NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
595741 | 2n0b | 25519 | cing | 4-filtered-FRED | STAR | entry | full | 50 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2n0b # This FRED archive file contains, for PDB entry <2n0b>: # # - 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_2n0b _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2n0b _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 1105.27 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 $Gastrin_releasing_peptide A . 1 1 stop_ save_ save_Gastrin_releasing_peptide _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Gastrin releasing peptide" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GNHWAVGHLMX _Entity.Number_of_monomers 11 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 ASN . 1 1 3 HIS . 1 1 4 TRP . 1 1 5 ALA . 1 1 6 VAL . 1 1 7 GLY . 1 1 8 HIS . 1 1 9 LEU . 1 1 10 MET . 1 1 11 NH2 $NH2 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 ASN 2 2 1 1 HIS 3 3 1 1 TRP 4 4 1 1 ALA 5 5 1 1 VAL 6 6 1 1 GLY 7 7 1 1 HIS 8 8 1 1 LEU 9 9 1 1 MET 10 10 1 1 NH2 11 11 1 1 stop_ save_ save_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NH2 _Chem_comp.Type non-polymer save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 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 3 HIS HA . 3 HIS HA 1 1 1 1 2 1 1 4 TRP H . 4 TRP H 1 1 2 1 1 1 1 4 TRP H . 4 TRP H 1 1 2 1 2 1 1 4 TRP HB2 . 4 TRP HB2 1 1 3 1 1 1 1 4 TRP H . 4 TRP H 1 1 3 1 2 1 1 4 TRP QB . 4 TRP QB 1 1 4 1 1 1 1 4 TRP H . 4 TRP H 1 1 4 1 2 1 1 4 TRP HB3 . 4 TRP HB3 1 1 5 1 1 1 1 4 TRP H . 4 TRP H 1 1 5 1 2 1 1 4 TRP HD1 . 4 TRP HD1 1 1 6 1 1 1 1 4 TRP H . 4 TRP H 1 1 6 1 2 1 1 4 TRP HE3 . 4 TRP HE3 1 1 7 1 1 1 1 4 TRP H . 4 TRP H 1 1 7 1 2 1 1 5 ALA H . 5 ALA H 1 1 8 1 1 1 1 4 TRP HA . 4 TRP HA 1 1 8 1 2 1 1 4 TRP HD1 . 4 TRP HD1 1 1 9 1 1 1 1 4 TRP HA . 4 TRP HA 1 1 9 1 2 1 1 4 TRP HE3 . 4 TRP HE3 1 1 10 1 1 1 1 4 TRP HA . 4 TRP HA 1 1 10 1 2 1 1 5 ALA HA . 5 ALA HA 1 1 11 1 1 1 1 4 TRP QB . 4 TRP QB 1 1 11 1 2 1 1 4 TRP HD1 . 4 TRP HD1 1 1 12 1 1 1 1 4 TRP QB . 4 TRP QB 1 1 12 1 2 1 1 4 TRP HE3 . 4 TRP HE3 1 1 13 1 1 1 1 4 TRP QB . 4 TRP QB 1 1 13 1 2 1 1 5 ALA H . 5 ALA H 1 1 14 1 1 1 1 4 TRP HB2 . 4 TRP HB2 1 1 14 1 2 1 1 4 TRP HD1 . 4 TRP HD1 1 1 15 1 1 1 1 4 TRP HB2 . 4 TRP HB2 1 1 15 1 2 1 1 5 ALA H . 5 ALA H 1 1 16 1 1 1 1 4 TRP HB3 . 4 TRP HB3 1 1 16 1 2 1 1 4 TRP HD1 . 4 TRP HD1 1 1 17 1 1 1 1 4 TRP HB3 . 4 TRP HB3 1 1 17 1 2 1 1 5 ALA H . 5 ALA H 1 1 18 1 1 1 1 4 TRP HD1 . 4 TRP HD1 1 1 18 1 2 1 1 5 ALA H . 5 ALA H 1 1 19 1 1 1 1 4 TRP HE3 . 4 TRP HE3 1 1 19 1 2 1 1 5 ALA H . 5 ALA H 1 1 20 1 1 1 1 4 TRP HE3 . 4 TRP HE3 1 1 20 1 2 1 1 5 ALA HA . 5 ALA HA 1 1 21 1 1 1 1 5 ALA H . 5 ALA H 1 1 21 1 2 1 1 5 ALA MB . 5 ALA QB 1 1 22 1 1 1 1 5 ALA H . 5 ALA H 1 1 22 1 2 1 1 6 VAL H . 6 VAL H 1 1 23 1 1 1 1 5 ALA HA . 5 ALA HA 1 1 23 1 2 1 1 6 VAL H . 6 VAL H 1 1 24 1 1 1 1 5 ALA HA . 5 ALA HA 1 1 24 1 2 1 1 6 VAL HA . 6 VAL HA 1 1 25 1 1 1 1 5 ALA HA . 5 ALA HA 1 1 25 1 2 1 1 6 VAL HB . 6 VAL HB 1 1 26 1 1 1 1 5 ALA HA . 5 ALA HA 1 1 26 1 2 1 1 6 VAL MG1 . 6 VAL QG1 1 1 27 1 1 1 1 5 ALA HA . 5 ALA HA 1 1 27 1 2 1 1 6 VAL MG2 . 6 VAL QG2 1 1 28 1 1 1 1 5 ALA HA . 5 ALA HA 1 1 28 1 2 1 1 7 GLY H . 7 GLY H 1 1 29 1 1 1 1 5 ALA MB . 5 ALA QB 1 1 29 1 2 1 1 6 VAL H . 6 VAL H 1 1 30 1 1 1 1 5 ALA MB . 5 ALA QB 1 1 30 1 2 1 1 6 VAL HA . 6 VAL HA 1 1 31 1 1 1 1 5 ALA MB . 5 ALA QB 1 1 31 1 2 1 1 7 GLY H . 7 GLY H 1 1 32 1 1 1 1 6 VAL H . 6 VAL H 1 1 32 1 2 1 1 6 VAL HB . 6 VAL HB 1 1 33 1 1 1 1 6 VAL H . 6 VAL H 1 1 33 1 2 1 1 6 VAL MG1 . 6 VAL QG1 1 1 34 1 1 1 1 6 VAL H . 6 VAL H 1 1 34 1 2 1 1 6 VAL QG . 6 VAL QQG 1 1 35 1 1 1 1 6 VAL H . 6 VAL H 1 1 35 1 2 1 1 6 VAL MG2 . 6 VAL QG2 1 1 36 1 1 1 1 6 VAL H . 6 VAL H 1 1 36 1 2 1 1 7 GLY H . 7 GLY H 1 1 37 1 1 1 1 6 VAL HB . 6 VAL HB 1 1 37 1 2 1 1 7 GLY H . 7 GLY H 1 1 38 1 1 1 1 6 VAL QG . 6 VAL QQG 1 1 38 1 2 1 1 7 GLY H . 7 GLY H 1 1 39 1 1 1 1 6 VAL QG . 6 VAL QQG 1 1 39 1 2 1 1 7 GLY QA . 7 GLY QA 1 1 40 1 1 1 1 7 GLY H . 7 GLY H 1 1 40 1 2 1 1 8 HIS H . 8 HIS H 1 1 41 1 1 1 1 7 GLY H . 7 GLY H 1 1 41 1 2 1 1 8 HIS HA . 8 HIS HA 1 1 42 1 1 1 1 7 GLY H . 7 GLY H 1 1 42 1 2 1 1 9 LEU H . 9 LEU H 1 1 43 1 1 1 1 8 HIS H . 8 HIS H 1 1 43 1 2 1 1 8 HIS HB2 . 8 HIS HB2 1 1 44 1 1 1 1 8 HIS H . 8 HIS H 1 1 44 1 2 1 1 8 HIS QB . 8 HIS QB 1 1 45 1 1 1 1 8 HIS H . 8 HIS H 1 1 45 1 2 1 1 8 HIS HB3 . 8 HIS HB3 1 1 46 1 1 1 1 8 HIS HA . 8 HIS HA 1 1 46 1 2 1 1 9 LEU H . 9 LEU H 1 1 47 1 1 1 1 8 HIS QB . 8 HIS QB 1 1 47 1 2 1 1 9 LEU H . 9 LEU H 1 1 48 1 1 1 1 8 HIS HB2 . 8 HIS HB2 1 1 48 1 2 1 1 9 LEU H . 9 LEU H 1 1 49 1 1 1 1 8 HIS HB3 . 8 HIS HB3 1 1 49 1 2 1 1 9 LEU H . 9 LEU H 1 1 50 1 1 1 1 9 LEU H . 9 LEU H 1 1 50 1 2 1 1 9 LEU QB . 9 LEU QB 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 3.08 1 1 2 1 . . . . . . . 3.79 1 1 3 1 . . . . . . . 3.24 1 1 4 1 . . . . . . . 3.79 1 1 5 1 . . . . . . . 4.55 1 1 6 1 . . . . . . . 5.13 1 1 7 1 . . . . . . . 3.45 1 1 8 1 . . . . . . . 4.31 1 1 9 1 . . . . . . . 3.97 1 1 10 1 . . . . . . . 4.96 1 1 11 1 . . . . . . . 3.22 1 1 12 1 . . . . . . . 3.58 1 1 13 1 . . . . . . . 3.64 1 1 14 1 . . . . . . . 3.74 1 1 15 1 . . . . . . . 4.18 1 1 16 1 . . . . . . . 3.74 1 1 17 1 . . . . . . . 4.18 1 1 18 1 . . . . . . . 5.4 1 1 19 1 . . . . . . . 4.74 1 1 20 1 . . . . . . . 4.86 1 1 21 1 . . . . . . . 3.62 1 1 22 1 . . . . . . . 3.84 1 1 23 1 . . . . . . . 2.87 1 1 24 1 . . . . . . . 5.09 1 1 25 1 . . . . . . . 5.03 1 1 26 1 . . . . . . . 5.5 1 1 27 1 . . . . . . . 5.5 1 1 28 1 . . . . . . . 5.32 1 1 29 1 . . . . . . . 4.14 1 1 30 1 . . . . . . . 5.29 1 1 31 1 . . . . . . . 5.11 1 1 32 1 . . . . . . . 3.45 1 1 33 1 . . . . . . . 4.68 1 1 34 1 . . . . . . . 4.0 1 1 35 1 . . . . . . . 4.68 1 1 36 1 . . . . . . . 3.95 1 1 37 1 . . . . . . . 4.22 1 1 38 1 . . . . . . . 4.46 1 1 39 1 . . . . . . . 4.87 1 1 40 1 . . . . . . . 4.19 1 1 41 1 . . . . . . . 5.5 1 1 42 1 . . . . . . . 4.2 1 1 43 1 . . . . . . . 4.13 1 1 44 1 . . . . . . . 3.6 1 1 45 1 . . . . . . . 4.13 1 1 46 1 . . . . . . . 3.12 1 1 47 1 . . . . . . . 4.2 1 1 48 1 . . . . . . . 4.79 1 1 49 1 . . . . . . . 4.79 1 1 50 1 . . . . . . . 3.6 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 11.136 2.111 6.305 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 11.920 2.065 7.600 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H 11.807 1.289 9.469 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H 10.346 1.702 8.824 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H 11.122 0.341 8.306 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H 12.056 3.083 7.962 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H 12.898 1.624 7.406 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N 11.248 1.290 8.628 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O 10.666 3.171 5.894 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 ASN C C 8.885 0.253 4.611 1.00 . A A . 2 ASN C 1 1 1 11 1 1 2 ASN CA C 10.264 0.872 4.398 1.00 . A A . 2 ASN CA 1 1 1 12 1 1 2 ASN CB C 11.054 0.048 3.381 1.00 . A A . 2 ASN CB 1 1 1 13 1 1 2 ASN CG C 10.727 0.426 1.950 1.00 . A A . 2 ASN CG 1 1 1 14 1 1 2 ASN H H 11.405 0.121 6.047 1.00 . A A . 2 ASN H 1 1 1 15 1 1 2 ASN HA H 10.135 1.880 4.002 1.00 . A A . 2 ASN HA 1 1 1 16 1 1 2 ASN HB2 H 12.118 0.210 3.551 1.00 . A A . 2 ASN HB2 1 1 1 17 1 1 2 ASN HB3 H 10.828 -1.008 3.529 1.00 . A A . 2 ASN HB3 1 1 1 18 1 1 2 ASN HD21 H 12.112 -0.884 1.250 1.00 . A A . 2 ASN HD21 1 1 1 19 1 1 2 ASN HD22 H 11.239 0.013 0.028 1.00 . A A . 2 ASN HD22 1 1 1 20 1 1 2 ASN N N 10.995 0.958 5.657 1.00 . A A . 2 ASN N 1 1 1 21 1 1 2 ASN ND2 N 11.414 -0.198 1.000 1.00 . A A . 2 ASN ND2 1 1 1 22 1 1 2 ASN O O 8.735 -0.714 5.360 1.00 . A A . 2 ASN O 1 1 1 23 1 1 2 ASN OD1 O 9.866 1.270 1.701 1.00 . A A . 2 ASN OD1 1 1 1 24 1 1 3 HIS C C 6.193 -0.651 2.930 1.00 . A A . 3 HIS C 1 1 1 25 1 1 3 HIS CA C 6.514 0.320 4.062 1.00 . A A . 3 HIS CA 1 1 1 26 1 1 3 HIS CB C 5.523 1.486 4.049 1.00 . A A . 3 HIS CB 1 1 1 27 1 1 3 HIS CD2 C 5.433 3.700 5.403 1.00 . A A . 3 HIS CD2 1 1 1 28 1 1 3 HIS CE1 C 5.910 2.868 7.371 1.00 . A A . 3 HIS CE1 1 1 1 29 1 1 3 HIS CG C 5.612 2.357 5.273 1.00 . A A . 3 HIS CG 1 1 1 30 1 1 3 HIS H H 8.069 1.608 3.348 1.00 . A A . 3 HIS H 1 1 1 31 1 1 3 HIS HA H 6.416 -0.209 5.011 1.00 . A A . 3 HIS HA 1 1 1 32 1 1 3 HIS HB2 H 5.713 2.099 3.168 1.00 . A A . 3 HIS HB2 1 1 1 33 1 1 3 HIS HB3 H 4.513 1.081 3.985 1.00 . A A . 3 HIS HB3 1 1 1 34 1 1 3 HIS HD2 H 5.188 4.394 4.612 1.00 . A A . 3 HIS HD2 1 1 1 35 1 1 3 HIS HE1 H 6.110 2.788 8.429 1.00 . A A . 3 HIS HE1 1 1 1 36 1 1 3 HIS HE2 H 5.563 4.926 7.155 1.00 . A A . 3 HIS HE2 1 1 1 37 1 1 3 HIS N N 7.881 0.817 3.947 1.00 . A A . 3 HIS N 1 1 1 38 1 1 3 HIS ND1 N 5.912 1.847 6.525 1.00 . A A . 3 HIS ND1 1 1 1 39 1 1 3 HIS NE2 N 5.626 4.009 6.737 1.00 . A A . 3 HIS NE2 1 1 1 40 1 1 3 HIS O O 5.850 -0.236 1.822 1.00 . A A . 3 HIS O 1 1 1 41 1 1 4 TRP C C 4.580 -2.890 1.742 1.00 . A A . 4 TRP C 1 1 1 42 1 1 4 TRP CA C 6.025 -2.973 2.220 1.00 . A A . 4 TRP CA 1 1 1 43 1 1 4 TRP CB C 6.307 -4.360 2.800 1.00 . A A . 4 TRP CB 1 1 1 44 1 1 4 TRP CD1 C 8.466 -5.726 2.619 1.00 . A A . 4 TRP CD1 1 1 1 45 1 1 4 TRP CD2 C 7.483 -5.295 0.654 1.00 . A A . 4 TRP CD2 1 1 1 46 1 1 4 TRP CE2 C 8.650 -6.046 0.416 1.00 . A A . 4 TRP CE2 1 1 1 47 1 1 4 TRP CE3 C 6.698 -4.907 -0.435 1.00 . A A . 4 TRP CE3 1 1 1 48 1 1 4 TRP CG C 7.384 -5.101 2.069 1.00 . A A . 4 TRP CG 1 1 1 49 1 1 4 TRP CH2 C 8.263 -6.024 -1.913 1.00 . A A . 4 TRP CH2 1 1 1 50 1 1 4 TRP CZ2 C 9.050 -6.416 -0.864 1.00 . A A . 4 TRP CZ2 1 1 1 51 1 1 4 TRP CZ3 C 7.097 -5.276 -1.707 1.00 . A A . 4 TRP CZ3 1 1 1 52 1 1 4 TRP H H 6.589 -2.220 4.143 1.00 . A A . 4 TRP H 1 1 1 53 1 1 4 TRP HA H 6.682 -2.815 1.365 1.00 . A A . 4 TRP HA 1 1 1 54 1 1 4 TRP HB2 H 6.612 -4.244 3.840 1.00 . A A . 4 TRP HB2 1 1 1 55 1 1 4 TRP HB3 H 5.390 -4.948 2.766 1.00 . A A . 4 TRP HB3 1 1 1 56 1 1 4 TRP HD1 H 8.687 -5.767 3.676 1.00 . A A . 4 TRP HD1 1 1 1 57 1 1 4 TRP HE1 H 10.087 -6.816 1.778 1.00 . A A . 4 TRP HE1 1 1 1 58 1 1 4 TRP HE3 H 5.797 -4.331 -0.287 1.00 . A A . 4 TRP HE3 1 1 1 59 1 1 4 TRP HH2 H 8.548 -6.297 -2.918 1.00 . A A . 4 TRP HH2 1 1 1 60 1 1 4 TRP HZ2 H 9.949 -6.992 -1.024 1.00 . A A . 4 TRP HZ2 1 1 1 61 1 1 4 TRP HZ3 H 6.499 -4.981 -2.557 1.00 . A A . 4 TRP HZ3 1 1 1 62 1 1 4 TRP N N 6.304 -1.943 3.215 1.00 . A A . 4 TRP N 1 1 1 63 1 1 4 TRP NE1 N 9.233 -6.297 1.632 1.00 . A A . 4 TRP NE1 1 1 1 64 1 1 4 TRP O O 4.320 -2.645 0.565 1.00 . A A . 4 TRP O 1 1 1 65 1 1 5 ALA C C 1.405 -2.549 3.523 1.00 . A A . 5 ALA C 1 1 1 66 1 1 5 ALA CA C 2.225 -3.042 2.335 1.00 . A A . 5 ALA CA 1 1 1 67 1 1 5 ALA CB C 1.736 -4.411 1.885 1.00 . A A . 5 ALA CB 1 1 1 68 1 1 5 ALA H H 3.922 -3.294 3.614 1.00 . A A . 5 ALA H 1 1 1 69 1 1 5 ALA HA H 2.090 -2.342 1.510 1.00 . A A . 5 ALA HA 1 1 1 70 1 1 5 ALA HB1 H 0.674 -4.357 1.643 1.00 . A A . 5 ALA HB1 1 1 1 71 1 1 5 ALA HB2 H 2.294 -4.725 1.003 1.00 . A A . 5 ALA HB2 1 1 1 72 1 1 5 ALA HB3 H 1.889 -5.133 2.687 1.00 . A A . 5 ALA HB3 1 1 1 73 1 1 5 ALA N N 3.643 -3.096 2.663 1.00 . A A . 5 ALA N 1 1 1 74 1 1 5 ALA O O 1.166 -3.291 4.476 1.00 . A A . 5 ALA O 1 1 1 75 1 1 6 VAL C C -1.211 -1.317 4.583 1.00 . A A . 6 VAL C 1 1 1 76 1 1 6 VAL CA C 0.181 -0.700 4.529 1.00 . A A . 6 VAL CA 1 1 1 77 1 1 6 VAL CB C 0.053 0.822 4.352 1.00 . A A . 6 VAL CB 1 1 1 78 1 1 6 VAL CG1 C -0.778 1.422 5.479 1.00 . A A . 6 VAL CG1 1 1 1 79 1 1 6 VAL CG2 C 1.426 1.473 4.291 1.00 . A A . 6 VAL CG2 1 1 1 80 1 1 6 VAL H H 1.206 -0.735 2.649 1.00 . A A . 6 VAL H 1 1 1 81 1 1 6 VAL HA H 0.681 -0.895 5.478 1.00 . A A . 6 VAL HA 1 1 1 82 1 1 6 VAL HB H -0.460 1.015 3.410 1.00 . A A . 6 VAL HB 1 1 1 83 1 1 6 VAL HG11 H -1.757 0.942 5.505 1.00 . A A . 6 VAL HG11 1 1 1 84 1 1 6 VAL HG12 H -0.270 1.262 6.430 1.00 . A A . 6 VAL HG12 1 1 1 85 1 1 6 VAL HG13 H -0.903 2.492 5.309 1.00 . A A . 6 VAL HG13 1 1 1 86 1 1 6 VAL HG21 H 2.003 1.029 3.479 1.00 . A A . 6 VAL HG21 1 1 1 87 1 1 6 VAL HG22 H 1.946 1.313 5.235 1.00 . A A . 6 VAL HG22 1 1 1 88 1 1 6 VAL HG23 H 1.314 2.543 4.114 1.00 . A A . 6 VAL HG23 1 1 1 89 1 1 6 VAL N N 0.976 -1.293 3.459 1.00 . A A . 6 VAL N 1 1 1 90 1 1 6 VAL O O -1.552 -2.025 5.531 1.00 . A A . 6 VAL O 1 1 1 91 1 1 7 GLY C C -4.172 -1.008 2.361 1.00 . A A . 7 GLY C 1 1 1 92 1 1 7 GLY CA C -3.364 -1.575 3.513 1.00 . A A . 7 GLY CA 1 1 1 93 1 1 7 GLY H H -1.685 -0.453 2.811 1.00 . A A . 7 GLY H 1 1 1 94 1 1 7 GLY HA2 H -3.312 -2.659 3.409 1.00 . A A . 7 GLY HA2 1 1 1 95 1 1 7 GLY HA3 H -3.870 -1.333 4.447 1.00 . A A . 7 GLY HA3 1 1 1 96 1 1 7 GLY N N -2.016 -1.042 3.562 1.00 . A A . 7 GLY N 1 1 1 97 1 1 7 GLY O O -4.591 -1.744 1.466 1.00 . A A . 7 GLY O 1 1 1 98 1 1 8 HIS C C -4.338 2.083 0.691 1.00 . A A . 8 HIS C 1 1 1 99 1 1 8 HIS CA C -5.155 0.967 1.334 1.00 . A A . 8 HIS CA 1 1 1 100 1 1 8 HIS CB C -6.457 1.532 1.900 1.00 . A A . 8 HIS CB 1 1 1 101 1 1 8 HIS CD2 C -7.509 1.519 -0.475 1.00 . A A . 8 HIS CD2 1 1 1 102 1 1 8 HIS CE1 C -9.433 2.426 0.046 1.00 . A A . 8 HIS CE1 1 1 1 103 1 1 8 HIS CG C -7.517 1.779 0.863 1.00 . A A . 8 HIS CG 1 1 1 104 1 1 8 HIS H H -4.022 0.851 3.146 1.00 . A A . 8 HIS H 1 1 1 105 1 1 8 HIS HA H -5.401 0.232 0.567 1.00 . A A . 8 HIS HA 1 1 1 106 1 1 8 HIS HB2 H -6.849 0.825 2.630 1.00 . A A . 8 HIS HB2 1 1 1 107 1 1 8 HIS HB3 H -6.238 2.472 2.406 1.00 . A A . 8 HIS HB3 1 1 1 108 1 1 8 HIS HD2 H -6.702 1.073 -1.036 1.00 . A A . 8 HIS HD2 1 1 1 109 1 1 8 HIS HE1 H -10.432 2.829 -0.035 1.00 . A A . 8 HIS HE1 1 1 1 110 1 1 8 HIS HE2 H -9.031 1.876 -1.939 1.00 . A A . 8 HIS HE2 1 1 1 111 1 1 8 HIS N N -4.392 0.302 2.383 1.00 . A A . 8 HIS N 1 1 1 112 1 1 8 HIS ND1 N -8.740 2.351 1.174 1.00 . A A . 8 HIS ND1 1 1 1 113 1 1 8 HIS NE2 N -8.729 1.934 -0.977 1.00 . A A . 8 HIS NE2 1 1 1 114 1 1 8 HIS O O -4.872 3.137 0.346 1.00 . A A . 8 HIS O 1 1 1 115 1 1 9 LEU C C -1.669 2.366 -1.438 1.00 . A A . 9 LEU C 1 1 1 116 1 1 9 LEU CA C -2.149 2.830 -0.067 1.00 . A A . 9 LEU CA 1 1 1 117 1 1 9 LEU CB C -0.948 3.084 0.847 1.00 . A A . 9 LEU CB 1 1 1 118 1 1 9 LEU CD1 C 0.487 4.872 1.859 1.00 . A A . 9 LEU CD1 1 1 1 119 1 1 9 LEU CD2 C 0.889 4.135 -0.497 1.00 . A A . 9 LEU CD2 1 1 1 120 1 1 9 LEU CG C -0.162 4.368 0.579 1.00 . A A . 9 LEU CG 1 1 1 121 1 1 9 LEU H H -2.662 0.958 0.837 1.00 . A A . 9 LEU H 1 1 1 122 1 1 9 LEU HA H -2.697 3.764 -0.188 1.00 . A A . 9 LEU HA 1 1 1 123 1 1 9 LEU HB2 H -1.313 3.125 1.873 1.00 . A A . 9 LEU HB2 1 1 1 124 1 1 9 LEU HB3 H -0.266 2.239 0.759 1.00 . A A . 9 LEU HB3 1 1 1 125 1 1 9 LEU HD11 H -0.279 5.033 2.617 1.00 . A A . 9 LEU HD11 1 1 1 126 1 1 9 LEU HD12 H 1.003 5.812 1.659 1.00 . A A . 9 LEU HD12 1 1 1 127 1 1 9 LEU HD13 H 1.204 4.134 2.218 1.00 . A A . 9 LEU HD13 1 1 1 128 1 1 9 LEU HD21 H 0.406 3.775 -1.405 1.00 . A A . 9 LEU HD21 1 1 1 129 1 1 9 LEU HD22 H 1.406 5.072 -0.707 1.00 . A A . 9 LEU HD22 1 1 1 130 1 1 9 LEU HD23 H 1.608 3.394 -0.148 1.00 . A A . 9 LEU HD23 1 1 1 131 1 1 9 LEU HG H -0.856 5.129 0.223 1.00 . A A . 9 LEU HG 1 1 1 132 1 1 9 LEU N N -3.040 1.844 0.534 1.00 . A A . 9 LEU N 1 1 1 133 1 1 9 LEU O O -1.298 1.207 -1.617 1.00 . A A . 9 LEU O 1 1 1 134 1 1 10 MET C C -0.001 3.773 -4.131 1.00 . A A . 10 MET C 1 1 1 135 1 1 10 MET CA C -1.240 2.965 -3.759 1.00 . A A . 10 MET CA 1 1 1 136 1 1 10 MET CB C -2.365 3.242 -4.757 1.00 . A A . 10 MET CB 1 1 1 137 1 1 10 MET CE C -5.031 2.165 -6.250 1.00 . A A . 10 MET CE 1 1 1 138 1 1 10 MET CG C -2.278 2.398 -6.019 1.00 . A A . 10 MET CG 1 1 1 139 1 1 10 MET H H -1.995 4.216 -2.194 1.00 . A A . 10 MET H 1 1 1 140 1 1 10 MET HA H -0.990 1.905 -3.804 1.00 . A A . 10 MET HA 1 1 1 141 1 1 10 MET HB2 H -3.318 3.037 -4.270 1.00 . A A . 10 MET HB2 1 1 1 142 1 1 10 MET HB3 H -2.334 4.296 -5.037 1.00 . A A . 10 MET HB3 1 1 1 143 1 1 10 MET HE1 H -5.937 2.313 -6.838 1.00 . A A . 10 MET HE1 1 1 1 144 1 1 10 MET HE2 H -5.107 2.725 -5.318 1.00 . A A . 10 MET HE2 1 1 1 145 1 1 10 MET HE3 H -4.910 1.104 -6.028 1.00 . A A . 10 MET HE3 1 1 1 146 1 1 10 MET HG2 H -1.324 2.592 -6.509 1.00 . A A . 10 MET HG2 1 1 1 147 1 1 10 MET HG3 H -2.325 1.346 -5.738 1.00 . A A . 10 MET HG3 1 1 1 148 1 1 10 MET N N -1.678 3.281 -2.404 1.00 . A A . 10 MET N 1 1 1 149 1 1 10 MET O O 0.121 4.256 -5.258 1.00 . A A . 10 MET O 1 1 1 150 1 1 10 MET SD S -3.613 2.745 -7.179 1.00 . A A . 10 MET SD 1 1 2 151 1 1 1 GLY C C 11.319 0.326 2.693 1.00 . A A . 1 GLY C 1 1 2 152 1 1 1 GLY CA C 11.395 0.793 1.253 1.00 . A A . 1 GLY CA 1 1 2 153 1 1 1 GLY H1 H 12.652 0.765 -0.335 1.00 . A A . 1 GLY H1 1 1 2 154 1 1 1 GLY H2 H 13.415 0.855 1.124 1.00 . A A . 1 GLY H2 1 1 2 155 1 1 1 GLY H3 H 12.754 -0.571 0.626 1.00 . A A . 1 GLY H3 1 1 2 156 1 1 1 GLY HA2 H 11.283 1.877 1.226 1.00 . A A . 1 GLY HA2 1 1 2 157 1 1 1 GLY HA3 H 10.578 0.338 0.694 1.00 . A A . 1 GLY HA3 1 1 2 158 1 1 1 GLY N N 12.649 0.433 0.618 1.00 . A A . 1 GLY N 1 1 2 159 1 1 1 GLY O O 11.965 -0.652 3.070 1.00 . A A . 1 GLY O 1 1 2 160 1 1 2 ASN C C 9.061 -0.060 5.144 1.00 . A A . 2 ASN C 1 1 2 161 1 1 2 ASN CA C 10.374 0.679 4.908 1.00 . A A . 2 ASN CA 1 1 2 162 1 1 2 ASN CB C 10.426 1.940 5.774 1.00 . A A . 2 ASN CB 1 1 2 163 1 1 2 ASN CG C 10.948 1.661 7.171 1.00 . A A . 2 ASN CG 1 1 2 164 1 1 2 ASN H H 10.027 1.820 3.131 1.00 . A A . 2 ASN H 1 1 2 165 1 1 2 ASN HA H 11.197 0.025 5.198 1.00 . A A . 2 ASN HA 1 1 2 166 1 1 2 ASN HB2 H 11.073 2.674 5.293 1.00 . A A . 2 ASN HB2 1 1 2 167 1 1 2 ASN HB3 H 9.420 2.352 5.852 1.00 . A A . 2 ASN HB3 1 1 2 168 1 1 2 ASN HD21 H 9.094 1.928 7.954 1.00 . A A . 2 ASN HD21 1 1 2 169 1 1 2 ASN HD22 H 10.350 1.535 9.107 1.00 . A A . 2 ASN HD22 1 1 2 170 1 1 2 ASN N N 10.530 1.027 3.501 1.00 . A A . 2 ASN N 1 1 2 171 1 1 2 ASN ND2 N 10.060 1.712 8.156 1.00 . A A . 2 ASN ND2 1 1 2 172 1 1 2 ASN O O 8.960 -0.897 6.042 1.00 . A A . 2 ASN O 1 1 2 173 1 1 2 ASN OD1 O 12.137 1.403 7.360 1.00 . A A . 2 ASN OD1 1 1 2 174 1 1 3 HIS C C 6.234 -0.823 3.084 1.00 . A A . 3 HIS C 1 1 2 175 1 1 3 HIS CA C 6.750 -0.382 4.451 1.00 . A A . 3 HIS CA 1 1 2 176 1 1 3 HIS CB C 5.751 0.573 5.100 1.00 . A A . 3 HIS CB 1 1 2 177 1 1 3 HIS CD2 C 6.192 -0.157 7.553 1.00 . A A . 3 HIS CD2 1 1 2 178 1 1 3 HIS CE1 C 6.174 1.833 8.467 1.00 . A A . 3 HIS CE1 1 1 2 179 1 1 3 HIS CG C 5.966 0.766 6.577 1.00 . A A . 3 HIS CG 1 1 2 180 1 1 3 HIS H H 8.203 0.950 3.614 1.00 . A A . 3 HIS H 1 1 2 181 1 1 3 HIS HA H 6.849 -1.263 5.085 1.00 . A A . 3 HIS HA 1 1 2 182 1 1 3 HIS HB2 H 5.837 1.544 4.611 1.00 . A A . 3 HIS HB2 1 1 2 183 1 1 3 HIS HB3 H 4.744 0.188 4.941 1.00 . A A . 3 HIS HB3 1 1 2 184 1 1 3 HIS HD2 H 6.257 -1.227 7.422 1.00 . A A . 3 HIS HD2 1 1 2 185 1 1 3 HIS HE1 H 6.224 2.626 9.199 1.00 . A A . 3 HIS HE1 1 1 2 186 1 1 3 HIS HE2 H 6.496 0.133 9.655 1.00 . A A . 3 HIS HE2 1 1 2 187 1 1 3 HIS N N 8.058 0.254 4.332 1.00 . A A . 3 HIS N 1 1 2 188 1 1 3 HIS ND1 N 5.959 2.017 7.173 1.00 . A A . 3 HIS ND1 1 1 2 189 1 1 3 HIS NE2 N 6.322 0.535 8.745 1.00 . A A . 3 HIS NE2 1 1 2 190 1 1 3 HIS O O 6.006 0.002 2.199 1.00 . A A . 3 HIS O 1 1 2 191 1 1 4 TRP C C 4.141 -2.212 1.376 1.00 . A A . 4 TRP C 1 1 2 192 1 1 4 TRP CA C 5.565 -2.680 1.660 1.00 . A A . 4 TRP CA 1 1 2 193 1 1 4 TRP CB C 5.615 -4.208 1.695 1.00 . A A . 4 TRP CB 1 1 2 194 1 1 4 TRP CD1 C 7.450 -5.722 0.741 1.00 . A A . 4 TRP CD1 1 1 2 195 1 1 4 TRP CD2 C 6.361 -4.511 -0.798 1.00 . A A . 4 TRP CD2 1 1 2 196 1 1 4 TRP CE2 C 7.335 -5.293 -1.449 1.00 . A A . 4 TRP CE2 1 1 2 197 1 1 4 TRP CE3 C 5.551 -3.668 -1.565 1.00 . A A . 4 TRP CE3 1 1 2 198 1 1 4 TRP CG C 6.450 -4.800 0.601 1.00 . A A . 4 TRP CG 1 1 2 199 1 1 4 TRP CH2 C 6.714 -4.422 -3.555 1.00 . A A . 4 TRP CH2 1 1 2 200 1 1 4 TRP CZ2 C 7.521 -5.256 -2.829 1.00 . A A . 4 TRP CZ2 1 1 2 201 1 1 4 TRP CZ3 C 5.737 -3.632 -2.934 1.00 . A A . 4 TRP CZ3 1 1 2 202 1 1 4 TRP H H 6.257 -2.755 3.685 1.00 . A A . 4 TRP H 1 1 2 203 1 1 4 TRP HA H 6.212 -2.330 0.856 1.00 . A A . 4 TRP HA 1 1 2 204 1 1 4 TRP HB2 H 6.019 -4.525 2.657 1.00 . A A . 4 TRP HB2 1 1 2 205 1 1 4 TRP HB3 H 4.598 -4.589 1.599 1.00 . A A . 4 TRP HB3 1 1 2 206 1 1 4 TRP HD1 H 7.771 -6.150 1.679 1.00 . A A . 4 TRP HD1 1 1 2 207 1 1 4 TRP HE1 H 8.737 -6.676 -0.657 1.00 . A A . 4 TRP HE1 1 1 2 208 1 1 4 TRP HE3 H 4.794 -3.057 -1.096 1.00 . A A . 4 TRP HE3 1 1 2 209 1 1 4 TRP HH2 H 6.832 -4.372 -4.627 1.00 . A A . 4 TRP HH2 1 1 2 210 1 1 4 TRP HZ2 H 8.275 -5.862 -3.309 1.00 . A A . 4 TRP HZ2 1 1 2 211 1 1 4 TRP HZ3 H 5.118 -2.983 -3.536 1.00 . A A . 4 TRP HZ3 1 1 2 212 1 1 4 TRP N N 6.053 -2.129 2.920 1.00 . A A . 4 TRP N 1 1 2 213 1 1 4 TRP NE1 N 7.986 -6.022 -0.488 1.00 . A A . 4 TRP NE1 1 1 2 214 1 1 4 TRP O O 3.899 -1.481 0.417 1.00 . A A . 4 TRP O 1 1 2 215 1 1 5 ALA C C 1.118 -2.116 3.410 1.00 . A A . 5 ALA C 1 1 2 216 1 1 5 ALA CA C 1.806 -2.259 2.056 1.00 . A A . 5 ALA CA 1 1 2 217 1 1 5 ALA CB C 1.077 -3.282 1.198 1.00 . A A . 5 ALA CB 1 1 2 218 1 1 5 ALA H H 3.468 -3.238 2.986 1.00 . A A . 5 ALA H 1 1 2 219 1 1 5 ALA HA H 1.768 -1.296 1.548 1.00 . A A . 5 ALA HA 1 1 2 220 1 1 5 ALA HB1 H 0.034 -2.986 1.086 1.00 . A A . 5 ALA HB1 1 1 2 221 1 1 5 ALA HB2 H 1.548 -3.333 0.216 1.00 . A A . 5 ALA HB2 1 1 2 222 1 1 5 ALA HB3 H 1.128 -4.260 1.676 1.00 . A A . 5 ALA HB3 1 1 2 223 1 1 5 ALA N N 3.205 -2.638 2.217 1.00 . A A . 5 ALA N 1 1 2 224 1 1 5 ALA O O 0.733 -3.108 4.030 1.00 . A A . 5 ALA O 1 1 2 225 1 1 6 VAL C C -1.139 -1.032 5.127 1.00 . A A . 6 VAL C 1 1 2 226 1 1 6 VAL CA C 0.323 -0.603 5.145 1.00 . A A . 6 VAL CA 1 1 2 227 1 1 6 VAL CB C 0.408 0.891 5.505 1.00 . A A . 6 VAL CB 1 1 2 228 1 1 6 VAL CG1 C -0.264 1.154 6.846 1.00 . A A . 6 VAL CG1 1 1 2 229 1 1 6 VAL CG2 C 1.855 1.355 5.525 1.00 . A A . 6 VAL CG2 1 1 2 230 1 1 6 VAL H H 1.306 -0.104 3.310 1.00 . A A . 6 VAL H 1 1 2 231 1 1 6 VAL HA H 0.839 -1.173 5.917 1.00 . A A . 6 VAL HA 1 1 2 232 1 1 6 VAL HB H -0.123 1.458 4.740 1.00 . A A . 6 VAL HB 1 1 2 233 1 1 6 VAL HG11 H -1.298 0.814 6.808 1.00 . A A . 6 VAL HG11 1 1 2 234 1 1 6 VAL HG12 H 0.267 0.615 7.630 1.00 . A A . 6 VAL HG12 1 1 2 235 1 1 6 VAL HG13 H -0.240 2.223 7.060 1.00 . A A . 6 VAL HG13 1 1 2 236 1 1 6 VAL HG21 H 2.314 1.157 4.557 1.00 . A A . 6 VAL HG21 1 1 2 237 1 1 6 VAL HG22 H 2.399 0.817 6.302 1.00 . A A . 6 VAL HG22 1 1 2 238 1 1 6 VAL HG23 H 1.891 2.425 5.732 1.00 . A A . 6 VAL HG23 1 1 2 239 1 1 6 VAL N N 0.967 -0.877 3.865 1.00 . A A . 6 VAL N 1 1 2 240 1 1 6 VAL O O -1.700 -1.401 6.157 1.00 . A A . 6 VAL O 1 1 2 241 1 1 7 GLY C C -3.683 -1.132 2.420 1.00 . A A . 7 GLY C 1 1 2 242 1 1 7 GLY CA C -3.144 -1.365 3.817 1.00 . A A . 7 GLY CA 1 1 2 243 1 1 7 GLY H H -1.243 -0.666 3.135 1.00 . A A . 7 GLY H 1 1 2 244 1 1 7 GLY HA2 H -3.237 -2.425 4.055 1.00 . A A . 7 GLY HA2 1 1 2 245 1 1 7 GLY HA3 H -3.740 -0.790 4.526 1.00 . A A . 7 GLY HA3 1 1 2 246 1 1 7 GLY N N -1.753 -0.979 3.949 1.00 . A A . 7 GLY N 1 1 2 247 1 1 7 GLY O O -3.483 -1.956 1.526 1.00 . A A . 7 GLY O 1 1 2 248 1 1 8 HIS C C -3.918 1.065 0.065 1.00 . A A . 8 HIS C 1 1 2 249 1 1 8 HIS CA C -4.936 0.327 0.929 1.00 . A A . 8 HIS CA 1 1 2 250 1 1 8 HIS CB C -6.190 1.183 1.103 1.00 . A A . 8 HIS CB 1 1 2 251 1 1 8 HIS CD2 C -6.981 0.563 -1.292 1.00 . A A . 8 HIS CD2 1 1 2 252 1 1 8 HIS CE1 C -8.623 2.002 -1.446 1.00 . A A . 8 HIS CE1 1 1 2 253 1 1 8 HIS CG C -7.043 1.276 -0.132 1.00 . A A . 8 HIS CG 1 1 2 254 1 1 8 HIS H H -4.497 0.626 3.003 1.00 . A A . 8 HIS H 1 1 2 255 1 1 8 HIS HA H -5.215 -0.597 0.423 1.00 . A A . 8 HIS HA 1 1 2 256 1 1 8 HIS HB2 H -6.790 0.765 1.912 1.00 . A A . 8 HIS HB2 1 1 2 257 1 1 8 HIS HB3 H -5.881 2.191 1.383 1.00 . A A . 8 HIS HB3 1 1 2 258 1 1 8 HIS HD2 H -6.278 -0.223 -1.526 1.00 . A A . 8 HIS HD2 1 1 2 259 1 1 8 HIS HE1 H -9.462 2.564 -1.832 1.00 . A A . 8 HIS HE1 1 1 2 260 1 1 8 HIS HE2 H -8.203 0.708 -3.044 1.00 . A A . 8 HIS HE2 1 1 2 261 1 1 8 HIS N N -4.367 -0.010 2.229 1.00 . A A . 8 HIS N 1 1 2 262 1 1 8 HIS ND1 N -8.086 2.180 -0.250 1.00 . A A . 8 HIS ND1 1 1 2 263 1 1 8 HIS NE2 N -7.988 1.035 -2.113 1.00 . A A . 8 HIS NE2 1 1 2 264 1 1 8 HIS O O -4.196 2.148 -0.451 1.00 . A A . 