.00 . A A . 29 GLN CB 1 1 10 6475 1 1 29 GLN CD C 1.496 -8.342 -1.975 1.00 . A A . 29 GLN CD 1 1 10 6476 1 1 29 GLN CG C 0.312 -8.261 -1.032 1.00 . A A . 29 GLN CG 1 1 10 6477 1 1 29 GLN H H -1.818 -7.052 -1.907 1.00 . A A . 29 GLN H 1 1 10 6478 1 1 29 GLN HA H -2.819 -9.685 -1.339 1.00 . A A . 29 GLN HA 1 1 10 6479 1 1 29 GLN HB2 H -0.485 -10.188 -0.979 1.00 . A A . 29 GLN HB2 1 1 10 6480 1 1 29 GLN HB3 H -0.749 -9.342 -2.453 1.00 . A A . 29 GLN HB3 1 1 10 6481 1 1 29 GLN HE21 H 1.852 -6.418 -1.725 1.00 . A A . 29 GLN HE21 1 1 10 6482 1 1 29 GLN HE22 H 2.895 -7.233 -2.834 1.00 . A A . 29 GLN HE22 1 1 10 6483 1 1 29 GLN HG2 H -0.105 -7.267 -1.072 1.00 . A A . 29 GLN HG2 1 1 10 6484 1 1 29 GLN HG3 H 0.648 -8.476 -0.039 1.00 . A A . 29 GLN HG3 1 1 10 6485 1 1 29 GLN N N -2.534 -7.677 -1.593 1.00 . A A . 29 GLN N 1 1 10 6486 1 1 29 GLN NE2 N 2.153 -7.221 -2.190 1.00 . A A . 29 GLN NE2 1 1 10 6487 1 1 29 GLN O O -2.499 -9.886 1.207 1.00 . A A . 29 GLN O 1 1 10 6488 1 1 29 GLN OE1 O 1.814 -9.407 -2.508 1.00 . A A . 29 GLN OE1 1 1 10 6489 1 1 30 THR C C -3.828 -7.157 2.854 1.00 . A A . 30 THR C 1 1 10 6490 1 1 30 THR CA C -2.366 -7.456 2.523 1.00 . A A . 30 THR CA 1 1 10 6491 1 1 30 THR CB C -1.522 -6.276 3.009 1.00 . A A . 30 THR CB 1 1 10 6492 1 1 30 THR CG2 C -0.044 -6.585 2.885 1.00 . A A . 30 THR CG2 1 1 10 6493 1 1 30 THR H H -1.850 -6.940 0.535 1.00 . A A . 30 THR H 1 1 10 6494 1 1 30 THR HA H -2.052 -8.341 3.057 1.00 . A A . 30 THR HA 1 1 10 6495 1 1 30 THR HB H -1.758 -6.091 4.037 1.00 . A A . 30 THR HB 1 1 10 6496 1 1 30 THR HG1 H -1.304 -5.095 1.449 1.00 . A A . 30 THR HG1 1 1 10 6497 1 1 30 THR HG21 H 0.192 -6.780 1.848 1.00 . A A . 30 THR HG21 1 1 10 6498 1 1 30 THR HG22 H 0.194 -7.453 3.480 1.00 . A A . 30 THR HG22 1 1 10 6499 1 1 30 THR HG23 H 0.530 -5.739 3.234 1.00 . A A . 30 THR HG23 1 1 10 6500 1 1 30 THR N N -2.156 -7.681 1.097 1.00 . A A . 30 THR N 1 1 10 6501 1 1 30 THR O O -4.229 -7.142 4.019 1.00 . A A . 30 THR O 1 1 10 6502 1 1 30 THR OG1 O -1.834 -5.103 2.256 1.00 . A A . 30 THR OG1 1 1 10 6503 1 1 31 ASN C C -6.088 -5.127 2.647 1.00 . A A . 31 ASN C 1 1 10 6504 1 1 31 ASN CA C -5.981 -6.462 1.903 1.00 . A A . 31 ASN CA 1 1 10 6505 1 1 31 ASN CB C -6.890 -7.515 2.533 1.00 . A A . 31 ASN CB 1 1 10 6506 1 1 31 ASN CG C -8.331 -7.315 2.118 1.00 . A A . 31 ASN CG 1 1 10 6507 1 1 31 ASN H H -4.238 -7.089 0.913 1.00 . A A . 31 ASN H 1 1 10 6508 1 1 31 ASN HA H -6.317 -6.293 0.888 1.00 . A A . 31 ASN HA 1 1 10 6509 1 1 31 ASN HB2 H -6.572 -8.497 2.216 1.00 . A A . 31 ASN HB2 1 1 10 6510 1 1 31 ASN HB3 H -6.828 -7.445 3.610 1.00 . A A . 31 ASN HB3 1 1 10 6511 1 1 31 ASN HD21 H -7.946 -8.203 0.386 1.00 . A A . 31 ASN HD21 1 1 10 6512 1 1 31 ASN HD22 H -9.575 -7.663 0.616 1.00 . A A . 31 ASN HD22 1 1 10 6513 1 1 31 ASN N N -4.603 -6.927 1.807 1.00 . A A . 31 ASN N 1 1 10 6514 1 1 31 ASN ND2 N -8.654 -7.769 0.923 1.00 . A A . 31 ASN ND2 1 1 10 6515 1 1 31 ASN O O -6.778 -5.013 3.660 1.00 . A A . 31 ASN O 1 1 10 6516 1 1 31 ASN OD1 O -9.135 -6.730 2.841 1.00 . A A . 31 ASN OD1 1 1 10 6517 1 1 32 GLY C C -4.994 -2.352 3.893 1.00 . A A . 32 GLY C 1 1 10 6518 1 1 32 GLY CA C -5.618 -2.764 2.554 1.00 . A A . 32 GLY CA 1 1 10 6519 1 1 32 GLY H H -4.762 -4.279 1.379 1.00 . A A . 32 GLY H 1 1 10 6520 1 1 32 GLY HA2 H -5.228 -2.117 1.772 1.00 . A A . 32 GLY HA2 1 1 10 6521 1 1 32 GLY HA3 H -6.687 -2.604 2.613 1.00 . A A . 32 GLY HA3 1 1 10 6522 1 1 32 GLY N N -5.401 -4.114 2.124 1.00 . A A . 32 GLY N 1 1 10 6523 1 1 32 GLY O O -5.173 -1.204 4.302 1.00 . A A . 32 GLY O 1 1 10 6524 1 1 33 ASN C C -2.278 -2.235 5.655 1.00 . A A . 33 ASN C 1 1 10 6525 1 1 33 ASN CA C -3.697 -2.792 5.862 1.00 . A A . 33 ASN CA 1 1 10 6526 1 1 33 ASN CB C -3.814 -3.890 6.927 1.00 . A A . 33 ASN CB 1 1 10 6527 1 1 33 ASN CG C -2.838 -5.041 6.836 1.00 . A A . 33 ASN CG 1 1 10 6528 1 1 33 ASN H H -4.181 -4.159 4.337 1.00 . A A . 33 ASN H 1 1 10 6529 1 1 33 ASN HA H -4.301 -1.968 6.186 1.00 . A A . 33 ASN HA 1 1 10 6530 1 1 33 ASN HB2 H -3.692 -3.440 7.875 1.00 . A A . 33 ASN HB2 1 1 10 6531 1 1 33 ASN HB3 H -4.813 -4.300 6.869 1.00 . A A . 33 ASN HB3 1 1 10 6532 1 1 33 ASN HD21 H -2.566 -4.729 4.917 1.00 . A A . 33 ASN HD21 1 1 10 6533 1 1 33 ASN HD22 H -1.692 -6.050 5.596 1.00 . A A . 33 ASN HD22 1 1 10 6534 1 1 33 ASN N N -4.280 -3.228 4.612 1.00 . A A . 33 ASN N 1 1 10 6535 1 1 33 ASN ND2 N -2.314 -5.300 5.667 1.00 . A A . 33 ASN ND2 1 1 10 6536 1 1 33 ASN O O -1.395 -2.894 5.110 1.00 . A A . 33 ASN O 1 1 10 6537 1 1 33 ASN OD1 O -2.541 -5.680 7.841 1.00 . A A . 33 ASN OD1 1 1 10 6538 1 1 34 ALA C C 0.407 -0.606 6.072 1.00 . A A . 