8 HIS O 1 1 2 265 1 1 9 LEU C C -1.235 2.405 -0.293 1.00 . A A . 9 LEU C 1 1 2 266 1 1 9 LEU CA C -1.679 1.074 -0.890 1.00 . A A . 9 LEU CA 1 1 2 267 1 1 9 LEU CB C -2.155 1.279 -2.329 1.00 . A A . 9 LEU CB 1 1 2 268 1 1 9 LEU CD1 C -0.512 -0.074 -3.652 1.00 . A A . 9 LEU CD1 1 1 2 269 1 1 9 LEU CD2 C -1.598 1.929 -4.686 1.00 . A A . 9 LEU CD2 1 1 2 270 1 1 9 LEU CG C -1.061 1.321 -3.397 1.00 . A A . 9 LEU CG 1 1 2 271 1 1 9 LEU H H -2.573 -0.417 0.361 1.00 . A A . 9 LEU H 1 1 2 272 1 1 9 LEU HA H -0.826 0.396 -0.900 1.00 . A A . 9 LEU HA 1 1 2 273 1 1 9 LEU HB2 H -2.831 0.461 -2.577 1.00 . A A . 9 LEU HB2 1 1 2 274 1 1 9 LEU HB3 H -2.715 2.213 -2.375 1.00 . A A . 9 LEU HB3 1 1 2 275 1 1 9 LEU HD11 H -0.133 -0.492 -2.720 1.00 . A A . 9 LEU HD11 1 1 2 276 1 1 9 LEU HD12 H -1.307 -0.712 -4.040 1.00 . A A . 9 LEU HD12 1 1 2 277 1 1 9 LEU HD13 H 0.297 -0.018 -4.381 1.00 . A A . 9 LEU HD13 1 1 2 278 1 1 9 LEU HD21 H -1.987 2.927 -4.483 1.00 . A A . 9 LEU HD21 1 1 2 279 1 1 9 LEU HD22 H -2.398 1.300 -5.078 1.00 . A A . 9 LEU HD22 1 1 2 280 1 1 9 LEU HD23 H -0.794 1.994 -5.419 1.00 . A A . 9 LEU HD23 1 1 2 281 1 1 9 LEU HG H -0.249 1.949 -3.033 1.00 . A A . 9 LEU HG 1 1 2 282 1 1 9 LEU N N -2.739 0.472 -0.088 1.00 . A A . 9 LEU N 1 1 2 283 1 1 9 LEU O O -0.997 3.372 -1.017 1.00 . A A . 9 LEU O 1 1 2 284 1 1 10 MET C C -1.631 4.826 1.389 1.00 . A A . 10 MET C 1 1 2 285 1 1 10 MET CA C -0.704 3.661 1.723 1.00 . A A . 10 MET CA 1 1 2 286 1 1 10 MET CB C 0.735 4.016 1.348 1.00 . A A . 10 MET CB 1 1 2 287 1 1 10 MET CE C 3.968 4.738 2.113 1.00 . A A . 10 MET CE 1 1 2 288 1 1 10 MET CG C 1.768 3.064 1.930 1.00 . A A . 10 MET CG 1 1 2 289 1 1 10 MET H H -1.335 1.621 1.569 1.00 . A A . 10 MET H 1 1 2 290 1 1 10 MET HA H -0.748 3.479 2.797 1.00 . A A . 10 MET HA 1 1 2 291 1 1 10 MET HB2 H 0.826 4.011 0.262 1.00 . A A . 10 MET HB2 1 1 2 292 1 1 10 MET HB3 H 0.948 5.021 1.713 1.00 . A A . 10 MET HB3 1 1 2 293 1 1 10 MET HE1 H 4.971 5.006 1.781 1.00 . A A . 10 MET HE1 1 1 2 294 1 1 10 MET HE2 H 3.985 4.517 3.180 1.00 . A A . 10 MET HE2 1 1 2 295 1 1 10 MET HE3 H 3.289 5.570 1.925 1.00 . A A . 10 MET HE3 1 1 2 296 1 1 10 MET HG2 H 1.830 3.231 3.005 1.00 . A A . 10 MET HG2 1 1 2 297 1 1 10 MET HG3 H 1.444 2.038 1.749 1.00 . A A . 10 MET HG3 1 1 2 298 1 1 10 MET N N -1.124 2.448 1.030 1.00 . A A . 10 MET N 1 1 2 299 1 1 10 MET O O -1.420 5.951 1.845 1.00 . A A . 10 MET O 1 1 2 300 1 1 10 MET SD S 3.407 3.295 1.214 1.00 . A A . 10 MET SD 1 1 3 301 1 1 1 GLY C C 10.004 2.754 1.604 1.00 . A A . 1 GLY C 1 1 3 302 1 1 1 GLY CA C 9.480 3.354 0.314 1.00 . A A . 1 GLY CA 1 1 3 303 1 1 1 GLY H1 H 10.060 3.701 -1.596 1.00 . A A . 1 GLY H1 1 1 3 304 1 1 1 GLY H2 H 11.287 3.778 -0.497 1.00 . A A . 1 GLY H2 1 1 3 305 1 1 1 GLY H3 H 10.675 2.314 -0.948 1.00 . A A . 1 GLY H3 1 1 3 306 1 1 1 GLY HA2 H 9.231 4.400 0.490 1.00 . A A . 1 GLY HA2 1 1 3 307 1 1 1 GLY HA3 H 8.578 2.820 0.015 1.00 . A A . 1 GLY HA3 1 1 3 308 1 1 1 GLY N N 10.449 3.281 -0.763 1.00 . A A . 1 GLY N 1 1 3 309 1 1 1 GLY O O 11.126 2.252 1.653 1.00 . A A . 1 GLY O 1 1 3 310 1 1 2 ASN C C 8.671 1.109 4.351 1.00 . A A . 2 ASN C 1 1 3 311 1 1 2 ASN CA C 9.577 2.269 3.951 1.00 . A A . 2 ASN CA 1 1 3 312 1 1 2 ASN CB C 9.524 3.363 5.019 1.00 . A A . 2 ASN CB 1 1 3 313 1 1 2 ASN CG C 10.514 4.480 4.750 1.00 . A A . 2 ASN CG 1 1 3 314 1 1 2 ASN H H 8.280 3.235 2.549 1.00 . A A . 2 ASN H 1 1 3 315 1 1 2 ASN HA H 10.601 1.901 3.882 1.00 . A A . 2 ASN HA 1 1 3 316 1 1 2 ASN HB2 H 8.519 3.784 5.039 1.00 . A A . 2 ASN HB2 1 1 3 317 1 1 2 ASN HB3 H 9.743 2.921 5.991 1.00 . A A . 2 ASN HB3 1 1 3 318 1 1 2 ASN HD21 H 12.065 3.273 5.259 1.00 . A A . 2 ASN HD21 1 1 3 319 1 1 2 ASN HD22 H 12.501 4.899 4.784 1.00 . A A . 2 ASN HD22 1 1 3 320 1 1 2 ASN N N 9.190 2.809 2.654 1.00 . A A . 2 ASN N 1 1 3 321 1 1 2 ASN ND2 N 11.795 4.195 4.947 1.00 . A A . 2 ASN ND2 1 1 3 322 1 1 2 ASN O O 9.096 0.183 5.041 1.00 . A A . 2 ASN O 1 1 3 323 1 1 2 ASN OD1 O 10.130 5.587 4.371 1.00 . A A . 2 ASN OD1 1 1 3 324 1 1 3 HIS C C 6.049 -0.641 2.962 1.00 . A A . 3 HIS C 1 1 3 325 1 1 3 HIS CA C 6.449 0.119 4.222 1.00 . A A . 3 HIS CA 1 1 3 326 1 1 3 HIS CB C 5.212 0.724 4.885 1.00 . A A . 3 HIS CB 1 1 3 327 1 1 3 HIS CD2 C 4.915 3.151 4.008 1.00 . A A . 3 HIS CD2 1 1 3 328 1 1 3 HIS CE1 C 3.184 2.795 2.717 1.00 . A A . 3 HIS CE1 1 1 3 329 1 1 3 HIS CG C 4.580 1.832 4.087 1.00 . A A . 3 HIS CG 1 1 3 330 1 1 3 HIS H H 7.128 1.951 3.347 1.00 . A A . 3 HIS H 1 1 3 331 1 1 3 HIS HA H 6.908 -0.582 4.919 1.00 . A A . 3 HIS HA 1 1 3 332 1 1 3 HIS HB2 H 4.473 -0.067 5.021 1.00 . A A . 3 HIS HB2 1 1 3 333 1 1 3 HIS HB3 H 5.493 1.112 5.864 1.00 . A A . 3 HIS HB3 1 1 3 334 1 1 3 HIS HD2 H 5.727 3.638 4.529 1.00 . A A . 3 HIS HD2 1 1 3 335 1 1 3 HIS HE1 H 2.371 2.955 2.024 1.00 . A A . 3 HIS HE1 1 1 3 336 1 1 3 HIS HE2 H 4.006 4.720 2.868 1.00 . A A . 3 HIS HE2 1 1 3 337 1 1 3 HIS N N 7.417 1.165 3.911 1.00 . A A . 3 HIS N 1 1 3 338 1 1 3 HIS ND1 N 3.484 1.626 3.265 1.00 . A A . 3 HIS ND1 1 1 3 339 1 1 3 HIS NE2 N 4.022 3.747 3.137 1.00 . A A . 3 HIS NE2 1 1 3 340 1 1 3 HIS O O 5.703 -0.040 1.945 1.00 . A A . 3 HIS O 1 1 3 341 1 1 4 TRP C C 4.271 -2.639 1.537 1.00 . A A . 4 TRP C 1 1 3 342 1 1 4 TRP CA C 5.741 -2.810 1.900 1.00 . A A . 4 TRP CA 1 1 3 343 1 1 4 TRP CB C 6.034 -4.278 2.216 1.00 . A A . 4 TRP CB 1 1 3 344 1 1 4 TRP CD1 C 8.177 -5.604 1.754 1.00 . A A . 4 TRP CD1 1 1 3 345 1 1 4 TRP CD2 C 7.193 -4.778 -0.080 1.00 . A A . 4 TRP CD2 1 1 3 346 1 1 4 TRP CE2 C 8.350 -5.481 -0.469 1.00 . A A . 4 TRP CE2 1 1 3 347 1 1 4 TRP CE3 C 6.410 -4.171 -1.065 1.00 . A A . 4 TRP CE3 1 1 3 348 1 1 4 TRP CG C 7.101 -4.870 1.346 1.00 . A A . 4 TRP CG 1 1 3 349 1 1 4 TRP CH2 C 7.957 -4.987 -2.745 1.00 . A A . 4 TRP CH2 1 1 3 350 1 1 4 TRP CZ2 C 8.742 -5.591 -1.800 1.00 . A A . 4 TRP CZ2 1 1 3 351 1 1 4 TRP CZ3 C 6.799 -4.282 -2.387 1.00 . A A . 4 TRP CZ3 1 1 3 352 1 1 4 TRP H H 6.390 -2.402 3.900 1.00 . A A . 4 TRP H 1 1 3 353 1 1 4 TRP HA H 6.346 -2.512 1.044 1.00 . A A . 4 TRP HA 1 1 3 354 1 1 4 TRP HB2 H 6.356 -4.350 3.255 1.00 . A A . 4 TRP HB2 1 1 3 355 1 1 4 TRP HB3 H 5.118 -4.854 2.091 1.00 . A A . 4 TRP HB3 1 1 3 356 1 1 4 TRP HD1 H 8.401 -5.857 2.779 1.00 . A A . 4 TRP HD1 1 1 3 357 1 1 4 TRP HE1 H 9.781 -6.523 0.703 1.00 . A A . 4 TRP HE1 1 1 3 358 1 1 4 TRP HE3 H 5.517 -3.625 -0.799 1.00 . A A . 4 TRP HE3 1 1 3 359 1 1 4 TRP HH2 H 8.235 -5.055 -3.786 1.00 . A A . 4 TRP HH2 1 1 3 360 1 1 4 TRP HZ2 H 9.633 -6.134 -2.078 1.00 . A A . 4 TRP HZ2 1 1 3 361 1 1 4 TRP HZ3 H 6.201 -3.817 -3.158 1.00 . A A . 4 TRP HZ3 1 1 3 362 1 1 4 TRP N N 6.098 -1.967 3.036 1.00 . A A . 4 TRP N 1 1 3 363 1 1 4 TRP NE1 N 8.933 -5.975 0.668 1.00 . A A . 4 TRP NE1 1 1 3 364 1 1 4 TRP O O 3.940 -2.210 0.431 1.00 . A A . 4 TRP O 1 1 3 365 1 1 5 ALA C C 1.222 -2.547 3.553 1.00 . A A . 5 ALA C 1 1 3 366 1 1 5 ALA CA C 1.955 -2.857 2.252 1.00 . A A . 5 ALA CA 1 1 3 367 1 1 5 ALA CB C 1.410 -4.133 1.628 1.00 . A A . 5 ALA CB 1 1 3 368 1 1 5 ALA H H 3.724 -3.322 3.361 1.00 . A A . 5 ALA H 1 1 3 369 1 1 5 ALA HA H 1.782 -2.035 1.557 1.00 . A A . 5 ALA HA 1 1 3 370 1 1 5 ALA HB1 H 0.337 -4.030 1.468 1.00 . A A . 5 ALA HB1 1 1 3 371 1 1 5 ALA HB2 H 1.904 -4.309 0.673 1.00 . A A . 5 ALA HB2 1 1 3 372 1 1 5 ALA HB3 H 1.600 -4.973 2.296 1.00 . A A . 5 ALA HB3 1 1 3 373 1 1 5 ALA N N 3.390 -2.976 2.473 1.00 . A A . 5 ALA N 1 1 3 374 1 1 5 ALA O O 1.027 -3.428 4.392 1.00 . A A . 5 ALA O 1 1 3 375 1 1 6 VAL C C -1.357 -1.275 4.859 1.00 . A A . 6 VAL C 1 1 3 376 1 1 6 VAL CA C 0.107 -0.865 4.916 1.00 . A A . 6 VAL CA 1 1 3 377 1 1 6 VAL CB C 0.199 0.660 5.109 1.00 . A A . 6 VAL CB 1 1 3 378 1 1 6 VAL CG1 C -0.531 1.384 3.987 1.00 . A A . 6 VAL CG1 1 1 3 379 1 1 6 VAL CG2 C -0.365 1.058 6.465 1.00 . A A . 6 VAL CG2 1 1 3 380 1 1 6 VAL H H 1.012 -0.615 2.991 1.00 . A A . 6 VAL H 1 1 3 381 1 1 6 VAL HA H 0.566 -1.349 5.778 1.00 . A A . 6 VAL HA 1 1 3 382 1 1 6 VAL HB H 1.250 0.947 5.077 1.00 . A A . 6 VAL HB 1 1 3 383 1 1 6 VAL HG11 H -0.111 1.084 3.027 1.00 . A A . 6 VAL HG11 1 1 3 384 1 1 6 VAL HG12 H -1.590 1.126 4.017 1.00 . A A . 6 VAL HG12 1 1 3 385 1 1 6 VAL HG13 H -0.416 2.461 4.114 1.00 . A A . 6 VAL HG13 1 1 3 386 1 1 6 VAL HG21 H 0.172 0.528 7.252 1.00 . A A . 6 VAL HG21 1 1 3 387 1 1 6 VAL HG22 H -1.423 0.798 6.509 1.00 . A A . 6 VAL HG22 1 1 3 388 1 1 6 VAL HG23 H -0.249 2.132 6.606 1.00 . A A . 6 VAL HG23 1 1 3 389 1 1 6 VAL N N 0.820 -1.291 3.716 1.00 . A A . 6 VAL N 1 1 3 390 1 1 6 VAL O O -2.005 -1.454 5.890 1.00 . A A . 6 VAL O 1 1 3 391 1 1 7 GLY C C -4.119 -0.686 2.912 1.00 . A A . 7 GLY C 1 1 3 392 1 1 7 GLY CA C -3.269 -1.809 3.474 1.00 . A A . 7 GLY CA 1 1 3 393 1 1 7 GLY H H -1.304 -1.259 2.830 1.00 . A A . 7 GLY H 1 1 3 394 1 1 7 GLY HA2 H -3.318 -2.663 2.798 1.00 . A A . 7 GLY HA2 1 1 3 395 1 1 7 GLY HA3 H -3.672 -2.100 4.444 1.00 . A A . 7 GLY HA3 1 1 3 396 1 1 7 GLY N N -1.880 -1.421 3.644 1.00 . A A . 7 GLY N 1 1 3 397 1 1 7 GLY O O -5.318 -0.611 3.184 1.00 . A A . 7 GLY O 1 1 3 398 1 1 8 HIS C C -3.906 1.409 0.032 1.00 . A A . 8 HIS C 1 1 3 399 1 1 8 HIS CA C -4.206 1.313 1.524 1.00 . A A . 8 HIS CA 1 1 3 400 1 1 8 HIS CB C -3.818 2.618 2.222 1.00 . A A . 8 HIS CB 1 1 3 401 1 1 8 HIS CD2 C -3.905 3.210 4.749 1.00 . A A . 8 HIS CD2 1 1 3 402 1 1 8 HIS CE1 C -6.016 2.742 5.093 1.00 . A A . 8 HIS CE1 1 1 3 403 1 1 8 HIS CG C -4.450 2.782 3.575 1.00 . A A . 8 HIS CG 1 1 3 404 1 1 8 HIS H H -2.512 0.071 1.940 1.00 . A A . 8 HIS H 1 1 3 405 1 1 8 HIS HA H -5.277 1.156 1.653 1.00 . A A . 8 HIS HA 1 1 3 406 1 1 8 HIS HB2 H -2.734 2.636 2.342 1.00 . A A . 8 HIS HB2 1 1 3 407 1 1 8 HIS HB3 H -4.115 3.455 1.591 1.00 . A A . 8 HIS HB3 1 1 3 408 1 1 8 HIS HD2 H -2.882 3.517 4.907 1.00 . A A . 8 HIS HD2 1 1 3 409 1 1 8 HIS HE1 H -6.971 2.611 5.581 1.00 . A A . 8 HIS HE1 1 1 3 410 1 1 8 HIS HE2 H -4.821 3.439 6.671 1.00 . A A . 8 HIS HE2 1 1 3 411 1 1 8 HIS N N -3.498 0.189 2.125 1.00 . A A . 8 HIS N 1 1 3 412 1 1 8 HIS ND1 N -5.784 2.490 3.813 1.00 . A A . 8 HIS ND1 1 1 3 413 1 1 8 HIS NE2 N -4.908 3.179 5.699 1.00 . A A . 8 HIS NE2 1 1 3 414 1 1 8 HIS O O -3.852 2.503 -0.531 1.00 . A A . 8 HIS O 1 1 3 415 1 1 9 LEU C C -4.398 -0.693 -2.762 1.00 . A A . 9 LEU C 1 1 3 416 1 1 9 LEU CA C -3.414 0.212 -2.030 1.00 . A A . 9 LEU CA 1 1 3 417 1 1 9 LEU CB C -1.983 -0.280 -2.258 1.00 . A A . 9 LEU CB 1 1 3 418 1 1 9 LEU CD1 C 0.446 -0.258 -1.640 1.00 . A A . 9 LEU CD1 1 1 3 419 1 1 9 LEU CD2 C -0.782 1.899 -1.951 1.00 . A A . 9 LEU CD2 1 1 3 420 1 1 9 LEU CG C -0.889 0.455 -1.483 1.00 . A A . 9 LEU CG 1 1 3 421 1 1 9 LEU H H -3.767 -0.607 -0.083 1.00 . A A . 9 LEU H 1 1 3 422 1 1 9 LEU HA H -3.503 1.220 -2.435 1.00 . A A . 9 LEU HA 1 1 3 423 1 1 9 LEU HB2 H -1.943 -1.332 -1.974 1.00 . A A . 9 LEU HB2 1 1 3 424 1 1 9 LEU HB3 H -1.759 -0.204 -3.322 1.00 . A A . 9 LEU HB3 1 1 3 425 1 1 9 LEU HD11 H 0.351 -1.289 -1.301 1.00 . A A . 9 LEU HD11 1 1 3 426 1 1 9 LEU HD12 H 0.742 -0.247 -2.689 1.00 . A A . 9 LEU HD12 1 1 3 427 1 1 9 LEU HD13 H 1.203 0.252 -1.044 1.00 . A A . 9 LEU HD13 1 1 3 428 1 1 9 LEU HD21 H -1.746 2.392 -1.832 1.00 . A A . 9 LEU HD21 1 1 3 429 1 1 9 LEU HD22 H -0.031 2.419 -1.356 1.00 . A A . 9 LEU HD22 1 1 3 430 1 1 9 LEU HD23 H -0.491 1.919 -3.002 1.00 . A A . 9 LEU HD23 1 1 3 431 1 1 9 LEU HG H -1.157 0.455 -0.427 1.00 . A A . 9 LEU HG 1 1 3 432 1 1 9 LEU N N -3.710 0.258 -0.602 1.00 . A A . 9 LEU N 1 1 3 433 1 1 9 LEU O O -4.057 -1.810 -3.152 1.00 . A A . 9 LEU O 1 1 3 434 1 1 10 MET C C -6.872 -0.438 -5.047 1.00 . A A . 10 MET C 1 1 3 435 1 1 10 MET CA C -6.654 -0.969 -3.635 1.00 . A A . 10 MET CA 1 1 3 436 1 1 10 MET CB C -7.965 -0.916 -2.848 1.00 . A A . 10 MET CB 1 1 3 437 1 1 10 MET CE C -9.953 -3.230 -1.140 1.00 . A A . 10 MET CE 1 1 3 438 1 1 10 MET CG C -7.846 -1.454 -1.431 1.00 . A A . 10 MET CG 1 1 3 439 1 1 10 MET H H -5.838 0.719 -2.599 1.00 . A A . 10 MET H 1 1 3 440 1 1 10 MET HA H -6.330 -2.008 -3.700 1.00 . A A . 10 MET HA 1 1 3 441 1 1 10 MET HB2 H -8.295 0.122 -2.797 1.00 . A A . 10 MET HB2 1 1 3 442 1 1 10 MET HB3 H -8.718 -1.497 -3.382 1.00 . A A . 10 MET HB3 1 1 3 443 1 1 10 MET HE1 H -10.928 -3.465 -0.711 1.00 . A A . 10 MET HE1 1 1 3 444 1 1 10 MET HE2 H -10.020 -3.253 -2.227 1.00 . A A . 10 MET HE2 1 1 3 445 1 1 10 MET HE3 H -9.222 -3.966 -0.805 1.00 . A A . 10 MET HE3 1 1 3 446 1 1 10 MET HG2 H -7.376 -2.437 -1.464 1.00 . A A . 10 MET HG2 1 1 3 447 1 1 10 MET HG3 H -7.215 -0.779 -0.853 1.00 . A A . 10 MET HG3 1 1 3 448 1 1 10 MET N N -5.620 -0.204 -2.945 1.00 . A A . 10 MET N 1 1 3 449 1 1 10 MET O O -6.950 -1.207 -6.006 1.00 . A A . 10 MET O 1 1 3 450 1 1 10 MET SD S -9.443 -1.598 -0.607 1.00 . A A . 10 MET SD 1 1 4 451 1 1 1 GLY C C 10.488 -0.885 8.464 1.00 . A A . 1 GLY C 1 1 4 452 1 1 1 GLY CA C 10.469 -1.064 9.969 1.00 . A A . 1 GLY CA 1 1 4 453 1 1 1 GLY H1 H 9.336 -0.446 11.530 1.00 . A A . 1 GLY H1 1 1 4 454 1 1 1 GLY H2 H 8.550 -1.452 10.487 1.00 . A A . 1 GLY H2 1 1 4 455 1 1 1 GLY H3 H 8.827 0.118 10.066 1.00 . A A . 1 GLY H3 1 1 4 456 1 1 1 GLY HA2 H 11.260 -0.457 10.408 1.00 . A A . 1 GLY HA2 1 1 4 457 1 1 1 GLY HA3 H 10.659 -2.113 10.199 1.00 . A A . 1 GLY HA3 1 1 4 458 1 1 1 GLY N N 9.199 -0.682 10.558 1.00 . A A . 1 GLY N 1 1 4 459 1 1 1 GLY O O 11.373 -0.225 7.923 1.00 . A A . 1 GLY O 1 1 4 460 1 1 2 ASN C C 8.059 -0.844 5.909 1.00 . A A . 2 ASN C 1 1 4 461 1 1 2 ASN CA C 9.421 -1.385 6.335 1.00 . A A . 2 ASN CA 1 1 4 462 1 1 2 ASN CB C 9.660 -2.754 5.697 1.00 . A A . 2 ASN CB 1 1 4 463 1 1 2 ASN CG C 9.084 -3.886 6.527 1.00 . A A . 2 ASN CG 1 1 4 464 1 1 2 ASN H H 8.814 -2.008 8.291 1.00 . A A . 2 ASN H 1 1 4 465 1 1 2 ASN HA H 10.192 -0.699 5.983 1.00 . A A . 2 ASN HA 1 1 4 466 1 1 2 ASN HB2 H 9.192 -2.769 4.713 1.00 . A A . 2 ASN HB2 1 1 4 467 1 1 2 ASN HB3 H 10.732 -2.910 5.582 1.00 . A A . 2 ASN HB3 1 1 4 468 1 1 2 ASN HD21 H 10.887 -4.819 6.567 1.00 . A A . 2 ASN HD21 1 1 4 469 1 1 2 ASN HD22 H 9.595 -5.639 7.415 1.00 . A A . 2 ASN HD22 1 1 4 470 1 1 2 ASN N N 9.511 -1.479 7.788 1.00 . A A . 2 ASN N 1 1 4 471 1 1 2 ASN ND2 N 9.922 -4.859 6.863 1.00 . A A . 2 ASN ND2 1 1 4 472 1 1 2 ASN O O 7.104 -0.851 6.687 1.00 . A A . 2 ASN O 1 1 4 473 1 1 2 ASN OD1 O 7.899 -3.886 6.860 1.00 . A A . 2 ASN OD1 1 1 4 474 1 1 3 HIS C C 6.316 -0.564 2.865 1.00 . A A . 3 HIS C 1 1 4 475 1 1 3 HIS CA C 6.731 0.169 4.137 1.00 . A A . 3 HIS CA 1 1 4 476 1 1 3 HIS CB C 6.883 1.663 3.849 1.00 . A A . 3 HIS CB 1 1 4 477 1 1 3 HIS CD2 C 8.273 2.178 1.716 1.00 . A A . 3 HIS CD2 1 1 4 478 1 1 3 HIS CE1 C 10.212 2.469 2.685 1.00 . A A . 3 HIS CE1 1 1 4 479 1 1 3 HIS CG C 8.117 2.001 3.058 1.00 . A A . 3 HIS CG 1 1 4 480 1 1 3 HIS H H 8.796 -0.396 4.077 1.00 . A A . 3 HIS H 1 1 4 481 1 1 3 HIS HA H 5.948 0.037 4.884 1.00 . A A . 3 HIS HA 1 1 4 482 1 1 3 HIS HB2 H 6.011 1.995 3.285 1.00 . A A . 3 HIS HB2 1 1 4 483 1 1 3 HIS HB3 H 6.914 2.201 4.796 1.00 . A A . 3 HIS HB3 1 1 4 484 1 1 3 HIS HD2 H 7.501 2.101 0.964 1.00 . A A . 3 HIS HD2 1 1 4 485 1 1 3 HIS HE1 H 11.263 2.668 2.836 1.00 . A A . 3 HIS HE1 1 1 4 486 1 1 3 HIS HE2 H 10.039 2.658 0.605 1.00 . A A . 3 HIS HE2 1 1 4 487 1 1 3 HIS N N 7.976 -0.375 4.667 1.00 . A A . 3 HIS N 1 1 4 488 1 1 3 HIS ND1 N 9.353 2.188 3.653 1.00 . A A . 3 HIS ND1 1 1 4 489 1 1 3 HIS NE2 N 9.605 2.473 1.498 1.00 . A A . 3 HIS NE2 1 1 4 490 1 1 3 HIS O O 6.304 0.016 1.779 1.00 . A A . 3 HIS O 1 1 4 491 1 1 4 TRP C C 4.129 -2.335 1.467 1.00 . A A . 4 TRP C 1 1 4 492 1 1 4 TRP CA C 5.566 -2.653 1.870 1.00 . A A . 4 TRP CA 1 1 4 493 1 1 4 TRP CB C 5.696 -4.141 2.203 1.00 . A A . 4 TRP CB 1 1 4 494 1 1 4 TRP CD1 C 7.813 -5.573 2.004 1.00 . A A . 4 TRP CD1 1 1 4 495 1 1 4 TRP CD2 C 7.036 -4.802 0.050 1.00 . A A . 4 TRP CD2 1 1 4 496 1 1 4 TRP CE2 C 8.193 -5.568 -0.197 1.00 . A A . 4 TRP CE2 1 1 4 497 1 1 4 TRP CE3 C 6.373 -4.215 -1.031 1.00 . A A . 4 TRP CE3 1 1 4 498 1 1 4 TRP CG C 6.811 -4.818 1.463 1.00 . A A . 4 TRP CG 1 1 4 499 1 1 4 TRP CH2 C 8.029 -5.174 -2.521 1.00 . A A . 4 TRP CH2 1 1 4 500 1 1 4 TRP CZ2 C 8.697 -5.759 -1.480 1.00 . A A . 4 TRP CZ2 1 1 4 501 1 1 4 TRP CZ3 C 6.876 -4.407 -2.304 1.00 . A A . 4 TRP CZ3 1 1 4 502 1 1 4 TRP H H 6.010 -2.259 3.926 1.00 . A A . 4 TRP H 1 1 4 503 1 1 4 TRP HA H 6.220 -2.428 1.027 1.00 . A A . 4 TRP HA 1 1 4 504 1 1 4 TRP HB2 H 5.880 -4.241 3.273 1.00 . A A . 4 TRP HB2 1 1 4 505 1 1 4 TRP HB3 H 4.758 -4.639 1.959 1.00 . A A . 4 TRP HB3 1 1 4 506 1 1 4 TRP HD1 H 7.932 -5.783 3.057 1.00 . A A . 4 TRP HD1 1 1 4 507 1 1 4 TRP HE1 H 9.465 -6.603 1.149 1.00 . A A . 4 TRP HE1 1 1 4 508 1 1 4 TRP HE3 H 5.484 -3.623 -0.875 1.00 . A A . 4 TRP HE3 1 1 4 509 1 1 4 TRP HH2 H 8.397 -5.305 -3.528 1.00 . A A . 4 TRP HH2 1 1 4 510 1 1 4 TRP HZ2 H 9.586 -6.350 -1.649 1.00 . A A . 4 TRP HZ2 1 1 4 511 1 1 4 TRP HZ3 H 6.371 -3.958 -3.147 1.00 . A A . 4 TRP HZ3 1 1 4 512 1 1 4 TRP N N 5.979 -1.841 3.008 1.00 . A A . 4 TRP N 1 1 4 513 1 1 4 TRP NE1 N 8.648 -6.026 1.011 1.00 . A A . 4 TRP NE1 1 1 4 514 1 1 4 TRP O O 3.884 -1.771 0.400 1.00 . A A . 4 TRP O 1 1 4 515 1 1 5 ALA C C 1.021 -2.128 3.348 1.00 . A A . 5 ALA C 1 1 4 516 1 1 5 ALA CA C 1.773 -2.452 2.061 1.00 . A A . 5 ALA CA 1 1 4 517 1 1 5 ALA CB C 1.145 -3.654 1.369 1.00 . A A . 5 ALA CB 1 1 4 518 1 1 5 ALA H H 3.450 -3.164 3.184 1.00 . A A . 5 ALA H 1 1 4 519 1 1 5 ALA HA H 1.696 -1.593 1.394 1.00 . A A . 5 ALA HA 1 1 4 520 1 1 5 ALA HB1 H 0.091 -3.454 1.177 1.00 . A A . 5 ALA HB1 1 1 4 521 1 1 5 ALA HB2 H 1.238 -4.530 2.010 1.00 . A A . 5 ALA HB2 1 1 4 522 1 1 5 ALA HB3 H 1.658 -3.838 0.425 1.00 . A A . 5 ALA HB3 1 1 4 523 1 1 5 ALA N N 3.184 -2.701 2.326 1.00 . A A . 5 ALA N 1 1 4 524 1 1 5 ALA O O 0.551 -3.025 4.047 1.00 . A A . 5 ALA O 1 1 4 525 1 1 6 VAL C C -1.188 -0.985 4.929 1.00 . A A . 6 VAL C 1 1 4 526 1 1 6 VAL CA C 0.215 -0.395 4.859 1.00 . A A . 6 VAL CA 1 1 4 527 1 1 6 VAL CB C 0.121 1.139 4.918 1.00 . A A . 6 VAL CB 1 1 4 528 1 1 6 VAL CG1 C -0.560 1.682 3.671 1.00 . A A . 6 VAL CG1 1 1 4 529 1 1 6 VAL CG2 C -0.620 1.578 6.173 1.00 . A A . 6 VAL CG2 1 1 4 530 1 1 6 VAL H H 1.321 -0.150 3.041 1.00 . A A . 6 VAL H 1 1 4 531 1 1 6 VAL HA H 0.776 -0.739 5.727 1.00 . A A . 6 VAL HA 1 1 4 532 1 1 6 VAL HB H 1.133 1.542 4.959 1.00 . A A . 6 VAL HB 1 1 4 533 1 1 6 VAL HG11 H -0.013 1.355 2.786 1.00 . A A . 6 VAL HG11 1 1 4 534 1 1 6 VAL HG12 H -1.583 1.309 3.624 1.00 . A A . 6 VAL HG12 1 1 4 535 1 1 6 VAL HG13 H -0.572 2.771 3.709 1.00 . A A . 6 VAL HG13 1 1 4 536 1 1 6 VAL HG21 H -0.116 1.178 7.052 1.00 . A A . 6 VAL HG21 1 1 4 537 1 1 6 VAL HG22 H -0.632 2.667 6.225 1.00 . A A . 6 VAL HG22 1 1 4 538 1 1 6 VAL HG23 H -1.644 1.205 6.140 1.00 . A A . 6 VAL HG23 1 1 4 539 1 1 6 VAL N N 0.912 -0.839 3.656 1.00 . A A . 6 VAL N 1 1 4 540 1 1 6 VAL O O -1.712 -1.240 6.013 1.00 . A A . 6 VAL O 1 1 4 541 1 1 7 GLY C C -3.960 -1.183 2.584 1.00 . A A . 7 GLY C 1 1 4 542 1 1 7 GLY CA C -3.133 -1.758 3.717 1.00 . A A . 7 GLY CA 1 1 4 543 1 1 7 GLY H H -1.318 -0.972 2.904 1.00 . A A . 7 GLY H 1 1 4 544 1 1 7 GLY HA2 H -3.057 -2.837 3.581 1.00 . A A . 7 GLY HA2 1 1 4 545 1 1 7 GLY HA3 H -3.635 -1.554 4.662 1.00 . A A . 7 GLY HA3 1 1 4 546 1 1 7 GLY N N -1.794 -1.200 3.764 1.00 . A A . 7 GLY N 1 1 4 547 1 1 7 GLY O O -4.653 -1.915 1.877 1.00 . A A . 7 GLY O 1 1 4 548 1 1 8 HIS C C -3.912 0.705 0.022 1.00 . A A . 8 HIS C 1 1 4 549 1 1 8 HIS CA C -4.641 0.809 1.359 1.00 . A A . 8 HIS CA 1 1 4 550 1 1 8 HIS CB C -4.860 2.278 1.718 1.00 . A A . 8 HIS CB 1 1 4 551 1 1 8 HIS CD2 C -6.005 3.555 -0.230 1.00 . A A . 8 HIS CD2 1 1 4 552 1 1 8 HIS CE1 C -8.042 3.567 0.574 1.00 . A A . 8 HIS CE1 1 1 4 553 1 1 8 HIS CG C -6.000 2.917 0.973 1.00 . A A . 8 HIS CG 1 1 4 554 1 1 8 HIS H H -3.305 0.681 3.027 1.00 . A A . 8 HIS H 1 1 4 555 1 1 8 HIS HA H -5.613 0.326 1.262 1.00 . A A . 8 HIS HA 1 1 4 556 1 1 8 HIS HB2 H -5.067 2.344 2.786 1.00 . A A . 8 HIS HB2 1 1 4 557 1 1 8 HIS HB3 H -3.946 2.831 1.503 1.00 . A A . 8 HIS HB3 1 1 4 558 1 1 8 HIS HD2 H -5.154 3.715 -0.876 1.00 . A A . 8 HIS HD2 1 1 4 559 1 1 8 HIS HE1 H -9.103 3.740 0.677 1.00 . A A . 8 HIS HE1 1 1 4 560 1 1 8 HIS HE2 H -7.639 4.462 -1.281 1.00 . A A . 8 HIS HE2 1 1 4 561 1 1 8 HIS N N -3.891 0.134 2.413 1.00 . A A . 8 HIS N 1 1 4 562 1 1 8 HIS ND1 N -7.293 2.934 1.466 1.00 . A A . 8 HIS ND1 1 1 4 563 1 1 8 HIS NE2 N -7.307 3.961 -0.469 1.00 . A A . 8 HIS NE2 1 1 4 564 1 1 8 HIS O O -3.583 1.716 -0.597 1.00 . A A . 8 HIS O 1 1 4 565 1 1 9 LEU C C -3.798 -1.666 -2.591 1.00 . A A . 9 LEU C 1 1 4 566 1 1 9 LEU CA C -2.973 -0.761 -1.680 1.00 . A A . 9 LEU CA 1 1 4 567 1 1 9 LEU CB C -1.602 -1.387 -1.425 1.00 . A A . 9 LEU CB 1 1 4 568 1 1 9 LEU CD1 C 0.801 -1.370 -2.138 1.00 . A A . 9 LEU CD1 1 1 4 569 1 1 9 LEU CD2 C -0.888 -2.643 -3.474 1.00 . A A . 9 LEU CD2 1 1 4 570 1 1 9 LEU CG C -0.642 -1.411 -2.615 1.00 . A A . 9 LEU CG 1 1 4 571 1 1 9 LEU H H -3.960 -1.314 0.138 1.00 . A A . 9 LEU H 1 1 4 572 1 1 9 LEU HA H -2.829 0.196 -2.182 1.00 . A A . 9 LEU HA 1 1 4 573 1 1 9 LEU HB2 H -1.124 -0.825 -0.622 1.00 . A A . 9 LEU HB2 1 1 4 574 1 1 9 LEU HB3 H -1.751 -2.412 -1.084 1.00 . A A . 9 LEU HB3 1 1 4 575 1 1 9 LEU HD11 H 0.957 -0.482 -1.526 1.00 . A A . 9 LEU HD11 1 1 4 576 1 1 9 LEU HD12 H 1.013 -2.261 -1.547 1.00 . A A . 9 LEU HD12 1 1 4 577 1 1 9 LEU HD13 H 1.467 -1.338 -3.000 1.00 . A A . 9 LEU HD13 1 1 4 578 1 1 9 LEU HD21 H -1.926 -2.654 -3.806 1.00 . A A . 9 LEU HD21 1 1 4 579 1 1 9 LEU HD22 H -0.229 -2.617 -4.343 1.00 . A A . 9 LEU HD22 1 1 4 580 1 1 9 LEU HD23 H -0.683 -3.540 -2.890 1.00 . A A . 9 LEU HD23 1 1 4 581 1 1 9 LEU HG H -0.828 -0.525 -3.223 1.00 . A A . 9 LEU HG 1 1 4 582 1 1 9 LEU N N -3.664 -0.524 -0.417 1.00 . A A . 9 LEU N 1 1 4 583 1 1 9 LEU O O -4.285 -2.712 -2.163 1.00 . A A . 9 LEU O 1 1 4 584 1 1 10 MET C C -3.936 -2.176 -6.124 1.00 . A A . 10 MET C 1 1 4 585 1 1 10 MET CA C -4.708 -2.033 -4.817 1.00 . A A . 10 MET CA 1 1 4 586 1 1 10 MET CB C -6.062 -1.372 -5.081 1.00 . A A . 10 MET CB 1 1 4 587 1 1 10 MET CE C -9.443 -3.420 -4.352 1.00 . A A . 10 MET CE 1 1 4 588 1 1 10 MET CG C -7.151 -2.353 -5.484 1.00 . A A . 10 MET CG 1 1 4 589 1 1 10 MET H H -3.521 -0.388 -4.135 1.00 . A A . 10 MET H 1 1 4 590 1 1 10 MET HA H -4.882 -3.027 -4.406 1.00 . A A . 10 MET HA 1 1 4 591 1 1 10 MET HB2 H -6.378 -0.861 -4.172 1.00 . A A . 10 MET HB2 1 1 4 592 1 1 10 MET HB3 H -5.943 -0.635 -5.875 1.00 . A A . 10 MET HB3 1 1 4 593 1 1 10 MET HE1 H -9.908 -4.037 -3.583 1.00 . A A . 10 MET HE1 1 1 4 594 1 1 10 MET HE2 H -9.822 -2.400 -4.277 1.00 . A A . 10 MET HE2 1 1 4 595 1 1 10 MET HE3 H -9.682 -3.824 -5.336 1.00 . A A . 10 MET HE3 1 1 4 596 1 1 10 MET HG2 H -8.014 -1.795 -5.844 1.00 . A A . 10 MET HG2 1 1 4 597 1 1 10 MET HG3 H -6.773 -2.980 -6.292 1.00 . A A . 10 MET HG3 1 1 4 598 1 1 10 MET N N -3.946 -1.257 -3.846 1.00 . A A . 10 MET N 1 1 4 599 1 1 10 MET O O -3.588 -1.184 -6.764 1.00 . A A . 10 MET O 1 1 4 600 1 1 10 MET SD S -7.667 -3.415 -4.123 1.00 . A A . 10 MET SD 1 1 5 601 1 1 1 GLY C C 11.223 0.417 5.299 1.00 . A A . 1 GLY C 1 1 5 602 1 1 1 GLY CA C 12.107 1.592 5.668 1.00 . A A . 1 GLY CA 1 1 5 603 1 1 1 GLY H1 H 11.998 3.139 6.971 1.00 . A A . 1 GLY H1 1 1 5 604 1 1 1 GLY H2 H 10.998 3.287 5.668 1.00 . A A . 1 GLY H2 1 1 5 605 1 1 1 GLY H3 H 10.620 2.237 6.883 1.00 . A A . 1 GLY H3 1 1 5 606 1 1 1 GLY HA2 H 12.551 2.001 4.760 1.00 . A A . 1 GLY HA2 1 1 5 607 1 1 1 GLY HA3 H 12.903 1.239 6.324 1.00 . A A . 1 GLY HA3 1 1 5 608 1 1 1 GLY N N 11.375 2.644 6.349 1.00 . A A . 1 GLY N 1 1 5 609 1 1 1 GLY O O 11.189 -0.002 4.143 1.00 . A A . 1 GLY O 1 1 5 610 1 1 2 ASN C C 8.193 -0.786 5.806 1.00 . A A . 2 ASN C 1 1 5 611 1 1 2 ASN CA C 9.623 -1.254 6.056 1.00 . A A . 2 ASN CA 1 1 5 612 1 1 2 ASN CB C 9.659 -2.202 7.256 1.00 . A A . 2 ASN CB 1 1 5 613 1 1 2 ASN CG C 11.052 -2.347 7.837 1.00 . A A . 2 ASN CG 1 1 5 614 1 1 2 ASN H H 10.581 0.273 7.213 1.00 . A A . 2 ASN H 1 1 5 615 1 1 2 ASN HA H 9.971 -1.794 5.176 1.00 . A A . 2 ASN HA 1 1 5 616 1 1 2 ASN HB2 H 8.996 -1.814 8.029 1.00 . A A . 2 ASN HB2 1 1 5 617 1 1 2 ASN HB3 H 9.301 -3.183 6.943 1.00 . A A . 2 ASN HB3 1 1 5 618 1 1 2 ASN HD21 H 10.331 -2.087 9.717 1.00 . A A . 