34 ALA C 1 1 10 6539 1 1 34 ALA CA C -0.978 -0.141 5.639 1.00 . A A . 34 ALA CA 1 1 10 6540 1 1 34 ALA CB C -1.204 1.291 6.093 1.00 . A A . 34 ALA CB 1 1 10 6541 1 1 34 ALA H H -2.781 -0.583 6.661 1.00 . A A . 34 ALA H 1 1 10 6542 1 1 34 ALA HA H -0.990 -0.140 4.565 1.00 . A A . 34 ALA HA 1 1 10 6543 1 1 34 ALA HB1 H -2.190 1.614 5.791 1.00 . A A . 34 ALA HB1 1 1 10 6544 1 1 34 ALA HB2 H -0.462 1.933 5.642 1.00 . A A . 34 ALA HB2 1 1 10 6545 1 1 34 ALA HB3 H -1.121 1.346 7.168 1.00 . A A . 34 ALA HB3 1 1 10 6546 1 1 34 ALA N N -2.103 -0.981 6.069 1.00 . A A . 34 ALA N 1 1 10 6547 1 1 34 ALA O O 1.347 -0.548 5.277 1.00 . A A . 34 ALA O 1 1 10 6548 1 1 35 GLU C C 2.380 -2.623 7.104 1.00 . A A . 35 GLU C 1 1 10 6549 1 1 35 GLU CA C 1.876 -1.376 7.772 1.00 . A A . 35 GLU CA 1 1 10 6550 1 1 35 GLU CB C 1.866 -1.499 9.269 1.00 . A A . 35 GLU CB 1 1 10 6551 1 1 35 GLU CD C 3.071 0.649 9.751 1.00 . A A . 35 GLU CD 1 1 10 6552 1 1 35 GLU CG C 1.813 -0.172 9.945 1.00 . A A . 35 GLU CG 1 1 10 6553 1 1 35 GLU H H -0.160 -1.098 7.917 1.00 . A A . 35 GLU H 1 1 10 6554 1 1 35 GLU HA H 2.487 -0.590 7.508 1.00 . A A . 35 GLU HA 1 1 10 6555 1 1 35 GLU HB2 H 1.003 -2.059 9.578 1.00 . A A . 35 GLU HB2 1 1 10 6556 1 1 35 GLU HB3 H 2.744 -2.001 9.580 1.00 . A A . 35 GLU HB3 1 1 10 6557 1 1 35 GLU HG2 H 0.976 0.375 9.554 1.00 . A A . 35 GLU HG2 1 1 10 6558 1 1 35 GLU HG3 H 1.670 -0.349 10.976 1.00 . A A . 35 GLU HG3 1 1 10 6559 1 1 35 GLU N N 0.577 -1.027 7.308 1.00 . A A . 35 GLU N 1 1 10 6560 1 1 35 GLU O O 3.530 -2.722 6.660 1.00 . A A . 35 GLU O 1 1 10 6561 1 1 35 GLU OE1 O 3.182 1.349 8.726 1.00 . A A . 35 GLU OE1 1 1 10 6562 1 1 35 GLU OE2 O 3.953 0.605 10.639 1.00 . A A . 35 GLU OE2 1 1 10 6563 1 1 36 PHE C C 1.937 -4.504 4.834 1.00 . A A . 36 PHE C 1 1 10 6564 1 1 36 PHE CA C 1.711 -4.775 6.300 1.00 . A A . 36 PHE CA 1 1 10 6565 1 1 36 PHE CB C 0.502 -5.673 6.505 1.00 . A A . 36 PHE CB 1 1 10 6566 1 1 36 PHE CD1 C 0.766 -5.641 8.967 1.00 . A A . 36 PHE CD1 1 1 10 6567 1 1 36 PHE CD2 C 0.307 -7.732 7.937 1.00 . A A . 36 PHE CD2 1 1 10 6568 1 1 36 PHE CE1 C 0.798 -6.226 10.182 1.00 . A A . 36 PHE CE1 1 1 10 6569 1 1 36 PHE CE2 C 0.336 -8.343 9.179 1.00 . A A . 36 PHE CE2 1 1 10 6570 1 1 36 PHE CG C 0.523 -6.370 7.825 1.00 . A A . 36 PHE CG 1 1 10 6571 1 1 36 PHE CZ C 0.584 -7.584 10.308 1.00 . A A . 36 PHE CZ 1 1 10 6572 1 1 36 PHE H H 0.590 -3.360 7.372 1.00 . A A . 36 PHE H 1 1 10 6573 1 1 36 PHE HA H 2.588 -5.239 6.727 1.00 . A A . 36 PHE HA 1 1 10 6574 1 1 36 PHE HB2 H -0.387 -5.056 6.478 1.00 . A A . 36 PHE HB2 1 1 10 6575 1 1 36 PHE HB3 H 0.438 -6.395 5.721 1.00 . A A . 36 PHE HB3 1 1 10 6576 1 1 36 PHE HD1 H 0.934 -4.585 8.899 1.00 . A A . 36 PHE HD1 1 1 10 6577 1 1 36 PHE HD2 H 0.114 -8.319 7.050 1.00 . A A . 36 PHE HD2 1 1 10 6578 1 1 36 PHE HE1 H 0.993 -5.612 11.029 1.00 . A A . 36 PHE HE1 1 1 10 6579 1 1 36 PHE HE2 H 0.169 -9.407 9.264 1.00 . A A . 36 PHE HE2 1 1 10 6580 1 1 36 PHE HZ H 0.611 -8.051 11.282 1.00 . A A . 36 PHE HZ 1 1 10 6581 1 1 36 PHE N N 1.473 -3.535 6.986 1.00 . A A . 36 PHE N 1 1 10 6582 1 1 36 PHE O O 2.646 -5.235 4.149 1.00 . A A . 36 PHE O 1 1 10 6583 1 1 37 ALA C C 2.809 -2.621 2.610 1.00 . A A . 37 ALA C 1 1 10 6584 1 1 37 ALA CA C 1.412 -3.040 2.989 1.00 . A A . 37 ALA CA 1 1 10 6585 1 1 37 ALA CB C 0.461 -1.904 2.772 1.00 . A A . 37 ALA CB 1 1 10 6586 1 1 37 ALA H H 0.850 -2.831 4.997 1.00 . A A . 37 ALA H 1 1 10 6587 1 1 37 ALA HA H 1.103 -3.875 2.381 1.00 . A A . 37 ALA HA 1 1 10 6588 1 1 37 ALA HB1 H 0.711 -1.093 3.441 1.00 . A A . 37 ALA HB1 1 1 10 6589 1 1 37 ALA HB2 H -0.547 -2.236 2.969 1.00 . A A . 37 ALA HB2 1 1 10 6590 1 1 37 ALA HB3 H 0.535 -1.562 1.751 1.00 . A A . 37 ALA HB3 1 1 10 6591 1 1 37 ALA N N 1.347 -3.420 4.372 1.00 . A A . 37 ALA N 1 1 10 6592 1 1 37 ALA O O 3.352 -3.068 1.619 1.00 . A A . 37 ALA O 1 1 10 6593 1 1 38 ALA C C 5.676 -2.411 3.152 1.00 . A A . 38 ALA C 1 1 10 6594 1 1 38 ALA CA C 4.709 -1.261 3.217 1.00 . A A . 38 ALA CA 1 1 10 6595 1 1 38 ALA CB C 5.096 -0.334 4.346 1.00 . A A . 38 ALA CB 1 1 10 6596 1 1 38 ALA H H 2.850 -1.409 4.148 1.00 . A A . 38 ALA H 1 1 10 6597 1 1 38 ALA HA H 4.745 -0.707 2.290 1.00 . A A . 38 ALA HA 1 1 10 6598 1 1 38 ALA HB1 H 5.093 -0.883 5.274 1.00 . A A . 38 ALA HB1 1 1 10 6599 1 1 38 ALA HB2 H 4.388 0.477 4.402 1.00 . A A . 38 ALA HB2 1 1 10 6600 1 1 38 ALA HB3 H 6.083 0.058 4.162 1.00 . A A . 38 ALA HB3 1 1 10 6601 1 1 38 ALA N N 3.367 -1.747 3.411 1.00 . A A . 38 ALA N 1 1 10 6602 1 1 38 ALA O O 6.466 -2.509 2.228 1.00 . A A . 38 ALA O 1 1 10 6603 1 1 39 SER C C 6.340 -5.333 3.056 1.00 . A A . 39 SER C 1 1 10 6604 1 1 39 SER CA C 6.490 -4.404 4.234 1.00 . A A . 