2 ASN HD21 1 1 5 619 1 1 2 ASN HD22 H 12.058 -2.338 9.601 1.00 . A A . 2 ASN HD22 1 1 5 620 1 1 2 ASN N N 10.509 -0.118 6.284 1.00 . A A . 2 ASN N 1 1 5 621 1 1 2 ASN ND2 N 11.155 -2.250 9.157 1.00 . A A . 2 ASN ND2 1 1 5 622 1 1 2 ASN O O 7.352 -0.817 6.705 1.00 . A A . 2 ASN O 1 1 5 623 1 1 2 ASN OD1 O 12.024 -2.545 7.107 1.00 . A A . 2 ASN OD1 1 1 5 624 1 1 3 HIS C C 6.144 -0.501 2.888 1.00 . A A . 3 HIS C 1 1 5 625 1 1 3 HIS CA C 6.594 0.119 4.208 1.00 . A A . 3 HIS CA 1 1 5 626 1 1 3 HIS CB C 6.583 1.642 4.101 1.00 . A A . 3 HIS CB 1 1 5 627 1 1 3 HIS CD2 C 7.009 2.081 6.625 1.00 . A A . 3 HIS CD2 1 1 5 628 1 1 3 HIS CE1 C 8.341 3.805 6.410 1.00 . A A . 3 HIS CE1 1 1 5 629 1 1 3 HIS CG C 7.168 2.342 5.297 1.00 . A A . 3 HIS CG 1 1 5 630 1 1 3 HIS H H 8.658 -0.351 3.884 1.00 . A A . 3 HIS H 1 1 5 631 1 1 3 HIS HA H 5.891 -0.178 4.987 1.00 . A A . 3 HIS HA 1 1 5 632 1 1 3 HIS HB2 H 7.159 1.928 3.220 1.00 . A A . 3 HIS HB2 1 1 5 633 1 1 3 HIS HB3 H 5.554 1.976 3.969 1.00 . A A . 3 HIS HB3 1 1 5 634 1 1 3 HIS HD2 H 6.411 1.292 7.057 1.00 . A A . 3 HIS HD2 1 1 5 635 1 1 3 HIS HE1 H 8.992 4.633 6.647 1.00 . A A . 3 HIS HE1 1 1 5 636 1 1 3 HIS HE2 H 7.850 3.090 8.318 1.00 . A A . 3 HIS HE2 1 1 5 637 1 1 3 HIS N N 7.924 -0.353 4.578 1.00 . A A . 3 HIS N 1 1 5 638 1 1 3 HIS ND1 N 8.011 3.434 5.181 1.00 . A A . 3 HIS ND1 1 1 5 639 1 1 3 HIS NE2 N 7.759 3.017 7.315 1.00 . A A . 3 HIS NE2 1 1 5 640 1 1 3 HIS O O 6.035 0.187 1.874 1.00 . A A . 3 HIS O 1 1 5 641 1 1 4 TRP C C 3.993 -2.197 1.392 1.00 . A A . 4 TRP C 1 1 5 642 1 1 4 TRP CA C 5.449 -2.516 1.715 1.00 . A A . 4 TRP CA 1 1 5 643 1 1 4 TRP CB C 5.625 -4.024 1.901 1.00 . A A . 4 TRP CB 1 1 5 644 1 1 4 TRP CD1 C 7.790 -5.350 1.556 1.00 . A A . 4 TRP CD1 1 1 5 645 1 1 4 TRP CD2 C 6.950 -4.455 -0.317 1.00 . A A . 4 TRP CD2 1 1 5 646 1 1 4 TRP CE2 C 8.130 -5.153 -0.641 1.00 . A A . 4 TRP CE2 1 1 5 647 1 1 4 TRP CE3 C 6.246 -3.810 -1.338 1.00 . A A . 4 TRP CE3 1 1 5 648 1 1 4 TRP CG C 6.750 -4.595 1.094 1.00 . A A . 4 TRP CG 1 1 5 649 1 1 4 TRP CH2 C 7.911 -4.580 -2.923 1.00 . A A . 4 TRP CH2 1 1 5 650 1 1 4 TRP CZ2 C 8.620 -5.220 -1.944 1.00 . A A . 4 TRP CZ2 1 1 5 651 1 1 4 TRP CZ3 C 6.734 -3.879 -2.629 1.00 . A A . 4 TRP CZ3 1 1 5 652 1 1 4 TRP H H 5.995 -2.313 3.776 1.00 . A A . 4 TRP H 1 1 5 653 1 1 4 TRP HA H 6.068 -2.196 0.877 1.00 . A A . 4 TRP HA 1 1 5 654 1 1 4 TRP HB2 H 5.821 -4.221 2.955 1.00 . A A . 4 TRP HB2 1 1 5 655 1 1 4 TRP HB3 H 4.699 -4.523 1.616 1.00 . A A . 4 TRP HB3 1 1 5 656 1 1 4 TRP HD1 H 7.936 -5.639 2.587 1.00 . A A . 4 TRP HD1 1 1 5 657 1 1 4 TRP HE1 H 9.465 -6.243 0.598 1.00 . A A . 4 TRP HE1 1 1 5 658 1 1 4 TRP HE3 H 5.338 -3.268 -1.122 1.00 . A A . 4 TRP HE3 1 1 5 659 1 1 4 TRP HH2 H 8.265 -4.616 -3.942 1.00 . A A . 4 TRP HH2 1 1 5 660 1 1 4 TRP HZ2 H 9.528 -5.758 -2.172 1.00 . A A . 4 TRP HZ2 1 1 5 661 1 1 4 TRP HZ3 H 6.199 -3.384 -3.426 1.00 . A A . 4 TRP HZ3 1 1 5 662 1 1 4 TRP N N 5.886 -1.804 2.910 1.00 . A A . 4 TRP N 1 1 5 663 1 1 4 TRP NE1 N 8.625 -5.689 0.519 1.00 . A A . 4 TRP NE1 1 1 5 664 1 1 4 TRP O O 3.698 -1.538 0.396 1.00 . A A . 4 TRP O 1 1 5 665 1 1 5 ALA C C 0.969 -2.142 3.376 1.00 . A A . 5 ALA C 1 1 5 666 1 1 5 ALA CA C 1.663 -2.430 2.050 1.00 . A A . 5 ALA CA 1 1 5 667 1 1 5 ALA CB C 1.016 -3.624 1.363 1.00 . A A . 5 ALA CB 1 1 5 668 1 1 5 ALA H H 3.393 -3.204 3.042 1.00 . A A . 5 ALA H 1 1 5 669 1 1 5 ALA HA H 1.545 -1.559 1.405 1.00 . A A . 5 ALA HA 1 1 5 670 1 1 5 ALA HB1 H 1.538 -4.536 1.652 1.00 . A A . 5 ALA HB1 1 1 5 671 1 1 5 ALA HB2 H -0.029 -3.694 1.663 1.00 . A A . 5 ALA HB2 1 1 5 672 1 1 5 ALA HB3 H 1.076 -3.498 0.282 1.00 . A A . 5 ALA HB3 1 1 5 673 1 1 5 ALA N N 3.086 -2.668 2.242 1.00 . A A . 5 ALA N 1 1 5 674 1 1 5 ALA O O 0.535 -3.058 4.074 1.00 . A A . 5 ALA O 1 1 5 675 1 1 6 VAL C C -1.180 -1.034 5.074 1.00 . A A . 6 VAL C 1 1 5 676 1 1 6 VAL CA C 0.223 -0.451 4.963 1.00 . A A . 6 VAL CA 1 1 5 677 1 1 6 VAL CB C 0.143 1.081 5.072 1.00 . A A . 6 VAL CB 1 1 5 678 1 1 6 VAL CG1 C -0.574 1.668 3.866 1.00 . A A . 6 VAL CG1 1 1 5 679 1 1 6 VAL CG2 C -0.553 1.486 6.364 1.00 . A A . 6 VAL CG2 1 1 5 680 1 1 6 VAL H H 1.241 -0.155 3.102 1.00 . A A . 6 VAL H 1 1 5 681 1 1 6 VAL HA H 0.818 -0.824 5.797 1.00 . A A . 6 VAL HA 1 1 5 682 1 1 6 VAL HB H 1.158 1.476 5.092 1.00 . A A . 6 VAL HB 1 1 5 683 1 1 6 VAL HG11 H -0.059 1.365 2.954 1.00 . A A . 6 VAL HG11 1 1 5 684 1 1 6 VAL HG12 H -0.575 2.756 3.938 1.00 . A A . 6 VAL HG12 1 1 5 685 1 1 6 VAL HG13 H -1.601 1.304 3.841 1.00 . A A . 6 VAL HG13 1 1 5 686 1 1 6 VAL HG21 H -0.602 2.573 6.426 1.00 . A A . 6 VAL HG21 1 1 5 687 1 1 6 VAL HG22 H -1.563 1.076 6.376 1.00 . A A . 6 VAL HG22 1 1 5 688 1 1 6 VAL HG23 H 0.007 1.099 7.215 1.00 . A A . 6 VAL HG23 1 1 5 689 1 1 6 VAL N N 0.865 -0.861 3.719 1.00 . A A . 6 VAL N 1 1 5 690 1 1 6 VAL O O -1.655 -1.332 6.169 1.00 . A A . 6 VAL O 1 1 5 691 1 1 7 GLY C C -4.021 -1.204 2.775 1.00 . A A . 7 GLY C 1 1 5 692 1 1 7 GLY CA C -3.186 -1.740 3.921 1.00 . A A . 7 GLY CA 1 1 5 693 1 1 7 GLY H H -1.404 -0.930 3.060 1.00 . A A . 7 GLY H 1 1 5 694 1 1 7 GLY HA2 H -3.121 -2.824 3.829 1.00 . A A . 7 GLY HA2 1 1 5 695 1 1 7 GLY HA3 H -3.676 -1.493 4.863 1.00 . A A . 7 GLY HA3 1 1 5 696 1 1 7 GLY N N -1.842 -1.193 3.931 1.00 . A A . 7 GLY N 1 1 5 697 1 1 7 GLY O O -5.031 -1.801 2.400 1.00 . A A . 7 GLY O 1 1 5 698 1 1 8 HIS C C -3.362 0.912 -0.021 1.00 . A A . 8 HIS C 1 1 5 699 1 1 8 HIS CA C -4.320 0.545 1.109 1.00 . A A . 8 HIS CA 1 1 5 700 1 1 8 HIS CB C -5.063 1.794 1.587 1.00 . A A . 8 HIS CB 1 1 5 701 1 1 8 HIS CD2 C -5.615 3.701 -0.089 1.00 . A A . 8 HIS CD2 1 1 5 702 1 1 8 HIS CE1 C -7.378 2.790 -1.010 1.00 . A A . 8 HIS CE1 1 1 5 703 1 1 8 HIS CG C -5.832 2.488 0.495 1.00 . A A . 8 HIS CG 1 1 5 704 1 1 8 HIS H H -2.766 0.371 2.572 1.00 . A A . 8 HIS H 1 1 5 705 1 1 8 HIS HA H -5.050 -0.169 0.728 1.00 . A A . 8 HIS HA 1 1 5 706 1 1 8 HIS HB2 H -5.764 1.501 2.369 1.00 . A A . 8 HIS HB2 1 1 5 707 1 1 8 HIS HB3 H -4.341 2.494 2.007 1.00 . A A . 8 HIS HB3 1 1 5 708 1 1 8 HIS HD2 H -4.821 4.395 0.147 1.00 . A A . 8 HIS HD2 1 1 5 709 1 1 8 HIS HE1 H -8.239 2.635 -1.644 1.00 . A A . 8 HIS HE1 1 1 5 710 1 1 8 HIS HE2 H -6.719 4.676 -1.645 1.00 . A A . 8 HIS HE2 1 1 5 711 1 1 8 HIS N N -3.602 -0.072 2.219 1.00 . A A . 8 HIS N 1 1 5 712 1 1 8 HIS ND1 N -6.949 1.927 -0.100 1.00 . A A . 8 HIS ND1 1 1 5 713 1 1 8 HIS NE2 N -6.604 3.875 -1.040 1.00 . A A . 8 HIS NE2 1 1 5 714 1 1 8 HIS O O -2.978 2.072 -0.170 1.00 . A A . 8 HIS O 1 1 5 715 1 1 9 LEU C C -2.789 -0.033 -3.264 1.00 . A A . 9 LEU C 1 1 5 716 1 1 9 LEU CA C -2.068 0.134 -1.929 1.00 . A A . 9 LEU CA 1 1 5 717 1 1 9 LEU CB C -0.892 -0.840 -1.848 1.00 . A A . 9 LEU CB 1 1 5 718 1 1 9 LEU CD1 C -0.047 -3.082 -2.585 1.00 . A A . 9 LEU CD1 1 1 5 719 1 1 9 LEU CD2 C -1.660 -2.920 -0.680 1.00 . A A . 9 LEU CD2 1 1 5 720 1 1 9 LEU CG C -1.233 -2.321 -2.013 1.00 . A A . 9 LEU CG 1 1 5 721 1 1 9 LEU H H -3.335 -1.014 -0.640 1.00 . A A . 9 LEU H 1 1 5 722 1 1 9 LEU HA H -1.682 1.151 -1.868 1.00 . A A . 9 LEU HA 1 1 5 723 1 1 9 LEU HB2 H -0.183 -0.572 -2.632 1.00 . A A . 9 LEU HB2 1 1 5 724 1 1 9 LEU HB3 H -0.402 -0.706 -0.883 1.00 . A A . 9 LEU HB3 1 1 5 725 1 1 9 LEU HD11 H 0.245 -2.640 -3.537 1.00 . A A . 9 LEU HD11 1 1 5 726 1 1 9 LEU HD12 H -0.325 -4.125 -2.739 1.00 . A A . 9 LEU HD12 1 1 5 727 1 1 9 LEU HD13 H 0.790 -3.028 -1.888 1.00 . A A . 9 LEU HD13 1 1 5 728 1 1 9 LEU HD21 H -2.747 -3.002 -0.650 1.00 . A A . 9 LEU HD21 1 1 5 729 1 1 9 LEU HD22 H -1.218 -3.909 -0.568 1.00 . A A . 9 LEU HD22 1 1 5 730 1 1 9 LEU HD23 H -1.322 -2.277 0.132 1.00 . A A . 9 LEU HD23 1 1 5 731 1 1 9 LEU HG H -2.065 -2.406 -2.711 1.00 . A A . 9 LEU HG 1 1 5 732 1 1 9 LEU N N -2.982 -0.084 -0.814 1.00 . A A . 9 LEU N 1 1 5 733 1 1 9 LEU O O -2.389 0.547 -4.273 1.00 . A A . 9 LEU O 1 1 5 734 1 1 10 MET C C -5.881 -0.191 -4.494 1.00 . A A . 10 MET C 1 1 5 735 1 1 10 MET CA C -4.633 -1.067 -4.469 1.00 . A A . 10 MET CA 1 1 5 736 1 1 10 MET CB C -5.030 -2.542 -4.562 1.00 . A A . 10 MET CB 1 1 5 737 1 1 10 MET CE C -4.058 -4.762 -7.174 1.00 . A A . 10 MET CE 1 1 5 738 1 1 10 MET CG C -5.674 -2.916 -5.887 1.00 . A A . 10 MET CG 1 1 5 739 1 1 10 MET H H -4.132 -1.277 -2.397 1.00 . A A . 10 MET H 1 1 5 740 1 1 10 MET HA H -4.017 -0.819 -5.333 1.00 . A A . 10 MET HA 1 1 5 741 1 1 10 MET HB2 H -4.134 -3.149 -4.431 1.00 . A A . 10 MET HB2 1 1 5 742 1 1 10 MET HB3 H -5.728 -2.769 -3.756 1.00 . A A . 10 MET HB3 1 1 5 743 1 1 10 MET HE1 H -3.861 -5.794 -7.461 1.00 . A A . 10 MET HE1 1 1 5 744 1 1 10 MET HE2 H -4.153 -4.147 -8.069 1.00 . A A . 10 MET HE2 1 1 5 745 1 1 10 MET HE3 H -3.233 -4.391 -6.565 1.00 . A A . 10 MET HE3 1 1 5 746 1 1 10 MET HG2 H -6.723 -2.622 -5.861 1.00 . A A . 10 MET HG2 1 1 5 747 1 1 10 MET HG3 H -5.174 -2.372 -6.689 1.00 . A A . 10 MET HG3 1 1 5 748 1 1 10 MET N N -3.855 -0.828 -3.259 1.00 . A A . 10 MET N 1 1 5 749 1 1 10 MET O O -6.553 -0.078 -5.520 1.00 . A A . 10 MET O 1 1 5 750 1 1 10 MET SD S -5.578 -4.682 -6.232 1.00 . A A . 10 MET SD 1 1 6 751 1 1 1 GLY C C 9.440 -2.012 5.632 1.00 . A A . 1 GLY C 1 1 6 752 1 1 1 GLY CA C 9.598 -3.517 5.717 1.00 . A A . 1 GLY CA 1 1 6 753 1 1 1 GLY H1 H 8.656 -5.149 6.465 1.00 . A A . 1 GLY H1 1 1 6 754 1 1 1 GLY H2 H 8.468 -3.788 7.378 1.00 . A A . 1 GLY H2 1 1 6 755 1 1 1 GLY H3 H 7.634 -3.955 5.965 1.00 . A A . 1 GLY H3 1 1 6 756 1 1 1 GLY HA2 H 10.532 -3.743 6.231 1.00 . A A . 1 GLY HA2 1 1 6 757 1 1 1 GLY HA3 H 9.641 -3.926 4.707 1.00 . A A . 1 GLY HA3 1 1 6 758 1 1 1 GLY N N 8.506 -4.151 6.436 1.00 . A A . 1 GLY N 1 1 6 759 1 1 1 GLY O O 8.996 -1.372 6.584 1.00 . A A . 1 GLY O 1 1 6 760 1 1 2 ASN C C 8.429 0.349 3.523 1.00 . A A . 2 ASN C 1 1 6 761 1 1 2 ASN CA C 9.704 -0.004 4.282 1.00 . A A . 2 ASN CA 1 1 6 762 1 1 2 ASN CB C 10.925 0.509 3.516 1.00 . A A . 2 ASN CB 1 1 6 763 1 1 2 ASN CG C 12.164 0.586 4.387 1.00 . A A . 2 ASN CG 1 1 6 764 1 1 2 ASN H H 10.163 -2.025 3.741 1.00 . A A . 2 ASN H 1 1 6 765 1 1 2 ASN HA H 9.676 0.484 5.256 1.00 . A A . 2 ASN HA 1 1 6 766 1 1 2 ASN HB2 H 11.125 -0.166 2.683 1.00 . A A . 2 ASN HB2 1 1 6 767 1 1 2 ASN HB3 H 10.706 1.501 3.123 1.00 . A A . 2 ASN HB3 1 1 6 768 1 1 2 ASN HD21 H 12.810 -1.208 3.684 1.00 . A A . 2 ASN HD21 1 1 6 769 1 1 2 ASN HD22 H 13.852 -0.440 4.861 1.00 . A A . 2 ASN HD22 1 1 6 770 1 1 2 ASN N N 9.806 -1.445 4.487 1.00 . A A . 2 ASN N 1 1 6 771 1 1 2 ASN ND2 N 13.010 -0.436 4.304 1.00 . A A . 2 ASN ND2 1 1 6 772 1 1 2 ASN O O 8.449 0.537 2.306 1.00 . A A . 2 ASN O 1 1 6 773 1 1 2 ASN OD1 O 12.358 1.551 5.125 1.00 . A A . 2 ASN OD1 1 1 6 774 1 1 3 HIS C C 5.677 -0.227 2.546 1.00 . A A . 3 HIS C 1 1 6 775 1 1 3 HIS CA C 6.034 0.769 3.646 1.00 . A A . 3 HIS CA 1 1 6 776 1 1 3 HIS CB C 6.068 2.188 3.077 1.00 . A A . 3 HIS CB 1 1 6 777 1 1 3 HIS CD2 C 7.230 4.018 4.505 1.00 . A A . 3 HIS CD2 1 1 6 778 1 1 3 HIS CE1 C 5.507 4.576 5.737 1.00 . A A . 3 HIS CE1 1 1 6 779 1 1 3 HIS CG C 6.165 3.255 4.132 1.00 . A A . 3 HIS CG 1 1 6 780 1 1 3 HIS H H 7.369 0.270 5.245 1.00 . A A . 3 HIS H 1 1 6 781 1 1 3 HIS HA H 5.266 0.723 4.418 1.00 . A A . 3 HIS HA 1 1 6 782 1 1 3 HIS HB2 H 6.932 2.274 2.418 1.00 . A A . 3 HIS HB2 1 1 6 783 1 1 3 HIS HB3 H 5.163 2.353 2.492 1.00 . A A . 3 HIS HB3 1 1 6 784 1 1 3 HIS HD2 H 8.225 3.980 4.085 1.00 . A A . 3 HIS HD2 1 1 6 785 1 1 3 HIS HE1 H 4.891 5.068 6.475 1.00 . A A . 3 HIS HE1 1 1 6 786 1 1 3 HIS HE2 H 7.354 5.536 6.012 1.00 . A A . 3 HIS HE2 1 1 6 787 1 1 3 HIS N N 7.320 0.437 4.250 1.00 . A A . 3 HIS N 1 1 6 788 1 1 3 HIS ND1 N 5.087 3.621 4.921 1.00 . A A . 3 HIS ND1 1 1 6 789 1 1 3 HIS NE2 N 6.798 4.850 5.522 1.00 . A A . 3 HIS NE2 1 1 6 790 1 1 3 HIS O O 5.125 0.149 1.512 1.00 . A A . 3 HIS O 1 1 6 791 1 1 4 TRP C C 4.212 -2.660 1.553 1.00 . A A . 4 TRP C 1 1 6 792 1 1 4 TRP CA C 5.710 -2.543 1.804 1.00 . A A . 4 TRP CA 1 1 6 793 1 1 4 TRP CB C 6.265 -3.885 2.291 1.00 . A A . 4 TRP CB 1 1 6 794 1 1 4 TRP CD1 C 8.570 -4.920 1.861 1.00 . A A . 4 TRP CD1 1 1 6 795 1 1 4 TRP CD2 C 7.393 -4.489 0.004 1.00 . A A . 4 TRP CD2 1 1 6 796 1 1 4 TRP CE2 C 8.630 -5.052 -0.368 1.00 . A A . 4 TRP CE2 1 1 6 797 1 1 4 TRP CE3 C 6.485 -4.137 -0.997 1.00 . A A . 4 TRP CE3 1 1 6 798 1 1 4 TRP CG C 7.375 -4.414 1.434 1.00 . A A . 4 TRP CG 1 1 6 799 1 1 4 TRP CH2 C 8.071 -4.914 -2.658 1.00 . A A . 4 TRP CH2 1 1 6 800 1 1 4 TRP CZ2 C 8.980 -5.268 -1.697 1.00 . A A . 4 TRP CZ2 1 1 6 801 1 1 4 TRP CZ3 C 6.833 -4.353 -2.317 1.00 . A A . 4 TRP CZ3 1 1 6 802 1 1 4 TRP H H 6.450 -1.739 3.645 1.00 . A A . 4 TRP H 1 1 6 803 1 1 4 TRP HA H 6.200 -2.287 0.864 1.00 . A A . 4 TRP HA 1 1 6 804 1 1 4 TRP HB2 H 6.643 -3.755 3.305 1.00 . A A . 4 TRP HB2 1 1 6 805 1 1 4 TRP HB3 H 5.455 -4.614 2.308 1.00 . A A . 4 TRP HB3 1 1 6 806 1 1 4 TRP HD1 H 8.872 -5.005 2.894 1.00 . A A . 4 TRP HD1 1 1 6 807 1 1 4 TRP HE1 H 10.255 -5.709 0.832 1.00 . A A . 4 TRP HE1 1 1 6 808 1 1 4 TRP HE3 H 5.528 -3.705 -0.745 1.00 . A A . 4 TRP HE3 1 1 6 809 1 1 4 TRP HH2 H 8.313 -5.070 -3.699 1.00 . A A . 4 TRP HH2 1 1 6 810 1 1 4 TRP HZ2 H 9.934 -5.699 -1.962 1.00 . A A . 4 TRP HZ2 1 1 6 811 1 1 4 TRP HZ3 H 6.139 -4.084 -3.099 1.00 . A A . 4 TRP HZ3 1 1 6 812 1 1 4 TRP N N 5.997 -1.495 2.776 1.00 . A A . 4 TRP N 1 1 6 813 1 1 4 TRP NE1 N 9.330 -5.305 0.783 1.00 . A A . 4 TRP NE1 1 1 6 814 1 1 4 TRP O O 3.741 -2.447 0.437 1.00 . A A . 4 TRP O 1 1 6 815 1 1 5 ALA C C 1.337 -2.816 3.819 1.00 . A A . 5 ALA C 1 1 6 816 1 1 5 ALA CA C 2.019 -3.141 2.494 1.00 . A A . 5 ALA CA 1 1 6 817 1 1 5 ALA CB C 1.660 -4.550 2.046 1.00 . A A . 5 ALA CB 1 1 6 818 1 1 5 ALA H H 3.913 -3.163 3.491 1.00 . A A . 5 ALA H 1 1 6 819 1 1 5 ALA HA H 1.659 -2.440 1.741 1.00 . A A . 5 ALA HA 1 1 6 820 1 1 5 ALA HB1 H 0.577 -4.643 1.971 1.00 . A A . 5 ALA HB1 1 1 6 821 1 1 5 ALA HB2 H 2.110 -4.747 1.073 1.00 . A A . 5 ALA HB2 1 1 6 822 1 1 5 ALA HB3 H 2.037 -5.270 2.772 1.00 . A A . 5 ALA HB3 1 1 6 823 1 1 5 ALA N N 3.466 -2.999 2.600 1.00 . A A . 5 ALA N 1 1 6 824 1 1 5 ALA O O 1.384 -3.603 4.762 1.00 . A A . 5 ALA O 1 1 6 825 1 1 6 VAL C C -1.487 -1.467 4.981 1.00 . A A . 6 VAL C 1 1 6 826 1 1 6 VAL CA C 0.011 -1.217 5.090 1.00 . A A . 6 VAL CA 1 1 6 827 1 1 6 VAL CB C 0.254 0.276 5.373 1.00 . A A . 6 VAL CB 1 1 6 828 1 1 6 VAL CG1 C -0.405 1.137 4.305 1.00 . A A . 6 VAL CG1 1 1 6 829 1 1 6 VAL CG2 C -0.258 0.646 6.757 1.00 . A A . 6 VAL CG2 1 1 6 830 1 1 6 VAL H H 0.705 -1.044 3.072 1.00 . A A . 6 VAL H 1 1 6 831 1 1 6 VAL HA H 0.395 -1.793 5.931 1.00 . A A . 6 VAL HA 1 1 6 832 1 1 6 VAL HB H 1.328 0.459 5.346 1.00 . A A . 6 VAL HB 1 1 6 833 1 1 6 VAL HG11 H 0.030 2.136 4.323 1.00 . A A . 6 VAL HG11 1 1 6 834 1 1 6 VAL HG12 H -0.243 0.688 3.325 1.00 . A A . 6 VAL HG12 1 1 6 835 1 1 6 VAL HG13 H -1.475 1.203 4.501 1.00 . A A . 6 VAL HG13 1 1 6 836 1 1 6 VAL HG21 H 0.227 0.018 7.504 1.00 . A A . 6 VAL HG21 1 1 6 837 1 1 6 VAL HG22 H -0.032 1.693 6.961 1.00 . A A . 6 VAL HG22 1 1 6 838 1 1 6 VAL HG23 H -1.337 0.493 6.798 1.00 . A A . 6 VAL HG23 1 1 6 839 1 1 6 VAL N N 0.705 -1.648 3.882 1.00 . A A . 6 VAL N 1 1 6 840 1 1 6 VAL O O -2.166 -1.687 5.986 1.00 . A A . 6 VAL O 1 1 6 841 1 1 7 GLY C C -4.015 -0.678 2.544 1.00 . A A . 7 GLY C 1 1 6 842 1 1 7 GLY CA C -3.419 -1.656 3.539 1.00 . A A . 7 GLY CA 1 1 6 843 1 1 7 GLY H H -1.400 -1.245 2.968 1.00 . A A . 7 GLY H 1 1 6 844 1 1 7 GLY HA2 H -3.564 -2.670 3.169 1.00 . A A . 7 GLY HA2 1 1 6 845 1 1 7 GLY HA3 H -3.940 -1.548 4.490 1.00 . A A . 7 GLY HA3 1 1 6 846 1 1 7 GLY N N -2.002 -1.431 3.757 1.00 . A A . 7 GLY N 1 1 6 847 1 1 7 GLY O O -5.077 -0.932 1.976 1.00 . A A . 7 GLY O 1 1 6 848 1 1 8 HIS C C -3.151 1.281 0.032 1.00 . A A . 8 HIS C 1 1 6 849 1 1 8 HIS CA C -3.800 1.460 1.402 1.00 . A A . 8 HIS CA 1 1 6 850 1 1 8 HIS CB C -3.498 2.856 1.944 1.00 . A A . 8 HIS CB 1 1 6 851 1 1 8 HIS CD2 C -5.726 3.195 3.236 1.00 . A A . 8 HIS CD2 1 1 6 852 1 1 8 HIS CE1 C -4.882 4.042 5.071 1.00 . A A . 8 HIS CE1 1 1 6 853 1 1 8 HIS CG C -4.372 3.262 3.101 1.00 . A A . 8 HIS CG 1 1 6 854 1 1 8 HIS H H -2.466 0.590 2.834 1.00 . A A . 8 HIS H 1 1 6 855 1 1 8 HIS HA H -4.879 1.357 1.290 1.00 . A A . 8 HIS HA 1 1 6 856 1 1 8 HIS HB2 H -2.460 2.879 2.274 1.00 . A A . 8 HIS HB2 1 1 6 857 1 1 8 HIS HB3 H -3.626 3.579 1.139 1.00 . A A . 8 HIS HB3 1 1 6 858 1 1 8 HIS HD2 H -6.427 2.824 2.503 1.00 . A A . 8 HIS HD2 1 1 6 859 1 1 8 HIS HE1 H -4.798 4.465 6.061 1.00 . A A . 8 HIS HE1 1 1 6 860 1 1 8 HIS HE2 H -6.956 3.777 4.892 1.00 . A A . 8 HIS HE2 1 1 6 861 1 1 8 HIS N N -3.331 0.441 2.335 1.00 . A A . 8 HIS N 1 1 6 862 1 1 8 HIS ND1 N -3.855 3.798 4.268 1.00 . A A . 8 HIS ND1 1 1 6 863 1 1 8 HIS NE2 N -6.033 3.693 4.490 1.00 . A A . 8 HIS NE2 1 1 6 864 1 1 8 HIS O O -2.652 2.240 -0.559 1.00 . A A . 8 HIS O 1 1 6 865 1 1 9 LEU C C -3.587 -0.949 -2.673 1.00 . A A . 9 LEU C 1 1 6 866 1 1 9 LEU CA C -2.574 -0.252 -1.767 1.00 . A A . 9 LEU CA 1 1 6 867 1 1 9 LEU CB C -1.336 -1.134 -1.595 1.00 . A A . 9 LEU CB 1 1 6 868 1 1 9 LEU CD1 C 0.312 0.509 -2.526 1.00 . A A . 9 LEU CD1 1 1 6 869 1 1 9 LEU CD2 C -0.084 0.402 -0.059 1.00 . A A . 9 LEU CD2 1 1 6 870 1 1 9 LEU CG C -0.018 -0.399 -1.352 1.00 . A A . 9 LEU CG 1 1 6 871 1 1 9 LEU H H -3.586 -0.693 0.067 1.00 . A A . 9 LEU H 1 1 6 872 1 1 9 LEU HA H -2.272 0.683 -2.238 1.00 . A A . 9 LEU HA 1 1 6 873 1 1 9 LEU HB2 H -1.512 -1.794 -0.745 1.00 . A A . 9 LEU HB2 1 1 6 874 1 1 9 LEU HB3 H -1.226 -1.748 -2.489 1.00 . A A . 9 LEU HB3 1 1 6 875 1 1 9 LEU HD11 H 0.355 -0.081 -3.442 1.00 . A A . 9 LEU HD11 1 1 6 876 1 1 9 LEU HD12 H -0.461 1.273 -2.623 1.00 . A A . 9 LEU HD12 1 1 6 877 1 1 9 LEU HD13 H 1.276 0.988 -2.356 1.00 . A A . 9 LEU HD13 1 1 6 878 1 1 9 LEU HD21 H 0.900 0.420 0.409 1.00 . A A . 9 LEU HD21 1 1 6 879 1 1 9 LEU HD22 H -0.401 1.421 -0.279 1.00 . A A . 9 LEU HD22 1 1 6 880 1 1 9 LEU HD23 H -0.800 -0.063 0.619 1.00 . A A . 9 LEU HD23 1 1 6 881 1 1 9 LEU HG H 0.777 -1.139 -1.257 1.00 . A A . 9 LEU HG 1 1 6 882 1 1 9 LEU N N -3.161 0.051 -0.467 1.00 . A A . 9 LEU N 1 1 6 883 1 1 9 LEU O O -4.593 -1.478 -2.202 1.00 . A A . 9 LEU O 1 1 6 884 1 1 10 MET C C -3.574 -2.861 -5.487 1.00 . A A . 10 MET C 1 1 6 885 1 1 10 MET CA C -4.195 -1.579 -4.943 1.00 . A A . 10 MET CA 1 1 6 886 1 1 10 MET CB C -4.498 -0.616 -6.092 1.00 . A A . 10 MET CB 1 1 6 887 1 1 10 MET CE C -8.126 -0.304 -7.477 1.00 . A A . 10 MET CE 1 1 6 888 1 1 10 MET CG C -5.517 -1.155 -7.083 1.00 . A A . 10 MET CG 1 1 6 889 1 1 10 MET H H -2.468 -0.490 -4.295 1.00 . A A . 10 MET H 1 1 6 890 1 1 10 MET HA H -5.132 -1.831 -4.446 1.00 . A A . 10 MET HA 1 1 6 891 1 1 10 MET HB2 H -4.874 0.319 -5.677 1.00 . A A . 10 MET HB2 1 1 6 892 1 1 10 MET HB3 H -3.570 -0.415 -6.627 1.00 . A A . 10 MET HB3 1 1 6 893 1 1 10 MET HE1 H -8.821 0.413 -7.914 1.00 . A A . 10 MET HE1 1 1 6 894 1 1 10 MET HE2 H -8.341 -1.300 -7.864 1.00 . A A . 10 MET HE2 1 1 6 895 1 1 10 MET HE3 H -8.237 -0.304 -6.393 1.00 . A A . 10 MET HE3 1 1 6 896 1 1 10 MET HG2 H -4.998 -1.747 -7.837 1.00 . A A . 10 MET HG2 1 1 6 897 1 1 10 MET HG3 H -6.217 -1.798 -6.549 1.00 . A A . 10 MET HG3 1 1 6 898 1 1 10 MET N N -3.311 -0.944 -3.972 1.00 . A A . 10 MET N 1 1 6 899 1 1 10 MET O O -4.284 -3.782 -5.895 1.00 . A A . 10 MET O 1 1 6 900 1 1 10 MET SD S -6.447 0.153 -7.905 1.00 . A A . 10 MET SD 1 1 7 901 1 1 1 GLY C C 11.173 -1.540 2.885 1.00 . A A . 1 GLY C 1 1 7 902 1 1 1 GLY CA C 11.868 -0.660 1.865 1.00 . A A . 1 GLY CA 1 1 7 903 1 1 1 GLY H1 H 11.551 1.016 0.770 1.00 . A A . 1 GLY H1 1 1 7 904 1 1 1 GLY H2 H 10.193 0.117 1.031 1.00 . A A . 1 GLY H2 1 1 7 905 1 1 1 GLY H3 H 10.822 1.032 2.250 1.00 . A A . 1 GLY H3 1 1 7 906 1 1 1 GLY HA2 H 12.118 -1.261 0.991 1.00 . A A . 1 GLY HA2 1 1 7 907 1 1 1 GLY HA3 H 12.787 -0.274 2.305 1.00 . A A . 1 GLY HA3 1 1 7 908 1 1 1 GLY N N 11.046 0.462 1.447 1.00 . A A . 1 GLY N 1 1 7 909 1 1 1 GLY O O 10.920 -2.716 2.630 1.00 . A A . 1 GLY O 1 1 7 910 1 1 2 ASN C C 8.680 -1.660 4.937 1.00 . A A . 2 ASN C 1 1 7 911 1 1 2 ASN CA C 10.196 -1.709 5.109 1.00 . A A . 2 ASN CA 1 1 7 912 1 1 2 ASN CB C 10.585 -1.143 6.475 1.00 . A A . 2 ASN CB 1 1 7 913 1 1 2 ASN CG C 12.087 -1.087 6.673 1.00 . A A . 2 ASN CG 1 1 7 914 1 1 2 ASN H H 11.097 0.004 4.194 1.00 . A A . 2 ASN H 1 1 7 915 1 1 2 ASN HA H 10.518 -2.749 5.061 1.00 . A A . 2 ASN HA 1 1 7 916 1 1 2 ASN HB2 H 10.177 -0.136 6.571 1.00 . A A . 2 ASN HB2 1 1 7 917 1 1 2 ASN HB3 H 10.153 -1.775 7.251 1.00 . A A . 2 ASN HB3 1 1 7 918 1 1 2 ASN HD21 H 11.873 0.254 8.183 1.00 . A A . 2 ASN HD21 1 1 7 919 1 1 2 ASN HD22 H 13.520 -0.202 7.808 1.00 . A A . 2 ASN HD22 1 1 7 920 1 1 2 ASN N N 10.864 -0.967 4.046 1.00 . A A . 2 ASN N 1 1 7 921 1 1 2 ASN ND2 N 12.529 -0.281 7.631 1.00 . A A . 2 ASN ND2 1 1 7 922 1 1 2 ASN O O 8.003 -2.686 5.007 1.00 . A A . 2 ASN O 1 1 7 923 1 1 2 ASN OD1 O 12.842 -1.760 5.971 1.00 . A A . 2 ASN OD1 1 1 7 924 1 1 3 HIS C C 6.280 -0.764 3.153 1.00 . A A . 3 HIS C 1 1 7 925 1 1 3 HIS CA C 6.720 -0.276 4.530 1.00 . A A . 3 HIS CA 1 1 7 926 1 1 3 HIS CB C 6.346 1.195 4.706 1.00 . A A . 3 HIS CB 1 1 7 927 1 1 3 HIS CD2 C 6.497 0.958 7.287 1.00 . A A . 3 HIS CD2 1 1 7 928 1 1 3 HIS CE1 C 6.411 3.087 7.788 1.00 . A A . 3 HIS CE1 1 1 7 929 1 1 3 HIS CG C 6.397 1.671 6.130 1.00 . A A . 3 HIS CG 1 1 7 930 1 1 3 HIS H H 8.766 0.344 4.666 1.00 . A A . 3 HIS H 1 1 7 931 1 1 3 HIS HA H 6.197 -0.859 5.288 1.00 . A A . 3 HIS HA 1 1 7 932 1 1 3 HIS HB2 H 7.039 1.797 4.118 1.00 . A A . 3 HIS HB2 1 1 7 933 1 1 3 HIS HB3 H 5.338 1.347 4.322 1.00 . A A . 3 HIS HB3 1 1 7 934 1 1 3 HIS HD2 H 6.559 -0.117 7.375 1.00 . A A . 3 HIS HD2 1 1 7 935 1 1 3 HIS HE1 H 6.393 4.007 8.353 1.00 . A A . 3 HIS HE1 1 1 7 936 1 1 3 HIS HE2 H 6.569 1.653 9.312 1.00 . A A . 3 HIS HE2 1 1 7 937 1 1 3 HIS N N 8.156 -0.460 4.712 1.00 . A A . 3 HIS N 1 1 7 938 1 1 3 HIS ND1 N 6.345 3.014 6.467 1.00 . A A . 3 HIS ND1 1 1 7 939 1 1 3 HIS NE2 N 6.505 1.869 8.327 1.00 . A A . 3 HIS NE2 1 1 7 940 1 1 3 HIS O O 6.161 0.023 2.213 1.00 . A A . 3 HIS O 1 1 7 941 1 1 4 TRP C C 4.184 -2.264 1.444 1.00 . A A . 4 TRP C 1 1 7 942 1 1 4 TRP CA C 5.619 -2.660 1.777 1.00 . A A . 4 TRP CA 1 1 7 943 1 1 4 TRP CB C 5.738 -4.184 1.840 1.00 . A A . 4 TRP CB 1 1 7 944 1 1 4 TRP CD1 C 7.896 -5.526 1.508 1.00 . A A . 4 TRP CD1 1 1 7 945 1 1 4 TRP CD2 C 7.163 -4.491 -0.338 1.00 . A A . 4 TRP CD2 1 1 7 946 1 1 4 TRP CE2 C 8.346 -5.188 -0.652 1.00 . A A . 4 TRP CE2 1 1 7 947 1 1 4 TRP CE3 C 6.521 -3.765 -1.345 1.00 . A A . 4 TRP CE3 1 1 7 948 1 1 4 TRP CG C 6.893 -4.721 1.050 1.00 . A A . 4 TRP CG 1 1 7 949 1 1 4 TRP CH2 C 8.248 -4.458 -2.897 1.00 . A A . 4 TRP CH2 1 1 7 950 1 1 4 TRP CZ2 C 8.899 -5.178 -1.931 1.00 . A A . 4 TRP CZ2 1 1 7 951 1 1 4 TRP CZ3 C 7.071 -3.756 -2.613 1.00 . A A . 4 TRP CZ3 1 1 7 952 1 1 4 TRP H H 6.163 -2.660 3.847 1.00 . A A . 4 TRP H 1 1 7 953 1 1 4 TRP HA H 6.271 -2.294 0.984 1.00 . A A . 4 TRP HA 1 1 7 954 1 1 4 TRP HB2 H 5.854 -4.485 2.881 1.00 . A A . 4 TRP HB2 1 1 7 955 1 1 4 TRP HB3 H 4.819 -4.619 1.448 1.00 . A A . 4 TRP HB3 1 1 7 956 1 1 4 TRP HD1 H 7.985 -5.886 2.522 1.00 . A A . 4 TRP HD1 1 1 7 957 1 1 4 TRP HE1 H 9.601 -6.384 0.572 1.00 . A A . 4 TRP HE1 1 1 7 958 1 1 4 TRP HE3 H 5.612 -3.221 -1.136 1.00 . A A . 4 TRP HE3 1 1 7 959 1 1 4 TRP HH2 H 8.651 -4.432 -3.898 1.00 . A A . 4 TRP HH2 1 1 7 960 1 1 4 TRP HZ2 H 9.807 -5.718 -2.153 1.00 . A A . 4 TRP HZ2 1 1 7 961 1 1 4 TRP HZ3 H 6.583 -3.198 -3.398 1.00 . A A . 4 TRP HZ3 1 1 7 962 1 1 4 TRP N N 6.044 -2.066 3.039 1.00 . A A . 4 TRP N 1 1 7 963 1 1 4 TRP NE1 N 8.775 -5.810 0.490 1.00 . A A . 4 TRP NE1 1 1 7 964 1 1 4 TRP O O 3.942 -1.502 0.510 1.00 . A A . 4 TRP O 1 1 7 965 1 1 5 ALA C C 1.162 -2.029 3.301 1.00 . A A . 5 ALA C 1 1 7 966 1 1 5 ALA CA C 1.826 -2.483 2.006 1.00 . A A . 5 ALA CA 1 1 7 967 1 1 5 ALA CB C 1.106 -3.698 1.438 1.00 . A A . 5 ALA CB 1 1 7 968 1 1 5 ALA H H 3.500 -3.405 2.970 1.00 . A A . 5 ALA H 1 1 7 969 1 1 5 ALA HA H 1.755 -1.672 1.281 1.00 . A A . 5 ALA HA 1 1 7 970 1 1 5 ALA HB1 H 0.054 -3.458 1.285 1.00 . A A . 5 ALA HB1 1 1 7 971 1 1 5 ALA HB2 H 1.558 -3.975 0.485 1.00 . A A . 5 ALA HB2 1 1 7 972 1 1 5 ALA HB3 H 1.192 -4.530 2.136 1.00 . A A . 5 ALA HB3 1 1 7 973 1 1 5 ALA N N 3.236 -2.785 2.217 1.00 . A A . 