39 SER CA 1 1 10 6605 1 1 39 SER CB C 6.230 -5.153 5.542 1.00 . A A . 39 SER CB 1 1 10 6606 1 1 39 SER H H 4.746 -3.335 4.651 1.00 . A A . 39 SER H 1 1 10 6607 1 1 39 SER HA H 7.485 -3.987 4.244 1.00 . A A . 39 SER HA 1 1 10 6608 1 1 39 SER HB2 H 5.254 -5.612 5.495 1.00 . A A . 39 SER HB2 1 1 10 6609 1 1 39 SER HB3 H 6.984 -5.915 5.678 1.00 . A A . 39 SER HB3 1 1 10 6610 1 1 39 SER HG H 6.619 -3.414 6.376 1.00 . A A . 39 SER HG 1 1 10 6611 1 1 39 SER N N 5.540 -3.330 4.087 1.00 . A A . 39 SER N 1 1 10 6612 1 1 39 SER O O 7.274 -6.029 2.653 1.00 . A A . 39 SER O 1 1 10 6613 1 1 39 SER OG O 6.261 -4.271 6.652 1.00 . A A . 39 SER OG 1 1 10 6614 1 1 40 LEU C C 5.300 -5.454 0.115 1.00 . A A . 40 LEU C 1 1 10 6615 1 1 40 LEU CA C 4.830 -6.122 1.384 1.00 . A A . 40 LEU CA 1 1 10 6616 1 1 40 LEU CB C 3.333 -6.329 1.363 1.00 . A A . 40 LEU CB 1 1 10 6617 1 1 40 LEU CD1 C 3.670 -8.653 0.458 1.00 . A A . 40 LEU CD1 1 1 10 6618 1 1 40 LEU CD2 C 3.020 -8.326 2.840 1.00 . A A . 40 LEU CD2 1 1 10 6619 1 1 40 LEU CG C 2.878 -7.791 1.425 1.00 . A A . 40 LEU CG 1 1 10 6620 1 1 40 LEU H H 4.446 -4.702 2.817 1.00 . A A . 40 LEU H 1 1 10 6621 1 1 40 LEU HA H 5.328 -7.070 1.493 1.00 . A A . 40 LEU HA 1 1 10 6622 1 1 40 LEU HB2 H 2.912 -5.806 2.207 1.00 . A A . 40 LEU HB2 1 1 10 6623 1 1 40 LEU HB3 H 2.959 -5.867 0.492 1.00 . A A . 40 LEU HB3 1 1 10 6624 1 1 40 LEU HD11 H 3.320 -9.672 0.514 1.00 . A A . 40 LEU HD11 1 1 10 6625 1 1 40 LEU HD12 H 4.717 -8.615 0.718 1.00 . A A . 40 LEU HD12 1 1 10 6626 1 1 40 LEU HD13 H 3.536 -8.283 -0.549 1.00 . A A . 40 LEU HD13 1 1 10 6627 1 1 40 LEU HD21 H 2.392 -7.754 3.507 1.00 . A A . 40 LEU HD21 1 1 10 6628 1 1 40 LEU HD22 H 4.051 -8.238 3.155 1.00 . A A . 40 LEU HD22 1 1 10 6629 1 1 40 LEU HD23 H 2.725 -9.364 2.866 1.00 . A A . 40 LEU HD23 1 1 10 6630 1 1 40 LEU HG H 1.834 -7.848 1.147 1.00 . A A . 40 LEU HG 1 1 10 6631 1 1 40 LEU N N 5.145 -5.312 2.490 1.00 . A A . 40 LEU N 1 1 10 6632 1 1 40 LEU O O 5.893 -6.089 -0.738 1.00 . A A . 40 LEU O 1 1 10 6633 1 1 41 LEU C C 6.976 -3.410 -1.264 1.00 . A A . 41 LEU C 1 1 10 6634 1 1 41 LEU CA C 5.459 -3.472 -1.204 1.00 . A A . 41 LEU CA 1 1 10 6635 1 1 41 LEU CB C 4.746 -2.128 -1.299 1.00 . A A . 41 LEU CB 1 1 10 6636 1 1 41 LEU CD1 C 6.579 -0.548 -0.906 1.00 . A A . 41 LEU CD1 1 1 10 6637 1 1 41 LEU CD2 C 4.243 0.104 -0.389 1.00 . A A . 