5 ALA N 1 1 7 974 1 1 5 ALA O O 0.672 -2.847 4.079 1.00 . A A . 5 ALA O 1 1 7 975 1 1 6 VAL C C -0.893 -0.637 4.896 1.00 . A A . 6 VAL C 1 1 7 976 1 1 6 VAL CA C 0.543 -0.155 4.728 1.00 . A A . 6 VAL CA 1 1 7 977 1 1 6 VAL CB C 0.559 1.383 4.693 1.00 . A A . 6 VAL CB 1 1 7 978 1 1 6 VAL CG1 C -0.130 1.898 3.439 1.00 . A A . 6 VAL CG1 1 1 7 979 1 1 6 VAL CG2 C -0.102 1.949 5.942 1.00 . A A . 6 VAL CG2 1 1 7 980 1 1 6 VAL H H 1.568 -0.099 2.848 1.00 . A A . 6 VAL H 1 1 7 981 1 1 6 VAL HA H 1.120 -0.486 5.591 1.00 . A A . 6 VAL HA 1 1 7 982 1 1 6 VAL HB H 1.597 1.714 4.674 1.00 . A A . 6 VAL HB 1 1 7 983 1 1 6 VAL HG11 H 0.280 2.872 3.172 1.00 . A A . 6 VAL HG11 1 1 7 984 1 1 6 VAL HG12 H 0.036 1.197 2.620 1.00 . A A . 6 VAL HG12 1 1 7 985 1 1 6 VAL HG13 H -1.200 1.992 3.624 1.00 . A A . 6 VAL HG13 1 1 7 986 1 1 6 VAL HG21 H 0.407 1.568 6.828 1.00 . A A . 6 VAL HG21 1 1 7 987 1 1 6 VAL HG22 H -1.149 1.648 5.967 1.00 . A A . 6 VAL HG22 1 1 7 988 1 1 6 VAL HG23 H -0.037 3.037 5.926 1.00 . A A . 6 VAL HG23 1 1 7 989 1 1 6 VAL N N 1.149 -0.719 3.526 1.00 . A A . 6 VAL N 1 1 7 990 1 1 6 VAL O O -1.359 -0.851 6.014 1.00 . A A . 6 VAL O 1 1 7 991 1 1 7 GLY C C -3.648 -1.185 2.468 1.00 . A A . 7 GLY C 1 1 7 992 1 1 7 GLY CA C -2.967 -1.258 3.822 1.00 . A A . 7 GLY CA 1 1 7 993 1 1 7 GLY H H -1.159 -0.609 2.886 1.00 . A A . 7 GLY H 1 1 7 994 1 1 7 GLY HA2 H -2.982 -2.293 4.165 1.00 . A A . 7 GLY HA2 1 1 7 995 1 1 7 GLY HA3 H -3.522 -0.642 4.531 1.00 . A A . 7 GLY HA3 1 1 7 996 1 1 7 GLY N N -1.592 -0.803 3.778 1.00 . A A . 7 GLY N 1 1 7 997 1 1 7 GLY O O -3.377 -1.998 1.585 1.00 . A A . 7 GLY O 1 1 7 998 1 1 8 HIS C C -4.746 1.194 0.298 1.00 . A A . 8 HIS C 1 1 7 999 1 1 8 HIS CA C -5.256 -0.032 1.050 1.00 . A A . 8 HIS CA 1 1 7 1000 1 1 8 HIS CB C -6.757 0.106 1.313 1.00 . A A . 8 HIS CB 1 1 7 1001 1 1 8 HIS CD2 C -7.419 2.575 1.770 1.00 . A A . 8 HIS CD2 1 1 7 1002 1 1 8 HIS CE1 C -7.513 2.460 3.954 1.00 . A A . 8 HIS CE1 1 1 7 1003 1 1 8 HIS CG C -7.113 1.303 2.151 1.00 . A A . 8 HIS CG 1 1 7 1004 1 1 8 HIS H H -4.713 0.428 3.070 1.00 . A A . 8 HIS H 1 1 7 1005 1 1 8 HIS HA H -5.092 -0.912 0.430 1.00 . A A . 8 HIS HA 1 1 7 1006 1 1 8 HIS HB2 H -7.268 0.191 0.354 1.00 . A A . 8 HIS HB2 1 1 7 1007 1 1 8 HIS HB3 H -7.108 -0.794 1.819 1.00 . A A . 8 HIS HB3 1 1 7 1008 1 1 8 HIS HD2 H -7.458 2.951 0.758 1.00 . A A . 8 HIS HD2 1 1 7 1009 1 1 8 HIS HE1 H -7.643 2.734 4.991 1.00 . A A . 8 HIS HE1 1 1 7 1010 1 1 8 HIS HE2 H -7.924 4.272 2.978 1.00 . A A . 8 HIS HE2 1 1 7 1011 1 1 8 HIS N N -4.535 -0.208 2.306 1.00 . A A . 8 HIS N 1 1 7 1012 1 1 8 HIS ND1 N -7.177 1.250 3.533 1.00 . A A . 8 HIS ND1 1 1 7 1013 1 1 8 HIS NE2 N -7.669 3.296 2.925 1.00 . A A . 8 HIS NE2 1 1 7 1014 1 1 8 HIS O O -5.485 1.819 -0.464 1.00 . A A . 8 HIS O 1 1 7 1015 1 1 9 LEU C C -2.350 2.308 -1.524 1.00 . A A . 9 LEU C 1 1 7 1016 1 1 9 LEU CA C -2.872 2.683 -0.140 1.00 . A A . 9 LEU CA 1 1 7 1017 1 1 9 LEU CB C -1.732 3.239 0.713 1.00 . A A . 9 LEU CB 1 1 7 1018 1 1 9 LEU CD1 C -2.357 5.666 0.793 1.00 . A A . 9 LEU CD1 1 1 7 1019 1 1 9 LEU CD2 C 0.031 4.982 1.088 1.00 . A A . 9 LEU CD2 1 1 7 1020 1 1 9 LEU CG C -1.284 4.665 0.391 1.00 . A A . 9 LEU CG 1 1 7 1021 1 1 9 LEU H H -2.927 0.978 1.154 1.00 . A A . 9 LEU H 1 1 7 1022 1 1 9 LEU HA H -3.629 3.459 -0.254 1.00 . A A . 9 LEU HA 1 1 7 1023 1 1 9 LEU HB2 H -2.054 3.218 1.754 1.00 . A A . 9 LEU HB2 1 1 7 1024 1 1 9 LEU HB3 H -0.871 2.577 0.608 1.00 . A A . 9 LEU HB3 1 1 7 1025 1 1 9 LEU HD11 H -3.290 5.423 0.285 1.00 . A A . 9 LEU HD11 1 1 7 1026 1 1 9 LEU HD12 H -2.041 6.670 0.512 1.00 . A A . 9 LEU HD12 1 1 7 1027 1 1 9 LEU HD13 H -2.509 5.622 1.872 1.00 . A A . 9 LEU HD13 1 1 7 1028 1 1 9 LEU HD21 H 0.787 4.256 0.788 1.00 . A A . 9 LEU HD21 1 1 7 1029 1 1 9 LEU HD22 H -0.110 4.935 2.168 1.00 . A A . 9 LEU HD22 1 1 7 1030 1 1 9 LEU HD23 H 0.358 5.984 0.808 1.00 . A A . 9 LEU HD23 1 1 7 1031 1 1 9 LEU HG H -1.129 4.741 -0.686 1.00 . A A . 9 LEU HG 1 1 7 1032 1 1 9 LEU N N -3.481 1.532 0.517 1.00 . A A . 9 LEU N 1 1 7 1033 1 1 9 LEU O O -1.463 1.465 -1.656 1.00 . A A . 9 LEU O 1 1 7 1034 1 1 10 MET C C -1.046 3.104 -4.151 1.00 . A A . 10 MET C 1 1 7 1035 1 1 10 MET CA C -2.492 2.676 -3.926 1.00 . A A . 10 MET CA 1 1 7 1036 1 1 10 MET CB C -3.411 3.406 -4.906 1.00 . A A . 10 MET CB 1 1 7 1037 1 1 10 MET CE C -2.630 3.105 -8.970 1.00 . A A . 10 MET CE 1 1 7 1038 1 1 10 MET CG C -3.374 2.834 -6.315 1.00 . A A . 10 MET CG 1 1 7 1039 1 1 10 MET H H -3.630 3.622 -2.378 1.00 . A A . 10 MET H 1 1 7 1040 1 1 10 MET HA H -2.569 1.605 -4.111 1.00 . A A . 10 MET HA 1 1 7 1041 1 1 10 MET HB2 H -4.434 3.340 -4.534 1.00 . A A . 10 MET HB2 1 1 7 1042 1 1 10 MET HB3 H -3.119 4.456 -4.945 1.00 . A A . 10 MET HB3 1 1 7 1043 1 1 10 MET HE1 H -1.931 3.491 -9.712 1.00 . A A . 10 MET HE1 1 1 7 1044 1 1 10 MET HE2 H -3.621 3.520 -9.155 1.00 . A A . 10 MET HE2 1 1 7 1045 1 1 10 MET HE3 H -2.672 2.018 -9.042 1.00 . A A . 10 MET HE3 1 1 7 1046 1 1 10 MET HG2 H -3.205 1.759 -6.256 1.00 . A A . 10 MET HG2 1 1 7 1047 1 1 10 MET HG3 H -4.338 3.015 -6.791 1.00 . A A . 10 MET HG3 1 1 7 1048 1 1 10 MET N N -2.905 2.941 -2.552 1.00 . A A . 10 MET N 1 1 7 1049 1 1 10 MET O O -0.741 4.297 -4.196 1.00 . A A . 10 MET O 1 1 7 1050 1 1 10 MET SD S -2.082 3.575 -7.331 1.00 . A A . 10 MET SD 1 1 8 1051 1 1 1 GLY C C 10.040 1.731 2.777 1.00 . A A . 1 GLY C 1 1 8 1052 1 1 1 GLY CA C 9.931 3.234 2.618 1.00 . A A . 1 GLY CA 1 1 8 1053 1 1 1 GLY H1 H 9.823 4.649 1.172 1.00 . A A . 1 GLY H1 1 1 8 1054 1 1 1 GLY H2 H 10.752 3.347 0.769 1.00 . A A . 1 GLY H2 1 1 8 1055 1 1 1 GLY H3 H 9.107 3.220 0.767 1.00 . A A . 1 GLY H3 1 1 8 1056 1 1 1 GLY HA2 H 10.784 3.704 3.107 1.00 . A A . 1 GLY HA2 1 1 8 1057 1 1 1 GLY HA3 H 9.015 3.571 3.102 1.00 . A A . 1 GLY HA3 1 1 8 1058 1 1 1 GLY N N 9.901 3.644 1.226 1.00 . A A . 1 GLY N 1 1 8 1059 1 1 1 GLY O O 10.105 0.998 1.790 1.00 . A A . 1 GLY O 1 1 8 1060 1 1 2 ASN C C 8.787 -0.823 4.257 1.00 . A A . 2 ASN C 1 1 8 1061 1 1 2 ASN CA C 10.160 -0.159 4.308 1.00 . A A . 2 ASN CA 1 1 8 1062 1 1 2 ASN CB C 10.795 -0.380 5.682 1.00 . A A . 2 ASN CB 1 1 8 1063 1 1 2 ASN CG C 9.974 0.226 6.804 1.00 . A A . 2 ASN CG 1 1 8 1064 1 1 2 ASN H H 9.999 1.921 4.792 1.00 . A A . 2 ASN H 1 1 8 1065 1 1 2 ASN HA H 10.797 -0.619 3.552 1.00 . A A . 2 ASN HA 1 1 8 1066 1 1 2 ASN HB2 H 10.896 -1.451 5.857 1.00 . A A . 2 ASN HB2 1 1 8 1067 1 1 2 ASN HB3 H 11.785 0.075 5.687 1.00 . A A . 2 ASN HB3 1 1 8 1068 1 1 2 ASN HD21 H 10.956 1.994 6.611 1.00 . A A . 2 ASN HD21 1 1 8 1069 1 1 2 ASN HD22 H 9.725 1.948 7.853 1.00 . A A . 2 ASN HD22 1 1 8 1070 1 1 2 ASN N N 10.058 1.268 4.023 1.00 . A A . 2 ASN N 1 1 8 1071 1 1 2 ASN ND2 N 10.240 1.491 7.114 1.00 . A A . 2 ASN ND2 1 1 8 1072 1 1 2 ASN O O 8.659 -1.976 3.843 1.00 . A A . 2 ASN O 1 1 8 1073 1 1 2 ASN OD1 O 9.111 -0.434 7.384 1.00 . A A . 2 ASN OD1 1 1 8 1074 1 1 3 HIS C C 5.884 -0.782 3.255 1.00 . A A . 3 HIS C 1 1 8 1075 1 1 3 HIS CA C 6.400 -0.605 4.680 1.00 . A A . 3 HIS CA 1 1 8 1076 1 1 3 HIS CB C 5.476 0.331 5.456 1.00 . A A . 3 HIS CB 1 1 8 1077 1 1 3 HIS CD2 C 6.096 -0.710 7.753 1.00 . A A . 3 HIS CD2 1 1 8 1078 1 1 3 HIS CE1 C 5.785 1.075 8.983 1.00 . A A . 3 HIS CE1 1 1 8 1079 1 1 3 HIS CG C 5.699 0.312 6.944 1.00 . A A . 3 HIS CG 1 1 8 1080 1 1 3 HIS H H 7.935 0.852 5.006 1.00 . A A . 3 HIS H 1 1 8 1081 1 1 3 HIS HA H 6.400 -1.578 5.172 1.00 . A A . 3 HIS HA 1 1 8 1082 1 1 3 HIS HB2 H 5.625 1.349 5.094 1.00 . A A . 3 HIS HB2 1 1 8 1083 1 1 3 HIS HB3 H 4.445 0.037 5.259 1.00 . A A . 3 HIS HB3 1 1 8 1084 1 1 3 HIS HD2 H 6.329 -1.719 7.447 1.00 . A A . 3 HIS HD2 1 1 8 1085 1 1 3 HIS HE1 H 5.728 1.736 9.836 1.00 . A A . 3 HIS HE1 1 1 8 1086 1 1 3 HIS HE2 H 6.406 -0.721 9.873 1.00 . A A . 3 HIS HE2 1 1 8 1087 1 1 3 HIS N N 7.764 -0.088 4.678 1.00 . A A . 3 HIS N 1 1 8 1088 1 1 3 HIS ND1 N 5.507 1.430 7.738 1.00 . A A . 3 HIS ND1 1 1 8 1089 1 1 3 HIS NE2 N 6.146 -0.210 9.042 1.00 . A A . 3 HIS NE2 1 1 8 1090 1 1 3 HIS O O 5.544 0.191 2.582 1.00 . A A . 3 HIS O 1 1 8 1091 1 1 4 TRP C C 3.907 -1.900 1.277 1.00 . A A . 4 TRP C 1 1 8 1092 1 1 4 TRP CA C 5.358 -2.333 1.455 1.00 . A A . 4 TRP CA 1 1 8 1093 1 1 4 TRP CB C 5.496 -3.829 1.169 1.00 . A A . 4 TRP CB 1 1 8 1094 1 1 4 TRP CD1 C 7.723 -4.966 0.602 1.00 . A A . 4 TRP CD1 1 1 8 1095 1 1 4 TRP CD2 C 6.894 -3.693 -1.043 1.00 . A A . 4 TRP CD2 1 1 8 1096 1 1 4 TRP CE2 C 8.109 -4.257 -1.478 1.00 . A A . 4 TRP CE2 1 1 8 1097 1 1 4 TRP CE3 C 6.191 -2.854 -1.912 1.00 . A A . 4 TRP CE3 1 1 8 1098 1 1 4 TRP CG C 6.665 -4.160 0.290 1.00 . A A . 4 TRP CG 1 1 8 1099 1 1 4 TRP CH2 C 7.925 -3.181 -3.574 1.00 . A A . 4 TRP CH2 1 1 8 1100 1 1 4 TRP CZ2 C 8.635 -4.006 -2.743 1.00 . A A . 4 TRP CZ2 1 1 8 1101 1 1 4 TRP CZ3 C 6.715 -2.607 -3.167 1.00 . A A . 4 TRP CZ3 1 1 8 1102 1 1 4 TRP H H 6.128 -2.785 3.401 1.00 . A A . 4 TRP H 1 1 8 1103 1 1 4 TRP HA H 5.972 -1.786 0.739 1.00 . A A . 4 TRP HA 1 1 8 1104 1 1 4 TRP HB2 H 5.606 -4.359 2.115 1.00 . A A . 4 TRP HB2 1 1 8 1105 1 1 4 TRP HB3 H 4.585 -4.172 0.677 1.00 . A A . 4 TRP HB3 1 1 8 1106 1 1 4 TRP HD1 H 7.854 -5.479 1.544 1.00 . A A . 4 TRP HD1 1 1 8 1107 1 1 4 TRP HE1 H 9.454 -5.559 -0.477 1.00 . A A . 4 TRP HE1 1 1 8 1108 1 1 4 TRP HE3 H 5.256 -2.408 -1.609 1.00 . A A . 4 TRP HE3 1 1 8 1109 1 1 4 TRP HH2 H 8.306 -2.969 -4.562 1.00 . A A . 4 TRP HH2 1 1 8 1110 1 1 4 TRP HZ2 H 9.569 -4.446 -3.058 1.00 . A A . 4 TRP HZ2 1 1 8 1111 1 1 4 TRP HZ3 H 6.181 -1.959 -3.846 1.00 . A A . 4 TRP HZ3 1 1 8 1112 1 1 4 TRP N N 5.832 -2.029 2.801 1.00 . A A . 4 TRP N 1 1 8 1113 1 1 4 TRP NE1 N 8.595 -5.030 -0.456 1.00 . A A . 4 TRP NE1 1 1 8 1114 1 1 4 TRP O O 3.619 -0.948 0.553 1.00 . A A . 4 TRP O 1 1 8 1115 1 1 5 ALA C C 0.996 -2.010 3.240 1.00 . A A . 5 ALA C 1 1 8 1116 1 1 5 ALA CA C 1.577 -2.292 1.859 1.00 . A A . 5 ALA CA 1 1 8 1117 1 1 5 ALA CB C 0.824 -3.432 1.189 1.00 . A A . 5 ALA CB 1 1 8 1118 1 1 5 ALA H H 3.299 -3.378 2.517 1.00 . A A . 5 ALA H 1 1 8 1119 1 1 5 ALA HA H 1.458 -1.397 1.249 1.00 . A A . 5 ALA HA 1 1 8 1120 1 1 5 ALA HB1 H -0.236 -3.185 1.134 1.00 . A A . 5 ALA HB1 1 1 8 1121 1 1 5 ALA HB2 H 0.955 -4.345 1.770 1.00 . A A . 5 ALA HB2 1 1 8 1122 1 1 5 ALA HB3 H 1.215 -3.582 0.182 1.00 . A A . 5 ALA HB3 1 1 8 1123 1 1 5 ALA N N 2.998 -2.605 1.941 1.00 . A A . 5 ALA N 1 1 8 1124 1 1 5 ALA O O 0.539 -2.922 3.930 1.00 . A A . 5 ALA O 1 1 8 1125 1 1 6 VAL C C -0.929 -0.863 5.140 1.00 . A A . 6 VAL C 1 1 8 1126 1 1 6 VAL CA C 0.487 -0.339 4.938 1.00 . A A . 6 VAL CA 1 1 8 1127 1 1 6 VAL CB C 0.487 1.191 5.092 1.00 . A A . 6 VAL CB 1 1 8 1128 1 1 6 VAL CG1 C -0.291 1.842 3.958 1.00 . A A . 6 VAL CG1 1 1 8 1129 1 1 6 VAL CG2 C -0.091 1.590 6.441 1.00 . A A . 6 VAL CG2 1 1 8 1130 1 1 6 VAL H H 1.402 -0.039 3.024 1.00 . A A . 6 VAL H 1 1 8 1131 1 1 6 VAL HA H 1.124 -0.762 5.714 1.00 . A A . 6 VAL HA 1 1 8 1132 1 1 6 VAL HB H 1.518 1.540 5.044 1.00 . A A . 6 VAL HB 1 1 8 1133 1 1 6 VAL HG11 H 0.092 2.848 3.785 1.00 . A A . 6 VAL HG11 1 1 8 1134 1 1 6 VAL HG12 H -0.175 1.249 3.051 1.00 . A A . 6 VAL HG12 1 1 8 1135 1 1 6 VAL HG13 H -1.346 1.896 4.224 1.00 . A A . 6 VAL HG13 1 1 8 1136 1 1 6 VAL HG21 H -0.084 2.676 6.534 1.00 . A A . 6 VAL HG21 1 1 8 1137 1 1 6 VAL HG22 H -1.116 1.226 6.520 1.00 . A A . 6 VAL HG22 1 1 8 1138 1 1 6 VAL HG23 H 0.512 1.154 7.238 1.00 . A A . 6 VAL HG23 1 1 8 1139 1 1 6 VAL N N 1.014 -0.742 3.638 1.00 . A A . 6 VAL N 1 1 8 1140 1 1 6 VAL O O -1.315 -1.225 6.251 1.00 . A A . 6 VAL O 1 1 8 1141 1 1 7 GLY C C -3.864 -1.085 2.883 1.00 . A A . 7 GLY C 1 1 8 1142 1 1 7 GLY CA C -3.070 -1.378 4.141 1.00 . A A . 7 GLY CA 1 1 8 1143 1 1 7 GLY H H -1.333 -0.589 3.172 1.00 . A A . 7 GLY H 1 1 8 1144 1 1 7 GLY HA2 H -3.058 -2.455 4.309 1.00 . A A . 7 GLY HA2 1 1 8 1145 1 1 7 GLY HA3 H -3.561 -0.894 4.985 1.00 . A A . 7 GLY HA3 1 1 8 1146 1 1 7 GLY N N -1.702 -0.899 4.060 1.00 . A A . 7 GLY N 1 1 8 1147 1 1 7 GLY O O -4.734 -1.862 2.494 1.00 . A A . 7 GLY O 1 1 8 1148 1 1 8 HIS C C -3.552 -0.123 -0.206 1.00 . A A . 8 HIS C 1 1 8 1149 1 1 8 HIS CA C -4.256 0.438 1.024 1.00 . A A . 8 HIS CA 1 1 8 1150 1 1 8 HIS CB C -4.339 1.961 0.931 1.00 . A A . 8 HIS CB 1 1 8 1151 1 1 8 HIS CD2 C -6.618 2.000 -0.314 1.00 . A A . 8 HIS CD2 1 1 8 1152 1 1 8 HIS CE1 C -6.209 3.700 -1.634 1.00 . A A . 8 HIS CE1 1 1 8 1153 1 1 8 HIS CG C -5.359 2.456 -0.058 1.00 . A A . 8 HIS CG 1 1 8 1154 1 1 8 HIS H H -2.838 0.641 2.617 1.00 . A A . 8 HIS H 1 1 8 1155 1 1 8 HIS HA H -5.269 0.037 1.056 1.00 . A A . 8 HIS HA 1 1 8 1156 1 1 8 HIS HB2 H -4.584 2.359 1.915 1.00 . A A . 8 HIS HB2 1 1 8 1157 1 1 8 HIS HB3 H -3.361 2.340 0.633 1.00 . A A . 8 HIS HB3 1 1 8 1158 1 1 8 HIS HD2 H -7.112 1.172 0.172 1.00 . A A . 8 HIS HD2 1 1 8 1159 1 1 8 HIS HE1 H -6.327 4.464 -2.388 1.00 . A A . 8 HIS HE1 1 1 8 1160 1 1 8 HIS HE2 H -8.061 2.716 -1.727 1.00 . A A . 8 HIS HE2 1 1 8 1161 1 1 8 HIS N N -3.563 0.043 2.246 1.00 . A A . 8 HIS N 1 1 8 1162 1 1 8 HIS ND1 N -5.119 3.528 -0.900 1.00 . A A . 8 HIS ND1 1 1 8 1163 1 1 8 HIS NE2 N -7.142 2.799 -1.315 1.00 . A A . 8 HIS NE2 1 1 8 1164 1 1 8 HIS O O -3.221 0.614 -1.136 1.00 . A A . 8 HIS O 1 1 8 1165 1 1 9 LEU C C -3.384 -1.813 -2.633 1.00 . A A . 9 LEU C 1 1 8 1166 1 1 9 LEU CA C -2.656 -2.094 -1.323 1.00 . A A . 9 LEU CA 1 1 8 1167 1 1 9 LEU CB C -2.584 -3.601 -1.077 1.00 . A A . 9 LEU CB 1 1 8 1168 1 1 9 LEU CD1 C -4.586 -4.772 -2.026 1.00 . A A . 9 LEU CD1 1 1 8 1169 1 1 9 LEU CD2 C -3.681 -5.457 0.203 1.00 . A A . 9 LEU CD2 1 1 8 1170 1 1 9 LEU CG C -3.907 -4.294 -0.753 1.00 . A A . 9 LEU CG 1 1 8 1171 1 1 9 LEU H H -3.616 -1.983 0.588 1.00 . A A . 9 LEU H 1 1 8 1172 1 1 9 LEU HA H -1.641 -1.706 -1.400 1.00 . A A . 9 LEU HA 1 1 8 1173 1 1 9 LEU HB2 H -2.159 -4.072 -1.964 1.00 . A A . 9 LEU HB2 1 1 8 1174 1 1 9 LEU HB3 H -1.905 -3.770 -0.241 1.00 . A A . 9 LEU HB3 1 1 8 1175 1 1 9 LEU HD11 H -4.740 -3.926 -2.696 1.00 . A A . 9 LEU HD11 1 1 8 1176 1 1 9 LEU HD12 H -5.549 -5.218 -1.778 1.00 . A A . 9 LEU HD12 1 1 8 1177 1 1 9 LEU HD13 H -3.957 -5.515 -2.516 1.00 . A A . 9 LEU HD13 1 1 8 1178 1 1 9 LEU HD21 H -3.194 -5.094 1.108 1.00 . A A . 9 LEU HD21 1 1 8 1179 1 1 9 LEU HD22 H -4.639 -5.906 0.461 1.00 . A A . 9 LEU HD22 1 1 8 1180 1 1 9 LEU HD23 H -3.047 -6.203 -0.277 1.00 . A A . 9 LEU HD23 1 1 8 1181 1 1 9 LEU HG H -4.562 -3.571 -0.265 1.00 . A A . 9 LEU HG 1 1 8 1182 1 1 9 LEU N N -3.322 -1.432 -0.206 1.00 . A A . 9 LEU N 1 1 8 1183 1 1 9 LEU O O -4.596 -1.604 -2.649 1.00 . A A . 9 LEU O 1 1 8 1184 1 1 10 MET C C -4.254 -2.621 -5.394 1.00 . A A . 10 MET C 1 1 8 1185 1 1 10 MET CA C -3.210 -1.565 -5.047 1.00 . A A . 10 MET CA 1 1 8 1186 1 1 10 MET CB C -2.112 -1.547 -6.113 1.00 . A A . 10 MET CB 1 1 8 1187 1 1 10 MET CE C 1.530 0.487 -6.288 1.00 . A A . 10 MET CE 1 1 8 1188 1 1 10 MET CG C -0.991 -0.565 -5.814 1.00 . A A . 10 MET CG 1 1 8 1189 1 1 10 MET H H -1.644 -1.991 -3.651 1.00 . A A . 10 MET H 1 1 8 1190 1 1 10 MET HA H -3.695 -0.589 -5.034 1.00 . A A . 10 MET HA 1 1 8 1191 1 1 10 MET HB2 H -1.688 -2.548 -6.196 1.00 . A A . 10 MET HB2 1 1 8 1192 1 1 10 MET HB3 H -2.562 -1.276 -7.068 1.00 . A A . 10 MET HB3 1 1 8 1193 1 1 10 MET HE1 H 2.487 0.427 -6.805 1.00 . A A . 10 MET HE1 1 1 8 1194 1 1 10 MET HE2 H 1.695 0.445 -5.211 1.00 . A A . 10 MET HE2 1 1 8 1195 1 1 10 MET HE3 H 1.036 1.424 -6.544 1.00 . A A . 10 MET HE3 1 1 8 1196 1 1 10 MET HG2 H -1.342 0.443 -6.038 1.00 . A A . 10 MET HG2 1 1 8 1197 1 1 10 MET HG3 H -0.741 -0.625 -4.755 1.00 . A A . 10 MET HG3 1 1 8 1198 1 1 10 MET N N -2.635 -1.814 -3.731 1.00 . A A . 10 MET N 1 1 8 1199 1 1 10 MET O O -4.641 -2.768 -6.556 1.00 . A A . 10 MET O 1 1 8 1200 1 1 10 MET SD S 0.494 -0.888 -6.785 1.00 . A A . 10 MET SD 1 1 9 1201 1 1 1 GLY C C 9.110 3.713 6.103 1.00 . A A . 1 GLY C 1 1 9 1202 1 1 1 GLY CA C 9.236 4.103 7.563 1.00 . A A . 1 GLY CA 1 1 9 1203 1 1 1 GLY H1 H 9.324 5.752 8.738 1.00 . A A . 1 GLY H1 1 1 9 1204 1 1 1 GLY H2 H 10.018 5.946 7.254 1.00 . A A . 1 GLY H2 1 1 9 1205 1 1 1 GLY H3 H 8.376 5.930 7.400 1.00 . A A . 1 GLY H3 1 1 9 1206 1 1 1 GLY HA2 H 10.163 3.691 7.961 1.00 . A A . 1 GLY HA2 1 1 9 1207 1 1 1 GLY HA3 H 8.395 3.679 8.112 1.00 . A A . 1 GLY HA3 1 1 9 1208 1 1 1 GLY N N 9.239 5.542 7.753 1.00 . A A . 1 GLY N 1 1 9 1209 1 1 1 GLY O O 8.636 4.497 5.282 1.00 . A A . 1 GLY O 1 1 9 1210 1 1 2 ASN C C 8.720 0.676 4.344 1.00 . A A . 2 ASN C 1 1 9 1211 1 1 2 ASN CA C 9.471 2.002 4.409 1.00 . A A . 2 ASN CA 1 1 9 1212 1 1 2 ASN CB C 10.880 1.832 3.839 1.00 . A A . 2 ASN CB 1 1 9 1213 1 1 2 ASN CG C 11.801 1.088 4.786 1.00 . A A . 2 ASN CG 1 1 9 1214 1 1 2 ASN H H 9.916 1.898 6.500 1.00 . A A . 2 ASN H 1 1 9 1215 1 1 2 ASN HA H 8.937 2.734 3.802 1.00 . A A . 2 ASN HA 1 1 9 1216 1 1 2 ASN HB2 H 10.814 1.275 2.904 1.00 . A A . 2 ASN HB2 1 1 9 1217 1 1 2 ASN HB3 H 11.301 2.817 3.635 1.00 . A A . 2 ASN HB3 1 1 9 1218 1 1 2 ASN HD21 H 11.775 -0.548 3.582 1.00 . A A . 2 ASN HD21 1 1 9 1219 1 1 2 ASN HD22 H 12.744 -0.694 5.031 1.00 . A A . 2 ASN HD22 1 1 9 1220 1 1 2 ASN N N 9.537 2.495 5.779 1.00 . A A . 2 ASN N 1 1 9 1221 1 1 2 ASN ND2 N 12.133 -0.150 4.438 1.00 . A A . 2 ASN ND2 1 1 9 1222 1 1 2 ASN O O 9.298 -0.362 4.024 1.00 . A A . 2 ASN O 1 1 9 1223 1 1 2 ASN OD1 O 12.209 1.620 5.819 1.00 . A A . 2 ASN OD1 1 1 9 1224 1 1 3 HIS C C 6.164 -0.812 3.197 1.00 . A A . 3 HIS C 1 1 9 1225 1 1 3 HIS CA C 6.595 -0.479 4.623 1.00 . A A . 3 HIS CA 1 1 9 1226 1 1 3 HIS CB C 5.365 -0.290 5.509 1.00 . A A . 3 HIS CB 1 1 9 1227 1 1 3 HIS CD2 C 6.644 -1.159 7.596 1.00 . A A . 3 HIS CD2 1 1 9 1228 1 1 3 HIS CE1 C 5.324 -0.316 9.127 1.00 . A A . 3 HIS CE1 1 1 9 1229 1 1 3 HIS CG C 5.633 -0.487 6.976 1.00 . A A . 3 HIS CG 1 1 9 1230 1 1 3 HIS H H 7.009 1.603 4.902 1.00 . A A . 3 HIS H 1 1 9 1231 1 1 3 HIS HA H 7.178 -1.313 5.013 1.00 . A A . 3 HIS HA 1 1 9 1232 1 1 3 HIS HB2 H 4.975 0.716 5.356 1.00 . A A . 3 HIS HB2 1 1 9 1233 1 1 3 HIS HB3 H 4.606 -1.009 5.200 1.00 . A A . 3 HIS HB3 1 1 9 1234 1 1 3 HIS HD2 H 7.455 -1.684 7.114 1.00 . A A . 3 HIS HD2 1 1 9 1235 1 1 3 HIS HE1 H 4.903 -0.053 10.086 1.00 . A A . 3 HIS HE1 1 1 9 1236 1 1 3 HIS HE2 H 7.012 -1.428 9.690 1.00 . A A . 3 HIS HE2 1 1 9 1237 1 1 3 HIS N N 7.426 0.719 4.648 1.00 . A A . 3 HIS N 1 1 9 1238 1 1 3 HIS ND1 N 4.809 0.038 7.958 1.00 . A A . 3 HIS ND1 1 1 9 1239 1 1 3 HIS NE2 N 6.434 -1.040 8.959 1.00 . A A . 3 HIS NE2 1 1 9 1240 1 1 3 HIS O O 5.971 0.082 2.373 1.00 . A A . 3 HIS O 1 1 9 1241 1 1 4 TRP C C 4.153 -2.193 1.316 1.00 . A A . 4 TRP C 1 1 9 1242 1 1 4 TRP CA C 5.610 -2.550 1.589 1.00 . A A . 4 TRP CA 1 1 9 1243 1 1 4 TRP CB C 5.812 -4.062 1.456 1.00 . A A . 4 TRP CB 1 1 9 1244 1 1 4 TRP CD1 C 8.038 -5.224 0.952 1.00 . A A . 4 TRP CD1 1 1 9 1245 1 1 4 TRP CD2 C 7.224 -4.018 -0.751 1.00 . A A . 4 TRP CD2 1 1 9 1246 1 1 4 TRP CE2 C 8.440 -4.601 -1.154 1.00 . A A . 4 TRP CE2 1 1 9 1247 1 1 4 TRP CE3 C 6.529 -3.214 -1.658 1.00 . A A . 4 TRP CE3 1 1 9 1248 1 1 4 TRP CG C 6.985 -4.430 0.599 1.00 . A A . 4 TRP CG 1 1 9 1249 1 1 4 TRP CH2 C 8.273 -3.612 -3.293 1.00 . A A . 4 TRP CH2 1 1 9 1250 1 1 4 TRP CZ2 C 8.975 -4.404 -2.425 1.00 . A A . 4 TRP CZ2 1 1 9 1251 1 1 4 TRP CZ3 C 7.060 -3.020 -2.917 1.00 . A A . 4 TRP CZ3 1 1 9 1252 1 1 4 TRP H H 6.189 -2.786 3.637 1.00 . A A . 4 TRP H 1 1 9 1253 1 1 4 TRP HA H 6.234 -2.051 0.848 1.00 . A A . 4 TRP HA 1 1 9 1254 1 1 4 TRP HB2 H 5.965 -4.479 2.451 1.00 . A A . 4 TRP HB2 1 1 9 1255 1 1 4 TRP HB3 H 4.911 -4.500 1.026 1.00 . A A . 4 TRP HB3 1 1 9 1256 1 1 4 TRP HD1 H 8.162 -5.699 1.914 1.00 . A A . 4 TRP HD1 1 1 9 1257 1 1 4 TRP HE1 H 9.777 -5.862 -0.092 1.00 . A A . 4 TRP HE1 1 1 9 1258 1 1 4 TRP HE3 H 5.593 -2.754 -1.380 1.00 . A A . 4 TRP HE3 1 1 9 1259 1 1 4 TRP HH2 H 8.661 -3.440 -4.286 1.00 . A A . 4 TRP HH2 1 1 9 1260 1 1 4 TRP HZ2 H 9.910 -4.859 -2.715 1.00 . A A . 4 TRP HZ2 1 1 9 1261 1 1 4 TRP HZ3 H 6.531 -2.400 -3.626 1.00 . A A . 4 TRP HZ3 1 1 9 1262 1 1 4 TRP N N 6.016 -2.101 2.916 1.00 . A A . 4 TRP N 1 1 9 1263 1 1 4 TRP NE1 N 8.918 -5.331 -0.098 1.00 . A A . 4 TRP NE1 1 1 9 1264 1 1 4 TRP O O 3.859 -1.341 0.480 1.00 . A A . 4 TRP O 1 1 9 1265 1 1 5 ALA C C 1.147 -2.339 3.207 1.00 . A A . 5 ALA C 1 1 9 1266 1 1 5 ALA CA C 1.817 -2.602 1.863 1.00 . A A . 5 ALA CA 1 1 9 1267 1 1 5 ALA CB C 1.153 -3.778 1.160 1.00 . A A . 5 ALA CB 1 1 9 1268 1 1 5 ALA H H 3.549 -3.544 2.697 1.00 . A A . 5 ALA H 1 1 9 1269 1 1 5 ALA HA H 1.694 -1.717 1.239 1.00 . A A . 5 ALA HA 1 1 9 1270 1 1 5 ALA HB1 H 0.088 -3.578 1.044 1.00 . A A . 5 ALA HB1 1 1 9 1271 1 1 5 ALA HB2 H 1.290 -4.681 1.755 1.00 . A A . 5 ALA HB2 1 1 9 1272 1 1 5 ALA HB3 H 1.606 -3.918 0.178 1.00 . A A . 5 ALA HB3 1 1 9 1273 1 1 5 ALA N N 3.244 -2.852 2.027 1.00 . A A . 5 ALA N 1 1 9 1274 1 1 5 ALA O O 0.724 -3.270 3.894 1.00 . A A . 5 ALA O 1 1 9 1275 1 1 6 VAL C C -0.977 -1.241 4.954 1.00 . A A . 6 VAL C 1 1 9 1276 1 1 6 VAL CA C 0.434 -0.681 4.842 1.00 . A A . 6 VAL CA 1 1 9 1277 1 1 6 VAL CB C 0.382 0.849 4.995 1.00 . A A . 6 VAL CB 1 1 9 1278 1 1 6 VAL CG1 C -0.295 1.232 6.303 1.00 . A A . 6 VAL CG1 1 1 9 1279 1 1 6 VAL CG2 C 1.781 1.442 4.916 1.00 . A A . 6 VAL CG2 1 1 9 1280 1 1 6 VAL H H 1.423 -0.349 2.971 1.00 . A A . 6 VAL H 1 1 9 1281 1 1 6 VAL HA H 1.031 -1.088 5.657 1.00 . A A . 6 VAL HA 1 1 9 1282 1 1 6 VAL HB H -0.208 1.255 4.173 1.00 . A A . 6 VAL HB 1 1 9 1283 1 1 6 VAL HG11 H -1.294 0.798 6.337 1.00 . A A . 6 VAL HG11 1 1 9 1284 1 1 6 VAL HG12 H 0.294 0.856 7.140 1.00 . A A . 6 VAL HG12 1 1 9 1285 1 1 6 VAL HG13 H -0.368 2.318 6.371 1.00 . A A . 6 VAL HG13 1 1 9 1286 1 1 6 VAL HG21 H 2.245 1.156 3.973 1.00 . A A . 6 VAL HG21 1 1 9 1287 1 1 6 VAL HG22 H 2.381 1.067 5.745 1.00 . A A . 6 VAL HG22 1 1 9 1288 1 1 6 VAL HG23 H 1.719 2.529 4.976 1.00 . A A . 6 VAL HG23 1 1 9 1289 1 1 6 VAL N N 1.054 -1.067 3.578 1.00 . A A . 6 VAL N 1 1 9 1290 1 1 6 VAL O O -1.245 -2.118 5.774 1.00 . A A . 6 VAL O 1 1 9 1291 1 1 7 GLY C C -4.148 -0.403 3.204 1.00 . A A . 7 GLY C 1 1 9 1292 1 1 7 GLY CA C -3.256 -1.191 4.145 1.00 . A A . 7 GLY CA 1 1 9 1293 1 1 7 GLY H H -1.606 -0.011 3.469 1.00 . A A . 7 GLY H 1 1 9 1294 1 1 7 GLY HA2 H -3.278 -2.240 3.849 1.00 . A A . 7 GLY HA2 1 1 9 1295 1 1 7 GLY HA3 H -3.644 -1.101 5.159 1.00 . A A . 7 GLY HA3 1 1 9 1296 1 1 7 GLY N N -1.880 -0.730 4.123 1.00 . A A . 7 GLY N 1 1 9 1297 1 1 7 GLY O O -5.316 -0.160 3.504 1.00 . A A . 7 GLY O 1 1 9 1298 1 1 8 HIS C C -4.173 0.172 -0.318 1.00 . A A . 8 HIS C 1 1 9 1299 1 1 8 HIS CA C -4.346 0.764 1.078 1.00 . A A . 8 HIS CA 1 1 9 1300 1 1 8 HIS CB C -3.895 2.225 1.082 1.00 . A A . 8 HIS CB 1 1 9 1301 1 1 8 HIS CD2 C -5.177 3.624 -0.693 1.00 . A A . 8 HIS CD2 1 1 9 1302 1 1 8 HIS CE1 C -6.638 4.547 0.649 1.00 . A A . 8 HIS CE1 1 1 9 1303 1 1 8 HIS CG C -4.942 3.180 0.573 1.00 . A A . 8 HIS CG 1 1 9 1304 1 1 8 HIS H H -2.629 -0.236 1.876 1.00 . A A . 8 HIS H 1 1 9 1305 1 1 8 HIS HA H -5.403 0.727 1.342 1.00 . A A . 8 HIS HA 1 1 9 1306 1 1 8 HIS HB2 H -3.629 2.507 2.100 1.00 . A A . 8 HIS HB2 1 1 9 1307 1 1 8 HIS HB3 H -3.011 2.315 0.451 1.00 . A A . 8 HIS HB3 1 1 9 1308 1 1 8 HIS HD2 H -4.625 3.352 -1.581 1.00 . A A . 8 HIS HD2 1 1 9 1309 1 1 8 HIS HE1 H -7.460 5.145 1.014 1.00 . A A . 8 HIS HE1 1 1 9 1310 1 1 8 HIS HE2 H -6.672 4.983 -1.401 1.00 . A A . 8 HIS HE2 1 1 9 1311 1 1 8 HIS N N -3.594 -0.003 2.064 1.00 . A A . 8 HIS N 1 1 9 1312 1 1 8 HIS ND1 N -5.874 3.773 1.408 1.00 . A A . 8 HIS ND1 1 1 9 1313 1 1 8 HIS NE2 N -6.254 4.488 -0.627 1.00 . A A . 8 HIS NE2 1 1 9 1314 1 1 8 HIS O O -4.222 0.889 -1.318 1.00 . A A . 8 HIS O 1 1 9 1315 1 1 9 LEU C C -5.124 -2.033 -2.356 1.00 . A A . 9 LEU C 1 1 9 1316 1 1 9 LEU CA C -3.788 -1.828 -1.650 1.00 . A A . 9 LEU CA 1 1 9 1317 1 1 9 LEU CB C -3.101 -3.178 -1.429 1.00 . A A . 9 LEU CB 1 1 9 1318 1 1 9 LEU CD1 C -1.757 -3.585 -3.505 1.00 . A A . 9 LEU CD1 1 1 9 1319 1 1 9 LEU CD2 C -2.759 -5.516 -2.268 1.00 . A A . 9 LEU CD2 1 1 9 1320 1 1 9 LEU CG C -2.937 -4.058 -2.668 1.00 . A A . 9 LEU CG 1 1 9 1321 1 1 9 LEU H H -3.939 -1.671 0.481 1.00 . A A . 9 LEU H 1 1 9 1322 1 1 9 LEU HA H -3.150 -1.215 -2.287 1.00 . A A . 9 LEU HA 1 1 9 1323 1 1 9 LEU HB2 H -2.108 -2.984 -1.023 1.00 . A A . 9 LEU HB2 1 1 9 1324 1 1 9 LEU HB3 H -3.672 -3.734 -0.686 1.00 . A A . 9 LEU HB3 1 1 9 1325 1 1 9 LEU HD11 H -1.903 -2.541 -3.781 1.00 . A A . 9 LEU HD11 1 1 9 1326 1 1 9 LEU HD12 H -0.839 -3.683 -2.926 1.00 . A A . 9 LEU HD12 1 1 9 1327 1 1 9 LEU HD13 H -1.685 -4.193 -4.407 1.00 . A A . 9 LEU HD13 1 1 9 1328 1 1 9 LEU HD21 H -3.612 -5.836 -1.670 1.00 . A A . 9 LEU HD21 1 1 9 1329 1 1 9 LEU HD22 H -2.691 -6.132 -3.165 1.00 . A A . 9 LEU HD22 1 1 9 1330 1 1 9 LEU HD23 H -1.845 -5.623 -1.684 1.00 . A A . 9 LEU HD23 1 1 9 1331 1 1 9 LEU HG H -3.841 -3.976 -3.271 1.00 . A A . 9 LEU HG 1 1 9 1332 1 1 9 LEU N N -3.969 -1.138 -0.377 1.00 . A A . 9 LEU N 1 1 9 1333 1 1 9 LEU O O -6.126 -2.364 -1.722 1.00 . A A . 9 LEU O 1 1 9 1334 1 1 10 MET C C -6.910 -3.410 -4.298 1.00 . A A . 10 MET C 1 1 9 1335 1 1 10 MET CA C -6.344 -2.002 -4.461 1.00 . A A . 10 MET CA 1 1 9 1336 1 1 10 MET CB C -6.060 -1.721 -5.937 1.00 . A A . 10 MET CB 1 1 9 1337 1 1 10 MET CE C -2.877 -2.821 -8.092 1.00 . A A . 10 MET CE 1 1 9 1338 1 1 10 MET CG C -5.218 -2.795 -6.608 1.00 . A A . 10 MET CG 1 1 9 1339 1 1 10 MET H H -4.274 -1.564 -4.131 1.00 . A A . 10 MET H 1 1 9 1340 1 1 10 MET HA H -7.088 -1.287 -4.109 1.00 . A A . 10 MET HA 1 1 9 1341 1 1 10 MET HB2 H -7.008 -1.636 -6.467 1.00 . A A . 10 MET HB2 1 1 9 1342 1 1 10 MET HB3 H -5.530 -0.771 -6.012 1.00 . A A . 10 MET HB3 1 1 9 1343 1 1 10 MET HE1 H -2.348 -2.570 -9.011 1.00 . A A . 10 MET HE1 1 1 9 1344 1 1 10 MET HE2 H -2.852 -3.901 -7.942 1.00 . A A . 10 MET HE2 1 1 9 1345 1 1 10 MET HE3 H -2.395 -2.327 -7.249 1.00 . A A . 10 MET HE3 1 1 9 1346 1 1 10 MET HG2 H -4.376 -3.035 -5.959 1.00 . A A . 10 MET HG2 1 1 9 1347 1 1 10 MET HG3 H -5.827 -3.689 -6.743 1.00 . A A . 10 MET HG3 1 1 9 1348 1 1 10 MET N N -5.130 -1.836 -3.669 1.00 . A A . 10 MET N 1 1 9 1349 1 1 10 MET O O -6.264 -4.288 -3.724 1.00 . A A . 10 MET O 1 1 9 1350 1 1 10 MET SD S -4.580 -2.274 -8.213 1.00 . A A . 10 MET SD 1 1 10 1351 1 1 1 GLY C C 10.466 2.268 1.581 1.00 . A A . 1 GLY C 1 1 10 1352 1 1 1 GLY CA C 10.346 2.481 0.084 1.00 . A A . 1 GLY CA 1 1 10 1353 1 1 1 GLY H1 H 11.510 2.653 -1.565 1.00 . A A . 1 GLY H1 1 1 10 1354 1 1 1 GLY H2 H 12.262 3.089 -0.163 1.00 . A A . 1 GLY H2 1 1 10 1355 1 1 1 GLY H3 H 12.014 1.495 -0.505 1.00 . A A . 1 GLY H3 1 1 10 1356 1 1 1 GLY HA2 H 9.899 3.459 -0.095 1.00 . A A . 1 GLY HA2 1 1 10 1357 1 1 1 GLY HA3 H 9.694 1.712 -0.332 1.00 . A A . 1 GLY HA3 1 1 10 1358 1 1 1 GLY N N 11.631 2.425 -0.588 1.00 . A A . 1 GLY N 1 1 10 1359 1 1 1 GLY O O 11.519 1.871 2.076 1.00 . A A . 1 GLY O 1 1 10 1360 1 1 2 ASN C C 8.601 1.120 4.153 1.00 . A A . 2 ASN C 1 1 10 1361 1 1 2 ASN CA C 9.371 2.374 3.752 1.00 . A A . 2 ASN CA 1 1 10 1362 1 1 2 ASN CB C 8.749 3.604 4.419 1.00 . A A . 2 ASN CB 1 1 10 1363 1 1 2 ASN CG C 9.582 4.854 4.217 1.00 . A A . 2 ASN CG 1 1 10 1364 1 1 2 ASN H H 8.547 2.860 1.837 1.00 . A A . 2 ASN H 1 1 10 1365 1 1 2 ASN HA H 10.400 2.275 4.098 1.00 . A A . 2 ASN HA 1 1 10 1366 1 1 2 ASN HB2 H 7.759 3.770 3.992 1.00 . A A . 2 ASN HB2 1 1 10 1367 1 1 2 ASN HB3 H 8.647 3.414 5.487 1.00 . A A . 2 ASN HB3 1 1 10 1368 1 1 2 ASN HD21 H 9.214 5.448 6.124 1.00 . A A . 2 ASN HD21 1 1 10 1369 1 1 2 ASN HD22 H 10.222 6.523 5.182 1.00 . A A . 2 ASN HD22 1 1 10 1370 1 1 2 ASN N N 9.383 2.536 2.303 1.00 . A A . 2 ASN N 1 1 10 1371 1 1 2 ASN ND2 N 9.681 5.674 5.257 1.00 . A A . 2 ASN ND2 1 1 10 1372 1 1 2 ASN O O 9.190 0.130 4.590 1.00 . A A . 2 ASN O 1 1 10 1373 1 1 2 ASN OD1 O 10.129 5.082 3.138 1.00 . A A . 2 ASN OD1 1 1 10 1374 1 1 3 HIS C C 6.159 -0.833 3.123 1.00 . A A . 3 HIS C 1 1 10 1375 1 1 3 HIS CA C 6.430 0.035 4.347 1.00 . A A . 3 HIS CA 1 1 10 1376 1 1 3 HIS CB C 5.109 0.525 4.944 1.00 . A A . 3 HIS CB 1 1 10 1377 1 1 3 HIS CD2 C 5.267 1.274 7.425 1.00 . A A . 3 HIS CD2 1 1 10 1378 1 1 3 HIS CE1 C 5.615 3.407 7.072 1.00 . A A . 3 HIS CE1 1 1 10 1379 1 1 3 HIS CG C 5.285 1.494 6.081 1.00 . A A . 3 HIS CG 1 1 10 1380 1 1 3 HIS H H 6.857 2.011 3.641 1.00 . A A . 3 HIS H 1 1 10 1381 1 1 3 HIS HA H 6.944 -0.570 5.094 1.00 . A A . 3 HIS HA 1 1 10 1382 1 1 3 HIS HB2 H 4.528 1.007 4.158 1.00 . A A . 3 HIS HB2 1 1 10 1383 1 1 3 HIS HB3 H 4.555 -0.340 5.310 1.00 . A A . 3 HIS HB3 1 1 10 1384 1 1 3 HIS HD2 H 5.117 0.325 7.919 1.00 . A A . 3 HIS HD2 1 1 10 1385 1 1 3 HIS HE1 H 5.792 4.458 7.242 1.00 . A A . 3 HIS HE1 1 1 10 1386 1 1 3 HIS HE2 H 5.519 2.667 9.033 1.00 . A A . 3 HIS HE2 1 1 10 1387 1 1 3 HIS N N 7.281 1.169 4.003 1.00 . A A . 3 HIS N 1 1 10 1388 1 1 3 HIS ND1 N 5.505 2.846 5.878 1.00 . A A . 3 HIS ND1 1 1 10 1389 1 1 3 HIS NE2 N 5.477 2.496 8.038 1.00 . A A . 3 HIS NE2 1 1 10 1390 1 1 3 HIS O O 5.907 -0.323 2.032 1.00 . A A . 3 HIS O 1 1 10 1391 1 1 4 TRP C C 4.542 -2.976 1.712 1.00 . A A . 4 TRP C 1 1 10 1392 1 1 4 TRP CA C 5.974 -3.087 2.223 1.00 . A A . 4 TRP CA 1 1 10 1393 1 1 4 TRP CB C 6.255 -4.518 2.685 1.00 . A A . 4 TRP CB 1 1 10 1394 1 1 4 TRP CD1 C 8.518 -5.717 2.765 1.00 . A A . 4 TRP CD1 1 1 10 1395 1 1 4 TRP CD2 C 7.867 -5.116 0.707 1.00 . A A . 4 TRP CD2 1 1 10 1396 1 1 4 TRP CE2 C 9.115 -5.760 0.612 1.00 . A A . 4 TRP CE2 1 1 10 1397 1 1 4 TRP CE3 C 7.258 -4.648 -0.461 1.00 . A A . 4 TRP CE3 1 1 10 1398 1 1 4 TRP CG C 7.502 -5.098 2.092 1.00 . A A . 4 TRP CG 1 1 10 1399 1 1 4 TRP CH2 C 9.146 -5.480 -1.733 1.00 . A A . 4 TRP CH2 1 1 10 1400 1 1 4 TRP CZ2 C 9.765 -5.948 -0.604 1.00 . A A . 4 TRP CZ2 1 1 10 1401 1 1 4 TRP CZ3 C 7.905 -4.836 -1.668 1.00 . A A . 4 TRP CZ3 1 1 10 1402 1 1 4 TRP H H 6.422 -2.503 4.234 1.00 . A A . 4 TRP H 1 1 10 1403 1 1 4 TRP HA H 6.653 -2.848 1.405 1.00 . A A . 4 TRP HA 1 1 10 1404 1 1 4 TRP HB2 H 6.356 -4.517 3.770 1.00 . A A . 4 TRP HB2 1 1 10 1405 1 1 4 TRP HB3 H 5.409 -5.148 2.411 1.00 . A A . 4 TRP HB3 1 1 10 1406 1 1 4 TRP HD1 H 8.551 -5.870 3.833 1.00 . A A . 4 TRP HD1 1 1 10 1407 1 1 4 TRP HE1 H 10.345 -6.597 2.125 1.00 . A A . 4 TRP HE1 1 1 10 1408 1 1 4 TRP HE3 H 6.301 -4.150 -0.421 1.00 . A A . 4 TRP HE3 1 1 10 1409 1 1 4 TRP HH2 H 9.625 -5.611 -2.692 1.00 . A A . 4 TRP HH2 1 1 10 1410 1 1 4 TRP HZ2 H 10.723 -6.444 -0.656 1.00 . A A . 4 TRP HZ2 1 1 10 1411 1 1 4 TRP HZ3 H 7.444 -4.478 -2.577 1.00 . A A . 4 TRP HZ3 1 1 10 1412 1 1 4 TRP N N 6.212 -2.146 3.313 1.00 . A A . 4 TRP N 1 1 10 1413 1 1 4 TRP NE1 N 9.491 -6.117 1.880 1.00 . A A . 4 TRP NE1 1 1 10 1414 1 1 4 TRP O O 4.312 -2.707 0.534 1.00 . A A . 4 TRP O 1 1 10 1415 1 1 5 ALA C C 1.358 -2.443 3.355 1.00 . A A . 5 ALA C 1 1 10 1416 1 1 5 ALA CA C 2.172 -3.104 2.248 1.00 . A A . 5 ALA CA 1 1 10 1417 1 1 5 ALA CB C 1.624 -4.490 1.947 1.00 . A A . 5 ALA CB 1 1 10 1418 1 1 5 ALA H H 3.834 -3.400 3.561 1.00 . A A . 5 ALA H 1 1 10 1419 1 1 5 ALA HA H 2.081 -2.496 1.348 1.00 . A A . 5 ALA HA 1 1 10 1420 1 1 5 ALA HB1 H 0.570 -4.415 1.679 1.00 . A A . 5 ALA HB1 1 1 10 1421 1 1 5 ALA HB2 H 2.179 -4.927 1.116 1.00 . A A . 5 ALA HB2 1 1 10 1422 1 1 5 ALA HB3 H 1.732 -5.123 2.828 1.00 . A A . 5 ALA HB3 1 1 10 1423 1 1 5 ALA N N 3.581 -3.182 2.608 1.00 . A A . 5 ALA N 1 1 10 1424 1 1 5 ALA O O 0.898 -3.107 4.283 1.00 . A A . 5 ALA O 1 1 10 1425 1 1 6 VAL C C -0.955 -0.982 4.453 1.00 . A A . 6 VAL C 1 1 10 1426 1 1 6 VAL CA C 0.428 -0.375 4.246 1.00 . A A . 6 VAL CA 1 1 10 1427 1 1 6 VAL CB C 0.275 1.099 3.835 1.00 . A A . 6 VAL CB 1 1 10 1428 1 1 6 VAL CG1 C -0.520 1.866 4.882 1.00 . A A . 6 VAL CG1 1 1 10 1429 1 1 6 VAL CG2 C 1.639 1.738 3.619 1.00 . A A . 6 VAL CG2 1 1 10 1430 1 1 6 VAL H H 1.589 -0.639 2.467 1.00 . A A . 6 VAL H 1 1 10 1431 1 1 6 VAL HA H 0.966 -0.415 5.192 1.00 . A A . 6 VAL HA 1 1 10 1432 1 1 6 VAL HB H -0.273 1.137 2.894 1.00 . A A . 6 VAL HB 1 1 10 1433 1 1 6 VAL HG11 H -1.492 1.392 5.021 1.00 . A A . 6 VAL HG11 1 1 10 1434 1 1 6 VAL HG12 H 0.024 1.862 5.827 1.00 . A A . 6 VAL HG12 1 1 10 1435 1 1 6 VAL HG13 H -0.662 2.895 4.550 1.00 . A A . 6 VAL HG13 1 1 10 1436 1 1 6 VAL HG21 H 2.190 1.173 2.867 1.00 . A A . 6 VAL HG21 1 1 10 1437 1 1 6 VAL HG22 H 2.195 1.732 4.557 1.00 . A A . 6 VAL HG22 1 1 10 1438 1 1 6 VAL HG23 H 1.509 2.765 3.280 1.00 . A A . 6 VAL HG23 1 1 10 1439 1 1 6 VAL N N 1.185 -1.128 3.253 1.00 . A A . 6 VAL N 1 1 10 1440 1 1 6 VAL O O -1.297 -1.413 5.555 1.00 . A A . 6 VAL O 1 1 10 1441 1 1 7 GLY C C -4.014 -1.015 2.407 1.00 . A A . 7 GLY C 1 1 10 1442 1 1 7 GLY CA C -3.088 -1.563 3.475 1.00 . A A . 7 GLY CA 1 1 10 1443 1 1 7 GLY H H -1.419 -0.639 2.510 1.00 . A A . 7 GLY H 1 1 10 1444 1 1 7 GLY HA2 H -3.026 -2.646 3.362 1.00 . A A . 7 GLY HA2 1 1 10 1445 1 1 7 GLY HA3 H -3.505 -1.334 4.456 1.00 . A A . 7 GLY HA3 1 1 10 1446 1 1 7 GLY N N -1.750 -1.009 3.390 1.00 . A A . 7 GLY N 1 1 10 1447 1 1 7 GLY O O -4.373 -1.721 1.464 1.00 . A A . 7 GLY O 1 1 10 1448 1 1 8 HIS C C -4.535 1.912 0.750 1.00 . A A . 8 HIS C 1 1 10 1449 1 1 8 HIS CA C -5.292 0.890 1.593 1.00 . A A . 8 HIS CA 1 1 10 1450 1 1 8 HIS CB C -6.454 1.573 2.319 1.00 . A A . 8 HIS CB 1 1 10 1451 1 1 8 HIS CD2 C -8.251 2.950 1.047 1.00 . A A . 8 HIS CD2 1 1 10 1452 1 1 8 HIS CE1 C -9.365 1.270 0.191 1.00 . A A . 8 HIS CE1 1 1 10 1453 1 1 8 HIS CG C -7.659 1.789 1.446 1.00 . A A . 8 HIS CG 1 1 10 1454 1 1 8 HIS H H -4.071 0.775 3.349 1.00 . A A . 8 HIS H 1 1 10 1455 1 1 8 HIS HA H -5.698 0.125 0.931 1.00 . A A . 8 HIS HA 1 1 10 1456 1 1 8 HIS HB2 H -6.747 0.950 3.164 1.00 . A A . 8 HIS HB2 1 1 10 1457 1 1 8 HIS HB3 H -6.115 2.538 2.694 1.00 . A A . 8 HIS HB3 1 1 10 1458 1 1 8 HIS HD2 H -7.937 3.951 1.303 1.00 . A A . 8 HIS HD2 1 1 10 1459 1 1 8 HIS HE1 H -10.100 0.701 -0.359 1.00 . A A . 8 HIS HE1 1 1 10 1460 1 1 8 HIS HE2 H -9.970 3.242 -0.200 1.00 . A A . 8 HIS HE2 1 1 10 1461 1 1 8 HIS N N -4.402 0.248 2.553 1.00 . A A . 8 HIS N 1 1 10 1462 1 1 8 HIS ND1 N -8.376 0.740 0.895 1.00 . A A . 8 HIS ND1 1 1 10 1463 1 1 8 HIS NE2 N -9.329 2.604 0.251 1.00 . A A . 8 HIS NE2 1 1 10 1464 1 1 8 HIS O O -4.798 3.112 0.825 1.00 . A A . 8 HIS O 1 1 10 1465 1 1 9 LEU C C -3.693 3.126 -1.827 1.00 . A A . 9 LEU C 1 1 10 1466 1 1 9 LEU CA C -2.798 2.298 -0.912 1.00 . A A . 9 LEU CA 1 1 10 1467 1 1 9 LEU CB C -1.821 1.469 -1.748 1.00 . A A . 9 LEU CB 1 1 10 1468 1 1 9 LEU CD1 C 0.021 -0.231 -1.786 1.00 . A A . 9 LEU CD1 1 1 10 1469 1 1 9 LEU CD2 C 0.418 2.016 -0.760 1.00 . A A . 9 LEU CD2 1 1 10 1470 1 1 9 LEU CG C -0.605 0.915 -1.005 1.00 . A A . 9 LEU CG 1 1 10 1471 1 1 9 LEU H H -3.425 0.431 -0.069 1.00 . A A . 9 LEU H 1 1 10 1472 1 1 9 LEU HA H -2.225 2.977 -0.281 1.00 . A A . 9 LEU HA 1 1 10 1473 1 1 9 LEU HB2 H -2.367 0.632 -2.183 1.00 . A A . 9 LEU HB2 1 1 10 1474 1 1 9 LEU HB3 H -1.458 2.100 -2.558 1.00 . A A . 9 LEU HB3 1 1 10 1475 1 1 9 LEU HD11 H -0.724 -1.009 -1.951 1.00 . A A . 9 LEU HD11 1 1 10 1476 1 1 9 LEU HD12 H 0.380 0.138 -2.746 1.00 . A A . 9 LEU HD12 1 1 10 1477 1 1 9 LEU HD13 H 0.857 -0.643 -1.219 1.00 . A A . 9 LEU HD13 1 1 10 1478 1 1 9 LEU HD21 H -0.048 2.827 -0.200 1.00 . A A . 9 LEU HD21 1 1 10 1479 1 1 9 LEU HD22 H 1.254 1.615 -0.189 1.00 . A A . 9 LEU HD22 1 1 10 1480 1 1 9 LEU HD23 H 0.779 2.395 -1.716 1.00 . A A . 9 LEU HD23 1 1 10 1481 1 1 9 LEU HG H -0.936 0.532 -0.039 1.00 . A A . 9 LEU HG 1 1 10 1482 1 1 9 LEU N N -3.594 1.427 -0.053 1.00 . A A . 9 LEU N 1 1 10 1483 1 1 9 LEU O O -4.510 2.583 -2.569 1.00 . A A . 9 LEU O 1 1 10 1484 1 1 10 MET C C -3.929 5.225 -4.066 1.00 . A A . 10 MET C 1 1 10 1485 1 1 10 MET CA C -4.322 5.347 -2.598 1.00 . A A . 10 MET CA 1 1 10 1486 1 1 10 MET CB C -4.143 6.792 -2.129 1.00 . A A . 10 MET CB 1 1 10 1487 1 1 10 MET CE C -7.480 9.007 -1.498 1.00 . A A . 10 MET CE 1 1 10 1488 1 1 10 MET CG C -5.271 7.716 -2.560 1.00 . A A . 10 MET CG 1 1 10 1489 1 1 10 MET H H -2.843 4.829 -1.138 1.00 . A A . 10 MET H 1 1 10 1490 1 1 10 MET HA H -5.374 5.078 -2.497 1.00 . A A . 10 MET HA 1 1 10 1491 1 1 10 MET HB2 H -4.090 6.797 -1.040 1.00 . A A . 10 MET HB2 1 1 10 1492 1 1 10 MET HB3 H -3.203 7.176 -2.527 1.00 . A A . 10 MET HB3 1 1 10 1493 1 1 10 MET HE1 H -8.443 8.951 -0.990 1.00 . A A . 10 MET HE1 1 1 10 1494 1 1 10 MET HE2 H -7.610 9.481 -2.470 1.00 . A A . 10 MET HE2 1 1 10 1495 1 1 10 MET HE3 H -6.787 9.595 -0.896 1.00 . A A . 10 MET HE3 1 1 10 1496 1 1 10 MET HG2 H -4.985 8.743 -2.337 1.00 . A A . 10 MET HG2 1 1 10 1497 1 1 10 MET HG3 H -5.418 7.615 -3.636 1.00 . A A . 10 MET HG3 1 1 10 1498 1 1 10 MET N N -3.531 4.444 -1.770 1.00 . A A . 10 MET N 1 1 10 1499 1 1 10 MET O O -4.596 5.772 -4.946 1.00 . A A . 10 MET O 1 1 10 1500 1 1 10 MET SD S -6.825 7.355 -1.722 1.00 . A A . 10 MET SD 1 1 11 1501 1 1 1 GLY C C 10.700 -0.230 3.351 1.00 . A A . 1 GLY C 1 1 11 1502 1 1 1 GLY CA C 11.083 0.060 1.913 1.00 . A A . 1 GLY CA 1 1 11 1503 1 1 1 GLY H1 H 12.636 -0.171 0.632 1.00 . A A . 1 GLY H1 1 1 11 1504 1 1 1 GLY H2 H 12.494 -1.383 1.741 1.00 . A A . 1 GLY H2 1 1 11 1505 1 1 1 GLY H3 H 13.089 0.086 2.196 1.00 . A A . 1 GLY H3 1 1 11 1506 1 1 1 GLY HA2 H 11.023 1.136 1.746 1.00 . A A . 1 GLY HA2 1 1 11 1507 1 1 1 GLY HA3 H 10.378 -0.441 1.251 1.00 . A A . 1 GLY HA3 1 1 11 1508 1 1 1 GLY N N 12.428 -0.386 1.597 1.00 . A A . 1 GLY N 1 1 11 1509 1 1 1 GLY O O 10.571 -1.388 3.744 1.00 . A A . 1 GLY O 1 1 11 1510 1 1 2 ASN C C 8.826 -0.062 5.682 1.00 . A A . 2 ASN C 1 1 11 1511 1 1 2 ASN CA C 10.152 0.679 5.542 1.00 . A A . 2 ASN CA 1 1 11 1512 1 1 2 ASN CB C 10.054 2.052 6.211 1.00 . A A . 2 ASN CB 1 1 11 1513 1 1 2 ASN CG C 8.973 2.920 5.596 1.00 . A A . 2 ASN CG 1 1 11 1514 1 1 2 ASN H H 10.639 1.753 3.755 1.00 . A A . 2 ASN H 1 1 11 1515 1 1 2 ASN HA H 10.927 0.102 6.045 1.00 . A A . 2 ASN HA 1 1 11 1516 1 1 2 ASN HB2 H 9.837 1.916 7.271 1.00 . A A . 2 ASN HB2 1 1 11 1517 1 1 2 ASN HB3 H 11.012 2.561 6.108 1.00 . A A . 2 ASN HB3 1 1 11 1518 1 1 2 ASN HD21 H 7.998 3.023 7.373 1.00 . A A . 2 ASN HD21 1 1 11 1519 1 1 2 ASN HD22 H 7.247 3.887 6.050 1.00 . A A . 2 ASN HD22 1 1 11 1520 1 1 2 ASN N N 10.519 0.826 4.138 1.00 . A A . 2 ASN N 1 1 11 1521 1 1 2 ASN ND2 N 7.995 3.308 6.404 1.00 . A A . 2 ASN ND2 1 1 11 1522 1 1 2 ASN O O 8.586 -0.744 6.678 1.00 . A A . 2 ASN O 1 1 11 1523 1 1 2 ASN OD1 O 9.019 3.238 4.407 1.00 . A A . 2 ASN OD1 1 1 11 1524 1 1 3 HIS C C 6.215 -0.913 3.265 1.00 . A A . 3 HIS C 1 1 11 1525 1 1 3 HIS CA C 6.666 -0.581 4.685 1.00 . A A . 3 HIS CA 1 1 11 1526 1 1 3 HIS CB C 5.626 0.307 5.369 1.00 . A A . 3 HIS CB 1 1 11 1527 1 1 3 HIS CD2 C 5.512 -0.825 7.703 1.00 . A A . 3 HIS CD2 1 1 11 1528 1 1 3 HIS CE1 C 5.859 0.962 8.920 1.00 . A A . 3 HIS CE1 1 1 11 1529 1 1 3 HIS CG C 5.666 0.243 6.871 1.00 . A A . 3 HIS CG 1 1 11 1530 1 1 3 HIS H H 8.222 0.652 3.887 1.00 . A A . 3 HIS H 1 1 11 1531 1 1 3 HIS HA H 6.752 -1.511 5.248 1.00 . A A . 3 HIS HA 1 1 11 1532 1 1 3 HIS HB2 H 5.801 1.338 5.064 1.00 . A A . 3 HIS HB2 1 1 11 1533 1 1 3 HIS HB3 H 4.634 0.006 5.032 1.00 . A A . 3 HIS HB3 1 1 11 1534 1 1 3 HIS HD2 H 5.327 -1.847 7.408 1.00 . A A . 3 HIS HD2 1 1 11 1535 1 1 3 HIS HE1 H 6.000 1.612 9.771 1.00 . A A . 3 HIS HE1 1 1 11 1536 1 1 3 HIS HE2 H 5.572 -0.901 9.845 1.00 . A A . 3 HIS HE2 1 1 11 1537 1 1 3 HIS N N 7.967 0.077 4.676 1.00 . A A . 3 HIS N 1 1 11 1538 1 1 3 HIS ND1 N 5.884 1.362 7.656 1.00 . A A . 3 HIS ND1 1 1 11 1539 1 1 3 HIS NE2 N 5.637 -0.353 8.998 1.00 . A A . 3 HIS NE2 1 1 11 1540 1 1 3 HIS O O 6.054 -0.024 2.431 1.00 . A A . 3 HIS O 1 1 11 1541 1 1 4 TRP C C 4.146 -2.210 1.400 1.00 . A A . 4 TRP C 1 1 11 1542 1 1 4 TRP CA C 5.580 -2.648 1.683 1.00 . A A . 4 TRP CA 1 1 11 1543 1 1 4 TRP CB C 5.690 -4.170 1.578 1.00 . A A . 4 TRP CB 1 1 11 1544 1 1 4 TRP CD1 C 7.867 -5.463 1.181 1.00 . A A . 4 TRP CD1 1 1 11 1545 1 1 4 TRP CD2 C 7.171 -4.269 -0.581 1.00 . A A . 4 TRP CD2 1 1 11 1546 1 1 4 TRP CE2 C 8.368 -4.926 -0.928 1.00 . A A . 4 TRP CE2 1 1 11 1547 1 1 4 TRP CE3 C 6.547 -3.459 -1.534 1.00 . A A . 4 TRP CE3 1 1 11 1548 1 1 4 TRP CG C 6.870 -4.626 0.772 1.00 . A A . 4 TRP CG 1 1 11 1549 1 1 4 TRP CH2 C 8.317 -3.996 -3.099 1.00 . A A . 4 TRP CH2 1 1 11 1550 1 1 4 TRP CZ2 C 8.950 -4.797 -2.186 1.00 . A A . 4 TRP CZ2 1 1 11 1551 1 1 4 TRP CZ3 C 7.126 -3.331 -2.782 1.00 . A A . 4 TRP CZ3 1 1 11 1552 1 1 4 TRP H H 6.160 -2.882 3.730 1.00 . A A . 4 TRP H 1 1 11 1553 1 1 4 TRP HA H 6.233 -2.201 0.933 1.00 . A A . 4 TRP HA 1 1 11 1554 1 1 4 TRP HB2 H 5.780 -4.580 2.584 1.00 . A A . 4 TRP HB2 1 1 11 1555 1 1 4 TRP HB3 H 4.780 -4.558 1.120 1.00 . A A . 4 TRP HB3 1 1 11 1556 1 1 4 TRP HD1 H 7.935 -5.913 2.161 1.00 . A A . 4 TRP HD1 1 1 11 1557 1 1 4 TRP HE1 H 9.602 -6.224 0.213 1.00 . A A . 4 TRP HE1 1 1 11 1558 1 1 4 TRP HE3 H 5.628 -2.942 -1.298 1.00 . A A . 4 TRP HE3 1 1 11 1559 1 1 4 TRP HH2 H 8.745 -3.876 -4.084 1.00 . A A . 4 TRP HH2 1 1 11 1560 1 1 4 TRP HZ2 H 9.868 -5.310 -2.433 1.00 . A A . 4 TRP HZ2 1 1 11 1561 1 1 4 TRP HZ3 H 6.652 -2.706 -3.525 1.00 . A A . 4 TRP HZ3 1 1 11 1562 1 1 4 TRP N N 6.012 -2.199 3.001 1.00 . A A . 4 TRP N 1 1 11 1563 1 1 4 TRP NE1 N 8.773 -5.649 0.164 1.00 . A A . 4 TRP NE1 1 1 11 1564 1 1 4 TRP O O 3.908 -1.348 0.556 1.00 . A A . 4 TRP O 1 1 11 1565 1 1 5 ALA C C 1.161 -2.045 3.260 1.00 . A A . 5 ALA C 1 1 11 1566 1 1 5 ALA CA C 1.789 -2.478 1.940 1.00 . A A . 5 ALA CA 1 1 11 1567 1 1 5 ALA CB C 1.036 -3.666 1.359 1.00 . A A . 5 ALA CB 1 1 11 1568 1 1 5 ALA H H 3.460 -3.512 2.789 1.00 . A A . 5 ALA H 1 1 11 1569 1 1 5 ALA HA H 1.716 -1.649 1.237 1.00 . A A . 5 ALA HA 1 1 11 1570 1 1 5 ALA HB1 H -0.015 -3.406 1.235 1.00 . A A . 5 ALA HB1 1 1 11 1571 1 1 5 ALA HB2 H 1.122 -4.517 2.035 1.00 . A A . 5 ALA HB2 1 1 11 1572 1 1 5 ALA HB3 H 1.462 -3.928 0.390 1.00 . A A . 5 ALA HB3 1 1 11 1573 1 1 5 ALA N N 3.198 -2.810 2.112 1.00 . A A . 5 ALA N 1 1 11 1574 1 1 5 ALA O O 0.666 -2.875 4.025 1.00 . A A . 5 ALA O 1 1 11 1575 1 1 6 VAL C C -0.823 -0.661 4.940 1.00 . A A . 6 VAL C 1 1 11 1576 1 1 6 VAL CA C 0.615 -0.199 4.751 1.00 . A A . 6 VAL CA 1 1 11 1577 1 1 6 VAL CB C 0.656 1.338 4.754 1.00 . A A . 6 VAL CB 1 1 11 1578 1 1 6 VAL CG1 C 0.031 1.888 6.029 1.00 . A A . 6 VAL CG1 1 1 11 1579 1 1 6 VAL CG2 C 2.084 1.836 4.596 1.00 . A A . 6 VAL CG2 1 1 11 1580 1 1 6 VAL H H 1.606 -0.113 2.854 1.00 . A A . 6 VAL H 1 1 11 1581 1 1 6 VAL HA H 1.206 -0.560 5.592 1.00 . A A . 6 VAL HA 1 1 11 1582 1 1 6 VAL HB H 0.074 1.697 3.905 1.00 . A A . 6 VAL HB 1 1 11 1583 1 1 6 VAL HG11 H -0.991 1.519 6.121 1.00 . A A . 6 VAL HG11 1 1 11 1584 1 1 6 VAL HG12 H 0.021 2.977 5.988 1.00 . A A . 6 VAL HG12 1 1 11 1585 1 1 6 VAL HG13 H 0.614 1.561 6.890 1.00 . A A . 6 VAL HG13 1 1 11 1586 1 1 6 VAL HG21 H 2.512 1.431 3.679 1.00 . A A . 6 VAL HG21 1 1 11 1587 1 1 6 VAL HG22 H 2.086 2.925 4.548 1.00 . A A . 6 VAL HG22 1 1 11 1588 1 1 6 VAL HG23 H 2.679 1.509 5.449 1.00 . A A . 6 VAL HG23 1 1 11 1589 1 1 6 VAL N N 1.184 -0.743 3.522 1.00 . A A . 6 VAL N 1 1 11 1590 1 1 6 VAL O O -1.248 -0.963 6.056 1.00 . A A . 6 VAL O 1 1 11 1591 1 1 7 GLY C C -3.629 -1.149 2.551 1.00 . A A . 7 GLY C 1 1 11 1592 1 1 7 GLY CA C -2.958 -1.140 3.910 1.00 . A A . 7 GLY CA 1 1 11 1593 1 1 7 GLY H H -1.172 -0.455 2.953 1.00 . A A . 7 GLY H 1 1 11 1594 1 1 7 GLY HA2 H -2.995 -2.147 4.324 1.00 . A A . 7 GLY HA2 1 1 11 1595 1 1 7 GLY HA3 H -3.504 -0.466 4.569 1.00 . A A . 7 GLY HA3 1 1 11 1596 1 1 7 GLY N N -1.572 -0.714 3.843 1.00 . A A . 7 GLY N 1 1 11 1597 1 1 7 GLY O O -3.380 -2.035 1.734 1.00 . A A . 7 GLY O 1 1 11 1598 1 1 8 HIS C C -4.594 1.043 0.167 1.00 . A A . 8 HIS C 1 1 11 1599 1 1 8 HIS CA C -5.193 -0.058 1.037 1.00 . A A . 8 HIS CA 1 1 11 1600 1 1 8 HIS CB C -6.677 0.219 1.280 1.00 . A A . 8 HIS CB 1 1 11 1601 1 1 8 HIS CD2 C -7.862 -0.361 3.518 1.00 . A A . 8 HIS CD2 1 1 11 1602 1 1 8 HIS CE1 C -7.940 -2.533 3.262 1.00 . A A . 8 HIS CE1 1 1 11 1603 1 1 8 HIS CG C -7.289 -0.678 2.323 1.00 . A A . 8 HIS CG 1 1 11 1604 1 1 8 HIS H H -4.644 0.539 3.019 1.00 . A A . 8 HIS H 1 1 11 1605 1 1 8 HIS HA H -5.099 -1.007 0.509 1.00 . A A . 8 HIS HA 1 1 11 1606 1 1 8 HIS HB2 H -6.795 1.255 1.596 1.00 . A A . 8 HIS HB2 1 1 11 1607 1 1 8 HIS HB3 H -7.214 0.074 0.343 1.00 . A A . 8 HIS HB3 1 1 11 1608 1 1 8 HIS HD2 H -7.977 0.629 3.933 1.00 . A A . 8 HIS HD2 1 1 11 1609 1 1 8 HIS HE1 H -8.131 -3.581 3.443 1.00 . A A . 8 HIS HE1 1 1 11 1610 1 1 8 HIS HE2 H -8.730 -1.652 4.991 1.00 . A A . 8 HIS HE2 1 1 11 1611 1 1 8 HIS N N -4.483 -0.160 2.308 1.00 . A A . 8 HIS N 1 1 11 1612 1 1 8 HIS ND1 N -7.347 -2.054 2.178 1.00 . A A . 8 HIS ND1 1 1 11 1613 1 1 8 HIS NE2 N -8.269 -1.549 4.098 1.00 . A A . 8 HIS NE2 1 1 11 1614 1 1 8 HIS O O -5.121 2.155 0.105 1.00 . A A . 8 HIS O 1 1 11 1615 1 1 9 LEU C C -3.763 2.198 -2.453 1.00 . A A . 9 LEU C 1 1 11 1616 1 1 9 LEU CA C -2.820 1.690 -1.368 1.00 . A A . 9 LEU CA 1 1 11 1617 1 1 9 LEU CB C -1.583 1.055 -2.008 1.00 . A A . 9 LEU CB 1 1 11 1618 1 1 9 LEU CD1 C -0.525 -0.240 -3.874 1.00 . A A . 9 LEU CD1 1 1 11 1619 1 1 9 LEU CD2 C -2.648 -1.058 -2.834 1.00 . A A . 9 LEU CD2 1 1 11 1620 1 1 9 LEU CG C -1.838 0.169 -3.228 1.00 . A A . 9 LEU CG 1 1 11 1621 1 1 9 LEU H H -3.106 -0.201 -0.409 1.00 . A A . 9 LEU H 1 1 11 1622 1 1 9 LEU HA H -2.500 2.538 -0.763 1.00 . A A . 9 LEU HA 1 1 11 1623 1 1 9 LEU HB2 H -0.916 1.861 -2.315 1.00 . A A . 9 LEU HB2 1 1 11 1624 1 1 9 LEU HB3 H -1.074 0.459 -1.251 1.00 . A A . 9 LEU HB3 1 1 11 1625 1 1 9 LEU HD11 H 0.039 0.652 -4.148 1.00 . A A . 9 LEU HD11 1 1 11 1626 1 1 9 LEU HD12 H -0.728 -0.830 -4.767 1.00 . A A . 9 LEU HD12 1 1 11 1627 1 1 9 LEU HD13 H 0.057 -0.835 -3.170 1.00 . A A . 9 LEU HD13 1 1 11 1628 1 1 9 LEU HD21 H -2.486 -1.851 -3.565 1.00 . A A . 9 LEU HD21 1 1 11 1629 1 1 9 LEU HD22 H -2.331 -1.401 -1.850 1.00 . A A . 9 LEU HD22 1 1 11 1630 1 1 9 LEU HD23 H -3.707 -0.801 -2.806 1.00 . A A . 9 LEU HD23 1 1 11 1631 1 1 9 LEU HG H -2.415 0.742 -3.955 1.00 . A A . 9 LEU HG 1 1 11 1632 1 1 9 LEU N N -3.490 0.728 -0.502 1.00 . A A . 9 LEU N 1 1 11 1633 1 1 9 LEU O O -4.817 1.609 -2.699 1.00 . A A . 9 LEU O 1 1 11 1634 1 1 10 MET C C -4.002 3.115 -5.472 1.00 . A A . 10 MET C 1 1 11 1635 1 1 10 MET CA C -4.190 3.876 -4.164 1.00 . A A . 10 MET CA 1 1 11 1636 1 1 10 MET CB C -3.827 5.349 -4.361 1.00 . A A . 10 MET CB 1 1 11 1637 1 1 10 MET CE C -4.684 8.563 -6.517 1.00 . A A . 10 MET CE 1 1 11 1638 1 1 10 MET CG C -4.803 6.101 -5.250 1.00 . A A . 10 MET CG 1 1 11 1639 1 1 10 MET H H -2.503 3.729 -2.853 1.00 . A A . 10 MET H 1 1 11 1640 1 1 10 MET HA H -5.239 3.813 -3.873 1.00 . A A . 10 MET HA 1 1 11 1641 1 1 10 MET HB2 H -3.807 5.833 -3.384 1.00 . A A . 10 MET HB2 1 1 11 1642 1 1 10 MET HB3 H -2.832 5.409 -4.802 1.00 . A A . 10 MET HB3 1 1 11 1643 1 1 10 MET HE1 H -4.703 9.651 -6.453 1.00 . A A . 10 MET HE1 1 1 11 1644 1 1 10 MET HE2 H -3.735 8.241 -6.947 1.00 . A A . 10 MET HE2 1 1 11 1645 1 1 10 MET HE3 H -5.504 8.222 -7.150 1.00 . A A . 10 MET HE3 1 1 11 1646 1 1 10 MET HG2 H -4.498 5.974 -6.289 1.00 . A A . 10 MET HG2 1 1 11 1647 1 1 10 MET HG3 H -5.799 5.677 -5.120 1.00 . A A . 10 MET HG3 1 1 11 1648 1 1 10 MET N N -3.378 3.292 -3.102 1.00 . A A . 10 MET N 1 1 11 1649 1 1 10 MET O O -3.130 3.448 -6.276 1.00 . A A . 10 MET O 1 1 11 1650 1 1 10 MET SD S -4.864 7.864 -4.878 1.00 . A A . 10 MET SD 1 1 12 1651 1 1 1 GLY C C 10.657 3.865 4.291 1.00 . A A . 1 GLY C 1 1 12 1652 1 1 1 GLY CA C 11.088 4.539 5.578 1.00 . A A . 1 GLY CA 1 1 12 1653 1 1 1 GLY H1 H 12.611 5.641 6.333 1.00 . A A . 1 GLY H1 1 1 12 1654 1 1 1 GLY H2 H 12.309 5.918 4.735 1.00 . A A . 1 GLY H2 1 1 12 1655 1 1 1 GLY H3 H 13.078 4.536 5.202 1.00 . A A . 1 GLY H3 1 1 12 1656 1 1 1 GLY HA2 H 11.164 3.783 6.360 1.00 . A A . 1 GLY HA2 1 1 12 1657 1 1 1 GLY HA3 H 10.332 5.270 5.865 1.00 . A A . 1 GLY HA3 1 1 12 1658 1 1 1 GLY N N 12.369 5.209 5.453 1.00 . A A . 1 GLY N 1 1 12 1659 1 1 1 GLY O O 10.378 4.533 3.297 1.00 . A A . 1 GLY O 1 1 12 1660 1 1 2 ASN C C 9.050 0.835 3.459 1.00 . A A . 2 ASN C 1 1 12 1661 1 1 2 ASN CA C 10.208 1.773 3.132 1.00 . A A . 2 ASN CA 1 1 12 1662 1 1 2 ASN CB C 11.394 0.969 2.595 1.00 . A A . 2 ASN CB 1 1 12 1663 1 1 2 ASN CG C 11.232 0.606 1.132 1.00 . A A . 2 ASN CG 1 1 12 1664 1 1 2 ASN H H 10.845 2.047 5.158 1.00 . A A . 2 ASN H 1 1 12 1665 1 1 2 ASN HA H 9.882 2.469 2.359 1.00 . A A . 2 ASN HA 1 1 12 1666 1 1 2 ASN HB2 H 12.300 1.564 2.710 1.00 . A A . 2 ASN HB2 1 1 12 1667 1 1 2 ASN HB3 H 11.495 0.054 3.179 1.00 . A A . 2 ASN HB3 1 1 12 1668 1 1 2 ASN HD21 H 13.066 1.365 0.705 1.00 . A A . 