41 LEU CD2 1 1 10 6638 1 1 41 LEU CG C 5.250 -1.015 -0.416 1.00 . A A . 41 LEU CG 1 1 10 6639 1 1 41 LEU H H 4.670 -3.619 0.748 1.00 . A A . 41 LEU H 1 1 10 6640 1 1 41 LEU HA H 5.131 -4.070 -2.018 1.00 . A A . 41 LEU HA 1 1 10 6641 1 1 41 LEU HB2 H 4.791 -1.792 -2.322 1.00 . A A . 41 LEU HB2 1 1 10 6642 1 1 41 LEU HB3 H 3.710 -2.303 -1.042 1.00 . A A . 41 LEU HB3 1 1 10 6643 1 1 41 LEU HD11 H 6.476 -0.144 -1.900 1.00 . A A . 41 LEU HD11 1 1 10 6644 1 1 41 LEU HD12 H 7.246 -1.397 -0.927 1.00 . A A . 41 LEU HD12 1 1 10 6645 1 1 41 LEU HD13 H 6.967 0.206 -0.240 1.00 . A A . 41 LEU HD13 1 1 10 6646 1 1 41 LEU HD21 H 4.061 0.445 -1.396 1.00 . A A . 41 LEU HD21 1 1 10 6647 1 1 41 LEU HD22 H 4.621 0.918 0.209 1.00 . A A . 41 LEU HD22 1 1 10 6648 1 1 41 LEU HD23 H 3.324 -0.266 0.039 1.00 . A A . 41 LEU HD23 1 1 10 6649 1 1 41 LEU HG H 5.377 -1.376 0.578 1.00 . A A . 41 LEU HG 1 1 10 6650 1 1 41 LEU N N 5.079 -4.154 -0.005 1.00 . A A . 41 LEU N 1 1 10 6651 1 1 41 LEU O O 7.574 -3.337 -2.340 1.00 . A A . 41 LEU O 1 1 10 6652 1 1 42 PHE C C 9.715 -4.476 -0.691 1.00 . A A . 42 PHE C 1 1 10 6653 1 1 42 PHE CA C 9.013 -3.386 0.120 1.00 . A A . 42 PHE CA 1 1 10 6654 1 1 42 PHE CB C 9.354 -3.552 1.591 1.00 . A A . 42 PHE CB 1 1 10 6655 1 1 42 PHE CD1 C 8.970 -1.310 2.360 1.00 . A A . 42 PHE CD1 1 1 10 6656 1 1 42 PHE CD2 C 11.202 -2.081 2.432 1.00 . A A . 42 PHE CD2 1 1 10 6657 1 1 42 PHE CE1 C 9.352 -0.103 2.841 1.00 . A A . 42 PHE CE1 1 1 10 6658 1 1 42 PHE CE2 C 11.613 -0.859 2.930 1.00 . A A . 42 PHE CE2 1 1 10 6659 1 1 42 PHE CG C 9.865 -2.297 2.153 1.00 . A A . 42 PHE CG 1 1 10 6660 1 1 42 PHE CZ C 10.679 0.140 3.135 1.00 . A A . 42 PHE CZ 1 1 10 6661 1 1 42 PHE H H 7.010 -3.466 0.726 1.00 . A A . 42 PHE H 1 1 10 6662 1 1 42 PHE HA H 9.350 -2.391 -0.182 1.00 . A A . 42 PHE HA 1 1 10 6663 1 1 42 PHE HB2 H 8.457 -3.798 2.139 1.00 . A A . 42 PHE HB2 1 1 10 6664 1 1 42 PHE HB3 H 10.089 -4.316 1.720 1.00 . A A . 42 PHE HB3 1 1 10 6665 1 1 42 PHE HD1 H 7.927 -1.511 2.143 1.00 . A A . 42 PHE HD1 1 1 10 6666 1 1 42 PHE HD2 H 11.919 -2.871 2.265 1.00 . A A . 42 PHE HD2 1 1 10 6667 1 1 42 PHE HE1 H 8.616 0.644 2.976 1.00 . A A . 42 PHE HE1 1 1 10 6668 1 1 42 PHE HE2 H 12.655 -0.685 3.154 1.00 . A A . 42 PHE HE2 1 1 10 6669 1 1 42 PHE HZ H 10.985 1.102 3.521 1.00 . A A . 