2 ASN HD21 1 1 12 1669 1 1 2 ASN HD22 H 12.193 0.694 -0.654 1.00 . A A . 2 ASN HD22 1 1 12 1670 1 1 2 ASN N N 10.605 2.538 4.309 1.00 . A A . 2 ASN N 1 1 12 1671 1 1 2 ASN ND2 N 12.244 0.913 0.331 1.00 . A A . 2 ASN ND2 1 1 12 1672 1 1 2 ASN O O 9.249 -0.360 3.686 1.00 . A A . 2 ASN O 1 1 12 1673 1 1 2 ASN OD1 O 10.209 0.054 0.729 1.00 . A A . 2 ASN OD1 1 1 12 1674 1 1 3 HIS C C 6.444 -0.498 2.734 1.00 . A A . 3 HIS C 1 1 12 1675 1 1 3 HIS CA C 6.649 0.594 3.780 1.00 . A A . 3 HIS CA 1 1 12 1676 1 1 3 HIS CB C 5.417 1.498 3.839 1.00 . A A . 3 HIS CB 1 1 12 1677 1 1 3 HIS CD2 C 5.963 3.822 4.864 1.00 . A A . 3 HIS CD2 1 1 12 1678 1 1 3 HIS CE1 C 5.254 3.428 6.896 1.00 . A A . 3 HIS CE1 1 1 12 1679 1 1 3 HIS CG C 5.490 2.544 4.918 1.00 . A A . 3 HIS CG 1 1 12 1680 1 1 3 HIS H H 7.740 2.369 3.288 1.00 . A A . 3 HIS H 1 1 12 1681 1 1 3 HIS HA H 6.780 0.122 4.754 1.00 . A A . 3 HIS HA 1 1 12 1682 1 1 3 HIS HB2 H 5.312 2.001 2.878 1.00 . A A . 3 HIS HB2 1 1 12 1683 1 1 3 HIS HB3 H 4.535 0.880 4.009 1.00 . A A . 3 HIS HB3 1 1 12 1684 1 1 3 HIS HD2 H 6.381 4.315 3.999 1.00 . A A . 3 HIS HD2 1 1 12 1685 1 1 3 HIS HE1 H 5.009 3.558 7.940 1.00 . A A . 3 HIS HE1 1 1 12 1686 1 1 3 HIS HE2 H 6.061 5.300 6.411 1.00 . A A . 3 HIS HE2 1 1 12 1687 1 1 3 HIS N N 7.839 1.383 3.482 1.00 . A A . 3 HIS N 1 1 12 1688 1 1 3 HIS ND1 N 5.047 2.313 6.209 1.00 . A A . 3 HIS ND1 1 1 12 1689 1 1 3 HIS NE2 N 5.805 4.366 6.126 1.00 . A A . 3 HIS NE2 1 1 12 1690 1 1 3 HIS O O 6.647 -0.273 1.540 1.00 . A A . 3 HIS O 1 1 12 1691 1 1 4 TRP C C 4.350 -2.861 1.855 1.00 . A A . 4 TRP C 1 1 12 1692 1 1 4 TRP CA C 5.811 -2.805 2.292 1.00 . A A . 4 TRP CA 1 1 12 1693 1 1 4 TRP CB C 6.203 -4.116 2.974 1.00 . A A . 4 TRP CB 1 1 12 1694 1 1 4 TRP CD1 C 8.408 -5.375 2.628 1.00 . A A . 4 TRP CD1 1 1 12 1695 1 1 4 TRP CD2 C 7.065 -5.359 0.835 1.00 . A A . 4 TRP CD2 1 1 12 1696 1 1 4 TRP CE2 C 8.234 -6.077 0.515 1.00 . A A . 4 TRP CE2 1 1 12 1697 1 1 4 TRP CE3 C 6.074 -5.217 -0.138 1.00 . A A . 4 TRP CE3 1 1 12 1698 1 1 4 TRP CG C 7.197 -4.919 2.191 1.00 . A A . 4 TRP CG 1 1 12 1699 1 1 4 TRP CH2 C 7.448 -6.496 -1.673 1.00 . A A . 4 TRP CH2 1 1 12 1700 1 1 4 TRP CZ2 C 8.436 -6.650 -0.738 1.00 . A A . 4 TRP CZ2 1 1 12 1701 1 1 4 TRP CZ3 C 6.275 -5.787 -1.383 1.00 . A A . 4 TRP CZ3 1 1 12 1702 1 1 4 TRP H H 5.893 -1.799 4.180 1.00 . A A . 4 TRP H 1 1 12 1703 1 1 4 TRP HA H 6.433 -2.676 1.406 1.00 . A A . 4 TRP HA 1 1 12 1704 1 1 4 TRP HB2 H 6.636 -3.884 3.947 1.00 . A A . 4 TRP HB2 1 1 12 1705 1 1 4 TRP HB3 H 5.305 -4.717 3.123 1.00 . A A . 4 TRP HB3 1 1 12 1706 1 1 4 TRP HD1 H 8.812 -5.211 3.616 1.00 . A A . 4 TRP HD1 1 1 12 1707 1 1 4 TRP HE1 H 9.945 -6.511 1.694 1.00 . A A . 4 TRP HE1 1 1 12 1708 1 1 4 TRP HE3 H 5.166 -4.673 0.077 1.00 . A A . 4 TRP HE3 1 1 12 1709 1 1 4 TRP HH2 H 7.575 -6.929 -2.654 1.00 . A A . 4 TRP HH2 1 1 12 1710 1 1 4 TRP HZ2 H 9.340 -7.196 -0.964 1.00 . A A . 4 TRP HZ2 1 1 12 1711 1 1 4 TRP HZ3 H 5.516 -5.682 -2.143 1.00 . A A . 4 TRP HZ3 1 1 12 1712 1 1 4 TRP N N 6.042 -1.678 3.189 1.00 . A A . 4 TRP N 1 1 12 1713 1 1 4 TRP NE1 N 9.038 -6.073 1.625 1.00 . A A . 4 TRP NE1 1 1 12 1714 1 1 4 TRP O O 4.038 -2.685 0.677 1.00 . A A . 4 TRP O 1 1 12 1715 1 1 5 ALA C C 1.206 -2.807 3.746 1.00 . A A . 5 ALA C 1 1 12 1716 1 1 5 ALA CA C 2.033 -3.188 2.523 1.00 . A A . 5 ALA CA 1 1 12 1717 1 1 5 ALA CB C 1.666 -4.584 2.048 1.00 . A A . 5 ALA CB 1 1 12 1718 1 1 5 ALA H H 3.781 -3.248 3.757 1.00 . A A . 5 ALA H 1 1 12 1719 1 1 5 ALA HA H 1.806 -2.483 1.723 1.00 . A A . 5 ALA HA 1 1 12 1720 1 1 5 ALA HB1 H 0.597 -4.628 1.837 1.00 . A A . 5 ALA HB1 1 1 12 1721 1 1 5 ALA HB2 H 2.224 -4.818 1.141 1.00 . A A . 5 ALA HB2 1 1 12 1722 1 1 5 ALA HB3 H 1.913 -5.309 2.824 1.00 . A A . 5 ALA HB3 1 1 12 1723 1 1 5 ALA N N 3.461 -3.110 2.810 1.00 . A A . 5 ALA N 1 1 12 1724 1 1 5 ALA O O 1.112 -3.572 4.706 1.00 . A A . 5 ALA O 1 1 12 1725 1 1 6 VAL C C -1.682 -1.479 4.593 1.00 . A A . 6 VAL C 1 1 12 1726 1 1 6 VAL CA C -0.214 -1.140 4.811 1.00 . A A . 6 VAL CA 1 1 12 1727 1 1 6 VAL CB C -0.069 0.382 4.995 1.00 . A A . 6 VAL CB 1 1 12 1728 1 1 6 VAL CG1 C -0.419 1.110 3.706 1.00 . A A . 6 VAL CG1 1 1 12 1729 1 1 6 VAL CG2 C -0.944 0.865 6.141 1.00 . A A . 6 VAL CG2 1 1 12 1730 1 1 6 VAL H H 0.725 -1.038 2.890 1.00 . A A . 6 VAL H 1 1 12 1731 1 1 6 VAL HA H 0.120 -1.629 5.726 1.00 . A A . 6 VAL HA 1 1 12 1732 1 1 6 VAL HB H 0.970 0.601 5.242 1.00 . A A . 6 VAL HB 1 1 12 1733 1 1 6 VAL HG11 H 0.438 1.698 3.376 1.00 . A A . 6 VAL HG11 1 1 12 1734 1 1 6 VAL HG12 H -0.678 0.382 2.937 1.00 . A A . 6 VAL HG12 1 1 12 1735 1 1 6 VAL HG13 H -1.267 1.772 3.880 1.00 . A A . 6 VAL HG13 1 1 12 1736 1 1 6 VAL HG21 H -0.677 0.332 7.053 1.00 . A A . 6 VAL HG21 1 1 12 1737 1 1 6 VAL HG22 H -0.792 1.935 6.289 1.00 . A A . 6 VAL HG22 1 1 12 1738 1 1 6 VAL HG23 H -1.991 0.677 5.903 1.00 . A A . 6 VAL HG23 1 1 12 1739 1 1 6 VAL N N 0.608 -1.621 3.707 1.00 . A A . 6 VAL N 1 1 12 1740 1 1 6 VAL O O -2.444 -1.629 5.547 1.00 . A A . 6 VAL O 1 1 12 1741 1 1 7 GLY C C -4.171 -0.775 2.323 1.00 . A A . 7 GLY C 1 1 12 1742 1 1 7 GLY CA C -3.453 -1.922 3.006 1.00 . A A . 7 GLY CA 1 1 12 1743 1 1 7 GLY H H -1.406 -1.467 2.584 1.00 . A A . 7 GLY H 1 1 12 1744 1 1 7 GLY HA2 H -3.464 -2.786 2.342 1.00 . A A . 7 GLY HA2 1 1 12 1745 1 1 7 GLY HA3 H -3.983 -2.174 3.925 1.00 . A A . 7 GLY HA3 1 1 12 1746 1 1 7 GLY N N -2.075 -1.600 3.329 1.00 . A A . 7 GLY N 1 1 12 1747 1 1 7 GLY O O -5.184 -0.979 1.653 1.00 . A A . 7 GLY O 1 1 12 1748 1 1 8 HIS C C -3.673 1.867 0.496 1.00 . A A . 8 HIS C 1 1 12 1749 1 1 8 HIS CA C -4.247 1.618 1.887 1.00 . A A . 8 HIS CA 1 1 12 1750 1 1 8 HIS CB C -4.014 2.844 2.773 1.00 . A A . 8 HIS CB 1 1 12 1751 1 1 8 HIS CD2 C -4.958 5.218 2.304 1.00 . A A . 8 HIS CD2 1 1 12 1752 1 1 8 HIS CE1 C -7.077 4.764 2.603 1.00 . A A . 8 HIS CE1 1 1 12 1753 1 1 8 HIS CG C -5.076 3.900 2.623 1.00 . A A . 8 HIS CG 1 1 12 1754 1 1 8 HIS H H -2.814 0.536 3.055 1.00 . A A . 8 HIS H 1 1 12 1755 1 1 8 HIS HA H -5.321 1.455 1.795 1.00 . A A . 8 HIS HA 1 1 12 1756 1 1 8 HIS HB2 H -3.994 2.520 3.813 1.00 . A A . 8 HIS HB2 1 1 12 1757 1 1 8 HIS HB3 H -3.047 3.281 2.522 1.00 . A A . 8 HIS HB3 1 1 12 1758 1 1 8 HIS HD2 H -4.040 5.749 2.097 1.00 . A A . 8 HIS HD2 1 1 12 1759 1 1 8 HIS HE1 H -8.149 4.874 2.675 1.00 . A A . 8 HIS HE1 1 1 12 1760 1 1 8 HIS HE2 H -6.482 6.709 2.095 1.00 . A A . 8 HIS HE2 1 1 12 1761 1 1 8 HIS N N -3.647 0.434 2.493 1.00 . A A . 8 HIS N 1 1 12 1762 1 1 8 HIS ND1 N -6.422 3.630 2.808 1.00 . A A . 8 HIS ND1 1 1 12 1763 1 1 8 HIS NE2 N -6.234 5.750 2.296 1.00 . A A . 8 HIS NE2 1 1 12 1764 1 1 8 HIS O O -3.125 2.936 0.221 1.00 . A A . 8 HIS O 1 1 12 1765 1 1 9 LEU C C -4.419 0.835 -2.756 1.00 . A A . 9 LEU C 1 1 12 1766 1 1 9 LEU CA C -3.291 0.985 -1.740 1.00 . A A . 9 LEU CA 1 1 12 1767 1 1 9 LEU CB C -2.219 -0.077 -1.995 1.00 . A A . 9 LEU CB 1 1 12 1768 1 1 9 LEU CD1 C -0.246 1.162 -2.921 1.00 . A A . 9 LEU CD1 1 1 12 1769 1 1 9 LEU CD2 C -0.724 -1.173 -3.683 1.00 . A A . 9 LEU CD2 1 1 12 1770 1 1 9 LEU CG C -1.335 0.144 -3.222 1.00 . A A . 9 LEU CG 1 1 12 1771 1 1 9 LEU H H -4.257 0.022 -0.089 1.00 . A A . 9 LEU H 1 1 12 1772 1 1 9 LEU HA H -2.841 1.970 -1.865 1.00 . A A . 9 LEU HA 1 1 12 1773 1 1 9 LEU HB2 H -1.571 -0.112 -1.119 1.00 . A A . 9 LEU HB2 1 1 12 1774 1 1 9 LEU HB3 H -2.712 -1.044 -2.097 1.00 . A A . 9 LEU HB3 1 1 12 1775 1 1 9 LEU HD11 H -0.701 2.096 -2.593 1.00 . A A . 9 LEU HD11 1 1 12 1776 1 1 9 LEU HD12 H 0.343 1.341 -3.821 1.00 . A A . 9 LEU HD12 1 1 12 1777 1 1 9 LEU HD13 H 0.403 0.778 -2.133 1.00 . A A . 9 LEU HD13 1 1 12 1778 1 1 9 LEU HD21 H -1.519 -1.888 -3.894 1.00 . A A . 9 LEU HD21 1 1 12 1779 1 1 9 LEU HD22 H -0.138 -1.004 -4.586 1.00 . A A . 9 LEU HD22 1 1 12 1780 1 1 9 LEU HD23 H -0.078 -1.568 -2.899 1.00 . A A . 9 LEU HD23 1 1 12 1781 1 1 9 LEU HG H -1.957 0.535 -4.028 1.00 . A A . 9 LEU HG 1 1 12 1782 1 1 9 LEU N N -3.799 0.875 -0.377 1.00 . A A . 9 LEU N 1 1 12 1783 1 1 9 LEU O O -5.178 -0.133 -2.717 1.00 . A A . 9 LEU O 1 1 12 1784 1 1 10 MET C C -4.960 2.025 -6.071 1.00 . A A . 10 MET C 1 1 12 1785 1 1 10 MET CA C -5.558 1.776 -4.690 1.00 . A A . 10 MET CA 1 1 12 1786 1 1 10 MET CB C -6.632 2.823 -4.391 1.00 . A A . 10 MET CB 1 1 12 1787 1 1 10 MET CE C -10.598 3.011 -5.668 1.00 . A A . 10 MET CE 1 1 12 1788 1 1 10 MET CG C -7.877 2.682 -5.251 1.00 . A A . 10 MET CG 1 1 12 1789 1 1 10 MET H H -3.870 2.571 -3.640 1.00 . A A . 10 MET H 1 1 12 1790 1 1 10 MET HA H -6.025 0.791 -4.688 1.00 . A A . 10 MET HA 1 1 12 1791 1 1 10 MET HB2 H -6.919 2.741 -3.342 1.00 . A A . 10 MET HB2 1 1 12 1792 1 1 10 MET HB3 H -6.206 3.812 -4.561 1.00 . A A . 10 MET HB3 1 1 12 1793 1 1 10 MET HE1 H -11.540 3.477 -5.379 1.00 . A A . 10 MET HE1 1 1 12 1794 1 1 10 MET HE2 H -10.358 3.284 -6.695 1.00 . A A . 10 MET HE2 1 1 12 1795 1 1 10 MET HE3 H -10.691 1.927 -5.593 1.00 . A A . 10 MET HE3 1 1 12 1796 1 1 10 MET HG2 H -7.660 3.071 -6.246 1.00 . A A . 10 MET HG2 1 1 12 1797 1 1 10 MET HG3 H -8.133 1.625 -5.333 1.00 . A A . 10 MET HG3 1 1 12 1798 1 1 10 MET N N -4.524 1.801 -3.663 1.00 . A A . 10 MET N 1 1 12 1799 1 1 10 MET O O -5.098 1.203 -6.978 1.00 . A A . 10 MET O 1 1 12 1800 1 1 10 MET SD S -9.292 3.575 -4.579 1.00 . A A . 10 MET SD 1 1 13 1801 1 1 1 GLY C C 10.879 0.371 7.555 1.00 . A A . 1 GLY C 1 1 13 1802 1 1 1 GLY CA C 11.715 -0.118 8.722 1.00 . A A . 1 GLY CA 1 1 13 1803 1 1 1 GLY H1 H 13.413 0.340 9.727 1.00 . A A . 1 GLY H1 1 1 13 1804 1 1 1 GLY H2 H 13.471 0.690 8.117 1.00 . A A . 1 GLY H2 1 1 13 1805 1 1 1 GLY H3 H 12.606 1.653 9.139 1.00 . A A . 1 GLY H3 1 1 13 1806 1 1 1 GLY HA2 H 12.031 -1.143 8.527 1.00 . A A . 1 GLY HA2 1 1 13 1807 1 1 1 GLY HA3 H 11.102 -0.102 9.623 1.00 . A A . 1 GLY HA3 1 1 13 1808 1 1 1 GLY N N 12.890 0.704 8.943 1.00 . A A . 1 GLY N 1 1 13 1809 1 1 1 GLY O O 10.236 1.417 7.639 1.00 . A A . 1 GLY O 1 1 13 1810 1 1 2 ASN C C 8.924 -0.948 5.094 1.00 . A A . 2 ASN C 1 1 13 1811 1 1 2 ASN CA C 10.125 -0.024 5.274 1.00 . A A . 2 ASN CA 1 1 13 1812 1 1 2 ASN CB C 11.018 -0.082 4.033 1.00 . A A . 2 ASN CB 1 1 13 1813 1 1 2 ASN CG C 12.124 0.954 4.068 1.00 . A A . 2 ASN CG 1 1 13 1814 1 1 2 ASN H H 11.433 -1.237 6.458 1.00 . A A . 2 ASN H 1 1 13 1815 1 1 2 ASN HA H 9.762 0.997 5.393 1.00 . A A . 2 ASN HA 1 1 13 1816 1 1 2 ASN HB2 H 11.468 -1.073 3.972 1.00 . A A . 2 ASN HB2 1 1 13 1817 1 1 2 ASN HB3 H 10.405 0.084 3.147 1.00 . A A . 2 ASN HB3 1 1 13 1818 1 1 2 ASN HD21 H 12.913 0.220 2.347 1.00 . A A . 2 ASN HD21 1 1 13 1819 1 1 2 ASN HD22 H 13.762 1.581 3.044 1.00 . A A . 2 ASN HD22 1 1 13 1820 1 1 2 ASN N N 10.886 -0.388 6.464 1.00 . A A . 2 ASN N 1 1 13 1821 1 1 2 ASN ND2 N 13.003 0.915 3.074 1.00 . A A . 2 ASN ND2 1 1 13 1822 1 1 2 ASN O O 9.068 -2.170 5.060 1.00 . A A . 2 ASN O 1 1 13 1823 1 1 2 ASN OD1 O 12.188 1.780 4.978 1.00 . A A . 2 ASN OD1 1 1 13 1824 1 1 3 HIS C C 6.033 -1.053 3.354 1.00 . A A . 3 HIS C 1 1 13 1825 1 1 3 HIS CA C 6.514 -1.124 4.800 1.00 . A A . 3 HIS CA 1 1 13 1826 1 1 3 HIS CB C 5.421 -0.610 5.740 1.00 . A A . 3 HIS CB 1 1 13 1827 1 1 3 HIS CD2 C 4.980 -1.838 7.984 1.00 . A A . 3 HIS CD2 1 1 13 1828 1 1 3 HIS CE1 C 6.598 -0.931 9.147 1.00 . A A . 3 HIS CE1 1 1 13 1829 1 1 3 HIS CG C 5.654 -0.968 7.183 1.00 . A A . 3 HIS CG 1 1 13 1830 1 1 3 HIS H H 7.690 0.654 5.014 1.00 . A A . 3 HIS H 1 1 13 1831 1 1 3 HIS HA H 6.720 -2.166 5.046 1.00 . A A . 3 HIS HA 1 1 13 1832 1 1 3 HIS HB2 H 5.377 0.476 5.656 1.00 . A A . 3 HIS HB2 1 1 13 1833 1 1 3 HIS HB3 H 4.463 -1.025 5.425 1.00 . A A . 3 HIS HB3 1 1 13 1834 1 1 3 HIS HD2 H 4.129 -2.442 7.703 1.00 . A A . 3 HIS HD2 1 1 13 1835 1 1 3 HIS HE1 H 7.263 -0.686 9.962 1.00 . A A . 3 HIS HE1 1 1 13 1836 1 1 3 HIS HE2 H 5.325 -2.339 10.040 1.00 . A A . 3 HIS HE2 1 1 13 1837 1 1 3 HIS N N 7.741 -0.354 4.978 1.00 . A A . 3 HIS N 1 1 13 1838 1 1 3 HIS ND1 N 6.673 -0.404 7.932 1.00 . A A . 3 HIS ND1 1 1 13 1839 1 1 3 HIS NE2 N 5.591 -1.804 9.226 1.00 . A A . 3 HIS NE2 1 1 13 1840 1 1 3 HIS O O 5.833 0.033 2.810 1.00 . A A . 3 HIS O 1 1 13 1841 1 1 4 TRP C C 3.975 -1.739 1.223 1.00 . A A . 4 TRP C 1 1 13 1842 1 1 4 TRP CA C 5.394 -2.284 1.356 1.00 . A A . 4 TRP CA 1 1 13 1843 1 1 4 TRP CB C 5.448 -3.726 0.849 1.00 . A A . 4 TRP CB 1 1 13 1844 1 1 4 TRP CD1 C 7.588 -4.930 0.113 1.00 . A A . 4 TRP CD1 1 1 13 1845 1 1 4 TRP CD2 C 6.913 -3.313 -1.284 1.00 . A A . 4 TRP CD2 1 1 13 1846 1 1 4 TRP CE2 C 8.090 -3.890 -1.799 1.00 . A A . 4 TRP CE2 1 1 13 1847 1 1 4 TRP CE3 C 6.304 -2.275 -1.994 1.00 . A A . 4 TRP CE3 1 1 13 1848 1 1 4 TRP CG C 6.609 -3.992 -0.061 1.00 . A A . 4 TRP CG 1 1 13 1849 1 1 4 TRP CH2 C 8.052 -2.444 -3.666 1.00 . A A . 4 TRP CH2 1 1 13 1850 1 1 4 TRP CZ2 C 8.669 -3.462 -2.991 1.00 . A A . 4 TRP CZ2 1 1 13 1851 1 1 4 TRP CZ3 C 6.881 -1.851 -3.177 1.00 . A A . 4 TRP CZ3 1 1 13 1852 1 1 4 TRP H H 6.033 -3.072 3.241 1.00 . A A . 4 TRP H 1 1 13 1853 1 1 4 TRP HA H 6.057 -1.675 0.741 1.00 . A A . 4 TRP HA 1 1 13 1854 1 1 4 TRP HB2 H 5.523 -4.392 1.709 1.00 . A A . 4 TRP HB2 1 1 13 1855 1 1 4 TRP HB3 H 4.524 -3.946 0.314 1.00 . A A . 4 TRP HB3 1 1 13 1856 1 1 4 TRP HD1 H 7.650 -5.614 0.946 1.00 . A A . 4 TRP HD1 1 1 13 1857 1 1 4 TRP HE1 H 9.298 -5.460 -1.036 1.00 . A A . 4 TRP HE1 1 1 13 1858 1 1 4 TRP HE3 H 5.400 -1.812 -1.626 1.00 . A A . 4 TRP HE3 1 1 13 1859 1 1 4 TRP HH2 H 8.476 -2.091 -4.594 1.00 . A A . 4 TRP HH2 1 1 13 1860 1 1 4 TRP HZ2 H 9.572 -3.917 -3.370 1.00 . A A . 4 TRP HZ2 1 1 13 1861 1 1 4 TRP HZ3 H 6.421 -1.048 -3.733 1.00 . A A . 4 TRP HZ3 1 1 13 1862 1 1 4 TRP N N 5.851 -2.215 2.739 1.00 . A A . 4 TRP N 1 1 13 1863 1 1 4 TRP NE1 N 8.483 -4.873 -0.929 1.00 . A A . 4 TRP NE1 1 1 13 1864 1 1 4 TRP O O 3.755 -0.702 0.598 1.00 . A A . 4 TRP O 1 1 13 1865 1 1 5 ALA C C 1.060 -1.815 3.166 1.00 . A A . 5 ALA C 1 1 13 1866 1 1 5 ALA CA C 1.621 -2.029 1.764 1.00 . A A . 5 ALA CA 1 1 13 1867 1 1 5 ALA CB C 0.790 -3.061 1.015 1.00 . A A . 5 ALA CB 1 1 13 1868 1 1 5 ALA H H 3.263 -3.288 2.313 1.00 . A A . 5 ALA H 1 1 13 1869 1 1 5 ALA HA H 1.564 -1.085 1.224 1.00 . A A . 5 ALA HA 1 1 13 1870 1 1 5 ALA HB1 H 0.861 -4.023 1.522 1.00 . A A . 5 ALA HB1 1 1 13 1871 1 1 5 ALA HB2 H -0.251 -2.739 0.989 1.00 . A A . 5 ALA HB2 1 1 13 1872 1 1 5 ALA HB3 H 1.166 -3.159 -0.004 1.00 . A A . 5 ALA HB3 1 1 13 1873 1 1 5 ALA N N 3.017 -2.444 1.815 1.00 . A A . 5 ALA N 1 1 13 1874 1 1 5 ALA O O 0.533 -2.742 3.783 1.00 . A A . 5 ALA O 1 1 13 1875 1 1 6 VAL C C -0.768 -0.683 5.164 1.00 . A A . 6 VAL C 1 1 13 1876 1 1 6 VAL CA C 0.683 -0.252 4.995 1.00 . A A . 6 VAL CA 1 1 13 1877 1 1 6 VAL CB C 0.797 1.258 5.269 1.00 . A A . 6 VAL CB 1 1 13 1878 1 1 6 VAL CG1 C 0.247 1.593 6.648 1.00 . A A . 6 VAL CG1 1 1 13 1879 1 1 6 VAL CG2 C 2.240 1.717 5.137 1.00 . A A . 6 VAL CG2 1 1 13 1880 1 1 6 VAL H H 1.624 0.128 3.108 1.00 . A A . 6 VAL H 1 1 13 1881 1 1 6 VAL HA H 1.287 -0.782 5.731 1.00 . A A . 6 VAL HA 1 1 13 1882 1 1 6 VAL HB H 0.201 1.787 4.525 1.00 . A A . 6 VAL HB 1 1 13 1883 1 1 6 VAL HG11 H -0.787 1.255 6.719 1.00 . A A . 6 VAL HG11 1 1 13 1884 1 1 6 VAL HG12 H 0.846 1.092 7.409 1.00 . A A . 6 VAL HG12 1 1 13 1885 1 1 6 VAL HG13 H 0.289 2.671 6.804 1.00 . A A . 6 VAL HG13 1 1 13 1886 1 1 6 VAL HG21 H 2.613 1.468 4.144 1.00 . A A . 6 VAL HG21 1 1 13 1887 1 1 6 VAL HG22 H 2.293 2.796 5.285 1.00 . A A . 6 VAL HG22 1 1 13 1888 1 1 6 VAL HG23 H 2.851 1.218 5.890 1.00 . A A . 6 VAL HG23 1 1 13 1889 1 1 6 VAL N N 1.179 -0.589 3.664 1.00 . A A . 6 VAL N 1 1 13 1890 1 1 6 VAL O O -1.144 -1.249 6.190 1.00 . A A . 6 VAL O 1 1 13 1891 1 1 7 GLY C C -3.537 -1.177 2.852 1.00 . A A . 7 GLY C 1 1 13 1892 1 1 7 GLY CA C -2.987 -0.776 4.206 1.00 . A A . 7 GLY CA 1 1 13 1893 1 1 7 GLY H H -1.223 0.057 3.330 1.00 . A A . 7 GLY H 1 1 13 1894 1 1 7 GLY HA2 H -3.108 -1.609 4.898 1.00 . A A . 7 GLY HA2 1 1 13 1895 1 1 7 GLY HA3 H -3.556 0.077 4.576 1.00 . A A . 7 GLY HA3 1 1 13 1896 1 1 7 GLY N N -1.584 -0.410 4.150 1.00 . A A . 7 GLY N 1 1 13 1897 1 1 7 GLY O O -3.361 -2.314 2.415 1.00 . A A . 7 GLY O 1 1 13 1898 1 1 8 HIS C C -3.920 0.097 -0.231 1.00 . A A . 8 HIS C 1 1 13 1899 1 1 8 HIS CA C -4.785 -0.503 0.873 1.00 . A A . 8 HIS CA 1 1 13 1900 1 1 8 HIS CB C -6.202 0.070 0.794 1.00 . A A . 8 HIS CB 1 1 13 1901 1 1 8 HIS CD2 C -7.739 0.425 2.858 1.00 . A A . 8 HIS CD2 1 1 13 1902 1 1 8 HIS CE1 C -8.129 -1.681 3.307 1.00 . A A . 8 HIS CE1 1 1 13 1903 1 1 8 HIS CG C -7.077 -0.342 1.947 1.00 . A A . 8 HIS CG 1 1 13 1904 1 1 8 HIS H H -4.317 0.675 2.599 1.00 . A A . 8 HIS H 1 1 13 1905 1 1 8 HIS HA H -4.838 -1.582 0.725 1.00 . A A . 8 HIS HA 1 1 13 1906 1 1 8 HIS HB2 H -6.135 1.158 0.783 1.00 . A A . 8 HIS HB2 1 1 13 1907 1 1 8 HIS HB3 H -6.665 -0.263 -0.135 1.00 . A A . 8 HIS HB3 1 1 13 1908 1 1 8 HIS HD2 H -7.747 1.504 2.904 1.00 . A A . 8 HIS HD2 1 1 13 1909 1 1 8 HIS HE1 H -8.506 -2.575 3.780 1.00 . A A . 8 HIS HE1 1 1 13 1910 1 1 8 HIS HE2 H -8.983 -0.179 4.494 1.00 . A A . 8 HIS HE2 1 1 13 1911 1 1 8 HIS N N -4.206 -0.240 2.186 1.00 . A A . 8 HIS N 1 1 13 1912 1 1 8 HIS ND1 N -7.334 -1.669 2.247 1.00 . A A . 8 HIS ND1 1 1 13 1913 1 1 8 HIS NE2 N -8.401 -0.440 3.711 1.00 . A A . 8 HIS NE2 1 1 13 1914 1 1 8 HIS O O -4.426 0.511 -1.276 1.00 . A A . 8 HIS O 1 1 13 1915 1 1 9 LEU C C -1.054 -0.417 -1.811 1.00 . A A . 9 LEU C 1 1 13 1916 1 1 9 LEU CA C -1.677 0.692 -0.969 1.00 . A A . 9 LEU CA 1 1 13 1917 1 1 9 LEU CB C -0.581 1.487 -0.259 1.00 . A A . 9 LEU CB 1 1 13 1918 1 1 9 LEU CD1 C 0.050 3.049 1.598 1.00 . A A . 9 LEU CD1 1 1 13 1919 1 1 9 LEU CD2 C -1.507 3.816 -0.204 1.00 . A A . 9 LEU CD2 1 1 13 1920 1 1 9 LEU CG C -1.054 2.632 0.638 1.00 . A A . 9 LEU CG 1 1 13 1921 1 1 9 LEU H H -2.259 -0.214 0.882 1.00 . A A . 9 LEU H 1 1 13 1922 1 1 9 LEU HA H -2.221 1.366 -1.631 1.00 . A A . 9 LEU HA 1 1 13 1923 1 1 9 LEU HB2 H -0.013 0.792 0.359 1.00 . A A . 9 LEU HB2 1 1 13 1924 1 1 9 LEU HB3 H 0.088 1.899 -1.015 1.00 . A A . 9 LEU HB3 1 1 13 1925 1 1 9 LEU HD11 H 0.361 2.189 2.191 1.00 . A A . 9 LEU HD11 1 1 13 1926 1 1 9 LEU HD12 H 0.902 3.426 1.031 1.00 . A A . 9 LEU HD12 1 1 13 1927 1 1 9 LEU HD13 H -0.321 3.832 2.260 1.00 . A A . 9 LEU HD13 1 1 13 1928 1 1 9 LEU HD21 H -2.296 3.498 -0.885 1.00 . A A . 9 LEU HD21 1 1 13 1929 1 1 9 LEU HD22 H -0.663 4.197 -0.779 1.00 . A A . 9 LEU HD22 1 1 13 1930 1 1 9 LEU HD23 H -1.885 4.602 0.450 1.00 . A A . 9 LEU HD23 1 1 13 1931 1 1 9 LEU HG H -1.904 2.281 1.223 1.00 . A A . 9 LEU HG 1 1 13 1932 1 1 9 LEU N N -2.613 0.142 0.006 1.00 . A A . 9 LEU N 1 1 13 1933 1 1 9 LEU O O -0.295 -1.242 -1.305 1.00 . A A . 9 LEU O 1 1 13 1934 1 1 10 MET C C 0.669 -1.322 -4.121 1.00 . A A . 10 MET C 1 1 13 1935 1 1 10 MET CA C -0.849 -1.433 -4.013 1.00 . A A . 10 MET CA 1 1 13 1936 1 1 10 MET CB C -1.482 -1.282 -5.397 1.00 . A A . 10 MET CB 1 1 13 1937 1 1 10 MET CE C -2.308 -4.864 -7.327 1.00 . A A . 10 MET CE 1 1 13 1938 1 1 10 MET CG C -1.302 -2.502 -6.285 1.00 . A A . 10 MET CG 1 1 13 1939 1 1 10 MET H H -2.008 0.279 -3.455 1.00 . A A . 10 MET H 1 1 13 1940 1 1 10 MET HA H -1.098 -2.420 -3.624 1.00 . A A . 10 MET HA 1 1 13 1941 1 1 10 MET HB2 H -2.550 -1.104 -5.269 1.00 . A A . 10 MET HB2 1 1 13 1942 1 1 10 MET HB3 H -1.040 -0.419 -5.893 1.00 . A A . 10 MET HB3 1 1 13 1943 1 1 10 MET HE1 H -2.954 -5.736 -7.219 1.00 . A A . 10 MET HE1 1 1 13 1944 1 1 10 MET HE2 H -2.618 -4.290 -8.200 1.00 . A A . 10 MET HE2 1 1 13 1945 1 1 10 MET HE3 H -1.276 -5.190 -7.454 1.00 . A A . 10 MET HE3 1 1 13 1946 1 1 10 MET HG2 H -1.478 -2.209 -7.320 1.00 . A A . 10 MET HG2 1 1 13 1947 1 1 10 MET HG3 H -0.278 -2.862 -6.188 1.00 . A A . 10 MET HG3 1 1 13 1948 1 1 10 MET N N -1.379 -0.427 -3.099 1.00 . A A . 10 MET N 1 1 13 1949 1 1 10 MET O O 1.190 -0.410 -4.765 1.00 . A A . 10 MET O 1 1 13 1950 1 1 10 MET SD S -2.435 -3.841 -5.864 1.00 . A A . 10 MET SD 1 1 14 1951 1 1 1 GLY C C 9.072 3.102 0.082 1.00 . A A . 1 GLY C 1 1 14 1952 1 1 1 GLY CA C 8.297 3.526 -1.149 1.00 . A A . 1 GLY CA 1 1 14 1953 1 1 1 GLY H1 H 8.608 4.032 -3.087 1.00 . A A . 1 GLY H1 1 1 14 1954 1 1 1 GLY H2 H 9.932 4.222 -2.123 1.00 . A A . 1 GLY H2 1 1 14 1955 1 1 1 GLY H3 H 9.464 2.712 -2.592 1.00 . A A . 1 GLY H3 1 1 14 1956 1 1 1 GLY HA2 H 7.841 4.497 -0.958 1.00 . A A . 1 GLY HA2 1 1 14 1957 1 1 1 GLY HA3 H 7.510 2.797 -1.340 1.00 . A A . 1 GLY HA3 1 1 14 1958 1 1 1 GLY N N 9.139 3.631 -2.328 1.00 . A A . 1 GLY N 1 1 14 1959 1 1 1 GLY O O 10.186 2.591 -0.023 1.00 . A A . 1 GLY O 1 1 14 1960 1 1 2 ASN C C 8.643 1.595 3.000 1.00 . A A . 2 ASN C 1 1 14 1961 1 1 2 ASN CA C 9.128 2.957 2.511 1.00 . A A . 2 ASN CA 1 1 14 1962 1 1 2 ASN CB C 8.850 4.021 3.575 1.00 . A A . 2 ASN CB 1 1 14 1963 1 1 2 ASN CG C 9.467 5.362 3.226 1.00 . A A . 2 ASN CG 1 1 14 1964 1 1 2 ASN H H 7.568 3.743 1.273 1.00 . A A . 2 ASN H 1 1 14 1965 1 1 2 ASN HA H 10.204 2.904 2.347 1.00 . A A . 2 ASN HA 1 1 14 1966 1 1 2 ASN HB2 H 7.772 4.147 3.672 1.00 . A A . 2 ASN HB2 1 1 14 1967 1 1 2 ASN HB3 H 9.255 3.683 4.529 1.00 . A A . 2 ASN HB3 1 1 14 1968 1 1 2 ASN HD21 H 11.300 4.507 3.036 1.00 . A A . 2 ASN HD21 1 1 14 1969 1 1 2 ASN HD22 H 11.239 6.231 2.745 1.00 . A A . 2 ASN HD22 1 1 14 1970 1 1 2 ASN N N 8.484 3.318 1.253 1.00 . A A . 2 ASN N 1 1 14 1971 1 1 2 ASN ND2 N 10.773 5.367 2.983 1.00 . A A . 2 ASN ND2 1 1 14 1972 1 1 2 ASN O O 9.372 0.605 2.935 1.00 . A A . 2 ASN O 1 1 14 1973 1 1 2 ASN OD1 O 8.777 6.381 3.175 1.00 . A A . 2 ASN OD1 1 1 14 1974 1 1 3 HIS C C 6.480 -0.626 2.836 1.00 . A A . 3 HIS C 1 1 14 1975 1 1 3 HIS CA C 6.824 0.313 3.987 1.00 . A A . 3 HIS CA 1 1 14 1976 1 1 3 HIS CB C 5.569 0.608 4.810 1.00 . A A . 3 HIS CB 1 1 14 1977 1 1 3 HIS CD2 C 3.509 0.653 3.231 1.00 . A A . 3 HIS CD2 1 1 14 1978 1 1 3 HIS CE1 C 3.209 2.822 3.192 1.00 . A A . 3 HIS CE1 1 1 14 1979 1 1 3 HIS CG C 4.460 1.237 4.013 1.00 . A A . 3 HIS CG 1 1 14 1980 1 1 3 HIS H H 6.860 2.402 3.516 1.00 . A A . 3 HIS H 1 1 14 1981 1 1 3 HIS HA H 7.553 -0.179 4.631 1.00 . A A . 3 HIS HA 1 1 14 1982 1 1 3 HIS HB2 H 5.204 -0.329 5.229 1.00 . A A . 3 HIS HB2 1 1 14 1983 1 1 3 HIS HB3 H 5.836 1.278 5.628 1.00 . A A . 3 HIS HB3 1 1 14 1984 1 1 3 HIS HD2 H 3.390 -0.405 3.046 1.00 . A A . 3 HIS HD2 1 1 14 1985 1 1 3 HIS HE1 H 2.804 3.797 2.966 1.00 . A A . 3 HIS HE1 1 1 14 1986 1 1 3 HIS HE2 H 1.932 1.565 2.101 1.00 . A A . 3 HIS HE2 1 1 14 1987 1 1 3 HIS N N 7.408 1.554 3.489 1.00 . A A . 3 HIS N 1 1 14 1988 1 1 3 HIS ND1 N 4.255 2.605 3.977 1.00 . A A . 3 HIS ND1 1 1 14 1989 1 1 3 HIS NE2 N 2.724 1.672 2.718 1.00 . A A . 3 HIS NE2 1 1 14 1990 1 1 3 HIS O O 6.577 -0.253 1.668 1.00 . A A . 3 HIS O 1 1 14 1991 1 1 4 TRP C C 4.274 -2.668 1.724 1.00 . A A . 4 TRP C 1 1 14 1992 1 1 4 TRP CA C 5.724 -2.840 2.169 1.00 . A A . 4 TRP CA 1 1 14 1993 1 1 4 TRP CB C 5.936 -4.252 2.717 1.00 . A A . 4 TRP CB 1 1 14 1994 1 1 4 TRP CD1 C 8.146 -5.546 2.609 1.00 . A A . 4 TRP CD1 1 1 14 1995 1 1 4 TRP CD2 C 7.142 -5.272 0.627 1.00 . A A . 4 TRP CD2 1 1 14 1996 1 1 4 TRP CE2 C 8.336 -5.993 0.429 1.00 . A A . 4 TRP CE2 1 1 14 1997 1 1 4 TRP CE3 C 6.340 -4.982 -0.481 1.00 . A A . 4 TRP CE3 1 1 14 1998 1 1 4 TRP CG C 7.039 -4.997 2.028 1.00 . A A . 4 TRP CG 1 1 14 1999 1 1 4 TRP CH2 C 7.942 -6.125 -1.895 1.00 . A A . 4 TRP CH2 1 1 14 2000 1 1 4 TRP CZ2 C 8.746 -6.424 -0.829 1.00 . A A . 4 TRP CZ2 1 1 14 2001 1 1 4 TRP CZ3 C 6.749 -5.410 -1.729 1.00 . A A . 4 TRP CZ3 1 1 14 2002 1 1 4 TRP H H 6.021 -2.093 4.152 1.00 . A A . 4 TRP H 1 1 14 2003 1 1 4 TRP HA H 6.371 -2.703 1.303 1.00 . A A . 4 TRP HA 1 1 14 2004 1 1 4 TRP HB2 H 6.169 -4.185 3.780 1.00 . A A . 4 TRP HB2 1 1 14 2005 1 1 4 TRP HB3 H 5.010 -4.814 2.594 1.00 . A A . 4 TRP HB3 1 1 14 2006 1 1 4 TRP HD1 H 8.371 -5.513 3.665 1.00 . A A . 4 TRP HD1 1 1 14 2007 1 1 4 TRP HE1 H 9.804 -6.623 1.828 1.00 . A A . 4 TRP HE1 1 1 14 2008 1 1 4 TRP HE3 H 5.418 -4.432 -0.363 1.00 . A A . 4 TRP HE3 1 1 14 2009 1 1 4 TRP HH2 H 8.232 -6.447 -2.884 1.00 . A A . 4 TRP HH2 1 1 14 2010 1 1 4 TRP HZ2 H 9.666 -6.975 -0.959 1.00 . A A . 4 TRP HZ2 1 1 14 2011 1 1 4 TRP HZ3 H 6.137 -5.190 -2.592 1.00 . A A . 4 TRP HZ3 1 1 14 2012 1 1 4 TRP N N 6.080 -1.847 3.175 1.00 . A A . 4 TRP N 1 1 14 2013 1 1 4 TRP NE1 N 8.931 -6.146 1.655 1.00 . A A . 4 TRP NE1 1 1 14 2014 1 1 4 TRP O O 4.007 -2.225 0.608 1.00 . A A . 4 TRP O 1 1 14 2015 1 1 5 ALA C C 1.103 -2.734 3.578 1.00 . A A . 5 ALA C 1 1 14 2016 1 1 5 ALA CA C 1.922 -2.902 2.304 1.00 . A A . 5 ALA CA 1 1 14 2017 1 1 5 ALA CB C 1.446 -4.120 1.524 1.00 . A A . 5 ALA CB 1 1 14 2018 1 1 5 ALA H H 3.629 -3.379 3.505 1.00 . A A . 5 ALA H 1 1 14 2019 1 1 5 ALA HA H 1.776 -2.018 1.683 1.00 . A A . 5 ALA HA 1 1 14 2020 1 1 5 ALA HB1 H 0.383 -4.019 1.305 1.00 . A A . 5 ALA HB1 1 1 14 2021 1 1 5 ALA HB2 H 2.003 -4.193 0.590 1.00 . A A . 5 ALA HB2 1 1 14 2022 1 1 5 ALA HB3 H 1.611 -5.019 2.117 1.00 . A A . 5 ALA HB3 1 1 14 2023 1 1 5 ALA N N 3.345 -3.020 2.604 1.00 . A A . 5 ALA N 1 1 14 2024 1 1 5 ALA O O 0.864 -3.697 4.306 1.00 . A A . 5 ALA O 1 1 14 2025 1 1 6 VAL C C -1.584 -1.561 4.811 1.00 . A A . 6 VAL C 1 1 14 2026 1 1 6 VAL CA C -0.120 -1.208 5.029 1.00 . A A . 6 VAL CA 1 1 14 2027 1 1 6 VAL CB C -0.012 0.277 5.419 1.00 . A A . 6 VAL CB 1 1 14 2028 1 1 6 VAL CG1 C -0.421 1.167 4.254 1.00 . A A . 6 VAL CG1 1 1 14 2029 1 1 6 VAL CG2 C -0.865 0.568 6.645 1.00 . A A . 6 VAL CG2 1 1 14 2030 1 1 6 VAL H H 0.905 -0.754 3.205 1.00 . A A . 6 VAL H 1 1 14 2031 1 1 6 VAL HA H 0.260 -1.808 5.855 1.00 . A A . 6 VAL HA 1 1 14 2032 1 1 6 VAL HB H 1.027 0.491 5.666 1.00 . A A . 6 VAL HB 1 1 14 2033 1 1 6 VAL HG11 H 0.202 0.942 3.388 1.00 . A A . 6 VAL HG11 1 1 14 2034 1 1 6 VAL HG12 H -1.466 0.984 4.007 1.00 . A A . 6 VAL HG12 1 1 14 2035 1 1 6 VAL HG13 H -0.291 2.213 4.533 1.00 . A A . 6 VAL HG13 1 1 14 2036 1 1 6 VAL HG21 H -0.556 -0.079 7.466 1.00 . A A . 6 VAL HG21 1 1 14 2037 1 1 6 VAL HG22 H -0.737 1.610 6.937 1.00 . A A . 6 VAL HG22 1 1 14 2038 1 1 6 VAL HG23 H -1.914 0.383 6.411 1.00 . A A . 6 VAL HG23 1 1 14 2039 1 1 6 VAL N N 0.674 -1.503 3.842 1.00 . A A . 6 VAL N 1 1 14 2040 1 1 6 VAL O O -2.314 -1.846 5.760 1.00 . A A . 6 VAL O 1 1 14 2041 1 1 7 GLY C C -4.164 -0.664 2.725 1.00 . A A . 7 GLY C 1 1 14 2042 1 1 7 GLY CA C -3.391 -1.865 3.232 1.00 . A A . 7 GLY CA 1 1 14 2043 1 1 7 GLY H H -1.370 -1.304 2.811 1.00 . A A . 7 GLY H 1 1 14 2044 1 1 7 GLY HA2 H -3.405 -2.643 2.468 1.00 . A A . 7 GLY HA2 1 1 14 2045 1 1 7 GLY HA3 H -3.880 -2.242 4.130 1.00 . A A . 7 GLY HA3 1 1 14 2046 1 1 7 GLY N N -2.012 -1.544 3.552 1.00 . A A . 7 GLY N 1 1 14 2047 1 1 7 GLY O O -5.390 -0.614 2.833 1.00 . A A . 7 GLY O 1 1 14 2048 1 1 8 HIS C C -3.761 1.695 0.168 1.00 . A A . 8 HIS C 1 1 14 2049 1 1 8 HIS CA C -4.073 1.520 1.651 1.00 . A A . 8 HIS CA 1 1 14 2050 1 1 8 HIS CB C -3.597 2.747 2.431 1.00 . A A . 8 HIS CB 1 1 14 2051 1 1 8 HIS CD2 C -4.171 5.138 1.602 1.00 . A A . 8 HIS CD2 1 1 14 2052 1 1 8 HIS CE1 C -6.234 5.222 2.330 1.00 . A A . 8 HIS CE1 1 1 14 2053 1 1 8 HIS CG C -4.459 3.960 2.222 1.00 . A A . 8 HIS CG 1 1 14 2054 1 1 8 HIS H H -2.443 0.211 2.117 1.00 . A A . 8 HIS H 1 1 14 2055 1 1 8 HIS HA H -5.152 1.430 1.770 1.00 . A A . 8 HIS HA 1 1 14 2056 1 1 8 HIS HB2 H -3.597 2.502 3.493 1.00 . A A . 8 HIS HB2 1 1 14 2057 1 1 8 HIS HB3 H -2.578 2.983 2.125 1.00 . A A . 8 HIS HB3 1 1 14 2058 1 1 8 HIS HD2 H -3.234 5.407 1.138 1.00 . A A . 8 HIS HD2 1 1 14 2059 1 1 8 HIS HE1 H -7.231 5.576 2.546 1.00 . A A . 8 HIS HE1 1 1 14 2060 1 1 8 HIS HE2 H -5.413 6.861 1.312 1.00 . A A . 8 HIS HE2 1 1 14 2061 1 1 8 HIS N N -3.447 0.310 2.174 1.00 . A A . 8 HIS N 1 1 14 2062 1 1 8 HIS ND1 N -5.767 4.031 2.676 1.00 . A A . 8 HIS ND1 1 1 14 2063 1 1 8 HIS NE2 N -5.307 5.926 1.680 1.00 . A A . 8 HIS NE2 1 1 14 2064 1 1 8 HIS O O -3.638 2.818 -0.323 1.00 . A A . 8 HIS O 1 1 14 2065 1 1 9 LEU C C -4.616 0.581 -2.795 1.00 . A A . 9 LEU C 1 1 14 2066 1 1 9 LEU CA C -3.333 0.609 -1.969 1.00 . A A . 9 LEU CA 1 1 14 2067 1 1 9 LEU CB C -2.442 -0.575 -2.347 1.00 . A A . 9 LEU CB 1 1 14 2068 1 1 9 LEU CD1 C -0.469 0.659 -3.277 1.00 . A A . 9 LEU CD1 1 1 14 2069 1 1 9 LEU CD2 C -0.571 0.127 -0.835 1.00 . A A . 9 LEU CD2 1 1 14 2070 1 1 9 LEU CG C -0.935 -0.346 -2.234 1.00 . A A . 9 LEU CG 1 1 14 2071 1 1 9 LEU H H -3.745 -0.313 -0.080 1.00 . A A . 9 LEU H 1 1 14 2072 1 1 9 LEU HA H -2.797 1.531 -2.191 1.00 . A A . 9 LEU HA 1 1 14 2073 1 1 9 LEU HB2 H -2.709 -1.421 -1.714 1.00 . A A . 9 LEU HB2 1 1 14 2074 1 1 9 LEU HB3 H -2.662 -0.840 -3.382 1.00 . A A . 9 LEU HB3 1 1 14 2075 1 1 9 LEU HD11 H -0.738 0.304 -4.271 1.00 . A A . 9 LEU HD11 1 1 14 2076 1 1 9 LEU HD12 H -0.947 1.621 -3.094 1.00 . A A . 9 LEU HD12 1 1 14 2077 1 1 9 LEU HD13 H 0.613 0.774 -3.213 1.00 . A A . 9 LEU HD13 1 1 14 2078 1 1 9 LEU HD21 H 0.507 0.056 -0.696 1.00 . A A . 9 LEU HD21 1 1 14 2079 1 1 9 LEU HD22 H -1.074 -0.500 -0.098 1.00 . A A . 9 LEU HD22 1 1 14 2080 1 1 9 LEU HD23 H -0.888 1.162 -0.707 1.00 . A A . 9 LEU HD23 1 1 14 2081 1 1 9 LEU HG H -0.429 -1.293 -2.420 1.00 . A A . 9 LEU HG 1 1 14 2082 1 1 9 LEU N N -3.633 0.578 -0.541 1.00 . A A . 9 LEU N 1 1 14 2083 1 1 9 LEU O O -5.662 0.141 -2.320 1.00 . A A . 9 LEU O 1 1 14 2084 1 1 10 MET C C -5.234 1.060 -6.386 1.00 . A A . 10 MET C 1 1 14 2085 1 1 10 MET CA C -5.677 1.078 -4.927 1.00 . A A . 10 MET CA 1 1 14 2086 1 1 10 MET CB C -6.532 2.318 -4.655 1.00 . A A . 10 MET CB 1 1 14 2087 1 1 10 MET CE C -7.168 6.028 -5.381 1.00 . A A . 10 MET CE 1 1 14 2088 1 1 10 MET CG C -5.841 3.623 -5.015 1.00 . A A . 10 MET CG 1 1 14 2089 1 1 10 MET H H -3.637 1.402 -4.364 1.00 . A A . 10 MET H 1 1 14 2090 1 1 10 MET HA H -6.283 0.192 -4.737 1.00 . A A . 10 MET HA 1 1 14 2091 1 1 10 MET HB2 H -7.448 2.240 -5.241 1.00 . A A . 10 MET HB2 1 1 14 2092 1 1 10 MET HB3 H -6.793 2.339 -3.597 1.00 . A A . 10 MET HB3 1 1 14 2093 1 1 10 MET HE1 H -7.598 6.935 -4.955 1.00 . A A . 10 MET HE1 1 1 14 2094 1 1 10 MET HE2 H -7.948 5.464 -5.894 1.00 . A A . 10 MET HE2 1 1 14 2095 1 1 10 MET HE3 H -6.386 6.296 -6.092 1.00 . A A . 10 MET HE3 1 1 14 2096 1 1 10 MET HG2 H -4.772 3.520 -4.827 1.00 . A A . 10 MET HG2 1 1 14 2097 1 1 10 MET HG3 H -5.995 3.818 -6.076 1.00 . A A . 10 MET HG3 1 1 14 2098 1 1 10 MET N N -4.525 1.053 -4.033 1.00 . A A . 10 MET N 1 1 14 2099 1 1 10 MET O O -4.042 1.135 -6.685 1.00 . A A . 10 MET O 1 1 14 2100 1 1 10 MET SD S -6.469 5.025 -4.072 1.00 . A A . 10 MET SD 1 1 15 2101 1 1 1 GLY C C 10.976 -1.855 6.511 1.00 . A A . 1 GLY C 1 1 15 2102 1 1 1 GLY CA C 12.005 -1.135 7.360 1.00 . A A . 1 GLY CA 1 1 15 2103 1 1 1 GLY H1 H 12.982 -1.321 9.124 1.00 . A A . 1 GLY H1 1 1 15 2104 1 1 1 GLY H2 H 12.655 -2.757 8.383 1.00 . A A . 1 GLY H2 1 1 15 2105 1 1 1 GLY H3 H 11.448 -1.925 9.139 1.00 . A A . 1 GLY H3 1 1 15 2106 1 1 1 GLY HA2 H 11.633 -0.139 7.598 1.00 . A A . 1 GLY HA2 1 1 15 2107 1 1 1 GLY HA3 H 12.927 -1.041 6.787 1.00 . A A . 1 GLY HA3 1 1 15 2108 1 1 1 GLY N N 12.295 -1.838 8.596 1.00 . A A . 1 GLY N 1 1 15 2109 1 1 1 GLY O O 11.240 -2.194 5.357 1.00 . A A . 1 GLY O 1 1 15 2110 1 1 2 ASN C C 7.548 -1.843 6.132 1.00 . A A . 2 ASN C 1 1 15 2111 1 1 2 ASN CA C 8.728 -2.778 6.371 1.00 . A A . 2 ASN CA 1 1 15 2112 1 1 2 ASN CB C 8.268 -4.006 7.161 1.00 . A A . 2 ASN CB 1 1 15 2113 1 1 2 ASN CG C 9.395 -4.993 7.403 1.00 . A A . 2 ASN CG 1 1 15 2114 1 1 2 ASN H H 9.646 -1.789 8.033 1.00 . A A . 2 ASN H 1 1 15 2115 1 1 2 ASN HA H 9.109 -3.109 5.406 1.00 . A A . 2 ASN HA 1 1 15 2116 1 1 2 ASN HB2 H 7.869 -3.680 8.122 1.00 . A A . 2 ASN HB2 1 1 15 2117 1 1 2 ASN HB3 H 7.478 -4.506 6.601 1.00 . A A . 2 ASN HB3 1 1 15 2118 1 1 2 ASN HD21 H 9.199 -5.728 5.520 1.00 . A A . 2 ASN HD21 1 1 15 2119 1 1 2 ASN HD22 H 10.447 -6.473 6.494 1.00 . A A . 2 ASN HD22 1 1 15 2120 1 1 2 ASN N N 9.800 -2.092 7.082 1.00 . A A . 2 ASN N 1 1 15 2121 1 1 2 ASN ND2 N 9.705 -5.795 6.392 1.00 . A A . 2 ASN ND2 1 1 15 2122 1 1 2 ASN O O 6.700 -1.657 7.006 1.00 . A A . 2 ASN O 1 1 15 2123 1 1 2 ASN OD1 O 9.978 -5.031 8.485 1.00 . A A . 2 ASN OD1 1 1 15 2124 1 1 3 HIS C C 5.884 -0.646 3.189 1.00 . A A . 3 HIS C 1 1 15 2125 1 1 3 HIS CA C 6.420 -0.340 4.585 1.00 . A A . 3 HIS CA 1 1 15 2126 1 1 3 HIS CB C 6.908 1.109 4.649 1.00 . A A . 3 HIS CB 1 1 15 2127 1 1 3 HIS CD2 C 6.378 2.230 6.931 1.00 . A A . 3 HIS CD2 1 1 15 2128 1 1 3 HIS CE1 C 8.336 1.940 7.869 1.00 . A A . 3 HIS CE1 1 1 15 2129 1 1 3 HIS CG C 7.191 1.586 6.047 1.00 . A A . 3 HIS CG 1 1 15 2130 1 1 3 HIS H H 8.221 -1.449 4.264 1.00 . A A . 3 HIS H 1 1 15 2131 1 1 3 HIS HA H 5.608 -0.464 5.302 1.00 . A A . 3 HIS HA 1 1 15 2132 1 1 3 HIS HB2 H 7.825 1.190 4.065 1.00 . A A . 3 HIS HB2 1 1 15 2133 1 1 3 HIS HB3 H 6.151 1.755 4.204 1.00 . A A . 3 HIS HB3 1 1 15 2134 1 1 3 HIS HD2 H 5.350 2.517 6.766 1.00 . A A . 3 HIS HD2 1 1 15 2135 1 1 3 HIS HE1 H 9.141 1.958 8.589 1.00 . A A . 3 HIS HE1 1 1 15 2136 1 1 3 HIS HE2 H 6.798 2.905 8.922 1.00 . A A . 3 HIS HE2 1 1 15 2137 1 1 3 HIS N N 7.496 -1.255 4.940 1.00 . A A . 3 HIS N 1 1 15 2138 1 1 3 HIS ND1 N 8.423 1.412 6.657 1.00 . A A . 3 HIS ND1 1 1 15 2139 1 1 3 HIS NE2 N 7.119 2.448 8.080 1.00 . A A . 3 HIS NE2 1 1 15 2140 1 1 3 HIS O O 5.427 0.249 2.478 1.00 . A A . 3 HIS O 1 1 15 2141 1 1 4 TRP C C 4.010 -1.944 1.289 1.00 . A A . 4 TRP C 1 1 15 2142 1 1 4 TRP CA C 5.469 -2.338 1.491 1.00 . A A . 4 TRP CA 1 1 15 2143 1 1 4 TRP CB C 5.628 -3.851 1.332 1.00 . A A . 4 TRP CB 1 1 15 2144 1 1 4 TRP CD1 C 7.850 -4.989 0.752 1.00 . A A . 4 TRP CD1 1 1 15 2145 1 1 4 TRP CD2 C 6.904 -3.892 -0.956 1.00 . A A . 4 TRP CD2 1 1 15 2146 1 1 4 TRP CE2 C 8.110 -4.466 -1.404 1.00 . A A . 4 TRP CE2 1 1 15 2147 1 1 4 TRP CE3 C 6.134 -3.153 -1.859 1.00 . A A . 4 TRP CE3 1 1 15 2148 1 1 4 TRP CG C 6.757 -4.237 0.426 1.00 . A A . 4 TRP CG 1 1 15 2149 1 1 4 TRP CH2 C 7.787 -3.595 -3.575 1.00 . A A . 4 TRP CH2 1 1 15 2150 1 1 4 TRP CZ2 C 8.560 -4.324 -2.713 1.00 . A A . 4 TRP CZ2 1 1 15 2151 1 1 4 TRP CZ3 C 6.584 -3.012 -3.158 1.00 . A A . 4 TRP CZ3 1 1 15 2152 1 1 4 TRP H H 6.335 -2.603 3.431 1.00 . A A . 4 TRP H 1 1 15 2153 1 1 4 TRP HA H 6.070 -1.845 0.728 1.00 . A A . 4 TRP HA 1 1 15 2154 1 1 4 TRP HB2 H 5.798 -4.292 2.314 1.00 . A A . 4 TRP HB2 1 1 15 2155 1 1 4 TRP HB3 H 4.702 -4.254 0.922 1.00 . A A . 4 TRP HB3 1 1 15 2156 1 1 4 TRP HD1 H 8.042 -5.410 1.728 1.00 . A A . 4 TRP HD1 1 1 15 2157 1 1 4 TRP HE1 H 9.540 -5.642 -0.362 1.00 . A A . 4 TRP HE1 1 1 15 2158 1 1 4 TRP HE3 H 5.205 -2.700 -1.547 1.00 . A A . 4 TRP HE3 1 1 15 2159 1 1 4 TRP HH2 H 8.111 -3.467 -4.598 1.00 . A A . 4 TRP HH2 1 1 15 2160 1 1 4 TRP HZ2 H 9.488 -4.772 -3.037 1.00 . A A . 4 TRP HZ2 1 1 15 2161 1 1 4 TRP HZ3 H 5.997 -2.443 -3.863 1.00 . A A . 4 TRP HZ3 1 1 15 2162 1 1 4 TRP N N 5.947 -1.914 2.802 1.00 . A A . 4 TRP N 1 1 15 2163 1 1 4 TRP NE1 N 8.668 -5.131 -0.342 1.00 . A A . 4 TRP NE1 1 1 15 2164 1 1 4 TRP O O 3.701 -1.067 0.485 1.00 . A A . 4 TRP O 1 1 15 2165 1 1 5 ALA C C 1.121 -1.897 3.280 1.00 . A A . 5 ALA C 1 1 15 2166 1 1 5 ALA CA C 1.690 -2.314 1.928 1.00 . A A . 5 ALA CA 1 1 15 2167 1 1 5 ALA CB C 0.946 -3.527 1.391 1.00 . A A . 5 ALA CB 1 1 15 2168 1 1 5 ALA H H 3.436 -3.310 2.668 1.00 . A A . 5 ALA H 1 1 15 2169 1 1 5 ALA HA H 1.552 -1.489 1.229 1.00 . A A . 5 ALA HA 1 1 15 2170 1 1 5 ALA HB1 H -0.118 -3.301 1.324 1.00 . A A . 5 ALA HB1 1 1 15 2171 1 1 5 ALA HB2 H 1.327 -3.778 0.402 1.00 . A A . 5 ALA HB2 1 1 15 2172 1 1 5 ALA HB3 H 1.096 -4.372 2.063 1.00 . A A . 5 ALA HB3 1 1 15 2173 1 1 5 ALA N N 3.118 -2.598 2.026 1.00 . A A . 5 ALA N 1 1 15 2174 1 1 5 ALA O O 0.680 -2.736 4.065 1.00 . A A . 5 ALA O 1 1 15 2175 1 1 6 VAL C C -0.789 -0.579 5.078 1.00 . A A . 6 VAL C 1 1 15 2176 1 1 6 VAL CA C 0.617 -0.064 4.803 1.00 . A A . 6 VAL CA 1 1 15 2177 1 1 6 VAL CB C 0.599 1.475 4.798 1.00 . A A . 6 VAL CB 1 1 15 2178 1 1 6 VAL CG1 C -0.198 1.996 3.612 1.00 . A A . 6 VAL CG1 1 1 15 2179 1 1 6 VAL CG2 C 0.033 2.004 6.107 1.00 . A A . 6 VAL CG2 1 1 15 2180 1 1 6 VAL H H 1.510 0.046 2.860 1.00 . A A . 6 VAL H 1 1 15 2181 1 1 6 VAL HA H 1.269 -0.398 5.611 1.00 . A A . 6 VAL HA 1 1 15 2182 1 1 6 VAL HB H 1.626 1.829 4.702 1.00 . A A . 6 VAL HB 1 1 15 2183 1 1 6 VAL HG11 H 0.172 2.981 3.329 1.00 . A A . 6 VAL HG11 1 1 15 2184 1 1 6 VAL HG12 H -0.086 1.311 2.771 1.00 . A A . 6 VAL HG12 1 1 15 2185 1 1 6 VAL HG13 H -1.251 2.068 3.885 1.00 . A A . 6 VAL HG13 1 1 15 2186 1 1 6 VAL HG21 H 0.027 3.094 6.087 1.00 . A A . 6 VAL HG21 1 1 15 2187 1 1 6 VAL HG22 H -0.985 1.638 6.237 1.00 . A A . 6 VAL HG22 1 1 15 2188 1 1 6 VAL HG23 H 0.651 1.660 6.936 1.00 . A A . 6 VAL HG23 1 1 15 2189 1 1 6 VAL N N 1.134 -0.593 3.546 1.00 . A A . 6 VAL N 1 1 15 2190 1 1 6 VAL O O -1.154 -0.836 6.225 1.00 . A A . 6 VAL O 1 1 15 2191 1 1 7 GLY C C -3.645 -1.369 2.836 1.00 . A A . 7 GLY C 1 1 15 2192 1 1 7 GLY CA C -2.938 -1.210 4.166 1.00 . A A . 7 GLY CA 1 1 15 2193 1 1 7 GLY H H -1.227 -0.497 3.100 1.00 . A A . 7 GLY H 1 1 15 2194 1 1 7 GLY HA2 H -2.912 -2.178 4.666 1.00 . A A . 7 GLY HA2 1 1 15 2195 1 1 7 GLY HA3 H -3.499 -0.508 4.783 1.00 . A A . 7 GLY HA3 1 1 15 2196 1 1 7 GLY N N -1.578 -0.726 4.019 1.00 . A A . 7 GLY N 1 1 15 2197 1 1 7 GLY O O -3.886 -2.489 2.382 1.00 . A A . 7 GLY O 1 1 15 2198 1 1 8 HIS C C -4.024 0.713 -0.054 1.00 . A A . 8 HIS C 1 1 15 2199 1 1 8 HIS CA C -4.667 -0.268 0.919 1.00 . A A . 8 HIS CA 1 1 15 2200 1 1 8 HIS CB C -6.147 0.071 1.102 1.00 . A A . 8 HIS CB 1 1 15 2201 1 1 8 HIS CD2 C -6.336 1.554 3.226 1.00 . A A . 8 HIS CD2 1 1 15 2202 1 1 8 HIS CE1 C -6.854 3.434 2.234 1.00 . A A . 8 HIS CE1 1 1 15 2203 1 1 8 HIS CG C -6.386 1.334 1.882 1.00 . A A . 8 HIS CG 1 1 15 2204 1 1 8 HIS H H -3.758 0.641 2.633 1.00 . A A . 8 HIS H 1 1 15 2205 1 1 8 HIS HA H -4.591 -1.272 0.501 1.00 . A A . 8 HIS HA 1 1 15 2206 1 1 8 HIS HB2 H -6.599 0.185 0.116 1.00 . A A . 8 HIS HB2 1 1 15 2207 1 1 8 HIS HB3 H -6.635 -0.757 1.617 1.00 . A A . 8 HIS HB3 1 1 15 2208 1 1 8 HIS HD2 H -6.106 0.822 3.987 1.00 . A A . 8 HIS HD2 1 1 15 2209 1 1 8 HIS HE1 H -7.111 4.471 2.070 1.00 . A A . 8 HIS HE1 1 1 15 2210 1 1 8 HIS HE2 H -6.679 3.361 4.324 1.00 . A A . 8 HIS HE2 1 1 15 2211 1 1 8 HIS N N -3.982 -0.247 2.208 1.00 . A A . 8 HIS N 1 1 15 2212 1 1 8 HIS ND1 N -6.714 2.534 1.273 1.00 . A A . 8 HIS ND1 1 1 15 2213 1 1 8 HIS NE2 N -6.635 2.888 3.433 1.00 . A A . 8 HIS NE2 1 1 15 2214 1 1 8 HIS O O -4.626 1.723 -0.424 1.00 . A A . 8 HIS O 1 1 15 2215 1 1 9 LEU C C -2.823 1.400 -2.717 1.00 . A A . 9 LEU C 1 1 15 2216 1 1 9 LEU CA C -2.071 1.269 -1.396 1.00 . A A . 9 LEU CA 1 1 15 2217 1 1 9 LEU CB C -0.669 0.710 -1.648 1.00 . A A . 9 LEU CB 1 1 15 2218 1 1 9 LEU CD1 C -0.642 -0.657 -3.749 1.00 . A A . 9 LEU CD1 1 1 15 2219 1 1 9 LEU CD2 C 0.645 -1.422 -1.745 1.00 . A A . 9 LEU CD2 1 1 15 2220 1 1 9 LEU CG C -0.605 -0.702 -2.229 1.00 . A A . 9 LEU CG 1 1 15 2221 1 1 9 LEU H H -2.356 -0.429 -0.126 1.00 . A A . 9 LEU H 1 1 15 2222 1 1 9 LEU HA H -1.974 2.260 -0.952 1.00 . A A . 9 LEU HA 1 1 15 2223 1 1 9 LEU HB2 H -0.164 1.380 -2.343 1.00 . A A . 9 LEU HB2 1 1 15 2224 1 1 9 LEU HB3 H -0.122 0.718 -0.705 1.00 . A A . 9 LEU HB3 1 1 15 2225 1 1 9 LEU HD11 H -1.543 -0.139 -4.076 1.00 . A A . 9 LEU HD11 1 1 15 2226 1 1 9 LEU HD12 H -0.644 -1.673 -4.143 1.00 . A A . 9 LEU HD12 1 1 15 2227 1 1 9 LEU HD13 H 0.236 -0.127 -4.118 1.00 . A A . 9 LEU HD13 1 1 15 2228 1 1 9 LEU HD21 H 0.653 -1.444 -0.655 1.00 . A A . 9 LEU HD21 1 1 15 2229 1 1 9 LEU HD22 H 0.649 -2.442 -2.129 1.00 . A A . 9 LEU HD22 1 1 15 2230 1 1 9 LEU HD23 H 1.529 -0.895 -2.104 1.00 . A A . 9 LEU HD23 1 1 15 2231 1 1 9 LEU HG H -1.477 -1.257 -1.881 1.00 . A A . 9 LEU HG 1 1 15 2232 1 1 9 LEU N N -2.797 0.413 -0.466 1.00 . A A . 9 LEU N 1 1 15 2233 1 1 9 LEU O O -2.731 2.421 -3.398 1.00 . A A . 9 LEU O 1 1 15 2234 1 1 10 MET C C -5.253 1.579 -4.381 1.00 . A A . 10 MET C 1 1 15 2235 1 1 10 MET CA C -4.341 0.358 -4.310 1.00 . A A . 10 MET CA 1 1 15 2236 1 1 10 MET CB C -5.171 -0.921 -4.418 1.00 . A A . 10 MET CB 1 1 15 2237 1 1 10 MET CE C -8.485 -2.638 -3.652 1.00 . A A . 10 MET CE 1 1 15 2238 1 1 10 MET CG C -6.238 -1.046 -3.343 1.00 . A A . 10 MET CG 1 1 15 2239 1 1 10 MET H H -3.604 -0.451 -2.470 1.00 . A A . 10 MET H 1 1 15 2240 1 1 10 MET HA H -3.647 0.394 -5.151 1.00 . A A . 10 MET HA 1 1 15 2241 1 1 10 MET HB2 H -5.661 -0.933 -5.392 1.00 . A A . 10 MET HB2 1 1 15 2242 1 1 10 MET HB3 H -4.503 -1.780 -4.351 1.00 . A A . 10 MET HB3 1 1 15 2243 1 1 10 MET HE1 H -8.960 -3.615 -3.563 1.00 . A A . 10 MET HE1 1 1 15 2244 1 1 10 MET HE2 H -8.510 -2.316 -4.693 1.00 . A A . 10 MET HE2 1 1 15 2245 1 1 10 MET HE3 H -9.021 -1.916 -3.036 1.00 . A A . 10 MET HE3 1 1 15 2246 1 1 10 MET HG2 H -5.838 -0.666 -2.403 1.00 . A A . 10 MET HG2 1 1 15 2247 1 1 10 MET HG3 H -7.097 -0.442 -3.632 1.00 . A A . 10 MET HG3 1 1 15 2248 1 1 10 MET N N -3.569 0.359 -3.072 1.00 . A A . 10 MET N 1 1 15 2249 1 1 10 MET O O -5.370 2.219 -5.427 1.00 . A A . 10 MET O 1 1 15 2250 1 1 10 MET SD S -6.784 -2.748 -3.101 1.00 . A A . 10 MET SD 1 1 16 2251 1 1 1 GLY C C 9.276 3.431 5.375 1.00 . A A . 1 GLY C 1 1 16 2252 1 1 1 GLY CA C 8.978 4.226 6.632 1.00 . A A . 1 GLY CA 1 1 16 2253 1 1 1 GLY H1 H 9.841 4.559 8.434 1.00 . A A . 1 GLY H1 1 1 16 2254 1 1 1 GLY H2 H 9.393 2.991 8.183 1.00 . A A . 1 GLY H2 1 1 16 2255 1 1 1 GLY H3 H 10.730 3.597 7.431 1.00 . A A . 1 GLY H3 1 1 16 2256 1 1 1 GLY HA2 H 7.929 4.085 6.894 1.00 . A A . 1 GLY HA2 1 1 16 2257 1 1 1 GLY HA3 H 9.155 5.282 6.433 1.00 . A A . 1 GLY HA3 1 1 16 2258 1 1 1 GLY N N 9.798 3.812 7.755 1.00 . A A . 1 GLY N 1 1 16 2259 1 1 1 GLY O O 9.479 4.005 4.306 1.00 . A A . 1 GLY O 1 1 16 2260 1 1 2 ASN C C 8.589 0.079 4.317 1.00 . A A . 2 ASN C 1 1 16 2261 1 1 2 ASN CA C 9.581 1.236 4.370 1.00 . A A . 2 ASN CA 1 1 16 2262 1 1 2 ASN CB C 11.009 0.694 4.455 1.00 . A A . 2 ASN CB 1 1 16 2263 1 1 2 ASN CG C 12.051 1.792 4.355 1.00 . A A . 2 ASN CG 1 1 16 2264 1 1 2 ASN H H 9.126 1.699 6.410 1.00 . A A . 2 ASN H 1 1 16 2265 1 1 2 ASN HA H 9.484 1.817 3.453 1.00 . A A . 2 ASN HA 1 1 16 2266 1 1 2 ASN HB2 H 11.133 0.180 5.408 1.00 . A A . 2 ASN HB2 1 1 16 2267 1 1 2 ASN HB3 H 11.167 -0.019 3.645 1.00 . A A . 2 ASN HB3 1 1 16 2268 1 1 2 ASN HD21 H 12.016 2.052 6.369 1.00 . A A . 2 ASN HD21 1 1 16 2269 1 1 2 ASN HD22 H 13.114 3.095 5.494 1.00 . A A . 2 ASN HD22 1 1 16 2270 1 1 2 ASN N N 9.303 2.110 5.504 1.00 . A A . 2 ASN N 1 1 16 2271 1 1 2 ASN ND2 N 12.423 2.359 5.497 1.00 . A A . 2 ASN ND2 1 1 16 2272 1 1 2 ASN O O 8.941 -1.040 3.942 1.00 . A A . 2 ASN O 1 1 16 2273 1 1 2 ASN OD1 O 12.515 2.125 3.265 1.00 . A A . 2 ASN OD1 1 1 16 2274 1 1 3 HIS C C 5.755 -0.876 3.285 1.00 . A A . 3 HIS C 1 1 16 2275 1 1 3 HIS CA C 6.300 -0.663 4.694 1.00 . A A . 3 HIS CA 1 1 16 2276 1 1 3 HIS CB C 5.167 -0.264 5.636 1.00 . A A . 3 HIS CB 1 1 16 2277 1 1 3 HIS CD2 C 6.310 -1.453 7.643 1.00 . A A . 3 HIS CD2 1 1 16 2278 1 1 3 HIS CE1 C 5.263 -0.401 9.251 1.00 . A A . 3 HIS CE1 1 1 16 2279 1 1 3 HIS CG C 5.443 -0.561 7.084 1.00 . A A . 3 HIS CG 1 1 16 2280 1 1 3 HIS H H 7.118 1.292 4.999 1.00 . A A . 3 HIS H 1 1 16 2281 1 1 3 HIS HA H 6.729 -1.601 5.046 1.00 . A A . 3 HIS HA 1 1 16 2282 1 1 3 HIS HB2 H 4.981 0.804 5.528 1.00 . A A . 3 HIS HB2 1 1 16 2283 1 1 3 HIS HB3 H 4.269 -0.807 5.340 1.00 . A A . 3 HIS HB3 1 1 16 2284 1 1 3 HIS HD2 H 6.971 -2.123 7.113 1.00 . A A . 3 HIS HD2 1 1 16 2285 1 1 3 HIS HE1 H 4.946 -0.089 10.235 1.00 . A A . 3 HIS HE1 1 1 16 2286 1 1 3 HIS HE2 H 6.693 -1.865 9.710 1.00 . A A . 3 HIS HE2 1 1 16 2287 1 1 3 HIS N N 7.345 0.354 4.699 1.00 . A A . 3 HIS N 1 1 16 2288 1 1 3 HIS ND1 N 4.791 0.094 8.116 1.00 . A A . 3 HIS ND1 1 1 16 2289 1 1 3 HIS NE2 N 6.183 -1.338 9.015 1.00 . A A . 3 HIS NE2 1 1 16 2290 1 1 3 HIS O O 5.235 0.049 2.663 1.00 . A A . 3 HIS O 1 1 16 2291 1 1 4 TRP C C 3.946 -2.010 1.271 1.00 . A A . 4 TRP C 1 1 16 2292 1 1 4 TRP CA C 5.399 -2.436 1.452 1.00 . A A . 4 TRP CA 1 1 16 2293 1 1 4 TRP CB C 5.537 -3.939 1.199 1.00 . A A . 4 TRP CB 1 1 16 2294 1 1 4 TRP CD1 C 7.719 -5.078 0.484 1.00 . A A . 4 TRP CD1 1 1 16 2295 1 1 4 TRP CD2 C 6.759 -3.837 -1.116 1.00 . A A . 4 TRP CD2 1 1 16 2296 1 1 4 TRP CE2 C 7.941 -4.403 -1.632 1.00 . A A . 4 TRP CE2 1 1 16 2297 1 1 4 TRP CE3 C 5.989 -3.017 -1.942 1.00 . A A . 4 TRP CE3 1 1 16 2298 1 1 4 TRP CG C 6.636 -4.281 0.239 1.00 . A A . 4 TRP CG 1 1 16 2299 1 1 4 TRP CH2 C 7.591 -3.366 -3.726 1.00 . A A . 4 TRP CH2 1 1 16 2300 1 1 4 TRP CZ2 C 8.367 -4.174 -2.939 1.00 . A A . 4 TRP CZ2 1 1 16 2301 1 1 4 TRP CZ3 C 6.411 -2.789 -3.238 1.00 . A A . 4 TRP CZ3 1 1 16 2302 1 1 4 TRP H H 6.313 -2.820 3.350 1.00 . A A . 4 TRP H 1 1 16 2303 1 1 4 TRP HA H 6.010 -1.905 0.722 1.00 . A A . 4 TRP HA 1 1 16 2304 1 1 4 TRP HB2 H 5.742 -4.432 2.150 1.00 . A A . 4 TRP HB2 1 1 16 2305 1 1 4 TRP HB3 H 4.594 -4.317 0.804 1.00 . A A . 4 TRP HB3 1 1 16 2306 1 1 4 TRP HD1 H 7.925 -5.574 1.421 1.00 . A A . 4 TRP HD1 1 1 16 2307 1 1 4 TRP HE1 H 9.365 -5.683 -0.719 1.00 . A A . 4 TRP HE1 1 1 16 2308 1 1 4 TRP HE3 H 5.078 -2.567 -1.574 1.00 . A A . 4 TRP HE3 1 1 16 2309 1 1 4 TRP HH2 H 7.894 -3.170 -4.744 1.00 . A A . 4 TRP HH2 1 1 16 2310 1 1 4 TRP HZ2 H 9.276 -4.617 -3.317 1.00 . A A . 4 TRP HZ2 1 1 16 2311 1 1 4 TRP HZ3 H 5.822 -2.156 -3.886 1.00 . A A . 4 TRP HZ3 1 1 16 2312 1 1 4 TRP N N 5.878 -2.102 2.788 1.00 . A A . 4 TRP N 1 1 16 2313 1 1 4 TRP NE1 N 8.507 -5.156 -0.639 1.00 . A A . 4 TRP NE1 1 1 16 2314 1 1 4 TRP O O 3.655 -1.063 0.542 1.00 . A A . 4 TRP O 1 1 16 2315 1 1 5 ALA C C 1.044 -2.078 3.232 1.00 . A A . 5 ALA C 1 1 16 2316 1 1 5 ALA CA C 1.617 -2.404 1.857 1.00 . A A . 5 ALA CA 1 1 16 2317 1 1 5 ALA CB C 0.861 -3.567 1.229 1.00 . A A . 5 ALA CB 1 1 16 2318 1 1 5 ALA H H 3.343 -3.481 2.524 1.00 . A A . 5 ALA H 1 1 16 2319 1 1 5 ALA HA H 1.494 -1.530 1.218 1.00 . A A . 5 ALA HA 1 1 16 2320 1 1 5 ALA HB1 H 0.638 -4.311 1.994 1.00 . A A . 5 ALA HB1 1 1 16 2321 1 1 5 ALA HB2 H -0.069 -3.203 0.794 1.00 . A A . 5 ALA HB2 1 1 16 2322 1 1 5 ALA HB3 H 1.474 -4.020 0.450 1.00 . A A . 5 ALA HB3 1 1 16 2323 1 1 5 ALA N N 3.039 -2.713 1.942 1.00 . A A . 5 ALA N 1 1 16 2324 1 1 5 ALA O O 0.580 -2.966 3.949 1.00 . A A . 5 ALA O 1 1 16 2325 1 1 6 VAL C C -0.860 -0.860 5.107 1.00 . A A . 6 VAL C 1 1 16 2326 1 1 6 VAL CA C 0.559 -0.356 4.884 1.00 . A A . 6 VAL CA 1 1 16 2327 1 1 6 VAL CB C 0.573 1.178 4.995 1.00 . A A . 6 VAL CB 1 1 16 2328 1 1 6 VAL CG1 C -0.203 1.804 3.844 1.00 . A A . 6 VAL CG1 1 1 16 2329 1 1 6 VAL CG2 C 0.004 1.621 6.334 1.00 . A A . 6 VAL CG2 1 1 16 2330 1 1 6 VAL H H 1.474 -0.120 2.961 1.00 . A A . 6 VAL H 1 1 16 2331 1 1 6 VAL HA H 1.195 -0.763 5.670 1.00 . A A . 6 VAL HA 1 1 16 2332 1 1 6 VAL HB H 1.608 1.517 4.933 1.00 . A A . 6 VAL HB 1 1 16 2333 1 1 6 VAL HG11 H 0.193 2.798 3.636 1.00 . A A . 6 VAL HG11 1 1 16 2334 1 1 6 VAL HG12 H -0.104 1.179 2.957 1.00 . A A . 6 VAL HG12 1 1 16 2335 1 1 6 VAL HG13 H -1.256 1.883 4.117 1.00 . A A . 6 VAL HG13 1 1 16 2336 1 1 6 VAL HG21 H 0.575 1.161 7.141 1.00 . A A . 6 VAL HG21 1 1 16 2337 1 1 6 VAL HG22 H -1.039 1.312 6.405 1.00 . A A . 6 VAL HG22 1 1 16 2338 1 1 6 VAL HG23 H 0.068 2.706 6.416 1.00 . A A . 6 VAL HG23 1 1 16 2339 1 1 6 VAL N N 1.078 -0.801 3.594 1.00 . A A . 6 VAL N 1 1 16 2340 1 1 6 VAL O O -1.234 -1.221 6.223 1.00 . A A . 6 VAL O 1 1 16 2341 1 1 7 GLY C C -3.853 -0.966 2.929 1.00 . A A . 7 GLY C 1 1 16 2342 1 1 7 GLY CA C -3.023 -1.346 4.139 1.00 . A A . 7 GLY CA 1 1 16 2343 1 1 7 GLY H H -1.292 -0.577 3.146 1.00 . A A . 7 GLY H 1 1 16 2344 1 1 7 GLY HA2 H -3.020 -2.432 4.234 1.00 . A A . 7 GLY HA2 1 1 16 2345 1 1 7 GLY HA3 H -3.478 -0.913 5.030 1.00 . A A . 7 GLY HA3 1 1 16 2346 1 1 7 GLY N N -1.651 -0.884 4.039 1.00 . A A . 7 GLY N 1 1 16 2347 1 1 7 GLY O O -4.839 -1.633 2.610 1.00 . A A . 7 GLY O 1 1 16 2348 1 1 8 HIS C C -3.665 -0.129 -0.184 1.00 . A A . 8 HIS C 1 1 16 2349 1 1 8 HIS CA C -4.171 0.575 1.072 1.00 . A A . 8 HIS CA 1 1 16 2350 1 1 8 HIS CB C -4.013 2.087 0.920 1.00 . A A . 8 HIS CB 1 1 16 2351 1 1 8 HIS CD2 C -1.438 1.844 0.702 1.00 . A A . 8 HIS CD2 1 1 16 2352 1 1 8 HIS CE1 C -0.910 3.945 1.020 1.00 . A A . 8 HIS CE1 1 1 16 2353 1 1 8 HIS CG C -2.584 2.553 0.900 1.00 . A A . 8 HIS CG 1 1 16 2354 1 1 8 HIS H H -2.639 0.612 2.567 1.00 . A A . 8 HIS H 1 1 16 2355 1 1 8 HIS HA H -5.230 0.348 1.194 1.00 . A A . 8 HIS HA 1 1 16 2356 1 1 8 HIS HB2 H -4.495 2.397 -0.007 1.00 . A A . 8 HIS HB2 1 1 16 2357 1 1 8 HIS HB3 H -4.520 2.570 1.755 1.00 . A A . 