42 PHE HZ 1 1 10 6670 1 1 42 PHE N N 7.574 -3.422 -0.067 1.00 . A A . 42 PHE N 1 1 10 6671 1 1 42 PHE O O 10.930 -4.424 -0.888 1.00 . A A . 42 PHE O 1 1 10 6672 1 1 43 GLN C C 10.168 -5.940 -3.208 1.00 . A A . 43 GLN C 1 1 10 6673 1 1 43 GLN CA C 9.448 -6.540 -2.014 1.00 . A A . 43 GLN CA 1 1 10 6674 1 1 43 GLN CB C 8.299 -7.416 -2.515 1.00 . A A . 43 GLN CB 1 1 10 6675 1 1 43 GLN CD C 6.339 -8.919 -1.844 1.00 . A A . 43 GLN CD 1 1 10 6676 1 1 43 GLN CG C 7.704 -8.346 -1.460 1.00 . A A . 43 GLN CG 1 1 10 6677 1 1 43 GLN H H 7.981 -5.499 -0.868 1.00 . A A . 43 GLN H 1 1 10 6678 1 1 43 GLN HA H 10.137 -7.134 -1.452 1.00 . A A . 43 GLN HA 1 1 10 6679 1 1 43 GLN HB2 H 7.527 -6.771 -2.885 1.00 . A A . 43 GLN HB2 1 1 10 6680 1 1 43 GLN HB3 H 8.663 -8.021 -3.329 1.00 . A A . 43 GLN HB3 1 1 10 6681 1 1 43 GLN HE21 H 5.714 -7.161 -2.532 1.00 . A A . 43 GLN HE21 1 1 10 6682 1 1 43 GLN HE22 H 4.579 -8.440 -2.633 1.00 . A A . 43 GLN HE22 1 1 10 6683 1 1 43 GLN HG2 H 8.387 -9.168 -1.304 1.00 . A A . 43 GLN HG2 1 1 10 6684 1 1 43 GLN HG3 H 7.598 -7.794 -0.538 1.00 . A A . 43 GLN HG3 1 1 10 6685 1 1 43 GLN N N 8.936 -5.479 -1.135 1.00 . A A . 43 GLN N 1 1 10 6686 1 1 43 GLN NE2 N 5.458 -8.093 -2.397 1.00 . A A . 43 GLN NE2 1 1 10 6687 1 1 43 GLN O O 11.115 -6.520 -3.744 1.00 . A A . 43 GLN O 1 1 10 6688 1 1 43 GLN OE1 O 6.049 -10.083 -1.570 1.00 . A A . 43 GLN OE1 1 1 10 6689 1 1 44 SER C C 9.983 -4.728 -6.016 1.00 . A A . 44 SER C 1 1 10 6690 1 1 44 SER CA C 10.233 -3.998 -4.698 1.00 . A A . 44 SER CA 1 1 10 6691 1 1 44 SER CB C 11.730 -3.733 -4.483 1.00 . A A . 44 SER CB 1 1 10 6692 1 1 44 SER H H 8.942 -4.399 -3.079 1.00 . A A . 44 SER H 1 1 10 6693 1 1 44 SER HA H 9.712 -3.052 -4.726 1.00 . A A . 44 SER HA 1 1 10 6694 1 1 44 SER HB2 H 11.908 -3.534 -3.437 1.00 . A A . 44 SER HB2 1 1 10 6695 1 1 44 SER HB3 H 12.293 -4.605 -4.784 1.00 . A A . 44 SER HB3 1 1 10 6696 1 1 44 SER HG H 12.032 -1.809 -4.723 1.00 . A A . 44 SER HG 1 1 10 6697 1 1 44 SER N N 9.692 -4.766 -3.587 1.00 . A A . 44 SER N 1 1 10 6698 1 1 44 SER O O 10.889 -5.438 -6.496 1.00 . A A . 44 SER O 1 1 10 6699 1 1 44 SER OXT O 8.862 -4.599 -6.555 1.00 . A A . 44 SER OXT 1 1 10 6700 1 1 44 SER OG O 12.176 -2.619 -5.238 1.00 . A A . 44 SER OG 1 1 stop_ save_
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