8 HIS HB3 1 1 16 2358 1 1 8 HIS HD2 H -1.364 0.782 0.519 1.00 . A A . 8 HIS HD2 1 1 16 2359 1 1 8 HIS HE1 H -0.335 4.852 1.134 1.00 . A A . 8 HIS HE1 1 1 16 2360 1 1 8 HIS HE2 H 0.595 2.523 0.676 1.00 . A A . 8 HIS HE2 1 1 16 2361 1 1 8 HIS N N -3.456 0.107 2.254 1.00 . A A . 8 HIS N 1 1 16 2362 1 1 8 HIS ND1 N -2.232 3.878 1.098 1.00 . A A . 8 HIS ND1 1 1 16 2363 1 1 8 HIS NE2 N -0.386 2.740 0.780 1.00 . A A . 8 HIS NE2 1 1 16 2364 1 1 8 HIS O O -3.279 0.519 -1.158 1.00 . A A . 8 HIS O 1 1 16 2365 1 1 9 LEU C C -4.382 -2.901 -2.009 1.00 . A A . 9 LEU C 1 1 16 2366 1 1 9 LEU CA C -3.206 -2.249 -1.289 1.00 . A A . 9 LEU CA 1 1 16 2367 1 1 9 LEU CB C -2.221 -3.322 -0.821 1.00 . A A . 9 LEU CB 1 1 16 2368 1 1 9 LEU CD1 C -0.181 -3.245 -2.276 1.00 . A A . 9 LEU CD1 1 1 16 2369 1 1 9 LEU CD2 C -1.069 -5.447 -1.487 1.00 . A A . 9 LEU CD2 1 1 16 2370 1 1 9 LEU CG C -1.433 -4.033 -1.920 1.00 . A A . 9 LEU CG 1 1 16 2371 1 1 9 LEU H H -3.996 -1.929 0.676 1.00 . A A . 9 LEU H 1 1 16 2372 1 1 9 LEU HA H -2.694 -1.588 -1.988 1.00 . A A . 9 LEU HA 1 1 16 2373 1 1 9 LEU HB2 H -1.504 -2.847 -0.151 1.00 . A A . 9 LEU HB2 1 1 16 2374 1 1 9 LEU HB3 H -2.774 -4.072 -0.256 1.00 . A A . 9 LEU HB3 1 1 16 2375 1 1 9 LEU HD11 H -0.461 -2.237 -2.584 1.00 . A A . 9 LEU HD11 1 1 16 2376 1 1 9 LEU HD12 H 0.473 -3.190 -1.406 1.00 . A A . 9 LEU HD12 1 1 16 2377 1 1 9 LEU HD13 H 0.341 -3.742 -3.093 1.00 . A A . 9 LEU HD13 1 1 16 2378 1 1 9 LEU HD21 H -1.977 -5.995 -1.236 1.00 . A A . 9 LEU HD21 1 1 16 2379 1 1 9 LEU HD22 H -0.419 -5.403 -0.613 1.00 . A A . 9 LEU HD22 1 1 16 2380 1 1 9 LEU HD23 H -0.551 -5.954 -2.300 1.00 . A A . 9 LEU HD23 1 1 16 2381 1 1 9 LEU HG H -2.062 -4.097 -2.808 1.00 . A A . 9 LEU HG 1 1 16 2382 1 1 9 LEU N N -3.667 -1.457 -0.153 1.00 . A A . 9 LEU N 1 1 16 2383 1 1 9 LEU O O -4.766 -4.027 -1.697 1.00 . A A . 9 LEU O 1 1 16 2384 1 1 10 MET C C -5.595 -3.514 -4.940 1.00 . A A . 10 MET C 1 1 16 2385 1 1 10 MET CA C -6.077 -2.698 -3.744 1.00 . A A . 10 MET CA 1 1 16 2386 1 1 10 MET CB C -6.960 -1.544 -4.222 1.00 . A A . 10 MET CB 1 1 16 2387 1 1 10 MET CE C -8.046 1.572 -2.391 1.00 . A A . 10 MET CE 1 1 16 2388 1 1 10 MET CG C -7.969 -1.082 -3.185 1.00 . A A . 10 MET CG 1 1 16 2389 1 1 10 MET H H -4.585 -1.267 -3.186 1.00 . A A . 10 MET H 1 1 16 2390 1 1 10 MET HA H -6.670 -3.345 -3.098 1.00 . A A . 10 MET HA 1 1 16 2391 1 1 10 MET HB2 H -6.322 -0.702 -4.491 1.00 . A A . 10 MET HB2 1 1 16 2392 1 1 10 MET HB3 H -7.503 -1.871 -5.109 1.00 . A A . 10 MET HB3 1 1 16 2393 1 1 10 MET HE1 H -7.701 2.360 -1.720 1.00 . A A . 10 MET HE1 1 1 16 2394 1 1 10 MET HE2 H -9.126 1.461 -2.295 1.00 . A A . 10 MET HE2 1 1 16 2395 1 1 10 MET HE3 H -7.797 1.836 -3.419 1.00 . A A . 10 MET HE3 1 1 16 2396 1 1 10 MET HG2 H -8.779 -0.560 -3.694 1.00 . A A . 10 MET HG2 1 1 16 2397 1 1 10 MET HG3 H -8.377 -1.954 -2.674 1.00 . A A . 10 MET HG3 1 1 16 2398 1 1 10 MET N N -4.947 -2.186 -2.977 1.00 . A A . 10 MET N 1 1 16 2399 1 1 10 MET O O -5.666 -3.061 -6.083 1.00 . A A . 10 MET O 1 1 16 2400 1 1 10 MET SD S -7.247 0.029 -1.960 1.00 . A A . 10 MET SD 1 1 17 2401 1 1 1 GLY C C 10.788 2.747 6.033 1.00 . A A . 1 GLY C 1 1 17 2402 1 1 1 GLY CA C 12.184 2.530 6.579 1.00 . A A . 1 GLY CA 1 1 17 2403 1 1 1 GLY H1 H 13.127 1.830 8.230 1.00 . A A . 1 GLY H1 1 1 17 2404 1 1 1 GLY H2 H 11.710 1.059 7.888 1.00 . A A . 1 GLY H2 1 1 17 2405 1 1 1 GLY H3 H 11.688 2.573 8.542 1.00 . A A . 1 GLY H3 1 1 17 2406 1 1 1 GLY HA2 H 12.698 3.491 6.616 1.00 . A A . 1 GLY HA2 1 1 17 2407 1 1 1 GLY HA3 H 12.728 1.865 5.908 1.00 . A A . 1 GLY HA3 1 1 17 2408 1 1 1 GLY N N 12.177 1.954 7.911 1.00 . A A . 1 GLY N 1 1 17 2409 1 1 1 GLY O O 10.090 3.672 6.445 1.00 . A A . 1 GLY O 1 1 17 2410 1 1 2 ASN C C 8.400 0.624 4.384 1.00 . A A . 2 ASN C 1 1 17 2411 1 1 2 ASN CA C 9.057 1.997 4.494 1.00 . A A . 2 ASN CA 1 1 17 2412 1 1 2 ASN CB C 9.157 2.640 3.111 1.00 . A A . 2 ASN CB 1 1 17 2413 1 1 2 ASN CG C 9.908 1.769 2.120 1.00 . A A . 2 ASN CG 1 1 17 2414 1 1 2 ASN H H 11.000 1.152 4.803 1.00 . A A . 2 ASN H 1 1 17 2415 1 1 2 ASN HA H 8.435 2.630 5.127 1.00 . A A . 2 ASN HA 1 1 17 2416 1 1 2 ASN HB2 H 8.150 2.811 2.731 1.00 . A A . 2 ASN HB2 1 1 17 2417 1 1 2 ASN HB3 H 9.670 3.597 3.201 1.00 . A A . 2 ASN HB3 1 1 17 2418 1 1 2 ASN HD21 H 8.160 1.054 1.374 1.00 . A A . 2 ASN HD21 1 1 17 2419 1 1 2 ASN HD22 H 9.611 0.422 0.630 1.00 . A A . 2 ASN HD22 1 1 17 2420 1 1 2 ASN N N 10.379 1.892 5.100 1.00 . A A . 2 ASN N 1 1 17 2421 1 1 2 ASN ND2 N 9.167 1.022 1.310 1.00 . A A . 2 ASN ND2 1 1 17 2422 1 1 2 ASN O O 9.009 -0.331 3.900 1.00 . A A . 2 ASN O 1 1 17 2423 1 1 2 ASN OD1 O 11.138 1.769 2.087 1.00 . A A . 2 ASN OD1 1 1 17 2424 1 1 3 HIS C C 5.955 -1.028 3.366 1.00 . A A . 3 HIS C 1 1 17 2425 1 1 3 HIS CA C 6.413 -0.723 4.789 1.00 . A A . 3 HIS CA 1 1 17 2426 1 1 3 HIS CB C 5.204 -0.663 5.724 1.00 . A A . 3 HIS CB 1 1 17 2427 1 1 3 HIS CD2 C 3.482 -2.600 5.909 1.00 . A A . 3 HIS CD2 1 1 17 2428 1 1 3 HIS CE1 C 4.730 -4.002 7.036 1.00 . A A . 3 HIS CE1 1 1 17 2429 1 1 3 HIS CG C 4.695 -2.019 6.131 1.00 . A A . 3 HIS CG 1 1 17 2430 1 1 3 HIS H H 6.709 1.353 5.223 1.00 . A A . 3 HIS H 1 1 17 2431 1 1 3 HIS HA H 7.069 -1.527 5.122 1.00 . A A . 3 HIS HA 1 1 17 2432 1 1 3 HIS HB2 H 5.490 -0.117 6.623 1.00 . A A . 3 HIS HB2 1 1 17 2433 1 1 3 HIS HB3 H 4.400 -0.121 5.225 1.00 . A A . 3 HIS HB3 1 1 17 2434 1 1 3 HIS HD2 H 2.648 -2.162 5.381 1.00 . A A . 3 HIS HD2 1 1 17 2435 1 1 3 HIS HE1 H 5.060 -4.884 7.564 1.00 . A A . 3 HIS HE1 1 1 17 2436 1 1 3 HIS HE2 H 2.775 -4.534 6.497 1.00 . A A . 3 HIS HE2 1 1 17 2437 1 1 3 HIS N N 7.154 0.532 4.837 1.00 . A A . 3 HIS N 1 1 17 2438 1 1 3 HIS ND1 N 5.469 -2.919 6.845 1.00 . A A . 3 HIS ND1 1 1 17 2439 1 1 3 HIS NE2 N 3.522 -3.855 6.489 1.00 . A A . 3 HIS NE2 1 1 17 2440 1 1 3 HIS O O 5.485 -0.143 2.651 1.00 . A A . 3 HIS O 1 1 17 2441 1 1 4 TRP C C 4.228 -2.380 1.365 1.00 . A A . 4 TRP C 1 1 17 2442 1 1 4 TRP CA C 5.695 -2.708 1.623 1.00 . A A . 4 TRP CA 1 1 17 2443 1 1 4 TRP CB C 5.934 -4.208 1.447 1.00 . A A . 4 TRP CB 1 1 17 2444 1 1 4 TRP CD1 C 8.244 -5.230 1.012 1.00 . A A . 4 TRP CD1 1 1 17 2445 1 1 4 TRP CD2 C 7.373 -4.140 -0.741 1.00 . A A . 4 TRP CD2 1 1 17 2446 1 1 4 TRP CE2 C 8.634 -4.649 -1.110 1.00 . A A . 4 TRP CE2 1 1 17 2447 1 1 4 TRP CE3 C 6.637 -3.419 -1.684 1.00 . A A . 4 TRP CE3 1 1 17 2448 1 1 4 TRP CG C 7.142 -4.522 0.619 1.00 . A A . 4 TRP CG 1 1 17 2449 1 1 4 TRP CH2 C 8.429 -3.747 -3.283 1.00 . A A . 4 TRP CH2 1 1 17 2450 1 1 4 TRP CZ2 C 9.173 -4.458 -2.380 1.00 . A A . 4 TRP CZ2 1 1 17 2451 1 1 4 TRP CZ3 C 7.173 -3.230 -2.944 1.00 . A A . 4 TRP CZ3 1 1 17 2452 1 1 4 TRP H H 6.484 -2.967 3.597 1.00 . A A . 4 TRP H 1 1 17 2453 1 1 4 TRP HA H 6.304 -2.172 0.895 1.00 . A A . 4 TRP HA 1 1 17 2454 1 1 4 TRP HB2 H 6.052 -4.663 2.430 1.00 . A A . 4 TRP HB2 1 1 17 2455 1 1 4 TRP HB3 H 5.060 -4.642 0.961 1.00 . A A . 4 TRP HB3 1 1 17 2456 1 1 4 TRP HD1 H 8.385 -5.662 1.992 1.00 . A A . 4 TRP HD1 1 1 17 2457 1 1 4 TRP HE1 H 10.039 -5.778 0.012 1.00 . A A . 4 TRP HE1 1 1 17 2458 1 1 4 TRP HE3 H 5.666 -3.016 -1.433 1.00 . A A . 4 TRP HE3 1 1 17 2459 1 1 4 TRP HH2 H 8.819 -3.582 -4.277 1.00 . A A . 4 TRP HH2 1 1 17 2460 1 1 4 TRP HZ2 H 10.141 -4.856 -2.643 1.00 . A A . 4 TRP HZ2 1 1 17 2461 1 1 4 TRP HZ3 H 6.612 -2.673 -3.681 1.00 . A A . 4 TRP HZ3 1 1 17 2462 1 1 4 TRP N N 6.094 -2.286 2.962 1.00 . A A . 4 TRP N 1 1 17 2463 1 1 4 TRP NE1 N 9.145 -5.309 -0.023 1.00 . A A . 4 TRP NE1 1 1 17 2464 1 1 4 TRP O O 3.907 -1.572 0.494 1.00 . A A . 4 TRP O 1 1 17 2465 1 1 5 ALA C C 1.320 -2.163 3.242 1.00 . A A . 5 ALA C 1 1 17 2466 1 1 5 ALA CA C 1.909 -2.785 1.980 1.00 . A A . 5 ALA CA 1 1 17 2467 1 1 5 ALA CB C 1.199 -4.090 1.652 1.00 . A A . 5 ALA CB 1 1 17 2468 1 1 5 ALA H H 3.668 -3.663 2.825 1.00 . A A . 5 ALA H 1 1 17 2469 1 1 5 ALA HA H 1.754 -2.093 1.152 1.00 . A A . 5 ALA HA 1 1 17 2470 1 1 5 ALA HB1 H 0.130 -3.905 1.545 1.00 . A A . 5 ALA HB1 1 1 17 2471 1 1 5 ALA HB2 H 1.593 -4.493 0.720 1.00 . A A . 5 ALA HB2 1 1 17 2472 1 1 5 ALA HB3 H 1.365 -4.806 2.457 1.00 . A A . 5 ALA HB3 1 1 17 2473 1 1 5 ALA N N 3.341 -3.011 2.127 1.00 . A A . 5 ALA N 1 1 17 2474 1 1 5 ALA O O 0.850 -2.869 4.134 1.00 . A A . 5 ALA O 1 1 17 2475 1 1 6 VAL C C -0.604 -0.566 4.782 1.00 . A A . 6 VAL C 1 1 17 2476 1 1 6 VAL CA C 0.817 -0.117 4.465 1.00 . A A . 6 VAL CA 1 1 17 2477 1 1 6 VAL CB C 0.825 1.404 4.228 1.00 . A A . 6 VAL CB 1 1 17 2478 1 1 6 VAL CG1 C 0.235 2.133 5.427 1.00 . A A . 6 VAL CG1 1 1 17 2479 1 1 6 VAL CG2 C 2.235 1.892 3.938 1.00 . A A . 6 VAL CG2 1 1 17 2480 1 1 6 VAL H H 1.751 -0.311 2.547 1.00 . A A . 6 VAL H 1 1 17 2481 1 1 6 VAL HA H 1.448 -0.335 5.327 1.00 . A A . 6 VAL HA 1 1 17 2482 1 1 6 VAL HB H 0.204 1.618 3.359 1.00 . A A . 6 VAL HB 1 1 17 2483 1 1 6 VAL HG11 H -0.774 1.767 5.615 1.00 . A A . 6 VAL HG11 1 1 17 2484 1 1 6 VAL HG12 H 0.201 3.202 5.221 1.00 . A A . 6 VAL HG12 1 1 17 2485 1 1 6 VAL HG13 H 0.857 1.951 6.304 1.00 . A A . 6 VAL HG13 1 1 17 2486 1 1 6 VAL HG21 H 2.636 1.356 3.077 1.00 . A A . 6 VAL HG21 1 1 17 2487 1 1 6 VAL HG22 H 2.869 1.709 4.806 1.00 . A A . 6 VAL HG22 1 1 17 2488 1 1 6 VAL HG23 H 2.213 2.960 3.723 1.00 . A A . 6 VAL HG23 1 1 17 2489 1 1 6 VAL N N 1.350 -0.835 3.311 1.00 . A A . 6 VAL N 1 1 17 2490 1 1 6 VAL O O -0.908 -0.943 5.912 1.00 . A A . 6 VAL O 1 1 17 2491 1 1 7 GLY C C -3.619 -1.013 2.662 1.00 . A A . 7 GLY C 1 1 17 2492 1 1 7 GLY CA C -2.853 -0.926 3.968 1.00 . A A . 7 GLY CA 1 1 17 2493 1 1 7 GLY H H -1.167 -0.204 2.867 1.00 . A A . 7 GLY H 1 1 17 2494 1 1 7 GLY HA2 H -2.872 -1.900 4.456 1.00 . A A . 7 GLY HA2 1 1 17 2495 1 1 7 GLY HA3 H -3.344 -0.197 4.613 1.00 . A A . 7 GLY HA3 1 1 17 2496 1 1 7 GLY N N -1.472 -0.522 3.776 1.00 . A A . 7 GLY N 1 1 17 2497 1 1 7 GLY O O -3.436 -1.953 1.889 1.00 . A A . 7 GLY O 1 1 17 2498 1 1 8 HIS C C -4.684 0.971 0.183 1.00 . A A . 8 HIS C 1 1 17 2499 1 1 8 HIS CA C -5.279 -0.001 1.196 1.00 . A A . 8 HIS CA 1 1 17 2500 1 1 8 HIS CB C -6.722 0.395 1.514 1.00 . A A . 8 HIS CB 1 1 17 2501 1 1 8 HIS CD2 C -8.498 0.981 -0.286 1.00 . A A . 8 HIS CD2 1 1 17 2502 1 1 8 HIS CE1 C -8.754 -1.029 -1.119 1.00 . A A . 8 HIS CE1 1 1 17 2503 1 1 8 HIS CG C -7.677 0.125 0.386 1.00 . A A . 8 HIS CG 1 1 17 2504 1 1 8 HIS H H -4.585 0.713 3.093 1.00 . A A . 8 HIS H 1 1 17 2505 1 1 8 HIS HA H -5.281 -1.000 0.759 1.00 . A A . 8 HIS HA 1 1 17 2506 1 1 8 HIS HB2 H -7.051 -0.168 2.388 1.00 . A A . 8 HIS HB2 1 1 17 2507 1 1 8 HIS HB3 H -6.751 1.459 1.751 1.00 . A A . 8 HIS HB3 1 1 17 2508 1 1 8 HIS HD2 H -8.601 2.042 -0.111 1.00 . A A . 8 HIS HD2 1 1 17 2509 1 1 8 HIS HE1 H -9.103 -1.850 -1.728 1.00 . A A . 8 HIS HE1 1 1 17 2510 1 1 8 HIS HE2 H -9.855 0.579 -1.896 1.00 . A A . 8 HIS HE2 1 1 17 2511 1 1 8 HIS N N -4.481 -0.031 2.417 1.00 . A A . 8 HIS N 1 1 17 2512 1 1 8 HIS ND1 N -7.853 -1.139 -0.154 1.00 . A A . 8 HIS ND1 1 1 17 2513 1 1 8 HIS NE2 N -9.173 0.233 -1.237 1.00 . A A . 8 HIS NE2 1 1 17 2514 1 1 8 HIS O O -5.094 2.130 0.106 1.00 . A A . 8 HIS O 1 1 17 2515 1 1 9 LEU C C -3.211 0.703 -2.988 1.00 . A A . 9 LEU C 1 1 17 2516 1 1 9 LEU CA C -3.066 1.321 -1.602 1.00 . A A . 9 LEU CA 1 1 17 2517 1 1 9 LEU CB C -1.586 1.502 -1.264 1.00 . A A . 9 LEU CB 1 1 17 2518 1 1 9 LEU CD1 C 0.684 0.472 -1.533 1.00 . A A . 9 LEU CD1 1 1 17 2519 1 1 9 LEU CD2 C -0.847 -0.336 0.273 1.00 . A A . 9 LEU CD2 1 1 17 2520 1 1 9 LEU CG C -0.763 0.218 -1.142 1.00 . A A . 9 LEU CG 1 1 17 2521 1 1 9 LEU H H -3.426 -0.467 -0.478 1.00 . A A . 9 LEU H 1 1 17 2522 1 1 9 LEU HA H -3.543 2.301 -1.607 1.00 . A A . 9 LEU HA 1 1 17 2523 1 1 9 LEU HB2 H -1.137 2.111 -2.048 1.00 . A A . 9 LEU HB2 1 1 17 2524 1 1 9 LEU HB3 H -1.513 2.046 -0.323 1.00 . A A . 9 LEU HB3 1 1 17 2525 1 1 9 LEU HD11 H 0.723 0.868 -2.548 1.00 . A A . 9 LEU HD11 1 1 17 2526 1 1 9 LEU HD12 H 1.125 1.194 -0.845 1.00 . A A . 9 LEU HD12 1 1 17 2527 1 1 9 LEU HD13 H 1.243 -0.462 -1.486 1.00 . A A . 9 LEU HD13 1 1 17 2528 1 1 9 LEU HD21 H -1.890 -0.511 0.534 1.00 . A A . 9 LEU HD21 1 1 17 2529 1 1 9 LEU HD22 H -0.296 -1.275 0.328 1.00 . A A . 9 LEU HD22 1 1 17 2530 1 1 9 LEU HD23 H -0.413 0.381 0.970 1.00 . A A . 9 LEU HD23 1 1 17 2531 1 1 9 LEU HG H -1.179 -0.522 -1.825 1.00 . A A . 9 LEU HG 1 1 17 2532 1 1 9 LEU N N -3.717 0.493 -0.591 1.00 . A A . 9 LEU N 1 1 17 2533 1 1 9 LEU O O -2.339 0.860 -3.842 1.00 . A A . 9 LEU O 1 1 17 2534 1 1 10 MET C C -5.770 0.013 -5.189 1.00 . A A . 10 MET C 1 1 17 2535 1 1 10 MET CA C -4.579 -0.636 -4.491 1.00 . A A . 10 MET CA 1 1 17 2536 1 1 10 MET CB C -4.839 -2.132 -4.298 1.00 . A A . 10 MET CB 1 1 17 2537 1 1 10 MET CE C -2.853 -4.926 -6.134 1.00 . A A . 10 MET CE 1 1 17 2538 1 1 10 MET CG C -3.574 -2.974 -4.303 1.00 . A A . 10 MET CG 1 1 17 2539 1 1 10 MET H H -4.998 -0.090 -2.463 1.00 . A A . 10 MET H 1 1 17 2540 1 1 10 MET HA H -3.699 -0.515 -5.122 1.00 . A A . 10 MET HA 1 1 17 2541 1 1 10 MET HB2 H -5.344 -2.274 -3.343 1.00 . A A . 10 MET HB2 1 1 17 2542 1 1 10 MET HB3 H -5.495 -2.479 -5.096 1.00 . A A . 10 MET HB3 1 1 17 2543 1 1 10 MET HE1 H -2.438 -5.189 -7.107 1.00 . A A . 10 MET HE1 1 1 17 2544 1 1 10 MET HE2 H -2.245 -5.370 -5.347 1.00 . A A . 10 MET HE2 1 1 17 2545 1 1 10 MET HE3 H -3.874 -5.302 -6.061 1.00 . A A . 10 MET HE3 1 1 17 2546 1 1 10 MET HG2 H -2.839 -2.503 -3.651 1.00 . A A . 10 MET HG2 1 1 17 2547 1 1 10 MET HG3 H -3.807 -3.965 -3.915 1.00 . A A . 10 MET HG3 1 1 17 2548 1 1 10 MET N N -4.319 0.002 -3.206 1.00 . A A . 10 MET N 1 1 17 2549 1 1 10 MET O O -6.141 -0.377 -6.297 1.00 . A A . 10 MET O 1 1 17 2550 1 1 10 MET SD S -2.859 -3.144 -5.950 1.00 . A A . 10 MET SD 1 1 18 2551 1 1 1 GLY C C 8.624 2.933 6.287 1.00 . A A . 1 GLY C 1 1 18 2552 1 1 1 GLY CA C 8.207 3.829 7.437 1.00 . A A . 1 GLY CA 1 1 18 2553 1 1 1 GLY H1 H 8.439 4.008 9.442 1.00 . A A . 1 GLY H1 1 1 18 2554 1 1 1 GLY H2 H 9.731 3.330 8.675 1.00 . A A . 1 GLY H2 1 1 18 2555 1 1 1 GLY H3 H 8.357 2.448 8.912 1.00 . A A . 1 GLY H3 1 1 18 2556 1 1 1 GLY HA2 H 7.119 3.861 7.485 1.00 . A A . 1 GLY HA2 1 1 18 2557 1 1 1 GLY HA3 H 8.583 4.835 7.250 1.00 . A A . 1 GLY HA3 1 1 18 2558 1 1 1 GLY N N 8.723 3.369 8.713 1.00 . A A . 1 GLY N 1 1 18 2559 1 1 1 GLY O O 9.274 1.910 6.493 1.00 . A A . 1 GLY O 1 1 18 2560 1 1 2 ASN C C 8.086 1.106 4.014 1.00 . A A . 2 ASN C 1 1 18 2561 1 1 2 ASN CA C 8.584 2.543 3.884 1.00 . A A . 2 ASN CA 1 1 18 2562 1 1 2 ASN CB C 10.096 2.552 3.656 1.00 . A A . 2 ASN CB 1 1 18 2563 1 1 2 ASN CG C 10.584 3.858 3.061 1.00 . A A . 2 ASN CG 1 1 18 2564 1 1 2 ASN H H 7.714 4.172 4.969 1.00 . A A . 2 ASN H 1 1 18 2565 1 1 2 ASN HA H 8.100 3.001 3.021 1.00 . A A . 2 ASN HA 1 1 18 2566 1 1 2 ASN HB2 H 10.595 2.395 4.612 1.00 . A A . 2 ASN HB2 1 1 18 2567 1 1 2 ASN HB3 H 10.358 1.736 2.982 1.00 . A A . 2 ASN HB3 1 1 18 2568 1 1 2 ASN HD21 H 12.030 2.883 2.019 1.00 . A A . 2 ASN HD21 1 1 18 2569 1 1 2 ASN HD22 H 11.983 4.618 1.798 1.00 . A A . 2 ASN HD22 1 1 18 2570 1 1 2 ASN N N 8.246 3.320 5.072 1.00 . A A . 2 ASN N 1 1 18 2571 1 1 2 ASN ND2 N 11.615 3.780 2.226 1.00 . A A . 2 ASN ND2 1 1 18 2572 1 1 2 ASN O O 8.799 0.159 3.684 1.00 . A A . 2 ASN O 1 1 18 2573 1 1 2 ASN OD1 O 10.041 4.926 3.347 1.00 . A A . 2 ASN OD1 1 1 18 2574 1 1 3 HIS C C 5.859 -0.962 3.326 1.00 . A A . 3 HIS C 1 1 18 2575 1 1 3 HIS CA C 6.263 -0.368 4.671 1.00 . A A . 3 HIS CA 1 1 18 2576 1 1 3 HIS CB C 5.047 -0.286 5.593 1.00 . A A . 3 HIS CB 1 1 18 2577 1 1 3 HIS CD2 C 5.260 -2.666 6.611 1.00 . A A . 3 HIS CD2 1 1 18 2578 1 1 3 HIS CE1 C 3.144 -3.217 6.532 1.00 . A A . 3 HIS CE1 1 1 18 2579 1 1 3 HIS CG C 4.562 -1.625 6.078 1.00 . A A . 3 HIS CG 1 1 18 2580 1 1 3 HIS H H 6.323 1.771 4.753 1.00 . A A . 3 HIS H 1 1 18 2581 1 1 3 HIS HA H 7.003 -1.023 5.130 1.00 . A A . 3 HIS HA 1 1 18 2582 1 1 3 HIS HB2 H 5.304 0.328 6.456 1.00 . A A . 3 HIS HB2 1 1 18 2583 1 1 3 HIS HB3 H 4.235 0.197 5.049 1.00 . A A . 3 HIS HB3 1 1 18 2584 1 1 3 HIS HD2 H 6.326 -2.702 6.782 1.00 . A A . 3 HIS HD2 1 1 18 2585 1 1 3 HIS HE1 H 2.226 -3.777 6.631 1.00 . A A . 3 HIS HE1 1 1 18 2586 1 1 3 HIS HE2 H 4.555 -4.569 7.298 1.00 . A A . 3 HIS HE2 1 1 18 2587 1 1 3 HIS N N 6.857 0.953 4.498 1.00 . A A . 3 HIS N 1 1 18 2588 1 1 3 HIS ND1 N 3.227 -1.992 6.036 1.00 . A A . 3 HIS ND1 1 1 18 2589 1 1 3 HIS NE2 N 4.349 -3.667 6.894 1.00 . A A . 3 HIS NE2 1 1 18 2590 1 1 3 HIS O O 5.258 -0.283 2.492 1.00 . A A . 3 HIS O 1 1 18 2591 1 1 4 TRP C C 4.379 -2.790 1.559 1.00 . A A . 4 TRP C 1 1 18 2592 1 1 4 TRP CA C 5.866 -2.915 1.874 1.00 . A A . 4 TRP CA 1 1 18 2593 1 1 4 TRP CB C 6.259 -4.391 1.960 1.00 . A A . 4 TRP CB 1 1 18 2594 1 1 4 TRP CD1 C 8.648 -5.241 1.588 1.00 . A A . 4 TRP CD1 1 1 18 2595 1 1 4 TRP CD2 C 7.598 -4.595 -0.283 1.00 . A A . 4 TRP CD2 1 1 18 2596 1 1 4 TRP CE2 C 8.891 -5.037 -0.623 1.00 . A A . 4 TRP CE2 1 1 18 2597 1 1 4 TRP CE3 C 6.752 -4.140 -1.298 1.00 . A A . 4 TRP CE3 1 1 18 2598 1 1 4 TRP CG C 7.463 -4.734 1.136 1.00 . A A . 4 TRP CG 1 1 18 2599 1 1 4 TRP CH2 C 8.507 -4.586 -2.909 1.00 . A A . 4 TRP CH2 1 1 18 2600 1 1 4 TRP CZ2 C 9.356 -5.037 -1.935 1.00 . A A . 4 TRP CZ2 1 1 18 2601 1 1 4 TRP CZ3 C 7.214 -4.140 -2.600 1.00 . A A . 4 TRP CZ3 1 1 18 2602 1 1 4 TRP H H 6.688 -2.732 3.844 1.00 . A A . 4 TRP H 1 1 18 2603 1 1 4 TRP HA H 6.432 -2.453 1.065 1.00 . A A . 4 TRP HA 1 1 18 2604 1 1 4 TRP HB2 H 6.473 -4.631 3.002 1.00 . A A . 4 TRP HB2 1 1 18 2605 1 1 4 TRP HB3 H 5.418 -4.998 1.625 1.00 . A A . 4 TRP HB3 1 1 18 2606 1 1 4 TRP HD1 H 8.872 -5.464 2.620 1.00 . A A . 4 TRP HD1 1 1 18 2607 1 1 4 TRP HE1 H 10.451 -5.788 0.605 1.00 . A A . 4 TRP HE1 1 1 18 2608 1 1 4 TRP HE3 H 5.754 -3.795 -1.069 1.00 . A A . 4 TRP HE3 1 1 18 2609 1 1 4 TRP HH2 H 8.839 -4.573 -3.936 1.00 . A A . 4 TRP HH2 1 1 18 2610 1 1 4 TRP HZ2 H 10.352 -5.380 -2.175 1.00 . A A . 4 TRP HZ2 1 1 18 2611 1 1 4 TRP HZ3 H 6.569 -3.791 -3.393 1.00 . A A . 4 TRP HZ3 1 1 18 2612 1 1 4 TRP N N 6.194 -2.229 3.120 1.00 . A A . 4 TRP N 1 1 18 2613 1 1 4 TRP NE1 N 9.511 -5.425 0.536 1.00 . A A . 4 TRP NE1 1 1 18 2614 1 1 4 TRP O O 4.001 -2.265 0.512 1.00 . A A . 4 TRP O 1 1 18 2615 1 1 5 ALA C C 1.449 -2.326 3.347 1.00 . A A . 5 ALA C 1 1 18 2616 1 1 5 ALA CA C 2.097 -3.212 2.290 1.00 . A A . 5 ALA CA 1 1 18 2617 1 1 5 ALA CB C 1.501 -4.612 2.334 1.00 . A A . 5 ALA CB 1 1 18 2618 1 1 5 ALA H H 3.916 -3.692 3.310 1.00 . A A . 5 ALA H 1 1 18 2619 1 1 5 ALA HA H 1.892 -2.782 1.309 1.00 . A A . 5 ALA HA 1 1 18 2620 1 1 5 ALA HB1 H 0.421 -4.552 2.197 1.00 . A A . 5 ALA HB1 1 1 18 2621 1 1 5 ALA HB2 H 1.935 -5.216 1.537 1.00 . A A . 5 ALA HB2 1 1 18 2622 1 1 5 ALA HB3 H 1.721 -5.070 3.298 1.00 . A A . 5 ALA HB3 1 1 18 2623 1 1 5 ALA N N 3.542 -3.273 2.471 1.00 . A A . 5 ALA N 1 1 18 2624 1 1 5 ALA O O 1.029 -2.804 4.400 1.00 . A A . 5 ALA O 1 1 18 2625 1 1 6 VAL C C -0.611 -0.534 4.429 1.00 . A A . 6 VAL C 1 1 18 2626 1 1 6 VAL CA C 0.772 -0.075 3.986 1.00 . A A . 6 VAL CA 1 1 18 2627 1 1 6 VAL CB C 0.661 1.324 3.354 1.00 . A A . 6 VAL CB 1 1 18 2628 1 1 6 VAL CG1 C 0.003 2.296 4.321 1.00 . A A . 6 VAL CG1 1 1 18 2629 1 1 6 VAL CG2 C 2.030 1.828 2.927 1.00 . A A . 6 VAL CG2 1 1 18 2630 1 1 6 VAL H H 1.737 -0.699 2.178 1.00 . A A . 6 VAL H 1 1 18 2631 1 1 6 VAL HA H 1.410 -0.004 4.868 1.00 . A A . 6 VAL HA 1 1 18 2632 1 1 6 VAL HB H 0.033 1.248 2.466 1.00 . A A . 6 VAL HB 1 1 18 2633 1 1 6 VAL HG11 H -0.976 1.914 4.612 1.00 . A A . 6 VAL HG11 1 1 18 2634 1 1 6 VAL HG12 H 0.628 2.406 5.207 1.00 . A A . 6 VAL HG12 1 1 18 2635 1 1 6 VAL HG13 H -0.116 3.266 3.838 1.00 . A A . 6 VAL HG13 1 1 18 2636 1 1 6 VAL HG21 H 2.481 1.116 2.235 1.00 . A A . 6 VAL HG21 1 1 18 2637 1 1 6 VAL HG22 H 1.924 2.795 2.434 1.00 . A A . 6 VAL HG22 1 1 18 2638 1 1 6 VAL HG23 H 2.668 1.936 3.804 1.00 . A A . 6 VAL HG23 1 1 18 2639 1 1 6 VAL N N 1.372 -1.030 3.059 1.00 . A A . 6 VAL N 1 1 18 2640 1 1 6 VAL O O -0.883 -0.659 5.622 1.00 . A A . 6 VAL O 1 1 18 2641 1 1 7 GLY C C -3.781 -1.065 2.599 1.00 . A A . 7 GLY C 1 1 18 2642 1 1 7 GLY CA C -2.832 -1.228 3.770 1.00 . A A . 7 GLY CA 1 1 18 2643 1 1 7 GLY H H -1.209 -0.663 2.496 1.00 . A A . 7 GLY H 1 1 18 2644 1 1 7 GLY HA2 H -2.798 -2.281 4.048 1.00 . A A . 7 GLY HA2 1 1 18 2645 1 1 7 GLY HA3 H -3.210 -0.651 4.614 1.00 . A A . 7 GLY HA3 1 1 18 2646 1 1 7 GLY N N -1.485 -0.784 3.461 1.00 . A A . 7 GLY N 1 1 18 2647 1 1 7 GLY O O -3.978 -1.995 1.816 1.00 . A A . 7 GLY O 1 1 18 2648 1 1 8 HIS C C -4.977 1.730 0.723 1.00 . A A . 8 HIS C 1 1 18 2649 1 1 8 HIS CA C -5.308 0.400 1.394 1.00 . A A . 8 HIS CA 1 1 18 2650 1 1 8 HIS CB C -6.742 0.426 1.922 1.00 . A A . 8 HIS CB 1 1 18 2651 1 1 8 HIS CD2 C -6.707 2.631 3.294 1.00 . A A . 8 HIS CD2 1 1 18 2652 1 1 8 HIS CE1 C -7.425 1.813 5.193 1.00 . A A . 8 HIS CE1 1 1 18 2653 1 1 8 HIS CG C -6.925 1.295 3.136 1.00 . A A . 8 HIS CG 1 1 18 2654 1 1 8 HIS H H -4.172 0.842 3.154 1.00 . A A . 8 HIS H 1 1 18 2655 1 1 8 HIS HA H -5.226 -0.393 0.651 1.00 . A A . 8 HIS HA 1 1 18 2656 1 1 8 HIS HB2 H -7.399 0.786 1.131 1.00 . A A . 8 HIS HB2 1 1 18 2657 1 1 8 HIS HB3 H -7.031 -0.592 2.181 1.00 . A A . 8 HIS HB3 1 1 18 2658 1 1 8 HIS HD2 H -6.350 3.317 2.539 1.00 . A A . 8 HIS HD2 1 1 18 2659 1 1 8 HIS HE1 H -7.741 1.738 6.223 1.00 . A A . 8 HIS HE1 1 1 18 2660 1 1 8 HIS HE2 H -6.975 3.856 5.031 1.00 . A A . 8 HIS HE2 1 1 18 2661 1 1 8 HIS N N -4.374 0.119 2.478 1.00 . A A . 8 HIS N 1 1 18 2662 1 1 8 HIS ND1 N -7.378 0.796 4.346 1.00 . A A . 8 HIS ND1 1 1 18 2663 1 1 8 HIS NE2 N -7.029 2.943 4.602 1.00 . A A . 8 HIS NE2 1 1 18 2664 1 1 8 HIS O O -5.869 2.526 0.426 1.00 . A A . 8 HIS O 1 1 18 2665 1 1 9 LEU C C -3.167 3.035 -1.663 1.00 . A A . 9 LEU C 1 1 18 2666 1 1 9 LEU CA C -3.244 3.199 -0.148 1.00 . A A . 9 LEU CA 1 1 18 2667 1 1 9 LEU CB C -1.876 3.612 0.401 1.00 . A A . 9 LEU CB 1 1 18 2668 1 1 9 LEU CD1 C -0.612 5.482 1.492 1.00 . A A . 9 LEU CD1 1 1 18 2669 1 1 9 LEU CD2 C -0.974 5.498 -0.982 1.00 . A A . 9 LEU CD2 1 1 18 2670 1 1 9 LEU CG C -1.563 5.108 0.367 1.00 . A A . 9 LEU CG 1 1 18 2671 1 1 9 LEU H H -3.006 1.272 0.755 1.00 . A A . 9 LEU H 1 1 18 2672 1 1 9 LEU HA H -3.961 3.987 0.080 1.00 . A A . 9 LEU HA 1 1 18 2673 1 1 9 LEU HB2 H -1.821 3.284 1.440 1.00 . A A . 9 LEU HB2 1 1 18 2674 1 1 9 LEU HB3 H -1.106 3.088 -0.165 1.00 . A A . 9 LEU HB3 1 1 18 2675 1 1 9 LEU HD11 H -1.049 5.195 2.449 1.00 . A A . 9 LEU HD11 1 1 18 2676 1 1 9 LEU HD12 H 0.335 4.960 1.355 1.00 . A A . 9 LEU HD12 1 1 18 2677 1 1 9 LEU HD13 H -0.439 6.558 1.479 1.00 . A A . 9 LEU HD13 1 1 18 2678 1 1 9 LEU HD21 H -1.669 5.223 -1.775 1.00 . A A . 9 LEU HD21 1 1 18 2679 1 1 9 LEU HD22 H -0.803 6.574 -1.005 1.00 . A A . 9 LEU HD22 1 1 18 2680 1 1 9 LEU HD23 H -0.028 4.977 -1.129 1.00 . A A . 9 LEU HD23 1 1 18 2681 1 1 9 LEU HG H -2.494 5.657 0.507 1.00 . A A . 9 LEU HG 1 1 18 2682 1 1 9 LEU N N -3.691 1.965 0.488 1.00 . A A . 9 LEU N 1 1 18 2683 1 1 9 LEU O O -3.757 3.814 -2.412 1.00 . A A . 9 LEU O 1 1 18 2684 1 1 10 MET C C -3.602 1.268 -4.136 1.00 . A A . 10 MET C 1 1 18 2685 1 1 10 MET CA C -2.287 1.749 -3.531 1.00 . A A . 10 MET CA 1 1 18 2686 1 1 10 MET CB C -1.192 0.705 -3.764 1.00 . A A . 10 MET CB 1 1 18 2687 1 1 10 MET CE C -0.974 0.829 -7.860 1.00 . A A . 10 MET CE 1 1 18 2688 1 1 10 MET CG C -0.525 0.816 -5.125 1.00 . A A . 10 MET CG 1 1 18 2689 1 1 10 MET H H -1.977 1.414 -1.439 1.00 . A A . 10 MET H 1 1 18 2690 1 1 10 MET HA H -1.994 2.674 -4.029 1.00 . A A . 10 MET HA 1 1 18 2691 1 1 10 MET HB2 H -0.429 0.829 -2.996 1.00 . A A . 10 MET HB2 1 1 18 2692 1 1 10 MET HB3 H -1.629 -0.288 -3.668 1.00 . A A . 10 MET HB3 1 1 18 2693 1 1 10 MET HE1 H -1.437 0.374 -8.735 1.00 . A A . 10 MET HE1 1 1 18 2694 1 1 10 MET HE2 H 0.108 0.844 -7.987 1.00 . A A . 10 MET HE2 1 1 18 2695 1 1 10 MET HE3 H -1.340 1.850 -7.745 1.00 . A A . 10 MET HE3 1 1 18 2696 1 1 10 MET HG2 H -0.503 1.866 -5.419 1.00 . A A . 10 MET HG2 1 1 18 2697 1 1 10 MET HG3 H 0.498 0.448 -5.049 1.00 . A A . 10 MET HG3 1 1 18 2698 1 1 10 MET N N -2.438 2.017 -2.106 1.00 . A A . 10 MET N 1 1 18 2699 1 1 10 MET O O -3.864 1.473 -5.322 1.00 . A A . 10 MET O 1 1 18 2700 1 1 10 MET SD S -1.390 -0.121 -6.400 1.00 . A A . 10 MET SD 1 1 stop_ save_
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